NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
630426 |
6cop   |
30428 | 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 10.242 -20.722 14.741
2 H2 GLU 1 HT2 GLU 1 11.672 -20.091 14.077
3 H3 GLU 1 HT3 GLU 1 10.550 -20.884 13.078
4 HA GLU 1 HA GLU 1 10.632 -18.378 13.028
5 HB2 GLU 1 HB2 GLU 1 8.049 -20.025 13.423
6 HB3 GLU 1 HB1 GLU 1 7.970 -18.266 13.031
7 HG2 GLU 1 HG2 GLU 1 9.275 -18.666 10.899
8 HG3 GLU 1 HG1 GLU 1 9.345 -20.433 11.275
9 H MET 2 HN MET 2 8.297 -19.545 15.630
10 HA MET 2 HA MET 2 9.455 -17.659 17.519
11 HB2 MET 2 HB2 MET 2 6.776 -17.204 16.195
12 HB3 MET 2 HB1 MET 2 6.767 -17.213 18.002
13 HG2 MET 2 HG2 MET 2 8.278 -15.381 18.130
14 HG3 MET 2 HG1 MET 2 8.697 -15.449 16.388
15 HE1 MET 2 HE1 MET 2 8.396 -12.920 16.134
16 HE2 MET 2 HE2 MET 2 8.033 -12.814 17.892
17 HE3 MET 2 HE3 MET 2 6.973 -11.978 16.704
18 H ALA 3 HN ALA 3 9.385 -18.443 19.481
19 HA ALA 3 HA ALA 3 7.553 -20.573 19.962
20 HB1 ALA 3 HB1 ALA 3 8.843 -21.426 21.673
21 HB2 ALA 3 HB2 ALA 3 9.654 -19.823 21.901
22 HB3 ALA 3 HB3 ALA 3 10.070 -20.849 20.473
23 H LEU 4 HN LEU 4 7.341 -17.505 20.178
24 HA LEU 4 HA LEU 4 6.277 -17.558 22.828
25 HB2 LEU 4 HB2 LEU 4 5.293 -15.454 21.150
26 HB3 LEU 4 HB1 LEU 4 6.057 -15.325 22.762
27 HG LEU 4 HG LEU 4 7.497 -15.702 20.137
28 HD11 LEU 4 HD11 LEU 4 6.202 -13.737 19.943
29 HD12 LEU 4 HD12 LEU 4 7.917 -13.196 20.229
30 HD13 LEU 4 HD13 LEU 4 6.697 -13.122 21.572
31 HD21 LEU 4 HD21 LEU 4 9.440 -14.588 21.679
32 HD22 LEU 4 HD22 LEU 4 9.083 -16.371 21.705
33 HD23 LEU 4 HD23 LEU 4 8.430 -15.297 23.012
34 H SER 5 HN SER 5 5.654 -18.271 19.689
35 HA SER 5 HA SER 5 3.157 -17.258 19.481
36 HB2 SER 5 HB2 SER 5 4.583 -17.783 17.640
37 HB3 SER 5 HB1 SER 5 4.557 -19.534 18.069
38 HG SER 5 HG SER 5 3.132 -19.126 16.374
39 H LYS 6 HN LYS 6 4.466 -19.770 21.277
40 HA LYS 6 HA LYS 6 2.111 -21.479 21.509
41 HB2 LYS 6 HB2 LYS 6 4.987 -21.259 22.517
42 HB3 LYS 6 HB1 LYS 6 3.840 -22.309 23.441
43 HG2 LYS 6 HG2 LYS 6 4.567 -23.962 22.061
44 HG3 LYS 6 HG1 LYS 6 3.445 -23.246 20.863
45 HD2 LYS 6 HD2 LYS 6 5.315 -21.881 19.894
46 HD3 LYS 6 HD1 LYS 6 6.446 -22.548 21.125
47 HE2 LYS 6 HE2 LYS 6 6.029 -24.907 20.190
48 HE3 LYS 6 HE1 LYS 6 4.994 -24.171 18.898
49 HZ1 LYS 6 HZ1 LYS 6 7.601 -24.637 18.686
50 HZ2 LYS 6 HZ2 LYS 6 7.646 -23.023 19.213
51 HZ3 LYS 6 HZ3 LYS 6 6.774 -23.437 17.815
52 H PHE 7 HN PHE 7 4.153 -19.097 22.988
53 HA PHE 7 HA PHE 7 2.825 -19.094 25.463
54 HB2 PHE 7 HB2 PHE 7 4.589 -17.017 24.214
55 HB3 PHE 7 HB1 PHE 7 3.981 -16.935 25.907
56 HD1 PHE 7 HD1 PHE 7 6.826 -16.783 25.006
57 HD2 PHE 7 HD2 PHE 7 4.515 -20.140 26.296
58 HE1 PHE 7 HE1 PHE 7 8.801 -17.931 25.683
59 HE2 PHE 7 HE2 PHE 7 6.501 -21.234 26.941
60 HZ PHE 7 HZ PHE 7 8.705 -20.174 26.679
61 H PHE 8 HN PHE 8 2.439 -17.561 22.378
62 HA PHE 8 HA PHE 8 0.647 -15.644 23.084
63 HB2 PHE 8 HB2 PHE 8 1.469 -16.906 20.561
64 HB3 PHE 8 HB1 PHE 8 -0.205 -16.209 20.482
65 HD1 PHE 8 HD1 PHE 8 3.163 -15.360 20.091
66 HD2 PHE 8 HD2 PHE 8 -0.365 -14.226 21.909
67 HE1 PHE 8 HE1 PHE 8 4.158 -13.419 20.808
68 HE2 PHE 8 HE2 PHE 8 0.388 -12.260 22.632
69 HZ PHE 8 HZ PHE 8 2.764 -11.765 22.049
70 H ARG 9 HN ARG 9 -0.091 -18.910 22.423
71 HA ARG 9 HA ARG 9 -2.748 -18.302 22.390
72 HB2 ARG 9 HB2 ARG 9 -0.949 -20.612 22.305
73 HB3 ARG 9 HB1 ARG 9 -2.350 -21.013 23.344
74 HG2 ARG 9 HG2 ARG 9 -3.332 -21.693 21.414
75 HG3 ARG 9 HG1 ARG 9 -3.645 -19.956 21.129
76 HD2 ARG 9 HD2 ARG 9 -1.915 -19.749 19.504
77 HD3 ARG 9 HD1 ARG 9 -1.010 -21.216 20.114
78 HE ARG 9 HE ARG 9 -3.548 -22.160 19.361
79 HH11 ARG 9 HH11 ARG 9 -0.839 -20.492 17.647
80 HH12 ARG 9 HH12 ARG 9 -1.183 -21.227 16.116
81 HH21 ARG 9 HH21 ARG 9 -3.960 -23.125 17.260
82 HH22 ARG 9 HH22 ARG 9 -2.967 -22.732 15.897
83 H ASP 10 HN ASP 10 -0.470 -18.076 24.978
84 HA ASP 10 HA ASP 10 -2.614 -18.841 26.757
85 HB2 ASP 10 HB2 ASP 10 0.322 -18.377 27.515
86 HB3 ASP 10 HB1 ASP 10 -0.972 -18.808 28.688
87 H PHE 11 HN PHE 11 -0.919 -15.848 25.734
88 HA PHE 11 HA PHE 11 -1.790 -14.632 28.211
89 HB2 PHE 11 HB2 PHE 11 -1.045 -12.887 25.866
90 HB3 PHE 11 HB1 PHE 11 -0.766 -12.580 27.635
91 HD1 PHE 11 HD1 PHE 11 0.168 -13.989 24.591
92 HD2 PHE 11 HD2 PHE 11 1.369 -13.531 28.614
93 HE1 PHE 11 HE1 PHE 11 2.258 -14.590 23.972
94 HE2 PHE 11 HE2 PHE 11 3.636 -14.128 27.961
95 HZ PHE 11 HZ PHE 11 4.165 -14.600 25.607
96 H ILE 12 HN ILE 12 -2.372 -14.159 24.722
97 HA ILE 12 HA ILE 12 -4.186 -12.028 25.182
98 HB ILE 12 HB ILE 12 -4.513 -13.377 22.644
99 HG12 ILE 12 HG12 ILE 12 -1.947 -11.922 22.565
100 HG13 ILE 12 HG11 ILE 12 -1.854 -13.437 23.557
101 HG21 ILE 12 HG21 ILE 12 -4.256 -11.036 21.758
102 HG22 ILE 12 HG22 ILE 12 -3.862 -10.455 23.421
103 HG23 ILE 12 HG23 ILE 12 -5.497 -11.142 23.063
104 HD11 ILE 12 HD11 ILE 12 -1.830 -13.322 20.788
105 HD12 ILE 12 HD12 ILE 12 -3.511 -13.891 21.209
106 HD13 ILE 12 HD13 ILE 12 -2.070 -14.739 21.892
107 H LEU 13 HN LEU 13 -4.483 -15.458 24.973
108 HA LEU 13 HA LEU 13 -7.145 -15.309 24.188
109 HB2 LEU 13 HB2 LEU 13 -5.182 -17.489 24.770
110 HB3 LEU 13 HB1 LEU 13 -6.909 -17.880 24.400
111 HG LEU 13 HG LEU 13 -6.535 -16.241 22.376
112 HD11 LEU 13 HD11 LEU 13 -4.652 -15.222 22.286
113 HD12 LEU 13 HD12 LEU 13 -3.926 -16.703 21.597
114 HD13 LEU 13 HD13 LEU 13 -3.787 -16.342 23.376
115 HD21 LEU 13 HD21 LEU 13 -5.732 -18.137 20.877
116 HD22 LEU 13 HD22 LEU 13 -7.036 -18.638 22.020
117 HD23 LEU 13 HD23 LEU 13 -5.319 -19.076 22.364
118 H GLN 14 HN GLN 14 -5.497 -15.304 27.171
119 HA GLN 14 HA GLN 14 -7.844 -16.107 28.737
120 HB2 GLN 14 HB2 GLN 14 -5.187 -14.730 29.536
121 HB3 GLN 14 HB1 GLN 14 -6.527 -15.041 30.718
122 HG2 GLN 14 HG2 GLN 14 -6.354 -17.548 30.131
123 HG3 GLN 14 HG1 GLN 14 -4.903 -17.147 29.133
124 HE21 GLN 14 HE21 GLN 14 -3.016 -17.648 30.279
125 HE22 GLN 14 HE22 GLN 14 -2.759 -17.379 31.971
126 H ARG 15 HN ARG 15 -7.121 -13.545 26.724
127 HA ARG 15 HA ARG 15 -8.569 -11.570 28.234
128 HB2 ARG 15 HB2 ARG 15 -7.114 -11.364 25.581
129 HB3 ARG 15 HB1 ARG 15 -7.795 -9.980 26.552
130 HG2 ARG 15 HG2 ARG 15 -6.216 -11.451 28.385
131 HG3 ARG 15 HG1 ARG 15 -5.292 -11.507 26.860
132 HD2 ARG 15 HD2 ARG 15 -5.246 -9.044 26.696
133 HD3 ARG 15 HD1 ARG 15 -6.400 -8.909 28.126
134 HE ARG 15 HE ARG 15 -4.005 -10.390 28.894
135 HH11 ARG 15 HH11 ARG 15 -5.068 -7.022 28.120
136 HH12 ARG 15 HH12 ARG 15 -3.860 -6.275 29.113
137 HH21 ARG 15 HH21 ARG 15 -2.396 -9.317 30.221
138 HH22 ARG 15 HH22 ARG 15 -2.334 -7.589 30.313
139 H LYS 16 HN LYS 16 -9.430 -14.060 26.664
140 HA LYS 16 HA LYS 16 -11.528 -12.820 25.045
141 HB2 LYS 16 HB2 LYS 16 -10.666 -15.683 25.651
142 HB3 LYS 16 HB1 LYS 16 -12.188 -15.325 24.759
143 HG2 LYS 16 HG2 LYS 16 -11.028 -14.304 22.921
144 HG3 LYS 16 HG1 LYS 16 -9.473 -14.213 23.820
145 HD2 LYS 16 HD2 LYS 16 -9.082 -16.511 23.713
146 HD3 LYS 16 HD1 LYS 16 -10.773 -16.933 23.285
147 HE2 LYS 16 HE2 LYS 16 -8.921 -15.325 21.371
148 HE3 LYS 16 HE1 LYS 16 -9.013 -17.132 21.364
149 HZ1 LYS 16 HZ1 LYS 16 -11.063 -15.143 20.615
150 HZ2 LYS 16 HZ2 LYS 16 -11.535 -16.688 21.137
151 HZ3 LYS 16 HZ3 LYS 16 -10.521 -16.522 19.784
152 H LYS 17 HN LYS 17 -12.148 -11.703 26.810
153 HA LYS 17 HA LYS 17 -13.668 -13.123 28.899
154 HB2 LYS 17 HB2 LYS 17 -12.470 -10.270 28.834
155 HB3 LYS 17 HB1 LYS 17 -13.298 -11.033 30.244
156 HG2 LYS 17 HG2 LYS 17 -11.468 -12.518 30.685
157 HG3 LYS 17 HG1 LYS 17 -10.779 -12.385 29.030
158 HD2 LYS 17 HD2 LYS 17 -9.304 -11.147 30.456
159 HD3 LYS 17 HD1 LYS 17 -10.230 -9.925 29.531
160 HE2 LYS 17 HE2 LYS 17 -11.688 -9.470 31.557
161 HE3 LYS 17 HE1 LYS 17 -10.824 -10.766 32.481
162 HZ1 LYS 17 HZ1 LYS 17 -9.342 -9.276 33.040
163 HZ2 LYS 17 HZ2 LYS 17 -10.147 -8.072 32.153
164 HZ3 LYS 17 HZ3 LYS 17 -8.927 -8.997 31.417
Start of MODEL 2
1 H1 GLU 1 HT1 GLU 1 7.722 -17.741 12.616
2 H2 GLU 1 HT2 GLU 1 8.876 -18.451 11.592
3 H3 GLU 1 HT3 GLU 1 9.342 -17.232 12.679
4 HA GLU 1 HA GLU 1 8.106 -19.685 13.681
5 HB2 GLU 1 HB2 GLU 1 11.039 -19.324 12.770
6 HB3 GLU 1 HB1 GLU 1 10.606 -20.519 14.050
7 HG2 GLU 1 HG2 GLU 1 9.052 -21.703 12.442
8 HG3 GLU 1 HG1 GLU 1 9.488 -20.517 11.149
9 H MET 2 HN MET 2 7.646 -19.275 15.815
10 HA MET 2 HA MET 2 9.662 -17.925 17.446
11 HB2 MET 2 HB2 MET 2 6.968 -16.775 16.776
12 HB3 MET 2 HB1 MET 2 7.235 -16.997 18.535
13 HG2 MET 2 HG2 MET 2 8.639 -15.128 16.580
14 HG3 MET 2 HG1 MET 2 7.801 -14.795 18.130
15 HE1 MET 2 HE1 MET 2 10.516 -13.489 17.177
16 HE2 MET 2 HE2 MET 2 11.414 -13.453 18.733
17 HE3 MET 2 HE3 MET 2 9.652 -13.101 18.706
18 H ALA 3 HN ALA 3 9.441 -18.257 19.645
19 HA ALA 3 HA ALA 3 7.741 -20.456 20.272
20 HB1 ALA 3 HB1 ALA 3 9.795 -19.502 22.159
21 HB2 ALA 3 HB2 ALA 3 10.270 -20.571 20.781
22 HB3 ALA 3 HB3 ALA 3 9.069 -21.149 22.015
23 H LEU 4 HN LEU 4 7.428 -17.350 20.377
24 HA LEU 4 HA LEU 4 6.299 -17.421 23.007
25 HB2 LEU 4 HB2 LEU 4 5.318 -15.326 21.327
26 HB3 LEU 4 HB1 LEU 4 6.038 -15.203 22.959
27 HG LEU 4 HG LEU 4 7.559 -15.529 20.377
28 HD11 LEU 4 HD11 LEU 4 7.924 -13.014 20.492
29 HD12 LEU 4 HD12 LEU 4 6.659 -12.973 21.797
30 HD13 LEU 4 HD13 LEU 4 6.235 -13.589 20.146
31 HD21 LEU 4 HD21 LEU 4 8.395 -15.123 23.281
32 HD22 LEU 4 HD22 LEU 4 9.431 -14.385 21.985
33 HD23 LEU 4 HD23 LEU 4 9.108 -16.176 21.989
34 H SER 5 HN SER 5 5.790 -18.141 19.861
35 HA SER 5 HA SER 5 3.278 -17.183 19.581
36 HB2 SER 5 HB2 SER 5 4.824 -17.700 17.800
37 HB3 SER 5 HB1 SER 5 4.723 -19.457 18.202
38 HG SER 5 HG SER 5 3.405 -18.789 16.404
39 H LYS 6 HN LYS 6 4.596 -19.670 21.414
40 HA LYS 6 HA LYS 6 2.276 -21.436 21.572
41 HB2 LYS 6 HB2 LYS 6 5.115 -21.151 22.667
42 HB3 LYS 6 HB1 LYS 6 3.964 -22.225 23.558
43 HG2 LYS 6 HG2 LYS 6 4.783 -23.859 22.205
44 HG3 LYS 6 HG1 LYS 6 3.660 -23.185 20.984
45 HD2 LYS 6 HD2 LYS 6 5.501 -21.765 20.041
46 HD3 LYS 6 HD1 LYS 6 6.632 -22.394 21.291
47 HE2 LYS 6 HE2 LYS 6 6.308 -24.765 20.358
48 HE3 LYS 6 HE1 LYS 6 5.268 -24.069 19.049
49 HZ1 LYS 6 HZ1 LYS 6 7.542 -24.417 18.362
50 HZ2 LYS 6 HZ2 LYS 6 8.117 -23.374 19.574
51 HZ3 LYS 6 HZ3 LYS 6 7.144 -22.767 18.322
52 H PHE 7 HN PHE 7 4.215 -19.011 23.118
53 HA PHE 7 HA PHE 7 2.818 -19.044 25.552
54 HB2 PHE 7 HB2 PHE 7 4.562 -16.922 24.354
55 HB3 PHE 7 HB1 PHE 7 3.909 -16.859 26.030
56 HD1 PHE 7 HD1 PHE 7 6.774 -16.636 25.201
57 HD2 PHE 7 HD2 PHE 7 4.511 -20.049 26.431
58 HE1 PHE 7 HE1 PHE 7 8.758 -17.739 25.928
59 HE2 PHE 7 HE2 PHE 7 6.504 -21.096 27.126
60 HZ PHE 7 HZ PHE 7 8.689 -19.986 26.920
61 H PHE 8 HN PHE 8 2.485 -17.515 22.458
62 HA PHE 8 HA PHE 8 0.628 -15.645 23.115
63 HB2 PHE 8 HB2 PHE 8 1.553 -16.877 20.615
64 HB3 PHE 8 HB1 PHE 8 -0.135 -16.220 20.489
65 HD1 PHE 8 HD1 PHE 8 3.218 -15.288 20.188
66 HD2 PHE 8 HD2 PHE 8 -0.378 -14.244 21.930
67 HE1 PHE 8 HE1 PHE 8 4.147 -13.326 20.932
68 HE2 PHE 8 HE2 PHE 8 0.310 -12.262 22.675
69 HZ PHE 8 HZ PHE 8 2.683 -11.710 22.145
70 H ARG 9 HN ARG 9 -0.015 -18.926 22.425
71 HA ARG 9 HA ARG 9 -2.685 -18.377 22.317
72 HB2 ARG 9 HB2 ARG 9 -0.830 -20.647 22.277
73 HB3 ARG 9 HB1 ARG 9 -2.260 -21.084 23.261
74 HG2 ARG 9 HG2 ARG 9 -3.154 -21.772 21.290
75 HG3 ARG 9 HG1 ARG 9 -3.495 -20.040 21.008
76 HD2 ARG 9 HD2 ARG 9 -1.709 -19.778 19.452
77 HD3 ARG 9 HD1 ARG 9 -0.799 -21.235 20.078
78 HE ARG 9 HE ARG 9 -3.289 -22.220 19.225
79 HH11 ARG 9 HH11 ARG 9 -0.559 -20.474 17.625
80 HH12 ARG 9 HH12 ARG 9 -0.834 -21.196 16.075
81 HH21 ARG 9 HH21 ARG 9 -3.610 -23.166 17.099
82 HH22 ARG 9 HH22 ARG 9 -2.579 -22.735 15.776
83 H ASP 10 HN ASP 10 -0.489 -18.117 24.968
84 HA ASP 10 HA ASP 10 -2.659 -18.949 26.688
85 HB2 ASP 10 HB2 ASP 10 0.243 -18.404 27.525
86 HB3 ASP 10 HB1 ASP 10 -1.069 -18.881 28.659
87 H PHE 11 HN PHE 11 -1.023 -15.918 25.696
88 HA PHE 11 HA PHE 11 -2.006 -14.732 28.143
89 HB2 PHE 11 HB2 PHE 11 -1.231 -12.952 25.836
90 HB3 PHE 11 HB1 PHE 11 -1.024 -12.651 27.615
91 HD1 PHE 11 HD1 PHE 11 0.058 -14.009 24.601
92 HD2 PHE 11 HD2 PHE 11 1.100 -13.548 28.665
93 HE1 PHE 11 HE1 PHE 11 2.185 -14.549 24.053
94 HE2 PHE 11 HE2 PHE 11 3.405 -14.079 28.092
95 HZ PHE 11 HZ PHE 11 4.031 -14.520 25.756
96 H ILE 12 HN ILE 12 -2.454 -14.185 24.641
97 HA ILE 12 HA ILE 12 -4.330 -12.104 25.022
98 HB ILE 12 HB ILE 12 -4.571 -13.518 22.500
99 HG12 ILE 12 HG12 ILE 12 -2.050 -11.984 22.458
100 HG13 ILE 12 HG11 ILE 12 -1.937 -13.477 23.477
101 HG21 ILE 12 HG21 ILE 12 -4.046 -10.562 23.235
102 HG22 ILE 12 HG22 ILE 12 -5.640 -11.314 22.830
103 HG23 ILE 12 HG23 ILE 12 -4.359 -11.189 21.569
104 HD11 ILE 12 HD11 ILE 12 -1.838 -13.405 20.709
105 HD12 ILE 12 HD12 ILE 12 -3.512 -14.021 21.089
106 HD13 ILE 12 HD13 ILE 12 -2.065 -14.810 21.827
107 H LEU 13 HN LEU 13 -4.588 -15.517 24.797
108 HA LEU 13 HA LEU 13 -7.214 -15.458 23.965
109 HB2 LEU 13 HB2 LEU 13 -5.212 -17.552 24.701
110 HB3 LEU 13 HB1 LEU 13 -6.906 -18.022 24.278
111 HG LEU 13 HG LEU 13 -6.504 -16.464 22.199
112 HD11 LEU 13 HD11 LEU 13 -3.790 -16.419 23.311
113 HD12 LEU 13 HD12 LEU 13 -4.664 -15.353 22.177
114 HD13 LEU 13 HD13 LEU 13 -3.863 -16.814 21.539
115 HD21 LEU 13 HD21 LEU 13 -6.881 -18.900 21.944
116 HD22 LEU 13 HD22 LEU 13 -5.157 -19.230 22.365
117 HD23 LEU 13 HD23 LEU 13 -5.564 -18.380 20.824
118 H GLN 14 HN GLN 14 -5.655 -15.393 27.008
119 HA GLN 14 HA GLN 14 -8.109 -16.101 28.492
120 HB2 GLN 14 HB2 GLN 14 -5.368 -15.029 29.462
121 HB3 GLN 14 HB1 GLN 14 -6.763 -15.386 30.563
122 HG2 GLN 14 HG2 GLN 14 -6.693 -17.829 29.653
123 HG3 GLN 14 HG1 GLN 14 -5.138 -17.383 28.849
124 HE21 GLN 14 HE21 GLN 14 -3.282 -17.772 30.086
125 HE22 GLN 14 HE22 GLN 14 -3.224 -17.852 31.817
126 H ARG 15 HN ARG 15 -7.103 -13.514 26.635
127 HA ARG 15 HA ARG 15 -8.231 -11.428 28.321
128 HB2 ARG 15 HB2 ARG 15 -6.746 -11.380 25.652
129 HB3 ARG 15 HB1 ARG 15 -7.243 -9.913 26.603
130 HG2 ARG 15 HG2 ARG 15 -5.768 -11.932 28.191
131 HG3 ARG 15 HG1 ARG 15 -4.841 -11.344 26.791
132 HD2 ARG 15 HD2 ARG 15 -4.913 -9.066 27.492
133 HD3 ARG 15 HD1 ARG 15 -6.232 -9.400 28.732
134 HE ARG 15 HE ARG 15 -3.908 -11.005 29.377
135 HH11 ARG 15 HH11 ARG 15 -4.862 -7.517 29.322
136 HH12 ARG 15 HH12 ARG 15 -3.772 -7.067 30.590
137 HH21 ARG 15 HH21 ARG 15 -2.455 -10.330 31.089
138 HH22 ARG 15 HH22 ARG 15 -2.396 -8.675 31.599
139 H LYS 16 HN LYS 16 -9.308 -13.640 26.194
140 HA LYS 16 HA LYS 16 -11.016 -12.027 24.546
141 HB2 LYS 16 HB2 LYS 16 -11.455 -14.927 25.456
142 HB3 LYS 16 HB1 LYS 16 -12.264 -14.146 24.050
143 HG2 LYS 16 HG2 LYS 16 -9.293 -14.834 24.333
144 HG3 LYS 16 HG1 LYS 16 -10.464 -15.735 23.360
145 HD2 LYS 16 HD2 LYS 16 -9.556 -12.823 22.803
146 HD3 LYS 16 HD1 LYS 16 -8.817 -14.286 22.079
147 HE2 LYS 16 HE2 LYS 16 -11.061 -14.870 21.003
148 HE3 LYS 16 HE1 LYS 16 -11.772 -13.357 21.701
149 HZ1 LYS 16 HZ1 LYS 16 -9.370 -13.340 19.955
150 HZ2 LYS 16 HZ2 LYS 16 -10.395 -12.053 20.372
151 HZ3 LYS 16 HZ3 LYS 16 -10.953 -13.285 19.344
152 H LYS 17 HN LYS 17 -11.240 -13.756 27.586
153 HA LYS 17 HA LYS 17 -12.671 -13.840 29.267
154 HB2 LYS 17 HB2 LYS 17 -12.766 -10.816 28.681
155 HB3 LYS 17 HB1 LYS 17 -13.195 -11.568 30.264
156 HG2 LYS 17 HG2 LYS 17 -10.951 -12.144 30.757
157 HG3 LYS 17 HG1 LYS 17 -10.446 -12.162 29.034
158 HD2 LYS 17 HD2 LYS 17 -9.406 -10.225 29.999
159 HD3 LYS 17 HD1 LYS 17 -10.761 -9.611 28.992
160 HE2 LYS 17 HE2 LYS 17 -12.162 -9.237 31.065
161 HE3 LYS 17 HE1 LYS 17 -10.847 -9.938 32.095
162 HZ1 LYS 17 HZ1 LYS 17 -9.419 -8.120 31.084
163 HZ2 LYS 17 HZ2 LYS 17 -10.602 -7.660 32.212
164 HZ3 LYS 17 HZ3 LYS 17 -10.867 -7.408 30.553
Start of MODEL 3
1 H1 GLU 1 HT1 GLU 1 10.403 -20.749 14.959
2 H2 GLU 1 HT2 GLU 1 11.039 -20.918 13.393
3 H3 GLU 1 HT3 GLU 1 9.371 -21.096 13.655
4 HA GLU 1 HA GLU 1 10.936 -18.768 13.233
5 HB2 GLU 1 HB2 GLU 1 8.845 -19.620 11.933
6 HB3 GLU 1 HB1 GLU 1 7.854 -19.074 13.331
7 HG2 GLU 1 HG2 GLU 1 8.631 -16.693 12.970
8 HG3 GLU 1 HG1 GLU 1 9.681 -17.235 11.603
9 H MET 2 HN MET 2 8.202 -19.497 15.603
10 HA MET 2 HA MET 2 9.513 -17.740 17.548
11 HB2 MET 2 HB2 MET 2 6.858 -17.171 16.232
12 HB3 MET 2 HB1 MET 2 6.836 -17.211 18.038
13 HG2 MET 2 HG2 MET 2 8.396 -15.433 18.215
14 HG3 MET 2 HG1 MET 2 8.855 -15.495 16.483
15 HE1 MET 2 HE1 MET 2 8.660 -12.959 16.259
16 HE2 MET 2 HE2 MET 2 8.247 -12.851 18.006
17 HE3 MET 2 HE3 MET 2 7.259 -11.966 16.793
18 H ALA 3 HN ALA 3 9.402 -18.513 19.516
19 HA ALA 3 HA ALA 3 7.528 -20.609 19.966
20 HB1 ALA 3 HB1 ALA 3 10.037 -20.926 20.493
21 HB2 ALA 3 HB2 ALA 3 8.783 -21.509 21.670
22 HB3 ALA 3 HB3 ALA 3 9.618 -19.925 21.935
23 H LEU 4 HN LEU 4 7.365 -17.537 20.214
24 HA LEU 4 HA LEU 4 6.275 -17.611 22.856
25 HB2 LEU 4 HB2 LEU 4 5.345 -15.468 21.198
26 HB3 LEU 4 HB1 LEU 4 6.093 -15.374 22.821
27 HG LEU 4 HG LEU 4 7.555 -15.734 20.205
28 HD11 LEU 4 HD11 LEU 4 8.014 -13.237 20.341
29 HD12 LEU 4 HD12 LEU 4 6.789 -13.165 21.680
30 HD13 LEU 4 HD13 LEU 4 6.295 -13.742 20.034
31 HD21 LEU 4 HD21 LEU 4 8.465 -15.394 23.096
32 HD22 LEU 4 HD22 LEU 4 9.501 -14.681 21.788
33 HD23 LEU 4 HD23 LEU 4 9.112 -16.458 21.779
34 H SER 5 HN SER 5 5.670 -18.254 19.697
35 HA SER 5 HA SER 5 3.194 -17.195 19.486
36 HB2 SER 5 HB2 SER 5 4.635 -17.713 17.651
37 HB3 SER 5 HB1 SER 5 4.569 -19.470 18.045
38 HG SER 5 HG SER 5 3.188 -18.730 16.283
39 H LYS 6 HN LYS 6 4.437 -19.770 21.244
40 HA LYS 6 HA LYS 6 2.041 -21.434 21.413
41 HB2 LYS 6 HB2 LYS 6 4.912 -21.305 22.454
42 HB3 LYS 6 HB1 LYS 6 3.733 -22.369 23.323
43 HG2 LYS 6 HG2 LYS 6 4.397 -23.993 21.873
44 HG3 LYS 6 HG1 LYS 6 3.362 -23.162 20.671
45 HD2 LYS 6 HD2 LYS 6 5.391 -21.774 19.961
46 HD3 LYS 6 HD1 LYS 6 6.397 -22.750 21.084
47 HE2 LYS 6 HE2 LYS 6 4.760 -24.016 18.757
48 HE3 LYS 6 HE1 LYS 6 6.484 -23.494 18.605
49 HZ1 LYS 6 HZ1 LYS 6 7.102 -25.061 20.268
50 HZ2 LYS 6 HZ2 LYS 6 6.165 -25.865 19.102
51 HZ3 LYS 6 HZ3 LYS 6 5.487 -25.464 20.607
52 H PHE 7 HN PHE 7 4.120 -19.126 22.960
53 HA PHE 7 HA PHE 7 2.774 -19.151 25.425
54 HB2 PHE 7 HB2 PHE 7 4.588 -17.082 24.234
55 HB3 PHE 7 HB1 PHE 7 3.966 -17.023 25.923
56 HD1 PHE 7 HD1 PHE 7 6.824 -16.908 25.052
57 HD2 PHE 7 HD2 PHE 7 4.434 -20.244 26.251
58 HE1 PHE 7 HE1 PHE 7 8.768 -18.110 25.722
59 HE2 PHE 7 HE2 PHE 7 6.390 -21.392 26.890
60 HZ PHE 7 HZ PHE 7 8.618 -20.372 26.670
61 H PHE 8 HN PHE 8 2.443 -17.548 22.370
62 HA PHE 8 HA PHE 8 0.677 -15.617 23.103
63 HB2 PHE 8 HB2 PHE 8 1.501 -16.832 20.557
64 HB3 PHE 8 HB1 PHE 8 -0.158 -16.100 20.481
65 HD1 PHE 8 HD1 PHE 8 3.226 -15.305 20.131
66 HD2 PHE 8 HD2 PHE 8 -0.286 -14.153 21.969
67 HE1 PHE 8 HE1 PHE 8 4.252 -13.401 20.905
68 HE2 PHE 8 HE2 PHE 8 0.496 -12.223 22.751
69 HZ PHE 8 HZ PHE 8 2.881 -11.757 22.187
70 H ARG 9 HN ARG 9 -0.111 -18.858 22.376
71 HA ARG 9 HA ARG 9 -2.756 -18.202 22.323
72 HB2 ARG 9 HB2 ARG 9 -1.000 -20.538 22.220
73 HB3 ARG 9 HB1 ARG 9 -2.397 -20.928 23.267
74 HG2 ARG 9 HG2 ARG 9 -3.424 -21.569 21.349
75 HG3 ARG 9 HG1 ARG 9 -3.684 -19.824 21.060
76 HD2 ARG 9 HD2 ARG 9 -1.971 -19.677 19.418
77 HD3 ARG 9 HD1 ARG 9 -1.087 -21.152 20.041
78 HE ARG 9 HE ARG 9 -3.646 -22.060 19.308
79 HH11 ARG 9 HH11 ARG 9 -0.905 -20.471 17.570
80 HH12 ARG 9 HH12 ARG 9 -1.263 -21.222 16.051
81 HH21 ARG 9 HH21 ARG 9 -4.080 -23.045 17.222
82 HH22 ARG 9 HH22 ARG 9 -3.078 -22.692 15.852
83 H ASP 10 HN ASP 10 -0.499 -18.049 24.944
84 HA ASP 10 HA ASP 10 -2.683 -18.777 26.687
85 HB2 ASP 10 HB2 ASP 10 0.253 -18.395 27.487
86 HB3 ASP 10 HB1 ASP 10 -1.066 -18.804 28.639
87 H PHE 11 HN PHE 11 -0.895 -15.812 25.737
88 HA PHE 11 HA PHE 11 -1.773 -14.606 28.216
89 HB2 PHE 11 HB2 PHE 11 -0.959 -12.851 25.907
90 HB3 PHE 11 HB1 PHE 11 -0.695 -12.573 27.682
91 HD1 PHE 11 HD1 PHE 11 0.231 -14.001 24.640
92 HD2 PHE 11 HD2 PHE 11 1.419 -13.543 28.666
93 HE1 PHE 11 HE1 PHE 11 2.311 -14.638 24.031
94 HE2 PHE 11 HE2 PHE 11 3.680 -14.181 28.028
95 HZ PHE 11 HZ PHE 11 4.211 -14.677 25.679
96 H ILE 12 HN ILE 12 -2.329 -14.140 24.717
97 HA ILE 12 HA ILE 12 -4.094 -11.961 25.200
98 HB ILE 12 HB ILE 12 -4.426 -13.233 22.627
99 HG12 ILE 12 HG12 ILE 12 -1.825 -11.848 22.589
100 HG13 ILE 12 HG11 ILE 12 -1.772 -13.373 23.571
101 HG21 ILE 12 HG21 ILE 12 -5.346 -10.980 23.104
102 HG22 ILE 12 HG22 ILE 12 -4.101 -10.878 21.805
103 HG23 ILE 12 HG23 ILE 12 -3.693 -10.353 23.484
104 HD11 ILE 12 HD11 ILE 12 -1.720 -13.237 20.804
105 HD12 ILE 12 HD12 ILE 12 -3.420 -13.769 21.202
106 HD13 ILE 12 HD13 ILE 12 -2.007 -14.655 21.893
107 H LEU 13 HN LEU 13 -4.443 -15.378 24.931
108 HA LEU 13 HA LEU 13 -7.100 -15.155 24.116
109 HB2 LEU 13 HB2 LEU 13 -5.207 -17.394 24.675
110 HB3 LEU 13 HB1 LEU 13 -6.943 -17.728 24.295
111 HG LEU 13 HG LEU 13 -6.518 -16.063 22.304
112 HD11 LEU 13 HD11 LEU 13 -3.922 -16.586 21.514
113 HD12 LEU 13 HD12 LEU 13 -3.776 -16.242 23.293
114 HD13 LEU 13 HD13 LEU 13 -4.615 -15.092 22.214
115 HD21 LEU 13 HD21 LEU 13 -5.389 -18.931 22.236
116 HD22 LEU 13 HD22 LEU 13 -5.763 -17.948 20.767
117 HD23 LEU 13 HD23 LEU 13 -7.088 -18.432 21.893
118 H GLN 14 HN GLN 14 -5.475 -15.165 27.092
119 HA GLN 14 HA GLN 14 -7.808 -15.952 28.670
120 HB2 GLN 14 HB2 GLN 14 -5.140 -14.605 29.457
121 HB3 GLN 14 HB1 GLN 14 -6.480 -14.865 30.643
122 HG2 GLN 14 HG2 GLN 14 -6.378 -17.380 30.109
123 HG3 GLN 14 HG1 GLN 14 -4.931 -17.044 29.082
124 HE21 GLN 14 HE21 GLN 14 -3.073 -17.656 30.230
125 HE22 GLN 14 HE22 GLN 14 -2.771 -17.332 31.905
126 H ARG 15 HN ARG 15 -7.229 -13.390 26.621
127 HA ARG 15 HA ARG 15 -8.522 -11.326 28.204
128 HB2 ARG 15 HB2 ARG 15 -7.562 -11.269 25.310
129 HB3 ARG 15 HB1 ARG 15 -8.050 -9.826 26.306
130 HG2 ARG 15 HG2 ARG 15 -5.754 -11.700 27.007
131 HG3 ARG 15 HG1 ARG 15 -5.538 -10.324 25.893
132 HD2 ARG 15 HD2 ARG 15 -6.486 -9.999 28.847
133 HD3 ARG 15 HD1 ARG 15 -4.743 -9.892 28.270
134 HE ARG 15 HE ARG 15 -6.321 -8.092 26.660
135 HH11 ARG 15 HH11 ARG 15 -5.230 -8.400 30.093
136 HH12 ARG 15 HH12 ARG 15 -5.248 -6.694 30.386
137 HH21 ARG 15 HH21 ARG 15 -6.320 -5.793 27.119
138 HH22 ARG 15 HH22 ARG 15 -5.871 -5.205 28.686
139 H LYS 16 HN LYS 16 -9.332 -13.910 26.429
140 HA LYS 16 HA LYS 16 -11.685 -12.740 25.168
141 HB2 LYS 16 HB2 LYS 16 -10.649 -15.601 25.423
142 HB3 LYS 16 HB1 LYS 16 -12.100 -15.132 24.460
143 HG2 LYS 16 HG2 LYS 16 -10.751 -13.775 22.934
144 HG3 LYS 16 HG1 LYS 16 -9.294 -13.935 23.963
145 HD2 LYS 16 HD2 LYS 16 -8.907 -15.384 22.166
146 HD3 LYS 16 HD1 LYS 16 -9.342 -16.429 23.553
147 HE2 LYS 16 HE2 LYS 16 -11.652 -16.796 22.604
148 HE3 LYS 16 HE1 LYS 16 -11.307 -15.637 21.257
149 HZ1 LYS 16 HZ1 LYS 16 -9.586 -18.000 21.701
150 HZ2 LYS 16 HZ2 LYS 16 -9.869 -17.110 20.282
151 HZ3 LYS 16 HZ3 LYS 16 -11.071 -18.144 20.889
152 H LYS 17 HN LYS 17 -12.270 -11.919 27.121
153 HA LYS 17 HA LYS 17 -13.552 -13.734 29.056
154 HB2 LYS 17 HB2 LYS 17 -12.835 -10.739 29.295
155 HB3 LYS 17 HB1 LYS 17 -13.367 -11.826 30.632
156 HG2 LYS 17 HG2 LYS 17 -11.269 -12.950 30.736
157 HG3 LYS 17 HG1 LYS 17 -10.802 -12.527 29.055
158 HD2 LYS 17 HD2 LYS 17 -9.409 -11.182 30.446
159 HD3 LYS 17 HD1 LYS 17 -10.659 -10.069 29.806
160 HE2 LYS 17 HE2 LYS 17 -11.891 -10.141 32.016
161 HE3 LYS 17 HE1 LYS 17 -10.693 -11.339 32.656
162 HZ1 LYS 17 HZ1 LYS 17 -10.363 -8.470 32.059
163 HZ2 LYS 17 HZ2 LYS 17 -9.013 -9.500 32.027
164 HZ3 LYS 17 HZ3 LYS 17 -9.939 -9.357 33.444
Start of MODEL 4
1 H1 GLU 1 HT1 GLU 1 10.851 -18.201 12.393
2 H2 GLU 1 HT2 GLU 1 9.354 -17.497 12.775
3 H3 GLU 1 HT3 GLU 1 9.426 -18.799 11.688
4 HA GLU 1 HA GLU 1 8.689 -19.770 13.605
5 HB2 GLU 1 HB2 GLU 1 11.756 -20.015 13.369
6 HB3 GLU 1 HB1 GLU 1 10.868 -20.942 14.634
7 HG2 GLU 1 HG2 GLU 1 9.462 -22.062 12.849
8 HG3 GLU 1 HG1 GLU 1 10.367 -21.154 11.574
9 H MET 2 HN MET 2 7.906 -19.227 15.604
10 HA MET 2 HA MET 2 9.688 -17.784 17.469
11 HB2 MET 2 HB2 MET 2 7.058 -16.847 16.370
12 HB3 MET 2 HB1 MET 2 7.068 -17.023 18.165
13 HG2 MET 2 HG2 MET 2 7.596 -14.753 17.681
14 HG3 MET 2 HG1 MET 2 9.101 -15.531 18.260
15 HE1 MET 2 HE1 MET 2 8.944 -12.704 16.897
16 HE2 MET 2 HE2 MET 2 10.396 -12.755 15.841
17 HE3 MET 2 HE3 MET 2 10.455 -13.485 17.480
18 H ALA 3 HN ALA 3 9.490 -18.382 19.550
19 HA ALA 3 HA ALA 3 7.621 -20.468 20.032
20 HB1 ALA 3 HB1 ALA 3 9.672 -19.758 22.023
21 HB2 ALA 3 HB2 ALA 3 10.136 -20.741 20.580
22 HB3 ALA 3 HB3 ALA 3 8.874 -21.352 21.733
23 H LEU 4 HN LEU 4 7.412 -17.389 20.255
24 HA LEU 4 HA LEU 4 6.296 -17.484 22.892
25 HB2 LEU 4 HB2 LEU 4 5.344 -15.348 21.238
26 HB3 LEU 4 HB1 LEU 4 6.088 -15.251 22.861
27 HG LEU 4 HG LEU 4 7.568 -15.583 20.251
28 HD11 LEU 4 HD11 LEU 4 6.270 -13.618 20.064
29 HD12 LEU 4 HD12 LEU 4 7.979 -13.077 20.384
30 HD13 LEU 4 HD13 LEU 4 6.738 -13.024 21.708
31 HD21 LEU 4 HD21 LEU 4 9.480 -14.487 21.847
32 HD22 LEU 4 HD22 LEU 4 9.127 -16.270 21.837
33 HD23 LEU 4 HD23 LEU 4 8.447 -15.219 23.148
34 H SER 5 HN SER 5 5.736 -18.114 19.716
35 HA SER 5 HA SER 5 3.245 -17.094 19.482
36 HB2 SER 5 HB2 SER 5 4.757 -17.605 17.676
37 HB3 SER 5 HB1 SER 5 4.627 -19.368 18.042
38 HG SER 5 HG SER 5 3.301 -18.425 16.259
39 H LYS 6 HN LYS 6 4.506 -19.666 21.229
40 HA LYS 6 HA LYS 6 2.131 -21.363 21.355
41 HB2 LYS 6 HB2 LYS 6 4.993 -21.216 22.419
42 HB3 LYS 6 HB1 LYS 6 3.820 -22.310 23.258
43 HG2 LYS 6 HG2 LYS 6 4.555 -23.890 21.786
44 HG3 LYS 6 HG1 LYS 6 3.463 -23.086 20.618
45 HD2 LYS 6 HD2 LYS 6 5.443 -21.607 19.902
46 HD3 LYS 6 HD1 LYS 6 6.495 -22.603 20.960
47 HE2 LYS 6 HE2 LYS 6 4.811 -23.824 18.645
48 HE3 LYS 6 HE1 LYS 6 6.513 -23.247 18.446
49 HZ1 LYS 6 HZ1 LYS 6 6.317 -24.954 20.698
50 HZ2 LYS 6 HZ2 LYS 6 7.222 -25.136 19.272
51 HZ3 LYS 6 HZ3 LYS 6 5.626 -25.715 19.346
52 H PHE 7 HN PHE 7 4.166 -19.047 22.951
53 HA PHE 7 HA PHE 7 2.807 -19.127 25.405
54 HB2 PHE 7 HB2 PHE 7 4.598 -17.016 24.254
55 HB3 PHE 7 HB1 PHE 7 3.963 -16.985 25.937
56 HD1 PHE 7 HD1 PHE 7 6.823 -16.813 25.100
57 HD2 PHE 7 HD2 PHE 7 4.479 -20.207 26.222
58 HE1 PHE 7 HE1 PHE 7 8.782 -17.992 25.773
59 HE2 PHE 7 HE2 PHE 7 6.447 -21.330 26.866
60 HZ PHE 7 HZ PHE 7 8.659 -20.270 26.686
61 H PHE 8 HN PHE 8 2.468 -17.493 22.370
62 HA PHE 8 HA PHE 8 0.672 -15.594 23.109
63 HB2 PHE 8 HB2 PHE 8 1.527 -16.784 20.562
64 HB3 PHE 8 HB1 PHE 8 -0.148 -16.087 20.479
65 HD1 PHE 8 HD1 PHE 8 3.226 -15.226 20.163
66 HD2 PHE 8 HD2 PHE 8 -0.332 -14.144 21.954
67 HE1 PHE 8 HE1 PHE 8 4.210 -13.308 20.948
68 HE2 PHE 8 HE2 PHE 8 0.409 -12.197 22.743
69 HZ PHE 8 HZ PHE 8 2.794 -11.687 22.211
70 H ARG 9 HN ARG 9 -0.066 -18.839 22.352
71 HA ARG 9 HA ARG 9 -2.723 -18.232 22.309
72 HB2 ARG 9 HB2 ARG 9 -0.926 -20.527 22.154
73 HB3 ARG 9 HB1 ARG 9 -2.287 -20.965 23.229
74 HG2 ARG 9 HG2 ARG 9 -3.365 -21.599 21.341
75 HG3 ARG 9 HG1 ARG 9 -3.636 -19.857 21.047
76 HD2 ARG 9 HD2 ARG 9 -1.967 -19.713 19.369
77 HD3 ARG 9 HD1 ARG 9 -1.046 -21.165 19.991
78 HE ARG 9 HE ARG 9 -3.597 -22.135 19.320
79 HH11 ARG 9 HH11 ARG 9 -0.950 -20.484 17.491
80 HH12 ARG 9 HH12 ARG 9 -1.334 -21.254 15.989
81 HH21 ARG 9 HH21 ARG 9 -4.064 -23.143 17.252
82 HH22 ARG 9 HH22 ARG 9 -3.114 -22.773 15.853
83 H ASP 10 HN ASP 10 -0.470 -18.075 24.934
84 HA ASP 10 HA ASP 10 -2.641 -18.876 26.665
85 HB2 ASP 10 HB2 ASP 10 0.287 -18.451 27.474
86 HB3 ASP 10 HB1 ASP 10 -1.024 -18.881 28.627
87 H PHE 11 HN PHE 11 -0.928 -15.865 25.739
88 HA PHE 11 HA PHE 11 -1.828 -14.713 28.236
89 HB2 PHE 11 HB2 PHE 11 -1.049 -12.908 25.949
90 HB3 PHE 11 HB1 PHE 11 -0.788 -12.652 27.729
91 HD1 PHE 11 HD1 PHE 11 0.175 -13.968 24.654
92 HD2 PHE 11 HD2 PHE 11 1.328 -13.655 28.705
93 HE1 PHE 11 HE1 PHE 11 2.268 -14.564 24.042
94 HE2 PHE 11 HE2 PHE 11 3.599 -14.246 28.060
95 HZ PHE 11 HZ PHE 11 4.155 -14.641 25.699
96 H ILE 12 HN ILE 12 -2.367 -14.145 24.754
97 HA ILE 12 HA ILE 12 -4.182 -12.024 25.252
98 HB ILE 12 HB ILE 12 -4.489 -13.312 22.680
99 HG12 ILE 12 HG12 ILE 12 -1.922 -11.856 22.657
100 HG13 ILE 12 HG11 ILE 12 -1.840 -13.395 23.612
101 HG21 ILE 12 HG21 ILE 12 -3.848 -10.410 23.530
102 HG22 ILE 12 HG22 ILE 12 -5.478 -11.089 23.142
103 HG23 ILE 12 HG23 ILE 12 -4.230 -10.953 21.849
104 HD11 ILE 12 HD11 ILE 12 -3.471 -13.788 21.235
105 HD12 ILE 12 HD12 ILE 12 -2.045 -14.656 21.920
106 HD13 ILE 12 HD13 ILE 12 -1.789 -13.207 20.849
107 H LEU 13 HN LEU 13 -4.486 -15.449 24.949
108 HA LEU 13 HA LEU 13 -7.142 -15.261 24.146
109 HB2 LEU 13 HB2 LEU 13 -5.213 -17.481 24.690
110 HB3 LEU 13 HB1 LEU 13 -6.938 -17.837 24.281
111 HG LEU 13 HG LEU 13 -6.506 -16.147 22.312
112 HD11 LEU 13 HD11 LEU 13 -4.607 -15.149 22.293
113 HD12 LEU 13 HD12 LEU 13 -3.894 -16.614 21.563
114 HD13 LEU 13 HD13 LEU 13 -3.778 -16.320 23.353
115 HD21 LEU 13 HD21 LEU 13 -5.331 -18.996 22.236
116 HD22 LEU 13 HD22 LEU 13 -5.700 -18.005 20.771
117 HD23 LEU 13 HD23 LEU 13 -7.034 -18.522 21.872
118 H GLN 14 HN GLN 14 -5.524 -15.364 27.146
119 HA GLN 14 HA GLN 14 -7.895 -16.196 28.660
120 HB2 GLN 14 HB2 GLN 14 -5.231 -14.882 29.543
121 HB3 GLN 14 HB1 GLN 14 -6.586 -15.234 30.695
122 HG2 GLN 14 HG2 GLN 14 -6.427 -17.716 29.980
123 HG3 GLN 14 HG1 GLN 14 -4.948 -17.275 29.042
124 HE21 GLN 14 HE21 GLN 14 -3.062 -17.752 30.197
125 HE22 GLN 14 HE22 GLN 14 -2.862 -17.607 31.913
126 H ARG 15 HN ARG 15 -7.136 -13.578 26.747
127 HA ARG 15 HA ARG 15 -8.562 -11.634 28.318
128 HB2 ARG 15 HB2 ARG 15 -7.100 -11.375 25.673
129 HB3 ARG 15 HB1 ARG 15 -7.770 -10.006 26.675
130 HG2 ARG 15 HG2 ARG 15 -6.205 -11.564 28.465
131 HG3 ARG 15 HG1 ARG 15 -5.277 -11.541 26.941
132 HD2 ARG 15 HD2 ARG 15 -5.239 -9.078 26.895
133 HD3 ARG 15 HD1 ARG 15 -6.400 -9.011 28.322
134 HE ARG 15 HE ARG 15 -4.009 -10.519 29.044
135 HH11 ARG 15 HH11 ARG 15 -5.063 -7.120 28.393
136 HH12 ARG 15 HH12 ARG 15 -3.854 -6.414 29.413
137 HH21 ARG 15 HH21 ARG 15 -2.397 -9.498 30.410
138 HH22 ARG 15 HH22 ARG 15 -2.332 -7.774 30.564
139 H LYS 16 HN LYS 16 -9.452 -14.067 26.663
140 HA LYS 16 HA LYS 16 -11.520 -12.737 25.073
141 HB2 LYS 16 HB2 LYS 16 -10.802 -15.667 25.581
142 HB3 LYS 16 HB1 LYS 16 -12.185 -15.144 24.542
143 HG2 LYS 16 HG2 LYS 16 -10.707 -14.055 22.948
144 HG3 LYS 16 HG1 LYS 16 -9.286 -14.214 24.026
145 HD2 LYS 16 HD2 LYS 16 -8.958 -15.863 22.394
146 HD3 LYS 16 HD1 LYS 16 -9.523 -16.737 23.850
147 HE2 LYS 16 HE2 LYS 16 -11.825 -17.003 22.849
148 HE3 LYS 16 HE1 LYS 16 -11.340 -16.010 21.416
149 HZ1 LYS 16 HZ1 LYS 16 -9.587 -18.235 21.935
150 HZ2 LYS 16 HZ2 LYS 16 -10.359 -17.745 20.504
151 HZ3 LYS 16 HZ3 LYS 16 -11.193 -18.699 21.635
152 H LYS 17 HN LYS 17 -12.124 -11.706 26.908
153 HA LYS 17 HA LYS 17 -13.683 -13.212 28.903
154 HB2 LYS 17 HB2 LYS 17 -12.499 -10.354 28.966
155 HB3 LYS 17 HB1 LYS 17 -13.320 -11.188 30.340
156 HG2 LYS 17 HG2 LYS 17 -11.481 -12.680 30.711
157 HG3 LYS 17 HG1 LYS 17 -10.796 -12.467 29.061
158 HD2 LYS 17 HD2 LYS 17 -9.322 -11.284 30.533
159 HD3 LYS 17 HD1 LYS 17 -10.267 -10.024 29.679
160 HE2 LYS 17 HE2 LYS 17 -11.716 -9.693 31.736
161 HE3 LYS 17 HE1 LYS 17 -10.827 -11.022 32.586
162 HZ1 LYS 17 HZ1 LYS 17 -10.109 -8.740 33.124
163 HZ2 LYS 17 HZ2 LYS 17 -9.545 -8.550 31.534
164 HZ3 LYS 17 HZ3 LYS 17 -8.860 -9.732 32.543
Start of MODEL 5
1 H1 GLU 1 HT1 GLU 1 9.443 -17.296 12.810
2 H2 GLU 1 HT2 GLU 1 8.906 -18.530 11.774
3 H3 GLU 1 HT3 GLU 1 10.570 -18.298 12.028
4 HA GLU 1 HA GLU 1 8.656 -19.757 13.552
5 HB2 GLU 1 HB2 GLU 1 11.739 -19.619 13.381
6 HB3 GLU 1 HB1 GLU 1 10.920 -20.682 14.587
7 HG2 GLU 1 HG2 GLU 1 9.738 -21.918 12.723
8 HG3 GLU 1 HG1 GLU 1 10.555 -20.863 11.504
9 H MET 2 HN MET 2 7.850 -19.345 15.576
10 HA MET 2 HA MET 2 9.436 -17.695 17.423
11 HB2 MET 2 HB2 MET 2 6.746 -16.984 16.277
12 HB3 MET 2 HB1 MET 2 6.794 -17.072 18.082
13 HG2 MET 2 HG2 MET 2 8.405 -15.359 18.254
14 HG3 MET 2 HG1 MET 2 8.854 -15.420 16.519
15 HE1 MET 2 HE1 MET 2 8.393 -12.766 18.060
16 HE2 MET 2 HE2 MET 2 7.439 -11.824 16.862
17 HE3 MET 2 HE3 MET 2 8.782 -12.882 16.306
18 H ALA 3 HN ALA 3 9.333 -18.353 19.460
19 HA ALA 3 HA ALA 3 7.513 -20.472 19.985
20 HB1 ALA 3 HB1 ALA 3 9.620 -19.717 21.905
21 HB2 ALA 3 HB2 ALA 3 10.034 -20.729 20.468
22 HB3 ALA 3 HB3 ALA 3 8.816 -21.319 21.678
23 H LEU 4 HN LEU 4 7.298 -17.390 20.212
24 HA LEU 4 HA LEU 4 6.236 -17.491 22.867
25 HB2 LEU 4 HB2 LEU 4 5.255 -15.356 21.228
26 HB3 LEU 4 HB1 LEU 4 6.010 -15.260 22.847
27 HG LEU 4 HG LEU 4 7.461 -15.574 20.219
28 HD11 LEU 4 HD11 LEU 4 6.659 -13.033 21.724
29 HD12 LEU 4 HD12 LEU 4 6.167 -13.602 20.075
30 HD13 LEU 4 HD13 LEU 4 7.882 -13.070 20.380
31 HD21 LEU 4 HD21 LEU 4 8.385 -15.239 23.107
32 HD22 LEU 4 HD22 LEU 4 9.402 -14.505 21.796
33 HD23 LEU 4 HD23 LEU 4 9.039 -16.288 21.780
34 H SER 5 HN SER 5 5.615 -18.119 19.707
35 HA SER 5 HA SER 5 3.120 -17.099 19.526
36 HB2 SER 5 HB2 SER 5 4.569 -17.581 17.679
37 HB3 SER 5 HB1 SER 5 4.508 -19.345 18.051
38 HG SER 5 HG SER 5 3.109 -18.473 16.300
39 H LYS 6 HN LYS 6 4.419 -19.674 21.244
40 HA LYS 6 HA LYS 6 2.048 -21.372 21.414
41 HB2 LYS 6 HB2 LYS 6 4.926 -21.222 22.429
42 HB3 LYS 6 HB1 LYS 6 3.769 -22.315 23.290
43 HG2 LYS 6 HG2 LYS 6 4.451 -23.905 21.807
44 HG3 LYS 6 HG1 LYS 6 3.379 -23.076 20.636
45 HD2 LYS 6 HD2 LYS 6 5.386 -21.630 19.937
46 HD3 LYS 6 HD1 LYS 6 6.417 -22.644 21.001
47 HE2 LYS 6 HE2 LYS 6 4.732 -23.835 18.670
48 HE3 LYS 6 HE1 LYS 6 6.445 -23.285 18.488
49 HZ1 LYS 6 HZ1 LYS 6 5.828 -25.153 20.667
50 HZ2 LYS 6 HZ2 LYS 6 7.207 -25.020 19.684
51 HZ3 LYS 6 HZ3 LYS 6 5.797 -25.747 19.077
52 H PHE 7 HN PHE 7 4.110 -19.056 22.973
53 HA PHE 7 HA PHE 7 2.792 -19.134 25.449
54 HB2 PHE 7 HB2 PHE 7 4.559 -17.024 24.265
55 HB3 PHE 7 HB1 PHE 7 3.957 -16.994 25.962
56 HD1 PHE 7 HD1 PHE 7 6.799 -16.819 25.064
57 HD2 PHE 7 HD2 PHE 7 4.482 -20.215 26.238
58 HE1 PHE 7 HE1 PHE 7 8.771 -17.995 25.696
59 HE2 PHE 7 HE2 PHE 7 6.465 -21.336 26.840
60 HZ PHE 7 HZ PHE 7 8.671 -20.273 26.613
61 H PHE 8 HN PHE 8 2.401 -17.498 22.420
62 HA PHE 8 HA PHE 8 0.619 -15.600 23.192
63 HB2 PHE 8 HB2 PHE 8 1.428 -16.783 20.628
64 HB3 PHE 8 HB1 PHE 8 -0.245 -16.082 20.577
65 HD1 PHE 8 HD1 PHE 8 3.122 -15.227 20.203
66 HD2 PHE 8 HD2 PHE 8 -0.397 -14.140 22.063
67 HE1 PHE 8 HE1 PHE 8 4.122 -13.310 20.972
68 HE2 PHE 8 HE2 PHE 8 0.359 -12.193 22.839
69 HZ PHE 8 HZ PHE 8 2.732 -11.688 22.262
70 H ARG 9 HN ARG 9 -0.134 -18.843 22.442
71 HA ARG 9 HA ARG 9 -2.789 -18.231 22.434
72 HB2 ARG 9 HB2 ARG 9 -0.995 -20.532 22.266
73 HB3 ARG 9 HB1 ARG 9 -2.364 -20.964 23.336
74 HG2 ARG 9 HG2 ARG 9 -3.440 -21.584 21.442
75 HG3 ARG 9 HG1 ARG 9 -3.699 -19.839 21.155
76 HD2 ARG 9 HD2 ARG 9 -2.040 -19.699 19.474
77 HD3 ARG 9 HD1 ARG 9 -1.110 -21.144 20.102
78 HE ARG 9 HE ARG 9 -3.665 -22.119 19.425
79 HH11 ARG 9 HH11 ARG 9 -0.983 -20.504 17.619
80 HH12 ARG 9 HH12 ARG 9 -1.348 -21.289 16.118
81 HH21 ARG 9 HH21 ARG 9 -4.109 -23.150 17.363
82 HH22 ARG 9 HH22 ARG 9 -3.135 -22.801 15.974
83 H ASP 10 HN ASP 10 -0.499 -18.079 25.026
84 HA ASP 10 HA ASP 10 -2.647 -18.868 26.789
85 HB2 ASP 10 HB2 ASP 10 0.292 -18.457 27.560
86 HB3 ASP 10 HB1 ASP 10 -1.009 -18.885 28.727
87 H PHE 11 HN PHE 11 -0.924 -15.867 25.842
88 HA PHE 11 HA PHE 11 -1.788 -14.708 28.348
89 HB2 PHE 11 HB2 PHE 11 -1.038 -12.907 26.051
90 HB3 PHE 11 HB1 PHE 11 -0.749 -12.652 27.827
91 HD1 PHE 11 HD1 PHE 11 0.159 -13.981 24.742
92 HD2 PHE 11 HD2 PHE 11 1.387 -13.643 28.767
93 HE1 PHE 11 HE1 PHE 11 2.241 -14.579 24.092
94 HE2 PHE 11 HE2 PHE 11 3.647 -14.237 28.083
95 HZ PHE 11 HZ PHE 11 4.157 -14.647 25.715
96 H ILE 12 HN ILE 12 -2.369 -14.143 24.870
97 HA ILE 12 HA ILE 12 -4.175 -12.013 25.375
98 HB ILE 12 HB ILE 12 -4.530 -13.332 22.821
99 HG12 ILE 12 HG12 ILE 12 -1.972 -11.866 22.735
100 HG13 ILE 12 HG11 ILE 12 -1.864 -13.395 23.703
101 HG21 ILE 12 HG21 ILE 12 -4.285 -10.976 21.963
102 HG22 ILE 12 HG22 ILE 12 -3.887 -10.418 23.633
103 HG23 ILE 12 HG23 ILE 12 -5.519 -11.108 23.273
104 HD11 ILE 12 HD11 ILE 12 -3.543 -13.814 21.360
105 HD12 ILE 12 HD12 ILE 12 -2.104 -14.673 22.027
106 HD13 ILE 12 HD13 ILE 12 -1.867 -13.236 20.939
107 H LEU 13 HN LEU 13 -4.477 -15.437 25.092
108 HA LEU 13 HA LEU 13 -7.166 -15.260 24.347
109 HB2 LEU 13 HB2 LEU 13 -5.218 -17.470 24.858
110 HB3 LEU 13 HB1 LEU 13 -6.952 -17.837 24.504
111 HG LEU 13 HG LEU 13 -6.595 -16.195 22.483
112 HD11 LEU 13 HD11 LEU 13 -3.832 -16.281 23.468
113 HD12 LEU 13 HD12 LEU 13 -4.715 -15.152 22.403
114 HD13 LEU 13 HD13 LEU 13 -3.986 -16.619 21.689
115 HD21 LEU 13 HD21 LEU 13 -7.070 -18.594 22.120
116 HD22 LEU 13 HD22 LEU 13 -5.348 -19.014 22.456
117 HD23 LEU 13 HD23 LEU 13 -5.775 -18.072 20.975
118 H GLN 14 HN GLN 14 -5.483 -15.290 27.312
119 HA GLN 14 HA GLN 14 -7.839 -16.093 28.878
120 HB2 GLN 14 HB2 GLN 14 -5.154 -14.787 29.705
121 HB3 GLN 14 HB1 GLN 14 -6.497 -15.106 30.879
122 HG2 GLN 14 HG2 GLN 14 -6.366 -17.598 30.243
123 HG3 GLN 14 HG1 GLN 14 -4.923 -17.205 29.231
124 HE21 GLN 14 HE21 GLN 14 -3.035 -17.781 30.337
125 HE22 GLN 14 HE22 GLN 14 -2.743 -17.546 32.028
126 H ARG 15 HN ARG 15 -6.987 -13.481 26.957
127 HA ARG 15 HA ARG 15 -8.478 -11.463 28.449
128 HB2 ARG 15 HB2 ARG 15 -6.905 -11.297 25.843
129 HB3 ARG 15 HB1 ARG 15 -7.542 -9.907 26.822
130 HG2 ARG 15 HG2 ARG 15 -5.922 -11.678 28.500
131 HG3 ARG 15 HG1 ARG 15 -5.026 -11.271 27.017
132 HD2 ARG 15 HD2 ARG 15 -5.151 -8.908 27.410
133 HD3 ARG 15 HD1 ARG 15 -6.425 -9.128 28.730
134 HE ARG 15 HE ARG 15 -4.046 -10.572 29.506
135 HH11 ARG 15 HH11 ARG 15 -5.046 -7.138 28.977
136 HH12 ARG 15 HH12 ARG 15 -3.924 -6.498 30.132
137 HH21 ARG 15 HH21 ARG 15 -2.548 -9.642 31.055
138 HH22 ARG 15 HH22 ARG 15 -2.497 -7.931 31.318
139 H LYS 16 HN LYS 16 -8.944 -13.933 26.346
140 HA LYS 16 HA LYS 16 -11.002 -12.638 24.774
141 HB2 LYS 16 HB2 LYS 16 -9.486 -15.171 24.709
142 HB3 LYS 16 HB1 LYS 16 -11.222 -15.466 24.491
143 HG2 LYS 16 HG2 LYS 16 -10.281 -15.263 22.322
144 HG3 LYS 16 HG1 LYS 16 -11.237 -13.765 22.639
145 HD2 LYS 16 HD2 LYS 16 -9.201 -12.435 22.862
146 HD3 LYS 16 HD1 LYS 16 -8.173 -13.900 22.980
147 HE2 LYS 16 HE2 LYS 16 -7.843 -12.967 20.744
148 HE3 LYS 16 HE1 LYS 16 -8.838 -14.461 20.534
149 HZ1 LYS 16 HZ1 LYS 16 -9.426 -11.780 19.839
150 HZ2 LYS 16 HZ2 LYS 16 -10.611 -12.354 20.912
151 HZ3 LYS 16 HZ3 LYS 16 -10.278 -13.204 19.479
152 H LYS 17 HN LYS 17 -12.014 -11.874 26.439
153 HA LYS 17 HA LYS 17 -13.527 -13.672 28.217
154 HB2 LYS 17 HB2 LYS 17 -12.682 -10.708 28.518
155 HB3 LYS 17 HB1 LYS 17 -13.599 -11.657 29.749
156 HG2 LYS 17 HG2 LYS 17 -11.688 -12.992 30.326
157 HG3 LYS 17 HG1 LYS 17 -10.813 -12.632 28.796
158 HD2 LYS 17 HD2 LYS 17 -9.678 -11.375 30.497
159 HD3 LYS 17 HD1 LYS 17 -10.632 -10.181 29.566
160 HE2 LYS 17 HE2 LYS 17 -12.371 -10.096 31.409
161 HE3 LYS 17 HE1 LYS 17 -11.473 -11.371 32.328
162 HZ1 LYS 17 HZ1 LYS 17 -10.238 -8.789 31.534
163 HZ2 LYS 17 HZ2 LYS 17 -9.715 -9.909 32.699
164 HZ3 LYS 17 HZ3 LYS 17 -11.116 -8.989 32.975
Start of MODEL 6
1 H1 GLU 1 HT1 GLU 1 9.906 -20.841 14.866
2 H2 GLU 1 HT2 GLU 1 11.155 -20.737 13.719
3 H3 GLU 1 HT3 GLU 1 9.581 -21.144 13.228
4 HA GLU 1 HA GLU 1 10.649 -18.713 13.105
5 HB2 GLU 1 HB2 GLU 1 7.706 -19.617 13.363
6 HB3 GLU 1 HB1 GLU 1 8.119 -17.890 13.048
7 HG2 GLU 1 HG2 GLU 1 9.339 -18.551 10.931
8 HG3 GLU 1 HG1 GLU 1 8.919 -20.283 11.231
9 H MET 2 HN MET 2 8.020 -19.351 15.605
10 HA MET 2 HA MET 2 9.534 -17.700 17.518
11 HB2 MET 2 HB2 MET 2 6.846 -17.023 16.330
12 HB3 MET 2 HB1 MET 2 6.882 -17.112 18.131
13 HG2 MET 2 HG2 MET 2 7.230 -14.838 17.606
14 HG3 MET 2 HG1 MET 2 8.836 -15.463 18.088
15 HE1 MET 2 HE1 MET 2 9.918 -13.308 17.176
16 HE2 MET 2 HE2 MET 2 8.301 -12.698 16.680
17 HE3 MET 2 HE3 MET 2 9.677 -12.635 15.526
18 H ALA 3 HN ALA 3 9.392 -18.386 19.542
19 HA ALA 3 HA ALA 3 7.559 -20.511 20.035
20 HB1 ALA 3 HB1 ALA 3 8.842 -21.360 21.743
21 HB2 ALA 3 HB2 ALA 3 9.623 -19.748 22.003
22 HB3 ALA 3 HB3 ALA 3 10.082 -20.753 20.572
23 H LEU 4 HN LEU 4 7.315 -17.443 20.229
24 HA LEU 4 HA LEU 4 6.231 -17.498 22.879
25 HB2 LEU 4 HB2 LEU 4 5.234 -15.408 21.191
26 HB3 LEU 4 HB1 LEU 4 6.001 -15.265 22.800
27 HG LEU 4 HG LEU 4 7.447 -15.644 20.175
28 HD11 LEU 4 HD11 LEU 4 6.606 -13.063 21.583
29 HD12 LEU 4 HD12 LEU 4 6.130 -13.699 19.955
30 HD13 LEU 4 HD13 LEU 4 7.835 -13.132 20.247
31 HD21 LEU 4 HD21 LEU 4 9.039 -16.276 21.750
32 HD22 LEU 4 HD22 LEU 4 8.366 -15.204 23.049
33 HD23 LEU 4 HD23 LEU 4 9.369 -14.488 21.717
34 H SER 5 HN SER 5 5.639 -18.234 19.737
35 HA SER 5 HA SER 5 3.134 -17.249 19.504
36 HB2 SER 5 HB2 SER 5 4.604 -17.802 17.685
37 HB3 SER 5 HB1 SER 5 4.532 -19.551 18.123
38 HG SER 5 HG SER 5 3.132 -18.640 16.336
39 H LYS 6 HN LYS 6 4.455 -19.732 21.332
40 HA LYS 6 HA LYS 6 2.117 -21.465 21.561
41 HB2 LYS 6 HB2 LYS 6 4.982 -21.206 22.590
42 HB3 LYS 6 HB1 LYS 6 3.840 -22.267 23.508
43 HG2 LYS 6 HG2 LYS 6 4.592 -23.917 22.140
44 HG3 LYS 6 HG1 LYS 6 3.481 -23.214 20.925
45 HD2 LYS 6 HD2 LYS 6 5.350 -21.835 19.975
46 HD3 LYS 6 HD1 LYS 6 6.471 -22.487 21.223
47 HE2 LYS 6 HE2 LYS 6 6.080 -24.856 20.292
48 HE3 LYS 6 HE1 LYS 6 5.068 -24.126 18.979
49 HZ1 LYS 6 HZ1 LYS 6 7.056 -24.203 17.977
50 HZ2 LYS 6 HZ2 LYS 6 7.960 -24.047 19.406
51 HZ3 LYS 6 HZ3 LYS 6 7.235 -22.680 18.707
52 H PHE 7 HN PHE 7 4.122 -19.048 23.034
53 HA PHE 7 HA PHE 7 2.776 -19.039 25.500
54 HB2 PHE 7 HB2 PHE 7 4.528 -16.954 24.245
55 HB3 PHE 7 HB1 PHE 7 3.906 -16.862 25.932
56 HD1 PHE 7 HD1 PHE 7 6.757 -16.689 25.052
57 HD2 PHE 7 HD2 PHE 7 4.469 -20.058 26.356
58 HE1 PHE 7 HE1 PHE 7 8.738 -17.813 25.755
59 HE2 PHE 7 HE2 PHE 7 6.459 -21.127 27.024
60 HZ PHE 7 HZ PHE 7 8.656 -20.049 26.769
61 H PHE 8 HN PHE 8 2.397 -17.539 22.397
62 HA PHE 8 HA PHE 8 0.579 -15.637 23.074
63 HB2 PHE 8 HB2 PHE 8 1.431 -16.909 20.567
64 HB3 PHE 8 HB1 PHE 8 -0.249 -16.229 20.472
65 HD1 PHE 8 HD1 PHE 8 3.112 -15.349 20.100
66 HD2 PHE 8 HD2 PHE 8 -0.440 -14.236 21.885
67 HE1 PHE 8 HE1 PHE 8 4.081 -13.391 20.806
68 HE2 PHE 8 HE2 PHE 8 0.287 -12.254 22.597
69 HZ PHE 8 HZ PHE 8 2.661 -11.741 22.023
70 H ARG 9 HN ARG 9 -0.118 -18.918 22.439
71 HA ARG 9 HA ARG 9 -2.783 -18.340 22.381
72 HB2 ARG 9 HB2 ARG 9 -0.957 -20.629 22.328
73 HB3 ARG 9 HB1 ARG 9 -2.356 -21.036 23.368
74 HG2 ARG 9 HG2 ARG 9 -3.342 -21.740 21.450
75 HG3 ARG 9 HG1 ARG 9 -3.646 -20.007 21.127
76 HD2 ARG 9 HD2 ARG 9 -1.915 -19.840 19.506
77 HD3 ARG 9 HD1 ARG 9 -1.005 -21.286 20.157
78 HE ARG 9 HE ARG 9 -3.537 -22.260 19.412
79 HH11 ARG 9 HH11 ARG 9 -0.814 -20.634 17.678
80 HH12 ARG 9 HH12 ARG 9 -1.140 -21.413 16.167
81 HH21 ARG 9 HH21 ARG 9 -3.927 -23.283 17.333
82 HH22 ARG 9 HH22 ARG 9 -2.919 -22.926 15.971
83 H ASP 10 HN ASP 10 -0.526 -18.068 24.984
84 HA ASP 10 HA ASP 10 -2.672 -18.844 26.757
85 HB2 ASP 10 HB2 ASP 10 0.254 -18.335 27.527
86 HB3 ASP 10 HB1 ASP 10 -1.040 -18.773 28.695
87 H PHE 11 HN PHE 11 -1.012 -15.845 25.702
88 HA PHE 11 HA PHE 11 -1.918 -14.616 28.159
89 HB2 PHE 11 HB2 PHE 11 -1.179 -12.881 25.806
90 HB3 PHE 11 HB1 PHE 11 -0.924 -12.554 27.574
91 HD1 PHE 11 HD1 PHE 11 0.065 -13.979 24.556
92 HD2 PHE 11 HD2 PHE 11 1.216 -13.459 28.585
93 HE1 PHE 11 HE1 PHE 11 2.170 -14.558 23.966
94 HE2 PHE 11 HE2 PHE 11 3.499 -14.031 27.963
95 HZ PHE 11 HZ PHE 11 4.059 -14.523 25.621
96 H ILE 12 HN ILE 12 -2.458 -14.145 24.662
97 HA ILE 12 HA ILE 12 -4.302 -12.033 25.069
98 HB ILE 12 HB ILE 12 -4.604 -13.444 22.557
99 HG12 ILE 12 HG12 ILE 12 -2.059 -11.953 22.467
100 HG13 ILE 12 HG11 ILE 12 -1.953 -13.449 23.485
101 HG21 ILE 12 HG21 ILE 12 -4.010 -10.498 23.279
102 HG22 ILE 12 HG22 ILE 12 -5.627 -11.219 22.913
103 HG23 ILE 12 HG23 ILE 12 -4.374 -11.120 21.622
104 HD11 ILE 12 HD11 ILE 12 -2.136 -14.780 21.842
105 HD12 ILE 12 HD12 ILE 12 -1.910 -13.373 20.713
106 HD13 ILE 12 HD13 ILE 12 -3.583 -13.969 21.131
107 H LEU 13 HN LEU 13 -4.585 -15.467 24.906
108 HA LEU 13 HA LEU 13 -7.236 -15.349 24.108
109 HB2 LEU 13 HB2 LEU 13 -5.266 -17.499 24.775
110 HB3 LEU 13 HB1 LEU 13 -6.981 -17.916 24.381
111 HG LEU 13 HG LEU 13 -6.577 -16.338 22.314
112 HD11 LEU 13 HD11 LEU 13 -3.958 -16.767 21.597
113 HD12 LEU 13 HD12 LEU 13 -3.845 -16.383 23.372
114 HD13 LEU 13 HD13 LEU 13 -4.706 -15.285 22.261
115 HD21 LEU 13 HD21 LEU 13 -7.032 -18.756 22.029
116 HD22 LEU 13 HD22 LEU 13 -5.312 -19.146 22.410
117 HD23 LEU 13 HD23 LEU 13 -5.721 -18.258 20.891
118 H GLN 14 HN GLN 14 -5.601 -15.289 27.101
119 HA GLN 14 HA GLN 14 -7.997 -16.010 28.651
120 HB2 GLN 14 HB2 GLN 14 -5.274 -14.805 29.506
121 HB3 GLN 14 HB1 GLN 14 -6.635 -15.115 30.661
122 HG2 GLN 14 HG2 GLN 14 -6.550 -17.605 29.926
123 HG3 GLN 14 HG1 GLN 14 -5.040 -17.198 29.021
124 HE21 GLN 14 HE21 GLN 14 -3.157 -17.612 30.203
125 HE22 GLN 14 HE22 GLN 14 -3.006 -17.524 31.927
126 H ARG 15 HN ARG 15 -7.138 -13.458 26.669
127 HA ARG 15 HA ARG 15 -8.356 -11.405 28.290
128 HB2 ARG 15 HB2 ARG 15 -6.901 -11.313 25.622
129 HB3 ARG 15 HB1 ARG 15 -7.471 -9.862 26.558
130 HG2 ARG 15 HG2 ARG 15 -5.925 -11.661 28.267
131 HG3 ARG 15 HG1 ARG 15 -5.020 -11.309 26.777
132 HD2 ARG 15 HD2 ARG 15 -5.071 -8.929 27.132
133 HD3 ARG 15 HD1 ARG 15 -6.324 -9.092 28.474
134 HE ARG 15 HE ARG 15 -3.979 -10.603 29.226
135 HH11 ARG 15 HH11 ARG 15 -4.887 -7.145 28.682
136 HH12 ARG 15 HH12 ARG 15 -3.725 -6.529 29.807
137 HH21 ARG 15 HH21 ARG 15 -2.424 -9.703 30.736
138 HH22 ARG 15 HH22 ARG 15 -2.317 -7.992 30.981
139 H LYS 16 HN LYS 16 -9.311 -13.687 26.213
140 HA LYS 16 HA LYS 16 -11.134 -12.265 24.544
141 HB2 LYS 16 HB2 LYS 16 -11.128 -15.126 25.655
142 HB3 LYS 16 HB1 LYS 16 -12.307 -14.564 24.401
143 HG2 LYS 16 HG2 LYS 16 -10.539 -14.188 22.770
144 HG3 LYS 16 HG1 LYS 16 -9.259 -14.369 24.005
145 HD2 LYS 16 HD2 LYS 16 -9.167 -16.384 22.829
146 HD3 LYS 16 HD1 LYS 16 -10.059 -16.778 24.332
147 HE2 LYS 16 HE2 LYS 16 -12.256 -16.757 23.091
148 HE3 LYS 16 HE1 LYS 16 -11.410 -16.258 21.570
149 HZ1 LYS 16 HZ1 LYS 16 -10.394 -18.313 21.406
150 HZ2 LYS 16 HZ2 LYS 16 -11.970 -18.688 21.919
151 HZ3 LYS 16 HZ3 LYS 16 -10.682 -18.735 23.025
152 H LYS 17 HN LYS 17 -11.233 -13.817 27.665
153 HA LYS 17 HA LYS 17 -12.626 -13.875 29.384
154 HB2 LYS 17 HB2 LYS 17 -12.825 -10.895 28.622
155 HB3 LYS 17 HB1 LYS 17 -13.278 -11.554 30.239
156 HG2 LYS 17 HG2 LYS 17 -11.037 -12.009 30.835
157 HG3 LYS 17 HG1 LYS 17 -10.483 -12.168 29.133
158 HD2 LYS 17 HD2 LYS 17 -9.510 -10.119 29.960
159 HD3 LYS 17 HD1 LYS 17 -10.832 -9.646 28.847
160 HE2 LYS 17 HE2 LYS 17 -10.890 -8.140 30.809
161 HE3 LYS 17 HE1 LYS 17 -12.338 -9.210 30.925
162 HZ1 LYS 17 HZ1 LYS 17 -11.422 -9.165 33.027
163 HZ2 LYS 17 HZ2 LYS 17 -9.819 -9.289 32.484
164 HZ3 LYS 17 HZ3 LYS 17 -10.849 -10.636 32.401
Start of MODEL 7
1 H1 GLU 1 HT1 GLU 1 10.571 -18.573 11.821
2 H2 GLU 1 HT2 GLU 1 10.393 -17.298 12.927
3 H3 GLU 1 HT3 GLU 1 9.020 -18.048 12.270
4 HA GLU 1 HA GLU 1 9.101 -19.787 13.622
5 HB2 GLU 1 HB2 GLU 1 12.171 -19.428 13.521
6 HB3 GLU 1 HB1 GLU 1 11.407 -20.570 14.691
7 HG2 GLU 1 HG2 GLU 1 10.350 -21.849 12.780
8 HG3 GLU 1 HG1 GLU 1 11.119 -20.717 11.599
9 H MET 2 HN MET 2 8.071 -19.261 15.520
10 HA MET 2 HA MET 2 9.564 -17.663 17.504
11 HB2 MET 2 HB2 MET 2 6.906 -16.996 16.246
12 HB3 MET 2 HB1 MET 2 6.899 -17.083 18.048
13 HG2 MET 2 HG2 MET 2 7.252 -14.800 17.501
14 HG3 MET 2 HG1 MET 2 8.822 -15.427 18.075
15 HE1 MET 2 HE1 MET 2 6.730 -15.262 14.624
16 HE2 MET 2 HE2 MET 2 7.616 -13.899 13.858
17 HE3 MET 2 HE3 MET 2 6.795 -13.659 15.439
18 H ALA 3 HN ALA 3 9.420 -18.409 19.495
19 HA ALA 3 HA ALA 3 7.549 -20.509 19.937
20 HB1 ALA 3 HB1 ALA 3 10.068 -20.797 20.479
21 HB2 ALA 3 HB2 ALA 3 8.809 -21.413 21.634
22 HB3 ALA 3 HB3 ALA 3 9.617 -19.821 21.929
23 H LEU 4 HN LEU 4 7.344 -17.447 20.174
24 HA LEU 4 HA LEU 4 6.262 -17.516 22.821
25 HB2 LEU 4 HB2 LEU 4 5.278 -15.405 21.155
26 HB3 LEU 4 HB1 LEU 4 6.051 -15.281 22.763
27 HG LEU 4 HG LEU 4 7.483 -15.645 20.128
28 HD11 LEU 4 HD11 LEU 4 6.184 -13.687 19.936
29 HD12 LEU 4 HD12 LEU 4 7.893 -13.134 20.234
30 HD13 LEU 4 HD13 LEU 4 6.665 -13.075 21.570
31 HD21 LEU 4 HD21 LEU 4 8.421 -15.252 23.002
32 HD22 LEU 4 HD22 LEU 4 9.422 -14.521 21.678
33 HD23 LEU 4 HD23 LEU 4 9.081 -16.308 21.685
34 H SER 5 HN SER 5 5.653 -18.208 19.667
35 HA SER 5 HA SER 5 3.155 -17.198 19.456
36 HB2 SER 5 HB2 SER 5 4.618 -17.738 17.626
37 HB3 SER 5 HB1 SER 5 4.530 -19.492 18.039
38 HG SER 5 HG SER 5 3.116 -18.449 16.280
39 H LYS 6 HN LYS 6 4.460 -19.723 21.240
40 HA LYS 6 HA LYS 6 2.107 -21.437 21.447
41 HB2 LYS 6 HB2 LYS 6 4.981 -21.228 22.460
42 HB3 LYS 6 HB1 LYS 6 3.835 -22.293 23.367
43 HG2 LYS 6 HG2 LYS 6 4.602 -23.914 21.961
44 HG3 LYS 6 HG1 LYS 6 3.428 -23.217 20.803
45 HD2 LYS 6 HD2 LYS 6 5.249 -21.786 19.805
46 HD3 LYS 6 HD1 LYS 6 6.426 -22.477 20.979
47 HE2 LYS 6 HE2 LYS 6 6.014 -24.808 19.997
48 HE3 LYS 6 HE1 LYS 6 4.901 -24.067 18.777
49 HZ1 LYS 6 HZ1 LYS 6 7.826 -23.818 19.057
50 HZ2 LYS 6 HZ2 LYS 6 6.940 -22.599 18.274
51 HZ3 LYS 6 HZ3 LYS 6 6.884 -24.194 17.694
52 H PHE 7 HN PHE 7 4.142 -19.067 22.953
53 HA PHE 7 HA PHE 7 2.814 -19.091 25.428
54 HB2 PHE 7 HB2 PHE 7 4.579 -17.000 24.202
55 HB3 PHE 7 HB1 PHE 7 3.975 -16.942 25.898
56 HD1 PHE 7 HD1 PHE 7 6.817 -16.773 25.007
57 HD2 PHE 7 HD2 PHE 7 4.510 -20.161 26.226
58 HE1 PHE 7 HE1 PHE 7 8.794 -17.934 25.661
59 HE2 PHE 7 HE2 PHE 7 6.495 -21.266 26.849
60 HZ PHE 7 HZ PHE 7 8.699 -20.199 26.610
61 H PHE 8 HN PHE 8 2.430 -17.532 22.356
62 HA PHE 8 HA PHE 8 0.636 -15.623 23.078
63 HB2 PHE 8 HB2 PHE 8 1.459 -16.864 20.544
64 HB3 PHE 8 HB1 PHE 8 -0.216 -16.170 20.471
65 HD1 PHE 8 HD1 PHE 8 3.149 -15.310 20.083
66 HD2 PHE 8 HD2 PHE 8 -0.380 -14.200 21.915
67 HE1 PHE 8 HE1 PHE 8 4.138 -13.372 20.812
68 HE2 PHE 8 HE2 PHE 8 0.367 -12.238 22.651
69 HZ PHE 8 HZ PHE 8 2.739 -11.730 22.068
70 H ARG 9 HN ARG 9 -0.092 -18.887 22.394
71 HA ARG 9 HA ARG 9 -2.751 -18.294 22.360
72 HB2 ARG 9 HB2 ARG 9 -0.942 -20.584 22.242
73 HB3 ARG 9 HB1 ARG 9 -2.300 -21.005 23.329
74 HG2 ARG 9 HG2 ARG 9 -3.392 -21.670 21.461
75 HG3 ARG 9 HG1 ARG 9 -3.651 -19.935 21.123
76 HD2 ARG 9 HD2 ARG 9 -2.000 -19.847 19.433
77 HD3 ARG 9 HD1 ARG 9 -1.064 -21.269 20.100
78 HE ARG 9 HE ARG 9 -3.616 -22.277 19.469
79 HH11 ARG 9 HH11 ARG 9 -0.965 -20.692 17.589
80 HH12 ARG 9 HH12 ARG 9 -1.341 -21.519 16.115
81 HH21 ARG 9 HH21 ARG 9 -4.073 -23.365 17.443
82 HH22 ARG 9 HH22 ARG 9 -3.120 -23.048 16.033
83 H ASP 10 HN ASP 10 -0.475 -18.073 24.957
84 HA ASP 10 HA ASP 10 -2.617 -18.859 26.730
85 HB2 ASP 10 HB2 ASP 10 0.317 -18.384 27.493
86 HB3 ASP 10 HB1 ASP 10 -0.974 -18.832 28.661
87 H PHE 11 HN PHE 11 -0.933 -15.854 25.726
88 HA PHE 11 HA PHE 11 -1.813 -14.660 28.209
89 HB2 PHE 11 HB2 PHE 11 -1.068 -12.895 25.880
90 HB3 PHE 11 HB1 PHE 11 -0.792 -12.602 27.652
91 HD1 PHE 11 HD1 PHE 11 0.151 -13.966 24.594
92 HD2 PHE 11 HD2 PHE 11 1.338 -13.579 28.629
93 HE1 PHE 11 HE1 PHE 11 2.244 -14.564 23.974
94 HE2 PHE 11 HE2 PHE 11 3.606 -14.171 27.975
95 HZ PHE 11 HZ PHE 11 4.143 -14.604 25.616
96 H ILE 12 HN ILE 12 -2.384 -14.154 24.724
97 HA ILE 12 HA ILE 12 -4.207 -12.036 25.192
98 HB ILE 12 HB ILE 12 -4.530 -13.381 22.649
99 HG12 ILE 12 HG12 ILE 12 -1.973 -11.909 22.575
100 HG13 ILE 12 HG11 ILE 12 -1.874 -13.429 23.558
101 HG21 ILE 12 HG21 ILE 12 -3.904 -10.457 23.430
102 HG22 ILE 12 HG22 ILE 12 -5.531 -11.156 23.068
103 HG23 ILE 12 HG23 ILE 12 -4.292 -11.040 21.765
104 HD11 ILE 12 HD11 ILE 12 -2.089 -14.725 21.890
105 HD12 ILE 12 HD12 ILE 12 -1.845 -13.296 20.792
106 HD13 ILE 12 HD13 ILE 12 -3.524 -13.876 21.203
107 H LEU 13 HN LEU 13 -4.496 -15.467 24.959
108 HA LEU 13 HA LEU 13 -7.159 -15.311 24.178
109 HB2 LEU 13 HB2 LEU 13 -5.210 -17.504 24.753
110 HB3 LEU 13 HB1 LEU 13 -6.936 -17.883 24.368
111 HG LEU 13 HG LEU 13 -6.539 -16.240 22.355
112 HD11 LEU 13 HD11 LEU 13 -3.798 -16.352 23.374
113 HD12 LEU 13 HD12 LEU 13 -4.654 -15.219 22.292
114 HD13 LEU 13 HD13 LEU 13 -3.928 -16.695 21.593
115 HD21 LEU 13 HD21 LEU 13 -5.716 -18.129 20.857
116 HD22 LEU 13 HD22 LEU 13 -7.042 -18.629 21.977
117 HD23 LEU 13 HD23 LEU 13 -5.332 -19.076 22.346
118 H GLN 14 HN GLN 14 -5.513 -15.345 27.164
119 HA GLN 14 HA GLN 14 -7.865 -16.152 28.720
120 HB2 GLN 14 HB2 GLN 14 -5.199 -14.806 29.544
121 HB3 GLN 14 HB1 GLN 14 -6.540 -15.133 30.718
122 HG2 GLN 14 HG2 GLN 14 -6.379 -17.630 30.075
123 HG3 GLN 14 HG1 GLN 14 -4.919 -17.212 29.098
124 HE21 GLN 14 HE21 GLN 14 -3.029 -17.706 30.239
125 HE22 GLN 14 HE22 GLN 14 -2.790 -17.490 31.942
126 H ARG 15 HN ARG 15 -7.123 -13.566 26.744
127 HA ARG 15 HA ARG 15 -8.546 -11.599 28.287
128 HB2 ARG 15 HB2 ARG 15 -7.098 -11.379 25.632
129 HB3 ARG 15 HB1 ARG 15 -7.767 -9.997 26.616
130 HG2 ARG 15 HG2 ARG 15 -6.195 -11.509 28.429
131 HG3 ARG 15 HG1 ARG 15 -5.273 -11.534 26.901
132 HD2 ARG 15 HD2 ARG 15 -5.231 -9.068 26.786
133 HD3 ARG 15 HD1 ARG 15 -6.373 -8.963 28.225
134 HE ARG 15 HE ARG 15 -3.988 -10.461 28.965
135 HH11 ARG 15 HH11 ARG 15 -5.004 -7.075 28.201
136 HH12 ARG 15 HH12 ARG 15 -3.775 -6.348 29.182
137 HH21 ARG 15 HH21 ARG 15 -2.348 -9.414 30.276
138 HH22 ARG 15 HH22 ARG 15 -2.258 -7.687 30.367
139 H LYS 16 HN LYS 16 -9.442 -14.060 26.684
140 HA LYS 16 HA LYS 16 -11.521 -12.767 25.080
141 HB2 LYS 16 HB2 LYS 16 -10.803 -15.684 25.657
142 HB3 LYS 16 HB1 LYS 16 -12.195 -15.189 24.619
143 HG2 LYS 16 HG2 LYS 16 -10.733 -14.142 22.982
144 HG3 LYS 16 HG1 LYS 16 -9.301 -14.274 24.049
145 HD2 LYS 16 HD2 LYS 16 -8.990 -15.968 22.460
146 HD3 LYS 16 HD1 LYS 16 -9.544 -16.801 23.944
147 HE2 LYS 16 HE2 LYS 16 -11.856 -17.087 22.970
148 HE3 LYS 16 HE1 LYS 16 -11.378 -16.139 21.504
149 HZ1 LYS 16 HZ1 LYS 16 -10.865 -18.093 20.672
150 HZ2 LYS 16 HZ2 LYS 16 -10.917 -18.889 22.171
151 HZ3 LYS 16 HZ3 LYS 16 -9.497 -18.098 21.678
152 H LYS 17 HN LYS 17 -12.107 -11.688 26.895
153 HA LYS 17 HA LYS 17 -13.667 -13.141 28.929
154 HB2 LYS 17 HB2 LYS 17 -12.451 -10.296 28.937
155 HB3 LYS 17 HB1 LYS 17 -13.278 -11.095 30.329
156 HG2 LYS 17 HG2 LYS 17 -11.453 -12.594 30.726
157 HG3 LYS 17 HG1 LYS 17 -10.773 -12.428 29.070
158 HD2 LYS 17 HD2 LYS 17 -9.280 -11.232 30.513
159 HD3 LYS 17 HD1 LYS 17 -10.206 -9.982 29.624
160 HE2 LYS 17 HE2 LYS 17 -11.646 -9.568 31.672
161 HE3 LYS 17 HE1 LYS 17 -10.782 -10.890 32.558
162 HZ1 LYS 17 HZ1 LYS 17 -9.960 -8.176 31.951
163 HZ2 LYS 17 HZ2 LYS 17 -8.751 -9.353 31.754
164 HZ3 LYS 17 HZ3 LYS 17 -9.550 -9.196 33.245
Start of MODEL 8
1 H1 GLU 1 HT1 GLU 1 9.368 -18.090 11.766
2 H2 GLU 1 HT2 GLU 1 8.756 -17.072 12.979
3 H3 GLU 1 HT3 GLU 1 7.716 -18.133 12.156
4 HA GLU 1 HA GLU 1 8.038 -19.649 13.661
5 HB2 GLU 1 HB2 GLU 1 10.972 -19.342 12.738
6 HB3 GLU 1 HB1 GLU 1 10.521 -20.544 14.005
7 HG2 GLU 1 HG2 GLU 1 8.930 -21.672 12.392
8 HG3 GLU 1 HG1 GLU 1 9.385 -20.481 11.111
9 H MET 2 HN MET 2 7.598 -19.258 15.803
10 HA MET 2 HA MET 2 9.653 -17.976 17.441
11 HB2 MET 2 HB2 MET 2 6.982 -16.759 16.802
12 HB3 MET 2 HB1 MET 2 7.247 -17.017 18.557
13 HG2 MET 2 HG2 MET 2 8.692 -15.149 16.629
14 HG3 MET 2 HG1 MET 2 7.857 -14.820 18.183
15 HE1 MET 2 HE1 MET 2 10.606 -13.568 17.246
16 HE2 MET 2 HE2 MET 2 11.505 -13.571 18.802
17 HE3 MET 2 HE3 MET 2 9.753 -13.173 18.780
18 H ALA 3 HN ALA 3 9.431 -18.331 19.640
19 HA ALA 3 HA ALA 3 7.694 -20.509 20.241
20 HB1 ALA 3 HB1 ALA 3 9.769 -19.620 22.137
21 HB2 ALA 3 HB2 ALA 3 10.224 -20.673 20.740
22 HB3 ALA 3 HB3 ALA 3 9.015 -21.253 21.966
23 H LEU 4 HN LEU 4 7.435 -17.400 20.393
24 HA LEU 4 HA LEU 4 6.309 -17.492 23.024
25 HB2 LEU 4 HB2 LEU 4 5.361 -15.355 21.378
26 HB3 LEU 4 HB1 LEU 4 6.088 -15.268 23.010
27 HG LEU 4 HG LEU 4 7.597 -15.581 20.419
28 HD11 LEU 4 HD11 LEU 4 6.740 -13.032 21.874
29 HD12 LEU 4 HD12 LEU 4 6.305 -13.619 20.217
30 HD13 LEU 4 HD13 LEU 4 8.006 -13.075 20.571
31 HD21 LEU 4 HD21 LEU 4 8.446 -15.228 23.325
32 HD22 LEU 4 HD22 LEU 4 9.491 -14.493 22.037
33 HD23 LEU 4 HD23 LEU 4 9.138 -16.278 22.019
34 H SER 5 HN SER 5 5.786 -18.155 19.868
35 HA SER 5 HA SER 5 3.290 -17.151 19.605
36 HB2 SER 5 HB2 SER 5 4.824 -17.668 17.815
37 HB3 SER 5 HB1 SER 5 4.694 -19.429 18.191
38 HG SER 5 HG SER 5 3.384 -18.752 16.412
39 H LYS 6 HN LYS 6 4.566 -19.686 21.400
40 HA LYS 6 HA LYS 6 2.219 -21.417 21.534
41 HB2 LYS 6 HB2 LYS 6 5.062 -21.191 22.633
42 HB3 LYS 6 HB1 LYS 6 3.894 -22.255 23.513
43 HG2 LYS 6 HG2 LYS 6 4.694 -23.885 22.143
44 HG3 LYS 6 HG1 LYS 6 3.569 -23.190 20.935
45 HD2 LYS 6 HD2 LYS 6 5.421 -21.780 19.991
46 HD3 LYS 6 HD1 LYS 6 6.552 -22.431 21.230
47 HE2 LYS 6 HE2 LYS 6 6.199 -24.792 20.280
48 HE3 LYS 6 HE1 LYS 6 5.154 -24.076 18.985
49 HZ1 LYS 6 HZ1 LYS 6 7.600 -24.506 18.519
50 HZ2 LYS 6 HZ2 LYS 6 7.917 -23.119 19.445
51 HZ3 LYS 6 HZ3 LYS 6 6.951 -23.007 18.052
52 H PHE 7 HN PHE 7 4.198 -19.045 23.115
53 HA PHE 7 HA PHE 7 2.796 -19.086 25.546
54 HB2 PHE 7 HB2 PHE 7 4.583 -16.981 24.380
55 HB3 PHE 7 HB1 PHE 7 3.925 -16.927 26.056
56 HD1 PHE 7 HD1 PHE 7 6.800 -16.757 25.224
57 HD2 PHE 7 HD2 PHE 7 4.460 -20.126 26.432
58 HE1 PHE 7 HE1 PHE 7 8.757 -17.909 25.941
59 HE2 PHE 7 HE2 PHE 7 6.429 -21.222 27.120
60 HZ PHE 7 HZ PHE 7 8.638 -20.161 26.920
61 H PHE 8 HN PHE 8 2.492 -17.510 22.473
62 HA PHE 8 HA PHE 8 0.666 -15.619 23.156
63 HB2 PHE 8 HB2 PHE 8 1.572 -16.831 20.639
64 HB3 PHE 8 HB1 PHE 8 -0.103 -16.144 20.522
65 HD1 PHE 8 HD1 PHE 8 3.266 -15.265 20.241
66 HD2 PHE 8 HD2 PHE 8 -0.318 -14.184 21.984
67 HE1 PHE 8 HE1 PHE 8 4.225 -13.329 21.014
68 HE2 PHE 8 HE2 PHE 8 0.400 -12.223 22.756
69 HZ PHE 8 HZ PHE 8 2.785 -11.703 22.242
70 H ARG 9 HN ARG 9 -0.028 -18.880 22.424
71 HA ARG 9 HA ARG 9 -2.689 -18.289 22.320
72 HB2 ARG 9 HB2 ARG 9 -0.869 -20.587 22.257
73 HB3 ARG 9 HB1 ARG 9 -2.304 -21.010 23.238
74 HG2 ARG 9 HG2 ARG 9 -3.201 -21.671 21.258
75 HG3 ARG 9 HG1 ARG 9 -3.535 -19.933 21.004
76 HD2 ARG 9 HD2 ARG 9 -1.743 -19.656 19.451
77 HD3 ARG 9 HD1 ARG 9 -0.854 -21.140 20.042
78 HE ARG 9 HE ARG 9 -3.360 -22.068 19.180
79 HH11 ARG 9 HH11 ARG 9 -0.616 -20.325 17.601
80 HH12 ARG 9 HH12 ARG 9 -0.913 -21.007 16.037
81 HH21 ARG 9 HH21 ARG 9 -3.709 -22.958 17.036
82 HH22 ARG 9 HH22 ARG 9 -2.681 -22.510 15.715
83 H ASP 10 HN ASP 10 -0.491 -18.090 24.978
84 HA ASP 10 HA ASP 10 -2.681 -18.901 26.681
85 HB2 ASP 10 HB2 ASP 10 0.227 -18.418 27.532
86 HB3 ASP 10 HB1 ASP 10 -1.095 -18.881 28.660
87 H PHE 11 HN PHE 11 -0.986 -15.885 25.739
88 HA PHE 11 HA PHE 11 -1.950 -14.711 28.199
89 HB2 PHE 11 HB2 PHE 11 -1.142 -12.921 25.912
90 HB3 PHE 11 HB1 PHE 11 -0.928 -12.643 27.694
91 HD1 PHE 11 HD1 PHE 11 0.126 -13.989 24.664
92 HD2 PHE 11 HD2 PHE 11 1.182 -13.593 28.732
93 HE1 PHE 11 HE1 PHE 11 2.241 -14.563 24.107
94 HE2 PHE 11 HE2 PHE 11 3.475 -14.161 28.148
95 HZ PHE 11 HZ PHE 11 4.089 -14.588 25.806
96 H ILE 12 HN ILE 12 -2.399 -14.150 24.701
97 HA ILE 12 HA ILE 12 -4.244 -12.040 25.113
98 HB ILE 12 HB ILE 12 -4.493 -13.396 22.562
99 HG12 ILE 12 HG12 ILE 12 -1.944 -11.911 22.560
100 HG13 ILE 12 HG11 ILE 12 -1.865 -13.426 23.551
101 HG21 ILE 12 HG21 ILE 12 -4.238 -11.053 21.682
102 HG22 ILE 12 HG22 ILE 12 -3.909 -10.467 23.357
103 HG23 ILE 12 HG23 ILE 12 -5.520 -11.177 22.944
104 HD11 ILE 12 HD11 ILE 12 -1.756 -13.304 20.785
105 HD12 ILE 12 HD12 ILE 12 -3.444 -13.894 21.151
106 HD13 ILE 12 HD13 ILE 12 -2.014 -14.725 21.877
107 H LEU 13 HN LEU 13 -4.537 -15.467 24.871
108 HA LEU 13 HA LEU 13 -7.167 -15.321 24.015
109 HB2 LEU 13 HB2 LEU 13 -5.221 -17.491 24.682
110 HB3 LEU 13 HB1 LEU 13 -6.928 -17.894 24.241
111 HG LEU 13 HG LEU 13 -6.474 -16.275 22.216
112 HD11 LEU 13 HD11 LEU 13 -3.766 -16.353 23.331
113 HD12 LEU 13 HD12 LEU 13 -4.599 -15.230 22.223
114 HD13 LEU 13 HD13 LEU 13 -3.842 -16.699 21.547
115 HD21 LEU 13 HD21 LEU 13 -5.600 -18.170 20.774
116 HD22 LEU 13 HD22 LEU 13 -6.931 -18.688 21.876
117 HD23 LEU 13 HD23 LEU 13 -5.218 -19.088 22.281
118 H GLN 14 HN GLN 14 -5.603 -15.332 27.043
119 HA GLN 14 HA GLN 14 -8.041 -16.061 28.523
120 HB2 GLN 14 HB2 GLN 14 -5.327 -14.906 29.469
121 HB3 GLN 14 HB1 GLN 14 -6.717 -15.231 30.585
122 HG2 GLN 14 HG2 GLN 14 -6.639 -17.702 29.796
123 HG3 GLN 14 HG1 GLN 14 -5.108 -17.290 28.929
124 HE21 GLN 14 HE21 GLN 14 -3.254 -17.759 30.134
125 HE22 GLN 14 HE22 GLN 14 -3.132 -17.709 31.863
126 H ARG 15 HN ARG 15 -7.110 -13.480 26.615
127 HA ARG 15 HA ARG 15 -8.336 -11.441 28.249
128 HB2 ARG 15 HB2 ARG 15 -6.814 -11.311 25.618
129 HB3 ARG 15 HB1 ARG 15 -7.381 -9.873 26.576
130 HG2 ARG 15 HG2 ARG 15 -5.878 -11.793 28.227
131 HG3 ARG 15 HG1 ARG 15 -4.942 -11.295 26.800
132 HD2 ARG 15 HD2 ARG 15 -5.011 -8.977 27.358
133 HD3 ARG 15 HD1 ARG 15 -6.342 -9.234 28.606
134 HE ARG 15 HE ARG 15 -4.034 -10.801 29.375
135 HH11 ARG 15 HH11 ARG 15 -4.947 -7.316 29.065
136 HH12 ARG 15 HH12 ARG 15 -3.865 -6.789 30.312
137 HH21 ARG 15 HH21 ARG 15 -2.591 -10.023 31.053
138 HH22 ARG 15 HH22 ARG 15 -2.519 -8.337 31.446
139 H LYS 16 HN LYS 16 -9.278 -13.675 26.127
140 HA LYS 16 HA LYS 16 -11.058 -12.192 24.452
141 HB2 LYS 16 HB2 LYS 16 -11.082 -15.088 25.470
142 HB3 LYS 16 HB1 LYS 16 -12.229 -14.479 24.208
143 HG2 LYS 16 HG2 LYS 16 -10.420 -14.061 22.631
144 HG3 LYS 16 HG1 LYS 16 -9.170 -14.293 23.890
145 HD2 LYS 16 HD2 LYS 16 -9.067 -16.268 22.650
146 HD3 LYS 16 HD1 LYS 16 -9.993 -16.704 24.118
147 HE2 LYS 16 HE2 LYS 16 -12.162 -16.628 22.832
148 HE3 LYS 16 HE1 LYS 16 -11.281 -16.083 21.346
149 HZ1 LYS 16 HZ1 LYS 16 -11.441 -18.715 22.593
150 HZ2 LYS 16 HZ2 LYS 16 -9.943 -18.290 21.915
151 HZ3 LYS 16 HZ3 LYS 16 -11.347 -18.267 20.959
152 H LYS 17 HN LYS 17 -11.202 -13.840 27.523
153 HA LYS 17 HA LYS 17 -12.618 -13.953 29.220
154 HB2 LYS 17 HB2 LYS 17 -12.854 -10.955 28.550
155 HB3 LYS 17 HB1 LYS 17 -13.282 -11.676 30.146
156 HG2 LYS 17 HG2 LYS 17 -11.028 -12.122 30.705
157 HG3 LYS 17 HG1 LYS 17 -10.488 -12.197 28.995
158 HD2 LYS 17 HD2 LYS 17 -9.542 -10.177 29.887
159 HD3 LYS 17 HD1 LYS 17 -10.904 -9.664 28.832
160 HE2 LYS 17 HE2 LYS 17 -12.356 -9.255 30.861
161 HE3 LYS 17 HE1 LYS 17 -11.036 -9.860 31.944
162 HZ1 LYS 17 HZ1 LYS 17 -10.465 -7.662 30.070
163 HZ2 LYS 17 HZ2 LYS 17 -9.816 -7.999 31.603
164 HZ3 LYS 17 HZ3 LYS 17 -11.377 -7.342 31.467
Start of MODEL 9
1 H1 GLU 1 HT1 GLU 1 9.117 -17.552 12.783
2 H2 GLU 1 HT2 GLU 1 9.459 -18.854 11.749
3 H3 GLU 1 HT3 GLU 1 10.727 -17.918 12.382
4 HA GLU 1 HA GLU 1 9.028 -19.904 13.704
5 HB2 GLU 1 HB2 GLU 1 12.065 -19.348 13.529
6 HB3 GLU 1 HB1 GLU 1 11.391 -20.491 14.751
7 HG2 GLU 1 HG2 GLU 1 10.404 -21.913 12.908
8 HG3 GLU 1 HG1 GLU 1 11.069 -20.776 11.671
9 H MET 2 HN MET 2 8.070 -19.431 15.650
10 HA MET 2 HA MET 2 9.478 -17.632 17.503
11 HB2 MET 2 HB2 MET 2 6.787 -17.127 16.246
12 HB3 MET 2 HB1 MET 2 6.796 -17.129 18.052
13 HG2 MET 2 HG2 MET 2 8.272 -15.310 18.187
14 HG3 MET 2 HG1 MET 2 8.821 -15.435 16.489
15 HE1 MET 2 HE1 MET 2 7.947 -14.244 14.581
16 HE2 MET 2 HE2 MET 2 6.246 -13.726 14.327
17 HE3 MET 2 HE3 MET 2 6.632 -15.469 14.523
18 H ALA 3 HN ALA 3 9.384 -18.280 19.533
19 HA ALA 3 HA ALA 3 7.610 -20.434 20.088
20 HB1 ALA 3 HB1 ALA 3 10.133 -20.614 20.608
21 HB2 ALA 3 HB2 ALA 3 8.915 -21.201 21.820
22 HB3 ALA 3 HB3 ALA 3 9.678 -19.571 22.009
23 H LEU 4 HN LEU 4 7.310 -17.360 20.220
24 HA LEU 4 HA LEU 4 6.223 -17.398 22.867
25 HB2 LEU 4 HB2 LEU 4 5.203 -15.348 21.143
26 HB3 LEU 4 HB1 LEU 4 5.939 -15.174 22.764
27 HG LEU 4 HG LEU 4 7.425 -15.548 20.164
28 HD11 LEU 4 HD11 LEU 4 7.776 -13.030 20.224
29 HD12 LEU 4 HD12 LEU 4 6.546 -12.970 21.560
30 HD13 LEU 4 HD13 LEU 4 6.080 -13.616 19.932
31 HD21 LEU 4 HD21 LEU 4 8.309 -15.080 23.046
32 HD22 LEU 4 HD22 LEU 4 9.318 -14.365 21.718
33 HD23 LEU 4 HD23 LEU 4 9.005 -16.156 21.764
34 H SER 5 HN SER 5 5.653 -18.167 19.730
35 HA SER 5 HA SER 5 3.132 -17.224 19.488
36 HB2 SER 5 HB2 SER 5 4.607 -17.734 17.673
37 HB3 SER 5 HB1 SER 5 4.597 -19.483 18.113
38 HG SER 5 HG SER 5 3.201 -18.997 16.359
39 H LYS 6 HN LYS 6 4.492 -19.682 21.321
40 HA LYS 6 HA LYS 6 2.184 -21.455 21.542
41 HB2 LYS 6 HB2 LYS 6 5.042 -21.146 22.580
42 HB3 LYS 6 HB1 LYS 6 3.914 -22.216 23.504
43 HG2 LYS 6 HG2 LYS 6 4.733 -23.855 22.154
44 HG3 LYS 6 HG1 LYS 6 3.561 -23.218 20.960
45 HD2 LYS 6 HD2 LYS 6 5.354 -21.779 19.942
46 HD3 LYS 6 HD1 LYS 6 6.532 -22.386 21.161
47 HE2 LYS 6 HE2 LYS 6 6.210 -24.765 20.259
48 HE3 LYS 6 HE1 LYS 6 5.107 -24.100 18.986
49 HZ1 LYS 6 HZ1 LYS 6 7.556 -22.667 19.060
50 HZ2 LYS 6 HZ2 LYS 6 6.844 -23.549 17.795
51 HZ3 LYS 6 HZ3 LYS 6 7.853 -24.333 18.914
52 H PHE 7 HN PHE 7 4.145 -19.005 23.025
53 HA PHE 7 HA PHE 7 2.796 -19.017 25.486
54 HB2 PHE 7 HB2 PHE 7 4.510 -16.901 24.231
55 HB3 PHE 7 HB1 PHE 7 3.888 -16.823 25.919
56 HD1 PHE 7 HD1 PHE 7 6.736 -16.598 25.041
57 HD2 PHE 7 HD2 PHE 7 4.507 -20.009 26.336
58 HE1 PHE 7 HE1 PHE 7 8.736 -17.687 25.741
59 HE2 PHE 7 HE2 PHE 7 6.516 -21.044 27.004
60 HZ PHE 7 HZ PHE 7 8.693 -19.926 26.751
61 H PHE 8 HN PHE 8 2.396 -17.520 22.386
62 HA PHE 8 HA PHE 8 0.547 -15.650 23.058
63 HB2 PHE 8 HB2 PHE 8 1.425 -16.910 20.555
64 HB3 PHE 8 HB1 PHE 8 -0.266 -16.257 20.456
65 HD1 PHE 8 HD1 PHE 8 3.078 -15.322 20.079
66 HD2 PHE 8 HD2 PHE 8 -0.486 -14.264 21.876
67 HE1 PHE 8 HE1 PHE 8 4.017 -13.348 20.781
68 HE2 PHE 8 HE2 PHE 8 0.212 -12.272 22.580
69 HZ PHE 8 HZ PHE 8 2.573 -11.721 22.001
70 H ARG 9 HN ARG 9 -0.096 -18.941 22.425
71 HA ARG 9 HA ARG 9 -2.770 -18.408 22.363
72 HB2 ARG 9 HB2 ARG 9 -0.905 -20.668 22.317
73 HB3 ARG 9 HB1 ARG 9 -2.305 -21.097 23.345
74 HG2 ARG 9 HG2 ARG 9 -3.241 -21.827 21.408
75 HG3 ARG 9 HG1 ARG 9 -3.606 -20.102 21.106
76 HD2 ARG 9 HD2 ARG 9 -1.859 -19.848 19.504
77 HD3 ARG 9 HD1 ARG 9 -0.926 -21.293 20.127
78 HE ARG 9 HE ARG 9 -3.426 -22.307 19.352
79 HH11 ARG 9 HH11 ARG 9 -0.763 -20.550 17.653
80 HH12 ARG 9 HH12 ARG 9 -1.079 -21.290 16.119
81 HH21 ARG 9 HH21 ARG 9 -3.804 -23.274 17.245
82 HH22 ARG 9 HH22 ARG 9 -2.816 -22.846 15.887
83 H ASP 10 HN ASP 10 -0.525 -18.099 24.971
84 HA ASP 10 HA ASP 10 -2.670 -18.900 26.738
85 HB2 ASP 10 HB2 ASP 10 0.244 -18.358 27.527
86 HB3 ASP 10 HB1 ASP 10 -1.057 -18.785 28.694
87 H PHE 11 HN PHE 11 -1.051 -15.885 25.673
88 HA PHE 11 HA PHE 11 -1.998 -14.665 28.119
89 HB2 PHE 11 HB2 PHE 11 -1.267 -12.919 25.772
90 HB3 PHE 11 HB1 PHE 11 -1.030 -12.589 27.542
91 HD1 PHE 11 HD1 PHE 11 0.002 -13.997 24.531
92 HD2 PHE 11 HD2 PHE 11 1.116 -13.461 28.567
93 HE1 PHE 11 HE1 PHE 11 2.118 -14.544 23.954
94 HE2 PHE 11 HE2 PHE 11 3.412 -14.000 27.961
95 HZ PHE 11 HZ PHE 11 3.996 -14.483 25.624
96 H ILE 12 HN ILE 12 -2.510 -14.178 24.615
97 HA ILE 12 HA ILE 12 -4.387 -12.097 24.998
98 HB ILE 12 HB ILE 12 -4.667 -13.551 22.503
99 HG12 ILE 12 HG12 ILE 12 -2.153 -12.008 22.394
100 HG13 ILE 12 HG11 ILE 12 -2.018 -13.487 23.432
101 HG21 ILE 12 HG21 ILE 12 -5.740 -11.346 22.815
102 HG22 ILE 12 HG22 ILE 12 -4.478 -11.233 21.534
103 HG23 ILE 12 HG23 ILE 12 -4.143 -10.582 23.184
104 HD11 ILE 12 HD11 ILE 12 -3.629 -14.065 21.075
105 HD12 ILE 12 HD12 ILE 12 -2.179 -14.848 21.810
106 HD13 ILE 12 HD13 ILE 12 -1.963 -13.453 20.664
107 H LEU 13 HN LEU 13 -4.634 -15.515 24.831
108 HA LEU 13 HA LEU 13 -7.277 -15.477 24.049
109 HB2 LEU 13 HB2 LEU 13 -5.253 -17.555 24.772
110 HB3 LEU 13 HB1 LEU 13 -6.955 -18.034 24.388
111 HG LEU 13 HG LEU 13 -6.595 -16.502 22.282
112 HD11 LEU 13 HD11 LEU 13 -3.862 -16.438 23.342
113 HD12 LEU 13 HD12 LEU 13 -4.757 -15.389 22.210
114 HD13 LEU 13 HD13 LEU 13 -3.966 -16.859 21.577
115 HD21 LEU 13 HD21 LEU 13 -5.678 -18.434 20.915
116 HD22 LEU 13 HD22 LEU 13 -6.973 -18.942 22.064
117 HD23 LEU 13 HD23 LEU 13 -5.241 -19.264 22.459
118 H GLN 14 HN GLN 14 -5.660 -15.353 27.057
119 HA GLN 14 HA GLN 14 -8.079 -16.056 28.600
120 HB2 GLN 14 HB2 GLN 14 -5.327 -14.952 29.499
121 HB3 GLN 14 HB1 GLN 14 -6.699 -15.295 30.632
122 HG2 GLN 14 HG2 GLN 14 -6.639 -17.752 29.778
123 HG3 GLN 14 HG1 GLN 14 -5.107 -17.320 28.920
124 HE21 GLN 14 HE21 GLN 14 -3.225 -17.711 30.113
125 HE22 GLN 14 HE22 GLN 14 -3.115 -17.745 31.842
126 H ARG 15 HN ARG 15 -7.126 -13.494 26.680
127 HA ARG 15 HA ARG 15 -8.234 -11.386 28.352
128 HB2 ARG 15 HB2 ARG 15 -6.806 -11.376 25.652
129 HB3 ARG 15 HB1 ARG 15 -7.295 -9.895 26.584
130 HG2 ARG 15 HG2 ARG 15 -5.772 -11.873 28.179
131 HG3 ARG 15 HG1 ARG 15 -4.878 -11.303 26.750
132 HD2 ARG 15 HD2 ARG 15 -4.958 -9.013 27.410
133 HD3 ARG 15 HD1 ARG 15 -6.246 -9.336 28.685
134 HE ARG 15 HE ARG 15 -3.904 -10.912 29.317
135 HH11 ARG 15 HH11 ARG 15 -4.851 -7.424 29.179
136 HH12 ARG 15 HH12 ARG 15 -3.735 -6.939 30.411
137 HH21 ARG 15 HH21 ARG 15 -2.414 -10.189 30.979
138 HH22 ARG 15 HH22 ARG 15 -2.342 -8.521 31.439
139 H LYS 16 HN LYS 16 -9.340 -13.644 26.288
140 HA LYS 16 HA LYS 16 -11.097 -12.072 24.650
141 HB2 LYS 16 HB2 LYS 16 -11.496 -14.958 25.614
142 HB3 LYS 16 HB1 LYS 16 -12.336 -14.204 24.212
143 HG2 LYS 16 HG2 LYS 16 -9.358 -14.876 24.449
144 HG3 LYS 16 HG1 LYS 16 -10.542 -15.793 23.508
145 HD2 LYS 16 HD2 LYS 16 -9.652 -12.886 22.899
146 HD3 LYS 16 HD1 LYS 16 -8.926 -14.357 22.178
147 HE2 LYS 16 HE2 LYS 16 -11.190 -14.955 21.154
148 HE3 LYS 16 HE1 LYS 16 -11.887 -13.434 21.846
149 HZ1 LYS 16 HZ1 LYS 16 -11.154 -13.337 19.492
150 HZ2 LYS 16 HZ2 LYS 16 -9.544 -13.488 20.014
151 HZ3 LYS 16 HZ3 LYS 16 -10.473 -12.150 20.498
152 H LYS 17 HN LYS 17 -11.238 -13.753 27.722
153 HA LYS 17 HA LYS 17 -12.629 -13.822 29.437
154 HB2 LYS 17 HB2 LYS 17 -12.775 -10.809 28.805
155 HB3 LYS 17 HB1 LYS 17 -13.154 -11.542 30.409
156 HG2 LYS 17 HG2 LYS 17 -10.890 -12.075 30.855
157 HG3 LYS 17 HG1 LYS 17 -10.430 -12.123 29.121
158 HD2 LYS 17 HD2 LYS 17 -9.388 -10.154 30.012
159 HD3 LYS 17 HD1 LYS 17 -10.782 -9.576 29.036
160 HE2 LYS 17 HE2 LYS 17 -12.123 -9.182 31.146
161 HE3 LYS 17 HE1 LYS 17 -10.764 -9.843 32.144
162 HZ1 LYS 17 HZ1 LYS 17 -9.410 -8.041 31.517
163 HZ2 LYS 17 HZ2 LYS 17 -10.911 -7.387 31.969
164 HZ3 LYS 17 HZ3 LYS 17 -10.496 -7.505 30.326
Start of MODEL 10
1 H1 GLU 1 HT1 GLU 1 10.281 -20.793 14.951
2 H2 GLU 1 HT2 GLU 1 10.990 -20.885 13.410
3 H3 GLU 1 HT3 GLU 1 9.331 -21.196 13.601
4 HA GLU 1 HA GLU 1 10.654 -18.777 13.130
5 HB2 GLU 1 HB2 GLU 1 7.710 -19.669 13.385
6 HB3 GLU 1 HB1 GLU 1 8.119 -17.939 13.084
7 HG2 GLU 1 HG2 GLU 1 9.349 -18.583 10.965
8 HG3 GLU 1 HG1 GLU 1 8.927 -20.317 11.251
9 H MET 2 HN MET 2 8.013 -19.351 15.625
10 HA MET 2 HA MET 2 9.543 -17.701 17.526
11 HB2 MET 2 HB2 MET 2 6.866 -17.011 16.329
12 HB3 MET 2 HB1 MET 2 6.887 -17.101 18.131
13 HG2 MET 2 HG2 MET 2 7.248 -14.824 17.585
14 HG3 MET 2 HG1 MET 2 8.833 -15.460 18.119
15 HE1 MET 2 HE1 MET 2 9.848 -12.691 15.582
16 HE2 MET 2 HE2 MET 2 10.022 -13.379 17.233
17 HE3 MET 2 HE3 MET 2 8.442 -12.699 16.704
18 H ALA 3 HN ALA 3 9.392 -18.366 19.557
19 HA ALA 3 HA ALA 3 7.564 -20.492 20.054
20 HB1 ALA 3 HB1 ALA 3 9.634 -19.716 22.010
21 HB2 ALA 3 HB2 ALA 3 10.077 -20.743 20.593
22 HB3 ALA 3 HB3 ALA 3 8.836 -21.320 21.785
23 H LEU 4 HN LEU 4 7.313 -17.422 20.239
24 HA LEU 4 HA LEU 4 6.220 -17.477 22.884
25 HB2 LEU 4 HB2 LEU 4 5.226 -15.391 21.189
26 HB3 LEU 4 HB1 LEU 4 5.986 -15.245 22.801
27 HG LEU 4 HG LEU 4 7.447 -15.627 20.186
28 HD11 LEU 4 HD11 LEU 4 6.599 -13.040 21.580
29 HD12 LEU 4 HD12 LEU 4 6.122 -13.687 19.956
30 HD13 LEU 4 HD13 LEU 4 7.828 -13.117 20.244
31 HD21 LEU 4 HD21 LEU 4 8.348 -15.181 23.064
32 HD22 LEU 4 HD22 LEU 4 9.355 -14.459 21.739
33 HD23 LEU 4 HD23 LEU 4 9.033 -16.249 21.770
34 H SER 5 HN SER 5 5.640 -18.203 19.734
35 HA SER 5 HA SER 5 3.133 -17.228 19.498
36 HB2 SER 5 HB2 SER 5 4.608 -17.773 17.681
37 HB3 SER 5 HB1 SER 5 4.542 -19.522 18.117
38 HG SER 5 HG SER 5 3.107 -18.466 16.348
39 H LYS 6 HN LYS 6 4.449 -19.719 21.323
40 HA LYS 6 HA LYS 6 2.105 -21.449 21.533
41 HB2 LYS 6 HB2 LYS 6 4.970 -21.210 22.568
42 HB3 LYS 6 HB1 LYS 6 3.823 -22.291 23.460
43 HG2 LYS 6 HG2 LYS 6 4.551 -23.921 22.045
44 HG3 LYS 6 HG1 LYS 6 3.471 -23.159 20.837
45 HD2 LYS 6 HD2 LYS 6 5.450 -21.700 20.089
46 HD3 LYS 6 HD1 LYS 6 6.497 -22.647 21.201
47 HE2 LYS 6 HE2 LYS 6 4.854 -23.963 18.906
48 HE3 LYS 6 HE1 LYS 6 6.563 -23.399 18.724
49 HZ1 LYS 6 HZ1 LYS 6 5.731 -25.316 20.838
50 HZ2 LYS 6 HZ2 LYS 6 7.291 -24.980 20.255
51 HZ3 LYS 6 HZ3 LYS 6 6.178 -25.807 19.275
52 H PHE 7 HN PHE 7 4.109 -19.041 23.020
53 HA PHE 7 HA PHE 7 2.760 -19.047 25.484
54 HB2 PHE 7 HB2 PHE 7 4.523 -16.961 24.247
55 HB3 PHE 7 HB1 PHE 7 3.895 -16.877 25.933
56 HD1 PHE 7 HD1 PHE 7 6.753 -16.715 25.060
57 HD2 PHE 7 HD2 PHE 7 4.441 -20.073 26.347
58 HE1 PHE 7 HE1 PHE 7 8.724 -17.852 25.761
59 HE2 PHE 7 HE2 PHE 7 6.422 -21.157 27.016
60 HZ PHE 7 HZ PHE 7 8.625 -20.093 26.768
61 H PHE 8 HN PHE 8 2.389 -17.534 22.388
62 HA PHE 8 HA PHE 8 0.572 -15.633 23.071
63 HB2 PHE 8 HB2 PHE 8 1.426 -16.892 20.558
64 HB3 PHE 8 HB1 PHE 8 -0.254 -16.212 20.466
65 HD1 PHE 8 HD1 PHE 8 3.108 -15.329 20.098
66 HD2 PHE 8 HD2 PHE 8 -0.445 -14.225 21.889
67 HE1 PHE 8 HE1 PHE 8 4.075 -13.374 20.814
68 HE2 PHE 8 HE2 PHE 8 0.282 -12.246 22.608
69 HZ PHE 8 HZ PHE 8 2.653 -11.730 22.037
70 H ARG 9 HN ARG 9 -0.122 -18.910 22.424
71 HA ARG 9 HA ARG 9 -2.787 -18.340 22.365
72 HB2 ARG 9 HB2 ARG 9 -0.956 -20.618 22.293
73 HB3 ARG 9 HB1 ARG 9 -2.330 -21.037 23.361
74 HG2 ARG 9 HG2 ARG 9 -3.369 -21.738 21.475
75 HG3 ARG 9 HG1 ARG 9 -3.656 -20.007 21.127
76 HD2 ARG 9 HD2 ARG 9 -1.956 -19.889 19.477
77 HD3 ARG 9 HD1 ARG 9 -1.040 -21.324 20.147
78 HE ARG 9 HE ARG 9 -3.579 -22.314 19.460
79 HH11 ARG 9 HH11 ARG 9 -0.897 -20.713 17.643
80 HH12 ARG 9 HH12 ARG 9 -1.253 -21.517 16.151
81 HH21 ARG 9 HH21 ARG 9 -4.010 -23.372 17.409
82 HH22 ARG 9 HH22 ARG 9 -3.033 -23.036 16.018
83 H ASP 10 HN ASP 10 -0.531 -18.069 24.971
84 HA ASP 10 HA ASP 10 -2.677 -18.850 26.743
85 HB2 ASP 10 HB2 ASP 10 0.247 -18.335 27.516
86 HB3 ASP 10 HB1 ASP 10 -1.047 -18.779 28.682
87 H PHE 11 HN PHE 11 -1.017 -15.848 25.696
88 HA PHE 11 HA PHE 11 -1.928 -14.625 28.154
89 HB2 PHE 11 HB2 PHE 11 -1.181 -12.881 25.811
90 HB3 PHE 11 HB1 PHE 11 -0.927 -12.564 27.581
91 HD1 PHE 11 HD1 PHE 11 0.062 -13.975 24.558
92 HD2 PHE 11 HD2 PHE 11 1.209 -13.480 28.590
93 HE1 PHE 11 HE1 PHE 11 2.165 -14.556 23.966
94 HE2 PHE 11 HE2 PHE 11 3.491 -14.054 27.968
95 HZ PHE 11 HZ PHE 11 4.052 -14.534 25.624
96 H ILE 12 HN ILE 12 -2.463 -14.144 24.656
97 HA ILE 12 HA ILE 12 -4.307 -12.033 25.067
98 HB ILE 12 HB ILE 12 -4.608 -13.440 22.551
99 HG12 ILE 12 HG12 ILE 12 -2.066 -11.948 22.460
100 HG13 ILE 12 HG11 ILE 12 -1.959 -13.443 23.479
101 HG21 ILE 12 HG21 ILE 12 -4.380 -11.113 21.620
102 HG22 ILE 12 HG22 ILE 12 -4.018 -10.494 23.276
103 HG23 ILE 12 HG23 ILE 12 -5.634 -11.218 22.911
104 HD11 ILE 12 HD11 ILE 12 -3.586 -13.959 21.121
105 HD12 ILE 12 HD12 ILE 12 -2.148 -14.778 21.841
106 HD13 ILE 12 HD13 ILE 12 -1.910 -13.374 20.711
107 H LEU 13 HN LEU 13 -4.587 -15.466 24.902
108 HA LEU 13 HA LEU 13 -7.237 -15.349 24.106
109 HB2 LEU 13 HB2 LEU 13 -5.268 -17.500 24.769
110 HB3 LEU 13 HB1 LEU 13 -6.984 -17.915 24.375
111 HG LEU 13 HG LEU 13 -6.581 -16.333 22.310
112 HD11 LEU 13 HD11 LEU 13 -4.708 -15.283 22.254
113 HD12 LEU 13 HD12 LEU 13 -3.963 -16.762 21.590
114 HD13 LEU 13 HD13 LEU 13 -3.848 -16.384 23.366
115 HD21 LEU 13 HD21 LEU 13 -5.725 -18.253 20.885
116 HD22 LEU 13 HD22 LEU 13 -7.040 -18.749 22.017
117 HD23 LEU 13 HD23 LEU 13 -5.321 -19.144 22.403
118 H GLN 14 HN GLN 14 -5.601 -15.292 27.096
119 HA GLN 14 HA GLN 14 -7.998 -16.004 28.648
120 HB2 GLN 14 HB2 GLN 14 -5.270 -14.810 29.504
121 HB3 GLN 14 HB1 GLN 14 -6.632 -15.118 30.658
122 HG2 GLN 14 HG2 GLN 14 -6.555 -17.606 29.934
123 HG3 GLN 14 HG1 GLN 14 -5.054 -17.208 29.008
124 HE21 GLN 14 HE21 GLN 14 -3.163 -17.648 30.169
125 HE22 GLN 14 HE22 GLN 14 -2.987 -17.546 31.890
126 H ARG 15 HN ARG 15 -7.132 -13.460 26.662
127 HA ARG 15 HA ARG 15 -8.339 -11.397 28.278
128 HB2 ARG 15 HB2 ARG 15 -6.876 -11.310 25.612
129 HB3 ARG 15 HB1 ARG 15 -7.438 -9.857 26.549
130 HG2 ARG 15 HG2 ARG 15 -5.885 -11.713 28.221
131 HG3 ARG 15 HG1 ARG 15 -4.983 -11.263 26.758
132 HD2 ARG 15 HD2 ARG 15 -5.047 -8.925 27.238
133 HD3 ARG 15 HD1 ARG 15 -6.352 -9.144 28.521
134 HE ARG 15 HE ARG 15 -4.017 -10.676 29.290
135 HH11 ARG 15 HH11 ARG 15 -4.975 -7.209 28.905
136 HH12 ARG 15 HH12 ARG 15 -3.876 -6.638 30.116
137 HH21 ARG 15 HH21 ARG 15 -2.552 -9.836 30.918
138 HH22 ARG 15 HH22 ARG 15 -2.491 -8.140 31.264
139 H LYS 16 HN LYS 16 -9.313 -13.685 26.232
140 HA LYS 16 HA LYS 16 -11.141 -12.251 24.564
141 HB2 LYS 16 HB2 LYS 16 -11.120 -15.124 25.645
142 HB3 LYS 16 HB1 LYS 16 -12.302 -14.551 24.400
143 HG2 LYS 16 HG2 LYS 16 -10.539 -14.156 22.770
144 HG3 LYS 16 HG1 LYS 16 -9.255 -14.345 24.001
145 HD2 LYS 16 HD2 LYS 16 -9.163 -16.345 22.798
146 HD3 LYS 16 HD1 LYS 16 -10.037 -16.759 24.304
147 HE2 LYS 16 HE2 LYS 16 -12.243 -16.752 23.089
148 HE3 LYS 16 HE1 LYS 16 -11.426 -16.212 21.565
149 HZ1 LYS 16 HZ1 LYS 16 -10.377 -18.625 22.820
150 HZ2 LYS 16 HZ2 LYS 16 -10.651 -18.253 21.185
151 HZ3 LYS 16 HZ3 LYS 16 -11.945 -18.733 22.176
152 H LYS 17 HN LYS 17 -11.205 -13.827 27.675
153 HA LYS 17 HA LYS 17 -12.586 -13.910 29.404
154 HB2 LYS 17 HB2 LYS 17 -12.843 -10.926 28.677
155 HB3 LYS 17 HB1 LYS 17 -13.230 -11.615 30.298
156 HG2 LYS 17 HG2 LYS 17 -10.962 -12.045 30.811
157 HG3 LYS 17 HG1 LYS 17 -10.464 -12.152 29.091
158 HD2 LYS 17 HD2 LYS 17 -9.503 -10.112 29.911
159 HD3 LYS 17 HD1 LYS 17 -10.898 -9.622 28.891
160 HE2 LYS 17 HE2 LYS 17 -12.288 -9.185 30.959
161 HE3 LYS 17 HE1 LYS 17 -10.929 -9.761 32.007
162 HZ1 LYS 17 HZ1 LYS 17 -11.157 -7.304 30.391
163 HZ2 LYS 17 HZ2 LYS 17 -9.624 -7.936 30.759
164 HZ3 LYS 17 HZ3 LYS 17 -10.690 -7.511 32.011
Start of MODEL 11
1 H1 GLU 1 HT1 GLU 1 9.053 -17.465 12.853
2 H2 GLU 1 HT2 GLU 1 9.106 -18.782 11.782
3 H3 GLU 1 HT3 GLU 1 10.544 -18.002 12.241
4 HA GLU 1 HA GLU 1 8.888 -19.903 13.691
5 HB2 GLU 1 HB2 GLU 1 11.914 -19.352 13.375
6 HB3 GLU 1 HB1 GLU 1 11.301 -20.507 14.618
7 HG2 GLU 1 HG2 GLU 1 10.217 -21.908 12.816
8 HG3 GLU 1 HG1 GLU 1 10.815 -20.758 11.556
9 H MET 2 HN MET 2 7.997 -19.432 15.667
10 HA MET 2 HA MET 2 9.504 -17.714 17.513
11 HB2 MET 2 HB2 MET 2 6.814 -17.075 16.319
12 HB3 MET 2 HB1 MET 2 6.851 -17.120 18.125
13 HG2 MET 2 HG2 MET 2 8.441 -15.379 18.263
14 HG3 MET 2 HG1 MET 2 8.882 -15.466 16.526
15 HE1 MET 2 HE1 MET 2 8.762 -12.931 16.273
16 HE2 MET 2 HE2 MET 2 8.380 -12.794 18.024
17 HE3 MET 2 HE3 MET 2 7.401 -11.889 16.818
18 H ALA 3 HN ALA 3 9.386 -18.352 19.551
19 HA ALA 3 HA ALA 3 7.579 -20.483 20.090
20 HB1 ALA 3 HB1 ALA 3 9.656 -19.675 22.023
21 HB2 ALA 3 HB2 ALA 3 10.100 -20.702 20.605
22 HB3 ALA 3 HB3 ALA 3 8.874 -21.289 21.810
23 H LEU 4 HN LEU 4 7.333 -17.402 20.255
24 HA LEU 4 HA LEU 4 6.242 -17.455 22.901
25 HB2 LEU 4 HB2 LEU 4 5.256 -15.363 21.209
26 HB3 LEU 4 HB1 LEU 4 6.002 -15.226 22.830
27 HG LEU 4 HG LEU 4 7.472 -15.588 20.219
28 HD11 LEU 4 HD11 LEU 4 6.625 -13.021 21.652
29 HD12 LEU 4 HD12 LEU 4 6.168 -13.633 20.010
30 HD13 LEU 4 HD13 LEU 4 7.871 -13.074 20.329
31 HD21 LEU 4 HD21 LEU 4 9.390 -14.461 21.784
32 HD22 LEU 4 HD22 LEU 4 9.048 -16.246 21.803
33 HD23 LEU 4 HD23 LEU 4 8.372 -15.179 23.104
34 H SER 5 HN SER 5 5.665 -18.173 19.754
35 HA SER 5 HA SER 5 3.161 -17.181 19.517
36 HB2 SER 5 HB2 SER 5 4.643 -17.695 17.702
37 HB3 SER 5 HB1 SER 5 4.586 -19.450 18.113
38 HG SER 5 HG SER 5 3.213 -18.896 16.360
39 H LYS 6 HN LYS 6 4.472 -19.689 21.320
40 HA LYS 6 HA LYS 6 2.133 -21.424 21.511
41 HB2 LYS 6 HB2 LYS 6 4.993 -21.181 22.558
42 HB3 LYS 6 HB1 LYS 6 3.845 -22.242 23.465
43 HG2 LYS 6 HG2 LYS 6 4.638 -23.877 22.092
44 HG3 LYS 6 HG1 LYS 6 3.478 -23.202 20.907
45 HD2 LYS 6 HD2 LYS 6 5.294 -21.783 19.909
46 HD3 LYS 6 HD1 LYS 6 6.460 -22.421 21.122
47 HE2 LYS 6 HE2 LYS 6 6.112 -24.783 20.190
48 HE3 LYS 6 HE1 LYS 6 5.011 -24.092 18.929
49 HZ1 LYS 6 HZ1 LYS 6 7.819 -23.196 19.310
50 HZ2 LYS 6 HZ2 LYS 6 6.784 -22.911 17.993
51 HZ3 LYS 6 HZ3 LYS 6 7.374 -24.477 18.286
52 H PHE 7 HN PHE 7 4.130 -19.028 23.029
53 HA PHE 7 HA PHE 7 2.774 -19.046 25.486
54 HB2 PHE 7 HB2 PHE 7 4.531 -16.947 24.265
55 HB3 PHE 7 HB1 PHE 7 3.903 -16.877 25.951
56 HD1 PHE 7 HD1 PHE 7 6.758 -16.692 25.088
57 HD2 PHE 7 HD2 PHE 7 4.463 -20.079 26.331
58 HE1 PHE 7 HE1 PHE 7 8.735 -17.825 25.784
59 HE2 PHE 7 HE2 PHE 7 6.450 -21.158 26.995
60 HZ PHE 7 HZ PHE 7 8.647 -20.076 26.767
61 H PHE 8 HN PHE 8 2.411 -17.506 22.403
62 HA PHE 8 HA PHE 8 0.589 -15.615 23.094
63 HB2 PHE 8 HB2 PHE 8 1.456 -16.852 20.576
64 HB3 PHE 8 HB1 PHE 8 -0.224 -16.170 20.480
65 HD1 PHE 8 HD1 PHE 8 3.138 -15.285 20.130
66 HD2 PHE 8 HD2 PHE 8 -0.416 -14.196 21.927
67 HE1 PHE 8 HE1 PHE 8 4.106 -13.339 20.868
68 HE2 PHE 8 HE2 PHE 8 0.309 -12.226 22.666
69 HZ PHE 8 HZ PHE 8 2.683 -11.706 22.105
70 H ARG 9 HN ARG 9 -0.104 -18.886 22.411
71 HA ARG 9 HA ARG 9 -2.769 -18.306 22.347
72 HB2 ARG 9 HB2 ARG 9 -0.942 -20.598 22.277
73 HB3 ARG 9 HB1 ARG 9 -2.357 -21.016 23.290
74 HG2 ARG 9 HG2 ARG 9 -3.285 -21.707 21.335
75 HG3 ARG 9 HG1 ARG 9 -3.635 -19.974 21.070
76 HD2 ARG 9 HD2 ARG 9 -1.870 -19.699 19.483
77 HD3 ARG 9 HD1 ARG 9 -0.968 -21.180 20.067
78 HE ARG 9 HE ARG 9 -3.487 -22.119 19.260
79 HH11 ARG 9 HH11 ARG 9 -0.786 -20.371 17.613
80 HH12 ARG 9 HH12 ARG 9 -1.115 -21.061 16.059
81 HH21 ARG 9 HH21 ARG 9 -3.882 -23.017 17.127
82 HH22 ARG 9 HH22 ARG 9 -2.886 -22.571 15.782
83 H ASP 10 HN ASP 10 -0.529 -18.070 24.963
84 HA ASP 10 HA ASP 10 -2.686 -18.867 26.712
85 HB2 ASP 10 HB2 ASP 10 0.235 -18.368 27.509
86 HB3 ASP 10 HB1 ASP 10 -1.068 -18.820 28.663
87 H PHE 11 HN PHE 11 -1.016 -15.856 25.708
88 HA PHE 11 HA PHE 11 -1.942 -14.659 28.171
89 HB2 PHE 11 HB2 PHE 11 -1.181 -12.891 25.851
90 HB3 PHE 11 HB1 PHE 11 -0.940 -12.591 27.625
91 HD1 PHE 11 HD1 PHE 11 0.070 -13.978 24.597
92 HD2 PHE 11 HD2 PHE 11 1.192 -13.508 28.639
93 HE1 PHE 11 HE1 PHE 11 2.178 -14.549 24.012
94 HE2 PHE 11 HE2 PHE 11 3.480 -14.073 28.027
95 HZ PHE 11 HZ PHE 11 4.057 -14.536 25.683
96 H ILE 12 HN ILE 12 -2.453 -14.140 24.675
97 HA ILE 12 HA ILE 12 -4.298 -12.032 25.094
98 HB ILE 12 HB ILE 12 -4.584 -13.414 22.563
99 HG12 ILE 12 HG12 ILE 12 -2.040 -11.921 22.503
100 HG13 ILE 12 HG11 ILE 12 -1.940 -13.425 23.509
101 HG21 ILE 12 HG21 ILE 12 -4.348 -11.078 21.655
102 HG22 ILE 12 HG22 ILE 12 -3.999 -10.476 23.321
103 HG23 ILE 12 HG23 ILE 12 -5.612 -11.196 22.936
104 HD11 ILE 12 HD11 ILE 12 -2.116 -14.744 21.856
105 HD12 ILE 12 HD12 ILE 12 -1.878 -13.329 20.740
106 HD13 ILE 12 HD13 ILE 12 -3.553 -13.925 21.140
107 H LEU 13 HN LEU 13 -4.582 -15.461 24.894
108 HA LEU 13 HA LEU 13 -7.227 -15.333 24.081
109 HB2 LEU 13 HB2 LEU 13 -5.262 -17.489 24.738
110 HB3 LEU 13 HB1 LEU 13 -6.977 -17.903 24.332
111 HG LEU 13 HG LEU 13 -6.562 -16.304 22.282
112 HD11 LEU 13 HD11 LEU 13 -3.835 -16.358 23.351
113 HD12 LEU 13 HD12 LEU 13 -4.691 -15.252 22.242
114 HD13 LEU 13 HD13 LEU 13 -3.940 -16.727 21.575
115 HD21 LEU 13 HD21 LEU 13 -5.698 -18.212 20.846
116 HD22 LEU 13 HD22 LEU 13 -7.018 -18.717 21.968
117 HD23 LEU 13 HD23 LEU 13 -5.301 -19.115 22.359
118 H GLN 14 HN GLN 14 -5.611 -15.306 27.084
119 HA GLN 14 HA GLN 14 -8.021 -16.028 28.613
120 HB2 GLN 14 HB2 GLN 14 -5.294 -14.854 29.501
121 HB3 GLN 14 HB1 GLN 14 -6.665 -15.173 30.642
122 HG2 GLN 14 HG2 GLN 14 -6.590 -17.652 29.881
123 HG3 GLN 14 HG1 GLN 14 -5.079 -17.245 28.978
124 HE21 GLN 14 HE21 GLN 14 -3.201 -17.701 30.152
125 HE22 GLN 14 HE22 GLN 14 -3.041 -17.629 31.875
126 H ARG 15 HN ARG 15 -7.132 -13.465 26.662
127 HA ARG 15 HA ARG 15 -8.338 -11.412 28.294
128 HB2 ARG 15 HB2 ARG 15 -6.868 -11.307 25.632
129 HB3 ARG 15 HB1 ARG 15 -7.426 -9.861 26.581
130 HG2 ARG 15 HG2 ARG 15 -5.880 -11.747 28.231
131 HG3 ARG 15 HG1 ARG 15 -4.975 -11.268 26.779
132 HD2 ARG 15 HD2 ARG 15 -5.048 -8.939 27.301
133 HD3 ARG 15 HD1 ARG 15 -6.349 -9.186 28.582
134 HE ARG 15 HE ARG 15 -4.025 -10.729 29.332
135 HH11 ARG 15 HH11 ARG 15 -4.932 -7.249 28.957
136 HH12 ARG 15 HH12 ARG 15 -3.818 -6.694 30.162
137 HH21 ARG 15 HH21 ARG 15 -2.539 -9.915 30.955
138 HH22 ARG 15 HH22 ARG 15 -2.451 -8.220 31.303
139 H LYS 16 HN LYS 16 -9.305 -13.677 26.212
140 HA LYS 16 HA LYS 16 -11.132 -12.223 24.561
141 HB2 LYS 16 HB2 LYS 16 -11.108 -15.108 25.606
142 HB3 LYS 16 HB1 LYS 16 -12.287 -14.522 24.364
143 HG2 LYS 16 HG2 LYS 16 -10.514 -14.098 22.746
144 HG3 LYS 16 HG1 LYS 16 -9.237 -14.313 23.980
145 HD2 LYS 16 HD2 LYS 16 -9.145 -16.293 22.747
146 HD3 LYS 16 HD1 LYS 16 -10.033 -16.728 24.240
147 HE2 LYS 16 HE2 LYS 16 -12.231 -16.687 23.004
148 HE3 LYS 16 HE1 LYS 16 -11.395 -16.131 21.498
149 HZ1 LYS 16 HZ1 LYS 16 -10.122 -18.213 21.566
150 HZ2 LYS 16 HZ2 LYS 16 -11.796 -18.457 21.415
151 HZ3 LYS 16 HZ3 LYS 16 -11.029 -18.729 22.906
152 H LYS 17 HN LYS 17 -11.195 -13.841 27.652
153 HA LYS 17 HA LYS 17 -12.570 -13.946 29.382
154 HB2 LYS 17 HB2 LYS 17 -12.862 -10.959 28.681
155 HB3 LYS 17 HB1 LYS 17 -13.240 -11.666 30.296
156 HG2 LYS 17 HG2 LYS 17 -10.970 -12.065 30.810
157 HG3 LYS 17 HG1 LYS 17 -10.469 -12.168 29.090
158 HD2 LYS 17 HD2 LYS 17 -9.528 -10.117 29.917
159 HD3 LYS 17 HD1 LYS 17 -10.921 -9.643 28.885
160 HE2 LYS 17 HE2 LYS 17 -12.330 -9.218 30.944
161 HE3 LYS 17 HE1 LYS 17 -10.968 -9.771 32.002
162 HZ1 LYS 17 HZ1 LYS 17 -10.768 -7.502 30.086
163 HZ2 LYS 17 HZ2 LYS 17 -9.679 -7.940 31.313
164 HZ3 LYS 17 HZ3 LYS 17 -11.213 -7.337 31.717
Start of MODEL 12
1 H1 GLU 1 HT1 GLU 1 10.624 -18.063 12.107
2 H2 GLU 1 HT2 GLU 1 9.280 -17.338 12.851
3 H3 GLU 1 HT3 GLU 1 9.062 -18.650 11.794
4 HA GLU 1 HA GLU 1 8.959 -19.851 13.624
5 HB2 GLU 1 HB2 GLU 1 11.983 -19.299 13.315
6 HB3 GLU 1 HB1 GLU 1 11.381 -20.432 14.582
7 HG2 GLU 1 HG2 GLU 1 10.292 -21.870 12.814
8 HG3 GLU 1 HG1 GLU 1 10.882 -20.743 11.530
9 H MET 2 HN MET 2 8.042 -19.393 15.591
10 HA MET 2 HA MET 2 9.534 -17.698 17.472
11 HB2 MET 2 HB2 MET 2 6.854 -17.043 16.264
12 HB3 MET 2 HB1 MET 2 6.877 -17.112 18.070
13 HG2 MET 2 HG2 MET 2 8.464 -15.372 18.245
14 HG3 MET 2 HG1 MET 2 8.929 -15.440 16.514
15 HE1 MET 2 HE1 MET 2 7.455 -11.864 16.832
16 HE2 MET 2 HE2 MET 2 8.818 -12.901 16.289
17 HE3 MET 2 HE3 MET 2 8.416 -12.788 18.038
18 H ALA 3 HN ALA 3 9.418 -18.381 19.493
19 HA ALA 3 HA ALA 3 7.592 -20.505 19.996
20 HB1 ALA 3 HB1 ALA 3 8.885 -21.353 21.700
21 HB2 ALA 3 HB2 ALA 3 9.680 -19.743 21.938
22 HB3 ALA 3 HB3 ALA 3 10.111 -20.760 20.507
23 H LEU 4 HN LEU 4 7.375 -17.425 20.216
24 HA LEU 4 HA LEU 4 6.294 -17.511 22.861
25 HB2 LEU 4 HB2 LEU 4 5.322 -15.386 21.202
26 HB3 LEU 4 HB1 LEU 4 6.068 -15.279 22.825
27 HG LEU 4 HG LEU 4 7.534 -15.613 20.208
28 HD11 LEU 4 HD11 LEU 4 6.729 -13.057 21.686
29 HD12 LEU 4 HD12 LEU 4 6.235 -13.642 20.044
30 HD13 LEU 4 HD13 LEU 4 7.951 -13.111 20.342
31 HD21 LEU 4 HD21 LEU 4 9.108 -16.308 21.774
32 HD22 LEU 4 HD22 LEU 4 8.439 -15.265 23.098
33 HD23 LEU 4 HD23 LEU 4 9.460 -14.525 21.795
34 H SER 5 HN SER 5 5.697 -18.174 19.706
35 HA SER 5 HA SER 5 3.201 -17.157 19.494
36 HB2 SER 5 HB2 SER 5 4.666 -17.655 17.665
37 HB3 SER 5 HB1 SER 5 4.601 -19.416 18.053
38 HG SER 5 HG SER 5 3.194 -18.424 16.292
39 H LYS 6 HN LYS 6 4.494 -19.704 21.253
40 HA LYS 6 HA LYS 6 2.137 -21.416 21.426
41 HB2 LYS 6 HB2 LYS 6 5.003 -21.221 22.466
42 HB3 LYS 6 HB1 LYS 6 3.847 -22.288 23.358
43 HG2 LYS 6 HG2 LYS 6 4.598 -23.909 21.949
44 HG3 LYS 6 HG1 LYS 6 3.467 -23.180 20.767
45 HD2 LYS 6 HD2 LYS 6 5.326 -21.777 19.825
46 HD3 LYS 6 HD1 LYS 6 6.465 -22.473 21.034
47 HE2 LYS 6 HE2 LYS 6 6.056 -24.806 20.039
48 HE3 LYS 6 HE1 LYS 6 5.007 -24.044 18.774
49 HZ1 LYS 6 HZ1 LYS 6 7.406 -24.499 18.219
50 HZ2 LYS 6 HZ2 LYS 6 7.814 -23.197 19.232
51 HZ3 LYS 6 HZ3 LYS 6 6.823 -22.941 17.876
52 H PHE 7 HN PHE 7 4.169 -19.069 22.977
53 HA PHE 7 HA PHE 7 2.829 -19.117 25.442
54 HB2 PHE 7 HB2 PHE 7 4.598 -17.015 24.245
55 HB3 PHE 7 HB1 PHE 7 3.985 -16.969 25.938
56 HD1 PHE 7 HD1 PHE 7 6.834 -16.795 25.058
57 HD2 PHE 7 HD2 PHE 7 4.517 -20.186 26.250
58 HE1 PHE 7 HE1 PHE 7 8.806 -17.960 25.718
59 HE2 PHE 7 HE2 PHE 7 6.499 -21.295 26.877
60 HZ PHE 7 HZ PHE 7 8.703 -20.229 26.655
61 H PHE 8 HN PHE 8 2.460 -17.520 22.391
62 HA PHE 8 HA PHE 8 0.664 -15.619 23.122
63 HB2 PHE 8 HB2 PHE 8 1.502 -16.835 20.582
64 HB3 PHE 8 HB1 PHE 8 -0.171 -16.137 20.505
65 HD1 PHE 8 HD1 PHE 8 3.195 -15.279 20.142
66 HD2 PHE 8 HD2 PHE 8 -0.336 -14.180 21.974
67 HE1 PHE 8 HE1 PHE 8 4.186 -13.349 20.895
68 HE2 PHE 8 HE2 PHE 8 0.412 -12.226 22.730
69 HZ PHE 8 HZ PHE 8 2.787 -11.719 22.161
70 H ARG 9 HN ARG 9 -0.068 -18.873 22.396
71 HA ARG 9 HA ARG 9 -2.724 -18.274 22.354
72 HB2 ARG 9 HB2 ARG 9 -0.918 -20.568 22.230
73 HB3 ARG 9 HB1 ARG 9 -2.288 -20.996 23.298
74 HG2 ARG 9 HG2 ARG 9 -3.335 -21.660 21.403
75 HG3 ARG 9 HG1 ARG 9 -3.628 -19.922 21.103
76 HD2 ARG 9 HD2 ARG 9 -1.937 -19.757 19.442
77 HD3 ARG 9 HD1 ARG 9 -1.023 -21.214 20.061
78 HE ARG 9 HE ARG 9 -3.568 -22.178 19.372
79 HH11 ARG 9 HH11 ARG 9 -0.914 -20.512 17.572
80 HH12 ARG 9 HH12 ARG 9 -1.289 -21.268 16.059
81 HH21 ARG 9 HH21 ARG 9 -4.025 -23.171 17.294
82 HH22 ARG 9 HH22 ARG 9 -3.068 -22.788 15.902
83 H ASP 10 HN ASP 10 -0.468 -18.083 24.972
84 HA ASP 10 HA ASP 10 -2.636 -18.866 26.712
85 HB2 ASP 10 HB2 ASP 10 0.291 -18.436 27.519
86 HB3 ASP 10 HB1 ASP 10 -1.023 -18.859 28.672
87 H PHE 11 HN PHE 11 -0.921 -15.866 25.756
88 HA PHE 11 HA PHE 11 -1.818 -14.691 28.242
89 HB2 PHE 11 HB2 PHE 11 -1.047 -12.907 25.936
90 HB3 PHE 11 HB1 PHE 11 -0.784 -12.633 27.712
91 HD1 PHE 11 HD1 PHE 11 0.175 -13.985 24.652
92 HD2 PHE 11 HD2 PHE 11 1.340 -13.611 28.693
93 HE1 PHE 11 HE1 PHE 11 2.269 -14.580 24.039
94 HE2 PHE 11 HE2 PHE 11 3.612 -14.203 28.049
95 HZ PHE 11 HZ PHE 11 4.160 -14.629 25.690
96 H ILE 12 HN ILE 12 -2.364 -14.158 24.754
97 HA ILE 12 HA ILE 12 -4.181 -12.033 25.229
98 HB ILE 12 HB ILE 12 -4.489 -13.350 22.671
99 HG12 ILE 12 HG12 ILE 12 -1.925 -11.890 22.632
100 HG13 ILE 12 HG11 ILE 12 -1.840 -13.420 23.603
101 HG21 ILE 12 HG21 ILE 12 -3.854 -10.438 23.490
102 HG22 ILE 12 HG22 ILE 12 -5.481 -11.125 23.107
103 HG23 ILE 12 HG23 ILE 12 -4.231 -11.000 21.816
104 HD11 ILE 12 HD11 ILE 12 -2.044 -14.697 21.920
105 HD12 ILE 12 HD12 ILE 12 -1.790 -13.259 20.837
106 HD13 ILE 12 HD13 ILE 12 -3.472 -13.839 21.230
107 H LEU 13 HN LEU 13 -4.479 -15.462 24.962
108 HA LEU 13 HA LEU 13 -7.136 -15.288 24.160
109 HB2 LEU 13 HB2 LEU 13 -5.204 -17.498 24.726
110 HB3 LEU 13 HB1 LEU 13 -6.928 -17.863 24.321
111 HG LEU 13 HG LEU 13 -6.504 -16.197 22.331
112 HD11 LEU 13 HD11 LEU 13 -3.773 -16.337 23.372
113 HD12 LEU 13 HD12 LEU 13 -4.613 -15.187 22.296
114 HD13 LEU 13 HD13 LEU 13 -3.889 -16.657 21.586
115 HD21 LEU 13 HD21 LEU 13 -5.674 -18.074 20.818
116 HD22 LEU 13 HD22 LEU 13 -7.019 -18.574 21.913
117 HD23 LEU 13 HD23 LEU 13 -5.320 -19.042 22.302
118 H GLN 14 HN GLN 14 -5.516 -15.353 27.157
119 HA GLN 14 HA GLN 14 -7.879 -16.169 28.691
120 HB2 GLN 14 HB2 GLN 14 -5.219 -14.826 29.539
121 HB3 GLN 14 HB1 GLN 14 -6.570 -15.157 30.703
122 HG2 GLN 14 HG2 GLN 14 -6.402 -17.651 30.063
123 HG3 GLN 14 HG1 GLN 14 -4.944 -17.235 29.083
124 HE21 GLN 14 HE21 GLN 14 -3.071 -17.779 30.227
125 HE22 GLN 14 HE22 GLN 14 -2.820 -17.547 31.924
126 H ARG 15 HN ARG 15 -7.124 -13.573 26.736
127 HA ARG 15 HA ARG 15 -8.558 -11.614 28.280
128 HB2 ARG 15 HB2 ARG 15 -7.085 -11.374 25.640
129 HB3 ARG 15 HB1 ARG 15 -7.761 -10.001 26.630
130 HG2 ARG 15 HG2 ARG 15 -6.204 -11.537 28.439
131 HG3 ARG 15 HG1 ARG 15 -5.270 -11.537 26.919
132 HD2 ARG 15 HD2 ARG 15 -5.218 -9.076 26.841
133 HD3 ARG 15 HD1 ARG 15 -6.389 -8.984 28.259
134 HE ARG 15 HE ARG 15 -4.011 -10.493 29.017
135 HH11 ARG 15 HH11 ARG 15 -5.041 -7.099 28.315
136 HH12 ARG 15 HH12 ARG 15 -3.842 -6.387 29.341
137 HH21 ARG 15 HH21 ARG 15 -2.410 -9.465 30.392
138 HH22 ARG 15 HH22 ARG 15 -2.339 -7.739 30.527
139 H LYS 16 HN LYS 16 -9.443 -14.062 26.653
140 HA LYS 16 HA LYS 16 -11.506 -12.753 25.041
141 HB2 LYS 16 HB2 LYS 16 -10.784 -15.673 25.592
142 HB3 LYS 16 HB1 LYS 16 -12.174 -15.174 24.553
143 HG2 LYS 16 HG2 LYS 16 -10.713 -14.106 22.931
144 HG3 LYS 16 HG1 LYS 16 -9.284 -14.235 24.004
145 HD2 LYS 16 HD2 LYS 16 -8.954 -15.910 22.397
146 HD3 LYS 16 HD1 LYS 16 -9.500 -16.761 23.874
147 HE2 LYS 16 HE2 LYS 16 -11.805 -17.070 22.896
148 HE3 LYS 16 HE1 LYS 16 -11.343 -16.094 21.441
149 HZ1 LYS 16 HZ1 LYS 16 -10.496 -18.803 22.245
150 HZ2 LYS 16 HZ2 LYS 16 -9.499 -17.868 21.238
151 HZ3 LYS 16 HZ3 LYS 16 -11.086 -18.237 20.757
152 H LYS 17 HN LYS 17 -12.109 -11.690 26.856
153 HA LYS 17 HA LYS 17 -13.683 -13.157 28.867
154 HB2 LYS 17 HB2 LYS 17 -12.469 -10.312 28.904
155 HB3 LYS 17 HB1 LYS 17 -13.307 -11.120 30.283
156 HG2 LYS 17 HG2 LYS 17 -11.483 -12.614 30.692
157 HG3 LYS 17 HG1 LYS 17 -10.792 -12.450 29.038
158 HD2 LYS 17 HD2 LYS 17 -9.310 -11.257 30.499
159 HD3 LYS 17 HD1 LYS 17 -10.220 -10.010 29.592
160 HE2 LYS 17 HE2 LYS 17 -11.678 -9.573 31.622
161 HE3 LYS 17 HE1 LYS 17 -10.834 -10.896 32.525
162 HZ1 LYS 17 HZ1 LYS 17 -9.116 -9.581 32.931
163 HZ2 LYS 17 HZ2 LYS 17 -10.166 -8.301 32.551
164 HZ3 LYS 17 HZ3 LYS 17 -9.088 -8.892 31.379
Start of MODEL 13
1 H1 GLU 1 HT1 GLU 1 10.216 -18.649 11.679
2 H2 GLU 1 HT2 GLU 1 10.281 -17.390 12.818
3 H3 GLU 1 HT3 GLU 1 8.783 -17.902 12.203
4 HA GLU 1 HA GLU 1 8.647 -19.669 13.502
5 HB2 GLU 1 HB2 GLU 1 10.844 -20.575 12.393
6 HB3 GLU 1 HB1 GLU 1 11.730 -19.837 13.775
7 HG2 GLU 1 HG2 GLU 1 10.460 -21.316 15.391
8 HG3 GLU 1 HG1 GLU 1 9.525 -22.028 14.019
9 H MET 2 HN MET 2 7.856 -19.229 15.535
10 HA MET 2 HA MET 2 9.580 -17.772 17.437
11 HB2 MET 2 HB2 MET 2 6.918 -16.884 16.353
12 HB3 MET 2 HB1 MET 2 6.972 -17.052 18.149
13 HG2 MET 2 HG2 MET 2 7.448 -14.777 17.673
14 HG3 MET 2 HG1 MET 2 8.996 -15.522 18.171
15 HE1 MET 2 HE1 MET 2 8.673 -12.693 16.830
16 HE2 MET 2 HE2 MET 2 10.070 -12.685 15.701
17 HE3 MET 2 HE3 MET 2 10.241 -13.415 17.335
18 H ALA 3 HN ALA 3 9.428 -18.462 19.476
19 HA ALA 3 HA ALA 3 7.536 -20.537 19.943
20 HB1 ALA 3 HB1 ALA 3 8.810 -21.465 21.615
21 HB2 ALA 3 HB2 ALA 3 9.643 -19.883 21.903
22 HB3 ALA 3 HB3 ALA 3 10.054 -20.867 20.443
23 H LEU 4 HN LEU 4 7.383 -17.464 20.222
24 HA LEU 4 HA LEU 4 6.321 -17.571 22.880
25 HB2 LEU 4 HB2 LEU 4 5.373 -15.401 21.269
26 HB3 LEU 4 HB1 LEU 4 6.155 -15.334 22.876
27 HG LEU 4 HG LEU 4 7.568 -15.664 20.228
28 HD11 LEU 4 HD11 LEU 4 6.307 -13.673 20.092
29 HD12 LEU 4 HD12 LEU 4 8.033 -13.168 20.383
30 HD13 LEU 4 HD13 LEU 4 6.821 -13.109 21.734
31 HD21 LEU 4 HD21 LEU 4 9.154 -16.400 21.765
32 HD22 LEU 4 HD22 LEU 4 8.526 -15.353 23.107
33 HD23 LEU 4 HD23 LEU 4 9.539 -14.624 21.790
34 H SER 5 HN SER 5 5.682 -18.178 19.718
35 HA SER 5 HA SER 5 3.204 -17.113 19.545
36 HB2 SER 5 HB2 SER 5 4.654 -17.634 17.699
37 HB3 SER 5 HB1 SER 5 4.522 -19.396 18.062
38 HG SER 5 HG SER 5 3.125 -18.235 16.344
39 H LYS 6 HN LYS 6 4.464 -19.703 21.263
40 HA LYS 6 HA LYS 6 2.071 -21.379 21.452
41 HB2 LYS 6 HB2 LYS 6 4.961 -21.245 22.450
42 HB3 LYS 6 HB1 LYS 6 3.799 -22.309 23.337
43 HG2 LYS 6 HG2 LYS 6 4.521 -23.912 21.889
44 HG3 LYS 6 HG1 LYS 6 3.366 -23.159 20.748
45 HD2 LYS 6 HD2 LYS 6 5.216 -21.750 19.784
46 HD3 LYS 6 HD1 LYS 6 6.377 -22.486 20.946
47 HE2 LYS 6 HE2 LYS 6 5.912 -24.792 19.914
48 HE3 LYS 6 HE1 LYS 6 4.837 -23.991 18.697
49 HZ1 LYS 6 HZ1 LYS 6 6.601 -23.042 17.666
50 HZ2 LYS 6 HZ2 LYS 6 7.323 -24.480 18.212
51 HZ3 LYS 6 HZ3 LYS 6 7.595 -23.024 19.042
52 H PHE 7 HN PHE 7 4.171 -19.072 22.992
53 HA PHE 7 HA PHE 7 2.858 -19.126 25.477
54 HB2 PHE 7 HB2 PHE 7 4.648 -17.039 24.279
55 HB3 PHE 7 HB1 PHE 7 4.049 -16.997 25.977
56 HD1 PHE 7 HD1 PHE 7 6.894 -16.862 25.077
57 HD2 PHE 7 HD2 PHE 7 4.532 -20.223 26.261
58 HE1 PHE 7 HE1 PHE 7 8.851 -18.063 25.709
59 HE2 PHE 7 HE2 PHE 7 6.500 -21.370 26.863
60 HZ PHE 7 HZ PHE 7 8.721 -20.339 26.630
61 H PHE 8 HN PHE 8 2.494 -17.482 22.447
62 HA PHE 8 HA PHE 8 0.728 -15.564 23.210
63 HB2 PHE 8 HB2 PHE 8 1.531 -16.769 20.654
64 HB3 PHE 8 HB1 PHE 8 -0.129 -16.039 20.594
65 HD1 PHE 8 HD1 PHE 8 3.248 -15.234 20.213
66 HD2 PHE 8 HD2 PHE 8 -0.249 -14.103 22.091
67 HE1 PHE 8 HE1 PHE 8 4.276 -13.332 20.983
68 HE2 PHE 8 HE2 PHE 8 0.526 -12.176 22.866
69 HZ PHE 8 HZ PHE 8 2.914 -11.694 22.283
70 H ARG 9 HN ARG 9 -0.012 -18.778 22.454
71 HA ARG 9 HA ARG 9 -2.669 -18.193 22.396
72 HB2 ARG 9 HB2 ARG 9 -0.937 -20.586 22.637
73 HB3 ARG 9 HB1 ARG 9 -2.701 -20.803 22.932
74 HG2 ARG 9 HG2 ARG 9 -3.083 -19.693 20.641
75 HG3 ARG 9 HG1 ARG 9 -1.293 -19.792 20.393
76 HD2 ARG 9 HD2 ARG 9 -1.342 -22.237 20.646
77 HD3 ARG 9 HD1 ARG 9 -3.126 -22.164 21.041
78 HE ARG 9 HE ARG 9 -2.649 -20.841 18.547
79 HH11 ARG 9 HH11 ARG 9 -2.707 -24.185 19.899
80 HH12 ARG 9 HH12 ARG 9 -3.145 -24.929 18.398
81 HH21 ARG 9 HH21 ARG 9 -3.248 -21.907 16.531
82 HH22 ARG 9 HH22 ARG 9 -3.453 -23.626 16.473
83 H ASP 10 HN ASP 10 -0.429 -18.055 25.029
84 HA ASP 10 HA ASP 10 -2.620 -18.858 26.728
85 HB2 ASP 10 HB2 ASP 10 0.300 -18.449 27.577
86 HB3 ASP 10 HB1 ASP 10 -1.029 -18.876 28.713
87 H PHE 11 HN PHE 11 -0.885 -15.852 25.829
88 HA PHE 11 HA PHE 11 -1.814 -14.699 28.314
89 HB2 PHE 11 HB2 PHE 11 -0.996 -12.890 26.045
90 HB3 PHE 11 HB1 PHE 11 -0.749 -12.647 27.828
91 HD1 PHE 11 HD1 PHE 11 0.238 -13.935 24.754
92 HD2 PHE 11 HD2 PHE 11 1.345 -13.695 28.822
93 HE1 PHE 11 HE1 PHE 11 2.333 -14.550 24.157
94 HE2 PHE 11 HE2 PHE 11 3.616 -14.308 28.196
95 HZ PHE 11 HZ PHE 11 4.194 -14.676 25.837
96 H ILE 12 HN ILE 12 -2.307 -14.114 24.828
97 HA ILE 12 HA ILE 12 -4.133 -12.000 25.310
98 HB ILE 12 HB ILE 12 -4.398 -13.264 22.723
99 HG12 ILE 12 HG12 ILE 12 -1.827 -11.813 22.753
100 HG13 ILE 12 HG11 ILE 12 -1.763 -13.362 23.694
101 HG21 ILE 12 HG21 ILE 12 -4.119 -10.898 21.918
102 HG22 ILE 12 HG22 ILE 12 -3.765 -10.370 23.608
103 HG23 ILE 12 HG23 ILE 12 -5.389 -11.043 23.190
104 HD11 ILE 12 HD11 ILE 12 -1.666 -13.160 20.935
105 HD12 ILE 12 HD12 ILE 12 -3.366 -13.720 21.286
106 HD13 ILE 12 HD13 ILE 12 -1.957 -14.609 21.982
107 H LEU 13 HN LEU 13 -4.422 -15.420 24.978
108 HA LEU 13 HA LEU 13 -7.063 -15.245 24.122
109 HB2 LEU 13 HB2 LEU 13 -5.121 -17.447 24.688
110 HB3 LEU 13 HB1 LEU 13 -6.834 -17.826 24.255
111 HG LEU 13 HG LEU 13 -6.409 -16.150 22.286
112 HD11 LEU 13 HD11 LEU 13 -4.554 -15.089 22.276
113 HD12 LEU 13 HD12 LEU 13 -3.772 -16.538 21.580
114 HD13 LEU 13 HD13 LEU 13 -3.698 -16.214 23.369
115 HD21 LEU 13 HD21 LEU 13 -5.577 -17.970 20.754
116 HD22 LEU 13 HD22 LEU 13 -6.823 -18.589 21.904
117 HD23 LEU 13 HD23 LEU 13 -5.075 -18.933 22.199
118 H GLN 14 HN GLN 14 -5.500 -15.350 27.149
119 HA GLN 14 HA GLN 14 -7.884 -16.211 28.623
120 HB2 GLN 14 HB2 GLN 14 -5.250 -14.865 29.540
121 HB3 GLN 14 HB1 GLN 14 -6.621 -15.212 30.675
122 HG2 GLN 14 HG2 GLN 14 -6.436 -17.700 29.996
123 HG3 GLN 14 HG1 GLN 14 -4.949 -17.262 29.068
124 HE21 GLN 14 HE21 GLN 14 -3.093 -17.771 30.259
125 HE22 GLN 14 HE22 GLN 14 -2.907 -17.581 31.970
126 H ARG 15 HN ARG 15 -7.120 -13.577 26.725
127 HA ARG 15 HA ARG 15 -8.604 -11.657 28.272
128 HB2 ARG 15 HB2 ARG 15 -7.089 -11.361 25.663
129 HB3 ARG 15 HB1 ARG 15 -7.794 -10.011 26.664
130 HG2 ARG 15 HG2 ARG 15 -6.259 -11.542 28.484
131 HG3 ARG 15 HG1 ARG 15 -5.300 -11.551 26.979
132 HD2 ARG 15 HD2 ARG 15 -5.246 -9.086 26.895
133 HD3 ARG 15 HD1 ARG 15 -6.434 -8.993 28.298
134 HE ARG 15 HE ARG 15 -4.063 -10.502 29.082
135 HH11 ARG 15 HH11 ARG 15 -5.102 -7.109 28.385
136 HH12 ARG 15 HH12 ARG 15 -3.916 -6.395 29.426
137 HH21 ARG 15 HH21 ARG 15 -2.481 -9.472 30.476
138 HH22 ARG 15 HH22 ARG 15 -2.419 -7.748 30.620
139 H LYS 16 HN LYS 16 -9.433 -14.091 26.590
140 HA LYS 16 HA LYS 16 -11.477 -12.777 24.957
141 HB2 LYS 16 HB2 LYS 16 -10.747 -15.701 25.483
142 HB3 LYS 16 HB1 LYS 16 -12.117 -15.195 24.421
143 HG2 LYS 16 HG2 LYS 16 -10.628 -14.102 22.844
144 HG3 LYS 16 HG1 LYS 16 -9.223 -14.229 23.947
145 HD2 LYS 16 HD2 LYS 16 -8.839 -15.886 22.334
146 HD3 LYS 16 HD1 LYS 16 -9.416 -16.758 23.788
147 HE2 LYS 16 HE2 LYS 16 -11.693 -17.074 22.748
148 HE3 LYS 16 HE1 LYS 16 -11.202 -16.079 21.317
149 HZ1 LYS 16 HZ1 LYS 16 -11.063 -18.400 20.841
150 HZ2 LYS 16 HZ2 LYS 16 -10.040 -18.687 22.167
151 HZ3 LYS 16 HZ3 LYS 16 -9.494 -17.748 20.862
152 H LYS 17 HN LYS 17 -12.123 -11.746 26.776
153 HA LYS 17 HA LYS 17 -13.724 -13.255 28.736
154 HB2 LYS 17 HB2 LYS 17 -12.520 -10.405 28.837
155 HB3 LYS 17 HB1 LYS 17 -13.387 -11.233 30.187
156 HG2 LYS 17 HG2 LYS 17 -11.571 -12.741 30.605
157 HG3 LYS 17 HG1 LYS 17 -10.840 -12.532 28.975
158 HD2 LYS 17 HD2 LYS 17 -9.399 -11.368 30.495
159 HD3 LYS 17 HD1 LYS 17 -10.299 -10.100 29.604
160 HE2 LYS 17 HE2 LYS 17 -11.804 -9.731 31.611
161 HE3 LYS 17 HE1 LYS 17 -10.974 -11.076 32.497
162 HZ1 LYS 17 HZ1 LYS 17 -10.323 -8.507 32.671
163 HZ2 LYS 17 HZ2 LYS 17 -9.252 -8.983 31.441
164 HZ3 LYS 17 HZ3 LYS 17 -9.235 -9.783 32.938
Start of MODEL 14
1 H1 GLU 1 HT1 GLU 1 10.225 -17.273 12.698
2 H2 GLU 1 HT2 GLU 1 8.653 -17.826 12.370
3 H3 GLU 1 HT3 GLU 1 9.989 -18.576 11.635
4 HA GLU 1 HA GLU 1 8.903 -19.748 13.568
5 HB2 GLU 1 HB2 GLU 1 11.935 -19.136 13.440
6 HB3 GLU 1 HB1 GLU 1 11.265 -20.351 14.594
7 HG2 GLU 1 HG2 GLU 1 10.327 -21.694 12.670
8 HG3 GLU 1 HG1 GLU 1 10.982 -20.483 11.499
9 H MET 2 HN MET 2 7.904 -19.313 15.512
10 HA MET 2 HA MET 2 9.302 -17.569 17.430
11 HB2 MET 2 HB2 MET 2 6.590 -17.081 16.202
12 HB3 MET 2 HB1 MET 2 6.628 -17.110 18.010
13 HG2 MET 2 HG2 MET 2 8.123 -15.288 18.135
14 HG3 MET 2 HG1 MET 2 8.572 -15.354 16.403
15 HE1 MET 2 HE1 MET 2 5.846 -13.612 14.456
16 HE2 MET 2 HE2 MET 2 6.328 -15.341 14.554
17 HE3 MET 2 HE3 MET 2 7.581 -14.053 14.604
18 H ALA 3 HN ALA 3 9.274 -18.312 19.414
19 HA ALA 3 HA ALA 3 7.490 -20.468 19.956
20 HB1 ALA 3 HB1 ALA 3 9.584 -19.693 21.878
21 HB2 ALA 3 HB2 ALA 3 10.051 -20.639 20.411
22 HB3 ALA 3 HB3 ALA 3 8.850 -21.317 21.594
23 H LEU 4 HN LEU 4 7.238 -17.397 20.171
24 HA LEU 4 HA LEU 4 6.237 -17.469 22.850
25 HB2 LEU 4 HB2 LEU 4 5.201 -15.373 21.183
26 HB3 LEU 4 HB1 LEU 4 5.981 -15.239 22.788
27 HG LEU 4 HG LEU 4 7.403 -15.615 20.153
28 HD11 LEU 4 HD11 LEU 4 6.089 -13.663 19.954
29 HD12 LEU 4 HD12 LEU 4 7.806 -13.112 20.208
30 HD13 LEU 4 HD13 LEU 4 6.606 -13.023 21.567
31 HD21 LEU 4 HD21 LEU 4 9.335 -14.462 21.699
32 HD22 LEU 4 HD22 LEU 4 9.013 -16.250 21.700
33 HD23 LEU 4 HD23 LEU 4 8.342 -15.207 23.023
34 H SER 5 HN SER 5 5.552 -18.181 19.728
35 HA SER 5 HA SER 5 3.038 -17.216 19.581
36 HB2 SER 5 HB2 SER 5 4.460 -17.735 17.721
37 HB3 SER 5 HB1 SER 5 4.423 -19.486 18.141
38 HG SER 5 HG SER 5 2.909 -18.366 16.440
39 H LYS 6 HN LYS 6 4.428 -19.696 21.360
40 HA LYS 6 HA LYS 6 2.124 -21.468 21.656
41 HB2 LYS 6 HB2 LYS 6 5.029 -21.166 22.558
42 HB3 LYS 6 HB1 LYS 6 3.949 -22.228 23.542
43 HG2 LYS 6 HG2 LYS 6 4.796 -23.839 22.151
44 HG3 LYS 6 HG1 LYS 6 3.445 -23.311 21.104
45 HD2 LYS 6 HD2 LYS 6 5.025 -21.794 19.836
46 HD3 LYS 6 HD1 LYS 6 6.371 -22.333 20.899
47 HE2 LYS 6 HE2 LYS 6 6.183 -24.680 20.048
48 HE3 LYS 6 HE1 LYS 6 4.730 -24.237 19.058
49 HZ1 LYS 6 HZ1 LYS 6 6.080 -22.805 17.744
50 HZ2 LYS 6 HZ2 LYS 6 6.831 -24.326 17.821
51 HZ3 LYS 6 HZ3 LYS 6 7.439 -23.031 18.738
52 H PHE 7 HN PHE 7 4.157 -19.034 23.088
53 HA PHE 7 HA PHE 7 2.880 -19.052 25.591
54 HB2 PHE 7 HB2 PHE 7 4.592 -16.957 24.298
55 HB3 PHE 7 HB1 PHE 7 4.009 -16.870 26.000
56 HD1 PHE 7 HD1 PHE 7 6.860 -16.765 24.958
57 HD2 PHE 7 HD2 PHE 7 4.545 -20.000 26.521
58 HE1 PHE 7 HE1 PHE 7 8.838 -17.912 25.617
59 HE2 PHE 7 HE2 PHE 7 6.534 -21.094 27.153
60 HZ PHE 7 HZ PHE 7 8.743 -20.095 26.746
61 H PHE 8 HN PHE 8 2.427 -17.497 22.530
62 HA PHE 8 HA PHE 8 0.603 -15.628 23.264
63 HB2 PHE 8 HB2 PHE 8 1.404 -16.887 20.736
64 HB3 PHE 8 HB1 PHE 8 -0.269 -16.193 20.684
65 HD1 PHE 8 HD1 PHE 8 3.046 -15.315 20.141
66 HD2 PHE 8 HD2 PHE 8 -0.362 -14.228 22.199
67 HE1 PHE 8 HE1 PHE 8 4.043 -13.345 20.777
68 HE2 PHE 8 HE2 PHE 8 0.373 -12.256 22.829
69 HZ PHE 8 HZ PHE 8 2.695 -11.709 22.090
70 H ARG 9 HN ARG 9 -0.021 -18.888 22.587
71 HA ARG 9 HA ARG 9 -2.693 -18.414 22.495
72 HB2 ARG 9 HB2 ARG 9 -0.871 -20.724 22.837
73 HB3 ARG 9 HB1 ARG 9 -2.626 -21.004 23.131
74 HG2 ARG 9 HG2 ARG 9 -3.027 -19.985 20.792
75 HG3 ARG 9 HG1 ARG 9 -1.234 -20.053 20.564
76 HD2 ARG 9 HD2 ARG 9 -1.228 -22.488 20.920
77 HD3 ARG 9 HD1 ARG 9 -3.018 -22.440 21.296
78 HE ARG 9 HE ARG 9 -2.557 -21.209 18.755
79 HH11 ARG 9 HH11 ARG 9 -2.499 -24.500 20.234
80 HH12 ARG 9 HH12 ARG 9 -2.906 -25.316 18.761
81 HH21 ARG 9 HH21 ARG 9 -3.109 -22.375 16.778
82 HH22 ARG 9 HH22 ARG 9 -3.254 -24.101 16.788
83 H ASP 10 HN ASP 10 -0.482 -18.117 25.147
84 HA ASP 10 HA ASP 10 -2.679 -18.924 26.842
85 HB2 ASP 10 HB2 ASP 10 0.215 -18.394 27.712
86 HB3 ASP 10 HB1 ASP 10 -1.116 -18.829 28.842
87 H PHE 11 HN PHE 11 -0.998 -15.917 25.849
88 HA PHE 11 HA PHE 11 -2.025 -14.704 28.264
89 HB2 PHE 11 HB2 PHE 11 -1.199 -12.932 25.976
90 HB3 PHE 11 HB1 PHE 11 -0.988 -12.654 27.759
91 HD1 PHE 11 HD1 PHE 11 0.092 -13.911 24.724
92 HD2 PHE 11 HD2 PHE 11 1.098 -13.706 28.817
93 HE1 PHE 11 HE1 PHE 11 2.211 -14.500 24.165
94 HE2 PHE 11 HE2 PHE 11 3.390 -14.286 28.239
95 HZ PHE 11 HZ PHE 11 4.031 -14.613 25.892
96 H ILE 12 HN ILE 12 -2.419 -14.200 24.742
97 HA ILE 12 HA ILE 12 -4.309 -12.122 25.081
98 HB ILE 12 HB ILE 12 -4.532 -13.531 22.555
99 HG12 ILE 12 HG12 ILE 12 -2.000 -12.021 22.528
100 HG13 ILE 12 HG11 ILE 12 -1.914 -13.508 23.559
101 HG21 ILE 12 HG21 ILE 12 -5.585 -11.322 22.877
102 HG22 ILE 12 HG22 ILE 12 -4.282 -11.192 21.638
103 HG23 ILE 12 HG23 ILE 12 -3.995 -10.583 23.313
104 HD11 ILE 12 HD11 ILE 12 -1.778 -13.469 20.793
105 HD12 ILE 12 HD12 ILE 12 -3.471 -14.047 21.154
106 HD13 ILE 12 HD13 ILE 12 -2.054 -14.857 21.919
107 H LEU 13 HN LEU 13 -4.550 -15.549 24.922
108 HA LEU 13 HA LEU 13 -7.170 -15.464 24.041
109 HB2 LEU 13 HB2 LEU 13 -5.186 -17.579 24.772
110 HB3 LEU 13 HB1 LEU 13 -6.883 -18.037 24.347
111 HG LEU 13 HG LEU 13 -6.476 -16.487 22.267
112 HD11 LEU 13 HD11 LEU 13 -3.826 -16.842 21.615
113 HD12 LEU 13 HD12 LEU 13 -3.775 -16.398 23.379
114 HD13 LEU 13 HD13 LEU 13 -4.652 -15.372 22.211
115 HD21 LEU 13 HD21 LEU 13 -6.822 -18.948 22.026
116 HD22 LEU 13 HD22 LEU 13 -5.080 -19.237 22.404
117 HD23 LEU 13 HD23 LEU 13 -5.545 -18.387 20.879
118 H GLN 14 HN GLN 14 -5.626 -15.361 27.075
119 HA GLN 14 HA GLN 14 -8.102 -16.023 28.537
120 HB2 GLN 14 HB2 GLN 14 -5.380 -14.935 29.537
121 HB3 GLN 14 HB1 GLN 14 -6.803 -15.252 30.613
122 HG2 GLN 14 HG2 GLN 14 -6.740 -17.715 29.823
123 HG3 GLN 14 HG1 GLN 14 -5.190 -17.326 28.977
124 HE21 GLN 14 HE21 GLN 14 -3.351 -17.795 30.201
125 HE22 GLN 14 HE22 GLN 14 -3.257 -17.771 31.931
126 H ARG 15 HN ARG 15 -7.043 -13.497 26.607
127 HA ARG 15 HA ARG 15 -8.236 -11.401 28.198
128 HB2 ARG 15 HB2 ARG 15 -6.665 -11.340 25.593
129 HB3 ARG 15 HB1 ARG 15 -7.221 -9.873 26.504
130 HG2 ARG 15 HG2 ARG 15 -5.752 -11.865 28.150
131 HG3 ARG 15 HG1 ARG 15 -4.789 -11.223 26.797
132 HD2 ARG 15 HD2 ARG 15 -4.905 -8.980 27.540
133 HD3 ARG 15 HD1 ARG 15 -6.339 -9.313 28.642
134 HE ARG 15 HE ARG 15 -4.105 -10.911 29.542
135 HH11 ARG 15 HH11 ARG 15 -4.971 -7.401 29.311
136 HH12 ARG 15 HH12 ARG 15 -4.042 -6.951 30.702
137 HH21 ARG 15 HH21 ARG 15 -2.877 -10.227 31.422
138 HH22 ARG 15 HH22 ARG 15 -2.848 -8.563 31.904
139 H LYS 16 HN LYS 16 -9.228 -13.644 26.133
140 HA LYS 16 HA LYS 16 -10.966 -12.145 24.421
141 HB2 LYS 16 HB2 LYS 16 -11.088 -15.024 25.487
142 HB3 LYS 16 HB1 LYS 16 -12.192 -14.398 24.201
143 HG2 LYS 16 HG2 LYS 16 -10.356 -14.094 22.636
144 HG3 LYS 16 HG1 LYS 16 -9.126 -14.336 23.914
145 HD2 LYS 16 HD2 LYS 16 -9.087 -16.347 22.723
146 HD3 LYS 16 HD1 LYS 16 -10.031 -16.708 24.200
147 HE2 LYS 16 HE2 LYS 16 -12.194 -16.594 22.899
148 HE3 LYS 16 HE1 LYS 16 -11.285 -16.135 21.402
149 HZ1 LYS 16 HZ1 LYS 16 -11.804 -18.442 21.390
150 HZ2 LYS 16 HZ2 LYS 16 -11.090 -18.696 22.911
151 HZ3 LYS 16 HZ3 LYS 16 -10.125 -18.275 21.578
152 H LYS 17 HN LYS 17 -11.164 -13.748 27.520
153 HA LYS 17 HA LYS 17 -12.617 -13.861 29.177
154 HB2 LYS 17 HB2 LYS 17 -12.895 -10.835 28.655
155 HB3 LYS 17 HB1 LYS 17 -13.141 -11.667 30.234
156 HG2 LYS 17 HG2 LYS 17 -10.832 -12.038 30.565
157 HG3 LYS 17 HG1 LYS 17 -10.453 -12.021 28.820
158 HD2 LYS 17 HD2 LYS 17 -9.543 -9.966 29.373
159 HD3 LYS 17 HD1 LYS 17 -11.214 -9.415 29.005
160 HE2 LYS 17 HE2 LYS 17 -11.760 -9.479 31.517
161 HE3 LYS 17 HE1 LYS 17 -10.048 -9.999 31.848
162 HZ1 LYS 17 HZ1 LYS 17 -9.277 -7.954 31.438
163 HZ2 LYS 17 HZ2 LYS 17 -10.855 -7.479 31.847
164 HZ3 LYS 17 HZ3 LYS 17 -10.400 -7.597 30.215
Start of MODEL 15
1 H1 GLU 1 HT1 GLU 1 10.847 -17.932 12.643
2 H2 GLU 1 HT2 GLU 1 9.184 -17.587 12.654
3 H3 GLU 1 HT3 GLU 1 9.782 -18.850 11.690
4 HA GLU 1 HA GLU 1 8.719 -19.734 13.613
5 HB2 GLU 1 HB2 GLU 1 11.803 -19.951 13.540
6 HB3 GLU 1 HB1 GLU 1 10.826 -20.933 14.697
7 HG2 GLU 1 HG2 GLU 1 9.573 -21.993 12.774
8 HG3 GLU 1 HG1 GLU 1 10.540 -21.017 11.601
9 H MET 2 HN MET 2 7.893 -19.249 15.613
10 HA MET 2 HA MET 2 9.586 -17.731 17.501
11 HB2 MET 2 HB2 MET 2 6.912 -16.932 16.378
12 HB3 MET 2 HB1 MET 2 6.960 -17.046 18.177
13 HG2 MET 2 HG2 MET 2 7.399 -14.776 17.651
14 HG3 MET 2 HG1 MET 2 8.956 -15.482 18.164
15 HE1 MET 2 HE1 MET 2 6.764 -15.162 14.790
16 HE2 MET 2 HE2 MET 2 7.688 -13.832 14.015
17 HE3 MET 2 HE3 MET 2 6.933 -13.578 15.626
18 H ALA 3 HN ALA 3 9.419 -18.345 19.565
19 HA ALA 3 HA ALA 3 7.592 -20.463 20.073
20 HB1 ALA 3 HB1 ALA 3 9.634 -19.693 22.050
21 HB2 ALA 3 HB2 ALA 3 10.116 -20.681 20.616
22 HB3 ALA 3 HB3 ALA 3 8.868 -21.306 21.779
23 H LEU 4 HN LEU 4 7.342 -17.387 20.259
24 HA LEU 4 HA LEU 4 6.240 -17.455 22.901
25 HB2 LEU 4 HB2 LEU 4 5.256 -15.358 21.217
26 HB3 LEU 4 HB1 LEU 4 6.010 -15.225 22.834
27 HG LEU 4 HG LEU 4 7.478 -15.584 20.219
28 HD11 LEU 4 HD11 LEU 4 7.864 -13.071 20.311
29 HD12 LEU 4 HD12 LEU 4 6.631 -13.012 21.645
30 HD13 LEU 4 HD13 LEU 4 6.161 -13.634 20.008
31 HD21 LEU 4 HD21 LEU 4 8.372 -15.169 23.104
32 HD22 LEU 4 HD22 LEU 4 9.387 -14.441 21.788
33 HD23 LEU 4 HD23 LEU 4 9.057 -16.229 21.803
34 H SER 5 HN SER 5 5.673 -18.150 19.741
35 HA SER 5 HA SER 5 3.167 -17.166 19.502
36 HB2 SER 5 HB2 SER 5 4.660 -17.694 17.692
37 HB3 SER 5 HB1 SER 5 4.578 -19.448 18.103
38 HG SER 5 HG SER 5 3.224 -18.764 16.322
39 H LYS 6 HN LYS 6 4.472 -19.684 21.299
40 HA LYS 6 HA LYS 6 2.122 -21.409 21.476
41 HB2 LYS 6 HB2 LYS 6 4.984 -21.197 22.526
42 HB3 LYS 6 HB1 LYS 6 3.829 -22.286 23.395
43 HG2 LYS 6 HG2 LYS 6 4.572 -23.894 21.959
44 HG3 LYS 6 HG1 LYS 6 3.483 -23.123 20.766
45 HD2 LYS 6 HD2 LYS 6 5.454 -21.647 20.029
46 HD3 LYS 6 HD1 LYS 6 6.508 -22.603 21.123
47 HE2 LYS 6 HE2 LYS 6 4.860 -23.906 18.827
48 HE3 LYS 6 HE1 LYS 6 6.557 -23.313 18.628
49 HZ1 LYS 6 HZ1 LYS 6 6.900 -25.465 19.153
50 HZ2 LYS 6 HZ2 LYS 6 5.526 -25.609 20.140
51 HZ3 LYS 6 HZ3 LYS 6 6.912 -24.824 20.726
52 H PHE 7 HN PHE 7 4.131 -19.031 23.010
53 HA PHE 7 HA PHE 7 2.779 -19.072 25.469
54 HB2 PHE 7 HB2 PHE 7 4.538 -16.966 24.264
55 HB3 PHE 7 HB1 PHE 7 3.910 -16.906 25.951
56 HD1 PHE 7 HD1 PHE 7 6.765 -16.722 25.087
57 HD2 PHE 7 HD2 PHE 7 4.465 -20.112 26.310
58 HE1 PHE 7 HE1 PHE 7 8.741 -17.863 25.773
59 HE2 PHE 7 HE2 PHE 7 6.450 -21.198 26.966
60 HZ PHE 7 HZ PHE 7 8.649 -20.120 26.741
61 H PHE 8 HN PHE 8 2.414 -17.507 22.400
62 HA PHE 8 HA PHE 8 0.596 -15.616 23.103
63 HB2 PHE 8 HB2 PHE 8 1.456 -16.847 20.579
64 HB3 PHE 8 HB1 PHE 8 -0.223 -16.164 20.489
65 HD1 PHE 8 HD1 PHE 8 3.138 -15.281 20.134
66 HD2 PHE 8 HD2 PHE 8 -0.412 -14.193 21.939
67 HE1 PHE 8 HE1 PHE 8 4.107 -13.335 20.870
68 HE2 PHE 8 HE2 PHE 8 0.315 -12.223 22.677
69 HZ PHE 8 HZ PHE 8 2.688 -11.702 22.113
70 H ARG 9 HN ARG 9 -0.106 -18.884 22.409
71 HA ARG 9 HA ARG 9 -2.770 -18.298 22.348
72 HB2 ARG 9 HB2 ARG 9 -0.949 -20.591 22.268
73 HB3 ARG 9 HB1 ARG 9 -2.354 -21.011 23.295
74 HG2 ARG 9 HG2 ARG 9 -3.323 -21.687 21.359
75 HG3 ARG 9 HG1 ARG 9 -3.639 -19.951 21.070
76 HD2 ARG 9 HD2 ARG 9 -1.900 -19.740 19.459
77 HD3 ARG 9 HD1 ARG 9 -0.991 -21.201 20.079
78 HE ARG 9 HE ARG 9 -3.519 -22.160 19.307
79 HH11 ARG 9 HH11 ARG 9 -0.801 -20.485 17.613
80 HH12 ARG 9 HH12 ARG 9 -1.128 -21.226 16.082
81 HH21 ARG 9 HH21 ARG 9 -3.910 -23.130 17.203
82 HH22 ARG 9 HH22 ARG 9 -2.905 -22.736 15.849
83 H ASP 10 HN ASP 10 -0.527 -18.075 24.972
84 HA ASP 10 HA ASP 10 -2.698 -18.858 26.712
85 HB2 ASP 10 HB2 ASP 10 0.221 -18.393 27.527
86 HB3 ASP 10 HB1 ASP 10 -1.095 -18.817 28.679
87 H PHE 11 HN PHE 11 -1.010 -15.859 25.717
88 HA PHE 11 HA PHE 11 -1.936 -14.660 28.181
89 HB2 PHE 11 HB2 PHE 11 -1.166 -12.892 25.866
90 HB3 PHE 11 HB1 PHE 11 -0.920 -12.600 27.641
91 HD1 PHE 11 HD1 PHE 11 0.079 -13.969 24.604
92 HD2 PHE 11 HD2 PHE 11 1.205 -13.549 28.651
93 HE1 PHE 11 HE1 PHE 11 2.184 -14.552 24.014
94 HE2 PHE 11 HE2 PHE 11 3.487 -14.127 28.031
95 HZ PHE 11 HZ PHE 11 4.060 -14.568 25.684
96 H ILE 12 HN ILE 12 -2.448 -14.140 24.684
97 HA ILE 12 HA ILE 12 -4.286 -12.026 25.111
98 HB ILE 12 HB ILE 12 -4.577 -13.399 22.575
99 HG12 ILE 12 HG12 ILE 12 -2.029 -11.914 22.518
100 HG13 ILE 12 HG11 ILE 12 -1.933 -13.421 23.521
101 HG21 ILE 12 HG21 ILE 12 -3.977 -10.465 23.340
102 HG22 ILE 12 HG22 ILE 12 -5.596 -11.176 22.961
103 HG23 ILE 12 HG23 ILE 12 -4.340 -11.063 21.674
104 HD11 ILE 12 HD11 ILE 12 -2.113 -14.736 21.865
105 HD12 ILE 12 HD12 ILE 12 -1.870 -13.319 20.752
106 HD13 ILE 12 HD13 ILE 12 -3.548 -13.910 21.150
107 H LEU 13 HN LEU 13 -4.579 -15.456 24.899
108 HA LEU 13 HA LEU 13 -7.224 -15.317 24.086
109 HB2 LEU 13 HB2 LEU 13 -5.271 -17.486 24.732
110 HB3 LEU 13 HB1 LEU 13 -6.985 -17.887 24.321
111 HG LEU 13 HG LEU 13 -6.560 -16.280 22.281
112 HD11 LEU 13 HD11 LEU 13 -4.682 -15.238 22.251
113 HD12 LEU 13 HD12 LEU 13 -3.939 -16.712 21.574
114 HD13 LEU 13 HD13 LEU 13 -3.835 -16.357 23.355
115 HD21 LEU 13 HD21 LEU 13 -5.312 -19.097 22.344
116 HD22 LEU 13 HD22 LEU 13 -5.706 -18.185 20.836
117 HD23 LEU 13 HD23 LEU 13 -7.027 -18.691 21.956
118 H GLN 14 HN GLN 14 -5.610 -15.300 27.088
119 HA GLN 14 HA GLN 14 -8.019 -16.033 28.612
120 HB2 GLN 14 HB2 GLN 14 -5.296 -14.853 29.503
121 HB3 GLN 14 HB1 GLN 14 -6.667 -15.171 30.644
122 HG2 GLN 14 HG2 GLN 14 -6.591 -17.651 29.877
123 HG3 GLN 14 HG1 GLN 14 -5.072 -17.240 28.988
124 HE21 GLN 14 HE21 GLN 14 -3.199 -17.678 30.177
125 HE22 GLN 14 HE22 GLN 14 -3.059 -17.615 31.903
126 H ARG 15 HN ARG 15 -7.142 -13.463 26.667
127 HA ARG 15 HA ARG 15 -8.357 -11.419 28.303
128 HB2 ARG 15 HB2 ARG 15 -6.886 -11.307 25.642
129 HB3 ARG 15 HB1 ARG 15 -7.450 -9.863 26.591
130 HG2 ARG 15 HG2 ARG 15 -5.903 -11.736 28.249
131 HG3 ARG 15 HG1 ARG 15 -4.997 -11.270 26.792
132 HD2 ARG 15 HD2 ARG 15 -5.064 -8.938 27.297
133 HD3 ARG 15 HD1 ARG 15 -6.371 -9.170 28.574
134 HE ARG 15 HE ARG 15 -4.028 -10.705 29.326
135 HH11 ARG 15 HH11 ARG 15 -5.022 -7.243 29.001
136 HH12 ARG 15 HH12 ARG 15 -3.933 -6.681 30.225
137 HH21 ARG 15 HH21 ARG 15 -2.575 -9.880 30.974
138 HH22 ARG 15 HH22 ARG 15 -2.534 -8.189 31.350
139 H LYS 16 HN LYS 16 -9.320 -13.683 26.222
140 HA LYS 16 HA LYS 16 -11.142 -12.232 24.565
141 HB2 LYS 16 HB2 LYS 16 -11.122 -15.116 25.614
142 HB3 LYS 16 HB1 LYS 16 -12.298 -14.532 24.367
143 HG2 LYS 16 HG2 LYS 16 -10.520 -14.113 22.754
144 HG3 LYS 16 HG1 LYS 16 -9.246 -14.322 23.993
145 HD2 LYS 16 HD2 LYS 16 -9.146 -16.309 22.773
146 HD3 LYS 16 HD1 LYS 16 -10.047 -16.738 24.259
147 HE2 LYS 16 HE2 LYS 16 -12.236 -16.687 23.001
148 HE3 LYS 16 HE1 LYS 16 -11.377 -16.155 21.498
149 HZ1 LYS 16 HZ1 LYS 16 -10.027 -18.368 22.148
150 HZ2 LYS 16 HZ2 LYS 16 -11.368 -18.324 21.107
151 HZ3 LYS 16 HZ3 LYS 16 -11.569 -18.772 22.733
152 H LYS 17 HN LYS 17 -11.220 -13.844 27.657
153 HA LYS 17 HA LYS 17 -12.606 -13.948 29.379
154 HB2 LYS 17 HB2 LYS 17 -12.866 -10.959 28.679
155 HB3 LYS 17 HB1 LYS 17 -13.264 -11.662 30.291
156 HG2 LYS 17 HG2 LYS 17 -11.000 -12.097 30.816
157 HG3 LYS 17 HG1 LYS 17 -10.488 -12.185 29.098
158 HD2 LYS 17 HD2 LYS 17 -9.536 -10.152 29.957
159 HD3 LYS 17 HD1 LYS 17 -10.917 -9.655 28.918
160 HE2 LYS 17 HE2 LYS 17 -12.339 -9.228 30.961
161 HE3 LYS 17 HE1 LYS 17 -11.006 -9.825 32.033
162 HZ1 LYS 17 HZ1 LYS 17 -10.987 -7.427 30.271
163 HZ2 LYS 17 HZ2 LYS 17 -9.629 -8.017 31.103
164 HZ3 LYS 17 HZ3 LYS 17 -10.988 -7.477 31.968
Start of MODEL 16
1 H1 GLU 1 HT1 GLU 1 9.076 -18.557 11.901
2 H2 GLU 1 HT2 GLU 1 10.751 -18.345 12.087
3 H3 GLU 1 HT3 GLU 1 9.670 -17.338 12.924
4 HA GLU 1 HA GLU 1 8.918 -19.845 13.637
5 HB2 GLU 1 HB2 GLU 1 11.990 -19.579 13.446
6 HB3 GLU 1 HB1 GLU 1 11.235 -20.656 14.681
7 HG2 GLU 1 HG2 GLU 1 10.076 -21.968 12.853
8 HG3 GLU 1 HG1 GLU 1 10.841 -20.906 11.607
9 H MET 2 HN MET 2 8.046 -19.422 15.628
10 HA MET 2 HA MET 2 9.579 -17.778 17.523
11 HB2 MET 2 HB2 MET 2 6.919 -17.059 16.310
12 HB3 MET 2 HB1 MET 2 6.927 -17.147 18.116
13 HG2 MET 2 HG2 MET 2 8.543 -15.438 18.320
14 HG3 MET 2 HG1 MET 2 9.017 -15.495 16.591
15 HE1 MET 2 HE1 MET 2 8.945 -12.952 16.386
16 HE2 MET 2 HE2 MET 2 8.537 -12.849 18.134
17 HE3 MET 2 HE3 MET 2 7.595 -11.900 16.935
18 H ALA 3 HN ALA 3 9.437 -18.468 19.544
19 HA ALA 3 HA ALA 3 7.573 -20.566 20.014
20 HB1 ALA 3 HB1 ALA 3 10.080 -20.866 20.543
21 HB2 ALA 3 HB2 ALA 3 8.827 -21.449 21.722
22 HB3 ALA 3 HB3 ALA 3 9.656 -19.861 21.979
23 H LEU 4 HN LEU 4 7.400 -17.488 20.261
24 HA LEU 4 HA LEU 4 6.290 -17.584 22.895
25 HB2 LEU 4 HB2 LEU 4 5.378 -15.425 21.247
26 HB3 LEU 4 HB1 LEU 4 6.104 -15.349 22.881
27 HG LEU 4 HG LEU 4 7.600 -15.680 20.280
28 HD11 LEU 4 HD11 LEU 4 8.061 -13.186 20.452
29 HD12 LEU 4 HD12 LEU 4 6.821 -13.128 21.780
30 HD13 LEU 4 HD13 LEU 4 6.344 -13.682 20.121
31 HD21 LEU 4 HD21 LEU 4 9.527 -14.651 21.901
32 HD22 LEU 4 HD22 LEU 4 9.135 -16.426 21.866
33 HD23 LEU 4 HD23 LEU 4 8.472 -15.378 23.187
34 H SER 5 HN SER 5 5.713 -18.203 19.727
35 HA SER 5 HA SER 5 3.241 -17.127 19.506
36 HB2 SER 5 HB2 SER 5 4.711 -17.624 17.683
37 HB3 SER 5 HB1 SER 5 4.611 -19.389 18.040
38 HG SER 5 HG SER 5 3.251 -18.413 16.275
39 H LYS 6 HN LYS 6 4.460 -19.733 21.234
40 HA LYS 6 HA LYS 6 2.061 -21.396 21.355
41 HB2 LYS 6 HB2 LYS 6 4.921 -21.276 22.436
42 HB3 LYS 6 HB1 LYS 6 3.731 -22.344 23.282
43 HG2 LYS 6 HG2 LYS 6 4.504 -23.943 21.852
44 HG3 LYS 6 HG1 LYS 6 3.381 -23.192 20.678
45 HD2 LYS 6 HD2 LYS 6 5.194 -21.855 19.678
46 HD3 LYS 6 HD1 LYS 6 6.333 -22.352 20.968
47 HE2 LYS 6 HE2 LYS 6 6.905 -23.670 18.987
48 HE3 LYS 6 HE1 LYS 6 6.090 -24.809 20.130
49 HZ1 LYS 6 HZ1 LYS 6 5.146 -23.685 17.580
50 HZ2 LYS 6 HZ2 LYS 6 3.999 -24.082 18.769
51 HZ3 LYS 6 HZ3 LYS 6 5.062 -25.270 18.184
52 H PHE 7 HN PHE 7 4.132 -19.116 22.960
53 HA PHE 7 HA PHE 7 2.764 -19.169 25.410
54 HB2 PHE 7 HB2 PHE 7 4.591 -17.087 24.265
55 HB3 PHE 7 HB1 PHE 7 3.960 -17.055 25.950
56 HD1 PHE 7 HD1 PHE 7 6.820 -16.926 25.108
57 HD2 PHE 7 HD2 PHE 7 4.422 -20.288 26.215
58 HE1 PHE 7 HE1 PHE 7 8.760 -18.141 25.769
59 HE2 PHE 7 HE2 PHE 7 6.373 -21.449 26.847
60 HZ PHE 7 HZ PHE 7 8.601 -20.424 26.667
61 H PHE 8 HN PHE 8 2.463 -17.520 22.376
62 HA PHE 8 HA PHE 8 0.698 -15.594 23.123
63 HB2 PHE 8 HB2 PHE 8 1.538 -16.776 20.568
64 HB3 PHE 8 HB1 PHE 8 -0.119 -16.039 20.489
65 HD1 PHE 8 HD1 PHE 8 3.267 -15.245 20.175
66 HD2 PHE 8 HD2 PHE 8 -0.256 -14.113 22.003
67 HE1 PHE 8 HE1 PHE 8 4.292 -13.355 20.985
68 HE2 PHE 8 HE2 PHE 8 0.524 -12.195 22.818
69 HZ PHE 8 HZ PHE 8 2.914 -11.726 22.278
70 H ARG 9 HN ARG 9 -0.093 -18.822 22.346
71 HA ARG 9 HA ARG 9 -2.736 -18.162 22.283
72 HB2 ARG 9 HB2 ARG 9 -0.985 -20.487 22.125
73 HB3 ARG 9 HB1 ARG 9 -2.346 -20.904 23.208
74 HG2 ARG 9 HG2 ARG 9 -3.438 -21.524 21.324
75 HG3 ARG 9 HG1 ARG 9 -3.698 -19.778 21.044
76 HD2 ARG 9 HD2 ARG 9 -2.028 -19.636 19.359
77 HD3 ARG 9 HD1 ARG 9 -1.135 -21.118 19.953
78 HE ARG 9 HE ARG 9 -3.700 -22.037 19.299
79 HH11 ARG 9 HH11 ARG 9 -1.091 -20.352 17.450
80 HH12 ARG 9 HH12 ARG 9 -1.522 -21.074 15.935
81 HH21 ARG 9 HH21 ARG 9 -4.234 -22.979 17.219
82 HH22 ARG 9 HH22 ARG 9 -3.319 -22.574 15.805
83 H ASP 10 HN ASP 10 -0.497 -18.050 24.922
84 HA ASP 10 HA ASP 10 -2.696 -18.797 26.638
85 HB2 ASP 10 HB2 ASP 10 0.236 -18.438 27.465
86 HB3 ASP 10 HB1 ASP 10 -1.093 -18.859 28.602
87 H PHE 11 HN PHE 11 -0.891 -15.824 25.745
88 HA PHE 11 HA PHE 11 -1.781 -14.653 28.236
89 HB2 PHE 11 HB2 PHE 11 -0.946 -12.864 25.961
90 HB3 PHE 11 HB1 PHE 11 -0.691 -12.617 27.742
91 HD1 PHE 11 HD1 PHE 11 0.247 -13.995 24.682
92 HD2 PHE 11 HD2 PHE 11 1.412 -13.614 28.722
93 HE1 PHE 11 HE1 PHE 11 2.329 -14.631 24.074
94 HE2 PHE 11 HE2 PHE 11 3.675 -14.252 28.086
95 HZ PHE 11 HZ PHE 11 4.218 -14.707 25.733
96 H ILE 12 HN ILE 12 -2.315 -14.133 24.741
97 HA ILE 12 HA ILE 12 -4.076 -11.956 25.248
98 HB ILE 12 HB ILE 12 -4.395 -13.187 22.652
99 HG12 ILE 12 HG12 ILE 12 -1.791 -11.810 22.652
100 HG13 ILE 12 HG11 ILE 12 -1.749 -13.349 23.611
101 HG21 ILE 12 HG21 ILE 12 -3.661 -10.323 23.559
102 HG22 ILE 12 HG22 ILE 12 -5.312 -10.939 23.160
103 HG23 ILE 12 HG23 ILE 12 -4.060 -10.821 21.869
104 HD11 ILE 12 HD11 ILE 12 -3.379 -13.703 21.224
105 HD12 ILE 12 HD12 ILE 12 -1.980 -14.607 21.917
106 HD13 ILE 12 HD13 ILE 12 -1.679 -13.168 20.848
107 H LEU 13 HN LEU 13 -4.433 -15.368 24.925
108 HA LEU 13 HA LEU 13 -7.085 -15.123 24.099
109 HB2 LEU 13 HB2 LEU 13 -5.206 -17.381 24.630
110 HB3 LEU 13 HB1 LEU 13 -6.941 -17.698 24.233
111 HG LEU 13 HG LEU 13 -6.493 -15.993 22.278
112 HD11 LEU 13 HD11 LEU 13 -3.896 -16.533 21.494
113 HD12 LEU 13 HD12 LEU 13 -3.760 -16.220 23.280
114 HD13 LEU 13 HD13 LEU 13 -4.579 -15.043 22.214
115 HD21 LEU 13 HD21 LEU 13 -5.737 -17.860 20.710
116 HD22 LEU 13 HD22 LEU 13 -7.093 -18.334 21.804
117 HD23 LEU 13 HD23 LEU 13 -5.412 -18.878 22.167
118 H GLN 14 HN GLN 14 -5.477 -15.186 27.082
119 HA GLN 14 HA GLN 14 -7.819 -15.992 28.634
120 HB2 GLN 14 HB2 GLN 14 -5.152 -14.665 29.456
121 HB3 GLN 14 HB1 GLN 14 -6.500 -14.939 30.632
122 HG2 GLN 14 HG2 GLN 14 -6.402 -17.445 30.062
123 HG3 GLN 14 HG1 GLN 14 -4.949 -17.099 29.047
124 HE21 GLN 14 HE21 GLN 14 -3.101 -17.735 30.193
125 HE22 GLN 14 HE22 GLN 14 -2.804 -17.436 31.874
126 H ARG 15 HN ARG 15 -7.222 -13.400 26.629
127 HA ARG 15 HA ARG 15 -8.524 -11.359 28.235
128 HB2 ARG 15 HB2 ARG 15 -7.543 -11.258 25.348
129 HB3 ARG 15 HB1 ARG 15 -8.035 -9.831 26.364
130 HG2 ARG 15 HG2 ARG 15 -5.746 -11.720 27.046
131 HG3 ARG 15 HG1 ARG 15 -5.522 -10.323 25.960
132 HD2 ARG 15 HD2 ARG 15 -6.486 -10.055 28.915
133 HD3 ARG 15 HD1 ARG 15 -4.740 -9.936 28.349
134 HE ARG 15 HE ARG 15 -6.309 -8.106 26.766
135 HH11 ARG 15 HH11 ARG 15 -5.243 -8.482 30.202
136 HH12 ARG 15 HH12 ARG 15 -5.265 -6.781 30.528
137 HH21 ARG 15 HH21 ARG 15 -6.315 -5.817 27.273
138 HH22 ARG 15 HH22 ARG 15 -5.878 -5.259 28.852
139 H LYS 16 HN LYS 16 -9.324 -13.912 26.410
140 HA LYS 16 HA LYS 16 -11.667 -12.716 25.157
141 HB2 LYS 16 HB2 LYS 16 -10.636 -15.583 25.363
142 HB3 LYS 16 HB1 LYS 16 -12.081 -15.093 24.400
143 HG2 LYS 16 HG2 LYS 16 -10.720 -13.709 22.912
144 HG3 LYS 16 HG1 LYS 16 -9.270 -13.891 23.945
145 HD2 LYS 16 HD2 LYS 16 -8.874 -15.305 22.123
146 HD3 LYS 16 HD1 LYS 16 -9.322 -16.378 23.483
147 HE2 LYS 16 HE2 LYS 16 -11.625 -16.719 22.509
148 HE3 LYS 16 HE1 LYS 16 -11.267 -15.531 21.190
149 HZ1 LYS 16 HZ1 LYS 16 -10.629 -17.302 20.075
150 HZ2 LYS 16 HZ2 LYS 16 -10.556 -18.301 21.447
151 HZ3 LYS 16 HZ3 LYS 16 -9.230 -17.322 21.037
152 H LYS 17 HN LYS 17 -12.267 -11.931 27.119
153 HA LYS 17 HA LYS 17 -13.561 -13.779 29.012
154 HB2 LYS 17 HB2 LYS 17 -12.846 -10.789 29.311
155 HB3 LYS 17 HB1 LYS 17 -13.385 -11.900 30.623
156 HG2 LYS 17 HG2 LYS 17 -11.288 -13.025 30.721
157 HG3 LYS 17 HG1 LYS 17 -10.810 -12.572 29.050
158 HD2 LYS 17 HD2 LYS 17 -9.426 -11.252 30.471
159 HD3 LYS 17 HD1 LYS 17 -10.675 -10.127 29.846
160 HE2 LYS 17 HE2 LYS 17 -11.918 -10.246 32.050
161 HE3 LYS 17 HE1 LYS 17 -10.715 -11.449 32.673
162 HZ1 LYS 17 HZ1 LYS 17 -10.553 -8.588 32.453
163 HZ2 LYS 17 HZ2 LYS 17 -9.183 -9.376 31.830
164 HZ3 LYS 17 HZ3 LYS 17 -9.680 -9.673 33.426
Start of MODEL 17
1 H1 GLU 1 HT1 GLU 1 8.849 -17.529 12.730
2 H2 GLU 1 HT2 GLU 1 9.459 -18.682 11.642
3 H3 GLU 1 HT3 GLU 1 10.523 -17.644 12.464
4 HA GLU 1 HA GLU 1 8.860 -19.794 13.611
5 HB2 GLU 1 HB2 GLU 1 11.904 -19.387 13.252
6 HB3 GLU 1 HB1 GLU 1 11.258 -20.558 14.463
7 HG2 GLU 1 HG2 GLU 1 10.063 -21.825 12.631
8 HG3 GLU 1 HG1 GLU 1 10.704 -20.661 11.405
9 H MET 2 HN MET 2 7.960 -19.257 15.566
10 HA MET 2 HA MET 2 9.604 -17.724 17.476
11 HB2 MET 2 HB2 MET 2 6.932 -16.921 16.344
12 HB3 MET 2 HB1 MET 2 6.973 -17.059 18.142
13 HG2 MET 2 HG2 MET 2 7.395 -14.781 17.640
14 HG3 MET 2 HG1 MET 2 8.960 -15.478 18.156
15 HE1 MET 2 HE1 MET 2 8.575 -12.677 16.778
16 HE2 MET 2 HE2 MET 2 9.979 -12.649 15.656
17 HE3 MET 2 HE3 MET 2 10.157 -13.355 17.300
18 H ALA 3 HN ALA 3 9.446 -18.409 19.513
19 HA ALA 3 HA ALA 3 7.584 -20.511 19.980
20 HB1 ALA 3 HB1 ALA 3 8.859 -21.411 21.663
21 HB2 ALA 3 HB2 ALA 3 9.656 -19.813 21.959
22 HB3 ALA 3 HB3 ALA 3 10.107 -20.790 20.506
23 H LEU 4 HN LEU 4 7.382 -17.441 20.227
24 HA LEU 4 HA LEU 4 6.296 -17.535 22.875
25 HB2 LEU 4 HB2 LEU 4 5.325 -15.399 21.230
26 HB3 LEU 4 HB1 LEU 4 6.095 -15.299 22.842
27 HG LEU 4 HG LEU 4 7.535 -15.641 20.209
28 HD11 LEU 4 HD11 LEU 4 6.243 -13.675 20.031
29 HD12 LEU 4 HD12 LEU 4 7.956 -13.134 20.335
30 HD13 LEU 4 HD13 LEU 4 6.727 -13.079 21.671
31 HD21 LEU 4 HD21 LEU 4 9.473 -14.543 21.773
32 HD22 LEU 4 HD22 LEU 4 9.119 -16.327 21.770
33 HD23 LEU 4 HD23 LEU 4 8.461 -15.273 23.091
34 H SER 5 HN SER 5 5.699 -18.191 19.713
35 HA SER 5 HA SER 5 3.205 -17.171 19.502
36 HB2 SER 5 HB2 SER 5 4.678 -17.700 17.674
37 HB3 SER 5 HB1 SER 5 4.571 -19.458 18.066
38 HG SER 5 HG SER 5 3.211 -18.651 16.297
39 H LYS 6 HN LYS 6 4.493 -19.715 21.269
40 HA LYS 6 HA LYS 6 2.135 -21.424 21.452
41 HB2 LYS 6 HB2 LYS 6 5.003 -21.227 22.484
42 HB3 LYS 6 HB1 LYS 6 3.849 -22.292 23.380
43 HG2 LYS 6 HG2 LYS 6 4.625 -23.908 21.974
44 HG3 LYS 6 HG1 LYS 6 3.455 -23.209 20.813
45 HD2 LYS 6 HD2 LYS 6 5.278 -21.774 19.827
46 HD3 LYS 6 HD1 LYS 6 6.451 -22.467 21.003
47 HE2 LYS 6 HE2 LYS 6 6.042 -24.797 20.013
48 HE3 LYS 6 HE1 LYS 6 4.940 -24.047 18.786
49 HZ1 LYS 6 HZ1 LYS 6 6.913 -24.144 17.701
50 HZ2 LYS 6 HZ2 LYS 6 7.862 -23.844 19.077
51 HZ3 LYS 6 HZ3 LYS 6 7.009 -22.574 18.340
52 H PHE 7 HN PHE 7 4.168 -19.071 22.989
53 HA PHE 7 HA PHE 7 2.821 -19.106 25.453
54 HB2 PHE 7 HB2 PHE 7 4.602 -17.014 24.252
55 HB3 PHE 7 HB1 PHE 7 3.980 -16.958 25.941
56 HD1 PHE 7 HD1 PHE 7 6.834 -16.802 25.067
57 HD2 PHE 7 HD2 PHE 7 4.498 -20.170 26.283
58 HE1 PHE 7 HE1 PHE 7 8.798 -17.969 25.740
59 HE2 PHE 7 HE2 PHE 7 6.473 -21.283 26.926
60 HZ PHE 7 HZ PHE 7 8.684 -20.230 26.698
61 H PHE 8 HN PHE 8 2.462 -17.523 22.390
62 HA PHE 8 HA PHE 8 0.669 -15.614 23.111
63 HB2 PHE 8 HB2 PHE 8 1.507 -16.838 20.575
64 HB3 PHE 8 HB1 PHE 8 -0.165 -16.137 20.495
65 HD1 PHE 8 HD1 PHE 8 3.208 -15.287 20.145
66 HD2 PHE 8 HD2 PHE 8 -0.335 -14.176 21.950
67 HE1 PHE 8 HE1 PHE 8 4.198 -13.359 20.899
68 HE2 PHE 8 HE2 PHE 8 0.414 -12.223 22.711
69 HZ PHE 8 HZ PHE 8 2.795 -11.721 22.154
70 H ARG 9 HN ARG 9 -0.069 -18.868 22.391
71 HA ARG 9 HA ARG 9 -2.725 -18.256 22.346
72 HB2 ARG 9 HB2 ARG 9 -0.928 -20.567 22.239
73 HB3 ARG 9 HB1 ARG 9 -2.336 -20.982 23.262
74 HG2 ARG 9 HG2 ARG 9 -3.318 -21.625 21.320
75 HG3 ARG 9 HG1 ARG 9 -3.608 -19.882 21.049
76 HD2 ARG 9 HD2 ARG 9 -1.870 -19.680 19.437
77 HD3 ARG 9 HD1 ARG 9 -0.975 -21.155 20.047
78 HE ARG 9 HE ARG 9 -3.516 -22.078 19.266
79 HH11 ARG 9 HH11 ARG 9 -0.767 -20.436 17.592
80 HH12 ARG 9 HH12 ARG 9 -1.096 -21.165 16.056
81 HH21 ARG 9 HH21 ARG 9 -3.910 -23.035 17.157
82 HH22 ARG 9 HH22 ARG 9 -2.893 -22.650 15.809
83 H ASP 10 HN ASP 10 -0.467 -18.077 24.958
84 HA ASP 10 HA ASP 10 -2.626 -18.868 26.705
85 HB2 ASP 10 HB2 ASP 10 0.305 -18.423 27.495
86 HB3 ASP 10 HB1 ASP 10 -0.998 -18.871 28.650
87 H PHE 11 HN PHE 11 -0.921 -15.862 25.743
88 HA PHE 11 HA PHE 11 -1.809 -14.687 28.234
89 HB2 PHE 11 HB2 PHE 11 -1.044 -12.903 25.926
90 HB3 PHE 11 HB1 PHE 11 -0.779 -12.627 27.701
91 HD1 PHE 11 HD1 PHE 11 0.178 -13.979 24.640
92 HD2 PHE 11 HD2 PHE 11 1.346 -13.602 28.681
93 HE1 PHE 11 HE1 PHE 11 2.272 -14.573 24.027
94 HE2 PHE 11 HE2 PHE 11 3.618 -14.191 28.035
95 HZ PHE 11 HZ PHE 11 4.165 -14.618 25.677
96 H ILE 12 HN ILE 12 -2.361 -14.150 24.749
97 HA ILE 12 HA ILE 12 -4.177 -12.026 25.231
98 HB ILE 12 HB ILE 12 -4.487 -13.337 22.669
99 HG12 ILE 12 HG12 ILE 12 -1.922 -11.878 22.631
100 HG13 ILE 12 HG11 ILE 12 -1.836 -13.409 23.599
101 HG21 ILE 12 HG21 ILE 12 -4.228 -10.983 21.820
102 HG22 ILE 12 HG22 ILE 12 -3.850 -10.426 23.496
103 HG23 ILE 12 HG23 ILE 12 -5.479 -11.112 23.113
104 HD11 ILE 12 HD11 ILE 12 -2.043 -14.685 21.914
105 HD12 ILE 12 HD12 ILE 12 -1.791 -13.244 20.833
106 HD13 ILE 12 HD13 ILE 12 -3.473 -13.825 21.229
107 H LEU 13 HN LEU 13 -4.476 -15.453 24.958
108 HA LEU 13 HA LEU 13 -7.133 -15.279 24.158
109 HB2 LEU 13 HB2 LEU 13 -5.197 -17.487 24.721
110 HB3 LEU 13 HB1 LEU 13 -6.922 -17.854 24.318
111 HG LEU 13 HG LEU 13 -6.503 -16.190 22.327
112 HD11 LEU 13 HD11 LEU 13 -3.889 -16.644 21.579
113 HD12 LEU 13 HD12 LEU 13 -3.771 -16.321 23.366
114 HD13 LEU 13 HD13 LEU 13 -4.616 -15.174 22.291
115 HD21 LEU 13 HD21 LEU 13 -5.685 -18.060 20.811
116 HD22 LEU 13 HD22 LEU 13 -7.007 -18.578 21.925
117 HD23 LEU 13 HD23 LEU 13 -5.296 -19.026 22.287
118 H GLN 14 HN GLN 14 -5.510 -15.347 27.154
119 HA GLN 14 HA GLN 14 -7.871 -16.167 28.688
120 HB2 GLN 14 HB2 GLN 14 -5.213 -14.819 29.534
121 HB3 GLN 14 HB1 GLN 14 -6.562 -15.151 30.700
122 HG2 GLN 14 HG2 GLN 14 -6.392 -17.646 30.054
123 HG3 GLN 14 HG1 GLN 14 -4.929 -17.225 29.082
124 HE21 GLN 14 HE21 GLN 14 -3.051 -17.744 30.234
125 HE22 GLN 14 HE22 GLN 14 -2.816 -17.520 31.936
126 H ARG 15 HN ARG 15 -7.124 -13.567 26.735
127 HA ARG 15 HA ARG 15 -8.565 -11.613 28.280
128 HB2 ARG 15 HB2 ARG 15 -7.094 -11.371 25.639
129 HB3 ARG 15 HB1 ARG 15 -7.773 -9.998 26.628
130 HG2 ARG 15 HG2 ARG 15 -6.211 -11.524 28.440
131 HG3 ARG 15 HG1 ARG 15 -5.278 -11.532 26.919
132 HD2 ARG 15 HD2 ARG 15 -5.229 -9.070 26.830
133 HD3 ARG 15 HD1 ARG 15 -6.399 -8.973 28.248
134 HE ARG 15 HE ARG 15 -4.015 -10.474 29.008
135 HH11 ARG 15 HH11 ARG 15 -5.063 -7.086 28.301
136 HH12 ARG 15 HH12 ARG 15 -3.864 -6.365 29.323
137 HH21 ARG 15 HH21 ARG 15 -2.416 -9.435 30.376
138 HH22 ARG 15 HH22 ARG 15 -2.352 -7.710 30.507
139 H LYS 16 HN LYS 16 -9.442 -14.066 26.649
140 HA LYS 16 HA LYS 16 -11.508 -12.761 25.037
141 HB2 LYS 16 HB2 LYS 16 -10.786 -15.681 25.590
142 HB3 LYS 16 HB1 LYS 16 -12.175 -15.181 24.549
143 HG2 LYS 16 HG2 LYS 16 -10.711 -14.119 22.928
144 HG3 LYS 16 HG1 LYS 16 -9.284 -14.243 24.003
145 HD2 LYS 16 HD2 LYS 16 -8.950 -15.924 22.402
146 HD3 LYS 16 HD1 LYS 16 -9.499 -16.771 23.880
147 HE2 LYS 16 HE2 LYS 16 -11.802 -17.082 22.898
148 HE3 LYS 16 HE1 LYS 16 -11.336 -16.113 21.441
149 HZ1 LYS 16 HZ1 LYS 16 -10.060 -17.795 20.652
150 HZ2 LYS 16 HZ2 LYS 16 -11.260 -18.694 21.449
151 HZ3 LYS 16 HZ3 LYS 16 -9.740 -18.477 22.174
152 H LYS 17 HN LYS 17 -12.115 -11.700 26.853
153 HA LYS 17 HA LYS 17 -13.689 -13.172 28.861
154 HB2 LYS 17 HB2 LYS 17 -12.473 -10.327 28.905
155 HB3 LYS 17 HB1 LYS 17 -13.315 -11.138 30.281
156 HG2 LYS 17 HG2 LYS 17 -11.494 -12.645 30.681
157 HG3 LYS 17 HG1 LYS 17 -10.796 -12.460 29.034
158 HD2 LYS 17 HD2 LYS 17 -9.320 -11.282 30.510
159 HD3 LYS 17 HD1 LYS 17 -10.233 -10.023 29.621
160 HE2 LYS 17 HE2 LYS 17 -11.695 -9.620 31.652
161 HE3 LYS 17 HE1 LYS 17 -10.855 -10.958 32.537
162 HZ1 LYS 17 HZ1 LYS 17 -10.021 -8.241 32.001
163 HZ2 LYS 17 HZ2 LYS 17 -8.809 -9.406 31.760
164 HZ3 LYS 17 HZ3 LYS 17 -9.601 -9.302 33.259
Start of MODEL 18
1 H1 GLU 1 HT1 GLU 1 9.649 -18.630 11.567
2 H2 GLU 1 HT2 GLU 1 9.936 -17.323 12.612
3 H3 GLU 1 HT3 GLU 1 8.359 -17.916 12.408
4 HA GLU 1 HA GLU 1 8.747 -19.823 13.582
5 HB2 GLU 1 HB2 GLU 1 11.734 -19.168 13.140
6 HB3 GLU 1 HB1 GLU 1 11.225 -20.340 14.414
7 HG2 GLU 1 HG2 GLU 1 10.102 -21.784 12.670
8 HG3 GLU 1 HG1 GLU 1 10.599 -20.619 11.381
9 H MET 2 HN MET 2 7.874 -19.368 15.571
10 HA MET 2 HA MET 2 9.414 -17.689 17.423
11 HB2 MET 2 HB2 MET 2 6.710 -17.006 16.282
12 HB3 MET 2 HB1 MET 2 6.774 -17.088 18.087
13 HG2 MET 2 HG2 MET 2 8.385 -15.364 18.233
14 HG3 MET 2 HG1 MET 2 8.792 -15.417 16.486
15 HE1 MET 2 HE1 MET 2 8.684 -12.875 16.283
16 HE2 MET 2 HE2 MET 2 8.345 -12.777 18.046
17 HE3 MET 2 HE3 MET 2 7.346 -11.837 16.885
18 H ALA 3 HN ALA 3 9.325 -18.373 19.448
19 HA ALA 3 HA ALA 3 7.500 -20.494 19.974
20 HB1 ALA 3 HB1 ALA 3 9.616 -19.752 21.891
21 HB2 ALA 3 HB2 ALA 3 10.032 -20.748 20.441
22 HB3 ALA 3 HB3 ALA 3 8.818 -21.354 21.648
23 H LEU 4 HN LEU 4 7.295 -17.414 20.206
24 HA LEU 4 HA LEU 4 6.249 -17.510 22.869
25 HB2 LEU 4 HB2 LEU 4 5.258 -15.372 21.238
26 HB3 LEU 4 HB1 LEU 4 6.033 -15.277 22.848
27 HG LEU 4 HG LEU 4 7.452 -15.598 20.204
28 HD11 LEU 4 HD11 LEU 4 7.877 -13.093 20.355
29 HD12 LEU 4 HD12 LEU 4 6.670 -13.053 21.712
30 HD13 LEU 4 HD13 LEU 4 6.162 -13.623 20.068
31 HD21 LEU 4 HD21 LEU 4 9.049 -16.310 21.745
32 HD22 LEU 4 HD22 LEU 4 8.410 -15.261 23.081
33 HD23 LEU 4 HD23 LEU 4 9.412 -14.530 21.757
34 H SER 5 HN SER 5 5.610 -18.155 19.719
35 HA SER 5 HA SER 5 3.113 -17.132 19.546
36 HB2 SER 5 HB2 SER 5 4.554 -17.623 17.694
37 HB3 SER 5 HB1 SER 5 4.488 -19.385 18.072
38 HG SER 5 HG SER 5 3.088 -18.800 16.359
39 H LYS 6 HN LYS 6 4.427 -19.689 21.276
40 HA LYS 6 HA LYS 6 2.071 -21.400 21.475
41 HB2 LYS 6 HB2 LYS 6 4.950 -21.211 22.478
42 HB3 LYS 6 HB1 LYS 6 3.804 -22.278 23.384
43 HG2 LYS 6 HG2 LYS 6 4.540 -23.897 21.964
44 HG3 LYS 6 HG1 LYS 6 3.386 -23.172 20.803
45 HD2 LYS 6 HD2 LYS 6 5.229 -21.760 19.832
46 HD3 LYS 6 HD1 LYS 6 6.388 -22.468 21.012
47 HE2 LYS 6 HE2 LYS 6 5.951 -24.793 20.013
48 HE3 LYS 6 HE1 LYS 6 4.880 -24.019 18.773
49 HZ1 LYS 6 HZ1 LYS 6 7.269 -24.483 18.175
50 HZ2 LYS 6 HZ2 LYS 6 7.695 -23.180 19.176
51 HZ3 LYS 6 HZ3 LYS 6 6.680 -22.926 17.839
52 H PHE 7 HN PHE 7 4.121 -19.057 23.004
53 HA PHE 7 HA PHE 7 2.807 -19.109 25.484
54 HB2 PHE 7 HB2 PHE 7 4.562 -17.002 24.272
55 HB3 PHE 7 HB1 PHE 7 3.964 -16.960 25.970
56 HD1 PHE 7 HD1 PHE 7 6.802 -16.777 25.062
57 HD2 PHE 7 HD2 PHE 7 4.507 -20.175 26.274
58 HE1 PHE 7 HE1 PHE 7 8.784 -17.936 25.701
59 HE2 PHE 7 HE2 PHE 7 6.498 -21.279 26.883
60 HZ PHE 7 HZ PHE 7 8.698 -20.206 26.639
61 H PHE 8 HN PHE 8 2.407 -17.503 22.437
62 HA PHE 8 HA PHE 8 0.619 -15.606 23.196
63 HB2 PHE 8 HB2 PHE 8 1.431 -16.804 20.639
64 HB3 PHE 8 HB1 PHE 8 -0.243 -16.103 20.585
65 HD1 PHE 8 HD1 PHE 8 3.124 -15.249 20.204
66 HD2 PHE 8 HD2 PHE 8 -0.395 -14.155 22.064
67 HE1 PHE 8 HE1 PHE 8 4.121 -13.327 20.963
68 HE2 PHE 8 HE2 PHE 8 0.359 -12.204 22.830
69 HZ PHE 8 HZ PHE 8 2.734 -11.701 22.247
70 H ARG 9 HN ARG 9 -0.123 -18.856 22.459
71 HA ARG 9 HA ARG 9 -2.781 -18.247 22.444
72 HB2 ARG 9 HB2 ARG 9 -0.982 -20.554 22.305
73 HB3 ARG 9 HB1 ARG 9 -2.378 -20.977 23.343
74 HG2 ARG 9 HG2 ARG 9 -3.382 -21.611 21.409
75 HG3 ARG 9 HG1 ARG 9 -3.675 -19.867 21.147
76 HD2 ARG 9 HD2 ARG 9 -1.958 -19.659 19.516
77 HD3 ARG 9 HD1 ARG 9 -1.053 -21.132 20.113
78 HE ARG 9 HE ARG 9 -3.595 -22.066 19.358
79 HH11 ARG 9 HH11 ARG 9 -0.882 -20.395 17.653
80 HH12 ARG 9 HH12 ARG 9 -1.226 -21.122 16.118
81 HH21 ARG 9 HH21 ARG 9 -4.011 -23.017 17.251
82 HH22 ARG 9 HH22 ARG 9 -3.017 -22.619 15.890
83 H ASP 10 HN ASP 10 -0.498 -18.078 25.035
84 HA ASP 10 HA ASP 10 -2.640 -18.878 26.800
85 HB2 ASP 10 HB2 ASP 10 0.298 -18.436 27.564
86 HB3 ASP 10 HB1 ASP 10 -0.994 -18.889 28.728
87 H PHE 11 HN PHE 11 -0.936 -15.870 25.840
88 HA PHE 11 HA PHE 11 -1.808 -14.704 28.340
89 HB2 PHE 11 HB2 PHE 11 -1.063 -12.909 26.036
90 HB3 PHE 11 HB1 PHE 11 -0.783 -12.642 27.810
91 HD1 PHE 11 HD1 PHE 11 0.147 -13.990 24.737
92 HD2 PHE 11 HD2 PHE 11 1.355 -13.607 28.765
93 HE1 PHE 11 HE1 PHE 11 2.236 -14.579 24.101
94 HE2 PHE 11 HE2 PHE 11 3.623 -14.191 28.096
95 HZ PHE 11 HZ PHE 11 4.146 -14.618 25.733
96 H ILE 12 HN ILE 12 -2.377 -14.145 24.859
97 HA ILE 12 HA ILE 12 -4.195 -12.023 25.349
98 HB ILE 12 HB ILE 12 -4.534 -13.352 22.796
99 HG12 ILE 12 HG12 ILE 12 -1.979 -11.881 22.716
100 HG13 ILE 12 HG11 ILE 12 -1.871 -13.405 23.693
101 HG21 ILE 12 HG21 ILE 12 -3.899 -10.435 23.607
102 HG22 ILE 12 HG22 ILE 12 -5.528 -11.128 23.240
103 HG23 ILE 12 HG23 ILE 12 -4.292 -10.998 21.935
104 HD11 ILE 12 HD11 ILE 12 -3.539 -13.842 21.347
105 HD12 ILE 12 HD12 ILE 12 -2.097 -14.691 22.019
106 HD13 ILE 12 HD13 ILE 12 -1.866 -13.259 20.925
107 H LEU 13 HN LEU 13 -4.487 -15.446 25.079
108 HA LEU 13 HA LEU 13 -7.172 -15.282 24.325
109 HB2 LEU 13 HB2 LEU 13 -5.216 -17.480 24.859
110 HB3 LEU 13 HB1 LEU 13 -6.946 -17.858 24.499
111 HG LEU 13 HG LEU 13 -6.587 -16.229 22.467
112 HD11 LEU 13 HD11 LEU 13 -3.973 -16.644 21.687
113 HD12 LEU 13 HD12 LEU 13 -3.827 -16.296 23.466
114 HD13 LEU 13 HD13 LEU 13 -4.711 -15.176 22.392
115 HD21 LEU 13 HD21 LEU 13 -5.320 -19.040 22.468
116 HD22 LEU 13 HD22 LEU 13 -5.752 -18.113 20.978
117 HD23 LEU 13 HD23 LEU 13 -7.045 -18.637 22.123
118 H GLN 14 HN GLN 14 -5.493 -15.300 27.298
119 HA GLN 14 HA GLN 14 -7.859 -16.090 28.858
120 HB2 GLN 14 HB2 GLN 14 -5.167 -14.810 29.698
121 HB3 GLN 14 HB1 GLN 14 -6.516 -15.129 30.866
122 HG2 GLN 14 HG2 GLN 14 -6.399 -17.619 30.197
123 HG3 GLN 14 HG1 GLN 14 -4.936 -17.220 29.216
124 HE21 GLN 14 HE21 GLN 14 -3.045 -17.745 30.340
125 HE22 GLN 14 HE22 GLN 14 -2.796 -17.558 32.045
126 H ARG 15 HN ARG 15 -6.982 -13.482 26.943
127 HA ARG 15 HA ARG 15 -8.450 -11.450 28.438
128 HB2 ARG 15 HB2 ARG 15 -6.881 -11.307 25.827
129 HB3 ARG 15 HB1 ARG 15 -7.505 -9.906 26.797
130 HG2 ARG 15 HG2 ARG 15 -5.882 -11.709 28.459
131 HG3 ARG 15 HG1 ARG 15 -4.992 -11.249 26.989
132 HD2 ARG 15 HD2 ARG 15 -5.137 -8.906 27.446
133 HD3 ARG 15 HD1 ARG 15 -6.418 -9.165 28.750
134 HE ARG 15 HE ARG 15 -4.030 -10.610 29.505
135 HH11 ARG 15 HH11 ARG 15 -5.067 -7.174 29.065
136 HH12 ARG 15 HH12 ARG 15 -3.957 -6.554 30.241
137 HH21 ARG 15 HH21 ARG 15 -2.549 -9.705 31.085
138 HH22 ARG 15 HH22 ARG 15 -2.518 -8.001 31.394
139 H LYS 16 HN LYS 16 -8.936 -13.916 26.340
140 HA LYS 16 HA LYS 16 -10.994 -12.615 24.770
141 HB2 LYS 16 HB2 LYS 16 -9.473 -15.142 24.703
142 HB3 LYS 16 HB1 LYS 16 -11.207 -15.445 24.490
143 HG2 LYS 16 HG2 LYS 16 -10.258 -15.252 22.321
144 HG3 LYS 16 HG1 LYS 16 -11.241 -13.769 22.632
145 HD2 LYS 16 HD2 LYS 16 -9.111 -12.471 23.010
146 HD3 LYS 16 HD1 LYS 16 -8.149 -13.974 22.761
147 HE2 LYS 16 HE2 LYS 16 -8.986 -14.125 20.382
148 HE3 LYS 16 HE1 LYS 16 -9.988 -12.638 20.633
149 HZ1 LYS 16 HZ1 LYS 16 -8.229 -11.544 19.958
150 HZ2 LYS 16 HZ2 LYS 16 -7.217 -12.907 20.026
151 HZ3 LYS 16 HZ3 LYS 16 -7.448 -11.949 21.410
152 H LYS 17 HN LYS 17 -12.001 -11.854 26.443
153 HA LYS 17 HA LYS 17 -13.512 -13.657 28.218
154 HB2 LYS 17 HB2 LYS 17 -12.674 -10.691 28.529
155 HB3 LYS 17 HB1 LYS 17 -13.580 -11.652 29.760
156 HG2 LYS 17 HG2 LYS 17 -11.661 -12.978 30.323
157 HG3 LYS 17 HG1 LYS 17 -10.796 -12.614 28.789
158 HD2 LYS 17 HD2 LYS 17 -9.652 -11.355 30.481
159 HD3 LYS 17 HD1 LYS 17 -10.620 -10.162 29.561
160 HE2 LYS 17 HE2 LYS 17 -12.344 -10.091 31.421
161 HE3 LYS 17 HE1 LYS 17 -11.428 -11.362 32.330
162 HZ1 LYS 17 HZ1 LYS 17 -9.661 -9.295 31.676
163 HZ2 LYS 17 HZ2 LYS 17 -10.242 -9.764 33.202
164 HZ3 LYS 17 HZ3 LYS 17 -11.069 -8.582 32.306
Start of MODEL 19
1 H1 GLU 1 HT1 GLU 1 10.596 -18.019 12.138
2 H2 GLU 1 HT2 GLU 1 9.264 -17.290 12.900
3 H3 GLU 1 HT3 GLU 1 9.020 -18.555 11.793
4 HA GLU 1 HA GLU 1 8.851 -19.786 13.608
5 HB2 GLU 1 HB2 GLU 1 11.899 -19.417 13.252
6 HB3 GLU 1 HB1 GLU 1 11.241 -20.572 14.472
7 HG2 GLU 1 HG2 GLU 1 10.029 -21.836 12.646
8 HG3 GLU 1 HG1 GLU 1 10.687 -20.689 11.415
9 H MET 2 HN MET 2 7.959 -19.251 15.568
10 HA MET 2 HA MET 2 9.612 -17.725 17.475
11 HB2 MET 2 HB2 MET 2 6.943 -16.911 16.346
12 HB3 MET 2 HB1 MET 2 6.982 -17.052 18.144
13 HG2 MET 2 HG2 MET 2 7.411 -14.775 17.643
14 HG3 MET 2 HG1 MET 2 8.973 -15.477 18.163
15 HE1 MET 2 HE1 MET 2 10.181 -13.360 17.312
16 HE2 MET 2 HE2 MET 2 8.605 -12.673 16.786
17 HE3 MET 2 HE3 MET 2 10.013 -12.653 15.668
18 H ALA 3 HN ALA 3 9.452 -18.406 19.513
19 HA ALA 3 HA ALA 3 7.589 -20.507 19.979
20 HB1 ALA 3 HB1 ALA 3 8.862 -21.405 21.666
21 HB2 ALA 3 HB2 ALA 3 9.661 -19.808 21.958
22 HB3 ALA 3 HB3 ALA 3 10.109 -20.790 20.507
23 H LEU 4 HN LEU 4 7.385 -17.436 20.228
24 HA LEU 4 HA LEU 4 6.297 -17.534 22.875
25 HB2 LEU 4 HB2 LEU 4 5.328 -15.396 21.231
26 HB3 LEU 4 HB1 LEU 4 6.094 -15.298 22.845
27 HG LEU 4 HG LEU 4 7.539 -15.634 20.214
28 HD11 LEU 4 HD11 LEU 4 6.729 -13.077 21.685
29 HD12 LEU 4 HD12 LEU 4 6.245 -13.667 20.042
30 HD13 LEU 4 HD13 LEU 4 7.958 -13.128 20.346
31 HD21 LEU 4 HD21 LEU 4 9.121 -16.324 21.775
32 HD22 LEU 4 HD22 LEU 4 8.461 -15.273 23.099
33 HD23 LEU 4 HD23 LEU 4 9.475 -14.542 21.784
34 H SER 5 HN SER 5 5.703 -18.185 19.712
35 HA SER 5 HA SER 5 3.209 -17.165 19.499
36 HB2 SER 5 HB2 SER 5 4.685 -17.690 17.673
37 HB3 SER 5 HB1 SER 5 4.578 -19.449 18.062
38 HG SER 5 HG SER 5 3.211 -18.882 16.334
39 H LYS 6 HN LYS 6 4.497 -19.711 21.263
40 HA LYS 6 HA LYS 6 2.139 -21.420 21.438
41 HB2 LYS 6 HB2 LYS 6 5.006 -21.227 22.475
42 HB3 LYS 6 HB1 LYS 6 3.849 -22.295 23.365
43 HG2 LYS 6 HG2 LYS 6 4.617 -23.910 21.955
44 HG3 LYS 6 HG1 LYS 6 3.462 -23.197 20.788
45 HD2 LYS 6 HD2 LYS 6 5.303 -21.771 19.824
46 HD3 LYS 6 HD1 LYS 6 6.461 -22.475 21.008
47 HE2 LYS 6 HE2 LYS 6 6.031 -24.802 20.004
48 HE3 LYS 6 HE1 LYS 6 4.967 -24.027 18.761
49 HZ1 LYS 6 HZ1 LYS 6 7.260 -22.585 18.640
50 HZ2 LYS 6 HZ2 LYS 6 6.821 -23.863 17.611
51 HZ3 LYS 6 HZ3 LYS 6 7.831 -24.155 18.945
52 H PHE 7 HN PHE 7 4.173 -19.073 22.986
53 HA PHE 7 HA PHE 7 2.825 -19.116 25.449
54 HB2 PHE 7 HB2 PHE 7 4.600 -17.017 24.252
55 HB3 PHE 7 HB1 PHE 7 3.978 -16.964 25.941
56 HD1 PHE 7 HD1 PHE 7 6.831 -16.797 25.068
57 HD2 PHE 7 HD2 PHE 7 4.508 -20.176 26.278
58 HE1 PHE 7 HE1 PHE 7 8.798 -17.957 25.741
59 HE2 PHE 7 HE2 PHE 7 6.487 -21.282 26.920
60 HZ PHE 7 HZ PHE 7 8.693 -20.219 26.695
61 H PHE 8 HN PHE 8 2.464 -17.524 22.393
62 HA PHE 8 HA PHE 8 0.668 -15.619 23.117
63 HB2 PHE 8 HB2 PHE 8 1.509 -16.839 20.579
64 HB3 PHE 8 HB1 PHE 8 -0.164 -16.140 20.499
65 HD1 PHE 8 HD1 PHE 8 3.208 -15.287 20.149
66 HD2 PHE 8 HD2 PHE 8 -0.335 -14.181 21.958
67 HE1 PHE 8 HE1 PHE 8 4.198 -13.358 20.905
68 HE2 PHE 8 HE2 PHE 8 0.413 -12.226 22.716
69 HZ PHE 8 HZ PHE 8 2.793 -11.723 22.160
70 H ARG 9 HN ARG 9 -0.066 -18.873 22.396
71 HA ARG 9 HA ARG 9 -2.722 -18.266 22.352
72 HB2 ARG 9 HB2 ARG 9 -0.922 -20.574 22.244
73 HB3 ARG 9 HB1 ARG 9 -2.326 -20.991 23.272
74 HG2 ARG 9 HG2 ARG 9 -3.299 -21.645 21.329
75 HG3 ARG 9 HG1 ARG 9 -3.614 -19.905 21.068
76 HD2 ARG 9 HD2 ARG 9 -1.882 -19.672 19.449
77 HD3 ARG 9 HD1 ARG 9 -0.973 -21.143 20.043
78 HE ARG 9 HE ARG 9 -3.505 -22.089 19.273
79 HH11 ARG 9 HH11 ARG 9 -0.802 -20.384 17.584
80 HH12 ARG 9 HH12 ARG 9 -1.138 -21.102 16.045
81 HH21 ARG 9 HH21 ARG 9 -3.909 -23.029 17.158
82 HH22 ARG 9 HH22 ARG 9 -2.914 -22.613 15.803
83 H ASP 10 HN ASP 10 -0.466 -18.084 24.968
84 HA ASP 10 HA ASP 10 -2.636 -18.863 26.708
85 HB2 ASP 10 HB2 ASP 10 0.292 -18.435 27.514
86 HB3 ASP 10 HB1 ASP 10 -1.023 -18.852 28.670
87 H PHE 11 HN PHE 11 -0.921 -15.862 25.748
88 HA PHE 11 HA PHE 11 -1.818 -14.684 28.234
89 HB2 PHE 11 HB2 PHE 11 -1.046 -12.903 25.926
90 HB3 PHE 11 HB1 PHE 11 -0.783 -12.626 27.702
91 HD1 PHE 11 HD1 PHE 11 0.176 -13.985 24.644
92 HD2 PHE 11 HD2 PHE 11 1.340 -13.600 28.685
93 HE1 PHE 11 HE1 PHE 11 2.270 -14.581 24.034
94 HE2 PHE 11 HE2 PHE 11 3.612 -14.192 28.042
95 HZ PHE 11 HZ PHE 11 4.161 -14.624 25.685
96 H ILE 12 HN ILE 12 -2.366 -14.158 24.746
97 HA ILE 12 HA ILE 12 -4.182 -12.032 25.222
98 HB ILE 12 HB ILE 12 -4.487 -13.347 22.663
99 HG12 ILE 12 HG12 ILE 12 -1.924 -11.887 22.625
100 HG13 ILE 12 HG11 ILE 12 -1.838 -13.415 23.596
101 HG21 ILE 12 HG21 ILE 12 -5.482 -11.122 23.100
102 HG22 ILE 12 HG22 ILE 12 -4.230 -10.994 21.810
103 HG23 ILE 12 HG23 ILE 12 -3.855 -10.435 23.485
104 HD11 ILE 12 HD11 ILE 12 -3.470 -13.835 21.223
105 HD12 ILE 12 HD12 ILE 12 -2.043 -14.695 21.916
106 HD13 ILE 12 HD13 ILE 12 -1.788 -13.258 20.831
107 H LEU 13 HN LEU 13 -4.478 -15.460 24.955
108 HA LEU 13 HA LEU 13 -7.135 -15.286 24.153
109 HB2 LEU 13 HB2 LEU 13 -5.200 -17.495 24.718
110 HB3 LEU 13 HB1 LEU 13 -6.924 -17.862 24.314
111 HG LEU 13 HG LEU 13 -6.503 -16.197 22.323
112 HD11 LEU 13 HD11 LEU 13 -3.887 -16.657 21.578
113 HD12 LEU 13 HD12 LEU 13 -3.773 -16.330 23.364
114 HD13 LEU 13 HD13 LEU 13 -4.614 -15.184 22.285
115 HD21 LEU 13 HD21 LEU 13 -5.684 -18.069 20.807
116 HD22 LEU 13 HD22 LEU 13 -7.010 -18.583 21.918
117 HD23 LEU 13 HD23 LEU 13 -5.302 -19.036 22.285
118 H GLN 14 HN GLN 14 -5.513 -15.350 27.151
119 HA GLN 14 HA GLN 14 -7.879 -16.167 28.682
120 HB2 GLN 14 HB2 GLN 14 -5.222 -14.823 29.536
121 HB3 GLN 14 HB1 GLN 14 -6.574 -15.160 30.697
122 HG2 GLN 14 HG2 GLN 14 -6.401 -17.653 30.049
123 HG3 GLN 14 HG1 GLN 14 -4.939 -17.231 29.076
124 HE21 GLN 14 HE21 GLN 14 -3.059 -17.747 30.226
125 HE22 GLN 14 HE22 GLN 14 -2.824 -17.528 31.928
126 H ARG 15 HN ARG 15 -7.113 -13.567 26.732
127 HA ARG 15 HA ARG 15 -8.550 -11.617 28.275
128 HB2 ARG 15 HB2 ARG 15 -7.091 -11.382 25.629
129 HB3 ARG 15 HB1 ARG 15 -7.779 -10.005 26.604
130 HG2 ARG 15 HG2 ARG 15 -6.209 -11.500 28.432
131 HG3 ARG 15 HG1 ARG 15 -5.275 -11.520 26.910
132 HD2 ARG 15 HD2 ARG 15 -5.246 -9.060 26.787
133 HD3 ARG 15 HD1 ARG 15 -6.417 -8.952 28.204
134 HE ARG 15 HE ARG 15 -4.031 -10.423 28.999
135 HH11 ARG 15 HH11 ARG 15 -5.064 -7.052 28.192
136 HH12 ARG 15 HH12 ARG 15 -3.860 -6.306 29.190
137 HH21 ARG 15 HH21 ARG 15 -2.425 -9.351 30.333
138 HH22 ARG 15 HH22 ARG 15 -2.353 -7.622 30.413
139 H LYS 16 HN LYS 16 -9.441 -14.067 26.664
140 HA LYS 16 HA LYS 16 -11.506 -12.762 25.054
141 HB2 LYS 16 HB2 LYS 16 -10.796 -15.684 25.615
142 HB3 LYS 16 HB1 LYS 16 -12.180 -15.180 24.571
143 HG2 LYS 16 HG2 LYS 16 -10.706 -14.122 22.952
144 HG3 LYS 16 HG1 LYS 16 -9.282 -14.263 24.028
145 HD2 LYS 16 HD2 LYS 16 -8.959 -15.944 22.429
146 HD3 LYS 16 HD1 LYS 16 -9.525 -16.789 23.901
147 HE2 LYS 16 HE2 LYS 16 -11.827 -17.071 22.907
148 HE3 LYS 16 HE1 LYS 16 -11.342 -16.103 21.455
149 HZ1 LYS 16 HZ1 LYS 16 -9.783 -17.792 20.874
150 HZ2 LYS 16 HZ2 LYS 16 -11.299 -18.514 21.134
151 HZ3 LYS 16 HZ3 LYS 16 -10.076 -18.663 22.303
152 H LYS 17 HN LYS 17 -12.106 -11.694 26.866
153 HA LYS 17 HA LYS 17 -13.709 -13.150 28.859
154 HB2 LYS 17 HB2 LYS 17 -12.533 -10.293 28.933
155 HB3 LYS 17 HB1 LYS 17 -13.347 -11.145 30.298
156 HG2 LYS 17 HG2 LYS 17 -11.486 -12.595 30.679
157 HG3 LYS 17 HG1 LYS 17 -10.788 -12.371 29.033
158 HD2 LYS 17 HD2 LYS 17 -9.685 -10.416 29.597
159 HD3 LYS 17 HD1 LYS 17 -11.010 -9.804 30.639
160 HE2 LYS 17 HE2 LYS 17 -9.208 -12.130 31.610
161 HE3 LYS 17 HE1 LYS 17 -8.693 -10.404 31.773
162 HZ1 LYS 17 HZ1 LYS 17 -11.368 -11.212 32.712
163 HZ2 LYS 17 HZ2 LYS 17 -10.338 -9.979 33.263
164 HZ3 LYS 17 HZ3 LYS 17 -10.002 -11.599 33.643
Start of MODEL 20
1 H1 GLU 1 HT1 GLU 1 9.192 -18.655 11.725
2 H2 GLU 1 HT2 GLU 1 10.612 -17.904 12.278
3 H3 GLU 1 HT3 GLU 1 9.100 -17.392 12.857
4 HA GLU 1 HA GLU 1 8.853 -19.813 13.619
5 HB2 GLU 1 HB2 GLU 1 11.903 -19.450 13.265
6 HB3 GLU 1 HB1 GLU 1 11.241 -20.605 14.483
7 HG2 GLU 1 HG2 GLU 1 10.029 -21.866 12.657
8 HG3 GLU 1 HG1 GLU 1 10.687 -20.719 11.426
9 H MET 2 HN MET 2 7.958 -19.267 15.574
10 HA MET 2 HA MET 2 9.615 -17.748 17.485
11 HB2 MET 2 HB2 MET 2 6.954 -16.920 16.348
12 HB3 MET 2 HB1 MET 2 6.985 -17.064 18.146
13 HG2 MET 2 HG2 MET 2 7.428 -14.787 17.647
14 HG3 MET 2 HG1 MET 2 8.982 -15.499 18.177
15 HE1 MET 2 HE1 MET 2 10.218 -13.398 17.335
16 HE2 MET 2 HE2 MET 2 8.653 -12.692 16.803
17 HE3 MET 2 HE3 MET 2 10.065 -12.685 15.693
18 H ALA 3 HN ALA 3 9.448 -18.426 19.523
19 HA ALA 3 HA ALA 3 7.575 -20.519 19.985
20 HB1 ALA 3 HB1 ALA 3 10.093 -20.809 20.517
21 HB2 ALA 3 HB2 ALA 3 8.836 -21.421 21.678
22 HB3 ALA 3 HB3 ALA 3 9.648 -19.829 21.967
23 H LEU 4 HN LEU 4 7.383 -17.447 20.232
24 HA LEU 4 HA LEU 4 6.290 -17.541 22.878
25 HB2 LEU 4 HB2 LEU 4 5.333 -15.399 21.234
26 HB3 LEU 4 HB1 LEU 4 6.097 -15.304 22.848
27 HG LEU 4 HG LEU 4 7.545 -15.646 20.220
28 HD11 LEU 4 HD11 LEU 4 6.743 -13.084 21.686
29 HD12 LEU 4 HD12 LEU 4 6.259 -13.675 20.044
30 HD13 LEU 4 HD13 LEU 4 7.973 -13.143 20.349
31 HD21 LEU 4 HD21 LEU 4 9.121 -16.341 21.784
32 HD22 LEU 4 HD22 LEU 4 8.462 -15.288 23.106
33 HD23 LEU 4 HD23 LEU 4 9.482 -14.560 21.794
34 H SER 5 HN SER 5 5.698 -18.189 19.713
35 HA SER 5 HA SER 5 3.209 -17.155 19.498
36 HB2 SER 5 HB2 SER 5 4.686 -17.685 17.673
37 HB3 SER 5 HB1 SER 5 4.571 -19.443 18.059
38 HG SER 5 HG SER 5 3.208 -18.875 16.332
39 H LYS 6 HN LYS 6 4.481 -19.712 21.259
40 HA LYS 6 HA LYS 6 2.111 -21.409 21.430
41 HB2 LYS 6 HB2 LYS 6 4.978 -21.232 22.474
42 HB3 LYS 6 HB1 LYS 6 3.814 -22.299 23.357
43 HG2 LYS 6 HG2 LYS 6 4.570 -23.914 21.943
44 HG3 LYS 6 HG1 LYS 6 3.433 -23.183 20.769
45 HD2 LYS 6 HD2 LYS 6 5.290 -21.776 19.821
46 HD3 LYS 6 HD1 LYS 6 6.433 -22.477 21.021
47 HE2 LYS 6 HE2 LYS 6 6.016 -24.806 20.020
48 HE3 LYS 6 HE1 LYS 6 4.962 -24.037 18.763
49 HZ1 LYS 6 HZ1 LYS 6 6.927 -22.677 18.159
50 HZ2 LYS 6 HZ2 LYS 6 7.110 -24.344 17.889
51 HZ3 LYS 6 HZ3 LYS 6 7.869 -23.610 19.219
52 H PHE 7 HN PHE 7 4.155 -19.072 22.980
53 HA PHE 7 HA PHE 7 2.803 -19.111 25.440
54 HB2 PHE 7 HB2 PHE 7 4.598 -17.024 24.252
55 HB3 PHE 7 HB1 PHE 7 3.973 -16.971 25.940
56 HD1 PHE 7 HD1 PHE 7 6.830 -16.827 25.072
57 HD2 PHE 7 HD2 PHE 7 4.473 -20.188 26.269
58 HE1 PHE 7 HE1 PHE 7 8.786 -18.008 25.745
59 HE2 PHE 7 HE2 PHE 7 6.439 -21.315 26.911
60 HZ PHE 7 HZ PHE 7 8.656 -20.273 26.693
61 H PHE 8 HN PHE 8 2.458 -17.517 22.382
62 HA PHE 8 HA PHE 8 0.672 -15.600 23.107
63 HB2 PHE 8 HB2 PHE 8 1.508 -16.818 20.567
64 HB3 PHE 8 HB1 PHE 8 -0.162 -16.111 20.487
65 HD1 PHE 8 HD1 PHE 8 3.217 -15.274 20.150
66 HD2 PHE 8 HD2 PHE 8 -0.329 -14.154 21.946
67 HE1 PHE 8 HE1 PHE 8 4.213 -13.354 20.914
68 HE2 PHE 8 HE2 PHE 8 0.427 -12.206 22.717
69 HZ PHE 8 HZ PHE 8 2.813 -11.713 22.169
70 H ARG 9 HN ARG 9 -0.079 -18.848 22.377
71 HA ARG 9 HA ARG 9 -2.732 -18.223 22.335
72 HB2 ARG 9 HB2 ARG 9 -0.949 -20.543 22.215
73 HB3 ARG 9 HB1 ARG 9 -2.356 -20.954 23.241
74 HG2 ARG 9 HG2 ARG 9 -3.346 -21.585 21.300
75 HG3 ARG 9 HG1 ARG 9 -3.629 -19.839 21.036
76 HD2 ARG 9 HD2 ARG 9 -1.894 -19.641 19.419
77 HD3 ARG 9 HD1 ARG 9 -1.005 -21.120 20.022
78 HE ARG 9 HE ARG 9 -3.550 -22.033 19.245
79 HH11 ARG 9 HH11 ARG 9 -0.804 -20.388 17.567
80 HH12 ARG 9 HH12 ARG 9 -1.143 -21.106 16.028
81 HH21 ARG 9 HH21 ARG 9 -3.957 -22.975 17.131
82 HH22 ARG 9 HH22 ARG 9 -2.946 -22.584 15.781
83 H ASP 10 HN ASP 10 -0.471 -18.064 24.945
84 HA ASP 10 HA ASP 10 -2.634 -18.850 26.691
85 HB2 ASP 10 HB2 ASP 10 0.301 -18.426 27.481
86 HB3 ASP 10 HB1 ASP 10 -1.003 -18.870 28.635
87 H PHE 11 HN PHE 11 -0.912 -15.848 25.741
88 HA PHE 11 HA PHE 11 -1.789 -14.680 28.240
89 HB2 PHE 11 HB2 PHE 11 -1.020 -12.889 25.938
90 HB3 PHE 11 HB1 PHE 11 -0.748 -12.621 27.713
91 HD1 PHE 11 HD1 PHE 11 0.193 -13.970 24.645
92 HD2 PHE 11 HD2 PHE 11 1.376 -13.606 28.683
93 HE1 PHE 11 HE1 PHE 11 2.281 -14.571 24.025
94 HE2 PHE 11 HE2 PHE 11 3.644 -14.203 28.027
95 HZ PHE 11 HZ PHE 11 4.180 -14.628 25.667
96 H ILE 12 HN ILE 12 -2.350 -14.135 24.757
97 HA ILE 12 HA ILE 12 -4.158 -12.005 25.255
98 HB ILE 12 HB ILE 12 -4.473 -13.299 22.686
99 HG12 ILE 12 HG12 ILE 12 -1.905 -11.849 22.650
100 HG13 ILE 12 HG11 ILE 12 -1.820 -13.385 23.611
101 HG21 ILE 12 HG21 ILE 12 -5.457 -11.074 23.145
102 HG22 ILE 12 HG22 ILE 12 -4.209 -10.941 21.852
103 HG23 ILE 12 HG23 ILE 12 -3.826 -10.396 23.530
104 HD11 ILE 12 HD11 ILE 12 -3.463 -13.780 21.241
105 HD12 ILE 12 HD12 ILE 12 -2.039 -14.653 21.923
106 HD13 ILE 12 HD13 ILE 12 -1.779 -13.209 20.846
107 H LEU 13 HN LEU 13 -4.459 -15.432 24.967
108 HA LEU 13 HA LEU 13 -7.119 -15.245 24.173
109 HB2 LEU 13 HB2 LEU 13 -5.192 -17.467 24.704
110 HB3 LEU 13 HB1 LEU 13 -6.921 -17.821 24.310
111 HG LEU 13 HG LEU 13 -6.507 -16.136 22.334
112 HD11 LEU 13 HD11 LEU 13 -3.898 -16.607 21.566
113 HD12 LEU 13 HD12 LEU 13 -3.771 -16.293 23.353
114 HD13 LEU 13 HD13 LEU 13 -4.613 -15.135 22.288
115 HD21 LEU 13 HD21 LEU 13 -5.324 -18.981 22.255
116 HD22 LEU 13 HD22 LEU 13 -5.714 -17.997 20.791
117 HD23 LEU 13 HD23 LEU 13 -7.033 -18.515 21.909
118 H GLN 14 HN GLN 14 -5.493 -15.330 27.163
119 HA GLN 14 HA GLN 14 -7.847 -16.165 28.696
120 HB2 GLN 14 HB2 GLN 14 -5.197 -14.801 29.538
121 HB3 GLN 14 HB1 GLN 14 -6.544 -15.133 30.706
122 HG2 GLN 14 HG2 GLN 14 -6.368 -17.628 30.076
123 HG3 GLN 14 HG1 GLN 14 -4.913 -17.211 29.091
124 HE21 GLN 14 HE21 GLN 14 -3.035 -17.746 30.235
125 HE22 GLN 14 HE22 GLN 14 -2.783 -17.504 31.933
126 H ARG 15 HN ARG 15 -7.124 -13.560 26.742
127 HA ARG 15 HA ARG 15 -8.583 -11.617 28.285
128 HB2 ARG 15 HB2 ARG 15 -7.114 -11.360 25.644
129 HB3 ARG 15 HB1 ARG 15 -7.802 -9.995 26.639
130 HG2 ARG 15 HG2 ARG 15 -6.229 -11.503 28.450
131 HG3 ARG 15 HG1 ARG 15 -5.299 -11.523 26.927
132 HD2 ARG 15 HD2 ARG 15 -5.256 -9.060 26.816
133 HD3 ARG 15 HD1 ARG 15 -6.420 -8.956 28.240
134 HE ARG 15 HE ARG 15 -4.029 -10.446 29.000
135 HH11 ARG 15 HH11 ARG 15 -5.085 -7.066 28.269
136 HH12 ARG 15 HH12 ARG 15 -3.882 -6.333 29.276
137 HH21 ARG 15 HH21 ARG 15 -2.423 -9.392 30.348
138 HH22 ARG 15 HH22 ARG 15 -2.361 -7.665 30.464
139 H LYS 16 HN LYS 16 -9.436 -14.079 26.644
140 HA LYS 16 HA LYS 16 -11.514 -12.780 25.038
141 HB2 LYS 16 HB2 LYS 16 -10.730 -15.690 25.550
142 HB3 LYS 16 HB1 LYS 16 -12.166 -15.226 24.561
143 HG2 LYS 16 HG2 LYS 16 -10.821 -14.164 22.872
144 HG3 LYS 16 HG1 LYS 16 -9.356 -14.149 23.903
145 HD2 LYS 16 HD2 LYS 16 -8.928 -15.862 22.361
146 HD3 LYS 16 HD1 LYS 16 -9.404 -16.697 23.865
147 HE2 LYS 16 HE2 LYS 16 -10.474 -17.895 21.990
148 HE3 LYS 16 HE1 LYS 16 -11.796 -16.999 22.835
149 HZ1 LYS 16 HZ1 LYS 16 -12.234 -15.967 20.963
150 HZ2 LYS 16 HZ2 LYS 16 -11.051 -16.884 20.162
151 HZ3 LYS 16 HZ3 LYS 16 -10.649 -15.371 20.822
152 H LYS 17 HN LYS 17 -12.138 -11.740 26.848
153 HA LYS 17 HA LYS 17 -13.685 -13.237 28.860
154 HB2 LYS 17 HB2 LYS 17 -12.503 -10.378 28.900
155 HB3 LYS 17 HB1 LYS 17 -13.338 -11.191 30.278
156 HG2 LYS 17 HG2 LYS 17 -11.503 -12.681 30.681
157 HG3 LYS 17 HG1 LYS 17 -10.805 -12.490 29.034
158 HD2 LYS 17 HD2 LYS 17 -9.343 -11.294 30.511
159 HD3 LYS 17 HD1 LYS 17 -10.269 -10.045 29.621
160 HE2 LYS 17 HE2 LYS 17 -11.737 -9.660 31.652
161 HE3 LYS 17 HE1 LYS 17 -10.879 -10.987 32.538
162 HZ1 LYS 17 HZ1 LYS 17 -9.799 -9.159 33.265
163 HZ2 LYS 17 HZ2 LYS 17 -9.963 -8.291 31.815
164 HZ3 LYS 17 HZ3 LYS 17 -8.815 -9.535 31.934
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