Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
540710 | 2ls2 RC | 18408 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 LYS 1 H1 LYS 1 0.839 -23.623 -1.503
2 HA LYS 1 HA LYS 1 2.110 -21.714 -0.531
3 HB3 LYS 1 HB3 LYS 1 1.522 -20.342 -2.852
4 HG3 LYS 1 HG3 LYS 1 3.201 -22.882 -2.750
5 HD3 LYS 1 HD3 LYS 1 2.906 -21.356 -4.873
6 HE3 LYS 1 HE3 LYS 1 4.918 -19.710 -3.266
7 HZ1 LYS 1 HZ1 LYS 1 5.455 -19.393 -5.425
8 HZ2 LYS 1 HZ2 LYS 1 3.960 -19.710 -6.001
9 HZ3 LYS 1 HZ3 LYS 1 4.278 -18.267 -5.307
10 H ASN 2 H ASN 2 1.527 -20.411 1.144
11 HA ASN 2 HA ASN 2 -0.690 -18.602 0.581
12 HB3 ASN 2 HB3 ASN 2 -0.899 -18.541 3.180
13 HD21 ASN 2 HD22 ASN 2 -0.504 -21.828 1.952
14 HD22 ASN 2 HD21 ASN 2 -2.183 -22.220 1.789
15 H THR 3 H THR 3 1.178 -17.252 -0.337
16 HA THR 3 HA THR 3 2.257 -15.567 1.755
17 HB THR 3 HB THR 3 3.952 -17.321 -0.080
18 HG1 THR 3 HG1 THR 3 3.423 -18.049 2.095
19 HG21 THR 3 HG21 THR 3 4.760 -14.886 -0.129
20 HG22 THR 3 HG22 THR 3 4.914 -14.982 1.641
21 HG23 THR 3 HG23 THR 3 5.908 -16.032 0.603
22 H ALA 4 H ALA 4 0.709 -14.095 0.848
23 HA ALA 4 HA ALA 4 1.523 -13.130 -1.807
24 HB1 ALA 4 HB1 ALA 4 -0.718 -13.832 -1.985
25 HB2 ALA 4 HB2 ALA 4 -1.130 -13.239 -0.357
26 HB3 ALA 4 HB3 ALA 4 -0.855 -12.083 -1.682
27 H GLY 5 H GLY 5 0.883 -12.366 1.617
28 HA2 GLY 5 HA2 GLY 5 0.770 -9.653 1.664
29 HA3 GLY 5 HA3 GLY 5 1.596 -10.627 2.864
30 H GLU 6 H GLU 6 3.587 -11.719 0.886
31 HA GLU 6 HA GLU 6 5.580 -9.901 1.306
32 HB3 GLU 6 HB3 GLU 6 6.183 -11.415 -1.073
33 HG3 GLU 6 HG3 GLU 6 7.328 -12.833 0.931
34 HE2 GLU 6 HE2 GLU 6 8.407 -12.354 -1.137
35 H MET 7 H MET 7 2.999 -9.830 -1.012
36 HA MET 7 HA MET 7 4.489 -8.010 -2.712
37 HB3 MET 7 HB3 MET 7 2.051 -8.237 -3.920
38 HG3 MET 7 HG3 MET 7 4.052 -10.543 -3.972
39 HE1 MET 7 HE1 MET 7 4.665 -9.701 -6.863
40 HE2 MET 7 HE2 MET 7 4.277 -11.433 -6.996
41 HE3 MET 7 HE3 MET 7 3.455 -10.255 -8.046
42 H ALA 8 H ALA 8 1.021 -8.140 -1.625
43 HA ALA 8 HA ALA 8 0.598 -5.421 -1.791
44 HB1 ALA 8 HB1 ALA 8 -1.103 -6.283 0.216
45 HB2 ALA 8 HB2 ALA 8 -1.414 -6.421 -1.531
46 HB3 ALA 8 HB3 ALA 8 -0.715 -7.794 -0.641
47 H GLY 9 H GLY 9 2.453 -7.272 0.510
48 HA2 GLY 9 HA2 GLY 9 2.209 -5.567 2.759
49 HA3 GLY 9 HA3 GLY 9 3.473 -6.740 2.446
50 H ALA 10 H ALA 10 4.251 -5.568 -0.190
51 HA ALA 10 HA ALA 10 5.836 -3.380 0.897
52 HB1 ALA 10 HB1 ALA 10 7.009 -3.730 -1.392
53 HB2 ALA 10 HB2 ALA 10 7.177 -5.006 -0.163
54 HB3 ALA 10 HB3 ALA 10 6.027 -5.210 -1.507
55 H PHE 11 H PHE 11 3.041 -4.022 -1.081
56 HA PHE 11 HA PHE 11 3.260 -1.683 -2.688
57 HB3 PHE 11 HB3 PHE 11 0.889 -2.358 -3.248
58 HD1 PHE 11 HD2 PHE 11 4.057 -3.496 -3.400
59 HD2 PHE 11 HD1 PHE 11 0.112 -5.003 -3.817
60 HE1 PHE 11 HE2 PHE 11 4.920 -5.350 -4.853
61 HE2 PHE 11 HE1 PHE 11 0.975 -6.858 -5.271
62 HZ PHE 11 HZ PHE 11 3.368 -7.010 -5.772
63 H VAL 12 H VAL 12 1.675 -2.573 0.411
64 HA VAL 12 HA VAL 12 -0.067 -0.527 0.739
65 HB VAL 12 HB VAL 12 0.756 -0.722 3.226
66 HG11 VAL 12 HG11 VAL 12 -0.294 -3.293 2.083
67 HG12 VAL 12 HG12 VAL 12 -0.807 -2.395 3.532
68 HG13 VAL 12 HG13 VAL 12 -1.255 -1.805 1.913
69 HG21 VAL 12 HG21 VAL 12 2.245 -2.359 3.780
70 HG22 VAL 12 HG22 VAL 12 1.833 -3.369 2.373
71 HG23 VAL 12 HG23 VAL 12 2.891 -1.952 2.171
72 H ALA 13 H ALA 13 3.509 -0.456 0.996
73 HA ALA 13 HA ALA 13 3.594 2.183 2.040
74 HB1 ALA 13 HB1 ALA 13 5.943 1.943 1.838
75 HB2 ALA 13 HB2 ALA 13 5.352 0.297 2.171
76 HB3 ALA 13 HB3 ALA 13 5.795 0.765 0.512
77 H VAL 14 H VAL 14 4.290 0.767 -1.238
78 HA VAL 14 HA VAL 14 4.768 3.105 -2.562
79 HB VAL 14 HB VAL 14 3.353 0.610 -3.517
80 HG11 VAL 14 HG11 VAL 14 3.055 1.674 -5.458
81 HG12 VAL 14 HG12 VAL 14 3.952 3.099 -4.881
82 HG13 VAL 14 HG13 VAL 14 4.825 1.739 -5.626
83 HG21 VAL 14 HG21 VAL 14 5.963 0.941 -2.559
84 HG22 VAL 14 HG22 VAL 14 5.335 -0.425 -3.513
85 HG23 VAL 14 HG23 VAL 14 6.125 0.944 -4.333
86 H PHE 15 H PHE 15 1.780 1.943 -1.155
87 HA PHE 15 HA PHE 15 0.155 3.686 -2.786
88 HB3 PHE 15 HB3 PHE 15 -0.175 1.687 -0.502
89 HD1 PHE 15 HD2 PHE 15 -2.707 3.231 -2.737
90 HD2 PHE 15 HD1 PHE 15 -1.445 2.563 1.260
91 HE1 PHE 15 HE2 PHE 15 -4.875 4.173 -1.895
92 HE2 PHE 15 HE1 PHE 15 -3.615 3.504 2.102
93 HZ PHE 15 HZ PHE 15 -5.304 4.297 0.515
94 H LEU 16 H LEU 16 1.094 3.359 0.710
95 HA LEU 16 HA LEU 16 -0.212 5.713 1.498
96 HB3 LEU 16 HB3 LEU 16 2.082 4.200 2.752
97 HG LEU 16 HG LEU 16 1.821 6.439 3.781
98 HD11 LEU 16 HD11 LEU 16 -0.925 5.989 3.345
99 HD12 LEU 16 HD12 LEU 16 -0.698 6.019 5.111
100 HD13 LEU 16 HD13 LEU 16 -0.152 7.393 4.119
101 HD21 LEU 16 HD21 LEU 16 2.417 5.476 5.688
102 HD22 LEU 16 HD22 LEU 16 0.744 4.950 5.996
103 HD23 LEU 16 HD23 LEU 16 1.841 3.920 5.044
104 H LEU 17 H LEU 17 3.231 5.003 0.613
105 HA LEU 17 HA LEU 17 4.193 7.563 1.053
106 HB3 LEU 17 HB3 LEU 17 5.080 5.093 -0.112
107 HG LEU 17 HG LEU 17 5.176 6.497 -2.228
108 HD11 LEU 17 HD11 LEU 17 7.566 7.909 -1.174
109 HD12 LEU 17 HD12 LEU 17 6.374 8.409 -2.397
110 HD13 LEU 17 HD13 LEU 17 5.977 8.528 -0.665
111 HD21 LEU 17 HD21 LEU 17 6.602 4.816 -2.586
112 HD22 LEU 17 HD22 LEU 17 7.880 6.004 -2.234
113 HD23 LEU 17 HD23 LEU 17 7.293 4.922 -0.949
114 H ALA 18 H ALA 18 2.216 6.216 -1.555
115 HA ALA 18 HA ALA 18 2.749 8.323 -3.391
116 HB1 ALA 18 HB1 ALA 18 0.817 7.322 -4.604
117 HB2 ALA 18 HB2 ALA 18 2.020 6.101 -4.122
118 HB3 ALA 18 HB3 ALA 18 0.506 6.271 -3.201
119 H MET 19 H MET 19 0.307 7.638 -0.843
120 HA MET 19 HA MET 19 -1.178 9.971 -1.543
121 HB3 MET 19 HB3 MET 19 -1.813 8.976 1.105
122 HG3 MET 19 HG3 MET 19 -3.342 7.966 -1.263
123 HE1 MET 19 HE1 MET 19 -6.696 9.418 0.380
124 HE2 MET 19 HE2 MET 19 -5.622 10.187 -0.813
125 HE3 MET 19 HE3 MET 19 -6.067 8.473 -0.990
126 H PHE 20 H PHE 20 1.792 9.597 -0.131
127 HA PHE 20 HA PHE 20 1.380 11.490 2.024
128 HB3 PHE 20 HB3 PHE 20 3.822 10.035 0.842
129 HD1 PHE 20 HD1 PHE 20 4.791 12.500 1.162
130 HD2 PHE 20 HD2 PHE 20 3.688 9.893 4.323
131 HE1 PHE 20 HE1 PHE 20 6.296 13.760 2.726
132 HE2 PHE 20 HE2 PHE 20 5.193 11.152 5.887
133 HZ PHE 20 HZ PHE 20 6.479 13.071 5.070
134 H TYR 21 H TYR 21 2.424 11.373 -1.337
135 HA TYR 21 HA TYR 21 4.161 13.477 -1.503
136 HB3 TYR 21 HB3 TYR 21 2.778 13.726 -3.798
137 HD1 TYR 21 HD1 TYR 21 3.077 10.176 -2.729
138 HD2 TYR 21 HD2 TYR 21 4.915 13.435 -4.803
139 HE1 TYR 21 HE1 TYR 21 4.838 8.597 -3.663
140 HE2 TYR 21 HE2 TYR 21 6.671 11.846 -5.730
141 HH TYR 21 HH TYR 21 7.501 9.840 -5.649
142 H GLU 22 H GLU 22 0.630 13.794 -2.305
143 HA GLU 22 HA GLU 22 0.659 16.302 -0.858
144 HB3 GLU 22 HB3 GLU 22 -0.787 17.145 -2.958
145 HG3 GLU 22 HG3 GLU 22 2.267 17.015 -2.955
146 HE2 GLU 22 HE2 GLU 22 2.357 18.747 -5.728
147 H GLY 23 H GLY 23 -0.520 13.387 -0.822
148 HA2 GLY 23 HA2 GLY 23 -3.273 13.488 -1.264
149 HA3 GLY 23 HA3 GLY 23 -2.433 12.409 -0.168
150 H LEU 24 H LEU 24 -1.434 13.870 1.859
151 HA LEU 24 HA LEU 24 -3.486 14.355 3.530
152 HB3 LEU 24 HB3 LEU 24 -1.286 14.175 4.352
153 HG LEU 24 HG LEU 24 -0.275 15.569 2.322
154 HD11 LEU 24 HD11 LEU 24 -0.052 17.792 2.554
155 HD12 LEU 24 HD12 LEU 24 -1.458 17.636 3.634
156 HD13 LEU 24 HD13 LEU 24 0.186 17.694 4.315
157 HD21 LEU 24 HD21 LEU 24 1.710 15.124 3.271
158 HD22 LEU 24 HD22 LEU 24 1.313 16.003 4.768
159 HD23 LEU 24 HD23 LEU 24 0.730 14.338 4.532
160 H LYS 25 H LYS 25 -1.836 16.826 1.449
161 HA LYS 25 HA LYS 25 -3.201 19.037 2.202
162 HB3 LYS 25 HB3 LYS 25 -2.755 18.593 -0.724
163 HG3 LYS 25 HG3 LYS 25 -2.170 20.777 1.322
164 HD3 LYS 25 HD3 LYS 25 -1.644 21.907 -1.124
165 HE3 LYS 25 HE3 LYS 25 -0.264 21.872 1.079
166 HZ1 LYS 25 HZ1 LYS 25 1.732 20.286 0.363
167 HZ2 LYS 25 HZ2 LYS 25 0.571 19.851 1.425
168 HZ3 LYS 25 HZ3 LYS 25 0.465 19.382 -0.135
Start of MODEL 2
1 H1 LYS 1 H1 LYS 1 -1.282 -21.319 -3.161
2 HA LYS 1 HA LYS 1 -1.210 -19.114 -4.312
3 HB3 LYS 1 HB3 LYS 1 -2.033 -17.427 -2.257
4 HG3 LYS 1 HG3 LYS 1 -4.030 -17.068 -3.870
5 HD3 LYS 1 HD3 LYS 1 -1.118 -16.751 -4.409
6 HE3 LYS 1 HE3 LYS 1 -2.876 -15.895 -6.673
7 HZ1 LYS 1 HZ1 LYS 1 -0.397 -17.278 -7.062
8 HZ2 LYS 1 HZ2 LYS 1 -0.912 -15.864 -7.696
9 HZ3 LYS 1 HZ3 LYS 1 -0.271 -15.900 -6.194
10 H ASN 2 H ASN 2 -1.139 -18.414 -0.814
11 HA ASN 2 HA ASN 2 0.490 -18.401 0.644
12 HB3 ASN 2 HB3 ASN 2 2.500 -19.527 -1.350
13 HD21 ASN 2 HD22 ASN 2 3.092 -21.711 0.266
14 HD22 ASN 2 HD21 ASN 2 3.839 -21.178 1.735
15 H THR 3 H THR 3 2.464 -17.015 1.093
16 HA THR 3 HA THR 3 3.429 -15.006 0.862
17 HB THR 3 HB THR 3 5.026 -14.978 -1.096
18 HG1 THR 3 HG1 THR 3 4.550 -16.412 -2.769
19 HG21 THR 3 HG21 THR 3 4.653 -17.787 0.069
20 HG22 THR 3 HG22 THR 3 6.137 -17.149 -0.678
21 HG23 THR 3 HG23 THR 3 5.560 -16.482 0.867
22 H ALA 4 H ALA 4 1.210 -14.031 0.857
23 HA ALA 4 HA ALA 4 0.647 -12.835 -1.767
24 HB1 ALA 4 HB1 ALA 4 -1.558 -12.320 -0.237
25 HB2 ALA 4 HB2 ALA 4 -1.375 -13.760 -1.269
26 HB3 ALA 4 HB3 ALA 4 -1.015 -13.859 0.472
27 H GLY 5 H GLY 5 1.445 -12.293 1.655
28 HA2 GLY 5 HA2 GLY 5 0.934 -9.470 1.598
29 HA3 GLY 5 HA3 GLY 5 1.754 -10.389 2.846
30 H GLU 6 H GLU 6 3.673 -11.649 0.875
31 HA GLU 6 HA GLU 6 5.726 -9.868 1.170
32 HB3 GLU 6 HB3 GLU 6 6.502 -11.407 -1.010
33 HG3 GLU 6 HG3 GLU 6 6.726 -13.071 1.292
34 HE2 GLU 6 HE2 GLU 6 9.875 -10.798 0.737
35 H MET 7 H MET 7 3.102 -9.839 -1.096
36 HA MET 7 HA MET 7 4.610 -8.139 -2.905
37 HB3 MET 7 HB3 MET 7 2.230 -8.392 -4.148
38 HG3 MET 7 HG3 MET 7 3.492 -11.041 -4.238
39 HE1 MET 7 HE1 MET 7 4.656 -10.154 -8.027
40 HE2 MET 7 HE2 MET 7 5.537 -9.339 -6.713
41 HE3 MET 7 HE3 MET 7 5.128 -11.065 -6.573
42 H ALA 8 H ALA 8 1.167 -8.193 -1.724
43 HA ALA 8 HA ALA 8 0.752 -5.479 -2.050
44 HB1 ALA 8 HB1 ALA 8 -1.256 -6.474 -1.713
45 HB2 ALA 8 HB2 ALA 8 -0.551 -7.775 -0.723
46 HB3 ALA 8 HB3 ALA 8 -0.930 -6.200 0.016
47 H GLY 9 H GLY 9 2.662 -7.205 0.294
48 HA2 GLY 9 HA2 GLY 9 2.460 -5.490 2.507
49 HA3 GLY 9 HA3 GLY 9 3.799 -6.552 2.118
50 H ALA 10 H ALA 10 4.209 -5.250 -0.595
51 HA ALA 10 HA ALA 10 5.804 -3.040 0.406
52 HB1 ALA 10 HB1 ALA 10 6.460 -5.023 -1.248
53 HB2 ALA 10 HB2 ALA 10 5.768 -3.923 -2.465
54 HB3 ALA 10 HB3 ALA 10 7.132 -3.388 -1.456
55 H PHE 11 H PHE 11 2.759 -3.677 -1.150
56 HA PHE 11 HA PHE 11 2.619 -1.248 -2.614
57 HB3 PHE 11 HB3 PHE 11 0.822 -3.516 -1.691
58 HD1 PHE 11 HD2 PHE 11 0.199 -0.706 -4.057
59 HD2 PHE 11 HD1 PHE 11 -1.199 -2.917 -0.716
60 HE1 PHE 11 HE2 PHE 11 -1.973 0.549 -4.137
61 HE2 PHE 11 HE1 PHE 11 -3.371 -1.662 -0.796
62 HZ PHE 11 HZ PHE 11 -3.733 0.055 -2.505
63 H VAL 12 H VAL 12 1.410 -2.392 0.597
64 HA VAL 12 HA VAL 12 -0.205 -0.382 1.335
65 HB VAL 12 HB VAL 12 1.023 -0.739 3.653
66 HG11 VAL 12 HG11 VAL 12 -1.238 -1.556 2.934
67 HG12 VAL 12 HG12 VAL 12 -0.451 -3.023 2.303
68 HG13 VAL 12 HG13 VAL 12 -0.381 -2.654 4.043
69 HG21 VAL 12 HG21 VAL 12 2.955 -1.877 2.308
70 HG22 VAL 12 HG22 VAL 12 2.414 -2.588 3.848
71 HG23 VAL 12 HG23 VAL 12 1.874 -3.291 2.303
72 H ALA 13 H ALA 13 3.378 -0.294 1.110
73 HA ALA 13 HA ALA 13 3.499 2.354 2.212
74 HB1 ALA 13 HB1 ALA 13 5.678 0.926 0.669
75 HB2 ALA 13 HB2 ALA 13 5.837 2.101 1.996
76 HB3 ALA 13 HB3 ALA 13 5.258 0.452 2.332
77 H VAL 14 H VAL 14 3.962 0.821 -1.047
78 HA VAL 14 HA VAL 14 4.462 3.150 -2.439
79 HB VAL 14 HB VAL 14 3.099 0.581 -3.263
80 HG11 VAL 14 HG11 VAL 14 2.624 1.555 -5.214
81 HG12 VAL 14 HG12 VAL 14 3.460 3.051 -4.736
82 HG13 VAL 14 HG13 VAL 14 4.374 1.723 -5.492
83 HG21 VAL 14 HG21 VAL 14 5.141 -0.334 -3.505
84 HG22 VAL 14 HG22 VAL 14 5.839 1.157 -4.180
85 HG23 VAL 14 HG23 VAL 14 5.681 0.967 -2.417
86 H PHE 15 H PHE 15 1.568 2.081 -0.842
87 HA PHE 15 HA PHE 15 -0.122 3.757 -2.502
88 HB3 PHE 15 HB3 PHE 15 -0.392 1.731 -0.240
89 HD1 PHE 15 HD2 PHE 15 -3.146 2.970 -2.324
90 HD2 PHE 15 HD1 PHE 15 -1.449 2.931 1.565
91 HE1 PHE 15 HE2 PHE 15 -5.281 3.897 -1.384
92 HE2 PHE 15 HE1 PHE 15 -3.583 3.858 2.505
93 HZ PHE 15 HZ PHE 15 -5.473 4.329 1.020
94 H LEU 16 H LEU 16 1.254 3.568 0.818
95 HA LEU 16 HA LEU 16 -0.183 5.873 1.701
96 HB3 LEU 16 HB3 LEU 16 1.655 3.880 2.806
97 HG LEU 16 HG LEU 16 2.885 6.104 3.232
98 HD11 LEU 16 HD11 LEU 16 0.612 7.253 3.730
99 HD12 LEU 16 HD12 LEU 16 0.803 6.551 5.355
100 HD13 LEU 16 HD13 LEU 16 2.034 7.667 4.718
101 HD21 LEU 16 HD21 LEU 16 2.871 3.815 4.566
102 HD22 LEU 16 HD22 LEU 16 3.745 5.247 5.163
103 HD23 LEU 16 HD23 LEU 16 2.148 4.837 5.832
104 H LEU 17 H LEU 17 3.187 5.146 0.607
105 HA LEU 17 HA LEU 17 4.191 7.705 1.026
106 HB3 LEU 17 HB3 LEU 17 5.012 5.228 -0.178
107 HG LEU 17 HG LEU 17 5.072 6.482 -2.312
108 HD11 LEU 17 HD11 LEU 17 5.983 8.609 -0.644
109 HD12 LEU 17 HD12 LEU 17 7.252 8.246 -1.837
110 HD13 LEU 17 HD13 LEU 17 5.602 8.632 -2.381
111 HD21 LEU 17 HD21 LEU 17 7.216 5.789 -2.943
112 HD22 LEU 17 HD22 LEU 17 7.899 6.114 -1.331
113 HD23 LEU 17 HD23 LEU 17 6.798 4.736 -1.570
114 H ALA 18 H ALA 18 2.066 6.369 -1.460
115 HA ALA 18 HA ALA 18 2.528 8.482 -3.323
116 HB1 ALA 18 HB1 ALA 18 0.182 6.556 -3.139
117 HB2 ALA 18 HB2 ALA 18 0.763 7.426 -4.579
118 HB3 ALA 18 HB3 ALA 18 1.753 6.132 -3.861
119 H MET 19 H MET 19 0.198 7.749 -0.687
120 HA MET 19 HA MET 19 -1.305 10.107 -1.311
121 HB3 MET 19 HB3 MET 19 -1.949 8.997 1.288
122 HG3 MET 19 HG3 MET 19 -3.791 7.931 -0.512
123 HE1 MET 19 HE1 MET 19 -5.977 8.296 0.930
124 HE2 MET 19 HE2 MET 19 -4.524 7.949 1.898
125 HE3 MET 19 HE3 MET 19 -5.672 9.200 2.433
126 H PHE 20 H PHE 20 1.662 9.640 0.077
127 HA PHE 20 HA PHE 20 1.253 11.490 2.283
128 HB3 PHE 20 HB3 PHE 20 3.673 9.943 1.172
129 HD1 PHE 20 HD1 PHE 20 4.726 12.360 1.596
130 HD2 PHE 20 HD2 PHE 20 3.382 9.724 4.638
131 HE1 PHE 20 HE1 PHE 20 6.212 13.517 3.255
132 HE2 PHE 20 HE2 PHE 20 4.867 10.881 6.298
133 HZ PHE 20 HZ PHE 20 6.265 12.764 5.587
134 H TYR 21 H TYR 21 3.313 11.135 -0.692
135 HA TYR 21 HA TYR 21 4.410 13.721 -0.483
136 HB3 TYR 21 HB3 TYR 21 4.978 11.463 -1.842
137 HD1 TYR 21 HD1 TYR 21 2.864 10.336 -2.663
138 HD2 TYR 21 HD2 TYR 21 4.513 13.792 -4.572
139 HE1 TYR 21 HE1 TYR 21 1.509 9.836 -4.755
140 HE2 TYR 21 HE2 TYR 21 3.151 13.281 -6.658
141 HH TYR 21 HH TYR 21 1.037 10.423 -6.773
142 H GLU 22 H GLU 22 1.558 12.358 -2.218
143 HA GLU 22 HA GLU 22 1.059 14.733 -3.627
144 HB3 GLU 22 HB3 GLU 22 -1.377 13.310 -3.399
145 HG3 GLU 22 HG3 GLU 22 -0.011 12.229 -5.602
146 HE2 GLU 22 HE2 GLU 22 -1.970 12.751 -7.175
147 H GLY 23 H GLY 23 -0.280 13.270 -0.598
148 HA2 GLY 23 HA2 GLY 23 -2.318 14.913 0.038
149 HA3 GLY 23 HA3 GLY 23 -1.174 14.293 1.212
150 H LEU 24 H LEU 24 1.172 15.594 0.833
151 HA LEU 24 HA LEU 24 0.926 17.966 2.059
152 HB3 LEU 24 HB3 LEU 24 3.117 18.428 0.519
153 HG LEU 24 HG LEU 24 2.724 17.623 3.129
154 HD11 LEU 24 HD11 LEU 24 3.208 15.479 3.404
155 HD12 LEU 24 HD12 LEU 24 3.530 15.295 1.664
156 HD13 LEU 24 HD13 LEU 24 4.841 15.781 2.766
157 HD21 LEU 24 HD21 LEU 24 5.498 17.766 1.991
158 HD22 LEU 24 HD22 LEU 24 4.437 19.194 1.946
159 HD23 LEU 24 HD23 LEU 24 4.850 18.441 3.505
160 H LYS 25 H LYS 25 0.873 20.204 1.458
161 HA LYS 25 HA LYS 25 -0.252 21.824 0.402
162 HB3 LYS 25 HB3 LYS 25 2.057 21.801 -0.558
163 HG3 LYS 25 HG3 LYS 25 1.720 21.194 -3.206
164 HD3 LYS 25 HD3 LYS 25 2.944 19.867 -0.860
165 HE3 LYS 25 HE3 LYS 25 1.657 18.232 -2.949
166 HZ1 LYS 25 HZ1 LYS 25 3.435 17.127 -3.705
167 HZ2 LYS 25 HZ2 LYS 25 4.203 18.551 -3.476
168 HZ3 LYS 25 HZ3 LYS 25 4.339 17.361 -2.365
Start of MODEL 3
1 H1 LYS 1 H1 LYS 1 -2.706 -19.501 1.973
2 HA LYS 1 HA LYS 1 -2.510 -17.274 0.070
3 HB3 LYS 1 HB3 LYS 1 -1.740 -17.040 2.961
4 HG3 LYS 1 HG3 LYS 1 -2.981 -15.185 0.874
5 HD3 LYS 1 HD3 LYS 1 -1.838 -13.965 3.291
6 HE3 LYS 1 HE3 LYS 1 -4.441 -13.816 1.728
7 HZ1 LYS 1 HZ1 LYS 1 -4.428 -11.780 3.478
8 HZ2 LYS 1 HZ2 LYS 1 -5.363 -13.114 3.597
9 HZ3 LYS 1 HZ3 LYS 1 -3.952 -13.030 4.415
10 H ASN 2 H ASN 2 -0.856 -18.031 -1.267
11 HA ASN 2 HA ASN 2 1.558 -18.883 0.086
12 HB3 ASN 2 HB3 ASN 2 0.864 -20.350 -1.732
13 HD21 ASN 2 HD22 ASN 2 -1.232 -19.561 -2.365
14 HD22 ASN 2 HD21 ASN 2 -1.448 -18.750 -3.880
15 H THR 3 H THR 3 2.894 -17.128 0.594
16 HA THR 3 HA THR 3 3.728 -15.031 0.485
17 HB THR 3 HB THR 3 5.445 -14.986 -1.188
18 HG1 THR 3 HG1 THR 3 3.670 -16.773 -2.689
19 HG21 THR 3 HG21 THR 3 5.050 -17.849 -1.724
20 HG22 THR 3 HG22 THR 3 6.355 -17.053 -0.810
21 HG23 THR 3 HG23 THR 3 4.832 -17.483 0.004
22 H ALA 4 H ALA 4 1.398 -14.210 0.541
23 HA ALA 4 HA ALA 4 0.792 -12.842 -1.985
24 HB1 ALA 4 HB1 ALA 4 -1.414 -13.153 -1.517
25 HB2 ALA 4 HB2 ALA 4 -0.809 -14.447 -0.454
26 HB3 ALA 4 HB3 ALA 4 -1.192 -12.845 0.223
27 H GLY 5 H GLY 5 1.527 -12.485 1.488
28 HA2 GLY 5 HA2 GLY 5 0.948 -9.681 1.584
29 HA3 GLY 5 HA3 GLY 5 1.777 -10.648 2.787
30 H GLU 6 H GLU 6 3.799 -11.744 0.883
31 HA GLU 6 HA GLU 6 5.756 -9.872 1.263
32 HB3 GLU 6 HB3 GLU 6 6.484 -11.446 -1.012
33 HG3 GLU 6 HG3 GLU 6 6.948 -12.308 1.853
34 HE2 GLU 6 HE2 GLU 6 10.011 -11.741 -0.227
35 H MET 7 H MET 7 3.209 -9.941 -1.090
36 HA MET 7 HA MET 7 4.696 -8.178 -2.851
37 HB3 MET 7 HB3 MET 7 2.364 -8.486 -4.151
38 HG3 MET 7 HG3 MET 7 4.539 -10.589 -3.800
39 HE1 MET 7 HE1 MET 7 4.545 -12.157 -6.701
40 HE2 MET 7 HE2 MET 7 4.848 -12.455 -4.972
41 HE3 MET 7 HE3 MET 7 3.639 -13.427 -5.843
42 H ALA 8 H ALA 8 1.220 -8.314 -1.793
43 HA ALA 8 HA ALA 8 0.764 -5.608 -2.088
44 HB1 ALA 8 HB1 ALA 8 -1.237 -6.637 -1.828
45 HB2 ALA 8 HB2 ALA 8 -0.538 -7.948 -0.846
46 HB3 ALA 8 HB3 ALA 8 -0.968 -6.396 -0.085
47 H GLY 9 H GLY 9 2.601 -7.339 0.319
48 HA2 GLY 9 HA2 GLY 9 2.295 -5.629 2.526
49 HA3 GLY 9 HA3 GLY 9 3.651 -6.691 2.198
50 H ALA 10 H ALA 10 4.193 -5.393 -0.489
51 HA ALA 10 HA ALA 10 5.738 -3.183 0.583
52 HB1 ALA 10 HB1 ALA 10 7.017 -4.664 -0.746
53 HB2 ALA 10 HB2 ALA 10 5.742 -4.797 -1.980
54 HB3 ALA 10 HB3 ALA 10 6.679 -3.291 -1.827
55 H PHE 11 H PHE 11 2.767 -3.815 -1.113
56 HA PHE 11 HA PHE 11 2.692 -1.385 -2.577
57 HB3 PHE 11 HB3 PHE 11 0.852 -3.647 -1.726
58 HD1 PHE 11 HD2 PHE 11 0.465 -0.575 -3.829
59 HD2 PHE 11 HD1 PHE 11 -1.337 -3.303 -1.123
60 HE1 PHE 11 HE2 PHE 11 -1.699 0.686 -3.998
61 HE2 PHE 11 HE1 PHE 11 -3.500 -2.041 -1.292
62 HZ PHE 11 HZ PHE 11 -3.655 -0.062 -2.728
63 H VAL 12 H VAL 12 1.315 -2.527 0.571
64 HA VAL 12 HA VAL 12 -0.308 -0.505 1.241
65 HB VAL 12 HB VAL 12 0.821 -0.869 3.609
66 HG11 VAL 12 HG11 VAL 12 -0.377 -3.288 3.436
67 HG12 VAL 12 HG12 VAL 12 -1.269 -1.752 3.548
68 HG13 VAL 12 HG13 VAL 12 -1.018 -2.521 1.963
69 HG21 VAL 12 HG21 VAL 12 2.214 -2.693 3.860
70 HG22 VAL 12 HG22 VAL 12 1.677 -3.451 2.342
71 HG23 VAL 12 HG23 VAL 12 2.775 -2.052 2.297
72 H ALA 13 H ALA 13 3.292 -0.452 1.270
73 HA ALA 13 HA ALA 13 3.371 2.198 2.344
74 HB1 ALA 13 HB1 ALA 13 5.595 0.712 0.913
75 HB2 ALA 13 HB2 ALA 13 5.730 1.945 2.190
76 HB3 ALA 13 HB3 ALA 13 5.114 0.322 2.582
77 H VAL 14 H VAL 14 4.043 0.685 -0.890
78 HA VAL 14 HA VAL 14 4.616 2.995 -2.255
79 HB VAL 14 HB VAL 14 3.232 0.457 -3.134
80 HG11 VAL 14 HG11 VAL 14 3.669 2.921 -4.592
81 HG12 VAL 14 HG12 VAL 14 4.598 1.589 -5.319
82 HG13 VAL 14 HG13 VAL 14 2.838 1.432 -5.103
83 HG21 VAL 14 HG21 VAL 14 5.784 0.785 -2.200
84 HG22 VAL 14 HG22 VAL 14 5.270 -0.488 -3.332
85 HG23 VAL 14 HG23 VAL 14 6.015 1.005 -3.952
86 H PHE 15 H PHE 15 1.606 1.947 -0.836
87 HA PHE 15 HA PHE 15 0.013 3.631 -2.557
88 HB3 PHE 15 HB3 PHE 15 -0.419 1.868 -0.081
89 HD1 PHE 15 HD2 PHE 15 -2.767 2.837 -2.774
90 HD2 PHE 15 HD1 PHE 15 -1.863 3.049 1.367
91 HE1 PHE 15 HE2 PHE 15 -5.043 3.797 -2.327
92 HE2 PHE 15 HE1 PHE 15 -4.138 4.009 1.815
93 HZ PHE 15 HZ PHE 15 -5.701 4.371 -0.038
94 H LEU 16 H LEU 16 0.993 3.477 0.937
95 HA LEU 16 HA LEU 16 -0.290 5.898 1.596
96 HB3 LEU 16 HB3 LEU 16 1.946 4.395 2.964
97 HG LEU 16 HG LEU 16 1.711 6.686 3.877
98 HD11 LEU 16 HD11 LEU 16 -0.250 7.693 4.121
99 HD12 LEU 16 HD12 LEU 16 -1.038 6.262 3.415
100 HD13 LEU 16 HD13 LEU 16 -0.838 6.388 5.178
101 HD21 LEU 16 HD21 LEU 16 2.280 5.773 5.814
102 HD22 LEU 16 HD22 LEU 16 0.580 5.374 6.156
103 HD23 LEU 16 HD23 LEU 16 1.605 4.218 5.271
104 H LEU 17 H LEU 17 3.147 5.045 0.822
105 HA LEU 17 HA LEU 17 4.173 7.597 1.134
106 HB3 LEU 17 HB3 LEU 17 5.011 5.042 0.128
107 HG LEU 17 HG LEU 17 5.184 6.323 -2.061
108 HD11 LEU 17 HD11 LEU 17 6.017 8.414 -0.600
109 HD12 LEU 17 HD12 LEU 17 7.597 7.721 -1.038
110 HD13 LEU 17 HD13 LEU 17 6.445 8.186 -2.313
111 HD21 LEU 17 HD21 LEU 17 6.527 4.519 -2.204
112 HD22 LEU 17 HD22 LEU 17 7.822 5.735 -2.098
113 HD23 LEU 17 HD23 LEU 17 7.318 4.842 -0.643
114 H ALA 18 H ALA 18 2.204 6.162 -1.430
115 HA ALA 18 HA ALA 18 2.833 8.146 -3.372
116 HB1 ALA 18 HB1 ALA 18 0.828 7.143 -4.523
117 HB2 ALA 18 HB2 ALA 18 2.065 5.952 -4.054
118 HB3 ALA 18 HB3 ALA 18 0.580 6.119 -3.089
119 H MET 19 H MET 19 0.327 7.676 -0.836
120 HA MET 19 HA MET 19 -1.076 10.008 -1.694
121 HB3 MET 19 HB3 MET 19 -1.788 9.180 0.991
122 HG3 MET 19 HG3 MET 19 -3.411 7.988 -1.146
123 HE1 MET 19 HE1 MET 19 -4.788 11.696 1.141
124 HE2 MET 19 HE2 MET 19 -3.074 11.458 0.729
125 HE3 MET 19 HE3 MET 19 -4.291 11.573 -0.563
126 H PHE 20 H PHE 20 1.855 9.627 -0.204
127 HA PHE 20 HA PHE 20 1.461 11.650 1.832
128 HB3 PHE 20 HB3 PHE 20 3.880 10.062 0.781
129 HD1 PHE 20 HD1 PHE 20 4.915 12.514 0.983
130 HD2 PHE 20 HD2 PHE 20 3.680 10.119 4.262
131 HE1 PHE 20 HE1 PHE 20 6.428 13.815 2.504
132 HE2 PHE 20 HE2 PHE 20 5.193 11.421 5.783
133 HZ PHE 20 HZ PHE 20 6.549 13.254 4.886
134 H TYR 21 H TYR 21 2.560 11.317 -1.497
135 HA TYR 21 HA TYR 21 4.360 13.359 -1.743
136 HB3 TYR 21 HB3 TYR 21 3.028 13.515 -4.076
137 HD1 TYR 21 HD1 TYR 21 3.202 10.023 -2.807
138 HD2 TYR 21 HD2 TYR 21 5.178 13.108 -5.017
139 HE1 TYR 21 HE1 TYR 21 4.935 8.346 -3.613
140 HE2 TYR 21 HE2 TYR 21 6.904 11.421 -5.815
141 HH TYR 21 HH TYR 21 7.775 9.073 -4.699
142 H GLU 22 H GLU 22 0.752 13.602 -2.160
143 HA GLU 22 HA GLU 22 0.806 16.355 -2.499
144 HB3 GLU 22 HB3 GLU 22 -1.699 15.481 -1.325
145 HG3 GLU 22 HG3 GLU 22 -0.633 16.567 -3.888
146 HE2 GLU 22 HE2 GLU 22 -2.841 16.033 -6.028
147 H GLY 23 H GLY 23 0.916 14.292 0.363
148 HA2 GLY 23 HA2 GLY 23 -0.115 15.819 2.366
149 HA3 GLY 23 HA3 GLY 23 1.310 14.810 2.522
150 H LEU 24 H LEU 24 2.892 16.360 0.495
151 HA LEU 24 HA LEU 24 4.130 18.134 2.229
152 HB3 LEU 24 HB3 LEU 24 4.633 18.900 -0.464
153 HG LEU 24 HG LEU 24 6.141 17.175 1.506
154 HD11 LEU 24 HD11 LEU 24 6.786 16.260 -0.579
155 HD12 LEU 24 HD12 LEU 24 6.880 17.866 -1.342
156 HD13 LEU 24 HD13 LEU 24 8.076 17.394 -0.111
157 HD21 LEU 24 HD21 LEU 24 6.178 19.438 2.167
158 HD22 LEU 24 HD22 LEU 24 7.737 19.147 1.360
159 HD23 LEU 24 HD23 LEU 24 6.437 20.008 0.501
160 H LYS 25 H LYS 25 4.489 20.524 0.687
161 HA LYS 25 HA LYS 25 2.683 22.196 1.746
162 HB3 LYS 25 HB3 LYS 25 4.599 23.103 0.726
163 HG3 LYS 25 HG3 LYS 25 4.202 21.149 -1.254
164 HD3 LYS 25 HD3 LYS 25 4.559 23.064 -3.211
165 HE3 LYS 25 HE3 LYS 25 2.149 22.537 -3.853
166 HZ1 LYS 25 HZ1 LYS 25 2.613 20.045 -3.732
167 HZ2 LYS 25 HZ2 LYS 25 3.629 20.979 -4.604
168 HZ3 LYS 25 HZ3 LYS 25 4.065 20.467 -3.117
Start of MODEL 4
1 H1 LYS 1 H1 LYS 1 -3.320 -17.678 -0.310
2 HA LYS 1 HA LYS 1 -2.007 -18.313 -2.003
3 HB3 LYS 1 HB3 LYS 1 -0.870 -15.930 -3.066
4 HG3 LYS 1 HG3 LYS 1 -1.969 -18.262 -4.004
5 HD3 LYS 1 HD3 LYS 1 -3.957 -16.022 -4.618
6 HE3 LYS 1 HE3 LYS 1 -4.852 -18.595 -5.495
7 HZ1 LYS 1 HZ1 LYS 1 -3.782 -16.676 -7.368
8 HZ2 LYS 1 HZ2 LYS 1 -5.233 -17.426 -7.359
9 HZ3 LYS 1 HZ3 LYS 1 -4.970 -16.145 -6.381
10 H ASN 2 H ASN 2 0.188 -18.922 -2.039
11 HA ASN 2 HA ASN 2 1.556 -18.802 0.232
12 HB3 ASN 2 HB3 ASN 2 2.286 -20.257 -1.576
13 HD21 ASN 2 HD22 ASN 2 4.694 -18.762 -2.961
14 HD22 ASN 2 HD21 ASN 2 4.028 -18.243 -4.472
15 H THR 3 H THR 3 2.553 -17.144 1.392
16 HA THR 3 HA THR 3 3.105 -15.003 1.853
17 HB THR 3 HB THR 3 5.344 -14.610 1.084
18 HG1 THR 3 HG1 THR 3 4.595 -16.305 -1.187
19 HG21 THR 3 HG21 THR 3 5.225 -16.880 2.126
20 HG22 THR 3 HG22 THR 3 4.784 -17.575 0.547
21 HG23 THR 3 HG23 THR 3 6.396 -16.861 0.784
22 H ALA 4 H ALA 4 0.826 -14.504 0.851
23 HA ALA 4 HA ALA 4 0.894 -13.137 -1.650
24 HB1 ALA 4 HB1 ALA 4 -1.230 -13.883 -1.321
25 HB2 ALA 4 HB2 ALA 4 -1.070 -13.862 0.452
26 HB3 ALA 4 HB3 ALA 4 -1.428 -12.356 -0.428
27 H GLY 5 H GLY 5 1.249 -12.296 1.800
28 HA2 GLY 5 HA2 GLY 5 0.915 -9.495 1.494
29 HA3 GLY 5 HA3 GLY 5 1.659 -10.339 2.838
30 H GLU 6 H GLU 6 3.561 -11.758 0.850
31 HA GLU 6 HA GLU 6 5.690 -10.060 1.196
32 HB3 GLU 6 HB3 GLU 6 6.407 -11.677 -0.971
33 HG3 GLU 6 HG3 GLU 6 6.340 -12.768 1.853
34 HE2 GLU 6 HE2 GLU 6 9.083 -13.564 1.934
35 H MET 7 H MET 7 3.101 -9.911 -1.084
36 HA MET 7 HA MET 7 4.719 -8.291 -2.879
37 HB3 MET 7 HB3 MET 7 2.375 -8.514 -4.203
38 HG3 MET 7 HG3 MET 7 4.099 -11.010 -3.932
39 HE1 MET 7 HE1 MET 7 1.627 -12.437 -5.191
40 HE2 MET 7 HE2 MET 7 2.695 -12.882 -6.545
41 HE3 MET 7 HE3 MET 7 3.368 -12.672 -4.910
42 H ALA 8 H ALA 8 1.278 -8.307 -1.677
43 HA ALA 8 HA ALA 8 0.905 -5.574 -2.084
44 HB1 ALA 8 HB1 ALA 8 -0.489 -7.848 -0.827
45 HB2 ALA 8 HB2 ALA 8 -0.855 -6.280 -0.070
46 HB3 ALA 8 HB3 ALA 8 -1.136 -6.514 -1.811
47 H GLY 9 H GLY 9 2.780 -7.293 0.256
48 HA2 GLY 9 HA2 GLY 9 2.510 -5.635 2.507
49 HA3 GLY 9 HA3 GLY 9 3.876 -6.661 2.113
50 H ALA 10 H ALA 10 4.311 -5.300 -0.559
51 HA ALA 10 HA ALA 10 5.830 -3.069 0.515
52 HB1 ALA 10 HB1 ALA 10 6.580 -3.157 -2.042
53 HB2 ALA 10 HB2 ALA 10 7.208 -4.324 -0.853
54 HB3 ALA 10 HB3 ALA 10 5.882 -4.791 -1.945
55 H PHE 11 H PHE 11 2.838 -3.754 -1.121
56 HA PHE 11 HA PHE 11 2.670 -1.319 -2.565
57 HB3 PHE 11 HB3 PHE 11 0.897 -3.620 -1.672
58 HD1 PHE 11 HD2 PHE 11 0.287 -0.788 -4.019
59 HD2 PHE 11 HD1 PHE 11 -1.165 -3.086 -0.761
60 HE1 PHE 11 HE2 PHE 11 -1.903 0.432 -4.136
61 HE2 PHE 11 HE1 PHE 11 -3.356 -1.866 -0.878
62 HZ PHE 11 HZ PHE 11 -3.699 -0.122 -2.564
63 H VAL 12 H VAL 12 1.422 -2.501 0.620
64 HA VAL 12 HA VAL 12 -0.233 -0.526 1.348
65 HB VAL 12 HB VAL 12 0.984 -0.860 3.677
66 HG11 VAL 12 HG11 VAL 12 -1.243 -1.685 3.141
67 HG12 VAL 12 HG12 VAL 12 -0.548 -3.031 2.205
68 HG13 VAL 12 HG13 VAL 12 -0.309 -2.954 3.968
69 HG21 VAL 12 HG21 VAL 12 1.878 -3.403 2.341
70 HG22 VAL 12 HG22 VAL 12 2.937 -1.974 2.330
71 HG23 VAL 12 HG23 VAL 12 2.410 -2.679 3.878
72 H ALA 13 H ALA 13 3.368 -0.378 1.298
73 HA ALA 13 HA ALA 13 3.409 2.272 2.363
74 HB1 ALA 13 HB1 ALA 13 5.612 0.818 0.859
75 HB2 ALA 13 HB2 ALA 13 5.776 2.092 2.091
76 HB3 ALA 13 HB3 ALA 13 5.213 0.469 2.558
77 H VAL 14 H VAL 14 4.046 0.799 -0.900
78 HA VAL 14 HA VAL 14 4.504 3.119 -2.274
79 HB VAL 14 HB VAL 14 3.140 0.556 -3.110
80 HG11 VAL 14 HG11 VAL 14 4.394 1.733 -5.342
81 HG12 VAL 14 HG12 VAL 14 2.649 1.522 -5.061
82 HG13 VAL 14 HG13 VAL 14 3.453 3.033 -4.573
83 HG21 VAL 14 HG21 VAL 14 5.745 0.995 -2.304
84 HG22 VAL 14 HG22 VAL 14 5.185 -0.347 -3.331
85 HG23 VAL 14 HG23 VAL 14 5.854 1.123 -4.076
86 H PHE 15 H PHE 15 1.555 1.983 -0.778
87 HA PHE 15 HA PHE 15 -0.141 3.620 -2.429
88 HB3 PHE 15 HB3 PHE 15 -0.473 2.013 0.173
89 HD1 PHE 15 HD2 PHE 15 -2.583 3.094 -2.721
90 HD2 PHE 15 HD1 PHE 15 -2.237 2.677 1.489
91 HE1 PHE 15 HE2 PHE 15 -4.930 3.940 -2.444
92 HE2 PHE 15 HE1 PHE 15 -4.583 3.524 1.765
93 HZ PHE 15 HZ PHE 15 -5.901 4.145 -0.205
94 H LEU 16 H LEU 16 0.898 3.553 1.056
95 HA LEU 16 HA LEU 16 -0.353 5.996 1.667
96 HB3 LEU 16 HB3 LEU 16 1.893 4.507 3.032
97 HG LEU 16 HG LEU 16 1.758 6.803 3.905
98 HD11 LEU 16 HD11 LEU 16 -0.768 6.754 5.222
99 HD12 LEU 16 HD12 LEU 16 -0.158 7.909 4.013
100 HD13 LEU 16 HD13 LEU 16 -1.038 6.453 3.489
101 HD21 LEU 16 HD21 LEU 16 0.515 5.564 6.192
102 HD22 LEU 16 HD22 LEU 16 1.576 4.403 5.359
103 HD23 LEU 16 HD23 LEU 16 2.226 5.968 5.905
104 H LEU 17 H LEU 17 3.054 5.111 0.815
105 HA LEU 17 HA LEU 17 4.061 7.703 1.038
106 HB3 LEU 17 HB3 LEU 17 4.937 5.101 0.151
107 HG LEU 17 HG LEU 17 5.232 6.162 -2.061
108 HD11 LEU 17 HD11 LEU 17 5.771 8.302 -2.256
109 HD12 LEU 17 HD12 LEU 17 5.989 8.427 -0.494
110 HD13 LEU 17 HD13 LEU 17 7.363 7.968 -1.530
111 HD21 LEU 17 HD21 LEU 17 7.663 5.723 -2.280
112 HD22 LEU 17 HD22 LEU 17 7.778 5.636 -0.506
113 HD23 LEU 17 HD23 LEU 17 6.791 4.449 -1.393
114 H ALA 18 H ALA 18 2.092 6.110 -1.417
115 HA ALA 18 HA ALA 18 2.724 8.008 -3.466
116 HB1 ALA 18 HB1 ALA 18 2.089 5.906 -4.279
117 HB2 ALA 18 HB2 ALA 18 0.775 5.731 -3.091
118 HB3 ALA 18 HB3 ALA 18 0.592 6.852 -4.462
119 H MET 19 H MET 19 0.406 7.681 -0.795
120 HA MET 19 HA MET 19 -1.128 9.895 -1.843
121 HB3 MET 19 HB3 MET 19 -1.965 9.060 0.804
122 HG3 MET 19 HG3 MET 19 -3.729 7.838 -0.920
123 HE1 MET 19 HE1 MET 19 -6.294 10.638 -1.162
124 HE2 MET 19 HE2 MET 19 -5.616 9.156 -1.876
125 HE3 MET 19 HE3 MET 19 -6.366 9.103 -0.263
126 H PHE 20 H PHE 20 1.726 9.571 -0.196
127 HA PHE 20 HA PHE 20 1.181 11.614 1.790
128 HB3 PHE 20 HB3 PHE 20 3.672 10.015 0.943
129 HD1 PHE 20 HD1 PHE 20 4.685 12.471 1.181
130 HD2 PHE 20 HD2 PHE 20 3.218 10.125 4.398
131 HE1 PHE 20 HE1 PHE 20 6.081 13.801 2.787
132 HE2 PHE 20 HE2 PHE 20 4.615 11.455 6.005
133 HZ PHE 20 HZ PHE 20 6.029 13.277 5.180
134 H TYR 21 H TYR 21 2.817 11.132 -1.350
135 HA TYR 21 HA TYR 21 4.534 13.166 -1.546
136 HB3 TYR 21 HB3 TYR 21 3.404 13.342 -3.960
137 HD1 TYR 21 HD2 TYR 21 6.012 12.673 -3.414
138 HD2 TYR 21 HD1 TYR 21 2.764 9.943 -3.957
139 HE1 TYR 21 HE2 TYR 21 7.651 10.842 -4.062
140 HE2 TYR 21 HE1 TYR 21 4.413 8.120 -4.603
141 HH TYR 21 HH TYR 21 6.476 7.608 -4.960
142 H GLU 22 H GLU 22 0.957 13.507 -2.113
143 HA GLU 22 HA GLU 22 0.782 16.056 -2.760
144 HB3 GLU 22 HB3 GLU 22 -1.436 16.088 -1.773
145 HG3 GLU 22 HG3 GLU 22 -1.378 13.161 -2.074
146 HE2 GLU 22 HE2 GLU 22 -3.933 13.799 -4.405
147 H GLY 23 H GLY 23 1.799 14.794 0.393
148 HA2 GLY 23 HA2 GLY 23 3.023 15.931 1.962
149 HA3 GLY 23 HA3 GLY 23 2.654 17.454 1.178
150 H LEU 24 H LEU 24 -0.232 15.678 1.418
151 HA LEU 24 HA LEU 24 -1.358 17.459 3.250
152 HB3 LEU 24 HB3 LEU 24 -2.443 16.048 1.417
153 HG LEU 24 HG LEU 24 -2.579 14.056 3.696
154 HD11 LEU 24 HD11 LEU 24 -4.062 13.693 1.117
155 HD12 LEU 24 HD12 LEU 24 -4.369 12.990 2.723
156 HD13 LEU 24 HD13 LEU 24 -4.770 14.694 2.406
157 HD21 LEU 24 HD21 LEU 24 -0.595 13.919 2.177
158 HD22 LEU 24 HD22 LEU 24 -1.629 12.471 2.181
159 HD23 LEU 24 HD23 LEU 24 -1.717 13.624 0.827
160 H LYS 25 H LYS 25 -2.855 15.808 5.027
161 HA LYS 25 HA LYS 25 -2.748 14.863 7.019
162 HB3 LYS 25 HB3 LYS 25 -0.474 13.477 7.413
163 HG3 LYS 25 HG3 LYS 25 -2.987 12.902 5.839
164 HD3 LYS 25 HD3 LYS 25 -1.608 10.438 6.308
165 HE3 LYS 25 HE3 LYS 25 -2.705 11.983 3.981
166 HZ1 LYS 25 HZ1 LYS 25 -0.493 11.048 3.331
167 HZ2 LYS 25 HZ2 LYS 25 -1.116 9.558 3.567
168 HZ3 LYS 25 HZ3 LYS 25 -1.762 10.543 2.436
Start of MODEL 5
1 H1 LYS 1 H1 LYS 1 2.853 -20.708 2.856
2 HA LYS 1 HA LYS 1 0.958 -19.946 1.775
3 HB3 LYS 1 HB3 LYS 1 0.948 -17.251 3.019
4 HG3 LYS 1 HG3 LYS 1 -1.568 -18.331 3.205
5 HD3 LYS 1 HD3 LYS 1 -0.282 -16.394 1.642
6 HE3 LYS 1 HE3 LYS 1 -0.666 -18.625 -0.053
7 HZ1 LYS 1 HZ1 LYS 1 -3.065 -17.649 0.127
8 HZ2 LYS 1 HZ2 LYS 1 -2.499 -16.589 -0.979
9 HZ3 LYS 1 HZ3 LYS 1 -2.476 -18.191 -1.297
10 H ASN 2 H ASN 2 1.196 -19.158 -0.287
11 HA ASN 2 HA ASN 2 3.553 -18.602 -1.316
12 HB3 ASN 2 HB3 ASN 2 1.935 -16.895 -2.833
13 HD21 ASN 2 HD22 ASN 2 0.752 -18.178 -4.618
14 HD22 ASN 2 HD21 ASN 2 1.559 -19.595 -5.203
15 H THR 3 H THR 3 4.613 -16.527 -2.090
16 HA THR 3 HA THR 3 4.677 -14.587 -0.002
17 HB THR 3 HB THR 3 6.532 -13.720 -1.274
18 HG1 THR 3 HG1 THR 3 5.128 -15.162 -3.408
19 HG21 THR 3 HG21 THR 3 6.743 -16.406 -2.532
20 HG22 THR 3 HG22 THR 3 7.860 -15.598 -1.407
21 HG23 THR 3 HG23 THR 3 6.433 -16.457 -0.779
22 H ALA 4 H ALA 4 2.162 -14.352 -0.293
23 HA ALA 4 HA ALA 4 1.481 -12.543 -2.439
24 HB1 ALA 4 HB1 ALA 4 0.129 -14.467 -0.950
25 HB2 ALA 4 HB2 ALA 4 -0.480 -12.931 -0.286
26 HB3 ALA 4 HB3 ALA 4 -0.620 -13.265 -2.030
27 H GLY 5 H GLY 5 2.390 -12.484 0.990
28 HA2 GLY 5 HA2 GLY 5 1.421 -9.858 1.533
29 HA3 GLY 5 HA3 GLY 5 2.553 -10.799 2.484
30 H GLU 6 H GLU 6 4.455 -11.265 0.232
31 HA GLU 6 HA GLU 6 6.100 -9.119 0.657
32 HB3 GLU 6 HB3 GLU 6 6.642 -10.375 -1.919
33 HG3 GLU 6 HG3 GLU 6 8.065 -11.219 0.573
34 HE2 GLU 6 HE2 GLU 6 10.280 -9.283 -1.057
35 H MET 7 H MET 7 3.316 -9.386 -1.385
36 HA MET 7 HA MET 7 4.242 -7.201 -3.056
37 HB3 MET 7 HB3 MET 7 1.809 -7.787 -4.081
38 HG3 MET 7 HG3 MET 7 3.160 -9.999 -5.042
39 HE1 MET 7 HE1 MET 7 3.716 -9.215 -8.172
40 HE2 MET 7 HE2 MET 7 5.135 -8.222 -7.763
41 HE3 MET 7 HE3 MET 7 4.796 -9.710 -6.847
42 H ALA 8 H ALA 8 1.054 -8.098 -1.542
43 HA ALA 8 HA ALA 8 0.080 -5.512 -1.465
44 HB1 ALA 8 HB1 ALA 8 -1.629 -6.947 -1.054
45 HB2 ALA 8 HB2 ALA 8 -0.560 -8.154 -0.300
46 HB3 ALA 8 HB3 ALA 8 -1.153 -6.771 0.652
47 H GLY 9 H GLY 9 2.508 -7.109 0.497
48 HA2 GLY 9 HA2 GLY 9 2.243 -5.415 2.793
49 HA3 GLY 9 HA3 GLY 9 3.547 -6.525 2.423
50 H ALA 10 H ALA 10 4.009 -5.344 -0.316
51 HA ALA 10 HA ALA 10 5.641 -3.125 0.602
52 HB1 ALA 10 HB1 ALA 10 6.641 -3.362 -1.687
53 HB2 ALA 10 HB2 ALA 10 6.717 -4.856 -0.722
54 HB3 ALA 10 HB3 ALA 10 5.497 -4.688 -2.006
55 H PHE 11 H PHE 11 2.604 -3.774 -0.980
56 HA PHE 11 HA PHE 11 2.538 -1.381 -2.517
57 HB3 PHE 11 HB3 PHE 11 0.703 -3.623 -1.613
58 HD1 PHE 11 HD2 PHE 11 0.187 -0.756 -3.945
59 HD2 PHE 11 HD1 PHE 11 -1.381 -3.089 -0.766
60 HE1 PHE 11 HE2 PHE 11 -1.980 0.503 -4.090
61 HE2 PHE 11 HE1 PHE 11 -3.547 -1.831 -0.911
62 HZ PHE 11 HZ PHE 11 -3.822 -0.049 -2.570
63 H VAL 12 H VAL 12 1.164 -2.452 0.659
64 HA VAL 12 HA VAL 12 -0.430 -0.391 1.291
65 HB VAL 12 HB VAL 12 0.674 -0.747 3.671
66 HG11 VAL 12 HG11 VAL 12 -1.149 -2.443 2.029
67 HG12 VAL 12 HG12 VAL 12 -0.571 -3.120 3.570
68 HG13 VAL 12 HG13 VAL 12 -1.449 -1.572 3.552
69 HG21 VAL 12 HG21 VAL 12 2.138 -2.464 3.936
70 HG22 VAL 12 HG22 VAL 12 1.452 -3.407 2.591
71 HG23 VAL 12 HG23 VAL 12 2.564 -2.057 2.257
72 H ALA 13 H ALA 13 3.161 -0.399 1.245
73 HA ALA 13 HA ALA 13 3.298 2.259 2.318
74 HB1 ALA 13 HB1 ALA 13 5.510 0.751 0.900
75 HB2 ALA 13 HB2 ALA 13 5.638 1.944 2.214
76 HB3 ALA 13 HB3 ALA 13 4.998 0.317 2.549
77 H VAL 14 H VAL 14 3.872 0.672 -0.897
78 HA VAL 14 HA VAL 14 4.507 2.963 -2.293
79 HB VAL 14 HB VAL 14 3.102 0.425 -3.141
80 HG11 VAL 14 HG11 VAL 14 3.598 2.864 -4.632
81 HG12 VAL 14 HG12 VAL 14 4.491 1.494 -5.336
82 HG13 VAL 14 HG13 VAL 14 2.727 1.389 -5.120
83 HG21 VAL 14 HG21 VAL 14 5.896 0.926 -3.946
84 HG22 VAL 14 HG22 VAL 14 5.652 0.739 -2.193
85 HG23 VAL 14 HG23 VAL 14 5.130 -0.547 -3.307
86 H PHE 15 H PHE 15 1.509 2.004 -0.821
87 HA PHE 15 HA PHE 15 -0.046 3.721 -2.572
88 HB3 PHE 15 HB3 PHE 15 -0.612 1.912 -0.151
89 HD1 PHE 15 HD2 PHE 15 -2.400 3.625 -2.959
90 HD2 PHE 15 HD1 PHE 15 -2.529 2.265 1.059
91 HE1 PHE 15 HE2 PHE 15 -4.723 4.546 -2.722
92 HE2 PHE 15 HE1 PHE 15 -4.852 3.185 1.296
93 HZ PHE 15 HZ PHE 15 -5.921 4.315 -0.598
94 H LEU 16 H LEU 16 1.137 3.500 0.822
95 HA LEU 16 HA LEU 16 -0.261 5.849 1.629
96 HB3 LEU 16 HB3 LEU 16 1.511 3.833 2.814
97 HG LEU 16 HG LEU 16 2.711 6.061 3.305
98 HD11 LEU 16 HD11 LEU 16 0.707 6.560 5.439
99 HD12 LEU 16 HD12 LEU 16 1.748 7.692 4.543
100 HD13 LEU 16 HD13 LEU 16 0.266 7.057 3.788
101 HD21 LEU 16 HD21 LEU 16 1.888 4.842 5.888
102 HD22 LEU 16 HD22 LEU 16 2.571 3.752 4.657
103 HD23 LEU 16 HD23 LEU 16 3.509 5.155 5.222
104 H LEU 17 H LEU 17 3.134 5.041 0.679
105 HA LEU 17 HA LEU 17 4.180 7.577 1.129
106 HB3 LEU 17 HB3 LEU 17 4.982 5.081 -0.063
107 HG LEU 17 HG LEU 17 5.186 6.347 -2.173
108 HD11 LEU 17 HD11 LEU 17 7.356 8.081 -1.587
109 HD12 LEU 17 HD12 LEU 17 5.730 8.495 -2.183
110 HD13 LEU 17 HD13 LEU 17 6.050 8.444 -0.432
111 HD21 LEU 17 HD21 LEU 17 6.797 4.555 -1.530
112 HD22 LEU 17 HD22 LEU 17 7.466 5.768 -2.649
113 HD23 LEU 17 HD23 LEU 17 7.893 5.819 -0.920
114 H ALA 18 H ALA 18 2.128 6.283 -1.443
115 HA ALA 18 HA ALA 18 2.705 8.395 -3.278
116 HB1 ALA 18 HB1 ALA 18 1.065 7.343 -4.645
117 HB2 ALA 18 HB2 ALA 18 1.883 6.016 -3.787
118 HB3 ALA 18 HB3 ALA 18 0.281 6.569 -3.248
119 H MET 19 H MET 19 0.264 7.692 -0.738
120 HA MET 19 HA MET 19 -1.202 10.051 -1.425
121 HB3 MET 19 HB3 MET 19 -1.916 8.984 1.173
122 HG3 MET 19 HG3 MET 19 -3.810 7.943 -0.443
123 HE1 MET 19 HE1 MET 19 -4.339 10.587 -2.123
124 HE2 MET 19 HE2 MET 19 -5.466 11.585 -1.173
125 HE3 MET 19 HE3 MET 19 -3.748 12.039 -1.282
126 H PHE 20 H PHE 20 1.727 9.595 0.047
127 HA PHE 20 HA PHE 20 1.266 11.491 2.206
128 HB3 PHE 20 HB3 PHE 20 3.704 9.897 1.207
129 HD1 PHE 20 HD1 PHE 20 4.768 12.312 1.617
130 HD2 PHE 20 HD2 PHE 20 3.296 9.752 4.665
131 HE1 PHE 20 HE1 PHE 20 6.210 13.489 3.301
132 HE2 PHE 20 HE2 PHE 20 4.739 10.929 6.349
133 HZ PHE 20 HZ PHE 20 6.178 12.783 5.647
134 H TYR 21 H TYR 21 3.406 11.050 -0.700
135 HA TYR 21 HA TYR 21 4.500 13.650 -0.505
136 HB3 TYR 21 HB3 TYR 21 5.167 11.355 -1.745
137 HD1 TYR 21 HD1 TYR 21 3.017 10.236 -2.586
138 HD2 TYR 21 HD2 TYR 21 4.904 13.488 -4.625
139 HE1 TYR 21 HE1 TYR 21 1.776 9.627 -4.721
140 HE2 TYR 21 HE2 TYR 21 3.657 12.869 -6.753
141 HH TYR 21 HH TYR 21 1.940 11.696 -7.552
142 H GLU 22 H GLU 22 1.748 12.203 -2.326
143 HA GLU 22 HA GLU 22 1.305 14.645 -3.722
144 HB3 GLU 22 HB3 GLU 22 -0.985 12.927 -3.881
145 HG3 GLU 22 HG3 GLU 22 0.519 12.397 -6.135
146 HE2 GLU 22 HE2 GLU 22 -2.458 13.578 -7.003
147 H GLY 23 H GLY 23 0.967 13.936 -0.552
148 HA2 GLY 23 HA2 GLY 23 -1.735 14.972 -0.170
149 HA3 GLY 23 HA3 GLY 23 -0.647 14.344 1.052
150 H LEU 24 H LEU 24 1.071 16.415 -1.066
151 HA LEU 24 HA LEU 24 0.423 18.799 0.479
152 HB3 LEU 24 HB3 LEU 24 2.152 18.253 1.822
153 HG LEU 24 HG LEU 24 2.907 16.356 -0.179
154 HD11 LEU 24 HD11 LEU 24 4.652 18.429 -0.396
155 HD12 LEU 24 HD12 LEU 24 5.449 17.442 0.854
156 HD13 LEU 24 HD13 LEU 24 5.054 16.726 -0.727
157 HD21 LEU 24 HD21 LEU 24 2.519 16.190 2.382
158 HD22 LEU 24 HD22 LEU 24 3.752 15.160 1.615
159 HD23 LEU 24 HD23 LEU 24 4.241 16.625 2.500
160 H LYS 25 H LYS 25 2.526 17.371 -2.114
161 HA LYS 25 HA LYS 25 1.450 19.233 -3.998
162 HB3 LYS 25 HB3 LYS 25 3.111 20.651 -2.825
163 HG3 LYS 25 HG3 LYS 25 4.681 18.478 -2.561
164 HD3 LYS 25 HD3 LYS 25 6.130 19.856 -4.815
165 HE3 LYS 25 HE3 LYS 25 7.367 18.207 -3.507
166 HZ1 LYS 25 HZ1 LYS 25 5.833 16.850 -2.539
167 HZ2 LYS 25 HZ2 LYS 25 4.948 16.638 -3.895
168 HZ3 LYS 25 HZ3 LYS 25 6.374 15.863 -3.722
Start of MODEL 6
1 H1 LYS 1 H1 LYS 1 -1.825 -19.020 -4.303
2 HA LYS 1 HA LYS 1 0.379 -18.475 -5.638
3 HB3 LYS 1 HB3 LYS 1 -0.741 -16.003 -4.520
4 HG3 LYS 1 HG3 LYS 1 -0.464 -17.360 -7.223
5 HD3 LYS 1 HD3 LYS 1 -1.553 -14.577 -7.094
6 HE3 LYS 1 HE3 LYS 1 -2.369 -16.967 -8.805
7 HZ1 LYS 1 HZ1 LYS 1 -2.551 -14.055 -9.141
8 HZ2 LYS 1 HZ2 LYS 1 -2.912 -15.138 -10.309
9 HZ3 LYS 1 HZ3 LYS 1 -3.797 -15.090 -8.936
10 H ASN 2 H ASN 2 2.444 -18.737 -4.915
11 HA ASN 2 HA ASN 2 3.265 -18.251 -2.352
12 HB3 ASN 2 HB3 ASN 2 5.460 -17.724 -4.168
13 HD21 ASN 2 HD22 ASN 2 7.110 -18.621 -3.207
14 HD22 ASN 2 HD21 ASN 2 7.096 -19.998 -2.156
15 H THR 3 H THR 3 4.845 -16.485 -1.611
16 HA THR 3 HA THR 3 5.018 -14.294 -1.119
17 HB THR 3 HB THR 3 6.173 -13.081 -2.999
18 HG1 THR 3 HG1 THR 3 4.560 -14.190 -4.541
19 HG21 THR 3 HG21 THR 3 8.033 -14.393 -2.759
20 HG22 THR 3 HG22 THR 3 7.013 -15.532 -1.848
21 HG23 THR 3 HG23 THR 3 7.244 -15.749 -3.599
22 H ALA 4 H ALA 4 2.783 -13.968 -0.533
23 HA ALA 4 HA ALA 4 1.309 -12.480 -2.594
24 HB1 ALA 4 HB1 ALA 4 0.320 -13.958 -0.121
25 HB2 ALA 4 HB2 ALA 4 -0.702 -13.087 -1.290
26 HB3 ALA 4 HB3 ALA 4 0.200 -14.534 -1.802
27 H GLY 5 H GLY 5 2.706 -12.488 0.679
28 HA2 GLY 5 HA2 GLY 5 1.492 -9.973 1.418
29 HA3 GLY 5 HA3 GLY 5 2.673 -10.903 2.318
30 H GLU 6 H GLU 6 4.604 -11.182 0.084
31 HA GLU 6 HA GLU 6 6.140 -8.981 0.585
32 HB3 GLU 6 HB3 GLU 6 7.023 -9.874 -1.908
33 HG3 GLU 6 HG3 GLU 6 7.538 -11.192 0.799
34 HE2 GLU 6 HE2 GLU 6 10.795 -11.175 -1.000
35 H MET 7 H MET 7 3.375 -9.299 -1.488
36 HA MET 7 HA MET 7 4.191 -7.014 -3.069
37 HB3 MET 7 HB3 MET 7 1.529 -7.880 -3.722
38 HG3 MET 7 HG3 MET 7 3.328 -9.170 -5.491
39 HE1 MET 7 HE1 MET 7 1.078 -9.283 -6.239
40 HE2 MET 7 HE2 MET 7 0.243 -8.048 -7.210
41 HE3 MET 7 HE3 MET 7 1.737 -8.801 -7.820
42 H ALA 8 H ALA 8 1.048 -8.047 -1.551
43 HA ALA 8 HA ALA 8 -0.006 -5.508 -1.364
44 HB1 ALA 8 HB1 ALA 8 -1.133 -6.858 0.753
45 HB2 ALA 8 HB2 ALA 8 -1.647 -7.017 -0.943
46 HB3 ALA 8 HB3 ALA 8 -0.515 -8.198 -0.243
47 H GLY 9 H GLY 9 2.468 -7.118 0.565
48 HA2 GLY 9 HA2 GLY 9 2.221 -5.420 2.860
49 HA3 GLY 9 HA3 GLY 9 3.521 -6.533 2.483
50 H ALA 10 H ALA 10 3.981 -5.358 -0.255
51 HA ALA 10 HA ALA 10 5.613 -3.136 0.654
52 HB1 ALA 10 HB1 ALA 10 6.426 -3.387 -1.811
53 HB2 ALA 10 HB2 ALA 10 6.839 -4.664 -0.643
54 HB3 ALA 10 HB3 ALA 10 5.503 -4.908 -1.792
55 H PHE 11 H PHE 11 2.578 -3.791 -0.927
56 HA PHE 11 HA PHE 11 2.510 -1.402 -2.470
57 HB3 PHE 11 HB3 PHE 11 0.677 -3.645 -1.562
58 HD1 PHE 11 HD2 PHE 11 0.145 -0.796 -3.912
59 HD2 PHE 11 HD1 PHE 11 -1.397 -3.096 -0.695
60 HE1 PHE 11 HE2 PHE 11 -2.025 0.459 -4.054
61 HE2 PHE 11 HE1 PHE 11 -3.565 -1.840 -0.837
62 HZ PHE 11 HZ PHE 11 -3.853 -0.078 -2.514
63 H VAL 12 H VAL 12 1.128 -2.467 0.706
64 HA VAL 12 HA VAL 12 -0.463 -0.402 1.331
65 HB VAL 12 HB VAL 12 0.635 -0.756 3.714
66 HG11 VAL 12 HG11 VAL 12 -1.056 -2.676 2.107
67 HG12 VAL 12 HG12 VAL 12 -0.672 -2.978 3.819
68 HG13 VAL 12 HG13 VAL 12 -1.559 -1.508 3.352
69 HG21 VAL 12 HG21 VAL 12 2.508 -2.097 2.271
70 HG22 VAL 12 HG22 VAL 12 2.126 -2.437 3.976
71 HG23 VAL 12 HG23 VAL 12 1.401 -3.427 2.687
72 H ALA 13 H ALA 13 3.126 -0.413 1.284
73 HA ALA 13 HA ALA 13 3.265 2.246 2.356
74 HB1 ALA 13 HB1 ALA 13 5.479 0.736 0.945
75 HB2 ALA 13 HB2 ALA 13 5.603 1.927 2.261
76 HB3 ALA 13 HB3 ALA 13 4.962 0.300 2.590
77 H VAL 14 H VAL 14 3.838 0.651 -0.855
78 HA VAL 14 HA VAL 14 4.478 2.940 -2.254
79 HB VAL 14 HB VAL 14 3.075 0.401 -3.101
80 HG11 VAL 14 HG11 VAL 14 2.709 1.361 -5.084
81 HG12 VAL 14 HG12 VAL 14 3.576 2.836 -4.596
82 HG13 VAL 14 HG13 VAL 14 4.473 1.466 -5.293
83 HG21 VAL 14 HG21 VAL 14 5.618 0.706 -2.141
84 HG22 VAL 14 HG22 VAL 14 5.103 -0.573 -3.267
85 HG23 VAL 14 HG23 VAL 14 5.876 0.904 -3.891
86 H PHE 15 H PHE 15 1.479 1.988 -0.783
87 HA PHE 15 HA PHE 15 -0.076 3.693 -2.544
88 HB3 PHE 15 HB3 PHE 15 -0.542 1.749 -0.232
89 HD1 PHE 15 HD2 PHE 15 -2.859 3.405 -2.634
90 HD2 PHE 15 HD1 PHE 15 -1.957 2.555 1.424
91 HE1 PHE 15 HE2 PHE 15 -5.053 4.405 -1.937
92 HE2 PHE 15 HE1 PHE 15 -4.151 3.555 2.121
93 HZ PHE 15 HZ PHE 15 -5.672 4.468 0.432
94 H LEU 16 H LEU 16 1.125 3.503 0.845
95 HA LEU 16 HA LEU 16 -0.275 5.861 1.632
96 HB3 LEU 16 HB3 LEU 16 1.465 3.838 2.840
97 HG LEU 16 HG LEU 16 2.720 6.037 3.303
98 HD11 LEU 16 HD11 LEU 16 1.806 7.709 4.531
99 HD12 LEU 16 HD12 LEU 16 0.317 7.122 3.752
100 HD13 LEU 16 HD13 LEU 16 0.709 6.620 5.414
101 HD21 LEU 16 HD21 LEU 16 2.518 3.756 4.693
102 HD22 LEU 16 HD22 LEU 16 3.488 5.145 5.239
103 HD23 LEU 16 HD23 LEU 16 1.857 4.883 5.903
104 H LEU 17 H LEU 17 3.117 5.028 0.699
105 HA LEU 17 HA LEU 17 4.176 7.561 1.132
106 HB3 LEU 17 HB3 LEU 17 4.968 5.051 -0.041
107 HG LEU 17 HG LEU 17 5.184 6.301 -2.159
108 HD11 LEU 17 HD11 LEU 17 7.361 8.030 -1.574
109 HD12 LEU 17 HD12 LEU 17 5.742 8.445 -2.187
110 HD13 LEU 17 HD13 LEU 17 6.047 8.409 -0.434
111 HD21 LEU 17 HD21 LEU 17 7.156 4.799 -0.821
112 HD22 LEU 17 HD22 LEU 17 6.967 5.051 -2.574
113 HD23 LEU 17 HD23 LEU 17 8.009 6.139 -1.625
114 H ALA 18 H ALA 18 2.125 6.259 -1.437
115 HA ALA 18 HA ALA 18 2.718 8.357 -3.283
116 HB1 ALA 18 HB1 ALA 18 1.906 6.000 -3.818
117 HB2 ALA 18 HB2 ALA 18 0.307 6.509 -3.226
118 HB3 ALA 18 HB3 ALA 18 1.034 7.318 -4.634
119 H MET 19 H MET 19 0.271 7.685 -0.742
120 HA MET 19 HA MET 19 -1.186 10.044 -1.449
121 HB3 MET 19 HB3 MET 19 -1.906 8.999 1.156
122 HG3 MET 19 HG3 MET 19 -3.549 7.924 -0.984
123 HE1 MET 19 HE1 MET 19 -6.165 8.762 -0.810
124 HE2 MET 19 HE2 MET 19 -6.606 10.205 0.135
125 HE3 MET 19 HE3 MET 19 -5.514 10.356 -1.263
126 H PHE 20 H PHE 20 1.740 9.588 0.030
127 HA PHE 20 HA PHE 20 1.283 11.505 2.169
128 HB3 PHE 20 HB3 PHE 20 3.715 9.885 1.198
129 HD1 PHE 20 HD1 PHE 20 4.792 12.297 1.590
130 HD2 PHE 20 HD2 PHE 20 3.290 9.776 4.655
131 HE1 PHE 20 HE1 PHE 20 6.234 13.480 3.269
132 HE2 PHE 20 HE2 PHE 20 4.732 10.959 6.334
133 HZ PHE 20 HZ PHE 20 6.187 12.797 5.622
134 H TYR 21 H TYR 21 3.435 11.021 -0.721
135 HA TYR 21 HA TYR 21 4.544 13.615 -0.548
136 HB3 TYR 21 HB3 TYR 21 5.201 11.301 -1.759
137 HD1 TYR 21 HD1 TYR 21 3.033 10.202 -2.600
138 HD2 TYR 21 HD2 TYR 21 4.990 13.396 -4.666
139 HE1 TYR 21 HE1 TYR 21 1.801 9.584 -4.737
140 HE2 TYR 21 HE2 TYR 21 3.753 12.767 -6.796
141 HH TYR 21 HH TYR 21 2.722 10.716 -7.738
142 H GLU 22 H GLU 22 1.786 12.166 -2.357
143 HA GLU 22 HA GLU 22 1.367 14.602 -3.777
144 HB3 GLU 22 HB3 GLU 22 0.875 12.185 -4.587
145 HG3 GLU 22 HG3 GLU 22 -1.769 12.732 -3.172
146 HE2 GLU 22 HE2 GLU 22 -3.238 11.271 -3.883
147 H GLY 23 H GLY 23 0.296 13.085 -0.779
148 HA2 GLY 23 HA2 GLY 23 -2.023 14.816 -0.502
149 HA3 GLY 23 HA3 GLY 23 -1.465 13.582 0.610
150 H LEU 24 H LEU 24 0.364 16.349 -0.852
151 HA LEU 24 HA LEU 24 1.610 16.981 1.572
152 HB3 LEU 24 HB3 LEU 24 2.094 19.165 0.268
153 HG LEU 24 HG LEU 24 3.087 16.438 -0.292
154 HD11 LEU 24 HD11 LEU 24 4.367 17.053 -2.265
155 HD12 LEU 24 HD12 LEU 24 2.621 17.208 -2.581
156 HD13 LEU 24 HD13 LEU 24 3.605 18.662 -2.285
157 HD21 LEU 24 HD21 LEU 24 4.282 19.132 0.355
158 HD22 LEU 24 HD22 LEU 24 4.265 17.645 1.335
159 HD23 LEU 24 HD23 LEU 24 5.285 17.740 -0.121
160 H LYS 25 H LYS 25 -1.239 18.400 -0.147
161 HA LYS 25 HA LYS 25 -1.756 20.549 1.380
162 HB3 LYS 25 HB3 LYS 25 -4.272 19.665 1.020
163 HG3 LYS 25 HG3 LYS 25 -3.306 21.632 -0.099
164 HD3 LYS 25 HD3 LYS 25 -1.126 20.424 -0.730
165 HE3 LYS 25 HE3 LYS 25 -2.328 19.753 -3.378
166 HZ1 LYS 25 HZ1 LYS 25 -0.525 18.482 -3.439
167 HZ2 LYS 25 HZ2 LYS 25 0.001 19.340 -2.152
168 HZ3 LYS 25 HZ3 LYS 25 -0.721 17.891 -1.929
Start of MODEL 7
1 H1 LYS 1 H1 LYS 1 -2.867 -19.628 3.309
2 HA LYS 1 HA LYS 1 -0.493 -19.643 4.226
3 HB3 LYS 1 HB3 LYS 1 -0.555 -22.398 2.972
4 HG3 LYS 1 HG3 LYS 1 1.481 -20.974 4.752
5 HD3 LYS 1 HD3 LYS 1 1.287 -23.559 4.823
6 HE3 LYS 1 HE3 LYS 1 1.530 -23.115 1.954
7 HZ1 LYS 1 HZ1 LYS 1 3.916 -23.530 2.758
8 HZ2 LYS 1 HZ2 LYS 1 3.433 -25.078 2.954
9 HZ3 LYS 1 HZ3 LYS 1 3.353 -24.378 1.481
10 H ASN 2 H ASN 2 -1.412 -17.966 2.590
11 HA ASN 2 HA ASN 2 -0.463 -18.713 -0.062
12 HB3 ASN 2 HB3 ASN 2 -1.901 -16.791 -0.867
13 HD21 ASN 2 HD22 ASN 2 -4.525 -16.961 0.577
14 HD22 ASN 2 HD21 ASN 2 -5.184 -18.515 0.186
15 H THR 3 H THR 3 1.439 -17.676 -0.696
16 HA THR 3 HA THR 3 2.420 -15.506 0.977
17 HB THR 3 HB THR 3 4.537 -15.982 -0.298
18 HG1 THR 3 HG1 THR 3 4.275 -17.181 -2.153
19 HG21 THR 3 HG21 THR 3 5.014 -18.019 0.747
20 HG22 THR 3 HG22 THR 3 3.536 -17.590 1.640
21 HG23 THR 3 HG23 THR 3 3.453 -18.736 0.280
22 H ALA 4 H ALA 4 0.476 -14.197 0.112
23 HA ALA 4 HA ALA 4 1.228 -13.008 -2.465
24 HB1 ALA 4 HB1 ALA 4 -1.006 -13.946 -2.472
25 HB2 ALA 4 HB2 ALA 4 -1.408 -13.118 -0.949
26 HB3 ALA 4 HB3 ALA 4 -1.147 -12.173 -2.434
27 H GLY 5 H GLY 5 0.666 -12.479 1.010
28 HA2 GLY 5 HA2 GLY 5 0.467 -9.726 1.115
29 HA3 GLY 5 HA3 GLY 5 1.183 -10.748 2.347
30 H GLU 6 H GLU 6 3.282 -11.805 0.418
31 HA GLU 6 HA GLU 6 5.287 -10.072 1.079
32 HB3 GLU 6 HB3 GLU 6 6.448 -11.306 -0.986
33 HG3 GLU 6 HG3 GLU 6 5.609 -13.344 0.987
34 HE2 GLU 6 HE2 GLU 6 7.970 -14.674 0.884
35 H MET 7 H MET 7 2.861 -9.783 -1.385
36 HA MET 7 HA MET 7 4.500 -7.902 -2.868
37 HB3 MET 7 HB3 MET 7 2.209 -7.978 -4.291
38 HG3 MET 7 HG3 MET 7 3.978 -10.463 -4.217
39 HE1 MET 7 HE1 MET 7 2.231 -11.691 -4.713
40 HE2 MET 7 HE2 MET 7 0.963 -11.437 -5.937
41 HE3 MET 7 HE3 MET 7 2.468 -12.279 -6.377
42 H ALA 8 H ALA 8 0.968 -8.014 -2.007
43 HA ALA 8 HA ALA 8 0.614 -5.279 -2.029
44 HB1 ALA 8 HB1 ALA 8 -1.416 -6.296 -1.991
45 HB2 ALA 8 HB2 ALA 8 -0.815 -7.684 -1.052
46 HB3 ALA 8 HB3 ALA 8 -1.253 -6.170 -0.224
47 H GLY 9 H GLY 9 2.281 -7.314 0.260
48 HA2 GLY 9 HA2 GLY 9 1.927 -5.751 2.595
49 HA3 GLY 9 HA3 GLY 9 3.186 -6.930 2.285
50 H ALA 10 H ALA 10 4.151 -5.609 -0.217
51 HA ALA 10 HA ALA 10 5.706 -3.531 1.107
52 HB1 ALA 10 HB1 ALA 10 6.083 -4.755 -1.649
53 HB2 ALA 10 HB2 ALA 10 7.276 -3.854 -0.682
54 HB3 ALA 10 HB3 ALA 10 6.746 -5.473 -0.161
55 H PHE 11 H PHE 11 3.028 -3.981 -1.077
56 HA PHE 11 HA PHE 11 3.390 -1.551 -2.512
57 HB3 PHE 11 HB3 PHE 11 1.043 -2.132 -3.252
58 HD1 PHE 11 HD2 PHE 11 4.194 -3.331 -3.290
59 HD2 PHE 11 HD1 PHE 11 0.253 -4.711 -4.049
60 HE1 PHE 11 HE2 PHE 11 5.108 -5.104 -4.813
61 HE2 PHE 11 HE1 PHE 11 1.168 -6.484 -5.573
62 HZ PHE 11 HZ PHE 11 3.584 -6.660 -5.937
63 H VAL 12 H VAL 12 1.598 -2.599 0.421
64 HA VAL 12 HA VAL 12 -0.118 -0.534 0.775
65 HB VAL 12 HB VAL 12 0.540 -0.910 3.289
66 HG11 VAL 12 HG11 VAL 12 -1.191 -2.173 1.449
67 HG12 VAL 12 HG12 VAL 12 -0.455 -3.476 2.412
68 HG13 VAL 12 HG13 VAL 12 -1.316 -2.146 3.225
69 HG21 VAL 12 HG21 VAL 12 1.932 -2.650 3.826
70 HG22 VAL 12 HG22 VAL 12 1.636 -3.509 2.295
71 HG23 VAL 12 HG23 VAL 12 2.721 -2.098 2.329
72 H ALA 13 H ALA 13 3.435 -0.571 1.256
73 HA ALA 13 HA ALA 13 3.513 1.989 2.479
74 HB1 ALA 13 HB1 ALA 13 5.903 1.740 2.273
75 HB2 ALA 13 HB2 ALA 13 5.232 0.142 2.677
76 HB3 ALA 13 HB3 ALA 13 5.721 0.504 1.005
77 H VAL 14 H VAL 14 4.539 0.828 -0.818
78 HA VAL 14 HA VAL 14 5.123 3.175 -1.974
79 HB VAL 14 HB VAL 14 3.577 0.847 -3.128
80 HG11 VAL 14 HG11 VAL 14 4.256 3.386 -4.315
81 HG12 VAL 14 HG12 VAL 14 5.157 2.081 -5.122
82 HG13 VAL 14 HG13 VAL 14 3.381 2.006 -5.022
83 HG21 VAL 14 HG21 VAL 14 5.511 -0.279 -3.221
84 HG22 VAL 14 HG22 VAL 14 6.389 1.128 -3.869
85 HG23 VAL 14 HG23 VAL 14 6.166 0.949 -2.112
86 H PHE 15 H PHE 15 1.938 2.058 -0.916
87 HA PHE 15 HA PHE 15 0.541 4.058 -2.421
88 HB3 PHE 15 HB3 PHE 15 -0.063 2.028 -0.208
89 HD1 PHE 15 HD2 PHE 15 -2.208 3.790 -2.691
90 HD2 PHE 15 HD1 PHE 15 -1.534 2.851 1.393
91 HE1 PHE 15 HE2 PHE 15 -4.408 4.838 -2.087
92 HE2 PHE 15 HE1 PHE 15 -3.734 3.899 1.996
93 HZ PHE 15 HZ PHE 15 -5.144 4.880 0.249
94 H LEU 16 H LEU 16 1.286 3.458 1.086
95 HA LEU 16 HA LEU 16 0.124 5.844 1.973
96 HB3 LEU 16 HB3 LEU 16 2.225 4.033 3.163
97 HG LEU 16 HG LEU 16 2.339 6.225 4.293
98 HD11 LEU 16 HD11 LEU 16 0.561 7.489 4.700
99 HD12 LEU 16 HD12 LEU 16 -0.433 6.286 3.842
100 HD13 LEU 16 HD13 LEU 16 -0.230 6.177 5.606
101 HD21 LEU 16 HD21 LEU 16 2.738 5.122 6.177
102 HD22 LEU 16 HD22 LEU 16 1.002 4.829 6.438
103 HD23 LEU 16 HD23 LEU 16 1.956 3.697 5.450
104 H LEU 17 H LEU 17 3.467 4.983 0.933
105 HA LEU 17 HA LEU 17 4.527 7.527 1.580
106 HB3 LEU 17 HB3 LEU 17 5.476 5.014 0.772
107 HG LEU 17 HG LEU 17 5.523 6.179 -1.578
108 HD11 LEU 17 HD11 LEU 17 8.166 7.256 -0.743
109 HD12 LEU 17 HD12 LEU 17 7.042 7.807 -2.008
110 HD13 LEU 17 HD13 LEU 17 6.724 8.200 -0.301
111 HD21 LEU 17 HD21 LEU 17 8.222 5.157 -0.983
112 HD22 LEU 17 HD22 LEU 17 6.886 4.112 -0.442
113 HD23 LEU 17 HD23 LEU 17 7.004 4.594 -2.152
114 H ALA 18 H ALA 18 2.612 6.240 -1.060
115 HA ALA 18 HA ALA 18 3.399 8.341 -2.876
116 HB1 ALA 18 HB1 ALA 18 2.929 6.277 -3.924
117 HB2 ALA 18 HB2 ALA 18 1.471 6.005 -2.938
118 HB3 ALA 18 HB3 ALA 18 1.464 7.247 -4.214
119 H MET 19 H MET 19 1.196 7.868 -0.239
120 HA MET 19 HA MET 19 -0.837 9.568 -1.184
121 HB3 MET 19 HB3 MET 19 -0.590 9.466 1.741
122 HG3 MET 19 HG3 MET 19 -2.486 7.675 0.255
123 HE1 MET 19 HE1 MET 19 -5.413 8.195 2.337
124 HE2 MET 19 HE2 MET 19 -4.587 7.504 0.921
125 HE3 MET 19 HE3 MET 19 -4.299 6.820 2.538
126 H PHE 20 H PHE 20 2.207 10.016 0.627
127 HA PHE 20 HA PHE 20 1.820 12.439 1.786
128 HB3 PHE 20 HB3 PHE 20 4.379 12.667 1.012
129 HD1 PHE 20 HD1 PHE 20 3.444 9.182 1.851
130 HD2 PHE 20 HD2 PHE 20 4.802 12.926 3.316
131 HE1 PHE 20 HE1 PHE 20 3.936 8.132 4.077
132 HE2 PHE 20 HE2 PHE 20 5.292 11.877 5.543
133 HZ PHE 20 HZ PHE 20 4.854 9.493 5.896
134 H TYR 21 H TYR 21 3.060 11.864 -1.587
135 HA TYR 21 HA TYR 21 3.445 14.363 -2.448
136 HB3 TYR 21 HB3 TYR 21 2.581 13.399 -4.670
137 HD1 TYR 21 HD1 TYR 21 3.243 10.321 -2.754
138 HD2 TYR 21 HD2 TYR 21 4.982 13.475 -5.062
139 HE1 TYR 21 HE1 TYR 21 5.404 8.996 -2.949
140 HE2 TYR 21 HE2 TYR 21 7.137 12.140 -5.250
141 HH TYR 21 HH TYR 21 7.805 9.516 -3.302
142 H GLU 22 H GLU 22 0.215 12.720 -2.283
143 HA GLU 22 HA GLU 22 -1.083 15.064 -3.212
144 HB3 GLU 22 HB3 GLU 22 -3.055 13.451 -2.081
145 HG3 GLU 22 HG3 GLU 22 -2.016 12.691 -4.792
146 HE2 GLU 22 HE2 GLU 22 -5.389 14.233 -4.991
147 H GLY 23 H GLY 23 -0.420 13.501 -0.054
148 HA2 GLY 23 HA2 GLY 23 -2.089 14.641 1.695
149 HA3 GLY 23 HA3 GLY 23 -0.375 14.456 2.005
150 H LEU 24 H LEU 24 0.724 16.300 0.122
151 HA LEU 24 HA LEU 24 0.776 18.618 1.509
152 HB3 LEU 24 HB3 LEU 24 0.969 19.111 -1.343
153 HG LEU 24 HG LEU 24 2.885 19.104 0.976
154 HD11 LEU 24 HD11 LEU 24 4.225 18.091 -0.695
155 HD12 LEU 24 HD12 LEU 24 3.609 19.182 -1.958
156 HD13 LEU 24 HD13 LEU 24 4.663 19.815 -0.672
157 HD21 LEU 24 HD21 LEU 24 2.457 21.319 -1.009
158 HD22 LEU 24 HD22 LEU 24 1.284 21.035 0.300
159 HD23 LEU 24 HD23 LEU 24 2.982 21.398 0.690
160 H LYS 25 H LYS 25 -1.262 18.053 -1.452
161 HA LYS 25 HA LYS 25 -3.419 19.488 -0.236
162 HB3 LYS 25 HB3 LYS 25 -2.231 21.430 -0.908
163 HG3 LYS 25 HG3 LYS 25 -0.954 19.857 -2.760
164 HD3 LYS 25 HD3 LYS 25 -1.946 21.619 -4.784
165 HE3 LYS 25 HE3 LYS 25 -2.558 19.456 -5.907
166 HZ1 LYS 25 HZ1 LYS 25 -0.001 19.622 -4.489
167 HZ2 LYS 25 HZ2 LYS 25 -0.313 18.444 -5.575
168 HZ3 LYS 25 HZ3 LYS 25 -0.315 20.008 -6.045
Start of MODEL 8
1 H1 LYS 1 H1 LYS 1 8.314 -18.556 -0.200
2 HA LYS 1 HA LYS 1 6.251 -20.607 0.052
3 HB3 LYS 1 HB3 LYS 1 7.841 -20.415 1.894
4 HG3 LYS 1 HG3 LYS 1 7.068 -18.058 3.214
5 HD3 LYS 1 HD3 LYS 1 9.549 -18.454 1.477
6 HE3 LYS 1 HE3 LYS 1 9.471 -17.071 4.163
7 HZ1 LYS 1 HZ1 LYS 1 11.552 -17.407 3.113
8 HZ2 LYS 1 HZ2 LYS 1 11.038 -16.782 1.695
9 HZ3 LYS 1 HZ3 LYS 1 11.207 -15.815 3.002
10 H ASN 2 H ASN 2 5.318 -19.200 -1.889
11 HA ASN 2 HA ASN 2 3.664 -17.973 -2.567
12 HB3 ASN 2 HB3 ASN 2 1.830 -17.361 -1.036
13 HD21 ASN 2 HD22 ASN 2 0.527 -18.976 -1.384
14 HD22 ASN 2 HD21 ASN 2 0.775 -20.641 -0.980
15 H THR 3 H THR 3 3.854 -15.852 -3.333
16 HA THR 3 HA THR 3 5.091 -13.898 -1.506
17 HB THR 3 HB THR 3 5.259 -14.280 -4.539
18 HG1 THR 3 HG1 THR 3 6.725 -15.597 -3.365
19 HG21 THR 3 HG21 THR 3 5.376 -11.890 -4.242
20 HG22 THR 3 HG22 THR 3 6.252 -12.054 -2.701
21 HG23 THR 3 HG23 THR 3 7.070 -12.437 -4.235
22 H ALA 4 H ALA 4 2.608 -13.966 -0.851
23 HA ALA 4 HA ALA 4 1.137 -12.169 -2.628
24 HB1 ALA 4 HB1 ALA 4 -0.665 -12.802 -0.766
25 HB2 ALA 4 HB2 ALA 4 -0.291 -13.910 -2.107
26 HB3 ALA 4 HB3 ALA 4 0.438 -14.174 -0.506
27 H GLY 5 H GLY 5 2.658 -12.471 0.588
28 HA2 GLY 5 HA2 GLY 5 1.572 -9.995 1.574
29 HA3 GLY 5 HA3 GLY 5 2.801 -11.002 2.315
30 H GLU 6 H GLU 6 4.709 -11.156 0.179
31 HA GLU 6 HA GLU 6 6.171 -8.907 0.658
32 HB3 GLU 6 HB3 GLU 6 6.837 -10.003 -1.952
33 HG3 GLU 6 HG3 GLU 6 8.788 -10.924 -0.569
34 HE2 GLU 6 HE2 GLU 6 9.715 -8.495 1.056
35 H MET 7 H MET 7 3.442 -9.335 -1.451
36 HA MET 7 HA MET 7 4.204 -7.061 -3.066
37 HB3 MET 7 HB3 MET 7 1.701 -7.770 -3.942
38 HG3 MET 7 HG3 MET 7 3.814 -9.730 -4.742
39 HE1 MET 7 HE1 MET 7 3.351 -6.738 -7.445
40 HE2 MET 7 HE2 MET 7 4.586 -7.960 -7.060
41 HE3 MET 7 HE3 MET 7 3.478 -8.217 -8.428
42 H ALA 8 H ALA 8 1.046 -8.068 -1.571
43 HA ALA 8 HA ALA 8 -0.002 -5.534 -1.403
44 HB1 ALA 8 HB1 ALA 8 -1.644 -7.035 -0.963
45 HB2 ALA 8 HB2 ALA 8 -0.512 -8.209 -0.250
46 HB3 ALA 8 HB3 ALA 8 -1.131 -6.858 0.731
47 H GLY 9 H GLY 9 2.427 -7.148 0.603
48 HA2 GLY 9 HA2 GLY 9 2.182 -5.409 2.857
49 HA3 GLY 9 HA3 GLY 9 3.486 -6.523 2.499
50 H ALA 10 H ALA 10 3.943 -5.369 -0.255
51 HA ALA 10 HA ALA 10 5.581 -3.145 0.639
52 HB1 ALA 10 HB1 ALA 10 6.590 -4.951 -0.694
53 HB2 ALA 10 HB2 ALA 10 5.421 -4.652 -2.003
54 HB3 ALA 10 HB3 ALA 10 6.630 -3.414 -1.589
55 H PHE 11 H PHE 11 2.537 -3.799 -0.924
56 HA PHE 11 HA PHE 11 2.468 -1.419 -2.480
57 HB3 PHE 11 HB3 PHE 11 0.632 -3.649 -1.547
58 HD1 PHE 11 HD2 PHE 11 0.204 -0.608 -3.687
59 HD2 PHE 11 HD1 PHE 11 -1.541 -3.292 -0.900
60 HE1 PHE 11 HE2 PHE 11 -1.960 0.655 -3.825
61 HE2 PHE 11 HE1 PHE 11 -3.705 -2.029 -1.040
62 HZ PHE 11 HZ PHE 11 -3.889 -0.070 -2.500
63 H VAL 12 H VAL 12 1.092 -2.461 0.706
64 HA VAL 12 HA VAL 12 -0.485 -0.385 1.329
65 HB VAL 12 HB VAL 12 0.629 -0.730 3.708
66 HG11 VAL 12 HG11 VAL 12 -0.633 -3.108 3.605
67 HG12 VAL 12 HG12 VAL 12 -1.493 -1.550 3.633
68 HG13 VAL 12 HG13 VAL 12 -1.232 -2.397 2.088
69 HG21 VAL 12 HG21 VAL 12 1.382 -3.401 2.629
70 HG22 VAL 12 HG22 VAL 12 2.506 -2.058 2.307
71 HG23 VAL 12 HG23 VAL 12 2.069 -2.471 3.982
72 H ALA 13 H ALA 13 3.104 -0.412 1.263
73 HA ALA 13 HA ALA 13 3.259 2.254 2.320
74 HB1 ALA 13 HB1 ALA 13 5.457 0.723 0.904
75 HB2 ALA 13 HB2 ALA 13 5.597 1.927 2.209
76 HB3 ALA 13 HB3 ALA 13 4.950 0.305 2.559
77 H VAL 14 H VAL 14 3.811 0.639 -0.885
78 HA VAL 14 HA VAL 14 4.450 2.918 -2.300
79 HB VAL 14 HB VAL 14 3.035 0.380 -3.125
80 HG11 VAL 14 HG11 VAL 14 4.418 1.426 -5.333
81 HG12 VAL 14 HG12 VAL 14 2.655 1.332 -5.109
82 HG13 VAL 14 HG13 VAL 14 3.535 2.805 -4.636
83 HG21 VAL 14 HG21 VAL 14 5.834 0.880 -3.930
84 HG22 VAL 14 HG22 VAL 14 5.580 0.675 -2.181
85 HG23 VAL 14 HG23 VAL 14 5.061 -0.600 -3.311
86 H PHE 15 H PHE 15 1.455 1.984 -0.809
87 HA PHE 15 HA PHE 15 -0.101 3.688 -2.570
88 HB3 PHE 15 HB3 PHE 15 -0.618 1.845 -0.171
89 HD1 PHE 15 HD2 PHE 15 -2.876 2.969 -2.884
90 HD2 PHE 15 HD1 PHE 15 -2.092 2.965 1.286
91 HE1 PHE 15 HE2 PHE 15 -5.149 3.942 -2.456
92 HE2 PHE 15 HE1 PHE 15 -4.365 3.938 1.715
93 HZ PHE 15 HZ PHE 15 -5.868 4.415 -0.162
94 H LEU 16 H LEU 16 1.116 3.507 0.813
95 HA LEU 16 HA LEU 16 -0.273 5.873 1.599
96 HB3 LEU 16 HB3 LEU 16 1.458 3.844 2.805
97 HG LEU 16 HG LEU 16 2.746 6.028 3.244
98 HD11 LEU 16 HD11 LEU 16 1.891 7.587 4.806
99 HD12 LEU 16 HD12 LEU 16 0.624 7.366 3.576
100 HD13 LEU 16 HD13 LEU 16 0.473 6.570 5.161
101 HD21 LEU 16 HD21 LEU 16 3.527 5.125 5.165
102 HD22 LEU 16 HD22 LEU 16 1.903 4.919 5.865
103 HD23 LEU 16 HD23 LEU 16 2.507 3.758 4.659
104 H LEU 17 H LEU 17 3.109 5.024 0.642
105 HA LEU 17 HA LEU 17 4.181 7.556 1.062
106 HB3 LEU 17 HB3 LEU 17 4.959 5.039 -0.097
107 HG LEU 17 HG LEU 17 5.161 6.269 -2.229
108 HD11 LEU 17 HD11 LEU 17 6.057 8.386 -0.524
109 HD12 LEU 17 HD12 LEU 17 7.343 7.998 -1.691
110 HD13 LEU 17 HD13 LEU 17 5.712 8.414 -2.270
111 HD21 LEU 17 HD21 LEU 17 7.370 5.035 -0.757
112 HD22 LEU 17 HD22 LEU 17 6.791 4.755 -2.416
113 HD23 LEU 17 HD23 LEU 17 7.907 6.100 -2.078
114 H ALA 18 H ALA 18 2.111 6.250 -1.488
115 HA ALA 18 HA ALA 18 2.702 8.333 -3.351
116 HB1 ALA 18 HB1 ALA 18 0.289 6.486 -3.255
117 HB2 ALA 18 HB2 ALA 18 0.983 7.302 -4.676
118 HB3 ALA 18 HB3 ALA 18 1.879 5.987 -3.879
119 H MET 19 H MET 19 0.255 7.686 -0.800
120 HA MET 19 HA MET 19 -1.162 10.075 -1.506
121 HB3 MET 19 HB3 MET 19 -1.939 9.004 1.074
122 HG3 MET 19 HG3 MET 19 -3.831 8.022 -0.584
123 HE1 MET 19 HE1 MET 19 -5.853 9.129 1.186
124 HE2 MET 19 HE2 MET 19 -6.456 10.411 0.110
125 HE3 MET 19 HE3 MET 19 -5.866 8.878 -0.577
126 H PHE 20 H PHE 20 1.734 9.544 0.004
127 HA PHE 20 HA PHE 20 1.286 11.423 2.178
128 HB3 PHE 20 HB3 PHE 20 3.707 9.806 1.176
129 HD1 PHE 20 HD1 PHE 20 4.805 12.198 1.625
130 HD2 PHE 20 HD2 PHE 20 3.272 9.623 4.629
131 HE1 PHE 20 HE1 PHE 20 6.252 13.331 3.334
132 HE2 PHE 20 HE2 PHE 20 4.720 10.756 6.338
133 HZ PHE 20 HZ PHE 20 6.192 12.596 5.671
134 H TYR 21 H TYR 21 3.456 10.989 -0.706
135 HA TYR 21 HA TYR 21 4.612 13.546 -0.475
136 HB3 TYR 21 HB3 TYR 21 5.167 11.264 -1.799
137 HD1 TYR 21 HD1 TYR 21 3.065 10.183 -2.698
138 HD2 TYR 21 HD2 TYR 21 4.859 13.596 -4.552
139 HE1 TYR 21 HE1 TYR 21 1.775 9.708 -4.837
140 HE2 TYR 21 HE2 TYR 21 3.563 13.109 -6.685
141 HH TYR 21 HH TYR 21 1.111 11.705 -7.019
142 H GLU 22 H GLU 22 1.793 12.250 -2.311
143 HA GLU 22 HA GLU 22 1.387 14.469 -3.884
144 HB3 GLU 22 HB3 GLU 22 -1.090 13.128 -2.984
145 HG3 GLU 22 HG3 GLU 22 0.403 13.274 -5.647
146 HE2 GLU 22 HE2 GLU 22 -2.306 13.788 -6.598
147 H GLY 23 H GLY 23 0.150 13.659 -0.585
148 HA2 GLY 23 HA2 GLY 23 -1.665 15.554 -0.062
149 HA3 GLY 23 HA3 GLY 23 -0.438 15.072 1.091
150 H LEU 24 H LEU 24 1.920 16.103 0.295
151 HA LEU 24 HA LEU 24 3.138 17.940 0.208
152 HB3 LEU 24 HB3 LEU 24 1.414 19.793 -1.132
153 HG LEU 24 HG LEU 24 3.900 18.278 -1.811
154 HD11 LEU 24 HD11 LEU 24 3.649 18.246 -4.021
155 HD12 LEU 24 HD12 LEU 24 1.916 18.539 -3.740
156 HD13 LEU 24 HD13 LEU 24 3.011 19.908 -4.051
157 HD21 LEU 24 HD21 LEU 24 3.064 21.074 -1.335
158 HD22 LEU 24 HD22 LEU 24 4.595 20.246 -0.965
159 HD23 LEU 24 HD23 LEU 24 4.278 20.835 -2.614
160 H LYS 25 H LYS 25 -0.067 19.612 0.268
161 HA LYS 25 HA LYS 25 0.751 21.267 2.392
162 HB3 LYS 25 HB3 LYS 25 -0.847 22.056 0.787
163 HG3 LYS 25 HG3 LYS 25 -3.126 20.418 1.720
164 HD3 LYS 25 HD3 LYS 25 -3.029 22.065 -0.255
165 HE3 LYS 25 HE3 LYS 25 -0.779 20.885 -1.045
166 HZ1 LYS 25 HZ1 LYS 25 -2.510 18.850 -1.397
167 HZ2 LYS 25 HZ2 LYS 25 -2.371 19.460 -2.905
168 HZ3 LYS 25 HZ3 LYS 25 -1.039 18.974 -2.096
Start of MODEL 9
1 H1 LYS 1 H1 LYS 1 5.400 -21.104 -2.489
2 HA LYS 1 HA LYS 1 3.188 -21.439 -2.960
3 HB3 LYS 1 HB3 LYS 1 2.397 -22.148 -0.348
4 HG3 LYS 1 HG3 LYS 1 3.797 -23.671 -2.592
5 HD3 LYS 1 HD3 LYS 1 2.067 -25.053 -0.565
6 HE3 LYS 1 HE3 LYS 1 4.586 -26.335 -1.174
7 HZ1 LYS 1 HZ1 LYS 1 3.182 -28.006 -1.504
8 HZ2 LYS 1 HZ2 LYS 1 2.023 -27.013 -0.923
9 HZ3 LYS 1 HZ3 LYS 1 2.222 -27.181 -2.536
10 H ASN 2 H ASN 2 2.554 -20.351 0.391
11 HA ASN 2 HA ASN 2 0.579 -18.571 -0.710
12 HB3 ASN 2 HB3 ASN 2 -0.116 -18.343 1.723
13 HD21 ASN 2 HD22 ASN 2 0.266 -21.159 2.877
14 HD22 ASN 2 HD21 ASN 2 -0.832 -22.157 1.983
15 H THR 3 H THR 3 1.619 -16.634 -1.359
16 HA THR 3 HA THR 3 2.789 -15.043 0.757
17 HB THR 3 HB THR 3 4.873 -14.645 -0.609
18 HG1 THR 3 HG1 THR 3 4.678 -15.434 -2.665
19 HG21 THR 3 HG21 THR 3 4.432 -17.644 -0.197
20 HG22 THR 3 HG22 THR 3 5.983 -16.771 -0.182
21 HG23 THR 3 HG23 THR 3 4.814 -16.532 1.139
22 H ALA 4 H ALA 4 0.433 -14.378 0.023
23 HA ALA 4 HA ALA 4 0.472 -12.810 -2.404
24 HB1 ALA 4 HB1 ALA 4 -1.844 -12.678 -2.121
25 HB2 ALA 4 HB2 ALA 4 -1.467 -14.249 -1.373
26 HB3 ALA 4 HB3 ALA 4 -1.739 -12.820 -0.350
27 H GLY 5 H GLY 5 0.952 -12.436 1.076
28 HA2 GLY 5 HA2 GLY 5 0.513 -9.590 1.090
29 HA3 GLY 5 HA3 GLY 5 1.140 -10.587 2.386
30 H GLU 6 H GLU 6 3.225 -11.851 0.573
31 HA GLU 6 HA GLU 6 5.298 -10.173 1.195
32 HB3 GLU 6 HB3 GLU 6 5.642 -11.961 -1.179
33 HG3 GLU 6 HG3 GLU 6 7.332 -12.853 0.755
34 HE2 GLU 6 HE2 GLU 6 9.296 -10.760 0.701
35 H MET 7 H MET 7 2.955 -9.926 -1.339
36 HA MET 7 HA MET 7 4.733 -8.232 -2.892
37 HB3 MET 7 HB3 MET 7 2.519 -8.337 -4.422
38 HG3 MET 7 HG3 MET 7 4.484 -10.631 -3.975
39 HE1 MET 7 HE1 MET 7 4.699 -12.586 -5.628
40 HE2 MET 7 HE2 MET 7 3.832 -12.684 -7.179
41 HE3 MET 7 HE3 MET 7 5.012 -11.381 -6.900
42 H ALA 8 H ALA 8 1.182 -8.199 -2.092
43 HA ALA 8 HA ALA 8 0.912 -5.452 -2.353
44 HB1 ALA 8 HB1 ALA 8 -0.636 -7.744 -1.322
45 HB2 ALA 8 HB2 ALA 8 -1.043 -6.194 -0.549
46 HB3 ALA 8 HB3 ALA 8 -1.161 -6.366 -2.318
47 H GLY 9 H GLY 9 2.476 -7.350 0.097
48 HA2 GLY 9 HA2 GLY 9 2.052 -5.747 2.364
49 HA3 GLY 9 HA3 GLY 9 3.397 -6.835 2.081
50 H ALA 10 H ALA 10 4.186 -5.423 -0.482
51 HA ALA 10 HA ALA 10 5.698 -3.315 0.821
52 HB1 ALA 10 HB1 ALA 10 5.894 -4.909 -1.729
53 HB2 ALA 10 HB2 ALA 10 6.746 -3.353 -1.602
54 HB3 ALA 10 HB3 ALA 10 7.109 -4.662 -0.452
55 H PHE 11 H PHE 11 2.862 -3.778 -1.143
56 HA PHE 11 HA PHE 11 2.972 -1.291 -2.498
57 HB3 PHE 11 HB3 PHE 11 0.996 -3.515 -1.876
58 HD1 PHE 11 HD2 PHE 11 0.813 -0.516 -4.093
59 HD2 PHE 11 HD1 PHE 11 -1.148 -2.957 -1.229
60 HE1 PHE 11 HE2 PHE 11 -1.286 0.830 -4.384
61 HE2 PHE 11 HE1 PHE 11 -3.247 -1.612 -1.519
62 HZ PHE 11 HZ PHE 11 -3.291 0.266 -3.093
63 H VAL 12 H VAL 12 1.325 -2.503 0.490
64 HA VAL 12 HA VAL 12 -0.281 -0.457 1.120
65 HB VAL 12 HB VAL 12 0.670 -0.945 3.549
66 HG11 VAL 12 HG11 VAL 12 -0.856 -2.804 3.706
67 HG12 VAL 12 HG12 VAL 12 -1.539 -1.613 2.572
68 HG13 VAL 12 HG13 VAL 12 -0.765 -3.091 1.952
69 HG21 VAL 12 HG21 VAL 12 2.644 -2.186 2.260
70 HG22 VAL 12 HG22 VAL 12 2.020 -2.776 3.820
71 HG23 VAL 12 HG23 VAL 12 1.485 -3.537 2.302
72 H ALA 13 H ALA 13 3.309 -0.532 1.480
73 HA ALA 13 HA ALA 13 3.398 2.061 2.656
74 HB1 ALA 13 HB1 ALA 13 5.810 1.777 2.447
75 HB2 ALA 13 HB2 ALA 13 5.089 0.249 3.008
76 HB3 ALA 13 HB3 ALA 13 5.586 0.428 1.308
77 H VAL 14 H VAL 14 4.300 0.727 -0.607
78 HA VAL 14 HA VAL 14 5.006 3.050 -1.821
79 HB VAL 14 HB VAL 14 3.520 0.642 -2.873
80 HG11 VAL 14 HG11 VAL 14 4.075 3.161 -4.196
81 HG12 VAL 14 HG12 VAL 14 4.950 1.827 -4.984
82 HG13 VAL 14 HG13 VAL 14 3.182 1.740 -4.788
83 HG21 VAL 14 HG21 VAL 14 6.354 1.179 -3.577
84 HG22 VAL 14 HG22 VAL 14 6.036 0.761 -1.876
85 HG23 VAL 14 HG23 VAL 14 5.537 -0.350 -3.174
86 H PHE 15 H PHE 15 1.838 2.066 -0.671
87 HA PHE 15 HA PHE 15 0.474 4.011 -2.308
88 HB3 PHE 15 HB3 PHE 15 -0.208 2.021 -0.079
89 HD1 PHE 15 HD2 PHE 15 -2.016 4.197 -2.533
90 HD2 PHE 15 HD1 PHE 15 -1.970 2.438 1.330
91 HE1 PHE 15 HE2 PHE 15 -4.225 5.270 -2.018
92 HE2 PHE 15 HE1 PHE 15 -4.180 3.512 1.845
93 HZ PHE 15 HZ PHE 15 -5.281 4.915 0.164
94 H LEU 16 H LEU 16 1.295 3.491 1.184
95 HA LEU 16 HA LEU 16 0.072 5.888 2.030
96 HB3 LEU 16 HB3 LEU 16 1.680 3.721 3.170
97 HG LEU 16 HG LEU 16 3.003 5.836 3.817
98 HD11 LEU 16 HD11 LEU 16 2.113 7.297 5.456
99 HD12 LEU 16 HD12 LEU 16 0.905 7.206 4.152
100 HD13 LEU 16 HD13 LEU 16 0.654 6.300 5.663
101 HD21 LEU 16 HD21 LEU 16 1.992 4.535 6.296
102 HD22 LEU 16 HD22 LEU 16 2.683 3.482 5.038
103 HD23 LEU 16 HD23 LEU 16 3.658 4.801 5.729
104 H LEU 17 H LEU 17 3.395 4.985 0.986
105 HA LEU 17 HA LEU 17 4.469 7.538 1.623
106 HB3 LEU 17 HB3 LEU 17 5.643 5.268 1.434
107 HG LEU 17 HG LEU 17 4.918 4.994 -1.058
108 HD11 LEU 17 HD11 LEU 17 5.881 6.218 -2.673
109 HD12 LEU 17 HD12 LEU 17 6.168 7.396 -1.368
110 HD13 LEU 17 HD13 LEU 17 7.457 6.264 -1.845
111 HD21 LEU 17 HD21 LEU 17 6.251 3.313 -0.186
112 HD22 LEU 17 HD22 LEU 17 7.243 3.937 -1.527
113 HD23 LEU 17 HD23 LEU 17 7.609 4.416 0.149
114 H ALA 18 H ALA 18 2.574 6.203 -0.996
115 HA ALA 18 HA ALA 18 3.422 8.230 -2.870
116 HB1 ALA 18 HB1 ALA 18 2.943 6.134 -3.853
117 HB2 ALA 18 HB2 ALA 18 1.461 5.921 -2.891
118 HB3 ALA 18 HB3 ALA 18 1.503 7.118 -4.208
119 H MET 19 H MET 19 1.182 7.875 -0.250
120 HA MET 19 HA MET 19 -0.817 9.569 -1.285
121 HB3 MET 19 HB3 MET 19 -0.488 9.452 1.675
122 HG3 MET 19 HG3 MET 19 -2.716 7.952 0.484
123 HE1 MET 19 HE1 MET 19 -4.651 10.002 0.423
124 HE2 MET 19 HE2 MET 19 -5.411 9.818 2.023
125 HE3 MET 19 HE3 MET 19 -4.610 11.347 1.589
126 H PHE 20 H PHE 20 2.228 10.033 0.500
127 HA PHE 20 HA PHE 20 1.848 12.495 1.605
128 HB3 PHE 20 HB3 PHE 20 4.421 12.663 0.866
129 HD1 PHE 20 HD1 PHE 20 3.410 9.218 1.786
130 HD2 PHE 20 HD2 PHE 20 4.827 12.974 3.165
131 HE1 PHE 20 HE1 PHE 20 3.854 8.221 4.046
132 HE2 PHE 20 HE2 PHE 20 5.269 11.976 5.425
133 HZ PHE 20 HZ PHE 20 4.779 9.612 5.839
134 H TYR 21 H TYR 21 3.113 11.791 -1.734
135 HA TYR 21 HA TYR 21 3.552 14.257 -2.667
136 HB3 TYR 21 HB3 TYR 21 2.700 13.236 -4.867
137 HD1 TYR 21 HD1 TYR 21 3.286 10.210 -2.848
138 HD2 TYR 21 HD2 TYR 21 5.108 13.261 -5.231
139 HE1 TYR 21 HE1 TYR 21 5.427 8.845 -2.972
140 HE2 TYR 21 HE2 TYR 21 7.243 11.885 -5.348
141 HH TYR 21 HH TYR 21 7.945 9.477 -3.314
142 H GLU 22 H GLU 22 0.385 12.871 -1.842
143 HA GLU 22 HA GLU 22 -0.877 15.217 -3.002
144 HB3 GLU 22 HB3 GLU 22 -2.903 13.551 -2.017
145 HG3 GLU 22 HG3 GLU 22 -1.691 13.336 -4.804
146 HE2 GLU 22 HE2 GLU 22 -2.872 11.311 -4.466
147 H GLY 23 H GLY 23 -1.091 13.157 -0.003
148 HA2 GLY 23 HA2 GLY 23 -1.748 13.692 2.093
149 HA3 GLY 23 HA3 GLY 23 -0.617 15.016 1.899
150 H LEU 24 H LEU 24 -3.473 14.786 -0.202
151 HA LEU 24 HA LEU 24 -4.455 17.240 1.021
152 HB3 LEU 24 HB3 LEU 24 -5.823 17.411 -1.010
153 HG LEU 24 HG LEU 24 -3.040 17.726 -0.939
154 HD11 LEU 24 HD11 LEU 24 -3.625 16.694 -3.685
155 HD12 LEU 24 HD12 LEU 24 -2.076 16.850 -2.822
156 HD13 LEU 24 HD13 LEU 24 -3.202 15.538 -2.399
157 HD21 LEU 24 HD21 LEU 24 -5.073 18.609 -3.008
158 HD22 LEU 24 HD22 LEU 24 -4.625 19.463 -1.512
159 HD23 LEU 24 HD23 LEU 24 -3.434 19.279 -2.822
160 H LYS 25 H LYS 25 -7.111 17.257 0.654
161 HA LYS 25 HA LYS 25 -8.164 15.950 2.748
162 HB3 LYS 25 HB3 LYS 25 -9.243 17.722 1.353
163 HG3 LYS 25 HG3 LYS 25 -10.864 16.251 -0.363
164 HD3 LYS 25 HD3 LYS 25 -8.466 18.035 -0.684
165 HE3 LYS 25 HE3 LYS 25 -9.731 17.233 -3.242
166 HZ1 LYS 25 HZ1 LYS 25 -7.626 18.598 -2.619
167 HZ2 LYS 25 HZ2 LYS 25 -6.893 17.140 -2.672
168 HZ3 LYS 25 HZ3 LYS 25 -7.669 17.712 -3.989
Start of MODEL 10
1 H1 LYS 1 H1 LYS 1 -3.044 -18.827 5.150
2 HA LYS 1 HA LYS 1 -0.276 -18.648 5.505
3 HB3 LYS 1 HB3 LYS 1 0.052 -20.025 3.196
4 HG3 LYS 1 HG3 LYS 1 0.053 -21.530 5.826
5 HD3 LYS 1 HD3 LYS 1 1.035 -22.233 3.410
6 HE3 LYS 1 HE3 LYS 1 3.647 -21.409 4.461
7 HZ1 LYS 1 HZ1 LYS 1 3.569 -22.127 2.304
8 HZ2 LYS 1 HZ2 LYS 1 2.200 -21.319 1.933
9 HZ3 LYS 1 HZ3 LYS 1 3.610 -20.509 2.086
10 H ASN 2 H ASN 2 -1.457 -19.236 2.233
11 HA ASN 2 HA ASN 2 -1.889 -17.920 0.566
12 HB3 ASN 2 HB3 ASN 2 -3.102 -15.723 0.996
13 HD21 ASN 2 HD22 ASN 2 -5.340 -15.680 1.642
14 HD22 ASN 2 HD21 ASN 2 -6.230 -17.155 1.827
15 H THR 3 H THR 3 0.316 -17.585 -0.109
16 HA THR 3 HA THR 3 1.853 -15.474 1.147
17 HB THR 3 HB THR 3 2.360 -17.533 -1.058
18 HG1 THR 3 HG1 THR 3 3.502 -16.990 1.588
19 HG21 THR 3 HG21 THR 3 3.937 -15.135 -0.203
20 HG22 THR 3 HG22 THR 3 4.835 -16.672 -0.220
21 HG23 THR 3 HG23 THR 3 4.049 -16.084 -1.705
22 H ALA 4 H ALA 4 -0.171 -14.049 0.440
23 HA ALA 4 HA ALA 4 0.584 -12.901 -2.162
24 HB1 ALA 4 HB1 ALA 4 -1.762 -12.287 -2.454
25 HB2 ALA 4 HB2 ALA 4 -1.640 -14.039 -2.163
26 HB3 ALA 4 HB3 ALA 4 -2.166 -12.954 -0.853
27 H GLY 5 H GLY 5 1.486 -12.475 0.764
28 HA2 GLY 5 HA2 GLY 5 0.585 -9.689 1.110
29 HA3 GLY 5 HA3 GLY 5 1.289 -10.717 2.343
30 H GLU 6 H GLU 6 3.408 -11.817 0.525
31 HA GLU 6 HA GLU 6 5.400 -10.052 1.135
32 HB3 GLU 6 HB3 GLU 6 5.935 -11.679 -1.275
33 HG3 GLU 6 HG3 GLU 6 7.339 -12.752 0.852
34 HE2 GLU 6 HE2 GLU 6 9.749 -11.862 -1.360
35 H MET 7 H MET 7 3.033 -9.910 -1.406
36 HA MET 7 HA MET 7 4.698 -8.098 -2.942
37 HB3 MET 7 HB3 MET 7 2.395 -8.257 -4.377
38 HG3 MET 7 HG3 MET 7 3.511 -10.778 -4.928
39 HE1 MET 7 HE1 MET 7 5.831 -7.400 -5.705
40 HE2 MET 7 HE2 MET 7 6.316 -9.105 -5.540
41 HE3 MET 7 HE3 MET 7 6.214 -8.360 -7.154
42 H ALA 8 H ALA 8 1.147 -8.167 -2.164
43 HA ALA 8 HA ALA 8 0.791 -5.440 -2.334
44 HB1 ALA 8 HB1 ALA 8 -1.099 -6.257 -0.503
45 HB2 ALA 8 HB2 ALA 8 -1.245 -6.435 -2.268
46 HB3 ALA 8 HB3 ALA 8 -0.655 -7.794 -1.281
47 H GLY 9 H GLY 9 2.407 -7.350 0.101
48 HA2 GLY 9 HA2 GLY 9 2.004 -5.734 2.365
49 HA3 GLY 9 HA3 GLY 9 3.341 -6.830 2.078
50 H ALA 10 H ALA 10 4.118 -5.433 -0.497
51 HA ALA 10 HA ALA 10 5.658 -3.333 0.785
52 HB1 ALA 10 HB1 ALA 10 7.201 -4.293 -0.547
53 HB2 ALA 10 HB2 ALA 10 5.959 -5.186 -1.457
54 HB3 ALA 10 HB3 ALA 10 6.372 -3.517 -1.918
55 H PHE 11 H PHE 11 2.796 -3.775 -1.143
56 HA PHE 11 HA PHE 11 2.908 -1.284 -2.493
57 HB3 PHE 11 HB3 PHE 11 0.929 -3.503 -1.870
58 HD1 PHE 11 HD2 PHE 11 0.689 -0.592 -4.181
59 HD2 PHE 11 HD1 PHE 11 -1.157 -2.839 -1.090
60 HE1 PHE 11 HE2 PHE 11 -1.407 0.761 -4.449
61 HE2 PHE 11 HE1 PHE 11 -3.254 -1.485 -1.358
62 HZ PHE 11 HZ PHE 11 -3.354 0.299 -3.034
63 H VAL 12 H VAL 12 1.272 -2.504 0.497
64 HA VAL 12 HA VAL 12 -0.318 -0.451 1.147
65 HB VAL 12 HB VAL 12 0.634 -0.962 3.569
66 HG11 VAL 12 HG11 VAL 12 -1.248 -2.163 3.711
67 HG12 VAL 12 HG12 VAL 12 -1.419 -1.953 1.953
68 HG13 VAL 12 HG13 VAL 12 -0.621 -3.405 2.603
69 HG21 VAL 12 HG21 VAL 12 2.644 -2.141 2.417
70 HG22 VAL 12 HG22 VAL 12 1.870 -2.925 3.816
71 HG23 VAL 12 HG23 VAL 12 1.503 -3.484 2.166
72 H ALA 13 H ALA 13 3.272 -0.553 1.482
73 HA ALA 13 HA ALA 13 3.386 2.031 2.678
74 HB1 ALA 13 HB1 ALA 13 5.065 0.208 3.014
75 HB2 ALA 13 HB2 ALA 13 5.554 0.386 1.312
76 HB3 ALA 13 HB3 ALA 13 5.796 1.731 2.453
77 H VAL 14 H VAL 14 4.253 0.708 -0.599
78 HA VAL 14 HA VAL 14 4.977 3.034 -1.801
79 HB VAL 14 HB VAL 14 3.467 0.643 -2.860
80 HG11 VAL 14 HG11 VAL 14 4.038 3.167 -4.172
81 HG12 VAL 14 HG12 VAL 14 4.887 1.825 -4.975
82 HG13 VAL 14 HG13 VAL 14 3.122 1.760 -4.763
83 HG21 VAL 14 HG21 VAL 14 6.304 1.173 -3.568
84 HG22 VAL 14 HG22 VAL 14 5.983 0.728 -1.875
85 HG23 VAL 14 HG23 VAL 14 5.477 -0.358 -3.192
86 H PHE 15 H PHE 15 1.808 2.072 -0.638
87 HA PHE 15 HA PHE 15 0.451 4.036 -2.258
88 HB3 PHE 15 HB3 PHE 15 -0.269 2.093 0.008
89 HD1 PHE 15 HD2 PHE 15 -1.980 4.140 -2.618
90 HD2 PHE 15 HD1 PHE 15 -2.100 2.547 1.314
91 HE1 PHE 15 HE2 PHE 15 -4.219 5.213 -2.253
92 HE2 PHE 15 HE1 PHE 15 -4.339 3.621 1.680
93 HZ PHE 15 HZ PHE 15 -5.372 4.941 -0.107
94 H LEU 16 H LEU 16 1.280 3.488 1.229
95 HA LEU 16 HA LEU 16 0.085 5.890 2.094
96 HB3 LEU 16 HB3 LEU 16 1.703 3.713 3.216
97 HG LEU 16 HG LEU 16 2.989 5.843 3.890
98 HD11 LEU 16 HD11 LEU 16 1.102 6.386 6.055
99 HD12 LEU 16 HD12 LEU 16 1.998 7.505 4.999
100 HD13 LEU 16 HD13 LEU 16 0.459 6.801 4.448
101 HD21 LEU 16 HD21 LEU 16 3.708 4.694 5.673
102 HD22 LEU 16 HD22 LEU 16 2.089 4.618 6.406
103 HD23 LEU 16 HD23 LEU 16 2.548 3.453 5.142
104 H LEU 17 H LEU 17 3.393 4.965 1.029
105 HA LEU 17 HA LEU 17 4.493 7.505 1.675
106 HB3 LEU 17 HB3 LEU 17 5.651 5.231 1.474
107 HG LEU 17 HG LEU 17 4.902 4.951 -1.007
108 HD11 LEU 17 HD11 LEU 17 5.817 6.195 -2.628
109 HD12 LEU 17 HD12 LEU 17 6.175 7.354 -1.326
110 HD13 LEU 17 HD13 LEU 17 7.421 6.200 -1.858
111 HD21 LEU 17 HD21 LEU 17 7.274 3.939 -1.490
112 HD22 LEU 17 HD22 LEU 17 7.572 4.356 0.215
113 HD23 LEU 17 HD23 LEU 17 6.238 3.258 -0.212
114 H ALA 18 H ALA 18 2.573 6.203 -0.940
115 HA ALA 18 HA ALA 18 3.430 8.234 -2.808
116 HB1 ALA 18 HB1 ALA 18 2.928 6.148 -3.801
117 HB2 ALA 18 HB2 ALA 18 1.450 5.941 -2.833
118 HB3 ALA 18 HB3 ALA 18 1.495 7.145 -4.143
119 H MET 19 H MET 19 1.199 7.882 -0.179
120 HA MET 19 HA MET 19 -0.790 9.598 -1.193
121 HB3 MET 19 HB3 MET 19 -1.370 9.682 1.365
122 HG3 MET 19 HG3 MET 19 -1.209 6.801 0.864
123 HE1 MET 19 HE1 MET 19 -4.078 7.090 -0.880
124 HE2 MET 19 HE2 MET 19 -5.315 8.052 -0.036
125 HE3 MET 19 HE3 MET 19 -3.976 8.868 -0.879
126 H PHE 20 H PHE 20 2.269 10.026 0.574
127 HA PHE 20 HA PHE 20 1.915 12.484 1.699
128 HB3 PHE 20 HB3 PHE 20 4.485 12.636 0.948
129 HD1 PHE 20 HD1 PHE 20 3.449 9.194 1.851
130 HD2 PHE 20 HD2 PHE 20 4.906 12.927 3.246
131 HE1 PHE 20 HE1 PHE 20 3.896 8.178 4.102
132 HE2 PHE 20 HE2 PHE 20 5.352 11.912 5.498
133 HZ PHE 20 HZ PHE 20 4.841 9.550 5.899
134 H TYR 21 H TYR 21 3.152 11.789 -1.653
135 HA TYR 21 HA TYR 21 3.608 14.258 -2.572
136 HB3 TYR 21 HB3 TYR 21 2.739 13.257 -4.774
137 HD1 TYR 21 HD1 TYR 21 3.310 10.215 -2.777
138 HD2 TYR 21 HD2 TYR 21 5.145 13.266 -5.149
139 HE1 TYR 21 HE1 TYR 21 5.439 8.833 -2.920
140 HE2 TYR 21 HE2 TYR 21 7.268 11.874 -5.284
141 HH TYR 21 HH TYR 21 7.914 9.561 -5.120
142 H GLU 22 H GLU 22 0.335 12.677 -2.532
143 HA GLU 22 HA GLU 22 -1.031 14.745 -3.661
144 HB3 GLU 22 HB3 GLU 22 -2.505 13.401 -1.478
145 HG3 GLU 22 HG3 GLU 22 -2.840 12.975 -4.461
146 HE2 GLU 22 HE2 GLU 22 -5.501 14.320 -3.645
147 H GLY 23 H GLY 23 -0.635 14.073 -0.103
148 HA2 GLY 23 HA2 GLY 23 -1.566 16.772 0.504
149 HA3 GLY 23 HA3 GLY 23 -1.262 15.465 1.632
150 H LEU 24 H LEU 24 0.822 16.920 -0.966
151 HA LEU 24 HA LEU 24 3.132 16.793 0.601
152 HB3 LEU 24 HB3 LEU 24 3.352 18.831 -1.379
153 HG LEU 24 HG LEU 24 4.289 15.982 -1.159
154 HD11 LEU 24 HD11 LEU 24 3.564 16.843 -3.593
155 HD12 LEU 24 HD12 LEU 24 5.201 17.539 -3.517
156 HD13 LEU 24 HD13 LEU 24 4.969 15.787 -3.309
157 HD21 LEU 24 HD21 LEU 24 5.388 17.955 0.028
158 HD22 LEU 24 HD22 LEU 24 6.439 16.909 -0.956
159 HD23 LEU 24 HD23 LEU 24 5.915 18.489 -1.586
160 H LYS 25 H LYS 25 1.283 19.750 -0.440
161 HA LYS 25 HA LYS 25 2.471 21.167 1.795
162 HB3 LYS 25 HB3 LYS 25 2.414 22.147 -0.496
163 HG3 LYS 25 HG3 LYS 25 -0.031 23.269 -0.814
164 HD3 LYS 25 HD3 LYS 25 1.450 21.148 -2.049
165 HE3 LYS 25 HE3 LYS 25 -1.404 20.527 -2.588
166 HZ1 LYS 25 HZ1 LYS 25 0.780 19.417 -3.313
167 HZ2 LYS 25 HZ2 LYS 25 0.695 18.642 -1.877
168 HZ3 LYS 25 HZ3 LYS 25 -0.511 18.480 -2.966
Start of MODEL 11
1 H1 LYS 1 H1 LYS 1 -2.743 -21.159 5.946
2 HA LYS 1 HA LYS 1 -1.023 -19.892 5.393
3 HB3 LYS 1 HB3 LYS 1 0.094 -21.737 3.366
4 HG3 LYS 1 HG3 LYS 1 1.171 -20.875 6.082
5 HD3 LYS 1 HD3 LYS 1 3.349 -20.999 4.719
6 HE3 LYS 1 HE3 LYS 1 2.042 -22.947 6.159
7 HZ1 LYS 1 HZ1 LYS 1 1.729 -24.780 4.922
8 HZ2 LYS 1 HZ2 LYS 1 1.399 -23.695 3.748
9 HZ3 LYS 1 HZ3 LYS 1 2.866 -24.410 3.811
10 H ASN 2 H ASN 2 -0.203 -18.370 3.793
11 HA ASN 2 HA ASN 2 -1.095 -18.496 1.149
12 HB3 ASN 2 HB3 ASN 2 -2.592 -16.627 3.055
13 HD21 ASN 2 HD22 ASN 2 -3.801 -14.996 2.197
14 HD22 ASN 2 HD21 ASN 2 -3.592 -14.365 0.598
15 H THR 3 H THR 3 0.787 -17.591 0.293
16 HA THR 3 HA THR 3 2.024 -15.370 1.754
17 HB THR 3 HB THR 3 2.968 -17.446 -0.271
18 HG1 THR 3 HG1 THR 3 3.727 -16.438 2.382
19 HG21 THR 3 HG21 THR 3 4.672 -16.085 -0.946
20 HG22 THR 3 HG22 THR 3 3.944 -14.736 -0.042
21 HG23 THR 3 HG23 THR 3 5.117 -15.810 0.755
22 H ALA 4 H ALA 4 0.165 -13.980 1.035
23 HA ALA 4 HA ALA 4 0.602 -13.114 -1.739
24 HB1 ALA 4 HB1 ALA 4 -1.663 -12.614 -1.886
25 HB2 ALA 4 HB2 ALA 4 -1.699 -14.037 -0.817
26 HB3 ALA 4 HB3 ALA 4 -1.839 -12.402 -0.127
27 H GLY 5 H GLY 5 0.427 -12.213 1.709
28 HA2 GLY 5 HA2 GLY 5 0.476 -9.419 1.395
29 HA3 GLY 5 HA3 GLY 5 0.989 -10.330 2.801
30 H GLU 6 H GLU 6 2.998 -11.943 1.213
31 HA GLU 6 HA GLU 6 5.206 -10.460 1.740
32 HB3 GLU 6 HB3 GLU 6 6.205 -12.078 -0.167
33 HG3 GLU 6 HG3 GLU 6 5.318 -13.883 1.878
34 HE2 GLU 6 HE2 GLU 6 7.738 -11.316 1.788
35 H MET 7 H MET 7 2.969 -10.161 -0.921
36 HA MET 7 HA MET 7 4.922 -8.645 -2.442
37 HB3 MET 7 HB3 MET 7 2.773 -8.652 -4.063
38 HG3 MET 7 HG3 MET 7 4.130 -11.332 -3.580
39 HE1 MET 7 HE1 MET 7 5.531 -11.667 -5.901
40 HE2 MET 7 HE2 MET 7 4.274 -12.894 -6.192
41 HE3 MET 7 HE3 MET 7 4.682 -11.719 -7.466
42 H ALA 8 H ALA 8 1.352 -8.324 -1.802
43 HA ALA 8 HA ALA 8 1.211 -5.619 -2.219
44 HB1 ALA 8 HB1 ALA 8 -0.884 -6.493 -2.041
45 HB2 ALA 8 HB2 ALA 8 -0.385 -7.712 -0.844
46 HB3 ALA 8 HB3 ALA 8 -0.717 -6.041 -0.328
47 H GLY 9 H GLY 9 2.671 -7.394 0.423
48 HA2 GLY 9 HA2 GLY 9 2.452 -5.609 2.531
49 HA3 GLY 9 HA3 GLY 9 3.782 -6.717 2.254
50 H ALA 10 H ALA 10 4.403 -5.460 -0.449
51 HA ALA 10 HA ALA 10 5.959 -3.251 0.639
52 HB1 ALA 10 HB1 ALA 10 6.412 -5.359 -1.227
53 HB2 ALA 10 HB2 ALA 10 6.487 -3.830 -2.135
54 HB3 ALA 10 HB3 ALA 10 7.541 -4.079 -0.722
55 H PHE 11 H PHE 11 3.072 -3.915 -1.171
56 HA PHE 11 HA PHE 11 3.137 -1.525 -2.729
57 HB3 PHE 11 HB3 PHE 11 0.599 -2.278 -2.893
58 HD1 PHE 11 HD1 PHE 11 3.506 -4.635 -2.929
59 HD2 PHE 11 HD2 PHE 11 0.339 -2.834 -5.104
60 HE1 PHE 11 HE1 PHE 11 4.232 -5.857 -4.998
61 HE2 PHE 11 HE2 PHE 11 1.065 -4.056 -7.172
62 HZ PHE 11 HZ PHE 11 3.002 -5.553 -7.095
63 H VAL 12 H VAL 12 1.768 -2.568 0.422
64 HA VAL 12 HA VAL 12 -0.033 -0.601 0.906
65 HB VAL 12 HB VAL 12 0.917 -0.848 3.339
66 HG11 VAL 12 HG11 VAL 12 -0.155 -3.335 1.986
67 HG12 VAL 12 HG12 VAL 12 -0.441 -2.765 3.648
68 HG13 VAL 12 HG13 VAL 12 -1.155 -1.890 2.272
69 HG21 VAL 12 HG21 VAL 12 2.089 -3.391 2.264
70 HG22 VAL 12 HG22 VAL 12 3.067 -1.904 2.217
71 HG23 VAL 12 HG23 VAL 12 2.448 -2.514 3.771
72 H ALA 13 H ALA 13 3.548 -0.411 0.995
73 HA ALA 13 HA ALA 13 3.553 2.227 2.081
74 HB1 ALA 13 HB1 ALA 13 5.898 2.048 1.922
75 HB2 ALA 13 HB2 ALA 13 5.366 0.370 2.190
76 HB3 ALA 13 HB3 ALA 13 5.812 0.913 0.554
77 H VAL 14 H VAL 14 4.128 0.776 -1.198
78 HA VAL 14 HA VAL 14 4.624 3.099 -2.560
79 HB VAL 14 HB VAL 14 3.165 0.595 -3.423
80 HG11 VAL 14 HG11 VAL 14 2.733 1.656 -5.343
81 HG12 VAL 14 HG12 VAL 14 3.695 3.072 -4.857
82 HG13 VAL 14 HG13 VAL 14 4.488 1.682 -5.634
83 HG21 VAL 14 HG21 VAL 14 5.832 0.992 -2.631
84 HG22 VAL 14 HG22 VAL 14 5.155 -0.416 -3.482
85 HG23 VAL 14 HG23 VAL 14 5.872 0.923 -4.409
86 H PHE 15 H PHE 15 1.683 2.031 -1.012
87 HA PHE 15 HA PHE 15 0.020 3.758 -2.623
88 HB3 PHE 15 HB3 PHE 15 -0.246 1.798 -0.303
89 HD1 PHE 15 HD2 PHE 15 -2.634 3.813 -2.360
90 HD2 PHE 15 HD1 PHE 15 -1.624 2.290 1.470
91 HE1 PHE 15 HE2 PHE 15 -4.732 4.810 -1.411
92 HE2 PHE 15 HE1 PHE 15 -3.722 3.288 2.419
93 HZ PHE 15 HZ PHE 15 -5.251 4.536 0.967
94 H LEU 16 H LEU 16 1.078 3.484 0.843
95 HA LEU 16 HA LEU 16 -0.159 5.868 1.640
96 HB3 LEU 16 HB3 LEU 16 2.181 4.358 2.815
97 HG LEU 16 HG LEU 16 1.968 6.637 3.796
98 HD11 LEU 16 HD11 LEU 16 -0.485 6.156 5.268
99 HD12 LEU 16 HD12 LEU 16 0.022 7.575 4.318
100 HD13 LEU 16 HD13 LEU 16 -0.775 6.204 3.512
101 HD21 LEU 16 HD21 LEU 16 2.062 4.130 5.114
102 HD22 LEU 16 HD22 LEU 16 2.725 5.693 5.652
103 HD23 LEU 16 HD23 LEU 16 1.075 5.218 6.120
104 H LEU 17 H LEU 17 3.233 5.113 0.609
105 HA LEU 17 HA LEU 17 4.234 7.673 0.951
106 HB3 LEU 17 HB3 LEU 17 5.047 5.174 -0.206
107 HG LEU 17 HG LEU 17 5.055 6.532 -2.350
108 HD11 LEU 17 HD11 LEU 17 5.939 8.589 -0.858
109 HD12 LEU 17 HD12 LEU 17 7.495 7.959 -1.452
110 HD13 LEU 17 HD13 LEU 17 6.231 8.443 -2.608
111 HD21 LEU 17 HD21 LEU 17 7.785 6.037 -2.403
112 HD22 LEU 17 HD22 LEU 17 7.174 4.933 -1.148
113 HD23 LEU 17 HD23 LEU 17 6.487 4.883 -2.790
114 H ALA 18 H ALA 18 2.124 6.292 -1.531
115 HA ALA 18 HA ALA 18 2.587 8.360 -3.432
116 HB1 ALA 18 HB1 ALA 18 0.306 6.365 -3.113
117 HB2 ALA 18 HB2 ALA 18 0.638 7.344 -4.562
118 HB3 ALA 18 HB3 ALA 18 1.801 6.101 -4.042
119 H MET 19 H MET 19 0.265 7.742 -0.757
120 HA MET 19 HA MET 19 -1.238 10.072 -1.431
121 HB3 MET 19 HB3 MET 19 -1.754 9.130 1.262
122 HG3 MET 19 HG3 MET 19 -3.395 8.093 -1.021
123 HE1 MET 19 HE1 MET 19 -5.200 10.898 2.062
124 HE2 MET 19 HE2 MET 19 -3.619 11.175 1.292
125 HE3 MET 19 HE3 MET 19 -5.093 11.106 0.297
126 H PHE 20 H PHE 20 1.792 9.702 -0.152
127 HA PHE 20 HA PHE 20 1.493 11.641 1.981
128 HB3 PHE 20 HB3 PHE 20 3.868 10.143 0.719
129 HD1 PHE 20 HD1 PHE 20 4.869 12.605 0.946
130 HD2 PHE 20 HD2 PHE 20 3.890 10.069 4.205
131 HE1 PHE 20 HE1 PHE 20 6.452 13.882 2.417
132 HE2 PHE 20 HE2 PHE 20 5.474 11.346 5.675
133 HZ PHE 20 HZ PHE 20 6.736 13.237 4.763
134 H TYR 21 H TYR 21 2.379 11.449 -1.422
135 HA TYR 21 HA TYR 21 4.125 13.529 -1.715
136 HB3 TYR 21 HB3 TYR 21 2.623 13.757 -3.938
137 HD1 TYR 21 HD1 TYR 21 2.954 10.223 -2.822
138 HD2 TYR 21 HD2 TYR 21 4.697 13.429 -5.056
139 HE1 TYR 21 HE1 TYR 21 4.652 8.614 -3.821
140 HE2 TYR 21 HE2 TYR 21 6.388 11.810 -6.047
141 HH TYR 21 HH TYR 21 6.900 8.738 -4.778
142 H GLU 22 H GLU 22 0.508 13.785 -2.056
143 HA GLU 22 HA GLU 22 0.638 16.588 -2.056
144 HB3 GLU 22 HB3 GLU 22 -1.994 15.874 -1.375
145 HG3 GLU 22 HG3 GLU 22 -1.738 15.658 -4.198
146 HE2 GLU 22 HE2 GLU 22 -4.266 17.889 -3.583
147 H GLY 23 H GLY 23 0.681 14.169 0.445
148 HA2 GLY 23 HA2 GLY 23 -0.364 15.960 2.496
149 HA3 GLY 23 HA3 GLY 23 0.122 14.286 2.682
150 H LEU 24 H LEU 24 2.037 16.889 1.085
151 HA LEU 24 HA LEU 24 3.782 17.021 3.405
152 HB3 LEU 24 HB3 LEU 24 4.403 15.177 1.588
153 HG LEU 24 HG LEU 24 4.754 17.318 -0.055
154 HD11 LEU 24 HD11 LEU 24 6.909 18.141 -0.105
155 HD12 LEU 24 HD12 LEU 24 6.604 18.022 1.645
156 HD13 LEU 24 HD13 LEU 24 7.572 16.774 0.823
157 HD21 LEU 24 HD21 LEU 24 5.113 15.594 -1.400
158 HD22 LEU 24 HD22 LEU 24 6.770 15.450 -0.767
159 HD23 LEU 24 HD23 LEU 24 5.443 14.543 -0.001
160 H LYS 25 H LYS 25 5.447 18.818 3.098
161 HA LYS 25 HA LYS 25 5.614 21.038 2.928
162 HB3 LYS 25 HB3 LYS 25 6.737 20.123 0.905
163 HG3 LYS 25 HG3 LYS 25 3.963 20.520 -0.200
164 HD3 LYS 25 HD3 LYS 25 6.249 20.518 -2.147
165 HE3 LYS 25 HE3 LYS 25 4.618 21.950 -3.419
166 HZ1 LYS 25 HZ1 LYS 25 4.192 19.283 -2.592
167 HZ2 LYS 25 HZ2 LYS 25 2.781 20.011 -2.973
168 HZ3 LYS 25 HZ3 LYS 25 3.991 19.952 -4.068
Start of MODEL 12
1 H1 LYS 1 H1 LYS 1 0.896 -20.381 -1.733
2 HA LYS 1 HA LYS 1 -1.584 -19.229 -2.800
3 HB3 LYS 1 HB3 LYS 1 -1.435 -21.693 -2.901
4 HG3 LYS 1 HG3 LYS 1 -1.471 -21.586 0.146
5 HD3 LYS 1 HD3 LYS 1 -0.560 -24.070 -0.680
6 HE3 LYS 1 HE3 LYS 1 -2.471 -23.309 0.972
7 HZ1 LYS 1 HZ1 LYS 1 -3.976 -23.951 -1.470
8 HZ2 LYS 1 HZ2 LYS 1 -4.628 -23.772 0.017
9 HZ3 LYS 1 HZ3 LYS 1 -3.934 -22.496 -0.731
10 H ASN 2 H ASN 2 0.578 -19.586 -0.012
11 HA ASN 2 HA ASN 2 -1.324 -17.996 1.519
12 HB3 ASN 2 HB3 ASN 2 -0.649 -20.204 2.533
13 HD21 ASN 2 HD22 ASN 2 0.963 -21.111 1.094
14 HD22 ASN 2 HD21 ASN 2 2.634 -21.116 1.551
15 H THR 3 H THR 3 0.839 -17.270 -0.606
16 HA THR 3 HA THR 3 2.270 -15.330 1.078
17 HB THR 3 HB THR 3 3.336 -17.224 -1.062
18 HG1 THR 3 HG1 THR 3 3.517 -17.886 1.150
19 HG21 THR 3 HG21 THR 3 4.067 -14.496 -0.873
20 HG22 THR 3 HG22 THR 3 5.276 -15.351 0.114
21 HG23 THR 3 HG23 THR 3 5.046 -15.797 -1.593
22 H ALA 4 H ALA 4 0.323 -14.034 0.473
23 HA ALA 4 HA ALA 4 0.604 -13.039 -2.278
24 HB1 ALA 4 HB1 ALA 4 -1.587 -13.715 -2.239
25 HB2 ALA 4 HB2 ALA 4 -1.717 -13.560 -0.470
26 HB3 ALA 4 HB3 ALA 4 -1.808 -12.110 -1.501
27 H GLY 5 H GLY 5 0.529 -12.291 1.204
28 HA2 GLY 5 HA2 GLY 5 0.401 -9.474 0.965
29 HA3 GLY 5 HA3 GLY 5 0.947 -10.398 2.349
30 H GLU 6 H GLU 6 2.971 -11.855 0.494
31 HA GLU 6 HA GLU 6 5.142 -10.305 1.148
32 HB3 GLU 6 HB3 GLU 6 5.531 -12.052 -1.209
33 HG3 GLU 6 HG3 GLU 6 7.201 -13.079 0.262
34 HE2 GLU 6 HE2 GLU 6 8.077 -9.393 1.285
35 H MET 7 H MET 7 2.823 -9.899 -1.375
36 HA MET 7 HA MET 7 4.712 -8.307 -2.913
37 HB3 MET 7 HB3 MET 7 2.631 -8.340 -4.554
38 HG3 MET 7 HG3 MET 7 4.373 -10.728 -3.849
39 HE1 MET 7 HE1 MET 7 3.198 -10.613 -7.822
40 HE2 MET 7 HE2 MET 7 4.710 -10.825 -6.907
41 HE3 MET 7 HE3 MET 7 3.800 -12.250 -7.465
42 H ALA 8 H ALA 8 1.171 -8.172 -2.062
43 HA ALA 8 HA ALA 8 0.990 -5.406 -2.380
44 HB1 ALA 8 HB1 ALA 8 -1.118 -6.227 -2.357
45 HB2 ALA 8 HB2 ALA 8 -0.650 -7.645 -1.388
46 HB3 ALA 8 HB3 ALA 8 -1.004 -6.096 -0.586
47 H GLY 9 H GLY 9 2.511 -7.331 0.057
48 HA2 GLY 9 HA2 GLY 9 2.099 -5.751 2.342
49 HA3 GLY 9 HA3 GLY 9 3.439 -6.842 2.044
50 H ALA 10 H ALA 10 4.229 -5.402 -0.504
51 HA ALA 10 HA ALA 10 5.751 -3.314 0.823
52 HB1 ALA 10 HB1 ALA 10 7.176 -4.625 -0.457
53 HB2 ALA 10 HB2 ALA 10 5.953 -4.912 -1.719
54 HB3 ALA 10 HB3 ALA 10 6.781 -3.339 -1.622
55 H PHE 11 H PHE 11 2.914 -3.749 -1.143
56 HA PHE 11 HA PHE 11 3.036 -1.251 -2.481
57 HB3 PHE 11 HB3 PHE 11 1.054 -3.474 -1.880
58 HD1 PHE 11 HD2 PHE 11 0.922 -0.355 -3.942
59 HD2 PHE 11 HD1 PHE 11 -1.136 -3.012 -1.351
60 HE1 PHE 11 HE2 PHE 11 -1.173 0.999 -4.218
61 HE2 PHE 11 HE1 PHE 11 -3.231 -1.657 -1.626
62 HZ PHE 11 HZ PHE 11 -3.224 0.331 -3.056
63 H VAL 12 H VAL 12 1.397 -2.479 0.503
64 HA VAL 12 HA VAL 12 -0.209 -0.436 1.148
65 HB VAL 12 HB VAL 12 0.745 -0.936 3.572
66 HG11 VAL 12 HG11 VAL 12 -0.480 -3.397 2.819
67 HG12 VAL 12 HG12 VAL 12 -1.218 -1.989 3.618
68 HG13 VAL 12 HG13 VAL 12 -1.216 -2.104 1.842
69 HG21 VAL 12 HG21 VAL 12 2.766 -2.101 2.424
70 HG22 VAL 12 HG22 VAL 12 1.996 -2.890 3.823
71 HG23 VAL 12 HG23 VAL 12 1.636 -3.454 2.174
72 H ALA 13 H ALA 13 3.382 -0.510 1.485
73 HA ALA 13 HA ALA 13 3.477 2.073 2.679
74 HB1 ALA 13 HB1 ALA 13 5.170 0.256 3.005
75 HB2 ALA 13 HB2 ALA 13 5.661 0.459 1.306
76 HB3 ALA 13 HB3 ALA 13 5.885 1.793 2.463
77 H VAL 14 H VAL 14 4.363 0.762 -0.596
78 HA VAL 14 HA VAL 14 5.059 3.097 -1.798
79 HB VAL 14 HB VAL 14 3.577 0.690 -2.861
80 HG11 VAL 14 HG11 VAL 14 3.229 1.801 -4.766
81 HG12 VAL 14 HG12 VAL 14 4.121 3.220 -4.168
82 HG13 VAL 14 HG13 VAL 14 4.995 1.893 -4.968
83 HG21 VAL 14 HG21 VAL 14 6.097 0.813 -1.872
84 HG22 VAL 14 HG22 VAL 14 5.594 -0.295 -3.171
85 HG23 VAL 14 HG23 VAL 14 6.405 1.238 -3.572
86 H PHE 15 H PHE 15 1.899 2.095 -0.639
87 HA PHE 15 HA PHE 15 0.523 4.045 -2.260
88 HB3 PHE 15 HB3 PHE 15 -0.193 2.114 0.021
89 HD1 PHE 15 HD2 PHE 15 -1.907 4.027 -2.704
90 HD2 PHE 15 HD1 PHE 15 -2.039 2.604 1.292
91 HE1 PHE 15 HE2 PHE 15 -4.174 5.063 -2.409
92 HE2 PHE 15 HE1 PHE 15 -4.306 3.642 1.587
93 HZ PHE 15 HZ PHE 15 -5.346 4.859 -0.268
94 H LEU 16 H LEU 16 1.373 3.509 1.222
95 HA LEU 16 HA LEU 16 0.140 5.893 2.091
96 HB3 LEU 16 HB3 LEU 16 1.724 3.710 3.207
97 HG LEU 16 HG LEU 16 3.139 5.755 3.830
98 HD11 LEU 16 HD11 LEU 16 2.354 7.383 5.260
99 HD12 LEU 16 HD12 LEU 16 0.941 7.116 4.211
100 HD13 LEU 16 HD13 LEU 16 0.997 6.384 5.833
101 HD21 LEU 16 HD21 LEU 16 2.590 3.434 5.141
102 HD22 LEU 16 HD22 LEU 16 3.801 4.631 5.657
103 HD23 LEU 16 HD23 LEU 16 2.177 4.640 6.383
104 H LEU 17 H LEU 17 3.464 5.010 1.035
105 HA LEU 17 HA LEU 17 4.530 7.562 1.680
106 HB3 LEU 17 HB3 LEU 17 5.721 5.310 1.481
107 HG LEU 17 HG LEU 17 4.959 5.011 -0.999
108 HD11 LEU 17 HD11 LEU 17 7.477 6.281 -1.843
109 HD12 LEU 17 HD12 LEU 17 5.883 6.234 -2.634
110 HD13 LEU 17 HD13 LEU 17 6.200 7.418 -1.343
111 HD21 LEU 17 HD21 LEU 17 6.992 3.731 -1.489
112 HD22 LEU 17 HD22 LEU 17 7.832 4.550 -0.150
113 HD23 LEU 17 HD23 LEU 17 6.446 3.485 0.187
114 H ALA 18 H ALA 18 2.627 6.239 -0.939
115 HA ALA 18 HA ALA 18 3.456 8.290 -2.799
116 HB1 ALA 18 HB1 ALA 18 2.996 6.191 -3.791
117 HB2 ALA 18 HB2 ALA 18 1.508 5.969 -2.841
118 HB3 ALA 18 HB3 ALA 18 1.555 7.174 -4.150
119 H MET 19 H MET 19 1.232 7.893 -0.174
120 HA MET 19 HA MET 19 -0.789 9.576 -1.189
121 HB3 MET 19 HB3 MET 19 -0.583 9.523 1.743
122 HG3 MET 19 HG3 MET 19 -2.629 7.854 1.210
123 HE1 MET 19 HE1 MET 19 -4.931 8.897 2.054
124 HE2 MET 19 HE2 MET 19 -3.521 8.875 3.140
125 HE3 MET 19 HE3 MET 19 -4.575 10.308 3.080
126 H PHE 20 H PHE 20 2.266 10.053 0.569
127 HA PHE 20 HA PHE 20 1.871 12.493 1.717
128 HB3 PHE 20 HB3 PHE 20 4.432 12.703 0.950
129 HD1 PHE 20 HD1 PHE 20 3.465 9.236 1.833
130 HD2 PHE 20 HD2 PHE 20 4.869 12.983 3.245
131 HE1 PHE 20 HE1 PHE 20 3.946 8.211 4.074
132 HE2 PHE 20 HE2 PHE 20 5.350 11.958 5.485
133 HZ PHE 20 HZ PHE 20 4.884 9.584 5.873
134 H TYR 21 H TYR 21 3.005 11.817 -1.671
135 HA TYR 21 HA TYR 21 3.398 14.356 -2.538
136 HB3 TYR 21 HB3 TYR 21 2.693 13.320 -4.768
137 HD1 TYR 21 HD1 TYR 21 3.297 10.268 -2.804
138 HD2 TYR 21 HD2 TYR 21 5.120 13.453 -5.002
139 HE1 TYR 21 HE1 TYR 21 5.489 8.983 -2.861
140 HE2 TYR 21 HE2 TYR 21 7.307 12.158 -5.051
141 HH TYR 21 HH TYR 21 7.660 9.149 -3.257
142 H GLU 22 H GLU 22 0.245 12.562 -2.452
143 HA GLU 22 HA GLU 22 -1.085 14.951 -3.330
144 HB3 GLU 22 HB3 GLU 22 -3.122 13.239 -2.811
145 HG3 GLU 22 HG3 GLU 22 -1.462 12.509 -5.204
146 HE2 GLU 22 HE2 GLU 22 -3.615 11.364 -6.457
147 H GLY 23 H GLY 23 0.340 14.482 -0.571
148 HA2 GLY 23 HA2 GLY 23 -1.964 15.013 1.188
149 HA3 GLY 23 HA3 GLY 23 -0.377 14.462 1.687
150 H LEU 24 H LEU 24 1.294 16.231 0.172
151 HA LEU 24 HA LEU 24 1.522 18.365 1.846
152 HB3 LEU 24 HB3 LEU 24 2.624 19.389 -0.357
153 HG LEU 24 HG LEU 24 3.743 18.263 1.747
154 HD11 LEU 24 HD11 LEU 24 5.094 16.246 0.947
155 HD12 LEU 24 HD12 LEU 24 3.383 15.977 1.355
156 HD13 LEU 24 HD13 LEU 24 3.884 16.097 -0.349
157 HD21 LEU 24 HD21 LEU 24 5.873 18.077 0.000
158 HD22 LEU 24 HD22 LEU 24 4.754 19.177 -0.839
159 HD23 LEU 24 HD23 LEU 24 5.302 19.554 0.813
160 H LYS 25 H LYS 25 1.386 20.797 0.999
161 HA LYS 25 HA LYS 25 0.103 22.517 0.475
162 HB3 LYS 25 HB3 LYS 25 -1.582 22.286 -1.355
163 HG3 LYS 25 HG3 LYS 25 1.295 21.504 -1.522
164 HD3 LYS 25 HD3 LYS 25 1.007 21.212 -4.061
165 HE3 LYS 25 HE3 LYS 25 -0.397 18.859 -2.927
166 HZ1 LYS 25 HZ1 LYS 25 1.107 17.846 -4.194
167 HZ2 LYS 25 HZ2 LYS 25 1.360 19.315 -4.861
168 HZ3 LYS 25 HZ3 LYS 25 2.359 18.766 -3.692
Start of MODEL 13
1 H1 LYS 1 H1 LYS 1 -4.702 -17.216 -2.079
2 HA LYS 1 HA LYS 1 -4.096 -15.175 -0.261
3 HB3 LYS 1 HB3 LYS 1 -4.860 -17.896 0.706
4 HG3 LYS 1 HG3 LYS 1 -4.938 -15.254 1.691
5 HD3 LYS 1 HD3 LYS 1 -7.792 -15.965 1.766
6 HE3 LYS 1 HE3 LYS 1 -6.963 -13.377 0.590
7 HZ1 LYS 1 HZ1 LYS 1 -9.040 -13.468 1.528
8 HZ2 LYS 1 HZ2 LYS 1 -8.568 -14.333 2.831
9 HZ3 LYS 1 HZ3 LYS 1 -8.181 -12.751 2.717
10 H ASN 2 H ASN 2 -2.437 -18.162 -1.210
11 HA ASN 2 HA ASN 2 -0.809 -18.266 1.077
12 HB3 ASN 2 HB3 ASN 2 0.471 -19.431 -1.272
13 HD21 ASN 2 HD22 ASN 2 1.663 -20.876 -0.319
14 HD22 ASN 2 HD21 ASN 2 1.237 -21.883 1.024
15 H THR 3 H THR 3 1.131 -17.144 1.469
16 HA THR 3 HA THR 3 2.555 -15.415 1.210
17 HB THR 3 HB THR 3 3.168 -17.128 -1.257
18 HG1 THR 3 HG1 THR 3 4.094 -18.441 0.316
19 HG21 THR 3 HG21 THR 3 4.694 -15.331 -1.456
20 HG22 THR 3 HG22 THR 3 4.703 -15.024 0.297
21 HG23 THR 3 HG23 THR 3 5.580 -16.423 -0.365
22 H ALA 4 H ALA 4 0.494 -14.055 0.808
23 HA ALA 4 HA ALA 4 0.703 -12.892 -1.884
24 HB1 ALA 4 HB1 ALA 4 -1.515 -13.312 -1.917
25 HB2 ALA 4 HB2 ALA 4 -1.551 -13.676 -0.174
26 HB3 ALA 4 HB3 ALA 4 -1.670 -11.990 -0.734
27 H GLY 5 H GLY 5 0.711 -12.364 1.646
28 HA2 GLY 5 HA2 GLY 5 0.609 -9.560 1.649
29 HA3 GLY 5 HA3 GLY 5 1.288 -10.588 2.896
30 H GLU 6 H GLU 6 3.282 -11.904 1.125
31 HA GLU 6 HA GLU 6 5.387 -10.219 1.559
32 HB3 GLU 6 HB3 GLU 6 6.532 -11.753 -0.232
33 HG3 GLU 6 HG3 GLU 6 5.711 -13.789 1.514
34 HE2 GLU 6 HE2 GLU 6 7.777 -14.440 1.273
35 H MET 7 H MET 7 2.958 -10.103 -0.916
36 HA MET 7 HA MET 7 4.683 -8.550 -2.651
37 HB3 MET 7 HB3 MET 7 1.937 -9.852 -2.894
38 HG3 MET 7 HG3 MET 7 2.852 -7.408 -4.259
39 HE1 MET 7 HE1 MET 7 0.282 -9.561 -5.964
40 HE2 MET 7 HE2 MET 7 0.535 -7.967 -6.715
41 HE3 MET 7 HE3 MET 7 0.882 -9.449 -7.636
42 H ALA 8 H ALA 8 1.157 -8.200 -1.888
43 HA ALA 8 HA ALA 8 1.071 -5.481 -2.185
44 HB1 ALA 8 HB1 ALA 8 -1.068 -6.158 -1.971
45 HB2 ALA 8 HB2 ALA 8 -0.589 -7.619 -1.074
46 HB3 ALA 8 HB3 ALA 8 -0.818 -6.081 -0.210
47 H GLY 9 H GLY 9 2.477 -7.395 0.393
48 HA2 GLY 9 HA2 GLY 9 2.296 -5.686 2.567
49 HA3 GLY 9 HA3 GLY 9 3.600 -6.813 2.250
50 H ALA 10 H ALA 10 4.324 -5.513 -0.376
51 HA ALA 10 HA ALA 10 5.869 -3.339 0.797
52 HB1 ALA 10 HB1 ALA 10 6.794 -3.651 -1.755
53 HB2 ALA 10 HB2 ALA 10 7.398 -4.572 -0.356
54 HB3 ALA 10 HB3 ALA 10 6.168 -5.286 -1.427
55 H PHE 11 H PHE 11 3.055 -3.952 -1.146
56 HA PHE 11 HA PHE 11 3.202 -1.575 -2.697
57 HB3 PHE 11 HB3 PHE 11 0.722 -2.240 -3.042
58 HD1 PHE 11 HD2 PHE 11 3.989 -3.324 -3.483
59 HD2 PHE 11 HD1 PHE 11 -0.010 -4.572 -4.167
60 HE1 PHE 11 HE2 PHE 11 4.781 -4.872 -5.292
61 HE2 PHE 11 HE1 PHE 11 0.784 -6.120 -5.977
62 HZ PHE 11 HZ PHE 11 3.170 -6.252 -6.518
63 H VAL 12 H VAL 12 1.714 -2.544 0.428
64 HA VAL 12 HA VAL 12 -0.027 -0.526 0.865
65 HB VAL 12 HB VAL 12 0.911 -0.747 3.315
66 HG11 VAL 12 HG11 VAL 12 -1.142 -1.842 2.040
67 HG12 VAL 12 HG12 VAL 12 -0.167 -3.319 2.219
68 HG13 VAL 12 HG13 VAL 12 -0.654 -2.394 3.660
69 HG21 VAL 12 HG21 VAL 12 2.357 -2.491 3.779
70 HG22 VAL 12 HG22 VAL 12 2.004 -3.337 2.253
71 HG23 VAL 12 HG23 VAL 12 3.030 -1.883 2.247
72 H ALA 13 H ALA 13 3.558 -0.408 1.007
73 HA ALA 13 HA ALA 13 3.629 2.228 2.067
74 HB1 ALA 13 HB1 ALA 13 5.414 0.355 2.140
75 HB2 ALA 13 HB2 ALA 13 5.821 0.861 0.483
76 HB3 ALA 13 HB3 ALA 13 5.972 2.016 1.829
77 H VAL 14 H VAL 14 4.219 0.818 -1.233
78 HA VAL 14 HA VAL 14 4.665 3.160 -2.567
79 HB VAL 14 HB VAL 14 3.225 0.662 -3.479
80 HG11 VAL 14 HG11 VAL 14 3.742 3.155 -4.857
81 HG12 VAL 14 HG12 VAL 14 4.630 1.818 -5.629
82 HG13 VAL 14 HG13 VAL 14 2.866 1.710 -5.416
83 HG21 VAL 14 HG21 VAL 14 5.972 1.024 -4.380
84 HG22 VAL 14 HG22 VAL 14 5.857 0.991 -2.604
85 HG23 VAL 14 HG23 VAL 14 5.211 -0.363 -3.562
86 H PHE 15 H PHE 15 1.730 2.007 -1.056
87 HA PHE 15 HA PHE 15 0.046 3.738 -2.640
88 HB3 PHE 15 HB3 PHE 15 -0.354 1.999 -0.132
89 HD1 PHE 15 HD2 PHE 15 -2.432 2.874 -3.101
90 HD2 PHE 15 HD1 PHE 15 -2.095 2.870 1.129
91 HE1 PHE 15 HE2 PHE 15 -4.801 3.679 -2.912
92 HE2 PHE 15 HE1 PHE 15 -4.465 3.675 1.318
93 HZ PHE 15 HZ PHE 15 -5.790 4.070 -0.705
94 H LEU 16 H LEU 16 1.112 3.439 0.821
95 HA LEU 16 HA LEU 16 -0.163 5.804 1.635
96 HB3 LEU 16 HB3 LEU 16 2.168 4.294 2.823
97 HG LEU 16 HG LEU 16 1.946 6.544 3.840
98 HD11 LEU 16 HD11 LEU 16 -0.811 6.096 3.504
99 HD12 LEU 16 HD12 LEU 16 -0.527 6.127 5.261
100 HD13 LEU 16 HD13 LEU 16 -0.013 7.501 4.252
101 HD21 LEU 16 HD21 LEU 16 2.617 5.590 5.726
102 HD22 LEU 16 HD22 LEU 16 0.955 5.082 6.108
103 HD23 LEU 16 HD23 LEU 16 2.002 4.032 5.124
104 H LEU 17 H LEU 17 3.245 5.076 0.641
105 HA LEU 17 HA LEU 17 4.225 7.639 1.025
106 HB3 LEU 17 HB3 LEU 17 5.072 5.155 -0.137
107 HG LEU 17 HG LEU 17 5.095 6.550 -2.271
108 HD11 LEU 17 HD11 LEU 17 5.960 8.587 -0.782
109 HD12 LEU 17 HD12 LEU 17 7.540 7.928 -1.275
110 HD13 LEU 17 HD13 LEU 17 6.357 8.424 -2.510
111 HD21 LEU 17 HD21 LEU 17 7.315 5.761 -2.925
112 HD22 LEU 17 HD22 LEU 17 7.736 5.500 -1.215
113 HD23 LEU 17 HD23 LEU 17 6.446 4.534 -1.972
114 H ALA 18 H ALA 18 2.162 6.269 -1.501
115 HA ALA 18 HA ALA 18 2.641 8.352 -3.380
116 HB1 ALA 18 HB1 ALA 18 1.883 6.141 -4.080
117 HB2 ALA 18 HB2 ALA 18 0.416 6.294 -3.083
118 HB3 ALA 18 HB3 ALA 18 0.644 7.347 -4.499
119 H MET 19 H MET 19 0.282 7.710 -0.744
120 HA MET 19 HA MET 19 -1.218 10.038 -1.421
121 HB3 MET 19 HB3 MET 19 -1.762 9.083 1.261
122 HG3 MET 19 HG3 MET 19 -3.595 7.885 -0.548
123 HE1 MET 19 HE1 MET 19 -5.592 8.762 2.420
124 HE2 MET 19 HE2 MET 19 -4.914 7.565 1.292
125 HE3 MET 19 HE3 MET 19 -3.892 8.261 2.572
126 H PHE 20 H PHE 20 1.799 9.675 -0.110
127 HA PHE 20 HA PHE 20 1.470 11.600 2.030
128 HB3 PHE 20 HB3 PHE 20 3.864 10.122 0.780
129 HD1 PHE 20 HD1 PHE 20 4.852 12.586 1.027
130 HD2 PHE 20 HD2 PHE 20 3.855 10.032 4.266
131 HE1 PHE 20 HE1 PHE 20 6.417 13.865 2.517
132 HE2 PHE 20 HE2 PHE 20 5.420 11.310 5.756
133 HZ PHE 20 HZ PHE 20 6.682 13.211 4.864
134 H TYR 21 H TYR 21 2.378 11.437 -1.367
135 HA TYR 21 HA TYR 21 4.113 13.542 -1.616
136 HB3 TYR 21 HB3 TYR 21 2.670 13.743 -3.877
137 HD1 TYR 21 HD1 TYR 21 2.999 10.213 -2.750
138 HD2 TYR 21 HD2 TYR 21 4.783 13.432 -4.932
139 HE1 TYR 21 HE1 TYR 21 4.735 8.617 -3.698
140 HE2 TYR 21 HE2 TYR 21 6.513 11.825 -5.873
141 HH TYR 21 HH TYR 21 7.355 9.177 -4.666
142 H GLU 22 H GLU 22 0.578 13.850 -2.388
143 HA GLU 22 HA GLU 22 0.609 16.362 -0.946
144 HB3 GLU 22 HB3 GLU 22 -0.866 17.156 -3.070
145 HG3 GLU 22 HG3 GLU 22 1.629 17.758 -4.041
146 HE2 GLU 22 HE2 GLU 22 2.318 19.473 -1.620
147 H GLY 23 H GLY 23 -0.577 13.432 -0.942
148 HA2 GLY 23 HA2 GLY 23 -2.443 12.681 0.157
149 HA3 GLY 23 HA3 GLY 23 -3.190 14.260 0.011
150 H LEU 24 H LEU 24 -3.019 14.739 -2.776
151 HA LEU 24 HA LEU 24 -5.264 13.508 -3.717
152 HB3 LEU 24 HB3 LEU 24 -3.926 15.551 -4.546
153 HG LEU 24 HG LEU 24 -2.632 13.342 -6.128
154 HD11 LEU 24 HD11 LEU 24 -2.720 14.396 -8.086
155 HD12 LEU 24 HD12 LEU 24 -4.004 15.408 -7.381
156 HD13 LEU 24 HD13 LEU 24 -2.313 15.965 -7.350
157 HD21 LEU 24 HD21 LEU 24 -1.309 15.934 -5.494
158 HD22 LEU 24 HD22 LEU 24 -1.634 14.820 -4.145
159 HD23 LEU 24 HD23 LEU 24 -0.652 14.280 -5.526
160 H LYS 25 H LYS 25 -1.824 12.486 -4.038
161 HA LYS 25 HA LYS 25 -2.610 10.180 -5.580
162 HB3 LYS 25 HB3 LYS 25 -0.047 9.716 -5.181
163 HG3 LYS 25 HG3 LYS 25 -0.762 12.179 -6.809
164 HD3 LYS 25 HD3 LYS 25 0.632 10.176 -8.283
165 HE3 LYS 25 HE3 LYS 25 0.800 12.780 -8.270
166 HZ1 LYS 25 HZ1 LYS 25 1.424 12.997 -5.980
167 HZ2 LYS 25 HZ2 LYS 25 2.758 12.079 -6.193
168 HZ3 LYS 25 HZ3 LYS 25 2.646 13.536 -6.921
Start of MODEL 14
1 H1 LYS 1 H1 LYS 1 4.063 -22.286 4.341
2 HA LYS 1 HA LYS 1 6.106 -21.093 2.664
3 HB3 LYS 1 HB3 LYS 1 6.193 -23.444 2.688
4 HG3 LYS 1 HG3 LYS 1 3.204 -23.218 2.655
5 HD3 LYS 1 HD3 LYS 1 4.273 -25.870 1.808
6 HE3 LYS 1 HE3 LYS 1 2.181 -25.654 0.311
7 HZ1 LYS 1 HZ1 LYS 1 2.422 -26.247 2.939
8 HZ2 LYS 1 HZ2 LYS 1 1.154 -25.219 2.907
9 HZ3 LYS 1 HZ3 LYS 1 1.128 -26.577 1.999
10 H ASN 2 H ASN 2 5.390 -19.107 1.936
11 HA ASN 2 HA ASN 2 3.637 -19.106 -0.181
12 HB3 ASN 2 HB3 ASN 2 2.423 -17.802 2.308
13 HD21 ASN 2 HD22 ASN 2 0.435 -19.565 0.245
14 HD22 ASN 2 HD21 ASN 2 -0.230 -18.281 -0.708
15 H THR 3 H THR 3 4.230 -17.247 -1.348
16 HA THR 3 HA THR 3 5.322 -14.997 0.207
17 HB THR 3 HB THR 3 7.116 -14.819 -1.429
18 HG1 THR 3 HG1 THR 3 5.662 -17.035 -2.694
19 HG21 THR 3 HG21 THR 3 6.616 -17.778 -0.810
20 HG22 THR 3 HG22 THR 3 8.143 -17.121 -1.444
21 HG23 THR 3 HG23 THR 3 7.578 -16.653 0.178
22 H ALA 4 H ALA 4 2.812 -14.626 -0.062
23 HA ALA 4 HA ALA 4 2.425 -13.255 -2.633
24 HB1 ALA 4 HB1 ALA 4 0.366 -14.294 -0.643
25 HB2 ALA 4 HB2 ALA 4 0.030 -13.565 -2.232
26 HB3 ALA 4 HB3 ALA 4 0.867 -15.134 -2.131
27 H GLY 5 H GLY 5 2.535 -13.004 0.903
28 HA2 GLY 5 HA2 GLY 5 1.346 -10.402 1.043
29 HA3 GLY 5 HA3 GLY 5 2.211 -11.256 2.305
30 H GLU 6 H GLU 6 4.205 -11.421 -0.388
31 HA GLU 6 HA GLU 6 5.884 -9.390 0.706
32 HB3 GLU 6 HB3 GLU 6 6.155 -11.591 -1.316
33 HG3 GLU 6 HG3 GLU 6 7.853 -9.067 -1.230
34 HE2 GLU 6 HE2 GLU 6 10.630 -10.788 -2.574
35 H MET 7 H MET 7 3.390 -9.551 -1.646
36 HA MET 7 HA MET 7 4.537 -7.391 -3.195
37 HB3 MET 7 HB3 MET 7 2.117 -7.851 -4.361
38 HG3 MET 7 HG3 MET 7 4.486 -9.771 -4.596
39 HE1 MET 7 HE1 MET 7 4.298 -11.631 -6.866
40 HE2 MET 7 HE2 MET 7 3.902 -10.644 -8.293
41 HE3 MET 7 HE3 MET 7 5.081 -10.050 -7.099
42 H ALA 8 H ALA 8 1.112 -8.026 -2.192
43 HA ALA 8 HA ALA 8 0.398 -5.373 -2.041
44 HB1 ALA 8 HB1 ALA 8 -1.234 -6.637 -0.200
45 HB2 ALA 8 HB2 ALA 8 -1.492 -6.617 -1.961
46 HB3 ALA 8 HB3 ALA 8 -0.661 -7.994 -1.198
47 H GLY 9 H GLY 9 2.099 -7.458 0.291
48 HA2 GLY 9 HA2 GLY 9 1.726 -5.901 2.599
49 HA3 GLY 9 HA3 GLY 9 3.030 -7.030 2.291
50 H ALA 10 H ALA 10 3.966 -5.642 -0.190
51 HA ALA 10 HA ALA 10 5.455 -3.548 1.173
52 HB1 ALA 10 HB1 ALA 10 6.986 -3.743 -0.699
53 HB2 ALA 10 HB2 ALA 10 6.585 -5.381 -0.128
54 HB3 ALA 10 HB3 ALA 10 5.821 -4.740 -1.604
55 H PHE 11 H PHE 11 2.776 -4.016 -1.010
56 HA PHE 11 HA PHE 11 3.044 -1.545 -2.384
57 HB3 PHE 11 HB3 PHE 11 0.659 -2.158 -3.040
58 HD1 PHE 11 HD2 PHE 11 3.868 -3.271 -3.217
59 HD2 PHE 11 HD1 PHE 11 -0.062 -4.653 -4.024
60 HE1 PHE 11 HE2 PHE 11 4.786 -4.911 -4.882
61 HE2 PHE 11 HE1 PHE 11 0.855 -6.293 -5.687
62 HZ PHE 11 HZ PHE 11 3.269 -6.403 -6.097
63 H VAL 12 H VAL 12 1.233 -2.706 0.512
64 HA VAL 12 HA VAL 12 -0.472 -0.669 0.952
65 HB VAL 12 HB VAL 12 0.240 -1.103 3.453
66 HG11 VAL 12 HG11 VAL 12 -1.106 -3.195 3.413
67 HG12 VAL 12 HG12 VAL 12 -1.847 -1.868 2.487
68 HG13 VAL 12 HG13 VAL 12 -1.011 -3.189 1.635
69 HG21 VAL 12 HG21 VAL 12 1.657 -2.830 3.908
70 HG22 VAL 12 HG22 VAL 12 1.272 -3.694 2.399
71 HG23 VAL 12 HG23 VAL 12 2.380 -2.301 2.369
72 H ALA 13 H ALA 13 3.086 -0.666 1.378
73 HA ALA 13 HA ALA 13 3.137 1.865 2.669
74 HB1 ALA 13 HB1 ALA 13 5.380 0.494 1.147
75 HB2 ALA 13 HB2 ALA 13 5.513 1.634 2.507
76 HB3 ALA 13 HB3 ALA 13 4.874 -0.005 2.779
77 H VAL 14 H VAL 14 4.126 0.771 -0.661
78 HA VAL 14 HA VAL 14 4.693 3.152 -1.773
79 HB VAL 14 HB VAL 14 3.170 0.822 -2.955
80 HG11 VAL 14 HG11 VAL 14 3.819 3.399 -4.107
81 HG12 VAL 14 HG12 VAL 14 4.679 2.096 -4.963
82 HG13 VAL 14 HG13 VAL 14 2.907 2.040 -4.807
83 HG21 VAL 14 HG21 VAL 14 5.121 -0.265 -3.066
84 HG22 VAL 14 HG22 VAL 14 5.954 1.153 -3.747
85 HG23 VAL 14 HG23 VAL 14 5.785 0.982 -1.984
86 H PHE 15 H PHE 15 1.535 1.994 -0.691
87 HA PHE 15 HA PHE 15 0.094 3.988 -2.161
88 HB3 PHE 15 HB3 PHE 15 -1.693 3.072 -0.397
89 HD1 PHE 15 HD2 PHE 15 -2.039 3.235 -3.083
90 HD2 PHE 15 HD1 PHE 15 -0.559 -0.136 -0.973
91 HE1 PHE 15 HE2 PHE 15 -2.760 1.739 -4.967
92 HE2 PHE 15 HE1 PHE 15 -1.279 -1.632 -2.856
93 HZ PHE 15 HZ PHE 15 -2.371 -0.675 -4.830
94 H LEU 16 H LEU 16 0.784 3.360 1.358
95 HA LEU 16 HA LEU 16 -0.333 5.767 2.232
96 HB3 LEU 16 HB3 LEU 16 1.264 3.566 3.329
97 HG LEU 16 HG LEU 16 2.579 5.670 4.031
98 HD11 LEU 16 HD11 LEU 16 1.678 7.245 5.404
99 HD12 LEU 16 HD12 LEU 16 0.221 6.822 4.472
100 HD13 LEU 16 HD13 LEU 16 0.474 6.128 6.091
101 HD21 LEU 16 HD21 LEU 16 2.198 3.277 5.215
102 HD22 LEU 16 HD22 LEU 16 3.255 4.551 5.870
103 HD23 LEU 16 HD23 LEU 16 1.601 4.355 6.499
104 H LEU 17 H LEU 17 2.997 4.850 1.209
105 HA LEU 17 HA LEU 17 4.093 7.375 1.892
106 HB3 LEU 17 HB3 LEU 17 5.012 4.841 1.080
107 HG LEU 17 HG LEU 17 5.170 5.907 -1.248
108 HD11 LEU 17 HD11 LEU 17 7.673 7.258 -0.533
109 HD12 LEU 17 HD12 LEU 17 6.365 7.756 -1.633
110 HD13 LEU 17 HD13 LEU 17 6.216 8.049 0.116
111 HD21 LEU 17 HD21 LEU 17 7.698 5.157 -1.369
112 HD22 LEU 17 HD22 LEU 17 7.371 4.585 0.284
113 HD23 LEU 17 HD23 LEU 17 6.394 3.981 -1.076
114 H ALA 18 H ALA 18 2.179 6.135 -0.759
115 HA ALA 18 HA ALA 18 3.074 8.044 -2.678
116 HB1 ALA 18 HB1 ALA 18 0.964 5.934 -2.440
117 HB2 ALA 18 HB2 ALA 18 0.702 7.221 -3.642
118 HB3 ALA 18 HB3 ALA 18 2.165 6.209 -3.724
119 H MET 19 H MET 19 0.591 7.873 -0.121
120 HA MET 19 HA MET 19 -1.014 9.928 -0.980
121 HB3 MET 19 HB3 MET 19 -0.756 10.010 1.906
122 HG3 MET 19 HG3 MET 19 -2.834 8.229 1.306
123 HE1 MET 19 HE1 MET 19 -5.492 11.211 1.078
124 HE2 MET 19 HE2 MET 19 -4.968 9.738 0.227
125 HE3 MET 19 HE3 MET 19 -5.517 9.642 1.918
126 H PHE 20 H PHE 20 2.234 9.983 0.369
127 HA PHE 20 HA PHE 20 2.173 12.601 1.395
128 HB3 PHE 20 HB3 PHE 20 4.761 12.226 0.941
129 HD1 PHE 20 HD1 PHE 20 2.967 9.128 1.945
130 HD2 PHE 20 HD2 PHE 20 5.117 12.556 3.225
131 HE1 PHE 20 HE1 PHE 20 3.018 8.223 4.286
132 HE2 PHE 20 HE2 PHE 20 5.168 11.650 5.565
133 HZ PHE 20 HZ PHE 20 4.117 9.494 6.069
134 H TYR 21 H TYR 21 2.734 11.212 -1.850
135 HA TYR 21 HA TYR 21 4.071 13.069 -3.200
136 HB3 TYR 21 HB3 TYR 21 2.212 12.568 -5.017
137 HD1 TYR 21 HD2 TYR 21 5.071 11.810 -4.372
138 HD2 TYR 21 HD1 TYR 21 1.502 9.461 -4.590
139 HE1 TYR 21 HE2 TYR 21 6.452 9.752 -4.939
140 HE2 TYR 21 HE1 TYR 21 2.895 7.410 -5.156
141 HH TYR 21 HH TYR 21 5.114 6.612 -4.879
142 H GLU 22 H GLU 22 0.448 13.295 -2.928
143 HA GLU 22 HA GLU 22 0.779 16.147 -2.585
144 HB3 GLU 22 HB3 GLU 22 -1.287 16.254 -4.311
145 HG3 GLU 22 HG3 GLU 22 0.675 16.340 -6.162
146 HE2 GLU 22 HE2 GLU 22 0.147 18.768 -3.157
147 H GLY 23 H GLY 23 -0.172 13.522 -1.148
148 HA2 GLY 23 HA2 GLY 23 -2.942 14.302 -0.552
149 HA3 GLY 23 HA3 GLY 23 -2.176 12.770 -0.180
150 H LEU 24 H LEU 24 -1.103 16.195 0.399
151 HA LEU 24 HA LEU 24 -0.268 15.498 3.041
152 HB3 LEU 24 HB3 LEU 24 0.127 18.048 3.098
153 HG LEU 24 HG LEU 24 1.762 16.042 2.229
154 HD11 LEU 24 HD11 LEU 24 2.086 16.045 0.037
155 HD12 LEU 24 HD12 LEU 24 0.865 17.327 -0.148
156 HD13 LEU 24 HD13 LEU 24 2.576 17.756 0.099
157 HD21 LEU 24 HD21 LEU 24 3.554 17.826 2.190
158 HD22 LEU 24 HD22 LEU 24 2.254 19.018 2.426
159 HD23 LEU 24 HD23 LEU 24 2.544 17.764 3.655
160 H LYS 25 H LYS 25 -2.653 17.936 1.768
161 HA LYS 25 HA LYS 25 -3.844 18.263 4.302
162 HB3 LYS 25 HB3 LYS 25 -3.883 20.022 2.635
163 HG3 LYS 25 HG3 LYS 25 -5.925 19.295 0.855
164 HD3 LYS 25 HD3 LYS 25 -3.009 19.842 0.754
165 HE3 LYS 25 HE3 LYS 25 -3.906 18.997 -1.900
166 HZ1 LYS 25 HZ1 LYS 25 -1.700 17.910 -0.320
167 HZ2 LYS 25 HZ2 LYS 25 -1.785 18.119 -1.938
168 HZ3 LYS 25 HZ3 LYS 25 -1.619 19.413 -0.956
Start of MODEL 15
1 H1 LYS 1 H1 LYS 1 -0.140 -20.830 -5.610
2 HA LYS 1 HA LYS 1 0.386 -17.942 -5.559
3 HB3 LYS 1 HB3 LYS 1 -1.899 -18.227 -4.065
4 HG3 LYS 1 HG3 LYS 1 -1.219 -16.582 -5.972
5 HD3 LYS 1 HD3 LYS 1 -2.924 -18.492 -7.622
6 HE3 LYS 1 HE3 LYS 1 -1.167 -16.807 -9.145
7 HZ1 LYS 1 HZ1 LYS 1 -3.234 -16.008 -9.968
8 HZ2 LYS 1 HZ2 LYS 1 -3.378 -17.618 -9.734
9 HZ3 LYS 1 HZ3 LYS 1 -4.058 -16.574 -8.677
10 H ASN 2 H ASN 2 1.251 -17.139 -3.667
11 HA ASN 2 HA ASN 2 0.995 -18.441 -1.231
12 HB3 ASN 2 HB3 ASN 2 3.734 -18.790 -1.268
13 HD21 ASN 2 HD22 ASN 2 2.246 -19.774 0.403
14 HD22 ASN 2 HD21 ASN 2 1.824 -21.444 0.214
15 H THR 3 H THR 3 2.392 -17.273 0.464
16 HA THR 3 HA THR 3 2.810 -15.215 1.309
17 HB THR 3 HB THR 3 5.117 -14.554 0.672
18 HG1 THR 3 HG1 THR 3 4.735 -16.519 -1.460
19 HG21 THR 3 HG21 THR 3 6.088 -17.036 0.334
20 HG22 THR 3 HG22 THR 3 5.415 -16.537 1.904
21 HG23 THR 3 HG23 THR 3 4.428 -17.499 0.778
22 H ALA 4 H ALA 4 0.677 -14.500 0.225
23 HA ALA 4 HA ALA 4 0.965 -12.822 -2.064
24 HB1 ALA 4 HB1 ALA 4 -1.116 -13.996 -1.661
25 HB2 ALA 4 HB2 ALA 4 -1.269 -13.264 -0.046
26 HB3 ALA 4 HB3 ALA 4 -1.421 -12.250 -1.501
27 H GLY 5 H GLY 5 1.139 -12.474 1.468
28 HA2 GLY 5 HA2 GLY 5 0.756 -9.684 1.616
29 HA3 GLY 5 HA3 GLY 5 1.562 -10.706 2.791
30 H GLU 6 H GLU 6 3.546 -11.747 0.758
31 HA GLU 6 HA GLU 6 5.549 -9.939 1.260
32 HB3 GLU 6 HB3 GLU 6 5.974 -11.549 -1.177
33 HG3 GLU 6 HG3 GLU 6 7.194 -12.107 1.526
34 HE2 GLU 6 HE2 GLU 6 9.520 -13.599 0.270
35 H MET 7 H MET 7 2.980 -9.795 -1.046
36 HA MET 7 HA MET 7 4.500 -7.973 -2.722
37 HB3 MET 7 HB3 MET 7 2.180 -8.173 -4.050
38 HG3 MET 7 HG3 MET 7 4.283 -10.362 -3.781
39 HE1 MET 7 HE1 MET 7 3.640 -10.044 -7.340
40 HE2 MET 7 HE2 MET 7 4.619 -11.287 -6.525
41 HE3 MET 7 HE3 MET 7 3.201 -11.763 -7.491
42 H ALA 8 H ALA 8 1.020 -8.124 -1.676
43 HA ALA 8 HA ALA 8 0.590 -5.407 -1.818
44 HB1 ALA 8 HB1 ALA 8 -1.424 -6.409 -1.579
45 HB2 ALA 8 HB2 ALA 8 -0.726 -7.796 -0.708
46 HB3 ALA 8 HB3 ALA 8 -1.122 -6.299 0.171
47 H GLY 9 H GLY 9 2.419 -7.280 0.491
48 HA2 GLY 9 HA2 GLY 9 2.154 -5.590 2.748
49 HA3 GLY 9 HA3 GLY 9 3.420 -6.762 2.440
50 H ALA 10 H ALA 10 4.230 -5.571 -0.179
51 HA ALA 10 HA ALA 10 5.807 -3.393 0.943
52 HB1 ALA 10 HB1 ALA 10 6.089 -5.424 -1.206
53 HB2 ALA 10 HB2 ALA 10 6.757 -3.818 -1.586
54 HB3 ALA 10 HB3 ALA 10 7.321 -4.698 -0.147
55 H PHE 11 H PHE 11 3.028 -4.014 -1.069
56 HA PHE 11 HA PHE 11 3.262 -1.668 -2.659
57 HB3 PHE 11 HB3 PHE 11 0.879 -2.323 -3.214
58 HD1 PHE 11 HD2 PHE 11 4.050 -3.477 -3.375
59 HD2 PHE 11 HD1 PHE 11 0.094 -4.940 -3.844
60 HE1 PHE 11 HE2 PHE 11 4.904 -5.311 -4.860
61 HE2 PHE 11 HE1 PHE 11 0.949 -6.774 -5.329
62 HZ PHE 11 HZ PHE 11 3.344 -6.937 -5.820
63 H VAL 12 H VAL 12 1.630 -2.566 0.419
64 HA VAL 12 HA VAL 12 -0.086 -0.505 0.752
65 HB VAL 12 HB VAL 12 0.730 -0.719 3.242
66 HG11 VAL 12 HG11 VAL 12 -1.349 -1.665 2.125
67 HG12 VAL 12 HG12 VAL 12 -0.425 -3.168 1.886
68 HG13 VAL 12 HG13 VAL 12 -0.736 -2.567 3.532
69 HG21 VAL 12 HG21 VAL 12 2.861 -1.945 2.230
70 HG22 VAL 12 HG22 VAL 12 2.161 -2.425 3.795
71 HG23 VAL 12 HG23 VAL 12 1.790 -3.363 2.329
72 H ALA 13 H ALA 13 3.490 -0.465 1.044
73 HA ALA 13 HA ALA 13 3.586 2.171 2.094
74 HB1 ALA 13 HB1 ALA 13 5.797 0.760 0.577
75 HB2 ALA 13 HB2 ALA 13 5.929 1.906 1.931
76 HB3 ALA 13 HB3 ALA 13 5.327 0.256 2.218
77 H VAL 14 H VAL 14 4.297 0.758 -1.183
78 HA VAL 14 HA VAL 14 4.809 3.094 -2.497
79 HB VAL 14 HB VAL 14 3.376 0.615 -3.469
80 HG11 VAL 14 HG11 VAL 14 3.110 1.674 -5.416
81 HG12 VAL 14 HG12 VAL 14 3.988 3.102 -4.821
82 HG13 VAL 14 HG13 VAL 14 4.882 1.751 -5.559
83 HG21 VAL 14 HG21 VAL 14 5.976 0.909 -2.487
84 HG22 VAL 14 HG22 VAL 14 5.349 -0.436 -3.468
85 HG23 VAL 14 HG23 VAL 14 6.161 0.937 -4.258
86 H PHE 15 H PHE 15 1.798 1.960 -1.117
87 HA PHE 15 HA PHE 15 0.205 3.725 -2.754
88 HB3 PHE 15 HB3 PHE 15 -0.175 1.742 -0.460
89 HD1 PHE 15 HD2 PHE 15 -2.318 3.888 -2.653
90 HD2 PHE 15 HD1 PHE 15 -1.815 2.014 1.121
91 HE1 PHE 15 HE2 PHE 15 -4.508 4.847 -1.885
92 HE2 PHE 15 HE1 PHE 15 -4.005 2.972 1.888
93 HZ PHE 15 HZ PHE 15 -5.325 4.376 0.376
94 H LEU 16 H LEU 16 1.116 3.377 0.746
95 HA LEU 16 HA LEU 16 -0.172 5.742 1.533
96 HB3 LEU 16 HB3 LEU 16 2.095 4.197 2.798
97 HG LEU 16 HG LEU 16 1.863 6.436 3.833
98 HD11 LEU 16 HD11 LEU 16 -0.888 6.028 3.379
99 HD12 LEU 16 HD12 LEU 16 -0.671 6.057 5.145
100 HD13 LEU 16 HD13 LEU 16 -0.097 7.420 4.155
101 HD21 LEU 16 HD21 LEU 16 2.455 5.430 5.717
102 HD22 LEU 16 HD22 LEU 16 0.762 4.997 6.052
103 HD23 LEU 16 HD23 LEU 16 1.788 3.900 5.098
104 H LEU 17 H LEU 17 3.265 4.999 0.662
105 HA LEU 17 HA LEU 17 4.250 7.550 1.119
106 HB3 LEU 17 HB3 LEU 17 5.125 5.073 -0.040
107 HG LEU 17 HG LEU 17 5.254 6.494 -2.148
108 HD11 LEU 17 HD11 LEU 17 7.656 7.849 -1.027
109 HD12 LEU 17 HD12 LEU 17 6.529 8.367 -2.302
110 HD13 LEU 17 HD13 LEU 17 6.061 8.506 -0.592
111 HD21 LEU 17 HD21 LEU 17 6.848 4.516 -1.223
112 HD22 LEU 17 HD22 LEU 17 7.024 5.274 -2.824
113 HD23 LEU 17 HD23 LEU 17 8.051 5.803 -1.470
114 H ALA 18 H ALA 18 2.286 6.221 -1.507
115 HA ALA 18 HA ALA 18 2.855 8.328 -3.334
116 HB1 ALA 18 HB1 ALA 18 2.127 6.120 -4.090
117 HB2 ALA 18 HB2 ALA 18 0.609 6.278 -3.174
118 HB3 ALA 18 HB3 ALA 18 0.923 7.341 -4.566
119 H MET 19 H MET 19 0.415 7.668 -0.787
120 HA MET 19 HA MET 19 -1.117 9.950 -1.511
121 HB3 MET 19 HB3 MET 19 -1.858 9.229 1.091
122 HG3 MET 19 HG3 MET 19 -3.371 9.365 -0.901
123 HE1 MET 19 HE1 MET 19 -2.879 8.258 -4.254
124 HE2 MET 19 HE2 MET 19 -3.279 9.479 -3.022
125 HE3 MET 19 HE3 MET 19 -1.577 9.115 -3.394
126 H PHE 20 H PHE 20 1.862 9.540 0.045
127 HA PHE 20 HA PHE 20 1.495 11.559 2.052
128 HB3 PHE 20 HB3 PHE 20 3.918 10.112 0.822
129 HD1 PHE 20 HD1 PHE 20 4.861 12.601 0.970
130 HD2 PHE 20 HD2 PHE 20 3.952 10.145 4.310
131 HE1 PHE 20 HE1 PHE 20 6.418 13.961 2.395
132 HE2 PHE 20 HE2 PHE 20 5.509 11.506 5.734
133 HZ PHE 20 HZ PHE 20 6.723 13.398 4.759
134 H TYR 21 H TYR 21 2.373 11.395 -1.346
135 HA TYR 21 HA TYR 21 4.054 13.561 -1.600
136 HB3 TYR 21 HB3 TYR 21 2.642 13.654 -3.888
137 HD1 TYR 21 HD1 TYR 21 3.156 10.179 -2.649
138 HD2 TYR 21 HD2 TYR 21 4.752 13.417 -4.946
139 HE1 TYR 21 HE1 TYR 21 4.986 8.655 -3.541
140 HE2 TYR 21 HE2 TYR 21 6.575 11.882 -5.829
141 HH TYR 21 HH TYR 21 6.739 8.487 -4.781
142 H GLU 22 H GLU 22 0.514 13.679 -2.405
143 HA GLU 22 HA GLU 22 0.396 16.208 -1.008
144 HB3 GLU 22 HB3 GLU 22 -1.023 16.969 -3.155
145 HG3 GLU 22 HG3 GLU 22 1.339 17.718 -4.143
146 HE2 GLU 22 HE2 GLU 22 0.734 19.413 -0.616
147 H GLY 23 H GLY 23 -0.651 13.246 -0.970
148 HA2 GLY 23 HA2 GLY 23 -2.517 12.247 -0.207
149 HA3 GLY 23 HA3 GLY 23 -3.191 13.831 0.121
150 H LEU 24 H LEU 24 -2.057 13.218 -3.155
151 HA LEU 24 HA LEU 24 -4.842 12.786 -3.984
152 HB3 LEU 24 HB3 LEU 24 -4.503 14.976 -4.587
153 HG LEU 24 HG LEU 24 -1.965 14.965 -4.147
154 HD11 LEU 24 HD11 LEU 24 -1.174 14.977 -6.878
155 HD12 LEU 24 HD12 LEU 24 -0.629 13.908 -5.564
156 HD13 LEU 24 HD13 LEU 24 -2.027 13.446 -6.564
157 HD21 LEU 24 HD21 LEU 24 -2.373 17.095 -4.625
158 HD22 LEU 24 HD22 LEU 24 -1.940 16.734 -6.313
159 HD23 LEU 24 HD23 LEU 24 -3.641 16.658 -5.795
160 H LYS 25 H LYS 25 -1.335 12.310 -4.660
161 HA LYS 25 HA LYS 25 -1.911 9.680 -5.631
162 HB3 LYS 25 HB3 LYS 25 -2.370 11.186 -7.614
163 HG3 LYS 25 HG3 LYS 25 0.590 11.368 -8.039
164 HD3 LYS 25 HD3 LYS 25 -1.635 13.389 -8.551
165 HE3 LYS 25 HE3 LYS 25 -0.068 14.112 -10.376
166 HZ1 LYS 25 HZ1 LYS 25 0.809 14.109 -7.594
167 HZ2 LYS 25 HZ2 LYS 25 1.740 14.804 -8.741
168 HZ3 LYS 25 HZ3 LYS 25 0.221 15.346 -8.484
Start of MODEL 16
1 H1 LYS 1 H1 LYS 1 -0.219 -20.811 4.059
2 HA LYS 1 HA LYS 1 0.652 -18.385 4.976
3 HB3 LYS 1 HB3 LYS 1 2.894 -20.412 5.196
4 HG3 LYS 1 HG3 LYS 1 2.894 -17.603 4.784
5 HD3 LYS 1 HD3 LYS 1 4.106 -16.929 6.951
6 HE3 LYS 1 HE3 LYS 1 1.149 -17.392 6.648
7 HZ1 LYS 1 HZ1 LYS 1 1.807 -17.831 9.007
8 HZ2 LYS 1 HZ2 LYS 1 2.283 -16.271 9.104
9 HZ3 LYS 1 HZ3 LYS 1 0.721 -16.630 8.789
10 H ASN 2 H ASN 2 0.416 -17.456 3.011
11 HA ASN 2 HA ASN 2 1.709 -18.845 0.797
12 HB3 ASN 2 HB3 ASN 2 0.044 -17.414 -0.616
13 HD21 ASN 2 HD22 ASN 2 -0.197 -19.331 -1.600
14 HD22 ASN 2 HD21 ASN 2 -1.195 -20.629 -1.038
15 H THR 3 H THR 3 3.071 -17.541 -0.581
16 HA THR 3 HA THR 3 4.101 -15.169 0.628
17 HB THR 3 HB THR 3 4.612 -16.657 -1.997
18 HG1 THR 3 HG1 THR 3 6.066 -16.240 0.519
19 HG21 THR 3 HG21 THR 3 5.949 -14.220 -0.740
20 HG22 THR 3 HG22 THR 3 6.868 -15.352 -1.763
21 HG23 THR 3 HG23 THR 3 5.483 -14.463 -2.441
22 H ALA 4 H ALA 4 1.729 -14.269 0.629
23 HA ALA 4 HA ALA 4 1.462 -12.704 -1.847
24 HB1 ALA 4 HB1 ALA 4 -0.969 -12.679 -1.384
25 HB2 ALA 4 HB2 ALA 4 -0.362 -14.341 -1.580
26 HB3 ALA 4 HB3 ALA 4 -0.705 -13.704 0.047
27 H GLY 5 H GLY 5 2.940 -12.397 0.896
28 HA2 GLY 5 HA2 GLY 5 1.569 -9.979 1.860
29 HA3 GLY 5 HA3 GLY 5 2.786 -10.907 2.715
30 H GLU 6 H GLU 6 4.716 -11.239 0.595
31 HA GLU 6 HA GLU 6 6.199 -8.986 0.924
32 HB3 GLU 6 HB3 GLU 6 7.260 -9.930 -1.384
33 HG3 GLU 6 HG3 GLU 6 8.353 -11.747 0.072
34 HE2 GLU 6 HE2 GLU 6 10.159 -10.419 -0.275
35 H MET 7 H MET 7 3.462 -9.511 -1.165
36 HA MET 7 HA MET 7 4.235 -7.323 -2.889
37 HB3 MET 7 HB3 MET 7 1.854 -8.006 -3.881
38 HG3 MET 7 HG3 MET 7 3.404 -10.390 -4.372
39 HE1 MET 7 HE1 MET 7 1.302 -10.274 -5.399
40 HE2 MET 7 HE2 MET 7 0.730 -9.134 -6.642
41 HE3 MET 7 HE3 MET 7 1.765 -10.507 -7.102
42 H ALA 8 H ALA 8 0.969 -8.169 -1.586
43 HA ALA 8 HA ALA 8 0.042 -5.601 -1.450
44 HB1 ALA 8 HB1 ALA 8 -0.663 -8.246 -0.345
45 HB2 ALA 8 HB2 ALA 8 -1.263 -6.877 0.621
46 HB3 ALA 8 HB3 ALA 8 -1.697 -7.011 -1.101
47 H GLY 9 H GLY 9 2.376 -7.232 0.600
48 HA2 GLY 9 HA2 GLY 9 2.041 -5.499 2.870
49 HA3 GLY 9 HA3 GLY 9 3.311 -6.673 2.593
50 H ALA 10 H ALA 10 4.015 -5.599 -0.119
51 HA ALA 10 HA ALA 10 5.637 -3.386 0.847
52 HB1 ALA 10 HB1 ALA 10 5.712 -5.272 -1.518
53 HB2 ALA 10 HB2 ALA 10 6.688 -3.784 -1.503
54 HB3 ALA 10 HB3 ALA 10 6.931 -5.021 -0.246
55 H PHE 11 H PHE 11 2.766 -4.063 -1.022
56 HA PHE 11 HA PHE 11 2.924 -1.710 -2.629
57 HB3 PHE 11 HB3 PHE 11 0.366 -2.443 -2.835
58 HD1 PHE 11 HD2 PHE 11 2.764 -2.136 -4.571
59 HD2 PHE 11 HD1 PHE 11 0.665 -5.615 -3.346
60 HE1 PHE 11 HE2 PHE 11 3.527 -3.326 -6.645
61 HE2 PHE 11 HE1 PHE 11 1.428 -6.805 -5.420
62 HZ PHE 11 HZ PHE 11 2.850 -5.646 -7.045
63 H VAL 12 H VAL 12 1.336 -2.689 0.450
64 HA VAL 12 HA VAL 12 -0.421 -0.664 0.817
65 HB VAL 12 HB VAL 12 0.396 -0.910 3.304
66 HG11 VAL 12 HG11 VAL 12 -0.857 -3.069 3.448
67 HG12 VAL 12 HG12 VAL 12 -1.695 -1.813 2.506
68 HG13 VAL 12 HG13 VAL 12 -0.854 -3.141 1.670
69 HG21 VAL 12 HG21 VAL 12 2.467 -2.259 2.048
70 HG22 VAL 12 HG22 VAL 12 2.038 -2.362 3.773
71 HG23 VAL 12 HG23 VAL 12 1.412 -3.570 2.626
72 H ALA 13 H ALA 13 3.155 -0.572 1.124
73 HA ALA 13 HA ALA 13 3.163 2.083 2.171
74 HB1 ALA 13 HB1 ALA 13 5.501 1.831 2.189
75 HB2 ALA 13 HB2 ALA 13 4.913 0.165 2.410
76 HB3 ALA 13 HB3 ALA 13 5.487 0.703 0.813
77 H VAL 14 H VAL 14 3.874 0.556 -1.044
78 HA VAL 14 HA VAL 14 4.540 2.838 -2.408
79 HB VAL 14 HB VAL 14 3.065 0.357 -3.305
80 HG11 VAL 14 HG11 VAL 14 3.628 2.795 -4.751
81 HG12 VAL 14 HG12 VAL 14 4.546 1.440 -5.451
82 HG13 VAL 14 HG13 VAL 14 2.777 1.329 -5.293
83 HG21 VAL 14 HG21 VAL 14 5.840 0.664 -4.144
84 HG22 VAL 14 HG22 VAL 14 5.674 0.680 -2.372
85 HG23 VAL 14 HG23 VAL 14 5.041 -0.692 -3.313
86 H PHE 15 H PHE 15 1.480 1.902 -1.019
87 HA PHE 15 HA PHE 15 -0.023 3.657 -2.757
88 HB3 PHE 15 HB3 PHE 15 -0.486 1.711 -0.462
89 HD1 PHE 15 HD2 PHE 15 -3.004 3.334 -2.636
90 HD2 PHE 15 HD1 PHE 15 -1.599 2.777 1.330
91 HE1 PHE 15 HE2 PHE 15 -5.086 4.418 -1.746
92 HE2 PHE 15 HE1 PHE 15 -3.680 3.861 2.219
93 HZ PHE 15 HZ PHE 15 -5.399 4.668 0.671
94 H LEU 16 H LEU 16 0.846 3.404 0.761
95 HA LEU 16 HA LEU 16 -0.367 5.835 1.457
96 HB3 LEU 16 HB3 LEU 16 1.853 4.281 2.793
97 HG LEU 16 HG LEU 16 1.639 6.558 3.749
98 HD11 LEU 16 HD11 LEU 16 -0.912 6.244 5.050
99 HD12 LEU 16 HD12 LEU 16 -0.312 7.574 4.030
100 HD13 LEU 16 HD13 LEU 16 -1.111 6.169 3.283
101 HD21 LEU 16 HD21 LEU 16 1.490 4.058 5.101
102 HD22 LEU 16 HD22 LEU 16 2.227 5.582 5.649
103 HD23 LEU 16 HD23 LEU 16 0.520 5.237 6.016
104 H LEU 17 H LEU 17 3.061 4.955 0.669
105 HA LEU 17 HA LEU 17 4.134 7.472 1.035
106 HB3 LEU 17 HB3 LEU 17 4.910 4.940 -0.057
107 HG LEU 17 HG LEU 17 5.044 6.298 -2.219
108 HD11 LEU 17 HD11 LEU 17 5.974 8.316 -0.763
109 HD12 LEU 17 HD12 LEU 17 7.534 7.555 -1.161
110 HD13 LEU 17 HD13 LEU 17 6.441 8.080 -2.464
111 HD21 LEU 17 HD21 LEU 17 7.401 5.481 -2.681
112 HD22 LEU 17 HD22 LEU 17 7.453 4.956 -0.981
113 HD23 LEU 17 HD23 LEU 17 6.242 4.266 -2.089
114 H ALA 18 H ALA 18 2.118 6.160 -1.565
115 HA ALA 18 HA ALA 18 2.750 8.217 -3.429
116 HB1 ALA 18 HB1 ALA 18 1.904 5.935 -4.015
117 HB2 ALA 18 HB2 ALA 18 0.340 6.362 -3.281
118 HB3 ALA 18 HB3 ALA 18 0.922 7.243 -4.714
119 H MET 19 H MET 19 0.028 7.567 -1.124
120 HA MET 19 HA MET 19 -1.266 9.978 -1.801
121 HB3 MET 19 HB3 MET 19 -2.041 9.058 0.824
122 HG3 MET 19 HG3 MET 19 -3.903 7.924 -0.767
123 HE1 MET 19 HE1 MET 19 -3.362 11.131 -2.314
124 HE2 MET 19 HE2 MET 19 -5.130 10.924 -2.342
125 HE3 MET 19 HE3 MET 19 -4.408 12.290 -1.458
126 H PHE 20 H PHE 20 1.628 9.474 -0.231
127 HA PHE 20 HA PHE 20 1.193 11.512 1.799
128 HB3 PHE 20 HB3 PHE 20 3.578 9.747 0.975
129 HD1 PHE 20 HD1 PHE 20 4.759 12.120 1.265
130 HD2 PHE 20 HD2 PHE 20 3.061 9.850 4.423
131 HE1 PHE 20 HE1 PHE 20 6.212 13.330 2.916
132 HE2 PHE 20 HE2 PHE 20 4.514 11.060 6.074
133 HZ PHE 20 HZ PHE 20 6.072 12.786 5.301
134 H TYR 21 H TYR 21 2.534 11.050 -1.423
135 HA TYR 21 HA TYR 21 4.532 12.778 -1.700
136 HB3 TYR 21 HB3 TYR 21 3.128 13.414 -3.899
137 HD1 TYR 21 HD2 TYR 21 5.652 11.970 -3.142
138 HD2 TYR 21 HD1 TYR 21 1.976 10.523 -4.784
139 HE1 TYR 21 HE2 TYR 21 6.885 10.013 -4.197
140 HE2 TYR 21 HE1 TYR 21 3.222 8.571 -5.834
141 HH TYR 21 HH TYR 21 5.719 8.241 -6.613
142 H GLU 22 H GLU 22 1.101 13.912 -2.135
143 HA GLU 22 HA GLU 22 2.035 16.580 -1.605
144 HB3 GLU 22 HB3 GLU 22 -0.733 16.709 -1.964
145 HG3 GLU 22 HG3 GLU 22 1.720 17.156 -3.582
146 HE2 GLU 22 HE2 GLU 22 0.520 16.614 -6.764
147 H GLY 23 H GLY 23 -0.632 14.408 -0.403
148 HA2 GLY 23 HA2 GLY 23 -1.793 14.465 1.538
149 HA3 GLY 23 HA3 GLY 23 -0.193 14.497 2.252
150 H LEU 24 H LEU 24 -1.318 17.174 0.195
151 HA LEU 24 HA LEU 24 -1.178 18.904 2.533
152 HB3 LEU 24 HB3 LEU 24 -1.118 20.715 0.871
153 HG LEU 24 HG LEU 24 0.965 18.908 1.338
154 HD11 LEU 24 HD11 LEU 24 0.301 18.208 -1.123
155 HD12 LEU 24 HD12 LEU 24 1.260 19.649 -1.542
156 HD13 LEU 24 HD13 LEU 24 2.002 18.324 -0.612
157 HD21 LEU 24 HD21 LEU 24 0.833 21.662 0.111
158 HD22 LEU 24 HD22 LEU 24 1.257 21.196 1.776
159 HD23 LEU 24 HD23 LEU 24 2.376 20.837 0.438
160 H LYS 25 H LYS 25 -2.840 20.945 2.095
161 HA LYS 25 HA LYS 25 -5.254 20.161 2.962
162 HB3 LYS 25 HB3 LYS 25 -4.555 22.471 2.948
163 HG3 LYS 25 HG3 LYS 25 -3.469 22.322 0.613
164 HD3 LYS 25 HD3 LYS 25 -5.642 23.453 -0.845
165 HE3 LYS 25 HE3 LYS 25 -5.342 21.414 -2.274
166 HZ1 LYS 25 HZ1 LYS 25 -3.394 23.235 -1.562
167 HZ2 LYS 25 HZ2 LYS 25 -2.641 21.797 -1.741
168 HZ3 LYS 25 HZ3 LYS 25 -3.527 22.413 -2.967
Start of MODEL 17
1 H1 LYS 1 H1 LYS 1 3.111 -21.251 4.090
2 HA LYS 1 HA LYS 1 1.813 -19.459 3.989
3 HB3 LYS 1 HB3 LYS 1 3.804 -17.456 4.877
4 HG3 LYS 1 HG3 LYS 1 1.911 -17.060 6.542
5 HD3 LYS 1 HD3 LYS 1 0.504 -17.058 3.927
6 HE3 LYS 1 HE3 LYS 1 0.608 -14.539 4.436
7 HZ1 LYS 1 HZ1 LYS 1 -0.616 -16.550 6.123
8 HZ2 LYS 1 HZ2 LYS 1 -0.704 -14.995 6.615
9 HZ3 LYS 1 HZ3 LYS 1 -1.319 -15.430 5.166
10 H ASN 2 H ASN 2 1.383 -19.139 1.866
11 HA ASN 2 HA ASN 2 3.114 -18.867 -0.130
12 HB3 ASN 2 HB3 ASN 2 0.961 -17.028 -0.704
13 HD21 ASN 2 HD22 ASN 2 -0.008 -20.296 -0.478
14 HD22 ASN 2 HD21 ASN 2 0.339 -20.806 -2.097
15 H THR 3 H THR 3 4.542 -17.261 -0.867
16 HA THR 3 HA THR 3 4.858 -14.904 0.731
17 HB THR 3 HB THR 3 6.210 -16.079 -1.745
18 HG1 THR 3 HG1 THR 3 6.358 -16.871 0.618
19 HG21 THR 3 HG21 THR 3 7.892 -14.185 -0.430
20 HG22 THR 3 HG22 THR 3 7.244 -14.069 -2.084
21 HG23 THR 3 HG23 THR 3 6.350 -13.344 -0.725
22 H ALA 4 H ALA 4 2.497 -14.267 0.300
23 HA ALA 4 HA ALA 4 2.318 -12.839 -2.252
24 HB1 ALA 4 HB1 ALA 4 0.558 -14.570 -1.222
25 HB2 ALA 4 HB2 ALA 4 0.010 -13.115 -0.356
26 HB3 ALA 4 HB3 ALA 4 0.032 -13.136 -2.136
27 H GLY 5 H GLY 5 2.462 -12.516 1.285
28 HA2 GLY 5 HA2 GLY 5 1.527 -9.927 1.612
29 HA3 GLY 5 HA3 GLY 5 2.733 -10.720 2.606
30 H GLU 6 H GLU 6 4.645 -11.149 0.337
31 HA GLU 6 HA GLU 6 6.164 -8.915 0.660
32 HB3 GLU 6 HB3 GLU 6 7.005 -9.886 -1.797
33 HG3 GLU 6 HG3 GLU 6 7.997 -11.724 0.103
34 HE2 GLU 6 HE2 GLU 6 10.278 -8.968 0.591
35 H MET 7 H MET 7 3.344 -9.369 -1.326
36 HA MET 7 HA MET 7 4.075 -7.159 -3.041
37 HB3 MET 7 HB3 MET 7 1.515 -7.868 -3.776
38 HG3 MET 7 HG3 MET 7 3.731 -9.755 -4.590
39 HE1 MET 7 HE1 MET 7 2.129 -11.095 -7.335
40 HE2 MET 7 HE2 MET 7 2.933 -11.219 -5.752
41 HE3 MET 7 HE3 MET 7 1.156 -11.222 -5.850
42 H ALA 8 H ALA 8 0.861 -8.003 -1.605
43 HA ALA 8 HA ALA 8 -0.035 -5.424 -1.392
44 HB1 ALA 8 HB1 ALA 8 -1.271 -6.728 0.705
45 HB2 ALA 8 HB2 ALA 8 -1.774 -6.822 -0.999
46 HB3 ALA 8 HB3 ALA 8 -0.724 -8.084 -0.310
47 H GLY 9 H GLY 9 2.373 -7.110 0.519
48 HA2 GLY 9 HA2 GLY 9 2.144 -5.425 2.840
49 HA3 GLY 9 HA3 GLY 9 3.392 -6.602 2.484
50 H ALA 10 H ALA 10 3.999 -5.481 -0.227
51 HA ALA 10 HA ALA 10 5.665 -3.290 0.714
52 HB1 ALA 10 HB1 ALA 10 5.668 -5.201 -1.619
53 HB2 ALA 10 HB2 ALA 10 6.572 -3.672 -1.732
54 HB3 ALA 10 HB3 ALA 10 6.960 -4.841 -0.447
55 H PHE 11 H PHE 11 2.729 -3.932 -1.066
56 HA PHE 11 HA PHE 11 2.844 -1.548 -2.636
57 HB3 PHE 11 HB3 PHE 11 0.301 -2.274 -2.832
58 HD1 PHE 11 HD2 PHE 11 2.717 -2.042 -4.565
59 HD2 PHE 11 HD1 PHE 11 0.527 -5.453 -3.309
60 HE1 PHE 11 HE2 PHE 11 3.455 -3.274 -6.624
61 HE2 PHE 11 HE1 PHE 11 1.266 -6.685 -5.367
62 HZ PHE 11 HZ PHE 11 2.722 -5.581 -7.000
63 H VAL 12 H VAL 12 1.387 -2.584 0.483
64 HA VAL 12 HA VAL 12 -0.378 -0.574 0.934
65 HB VAL 12 HB VAL 12 0.488 -0.870 3.390
66 HG11 VAL 12 HG11 VAL 12 -0.827 -2.988 1.673
67 HG12 VAL 12 HG12 VAL 12 -0.664 -3.149 3.438
68 HG13 VAL 12 HG13 VAL 12 -1.594 -1.797 2.750
69 HG21 VAL 12 HG21 VAL 12 2.547 -2.181 2.049
70 HG22 VAL 12 HG22 VAL 12 2.180 -2.281 3.789
71 HG23 VAL 12 HG23 VAL 12 1.528 -3.502 2.670
72 H ALA 13 H ALA 13 3.203 -0.482 1.113
73 HA ALA 13 HA ALA 13 3.243 2.148 2.226
74 HB1 ALA 13 HB1 ALA 13 4.999 0.220 2.359
75 HB2 ALA 13 HB2 ALA 13 5.527 0.811 0.766
76 HB3 ALA 13 HB3 ALA 13 5.576 1.894 2.178
77 H VAL 14 H VAL 14 3.855 0.690 -1.041
78 HA VAL 14 HA VAL 14 4.477 3.003 -2.377
79 HB VAL 14 HB VAL 14 2.974 0.544 -3.287
80 HG11 VAL 14 HG11 VAL 14 4.411 1.672 -5.441
81 HG12 VAL 14 HG12 VAL 14 2.646 1.556 -5.247
82 HG13 VAL 14 HG13 VAL 14 3.508 3.010 -4.690
83 HG21 VAL 14 HG21 VAL 14 5.730 0.855 -4.185
84 HG22 VAL 14 HG22 VAL 14 5.607 0.834 -2.409
85 HG23 VAL 14 HG23 VAL 14 4.944 -0.514 -3.364
86 H PHE 15 H PHE 15 1.463 2.034 -0.912
87 HA PHE 15 HA PHE 15 -0.096 3.817 -2.568
88 HB3 PHE 15 HB3 PHE 15 -0.539 1.946 -0.181
89 HD1 PHE 15 HD2 PHE 15 -2.475 4.133 -2.517
90 HD2 PHE 15 HD1 PHE 15 -2.326 2.182 1.249
91 HE1 PHE 15 HE2 PHE 15 -4.672 5.172 -1.892
92 HE2 PHE 15 HE1 PHE 15 -4.524 3.221 1.874
93 HZ PHE 15 HZ PHE 15 -5.671 4.704 0.296
94 H LEU 16 H LEU 16 0.865 3.499 0.922
95 HA LEU 16 HA LEU 16 -0.321 5.917 1.696
96 HB3 LEU 16 HB3 LEU 16 1.943 4.342 2.930
97 HG LEU 16 HG LEU 16 1.765 6.603 3.931
98 HD11 LEU 16 HD11 LEU 16 -0.998 6.226 3.552
99 HD12 LEU 16 HD12 LEU 16 -0.740 6.269 5.313
100 HD13 LEU 16 HD13 LEU 16 -0.173 7.617 4.297
101 HD21 LEU 16 HD21 LEU 16 1.679 4.085 5.241
102 HD22 LEU 16 HD22 LEU 16 2.407 5.609 5.805
103 HD23 LEU 16 HD23 LEU 16 0.715 5.228 6.206
104 H LEU 17 H LEU 17 3.078 5.062 0.772
105 HA LEU 17 HA LEU 17 4.150 7.583 1.148
106 HB3 LEU 17 HB3 LEU 17 4.904 5.068 -0.022
107 HG LEU 17 HG LEU 17 5.070 6.282 -2.163
108 HD11 LEU 17 HD11 LEU 17 5.619 8.427 -2.234
109 HD12 LEU 17 HD12 LEU 17 5.986 8.415 -0.491
110 HD13 LEU 17 HD13 LEU 17 7.259 8.020 -1.671
111 HD21 LEU 17 HD21 LEU 17 7.264 5.598 -2.707
112 HD22 LEU 17 HD22 LEU 17 7.842 5.846 -1.042
113 HD23 LEU 17 HD23 LEU 17 6.723 4.511 -1.404
114 H ALA 18 H ALA 18 2.061 6.290 -1.400
115 HA ALA 18 HA ALA 18 2.632 8.383 -3.252
116 HB1 ALA 18 HB1 ALA 18 0.748 7.404 -4.493
117 HB2 ALA 18 HB2 ALA 18 1.846 6.128 -3.916
118 HB3 ALA 18 HB3 ALA 18 0.305 6.426 -3.074
119 H MET 19 H MET 19 0.219 7.739 -0.671
120 HA MET 19 HA MET 19 -1.216 10.119 -1.353
121 HB3 MET 19 HB3 MET 19 -1.919 9.078 1.258
122 HG3 MET 19 HG3 MET 19 -3.439 8.169 -1.156
123 HE1 MET 19 HE1 MET 19 -4.369 11.354 0.713
124 HE2 MET 19 HE2 MET 19 -5.008 10.793 2.276
125 HE3 MET 19 HE3 MET 19 -3.267 10.665 1.930
126 H PHE 20 H PHE 20 1.722 9.621 0.083
127 HA PHE 20 HA PHE 20 1.321 11.532 2.238
128 HB3 PHE 20 HB3 PHE 20 3.719 9.891 1.218
129 HD1 PHE 20 HD1 PHE 20 4.830 12.289 1.604
130 HD2 PHE 20 HD2 PHE 20 3.350 9.770 4.682
131 HE1 PHE 20 HE1 PHE 20 6.313 13.446 3.265
132 HE2 PHE 20 HE2 PHE 20 4.833 10.928 6.343
133 HZ PHE 20 HZ PHE 20 6.297 12.752 5.615
134 H TYR 21 H TYR 21 3.425 11.040 -0.686
135 HA TYR 21 HA TYR 21 4.572 13.616 -0.519
136 HB3 TYR 21 HB3 TYR 21 5.161 11.302 -1.769
137 HD1 TYR 21 HD1 TYR 21 2.984 10.226 -2.584
138 HD2 TYR 21 HD2 TYR 21 4.895 13.457 -4.637
139 HE1 TYR 21 HE1 TYR 21 1.696 9.653 -4.700
140 HE2 TYR 21 HE2 TYR 21 3.600 12.873 -6.746
141 HH TYR 21 HH TYR 21 0.983 11.302 -6.874
142 H GLU 22 H GLU 22 1.761 12.227 -2.299
143 HA GLU 22 HA GLU 22 1.247 14.130 -4.083
144 HB3 GLU 22 HB3 GLU 22 -0.125 12.081 -3.678
145 HG3 GLU 22 HG3 GLU 22 -0.987 13.711 -1.274
146 HE2 GLU 22 HE2 GLU 22 -2.919 12.729 -0.233
147 H GLY 23 H GLY 23 1.089 14.446 -0.567
148 HA2 GLY 23 HA2 GLY 23 -0.367 16.970 -0.707
149 HA3 GLY 23 HA3 GLY 23 0.136 16.103 0.730
150 H LEU 24 H LEU 24 2.216 16.880 -2.109
151 HA LEU 24 HA LEU 24 4.009 18.263 -0.286
152 HB3 LEU 24 HB3 LEU 24 5.315 18.239 -2.632
153 HG LEU 24 HG LEU 24 5.070 15.882 -0.745
154 HD11 LEU 24 HD11 LEU 24 7.355 16.296 -2.660
155 HD12 LEU 24 HD12 LEU 24 6.884 14.835 -1.761
156 HD13 LEU 24 HD13 LEU 24 5.900 15.389 -3.136
157 HD21 LEU 24 HD21 LEU 24 6.033 18.309 -0.136
158 HD22 LEU 24 HD22 LEU 24 6.700 16.800 0.531
159 HD23 LEU 24 HD23 LEU 24 7.497 17.592 -0.849
160 H LYS 25 H LYS 25 1.807 19.771 -0.397
161 HA LYS 25 HA LYS 25 2.715 22.180 -1.425
162 HB3 LYS 25 HB3 LYS 25 2.344 21.476 -3.643
163 HG3 LYS 25 HG3 LYS 25 -0.529 20.715 -3.159
164 HD3 LYS 25 HD3 LYS 25 0.608 20.844 -5.455
165 HE3 LYS 25 HE3 LYS 25 2.802 19.872 -4.784
166 HZ1 LYS 25 HZ1 LYS 25 2.130 17.200 -4.776
167 HZ2 LYS 25 HZ2 LYS 25 2.782 18.066 -3.555
168 HZ3 LYS 25 HZ3 LYS 25 1.161 17.917 -3.674
Start of MODEL 18
1 H1 LYS 1 H1 LYS 1 -5.183 -16.938 0.582
2 HA LYS 1 HA LYS 1 -4.073 -15.509 -0.718
3 HB3 LYS 1 HB3 LYS 1 -2.064 -14.631 1.121
4 HG3 LYS 1 HG3 LYS 1 -4.830 -13.436 0.964
5 HD3 LYS 1 HD3 LYS 1 -2.861 -11.565 0.265
6 HE3 LYS 1 HE3 LYS 1 -3.141 -10.801 2.679
7 HZ1 LYS 1 HZ1 LYS 1 -4.755 -10.051 1.212
8 HZ2 LYS 1 HZ2 LYS 1 -5.462 -11.513 1.045
9 HZ3 LYS 1 HZ3 LYS 1 -5.623 -10.683 2.442
10 H ASN 2 H ASN 2 -2.023 -17.903 0.942
11 HA ASN 2 HA ASN 2 -0.099 -18.796 0.433
12 HB3 ASN 2 HB3 ASN 2 0.067 -19.728 -1.842
13 HD21 ASN 2 HD22 ASN 2 -2.530 -19.890 -3.237
14 HD22 ASN 2 HD21 ASN 2 -3.574 -20.849 -2.241
15 H THR 3 H THR 3 1.419 -17.105 0.986
16 HA THR 3 HA THR 3 2.721 -15.285 0.671
17 HB THR 3 HB THR 3 3.363 -16.988 -1.796
18 HG1 THR 3 HG1 THR 3 3.331 -18.093 0.316
19 HG21 THR 3 HG21 THR 3 4.774 -15.092 -2.020
20 HG22 THR 3 HG22 THR 3 4.844 -14.824 -0.262
21 HG23 THR 3 HG23 THR 3 5.754 -16.167 -0.994
22 H ALA 4 H ALA 4 0.536 -14.086 0.288
23 HA ALA 4 HA ALA 4 0.635 -12.928 -2.412
24 HB1 ALA 4 HB1 ALA 4 -1.764 -12.182 -1.677
25 HB2 ALA 4 HB2 ALA 4 -1.498 -13.871 -2.177
26 HB3 ALA 4 HB3 ALA 4 -1.598 -13.458 -0.448
27 H GLY 5 H GLY 5 0.714 -12.380 1.106
28 HA2 GLY 5 HA2 GLY 5 0.471 -9.552 1.009
29 HA3 GLY 5 HA3 GLY 5 1.071 -10.526 2.337
30 H GLU 6 H GLU 6 3.128 -11.857 0.493
31 HA GLU 6 HA GLU 6 5.243 -10.234 1.126
32 HB3 GLU 6 HB3 GLU 6 6.147 -11.739 -1.043
33 HG3 GLU 6 HG3 GLU 6 6.554 -11.644 1.696
34 HE2 GLU 6 HE2 GLU 6 6.876 -14.999 1.246
35 H MET 7 H MET 7 2.899 -9.913 -1.398
36 HA MET 7 HA MET 7 4.713 -8.242 -2.937
37 HB3 MET 7 HB3 MET 7 2.513 -8.307 -4.485
38 HG3 MET 7 HG3 MET 7 4.421 -10.646 -4.028
39 HE1 MET 7 HE1 MET 7 3.137 -9.589 -7.799
40 HE2 MET 7 HE2 MET 7 4.714 -10.132 -7.176
41 HE3 MET 7 HE3 MET 7 3.677 -11.262 -8.081
42 H ALA 8 H ALA 8 1.165 -8.177 -2.113
43 HA ALA 8 HA ALA 8 0.926 -5.422 -2.373
44 HB1 ALA 8 HB1 ALA 8 -1.054 -6.107 -0.606
45 HB2 ALA 8 HB2 ALA 8 -1.145 -6.363 -2.365
46 HB3 ALA 8 HB3 ALA 8 -0.645 -7.696 -1.297
47 H GLY 9 H GLY 9 2.486 -7.344 0.054
48 HA2 GLY 9 HA2 GLY 9 2.076 -5.761 2.339
49 HA3 GLY 9 HA3 GLY 9 3.416 -6.849 2.039
50 H ALA 10 H ALA 10 4.196 -5.416 -0.516
51 HA ALA 10 HA ALA 10 5.722 -3.325 0.800
52 HB1 ALA 10 HB1 ALA 10 5.873 -4.707 -1.902
53 HB2 ALA 10 HB2 ALA 10 6.918 -3.338 -1.450
54 HB3 ALA 10 HB3 ALA 10 6.996 -4.860 -0.530
55 H PHE 11 H PHE 11 2.872 -3.761 -1.145
56 HA PHE 11 HA PHE 11 2.985 -1.262 -2.484
57 HB3 PHE 11 HB3 PHE 11 1.012 -3.490 -1.878
58 HD1 PHE 11 HD2 PHE 11 0.882 -0.313 -3.852
59 HD2 PHE 11 HD1 PHE 11 -1.199 -3.088 -1.407
60 HE1 PHE 11 HE2 PHE 11 -1.219 1.036 -4.110
61 HE2 PHE 11 HE1 PHE 11 -3.300 -1.739 -1.665
62 HZ PHE 11 HZ PHE 11 -3.286 0.307 -3.013
63 H VAL 12 H VAL 12 1.353 -2.497 0.502
64 HA VAL 12 HA VAL 12 -0.248 -0.456 1.159
65 HB VAL 12 HB VAL 12 0.719 -0.963 3.578
66 HG11 VAL 12 HG11 VAL 12 -1.356 -1.820 3.449
67 HG12 VAL 12 HG12 VAL 12 -1.136 -2.352 1.765
68 HG13 VAL 12 HG13 VAL 12 -0.540 -3.363 3.104
69 HG21 VAL 12 HG21 VAL 12 2.699 -2.173 2.314
70 HG22 VAL 12 HG22 VAL 12 2.033 -2.839 3.824
71 HG23 VAL 12 HG23 VAL 12 1.543 -3.526 2.256
72 H ALA 13 H ALA 13 3.343 -0.531 1.491
73 HA ALA 13 HA ALA 13 3.445 2.046 2.693
74 HB1 ALA 13 HB1 ALA 13 5.862 1.773 2.418
75 HB2 ALA 13 HB2 ALA 13 5.147 0.256 3.017
76 HB3 ALA 13 HB3 ALA 13 5.605 0.409 1.303
77 H VAL 14 H VAL 14 4.337 0.765 -0.595
78 HA VAL 14 HA VAL 14 5.015 3.098 -1.789
79 HB VAL 14 HB VAL 14 3.513 0.704 -2.847
80 HG11 VAL 14 HG11 VAL 14 4.893 1.925 -4.972
81 HG12 VAL 14 HG12 VAL 14 3.130 1.822 -4.741
82 HG13 VAL 14 HG13 VAL 14 4.025 3.243 -4.148
83 HG21 VAL 14 HG21 VAL 14 6.070 0.862 -1.914
84 HG22 VAL 14 HG22 VAL 14 5.520 -0.286 -3.157
85 HG23 VAL 14 HG23 VAL 14 6.314 1.233 -3.638
86 H PHE 15 H PHE 15 1.850 2.090 -0.633
87 HA PHE 15 HA PHE 15 0.464 4.051 -2.220
88 HB3 PHE 15 HB3 PHE 15 -0.259 2.207 0.136
89 HD1 PHE 15 HD2 PHE 15 -1.919 3.868 -2.780
90 HD2 PHE 15 HD1 PHE 15 -2.137 2.791 1.319
91 HE1 PHE 15 HE2 PHE 15 -4.207 4.889 -2.633
92 HE2 PHE 15 HE1 PHE 15 -4.424 3.811 1.465
93 HZ PHE 15 HZ PHE 15 -5.433 4.848 -0.512
94 H LEU 16 H LEU 16 1.268 3.519 1.281
95 HA LEU 16 HA LEU 16 0.108 5.939 2.122
96 HB3 LEU 16 HB3 LEU 16 1.846 3.830 3.272
97 HG LEU 16 HG LEU 16 2.796 6.128 4.027
98 HD11 LEU 16 HD11 LEU 16 0.111 6.623 4.562
99 HD12 LEU 16 HD12 LEU 16 0.830 6.315 6.161
100 HD13 LEU 16 HD13 LEU 16 1.507 7.582 5.110
101 HD21 LEU 16 HD21 LEU 16 3.649 5.005 5.759
102 HD22 LEU 16 HD22 LEU 16 2.048 4.713 6.480
103 HD23 LEU 16 HD23 LEU 16 2.654 3.641 5.194
104 H LEU 17 H LEU 17 3.404 4.992 1.043
105 HA LEU 17 HA LEU 17 4.529 7.522 1.677
106 HB3 LEU 17 HB3 LEU 17 5.431 4.973 0.930
107 HG LEU 17 HG LEU 17 5.511 6.051 -1.446
108 HD11 LEU 17 HD11 LEU 17 8.128 7.196 -0.574
109 HD12 LEU 17 HD12 LEU 17 7.074 7.640 -1.938
110 HD13 LEU 17 HD13 LEU 17 6.649 8.145 -0.285
111 HD21 LEU 17 HD21 LEU 17 8.170 5.123 -1.223
112 HD22 LEU 17 HD22 LEU 17 7.209 4.223 -0.025
113 HD23 LEU 17 HD23 LEU 17 6.725 4.220 -1.738
114 H ALA 18 H ALA 18 2.583 6.232 -0.931
115 HA ALA 18 HA ALA 18 3.428 8.272 -2.793
116 HB1 ALA 18 HB1 ALA 18 1.483 7.191 -4.121
117 HB2 ALA 18 HB2 ALA 18 2.919 6.191 -3.793
118 HB3 ALA 18 HB3 ALA 18 1.446 5.981 -2.817
119 H MET 19 H MET 19 1.213 7.905 -0.152
120 HA MET 19 HA MET 19 -0.784 9.625 -1.142
121 HB3 MET 19 HB3 MET 19 -1.356 9.697 1.409
122 HG3 MET 19 HG3 MET 19 -1.403 6.907 1.241
123 HE1 MET 19 HE1 MET 19 -3.068 8.822 -1.638
124 HE2 MET 19 HE2 MET 19 -3.631 7.140 -1.488
125 HE3 MET 19 HE3 MET 19 -4.770 8.484 -1.238
126 H PHE 20 H PHE 20 2.275 10.049 0.639
127 HA PHE 20 HA PHE 20 1.940 12.498 1.764
128 HB3 PHE 20 HB3 PHE 20 4.498 12.665 0.967
129 HD1 PHE 20 HD1 PHE 20 3.495 9.216 1.874
130 HD2 PHE 20 HD2 PHE 20 4.949 12.953 3.262
131 HE1 PHE 20 HE1 PHE 20 3.985 8.193 4.113
132 HE2 PHE 20 HE2 PHE 20 5.439 11.931 5.501
133 HZ PHE 20 HZ PHE 20 4.951 9.563 5.901
134 H TYR 21 H TYR 21 3.049 11.811 -1.630
135 HA TYR 21 HA TYR 21 3.463 14.345 -2.498
136 HB3 TYR 21 HB3 TYR 21 2.738 13.319 -4.726
137 HD1 TYR 21 HD1 TYR 21 3.307 10.256 -2.768
138 HD2 TYR 21 HD2 TYR 21 5.167 13.421 -4.967
139 HE1 TYR 21 HE1 TYR 21 5.483 8.943 -2.833
140 HE2 TYR 21 HE2 TYR 21 7.336 12.096 -5.024
141 HH TYR 21 HH TYR 21 7.506 8.893 -4.431
142 H GLU 22 H GLU 22 0.299 12.563 -2.762
143 HA GLU 22 HA GLU 22 -0.968 15.070 -3.357
144 HB3 GLU 22 HB3 GLU 22 -2.878 12.945 -3.039
145 HG3 GLU 22 HG3 GLU 22 -1.867 13.543 -5.767
146 HE2 GLU 22 HE2 GLU 22 -4.343 15.345 -4.544
147 H GLY 23 H GLY 23 0.238 14.172 -0.603
148 HA2 GLY 23 HA2 GLY 23 -2.200 14.414 1.034
149 HA3 GLY 23 HA3 GLY 23 -0.642 13.812 1.563
150 H LEU 24 H LEU 24 1.072 15.832 0.419
151 HA LEU 24 HA LEU 24 1.226 17.654 2.405
152 HB3 LEU 24 HB3 LEU 24 2.210 19.089 0.333
153 HG LEU 24 HG LEU 24 4.298 17.532 0.477
154 HD11 LEU 24 HD11 LEU 24 4.842 19.361 1.624
155 HD12 LEU 24 HD12 LEU 24 3.197 19.545 2.278
156 HD13 LEU 24 HD13 LEU 24 4.359 18.464 3.084
157 HD21 LEU 24 HD21 LEU 24 2.972 15.615 1.415
158 HD22 LEU 24 HD22 LEU 24 4.429 16.054 2.339
159 HD23 LEU 24 HD23 LEU 24 2.822 16.544 2.926
160 H LYS 25 H LYS 25 -0.144 18.474 -0.864
161 HA LYS 25 HA LYS 25 -1.808 20.451 0.523
162 HB3 LYS 25 HB3 LYS 25 -0.197 21.366 -1.100
163 HG3 LYS 25 HG3 LYS 25 -1.755 20.319 -3.418
164 HD3 LYS 25 HD3 LYS 25 0.278 21.868 -3.515
165 HE3 LYS 25 HE3 LYS 25 1.536 20.543 -1.697
166 HZ1 LYS 25 HZ1 LYS 25 2.342 18.843 -3.929
167 HZ2 LYS 25 HZ2 LYS 25 2.585 18.613 -2.331
168 HZ3 LYS 25 HZ3 LYS 25 1.095 18.411 -2.967
Start of MODEL 19
1 H1 LYS 1 H1 LYS 1 3.844 -22.369 4.823
2 HA LYS 1 HA LYS 1 4.846 -21.244 2.954
3 HB3 LYS 1 HB3 LYS 1 3.235 -23.325 1.573
4 HG3 LYS 1 HG3 LYS 1 5.836 -22.140 1.411
5 HD3 LYS 1 HD3 LYS 1 5.803 -25.011 2.381
6 HE3 LYS 1 HE3 LYS 1 7.923 -23.726 0.593
7 HZ1 LYS 1 HZ1 LYS 1 8.574 -25.268 2.487
8 HZ2 LYS 1 HZ2 LYS 1 7.905 -26.465 1.599
9 HZ3 LYS 1 HZ3 LYS 1 9.157 -25.604 0.999
10 H ASN 2 H ASN 2 4.275 -19.203 2.307
11 HA ASN 2 HA ASN 2 2.672 -18.931 0.104
12 HB3 ASN 2 HB3 ASN 2 1.310 -18.030 2.697
13 HD21 ASN 2 HD22 ASN 2 -1.061 -18.695 0.792
14 HD22 ASN 2 HD21 ASN 2 -1.337 -17.216 -0.066
15 H THR 3 H THR 3 4.116 -17.374 -0.696
16 HA THR 3 HA THR 3 4.788 -15.136 1.095
17 HB THR 3 HB THR 3 6.246 -16.500 -1.218
18 HG1 THR 3 HG1 THR 3 7.546 -17.083 0.546
19 HG21 THR 3 HG21 THR 3 7.741 -14.746 -1.383
20 HG22 THR 3 HG22 THR 3 6.372 -13.765 -0.807
21 HG23 THR 3 HG23 THR 3 7.598 -14.346 0.345
22 H ALA 4 H ALA 4 2.568 -14.316 0.559
23 HA ALA 4 HA ALA 4 2.600 -13.047 -2.092
24 HB1 ALA 4 HB1 ALA 4 0.629 -14.211 -2.157
25 HB2 ALA 4 HB2 ALA 4 0.483 -14.273 -0.384
26 HB3 ALA 4 HB3 ALA 4 0.036 -12.790 -1.262
27 H GLY 5 H GLY 5 2.386 -12.633 1.436
28 HA2 GLY 5 HA2 GLY 5 1.460 -10.046 1.641
29 HA3 GLY 5 HA3 GLY 5 2.609 -10.806 2.724
30 H GLU 6 H GLU 6 4.653 -11.265 0.569
31 HA GLU 6 HA GLU 6 6.140 -9.019 0.940
32 HB3 GLU 6 HB3 GLU 6 7.229 -9.961 -1.361
33 HG3 GLU 6 HG3 GLU 6 8.186 -11.871 0.196
34 HE2 GLU 6 HE2 GLU 6 10.267 -9.389 1.818
35 H MET 7 H MET 7 3.436 -9.519 -1.191
36 HA MET 7 HA MET 7 4.250 -7.333 -2.899
37 HB3 MET 7 HB3 MET 7 1.777 -8.037 -3.812
38 HG3 MET 7 HG3 MET 7 3.865 -10.118 -4.369
39 HE1 MET 7 HE1 MET 7 3.410 -7.634 -7.693
40 HE2 MET 7 HE2 MET 7 4.691 -8.398 -6.723
41 HE3 MET 7 HE3 MET 7 3.901 -9.311 -8.031
42 H ALA 8 H ALA 8 0.965 -8.163 -1.624
43 HA ALA 8 HA ALA 8 0.055 -5.585 -1.501
44 HB1 ALA 8 HB1 ALA 8 -0.688 -8.229 -0.420
45 HB2 ALA 8 HB2 ALA 8 -1.290 -6.861 0.546
46 HB3 ALA 8 HB3 ALA 8 -1.702 -6.979 -1.182
47 H GLY 9 H GLY 9 2.357 -7.235 0.564
48 HA2 GLY 9 HA2 GLY 9 1.999 -5.518 2.844
49 HA3 GLY 9 HA3 GLY 9 3.268 -6.695 2.574
50 H ALA 10 H ALA 10 4.009 -5.606 -0.122
51 HA ALA 10 HA ALA 10 5.623 -3.400 0.877
52 HB1 ALA 10 HB1 ALA 10 6.840 -5.162 -0.211
53 HB2 ALA 10 HB2 ALA 10 5.722 -5.164 -1.596
54 HB3 ALA 10 HB3 ALA 10 6.814 -3.783 -1.335
55 H PHE 11 H PHE 11 2.777 -4.066 -1.032
56 HA PHE 11 HA PHE 11 2.970 -1.699 -2.623
57 HB3 PHE 11 HB3 PHE 11 0.439 -2.436 -2.935
58 HD1 PHE 11 HD2 PHE 11 2.928 -2.191 -4.557
59 HD2 PHE 11 HD1 PHE 11 0.712 -5.617 -3.387
60 HE1 PHE 11 HE2 PHE 11 3.771 -3.424 -6.574
61 HE2 PHE 11 HE1 PHE 11 1.555 -6.850 -5.404
62 HZ PHE 11 HZ PHE 11 3.074 -5.739 -6.973
63 H VAL 12 H VAL 12 1.360 -2.708 0.428
64 HA VAL 12 HA VAL 12 -0.432 -0.698 0.767
65 HB VAL 12 HB VAL 12 0.306 -0.971 3.267
66 HG11 VAL 12 HG11 VAL 12 -1.739 -1.906 2.515
67 HG12 VAL 12 HG12 VAL 12 -0.907 -3.118 1.510
68 HG13 VAL 12 HG13 VAL 12 -0.849 -3.242 3.285
69 HG21 VAL 12 HG21 VAL 12 1.390 -3.605 2.616
70 HG22 VAL 12 HG22 VAL 12 2.437 -2.281 2.055
71 HG23 VAL 12 HG23 VAL 12 1.972 -2.382 3.770
72 H ALA 13 H ALA 13 3.135 -0.598 1.134
73 HA ALA 13 HA ALA 13 3.112 2.043 2.222
74 HB1 ALA 13 HB1 ALA 13 5.475 0.703 0.897
75 HB2 ALA 13 HB2 ALA 13 5.443 1.791 2.304
76 HB3 ALA 13 HB3 ALA 13 4.863 0.117 2.462
77 H VAL 14 H VAL 14 3.911 0.559 -0.992
78 HA VAL 14 HA VAL 14 4.599 2.853 -2.319
79 HB VAL 14 HB VAL 14 3.131 0.389 -3.274
80 HG11 VAL 14 HG11 VAL 14 3.759 2.843 -4.681
81 HG12 VAL 14 HG12 VAL 14 4.645 1.469 -5.385
82 HG13 VAL 14 HG13 VAL 14 2.872 1.406 -5.244
83 HG21 VAL 14 HG21 VAL 14 5.731 0.700 -2.294
84 HG22 VAL 14 HG22 VAL 14 5.099 -0.669 -3.240
85 HG23 VAL 14 HG23 VAL 14 5.917 0.679 -4.065
86 H PHE 15 H PHE 15 1.504 1.903 -1.011
87 HA PHE 15 HA PHE 15 0.054 3.705 -2.747
88 HB3 PHE 15 HB3 PHE 15 -0.566 1.852 -0.380
89 HD1 PHE 15 HD2 PHE 15 -2.487 3.580 -3.084
90 HD2 PHE 15 HD1 PHE 15 -2.286 2.478 1.008
91 HE1 PHE 15 HE2 PHE 15 -4.743 4.611 -2.696
92 HE2 PHE 15 HE1 PHE 15 -4.543 3.508 1.396
93 HZ PHE 15 HZ PHE 15 -5.744 4.561 -0.460
94 H LEU 16 H LEU 16 0.854 3.359 0.777
95 HA LEU 16 HA LEU 16 -0.380 5.774 1.510
96 HB3 LEU 16 HB3 LEU 16 1.286 3.702 2.736
97 HG LEU 16 HG LEU 16 2.577 5.863 3.265
98 HD11 LEU 16 HD11 LEU 16 1.664 7.545 4.479
99 HD12 LEU 16 HD12 LEU 16 0.183 6.996 3.659
100 HD13 LEU 16 HD13 LEU 16 0.523 6.473 5.326
101 HD21 LEU 16 HD21 LEU 16 1.619 4.712 5.830
102 HD22 LEU 16 HD22 LEU 16 2.267 3.571 4.626
103 HD23 LEU 16 HD23 LEU 16 3.271 4.922 5.202
104 H LEU 17 H LEU 17 3.011 4.894 0.627
105 HA LEU 17 HA LEU 17 4.082 7.426 1.125
106 HB3 LEU 17 HB3 LEU 17 4.926 4.896 0.100
107 HG LEU 17 HG LEU 17 5.104 6.206 -2.089
108 HD11 LEU 17 HD11 LEU 17 6.010 8.250 -0.610
109 HD12 LEU 17 HD12 LEU 17 7.565 7.506 -1.052
110 HD13 LEU 17 HD13 LEU 17 6.433 8.023 -2.325
111 HD21 LEU 17 HD21 LEU 17 7.767 5.539 -2.041
112 HD22 LEU 17 HD22 LEU 17 7.104 4.559 -0.711
113 HD23 LEU 17 HD23 LEU 17 6.420 4.417 -2.349
114 H ALA 18 H ALA 18 2.121 6.122 -1.502
115 HA ALA 18 HA ALA 18 2.835 8.130 -3.389
116 HB1 ALA 18 HB1 ALA 18 0.851 7.218 -4.608
117 HB2 ALA 18 HB2 ALA 18 1.993 5.953 -4.094
118 HB3 ALA 18 HB3 ALA 18 0.483 6.208 -3.188
119 H MET 19 H MET 19 0.296 7.688 -0.884
120 HA MET 19 HA MET 19 -1.022 10.084 -1.698
121 HB3 MET 19 HB3 MET 19 -1.785 9.216 0.961
122 HG3 MET 19 HG3 MET 19 -3.686 8.138 -0.709
123 HE1 MET 19 HE1 MET 19 -5.415 9.704 -1.710
124 HE2 MET 19 HE2 MET 19 -6.292 10.642 -0.478
125 HE3 MET 19 HE3 MET 19 -5.225 11.472 -1.635
126 H PHE 20 H PHE 20 1.881 9.570 -0.194
127 HA PHE 20 HA PHE 20 1.534 11.558 1.886
128 HB3 PHE 20 HB3 PHE 20 3.909 9.912 0.823
129 HD1 PHE 20 HD1 PHE 20 5.025 12.319 1.095
130 HD2 PHE 20 HD2 PHE 20 3.668 9.893 4.301
131 HE1 PHE 20 HE1 PHE 20 6.564 13.532 2.664
132 HE2 PHE 20 HE2 PHE 20 5.207 11.106 5.870
133 HZ PHE 20 HZ PHE 20 6.638 12.910 5.033
134 H TYR 21 H TYR 21 2.658 11.260 -1.439
135 HA TYR 21 HA TYR 21 4.533 13.235 -1.626
136 HB3 TYR 21 HB3 TYR 21 3.216 13.507 -3.960
137 HD1 TYR 21 HD1 TYR 21 3.260 9.980 -2.778
138 HD2 TYR 21 HD2 TYR 21 5.349 13.045 -4.910
139 HE1 TYR 21 HE1 TYR 21 4.934 8.262 -3.623
140 HE2 TYR 21 HE2 TYR 21 7.014 11.317 -5.749
141 HH TYR 21 HH TYR 21 7.762 9.261 -5.477
142 H GLU 22 H GLU 22 0.964 13.673 -2.206
143 HA GLU 22 HA GLU 22 1.383 16.509 -1.890
144 HB3 GLU 22 HB3 GLU 22 -1.277 16.295 -2.400
145 HG3 GLU 22 HG3 GLU 22 1.157 16.305 -4.175
146 HE2 GLU 22 HE2 GLU 22 -0.673 17.722 -5.984
147 H GLY 23 H GLY 23 0.047 13.697 -0.207
148 HA2 GLY 23 HA2 GLY 23 -1.776 14.654 1.530
149 HA3 GLY 23 HA3 GLY 23 -0.549 13.482 1.966
150 H LEU 24 H LEU 24 1.827 14.808 2.050
151 HA LEU 24 HA LEU 24 1.919 16.020 4.439
152 HB3 LEU 24 HB3 LEU 24 3.910 15.375 3.384
153 HG LEU 24 HG LEU 24 3.050 16.088 0.984
154 HD11 LEU 24 HD11 LEU 24 3.291 18.581 1.914
155 HD12 LEU 24 HD12 LEU 24 4.947 18.360 1.297
156 HD13 LEU 24 HD13 LEU 24 3.556 18.158 0.205
157 HD21 LEU 24 HD21 LEU 24 5.060 15.392 0.208
158 HD22 LEU 24 HD22 LEU 24 5.980 16.486 1.268
159 HD23 LEU 24 HD23 LEU 24 5.304 14.975 1.921
160 H LYS 25 H LYS 25 1.155 17.573 1.283
161 HA LYS 25 HA LYS 25 0.206 19.879 2.831
162 HB3 LYS 25 HB3 LYS 25 2.320 20.501 1.809
163 HG3 LYS 25 HG3 LYS 25 1.688 18.753 -0.221
164 HD3 LYS 25 HD3 LYS 25 1.000 21.577 -1.113
165 HE3 LYS 25 HE3 LYS 25 2.761 20.754 -2.654
166 HZ1 LYS 25 HZ1 LYS 25 1.964 18.714 -3.948
167 HZ2 LYS 25 HZ2 LYS 25 2.718 18.487 -2.517
168 HZ3 LYS 25 HZ3 LYS 25 1.092 18.367 -2.612
Start of MODEL 20
1 H1 LYS 1 H1 LYS 1 -2.258 -21.897 2.197
2 HA LYS 1 HA LYS 1 -0.349 -21.560 0.810
3 HB3 LYS 1 HB3 LYS 1 -1.011 -21.515 -1.768
4 HG3 LYS 1 HG3 LYS 1 -0.398 -24.016 -0.124
5 HD3 LYS 1 HD3 LYS 1 0.111 -23.485 -3.088
6 HE3 LYS 1 HE3 LYS 1 1.483 -25.171 -1.400
7 HZ1 LYS 1 HZ1 LYS 1 -0.992 -26.418 -2.089
8 HZ2 LYS 1 HZ2 LYS 1 0.320 -27.318 -2.460
9 HZ3 LYS 1 HZ3 LYS 1 0.084 -26.811 -0.926
10 H ASN 2 H ASN 2 -1.416 -19.767 2.266
11 HA ASN 2 HA ASN 2 -2.526 -17.760 0.467
12 HB3 ASN 2 HB3 ASN 2 -3.370 -16.664 2.590
13 HD21 ASN 2 HD22 ASN 2 -4.516 -18.837 4.319
14 HD22 ASN 2 HD21 ASN 2 -5.775 -19.571 3.384
15 H THR 3 H THR 3 -0.534 -16.816 -0.264
16 HA THR 3 HA THR 3 0.882 -15.270 1.746
17 HB THR 3 HB THR 3 3.086 -16.184 0.985
18 HG1 THR 3 HG1 THR 3 1.199 -17.900 -0.469
19 HG21 THR 3 HG21 THR 3 1.167 -18.457 1.717
20 HG22 THR 3 HG22 THR 3 2.935 -18.452 1.932
21 HG23 THR 3 HG23 THR 3 1.916 -17.365 2.906
22 H ALA 4 H ALA 4 -0.739 -13.922 0.316
23 HA ALA 4 HA ALA 4 0.600 -13.187 -2.180
24 HB1 ALA 4 HB1 ALA 4 -2.187 -12.880 -1.055
25 HB2 ALA 4 HB2 ALA 4 -1.628 -11.821 -2.371
26 HB3 ALA 4 HB3 ALA 4 -1.669 -13.585 -2.606
27 H GLY 5 H GLY 5 -0.081 -12.162 1.127
28 HA2 GLY 5 HA2 GLY 5 0.176 -9.398 0.881
29 HA3 GLY 5 HA3 GLY 5 0.551 -10.354 2.301
30 H GLU 6 H GLU 6 2.585 -12.011 0.715
31 HA GLU 6 HA GLU 6 4.823 -10.678 1.477
32 HB3 GLU 6 HB3 GLU 6 5.447 -12.298 -0.834
33 HG3 GLU 6 HG3 GLU 6 5.518 -13.507 1.890
34 HE2 GLU 6 HE2 GLU 6 8.662 -12.518 -0.038
35 H MET 7 H MET 7 2.772 -10.096 -1.283
36 HA MET 7 HA MET 7 4.887 -8.575 -2.570
37 HB3 MET 7 HB3 MET 7 2.901 -8.407 -4.359
38 HG3 MET 7 HG3 MET 7 4.080 -11.173 -3.864
39 HE1 MET 7 HE1 MET 7 5.107 -11.527 -7.443
40 HE2 MET 7 HE2 MET 7 5.208 -12.085 -5.756
41 HE3 MET 7 HE3 MET 7 3.938 -12.721 -6.829
42 H ALA 8 H ALA 8 1.295 -8.181 -2.116
43 HA ALA 8 HA ALA 8 1.252 -5.451 -2.394
44 HB1 ALA 8 HB1 ALA 8 -0.484 -7.579 -1.310
45 HB2 ALA 8 HB2 ALA 8 -0.780 -5.975 -0.598
46 HB3 ALA 8 HB3 ALA 8 -0.886 -6.200 -2.361
47 H GLY 9 H GLY 9 2.518 -7.413 0.213
48 HA2 GLY 9 HA2 GLY 9 2.218 -5.744 2.409
49 HA3 GLY 9 HA3 GLY 9 3.531 -6.874 2.144
50 H ALA 10 H ALA 10 4.344 -5.488 -0.443
51 HA ALA 10 HA ALA 10 5.892 -3.390 0.857
52 HB1 ALA 10 HB1 ALA 10 6.161 -5.125 -1.581
53 HB2 ALA 10 HB2 ALA 10 6.985 -3.548 -1.567
54 HB3 ALA 10 HB3 ALA 10 7.351 -4.754 -0.311
55 H PHE 11 H PHE 11 3.105 -3.868 -1.159
56 HA PHE 11 HA PHE 11 3.324 -1.405 -2.576
57 HB3 PHE 11 HB3 PHE 11 0.773 -2.062 -2.904
58 HD1 PHE 11 HD1 PHE 11 3.622 -4.491 -2.933
59 HD2 PHE 11 HD2 PHE 11 0.595 -2.507 -5.149
60 HE1 PHE 11 HE1 PHE 11 4.414 -5.623 -5.029
61 HE2 PHE 11 HE2 PHE 11 1.387 -3.639 -7.245
62 HZ PHE 11 HZ PHE 11 3.288 -5.183 -7.159
63 H VAL 12 H VAL 12 1.730 -2.560 0.431
64 HA VAL 12 HA VAL 12 -0.024 -0.561 0.925
65 HB VAL 12 HB VAL 12 0.808 -0.949 3.388
66 HG11 VAL 12 HG11 VAL 12 -0.648 -2.801 3.550
67 HG12 VAL 12 HG12 VAL 12 -1.248 -1.861 2.163
68 HG13 VAL 12 HG13 VAL 12 -0.290 -3.337 1.891
69 HG21 VAL 12 HG21 VAL 12 1.951 -3.461 2.194
70 HG22 VAL 12 HG22 VAL 12 2.973 -2.013 2.360
71 HG23 VAL 12 HG23 VAL 12 2.220 -2.740 3.800
72 H ALA 13 H ALA 13 3.554 -0.487 1.236
73 HA ALA 13 HA ALA 13 3.586 2.085 2.449
74 HB1 ALA 13 HB1 ALA 13 5.821 0.692 0.933
75 HB2 ALA 13 HB2 ALA 13 5.964 1.888 2.242
76 HB3 ALA 13 HB3 ALA 13 5.356 0.253 2.594
77 H VAL 14 H VAL 14 4.430 0.869 -0.876
78 HA VAL 14 HA VAL 14 4.990 3.206 -2.091
79 HB VAL 14 HB VAL 14 3.410 0.844 -3.117
80 HG11 VAL 14 HG11 VAL 14 4.818 2.074 -5.236
81 HG12 VAL 14 HG12 VAL 14 3.056 1.967 -5.011
82 HG13 VAL 14 HG13 VAL 14 3.949 3.376 -4.390
83 HG21 VAL 14 HG21 VAL 14 5.358 -0.239 -3.315
84 HG22 VAL 14 HG22 VAL 14 6.154 1.170 -4.056
85 HG23 VAL 14 HG23 VAL 14 6.062 1.030 -2.284
86 H PHE 15 H PHE 15 1.876 2.137 -0.823
87 HA PHE 15 HA PHE 15 0.405 4.113 -2.302
88 HB3 PHE 15 HB3 PHE 15 -0.127 2.159 0.005
89 HD1 PHE 15 HD2 PHE 15 -2.254 3.817 -2.572
90 HD2 PHE 15 HD1 PHE 15 -1.657 2.966 1.541
91 HE1 PHE 15 HE2 PHE 15 -4.471 4.864 -2.035
92 HE2 PHE 15 HE1 PHE 15 -3.874 4.013 2.080
93 HZ PHE 15 HZ PHE 15 -5.255 4.949 0.285
94 H LEU 16 H LEU 16 1.151 3.519 1.212
95 HA LEU 16 HA LEU 16 0.100 5.939 2.094
96 HB3 LEU 16 HB3 LEU 16 2.179 4.077 3.235
97 HG LEU 16 HG LEU 16 2.456 6.271 4.327
98 HD11 LEU 16 HD11 LEU 16 -0.070 6.377 5.728
99 HD12 LEU 16 HD12 LEU 16 0.770 7.637 4.794
100 HD13 LEU 16 HD13 LEU 16 -0.317 6.493 3.969
101 HD21 LEU 16 HD21 LEU 16 2.847 5.199 6.232
102 HD22 LEU 16 HD22 LEU 16 1.108 4.959 6.532
103 HD23 LEU 16 HD23 LEU 16 2.010 3.790 5.536
104 H LEU 17 H LEU 17 3.369 5.026 0.903
105 HA LEU 17 HA LEU 17 4.497 7.556 1.523
106 HB3 LEU 17 HB3 LEU 17 5.377 5.018 0.673
107 HG LEU 17 HG LEU 17 5.425 6.098 -1.659
108 HD11 LEU 17 HD11 LEU 17 6.521 8.234 -0.361
109 HD12 LEU 17 HD12 LEU 17 7.970 7.428 -1.009
110 HD13 LEU 17 HD13 LEU 17 6.657 7.917 -2.108
111 HD21 LEU 17 HD21 LEU 17 6.705 4.273 -1.806
112 HD22 LEU 17 HD22 LEU 17 8.081 5.394 -1.672
113 HD23 LEU 17 HD23 LEU 17 7.466 4.561 -0.223
114 H ALA 18 H ALA 18 2.472 6.283 -1.036
115 HA ALA 18 HA ALA 18 3.236 8.350 -2.901
116 HB1 ALA 18 HB1 ALA 18 1.298 6.029 -2.869
117 HB2 ALA 18 HB2 ALA 18 1.210 7.273 -4.140
118 HB3 ALA 18 HB3 ALA 18 2.694 6.310 -3.937
119 H MET 19 H MET 19 1.122 7.946 -0.185
120 HA MET 19 HA MET 19 -0.915 9.673 -1.079
121 HB3 MET 19 HB3 MET 19 -0.606 9.616 1.830
122 HG3 MET 19 HG3 MET 19 -2.498 7.757 0.424
123 HE1 MET 19 HE1 MET 19 -1.716 10.739 3.155
124 HE2 MET 19 HE2 MET 19 -2.700 11.252 1.762
125 HE3 MET 19 HE3 MET 19 -3.439 11.126 3.376
126 H PHE 20 H PHE 20 2.202 10.083 0.610
127 HA PHE 20 HA PHE 20 1.897 12.525 1.760
128 HB3 PHE 20 HB3 PHE 20 4.432 12.697 0.896
129 HD1 PHE 20 HD1 PHE 20 3.460 9.241 1.804
130 HD2 PHE 20 HD2 PHE 20 4.940 12.972 3.181
131 HE1 PHE 20 HE1 PHE 20 4.009 8.203 4.024
132 HE2 PHE 20 HE2 PHE 20 5.489 11.934 5.401
133 HZ PHE 20 HZ PHE 20 5.017 9.564 5.795
134 H TYR 21 H TYR 21 3.008 11.890 -1.647
135 HA TYR 21 HA TYR 21 3.409 14.372 -2.551
136 HB3 TYR 21 HB3 TYR 21 2.446 13.402 -4.728
137 HD1 TYR 21 HD1 TYR 21 3.119 10.332 -2.803
138 HD2 TYR 21 HD2 TYR 21 4.832 13.426 -5.210
139 HE1 TYR 21 HE1 TYR 21 5.246 8.964 -3.061
140 HE2 TYR 21 HE2 TYR 21 6.953 12.047 -5.460
141 HH TYR 21 HH TYR 21 7.553 9.299 -3.531
142 H GLU 22 H GLU 22 0.167 12.813 -2.149
143 HA GLU 22 HA GLU 22 -1.253 14.916 -3.256
144 HB3 GLU 22 HB3 GLU 22 -2.875 13.684 -1.256
145 HG3 GLU 22 HG3 GLU 22 -2.536 12.754 -4.137
146 HE2 GLU 22 HE2 GLU 22 -5.353 11.052 -3.755
147 H GLY 23 H GLY 23 -0.267 14.192 0.145
148 HA2 GLY 23 HA2 GLY 23 -1.607 16.008 1.608
149 HA3 GLY 23 HA3 GLY 23 0.084 15.623 1.864
150 H LEU 24 H LEU 24 1.472 16.722 -0.206
151 HA LEU 24 HA LEU 24 1.811 19.307 0.417
152 HB3 LEU 24 HB3 LEU 24 2.907 17.589 -1.345
153 HG LEU 24 HG LEU 24 1.079 18.520 -3.050
154 HD11 LEU 24 HD11 LEU 24 1.643 20.455 -4.216
155 HD12 LEU 24 HD12 LEU 24 1.914 20.900 -2.513
156 HD13 LEU 24 HD13 LEU 24 3.297 20.492 -3.557
157 HD21 LEU 24 HD21 LEU 24 3.060 16.904 -3.362
158 HD22 LEU 24 HD22 LEU 24 2.428 17.758 -4.791
159 HD23 LEU 24 HD23 LEU 24 3.926 18.318 -4.011
160 H LYS 25 H LYS 25 -0.705 17.928 -1.713
161 HA LYS 25 HA LYS 25 -1.588 20.115 -3.034
162 HB3 LYS 25 HB3 LYS 25 -3.386 18.064 -1.712
163 HG3 LYS 25 HG3 LYS 25 -3.760 20.213 -3.667
164 HD3 LYS 25 HD3 LYS 25 -5.308 18.389 -4.987
165 HE3 LYS 25 HE3 LYS 25 -2.957 19.938 -5.543
166 HZ1 LYS 25 HZ1 LYS 25 -2.347 17.325 -5.772
167 HZ2 LYS 25 HZ2 LYS 25 -2.780 17.718 -7.297
168 HZ3 LYS 25 HZ3 LYS 25 -1.587 18.545 -6.549