Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
630492 | 6cow RC | 30435 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLU 1 HT1 GLU 1 48.586 21.557 -12.489
2 H2 GLU 1 HT2 GLU 1 47.171 21.311 -13.394
3 H3 GLU 1 HT3 GLU 1 48.611 21.756 -14.177
4 HA GLU 1 HA GLU 1 49.354 19.717 -14.290
5 HB2 GLU 1 HB2 GLU 1 48.269 19.338 -11.412
6 HB3 GLU 1 HB1 GLU 1 49.135 18.035 -12.312
7 HG2 GLU 1 HG2 GLU 1 51.196 19.492 -12.469
8 HG3 GLU 1 HG1 GLU 1 50.341 20.806 -11.572
9 H MET 2 HN MET 2 48.031 19.155 -16.044
10 HA MET 2 HA MET 2 45.546 17.708 -15.353
11 HB2 MET 2 HB2 MET 2 46.175 19.418 -17.855
12 HB3 MET 2 HB1 MET 2 44.719 18.370 -17.690
13 HG2 MET 2 HG2 MET 2 43.968 19.717 -15.720
14 HG3 MET 2 HG1 MET 2 45.410 20.774 -15.889
15 HE1 MET 2 HE1 MET 2 42.403 23.056 -16.920
16 HE2 MET 2 HE2 MET 2 43.810 22.810 -15.828
17 HE3 MET 2 HE3 MET 2 42.388 21.714 -15.725
18 H ARG 3 HN ARG 3 48.686 17.121 -15.936
19 HA ARG 3 HA ARG 3 48.109 14.824 -17.694
20 HB2 ARG 3 HB2 ARG 3 50.627 16.624 -17.745
21 HB3 ARG 3 HB1 ARG 3 50.526 15.016 -18.554
22 HG2 ARG 3 HG2 ARG 3 48.652 15.859 -19.997
23 HG3 ARG 3 HG1 ARG 3 48.758 17.467 -19.197
24 HD2 ARG 3 HD2 ARG 3 51.126 17.741 -20.054
25 HD3 ARG 3 HD1 ARG 3 51.004 16.118 -20.873
26 HE ARG 3 HE ARG 3 48.763 17.728 -21.714
27 HH11 ARG 3 HH11 ARG 3 52.351 17.636 -22.086
28 HH12 ARG 3 HH12 ARG 3 52.340 18.419 -23.630
29 HH21 ARG 3 HH21 ARG 3 48.808 18.780 -23.801
30 HH22 ARG 3 HH22 ARG 3 50.310 19.075 -24.611
31 H LEU 4 HN LEU 4 49.549 12.988 -17.328
32 HA LEU 4 HA LEU 4 50.614 11.499 -16.163
33 HB2 LEU 4 HB2 LEU 4 51.593 13.658 -14.184
34 HB3 LEU 4 HB1 LEU 4 52.154 11.953 -14.204
35 HG LEU 4 HG LEU 4 52.534 13.944 -16.535
36 HD11 LEU 4 HD11 LEU 4 54.926 14.096 -15.839
37 HD12 LEU 4 HD12 LEU 4 54.593 13.043 -14.410
38 HD13 LEU 4 HD13 LEU 4 53.827 14.673 -14.529
39 HD21 LEU 4 HD21 LEU 4 54.412 12.124 -17.138
40 HD22 LEU 4 HD22 LEU 4 52.700 11.838 -17.602
41 HD23 LEU 4 HD23 LEU 4 53.385 11.012 -16.151
42 H SER 5 HN SER 5 47.825 12.831 -15.369
43 HA SER 5 HA SER 5 47.496 11.653 -12.736
44 HB2 SER 5 HB2 SER 5 45.131 12.502 -12.858
45 HB3 SER 5 HB1 SER 5 46.314 13.817 -13.201
46 HG SER 5 HG SER 5 45.523 12.402 -15.419
47 H LYS 6 HN LYS 6 47.364 10.686 -16.051
48 HA LYS 6 HA LYS 6 45.333 8.635 -15.724
49 HB2 LYS 6 HB2 LYS 6 47.278 9.266 -18.038
50 HB3 LYS 6 HB1 LYS 6 45.924 8.073 -18.109
51 HG2 LYS 6 HG2 LYS 6 44.267 9.915 -17.712
52 HG3 LYS 6 HG1 LYS 6 45.604 11.114 -17.623
53 HD2 LYS 6 HD2 LYS 6 46.247 10.553 -19.989
54 HD3 LYS 6 HD1 LYS 6 44.878 9.389 -20.069
55 HE2 LYS 6 HE2 LYS 6 43.238 11.273 -19.712
56 HE3 LYS 6 HE1 LYS 6 44.612 12.449 -19.596
57 HZ1 LYS 6 HZ1 LYS 6 43.303 11.473 -21.871
58 HZ2 LYS 6 HZ2 LYS 6 44.919 10.958 -21.942
59 HZ3 LYS 6 HZ3 LYS 6 44.561 12.608 -21.761
60 H PHE 7 HN PHE 7 48.767 9.100 -15.272
61 HA PHE 7 HA PHE 7 49.648 6.381 -15.580
62 HB2 PHE 7 HB2 PHE 7 50.803 9.016 -14.498
63 HB3 PHE 7 HB1 PHE 7 51.643 7.477 -14.075
64 HD1 PHE 7 HD1 PHE 7 50.374 9.400 -17.127
65 HD2 PHE 7 HD2 PHE 7 53.315 6.724 -15.530
66 HE1 PHE 7 HE1 PHE 7 51.627 9.501 -19.214
67 HE2 PHE 7 HE2 PHE 7 54.541 6.861 -17.633
68 HZ PHE 7 HZ PHE 7 53.706 8.242 -19.471
69 H PHE 8 HN PHE 8 48.310 8.519 -13.236
70 HA PHE 8 HA PHE 8 49.046 6.932 -10.956
71 HB2 PHE 8 HB2 PHE 8 48.473 9.710 -11.715
72 HB3 PHE 8 HB1 PHE 8 47.407 9.204 -10.349
73 HD1 PHE 8 HD1 PHE 8 50.916 8.255 -11.262
74 HD2 PHE 8 HD2 PHE 8 48.376 10.151 -8.378
75 HE1 PHE 8 HE1 PHE 8 52.849 8.784 -9.920
76 HE2 PHE 8 HE2 PHE 8 50.351 10.626 -6.989
77 HZ PHE 8 HZ PHE 8 52.591 9.951 -7.753
78 H ARG 9 HN ARG 9 46.544 7.231 -13.224
79 HA ARG 9 HA ARG 9 44.519 6.365 -11.384
80 HB2 ARG 9 HB2 ARG 9 44.028 7.889 -13.388
81 HB3 ARG 9 HB1 ARG 9 44.644 6.626 -14.487
82 HG2 ARG 9 HG2 ARG 9 42.263 6.607 -14.632
83 HG3 ARG 9 HG1 ARG 9 42.737 5.127 -13.744
84 HD2 ARG 9 HD2 ARG 9 42.119 6.230 -11.562
85 HD3 ARG 9 HD1 ARG 9 41.643 7.733 -12.466
86 HE ARG 9 HE ARG 9 40.181 5.618 -13.665
87 HH11 ARG 9 HH11 ARG 9 40.436 7.062 -10.366
88 HH12 ARG 9 HH12 ARG 9 38.816 6.649 -9.919
89 HH21 ARG 9 HH21 ARG 9 38.006 5.079 -13.003
90 HH22 ARG 9 HH22 ARG 9 37.426 5.512 -11.430
91 H ASP 10 HN ASP 10 46.988 5.071 -13.604
92 HA ASP 10 HA ASP 10 45.706 2.451 -13.465
93 HB2 ASP 10 HB2 ASP 10 48.392 3.300 -14.739
94 HB3 ASP 10 HB1 ASP 10 47.667 1.655 -14.882
95 H PHE 11 HN PHE 11 48.325 4.232 -11.853
96 HA PHE 11 HA PHE 11 49.375 1.844 -10.751
97 HB2 PHE 11 HB2 PHE 11 51.311 2.980 -10.776
98 HB3 PHE 11 HB1 PHE 11 50.407 4.453 -11.240
99 HD1 PHE 11 HD1 PHE 11 51.503 2.516 -8.120
100 HD2 PHE 11 HD2 PHE 11 50.189 6.123 -9.910
101 HE1 PHE 11 HE1 PHE 11 51.685 3.681 -5.981
102 HE2 PHE 11 HE2 PHE 11 50.389 7.248 -7.833
103 HZ PHE 11 HZ PHE 11 51.080 6.081 -5.836
104 H ILE 12 HN ILE 12 47.438 4.495 -9.378
105 HA ILE 12 HA ILE 12 47.634 3.485 -6.745
106 HB ILE 12 HB ILE 12 45.752 5.332 -8.201
107 HG12 ILE 12 HG12 ILE 12 47.969 5.781 -6.141
108 HG13 ILE 12 HG11 ILE 12 48.090 5.863 -7.929
109 HG21 ILE 12 HG21 ILE 12 44.976 6.071 -5.758
110 HG22 ILE 12 HG22 ILE 12 45.671 4.517 -5.173
111 HG23 ILE 12 HG23 ILE 12 44.302 4.511 -6.343
112 HD11 ILE 12 HD11 ILE 12 47.946 8.075 -6.940
113 HD12 ILE 12 HD12 ILE 12 46.329 7.686 -6.236
114 HD13 ILE 12 HD13 ILE 12 46.539 7.727 -8.037
115 H LEU 13 HN LEU 13 45.547 2.786 -9.504
116 HA LEU 13 HA LEU 13 43.439 1.676 -7.906
117 HB2 LEU 13 HB2 LEU 13 44.171 1.871 -10.806
118 HB3 LEU 13 HB1 LEU 13 42.759 0.865 -10.326
119 HG LEU 13 HG LEU 13 42.330 3.253 -11.066
120 HD11 LEU 13 HD11 LEU 13 40.592 1.913 -9.910
121 HD12 LEU 13 HD12 LEU 13 40.439 3.668 -9.528
122 HD13 LEU 13 HD13 LEU 13 41.162 2.543 -8.320
123 HD21 LEU 13 HD21 LEU 13 42.577 5.217 -9.651
124 HD22 LEU 13 HD22 LEU 13 44.202 4.447 -9.781
125 HD23 LEU 13 HD23 LEU 13 43.212 4.249 -8.277
126 H GLN 14 HN GLN 14 46.443 0.362 -8.985
127 HA GLN 14 HA GLN 14 45.531 -2.413 -8.911
128 HB2 GLN 14 HB2 GLN 14 48.323 -1.150 -9.223
129 HB3 GLN 14 HB1 GLN 14 48.064 -2.934 -9.135
130 HG2 GLN 14 HG2 GLN 14 46.621 -2.851 -11.185
131 HG3 GLN 14 HG1 GLN 14 46.838 -1.066 -11.289
132 HE21 GLN 14 HE21 GLN 14 49.097 -0.218 -11.749
133 HE22 GLN 14 HE22 GLN 14 50.258 -1.240 -12.527
134 H ARG 15 HN ARG 15 46.070 -0.126 -6.480
135 HA ARG 15 HA ARG 15 47.175 -2.132 -4.606
136 HB2 ARG 15 HB2 ARG 15 47.471 0.904 -4.818
137 HB3 ARG 15 HB1 ARG 15 47.452 0.193 -3.176
138 HG2 ARG 15 HG2 ARG 15 49.741 0.317 -3.667
139 HG3 ARG 15 HG1 ARG 15 49.349 -1.404 -3.996
140 HD2 ARG 15 HD2 ARG 15 49.373 -1.012 -6.446
141 HD3 ARG 15 HD1 ARG 15 49.524 0.785 -6.199
142 HE ARG 15 HE ARG 15 51.719 -0.407 -4.827
143 HH11 ARG 15 HH11 ARG 15 50.514 -0.235 -8.227
144 HH12 ARG 15 HH12 ARG 15 52.096 -0.284 -8.928
145 HH21 ARG 15 HH21 ARG 15 53.833 -0.467 -5.834
146 HH22 ARG 15 HH22 ARG 15 53.994 -0.417 -7.557
147 H LYS 16 HN LYS 16 44.350 -1.840 -5.665
148 HA LYS 16 HA LYS 16 42.977 -1.166 -3.137
149 HB2 LYS 16 HB2 LYS 16 41.902 -1.090 -6.013
150 HB3 LYS 16 HB1 LYS 16 40.927 -0.800 -4.520
151 HG2 LYS 16 HG2 LYS 16 42.778 1.070 -4.016
152 HG3 LYS 16 HG1 LYS 16 43.113 0.934 -5.775
153 HD2 LYS 16 HD2 LYS 16 40.690 1.406 -6.255
154 HD3 LYS 16 HD1 LYS 16 40.394 1.535 -4.483
155 HE2 LYS 16 HE2 LYS 16 41.987 3.514 -4.376
156 HE3 LYS 16 HE1 LYS 16 42.230 3.391 -6.169
157 HZ1 LYS 16 HZ1 LYS 16 40.358 4.460 -6.500
158 HZ2 LYS 16 HZ2 LYS 16 40.290 4.794 -4.838
159 HZ3 LYS 16 HZ3 LYS 16 39.465 3.451 -5.468
160 H LYS 17 HN LYS 17 44.356 -3.536 -3.341
161 HA LYS 17 HA LYS 17 42.760 -5.619 -4.433
162 HB2 LYS 17 HB2 LYS 17 44.427 -7.133 -3.258
163 HB3 LYS 17 HB1 LYS 17 45.182 -5.904 -4.325
164 HG2 LYS 17 HG2 LYS 17 45.656 -4.451 -2.290
165 HG3 LYS 17 HG1 LYS 17 44.964 -5.735 -1.241
166 HD2 LYS 17 HD2 LYS 17 46.727 -7.332 -2.052
167 HD3 LYS 17 HD1 LYS 17 47.405 -6.032 -3.098
168 HE2 LYS 17 HE2 LYS 17 47.941 -4.652 -1.059
169 HE3 LYS 17 HE1 LYS 17 47.241 -5.943 0.003
170 HZ1 LYS 17 HZ1 LYS 17 49.321 -6.699 -1.921
171 HZ2 LYS 17 HZ2 LYS 17 48.992 -7.287 -0.363
172 HZ3 LYS 17 HZ3 LYS 17 49.779 -5.795 -0.559
Start of MODEL 2
1 H1 GLU 1 HT1 GLU 1 50.845 21.843 -14.917
2 H2 GLU 1 HT2 GLU 1 50.029 21.699 -13.435
3 H3 GLU 1 HT3 GLU 1 49.397 22.694 -14.659
4 HA GLU 1 HA GLU 1 48.908 20.004 -14.167
5 HB2 GLU 1 HB2 GLU 1 48.051 21.958 -16.414
6 HB3 GLU 1 HB1 GLU 1 47.372 20.292 -16.279
7 HG2 GLU 1 HG2 GLU 1 46.471 20.825 -13.977
8 HG3 GLU 1 HG1 GLU 1 47.145 22.498 -14.098
9 H MET 2 HN MET 2 50.311 18.334 -14.655
10 HA MET 2 HA MET 2 51.694 18.417 -17.254
11 HB2 MET 2 HB2 MET 2 52.169 16.678 -14.746
12 HB3 MET 2 HB1 MET 2 53.081 16.495 -16.289
13 HG2 MET 2 HG2 MET 2 53.928 18.841 -16.064
14 HG3 MET 2 HG1 MET 2 53.033 19.022 -14.520
15 HE1 MET 2 HE1 MET 2 55.223 19.860 -13.440
16 HE2 MET 2 HE2 MET 2 56.111 19.609 -14.983
17 HE3 MET 2 HE3 MET 2 56.790 18.978 -13.443
18 H ARG 3 HN ARG 3 48.837 17.208 -15.816
19 HA ARG 3 HA ARG 3 47.324 15.716 -16.317
20 HB2 ARG 3 HB2 ARG 3 48.677 15.506 -19.083
21 HB3 ARG 3 HB1 ARG 3 47.090 14.760 -18.678
22 HG2 ARG 3 HG2 ARG 3 46.072 16.954 -18.267
23 HG3 ARG 3 HG1 ARG 3 47.646 17.792 -18.446
24 HD2 ARG 3 HD2 ARG 3 46.287 16.194 -20.742
25 HD3 ARG 3 HD1 ARG 3 46.097 17.984 -20.486
26 HE ARG 3 HE ARG 3 48.916 17.379 -20.530
27 HH11 ARG 3 HH11 ARG 3 46.094 17.399 -22.778
28 HH12 ARG 3 HH12 ARG 3 47.055 17.693 -24.188
29 HH21 ARG 3 HH21 ARG 3 50.163 17.775 -22.462
30 HH22 ARG 3 HH22 ARG 3 49.388 17.907 -24.005
31 H LEU 4 HN LEU 4 48.743 14.592 -14.553
32 HA LEU 4 HA LEU 4 49.517 11.939 -15.578
33 HB2 LEU 4 HB2 LEU 4 50.491 13.350 -13.010
34 HB3 LEU 4 HB1 LEU 4 50.978 11.700 -13.541
35 HG LEU 4 HG LEU 4 51.607 14.308 -15.072
36 HD11 LEU 4 HD11 LEU 4 52.810 14.221 -12.887
37 HD12 LEU 4 HD12 LEU 4 53.953 14.038 -14.269
38 HD13 LEU 4 HD13 LEU 4 53.472 12.592 -13.300
39 HD21 LEU 4 HD21 LEU 4 52.297 11.362 -15.657
40 HD22 LEU 4 HD22 LEU 4 53.397 12.685 -16.204
41 HD23 LEU 4 HD23 LEU 4 51.692 12.644 -16.776
42 H SER 5 HN SER 5 46.765 13.017 -14.913
43 HA SER 5 HA SER 5 46.131 11.754 -12.380
44 HB2 SER 5 HB2 SER 5 44.329 13.102 -14.502
45 HB3 SER 5 HB1 SER 5 43.738 12.460 -12.913
46 HG SER 5 HG SER 5 45.906 14.239 -12.988
47 H LYS 6 HN LYS 6 46.242 10.870 -15.792
48 HA LYS 6 HA LYS 6 44.337 8.662 -15.524
49 HB2 LYS 6 HB2 LYS 6 46.233 9.459 -17.836
50 HB3 LYS 6 HB1 LYS 6 44.946 8.195 -17.918
51 HG2 LYS 6 HG2 LYS 6 43.199 9.959 -17.479
52 HG3 LYS 6 HG1 LYS 6 44.484 11.216 -17.428
53 HD2 LYS 6 HD2 LYS 6 45.117 10.597 -19.810
54 HD3 LYS 6 HD1 LYS 6 43.741 9.445 -19.841
55 HE2 LYS 6 HE2 LYS 6 43.458 12.506 -19.375
56 HE3 LYS 6 HE1 LYS 6 43.226 11.676 -20.964
57 HZ1 LYS 6 HZ1 LYS 6 41.124 11.722 -20.225
58 HZ2 LYS 6 HZ2 LYS 6 41.536 11.695 -18.578
59 HZ3 LYS 6 HZ3 LYS 6 41.578 10.261 -19.487
60 H PHE 7 HN PHE 7 47.703 9.376 -15.017
61 HA PHE 7 HA PHE 7 48.814 6.765 -15.444
62 HB2 PHE 7 HB2 PHE 7 49.714 9.416 -14.175
63 HB3 PHE 7 HB1 PHE 7 50.694 7.932 -13.877
64 HD1 PHE 7 HD1 PHE 7 49.259 10.000 -16.749
65 HD2 PHE 7 HD2 PHE 7 52.400 7.422 -15.400
66 HE1 PHE 7 HE1 PHE 7 50.492 10.397 -18.811
67 HE2 PHE 7 HE2 PHE 7 53.604 7.847 -17.477
68 HZ PHE 7 HZ PHE 7 52.659 9.329 -19.181
69 H PHE 8 HN PHE 8 47.270 8.653 -12.987
70 HA PHE 8 HA PHE 8 48.163 7.021 -10.794
71 HB2 PHE 8 HB2 PHE 8 47.267 9.751 -11.404
72 HB3 PHE 8 HB1 PHE 8 46.302 9.055 -10.055
73 HD1 PHE 8 HD1 PHE 8 49.880 8.541 -11.038
74 HD2 PHE 8 HD2 PHE 8 47.186 10.062 -8.074
75 HE1 PHE 8 HE1 PHE 8 51.763 9.230 -9.689
76 HE2 PHE 8 HE2 PHE 8 49.113 10.696 -6.683
77 HZ PHE 8 HZ PHE 8 51.404 10.288 -7.484
78 H ARG 9 HN ARG 9 45.600 7.302 -12.984
79 HA ARG 9 HA ARG 9 43.655 6.137 -11.258
80 HB2 ARG 9 HB2 ARG 9 43.177 7.723 -13.173
81 HB3 ARG 9 HB1 ARG 9 43.867 6.532 -14.318
82 HG2 ARG 9 HG2 ARG 9 42.051 4.992 -13.936
83 HG3 ARG 9 HG1 ARG 9 41.439 5.939 -12.542
84 HD2 ARG 9 HD2 ARG 9 39.999 6.437 -14.456
85 HD3 ARG 9 HD1 ARG 9 41.049 7.892 -14.161
86 HE ARG 9 HE ARG 9 42.294 6.074 -16.089
87 HH11 ARG 9 HH11 ARG 9 39.703 8.574 -15.817
88 HH12 ARG 9 HH12 ARG 9 39.797 9.032 -17.484
89 HH21 ARG 9 HH21 ARG 9 42.382 6.742 -18.318
90 HH22 ARG 9 HH22 ARG 9 41.332 7.983 -18.915
91 H ASP 10 HN ASP 10 46.103 5.119 -13.687
92 HA ASP 10 HA ASP 10 45.102 2.388 -13.437
93 HB2 ASP 10 HB2 ASP 10 47.415 3.646 -15.016
94 HB3 ASP 10 HB1 ASP 10 47.218 1.857 -14.919
95 H PHE 11 HN PHE 11 47.456 4.365 -11.730
96 HA PHE 11 HA PHE 11 48.825 2.019 -10.862
97 HB2 PHE 11 HB2 PHE 11 50.656 3.330 -10.810
98 HB3 PHE 11 HB1 PHE 11 49.618 4.737 -11.188
99 HD1 PHE 11 HD1 PHE 11 50.807 2.714 -8.150
100 HD2 PHE 11 HD2 PHE 11 49.366 6.330 -9.787
101 HE1 PHE 11 HE1 PHE 11 50.901 3.792 -5.955
102 HE2 PHE 11 HE2 PHE 11 49.476 7.367 -7.660
103 HZ PHE 11 HZ PHE 11 50.182 6.145 -5.709
104 H ILE 12 HN ILE 12 46.721 4.408 -9.309
105 HA ILE 12 HA ILE 12 47.035 3.315 -6.734
106 HB ILE 12 HB ILE 12 44.964 5.008 -8.115
107 HG12 ILE 12 HG12 ILE 12 47.113 5.642 -6.033
108 HG13 ILE 12 HG11 ILE 12 47.256 5.763 -7.819
109 HG21 ILE 12 HG21 ILE 12 44.990 4.080 -5.121
110 HG22 ILE 12 HG22 ILE 12 43.614 3.989 -6.283
111 HG23 ILE 12 HG23 ILE 12 44.138 5.580 -5.643
112 HD11 ILE 12 HD11 ILE 12 45.521 7.454 -7.942
113 HD12 ILE 12 HD12 ILE 12 46.849 7.927 -6.782
114 HD13 ILE 12 HD13 ILE 12 45.261 7.357 -6.151
115 H LEU 13 HN LEU 13 44.926 2.596 -9.467
116 HA LEU 13 HA LEU 13 42.951 1.230 -7.926
117 HB2 LEU 13 HB2 LEU 13 43.649 1.601 -10.823
118 HB3 LEU 13 HB1 LEU 13 42.316 0.478 -10.376
119 HG LEU 13 HG LEU 13 41.688 2.833 -11.050
120 HD11 LEU 13 HD11 LEU 13 40.628 2.066 -8.275
121 HD12 LEU 13 HD12 LEU 13 40.108 1.316 -9.831
122 HD13 LEU 13 HD13 LEU 13 39.789 3.063 -9.520
123 HD21 LEU 13 HD21 LEU 13 42.491 3.881 -8.259
124 HD22 LEU 13 HD22 LEU 13 41.845 4.799 -9.664
125 HD23 LEU 13 HD23 LEU 13 43.513 4.116 -9.736
126 H GLN 14 HN GLN 14 45.969 0.173 -9.427
127 HA GLN 14 HA GLN 14 45.200 -2.650 -9.185
128 HB2 GLN 14 HB2 GLN 14 47.851 -1.384 -10.114
129 HB3 GLN 14 HB1 GLN 14 47.470 -3.151 -10.148
130 HG2 GLN 14 HG2 GLN 14 45.486 -2.616 -11.708
131 HG3 GLN 14 HG1 GLN 14 46.080 -0.912 -11.779
132 HE21 GLN 14 HE21 GLN 14 48.313 -0.523 -12.730
133 HE22 GLN 14 HE22 GLN 14 48.978 -1.673 -13.840
134 H ARG 15 HN ARG 15 46.279 -0.323 -6.961
135 HA ARG 15 HA ARG 15 47.887 -2.293 -5.468
136 HB2 ARG 15 HB2 ARG 15 47.927 0.761 -5.399
137 HB3 ARG 15 HB1 ARG 15 48.767 -0.282 -4.184
138 HG2 ARG 15 HG2 ARG 15 49.994 -1.418 -6.124
139 HG3 ARG 15 HG1 ARG 15 49.290 -0.169 -7.216
140 HD2 ARG 15 HD2 ARG 15 50.339 1.624 -5.758
141 HD3 ARG 15 HD1 ARG 15 51.130 0.303 -4.795
142 HE ARG 15 HE ARG 15 51.739 -0.119 -7.581
143 HH11 ARG 15 HH11 ARG 15 52.504 2.210 -4.934
144 HH12 ARG 15 HH12 ARG 15 54.024 2.684 -5.614
145 HH21 ARG 15 HH21 ARG 15 53.788 0.569 -8.460
146 HH22 ARG 15 HH22 ARG 15 54.758 1.743 -7.636
147 H LYS 16 HN LYS 16 44.915 -2.296 -5.582
148 HA LYS 16 HA LYS 16 44.064 -1.097 -3.076
149 HB2 LYS 16 HB2 LYS 16 42.573 -2.878 -5.121
150 HB3 LYS 16 HB1 LYS 16 41.817 -2.166 -3.654
151 HG2 LYS 16 HG2 LYS 16 43.074 -0.463 -5.907
152 HG3 LYS 16 HG1 LYS 16 41.366 -0.999 -5.908
153 HD2 LYS 16 HD2 LYS 16 41.109 0.192 -3.612
154 HD3 LYS 16 HD1 LYS 16 42.752 0.862 -3.863
155 HE2 LYS 16 HE2 LYS 16 41.183 2.582 -4.575
156 HE3 LYS 16 HE1 LYS 16 41.883 1.893 -6.090
157 HZ1 LYS 16 HZ1 LYS 16 39.859 1.409 -6.732
158 HZ2 LYS 16 HZ2 LYS 16 39.206 2.057 -5.305
159 HZ3 LYS 16 HZ3 LYS 16 39.604 0.408 -5.385
160 H LYS 17 HN LYS 17 45.247 -4.108 -4.512
161 HA LYS 17 HA LYS 17 44.663 -5.508 -2.024
162 HB2 LYS 17 HB2 LYS 17 45.192 -6.506 -4.882
163 HB3 LYS 17 HB1 LYS 17 45.081 -7.606 -3.456
164 HG2 LYS 17 HG2 LYS 17 42.750 -7.013 -3.062
165 HG3 LYS 17 HG1 LYS 17 42.803 -5.684 -4.272
166 HD2 LYS 17 HD2 LYS 17 43.178 -7.326 -6.095
167 HD3 LYS 17 HD1 LYS 17 43.175 -8.679 -4.914
168 HE2 LYS 17 HE2 LYS 17 40.963 -8.615 -5.994
169 HE3 LYS 17 HE1 LYS 17 40.745 -8.036 -4.294
170 HZ1 LYS 17 HZ1 LYS 17 40.152 -6.734 -6.714
171 HZ2 LYS 17 HZ2 LYS 17 41.332 -5.822 -5.901
172 HZ3 LYS 17 HZ3 LYS 17 39.876 -6.216 -5.120
Start of MODEL 3
1 H1 GLU 1 HT1 GLU 1 52.119 23.267 -17.816
2 H2 GLU 1 HT2 GLU 1 52.853 21.777 -18.172
3 H3 GLU 1 HT3 GLU 1 52.881 22.379 -16.584
4 HA GLU 1 HA GLU 1 50.877 21.657 -16.099
5 HB2 GLU 1 HB2 GLU 1 50.144 22.492 -18.984
6 HB3 GLU 1 HB1 GLU 1 48.971 21.585 -17.955
7 HG2 GLU 1 HG2 GLU 1 49.049 23.425 -16.216
8 HG3 GLU 1 HG1 GLU 1 50.212 24.347 -17.248
9 H MET 2 HN MET 2 50.876 19.499 -15.631
10 HA MET 2 HA MET 2 51.039 17.598 -17.884
11 HB2 MET 2 HB2 MET 2 52.441 17.362 -15.131
12 HB3 MET 2 HB1 MET 2 52.317 16.020 -16.327
13 HG2 MET 2 HG2 MET 2 53.632 17.369 -17.976
14 HG3 MET 2 HG1 MET 2 53.760 18.707 -16.786
15 HE1 MET 2 HE1 MET 2 57.406 17.351 -17.017
16 HE2 MET 2 HE2 MET 2 56.308 18.769 -17.134
17 HE3 MET 2 HE3 MET 2 56.171 17.427 -18.322
18 H ARG 3 HN ARG 3 49.909 15.550 -17.471
19 HA ARG 3 HA ARG 3 47.751 15.874 -15.472
20 HB2 ARG 3 HB2 ARG 3 47.855 14.181 -18.062
21 HB3 ARG 3 HB1 ARG 3 46.476 14.204 -16.900
22 HG2 ARG 3 HG2 ARG 3 46.105 16.636 -17.372
23 HG3 ARG 3 HG1 ARG 3 47.494 16.637 -18.516
24 HD2 ARG 3 HD2 ARG 3 46.277 14.924 -19.963
25 HD3 ARG 3 HD1 ARG 3 44.855 15.026 -18.828
26 HE ARG 3 HE ARG 3 45.530 17.703 -19.639
27 HH11 ARG 3 HH11 ARG 3 44.238 14.670 -21.112
28 HH12 ARG 3 HH12 ARG 3 43.345 15.496 -22.345
29 HH21 ARG 3 HH21 ARG 3 44.308 18.763 -21.332
30 HH22 ARG 3 HH22 ARG 3 43.388 17.838 -22.471
31 H LEU 4 HN LEU 4 47.834 14.512 -13.718
32 HA LEU 4 HA LEU 4 49.342 11.997 -14.017
33 HB2 LEU 4 HB2 LEU 4 49.282 13.939 -11.619
34 HB3 LEU 4 HB1 LEU 4 49.907 12.258 -11.494
35 HG LEU 4 HG LEU 4 51.079 14.381 -13.407
36 HD11 LEU 4 HD11 LEU 4 52.102 13.567 -10.601
37 HD12 LEU 4 HD12 LEU 4 51.339 15.143 -11.041
38 HD13 LEU 4 HD13 LEU 4 52.930 14.684 -11.755
39 HD21 LEU 4 HD21 LEU 4 52.041 11.557 -12.576
40 HD22 LEU 4 HD22 LEU 4 53.153 12.785 -13.290
41 HD23 LEU 4 HD23 LEU 4 51.740 12.197 -14.237
42 H SER 5 HN SER 5 46.305 13.045 -14.095
43 HA SER 5 HA SER 5 45.225 11.604 -11.825
44 HB2 SER 5 HB2 SER 5 43.828 13.009 -14.200
45 HB3 SER 5 HB1 SER 5 42.955 12.242 -12.810
46 HG SER 5 HG SER 5 44.993 14.059 -12.247
47 H LYS 6 HN LYS 6 46.038 10.922 -15.206
48 HA LYS 6 HA LYS 6 44.251 8.626 -15.359
49 HB2 LYS 6 HB2 LYS 6 46.427 9.661 -17.281
50 HB3 LYS 6 HB1 LYS 6 45.366 8.238 -17.609
51 HG2 LYS 6 HG2 LYS 6 43.338 9.740 -17.456
52 HG3 LYS 6 HG1 LYS 6 44.418 11.153 -17.193
53 HD2 LYS 6 HD2 LYS 6 45.485 10.754 -19.429
54 HD3 LYS 6 HD1 LYS 6 44.406 9.336 -19.687
55 HE2 LYS 6 HE2 LYS 6 42.387 10.858 -19.619
56 HE3 LYS 6 HE1 LYS 6 43.475 12.283 -19.357
57 HZ1 LYS 6 HZ1 LYS 6 42.661 11.228 -21.745
58 HZ2 LYS 6 HZ2 LYS 6 44.275 10.717 -21.608
59 HZ3 LYS 6 HZ3 LYS 6 43.894 12.368 -21.496
60 H PHE 7 HN PHE 7 47.372 9.421 -14.147
61 HA PHE 7 HA PHE 7 48.694 6.908 -14.601
62 HB2 PHE 7 HB2 PHE 7 49.282 9.528 -13.118
63 HB3 PHE 7 HB1 PHE 7 50.299 8.076 -12.763
64 HD1 PHE 7 HD1 PHE 7 49.171 10.330 -15.603
65 HD2 PHE 7 HD2 PHE 7 52.128 7.583 -14.179
66 HE1 PHE 7 HE1 PHE 7 50.612 10.878 -17.491
67 HE2 PHE 7 HE2 PHE 7 53.541 8.156 -16.083
68 HZ PHE 7 HZ PHE 7 52.792 9.797 -17.737
69 H PHE 8 HN PHE 8 46.760 8.555 -12.164
70 HA PHE 8 HA PHE 8 47.629 6.739 -10.093
71 HB2 PHE 8 HB2 PHE 8 46.692 9.494 -10.390
72 HB3 PHE 8 HB1 PHE 8 45.649 8.611 -9.218
73 HD1 PHE 8 HD1 PHE 8 49.306 8.323 -10.022
74 HD2 PHE 8 HD2 PHE 8 46.381 9.284 -7.037
75 HE1 PHE 8 HE1 PHE 8 51.076 8.857 -8.461
76 HE2 PHE 8 HE2 PHE 8 48.196 9.759 -5.445
77 HZ PHE 8 HZ PHE 8 50.545 9.553 -6.148
78 H ARG 9 HN ARG 9 45.043 7.078 -12.360
79 HA ARG 9 HA ARG 9 43.353 5.455 -10.620
80 HB2 ARG 9 HB2 ARG 9 41.641 5.504 -12.301
81 HB3 ARG 9 HB1 ARG 9 42.268 7.172 -12.101
82 HG2 ARG 9 HG2 ARG 9 43.725 6.730 -14.188
83 HG3 ARG 9 HG1 ARG 9 42.781 5.220 -14.425
84 HD2 ARG 9 HD2 ARG 9 40.654 6.565 -14.495
85 HD3 ARG 9 HD1 ARG 9 41.638 8.087 -14.316
86 HE ARG 9 HE ARG 9 42.660 6.513 -16.541
87 HH11 ARG 9 HH11 ARG 9 39.844 8.598 -15.673
88 HH12 ARG 9 HH12 ARG 9 39.541 9.084 -17.307
89 HH21 ARG 9 HH21 ARG 9 42.206 7.207 -18.719
90 HH22 ARG 9 HH22 ARG 9 40.893 8.287 -19.049
91 H ASP 10 HN ASP 10 45.866 5.071 -13.061
92 HA ASP 10 HA ASP 10 44.950 2.330 -13.449
93 HB2 ASP 10 HB2 ASP 10 47.440 3.842 -14.492
94 HB3 ASP 10 HB1 ASP 10 47.112 2.112 -14.873
95 H PHE 11 HN PHE 11 47.353 4.136 -11.517
96 HA PHE 11 HA PHE 11 48.670 1.737 -10.798
97 HB2 PHE 11 HB2 PHE 11 50.452 3.079 -10.492
98 HB3 PHE 11 HB1 PHE 11 49.389 4.492 -10.768
99 HD1 PHE 11 HD1 PHE 11 50.621 2.213 -7.953
100 HD2 PHE 11 HD2 PHE 11 48.870 5.875 -9.179
101 HE1 PHE 11 HE1 PHE 11 50.559 3.003 -5.640
102 HE2 PHE 11 HE2 PHE 11 48.838 6.628 -6.923
103 HZ PHE 11 HZ PHE 11 49.623 5.232 -5.122
104 H ILE 12 HN ILE 12 46.402 3.822 -9.018
105 HA ILE 12 HA ILE 12 46.704 2.394 -6.622
106 HB ILE 12 HB ILE 12 44.579 4.149 -7.828
107 HG12 ILE 12 HG12 ILE 12 46.574 4.554 -5.541
108 HG13 ILE 12 HG11 ILE 12 46.824 4.948 -7.272
109 HG21 ILE 12 HG21 ILE 12 44.533 2.781 -5.003
110 HG22 ILE 12 HG22 ILE 12 43.226 2.760 -6.244
111 HG23 ILE 12 HG23 ILE 12 43.591 4.276 -5.359
112 HD11 ILE 12 HD11 ILE 12 46.245 6.928 -5.989
113 HD12 ILE 12 HD12 ILE 12 44.671 6.193 -5.499
114 HD13 ILE 12 HD13 ILE 12 44.986 6.563 -7.245
115 H LEU 13 HN LEU 13 44.687 1.965 -9.502
116 HA LEU 13 HA LEU 13 42.875 0.155 -8.232
117 HB2 LEU 13 HB2 LEU 13 43.512 1.041 -11.039
118 HB3 LEU 13 HB1 LEU 13 42.287 -0.245 -10.762
119 HG LEU 13 HG LEU 13 41.426 2.111 -11.088
120 HD11 LEU 13 HD11 LEU 13 39.555 1.957 -9.525
121 HD12 LEU 13 HD12 LEU 13 40.509 0.898 -8.417
122 HD13 LEU 13 HD13 LEU 13 40.028 0.298 -10.051
123 HD21 LEU 13 HD21 LEU 13 42.128 2.872 -8.188
124 HD22 LEU 13 HD22 LEU 13 41.499 3.904 -9.525
125 HD23 LEU 13 HD23 LEU 13 43.203 3.316 -9.575
126 H GLN 14 HN GLN 14 45.809 -0.278 -10.290
127 HA GLN 14 HA GLN 14 45.520 -3.074 -10.624
128 HB2 GLN 14 HB2 GLN 14 47.948 -1.216 -10.802
129 HB3 GLN 14 HB1 GLN 14 48.119 -2.999 -11.032
130 HG2 GLN 14 HG2 GLN 14 46.548 -2.943 -12.978
131 HG3 GLN 14 HG1 GLN 14 46.255 -1.183 -12.719
132 HE21 GLN 14 HE21 GLN 14 49.088 -3.491 -13.171
133 HE22 GLN 14 HE22 GLN 14 50.013 -2.414 -14.161
134 H ARG 15 HN ARG 15 47.205 -1.152 -8.035
135 HA ARG 15 HA ARG 15 48.459 -3.419 -6.864
136 HB2 ARG 15 HB2 ARG 15 47.875 -0.637 -5.759
137 HB3 ARG 15 HB1 ARG 15 48.763 -1.904 -4.830
138 HG2 ARG 15 HG2 ARG 15 50.440 -2.027 -6.779
139 HG3 ARG 15 HG1 ARG 15 49.608 -0.600 -7.497
140 HD2 ARG 15 HD2 ARG 15 50.087 0.702 -5.362
141 HD3 ARG 15 HD1 ARG 15 51.007 -0.742 -4.750
142 HE ARG 15 HE ARG 15 52.040 -0.047 -7.353
143 HH11 ARG 15 HH11 ARG 15 51.972 1.278 -3.994
144 HH12 ARG 15 HH12 ARG 15 53.433 2.188 -4.185
145 HH21 ARG 15 HH21 ARG 15 53.999 1.216 -7.555
146 HH22 ARG 15 HH22 ARG 15 54.591 2.151 -6.224
147 H LYS 16 HN LYS 16 45.417 -1.704 -6.311
148 HA LYS 16 HA LYS 16 43.512 -2.157 -5.433
149 HB2 LYS 16 HB2 LYS 16 44.576 -4.918 -4.726
150 HB3 LYS 16 HB1 LYS 16 42.897 -4.365 -4.409
151 HG2 LYS 16 HG2 LYS 16 42.630 -3.923 -6.905
152 HG3 LYS 16 HG1 LYS 16 44.263 -4.642 -7.160
153 HD2 LYS 16 HD2 LYS 16 43.469 -6.778 -6.119
154 HD3 LYS 16 HD1 LYS 16 41.848 -6.039 -5.884
155 HE2 LYS 16 HE2 LYS 16 41.573 -5.815 -8.382
156 HE3 LYS 16 HE1 LYS 16 43.216 -6.542 -8.628
157 HZ1 LYS 16 HZ1 LYS 16 40.813 -7.827 -7.435
158 HZ2 LYS 16 HZ2 LYS 16 42.365 -8.512 -7.412
159 HZ3 LYS 16 HZ3 LYS 16 41.593 -8.208 -8.893
160 H LYS 17 HN LYS 17 46.063 -1.107 -4.206
161 HA LYS 17 HA LYS 17 45.255 -1.292 -1.422
162 HB2 LYS 17 HB2 LYS 17 47.991 -0.765 -2.730
163 HB3 LYS 17 HB1 LYS 17 47.688 -0.577 -0.962
164 HG2 LYS 17 HG2 LYS 17 47.188 -2.966 -0.715
165 HG3 LYS 17 HG1 LYS 17 47.238 -3.227 -2.493
166 HD2 LYS 17 HD2 LYS 17 49.643 -2.605 -2.531
167 HD3 LYS 17 HD1 LYS 17 49.624 -2.334 -0.750
168 HE2 LYS 17 HE2 LYS 17 49.058 -4.776 -0.384
169 HE3 LYS 17 HE1 LYS 17 49.068 -5.043 -2.177
170 HZ1 LYS 17 HZ1 LYS 17 51.383 -4.356 -2.190
171 HZ2 LYS 17 HZ2 LYS 17 51.130 -5.687 -1.167
172 HZ3 LYS 17 HZ3 LYS 17 51.363 -4.140 -0.507
Start of MODEL 4
1 H1 GLU 1 HT1 GLU 1 50.821 22.335 -20.925
2 H2 GLU 1 HT2 GLU 1 51.359 22.615 -19.339
3 H3 GLU 1 HT3 GLU 1 50.152 23.602 -20.012
4 HA GLU 1 HA GLU 1 49.045 22.178 -18.583
5 HB2 GLU 1 HB2 GLU 1 48.886 21.224 -21.520
6 HB3 GLU 1 HB1 GLU 1 47.807 20.522 -20.257
7 HG2 GLU 1 HG2 GLU 1 46.873 22.818 -19.753
8 HG3 GLU 1 HG1 GLU 1 47.943 23.532 -21.023
9 H MET 2 HN MET 2 49.462 20.615 -17.077
10 HA MET 2 HA MET 2 50.870 18.178 -17.975
11 HB2 MET 2 HB2 MET 2 51.278 19.729 -15.326
12 HB3 MET 2 HB1 MET 2 51.933 18.083 -15.647
13 HG2 MET 2 HG2 MET 2 53.301 18.993 -17.533
14 HG3 MET 2 HG1 MET 2 52.650 20.636 -17.221
15 HE1 MET 2 HE1 MET 2 55.693 19.898 -17.462
16 HE2 MET 2 HE2 MET 2 56.391 20.908 -16.150
17 HE3 MET 2 HE3 MET 2 55.057 21.554 -17.167
18 H ARG 3 HN ARG 3 50.123 16.227 -17.013
19 HA ARG 3 HA ARG 3 47.966 16.407 -15.063
20 HB2 ARG 3 HB2 ARG 3 46.844 16.436 -17.397
21 HB3 ARG 3 HB1 ARG 3 47.637 14.864 -17.740
22 HG2 ARG 3 HG2 ARG 3 46.369 13.762 -15.922
23 HG3 ARG 3 HG1 ARG 3 45.679 15.335 -15.389
24 HD2 ARG 3 HD2 ARG 3 44.407 15.542 -17.539
25 HD3 ARG 3 HD1 ARG 3 45.147 13.988 -18.140
26 HE ARG 3 HE ARG 3 43.988 13.362 -15.626
27 HH11 ARG 3 HH11 ARG 3 42.773 14.634 -18.778
28 HH12 ARG 3 HH12 ARG 3 41.220 13.884 -18.625
29 HH21 ARG 3 HH21 ARG 3 41.889 12.368 -15.479
30 HH22 ARG 3 HH22 ARG 3 40.715 12.585 -16.733
31 H LEU 4 HN LEU 4 48.084 14.680 -13.623
32 HA LEU 4 HA LEU 4 49.761 12.403 -14.371
33 HB2 LEU 4 HB2 LEU 4 50.836 14.431 -12.785
34 HB3 LEU 4 HB1 LEU 4 50.044 13.439 -11.523
35 HG LEU 4 HG LEU 4 51.333 11.403 -12.684
36 HD11 LEU 4 HD11 LEU 4 53.080 13.764 -13.642
37 HD12 LEU 4 HD12 LEU 4 52.214 12.569 -14.679
38 HD13 LEU 4 HD13 LEU 4 53.582 12.032 -13.639
39 HD21 LEU 4 HD21 LEU 4 51.730 12.183 -10.347
40 HD22 LEU 4 HD22 LEU 4 52.859 13.455 -10.950
41 HD23 LEU 4 HD23 LEU 4 53.273 11.710 -11.152
42 H SER 5 HN SER 5 46.752 13.139 -14.044
43 HA SER 5 HA SER 5 46.017 11.642 -11.668
44 HB2 SER 5 HB2 SER 5 44.297 12.973 -13.860
45 HB3 SER 5 HB1 SER 5 43.618 12.128 -12.409
46 HG SER 5 HG SER 5 45.578 14.102 -12.071
47 H LYS 6 HN LYS 6 46.626 10.901 -15.066
48 HA LYS 6 HA LYS 6 44.852 8.565 -15.088
49 HB2 LYS 6 HB2 LYS 6 46.972 9.556 -17.106
50 HB3 LYS 6 HB1 LYS 6 45.882 8.141 -17.363
51 HG2 LYS 6 HG2 LYS 6 43.881 9.664 -17.207
52 HG3 LYS 6 HG1 LYS 6 44.977 11.075 -16.988
53 HD2 LYS 6 HD2 LYS 6 46.015 10.609 -19.230
54 HD3 LYS 6 HD1 LYS 6 44.904 9.210 -19.445
55 HE2 LYS 6 HE2 LYS 6 42.918 10.775 -19.387
56 HE3 LYS 6 HE1 LYS 6 44.042 12.179 -19.164
57 HZ1 LYS 6 HZ1 LYS 6 44.967 10.772 -21.353
58 HZ2 LYS 6 HZ2 LYS 6 44.163 12.268 -21.332
59 HZ3 LYS 6 HZ3 LYS 6 43.280 10.832 -21.531
60 H PHE 7 HN PHE 7 48.085 9.458 -14.133
61 HA PHE 7 HA PHE 7 49.393 6.927 -14.437
62 HB2 PHE 7 HB2 PHE 7 49.940 9.547 -12.917
63 HB3 PHE 7 HB1 PHE 7 50.972 8.101 -12.606
64 HD1 PHE 7 HD1 PHE 7 49.802 10.379 -15.416
65 HD2 PHE 7 HD2 PHE 7 52.846 7.736 -13.983
66 HE1 PHE 7 HE1 PHE 7 51.250 11.024 -17.265
67 HE2 PHE 7 HE2 PHE 7 54.266 8.402 -15.850
68 HZ PHE 7 HZ PHE 7 53.477 10.041 -17.488
69 H PHE 8 HN PHE 8 47.420 8.660 -12.183
70 HA PHE 8 HA PHE 8 48.065 6.977 -9.945
71 HB2 PHE 8 HB2 PHE 8 47.191 9.710 -10.554
72 HB3 PHE 8 HB1 PHE 8 46.043 8.930 -9.404
73 HD1 PHE 8 HD1 PHE 8 49.744 8.548 -9.864
74 HD2 PHE 8 HD2 PHE 8 46.594 9.814 -7.247
75 HE1 PHE 8 HE1 PHE 8 51.382 9.188 -8.212
76 HE2 PHE 8 HE2 PHE 8 48.275 10.398 -5.550
77 HZ PHE 8 HZ PHE 8 50.669 10.092 -6.023
78 H ARG 9 HN ARG 9 45.857 7.192 -12.502
79 HA ARG 9 HA ARG 9 43.780 5.831 -11.058
80 HB2 ARG 9 HB2 ARG 9 43.346 7.528 -12.897
81 HB3 ARG 9 HB1 ARG 9 44.220 6.475 -14.056
82 HG2 ARG 9 HG2 ARG 9 42.533 4.767 -13.899
83 HG3 ARG 9 HG1 ARG 9 41.717 5.588 -12.522
84 HD2 ARG 9 HD2 ARG 9 41.118 7.507 -14.005
85 HD3 ARG 9 HD1 ARG 9 41.966 6.693 -15.399
86 HE ARG 9 HE ARG 9 40.101 4.793 -14.383
87 HH11 ARG 9 HH11 ARG 9 39.954 8.069 -15.885
88 HH12 ARG 9 HH12 ARG 9 38.381 7.827 -16.565
89 HH21 ARG 9 HH21 ARG 9 37.987 4.519 -15.315
90 HH22 ARG 9 HH22 ARG 9 37.253 5.788 -16.236
91 H ASP 10 HN ASP 10 46.664 5.168 -13.069
92 HA ASP 10 HA ASP 10 45.789 2.395 -13.320
93 HB2 ASP 10 HB2 ASP 10 48.433 3.756 -14.161
94 HB3 ASP 10 HB1 ASP 10 48.018 2.038 -14.520
95 H PHE 11 HN PHE 11 47.818 4.323 -11.149
96 HA PHE 11 HA PHE 11 49.058 1.968 -10.159
97 HB2 PHE 11 HB2 PHE 11 50.825 3.309 -9.762
98 HB3 PHE 11 HB1 PHE 11 49.827 4.709 -10.260
99 HD1 PHE 11 HD1 PHE 11 50.700 2.645 -7.163
100 HD2 PHE 11 HD2 PHE 11 49.157 6.200 -8.849
101 HE1 PHE 11 HE1 PHE 11 50.387 3.608 -4.935
102 HE2 PHE 11 HE2 PHE 11 48.874 7.132 -6.687
103 HZ PHE 11 HZ PHE 11 49.416 5.877 -4.705
104 H ILE 12 HN ILE 12 46.636 4.210 -8.853
105 HA ILE 12 HA ILE 12 46.619 2.996 -6.318
106 HB ILE 12 HB ILE 12 44.686 4.656 -7.915
107 HG12 ILE 12 HG12 ILE 12 46.431 5.236 -5.467
108 HG13 ILE 12 HG11 ILE 12 46.846 5.501 -7.192
109 HG21 ILE 12 HG21 ILE 12 44.273 3.533 -5.016
110 HG22 ILE 12 HG22 ILE 12 43.124 3.433 -6.403
111 HG23 ILE 12 HG23 ILE 12 43.419 5.009 -5.602
112 HD11 ILE 12 HD11 ILE 12 46.168 7.569 -6.129
113 HD12 ILE 12 HD12 ILE 12 44.551 6.878 -5.725
114 HD13 ILE 12 HD13 ILE 12 45.020 7.109 -7.460
115 H LEU 13 HN LEU 13 44.964 2.340 -9.368
116 HA LEU 13 HA LEU 13 42.876 0.789 -8.230
117 HB2 LEU 13 HB2 LEU 13 44.030 1.294 -10.957
118 HB3 LEU 13 HB1 LEU 13 42.719 0.075 -10.772
119 HG LEU 13 HG LEU 13 42.079 2.444 -11.476
120 HD11 LEU 13 HD11 LEU 13 39.917 2.484 -10.269
121 HD12 LEU 13 HD12 LEU 13 40.578 1.340 -9.046
122 HD13 LEU 13 HD13 LEU 13 40.382 0.812 -10.756
123 HD21 LEU 13 HD21 LEU 13 41.823 4.319 -9.978
124 HD22 LEU 13 HD22 LEU 13 43.519 3.749 -9.758
125 HD23 LEU 13 HD23 LEU 13 42.257 3.347 -8.524
126 H GLN 14 HN GLN 14 46.101 -0.099 -9.516
127 HA GLN 14 HA GLN 14 45.494 -2.937 -9.413
128 HB2 GLN 14 HB2 GLN 14 48.181 -1.484 -9.821
129 HB3 GLN 14 HB1 GLN 14 47.930 -3.266 -9.988
130 HG2 GLN 14 HG2 GLN 14 46.242 -2.807 -11.856
131 HG3 GLN 14 HG1 GLN 14 46.640 -1.051 -11.735
132 HE21 GLN 14 HE21 GLN 14 48.900 -0.345 -12.313
133 HE22 GLN 14 HE22 GLN 14 49.893 -1.348 -13.314
134 H ARG 15 HN ARG 15 46.260 -0.642 -6.938
135 HA ARG 15 HA ARG 15 47.646 -2.691 -5.333
136 HB2 ARG 15 HB2 ARG 15 47.589 0.353 -5.081
137 HB3 ARG 15 HB1 ARG 15 48.286 -0.746 -3.826
138 HG2 ARG 15 HG2 ARG 15 49.817 -1.720 -5.624
139 HG3 ARG 15 HG1 ARG 15 49.214 -0.453 -6.752
140 HD2 ARG 15 HD2 ARG 15 49.989 1.319 -5.118
141 HD3 ARG 15 HD1 ARG 15 50.675 -0.004 -4.079
142 HE ARG 15 HE ARG 15 51.714 -0.346 -6.737
143 HH11 ARG 15 HH11 ARG 15 51.941 2.025 -4.028
144 HH12 ARG 15 HH12 ARG 15 53.533 2.557 -4.453
145 HH21 ARG 15 HH21 ARG 15 53.858 0.420 -7.274
146 HH22 ARG 15 HH22 ARG 15 54.628 1.636 -6.313
147 H LYS 16 HN LYS 16 44.646 -2.580 -5.891
148 HA LYS 16 HA LYS 16 43.602 -1.808 -3.265
149 HB2 LYS 16 HB2 LYS 16 42.208 -2.665 -5.857
150 HB3 LYS 16 HB1 LYS 16 41.352 -2.379 -4.290
151 HG2 LYS 16 HG2 LYS 16 42.378 -0.001 -4.302
152 HG3 LYS 16 HG1 LYS 16 42.923 -0.345 -5.982
153 HD2 LYS 16 HD2 LYS 16 40.585 -0.744 -6.691
154 HD3 LYS 16 HD1 LYS 16 40.026 -0.494 -5.000
155 HE2 LYS 16 HE2 LYS 16 40.807 1.906 -5.087
156 HE3 LYS 16 HE1 LYS 16 41.382 1.657 -6.784
157 HZ1 LYS 16 HZ1 LYS 16 39.079 2.658 -6.329
158 HZ2 LYS 16 HZ2 LYS 16 38.586 1.056 -6.055
159 HZ3 LYS 16 HZ3 LYS 16 39.254 1.495 -7.553
160 H LYS 17 HN LYS 17 44.879 -4.460 -5.105
161 HA LYS 17 HA LYS 17 43.556 -6.384 -3.358
162 HB2 LYS 17 HB2 LYS 17 44.841 -6.628 -6.139
163 HB3 LYS 17 HB1 LYS 17 44.322 -8.058 -5.168
164 HG2 LYS 17 HG2 LYS 17 41.983 -7.376 -5.236
165 HG3 LYS 17 HG1 LYS 17 42.389 -5.775 -5.947
166 HD2 LYS 17 HD2 LYS 17 43.187 -6.846 -8.020
167 HD3 LYS 17 HD1 LYS 17 42.907 -8.481 -7.333
168 HE2 LYS 17 HE2 LYS 17 41.036 -7.953 -8.852
169 HE3 LYS 17 HE1 LYS 17 40.394 -7.911 -7.162
170 HZ1 LYS 17 HZ1 LYS 17 41.393 -5.411 -8.337
171 HZ2 LYS 17 HZ2 LYS 17 40.116 -5.687 -7.253
172 HZ3 LYS 17 HZ3 LYS 17 39.917 -6.031 -8.905
Start of MODEL 5
1 H1 GLU 1 HT1 GLU 1 46.372 22.247 -15.689
2 H2 GLU 1 HT2 GLU 1 45.521 21.226 -14.631
3 H3 GLU 1 HT3 GLU 1 44.715 21.960 -15.933
4 HA GLU 1 HA GLU 1 45.119 19.671 -16.404
5 HB2 GLU 1 HB2 GLU 1 46.820 21.696 -18.009
6 HB3 GLU 1 HB1 GLU 1 46.647 19.980 -18.540
7 HG2 GLU 1 HG2 GLU 1 44.132 20.266 -18.685
8 HG3 GLU 1 HG1 GLU 1 44.302 21.991 -18.173
9 H MET 2 HN MET 2 46.269 17.833 -15.916
10 HA MET 2 HA MET 2 49.153 18.119 -15.355
11 HB2 MET 2 HB2 MET 2 47.099 16.441 -13.753
12 HB3 MET 2 HB1 MET 2 48.885 16.304 -13.567
13 HG2 MET 2 HG2 MET 2 48.995 18.690 -12.822
14 HG3 MET 2 HG1 MET 2 47.217 18.838 -13.011
15 HE1 MET 2 HE1 MET 2 47.725 19.034 -9.158
16 HE2 MET 2 HE2 MET 2 47.030 19.786 -10.635
17 HE3 MET 2 HE3 MET 2 48.814 19.645 -10.452
18 H ARG 3 HN ARG 3 50.419 16.228 -15.916
19 HA ARG 3 HA ARG 3 49.048 14.500 -17.888
20 HB2 ARG 3 HB2 ARG 3 52.014 15.326 -17.622
21 HB3 ARG 3 HB1 ARG 3 51.394 14.140 -18.832
22 HG2 ARG 3 HG2 ARG 3 50.028 15.878 -19.924
23 HG3 ARG 3 HG1 ARG 3 50.474 17.087 -18.666
24 HD2 ARG 3 HD2 ARG 3 52.902 16.928 -19.380
25 HD3 ARG 3 HD1 ARG 3 52.422 15.752 -20.686
26 HE ARG 3 HE ARG 3 50.748 18.014 -21.043
27 HH11 ARG 3 HH11 ARG 3 54.300 17.386 -21.054
28 HH12 ARG 3 HH12 ARG 3 54.653 18.651 -22.182
29 HH21 ARG 3 HH21 ARG 3 51.279 19.710 -22.561
30 HH22 ARG 3 HH22 ARG 3 52.919 19.983 -23.044
31 H LEU 4 HN LEU 4 50.137 14.538 -14.673
32 HA LEU 4 HA LEU 4 51.075 11.753 -14.784
33 HB2 LEU 4 HB2 LEU 4 51.422 13.925 -12.628
34 HB3 LEU 4 HB1 LEU 4 51.911 12.210 -12.386
35 HG LEU 4 HG LEU 4 53.058 14.023 -14.612
36 HD11 LEU 4 HD11 LEU 4 55.100 14.272 -13.195
37 HD12 LEU 4 HD12 LEU 4 54.301 13.359 -11.858
38 HD13 LEU 4 HD13 LEU 4 53.648 14.960 -12.376
39 HD21 LEU 4 HD21 LEU 4 54.979 12.239 -14.537
40 HD22 LEU 4 HD22 LEU 4 53.429 11.730 -15.293
41 HD23 LEU 4 HD23 LEU 4 53.829 11.196 -13.617
42 H SER 5 HN SER 5 48.187 13.041 -14.825
43 HA SER 5 HA SER 5 47.096 12.045 -12.340
44 HB2 SER 5 HB2 SER 5 46.191 14.129 -13.598
45 HB3 SER 5 HB1 SER 5 45.558 13.001 -14.853
46 HG SER 5 HG SER 5 44.561 11.930 -12.910
47 H LYS 6 HN LYS 6 47.523 10.962 -15.726
48 HA LYS 6 HA LYS 6 45.634 8.770 -15.516
49 HB2 LYS 6 HB2 LYS 6 47.818 9.413 -17.607
50 HB3 LYS 6 HB1 LYS 6 46.562 8.128 -17.777
51 HG2 LYS 6 HG2 LYS 6 44.759 9.876 -17.706
52 HG3 LYS 6 HG1 LYS 6 46.006 11.163 -17.535
53 HD2 LYS 6 HD2 LYS 6 46.992 10.485 -19.749
54 HD3 LYS 6 HD1 LYS 6 45.713 9.231 -19.919
55 HE2 LYS 6 HE2 LYS 6 43.941 11.025 -19.940
56 HE3 LYS 6 HE1 LYS 6 45.220 12.293 -19.736
57 HZ1 LYS 6 HZ1 LYS 6 44.852 10.435 -22.029
58 HZ2 LYS 6 HZ2 LYS 6 46.202 11.444 -21.825
59 HZ3 LYS 6 HZ3 LYS 6 44.654 12.121 -22.004
60 H PHE 7 HN PHE 7 48.965 9.407 -14.668
61 HA PHE 7 HA PHE 7 50.074 6.781 -14.887
62 HB2 PHE 7 HB2 PHE 7 50.808 9.436 -13.526
63 HB3 PHE 7 HB1 PHE 7 51.725 7.951 -13.068
64 HD1 PHE 7 HD1 PHE 7 50.698 9.894 -16.202
65 HD2 PHE 7 HD2 PHE 7 53.686 7.524 -14.258
66 HE1 PHE 7 HE1 PHE 7 52.231 10.289 -18.047
67 HE2 PHE 7 HE2 PHE 7 55.192 7.943 -16.128
68 HZ PHE 7 HZ PHE 7 54.475 9.321 -18.018
69 H PHE 8 HN PHE 8 48.331 8.743 -12.626
70 HA PHE 8 HA PHE 8 48.848 7.045 -10.367
71 HB2 PHE 8 HB2 PHE 8 48.240 9.842 -11.032
72 HB3 PHE 8 HB1 PHE 8 47.072 9.211 -9.817
73 HD1 PHE 8 HD1 PHE 8 50.692 8.409 -10.375
74 HD2 PHE 8 HD2 PHE 8 47.795 10.146 -7.737
75 HE1 PHE 8 HE1 PHE 8 52.446 8.930 -8.802
76 HE2 PHE 8 HE2 PHE 8 49.589 10.610 -6.118
77 HZ PHE 8 HZ PHE 8 51.914 10.008 -6.642
78 H ARG 9 HN ARG 9 46.603 7.451 -12.872
79 HA ARG 9 HA ARG 9 44.418 6.389 -11.346
80 HB2 ARG 9 HB2 ARG 9 44.468 7.937 -13.576
81 HB3 ARG 9 HB1 ARG 9 44.610 6.351 -14.401
82 HG2 ARG 9 HG2 ARG 9 42.543 5.708 -12.841
83 HG3 ARG 9 HG1 ARG 9 42.355 7.493 -12.729
84 HD2 ARG 9 HD2 ARG 9 40.984 7.004 -14.584
85 HD3 ARG 9 HD1 ARG 9 42.568 7.377 -15.402
86 HE ARG 9 HE ARG 9 42.413 4.547 -14.714
87 HH11 ARG 9 HH11 ARG 9 41.189 6.939 -17.118
88 HH12 ARG 9 HH12 ARG 9 40.914 5.751 -18.347
89 HH21 ARG 9 HH21 ARG 9 42.024 2.994 -16.391
90 HH22 ARG 9 HH22 ARG 9 41.394 3.485 -17.927
91 H ASP 10 HN ASP 10 47.132 5.277 -13.357
92 HA ASP 10 HA ASP 10 45.871 2.664 -13.470
93 HB2 ASP 10 HB2 ASP 10 48.682 3.588 -14.374
94 HB3 ASP 10 HB1 ASP 10 48.019 1.935 -14.662
95 H PHE 11 HN PHE 11 48.299 4.380 -11.504
96 HA PHE 11 HA PHE 11 49.222 1.973 -10.353
97 HB2 PHE 11 HB2 PHE 11 51.103 3.159 -10.023
98 HB3 PHE 11 HB1 PHE 11 50.232 4.628 -10.559
99 HD1 PHE 11 HD1 PHE 11 50.806 2.562 -7.367
100 HD2 PHE 11 HD2 PHE 11 49.862 6.245 -9.215
101 HE1 PHE 11 HE1 PHE 11 50.613 3.659 -5.188
102 HE2 PHE 11 HE2 PHE 11 49.707 7.293 -7.098
103 HZ PHE 11 HZ PHE 11 50.018 6.051 -5.060
104 H ILE 12 HN ILE 12 47.078 4.525 -9.110
105 HA ILE 12 HA ILE 12 46.932 3.424 -6.535
106 HB ILE 12 HB ILE 12 45.195 5.223 -8.207
107 HG12 ILE 12 HG12 ILE 12 46.999 5.722 -5.784
108 HG13 ILE 12 HG11 ILE 12 47.456 5.837 -7.516
109 HG21 ILE 12 HG21 ILE 12 43.514 4.263 -6.631
110 HG22 ILE 12 HG22 ILE 12 43.996 5.831 -5.909
111 HG23 ILE 12 HG23 ILE 12 44.680 4.299 -5.255
112 HD11 ILE 12 HD11 ILE 12 47.014 8.032 -6.613
113 HD12 ILE 12 HD12 ILE 12 45.340 7.556 -6.139
114 HD13 ILE 12 HD13 ILE 12 45.795 7.616 -7.892
115 H LEU 13 HN LEU 13 45.215 2.790 -9.551
116 HA LEU 13 HA LEU 13 42.985 1.511 -8.330
117 HB2 LEU 13 HB2 LEU 13 44.148 1.814 -11.078
118 HB3 LEU 13 HB1 LEU 13 42.727 0.735 -10.846
119 HG LEU 13 HG LEU 13 42.330 3.136 -11.611
120 HD11 LEU 13 HD11 LEU 13 40.466 1.734 -10.890
121 HD12 LEU 13 HD12 LEU 13 40.190 3.433 -10.356
122 HD13 LEU 13 HD13 LEU 13 40.738 2.193 -9.171
123 HD21 LEU 13 HD21 LEU 13 43.891 4.348 -9.951
124 HD22 LEU 13 HD22 LEU 13 42.621 4.086 -8.686
125 HD23 LEU 13 HD23 LEU 13 42.245 5.062 -10.147
126 H GLN 14 HN GLN 14 46.156 0.326 -9.328
127 HA GLN 14 HA GLN 14 45.322 -2.463 -9.270
128 HB2 GLN 14 HB2 GLN 14 48.094 -1.145 -9.510
129 HB3 GLN 14 HB1 GLN 14 47.833 -2.933 -9.531
130 HG2 GLN 14 HG2 GLN 14 46.379 -2.704 -11.579
131 HG3 GLN 14 HG1 GLN 14 46.651 -0.922 -11.578
132 HE21 GLN 14 HE21 GLN 14 48.920 -0.108 -11.989
133 HE22 GLN 14 HE22 GLN 14 50.060 -1.114 -12.816
134 H ARG 15 HN ARG 15 46.017 -0.169 -6.771
135 HA ARG 15 HA ARG 15 47.128 -2.252 -5.001
136 HB2 ARG 15 HB2 ARG 15 47.107 0.796 -4.713
137 HB3 ARG 15 HB1 ARG 15 47.733 -0.356 -3.468
138 HG2 ARG 15 HG2 ARG 15 49.320 -1.275 -5.297
139 HG3 ARG 15 HG1 ARG 15 48.820 0.132 -6.304
140 HD2 ARG 15 HD2 ARG 15 49.568 1.685 -4.443
141 HD3 ARG 15 HD1 ARG 15 50.160 0.224 -3.534
142 HE ARG 15 HE ARG 15 51.285 0.205 -6.203
143 HH11 ARG 15 HH11 ARG 15 51.569 1.985 -3.081
144 HH12 ARG 15 HH12 ARG 15 53.200 2.491 -3.367
145 HH21 ARG 15 HH21 ARG 15 53.479 0.930 -6.550
146 HH22 ARG 15 HH22 ARG 15 54.292 1.886 -5.357
147 H LYS 16 HN LYS 16 44.220 -2.038 -5.871
148 HA LYS 16 HA LYS 16 42.948 -1.234 -3.343
149 HB2 LYS 16 HB2 LYS 16 41.750 -1.784 -6.116
150 HB3 LYS 16 HB1 LYS 16 40.808 -1.350 -4.636
151 HG2 LYS 16 HG2 LYS 16 42.402 0.776 -4.543
152 HG3 LYS 16 HG1 LYS 16 42.773 0.356 -6.249
153 HD2 LYS 16 HD2 LYS 16 40.353 0.479 -6.821
154 HD3 LYS 16 HD1 LYS 16 39.973 0.833 -5.097
155 HE2 LYS 16 HE2 LYS 16 41.269 2.997 -5.248
156 HE3 LYS 16 HE1 LYS 16 41.660 2.641 -6.980
157 HZ1 LYS 16 HZ1 LYS 16 38.950 2.364 -6.802
158 HZ2 LYS 16 HZ2 LYS 16 39.806 3.690 -7.428
159 HZ3 LYS 16 HZ3 LYS 16 39.283 3.703 -5.813
160 H LYS 17 HN LYS 17 44.414 -3.852 -4.839
161 HA LYS 17 HA LYS 17 42.566 -5.726 -3.569
162 HB2 LYS 17 HB2 LYS 17 43.904 -5.803 -6.307
163 HB3 LYS 17 HB1 LYS 17 43.759 -7.353 -5.416
164 HG2 LYS 17 HG2 LYS 17 41.788 -7.453 -6.620
165 HG3 LYS 17 HG1 LYS 17 41.172 -6.620 -5.156
166 HD2 LYS 17 HD2 LYS 17 41.457 -4.386 -6.367
167 HD3 LYS 17 HD1 LYS 17 41.995 -5.279 -7.824
168 HE2 LYS 17 HE2 LYS 17 39.649 -4.755 -8.176
169 HE3 LYS 17 HE1 LYS 17 39.688 -6.515 -7.764
170 HZ1 LYS 17 HZ1 LYS 17 38.580 -6.147 -5.890
171 HZ2 LYS 17 HZ2 LYS 17 38.129 -4.674 -6.603
172 HZ3 LYS 17 HZ3 LYS 17 39.419 -4.723 -5.500
Start of MODEL 6
1 H1 GLU 1 HT1 GLU 1 56.060 16.778 -17.044
2 H2 GLU 1 HT2 GLU 1 55.098 17.674 -18.121
3 H3 GLU 1 HT3 GLU 1 54.382 16.521 -17.100
4 HA GLU 1 HA GLU 1 55.881 18.374 -15.613
5 HB2 GLU 1 HB2 GLU 1 55.242 19.818 -17.674
6 HB3 GLU 1 HB1 GLU 1 53.520 19.596 -17.209
7 HG2 GLU 1 HG2 GLU 1 53.949 20.769 -15.007
8 HG3 GLU 1 HG1 GLU 1 55.697 20.944 -15.431
9 H MET 2 HN MET 2 52.411 17.653 -16.602
10 HA MET 2 HA MET 2 51.896 16.886 -13.799
11 HB2 MET 2 HB2 MET 2 50.041 18.531 -15.655
12 HB3 MET 2 HB1 MET 2 49.517 17.798 -14.096
13 HG2 MET 2 HG2 MET 2 51.182 19.205 -12.871
14 HG3 MET 2 HG1 MET 2 51.711 19.940 -14.421
15 HE1 MET 2 HE1 MET 2 51.386 22.282 -13.371
16 HE2 MET 2 HE2 MET 2 50.839 21.512 -11.841
17 HE3 MET 2 HE3 MET 2 49.886 22.853 -12.563
18 H ARG 3 HN ARG 3 50.309 15.194 -13.547
19 HA ARG 3 HA ARG 3 49.995 13.561 -15.981
20 HB2 ARG 3 HB2 ARG 3 49.887 12.836 -12.978
21 HB3 ARG 3 HB1 ARG 3 49.433 11.687 -14.286
22 HG2 ARG 3 HG2 ARG 3 51.756 11.849 -15.237
23 HG3 ARG 3 HG1 ARG 3 52.214 12.981 -13.914
24 HD2 ARG 3 HD2 ARG 3 51.766 11.189 -12.199
25 HD3 ARG 3 HD1 ARG 3 51.268 10.041 -13.522
26 HE ARG 3 HE ARG 3 53.913 11.065 -14.106
27 HH11 ARG 3 HH11 ARG 3 52.239 8.871 -11.774
28 HH12 ARG 3 HH12 ARG 3 53.643 7.901 -11.476
29 HH21 ARG 3 HH21 ARG 3 55.781 9.714 -13.661
30 HH22 ARG 3 HH22 ARG 3 55.667 8.386 -12.555
31 H LEU 4 HN LEU 4 47.892 12.248 -16.039
32 HA LEU 4 HA LEU 4 45.662 14.053 -15.700
33 HB2 LEU 4 HB2 LEU 4 45.727 11.195 -16.821
34 HB3 LEU 4 HB1 LEU 4 44.349 12.342 -16.954
35 HG LEU 4 HG LEU 4 47.122 12.760 -18.252
36 HD11 LEU 4 HD11 LEU 4 44.488 11.862 -19.593
37 HD12 LEU 4 HD12 LEU 4 45.880 10.785 -19.196
38 HD13 LEU 4 HD13 LEU 4 46.087 12.117 -20.395
39 HD21 LEU 4 HD21 LEU 4 46.210 14.975 -18.043
40 HD22 LEU 4 HD22 LEU 4 44.523 14.424 -18.362
41 HD23 LEU 4 HD23 LEU 4 45.725 14.475 -19.705
42 H SER 5 HN SER 5 43.510 13.111 -14.901
43 HA SER 5 HA SER 5 43.954 11.929 -12.293
44 HB2 SER 5 HB2 SER 5 41.346 12.796 -13.732
45 HB3 SER 5 HB1 SER 5 41.428 12.192 -12.024
46 HG SER 5 HG SER 5 43.150 14.253 -12.732
47 H LYS 6 HN LYS 6 43.325 10.929 -15.558
48 HA LYS 6 HA LYS 6 42.028 8.410 -14.873
49 HB2 LYS 6 HB2 LYS 6 43.143 9.513 -17.543
50 HB3 LYS 6 HB1 LYS 6 42.219 7.973 -17.359
51 HG2 LYS 6 HG2 LYS 6 40.226 9.266 -16.533
52 HG3 LYS 6 HG1 LYS 6 41.141 10.803 -16.720
53 HD2 LYS 6 HD2 LYS 6 41.370 10.354 -19.185
54 HD3 LYS 6 HD1 LYS 6 40.430 8.833 -18.984
55 HE2 LYS 6 HE2 LYS 6 38.423 10.161 -18.224
56 HE3 LYS 6 HE1 LYS 6 39.371 11.696 -18.396
57 HZ1 LYS 6 HZ1 LYS 6 39.178 11.640 -20.599
58 HZ2 LYS 6 HZ2 LYS 6 37.832 10.653 -20.288
59 HZ3 LYS 6 HZ3 LYS 6 39.317 9.953 -20.725
60 H PHE 7 HN PHE 7 45.268 9.849 -15.206
61 HA PHE 7 HA PHE 7 46.698 7.411 -15.754
62 HB2 PHE 7 HB2 PHE 7 47.276 10.266 -15.350
63 HB3 PHE 7 HB1 PHE 7 48.371 9.307 -14.278
64 HD1 PHE 7 HD1 PHE 7 47.247 9.760 -17.847
65 HD2 PHE 7 HD2 PHE 7 50.296 8.291 -15.244
66 HE1 PHE 7 HE1 PHE 7 48.716 9.435 -19.742
67 HE2 PHE 7 HE2 PHE 7 51.756 7.973 -17.173
68 HZ PHE 7 HZ PHE 7 50.977 8.541 -19.425
69 H PHE 8 HN PHE 8 45.380 9.132 -13.056
70 HA PHE 8 HA PHE 8 46.984 7.769 -11.093
71 HB2 PHE 8 HB2 PHE 8 45.574 10.306 -11.485
72 HB3 PHE 8 HB1 PHE 8 44.965 9.493 -9.996
73 HD1 PHE 8 HD1 PHE 8 48.348 9.527 -11.605
74 HD2 PHE 8 HD2 PHE 8 46.029 10.614 -8.167
75 HE1 PHE 8 HE1 PHE 8 50.309 10.498 -10.588
76 HE2 PHE 8 HE2 PHE 8 48.054 11.542 -7.122
77 HZ PHE 8 HZ PHE 8 50.199 11.493 -8.327
78 H ARG 9 HN ARG 9 44.042 7.452 -12.742
79 HA ARG 9 HA ARG 9 42.798 5.980 -10.606
80 HB2 ARG 9 HB2 ARG 9 41.523 7.434 -12.255
81 HB3 ARG 9 HB1 ARG 9 42.099 6.390 -13.594
82 HG2 ARG 9 HG2 ARG 9 40.822 4.516 -12.788
83 HG3 ARG 9 HG1 ARG 9 40.404 5.358 -11.255
84 HD2 ARG 9 HD2 ARG 9 39.088 7.057 -12.528
85 HD3 ARG 9 HD1 ARG 9 39.529 6.228 -14.091
86 HE ARG 9 HE ARG 9 38.369 4.228 -12.419
87 HH11 ARG 9 HH11 ARG 9 37.315 7.325 -13.942
88 HH12 ARG 9 HH12 ARG 9 35.652 6.854 -14.053
89 HH21 ARG 9 HH21 ARG 9 36.116 3.646 -12.590
90 HH22 ARG 9 HH22 ARG 9 34.966 4.744 -13.275
91 H ASP 10 HN ASP 10 44.911 5.501 -13.448
92 HA ASP 10 HA ASP 10 44.420 2.631 -13.268
93 HB2 ASP 10 HB2 ASP 10 46.431 4.221 -14.998
94 HB3 ASP 10 HB1 ASP 10 46.174 2.441 -15.121
95 H PHE 11 HN PHE 11 46.787 4.993 -12.049
96 HA PHE 11 HA PHE 11 48.596 2.910 -11.395
97 HB2 PHE 11 HB2 PHE 11 50.180 4.483 -11.680
98 HB3 PHE 11 HB1 PHE 11 48.882 5.702 -11.873
99 HD1 PHE 11 HD1 PHE 11 51.034 4.048 -9.167
100 HD2 PHE 11 HD2 PHE 11 48.482 7.211 -10.379
101 HE1 PHE 11 HE1 PHE 11 51.326 5.166 -7.009
102 HE2 PHE 11 HE2 PHE 11 48.792 8.290 -8.292
103 HZ PHE 11 HZ PHE 11 50.149 7.303 -6.559
104 H ILE 12 HN ILE 12 46.433 4.945 -9.442
105 HA ILE 12 HA ILE 12 47.433 3.973 -7.000
106 HB ILE 12 HB ILE 12 44.857 5.232 -7.911
107 HG12 ILE 12 HG12 ILE 12 47.214 6.240 -6.237
108 HG13 ILE 12 HG11 ILE 12 46.982 6.400 -8.010
109 HG21 ILE 12 HG21 ILE 12 45.608 4.338 -4.997
110 HG22 ILE 12 HG22 ILE 12 44.089 3.966 -5.897
111 HG23 ILE 12 HG23 ILE 12 44.396 5.634 -5.318
112 HD11 ILE 12 HD11 ILE 12 46.404 8.453 -6.852
113 HD12 ILE 12 HD12 ILE 12 45.127 7.601 -5.905
114 HD13 ILE 12 HD13 ILE 12 44.965 7.741 -7.705
115 H LEU 13 HN LEU 13 44.995 2.828 -9.288
116 HA LEU 13 HA LEU 13 43.691 1.107 -7.424
117 HB2 LEU 13 HB2 LEU 13 43.721 1.542 -10.401
118 HB3 LEU 13 HB1 LEU 13 42.761 0.181 -9.716
119 HG LEU 13 HG LEU 13 41.553 2.363 -10.217
120 HD11 LEU 13 HD11 LEU 13 39.981 2.232 -8.316
121 HD12 LEU 13 HD12 LEU 13 41.214 1.347 -7.343
122 HD13 LEU 13 HD13 LEU 13 40.524 0.590 -8.826
123 HD21 LEU 13 HD21 LEU 13 42.623 3.571 -7.584
124 HD22 LEU 13 HD22 LEU 13 41.568 4.331 -8.826
125 HD23 LEU 13 HD23 LEU 13 43.299 4.000 -9.211
126 H GLN 14 HN GLN 14 46.437 0.642 -9.666
127 HA GLN 14 HA GLN 14 46.409 -2.236 -9.412
128 HB2 GLN 14 HB2 GLN 14 48.548 -0.292 -10.473
129 HB3 GLN 14 HB1 GLN 14 48.778 -2.084 -10.441
130 HG2 GLN 14 HG2 GLN 14 46.743 -2.363 -11.922
131 HG3 GLN 14 HG1 GLN 14 46.560 -0.570 -11.993
132 HE21 GLN 14 HE21 GLN 14 48.342 0.719 -13.081
133 HE22 GLN 14 HE22 GLN 14 49.383 -0.052 -14.229
134 H ARG 15 HN ARG 15 47.454 0.320 -7.255
135 HA ARG 15 HA ARG 15 49.453 -1.425 -5.986
136 HB2 ARG 15 HB2 ARG 15 48.868 1.559 -5.629
137 HB3 ARG 15 HB1 ARG 15 50.068 0.631 -4.648
138 HG2 ARG 15 HG2 ARG 15 51.208 -0.035 -6.864
139 HG3 ARG 15 HG1 ARG 15 50.129 1.149 -7.684
140 HD2 ARG 15 HD2 ARG 15 51.030 2.971 -6.157
141 HD3 ARG 15 HD1 ARG 15 52.173 1.743 -5.455
142 HE ARG 15 HE ARG 15 52.440 1.750 -8.341
143 HH11 ARG 15 HH11 ARG 15 53.226 3.803 -5.477
144 HH12 ARG 15 HH12 ARG 15 54.553 4.601 -6.252
145 HH21 ARG 15 HH21 ARG 15 54.239 2.867 -9.337
146 HH22 ARG 15 HH22 ARG 15 55.132 4.065 -8.462
147 H LYS 16 HN LYS 16 46.308 -1.624 -5.884
148 HA LYS 16 HA LYS 16 45.916 -1.251 -2.997
149 HB2 LYS 16 HB2 LYS 16 43.968 -1.987 -5.241
150 HB3 LYS 16 HB1 LYS 16 43.529 -1.985 -3.490
151 HG2 LYS 16 HG2 LYS 16 44.315 0.488 -3.427
152 HG3 LYS 16 HG1 LYS 16 44.403 0.403 -5.222
153 HD2 LYS 16 HD2 LYS 16 41.999 -0.214 -5.331
154 HD3 LYS 16 HD1 LYS 16 41.918 -0.203 -3.534
155 HE2 LYS 16 HE2 LYS 16 42.443 2.276 -3.526
156 HE3 LYS 16 HE1 LYS 16 42.505 2.258 -5.338
157 HZ1 LYS 16 HZ1 LYS 16 40.333 2.415 -5.400
158 HZ2 LYS 16 HZ2 LYS 16 40.304 2.615 -3.714
159 HZ3 LYS 16 HZ3 LYS 16 40.107 1.069 -4.388
160 H LYS 17 HN LYS 17 46.986 -3.556 -5.311
161 HA LYS 17 HA LYS 17 47.378 -5.674 -5.361
162 HB2 LYS 17 HB2 LYS 17 47.189 -5.714 -2.278
163 HB3 LYS 17 HB1 LYS 17 47.920 -7.001 -3.297
164 HG2 LYS 17 HG2 LYS 17 49.904 -5.944 -2.962
165 HG3 LYS 17 HG1 LYS 17 49.344 -4.741 -4.168
166 HD2 LYS 17 HD2 LYS 17 48.483 -3.272 -2.346
167 HD3 LYS 17 HD1 LYS 17 48.923 -4.502 -1.110
168 HE2 LYS 17 HE2 LYS 17 51.381 -4.243 -1.801
169 HE3 LYS 17 HE1 LYS 17 50.878 -2.917 -2.929
170 HZ1 LYS 17 HZ1 LYS 17 51.265 -1.661 -1.165
171 HZ2 LYS 17 HZ2 LYS 17 51.143 -2.936 -0.048
172 HZ3 LYS 17 HZ3 LYS 17 49.739 -2.168 -0.618
Start of MODEL 7
1 H1 GLU 1 HT1 GLU 1 50.458 22.742 -15.524
2 H2 GLU 1 HT2 GLU 1 48.824 22.703 -15.064
3 H3 GLU 1 HT3 GLU 1 49.305 23.626 -16.405
4 HA GLU 1 HA GLU 1 48.292 21.153 -16.503
5 HB2 GLU 1 HB2 GLU 1 50.189 22.616 -18.466
6 HB3 GLU 1 HB1 GLU 1 49.346 21.084 -18.910
7 HG2 GLU 1 HG2 GLU 1 47.102 22.184 -18.547
8 HG3 GLU 1 HG1 GLU 1 47.925 23.724 -18.086
9 H MET 2 HN MET 2 48.956 19.195 -15.700
10 HA MET 2 HA MET 2 51.831 18.532 -15.937
11 HB2 MET 2 HB2 MET 2 49.758 17.602 -13.832
12 HB3 MET 2 HB1 MET 2 51.425 16.936 -13.984
13 HG2 MET 2 HG2 MET 2 52.390 19.176 -13.469
14 HG3 MET 2 HG1 MET 2 50.753 19.891 -13.393
15 HE1 MET 2 HE1 MET 2 53.546 17.878 -11.821
16 HE2 MET 2 HE2 MET 2 52.433 16.468 -11.869
17 HE3 MET 2 HE3 MET 2 52.909 17.182 -10.292
18 H ARG 3 HN ARG 3 48.446 17.184 -15.797
19 HA ARG 3 HA ARG 3 47.401 15.585 -16.836
20 HB2 ARG 3 HB2 ARG 3 48.323 16.886 -18.938
21 HB3 ARG 3 HB1 ARG 3 49.450 15.508 -19.141
22 HG2 ARG 3 HG2 ARG 3 47.479 13.936 -19.313
23 HG3 ARG 3 HG1 ARG 3 46.356 15.328 -19.102
24 HD2 ARG 3 HD2 ARG 3 47.309 16.375 -21.238
25 HD3 ARG 3 HD1 ARG 3 48.325 14.880 -21.464
26 HE ARG 3 HE ARG 3 45.600 14.040 -21.102
27 HH11 ARG 3 HH11 ARG 3 47.568 15.880 -23.504
28 HH12 ARG 3 HH12 ARG 3 46.578 15.434 -24.852
29 HH21 ARG 3 HH21 ARG 3 44.297 13.469 -22.961
30 HH22 ARG 3 HH22 ARG 3 44.703 14.054 -24.540
31 H LEU 4 HN LEU 4 48.246 14.394 -14.850
32 HA LEU 4 HA LEU 4 49.507 11.903 -15.762
33 HB2 LEU 4 HB2 LEU 4 50.203 13.471 -13.178
34 HB3 LEU 4 HB1 LEU 4 50.662 11.751 -13.434
35 HG LEU 4 HG LEU 4 51.609 14.075 -15.233
36 HD11 LEU 4 HD11 LEU 4 52.465 14.383 -12.905
37 HD12 LEU 4 HD12 LEU 4 53.799 13.952 -14.038
38 HD13 LEU 4 HD13 LEU 4 53.134 12.706 -12.913
39 HD21 LEU 4 HD21 LEU 4 51.850 12.076 -16.545
40 HD22 LEU 4 HD22 LEU 4 52.356 11.079 -15.128
41 HD23 LEU 4 HD23 LEU 4 53.481 12.309 -15.818
42 H SER 5 HN SER 5 46.674 12.711 -15.520
43 HA SER 5 HA SER 5 45.786 11.641 -12.976
44 HB2 SER 5 HB2 SER 5 44.192 12.628 -15.434
45 HB3 SER 5 HB1 SER 5 43.442 12.089 -13.874
46 HG SER 5 HG SER 5 45.475 13.994 -13.771
47 H LYS 6 HN LYS 6 46.415 10.389 -16.227
48 HA LYS 6 HA LYS 6 44.601 8.131 -15.908
49 HB2 LYS 6 HB2 LYS 6 46.725 8.771 -18.051
50 HB3 LYS 6 HB1 LYS 6 45.630 7.336 -18.092
51 HG2 LYS 6 HG2 LYS 6 43.634 8.880 -18.147
52 HG3 LYS 6 HG1 LYS 6 44.740 10.298 -18.154
53 HD2 LYS 6 HD2 LYS 6 45.736 9.507 -20.318
54 HD3 LYS 6 HD1 LYS 6 44.627 8.090 -20.306
55 HE2 LYS 6 HE2 LYS 6 42.636 9.638 -20.444
56 HE3 LYS 6 HE1 LYS 6 43.749 11.068 -20.444
57 HZ1 LYS 6 HZ1 LYS 6 43.256 9.056 -22.528
58 HZ2 LYS 6 HZ2 LYS 6 44.786 9.787 -22.446
59 HZ3 LYS 6 HZ3 LYS 6 43.397 10.745 -22.638
60 H PHE 7 HN PHE 7 47.785 9.063 -14.989
61 HA PHE 7 HA PHE 7 49.049 6.481 -15.045
62 HB2 PHE 7 HB2 PHE 7 49.736 9.308 -14.045
63 HB3 PHE 7 HB1 PHE 7 50.771 7.910 -13.549
64 HD1 PHE 7 HD1 PHE 7 49.467 9.757 -16.592
65 HD2 PHE 7 HD2 PHE 7 52.470 7.149 -15.015
66 HE1 PHE 7 HE1 PHE 7 50.759 9.979 -18.648
67 HE2 PHE 7 HE2 PHE 7 53.736 7.394 -17.086
68 HZ PHE 7 HZ PHE 7 52.889 8.803 -18.900
69 H PHE 8 HN PHE 8 47.277 8.597 -12.871
70 HA PHE 8 HA PHE 8 48.201 7.185 -10.530
71 HB2 PHE 8 HB2 PHE 8 47.296 9.845 -11.335
72 HB3 PHE 8 HB1 PHE 8 46.299 9.242 -9.965
73 HD1 PHE 8 HD1 PHE 8 49.906 8.694 -10.838
74 HD2 PHE 8 HD2 PHE 8 47.134 10.345 -8.018
75 HE1 PHE 8 HE1 PHE 8 51.754 9.509 -9.501
76 HE2 PHE 8 HE2 PHE 8 49.023 11.102 -6.637
77 HZ PHE 8 HZ PHE 8 51.334 10.696 -7.371
78 H ARG 9 HN ARG 9 45.506 7.153 -12.702
79 HA ARG 9 HA ARG 9 43.875 6.013 -10.581
80 HB2 ARG 9 HB2 ARG 9 42.063 5.777 -12.158
81 HB3 ARG 9 HB1 ARG 9 42.754 7.425 -12.325
82 HG2 ARG 9 HG2 ARG 9 44.090 6.505 -14.347
83 HG3 ARG 9 HG1 ARG 9 43.070 5.030 -14.232
84 HD2 ARG 9 HD2 ARG 9 40.999 6.450 -14.473
85 HD3 ARG 9 HD1 ARG 9 42.064 7.920 -14.654
86 HE ARG 9 HE ARG 9 42.869 5.846 -16.546
87 HH11 ARG 9 HH11 ARG 9 40.291 8.319 -16.022
88 HH12 ARG 9 HH12 ARG 9 39.926 8.476 -17.708
89 HH21 ARG 9 HH21 ARG 9 42.335 6.102 -18.798
90 HH22 ARG 9 HH22 ARG 9 41.097 7.206 -19.297
91 H ASP 10 HN ASP 10 46.171 4.969 -13.086
92 HA ASP 10 HA ASP 10 45.144 2.258 -12.684
93 HB2 ASP 10 HB2 ASP 10 47.312 3.439 -14.515
94 HB3 ASP 10 HB1 ASP 10 47.188 1.657 -14.278
95 H PHE 11 HN PHE 11 47.525 4.365 -11.244
96 HA PHE 11 HA PHE 11 48.962 2.098 -10.295
97 HB2 PHE 11 HB2 PHE 11 50.798 3.407 -10.410
98 HB3 PHE 11 HB1 PHE 11 49.744 4.779 -10.857
99 HD1 PHE 11 HD1 PHE 11 51.110 3.011 -7.746
100 HD2 PHE 11 HD2 PHE 11 49.483 6.482 -9.553
101 HE1 PHE 11 HE1 PHE 11 51.283 4.237 -5.636
102 HE2 PHE 11 HE2 PHE 11 49.674 7.661 -7.490
103 HZ PHE 11 HZ PHE 11 50.523 6.585 -5.510
104 H ILE 12 HN ILE 12 46.917 4.583 -8.818
105 HA ILE 12 HA ILE 12 47.370 3.658 -6.200
106 HB ILE 12 HB ILE 12 45.235 5.261 -7.587
107 HG12 ILE 12 HG12 ILE 12 47.419 6.015 -5.583
108 HG13 ILE 12 HG11 ILE 12 47.558 6.011 -7.371
109 HG21 ILE 12 HG21 ILE 12 45.366 4.529 -4.539
110 HG22 ILE 12 HG22 ILE 12 43.963 4.301 -5.650
111 HG23 ILE 12 HG23 ILE 12 44.450 5.954 -5.152
112 HD11 ILE 12 HD11 ILE 12 47.158 8.249 -6.494
113 HD12 ILE 12 HD12 ILE 12 45.575 7.723 -5.801
114 HD13 ILE 12 HD13 ILE 12 45.821 7.703 -7.596
115 H LEU 13 HN LEU 13 45.080 2.789 -8.747
116 HA LEU 13 HA LEU 13 43.222 1.529 -6.987
117 HB2 LEU 13 HB2 LEU 13 43.712 1.681 -9.949
118 HB3 LEU 13 HB1 LEU 13 42.410 0.615 -9.321
119 HG LEU 13 HG LEU 13 41.729 2.897 -10.142
120 HD11 LEU 13 HD11 LEU 13 40.904 2.404 -7.221
121 HD12 LEU 13 HD12 LEU 13 40.254 1.520 -8.655
122 HD13 LEU 13 HD13 LEU 13 39.969 3.292 -8.485
123 HD21 LEU 13 HD21 LEU 13 42.701 4.221 -7.535
124 HD22 LEU 13 HD22 LEU 13 42.050 4.982 -9.034
125 HD23 LEU 13 HD23 LEU 13 43.692 4.240 -9.050
126 H GLN 14 HN GLN 14 45.925 0.269 -8.995
127 HA GLN 14 HA GLN 14 45.087 -2.471 -8.643
128 HB2 GLN 14 HB2 GLN 14 47.705 -1.319 -9.784
129 HB3 GLN 14 HB1 GLN 14 47.204 -3.054 -9.872
130 HG2 GLN 14 HG2 GLN 14 45.148 -2.376 -11.211
131 HG3 GLN 14 HG1 GLN 14 45.709 -0.655 -11.144
132 HE21 GLN 14 HE21 GLN 14 45.734 -0.794 -13.604
133 HE22 GLN 14 HE22 GLN 14 47.115 -1.480 -14.388
134 H ARG 15 HN ARG 15 46.657 -0.418 -6.344
135 HA ARG 15 HA ARG 15 48.445 -2.533 -5.403
136 HB2 ARG 15 HB2 ARG 15 48.019 0.344 -4.488
137 HB3 ARG 15 HB1 ARG 15 49.081 -0.824 -3.609
138 HG2 ARG 15 HG2 ARG 15 50.334 -1.198 -5.821
139 HG3 ARG 15 HG1 ARG 15 49.384 0.165 -6.506
140 HD2 ARG 15 HD2 ARG 15 50.296 1.691 -4.714
141 HD3 ARG 15 HD1 ARG 15 51.268 0.296 -4.068
142 HE ARG 15 HE ARG 15 51.821 0.621 -6.895
143 HH11 ARG 15 HH11 ARG 15 52.472 2.239 -3.734
144 HH12 ARG 15 HH12 ARG 15 53.928 3.001 -4.278
145 HH21 ARG 15 HH21 ARG 15 53.785 1.692 -7.579
146 HH22 ARG 15 HH22 ARG 15 54.678 2.689 -6.479
147 H LYS 16 HN LYS 16 45.160 -1.866 -5.071
148 HA LYS 16 HA LYS 16 45.133 -2.982 -2.341
149 HB2 LYS 16 HB2 LYS 16 43.004 -1.217 -3.721
150 HB3 LYS 16 HB1 LYS 16 42.832 -1.956 -2.089
151 HG2 LYS 16 HG2 LYS 16 45.041 0.087 -2.825
152 HG3 LYS 16 HG1 LYS 16 43.440 0.537 -2.159
153 HD2 LYS 16 HD2 LYS 16 43.944 -0.896 -0.103
154 HD3 LYS 16 HD1 LYS 16 45.582 -1.216 -0.753
155 HE2 LYS 16 HE2 LYS 16 44.529 1.645 -0.178
156 HE3 LYS 16 HE1 LYS 16 45.440 0.647 1.025
157 HZ1 LYS 16 HZ1 LYS 16 46.719 2.279 -0.388
158 HZ2 LYS 16 HZ2 LYS 16 46.504 1.205 -1.688
159 HZ3 LYS 16 HZ3 LYS 16 47.330 0.696 -0.294
160 H LYS 17 HN LYS 17 44.849 -3.714 -5.629
161 HA LYS 17 HA LYS 17 42.619 -5.545 -5.230
162 HB2 LYS 17 HB2 LYS 17 44.228 -4.630 -7.682
163 HB3 LYS 17 HB1 LYS 17 43.042 -5.987 -7.764
164 HG2 LYS 17 HG2 LYS 17 41.199 -4.486 -7.082
165 HG3 LYS 17 HG1 LYS 17 42.341 -3.119 -6.850
166 HD2 LYS 17 HD2 LYS 17 42.920 -3.166 -9.266
167 HD3 LYS 17 HD1 LYS 17 41.812 -4.561 -9.530
168 HE2 LYS 17 HE2 LYS 17 39.843 -3.112 -8.835
169 HE3 LYS 17 HE1 LYS 17 40.972 -1.714 -8.602
170 HZ1 LYS 17 HZ1 LYS 17 41.619 -2.202 -11.017
171 HZ2 LYS 17 HZ2 LYS 17 40.139 -1.434 -10.702
172 HZ3 LYS 17 HZ3 LYS 17 40.171 -3.085 -11.095
Start of MODEL 8
1 H1 GLU 1 HT1 GLU 1 51.835 21.941 -21.235
2 H2 GLU 1 HT2 GLU 1 52.791 20.881 -20.315
3 H3 GLU 1 HT3 GLU 1 52.448 22.438 -19.730
4 HA GLU 1 HA GLU 1 50.800 21.568 -18.619
5 HB2 GLU 1 HB2 GLU 1 49.733 21.203 -21.500
6 HB3 GLU 1 HB1 GLU 1 48.708 20.831 -20.064
7 HG2 GLU 1 HG2 GLU 1 48.942 23.215 -19.253
8 HG3 GLU 1 HG1 GLU 1 49.974 23.603 -20.685
9 H MET 2 HN MET 2 50.856 19.754 -17.364
10 HA MET 2 HA MET 2 50.902 17.133 -18.724
11 HB2 MET 2 HB2 MET 2 52.491 17.968 -16.200
12 HB3 MET 2 HB1 MET 2 52.311 16.269 -16.768
13 HG2 MET 2 HG2 MET 2 53.482 16.855 -18.899
14 HG3 MET 2 HG1 MET 2 53.662 18.551 -18.342
15 HE1 MET 2 HE1 MET 2 57.308 17.161 -18.296
16 HE2 MET 2 HE2 MET 2 56.177 18.423 -18.895
17 HE3 MET 2 HE3 MET 2 55.978 16.715 -19.420
18 H ARG 3 HN ARG 3 49.817 15.421 -17.523
19 HA ARG 3 HA ARG 3 48.027 16.408 -15.389
20 HB2 ARG 3 HB2 ARG 3 47.353 14.478 -17.711
21 HB3 ARG 3 HB1 ARG 3 46.296 14.744 -16.276
22 HG2 ARG 3 HG2 ARG 3 45.983 17.133 -16.900
23 HG3 ARG 3 HG1 ARG 3 47.122 16.955 -18.275
24 HD2 ARG 3 HD2 ARG 3 44.794 16.887 -19.134
25 HD3 ARG 3 HD1 ARG 3 45.528 15.232 -19.320
26 HE ARG 3 HE ARG 3 44.141 15.446 -16.758
27 HH11 ARG 3 HH11 ARG 3 43.465 15.142 -20.292
28 HH12 ARG 3 HH12 ARG 3 41.975 14.290 -20.062
29 HH21 ARG 3 HH21 ARG 3 42.133 14.287 -16.511
30 HH22 ARG 3 HH22 ARG 3 41.214 13.802 -17.896
31 H LEU 4 HN LEU 4 47.586 14.894 -13.713
32 HA LEU 4 HA LEU 4 49.139 12.400 -13.815
33 HB2 LEU 4 HB2 LEU 4 48.939 14.419 -11.487
34 HB3 LEU 4 HB1 LEU 4 49.523 12.735 -11.257
35 HG LEU 4 HG LEU 4 50.876 14.757 -13.157
36 HD11 LEU 4 HD11 LEU 4 51.658 14.068 -10.241
37 HD12 LEU 4 HD12 LEU 4 50.957 15.630 -10.815
38 HD13 LEU 4 HD13 LEU 4 52.593 15.118 -11.375
39 HD21 LEU 4 HD21 LEU 4 51.746 11.979 -12.093
40 HD22 LEU 4 HD22 LEU 4 52.902 13.154 -12.828
41 HD23 LEU 4 HD23 LEU 4 51.541 12.503 -13.809
42 H SER 5 HN SER 5 46.237 13.061 -14.435
43 HA SER 5 HA SER 5 44.816 12.131 -12.097
44 HB2 SER 5 HB2 SER 5 43.837 12.841 -14.937
45 HB3 SER 5 HB1 SER 5 42.739 12.327 -13.589
46 HG SER 5 HG SER 5 44.510 14.551 -13.589
47 H LYS 6 HN LYS 6 45.759 10.797 -15.342
48 HA LYS 6 HA LYS 6 44.290 8.322 -14.848
49 HB2 LYS 6 HB2 LYS 6 46.202 9.177 -17.113
50 HB3 LYS 6 HB1 LYS 6 45.377 7.573 -17.036
51 HG2 LYS 6 HG2 LYS 6 43.135 8.784 -17.015
52 HG3 LYS 6 HG1 LYS 6 44.014 10.340 -17.232
53 HD2 LYS 6 HD2 LYS 6 44.964 9.516 -19.398
54 HD3 LYS 6 HD1 LYS 6 44.143 7.938 -19.167
55 HE2 LYS 6 HE2 LYS 6 42.797 9.226 -20.752
56 HE3 LYS 6 HE1 LYS 6 41.880 9.211 -19.193
57 HZ1 LYS 6 HZ1 LYS 6 42.086 11.379 -20.426
58 HZ2 LYS 6 HZ2 LYS 6 43.714 11.423 -19.945
59 HZ3 LYS 6 HZ3 LYS 6 42.485 11.406 -18.775
60 H PHE 7 HN PHE 7 47.367 9.673 -14.029
61 HA PHE 7 HA PHE 7 49.004 7.343 -14.082
62 HB2 PHE 7 HB2 PHE 7 49.112 10.134 -12.827
63 HB3 PHE 7 HB1 PHE 7 50.303 8.894 -12.270
64 HD1 PHE 7 HD1 PHE 7 49.055 10.651 -15.406
65 HD2 PHE 7 HD2 PHE 7 52.285 8.574 -13.513
66 HE1 PHE 7 HE1 PHE 7 50.530 11.216 -17.262
67 HE2 PHE 7 HE2 PHE 7 53.728 9.160 -15.389
68 HZ PHE 7 HZ PHE 7 52.860 10.475 -17.261
69 H PHE 8 HN PHE 8 46.832 8.974 -11.864
70 HA PHE 8 HA PHE 8 47.690 7.413 -9.599
71 HB2 PHE 8 HB2 PHE 8 46.552 10.034 -10.239
72 HB3 PHE 8 HB1 PHE 8 45.508 9.182 -9.045
73 HD1 PHE 8 HD1 PHE 8 49.218 9.150 -9.590
74 HD2 PHE 8 HD2 PHE 8 46.021 10.142 -6.913
75 HE1 PHE 8 HE1 PHE 8 50.823 9.992 -7.991
76 HE2 PHE 8 HE2 PHE 8 47.672 10.932 -5.269
77 HZ PHE 8 HZ PHE 8 50.074 10.866 -5.799
78 H ARG 9 HN ARG 9 45.381 7.374 -12.072
79 HA ARG 9 HA ARG 9 43.443 5.922 -10.536
80 HB2 ARG 9 HB2 ARG 9 42.956 7.520 -12.485
81 HB3 ARG 9 HB1 ARG 9 43.806 6.383 -13.577
82 HG2 ARG 9 HG2 ARG 9 42.119 4.654 -13.158
83 HG3 ARG 9 HG1 ARG 9 41.313 5.683 -11.929
84 HD2 ARG 9 HD2 ARG 9 39.994 5.928 -13.940
85 HD3 ARG 9 HD1 ARG 9 41.000 7.439 -13.824
86 HE ARG 9 HE ARG 9 42.433 5.460 -15.386
87 HH11 ARG 9 HH11 ARG 9 39.578 7.652 -15.637
88 HH12 ARG 9 HH12 ARG 9 39.665 7.778 -17.362
89 HH21 ARG 9 HH21 ARG 9 42.505 5.668 -17.708
90 HH22 ARG 9 HH22 ARG 9 41.343 6.641 -18.546
91 H ASP 10 HN ASP 10 46.239 5.361 -12.687
92 HA ASP 10 HA ASP 10 45.585 2.518 -12.710
93 HB2 ASP 10 HB2 ASP 10 48.023 4.041 -13.842
94 HB3 ASP 10 HB1 ASP 10 47.773 2.265 -14.032
95 H PHE 11 HN PHE 11 47.630 4.719 -10.791
96 HA PHE 11 HA PHE 11 49.111 2.505 -9.816
97 HB2 PHE 11 HB2 PHE 11 50.772 3.997 -9.506
98 HB3 PHE 11 HB1 PHE 11 49.637 5.296 -9.978
99 HD1 PHE 11 HD1 PHE 11 50.798 3.362 -6.875
100 HD2 PHE 11 HD2 PHE 11 48.924 6.762 -8.566
101 HE1 PHE 11 HE1 PHE 11 50.489 4.347 -4.656
102 HE2 PHE 11 HE2 PHE 11 48.653 7.713 -6.410
103 HZ PHE 11 HZ PHE 11 49.365 6.543 -4.427
104 H ILE 12 HN ILE 12 46.581 4.538 -8.386
105 HA ILE 12 HA ILE 12 46.826 3.363 -5.845
106 HB ILE 12 HB ILE 12 44.647 4.794 -7.348
107 HG12 ILE 12 HG12 ILE 12 46.475 5.629 -5.043
108 HG13 ILE 12 HG11 ILE 12 46.738 5.887 -6.800
109 HG21 ILE 12 HG21 ILE 12 44.551 3.755 -4.391
110 HG22 ILE 12 HG22 ILE 12 43.342 3.440 -5.690
111 HG23 ILE 12 HG23 ILE 12 43.486 5.082 -4.984
112 HD11 ILE 12 HD11 ILE 12 45.903 7.898 -5.725
113 HD12 ILE 12 HD12 ILE 12 44.398 7.043 -5.216
114 HD13 ILE 12 HD13 ILE 12 44.742 7.281 -6.981
115 H LEU 13 HN LEU 13 45.038 2.529 -8.782
116 HA LEU 13 HA LEU 13 43.208 0.786 -7.466
117 HB2 LEU 13 HB2 LEU 13 44.006 1.437 -10.288
118 HB3 LEU 13 HB1 LEU 13 42.837 0.105 -9.991
119 HG LEU 13 HG LEU 13 41.881 2.363 -10.591
120 HD11 LEU 13 HD11 LEU 13 40.498 0.569 -9.500
121 HD12 LEU 13 HD12 LEU 13 39.902 2.233 -9.148
122 HD13 LEU 13 HD13 LEU 13 40.826 1.324 -7.893
123 HD21 LEU 13 HD21 LEU 13 41.690 4.269 -9.141
124 HD22 LEU 13 HD22 LEU 13 43.439 3.828 -9.121
125 HD23 LEU 13 HD23 LEU 13 42.377 3.392 -7.724
126 H GLN 14 HN GLN 14 46.319 0.191 -9.212
127 HA GLN 14 HA GLN 14 45.943 -2.654 -9.255
128 HB2 GLN 14 HB2 GLN 14 48.475 -0.962 -9.685
129 HB3 GLN 14 HB1 GLN 14 48.427 -2.758 -9.883
130 HG2 GLN 14 HG2 GLN 14 46.609 -2.471 -11.659
131 HG3 GLN 14 HG1 GLN 14 46.803 -0.681 -11.514
132 HE21 GLN 14 HE21 GLN 14 48.948 0.295 -12.175
133 HE22 GLN 14 HE22 GLN 14 49.992 -0.567 -13.254
134 H ARG 15 HN ARG 15 46.820 -0.593 -6.559
135 HA ARG 15 HA ARG 15 48.496 -2.653 -5.329
136 HB2 ARG 15 HB2 ARG 15 47.665 0.130 -4.377
137 HB3 ARG 15 HB1 ARG 15 48.672 -1.013 -3.404
138 HG2 ARG 15 HG2 ARG 15 50.308 -1.098 -5.389
139 HG3 ARG 15 HG1 ARG 15 49.360 0.238 -6.130
140 HD2 ARG 15 HD2 ARG 15 49.796 1.653 -4.063
141 HD3 ARG 15 HD1 ARG 15 50.823 0.296 -3.415
142 HE ARG 15 HE ARG 15 51.739 0.962 -6.072
143 HH11 ARG 15 HH11 ARG 15 51.679 2.378 -2.753
144 HH12 ARG 15 HH12 ARG 15 53.089 3.352 -3.003
145 HH21 ARG 15 HH21 ARG 15 53.629 2.307 -6.358
146 HH22 ARG 15 HH22 ARG 15 54.203 3.311 -5.069
147 H LYS 16 HN LYS 16 45.225 -2.208 -5.765
148 HA LYS 16 HA LYS 16 44.495 -3.220 -3.099
149 HB2 LYS 16 HB2 LYS 16 42.795 -1.884 -5.270
150 HB3 LYS 16 HB1 LYS 16 42.161 -2.558 -3.716
151 HG2 LYS 16 HG2 LYS 16 43.646 -0.951 -2.442
152 HG3 LYS 16 HG1 LYS 16 44.200 -0.249 -4.004
153 HD2 LYS 16 HD2 LYS 16 41.837 0.359 -4.552
154 HD3 LYS 16 HD1 LYS 16 41.316 -0.328 -2.974
155 HE2 LYS 16 HE2 LYS 16 42.693 1.391 -1.751
156 HE3 LYS 16 HE1 LYS 16 43.256 2.071 -3.333
157 HZ1 LYS 16 HZ1 LYS 16 41.371 3.159 -3.579
158 HZ2 LYS 16 HZ2 LYS 16 41.082 2.853 -1.934
159 HZ3 LYS 16 HZ3 LYS 16 40.395 1.848 -3.118
160 H LYS 17 HN LYS 17 45.111 -4.007 -6.423
161 HA LYS 17 HA LYS 17 43.249 -6.245 -6.394
162 HB2 LYS 17 HB2 LYS 17 44.993 -4.947 -8.571
163 HB3 LYS 17 HB1 LYS 17 44.054 -6.463 -8.845
164 HG2 LYS 17 HG2 LYS 17 41.925 -5.302 -8.427
165 HG3 LYS 17 HG1 LYS 17 42.774 -3.794 -7.950
166 HD2 LYS 17 HD2 LYS 17 43.724 -3.592 -10.249
167 HD3 LYS 17 HD1 LYS 17 42.874 -5.100 -10.746
168 HE2 LYS 17 HE2 LYS 17 40.642 -3.984 -10.301
169 HE3 LYS 17 HE1 LYS 17 41.505 -2.472 -9.803
170 HZ1 LYS 17 HZ1 LYS 17 40.642 -2.694 -12.171
171 HZ2 LYS 17 HZ2 LYS 17 41.974 -3.709 -12.450
172 HZ3 LYS 17 HZ3 LYS 17 42.219 -2.107 -11.945
Start of MODEL 9
1 H1 GLU 1 HT1 GLU 1 46.881 20.877 -16.965
2 H2 GLU 1 HT2 GLU 1 47.190 20.969 -15.297
3 H3 GLU 1 HT3 GLU 1 47.589 19.562 -16.158
4 HA GLU 1 HA GLU 1 48.857 21.574 -17.484
5 HB2 GLU 1 HB2 GLU 1 48.956 21.933 -14.427
6 HB3 GLU 1 HB1 GLU 1 50.384 22.389 -15.429
7 HG2 GLU 1 HG2 GLU 1 48.950 23.992 -16.768
8 HG3 GLU 1 HG1 GLU 1 47.521 23.559 -15.748
9 H MET 2 HN MET 2 49.526 19.537 -14.491
10 HA MET 2 HA MET 2 52.021 18.614 -15.513
11 HB2 MET 2 HB2 MET 2 50.231 17.605 -13.208
12 HB3 MET 2 HB1 MET 2 51.856 16.918 -13.571
13 HG2 MET 2 HG2 MET 2 52.852 19.235 -13.248
14 HG3 MET 2 HG1 MET 2 51.235 19.828 -12.755
15 HE1 MET 2 HE1 MET 2 50.510 18.462 -9.308
16 HE2 MET 2 HE2 MET 2 49.852 17.834 -10.857
17 HE3 MET 2 HE3 MET 2 50.129 19.598 -10.648
18 H ARG 3 HN ARG 3 48.653 17.260 -15.383
19 HA ARG 3 HA ARG 3 47.649 15.557 -16.312
20 HB2 ARG 3 HB2 ARG 3 48.589 16.788 -18.449
21 HB3 ARG 3 HB1 ARG 3 49.745 15.426 -18.576
22 HG2 ARG 3 HG2 ARG 3 47.834 13.807 -18.754
23 HG3 ARG 3 HG1 ARG 3 46.658 15.157 -18.562
24 HD2 ARG 3 HD2 ARG 3 47.616 16.212 -20.714
25 HD3 ARG 3 HD1 ARG 3 48.627 14.711 -20.925
26 HE ARG 3 HE ARG 3 45.928 13.848 -20.538
27 HH11 ARG 3 HH11 ARG 3 47.783 15.772 -22.965
28 HH12 ARG 3 HH12 ARG 3 46.750 15.341 -24.287
29 HH21 ARG 3 HH21 ARG 3 44.566 13.304 -22.358
30 HH22 ARG 3 HH22 ARG 3 44.907 13.929 -23.937
31 H LEU 4 HN LEU 4 48.192 14.249 -14.402
32 HA LEU 4 HA LEU 4 49.675 11.869 -15.162
33 HB2 LEU 4 HB2 LEU 4 51.060 13.830 -13.679
34 HB3 LEU 4 HB1 LEU 4 50.349 12.843 -12.368
35 HG LEU 4 HG LEU 4 51.375 10.778 -13.712
36 HD11 LEU 4 HD11 LEU 4 52.095 11.950 -15.772
37 HD12 LEU 4 HD12 LEU 4 53.533 11.297 -14.908
38 HD13 LEU 4 HD13 LEU 4 53.147 13.057 -14.811
39 HD21 LEU 4 HD21 LEU 4 52.084 11.472 -11.421
40 HD22 LEU 4 HD22 LEU 4 53.214 12.687 -12.128
41 HD23 LEU 4 HD23 LEU 4 53.490 10.926 -12.408
42 H SER 5 HN SER 5 46.800 12.824 -14.648
43 HA SER 5 HA SER 5 46.131 11.559 -12.129
44 HB2 SER 5 HB2 SER 5 44.347 12.829 -14.312
45 HB3 SER 5 HB1 SER 5 43.731 12.174 -12.738
46 HG SER 5 HG SER 5 45.854 13.969 -12.647
47 H LYS 6 HN LYS 6 46.339 10.581 -15.540
48 HA LYS 6 HA LYS 6 44.455 8.372 -15.193
49 HB2 LYS 6 HB2 LYS 6 46.319 9.139 -17.532
50 HB3 LYS 6 HB1 LYS 6 45.159 7.756 -17.558
51 HG2 LYS 6 HG2 LYS 6 43.250 9.364 -17.208
52 HG3 LYS 6 HG1 LYS 6 44.410 10.739 -17.225
53 HD2 LYS 6 HD2 LYS 6 45.089 10.130 -19.566
54 HD3 LYS 6 HD1 LYS 6 43.923 8.760 -19.541
55 HE2 LYS 6 HE2 LYS 6 42.007 10.386 -19.278
56 HE3 LYS 6 HE1 LYS 6 43.182 11.767 -19.291
57 HZ1 LYS 6 HZ1 LYS 6 43.658 10.110 -21.514
58 HZ2 LYS 6 HZ2 LYS 6 43.130 11.723 -21.464
59 HZ3 LYS 6 HZ3 LYS 6 41.998 10.457 -21.445
60 H PHE 7 HN PHE 7 47.824 9.062 -14.649
61 HA PHE 7 HA PHE 7 48.939 6.458 -15.041
62 HB2 PHE 7 HB2 PHE 7 49.781 9.068 -13.661
63 HB3 PHE 7 HB1 PHE 7 50.757 7.573 -13.379
64 HD1 PHE 7 HD1 PHE 7 49.479 9.844 -16.143
65 HD2 PHE 7 HD2 PHE 7 52.430 6.989 -14.949
66 HE1 PHE 7 HE1 PHE 7 50.762 10.308 -18.161
67 HE2 PHE 7 HE2 PHE 7 53.686 7.475 -16.983
68 HZ PHE 7 HZ PHE 7 52.860 9.127 -18.587
69 H PHE 8 HN PHE 8 47.368 8.320 -12.562
70 HA PHE 8 HA PHE 8 48.134 6.543 -10.433
71 HB2 PHE 8 HB2 PHE 8 47.430 9.352 -10.905
72 HB3 PHE 8 HB1 PHE 8 46.345 8.646 -9.645
73 HD1 PHE 8 HD1 PHE 8 49.931 8.000 -10.524
74 HD2 PHE 8 HD2 PHE 8 47.198 9.386 -7.528
75 HE1 PHE 8 HE1 PHE 8 51.787 8.465 -9.057
76 HE2 PHE 8 HE2 PHE 8 49.100 9.796 -6.020
77 HZ PHE 8 HZ PHE 8 51.396 9.341 -6.775
78 H ARG 9 HN ARG 9 45.655 6.989 -12.712
79 HA ARG 9 HA ARG 9 43.654 5.760 -11.068
80 HB2 ARG 9 HB2 ARG 9 43.389 7.454 -13.134
81 HB3 ARG 9 HB1 ARG 9 43.650 5.998 -14.146
82 HG2 ARG 9 HG2 ARG 9 41.713 5.050 -12.458
83 HG3 ARG 9 HG1 ARG 9 41.316 6.803 -12.417
84 HD2 ARG 9 HD2 ARG 9 41.611 5.115 -14.986
85 HD3 ARG 9 HD1 ARG 9 40.032 5.501 -14.174
86 HE ARG 9 HE ARG 9 41.307 8.006 -14.594
87 HH11 ARG 9 HH11 ARG 9 40.164 5.303 -16.700
88 HH12 ARG 9 HH12 ARG 9 39.843 6.329 -18.057
89 HH21 ARG 9 HH21 ARG 9 40.860 9.334 -16.464
90 HH22 ARG 9 HH22 ARG 9 40.243 8.633 -17.921
91 H ASP 10 HN ASP 10 46.272 4.857 -13.335
92 HA ASP 10 HA ASP 10 45.074 2.202 -13.475
93 HB2 ASP 10 HB2 ASP 10 47.677 3.312 -14.721
94 HB3 ASP 10 HB1 ASP 10 47.080 1.629 -14.972
95 H PHE 11 HN PHE 11 47.573 3.933 -11.640
96 HA PHE 11 HA PHE 11 48.740 1.478 -10.832
97 HB2 PHE 11 HB2 PHE 11 50.629 2.690 -10.604
98 HB3 PHE 11 HB1 PHE 11 49.677 4.163 -10.960
99 HD1 PHE 11 HD1 PHE 11 50.745 1.965 -8.001
100 HD2 PHE 11 HD2 PHE 11 49.280 5.661 -9.465
101 HE1 PHE 11 HE1 PHE 11 50.737 2.904 -5.740
102 HE2 PHE 11 HE2 PHE 11 49.302 6.562 -7.277
103 HZ PHE 11 HZ PHE 11 49.963 5.233 -5.377
104 H ILE 12 HN ILE 12 46.651 3.825 -9.185
105 HA ILE 12 HA ILE 12 46.858 2.533 -6.695
106 HB ILE 12 HB ILE 12 44.843 4.337 -8.017
107 HG12 ILE 12 HG12 ILE 12 46.906 4.807 -5.811
108 HG13 ILE 12 HG11 ILE 12 47.117 5.065 -7.576
109 HG21 ILE 12 HG21 ILE 12 44.781 3.232 -5.078
110 HG22 ILE 12 HG22 ILE 12 43.454 3.132 -6.295
111 HG23 ILE 12 HG23 ILE 12 43.886 4.716 -5.575
112 HD11 ILE 12 HD11 ILE 12 46.659 7.156 -6.462
113 HD12 ILE 12 HD12 ILE 12 45.093 6.529 -5.823
114 HD13 ILE 12 HD13 ILE 12 45.316 6.734 -7.612
115 H LEU 13 HN LEU 13 44.791 2.101 -9.543
116 HA LEU 13 HA LEU 13 42.806 0.586 -8.164
117 HB2 LEU 13 HB2 LEU 13 43.522 1.243 -11.011
118 HB3 LEU 13 HB1 LEU 13 42.186 0.086 -10.683
119 HG LEU 13 HG LEU 13 41.531 2.480 -11.134
120 HD11 LEU 13 HD11 LEU 13 40.530 1.566 -8.371
121 HD12 LEU 13 HD12 LEU 13 40.014 0.825 -9.935
122 HD13 LEU 13 HD13 LEU 13 39.651 2.557 -9.595
123 HD21 LEU 13 HD21 LEU 13 43.405 3.632 -9.748
124 HD22 LEU 13 HD22 LEU 13 42.385 3.313 -8.288
125 HD23 LEU 13 HD23 LEU 13 41.746 4.334 -9.627
126 H GLN 14 HN GLN 14 45.644 -0.324 -10.196
127 HA GLN 14 HA GLN 14 44.989 -3.076 -10.346
128 HB2 GLN 14 HB2 GLN 14 47.667 -1.612 -10.668
129 HB3 GLN 14 HB1 GLN 14 47.503 -3.397 -10.897
130 HG2 GLN 14 HG2 GLN 14 45.883 -3.063 -12.757
131 HG3 GLN 14 HG1 GLN 14 45.887 -1.279 -12.476
132 HE21 GLN 14 HE21 GLN 14 46.655 -0.983 -14.765
133 HE22 GLN 14 HE22 GLN 14 48.318 -1.247 -15.160
134 H ARG 15 HN ARG 15 46.928 -1.212 -7.907
135 HA ARG 15 HA ARG 15 47.936 -3.519 -6.589
136 HB2 ARG 15 HB2 ARG 15 47.613 -0.635 -5.651
137 HB3 ARG 15 HB1 ARG 15 48.384 -1.924 -4.650
138 HG2 ARG 15 HG2 ARG 15 50.040 -2.303 -6.585
139 HG3 ARG 15 HG1 ARG 15 49.341 -0.843 -7.375
140 HD2 ARG 15 HD2 ARG 15 49.927 0.507 -5.291
141 HD3 ARG 15 HD1 ARG 15 50.728 -0.984 -4.625
142 HE ARG 15 HE ARG 15 51.793 -0.463 -7.260
143 HH11 ARG 15 HH11 ARG 15 51.868 0.940 -3.935
144 HH12 ARG 15 HH12 ARG 15 53.402 1.714 -4.155
145 HH21 ARG 15 HH21 ARG 15 53.853 0.618 -7.506
146 HH22 ARG 15 HH22 ARG 15 54.535 1.529 -6.201
147 H LYS 16 HN LYS 16 45.097 -1.450 -6.164
148 HA LYS 16 HA LYS 16 43.139 -1.652 -5.308
149 HB2 LYS 16 HB2 LYS 16 43.905 -4.445 -4.380
150 HB3 LYS 16 HB1 LYS 16 42.292 -3.699 -4.117
151 HG2 LYS 16 HG2 LYS 16 42.079 -3.416 -6.643
152 HG3 LYS 16 HG1 LYS 16 43.626 -4.322 -6.827
153 HD2 LYS 16 HD2 LYS 16 42.604 -6.278 -5.640
154 HD3 LYS 16 HD1 LYS 16 41.072 -5.352 -5.475
155 HE2 LYS 16 HE2 LYS 16 40.830 -5.281 -7.987
156 HE3 LYS 16 HE1 LYS 16 42.381 -6.204 -8.160
157 HZ1 LYS 16 HZ1 LYS 16 40.179 -7.276 -6.509
158 HZ2 LYS 16 HZ2 LYS 16 41.426 -8.088 -7.326
159 HZ3 LYS 16 HZ3 LYS 16 40.134 -7.418 -8.200
160 H LYS 17 HN LYS 17 45.939 -1.057 -3.999
161 HA LYS 17 HA LYS 17 44.891 -0.707 -1.314
162 HB2 LYS 17 HB2 LYS 17 47.768 -1.090 -2.344
163 HB3 LYS 17 HB1 LYS 17 47.376 -0.639 -0.642
164 HG2 LYS 17 HG2 LYS 17 46.214 -2.767 -0.265
165 HG3 LYS 17 HG1 LYS 17 46.343 -3.221 -1.999
166 HD2 LYS 17 HD2 LYS 17 48.820 -3.271 -1.816
167 HD3 LYS 17 HD1 LYS 17 48.721 -2.817 -0.075
168 HE2 LYS 17 HE2 LYS 17 47.479 -4.965 0.419
169 HE3 LYS 17 HE1 LYS 17 47.564 -5.415 -1.335
170 HZ1 LYS 17 HZ1 LYS 17 50.103 -4.722 -0.130
171 HZ2 LYS 17 HZ2 LYS 17 49.666 -6.027 -1.125
172 HZ3 LYS 17 HZ3 LYS 17 49.352 -6.090 0.543
Start of MODEL 10
1 H1 GLU 1 HT1 GLU 1 52.301 22.296 -18.680
2 H2 GLU 1 HT2 GLU 1 51.702 23.596 -17.765
3 H3 GLU 1 HT3 GLU 1 51.282 23.447 -19.404
4 HA GLU 1 HA GLU 1 50.162 22.213 -17.081
5 HB2 GLU 1 HB2 GLU 1 49.268 22.770 -19.986
6 HB3 GLU 1 HB1 GLU 1 48.234 21.793 -18.877
7 HG2 GLU 1 HG2 GLU 1 48.125 23.727 -17.248
8 HG3 GLU 1 HG1 GLU 1 49.152 24.719 -18.357
9 H MET 2 HN MET 2 50.444 20.114 -16.466
10 HA MET 2 HA MET 2 50.729 18.080 -18.585
11 HB2 MET 2 HB2 MET 2 52.276 18.221 -15.903
12 HB3 MET 2 HB1 MET 2 52.247 16.778 -16.981
13 HG2 MET 2 HG2 MET 2 53.323 18.113 -18.802
14 HG3 MET 2 HG1 MET 2 53.353 19.556 -17.735
15 HE1 MET 2 HE1 MET 2 57.114 18.560 -18.078
16 HE2 MET 2 HE2 MET 2 55.865 19.840 -18.263
17 HE3 MET 2 HE3 MET 2 55.813 18.375 -19.304
18 H ARG 3 HN ARG 3 49.880 15.951 -17.960
19 HA ARG 3 HA ARG 3 47.844 16.153 -15.822
20 HB2 ARG 3 HB2 ARG 3 47.873 14.390 -18.367
21 HB3 ARG 3 HB1 ARG 3 46.614 14.324 -17.078
22 HG2 ARG 3 HG2 ARG 3 46.004 16.721 -17.571
23 HG3 ARG 3 HG1 ARG 3 47.235 16.755 -18.884
24 HD2 ARG 3 HD2 ARG 3 45.980 14.885 -20.081
25 HD3 ARG 3 HD1 ARG 3 44.711 14.944 -18.775
26 HE ARG 3 HE ARG 3 45.093 17.614 -19.821
27 HH11 ARG 3 HH11 ARG 3 43.736 14.424 -20.826
28 HH12 ARG 3 HH12 ARG 3 42.619 15.110 -21.958
29 HH21 ARG 3 HH21 ARG 3 43.567 18.484 -21.367
30 HH22 ARG 3 HH22 ARG 3 42.525 17.436 -22.267
31 H LEU 4 HN LEU 4 47.697 14.416 -14.316
32 HA LEU 4 HA LEU 4 49.467 12.157 -14.631
33 HB2 LEU 4 HB2 LEU 4 50.597 14.341 -13.315
34 HB3 LEU 4 HB1 LEU 4 49.759 13.559 -11.942
35 HG LEU 4 HG LEU 4 50.995 11.349 -12.727
36 HD11 LEU 4 HD11 LEU 4 51.879 12.074 -14.915
37 HD12 LEU 4 HD12 LEU 4 53.256 11.729 -13.808
38 HD13 LEU 4 HD13 LEU 4 52.778 13.436 -14.147
39 HD21 LEU 4 HD21 LEU 4 52.982 11.866 -11.316
40 HD22 LEU 4 HD22 LEU 4 51.473 12.524 -10.583
41 HD23 LEU 4 HD23 LEU 4 52.620 13.632 -11.428
42 H SER 5 HN SER 5 46.472 13.103 -14.355
43 HA SER 5 HA SER 5 45.715 11.854 -11.848
44 HB2 SER 5 HB2 SER 5 44.008 13.031 -14.142
45 HB3 SER 5 HB1 SER 5 43.328 12.373 -12.596
46 HG SER 5 HG SER 5 45.372 14.278 -12.484
47 H LYS 6 HN LYS 6 46.080 10.912 -15.251
48 HA LYS 6 HA LYS 6 44.336 8.579 -14.986
49 HB2 LYS 6 HB2 LYS 6 46.189 9.523 -17.269
50 HB3 LYS 6 HB1 LYS 6 45.098 8.087 -17.353
51 HG2 LYS 6 HG2 LYS 6 43.106 9.586 -16.984
52 HG3 LYS 6 HG1 LYS 6 44.195 11.018 -16.926
53 HD2 LYS 6 HD2 LYS 6 44.938 10.538 -19.278
54 HD3 LYS 6 HD1 LYS 6 43.835 9.117 -19.329
55 HE2 LYS 6 HE2 LYS 6 41.844 10.643 -19.022
56 HE3 LYS 6 HE1 LYS 6 42.954 12.074 -18.955
57 HZ1 LYS 6 HZ1 LYS 6 42.361 10.277 -21.233
58 HZ2 LYS 6 HZ2 LYS 6 43.745 11.262 -21.207
59 HZ3 LYS 6 HZ3 LYS 6 42.201 11.963 -21.117
60 H PHE 7 HN PHE 7 47.626 9.500 -14.349
61 HA PHE 7 HA PHE 7 48.936 6.983 -14.735
62 HB2 PHE 7 HB2 PHE 7 49.554 9.655 -13.363
63 HB3 PHE 7 HB1 PHE 7 50.613 8.239 -13.004
64 HD1 PHE 7 HD1 PHE 7 49.266 10.263 -15.946
65 HD2 PHE 7 HD2 PHE 7 52.459 7.863 -14.402
66 HE1 PHE 7 HE1 PHE 7 50.628 10.794 -17.892
67 HE2 PHE 7 HE2 PHE 7 53.790 8.417 -16.368
68 HZ PHE 7 HZ PHE 7 52.884 9.877 -18.111
69 H PHE 8 HN PHE 8 47.175 8.720 -12.297
70 HA PHE 8 HA PHE 8 48.036 7.033 -10.132
71 HB2 PHE 8 HB2 PHE 8 47.098 9.765 -10.653
72 HB3 PHE 8 HB1 PHE 8 46.073 8.984 -9.395
73 HD1 PHE 8 HD1 PHE 8 49.713 8.601 -10.206
74 HD2 PHE 8 HD2 PHE 8 46.827 9.895 -7.312
75 HE1 PHE 8 HE1 PHE 8 51.501 9.251 -8.722
76 HE2 PHE 8 HE2 PHE 8 48.663 10.491 -5.787
77 HZ PHE 8 HZ PHE 8 51.001 10.177 -6.483
78 H ARG 9 HN ARG 9 45.598 7.243 -12.459
79 HA ARG 9 HA ARG 9 43.652 5.893 -10.835
80 HB2 ARG 9 HB2 ARG 9 43.099 7.605 -12.631
81 HB3 ARG 9 HB1 ARG 9 43.852 6.535 -13.854
82 HG2 ARG 9 HG2 ARG 9 42.136 4.865 -13.560
83 HG3 ARG 9 HG1 ARG 9 41.441 5.725 -12.139
84 HD2 ARG 9 HD2 ARG 9 40.814 7.657 -13.586
85 HD3 ARG 9 HD1 ARG 9 41.556 6.827 -15.028
86 HE ARG 9 HE ARG 9 39.660 5.002 -13.905
87 HH11 ARG 9 HH11 ARG 9 39.631 8.256 -15.467
88 HH12 ARG 9 HH12 ARG 9 38.026 8.084 -16.094
89 HH21 ARG 9 HH21 ARG 9 37.500 4.823 -14.772
90 HH22 ARG 9 HH22 ARG 9 36.805 6.113 -15.693
91 H ASP 10 HN ASP 10 46.358 5.208 -13.071
92 HA ASP 10 HA ASP 10 45.443 2.444 -13.245
93 HB2 ASP 10 HB2 ASP 10 48.038 3.774 -14.270
94 HB3 ASP 10 HB1 ASP 10 47.584 2.059 -14.590
95 H PHE 11 HN PHE 11 47.724 4.375 -11.309
96 HA PHE 11 HA PHE 11 49.005 2.035 -10.358
97 HB2 PHE 11 HB2 PHE 11 50.786 3.385 -10.120
98 HB3 PHE 11 HB1 PHE 11 49.743 4.779 -10.539
99 HD1 PHE 11 HD1 PHE 11 50.843 2.710 -7.495
100 HD2 PHE 11 HD2 PHE 11 49.221 6.282 -9.097
101 HE1 PHE 11 HE1 PHE 11 50.703 3.701 -5.262
102 HE2 PHE 11 HE2 PHE 11 49.116 7.232 -6.930
103 HZ PHE 11 HZ PHE 11 49.788 5.984 -4.981
104 H ILE 12 HN ILE 12 46.693 4.290 -8.870
105 HA ILE 12 HA ILE 12 46.876 3.101 -6.331
106 HB ILE 12 HB ILE 12 44.823 4.751 -7.785
107 HG12 ILE 12 HG12 ILE 12 46.760 5.345 -5.490
108 HG13 ILE 12 HG11 ILE 12 47.040 5.592 -7.245
109 HG21 ILE 12 HG21 ILE 12 44.640 3.659 -4.851
110 HG22 ILE 12 HG22 ILE 12 43.382 3.549 -6.140
111 HG23 ILE 12 HG23 ILE 12 43.745 5.132 -5.381
112 HD11 ILE 12 HD11 ILE 12 44.873 6.995 -5.617
113 HD12 ILE 12 HD12 ILE 12 45.207 7.205 -7.384
114 HD13 ILE 12 HD13 ILE 12 46.459 7.671 -6.144
115 H LEU 13 HN LEU 13 45.012 2.386 -9.244
116 HA LEU 13 HA LEU 13 43.042 0.809 -7.922
117 HB2 LEU 13 HB2 LEU 13 43.971 1.321 -10.737
118 HB3 LEU 13 HB1 LEU 13 42.698 0.083 -10.443
119 HG LEU 13 HG LEU 13 41.980 2.442 -11.104
120 HD11 LEU 13 HD11 LEU 13 39.915 2.466 -9.706
121 HD12 LEU 13 HD12 LEU 13 40.681 1.278 -8.590
122 HD13 LEU 13 HD13 LEU 13 40.345 0.818 -10.297
123 HD21 LEU 13 HD21 LEU 13 41.798 4.319 -9.595
124 HD22 LEU 13 HD22 LEU 13 43.517 3.780 -9.505
125 HD23 LEU 13 HD23 LEU 13 42.360 3.359 -8.176
126 H GLN 14 HN GLN 14 46.243 0.040 -9.273
127 HA GLN 14 HA GLN 14 45.789 -2.822 -9.260
128 HB2 GLN 14 HB2 GLN 14 48.350 -1.139 -9.554
129 HB3 GLN 14 HB1 GLN 14 48.349 -2.945 -9.597
130 HG2 GLN 14 HG2 GLN 14 46.813 -2.907 -11.594
131 HG3 GLN 14 HG1 GLN 14 46.814 -1.104 -11.569
132 HE21 GLN 14 HE21 GLN 14 48.955 0.037 -11.987
133 HE22 GLN 14 HE22 GLN 14 50.192 -0.774 -12.886
134 H ARG 15 HN ARG 15 46.453 -0.517 -6.711
135 HA ARG 15 HA ARG 15 47.826 -2.555 -5.086
136 HB2 ARG 15 HB2 ARG 15 47.523 0.464 -4.665
137 HB3 ARG 15 HB1 ARG 15 48.327 -0.665 -3.504
138 HG2 ARG 15 HG2 ARG 15 49.895 -1.356 -5.441
139 HG3 ARG 15 HG1 ARG 15 49.201 0.015 -6.378
140 HD2 ARG 15 HD2 ARG 15 49.906 1.595 -4.519
141 HD3 ARG 15 HD1 ARG 15 50.683 0.176 -3.682
142 HE ARG 15 HE ARG 15 51.653 0.319 -6.409
143 HH11 ARG 15 HH11 ARG 15 51.942 2.080 -3.274
144 HH12 ARG 15 HH12 ARG 15 53.514 2.715 -3.627
145 HH21 ARG 15 HH21 ARG 15 53.769 1.213 -6.839
146 HH22 ARG 15 HH22 ARG 15 54.558 2.218 -5.671
147 H LYS 16 HN LYS 16 44.833 -2.521 -5.813
148 HA LYS 16 HA LYS 16 43.662 -2.052 -3.155
149 HB2 LYS 16 HB2 LYS 16 42.360 -2.567 -5.878
150 HB3 LYS 16 HB1 LYS 16 41.451 -2.451 -4.321
151 HG2 LYS 16 HG2 LYS 16 42.533 -0.116 -4.007
152 HG3 LYS 16 HG1 LYS 16 43.115 -0.262 -5.703
153 HD2 LYS 16 HD2 LYS 16 40.779 -0.526 -6.501
154 HD3 LYS 16 HD1 LYS 16 40.193 -0.451 -4.802
155 HE2 LYS 16 HE2 LYS 16 41.059 1.919 -4.607
156 HE3 LYS 16 HE1 LYS 16 41.635 1.842 -6.323
157 HZ1 LYS 16 HZ1 LYS 16 39.634 2.394 -6.967
158 HZ2 LYS 16 HZ2 LYS 16 39.107 2.502 -5.357
159 HZ3 LYS 16 HZ3 LYS 16 38.942 1.042 -6.208
160 H LYS 17 HN LYS 17 45.291 -4.419 -4.855
161 HA LYS 17 HA LYS 17 45.629 -6.534 -4.664
162 HB2 LYS 17 HB2 LYS 17 43.706 -6.760 -2.254
163 HB3 LYS 17 HB1 LYS 17 44.971 -7.941 -2.727
164 HG2 LYS 17 HG2 LYS 17 45.529 -5.050 -1.779
165 HG3 LYS 17 HG1 LYS 17 45.536 -6.494 -0.721
166 HD2 LYS 17 HD2 LYS 17 47.425 -7.469 -2.127
167 HD3 LYS 17 HD1 LYS 17 47.449 -5.956 -3.099
168 HE2 LYS 17 HE2 LYS 17 48.022 -4.624 -1.035
169 HE3 LYS 17 HE1 LYS 17 47.998 -6.145 -0.051
170 HZ1 LYS 17 HZ1 LYS 17 49.702 -5.960 -2.451
171 HZ2 LYS 17 HZ2 LYS 17 49.891 -6.893 -1.045
172 HZ3 LYS 17 HZ3 LYS 17 50.190 -5.222 -1.002
Start of MODEL 11
1 H1 GLU 1 HT1 GLU 1 48.882 19.982 -18.729
2 H2 GLU 1 HT2 GLU 1 48.801 21.666 -18.931
3 H3 GLU 1 HT3 GLU 1 47.386 20.731 -19.022
4 HA GLU 1 HA GLU 1 49.084 21.124 -16.648
5 HB2 GLU 1 HB2 GLU 1 47.519 23.073 -17.501
6 HB3 GLU 1 HB1 GLU 1 46.140 22.011 -17.050
7 HG2 GLU 1 HG2 GLU 1 46.990 21.977 -14.637
8 HG3 GLU 1 HG1 GLU 1 48.327 23.096 -15.116
9 H MET 2 HN MET 2 49.114 19.343 -15.307
10 HA MET 2 HA MET 2 48.541 17.547 -14.193
11 HB2 MET 2 HB2 MET 2 45.578 18.284 -14.718
12 HB3 MET 2 HB1 MET 2 46.124 16.996 -13.589
13 HG2 MET 2 HG2 MET 2 47.302 18.674 -12.187
14 HG3 MET 2 HG1 MET 2 46.889 19.975 -13.342
15 HE1 MET 2 HE1 MET 2 44.754 16.919 -11.644
16 HE2 MET 2 HE2 MET 2 44.145 17.862 -10.239
17 HE3 MET 2 HE3 MET 2 45.914 17.669 -10.492
18 H ARG 3 HN ARG 3 49.681 16.553 -16.109
19 HA ARG 3 HA ARG 3 47.885 14.877 -17.758
20 HB2 ARG 3 HB2 ARG 3 50.823 15.749 -18.150
21 HB3 ARG 3 HB1 ARG 3 49.981 14.571 -19.224
22 HG2 ARG 3 HG2 ARG 3 48.319 16.332 -19.865
23 HG3 ARG 3 HG1 ARG 3 49.141 17.513 -18.784
24 HD2 ARG 3 HD2 ARG 3 51.260 17.308 -20.163
25 HD3 ARG 3 HD1 ARG 3 50.407 16.141 -21.273
26 HE ARG 3 HE ARG 3 48.761 18.468 -21.134
27 HH11 ARG 3 HH11 ARG 3 52.108 17.656 -22.230
28 HH12 ARG 3 HH12 ARG 3 52.139 18.879 -23.456
29 HH21 ARG 3 HH21 ARG 3 48.868 20.098 -22.808
30 HH22 ARG 3 HH22 ARG 3 50.287 20.276 -23.786
31 H LEU 4 HN LEU 4 49.532 14.716 -14.844
32 HA LEU 4 HA LEU 4 50.574 12.000 -15.337
33 HB2 LEU 4 HB2 LEU 4 51.236 14.121 -13.204
34 HB3 LEU 4 HB1 LEU 4 51.807 12.419 -13.071
35 HG LEU 4 HG LEU 4 52.458 14.200 -15.510
36 HD11 LEU 4 HD11 LEU 4 54.187 13.812 -12.975
37 HD12 LEU 4 HD12 LEU 4 53.353 15.332 -13.486
38 HD13 LEU 4 HD13 LEU 4 54.691 14.658 -14.491
39 HD21 LEU 4 HD21 LEU 4 52.825 11.868 -16.074
40 HD22 LEU 4 HD22 LEU 4 53.605 11.511 -14.489
41 HD23 LEU 4 HD23 LEU 4 54.455 12.540 -15.708
42 H SER 5 HN SER 5 47.674 13.158 -14.704
43 HA SER 5 HA SER 5 47.140 11.863 -12.166
44 HB2 SER 5 HB2 SER 5 45.230 13.167 -14.230
45 HB3 SER 5 HB1 SER 5 44.719 12.517 -12.615
46 HG SER 5 HG SER 5 46.753 14.454 -12.963
47 H LYS 6 HN LYS 6 47.350 10.934 -15.526
48 HA LYS 6 HA LYS 6 45.392 8.797 -15.371
49 HB2 LYS 6 HB2 LYS 6 47.519 9.496 -17.492
50 HB3 LYS 6 HB1 LYS 6 46.262 8.213 -17.673
51 HG2 LYS 6 HG2 LYS 6 44.458 9.954 -17.471
52 HG3 LYS 6 HG1 LYS 6 45.711 11.232 -17.298
53 HD2 LYS 6 HD2 LYS 6 46.603 10.652 -19.583
54 HD3 LYS 6 HD1 LYS 6 45.331 9.394 -19.744
55 HE2 LYS 6 HE2 LYS 6 44.610 11.409 -20.977
56 HE3 LYS 6 HE1 LYS 6 43.551 11.238 -19.520
57 HZ1 LYS 6 HZ1 LYS 6 44.228 13.483 -19.779
58 HZ2 LYS 6 HZ2 LYS 6 45.874 13.074 -19.860
59 HZ3 LYS 6 HZ3 LYS 6 45.016 12.856 -18.411
60 H PHE 7 HN PHE 7 48.769 9.332 -14.596
61 HA PHE 7 HA PHE 7 49.710 6.641 -14.894
62 HB2 PHE 7 HB2 PHE 7 50.734 9.240 -13.615
63 HB3 PHE 7 HB1 PHE 7 51.567 7.685 -13.209
64 HD1 PHE 7 HD1 PHE 7 50.553 9.850 -16.166
65 HD2 PHE 7 HD2 PHE 7 53.235 6.869 -14.668
66 HE1 PHE 7 HE1 PHE 7 51.902 10.021 -18.193
67 HE2 PHE 7 HE2 PHE 7 54.562 7.073 -16.706
68 HZ PHE 7 HZ PHE 7 53.903 8.642 -18.465
69 H PHE 8 HN PHE 8 48.183 8.668 -12.546
70 HA PHE 8 HA PHE 8 48.766 6.928 -10.334
71 HB2 PHE 8 HB2 PHE 8 48.205 9.748 -10.924
72 HB3 PHE 8 HB1 PHE 8 47.048 9.126 -9.681
73 HD1 PHE 8 HD1 PHE 8 50.631 8.310 -10.429
74 HD2 PHE 8 HD2 PHE 8 47.855 9.876 -7.563
75 HE1 PHE 8 HE1 PHE 8 52.456 8.744 -8.915
76 HE2 PHE 8 HE2 PHE 8 49.722 10.253 -6.001
77 HZ PHE 8 HZ PHE 8 52.024 9.695 -6.670
78 H ARG 9 HN ARG 9 46.439 7.392 -12.746
79 HA ARG 9 HA ARG 9 44.298 6.341 -11.155
80 HB2 ARG 9 HB2 ARG 9 44.326 7.942 -13.399
81 HB3 ARG 9 HB1 ARG 9 44.384 6.367 -14.240
82 HG2 ARG 9 HG2 ARG 9 42.126 6.685 -14.198
83 HG3 ARG 9 HG1 ARG 9 42.317 5.793 -12.649
84 HD2 ARG 9 HD2 ARG 9 42.408 8.095 -11.440
85 HD3 ARG 9 HD1 ARG 9 42.006 8.860 -13.033
86 HE ARG 9 HE ARG 9 39.800 7.898 -12.952
87 HH11 ARG 9 HH11 ARG 9 41.672 7.053 -9.961
88 HH12 ARG 9 HH12 ARG 9 40.299 6.371 -9.153
89 HH21 ARG 9 HH21 ARG 9 38.008 6.963 -11.795
90 HH22 ARG 9 HH22 ARG 9 38.215 6.323 -10.199
91 H ASP 10 HN ASP 10 46.963 5.264 -13.212
92 HA ASP 10 HA ASP 10 45.670 2.662 -13.425
93 HB2 ASP 10 HB2 ASP 10 48.445 3.626 -14.408
94 HB3 ASP 10 HB1 ASP 10 47.784 1.973 -14.713
95 H PHE 11 HN PHE 11 48.282 4.271 -11.594
96 HA PHE 11 HA PHE 11 49.257 1.830 -10.593
97 HB2 PHE 11 HB2 PHE 11 51.175 2.974 -10.377
98 HB3 PHE 11 HB1 PHE 11 50.287 4.471 -10.799
99 HD1 PHE 11 HD1 PHE 11 51.232 2.323 -7.774
100 HD2 PHE 11 HD2 PHE 11 49.895 6.020 -9.356
101 HE1 PHE 11 HE1 PHE 11 51.216 3.329 -5.544
102 HE2 PHE 11 HE2 PHE 11 49.908 6.974 -7.186
103 HZ PHE 11 HZ PHE 11 50.512 5.676 -5.247
104 H ILE 12 HN ILE 12 47.192 4.297 -9.107
105 HA ILE 12 HA ILE 12 47.244 3.060 -6.579
106 HB ILE 12 HB ILE 12 45.391 4.967 -7.989
107 HG12 ILE 12 HG12 ILE 12 47.467 5.298 -5.770
108 HG13 ILE 12 HG11 ILE 12 47.667 5.574 -7.533
109 HG21 ILE 12 HG21 ILE 12 45.164 3.927 -5.036
110 HG22 ILE 12 HG22 ILE 12 43.871 3.895 -6.294
111 HG23 ILE 12 HG23 ILE 12 44.390 5.460 -5.588
112 HD11 ILE 12 HD11 ILE 12 47.385 7.663 -6.322
113 HD12 ILE 12 HD12 ILE 12 45.750 7.143 -5.752
114 HD13 ILE 12 HD13 ILE 12 46.053 7.385 -7.526
115 H LEU 13 HN LEU 13 45.357 2.608 -9.539
116 HA LEU 13 HA LEU 13 43.254 1.193 -8.223
117 HB2 LEU 13 HB2 LEU 13 44.100 1.779 -11.035
118 HB3 LEU 13 HB1 LEU 13 42.700 0.686 -10.736
119 HG LEU 13 HG LEU 13 42.163 3.090 -11.215
120 HD11 LEU 13 HD11 LEU 13 41.062 2.217 -8.479
121 HD12 LEU 13 HD12 LEU 13 40.503 1.582 -10.076
122 HD13 LEU 13 HD13 LEU 13 40.274 3.324 -9.668
123 HD21 LEU 13 HD21 LEU 13 42.976 3.950 -8.373
124 HD22 LEU 13 HD22 LEU 13 42.446 4.961 -9.760
125 HD23 LEU 13 HD23 LEU 13 44.060 4.175 -9.803
126 H GLN 14 HN GLN 14 46.370 0.215 -9.378
127 HA GLN 14 HA GLN 14 45.668 -2.610 -9.616
128 HB2 GLN 14 HB2 GLN 14 48.367 -1.117 -9.684
129 HB3 GLN 14 HB1 GLN 14 48.248 -2.917 -9.779
130 HG2 GLN 14 HG2 GLN 14 46.977 -2.800 -11.888
131 HG3 GLN 14 HG1 GLN 14 46.867 -1.007 -11.797
132 HE21 GLN 14 HE21 GLN 14 48.884 0.290 -12.176
133 HE22 GLN 14 HE22 GLN 14 50.269 -0.421 -12.927
134 H ARG 15 HN ARG 15 46.164 -0.466 -7.004
135 HA ARG 15 HA ARG 15 47.209 -2.572 -5.231
136 HB2 ARG 15 HB2 ARG 15 47.305 0.488 -4.976
137 HB3 ARG 15 HB1 ARG 15 47.816 -0.661 -3.676
138 HG2 ARG 15 HG2 ARG 15 49.450 -1.704 -5.311
139 HG3 ARG 15 HG1 ARG 15 49.035 -0.411 -6.497
140 HD2 ARG 15 HD2 ARG 15 49.783 1.330 -4.819
141 HD3 ARG 15 HD1 ARG 15 50.268 -0.021 -3.697
142 HE ARG 15 HE ARG 15 51.484 -0.428 -6.305
143 HH11 ARG 15 HH11 ARG 15 51.800 1.668 -3.375
144 HH12 ARG 15 HH12 ARG 15 53.472 2.019 -3.659
145 HH21 ARG 15 HH21 ARG 15 53.726 0.093 -6.634
146 HH22 ARG 15 HH22 ARG 15 54.575 1.117 -5.527
147 H LYS 16 HN LYS 16 44.371 -2.324 -6.240
148 HA LYS 16 HA LYS 16 42.981 -1.432 -3.804
149 HB2 LYS 16 HB2 LYS 16 42.052 -1.923 -6.702
150 HB3 LYS 16 HB1 LYS 16 40.877 -1.784 -5.349
151 HG2 LYS 16 HG2 LYS 16 42.940 0.433 -5.861
152 HG3 LYS 16 HG1 LYS 16 41.444 0.327 -6.839
153 HD2 LYS 16 HD2 LYS 16 40.058 0.465 -4.750
154 HD3 LYS 16 HD1 LYS 16 41.553 0.562 -3.754
155 HE2 LYS 16 HE2 LYS 16 42.173 2.733 -4.848
156 HE3 LYS 16 HE1 LYS 16 40.709 2.631 -5.913
157 HZ1 LYS 16 HZ1 LYS 16 39.809 3.811 -4.287
158 HZ2 LYS 16 HZ2 LYS 16 40.955 3.357 -3.122
159 HZ3 LYS 16 HZ3 LYS 16 39.650 2.330 -3.473
160 H LYS 17 HN LYS 17 44.292 -3.467 -3.067
161 HA LYS 17 HA LYS 17 43.233 -5.977 -3.860
162 HB2 LYS 17 HB2 LYS 17 44.888 -5.108 -1.406
163 HB3 LYS 17 HB1 LYS 17 44.537 -6.827 -1.832
164 HG2 LYS 17 HG2 LYS 17 45.735 -6.559 -4.003
165 HG3 LYS 17 HG1 LYS 17 46.062 -4.827 -3.634
166 HD2 LYS 17 HD2 LYS 17 47.375 -5.491 -1.625
167 HD3 LYS 17 HD1 LYS 17 47.054 -7.230 -1.968
168 HE2 LYS 17 HE2 LYS 17 48.302 -7.017 -4.164
169 HE3 LYS 17 HE1 LYS 17 48.626 -5.271 -3.800
170 HZ1 LYS 17 HZ1 LYS 17 49.378 -7.306 -1.814
171 HZ2 LYS 17 HZ2 LYS 17 50.092 -5.807 -2.182
172 HZ3 LYS 17 HZ3 LYS 17 50.320 -7.133 -3.216
Start of MODEL 12
1 H1 GLU 1 HT1 GLU 1 51.908 19.731 -20.440
2 H2 GLU 1 HT2 GLU 1 50.973 20.623 -21.542
3 H3 GLU 1 HT3 GLU 1 51.490 19.056 -21.942
4 HA GLU 1 HA GLU 1 49.105 19.743 -20.884
5 HB2 GLU 1 HB2 GLU 1 50.630 17.050 -20.945
6 HB3 GLU 1 HB1 GLU 1 48.909 17.151 -20.409
7 HG2 GLU 1 HG2 GLU 1 48.233 18.081 -22.651
8 HG3 GLU 1 HG1 GLU 1 49.953 18.033 -23.203
9 H MET 2 HN MET 2 51.471 17.672 -19.008
10 HA MET 2 HA MET 2 51.902 17.407 -16.890
11 HB2 MET 2 HB2 MET 2 51.037 20.343 -16.470
12 HB3 MET 2 HB1 MET 2 51.889 19.342 -15.240
13 HG2 MET 2 HG2 MET 2 53.837 19.089 -16.797
14 HG3 MET 2 HG1 MET 2 52.993 20.100 -18.017
15 HE1 MET 2 HE1 MET 2 55.899 20.615 -17.075
16 HE2 MET 2 HE2 MET 2 55.906 22.403 -16.894
17 HE3 MET 2 HE3 MET 2 55.013 21.644 -18.256
18 H ARG 3 HN ARG 3 49.982 15.866 -17.140
19 HA ARG 3 HA ARG 3 47.952 16.550 -15.095
20 HB2 ARG 3 HB2 ARG 3 47.639 14.766 -17.607
21 HB3 ARG 3 HB1 ARG 3 46.419 14.887 -16.284
22 HG2 ARG 3 HG2 ARG 3 46.153 17.347 -16.774
23 HG3 ARG 3 HG1 ARG 3 47.342 17.198 -18.118
24 HD2 ARG 3 HD2 ARG 3 45.803 15.553 -19.291
25 HD3 ARG 3 HD1 ARG 3 44.596 15.750 -17.942
26 HE ARG 3 HE ARG 3 45.286 18.366 -18.967
27 HH11 ARG 3 HH11 ARG 3 43.492 15.396 -19.958
28 HH12 ARG 3 HH12 ARG 3 42.431 16.240 -21.035
29 HH21 ARG 3 HH21 ARG 3 43.829 19.453 -20.439
30 HH22 ARG 3 HH22 ARG 3 42.626 18.563 -21.310
31 H LEU 4 HN LEU 4 48.000 15.208 -13.321
32 HA LEU 4 HA LEU 4 49.446 12.657 -13.613
33 HB2 LEU 4 HB2 LEU 4 49.467 14.629 -11.241
34 HB3 LEU 4 HB1 LEU 4 50.123 12.959 -11.139
35 HG LEU 4 HG LEU 4 51.178 15.103 -13.098
36 HD11 LEU 4 HD11 LEU 4 52.341 14.281 -10.350
37 HD12 LEU 4 HD12 LEU 4 51.541 15.851 -10.744
38 HD13 LEU 4 HD13 LEU 4 53.102 15.414 -11.535
39 HD21 LEU 4 HD21 LEU 4 53.281 13.520 -13.063
40 HD22 LEU 4 HD22 LEU 4 51.845 12.960 -13.990
41 HD23 LEU 4 HD23 LEU 4 52.184 12.273 -12.356
42 H SER 5 HN SER 5 46.433 13.607 -13.721
43 HA SER 5 HA SER 5 45.375 12.323 -11.347
44 HB2 SER 5 HB2 SER 5 43.962 13.488 -13.840
45 HB3 SER 5 HB1 SER 5 43.097 12.809 -12.400
46 HG SER 5 HG SER 5 45.067 14.801 -12.114
47 H LYS 6 HN LYS 6 46.128 11.469 -14.718
48 HA LYS 6 HA LYS 6 44.482 9.056 -14.649
49 HB2 LYS 6 HB2 LYS 6 46.439 10.165 -16.762
50 HB3 LYS 6 HB1 LYS 6 45.464 8.658 -16.961
51 HG2 LYS 6 HG2 LYS 6 43.347 10.004 -16.697
52 HG3 LYS 6 HG1 LYS 6 44.325 11.504 -16.537
53 HD2 LYS 6 HD2 LYS 6 45.249 11.143 -18.842
54 HD3 LYS 6 HD1 LYS 6 44.264 9.644 -18.996
55 HE2 LYS 6 HE2 LYS 6 42.146 11.007 -18.783
56 HE3 LYS 6 HE1 LYS 6 43.135 12.515 -18.616
57 HZ1 LYS 6 HZ1 LYS 6 42.354 11.100 -20.944
58 HZ2 LYS 6 HZ2 LYS 6 44.046 11.238 -20.885
59 HZ3 LYS 6 HZ3 LYS 6 43.078 12.629 -20.787
60 H PHE 7 HN PHE 7 47.652 10.096 -13.680
61 HA PHE 7 HA PHE 7 49.124 7.671 -14.045
62 HB2 PHE 7 HB2 PHE 7 49.455 10.299 -12.521
63 HB3 PHE 7 HB1 PHE 7 50.492 8.913 -12.014
64 HD1 PHE 7 HD1 PHE 7 49.528 10.886 -15.140
65 HD2 PHE 7 HD2 PHE 7 52.550 8.646 -13.092
66 HE1 PHE 7 HE1 PHE 7 51.151 11.464 -16.862
67 HE2 PHE 7 HE2 PHE 7 54.142 9.248 -14.835
68 HZ PHE 7 HZ PHE 7 53.453 10.651 -16.717
69 H PHE 8 HN PHE 8 47.024 9.160 -11.716
70 HA PHE 8 HA PHE 8 47.731 7.370 -9.580
71 HB2 PHE 8 HB2 PHE 8 46.709 10.085 -10.036
72 HB3 PHE 8 HB1 PHE 8 45.589 9.173 -8.959
73 HD1 PHE 8 HD1 PHE 8 49.312 9.033 -9.363
74 HD2 PHE 8 HD2 PHE 8 46.047 9.954 -6.741
75 HE1 PHE 8 HE1 PHE 8 50.880 9.660 -7.639
76 HE2 PHE 8 HE2 PHE 8 47.660 10.529 -4.976
77 HZ PHE 8 HZ PHE 8 50.077 10.388 -5.415
78 H ARG 9 HN ARG 9 45.544 7.633 -12.145
79 HA ARG 9 HA ARG 9 43.503 6.087 -10.850
80 HB2 ARG 9 HB2 ARG 9 43.239 7.903 -12.712
81 HB3 ARG 9 HB1 ARG 9 43.961 6.716 -13.842
82 HG2 ARG 9 HG2 ARG 9 42.097 5.131 -13.327
83 HG3 ARG 9 HG1 ARG 9 41.368 6.357 -12.236
84 HD2 ARG 9 HD2 ARG 9 41.900 6.761 -15.246
85 HD3 ARG 9 HD1 ARG 9 40.295 6.310 -14.526
86 HE ARG 9 HE ARG 9 41.083 8.663 -13.164
87 HH11 ARG 9 HH11 ARG 9 40.453 7.784 -16.612
88 HH12 ARG 9 HH12 ARG 9 39.982 9.388 -17.065
89 HH21 ARG 9 HH21 ARG 9 40.452 10.806 -13.843
90 HH22 ARG 9 HH22 ARG 9 39.984 11.115 -15.481
91 H ASP 10 HN ASP 10 46.474 5.647 -12.781
92 HA ASP 10 HA ASP 10 45.715 2.868 -13.215
93 HB2 ASP 10 HB2 ASP 10 48.346 4.363 -13.856
94 HB3 ASP 10 HB1 ASP 10 48.008 2.655 -14.328
95 H PHE 11 HN PHE 11 47.765 4.790 -10.989
96 HA PHE 11 HA PHE 11 49.059 2.478 -10.014
97 HB2 PHE 11 HB2 PHE 11 50.700 3.921 -9.484
98 HB3 PHE 11 HB1 PHE 11 49.609 5.271 -9.927
99 HD1 PHE 11 HD1 PHE 11 50.522 3.066 -6.912
100 HD2 PHE 11 HD2 PHE 11 48.818 6.621 -8.460
101 HE1 PHE 11 HE1 PHE 11 50.055 3.882 -4.652
102 HE2 PHE 11 HE2 PHE 11 48.398 7.403 -6.269
103 HZ PHE 11 HZ PHE 11 48.937 6.071 -4.336
104 H ILE 12 HN ILE 12 46.452 4.467 -8.642
105 HA ILE 12 HA ILE 12 46.431 3.094 -6.195
106 HB ILE 12 HB ILE 12 44.427 4.695 -7.771
107 HG12 ILE 12 HG12 ILE 12 46.035 5.298 -5.239
108 HG13 ILE 12 HG11 ILE 12 46.498 5.666 -6.935
109 HG21 ILE 12 HG21 ILE 12 44.047 3.442 -4.915
110 HG22 ILE 12 HG22 ILE 12 42.955 3.240 -6.336
111 HG23 ILE 12 HG23 ILE 12 43.056 4.827 -5.508
112 HD11 ILE 12 HD11 ILE 12 45.609 7.633 -5.846
113 HD12 ILE 12 HD12 ILE 12 44.047 6.796 -5.505
114 HD13 ILE 12 HD13 ILE 12 44.537 7.120 -7.221
115 H LEU 13 HN LEU 13 44.974 2.509 -9.367
116 HA LEU 13 HA LEU 13 43.064 0.620 -8.384
117 HB2 LEU 13 HB2 LEU 13 44.081 1.579 -11.041
118 HB3 LEU 13 HB1 LEU 13 42.923 0.205 -10.984
119 HG LEU 13 HG LEU 13 41.967 2.498 -11.410
120 HD11 LEU 13 HD11 LEU 13 40.550 0.566 -10.620
121 HD12 LEU 13 HD12 LEU 13 39.879 2.180 -10.182
122 HD13 LEU 13 HD13 LEU 13 40.714 1.183 -8.931
123 HD21 LEU 13 HD21 LEU 13 43.367 3.827 -9.683
124 HD22 LEU 13 HD22 LEU 13 42.211 3.226 -8.426
125 HD23 LEU 13 HD23 LEU 13 41.611 4.233 -9.790
126 H GLN 14 HN GLN 14 46.429 0.368 -9.336
127 HA GLN 14 HA GLN 14 46.315 -2.511 -9.784
128 HB2 GLN 14 HB2 GLN 14 48.619 -0.487 -9.636
129 HB3 GLN 14 HB1 GLN 14 48.940 -2.262 -9.700
130 HG2 GLN 14 HG2 GLN 14 47.744 -2.431 -11.893
131 HG3 GLN 14 HG1 GLN 14 47.363 -0.671 -11.849
132 HE21 GLN 14 HE21 GLN 14 49.266 0.902 -11.910
133 HE22 GLN 14 HE22 GLN 14 50.751 0.405 -12.647
134 H ARG 15 HN ARG 15 46.358 -0.507 -6.938
135 HA ARG 15 HA ARG 15 47.763 -2.568 -5.370
136 HB2 ARG 15 HB2 ARG 15 47.103 0.347 -4.702
137 HB3 ARG 15 HB1 ARG 15 47.851 -0.825 -3.548
138 HG2 ARG 15 HG2 ARG 15 49.724 -1.183 -5.287
139 HG3 ARG 15 HG1 ARG 15 49.029 0.202 -6.202
140 HD2 ARG 15 HD2 ARG 15 49.332 1.667 -4.159
141 HD3 ARG 15 HD1 ARG 15 50.108 0.252 -3.317
142 HE ARG 15 HE ARG 15 51.431 0.690 -5.858
143 HH11 ARG 15 HH11 ARG 15 51.124 2.217 -2.605
144 HH12 ARG 15 HH12 ARG 15 52.673 2.989 -2.679
145 HH21 ARG 15 HH21 ARG 15 53.507 1.762 -5.909
146 HH22 ARG 15 HH22 ARG 15 54.036 2.728 -4.572
147 H LYS 16 HN LYS 16 44.942 -2.829 -6.469
148 HA LYS 16 HA LYS 16 43.290 -2.599 -4.058
149 HB2 LYS 16 HB2 LYS 16 42.607 -3.581 -6.907
150 HB3 LYS 16 HB1 LYS 16 41.423 -3.424 -5.563
151 HG2 LYS 16 HG2 LYS 16 43.061 -0.991 -6.507
152 HG3 LYS 16 HG1 LYS 16 41.630 -1.533 -7.427
153 HD2 LYS 16 HD2 LYS 16 41.453 -0.932 -4.403
154 HD3 LYS 16 HD1 LYS 16 41.377 0.373 -5.633
155 HE2 LYS 16 HE2 LYS 16 39.381 -0.773 -6.712
156 HE3 LYS 16 HE1 LYS 16 39.440 -2.044 -5.423
157 HZ1 LYS 16 HZ1 LYS 16 37.874 -0.107 -5.130
158 HZ2 LYS 16 HZ2 LYS 16 39.238 0.845 -4.789
159 HZ3 LYS 16 HZ3 LYS 16 38.873 -0.496 -3.814
160 H LYS 17 HN LYS 17 45.461 -4.767 -5.593
161 HA LYS 17 HA LYS 17 45.966 -6.870 -5.509
162 HB2 LYS 17 HB2 LYS 17 44.708 -6.588 -2.722
163 HB3 LYS 17 HB1 LYS 17 45.421 -8.148 -3.250
164 HG2 LYS 17 HG2 LYS 17 47.548 -7.442 -2.886
165 HG3 LYS 17 HG1 LYS 17 47.302 -5.922 -3.811
166 HD2 LYS 17 HD2 LYS 17 46.276 -4.842 -1.822
167 HD3 LYS 17 HD1 LYS 17 46.441 -6.367 -0.874
168 HE2 LYS 17 HE2 LYS 17 48.966 -6.216 -1.103
169 HE3 LYS 17 HE1 LYS 17 48.774 -4.664 -2.021
170 HZ1 LYS 17 HZ1 LYS 17 48.121 -5.241 0.814
171 HZ2 LYS 17 HZ2 LYS 17 47.510 -3.880 0.001
172 HZ3 LYS 17 HZ3 LYS 17 49.186 -4.085 0.170
Start of MODEL 13
1 H1 GLU 1 HT1 GLU 1 55.143 19.159 -14.782
2 H2 GLU 1 HT2 GLU 1 53.798 20.156 -14.497
3 H3 GLU 1 HT3 GLU 1 54.001 19.418 -16.013
4 HA GLU 1 HA GLU 1 53.600 17.293 -15.172
5 HB2 GLU 1 HB2 GLU 1 53.717 18.697 -12.418
6 HB3 GLU 1 HB1 GLU 1 52.950 17.078 -12.609
7 HG2 GLU 1 HG2 GLU 1 55.123 16.118 -13.460
8 HG3 GLU 1 HG1 GLU 1 55.909 17.737 -13.295
9 H MET 2 HN MET 2 51.803 17.728 -16.587
10 HA MET 2 HA MET 2 49.336 18.461 -15.151
11 HB2 MET 2 HB2 MET 2 50.155 19.407 -17.988
12 HB3 MET 2 HB1 MET 2 48.501 19.584 -17.298
13 HG2 MET 2 HG2 MET 2 49.410 21.062 -15.494
14 HG3 MET 2 HG1 MET 2 51.062 20.880 -16.170
15 HE1 MET 2 HE1 MET 2 49.761 23.623 -15.507
16 HE2 MET 2 HE2 MET 2 50.259 24.597 -16.933
17 HE3 MET 2 HE3 MET 2 51.398 23.403 -16.219
18 H ARG 3 HN ARG 3 47.432 17.392 -15.955
19 HA ARG 3 HA ARG 3 46.247 15.702 -16.668
20 HB2 ARG 3 HB2 ARG 3 48.130 15.627 -19.114
21 HB3 ARG 3 HB1 ARG 3 46.594 14.696 -18.993
22 HG2 ARG 3 HG2 ARG 3 45.265 16.756 -18.865
23 HG3 ARG 3 HG1 ARG 3 46.737 17.778 -18.786
24 HD2 ARG 3 HD2 ARG 3 46.034 15.974 -21.221
25 HD3 ARG 3 HD1 ARG 3 45.589 17.732 -21.086
26 HE ARG 3 HE ARG 3 48.411 17.507 -20.577
27 HH11 ARG 3 HH11 ARG 3 46.115 16.993 -23.313
28 HH12 ARG 3 HH12 ARG 3 47.278 17.386 -24.533
29 HH21 ARG 3 HH21 ARG 3 49.940 18.028 -22.267
30 HH22 ARG 3 HH22 ARG 3 49.469 17.978 -23.933
31 H LEU 4 HN LEU 4 47.696 14.914 -14.620
32 HA LEU 4 HA LEU 4 48.754 12.273 -15.390
33 HB2 LEU 4 HB2 LEU 4 49.512 14.046 -12.981
34 HB3 LEU 4 HB1 LEU 4 50.082 12.354 -13.204
35 HG LEU 4 HG LEU 4 50.695 14.667 -15.160
36 HD11 LEU 4 HD11 LEU 4 52.522 13.470 -12.971
37 HD12 LEU 4 HD12 LEU 4 51.736 15.095 -12.928
38 HD13 LEU 4 HD13 LEU 4 52.981 14.732 -14.179
39 HD21 LEU 4 HD21 LEU 4 51.635 11.726 -15.059
40 HD22 LEU 4 HD22 LEU 4 52.626 13.001 -15.864
41 HD23 LEU 4 HD23 LEU 4 50.961 12.657 -16.451
42 H SER 5 HN SER 5 45.904 13.311 -14.824
43 HA SER 5 HA SER 5 45.289 12.074 -12.276
44 HB2 SER 5 HB2 SER 5 43.457 13.321 -14.435
45 HB3 SER 5 HB1 SER 5 42.878 12.693 -12.837
46 HG SER 5 HG SER 5 44.986 14.540 -12.932
47 H LYS 6 HN LYS 6 45.424 11.134 -15.686
48 HA LYS 6 HA LYS 6 43.614 8.863 -15.351
49 HB2 LYS 6 HB2 LYS 6 45.437 9.715 -17.692
50 HB3 LYS 6 HB1 LYS 6 44.269 8.339 -17.737
51 HG2 LYS 6 HG2 LYS 6 42.371 9.944 -17.336
52 HG3 LYS 6 HG1 LYS 6 43.537 11.314 -17.313
53 HD2 LYS 6 HD2 LYS 6 44.210 10.779 -19.669
54 HD3 LYS 6 HD1 LYS 6 43.036 9.416 -19.690
55 HE2 LYS 6 HE2 LYS 6 41.132 11.041 -19.365
56 HE3 LYS 6 HE1 LYS 6 42.313 12.415 -19.323
57 HZ1 LYS 6 HZ1 LYS 6 42.679 12.259 -21.524
58 HZ2 LYS 6 HZ2 LYS 6 41.087 11.667 -21.497
59 HZ3 LYS 6 HZ3 LYS 6 42.392 10.587 -21.614
60 H PHE 7 HN PHE 7 46.955 9.696 -14.900
61 HA PHE 7 HA PHE 7 48.163 7.148 -15.365
62 HB2 PHE 7 HB2 PHE 7 48.976 9.830 -14.124
63 HB3 PHE 7 HB1 PHE 7 50.030 8.392 -13.835
64 HD1 PHE 7 HD1 PHE 7 48.459 10.412 -16.662
65 HD2 PHE 7 HD2 PHE 7 51.682 7.877 -15.431
66 HE1 PHE 7 HE1 PHE 7 49.612 10.829 -18.766
67 HE2 PHE 7 HE2 PHE 7 52.804 8.321 -17.550
68 HZ PHE 7 HZ PHE 7 51.778 9.790 -19.217
69 H PHE 8 HN PHE 8 46.636 8.923 -12.797
70 HA PHE 8 HA PHE 8 47.696 7.247 -10.710
71 HB2 PHE 8 HB2 PHE 8 46.703 9.969 -11.153
72 HB3 PHE 8 HB1 PHE 8 45.805 9.189 -9.802
73 HD1 PHE 8 HD1 PHE 8 49.352 8.866 -10.967
74 HD2 PHE 8 HD2 PHE 8 46.743 10.062 -7.785
75 HE1 PHE 8 HE1 PHE 8 51.265 9.551 -9.663
76 HE2 PHE 8 HE2 PHE 8 48.706 10.691 -6.443
77 HZ PHE 8 HZ PHE 8 50.970 10.445 -7.373
78 H ARG 9 HN ARG 9 45.037 7.436 -12.796
79 HA ARG 9 HA ARG 9 43.213 6.203 -10.976
80 HB2 ARG 9 HB2 ARG 9 42.829 7.723 -13.213
81 HB3 ARG 9 HB1 ARG 9 43.044 6.172 -14.065
82 HG2 ARG 9 HG2 ARG 9 40.769 6.214 -13.873
83 HG3 ARG 9 HG1 ARG 9 41.182 5.290 -12.391
84 HD2 ARG 9 HD2 ARG 9 41.140 8.259 -11.917
85 HD3 ARG 9 HD1 ARG 9 39.559 7.634 -12.533
86 HE ARG 9 HE ARG 9 39.461 6.078 -10.610
87 HH11 ARG 9 HH11 ARG 9 42.142 8.503 -10.335
88 HH12 ARG 9 HH12 ARG 9 42.188 8.431 -8.604
89 HH21 ARG 9 HH21 ARG 9 39.581 6.046 -8.283
90 HH22 ARG 9 HH22 ARG 9 40.729 7.029 -7.437
91 H ASP 10 HN ASP 10 45.593 5.295 -13.467
92 HA ASP 10 HA ASP 10 44.624 2.551 -13.239
93 HB2 ASP 10 HB2 ASP 10 46.864 3.827 -14.926
94 HB3 ASP 10 HB1 ASP 10 46.634 2.040 -14.850
95 H PHE 11 HN PHE 11 47.284 4.567 -11.928
96 HA PHE 11 HA PHE 11 48.703 2.263 -11.126
97 HB2 PHE 11 HB2 PHE 11 50.484 3.644 -11.168
98 HB3 PHE 11 HB1 PHE 11 49.370 5.023 -11.408
99 HD1 PHE 11 HD1 PHE 11 51.018 2.985 -8.608
100 HD2 PHE 11 HD2 PHE 11 49.012 6.499 -9.872
101 HE1 PHE 11 HE1 PHE 11 51.221 3.957 -6.369
102 HE2 PHE 11 HE2 PHE 11 49.232 7.432 -7.702
103 HZ PHE 11 HZ PHE 11 50.273 6.205 -5.910
104 H ILE 12 HN ILE 12 46.612 4.463 -9.291
105 HA ILE 12 HA ILE 12 47.232 3.266 -6.823
106 HB ILE 12 HB ILE 12 44.929 4.867 -7.910
107 HG12 ILE 12 HG12 ILE 12 47.252 5.528 -6.040
108 HG13 ILE 12 HG11 ILE 12 47.127 5.805 -7.810
109 HG21 ILE 12 HG21 ILE 12 45.335 3.871 -4.958
110 HG22 ILE 12 HG22 ILE 12 43.891 3.579 -5.998
111 HG23 ILE 12 HG23 ILE 12 44.233 5.230 -5.390
112 HD11 ILE 12 HD11 ILE 12 46.735 7.837 -6.518
113 HD12 ILE 12 HD12 ILE 12 45.282 7.091 -5.753
114 HD13 ILE 12 HD13 ILE 12 45.310 7.369 -7.546
115 H LEU 13 HN LEU 13 44.894 2.601 -9.385
116 HA LEU 13 HA LEU 13 43.252 0.910 -7.775
117 HB2 LEU 13 HB2 LEU 13 43.524 1.637 -10.679
118 HB3 LEU 13 HB1 LEU 13 42.358 0.356 -10.195
119 HG LEU 13 HG LEU 13 41.421 2.665 -10.524
120 HD11 LEU 13 HD11 LEU 13 40.233 0.900 -9.141
121 HD12 LEU 13 HD12 LEU 13 39.784 2.594 -8.717
122 HD13 LEU 13 HD13 LEU 13 40.912 1.668 -7.655
123 HD21 LEU 13 HD21 LEU 13 41.676 4.534 -9.073
124 HD22 LEU 13 HD22 LEU 13 43.356 3.994 -9.413
125 HD23 LEU 13 HD23 LEU 13 42.576 3.604 -7.827
126 H GLN 14 HN GLN 14 45.962 0.291 -10.062
127 HA GLN 14 HA GLN 14 45.483 -2.543 -10.129
128 HB2 GLN 14 HB2 GLN 14 47.886 -0.848 -11.024
129 HB3 GLN 14 HB1 GLN 14 47.857 -2.647 -11.187
130 HG2 GLN 14 HG2 GLN 14 45.780 -2.482 -12.625
131 HG3 GLN 14 HG1 GLN 14 45.840 -0.684 -12.491
132 HE21 GLN 14 HE21 GLN 14 47.687 0.488 -13.548
133 HE22 GLN 14 HE22 GLN 14 48.608 -0.278 -14.798
134 H ARG 15 HN ARG 15 46.812 -0.618 -7.545
135 HA ARG 15 HA ARG 15 48.919 -2.321 -6.742
136 HB2 ARG 15 HB2 ARG 15 47.218 -0.301 -5.252
137 HB3 ARG 15 HB1 ARG 15 48.477 -1.272 -4.404
138 HG2 ARG 15 HG2 ARG 15 50.266 -0.305 -5.649
139 HG3 ARG 15 HG1 ARG 15 49.180 0.330 -6.924
140 HD2 ARG 15 HD2 ARG 15 49.963 2.170 -5.488
141 HD3 ARG 15 HD1 ARG 15 48.183 1.923 -5.264
142 HE ARG 15 HE ARG 15 49.745 0.411 -3.291
143 HH11 ARG 15 HH11 ARG 15 48.490 3.718 -4.035
144 HH12 ARG 15 HH12 ARG 15 48.440 4.209 -2.374
145 HH21 ARG 15 HH21 ARG 15 49.645 1.125 -1.077
146 HH22 ARG 15 HH22 ARG 15 49.103 2.720 -0.683
147 H LYS 16 HN LYS 16 45.460 -2.161 -5.964
148 HA LYS 16 HA LYS 16 43.991 -3.412 -5.005
149 HB2 LYS 16 HB2 LYS 16 45.821 -5.754 -5.725
150 HB3 LYS 16 HB1 LYS 16 44.105 -5.915 -5.231
151 HG2 LYS 16 HG2 LYS 16 45.101 -4.453 -7.767
152 HG3 LYS 16 HG1 LYS 16 44.513 -6.143 -7.719
153 HD2 LYS 16 HD2 LYS 16 42.245 -5.305 -6.934
154 HD3 LYS 16 HD1 LYS 16 42.842 -3.614 -7.062
155 HE2 LYS 16 HE2 LYS 16 43.229 -3.923 -9.534
156 HE3 LYS 16 HE1 LYS 16 42.623 -5.626 -9.414
157 HZ1 LYS 16 HZ1 LYS 16 40.881 -3.576 -8.316
158 HZ2 LYS 16 HZ2 LYS 16 40.529 -4.930 -9.277
159 HZ3 LYS 16 HZ3 LYS 16 41.122 -3.508 -9.995
160 H LYS 17 HN LYS 17 45.532 -2.069 -3.379
161 HA LYS 17 HA LYS 17 46.189 -1.726 -1.404
162 HB2 LYS 17 HB2 LYS 17 44.822 -4.289 -0.367
163 HB3 LYS 17 HB1 LYS 17 45.249 -2.825 0.583
164 HG2 LYS 17 HG2 LYS 17 43.096 -2.165 0.251
165 HG3 LYS 17 HG1 LYS 17 43.609 -1.713 -1.406
166 HD2 LYS 17 HD2 LYS 17 43.017 -4.344 -1.883
167 HD3 LYS 17 HD1 LYS 17 41.991 -4.114 -0.428
168 HE2 LYS 17 HE2 LYS 17 40.822 -2.176 -1.572
169 HE3 LYS 17 HE1 LYS 17 41.857 -2.436 -3.037
170 HZ1 LYS 17 HZ1 LYS 17 40.158 -4.575 -1.872
171 HZ2 LYS 17 HZ2 LYS 17 40.877 -4.500 -3.410
172 HZ3 LYS 17 HZ3 LYS 17 39.587 -3.465 -3.024
Start of MODEL 14
1 H1 GLU 1 HT1 GLU 1 50.272 23.297 -18.872
2 H2 GLU 1 HT2 GLU 1 51.531 22.804 -19.899
3 H3 GLU 1 HT3 GLU 1 51.464 22.228 -18.303
4 HA GLU 1 HA GLU 1 49.108 21.435 -19.104
5 HB2 GLU 1 HB2 GLU 1 50.913 21.490 -21.619
6 HB3 GLU 1 HB1 GLU 1 49.516 20.359 -21.476
7 HG2 GLU 1 HG2 GLU 1 47.931 22.308 -21.222
8 HG3 GLU 1 HG1 GLU 1 49.318 23.460 -21.348
9 H MET 2 HN MET 2 49.452 19.875 -17.507
10 HA MET 2 HA MET 2 51.063 17.590 -18.285
11 HB2 MET 2 HB2 MET 2 52.606 19.205 -16.882
12 HB3 MET 2 HB1 MET 2 51.502 18.903 -15.505
13 HG2 MET 2 HG2 MET 2 52.040 16.459 -15.597
14 HG3 MET 2 HG1 MET 2 53.105 16.735 -17.014
15 HE1 MET 2 HE1 MET 2 55.014 15.468 -15.879
16 HE2 MET 2 HE2 MET 2 53.959 15.162 -14.455
17 HE3 MET 2 HE3 MET 2 55.631 15.778 -14.219
18 H ARG 3 HN ARG 3 50.091 15.677 -17.507
19 HA ARG 3 HA ARG 3 47.745 16.054 -15.740
20 HB2 ARG 3 HB2 ARG 3 48.164 13.991 -18.009
21 HB3 ARG 3 HB1 ARG 3 46.781 13.974 -16.851
22 HG2 ARG 3 HG2 ARG 3 46.065 16.239 -17.697
23 HG3 ARG 3 HG1 ARG 3 47.422 16.216 -18.880
24 HD2 ARG 3 HD2 ARG 3 46.436 14.138 -19.960
25 HD3 ARG 3 HD1 ARG 3 45.047 14.211 -18.783
26 HE ARG 3 HE ARG 3 45.309 16.778 -20.097
27 HH11 ARG 3 HH11 ARG 3 44.292 13.390 -20.811
28 HH12 ARG 3 HH12 ARG 3 43.221 13.844 -22.093
29 HH21 ARG 3 HH21 ARG 3 43.850 17.333 -21.839
30 HH22 ARG 3 HH22 ARG 3 42.970 16.102 -22.680
31 H LEU 4 HN LEU 4 47.402 14.394 -14.140
32 HA LEU 4 HA LEU 4 49.404 12.331 -13.875
33 HB2 LEU 4 HB2 LEU 4 49.842 14.822 -12.533
34 HB3 LEU 4 HB1 LEU 4 49.113 13.789 -11.267
35 HG LEU 4 HG LEU 4 51.417 12.635 -12.925
36 HD11 LEU 4 HD11 LEU 4 52.243 14.918 -12.375
37 HD12 LEU 4 HD12 LEU 4 53.147 13.657 -11.456
38 HD13 LEU 4 HD13 LEU 4 51.884 14.645 -10.626
39 HD21 LEU 4 HD21 LEU 4 52.006 11.491 -10.770
40 HD22 LEU 4 HD22 LEU 4 50.299 11.169 -11.236
41 HD23 LEU 4 HD23 LEU 4 50.662 12.358 -9.933
42 H SER 5 HN SER 5 46.297 13.068 -14.173
43 HA SER 5 HA SER 5 45.260 11.874 -11.745
44 HB2 SER 5 HB2 SER 5 43.839 12.822 -14.319
45 HB3 SER 5 HB1 SER 5 42.981 12.176 -12.859
46 HG SER 5 HG SER 5 44.850 14.214 -12.503
47 H LYS 6 HN LYS 6 45.874 10.874 -15.158
48 HA LYS 6 HA LYS 6 44.393 8.385 -14.837
49 HB2 LYS 6 HB2 LYS 6 46.223 9.417 -17.095
50 HB3 LYS 6 HB1 LYS 6 45.319 7.854 -17.146
51 HG2 LYS 6 HG2 LYS 6 43.148 9.118 -16.913
52 HG3 LYS 6 HG1 LYS 6 44.059 10.670 -16.910
53 HD2 LYS 6 HD2 LYS 6 44.937 10.154 -19.205
54 HD3 LYS 6 HD1 LYS 6 44.023 8.605 -19.202
55 HE2 LYS 6 HE2 LYS 6 41.848 9.883 -19.047
56 HE3 LYS 6 HE1 LYS 6 42.771 11.443 -19.042
57 HZ1 LYS 6 HZ1 LYS 6 43.216 9.508 -21.214
58 HZ2 LYS 6 HZ2 LYS 6 43.323 11.203 -21.213
59 HZ3 LYS 6 HZ3 LYS 6 41.802 10.447 -21.213
60 H PHE 7 HN PHE 7 47.543 9.613 -14.107
61 HA PHE 7 HA PHE 7 49.098 7.232 -14.385
62 HB2 PHE 7 HB2 PHE 7 49.385 9.966 -13.013
63 HB3 PHE 7 HB1 PHE 7 50.597 8.671 -12.662
64 HD1 PHE 7 HD1 PHE 7 49.075 10.657 -15.528
65 HD2 PHE 7 HD2 PHE 7 52.433 8.399 -14.130
66 HE1 PHE 7 HE1 PHE 7 50.361 11.332 -17.481
67 HE2 PHE 7 HE2 PHE 7 53.687 9.097 -16.101
68 HZ PHE 7 HZ PHE 7 52.662 10.558 -17.775
69 H PHE 8 HN PHE 8 47.096 8.836 -12.019
70 HA PHE 8 HA PHE 8 48.041 7.242 -9.815
71 HB2 PHE 8 HB2 PHE 8 46.856 9.869 -10.380
72 HB3 PHE 8 HB1 PHE 8 45.900 9.001 -9.130
73 HD1 PHE 8 HD1 PHE 8 49.574 8.927 -9.858
74 HD2 PHE 8 HD2 PHE 8 46.521 10.060 -7.072
75 HE1 PHE 8 HE1 PHE 8 51.264 9.778 -8.356
76 HE2 PHE 8 HE2 PHE 8 48.260 10.854 -5.525
77 HZ PHE 8 HZ PHE 8 50.633 10.721 -6.160
78 H ARG 9 HN ARG 9 45.619 7.283 -12.185
79 HA ARG 9 HA ARG 9 43.737 5.815 -10.623
80 HB2 ARG 9 HB2 ARG 9 43.099 7.380 -12.492
81 HB3 ARG 9 HB1 ARG 9 44.064 6.399 -13.638
82 HG2 ARG 9 HG2 ARG 9 42.537 4.516 -13.404
83 HG3 ARG 9 HG1 ARG 9 41.605 5.366 -12.122
84 HD2 ARG 9 HD2 ARG 9 40.860 7.082 -13.709
85 HD3 ARG 9 HD1 ARG 9 41.950 6.414 -15.008
86 HE ARG 9 HE ARG 9 40.143 4.340 -14.035
87 HH11 ARG 9 HH11 ARG 9 40.189 7.295 -16.109
88 HH12 ARG 9 HH12 ARG 9 38.867 6.776 -17.099
89 HH21 ARG 9 HH21 ARG 9 38.372 3.688 -15.404
90 HH22 ARG 9 HH22 ARG 9 37.826 4.708 -16.693
91 H ASP 10 HN ASP 10 46.532 5.202 -12.824
92 HA ASP 10 HA ASP 10 45.782 2.376 -12.802
93 HB2 ASP 10 HB2 ASP 10 47.983 3.992 -14.196
94 HB3 ASP 10 HB1 ASP 10 48.119 2.198 -14.102
95 H PHE 11 HN PHE 11 47.782 4.535 -10.879
96 HA PHE 11 HA PHE 11 49.322 2.320 -9.965
97 HB2 PHE 11 HB2 PHE 11 51.001 3.802 -9.743
98 HB3 PHE 11 HB1 PHE 11 49.857 5.107 -10.180
99 HD1 PHE 11 HD1 PHE 11 51.070 3.161 -7.092
100 HD2 PHE 11 HD2 PHE 11 49.266 6.606 -8.768
101 HE1 PHE 11 HE1 PHE 11 50.857 4.184 -4.879
102 HE2 PHE 11 HE2 PHE 11 49.088 7.587 -6.618
103 HZ PHE 11 HZ PHE 11 49.814 6.416 -4.645
104 H ILE 12 HN ILE 12 46.865 4.419 -8.521
105 HA ILE 12 HA ILE 12 47.122 3.288 -5.956
106 HB ILE 12 HB ILE 12 44.964 4.769 -7.444
107 HG12 ILE 12 HG12 ILE 12 46.862 5.586 -5.190
108 HG13 ILE 12 HG11 ILE 12 47.116 5.783 -6.956
109 HG21 ILE 12 HG21 ILE 12 44.887 3.745 -4.483
110 HG22 ILE 12 HG22 ILE 12 43.620 3.538 -5.751
111 HG23 ILE 12 HG23 ILE 12 43.902 5.153 -5.027
112 HD11 ILE 12 HD11 ILE 12 46.368 7.847 -5.890
113 HD12 ILE 12 HD12 ILE 12 44.816 7.062 -5.411
114 HD13 ILE 12 HD13 ILE 12 45.213 7.269 -7.169
115 H LEU 13 HN LEU 13 45.256 2.461 -8.842
116 HA LEU 13 HA LEU 13 43.341 0.866 -7.473
117 HB2 LEU 13 HB2 LEU 13 44.190 1.353 -10.313
118 HB3 LEU 13 HB1 LEU 13 42.959 0.088 -9.972
119 HG LEU 13 HG LEU 13 42.114 2.368 -10.665
120 HD11 LEU 13 HD11 LEU 13 40.981 1.453 -7.958
121 HD12 LEU 13 HD12 LEU 13 40.641 0.672 -9.550
122 HD13 LEU 13 HD13 LEU 13 40.115 2.369 -9.248
123 HD21 LEU 13 HD21 LEU 13 42.000 4.330 -9.288
124 HD22 LEU 13 HD22 LEU 13 43.722 3.803 -9.197
125 HD23 LEU 13 HD23 LEU 13 42.599 3.468 -7.820
126 H GLN 14 HN GLN 14 46.445 0.055 -9.099
127 HA GLN 14 HA GLN 14 45.986 -2.758 -9.096
128 HB2 GLN 14 HB2 GLN 14 48.599 -1.147 -9.261
129 HB3 GLN 14 HB1 GLN 14 48.536 -2.946 -9.410
130 HG2 GLN 14 HG2 GLN 14 46.951 -2.685 -11.399
131 HG3 GLN 14 HG1 GLN 14 47.158 -0.896 -11.286
132 HE21 GLN 14 HE21 GLN 14 49.462 -0.013 -11.568
133 HE22 GLN 14 HE22 GLN 14 50.584 -0.902 -12.542
134 H ARG 15 HN ARG 15 46.783 -0.622 -6.403
135 HA ARG 15 HA ARG 15 48.156 -2.725 -4.918
136 HB2 ARG 15 HB2 ARG 15 47.353 0.112 -4.103
137 HB3 ARG 15 HB1 ARG 15 48.281 -1.043 -3.068
138 HG2 ARG 15 HG2 ARG 15 49.994 -1.170 -5.028
139 HG3 ARG 15 HG1 ARG 15 49.131 0.250 -5.721
140 HD2 ARG 15 HD2 ARG 15 49.559 1.531 -3.573
141 HD3 ARG 15 HD1 ARG 15 50.480 0.090 -2.951
142 HE ARG 15 HE ARG 15 51.531 0.891 -5.541
143 HH11 ARG 15 HH11 ARG 15 51.484 1.946 -2.091
144 HH12 ARG 15 HH12 ARG 15 52.982 2.809 -2.198
145 HH21 ARG 15 HH21 ARG 15 53.540 2.084 -5.633
146 HH22 ARG 15 HH22 ARG 15 54.157 2.888 -4.229
147 H LYS 16 HN LYS 16 44.962 -2.018 -5.680
148 HA LYS 16 HA LYS 16 43.904 -2.883 -3.072
149 HB2 LYS 16 HB2 LYS 16 42.428 -1.680 -5.489
150 HB3 LYS 16 HB1 LYS 16 41.714 -2.077 -3.880
151 HG2 LYS 16 HG2 LYS 16 43.788 -0.381 -3.113
152 HG3 LYS 16 HG1 LYS 16 43.418 0.270 -4.742
153 HD2 LYS 16 HD2 LYS 16 41.293 -0.207 -2.571
154 HD3 LYS 16 HD1 LYS 16 42.196 1.330 -2.731
155 HE2 LYS 16 HE2 LYS 16 40.441 0.142 -5.017
156 HE3 LYS 16 HE1 LYS 16 39.853 1.344 -3.804
157 HZ1 LYS 16 HZ1 LYS 16 41.616 1.681 -6.080
158 HZ2 LYS 16 HZ2 LYS 16 42.079 2.523 -4.679
159 HZ3 LYS 16 HZ3 LYS 16 40.536 2.765 -5.345
160 H LYS 17 HN LYS 17 44.636 -3.750 -6.403
161 HA LYS 17 HA LYS 17 42.717 -5.929 -6.397
162 HB2 LYS 17 HB2 LYS 17 44.612 -4.744 -8.509
163 HB3 LYS 17 HB1 LYS 17 43.642 -6.236 -8.801
164 HG2 LYS 17 HG2 LYS 17 41.533 -5.012 -8.538
165 HG3 LYS 17 HG1 LYS 17 42.387 -3.522 -8.014
166 HD2 LYS 17 HD2 LYS 17 43.486 -3.359 -10.254
167 HD3 LYS 17 HD1 LYS 17 42.623 -4.845 -10.795
168 HE2 LYS 17 HE2 LYS 17 40.404 -3.667 -10.498
169 HE3 LYS 17 HE1 LYS 17 41.273 -2.177 -9.941
170 HZ1 LYS 17 HZ1 LYS 17 42.139 -3.286 -12.488
171 HZ2 LYS 17 HZ2 LYS 17 41.871 -1.678 -12.010
172 HZ3 LYS 17 HZ3 LYS 17 40.560 -2.664 -12.451
Start of MODEL 15
1 H1 GLU 1 HT1 GLU 1 50.392 20.909 -22.360
2 H2 GLU 1 HT2 GLU 1 51.594 20.578 -21.205
3 H3 GLU 1 HT3 GLU 1 50.848 22.103 -21.241
4 HA GLU 1 HA GLU 1 49.745 21.182 -19.532
5 HB2 GLU 1 HB2 GLU 1 48.233 20.378 -22.105
6 HB3 GLU 1 HB1 GLU 1 47.502 20.116 -20.475
7 HG2 GLU 1 HG2 GLU 1 47.662 22.591 -19.983
8 HG3 GLU 1 HG1 GLU 1 48.395 22.870 -21.610
9 H MET 2 HN MET 2 50.197 19.575 -18.089
10 HA MET 2 HA MET 2 50.180 16.792 -19.073
11 HB2 MET 2 HB2 MET 2 52.154 18.057 -17.047
12 HB3 MET 2 HB1 MET 2 52.000 16.288 -17.343
13 HG2 MET 2 HG2 MET 2 52.698 16.620 -19.721
14 HG3 MET 2 HG1 MET 2 52.849 18.386 -19.437
15 HE1 MET 2 HE1 MET 2 55.061 16.543 -20.704
16 HE2 MET 2 HE2 MET 2 56.536 17.215 -19.928
17 HE3 MET 2 HE3 MET 2 55.216 18.317 -20.447
18 H ARG 3 HN ARG 3 49.438 15.230 -17.484
19 HA ARG 3 HA ARG 3 48.090 16.425 -15.146
20 HB2 ARG 3 HB2 ARG 3 46.998 14.272 -17.077
21 HB3 ARG 3 HB1 ARG 3 46.287 14.614 -15.457
22 HG2 ARG 3 HG2 ARG 3 45.725 16.939 -16.158
23 HG3 ARG 3 HG1 ARG 3 46.514 16.678 -17.747
24 HD2 ARG 3 HD2 ARG 3 44.040 16.479 -17.992
25 HD3 ARG 3 HD1 ARG 3 44.799 14.848 -18.267
26 HE ARG 3 HE ARG 3 44.079 15.152 -15.458
27 HH11 ARG 3 HH11 ARG 3 42.528 14.671 -18.683
28 HH12 ARG 3 HH12 ARG 3 41.203 13.755 -18.048
29 HH21 ARG 3 HH21 ARG 3 42.278 13.902 -14.665
30 HH22 ARG 3 HH22 ARG 3 41.061 13.315 -15.748
31 H LEU 4 HN LEU 4 48.006 15.088 -13.284
32 HA LEU 4 HA LEU 4 49.712 12.690 -13.406
33 HB2 LEU 4 HB2 LEU 4 49.458 14.806 -11.173
34 HB3 LEU 4 HB1 LEU 4 50.274 13.220 -10.933
35 HG LEU 4 HG LEU 4 51.173 15.304 -13.030
36 HD11 LEU 4 HD11 LEU 4 52.319 14.839 -10.193
37 HD12 LEU 4 HD12 LEU 4 51.374 16.277 -10.739
38 HD13 LEU 4 HD13 LEU 4 52.996 15.945 -11.451
39 HD21 LEU 4 HD21 LEU 4 52.077 13.165 -13.709
40 HD22 LEU 4 HD22 LEU 4 52.444 12.672 -12.013
41 HD23 LEU 4 HD23 LEU 4 53.421 13.961 -12.812
42 H SER 5 HN SER 5 46.602 13.512 -13.522
43 HA SER 5 HA SER 5 45.624 12.084 -11.192
44 HB2 SER 5 HB2 SER 5 44.150 13.312 -13.618
45 HB3 SER 5 HB1 SER 5 43.318 12.514 -12.219
46 HG SER 5 HG SER 5 45.183 14.607 -11.873
47 H LYS 6 HN LYS 6 46.561 11.366 -14.514
48 HA LYS 6 HA LYS 6 44.953 8.929 -14.681
49 HB2 LYS 6 HB2 LYS 6 47.136 10.093 -16.535
50 HB3 LYS 6 HB1 LYS 6 46.154 8.620 -16.887
51 HG2 LYS 6 HG2 LYS 6 44.056 10.013 -16.839
52 HG3 LYS 6 HG1 LYS 6 45.041 11.483 -16.513
53 HD2 LYS 6 HD2 LYS 6 46.247 11.149 -18.694
54 HD3 LYS 6 HD1 LYS 6 45.241 9.693 -19.017
55 HE2 LYS 6 HE2 LYS 6 43.161 11.129 -19.041
56 HE3 LYS 6 HE1 LYS 6 44.174 12.593 -18.704
57 HZ1 LYS 6 HZ1 LYS 6 45.188 12.420 -20.771
58 HZ2 LYS 6 HZ2 LYS 6 43.546 12.115 -21.077
59 HZ3 LYS 6 HZ3 LYS 6 44.656 10.831 -21.042
60 H PHE 7 HN PHE 7 48.022 10.012 -13.423
61 HA PHE 7 HA PHE 7 49.544 7.603 -13.695
62 HB2 PHE 7 HB2 PHE 7 49.762 10.243 -12.172
63 HB3 PHE 7 HB1 PHE 7 50.756 8.864 -11.570
64 HD1 PHE 7 HD1 PHE 7 50.036 10.832 -14.758
65 HD2 PHE 7 HD2 PHE 7 52.884 8.563 -12.503
66 HE1 PHE 7 HE1 PHE 7 51.783 11.405 -16.355
67 HE2 PHE 7 HE2 PHE 7 54.605 9.159 -14.125
68 HZ PHE 7 HZ PHE 7 54.064 10.575 -16.046
69 H PHE 8 HN PHE 8 47.288 9.089 -11.511
70 HA PHE 8 HA PHE 8 47.867 7.301 -9.337
71 HB2 PHE 8 HB2 PHE 8 46.898 10.021 -9.842
72 HB3 PHE 8 HB1 PHE 8 45.702 9.116 -8.840
73 HD1 PHE 8 HD1 PHE 8 49.445 8.948 -9.016
74 HD2 PHE 8 HD2 PHE 8 46.031 9.871 -6.592
75 HE1 PHE 8 HE1 PHE 8 50.909 9.555 -7.195
76 HE2 PHE 8 HE2 PHE 8 47.537 10.422 -4.727
77 HZ PHE 8 HZ PHE 8 49.976 10.271 -5.019
78 H ARG 9 HN ARG 9 45.831 7.551 -12.029
79 HA ARG 9 HA ARG 9 43.740 5.993 -10.819
80 HB2 ARG 9 HB2 ARG 9 43.355 7.791 -12.577
81 HB3 ARG 9 HB1 ARG 9 44.341 6.841 -13.734
82 HG2 ARG 9 HG2 ARG 9 42.714 5.072 -13.795
83 HG3 ARG 9 HG1 ARG 9 41.778 5.776 -12.429
84 HD2 ARG 9 HD2 ARG 9 41.224 7.776 -13.825
85 HD3 ARG 9 HD1 ARG 9 42.181 7.073 -15.207
86 HE ARG 9 HE ARG 9 40.298 5.074 -14.444
87 HH11 ARG 9 HH11 ARG 9 40.180 8.443 -15.734
88 HH12 ARG 9 HH12 ARG 9 38.662 8.219 -16.537
89 HH21 ARG 9 HH21 ARG 9 38.256 4.829 -15.541
90 HH22 ARG 9 HH22 ARG 9 37.560 6.146 -16.425
91 H ASP 10 HN ASP 10 46.793 5.603 -12.631
92 HA ASP 10 HA ASP 10 46.084 2.816 -13.122
93 HB2 ASP 10 HB2 ASP 10 48.713 4.351 -13.654
94 HB3 ASP 10 HB1 ASP 10 48.434 2.635 -14.128
95 H PHE 11 HN PHE 11 47.922 4.716 -10.734
96 HA PHE 11 HA PHE 11 49.173 2.375 -9.744
97 HB2 PHE 11 HB2 PHE 11 50.816 3.785 -9.135
98 HB3 PHE 11 HB1 PHE 11 49.775 5.157 -9.623
99 HD1 PHE 11 HD1 PHE 11 50.523 2.932 -6.589
100 HD2 PHE 11 HD2 PHE 11 48.918 6.514 -8.186
101 HE1 PHE 11 HE1 PHE 11 49.970 3.734 -4.346
102 HE2 PHE 11 HE2 PHE 11 48.411 7.285 -6.005
103 HZ PHE 11 HZ PHE 11 48.860 5.933 -4.061
104 H ILE 12 HN ILE 12 46.525 4.403 -8.505
105 HA ILE 12 HA ILE 12 46.385 3.034 -6.055
106 HB ILE 12 HB ILE 12 44.479 4.679 -7.700
107 HG12 ILE 12 HG12 ILE 12 45.997 5.196 -5.093
108 HG13 ILE 12 HG11 ILE 12 46.521 5.598 -6.762
109 HG21 ILE 12 HG21 ILE 12 43.018 4.811 -5.481
110 HG22 ILE 12 HG22 ILE 12 43.918 3.361 -4.910
111 HG23 ILE 12 HG23 ILE 12 42.891 3.265 -6.388
112 HD11 ILE 12 HD11 ILE 12 44.043 6.744 -5.397
113 HD12 ILE 12 HD12 ILE 12 44.627 7.112 -7.072
114 HD13 ILE 12 HD13 ILE 12 45.642 7.547 -5.620
115 H LEU 13 HN LEU 13 45.027 2.467 -9.267
116 HA LEU 13 HA LEU 13 43.015 0.648 -8.381
117 HB2 LEU 13 HB2 LEU 13 44.284 1.465 -10.988
118 HB3 LEU 13 HB1 LEU 13 43.064 0.143 -10.971
119 HG LEU 13 HG LEU 13 42.281 2.497 -11.554
120 HD11 LEU 13 HD11 LEU 13 40.058 2.297 -10.475
121 HD12 LEU 13 HD12 LEU 13 40.740 1.121 -9.294
122 HD13 LEU 13 HD13 LEU 13 40.677 0.703 -11.044
123 HD21 LEU 13 HD21 LEU 13 43.518 3.788 -9.676
124 HD22 LEU 13 HD22 LEU 13 42.219 3.217 -8.551
125 HD23 LEU 13 HD23 LEU 13 41.795 4.245 -9.965
126 H GLN 14 HN GLN 14 46.404 0.278 -9.390
127 HA GLN 14 HA GLN 14 46.317 -2.567 -9.714
128 HB2 GLN 14 HB2 GLN 14 48.567 -0.521 -9.375
129 HB3 GLN 14 HB1 GLN 14 48.939 -2.285 -9.333
130 HG2 GLN 14 HG2 GLN 14 47.975 -2.568 -11.640
131 HG3 GLN 14 HG1 GLN 14 47.552 -0.816 -11.685
132 HE21 GLN 14 HE21 GLN 14 50.450 -3.013 -11.137
133 HE22 GLN 14 HE22 GLN 14 51.599 -1.958 -11.889
134 H ARG 15 HN ARG 15 46.432 -0.500 -6.831
135 HA ARG 15 HA ARG 15 47.595 -2.667 -5.225
136 HB2 ARG 15 HB2 ARG 15 47.045 0.265 -4.540
137 HB3 ARG 15 HB1 ARG 15 47.722 -0.952 -3.389
138 HG2 ARG 15 HG2 ARG 15 49.611 -1.361 -5.094
139 HG3 ARG 15 HG1 ARG 15 48.991 0.059 -6.008
140 HD2 ARG 15 HD2 ARG 15 49.296 1.480 -3.913
141 HD3 ARG 15 HD1 ARG 15 50.050 0.026 -3.117
142 HE ARG 15 HE ARG 15 51.382 0.481 -5.636
143 HH11 ARG 15 HH11 ARG 15 51.074 2.023 -2.389
144 HH12 ARG 15 HH12 ARG 15 52.616 2.807 -2.473
145 HH21 ARG 15 HH21 ARG 15 53.446 1.570 -5.700
146 HH22 ARG 15 HH22 ARG 15 53.974 2.546 -4.370
147 H LYS 16 HN LYS 16 44.694 -2.535 -6.423
148 HA LYS 16 HA LYS 16 43.151 -2.541 -3.926
149 HB2 LYS 16 HB2 LYS 16 42.299 -2.758 -6.860
150 HB3 LYS 16 HB1 LYS 16 41.167 -2.946 -5.463
151 HG2 LYS 16 HG2 LYS 16 41.944 -0.609 -4.669
152 HG3 LYS 16 HG1 LYS 16 42.797 -0.455 -6.244
153 HD2 LYS 16 HD2 LYS 16 40.653 -0.776 -7.457
154 HD3 LYS 16 HD1 LYS 16 39.803 -0.994 -5.886
155 HE2 LYS 16 HE2 LYS 16 40.386 1.381 -5.237
156 HE3 LYS 16 HE1 LYS 16 41.235 1.600 -6.823
157 HZ1 LYS 16 HZ1 LYS 16 38.927 0.795 -7.719
158 HZ2 LYS 16 HZ2 LYS 16 39.203 2.414 -7.290
159 HZ3 LYS 16 HZ3 LYS 16 38.370 1.385 -6.228
160 H LYS 17 HN LYS 17 44.993 -4.595 -5.989
161 HA LYS 17 HA LYS 17 45.295 -6.716 -6.238
162 HB2 LYS 17 HB2 LYS 17 43.941 -7.157 -3.499
163 HB3 LYS 17 HB1 LYS 17 44.995 -8.337 -4.352
164 HG2 LYS 17 HG2 LYS 17 46.723 -7.471 -3.161
165 HG3 LYS 17 HG1 LYS 17 46.647 -6.051 -4.254
166 HD2 LYS 17 HD2 LYS 17 45.094 -4.904 -2.623
167 HD3 LYS 17 HD1 LYS 17 45.189 -6.323 -1.531
168 HE2 LYS 17 HE2 LYS 17 47.710 -4.729 -2.391
169 HE3 LYS 17 HE1 LYS 17 46.711 -4.282 -0.951
170 HZ1 LYS 17 HZ1 LYS 17 48.411 -6.636 -1.407
171 HZ2 LYS 17 HZ2 LYS 17 47.066 -6.786 -0.382
172 HZ3 LYS 17 HZ3 LYS 17 48.266 -5.632 -0.047
Start of MODEL 16
1 H1 GLU 1 HT1 GLU 1 55.400 18.441 -17.262
2 H2 GLU 1 HT2 GLU 1 55.382 18.979 -15.651
3 H3 GLU 1 HT3 GLU 1 54.227 19.558 -16.753
4 HA GLU 1 HA GLU 1 53.812 16.960 -16.970
5 HB2 GLU 1 HB2 GLU 1 54.780 17.542 -14.092
6 HB3 GLU 1 HB1 GLU 1 53.612 16.208 -14.419
7 HG2 GLU 1 HG2 GLU 1 55.269 15.114 -15.986
8 HG3 GLU 1 HG1 GLU 1 56.451 16.443 -15.665
9 H MET 2 HN MET 2 51.772 17.594 -17.657
10 HA MET 2 HA MET 2 49.972 18.669 -15.586
11 HB2 MET 2 HB2 MET 2 50.117 19.561 -18.551
12 HB3 MET 2 HB1 MET 2 48.763 19.974 -17.437
13 HG2 MET 2 HG2 MET 2 50.343 21.238 -15.974
14 HG3 MET 2 HG1 MET 2 51.706 20.816 -17.063
15 HE1 MET 2 HE1 MET 2 50.974 23.730 -16.104
16 HE2 MET 2 HE2 MET 2 51.262 24.651 -17.621
17 HE3 MET 2 HE3 MET 2 52.360 23.301 -17.168
18 H ARG 3 HN ARG 3 47.811 17.875 -15.724
19 HA ARG 3 HA ARG 3 46.224 16.412 -16.047
20 HB2 ARG 3 HB2 ARG 3 47.210 16.136 -18.963
21 HB3 ARG 3 HB1 ARG 3 45.653 15.483 -18.334
22 HG2 ARG 3 HG2 ARG 3 44.914 17.826 -17.759
23 HG3 ARG 3 HG1 ARG 3 46.459 18.467 -18.404
24 HD2 ARG 3 HD2 ARG 3 44.764 18.785 -20.142
25 HD3 ARG 3 HD1 ARG 3 45.824 17.418 -20.703
26 HE ARG 3 HE ARG 3 43.589 16.339 -19.198
27 HH11 ARG 3 HH11 ARG 3 44.283 17.941 -22.358
28 HH12 ARG 3 HH12 ARG 3 42.957 17.186 -23.175
29 HH21 ARG 3 HH21 ARG 3 41.822 15.347 -20.354
30 HH22 ARG 3 HH22 ARG 3 41.550 15.700 -22.028
31 H LEU 4 HN LEU 4 47.165 15.002 -14.449
32 HA LEU 4 HA LEU 4 47.952 12.466 -15.646
33 HB2 LEU 4 HB2 LEU 4 49.707 12.128 -13.794
34 HB3 LEU 4 HB1 LEU 4 50.145 13.288 -15.074
35 HG LEU 4 HG LEU 4 48.787 14.701 -12.840
36 HD11 LEU 4 HD11 LEU 4 50.478 14.401 -11.059
37 HD12 LEU 4 HD12 LEU 4 51.341 13.161 -12.047
38 HD13 LEU 4 HD13 LEU 4 49.674 12.832 -11.441
39 HD21 LEU 4 HD21 LEU 4 50.800 16.164 -12.931
40 HD22 LEU 4 HD22 LEU 4 50.187 15.825 -14.593
41 HD23 LEU 4 HD23 LEU 4 51.652 14.967 -13.980
42 H SER 5 HN SER 5 45.371 13.288 -14.796
43 HA SER 5 HA SER 5 44.996 12.240 -12.116
44 HB2 SER 5 HB2 SER 5 42.959 13.168 -14.256
45 HB3 SER 5 HB1 SER 5 42.518 12.655 -12.575
46 HG SER 5 HG SER 5 44.442 14.659 -13.067
47 H LYS 6 HN LYS 6 44.963 11.115 -15.458
48 HA LYS 6 HA LYS 6 43.410 8.717 -14.878
49 HB2 LYS 6 HB2 LYS 6 44.855 9.728 -17.404
50 HB3 LYS 6 HB1 LYS 6 43.928 8.181 -17.322
51 HG2 LYS 6 HG2 LYS 6 41.860 9.487 -16.648
52 HG3 LYS 6 HG1 LYS 6 42.779 11.016 -16.834
53 HD2 LYS 6 HD2 LYS 6 42.409 8.984 -19.120
54 HD3 LYS 6 HD1 LYS 6 41.228 10.289 -18.771
55 HE2 LYS 6 HE2 LYS 6 43.082 12.019 -19.129
56 HE3 LYS 6 HE1 LYS 6 44.205 10.671 -19.584
57 HZ1 LYS 6 HZ1 LYS 6 42.096 10.187 -21.149
58 HZ2 LYS 6 HZ2 LYS 6 43.442 11.121 -21.598
59 HZ3 LYS 6 HZ3 LYS 6 42.023 11.880 -21.054
60 H PHE 7 HN PHE 7 46.701 9.826 -14.678
61 HA PHE 7 HA PHE 7 48.083 7.365 -15.172
62 HB2 PHE 7 HB2 PHE 7 48.718 10.109 -13.990
63 HB3 PHE 7 HB1 PHE 7 49.859 8.765 -13.619
64 HD1 PHE 7 HD1 PHE 7 48.171 10.438 -16.615
65 HD2 PHE 7 HD2 PHE 7 51.631 8.429 -15.095
66 HE1 PHE 7 HE1 PHE 7 49.352 10.867 -18.696
67 HE2 PHE 7 HE2 PHE 7 52.778 8.874 -17.197
68 HZ PHE 7 HZ PHE 7 51.649 10.089 -18.996
69 H PHE 8 HN PHE 8 46.545 9.067 -12.575
70 HA PHE 8 HA PHE 8 47.741 7.479 -10.501
71 HB2 PHE 8 HB2 PHE 8 46.596 10.139 -10.970
72 HB3 PHE 8 HB1 PHE 8 45.754 9.336 -9.593
73 HD1 PHE 8 HD1 PHE 8 49.298 9.148 -10.792
74 HD2 PHE 8 HD2 PHE 8 46.672 10.314 -7.613
75 HE1 PHE 8 HE1 PHE 8 51.193 9.935 -9.524
76 HE2 PHE 8 HE2 PHE 8 48.620 11.052 -6.307
77 HZ PHE 8 HZ PHE 8 50.883 10.869 -7.253
78 H ARG 9 HN ARG 9 45.024 7.539 -12.509
79 HA ARG 9 HA ARG 9 43.366 6.113 -10.663
80 HB2 ARG 9 HB2 ARG 9 42.543 7.765 -12.404
81 HB3 ARG 9 HB1 ARG 9 43.197 6.699 -13.686
82 HG2 ARG 9 HG2 ARG 9 41.594 4.956 -13.137
83 HG3 ARG 9 HG1 ARG 9 40.996 5.884 -11.713
84 HD2 ARG 9 HD2 ARG 9 40.182 7.703 -13.194
85 HD3 ARG 9 HD1 ARG 9 40.854 6.837 -14.651
86 HE ARG 9 HE ARG 9 39.085 5.035 -13.259
87 HH11 ARG 9 HH11 ARG 9 38.947 8.085 -15.177
88 HH12 ARG 9 HH12 ARG 9 37.333 7.811 -15.744
89 HH21 ARG 9 HH21 ARG 9 36.916 4.708 -14.051
90 HH22 ARG 9 HH22 ARG 9 36.170 5.870 -15.095
91 H ASP 10 HN ASP 10 45.821 5.476 -13.201
92 HA ASP 10 HA ASP 10 44.991 2.679 -13.172
93 HB2 ASP 10 HB2 ASP 10 47.155 4.235 -14.696
94 HB3 ASP 10 HB1 ASP 10 47.228 2.436 -14.627
95 H PHE 11 HN PHE 11 47.469 4.771 -11.663
96 HA PHE 11 HA PHE 11 48.960 2.538 -10.793
97 HB2 PHE 11 HB2 PHE 11 50.662 4.002 -10.783
98 HB3 PHE 11 HB1 PHE 11 49.487 5.319 -11.083
99 HD1 PHE 11 HD1 PHE 11 51.033 3.355 -8.163
100 HD2 PHE 11 HD2 PHE 11 49.095 6.831 -9.614
101 HE1 PHE 11 HE1 PHE 11 51.110 4.380 -5.944
102 HE2 PHE 11 HE2 PHE 11 49.203 7.813 -7.461
103 HZ PHE 11 HZ PHE 11 50.151 6.628 -5.588
104 H ILE 12 HN ILE 12 46.708 4.675 -9.064
105 HA ILE 12 HA ILE 12 47.253 3.519 -6.559
106 HB ILE 12 HB ILE 12 44.969 5.062 -7.765
107 HG12 ILE 12 HG12 ILE 12 47.138 5.791 -5.733
108 HG13 ILE 12 HG11 ILE 12 47.198 6.008 -7.513
109 HG21 ILE 12 HG21 ILE 12 44.224 5.438 -5.220
110 HG22 ILE 12 HG22 ILE 12 45.202 3.975 -4.837
111 HG23 ILE 12 HG23 ILE 12 43.789 3.854 -5.948
112 HD11 ILE 12 HD11 ILE 12 45.290 7.532 -7.469
113 HD12 ILE 12 HD12 ILE 12 46.649 8.083 -6.385
114 HD13 ILE 12 HD13 ILE 12 45.167 7.347 -5.670
115 H LEU 13 HN LEU 13 45.110 2.687 -9.246
116 HA LEU 13 HA LEU 13 43.432 0.982 -7.667
117 HB2 LEU 13 HB2 LEU 13 43.842 1.619 -10.572
118 HB3 LEU 13 HB1 LEU 13 42.694 0.317 -10.104
119 HG LEU 13 HG LEU 13 41.732 2.595 -10.567
120 HD11 LEU 13 HD11 LEU 13 41.026 1.582 -7.759
121 HD12 LEU 13 HD12 LEU 13 40.462 0.843 -9.306
122 HD13 LEU 13 HD13 LEU 13 39.965 2.521 -8.875
123 HD21 LEU 13 HD21 LEU 13 43.523 4.015 -9.316
124 HD22 LEU 13 HD22 LEU 13 42.606 3.631 -7.806
125 HD23 LEU 13 HD23 LEU 13 41.797 4.517 -9.148
126 H GLN 14 HN GLN 14 46.511 0.497 -9.229
127 HA GLN 14 HA GLN 14 46.229 -2.402 -9.412
128 HB2 GLN 14 HB2 GLN 14 48.587 -0.483 -9.864
129 HB3 GLN 14 HB1 GLN 14 48.809 -2.274 -9.885
130 HG2 GLN 14 HG2 GLN 14 47.205 -2.491 -11.783
131 HG3 GLN 14 HG1 GLN 14 46.891 -0.717 -11.763
132 HE21 GLN 14 HE21 GLN 14 48.801 0.775 -12.274
133 HE22 GLN 14 HE22 GLN 14 50.089 0.186 -13.270
134 H ARG 15 HN ARG 15 46.774 -0.237 -6.783
135 HA ARG 15 HA ARG 15 48.502 -2.159 -5.365
136 HB2 ARG 15 HB2 ARG 15 47.883 0.785 -4.790
137 HB3 ARG 15 HB1 ARG 15 48.883 -0.283 -3.728
138 HG2 ARG 15 HG2 ARG 15 50.376 -0.731 -5.797
139 HG3 ARG 15 HG1 ARG 15 49.480 0.601 -6.615
140 HD2 ARG 15 HD2 ARG 15 50.166 2.183 -4.783
141 HD3 ARG 15 HD1 ARG 15 51.083 0.823 -3.993
142 HE ARG 15 HE ARG 15 51.909 1.124 -6.773
143 HH11 ARG 15 HH11 ARG 15 52.277 2.701 -3.550
144 HH12 ARG 15 HH12 ARG 15 53.811 3.411 -3.929
145 HH21 ARG 15 HH21 ARG 15 53.968 2.118 -7.235
146 HH22 ARG 15 HH22 ARG 15 54.777 3.077 -6.042
147 H LYS 16 HN LYS 16 45.509 -2.466 -5.918
148 HA LYS 16 HA LYS 16 44.382 -2.149 -3.228
149 HB2 LYS 16 HB2 LYS 16 43.076 -3.183 -5.833
150 HB3 LYS 16 HB1 LYS 16 42.215 -2.863 -4.287
151 HG2 LYS 16 HG2 LYS 16 43.677 -0.708 -5.941
152 HG3 LYS 16 HG1 LYS 16 41.942 -1.103 -6.115
153 HD2 LYS 16 HD2 LYS 16 41.560 -0.434 -3.714
154 HD3 LYS 16 HD1 LYS 16 43.303 -0.020 -3.549
155 HE2 LYS 16 HE2 LYS 16 43.062 1.733 -5.351
156 HE3 LYS 16 HE1 LYS 16 41.303 1.329 -5.497
157 HZ1 LYS 16 HZ1 LYS 16 42.736 2.795 -3.439
158 HZ2 LYS 16 HZ2 LYS 16 41.506 1.759 -2.891
159 HZ3 LYS 16 HZ3 LYS 16 41.154 2.971 -4.028
160 H LYS 17 HN LYS 17 46.087 -4.400 -5.214
161 HA LYS 17 HA LYS 17 46.523 -6.523 -5.193
162 HB2 LYS 17 HB2 LYS 17 45.897 -6.339 -2.179
163 HB3 LYS 17 HB1 LYS 17 46.716 -7.742 -2.952
164 HG2 LYS 17 HG2 LYS 17 48.732 -6.718 -2.839
165 HG3 LYS 17 HG1 LYS 17 48.136 -5.299 -3.760
166 HD2 LYS 17 HD2 LYS 17 47.303 -4.251 -1.664
167 HD3 LYS 17 HD1 LYS 17 47.805 -5.697 -0.711
168 HE2 LYS 17 HE2 LYS 17 50.231 -5.252 -1.391
169 HE3 LYS 17 HE1 LYS 17 49.678 -3.747 -2.238
170 HZ1 LYS 17 HZ1 LYS 17 50.252 -2.958 -0.221
171 HZ2 LYS 17 HZ2 LYS 17 49.817 -4.362 0.629
172 HZ3 LYS 17 HZ3 LYS 17 48.615 -3.292 0.086
Start of MODEL 17
1 H1 GLU 1 HT1 GLU 1 51.006 23.254 -20.030
2 H2 GLU 1 HT2 GLU 1 52.002 22.259 -19.080
3 H3 GLU 1 HT3 GLU 1 51.042 23.451 -18.344
4 HA GLU 1 HA GLU 1 49.470 21.998 -18.051
5 HB2 GLU 1 HB2 GLU 1 49.558 21.936 -21.141
6 HB3 GLU 1 HB1 GLU 1 48.343 20.967 -20.225
7 HG2 GLU 1 HG2 GLU 1 47.443 23.079 -19.154
8 HG3 GLU 1 HG1 GLU 1 48.645 24.058 -20.083
9 H MET 2 HN MET 2 49.857 20.115 -16.967
10 HA MET 2 HA MET 2 51.125 17.903 -18.455
11 HB2 MET 2 HB2 MET 2 51.677 18.752 -15.527
12 HB3 MET 2 HB1 MET 2 52.207 17.186 -16.240
13 HG2 MET 2 HG2 MET 2 53.610 18.413 -17.906
14 HG3 MET 2 HG1 MET 2 53.084 19.980 -17.206
15 HE1 MET 2 HE1 MET 2 56.866 19.695 -16.241
16 HE2 MET 2 HE2 MET 2 55.584 20.651 -17.060
17 HE3 MET 2 HE3 MET 2 56.062 19.046 -17.713
18 H ARG 3 HN ARG 3 50.467 15.754 -17.678
19 HA ARG 3 HA ARG 3 47.850 15.823 -16.296
20 HB2 ARG 3 HB2 ARG 3 48.916 13.827 -18.409
21 HB3 ARG 3 HB1 ARG 3 47.359 13.643 -17.517
22 HG2 ARG 3 HG2 ARG 3 46.527 15.788 -18.536
23 HG3 ARG 3 HG1 ARG 3 48.074 15.959 -19.439
24 HD2 ARG 3 HD2 ARG 3 47.591 13.773 -20.653
25 HD3 ARG 3 HD1 ARG 3 46.001 13.666 -19.770
26 HE ARG 3 HE ARG 3 46.170 16.254 -21.040
27 HH11 ARG 3 HH11 ARG 3 45.836 12.773 -21.944
28 HH12 ARG 3 HH12 ARG 3 45.003 13.105 -23.426
29 HH21 ARG 3 HH21 ARG 3 45.045 16.640 -23.054
30 HH22 ARG 3 HH22 ARG 3 44.552 15.319 -24.060
31 H LEU 4 HN LEU 4 47.506 14.280 -14.622
32 HA LEU 4 HA LEU 4 49.571 12.361 -14.012
33 HB2 LEU 4 HB2 LEU 4 49.778 14.968 -12.821
34 HB3 LEU 4 HB1 LEU 4 48.995 13.982 -11.550
35 HG LEU 4 HG LEU 4 51.525 12.926 -12.942
36 HD11 LEU 4 HD11 LEU 4 52.112 15.266 -12.310
37 HD12 LEU 4 HD12 LEU 4 52.993 14.073 -11.285
38 HD13 LEU 4 HD13 LEU 4 51.571 14.961 -10.615
39 HD21 LEU 4 HD21 LEU 4 50.426 12.584 -10.064
40 HD22 LEU 4 HD22 LEU 4 51.946 11.847 -10.700
41 HD23 LEU 4 HD23 LEU 4 50.357 11.365 -11.391
42 H SER 5 HN SER 5 46.451 13.028 -14.571
43 HA SER 5 HA SER 5 45.273 11.964 -12.155
44 HB2 SER 5 HB2 SER 5 44.019 12.751 -14.866
45 HB3 SER 5 HB1 SER 5 43.067 12.175 -13.435
46 HG SER 5 HG SER 5 44.870 14.196 -12.925
47 H LYS 6 HN LYS 6 46.048 10.750 -15.486
48 HA LYS 6 HA LYS 6 44.572 8.275 -15.058
49 HB2 LYS 6 HB2 LYS 6 46.515 9.157 -17.290
50 HB3 LYS 6 HB1 LYS 6 45.639 7.579 -17.271
51 HG2 LYS 6 HG2 LYS 6 43.439 8.815 -17.269
52 HG3 LYS 6 HG1 LYS 6 44.326 10.378 -17.336
53 HD2 LYS 6 HD2 LYS 6 45.354 9.700 -19.524
54 HD3 LYS 6 HD1 LYS 6 44.470 8.135 -19.452
55 HE2 LYS 6 HE2 LYS 6 42.266 9.367 -19.549
56 HE3 LYS 6 HE1 LYS 6 43.155 10.945 -19.612
57 HZ1 LYS 6 HZ1 LYS 6 43.105 10.661 -21.778
58 HZ2 LYS 6 HZ2 LYS 6 42.629 9.035 -21.678
59 HZ3 LYS 6 HZ3 LYS 6 44.275 9.444 -21.597
60 H PHE 7 HN PHE 7 47.692 9.547 -14.225
61 HA PHE 7 HA PHE 7 49.268 7.172 -14.323
62 HB2 PHE 7 HB2 PHE 7 49.460 9.954 -13.038
63 HB3 PHE 7 HB1 PHE 7 50.635 8.676 -12.521
64 HD1 PHE 7 HD1 PHE 7 49.375 10.553 -15.571
65 HD2 PHE 7 HD2 PHE 7 52.573 8.297 -13.838
66 HE1 PHE 7 HE1 PHE 7 50.823 11.131 -17.448
67 HE2 PHE 7 HE2 PHE 7 53.990 8.896 -15.732
68 HZ PHE 7 HZ PHE 7 53.124 10.309 -17.535
69 H PHE 8 HN PHE 8 47.172 8.855 -12.083
70 HA PHE 8 HA PHE 8 47.983 7.274 -9.815
71 HB2 PHE 8 HB2 PHE 8 46.932 9.929 -10.486
72 HB3 PHE 8 HB1 PHE 8 45.876 9.129 -9.268
73 HD1 PHE 8 HD1 PHE 8 49.578 8.904 -9.810
74 HD2 PHE 8 HD2 PHE 8 46.440 10.196 -7.191
75 HE1 PHE 8 HE1 PHE 8 51.226 9.735 -8.245
76 HE2 PHE 8 HE2 PHE 8 48.130 10.964 -5.579
77 HZ PHE 8 HZ PHE 8 50.525 10.743 -6.098
78 H ARG 9 HN ARG 9 45.635 7.319 -12.273
79 HA ARG 9 HA ARG 9 43.634 5.998 -10.735
80 HB2 ARG 9 HB2 ARG 9 43.297 7.482 -12.826
81 HB3 ARG 9 HB1 ARG 9 44.070 6.191 -13.798
82 HG2 ARG 9 HG2 ARG 9 42.221 4.622 -13.046
83 HG3 ARG 9 HG1 ARG 9 41.459 6.005 -12.198
84 HD2 ARG 9 HD2 ARG 9 40.312 5.873 -14.304
85 HD3 ARG 9 HD1 ARG 9 41.505 7.229 -14.504
86 HE ARG 9 HE ARG 9 42.721 4.730 -15.360
87 HH11 ARG 9 HH11 ARG 9 40.253 7.135 -16.441
88 HH12 ARG 9 HH12 ARG 9 40.464 6.783 -18.124
89 HH21 ARG 9 HH21 ARG 9 42.963 4.302 -17.640
90 HH22 ARG 9 HH22 ARG 9 42.015 5.160 -18.809
91 H ASP 10 HN ASP 10 46.401 5.133 -12.876
92 HA ASP 10 HA ASP 10 45.573 2.337 -12.659
93 HB2 ASP 10 HB2 ASP 10 47.889 3.745 -14.108
94 HB3 ASP 10 HB1 ASP 10 47.837 1.947 -13.976
95 H PHE 11 HN PHE 11 47.613 4.519 -10.810
96 HA PHE 11 HA PHE 11 49.067 2.286 -9.806
97 HB2 PHE 11 HB2 PHE 11 50.799 3.719 -9.599
98 HB3 PHE 11 HB1 PHE 11 49.708 5.051 -10.087
99 HD1 PHE 11 HD1 PHE 11 50.830 3.152 -6.938
100 HD2 PHE 11 HD2 PHE 11 49.123 6.598 -8.715
101 HE1 PHE 11 HE1 PHE 11 50.610 4.225 -4.752
102 HE2 PHE 11 HE2 PHE 11 48.935 7.632 -6.589
103 HZ PHE 11 HZ PHE 11 49.608 6.488 -4.579
104 H ILE 12 HN ILE 12 46.652 4.501 -8.466
105 HA ILE 12 HA ILE 12 46.836 3.434 -5.864
106 HB ILE 12 HB ILE 12 44.746 4.934 -7.430
107 HG12 ILE 12 HG12 ILE 12 46.632 5.779 -5.182
108 HG13 ILE 12 HG11 ILE 12 46.913 5.905 -6.951
109 HG21 ILE 12 HG21 ILE 12 43.348 3.793 -5.703
110 HG22 ILE 12 HG22 ILE 12 43.663 5.429 -5.039
111 HG23 ILE 12 HG23 ILE 12 44.607 4.020 -4.432
112 HD11 ILE 12 HD11 ILE 12 46.200 8.022 -5.960
113 HD12 ILE 12 HD12 ILE 12 44.618 7.293 -5.496
114 HD13 ILE 12 HD13 ILE 12 45.062 7.432 -7.251
115 H LEU 13 HN LEU 13 44.985 2.596 -8.755
116 HA LEU 13 HA LEU 13 43.010 1.077 -7.368
117 HB2 LEU 13 HB2 LEU 13 43.863 1.527 -10.214
118 HB3 LEU 13 HB1 LEU 13 42.588 0.313 -9.861
119 HG LEU 13 HG LEU 13 41.825 2.605 -10.582
120 HD11 LEU 13 HD11 LEU 13 39.835 2.715 -9.141
121 HD12 LEU 13 HD12 LEU 13 40.676 1.776 -7.850
122 HD13 LEU 13 HD13 LEU 13 40.288 0.993 -9.430
123 HD21 LEU 13 HD21 LEU 13 41.775 4.588 -9.226
124 HD22 LEU 13 HD22 LEU 13 43.485 4.016 -9.175
125 HD23 LEU 13 HD23 LEU 13 42.388 3.731 -7.764
126 H GLN 14 HN GLN 14 46.056 0.167 -9.074
127 HA GLN 14 HA GLN 14 45.402 -2.652 -8.927
128 HB2 GLN 14 HB2 GLN 14 48.037 -1.285 -9.751
129 HB3 GLN 14 HB1 GLN 14 47.674 -3.047 -9.930
130 HG2 GLN 14 HG2 GLN 14 45.640 -2.351 -11.405
131 HG3 GLN 14 HG1 GLN 14 46.321 -0.676 -11.386
132 HE21 GLN 14 HE21 GLN 14 48.311 -0.242 -12.637
133 HE22 GLN 14 HE22 GLN 14 49.000 -1.421 -13.699
134 H ARG 15 HN ARG 15 46.399 -0.609 -6.388
135 HA ARG 15 HA ARG 15 48.327 -2.513 -5.306
136 HB2 ARG 15 HB2 ARG 15 47.424 0.244 -4.416
137 HB3 ARG 15 HB1 ARG 15 48.365 -0.833 -3.315
138 HG2 ARG 15 HG2 ARG 15 50.155 -1.045 -5.085
139 HG3 ARG 15 HG1 ARG 15 49.233 0.082 -6.126
140 HD2 ARG 15 HD2 ARG 15 50.992 1.358 -5.039
141 HD3 ARG 15 HD1 ARG 15 49.432 1.835 -4.250
142 HE ARG 15 HE ARG 15 50.624 -0.357 -2.769
143 HH11 ARG 15 HH11 ARG 15 51.159 3.161 -3.385
144 HH12 ARG 15 HH12 ARG 15 51.933 3.438 -1.861
145 HH21 ARG 15 HH21 ARG 15 51.669 0.083 -0.728
146 HH22 ARG 15 HH22 ARG 15 52.223 1.677 -0.343
147 H LYS 16 HN LYS 16 44.967 -2.322 -5.416
148 HA LYS 16 HA LYS 16 44.723 -3.617 -2.778
149 HB2 LYS 16 HB2 LYS 16 42.559 -2.059 -4.341
150 HB3 LYS 16 HB1 LYS 16 42.310 -2.894 -2.766
151 HG2 LYS 16 HG2 LYS 16 44.256 -0.521 -3.193
152 HG3 LYS 16 HG1 LYS 16 42.557 -0.356 -2.651
153 HD2 LYS 16 HD2 LYS 16 43.087 -1.764 -0.609
154 HD3 LYS 16 HD1 LYS 16 44.802 -1.871 -1.139
155 HE2 LYS 16 HE2 LYS 16 45.027 0.636 -0.957
156 HE3 LYS 16 HE1 LYS 16 43.300 0.746 -0.416
157 HZ1 LYS 16 HZ1 LYS 16 45.622 -0.462 0.970
158 HZ2 LYS 16 HZ2 LYS 16 44.029 -0.881 1.385
159 HZ3 LYS 16 HZ3 LYS 16 44.543 0.733 1.508
160 H LYS 17 HN LYS 17 44.976 -4.152 -6.112
161 HA LYS 17 HA LYS 17 42.961 -6.262 -6.110
162 HB2 LYS 17 HB2 LYS 17 44.737 -5.022 -8.293
163 HB3 LYS 17 HB1 LYS 17 43.710 -6.477 -8.582
164 HG2 LYS 17 HG2 LYS 17 41.659 -5.190 -8.037
165 HG3 LYS 17 HG1 LYS 17 42.635 -3.736 -7.635
166 HD2 LYS 17 HD2 LYS 17 43.466 -3.623 -9.974
167 HD3 LYS 17 HD1 LYS 17 42.526 -5.098 -10.405
168 HE2 LYS 17 HE2 LYS 17 40.369 -3.864 -9.876
169 HE3 LYS 17 HE1 LYS 17 41.331 -2.383 -9.473
170 HZ1 LYS 17 HZ1 LYS 17 40.567 -3.461 -12.016
171 HZ2 LYS 17 HZ2 LYS 17 42.227 -3.118 -11.936
172 HZ3 LYS 17 HZ3 LYS 17 41.093 -1.903 -11.592
Start of MODEL 18
1 H1 GLU 1 HT1 GLU 1 49.891 22.511 -19.049
2 H2 GLU 1 HT2 GLU 1 50.167 21.432 -17.767
3 H3 GLU 1 HT3 GLU 1 48.971 21.088 -18.923
4 HA GLU 1 HA GLU 1 50.804 21.136 -20.616
5 HB2 GLU 1 HB2 GLU 1 52.403 20.963 -17.978
6 HB3 GLU 1 HB1 GLU 1 53.071 20.298 -19.515
7 HG2 GLU 1 HG2 GLU 1 52.907 22.581 -20.595
8 HG3 GLU 1 HG1 GLU 1 52.243 23.260 -19.056
9 H MET 2 HN MET 2 51.082 19.137 -17.548
10 HA MET 2 HA MET 2 50.059 16.830 -19.075
11 HB2 MET 2 HB2 MET 2 52.442 16.835 -17.094
12 HB3 MET 2 HB1 MET 2 51.642 15.344 -17.712
13 HG2 MET 2 HG2 MET 2 52.309 15.949 -20.044
14 HG3 MET 2 HG1 MET 2 53.100 17.441 -19.440
15 HE1 MET 2 HE1 MET 2 55.233 16.800 -20.729
16 HE2 MET 2 HE2 MET 2 54.432 15.299 -21.310
17 HE3 MET 2 HE3 MET 2 56.085 15.221 -20.609
18 H ARG 3 HN ARG 3 48.960 15.223 -17.711
19 HA ARG 3 HA ARG 3 47.926 16.426 -15.214
20 HB2 ARG 3 HB2 ARG 3 46.635 14.363 -17.126
21 HB3 ARG 3 HB1 ARG 3 45.928 14.876 -15.548
22 HG2 ARG 3 HG2 ARG 3 45.753 17.234 -16.389
23 HG3 ARG 3 HG1 ARG 3 46.454 16.728 -17.968
24 HD2 ARG 3 HD2 ARG 3 44.482 15.169 -18.336
25 HD3 ARG 3 HD1 ARG 3 43.766 15.736 -16.760
26 HE ARG 3 HE ARG 3 44.357 18.053 -18.373
27 HH11 ARG 3 HH11 ARG 3 42.106 15.230 -18.360
28 HH12 ARG 3 HH12 ARG 3 40.860 16.056 -19.235
29 HH21 ARG 3 HH21 ARG 3 42.642 19.116 -19.554
30 HH22 ARG 3 HH22 ARG 3 41.169 18.281 -19.919
31 H LEU 4 HN LEU 4 47.970 15.177 -13.315
32 HA LEU 4 HA LEU 4 49.417 12.620 -13.538
33 HB2 LEU 4 HB2 LEU 4 49.368 14.687 -11.252
34 HB3 LEU 4 HB1 LEU 4 50.114 13.057 -11.098
35 HG LEU 4 HG LEU 4 51.013 15.174 -13.163
36 HD11 LEU 4 HD11 LEU 4 51.392 16.023 -10.847
37 HD12 LEU 4 HD12 LEU 4 52.953 15.640 -11.665
38 HD13 LEU 4 HD13 LEU 4 52.285 14.512 -10.423
39 HD21 LEU 4 HD21 LEU 4 51.780 13.057 -14.009
40 HD22 LEU 4 HD22 LEU 4 52.153 12.414 -12.365
41 HD23 LEU 4 HD23 LEU 4 53.200 13.687 -13.097
42 H SER 5 HN SER 5 46.337 13.596 -13.505
43 HA SER 5 HA SER 5 45.409 12.134 -11.173
44 HB2 SER 5 HB2 SER 5 43.864 13.463 -13.504
45 HB3 SER 5 HB1 SER 5 43.079 12.675 -12.072
46 HG SER 5 HG SER 5 45.050 14.649 -11.721
47 H LYS 6 HN LYS 6 46.170 11.528 -14.550
48 HA LYS 6 HA LYS 6 44.512 9.139 -14.724
49 HB2 LYS 6 HB2 LYS 6 46.556 10.380 -16.671
50 HB3 LYS 6 HB1 LYS 6 45.555 8.918 -17.023
51 HG2 LYS 6 HG2 LYS 6 43.460 10.290 -16.723
52 HG3 LYS 6 HG1 LYS 6 44.463 11.749 -16.405
53 HD2 LYS 6 HD2 LYS 6 45.464 11.555 -18.697
54 HD3 LYS 6 HD1 LYS 6 44.449 10.102 -19.010
55 HE2 LYS 6 HE2 LYS 6 42.359 11.501 -18.756
56 HE3 LYS 6 HE1 LYS 6 43.381 12.962 -18.429
57 HZ1 LYS 6 HZ1 LYS 6 42.595 12.743 -20.727
58 HZ2 LYS 6 HZ2 LYS 6 43.513 11.326 -20.911
59 HZ3 LYS 6 HZ3 LYS 6 44.287 12.805 -20.602
60 H PHE 7 HN PHE 7 47.656 10.116 -13.606
61 HA PHE 7 HA PHE 7 49.101 7.675 -14.036
62 HB2 PHE 7 HB2 PHE 7 49.481 10.273 -12.481
63 HB3 PHE 7 HB1 PHE 7 50.449 8.855 -11.938
64 HD1 PHE 7 HD1 PHE 7 49.670 10.880 -15.073
65 HD2 PHE 7 HD2 PHE 7 52.525 8.493 -12.954
66 HE1 PHE 7 HE1 PHE 7 51.370 11.407 -16.734
67 HE2 PHE 7 HE2 PHE 7 54.198 9.044 -14.639
68 HZ PHE 7 HZ PHE 7 53.630 10.496 -16.524
69 H PHE 8 HN PHE 8 46.959 9.136 -11.737
70 HA PHE 8 HA PHE 8 47.624 7.329 -9.601
71 HB2 PHE 8 HB2 PHE 8 46.609 10.045 -10.040
72 HB3 PHE 8 HB1 PHE 8 45.468 9.116 -8.998
73 HD1 PHE 8 HD1 PHE 8 49.202 9.023 -9.349
74 HD2 PHE 8 HD2 PHE 8 45.885 9.811 -6.751
75 HE1 PHE 8 HE1 PHE 8 50.735 9.621 -7.583
76 HE2 PHE 8 HE2 PHE 8 47.463 10.356 -4.945
77 HZ PHE 8 HZ PHE 8 49.888 10.268 -5.352
78 H ARG 9 HN ARG 9 45.522 7.586 -12.234
79 HA ARG 9 HA ARG 9 43.458 6.025 -10.988
80 HB2 ARG 9 HB2 ARG 9 42.981 7.791 -12.777
81 HB3 ARG 9 HB1 ARG 9 44.060 6.928 -13.905
82 HG2 ARG 9 HG2 ARG 9 41.799 6.503 -14.566
83 HG3 ARG 9 HG1 ARG 9 42.468 4.979 -13.904
84 HD2 ARG 9 HD2 ARG 9 41.233 5.339 -11.754
85 HD3 ARG 9 HD1 ARG 9 40.595 6.924 -12.379
86 HE ARG 9 HE ARG 9 39.866 5.017 -14.330
87 HH11 ARG 9 HH11 ARG 9 39.252 5.418 -10.794
88 HH12 ARG 9 HH12 ARG 9 37.718 4.616 -10.842
89 HH21 ARG 9 HH21 ARG 9 37.798 3.944 -14.330
90 HH22 ARG 9 HH22 ARG 9 36.888 3.773 -12.866
91 H ASP 10 HN ASP 10 46.484 5.669 -12.837
92 HA ASP 10 HA ASP 10 45.813 2.875 -13.345
93 HB2 ASP 10 HB2 ASP 10 48.388 4.466 -13.966
94 HB3 ASP 10 HB1 ASP 10 48.098 2.759 -14.470
95 H PHE 11 HN PHE 11 47.677 4.784 -10.996
96 HA PHE 11 HA PHE 11 49.048 2.452 -10.134
97 HB2 PHE 11 HB2 PHE 11 50.699 3.879 -9.594
98 HB3 PHE 11 HB1 PHE 11 49.613 5.239 -10.016
99 HD1 PHE 11 HD1 PHE 11 50.624 3.039 -7.054
100 HD2 PHE 11 HD2 PHE 11 48.749 6.543 -8.523
101 HE1 PHE 11 HE1 PHE 11 50.187 3.814 -4.775
102 HE2 PHE 11 HE2 PHE 11 48.352 7.282 -6.306
103 HZ PHE 11 HZ PHE 11 48.996 5.952 -4.407
104 H ILE 12 HN ILE 12 46.416 4.387 -8.742
105 HA ILE 12 HA ILE 12 46.439 2.977 -6.303
106 HB ILE 12 HB ILE 12 44.415 4.610 -7.815
107 HG12 ILE 12 HG12 ILE 12 46.120 5.122 -5.327
108 HG13 ILE 12 HG11 ILE 12 46.472 5.576 -7.027
109 HG21 ILE 12 HG21 ILE 12 43.106 4.694 -5.491
110 HG22 ILE 12 HG22 ILE 12 44.058 3.242 -5.016
111 HG23 ILE 12 HG23 ILE 12 42.933 3.166 -6.421
112 HD11 ILE 12 HD11 ILE 12 44.100 6.618 -5.422
113 HD12 ILE 12 HD12 ILE 12 44.543 7.048 -7.125
114 HD13 ILE 12 HD13 ILE 12 45.659 7.467 -5.744
115 H LEU 13 HN LEU 13 44.953 2.439 -9.462
116 HA LEU 13 HA LEU 13 43.007 0.579 -8.508
117 HB2 LEU 13 HB2 LEU 13 44.112 1.494 -11.151
118 HB3 LEU 13 HB1 LEU 13 42.925 0.142 -11.111
119 HG LEU 13 HG LEU 13 42.051 2.485 -11.570
120 HD11 LEU 13 HD11 LEU 13 40.676 1.057 -9.231
121 HD12 LEU 13 HD12 LEU 13 40.533 0.618 -10.972
122 HD13 LEU 13 HD13 LEU 13 39.905 2.203 -10.388
123 HD21 LEU 13 HD21 LEU 13 43.371 3.776 -9.779
124 HD22 LEU 13 HD22 LEU 13 42.214 3.119 -8.550
125 HD23 LEU 13 HD23 LEU 13 41.611 4.166 -9.876
126 H GLN 14 HN GLN 14 46.363 0.255 -9.583
127 HA GLN 14 HA GLN 14 46.205 -2.625 -9.930
128 HB2 GLN 14 HB2 GLN 14 48.569 -0.657 -9.836
129 HB3 GLN 14 HB1 GLN 14 48.789 -2.437 -10.050
130 HG2 GLN 14 HG2 GLN 14 47.545 -2.413 -12.179
131 HG3 GLN 14 HG1 GLN 14 47.085 -0.682 -11.945
132 HE21 GLN 14 HE21 GLN 14 48.205 -0.082 -14.005
133 HE22 GLN 14 HE22 GLN 14 49.930 0.013 -14.072
134 H ARG 15 HN ARG 15 46.368 -0.574 -7.129
135 HA ARG 15 HA ARG 15 47.835 -2.600 -5.577
136 HB2 ARG 15 HB2 ARG 15 47.252 0.347 -5.010
137 HB3 ARG 15 HB1 ARG 15 47.953 -0.788 -3.788
138 HG2 ARG 15 HG2 ARG 15 49.800 -1.333 -5.463
139 HG3 ARG 15 HG1 ARG 15 49.165 -0.013 -6.512
140 HD2 ARG 15 HD2 ARG 15 49.517 1.615 -4.592
141 HD3 ARG 15 HD1 ARG 15 50.268 0.252 -3.649
142 HE ARG 15 HE ARG 15 51.548 0.457 -6.247
143 HH11 ARG 15 HH11 ARG 15 51.415 2.145 -3.062
144 HH12 ARG 15 HH12 ARG 15 52.965 2.894 -3.251
145 HH21 ARG 15 HH21 ARG 15 53.624 1.497 -6.451
146 HH22 ARG 15 HH22 ARG 15 54.228 2.522 -5.194
147 H LYS 16 HN LYS 16 45.039 -2.957 -6.549
148 HA LYS 16 HA LYS 16 43.556 -2.844 -4.007
149 HB2 LYS 16 HB2 LYS 16 42.581 -3.217 -6.895
150 HB3 LYS 16 HB1 LYS 16 41.535 -3.331 -5.426
151 HG2 LYS 16 HG2 LYS 16 42.523 -0.896 -4.889
152 HG3 LYS 16 HG1 LYS 16 42.919 -0.890 -6.642
153 HD2 LYS 16 HD2 LYS 16 40.527 -1.343 -7.191
154 HD3 LYS 16 HD1 LYS 16 40.147 -1.403 -5.432
155 HE2 LYS 16 HE2 LYS 16 40.815 1.023 -5.201
156 HE3 LYS 16 HE1 LYS 16 41.197 1.083 -6.971
157 HZ1 LYS 16 HZ1 LYS 16 38.864 0.441 -7.368
158 HZ2 LYS 16 HZ2 LYS 16 39.040 1.940 -6.591
159 HZ3 LYS 16 HZ3 LYS 16 38.552 0.576 -5.705
160 H LYS 17 HN LYS 17 45.328 -4.527 -3.541
161 HA LYS 17 HA LYS 17 45.209 -7.034 -4.803
162 HB2 LYS 17 HB2 LYS 17 46.184 -6.266 -1.972
163 HB3 LYS 17 HB1 LYS 17 46.554 -7.822 -2.805
164 HG2 LYS 17 HG2 LYS 17 47.807 -6.601 -4.585
165 HG3 LYS 17 HG1 LYS 17 47.404 -5.024 -3.821
166 HD2 LYS 17 HD2 LYS 17 48.639 -5.712 -1.748
167 HD3 LYS 17 HD1 LYS 17 49.054 -7.283 -2.509
168 HE2 LYS 17 HE2 LYS 17 51.018 -5.837 -2.713
169 HE3 LYS 17 HE1 LYS 17 50.291 -5.946 -4.365
170 HZ1 LYS 17 HZ1 LYS 17 49.996 -3.715 -2.412
171 HZ2 LYS 17 HZ2 LYS 17 49.190 -3.815 -3.903
172 HZ3 LYS 17 HZ3 LYS 17 50.884 -3.712 -3.859
Start of MODEL 19
1 H1 GLU 1 HT1 GLU 1 51.337 23.513 -17.737
2 H2 GLU 1 HT2 GLU 1 51.912 22.772 -16.320
3 H3 GLU 1 HT3 GLU 1 50.740 23.998 -16.222
4 HA GLU 1 HA GLU 1 49.447 22.193 -15.951
5 HB2 GLU 1 HB2 GLU 1 49.660 22.704 -18.992
6 HB3 GLU 1 HB1 GLU 1 48.443 21.552 -18.323
7 HG2 GLU 1 HG2 GLU 1 47.424 23.407 -16.936
8 HG3 GLU 1 HG1 GLU 1 48.635 24.572 -17.601
9 H MET 2 HN MET 2 49.661 20.081 -15.339
10 HA MET 2 HA MET 2 51.251 18.294 -17.073
11 HB2 MET 2 HB2 MET 2 51.244 18.426 -13.978
12 HB3 MET 2 HB1 MET 2 51.965 17.075 -14.927
13 HG2 MET 2 HG2 MET 2 53.511 18.772 -16.042
14 HG3 MET 2 HG1 MET 2 52.864 20.025 -14.936
15 HE1 MET 2 HE1 MET 2 54.245 19.321 -11.479
16 HE2 MET 2 HE2 MET 2 52.601 18.874 -12.048
17 HE3 MET 2 HE3 MET 2 53.365 20.398 -12.620
18 H ARG 3 HN ARG 3 50.463 16.105 -17.169
19 HA ARG 3 HA ARG 3 47.763 15.733 -16.014
20 HB2 ARG 3 HB2 ARG 3 48.838 14.782 -18.762
21 HB3 ARG 3 HB1 ARG 3 47.255 14.284 -18.056
22 HG2 ARG 3 HG2 ARG 3 46.425 16.617 -18.146
23 HG3 ARG 3 HG1 ARG 3 48.024 17.211 -18.696
24 HD2 ARG 3 HD2 ARG 3 46.551 17.107 -20.659
25 HD3 ARG 3 HD1 ARG 3 47.752 15.752 -20.822
26 HE ARG 3 HE ARG 3 45.398 14.758 -19.455
27 HH11 ARG 3 HH11 ARG 3 46.401 15.914 -22.726
28 HH12 ARG 3 HH12 ARG 3 45.247 14.934 -23.568
29 HH21 ARG 3 HH21 ARG 3 43.861 13.456 -20.647
30 HH22 ARG 3 HH22 ARG 3 43.793 13.528 -22.376
31 H LEU 4 HN LEU 4 48.182 14.409 -14.266
32 HA LEU 4 HA LEU 4 49.586 11.893 -14.828
33 HB2 LEU 4 HB2 LEU 4 50.025 13.739 -12.386
34 HB3 LEU 4 HB1 LEU 4 50.527 12.013 -12.396
35 HG LEU 4 HG LEU 4 51.588 14.106 -14.400
36 HD11 LEU 4 HD11 LEU 4 52.916 13.145 -11.774
37 HD12 LEU 4 HD12 LEU 4 52.217 14.782 -12.077
38 HD13 LEU 4 HD13 LEU 4 53.660 14.233 -13.009
39 HD21 LEU 4 HD21 LEU 4 53.525 12.380 -14.624
40 HD22 LEU 4 HD22 LEU 4 51.949 11.883 -15.333
41 HD23 LEU 4 HD23 LEU 4 52.470 11.209 -13.742
42 H SER 5 HN SER 5 46.686 12.844 -14.725
43 HA SER 5 HA SER 5 45.712 11.771 -12.225
44 HB2 SER 5 HB2 SER 5 44.220 12.833 -14.714
45 HB3 SER 5 HB1 SER 5 43.399 12.275 -13.197
46 HG SER 5 HG SER 5 45.446 14.055 -12.794
47 H LYS 6 HN LYS 6 46.050 10.673 -15.646
48 HA LYS 6 HA LYS 6 44.357 8.339 -15.210
49 HB2 LYS 6 HB2 LYS 6 46.183 9.146 -17.564
50 HB3 LYS 6 HB1 LYS 6 45.150 7.668 -17.539
51 HG2 LYS 6 HG2 LYS 6 43.102 9.120 -17.282
52 HG3 LYS 6 HG1 LYS 6 44.143 10.586 -17.360
53 HD2 LYS 6 HD2 LYS 6 44.905 9.920 -19.658
54 HD3 LYS 6 HD1 LYS 6 43.868 8.452 -19.574
55 HE2 LYS 6 HE2 LYS 6 41.809 9.909 -19.423
56 HE3 LYS 6 HE1 LYS 6 42.853 11.388 -19.500
57 HZ1 LYS 6 HZ1 LYS 6 43.665 10.534 -21.661
58 HZ2 LYS 6 HZ2 LYS 6 42.012 10.920 -21.638
59 HZ3 LYS 6 HZ3 LYS 6 42.505 9.296 -21.586
60 H PHE 7 HN PHE 7 47.649 9.263 -14.610
61 HA PHE 7 HA PHE 7 48.959 6.755 -14.963
62 HB2 PHE 7 HB2 PHE 7 49.564 9.444 -13.627
63 HB3 PHE 7 HB1 PHE 7 50.617 8.032 -13.211
64 HD1 PHE 7 HD1 PHE 7 49.335 10.026 -16.194
65 HD2 PHE 7 HD2 PHE 7 52.447 7.543 -14.617
66 HE1 PHE 7 HE1 PHE 7 50.708 10.471 -18.157
67 HE2 PHE 7 HE2 PHE 7 53.790 8.013 -16.599
68 HZ PHE 7 HZ PHE 7 52.930 9.471 -18.366
69 H PHE 8 HN PHE 8 47.264 8.510 -12.451
70 HA PHE 8 HA PHE 8 48.116 6.712 -10.366
71 HB2 PHE 8 HB2 PHE 8 47.320 9.502 -10.769
72 HB3 PHE 8 HB1 PHE 8 46.281 8.740 -9.509
73 HD1 PHE 8 HD1 PHE 8 49.875 8.195 -10.432
74 HD2 PHE 8 HD2 PHE 8 47.139 9.509 -7.406
75 HE1 PHE 8 HE1 PHE 8 51.735 8.709 -8.976
76 HE2 PHE 8 HE2 PHE 8 49.041 9.959 -5.913
77 HZ PHE 8 HZ PHE 8 51.342 9.567 -6.689
78 H ARG 9 HN ARG 9 45.583 7.115 -12.579
79 HA ARG 9 HA ARG 9 43.616 5.866 -10.906
80 HB2 ARG 9 HB2 ARG 9 43.164 7.595 -12.745
81 HB3 ARG 9 HB1 ARG 9 43.758 6.415 -13.953
82 HG2 ARG 9 HG2 ARG 9 41.889 4.882 -13.360
83 HG3 ARG 9 HG1 ARG 9 41.321 6.046 -12.121
84 HD2 ARG 9 HD2 ARG 9 39.928 6.442 -14.052
85 HD3 ARG 9 HD1 ARG 9 41.156 7.782 -14.055
86 HE ARG 9 HE ARG 9 42.158 5.557 -15.629
87 HH11 ARG 9 HH11 ARG 9 39.683 8.180 -15.794
88 HH12 ARG 9 HH12 ARG 9 39.683 8.243 -17.525
89 HH21 ARG 9 HH21 ARG 9 42.114 5.689 -17.958
90 HH22 ARG 9 HH22 ARG 9 41.073 6.816 -18.762
91 H ASP 10 HN ASP 10 46.084 5.028 -13.352
92 HA ASP 10 HA ASP 10 45.027 2.310 -13.412
93 HB2 ASP 10 HB2 ASP 10 47.543 3.531 -14.728
94 HB3 ASP 10 HB1 ASP 10 47.011 1.825 -14.967
95 H PHE 11 HN PHE 11 47.539 4.106 -11.634
96 HA PHE 11 HA PHE 11 48.767 1.657 -10.897
97 HB2 PHE 11 HB2 PHE 11 50.652 2.878 -10.725
98 HB3 PHE 11 HB1 PHE 11 49.679 4.351 -11.019
99 HD1 PHE 11 HD1 PHE 11 50.882 2.109 -8.146
100 HD2 PHE 11 HD2 PHE 11 49.319 5.819 -9.479
101 HE1 PHE 11 HE1 PHE 11 50.960 3.006 -5.870
102 HE2 PHE 11 HE2 PHE 11 49.417 6.682 -7.272
103 HZ PHE 11 HZ PHE 11 50.175 5.322 -5.429
104 H ILE 12 HN ILE 12 46.715 3.960 -9.136
105 HA ILE 12 HA ILE 12 47.038 2.635 -6.673
106 HB ILE 12 HB ILE 12 44.950 4.440 -7.878
107 HG12 ILE 12 HG12 ILE 12 47.116 4.895 -5.768
108 HG13 ILE 12 HG11 ILE 12 47.228 5.190 -7.536
109 HG21 ILE 12 HG21 ILE 12 43.627 3.238 -6.129
110 HG22 ILE 12 HG22 ILE 12 44.135 4.775 -5.357
111 HG23 ILE 12 HG23 ILE 12 45.013 3.251 -4.974
112 HD11 ILE 12 HD11 ILE 12 46.814 7.247 -6.304
113 HD12 ILE 12 HD12 ILE 12 45.252 6.595 -5.680
114 HD13 ILE 12 HD13 ILE 12 45.465 6.868 -7.463
115 H LEU 13 HN LEU 13 44.867 2.210 -9.437
116 HA LEU 13 HA LEU 13 42.942 0.676 -7.996
117 HB2 LEU 13 HB2 LEU 13 43.550 1.340 -10.865
118 HB3 LEU 13 HB1 LEU 13 42.234 0.176 -10.489
119 HG LEU 13 HG LEU 13 41.562 2.576 -10.915
120 HD11 LEU 13 HD11 LEU 13 40.050 0.940 -9.744
121 HD12 LEU 13 HD12 LEU 13 39.735 2.654 -9.282
122 HD13 LEU 13 HD13 LEU 13 40.637 1.569 -8.157
123 HD21 LEU 13 HD21 LEU 13 43.455 3.735 -9.564
124 HD22 LEU 13 HD22 LEU 13 42.484 3.383 -8.079
125 HD23 LEU 13 HD23 LEU 13 41.792 4.414 -9.382
126 H GLN 14 HN GLN 14 45.737 -0.219 -10.108
127 HA GLN 14 HA GLN 14 45.042 -2.993 -10.158
128 HB2 GLN 14 HB2 GLN 14 47.687 -1.575 -10.815
129 HB3 GLN 14 HB1 GLN 14 47.446 -3.356 -11.002
130 HG2 GLN 14 HG2 GLN 14 45.502 -2.878 -12.598
131 HG3 GLN 14 HG1 GLN 14 45.894 -1.119 -12.483
132 HE21 GLN 14 HE21 GLN 14 47.985 -0.342 -13.431
133 HE22 GLN 14 HE22 GLN 14 48.856 -1.318 -14.565
134 H ARG 15 HN ARG 15 46.734 -1.041 -7.688
135 HA ARG 15 HA ARG 15 48.322 -3.091 -6.597
136 HB2 ARG 15 HB2 ARG 15 47.174 -0.508 -5.471
137 HB3 ARG 15 HB1 ARG 15 48.168 -1.610 -4.456
138 HG2 ARG 15 HG2 ARG 15 49.521 -1.112 -7.050
139 HG3 ARG 15 HG1 ARG 15 49.061 0.437 -6.275
140 HD2 ARG 15 HD2 ARG 15 51.329 -0.194 -5.558
141 HD3 ARG 15 HD1 ARG 15 50.203 -0.325 -4.146
142 HE ARG 15 HE ARG 15 50.567 -2.865 -5.631
143 HH11 ARG 15 HH11 ARG 15 51.920 -0.794 -2.991
144 HH12 ARG 15 HH12 ARG 15 52.644 -2.124 -2.150
145 HH21 ARG 15 HH21 ARG 15 51.553 -4.611 -4.440
146 HH22 ARG 15 HH22 ARG 15 52.432 -4.305 -2.979
147 H LYS 16 HN LYS 16 44.971 -2.062 -5.956
148 HA LYS 16 HA LYS 16 43.247 -2.866 -4.946
149 HB2 LYS 16 HB2 LYS 16 44.672 -5.574 -5.104
150 HB3 LYS 16 HB1 LYS 16 42.960 -5.368 -4.623
151 HG2 LYS 16 HG2 LYS 16 44.098 -4.559 -7.381
152 HG3 LYS 16 HG1 LYS 16 43.384 -6.163 -7.023
153 HD2 LYS 16 HD2 LYS 16 41.197 -5.001 -6.402
154 HD3 LYS 16 HD1 LYS 16 41.926 -3.430 -6.886
155 HE2 LYS 16 HE2 LYS 16 42.221 -4.270 -9.241
156 HE3 LYS 16 HE1 LYS 16 41.513 -5.869 -8.763
157 HZ1 LYS 16 HZ1 LYS 16 39.832 -3.704 -7.987
158 HZ2 LYS 16 HZ2 LYS 16 39.507 -5.043 -8.981
159 HZ3 LYS 16 HZ3 LYS 16 40.184 -3.634 -9.647
160 H LYS 17 HN LYS 17 44.642 -1.402 -3.396
161 HA LYS 17 HA LYS 17 45.804 -2.651 -1.192
162 HB2 LYS 17 HB2 LYS 17 44.675 0.193 -1.541
163 HB3 LYS 17 HB1 LYS 17 45.625 -0.332 -0.101
164 HG2 LYS 17 HG2 LYS 17 47.590 -0.840 -1.575
165 HG3 LYS 17 HG1 LYS 17 46.642 -0.333 -3.014
166 HD2 LYS 17 HD2 LYS 17 46.421 1.964 -2.093
167 HD3 LYS 17 HD1 LYS 17 47.342 1.486 -0.622
168 HE2 LYS 17 HE2 LYS 17 49.375 1.012 -2.061
169 HE3 LYS 17 HE1 LYS 17 48.438 1.512 -3.530
170 HZ1 LYS 17 HZ1 LYS 17 48.478 3.674 -2.905
171 HZ2 LYS 17 HZ2 LYS 17 49.959 3.163 -2.249
172 HZ3 LYS 17 HZ3 LYS 17 48.605 3.354 -1.242
Start of MODEL 20
1 H1 GLU 1 HT1 GLU 1 46.027 19.616 -17.752
2 H2 GLU 1 HT2 GLU 1 46.358 21.108 -18.494
3 H3 GLU 1 HT3 GLU 1 44.996 20.941 -17.494
4 HA GLU 1 HA GLU 1 47.159 22.057 -16.652
5 HB2 GLU 1 HB2 GLU 1 45.349 20.086 -15.108
6 HB3 GLU 1 HB1 GLU 1 46.624 21.036 -14.257
7 HG2 GLU 1 HG2 GLU 1 45.557 23.195 -15.027
8 HG3 GLU 1 HG1 GLU 1 44.270 22.257 -15.882
9 H MET 2 HN MET 2 46.816 18.481 -15.873
10 HA MET 2 HA MET 2 49.740 18.239 -16.184
11 HB2 MET 2 HB2 MET 2 48.006 17.009 -13.931
12 HB3 MET 2 HB1 MET 2 49.711 16.539 -14.267
13 HG2 MET 2 HG2 MET 2 50.458 18.870 -13.759
14 HG3 MET 2 HG1 MET 2 48.761 19.352 -13.433
15 HE1 MET 2 HE1 MET 2 50.427 19.499 -9.916
16 HE2 MET 2 HE2 MET 2 49.481 20.355 -11.182
17 HE3 MET 2 HE3 MET 2 51.180 19.865 -11.507
18 H ARG 3 HN ARG 3 50.445 16.109 -16.886
19 HA ARG 3 HA ARG 3 48.276 14.538 -18.151
20 HB2 ARG 3 HB2 ARG 3 51.235 14.896 -18.993
21 HB3 ARG 3 HB1 ARG 3 50.086 13.751 -19.780
22 HG2 ARG 3 HG2 ARG 3 48.629 15.689 -20.459
23 HG3 ARG 3 HG1 ARG 3 49.805 16.827 -19.706
24 HD2 ARG 3 HD2 ARG 3 51.604 16.039 -21.309
25 HD3 ARG 3 HD1 ARG 3 50.404 14.903 -22.077
26 HE ARG 3 HE ARG 3 49.280 17.563 -22.079
27 HH11 ARG 3 HH11 ARG 3 51.960 15.716 -23.641
28 HH12 ARG 3 HH12 ARG 3 51.953 16.673 -25.085
29 HH21 ARG 3 HH21 ARG 3 49.316 18.822 -24.054
30 HH22 ARG 3 HH22 ARG 3 50.439 18.451 -25.318
31 H LEU 4 HN LEU 4 49.648 14.495 -15.305
32 HA LEU 4 HA LEU 4 50.751 11.766 -15.433
33 HB2 LEU 4 HB2 LEU 4 51.028 13.950 -13.270
34 HB3 LEU 4 HB1 LEU 4 51.700 12.288 -13.114
35 HG LEU 4 HG LEU 4 52.524 14.289 -15.321
36 HD11 LEU 4 HD11 LEU 4 54.617 14.677 -14.019
37 HD12 LEU 4 HD12 LEU 4 54.005 13.620 -12.689
38 HD13 LEU 4 HD13 LEU 4 53.163 15.169 -13.072
39 HD21 LEU 4 HD21 LEU 4 53.101 12.128 -16.188
40 HD22 LEU 4 HD22 LEU 4 53.550 11.476 -14.566
41 HD23 LEU 4 HD23 LEU 4 54.626 12.667 -15.391
42 H SER 5 HN SER 5 47.749 12.862 -15.331
43 HA SER 5 HA SER 5 46.924 11.838 -12.756
44 HB2 SER 5 HB2 SER 5 44.592 12.473 -13.448
45 HB3 SER 5 HB1 SER 5 45.743 13.845 -13.649
46 HG SER 5 HG SER 5 45.459 12.164 -15.833
47 H LYS 6 HN LYS 6 47.429 10.473 -15.970
48 HA LYS 6 HA LYS 6 45.481 8.319 -15.573
49 HB2 LYS 6 HB2 LYS 6 47.628 8.776 -17.753
50 HB3 LYS 6 HB1 LYS 6 46.455 7.405 -17.740
51 HG2 LYS 6 HG2 LYS 6 44.546 9.049 -17.864
52 HG3 LYS 6 HG1 LYS 6 45.726 10.407 -17.911
53 HD2 LYS 6 HD2 LYS 6 46.700 9.482 -20.037
54 HD3 LYS 6 HD1 LYS 6 45.514 8.130 -19.987
55 HE2 LYS 6 HE2 LYS 6 43.615 9.779 -20.219
56 HE3 LYS 6 HE1 LYS 6 44.805 11.146 -20.251
57 HZ1 LYS 6 HZ1 LYS 6 44.185 9.129 -22.281
58 HZ2 LYS 6 HZ2 LYS 6 45.791 9.671 -22.181
59 HZ3 LYS 6 HZ3 LYS 6 44.533 10.783 -22.436
60 H PHE 7 HN PHE 7 48.790 9.109 -14.766
61 HA PHE 7 HA PHE 7 49.912 6.475 -14.704
62 HB2 PHE 7 HB2 PHE 7 50.694 9.261 -13.669
63 HB3 PHE 7 HB1 PHE 7 51.613 7.822 -13.079
64 HD1 PHE 7 HD1 PHE 7 50.607 9.643 -16.258
65 HD2 PHE 7 HD2 PHE 7 53.406 7.000 -14.390
66 HE1 PHE 7 HE1 PHE 7 52.067 9.788 -18.206
67 HE2 PHE 7 HE2 PHE 7 54.839 7.165 -16.359
68 HZ PHE 7 HZ PHE 7 54.178 8.553 -18.264
69 H PHE 8 HN PHE 8 48.201 8.686 -12.608
70 HA PHE 8 HA PHE 8 48.810 7.196 -10.219
71 HB2 PHE 8 HB2 PHE 8 48.200 9.927 -11.092
72 HB3 PHE 8 HB1 PHE 8 47.042 9.414 -9.807
73 HD1 PHE 8 HD1 PHE 8 50.644 8.537 -10.368
74 HD2 PHE 8 HD2 PHE 8 47.815 10.485 -7.802
75 HE1 PHE 8 HE1 PHE 8 52.441 9.192 -8.888
76 HE2 PHE 8 HE2 PHE 8 49.646 11.078 -6.270
77 HZ PHE 8 HZ PHE 8 51.961 10.441 -6.804
78 H ARG 9 HN ARG 9 46.421 7.395 -12.648
79 HA ARG 9 HA ARG 9 44.323 6.475 -10.937
80 HB2 ARG 9 HB2 ARG 9 44.001 7.838 -13.117
81 HB3 ARG 9 HB1 ARG 9 44.587 6.423 -14.041
82 HG2 ARG 9 HG2 ARG 9 42.357 5.830 -12.137
83 HG3 ARG 9 HG1 ARG 9 41.931 7.024 -13.407
84 HD2 ARG 9 HD2 ARG 9 43.219 4.287 -14.059
85 HD3 ARG 9 HD1 ARG 9 41.422 4.505 -13.897
86 HE ARG 9 HE ARG 9 42.382 6.521 -15.713
87 HH11 ARG 9 HH11 ARG 9 42.070 2.926 -15.588
88 HH12 ARG 9 HH12 ARG 9 41.936 2.749 -17.306
89 HH21 ARG 9 HH21 ARG 9 42.199 6.220 -18.027
90 HH22 ARG 9 HH22 ARG 9 42.010 4.635 -18.700
91 H ASP 10 HN ASP 10 46.955 5.115 -12.994
92 HA ASP 10 HA ASP 10 45.653 2.524 -12.678
93 HB2 ASP 10 HB2 ASP 10 48.275 3.320 -14.105
94 HB3 ASP 10 HB1 ASP 10 47.645 1.632 -14.056
95 H PHE 11 HN PHE 11 48.052 4.431 -10.972
96 HA PHE 11 HA PHE 11 49.172 2.062 -9.852
97 HB2 PHE 11 HB2 PHE 11 51.110 3.214 -9.792
98 HB3 PHE 11 HB1 PHE 11 50.224 4.657 -10.370
99 HD1 PHE 11 HD1 PHE 11 51.223 2.880 -7.129
100 HD2 PHE 11 HD2 PHE 11 49.855 6.372 -9.108
101 HE1 PHE 11 HE1 PHE 11 51.264 4.132 -5.033
102 HE2 PHE 11 HE2 PHE 11 49.907 7.581 -7.066
103 HZ PHE 11 HZ PHE 11 50.550 6.514 -5.001
104 H ILE 12 HN ILE 12 47.141 4.698 -8.643
105 HA ILE 12 HA ILE 12 47.229 3.806 -5.963
106 HB ILE 12 HB ILE 12 45.374 5.515 -7.604
107 HG12 ILE 12 HG12 ILE 12 47.435 6.172 -5.447
108 HG13 ILE 12 HG11 ILE 12 47.677 6.142 -7.226
109 HG21 ILE 12 HG21 ILE 12 43.850 4.732 -5.781
110 HG22 ILE 12 HG22 ILE 12 44.434 6.341 -5.247
111 HG23 ILE 12 HG23 ILE 12 45.158 4.848 -4.544
112 HD11 ILE 12 HD11 ILE 12 47.368 8.403 -6.401
113 HD12 ILE 12 HD12 ILE 12 45.720 7.987 -5.792
114 HD13 ILE 12 HD13 ILE 12 46.064 7.918 -7.573
115 H LEU 13 HN LEU 13 45.232 3.035 -8.768
116 HA LEU 13 HA LEU 13 43.093 1.903 -7.245
117 HB2 LEU 13 HB2 LEU 13 43.938 2.036 -10.128
118 HB3 LEU 13 HB1 LEU 13 42.510 1.045 -9.669
119 HG LEU 13 HG LEU 13 42.067 3.376 -10.534
120 HD11 LEU 13 HD11 LEU 13 40.150 3.868 -9.075
121 HD12 LEU 13 HD12 LEU 13 40.882 2.913 -7.729
122 HD13 LEU 13 HD13 LEU 13 40.344 2.082 -9.239
123 HD21 LEU 13 HD21 LEU 13 43.946 4.624 -9.261
124 HD22 LEU 13 HD22 LEU 13 42.867 4.587 -7.809
125 HD23 LEU 13 HD23 LEU 13 42.331 5.429 -9.307
126 H GLN 14 HN GLN 14 46.020 0.542 -8.780
127 HA GLN 14 HA GLN 14 45.122 -2.186 -8.553
128 HB2 GLN 14 HB2 GLN 14 47.885 -1.003 -9.197
129 HB3 GLN 14 HB1 GLN 14 47.537 -2.776 -9.197
130 HG2 GLN 14 HG2 GLN 14 45.788 -2.443 -10.987
131 HG3 GLN 14 HG1 GLN 14 46.141 -0.669 -10.989
132 HE21 GLN 14 HE21 GLN 14 46.570 -1.362 -13.427
133 HE22 GLN 14 HE22 GLN 14 48.199 -1.793 -13.817
134 H ARG 15 HN ARG 15 45.922 -0.166 -5.968
135 HA ARG 15 HA ARG 15 47.819 -1.722 -4.569
136 HB2 ARG 15 HB2 ARG 15 45.747 0.279 -3.581
137 HB3 ARG 15 HB1 ARG 15 46.908 -0.554 -2.477
138 HG2 ARG 15 HG2 ARG 15 48.798 0.362 -4.006
139 HG3 ARG 15 HG1 ARG 15 47.533 1.381 -4.782
140 HD2 ARG 15 HD2 ARG 15 46.980 2.402 -2.535
141 HD3 ARG 15 HD1 ARG 15 48.268 1.363 -1.780
142 HE ARG 15 HE ARG 15 49.410 2.913 -3.963
143 HH11 ARG 15 HH11 ARG 15 48.175 3.307 -0.590
144 HH12 ARG 15 HH12 ARG 15 49.171 4.681 -0.244
145 HH21 ARG 15 HH21 ARG 15 50.734 4.786 -3.429
146 HH22 ARG 15 HH22 ARG 15 50.629 5.524 -1.866
147 H LYS 16 HN LYS 16 44.251 -1.892 -4.742
148 HA LYS 16 HA LYS 16 44.341 -4.216 -2.932
149 HB2 LYS 16 HB2 LYS 16 42.138 -2.120 -3.409
150 HB3 LYS 16 HB1 LYS 16 41.774 -3.716 -2.666
151 HG2 LYS 16 HG2 LYS 16 43.946 -1.885 -1.468
152 HG3 LYS 16 HG1 LYS 16 42.207 -1.597 -1.131
153 HD2 LYS 16 HD2 LYS 16 42.021 -3.991 -0.267
154 HD3 LYS 16 HD1 LYS 16 43.785 -4.196 -0.517
155 HE2 LYS 16 HE2 LYS 16 42.608 -1.986 1.318
156 HE3 LYS 16 HE1 LYS 16 43.019 -3.646 1.905
157 HZ1 LYS 16 HZ1 LYS 16 44.762 -1.957 2.223
158 HZ2 LYS 16 HZ2 LYS 16 44.943 -1.831 0.539
159 HZ3 LYS 16 HZ3 LYS 16 45.274 -3.301 1.321
160 H LYS 17 HN LYS 17 43.684 -3.002 -6.215
161 HA LYS 17 HA LYS 17 41.982 -5.278 -6.781
162 HB2 LYS 17 HB2 LYS 17 43.078 -3.005 -8.533
163 HB3 LYS 17 HB1 LYS 17 42.083 -4.354 -9.190
164 HG2 LYS 17 HG2 LYS 17 40.183 -3.712 -7.714
165 HG3 LYS 17 HG1 LYS 17 41.167 -2.394 -6.981
166 HD2 LYS 17 HD2 LYS 17 41.361 -1.280 -9.193
167 HD3 LYS 17 HD1 LYS 17 40.410 -2.598 -9.970
168 HE2 LYS 17 HE2 LYS 17 38.407 -1.978 -8.537
169 HE3 LYS 17 HE1 LYS 17 39.373 -0.641 -7.788
170 HZ1 LYS 17 HZ1 LYS 17 38.156 0.330 -9.474
171 HZ2 LYS 17 HZ2 LYS 17 38.437 -0.922 -10.585
172 HZ3 LYS 17 HZ3 LYS 17 39.695 0.137 -10.166