Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
622517 | 5wye RC | 36044 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 VAL 1 H VAL 1 1.807 0.001 0.856
2 HA VAL 1 HA VAL 1 2.308 1.024 -1.504
3 HB VAL 1 HB VAL 1 4.019 -0.230 -0.331
4 HG11 VAL 1 1HG1 VAL 1 2.682 -2.145 0.359
5 HG12 VAL 1 2HG1 VAL 1 2.590 -2.700 -1.313
6 HG13 VAL 1 3HG1 VAL 1 4.142 -2.673 -0.475
7 HG21 VAL 1 1HG2 VAL 1 5.258 -0.595 -2.177
8 HG22 VAL 1 2HG2 VAL 1 4.071 -1.690 -2.887
9 HG23 VAL 1 3HG2 VAL 1 3.848 0.055 -3.015
10 H ALA 2 H ALA 2 0.479 -1.946 -1.097
11 HA ALA 2 HA ALA 2 -0.177 -1.859 -3.970
12 HB1 ALA 2 1HB ALA 2 1.237 -3.851 -2.921
13 HB2 ALA 2 2HB ALA 2 -0.379 -4.445 -2.535
14 HB3 ALA 2 3HB ALA 2 0.059 -4.106 -4.209
15 H ARG 3 H ARG 3 -2.237 -1.394 -4.330
16 HA ARG 3 HA ARG 3 -4.182 -1.021 -2.409
17 HB2 ARG 3 2HB ARG 3 -5.706 -0.712 -4.154
18 HB3 ARG 3 3HB ARG 3 -4.156 -0.321 -4.887
19 HG2 ARG 3 2HG ARG 3 -4.177 -2.829 -5.597
20 HG3 ARG 3 3HG ARG 3 -5.915 -2.685 -5.324
21 HD2 ARG 3 2HD ARG 3 -6.098 -0.935 -6.934
22 HD3 ARG 3 3HD ARG 3 -4.345 -0.803 -7.072
23 HE ARG 3 HE ARG 3 -6.033 -2.625 -8.459
24 HH11 ARG 3 1HH1 ARG 3 -2.868 -2.281 -7.050
25 HH12 ARG 3 2HH1 ARG 3 -2.131 -3.448 -8.098
26 HH21 ARG 3 1HH2 ARG 3 -5.075 -4.163 -9.845
27 HH22 ARG 3 2HH2 ARG 3 -3.387 -4.517 -9.688
28 H GLY 4 H GLY 4 -3.237 -3.958 -4.048
29 HA2 GLY 4 2HA GLY 4 -5.392 -5.401 -2.637
30 HA3 GLY 4 3HA GLY 4 -4.647 -5.949 -4.131
31 H TRP 5 H TRP 5 -4.529 -6.008 -0.722
32 HA TRP 5 HA TRP 5 -2.038 -7.579 -0.835
33 HB2 TRP 5 2HB TRP 5 -2.943 -5.494 1.098
34 HB3 TRP 5 3HB TRP 5 -1.994 -6.843 1.716
35 HD1 TRP 5 HD1 TRP 5 -1.270 -3.540 1.056
36 HE1 TRP 5 HE1 TRP 5 1.048 -3.141 0.010
37 HE3 TRP 5 HE3 TRP 5 -0.312 -8.273 -0.622
38 HZ2 TRP 5 HZ2 TRP 5 3.021 -4.636 -1.346
39 HZ3 TRP 5 HZ3 TRP 5 1.813 -8.705 -1.784
40 HH2 TRP 5 HH2 TRP 5 3.444 -6.922 -2.138
41 H LYS 6 H LYS 6 -4.333 -7.082 1.812
42 HA LYS 6 HA LYS 6 -4.431 -9.421 3.012
43 HB2 LYS 6 2HB LYS 6 -7.078 -9.141 2.952
44 HB3 LYS 6 3HB LYS 6 -6.046 -8.055 3.873
45 HG2 LYS 6 2HG LYS 6 -6.518 -7.271 1.079
46 HG3 LYS 6 3HG LYS 6 -7.936 -7.244 2.131
47 HD2 LYS 6 2HD LYS 6 -5.958 -6.071 3.666
48 HD3 LYS 6 3HD LYS 6 -5.644 -5.455 2.042
49 HE2 LYS 6 2HE LYS 6 -8.322 -5.178 2.149
50 HE3 LYS 6 3HE LYS 6 -7.923 -4.971 3.853
51 HZ1 LYS 6 1HZ LYS 6 -7.544 -3.167 1.688
52 HZ2 LYS 6 2HZ LYS 6 -6.083 -3.457 2.488
53 HZ3 LYS 6 3HZ LYS 6 -7.420 -2.884 3.352
54 H ARG 7 H ARG 7 -6.401 -8.871 0.087
55 HA ARG 7 HA ARG 7 -6.996 -11.669 -0.175
56 HB2 ARG 7 2HB ARG 7 -7.546 -9.255 -1.890
57 HB3 ARG 7 3HB ARG 7 -7.955 -10.882 -2.417
58 HG2 ARG 7 2HG ARG 7 -9.283 -11.100 -0.275
59 HG3 ARG 7 3HG ARG 7 -9.054 -9.361 -0.073
60 HD2 ARG 7 2HD ARG 7 -10.711 -8.939 -1.491
61 HD3 ARG 7 3HD ARG 7 -9.929 -9.904 -2.742
62 HE ARG 7 HE ARG 7 -11.184 -11.638 -0.940
63 HH11 ARG 7 1HH1 ARG 7 -12.004 -9.237 -3.324
64 HH12 ARG 7 2HH1 ARG 7 -13.527 -9.961 -3.720
65 HH21 ARG 7 1HH2 ARG 7 -13.188 -12.601 -1.452
66 HH22 ARG 7 2HH2 ARG 7 -14.200 -11.874 -2.654
67 H LYS 8 H LYS 8 -5.632 -9.517 -2.653
68 HA LYS 8 HA LYS 8 -4.195 -11.690 -3.856
69 HB2 LYS 8 2HB LYS 8 -4.127 -8.721 -4.430
70 HB3 LYS 8 3HB LYS 8 -3.371 -9.959 -5.425
71 HG2 LYS 8 2HG LYS 8 -6.128 -10.609 -5.004
72 HG3 LYS 8 3HG LYS 8 -5.981 -8.957 -5.609
73 HD2 LYS 8 2HD LYS 8 -6.058 -10.168 -7.572
74 HD3 LYS 8 3HD LYS 8 -4.318 -10.030 -7.310
75 HE2 LYS 8 2HE LYS 8 -4.690 -12.284 -7.873
76 HE3 LYS 8 3HE LYS 8 -4.470 -12.269 -6.124
77 HZ1 LYS 8 1HZ LYS 8 -6.472 -13.143 -5.857
78 HZ2 LYS 8 2HZ LYS 8 -6.610 -13.305 -7.534
79 HZ3 LYS 8 3HZ LYS 8 -7.201 -11.918 -6.768
80 H CYS 9 H CYS 9 -2.292 -12.420 -3.203
81 HA CYS 9 HA CYS 9 -0.449 -10.546 -1.869
82 HB2 CYS 9 2HB CYS 9 0.469 -12.619 -0.730
83 HB3 CYS 9 3HB CYS 9 -1.139 -12.115 -0.225
84 HG CYS 9 HG CYS 9 -0.196 -14.885 -1.915
85 HA PRO 10 HA PRO 10 1.545 -12.050 -5.779
86 HB2 PRO 10 2HB PRO 10 2.495 -9.613 -6.506
87 HB3 PRO 10 3HB PRO 10 0.873 -10.175 -6.924
88 HG2 PRO 10 2HG PRO 10 1.734 -8.354 -4.710
89 HG3 PRO 10 3HG PRO 10 0.343 -8.209 -5.801
90 HD2 PRO 10 2HD PRO 10 0.118 -9.142 -3.269
91 HD3 PRO 10 3HD PRO 10 -0.921 -9.710 -4.592
92 H LEU 11 H LEU 11 2.774 -9.601 -3.500
93 HA LEU 11 HA LEU 11 5.396 -10.941 -3.608
94 HB2 LEU 11 2HB LEU 11 5.613 -8.351 -2.462
95 HB3 LEU 11 3HB LEU 11 6.335 -8.967 -3.947
96 HG LEU 11 HG LEU 11 3.545 -7.847 -3.862
97 HD11 LEU 11 1HD1 LEU 11 4.482 -5.875 -3.369
98 HD12 LEU 11 2HD1 LEU 11 5.054 -5.910 -5.036
99 HD13 LEU 11 3HD1 LEU 11 6.112 -6.445 -3.730
100 HD21 LEU 11 1HD2 LEU 11 5.322 -7.721 -6.228
101 HD22 LEU 11 2HD2 LEU 11 3.580 -7.977 -6.128
102 HD23 LEU 11 3HD2 LEU 11 4.689 -9.304 -5.777
103 H PHE 12 H PHE 12 4.043 -8.578 -1.335
104 HA PHE 12 HA PHE 12 4.416 -10.556 0.817
105 HB2 PHE 12 2HB PHE 12 4.621 -8.067 2.030
106 HB3 PHE 12 3HB PHE 12 5.955 -9.154 1.656
107 HD1 PHE 12 HD1 PHE 12 4.113 -6.172 0.577
108 HD2 PHE 12 HD2 PHE 12 7.455 -8.704 -0.153
109 HE1 PHE 12 HE1 PHE 12 5.062 -4.478 -0.934
110 HE2 PHE 12 HE2 PHE 12 8.410 -7.014 -1.665
111 HZ PHE 12 HZ PHE 12 7.214 -4.897 -2.056
112 H GLY 13 H GLY 13 2.238 -11.175 0.773
113 HA2 GLY 13 2HA GLY 13 0.166 -9.174 1.091
114 HA3 GLY 13 3HA GLY 13 -0.064 -10.914 1.015
115 H LYS 14 H LYS 14 2.250 -10.815 3.173
116 HA LYS 14 HA LYS 14 0.458 -11.091 5.397
117 HB2 LYS 14 2HB LYS 14 3.465 -11.013 5.553
118 HB3 LYS 14 3HB LYS 14 2.342 -11.828 6.633
119 HG2 LYS 14 2HG LYS 14 2.688 -13.683 5.478
120 HG3 LYS 14 3HG LYS 14 1.863 -12.926 4.113
121 HD2 LYS 14 2HD LYS 14 4.179 -11.857 3.633
122 HD3 LYS 14 3HD LYS 14 4.798 -13.145 4.670
123 HE2 LYS 14 2HE LYS 14 2.989 -14.353 2.886
124 HE3 LYS 14 3HE LYS 14 3.980 -13.258 1.923
125 HZ1 LYS 14 1HZ LYS 14 5.950 -14.321 2.704
126 HZ2 LYS 14 2HZ LYS 14 4.906 -15.527 2.143
127 HZ3 LYS 14 3HZ LYS 14 5.084 -15.270 3.805
128 H GLY 15 H GLY 15 3.163 -8.889 4.651
129 HA2 GLY 15 2HA GLY 15 2.201 -7.099 6.779
130 HA3 GLY 15 3HA GLY 15 3.808 -7.069 6.070
131 H GLY 16 H GLY 16 0.778 -7.236 4.275
132 HA2 GLY 16 2HA GLY 16 1.422 -5.327 2.392
133 HA3 GLY 16 3HA GLY 16 -0.225 -5.745 2.842
Start of MODEL 2
1 H1 VAL 1 H VAL 1 1.280 0.763 0.065
2 HA VAL 1 HA VAL 1 2.444 0.801 -1.894
3 HB VAL 1 HB VAL 1 4.168 -0.490 -0.783
4 HG11 VAL 1 1HG1 VAL 1 4.171 -2.934 -0.818
5 HG12 VAL 1 2HG1 VAL 1 2.777 -2.308 0.065
6 HG13 VAL 1 3HG1 VAL 1 2.578 -2.928 -1.575
7 HG21 VAL 1 1HG2 VAL 1 3.832 -0.303 -3.460
8 HG22 VAL 1 2HG2 VAL 1 5.266 -0.982 -2.689
9 HG23 VAL 1 3HG2 VAL 1 3.988 -2.050 -3.271
10 H ALA 2 H ALA 2 0.527 -2.076 -1.258
11 HA ALA 2 HA ALA 2 -0.324 -2.051 -4.081
12 HB1 ALA 2 1HB ALA 2 -0.179 -4.308 -4.266
13 HB2 ALA 2 2HB ALA 2 1.083 -4.067 -3.057
14 HB3 ALA 2 3HB ALA 2 -0.527 -4.584 -2.559
15 H ARG 3 H ARG 3 -2.385 -1.514 -4.312
16 HA ARG 3 HA ARG 3 -4.175 -1.019 -2.268
17 HB2 ARG 3 2HB ARG 3 -5.834 -0.743 -3.921
18 HB3 ARG 3 3HB ARG 3 -4.322 -0.317 -4.713
19 HG2 ARG 3 2HG ARG 3 -5.578 -3.039 -4.926
20 HG3 ARG 3 3HG ARG 3 -5.904 -1.726 -6.058
21 HD2 ARG 3 2HD ARG 3 -3.214 -1.686 -6.059
22 HD3 ARG 3 3HD ARG 3 -3.492 -3.394 -5.721
23 HE ARG 3 HE ARG 3 -4.154 -3.659 -7.886
24 HH11 ARG 3 1HH1 ARG 3 -4.371 -0.284 -7.060
25 HH12 ARG 3 2HH1 ARG 3 -4.773 0.218 -8.669
26 HH21 ARG 3 1HH2 ARG 3 -4.683 -3.010 -10.008
27 HH22 ARG 3 2HH2 ARG 3 -4.951 -1.334 -10.345
28 H GLY 4 H GLY 4 -3.449 -4.022 -3.892
29 HA2 GLY 4 2HA GLY 4 -5.570 -5.350 -2.324
30 HA3 GLY 4 3HA GLY 4 -4.932 -5.961 -3.843
31 H TRP 5 H TRP 5 -4.611 -5.926 -0.442
32 HA TRP 5 HA TRP 5 -2.199 -7.607 -0.656
33 HB2 TRP 5 2HB TRP 5 -2.898 -5.431 1.265
34 HB3 TRP 5 3HB TRP 5 -1.962 -6.799 1.861
35 HD1 TRP 5 HD1 TRP 5 -1.163 -3.545 1.050
36 HE1 TRP 5 HE1 TRP 5 1.096 -3.267 -0.151
37 HE3 TRP 5 HE3 TRP 5 -0.486 -8.360 -0.528
38 HZ2 TRP 5 HZ2 TRP 5 2.923 -4.876 -1.580
39 HZ3 TRP 5 HZ3 TRP 5 1.543 -8.907 -1.807
40 HH2 TRP 5 HH2 TRP 5 3.211 -7.200 -2.321
41 H LYS 6 H LYS 6 -4.313 -6.930 2.102
42 HA LYS 6 HA LYS 6 -4.431 -9.224 3.386
43 HB2 LYS 6 2HB LYS 6 -7.063 -8.837 3.471
44 HB3 LYS 6 3HB LYS 6 -5.936 -7.763 4.290
45 HG2 LYS 6 2HG LYS 6 -6.544 -7.056 1.503
46 HG3 LYS 6 3HG LYS 6 -7.895 -6.937 2.632
47 HD2 LYS 6 2HD LYS 6 -5.324 -5.805 3.546
48 HD3 LYS 6 3HD LYS 6 -6.123 -4.956 2.220
49 HE2 LYS 6 2HE LYS 6 -8.192 -5.435 3.951
50 HE3 LYS 6 3HE LYS 6 -6.844 -5.140 5.048
51 HZ1 LYS 6 1HZ LYS 6 -6.704 -3.211 3.059
52 HZ2 LYS 6 2HZ LYS 6 -7.119 -2.988 4.683
53 HZ3 LYS 6 3HZ LYS 6 -8.326 -3.279 3.535
54 H ARG 7 H ARG 7 -6.532 -8.685 0.552
55 HA ARG 7 HA ARG 7 -7.244 -11.470 0.423
56 HB2 ARG 7 2HB ARG 7 -8.882 -9.817 -0.238
57 HB3 ARG 7 3HB ARG 7 -7.788 -9.161 -1.447
58 HG2 ARG 7 2HG ARG 7 -8.081 -11.916 -1.993
59 HG3 ARG 7 3HG ARG 7 -9.692 -11.255 -1.706
60 HD2 ARG 7 2HD ARG 7 -7.847 -9.698 -3.431
61 HD3 ARG 7 3HD ARG 7 -8.529 -11.183 -4.095
62 HE ARG 7 HE ARG 7 -9.913 -8.717 -3.576
63 HH11 ARG 7 1HH1 ARG 7 -10.240 -12.161 -3.968
64 HH12 ARG 7 2HH1 ARG 7 -11.906 -12.081 -4.436
65 HH21 ARG 7 1HH2 ARG 7 -12.107 -8.599 -4.191
66 HH22 ARG 7 2HH2 ARG 7 -12.967 -10.054 -4.563
67 H LYS 8 H LYS 8 -5.993 -9.437 -2.209
68 HA LYS 8 HA LYS 8 -4.733 -11.671 -3.470
69 HB2 LYS 8 2HB LYS 8 -4.861 -8.725 -4.022
70 HB3 LYS 8 3HB LYS 8 -3.729 -9.738 -4.908
71 HG2 LYS 8 2HG LYS 8 -6.306 -10.972 -4.921
72 HG3 LYS 8 3HG LYS 8 -6.451 -9.293 -5.447
73 HD2 LYS 8 2HD LYS 8 -6.035 -10.593 -7.393
74 HD3 LYS 8 3HD LYS 8 -4.537 -9.736 -7.023
75 HE2 LYS 8 2HE LYS 8 -3.417 -11.643 -6.725
76 HE3 LYS 8 3HE LYS 8 -4.681 -12.310 -5.693
77 HZ1 LYS 8 1HZ LYS 8 -5.792 -13.210 -7.500
78 HZ2 LYS 8 2HZ LYS 8 -4.169 -13.478 -7.893
79 HZ3 LYS 8 3HZ LYS 8 -5.017 -12.209 -8.623
80 H CYS 9 H CYS 9 -2.847 -12.521 -2.919
81 HA CYS 9 HA CYS 9 -0.828 -10.775 -1.671
82 HB2 CYS 9 2HB CYS 9 -1.047 -13.762 -1.290
83 HB3 CYS 9 3HB CYS 9 -0.051 -12.633 -0.379
84 HG CYS 9 HG CYS 9 -3.473 -12.686 -0.296
85 HA PRO 10 HA PRO 10 0.853 -12.286 -5.728
86 HB2 PRO 10 2HB PRO 10 1.853 -9.876 -6.479
87 HB3 PRO 10 3HB PRO 10 0.187 -10.369 -6.805
88 HG2 PRO 10 2HG PRO 10 1.253 -8.618 -4.623
89 HG3 PRO 10 3HG PRO 10 -0.195 -8.402 -5.624
90 HD2 PRO 10 2HD PRO 10 -0.303 -9.365 -3.096
91 HD3 PRO 10 3HD PRO 10 -1.442 -9.871 -4.360
92 H LEU 11 H LEU 11 2.341 -9.867 -3.567
93 HA LEU 11 HA LEU 11 4.875 -11.352 -3.798
94 HB2 LEU 11 2HB LEU 11 5.309 -8.753 -2.745
95 HB3 LEU 11 3HB LEU 11 5.890 -9.442 -4.260
96 HG LEU 11 HG LEU 11 3.174 -8.175 -4.022
97 HD11 LEU 11 1HD1 LEU 11 4.223 -6.239 -3.634
98 HD12 LEU 11 2HD1 LEU 11 4.715 -6.340 -5.324
99 HD13 LEU 11 3HD1 LEU 11 5.804 -6.898 -4.054
100 HD21 LEU 11 1HD2 LEU 11 4.830 -8.202 -6.485
101 HD22 LEU 11 2HD2 LEU 11 3.080 -8.312 -6.293
102 HD23 LEU 11 3HD2 LEU 11 4.093 -9.719 -5.970
103 H PHE 12 H PHE 12 3.806 -8.858 -1.516
104 HA PHE 12 HA PHE 12 4.205 -10.798 0.666
105 HB2 PHE 12 2HB PHE 12 4.637 -8.323 1.815
106 HB3 PHE 12 3HB PHE 12 5.888 -9.463 1.329
107 HD1 PHE 12 HD1 PHE 12 4.054 -6.428 0.372
108 HD2 PHE 12 HD2 PHE 12 7.267 -9.056 -0.573
109 HE1 PHE 12 HE1 PHE 12 4.935 -4.773 -1.222
110 HE2 PHE 12 HE2 PHE 12 8.152 -7.405 -2.168
111 HZ PHE 12 HZ PHE 12 6.987 -5.260 -2.493
112 H GLY 13 H GLY 13 1.984 -11.284 0.737
113 HA2 GLY 13 2HA GLY 13 0.144 -9.085 1.331
114 HA3 GLY 13 3HA GLY 13 -0.309 -10.742 0.961
115 H LYS 14 H LYS 14 2.200 -10.852 3.113
116 HA LYS 14 HA LYS 14 0.491 -11.703 5.250
117 HB2 LYS 14 2HB LYS 14 2.656 -12.007 6.483
118 HB3 LYS 14 3HB LYS 14 2.556 -12.872 4.956
119 HG2 LYS 14 2HG LYS 14 3.678 -10.275 4.520
120 HG3 LYS 14 3HG LYS 14 4.556 -11.103 5.808
121 HD2 LYS 14 2HD LYS 14 3.967 -12.252 3.080
122 HD3 LYS 14 3HD LYS 14 5.509 -11.553 3.580
123 HE2 LYS 14 2HE LYS 14 5.165 -13.328 5.558
124 HE3 LYS 14 3HE LYS 14 4.278 -14.152 4.276
125 HZ1 LYS 14 1HZ LYS 14 6.631 -14.787 4.364
126 HZ2 LYS 14 2HZ LYS 14 7.077 -13.186 4.047
127 HZ3 LYS 14 3HZ LYS 14 6.223 -14.072 2.886
128 H GLY 15 H GLY 15 2.385 -8.836 4.526
129 HA2 GLY 15 2HA GLY 15 1.347 -7.618 7.012
130 HA3 GLY 15 3HA GLY 15 2.925 -7.231 6.342
131 H GLY 16 H GLY 16 1.977 -7.178 3.584
132 HA2 GLY 16 2HA GLY 16 1.292 -5.562 2.100
133 HA3 GLY 16 3HA GLY 16 -0.157 -5.500 3.092
Start of MODEL 3
1 H1 VAL 1 H VAL 1 0.558 0.363 0.490
2 HA VAL 1 HA VAL 1 2.682 0.347 -1.411
3 HB VAL 1 HB VAL 1 1.551 -1.785 0.392
4 HG11 VAL 1 1HG1 VAL 1 3.629 -1.993 -1.745
5 HG12 VAL 1 2HG1 VAL 1 3.770 -2.968 -0.280
6 HG13 VAL 1 3HG1 VAL 1 2.348 -3.125 -1.311
7 HG21 VAL 1 1HG2 VAL 1 3.709 -1.521 1.542
8 HG22 VAL 1 2HG2 VAL 1 4.152 -0.253 0.398
9 HG23 VAL 1 3HG2 VAL 1 2.794 -0.014 1.498
10 H ALA 2 H ALA 2 0.233 -2.200 -1.084
11 HA ALA 2 HA ALA 2 -0.109 -2.142 -4.011
12 HB1 ALA 2 1HB ALA 2 0.166 -4.393 -4.212
13 HB2 ALA 2 2HB ALA 2 1.225 -4.105 -2.831
14 HB3 ALA 2 3HB ALA 2 -0.407 -4.723 -2.576
15 H ARG 3 H ARG 3 -2.129 -1.739 -4.601
16 HA ARG 3 HA ARG 3 -4.271 -1.360 -2.910
17 HB2 ARG 3 2HB ARG 3 -5.605 -1.127 -4.810
18 HB3 ARG 3 3HB ARG 3 -3.993 -0.747 -5.401
19 HG2 ARG 3 2HG ARG 3 -3.934 -3.290 -6.002
20 HG3 ARG 3 3HG ARG 3 -5.691 -3.135 -5.927
21 HD2 ARG 3 2HD ARG 3 -4.464 -0.966 -7.410
22 HD3 ARG 3 3HD ARG 3 -4.065 -2.542 -8.092
23 HE ARG 3 HE ARG 3 -6.857 -2.232 -7.515
24 HH11 ARG 3 1HH1 ARG 3 -4.348 -1.627 -9.851
25 HH12 ARG 3 2HH1 ARG 3 -5.436 -1.566 -11.198
26 HH21 ARG 3 1HH2 ARG 3 -8.300 -2.154 -9.280
27 HH22 ARG 3 2HH2 ARG 3 -7.684 -1.865 -10.872
28 H GLY 4 H GLY 4 -3.088 -4.325 -4.317
29 HA2 GLY 4 2HA GLY 4 -5.316 -5.770 -3.019
30 HA3 GLY 4 3HA GLY 4 -4.533 -6.323 -4.492
31 H TRP 5 H TRP 5 -4.542 -6.440 -1.102
32 HA TRP 5 HA TRP 5 -2.004 -7.939 -1.133
33 HB2 TRP 5 2HB TRP 5 -3.037 -5.902 0.781
34 HB3 TRP 5 3HB TRP 5 -2.111 -7.249 1.438
35 HD1 TRP 5 HD1 TRP 5 -1.378 -3.935 0.870
36 HE1 TRP 5 HE1 TRP 5 0.989 -3.502 -0.044
37 HE3 TRP 5 HE3 TRP 5 -0.294 -8.631 -0.836
38 HZ2 TRP 5 HZ2 TRP 5 3.043 -4.958 -1.320
39 HZ3 TRP 5 HZ3 TRP 5 1.893 -9.027 -1.891
40 HH2 TRP 5 HH2 TRP 5 3.526 -7.227 -2.127
41 H LYS 6 H LYS 6 -4.436 -7.549 1.410
42 HA LYS 6 HA LYS 6 -4.527 -9.907 2.570
43 HB2 LYS 6 2HB LYS 6 -7.175 -9.703 2.377
44 HB3 LYS 6 3HB LYS 6 -6.223 -8.603 3.366
45 HG2 LYS 6 2HG LYS 6 -6.575 -7.788 0.564
46 HG3 LYS 6 3HG LYS 6 -8.045 -7.818 1.541
47 HD2 LYS 6 2HD LYS 6 -7.315 -6.151 2.934
48 HD3 LYS 6 3HD LYS 6 -5.612 -6.544 2.688
49 HE2 LYS 6 2HE LYS 6 -5.736 -5.607 0.424
50 HE3 LYS 6 3HE LYS 6 -7.430 -5.201 0.689
51 HZ1 LYS 6 1HZ LYS 6 -5.051 -3.849 1.597
52 HZ2 LYS 6 2HZ LYS 6 -6.225 -4.046 2.799
53 HZ3 LYS 6 3HZ LYS 6 -6.614 -3.247 1.360
54 H ARG 7 H ARG 7 -6.370 -9.372 -0.439
55 HA ARG 7 HA ARG 7 -6.842 -12.191 -0.770
56 HB2 ARG 7 2HB ARG 7 -7.518 -9.722 -2.324
57 HB3 ARG 7 3HB ARG 7 -7.660 -11.295 -3.097
58 HG2 ARG 7 2HG ARG 7 -9.764 -11.131 -2.293
59 HG3 ARG 7 3HG ARG 7 -9.002 -11.825 -0.860
60 HD2 ARG 7 2HD ARG 7 -9.425 -9.999 0.343
61 HD3 ARG 7 3HD ARG 7 -8.742 -8.949 -0.898
62 HE ARG 7 HE ARG 7 -11.189 -9.636 -1.877
63 HH11 ARG 7 1HH1 ARG 7 -10.051 -8.208 1.087
64 HH12 ARG 7 2HH1 ARG 7 -11.493 -7.282 1.347
65 HH21 ARG 7 1HH2 ARG 7 -13.092 -8.423 -1.546
66 HH22 ARG 7 2HH2 ARG 7 -13.222 -7.406 -0.151
67 H LYS 8 H LYS 8 -5.504 -9.935 -3.168
68 HA LYS 8 HA LYS 8 -3.960 -11.994 -4.403
69 HB2 LYS 8 2HB LYS 8 -4.799 -9.360 -5.047
70 HB3 LYS 8 3HB LYS 8 -3.044 -9.390 -5.164
71 HG2 LYS 8 2HG LYS 8 -3.226 -10.318 -7.161
72 HG3 LYS 8 3HG LYS 8 -3.968 -11.734 -6.413
73 HD2 LYS 8 2HD LYS 8 -5.507 -9.265 -7.199
74 HD3 LYS 8 3HD LYS 8 -5.311 -10.669 -8.251
75 HE2 LYS 8 2HE LYS 8 -6.615 -12.021 -6.906
76 HE3 LYS 8 3HE LYS 8 -6.337 -11.036 -5.470
77 HZ1 LYS 8 1HZ LYS 8 -7.638 -9.267 -6.830
78 HZ2 LYS 8 2HZ LYS 8 -8.479 -10.482 -6.007
79 HZ3 LYS 8 3HZ LYS 8 -8.230 -10.608 -7.676
80 H CYS 9 H CYS 9 -2.163 -12.799 -3.556
81 HA CYS 9 HA CYS 9 -0.369 -10.988 -2.080
82 HB2 CYS 9 2HB CYS 9 -0.469 -13.994 -1.814
83 HB3 CYS 9 3HB CYS 9 0.360 -12.850 -0.766
84 HG CYS 9 HG CYS 9 -1.542 -12.865 0.948
85 HA PRO 10 HA PRO 10 1.830 -12.263 -5.965
86 HB2 PRO 10 2HB PRO 10 2.787 -9.782 -6.515
87 HB3 PRO 10 3HB PRO 10 1.194 -10.336 -7.044
88 HG2 PRO 10 2HG PRO 10 1.921 -8.626 -4.697
89 HG3 PRO 10 3HG PRO 10 0.585 -8.437 -5.848
90 HD2 PRO 10 2HD PRO 10 0.244 -9.504 -3.383
91 HD3 PRO 10 3HD PRO 10 -0.720 -10.011 -4.784
92 H LEU 11 H LEU 11 2.937 -9.881 -3.551
93 HA LEU 11 HA LEU 11 5.555 -11.235 -3.548
94 HB2 LEU 11 2HB LEU 11 5.745 -8.663 -2.367
95 HB3 LEU 11 3HB LEU 11 6.519 -9.264 -3.832
96 HG LEU 11 HG LEU 11 3.734 -8.132 -3.852
97 HD11 LEU 11 1HD1 LEU 11 4.631 -6.166 -3.278
98 HD12 LEU 11 2HD1 LEU 11 5.321 -6.174 -4.901
99 HD13 LEU 11 3HD1 LEU 11 6.281 -6.734 -3.533
100 HD21 LEU 11 1HD2 LEU 11 4.939 -9.546 -5.741
101 HD22 LEU 11 2HD2 LEU 11 5.656 -7.977 -6.111
102 HD23 LEU 11 3HD2 LEU 11 3.902 -8.171 -6.124
103 H PHE 12 H PHE 12 4.116 -8.880 -1.321
104 HA PHE 12 HA PHE 12 4.358 -10.884 0.825
105 HB2 PHE 12 2HB PHE 12 4.550 -8.450 2.107
106 HB3 PHE 12 3HB PHE 12 5.900 -9.508 1.710
107 HD1 PHE 12 HD1 PHE 12 4.023 -6.522 0.682
108 HD2 PHE 12 HD2 PHE 12 7.453 -8.946 -0.007
109 HE1 PHE 12 HE1 PHE 12 4.981 -4.756 -0.739
110 HE2 PHE 12 HE2 PHE 12 8.417 -7.184 -1.428
111 HZ PHE 12 HZ PHE 12 7.182 -5.085 -1.795
112 H GLY 13 H GLY 13 2.172 -11.468 0.653
113 HA2 GLY 13 2HA GLY 13 0.179 -9.367 1.103
114 HA3 GLY 13 3HA GLY 13 -0.156 -11.024 0.621
115 H LYS 14 H LYS 14 2.091 -11.177 3.024
116 HA LYS 14 HA LYS 14 0.254 -12.239 4.910
117 HB2 LYS 14 2HB LYS 14 2.248 -12.351 6.411
118 HB3 LYS 14 3HB LYS 14 2.490 -13.110 4.843
119 HG2 LYS 14 2HG LYS 14 3.346 -10.524 4.433
120 HG3 LYS 14 3HG LYS 14 3.888 -10.884 6.074
121 HD2 LYS 14 2HD LYS 14 4.889 -12.998 5.197
122 HD3 LYS 14 3HD LYS 14 4.481 -12.454 3.568
123 HE2 LYS 14 2HE LYS 14 6.206 -11.029 3.499
124 HE3 LYS 14 3HE LYS 14 5.904 -10.447 5.135
125 HZ1 LYS 14 1HZ LYS 14 7.022 -13.127 4.866
126 HZ2 LYS 14 2HZ LYS 14 7.329 -11.938 6.029
127 HZ3 LYS 14 3HZ LYS 14 8.049 -11.832 4.502
128 H GLY 15 H GLY 15 1.978 -9.165 4.649
129 HA2 GLY 15 2HA GLY 15 0.354 -8.173 6.911
130 HA3 GLY 15 3HA GLY 15 1.998 -7.633 6.601
131 H GLY 16 H GLY 16 1.580 -7.527 3.692
132 HA2 GLY 16 2HA GLY 16 1.074 -5.890 2.160
133 HA3 GLY 16 3HA GLY 16 -0.532 -5.952 2.872
Start of MODEL 4
1 H1 VAL 1 H VAL 1 1.890 0.359 -0.250
2 HA VAL 1 HA VAL 1 3.161 0.255 -2.146
3 HB VAL 1 HB VAL 1 4.748 -1.153 -0.981
4 HG11 VAL 1 1HG1 VAL 1 4.541 -3.568 -0.899
5 HG12 VAL 1 2HG1 VAL 1 3.141 -2.814 -0.132
6 HG13 VAL 1 3HG1 VAL 1 3.003 -3.488 -1.757
7 HG21 VAL 1 1HG2 VAL 1 4.459 -1.019 -3.670
8 HG22 VAL 1 2HG2 VAL 1 5.823 -1.785 -2.856
9 HG23 VAL 1 3HG2 VAL 1 4.472 -2.765 -3.424
10 H ALA 2 H ALA 2 1.051 -2.498 -1.507
11 HA ALA 2 HA ALA 2 0.200 -2.404 -4.328
12 HB1 ALA 2 1HB ALA 2 1.495 -4.504 -3.299
13 HB2 ALA 2 2HB ALA 2 -0.153 -4.939 -2.848
14 HB3 ALA 2 3HB ALA 2 0.252 -4.657 -4.541
15 H ARG 3 H ARG 3 -1.831 -1.759 -4.551
16 HA ARG 3 HA ARG 3 -3.588 -1.207 -2.484
17 HB2 ARG 3 2HB ARG 3 -5.181 -0.710 -4.114
18 HB3 ARG 3 3HB ARG 3 -3.656 -0.481 -4.960
19 HG2 ARG 3 2HG ARG 3 -4.030 -2.994 -5.635
20 HG3 ARG 3 3HG ARG 3 -5.715 -2.597 -5.295
21 HD2 ARG 3 2HD ARG 3 -4.098 -0.767 -7.009
22 HD3 ARG 3 3HD ARG 3 -4.717 -2.267 -7.697
23 HE ARG 3 HE ARG 3 -6.848 -1.034 -6.431
24 HH11 ARG 3 1HH1 ARG 3 -4.670 -0.350 -9.059
25 HH12 ARG 3 2HH1 ARG 3 -5.816 0.613 -9.930
26 HH21 ARG 3 1HH2 ARG 3 -8.366 0.232 -7.569
27 HH22 ARG 3 2HH2 ARG 3 -7.918 0.944 -9.081
28 H GLY 4 H GLY 4 -3.026 -4.197 -4.190
29 HA2 GLY 4 2HA GLY 4 -5.249 -5.444 -2.701
30 HA3 GLY 4 3HA GLY 4 -4.583 -6.064 -4.205
31 H TRP 5 H TRP 5 -4.383 -6.084 -0.792
32 HA TRP 5 HA TRP 5 -2.071 -7.904 -0.948
33 HB2 TRP 5 2HB TRP 5 -2.674 -5.691 0.965
34 HB3 TRP 5 3HB TRP 5 -1.823 -7.112 1.566
35 HD1 TRP 5 HD1 TRP 5 -0.842 -3.898 0.768
36 HE1 TRP 5 HE1 TRP 5 1.448 -3.743 -0.396
37 HE3 TRP 5 HE3 TRP 5 -0.393 -8.746 -0.791
38 HZ2 TRP 5 HZ2 TRP 5 3.211 -5.449 -1.791
39 HZ3 TRP 5 HZ3 TRP 5 1.626 -9.403 -2.034
40 HH2 TRP 5 HH2 TRP 5 3.389 -7.787 -2.524
41 H LYS 6 H LYS 6 -4.161 -7.095 1.786
42 HA LYS 6 HA LYS 6 -4.455 -9.409 3.025
43 HB2 LYS 6 2HB LYS 6 -7.034 -8.784 3.171
44 HB3 LYS 6 3HB LYS 6 -5.801 -7.831 3.986
45 HG2 LYS 6 2HG LYS 6 -5.812 -6.213 2.191
46 HG3 LYS 6 3HG LYS 6 -6.965 -7.194 1.282
47 HD2 LYS 6 2HD LYS 6 -7.607 -6.236 4.049
48 HD3 LYS 6 3HD LYS 6 -7.843 -5.185 2.651
49 HE2 LYS 6 2HE LYS 6 -8.960 -7.654 1.945
50 HE3 LYS 6 3HE LYS 6 -9.470 -7.361 3.607
51 HZ1 LYS 6 1HZ LYS 6 -10.058 -5.809 1.184
52 HZ2 LYS 6 2HZ LYS 6 -10.015 -5.012 2.675
53 HZ3 LYS 6 3HZ LYS 6 -11.096 -6.289 2.430
54 H ARG 7 H ARG 7 -6.417 -8.603 0.162
55 HA ARG 7 HA ARG 7 -7.530 -11.241 -0.001
56 HB2 ARG 7 2HB ARG 7 -8.836 -9.376 -0.801
57 HB3 ARG 7 3HB ARG 7 -7.564 -8.910 -1.922
58 HG2 ARG 7 2HG ARG 7 -9.444 -10.038 -3.028
59 HG3 ARG 7 3HG ARG 7 -7.921 -10.908 -3.224
60 HD2 ARG 7 2HD ARG 7 -8.725 -12.716 -2.199
61 HD3 ARG 7 3HD ARG 7 -9.343 -11.761 -0.853
62 HE ARG 7 HE ARG 7 -10.827 -12.745 -3.098
63 HH11 ARG 7 1HH1 ARG 7 -10.657 -10.243 -0.683
64 HH12 ARG 7 2HH1 ARG 7 -12.356 -9.902 -0.729
65 HH21 ARG 7 1HH2 ARG 7 -13.064 -12.307 -3.167
66 HH22 ARG 7 2HH2 ARG 7 -13.724 -11.078 -2.141
67 H LYS 8 H LYS 8 -5.864 -9.538 -2.627
68 HA LYS 8 HA LYS 8 -4.761 -12.038 -3.573
69 HB2 LYS 8 2HB LYS 8 -3.787 -10.529 -5.377
70 HB3 LYS 8 3HB LYS 8 -5.541 -10.615 -5.290
71 HG2 LYS 8 2HG LYS 8 -5.737 -8.471 -4.450
72 HG3 LYS 8 3HG LYS 8 -4.074 -8.442 -3.858
73 HD2 LYS 8 2HD LYS 8 -4.642 -8.650 -6.792
74 HD3 LYS 8 3HD LYS 8 -4.689 -7.083 -5.980
75 HE2 LYS 8 2HE LYS 8 -2.419 -7.212 -5.377
76 HE3 LYS 8 3HE LYS 8 -2.339 -8.938 -5.729
77 HZ1 LYS 8 1HZ LYS 8 -2.926 -6.978 -7.857
78 HZ2 LYS 8 2HZ LYS 8 -2.325 -8.552 -8.004
79 HZ3 LYS 8 3HZ LYS 8 -1.331 -7.320 -7.406
80 H CYS 9 H CYS 9 -2.869 -12.824 -2.951
81 HA CYS 9 HA CYS 9 -0.831 -10.949 -1.945
82 HB2 CYS 9 2HB CYS 9 0.029 -12.954 -0.651
83 HB3 CYS 9 3HB CYS 9 -1.516 -12.303 -0.117
84 HG CYS 9 HG CYS 9 -1.159 -15.264 -0.213
85 HA PRO 10 HA PRO 10 0.869 -12.896 -5.781
86 HB2 PRO 10 2HB PRO 10 2.026 -10.615 -6.692
87 HB3 PRO 10 3HB PRO 10 0.339 -11.032 -7.015
88 HG2 PRO 10 2HG PRO 10 1.472 -9.182 -4.951
89 HG3 PRO 10 3HG PRO 10 0.057 -8.960 -5.998
90 HD2 PRO 10 2HD PRO 10 -0.152 -9.715 -3.406
91 HD3 PRO 10 3HD PRO 10 -1.298 -10.250 -4.652
92 H LEU 11 H LEU 11 2.432 -10.457 -3.704
93 HA LEU 11 HA LEU 11 4.901 -12.060 -3.826
94 HB2 LEU 11 2HB LEU 11 5.436 -9.454 -2.846
95 HB3 LEU 11 3HB LEU 11 6.007 -10.213 -4.331
96 HG LEU 11 HG LEU 11 3.351 -8.813 -4.173
97 HD11 LEU 11 1HD1 LEU 11 5.028 -7.108 -5.510
98 HD12 LEU 11 2HD1 LEU 11 6.028 -7.660 -4.167
99 HD13 LEU 11 3HD1 LEU 11 4.465 -6.906 -3.851
100 HD21 LEU 11 1HD2 LEU 11 4.282 -10.454 -6.067
101 HD22 LEU 11 2HD2 LEU 11 5.005 -8.944 -6.622
102 HD23 LEU 11 3HD2 LEU 11 3.256 -9.064 -6.422
103 H PHE 12 H PHE 12 3.913 -9.443 -1.650
104 HA PHE 12 HA PHE 12 4.155 -11.330 0.600
105 HB2 PHE 12 2HB PHE 12 4.713 -8.866 1.696
106 HB3 PHE 12 3HB PHE 12 5.909 -10.074 1.240
107 HD1 PHE 12 HD1 PHE 12 4.233 -6.969 0.215
108 HD2 PHE 12 HD2 PHE 12 7.325 -9.763 -0.652
109 HE1 PHE 12 HE1 PHE 12 5.208 -5.386 -1.397
110 HE2 PHE 12 HE2 PHE 12 8.305 -8.184 -2.265
111 HZ PHE 12 HZ PHE 12 7.247 -5.992 -2.638
112 H GLY 13 H GLY 13 1.926 -11.695 0.696
113 HA2 GLY 13 2HA GLY 13 0.202 -9.369 1.167
114 HA3 GLY 13 3HA GLY 13 -0.343 -11.004 0.824
115 H LYS 14 H LYS 14 2.070 -11.341 3.008
116 HA LYS 14 HA LYS 14 0.353 -12.104 5.109
117 HB2 LYS 14 2HB LYS 14 2.439 -12.302 6.445
118 HB3 LYS 14 3HB LYS 14 2.533 -13.115 4.888
119 HG2 LYS 14 2HG LYS 14 4.510 -12.071 4.746
120 HG3 LYS 14 3HG LYS 14 3.532 -10.693 4.237
121 HD2 LYS 14 2HD LYS 14 3.406 -10.394 6.910
122 HD3 LYS 14 3HD LYS 14 4.987 -11.165 6.764
123 HE2 LYS 14 2HE LYS 14 4.270 -8.859 4.999
124 HE3 LYS 14 3HE LYS 14 4.793 -8.571 6.658
125 HZ1 LYS 14 1HZ LYS 14 6.535 -8.614 4.782
126 HZ2 LYS 14 2HZ LYS 14 6.391 -10.296 4.884
127 HZ3 LYS 14 3HZ LYS 14 6.885 -9.406 6.235
128 H GLY 15 H GLY 15 2.324 -9.204 4.589
129 HA2 GLY 15 2HA GLY 15 0.895 -7.954 6.855
130 HA3 GLY 15 3HA GLY 15 2.568 -7.592 6.459
131 H GLY 16 H GLY 16 1.971 -7.625 3.549
132 HA2 GLY 16 2HA GLY 16 1.549 -6.031 1.948
133 HA3 GLY 16 3HA GLY 16 0.006 -5.851 2.769
Start of MODEL 5
1 H1 VAL 1 H VAL 1 1.724 -0.789 0.466
2 HA VAL 1 HA VAL 1 2.267 0.857 -1.758
3 HB VAL 1 HB VAL 1 4.029 -0.745 -2.319
4 HG11 VAL 1 1HG1 VAL 1 5.335 -0.024 -0.644
5 HG12 VAL 1 2HG1 VAL 1 3.883 0.809 -0.084
6 HG13 VAL 1 3HG1 VAL 1 4.318 -0.760 0.595
7 HG21 VAL 1 1HG2 VAL 1 2.959 -2.458 -0.083
8 HG22 VAL 1 2HG2 VAL 1 2.682 -2.781 -1.794
9 HG23 VAL 1 3HG2 VAL 1 4.322 -2.812 -1.145
10 H ALA 2 H ALA 2 0.441 -2.078 -1.394
11 HA ALA 2 HA ALA 2 -0.078 -2.069 -4.295
12 HB1 ALA 2 1HB ALA 2 1.269 -4.046 -3.193
13 HB2 ALA 2 2HB ALA 2 -0.348 -4.599 -2.754
14 HB3 ALA 2 3HB ALA 2 0.067 -4.346 -4.449
15 H ARG 3 H ARG 3 -2.116 -1.617 -4.776
16 HA ARG 3 HA ARG 3 -4.137 -1.093 -2.993
17 HB2 ARG 3 2HB ARG 3 -5.617 -1.005 -4.827
18 HB3 ARG 3 3HB ARG 3 -4.044 -0.576 -5.486
19 HG2 ARG 3 2HG ARG 3 -5.161 -3.362 -5.617
20 HG3 ARG 3 3HG ARG 3 -5.439 -2.149 -6.869
21 HD2 ARG 3 2HD ARG 3 -2.791 -3.269 -5.967
22 HD3 ARG 3 3HD ARG 3 -3.581 -3.525 -7.521
23 HE ARG 3 HE ARG 3 -2.035 -1.239 -6.716
24 HH11 ARG 3 1HH1 ARG 3 -4.513 -2.413 -8.861
25 HH12 ARG 3 2HH1 ARG 3 -4.245 -1.185 -10.054
26 HH21 ARG 3 1HH2 ARG 3 -1.673 0.383 -8.278
27 HH22 ARG 3 2HH2 ARG 3 -2.629 0.404 -9.722
28 H GLY 4 H GLY 4 -3.142 -4.173 -4.299
29 HA2 GLY 4 2HA GLY 4 -5.324 -5.465 -2.780
30 HA3 GLY 4 3HA GLY 4 -4.648 -6.129 -4.260
31 H TRP 5 H TRP 5 -4.443 -6.026 -0.871
32 HA TRP 5 HA TRP 5 -1.959 -7.610 -0.961
33 HB2 TRP 5 2HB TRP 5 -2.825 -5.439 0.890
34 HB3 TRP 5 3HB TRP 5 -1.889 -6.771 1.564
35 HD1 TRP 5 HD1 TRP 5 -1.117 -3.516 0.770
36 HE1 TRP 5 HE1 TRP 5 1.196 -3.194 -0.312
37 HE3 TRP 5 HE3 TRP 5 -0.254 -8.322 -0.743
38 HZ2 TRP 5 HZ2 TRP 5 3.130 -4.769 -1.634
39 HZ3 TRP 5 HZ3 TRP 5 1.852 -8.830 -1.911
40 HH2 TRP 5 HH2 TRP 5 3.507 -7.089 -2.346
41 H LYS 6 H LYS 6 -4.240 -6.999 1.679
42 HA LYS 6 HA LYS 6 -4.314 -9.297 2.973
43 HB2 LYS 6 2HB LYS 6 -6.845 -9.028 3.204
44 HB3 LYS 6 3HB LYS 6 -5.849 -7.659 3.678
45 HG2 LYS 6 2HG LYS 6 -6.270 -6.707 1.383
46 HG3 LYS 6 3HG LYS 6 -7.474 -7.980 1.172
47 HD2 LYS 6 2HD LYS 6 -7.779 -6.575 3.697
48 HD3 LYS 6 3HD LYS 6 -7.893 -5.491 2.309
49 HE2 LYS 6 2HE LYS 6 -9.918 -6.257 1.796
50 HE3 LYS 6 3HE LYS 6 -9.354 -7.927 1.825
51 HZ1 LYS 6 1HZ LYS 6 -10.383 -8.239 3.744
52 HZ2 LYS 6 2HZ LYS 6 -11.026 -6.677 3.648
53 HZ3 LYS 6 3HZ LYS 6 -9.566 -6.942 4.461
54 H ARG 7 H ARG 7 -6.205 -8.822 -0.009
55 HA ARG 7 HA ARG 7 -6.853 -11.636 -0.141
56 HB2 ARG 7 2HB ARG 7 -7.516 -9.231 -1.808
57 HB3 ARG 7 3HB ARG 7 -7.812 -10.849 -2.432
58 HG2 ARG 7 2HG ARG 7 -9.353 -11.333 -0.700
59 HG3 ARG 7 3HG ARG 7 -8.891 -9.889 0.203
60 HD2 ARG 7 2HD ARG 7 -10.026 -8.472 -1.221
61 HD3 ARG 7 3HD ARG 7 -9.960 -9.608 -2.569
62 HE ARG 7 HE ARG 7 -11.531 -10.700 -0.508
63 HH11 ARG 7 1HH1 ARG 7 -11.597 -8.158 -2.885
64 HH12 ARG 7 2HH1 ARG 7 -13.324 -8.155 -3.025
65 HH21 ARG 7 1HH2 ARG 7 -13.805 -10.707 -0.683
66 HH22 ARG 7 2HH2 ARG 7 -14.579 -9.605 -1.772
67 H LYS 8 H LYS 8 -5.592 -9.548 -2.724
68 HA LYS 8 HA LYS 8 -4.178 -11.730 -3.921
69 HB2 LYS 8 2HB LYS 8 -4.087 -8.770 -4.532
70 HB3 LYS 8 3HB LYS 8 -3.396 -10.036 -5.538
71 HG2 LYS 8 2HG LYS 8 -6.305 -10.052 -4.839
72 HG3 LYS 8 3HG LYS 8 -5.691 -9.064 -6.166
73 HD2 LYS 8 2HD LYS 8 -5.953 -10.893 -7.428
74 HD3 LYS 8 3HD LYS 8 -4.505 -11.500 -6.623
75 HE2 LYS 8 2HE LYS 8 -5.949 -13.239 -6.251
76 HE3 LYS 8 3HE LYS 8 -6.233 -12.274 -4.803
77 HZ1 LYS 8 1HZ LYS 8 -7.996 -12.828 -7.030
78 HZ2 LYS 8 2HZ LYS 8 -8.011 -11.222 -6.501
79 HZ3 LYS 8 3HZ LYS 8 -8.366 -12.473 -5.418
80 H CYS 9 H CYS 9 -2.320 -12.491 -3.173
81 HA CYS 9 HA CYS 9 -0.408 -10.600 -1.970
82 HB2 CYS 9 2HB CYS 9 0.496 -12.644 -0.777
83 HB3 CYS 9 3HB CYS 9 -1.102 -12.110 -0.269
84 HG CYS 9 HG CYS 9 -1.264 -14.374 -2.696
85 HA PRO 10 HA PRO 10 1.493 -12.260 -5.864
86 HB2 PRO 10 2HB PRO 10 2.465 -9.862 -6.686
87 HB3 PRO 10 3HB PRO 10 0.827 -10.412 -7.058
88 HG2 PRO 10 2HG PRO 10 1.755 -8.534 -4.919
89 HG3 PRO 10 3HG PRO 10 0.347 -8.403 -5.990
90 HD2 PRO 10 2HD PRO 10 0.153 -9.250 -3.426
91 HD3 PRO 10 3HD PRO 10 -0.917 -9.845 -4.711
92 H LEU 11 H LEU 11 2.758 -9.841 -3.586
93 HA LEU 11 HA LEU 11 5.369 -11.199 -3.726
94 HB2 LEU 11 2HB LEU 11 5.663 -8.582 -2.670
95 HB3 LEU 11 3HB LEU 11 6.336 -9.256 -4.154
96 HG LEU 11 HG LEU 11 3.572 -8.077 -4.041
97 HD11 LEU 11 1HD1 LEU 11 5.101 -6.201 -5.291
98 HD12 LEU 11 2HD1 LEU 11 6.164 -6.720 -3.983
99 HD13 LEU 11 3HD1 LEU 11 4.550 -6.109 -3.619
100 HD21 LEU 11 1HD2 LEU 11 3.572 -8.241 -6.310
101 HD22 LEU 11 2HD2 LEU 11 4.628 -9.605 -5.938
102 HD23 LEU 11 3HD2 LEU 11 5.322 -8.062 -6.437
103 H PHE 12 H PHE 12 4.095 -8.734 -1.518
104 HA PHE 12 HA PHE 12 4.450 -10.648 0.694
105 HB2 PHE 12 2HB PHE 12 4.741 -8.143 1.836
106 HB3 PHE 12 3HB PHE 12 6.046 -9.259 1.448
107 HD1 PHE 12 HD1 PHE 12 4.208 -6.281 0.337
108 HD2 PHE 12 HD2 PHE 12 7.521 -8.855 -0.384
109 HE1 PHE 12 HE1 PHE 12 5.144 -4.632 -1.231
110 HE2 PHE 12 HE2 PHE 12 8.463 -7.209 -1.952
111 HZ PHE 12 HZ PHE 12 7.275 -5.094 -2.377
112 H GLY 13 H GLY 13 2.241 -11.202 0.646
113 HA2 GLY 13 2HA GLY 13 0.302 -9.063 1.126
114 HA3 GLY 13 3HA GLY 13 -0.073 -10.741 0.762
115 H LYS 14 H LYS 14 2.312 -10.817 3.017
116 HA LYS 14 HA LYS 14 0.529 -11.654 5.088
117 HB2 LYS 14 2HB LYS 14 2.643 -11.889 6.425
118 HB3 LYS 14 3HB LYS 14 2.625 -12.785 4.911
119 HG2 LYS 14 2HG LYS 14 3.715 -10.180 4.462
120 HG3 LYS 14 3HG LYS 14 4.548 -10.951 5.814
121 HD2 LYS 14 2HD LYS 14 4.118 -12.185 3.093
122 HD3 LYS 14 3HD LYS 14 5.619 -11.444 3.653
123 HE2 LYS 14 2HE LYS 14 5.104 -13.206 5.660
124 HE3 LYS 14 3HE LYS 14 4.457 -14.071 4.267
125 HZ1 LYS 14 1HZ LYS 14 6.833 -14.527 4.739
126 HZ2 LYS 14 2HZ LYS 14 7.187 -12.915 4.370
127 HZ3 LYS 14 3HZ LYS 14 6.554 -13.935 3.178
128 H GLY 15 H GLY 15 2.407 -8.759 4.426
129 HA2 GLY 15 2HA GLY 15 1.217 -7.533 6.838
130 HA3 GLY 15 3HA GLY 15 2.822 -7.126 6.250
131 H GLY 16 H GLY 16 1.988 -7.142 3.439
132 HA2 GLY 16 2HA GLY 16 1.356 -5.557 1.898
133 HA3 GLY 16 3HA GLY 16 -0.133 -5.488 2.829
Start of MODEL 6
1 H1 VAL 1 H VAL 1 1.629 0.637 0.068
2 HA VAL 1 HA VAL 1 3.838 0.350 -1.827
3 HB VAL 1 HB VAL 1 2.575 -1.562 0.129
4 HG11 VAL 1 1HG1 VAL 1 4.525 -3.072 -0.707
5 HG12 VAL 1 2HG1 VAL 1 3.002 -3.034 -1.597
6 HG13 VAL 1 3HG1 VAL 1 4.389 -2.113 -2.180
7 HG21 VAL 1 1HG2 VAL 1 4.853 -1.611 1.066
8 HG22 VAL 1 2HG2 VAL 1 5.360 -0.431 -0.142
9 HG23 VAL 1 3HG2 VAL 1 4.162 0.011 1.074
10 H ALA 2 H ALA 2 1.078 -1.795 -1.213
11 HA ALA 2 HA ALA 2 0.482 -1.731 -4.100
12 HB1 ALA 2 1HB ALA 2 -0.063 -4.214 -2.570
13 HB2 ALA 2 2HB ALA 2 0.400 -4.001 -4.258
14 HB3 ALA 2 3HB ALA 2 1.612 -3.854 -2.986
15 H ARG 3 H ARG 3 -1.501 -1.039 -4.521
16 HA ARG 3 HA ARG 3 -3.399 -0.315 -2.660
17 HB2 ARG 3 2HB ARG 3 -4.852 0.086 -4.442
18 HB3 ARG 3 3HB ARG 3 -3.263 0.211 -5.183
19 HG2 ARG 3 2HG ARG 3 -3.607 -2.295 -5.751
20 HG3 ARG 3 3HG ARG 3 -5.311 -1.943 -5.457
21 HD2 ARG 3 2HD ARG 3 -5.326 -0.263 -7.161
22 HD3 ARG 3 3HD ARG 3 -3.576 -0.370 -7.351
23 HE ARG 3 HE ARG 3 -3.860 -2.226 -8.670
24 HH11 ARG 3 1HH1 ARG 3 -6.841 -1.504 -7.023
25 HH12 ARG 3 2HH1 ARG 3 -7.772 -2.648 -7.932
26 HH21 ARG 3 1HH2 ARG 3 -5.075 -3.736 -9.873
27 HH22 ARG 3 2HH2 ARG 3 -6.767 -3.918 -9.552
28 H GLY 4 H GLY 4 -2.804 -3.446 -4.079
29 HA2 GLY 4 2HA GLY 4 -5.093 -4.519 -2.547
30 HA3 GLY 4 3HA GLY 4 -4.540 -5.205 -4.067
31 H TRP 5 H TRP 5 -4.253 -5.267 -0.688
32 HA TRP 5 HA TRP 5 -1.980 -7.131 -0.901
33 HB2 TRP 5 2HB TRP 5 -2.520 -4.934 1.038
34 HB3 TRP 5 3HB TRP 5 -1.749 -6.395 1.649
35 HD1 TRP 5 HD1 TRP 5 -0.586 -3.239 0.925
36 HE1 TRP 5 HE1 TRP 5 1.726 -3.180 -0.205
37 HE3 TRP 5 HE3 TRP 5 -0.372 -8.069 -0.736
38 HZ2 TRP 5 HZ2 TRP 5 3.416 -4.948 -1.615
39 HZ3 TRP 5 HZ3 TRP 5 1.627 -8.805 -1.967
40 HH2 TRP 5 HH2 TRP 5 3.480 -7.275 -2.397
41 H LYS 6 H LYS 6 -4.088 -6.342 1.832
42 HA LYS 6 HA LYS 6 -4.415 -8.658 3.050
43 HB2 LYS 6 2HB LYS 6 -6.986 -8.048 3.165
44 HB3 LYS 6 3HB LYS 6 -5.775 -7.061 3.973
45 HG2 LYS 6 2HG LYS 6 -5.780 -5.507 2.089
46 HG3 LYS 6 3HG LYS 6 -6.993 -6.498 1.275
47 HD2 LYS 6 2HD LYS 6 -7.554 -5.538 4.039
48 HD3 LYS 6 3HD LYS 6 -7.678 -4.389 2.705
49 HE2 LYS 6 2HE LYS 6 -8.971 -6.978 2.218
50 HE3 LYS 6 3HE LYS 6 -9.677 -6.043 3.536
51 HZ1 LYS 6 1HZ LYS 6 -9.171 -4.369 1.314
52 HZ2 LYS 6 2HZ LYS 6 -10.642 -4.706 2.078
53 HZ3 LYS 6 3HZ LYS 6 -10.094 -5.699 0.823
54 H ARG 7 H ARG 7 -6.318 -7.846 0.149
55 HA ARG 7 HA ARG 7 -7.324 -10.546 -0.054
56 HB2 ARG 7 2HB ARG 7 -8.748 -8.655 -0.682
57 HB3 ARG 7 3HB ARG 7 -7.596 -8.189 -1.927
58 HG2 ARG 7 2HG ARG 7 -9.458 -9.334 -2.929
59 HG3 ARG 7 3HG ARG 7 -8.007 -10.327 -3.074
60 HD2 ARG 7 2HD ARG 7 -9.151 -11.085 -0.652
61 HD3 ARG 7 3HD ARG 7 -10.515 -10.899 -1.754
62 HE ARG 7 HE ARG 7 -8.730 -12.355 -3.187
63 HH11 ARG 7 1HH1 ARG 7 -10.155 -12.709 -0.030
64 HH12 ARG 7 2HH1 ARG 7 -10.092 -14.440 -0.053
65 HH21 ARG 7 1HH2 ARG 7 -8.642 -14.634 -3.229
66 HH22 ARG 7 2HH2 ARG 7 -9.231 -15.534 -1.872
67 H LYS 8 H LYS 8 -5.811 -8.551 -2.579
68 HA LYS 8 HA LYS 8 -4.722 -10.875 -3.863
69 HB2 LYS 8 2HB LYS 8 -4.504 -7.917 -4.405
70 HB3 LYS 8 3HB LYS 8 -3.646 -9.115 -5.366
71 HG2 LYS 8 2HG LYS 8 -6.544 -9.548 -5.018
72 HG3 LYS 8 3HG LYS 8 -6.062 -8.167 -6.007
73 HD2 LYS 8 2HD LYS 8 -6.183 -9.856 -7.578
74 HD3 LYS 8 3HD LYS 8 -4.471 -9.889 -7.146
75 HE2 LYS 8 2HE LYS 8 -4.818 -11.761 -5.685
76 HE3 LYS 8 3HE LYS 8 -6.566 -11.658 -5.893
77 HZ1 LYS 8 1HZ LYS 8 -4.634 -12.278 -8.061
78 HZ2 LYS 8 2HZ LYS 8 -6.320 -12.264 -8.196
79 HZ3 LYS 8 3HZ LYS 8 -5.558 -13.427 -7.232
80 H CYS 9 H CYS 9 -2.966 -11.872 -3.142
81 HA CYS 9 HA CYS 9 -0.805 -10.244 -1.976
82 HB2 CYS 9 2HB CYS 9 -0.141 -12.388 -0.806
83 HB3 CYS 9 3HB CYS 9 -1.653 -11.668 -0.268
84 HG CYS 9 HG CYS 9 -3.208 -13.654 -0.838
85 HA PRO 10 HA PRO 10 0.786 -12.108 -5.918
86 HB2 PRO 10 2HB PRO 10 2.027 -9.845 -6.759
87 HB3 PRO 10 3HB PRO 10 0.326 -10.188 -7.094
88 HG2 PRO 10 2HG PRO 10 1.526 -8.446 -4.975
89 HG3 PRO 10 3HG PRO 10 0.121 -8.139 -6.013
90 HD2 PRO 10 2HD PRO 10 -0.118 -8.966 -3.445
91 HD3 PRO 10 3HD PRO 10 -1.282 -9.419 -4.707
92 H LEU 11 H LEU 11 2.381 -9.888 -3.646
93 HA LEU 11 HA LEU 11 4.811 -11.541 -3.866
94 HB2 LEU 11 2HB LEU 11 5.423 -8.991 -2.775
95 HB3 LEU 11 3HB LEU 11 5.996 -9.718 -4.275
96 HG LEU 11 HG LEU 11 3.389 -8.227 -4.109
97 HD11 LEU 11 1HD1 LEU 11 4.600 -6.393 -3.684
98 HD12 LEU 11 2HD1 LEU 11 5.108 -6.529 -5.367
99 HD13 LEU 11 3HD1 LEU 11 6.124 -7.186 -4.084
100 HD21 LEU 11 1HD2 LEU 11 3.330 -8.374 -6.375
101 HD22 LEU 11 2HD2 LEU 11 4.239 -9.847 -6.037
102 HD23 LEU 11 3HD2 LEU 11 5.086 -8.382 -6.535
103 H PHE 12 H PHE 12 3.880 -8.985 -1.590
104 HA PHE 12 HA PHE 12 4.056 -10.968 0.582
105 HB2 PHE 12 2HB PHE 12 4.655 -8.525 1.749
106 HB3 PHE 12 3HB PHE 12 5.810 -9.787 1.334
107 HD1 PHE 12 HD1 PHE 12 4.353 -6.586 0.300
108 HD2 PHE 12 HD2 PHE 12 7.277 -9.561 -0.545
109 HE1 PHE 12 HE1 PHE 12 5.460 -5.047 -1.269
110 HE2 PHE 12 HE2 PHE 12 8.390 -8.027 -2.114
111 HZ PHE 12 HZ PHE 12 7.482 -5.767 -2.478
112 H GLY 13 H GLY 13 1.814 -11.277 0.635
113 HA2 GLY 13 2HA GLY 13 0.051 -9.004 0.977
114 HA3 GLY 13 3HA GLY 13 -0.417 -10.698 0.961
115 H LYS 14 H LYS 14 1.937 -10.940 3.025
116 HA LYS 14 HA LYS 14 0.226 -10.885 5.320
117 HB2 LYS 14 2HB LYS 14 3.218 -11.238 5.364
118 HB3 LYS 14 3HB LYS 14 2.033 -11.860 6.506
119 HG2 LYS 14 2HG LYS 14 2.065 -13.769 5.387
120 HG3 LYS 14 3HG LYS 14 1.301 -12.929 4.034
121 HD2 LYS 14 2HD LYS 14 3.252 -13.994 3.184
122 HD3 LYS 14 3HD LYS 14 3.606 -12.267 3.278
123 HE2 LYS 14 2HE LYS 14 5.517 -13.265 4.157
124 HE3 LYS 14 3HE LYS 14 4.595 -12.812 5.589
125 HZ1 LYS 14 1HZ LYS 14 4.374 -15.509 4.402
126 HZ2 LYS 14 2HZ LYS 14 3.963 -15.008 5.964
127 HZ3 LYS 14 3HZ LYS 14 5.590 -15.134 5.518
128 H GLY 15 H GLY 15 3.215 -9.134 4.458
129 HA2 GLY 15 2HA GLY 15 2.615 -7.187 6.574
130 HA3 GLY 15 3HA GLY 15 4.164 -7.382 5.767
131 H GLY 16 H GLY 16 1.073 -7.197 4.102
132 HA2 GLY 16 2HA GLY 16 1.862 -5.371 2.191
133 HA3 GLY 16 3HA GLY 16 0.194 -5.612 2.689
Start of MODEL 7
1 H1 VAL 1 H VAL 1 0.309 -0.385 0.035
2 HA VAL 1 HA VAL 1 2.245 0.816 -1.235
3 HB VAL 1 HB VAL 1 4.072 -0.714 -1.784
4 HG11 VAL 1 1HG1 VAL 1 5.273 -0.112 0.021
5 HG12 VAL 1 2HG1 VAL 1 3.791 0.718 0.500
6 HG13 VAL 1 3HG1 VAL 1 4.157 -0.881 1.149
7 HG21 VAL 1 1HG2 VAL 1 2.714 -2.797 -1.439
8 HG22 VAL 1 2HG2 VAL 1 4.340 -2.848 -0.758
9 HG23 VAL 1 3HG2 VAL 1 2.951 -2.583 0.296
10 H ALA 2 H ALA 2 0.413 -2.121 -1.136
11 HA ALA 2 HA ALA 2 0.108 -1.997 -4.065
12 HB1 ALA 2 1HB ALA 2 -0.281 -4.571 -2.614
13 HB2 ALA 2 2HB ALA 2 0.204 -4.280 -4.285
14 HB3 ALA 2 3HB ALA 2 1.357 -4.025 -2.975
15 H ARG 3 H ARG 3 -1.886 -1.519 -4.689
16 HA ARG 3 HA ARG 3 -4.028 -0.994 -3.069
17 HB2 ARG 3 2HB ARG 3 -5.346 -0.846 -4.996
18 HB3 ARG 3 3HB ARG 3 -3.717 -0.535 -5.581
19 HG2 ARG 3 2HG ARG 3 -3.719 -3.116 -6.031
20 HG3 ARG 3 3HG ARG 3 -5.470 -2.899 -6.014
21 HD2 ARG 3 2HD ARG 3 -3.605 -1.243 -7.701
22 HD3 ARG 3 3HD ARG 3 -4.374 -2.723 -8.273
23 HE ARG 3 HE ARG 3 -6.418 -1.150 -7.322
24 HH11 ARG 3 1HH1 ARG 3 -3.939 -0.865 -9.750
25 HH12 ARG 3 2HH1 ARG 3 -4.879 0.169 -10.774
26 HH21 ARG 3 1HH2 ARG 3 -7.665 0.212 -8.662
27 HH22 ARG 3 2HH2 ARG 3 -6.997 0.782 -10.154
28 H GLY 4 H GLY 4 -2.983 -4.088 -4.315
29 HA2 GLY 4 2HA GLY 4 -5.246 -5.355 -2.898
30 HA3 GLY 4 3HA GLY 4 -4.544 -6.013 -4.368
31 H TRP 5 H TRP 5 -4.466 -6.019 -0.988
32 HA TRP 5 HA TRP 5 -1.982 -7.605 -1.023
33 HB2 TRP 5 2HB TRP 5 -2.924 -5.495 0.857
34 HB3 TRP 5 3HB TRP 5 -2.035 -6.856 1.535
35 HD1 TRP 5 HD1 TRP 5 -1.191 -3.588 0.901
36 HE1 TRP 5 HE1 TRP 5 1.175 -3.253 -0.055
37 HE3 TRP 5 HE3 TRP 5 -0.303 -8.343 -0.752
38 HZ2 TRP 5 HZ2 TRP 5 3.155 -4.800 -1.341
39 HZ3 TRP 5 HZ3 TRP 5 1.852 -8.832 -1.834
40 HH2 TRP 5 HH2 TRP 5 3.544 -7.096 -2.122
41 H LYS 6 H LYS 6 -4.358 -7.089 1.549
42 HA LYS 6 HA LYS 6 -4.504 -9.419 2.758
43 HB2 LYS 6 2HB LYS 6 -7.148 -9.135 2.599
44 HB3 LYS 6 3HB LYS 6 -6.147 -8.047 3.552
45 HG2 LYS 6 2HG LYS 6 -6.517 -7.276 0.740
46 HG3 LYS 6 3HG LYS 6 -7.971 -7.240 1.740
47 HD2 LYS 6 2HD LYS 6 -7.218 -5.515 3.005
48 HD3 LYS 6 3HD LYS 6 -5.536 -6.046 2.918
49 HE2 LYS 6 2HE LYS 6 -5.133 -4.559 1.321
50 HE3 LYS 6 3HE LYS 6 -6.380 -5.286 0.309
51 HZ1 LYS 6 1HZ LYS 6 -7.533 -3.428 0.565
52 HZ2 LYS 6 2HZ LYS 6 -6.426 -2.815 1.688
53 HZ3 LYS 6 3HZ LYS 6 -7.709 -3.786 2.210
54 H ARG 7 H ARG 7 -6.383 -8.888 -0.231
55 HA ARG 7 HA ARG 7 -6.938 -11.698 -0.498
56 HB2 ARG 7 2HB ARG 7 -7.584 -9.240 -2.080
57 HB3 ARG 7 3HB ARG 7 -7.777 -10.821 -2.826
58 HG2 ARG 7 2HG ARG 7 -9.073 -9.993 -0.238
59 HG3 ARG 7 3HG ARG 7 -9.852 -9.922 -1.820
60 HD2 ARG 7 2HD ARG 7 -8.879 -12.490 -1.729
61 HD3 ARG 7 3HD ARG 7 -9.376 -12.201 -0.062
62 HE ARG 7 HE ARG 7 -11.079 -12.589 -2.309
63 HH11 ARG 7 1HH1 ARG 7 -10.806 -10.897 0.721
64 HH12 ARG 7 2HH1 ARG 7 -12.518 -10.779 0.959
65 HH21 ARG 7 1HH2 ARG 7 -13.335 -12.440 -2.007
66 HH22 ARG 7 2HH2 ARG 7 -13.956 -11.658 -0.593
67 H LYS 8 H LYS 8 -5.581 -9.517 -2.954
68 HA LYS 8 HA LYS 8 -4.103 -11.651 -4.160
69 HB2 LYS 8 2HB LYS 8 -4.864 -8.962 -4.837
70 HB3 LYS 8 3HB LYS 8 -3.142 -9.177 -5.125
71 HG2 LYS 8 2HG LYS 8 -3.769 -9.986 -7.105
72 HG3 LYS 8 3HG LYS 8 -4.183 -11.452 -6.213
73 HD2 LYS 8 2HD LYS 8 -6.234 -9.325 -6.274
74 HD3 LYS 8 3HD LYS 8 -5.914 -10.150 -7.801
75 HE2 LYS 8 2HE LYS 8 -6.040 -12.201 -5.948
76 HE3 LYS 8 3HE LYS 8 -7.305 -11.088 -5.430
77 HZ1 LYS 8 1HZ LYS 8 -8.546 -11.535 -7.224
78 HZ2 LYS 8 2HZ LYS 8 -7.622 -12.947 -7.325
79 HZ3 LYS 8 3HZ LYS 8 -7.222 -11.606 -8.275
80 H CYS 9 H CYS 9 -2.267 -12.424 -3.372
81 HA CYS 9 HA CYS 9 -0.418 -10.561 -2.033
82 HB2 CYS 9 2HB CYS 9 0.434 -12.633 -0.844
83 HB3 CYS 9 3HB CYS 9 -1.180 -12.099 -0.390
84 HG CYS 9 HG CYS 9 -0.509 -14.682 -2.535
85 HA PRO 10 HA PRO 10 1.656 -12.138 -5.870
86 HB2 PRO 10 2HB PRO 10 2.683 -9.728 -6.582
87 HB3 PRO 10 3HB PRO 10 1.060 -10.255 -7.044
88 HG2 PRO 10 2HG PRO 10 1.901 -8.441 -4.815
89 HG3 PRO 10 3HG PRO 10 0.545 -8.271 -5.946
90 HD2 PRO 10 2HD PRO 10 0.226 -9.183 -3.417
91 HD3 PRO 10 3HD PRO 10 -0.788 -9.734 -4.766
92 H LEU 11 H LEU 11 2.828 -9.796 -3.466
93 HA LEU 11 HA LEU 11 5.436 -11.167 -3.527
94 HB2 LEU 11 2HB LEU 11 5.685 -8.582 -2.378
95 HB3 LEU 11 3HB LEU 11 6.437 -9.219 -3.840
96 HG LEU 11 HG LEU 11 3.676 -8.026 -3.845
97 HD11 LEU 11 1HD1 LEU 11 6.271 -6.690 -3.626
98 HD12 LEU 11 2HD1 LEU 11 4.646 -6.078 -3.320
99 HD13 LEU 11 3HD1 LEU 11 5.273 -6.129 -4.968
100 HD21 LEU 11 1HD2 LEU 11 4.819 -9.516 -5.721
101 HD22 LEU 11 2HD2 LEU 11 5.550 -7.968 -6.145
102 HD23 LEU 11 3HD2 LEU 11 3.794 -8.136 -6.115
103 H PHE 12 H PHE 12 4.071 -8.763 -1.305
104 HA PHE 12 HA PHE 12 4.317 -10.746 0.861
105 HB2 PHE 12 2HB PHE 12 4.554 -8.266 2.081
106 HB3 PHE 12 3HB PHE 12 5.869 -9.387 1.745
107 HD1 PHE 12 HD1 PHE 12 4.134 -6.361 0.609
108 HD2 PHE 12 HD2 PHE 12 7.440 -8.969 -0.008
109 HE1 PHE 12 HE1 PHE 12 5.171 -4.690 -0.869
110 HE2 PHE 12 HE2 PHE 12 8.484 -7.302 -1.486
111 HZ PHE 12 HZ PHE 12 7.350 -5.159 -1.918
112 H GLY 13 H GLY 13 2.127 -11.304 0.755
113 HA2 GLY 13 2HA GLY 13 0.098 -9.251 0.982
114 HA3 GLY 13 3HA GLY 13 -0.172 -10.987 0.930
115 H LYS 14 H LYS 14 2.049 -10.976 3.152
116 HA LYS 14 HA LYS 14 0.188 -11.135 5.323
117 HB2 LYS 14 2HB LYS 14 3.190 -11.160 5.574
118 HB3 LYS 14 3HB LYS 14 2.005 -11.919 6.629
119 HG2 LYS 14 2HG LYS 14 2.325 -13.802 5.511
120 HG3 LYS 14 3HG LYS 14 1.563 -13.039 4.113
121 HD2 LYS 14 2HD LYS 14 3.675 -13.879 3.398
122 HD3 LYS 14 3HD LYS 14 3.820 -12.123 3.504
123 HE2 LYS 14 2HE LYS 14 5.619 -12.453 4.773
124 HE3 LYS 14 3HE LYS 14 4.525 -13.026 6.032
125 HZ1 LYS 14 1HZ LYS 14 5.629 -14.806 3.937
126 HZ2 LYS 14 2HZ LYS 14 4.851 -15.250 5.372
127 HZ3 LYS 14 3HZ LYS 14 6.395 -14.561 5.425
128 H GLY 15 H GLY 15 3.008 -9.052 4.657
129 HA2 GLY 15 2HA GLY 15 2.064 -7.207 6.740
130 HA3 GLY 15 3HA GLY 15 3.672 -7.220 6.032
131 H GLY 16 H GLY 16 0.692 -7.365 4.174
132 HA2 GLY 16 2HA GLY 16 1.389 -5.444 2.322
133 HA3 GLY 16 3HA GLY 16 -0.270 -5.873 2.714
Start of MODEL 8
1 H1 VAL 1 H VAL 1 1.487 1.616 -1.242
2 HA VAL 1 HA VAL 1 3.571 0.385 -2.007
3 HB VAL 1 HB VAL 1 2.412 -1.530 0.010
4 HG11 VAL 1 1HG1 VAL 1 4.140 -2.067 -2.368
5 HG12 VAL 1 2HG1 VAL 1 4.348 -3.019 -0.897
6 HG13 VAL 1 3HG1 VAL 1 2.791 -3.004 -1.726
7 HG21 VAL 1 1HG2 VAL 1 4.718 -1.543 0.864
8 HG22 VAL 1 2HG2 VAL 1 5.173 -0.373 -0.375
9 HG23 VAL 1 3HG2 VAL 1 4.016 0.075 0.878
10 H ALA 2 H ALA 2 0.874 -1.796 -1.264
11 HA ALA 2 HA ALA 2 0.140 -1.741 -4.118
12 HB1 ALA 2 1HB ALA 2 -0.290 -4.239 -2.577
13 HB2 ALA 2 2HB ALA 2 0.104 -4.010 -4.281
14 HB3 ALA 2 3HB ALA 2 1.362 -3.845 -3.056
15 H ARG 3 H ARG 3 -1.873 -1.079 -4.436
16 HA ARG 3 HA ARG 3 -3.691 -0.405 -2.478
17 HB2 ARG 3 2HB ARG 3 -5.281 -0.091 -4.195
18 HB3 ARG 3 3HB ARG 3 -3.721 0.215 -4.947
19 HG2 ARG 3 2HG ARG 3 -5.117 -2.441 -5.110
20 HG3 ARG 3 3HG ARG 3 -5.354 -1.150 -6.290
21 HD2 ARG 3 2HD ARG 3 -2.869 -1.143 -6.635
22 HD3 ARG 3 3HD ARG 3 -2.791 -2.589 -5.629
23 HE ARG 3 HE ARG 3 -4.626 -2.810 -7.830
24 HH11 ARG 3 1HH1 ARG 3 -1.316 -3.168 -6.813
25 HH12 ARG 3 2HH1 ARG 3 -0.920 -4.308 -8.057
26 HH21 ARG 3 1HH2 ARG 3 -4.117 -4.309 -9.472
27 HH22 ARG 3 2HH2 ARG 3 -2.514 -4.955 -9.569
28 H GLY 4 H GLY 4 -3.114 -3.510 -3.962
29 HA2 GLY 4 2HA GLY 4 -5.319 -4.638 -2.349
30 HA3 GLY 4 3HA GLY 4 -4.798 -5.309 -3.888
31 H TRP 5 H TRP 5 -4.388 -5.349 -0.514
32 HA TRP 5 HA TRP 5 -2.098 -7.181 -0.806
33 HB2 TRP 5 2HB TRP 5 -2.593 -4.980 1.141
34 HB3 TRP 5 3HB TRP 5 -1.773 -6.424 1.727
35 HD1 TRP 5 HD1 TRP 5 -0.694 -3.254 0.940
36 HE1 TRP 5 HE1 TRP 5 1.568 -3.164 -0.285
37 HE3 TRP 5 HE3 TRP 5 -0.469 -8.089 -0.705
38 HZ2 TRP 5 HZ2 TRP 5 3.228 -4.912 -1.755
39 HZ3 TRP 5 HZ3 TRP 5 1.489 -8.800 -2.014
40 HH2 TRP 5 HH2 TRP 5 3.298 -7.243 -2.528
41 H LYS 6 H LYS 6 -4.106 -6.404 2.005
42 HA LYS 6 HA LYS 6 -4.351 -8.710 3.255
43 HB2 LYS 6 2HB LYS 6 -6.953 -8.130 3.398
44 HB3 LYS 6 3HB LYS 6 -5.730 -7.180 4.232
45 HG2 LYS 6 2HG LYS 6 -5.748 -5.532 2.470
46 HG3 LYS 6 3HG LYS 6 -6.876 -6.510 1.529
47 HD2 LYS 6 2HD LYS 6 -7.551 -5.582 4.302
48 HD3 LYS 6 3HD LYS 6 -7.816 -4.546 2.898
49 HE2 LYS 6 2HE LYS 6 -9.082 -6.539 1.907
50 HE3 LYS 6 3HE LYS 6 -9.073 -7.196 3.543
51 HZ1 LYS 6 1HZ LYS 6 -9.937 -4.456 3.406
52 HZ2 LYS 6 2HZ LYS 6 -10.646 -5.775 4.193
53 HZ3 LYS 6 3HZ LYS 6 -10.939 -5.515 2.547
54 H ARG 7 H ARG 7 -6.409 -7.967 0.440
55 HA ARG 7 HA ARG 7 -7.341 -10.695 0.293
56 HB2 ARG 7 2HB ARG 7 -8.844 -8.847 -0.279
57 HB3 ARG 7 3HB ARG 7 -7.765 -8.358 -1.579
58 HG2 ARG 7 2HG ARG 7 -9.662 -9.569 -2.461
59 HG3 ARG 7 3HG ARG 7 -8.177 -10.489 -2.713
60 HD2 ARG 7 2HD ARG 7 -9.187 -11.271 -0.207
61 HD3 ARG 7 3HD ARG 7 -10.562 -11.238 -1.310
62 HE ARG 7 HE ARG 7 -8.371 -13.089 -1.333
63 HH11 ARG 7 1HH1 ARG 7 -10.817 -11.548 -3.273
64 HH12 ARG 7 2HH1 ARG 7 -10.853 -12.808 -4.461
65 HH21 ARG 7 1HH2 ARG 7 -8.409 -14.754 -2.891
66 HH22 ARG 7 2HH2 ARG 7 -9.484 -14.632 -4.242
67 H LYS 8 H LYS 8 -6.005 -8.675 -2.311
68 HA LYS 8 HA LYS 8 -4.921 -10.970 -3.644
69 HB2 LYS 8 2HB LYS 8 -4.639 -8.012 -4.196
70 HB3 LYS 8 3HB LYS 8 -4.015 -9.278 -5.245
71 HG2 LYS 8 2HG LYS 8 -6.870 -9.478 -4.548
72 HG3 LYS 8 3HG LYS 8 -6.410 -8.113 -5.569
73 HD2 LYS 8 2HD LYS 8 -6.272 -9.452 -7.338
74 HD3 LYS 8 3HD LYS 8 -5.086 -10.463 -6.508
75 HE2 LYS 8 2HE LYS 8 -6.747 -11.876 -5.633
76 HE3 LYS 8 3HE LYS 8 -8.033 -10.725 -5.992
77 HZ1 LYS 8 1HZ LYS 8 -7.151 -11.141 -8.430
78 HZ2 LYS 8 2HZ LYS 8 -8.313 -12.142 -7.719
79 HZ3 LYS 8 3HZ LYS 8 -6.692 -12.624 -7.757
80 H CYS 9 H CYS 9 -3.123 -11.943 -2.996
81 HA CYS 9 HA CYS 9 -0.939 -10.283 -1.919
82 HB2 CYS 9 2HB CYS 9 -0.196 -12.422 -0.783
83 HB3 CYS 9 3HB CYS 9 -1.689 -11.717 -0.176
84 HG CYS 9 HG CYS 9 -3.378 -13.546 -1.291
85 HA PRO 10 HA PRO 10 0.514 -12.123 -5.924
86 HB2 PRO 10 2HB PRO 10 1.694 -9.844 -6.810
87 HB3 PRO 10 3HB PRO 10 -0.015 -10.207 -7.076
88 HG2 PRO 10 2HG PRO 10 1.249 -8.455 -5.004
89 HG3 PRO 10 3HG PRO 10 -0.200 -8.163 -5.983
90 HD2 PRO 10 2HD PRO 10 -0.324 -8.997 -3.410
91 HD3 PRO 10 3HD PRO 10 -1.534 -9.461 -4.624
92 H LEU 11 H LEU 11 2.179 -9.880 -3.725
93 HA LEU 11 HA LEU 11 4.611 -11.515 -4.036
94 HB2 LEU 11 2HB LEU 11 5.259 -8.958 -2.992
95 HB3 LEU 11 3HB LEU 11 5.757 -9.685 -4.518
96 HG LEU 11 HG LEU 11 3.152 -8.212 -4.224
97 HD11 LEU 11 1HD1 LEU 11 4.802 -6.502 -5.561
98 HD12 LEU 11 2HD1 LEU 11 5.874 -7.146 -4.318
99 HD13 LEU 11 3HD1 LEU 11 4.361 -6.365 -3.859
100 HD21 LEU 11 1HD2 LEU 11 3.924 -9.822 -6.193
101 HD22 LEU 11 2HD2 LEU 11 4.735 -8.351 -6.728
102 HD23 LEU 11 3HD2 LEU 11 2.988 -8.356 -6.486
103 H PHE 12 H PHE 12 3.763 -8.947 -1.743
104 HA PHE 12 HA PHE 12 4.037 -10.912 0.435
105 HB2 PHE 12 2HB PHE 12 4.684 -8.474 1.570
106 HB3 PHE 12 3HB PHE 12 5.828 -9.721 1.084
107 HD1 PHE 12 HD1 PHE 12 4.265 -6.540 0.130
108 HD2 PHE 12 HD2 PHE 12 7.211 -9.454 -0.844
109 HE1 PHE 12 HE1 PHE 12 5.271 -4.978 -1.484
110 HE2 PHE 12 HE2 PHE 12 8.222 -7.897 -2.459
111 HZ PHE 12 HZ PHE 12 7.252 -5.656 -2.780
112 H GLY 13 H GLY 13 1.789 -11.218 0.552
113 HA2 GLY 13 2HA GLY 13 0.136 -8.878 1.150
114 HA3 GLY 13 3HA GLY 13 -0.449 -10.500 0.811
115 H LYS 14 H LYS 14 2.011 -10.974 2.881
116 HA LYS 14 HA LYS 14 0.353 -11.682 5.046
117 HB2 LYS 14 2HB LYS 14 2.479 -12.006 6.286
118 HB3 LYS 14 3HB LYS 14 2.474 -12.789 4.711
119 HG2 LYS 14 2HG LYS 14 3.698 -10.769 3.833
120 HG3 LYS 14 3HG LYS 14 3.889 -10.263 5.514
121 HD2 LYS 14 2HD LYS 14 5.870 -11.415 5.012
122 HD3 LYS 14 3HD LYS 14 4.895 -12.579 5.911
123 HE2 LYS 14 2HE LYS 14 4.110 -13.463 3.685
124 HE3 LYS 14 3HE LYS 14 5.340 -12.448 2.935
125 HZ1 LYS 14 1HZ LYS 14 5.629 -14.937 4.360
126 HZ2 LYS 14 2HZ LYS 14 6.743 -13.753 4.826
127 HZ3 LYS 14 3HZ LYS 14 6.641 -14.227 3.205
128 H GLY 15 H GLY 15 2.434 -8.869 4.479
129 HA2 GLY 15 2HA GLY 15 1.168 -7.591 6.825
130 HA3 GLY 15 3HA GLY 15 2.837 -7.300 6.358
131 H GLY 16 H GLY 16 2.087 -7.270 3.475
132 HA2 GLY 16 2HA GLY 16 1.665 -5.636 1.915
133 HA3 GLY 16 3HA GLY 16 0.181 -5.384 2.821
Start of MODEL 9
1 H1 VAL 1 H VAL 1 0.404 0.446 -0.222
2 HA VAL 1 HA VAL 1 1.725 0.570 -2.088
3 HB VAL 1 HB VAL 1 3.497 -0.598 -0.920
4 HG11 VAL 1 1HG1 VAL 1 2.095 -3.142 -1.734
5 HG12 VAL 1 2HG1 VAL 1 3.658 -3.035 -0.922
6 HG13 VAL 1 3HG1 VAL 1 2.196 -2.496 -0.097
7 HG21 VAL 1 1HG2 VAL 1 3.487 -2.187 -3.396
8 HG22 VAL 1 2HG2 VAL 1 3.224 -0.456 -3.609
9 HG23 VAL 1 3HG2 VAL 1 4.676 -1.033 -2.791
10 H ALA 2 H ALA 2 -0.014 -2.426 -1.487
11 HA ALA 2 HA ALA 2 -0.787 -2.469 -4.332
12 HB1 ALA 2 1HB ALA 2 -0.487 -4.712 -4.501
13 HB2 ALA 2 2HB ALA 2 0.725 -4.381 -3.262
14 HB3 ALA 2 3HB ALA 2 -0.859 -5.004 -2.801
15 H ARG 3 H ARG 3 -2.873 -2.076 -4.623
16 HA ARG 3 HA ARG 3 -4.747 -1.694 -2.630
17 HB2 ARG 3 2HB ARG 3 -6.378 -1.546 -4.331
18 HB3 ARG 3 3HB ARG 3 -4.879 -1.009 -5.078
19 HG2 ARG 3 2HG ARG 3 -5.911 -3.821 -5.320
20 HG3 ARG 3 3HG ARG 3 -6.320 -2.537 -6.460
21 HD2 ARG 3 2HD ARG 3 -3.583 -3.634 -5.840
22 HD3 ARG 3 3HD ARG 3 -4.479 -3.786 -7.351
23 HE ARG 3 HE ARG 3 -2.909 -1.547 -6.490
24 HH11 ARG 3 1HH1 ARG 3 -5.594 -2.545 -8.469
25 HH12 ARG 3 2HH1 ARG 3 -5.463 -1.200 -9.554
26 HH21 ARG 3 1HH2 ARG 3 -2.727 0.228 -7.911
27 HH22 ARG 3 2HH2 ARG 3 -3.831 0.376 -9.236
28 H GLY 4 H GLY 4 -3.770 -4.648 -4.209
29 HA2 GLY 4 2HA GLY 4 -5.838 -6.110 -2.689
30 HA3 GLY 4 3HA GLY 4 -5.124 -6.682 -4.190
31 H TRP 5 H TRP 5 -4.899 -6.633 -0.786
32 HA TRP 5 HA TRP 5 -2.370 -8.139 -0.932
33 HB2 TRP 5 2HB TRP 5 -3.265 -6.015 0.964
34 HB3 TRP 5 3HB TRP 5 -2.253 -7.315 1.587
35 HD1 TRP 5 HD1 TRP 5 -1.667 -4.010 0.775
36 HE1 TRP 5 HE1 TRP 5 0.601 -3.580 -0.363
37 HE3 TRP 5 HE3 TRP 5 -0.602 -8.776 -0.740
38 HZ2 TRP 5 HZ2 TRP 5 2.579 -5.064 -1.724
39 HZ3 TRP 5 HZ3 TRP 5 1.498 -9.185 -1.954
40 HH2 TRP 5 HH2 TRP 5 3.054 -7.366 -2.436
41 H LYS 6 H LYS 6 -4.562 -7.612 1.792
42 HA LYS 6 HA LYS 6 -4.555 -9.928 3.049
43 HB2 LYS 6 2HB LYS 6 -7.202 -9.682 3.134
44 HB3 LYS 6 3HB LYS 6 -6.137 -8.557 3.965
45 HG2 LYS 6 2HG LYS 6 -6.777 -7.852 1.185
46 HG3 LYS 6 3HG LYS 6 -8.136 -7.822 2.311
47 HD2 LYS 6 2HD LYS 6 -6.214 -6.559 3.761
48 HD3 LYS 6 3HD LYS 6 -5.794 -6.057 2.122
49 HE2 LYS 6 2HE LYS 6 -8.657 -5.935 2.824
50 HE3 LYS 6 3HE LYS 6 -7.608 -4.793 3.663
51 HZ1 LYS 6 1HZ LYS 6 -7.325 -3.597 1.819
52 HZ2 LYS 6 2HZ LYS 6 -8.667 -4.423 1.205
53 HZ3 LYS 6 3HZ LYS 6 -7.105 -4.956 0.836
54 H ARG 7 H ARG 7 -6.657 -9.459 0.204
55 HA ARG 7 HA ARG 7 -7.337 -12.227 0.042
56 HB2 ARG 7 2HB ARG 7 -7.828 -9.803 -1.627
57 HB3 ARG 7 3HB ARG 7 -8.059 -11.382 -2.365
58 HG2 ARG 7 2HG ARG 7 -9.968 -11.743 -1.267
59 HG3 ARG 7 3HG ARG 7 -9.320 -11.124 0.253
60 HD2 ARG 7 2HD ARG 7 -11.213 -9.789 -0.629
61 HD3 ARG 7 3HD ARG 7 -9.728 -8.857 -0.436
62 HE ARG 7 HE ARG 7 -9.817 -9.818 -3.057
63 HH11 ARG 7 1HH1 ARG 7 -11.535 -7.597 -0.999
64 HH12 ARG 7 2HH1 ARG 7 -12.026 -6.566 -2.302
65 HH21 ARG 7 1HH2 ARG 7 -10.458 -8.469 -4.781
66 HH22 ARG 7 2HH2 ARG 7 -11.414 -7.064 -4.452
67 H LYS 8 H LYS 8 -5.912 -10.356 -2.608
68 HA LYS 8 HA LYS 8 -4.457 -12.678 -3.509
69 HB2 LYS 8 2HB LYS 8 -3.663 -11.084 -5.309
70 HB3 LYS 8 3HB LYS 8 -5.401 -11.344 -5.228
71 HG2 LYS 8 2HG LYS 8 -5.830 -9.218 -4.556
72 HG3 LYS 8 3HG LYS 8 -4.291 -9.056 -3.706
73 HD2 LYS 8 2HD LYS 8 -4.458 -9.204 -6.705
74 HD3 LYS 8 3HD LYS 8 -4.600 -7.677 -5.830
75 HE2 LYS 8 2HE LYS 8 -2.365 -8.846 -4.718
76 HE3 LYS 8 3HE LYS 8 -2.246 -9.286 -6.421
77 HZ1 LYS 8 1HZ LYS 8 -1.438 -7.266 -6.763
78 HZ2 LYS 8 2HZ LYS 8 -1.789 -6.771 -5.184
79 HZ3 LYS 8 3HZ LYS 8 -2.962 -6.631 -6.395
80 H CYS 9 H CYS 9 -2.486 -13.212 -2.865
81 HA CYS 9 HA CYS 9 -0.727 -11.091 -1.819
82 HB2 CYS 9 2HB CYS 9 0.356 -12.966 -0.500
83 HB3 CYS 9 3HB CYS 9 -1.270 -12.519 0.001
84 HG CYS 9 HG CYS 9 -0.463 -15.423 -0.145
85 HA PRO 10 HA PRO 10 1.275 -12.828 -5.614
86 HB2 PRO 10 2HB PRO 10 2.122 -10.422 -6.541
87 HB3 PRO 10 3HB PRO 10 0.514 -11.070 -6.882
88 HG2 PRO 10 2HG PRO 10 1.349 -9.058 -4.829
89 HG3 PRO 10 3HG PRO 10 -0.066 -9.044 -5.898
90 HD2 PRO 10 2HD PRO 10 -0.210 -9.790 -3.299
91 HD3 PRO 10 3HD PRO 10 -1.252 -10.492 -4.553
92 H LEU 11 H LEU 11 2.470 -10.144 -3.592
93 HA LEU 11 HA LEU 11 5.133 -11.403 -3.647
94 HB2 LEU 11 2HB LEU 11 5.269 -8.730 -2.693
95 HB3 LEU 11 3HB LEU 11 5.987 -9.424 -4.145
96 HG LEU 11 HG LEU 11 3.157 -8.408 -4.080
97 HD11 LEU 11 1HD1 LEU 11 4.025 -6.370 -3.753
98 HD12 LEU 11 2HD1 LEU 11 4.568 -6.508 -5.426
99 HD13 LEU 11 3HD1 LEU 11 5.669 -6.904 -4.107
100 HD21 LEU 11 1HD2 LEU 11 4.868 -8.375 -6.493
101 HD22 LEU 11 2HD2 LEU 11 3.147 -8.721 -6.324
102 HD23 LEU 11 3HD2 LEU 11 4.339 -9.954 -5.911
103 H PHE 12 H PHE 12 3.744 -8.932 -1.515
104 HA PHE 12 HA PHE 12 4.232 -10.738 0.761
105 HB2 PHE 12 2HB PHE 12 4.381 -8.166 1.793
106 HB3 PHE 12 3HB PHE 12 5.742 -9.231 1.459
107 HD1 PHE 12 HD1 PHE 12 3.778 -6.387 0.241
108 HD2 PHE 12 HD2 PHE 12 7.173 -8.865 -0.429
109 HE1 PHE 12 HE1 PHE 12 4.629 -4.770 -1.407
110 HE2 PHE 12 HE2 PHE 12 8.030 -7.252 -2.077
111 HZ PHE 12 HZ PHE 12 6.759 -5.201 -2.567
112 H GLY 13 H GLY 13 2.083 -11.431 0.840
113 HA2 GLY 13 2HA GLY 13 -0.033 -9.453 1.102
114 HA3 GLY 13 3HA GLY 13 -0.234 -11.198 1.065
115 H LYS 14 H LYS 14 2.124 -10.991 3.179
116 HA LYS 14 HA LYS 14 0.356 -11.217 5.443
117 HB2 LYS 14 2HB LYS 14 2.434 -11.732 6.697
118 HB3 LYS 14 3HB LYS 14 2.217 -12.750 5.279
119 HG2 LYS 14 2HG LYS 14 3.697 -10.691 4.272
120 HG3 LYS 14 3HG LYS 14 4.327 -10.834 5.915
121 HD2 LYS 14 2HD LYS 14 4.622 -13.278 5.513
122 HD3 LYS 14 3HD LYS 14 4.155 -13.010 3.832
123 HE2 LYS 14 2HE LYS 14 6.060 -11.676 3.417
124 HE3 LYS 14 3HE LYS 14 6.424 -11.528 5.135
125 HZ1 LYS 14 1HZ LYS 14 7.909 -13.125 4.529
126 HZ2 LYS 14 2HZ LYS 14 6.921 -13.770 3.317
127 HZ3 LYS 14 3HZ LYS 14 6.602 -14.118 4.942
128 H GLY 15 H GLY 15 2.842 -8.963 4.326
129 HA2 GLY 15 2HA GLY 15 2.113 -7.167 6.554
130 HA3 GLY 15 3HA GLY 15 3.667 -7.153 5.733
131 H GLY 16 H GLY 16 0.648 -7.448 3.995
132 HA2 GLY 16 2HA GLY 16 1.160 -5.494 2.129
133 HA3 GLY 16 3HA GLY 16 -0.457 -6.006 2.585
Start of MODEL 10
1 H1 VAL 1 H VAL 1 0.894 0.346 0.315
2 HA VAL 1 HA VAL 1 2.625 0.759 -1.276
3 HB VAL 1 HB VAL 1 4.285 -0.634 -0.191
4 HG11 VAL 1 1HG1 VAL 1 4.301 -3.069 -0.484
5 HG12 VAL 1 2HG1 VAL 1 2.872 -2.527 0.399
6 HG13 VAL 1 3HG1 VAL 1 2.742 -2.976 -1.302
7 HG21 VAL 1 1HG2 VAL 1 5.499 -0.949 -2.064
8 HG22 VAL 1 2HG2 VAL 1 4.259 -1.942 -2.829
9 HG23 VAL 1 3HG2 VAL 1 4.118 -0.184 -2.850
10 H ALA 2 H ALA 2 0.664 -2.142 -1.030
11 HA ALA 2 HA ALA 2 0.006 -1.863 -3.890
12 HB1 ALA 2 1HB ALA 2 1.328 -3.974 -2.965
13 HB2 ALA 2 2HB ALA 2 -0.311 -4.512 -2.598
14 HB3 ALA 2 3HB ALA 2 0.132 -4.102 -4.255
15 H ARG 3 H ARG 3 -2.030 -1.280 -4.213
16 HA ARG 3 HA ARG 3 -3.951 -0.926 -2.264
17 HB2 ARG 3 2HB ARG 3 -5.494 -0.508 -3.998
18 HB3 ARG 3 3HB ARG 3 -3.930 -0.043 -4.655
19 HG2 ARG 3 2HG ARG 3 -5.189 -2.727 -5.152
20 HG3 ARG 3 3HG ARG 3 -5.428 -1.329 -6.203
21 HD2 ARG 3 2HD ARG 3 -2.742 -1.327 -6.018
22 HD3 ARG 3 3HD ARG 3 -3.059 -3.051 -5.834
23 HE ARG 3 HE ARG 3 -4.488 -1.964 -8.038
24 HH11 ARG 3 1HH1 ARG 3 -1.331 -3.024 -7.024
25 HH12 ARG 3 2HH1 ARG 3 -0.809 -3.429 -8.626
26 HH21 ARG 3 1HH2 ARG 3 -3.813 -2.494 -10.151
27 HH22 ARG 3 2HH2 ARG 3 -2.222 -3.127 -10.404
28 H GLY 4 H GLY 4 -3.138 -3.808 -4.057
29 HA2 GLY 4 2HA GLY 4 -5.359 -5.226 -2.722
30 HA3 GLY 4 3HA GLY 4 -4.648 -5.722 -4.251
31 H TRP 5 H TRP 5 -4.516 -5.979 -0.851
32 HA TRP 5 HA TRP 5 -2.102 -7.656 -1.072
33 HB2 TRP 5 2HB TRP 5 -2.901 -5.646 0.984
34 HB3 TRP 5 3HB TRP 5 -2.013 -7.071 1.517
35 HD1 TRP 5 HD1 TRP 5 -1.140 -3.772 1.040
36 HE1 TRP 5 HE1 TRP 5 1.190 -3.421 0.004
37 HE3 TRP 5 HE3 TRP 5 -0.408 -8.441 -0.909
38 HZ2 TRP 5 HZ2 TRP 5 3.086 -4.925 -1.449
39 HZ3 TRP 5 HZ3 TRP 5 1.690 -8.903 -2.108
40 HH2 TRP 5 HH2 TRP 5 3.400 -7.180 -2.372
41 H LYS 6 H LYS 6 -4.368 -7.204 1.610
42 HA LYS 6 HA LYS 6 -4.570 -9.599 2.680
43 HB2 LYS 6 2HB LYS 6 -7.234 -9.157 2.548
44 HB3 LYS 6 3HB LYS 6 -6.156 -8.310 3.650
45 HG2 LYS 6 2HG LYS 6 -6.227 -6.363 2.445
46 HG3 LYS 6 3HG LYS 6 -6.598 -7.186 0.929
47 HD2 LYS 6 2HD LYS 6 -8.526 -5.926 1.743
48 HD3 LYS 6 3HD LYS 6 -8.858 -7.660 1.736
49 HE2 LYS 6 2HE LYS 6 -8.882 -7.801 4.019
50 HE3 LYS 6 3HE LYS 6 -7.770 -6.449 4.224
51 HZ1 LYS 6 1HZ LYS 6 -9.548 -5.237 4.703
52 HZ2 LYS 6 2HZ LYS 6 -10.617 -6.454 4.217
53 HZ3 LYS 6 3HZ LYS 6 -10.009 -5.359 3.080
54 H ARG 7 H ARG 7 -6.561 -8.806 -0.176
55 HA ARG 7 HA ARG 7 -7.261 -11.556 -0.598
56 HB2 ARG 7 2HB ARG 7 -7.882 -8.955 -1.873
57 HB3 ARG 7 3HB ARG 7 -7.976 -10.370 -2.913
58 HG2 ARG 7 2HG ARG 7 -9.940 -10.930 -2.062
59 HG3 ARG 7 3HG ARG 7 -9.291 -10.902 -0.422
60 HD2 ARG 7 2HD ARG 7 -9.494 -8.291 -0.767
61 HD3 ARG 7 3HD ARG 7 -10.709 -8.777 -1.949
62 HE ARG 7 HE ARG 7 -10.936 -8.887 0.904
63 HH11 ARG 7 1HH1 ARG 7 -12.007 -10.319 -2.083
64 HH12 ARG 7 2HH1 ARG 7 -13.499 -10.900 -1.421
65 HH21 ARG 7 1HH2 ARG 7 -12.897 -9.646 1.787
66 HH22 ARG 7 2HH2 ARG 7 -14.005 -10.515 0.780
67 H LYS 8 H LYS 8 -5.825 -9.330 -2.967
68 HA LYS 8 HA LYS 8 -4.493 -11.488 -4.305
69 HB2 LYS 8 2HB LYS 8 -4.560 -8.506 -4.690
70 HB3 LYS 8 3HB LYS 8 -3.465 -9.519 -5.621
71 HG2 LYS 8 2HG LYS 8 -6.341 -10.259 -5.550
72 HG3 LYS 8 3HG LYS 8 -5.851 -8.868 -6.521
73 HD2 LYS 8 2HD LYS 8 -4.926 -10.167 -8.090
74 HD3 LYS 8 3HD LYS 8 -4.106 -11.169 -6.890
75 HE2 LYS 8 2HE LYS 8 -5.925 -12.607 -6.671
76 HE3 LYS 8 3HE LYS 8 -7.053 -11.437 -7.354
77 HZ1 LYS 8 1HZ LYS 8 -6.345 -13.394 -8.799
78 HZ2 LYS 8 2HZ LYS 8 -4.870 -12.585 -8.978
79 HZ3 LYS 8 3HZ LYS 8 -6.303 -11.854 -9.500
80 H CYS 9 H CYS 9 -2.608 -12.335 -3.743
81 HA CYS 9 HA CYS 9 -0.679 -10.638 -2.299
82 HB2 CYS 9 2HB CYS 9 0.152 -12.822 -1.306
83 HB3 CYS 9 3HB CYS 9 -1.426 -12.277 -0.752
84 HG CYS 9 HG CYS 9 -1.375 -15.093 -1.064
85 HA PRO 10 HA PRO 10 1.223 -11.971 -6.315
86 HB2 PRO 10 2HB PRO 10 2.284 -9.538 -6.885
87 HB3 PRO 10 3HB PRO 10 0.634 -9.993 -7.326
88 HG2 PRO 10 2HG PRO 10 1.593 -8.368 -5.002
89 HG3 PRO 10 3HG PRO 10 0.205 -8.084 -6.069
90 HD2 PRO 10 2HD PRO 10 -0.051 -9.174 -3.604
91 HD3 PRO 10 3HD PRO 10 -1.123 -9.602 -4.953
92 H LEU 11 H LEU 11 2.586 -9.726 -3.904
93 HA LEU 11 HA LEU 11 5.138 -11.185 -4.117
94 HB2 LEU 11 2HB LEU 11 5.485 -8.686 -2.810
95 HB3 LEU 11 3HB LEU 11 6.169 -9.240 -4.336
96 HG LEU 11 HG LEU 11 3.437 -7.995 -4.157
97 HD11 LEU 11 1HD1 LEU 11 4.483 -6.110 -3.542
98 HD12 LEU 11 2HD1 LEU 11 5.021 -6.060 -5.221
99 HD13 LEU 11 3HD1 LEU 11 6.076 -6.731 -3.977
100 HD21 LEU 11 1HD2 LEU 11 4.494 -9.385 -6.169
101 HD22 LEU 11 2HD2 LEU 11 5.206 -7.812 -6.528
102 HD23 LEU 11 3HD2 LEU 11 3.453 -7.984 -6.428
103 H PHE 12 H PHE 12 3.908 -8.912 -1.686
104 HA PHE 12 HA PHE 12 4.207 -11.038 0.332
105 HB2 PHE 12 2HB PHE 12 4.519 -8.629 1.689
106 HB3 PHE 12 3HB PHE 12 5.798 -9.761 1.262
107 HD1 PHE 12 HD1 PHE 12 4.124 -6.632 0.348
108 HD2 PHE 12 HD2 PHE 12 7.321 -9.301 -0.530
109 HE1 PHE 12 HE1 PHE 12 5.166 -4.912 -1.070
110 HE2 PHE 12 HE2 PHE 12 8.368 -7.586 -1.949
111 HZ PHE 12 HZ PHE 12 7.291 -5.387 -2.220
112 H GLY 13 H GLY 13 1.993 -11.551 0.228
113 HA2 GLY 13 2HA GLY 13 0.029 -9.478 0.739
114 HA3 GLY 13 3HA GLY 13 -0.296 -11.186 0.485
115 H LYS 14 H LYS 14 2.070 -11.276 2.663
116 HA LYS 14 HA LYS 14 0.223 -11.684 4.855
117 HB2 LYS 14 2HB LYS 14 2.191 -12.544 6.057
118 HB3 LYS 14 3HB LYS 14 1.993 -13.317 4.490
119 HG2 LYS 14 2HG LYS 14 4.193 -12.908 4.316
120 HG3 LYS 14 3HG LYS 14 3.645 -11.308 3.809
121 HD2 LYS 14 2HD LYS 14 3.699 -10.811 6.381
122 HD3 LYS 14 3HD LYS 14 4.807 -12.184 6.417
123 HE2 LYS 14 2HE LYS 14 6.348 -11.106 4.999
124 HE3 LYS 14 3HE LYS 14 5.174 -9.881 4.523
125 HZ1 LYS 14 1HZ LYS 14 5.207 -9.255 6.992
126 HZ2 LYS 14 2HZ LYS 14 6.521 -8.789 6.035
127 HZ3 LYS 14 3HZ LYS 14 6.656 -10.127 7.061
128 H GLY 15 H GLY 15 2.889 -9.515 4.030
129 HA2 GLY 15 2HA GLY 15 2.249 -7.932 6.440
130 HA3 GLY 15 3HA GLY 15 3.825 -7.959 5.663
131 H GLY 16 H GLY 16 0.777 -7.757 3.927
132 HA2 GLY 16 2HA GLY 16 1.504 -5.703 2.243
133 HA3 GLY 16 3HA GLY 16 -0.159 -6.069 2.677
Start of MODEL 11
1 H1 VAL 1 H VAL 1 0.638 0.244 -0.248
2 HA VAL 1 HA VAL 1 2.480 1.110 -1.824
3 HB VAL 1 HB VAL 1 4.268 -0.140 -0.770
4 HG11 VAL 1 1HG1 VAL 1 4.400 -2.585 -0.957
5 HG12 VAL 1 2HG1 VAL 1 3.003 -2.071 -0.010
6 HG13 VAL 1 3HG1 VAL 1 2.791 -2.609 -1.677
7 HG21 VAL 1 1HG2 VAL 1 5.398 -0.491 -2.690
8 HG22 VAL 1 2HG2 VAL 1 4.168 -1.575 -3.341
9 HG23 VAL 1 3HG2 VAL 1 3.941 0.171 -3.432
10 H ALA 2 H ALA 2 0.689 -1.869 -1.338
11 HA ALA 2 HA ALA 2 -0.124 -1.767 -4.170
12 HB1 ALA 2 1HB ALA 2 0.098 -4.013 -4.434
13 HB2 ALA 2 2HB ALA 2 1.347 -3.764 -3.213
14 HB3 ALA 2 3HB ALA 2 -0.243 -4.360 -2.739
15 H ARG 3 H ARG 3 -2.202 -1.307 -4.417
16 HA ARG 3 HA ARG 3 -4.040 -0.941 -2.393
17 HB2 ARG 3 2HB ARG 3 -5.689 -0.704 -4.064
18 HB3 ARG 3 3HB ARG 3 -4.187 -0.191 -4.822
19 HG2 ARG 3 2HG ARG 3 -5.314 -2.962 -5.117
20 HG3 ARG 3 3HG ARG 3 -5.680 -1.638 -6.225
21 HD2 ARG 3 2HD ARG 3 -2.998 -1.477 -6.184
22 HD3 ARG 3 3HD ARG 3 -3.199 -3.202 -5.881
23 HE ARG 3 HE ARG 3 -3.646 -1.829 -8.343
24 HH11 ARG 3 1HH1 ARG 3 -4.668 -4.539 -6.411
25 HH12 ARG 3 2HH1 ARG 3 -5.219 -5.465 -7.767
26 HH21 ARG 3 1HH2 ARG 3 -4.368 -3.039 -10.137
27 HH22 ARG 3 2HH2 ARG 3 -5.047 -4.611 -9.886
28 H GLY 4 H GLY 4 -3.174 -3.875 -4.077
29 HA2 GLY 4 2HA GLY 4 -5.240 -5.325 -2.541
30 HA3 GLY 4 3HA GLY 4 -4.595 -5.867 -4.084
31 H TRP 5 H TRP 5 -4.256 -5.944 -0.691
32 HA TRP 5 HA TRP 5 -1.772 -7.506 -0.974
33 HB2 TRP 5 2HB TRP 5 -2.563 -5.440 1.028
34 HB3 TRP 5 3HB TRP 5 -1.574 -6.791 1.576
35 HD1 TRP 5 HD1 TRP 5 -0.898 -3.482 0.905
36 HE1 TRP 5 HE1 TRP 5 1.349 -3.067 -0.279
37 HE3 TRP 5 HE3 TRP 5 -0.038 -8.195 -0.879
38 HZ2 TRP 5 HZ2 TRP 5 3.236 -4.542 -1.773
39 HZ3 TRP 5 HZ3 TRP 5 2.011 -8.609 -2.177
40 HH2 TRP 5 HH2 TRP 5 3.612 -6.819 -2.614
41 H LYS 6 H LYS 6 -3.913 -7.039 1.806
42 HA LYS 6 HA LYS 6 -3.919 -9.401 2.982
43 HB2 LYS 6 2HB LYS 6 -6.504 -9.140 3.235
44 HB3 LYS 6 3HB LYS 6 -5.434 -7.925 3.922
45 HG2 LYS 6 2HG LYS 6 -5.782 -6.555 1.875
46 HG3 LYS 6 3HG LYS 6 -6.981 -7.738 1.347
47 HD2 LYS 6 2HD LYS 6 -7.225 -6.534 4.067
48 HD3 LYS 6 3HD LYS 6 -7.706 -5.582 2.660
49 HE2 LYS 6 2HE LYS 6 -9.180 -7.456 1.967
50 HE3 LYS 6 3HE LYS 6 -8.764 -8.290 3.463
51 HZ1 LYS 6 1HZ LYS 6 -10.861 -7.105 3.655
52 HZ2 LYS 6 2HZ LYS 6 -10.098 -5.643 3.280
53 HZ3 LYS 6 3HZ LYS 6 -9.710 -6.455 4.712
54 H ARG 7 H ARG 7 -5.932 -8.780 0.111
55 HA ARG 7 HA ARG 7 -6.597 -11.586 -0.125
56 HB2 ARG 7 2HB ARG 7 -7.277 -9.157 -1.779
57 HB3 ARG 7 3HB ARG 7 -7.759 -10.784 -2.239
58 HG2 ARG 7 2HG ARG 7 -8.840 -10.917 0.077
59 HG3 ARG 7 3HG ARG 7 -8.645 -9.163 0.118
60 HD2 ARG 7 2HD ARG 7 -10.393 -8.862 -1.227
61 HD3 ARG 7 3HD ARG 7 -9.773 -10.031 -2.393
62 HE ARG 7 HE ARG 7 -10.788 -11.571 -0.395
63 HH11 ARG 7 1HH1 ARG 7 -12.057 -9.005 -2.376
64 HH12 ARG 7 2HH1 ARG 7 -13.682 -9.604 -2.339
65 HH21 ARG 7 1HH2 ARG 7 -12.924 -12.370 -0.338
66 HH22 ARG 7 2HH2 ARG 7 -14.174 -11.517 -1.178
67 H LYS 8 H LYS 8 -5.413 -9.345 -2.620
68 HA LYS 8 HA LYS 8 -4.089 -11.461 -4.022
69 HB2 LYS 8 2HB LYS 8 -3.942 -8.469 -4.435
70 HB3 LYS 8 3HB LYS 8 -3.354 -9.688 -5.559
71 HG2 LYS 8 2HG LYS 8 -5.977 -10.421 -5.146
72 HG3 LYS 8 3HG LYS 8 -6.037 -8.657 -5.163
73 HD2 LYS 8 2HD LYS 8 -6.335 -9.366 -7.407
74 HD3 LYS 8 3HD LYS 8 -4.685 -8.748 -7.292
75 HE2 LYS 8 2HE LYS 8 -3.962 -11.143 -6.905
76 HE3 LYS 8 3HE LYS 8 -5.594 -11.616 -7.373
77 HZ1 LYS 8 1HZ LYS 8 -5.254 -10.526 -9.507
78 HZ2 LYS 8 2HZ LYS 8 -4.085 -11.721 -9.248
79 HZ3 LYS 8 3HZ LYS 8 -3.682 -10.089 -9.057
80 H CYS 9 H CYS 9 -2.205 -12.295 -3.435
81 HA CYS 9 HA CYS 9 -0.234 -10.538 -2.128
82 HB2 CYS 9 2HB CYS 9 -0.345 -13.548 -1.912
83 HB3 CYS 9 3HB CYS 9 0.609 -12.435 -0.939
84 HG CYS 9 HG CYS 9 -1.857 -13.748 0.208
85 HA PRO 10 HA PRO 10 1.494 -11.769 -6.262
86 HB2 PRO 10 2HB PRO 10 2.395 -9.285 -6.887
87 HB3 PRO 10 3HB PRO 10 0.749 -9.827 -7.238
88 HG2 PRO 10 2HG PRO 10 1.748 -8.148 -4.969
89 HG3 PRO 10 3HG PRO 10 0.291 -7.940 -5.958
90 HD2 PRO 10 2HD PRO 10 0.227 -9.035 -3.483
91 HD3 PRO 10 3HD PRO 10 -0.894 -9.521 -4.771
92 H LEU 11 H LEU 11 2.867 -9.455 -3.923
93 HA LEU 11 HA LEU 11 5.464 -10.812 -4.243
94 HB2 LEU 11 2HB LEU 11 5.790 -8.243 -3.069
95 HB3 LEU 11 3HB LEU 11 6.418 -8.848 -4.601
96 HG LEU 11 HG LEU 11 3.649 -7.704 -4.360
97 HD11 LEU 11 1HD1 LEU 11 4.616 -5.750 -3.852
98 HD12 LEU 11 2HD1 LEU 11 5.118 -5.742 -5.542
99 HD13 LEU 11 3HD1 LEU 11 6.226 -6.315 -4.297
100 HD21 LEU 11 1HD2 LEU 11 3.620 -7.710 -6.646
101 HD22 LEU 11 2HD2 LEU 11 4.635 -9.122 -6.352
102 HD23 LEU 11 3HD2 LEU 11 5.373 -7.578 -6.781
103 H PHE 12 H PHE 12 4.290 -8.470 -1.852
104 HA PHE 12 HA PHE 12 4.769 -10.489 0.240
105 HB2 PHE 12 2HB PHE 12 5.091 -8.059 1.507
106 HB3 PHE 12 3HB PHE 12 6.392 -9.113 0.965
107 HD1 PHE 12 HD1 PHE 12 4.405 -6.131 0.144
108 HD2 PHE 12 HD2 PHE 12 7.759 -8.537 -0.895
109 HE1 PHE 12 HE1 PHE 12 5.205 -4.359 -1.364
110 HE2 PHE 12 HE2 PHE 12 8.564 -6.769 -2.405
111 HZ PHE 12 HZ PHE 12 7.287 -4.676 -2.640
112 H GLY 13 H GLY 13 2.610 -11.099 0.392
113 HA2 GLY 13 2HA GLY 13 0.550 -9.107 0.791
114 HA3 GLY 13 3HA GLY 13 0.336 -10.851 0.810
115 H LYS 14 H LYS 14 2.584 -11.087 2.788
116 HA LYS 14 HA LYS 14 1.140 -11.324 5.116
117 HB2 LYS 14 2HB LYS 14 4.020 -11.129 4.455
118 HB3 LYS 14 3HB LYS 14 3.592 -10.824 6.133
119 HG2 LYS 14 2HG LYS 14 2.951 -13.305 4.551
120 HG3 LYS 14 3HG LYS 14 4.172 -13.148 5.816
121 HD2 LYS 14 2HD LYS 14 2.652 -13.576 7.381
122 HD3 LYS 14 3HD LYS 14 1.652 -12.235 6.816
123 HE2 LYS 14 2HE LYS 14 0.194 -13.957 6.485
124 HE3 LYS 14 3HE LYS 14 1.022 -13.976 4.928
125 HZ1 LYS 14 1HZ LYS 14 0.763 -16.085 6.633
126 HZ2 LYS 14 2HZ LYS 14 2.354 -15.572 6.892
127 HZ3 LYS 14 3HZ LYS 14 1.843 -15.987 5.334
128 H GLY 15 H GLY 15 3.731 -8.922 5.095
129 HA2 GLY 15 2HA GLY 15 2.088 -7.184 6.756
130 HA3 GLY 15 3HA GLY 15 3.802 -6.991 6.421
131 H GLY 16 H GLY 16 1.084 -7.329 4.160
132 HA2 GLY 16 2HA GLY 16 1.952 -5.482 2.308
133 HA3 GLY 16 3HA GLY 16 0.263 -5.894 2.563
Start of MODEL 12
1 H1 VAL 1 H VAL 1 0.272 -0.150 0.021
2 HA VAL 1 HA VAL 1 2.085 0.859 -1.420
3 HB VAL 1 HB VAL 1 3.894 -0.653 -2.070
4 HG11 VAL 1 1HG1 VAL 1 4.212 -0.824 0.833
5 HG12 VAL 1 2HG1 VAL 1 5.182 0.031 -0.369
6 HG13 VAL 1 3HG1 VAL 1 3.704 0.764 0.257
7 HG21 VAL 1 1HG2 VAL 1 2.909 -2.519 0.081
8 HG22 VAL 1 2HG2 VAL 1 2.598 -2.753 -1.639
9 HG23 VAL 1 3HG2 VAL 1 4.254 -2.774 -1.032
10 H ALA 2 H ALA 2 0.326 -2.122 -1.186
11 HA ALA 2 HA ALA 2 -0.193 -2.003 -4.085
12 HB1 ALA 2 1HB ALA 2 1.191 -3.998 -3.079
13 HB2 ALA 2 2HB ALA 2 -0.409 -4.597 -2.640
14 HB3 ALA 2 3HB ALA 2 -0.021 -4.273 -4.330
15 H ARG 3 H ARG 3 -2.240 -1.571 -4.550
16 HA ARG 3 HA ARG 3 -4.270 -1.133 -2.767
17 HB2 ARG 3 2HB ARG 3 -5.752 -1.046 -4.597
18 HB3 ARG 3 3HB ARG 3 -4.188 -0.592 -5.260
19 HG2 ARG 3 2HG ARG 3 -5.284 -3.387 -5.408
20 HG3 ARG 3 3HG ARG 3 -5.558 -2.168 -6.655
21 HD2 ARG 3 2HD ARG 3 -2.864 -2.008 -6.330
22 HD3 ARG 3 3HD ARG 3 -3.148 -3.720 -6.021
23 HE ARG 3 HE ARG 3 -4.540 -3.166 -8.316
24 HH11 ARG 3 1HH1 ARG 3 -1.228 -2.892 -7.277
25 HH12 ARG 3 2HH1 ARG 3 -0.574 -3.134 -8.863
26 HH21 ARG 3 1HH2 ARG 3 -3.690 -3.486 -10.409
27 HH22 ARG 3 2HH2 ARG 3 -1.975 -3.471 -10.644
28 H GLY 4 H GLY 4 -3.240 -4.176 -4.150
29 HA2 GLY 4 2HA GLY 4 -5.363 -5.531 -2.603
30 HA3 GLY 4 3HA GLY 4 -4.722 -6.152 -4.117
31 H TRP 5 H TRP 5 -4.462 -6.192 -0.748
32 HA TRP 5 HA TRP 5 -1.936 -7.700 -0.938
33 HB2 TRP 5 2HB TRP 5 -2.815 -5.618 1.004
34 HB3 TRP 5 3HB TRP 5 -1.846 -6.955 1.618
35 HD1 TRP 5 HD1 TRP 5 -1.141 -3.661 0.936
36 HE1 TRP 5 HE1 TRP 5 1.149 -3.258 -0.167
37 HE3 TRP 5 HE3 TRP 5 -0.219 -8.390 -0.772
38 HZ2 TRP 5 HZ2 TRP 5 3.089 -4.747 -1.576
39 HZ3 TRP 5 HZ3 TRP 5 1.877 -8.817 -1.988
40 HH2 TRP 5 HH2 TRP 5 3.495 -7.032 -2.381
41 H LYS 6 H LYS 6 -4.224 -7.235 1.732
42 HA LYS 6 HA LYS 6 -4.238 -9.533 2.996
43 HB2 LYS 6 2HB LYS 6 -6.936 -9.353 2.760
44 HB3 LYS 6 3HB LYS 6 -5.969 -8.351 3.834
45 HG2 LYS 6 2HG LYS 6 -6.010 -6.532 2.339
46 HG3 LYS 6 3HG LYS 6 -6.617 -7.533 1.018
47 HD2 LYS 6 2HD LYS 6 -8.147 -6.998 3.560
48 HD3 LYS 6 3HD LYS 6 -8.329 -6.045 2.085
49 HE2 LYS 6 2HE LYS 6 -8.654 -8.492 1.058
50 HE3 LYS 6 3HE LYS 6 -9.220 -8.803 2.698
51 HZ1 LYS 6 1HZ LYS 6 -10.622 -6.697 2.318
52 HZ2 LYS 6 2HZ LYS 6 -11.126 -8.147 1.606
53 HZ3 LYS 6 3HZ LYS 6 -10.336 -6.977 0.674
54 H ARG 7 H ARG 7 -6.701 -9.344 0.443
55 HA ARG 7 HA ARG 7 -6.750 -12.175 0.122
56 HB2 ARG 7 2HB ARG 7 -8.281 -11.678 -1.784
57 HB3 ARG 7 3HB ARG 7 -8.765 -10.924 -0.271
58 HG2 ARG 7 2HG ARG 7 -7.310 -8.930 -1.307
59 HG3 ARG 7 3HG ARG 7 -7.855 -9.703 -2.796
60 HD2 ARG 7 2HD ARG 7 -9.809 -9.131 -0.609
61 HD3 ARG 7 3HD ARG 7 -9.297 -7.834 -1.688
62 HE ARG 7 HE ARG 7 -10.049 -9.988 -3.277
63 HH11 ARG 7 1HH1 ARG 7 -11.510 -7.788 -1.008
64 HH12 ARG 7 2HH1 ARG 7 -13.074 -7.855 -1.751
65 HH21 ARG 7 1HH2 ARG 7 -12.103 -10.084 -4.264
66 HH22 ARG 7 2HH2 ARG 7 -13.410 -9.161 -3.603
67 H LYS 8 H LYS 8 -5.572 -9.509 -1.916
68 HA LYS 8 HA LYS 8 -4.369 -11.388 -3.776
69 HB2 LYS 8 2HB LYS 8 -5.102 -8.563 -3.796
70 HB3 LYS 8 3HB LYS 8 -3.515 -8.852 -4.495
71 HG2 LYS 8 2HG LYS 8 -4.707 -9.174 -6.372
72 HG3 LYS 8 3HG LYS 8 -4.911 -10.798 -5.712
73 HD2 LYS 8 2HD LYS 8 -6.900 -9.113 -4.572
74 HD3 LYS 8 3HD LYS 8 -6.905 -8.872 -6.321
75 HE2 LYS 8 2HE LYS 8 -7.019 -11.338 -6.601
76 HE3 LYS 8 3HE LYS 8 -7.160 -11.493 -4.851
77 HZ1 LYS 8 1HZ LYS 8 -9.104 -10.434 -6.783
78 HZ2 LYS 8 2HZ LYS 8 -9.134 -9.864 -5.191
79 HZ3 LYS 8 3HZ LYS 8 -9.343 -11.513 -5.502
80 H CYS 9 H CYS 9 -2.595 -12.350 -2.958
81 HA CYS 9 HA CYS 9 -0.524 -10.622 -1.775
82 HB2 CYS 9 2HB CYS 9 0.344 -12.770 -0.762
83 HB3 CYS 9 3HB CYS 9 -1.210 -12.221 -0.147
84 HG CYS 9 HG CYS 9 -0.567 -15.160 -0.994
85 HA PRO 10 HA PRO 10 1.078 -12.119 -5.874
86 HB2 PRO 10 2HB PRO 10 2.055 -9.705 -6.642
87 HB3 PRO 10 3HB PRO 10 0.385 -10.204 -6.937
88 HG2 PRO 10 2HG PRO 10 1.484 -8.449 -4.774
89 HG3 PRO 10 3HG PRO 10 0.018 -8.238 -5.749
90 HD2 PRO 10 2HD PRO 10 -0.041 -9.203 -3.220
91 HD3 PRO 10 3HD PRO 10 -1.201 -9.713 -4.463
92 H LEU 11 H LEU 11 2.596 -9.695 -3.739
93 HA LEU 11 HA LEU 11 5.136 -11.158 -4.032
94 HB2 LEU 11 2HB LEU 11 5.584 -8.585 -2.939
95 HB3 LEU 11 3HB LEU 11 6.109 -9.226 -4.495
96 HG LEU 11 HG LEU 11 3.397 -7.984 -4.115
97 HD11 LEU 11 1HD1 LEU 11 6.005 -6.688 -4.167
98 HD12 LEU 11 2HD1 LEU 11 4.422 -6.039 -3.741
99 HD13 LEU 11 3HD1 LEU 11 4.915 -6.117 -5.432
100 HD21 LEU 11 1HD2 LEU 11 4.287 -9.461 -6.148
101 HD22 LEU 11 2HD2 LEU 11 4.933 -7.897 -6.646
102 HD23 LEU 11 3HD2 LEU 11 3.201 -8.090 -6.373
103 H PHE 12 H PHE 12 4.090 -8.718 -1.683
104 HA PHE 12 HA PHE 12 4.544 -10.697 0.453
105 HB2 PHE 12 2HB PHE 12 4.995 -8.269 1.662
106 HB3 PHE 12 3HB PHE 12 6.246 -9.362 1.078
107 HD1 PHE 12 HD1 PHE 12 4.292 -6.346 0.290
108 HD2 PHE 12 HD2 PHE 12 7.568 -8.826 -0.820
109 HE1 PHE 12 HE1 PHE 12 5.078 -4.607 -1.264
110 HE2 PHE 12 HE2 PHE 12 8.360 -7.091 -2.374
111 HZ PHE 12 HZ PHE 12 7.115 -4.978 -2.598
112 H GLY 13 H GLY 13 2.331 -11.200 0.570
113 HA2 GLY 13 2HA GLY 13 0.469 -9.035 1.192
114 HA3 GLY 13 3HA GLY 13 0.046 -10.712 0.879
115 H LYS 14 H LYS 14 2.524 -11.029 2.900
116 HA LYS 14 HA LYS 14 1.040 -11.895 5.082
117 HB2 LYS 14 2HB LYS 14 3.202 -11.763 6.344
118 HB3 LYS 14 3HB LYS 14 3.301 -12.635 4.820
119 HG2 LYS 14 2HG LYS 14 4.192 -10.546 3.777
120 HG3 LYS 14 3HG LYS 14 4.262 -9.842 5.394
121 HD2 LYS 14 2HD LYS 14 6.426 -10.674 4.985
122 HD3 LYS 14 3HD LYS 14 5.665 -11.863 6.044
123 HE2 LYS 14 2HE LYS 14 5.302 -12.329 3.162
124 HE3 LYS 14 3HE LYS 14 6.962 -12.464 3.741
125 HZ1 LYS 14 1HZ LYS 14 5.277 -13.797 5.540
126 HZ2 LYS 14 2HZ LYS 14 6.485 -14.451 4.553
127 HZ3 LYS 14 3HZ LYS 14 4.898 -14.330 3.979
128 H GLY 15 H GLY 15 2.687 -8.783 4.591
129 HA2 GLY 15 2HA GLY 15 1.108 -7.721 6.854
130 HA3 GLY 15 3HA GLY 15 2.743 -7.187 6.490
131 H GLY 16 H GLY 16 1.995 -7.358 3.537
132 HA2 GLY 16 2HA GLY 16 1.421 -5.809 1.937
133 HA3 GLY 16 3HA GLY 16 -0.070 -5.662 2.856
Start of MODEL 13
1 H1 VAL 1 H VAL 1 2.128 -0.958 1.165
2 HA VAL 1 HA VAL 1 2.049 0.352 -0.841
3 HB VAL 1 HB VAL 1 3.407 -1.393 -2.440
4 HG11 VAL 1 1HG1 VAL 1 5.302 -0.494 -0.592
5 HG12 VAL 1 2HG1 VAL 1 4.805 0.300 -2.088
6 HG13 VAL 1 3HG1 VAL 1 4.011 0.707 -0.566
7 HG21 VAL 1 1HG2 VAL 1 2.979 -3.124 -0.602
8 HG22 VAL 1 2HG2 VAL 1 4.631 -2.952 -1.193
9 HG23 VAL 1 3HG2 VAL 1 4.164 -2.224 0.344
10 H ALA 2 H ALA 2 1.842 -2.931 -2.162
11 HA ALA 2 HA ALA 2 0.395 -2.272 -4.426
12 HB1 ALA 2 1HB ALA 2 0.177 -4.539 -4.822
13 HB2 ALA 2 2HB ALA 2 1.578 -4.480 -3.752
14 HB3 ALA 2 3HB ALA 2 -0.002 -4.927 -3.111
15 H ARG 3 H ARG 3 -1.610 -1.578 -4.733
16 HA ARG 3 HA ARG 3 -3.460 -0.988 -2.821
17 HB2 ARG 3 2HB ARG 3 -5.048 -0.694 -4.542
18 HB3 ARG 3 3HB ARG 3 -3.489 -0.378 -5.292
19 HG2 ARG 3 2HG ARG 3 -4.880 -3.038 -5.451
20 HG3 ARG 3 3HG ARG 3 -5.093 -1.755 -6.643
21 HD2 ARG 3 2HD ARG 3 -2.383 -1.891 -6.478
22 HD3 ARG 3 3HD ARG 3 -2.831 -3.573 -6.201
23 HE ARG 3 HE ARG 3 -3.446 -3.731 -8.397
24 HH11 ARG 3 1HH1 ARG 3 -3.190 -0.370 -7.529
25 HH12 ARG 3 2HH1 ARG 3 -3.399 0.200 -9.152
26 HH21 ARG 3 1HH2 ARG 3 -3.722 -2.994 -10.538
27 HH22 ARG 3 2HH2 ARG 3 -3.703 -1.294 -10.863
28 H GLY 4 H GLY 4 -2.899 -4.088 -4.348
29 HA2 GLY 4 2HA GLY 4 -5.151 -5.228 -2.822
30 HA3 GLY 4 3HA GLY 4 -4.438 -5.953 -4.255
31 H TRP 5 H TRP 5 -4.355 -5.734 -0.845
32 HA TRP 5 HA TRP 5 -2.028 -7.542 -0.791
33 HB2 TRP 5 2HB TRP 5 -2.775 -5.275 1.025
34 HB3 TRP 5 3HB TRP 5 -1.827 -6.623 1.647
35 HD1 TRP 5 HD1 TRP 5 -1.102 -3.354 0.727
36 HE1 TRP 5 HE1 TRP 5 1.180 -3.070 -0.429
37 HE3 TRP 5 HE3 TRP 5 -0.256 -8.217 -0.606
38 HZ2 TRP 5 HZ2 TRP 5 3.086 -4.692 -1.735
39 HZ3 TRP 5 HZ3 TRP 5 1.820 -8.766 -1.806
40 HH2 TRP 5 HH2 TRP 5 3.455 -7.039 -2.359
41 H LYS 6 H LYS 6 -4.293 -6.593 1.759
42 HA LYS 6 HA LYS 6 -4.616 -8.807 3.154
43 HB2 LYS 6 2HB LYS 6 -7.110 -8.292 3.314
44 HB3 LYS 6 3HB LYS 6 -6.003 -6.992 3.733
45 HG2 LYS 6 2HG LYS 6 -6.299 -6.123 1.396
46 HG3 LYS 6 3HG LYS 6 -7.590 -7.311 1.200
47 HD2 LYS 6 2HD LYS 6 -7.525 -5.242 3.392
48 HD3 LYS 6 3HD LYS 6 -8.363 -5.020 1.855
49 HE2 LYS 6 2HE LYS 6 -9.248 -7.486 2.730
50 HE3 LYS 6 3HE LYS 6 -9.149 -6.535 4.211
51 HZ1 LYS 6 1HZ LYS 6 -10.335 -5.053 2.087
52 HZ2 LYS 6 2HZ LYS 6 -10.938 -5.381 3.632
53 HZ3 LYS 6 3HZ LYS 6 -11.182 -6.488 2.377
54 H ARG 7 H ARG 7 -6.359 -8.306 0.089
55 HA ARG 7 HA ARG 7 -7.220 -11.080 0.073
56 HB2 ARG 7 2HB ARG 7 -7.750 -8.715 -1.711
57 HB3 ARG 7 3HB ARG 7 -8.226 -10.342 -2.179
58 HG2 ARG 7 2HG ARG 7 -9.062 -9.201 0.457
59 HG3 ARG 7 3HG ARG 7 -9.949 -8.827 -1.022
60 HD2 ARG 7 2HD ARG 7 -9.377 -11.668 -0.708
61 HD3 ARG 7 3HD ARG 7 -10.359 -11.009 0.600
62 HE ARG 7 HE ARG 7 -11.532 -10.071 -1.681
63 HH11 ARG 7 1HH1 ARG 7 -10.705 -13.219 -0.446
64 HH12 ARG 7 2HH1 ARG 7 -12.010 -14.023 -1.254
65 HH21 ARG 7 1HH2 ARG 7 -13.255 -11.117 -2.749
66 HH22 ARG 7 2HH2 ARG 7 -13.459 -12.826 -2.564
67 H LYS 8 H LYS 8 -5.675 -9.022 -2.398
68 HA LYS 8 HA LYS 8 -4.517 -11.317 -3.690
69 HB2 LYS 8 2HB LYS 8 -3.925 -8.405 -4.231
70 HB3 LYS 8 3HB LYS 8 -3.671 -9.765 -5.317
71 HG2 LYS 8 2HG LYS 8 -6.323 -8.677 -4.394
72 HG3 LYS 8 3HG LYS 8 -5.612 -8.514 -6.002
73 HD2 LYS 8 2HD LYS 8 -6.386 -11.118 -4.686
74 HD3 LYS 8 3HD LYS 8 -7.330 -10.274 -5.916
75 HE2 LYS 8 2HE LYS 8 -4.538 -11.365 -6.259
76 HE3 LYS 8 3HE LYS 8 -6.017 -12.088 -6.892
77 HZ1 LYS 8 1HZ LYS 8 -5.648 -10.882 -8.703
78 HZ2 LYS 8 2HZ LYS 8 -4.445 -9.957 -7.957
79 HZ3 LYS 8 3HZ LYS 8 -6.070 -9.513 -7.803
80 H CYS 9 H CYS 9 -2.663 -12.245 -3.153
81 HA CYS 9 HA CYS 9 -0.634 -10.629 -1.755
82 HB2 CYS 9 2HB CYS 9 0.079 -12.816 -0.699
83 HB3 CYS 9 3HB CYS 9 -1.477 -12.191 -0.168
84 HG CYS 9 HG CYS 9 -1.332 -14.510 -2.656
85 HA PRO 10 HA PRO 10 1.110 -12.247 -5.761
86 HB2 PRO 10 2HB PRO 10 2.156 -9.870 -6.551
87 HB3 PRO 10 3HB PRO 10 0.494 -10.355 -6.910
88 HG2 PRO 10 2HG PRO 10 1.517 -8.552 -4.750
89 HG3 PRO 10 3HG PRO 10 0.100 -8.351 -5.797
90 HD2 PRO 10 2HD PRO 10 -0.089 -9.240 -3.247
91 HD3 PRO 10 3HD PRO 10 -1.197 -9.772 -4.528
92 H LEU 11 H LEU 11 2.583 -9.745 -3.682
93 HA LEU 11 HA LEU 11 5.111 -11.250 -3.808
94 HB2 LEU 11 2HB LEU 11 5.505 -8.651 -2.736
95 HB3 LEU 11 3HB LEU 11 6.129 -9.333 -4.237
96 HG LEU 11 HG LEU 11 3.411 -8.055 -4.045
97 HD11 LEU 11 1HD1 LEU 11 4.485 -6.127 -3.683
98 HD12 LEU 11 2HD1 LEU 11 4.979 -6.260 -5.371
99 HD13 LEU 11 3HD1 LEU 11 6.058 -6.813 -4.091
100 HD21 LEU 11 1HD2 LEU 11 4.350 -9.640 -5.968
101 HD22 LEU 11 2HD2 LEU 11 5.056 -8.117 -6.509
102 HD23 LEU 11 3HD2 LEU 11 3.309 -8.257 -6.304
103 H PHE 12 H PHE 12 3.980 -8.766 -1.545
104 HA PHE 12 HA PHE 12 4.336 -10.712 0.640
105 HB2 PHE 12 2HB PHE 12 4.698 -8.176 1.751
106 HB3 PHE 12 3HB PHE 12 5.949 -9.371 1.424
107 HD1 PHE 12 HD1 PHE 12 4.287 -6.341 0.186
108 HD2 PHE 12 HD2 PHE 12 7.465 -9.111 -0.404
109 HE1 PHE 12 HE1 PHE 12 5.329 -4.799 -1.424
110 HE2 PHE 12 HE2 PHE 12 8.512 -7.573 -2.014
111 HZ PHE 12 HZ PHE 12 7.444 -5.413 -2.525
112 H GLY 13 H GLY 13 2.099 -11.203 0.593
113 HA2 GLY 13 2HA GLY 13 0.219 -9.036 1.132
114 HA3 GLY 13 3HA GLY 13 -0.191 -10.714 0.809
115 H LYS 14 H LYS 14 2.300 -10.482 3.054
116 HA LYS 14 HA LYS 14 0.637 -11.472 5.160
117 HB2 LYS 14 2HB LYS 14 3.526 -10.590 5.288
118 HB3 LYS 14 3HB LYS 14 2.687 -11.596 6.462
119 HG2 LYS 14 2HG LYS 14 2.851 -13.457 5.192
120 HG3 LYS 14 3HG LYS 14 2.700 -12.568 3.675
121 HD2 LYS 14 2HD LYS 14 5.052 -11.654 4.258
122 HD3 LYS 14 3HD LYS 14 5.129 -13.023 5.370
123 HE2 LYS 14 2HE LYS 14 4.173 -14.057 2.950
124 HE3 LYS 14 3HE LYS 14 5.480 -12.958 2.513
125 HZ1 LYS 14 1HZ LYS 14 7.017 -14.281 3.445
126 HZ2 LYS 14 2HZ LYS 14 5.852 -15.492 3.252
127 HZ3 LYS 14 3HZ LYS 14 6.030 -14.722 4.747
128 H GLY 15 H GLY 15 2.446 -8.460 4.620
129 HA2 GLY 15 2HA GLY 15 0.861 -7.250 6.803
130 HA3 GLY 15 3HA GLY 15 2.527 -6.803 6.464
131 H GLY 16 H GLY 16 2.078 -6.900 3.542
132 HA2 GLY 16 2HA GLY 16 1.633 -5.360 1.896
133 HA3 GLY 16 3HA GLY 16 0.044 -5.264 2.640
Start of MODEL 14
1 H1 VAL 1 H VAL 1 1.947 -0.783 0.879
2 HA VAL 1 HA VAL 1 2.329 0.909 -1.267
3 HB VAL 1 HB VAL 1 4.154 -0.554 -1.974
4 HG11 VAL 1 1HG1 VAL 1 5.453 0.025 -0.230
5 HG12 VAL 1 2HG1 VAL 1 3.984 0.799 0.369
6 HG13 VAL 1 3HG1 VAL 1 4.431 -0.809 0.940
7 HG21 VAL 1 1HG2 VAL 1 3.214 -2.513 0.111
8 HG22 VAL 1 2HG2 VAL 1 2.870 -2.682 -1.610
9 HG23 VAL 1 3HG2 VAL 1 4.538 -2.710 -1.037
10 H ALA 2 H ALA 2 0.576 -2.074 -1.131
11 HA ALA 2 HA ALA 2 0.078 -1.879 -4.030
12 HB1 ALA 2 1HB ALA 2 0.217 -4.151 -4.323
13 HB2 ALA 2 2HB ALA 2 1.445 -3.903 -3.081
14 HB3 ALA 2 3HB ALA 2 -0.153 -4.502 -2.634
15 H ARG 3 H ARG 3 -1.965 -1.438 -4.508
16 HA ARG 3 HA ARG 3 -4.008 -1.004 -2.748
17 HB2 ARG 3 2HB ARG 3 -5.466 -0.892 -4.583
18 HB3 ARG 3 3HB ARG 3 -3.892 -0.489 -5.256
19 HG2 ARG 3 2HG ARG 3 -3.798 -3.058 -5.765
20 HG3 ARG 3 3HG ARG 3 -5.554 -2.926 -5.641
21 HD2 ARG 3 2HD ARG 3 -4.965 -0.787 -7.210
22 HD3 ARG 3 3HD ARG 3 -3.721 -1.932 -7.709
23 HE ARG 3 HE ARG 3 -5.335 -3.133 -8.780
24 HH11 ARG 3 1HH1 ARG 3 -6.858 -1.092 -6.406
25 HH12 ARG 3 2HH1 ARG 3 -8.469 -1.504 -6.895
26 HH21 ARG 3 1HH2 ARG 3 -7.451 -3.683 -9.432
27 HH22 ARG 3 2HH2 ARG 3 -8.805 -2.979 -8.615
28 H GLY 4 H GLY 4 -2.993 -4.053 -4.139
29 HA2 GLY 4 2HA GLY 4 -5.103 -5.398 -2.564
30 HA3 GLY 4 3HA GLY 4 -4.509 -6.012 -4.100
31 H TRP 5 H TRP 5 -4.189 -6.134 -0.751
32 HA TRP 5 HA TRP 5 -1.664 -7.632 -1.013
33 HB2 TRP 5 2HB TRP 5 -2.520 -5.604 0.994
34 HB3 TRP 5 3HB TRP 5 -1.550 -6.959 1.564
35 HD1 TRP 5 HD1 TRP 5 -0.842 -3.650 0.966
36 HE1 TRP 5 HE1 TRP 5 1.439 -3.222 -0.147
37 HE3 TRP 5 HE3 TRP 5 0.052 -8.333 -0.880
38 HZ2 TRP 5 HZ2 TRP 5 3.363 -4.678 -1.613
39 HZ3 TRP 5 HZ3 TRP 5 2.136 -8.732 -2.126
40 HH2 TRP 5 HH2 TRP 5 3.755 -6.940 -2.485
41 H LYS 6 H LYS 6 -3.921 -7.247 1.695
42 HA LYS 6 HA LYS 6 -3.917 -9.579 2.895
43 HB2 LYS 6 2HB LYS 6 -6.620 -9.398 2.686
44 HB3 LYS 6 3HB LYS 6 -5.645 -8.431 3.783
45 HG2 LYS 6 2HG LYS 6 -5.676 -6.571 2.318
46 HG3 LYS 6 3HG LYS 6 -6.351 -7.536 1.003
47 HD2 LYS 6 2HD LYS 6 -7.922 -7.473 3.501
48 HD3 LYS 6 3HD LYS 6 -7.827 -5.952 2.609
49 HE2 LYS 6 2HE LYS 6 -8.351 -8.289 0.928
50 HE3 LYS 6 3HE LYS 6 -9.609 -7.973 2.122
51 HZ1 LYS 6 1HZ LYS 6 -9.194 -6.673 -0.301
52 HZ2 LYS 6 2HZ LYS 6 -8.845 -5.550 0.914
53 HZ3 LYS 6 3HZ LYS 6 -10.352 -6.317 0.880
54 H ARG 7 H ARG 7 -6.405 -9.325 0.370
55 HA ARG 7 HA ARG 7 -6.445 -12.148 -0.029
56 HB2 ARG 7 2HB ARG 7 -8.009 -11.609 -1.893
57 HB3 ARG 7 3HB ARG 7 -8.472 -10.893 -0.355
58 HG2 ARG 7 2HG ARG 7 -7.049 -8.865 -1.356
59 HG3 ARG 7 3HG ARG 7 -7.594 -9.607 -2.862
60 HD2 ARG 7 2HD ARG 7 -9.462 -8.949 -0.598
61 HD3 ARG 7 3HD ARG 7 -9.084 -7.804 -1.885
62 HE ARG 7 HE ARG 7 -9.871 -10.087 -3.176
63 HH11 ARG 7 1HH1 ARG 7 -11.276 -7.957 -0.807
64 HH12 ARG 7 2HH1 ARG 7 -12.904 -8.242 -1.326
65 HH21 ARG 7 1HH2 ARG 7 -12.010 -10.471 -3.868
66 HH22 ARG 7 2HH2 ARG 7 -13.321 -9.673 -3.067
67 H LYS 8 H LYS 8 -5.310 -9.415 -2.001
68 HA LYS 8 HA LYS 8 -4.129 -11.227 -3.940
69 HB2 LYS 8 2HB LYS 8 -4.522 -8.265 -3.763
70 HB3 LYS 8 3HB LYS 8 -3.312 -8.906 -4.867
71 HG2 LYS 8 2HG LYS 8 -6.224 -9.670 -4.871
72 HG3 LYS 8 3HG LYS 8 -5.480 -8.489 -5.950
73 HD2 LYS 8 2HD LYS 8 -4.857 -10.115 -7.331
74 HD3 LYS 8 3HD LYS 8 -3.951 -10.896 -6.032
75 HE2 LYS 8 2HE LYS 8 -5.951 -12.072 -5.315
76 HE3 LYS 8 3HE LYS 8 -6.904 -11.243 -6.545
77 HZ1 LYS 8 1HZ LYS 8 -5.095 -13.491 -6.810
78 HZ2 LYS 8 2HZ LYS 8 -4.973 -12.327 -8.032
79 HZ3 LYS 8 3HZ LYS 8 -6.457 -13.081 -7.728
80 H CYS 9 H CYS 9 -2.345 -12.218 -3.182
81 HA CYS 9 HA CYS 9 -0.256 -10.536 -1.965
82 HB2 CYS 9 2HB CYS 9 0.623 -12.719 -1.043
83 HB3 CYS 9 3HB CYS 9 -0.922 -12.192 -0.387
84 HG CYS 9 HG CYS 9 -0.362 -15.102 -1.223
85 HA PRO 10 HA PRO 10 1.287 -11.886 -6.137
86 HB2 PRO 10 2HB PRO 10 2.256 -9.447 -6.832
87 HB3 PRO 10 3HB PRO 10 0.581 -9.933 -7.122
88 HG2 PRO 10 2HG PRO 10 1.712 -8.258 -4.913
89 HG3 PRO 10 3HG PRO 10 0.233 -8.012 -5.859
90 HD2 PRO 10 2HD PRO 10 0.208 -9.066 -3.365
91 HD3 PRO 10 3HD PRO 10 -0.969 -9.531 -4.610
92 H LEU 11 H LEU 11 2.833 -9.550 -3.928
93 HA LEU 11 HA LEU 11 5.370 -10.998 -4.314
94 HB2 LEU 11 2HB LEU 11 5.830 -8.468 -3.129
95 HB3 LEU 11 3HB LEU 11 6.338 -9.050 -4.712
96 HG LEU 11 HG LEU 11 3.631 -7.824 -4.257
97 HD11 LEU 11 1HD1 LEU 11 5.139 -5.911 -5.522
98 HD12 LEU 11 2HD1 LEU 11 6.238 -6.526 -4.289
99 HD13 LEU 11 3HD1 LEU 11 4.659 -5.893 -3.825
100 HD21 LEU 11 1HD2 LEU 11 4.497 -9.225 -6.352
101 HD22 LEU 11 2HD2 LEU 11 5.139 -7.645 -6.800
102 HD23 LEU 11 3HD2 LEU 11 3.410 -7.846 -6.515
103 H PHE 12 H PHE 12 4.351 -8.651 -1.858
104 HA PHE 12 HA PHE 12 4.836 -10.709 0.194
105 HB2 PHE 12 2HB PHE 12 5.299 -8.330 1.490
106 HB3 PHE 12 3HB PHE 12 6.544 -9.395 0.846
107 HD1 PHE 12 HD1 PHE 12 4.573 -6.355 0.206
108 HD2 PHE 12 HD2 PHE 12 7.839 -8.780 -1.047
109 HE1 PHE 12 HE1 PHE 12 5.332 -4.554 -1.289
110 HE2 PHE 12 HE2 PHE 12 8.604 -6.983 -2.543
111 HZ PHE 12 HZ PHE 12 7.351 -4.866 -2.665
112 H GLY 13 H GLY 13 2.649 -11.236 0.382
113 HA2 GLY 13 2HA GLY 13 0.709 -9.154 0.937
114 HA3 GLY 13 3HA GLY 13 0.394 -10.881 0.848
115 H LYS 14 H LYS 14 2.944 -10.849 2.770
116 HA LYS 14 HA LYS 14 1.696 -11.581 5.094
117 HB2 LYS 14 2HB LYS 14 4.390 -10.551 4.421
118 HB3 LYS 14 3HB LYS 14 3.939 -10.482 6.119
119 HG2 LYS 14 2HG LYS 14 3.958 -12.943 4.383
120 HG3 LYS 14 3HG LYS 14 5.137 -12.529 5.630
121 HD2 LYS 14 2HD LYS 14 3.851 -13.433 7.204
122 HD3 LYS 14 3HD LYS 14 2.489 -12.418 6.725
123 HE2 LYS 14 2HE LYS 14 2.178 -14.113 4.813
124 HE3 LYS 14 3HE LYS 14 3.229 -15.162 5.763
125 HZ1 LYS 14 1HZ LYS 14 1.472 -14.386 7.612
126 HZ2 LYS 14 2HZ LYS 14 1.295 -15.788 6.683
127 HZ3 LYS 14 3HZ LYS 14 0.481 -14.373 6.241
128 H GLY 15 H GLY 15 3.516 -8.552 5.190
129 HA2 GLY 15 2HA GLY 15 1.536 -7.444 7.007
130 HA3 GLY 15 3HA GLY 15 3.093 -6.738 6.603
131 H GLY 16 H GLY 16 2.487 -7.091 3.682
132 HA2 GLY 16 2HA GLY 16 1.742 -5.710 2.003
133 HA3 GLY 16 3HA GLY 16 0.205 -5.783 2.852
Start of MODEL 15
1 H1 VAL 1 H VAL 1 0.766 0.327 0.124
2 HA VAL 1 HA VAL 1 3.275 0.340 -1.426
3 HB VAL 1 HB VAL 1 2.160 -1.807 0.368
4 HG11 VAL 1 1HG1 VAL 1 4.061 -2.037 -1.926
5 HG12 VAL 1 2HG1 VAL 1 4.243 -3.085 -0.519
6 HG13 VAL 1 3HG1 VAL 1 2.745 -3.109 -1.450
7 HG21 VAL 1 1HG2 VAL 1 3.577 -0.176 1.457
8 HG22 VAL 1 2HG2 VAL 1 4.427 -1.717 1.342
9 HG23 VAL 1 3HG2 VAL 1 4.827 -0.404 0.234
10 H ALA 2 H ALA 2 0.707 -2.079 -1.029
11 HA ALA 2 HA ALA 2 0.176 -1.878 -3.922
12 HB1 ALA 2 1HB ALA 2 -0.174 -4.493 -2.559
13 HB2 ALA 2 2HB ALA 2 0.288 -4.135 -4.223
14 HB3 ALA 2 3HB ALA 2 1.467 -3.960 -2.923
15 H ARG 3 H ARG 3 -1.851 -1.338 -4.359
16 HA ARG 3 HA ARG 3 -3.849 -0.902 -2.513
17 HB2 ARG 3 2HB ARG 3 -5.293 -0.527 -4.310
18 HB3 ARG 3 3HB ARG 3 -3.704 -0.207 -4.992
19 HG2 ARG 3 2HG ARG 3 -3.797 -2.693 -5.723
20 HG3 ARG 3 3HG ARG 3 -5.533 -2.517 -5.464
21 HD2 ARG 3 2HD ARG 3 -5.437 -0.496 -6.963
22 HD3 ARG 3 3HD ARG 3 -3.780 -0.957 -7.350
23 HE ARG 3 HE ARG 3 -5.705 -3.056 -7.759
24 HH11 ARG 3 1HH1 ARG 3 -4.123 -0.293 -9.168
25 HH12 ARG 3 2HH1 ARG 3 -4.379 -0.815 -10.800
26 HH21 ARG 3 1HH2 ARG 3 -6.048 -3.754 -9.904
27 HH22 ARG 3 2HH2 ARG 3 -5.475 -2.783 -11.218
28 H GLY 4 H GLY 4 -2.936 -3.875 -4.089
29 HA2 GLY 4 2HA GLY 4 -5.154 -5.238 -2.688
30 HA3 GLY 4 3HA GLY 4 -4.516 -5.776 -4.235
31 H TRP 5 H TRP 5 -4.288 -6.033 -0.861
32 HA TRP 5 HA TRP 5 -1.853 -7.671 -1.136
33 HB2 TRP 5 2HB TRP 5 -2.625 -5.662 0.925
34 HB3 TRP 5 3HB TRP 5 -1.737 -7.086 1.461
35 HD1 TRP 5 HD1 TRP 5 -0.852 -3.796 0.962
36 HE1 TRP 5 HE1 TRP 5 1.467 -3.460 -0.103
37 HE3 TRP 5 HE3 TRP 5 -0.166 -8.474 -0.983
38 HZ2 TRP 5 HZ2 TRP 5 3.339 -4.978 -1.572
39 HZ3 TRP 5 HZ3 TRP 5 1.916 -8.950 -2.204
40 HH2 TRP 5 HH2 TRP 5 3.631 -7.237 -2.492
41 H LYS 6 H LYS 6 -4.096 -7.246 1.574
42 HA LYS 6 HA LYS 6 -4.226 -9.672 2.626
43 HB2 LYS 6 2HB LYS 6 -6.760 -9.318 2.911
44 HB3 LYS 6 3HB LYS 6 -5.678 -8.097 3.569
45 HG2 LYS 6 2HG LYS 6 -6.043 -6.762 1.495
46 HG3 LYS 6 3HG LYS 6 -7.266 -7.943 1.018
47 HD2 LYS 6 2HD LYS 6 -7.468 -6.737 3.728
48 HD3 LYS 6 3HD LYS 6 -7.892 -5.732 2.340
49 HE2 LYS 6 2HE LYS 6 -9.505 -7.400 1.606
50 HE3 LYS 6 3HE LYS 6 -9.052 -8.451 2.947
51 HZ1 LYS 6 1HZ LYS 6 -10.983 -6.454 2.931
52 HZ2 LYS 6 2HZ LYS 6 -9.741 -5.908 3.941
53 HZ3 LYS 6 3HZ LYS 6 -10.483 -7.398 4.243
54 H ARG 7 H ARG 7 -6.113 -8.793 -0.262
55 HA ARG 7 HA ARG 7 -6.939 -11.532 -0.669
56 HB2 ARG 7 2HB ARG 7 -7.445 -8.929 -2.063
57 HB3 ARG 7 3HB ARG 7 -7.801 -10.440 -2.890
58 HG2 ARG 7 2HG ARG 7 -9.290 -11.085 -1.054
59 HG3 ARG 7 3HG ARG 7 -8.947 -9.552 -0.251
60 HD2 ARG 7 2HD ARG 7 -9.688 -8.668 -2.690
61 HD3 ARG 7 3HD ARG 7 -10.656 -10.138 -2.580
62 HE ARG 7 HE ARG 7 -11.073 -7.705 -1.157
63 HH11 ARG 7 1HH1 ARG 7 -11.403 -11.164 -0.936
64 HH12 ARG 7 2HH1 ARG 7 -12.704 -11.097 0.206
65 HH21 ARG 7 1HH2 ARG 7 -12.785 -7.605 0.347
66 HH22 ARG 7 2HH2 ARG 7 -13.490 -9.073 0.935
67 H LYS 8 H LYS 8 -5.511 -9.291 -3.029
68 HA LYS 8 HA LYS 8 -4.226 -11.453 -4.411
69 HB2 LYS 8 2HB LYS 8 -3.990 -8.463 -4.800
70 HB3 LYS 8 3HB LYS 8 -3.365 -9.684 -5.901
71 HG2 LYS 8 2HG LYS 8 -6.244 -9.822 -5.229
72 HG3 LYS 8 3HG LYS 8 -5.711 -8.490 -6.258
73 HD2 LYS 8 2HD LYS 8 -6.079 -10.029 -7.886
74 HD3 LYS 8 3HD LYS 8 -4.428 -10.495 -7.470
75 HE2 LYS 8 2HE LYS 8 -5.258 -12.240 -6.009
76 HE3 LYS 8 3HE LYS 8 -6.920 -11.735 -6.308
77 HZ1 LYS 8 1HZ LYS 8 -5.322 -13.504 -7.808
78 HZ2 LYS 8 2HZ LYS 8 -5.748 -12.191 -8.784
79 HZ3 LYS 8 3HZ LYS 8 -6.952 -13.107 -8.027
80 H CYS 9 H CYS 9 -2.393 -12.349 -3.760
81 HA CYS 9 HA CYS 9 -0.409 -10.657 -2.388
82 HB2 CYS 9 2HB CYS 9 0.422 -12.837 -1.408
83 HB3 CYS 9 3HB CYS 9 -1.162 -12.312 -0.850
84 HG CYS 9 HG CYS 9 -2.576 -14.287 -1.822
85 HA PRO 10 HA PRO 10 1.423 -11.985 -6.443
86 HB2 PRO 10 2HB PRO 10 2.465 -9.550 -7.035
87 HB3 PRO 10 3HB PRO 10 0.810 -10.013 -7.448
88 HG2 PRO 10 2HG PRO 10 1.801 -8.378 -5.144
89 HG3 PRO 10 3HG PRO 10 0.394 -8.103 -6.189
90 HD2 PRO 10 2HD PRO 10 0.183 -9.187 -3.717
91 HD3 PRO 10 3HD PRO 10 -0.909 -9.622 -5.047
92 H LEU 11 H LEU 11 2.773 -9.825 -3.960
93 HA LEU 11 HA LEU 11 5.340 -11.246 -4.242
94 HB2 LEU 11 2HB LEU 11 5.703 -8.742 -2.946
95 HB3 LEU 11 3HB LEU 11 6.373 -9.304 -4.477
96 HG LEU 11 HG LEU 11 3.644 -8.053 -4.277
97 HD11 LEU 11 1HD1 LEU 11 6.290 -6.793 -4.144
98 HD12 LEU 11 2HD1 LEU 11 4.708 -6.173 -3.673
99 HD13 LEU 11 3HD1 LEU 11 5.206 -6.122 -5.364
100 HD21 LEU 11 1HD2 LEU 11 4.638 -9.459 -6.289
101 HD22 LEU 11 2HD2 LEU 11 5.410 -7.917 -6.661
102 HD23 LEU 11 3HD2 LEU 11 3.652 -8.022 -6.555
103 H PHE 12 H PHE 12 4.131 -8.967 -1.805
104 HA PHE 12 HA PHE 12 4.457 -11.086 0.217
105 HB2 PHE 12 2HB PHE 12 4.777 -8.659 1.553
106 HB3 PHE 12 3HB PHE 12 6.048 -9.805 1.139
107 HD1 PHE 12 HD1 PHE 12 4.395 -6.675 0.195
108 HD2 PHE 12 HD2 PHE 12 7.565 -9.381 -0.670
109 HE1 PHE 12 HE1 PHE 12 5.443 -4.980 -1.248
110 HE2 PHE 12 HE2 PHE 12 8.619 -7.690 -2.114
111 HZ PHE 12 HZ PHE 12 7.559 -5.486 -2.404
112 H GLY 13 H GLY 13 2.237 -11.596 0.115
113 HA2 GLY 13 2HA GLY 13 0.278 -9.526 0.650
114 HA3 GLY 13 3HA GLY 13 -0.048 -11.235 0.402
115 H LYS 14 H LYS 14 2.361 -11.242 2.569
116 HA LYS 14 HA LYS 14 0.521 -11.647 4.782
117 HB2 LYS 14 2HB LYS 14 2.094 -13.368 4.675
118 HB3 LYS 14 3HB LYS 14 3.415 -12.270 4.296
119 HG2 LYS 14 2HG LYS 14 2.458 -11.513 6.827
120 HG3 LYS 14 3HG LYS 14 2.570 -13.275 6.833
121 HD2 LYS 14 2HD LYS 14 4.712 -12.783 7.432
122 HD3 LYS 14 3HD LYS 14 4.905 -12.742 5.678
123 HE2 LYS 14 2HE LYS 14 5.955 -10.806 6.739
124 HE3 LYS 14 3HE LYS 14 4.622 -10.322 5.693
125 HZ1 LYS 14 1HZ LYS 14 3.284 -9.815 7.498
126 HZ2 LYS 14 2HZ LYS 14 4.802 -9.264 7.998
127 HZ3 LYS 14 3HZ LYS 14 4.201 -10.732 8.584
128 H GLY 15 H GLY 15 3.175 -9.511 3.868
129 HA2 GLY 15 2HA GLY 15 2.639 -7.920 6.299
130 HA3 GLY 15 3HA GLY 15 4.191 -7.971 5.476
131 H GLY 16 H GLY 16 1.102 -7.737 3.821
132 HA2 GLY 16 2HA GLY 16 1.812 -5.688 2.120
133 HA3 GLY 16 3HA GLY 16 0.156 -6.044 2.586
Start of MODEL 16
1 H1 VAL 1 H VAL 1 1.455 1.278 -0.031
2 HA VAL 1 HA VAL 1 2.530 0.809 -2.112
3 HB VAL 1 HB VAL 1 3.918 -0.382 -0.775
4 HG11 VAL 1 1HG1 VAL 1 2.782 -0.857 1.135
5 HG12 VAL 1 2HG1 VAL 1 1.409 -1.558 0.276
6 HG13 VAL 1 3HG1 VAL 1 2.891 -2.492 0.483
7 HG21 VAL 1 1HG2 VAL 1 3.467 -1.673 -2.950
8 HG22 VAL 1 2HG2 VAL 1 4.326 -2.507 -1.654
9 HG23 VAL 1 3HG2 VAL 1 2.613 -2.826 -1.924
10 H ALA 2 H ALA 2 0.454 -1.976 -1.287
11 HA ALA 2 HA ALA 2 -0.285 -2.140 -4.136
12 HB1 ALA 2 1HB ALA 2 0.177 -4.336 -4.256
13 HB2 ALA 2 2HB ALA 2 1.234 -4.000 -2.884
14 HB3 ALA 2 3HB ALA 2 -0.383 -4.651 -2.613
15 H ARG 3 H ARG 3 -2.381 -1.844 -4.466
16 HA ARG 3 HA ARG 3 -4.267 -1.494 -2.439
17 HB2 ARG 3 2HB ARG 3 -5.842 -1.179 -4.126
18 HB3 ARG 3 3HB ARG 3 -4.330 -0.765 -4.922
19 HG2 ARG 3 2HG ARG 3 -4.343 -3.259 -5.657
20 HG3 ARG 3 3HG ARG 3 -6.065 -3.163 -5.286
21 HD2 ARG 3 2HD ARG 3 -4.999 -0.945 -6.897
22 HD3 ARG 3 3HD ARG 3 -4.974 -2.523 -7.682
23 HE ARG 3 HE ARG 3 -7.498 -2.075 -6.504
24 HH11 ARG 3 1HH1 ARG 3 -5.524 -1.045 -9.180
25 HH12 ARG 3 2HH1 ARG 3 -6.873 -0.642 -10.189
26 HH21 ARG 3 1HH2 ARG 3 -9.283 -1.549 -7.823
27 HH22 ARG 3 2HH2 ARG 3 -9.011 -0.928 -9.416
28 H GLY 4 H GLY 4 -3.223 -4.365 -4.111
29 HA2 GLY 4 2HA GLY 4 -5.336 -5.914 -2.752
30 HA3 GLY 4 3HA GLY 4 -4.501 -6.429 -4.210
31 H TRP 5 H TRP 5 -4.473 -6.376 -0.778
32 HA TRP 5 HA TRP 5 -1.961 -7.917 -0.797
33 HB2 TRP 5 2HB TRP 5 -2.883 -5.739 1.028
34 HB3 TRP 5 3HB TRP 5 -1.897 -7.035 1.697
35 HD1 TRP 5 HD1 TRP 5 -1.266 -3.751 0.838
36 HE1 TRP 5 HE1 TRP 5 1.032 -3.360 -0.254
37 HE3 TRP 5 HE3 TRP 5 -0.204 -8.552 -0.561
38 HZ2 TRP 5 HZ2 TRP 5 3.030 -4.884 -1.539
39 HZ3 TRP 5 HZ3 TRP 5 1.921 -9.001 -1.717
40 HH2 TRP 5 HH2 TRP 5 3.503 -7.204 -2.196
41 H LYS 6 H LYS 6 -4.311 -7.267 1.777
42 HA LYS 6 HA LYS 6 -4.386 -9.526 3.136
43 HB2 LYS 6 2HB LYS 6 -7.023 -9.282 3.063
44 HB3 LYS 6 3HB LYS 6 -6.013 -8.094 3.876
45 HG2 LYS 6 2HG LYS 6 -6.505 -7.575 1.027
46 HG3 LYS 6 3HG LYS 6 -7.926 -7.492 2.071
47 HD2 LYS 6 2HD LYS 6 -5.715 -6.160 3.325
48 HD3 LYS 6 3HD LYS 6 -5.944 -5.531 1.692
49 HE2 LYS 6 2HE LYS 6 -8.218 -5.855 3.631
50 HE3 LYS 6 3HE LYS 6 -7.237 -4.391 3.565
51 HZ1 LYS 6 1HZ LYS 6 -7.904 -4.815 0.973
52 HZ2 LYS 6 2HZ LYS 6 -8.675 -3.731 2.017
53 HZ3 LYS 6 3HZ LYS 6 -9.309 -5.283 1.791
54 H ARG 7 H ARG 7 -6.164 -9.174 0.070
55 HA ARG 7 HA ARG 7 -6.732 -12.018 0.009
56 HB2 ARG 7 2HB ARG 7 -7.579 -11.137 -2.399
57 HB3 ARG 7 3HB ARG 7 -8.547 -11.049 -0.934
58 HG2 ARG 7 2HG ARG 7 -8.159 -8.775 -0.662
59 HG3 ARG 7 3HG ARG 7 -6.739 -8.796 -1.710
60 HD2 ARG 7 2HD ARG 7 -7.977 -8.359 -3.506
61 HD3 ARG 7 3HD ARG 7 -9.075 -9.689 -3.138
62 HE ARG 7 HE ARG 7 -9.662 -7.541 -1.437
63 HH11 ARG 7 1HH1 ARG 7 -9.850 -8.407 -4.804
64 HH12 ARG 7 2HH1 ARG 7 -11.215 -7.389 -5.124
65 HH21 ARG 7 1HH2 ARG 7 -11.459 -6.197 -1.846
66 HH22 ARG 7 2HH2 ARG 7 -12.128 -6.131 -3.441
67 H LYS 8 H LYS 8 -5.538 -9.916 -2.596
68 HA LYS 8 HA LYS 8 -4.068 -12.042 -3.797
69 HB2 LYS 8 2HB LYS 8 -3.822 -9.084 -4.361
70 HB3 LYS 8 3HB LYS 8 -3.366 -10.407 -5.426
71 HG2 LYS 8 2HG LYS 8 -6.166 -9.718 -4.558
72 HG3 LYS 8 3HG LYS 8 -5.451 -9.391 -6.138
73 HD2 LYS 8 2HD LYS 8 -5.816 -12.137 -4.939
74 HD3 LYS 8 3HD LYS 8 -6.896 -11.400 -6.125
75 HE2 LYS 8 2HE LYS 8 -4.932 -11.191 -7.658
76 HE3 LYS 8 3HE LYS 8 -3.993 -12.123 -6.493
77 HZ1 LYS 8 1HZ LYS 8 -5.849 -13.842 -6.740
78 HZ2 LYS 8 2HZ LYS 8 -4.735 -13.697 -8.005
79 HZ3 LYS 8 3HZ LYS 8 -6.271 -13.005 -8.149
80 H CYS 9 H CYS 9 -2.230 -12.821 -3.015
81 HA CYS 9 HA CYS 9 -0.351 -10.958 -1.721
82 HB2 CYS 9 2HB CYS 9 -0.430 -13.946 -1.309
83 HB3 CYS 9 3HB CYS 9 0.425 -12.746 -0.347
84 HG CYS 9 HG CYS 9 -2.949 -13.285 -0.438
85 HA PRO 10 HA PRO 10 1.627 -12.444 -5.654
86 HB2 PRO 10 2HB PRO 10 2.542 -9.998 -6.395
87 HB3 PRO 10 3HB PRO 10 0.924 -10.583 -6.803
88 HG2 PRO 10 2HG PRO 10 1.774 -8.742 -4.601
89 HG3 PRO 10 3HG PRO 10 0.376 -8.619 -5.685
90 HD2 PRO 10 2HD PRO 10 0.176 -9.544 -3.148
91 HD3 PRO 10 3HD PRO 10 -0.863 -10.130 -4.463
92 H LEU 11 H LEU 11 2.857 -9.929 -3.443
93 HA LEU 11 HA LEU 11 5.477 -11.274 -3.515
94 HB2 LEU 11 2HB LEU 11 5.710 -8.643 -2.474
95 HB3 LEU 11 3HB LEU 11 6.413 -9.316 -3.944
96 HG LEU 11 HG LEU 11 3.624 -8.196 -3.877
97 HD11 LEU 11 1HD1 LEU 11 5.118 -6.288 -5.112
98 HD12 LEU 11 2HD1 LEU 11 6.186 -6.780 -3.798
99 HD13 LEU 11 3HD1 LEU 11 4.556 -6.207 -3.443
100 HD21 LEU 11 1HD2 LEU 11 4.735 -9.710 -5.748
101 HD22 LEU 11 2HD2 LEU 11 5.415 -8.159 -6.244
102 HD23 LEU 11 3HD2 LEU 11 3.665 -8.365 -6.147
103 H PHE 12 H PHE 12 4.151 -8.817 -1.330
104 HA PHE 12 HA PHE 12 4.533 -10.709 0.897
105 HB2 PHE 12 2HB PHE 12 4.749 -8.190 2.023
106 HB3 PHE 12 3HB PHE 12 6.086 -9.273 1.651
107 HD1 PHE 12 HD1 PHE 12 4.175 -6.354 0.506
108 HD2 PHE 12 HD2 PHE 12 7.563 -8.840 -0.173
109 HE1 PHE 12 HE1 PHE 12 5.076 -4.691 -1.068
110 HE2 PHE 12 HE2 PHE 12 8.470 -7.180 -1.747
111 HZ PHE 12 HZ PHE 12 7.227 -5.102 -2.195
112 H GLY 13 H GLY 13 2.344 -11.325 0.850
113 HA2 GLY 13 2HA GLY 13 0.342 -9.238 1.294
114 HA3 GLY 13 3HA GLY 13 0.017 -10.930 0.949
115 H LYS 14 H LYS 14 2.403 -10.840 3.230
116 HA LYS 14 HA LYS 14 0.764 -11.878 5.276
117 HB2 LYS 14 2HB LYS 14 3.544 -10.720 5.538
118 HB3 LYS 14 3HB LYS 14 2.760 -11.816 6.668
119 HG2 LYS 14 2HG LYS 14 3.146 -13.637 5.386
120 HG3 LYS 14 3HG LYS 14 2.992 -12.743 3.873
121 HD2 LYS 14 2HD LYS 14 5.218 -11.624 4.606
122 HD3 LYS 14 3HD LYS 14 5.364 -13.018 5.679
123 HE2 LYS 14 2HE LYS 14 4.786 -14.329 3.454
124 HE3 LYS 14 3HE LYS 14 5.454 -12.878 2.709
125 HZ1 LYS 14 1HZ LYS 14 6.833 -15.033 3.835
126 HZ2 LYS 14 2HZ LYS 14 7.158 -13.672 4.784
127 HZ3 LYS 14 3HZ LYS 14 7.475 -13.639 3.123
128 H GLY 15 H GLY 15 2.308 -8.699 4.880
129 HA2 GLY 15 2HA GLY 15 0.498 -7.685 6.986
130 HA3 GLY 15 3HA GLY 15 2.133 -7.083 6.754
131 H GLY 16 H GLY 16 1.888 -7.134 3.819
132 HA2 GLY 16 2HA GLY 16 1.400 -5.601 2.178
133 HA3 GLY 16 3HA GLY 16 -0.238 -5.684 2.812
Start of MODEL 17
1 H1 VAL 1 H VAL 1 0.209 1.478 1.261
2 HA VAL 1 HA VAL 1 2.268 0.513 0.603
3 HB VAL 1 HB VAL 1 0.816 -2.132 0.772
4 HG11 VAL 1 1HG1 VAL 1 3.747 -2.078 0.707
5 HG12 VAL 1 2HG1 VAL 1 2.611 -3.142 -0.124
6 HG13 VAL 1 3HG1 VAL 1 2.970 -1.546 -0.783
7 HG21 VAL 1 1HG2 VAL 1 2.800 -0.819 2.622
8 HG22 VAL 1 2HG2 VAL 1 1.135 -1.273 2.983
9 HG23 VAL 1 3HG2 VAL 1 2.349 -2.522 2.708
10 H ALA 2 H ALA 2 -0.260 -1.610 -0.724
11 HA ALA 2 HA ALA 2 0.172 -0.347 -3.351
12 HB1 ALA 2 1HB ALA 2 -0.354 -3.283 -2.932
13 HB2 ALA 2 2HB ALA 2 0.067 -2.466 -4.438
14 HB3 ALA 2 3HB ALA 2 1.256 -2.593 -3.141
15 H ARG 3 H ARG 3 -1.870 -2.797 -3.878
16 HA ARG 3 HA ARG 3 -4.264 -1.205 -3.230
17 HB2 ARG 3 2HB ARG 3 -5.126 -2.514 -5.388
18 HB3 ARG 3 3HB ARG 3 -4.311 -0.960 -5.496
19 HG2 ARG 3 2HG ARG 3 -2.581 -3.349 -5.551
20 HG3 ARG 3 3HG ARG 3 -3.622 -3.093 -6.953
21 HD2 ARG 3 2HD ARG 3 -2.553 -1.169 -7.568
22 HD3 ARG 3 3HD ARG 3 -2.091 -0.770 -5.914
23 HE ARG 3 HE ARG 3 -0.111 -1.826 -6.290
24 HH11 ARG 3 1HH1 ARG 3 -2.459 -3.060 -8.544
25 HH12 ARG 3 2HH1 ARG 3 -1.320 -4.059 -9.385
26 HH21 ARG 3 1HH2 ARG 3 1.398 -3.138 -7.388
27 HH22 ARG 3 2HH2 ARG 3 0.873 -4.103 -8.725
28 H GLY 4 H GLY 4 -3.669 -4.458 -4.566
29 HA2 GLY 4 2HA GLY 4 -5.598 -5.516 -2.621
30 HA3 GLY 4 3HA GLY 4 -5.084 -6.317 -4.098
31 H TRP 5 H TRP 5 -4.490 -5.861 -0.746
32 HA TRP 5 HA TRP 5 -2.151 -7.647 -0.914
33 HB2 TRP 5 2HB TRP 5 -2.816 -5.405 0.968
34 HB3 TRP 5 3HB TRP 5 -1.732 -6.697 1.476
35 HD1 TRP 5 HD1 TRP 5 -1.307 -3.394 0.473
36 HE1 TRP 5 HE1 TRP 5 0.817 -2.989 -0.924
37 HE3 TRP 5 HE3 TRP 5 -0.321 -8.213 -0.919
38 HZ2 TRP 5 HZ2 TRP 5 2.665 -4.512 -2.419
39 HZ3 TRP 5 HZ3 TRP 5 1.644 -8.654 -2.333
40 HH2 TRP 5 HH2 TRP 5 3.104 -6.840 -3.067
41 H LYS 6 H LYS 6 -4.222 -6.761 1.822
42 HA LYS 6 HA LYS 6 -4.307 -8.951 3.283
43 HB2 LYS 6 2HB LYS 6 -6.804 -8.576 3.639
44 HB3 LYS 6 3HB LYS 6 -5.748 -7.200 3.929
45 HG2 LYS 6 2HG LYS 6 -6.289 -6.417 1.610
46 HG3 LYS 6 3HG LYS 6 -7.509 -7.691 1.542
47 HD2 LYS 6 2HD LYS 6 -8.112 -6.511 3.913
48 HD3 LYS 6 3HD LYS 6 -7.523 -5.129 2.986
49 HE2 LYS 6 2HE LYS 6 -9.530 -7.035 1.833
50 HE3 LYS 6 3HE LYS 6 -10.031 -5.709 2.880
51 HZ1 LYS 6 1HZ LYS 6 -8.413 -4.467 1.132
52 HZ2 LYS 6 2HZ LYS 6 -10.095 -4.554 0.983
53 HZ3 LYS 6 3HZ LYS 6 -9.115 -5.648 0.145
54 H ARG 7 H ARG 7 -6.305 -8.635 0.353
55 HA ARG 7 HA ARG 7 -7.034 -11.439 0.475
56 HB2 ARG 7 2HB ARG 7 -7.697 -9.269 -1.523
57 HB3 ARG 7 3HB ARG 7 -8.307 -10.916 -1.611
58 HG2 ARG 7 2HG ARG 7 -9.634 -10.655 0.288
59 HG3 ARG 7 3HG ARG 7 -8.746 -9.227 0.822
60 HD2 ARG 7 2HD ARG 7 -10.133 -7.894 -0.288
61 HD3 ARG 7 3HD ARG 7 -9.828 -8.768 -1.789
62 HE ARG 7 HE ARG 7 -12.103 -9.044 -0.049
63 HH11 ARG 7 1HH1 ARG 7 -10.159 -10.570 -2.502
64 HH12 ARG 7 2HH1 ARG 7 -11.423 -11.633 -3.026
65 HH21 ARG 7 1HH2 ARG 7 -13.775 -10.439 -0.731
66 HH22 ARG 7 2HH2 ARG 7 -13.479 -11.557 -2.019
67 H LYS 8 H LYS 8 -5.711 -9.423 -2.155
68 HA LYS 8 HA LYS 8 -4.520 -11.728 -3.407
69 HB2 LYS 8 2HB LYS 8 -4.437 -8.782 -4.068
70 HB3 LYS 8 3HB LYS 8 -3.647 -10.019 -5.037
71 HG2 LYS 8 2HG LYS 8 -6.494 -10.490 -4.473
72 HG3 LYS 8 3HG LYS 8 -6.137 -9.092 -5.490
73 HD2 LYS 8 2HD LYS 8 -6.264 -10.706 -7.101
74 HD3 LYS 8 3HD LYS 8 -4.550 -10.835 -6.698
75 HE2 LYS 8 2HE LYS 8 -4.887 -12.767 -5.412
76 HE3 LYS 8 3HE LYS 8 -6.626 -12.497 -5.304
77 HZ1 LYS 8 1HZ LYS 8 -6.857 -13.816 -7.049
78 HZ2 LYS 8 2HZ LYS 8 -5.182 -13.962 -7.235
79 HZ3 LYS 8 3HZ LYS 8 -6.011 -12.701 -8.000
80 H CYS 9 H CYS 9 -2.574 -12.518 -2.979
81 HA CYS 9 HA CYS 9 -0.569 -10.730 -1.768
82 HB2 CYS 9 2HB CYS 9 -0.792 -13.706 -1.295
83 HB3 CYS 9 3HB CYS 9 0.266 -12.572 -0.465
84 HG CYS 9 HG CYS 9 -2.517 -13.634 0.594
85 HA PRO 10 HA PRO 10 1.006 -12.439 -5.818
86 HB2 PRO 10 2HB PRO 10 1.776 -10.039 -6.824
87 HB3 PRO 10 3HB PRO 10 0.144 -10.686 -7.027
88 HG2 PRO 10 2HG PRO 10 1.149 -8.665 -5.061
89 HG3 PRO 10 3HG PRO 10 -0.350 -8.655 -6.009
90 HD2 PRO 10 2HD PRO 10 -0.280 -9.387 -3.404
91 HD3 PRO 10 3HD PRO 10 -1.423 -10.094 -4.564
92 H LEU 11 H LEU 11 2.398 -9.671 -4.041
93 HA LEU 11 HA LEU 11 5.029 -10.979 -4.240
94 HB2 LEU 11 2HB LEU 11 5.256 -8.267 -3.409
95 HB3 LEU 11 3HB LEU 11 5.862 -9.031 -4.877
96 HG LEU 11 HG LEU 11 3.051 -7.984 -4.649
97 HD11 LEU 11 1HD1 LEU 11 5.536 -6.499 -4.842
98 HD12 LEU 11 2HD1 LEU 11 3.892 -5.925 -4.565
99 HD13 LEU 11 3HD1 LEU 11 4.464 -6.202 -6.211
100 HD21 LEU 11 1HD2 LEU 11 4.041 -9.637 -6.479
101 HD22 LEU 11 2HD2 LEU 11 4.599 -8.116 -7.176
102 HD23 LEU 11 3HD2 LEU 11 2.878 -8.373 -6.882
103 H PHE 12 H PHE 12 3.883 -8.397 -2.102
104 HA PHE 12 HA PHE 12 4.534 -10.121 0.197
105 HB2 PHE 12 2HB PHE 12 4.818 -7.551 1.143
106 HB3 PHE 12 3HB PHE 12 6.136 -8.607 0.646
107 HD1 PHE 12 HD1 PHE 12 4.026 -5.772 -0.314
108 HD2 PHE 12 HD2 PHE 12 7.306 -8.249 -1.420
109 HE1 PHE 12 HE1 PHE 12 4.653 -4.156 -2.061
110 HE2 PHE 12 HE2 PHE 12 7.938 -6.638 -3.168
111 HZ PHE 12 HZ PHE 12 6.612 -4.588 -3.490
112 H GLY 13 H GLY 13 2.382 -10.780 0.460
113 HA2 GLY 13 2HA GLY 13 0.358 -8.721 0.907
114 HA3 GLY 13 3HA GLY 13 0.076 -10.453 0.808
115 H LYS 14 H LYS 14 2.477 -10.702 2.729
116 HA LYS 14 HA LYS 14 0.958 -10.999 5.088
117 HB2 LYS 14 2HB LYS 14 3.964 -10.829 4.821
118 HB3 LYS 14 3HB LYS 14 3.077 -11.511 6.177
119 HG2 LYS 14 2HG LYS 14 2.613 -13.440 5.085
120 HG3 LYS 14 3HG LYS 14 2.527 -12.656 3.506
121 HD2 LYS 14 2HD LYS 14 5.096 -12.319 3.862
122 HD3 LYS 14 3HD LYS 14 4.912 -13.645 5.011
123 HE2 LYS 14 2HE LYS 14 3.514 -14.446 2.731
124 HE3 LYS 14 3HE LYS 14 4.995 -13.705 2.127
125 HZ1 LYS 14 1HZ LYS 14 4.629 -16.181 3.547
126 HZ2 LYS 14 2HZ LYS 14 5.882 -15.230 4.168
127 HZ3 LYS 14 3HZ LYS 14 5.897 -15.689 2.540
128 H GLY 15 H GLY 15 3.380 -8.571 4.135
129 HA2 GLY 15 2HA GLY 15 2.491 -6.921 6.415
130 HA3 GLY 15 3HA GLY 15 4.069 -6.804 5.650
131 H GLY 16 H GLY 16 1.307 -7.177 3.612
132 HA2 GLY 16 2HA GLY 16 1.798 -4.970 2.034
133 HA3 GLY 16 3HA GLY 16 0.223 -5.734 2.190
Start of MODEL 18
1 H1 VAL 1 H VAL 1 1.174 0.846 -1.337
2 HA VAL 1 HA VAL 1 2.624 0.712 -3.122
3 HB VAL 1 HB VAL 1 4.356 -0.367 -1.919
4 HG11 VAL 1 1HG1 VAL 1 2.834 -2.962 -2.085
5 HG12 VAL 1 2HG1 VAL 1 4.340 -2.654 -1.219
6 HG13 VAL 1 3HG1 VAL 1 2.838 -1.909 -0.670
7 HG21 VAL 1 1HG2 VAL 1 3.959 -0.823 -4.541
8 HG22 VAL 1 2HG2 VAL 1 5.385 -1.374 -3.661
9 HG23 VAL 1 3HG2 VAL 1 4.045 -2.483 -3.951
10 H ALA 2 H ALA 2 1.028 -2.363 -2.314
11 HA ALA 2 HA ALA 2 0.007 -2.449 -5.077
12 HB1 ALA 2 1HB ALA 2 0.868 -4.469 -5.386
13 HB2 ALA 2 2HB ALA 2 1.684 -4.325 -3.829
14 HB3 ALA 2 3HB ALA 2 0.088 -5.069 -3.922
15 H ARG 3 H ARG 3 -1.965 -1.514 -4.566
16 HA ARG 3 HA ARG 3 -3.655 -1.665 -2.548
17 HB2 ARG 3 2HB ARG 3 -3.967 -1.265 -5.307
18 HB3 ARG 3 3HB ARG 3 -5.186 -2.454 -4.869
19 HG2 ARG 3 2HG ARG 3 -6.413 -0.964 -3.731
20 HG3 ARG 3 3HG ARG 3 -4.996 -0.168 -3.044
21 HD2 ARG 3 2HD ARG 3 -4.733 0.572 -5.611
22 HD3 ARG 3 3HD ARG 3 -6.486 0.406 -5.531
23 HE ARG 3 HE ARG 3 -6.570 2.283 -4.221
24 HH11 ARG 3 1HH1 ARG 3 -3.293 1.116 -4.341
25 HH12 ARG 3 2HH1 ARG 3 -2.632 2.500 -3.535
26 HH21 ARG 3 1HH2 ARG 3 -5.713 4.110 -3.159
27 HH22 ARG 3 2HH2 ARG 3 -4.010 4.202 -2.862
28 H GLY 4 H GLY 4 -3.518 -4.292 -4.963
29 HA2 GLY 4 2HA GLY 4 -5.234 -6.012 -3.475
30 HA3 GLY 4 3HA GLY 4 -4.238 -6.475 -4.847
31 H TRP 5 H TRP 5 -4.308 -6.053 -1.364
32 HA TRP 5 HA TRP 5 -1.887 -7.724 -1.181
33 HB2 TRP 5 2HB TRP 5 -2.811 -5.383 0.430
34 HB3 TRP 5 3HB TRP 5 -1.878 -6.643 1.234
35 HD1 TRP 5 HD1 TRP 5 -1.130 -3.456 0.153
36 HE1 TRP 5 HE1 TRP 5 1.206 -3.206 -0.900
37 HE3 TRP 5 HE3 TRP 5 -0.167 -8.373 -0.865
38 HZ2 TRP 5 HZ2 TRP 5 3.193 -4.872 -2.015
39 HZ3 TRP 5 HZ3 TRP 5 1.974 -8.960 -1.927
40 HH2 TRP 5 HH2 TRP 5 3.617 -7.245 -2.489
41 H LYS 6 H LYS 6 -4.254 -6.816 1.290
42 HA LYS 6 HA LYS 6 -4.431 -8.978 2.793
43 HB2 LYS 6 2HB LYS 6 -6.961 -8.634 2.901
44 HB3 LYS 6 3HB LYS 6 -5.949 -7.246 3.281
45 HG2 LYS 6 2HG LYS 6 -6.264 -6.504 0.897
46 HG3 LYS 6 3HG LYS 6 -7.485 -7.771 0.752
47 HD2 LYS 6 2HD LYS 6 -7.875 -6.149 3.126
48 HD3 LYS 6 3HD LYS 6 -7.888 -5.178 1.651
49 HE2 LYS 6 2HE LYS 6 -9.422 -7.708 1.596
50 HE3 LYS 6 3HE LYS 6 -10.059 -6.420 2.617
51 HZ1 LYS 6 1HZ LYS 6 -10.574 -6.646 0.011
52 HZ2 LYS 6 2HZ LYS 6 -9.240 -5.607 -0.041
53 HZ3 LYS 6 3HZ LYS 6 -10.613 -5.177 0.849
54 H ARG 7 H ARG 7 -6.193 -8.750 -0.295
55 HA ARG 7 HA ARG 7 -6.948 -11.532 -0.184
56 HB2 ARG 7 2HB ARG 7 -7.291 -9.401 -2.295
57 HB3 ARG 7 3HB ARG 7 -7.856 -11.055 -2.491
58 HG2 ARG 7 2HG ARG 7 -9.281 -10.777 -0.502
59 HG3 ARG 7 3HG ARG 7 -8.752 -9.097 -0.387
60 HD2 ARG 7 2HD ARG 7 -10.149 -8.442 -2.003
61 HD3 ARG 7 3HD ARG 7 -9.708 -9.796 -3.043
62 HE ARG 7 HE ARG 7 -12.010 -9.599 -1.374
63 HH11 ARG 7 1HH1 ARG 7 -9.704 -11.839 -2.709
64 HH12 ARG 7 2HH1 ARG 7 -10.786 -13.190 -2.650
65 HH21 ARG 7 1HH2 ARG 7 -13.445 -11.370 -1.291
66 HH22 ARG 7 2HH2 ARG 7 -12.914 -12.923 -1.844
67 H LYS 8 H LYS 8 -5.403 -9.788 -2.868
68 HA LYS 8 HA LYS 8 -4.016 -12.159 -3.702
69 HB2 LYS 8 2HB LYS 8 -4.574 -9.518 -4.783
70 HB3 LYS 8 3HB LYS 8 -2.916 -10.014 -5.095
71 HG2 LYS 8 2HG LYS 8 -3.962 -10.851 -6.942
72 HG3 LYS 8 3HG LYS 8 -4.055 -12.245 -5.864
73 HD2 LYS 8 2HD LYS 8 -6.314 -10.637 -5.331
74 HD3 LYS 8 3HD LYS 8 -6.177 -10.768 -7.086
75 HE2 LYS 8 2HE LYS 8 -6.043 -13.139 -5.234
76 HE3 LYS 8 3HE LYS 8 -7.546 -12.557 -5.950
77 HZ1 LYS 8 1HZ LYS 8 -5.872 -12.758 -8.074
78 HZ2 LYS 8 2HZ LYS 8 -7.039 -13.900 -7.635
79 HZ3 LYS 8 3HZ LYS 8 -5.435 -14.096 -7.136
80 H CYS 9 H CYS 9 -2.140 -12.845 -2.931
81 HA CYS 9 HA CYS 9 -0.299 -10.871 -1.751
82 HB2 CYS 9 2HB CYS 9 0.543 -12.821 -0.368
83 HB3 CYS 9 3HB CYS 9 -1.076 -12.252 0.022
84 HG CYS 9 HG CYS 9 -0.824 -14.813 -2.172
85 HA PRO 10 HA PRO 10 1.771 -12.838 -5.417
86 HB2 PRO 10 2HB PRO 10 2.739 -10.508 -6.420
87 HB3 PRO 10 3HB PRO 10 1.127 -11.123 -6.803
88 HG2 PRO 10 2HG PRO 10 1.935 -9.037 -4.814
89 HG3 PRO 10 3HG PRO 10 0.571 -9.034 -5.947
90 HD2 PRO 10 2HD PRO 10 0.285 -9.643 -3.325
91 HD3 PRO 10 3HD PRO 10 -0.722 -10.375 -4.590
92 H LEU 11 H LEU 11 2.973 -10.078 -3.501
93 HA LEU 11 HA LEU 11 5.584 -11.434 -3.347
94 HB2 LEU 11 2HB LEU 11 5.787 -8.711 -2.565
95 HB3 LEU 11 3HB LEU 11 6.537 -9.527 -3.936
96 HG LEU 11 HG LEU 11 3.750 -8.402 -4.064
97 HD11 LEU 11 1HD1 LEU 11 6.324 -7.002 -4.087
98 HD12 LEU 11 2HD1 LEU 11 4.695 -6.384 -3.819
99 HD13 LEU 11 3HD1 LEU 11 5.279 -6.645 -5.462
100 HD21 LEU 11 1HD2 LEU 11 4.919 -10.114 -5.734
101 HD22 LEU 11 2HD2 LEU 11 5.579 -8.614 -6.386
102 HD23 LEU 11 3HD2 LEU 11 3.832 -8.841 -6.290
103 H PHE 12 H PHE 12 4.193 -8.779 -1.452
104 HA PHE 12 HA PHE 12 4.515 -10.441 0.960
105 HB2 PHE 12 2HB PHE 12 4.692 -7.796 1.808
106 HB3 PHE 12 3HB PHE 12 6.027 -8.933 1.646
107 HD1 PHE 12 HD1 PHE 12 4.257 -6.130 0.084
108 HD2 PHE 12 HD2 PHE 12 7.582 -8.774 -0.170
109 HE1 PHE 12 HE1 PHE 12 5.271 -4.685 -1.630
110 HE2 PHE 12 HE2 PHE 12 8.602 -7.333 -1.884
111 HZ PHE 12 HZ PHE 12 7.446 -5.285 -2.616
112 H GLY 13 H GLY 13 2.333 -11.064 0.939
113 HA2 GLY 13 2HA GLY 13 0.270 -9.023 0.968
114 HA3 GLY 13 3HA GLY 13 0.024 -10.760 1.066
115 H LYS 14 H LYS 14 2.321 -10.322 3.261
116 HA LYS 14 HA LYS 14 0.452 -10.388 5.457
117 HB2 LYS 14 2HB LYS 14 3.474 -10.438 5.514
118 HB3 LYS 14 3HB LYS 14 2.400 -10.855 6.842
119 HG2 LYS 14 2HG LYS 14 1.915 -12.897 5.995
120 HG3 LYS 14 3HG LYS 14 2.045 -12.356 4.319
121 HD2 LYS 14 2HD LYS 14 4.574 -12.130 4.851
122 HD3 LYS 14 3HD LYS 14 4.210 -13.192 6.214
123 HE2 LYS 14 2HE LYS 14 3.213 -13.972 3.524
124 HE3 LYS 14 3HE LYS 14 4.938 -14.139 3.847
125 HZ1 LYS 14 1HZ LYS 14 2.759 -15.335 5.473
126 HZ2 LYS 14 2HZ LYS 14 4.416 -15.509 5.762
127 HZ3 LYS 14 3HZ LYS 14 3.728 -16.168 4.364
128 H GLY 15 H GLY 15 3.127 -8.277 4.431
129 HA2 GLY 15 2HA GLY 15 2.150 -6.255 6.345
130 HA3 GLY 15 3HA GLY 15 3.794 -6.341 5.730
131 H GLY 16 H GLY 16 0.811 -6.617 3.853
132 HA2 GLY 16 2HA GLY 16 1.601 -5.006 1.759
133 HA3 GLY 16 3HA GLY 16 -0.076 -5.278 2.209
Start of MODEL 19
1 H1 VAL 1 H VAL 1 0.756 -0.991 -0.692
2 HA VAL 1 HA VAL 1 2.470 0.009 -2.242
3 HB VAL 1 HB VAL 1 3.792 -2.185 -3.183
4 HG11 VAL 1 1HG1 VAL 1 5.663 -1.035 -2.600
5 HG12 VAL 1 2HG1 VAL 1 4.475 0.235 -2.301
6 HG13 VAL 1 3HG1 VAL 1 5.097 -0.726 -0.959
7 HG21 VAL 1 1HG2 VAL 1 3.963 -2.450 -0.197
8 HG22 VAL 1 2HG2 VAL 1 2.844 -3.419 -1.156
9 HG23 VAL 1 3HG2 VAL 1 4.581 -3.540 -1.437
10 H ALA 2 H ALA 2 2.035 -3.439 -2.921
11 HA ALA 2 HA ALA 2 0.795 -2.900 -5.432
12 HB1 ALA 2 1HB ALA 2 1.206 -5.055 -5.876
13 HB2 ALA 2 2HB ALA 2 2.127 -5.034 -4.372
14 HB3 ALA 2 3HB ALA 2 0.459 -5.607 -4.376
15 H ARG 3 H ARG 3 -1.167 -1.959 -5.396
16 HA ARG 3 HA ARG 3 -3.146 -1.775 -3.690
17 HB2 ARG 3 2HB ARG 3 -3.022 -1.680 -6.473
18 HB3 ARG 3 3HB ARG 3 -4.339 -2.795 -6.134
19 HG2 ARG 3 2HG ARG 3 -5.685 -1.173 -5.377
20 HG3 ARG 3 3HG ARG 3 -4.377 -0.342 -4.533
21 HD2 ARG 3 2HD ARG 3 -3.600 0.251 -6.963
22 HD3 ARG 3 3HD ARG 3 -5.285 -0.079 -7.363
23 HE ARG 3 HE ARG 3 -5.879 1.874 -6.325
24 HH11 ARG 3 1HH1 ARG 3 -2.625 1.035 -5.415
25 HH12 ARG 3 2HH1 ARG 3 -2.325 2.538 -4.607
26 HH21 ARG 3 1HH2 ARG 3 -5.496 3.857 -5.263
27 HH22 ARG 3 2HH2 ARG 3 -3.958 4.142 -4.520
28 H GLY 4 H GLY 4 -3.044 -4.654 -5.806
29 HA2 GLY 4 2HA GLY 4 -5.009 -6.069 -4.341
30 HA3 GLY 4 3HA GLY 4 -3.900 -6.766 -5.513
31 H TRP 5 H TRP 5 -4.454 -6.053 -2.147
32 HA TRP 5 HA TRP 5 -2.187 -7.808 -1.463
33 HB2 TRP 5 2HB TRP 5 -3.146 -5.274 -0.173
34 HB3 TRP 5 3HB TRP 5 -2.308 -6.490 0.788
35 HD1 TRP 5 HD1 TRP 5 -1.414 -3.413 -0.527
36 HE1 TRP 5 HE1 TRP 5 1.003 -3.301 -1.405
37 HE3 TRP 5 HE3 TRP 5 -0.479 -8.419 -0.972
38 HZ2 TRP 5 HZ2 TRP 5 3.036 -5.097 -2.184
39 HZ3 TRP 5 HZ3 TRP 5 1.727 -9.139 -1.792
40 HH2 TRP 5 HH2 TRP 5 3.446 -7.510 -2.385
41 H LYS 6 H LYS 6 -4.846 -6.452 0.460
42 HA LYS 6 HA LYS 6 -5.419 -8.302 2.222
43 HB2 LYS 6 2HB LYS 6 -6.864 -6.295 1.502
44 HB3 LYS 6 3HB LYS 6 -7.690 -7.435 0.447
45 HG2 LYS 6 2HG LYS 6 -8.948 -8.126 2.128
46 HG3 LYS 6 3HG LYS 6 -7.515 -8.555 3.065
47 HD2 LYS 6 2HD LYS 6 -7.497 -5.878 3.372
48 HD3 LYS 6 3HD LYS 6 -9.232 -6.157 3.205
49 HE2 LYS 6 2HE LYS 6 -9.199 -6.620 5.392
50 HE3 LYS 6 3HE LYS 6 -8.462 -8.152 4.925
51 HZ1 LYS 6 1HZ LYS 6 -7.364 -6.168 6.517
52 HZ2 LYS 6 2HZ LYS 6 -6.488 -6.138 5.071
53 HZ3 LYS 6 3HZ LYS 6 -6.606 -7.574 5.957
54 H ARG 7 H ARG 7 -7.105 -8.645 -0.900
55 HA ARG 7 HA ARG 7 -7.352 -11.501 -0.454
56 HB2 ARG 7 2HB ARG 7 -8.917 -9.593 -1.735
57 HB3 ARG 7 3HB ARG 7 -8.242 -10.543 -3.053
58 HG2 ARG 7 2HG ARG 7 -10.064 -11.810 -2.666
59 HG3 ARG 7 3HG ARG 7 -9.016 -12.533 -1.444
60 HD2 ARG 7 2HD ARG 7 -9.987 -11.194 0.280
61 HD3 ARG 7 3HD ARG 7 -10.880 -10.232 -0.897
62 HE ARG 7 HE ARG 7 -11.586 -12.968 -1.099
63 HH11 ARG 7 1HH1 ARG 7 -12.044 -10.148 0.892
64 HH12 ARG 7 2HH1 ARG 7 -13.587 -10.660 1.489
65 HH21 ARG 7 1HH2 ARG 7 -13.617 -13.653 -0.320
66 HH22 ARG 7 2HH2 ARG 7 -14.481 -12.654 0.800
67 H LYS 8 H LYS 8 -5.872 -9.332 -2.843
68 HA LYS 8 HA LYS 8 -4.664 -11.501 -4.295
69 HB2 LYS 8 2HB LYS 8 -4.974 -8.628 -4.616
70 HB3 LYS 8 3HB LYS 8 -3.348 -9.159 -5.027
71 HG2 LYS 8 2HG LYS 8 -5.917 -10.207 -6.197
72 HG3 LYS 8 3HG LYS 8 -4.754 -9.144 -6.992
73 HD2 LYS 8 2HD LYS 8 -4.362 -12.012 -6.156
74 HD3 LYS 8 3HD LYS 8 -4.360 -11.354 -7.794
75 HE2 LYS 8 2HE LYS 8 -2.401 -9.875 -6.682
76 HE3 LYS 8 3HE LYS 8 -2.241 -11.356 -5.739
77 HZ1 LYS 8 1HZ LYS 8 -2.417 -12.381 -8.168
78 HZ2 LYS 8 2HZ LYS 8 -0.942 -11.923 -7.478
79 HZ3 LYS 8 3HZ LYS 8 -1.723 -10.890 -8.566
80 H CYS 9 H CYS 9 -2.953 -12.576 -3.586
81 HA CYS 9 HA CYS 9 -0.961 -11.137 -1.961
82 HB2 CYS 9 2HB CYS 9 -1.396 -14.121 -1.931
83 HB3 CYS 9 3HB CYS 9 -0.498 -13.145 -0.775
84 HG CYS 9 HG CYS 9 -3.868 -13.497 -1.083
85 HA PRO 10 HA PRO 10 1.039 -12.416 -5.966
86 HB2 PRO 10 2HB PRO 10 2.218 -10.014 -6.426
87 HB3 PRO 10 3HB PRO 10 0.574 -10.393 -6.953
88 HG2 PRO 10 2HG PRO 10 1.486 -8.862 -4.548
89 HG3 PRO 10 3HG PRO 10 0.161 -8.499 -5.669
90 HD2 PRO 10 2HD PRO 10 -0.251 -9.635 -3.246
91 HD3 PRO 10 3HD PRO 10 -1.275 -9.988 -4.653
92 H LEU 11 H LEU 11 2.440 -10.182 -3.557
93 HA LEU 11 HA LEU 11 4.853 -11.874 -3.535
94 HB2 LEU 11 2HB LEU 11 5.431 -9.274 -2.544
95 HB3 LEU 11 3HB LEU 11 6.096 -10.093 -3.956
96 HG LEU 11 HG LEU 11 3.504 -8.574 -4.068
97 HD11 LEU 11 1HD1 LEU 11 4.740 -6.757 -3.575
98 HD12 LEU 11 2HD1 LEU 11 5.254 -6.911 -5.255
99 HD13 LEU 11 3HD1 LEU 11 6.265 -7.554 -3.961
100 HD21 LEU 11 1HD2 LEU 11 3.726 -8.703 -6.370
101 HD22 LEU 11 2HD2 LEU 11 4.315 -10.279 -5.841
102 HD23 LEU 11 3HD2 LEU 11 5.460 -9.014 -6.289
103 H PHE 12 H PHE 12 3.804 -9.190 -1.465
104 HA PHE 12 HA PHE 12 3.846 -11.050 0.821
105 HB2 PHE 12 2HB PHE 12 4.318 -8.491 1.840
106 HB3 PHE 12 3HB PHE 12 5.493 -9.791 1.668
107 HD1 PHE 12 HD1 PHE 12 4.071 -6.818 -0.004
108 HD2 PHE 12 HD2 PHE 12 7.254 -9.641 0.119
109 HE1 PHE 12 HE1 PHE 12 5.346 -5.445 -1.599
110 HE2 PHE 12 HE2 PHE 12 8.534 -8.273 -1.475
111 HZ PHE 12 HZ PHE 12 7.581 -6.172 -2.336
112 H GLY 13 H GLY 13 1.594 -11.386 0.663
113 HA2 GLY 13 2HA GLY 13 -0.187 -9.100 0.863
114 HA3 GLY 13 3HA GLY 13 -0.662 -10.789 0.759
115 H LYS 14 H LYS 14 1.724 -10.406 3.073
116 HA LYS 14 HA LYS 14 -0.083 -10.986 5.207
117 HB2 LYS 14 2HB LYS 14 1.940 -10.924 6.628
118 HB3 LYS 14 3HB LYS 14 2.145 -11.942 5.209
119 HG2 LYS 14 2HG LYS 14 3.344 -10.085 4.100
120 HG3 LYS 14 3HG LYS 14 3.217 -9.155 5.595
121 HD2 LYS 14 2HD LYS 14 5.198 -10.076 6.105
122 HD3 LYS 14 3HD LYS 14 4.258 -11.522 6.483
123 HE2 LYS 14 2HE LYS 14 4.539 -12.142 4.028
124 HE3 LYS 14 3HE LYS 14 5.759 -10.872 3.961
125 HZ1 LYS 14 1HZ LYS 14 6.267 -12.491 6.194
126 HZ2 LYS 14 2HZ LYS 14 7.223 -12.272 4.816
127 HZ3 LYS 14 3HZ LYS 14 6.060 -13.499 4.851
128 H GLY 15 H GLY 15 1.803 -8.149 4.243
129 HA2 GLY 15 2HA GLY 15 0.286 -6.588 6.243
130 HA3 GLY 15 3HA GLY 15 1.951 -6.231 5.810
131 H GLY 16 H GLY 16 1.597 -6.652 2.974
132 HA2 GLY 16 2HA GLY 16 1.159 -5.350 1.131
133 HA3 GLY 16 3HA GLY 16 -0.464 -5.238 1.794
Start of MODEL 20
1 H1 VAL 1 H VAL 1 0.845 0.225 -0.717
2 HA VAL 1 HA VAL 1 2.976 0.951 -1.911
3 HB VAL 1 HB VAL 1 4.717 -0.763 -2.037
4 HG11 VAL 1 1HG1 VAL 1 5.763 0.042 -0.223
5 HG12 VAL 1 2HG1 VAL 1 4.287 0.981 0.013
6 HG13 VAL 1 3HG1 VAL 1 4.514 -0.540 0.877
7 HG21 VAL 1 1HG2 VAL 1 3.184 -2.234 0.102
8 HG22 VAL 1 2HG2 VAL 1 3.206 -2.695 -1.600
9 HG23 VAL 1 3HG2 VAL 1 4.697 -2.729 -0.659
10 H ALA 2 H ALA 2 0.970 -1.877 -1.632
11 HA ALA 2 HA ALA 2 0.926 -2.085 -4.572
12 HB1 ALA 2 1HB ALA 2 1.985 -4.010 -3.108
13 HB2 ALA 2 2HB ALA 2 0.294 -4.479 -2.928
14 HB3 ALA 2 3HB ALA 2 1.011 -4.365 -4.535
15 H ARG 3 H ARG 3 -0.988 -1.610 -5.410
16 HA ARG 3 HA ARG 3 -3.241 -0.872 -4.035
17 HB2 ARG 3 2HB ARG 3 -4.386 -0.869 -6.079
18 HB3 ARG 3 3HB ARG 3 -2.704 -0.640 -6.536
19 HG2 ARG 3 2HG ARG 3 -2.718 -3.239 -6.782
20 HG3 ARG 3 3HG ARG 3 -4.464 -3.013 -6.910
21 HD2 ARG 3 2HD ARG 3 -2.525 -1.434 -8.574
22 HD3 ARG 3 3HD ARG 3 -3.109 -3.021 -9.077
23 HE ARG 3 HE ARG 3 -4.535 -0.558 -9.197
24 HH11 ARG 3 1HH1 ARG 3 -4.914 -3.986 -8.728
25 HH12 ARG 3 2HH1 ARG 3 -6.549 -4.016 -9.299
26 HH21 ARG 3 1HH2 ARG 3 -6.687 -0.583 -9.951
27 HH22 ARG 3 2HH2 ARG 3 -7.557 -2.080 -9.996
28 H GLY 4 H GLY 4 -2.213 -4.094 -4.929
29 HA2 GLY 4 2HA GLY 4 -4.644 -5.168 -3.636
30 HA3 GLY 4 3HA GLY 4 -3.801 -5.982 -4.945
31 H TRP 5 H TRP 5 -4.135 -5.704 -1.605
32 HA TRP 5 HA TRP 5 -1.713 -7.331 -1.200
33 HB2 TRP 5 2HB TRP 5 -2.760 -5.010 0.354
34 HB3 TRP 5 3HB TRP 5 -1.976 -6.314 1.241
35 HD1 TRP 5 HD1 TRP 5 -0.985 -3.142 0.369
36 HE1 TRP 5 HE1 TRP 5 1.466 -2.951 -0.390
37 HE3 TRP 5 HE3 TRP 5 -0.085 -8.057 -0.715
38 HZ2 TRP 5 HZ2 TRP 5 3.511 -4.657 -1.325
39 HZ3 TRP 5 HZ3 TRP 5 2.144 -8.694 -1.537
40 HH2 TRP 5 HH2 TRP 5 3.904 -7.028 -1.836
41 H LYS 6 H LYS 6 -4.315 -6.460 1.035
42 HA LYS 6 HA LYS 6 -4.686 -8.649 2.451
43 HB2 LYS 6 2HB LYS 6 -6.197 -6.602 2.355
44 HB3 LYS 6 3HB LYS 6 -7.083 -7.433 1.083
45 HG2 LYS 6 2HG LYS 6 -8.300 -8.419 2.642
46 HG3 LYS 6 3HG LYS 6 -6.853 -9.269 3.189
47 HD2 LYS 6 2HD LYS 6 -6.507 -6.836 4.347
48 HD3 LYS 6 3HD LYS 6 -8.266 -6.978 4.371
49 HE2 LYS 6 2HE LYS 6 -8.083 -9.133 5.500
50 HE3 LYS 6 3HE LYS 6 -6.325 -9.024 5.445
51 HZ1 LYS 6 1HZ LYS 6 -8.197 -7.735 7.228
52 HZ2 LYS 6 2HZ LYS 6 -6.983 -6.716 6.640
53 HZ3 LYS 6 3HZ LYS 6 -6.570 -8.132 7.468
54 H ARG 7 H ARG 7 -6.760 -8.419 -0.430
55 HA ARG 7 HA ARG 7 -7.066 -11.256 -0.562
56 HB2 ARG 7 2HB ARG 7 -7.835 -9.091 -2.528
57 HB3 ARG 7 3HB ARG 7 -8.317 -10.777 -2.654
58 HG2 ARG 7 2HG ARG 7 -8.940 -9.421 -0.107
59 HG3 ARG 7 3HG ARG 7 -9.839 -8.891 -1.530
60 HD2 ARG 7 2HD ARG 7 -9.604 -11.800 -1.245
61 HD3 ARG 7 3HD ARG 7 -10.511 -11.009 0.044
62 HE ARG 7 HE ARG 7 -11.562 -9.950 -2.222
63 HH11 ARG 7 1HH1 ARG 7 -11.038 -13.200 -1.089
64 HH12 ARG 7 2HH1 ARG 7 -12.399 -13.855 -1.938
65 HH21 ARG 7 1HH2 ARG 7 -13.357 -10.800 -3.345
66 HH22 ARG 7 2HH2 ARG 7 -13.717 -12.489 -3.222
67 H LYS 8 H LYS 8 -5.462 -8.873 -2.668
68 HA LYS 8 HA LYS 8 -4.226 -10.975 -4.229
69 HB2 LYS 8 2HB LYS 8 -4.559 -8.060 -4.446
70 HB3 LYS 8 3HB LYS 8 -3.019 -8.662 -5.045
71 HG2 LYS 8 2HG LYS 8 -4.228 -8.839 -6.950
72 HG3 LYS 8 3HG LYS 8 -4.607 -10.414 -6.249
73 HD2 LYS 8 2HD LYS 8 -6.462 -8.600 -5.165
74 HD3 LYS 8 3HD LYS 8 -6.367 -8.238 -6.890
75 HE2 LYS 8 2HE LYS 8 -6.673 -10.692 -7.319
76 HE3 LYS 8 3HE LYS 8 -6.997 -10.886 -5.597
77 HZ1 LYS 8 1HZ LYS 8 -9.065 -10.174 -5.873
78 HZ2 LYS 8 2HZ LYS 8 -8.822 -10.256 -7.545
79 HZ3 LYS 8 3HZ LYS 8 -8.570 -8.799 -6.724
80 H CYS 9 H CYS 9 -2.616 -12.044 -3.255
81 HA CYS 9 HA CYS 9 -0.551 -10.465 -1.869
82 HB2 CYS 9 2HB CYS 9 -0.015 -12.626 -0.680
83 HB3 CYS 9 3HB CYS 9 -1.579 -11.924 -0.284
84 HG CYS 9 HG CYS 9 -0.882 -14.912 -1.461
85 HA PRO 10 HA PRO 10 1.305 -12.366 -5.708
86 HB2 PRO 10 2HB PRO 10 2.452 -10.072 -6.598
87 HB3 PRO 10 3HB PRO 10 0.795 -10.537 -7.002
88 HG2 PRO 10 2HG PRO 10 1.770 -8.625 -4.915
89 HG3 PRO 10 3HG PRO 10 0.408 -8.457 -6.038
90 HD2 PRO 10 2HD PRO 10 0.081 -9.174 -3.448
91 HD3 PRO 10 3HD PRO 10 -0.984 -9.759 -4.743
92 H LEU 11 H LEU 11 2.613 -9.989 -3.422
93 HA LEU 11 HA LEU 11 5.164 -11.464 -3.470
94 HB2 LEU 11 2HB LEU 11 5.521 -8.849 -2.411
95 HB3 LEU 11 3HB LEU 11 6.245 -9.571 -3.847
96 HG LEU 11 HG LEU 11 3.542 -8.247 -3.876
97 HD11 LEU 11 1HD1 LEU 11 5.238 -6.522 -5.142
98 HD12 LEU 11 2HD1 LEU 11 6.207 -7.053 -3.769
99 HD13 LEU 11 3HD1 LEU 11 4.623 -6.326 -3.501
100 HD21 LEU 11 1HD2 LEU 11 5.353 -8.419 -6.218
101 HD22 LEU 11 2HD2 LEU 11 3.592 -8.495 -6.136
102 HD23 LEU 11 3HD2 LEU 11 4.558 -9.902 -5.690
103 H PHE 12 H PHE 12 4.034 -8.909 -1.301
104 HA PHE 12 HA PHE 12 4.165 -10.841 0.920
105 HB2 PHE 12 2HB PHE 12 4.620 -8.439 2.133
106 HB3 PHE 12 3HB PHE 12 5.883 -9.556 1.625
107 HD1 PHE 12 HD1 PHE 12 6.952 -9.220 -0.633
108 HD2 PHE 12 HD2 PHE 12 4.442 -6.306 1.191
109 HE1 PHE 12 HE1 PHE 12 7.883 -7.493 -2.118
110 HE2 PHE 12 HE2 PHE 12 5.368 -4.575 -0.291
111 HZ PHE 12 HZ PHE 12 7.090 -5.167 -1.949
112 H GLY 13 H GLY 13 1.866 -11.162 0.530
113 HA2 GLY 13 2HA GLY 13 0.103 -8.912 1.071
114 HA3 GLY 13 3HA GLY 13 -0.388 -10.545 0.645
115 H LYS 14 H LYS 14 1.873 -10.870 3.002
116 HA LYS 14 HA LYS 14 0.014 -11.727 4.948
117 HB2 LYS 14 2HB LYS 14 1.990 -11.948 6.425
118 HB3 LYS 14 3HB LYS 14 2.233 -12.690 4.849
119 HG2 LYS 14 2HG LYS 14 3.442 -10.615 4.151
120 HG3 LYS 14 3HG LYS 14 3.342 -10.072 5.828
121 HD2 LYS 14 2HD LYS 14 5.466 -11.081 5.599
122 HD3 LYS 14 3HD LYS 14 4.465 -12.254 6.458
123 HE2 LYS 14 2HE LYS 14 4.933 -13.762 4.897
124 HE3 LYS 14 3HE LYS 14 4.133 -12.746 3.699
125 HZ1 LYS 14 1HZ LYS 14 6.896 -12.118 4.455
126 HZ2 LYS 14 2HZ LYS 14 6.104 -11.881 2.980
127 HZ3 LYS 14 3HZ LYS 14 6.621 -13.430 3.422
128 H GLY 15 H GLY 15 1.927 -8.769 4.605
129 HA2 GLY 15 2HA GLY 15 0.353 -7.614 6.825
130 HA3 GLY 15 3HA GLY 15 2.030 -7.189 6.515
131 H GLY 16 H GLY 16 1.479 -7.233 3.559
132 HA2 GLY 16 2HA GLY 16 1.058 -5.638 1.959
133 HA3 GLY 16 3HA GLY 16 -0.484 -5.451 2.781