NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12938 |
1ttx   |
6705 | cing | 1-original | 9 | DYANA/DIANA | pseudocontact shift |
3 ILE N -0.01 1 0.10 0.50
3 ILE HN 0.06 1 0.10 0.50
4 THR N -0.01 1 0.10 0.50
4 THR HN 0.00 1 0.10 0.50
5 ASP N 0.00 1 0.10 0.50
5 ASP HN 0.01 1 0.10 0.50
6 VAL N 0.11 1 0.10 0.50
6 VAL HN 0.06 1 0.10 0.50
7 LEU N 0.00 1 0.10 0.50
7 LEU HN 0.01 1 0.10 0.50
8 SER N -0.02 1 0.10 0.50
8 SER HN -0.01 1 0.10 0.50
9 ALA N -0.10 1 0.10 0.50
9 ALA HN -0.14 1 0.10 0.50
10 ASP N -0.13 1 0.10 0.50
10 ASP HN -0.18 1 0.10 0.50
11 ASP N -0.17 1 0.10 0.50
11 ASP HN -0.24 1 0.10 0.50
12 ILE N -0.34 1 0.10 0.50
12 ILE HN -0.35 1 0.10 0.50
13 ALA N -0.32 1 0.10 0.50
13 ALA HN -0.37 1 0.10 0.50
14 ALA N -0.37 1 0.10 0.50
14 ALA HN -0.41 1 0.10 0.50
15 ALA N -0.52 1 0.10 0.50
15 ALA HN -0.57 1 0.10 0.50
16 LEU N -0.65 1 0.10 0.50
16 LEU HN -0.66 1 0.10 0.50
19 CYS N -0.59 1 0.10 0.50
19 CYS HN -0.75 1 0.10 0.50
20 ARG N -0.69 1 0.10 0.50
20 ARG HN -0.63 1 0.10 0.50
21 ASP N -0.65 1 0.10 0.50
21 ASP HN -0.61 1 0.10 0.50
23 ASP N -0.69 1 0.10 0.50
23 ASP HN -0.91 1 0.10 0.50
24 THR N -0.89 1 0.10 0.50
24 THR HN -0.85 1 0.10 0.50
25 PHE N -1.11 1 0.10 0.50
25 PHE HN -1.20 1 0.10 0.50
26 GLU N -1.53 1 0.10 0.50
26 GLU HN -1.47 1 0.10 0.50
28 GLN N -2.12 1 0.10 0.50
28 GLN HN -2.16 1 0.10 0.50
29 LYS N -1.29 1 0.10 0.50
29 LYS HN -1.47 1 0.10 0.50
30 PHE N -1.34 1 0.10 0.50
30 PHE HN -1.54 1 0.10 0.50
31 PHE N -1.43 1 0.10 0.50
31 PHE HN -1.72 1 0.10 0.50
32 GLN N -0.94 1 0.10 0.50
32 GLN HN -1.12 1 0.10 0.50
33 THR N -0.70 1 0.10 0.50
33 THR HN -0.85 1 0.10 0.50
34 SER N -0.62 1 0.10 0.50
34 SER HN -0.80 1 0.10 0.50
35 GLY N -0.43 1 0.10 0.50
35 GLY HN -0.58 1 0.10 0.50
36 LEU N -0.61 1 0.10 0.50
36 LEU HN -0.63 1 0.10 0.50
37 SER N -0.63 1 0.10 0.50
37 SER HN -0.68 1 0.10 0.50
38 LYS N -0.30 1 0.10 0.50
38 LYS HN -0.30 1 0.10 0.50
39 MET N 0.14 1 0.10 0.50
39 MET HN -0.09 1 0.10 0.50
40 SER N 0.40 1 0.10 0.50
40 SER HN 0.45 1 0.10 0.50
41 ALA N 0.77 1 0.10 0.50
41 ALA HN 1.09 1 0.10 0.50
43 GLN N 1.01 1 0.10 0.50
43 GLN HN 1.11 1 0.10 0.50
44 VAL N 1.04 1 0.10 0.50
44 VAL HN 1.09 1 0.10 0.50
45 LYS N 2.11 1 0.10 0.50
45 LYS HN 2.05 1 0.10 0.50
47 VAL N 0.95 1 0.10 0.50
47 VAL HN 1.11 1 0.10 0.50
48 PHE N 1.23 1 0.10 0.50
48 PHE HN 1.53 1 0.10 0.50
49 ARG N 2.16 1 0.10 0.50
49 ARG HN 2.15 1 0.10 0.50
50 PHE N 1.12 1 0.10 0.50
50 PHE HN 1.09 1 0.10 0.50
53 ASN N 0.28 1 0.10 0.50
53 ASN HN -0.25 1 0.10 0.50
54 ASP N 0.29 1 0.10 0.50
54 ASP HN 0.27 1 0.10 0.50
55 GLN N 1.07 1 0.10 0.50
55 GLN HN 1.05 1 0.10 0.50
67 PHE N -2.35 1 0.10 0.50
67 PHE HN -2.46 1 0.10 0.50
68 LEU N -1.65 1 0.10 0.50
68 LEU HN -1.69 1 0.10 0.50
69 GLN N -1.16 1 0.10 0.50
69 GLN HN -1.18 1 0.10 0.50
70 LYS N -0.90 1 0.10 0.50
70 LYS HN -1.05 1 0.10 0.50
71 PHE N -0.82 1 0.10 0.50
71 PHE HN -0.72 1 0.10 0.50
73 SER N -0.38 1 0.10 0.50
73 SER HN -0.37 1 0.10 0.50
74 GLY N -0.39 1 0.10 0.50
74 GLY HN -0.42 1 0.10 0.50
75 ALA N -0.53 1 0.10 0.50
75 ALA HN -0.58 1 0.10 0.50
76 ARG N -0.74 1 0.10 0.50
76 ARG HN -0.80 1 0.10 0.50
78 LEU N -1.51 1 0.10 0.50
78 LEU HN -1.67 1 0.10 0.50
79 THR N -1.54 1 0.10 0.50
79 THR HN -1.44 1 0.10 0.50
80 GLU N -1.14 1 0.10 0.50
80 GLU HN -0.92 1 0.10 0.50
81 SER N -1.03 1 0.10 0.50
81 SER HN -0.89 1 0.10 0.50
82 GLU N -1.94 1 0.10 0.50
82 GLU HN -1.48 1 0.10 0.50
83 THR N -2.69 1 0.10 0.50
83 THR HN -2.29 1 0.10 0.50
84 LYS N -2.86 1 0.10 0.50
84 LYS HN -2.28 1 0.10 0.50
85 SER N -2.56 1 0.10 0.50
85 SER HN -2.47 1 0.10 0.50
69 GLN NE2 -0.85 1 0.10 0.50
69 GLN HE21 -0.77 1 0.10 0.50
69 GLN HE22 -0.74 1 0.10 0.50
17 GLN NE2 -0.37 1 0.10 0.50
17 GLN HE21 -0.34 1 0.10 0.50
17 GLN HE22 -0.37 1 0.10 0.50
32 GLN NE2 -0.70 1 0.10 0.50
32 GLN HE21 -0.71 1 0.10 0.50
32 GLN HE22 -0.64 1 0.10 0.50
53 ASN ND2 -0.30 1 0.10 0.50
53 ASN HD21 -0.39 1 0.10 0.50
53 ASN HD22 -0.36 1 0.10 0.50
28 GLN NE2 -1.69 1 0.10 0.50
28 GLN HE21 -1.72 1 0.10 0.50
28 GLN HE22 -1.60 1 0.10 0.50
55 GLN NE2 1.12 1 0.10 0.50
55 GLN HE21 1.15 1 0.10 0.50
55 GLN HE22 1.12 1 0.10 0.50
43 GLN NE2 0.48 1 0.10 0.50
43 GLN HE21 0.49 1 0.10 0.50
43 GLN HE22 0.40 1 0.10 0.50
150 LTNS PCN
(Residual dipolar coupling)
7 LEU HN -4.14 0.50 0.10
8 SER HN 0.22 0.50 0.10
9 ALA HN 27.33 0.50 0.10
10 ASP- HN 13.71 0.50 0.10
11 ASP- HN 16.99 0.50 0.10
12 ILE HN 23.39 0.50 0.10
14 ALA HN 15.10 0.50 0.10
16 LEU HN 22.34 0.50 0.10
19 CYS HN 22.19 0.50 0.10
23 ASP- HN 8.50 0.50 0.10
24 THR HN 2.30 0.50 0.10
25 PHE HN 1.60 0.50 0.10
26 GLU- HN 4.67 0.50 0.10
28 GLN HN 17.55 0.50 0.10
30 PHE HN 11.18 0.50 0.10
31 PHE HN 19.30 0.50 0.10
33 THR HN 17.85 0.50 0.10
34 SER HN 7.39 0.50 0.10
35 GLY HN 16.32 0.50 0.10
39 MET HN 15.52 0.50 0.10
40 SER HN 9.64 0.50 0.10
45 LYS+ HN -0.06 0.50 0.10
49 ARG+ HN 4.34 0.50 0.10
50 PHE HN -10.01 0.50 0.10
53 ASN HN 8.44 0.50 0.10
54 ASP- HN 12.32 0.50 0.10
55 GLN HN 7.12 0.50 0.10
68 LEU HN 17.30 0.50 0.10
69 GLN HN 6.44 0.50 0.10
71 PHE HN 14.27 0.50 0.10
75 ALA HN 4.71 0.50 0.10
76 ARG+ HN -3.42 0.50 0.10
78 LEU HN -2.79 0.50 0.10
79 THR HN -8.73 0.50 0.10
80 GLU- HN 5.19 0.50 0.10
83 THR HN 2.33 0.50 0.10
109 SER HN -6.62 0.50 0.10
150 LTNS
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 H1 MET 1 -15.705 0.588 2.445
2 2H MET 1 H2 MET 1 -16.468 0.441 0.991
3 3H MET 1 H3 MET 1 -15.051 1.276 1.104
4 HA MET 1 HA MET 1 -16.923 2.796 0.941
5 1HB MET 1 2HB MET 1 -17.766 1.222 3.394
6 2HB MET 1 3HB MET 1 -18.377 2.846 3.045
7 1HG MET 1 2HG MET 1 -19.343 2.162 0.960
8 2HG MET 1 3HG MET 1 -18.694 0.519 1.115
9 1HE MET 1 1HE MET 1 -21.790 1.454 0.569
10 2HE MET 1 2HE MET 1 -21.207 -0.230 0.504
11 3HE MET 1 3HE MET 1 -22.612 0.191 1.513
12 H SER 2 H SER 2 -14.630 3.665 1.137
13 HA SER 2 HA SER 2 -14.533 5.510 3.293
14 1HB SER 2 2HB SER 2 -12.215 3.507 3.287
15 2HB SER 2 3HB SER 2 -12.454 4.905 4.344
16 HG SER 2 HG SER 2 -14.526 3.598 4.843
17 H ILE 3 H ILE 3 -12.163 3.784 1.275
18 HA ILE 3 HA ILE 3 -10.972 6.340 0.450
19 HB ILE 3 HB ILE 3 -9.081 5.080 -0.167
20 1HG1 ILE 3 2HG1 ILE 3 -9.331 2.442 0.202
21 2HG1 ILE 3 3HG1 ILE 3 -10.963 2.723 -0.359
22 1HG2 ILE 3 1HG2 ILE 3 -8.484 4.016 1.869
23 2HG2 ILE 3 2HG2 ILE 3 -9.657 5.280 2.298
24 3HG2 ILE 3 3HG2 ILE 3 -10.146 3.575 2.248
25 1HD1 ILE 3 1HD1 ILE 3 -9.535 2.146 -2.246
26 2HD1 ILE 3 2HD1 ILE 3 -9.910 3.859 -2.434
27 3HD1 ILE 3 3HD1 ILE 3 -8.338 3.369 -1.783
28 H THR 4 H THR 4 -12.904 3.709 -0.959
29 HA THR 4 HA THR 4 -12.334 3.973 -3.604
30 HB THR 4 HB THR 4 -13.240 2.009 -2.355
31 HG1 THR 4 1HG THR 4 -14.532 3.279 -4.370
32 1HG2 THR 4 1HG2 THR 4 -14.867 3.235 -0.814
33 2HG2 THR 4 2HG2 THR 4 -15.867 3.592 -2.230
34 3HG2 THR 4 3HG2 THR 4 -15.612 1.915 -1.736
35 H ASP 5 H ASP 5 -14.013 6.201 -1.588
36 HA ASP 5 HA ASP 5 -15.145 7.540 -3.965
37 1HB ASP 5 2HB ASP 5 -16.933 6.164 -2.825
38 2HB ASP 5 3HB ASP 5 -16.654 7.105 -1.345
39 H VAL 6 H VAL 6 -12.694 7.846 -2.259
40 HA VAL 6 HA VAL 6 -13.248 10.589 -1.186
41 HB VAL 6 HB VAL 6 -12.012 8.710 0.153
42 1HG1 VAL 6 1HG1 VAL 6 -9.560 9.905 -1.070
43 2HG1 VAL 6 2HG1 VAL 6 -9.696 8.581 0.087
44 3HG1 VAL 6 3HG1 VAL 6 -10.233 8.340 -1.577
45 1HG2 VAL 6 1HG2 VAL 6 -12.412 10.954 0.998
46 2HG2 VAL 6 2HG2 VAL 6 -10.765 10.429 1.389
47 3HG2 VAL 6 3HG2 VAL 6 -11.033 11.575 0.057
48 H LEU 7 H LEU 7 -11.206 8.761 -3.384
49 HA LEU 7 HA LEU 7 -10.722 10.747 -5.309
50 1HB LEU 7 2HB LEU 7 -9.659 12.076 -3.629
51 2HB LEU 7 3HB LEU 7 -8.845 10.701 -2.912
52 HG LEU 7 HG LEU 7 -7.959 11.012 -5.677
53 1HD1 LEU 7 1HD1 LEU 7 -6.854 13.223 -5.288
54 2HD1 LEU 7 2HD1 LEU 7 -8.632 13.350 -5.307
55 3HD1 LEU 7 3HD1 LEU 7 -7.763 13.370 -3.756
56 1HD2 LEU 7 1HD2 LEU 7 -6.547 11.342 -2.976
57 2HD2 LEU 7 2HD2 LEU 7 -6.745 9.800 -3.835
58 3HD2 LEU 7 3HD2 LEU 7 -5.773 11.086 -4.550
59 H SER 8 H SER 8 -8.889 8.473 -3.238
60 HA SER 8 HA SER 8 -7.065 7.494 -4.837
61 1HB SER 8 2HB SER 8 -7.816 5.216 -3.384
62 2HB SER 8 3HB SER 8 -6.649 6.464 -2.947
63 HG SER 8 HG SER 8 -9.440 6.467 -2.324
64 H ALA 9 H ALA 9 -10.434 6.511 -5.190
65 HA ALA 9 HA ALA 9 -10.226 4.153 -6.682
66 1HB ALA 9 1HB ALA 9 -12.337 5.159 -5.970
67 2HB ALA 9 2HB ALA 9 -12.078 6.537 -7.068
68 3HB ALA 9 3HB ALA 9 -12.343 4.905 -7.729
69 H ASP 10 H ASP 10 -9.835 7.560 -7.832
70 HA ASP 10 HA ASP 10 -9.545 6.769 -10.614
71 1HB ASP 10 2HB ASP 10 -10.295 9.031 -9.827
72 2HB ASP 10 3HB ASP 10 -8.647 9.336 -9.241
73 H ASP 11 H ASP 11 -7.367 7.488 -7.888
74 HA ASP 11 HA ASP 11 -4.942 7.523 -9.342
75 1HB ASP 11 2HB ASP 11 -5.347 6.807 -6.407
76 2HB ASP 11 3HB ASP 11 -3.898 7.432 -7.207
77 H ILE 12 H ILE 12 -6.658 4.898 -7.553
78 HA ILE 12 HA ILE 12 -4.680 2.948 -8.097
79 HB ILE 12 HB ILE 12 -6.218 1.351 -7.415
80 1HG1 ILE 12 2HG1 ILE 12 -8.304 3.447 -7.203
81 2HG1 ILE 12 3HG1 ILE 12 -8.317 2.080 -8.320
82 1HG2 ILE 12 1HG2 ILE 12 -6.426 2.065 -5.078
83 2HG2 ILE 12 2HG2 ILE 12 -4.883 2.556 -5.771
84 3HG2 ILE 12 3HG2 ILE 12 -6.174 3.748 -5.552
85 1HD1 ILE 12 1HD1 ILE 12 -9.811 1.531 -6.565
86 2HD1 ILE 12 2HD1 ILE 12 -8.357 0.549 -6.303
87 3HD1 ILE 12 3HD1 ILE 12 -8.660 2.002 -5.309
88 H ALA 13 H ALA 13 -7.673 3.929 -9.833
89 HA ALA 13 HA ALA 13 -7.526 1.964 -11.877
90 1HB ALA 13 1HB ALA 13 -8.730 3.604 -13.289
91 2HB ALA 13 2HB ALA 13 -9.455 3.402 -11.681
92 3HB ALA 13 3HB ALA 13 -8.492 4.846 -12.050
93 H ALA 14 H ALA 14 -5.781 5.110 -11.572
94 HA ALA 14 HA ALA 14 -4.272 4.765 -13.987
95 1HB ALA 14 1HB ALA 14 -2.754 6.430 -13.107
96 2HB ALA 14 2HB ALA 14 -4.434 6.915 -12.801
97 3HB ALA 14 3HB ALA 14 -3.436 6.278 -11.481
98 H ALA 15 H ALA 15 -3.340 4.024 -10.584
99 HA ALA 15 HA ALA 15 -0.833 2.977 -10.892
100 1HB ALA 15 1HB ALA 15 -2.109 3.326 -8.718
101 2HB ALA 15 2HB ALA 15 -2.930 1.791 -9.036
102 3HB ALA 15 3HB ALA 15 -1.177 1.818 -8.822
103 H LEU 16 H LEU 16 -3.897 1.311 -11.162
104 HA LEU 16 HA LEU 16 -3.169 -1.328 -11.540
105 1HB LEU 16 2HB LEU 16 -5.460 -0.802 -11.228
106 2HB LEU 16 3HB LEU 16 -5.448 0.386 -12.526
107 HG LEU 16 HG LEU 16 -5.320 -1.382 -14.231
108 1HD1 LEU 16 1HD1 LEU 16 -4.209 -3.183 -12.914
109 2HD1 LEU 16 2HD1 LEU 16 -5.647 -3.301 -11.876
110 3HD1 LEU 16 3HD1 LEU 16 -5.749 -3.727 -13.597
111 1HD2 LEU 16 1HD2 LEU 16 -7.597 -1.708 -12.242
112 2HD2 LEU 16 2HD2 LEU 16 -7.472 -0.442 -13.481
113 3HD2 LEU 16 3HD2 LEU 16 -7.628 -2.139 -13.965
114 H GLN 17 H GLN 17 -3.329 1.348 -13.935
115 HA GLN 17 HA GLN 17 -2.704 -0.534 -16.141
116 1HB GLN 17 2HB GLN 17 -3.326 2.432 -16.131
117 2HB GLN 17 3HB GLN 17 -2.934 1.454 -17.562
118 1HG GLN 17 2HG GLN 17 -4.839 -0.087 -16.988
119 2HG GLN 17 3HG GLN 17 -5.268 0.991 -15.649
120 1HE2 GLN 17 1HE2 GLN 17 -7.335 1.528 -16.483
121 2HE2 GLN 17 2HE2 GLN 17 -7.521 2.455 -17.963
122 H GLU 18 H GLU 18 -1.219 2.175 -14.361
123 HA GLU 18 HA GLU 18 1.019 2.316 -16.127
124 1HB GLU 18 2HB GLU 18 1.799 4.038 -14.831
125 2HB GLU 18 3HB GLU 18 0.050 4.105 -14.651
126 1HG GLU 18 2HG GLU 18 0.487 4.377 -12.476
127 2HG GLU 18 3HG GLU 18 0.634 2.616 -12.458
128 H CYS 19 H CYS 19 0.486 0.564 -13.077
129 HA CYS 19 HA CYS 19 2.936 -1.099 -13.610
130 1HB CYS 19 2HB CYS 19 1.437 -0.557 -11.033
131 2HB CYS 19 3HB CYS 19 2.569 -1.905 -11.292
132 HG CYS 19 HG CYS 19 3.144 1.326 -11.553
133 H ARG 20 H ARG 20 1.137 -1.628 -15.464
134 HA ARG 20 HA ARG 20 -0.802 -3.648 -14.585
135 1HB ARG 20 2HB ARG 20 -0.136 -2.294 -17.082
136 2HB ARG 20 3HB ARG 20 -0.088 -4.020 -17.355
137 1HG ARG 20 2HG ARG 20 -2.432 -2.682 -15.975
138 2HG ARG 20 3HG ARG 20 -2.341 -2.832 -17.721
139 1HD ARG 20 2HD ARG 20 -2.085 -5.198 -15.826
140 2HD ARG 20 3HD ARG 20 -3.651 -4.594 -16.409
141 HE ARG 20 HE ARG 20 -2.116 -4.893 -18.701
142 1HH1 ARG 20 2HH2 ARG 20 -3.169 -7.048 -16.130
143 2HH1 ARG 20 1HH2 ARG 20 -3.368 -8.447 -17.140
144 1HH2 ARG 20 2HH1 ARG 20 -2.401 -6.703 -20.103
145 2HH2 ARG 20 1HH1 ARG 20 -2.916 -8.233 -19.474
146 H ASP 21 H ASP 21 2.506 -3.518 -15.831
147 HA ASP 21 HA ASP 21 2.505 -6.229 -16.650
148 1HB ASP 21 2HB ASP 21 4.454 -3.911 -16.648
149 2HB ASP 21 3HB ASP 21 5.064 -5.526 -16.969
150 HA PRO 22 HA PRO 22 3.782 -8.311 -13.076
151 1HB PRO 22 2HB PRO 22 5.278 -10.409 -13.995
152 2HB PRO 22 3HB PRO 22 3.514 -10.264 -14.261
153 1HG PRO 22 2HG PRO 22 5.738 -9.462 -16.158
154 2HG PRO 22 3HG PRO 22 4.304 -10.466 -16.527
155 1HD PRO 22 2HD PRO 22 4.350 -7.813 -17.087
156 2HD PRO 22 3HD PRO 22 2.863 -8.566 -16.442
157 H ASP 23 H ASP 23 5.186 -7.619 -11.586
158 HA ASP 23 HA ASP 23 6.971 -7.569 -10.388
159 1HB ASP 23 2HB ASP 23 8.623 -8.444 -12.787
160 2HB ASP 23 3HB ASP 23 9.233 -8.192 -11.154
161 H THR 24 H THR 24 5.748 -5.354 -11.601
162 HA THR 24 HA THR 24 7.981 -3.496 -12.397
163 HB THR 24 HB THR 24 5.069 -3.269 -13.127
164 HG1 THR 24 1HG THR 24 5.488 -4.544 -14.685
165 1HG2 THR 24 1HG2 THR 24 7.589 -1.952 -14.246
166 2HG2 THR 24 2HG2 THR 24 5.989 -1.883 -15.006
167 3HG2 THR 24 3HG2 THR 24 6.241 -1.116 -13.438
168 H PHE 25 H PHE 25 6.020 -4.164 -9.718
169 HA PHE 25 HA PHE 25 4.732 -1.597 -9.466
170 1HB PHE 25 2HB PHE 25 3.840 -3.879 -8.907
171 2HB PHE 25 3HB PHE 25 4.865 -3.870 -7.479
172 HD1 PHE 25 HD1 PHE 25 1.820 -2.568 -9.080
173 HD2 PHE 25 HD2 PHE 25 4.323 -2.364 -5.571
174 HE1 PHE 25 HE1 PHE 25 -0.094 -1.711 -7.763
175 HE2 PHE 25 HE2 PHE 25 2.405 -1.477 -4.268
176 HZ PHE 25 HZ PHE 25 0.183 -1.225 -5.338
177 H GLU 26 H GLU 26 6.604 -0.149 -9.297
178 HA GLU 26 HA GLU 26 8.480 -0.391 -7.176
179 1HB GLU 26 2HB GLU 26 7.908 1.628 -9.271
180 2HB GLU 26 3HB GLU 26 8.332 2.344 -7.719
181 1HG GLU 26 2HG GLU 26 10.349 0.593 -7.799
182 2HG GLU 26 3HG GLU 26 10.060 0.757 -9.538
183 HA PRO 27 HA PRO 27 5.967 0.903 -3.887
184 1HB PRO 27 2HB PRO 27 7.821 1.808 -2.008
185 2HB PRO 27 3HB PRO 27 7.545 0.096 -2.418
186 1HG PRO 27 2HG PRO 27 9.768 1.868 -3.406
187 2HG PRO 27 3HG PRO 27 9.808 0.133 -2.976
188 1HD PRO 27 2HD PRO 27 9.660 1.016 -5.556
189 2HD PRO 27 3HD PRO 27 8.984 -0.543 -4.985
190 H GLN 28 H GLN 28 8.605 3.375 -4.105
191 HA GLN 28 HA GLN 28 7.073 5.585 -3.205
192 1HB GLN 28 2HB GLN 28 9.520 5.380 -4.992
193 2HB GLN 28 3HB GLN 28 8.839 6.926 -4.452
194 1HG GLN 28 2HG GLN 28 9.197 6.399 -2.128
195 2HG GLN 28 3HG GLN 28 9.605 4.719 -2.497
196 1HE2 GLN 28 1HE2 GLN 28 10.737 8.084 -3.250
197 2HE2 GLN 28 2HE2 GLN 28 12.432 7.628 -3.259
198 H LYS 29 H LYS 29 7.681 4.373 -6.499
199 HA LYS 29 HA LYS 29 6.160 6.201 -7.942
200 1HB LYS 29 2HB LYS 29 7.590 4.304 -8.881
201 2HB LYS 29 3HB LYS 29 6.289 3.189 -8.417
202 1HG LYS 29 2HG LYS 29 5.979 3.587 -10.715
203 2HG LYS 29 3HG LYS 29 4.724 4.512 -9.909
204 1HD LYS 29 2HD LYS 29 6.380 6.538 -10.057
205 2HD LYS 29 3HD LYS 29 7.350 5.501 -11.122
206 1HE LYS 29 2HE LYS 29 5.452 5.274 -12.665
207 2HE LYS 29 3HE LYS 29 4.383 6.137 -11.534
208 1HZ LYS 29 1HZ LYS 29 5.739 8.087 -11.855
209 2HZ LYS 29 2HZ LYS 29 6.653 7.294 -12.983
210 3HZ LYS 29 3HZ LYS 29 5.044 7.550 -13.249
211 H PHE 30 H PHE 30 5.017 3.057 -6.527
212 HA PHE 30 HA PHE 30 2.331 3.435 -7.163
213 1HB PHE 30 2HB PHE 30 3.149 1.289 -6.468
214 2HB PHE 30 3HB PHE 30 3.617 1.907 -4.887
215 HD1 PHE 30 HD1 PHE 30 2.133 1.604 -3.079
216 HD2 PHE 30 HD2 PHE 30 0.580 1.678 -7.103
217 HE1 PHE 30 HE1 PHE 30 -0.165 1.357 -2.200
218 HE2 PHE 30 HE2 PHE 30 -1.726 1.423 -6.212
219 HZ PHE 30 HZ PHE 30 -2.101 1.382 -3.760
220 H PHE 31 H PHE 31 3.990 4.359 -4.082
221 HA PHE 31 HA PHE 31 1.703 5.385 -2.801
222 1HB PHE 31 2HB PHE 31 4.599 6.282 -2.560
223 2HB PHE 31 3HB PHE 31 3.320 6.715 -1.434
224 HD1 PHE 31 HD1 PHE 31 6.095 4.917 -1.311
225 HD2 PHE 31 HD2 PHE 31 1.852 4.285 -0.856
226 HE1 PHE 31 HE1 PHE 31 6.535 3.010 0.188
227 HE2 PHE 31 HE2 PHE 31 2.303 2.487 0.767
228 HZ PHE 31 HZ PHE 31 4.653 1.856 1.314
229 H GLN 32 H GLN 32 3.755 6.926 -5.262
230 HA GLN 32 HA GLN 32 2.505 9.570 -4.961
231 1HB GLN 32 2HB GLN 32 4.209 8.302 -7.128
232 2HB GLN 32 3HB GLN 32 3.623 9.965 -7.159
233 1HG GLN 32 2HG GLN 32 5.009 9.212 -4.616
234 2HG GLN 32 3HG GLN 32 6.003 9.105 -6.063
235 1HE2 GLN 32 1HE2 GLN 32 4.410 11.376 -3.826
236 2HE2 GLN 32 2HE2 GLN 32 5.001 12.787 -4.654
237 H THR 33 H THR 33 2.334 6.896 -7.399
238 HA THR 33 HA THR 33 0.457 8.213 -8.880
239 HB THR 33 HB THR 33 2.149 6.143 -9.328
240 HG1 THR 33 1HG THR 33 -0.263 6.707 -10.555
241 1HG2 THR 33 1HG2 THR 33 1.051 4.064 -9.692
242 2HG2 THR 33 2HG2 THR 33 0.609 4.512 -8.033
243 3HG2 THR 33 3HG2 THR 33 -0.542 4.765 -9.357
244 H SER 34 H SER 34 0.074 6.182 -6.107
245 HA SER 34 HA SER 34 -2.745 5.611 -6.462
246 1HB SER 34 2HB SER 34 -1.124 4.064 -5.412
247 2HB SER 34 3HB SER 34 -0.918 5.186 -4.064
248 HG SER 34 HG SER 34 -3.506 4.335 -4.766
249 H GLY 35 H GLY 35 -0.977 8.371 -5.390
250 1HA GLY 35 1HA GLY 35 -1.951 10.402 -4.859
251 2HA GLY 35 2HA GLY 35 -3.495 9.618 -4.505
252 H LEU 36 H LEU 36 -1.561 7.673 -2.890
253 HA LEU 36 HA LEU 36 -2.228 8.489 -0.308
254 1HB LEU 36 2HB LEU 36 0.042 6.736 -1.342
255 2HB LEU 36 3HB LEU 36 -0.507 6.783 0.325
256 HG LEU 36 HG LEU 36 -2.269 5.950 -2.031
257 1HD1 LEU 36 1HD1 LEU 36 -0.844 4.246 0.047
258 2HD1 LEU 36 2HD1 LEU 36 -1.982 3.667 -1.191
259 3HD1 LEU 36 3HD1 LEU 36 -0.432 4.362 -1.680
260 1HD2 LEU 36 1HD2 LEU 36 -3.643 6.787 -0.192
261 2HD2 LEU 36 2HD2 LEU 36 -3.734 5.026 -0.231
262 3HD2 LEU 36 3HD2 LEU 36 -2.709 5.827 0.980
263 H SER 37 H SER 37 0.787 9.110 -2.161
264 HA SER 37 HA SER 37 2.012 10.585 0.030
265 1HB SER 37 2HB SER 37 3.509 9.505 -1.455
266 2HB SER 37 3HB SER 37 2.609 10.060 -2.874
267 HG SER 37 HG SER 37 4.524 11.417 -1.367
268 H LYS 38 H LYS 38 -0.554 11.396 -2.015
269 HA LYS 38 HA LYS 38 0.056 14.283 -1.887
270 1HB LYS 38 2HB LYS 38 -1.239 12.698 -3.859
271 2HB LYS 38 3HB LYS 38 -2.541 13.535 -3.022
272 1HG LYS 38 2HG LYS 38 -1.906 14.956 -4.784
273 2HG LYS 38 3HG LYS 38 -1.206 15.687 -3.322
274 1HD LYS 38 2HD LYS 38 0.971 14.374 -3.921
275 2HD LYS 38 3HD LYS 38 0.220 14.020 -5.470
276 1HE LYS 38 2HE LYS 38 0.876 16.777 -4.302
277 2HE LYS 38 3HE LYS 38 1.743 15.959 -5.608
278 1HZ LYS 38 1HZ LYS 38 -1.048 16.897 -5.726
279 2HZ LYS 38 2HZ LYS 38 0.243 17.594 -6.466
280 3HZ LYS 38 3HZ LYS 38 -0.266 16.102 -6.938
281 H MET 39 H MET 39 -2.077 11.730 -0.671
282 HA MET 39 HA MET 39 -3.849 13.332 0.837
283 1HB MET 39 2HB MET 39 -2.731 10.546 1.384
284 2HB MET 39 3HB MET 39 -4.009 11.305 2.312
285 1HG MET 39 2HG MET 39 -5.375 11.485 0.212
286 2HG MET 39 3HG MET 39 -4.131 10.531 -0.611
287 1HE MET 39 1HE MET 39 -5.859 8.662 -1.353
288 2HE MET 39 2HE MET 39 -7.054 7.964 -0.233
289 3HE MET 39 3HE MET 39 -7.126 9.696 -0.642
290 H SER 40 H SER 40 -3.881 13.827 3.082
291 HA SER 40 HA SER 40 -1.286 14.649 4.185
292 1HB SER 40 2HB SER 40 -3.335 16.086 4.352
293 2HB SER 40 3HB SER 40 -4.082 14.843 5.379
294 HG SER 40 HG SER 40 -1.816 16.454 5.913
295 H ALA 41 H ALA 41 -0.552 13.972 6.245
296 HA ALA 41 HA ALA 41 -0.223 11.328 6.857
297 1HB ALA 41 1HB ALA 41 -0.397 13.711 8.745
298 2HB ALA 41 2HB ALA 41 0.228 12.116 9.193
299 3HB ALA 41 3HB ALA 41 1.057 13.070 7.942
300 H ASN 42 H ASN 42 -2.840 13.431 8.055
301 HA ASN 42 HA ASN 42 -4.097 11.655 9.844
302 1HB ASN 42 2HB ASN 42 -5.470 13.687 8.025
303 2HB ASN 42 3HB ASN 42 -6.111 12.999 9.521
304 1HD2 ASN 42 1HD2 ASN 42 -4.574 15.721 8.246
305 2HD2 ASN 42 2HD2 ASN 42 -3.879 16.313 9.739
306 H GLN 43 H GLN 43 -4.825 12.191 6.372
307 HA GLN 43 HA GLN 43 -6.845 10.154 6.207
308 1HB GLN 43 2HB GLN 43 -5.502 12.051 4.380
309 2HB GLN 43 3HB GLN 43 -5.789 10.488 3.624
310 1HG GLN 43 2HG GLN 43 -7.945 12.064 5.079
311 2HG GLN 43 3HG GLN 43 -7.647 12.149 3.334
312 1HE2 GLN 43 1HE2 GLN 43 -10.176 11.375 4.243
313 2HE2 GLN 43 2HE2 GLN 43 -10.382 9.671 3.884
314 H VAL 44 H VAL 44 -3.279 10.212 5.554
315 HA VAL 44 HA VAL 44 -3.126 7.632 4.403
316 HB VAL 44 HB VAL 44 -1.232 9.485 5.899
317 1HG1 VAL 44 1HG1 VAL 44 0.617 8.152 4.944
318 2HG1 VAL 44 2HG1 VAL 44 -0.311 7.317 6.193
319 3HG1 VAL 44 3HG1 VAL 44 -0.579 6.916 4.465
320 1HG2 VAL 44 1HG2 VAL 44 -2.106 10.263 3.687
321 2HG2 VAL 44 2HG2 VAL 44 -0.377 9.934 3.632
322 3HG2 VAL 44 3HG2 VAL 44 -1.533 8.766 2.948
323 H LYS 45 H LYS 45 -2.952 8.757 7.824
324 HA LYS 45 HA LYS 45 -2.501 6.163 8.906
325 1HB LYS 45 2HB LYS 45 -2.123 8.397 9.982
326 2HB LYS 45 3HB LYS 45 -3.858 8.526 10.279
327 1HG LYS 45 2HG LYS 45 -3.796 7.012 11.997
328 2HG LYS 45 3HG LYS 45 -2.629 5.954 11.183
329 1HD LYS 45 2HD LYS 45 -0.798 7.539 11.656
330 2HD LYS 45 3HD LYS 45 -1.939 8.627 12.475
331 1HE LYS 45 2HE LYS 45 -2.396 6.848 14.169
332 2HE LYS 45 3HE LYS 45 -1.276 5.759 13.329
333 1HZ LYS 45 1HZ LYS 45 -0.216 6.824 15.186
334 2HZ LYS 45 2HZ LYS 45 0.495 7.327 13.792
335 3HZ LYS 45 3HZ LYS 45 -0.544 8.321 14.591
336 H ASP 46 H ASP 46 -5.576 8.035 8.456
337 HA ASP 46 HA ASP 46 -7.352 6.090 9.422
338 1HB ASP 46 2HB ASP 46 -7.561 8.329 7.434
339 2HB ASP 46 3HB ASP 46 -8.800 7.079 7.363
340 H VAL 47 H VAL 47 -6.182 6.398 6.009
341 HA VAL 47 HA VAL 47 -7.494 4.052 5.184
342 HB VAL 47 HB VAL 47 -6.118 3.947 3.240
343 1HG1 VAL 47 1HG1 VAL 47 -6.603 6.889 3.752
344 2HG1 VAL 47 2HG1 VAL 47 -6.820 5.970 2.262
345 3HG1 VAL 47 3HG1 VAL 47 -7.942 5.755 3.625
346 1HG2 VAL 47 1HG2 VAL 47 -4.321 5.441 2.747
347 2HG2 VAL 47 2HG2 VAL 47 -4.462 6.095 4.382
348 3HG2 VAL 47 3HG2 VAL 47 -3.898 4.422 4.142
349 H PHE 48 H PHE 48 -4.194 4.305 6.628
350 HA PHE 48 HA PHE 48 -3.610 1.542 6.532
351 1HB PHE 48 2HB PHE 48 -2.966 3.388 8.826
352 2HB PHE 48 3HB PHE 48 -2.208 1.844 8.461
353 HD1 PHE 48 HD1 PHE 48 -2.214 2.665 5.246
354 HD2 PHE 48 HD2 PHE 48 -0.693 4.309 8.946
355 HE1 PHE 48 HE1 PHE 48 -0.500 3.902 3.997
356 HE2 PHE 48 HE2 PHE 48 1.009 5.539 7.684
357 HZ PHE 48 HZ PHE 48 1.127 5.351 5.206
358 H ARG 49 H ARG 49 -5.738 3.259 8.865
359 HA ARG 49 HA ARG 49 -6.113 0.978 10.581
360 1HB ARG 49 2HB ARG 49 -8.147 3.158 9.960
361 2HB ARG 49 3HB ARG 49 -8.197 1.999 11.286
362 1HG ARG 49 2HG ARG 49 -6.075 2.935 12.197
363 2HG ARG 49 3HG ARG 49 -6.046 4.112 10.882
364 1HD ARG 49 2HD ARG 49 -7.002 5.307 12.711
365 2HD ARG 49 3HD ARG 49 -8.294 4.956 11.589
366 HE ARG 49 HE ARG 49 -9.344 3.634 13.129
367 1HH1 ARG 49 2HH2 ARG 49 -6.019 4.087 14.144
368 2HH1 ARG 49 1HH2 ARG 49 -6.226 3.476 15.760
369 1HH2 ARG 49 2HH1 ARG 49 -9.688 2.772 15.262
370 2HH2 ARG 49 1HH1 ARG 49 -8.379 2.687 16.393
371 H PHE 50 H PHE 50 -7.722 2.016 7.511
372 HA PHE 50 HA PHE 50 -9.549 -0.229 7.564
373 1HB PHE 50 2HB PHE 50 -8.657 1.323 5.137
374 2HB PHE 50 3HB PHE 50 -10.155 0.419 5.352
375 HD1 PHE 50 HD1 PHE 50 -10.970 1.455 8.137
376 HD2 PHE 50 HD2 PHE 50 -9.559 3.471 4.596
377 HE1 PHE 50 HE1 PHE 50 -11.707 3.619 9.067
378 HE2 PHE 50 HE2 PHE 50 -10.166 5.654 5.607
379 HZ PHE 50 HZ PHE 50 -11.210 5.735 7.858
380 H ILE 51 H ILE 51 -6.235 0.239 6.324
381 HA ILE 51 HA ILE 51 -6.137 -2.232 4.869
382 HB ILE 51 HB ILE 51 -3.811 -0.803 6.170
383 1HG1 ILE 51 2HG1 ILE 51 -4.632 0.812 4.642
384 2HG1 ILE 51 3HG1 ILE 51 -3.360 -0.019 3.786
385 1HG2 ILE 51 1HG2 ILE 51 -3.382 -3.193 5.483
386 2HG2 ILE 51 2HG2 ILE 51 -3.824 -2.746 3.833
387 3HG2 ILE 51 3HG2 ILE 51 -2.427 -1.988 4.627
388 1HD1 ILE 51 1HD1 ILE 51 -6.362 -0.382 3.411
389 2HD1 ILE 51 2HD1 ILE 51 -5.193 0.357 2.307
390 3HD1 ILE 51 3HD1 ILE 51 -5.135 -1.384 2.596
391 H ASP 52 H ASP 52 -4.918 -1.534 8.238
392 HA ASP 52 HA ASP 52 -4.376 -4.368 8.610
393 1HB ASP 52 2HB ASP 52 -3.010 -2.601 9.736
394 2HB ASP 52 3HB ASP 52 -4.386 -2.243 10.786
395 H ASN 53 H ASN 53 -6.569 -4.928 7.950
396 HA ASN 53 HA ASN 53 -8.973 -4.646 9.275
397 1HB ASN 53 2HB ASN 53 -8.510 -5.966 7.207
398 2HB ASN 53 3HB ASN 53 -7.763 -7.234 8.171
399 1HD2 ASN 53 1HD2 ASN 53 -9.099 -8.831 9.019
400 2HD2 ASN 53 2HD2 ASN 53 -10.852 -8.738 8.994
401 H ASP 54 H ASP 54 -6.385 -6.988 9.997
402 HA ASP 54 HA ASP 54 -7.505 -8.300 12.171
403 1HB ASP 54 2HB ASP 54 -4.558 -7.782 11.624
404 2HB ASP 54 3HB ASP 54 -5.263 -9.176 12.453
405 H GLN 55 H GLN 55 -6.150 -5.106 12.043
406 HA GLN 55 HA GLN 55 -5.664 -3.527 13.476
407 1HB GLN 55 2HB GLN 55 -7.263 -2.974 14.947
408 2HB GLN 55 3HB GLN 55 -8.101 -4.238 14.053
409 1HG GLN 55 2HG GLN 55 -7.298 -5.817 15.993
410 2HG GLN 55 3HG GLN 55 -6.906 -4.325 16.842
411 1HE2 GLN 55 1HE2 GLN 55 -8.564 -3.474 18.090
412 2HE2 GLN 55 2HE2 GLN 55 -10.256 -3.888 17.857
413 H SER 56 H SER 56 -4.153 -6.229 13.750
414 HA SER 56 HA SER 56 -3.338 -6.467 16.417
415 1HB SER 56 2HB SER 56 -1.499 -7.911 15.297
416 2HB SER 56 3HB SER 56 -3.204 -8.351 15.096
417 HG SER 56 HG SER 56 -2.253 -8.430 13.086
418 H GLY 57 H GLY 57 -2.338 -3.992 14.253
419 1HA GLY 57 1HA GLY 57 -1.063 -2.175 14.898
420 2HA GLY 57 2HA GLY 57 -0.526 -3.031 16.347
421 H TYR 58 H TYR 58 -0.308 -4.174 13.021
422 HA TYR 58 HA TYR 58 2.269 -3.348 12.282
423 1HB TYR 58 2HB TYR 58 2.087 -6.020 13.705
424 2HB TYR 58 3HB TYR 58 3.010 -5.954 12.216
425 HD1 TYR 58 HD1 TYR 58 4.584 -3.751 12.024
426 HD2 TYR 58 HD2 TYR 58 3.574 -5.946 15.582
427 HE1 TYR 58 HE1 TYR 58 6.670 -2.961 13.082
428 HE2 TYR 58 HE2 TYR 58 5.721 -5.250 16.610
429 HH TYR 58 HH TYR 58 7.685 -2.734 15.340
430 H LEU 59 H LEU 59 2.481 -3.778 10.083
431 HA LEU 59 HA LEU 59 0.180 -5.209 8.795
432 1HB LEU 59 2HB LEU 59 2.069 -3.019 7.916
433 2HB LEU 59 3HB LEU 59 1.124 -3.976 6.765
434 HG LEU 59 HG LEU 59 0.100 -1.819 7.221
435 1HD1 LEU 59 1HD1 LEU 59 -1.652 -4.088 8.239
436 2HD1 LEU 59 2HD1 LEU 59 -2.158 -2.578 7.465
437 3HD1 LEU 59 3HD1 LEU 59 -1.249 -3.785 6.537
438 1HD2 LEU 59 1HD2 LEU 59 0.768 -1.587 9.627
439 2HD2 LEU 59 2HD2 LEU 59 -0.929 -1.206 9.280
440 3HD2 LEU 59 3HD2 LEU 59 -0.518 -2.747 10.042
441 H ASP 60 H ASP 60 1.430 -7.043 9.776
442 HA ASP 60 HA ASP 60 3.853 -7.993 8.843
443 1HB ASP 60 2HB ASP 60 1.379 -9.665 9.437
444 2HB ASP 60 3HB ASP 60 3.070 -10.135 9.665
445 H GLU 61 H GLU 61 4.497 -9.376 7.091
446 HA GLU 61 HA GLU 61 3.649 -8.802 4.588
447 1HB GLU 61 2HB GLU 61 4.936 -11.366 5.602
448 2HB GLU 61 3HB GLU 61 4.515 -11.119 3.907
449 1HG GLU 61 2HG GLU 61 5.846 -8.937 3.993
450 2HG GLU 61 3HG GLU 61 6.546 -9.553 5.502
451 H GLU 62 H GLU 62 2.458 -11.670 6.407
452 HA GLU 62 HA GLU 62 0.898 -12.491 4.170
453 1HB GLU 62 2HB GLU 62 1.858 -13.954 6.027
454 2HB GLU 62 3HB GLU 62 0.442 -13.509 6.997
455 1HG GLU 62 2HG GLU 62 -1.048 -14.484 5.342
456 2HG GLU 62 3HG GLU 62 0.268 -14.606 4.152
457 H GLU 63 H GLU 63 0.250 -10.095 6.598
458 HA GLU 63 HA GLU 63 -2.645 -10.041 6.084
459 1HB GLU 63 2HB GLU 63 -0.830 -7.947 7.299
460 2HB GLU 63 3HB GLU 63 -2.594 -7.949 7.285
461 1HG GLU 63 2HG GLU 63 -2.649 -9.919 8.758
462 2HG GLU 63 3HG GLU 63 -0.871 -9.991 8.771
463 H LEU 64 H LEU 64 0.350 -8.303 5.202
464 HA LEU 64 HA LEU 64 -0.746 -6.442 3.384
465 1HB LEU 64 2HB LEU 64 1.394 -5.956 3.983
466 2HB LEU 64 3HB LEU 64 1.923 -7.617 3.897
467 HG LEU 64 HG LEU 64 1.998 -7.507 1.422
468 1HD1 LEU 64 1HD1 LEU 64 0.510 -5.637 0.869
469 2HD1 LEU 64 2HD1 LEU 64 1.466 -4.528 1.871
470 3HD1 LEU 64 3HD1 LEU 64 2.138 -5.230 0.380
471 1HD2 LEU 64 1HD2 LEU 64 3.628 -5.459 2.986
472 2HD2 LEU 64 2HD2 LEU 64 3.997 -7.187 2.808
473 3HD2 LEU 64 3HD2 LEU 64 4.064 -6.118 1.400
474 H LYS 65 H LYS 65 -0.088 -9.897 2.932
475 HA LYS 65 HA LYS 65 -0.534 -10.144 0.206
476 1HB LYS 65 2HB LYS 65 -0.070 -11.981 1.893
477 2HB LYS 65 3HB LYS 65 -1.812 -11.981 2.245
478 1HG LYS 65 2HG LYS 65 -2.304 -12.583 -0.100
479 2HG LYS 65 3HG LYS 65 -0.599 -12.414 -0.522
480 1HD LYS 65 2HD LYS 65 -1.267 -14.742 -0.321
481 2HD LYS 65 3HD LYS 65 -0.025 -14.344 0.879
482 1HE LYS 65 2HE LYS 65 -1.587 -14.342 2.688
483 2HE LYS 65 3HE LYS 65 -2.984 -14.219 1.609
484 1HZ LYS 65 1HZ LYS 65 -2.704 -16.412 2.542
485 2HZ LYS 65 2HZ LYS 65 -2.593 -16.450 0.900
486 3HZ LYS 65 3HZ LYS 65 -1.236 -16.582 1.840
487 H PHE 66 H PHE 66 -2.924 -8.853 2.449
488 HA PHE 66 HA PHE 66 -4.724 -8.640 0.102
489 1HB PHE 66 2HB PHE 66 -6.673 -8.737 1.716
490 2HB PHE 66 3HB PHE 66 -5.817 -10.239 1.453
491 HD1 PHE 66 HD1 PHE 66 -4.782 -11.430 3.262
492 HD2 PHE 66 HD2 PHE 66 -6.250 -7.422 3.911
493 HE1 PHE 66 HE1 PHE 66 -4.650 -11.768 5.710
494 HE2 PHE 66 HE2 PHE 66 -5.996 -7.745 6.361
495 HZ PHE 66 HZ PHE 66 -5.270 -9.927 7.262
496 H PHE 67 H PHE 67 -2.655 -6.805 0.950
497 HA PHE 67 HA PHE 67 -3.680 -4.596 2.373
498 1HB PHE 67 2HB PHE 67 -1.359 -4.871 1.919
499 2HB PHE 67 3HB PHE 67 -1.585 -4.807 0.188
500 HD1 PHE 67 HD1 PHE 67 -0.828 -2.921 3.157
501 HD2 PHE 67 HD2 PHE 67 -2.087 -2.636 -0.943
502 HE1 PHE 67 HE1 PHE 67 -0.251 -0.511 3.143
503 HE2 PHE 67 HE2 PHE 67 -1.618 -0.211 -0.929
504 HZ PHE 67 HZ PHE 67 -0.687 0.863 1.115
505 H LEU 68 H LEU 68 -3.346 -4.691 -1.230
506 HA LEU 68 HA LEU 68 -5.343 -2.587 -1.457
507 1HB LEU 68 2HB LEU 68 -3.108 -3.185 -2.879
508 2HB LEU 68 3HB LEU 68 -4.316 -4.032 -3.822
509 HG LEU 68 HG LEU 68 -5.563 -1.745 -3.874
510 1HD1 LEU 68 1HD1 LEU 68 -4.200 -0.702 -2.030
511 2HD1 LEU 68 2HD1 LEU 68 -2.751 -0.880 -3.039
512 3HD1 LEU 68 3HD1 LEU 68 -4.059 0.201 -3.552
513 1HD2 LEU 68 1HD2 LEU 68 -4.504 -2.584 -5.871
514 2HD2 LEU 68 2HD2 LEU 68 -4.016 -0.899 -5.691
515 3HD2 LEU 68 3HD2 LEU 68 -2.884 -2.197 -5.250
516 H GLN 69 H GLN 69 -5.618 -5.979 -1.293
517 HA GLN 69 HA GLN 69 -7.800 -6.601 -3.009
518 1HB GLN 69 2HB GLN 69 -7.119 -7.565 -0.215
519 2HB GLN 69 3HB GLN 69 -8.413 -8.255 -1.186
520 1HG GLN 69 2HG GLN 69 -5.501 -8.270 -2.045
521 2HG GLN 69 3HG GLN 69 -6.336 -9.591 -1.225
522 1HE2 GLN 69 1HE2 GLN 69 -5.757 -8.095 -4.308
523 2HE2 GLN 69 2HE2 GLN 69 -6.805 -9.190 -5.205
524 H LYS 70 H LYS 70 -7.622 -4.490 -0.202
525 HA LYS 70 HA LYS 70 -10.488 -4.616 0.407
526 1HB LYS 70 2HB LYS 70 -8.497 -2.570 1.417
527 2HB LYS 70 3HB LYS 70 -10.022 -3.115 2.138
528 1HG LYS 70 2HG LYS 70 -8.792 -5.508 2.132
529 2HG LYS 70 3HG LYS 70 -7.345 -4.524 1.952
530 1HD LYS 70 2HD LYS 70 -7.518 -4.895 4.239
531 2HD LYS 70 3HD LYS 70 -8.028 -3.228 4.003
532 1HE LYS 70 2HE LYS 70 -10.289 -5.187 3.835
533 2HE LYS 70 3HE LYS 70 -9.413 -5.292 5.356
534 1HZ LYS 70 1HZ LYS 70 -11.158 -3.747 5.572
535 2HZ LYS 70 2HZ LYS 70 -9.718 -2.945 5.652
536 3HZ LYS 70 3HZ LYS 70 -10.630 -2.855 4.283
537 H PHE 71 H PHE 71 -8.511 -3.001 -1.900
538 HA PHE 71 HA PHE 71 -10.401 -0.710 -2.245
539 1HB PHE 71 2HB PHE 71 -7.674 -1.235 -3.462
540 2HB PHE 71 3HB PHE 71 -8.677 0.181 -3.702
541 HD1 PHE 71 HD1 PHE 71 -8.961 -0.406 -0.213
542 HD2 PHE 71 HD2 PHE 71 -6.200 0.955 -3.225
543 HE1 PHE 71 HE1 PHE 71 -7.672 0.794 1.503
544 HE2 PHE 71 HE2 PHE 71 -5.011 2.303 -1.523
545 HZ PHE 71 HZ PHE 71 -5.751 2.232 0.847
546 H GLU 72 H GLU 72 -8.629 -3.281 -4.015
547 HA GLU 72 HA GLU 72 -10.742 -3.354 -6.128
548 1HB GLU 72 2HB GLU 72 -7.932 -2.871 -6.422
549 2HB GLU 72 3HB GLU 72 -8.175 -4.554 -6.886
550 1HG GLU 72 2HG GLU 72 -9.732 -2.192 -8.024
551 2HG GLU 72 3HG GLU 72 -8.312 -2.932 -8.774
552 H SER 73 H SER 73 -10.870 -5.672 -6.965
553 HA SER 73 HA SER 73 -10.771 -7.616 -4.683
554 1HB SER 73 2HB SER 73 -12.037 -7.865 -7.446
555 2HB SER 73 3HB SER 73 -12.171 -9.013 -6.098
556 HG SER 73 HG SER 73 -12.981 -6.980 -4.945
557 H GLY 74 H GLY 74 -9.420 -6.772 -7.813
558 1HA GLY 74 1HA GLY 74 -7.861 -9.352 -7.984
559 2HA GLY 74 2HA GLY 74 -8.490 -8.434 -9.361
560 H ALA 75 H ALA 75 -6.988 -7.196 -6.389
561 HA ALA 75 HA ALA 75 -5.141 -5.541 -7.893
562 1HB ALA 75 1HB ALA 75 -4.376 -4.811 -5.762
563 2HB ALA 75 2HB ALA 75 -6.142 -4.813 -5.758
564 3HB ALA 75 3HB ALA 75 -5.262 -6.101 -4.908
565 H ARG 76 H ARG 76 -2.739 -5.765 -6.325
566 HA ARG 76 HA ARG 76 -1.679 -7.903 -8.063
567 1HB ARG 76 2HB ARG 76 -0.941 -5.278 -7.823
568 2HB ARG 76 3HB ARG 76 0.094 -5.984 -6.578
569 1HG ARG 76 2HG ARG 76 1.318 -6.019 -8.607
570 2HG ARG 76 3HG ARG 76 0.843 -7.688 -8.301
571 1HD ARG 76 2HD ARG 76 -0.272 -7.769 -10.331
572 2HD ARG 76 3HD ARG 76 -1.329 -6.478 -9.803
573 HE ARG 76 HE ARG 76 -0.212 -4.948 -11.071
574 1HH1 ARG 76 2HH2 ARG 76 1.740 -7.865 -10.775
575 2HH1 ARG 76 1HH2 ARG 76 3.187 -7.004 -11.233
576 1HH2 ARG 76 2HH1 ARG 76 1.615 -4.056 -12.137
577 2HH2 ARG 76 1HH1 ARG 76 3.005 -5.076 -12.493
578 H GLU 77 H GLU 77 -2.284 -7.280 -4.825
579 HA GLU 77 HA GLU 77 -0.351 -7.934 -3.316
580 1HB GLU 77 2HB GLU 77 -2.928 -9.282 -2.565
581 2HB GLU 77 3HB GLU 77 -1.795 -8.340 -1.577
582 1HG GLU 77 2HG GLU 77 -3.913 -7.370 -3.513
583 2HG GLU 77 3HG GLU 77 -3.712 -7.000 -1.794
584 H LEU 78 H LEU 78 -2.287 -10.452 -4.772
585 HA LEU 78 HA LEU 78 -1.198 -12.779 -3.774
586 1HB LEU 78 2HB LEU 78 -1.791 -12.496 -6.735
587 2HB LEU 78 3HB LEU 78 -1.883 -13.921 -5.712
588 HG LEU 78 HG LEU 78 -4.070 -13.509 -5.949
589 1HD1 LEU 78 1HD1 LEU 78 -3.624 -13.347 -3.497
590 2HD1 LEU 78 2HD1 LEU 78 -3.734 -11.576 -3.627
591 3HD1 LEU 78 3HD1 LEU 78 -5.124 -12.578 -4.039
592 1HD2 LEU 78 1HD2 LEU 78 -3.958 -11.652 -7.428
593 2HD2 LEU 78 2HD2 LEU 78 -5.163 -11.299 -6.181
594 3HD2 LEU 78 3HD2 LEU 78 -3.576 -10.520 -6.125
595 H THR 79 H THR 79 0.289 -10.727 -6.357
596 HA THR 79 HA THR 79 2.480 -12.560 -6.819
597 HB THR 79 HB THR 79 2.339 -9.584 -7.453
598 HG1 THR 79 1HG THR 79 2.288 -11.032 -9.554
599 1HG2 THR 79 1HG2 THR 79 4.122 -10.233 -9.113
600 2HG2 THR 79 2HG2 THR 79 4.654 -10.539 -7.458
601 3HG2 THR 79 3HG2 THR 79 4.110 -11.880 -8.469
602 H GLU 80 H GLU 80 3.630 -13.043 -5.087
603 HA GLU 80 HA GLU 80 4.208 -11.469 -2.847
604 1HB GLU 80 2HB GLU 80 6.032 -13.588 -4.049
605 2HB GLU 80 3HB GLU 80 6.199 -12.772 -2.481
606 1HG GLU 80 2HG GLU 80 4.002 -13.671 -1.764
607 2HG GLU 80 3HG GLU 80 3.906 -14.599 -3.272
608 H SER 81 H SER 81 6.059 -11.627 -5.915
609 HA SER 81 HA SER 81 8.316 -10.144 -5.160
610 1HB SER 81 2HB SER 81 8.045 -11.352 -7.324
611 2HB SER 81 3HB SER 81 6.878 -10.130 -7.852
612 HG SER 81 HG SER 81 8.731 -9.576 -8.685
613 H GLU 82 H GLU 82 5.281 -8.895 -6.616
614 HA GLU 82 HA GLU 82 5.997 -6.144 -6.526
615 1HB GLU 82 2HB GLU 82 3.243 -7.455 -6.534
616 2HB GLU 82 3HB GLU 82 3.595 -5.805 -7.035
617 1HG GLU 82 2HG GLU 82 4.841 -8.218 -8.461
618 2HG GLU 82 3HG GLU 82 3.254 -7.584 -8.869
619 H THR 83 H THR 83 4.006 -8.231 -4.393
620 HA THR 83 HA THR 83 3.428 -6.349 -2.430
621 HB THR 83 HB THR 83 3.445 -9.286 -2.649
622 HG1 THR 83 1HG THR 83 1.777 -8.184 -0.898
623 1HG2 THR 83 1HG2 THR 83 4.838 -9.368 -0.675
624 2HG2 THR 83 2HG2 THR 83 3.847 -8.146 0.140
625 3HG2 THR 83 3HG2 THR 83 3.180 -9.748 -0.236
626 H LYS 84 H LYS 84 6.394 -8.309 -2.810
627 HA LYS 84 HA LYS 84 7.554 -7.386 -0.336
628 1HB LYS 84 2HB LYS 84 8.567 -9.120 -2.596
629 2HB LYS 84 3HB LYS 84 9.613 -8.595 -1.264
630 1HG LYS 84 2HG LYS 84 8.180 -9.570 0.415
631 2HG LYS 84 3HG LYS 84 6.935 -9.935 -0.776
632 1HD LYS 84 2HD LYS 84 8.289 -11.608 -1.847
633 2HD LYS 84 3HD LYS 84 9.684 -11.220 -0.807
634 1HE LYS 84 2HE LYS 84 8.518 -11.924 1.194
635 2HE LYS 84 3HE LYS 84 6.968 -12.041 0.347
636 1HZ LYS 84 1HZ LYS 84 9.233 -13.825 -0.219
637 2HZ LYS 84 2HZ LYS 84 7.972 -14.154 0.789
638 3HZ LYS 84 3HZ LYS 84 7.680 -13.953 -0.782
639 H SER 85 H SER 85 7.693 -6.323 -3.704
640 HA SER 85 HA SER 85 9.806 -4.427 -3.403
641 1HB SER 85 2HB SER 85 7.328 -4.228 -5.182
642 2HB SER 85 3HB SER 85 8.839 -3.337 -5.353
643 HG SER 85 HG SER 85 8.522 -6.174 -5.512
644 H LEU 86 H LEU 86 6.261 -4.208 -2.836
645 HA LEU 86 HA LEU 86 6.282 -1.547 -1.754
646 1HB LEU 86 2HB LEU 86 4.299 -2.625 -2.566
647 2HB LEU 86 3HB LEU 86 4.370 -3.867 -1.332
648 HG LEU 86 HG LEU 86 2.679 -2.102 -1.002
649 1HD1 LEU 86 1HD1 LEU 86 4.560 -2.011 1.365
650 2HD1 LEU 86 2HD1 LEU 86 2.788 -2.050 1.285
651 3HD1 LEU 86 3HD1 LEU 86 3.717 -3.499 0.886
652 1HD2 LEU 86 1HD2 LEU 86 4.979 -0.239 -0.286
653 2HD2 LEU 86 2HD2 LEU 86 4.018 -0.146 -1.780
654 3HD2 LEU 86 3HD2 LEU 86 3.239 0.097 -0.207
655 H MET 87 H MET 87 6.251 -4.704 -0.001
656 HA MET 87 HA MET 87 6.655 -3.814 2.542
657 1HB MET 87 2HB MET 87 6.454 -6.242 1.783
658 2HB MET 87 3HB MET 87 8.167 -6.164 1.362
659 1HG MET 87 2HG MET 87 8.450 -5.374 3.897
660 2HG MET 87 3HG MET 87 6.866 -6.135 4.066
661 1HE MET 87 1HE MET 87 10.678 -6.527 3.460
662 2HE MET 87 2HE MET 87 10.845 -8.262 3.105
663 3HE MET 87 3HE MET 87 10.104 -7.184 1.905
664 H ALA 88 H ALA 88 9.246 -4.481 0.191
665 HA ALA 88 HA ALA 88 11.501 -4.200 1.710
666 1HB ALA 88 1HB ALA 88 11.011 -3.480 -1.216
667 2HB ALA 88 2HB ALA 88 12.625 -3.590 -0.476
668 3HB ALA 88 3HB ALA 88 11.583 -5.020 -0.564
669 H ALA 89 H ALA 89 9.876 -1.545 -0.086
670 HA ALA 89 HA ALA 89 11.738 0.453 1.000
671 1HB ALA 89 1HB ALA 89 9.200 0.627 -0.622
672 2HB ALA 89 2HB ALA 89 10.163 2.044 -0.157
673 3HB ALA 89 3HB ALA 89 10.892 0.803 -1.190
674 H ALA 90 H ALA 90 8.346 -0.582 1.614
675 HA ALA 90 HA ALA 90 7.611 1.487 3.422
676 1HB ALA 90 1HB ALA 90 6.800 -1.442 3.418
677 2HB ALA 90 2HB ALA 90 5.923 -0.096 4.180
678 3HB ALA 90 3HB ALA 90 6.068 -0.178 2.407
679 H ASP 91 H ASP 91 9.382 -1.564 3.963
680 HA ASP 91 HA ASP 91 9.408 -1.220 6.815
681 1HB ASP 91 2HB ASP 91 9.423 -3.448 5.608
682 2HB ASP 91 3HB ASP 91 11.116 -3.147 5.179
683 H ASN 92 H ASN 92 10.334 0.915 6.975
684 HA ASN 92 HA ASN 92 13.127 1.318 6.186
685 1HB ASN 92 2HB ASN 92 12.952 3.487 7.182
686 2HB ASN 92 3HB ASN 92 11.537 3.173 6.170
687 1HD2 ASN 92 1HD2 ASN 92 11.251 5.261 7.928
688 2HD2 ASN 92 2HD2 ASN 92 10.251 4.752 9.265
689 H ASP 93 H ASP 93 12.996 -0.993 7.649
690 HA ASP 93 HA ASP 93 14.675 -0.379 10.047
691 1HB ASP 93 2HB ASP 93 12.566 -2.574 9.763
692 2HB ASP 93 3HB ASP 93 13.877 -2.623 10.934
693 H GLY 94 H GLY 94 13.508 -2.976 7.843
694 1HA GLY 94 1HA GLY 94 14.856 -4.536 6.645
695 2HA GLY 94 2HA GLY 94 16.261 -4.127 7.643
696 H ASP 95 H ASP 95 12.823 -4.726 8.512
697 HA ASP 95 HA ASP 95 13.607 -7.238 9.898
698 1HB ASP 95 2HB ASP 95 12.248 -6.874 11.777
699 2HB ASP 95 3HB ASP 95 13.411 -5.555 11.657
700 H GLY 96 H GLY 96 10.843 -5.311 8.698
701 1HA GLY 96 1HA GLY 96 9.842 -6.191 6.606
702 2HA GLY 96 2HA GLY 96 9.855 -7.814 7.300
703 H LYS 97 H LYS 97 9.101 -6.782 9.974
704 HA LYS 97 HA LYS 97 6.195 -6.588 9.679
705 1HB LYS 97 2HB LYS 97 6.185 -6.322 12.120
706 2HB LYS 97 3HB LYS 97 7.025 -7.771 11.569
707 1HG LYS 97 2HG LYS 97 9.221 -6.653 11.946
708 2HG LYS 97 3HG LYS 97 8.363 -5.212 12.522
709 1HD LYS 97 2HD LYS 97 7.359 -6.582 14.353
710 2HD LYS 97 3HD LYS 97 8.200 -8.003 13.738
711 1HE LYS 97 2HE LYS 97 9.375 -7.003 15.684
712 2HE LYS 97 3HE LYS 97 10.383 -7.044 14.226
713 1HZ LYS 97 1HZ LYS 97 10.052 -4.791 13.881
714 2HZ LYS 97 2HZ LYS 97 8.919 -4.630 15.091
715 3HZ LYS 97 3HZ LYS 97 10.511 -4.945 15.430
716 H ILE 98 H ILE 98 5.299 -4.728 8.944
717 HA ILE 98 HA ILE 98 6.827 -2.194 9.151
718 HB ILE 98 HB ILE 98 4.605 -3.102 7.338
719 1HG1 ILE 98 2HG1 ILE 98 7.357 -2.215 6.465
720 2HG1 ILE 98 3HG1 ILE 98 7.234 -3.812 7.172
721 1HG2 ILE 98 1HG2 ILE 98 6.196 -0.490 7.325
722 2HG2 ILE 98 2HG2 ILE 98 5.007 -0.987 6.124
723 3HG2 ILE 98 3HG2 ILE 98 4.485 -0.626 7.773
724 1HD1 ILE 98 1HD1 ILE 98 5.507 -2.873 4.849
725 2HD1 ILE 98 2HD1 ILE 98 7.017 -3.799 4.732
726 3HD1 ILE 98 3HD1 ILE 98 5.599 -4.513 5.534
727 H GLY 99 H GLY 99 6.279 -0.925 10.858
728 1HA GLY 99 1HA GLY 99 3.656 -0.934 12.099
729 2HA GLY 99 2HA GLY 99 4.953 0.245 12.346
730 H ALA 100 H ALA 100 2.234 0.974 12.220
731 HA ALA 100 HA ALA 100 1.405 2.081 9.721
732 1HB ALA 100 1HB ALA 100 0.093 3.639 11.144
733 2HB ALA 100 2HB ALA 100 -0.102 1.948 11.648
734 3HB ALA 100 3HB ALA 100 0.947 3.044 12.580
735 H GLU 101 H GLU 101 3.557 3.212 12.309
736 HA GLU 101 HA GLU 101 4.053 5.800 11.385
737 1HB GLU 101 2HB GLU 101 4.941 4.157 13.503
738 2HB GLU 101 3HB GLU 101 6.424 4.515 12.616
739 1HG GLU 101 2HG GLU 101 6.049 6.900 12.860
740 2HG GLU 101 3HG GLU 101 4.417 6.632 13.508
741 H GLU 102 H GLU 102 5.921 2.800 10.755
742 HA GLU 102 HA GLU 102 7.822 3.753 8.954
743 1HB GLU 102 2HB GLU 102 6.372 1.080 8.823
744 2HB GLU 102 3HB GLU 102 7.961 1.472 8.157
745 1HG GLU 102 2HG GLU 102 8.749 1.878 10.535
746 2HG GLU 102 3HG GLU 102 7.194 1.265 11.110
747 H PHE 103 H PHE 103 4.536 2.437 8.249
748 HA PHE 103 HA PHE 103 4.703 2.963 5.445
749 1HB PHE 103 2HB PHE 103 2.441 2.385 7.351
750 2HB PHE 103 3HB PHE 103 2.076 3.104 5.797
751 HD1 PHE 103 HD1 PHE 103 3.240 2.173 3.669
752 HD2 PHE 103 HD2 PHE 103 2.204 -0.013 7.240
753 HE1 PHE 103 HE1 PHE 103 3.038 0.093 2.338
754 HE2 PHE 103 HE2 PHE 103 2.116 -2.108 5.894
755 HZ PHE 103 HZ PHE 103 2.490 -2.065 3.483
756 H GLN 104 H GLN 104 3.510 5.060 8.106
757 HA GLN 104 HA GLN 104 2.501 7.204 6.464
758 1HB GLN 104 2HB GLN 104 2.251 6.843 9.037
759 2HB GLN 104 3HB GLN 104 3.839 7.609 9.161
760 1HG GLN 104 2HG GLN 104 2.929 9.533 7.797
761 2HG GLN 104 3HG GLN 104 1.337 8.760 7.837
762 1HE2 GLN 104 1HE2 GLN 104 2.861 11.257 9.167
763 2HE2 GLN 104 2HE2 GLN 104 2.186 11.227 10.785
764 H GLU 105 H GLU 105 5.775 6.673 7.945
765 HA GLU 105 HA GLU 105 7.153 8.848 6.836
766 1HB GLU 105 2HB GLU 105 7.866 6.027 7.629
767 2HB GLU 105 3HB GLU 105 9.031 6.896 6.643
768 1HG GLU 105 2HG GLU 105 7.887 8.257 9.094
769 2HG GLU 105 3HG GLU 105 9.156 7.034 9.257
770 H MET 106 H MET 106 6.804 5.577 5.329
771 HA MET 106 HA MET 106 8.195 6.438 3.025
772 1HB MET 106 2HB MET 106 7.163 3.970 3.955
773 2HB MET 106 3HB MET 106 6.362 4.230 2.401
774 1HG MET 106 2HG MET 106 9.341 4.349 2.995
775 2HG MET 106 3HG MET 106 8.524 3.062 2.110
776 1HE MET 106 1HE MET 106 11.008 3.865 0.879
777 2HE MET 106 2HE MET 106 11.054 5.295 -0.182
778 3HE MET 106 3HE MET 106 11.032 5.496 1.581
779 H VAL 107 H VAL 107 4.703 6.272 3.664
780 HA VAL 107 HA VAL 107 3.882 7.166 1.064
781 HB VAL 107 HB VAL 107 2.544 7.230 3.798
782 1HG1 VAL 107 1HG1 VAL 107 1.520 9.016 2.525
783 2HG1 VAL 107 2HG1 VAL 107 1.507 8.012 1.056
784 3HG1 VAL 107 3HG1 VAL 107 0.442 7.616 2.419
785 1HG2 VAL 107 1HG2 VAL 107 2.929 4.966 2.700
786 2HG2 VAL 107 2HG2 VAL 107 1.212 5.385 2.854
787 3HG2 VAL 107 3HG2 VAL 107 2.024 5.567 1.297
788 H HIS 108 H HIS 108 4.944 8.929 3.997
789 HA HIS 108 HA HIS 108 3.800 11.429 3.281
790 1HB HIS 108 2HB HIS 108 4.285 10.898 5.568
791 2HB HIS 108 3HB HIS 108 5.996 10.622 5.214
792 HD1 HIS 108 1HD HIS 108 3.485 13.532 5.501
793 HD2 HIS 108 2HD HIS 108 7.602 12.668 5.451
794 HE1 HIS 108 1HE HIS 108 4.692 15.660 6.247
795 H SER 109 H SER 109 6.650 9.682 2.358
796 HA SER 109 HA SER 109 8.283 11.823 1.532
797 1HB SER 109 2HB SER 109 9.082 9.469 1.880
798 2HB SER 109 3HB SER 109 8.183 9.002 0.414
799 HG SER 109 HG SER 109 9.413 10.822 -0.569
Start of MODEL 2
1 1H MET 1 H1 MET 1 -15.705 0.588 2.445
2 2H MET 1 H2 MET 1 -16.468 0.441 0.991
3 3H MET 1 H3 MET 1 -15.051 1.276 1.104
4 HA MET 1 HA MET 1 -16.923 2.796 0.941
5 1HB MET 1 2HB MET 1 -17.766 1.222 3.394
6 2HB MET 1 3HB MET 1 -18.377 2.846 3.045
7 1HG MET 1 2HG MET 1 -19.343 2.162 0.960
8 2HG MET 1 3HG MET 1 -18.694 0.519 1.115
9 1HE MET 1 1HE MET 1 -21.790 1.454 0.569
10 2HE MET 1 2HE MET 1 -21.207 -0.230 0.504
11 3HE MET 1 3HE MET 1 -22.612 0.191 1.513
12 H SER 2 H SER 2 -14.630 3.665 1.137
13 HA SER 2 HA SER 2 -14.533 5.510 3.293
14 1HB SER 2 2HB SER 2 -12.215 3.507 3.287
15 2HB SER 2 3HB SER 2 -12.454 4.905 4.344
16 HG SER 2 HG SER 2 -14.526 3.598 4.843
17 H ILE 3 H ILE 3 -12.163 3.784 1.275
18 HA ILE 3 HA ILE 3 -10.972 6.340 0.450
19 HB ILE 3 HB ILE 3 -9.081 5.080 -0.167
20 1HG1 ILE 3 2HG1 ILE 3 -9.331 2.442 0.202
21 2HG1 ILE 3 3HG1 ILE 3 -10.963 2.723 -0.359
22 1HG2 ILE 3 1HG2 ILE 3 -8.484 4.016 1.869
23 2HG2 ILE 3 2HG2 ILE 3 -9.657 5.280 2.298
24 3HG2 ILE 3 3HG2 ILE 3 -10.146 3.575 2.248
25 1HD1 ILE 3 1HD1 ILE 3 -9.535 2.146 -2.246
26 2HD1 ILE 3 2HD1 ILE 3 -9.910 3.859 -2.434
27 3HD1 ILE 3 3HD1 ILE 3 -8.338 3.369 -1.783
28 H THR 4 H THR 4 -12.904 3.709 -0.959
29 HA THR 4 HA THR 4 -12.334 3.973 -3.604
30 HB THR 4 HB THR 4 -13.240 2.009 -2.355
31 HG1 THR 4 1HG THR 4 -14.532 3.279 -4.370
32 1HG2 THR 4 1HG2 THR 4 -14.867 3.235 -0.814
33 2HG2 THR 4 2HG2 THR 4 -15.867 3.592 -2.230
34 3HG2 THR 4 3HG2 THR 4 -15.612 1.915 -1.736
35 H ASP 5 H ASP 5 -14.013 6.201 -1.588
36 HA ASP 5 HA ASP 5 -15.145 7.540 -3.965
37 1HB ASP 5 2HB ASP 5 -16.933 6.164 -2.825
38 2HB ASP 5 3HB ASP 5 -16.654 7.105 -1.345
39 H VAL 6 H VAL 6 -12.694 7.846 -2.259
40 HA VAL 6 HA VAL 6 -13.248 10.589 -1.186
41 HB VAL 6 HB VAL 6 -12.012 8.710 0.153
42 1HG1 VAL 6 1HG1 VAL 6 -9.560 9.905 -1.070
43 2HG1 VAL 6 2HG1 VAL 6 -9.696 8.581 0.087
44 3HG1 VAL 6 3HG1 VAL 6 -10.233 8.340 -1.577
45 1HG2 VAL 6 1HG2 VAL 6 -12.412 10.954 0.998
46 2HG2 VAL 6 2HG2 VAL 6 -10.765 10.429 1.389
47 3HG2 VAL 6 3HG2 VAL 6 -11.033 11.575 0.057
48 H LEU 7 H LEU 7 -11.206 8.761 -3.384
49 HA LEU 7 HA LEU 7 -10.722 10.747 -5.309
50 1HB LEU 7 2HB LEU 7 -9.659 12.076 -3.629
51 2HB LEU 7 3HB LEU 7 -8.845 10.701 -2.912
52 HG LEU 7 HG LEU 7 -7.959 11.012 -5.677
53 1HD1 LEU 7 1HD1 LEU 7 -6.854 13.223 -5.288
54 2HD1 LEU 7 2HD1 LEU 7 -8.632 13.350 -5.307
55 3HD1 LEU 7 3HD1 LEU 7 -7.763 13.370 -3.756
56 1HD2 LEU 7 1HD2 LEU 7 -6.547 11.342 -2.976
57 2HD2 LEU 7 2HD2 LEU 7 -6.745 9.800 -3.835
58 3HD2 LEU 7 3HD2 LEU 7 -5.773 11.086 -4.550
59 H SER 8 H SER 8 -8.889 8.473 -3.238
60 HA SER 8 HA SER 8 -7.065 7.494 -4.837
61 1HB SER 8 2HB SER 8 -7.816 5.216 -3.384
62 2HB SER 8 3HB SER 8 -6.649 6.464 -2.947
63 HG SER 8 HG SER 8 -9.440 6.467 -2.324
64 H ALA 9 H ALA 9 -10.434 6.511 -5.190
65 HA ALA 9 HA ALA 9 -10.226 4.153 -6.682
66 1HB ALA 9 1HB ALA 9 -12.337 5.159 -5.970
67 2HB ALA 9 2HB ALA 9 -12.078 6.537 -7.068
68 3HB ALA 9 3HB ALA 9 -12.343 4.905 -7.729
69 H ASP 10 H ASP 10 -9.835 7.560 -7.832
70 HA ASP 10 HA ASP 10 -9.545 6.769 -10.614
71 1HB ASP 10 2HB ASP 10 -10.295 9.031 -9.827
72 2HB ASP 10 3HB ASP 10 -8.647 9.336 -9.241
73 H ASP 11 H ASP 11 -7.367 7.488 -7.888
74 HA ASP 11 HA ASP 11 -4.942 7.523 -9.342
75 1HB ASP 11 2HB ASP 11 -5.347 6.807 -6.407
76 2HB ASP 11 3HB ASP 11 -3.898 7.432 -7.207
77 H ILE 12 H ILE 12 -6.658 4.898 -7.553
78 HA ILE 12 HA ILE 12 -4.680 2.948 -8.097
79 HB ILE 12 HB ILE 12 -6.218 1.351 -7.415
80 1HG1 ILE 12 2HG1 ILE 12 -8.304 3.447 -7.203
81 2HG1 ILE 12 3HG1 ILE 12 -8.317 2.080 -8.320
82 1HG2 ILE 12 1HG2 ILE 12 -6.426 2.065 -5.078
83 2HG2 ILE 12 2HG2 ILE 12 -4.883 2.556 -5.771
84 3HG2 ILE 12 3HG2 ILE 12 -6.174 3.748 -5.552
85 1HD1 ILE 12 1HD1 ILE 12 -9.811 1.531 -6.565
86 2HD1 ILE 12 2HD1 ILE 12 -8.357 0.549 -6.303
87 3HD1 ILE 12 3HD1 ILE 12 -8.660 2.002 -5.309
88 H ALA 13 H ALA 13 -7.673 3.929 -9.833
89 HA ALA 13 HA ALA 13 -7.526 1.964 -11.877
90 1HB ALA 13 1HB ALA 13 -8.730 3.604 -13.289
91 2HB ALA 13 2HB ALA 13 -9.455 3.402 -11.681
92 3HB ALA 13 3HB ALA 13 -8.492 4.846 -12.050
93 H ALA 14 H ALA 14 -5.781 5.110 -11.572
94 HA ALA 14 HA ALA 14 -4.272 4.765 -13.987
95 1HB ALA 14 1HB ALA 14 -2.754 6.430 -13.107
96 2HB ALA 14 2HB ALA 14 -4.434 6.915 -12.801
97 3HB ALA 14 3HB ALA 14 -3.436 6.278 -11.481
98 H ALA 15 H ALA 15 -3.340 4.024 -10.584
99 HA ALA 15 HA ALA 15 -0.833 2.977 -10.892
100 1HB ALA 15 1HB ALA 15 -2.109 3.326 -8.718
101 2HB ALA 15 2HB ALA 15 -2.930 1.791 -9.036
102 3HB ALA 15 3HB ALA 15 -1.177 1.818 -8.822
103 H LEU 16 H LEU 16 -3.897 1.311 -11.162
104 HA LEU 16 HA LEU 16 -3.169 -1.328 -11.540
105 1HB LEU 16 2HB LEU 16 -5.460 -0.802 -11.228
106 2HB LEU 16 3HB LEU 16 -5.448 0.386 -12.526
107 HG LEU 16 HG LEU 16 -5.320 -1.382 -14.231
108 1HD1 LEU 16 1HD1 LEU 16 -4.209 -3.183 -12.914
109 2HD1 LEU 16 2HD1 LEU 16 -5.647 -3.301 -11.876
110 3HD1 LEU 16 3HD1 LEU 16 -5.749 -3.727 -13.597
111 1HD2 LEU 16 1HD2 LEU 16 -7.597 -1.708 -12.242
112 2HD2 LEU 16 2HD2 LEU 16 -7.472 -0.442 -13.481
113 3HD2 LEU 16 3HD2 LEU 16 -7.628 -2.139 -13.965
114 H GLN 17 H GLN 17 -3.329 1.348 -13.935
115 HA GLN 17 HA GLN 17 -2.704 -0.534 -16.141
116 1HB GLN 17 2HB GLN 17 -3.326 2.432 -16.131
117 2HB GLN 17 3HB GLN 17 -2.934 1.454 -17.562
118 1HG GLN 17 2HG GLN 17 -4.839 -0.087 -16.988
119 2HG GLN 17 3HG GLN 17 -5.268 0.991 -15.649
120 1HE2 GLN 17 1HE2 GLN 17 -7.335 1.528 -16.483
121 2HE2 GLN 17 2HE2 GLN 17 -7.521 2.455 -17.963
122 H GLU 18 H GLU 18 -1.219 2.175 -14.361
123 HA GLU 18 HA GLU 18 1.019 2.316 -16.127
124 1HB GLU 18 2HB GLU 18 1.799 4.038 -14.831
125 2HB GLU 18 3HB GLU 18 0.050 4.105 -14.651
126 1HG GLU 18 2HG GLU 18 0.487 4.377 -12.476
127 2HG GLU 18 3HG GLU 18 0.634 2.616 -12.458
128 H CYS 19 H CYS 19 0.486 0.564 -13.077
129 HA CYS 19 HA CYS 19 2.936 -1.099 -13.610
130 1HB CYS 19 2HB CYS 19 1.437 -0.557 -11.033
131 2HB CYS 19 3HB CYS 19 2.569 -1.905 -11.292
132 HG CYS 19 HG CYS 19 3.144 1.326 -11.553
133 H ARG 20 H ARG 20 1.137 -1.628 -15.464
134 HA ARG 20 HA ARG 20 -0.802 -3.648 -14.585
135 1HB ARG 20 2HB ARG 20 -0.136 -2.294 -17.082
136 2HB ARG 20 3HB ARG 20 -0.088 -4.020 -17.355
137 1HG ARG 20 2HG ARG 20 -2.432 -2.682 -15.975
138 2HG ARG 20 3HG ARG 20 -2.341 -2.832 -17.721
139 1HD ARG 20 2HD ARG 20 -2.085 -5.198 -15.826
140 2HD ARG 20 3HD ARG 20 -3.651 -4.594 -16.409
141 HE ARG 20 HE ARG 20 -2.116 -4.893 -18.701
142 1HH1 ARG 20 2HH2 ARG 20 -3.169 -7.048 -16.130
143 2HH1 ARG 20 1HH2 ARG 20 -3.368 -8.447 -17.140
144 1HH2 ARG 20 2HH1 ARG 20 -2.401 -6.703 -20.103
145 2HH2 ARG 20 1HH1 ARG 20 -2.916 -8.233 -19.474
146 H ASP 21 H ASP 21 2.506 -3.518 -15.831
147 HA ASP 21 HA ASP 21 2.505 -6.229 -16.650
148 1HB ASP 21 2HB ASP 21 4.454 -3.911 -16.648
149 2HB ASP 21 3HB ASP 21 5.064 -5.526 -16.969
150 HA PRO 22 HA PRO 22 3.782 -8.311 -13.076
151 1HB PRO 22 2HB PRO 22 5.278 -10.409 -13.995
152 2HB PRO 22 3HB PRO 22 3.514 -10.264 -14.261
153 1HG PRO 22 2HG PRO 22 5.738 -9.462 -16.158
154 2HG PRO 22 3HG PRO 22 4.304 -10.466 -16.527
155 1HD PRO 22 2HD PRO 22 4.350 -7.813 -17.087
156 2HD PRO 22 3HD PRO 22 2.863 -8.566 -16.442
157 H ASP 23 H ASP 23 5.186 -7.619 -11.586
158 HA ASP 23 HA ASP 23 6.971 -7.569 -10.388
159 1HB ASP 23 2HB ASP 23 8.623 -8.444 -12.787
160 2HB ASP 23 3HB ASP 23 9.233 -8.192 -11.154
161 H THR 24 H THR 24 5.748 -5.354 -11.601
162 HA THR 24 HA THR 24 7.981 -3.496 -12.397
163 HB THR 24 HB THR 24 5.069 -3.269 -13.127
164 HG1 THR 24 1HG THR 24 5.488 -4.544 -14.685
165 1HG2 THR 24 1HG2 THR 24 7.589 -1.952 -14.246
166 2HG2 THR 24 2HG2 THR 24 5.989 -1.883 -15.006
167 3HG2 THR 24 3HG2 THR 24 6.241 -1.116 -13.438
168 H PHE 25 H PHE 25 6.020 -4.164 -9.718
169 HA PHE 25 HA PHE 25 4.732 -1.597 -9.466
170 1HB PHE 25 2HB PHE 25 3.840 -3.879 -8.907
171 2HB PHE 25 3HB PHE 25 4.865 -3.870 -7.479
172 HD1 PHE 25 1HD PHE 25 1.820 -2.568 -9.080
173 HD2 PHE 25 2HD PHE 25 4.323 -2.364 -5.571
174 HE1 PHE 25 1HE PHE 25 -0.094 -1.711 -7.763
175 HE2 PHE 25 2HE PHE 25 2.405 -1.477 -4.268
176 HZ PHE 25 HZ PHE 25 0.183 -1.225 -5.338
177 H GLU 26 H GLU 26 6.604 -0.149 -9.297
178 HA GLU 26 HA GLU 26 8.480 -0.391 -7.176
179 1HB GLU 26 2HB GLU 26 7.908 1.628 -9.271
180 2HB GLU 26 3HB GLU 26 8.332 2.344 -7.719
181 1HG GLU 26 2HG GLU 26 10.349 0.593 -7.799
182 2HG GLU 26 3HG GLU 26 10.060 0.757 -9.538
183 HA PRO 27 HA PRO 27 5.967 0.903 -3.887
184 1HB PRO 27 2HB PRO 27 7.821 1.808 -2.008
185 2HB PRO 27 3HB PRO 27 7.545 0.096 -2.418
186 1HG PRO 27 2HG PRO 27 9.768 1.868 -3.406
187 2HG PRO 27 3HG PRO 27 9.808 0.133 -2.976
188 1HD PRO 27 2HD PRO 27 9.660 1.016 -5.556
189 2HD PRO 27 3HD PRO 27 8.984 -0.543 -4.985
190 H GLN 28 H GLN 28 8.605 3.375 -4.105
191 HA GLN 28 HA GLN 28 7.073 5.585 -3.205
192 1HB GLN 28 2HB GLN 28 9.520 5.380 -4.992
193 2HB GLN 28 3HB GLN 28 8.839 6.926 -4.452
194 1HG GLN 28 2HG GLN 28 9.197 6.399 -2.128
195 2HG GLN 28 3HG GLN 28 9.605 4.719 -2.497
196 1HE2 GLN 28 1HE2 GLN 28 10.737 8.084 -3.250
197 2HE2 GLN 28 2HE2 GLN 28 12.432 7.628 -3.259
198 H LYS 29 H LYS 29 7.681 4.373 -6.499
199 HA LYS 29 HA LYS 29 6.160 6.201 -7.942
200 1HB LYS 29 2HB LYS 29 7.590 4.304 -8.881
201 2HB LYS 29 3HB LYS 29 6.289 3.189 -8.417
202 1HG LYS 29 2HG LYS 29 5.979 3.587 -10.715
203 2HG LYS 29 3HG LYS 29 4.724 4.512 -9.909
204 1HD LYS 29 2HD LYS 29 6.380 6.538 -10.057
205 2HD LYS 29 3HD LYS 29 7.350 5.501 -11.122
206 1HE LYS 29 2HE LYS 29 5.452 5.274 -12.665
207 2HE LYS 29 3HE LYS 29 4.383 6.137 -11.534
208 1HZ LYS 29 1HZ LYS 29 5.739 8.087 -11.855
209 2HZ LYS 29 2HZ LYS 29 6.653 7.294 -12.983
210 3HZ LYS 29 3HZ LYS 29 5.044 7.550 -13.249
211 H PHE 30 H PHE 30 5.017 3.057 -6.527
212 HA PHE 30 HA PHE 30 2.331 3.435 -7.163
213 1HB PHE 30 2HB PHE 30 3.149 1.289 -6.468
214 2HB PHE 30 3HB PHE 30 3.617 1.907 -4.887
215 HD1 PHE 30 1HD PHE 30 2.133 1.604 -3.079
216 HD2 PHE 30 2HD PHE 30 0.580 1.678 -7.103
217 HE1 PHE 30 1HE PHE 30 -0.165 1.357 -2.200
218 HE2 PHE 30 2HE PHE 30 -1.726 1.423 -6.212
219 HZ PHE 30 HZ PHE 30 -2.101 1.382 -3.760
220 H PHE 31 H PHE 31 3.990 4.359 -4.082
221 HA PHE 31 HA PHE 31 1.703 5.385 -2.801
222 1HB PHE 31 2HB PHE 31 4.599 6.282 -2.560
223 2HB PHE 31 3HB PHE 31 3.320 6.715 -1.434
224 HD1 PHE 31 1HD PHE 31 6.095 4.917 -1.311
225 HD2 PHE 31 2HD PHE 31 1.852 4.285 -0.856
226 HE1 PHE 31 1HE PHE 31 6.535 3.010 0.188
227 HE2 PHE 31 2HE PHE 31 2.303 2.487 0.767
228 HZ PHE 31 HZ PHE 31 4.653 1.856 1.314
229 H GLN 32 H GLN 32 3.755 6.926 -5.262
230 HA GLN 32 HA GLN 32 2.505 9.570 -4.961
231 1HB GLN 32 2HB GLN 32 4.209 8.302 -7.128
232 2HB GLN 32 3HB GLN 32 3.623 9.965 -7.159
233 1HG GLN 32 2HG GLN 32 5.009 9.212 -4.616
234 2HG GLN 32 3HG GLN 32 6.003 9.105 -6.063
235 1HE2 GLN 32 1HE2 GLN 32 4.410 11.376 -3.826
236 2HE2 GLN 32 2HE2 GLN 32 5.001 12.787 -4.654
237 H THR 33 H THR 33 2.334 6.896 -7.399
238 HA THR 33 HA THR 33 0.457 8.213 -8.880
239 HB THR 33 HB THR 33 2.149 6.143 -9.328
240 HG1 THR 33 1HG THR 33 -0.263 6.707 -10.555
241 1HG2 THR 33 1HG2 THR 33 1.051 4.064 -9.692
242 2HG2 THR 33 2HG2 THR 33 0.609 4.512 -8.033
243 3HG2 THR 33 3HG2 THR 33 -0.542 4.765 -9.357
244 H SER 34 H SER 34 0.074 6.182 -6.107
245 HA SER 34 HA SER 34 -2.745 5.611 -6.462
246 1HB SER 34 2HB SER 34 -1.124 4.064 -5.412
247 2HB SER 34 3HB SER 34 -0.918 5.186 -4.064
248 HG SER 34 HG SER 34 -3.506 4.335 -4.766
249 H GLY 35 H GLY 35 -0.977 8.371 -5.390
250 1HA GLY 35 1HA GLY 35 -1.951 10.402 -4.859
251 2HA GLY 35 2HA GLY 35 -3.495 9.618 -4.505
252 H LEU 36 H LEU 36 -1.561 7.673 -2.890
253 HA LEU 36 HA LEU 36 -2.228 8.489 -0.308
254 1HB LEU 36 2HB LEU 36 0.042 6.736 -1.342
255 2HB LEU 36 3HB LEU 36 -0.507 6.783 0.325
256 HG LEU 36 HG LEU 36 -2.269 5.950 -2.031
257 1HD1 LEU 36 1HD1 LEU 36 -0.844 4.246 0.047
258 2HD1 LEU 36 2HD1 LEU 36 -1.982 3.667 -1.191
259 3HD1 LEU 36 3HD1 LEU 36 -0.432 4.362 -1.680
260 1HD2 LEU 36 1HD2 LEU 36 -3.643 6.787 -0.192
261 2HD2 LEU 36 2HD2 LEU 36 -3.734 5.026 -0.231
262 3HD2 LEU 36 3HD2 LEU 36 -2.709 5.827 0.980
263 H SER 37 H SER 37 0.787 9.110 -2.161
264 HA SER 37 HA SER 37 2.012 10.585 0.030
265 1HB SER 37 2HB SER 37 3.509 9.505 -1.455
266 2HB SER 37 3HB SER 37 2.609 10.060 -2.874
267 HG SER 37 HG SER 37 4.524 11.417 -1.367
268 H LYS 38 H LYS 38 -0.554 11.396 -2.015
269 HA LYS 38 HA LYS 38 0.056 14.283 -1.887
270 1HB LYS 38 2HB LYS 38 -1.239 12.698 -3.859
271 2HB LYS 38 3HB LYS 38 -2.541 13.535 -3.022
272 1HG LYS 38 2HG LYS 38 -1.906 14.956 -4.784
273 2HG LYS 38 3HG LYS 38 -1.206 15.687 -3.322
274 1HD LYS 38 2HD LYS 38 0.971 14.374 -3.921
275 2HD LYS 38 3HD LYS 38 0.220 14.020 -5.470
276 1HE LYS 38 2HE LYS 38 0.876 16.777 -4.302
277 2HE LYS 38 3HE LYS 38 1.743 15.959 -5.608
278 1HZ LYS 38 1HZ LYS 38 -1.048 16.897 -5.726
279 2HZ LYS 38 2HZ LYS 38 0.243 17.594 -6.466
280 3HZ LYS 38 3HZ LYS 38 -0.266 16.102 -6.938
281 H MET 39 H MET 39 -2.077 11.730 -0.671
282 HA MET 39 HA MET 39 -3.849 13.332 0.837
283 1HB MET 39 2HB MET 39 -2.731 10.546 1.384
284 2HB MET 39 3HB MET 39 -4.009 11.305 2.312
285 1HG MET 39 2HG MET 39 -5.375 11.485 0.212
286 2HG MET 39 3HG MET 39 -4.131 10.531 -0.611
287 1HE MET 39 1HE MET 39 -5.859 8.662 -1.353
288 2HE MET 39 2HE MET 39 -7.054 7.964 -0.233
289 3HE MET 39 3HE MET 39 -7.126 9.696 -0.642
290 H SER 40 H SER 40 -3.881 13.827 3.082
291 HA SER 40 HA SER 40 -1.286 14.649 4.185
292 1HB SER 40 2HB SER 40 -3.335 16.086 4.352
293 2HB SER 40 3HB SER 40 -4.082 14.843 5.379
294 HG SER 40 HG SER 40 -1.816 16.454 5.913
295 H ALA 41 H ALA 41 -0.552 13.972 6.245
296 HA ALA 41 HA ALA 41 -0.223 11.328 6.857
297 1HB ALA 41 1HB ALA 41 -0.397 13.711 8.745
298 2HB ALA 41 2HB ALA 41 0.228 12.116 9.193
299 3HB ALA 41 3HB ALA 41 1.057 13.070 7.942
300 H ASN 42 H ASN 42 -2.840 13.431 8.055
301 HA ASN 42 HA ASN 42 -4.097 11.655 9.844
302 1HB ASN 42 2HB ASN 42 -5.470 13.687 8.025
303 2HB ASN 42 3HB ASN 42 -6.111 12.999 9.521
304 1HD2 ASN 42 1HD2 ASN 42 -4.574 15.721 8.246
305 2HD2 ASN 42 2HD2 ASN 42 -3.879 16.313 9.739
306 H GLN 43 H GLN 43 -4.825 12.191 6.372
307 HA GLN 43 HA GLN 43 -6.845 10.154 6.207
308 1HB GLN 43 2HB GLN 43 -5.502 12.051 4.380
309 2HB GLN 43 3HB GLN 43 -5.789 10.488 3.624
310 1HG GLN 43 2HG GLN 43 -7.945 12.064 5.079
311 2HG GLN 43 3HG GLN 43 -7.647 12.149 3.334
312 1HE2 GLN 43 1HE2 GLN 43 -10.176 11.375 4.243
313 2HE2 GLN 43 2HE2 GLN 43 -10.382 9.671 3.884
314 H VAL 44 H VAL 44 -3.279 10.212 5.554
315 HA VAL 44 HA VAL 44 -3.126 7.632 4.403
316 HB VAL 44 HB VAL 44 -1.232 9.485 5.899
317 1HG1 VAL 44 1HG1 VAL 44 0.617 8.152 4.944
318 2HG1 VAL 44 2HG1 VAL 44 -0.311 7.317 6.193
319 3HG1 VAL 44 3HG1 VAL 44 -0.579 6.916 4.465
320 1HG2 VAL 44 1HG2 VAL 44 -2.106 10.263 3.687
321 2HG2 VAL 44 2HG2 VAL 44 -0.377 9.934 3.632
322 3HG2 VAL 44 3HG2 VAL 44 -1.533 8.766 2.948
323 H LYS 45 H LYS 45 -2.952 8.757 7.824
324 HA LYS 45 HA LYS 45 -2.501 6.163 8.906
325 1HB LYS 45 2HB LYS 45 -2.123 8.397 9.982
326 2HB LYS 45 3HB LYS 45 -3.858 8.526 10.279
327 1HG LYS 45 2HG LYS 45 -3.796 7.012 11.997
328 2HG LYS 45 3HG LYS 45 -2.629 5.954 11.183
329 1HD LYS 45 2HD LYS 45 -0.798 7.539 11.656
330 2HD LYS 45 3HD LYS 45 -1.939 8.627 12.475
331 1HE LYS 45 2HE LYS 45 -2.396 6.848 14.169
332 2HE LYS 45 3HE LYS 45 -1.276 5.759 13.329
333 1HZ LYS 45 1HZ LYS 45 -0.216 6.824 15.186
334 2HZ LYS 45 2HZ LYS 45 0.495 7.327 13.792
335 3HZ LYS 45 3HZ LYS 45 -0.544 8.321 14.591
336 H ASP 46 H ASP 46 -5.576 8.035 8.456
337 HA ASP 46 HA ASP 46 -7.352 6.090 9.422
338 1HB ASP 46 2HB ASP 46 -7.561 8.329 7.434
339 2HB ASP 46 3HB ASP 46 -8.800 7.079 7.363
340 H VAL 47 H VAL 47 -6.182 6.398 6.009
341 HA VAL 47 HA VAL 47 -7.494 4.052 5.184
342 HB VAL 47 HB VAL 47 -6.118 3.947 3.240
343 1HG1 VAL 47 1HG1 VAL 47 -6.603 6.889 3.752
344 2HG1 VAL 47 2HG1 VAL 47 -6.820 5.970 2.262
345 3HG1 VAL 47 3HG1 VAL 47 -7.942 5.755 3.625
346 1HG2 VAL 47 1HG2 VAL 47 -4.321 5.441 2.747
347 2HG2 VAL 47 2HG2 VAL 47 -4.462 6.095 4.382
348 3HG2 VAL 47 3HG2 VAL 47 -3.898 4.422 4.142
349 H PHE 48 H PHE 48 -4.194 4.305 6.628
350 HA PHE 48 HA PHE 48 -3.610 1.542 6.532
351 1HB PHE 48 2HB PHE 48 -2.966 3.388 8.826
352 2HB PHE 48 3HB PHE 48 -2.208 1.844 8.461
353 HD1 PHE 48 1HD PHE 48 -2.214 2.665 5.246
354 HD2 PHE 48 2HD PHE 48 -0.693 4.309 8.946
355 HE1 PHE 48 1HE PHE 48 -0.500 3.902 3.997
356 HE2 PHE 48 2HE PHE 48 1.009 5.539 7.684
357 HZ PHE 48 HZ PHE 48 1.127 5.351 5.206
358 H ARG 49 H ARG 49 -5.738 3.259 8.865
359 HA ARG 49 HA ARG 49 -6.113 0.978 10.581
360 1HB ARG 49 2HB ARG 49 -8.147 3.158 9.960
361 2HB ARG 49 3HB ARG 49 -8.197 1.999 11.286
362 1HG ARG 49 2HG ARG 49 -6.075 2.935 12.197
363 2HG ARG 49 3HG ARG 49 -6.046 4.112 10.882
364 1HD ARG 49 2HD ARG 49 -7.002 5.307 12.711
365 2HD ARG 49 3HD ARG 49 -8.294 4.956 11.589
366 HE ARG 49 HE ARG 49 -9.344 3.634 13.129
367 1HH1 ARG 49 2HH2 ARG 49 -6.019 4.087 14.144
368 2HH1 ARG 49 1HH2 ARG 49 -6.226 3.476 15.760
369 1HH2 ARG 49 2HH1 ARG 49 -9.688 2.772 15.262
370 2HH2 ARG 49 1HH1 ARG 49 -8.379 2.687 16.393
371 H PHE 50 H PHE 50 -7.722 2.016 7.511
372 HA PHE 50 HA PHE 50 -9.549 -0.229 7.564
373 1HB PHE 50 2HB PHE 50 -8.657 1.323 5.137
374 2HB PHE 50 3HB PHE 50 -10.155 0.419 5.352
375 HD1 PHE 50 1HD PHE 50 -10.970 1.455 8.137
376 HD2 PHE 50 2HD PHE 50 -9.559 3.471 4.596
377 HE1 PHE 50 1HE PHE 50 -11.707 3.619 9.067
378 HE2 PHE 50 2HE PHE 50 -10.166 5.654 5.607
379 HZ PHE 50 HZ PHE 50 -11.210 5.735 7.858
380 H ILE 51 H ILE 51 -6.235 0.239 6.324
381 HA ILE 51 HA ILE 51 -6.137 -2.232 4.869
382 HB ILE 51 HB ILE 51 -3.811 -0.803 6.170
383 1HG1 ILE 51 2HG1 ILE 51 -4.632 0.812 4.642
384 2HG1 ILE 51 3HG1 ILE 51 -3.360 -0.019 3.786
385 1HG2 ILE 51 1HG2 ILE 51 -3.382 -3.193 5.483
386 2HG2 ILE 51 2HG2 ILE 51 -3.824 -2.746 3.833
387 3HG2 ILE 51 3HG2 ILE 51 -2.427 -1.988 4.627
388 1HD1 ILE 51 1HD1 ILE 51 -6.362 -0.382 3.411
389 2HD1 ILE 51 2HD1 ILE 51 -5.193 0.357 2.307
390 3HD1 ILE 51 3HD1 ILE 51 -5.135 -1.384 2.596
391 H ASP 52 H ASP 52 -4.918 -1.534 8.238
392 HA ASP 52 HA ASP 52 -4.376 -4.368 8.610
393 1HB ASP 52 2HB ASP 52 -3.010 -2.601 9.736
394 2HB ASP 52 3HB ASP 52 -4.386 -2.243 10.786
395 H ASN 53 H ASN 53 -6.569 -4.928 7.950
396 HA ASN 53 HA ASN 53 -8.973 -4.646 9.275
397 1HB ASN 53 2HB ASN 53 -8.510 -5.966 7.207
398 2HB ASN 53 3HB ASN 53 -7.763 -7.234 8.171
399 1HD2 ASN 53 1HD2 ASN 53 -9.099 -8.831 9.019
400 2HD2 ASN 53 2HD2 ASN 53 -10.852 -8.738 8.994
401 H ASP 54 H ASP 54 -6.385 -6.988 9.997
402 HA ASP 54 HA ASP 54 -7.505 -8.300 12.171
403 1HB ASP 54 2HB ASP 54 -4.558 -7.782 11.624
404 2HB ASP 54 3HB ASP 54 -5.263 -9.176 12.453
405 H GLN 55 H GLN 55 -6.150 -5.106 12.043
406 HA GLN 55 HA GLN 55 -5.664 -3.527 13.476
407 1HB GLN 55 2HB GLN 55 -7.263 -2.974 14.947
408 2HB GLN 55 3HB GLN 55 -8.101 -4.238 14.053
409 1HG GLN 55 2HG GLN 55 -7.298 -5.817 15.993
410 2HG GLN 55 3HG GLN 55 -6.906 -4.325 16.842
411 1HE2 GLN 55 1HE2 GLN 55 -8.564 -3.474 18.090
412 2HE2 GLN 55 2HE2 GLN 55 -10.256 -3.888 17.857
413 H SER 56 H SER 56 -4.153 -6.229 13.750
414 HA SER 56 HA SER 56 -3.338 -6.467 16.417
415 1HB SER 56 2HB SER 56 -1.499 -7.911 15.297
416 2HB SER 56 3HB SER 56 -3.204 -8.351 15.096
417 HG SER 56 HG SER 56 -2.253 -8.430 13.086
418 H GLY 57 H GLY 57 -2.338 -3.992 14.253
419 1HA GLY 57 1HA GLY 57 -1.063 -2.175 14.898
420 2HA GLY 57 2HA GLY 57 -0.526 -3.031 16.347
421 H TYR 58 H TYR 58 -0.308 -4.174 13.021
422 HA TYR 58 HA TYR 58 2.269 -3.348 12.282
423 1HB TYR 58 2HB TYR 58 2.087 -6.020 13.705
424 2HB TYR 58 3HB TYR 58 3.010 -5.954 12.216
425 HD1 TYR 58 HD1 TYR 58 4.584 -3.751 12.024
426 HD2 TYR 58 HD2 TYR 58 3.574 -5.946 15.582
427 HE1 TYR 58 HE1 TYR 58 6.670 -2.961 13.082
428 HE2 TYR 58 HE2 TYR 58 5.721 -5.250 16.610
429 HH TYR 58 HH TYR 58 7.685 -2.734 15.340
430 H LEU 59 H LEU 59 2.481 -3.778 10.083
431 HA LEU 59 HA LEU 59 0.180 -5.209 8.795
432 1HB LEU 59 2HB LEU 59 2.069 -3.019 7.916
433 2HB LEU 59 3HB LEU 59 1.124 -3.976 6.765
434 HG LEU 59 HG LEU 59 0.100 -1.819 7.221
435 1HD1 LEU 59 1HD1 LEU 59 -1.652 -4.088 8.239
436 2HD1 LEU 59 2HD1 LEU 59 -2.158 -2.578 7.465
437 3HD1 LEU 59 3HD1 LEU 59 -1.249 -3.785 6.537
438 1HD2 LEU 59 1HD2 LEU 59 0.768 -1.587 9.627
439 2HD2 LEU 59 2HD2 LEU 59 -0.929 -1.206 9.280
440 3HD2 LEU 59 3HD2 LEU 59 -0.518 -2.747 10.042
441 H ASP 60 H ASP 60 1.430 -7.043 9.776
442 HA ASP 60 HA ASP 60 3.853 -7.993 8.843
443 1HB ASP 60 2HB ASP 60 1.379 -9.665 9.437
444 2HB ASP 60 3HB ASP 60 3.070 -10.135 9.665
445 H GLU 61 H GLU 61 4.497 -9.376 7.091
446 HA GLU 61 HA GLU 61 3.649 -8.802 4.588
447 1HB GLU 61 2HB GLU 61 4.936 -11.366 5.602
448 2HB GLU 61 3HB GLU 61 4.515 -11.119 3.907
449 1HG GLU 61 2HG GLU 61 5.846 -8.937 3.993
450 2HG GLU 61 3HG GLU 61 6.546 -9.553 5.502
451 H GLU 62 H GLU 62 2.458 -11.670 6.407
452 HA GLU 62 HA GLU 62 0.898 -12.491 4.170
453 1HB GLU 62 2HB GLU 62 1.858 -13.954 6.027
454 2HB GLU 62 3HB GLU 62 0.442 -13.509 6.997
455 1HG GLU 62 2HG GLU 62 -1.048 -14.484 5.342
456 2HG GLU 62 3HG GLU 62 0.268 -14.606 4.152
457 H GLU 63 H GLU 63 0.250 -10.095 6.598
458 HA GLU 63 HA GLU 63 -2.645 -10.041 6.084
459 1HB GLU 63 2HB GLU 63 -0.830 -7.947 7.299
460 2HB GLU 63 3HB GLU 63 -2.594 -7.949 7.285
461 1HG GLU 63 2HG GLU 63 -2.649 -9.919 8.758
462 2HG GLU 63 3HG GLU 63 -0.871 -9.991 8.771
463 H LEU 64 H LEU 64 0.350 -8.303 5.202
464 HA LEU 64 HA LEU 64 -0.746 -6.442 3.384
465 1HB LEU 64 2HB LEU 64 1.394 -5.956 3.983
466 2HB LEU 64 3HB LEU 64 1.923 -7.617 3.897
467 HG LEU 64 HG LEU 64 1.998 -7.507 1.422
468 1HD1 LEU 64 1HD1 LEU 64 0.510 -5.637 0.869
469 2HD1 LEU 64 2HD1 LEU 64 1.466 -4.528 1.871
470 3HD1 LEU 64 3HD1 LEU 64 2.138 -5.230 0.380
471 1HD2 LEU 64 1HD2 LEU 64 3.628 -5.459 2.986
472 2HD2 LEU 64 2HD2 LEU 64 3.997 -7.187 2.808
473 3HD2 LEU 64 3HD2 LEU 64 4.064 -6.118 1.400
474 H LYS 65 H LYS 65 -0.088 -9.897 2.932
475 HA LYS 65 HA LYS 65 -0.534 -10.144 0.206
476 1HB LYS 65 2HB LYS 65 -0.070 -11.981 1.893
477 2HB LYS 65 3HB LYS 65 -1.812 -11.981 2.245
478 1HG LYS 65 2HG LYS 65 -2.304 -12.583 -0.100
479 2HG LYS 65 3HG LYS 65 -0.599 -12.414 -0.522
480 1HD LYS 65 2HD LYS 65 -1.267 -14.742 -0.321
481 2HD LYS 65 3HD LYS 65 -0.025 -14.344 0.879
482 1HE LYS 65 2HE LYS 65 -1.587 -14.342 2.688
483 2HE LYS 65 3HE LYS 65 -2.984 -14.219 1.609
484 1HZ LYS 65 1HZ LYS 65 -2.704 -16.412 2.542
485 2HZ LYS 65 2HZ LYS 65 -2.593 -16.450 0.900
486 3HZ LYS 65 3HZ LYS 65 -1.236 -16.582 1.840
487 H PHE 66 H PHE 66 -2.924 -8.853 2.449
488 HA PHE 66 HA PHE 66 -4.724 -8.640 0.102
489 1HB PHE 66 2HB PHE 66 -6.673 -8.737 1.716
490 2HB PHE 66 3HB PHE 66 -5.817 -10.239 1.453
491 HD1 PHE 66 1HD PHE 66 -4.782 -11.430 3.262
492 HD2 PHE 66 2HD PHE 66 -6.250 -7.422 3.911
493 HE1 PHE 66 1HE PHE 66 -4.650 -11.768 5.710
494 HE2 PHE 66 2HE PHE 66 -5.996 -7.745 6.361
495 HZ PHE 66 HZ PHE 66 -5.270 -9.927 7.262
496 H PHE 67 H PHE 67 -2.655 -6.805 0.950
497 HA PHE 67 HA PHE 67 -3.680 -4.596 2.373
498 1HB PHE 67 2HB PHE 67 -1.359 -4.871 1.919
499 2HB PHE 67 3HB PHE 67 -1.585 -4.807 0.188
500 HD1 PHE 67 1HD PHE 67 -0.828 -2.921 3.157
501 HD2 PHE 67 2HD PHE 67 -2.087 -2.636 -0.943
502 HE1 PHE 67 1HE PHE 67 -0.251 -0.511 3.143
503 HE2 PHE 67 2HE PHE 67 -1.618 -0.211 -0.929
504 HZ PHE 67 HZ PHE 67 -0.687 0.863 1.115
505 H LEU 68 H LEU 68 -3.346 -4.691 -1.230
506 HA LEU 68 HA LEU 68 -5.343 -2.587 -1.457
507 1HB LEU 68 2HB LEU 68 -3.108 -3.185 -2.879
508 2HB LEU 68 3HB LEU 68 -4.316 -4.032 -3.822
509 HG LEU 68 HG LEU 68 -5.563 -1.745 -3.874
510 1HD1 LEU 68 1HD1 LEU 68 -4.200 -0.702 -2.030
511 2HD1 LEU 68 2HD1 LEU 68 -2.751 -0.880 -3.039
512 3HD1 LEU 68 3HD1 LEU 68 -4.059 0.201 -3.552
513 1HD2 LEU 68 1HD2 LEU 68 -4.504 -2.584 -5.871
514 2HD2 LEU 68 2HD2 LEU 68 -4.016 -0.899 -5.691
515 3HD2 LEU 68 3HD2 LEU 68 -2.884 -2.197 -5.250
516 H GLN 69 H GLN 69 -5.618 -5.979 -1.293
517 HA GLN 69 HA GLN 69 -7.800 -6.601 -3.009
518 1HB GLN 69 2HB GLN 69 -7.119 -7.565 -0.215
519 2HB GLN 69 3HB GLN 69 -8.413 -8.255 -1.186
520 1HG GLN 69 2HG GLN 69 -5.501 -8.270 -2.045
521 2HG GLN 69 3HG GLN 69 -6.336 -9.591 -1.225
522 1HE2 GLN 69 1HE2 GLN 69 -5.757 -8.095 -4.308
523 2HE2 GLN 69 2HE2 GLN 69 -6.805 -9.190 -5.205
524 H LYS 70 H LYS 70 -7.622 -4.490 -0.202
525 HA LYS 70 HA LYS 70 -10.488 -4.616 0.407
526 1HB LYS 70 2HB LYS 70 -8.497 -2.570 1.417
527 2HB LYS 70 3HB LYS 70 -10.022 -3.115 2.138
528 1HG LYS 70 2HG LYS 70 -8.792 -5.508 2.132
529 2HG LYS 70 3HG LYS 70 -7.345 -4.524 1.952
530 1HD LYS 70 2HD LYS 70 -7.518 -4.895 4.239
531 2HD LYS 70 3HD LYS 70 -8.028 -3.228 4.003
532 1HE LYS 70 2HE LYS 70 -10.289 -5.187 3.835
533 2HE LYS 70 3HE LYS 70 -9.413 -5.292 5.356
534 1HZ LYS 70 1HZ LYS 70 -11.158 -3.747 5.572
535 2HZ LYS 70 2HZ LYS 70 -9.718 -2.945 5.652
536 3HZ LYS 70 3HZ LYS 70 -10.630 -2.855 4.283
537 H PHE 71 H PHE 71 -8.511 -3.001 -1.900
538 HA PHE 71 HA PHE 71 -10.401 -0.710 -2.245
539 1HB PHE 71 2HB PHE 71 -7.674 -1.235 -3.462
540 2HB PHE 71 3HB PHE 71 -8.677 0.181 -3.702
541 HD1 PHE 71 1HD PHE 71 -8.961 -0.406 -0.213
542 HD2 PHE 71 2HD PHE 71 -6.200 0.955 -3.225
543 HE1 PHE 71 1HE PHE 71 -7.672 0.794 1.503
544 HE2 PHE 71 2HE PHE 71 -5.011 2.303 -1.523
545 HZ PHE 71 HZ PHE 71 -5.751 2.232 0.847
546 H GLU 72 H GLU 72 -8.629 -3.281 -4.015
547 HA GLU 72 HA GLU 72 -10.742 -3.354 -6.128
548 1HB GLU 72 2HB GLU 72 -7.932 -2.871 -6.422
549 2HB GLU 72 3HB GLU 72 -8.175 -4.554 -6.886
550 1HG GLU 72 2HG GLU 72 -9.732 -2.192 -8.024
551 2HG GLU 72 3HG GLU 72 -8.312 -2.932 -8.774
552 H SER 73 H SER 73 -10.870 -5.672 -6.965
553 HA SER 73 HA SER 73 -10.771 -7.616 -4.683
554 1HB SER 73 2HB SER 73 -12.037 -7.865 -7.446
555 2HB SER 73 3HB SER 73 -12.171 -9.013 -6.098
556 HG SER 73 HG SER 73 -12.981 -6.980 -4.945
557 H GLY 74 H GLY 74 -9.420 -6.772 -7.813
558 1HA GLY 74 1HA GLY 74 -7.861 -9.352 -7.984
559 2HA GLY 74 2HA GLY 74 -8.490 -8.434 -9.361
560 H ALA 75 H ALA 75 -6.988 -7.196 -6.389
561 HA ALA 75 HA ALA 75 -5.141 -5.541 -7.893
562 1HB ALA 75 1HB ALA 75 -4.376 -4.811 -5.762
563 2HB ALA 75 2HB ALA 75 -6.142 -4.813 -5.758
564 3HB ALA 75 3HB ALA 75 -5.262 -6.101 -4.908
565 H ARG 76 H ARG 76 -2.739 -5.765 -6.325
566 HA ARG 76 HA ARG 76 -1.679 -7.903 -8.063
567 1HB ARG 76 2HB ARG 76 -0.941 -5.278 -7.823
568 2HB ARG 76 3HB ARG 76 0.094 -5.984 -6.578
569 1HG ARG 76 2HG ARG 76 1.318 -6.019 -8.607
570 2HG ARG 76 3HG ARG 76 0.843 -7.688 -8.301
571 1HD ARG 76 2HD ARG 76 -0.272 -7.769 -10.331
572 2HD ARG 76 3HD ARG 76 -1.329 -6.478 -9.803
573 HE ARG 76 HE ARG 76 -0.212 -4.948 -11.071
574 1HH1 ARG 76 2HH2 ARG 76 1.740 -7.865 -10.775
575 2HH1 ARG 76 1HH2 ARG 76 3.187 -7.004 -11.233
576 1HH2 ARG 76 2HH1 ARG 76 1.615 -4.056 -12.137
577 2HH2 ARG 76 1HH1 ARG 76 3.005 -5.076 -12.493
578 H GLU 77 H GLU 77 -2.284 -7.280 -4.825
579 HA GLU 77 HA GLU 77 -0.351 -7.934 -3.316
580 1HB GLU 77 2HB GLU 77 -2.928 -9.282 -2.565
581 2HB GLU 77 3HB GLU 77 -1.795 -8.340 -1.577
582 1HG GLU 77 2HG GLU 77 -3.913 -7.370 -3.513
583 2HG GLU 77 3HG GLU 77 -3.712 -7.000 -1.794
584 H LEU 78 H LEU 78 -2.287 -10.452 -4.772
585 HA LEU 78 HA LEU 78 -1.198 -12.779 -3.774
586 1HB LEU 78 2HB LEU 78 -1.791 -12.496 -6.735
587 2HB LEU 78 3HB LEU 78 -1.883 -13.921 -5.712
588 HG LEU 78 HG LEU 78 -4.070 -13.509 -5.949
589 1HD1 LEU 78 1HD1 LEU 78 -3.624 -13.347 -3.497
590 2HD1 LEU 78 2HD1 LEU 78 -3.734 -11.576 -3.627
591 3HD1 LEU 78 3HD1 LEU 78 -5.124 -12.578 -4.039
592 1HD2 LEU 78 1HD2 LEU 78 -3.958 -11.652 -7.428
593 2HD2 LEU 78 2HD2 LEU 78 -5.163 -11.299 -6.181
594 3HD2 LEU 78 3HD2 LEU 78 -3.576 -10.520 -6.125
595 H THR 79 H THR 79 0.289 -10.727 -6.357
596 HA THR 79 HA THR 79 2.480 -12.560 -6.819
597 HB THR 79 HB THR 79 2.339 -9.584 -7.453
598 HG1 THR 79 1HG THR 79 2.288 -11.032 -9.554
599 1HG2 THR 79 1HG2 THR 79 4.122 -10.233 -9.113
600 2HG2 THR 79 2HG2 THR 79 4.654 -10.539 -7.458
601 3HG2 THR 79 3HG2 THR 79 4.110 -11.880 -8.469
602 H GLU 80 H GLU 80 3.630 -13.043 -5.087
603 HA GLU 80 HA GLU 80 4.208 -11.469 -2.847
604 1HB GLU 80 2HB GLU 80 6.032 -13.588 -4.049
605 2HB GLU 80 3HB GLU 80 6.199 -12.772 -2.481
606 1HG GLU 80 2HG GLU 80 4.002 -13.671 -1.764
607 2HG GLU 80 3HG GLU 80 3.906 -14.599 -3.272
608 H SER 81 H SER 81 6.059 -11.627 -5.915
609 HA SER 81 HA SER 81 8.316 -10.144 -5.160
610 1HB SER 81 2HB SER 81 8.045 -11.352 -7.324
611 2HB SER 81 3HB SER 81 6.878 -10.130 -7.852
612 HG SER 81 HG SER 81 8.731 -9.576 -8.685
613 H GLU 82 H GLU 82 5.281 -8.895 -6.616
614 HA GLU 82 HA GLU 82 5.997 -6.144 -6.526
615 1HB GLU 82 2HB GLU 82 3.243 -7.455 -6.534
616 2HB GLU 82 3HB GLU 82 3.595 -5.805 -7.035
617 1HG GLU 82 2HG GLU 82 4.841 -8.218 -8.461
618 2HG GLU 82 3HG GLU 82 3.254 -7.584 -8.869
619 H THR 83 H THR 83 4.006 -8.231 -4.393
620 HA THR 83 HA THR 83 3.428 -6.349 -2.430
621 HB THR 83 HB THR 83 3.445 -9.286 -2.649
622 HG1 THR 83 1HG THR 83 1.777 -8.184 -0.898
623 1HG2 THR 83 1HG2 THR 83 4.838 -9.368 -0.675
624 2HG2 THR 83 2HG2 THR 83 3.847 -8.146 0.140
625 3HG2 THR 83 3HG2 THR 83 3.180 -9.748 -0.236
626 H LYS 84 H LYS 84 6.394 -8.309 -2.810
627 HA LYS 84 HA LYS 84 7.554 -7.386 -0.336
628 1HB LYS 84 2HB LYS 84 8.567 -9.120 -2.596
629 2HB LYS 84 3HB LYS 84 9.613 -8.595 -1.264
630 1HG LYS 84 2HG LYS 84 8.180 -9.570 0.415
631 2HG LYS 84 3HG LYS 84 6.935 -9.935 -0.776
632 1HD LYS 84 2HD LYS 84 8.289 -11.608 -1.847
633 2HD LYS 84 3HD LYS 84 9.684 -11.220 -0.807
634 1HE LYS 84 2HE LYS 84 8.518 -11.924 1.194
635 2HE LYS 84 3HE LYS 84 6.968 -12.041 0.347
636 1HZ LYS 84 1HZ LYS 84 9.233 -13.825 -0.219
637 2HZ LYS 84 2HZ LYS 84 7.972 -14.154 0.789
638 3HZ LYS 84 3HZ LYS 84 7.680 -13.953 -0.782
639 H SER 85 H SER 85 7.693 -6.323 -3.704
640 HA SER 85 HA SER 85 9.806 -4.427 -3.403
641 1HB SER 85 2HB SER 85 7.328 -4.228 -5.182
642 2HB SER 85 3HB SER 85 8.839 -3.337 -5.353
643 HG SER 85 HG SER 85 8.522 -6.174 -5.512
644 H LEU 86 H LEU 86 6.261 -4.208 -2.836
645 HA LEU 86 HA LEU 86 6.282 -1.547 -1.754
646 1HB LEU 86 2HB LEU 86 4.299 -2.625 -2.566
647 2HB LEU 86 3HB LEU 86 4.370 -3.867 -1.332
648 HG LEU 86 HG LEU 86 2.679 -2.102 -1.002
649 1HD1 LEU 86 1HD1 LEU 86 4.560 -2.011 1.365
650 2HD1 LEU 86 2HD1 LEU 86 2.788 -2.050 1.285
651 3HD1 LEU 86 3HD1 LEU 86 3.717 -3.499 0.886
652 1HD2 LEU 86 1HD2 LEU 86 4.979 -0.239 -0.286
653 2HD2 LEU 86 2HD2 LEU 86 4.018 -0.146 -1.780
654 3HD2 LEU 86 3HD2 LEU 86 3.239 0.097 -0.207
655 H MET 87 H MET 87 6.251 -4.704 -0.001
656 HA MET 87 HA MET 87 6.655 -3.814 2.542
657 1HB MET 87 2HB MET 87 6.454 -6.242 1.783
658 2HB MET 87 3HB MET 87 8.167 -6.164 1.362
659 1HG MET 87 2HG MET 87 8.450 -5.374 3.897
660 2HG MET 87 3HG MET 87 6.866 -6.135 4.066
661 1HE MET 87 1HE MET 87 10.678 -6.527 3.460
662 2HE MET 87 2HE MET 87 10.845 -8.262 3.105
663 3HE MET 87 3HE MET 87 10.104 -7.184 1.905
664 H ALA 88 H ALA 88 9.246 -4.481 0.191
665 HA ALA 88 HA ALA 88 11.501 -4.200 1.710
666 1HB ALA 88 1HB ALA 88 11.011 -3.480 -1.216
667 2HB ALA 88 2HB ALA 88 12.625 -3.590 -0.476
668 3HB ALA 88 3HB ALA 88 11.583 -5.020 -0.564
669 H ALA 89 H ALA 89 9.876 -1.545 -0.086
670 HA ALA 89 HA ALA 89 11.738 0.453 1.000
671 1HB ALA 89 1HB ALA 89 9.200 0.627 -0.622
672 2HB ALA 89 2HB ALA 89 10.163 2.044 -0.157
673 3HB ALA 89 3HB ALA 89 10.892 0.803 -1.190
674 H ALA 90 H ALA 90 8.346 -0.582 1.614
675 HA ALA 90 HA ALA 90 7.611 1.487 3.422
676 1HB ALA 90 1HB ALA 90 6.800 -1.442 3.418
677 2HB ALA 90 2HB ALA 90 5.923 -0.096 4.180
678 3HB ALA 90 3HB ALA 90 6.068 -0.178 2.407
679 H ASP 91 H ASP 91 9.382 -1.564 3.963
680 HA ASP 91 HA ASP 91 9.408 -1.220 6.815
681 1HB ASP 91 2HB ASP 91 9.423 -3.448 5.608
682 2HB ASP 91 3HB ASP 91 11.116 -3.147 5.179
683 H ASN 92 H ASN 92 10.334 0.915 6.975
684 HA ASN 92 HA ASN 92 13.127 1.318 6.186
685 1HB ASN 92 2HB ASN 92 12.952 3.487 7.182
686 2HB ASN 92 3HB ASN 92 11.537 3.173 6.170
687 1HD2 ASN 92 1HD2 ASN 92 11.251 5.261 7.928
688 2HD2 ASN 92 2HD2 ASN 92 10.251 4.752 9.265
689 H ASP 93 H ASP 93 12.996 -0.993 7.649
690 HA ASP 93 HA ASP 93 14.675 -0.379 10.047
691 1HB ASP 93 2HB ASP 93 12.566 -2.574 9.763
692 2HB ASP 93 3HB ASP 93 13.877 -2.623 10.934
693 H GLY 94 H GLY 94 13.508 -2.976 7.843
694 1HA GLY 94 1HA GLY 94 14.856 -4.536 6.645
695 2HA GLY 94 2HA GLY 94 16.261 -4.127 7.643
696 H ASP 95 H ASP 95 12.823 -4.726 8.512
697 HA ASP 95 HA ASP 95 13.607 -7.238 9.898
698 1HB ASP 95 2HB ASP 95 12.248 -6.874 11.777
699 2HB ASP 95 3HB ASP 95 13.411 -5.555 11.657
700 H GLY 96 H GLY 96 10.843 -5.311 8.698
701 1HA GLY 96 1HA GLY 96 9.842 -6.191 6.606
702 2HA GLY 96 2HA GLY 96 9.855 -7.814 7.300
703 H LYS 97 H LYS 97 9.101 -6.782 9.974
704 HA LYS 97 HA LYS 97 6.195 -6.588 9.679
705 1HB LYS 97 2HB LYS 97 6.185 -6.322 12.120
706 2HB LYS 97 3HB LYS 97 7.025 -7.771 11.569
707 1HG LYS 97 2HG LYS 97 9.221 -6.653 11.946
708 2HG LYS 97 3HG LYS 97 8.363 -5.212 12.522
709 1HD LYS 97 2HD LYS 97 7.359 -6.582 14.353
710 2HD LYS 97 3HD LYS 97 8.200 -8.003 13.738
711 1HE LYS 97 2HE LYS 97 9.375 -7.003 15.684
712 2HE LYS 97 3HE LYS 97 10.383 -7.044 14.226
713 1HZ LYS 97 1HZ LYS 97 10.052 -4.791 13.881
714 2HZ LYS 97 2HZ LYS 97 8.919 -4.630 15.091
715 3HZ LYS 97 3HZ LYS 97 10.511 -4.945 15.430
716 H ILE 98 H ILE 98 5.299 -4.728 8.944
717 HA ILE 98 HA ILE 98 6.827 -2.194 9.151
718 HB ILE 98 HB ILE 98 4.605 -3.102 7.338
719 1HG1 ILE 98 2HG1 ILE 98 7.357 -2.215 6.465
720 2HG1 ILE 98 3HG1 ILE 98 7.234 -3.812 7.172
721 1HG2 ILE 98 1HG2 ILE 98 6.196 -0.490 7.325
722 2HG2 ILE 98 2HG2 ILE 98 5.007 -0.987 6.124
723 3HG2 ILE 98 3HG2 ILE 98 4.485 -0.626 7.773
724 1HD1 ILE 98 1HD1 ILE 98 5.507 -2.873 4.849
725 2HD1 ILE 98 2HD1 ILE 98 7.017 -3.799 4.732
726 3HD1 ILE 98 3HD1 ILE 98 5.599 -4.513 5.534
727 H GLY 99 H GLY 99 6.279 -0.925 10.858
728 1HA GLY 99 1HA GLY 99 3.656 -0.934 12.099
729 2HA GLY 99 2HA GLY 99 4.953 0.245 12.346
730 H ALA 100 H ALA 100 2.234 0.974 12.220
731 HA ALA 100 HA ALA 100 1.405 2.081 9.721
732 1HB ALA 100 1HB ALA 100 0.093 3.639 11.144
733 2HB ALA 100 2HB ALA 100 -0.102 1.948 11.648
734 3HB ALA 100 3HB ALA 100 0.947 3.044 12.580
735 H GLU 101 H GLU 101 3.557 3.212 12.309
736 HA GLU 101 HA GLU 101 4.053 5.800 11.385
737 1HB GLU 101 2HB GLU 101 4.941 4.157 13.503
738 2HB GLU 101 3HB GLU 101 6.424 4.515 12.616
739 1HG GLU 101 2HG GLU 101 6.049 6.900 12.860
740 2HG GLU 101 3HG GLU 101 4.417 6.632 13.508
741 H GLU 102 H GLU 102 5.921 2.800 10.755
742 HA GLU 102 HA GLU 102 7.822 3.753 8.954
743 1HB GLU 102 2HB GLU 102 6.372 1.080 8.823
744 2HB GLU 102 3HB GLU 102 7.961 1.472 8.157
745 1HG GLU 102 2HG GLU 102 8.749 1.878 10.535
746 2HG GLU 102 3HG GLU 102 7.194 1.265 11.110
747 H PHE 103 H PHE 103 4.536 2.437 8.249
748 HA PHE 103 HA PHE 103 4.703 2.963 5.445
749 1HB PHE 103 2HB PHE 103 2.441 2.385 7.351
750 2HB PHE 103 3HB PHE 103 2.076 3.104 5.797
751 HD1 PHE 103 1HD PHE 103 3.240 2.173 3.669
752 HD2 PHE 103 2HD PHE 103 2.204 -0.013 7.240
753 HE1 PHE 103 1HE PHE 103 3.038 0.093 2.338
754 HE2 PHE 103 2HE PHE 103 2.116 -2.108 5.894
755 HZ PHE 103 HZ PHE 103 2.490 -2.065 3.483
756 H GLN 104 H GLN 104 3.510 5.060 8.106
757 HA GLN 104 HA GLN 104 2.501 7.204 6.464
758 1HB GLN 104 2HB GLN 104 2.251 6.843 9.037
759 2HB GLN 104 3HB GLN 104 3.839 7.609 9.161
760 1HG GLN 104 2HG GLN 104 2.929 9.533 7.797
761 2HG GLN 104 3HG GLN 104 1.337 8.760 7.837
762 1HE2 GLN 104 1HE2 GLN 104 2.861 11.257 9.167
763 2HE2 GLN 104 2HE2 GLN 104 2.186 11.227 10.785
764 H GLU 105 H GLU 105 5.775 6.673 7.945
765 HA GLU 105 HA GLU 105 7.153 8.848 6.836
766 1HB GLU 105 2HB GLU 105 7.866 6.027 7.629
767 2HB GLU 105 3HB GLU 105 9.031 6.896 6.643
768 1HG GLU 105 2HG GLU 105 7.887 8.257 9.094
769 2HG GLU 105 3HG GLU 105 9.156 7.034 9.257
770 H MET 106 H MET 106 6.804 5.577 5.329
771 HA MET 106 HA MET 106 8.195 6.438 3.025
772 1HB MET 106 2HB MET 106 7.163 3.970 3.955
773 2HB MET 106 3HB MET 106 6.362 4.230 2.401
774 1HG MET 106 2HG MET 106 9.341 4.349 2.995
775 2HG MET 106 3HG MET 106 8.524 3.062 2.110
776 1HE MET 106 1HE MET 106 11.008 3.865 0.879
777 2HE MET 106 2HE MET 106 11.054 5.295 -0.182
778 3HE MET 106 3HE MET 106 11.032 5.496 1.581
779 H VAL 107 H VAL 107 4.703 6.272 3.664
780 HA VAL 107 HA VAL 107 3.882 7.166 1.064
781 HB VAL 107 HB VAL 107 2.544 7.230 3.798
782 1HG1 VAL 107 1HG1 VAL 107 1.520 9.016 2.525
783 2HG1 VAL 107 2HG1 VAL 107 1.507 8.012 1.056
784 3HG1 VAL 107 3HG1 VAL 107 0.442 7.616 2.419
785 1HG2 VAL 107 1HG2 VAL 107 2.929 4.966 2.700
786 2HG2 VAL 107 2HG2 VAL 107 1.212 5.385 2.854
787 3HG2 VAL 107 3HG2 VAL 107 2.024 5.567 1.297
788 H HIS 108 H HIS 108 4.944 8.929 3.997
789 HA HIS 108 HA HIS 108 3.800 11.429 3.281
790 1HB HIS 108 2HB HIS 108 4.285 10.898 5.568
791 2HB HIS 108 3HB HIS 108 5.996 10.622 5.214
792 HD1 HIS 108 1HD HIS 108 3.485 13.532 5.501
793 HD2 HIS 108 2HD HIS 108 7.602 12.668 5.451
794 HE1 HIS 108 1HE HIS 108 4.692 15.660 6.247
795 H SER 109 H SER 109 6.650 9.682 2.358
796 HA SER 109 HA SER 109 8.283 11.823 1.532
797 1HB SER 109 2HB SER 109 9.082 9.469 1.880
798 2HB SER 109 3HB SER 109 8.183 9.002 0.414
799 HG SER 109 HG SER 109 9.413 10.822 -0.569
Start of MODEL 3
1 1H MET 1 H1 MET 1 -17.546 8.006 4.884
2 2H MET 1 H2 MET 1 -18.794 8.290 3.807
3 3H MET 1 H3 MET 1 -18.349 6.745 4.230
4 HA MET 1 HA MET 1 -17.531 7.260 2.057
5 1HB MET 1 2HB MET 1 -15.763 9.302 3.498
6 2HB MET 1 3HB MET 1 -15.839 8.948 1.766
7 1HG MET 1 2HG MET 1 -17.972 10.325 3.420
8 2HG MET 1 3HG MET 1 -17.005 11.011 2.116
9 1HE MET 1 1HE MET 1 -19.493 11.929 1.373
10 2HE MET 1 2HE MET 1 -20.790 10.832 0.839
11 3HE MET 1 3HE MET 1 -20.349 10.908 2.562
12 H SER 2 H SER 2 -15.261 6.635 1.421
13 HA SER 2 HA SER 2 -13.442 5.583 3.348
14 1HB SER 2 2HB SER 2 -15.149 3.634 1.706
15 2HB SER 2 3HB SER 2 -13.654 3.191 2.552
16 HG SER 2 HG SER 2 -15.413 4.471 4.191
17 H ILE 3 H ILE 3 -11.674 4.482 1.927
18 HA ILE 3 HA ILE 3 -10.712 6.306 0.173
19 HB ILE 3 HB ILE 3 -8.989 4.809 -0.356
20 1HG1 ILE 3 2HG1 ILE 3 -9.410 2.274 0.413
21 2HG1 ILE 3 3HG1 ILE 3 -11.044 2.618 -0.118
22 1HG2 ILE 3 1HG2 ILE 3 -9.365 5.421 2.046
23 2HG2 ILE 3 2HG2 ILE 3 -9.920 3.753 2.310
24 3HG2 ILE 3 3HG2 ILE 3 -8.285 4.049 1.712
25 1HD1 ILE 3 1HD1 ILE 3 -10.059 3.328 -2.373
26 2HD1 ILE 3 2HD1 ILE 3 -8.459 2.896 -1.741
27 3HD1 ILE 3 3HD1 ILE 3 -9.703 1.651 -1.945
28 H THR 4 H THR 4 -12.919 3.627 -0.774
29 HA THR 4 HA THR 4 -12.598 3.722 -3.506
30 HB THR 4 HB THR 4 -13.294 1.818 -2.022
31 HG1 THR 4 1HG THR 4 -14.829 2.904 -3.996
32 1HG2 THR 4 1HG2 THR 4 -15.502 1.706 -1.073
33 2HG2 THR 4 2HG2 THR 4 -14.863 3.258 -0.509
34 3HG2 THR 4 3HG2 THR 4 -16.013 3.211 -1.849
35 H ASP 5 H ASP 5 -14.037 6.034 -1.434
36 HA ASP 5 HA ASP 5 -15.512 7.297 -3.607
37 1HB ASP 5 2HB ASP 5 -17.105 5.644 -2.509
38 2HB ASP 5 3HB ASP 5 -16.908 6.543 -0.994
39 H VAL 6 H VAL 6 -13.126 7.915 -2.367
40 HA VAL 6 HA VAL 6 -13.743 10.545 -1.090
41 HB VAL 6 HB VAL 6 -11.635 8.450 -0.418
42 1HG1 VAL 6 1HG1 VAL 6 -10.582 10.169 1.078
43 2HG1 VAL 6 2HG1 VAL 6 -10.259 10.388 -0.637
44 3HG1 VAL 6 3HG1 VAL 6 -11.460 11.424 0.172
45 1HG2 VAL 6 1HG2 VAL 6 -13.854 8.585 0.738
46 2HG2 VAL 6 2HG2 VAL 6 -12.457 8.754 1.822
47 3HG2 VAL 6 3HG2 VAL 6 -13.405 10.185 1.342
48 H LEU 7 H LEU 7 -11.206 8.705 -2.785
49 HA LEU 7 HA LEU 7 -10.908 10.496 -4.978
50 1HB LEU 7 2HB LEU 7 -9.978 12.156 -3.704
51 2HB LEU 7 3HB LEU 7 -9.270 11.076 -2.518
52 HG LEU 7 HG LEU 7 -8.030 10.898 -5.224
53 1HD1 LEU 7 1HD1 LEU 7 -6.685 12.933 -4.863
54 2HD1 LEU 7 2HD1 LEU 7 -8.395 13.310 -5.154
55 3HD1 LEU 7 3HD1 LEU 7 -7.732 13.390 -3.503
56 1HD2 LEU 7 1HD2 LEU 7 -7.153 9.737 -3.139
57 2HD2 LEU 7 2HD2 LEU 7 -5.989 10.863 -3.858
58 3HD2 LEU 7 3HD2 LEU 7 -6.879 11.327 -2.411
59 H SER 8 H SER 8 -9.162 8.331 -2.694
60 HA SER 8 HA SER 8 -7.352 7.232 -4.251
61 1HB SER 8 2HB SER 8 -8.958 5.562 -2.376
62 2HB SER 8 3HB SER 8 -7.225 5.452 -2.733
63 HG SER 8 HG SER 8 -7.031 7.601 -1.859
64 H ALA 9 H ALA 9 -10.793 6.323 -4.502
65 HA ALA 9 HA ALA 9 -10.519 4.011 -6.048
66 1HB ALA 9 1HB ALA 9 -12.542 6.209 -6.682
67 2HB ALA 9 2HB ALA 9 -12.764 4.447 -6.798
68 3HB ALA 9 3HB ALA 9 -12.650 5.237 -5.213
69 H ASP 10 H ASP 10 -10.125 7.404 -7.151
70 HA ASP 10 HA ASP 10 -9.870 6.581 -9.956
71 1HB ASP 10 2HB ASP 10 -10.801 8.799 -9.187
72 2HB ASP 10 3HB ASP 10 -9.164 9.244 -8.667
73 H ASP 11 H ASP 11 -7.815 7.329 -7.174
74 HA ASP 11 HA ASP 11 -5.284 7.573 -8.417
75 1HB ASP 11 2HB ASP 11 -5.915 6.319 -5.686
76 2HB ASP 11 3HB ASP 11 -4.376 6.872 -6.234
77 H ILE 12 H ILE 12 -6.952 4.744 -6.944
78 HA ILE 12 HA ILE 12 -4.948 2.940 -7.571
79 HB ILE 12 HB ILE 12 -6.489 1.216 -7.111
80 1HG1 ILE 12 2HG1 ILE 12 -8.646 3.259 -6.882
81 2HG1 ILE 12 3HG1 ILE 12 -8.557 1.961 -8.079
82 1HG2 ILE 12 1HG2 ILE 12 -5.297 2.452 -5.305
83 2HG2 ILE 12 2HG2 ILE 12 -6.762 3.406 -5.029
84 3HG2 ILE 12 3HG2 ILE 12 -6.778 1.660 -4.764
85 1HD1 ILE 12 1HD1 ILE 12 -8.677 0.303 -6.184
86 2HD1 ILE 12 2HD1 ILE 12 -9.031 1.671 -5.092
87 3HD1 ILE 12 3HD1 ILE 12 -10.131 1.289 -6.423
88 H ALA 13 H ALA 13 -7.842 3.959 -9.400
89 HA ALA 13 HA ALA 13 -7.670 2.137 -11.527
90 1HB ALA 13 1HB ALA 13 -9.474 3.887 -11.120
91 2HB ALA 13 2HB ALA 13 -8.397 5.063 -11.901
92 3HB ALA 13 3HB ALA 13 -8.966 3.653 -12.802
93 H ALA 14 H ALA 14 -5.881 5.246 -11.084
94 HA ALA 14 HA ALA 14 -4.384 5.010 -13.533
95 1HB ALA 14 1HB ALA 14 -4.483 7.133 -12.333
96 2HB ALA 14 2HB ALA 14 -3.602 6.439 -10.957
97 3HB ALA 14 3HB ALA 14 -2.799 6.584 -12.532
98 H ALA 15 H ALA 15 -3.367 4.254 -10.145
99 HA ALA 15 HA ALA 15 -0.894 3.187 -10.655
100 1HB ALA 15 1HB ALA 15 -2.038 3.631 -8.399
101 2HB ALA 15 2HB ALA 15 -2.839 2.062 -8.593
102 3HB ALA 15 3HB ALA 15 -1.065 2.157 -8.522
103 H LEU 16 H LEU 16 -3.968 1.493 -10.705
104 HA LEU 16 HA LEU 16 -3.169 -1.102 -11.125
105 1HB LEU 16 2HB LEU 16 -5.451 -0.368 -10.637
106 2HB LEU 16 3HB LEU 16 -5.597 0.385 -12.222
107 HG LEU 16 HG LEU 16 -6.861 -1.672 -11.936
108 1HD1 LEU 16 1HD1 LEU 16 -4.779 -2.263 -14.051
109 2HD1 LEU 16 2HD1 LEU 16 -6.495 -2.657 -14.022
110 3HD1 LEU 16 3HD1 LEU 16 -5.992 -0.969 -14.210
111 1HD2 LEU 16 1HD2 LEU 16 -5.834 -3.866 -11.799
112 2HD2 LEU 16 2HD2 LEU 16 -4.210 -3.153 -11.756
113 3HD2 LEU 16 3HD2 LEU 16 -5.346 -2.874 -10.414
114 H GLN 17 H GLN 17 -3.449 1.603 -13.470
115 HA GLN 17 HA GLN 17 -2.768 -0.229 -15.695
116 1HB GLN 17 2HB GLN 17 -3.807 2.599 -15.559
117 2HB GLN 17 3HB GLN 17 -2.862 2.070 -16.957
118 1HG GLN 17 2HG GLN 17 -4.420 0.031 -17.111
119 2HG GLN 17 3HG GLN 17 -5.492 0.902 -16.005
120 1HE2 GLN 17 1HE2 GLN 17 -6.204 3.126 -16.777
121 2HE2 GLN 17 2HE2 GLN 17 -6.315 3.393 -18.510
122 H GLU 18 H GLU 18 -1.186 2.256 -13.666
123 HA GLU 18 HA GLU 18 1.023 2.397 -15.551
124 1HB GLU 18 2HB GLU 18 1.893 4.034 -14.351
125 2HB GLU 18 3HB GLU 18 0.215 4.181 -13.930
126 1HG GLU 18 2HG GLU 18 0.726 4.167 -11.821
127 2HG GLU 18 3HG GLU 18 1.275 2.494 -11.899
128 H CYS 19 H CYS 19 0.229 0.273 -12.870
129 HA CYS 19 HA CYS 19 2.718 -1.315 -13.401
130 1HB CYS 19 2HB CYS 19 1.235 -0.849 -10.781
131 2HB CYS 19 3HB CYS 19 2.567 -1.999 -11.016
132 HG CYS 19 HG CYS 19 4.353 -0.298 -11.739
133 H ARG 20 H ARG 20 0.437 -1.772 -15.018
134 HA ARG 20 HA ARG 20 -1.047 -3.994 -13.770
135 1HB ARG 20 2HB ARG 20 -2.067 -4.480 -15.776
136 2HB ARG 20 3HB ARG 20 -2.199 -2.751 -15.556
137 1HG ARG 20 2HG ARG 20 -0.136 -4.014 -17.453
138 2HG ARG 20 3HG ARG 20 -1.809 -3.713 -17.890
139 1HD ARG 20 2HD ARG 20 -1.581 -1.353 -17.292
140 2HD ARG 20 3HD ARG 20 0.169 -1.588 -17.016
141 HE ARG 20 HE ARG 20 -0.002 -2.528 -19.483
142 1HH1 ARG 20 2HH2 ARG 20 -0.745 0.517 -17.981
143 2HH1 ARG 20 1HH2 ARG 20 -1.170 1.389 -19.431
144 1HH2 ARG 20 2HH1 ARG 20 -0.563 -1.450 -21.521
145 2HH2 ARG 20 1HH1 ARG 20 -0.942 0.245 -21.518
146 H ASP 21 H ASP 21 1.690 -3.474 -15.957
147 HA ASP 21 HA ASP 21 2.061 -6.040 -16.832
148 1HB ASP 21 2HB ASP 21 4.166 -3.885 -16.377
149 2HB ASP 21 3HB ASP 21 4.248 -5.199 -17.557
150 HA PRO 22 HA PRO 22 3.256 -8.048 -13.121
151 1HB PRO 22 2HB PRO 22 4.751 -10.206 -14.018
152 2HB PRO 22 3HB PRO 22 2.971 -10.091 -14.197
153 1HG PRO 22 2HG PRO 22 5.084 -9.351 -16.229
154 2HG PRO 22 3HG PRO 22 3.640 -10.378 -16.481
155 1HD PRO 22 2HD PRO 22 3.631 -7.758 -17.162
156 2HD PRO 22 3HD PRO 22 2.186 -8.470 -16.378
157 H ASP 23 H ASP 23 4.975 -8.041 -11.597
158 HA ASP 23 HA ASP 23 6.871 -7.569 -10.702
159 1HB ASP 23 2HB ASP 23 8.348 -8.276 -13.181
160 2HB ASP 23 3HB ASP 23 8.731 -8.593 -11.477
161 H THR 24 H THR 24 5.485 -5.392 -12.295
162 HA THR 24 HA THR 24 7.739 -3.449 -12.510
163 HB THR 24 HB THR 24 4.944 -2.956 -13.552
164 HG1 THR 24 1HG THR 24 5.270 -4.834 -14.453
165 1HG2 THR 24 1HG2 THR 24 6.173 -1.807 -15.366
166 2HG2 THR 24 2HG2 THR 24 6.587 -1.110 -13.793
167 3HG2 THR 24 3HG2 THR 24 7.718 -2.222 -14.597
168 H PHE 25 H PHE 25 5.922 -4.349 -10.028
169 HA PHE 25 HA PHE 25 4.692 -1.739 -9.365
170 1HB PHE 25 2HB PHE 25 3.759 -4.089 -8.833
171 2HB PHE 25 3HB PHE 25 4.909 -4.074 -7.485
172 HD1 PHE 25 1HD PHE 25 1.589 -3.424 -8.364
173 HD2 PHE 25 2HD PHE 25 4.825 -1.761 -6.026
174 HE1 PHE 25 1HE PHE 25 -0.037 -2.521 -6.732
175 HE2 PHE 25 2HE PHE 25 3.160 -0.674 -4.551
176 HZ PHE 25 HZ PHE 25 0.757 -1.226 -4.770
177 H GLU 26 H GLU 26 6.073 -0.187 -8.647
178 HA GLU 26 HA GLU 26 8.361 -0.948 -6.895
179 1HB GLU 26 2HB GLU 26 8.059 1.091 -9.058
180 2HB GLU 26 3HB GLU 26 8.972 1.584 -7.618
181 1HG GLU 26 2HG GLU 26 10.465 -0.350 -7.889
182 2HG GLU 26 3HG GLU 26 9.550 -0.859 -9.325
183 HA PRO 27 HA PRO 27 6.208 0.861 -3.606
184 1HB PRO 27 2HB PRO 27 8.261 1.913 -2.050
185 2HB PRO 27 3HB PRO 27 7.811 0.199 -2.141
186 1HG PRO 27 2HG PRO 27 10.064 1.643 -3.544
187 2HG PRO 27 3HG PRO 27 10.055 -0.003 -2.856
188 1HD PRO 27 2HD PRO 27 9.779 0.475 -5.525
189 2HD PRO 27 3HD PRO 27 8.994 -0.894 -4.689
190 H GLN 28 H GLN 28 8.882 3.294 -3.893
191 HA GLN 28 HA GLN 28 7.450 5.502 -3.335
192 1HB GLN 28 2HB GLN 28 10.084 4.885 -4.140
193 2HB GLN 28 3HB GLN 28 9.501 5.966 -5.410
194 1HG GLN 28 2HG GLN 28 8.673 7.457 -3.540
195 2HG GLN 28 3HG GLN 28 9.558 6.439 -2.398
196 1HE2 GLN 28 1HE2 GLN 28 10.986 8.211 -1.755
197 2HE2 GLN 28 2HE2 GLN 28 12.221 8.770 -2.864
198 H LYS 29 H LYS 29 7.964 4.004 -6.465
199 HA LYS 29 HA LYS 29 6.743 5.756 -8.238
200 1HB LYS 29 2HB LYS 29 8.134 3.764 -8.747
201 2HB LYS 29 3HB LYS 29 6.822 2.730 -8.180
202 1HG LYS 29 2HG LYS 29 6.977 2.688 -10.550
203 2HG LYS 29 3HG LYS 29 5.429 3.345 -10.071
204 1HD LYS 29 2HD LYS 29 7.820 5.123 -10.792
205 2HD LYS 29 3HD LYS 29 6.794 4.377 -12.020
206 1HE LYS 29 2HE LYS 29 4.896 5.551 -10.340
207 2HE LYS 29 3HE LYS 29 6.217 6.727 -10.297
208 1HZ LYS 29 1HZ LYS 29 4.769 5.641 -12.605
209 2HZ LYS 29 2HZ LYS 29 4.721 7.175 -12.079
210 3HZ LYS 29 3HZ LYS 29 6.108 6.605 -12.786
211 H PHE 30 H PHE 30 5.155 2.809 -6.796
212 HA PHE 30 HA PHE 30 2.547 3.444 -7.649
213 1HB PHE 30 2HB PHE 30 3.217 1.237 -6.893
214 2HB PHE 30 3HB PHE 30 3.539 1.838 -5.271
215 HD1 PHE 30 1HD PHE 30 1.699 2.320 -3.695
216 HD2 PHE 30 2HD PHE 30 0.921 0.875 -7.685
217 HE1 PHE 30 1HE PHE 30 -0.619 1.743 -3.036
218 HE2 PHE 30 2HE PHE 30 -1.380 0.247 -7.000
219 HZ PHE 30 HZ PHE 30 -2.164 0.701 -4.686
220 H PHE 31 H PHE 31 4.253 4.182 -4.642
221 HA PHE 31 HA PHE 31 2.217 5.349 -3.109
222 1HB PHE 31 2HB PHE 31 4.191 4.878 -2.042
223 2HB PHE 31 3HB PHE 31 5.203 5.529 -3.320
224 HD1 PHE 31 1HD PHE 31 2.551 6.801 -1.058
225 HD2 PHE 31 2HD PHE 31 6.387 7.512 -2.880
226 HE1 PHE 31 1HE PHE 31 2.713 8.997 0.053
227 HE2 PHE 31 2HE PHE 31 6.675 9.542 -1.482
228 HZ PHE 31 HZ PHE 31 4.880 10.168 0.142
229 H GLN 32 H GLN 32 4.415 7.024 -5.427
230 HA GLN 32 HA GLN 32 3.007 9.554 -5.143
231 1HB GLN 32 2HB GLN 32 5.266 8.523 -6.867
232 2HB GLN 32 3HB GLN 32 4.408 10.005 -7.319
233 1HG GLN 32 2HG GLN 32 4.856 11.015 -5.139
234 2HG GLN 32 3HG GLN 32 5.648 9.535 -4.579
235 1HE2 GLN 32 1HE2 GLN 32 5.826 11.759 -7.448
236 2HE2 GLN 32 2HE2 GLN 32 7.582 11.834 -7.439
237 H THR 33 H THR 33 2.843 6.756 -7.474
238 HA THR 33 HA THR 33 1.356 8.216 -9.302
239 HB THR 33 HB THR 33 2.462 5.791 -9.546
240 HG1 THR 33 1HG THR 33 0.132 6.901 -10.523
241 1HG2 THR 33 1HG2 THR 33 0.952 3.970 -9.578
242 2HG2 THR 33 2HG2 THR 33 0.667 4.643 -7.996
243 3HG2 THR 33 3HG2 THR 33 -0.456 5.017 -9.299
244 H SER 34 H SER 34 0.358 6.285 -6.490
245 HA SER 34 HA SER 34 -2.440 6.544 -6.969
246 1HB SER 34 2HB SER 34 -2.594 6.185 -4.442
247 2HB SER 34 3HB SER 34 -1.812 4.907 -5.390
248 HG SER 34 HG SER 34 0.189 5.623 -4.724
249 H GLY 35 H GLY 35 -0.019 8.392 -5.072
250 1HA GLY 35 1HA GLY 35 0.078 10.776 -5.008
251 2HA GLY 35 2HA GLY 35 -1.664 10.895 -5.298
252 H LEU 36 H LEU 36 -0.523 8.380 -3.123
253 HA LEU 36 HA LEU 36 -1.741 9.510 -0.798
254 1HB LEU 36 2HB LEU 36 0.461 7.462 -1.062
255 2HB LEU 36 3HB LEU 36 -0.465 7.800 0.414
256 HG LEU 36 HG LEU 36 -1.819 6.839 -2.127
257 1HD1 LEU 36 1HD1 LEU 36 -0.694 5.173 0.164
258 2HD1 LEU 36 2HD1 LEU 36 -1.706 4.569 -1.168
259 3HD1 LEU 36 3HD1 LEU 36 -0.087 5.202 -1.506
260 1HD2 LEU 36 1HD2 LEU 36 -2.606 6.756 0.821
261 2HD2 LEU 36 2HD2 LEU 36 -3.299 7.832 -0.412
262 3HD2 LEU 36 3HD2 LEU 36 -3.546 6.085 -0.527
263 H SER 37 H SER 37 1.336 10.054 -2.412
264 HA SER 37 HA SER 37 2.788 11.304 -0.243
265 1HB SER 37 2HB SER 37 3.746 10.546 -2.517
266 2HB SER 37 3HB SER 37 2.896 11.907 -3.232
267 HG SER 37 HG SER 37 5.033 12.078 -1.315
268 H LYS 38 H LYS 38 -0.015 12.293 -2.071
269 HA LYS 38 HA LYS 38 0.426 15.113 -1.341
270 1HB LYS 38 2HB LYS 38 -0.581 13.946 -3.724
271 2HB LYS 38 3HB LYS 38 -2.010 14.505 -2.865
272 1HG LYS 38 2HG LYS 38 -1.307 16.308 -4.248
273 2HG LYS 38 3HG LYS 38 -0.888 16.749 -2.584
274 1HD LYS 38 2HD LYS 38 1.475 15.964 -3.014
275 2HD LYS 38 3HD LYS 38 1.041 15.581 -4.671
276 1HE LYS 38 2HE LYS 38 0.436 18.386 -3.717
277 2HE LYS 38 3HE LYS 38 2.143 17.950 -3.799
278 1HZ LYS 38 1HZ LYS 38 1.378 18.929 -5.831
279 2HZ LYS 38 2HZ LYS 38 1.884 17.389 -6.086
280 3HZ LYS 38 3HZ LYS 38 0.272 17.732 -6.058
281 H MET 39 H MET 39 -1.318 12.185 -0.518
282 HA MET 39 HA MET 39 -3.427 13.582 0.866
283 1HB MET 39 2HB MET 39 -2.364 10.758 0.978
284 2HB MET 39 3HB MET 39 -3.611 11.320 2.059
285 1HG MET 39 2HG MET 39 -3.903 11.464 -0.971
286 2HG MET 39 3HG MET 39 -4.418 10.123 0.040
287 1HE MET 39 1HE MET 39 -5.299 14.262 0.254
288 2HE MET 39 2HE MET 39 -5.292 13.530 -1.375
289 3HE MET 39 3HE MET 39 -6.818 13.940 -0.567
290 H SER 40 H SER 40 -3.693 13.991 3.036
291 HA SER 40 HA SER 40 -1.241 14.800 4.379
292 1HB SER 40 2HB SER 40 -3.464 16.075 4.417
293 2HB SER 40 3HB SER 40 -4.066 14.813 5.512
294 HG SER 40 HG SER 40 -1.972 16.673 5.904
295 H ALA 41 H ALA 41 -0.657 14.093 6.510
296 HA ALA 41 HA ALA 41 -0.330 11.390 6.978
297 1HB ALA 41 1HB ALA 41 0.918 13.066 8.203
298 2HB ALA 41 2HB ALA 41 -0.561 13.667 8.990
299 3HB ALA 41 3HB ALA 41 0.042 12.042 9.362
300 H ASN 42 H ASN 42 -3.014 13.457 8.070
301 HA ASN 42 HA ASN 42 -4.462 11.631 9.680
302 1HB ASN 42 2HB ASN 42 -5.031 14.149 8.199
303 2HB ASN 42 3HB ASN 42 -6.417 13.067 8.257
304 1HD2 ASN 42 1HD2 ASN 42 -3.823 13.967 10.643
305 2HD2 ASN 42 2HD2 ASN 42 -4.989 14.331 11.906
306 H GLN 43 H GLN 43 -4.952 12.282 6.187
307 HA GLN 43 HA GLN 43 -6.831 10.185 5.793
308 1HB GLN 43 2HB GLN 43 -5.426 12.167 4.157
309 2HB GLN 43 3HB GLN 43 -5.454 10.613 3.336
310 1HG GLN 43 2HG GLN 43 -7.959 11.838 4.557
311 2HG GLN 43 3HG GLN 43 -7.417 12.207 2.919
312 1HE2 GLN 43 1HE2 GLN 43 -9.680 10.334 4.384
313 2HE2 GLN 43 2HE2 GLN 43 -9.666 8.989 3.263
314 H VAL 44 H VAL 44 -3.229 10.269 5.396
315 HA VAL 44 HA VAL 44 -3.006 7.651 4.346
316 HB VAL 44 HB VAL 44 -1.119 9.399 5.967
317 1HG1 VAL 44 1HG1 VAL 44 -0.557 6.840 4.432
318 2HG1 VAL 44 2HG1 VAL 44 0.681 7.997 4.982
319 3HG1 VAL 44 3HG1 VAL 44 -0.297 7.118 6.169
320 1HG2 VAL 44 1HG2 VAL 44 -1.246 8.810 2.971
321 2HG2 VAL 44 2HG2 VAL 44 -1.881 10.282 3.708
322 3HG2 VAL 44 3HG2 VAL 44 -0.156 9.949 3.791
323 H LYS 45 H LYS 45 -3.225 8.823 7.744
324 HA LYS 45 HA LYS 45 -2.726 6.256 8.898
325 1HB LYS 45 2HB LYS 45 -2.826 8.758 9.926
326 2HB LYS 45 3HB LYS 45 -4.430 8.203 10.371
327 1HG LYS 45 2HG LYS 45 -3.211 7.526 12.173
328 2HG LYS 45 3HG LYS 45 -3.144 6.037 11.240
329 1HD LYS 45 2HD LYS 45 -0.887 6.555 10.443
330 2HD LYS 45 3HD LYS 45 -1.003 8.214 11.050
331 1HE LYS 45 2HE LYS 45 -1.042 7.436 13.371
332 2HE LYS 45 3HE LYS 45 -0.925 5.751 12.846
333 1HZ LYS 45 1HZ LYS 45 1.240 6.194 11.984
334 2HZ LYS 45 2HZ LYS 45 1.088 7.803 12.149
335 3HZ LYS 45 3HZ LYS 45 1.215 6.850 13.494
336 H ASP 46 H ASP 46 -5.739 8.054 8.085
337 HA ASP 46 HA ASP 46 -7.596 6.139 9.048
338 1HB ASP 46 2HB ASP 46 -7.752 8.186 6.794
339 2HB ASP 46 3HB ASP 46 -9.104 7.135 7.217
340 H VAL 47 H VAL 47 -6.270 6.502 5.712
341 HA VAL 47 HA VAL 47 -7.497 4.116 4.772
342 HB VAL 47 HB VAL 47 -6.083 4.173 2.876
343 1HG1 VAL 47 1HG1 VAL 47 -6.807 6.157 1.962
344 2HG1 VAL 47 2HG1 VAL 47 -7.813 6.133 3.431
345 3HG1 VAL 47 3HG1 VAL 47 -6.355 7.121 3.361
346 1HG2 VAL 47 1HG2 VAL 47 -4.338 6.068 4.325
347 2HG2 VAL 47 2HG2 VAL 47 -3.882 4.451 3.749
348 3HG2 VAL 47 3HG2 VAL 47 -4.223 5.748 2.584
349 H PHE 48 H PHE 48 -4.298 4.638 6.388
350 HA PHE 48 HA PHE 48 -3.296 2.013 6.260
351 1HB PHE 48 2HB PHE 48 -1.908 3.671 7.067
352 2HB PHE 48 3HB PHE 48 -3.038 4.189 8.291
353 HD1 PHE 48 1HD PHE 48 -0.457 1.728 7.491
354 HD2 PHE 48 2HD PHE 48 -3.495 2.875 10.332
355 HE1 PHE 48 1HE PHE 48 0.491 0.173 9.149
356 HE2 PHE 48 2HE PHE 48 -2.768 1.047 11.837
357 HZ PHE 48 HZ PHE 48 -0.771 -0.315 11.260
358 H ARG 49 H ARG 49 -5.645 3.360 8.678
359 HA ARG 49 HA ARG 49 -5.927 0.894 10.093
360 1HB ARG 49 2HB ARG 49 -7.821 3.248 9.759
361 2HB ARG 49 3HB ARG 49 -8.230 1.802 10.686
362 1HG ARG 49 2HG ARG 49 -6.137 2.135 12.068
363 2HG ARG 49 3HG ARG 49 -5.880 3.666 11.209
364 1HD ARG 49 2HD ARG 49 -7.014 4.105 13.322
365 2HD ARG 49 3HD ARG 49 -8.102 4.447 11.956
366 HE ARG 49 HE ARG 49 -8.347 1.717 13.022
367 1HH1 ARG 49 2HH2 ARG 49 -9.430 5.044 13.491
368 2HH1 ARG 49 1HH2 ARG 49 -10.920 4.611 14.269
369 1HH2 ARG 49 2HH1 ARG 49 -10.220 1.108 14.045
370 2HH2 ARG 49 1HH1 ARG 49 -11.418 2.271 14.572
371 H PHE 50 H PHE 50 -7.506 1.976 7.078
372 HA PHE 50 HA PHE 50 -9.403 -0.247 7.033
373 1HB PHE 50 2HB PHE 50 -8.449 1.763 4.998
374 2HB PHE 50 3HB PHE 50 -9.151 0.262 4.443
375 HD1 PHE 50 1HD PHE 50 -9.887 3.083 6.834
376 HD2 PHE 50 2HD PHE 50 -11.472 0.066 4.182
377 HE1 PHE 50 1HE PHE 50 -12.175 3.988 7.154
378 HE2 PHE 50 2HE PHE 50 -13.751 0.983 4.509
379 HZ PHE 50 HZ PHE 50 -14.108 2.926 6.002
380 H ILE 51 H ILE 51 -5.996 0.213 6.114
381 HA ILE 51 HA ILE 51 -5.885 -2.289 4.664
382 HB ILE 51 HB ILE 51 -3.513 -0.776 5.781
383 1HG1 ILE 51 2HG1 ILE 51 -4.324 0.935 4.496
384 2HG1 ILE 51 3HG1 ILE 51 -3.365 0.074 3.329
385 1HG2 ILE 51 1HG2 ILE 51 -3.046 -3.059 4.970
386 2HG2 ILE 51 2HG2 ILE 51 -3.896 -2.726 3.474
387 3HG2 ILE 51 3HG2 ILE 51 -2.373 -1.888 3.838
388 1HD1 ILE 51 1HD1 ILE 51 -5.519 -1.061 2.530
389 2HD1 ILE 51 2HD1 ILE 51 -6.403 0.102 3.541
390 3HD1 ILE 51 3HD1 ILE 51 -5.357 0.690 2.260
391 H ASP 52 H ASP 52 -4.867 -1.280 7.988
392 HA ASP 52 HA ASP 52 -4.102 -4.001 8.683
393 1HB ASP 52 2HB ASP 52 -3.227 -1.834 9.807
394 2HB ASP 52 3HB ASP 52 -4.731 -1.802 10.703
395 H ASN 53 H ASN 53 -6.196 -4.727 7.687
396 HA ASN 53 HA ASN 53 -8.741 -4.148 8.640
397 1HB ASN 53 2HB ASN 53 -8.199 -5.288 6.559
398 2HB ASN 53 3HB ASN 53 -7.686 -6.743 7.424
399 1HD2 ASN 53 1HD2 ASN 53 -9.319 -8.172 8.263
400 2HD2 ASN 53 2HD2 ASN 53 -11.011 -7.942 7.880
401 H ASP 54 H ASP 54 -6.404 -6.509 9.883
402 HA ASP 54 HA ASP 54 -8.218 -7.802 11.751
403 1HB ASP 54 2HB ASP 54 -6.129 -8.871 12.491
404 2HB ASP 54 3HB ASP 54 -6.251 -8.926 10.722
405 H GLN 55 H GLN 55 -6.404 -4.829 11.682
406 HA GLN 55 HA GLN 55 -5.699 -3.347 13.169
407 1HB GLN 55 2HB GLN 55 -8.356 -4.173 14.243
408 2HB GLN 55 3HB GLN 55 -7.360 -3.090 15.230
409 1HG GLN 55 2HG GLN 55 -7.076 -1.529 13.355
410 2HG GLN 55 3HG GLN 55 -8.082 -2.552 12.320
411 1HE2 GLN 55 1HE2 GLN 55 -10.126 -3.200 14.251
412 2HE2 GLN 55 2HE2 GLN 55 -11.027 -1.735 14.559
413 H SER 56 H SER 56 -3.820 -4.606 13.416
414 HA SER 56 HA SER 56 -3.468 -5.766 16.175
415 1HB SER 56 2HB SER 56 -1.509 -6.908 15.397
416 2HB SER 56 3HB SER 56 -2.928 -7.447 14.515
417 HG SER 56 HG SER 56 -0.681 -6.639 13.498
418 H GLY 57 H GLY 57 -2.421 -3.275 13.854
419 1HA GLY 57 1HA GLY 57 -1.061 -1.441 14.334
420 2HA GLY 57 2HA GLY 57 -0.560 -2.138 15.878
421 H TYR 58 H TYR 58 -0.423 -4.493 13.382
422 HA TYR 58 HA TYR 58 2.124 -3.565 12.253
423 1HB TYR 58 2HB TYR 58 1.807 -6.209 13.683
424 2HB TYR 58 3HB TYR 58 2.829 -6.069 12.262
425 HD1 TYR 58 HD1 TYR 58 4.700 -4.375 12.162
426 HD2 TYR 58 HD2 TYR 58 2.794 -5.603 15.825
427 HE1 TYR 58 HE1 TYR 58 6.672 -3.613 13.424
428 HE2 TYR 58 HE2 TYR 58 4.824 -4.924 17.088
429 HH TYR 58 HH TYR 58 7.645 -3.408 15.512
430 H LEU 59 H LEU 59 2.145 -3.775 10.194
431 HA LEU 59 HA LEU 59 0.198 -5.433 8.689
432 1HB LEU 59 2HB LEU 59 1.945 -3.070 7.932
433 2HB LEU 59 3HB LEU 59 1.323 -4.197 6.722
434 HG LEU 59 HG LEU 59 -0.028 -2.161 6.940
435 1HD1 LEU 59 1HD1 LEU 59 -1.097 -4.230 6.097
436 2HD1 LEU 59 2HD1 LEU 59 -1.588 -4.666 7.749
437 3HD1 LEU 59 3HD1 LEU 59 -2.225 -3.202 7.015
438 1HD2 LEU 59 1HD2 LEU 59 -1.336 -1.666 8.808
439 2HD2 LEU 59 2HD2 LEU 59 -0.997 -3.205 9.618
440 3HD2 LEU 59 3HD2 LEU 59 0.287 -1.992 9.473
441 H ASP 60 H ASP 60 1.299 -7.206 9.677
442 HA ASP 60 HA ASP 60 3.931 -7.965 8.935
443 1HB ASP 60 2HB ASP 60 1.468 -9.694 9.411
444 2HB ASP 60 3HB ASP 60 3.159 -10.221 9.503
445 H GLU 61 H GLU 61 4.593 -9.413 7.253
446 HA GLU 61 HA GLU 61 4.055 -8.553 4.715
447 1HB GLU 61 2HB GLU 61 5.074 -11.285 5.625
448 2HB GLU 61 3HB GLU 61 5.201 -10.667 3.972
449 1HG GLU 61 2HG GLU 61 6.583 -8.807 4.701
450 2HG GLU 61 3HG GLU 61 6.424 -9.260 6.401
451 H GLU 62 H GLU 62 2.598 -11.401 6.282
452 HA GLU 62 HA GLU 62 1.256 -12.393 4.004
453 1HB GLU 62 2HB GLU 62 1.768 -13.536 6.235
454 2HB GLU 62 3HB GLU 62 0.342 -12.729 6.903
455 1HG GLU 62 2HG GLU 62 0.252 -14.516 4.422
456 2HG GLU 62 3HG GLU 62 0.100 -15.143 6.070
457 H GLU 63 H GLU 63 0.149 -10.125 6.554
458 HA GLU 63 HA GLU 63 -2.501 -9.760 5.569
459 1HB GLU 63 2HB GLU 63 -0.668 -7.794 6.990
460 2HB GLU 63 3HB GLU 63 -2.426 -7.685 6.871
461 1HG GLU 63 2HG GLU 63 -2.691 -9.750 8.182
462 2HG GLU 63 3HG GLU 63 -0.932 -9.974 8.285
463 H LEU 64 H LEU 64 0.609 -8.112 4.875
464 HA LEU 64 HA LEU 64 -0.441 -6.239 3.028
465 1HB LEU 64 2HB LEU 64 1.983 -6.647 4.133
466 2HB LEU 64 3HB LEU 64 2.332 -7.275 2.525
467 HG LEU 64 HG LEU 64 1.036 -4.548 3.040
468 1HD1 LEU 64 1HD1 LEU 64 3.995 -5.202 2.810
469 2HD1 LEU 64 2HD1 LEU 64 3.291 -3.568 2.818
470 3HD1 LEU 64 3HD1 LEU 64 3.129 -4.606 4.245
471 1HD2 LEU 64 1HD2 LEU 64 1.872 -3.935 0.845
472 2HD2 LEU 64 2HD2 LEU 64 2.684 -5.495 0.653
473 3HD2 LEU 64 3HD2 LEU 64 0.909 -5.404 0.671
474 H LYS 65 H LYS 65 0.587 -9.619 2.577
475 HA LYS 65 HA LYS 65 0.232 -9.808 -0.227
476 1HB LYS 65 2HB LYS 65 1.152 -11.511 1.565
477 2HB LYS 65 3HB LYS 65 -0.534 -12.073 1.593
478 1HG LYS 65 2HG LYS 65 -0.331 -12.245 -0.983
479 2HG LYS 65 3HG LYS 65 1.405 -12.077 -0.735
480 1HD LYS 65 2HD LYS 65 -0.481 -14.225 0.342
481 2HD LYS 65 3HD LYS 65 0.809 -14.428 -0.860
482 1HE LYS 65 2HE LYS 65 2.478 -13.774 0.971
483 2HE LYS 65 3HE LYS 65 1.128 -13.798 2.124
484 1HZ LYS 65 1HZ LYS 65 0.781 -16.095 1.616
485 2HZ LYS 65 2HZ LYS 65 2.057 -16.102 0.565
486 3HZ LYS 65 3HZ LYS 65 2.306 -15.836 2.169
487 H PHE 66 H PHE 66 -2.199 -9.170 2.165
488 HA PHE 66 HA PHE 66 -4.310 -9.665 0.113
489 1HB PHE 66 2HB PHE 66 -4.227 -11.136 2.294
490 2HB PHE 66 3HB PHE 66 -4.819 -9.694 3.094
491 HD1 PHE 66 1HD PHE 66 -7.176 -9.016 2.788
492 HD2 PHE 66 2HD PHE 66 -5.520 -12.289 0.521
493 HE1 PHE 66 1HE PHE 66 -9.445 -9.603 1.972
494 HE2 PHE 66 2HE PHE 66 -7.795 -12.886 -0.271
495 HZ PHE 66 HZ PHE 66 -9.756 -11.528 0.430
496 H PHE 67 H PHE 67 -2.515 -7.285 0.659
497 HA PHE 67 HA PHE 67 -4.054 -5.277 1.968
498 1HB PHE 67 2HB PHE 67 -1.760 -4.877 1.711
499 2HB PHE 67 3HB PHE 67 -1.787 -5.245 -0.011
500 HD1 PHE 67 1HD PHE 67 -0.416 -3.295 -0.444
501 HD2 PHE 67 2HD PHE 67 -4.348 -2.861 1.296
502 HE1 PHE 67 1HE PHE 67 -0.496 -0.923 -1.162
503 HE2 PHE 67 2HE PHE 67 -4.468 -0.574 0.436
504 HZ PHE 67 HZ PHE 67 -2.528 0.441 -0.733
505 H LEU 68 H LEU 68 -3.462 -5.385 -1.618
506 HA LEU 68 HA LEU 68 -5.390 -3.355 -1.905
507 1HB LEU 68 2HB LEU 68 -3.261 -4.210 -3.305
508 2HB LEU 68 3HB LEU 68 -4.543 -4.903 -4.283
509 HG LEU 68 HG LEU 68 -4.569 -1.977 -3.482
510 1HD1 LEU 68 1HD1 LEU 68 -2.975 -3.206 -5.763
511 2HD1 LEU 68 2HD1 LEU 68 -3.313 -1.471 -5.584
512 3HD1 LEU 68 3HD1 LEU 68 -2.336 -2.314 -4.366
513 1HD2 LEU 68 1HD2 LEU 68 -5.386 -3.088 -6.185
514 2HD2 LEU 68 2HD2 LEU 68 -6.508 -3.183 -4.833
515 3HD2 LEU 68 3HD2 LEU 68 -5.914 -1.608 -5.386
516 H GLN 69 H GLN 69 -5.770 -6.808 -1.959
517 HA GLN 69 HA GLN 69 -8.279 -7.243 -3.007
518 1HB GLN 69 2HB GLN 69 -7.197 -8.226 -0.343
519 2HB GLN 69 3HB GLN 69 -8.572 -8.930 -1.187
520 1HG GLN 69 2HG GLN 69 -5.718 -8.861 -2.248
521 2HG GLN 69 3HG GLN 69 -6.470 -10.217 -1.441
522 1HE2 GLN 69 1HE2 GLN 69 -5.370 -10.048 -4.253
523 2HE2 GLN 69 2HE2 GLN 69 -6.656 -10.637 -5.206
524 H LYS 70 H LYS 70 -7.519 -5.169 -0.262
525 HA LYS 70 HA LYS 70 -10.264 -5.061 0.744
526 1HB LYS 70 2HB LYS 70 -7.919 -3.200 1.246
527 2HB LYS 70 3HB LYS 70 -9.372 -3.324 2.229
528 1HG LYS 70 2HG LYS 70 -7.907 -5.924 1.969
529 2HG LYS 70 3HG LYS 70 -6.930 -4.626 2.625
530 1HD LYS 70 2HD LYS 70 -7.942 -5.878 4.378
531 2HD LYS 70 3HD LYS 70 -8.508 -4.205 4.408
532 1HE LYS 70 2HE LYS 70 -10.314 -5.866 2.785
533 2HE LYS 70 3HE LYS 70 -10.051 -6.651 4.334
534 1HZ LYS 70 1HZ LYS 70 -11.921 -5.084 4.275
535 2HZ LYS 70 2HZ LYS 70 -10.837 -4.794 5.465
536 3HZ LYS 70 3HZ LYS 70 -10.862 -3.830 4.115
537 H PHE 71 H PHE 71 -8.427 -3.495 -1.750
538 HA PHE 71 HA PHE 71 -10.278 -1.170 -1.980
539 1HB PHE 71 2HB PHE 71 -7.686 -1.874 -3.414
540 2HB PHE 71 3HB PHE 71 -8.657 -0.440 -3.692
541 HD1 PHE 71 1HD PHE 71 -8.834 -0.620 -0.223
542 HD2 PHE 71 2HD PHE 71 -5.951 0.014 -3.373
543 HE1 PHE 71 1HE PHE 71 -7.589 0.943 1.217
544 HE2 PHE 71 2HE PHE 71 -4.777 1.669 -1.960
545 HZ PHE 71 HZ PHE 71 -5.635 2.193 0.315
546 H GLU 72 H GLU 72 -8.753 -3.684 -4.023
547 HA GLU 72 HA GLU 72 -11.034 -3.579 -5.940
548 1HB GLU 72 2HB GLU 72 -8.381 -3.071 -6.492
549 2HB GLU 72 3HB GLU 72 -8.403 -4.822 -6.694
550 1HG GLU 72 2HG GLU 72 -8.840 -3.864 -8.835
551 2HG GLU 72 3HG GLU 72 -10.434 -4.402 -8.295
552 H SER 73 H SER 73 -10.915 -5.941 -7.121
553 HA SER 73 HA SER 73 -10.688 -8.039 -4.987
554 1HB SER 73 2HB SER 73 -12.845 -7.879 -7.146
555 2HB SER 73 3HB SER 73 -12.714 -9.091 -5.862
556 HG SER 73 HG SER 73 -13.006 -6.306 -5.375
557 H GLY 74 H GLY 74 -8.556 -7.502 -6.571
558 1HA GLY 74 1HA GLY 74 -7.642 -9.884 -7.466
559 2HA GLY 74 2HA GLY 74 -8.576 -9.339 -8.875
560 H ALA 75 H ALA 75 -6.230 -7.859 -6.489
561 HA ALA 75 HA ALA 75 -5.051 -6.349 -8.767
562 1HB ALA 75 1HB ALA 75 -5.749 -5.420 -6.374
563 2HB ALA 75 2HB ALA 75 -4.141 -6.026 -5.949
564 3HB ALA 75 3HB ALA 75 -4.298 -4.843 -7.246
565 H ARG 76 H ARG 76 -2.517 -6.416 -7.004
566 HA ARG 76 HA ARG 76 -1.505 -9.068 -7.932
567 1HB ARG 76 2HB ARG 76 -0.979 -7.101 -9.381
568 2HB ARG 76 3HB ARG 76 -0.101 -6.365 -8.032
569 1HG ARG 76 2HG ARG 76 1.666 -7.731 -8.261
570 2HG ARG 76 3HG ARG 76 0.698 -9.176 -8.495
571 1HD ARG 76 2HD ARG 76 0.158 -8.538 -10.852
572 2HD ARG 76 3HD ARG 76 1.129 -7.078 -10.663
573 HE ARG 76 HE ARG 76 3.114 -8.364 -10.367
574 1HH1 ARG 76 2HH2 ARG 76 0.496 -10.412 -11.541
575 2HH1 ARG 76 1HH2 ARG 76 1.572 -11.669 -12.080
576 1HH2 ARG 76 2HH1 ARG 76 4.511 -9.926 -10.992
577 2HH2 ARG 76 1HH1 ARG 76 3.991 -11.317 -11.858
578 H GLU 77 H GLU 77 -2.537 -8.727 -5.406
579 HA GLU 77 HA GLU 77 -0.464 -8.156 -3.475
580 1HB GLU 77 2HB GLU 77 -2.972 -9.646 -2.795
581 2HB GLU 77 3HB GLU 77 -2.025 -8.479 -1.870
582 1HG GLU 77 2HG GLU 77 -3.927 -7.315 -2.388
583 2HG GLU 77 3HG GLU 77 -2.819 -6.721 -3.637
584 H LEU 78 H LEU 78 -2.044 -10.864 -4.988
585 HA LEU 78 HA LEU 78 -1.000 -13.054 -3.672
586 1HB LEU 78 2HB LEU 78 -1.244 -13.042 -6.702
587 2HB LEU 78 3HB LEU 78 -1.446 -14.370 -5.568
588 HG LEU 78 HG LEU 78 -3.595 -14.000 -6.123
589 1HD1 LEU 78 1HD1 LEU 78 -4.855 -13.001 -4.397
590 2HD1 LEU 78 2HD1 LEU 78 -3.400 -13.678 -3.651
591 3HD1 LEU 78 3HD1 LEU 78 -3.549 -11.924 -3.908
592 1HD2 LEU 78 1HD2 LEU 78 -3.478 -12.328 -7.709
593 2HD2 LEU 78 2HD2 LEU 78 -4.604 -11.681 -6.509
594 3HD2 LEU 78 3HD2 LEU 78 -2.937 -11.077 -6.595
595 H THR 79 H THR 79 0.600 -11.173 -6.324
596 HA THR 79 HA THR 79 2.857 -12.915 -6.418
597 HB THR 79 HB THR 79 2.851 -9.998 -7.255
598 HG1 THR 79 1HG THR 79 2.662 -11.378 -9.288
599 1HG2 THR 79 1HG2 THR 79 4.661 -10.792 -8.745
600 2HG2 THR 79 2HG2 THR 79 5.060 -11.242 -7.090
601 3HG2 THR 79 3HG2 THR 79 4.422 -12.460 -8.199
602 H GLU 80 H GLU 80 4.172 -13.227 -4.831
603 HA GLU 80 HA GLU 80 4.514 -11.577 -2.566
604 1HB GLU 80 2HB GLU 80 6.387 -12.995 -1.988
605 2HB GLU 80 3HB GLU 80 4.958 -13.903 -2.484
606 1HG GLU 80 2HG GLU 80 6.046 -14.161 -4.807
607 2HG GLU 80 3HG GLU 80 7.514 -13.469 -4.095
608 H SER 81 H SER 81 6.540 -11.759 -5.599
609 HA SER 81 HA SER 81 8.486 -9.949 -5.000
610 1HB SER 81 2HB SER 81 6.934 -10.177 -7.612
611 2HB SER 81 3HB SER 81 8.558 -9.522 -7.414
612 HG SER 81 HG SER 81 8.455 -11.763 -8.048
613 H GLU 82 H GLU 82 5.394 -8.948 -6.578
614 HA GLU 82 HA GLU 82 5.887 -6.237 -6.290
615 1HB GLU 82 2HB GLU 82 3.331 -7.808 -6.729
616 2HB GLU 82 3HB GLU 82 3.342 -6.049 -6.651
617 1HG GLU 82 2HG GLU 82 3.463 -6.655 -8.978
618 2HG GLU 82 3HG GLU 82 5.001 -5.937 -8.502
619 H THR 83 H THR 83 4.020 -8.408 -4.117
620 HA THR 83 HA THR 83 3.185 -6.439 -2.343
621 HB THR 83 HB THR 83 3.826 -9.373 -2.115
622 HG1 THR 83 1HG THR 83 1.695 -7.955 -1.020
623 1HG2 THR 83 1HG2 THR 83 3.410 -7.650 0.367
624 2HG2 THR 83 2HG2 THR 83 3.193 -9.407 0.300
625 3HG2 THR 83 3HG2 THR 83 4.795 -8.713 0.039
626 H LYS 84 H LYS 84 6.242 -8.245 -2.620
627 HA LYS 84 HA LYS 84 7.459 -7.153 -0.322
628 1HB LYS 84 2HB LYS 84 8.010 -9.328 -1.042
629 2HB LYS 84 3HB LYS 84 8.616 -8.761 -2.610
630 1HG LYS 84 2HG LYS 84 10.520 -7.842 -1.727
631 2HG LYS 84 3HG LYS 84 9.816 -7.628 -0.100
632 1HD LYS 84 2HD LYS 84 10.006 -9.923 0.456
633 2HD LYS 84 3HD LYS 84 10.236 -10.414 -1.225
634 1HE LYS 84 2HE LYS 84 12.345 -10.533 0.090
635 2HE LYS 84 3HE LYS 84 12.453 -9.473 -1.323
636 1HZ LYS 84 1HZ LYS 84 12.047 -8.582 1.457
637 2HZ LYS 84 2HZ LYS 84 13.450 -8.470 0.603
638 3HZ LYS 84 3HZ LYS 84 12.139 -7.593 0.143
639 H SER 85 H SER 85 7.480 -6.098 -3.754
640 HA SER 85 HA SER 85 9.420 -4.095 -3.560
641 1HB SER 85 2HB SER 85 6.724 -3.912 -4.980
642 2HB SER 85 3HB SER 85 8.131 -2.888 -5.245
643 HG SER 85 HG SER 85 8.069 -4.486 -6.762
644 H LEU 86 H LEU 86 5.950 -3.978 -2.510
645 HA LEU 86 HA LEU 86 6.196 -1.313 -1.400
646 1HB LEU 86 2HB LEU 86 4.195 -3.539 -1.157
647 2HB LEU 86 3HB LEU 86 4.232 -2.350 0.143
648 HG LEU 86 HG LEU 86 4.076 -1.555 -2.764
649 1HD1 LEU 86 1HD1 LEU 86 1.799 -2.009 -0.785
650 2HD1 LEU 86 2HD1 LEU 86 1.622 -1.289 -2.398
651 3HD1 LEU 86 3HD1 LEU 86 2.129 -2.980 -2.239
652 1HD2 LEU 86 1HD2 LEU 86 4.736 0.290 -1.212
653 2HD2 LEU 86 2HD2 LEU 86 3.095 0.547 -1.805
654 3HD2 LEU 86 3HD2 LEU 86 3.354 -0.092 -0.172
655 H MET 87 H MET 87 6.193 -4.554 0.174
656 HA MET 87 HA MET 87 6.822 -3.760 2.696
657 1HB MET 87 2HB MET 87 6.477 -6.150 1.851
658 2HB MET 87 3HB MET 87 8.186 -6.125 1.386
659 1HG MET 87 2HG MET 87 8.233 -5.328 4.081
660 2HG MET 87 3HG MET 87 6.975 -6.552 4.004
661 1HE MET 87 1HE MET 87 10.679 -5.612 3.707
662 2HE MET 87 2HE MET 87 11.469 -7.105 3.165
663 3HE MET 87 3HE MET 87 10.455 -6.176 2.032
664 H ALA 88 H ALA 88 9.162 -4.128 0.078
665 HA ALA 88 HA ALA 88 11.572 -4.036 1.472
666 1HB ALA 88 1HB ALA 88 10.863 -3.110 -1.349
667 2HB ALA 88 2HB ALA 88 12.521 -3.332 -0.744
668 3HB ALA 88 3HB ALA 88 11.417 -4.716 -0.865
669 H ALA 89 H ALA 89 9.661 -1.300 0.156
670 HA ALA 89 HA ALA 89 11.641 0.654 1.208
671 1HB ALA 89 1HB ALA 89 8.969 1.017 -0.159
672 2HB ALA 89 2HB ALA 89 10.095 2.325 0.268
673 3HB ALA 89 3HB ALA 89 10.581 1.116 -0.935
674 H ALA 90 H ALA 90 8.277 -0.445 1.797
675 HA ALA 90 HA ALA 90 7.563 1.489 3.736
676 1HB ALA 90 1HB ALA 90 6.708 -1.427 3.523
677 2HB ALA 90 2HB ALA 90 5.845 -0.135 4.383
678 3HB ALA 90 3HB ALA 90 5.992 -0.076 2.605
679 H ASP 91 H ASP 91 9.163 -1.722 4.135
680 HA ASP 91 HA ASP 91 9.304 -1.387 6.984
681 1HB ASP 91 2HB ASP 91 9.235 -3.638 5.981
682 2HB ASP 91 3HB ASP 91 10.827 -3.358 5.251
683 H ASN 92 H ASN 92 10.230 0.803 6.876
684 HA ASN 92 HA ASN 92 12.977 1.155 5.970
685 1HB ASN 92 2HB ASN 92 12.809 3.394 6.977
686 2HB ASN 92 3HB ASN 92 11.489 3.000 5.880
687 1HD2 ASN 92 1HD2 ASN 92 12.200 2.733 9.440
688 2HD2 ASN 92 2HD2 ASN 92 10.600 3.291 9.921
689 H ASP 93 H ASP 93 13.094 -1.061 7.507
690 HA ASP 93 HA ASP 93 14.688 -0.263 9.915
691 1HB ASP 93 2HB ASP 93 12.561 -2.441 9.731
692 2HB ASP 93 3HB ASP 93 13.740 -2.311 11.035
693 H GLY 94 H GLY 94 13.580 -3.058 7.933
694 1HA GLY 94 1HA GLY 94 15.049 -4.598 6.813
695 2HA GLY 94 2HA GLY 94 16.336 -4.232 7.974
696 H ASP 95 H ASP 95 12.827 -4.849 8.394
697 HA ASP 95 HA ASP 95 13.415 -7.404 9.783
698 1HB ASP 95 2HB ASP 95 11.719 -7.074 11.446
699 2HB ASP 95 3HB ASP 95 12.997 -5.865 11.589
700 H GLY 96 H GLY 96 10.554 -5.509 8.606
701 1HA GLY 96 1HA GLY 96 9.759 -6.321 6.336
702 2HA GLY 96 2HA GLY 96 9.692 -7.938 7.052
703 H LYS 97 H LYS 97 8.940 -6.394 9.688
704 HA LYS 97 HA LYS 97 6.012 -6.612 9.314
705 1HB LYS 97 2HB LYS 97 7.698 -6.094 11.797
706 2HB LYS 97 3HB LYS 97 5.960 -6.422 11.734
707 1HG LYS 97 2HG LYS 97 6.421 -8.706 10.850
708 2HG LYS 97 3HG LYS 97 8.157 -8.356 10.861
709 1HD LYS 97 2HD LYS 97 7.906 -9.523 12.844
710 2HD LYS 97 3HD LYS 97 7.877 -7.832 13.381
711 1HE LYS 97 2HE LYS 97 5.275 -8.011 13.218
712 2HE LYS 97 3HE LYS 97 5.531 -9.744 12.949
713 1HZ LYS 97 1HZ LYS 97 6.332 -8.260 15.349
714 2HZ LYS 97 2HZ LYS 97 5.038 -9.267 15.193
715 3HZ LYS 97 3HZ LYS 97 6.563 -9.877 15.086
716 H ILE 98 H ILE 98 5.069 -4.747 8.600
717 HA ILE 98 HA ILE 98 6.458 -2.136 8.990
718 HB ILE 98 HB ILE 98 4.189 -3.114 7.251
719 1HG1 ILE 98 2HG1 ILE 98 6.691 -1.998 6.063
720 2HG1 ILE 98 3HG1 ILE 98 6.939 -3.485 6.959
721 1HG2 ILE 98 1HG2 ILE 98 3.771 -0.744 7.726
722 2HG2 ILE 98 2HG2 ILE 98 5.438 -0.344 7.239
723 3HG2 ILE 98 3HG2 ILE 98 4.285 -0.984 6.055
724 1HD1 ILE 98 1HD1 ILE 98 5.007 -3.098 4.667
725 2HD1 ILE 98 2HD1 ILE 98 6.472 -4.106 4.754
726 3HD1 ILE 98 3HD1 ILE 98 5.059 -4.559 5.701
727 H GLY 99 H GLY 99 5.205 -0.340 9.904
728 1HA GLY 99 1HA GLY 99 2.730 -1.076 11.405
729 2HA GLY 99 2HA GLY 99 4.075 -0.250 12.222
730 H ALA 100 H ALA 100 1.918 1.241 12.353
731 HA ALA 100 HA ALA 100 1.203 2.659 9.959
732 1HB ALA 100 1HB ALA 100 -0.181 2.438 12.116
733 2HB ALA 100 2HB ALA 100 0.846 3.728 12.764
734 3HB ALA 100 3HB ALA 100 -0.138 4.005 11.294
735 H GLU 101 H GLU 101 3.601 3.240 12.533
736 HA GLU 101 HA GLU 101 4.332 5.828 11.605
737 1HB GLU 101 2HB GLU 101 5.763 3.735 13.281
738 2HB GLU 101 3HB GLU 101 6.598 5.187 12.708
739 1HG GLU 101 2HG GLU 101 4.869 6.634 13.704
740 2HG GLU 101 3HG GLU 101 4.030 5.205 14.351
741 H GLU 102 H GLU 102 5.939 2.638 10.962
742 HA GLU 102 HA GLU 102 7.732 3.552 9.069
743 1HB GLU 102 2HB GLU 102 6.285 0.887 8.912
744 2HB GLU 102 3HB GLU 102 7.859 1.289 8.245
745 1HG GLU 102 2HG GLU 102 8.789 1.571 10.503
746 2HG GLU 102 3HG GLU 102 7.238 1.133 11.237
747 H PHE 103 H PHE 103 4.354 2.463 8.525
748 HA PHE 103 HA PHE 103 4.417 2.729 5.690
749 1HB PHE 103 2HB PHE 103 2.742 1.428 7.007
750 2HB PHE 103 3HB PHE 103 2.013 2.936 7.542
751 HD1 PHE 103 1HD PHE 103 2.857 0.891 4.514
752 HD2 PHE 103 2HD PHE 103 0.432 4.093 6.091
753 HE1 PHE 103 1HE PHE 103 1.456 0.840 2.472
754 HE2 PHE 103 2HE PHE 103 -1.007 3.990 4.074
755 HZ PHE 103 HZ PHE 103 -0.495 2.365 2.259
756 H GLN 104 H GLN 104 3.160 4.983 8.223
757 HA GLN 104 HA GLN 104 2.409 7.124 6.474
758 1HB GLN 104 2HB GLN 104 1.754 6.855 8.862
759 2HB GLN 104 3HB GLN 104 3.423 7.252 9.334
760 1HG GLN 104 2HG GLN 104 3.131 9.442 8.056
761 2HG GLN 104 3HG GLN 104 1.426 9.015 7.849
762 1HE2 GLN 104 1HE2 GLN 104 2.613 11.304 9.320
763 2HE2 GLN 104 2HE2 GLN 104 2.070 11.150 10.979
764 H GLU 105 H GLU 105 5.572 6.455 8.141
765 HA GLU 105 HA GLU 105 6.962 8.736 7.272
766 1HB GLU 105 2HB GLU 105 7.742 5.888 7.977
767 2HB GLU 105 3HB GLU 105 8.946 6.919 7.217
768 1HG GLU 105 2HG GLU 105 7.412 7.830 9.676
769 2HG GLU 105 3HG GLU 105 8.949 6.945 9.745
770 H MET 106 H MET 106 6.831 5.504 5.677
771 HA MET 106 HA MET 106 8.286 6.319 3.384
772 1HB MET 106 2HB MET 106 7.933 4.005 3.983
773 2HB MET 106 3HB MET 106 6.183 4.130 3.741
774 1HG MET 106 2HG MET 106 7.967 4.920 1.454
775 2HG MET 106 3HG MET 106 7.879 3.206 1.861
776 1HE MET 106 1HE MET 106 6.862 4.906 -0.960
777 2HE MET 106 2HE MET 106 7.423 3.255 -0.614
778 3HE MET 106 3HE MET 106 5.833 3.501 -1.371
779 H VAL 107 H VAL 107 4.796 6.258 4.041
780 HA VAL 107 HA VAL 107 4.103 7.331 1.506
781 HB VAL 107 HB VAL 107 2.483 6.805 4.004
782 1HG1 VAL 107 1HG1 VAL 107 0.516 6.841 2.443
783 2HG1 VAL 107 2HG1 VAL 107 1.230 8.440 2.689
784 3HG1 VAL 107 3HG1 VAL 107 1.578 7.521 1.208
785 1HG2 VAL 107 1HG2 VAL 107 2.695 5.333 1.326
786 2HG2 VAL 107 2HG2 VAL 107 3.474 4.784 2.816
787 3HG2 VAL 107 3HG2 VAL 107 1.714 4.843 2.717
788 H HIS 108 H HIS 108 5.362 8.919 4.255
789 HA HIS 108 HA HIS 108 4.080 11.482 3.668
790 1HB HIS 108 2HB HIS 108 4.521 10.915 5.955
791 2HB HIS 108 3HB HIS 108 6.221 10.579 5.619
792 HD1 HIS 108 1HD HIS 108 4.501 13.835 4.490
793 HD2 HIS 108 2HD HIS 108 7.294 12.311 7.241
794 HE1 HIS 108 1HE HIS 108 5.556 15.851 5.658
795 H SER 109 H SER 109 6.635 9.634 2.394
796 HA SER 109 HA SER 109 8.612 11.632 1.952
797 1HB SER 109 2HB SER 109 9.021 9.173 2.010
798 2HB SER 109 3HB SER 109 8.142 9.024 0.473
799 HG SER 109 HG SER 109 9.704 10.749 -0.214
Start of MODEL 4
1 1H MET 1 H1 MET 1 -14.830 0.482 2.199
2 2H MET 1 H2 MET 1 -15.836 0.465 0.887
3 3H MET 1 H3 MET 1 -14.529 1.476 0.928
4 HA MET 1 HA MET 1 -16.504 2.737 1.390
5 1HB MET 1 2HB MET 1 -17.742 0.763 2.135
6 2HB MET 1 3HB MET 1 -16.851 0.727 3.659
7 1HG MET 1 2HG MET 1 -17.777 2.982 4.218
8 2HG MET 1 3HG MET 1 -18.685 2.964 2.693
9 1HE MET 1 1HE MET 1 -20.053 3.552 5.474
10 2HE MET 1 2HE MET 1 -20.962 3.453 3.943
11 3HE MET 1 3HE MET 1 -21.508 2.534 5.365
12 H SER 2 H SER 2 -14.900 4.311 1.698
13 HA SER 2 HA SER 2 -14.069 5.502 3.909
14 1HB SER 2 2HB SER 2 -13.082 3.603 5.024
15 2HB SER 2 3HB SER 2 -12.295 3.051 3.533
16 HG SER 2 HG SER 2 -11.640 5.248 5.190
17 H ILE 3 H ILE 3 -11.979 3.820 1.558
18 HA ILE 3 HA ILE 3 -10.854 6.420 0.746
19 HB ILE 3 HB ILE 3 -9.005 5.185 -0.041
20 1HG1 ILE 3 2HG1 ILE 3 -9.314 2.505 0.381
21 2HG1 ILE 3 3HG1 ILE 3 -10.911 2.868 -0.228
22 1HG2 ILE 3 1HG2 ILE 3 -9.350 5.375 2.435
23 2HG2 ILE 3 2HG2 ILE 3 -9.947 3.699 2.433
24 3HG2 ILE 3 3HG2 ILE 3 -8.296 4.045 1.899
25 1HD1 ILE 3 1HD1 ILE 3 -9.429 2.243 -2.072
26 2HD1 ILE 3 2HD1 ILE 3 -9.788 3.965 -2.250
27 3HD1 ILE 3 3HD1 ILE 3 -8.230 3.448 -1.572
28 H THR 4 H THR 4 -12.979 3.965 -0.600
29 HA THR 4 HA THR 4 -12.461 4.171 -3.257
30 HB THR 4 HB THR 4 -13.515 2.300 -2.015
31 HG1 THR 4 1HG THR 4 -14.665 3.702 -4.015
32 1HG2 THR 4 1HG2 THR 4 -14.970 3.651 -0.407
33 2HG2 THR 4 2HG2 THR 4 -15.975 4.120 -1.788
34 3HG2 THR 4 3HG2 THR 4 -15.869 2.421 -1.324
35 H ASP 5 H ASP 5 -13.988 6.450 -1.126
36 HA ASP 5 HA ASP 5 -15.090 7.942 -3.451
37 1HB ASP 5 2HB ASP 5 -16.910 6.679 -2.264
38 2HB ASP 5 3HB ASP 5 -16.493 7.545 -0.769
39 H VAL 6 H VAL 6 -12.598 8.237 -2.393
40 HA VAL 6 HA VAL 6 -12.722 10.926 -1.043
41 HB VAL 6 HB VAL 6 -10.815 8.580 -0.744
42 1HG1 VAL 6 1HG1 VAL 6 -9.324 10.511 -1.036
43 2HG1 VAL 6 2HG1 VAL 6 -10.244 11.424 0.178
44 3HG1 VAL 6 3HG1 VAL 6 -9.346 9.951 0.623
45 1HG2 VAL 6 1HG2 VAL 6 -12.849 8.826 0.730
46 2HG2 VAL 6 2HG2 VAL 6 -11.309 8.851 1.622
47 3HG2 VAL 6 3HG2 VAL 6 -12.193 10.362 1.312
48 H LEU 7 H LEU 7 -10.580 8.931 -3.046
49 HA LEU 7 HA LEU 7 -10.341 10.769 -5.230
50 1HB LEU 7 2HB LEU 7 -9.055 12.212 -3.839
51 2HB LEU 7 3HB LEU 7 -8.305 10.869 -2.976
52 HG LEU 7 HG LEU 7 -6.880 10.334 -4.859
53 1HD1 LEU 7 1HD1 LEU 7 -8.308 11.069 -6.752
54 2HD1 LEU 7 2HD1 LEU 7 -8.119 12.762 -6.235
55 3HD1 LEU 7 3HD1 LEU 7 -6.712 11.830 -6.800
56 1HD2 LEU 7 1HD2 LEU 7 -6.123 11.923 -3.154
57 2HD2 LEU 7 2HD2 LEU 7 -5.440 12.289 -4.747
58 3HD2 LEU 7 3HD2 LEU 7 -6.770 13.273 -4.106
59 H SER 8 H SER 8 -8.382 8.658 -3.197
60 HA SER 8 HA SER 8 -6.733 7.345 -4.656
61 1HB SER 8 2HB SER 8 -7.627 5.277 -3.075
62 2HB SER 8 3HB SER 8 -6.511 6.559 -2.634
63 HG SER 8 HG SER 8 -9.346 6.561 -2.195
64 H ALA 9 H ALA 9 -10.184 6.525 -4.900
65 HA ALA 9 HA ALA 9 -9.958 3.978 -6.103
66 1HB ALA 9 1HB ALA 9 -11.973 6.215 -6.622
67 2HB ALA 9 2HB ALA 9 -12.225 4.493 -6.995
68 3HB ALA 9 3HB ALA 9 -12.083 5.026 -5.308
69 H ASP 10 H ASP 10 -9.695 7.244 -7.566
70 HA ASP 10 HA ASP 10 -9.632 6.225 -10.304
71 1HB ASP 10 2HB ASP 10 -10.265 8.570 -9.530
72 2HB ASP 10 3HB ASP 10 -8.546 8.863 -9.228
73 H ASP 11 H ASP 11 -7.315 7.171 -7.777
74 HA ASP 11 HA ASP 11 -4.975 7.165 -9.310
75 1HB ASP 11 2HB ASP 11 -5.229 6.621 -6.318
76 2HB ASP 11 3HB ASP 11 -3.887 7.358 -7.185
77 H ILE 12 H ILE 12 -6.402 4.645 -7.180
78 HA ILE 12 HA ILE 12 -4.432 2.703 -7.601
79 HB ILE 12 HB ILE 12 -5.999 1.126 -6.837
80 1HG1 ILE 12 2HG1 ILE 12 -8.067 3.265 -6.906
81 2HG1 ILE 12 3HG1 ILE 12 -8.062 1.773 -7.845
82 1HG2 ILE 12 1HG2 ILE 12 -6.205 1.977 -4.554
83 2HG2 ILE 12 2HG2 ILE 12 -4.681 2.491 -5.273
84 3HG2 ILE 12 3HG2 ILE 12 -6.020 3.639 -5.131
85 1HD1 ILE 12 1HD1 ILE 12 -9.612 1.465 -6.074
86 2HD1 ILE 12 2HD1 ILE 12 -8.180 0.483 -5.707
87 3HD1 ILE 12 3HD1 ILE 12 -8.457 2.039 -4.861
88 H ALA 13 H ALA 13 -7.352 3.529 -9.493
89 HA ALA 13 HA ALA 13 -7.281 1.237 -11.191
90 1HB ALA 13 1HB ALA 13 -8.688 2.474 -12.700
91 2HB ALA 13 2HB ALA 13 -9.207 2.805 -11.036
92 3HB ALA 13 3HB ALA 13 -8.275 4.016 -11.943
93 H ALA 14 H ALA 14 -5.701 4.469 -11.478
94 HA ALA 14 HA ALA 14 -4.267 3.871 -13.889
95 1HB ALA 14 1HB ALA 14 -3.409 5.677 -11.588
96 2HB ALA 14 2HB ALA 14 -2.707 5.629 -13.214
97 3HB ALA 14 3HB ALA 14 -4.395 6.151 -12.988
98 H ALA 15 H ALA 15 -3.229 3.580 -10.452
99 HA ALA 15 HA ALA 15 -0.727 2.563 -10.738
100 1HB ALA 15 1HB ALA 15 -2.018 3.148 -8.593
101 2HB ALA 15 2HB ALA 15 -2.630 1.488 -8.637
102 3HB ALA 15 3HB ALA 15 -0.885 1.790 -8.536
103 H LEU 16 H LEU 16 -3.761 0.758 -10.706
104 HA LEU 16 HA LEU 16 -2.812 -1.834 -10.781
105 1HB LEU 16 2HB LEU 16 -5.162 -1.064 -10.397
106 2HB LEU 16 3HB LEU 16 -5.336 -0.735 -12.117
107 HG LEU 16 HG LEU 16 -6.434 -2.771 -11.306
108 1HD1 LEU 16 1HD1 LEU 16 -5.633 -2.561 -13.710
109 2HD1 LEU 16 2HD1 LEU 16 -4.314 -3.671 -13.268
110 3HD1 LEU 16 3HD1 LEU 16 -5.989 -4.190 -13.107
111 1HD2 LEU 16 1HD2 LEU 16 -5.236 -4.750 -10.642
112 2HD2 LEU 16 2HD2 LEU 16 -3.666 -3.967 -10.895
113 3HD2 LEU 16 3HD2 LEU 16 -4.743 -3.400 -9.599
114 H GLN 17 H GLN 17 -3.266 0.523 -13.433
115 HA GLN 17 HA GLN 17 -2.807 -1.539 -15.464
116 1HB GLN 17 2HB GLN 17 -4.270 0.751 -15.549
117 2HB GLN 17 3HB GLN 17 -2.755 1.329 -16.263
118 1HG GLN 17 2HG GLN 17 -2.832 -0.667 -17.829
119 2HG GLN 17 3HG GLN 17 -4.393 -1.106 -17.113
120 1HE2 GLN 17 1HE2 GLN 17 -6.012 -0.614 -18.571
121 2HE2 GLN 17 2HE2 GLN 17 -6.051 0.863 -19.514
122 H GLU 18 H GLU 18 -1.118 1.347 -14.133
123 HA GLU 18 HA GLU 18 1.095 1.167 -15.871
124 1HB GLU 18 2HB GLU 18 2.018 2.921 -14.686
125 2HB GLU 18 3HB GLU 18 0.304 3.102 -14.327
126 1HG GLU 18 2HG GLU 18 0.710 1.878 -12.169
127 2HG GLU 18 3HG GLU 18 2.426 1.868 -12.538
128 H CYS 19 H CYS 19 0.465 -0.480 -12.795
129 HA CYS 19 HA CYS 19 3.024 -2.012 -13.031
130 1HB CYS 19 2HB CYS 19 1.081 -1.700 -10.700
131 2HB CYS 19 3HB CYS 19 2.595 -2.630 -10.697
132 HG CYS 19 HG CYS 19 4.134 -0.657 -11.322
133 H ARG 20 H ARG 20 0.823 -2.573 -14.894
134 HA ARG 20 HA ARG 20 -0.537 -4.926 -13.820
135 1HB ARG 20 2HB ARG 20 -1.555 -3.417 -15.460
136 2HB ARG 20 3HB ARG 20 -0.388 -3.924 -16.692
137 1HG ARG 20 2HG ARG 20 -1.283 -6.151 -16.725
138 2HG ARG 20 3HG ARG 20 -2.118 -5.922 -15.177
139 1HD ARG 20 2HD ARG 20 -3.607 -4.238 -16.171
140 2HD ARG 20 3HD ARG 20 -2.875 -4.466 -17.754
141 HE ARG 20 HE ARG 20 -4.784 -6.163 -16.314
142 1HH1 ARG 20 2HH2 ARG 20 -2.338 -6.189 -18.845
143 2HH1 ARG 20 1HH2 ARG 20 -2.988 -7.549 -19.706
144 1HH2 ARG 20 2HH1 ARG 20 -5.648 -8.026 -17.368
145 2HH2 ARG 20 1HH1 ARG 20 -4.913 -8.640 -18.812
146 H ASP 21 H ASP 21 2.342 -4.189 -15.677
147 HA ASP 21 HA ASP 21 2.910 -6.902 -16.475
148 1HB ASP 21 2HB ASP 21 4.332 -4.222 -16.509
149 2HB ASP 21 3HB ASP 21 5.218 -5.706 -16.875
150 HA PRO 22 HA PRO 22 4.477 -8.408 -12.653
151 1HB PRO 22 2HB PRO 22 6.294 -10.290 -13.409
152 2HB PRO 22 3HB PRO 22 4.537 -10.481 -13.659
153 1HG PRO 22 2HG PRO 22 6.589 -9.477 -15.650
154 2HG PRO 22 3HG PRO 22 5.359 -10.752 -15.907
155 1HD PRO 22 2HD PRO 22 4.932 -8.197 -16.717
156 2HD PRO 22 3HD PRO 22 3.600 -9.138 -15.981
157 H ASP 23 H ASP 23 6.010 -8.000 -11.116
158 HA ASP 23 HA ASP 23 7.608 -6.988 -10.121
159 1HB ASP 23 2HB ASP 23 9.318 -7.662 -12.553
160 2HB ASP 23 3HB ASP 23 9.903 -7.327 -10.924
161 H THR 24 H THR 24 6.125 -5.331 -12.441
162 HA THR 24 HA THR 24 7.984 -3.101 -12.847
163 HB THR 24 HB THR 24 5.112 -3.514 -13.734
164 HG1 THR 24 1HG THR 24 6.070 -4.331 -15.547
165 1HG2 THR 24 1HG2 THR 24 5.879 -2.043 -15.671
166 2HG2 THR 24 2HG2 THR 24 5.631 -1.188 -14.161
167 3HG2 THR 24 3HG2 THR 24 7.286 -1.598 -14.684
168 H PHE 25 H PHE 25 6.708 -3.877 -10.138
169 HA PHE 25 HA PHE 25 5.200 -1.395 -9.481
170 1HB PHE 25 2HB PHE 25 4.267 -3.711 -9.063
171 2HB PHE 25 3HB PHE 25 5.534 -3.914 -7.856
172 HD1 PHE 25 1HD PHE 25 2.167 -3.186 -8.286
173 HD2 PHE 25 2HD PHE 25 5.614 -1.846 -6.051
174 HE1 PHE 25 1HE PHE 25 0.711 -2.570 -6.385
175 HE2 PHE 25 2HE PHE 25 4.132 -1.136 -4.216
176 HZ PHE 25 HZ PHE 25 1.681 -1.576 -4.345
177 H GLU 26 H GLU 26 6.633 0.134 -8.914
178 HA GLU 26 HA GLU 26 8.834 -0.569 -7.040
179 1HB GLU 26 2HB GLU 26 8.467 2.005 -8.618
180 2HB GLU 26 3HB GLU 26 9.774 1.648 -7.505
181 1HG GLU 26 2HG GLU 26 10.804 1.112 -9.471
182 2HG GLU 26 3HG GLU 26 10.105 -0.478 -9.125
183 HA PRO 27 HA PRO 27 6.346 0.943 -3.787
184 1HB PRO 27 2HB PRO 27 8.216 2.167 -2.116
185 2HB PRO 27 3HB PRO 27 7.928 0.416 -2.243
186 1HG PRO 27 2HG PRO 27 10.132 2.002 -3.536
187 2HG PRO 27 3HG PRO 27 10.188 0.356 -2.838
188 1HD PRO 27 2HD PRO 27 10.046 0.748 -5.488
189 2HD PRO 27 3HD PRO 27 9.242 -0.623 -4.682
190 H GLN 28 H GLN 28 8.877 3.448 -4.342
191 HA GLN 28 HA GLN 28 7.297 5.584 -3.496
192 1HB GLN 28 2HB GLN 28 9.723 5.516 -5.309
193 2HB GLN 28 3HB GLN 28 8.998 7.013 -4.690
194 1HG GLN 28 2HG GLN 28 9.333 6.298 -2.374
195 2HG GLN 28 3HG GLN 28 9.950 4.729 -2.897
196 1HE2 GLN 28 1HE2 GLN 28 10.674 8.244 -2.873
197 2HE2 GLN 28 2HE2 GLN 28 12.398 8.017 -3.094
198 H LYS 29 H LYS 29 7.757 4.269 -6.737
199 HA LYS 29 HA LYS 29 6.196 5.996 -8.330
200 1HB LYS 29 2HB LYS 29 7.657 4.123 -9.076
201 2HB LYS 29 3HB LYS 29 6.506 2.979 -8.400
202 1HG LYS 29 2HG LYS 29 5.042 4.587 -10.276
203 2HG LYS 29 3HG LYS 29 6.613 4.243 -10.999
204 1HD LYS 29 2HD LYS 29 5.878 1.720 -10.012
205 2HD LYS 29 3HD LYS 29 4.325 2.464 -10.379
206 1HE LYS 29 2HE LYS 29 4.680 1.559 -12.429
207 2HE LYS 29 3HE LYS 29 5.618 3.020 -12.703
208 1HZ LYS 29 1HZ LYS 29 6.711 0.341 -11.883
209 2HZ LYS 29 2HZ LYS 29 6.863 1.071 -13.336
210 3HZ LYS 29 3HZ LYS 29 7.598 1.688 -12.007
211 H PHE 30 H PHE 30 5.104 2.848 -6.904
212 HA PHE 30 HA PHE 30 2.395 3.181 -7.450
213 1HB PHE 30 2HB PHE 30 3.456 1.060 -6.817
214 2HB PHE 30 3HB PHE 30 3.734 1.655 -5.184
215 HD1 PHE 30 1HD PHE 30 1.173 0.554 -7.628
216 HD2 PHE 30 2HD PHE 30 1.897 1.779 -3.553
217 HE1 PHE 30 1HE PHE 30 -1.150 -0.073 -7.017
218 HE2 PHE 30 2HE PHE 30 -0.443 1.213 -2.973
219 HZ PHE 30 HZ PHE 30 -1.994 0.398 -4.745
220 H PHE 31 H PHE 31 4.183 4.120 -4.587
221 HA PHE 31 HA PHE 31 2.207 4.936 -2.774
222 1HB PHE 31 2HB PHE 31 4.397 4.796 -1.944
223 2HB PHE 31 3HB PHE 31 5.078 5.570 -3.360
224 HD1 PHE 31 1HD PHE 31 6.331 7.461 -2.759
225 HD2 PHE 31 2HD PHE 31 2.472 6.746 -0.984
226 HE1 PHE 31 1HE PHE 31 6.499 9.600 -1.515
227 HE2 PHE 31 2HE PHE 31 2.479 9.049 -0.114
228 HZ PHE 31 HZ PHE 31 4.580 10.389 -0.159
229 H GLN 32 H GLN 32 4.009 6.919 -5.200
230 HA GLN 32 HA GLN 32 2.519 9.294 -4.593
231 1HB GLN 32 2HB GLN 32 4.786 9.325 -5.561
232 2HB GLN 32 3HB GLN 32 4.204 8.525 -7.020
233 1HG GLN 32 2HG GLN 32 2.552 10.884 -6.557
234 2HG GLN 32 3HG GLN 32 4.239 11.340 -6.355
235 1HE2 GLN 32 1HE2 GLN 32 2.403 9.145 -8.638
236 2HE2 GLN 32 2HE2 GLN 32 3.120 9.855 -10.061
237 H THR 33 H THR 33 2.377 6.764 -7.196
238 HA THR 33 HA THR 33 0.475 8.072 -8.697
239 HB THR 33 HB THR 33 2.151 5.833 -8.936
240 HG1 THR 33 1HG THR 33 0.439 5.846 -10.711
241 1HG2 THR 33 1HG2 THR 33 0.324 4.324 -7.892
242 2HG2 THR 33 2HG2 THR 33 -0.658 4.784 -9.302
243 3HG2 THR 33 3HG2 THR 33 0.885 3.933 -9.501
244 H SER 34 H SER 34 0.086 5.782 -6.028
245 HA SER 34 HA SER 34 -2.754 5.513 -6.433
246 1HB SER 34 2HB SER 34 -1.009 4.803 -4.055
247 2HB SER 34 3HB SER 34 -2.709 4.323 -4.294
248 HG SER 34 HG SER 34 -0.391 3.621 -5.757
249 H GLY 35 H GLY 35 -0.932 8.137 -5.525
250 1HA GLY 35 1HA GLY 35 -1.787 10.247 -5.078
251 2HA GLY 35 2HA GLY 35 -3.385 9.548 -4.759
252 H LEU 36 H LEU 36 -0.886 7.948 -3.058
253 HA LEU 36 HA LEU 36 -2.143 8.726 -0.574
254 1HB LEU 36 2HB LEU 36 0.340 7.071 -1.040
255 2HB LEU 36 3HB LEU 36 -0.726 7.109 0.372
256 HG LEU 36 HG LEU 36 -1.468 6.046 -2.350
257 1HD1 LEU 36 1HD1 LEU 36 -0.960 4.622 0.295
258 2HD1 LEU 36 2HD1 LEU 36 -1.461 3.853 -1.226
259 3HD1 LEU 36 3HD1 LEU 36 0.132 4.623 -1.106
260 1HD2 LEU 36 1HD2 LEU 36 -3.067 6.087 0.237
261 2HD2 LEU 36 2HD2 LEU 36 -3.461 6.966 -1.263
262 3HD2 LEU 36 3HD2 LEU 36 -3.515 5.202 -1.236
263 H SER 37 H SER 37 0.651 9.811 -2.421
264 HA SER 37 HA SER 37 1.950 11.344 -0.323
265 1HB SER 37 2HB SER 37 2.862 12.547 -2.350
266 2HB SER 37 3HB SER 37 3.111 10.796 -2.411
267 HG SER 37 HG SER 37 2.261 11.542 -4.379
268 H LYS 38 H LYS 38 -1.034 11.670 -2.131
269 HA LYS 38 HA LYS 38 -1.120 14.616 -1.848
270 1HB LYS 38 2HB LYS 38 -2.191 12.696 -3.758
271 2HB LYS 38 3HB LYS 38 -3.535 13.463 -2.917
272 1HG LYS 38 2HG LYS 38 -3.061 14.725 -4.870
273 2HG LYS 38 3HG LYS 38 -2.567 15.702 -3.477
274 1HD LYS 38 2HD LYS 38 -0.191 15.033 -3.859
275 2HD LYS 38 3HD LYS 38 -0.703 13.978 -5.189
276 1HE LYS 38 2HE LYS 38 -1.564 15.945 -6.439
277 2HE LYS 38 3HE LYS 38 -1.111 17.013 -5.099
278 1HZ LYS 38 1HZ LYS 38 1.181 16.425 -5.483
279 2HZ LYS 38 2HZ LYS 38 0.764 15.417 -6.718
280 3HZ LYS 38 3HZ LYS 38 0.511 17.035 -6.853
281 H MET 39 H MET 39 -2.499 11.549 -0.668
282 HA MET 39 HA MET 39 -4.707 12.494 0.665
283 1HB MET 39 2HB MET 39 -2.734 10.309 1.332
284 2HB MET 39 3HB MET 39 -4.045 10.694 2.440
285 1HG MET 39 2HG MET 39 -5.704 10.426 0.658
286 2HG MET 39 3HG MET 39 -4.422 9.956 -0.468
287 1HE MET 39 1HE MET 39 -7.185 8.329 0.369
288 2HE MET 39 2HE MET 39 -6.044 8.027 -0.959
289 3HE MET 39 3HE MET 39 -6.478 6.708 0.159
290 H SER 40 H SER 40 -1.671 12.177 2.545
291 HA SER 40 HA SER 40 -0.778 13.988 3.904
292 1HB SER 40 2HB SER 40 -2.733 15.528 3.852
293 2HB SER 40 3HB SER 40 -3.679 14.351 4.797
294 HG SER 40 HG SER 40 -1.444 15.831 5.650
295 H ALA 41 H ALA 41 0.041 13.279 5.876
296 HA ALA 41 HA ALA 41 -0.036 10.757 6.869
297 1HB ALA 41 1HB ALA 41 0.169 13.371 8.406
298 2HB ALA 41 2HB ALA 41 0.538 11.776 9.085
299 3HB ALA 41 3HB ALA 41 1.487 12.391 7.725
300 H ASN 42 H ASN 42 -2.413 13.285 7.520
301 HA ASN 42 HA ASN 42 -3.765 12.098 9.755
302 1HB ASN 42 2HB ASN 42 -4.948 13.891 7.569
303 2HB ASN 42 3HB ASN 42 -5.646 13.551 9.152
304 1HD2 ASN 42 1HD2 ASN 42 -3.395 15.545 7.349
305 2HD2 ASN 42 2HD2 ASN 42 -2.953 16.522 8.738
306 H GLN 43 H GLN 43 -4.606 12.145 6.254
307 HA GLN 43 HA GLN 43 -6.803 10.308 6.609
308 1HB GLN 43 2HB GLN 43 -6.952 12.061 4.992
309 2HB GLN 43 3HB GLN 43 -5.480 11.525 4.152
310 1HG GLN 43 2HG GLN 43 -6.488 9.563 3.374
311 2HG GLN 43 3HG GLN 43 -7.769 9.607 4.599
312 1HE2 GLN 43 1HE2 GLN 43 -9.761 10.277 3.927
313 2HE2 GLN 43 2HE2 GLN 43 -10.036 11.267 2.507
314 H VAL 44 H VAL 44 -3.325 10.081 5.638
315 HA VAL 44 HA VAL 44 -3.442 7.472 4.549
316 HB VAL 44 HB VAL 44 -1.353 9.228 5.910
317 1HG1 VAL 44 1HG1 VAL 44 0.383 7.830 4.933
318 2HG1 VAL 44 2HG1 VAL 44 -0.548 6.987 6.180
319 3HG1 VAL 44 3HG1 VAL 44 -0.858 6.646 4.442
320 1HG2 VAL 44 1HG2 VAL 44 -0.562 9.695 3.690
321 2HG2 VAL 44 2HG2 VAL 44 -1.611 8.442 2.976
322 3HG2 VAL 44 3HG2 VAL 44 -2.309 9.916 3.641
323 H LYS 45 H LYS 45 -2.777 8.656 7.924
324 HA LYS 45 HA LYS 45 -2.613 6.077 9.105
325 1HB LYS 45 2HB LYS 45 -2.025 8.234 10.233
326 2HB LYS 45 3HB LYS 45 -3.739 8.677 10.262
327 1HG LYS 45 2HG LYS 45 -4.201 6.651 11.682
328 2HG LYS 45 3HG LYS 45 -2.461 6.299 11.682
329 1HD LYS 45 2HD LYS 45 -2.044 8.543 12.708
330 2HD LYS 45 3HD LYS 45 -3.794 8.855 12.702
331 1HE LYS 45 2HE LYS 45 -4.146 6.873 14.189
332 2HE LYS 45 3HE LYS 45 -2.399 6.575 14.202
333 1HZ LYS 45 1HZ LYS 45 -3.103 7.758 16.148
334 2HZ LYS 45 2HZ LYS 45 -2.108 8.714 15.260
335 3HZ LYS 45 3HZ LYS 45 -3.732 8.985 15.255
336 H ASP 46 H ASP 46 -5.512 8.159 8.484
337 HA ASP 46 HA ASP 46 -7.355 6.402 9.680
338 1HB ASP 46 2HB ASP 46 -7.900 8.709 8.938
339 2HB ASP 46 3HB ASP 46 -7.857 8.168 7.252
340 H VAL 47 H VAL 47 -6.407 6.535 6.185
341 HA VAL 47 HA VAL 47 -7.912 4.325 5.410
342 HB VAL 47 HB VAL 47 -6.788 4.125 3.464
343 1HG1 VAL 47 1HG1 VAL 47 -6.959 6.177 2.476
344 2HG1 VAL 47 2HG1 VAL 47 -7.849 6.460 3.986
345 3HG1 VAL 47 3HG1 VAL 47 -6.171 7.025 3.795
346 1HG2 VAL 47 1HG2 VAL 47 -4.517 3.732 4.011
347 2HG2 VAL 47 2HG2 VAL 47 -4.681 4.936 2.733
348 3HG2 VAL 47 3HG2 VAL 47 -4.281 5.456 4.364
349 H PHE 48 H PHE 48 -4.564 4.343 6.761
350 HA PHE 48 HA PHE 48 -4.058 1.605 6.567
351 1HB PHE 48 2HB PHE 48 -3.378 3.350 8.932
352 2HB PHE 48 3HB PHE 48 -2.671 1.788 8.542
353 HD1 PHE 48 1HD PHE 48 -2.737 2.855 5.327
354 HD2 PHE 48 2HD PHE 48 -0.962 4.036 9.086
355 HE1 PHE 48 1HE PHE 48 -0.876 3.910 4.121
356 HE2 PHE 48 2HE PHE 48 0.907 5.059 7.864
357 HZ PHE 48 HZ PHE 48 1.015 4.918 5.373
358 H ARG 49 H ARG 49 -6.268 3.193 8.920
359 HA ARG 49 HA ARG 49 -6.526 0.863 10.571
360 1HB ARG 49 2HB ARG 49 -8.677 2.965 10.045
361 2HB ARG 49 3HB ARG 49 -8.556 1.872 11.428
362 1HG ARG 49 2HG ARG 49 -6.342 3.038 12.016
363 2HG ARG 49 3HG ARG 49 -6.716 4.191 10.727
364 1HD ARG 49 2HD ARG 49 -7.473 5.205 12.724
365 2HD ARG 49 3HD ARG 49 -8.902 4.683 11.807
366 HE ARG 49 HE ARG 49 -8.001 2.652 13.672
367 1HH1 ARG 49 2HH2 ARG 49 -9.829 5.651 13.489
368 2HH1 ARG 49 1HH2 ARG 49 -10.689 5.425 14.982
369 1HH2 ARG 49 2HH1 ARG 49 -9.110 2.296 15.669
370 2HH2 ARG 49 1HH1 ARG 49 -10.263 3.449 16.252
371 H PHE 50 H PHE 50 -7.881 1.686 7.449
372 HA PHE 50 HA PHE 50 -10.038 -0.245 7.526
373 1HB PHE 50 2HB PHE 50 -9.844 1.891 6.109
374 2HB PHE 50 3HB PHE 50 -8.752 0.991 5.072
375 HD1 PHE 50 1HD PHE 50 -9.706 -0.201 3.236
376 HD2 PHE 50 2HD PHE 50 -12.191 0.891 6.584
377 HE1 PHE 50 1HE PHE 50 -11.675 -1.197 2.101
378 HE2 PHE 50 2HE PHE 50 -14.155 -0.094 5.450
379 HZ PHE 50 HZ PHE 50 -13.864 -1.292 3.281
380 H ILE 51 H ILE 51 -6.561 -0.419 6.950
381 HA ILE 51 HA ILE 51 -6.860 -3.213 5.968
382 HB ILE 51 HB ILE 51 -4.721 -1.313 5.013
383 1HG1 ILE 51 2HG1 ILE 51 -6.116 -1.973 2.748
384 2HG1 ILE 51 3HG1 ILE 51 -7.438 -1.955 3.915
385 1HG2 ILE 51 1HG2 ILE 51 -4.431 -3.217 3.384
386 2HG2 ILE 51 2HG2 ILE 51 -4.049 -3.689 5.043
387 3HG2 ILE 51 3HG2 ILE 51 -5.589 -4.171 4.300
388 1HD1 ILE 51 1HD1 ILE 51 -7.321 0.228 3.047
389 2HD1 ILE 51 2HD1 ILE 51 -6.493 0.358 4.602
390 3HD1 ILE 51 3HD1 ILE 51 -5.539 0.273 3.114
391 H ASP 52 H ASP 52 -6.501 -4.196 7.806
392 HA ASP 52 HA ASP 52 -3.729 -4.636 8.477
393 1HB ASP 52 2HB ASP 52 -4.296 -2.809 10.070
394 2HB ASP 52 3HB ASP 52 -5.645 -3.755 10.693
395 H ASN 53 H ASN 53 -7.058 -5.053 9.525
396 HA ASN 53 HA ASN 53 -8.512 -6.828 9.121
397 1HB ASN 53 2HB ASN 53 -6.871 -8.180 7.752
398 2HB ASN 53 3HB ASN 53 -6.212 -8.815 9.273
399 1HD2 ASN 53 1HD2 ASN 53 -9.051 -8.807 7.124
400 2HD2 ASN 53 2HD2 ASN 53 -9.849 -10.130 7.953
401 H ASP 54 H ASP 54 -5.665 -7.460 11.213
402 HA ASP 54 HA ASP 54 -7.029 -8.200 13.577
403 1HB ASP 54 2HB ASP 54 -4.585 -6.380 13.419
404 2HB ASP 54 3HB ASP 54 -5.085 -7.398 14.778
405 H GLN 55 H GLN 55 -6.154 -5.104 12.259
406 HA GLN 55 HA GLN 55 -6.283 -2.971 12.888
407 1HB GLN 55 2HB GLN 55 -8.719 -3.660 14.587
408 2HB GLN 55 3HB GLN 55 -8.060 -2.050 14.280
409 1HG GLN 55 2HG GLN 55 -8.292 -2.613 11.760
410 2HG GLN 55 3HG GLN 55 -9.328 -3.952 12.283
411 1HE2 GLN 55 1HE2 GLN 55 -9.578 -0.970 10.986
412 2HE2 GLN 55 2HE2 GLN 55 -11.031 -0.415 11.808
413 H SER 56 H SER 56 -4.301 -3.956 13.612
414 HA SER 56 HA SER 56 -3.849 -3.965 16.555
415 1HB SER 56 2HB SER 56 -1.811 -5.186 16.037
416 2HB SER 56 3HB SER 56 -3.197 -6.026 15.342
417 HG SER 56 HG SER 56 -2.591 -4.781 13.327
418 H GLY 57 H GLY 57 -2.720 -2.702 13.408
419 1HA GLY 57 1HA GLY 57 -1.775 -0.436 13.217
420 2HA GLY 57 2HA GLY 57 -0.997 -0.651 14.789
421 H TYR 58 H TYR 58 -0.729 -3.676 13.611
422 HA TYR 58 HA TYR 58 1.901 -3.229 12.252
423 1HB TYR 58 2HB TYR 58 0.753 -5.606 13.739
424 2HB TYR 58 3HB TYR 58 2.254 -5.608 12.824
425 HD1 TYR 58 HD1 TYR 58 0.762 -4.846 16.029
426 HD2 TYR 58 HD2 TYR 58 4.098 -3.927 13.456
427 HE1 TYR 58 HE1 TYR 58 2.019 -3.946 17.971
428 HE2 TYR 58 HE2 TYR 58 5.340 -3.013 15.389
429 HH TYR 58 HH TYR 58 5.306 -2.581 17.654
430 H LEU 59 H LEU 59 1.827 -3.268 10.193
431 HA LEU 59 HA LEU 59 -0.073 -4.943 8.651
432 1HB LEU 59 2HB LEU 59 1.728 -2.594 8.052
433 2HB LEU 59 3HB LEU 59 1.374 -3.744 6.768
434 HG LEU 59 HG LEU 59 -0.119 -1.742 6.852
435 1HD1 LEU 59 1HD1 LEU 59 -0.688 -3.859 5.670
436 2HD1 LEU 59 2HD1 LEU 59 -1.568 -4.416 7.107
437 3HD1 LEU 59 3HD1 LEU 59 -2.100 -2.967 6.239
438 1HD2 LEU 59 1HD2 LEU 59 -1.910 -1.573 8.454
439 2HD2 LEU 59 2HD2 LEU 59 -1.448 -3.084 9.249
440 3HD2 LEU 59 3HD2 LEU 59 -0.391 -1.655 9.356
441 H ASP 60 H ASP 60 0.772 -6.773 9.604
442 HA ASP 60 HA ASP 60 3.473 -7.670 9.325
443 1HB ASP 60 2HB ASP 60 0.977 -9.403 9.376
444 2HB ASP 60 3HB ASP 60 2.614 -9.813 9.924
445 H GLU 61 H GLU 61 4.467 -8.885 7.621
446 HA GLU 61 HA GLU 61 4.226 -8.102 5.169
447 1HB GLU 61 2HB GLU 61 5.745 -10.072 6.432
448 2HB GLU 61 3HB GLU 61 4.867 -11.015 5.225
449 1HG GLU 61 2HG GLU 61 5.573 -9.079 3.617
450 2HG GLU 61 3HG GLU 61 6.788 -8.713 4.850
451 H GLU 62 H GLU 62 2.477 -11.073 6.205
452 HA GLU 62 HA GLU 62 1.475 -11.493 3.544
453 1HB GLU 62 2HB GLU 62 1.888 -13.243 5.425
454 2HB GLU 62 3HB GLU 62 0.321 -12.749 6.095
455 1HG GLU 62 2HG GLU 62 -0.772 -13.358 3.968
456 2HG GLU 62 3HG GLU 62 0.828 -13.657 3.250
457 H GLU 63 H GLU 63 0.310 -9.432 6.128
458 HA GLU 63 HA GLU 63 -2.409 -9.223 5.053
459 1HB GLU 63 2HB GLU 63 -0.754 -7.357 6.788
460 2HB GLU 63 3HB GLU 63 -2.463 -7.141 6.409
461 1HG GLU 63 2HG GLU 63 -3.121 -9.123 7.549
462 2HG GLU 63 3HG GLU 63 -1.468 -9.742 7.670
463 H LEU 64 H LEU 64 0.793 -7.731 4.598
464 HA LEU 64 HA LEU 64 0.080 -5.724 2.788
465 1HB LEU 64 2HB LEU 64 2.461 -6.622 3.813
466 2HB LEU 64 3HB LEU 64 2.593 -7.142 2.134
467 HG LEU 64 HG LEU 64 3.617 -5.036 2.319
468 1HD1 LEU 64 1HD1 LEU 64 2.093 -5.278 0.318
469 2HD1 LEU 64 2HD1 LEU 64 0.880 -4.320 1.184
470 3HD1 LEU 64 3HD1 LEU 64 2.455 -3.618 0.803
471 1HD2 LEU 64 1HD2 LEU 64 1.132 -3.921 3.688
472 2HD2 LEU 64 2HD2 LEU 64 2.664 -4.343 4.480
473 3HD2 LEU 64 3HD2 LEU 64 2.613 -3.035 3.287
474 H LYS 65 H LYS 65 0.852 -9.165 2.222
475 HA LYS 65 HA LYS 65 0.427 -9.335 -0.532
476 1HB LYS 65 2HB LYS 65 1.336 -11.078 1.055
477 2HB LYS 65 3HB LYS 65 -0.347 -11.492 1.426
478 1HG LYS 65 2HG LYS 65 -0.737 -12.131 -0.937
479 2HG LYS 65 3HG LYS 65 0.891 -11.577 -1.344
480 1HD LYS 65 2HD LYS 65 1.029 -13.940 -1.173
481 2HD LYS 65 3HD LYS 65 1.806 -13.277 0.273
482 1HE LYS 65 2HE LYS 65 -0.516 -13.650 1.440
483 2HE LYS 65 3HE LYS 65 -0.951 -14.601 0.030
484 1HZ LYS 65 1HZ LYS 65 0.781 -16.141 0.578
485 2HZ LYS 65 2HZ LYS 65 1.420 -15.124 1.710
486 3HZ LYS 65 3HZ LYS 65 0.009 -15.803 2.007
487 H PHE 66 H PHE 66 -2.086 -8.585 1.769
488 HA PHE 66 HA PHE 66 -4.095 -9.009 -0.420
489 1HB PHE 66 2HB PHE 66 -4.563 -9.271 2.557
490 2HB PHE 66 3HB PHE 66 -5.781 -9.410 1.296
491 HD1 PHE 66 1HD PHE 66 -5.437 -11.276 -0.522
492 HD2 PHE 66 2HD PHE 66 -3.401 -11.231 3.281
493 HE1 PHE 66 1HE PHE 66 -5.041 -13.709 -0.703
494 HE2 PHE 66 2HE PHE 66 -2.995 -13.663 3.088
495 HZ PHE 66 HZ PHE 66 -3.824 -14.915 1.104
496 H PHE 67 H PHE 67 -2.309 -6.672 0.827
497 HA PHE 67 HA PHE 67 -3.818 -4.920 2.225
498 1HB PHE 67 2HB PHE 67 -1.492 -4.626 1.923
499 2HB PHE 67 3HB PHE 67 -1.616 -4.442 0.189
500 HD1 PHE 67 1HD PHE 67 -1.577 -2.276 -0.726
501 HD2 PHE 67 2HD PHE 67 -2.214 -2.781 3.479
502 HE1 PHE 67 1HE PHE 67 -1.787 0.183 -0.467
503 HE2 PHE 67 2HE PHE 67 -2.556 -0.342 3.738
504 HZ PHE 67 HZ PHE 67 -2.361 1.155 1.749
505 H LEU 68 H LEU 68 -3.335 -4.515 -1.287
506 HA LEU 68 HA LEU 68 -5.334 -2.556 -1.616
507 1HB LEU 68 2HB LEU 68 -4.217 -4.498 -3.653
508 2HB LEU 68 3HB LEU 68 -5.031 -2.953 -4.017
509 HG LEU 68 HG LEU 68 -2.360 -3.295 -2.611
510 1HD1 LEU 68 1HD1 LEU 68 -2.278 -3.899 -5.007
511 2HD1 LEU 68 2HD1 LEU 68 -2.994 -2.328 -5.427
512 3HD1 LEU 68 3HD1 LEU 68 -1.386 -2.410 -4.672
513 1HD2 LEU 68 1HD2 LEU 68 -3.685 -0.759 -3.627
514 2HD2 LEU 68 2HD2 LEU 68 -3.596 -1.232 -1.913
515 3HD2 LEU 68 3HD2 LEU 68 -2.113 -0.900 -2.806
516 H GLN 69 H GLN 69 -5.957 -5.918 -1.040
517 HA GLN 69 HA GLN 69 -8.152 -6.263 -2.895
518 1HB GLN 69 2HB GLN 69 -7.765 -7.580 -0.200
519 2HB GLN 69 3HB GLN 69 -8.819 -8.124 -1.506
520 1HG GLN 69 2HG GLN 69 -5.780 -7.952 -1.735
521 2HG GLN 69 3HG GLN 69 -6.696 -9.400 -1.295
522 1HE2 GLN 69 1HE2 GLN 69 -6.120 -7.045 -3.894
523 2HE2 GLN 69 2HE2 GLN 69 -6.424 -8.201 -5.184
524 H LYS 70 H LYS 70 -7.800 -4.672 0.247
525 HA LYS 70 HA LYS 70 -10.603 -4.320 0.804
526 1HB LYS 70 2HB LYS 70 -8.018 -3.184 1.765
527 2HB LYS 70 3HB LYS 70 -9.339 -2.032 1.756
528 1HG LYS 70 2HG LYS 70 -9.399 -2.986 3.872
529 2HG LYS 70 3HG LYS 70 -10.771 -3.670 3.014
530 1HD LYS 70 2HD LYS 70 -9.486 -5.739 2.545
531 2HD LYS 70 3HD LYS 70 -8.059 -5.073 3.342
532 1HE LYS 70 2HE LYS 70 -10.777 -5.557 4.682
533 2HE LYS 70 3HE LYS 70 -9.397 -6.662 4.773
534 1HZ LYS 70 1HZ LYS 70 -9.562 -5.224 6.700
535 2HZ LYS 70 2HZ LYS 70 -8.154 -4.983 5.886
536 3HZ LYS 70 3HZ LYS 70 -9.355 -3.873 5.797
537 H PHE 71 H PHE 71 -8.432 -2.787 -1.502
538 HA PHE 71 HA PHE 71 -10.266 -0.515 -1.958
539 1HB PHE 71 2HB PHE 71 -7.745 -1.259 -3.469
540 2HB PHE 71 3HB PHE 71 -8.628 0.261 -3.464
541 HD1 PHE 71 1HD PHE 71 -8.854 0.173 -0.212
542 HD2 PHE 71 2HD PHE 71 -5.728 0.074 -3.170
543 HE1 PHE 71 1HE PHE 71 -7.377 1.490 1.276
544 HE2 PHE 71 2HE PHE 71 -4.206 1.252 -1.603
545 HZ PHE 71 HZ PHE 71 -5.029 1.940 0.639
546 H GLU 72 H GLU 72 -8.847 -3.307 -3.746
547 HA GLU 72 HA GLU 72 -11.237 -3.427 -5.465
548 1HB GLU 72 2HB GLU 72 -9.207 -1.930 -6.377
549 2HB GLU 72 3HB GLU 72 -8.554 -3.506 -6.843
550 1HG GLU 72 2HG GLU 72 -11.334 -2.480 -7.605
551 2HG GLU 72 3HG GLU 72 -9.889 -2.302 -8.604
552 H SER 73 H SER 73 -11.761 -5.440 -5.801
553 HA SER 73 HA SER 73 -10.789 -7.717 -4.405
554 1HB SER 73 2HB SER 73 -12.341 -8.906 -5.934
555 2HB SER 73 3HB SER 73 -13.088 -7.468 -5.220
556 HG SER 73 HG SER 73 -12.197 -6.483 -7.400
557 H GLY 74 H GLY 74 -10.104 -6.343 -7.533
558 1HA GLY 74 1HA GLY 74 -8.445 -8.669 -8.424
559 2HA GLY 74 2HA GLY 74 -9.206 -7.443 -9.447
560 H ALA 75 H ALA 75 -7.553 -6.399 -6.508
561 HA ALA 75 HA ALA 75 -5.610 -4.911 -8.025
562 1HB ALA 75 1HB ALA 75 -6.540 -4.245 -5.801
563 2HB ALA 75 2HB ALA 75 -5.567 -5.539 -5.073
564 3HB ALA 75 3HB ALA 75 -4.779 -4.182 -5.927
565 H ARG 76 H ARG 76 -3.203 -5.271 -6.563
566 HA ARG 76 HA ARG 76 -2.331 -7.562 -8.185
567 1HB ARG 76 2HB ARG 76 -1.871 -5.255 -8.933
568 2HB ARG 76 3HB ARG 76 -0.915 -4.962 -7.471
569 1HG ARG 76 2HG ARG 76 0.403 -5.494 -9.538
570 2HG ARG 76 3HG ARG 76 0.774 -6.540 -8.165
571 1HD ARG 76 2HD ARG 76 -0.546 -8.377 -9.127
572 2HD ARG 76 3HD ARG 76 -1.268 -7.288 -10.315
573 HE ARG 76 HE ARG 76 1.636 -8.100 -10.112
574 1HH1 ARG 76 2HH2 ARG 76 -1.127 -7.354 -12.250
575 2HH1 ARG 76 1HH2 ARG 76 -0.119 -7.532 -13.672
576 1HH2 ARG 76 2HH1 ARG 76 2.725 -8.435 -11.831
577 2HH2 ARG 76 1HH1 ARG 76 2.100 -8.234 -13.489
578 H GLU 77 H GLU 77 -2.323 -6.806 -4.867
579 HA GLU 77 HA GLU 77 0.253 -7.552 -4.064
580 1HB GLU 77 2HB GLU 77 -2.400 -7.989 -2.644
581 2HB GLU 77 3HB GLU 77 -0.803 -7.983 -1.894
582 1HG GLU 77 2HG GLU 77 -1.897 -5.537 -3.325
583 2HG GLU 77 3HG GLU 77 -2.139 -5.923 -1.621
584 H LEU 78 H LEU 78 -1.886 -9.606 -5.638
585 HA LEU 78 HA LEU 78 -1.395 -12.112 -4.382
586 1HB LEU 78 2HB LEU 78 -1.801 -11.605 -7.356
587 2HB LEU 78 3HB LEU 78 -2.028 -13.102 -6.462
588 HG LEU 78 HG LEU 78 -4.170 -12.444 -6.793
589 1HD1 LEU 78 1HD1 LEU 78 -3.651 -11.074 -4.118
590 2HD1 LEU 78 2HD1 LEU 78 -5.186 -11.719 -4.713
591 3HD1 LEU 78 3HD1 LEU 78 -3.844 -12.825 -4.360
592 1HD2 LEU 78 1HD2 LEU 78 -5.118 -10.296 -6.843
593 2HD2 LEU 78 2HD2 LEU 78 -3.720 -9.531 -6.096
594 3HD2 LEU 78 3HD2 LEU 78 -3.600 -10.190 -7.745
595 H THR 79 H THR 79 0.555 -10.121 -6.734
596 HA THR 79 HA THR 79 2.443 -12.349 -7.008
597 HB THR 79 HB THR 79 3.140 -9.504 -7.670
598 HG1 THR 79 1HG THR 79 2.547 -9.886 -9.681
599 1HG2 THR 79 1HG2 THR 79 4.548 -10.721 -9.397
600 2HG2 THR 79 2HG2 THR 79 4.985 -11.113 -7.738
601 3HG2 THR 79 3HG2 THR 79 4.017 -12.250 -8.694
602 H GLU 80 H GLU 80 4.126 -12.723 -5.768
603 HA GLU 80 HA GLU 80 4.457 -11.293 -3.280
604 1HB GLU 80 2HB GLU 80 6.340 -12.756 -2.832
605 2HB GLU 80 3HB GLU 80 4.846 -13.602 -3.233
606 1HG GLU 80 2HG GLU 80 5.713 -14.057 -5.535
607 2HG GLU 80 3HG GLU 80 7.226 -13.226 -5.109
608 H SER 81 H SER 81 6.462 -11.379 -6.316
609 HA SER 81 HA SER 81 8.359 -9.492 -5.622
610 1HB SER 81 2HB SER 81 6.910 -9.743 -8.297
611 2HB SER 81 3HB SER 81 8.354 -8.782 -7.990
612 HG SER 81 HG SER 81 9.030 -10.640 -8.743
613 H GLU 82 H GLU 82 5.280 -8.526 -7.337
614 HA GLU 82 HA GLU 82 5.618 -5.869 -6.937
615 1HB GLU 82 2HB GLU 82 2.973 -7.385 -7.103
616 2HB GLU 82 3HB GLU 82 3.137 -5.640 -7.129
617 1HG GLU 82 2HG GLU 82 2.988 -6.136 -9.396
618 2HG GLU 82 3HG GLU 82 4.714 -5.885 -9.138
619 H THR 83 H THR 83 4.073 -8.114 -4.551
620 HA THR 83 HA THR 83 3.406 -6.086 -2.719
621 HB THR 83 HB THR 83 4.182 -9.020 -2.362
622 HG1 THR 83 1HG THR 83 1.809 -7.544 -1.939
623 1HG2 THR 83 1HG2 THR 83 4.876 -8.061 -0.231
624 2HG2 THR 83 2HG2 THR 83 3.399 -7.074 -0.163
625 3HG2 THR 83 3HG2 THR 83 3.305 -8.839 -0.015
626 H LYS 84 H LYS 84 6.334 -8.030 -3.115
627 HA LYS 84 HA LYS 84 7.722 -7.232 -0.841
628 1HB LYS 84 2HB LYS 84 8.147 -9.258 -2.112
629 2HB LYS 84 3HB LYS 84 8.776 -8.321 -3.473
630 1HG LYS 84 2HG LYS 84 10.799 -8.302 -2.569
631 2HG LYS 84 3HG LYS 84 10.197 -7.512 -1.097
632 1HD LYS 84 2HD LYS 84 9.535 -9.665 -0.143
633 2HD LYS 84 3HD LYS 84 10.076 -10.513 -1.612
634 1HE LYS 84 2HE LYS 84 12.395 -9.816 -1.223
635 2HE LYS 84 3HE LYS 84 11.909 -8.822 0.162
636 1HZ LYS 84 1HZ LYS 84 12.799 -10.938 0.846
637 2HZ LYS 84 2HZ LYS 84 11.221 -10.811 1.296
638 3HZ LYS 84 3HZ LYS 84 11.636 -11.751 0.011
639 H SER 85 H SER 85 7.801 -5.866 -4.184
640 HA SER 85 HA SER 85 9.730 -3.885 -3.839
641 1HB SER 85 2HB SER 85 7.034 -3.705 -5.252
642 2HB SER 85 3HB SER 85 8.405 -2.600 -5.460
643 HG SER 85 HG SER 85 8.476 -4.121 -7.047
644 H LEU 86 H LEU 86 6.277 -3.826 -2.770
645 HA LEU 86 HA LEU 86 6.456 -1.102 -1.770
646 1HB LEU 86 2HB LEU 86 4.362 -2.707 -2.417
647 2HB LEU 86 3HB LEU 86 4.399 -3.003 -0.686
648 HG LEU 86 HG LEU 86 4.190 -0.285 -2.074
649 1HD1 LEU 86 1HD1 LEU 86 2.133 -1.693 -0.329
650 2HD1 LEU 86 2HD1 LEU 86 1.919 -0.231 -1.305
651 3HD1 LEU 86 3HD1 LEU 86 2.143 -1.804 -2.095
652 1HD2 LEU 86 1HD2 LEU 86 3.694 0.543 0.279
653 2HD2 LEU 86 2HD2 LEU 86 4.313 -1.023 0.859
654 3HD2 LEU 86 3HD2 LEU 86 5.380 0.100 -0.012
655 H MET 87 H MET 87 6.291 -4.342 -0.249
656 HA MET 87 HA MET 87 6.769 -3.727 2.356
657 1HB MET 87 2HB MET 87 6.444 -6.027 1.323
658 2HB MET 87 3HB MET 87 8.167 -6.007 0.940
659 1HG MET 87 2HG MET 87 8.129 -5.375 3.676
660 2HG MET 87 3HG MET 87 6.798 -6.505 3.492
661 1HE MET 87 1HE MET 87 11.261 -7.406 2.722
662 2HE MET 87 2HE MET 87 10.365 -6.317 1.641
663 3HE MET 87 3HE MET 87 10.622 -5.871 3.349
664 H ALA 88 H ALA 88 9.255 -4.014 -0.157
665 HA ALA 88 HA ALA 88 11.567 -4.019 1.391
666 1HB ALA 88 1HB ALA 88 11.529 -4.681 -0.954
667 2HB ALA 88 2HB ALA 88 11.082 -3.047 -1.460
668 3HB ALA 88 3HB ALA 88 12.685 -3.351 -0.751
669 H ALA 89 H ALA 89 9.818 -1.205 0.036
670 HA ALA 89 HA ALA 89 11.829 0.670 1.194
671 1HB ALA 89 1HB ALA 89 9.357 1.054 -0.494
672 2HB ALA 89 2HB ALA 89 10.396 2.384 0.072
673 3HB ALA 89 3HB ALA 89 11.070 1.164 -1.021
674 H ALA 90 H ALA 90 8.511 -0.483 1.706
675 HA ALA 90 HA ALA 90 7.697 1.467 3.667
676 1HB ALA 90 1HB ALA 90 6.129 -0.414 4.295
677 2HB ALA 90 2HB ALA 90 6.102 0.012 2.557
678 3HB ALA 90 3HB ALA 90 6.954 -1.440 3.117
679 H ASP 91 H ASP 91 9.311 -1.750 3.974
680 HA ASP 91 HA ASP 91 9.419 -1.539 6.837
681 1HB ASP 91 2HB ASP 91 9.441 -3.721 5.648
682 2HB ASP 91 3HB ASP 91 11.051 -3.336 5.004
683 H ASN 92 H ASN 92 10.763 -0.145 7.900
684 HA ASN 92 HA ASN 92 13.332 0.694 6.525
685 1HB ASN 92 2HB ASN 92 11.404 2.336 8.184
686 2HB ASN 92 3HB ASN 92 13.098 2.790 7.941
687 1HD2 ASN 92 1HD2 ASN 92 10.188 1.825 6.028
688 2HD2 ASN 92 2HD2 ASN 92 10.703 2.631 4.568
689 H ASP 93 H ASP 93 12.963 -1.669 7.953
690 HA ASP 93 HA ASP 93 14.907 -1.227 10.196
691 1HB ASP 93 2HB ASP 93 12.822 -3.421 9.807
692 2HB ASP 93 3HB ASP 93 14.108 -3.452 11.019
693 H GLY 94 H GLY 94 13.827 -3.393 7.565
694 1HA GLY 94 1HA GLY 94 15.114 -4.853 6.236
695 2HA GLY 94 2HA GLY 94 16.475 -4.735 7.368
696 H ASP 95 H ASP 95 12.945 -5.121 7.983
697 HA ASP 95 HA ASP 95 13.479 -7.772 9.264
698 1HB ASP 95 2HB ASP 95 12.577 -7.255 11.205
699 2HB ASP 95 3HB ASP 95 12.960 -5.593 10.796
700 H GLY 96 H GLY 96 10.776 -5.684 8.060
701 1HA GLY 96 1HA GLY 96 9.763 -6.497 5.939
702 2HA GLY 96 2HA GLY 96 9.643 -8.102 6.666
703 H LYS 97 H LYS 97 8.950 -7.087 9.384
704 HA LYS 97 HA LYS 97 6.074 -6.873 9.018
705 1HB LYS 97 2HB LYS 97 7.806 -6.492 11.487
706 2HB LYS 97 3HB LYS 97 6.061 -6.752 11.476
707 1HG LYS 97 2HG LYS 97 6.277 -9.020 10.749
708 2HG LYS 97 3HG LYS 97 7.965 -8.799 10.257
709 1HD LYS 97 2HD LYS 97 8.619 -8.347 12.590
710 2HD LYS 97 3HD LYS 97 6.962 -8.748 13.116
711 1HE LYS 97 2HE LYS 97 7.217 -11.029 12.142
712 2HE LYS 97 3HE LYS 97 8.823 -10.599 11.521
713 1HZ LYS 97 1HZ LYS 97 8.982 -11.843 13.538
714 2HZ LYS 97 2HZ LYS 97 9.577 -10.326 13.762
715 3HZ LYS 97 3HZ LYS 97 8.097 -10.729 14.366
716 H ILE 98 H ILE 98 5.013 -4.935 8.640
717 HA ILE 98 HA ILE 98 6.601 -2.420 8.930
718 HB ILE 98 HB ILE 98 4.447 -3.390 7.077
719 1HG1 ILE 98 2HG1 ILE 98 6.967 -1.892 6.357
720 2HG1 ILE 98 3HG1 ILE 98 7.143 -3.559 6.898
721 1HG2 ILE 98 1HG2 ILE 98 4.370 -1.149 6.096
722 2HG2 ILE 98 2HG2 ILE 98 3.709 -1.139 7.728
723 3HG2 ILE 98 3HG2 ILE 98 5.343 -0.499 7.434
724 1HD1 ILE 98 1HD1 ILE 98 6.994 -3.444 4.506
725 2HD1 ILE 98 2HD1 ILE 98 5.643 -4.380 5.178
726 3HD1 ILE 98 3HD1 ILE 98 5.364 -2.724 4.584
727 H GLY 99 H GLY 99 6.039 -1.031 10.504
728 1HA GLY 99 1HA GLY 99 3.422 -1.334 11.893
729 2HA GLY 99 2HA GLY 99 4.709 -0.183 12.270
730 H ALA 100 H ALA 100 1.865 0.416 11.981
731 HA ALA 100 HA ALA 100 1.230 1.890 9.662
732 1HB ALA 100 1HB ALA 100 -0.334 1.593 11.535
733 2HB ALA 100 2HB ALA 100 0.726 2.548 12.601
734 3HB ALA 100 3HB ALA 100 -0.077 3.322 11.223
735 H GLU 101 H GLU 101 3.467 2.563 12.327
736 HA GLU 101 HA GLU 101 3.937 5.246 11.754
737 1HB GLU 101 2HB GLU 101 4.485 4.038 13.862
738 2HB GLU 101 3HB GLU 101 5.879 3.283 13.073
739 1HG GLU 101 2HG GLU 101 6.958 5.434 12.817
740 2HG GLU 101 3HG GLU 101 5.476 6.299 13.263
741 H GLU 102 H GLU 102 6.104 2.454 10.966
742 HA GLU 102 HA GLU 102 7.845 3.573 9.128
743 1HB GLU 102 2HB GLU 102 6.454 0.847 9.069
744 2HB GLU 102 3HB GLU 102 7.781 1.304 8.005
745 1HG GLU 102 2HG GLU 102 9.275 1.620 9.920
746 2HG GLU 102 3HG GLU 102 7.979 1.173 11.036
747 H PHE 103 H PHE 103 4.554 2.302 8.510
748 HA PHE 103 HA PHE 103 4.700 2.851 5.725
749 1HB PHE 103 2HB PHE 103 3.070 1.333 7.281
750 2HB PHE 103 3HB PHE 103 2.011 2.705 7.051
751 HD1 PHE 103 1HD PHE 103 4.481 0.873 4.871
752 HD2 PHE 103 2HD PHE 103 0.350 1.710 5.618
753 HE1 PHE 103 1HE PHE 103 3.834 -0.525 2.947
754 HE2 PHE 103 2HE PHE 103 -0.259 0.648 3.467
755 HZ PHE 103 HZ PHE 103 1.475 -0.541 2.146
756 H GLN 104 H GLN 104 3.420 4.858 8.389
757 HA GLN 104 HA GLN 104 2.415 7.029 6.724
758 1HB GLN 104 2HB GLN 104 1.997 6.628 9.231
759 2HB GLN 104 3HB GLN 104 3.613 7.302 9.498
760 1HG GLN 104 2HG GLN 104 2.840 9.334 8.111
761 2HG GLN 104 3HG GLN 104 1.217 8.639 8.146
762 1HE2 GLN 104 1HE2 GLN 104 0.744 7.809 10.650
763 2HE2 GLN 104 2HE2 GLN 104 1.007 9.110 11.807
764 H GLU 105 H GLU 105 5.704 6.312 8.230
765 HA GLU 105 HA GLU 105 6.928 8.682 7.284
766 1HB GLU 105 2HB GLU 105 8.118 5.891 7.684
767 2HB GLU 105 3HB GLU 105 9.038 7.281 7.127
768 1HG GLU 105 2HG GLU 105 8.197 8.560 9.187
769 2HG GLU 105 3HG GLU 105 7.674 6.987 9.819
770 H MET 106 H MET 106 6.664 5.511 5.596
771 HA MET 106 HA MET 106 8.020 6.398 3.261
772 1HB MET 106 2HB MET 106 6.860 3.993 4.113
773 2HB MET 106 3HB MET 106 5.838 4.442 2.749
774 1HG MET 106 2HG MET 106 8.847 4.041 2.774
775 2HG MET 106 3HG MET 106 7.629 3.035 1.996
776 1HE MET 106 1HE MET 106 10.082 6.103 -0.003
777 2HE MET 106 2HE MET 106 9.836 6.204 1.751
778 3HE MET 106 3HE MET 106 10.468 4.707 1.026
779 H VAL 107 H VAL 107 4.546 6.192 4.013
780 HA VAL 107 HA VAL 107 3.779 7.294 1.511
781 HB VAL 107 HB VAL 107 2.195 6.646 4.012
782 1HG1 VAL 107 1HG1 VAL 107 1.319 7.367 1.207
783 2HG1 VAL 107 2HG1 VAL 107 0.257 6.573 2.398
784 3HG1 VAL 107 3HG1 VAL 107 0.874 8.203 2.703
785 1HG2 VAL 107 1HG2 VAL 107 2.531 5.170 1.348
786 2HG2 VAL 107 2HG2 VAL 107 3.316 4.681 2.855
787 3HG2 VAL 107 3HG2 VAL 107 1.556 4.628 2.729
788 H HIS 108 H HIS 108 4.691 8.916 4.460
789 HA HIS 108 HA HIS 108 3.311 11.374 3.567
790 1HB HIS 108 2HB HIS 108 3.239 10.613 5.945
791 2HB HIS 108 3HB HIS 108 4.967 10.972 6.064
792 HD1 HIS 108 1HD HIS 108 2.725 13.376 4.108
793 HD2 HIS 108 2HD HIS 108 4.386 12.879 7.942
794 HE1 HIS 108 1HE HIS 108 2.295 15.550 5.380
795 H SER 109 H SER 109 6.073 9.829 2.627
796 HA SER 109 HA SER 109 7.955 12.035 2.851
797 1HB SER 109 2HB SER 109 8.660 9.637 2.875
798 2HB SER 109 3HB SER 109 8.069 9.486 1.202
799 HG SER 109 HG SER 109 9.468 11.384 0.819
Start of MODEL 5
1 1H MET 1 H1 MET 1 -18.015 5.211 3.083
2 2H MET 1 H2 MET 1 -19.204 5.957 2.167
3 3H MET 1 H3 MET 1 -18.895 4.322 2.032
4 HA MET 1 HA MET 1 -17.728 5.111 0.219
5 1HB MET 1 2HB MET 1 -16.711 7.356 2.032
6 2HB MET 1 3HB MET 1 -16.311 7.095 0.342
7 1HG MET 1 2HG MET 1 -17.976 8.775 0.265
8 2HG MET 1 3HG MET 1 -18.775 7.285 -0.220
9 1HE MET 1 1HE MET 1 -21.256 7.674 0.250
10 2HE MET 1 2HE MET 1 -21.829 8.749 1.546
11 3HE MET 1 3HE MET 1 -20.753 9.383 0.277
12 H SER 2 H SER 2 -15.292 5.073 -0.107
13 HA SER 2 HA SER 2 -13.762 3.927 2.108
14 1HB SER 2 2HB SER 2 -14.299 2.421 -0.502
15 2HB SER 2 3HB SER 2 -13.187 1.908 0.786
16 HG SER 2 HG SER 2 -15.231 0.883 0.956
17 H ILE 3 H ILE 3 -11.524 3.488 1.154
18 HA ILE 3 HA ILE 3 -10.431 5.815 0.138
19 HB ILE 3 HB ILE 3 -8.388 4.720 -0.012
20 1HG1 ILE 3 2HG1 ILE 3 -8.573 2.001 0.362
21 2HG1 ILE 3 3HG1 ILE 3 -9.884 2.242 -0.781
22 1HG2 ILE 3 1HG2 ILE 3 -9.499 4.817 2.255
23 2HG2 ILE 3 2HG2 ILE 3 -9.878 3.094 2.095
24 3HG2 ILE 3 3HG2 ILE 3 -8.202 3.614 2.108
25 1HD1 ILE 3 1HD1 ILE 3 -7.631 1.754 -1.806
26 2HD1 ILE 3 2HD1 ILE 3 -8.288 3.303 -2.356
27 3HD1 ILE 3 3HD1 ILE 3 -7.006 3.250 -1.118
28 H THR 4 H THR 4 -11.826 3.093 -1.730
29 HA THR 4 HA THR 4 -10.908 4.080 -4.293
30 HB THR 4 HB THR 4 -10.767 1.720 -3.909
31 HG1 THR 4 1HG THR 4 -13.102 2.419 -5.200
32 1HG2 THR 4 1HG2 THR 4 -13.685 1.790 -2.987
33 2HG2 THR 4 2HG2 THR 4 -12.794 0.328 -3.415
34 3HG2 THR 4 3HG2 THR 4 -12.285 1.262 -2.017
35 H ASP 5 H ASP 5 -12.226 6.079 -3.142
36 HA ASP 5 HA ASP 5 -14.457 6.634 -4.831
37 1HB ASP 5 2HB ASP 5 -15.788 5.156 -3.430
38 2HB ASP 5 3HB ASP 5 -15.150 5.902 -1.957
39 H VAL 6 H VAL 6 -13.181 7.211 -1.558
40 HA VAL 6 HA VAL 6 -13.747 9.909 -1.252
41 HB VAL 6 HB VAL 6 -11.458 8.170 -0.273
42 1HG1 VAL 6 1HG1 VAL 6 -11.970 11.062 0.522
43 2HG1 VAL 6 2HG1 VAL 6 -10.959 9.914 1.426
44 3HG1 VAL 6 3HG1 VAL 6 -10.487 10.397 -0.200
45 1HG2 VAL 6 1HG2 VAL 6 -13.815 9.446 1.184
46 2HG2 VAL 6 2HG2 VAL 6 -13.843 7.803 0.533
47 3HG2 VAL 6 3HG2 VAL 6 -12.697 8.219 1.819
48 H LEU 7 H LEU 7 -10.901 8.525 -2.852
49 HA LEU 7 HA LEU 7 -10.480 10.836 -4.552
50 1HB LEU 7 2HB LEU 7 -9.472 11.879 -2.661
51 2HB LEU 7 3HB LEU 7 -8.744 10.369 -2.111
52 HG LEU 7 HG LEU 7 -7.107 10.411 -3.941
53 1HD1 LEU 7 1HD1 LEU 7 -6.903 12.368 -5.429
54 2HD1 LEU 7 2HD1 LEU 7 -8.414 11.513 -5.730
55 3HD1 LEU 7 3HD1 LEU 7 -8.429 13.027 -4.800
56 1HD2 LEU 7 1HD2 LEU 7 -7.267 13.100 -2.529
57 2HD2 LEU 7 2HD2 LEU 7 -6.625 11.601 -1.823
58 3HD2 LEU 7 3HD2 LEU 7 -5.817 12.339 -3.217
59 H SER 8 H SER 8 -8.679 8.215 -2.878
60 HA SER 8 HA SER 8 -6.921 7.596 -4.766
61 1HB SER 8 2HB SER 8 -8.203 5.440 -3.111
62 2HB SER 8 3HB SER 8 -6.521 5.580 -3.640
63 HG SER 8 HG SER 8 -6.298 7.382 -2.291
64 H ALA 9 H ALA 9 -10.326 6.734 -4.991
65 HA ALA 9 HA ALA 9 -10.487 4.737 -6.874
66 1HB ALA 9 1HB ALA 9 -12.372 6.162 -7.879
67 2HB ALA 9 2HB ALA 9 -12.496 5.841 -6.151
68 3HB ALA 9 3HB ALA 9 -11.915 7.424 -6.716
69 H ASP 10 H ASP 10 -9.530 8.158 -7.623
70 HA ASP 10 HA ASP 10 -9.402 7.548 -10.484
71 1HB ASP 10 2HB ASP 10 -9.802 9.834 -9.497
72 2HB ASP 10 3HB ASP 10 -8.100 9.862 -8.999
73 H ASP 11 H ASP 11 -7.148 7.777 -7.766
74 HA ASP 11 HA ASP 11 -4.734 7.612 -9.220
75 1HB ASP 11 2HB ASP 11 -5.267 6.864 -6.313
76 2HB ASP 11 3HB ASP 11 -3.739 7.303 -7.077
77 H ILE 12 H ILE 12 -6.765 5.079 -7.651
78 HA ILE 12 HA ILE 12 -5.048 2.920 -8.140
79 HB ILE 12 HB ILE 12 -6.963 1.528 -7.899
80 1HG1 ILE 12 2HG1 ILE 12 -8.591 3.963 -7.428
81 2HG1 ILE 12 3HG1 ILE 12 -8.700 2.997 -8.901
82 1HG2 ILE 12 1HG2 ILE 12 -6.709 3.631 -5.721
83 2HG2 ILE 12 2HG2 ILE 12 -7.301 1.976 -5.502
84 3HG2 ILE 12 3HG2 ILE 12 -5.626 2.252 -5.971
85 1HD1 ILE 12 1HD1 ILE 12 -9.541 1.110 -7.677
86 2HD1 ILE 12 2HD1 ILE 12 -9.446 2.015 -6.136
87 3HD1 ILE 12 3HD1 ILE 12 -10.550 2.521 -7.422
88 H ALA 13 H ALA 13 -7.529 4.530 -10.167
89 HA ALA 13 HA ALA 13 -7.527 2.545 -12.230
90 1HB ALA 13 1HB ALA 13 -8.639 4.199 -13.589
91 2HB ALA 13 2HB ALA 13 -9.299 4.267 -11.943
92 3HB ALA 13 3HB ALA 13 -8.162 5.511 -12.503
93 H ALA 14 H ALA 14 -5.600 5.526 -11.683
94 HA ALA 14 HA ALA 14 -3.973 5.262 -14.029
95 1HB ALA 14 1HB ALA 14 -4.024 7.303 -12.658
96 2HB ALA 14 2HB ALA 14 -3.209 6.458 -11.329
97 3HB ALA 14 3HB ALA 14 -2.372 6.693 -12.872
98 H ALA 15 H ALA 15 -3.282 4.224 -10.661
99 HA ALA 15 HA ALA 15 -0.859 2.974 -10.982
100 1HB ALA 15 1HB ALA 15 -3.051 1.978 -9.134
101 2HB ALA 15 2HB ALA 15 -1.293 1.892 -8.913
102 3HB ALA 15 3HB ALA 15 -2.116 3.453 -8.831
103 H LEU 16 H LEU 16 -4.045 1.591 -11.322
104 HA LEU 16 HA LEU 16 -3.555 -1.094 -11.759
105 1HB LEU 16 2HB LEU 16 -5.805 -0.353 -11.490
106 2HB LEU 16 3HB LEU 16 -5.642 0.832 -12.786
107 HG LEU 16 HG LEU 16 -5.591 -0.977 -14.484
108 1HD1 LEU 16 1HD1 LEU 16 -4.772 -2.854 -13.043
109 2HD1 LEU 16 2HD1 LEU 16 -6.294 -2.792 -12.130
110 3HD1 LEU 16 3HD1 LEU 16 -6.300 -3.243 -13.848
111 1HD2 LEU 16 1HD2 LEU 16 -7.652 0.218 -13.904
112 2HD2 LEU 16 2HD2 LEU 16 -7.975 -1.467 -14.348
113 3HD2 LEU 16 3HD2 LEU 16 -8.001 -0.980 -12.639
114 H GLN 17 H GLN 17 -3.278 1.659 -14.052
115 HA GLN 17 HA GLN 17 -2.844 -0.293 -16.257
116 1HB GLN 17 2HB GLN 17 -4.203 2.202 -16.143
117 2HB GLN 17 3HB GLN 17 -2.760 2.453 -17.142
118 1HG GLN 17 2HG GLN 17 -3.361 0.411 -18.467
119 2HG GLN 17 3HG GLN 17 -4.793 0.191 -17.443
120 1HE2 GLN 17 1HE2 GLN 17 -3.251 2.745 -19.506
121 2HE2 GLN 17 2HE2 GLN 17 -4.779 3.282 -20.184
122 H GLU 18 H GLU 18 -1.243 2.368 -14.510
123 HA GLU 18 HA GLU 18 1.005 2.417 -16.234
124 1HB GLU 18 2HB GLU 18 1.863 4.050 -14.827
125 2HB GLU 18 3HB GLU 18 0.109 4.206 -14.731
126 1HG GLU 18 2HG GLU 18 0.438 4.349 -12.526
127 2HG GLU 18 3HG GLU 18 0.469 2.582 -12.615
128 H CYS 19 H CYS 19 0.336 0.494 -13.305
129 HA CYS 19 HA CYS 19 2.770 -1.174 -13.922
130 1HB CYS 19 2HB CYS 19 1.614 -0.417 -11.245
131 2HB CYS 19 3HB CYS 19 2.707 -1.795 -11.515
132 HG CYS 19 HG CYS 19 3.208 1.401 -11.910
133 H ARG 20 H ARG 20 0.752 -1.829 -15.463
134 HA ARG 20 HA ARG 20 -1.099 -3.620 -14.067
135 1HB ARG 20 2HB ARG 20 -1.526 -2.182 -16.185
136 2HB ARG 20 3HB ARG 20 -0.763 -3.499 -17.075
137 1HG ARG 20 2HG ARG 20 -2.456 -5.063 -16.344
138 2HG ARG 20 3HG ARG 20 -3.030 -3.964 -15.074
139 1HD ARG 20 2HD ARG 20 -3.842 -2.372 -16.729
140 2HD ARG 20 3HD ARG 20 -3.313 -3.453 -18.050
141 HE ARG 20 HE ARG 20 -4.973 -4.910 -16.263
142 1HH1 ARG 20 2HH2 ARG 20 -5.258 -2.256 -18.551
143 2HH1 ARG 20 1HH2 ARG 20 -6.933 -2.518 -18.927
144 1HH2 ARG 20 2HH1 ARG 20 -7.198 -5.332 -16.742
145 2HH2 ARG 20 1HH1 ARG 20 -8.056 -4.343 -17.879
146 H ASP 21 H ASP 21 2.051 -3.848 -15.424
147 HA ASP 21 HA ASP 21 1.861 -6.634 -16.194
148 1HB ASP 21 2HB ASP 21 3.961 -4.442 -16.425
149 2HB ASP 21 3HB ASP 21 4.239 -6.084 -16.993
150 HA PRO 22 HA PRO 22 3.405 -8.449 -12.574
151 1HB PRO 22 2HB PRO 22 5.029 -10.503 -13.440
152 2HB PRO 22 3HB PRO 22 3.245 -10.514 -13.563
153 1HG PRO 22 2HG PRO 22 5.239 -9.695 -15.693
154 2HG PRO 22 3HG PRO 22 3.867 -10.830 -15.866
155 1HD PRO 22 2HD PRO 22 3.624 -8.262 -16.637
156 2HD PRO 22 3HD PRO 22 2.280 -9.030 -15.746
157 H ASP 23 H ASP 23 4.781 -7.582 -11.205
158 HA ASP 23 HA ASP 23 6.645 -7.295 -10.071
159 1HB ASP 23 2HB ASP 23 8.258 -8.383 -12.385
160 2HB ASP 23 3HB ASP 23 8.810 -8.120 -10.730
161 H THR 24 H THR 24 5.476 -5.400 -12.164
162 HA THR 24 HA THR 24 7.728 -3.597 -12.722
163 HB THR 24 HB THR 24 4.762 -3.133 -13.236
164 HG1 THR 24 1HG THR 24 5.126 -4.974 -14.223
165 1HG2 THR 24 1HG2 THR 24 7.334 -1.957 -14.335
166 2HG2 THR 24 2HG2 THR 24 5.868 -2.017 -15.328
167 3HG2 THR 24 3HG2 THR 24 5.857 -1.127 -13.796
168 H PHE 25 H PHE 25 5.535 -4.042 -10.117
169 HA PHE 25 HA PHE 25 4.855 -1.292 -9.886
170 1HB PHE 25 2HB PHE 25 3.449 -3.359 -9.565
171 2HB PHE 25 3HB PHE 25 4.130 -3.515 -7.952
172 HD1 PHE 25 1HD PHE 25 1.637 -3.661 -7.522
173 HD2 PHE 25 2HD PHE 25 3.435 -0.003 -8.971
174 HE1 PHE 25 1HE PHE 25 -0.558 -2.530 -7.445
175 HE2 PHE 25 2HE PHE 25 1.236 1.046 -9.036
176 HZ PHE 25 HZ PHE 25 -0.789 -0.214 -8.281
177 H GLU 26 H GLU 26 6.519 0.022 -9.186
178 HA GLU 26 HA GLU 26 8.303 -0.754 -7.036
179 1HB GLU 26 2HB GLU 26 8.232 1.325 -9.135
180 2HB GLU 26 3HB GLU 26 8.574 2.026 -7.566
181 1HG GLU 26 2HG GLU 26 10.349 -0.023 -7.453
182 2HG GLU 26 3HG GLU 26 10.242 0.188 -9.202
183 HA PRO 27 HA PRO 27 6.037 1.019 -3.765
184 1HB PRO 27 2HB PRO 27 7.967 1.937 -1.999
185 2HB PRO 27 3HB PRO 27 7.604 0.216 -2.280
186 1HG PRO 27 2HG PRO 27 9.899 1.797 -3.395
187 2HG PRO 27 3HG PRO 27 9.848 0.095 -2.862
188 1HD PRO 27 2HD PRO 27 9.703 0.893 -5.491
189 2HD PRO 27 3HD PRO 27 9.039 -0.645 -4.862
190 H GLN 28 H GLN 28 8.816 3.291 -4.239
191 HA GLN 28 HA GLN 28 7.321 5.581 -3.499
192 1HB GLN 28 2HB GLN 28 9.919 5.227 -5.007
193 2HB GLN 28 3HB GLN 28 9.226 6.823 -4.661
194 1HG GLN 28 2HG GLN 28 9.232 6.414 -2.269
195 2HG GLN 28 3HG GLN 28 9.719 4.730 -2.497
196 1HE2 GLN 28 1HE2 GLN 28 10.871 8.078 -3.319
197 2HE2 GLN 28 2HE2 GLN 28 12.556 7.683 -3.025
198 H LYS 29 H LYS 29 7.714 3.956 -6.618
199 HA LYS 29 HA LYS 29 6.452 5.941 -8.216
200 1HB LYS 29 2HB LYS 29 7.727 3.960 -9.070
201 2HB LYS 29 3HB LYS 29 6.415 2.908 -8.545
202 1HG LYS 29 2HG LYS 29 6.310 3.280 -10.905
203 2HG LYS 29 3HG LYS 29 4.869 3.960 -10.168
204 1HD LYS 29 2HD LYS 29 7.255 5.783 -10.547
205 2HD LYS 29 3HD LYS 29 6.464 5.238 -12.017
206 1HE LYS 29 2HE LYS 29 4.913 6.560 -9.738
207 2HE LYS 29 3HE LYS 29 5.650 7.477 -11.049
208 1HZ LYS 29 1HZ LYS 29 3.193 6.728 -11.283
209 2HZ LYS 29 2HZ LYS 29 4.200 6.511 -12.580
210 3HZ LYS 29 3HZ LYS 29 3.810 5.269 -11.679
211 H PHE 30 H PHE 30 5.078 2.890 -6.822
212 HA PHE 30 HA PHE 30 2.453 3.393 -7.533
213 1HB PHE 30 2HB PHE 30 3.297 1.211 -6.783
214 2HB PHE 30 3HB PHE 30 3.547 1.842 -5.162
215 HD1 PHE 30 1HD PHE 30 0.430 2.617 -7.111
216 HD2 PHE 30 2HD PHE 30 2.240 -0.074 -4.290
217 HE1 PHE 30 1HE PHE 30 -1.803 1.953 -6.300
218 HE2 PHE 30 2HE PHE 30 0.048 -0.747 -3.510
219 HZ PHE 30 HZ PHE 30 -2.015 0.443 -4.365
220 H PHE 31 H PHE 31 4.070 4.124 -4.480
221 HA PHE 31 HA PHE 31 2.296 5.301 -2.796
222 1HB PHE 31 2HB PHE 31 4.546 5.187 -2.135
223 2HB PHE 31 3HB PHE 31 5.104 5.851 -3.660
224 HD1 PHE 31 1HD PHE 31 2.795 7.158 -1.023
225 HD2 PHE 31 2HD PHE 31 6.348 7.795 -3.383
226 HE1 PHE 31 1HE PHE 31 3.025 9.429 -0.098
227 HE2 PHE 31 2HE PHE 31 6.672 9.989 -2.295
228 HZ PHE 31 HZ PHE 31 5.044 10.781 -0.596
229 H GLN 32 H GLN 32 4.033 7.194 -5.354
230 HA GLN 32 HA GLN 32 2.384 9.501 -4.872
231 1HB GLN 32 2HB GLN 32 4.717 9.538 -5.855
232 2HB GLN 32 3HB GLN 32 4.028 8.903 -7.362
233 1HG GLN 32 2HG GLN 32 2.412 10.913 -7.311
234 2HG GLN 32 3HG GLN 32 3.379 11.550 -5.977
235 1HE2 GLN 32 1HE2 GLN 32 5.900 11.552 -6.549
236 2HE2 GLN 32 2HE2 GLN 32 6.248 12.171 -8.157
237 H THR 33 H THR 33 2.423 6.917 -7.368
238 HA THR 33 HA THR 33 0.410 8.059 -8.978
239 HB THR 33 HB THR 33 2.156 5.762 -9.006
240 HG1 THR 33 1HG THR 33 0.310 6.795 -10.803
241 1HG2 THR 33 1HG2 THR 33 -0.653 4.993 -9.803
242 2HG2 THR 33 2HG2 THR 33 0.836 4.027 -9.914
243 3HG2 THR 33 3HG2 THR 33 0.162 4.408 -8.331
244 H SER 34 H SER 34 0.194 6.218 -6.064
245 HA SER 34 HA SER 34 -2.617 5.524 -6.342
246 1HB SER 34 2HB SER 34 -0.989 4.017 -5.317
247 2HB SER 34 3HB SER 34 -0.645 5.179 -4.054
248 HG SER 34 HG SER 34 -3.076 5.055 -3.727
249 H GLY 35 H GLY 35 -0.888 8.320 -5.453
250 1HA GLY 35 1HA GLY 35 -1.853 10.363 -4.885
251 2HA GLY 35 2HA GLY 35 -3.392 9.561 -4.531
252 H LEU 36 H LEU 36 -0.867 7.930 -2.993
253 HA LEU 36 HA LEU 36 -1.888 8.606 -0.395
254 1HB LEU 36 2HB LEU 36 0.584 7.071 -1.256
255 2HB LEU 36 3HB LEU 36 -0.163 7.053 0.337
256 HG LEU 36 HG LEU 36 -1.425 6.007 -2.199
257 1HD1 LEU 36 1HD1 LEU 36 -1.124 3.807 -1.173
258 2HD1 LEU 36 2HD1 LEU 36 0.441 4.630 -1.286
259 3HD1 LEU 36 3HD1 LEU 36 -0.406 4.549 0.273
260 1HD2 LEU 36 1HD2 LEU 36 -2.505 6.046 0.642
261 2HD2 LEU 36 2HD2 LEU 36 -3.215 6.824 -0.796
262 3HD2 LEU 36 3HD2 LEU 36 -3.164 5.065 -0.685
263 H SER 37 H SER 37 0.711 9.777 -2.403
264 HA SER 37 HA SER 37 2.115 11.403 -0.464
265 1HB SER 37 2HB SER 37 2.933 10.754 -2.796
266 2HB SER 37 3HB SER 37 1.687 11.809 -3.471
267 HG SER 37 HG SER 37 3.733 12.659 -1.695
268 H LYS 38 H LYS 38 -1.005 11.722 -2.091
269 HA LYS 38 HA LYS 38 -1.032 14.637 -1.658
270 1HB LYS 38 2HB LYS 38 -2.055 13.042 -3.723
271 2HB LYS 38 3HB LYS 38 -3.469 13.321 -2.717
272 1HG LYS 38 2HG LYS 38 -3.364 15.094 -4.336
273 2HG LYS 38 3HG LYS 38 -2.970 15.778 -2.756
274 1HD LYS 38 2HD LYS 38 -0.480 14.896 -3.884
275 2HD LYS 38 3HD LYS 38 -1.366 15.636 -5.219
276 1HE LYS 38 2HE LYS 38 -1.677 17.712 -3.887
277 2HE LYS 38 3HE LYS 38 -0.873 16.961 -2.496
278 1HZ LYS 38 1HZ LYS 38 1.132 16.815 -3.786
279 2HZ LYS 38 2HZ LYS 38 0.403 17.512 -5.091
280 3HZ LYS 38 3HZ LYS 38 0.612 18.370 -3.703
281 H MET 39 H MET 39 -2.527 11.585 -0.629
282 HA MET 39 HA MET 39 -4.436 12.685 1.133
283 1HB MET 39 2HB MET 39 -2.864 10.089 1.081
284 2HB MET 39 3HB MET 39 -3.929 10.463 2.429
285 1HG MET 39 2HG MET 39 -5.819 10.804 0.926
286 2HG MET 39 3HG MET 39 -4.822 10.382 -0.475
287 1HE MET 39 1HE MET 39 -7.264 8.960 -0.615
288 2HE MET 39 2HE MET 39 -7.582 7.542 0.420
289 3HE MET 39 3HE MET 39 -7.686 9.179 1.099
290 H SER 40 H SER 40 -4.268 13.867 3.015
291 HA SER 40 HA SER 40 -1.809 14.562 4.206
292 1HB SER 40 2HB SER 40 -4.569 14.518 5.507
293 2HB SER 40 3HB SER 40 -3.205 15.580 5.907
294 HG SER 40 HG SER 40 -4.649 16.675 4.547
295 H ALA 41 H ALA 41 -1.054 13.970 6.377
296 HA ALA 41 HA ALA 41 -0.573 11.352 6.949
297 1HB ALA 41 1HB ALA 41 0.499 13.223 8.120
298 2HB ALA 41 2HB ALA 41 -1.017 13.587 8.972
299 3HB ALA 41 3HB ALA 41 -0.164 12.060 9.279
300 H ASN 42 H ASN 42 -3.426 13.213 8.024
301 HA ASN 42 HA ASN 42 -4.632 11.326 9.720
302 1HB ASN 42 2HB ASN 42 -6.056 13.227 7.804
303 2HB ASN 42 3HB ASN 42 -6.723 12.507 9.273
304 1HD2 ASN 42 1HD2 ASN 42 -6.352 13.617 11.245
305 2HD2 ASN 42 2HD2 ASN 42 -5.306 15.018 11.357
306 H GLN 43 H GLN 43 -5.141 11.818 6.190
307 HA GLN 43 HA GLN 43 -6.952 9.595 5.925
308 1HB GLN 43 2HB GLN 43 -5.561 11.498 4.060
309 2HB GLN 43 3HB GLN 43 -6.051 9.939 3.397
310 1HG GLN 43 2HG GLN 43 -7.958 11.761 4.905
311 2HG GLN 43 3HG GLN 43 -7.768 11.756 3.143
312 1HE2 GLN 43 1HE2 GLN 43 -10.304 11.233 4.157
313 2HE2 GLN 43 2HE2 GLN 43 -10.646 9.523 3.980
314 H VAL 44 H VAL 44 -3.395 10.011 5.319
315 HA VAL 44 HA VAL 44 -2.956 7.430 4.291
316 HB VAL 44 HB VAL 44 -1.218 9.310 5.955
317 1HG1 VAL 44 1HG1 VAL 44 0.702 8.088 4.947
318 2HG1 VAL 44 2HG1 VAL 44 -0.213 7.115 6.105
319 3HG1 VAL 44 3HG1 VAL 44 -0.446 6.861 4.353
320 1HG2 VAL 44 1HG2 VAL 44 -0.278 9.949 3.774
321 2HG2 VAL 44 2HG2 VAL 44 -1.340 8.786 2.947
322 3HG2 VAL 44 3HG2 VAL 44 -2.018 10.201 3.754
323 H LYS 45 H LYS 45 -2.912 8.537 7.738
324 HA LYS 45 HA LYS 45 -2.350 5.853 8.666
325 1HB LYS 45 2HB LYS 45 -1.786 8.162 9.741
326 2HB LYS 45 3HB LYS 45 -3.415 8.073 10.428
327 1HG LYS 45 2HG LYS 45 -2.796 5.875 11.477
328 2HG LYS 45 3HG LYS 45 -1.211 5.960 10.684
329 1HD LYS 45 2HD LYS 45 -0.711 8.075 11.885
330 2HD LYS 45 3HD LYS 45 -2.263 7.947 12.744
331 1HE LYS 45 2HE LYS 45 -1.535 5.776 13.734
332 2HE LYS 45 3HE LYS 45 -0.020 5.853 12.819
333 1HZ LYS 45 1HZ LYS 45 0.575 7.816 14.045
334 2HZ LYS 45 2HZ LYS 45 -0.825 7.763 14.911
335 3HZ LYS 45 3HZ LYS 45 0.288 6.562 15.063
336 H ASP 46 H ASP 46 -5.324 7.623 7.944
337 HA ASP 46 HA ASP 46 -7.107 5.780 9.290
338 1HB ASP 46 2HB ASP 46 -7.836 8.016 8.585
339 2HB ASP 46 3HB ASP 46 -7.568 7.594 6.889
340 H VAL 47 H VAL 47 -6.326 6.142 5.775
341 HA VAL 47 HA VAL 47 -7.360 3.738 4.933
342 HB VAL 47 HB VAL 47 -6.005 3.845 2.963
343 1HG1 VAL 47 1HG1 VAL 47 -6.849 5.806 2.088
344 2HG1 VAL 47 2HG1 VAL 47 -7.857 5.643 3.544
345 3HG1 VAL 47 3HG1 VAL 47 -6.492 6.758 3.527
346 1HG2 VAL 47 1HG2 VAL 47 -3.786 4.273 3.706
347 2HG2 VAL 47 2HG2 VAL 47 -4.297 5.494 2.528
348 3HG2 VAL 47 3HG2 VAL 47 -4.318 5.879 4.253
349 H PHE 48 H PHE 48 -3.921 4.202 6.060
350 HA PHE 48 HA PHE 48 -3.284 1.480 5.791
351 1HB PHE 48 2HB PHE 48 -2.220 3.601 7.662
352 2HB PHE 48 3HB PHE 48 -1.678 1.930 7.784
353 HD1 PHE 48 1HD PHE 48 -1.117 0.760 5.410
354 HD2 PHE 48 2HD PHE 48 -0.574 4.888 6.483
355 HE1 PHE 48 1HE PHE 48 0.483 1.036 3.554
356 HE2 PHE 48 2HE PHE 48 1.071 5.134 4.634
357 HZ PHE 48 HZ PHE 48 1.506 3.226 3.101
358 H ARG 49 H ARG 49 -5.017 3.032 8.540
359 HA ARG 49 HA ARG 49 -5.014 0.544 10.055
360 1HB ARG 49 2HB ARG 49 -6.471 3.168 10.339
361 2HB ARG 49 3HB ARG 49 -6.879 1.751 11.322
362 1HG ARG 49 2HG ARG 49 -4.600 1.516 12.127
363 2HG ARG 49 3HG ARG 49 -4.040 2.857 11.115
364 1HD ARG 49 2HD ARG 49 -6.177 3.082 13.273
365 2HD ARG 49 3HD ARG 49 -4.450 3.441 13.528
366 HE ARG 49 HE ARG 49 -5.281 4.902 11.259
367 1HH1 ARG 49 2HH2 ARG 49 -5.940 4.777 14.711
368 2HH1 ARG 49 1HH2 ARG 49 -6.310 6.460 14.907
369 1HH2 ARG 49 2HH1 ARG 49 -5.867 7.150 11.422
370 2HH2 ARG 49 1HH1 ARG 49 -6.234 7.863 12.962
371 H PHE 50 H PHE 50 -7.192 2.048 7.638
372 HA PHE 50 HA PHE 50 -9.397 0.296 8.128
373 1HB PHE 50 2HB PHE 50 -9.409 2.500 6.896
374 2HB PHE 50 3HB PHE 50 -8.599 1.710 5.553
375 HD1 PHE 50 1HD PHE 50 -11.655 1.523 7.717
376 HD2 PHE 50 2HD PHE 50 -9.949 0.688 3.843
377 HE1 PHE 50 1HE PHE 50 -13.910 1.000 6.834
378 HE2 PHE 50 2HE PHE 50 -12.213 0.188 2.961
379 HZ PHE 50 HZ PHE 50 -14.200 0.373 4.445
380 H ILE 51 H ILE 51 -6.552 0.152 5.989
381 HA ILE 51 HA ILE 51 -7.288 -2.472 4.931
382 HB ILE 51 HB ILE 51 -4.896 -0.644 4.546
383 1HG1 ILE 51 2HG1 ILE 51 -5.905 -1.149 2.075
384 2HG1 ILE 51 3HG1 ILE 51 -7.380 -1.421 2.994
385 1HG2 ILE 51 1HG2 ILE 51 -4.002 -2.902 4.459
386 2HG2 ILE 51 2HG2 ILE 51 -5.361 -3.437 3.431
387 3HG2 ILE 51 3HG2 ILE 51 -4.191 -2.248 2.831
388 1HD1 ILE 51 1HD1 ILE 51 -5.724 1.123 3.061
389 2HD1 ILE 51 2HD1 ILE 51 -7.134 0.845 2.025
390 3HD1 ILE 51 3HD1 ILE 51 -7.346 0.867 3.777
391 H ASP 52 H ASP 52 -5.182 -1.328 7.588
392 HA ASP 52 HA ASP 52 -4.117 -3.937 8.196
393 1HB ASP 52 2HB ASP 52 -3.116 -1.829 9.070
394 2HB ASP 52 3HB ASP 52 -4.567 -1.579 10.045
395 H ASN 53 H ASN 53 -6.136 -5.057 7.730
396 HA ASN 53 HA ASN 53 -8.349 -5.111 9.515
397 1HB ASN 53 2HB ASN 53 -7.929 -6.468 7.320
398 2HB ASN 53 3HB ASN 53 -7.078 -7.622 8.376
399 1HD2 ASN 53 1HD2 ASN 53 -9.303 -8.439 6.915
400 2HD2 ASN 53 2HD2 ASN 53 -10.658 -8.678 8.008
401 H ASP 54 H ASP 54 -8.643 -6.698 11.318
402 HA ASP 54 HA ASP 54 -8.103 -7.446 13.321
403 1HB ASP 54 2HB ASP 54 -6.596 -9.070 13.371
404 2HB ASP 54 3HB ASP 54 -6.065 -8.609 11.761
405 H GLN 55 H GLN 55 -5.652 -5.137 12.200
406 HA GLN 55 HA GLN 55 -4.611 -3.446 13.187
407 1HB GLN 55 2HB GLN 55 -7.248 -3.294 14.628
408 2HB GLN 55 3HB GLN 55 -5.916 -2.288 15.193
409 1HG GLN 55 2HG GLN 55 -6.164 -0.827 13.560
410 2HG GLN 55 3HG GLN 55 -6.022 -2.062 12.321
411 1HE2 GLN 55 1HE2 GLN 55 -7.845 -2.880 11.322
412 2HE2 GLN 55 2HE2 GLN 55 -9.469 -2.249 11.617
413 H SER 56 H SER 56 -3.674 -5.881 13.742
414 HA SER 56 HA SER 56 -2.723 -6.252 16.312
415 1HB SER 56 2HB SER 56 -0.642 -7.135 15.153
416 2HB SER 56 3HB SER 56 -2.169 -7.845 14.644
417 HG SER 56 HG SER 56 -0.483 -7.092 12.985
418 H GLY 57 H GLY 57 -2.401 -3.300 14.667
419 1HA GLY 57 1HA GLY 57 -1.126 -1.438 15.088
420 2HA GLY 57 2HA GLY 57 -0.264 -2.286 16.387
421 H TYR 58 H TYR 58 -0.552 -4.026 13.393
422 HA TYR 58 HA TYR 58 1.941 -3.100 12.226
423 1HB TYR 58 2HB TYR 58 1.752 -5.583 13.871
424 2HB TYR 58 3HB TYR 58 2.384 -5.805 12.249
425 HD1 TYR 58 HD1 TYR 58 3.154 -4.392 15.546
426 HD2 TYR 58 HD2 TYR 58 4.357 -4.628 11.420
427 HE1 TYR 58 HE1 TYR 58 5.372 -3.436 16.132
428 HE2 TYR 58 HE2 TYR 58 6.522 -3.546 11.991
429 HH TYR 58 HH TYR 58 7.753 -2.503 13.657
430 H LEU 59 H LEU 59 2.035 -3.422 10.158
431 HA LEU 59 HA LEU 59 -0.020 -5.068 8.820
432 1HB LEU 59 2HB LEU 59 1.827 -2.906 7.738
433 2HB LEU 59 3HB LEU 59 0.755 -3.956 6.793
434 HG LEU 59 HG LEU 59 -1.039 -3.127 8.651
435 1HD1 LEU 59 1HD1 LEU 59 0.872 -1.528 9.602
436 2HD1 LEU 59 2HD1 LEU 59 0.331 -0.488 8.278
437 3HD1 LEU 59 3HD1 LEU 59 -0.819 -1.023 9.501
438 1HD2 LEU 59 1HD2 LEU 59 -0.349 -1.571 6.146
439 2HD2 LEU 59 2HD2 LEU 59 -1.403 -2.999 6.265
440 3HD2 LEU 59 3HD2 LEU 59 -1.859 -1.489 7.072
441 H ASP 60 H ASP 60 0.881 -6.820 9.831
442 HA ASP 60 HA ASP 60 3.575 -7.759 9.518
443 1HB ASP 60 2HB ASP 60 1.032 -9.399 9.889
444 2HB ASP 60 3HB ASP 60 2.689 -9.829 10.355
445 H GLU 61 H GLU 61 3.976 -9.955 8.122
446 HA GLU 61 HA GLU 61 3.997 -9.131 5.573
447 1HB GLU 61 2HB GLU 61 5.094 -11.273 6.792
448 2HB GLU 61 3HB GLU 61 3.828 -12.142 5.927
449 1HG GLU 61 2HG GLU 61 5.053 -10.243 4.134
450 2HG GLU 61 3HG GLU 61 6.349 -11.104 4.973
451 H GLU 62 H GLU 62 1.702 -11.747 6.576
452 HA GLU 62 HA GLU 62 -0.032 -11.772 4.557
453 1HB GLU 62 2HB GLU 62 -0.356 -11.835 7.599
454 2HB GLU 62 3HB GLU 62 -1.823 -11.913 6.627
455 1HG GLU 62 2HG GLU 62 -0.925 -14.131 7.374
456 2HG GLU 62 3HG GLU 62 -1.242 -13.967 5.649
457 H GLU 63 H GLU 63 0.079 -8.863 6.693
458 HA GLU 63 HA GLU 63 -2.484 -7.883 5.757
459 1HB GLU 63 2HB GLU 63 -0.192 -6.754 7.238
460 2HB GLU 63 3HB GLU 63 -0.790 -5.641 6.018
461 1HG GLU 63 2HG GLU 63 -2.088 -5.077 7.817
462 2HG GLU 63 3HG GLU 63 -3.169 -6.166 6.966
463 H LEU 64 H LEU 64 0.839 -7.797 4.597
464 HA LEU 64 HA LEU 64 0.106 -6.291 2.198
465 1HB LEU 64 2HB LEU 64 2.498 -6.748 3.709
466 2HB LEU 64 3HB LEU 64 2.779 -7.423 2.121
467 HG LEU 64 HG LEU 64 1.767 -4.598 2.702
468 1HD1 LEU 64 1HD1 LEU 64 4.506 -5.593 1.835
469 2HD1 LEU 64 2HD1 LEU 64 4.054 -3.893 2.063
470 3HD1 LEU 64 3HD1 LEU 64 4.099 -4.992 3.456
471 1HD2 LEU 64 1HD2 LEU 64 1.078 -5.427 0.413
472 2HD2 LEU 64 2HD2 LEU 64 2.259 -4.117 0.340
473 3HD2 LEU 64 3HD2 LEU 64 2.773 -5.791 0.071
474 H LYS 65 H LYS 65 -0.867 -9.199 2.995
475 HA LYS 65 HA LYS 65 -0.585 -10.219 0.216
476 1HB LYS 65 2HB LYS 65 0.010 -11.679 2.246
477 2HB LYS 65 3HB LYS 65 -1.732 -11.672 2.608
478 1HG LYS 65 2HG LYS 65 -2.232 -12.871 0.575
479 2HG LYS 65 3HG LYS 65 -0.613 -12.553 -0.071
480 1HD LYS 65 2HD LYS 65 -0.660 -14.845 0.684
481 2HD LYS 65 3HD LYS 65 0.414 -13.898 1.726
482 1HE LYS 65 2HE LYS 65 -1.585 -13.701 3.366
483 2HE LYS 65 3HE LYS 65 -2.401 -14.904 2.360
484 1HZ LYS 65 1HZ LYS 65 0.131 -15.206 3.881
485 2HZ LYS 65 2HZ LYS 65 -1.274 -15.908 4.211
486 3HZ LYS 65 3HZ LYS 65 -0.450 -16.363 2.856
487 H PHE 66 H PHE 66 -2.380 -8.067 2.037
488 HA PHE 66 HA PHE 66 -4.490 -8.305 0.084
489 1HB PHE 66 2HB PHE 66 -6.323 -8.197 1.829
490 2HB PHE 66 3HB PHE 66 -5.500 -9.727 1.648
491 HD1 PHE 66 1HD PHE 66 -5.591 -6.633 3.844
492 HD2 PHE 66 2HD PHE 66 -4.505 -10.798 3.523
493 HE1 PHE 66 1HE PHE 66 -5.404 -6.777 6.292
494 HE2 PHE 66 2HE PHE 66 -4.321 -10.925 5.985
495 HZ PHE 66 HZ PHE 66 -4.769 -8.913 7.380
496 H PHE 67 H PHE 67 -2.349 -6.356 0.610
497 HA PHE 67 HA PHE 67 -3.305 -4.137 2.089
498 1HB PHE 67 2HB PHE 67 -0.967 -4.459 1.568
499 2HB PHE 67 3HB PHE 67 -1.257 -4.280 -0.145
500 HD1 PHE 67 1HD PHE 67 -2.042 -2.227 2.934
501 HD2 PHE 67 2HD PHE 67 0.061 -2.456 -0.788
502 HE1 PHE 67 1HE PHE 67 -1.843 0.247 2.914
503 HE2 PHE 67 2HE PHE 67 0.487 -0.016 -0.697
504 HZ PHE 67 HZ PHE 67 -0.538 1.359 1.107
505 H LEU 68 H LEU 68 -3.137 -4.470 -1.530
506 HA LEU 68 HA LEU 68 -5.202 -2.463 -1.895
507 1HB LEU 68 2HB LEU 68 -3.681 -4.341 -3.701
508 2HB LEU 68 3HB LEU 68 -4.950 -3.252 -4.279
509 HG LEU 68 HG LEU 68 -3.749 -1.334 -3.966
510 1HD1 LEU 68 1HD1 LEU 68 -1.834 -0.977 -2.570
511 2HD1 LEU 68 2HD1 LEU 68 -3.107 -1.628 -1.597
512 3HD1 LEU 68 3HD1 LEU 68 -1.784 -2.695 -2.139
513 1HD2 LEU 68 1HD2 LEU 68 -2.785 -3.126 -5.622
514 2HD2 LEU 68 2HD2 LEU 68 -1.822 -1.703 -5.292
515 3HD2 LEU 68 3HD2 LEU 68 -1.438 -3.228 -4.474
516 H GLN 69 H GLN 69 -5.446 -5.851 -1.274
517 HA GLN 69 HA GLN 69 -7.852 -6.399 -2.796
518 1HB GLN 69 2HB GLN 69 -6.691 -7.672 -0.307
519 2HB GLN 69 3HB GLN 69 -8.056 -8.346 -1.182
520 1HG GLN 69 2HG GLN 69 -5.437 -7.883 -2.611
521 2HG GLN 69 3HG GLN 69 -5.722 -9.334 -1.629
522 1HE2 GLN 69 1HE2 GLN 69 -5.778 -8.271 -4.805
523 2HE2 GLN 69 2HE2 GLN 69 -7.038 -9.337 -5.356
524 H LYS 70 H LYS 70 -7.617 -4.007 -0.589
525 HA LYS 70 HA LYS 70 -10.404 -4.373 0.438
526 1HB LYS 70 2HB LYS 70 -8.018 -2.783 1.382
527 2HB LYS 70 3HB LYS 70 -9.645 -2.140 1.632
528 1HG LYS 70 2HG LYS 70 -9.145 -3.252 3.618
529 2HG LYS 70 3HG LYS 70 -10.319 -4.241 2.785
530 1HD LYS 70 2HD LYS 70 -7.691 -5.170 1.971
531 2HD LYS 70 3HD LYS 70 -7.589 -4.834 3.685
532 1HE LYS 70 2HE LYS 70 -8.194 -7.152 3.394
533 2HE LYS 70 3HE LYS 70 -9.557 -6.292 4.121
534 1HZ LYS 70 1HZ LYS 70 -10.620 -6.254 1.974
535 2HZ LYS 70 2HZ LYS 70 -9.360 -6.926 1.220
536 3HZ LYS 70 3HZ LYS 70 -10.206 -7.804 2.323
537 H PHE 71 H PHE 71 -8.346 -2.677 -1.879
538 HA PHE 71 HA PHE 71 -10.452 -0.672 -2.384
539 1HB PHE 71 2HB PHE 71 -8.948 0.548 -3.452
540 2HB PHE 71 3HB PHE 71 -7.796 -0.395 -2.541
541 HD1 PHE 71 1HD PHE 71 -9.663 -0.497 -5.854
542 HD2 PHE 71 2HD PHE 71 -5.926 -0.976 -3.778
543 HE1 PHE 71 1HE PHE 71 -8.525 -0.992 -8.004
544 HE2 PHE 71 2HE PHE 71 -4.780 -1.367 -5.971
545 HZ PHE 71 HZ PHE 71 -6.107 -1.446 -8.061
546 H GLU 72 H GLU 72 -8.825 -3.495 -3.853
547 HA GLU 72 HA GLU 72 -11.113 -3.768 -5.774
548 1HB GLU 72 2HB GLU 72 -8.361 -3.372 -6.315
549 2HB GLU 72 3HB GLU 72 -8.580 -5.089 -6.483
550 1HG GLU 72 2HG GLU 72 -10.632 -4.520 -7.995
551 2HG GLU 72 3HG GLU 72 -9.998 -2.871 -8.002
552 H SER 73 H SER 73 -11.133 -6.028 -6.681
553 HA SER 73 HA SER 73 -10.805 -8.134 -4.602
554 1HB SER 73 2HB SER 73 -12.092 -8.348 -7.350
555 2HB SER 73 3HB SER 73 -12.232 -9.465 -5.979
556 HG SER 73 HG SER 73 -13.146 -7.523 -4.853
557 H GLY 74 H GLY 74 -9.343 -6.860 -7.609
558 1HA GLY 74 1HA GLY 74 -8.009 -9.484 -8.159
559 2HA GLY 74 2HA GLY 74 -8.494 -8.260 -9.335
560 H ALA 75 H ALA 75 -7.239 -6.889 -6.453
561 HA ALA 75 HA ALA 75 -5.062 -5.725 -7.914
562 1HB ALA 75 1HB ALA 75 -5.590 -5.723 -4.914
563 2HB ALA 75 2HB ALA 75 -4.506 -4.659 -5.852
564 3HB ALA 75 3HB ALA 75 -6.261 -4.549 -6.082
565 H ARG 76 H ARG 76 -2.815 -5.783 -7.245
566 HA ARG 76 HA ARG 76 -2.050 -8.402 -7.783
567 1HB ARG 76 2HB ARG 76 -1.053 -6.039 -8.487
568 2HB ARG 76 3HB ARG 76 -0.059 -6.245 -7.046
569 1HG ARG 76 2HG ARG 76 1.313 -7.459 -8.331
570 2HG ARG 76 3HG ARG 76 0.161 -8.743 -8.196
571 1HD ARG 76 2HD ARG 76 0.119 -8.751 -10.440
572 2HD ARG 76 3HD ARG 76 -1.088 -7.493 -10.262
573 HE ARG 76 HE ARG 76 1.863 -7.156 -10.802
574 1HH1 ARG 76 2HH2 ARG 76 -1.283 -5.414 -10.884
575 2HH1 ARG 76 1HH2 ARG 76 -0.458 -4.014 -11.584
576 1HH2 ARG 76 2HH1 ARG 76 2.702 -5.430 -11.567
577 2HH2 ARG 76 1HH1 ARG 76 1.715 -4.005 -12.002
578 H GLU 77 H GLU 77 -2.913 -8.002 -4.823
579 HA GLU 77 HA GLU 77 -0.635 -8.095 -3.182
580 1HB GLU 77 2HB GLU 77 -3.402 -9.264 -2.690
581 2HB GLU 77 3HB GLU 77 -2.144 -8.966 -1.477
582 1HG GLU 77 2HG GLU 77 -3.358 -6.761 -3.223
583 2HG GLU 77 3HG GLU 77 -3.777 -7.085 -1.542
584 H LEU 78 H LEU 78 -2.404 -10.597 -4.762
585 HA LEU 78 HA LEU 78 -1.225 -12.896 -3.744
586 1HB LEU 78 2HB LEU 78 -1.753 -12.740 -6.711
587 2HB LEU 78 3HB LEU 78 -1.961 -14.075 -5.587
588 HG LEU 78 HG LEU 78 -4.114 -13.542 -6.034
589 1HD1 LEU 78 1HD1 LEU 78 -3.743 -13.345 -3.553
590 2HD1 LEU 78 2HD1 LEU 78 -3.875 -11.582 -3.733
591 3HD1 LEU 78 3HD1 LEU 78 -5.221 -12.612 -4.199
592 1HD2 LEU 78 1HD2 LEU 78 -4.034 -11.823 -7.530
593 2HD2 LEU 78 2HD2 LEU 78 -4.923 -11.074 -6.197
594 3HD2 LEU 78 3HD2 LEU 78 -3.199 -10.701 -6.464
595 H THR 79 H THR 79 0.270 -10.566 -6.059
596 HA THR 79 HA THR 79 2.367 -12.476 -6.760
597 HB THR 79 HB THR 79 2.312 -9.496 -7.316
598 HG1 THR 79 1HG THR 79 1.989 -10.745 -9.440
599 1HG2 THR 79 1HG2 THR 79 3.974 -10.199 -9.082
600 2HG2 THR 79 2HG2 THR 79 4.582 -10.549 -7.465
601 3HG2 THR 79 3HG2 THR 79 3.918 -11.851 -8.460
602 H GLU 80 H GLU 80 3.622 -13.037 -5.202
603 HA GLU 80 HA GLU 80 4.132 -11.643 -2.824
604 1HB GLU 80 2HB GLU 80 5.922 -13.166 -2.361
605 2HB GLU 80 3HB GLU 80 4.512 -14.024 -2.977
606 1HG GLU 80 2HG GLU 80 5.588 -14.380 -5.140
607 2HG GLU 80 3HG GLU 80 6.965 -13.355 -4.681
608 H SER 81 H SER 81 6.023 -11.608 -5.842
609 HA SER 81 HA SER 81 8.203 -10.088 -4.868
610 1HB SER 81 2HB SER 81 7.092 -10.404 -7.668
611 2HB SER 81 3HB SER 81 8.612 -9.579 -7.296
612 HG SER 81 HG SER 81 7.933 -12.299 -6.851
613 H GLU 82 H GLU 82 5.274 -8.844 -6.669
614 HA GLU 82 HA GLU 82 6.002 -6.116 -6.384
615 1HB GLU 82 2HB GLU 82 3.179 -7.288 -6.532
616 2HB GLU 82 3HB GLU 82 3.680 -5.609 -6.778
617 1HG GLU 82 2HG GLU 82 5.338 -6.612 -8.539
618 2HG GLU 82 3HG GLU 82 4.274 -8.040 -8.499
619 H THR 83 H THR 83 3.963 -8.242 -4.316
620 HA THR 83 HA THR 83 3.322 -6.416 -2.414
621 HB THR 83 HB THR 83 3.649 -9.364 -2.479
622 HG1 THR 83 1HG THR 83 1.753 -8.184 -0.936
623 1HG2 THR 83 1HG2 THR 83 3.221 -9.652 -0.035
624 2HG2 THR 83 2HG2 THR 83 4.880 -9.199 -0.405
625 3HG2 THR 83 3HG2 THR 83 3.755 -7.979 0.217
626 H LYS 84 H LYS 84 6.273 -8.420 -2.622
627 HA LYS 84 HA LYS 84 7.574 -7.449 -0.294
628 1HB LYS 84 2HB LYS 84 8.499 -9.027 -2.700
629 2HB LYS 84 3HB LYS 84 9.615 -8.545 -1.416
630 1HG LYS 84 2HG LYS 84 8.435 -9.723 0.267
631 2HG LYS 84 3HG LYS 84 7.022 -9.980 -0.764
632 1HD LYS 84 2HD LYS 84 8.305 -11.477 -2.227
633 2HD LYS 84 3HD LYS 84 9.760 -11.219 -1.239
634 1HE LYS 84 2HE LYS 84 8.588 -12.169 0.748
635 2HE LYS 84 3HE LYS 84 7.106 -12.361 -0.195
636 1HZ LYS 84 1HZ LYS 84 8.238 -13.964 -1.584
637 2HZ LYS 84 2HZ LYS 84 9.631 -13.782 -0.748
638 3HZ LYS 84 3HZ LYS 84 8.292 -14.411 -0.024
639 H SER 85 H SER 85 7.545 -6.245 -3.635
640 HA SER 85 HA SER 85 9.682 -4.394 -3.365
641 1HB SER 85 2HB SER 85 8.303 -5.055 -5.464
642 2HB SER 85 3HB SER 85 7.156 -3.801 -4.952
643 HG SER 85 HG SER 85 8.771 -3.029 -6.382
644 H LEU 86 H LEU 86 6.170 -4.119 -2.581
645 HA LEU 86 HA LEU 86 6.465 -1.466 -1.436
646 1HB LEU 86 2HB LEU 86 4.285 -3.501 -1.570
647 2HB LEU 86 3HB LEU 86 4.239 -2.400 -0.195
648 HG LEU 86 HG LEU 86 2.943 -1.628 -2.184
649 1HD1 LEU 86 1HD1 LEU 86 5.158 0.288 -1.340
650 2HD1 LEU 86 2HD1 LEU 86 3.572 0.698 -2.004
651 3HD1 LEU 86 3HD1 LEU 86 3.689 -0.080 -0.421
652 1HD2 LEU 86 1HD2 LEU 86 5.701 -1.350 -3.488
653 2HD2 LEU 86 2HD2 LEU 86 4.321 -2.319 -4.030
654 3HD2 LEU 86 3HD2 LEU 86 4.268 -0.548 -4.065
655 H MET 87 H MET 87 6.257 -4.708 0.129
656 HA MET 87 HA MET 87 6.824 -3.951 2.682
657 1HB MET 87 2HB MET 87 6.632 -6.335 1.753
658 2HB MET 87 3HB MET 87 8.361 -6.220 1.383
659 1HG MET 87 2HG MET 87 8.702 -5.611 3.868
660 2HG MET 87 3HG MET 87 7.037 -6.151 4.099
661 1HE MET 87 1HE MET 87 7.318 -9.922 3.051
662 2HE MET 87 2HE MET 87 6.241 -8.548 3.440
663 3HE MET 87 3HE MET 87 7.073 -8.615 1.874
664 H ALA 88 H ALA 88 9.263 -4.387 0.128
665 HA ALA 88 HA ALA 88 11.582 -4.218 1.582
666 1HB ALA 88 1HB ALA 88 11.042 -3.378 -1.302
667 2HB ALA 88 2HB ALA 88 12.659 -3.611 -0.602
668 3HB ALA 88 3HB ALA 88 11.535 -4.975 -0.727
669 H ALA 89 H ALA 89 9.835 -1.474 0.062
670 HA ALA 89 HA ALA 89 11.821 0.432 1.163
671 1HB ALA 89 1HB ALA 89 9.309 0.874 -0.449
672 2HB ALA 89 2HB ALA 89 10.476 2.131 0.017
673 3HB ALA 89 3HB ALA 89 10.990 0.825 -1.062
674 H ALA 90 H ALA 90 8.380 -0.509 1.743
675 HA ALA 90 HA ALA 90 7.802 1.597 3.631
676 1HB ALA 90 1HB ALA 90 6.064 0.154 2.594
677 2HB ALA 90 2HB ALA 90 6.751 -1.256 3.446
678 3HB ALA 90 3HB ALA 90 6.021 0.068 4.376
679 H ASP 91 H ASP 91 9.330 -1.630 4.019
680 HA ASP 91 HA ASP 91 9.438 -1.388 6.873
681 1HB ASP 91 2HB ASP 91 9.712 -3.612 5.916
682 2HB ASP 91 3HB ASP 91 11.086 -3.057 4.935
683 H ASN 92 H ASN 92 10.597 0.175 7.885
684 HA ASN 92 HA ASN 92 12.882 1.440 6.398
685 1HB ASN 92 2HB ASN 92 11.410 2.385 8.869
686 2HB ASN 92 3HB ASN 92 12.719 3.235 8.032
687 1HD2 ASN 92 1HD2 ASN 92 9.462 3.327 8.356
688 2HD2 ASN 92 2HD2 ASN 92 8.957 3.790 6.746
689 H ASP 93 H ASP 93 12.593 -1.244 8.297
690 HA ASP 93 HA ASP 93 14.937 -0.608 10.032
691 1HB ASP 93 2HB ASP 93 13.133 -3.053 9.990
692 2HB ASP 93 3HB ASP 93 14.454 -2.736 11.109
693 H GLY 94 H GLY 94 13.766 -3.167 7.746
694 1HA GLY 94 1HA GLY 94 15.197 -4.536 6.386
695 2HA GLY 94 2HA GLY 94 16.564 -4.180 7.453
696 H ASP 95 H ASP 95 13.151 -5.085 7.949
697 HA ASP 95 HA ASP 95 13.902 -7.595 9.301
698 1HB ASP 95 2HB ASP 95 12.529 -7.299 11.164
699 2HB ASP 95 3HB ASP 95 13.663 -5.955 11.118
700 H GLY 96 H GLY 96 11.160 -5.584 8.258
701 1HA GLY 96 1HA GLY 96 10.208 -6.388 6.071
702 2HA GLY 96 2HA GLY 96 10.004 -7.983 6.808
703 H LYS 97 H LYS 97 9.062 -7.327 9.345
704 HA LYS 97 HA LYS 97 6.334 -6.656 8.962
705 1HB LYS 97 2HB LYS 97 6.173 -6.564 11.379
706 2HB LYS 97 3HB LYS 97 7.161 -7.941 10.879
707 1HG LYS 97 2HG LYS 97 9.196 -6.519 11.303
708 2HG LYS 97 3HG LYS 97 8.160 -5.287 12.013
709 1HD LYS 97 2HD LYS 97 8.474 -6.344 13.985
710 2HD LYS 97 3HD LYS 97 7.313 -7.527 13.381
711 1HE LYS 97 2HE LYS 97 9.184 -8.843 14.056
712 2HE LYS 97 3HE LYS 97 9.346 -8.729 12.299
713 1HZ LYS 97 1HZ LYS 97 10.856 -6.780 12.778
714 2HZ LYS 97 2HZ LYS 97 10.842 -7.209 14.343
715 3HZ LYS 97 3HZ LYS 97 11.449 -8.249 13.218
716 H ILE 98 H ILE 98 5.224 -4.749 9.008
717 HA ILE 98 HA ILE 98 6.791 -2.200 9.099
718 HB ILE 98 HB ILE 98 4.728 -3.269 7.180
719 1HG1 ILE 98 2HG1 ILE 98 7.251 -1.856 6.390
720 2HG1 ILE 98 3HG1 ILE 98 7.483 -3.430 7.121
721 1HG2 ILE 98 1HG2 ILE 98 5.774 -0.406 7.357
722 2HG2 ILE 98 2HG2 ILE 98 4.806 -1.092 6.055
723 3HG2 ILE 98 3HG2 ILE 98 4.106 -0.922 7.675
724 1HD1 ILE 98 1HD1 ILE 98 5.730 -2.881 4.703
725 2HD1 ILE 98 2HD1 ILE 98 7.352 -3.630 4.749
726 3HD1 ILE 98 3HD1 ILE 98 5.963 -4.462 5.484
727 H GLY 99 H GLY 99 6.170 -1.067 10.835
728 1HA GLY 99 1HA GLY 99 3.539 -1.363 12.061
729 2HA GLY 99 2HA GLY 99 4.752 -0.136 12.426
730 H ALA 100 H ALA 100 1.961 0.434 12.182
731 HA ALA 100 HA ALA 100 1.272 1.599 9.647
732 1HB ALA 100 1HB ALA 100 -0.407 1.238 11.389
733 2HB ALA 100 2HB ALA 100 0.424 2.396 12.460
734 3HB ALA 100 3HB ALA 100 -0.314 2.954 10.941
735 H GLU 101 H GLU 101 3.148 2.713 12.478
736 HA GLU 101 HA GLU 101 3.840 5.278 11.689
737 1HB GLU 101 2HB GLU 101 5.952 4.857 12.956
738 2HB GLU 101 3HB GLU 101 4.432 4.576 13.804
739 1HG GLU 101 2HG GLU 101 5.048 2.066 12.678
740 2HG GLU 101 3HG GLU 101 6.598 2.703 13.228
741 H GLU 102 H GLU 102 5.977 2.442 11.044
742 HA GLU 102 HA GLU 102 7.657 3.500 9.226
743 1HB GLU 102 2HB GLU 102 6.395 0.728 9.111
744 2HB GLU 102 3HB GLU 102 7.838 1.221 8.216
745 1HG GLU 102 2HG GLU 102 8.949 1.709 10.430
746 2HG GLU 102 3HG GLU 102 7.560 0.965 11.239
747 H PHE 103 H PHE 103 4.437 2.168 8.421
748 HA PHE 103 HA PHE 103 4.743 2.655 5.616
749 1HB PHE 103 2HB PHE 103 2.676 1.626 7.421
750 2HB PHE 103 3HB PHE 103 1.965 2.635 6.206
751 HD1 PHE 103 1HD PHE 103 3.689 2.011 3.776
752 HD2 PHE 103 2HD PHE 103 1.921 -0.516 6.789
753 HE1 PHE 103 1HE PHE 103 3.538 0.159 2.150
754 HE2 PHE 103 2HE PHE 103 1.785 -2.366 5.153
755 HZ PHE 103 HZ PHE 103 2.563 -2.025 2.823
756 H GLN 104 H GLN 104 3.074 4.576 8.147
757 HA GLN 104 HA GLN 104 2.158 6.701 6.393
758 1HB GLN 104 2HB GLN 104 1.198 6.148 8.584
759 2HB GLN 104 3HB GLN 104 2.668 6.691 9.395
760 1HG GLN 104 2HG GLN 104 1.377 8.635 7.479
761 2HG GLN 104 3HG GLN 104 0.442 8.222 8.910
762 1HE2 GLN 104 1HE2 GLN 104 2.338 10.636 7.881
763 2HE2 GLN 104 2HE2 GLN 104 3.079 11.079 9.403
764 H GLU 105 H GLU 105 5.234 6.112 8.152
765 HA GLU 105 HA GLU 105 6.475 8.617 7.555
766 1HB GLU 105 2HB GLU 105 7.534 5.783 7.931
767 2HB GLU 105 3HB GLU 105 8.599 7.146 7.650
768 1HG GLU 105 2HG GLU 105 8.042 8.205 9.668
769 2HG GLU 105 3HG GLU 105 6.526 7.313 9.854
770 H MET 106 H MET 106 6.640 5.451 5.829
771 HA MET 106 HA MET 106 8.249 6.337 3.743
772 1HB MET 106 2HB MET 106 7.719 3.966 4.253
773 2HB MET 106 3HB MET 106 6.078 4.201 3.638
774 1HG MET 106 2HG MET 106 7.346 3.105 1.971
775 2HG MET 106 3HG MET 106 7.056 4.720 1.360
776 1HE MET 106 1HE MET 106 10.574 6.075 0.790
777 2HE MET 106 2HE MET 106 8.891 6.013 0.219
778 3HE MET 106 3HE MET 106 9.274 6.689 1.819
779 H VAL 107 H VAL 107 4.704 6.267 3.998
780 HA VAL 107 HA VAL 107 4.260 7.430 1.389
781 HB VAL 107 HB VAL 107 2.515 6.930 3.822
782 1HG1 VAL 107 1HG1 VAL 107 0.587 7.484 2.386
783 2HG1 VAL 107 2HG1 VAL 107 1.566 8.910 2.718
784 3HG1 VAL 107 3HG1 VAL 107 1.699 8.099 1.145
785 1HG2 VAL 107 1HG2 VAL 107 2.746 5.739 1.016
786 2HG2 VAL 107 2HG2 VAL 107 3.200 4.957 2.542
787 3HG2 VAL 107 3HG2 VAL 107 1.490 5.309 2.181
788 H HIS 108 H HIS 108 3.764 8.880 4.701
789 HA HIS 108 HA HIS 108 2.937 11.288 3.570
790 1HB HIS 108 2HB HIS 108 2.628 10.500 5.927
791 2HB HIS 108 3HB HIS 108 4.280 11.029 6.287
792 HD1 HIS 108 1HD HIS 108 1.473 12.902 4.330
793 HD2 HIS 108 2HD HIS 108 3.952 13.209 7.722
794 HE1 HIS 108 1HE HIS 108 1.010 15.186 5.375
795 H SER 109 H SER 109 6.115 10.105 4.463
796 HA SER 109 HA SER 109 8.175 10.741 4.132
797 1HB SER 109 2HB SER 109 8.712 11.535 1.854
798 2HB SER 109 3HB SER 109 7.555 10.189 1.891
799 HG SER 109 HG SER 109 6.267 12.558 1.931
Start of MODEL 6
1 1H MET 1 H1 MET 1 -16.154 0.079 2.544
2 2H MET 1 H2 MET 1 -17.062 -0.009 1.149
3 3H MET 1 H3 MET 1 -15.460 0.428 1.098
4 HA MET 1 HA MET 1 -16.695 2.422 0.914
5 1HB MET 1 2HB MET 1 -18.153 1.310 3.337
6 2HB MET 1 3HB MET 1 -18.235 3.009 2.858
7 1HG MET 1 2HG MET 1 -20.175 1.830 1.983
8 2HG MET 1 3HG MET 1 -19.156 2.433 0.683
9 1HE MET 1 1HE MET 1 -18.572 1.084 -1.316
10 2HE MET 1 2HE MET 1 -19.412 -0.458 -1.581
11 3HE MET 1 3HE MET 1 -20.343 0.991 -1.141
12 H SER 2 H SER 2 -15.527 4.164 1.696
13 HA SER 2 HA SER 2 -14.568 5.192 3.792
14 1HB SER 2 2HB SER 2 -12.819 2.691 3.585
15 2HB SER 2 3HB SER 2 -12.282 4.210 4.326
16 HG SER 2 HG SER 2 -14.528 2.684 5.096
17 H ILE 3 H ILE 3 -12.242 3.485 1.648
18 HA ILE 3 HA ILE 3 -11.221 6.108 0.937
19 HB ILE 3 HB ILE 3 -9.332 5.076 0.177
20 1HG1 ILE 3 2HG1 ILE 3 -10.297 2.239 0.273
21 2HG1 ILE 3 3HG1 ILE 3 -10.441 3.195 -1.213
22 1HG2 ILE 3 1HG2 ILE 3 -10.296 3.241 2.414
23 2HG2 ILE 3 2HG2 ILE 3 -8.655 3.833 2.142
24 3HG2 ILE 3 3HG2 ILE 3 -9.924 4.956 2.655
25 1HD1 ILE 3 1HD1 ILE 3 -8.083 3.712 -1.249
26 2HD1 ILE 3 2HD1 ILE 3 -7.814 2.936 0.323
27 3HD1 ILE 3 3HD1 ILE 3 -8.250 1.968 -1.072
28 H THR 4 H THR 4 -13.270 3.750 -0.664
29 HA THR 4 HA THR 4 -12.851 4.232 -3.247
30 HB THR 4 HB THR 4 -14.151 2.424 -2.109
31 HG1 THR 4 1HG THR 4 -14.609 3.781 -4.218
32 1HG2 THR 4 1HG2 THR 4 -15.483 3.875 -0.506
33 2HG2 THR 4 2HG2 THR 4 -16.431 4.445 -1.896
34 3HG2 THR 4 3HG2 THR 4 -16.459 2.733 -1.463
35 H ASP 5 H ASP 5 -14.668 6.235 -0.936
36 HA ASP 5 HA ASP 5 -15.468 8.035 -3.163
37 1HB ASP 5 2HB ASP 5 -17.322 6.869 -1.959
38 2HB ASP 5 3HB ASP 5 -16.796 7.647 -0.451
39 H VAL 6 H VAL 6 -12.911 8.131 -2.187
40 HA VAL 6 HA VAL 6 -12.855 10.812 -0.810
41 HB VAL 6 HB VAL 6 -10.879 8.497 -0.699
42 1HG1 VAL 6 1HG1 VAL 6 -9.553 10.552 -0.831
43 2HG1 VAL 6 2HG1 VAL 6 -10.574 11.318 0.406
44 3HG1 VAL 6 3HG1 VAL 6 -9.544 9.931 0.820
45 1HG2 VAL 6 1HG2 VAL 6 -12.893 8.410 0.801
46 2HG2 VAL 6 2HG2 VAL 6 -11.368 8.537 1.693
47 3HG2 VAL 6 3HG2 VAL 6 -12.412 9.962 1.495
48 H LEU 7 H LEU 7 -10.829 8.803 -2.940
49 HA LEU 7 HA LEU 7 -10.620 10.741 -5.069
50 1HB LEU 7 2HB LEU 7 -9.246 11.965 -3.418
51 2HB LEU 7 3HB LEU 7 -8.348 10.503 -3.045
52 HG LEU 7 HG LEU 7 -7.977 10.777 -5.828
53 1HD1 LEU 7 1HD1 LEU 7 -7.771 13.522 -4.535
54 2HD1 LEU 7 2HD1 LEU 7 -7.232 13.067 -6.164
55 3HD1 LEU 7 3HD1 LEU 7 -8.960 13.037 -5.767
56 1HD2 LEU 7 1HD2 LEU 7 -6.189 11.771 -3.575
57 2HD2 LEU 7 2HD2 LEU 7 -6.297 10.091 -4.145
58 3HD2 LEU 7 3HD2 LEU 7 -5.686 11.353 -5.225
59 H SER 8 H SER 8 -8.767 8.352 -3.203
60 HA SER 8 HA SER 8 -7.142 7.122 -4.669
61 1HB SER 8 2HB SER 8 -9.065 5.530 -2.980
62 2HB SER 8 3HB SER 8 -7.315 5.292 -3.228
63 HG SER 8 HG SER 8 -7.624 6.422 -1.286
64 H ALA 9 H ALA 9 -10.560 6.680 -5.401
65 HA ALA 9 HA ALA 9 -10.504 4.273 -6.927
66 1HB ALA 9 1HB ALA 9 -12.143 6.815 -7.303
67 2HB ALA 9 2HB ALA 9 -12.502 5.223 -8.009
68 3HB ALA 9 3HB ALA 9 -12.578 5.453 -6.250
69 H ASP 10 H ASP 10 -9.798 7.678 -7.858
70 HA ASP 10 HA ASP 10 -9.390 7.040 -10.653
71 1HB ASP 10 2HB ASP 10 -9.892 9.321 -9.707
72 2HB ASP 10 3HB ASP 10 -8.252 9.359 -9.031
73 H ASP 11 H ASP 11 -7.317 7.284 -7.764
74 HA ASP 11 HA ASP 11 -4.848 7.164 -9.107
75 1HB ASP 11 2HB ASP 11 -5.412 6.390 -6.217
76 2HB ASP 11 3HB ASP 11 -3.928 7.031 -6.946
77 H ILE 12 H ILE 12 -6.878 4.592 -7.502
78 HA ILE 12 HA ILE 12 -5.046 2.536 -8.095
79 HB ILE 12 HB ILE 12 -6.781 1.033 -7.834
80 1HG1 ILE 12 2HG1 ILE 12 -8.775 3.095 -7.090
81 2HG1 ILE 12 3HG1 ILE 12 -8.706 2.424 -8.725
82 1HG2 ILE 12 1HG2 ILE 12 -7.060 1.284 -5.445
83 2HG2 ILE 12 2HG2 ILE 12 -5.486 1.927 -5.909
84 3HG2 ILE 12 3HG2 ILE 12 -6.817 3.040 -5.563
85 1HD1 ILE 12 1HD1 ILE 12 -9.128 0.740 -6.237
86 2HD1 ILE 12 2HD1 ILE 12 -10.372 1.249 -7.392
87 3HD1 ILE 12 3HD1 ILE 12 -9.063 0.173 -7.916
88 H ALA 13 H ALA 13 -7.655 4.013 -10.061
89 HA ALA 13 HA ALA 13 -7.540 2.110 -12.176
90 1HB ALA 13 1HB ALA 13 -8.549 3.777 -13.578
91 2HB ALA 13 2HB ALA 13 -9.280 3.885 -11.964
92 3HB ALA 13 3HB ALA 13 -8.085 5.090 -12.491
93 H ALA 14 H ALA 14 -5.603 5.092 -11.597
94 HA ALA 14 HA ALA 14 -3.895 4.793 -13.870
95 1HB ALA 14 1HB ALA 14 -3.202 5.987 -11.150
96 2HB ALA 14 2HB ALA 14 -2.325 6.225 -12.668
97 3HB ALA 14 3HB ALA 14 -3.982 6.841 -12.494
98 H ALA 15 H ALA 15 -3.401 3.703 -10.486
99 HA ALA 15 HA ALA 15 -0.912 2.492 -10.785
100 1HB ALA 15 1HB ALA 15 -2.186 2.972 -8.610
101 2HB ALA 15 2HB ALA 15 -3.115 1.495 -8.930
102 3HB ALA 15 3HB ALA 15 -1.360 1.411 -8.700
103 H LEU 16 H LEU 16 -4.120 1.090 -11.217
104 HA LEU 16 HA LEU 16 -3.505 -1.587 -11.668
105 1HB LEU 16 2HB LEU 16 -5.729 -0.957 -11.371
106 2HB LEU 16 3HB LEU 16 -5.701 0.260 -12.639
107 HG LEU 16 HG LEU 16 -5.273 -2.597 -13.486
108 1HD1 LEU 16 1HD1 LEU 16 -7.132 -2.803 -11.915
109 2HD1 LEU 16 2HD1 LEU 16 -7.967 -1.431 -12.680
110 3HD1 LEU 16 3HD1 LEU 16 -7.723 -2.946 -13.578
111 1HD2 LEU 16 1HD2 LEU 16 -5.260 -0.724 -15.181
112 2HD2 LEU 16 2HD2 LEU 16 -6.625 -1.813 -15.425
113 3HD2 LEU 16 3HD2 LEU 16 -6.873 -0.246 -14.635
114 H GLN 17 H GLN 17 -3.211 1.200 -13.888
115 HA GLN 17 HA GLN 17 -2.581 -0.635 -16.111
116 1HB GLN 17 2HB GLN 17 -4.105 1.367 -16.322
117 2HB GLN 17 3HB GLN 17 -2.659 2.388 -16.232
118 1HG GLN 17 2HG GLN 17 -1.714 1.297 -18.213
119 2HG GLN 17 3HG GLN 17 -2.998 0.080 -18.219
120 1HE2 GLN 17 1HE2 GLN 17 -5.340 1.090 -18.260
121 2HE2 GLN 17 2HE2 GLN 17 -5.524 2.343 -19.476
122 H GLU 18 H GLU 18 -0.994 1.892 -14.106
123 HA GLU 18 HA GLU 18 1.433 1.774 -15.626
124 1HB GLU 18 2HB GLU 18 2.123 3.511 -14.416
125 2HB GLU 18 3HB GLU 18 0.414 3.616 -14.059
126 1HG GLU 18 2HG GLU 18 1.192 3.900 -11.969
127 2HG GLU 18 3HG GLU 18 1.090 2.141 -11.915
128 H CYS 19 H CYS 19 0.296 0.043 -12.776
129 HA CYS 19 HA CYS 19 2.772 -1.631 -12.741
130 1HB CYS 19 2HB CYS 19 2.090 -0.413 -10.608
131 2HB CYS 19 3HB CYS 19 0.624 -1.425 -10.599
132 HG CYS 19 HG CYS 19 3.808 -2.210 -10.540
133 H ARG 20 H ARG 20 1.271 -2.106 -14.878
134 HA ARG 20 HA ARG 20 -0.666 -4.281 -14.298
135 1HB ARG 20 2HB ARG 20 -1.187 -2.523 -15.865
136 2HB ARG 20 3HB ARG 20 0.182 -2.941 -16.899
137 1HG ARG 20 2HG ARG 20 -0.855 -4.839 -17.719
138 2HG ARG 20 3HG ARG 20 -1.792 -5.128 -16.247
139 1HD ARG 20 2HD ARG 20 -3.476 -3.681 -16.771
140 2HD ARG 20 3HD ARG 20 -2.472 -2.584 -17.694
141 HE ARG 20 HE ARG 20 -3.960 -4.859 -18.693
142 1HH1 ARG 20 2HH2 ARG 20 -1.055 -2.957 -19.220
143 2HH1 ARG 20 1HH2 ARG 20 -1.096 -3.008 -20.954
144 1HH2 ARG 20 2HH1 ARG 20 -4.066 -5.008 -21.020
145 2HH2 ARG 20 1HH1 ARG 20 -2.850 -4.253 -22.000
146 H ASP 21 H ASP 21 2.381 -3.691 -16.102
147 HA ASP 21 HA ASP 21 2.935 -6.303 -16.866
148 1HB ASP 21 2HB ASP 21 4.940 -4.142 -16.157
149 2HB ASP 21 3HB ASP 21 5.144 -5.405 -17.371
150 HA PRO 22 HA PRO 22 4.046 -8.200 -13.084
151 1HB PRO 22 2HB PRO 22 5.918 -10.100 -13.746
152 2HB PRO 22 3HB PRO 22 4.198 -10.207 -14.227
153 1HG PRO 22 2HG PRO 22 6.505 -9.114 -15.863
154 2HG PRO 22 3HG PRO 22 5.287 -10.320 -16.375
155 1HD PRO 22 2HD PRO 22 5.022 -7.695 -17.005
156 2HD PRO 22 3HD PRO 22 3.586 -8.640 -16.509
157 H ASP 23 H ASP 23 5.296 -7.812 -11.371
158 HA ASP 23 HA ASP 23 6.916 -7.196 -10.034
159 1HB ASP 23 2HB ASP 23 8.729 -8.179 -12.250
160 2HB ASP 23 3HB ASP 23 9.272 -7.743 -10.633
161 H THR 24 H THR 24 5.805 -5.163 -11.938
162 HA THR 24 HA THR 24 7.996 -3.207 -12.263
163 HB THR 24 HB THR 24 5.115 -3.387 -13.188
164 HG1 THR 24 1HG THR 24 6.379 -3.172 -15.183
165 1HG2 THR 24 1HG2 THR 24 5.373 -1.005 -12.727
166 2HG2 THR 24 2HG2 THR 24 6.968 -0.992 -13.516
167 3HG2 THR 24 3HG2 THR 24 5.492 -1.286 -14.460
168 H PHE 25 H PHE 25 5.727 -4.031 -9.846
169 HA PHE 25 HA PHE 25 4.953 -1.555 -8.803
170 1HB PHE 25 2HB PHE 25 4.300 -3.935 -8.161
171 2HB PHE 25 3HB PHE 25 5.737 -3.972 -7.148
172 HD1 PHE 25 1HD PHE 25 5.925 -1.795 -5.460
173 HD2 PHE 25 2HD PHE 25 2.279 -3.374 -7.171
174 HE1 PHE 25 1HE PHE 25 4.597 -0.511 -3.841
175 HE2 PHE 25 2HE PHE 25 0.989 -2.317 -5.342
176 HZ PHE 25 HZ PHE 25 2.118 -0.839 -3.721
177 H GLU 26 H GLU 26 6.113 0.114 -8.107
178 HA GLU 26 HA GLU 26 8.621 -0.316 -6.556
179 1HB GLU 26 2HB GLU 26 8.053 1.568 -8.811
180 2HB GLU 26 3HB GLU 26 8.691 2.333 -7.358
181 1HG GLU 26 2HG GLU 26 10.535 0.461 -7.458
182 2HG GLU 26 3HG GLU 26 10.046 0.372 -9.159
183 HA PRO 27 HA PRO 27 6.486 1.523 -3.240
184 1HB PRO 27 2HB PRO 27 8.433 2.853 -1.818
185 2HB PRO 27 3HB PRO 27 8.282 1.084 -1.986
186 1HG PRO 27 2HG PRO 27 10.098 2.919 -3.605
187 2HG PRO 27 3HG PRO 27 10.533 1.408 -2.787
188 1HD PRO 27 2HD PRO 27 9.938 1.475 -5.414
189 2HD PRO 27 3HD PRO 27 9.447 0.090 -4.394
190 H GLN 28 H GLN 28 8.728 4.284 -3.678
191 HA GLN 28 HA GLN 28 6.880 6.285 -3.192
192 1HB GLN 28 2HB GLN 28 9.409 6.278 -4.862
193 2HB GLN 28 3HB GLN 28 8.523 7.759 -4.461
194 1HG GLN 28 2HG GLN 28 8.867 7.481 -2.108
195 2HG GLN 28 3HG GLN 28 9.416 5.814 -2.294
196 1HE2 GLN 28 1HE2 GLN 28 10.416 9.191 -2.466
197 2HE2 GLN 28 2HE2 GLN 28 12.110 8.828 -2.745
198 H LYS 29 H LYS 29 7.786 4.952 -6.331
199 HA LYS 29 HA LYS 29 6.160 6.206 -8.179
200 1HB LYS 29 2HB LYS 29 7.754 4.286 -8.539
201 2HB LYS 29 3HB LYS 29 6.603 3.235 -7.743
202 1HG LYS 29 2HG LYS 29 6.128 2.717 -9.857
203 2HG LYS 29 3HG LYS 29 4.912 3.940 -9.643
204 1HD LYS 29 2HD LYS 29 7.645 4.807 -10.668
205 2HD LYS 29 3HD LYS 29 6.693 3.728 -11.679
206 1HE LYS 29 2HE LYS 29 4.831 5.722 -10.956
207 2HE LYS 29 3HE LYS 29 6.342 6.615 -11.206
208 1HZ LYS 29 1HZ LYS 29 5.013 4.737 -13.032
209 2HZ LYS 29 2HZ LYS 29 5.079 6.356 -13.240
210 3HZ LYS 29 3HZ LYS 29 6.460 5.451 -13.384
211 H PHE 30 H PHE 30 5.144 3.256 -6.292
212 HA PHE 30 HA PHE 30 2.454 3.518 -7.164
213 1HB PHE 30 2HB PHE 30 3.635 1.419 -6.485
214 2HB PHE 30 3HB PHE 30 3.474 1.914 -4.803
215 HD1 PHE 30 1HD PHE 30 1.899 0.446 -7.743
216 HD2 PHE 30 2HD PHE 30 1.075 2.154 -3.862
217 HE1 PHE 30 1HE PHE 30 -0.315 -0.649 -7.728
218 HE2 PHE 30 2HE PHE 30 -1.206 1.187 -3.935
219 HZ PHE 30 HZ PHE 30 -1.894 -0.238 -5.854
220 H PHE 31 H PHE 31 4.140 4.590 -4.176
221 HA PHE 31 HA PHE 31 1.846 5.264 -2.665
222 1HB PHE 31 2HB PHE 31 4.437 6.829 -2.690
223 2HB PHE 31 3HB PHE 31 3.247 6.718 -1.393
224 HD1 PHE 31 1HD PHE 31 6.130 6.419 -0.956
225 HD2 PHE 31 2HD PHE 31 3.070 3.483 -1.760
226 HE1 PHE 31 1HE PHE 31 7.489 4.696 0.147
227 HE2 PHE 31 2HE PHE 31 4.391 1.797 -0.533
228 HZ PHE 31 HZ PHE 31 6.613 2.378 0.412
229 H GLN 32 H GLN 32 3.649 7.157 -5.155
230 HA GLN 32 HA GLN 32 1.866 9.460 -4.906
231 1HB GLN 32 2HB GLN 32 3.905 8.584 -6.988
232 2HB GLN 32 3HB GLN 32 2.863 10.004 -7.186
233 1HG GLN 32 2HG GLN 32 3.723 10.973 -5.087
234 2HG GLN 32 3HG GLN 32 4.748 9.551 -4.830
235 1HE2 GLN 32 1HE2 GLN 32 4.029 11.819 -7.586
236 2HE2 GLN 32 2HE2 GLN 32 5.723 12.103 -7.952
237 H THR 33 H THR 33 2.145 6.680 -7.218
238 HA THR 33 HA THR 33 0.116 7.670 -8.854
239 HB THR 33 HB THR 33 2.042 5.643 -9.006
240 HG1 THR 33 1HG THR 33 -0.059 6.481 -10.601
241 1HG2 THR 33 1HG2 THR 33 0.985 3.607 -9.610
242 2HG2 THR 33 2HG2 THR 33 0.369 3.996 -7.998
243 3HG2 THR 33 3HG2 THR 33 -0.629 4.326 -9.435
244 H SER 34 H SER 34 -0.055 5.772 -5.952
245 HA SER 34 HA SER 34 -2.876 5.098 -6.319
246 1HB SER 34 2HB SER 34 -1.298 3.452 -5.425
247 2HB SER 34 3HB SER 34 -0.972 4.501 -4.033
248 HG SER 34 HG SER 34 -3.390 4.406 -3.781
249 H GLY 35 H GLY 35 -1.232 7.876 -5.305
250 1HA GLY 35 1HA GLY 35 -2.334 9.834 -4.761
251 2HA GLY 35 2HA GLY 35 -3.732 8.927 -4.160
252 H LEU 36 H LEU 36 -1.271 7.299 -2.835
253 HA LEU 36 HA LEU 36 -2.098 8.087 -0.242
254 1HB LEU 36 2HB LEU 36 0.192 6.301 -1.167
255 2HB LEU 36 3HB LEU 36 -0.498 6.378 0.444
256 HG LEU 36 HG LEU 36 -1.908 5.406 -2.061
257 1HD1 LEU 36 1HD1 LEU 36 -1.161 3.991 0.519
258 2HD1 LEU 36 2HD1 LEU 36 -1.949 3.259 -0.895
259 3HD1 LEU 36 3HD1 LEU 36 -0.279 3.845 -1.018
260 1HD2 LEU 36 1HD2 LEU 36 -3.785 4.795 -0.498
261 2HD2 LEU 36 2HD2 LEU 36 -3.017 5.800 0.748
262 3HD2 LEU 36 3HD2 LEU 36 -3.618 6.528 -0.761
263 H SER 37 H SER 37 0.875 8.829 -2.115
264 HA SER 37 HA SER 37 2.110 10.227 0.121
265 1HB SER 37 2HB SER 37 2.592 10.553 -2.870
266 2HB SER 37 3HB SER 37 3.642 11.134 -1.560
267 HG SER 37 HG SER 37 4.017 9.055 -0.934
268 H LYS 38 H LYS 38 -0.542 11.027 -1.949
269 HA LYS 38 HA LYS 38 -0.064 13.939 -1.764
270 1HB LYS 38 2HB LYS 38 -1.318 12.194 -3.679
271 2HB LYS 38 3HB LYS 38 -2.590 13.178 -2.965
272 1HG LYS 38 2HG LYS 38 -1.186 15.227 -3.451
273 2HG LYS 38 3HG LYS 38 0.025 14.160 -4.197
274 1HD LYS 38 2HD LYS 38 -1.804 13.337 -5.767
275 2HD LYS 38 3HD LYS 38 -2.860 14.597 -5.091
276 1HE LYS 38 2HE LYS 38 -1.157 16.332 -5.787
277 2HE LYS 38 3HE LYS 38 -0.176 15.043 -6.505
278 1HZ LYS 38 1HZ LYS 38 -2.027 14.566 -7.985
279 2HZ LYS 38 2HZ LYS 38 -2.893 15.811 -7.345
280 3HZ LYS 38 3HZ LYS 38 -1.496 16.114 -8.157
281 H MET 39 H MET 39 -2.159 11.291 -0.645
282 HA MET 39 HA MET 39 -3.854 12.874 1.025
283 1HB MET 39 2HB MET 39 -2.934 9.989 1.100
284 2HB MET 39 3HB MET 39 -4.049 10.648 2.287
285 1HG MET 39 2HG MET 39 -4.580 10.686 -0.719
286 2HG MET 39 3HG MET 39 -5.107 9.436 0.403
287 1HE MET 39 1HE MET 39 -5.537 13.497 -0.082
288 2HE MET 39 2HE MET 39 -6.176 12.526 -1.421
289 3HE MET 39 3HE MET 39 -7.281 13.368 -0.321
290 H SER 40 H SER 40 -3.553 13.774 2.932
291 HA SER 40 HA SER 40 -0.852 14.134 3.874
292 1HB SER 40 2HB SER 40 -2.995 15.694 4.066
293 2HB SER 40 3HB SER 40 -3.249 14.829 5.589
294 HG SER 40 HG SER 40 -1.139 15.552 6.205
295 H ALA 41 H ALA 41 -0.060 13.493 6.004
296 HA ALA 41 HA ALA 41 -0.077 10.892 6.714
297 1HB ALA 41 1HB ALA 41 0.569 11.640 9.012
298 2HB ALA 41 2HB ALA 41 1.434 12.498 7.719
299 3HB ALA 41 3HB ALA 41 0.095 13.291 8.584
300 H ASN 42 H ASN 42 -2.460 13.267 7.892
301 HA ASN 42 HA ASN 42 -3.915 11.631 9.685
302 1HB ASN 42 2HB ASN 42 -4.378 14.166 8.212
303 2HB ASN 42 3HB ASN 42 -5.847 13.219 8.409
304 1HD2 ASN 42 1HD2 ASN 42 -2.984 14.175 10.439
305 2HD2 ASN 42 2HD2 ASN 42 -3.978 14.528 11.841
306 H GLN 43 H GLN 43 -4.389 12.018 6.123
307 HA GLN 43 HA GLN 43 -6.634 10.159 6.181
308 1HB GLN 43 2HB GLN 43 -5.187 11.706 4.027
309 2HB GLN 43 3HB GLN 43 -6.132 10.288 3.569
310 1HG GLN 43 2HG GLN 43 -7.192 12.696 5.093
311 2HG GLN 43 3HG GLN 43 -7.483 12.338 3.387
312 1HE2 GLN 43 1HE2 GLN 43 -8.150 9.632 3.343
313 2HE2 GLN 43 2HE2 GLN 43 -9.480 9.304 4.438
314 H VAL 44 H VAL 44 -3.124 9.990 5.392
315 HA VAL 44 HA VAL 44 -3.256 7.291 4.434
316 HB VAL 44 HB VAL 44 -1.012 8.785 5.858
317 1HG1 VAL 44 1HG1 VAL 44 -0.566 6.371 5.983
318 2HG1 VAL 44 2HG1 VAL 44 -0.974 6.185 4.260
319 3HG1 VAL 44 3HG1 VAL 44 0.464 7.102 4.745
320 1HG2 VAL 44 1HG2 VAL 44 -0.159 9.136 3.575
321 2HG2 VAL 44 2HG2 VAL 44 -1.532 8.239 2.895
322 3HG2 VAL 44 3HG2 VAL 44 -1.787 9.801 3.688
323 H LYS 45 H LYS 45 -2.984 8.668 7.740
324 HA LYS 45 HA LYS 45 -2.823 6.175 9.091
325 1HB LYS 45 2HB LYS 45 -2.204 8.375 10.035
326 2HB LYS 45 3HB LYS 45 -3.923 8.793 10.169
327 1HG LYS 45 2HG LYS 45 -4.286 6.894 11.696
328 2HG LYS 45 3HG LYS 45 -2.614 6.349 11.447
329 1HD LYS 45 2HD LYS 45 -1.781 8.498 12.386
330 2HD LYS 45 3HD LYS 45 -3.457 9.008 12.685
331 1HE LYS 45 2HE LYS 45 -3.784 7.087 14.223
332 2HE LYS 45 3HE LYS 45 -2.151 6.499 13.867
333 1HZ LYS 45 1HZ LYS 45 -1.266 8.493 14.852
334 2HZ LYS 45 2HZ LYS 45 -2.779 9.055 15.190
335 3HZ LYS 45 3HZ LYS 45 -2.218 7.696 15.926
336 H ASP 46 H ASP 46 -5.656 8.194 8.105
337 HA ASP 46 HA ASP 46 -7.680 6.555 9.239
338 1HB ASP 46 2HB ASP 46 -8.275 8.700 8.324
339 2HB ASP 46 3HB ASP 46 -7.699 8.248 6.713
340 H VAL 47 H VAL 47 -6.571 6.498 5.805
341 HA VAL 47 HA VAL 47 -7.988 4.192 5.130
342 HB VAL 47 HB VAL 47 -6.614 3.983 3.166
343 1HG1 VAL 47 1HG1 VAL 47 -8.196 6.042 3.557
344 2HG1 VAL 47 2HG1 VAL 47 -6.698 6.967 3.608
345 3HG1 VAL 47 3HG1 VAL 47 -7.093 6.035 2.164
346 1HG2 VAL 47 1HG2 VAL 47 -4.649 5.761 4.464
347 2HG2 VAL 47 2HG2 VAL 47 -4.379 4.098 3.908
348 3HG2 VAL 47 3HG2 VAL 47 -4.652 5.394 2.730
349 H PHE 48 H PHE 48 -4.658 4.414 6.354
350 HA PHE 48 HA PHE 48 -3.765 1.814 6.484
351 1HB PHE 48 2HB PHE 48 -2.350 3.470 7.231
352 2HB PHE 48 3HB PHE 48 -3.550 4.156 8.303
353 HD1 PHE 48 1HD PHE 48 -3.927 3.431 10.526
354 HD2 PHE 48 2HD PHE 48 -1.195 1.308 7.943
355 HE1 PHE 48 1HE PHE 48 -3.021 2.210 12.485
356 HE2 PHE 48 2HE PHE 48 -0.249 0.148 9.928
357 HZ PHE 48 HZ PHE 48 -1.093 0.686 12.181
358 H ARG 49 H ARG 49 -6.279 3.239 8.699
359 HA ARG 49 HA ARG 49 -6.275 1.033 10.511
360 1HB ARG 49 2HB ARG 49 -8.674 2.774 9.811
361 2HB ARG 49 3HB ARG 49 -8.423 1.795 11.259
362 1HG ARG 49 2HG ARG 49 -6.279 3.337 11.591
363 2HG ARG 49 3HG ARG 49 -7.125 4.384 10.438
364 1HD ARG 49 2HD ARG 49 -7.731 5.158 12.578
365 2HD ARG 49 3HD ARG 49 -9.149 4.323 11.902
366 HE ARG 49 HE ARG 49 -7.615 2.449 13.391
367 1HH1 ARG 49 2HH2 ARG 49 -9.643 5.267 13.930
368 2HH1 ARG 49 1HH2 ARG 49 -10.047 4.891 15.577
369 1HH2 ARG 49 2HH1 ARG 49 -8.099 1.894 15.590
370 2HH2 ARG 49 1HH1 ARG 49 -9.145 2.898 16.538
371 H PHE 50 H PHE 50 -7.710 1.428 7.332
372 HA PHE 50 HA PHE 50 -9.607 -0.776 7.664
373 1HB PHE 50 2HB PHE 50 -9.704 1.447 6.198
374 2HB PHE 50 3HB PHE 50 -8.910 0.443 5.002
375 HD1 PHE 50 1HD PHE 50 -12.059 1.452 6.418
376 HD2 PHE 50 2HD PHE 50 -10.083 -1.824 4.475
377 HE1 PHE 50 1HE PHE 50 -14.252 0.461 5.868
378 HE2 PHE 50 2HE PHE 50 -12.296 -2.832 3.902
379 HZ PHE 50 HZ PHE 50 -14.382 -1.700 4.641
380 H ILE 51 H ILE 51 -6.402 -0.181 6.280
381 HA ILE 51 HA ILE 51 -6.001 -2.888 5.227
382 HB ILE 51 HB ILE 51 -4.130 -0.531 5.683
383 1HG1 ILE 51 2HG1 ILE 51 -3.996 -0.812 3.084
384 2HG1 ILE 51 3HG1 ILE 51 -5.477 -1.749 3.225
385 1HG2 ILE 51 1HG2 ILE 51 -2.724 -2.473 5.868
386 2HG2 ILE 51 2HG2 ILE 51 -3.509 -3.242 4.453
387 3HG2 ILE 51 3HG2 ILE 51 -2.497 -1.801 4.273
388 1HD1 ILE 51 1HD1 ILE 51 -6.640 0.267 4.042
389 2HD1 ILE 51 2HD1 ILE 51 -5.080 1.130 4.159
390 3HD1 ILE 51 3HD1 ILE 51 -5.735 0.661 2.584
391 H ASP 52 H ASP 52 -3.910 -4.036 6.313
392 HA ASP 52 HA ASP 52 -3.056 -5.231 8.001
393 1HB ASP 52 2HB ASP 52 -2.582 -3.296 9.319
394 2HB ASP 52 3HB ASP 52 -4.249 -3.146 9.863
395 H ASN 53 H ASN 53 -6.350 -4.212 8.825
396 HA ASN 53 HA ASN 53 -8.280 -5.375 8.920
397 1HB ASN 53 2HB ASN 53 -7.303 -6.842 7.089
398 2HB ASN 53 3HB ASN 53 -6.908 -8.028 8.341
399 1HD2 ASN 53 1HD2 ASN 53 -8.638 -9.231 9.326
400 2HD2 ASN 53 2HD2 ASN 53 -10.285 -9.090 8.745
401 H ASP 54 H ASP 54 -5.559 -7.113 10.537
402 HA ASP 54 HA ASP 54 -6.929 -8.063 12.833
403 1HB ASP 54 2HB ASP 54 -4.292 -6.551 12.674
404 2HB ASP 54 3HB ASP 54 -4.907 -7.332 14.142
405 H GLN 55 H GLN 55 -5.556 -4.881 12.146
406 HA GLN 55 HA GLN 55 -6.211 -2.797 12.631
407 1HB GLN 55 2HB GLN 55 -7.903 -2.070 13.921
408 2HB GLN 55 3HB GLN 55 -8.514 -3.671 13.519
409 1HG GLN 55 2HG GLN 55 -7.355 -4.359 15.829
410 2HG GLN 55 3HG GLN 55 -7.335 -2.623 16.121
411 1HE2 GLN 55 1HE2 GLN 55 -9.956 -2.195 14.653
412 2HE2 GLN 55 2HE2 GLN 55 -11.152 -2.801 15.787
413 H SER 56 H SER 56 -4.521 -5.140 13.955
414 HA SER 56 HA SER 56 -3.166 -4.288 16.252
415 1HB SER 56 2HB SER 56 -1.357 -5.688 15.401
416 2HB SER 56 3HB SER 56 -2.896 -6.496 15.104
417 HG SER 56 HG SER 56 -2.670 -5.355 12.903
418 H GLY 57 H GLY 57 -2.859 -3.376 12.835
419 1HA GLY 57 1HA GLY 57 -1.979 -1.464 11.942
420 2HA GLY 57 2HA GLY 57 -1.301 -0.985 13.524
421 H TYR 58 H TYR 58 -0.245 -4.020 13.417
422 HA TYR 58 HA TYR 58 2.301 -3.536 11.920
423 1HB TYR 58 2HB TYR 58 1.211 -5.800 13.633
424 2HB TYR 58 3HB TYR 58 2.617 -5.975 12.593
425 HD1 TYR 58 HD1 TYR 58 4.505 -4.148 12.833
426 HD2 TYR 58 HD2 TYR 58 1.661 -5.197 15.902
427 HE1 TYR 58 HE1 TYR 58 6.120 -3.446 14.565
428 HE2 TYR 58 HE2 TYR 58 3.289 -4.496 17.637
429 HH TYR 58 HH TYR 58 6.530 -3.230 16.825
430 H LEU 59 H LEU 59 1.787 -3.315 9.838
431 HA LEU 59 HA LEU 59 0.211 -5.340 8.410
432 1HB LEU 59 2HB LEU 59 2.146 -3.179 7.505
433 2HB LEU 59 3HB LEU 59 1.480 -4.419 6.439
434 HG LEU 59 HG LEU 59 -0.845 -3.677 7.065
435 1HD1 LEU 59 1HD1 LEU 59 -1.081 -1.359 7.938
436 2HD1 LEU 59 2HD1 LEU 59 -0.423 -2.448 9.152
437 3HD1 LEU 59 3HD1 LEU 59 0.663 -1.330 8.295
438 1HD2 LEU 59 1HD2 LEU 59 -0.596 -1.516 5.662
439 2HD2 LEU 59 2HD2 LEU 59 1.138 -1.857 5.653
440 3HD2 LEU 59 3HD2 LEU 59 -0.010 -3.032 4.959
441 H ASP 60 H ASP 60 1.006 -7.121 9.361
442 HA ASP 60 HA ASP 60 3.746 -8.086 9.145
443 1HB ASP 60 2HB ASP 60 1.159 -9.688 9.314
444 2HB ASP 60 3HB ASP 60 2.790 -10.220 9.754
445 H GLU 61 H GLU 61 4.534 -9.625 7.449
446 HA GLU 61 HA GLU 61 4.210 -8.815 4.945
447 1HB GLU 61 2HB GLU 61 5.875 -10.395 6.042
448 2HB GLU 61 3HB GLU 61 4.830 -11.722 5.524
449 1HG GLU 61 2HG GLU 61 5.632 -9.597 3.493
450 2HG GLU 61 3HG GLU 61 6.844 -10.685 4.143
451 H GLU 62 H GLU 62 2.511 -11.715 6.181
452 HA GLU 62 HA GLU 62 1.045 -12.286 3.880
453 1HB GLU 62 2HB GLU 62 1.235 -13.895 5.588
454 2HB GLU 62 3HB GLU 62 0.530 -12.854 6.827
455 1HG GLU 62 2HG GLU 62 -1.622 -13.316 6.226
456 2HG GLU 62 3HG GLU 62 -1.254 -13.476 4.515
457 H GLU 63 H GLU 63 0.389 -9.614 6.149
458 HA GLU 63 HA GLU 63 -2.363 -9.315 5.173
459 1HB GLU 63 2HB GLU 63 -0.530 -7.534 6.793
460 2HB GLU 63 3HB GLU 63 -2.219 -7.151 6.416
461 1HG GLU 63 2HG GLU 63 -3.072 -9.018 7.579
462 2HG GLU 63 3HG GLU 63 -1.526 -9.867 7.648
463 H LEU 64 H LEU 64 0.863 -8.267 4.215
464 HA LEU 64 HA LEU 64 -0.112 -6.210 2.419
465 1HB LEU 64 2HB LEU 64 2.545 -7.662 2.559
466 2HB LEU 64 3HB LEU 64 2.178 -6.338 1.454
467 HG LEU 64 HG LEU 64 1.711 -5.917 4.428
468 1HD1 LEU 64 1HD1 LEU 64 4.038 -4.966 4.504
469 2HD1 LEU 64 2HD1 LEU 64 3.959 -6.726 4.435
470 3HD1 LEU 64 3HD1 LEU 64 4.363 -5.804 2.970
471 1HD2 LEU 64 1HD2 LEU 64 0.945 -4.212 2.758
472 2HD2 LEU 64 2HD2 LEU 64 2.250 -3.587 3.782
473 3HD2 LEU 64 3HD2 LEU 64 2.605 -4.138 2.133
474 H LYS 65 H LYS 65 0.019 -9.704 2.348
475 HA LYS 65 HA LYS 65 -0.337 -10.054 -0.474
476 1HB LYS 65 2HB LYS 65 0.201 -11.857 1.247
477 2HB LYS 65 3HB LYS 65 -1.518 -11.748 1.709
478 1HG LYS 65 2HG LYS 65 -2.278 -12.527 -0.405
479 2HG LYS 65 3HG LYS 65 -0.646 -12.482 -1.081
480 1HD LYS 65 2HD LYS 65 -1.588 -14.752 -0.393
481 2HD LYS 65 3HD LYS 65 0.027 -14.363 0.231
482 1HE LYS 65 2HE LYS 65 -0.781 -13.878 2.408
483 2HE LYS 65 3HE LYS 65 -2.481 -13.835 1.899
484 1HZ LYS 65 1HZ LYS 65 -2.433 -16.182 1.637
485 2HZ LYS 65 2HZ LYS 65 -0.803 -16.254 1.940
486 3HZ LYS 65 3HZ LYS 65 -1.821 -15.802 3.116
487 H PHE 66 H PHE 66 -2.396 -8.408 1.806
488 HA PHE 66 HA PHE 66 -4.376 -8.353 -0.374
489 1HB PHE 66 2HB PHE 66 -6.233 -8.317 1.318
490 2HB PHE 66 3HB PHE 66 -5.431 -9.850 1.061
491 HD1 PHE 66 1HD PHE 66 -4.571 -11.082 2.903
492 HD2 PHE 66 2HD PHE 66 -5.444 -6.891 3.419
493 HE1 PHE 66 1HE PHE 66 -4.624 -11.388 5.360
494 HE2 PHE 66 2HE PHE 66 -5.339 -7.191 5.878
495 HZ PHE 66 HZ PHE 66 -5.144 -9.465 6.845
496 H PHE 67 H PHE 67 -2.205 -6.550 0.305
497 HA PHE 67 HA PHE 67 -2.949 -4.313 1.765
498 1HB PHE 67 2HB PHE 67 -0.724 -4.647 0.942
499 2HB PHE 67 3HB PHE 67 -1.226 -4.558 -0.719
500 HD1 PHE 67 1HD PHE 67 -0.765 -2.592 2.415
501 HD2 PHE 67 2HD PHE 67 -1.398 -2.442 -1.851
502 HE1 PHE 67 1HE PHE 67 -0.087 -0.221 2.401
503 HE2 PHE 67 2HE PHE 67 -0.786 -0.040 -1.850
504 HZ PHE 67 HZ PHE 67 -0.101 1.074 0.258
505 H LEU 68 H LEU 68 -3.191 -4.247 -1.867
506 HA LEU 68 HA LEU 68 -5.134 -2.100 -1.706
507 1HB LEU 68 2HB LEU 68 -3.305 -2.900 -3.603
508 2HB LEU 68 3HB LEU 68 -4.784 -3.611 -4.246
509 HG LEU 68 HG LEU 68 -5.816 -1.227 -3.939
510 1HD1 LEU 68 1HD1 LEU 68 -4.084 0.604 -3.971
511 2HD1 LEU 68 2HD1 LEU 68 -4.077 -0.283 -2.442
512 3HD1 LEU 68 3HD1 LEU 68 -2.833 -0.615 -3.652
513 1HD2 LEU 68 1HD2 LEU 68 -5.323 -2.090 -6.128
514 2HD2 LEU 68 2HD2 LEU 68 -4.678 -0.443 -6.067
515 3HD2 LEU 68 3HD2 LEU 68 -3.580 -1.835 -5.915
516 H GLN 69 H GLN 69 -5.321 -5.524 -1.745
517 HA GLN 69 HA GLN 69 -7.860 -5.964 -2.879
518 1HB GLN 69 2HB GLN 69 -5.863 -7.524 -1.637
519 2HB GLN 69 3HB GLN 69 -7.289 -7.734 -0.623
520 1HG GLN 69 2HG GLN 69 -7.487 -9.448 -2.112
521 2HG GLN 69 3HG GLN 69 -8.513 -8.229 -2.890
522 1HE2 GLN 69 1HE2 GLN 69 -7.172 -6.814 -4.588
523 2HE2 GLN 69 2HE2 GLN 69 -5.978 -7.731 -5.510
524 H LYS 70 H LYS 70 -6.960 -4.347 0.062
525 HA LYS 70 HA LYS 70 -9.413 -4.725 1.489
526 1HB LYS 70 2HB LYS 70 -6.948 -3.293 1.879
527 2HB LYS 70 3HB LYS 70 -8.229 -2.077 1.892
528 1HG LYS 70 2HG LYS 70 -8.044 -2.836 4.090
529 2HG LYS 70 3HG LYS 70 -9.505 -3.625 3.430
530 1HD LYS 70 2HD LYS 70 -7.639 -5.533 2.830
531 2HD LYS 70 3HD LYS 70 -6.844 -4.813 4.220
532 1HE LYS 70 2HE LYS 70 -9.582 -6.150 4.058
533 2HE LYS 70 3HE LYS 70 -8.187 -6.631 5.016
534 1HZ LYS 70 1HZ LYS 70 -8.597 -4.362 6.197
535 2HZ LYS 70 2HZ LYS 70 -10.048 -4.401 5.478
536 3HZ LYS 70 3HZ LYS 70 -9.641 -5.627 6.489
537 H PHE 71 H PHE 71 -8.496 -2.672 -1.202
538 HA PHE 71 HA PHE 71 -10.984 -1.057 -1.029
539 1HB PHE 71 2HB PHE 71 -8.816 -0.034 -1.470
540 2HB PHE 71 3HB PHE 71 -8.674 -0.911 -2.980
541 HD1 PHE 71 1HD PHE 71 -8.272 1.703 -3.446
542 HD2 PHE 71 2HD PHE 71 -12.157 -0.083 -2.766
543 HE1 PHE 71 1HE PHE 71 -9.343 3.440 -4.823
544 HE2 PHE 71 2HE PHE 71 -13.149 1.498 -4.332
545 HZ PHE 71 HZ PHE 71 -11.785 3.310 -5.323
546 H GLU 72 H GLU 72 -9.086 -3.055 -3.371
547 HA GLU 72 HA GLU 72 -11.535 -3.490 -5.018
548 1HB GLU 72 2HB GLU 72 -9.347 -2.190 -5.721
549 2HB GLU 72 3HB GLU 72 -8.664 -3.796 -5.972
550 1HG GLU 72 2HG GLU 72 -11.340 -3.124 -7.249
551 2HG GLU 72 3HG GLU 72 -9.893 -2.332 -7.869
552 H SER 73 H SER 73 -10.956 -5.734 -6.422
553 HA SER 73 HA SER 73 -10.327 -7.835 -4.353
554 1HB SER 73 2HB SER 73 -12.548 -7.844 -6.408
555 2HB SER 73 3HB SER 73 -12.100 -9.186 -5.331
556 HG SER 73 HG SER 73 -13.761 -7.970 -4.374
557 H GLY 74 H GLY 74 -9.636 -6.680 -7.548
558 1HA GLY 74 1HA GLY 74 -8.128 -9.198 -8.183
559 2HA GLY 74 2HA GLY 74 -9.118 -8.317 -9.358
560 H ALA 75 H ALA 75 -7.174 -6.847 -6.837
561 HA ALA 75 HA ALA 75 -5.542 -5.330 -8.686
562 1HB ALA 75 1HB ALA 75 -5.281 -5.616 -5.662
563 2HB ALA 75 2HB ALA 75 -4.526 -4.385 -6.687
564 3HB ALA 75 3HB ALA 75 -6.285 -4.436 -6.514
565 H ARG 76 H ARG 76 -3.181 -6.010 -6.507
566 HA ARG 76 HA ARG 76 -2.003 -8.075 -8.341
567 1HB ARG 76 2HB ARG 76 -1.398 -5.561 -8.632
568 2HB ARG 76 3HB ARG 76 -0.571 -5.732 -7.081
569 1HG ARG 76 2HG ARG 76 1.189 -6.276 -8.378
570 2HG ARG 76 3HG ARG 76 0.504 -7.883 -8.403
571 1HD ARG 76 2HD ARG 76 -0.869 -7.118 -10.500
572 2HD ARG 76 3HD ARG 76 0.246 -5.751 -10.532
573 HE ARG 76 HE ARG 76 2.113 -7.138 -10.831
574 1HH1 ARG 76 2HH2 ARG 76 -0.896 -9.005 -11.130
575 2HH1 ARG 76 1HH2 ARG 76 -0.095 -10.453 -11.659
576 1HH2 ARG 76 2HH1 ARG 76 3.108 -8.982 -11.339
577 2HH2 ARG 76 1HH1 ARG 76 2.298 -10.385 -12.046
578 H GLU 77 H GLU 77 -2.791 -7.401 -5.148
579 HA GLU 77 HA GLU 77 -0.628 -7.765 -3.679
580 1HB GLU 77 2HB GLU 77 -3.174 -9.014 -2.717
581 2HB GLU 77 3HB GLU 77 -1.968 -8.029 -1.855
582 1HG GLU 77 2HG GLU 77 -4.246 -7.189 -3.636
583 2HG GLU 77 3HG GLU 77 -3.776 -6.618 -2.035
584 H LEU 78 H LEU 78 -2.227 -10.332 -5.289
585 HA LEU 78 HA LEU 78 -1.234 -12.633 -4.026
586 1HB LEU 78 2HB LEU 78 -1.397 -12.550 -7.033
587 2HB LEU 78 3HB LEU 78 -1.832 -13.818 -5.903
588 HG LEU 78 HG LEU 78 -3.809 -13.101 -6.852
589 1HD1 LEU 78 1HD1 LEU 78 -3.810 -11.594 -4.204
590 2HD1 LEU 78 2HD1 LEU 78 -5.189 -12.286 -5.065
591 3HD1 LEU 78 3HD1 LEU 78 -3.943 -13.352 -4.387
592 1HD2 LEU 78 1HD2 LEU 78 -4.265 -11.121 -7.744
593 2HD2 LEU 78 2HD2 LEU 78 -3.949 -10.242 -6.250
594 3HD2 LEU 78 3HD2 LEU 78 -2.605 -10.637 -7.351
595 H THR 79 H THR 79 0.368 -10.468 -6.440
596 HA THR 79 HA THR 79 2.538 -12.319 -6.884
597 HB THR 79 HB THR 79 2.425 -9.363 -7.574
598 HG1 THR 79 1HG THR 79 2.334 -10.799 -9.629
599 1HG2 THR 79 1HG2 THR 79 4.202 -11.696 -8.502
600 2HG2 THR 79 2HG2 THR 79 4.221 -10.073 -9.205
601 3HG2 THR 79 3HG2 THR 79 4.752 -10.316 -7.544
602 H GLU 80 H GLU 80 3.616 -12.845 -5.175
603 HA GLU 80 HA GLU 80 4.215 -11.407 -2.889
604 1HB GLU 80 2HB GLU 80 5.994 -13.001 -2.465
605 2HB GLU 80 3HB GLU 80 4.496 -13.766 -2.993
606 1HG GLU 80 2HG GLU 80 5.430 -14.083 -5.286
607 2HG GLU 80 3HG GLU 80 6.928 -13.271 -4.797
608 H SER 81 H SER 81 6.236 -11.507 -5.897
609 HA SER 81 HA SER 81 8.330 -9.934 -4.951
610 1HB SER 81 2HB SER 81 7.139 -9.940 -7.749
611 2HB SER 81 3HB SER 81 8.710 -9.277 -7.299
612 HG SER 81 HG SER 81 8.808 -11.344 -8.137
613 H GLU 82 H GLU 82 5.116 -8.880 -6.095
614 HA GLU 82 HA GLU 82 5.996 -6.092 -6.294
615 1HB GLU 82 2HB GLU 82 3.303 -7.448 -6.769
616 2HB GLU 82 3HB GLU 82 3.643 -5.741 -7.046
617 1HG GLU 82 2HG GLU 82 5.601 -6.401 -8.489
618 2HG GLU 82 3HG GLU 82 5.112 -8.102 -8.340
619 H THR 83 H THR 83 3.813 -8.076 -4.284
620 HA THR 83 HA THR 83 3.182 -6.216 -2.338
621 HB THR 83 HB THR 83 3.555 -9.191 -2.424
622 HG1 THR 83 1HG THR 83 1.567 -7.787 -1.086
623 1HG2 THR 83 1HG2 THR 83 4.636 -8.975 -0.284
624 2HG2 THR 83 2HG2 THR 83 3.492 -7.721 0.234
625 3HG2 THR 83 3HG2 THR 83 2.953 -9.398 0.017
626 H LYS 84 H LYS 84 6.101 -8.340 -2.481
627 HA LYS 84 HA LYS 84 7.187 -7.232 -0.124
628 1HB LYS 84 2HB LYS 84 8.884 -8.724 -0.226
629 2HB LYS 84 3HB LYS 84 7.631 -9.559 -1.137
630 1HG LYS 84 2HG LYS 84 8.767 -8.494 -3.219
631 2HG LYS 84 3HG LYS 84 10.115 -8.091 -2.146
632 1HD LYS 84 2HD LYS 84 10.298 -10.536 -1.571
633 2HD LYS 84 3HD LYS 84 8.998 -10.863 -2.735
634 1HE LYS 84 2HE LYS 84 10.498 -9.627 -4.489
635 2HE LYS 84 3HE LYS 84 11.787 -9.725 -3.292
636 1HZ LYS 84 1HZ LYS 84 11.542 -12.132 -3.360
637 2HZ LYS 84 2HZ LYS 84 10.329 -12.013 -4.469
638 3HZ LYS 84 3HZ LYS 84 11.848 -11.533 -4.863
639 H SER 85 H SER 85 7.462 -6.175 -3.497
640 HA SER 85 HA SER 85 9.695 -4.445 -3.135
641 1HB SER 85 2HB SER 85 8.599 -4.950 -5.333
642 2HB SER 85 3HB SER 85 7.244 -3.908 -4.859
643 HG SER 85 HG SER 85 8.841 -2.794 -6.071
644 H LEU 86 H LEU 86 6.146 -3.931 -2.555
645 HA LEU 86 HA LEU 86 6.491 -1.318 -1.448
646 1HB LEU 86 2HB LEU 86 4.292 -2.258 -2.118
647 2HB LEU 86 3HB LEU 86 4.299 -3.311 -0.713
648 HG LEU 86 HG LEU 86 4.882 -0.461 -0.065
649 1HD1 LEU 86 1HD1 LEU 86 2.162 -1.220 -1.201
650 2HD1 LEU 86 2HD1 LEU 86 2.506 0.259 -0.285
651 3HD1 LEU 86 3HD1 LEU 86 3.294 -0.006 -1.846
652 1HD2 LEU 86 1HD2 LEU 86 3.359 -0.836 1.757
653 2HD2 LEU 86 2HD2 LEU 86 2.703 -2.284 0.976
654 3HD2 LEU 86 3HD2 LEU 86 4.365 -2.289 1.621
655 H MET 87 H MET 87 6.166 -4.539 0.186
656 HA MET 87 HA MET 87 6.651 -3.755 2.757
657 1HB MET 87 2HB MET 87 6.303 -6.157 1.875
658 2HB MET 87 3HB MET 87 8.051 -6.187 1.628
659 1HG MET 87 2HG MET 87 8.198 -5.436 4.149
660 2HG MET 87 3HG MET 87 6.515 -5.939 4.217
661 1HE MET 87 1HE MET 87 10.146 -8.709 3.634
662 2HE MET 87 2HE MET 87 9.664 -7.604 2.333
663 3HE MET 87 3HE MET 87 10.229 -6.953 3.893
664 H ALA 88 H ALA 88 9.176 -4.514 0.379
665 HA ALA 88 HA ALA 88 11.426 -4.507 1.978
666 1HB ALA 88 1HB ALA 88 11.077 -3.827 -0.977
667 2HB ALA 88 2HB ALA 88 12.656 -4.086 -0.197
668 3HB ALA 88 3HB ALA 88 11.472 -5.400 -0.267
669 H ALA 89 H ALA 89 9.912 -1.737 0.328
670 HA ALA 89 HA ALA 89 12.041 0.084 1.326
671 1HB ALA 89 1HB ALA 89 9.637 0.532 -0.431
672 2HB ALA 89 2HB ALA 89 10.883 1.752 -0.061
673 3HB ALA 89 3HB ALA 89 11.316 0.284 -0.973
674 H ALA 90 H ALA 90 8.512 -0.538 1.797
675 HA ALA 90 HA ALA 90 8.010 1.706 3.528
676 1HB ALA 90 1HB ALA 90 6.141 0.295 4.354
677 2HB ALA 90 2HB ALA 90 6.192 0.358 2.569
678 3HB ALA 90 3HB ALA 90 6.797 -1.077 3.436
679 H ASP 91 H ASP 91 9.290 -1.594 4.119
680 HA ASP 91 HA ASP 91 9.393 -1.207 6.955
681 1HB ASP 91 2HB ASP 91 9.375 -3.476 5.918
682 2HB ASP 91 3HB ASP 91 11.005 -3.172 5.280
683 H ASN 92 H ASN 92 10.861 0.035 7.997
684 HA ASN 92 HA ASN 92 13.334 0.947 6.507
685 1HB ASN 92 2HB ASN 92 11.636 2.343 8.597
686 2HB ASN 92 3HB ASN 92 13.269 2.855 8.167
687 1HD2 ASN 92 1HD2 ASN 92 10.051 2.175 6.555
688 2HD2 ASN 92 2HD2 ASN 92 10.338 3.389 5.342
689 H ASP 93 H ASP 93 12.700 -1.530 8.391
690 HA ASP 93 HA ASP 93 14.872 -1.033 10.400
691 1HB ASP 93 2HB ASP 93 12.778 -3.225 10.143
692 2HB ASP 93 3HB ASP 93 14.088 -3.207 11.330
693 H GLY 94 H GLY 94 13.778 -3.065 7.729
694 1HA GLY 94 1HA GLY 94 15.006 -4.552 6.359
695 2HA GLY 94 2HA GLY 94 16.365 -4.521 7.500
696 H ASP 95 H ASP 95 12.837 -4.770 8.205
697 HA ASP 95 HA ASP 95 13.332 -7.502 9.345
698 1HB ASP 95 2HB ASP 95 12.504 -7.057 11.320
699 2HB ASP 95 3HB ASP 95 12.930 -5.391 10.977
700 H GLY 96 H GLY 96 10.557 -5.382 8.349
701 1HA GLY 96 1HA GLY 96 9.458 -6.204 6.264
702 2HA GLY 96 2HA GLY 96 9.322 -7.789 7.041
703 H LYS 97 H LYS 97 8.787 -6.711 9.751
704 HA LYS 97 HA LYS 97 5.919 -6.389 9.642
705 1HB LYS 97 2HB LYS 97 7.928 -5.634 11.811
706 2HB LYS 97 3HB LYS 97 6.193 -5.788 12.040
707 1HG LYS 97 2HG LYS 97 7.945 -8.128 11.154
708 2HG LYS 97 3HG LYS 97 7.728 -7.643 12.832
709 1HD LYS 97 2HD LYS 97 5.196 -7.898 12.499
710 2HD LYS 97 3HD LYS 97 5.525 -8.484 10.874
711 1HE LYS 97 2HE LYS 97 5.159 -10.369 12.343
712 2HE LYS 97 3HE LYS 97 6.847 -10.377 11.796
713 1HZ LYS 97 1HZ LYS 97 7.463 -9.414 13.909
714 2HZ LYS 97 2HZ LYS 97 5.886 -9.369 14.393
715 3HZ LYS 97 3HZ LYS 97 6.638 -10.814 14.154
716 H ILE 98 H ILE 98 4.945 -4.526 8.842
717 HA ILE 98 HA ILE 98 6.420 -1.920 9.115
718 HB ILE 98 HB ILE 98 4.479 -3.053 7.129
719 1HG1 ILE 98 2HG1 ILE 98 6.946 -1.425 6.538
720 2HG1 ILE 98 3HG1 ILE 98 7.199 -3.043 7.198
721 1HG2 ILE 98 1HG2 ILE 98 5.163 -0.108 7.533
722 2HG2 ILE 98 2HG2 ILE 98 4.448 -0.783 6.055
723 3HG2 ILE 98 3HG2 ILE 98 3.546 -0.851 7.570
724 1HD1 ILE 98 1HD1 ILE 98 5.502 -2.497 4.743
725 2HD1 ILE 98 2HD1 ILE 98 7.192 -3.072 4.783
726 3HD1 ILE 98 3HD1 ILE 98 5.901 -4.073 5.468
727 H GLY 99 H GLY 99 5.839 -0.787 10.821
728 1HA GLY 99 1HA GLY 99 3.142 -0.928 11.980
729 2HA GLY 99 2HA GLY 99 4.454 0.169 12.432
730 H ALA 100 H ALA 100 1.929 1.199 12.260
731 HA ALA 100 HA ALA 100 1.186 2.409 9.812
732 1HB ALA 100 1HB ALA 100 0.977 4.129 12.243
733 2HB ALA 100 2HB ALA 100 -0.249 3.653 11.053
734 3HB ALA 100 3HB ALA 100 0.205 2.558 12.392
735 H GLU 101 H GLU 101 3.520 3.315 12.316
736 HA GLU 101 HA GLU 101 4.131 5.846 11.330
737 1HB GLU 101 2HB GLU 101 4.810 4.362 13.563
738 2HB GLU 101 3HB GLU 101 6.373 4.463 12.748
739 1HG GLU 101 2HG GLU 101 6.359 6.845 12.870
740 2HG GLU 101 3HG GLU 101 4.617 6.916 13.198
741 H GLU 102 H GLU 102 6.228 2.912 10.974
742 HA GLU 102 HA GLU 102 7.893 3.655 8.943
743 1HB GLU 102 2HB GLU 102 6.454 1.034 9.495
744 2HB GLU 102 3HB GLU 102 7.490 1.201 8.075
745 1HG GLU 102 2HG GLU 102 9.391 1.863 9.468
746 2HG GLU 102 3HG GLU 102 8.417 1.679 10.933
747 H PHE 103 H PHE 103 4.534 2.429 8.422
748 HA PHE 103 HA PHE 103 4.713 2.555 5.586
749 1HB PHE 103 2HB PHE 103 2.978 1.290 6.791
750 2HB PHE 103 3HB PHE 103 2.289 2.778 7.414
751 HD1 PHE 103 1HD PHE 103 3.356 1.451 4.029
752 HD2 PHE 103 2HD PHE 103 0.286 3.409 6.351
753 HE1 PHE 103 1HE PHE 103 1.935 1.615 2.016
754 HE2 PHE 103 2HE PHE 103 -1.171 3.483 4.348
755 HZ PHE 103 HZ PHE 103 -0.359 2.578 2.186
756 H GLN 104 H GLN 104 3.292 4.882 7.891
757 HA GLN 104 HA GLN 104 2.494 6.806 5.929
758 1HB GLN 104 2HB GLN 104 1.503 6.503 8.172
759 2HB GLN 104 3HB GLN 104 2.972 7.127 8.930
760 1HG GLN 104 2HG GLN 104 1.630 8.826 6.812
761 2HG GLN 104 3HG GLN 104 0.799 8.627 8.361
762 1HE2 GLN 104 1HE2 GLN 104 3.786 9.833 6.852
763 2HE2 GLN 104 2HE2 GLN 104 4.206 10.891 8.195
764 H GLU 105 H GLU 105 5.522 6.446 7.835
765 HA GLU 105 HA GLU 105 6.761 8.868 7.029
766 1HB GLU 105 2HB GLU 105 7.853 6.074 7.611
767 2HB GLU 105 3HB GLU 105 8.892 7.443 7.220
768 1HG GLU 105 2HG GLU 105 8.116 8.699 9.146
769 2HG GLU 105 3HG GLU 105 6.919 7.461 9.544
770 H MET 106 H MET 106 7.048 5.585 5.528
771 HA MET 106 HA MET 106 8.538 6.660 3.377
772 1HB MET 106 2HB MET 106 8.074 4.114 4.293
773 2HB MET 106 3HB MET 106 7.096 4.108 2.817
774 1HG MET 106 2HG MET 106 9.343 3.376 2.286
775 2HG MET 106 3HG MET 106 9.153 4.990 1.591
776 1HE MET 106 1HE MET 106 12.957 4.768 2.609
777 2HE MET 106 2HE MET 106 11.947 3.411 2.067
778 3HE MET 106 3HE MET 106 11.821 4.993 1.256
779 H VAL 107 H VAL 107 5.063 6.037 3.665
780 HA VAL 107 HA VAL 107 4.355 6.722 0.975
781 HB VAL 107 HB VAL 107 2.864 6.815 3.614
782 1HG1 VAL 107 1HG1 VAL 107 0.792 7.034 2.246
783 2HG1 VAL 107 2HG1 VAL 107 1.786 8.490 2.197
784 3HG1 VAL 107 3HG1 VAL 107 1.804 7.363 0.820
785 1HG2 VAL 107 1HG2 VAL 107 3.487 4.559 2.617
786 2HG2 VAL 107 2HG2 VAL 107 1.742 4.849 2.726
787 3HG2 VAL 107 3HG2 VAL 107 2.578 5.006 1.166
788 H HIS 108 H HIS 108 4.737 8.745 3.942
789 HA HIS 108 HA HIS 108 3.631 11.070 2.735
790 1HB HIS 108 2HB HIS 108 3.568 10.728 5.090
791 2HB HIS 108 3HB HIS 108 5.346 10.671 5.202
792 HD1 HIS 108 1HD HIS 108 2.709 13.291 4.038
793 HD2 HIS 108 2HD HIS 108 6.275 12.834 6.226
794 HE1 HIS 108 1HE HIS 108 3.220 15.563 5.103
795 H SER 109 H SER 109 6.817 9.687 3.026
796 HA SER 109 HA SER 109 8.618 11.612 2.499
797 1HB SER 109 2HB SER 109 8.905 9.057 2.728
798 2HB SER 109 3HB SER 109 8.644 8.991 0.973
799 HG SER 109 HG SER 109 10.854 9.085 1.501
Start of MODEL 7
1 1H MET 1 H1 MET 1 -14.969 1.505 -0.560
2 2H MET 1 H2 MET 1 -16.124 1.543 -1.730
3 3H MET 1 H3 MET 1 -15.150 2.832 -1.539
4 HA MET 1 HA MET 1 -17.165 3.436 -0.584
5 1HB MET 1 2HB MET 1 -18.456 1.989 0.862
6 2HB MET 1 3HB MET 1 -18.092 1.196 -0.673
7 1HG MET 1 2HG MET 1 -16.152 0.011 0.551
8 2HG MET 1 3HG MET 1 -16.880 0.587 2.050
9 1HE MET 1 1HE MET 1 -20.047 0.292 1.360
10 2HE MET 1 2HE MET 1 -20.304 -1.333 2.027
11 3HE MET 1 3HE MET 1 -19.280 -0.171 2.902
12 H SER 2 H SER 2 -14.552 4.180 0.084
13 HA SER 2 HA SER 2 -14.797 5.350 2.588
14 1HB SER 2 2HB SER 2 -13.165 2.771 2.666
15 2HB SER 2 3HB SER 2 -12.745 4.163 3.676
16 HG SER 2 HG SER 2 -15.377 3.173 3.670
17 H ILE 3 H ILE 3 -12.250 3.758 0.666
18 HA ILE 3 HA ILE 3 -10.746 6.308 0.547
19 HB ILE 3 HB ILE 3 -9.021 4.986 -0.440
20 1HG1 ILE 3 2HG1 ILE 3 -9.700 2.303 0.027
21 2HG1 ILE 3 3HG1 ILE 3 -11.072 2.901 -0.860
22 1HG2 ILE 3 1HG2 ILE 3 -10.138 3.554 2.017
23 2HG2 ILE 3 2HG2 ILE 3 -8.434 3.719 1.548
24 3HG2 ILE 3 3HG2 ILE 3 -9.367 5.147 2.049
25 1HD1 ILE 3 1HD1 ILE 3 -9.341 1.997 -2.347
26 2HD1 ILE 3 2HD1 ILE 3 -9.555 3.712 -2.657
27 3HD1 ILE 3 3HD1 ILE 3 -8.150 3.149 -1.713
28 H THR 4 H THR 4 -12.516 4.114 -1.548
29 HA THR 4 HA THR 4 -11.749 5.133 -4.038
30 HB THR 4 HB THR 4 -13.861 4.080 -4.745
31 HG1 THR 4 1HG THR 4 -15.307 4.336 -3.194
32 1HG2 THR 4 1HG2 THR 4 -12.425 2.318 -2.710
33 2HG2 THR 4 2HG2 THR 4 -13.321 1.803 -4.146
34 3HG2 THR 4 3HG2 THR 4 -11.810 2.703 -4.329
35 H ASP 5 H ASP 5 -14.540 5.824 -2.010
36 HA ASP 5 HA ASP 5 -15.639 7.864 -3.720
37 1HB ASP 5 2HB ASP 5 -16.899 6.074 -2.454
38 2HB ASP 5 3HB ASP 5 -16.473 6.903 -0.942
39 H VAL 6 H VAL 6 -13.184 8.713 -2.990
40 HA VAL 6 HA VAL 6 -13.628 11.195 -1.429
41 HB VAL 6 HB VAL 6 -11.398 9.146 -0.971
42 1HG1 VAL 6 1HG1 VAL 6 -10.450 10.657 0.675
43 2HG1 VAL 6 2HG1 VAL 6 -10.461 11.417 -0.924
44 3HG1 VAL 6 3HG1 VAL 6 -11.667 11.899 0.288
45 1HG2 VAL 6 1HG2 VAL 6 -13.438 8.599 0.204
46 2HG2 VAL 6 2HG2 VAL 6 -12.211 9.160 1.365
47 3HG2 VAL 6 3HG2 VAL 6 -13.543 10.239 0.886
48 H LEU 7 H LEU 7 -11.251 9.234 -3.209
49 HA LEU 7 HA LEU 7 -10.833 11.134 -5.340
50 1HB LEU 7 2HB LEU 7 -9.536 12.298 -3.531
51 2HB LEU 7 3HB LEU 7 -8.691 10.795 -3.190
52 HG LEU 7 HG LEU 7 -8.080 11.026 -5.841
53 1HD1 LEU 7 1HD1 LEU 7 -8.298 13.893 -4.861
54 2HD1 LEU 7 2HD1 LEU 7 -7.591 13.337 -6.395
55 3HD1 LEU 7 3HD1 LEU 7 -9.329 13.138 -6.099
56 1HD2 LEU 7 1HD2 LEU 7 -5.929 11.909 -5.182
57 2HD2 LEU 7 2HD2 LEU 7 -6.583 12.485 -3.635
58 3HD2 LEU 7 3HD2 LEU 7 -6.464 10.739 -3.975
59 H SER 8 H SER 8 -9.173 8.743 -3.306
60 HA SER 8 HA SER 8 -7.450 7.639 -4.834
61 1HB SER 8 2HB SER 8 -8.913 5.734 -3.102
62 2HB SER 8 3HB SER 8 -7.181 6.089 -3.209
63 HG SER 8 HG SER 8 -9.251 7.402 -1.828
64 H ALA 9 H ALA 9 -10.839 6.975 -5.445
65 HA ALA 9 HA ALA 9 -10.712 4.508 -6.849
66 1HB ALA 9 1HB ALA 9 -12.828 5.605 -6.345
67 2HB ALA 9 2HB ALA 9 -12.386 7.004 -7.345
68 3HB ALA 9 3HB ALA 9 -12.661 5.419 -8.098
69 H ASP 10 H ASP 10 -10.027 7.883 -7.890
70 HA ASP 10 HA ASP 10 -9.581 7.225 -10.659
71 1HB ASP 10 2HB ASP 10 -10.123 9.503 -9.614
72 2HB ASP 10 3HB ASP 10 -8.424 9.581 -9.116
73 H ASP 11 H ASP 11 -7.541 7.472 -7.759
74 HA ASP 11 HA ASP 11 -5.052 7.318 -9.119
75 1HB ASP 11 2HB ASP 11 -5.653 6.755 -6.190
76 2HB ASP 11 3HB ASP 11 -4.118 7.194 -6.958
77 H ILE 12 H ILE 12 -7.091 4.818 -7.398
78 HA ILE 12 HA ILE 12 -5.258 2.726 -7.906
79 HB ILE 12 HB ILE 12 -7.016 1.239 -7.503
80 1HG1 ILE 12 2HG1 ILE 12 -8.876 3.548 -7.278
81 2HG1 ILE 12 3HG1 ILE 12 -8.947 2.264 -8.492
82 1HG2 ILE 12 1HG2 ILE 12 -7.284 1.691 -5.144
83 2HG2 ILE 12 2HG2 ILE 12 -5.701 2.260 -5.667
84 3HG2 ILE 12 3HG2 ILE 12 -7.012 3.426 -5.407
85 1HD1 ILE 12 1HD1 ILE 12 -9.336 0.619 -6.613
86 2HD1 ILE 12 2HD1 ILE 12 -9.513 2.011 -5.515
87 3HD1 ILE 12 3HD1 ILE 12 -10.632 1.800 -6.869
88 H ALA 13 H ALA 13 -7.993 4.068 -9.858
89 HA ALA 13 HA ALA 13 -7.760 2.231 -11.998
90 1HB ALA 13 1HB ALA 13 -9.592 3.785 -11.925
91 2HB ALA 13 2HB ALA 13 -8.510 5.179 -12.074
92 3HB ALA 13 3HB ALA 13 -8.677 4.048 -13.423
93 H ALA 14 H ALA 14 -5.905 5.301 -11.468
94 HA ALA 14 HA ALA 14 -4.228 5.028 -13.738
95 1HB ALA 14 1HB ALA 14 -2.653 6.478 -12.567
96 2HB ALA 14 2HB ALA 14 -4.316 7.060 -12.348
97 3HB ALA 14 3HB ALA 14 -3.488 6.216 -11.027
98 H ALA 15 H ALA 15 -3.513 3.994 -10.380
99 HA ALA 15 HA ALA 15 -1.136 2.655 -10.677
100 1HB ALA 15 1HB ALA 15 -1.644 1.488 -8.670
101 2HB ALA 15 2HB ALA 15 -2.323 3.116 -8.529
102 3HB ALA 15 3HB ALA 15 -3.387 1.737 -8.885
103 H LEU 16 H LEU 16 -4.384 1.411 -11.303
104 HA LEU 16 HA LEU 16 -3.708 -1.281 -11.656
105 1HB LEU 16 2HB LEU 16 -6.022 -0.394 -11.327
106 2HB LEU 16 3HB LEU 16 -5.964 0.309 -12.947
107 HG LEU 16 HG LEU 16 -5.730 -2.023 -13.894
108 1HD1 LEU 16 1HD1 LEU 16 -4.857 -3.218 -11.919
109 2HD1 LEU 16 2HD1 LEU 16 -6.323 -2.808 -11.000
110 3HD1 LEU 16 3HD1 LEU 16 -6.415 -3.904 -12.392
111 1HD2 LEU 16 1HD2 LEU 16 -7.882 -0.838 -13.823
112 2HD2 LEU 16 2HD2 LEU 16 -8.109 -2.575 -13.551
113 3HD2 LEU 16 3HD2 LEU 16 -8.180 -1.446 -12.180
114 H GLN 17 H GLN 17 -3.644 1.467 -13.936
115 HA GLN 17 HA GLN 17 -3.224 -0.387 -16.206
116 1HB GLN 17 2HB GLN 17 -4.730 1.786 -16.198
117 2HB GLN 17 3HB GLN 17 -3.187 2.605 -16.517
118 1HG GLN 17 2HG GLN 17 -2.803 0.969 -18.415
119 2HG GLN 17 3HG GLN 17 -4.401 0.281 -18.094
120 1HE2 GLN 17 1HE2 GLN 17 -6.208 1.275 -19.042
121 2HE2 GLN 17 2HE2 GLN 17 -6.075 2.759 -19.970
122 H GLU 18 H GLU 18 -1.497 2.117 -14.322
123 HA GLU 18 HA GLU 18 0.832 2.052 -16.012
124 1HB GLU 18 2HB GLU 18 1.760 3.580 -14.509
125 2HB GLU 18 3HB GLU 18 0.023 3.891 -14.506
126 1HG GLU 18 2HG GLU 18 0.481 4.028 -12.262
127 2HG GLU 18 3HG GLU 18 -0.102 2.379 -12.454
128 H CYS 19 H CYS 19 0.004 0.455 -12.886
129 HA CYS 19 HA CYS 19 2.455 -1.138 -12.936
130 1HB CYS 19 2HB CYS 19 0.914 -0.053 -10.902
131 2HB CYS 19 3HB CYS 19 0.359 -1.717 -10.874
132 HG CYS 19 HG CYS 19 2.736 -2.771 -10.861
133 H ARG 20 H ARG 20 1.098 -1.645 -15.224
134 HA ARG 20 HA ARG 20 -0.800 -3.894 -14.827
135 1HB ARG 20 2HB ARG 20 -1.449 -2.304 -16.382
136 2HB ARG 20 3HB ARG 20 0.119 -2.304 -17.230
137 1HG ARG 20 2HG ARG 20 -0.283 -4.491 -18.141
138 2HG ARG 20 3HG ARG 20 -1.712 -4.737 -17.105
139 1HD ARG 20 2HD ARG 20 -2.901 -2.943 -18.208
140 2HD ARG 20 3HD ARG 20 -1.464 -2.513 -19.174
141 HE ARG 20 HE ARG 20 -1.889 -5.161 -19.784
142 1HH1 ARG 20 2HH2 ARG 20 -3.805 -2.222 -20.009
143 2HH1 ARG 20 1HH2 ARG 20 -4.762 -2.731 -21.367
144 1HH2 ARG 20 2HH1 ARG 20 -3.097 -5.876 -21.628
145 2HH2 ARG 20 1HH1 ARG 20 -4.323 -4.867 -22.323
146 H ASP 21 H ASP 21 2.263 -3.293 -16.681
147 HA ASP 21 HA ASP 21 2.882 -5.927 -17.204
148 1HB ASP 21 2HB ASP 21 4.598 -3.461 -16.752
149 2HB ASP 21 3HB ASP 21 5.256 -5.004 -17.300
150 HA PRO 22 HA PRO 22 3.414 -7.492 -13.119
151 1HB PRO 22 2HB PRO 22 4.896 -9.765 -13.523
152 2HB PRO 22 3HB PRO 22 3.179 -9.610 -13.995
153 1HG PRO 22 2HG PRO 22 5.622 -9.190 -15.738
154 2HG PRO 22 3HG PRO 22 4.189 -10.201 -16.102
155 1HD PRO 22 2HD PRO 22 4.417 -7.678 -17.072
156 2HD PRO 22 3HD PRO 22 2.832 -8.259 -16.469
157 H ASP 23 H ASP 23 4.879 -7.519 -11.437
158 HA ASP 23 HA ASP 23 6.647 -7.080 -10.229
159 1HB ASP 23 2HB ASP 23 8.319 -7.823 -12.634
160 2HB ASP 23 3HB ASP 23 8.886 -7.688 -10.971
161 H THR 24 H THR 24 5.746 -4.917 -12.573
162 HA THR 24 HA THR 24 7.996 -3.149 -12.611
163 HB THR 24 HB THR 24 5.083 -2.585 -13.367
164 HG1 THR 24 1HG THR 24 5.440 -4.159 -14.619
165 1HG2 THR 24 1HG2 THR 24 6.175 -1.158 -15.115
166 2HG2 THR 24 2HG2 THR 24 6.468 -0.537 -13.487
167 3HG2 THR 24 3HG2 THR 24 7.747 -1.435 -14.340
168 H PHE 25 H PHE 25 5.850 -3.815 -10.110
169 HA PHE 25 HA PHE 25 5.114 -1.207 -9.268
170 1HB PHE 25 2HB PHE 25 3.887 -3.231 -8.708
171 2HB PHE 25 3HB PHE 25 5.266 -3.884 -7.848
172 HD1 PHE 25 1HD PHE 25 5.985 -2.803 -5.714
173 HD2 PHE 25 2HD PHE 25 2.217 -1.926 -7.612
174 HE1 PHE 25 1HE PHE 25 5.123 -2.063 -3.602
175 HE2 PHE 25 2HE PHE 25 1.260 -1.349 -5.400
176 HZ PHE 25 HZ PHE 25 2.686 -1.389 -3.376
177 H GLU 26 H GLU 26 6.484 0.286 -8.675
178 HA GLU 26 HA GLU 26 8.662 -0.290 -6.722
179 1HB GLU 26 2HB GLU 26 8.321 1.755 -8.866
180 2HB GLU 26 3HB GLU 26 8.786 2.426 -7.308
181 1HG GLU 26 2HG GLU 26 10.642 0.528 -7.340
182 2HG GLU 26 3HG GLU 26 10.347 0.595 -9.084
183 HA PRO 27 HA PRO 27 6.309 1.303 -3.422
184 1HB PRO 27 2HB PRO 27 8.165 2.467 -1.754
185 2HB PRO 27 3HB PRO 27 8.039 0.716 -2.063
186 1HG PRO 27 2HG PRO 27 9.967 2.661 -3.367
187 2HG PRO 27 3HG PRO 27 10.299 1.048 -2.717
188 1HD PRO 27 2HD PRO 27 9.899 1.463 -5.347
189 2HD PRO 27 3HD PRO 27 9.361 -0.038 -4.533
190 H GLN 28 H GLN 28 8.680 4.018 -3.779
191 HA GLN 28 HA GLN 28 6.902 6.075 -3.077
192 1HB GLN 28 2HB GLN 28 9.349 6.121 -4.874
193 2HB GLN 28 3HB GLN 28 8.505 7.566 -4.289
194 1HG GLN 28 2HG GLN 28 8.916 6.942 -1.957
195 2HG GLN 28 3HG GLN 28 9.744 5.460 -2.457
196 1HE2 GLN 28 1HE2 GLN 28 11.603 5.937 -4.206
197 2HE2 GLN 28 2HE2 GLN 28 12.632 7.282 -3.745
198 H LYS 29 H LYS 29 7.735 4.827 -6.245
199 HA LYS 29 HA LYS 29 6.125 6.296 -7.967
200 1HB LYS 29 2HB LYS 29 7.840 4.506 -8.413
201 2HB LYS 29 3HB LYS 29 6.636 3.287 -8.025
202 1HG LYS 29 2HG LYS 29 6.424 5.305 -10.324
203 2HG LYS 29 3HG LYS 29 7.145 3.702 -10.426
204 1HD LYS 29 2HD LYS 29 5.069 3.112 -11.165
205 2HD LYS 29 3HD LYS 29 4.867 2.837 -9.452
206 1HE LYS 29 2HE LYS 29 3.019 4.042 -9.747
207 2HE LYS 29 3HE LYS 29 4.078 5.463 -9.545
208 1HZ LYS 29 1HZ LYS 29 4.126 5.774 -11.839
209 2HZ LYS 29 2HZ LYS 29 3.367 4.335 -12.117
210 3HZ LYS 29 3HZ LYS 29 2.544 5.555 -11.345
211 H PHE 30 H PHE 30 5.162 3.120 -6.436
212 HA PHE 30 HA PHE 30 2.449 3.278 -7.043
213 1HB PHE 30 2HB PHE 30 3.314 1.224 -6.248
214 2HB PHE 30 3HB PHE 30 3.930 1.949 -4.771
215 HD1 PHE 30 1HD PHE 30 2.655 2.036 -2.813
216 HD2 PHE 30 2HD PHE 30 0.697 1.259 -6.571
217 HE1 PHE 30 1HE PHE 30 0.484 1.818 -1.635
218 HE2 PHE 30 2HE PHE 30 -1.460 0.953 -5.380
219 HZ PHE 30 HZ PHE 30 -1.585 1.377 -2.927
220 H PHE 31 H PHE 31 4.022 4.497 -3.997
221 HA PHE 31 HA PHE 31 1.698 5.302 -2.696
222 1HB PHE 31 2HB PHE 31 4.316 6.838 -2.657
223 2HB PHE 31 3HB PHE 31 3.056 6.852 -1.426
224 HD1 PHE 31 1HD PHE 31 6.054 6.314 -1.060
225 HD2 PHE 31 2HD PHE 31 2.530 3.866 -1.155
226 HE1 PHE 31 1HE PHE 31 7.314 4.492 0.018
227 HE2 PHE 31 2HE PHE 31 3.682 2.214 0.279
228 HZ PHE 31 HZ PHE 31 6.125 2.407 0.697
229 H GLN 32 H GLN 32 3.634 7.229 -5.064
230 HA GLN 32 HA GLN 32 1.785 9.448 -4.776
231 1HB GLN 32 2HB GLN 32 4.172 9.679 -5.408
232 2HB GLN 32 3HB GLN 32 3.792 9.032 -7.017
233 1HG GLN 32 2HG GLN 32 2.394 10.930 -7.528
234 2HG GLN 32 3HG GLN 32 2.242 11.377 -5.826
235 1HE2 GLN 32 1HE2 GLN 32 5.102 10.762 -7.977
236 2HE2 GLN 32 2HE2 GLN 32 5.879 12.276 -7.539
237 H THR 33 H THR 33 2.082 6.712 -7.096
238 HA THR 33 HA THR 33 0.136 7.685 -8.922
239 HB THR 33 HB THR 33 1.827 5.369 -8.541
240 HG1 THR 33 1HG THR 33 0.252 6.307 -10.664
241 1HG2 THR 33 1HG2 THR 33 0.535 3.633 -9.562
242 2HG2 THR 33 2HG2 THR 33 -0.133 4.046 -7.991
243 3HG2 THR 33 3HG2 THR 33 -0.929 4.636 -9.484
244 H SER 34 H SER 34 -0.129 5.821 -5.929
245 HA SER 34 HA SER 34 -2.978 5.281 -6.294
246 1HB SER 34 2HB SER 34 -2.774 4.293 -4.025
247 2HB SER 34 3HB SER 34 -1.643 3.615 -5.209
248 HG SER 34 HG SER 34 0.009 4.728 -4.294
249 H GLY 35 H GLY 35 -1.230 8.040 -5.499
250 1HA GLY 35 1HA GLY 35 -2.138 10.099 -4.959
251 2HA GLY 35 2HA GLY 35 -3.655 9.333 -4.460
252 H LEU 36 H LEU 36 -1.394 7.475 -2.979
253 HA LEU 36 HA LEU 36 -2.172 8.325 -0.403
254 1HB LEU 36 2HB LEU 36 0.032 6.487 -1.417
255 2HB LEU 36 3HB LEU 36 -0.397 6.681 0.263
256 HG LEU 36 HG LEU 36 -2.279 5.632 -1.869
257 1HD1 LEU 36 1HD1 LEU 36 -1.956 3.473 -0.737
258 2HD1 LEU 36 2HD1 LEU 36 -0.390 4.112 -1.267
259 3HD1 LEU 36 3HD1 LEU 36 -0.858 4.227 0.441
260 1HD2 LEU 36 1HD2 LEU 36 -3.621 6.706 -0.151
261 2HD2 LEU 36 2HD2 LEU 36 -3.678 4.964 0.097
262 3HD2 LEU 36 3HD2 LEU 36 -2.638 5.966 1.137
263 H SER 37 H SER 37 0.775 9.045 -2.326
264 HA SER 37 HA SER 37 2.016 10.458 -0.103
265 1HB SER 37 2HB SER 37 2.586 10.777 -3.075
266 2HB SER 37 3HB SER 37 3.620 11.273 -1.724
267 HG SER 37 HG SER 37 3.894 9.187 -1.131
268 H LYS 38 H LYS 38 -0.563 11.303 -2.277
269 HA LYS 38 HA LYS 38 -0.043 14.189 -1.973
270 1HB LYS 38 2HB LYS 38 -1.236 12.657 -4.025
271 2HB LYS 38 3HB LYS 38 -2.594 13.444 -3.219
272 1HG LYS 38 2HG LYS 38 -1.348 15.645 -3.414
273 2HG LYS 38 3HG LYS 38 -0.041 14.782 -4.234
274 1HD LYS 38 2HD LYS 38 -1.293 15.854 -5.914
275 2HD LYS 38 3HD LYS 38 -1.638 14.120 -6.052
276 1HE LYS 38 2HE LYS 38 -3.823 14.401 -4.996
277 2HE LYS 38 3HE LYS 38 -3.445 16.068 -4.527
278 1HZ LYS 38 1HZ LYS 38 -3.769 15.113 -7.294
279 2HZ LYS 38 2HZ LYS 38 -4.865 15.986 -6.438
280 3HZ LYS 38 3HZ LYS 38 -3.424 16.661 -6.844
281 H MET 39 H MET 39 -2.154 11.560 -0.907
282 HA MET 39 HA MET 39 -3.920 13.126 0.650
283 1HB MET 39 2HB MET 39 -3.013 10.223 0.682
284 2HB MET 39 3HB MET 39 -4.013 10.840 1.995
285 1HG MET 39 2HG MET 39 -4.777 11.029 -0.936
286 2HG MET 39 3HG MET 39 -5.361 9.795 0.195
287 1HE MET 39 1HE MET 39 -8.462 12.183 -0.367
288 2HE MET 39 2HE MET 39 -7.236 11.681 -1.553
289 3HE MET 39 3HE MET 39 -7.928 10.476 -0.432
290 H SER 40 H SER 40 -3.821 13.936 2.666
291 HA SER 40 HA SER 40 -1.265 14.390 3.905
292 1HB SER 40 2HB SER 40 -4.136 14.706 4.889
293 2HB SER 40 3HB SER 40 -2.717 15.256 5.799
294 HG SER 40 HG SER 40 -2.959 16.028 3.111
295 H ALA 41 H ALA 41 -0.451 13.564 5.817
296 HA ALA 41 HA ALA 41 -0.342 10.950 6.498
297 1HB ALA 41 1HB ALA 41 0.231 11.735 8.804
298 2HB ALA 41 2HB ALA 41 1.073 12.626 7.521
299 3HB ALA 41 3HB ALA 41 -0.316 13.360 8.359
300 H ASN 42 H ASN 42 -2.826 13.226 7.619
301 HA ASN 42 HA ASN 42 -4.269 11.665 9.437
302 1HB ASN 42 2HB ASN 42 -5.446 13.567 7.360
303 2HB ASN 42 3HB ASN 42 -6.182 13.093 8.895
304 1HD2 ASN 42 1HD2 ASN 42 -5.094 15.770 7.622
305 2HD2 ASN 42 2HD2 ASN 42 -4.122 16.420 8.926
306 H GLN 43 H GLN 43 -4.704 11.857 5.874
307 HA GLN 43 HA GLN 43 -6.950 9.961 5.910
308 1HB GLN 43 2HB GLN 43 -6.004 12.019 4.193
309 2HB GLN 43 3HB GLN 43 -5.902 10.518 3.275
310 1HG GLN 43 2HG GLN 43 -8.169 10.137 3.298
311 2HG GLN 43 3HG GLN 43 -8.447 10.958 4.840
312 1HE2 GLN 43 1HE2 GLN 43 -10.218 11.374 2.808
313 2HE2 GLN 43 2HE2 GLN 43 -10.061 13.047 2.305
314 H VAL 44 H VAL 44 -3.412 9.947 5.118
315 HA VAL 44 HA VAL 44 -3.352 7.313 4.074
316 HB VAL 44 HB VAL 44 -1.408 9.175 5.526
317 1HG1 VAL 44 1HG1 VAL 44 -0.542 7.003 5.907
318 2HG1 VAL 44 2HG1 VAL 44 -0.776 6.549 4.186
319 3HG1 VAL 44 3HG1 VAL 44 0.434 7.775 4.653
320 1HG2 VAL 44 1HG2 VAL 44 -0.474 9.536 3.289
321 2HG2 VAL 44 2HG2 VAL 44 -1.635 8.382 2.591
322 3HG2 VAL 44 3HG2 VAL 44 -2.195 9.917 3.276
323 H LYS 45 H LYS 45 -2.996 8.582 7.434
324 HA LYS 45 HA LYS 45 -2.706 6.085 8.734
325 1HB LYS 45 2HB LYS 45 -2.368 8.343 9.768
326 2HB LYS 45 3HB LYS 45 -4.121 8.592 9.746
327 1HG LYS 45 2HG LYS 45 -4.364 6.543 11.213
328 2HG LYS 45 3HG LYS 45 -2.592 6.452 11.275
329 1HD LYS 45 2HD LYS 45 -2.579 8.828 12.152
330 2HD LYS 45 3HD LYS 45 -4.354 8.776 12.192
331 1HE LYS 45 2HE LYS 45 -4.260 6.856 13.786
332 2HE LYS 45 3HE LYS 45 -2.489 6.889 13.726
333 1HZ LYS 45 1HZ LYS 45 -2.558 9.099 14.666
334 2HZ LYS 45 2HZ LYS 45 -4.202 9.057 14.747
335 3HZ LYS 45 3HZ LYS 45 -3.304 8.019 15.651
336 H ASP 46 H ASP 46 -5.725 7.959 7.928
337 HA ASP 46 HA ASP 46 -7.451 6.058 9.061
338 1HB ASP 46 2HB ASP 46 -8.168 8.318 8.280
339 2HB ASP 46 3HB ASP 46 -8.112 7.717 6.608
340 H VAL 47 H VAL 47 -6.325 6.205 5.614
341 HA VAL 47 HA VAL 47 -7.680 3.862 4.859
342 HB VAL 47 HB VAL 47 -6.432 3.695 2.944
343 1HG1 VAL 47 1HG1 VAL 47 -6.173 6.648 3.208
344 2HG1 VAL 47 2HG1 VAL 47 -6.844 5.675 1.909
345 3HG1 VAL 47 3HG1 VAL 47 -7.772 5.913 3.408
346 1HG2 VAL 47 1HG2 VAL 47 -4.211 5.401 3.914
347 2HG2 VAL 47 2HG2 VAL 47 -4.140 3.639 3.729
348 3HG2 VAL 47 3HG2 VAL 47 -4.398 4.678 2.325
349 H PHE 48 H PHE 48 -4.431 4.165 6.384
350 HA PHE 48 HA PHE 48 -3.777 1.422 6.415
351 1HB PHE 48 2HB PHE 48 -3.213 3.398 8.612
352 2HB PHE 48 3HB PHE 48 -2.447 1.838 8.373
353 HD1 PHE 48 1HD PHE 48 -0.869 4.225 8.742
354 HD2 PHE 48 2HD PHE 48 -2.411 2.491 5.093
355 HE1 PHE 48 1HE PHE 48 0.932 5.289 7.455
356 HE2 PHE 48 2HE PHE 48 -0.608 3.565 3.822
357 HZ PHE 48 HZ PHE 48 1.068 4.991 4.990
358 H ARG 49 H ARG 49 -6.186 3.092 8.472
359 HA ARG 49 HA ARG 49 -6.443 0.892 10.342
360 1HB ARG 49 2HB ARG 49 -8.580 2.870 9.463
361 2HB ARG 49 3HB ARG 49 -8.613 1.825 10.883
362 1HG ARG 49 2HG ARG 49 -6.673 3.015 11.856
363 2HG ARG 49 3HG ARG 49 -6.535 4.009 10.402
364 1HD ARG 49 2HD ARG 49 -7.702 5.324 12.020
365 2HD ARG 49 3HD ARG 49 -8.820 4.862 10.722
366 HE ARG 49 HE ARG 49 -8.811 2.992 12.959
367 1HH1 ARG 49 2HH2 ARG 49 -10.266 5.948 11.680
368 2HH1 ARG 49 1HH2 ARG 49 -11.538 6.025 12.856
369 1HH2 ARG 49 2HH1 ARG 49 -10.544 2.984 14.463
370 2HH2 ARG 49 1HH1 ARG 49 -11.736 4.243 14.454
371 H PHE 50 H PHE 50 -7.832 1.673 7.163
372 HA PHE 50 HA PHE 50 -9.694 -0.537 7.107
373 1HB PHE 50 2HB PHE 50 -9.406 1.684 5.591
374 2HB PHE 50 3HB PHE 50 -8.545 0.558 4.558
375 HD1 PHE 50 1HD PHE 50 -11.732 1.901 5.412
376 HD2 PHE 50 2HD PHE 50 -9.890 -1.816 4.236
377 HE1 PHE 50 1HE PHE 50 -13.935 0.998 4.755
378 HE2 PHE 50 2HE PHE 50 -12.088 -2.664 3.482
379 HZ PHE 50 HZ PHE 50 -14.114 -1.258 3.733
380 H ILE 51 H ILE 51 -6.338 0.002 5.969
381 HA ILE 51 HA ILE 51 -5.973 -2.545 4.776
382 HB ILE 51 HB ILE 51 -3.871 -0.859 6.172
383 1HG1 ILE 51 2HG1 ILE 51 -4.759 0.522 4.416
384 2HG1 ILE 51 3HG1 ILE 51 -3.247 -0.160 3.845
385 1HG2 ILE 51 1HG2 ILE 51 -3.541 -3.078 4.124
386 2HG2 ILE 51 2HG2 ILE 51 -2.269 -2.046 4.818
387 3HG2 ILE 51 3HG2 ILE 51 -3.158 -3.167 5.846
388 1HD1 ILE 51 1HD1 ILE 51 -4.748 -0.268 2.038
389 2HD1 ILE 51 2HD1 ILE 51 -4.671 -1.927 2.621
390 3HD1 ILE 51 3HD1 ILE 51 -6.073 -0.911 3.035
391 H ASP 52 H ASP 52 -5.189 -1.518 8.137
392 HA ASP 52 HA ASP 52 -4.308 -4.157 8.864
393 1HB ASP 52 2HB ASP 52 -3.497 -1.837 9.746
394 2HB ASP 52 3HB ASP 52 -4.855 -1.941 10.869
395 H ASN 53 H ASN 53 -6.404 -4.974 8.015
396 HA ASN 53 HA ASN 53 -8.926 -4.634 9.135
397 1HB ASN 53 2HB ASN 53 -8.501 -5.788 7.041
398 2HB ASN 53 3HB ASN 53 -7.655 -7.101 7.878
399 1HD2 ASN 53 1HD2 ASN 53 -8.889 -8.900 8.432
400 2HD2 ASN 53 2HD2 ASN 53 -10.642 -8.893 8.428
401 H ASP 54 H ASP 54 -6.243 -6.570 10.348
402 HA ASP 54 HA ASP 54 -7.736 -8.037 12.369
403 1HB ASP 54 2HB ASP 54 -5.437 -8.738 13.000
404 2HB ASP 54 3HB ASP 54 -5.753 -9.001 11.278
405 H GLN 55 H GLN 55 -6.021 -4.948 12.086
406 HA GLN 55 HA GLN 55 -5.443 -3.365 13.492
407 1HB GLN 55 2HB GLN 55 -8.071 -4.191 14.592
408 2HB GLN 55 3HB GLN 55 -7.074 -3.156 15.625
409 1HG GLN 55 2HG GLN 55 -6.764 -1.521 13.841
410 2HG GLN 55 3HG GLN 55 -7.697 -2.516 12.717
411 1HE2 GLN 55 1HE2 GLN 55 -9.961 -3.202 13.778
412 2HE2 GLN 55 2HE2 GLN 55 -10.860 -1.824 14.396
413 H SER 56 H SER 56 -3.672 -4.938 13.551
414 HA SER 56 HA SER 56 -3.010 -5.914 16.303
415 1HB SER 56 2HB SER 56 -0.952 -6.761 15.324
416 2HB SER 56 3HB SER 56 -2.371 -7.411 14.516
417 HG SER 56 HG SER 56 -0.538 -6.614 13.172
418 H GLY 57 H GLY 57 -1.898 -3.579 13.861
419 1HA GLY 57 1HA GLY 57 -0.848 -1.436 14.599
420 2HA GLY 57 2HA GLY 57 0.001 -2.354 15.849
421 H TYR 58 H TYR 58 0.103 -4.643 13.640
422 HA TYR 58 HA TYR 58 2.478 -3.566 12.163
423 1HB TYR 58 2HB TYR 58 2.065 -6.345 13.303
424 2HB TYR 58 3HB TYR 58 3.399 -5.843 12.272
425 HD1 TYR 58 HD1 TYR 58 4.859 -3.819 13.110
426 HD2 TYR 58 HD2 TYR 58 2.306 -6.189 15.656
427 HE1 TYR 58 HE1 TYR 58 6.099 -3.025 15.105
428 HE2 TYR 58 HE2 TYR 58 3.542 -5.392 17.640
429 HH TYR 58 HH TYR 58 5.206 -4.002 18.426
430 H LEU 59 H LEU 59 2.581 -3.951 10.044
431 HA LEU 59 HA LEU 59 0.418 -5.539 8.753
432 1HB LEU 59 2HB LEU 59 1.737 -2.976 8.248
433 2HB LEU 59 3HB LEU 59 1.944 -4.050 6.871
434 HG LEU 59 HG LEU 59 -0.801 -3.908 8.076
435 1HD1 LEU 59 1HD1 LEU 59 0.095 -1.705 6.219
436 2HD1 LEU 59 2HD1 LEU 59 -1.461 -1.928 7.034
437 3HD1 LEU 59 3HD1 LEU 59 -0.036 -1.524 7.986
438 1HD2 LEU 59 1HD2 LEU 59 -0.037 -5.406 6.155
439 2HD2 LEU 59 2HD2 LEU 59 -1.366 -4.342 5.705
440 3HD2 LEU 59 3HD2 LEU 59 0.298 -3.936 5.233
441 H ASP 60 H ASP 60 1.680 -7.339 9.805
442 HA ASP 60 HA ASP 60 4.073 -8.307 8.879
443 1HB ASP 60 2HB ASP 60 1.559 -9.922 9.479
444 2HB ASP 60 3HB ASP 60 3.226 -10.492 9.609
445 H GLU 61 H GLU 61 4.576 -10.058 7.333
446 HA GLU 61 HA GLU 61 4.173 -9.462 4.715
447 1HB GLU 61 2HB GLU 61 4.771 -12.143 6.025
448 2HB GLU 61 3HB GLU 61 4.778 -11.909 4.269
449 1HG GLU 61 2HG GLU 61 6.425 -10.161 4.426
450 2HG GLU 61 3HG GLU 61 6.488 -10.275 6.200
451 H GLU 62 H GLU 62 2.284 -12.048 6.334
452 HA GLU 62 HA GLU 62 0.691 -12.563 4.023
453 1HB GLU 62 2HB GLU 62 0.948 -14.230 5.775
454 2HB GLU 62 3HB GLU 62 0.246 -13.162 7.000
455 1HG GLU 62 2HG GLU 62 -1.929 -13.406 6.198
456 2HG GLU 62 3HG GLU 62 -1.399 -13.863 4.581
457 H GLU 63 H GLU 63 0.464 -9.999 6.407
458 HA GLU 63 HA GLU 63 -2.340 -9.441 5.858
459 1HB GLU 63 2HB GLU 63 -0.928 -8.873 7.925
460 2HB GLU 63 3HB GLU 63 -0.262 -7.532 6.984
461 1HG GLU 63 2HG GLU 63 -2.514 -6.599 6.663
462 2HG GLU 63 3HG GLU 63 -3.239 -8.016 7.465
463 H LEU 64 H LEU 64 0.872 -8.354 4.761
464 HA LEU 64 HA LEU 64 0.071 -6.402 2.906
465 1HB LEU 64 2HB LEU 64 2.470 -7.463 3.672
466 2HB LEU 64 3HB LEU 64 2.312 -8.171 2.076
467 HG LEU 64 HG LEU 64 3.587 -6.176 1.915
468 1HD1 LEU 64 1HD1 LEU 64 2.568 -4.981 0.208
469 2HD1 LEU 64 2HD1 LEU 64 1.658 -6.495 0.169
470 3HD1 LEU 64 3HD1 LEU 64 0.960 -5.072 0.929
471 1HD2 LEU 64 1HD2 LEU 64 2.988 -4.023 2.687
472 2HD2 LEU 64 2HD2 LEU 64 1.358 -4.531 3.164
473 3HD2 LEU 64 3HD2 LEU 64 2.765 -5.123 4.062
474 H LYS 65 H LYS 65 0.284 -9.941 2.585
475 HA LYS 65 HA LYS 65 -0.416 -10.273 -0.104
476 1HB LYS 65 2HB LYS 65 0.259 -12.026 1.619
477 2HB LYS 65 3HB LYS 65 -1.444 -12.025 2.116
478 1HG LYS 65 2HG LYS 65 -2.180 -12.870 -0.021
479 2HG LYS 65 3HG LYS 65 -0.567 -12.629 -0.710
480 1HD LYS 65 2HD LYS 65 -0.766 -14.974 -0.239
481 2HD LYS 65 3HD LYS 65 0.355 -14.271 0.931
482 1HE LYS 65 2HE LYS 65 -1.861 -14.091 2.441
483 2HE LYS 65 3HE LYS 65 -2.477 -15.316 1.344
484 1HZ LYS 65 1HZ LYS 65 -0.651 -16.737 2.042
485 2HZ LYS 65 2HZ LYS 65 -0.005 -15.521 2.956
486 3HZ LYS 65 3HZ LYS 65 -1.404 -16.160 3.391
487 H PHE 66 H PHE 66 -2.455 -8.931 2.395
488 HA PHE 66 HA PHE 66 -4.501 -8.647 0.310
489 1HB PHE 66 2HB PHE 66 -5.162 -9.191 3.240
490 2HB PHE 66 3HB PHE 66 -6.326 -8.864 1.963
491 HD1 PHE 66 1HD PHE 66 -3.930 -11.353 3.329
492 HD2 PHE 66 2HD PHE 66 -7.192 -10.666 0.584
493 HE1 PHE 66 1HE PHE 66 -4.215 -13.791 3.030
494 HE2 PHE 66 2HE PHE 66 -7.323 -13.085 0.132
495 HZ PHE 66 HZ PHE 66 -5.846 -14.666 1.358
496 H PHE 67 H PHE 67 -2.542 -6.844 0.647
497 HA PHE 67 HA PHE 67 -3.416 -4.661 2.366
498 1HB PHE 67 2HB PHE 67 -1.134 -4.922 1.928
499 2HB PHE 67 3HB PHE 67 -1.327 -4.940 0.194
500 HD1 PHE 67 1HD PHE 67 -1.449 -2.861 -1.069
501 HD2 PHE 67 2HD PHE 67 -0.983 -2.892 3.202
502 HE1 PHE 67 1HE PHE 67 -0.816 -0.477 -1.124
503 HE2 PHE 67 2HE PHE 67 -0.412 -0.479 3.163
504 HZ PHE 67 HZ PHE 67 -0.332 0.741 0.996
505 H LEU 68 H LEU 68 -3.033 -4.523 -1.237
506 HA LEU 68 HA LEU 68 -5.099 -2.509 -1.337
507 1HB LEU 68 2HB LEU 68 -2.929 -3.122 -2.895
508 2HB LEU 68 3HB LEU 68 -4.229 -3.842 -3.823
509 HG LEU 68 HG LEU 68 -5.376 -1.505 -3.609
510 1HD1 LEU 68 1HD1 LEU 68 -2.467 -0.830 -2.950
511 2HD1 LEU 68 2HD1 LEU 68 -3.762 0.348 -3.242
512 3HD1 LEU 68 3HD1 LEU 68 -3.803 -0.684 -1.797
513 1HD2 LEU 68 1HD2 LEU 68 -3.983 -0.623 -5.499
514 2HD2 LEU 68 2HD2 LEU 68 -2.809 -1.924 -5.200
515 3HD2 LEU 68 3HD2 LEU 68 -4.463 -2.313 -5.718
516 H GLN 69 H GLN 69 -5.350 -5.886 -1.231
517 HA GLN 69 HA GLN 69 -7.454 -6.610 -2.906
518 1HB GLN 69 2HB GLN 69 -6.838 -7.374 -0.022
519 2HB GLN 69 3HB GLN 69 -8.173 -8.102 -0.916
520 1HG GLN 69 2HG GLN 69 -5.292 -8.213 -1.877
521 2HG GLN 69 3HG GLN 69 -6.077 -9.475 -0.941
522 1HE2 GLN 69 1HE2 GLN 69 -5.465 -8.445 -4.134
523 2HE2 GLN 69 2HE2 GLN 69 -6.788 -9.347 -4.875
524 H LYS 70 H LYS 70 -7.691 -4.966 0.267
525 HA LYS 70 HA LYS 70 -10.556 -4.961 0.307
526 1HB LYS 70 2HB LYS 70 -10.215 -3.084 2.019
527 2HB LYS 70 3HB LYS 70 -9.793 -4.734 2.425
528 1HG LYS 70 2HG LYS 70 -7.662 -2.933 1.308
529 2HG LYS 70 3HG LYS 70 -8.222 -2.615 2.937
530 1HD LYS 70 2HD LYS 70 -6.986 -5.229 2.010
531 2HD LYS 70 3HD LYS 70 -6.247 -3.972 2.998
532 1HE LYS 70 2HE LYS 70 -8.072 -4.462 4.745
533 2HE LYS 70 3HE LYS 70 -8.432 -5.907 3.782
534 1HZ LYS 70 1HZ LYS 70 -5.928 -6.304 3.967
535 2HZ LYS 70 2HZ LYS 70 -5.981 -5.241 5.236
536 3HZ LYS 70 3HZ LYS 70 -6.866 -6.615 5.299
537 H PHE 71 H PHE 71 -8.482 -3.186 -1.713
538 HA PHE 71 HA PHE 71 -10.456 -0.973 -2.061
539 1HB PHE 71 2HB PHE 71 -7.629 -1.297 -3.096
540 2HB PHE 71 3HB PHE 71 -8.662 0.097 -3.304
541 HD1 PHE 71 1HD PHE 71 -6.001 0.491 -2.308
542 HD2 PHE 71 2HD PHE 71 -9.582 -0.426 -0.077
543 HE1 PHE 71 1HE PHE 71 -5.024 1.524 -0.278
544 HE2 PHE 71 2HE PHE 71 -8.600 0.578 1.923
545 HZ PHE 71 HZ PHE 71 -6.340 1.610 1.830
546 H GLU 72 H GLU 72 -8.437 -3.209 -4.061
547 HA GLU 72 HA GLU 72 -10.360 -2.708 -6.287
548 1HB GLU 72 2HB GLU 72 -7.788 -2.338 -6.407
549 2HB GLU 72 3HB GLU 72 -7.716 -4.111 -6.519
550 1HG GLU 72 2HG GLU 72 -7.619 -3.212 -8.725
551 2HG GLU 72 3HG GLU 72 -9.198 -3.981 -8.553
552 H SER 73 H SER 73 -9.468 -5.281 -4.089
553 HA SER 73 HA SER 73 -10.130 -7.396 -3.850
554 1HB SER 73 2HB SER 73 -12.351 -6.469 -4.751
555 2HB SER 73 3HB SER 73 -11.929 -7.257 -6.286
556 HG SER 73 HG SER 73 -13.162 -8.587 -4.850
557 H GLY 74 H GLY 74 -9.624 -6.600 -7.280
558 1HA GLY 74 1HA GLY 74 -8.091 -9.157 -7.696
559 2HA GLY 74 2HA GLY 74 -8.762 -8.115 -8.952
560 H ALA 75 H ALA 75 -6.851 -7.159 -6.072
561 HA ALA 75 HA ALA 75 -5.033 -5.613 -7.805
562 1HB ALA 75 1HB ALA 75 -4.159 -4.718 -5.787
563 2HB ALA 75 2HB ALA 75 -5.908 -4.694 -5.640
564 3HB ALA 75 3HB ALA 75 -4.997 -5.943 -4.788
565 H ARG 76 H ARG 76 -2.627 -5.806 -6.359
566 HA ARG 76 HA ARG 76 -1.686 -8.106 -7.931
567 1HB ARG 76 2HB ARG 76 -0.834 -5.575 -8.003
568 2HB ARG 76 3HB ARG 76 0.073 -6.066 -6.569
569 1HG ARG 76 2HG ARG 76 1.599 -6.749 -8.088
570 2HG ARG 76 3HG ARG 76 0.637 -8.202 -8.178
571 1HD ARG 76 2HD ARG 76 0.535 -7.811 -10.390
572 2HD ARG 76 3HD ARG 76 -0.760 -6.665 -10.012
573 HE ARG 76 HE ARG 76 1.836 -5.450 -9.714
574 1HH1 ARG 76 2HH2 ARG 76 -0.154 -6.645 -12.340
575 2HH1 ARG 76 1HH2 ARG 76 0.901 -6.045 -13.586
576 1HH2 ARG 76 2HH1 ARG 76 3.240 -4.957 -11.108
577 2HH2 ARG 76 1HH1 ARG 76 2.961 -4.896 -12.851
578 H GLU 77 H GLU 77 -2.306 -7.343 -4.720
579 HA GLU 77 HA GLU 77 -0.329 -7.892 -3.192
580 1HB GLU 77 2HB GLU 77 -2.935 -9.186 -2.415
581 2HB GLU 77 3HB GLU 77 -1.768 -8.290 -1.424
582 1HG GLU 77 2HG GLU 77 -3.860 -7.249 -3.338
583 2HG GLU 77 3HG GLU 77 -3.569 -6.826 -1.644
584 H LEU 78 H LEU 78 -2.164 -10.499 -4.602
585 HA LEU 78 HA LEU 78 -0.992 -12.758 -3.493
586 1HB LEU 78 2HB LEU 78 -1.504 -12.685 -6.474
587 2HB LEU 78 3HB LEU 78 -1.680 -14.003 -5.326
588 HG LEU 78 HG LEU 78 -3.846 -13.517 -5.782
589 1HD1 LEU 78 1HD1 LEU 78 -3.474 -13.316 -3.311
590 2HD1 LEU 78 2HD1 LEU 78 -3.596 -11.552 -3.482
591 3HD1 LEU 78 3HD1 LEU 78 -4.954 -12.573 -3.938
592 1HD2 LEU 78 1HD2 LEU 78 -3.868 -11.815 -7.277
593 2HD2 LEU 78 2HD2 LEU 78 -4.674 -11.025 -5.915
594 3HD2 LEU 78 3HD2 LEU 78 -2.962 -10.687 -6.281
595 H THR 79 H THR 79 0.371 -10.735 -6.164
596 HA THR 79 HA THR 79 2.566 -12.473 -6.700
597 HB THR 79 HB THR 79 2.447 -9.479 -7.228
598 HG1 THR 79 1HG THR 79 2.064 -10.591 -9.355
599 1HG2 THR 79 1HG2 THR 79 4.721 -10.500 -7.457
600 2HG2 THR 79 2HG2 THR 79 4.046 -11.804 -8.442
601 3HG2 THR 79 3HG2 THR 79 4.057 -10.147 -9.056
602 H GLU 80 H GLU 80 3.900 -12.975 -5.238
603 HA GLU 80 HA GLU 80 4.475 -11.558 -2.858
604 1HB GLU 80 2HB GLU 80 6.300 -13.124 -2.486
605 2HB GLU 80 3HB GLU 80 4.796 -13.919 -2.957
606 1HG GLU 80 2HG GLU 80 5.683 -14.210 -5.278
607 2HG GLU 80 3HG GLU 80 7.205 -13.449 -4.766
608 H SER 81 H SER 81 6.300 -11.584 -6.003
609 HA SER 81 HA SER 81 8.446 -10.044 -5.352
610 1HB SER 81 2HB SER 81 6.897 -9.288 -7.844
611 2HB SER 81 3HB SER 81 8.622 -9.492 -7.614
612 HG SER 81 HG SER 81 7.597 -11.050 -8.846
613 H GLU 82 H GLU 82 5.259 -8.733 -6.381
614 HA GLU 82 HA GLU 82 6.150 -6.022 -6.185
615 1HB GLU 82 2HB GLU 82 3.310 -7.096 -6.495
616 2HB GLU 82 3HB GLU 82 3.900 -5.477 -6.909
617 1HG GLU 82 2HG GLU 82 5.693 -6.769 -8.333
618 2HG GLU 82 3HG GLU 82 4.591 -8.150 -8.191
619 H THR 83 H THR 83 4.053 -8.101 -4.164
620 HA THR 83 HA THR 83 3.505 -6.300 -2.121
621 HB THR 83 HB THR 83 3.835 -9.274 -2.342
622 HG1 THR 83 1HG THR 83 1.932 -8.027 -0.809
623 1HG2 THR 83 1HG2 THR 83 5.018 -9.104 -0.235
624 2HG2 THR 83 2HG2 THR 83 3.876 -7.892 0.367
625 3HG2 THR 83 3HG2 THR 83 3.353 -9.572 0.106
626 H LYS 84 H LYS 84 6.416 -8.365 -2.595
627 HA LYS 84 HA LYS 84 7.698 -7.451 -0.219
628 1HB LYS 84 2HB LYS 84 8.713 -9.026 -2.590
629 2HB LYS 84 3HB LYS 84 9.711 -8.664 -1.183
630 1HG LYS 84 2HG LYS 84 6.998 -9.993 -0.873
631 2HG LYS 84 3HG LYS 84 8.418 -10.940 -1.260
632 1HD LYS 84 2HD LYS 84 8.672 -9.045 1.075
633 2HD LYS 84 3HD LYS 84 7.561 -10.408 1.279
634 1HE LYS 84 2HE LYS 84 9.309 -12.016 0.704
635 2HE LYS 84 3HE LYS 84 10.466 -10.709 0.387
636 1HZ LYS 84 1HZ LYS 84 10.708 -11.708 2.591
637 2HZ LYS 84 2HZ LYS 84 10.299 -10.121 2.733
638 3HZ LYS 84 3HZ LYS 84 9.192 -11.291 2.997
639 H SER 85 H SER 85 7.905 -6.317 -3.624
640 HA SER 85 HA SER 85 9.983 -4.458 -3.253
641 1HB SER 85 2HB SER 85 7.471 -4.245 -4.944
642 2HB SER 85 3HB SER 85 8.882 -3.181 -5.083
643 HG SER 85 HG SER 85 8.956 -4.928 -6.561
644 H LEU 86 H LEU 86 6.462 -4.172 -2.428
645 HA LEU 86 HA LEU 86 6.748 -1.486 -1.390
646 1HB LEU 86 2HB LEU 86 4.532 -2.992 -1.826
647 2HB LEU 86 3HB LEU 86 4.757 -3.410 -0.162
648 HG LEU 86 HG LEU 86 3.196 -1.546 -0.531
649 1HD1 LEU 86 1HD1 LEU 86 5.656 -0.768 1.071
650 2HD1 LEU 86 2HD1 LEU 86 4.056 -0.065 1.237
651 3HD1 LEU 86 3HD1 LEU 86 4.311 -1.776 1.652
652 1HD2 LEU 86 1HD2 LEU 86 4.639 -0.373 -2.397
653 2HD2 LEU 86 2HD2 LEU 86 3.737 0.579 -1.245
654 3HD2 LEU 86 3HD2 LEU 86 5.486 0.369 -1.041
655 H MET 87 H MET 87 6.495 -4.649 0.297
656 HA MET 87 HA MET 87 6.995 -3.759 2.795
657 1HB MET 87 2HB MET 87 6.359 -6.046 2.140
658 2HB MET 87 3HB MET 87 8.029 -6.386 1.676
659 1HG MET 87 2HG MET 87 8.775 -6.556 3.814
660 2HG MET 87 3HG MET 87 7.660 -5.362 4.469
661 1HE MET 87 1HE MET 87 4.899 -6.021 3.905
662 2HE MET 87 2HE MET 87 4.374 -7.284 5.041
663 3HE MET 87 3HE MET 87 5.331 -5.937 5.626
664 H ALA 88 H ALA 88 9.509 -4.730 0.509
665 HA ALA 88 HA ALA 88 11.836 -4.620 1.998
666 1HB ALA 88 1HB ALA 88 12.933 -4.126 -0.213
667 2HB ALA 88 2HB ALA 88 11.766 -5.458 -0.291
668 3HB ALA 88 3HB ALA 88 11.321 -3.861 -0.916
669 H ALA 89 H ALA 89 10.153 -1.890 0.371
670 HA ALA 89 HA ALA 89 12.289 -0.018 1.208
671 1HB ALA 89 1HB ALA 89 11.322 0.229 -0.973
672 2HB ALA 89 2HB ALA 89 9.682 0.402 -0.289
673 3HB ALA 89 3HB ALA 89 10.916 1.648 0.020
674 H ALA 90 H ALA 90 8.803 -0.589 1.851
675 HA ALA 90 HA ALA 90 8.392 1.556 3.678
676 1HB ALA 90 1HB ALA 90 6.523 0.413 2.767
677 2HB ALA 90 2HB ALA 90 7.110 -1.158 3.364
678 3HB ALA 90 3HB ALA 90 6.540 0.082 4.515
679 H ASP 91 H ASP 91 9.602 -1.774 4.258
680 HA ASP 91 HA ASP 91 9.686 -1.327 7.103
681 1HB ASP 91 2HB ASP 91 9.407 -3.605 6.104
682 2HB ASP 91 3HB ASP 91 11.064 -3.506 5.483
683 H ASN 92 H ASN 92 10.840 0.673 7.168
684 HA ASN 92 HA ASN 92 13.657 0.739 6.346
685 1HB ASN 92 2HB ASN 92 13.693 2.966 7.351
686 2HB ASN 92 3HB ASN 92 12.414 2.746 6.153
687 1HD2 ASN 92 1HD2 ASN 92 12.010 4.897 7.518
688 2HD2 ASN 92 2HD2 ASN 92 10.754 4.734 8.716
689 H ASP 93 H ASP 93 13.476 -1.459 7.752
690 HA ASP 93 HA ASP 93 15.049 -0.962 10.240
691 1HB ASP 93 2HB ASP 93 12.669 -2.850 9.920
692 2HB ASP 93 3HB ASP 93 13.871 -2.999 11.198
693 H GLY 94 H GLY 94 13.679 -3.532 8.139
694 1HA GLY 94 1HA GLY 94 14.964 -5.206 6.976
695 2HA GLY 94 2HA GLY 94 16.287 -5.013 8.137
696 H ASP 95 H ASP 95 12.741 -5.219 8.617
697 HA ASP 95 HA ASP 95 13.024 -7.817 10.020
698 1HB ASP 95 2HB ASP 95 11.392 -7.233 11.673
699 2HB ASP 95 3HB ASP 95 12.794 -6.166 11.770
700 H GLY 96 H GLY 96 10.409 -5.644 8.813
701 1HA GLY 96 1HA GLY 96 9.420 -6.310 6.574
702 2HA GLY 96 2HA GLY 96 9.296 -7.949 7.226
703 H LYS 97 H LYS 97 8.786 -6.451 9.961
704 HA LYS 97 HA LYS 97 5.829 -6.354 9.700
705 1HB LYS 97 2HB LYS 97 7.709 -6.375 12.099
706 2HB LYS 97 3HB LYS 97 5.949 -6.141 12.179
707 1HG LYS 97 2HG LYS 97 5.645 -8.284 10.913
708 2HG LYS 97 3HG LYS 97 7.398 -8.567 11.004
709 1HD LYS 97 2HD LYS 97 7.219 -8.543 13.509
710 2HD LYS 97 3HD LYS 97 5.471 -8.249 13.333
711 1HE LYS 97 2HE LYS 97 5.768 -10.454 11.706
712 2HE LYS 97 3HE LYS 97 7.047 -10.782 12.881
713 1HZ LYS 97 1HZ LYS 97 4.187 -10.293 13.284
714 2HZ LYS 97 2HZ LYS 97 4.940 -11.720 13.535
715 3HZ LYS 97 3HZ LYS 97 5.228 -10.463 14.579
716 H ILE 98 H ILE 98 5.350 -4.509 8.745
717 HA ILE 98 HA ILE 98 6.854 -2.047 9.316
718 HB ILE 98 HB ILE 98 4.703 -2.734 7.317
719 1HG1 ILE 98 2HG1 ILE 98 7.632 -2.087 6.858
720 2HG1 ILE 98 3HG1 ILE 98 7.158 -3.745 7.169
721 1HG2 ILE 98 1HG2 ILE 98 6.517 -0.271 7.417
722 2HG2 ILE 98 2HG2 ILE 98 5.218 -0.567 6.278
723 3HG2 ILE 98 3HG2 ILE 98 4.836 -0.251 7.964
724 1HD1 ILE 98 1HD1 ILE 98 7.361 -3.091 4.786
725 2HD1 ILE 98 2HD1 ILE 98 5.822 -3.872 5.222
726 3HD1 ILE 98 3HD1 ILE 98 5.869 -2.141 4.940
727 H GLY 99 H GLY 99 6.226 -0.851 11.038
728 1HA GLY 99 1HA GLY 99 3.550 -0.904 12.158
729 2HA GLY 99 2HA GLY 99 4.842 0.251 12.525
730 H ALA 100 H ALA 100 2.244 1.183 12.376
731 HA ALA 100 HA ALA 100 1.442 2.116 9.794
732 1HB ALA 100 1HB ALA 100 0.032 3.695 11.034
733 2HB ALA 100 2HB ALA 100 -0.113 2.047 11.671
734 3HB ALA 100 3HB ALA 100 0.855 3.262 12.550
735 H GLU 101 H GLU 101 3.613 3.431 12.314
736 HA GLU 101 HA GLU 101 4.045 5.929 11.077
737 1HB GLU 101 2HB GLU 101 5.737 4.322 13.030
738 2HB GLU 101 3HB GLU 101 6.148 5.956 12.487
739 1HG GLU 101 2HG GLU 101 4.026 6.843 13.311
740 2HG GLU 101 3HG GLU 101 3.472 5.228 13.789
741 H GLU 102 H GLU 102 6.105 2.949 10.951
742 HA GLU 102 HA GLU 102 7.955 3.644 9.036
743 1HB GLU 102 2HB GLU 102 6.414 1.020 9.194
744 2HB GLU 102 3HB GLU 102 7.942 1.285 8.332
745 1HG GLU 102 2HG GLU 102 9.050 1.736 10.504
746 2HG GLU 102 3HG GLU 102 7.538 1.373 11.348
747 H PHE 103 H PHE 103 4.633 2.417 8.414
748 HA PHE 103 HA PHE 103 4.739 2.693 5.580
749 1HB PHE 103 2HB PHE 103 2.632 2.224 7.629
750 2HB PHE 103 3HB PHE 103 2.092 3.062 6.207
751 HD1 PHE 103 1HD PHE 103 2.638 2.200 3.868
752 HD2 PHE 103 2HD PHE 103 2.623 -0.174 7.470
753 HE1 PHE 103 1HE PHE 103 2.252 0.140 2.533
754 HE2 PHE 103 2HE PHE 103 2.714 -2.226 6.085
755 HZ PHE 103 HZ PHE 103 2.381 -2.082 3.630
756 H GLN 104 H GLN 104 3.396 5.003 7.995
757 HA GLN 104 HA GLN 104 2.407 7.019 6.191
758 1HB GLN 104 2HB GLN 104 1.990 6.848 8.689
759 2HB GLN 104 3HB GLN 104 3.627 7.458 8.949
760 1HG GLN 104 2HG GLN 104 3.052 9.494 7.596
761 2HG GLN 104 3HG GLN 104 1.414 8.866 7.374
762 1HE2 GLN 104 1HE2 GLN 104 0.360 8.173 9.630
763 2HE2 GLN 104 2HE2 GLN 104 0.554 9.393 10.885
764 H GLU 105 H GLU 105 5.638 6.667 7.824
765 HA GLU 105 HA GLU 105 6.925 8.915 6.783
766 1HB GLU 105 2HB GLU 105 7.922 6.099 7.388
767 2HB GLU 105 3HB GLU 105 9.012 7.420 6.970
768 1HG GLU 105 2HG GLU 105 8.484 8.646 8.934
769 2HG GLU 105 3HG GLU 105 7.040 7.683 9.268
770 H MET 106 H MET 106 6.911 5.584 5.373
771 HA MET 106 HA MET 106 8.335 6.422 3.083
772 1HB MET 106 2HB MET 106 7.299 3.933 4.074
773 2HB MET 106 3HB MET 106 6.663 4.123 2.444
774 1HG MET 106 2HG MET 106 8.820 3.089 2.175
775 2HG MET 106 3HG MET 106 9.057 4.774 1.743
776 1HE MET 106 1HE MET 106 11.598 5.038 2.093
777 2HE MET 106 2HE MET 106 12.480 4.149 3.358
778 3HE MET 106 3HE MET 106 11.551 3.259 2.127
779 H VAL 107 H VAL 107 4.820 6.012 3.535
780 HA VAL 107 HA VAL 107 4.045 6.715 0.888
781 HB VAL 107 HB VAL 107 2.663 6.870 3.588
782 1HG1 VAL 107 1HG1 VAL 107 1.589 7.624 0.853
783 2HG1 VAL 107 2HG1 VAL 107 0.552 7.210 2.242
784 3HG1 VAL 107 3HG1 VAL 107 1.601 8.628 2.319
785 1HG2 VAL 107 1HG2 VAL 107 3.111 4.614 2.554
786 2HG2 VAL 107 2HG2 VAL 107 1.378 4.979 2.662
787 3HG2 VAL 107 3HG2 VAL 107 2.214 5.139 1.114
788 H HIS 108 H HIS 108 4.713 8.732 3.730
789 HA HIS 108 HA HIS 108 3.565 11.129 2.805
790 1HB HIS 108 2HB HIS 108 3.939 10.742 5.138
791 2HB HIS 108 3HB HIS 108 5.672 10.484 4.891
792 HD1 HIS 108 1HD HIS 108 3.130 13.330 5.145
793 HD2 HIS 108 2HD HIS 108 7.261 12.585 4.872
794 HE1 HIS 108 1HE HIS 108 4.313 15.513 5.761
795 H SER 109 H SER 109 6.658 9.565 2.350
796 HA SER 109 HA SER 109 8.338 11.628 1.757
797 1HB SER 109 2HB SER 109 8.746 9.066 1.989
798 2HB SER 109 3HB SER 109 8.403 8.990 0.250
799 HG SER 109 HG SER 109 10.196 10.949 0.965
Start of MODEL 8
1 1H MET 1 H1 MET 1 -17.144 4.212 0.542
2 2H MET 1 H2 MET 1 -18.737 4.334 0.893
3 3H MET 1 H3 MET 1 -17.789 5.585 1.161
4 HA MET 1 HA MET 1 -18.357 4.493 3.176
5 1HB MET 1 2HB MET 1 -18.087 2.246 3.652
6 2HB MET 1 3HB MET 1 -18.676 2.280 1.986
7 1HG MET 1 2HG MET 1 -16.232 2.038 1.271
8 2HG MET 1 3HG MET 1 -15.888 1.631 2.961
9 1HE MET 1 1HE MET 1 -16.959 -0.506 4.172
10 2HE MET 1 2HE MET 1 -18.611 -0.091 3.638
11 3HE MET 1 3HE MET 1 -17.954 -1.710 3.317
12 H SER 2 H SER 2 -15.181 3.906 1.543
13 HA SER 2 HA SER 2 -13.870 5.209 3.855
14 1HB SER 2 2HB SER 2 -12.921 2.505 2.794
15 2HB SER 2 3HB SER 2 -12.227 3.487 4.099
16 HG SER 2 HG SER 2 -13.547 1.855 4.907
17 H ILE 3 H ILE 3 -12.305 3.458 1.209
18 HA ILE 3 HA ILE 3 -11.125 6.055 0.365
19 HB ILE 3 HB ILE 3 -9.207 4.922 -0.217
20 1HG1 ILE 3 2HG1 ILE 3 -9.237 2.315 0.038
21 2HG1 ILE 3 3HG1 ILE 3 -10.921 2.438 -0.420
22 1HG2 ILE 3 1HG2 ILE 3 -9.660 5.033 2.253
23 2HG2 ILE 3 2HG2 ILE 3 -10.151 3.327 2.202
24 3HG2 ILE 3 3HG2 ILE 3 -8.507 3.780 1.761
25 1HD1 ILE 3 1HD1 ILE 3 -8.451 3.405 -1.961
26 2HD1 ILE 3 2HD1 ILE 3 -9.486 2.042 -2.376
27 3HD1 ILE 3 3HD1 ILE 3 -10.110 3.665 -2.544
28 H THR 4 H THR 4 -13.236 3.433 -0.711
29 HA THR 4 HA THR 4 -12.740 3.566 -3.475
30 HB THR 4 HB THR 4 -13.384 1.549 -2.178
31 HG1 THR 4 1HG THR 4 -15.183 2.692 -3.904
32 1HG2 THR 4 1HG2 THR 4 -15.675 1.301 -1.298
33 2HG2 THR 4 2HG2 THR 4 -14.863 2.587 -0.406
34 3HG2 THR 4 3HG2 THR 4 -16.047 2.988 -1.667
35 H ASP 5 H ASP 5 -13.830 6.004 -1.691
36 HA ASP 5 HA ASP 5 -16.040 7.063 -3.250
37 1HB ASP 5 2HB ASP 5 -17.158 5.236 -2.064
38 2HB ASP 5 3HB ASP 5 -16.291 5.678 -0.570
39 H VAL 6 H VAL 6 -13.517 7.950 -2.757
40 HA VAL 6 HA VAL 6 -14.012 10.337 -1.142
41 HB VAL 6 HB VAL 6 -12.959 8.433 0.322
42 1HG1 VAL 6 1HG1 VAL 6 -11.004 7.923 -1.189
43 2HG1 VAL 6 2HG1 VAL 6 -10.376 9.544 -0.835
44 3HG1 VAL 6 3HG1 VAL 6 -10.557 8.365 0.462
45 1HG2 VAL 6 1HG2 VAL 6 -11.840 11.252 0.320
46 2HG2 VAL 6 2HG2 VAL 6 -13.341 10.696 1.101
47 3HG2 VAL 6 3HG2 VAL 6 -11.774 10.098 1.672
48 H LEU 7 H LEU 7 -11.598 8.595 -3.064
49 HA LEU 7 HA LEU 7 -11.190 10.559 -5.051
50 1HB LEU 7 2HB LEU 7 -10.226 12.027 -3.426
51 2HB LEU 7 3HB LEU 7 -9.434 10.711 -2.579
52 HG LEU 7 HG LEU 7 -8.296 10.780 -5.214
53 1HD1 LEU 7 1HD1 LEU 7 -9.129 13.065 -5.459
54 2HD1 LEU 7 2HD1 LEU 7 -8.364 13.519 -3.913
55 3HD1 LEU 7 3HD1 LEU 7 -7.363 13.020 -5.292
56 1HD2 LEU 7 1HD2 LEU 7 -6.251 11.412 -3.914
57 2HD2 LEU 7 2HD2 LEU 7 -7.262 11.712 -2.487
58 3HD2 LEU 7 3HD2 LEU 7 -7.102 10.069 -3.156
59 H SER 8 H SER 8 -9.352 8.416 -2.868
60 HA SER 8 HA SER 8 -7.505 7.365 -4.350
61 1HB SER 8 2HB SER 8 -9.143 5.764 -2.404
62 2HB SER 8 3HB SER 8 -7.425 5.537 -2.807
63 HG SER 8 HG SER 8 -7.112 7.714 -2.056
64 H ALA 9 H ALA 9 -10.882 6.261 -4.730
65 HA ALA 9 HA ALA 9 -10.459 3.886 -6.154
66 1HB ALA 9 1HB ALA 9 -12.546 6.051 -6.680
67 2HB ALA 9 2HB ALA 9 -12.642 4.358 -7.217
68 3HB ALA 9 3HB ALA 9 -12.689 4.743 -5.486
69 H ASP 10 H ASP 10 -10.252 7.262 -7.403
70 HA ASP 10 HA ASP 10 -9.899 6.355 -10.157
71 1HB ASP 10 2HB ASP 10 -10.894 8.560 -9.472
72 2HB ASP 10 3HB ASP 10 -9.298 9.065 -8.889
73 H ASP 11 H ASP 11 -7.874 7.266 -7.416
74 HA ASP 11 HA ASP 11 -5.361 7.525 -8.764
75 1HB ASP 11 2HB ASP 11 -6.073 6.814 -5.881
76 2HB ASP 11 3HB ASP 11 -4.473 7.113 -6.456
77 H ILE 12 H ILE 12 -6.978 4.755 -7.057
78 HA ILE 12 HA ILE 12 -4.830 3.006 -7.516
79 HB ILE 12 HB ILE 12 -6.288 1.243 -7.031
80 1HG1 ILE 12 2HG1 ILE 12 -8.538 3.180 -6.766
81 2HG1 ILE 12 3HG1 ILE 12 -8.394 1.946 -8.029
82 1HG2 ILE 12 1HG2 ILE 12 -6.608 3.523 -5.052
83 2HG2 ILE 12 2HG2 ILE 12 -6.621 1.793 -4.697
84 3HG2 ILE 12 3HG2 ILE 12 -5.141 2.553 -5.272
85 1HD1 ILE 12 1HD1 ILE 12 -8.830 1.493 -5.058
86 2HD1 ILE 12 2HD1 ILE 12 -9.901 1.086 -6.405
87 3HD1 ILE 12 3HD1 ILE 12 -8.381 0.199 -6.199
88 H ALA 13 H ALA 13 -7.738 3.776 -9.495
89 HA ALA 13 HA ALA 13 -7.330 1.872 -11.517
90 1HB ALA 13 1HB ALA 13 -8.247 4.734 -12.001
91 2HB ALA 13 2HB ALA 13 -8.558 3.306 -12.995
92 3HB ALA 13 3HB ALA 13 -9.277 3.427 -11.377
93 H ALA 14 H ALA 14 -5.835 5.140 -11.227
94 HA ALA 14 HA ALA 14 -4.086 4.962 -13.480
95 1HB ALA 14 1HB ALA 14 -4.443 7.028 -12.180
96 2HB ALA 14 2HB ALA 14 -3.517 6.340 -10.830
97 3HB ALA 14 3HB ALA 14 -2.726 6.623 -12.388
98 H ALA 15 H ALA 15 -3.251 4.132 -10.063
99 HA ALA 15 HA ALA 15 -0.704 3.147 -10.560
100 1HB ALA 15 1HB ALA 15 -2.674 2.007 -8.521
101 2HB ALA 15 2HB ALA 15 -0.898 2.059 -8.419
102 3HB ALA 15 3HB ALA 15 -1.837 3.554 -8.354
103 H LEU 16 H LEU 16 -3.733 1.381 -10.556
104 HA LEU 16 HA LEU 16 -2.887 -1.213 -10.994
105 1HB LEU 16 2HB LEU 16 -5.407 0.305 -11.504
106 2HB LEU 16 3HB LEU 16 -5.188 -1.035 -12.594
107 HG LEU 16 HG LEU 16 -6.558 -1.646 -10.724
108 1HD1 LEU 16 1HD1 LEU 16 -5.170 -3.344 -11.885
109 2HD1 LEU 16 2HD1 LEU 16 -3.929 -3.175 -10.623
110 3HD1 LEU 16 3HD1 LEU 16 -5.549 -3.762 -10.206
111 1HD2 LEU 16 1HD2 LEU 16 -5.704 -0.289 -8.925
112 2HD2 LEU 16 2HD2 LEU 16 -5.628 -1.988 -8.464
113 3HD2 LEU 16 3HD2 LEU 16 -4.141 -1.141 -8.944
114 H GLN 17 H GLN 17 -3.470 1.370 -13.445
115 HA GLN 17 HA GLN 17 -2.849 -0.565 -15.583
116 1HB GLN 17 2HB GLN 17 -4.591 1.069 -15.935
117 2HB GLN 17 3HB GLN 17 -3.440 2.408 -15.768
118 1HG GLN 17 2HG GLN 17 -2.566 2.077 -17.874
119 2HG GLN 17 3HG GLN 17 -2.580 0.321 -17.715
120 1HE2 GLN 17 1HE2 GLN 17 -5.190 2.838 -17.791
121 2HE2 GLN 17 2HE2 GLN 17 -6.110 1.993 -19.026
122 H GLU 18 H GLU 18 -1.378 2.329 -14.108
123 HA GLU 18 HA GLU 18 0.906 2.645 -15.621
124 1HB GLU 18 2HB GLU 18 0.165 4.142 -13.852
125 2HB GLU 18 3HB GLU 18 0.453 2.908 -12.620
126 1HG GLU 18 2HG GLU 18 2.129 4.643 -12.605
127 2HG GLU 18 3HG GLU 18 2.865 3.068 -12.972
128 H CYS 19 H CYS 19 0.486 0.396 -12.823
129 HA CYS 19 HA CYS 19 3.080 -0.928 -13.558
130 1HB CYS 19 2HB CYS 19 1.501 -0.933 -10.964
131 2HB CYS 19 3HB CYS 19 3.036 -1.781 -11.261
132 HG CYS 19 HG CYS 19 2.407 1.432 -11.550
133 H ARG 20 H ARG 20 1.024 -1.546 -15.329
134 HA ARG 20 HA ARG 20 -0.527 -3.779 -14.360
135 1HB ARG 20 2HB ARG 20 -1.269 -4.197 -16.495
136 2HB ARG 20 3HB ARG 20 -1.310 -2.458 -16.282
137 1HG ARG 20 2HG ARG 20 0.966 -3.820 -17.822
138 2HG ARG 20 3HG ARG 20 -0.605 -3.585 -18.530
139 1HD ARG 20 2HD ARG 20 -0.432 -1.115 -18.098
140 2HD ARG 20 3HD ARG 20 1.192 -1.384 -17.467
141 HE ARG 20 HE ARG 20 2.021 -1.933 -19.528
142 1HH1 ARG 20 2HH2 ARG 20 -1.480 -1.912 -19.680
143 2HH1 ARG 20 1HH2 ARG 20 -1.643 -1.655 -21.386
144 1HH2 ARG 20 2HH1 ARG 20 1.872 -1.278 -21.862
145 2HH2 ARG 20 1HH1 ARG 20 0.328 -1.313 -22.665
146 H ASP 21 H ASP 21 2.462 -3.348 -16.116
147 HA ASP 21 HA ASP 21 2.988 -6.004 -16.805
148 1HB ASP 21 2HB ASP 21 4.637 -3.449 -16.558
149 2HB ASP 21 3HB ASP 21 5.304 -4.948 -17.162
150 HA PRO 22 HA PRO 22 3.991 -7.591 -12.861
151 1HB PRO 22 2HB PRO 22 5.534 -9.809 -13.406
152 2HB PRO 22 3HB PRO 22 3.776 -9.704 -13.713
153 1HG PRO 22 2HG PRO 22 6.026 -9.188 -15.675
154 2HG PRO 22 3HG PRO 22 4.589 -10.230 -15.911
155 1HD PRO 22 2HD PRO 22 4.648 -7.693 -16.865
156 2HD PRO 22 3HD PRO 22 3.154 -8.321 -16.101
157 H ASP 23 H ASP 23 5.520 -7.535 -11.190
158 HA ASP 23 HA ASP 23 7.227 -7.106 -10.051
159 1HB ASP 23 2HB ASP 23 8.346 -8.733 -11.655
160 2HB ASP 23 3HB ASP 23 9.099 -7.325 -12.424
161 H THR 24 H THR 24 6.078 -5.001 -12.255
162 HA THR 24 HA THR 24 8.100 -2.937 -12.209
163 HB THR 24 HB THR 24 5.182 -2.731 -13.073
164 HG1 THR 24 1HG THR 24 5.909 -4.310 -14.284
165 1HG2 THR 24 1HG2 THR 24 6.232 -0.525 -13.086
166 2HG2 THR 24 2HG2 THR 24 7.649 -1.174 -13.951
167 3HG2 THR 24 3HG2 THR 24 6.063 -1.106 -14.746
168 H PHE 25 H PHE 25 5.602 -3.754 -9.999
169 HA PHE 25 HA PHE 25 4.878 -1.042 -9.448
170 1HB PHE 25 2HB PHE 25 3.835 -3.501 -9.033
171 2HB PHE 25 3HB PHE 25 4.285 -3.069 -7.390
172 HD1 PHE 25 1HD PHE 25 3.529 0.012 -7.876
173 HD2 PHE 25 2HD PHE 25 1.557 -3.751 -8.634
174 HE1 PHE 25 1HE PHE 25 1.340 1.148 -7.903
175 HE2 PHE 25 2HE PHE 25 -0.641 -2.621 -8.534
176 HZ PHE 25 HZ PHE 25 -0.766 -0.185 -8.133
177 H GLU 26 H GLU 26 6.742 0.151 -8.927
178 HA GLU 26 HA GLU 26 8.356 -0.530 -6.636
179 1HB GLU 26 2HB GLU 26 8.338 1.639 -8.688
180 2HB GLU 26 3HB GLU 26 8.845 2.149 -7.077
181 1HG GLU 26 2HG GLU 26 10.460 0.117 -7.126
182 2HG GLU 26 3HG GLU 26 10.148 0.114 -8.871
183 HA PRO 27 HA PRO 27 5.901 1.199 -3.545
184 1HB PRO 27 2HB PRO 27 7.753 2.095 -1.644
185 2HB PRO 27 3HB PRO 27 7.364 0.390 -1.978
186 1HG PRO 27 2HG PRO 27 9.727 1.969 -2.980
187 2HG PRO 27 3HG PRO 27 9.649 0.262 -2.452
188 1HD PRO 27 2HD PRO 27 9.651 0.994 -5.072
189 2HD PRO 27 3HD PRO 27 8.855 -0.479 -4.442
190 H GLN 28 H GLN 28 8.643 3.593 -3.672
191 HA GLN 28 HA GLN 28 7.068 5.855 -3.074
192 1HB GLN 28 2HB GLN 28 9.648 5.589 -4.647
193 2HB GLN 28 3HB GLN 28 8.920 7.145 -4.213
194 1HG GLN 28 2HG GLN 28 9.072 6.646 -1.830
195 2HG GLN 28 3HG GLN 28 9.664 5.014 -2.169
196 1HE2 GLN 28 1HE2 GLN 28 10.660 8.357 -1.690
197 2HE2 GLN 28 2HE2 GLN 28 12.327 8.067 -2.126
198 H LYS 29 H LYS 29 7.883 4.459 -6.227
199 HA LYS 29 HA LYS 29 6.508 6.073 -8.025
200 1HB LYS 29 2HB LYS 29 7.855 4.088 -8.629
201 2HB LYS 29 3HB LYS 29 6.671 3.058 -7.832
202 1HG LYS 29 2HG LYS 29 5.970 2.713 -9.920
203 2HG LYS 29 3HG LYS 29 4.976 4.132 -9.599
204 1HD LYS 29 2HD LYS 29 6.833 5.532 -10.673
205 2HD LYS 29 3HD LYS 29 7.635 3.996 -11.086
206 1HE LYS 29 2HE LYS 29 5.438 3.279 -12.220
207 2HE LYS 29 3HE LYS 29 4.839 4.920 -11.952
208 1HZ LYS 29 1HZ LYS 29 7.126 4.145 -13.634
209 2HZ LYS 29 2HZ LYS 29 5.628 4.656 -14.094
210 3HZ LYS 29 3HZ LYS 29 6.644 5.711 -13.351
211 H PHE 30 H PHE 30 5.079 3.199 -6.307
212 HA PHE 30 HA PHE 30 2.428 3.660 -7.082
213 1HB PHE 30 2HB PHE 30 3.080 1.558 -6.136
214 2HB PHE 30 3HB PHE 30 3.667 2.311 -4.676
215 HD1 PHE 30 1HD PHE 30 0.325 2.659 -6.444
216 HD2 PHE 30 2HD PHE 30 2.467 1.574 -2.868
217 HE1 PHE 30 1HE PHE 30 -1.803 2.095 -5.339
218 HE2 PHE 30 2HE PHE 30 0.313 1.350 -1.666
219 HZ PHE 30 HZ PHE 30 -1.836 1.524 -2.926
220 H PHE 31 H PHE 31 4.077 4.749 -4.066
221 HA PHE 31 HA PHE 31 1.824 5.986 -2.908
222 1HB PHE 31 2HB PHE 31 4.688 6.921 -2.630
223 2HB PHE 31 3HB PHE 31 3.380 7.125 -1.471
224 HD1 PHE 31 1HD PHE 31 2.373 4.088 -1.776
225 HD2 PHE 31 2HD PHE 31 6.172 5.965 -0.956
226 HE1 PHE 31 1HE PHE 31 3.164 2.030 -0.672
227 HE2 PHE 31 2HE PHE 31 6.994 3.854 0.018
228 HZ PHE 31 HZ PHE 31 5.507 1.874 0.165
229 H GLN 32 H GLN 32 4.067 7.221 -5.382
230 HA GLN 32 HA GLN 32 3.019 9.937 -5.253
231 1HB GLN 32 2HB GLN 32 5.345 9.304 -6.072
232 2HB GLN 32 3HB GLN 32 4.572 8.624 -7.511
233 1HG GLN 32 2HG GLN 32 3.397 10.995 -7.668
234 2HG GLN 32 3HG GLN 32 4.681 11.511 -6.573
235 1HE2 GLN 32 1HE2 GLN 32 6.942 11.376 -7.396
236 2HE2 GLN 32 2HE2 GLN 32 7.199 11.326 -9.133
237 H THR 33 H THR 33 2.742 7.153 -7.587
238 HA THR 33 HA THR 33 1.083 8.383 -9.360
239 HB THR 33 HB THR 33 2.428 6.045 -9.338
240 HG1 THR 33 1HG THR 33 0.172 6.764 -10.751
241 1HG2 THR 33 1HG2 THR 33 0.695 4.870 -7.853
242 2HG2 THR 33 2HG2 THR 33 -0.441 5.102 -9.189
243 3HG2 THR 33 3HG2 THR 33 1.031 4.131 -9.423
244 H SER 34 H SER 34 0.270 6.594 -6.398
245 HA SER 34 HA SER 34 -2.535 6.733 -6.992
246 1HB SER 34 2HB SER 34 -1.012 5.659 -4.604
247 2HB SER 34 3HB SER 34 -2.783 5.615 -4.751
248 HG SER 34 HG SER 34 -2.510 4.570 -6.768
249 H GLY 35 H GLY 35 -0.446 9.141 -5.743
250 1HA GLY 35 1HA GLY 35 -1.085 11.240 -5.048
251 2HA GLY 35 2HA GLY 35 -2.775 10.722 -4.986
252 H LEU 36 H LEU 36 -1.762 8.410 -3.216
253 HA LEU 36 HA LEU 36 -2.190 9.107 -0.631
254 1HB LEU 36 2HB LEU 36 -0.186 7.151 -1.819
255 2HB LEU 36 3HB LEU 36 -0.664 7.156 -0.132
256 HG LEU 36 HG LEU 36 -2.551 6.679 -2.487
257 1HD1 LEU 36 1HD1 LEU 36 -0.938 4.844 -2.119
258 2HD1 LEU 36 2HD1 LEU 36 -1.448 4.743 -0.419
259 3HD1 LEU 36 3HD1 LEU 36 -2.595 4.364 -1.722
260 1HD2 LEU 36 1HD2 LEU 36 -3.851 7.648 -0.689
261 2HD2 LEU 36 2HD2 LEU 36 -4.146 5.913 -0.702
262 3HD2 LEU 36 3HD2 LEU 36 -3.056 6.607 0.516
263 H SER 37 H SER 37 0.829 9.697 -2.427
264 HA SER 37 HA SER 37 2.395 10.442 -0.132
265 1HB SER 37 2HB SER 37 3.607 9.980 -2.137
266 2HB SER 37 3HB SER 37 2.569 11.057 -3.099
267 HG SER 37 HG SER 37 4.768 11.677 -1.516
268 H LYS 38 H LYS 38 -0.019 12.151 -2.031
269 HA LYS 38 HA LYS 38 0.774 14.692 -0.821
270 1HB LYS 38 2HB LYS 38 0.086 14.217 -3.354
271 2HB LYS 38 3HB LYS 38 -1.545 14.464 -2.730
272 1HG LYS 38 2HG LYS 38 -0.827 16.654 -1.769
273 2HG LYS 38 3HG LYS 38 0.818 16.360 -2.384
274 1HD LYS 38 2HD LYS 38 -0.072 16.327 -4.724
275 2HD LYS 38 3HD LYS 38 -1.702 16.582 -4.098
276 1HE LYS 38 2HE LYS 38 -0.819 18.700 -4.914
277 2HE LYS 38 3HE LYS 38 -1.052 18.779 -3.162
278 1HZ LYS 38 1HZ LYS 38 1.527 18.313 -4.524
279 2HZ LYS 38 2HZ LYS 38 1.040 19.732 -3.851
280 3HZ LYS 38 3HZ LYS 38 1.310 18.426 -2.895
281 H MET 39 H MET 39 -1.719 12.244 -0.745
282 HA MET 39 HA MET 39 -3.989 13.218 0.100
283 1HB MET 39 2HB MET 39 -2.457 10.823 0.871
284 2HB MET 39 3HB MET 39 -3.673 11.259 2.041
285 1HG MET 39 2HG MET 39 -4.263 10.809 -0.897
286 2HG MET 39 3HG MET 39 -4.491 9.667 0.436
287 1HE MET 39 1HE MET 39 -6.844 9.085 0.766
288 2HE MET 39 2HE MET 39 -8.176 10.123 0.213
289 3HE MET 39 3HE MET 39 -6.917 9.598 -0.933
290 H SER 40 H SER 40 -1.697 12.465 2.659
291 HA SER 40 HA SER 40 -1.009 14.347 4.194
292 1HB SER 40 2HB SER 40 -4.027 14.293 4.683
293 2HB SER 40 3HB SER 40 -2.852 14.889 5.864
294 HG SER 40 HG SER 40 -3.249 15.882 3.259
295 H ALA 41 H ALA 41 -0.318 13.531 6.146
296 HA ALA 41 HA ALA 41 -0.067 10.874 6.702
297 1HB ALA 41 1HB ALA 41 -0.347 13.198 8.662
298 2HB ALA 41 2HB ALA 41 0.274 11.596 9.084
299 3HB ALA 41 3HB ALA 41 1.154 12.603 7.913
300 H ASN 42 H ASN 42 -2.751 12.966 7.668
301 HA ASN 42 HA ASN 42 -4.062 11.210 9.471
302 1HB ASN 42 2HB ASN 42 -5.267 13.348 7.652
303 2HB ASN 42 3HB ASN 42 -6.094 12.566 9.007
304 1HD2 ASN 42 1HD2 ASN 42 -6.106 15.215 9.188
305 2HD2 ASN 42 2HD2 ASN 42 -4.892 15.784 10.320
306 H GLN 43 H GLN 43 -4.719 11.802 5.997
307 HA GLN 43 HA GLN 43 -6.764 9.791 5.810
308 1HB GLN 43 2HB GLN 43 -5.447 11.740 4.019
309 2HB GLN 43 3HB GLN 43 -5.714 10.196 3.218
310 1HG GLN 43 2HG GLN 43 -7.869 11.709 4.749
311 2HG GLN 43 3HG GLN 43 -7.625 11.824 3.001
312 1HE2 GLN 43 1HE2 GLN 43 -10.073 10.868 4.301
313 2HE2 GLN 43 2HE2 GLN 43 -10.241 9.186 3.833
314 H VAL 44 H VAL 44 -3.297 9.858 4.726
315 HA VAL 44 HA VAL 44 -3.146 7.229 3.820
316 HB VAL 44 HB VAL 44 -1.175 9.061 5.279
317 1HG1 VAL 44 1HG1 VAL 44 -0.266 6.860 5.503
318 2HG1 VAL 44 2HG1 VAL 44 -0.578 6.494 3.775
319 3HG1 VAL 44 3HG1 VAL 44 0.631 7.717 4.241
320 1HG2 VAL 44 1HG2 VAL 44 -1.497 8.391 2.319
321 2HG2 VAL 44 2HG2 VAL 44 -2.058 9.885 3.083
322 3HG2 VAL 44 3HG2 VAL 44 -0.333 9.532 3.034
323 H LYS 45 H LYS 45 -2.775 8.386 7.226
324 HA LYS 45 HA LYS 45 -2.245 5.805 8.308
325 1HB LYS 45 2HB LYS 45 -1.688 7.864 9.398
326 2HB LYS 45 3HB LYS 45 -3.378 8.334 9.566
327 1HG LYS 45 2HG LYS 45 -2.423 5.699 10.739
328 2HG LYS 45 3HG LYS 45 -1.937 7.230 11.474
329 1HD LYS 45 2HD LYS 45 -4.545 7.797 11.355
330 2HD LYS 45 3HD LYS 45 -4.722 6.050 11.285
331 1HE LYS 45 2HE LYS 45 -3.376 7.761 13.439
332 2HE LYS 45 3HE LYS 45 -4.873 6.838 13.606
333 1HZ LYS 45 1HZ LYS 45 -3.020 5.723 14.629
334 2HZ LYS 45 2HZ LYS 45 -3.546 4.819 13.356
335 3HZ LYS 45 3HZ LYS 45 -2.170 5.709 13.228
336 H ASP 46 H ASP 46 -5.359 7.610 7.899
337 HA ASP 46 HA ASP 46 -7.023 5.654 9.109
338 1HB ASP 46 2HB ASP 46 -7.862 7.873 8.530
339 2HB ASP 46 3HB ASP 46 -7.640 7.543 6.800
340 H VAL 47 H VAL 47 -6.103 6.019 5.623
341 HA VAL 47 HA VAL 47 -7.413 3.655 4.839
342 HB VAL 47 HB VAL 47 -6.329 3.654 2.816
343 1HG1 VAL 47 1HG1 VAL 47 -6.806 5.750 1.945
344 2HG1 VAL 47 2HG1 VAL 47 -7.779 5.701 3.431
345 3HG1 VAL 47 3HG1 VAL 47 -6.258 6.602 3.385
346 1HG2 VAL 47 1HG2 VAL 47 -4.131 5.406 3.717
347 2HG2 VAL 47 2HG2 VAL 47 -3.981 3.667 3.403
348 3HG2 VAL 47 3HG2 VAL 47 -4.395 4.786 2.093
349 H PHE 48 H PHE 48 -4.045 4.038 6.162
350 HA PHE 48 HA PHE 48 -3.493 1.255 5.881
351 1HB PHE 48 2HB PHE 48 -2.390 3.276 7.844
352 2HB PHE 48 3HB PHE 48 -1.822 1.611 7.725
353 HD1 PHE 48 1HD PHE 48 -1.562 0.950 4.938
354 HD2 PHE 48 2HD PHE 48 -0.574 4.601 7.023
355 HE1 PHE 48 1HE PHE 48 0.034 1.549 3.156
356 HE2 PHE 48 2HE PHE 48 1.126 5.091 5.286
357 HZ PHE 48 HZ PHE 48 1.373 3.596 3.333
358 H ARG 49 H ARG 49 -5.240 2.969 8.511
359 HA ARG 49 HA ARG 49 -5.483 0.597 10.138
360 1HB ARG 49 2HB ARG 49 -7.495 2.874 9.870
361 2HB ARG 49 3HB ARG 49 -7.509 1.570 11.055
362 1HG ARG 49 2HG ARG 49 -5.052 2.427 11.624
363 2HG ARG 49 3HG ARG 49 -5.625 3.897 10.817
364 1HD ARG 49 2HD ARG 49 -6.134 4.206 13.130
365 2HD ARG 49 3HD ARG 49 -7.674 3.803 12.340
366 HE ARG 49 HE ARG 49 -6.468 1.387 13.248
367 1HH1 ARG 49 2HH2 ARG 49 -8.028 4.259 14.545
368 2HH1 ARG 49 1HH2 ARG 49 -8.391 3.568 16.097
369 1HH2 ARG 49 2HH1 ARG 49 -7.407 0.356 15.172
370 2HH2 ARG 49 1HH1 ARG 49 -7.703 1.345 16.549
371 H PHE 50 H PHE 50 -7.438 1.825 7.352
372 HA PHE 50 HA PHE 50 -9.370 -0.254 7.513
373 1HB PHE 50 2HB PHE 50 -9.487 1.865 6.128
374 2HB PHE 50 3HB PHE 50 -8.427 1.088 4.959
375 HD1 PHE 50 1HD PHE 50 -9.449 -0.144 3.187
376 HD2 PHE 50 2HD PHE 50 -11.645 0.497 6.841
377 HE1 PHE 50 1HE PHE 50 -11.473 -1.136 2.147
378 HE2 PHE 50 2HE PHE 50 -13.638 -0.574 5.823
379 HZ PHE 50 HZ PHE 50 -13.564 -1.354 3.460
380 H ILE 51 H ILE 51 -6.214 -0.127 5.789
381 HA ILE 51 HA ILE 51 -6.363 -2.773 4.707
382 HB ILE 51 HB ILE 51 -4.036 -0.953 5.336
383 1HG1 ILE 51 2HG1 ILE 51 -3.698 -1.557 2.773
384 2HG1 ILE 51 3HG1 ILE 51 -5.386 -2.045 2.817
385 1HG2 ILE 51 1HG2 ILE 51 -3.213 -3.245 5.800
386 2HG2 ILE 51 2HG2 ILE 51 -3.808 -3.763 4.207
387 3HG2 ILE 51 3HG2 ILE 51 -2.534 -2.526 4.354
388 1HD1 ILE 51 1HD1 ILE 51 -6.030 0.228 3.378
389 2HD1 ILE 51 2HD1 ILE 51 -4.321 0.695 3.641
390 3HD1 ILE 51 3HD1 ILE 51 -4.874 0.263 2.025
391 H ASP 52 H ASP 52 -5.031 -1.688 7.885
392 HA ASP 52 HA ASP 52 -4.124 -4.319 8.608
393 1HB ASP 52 2HB ASP 52 -3.229 -2.116 9.488
394 2HB ASP 52 3HB ASP 52 -4.682 -1.982 10.480
395 H ASN 53 H ASN 53 -6.148 -5.303 7.929
396 HA ASN 53 HA ASN 53 -8.685 -4.845 8.903
397 1HB ASN 53 2HB ASN 53 -8.090 -6.069 6.879
398 2HB ASN 53 3HB ASN 53 -7.427 -7.407 7.830
399 1HD2 ASN 53 1HD2 ASN 53 -8.845 -9.058 8.468
400 2HD2 ASN 53 2HD2 ASN 53 -10.572 -8.980 8.173
401 H ASP 54 H ASP 54 -6.208 -7.017 10.217
402 HA ASP 54 HA ASP 54 -7.818 -8.240 12.309
403 1HB ASP 54 2HB ASP 54 -5.551 -8.964 13.064
404 2HB ASP 54 3HB ASP 54 -5.804 -9.316 11.343
405 H GLN 55 H GLN 55 -6.061 -5.235 11.813
406 HA GLN 55 HA GLN 55 -5.581 -3.484 13.033
407 1HB GLN 55 2HB GLN 55 -8.145 -4.452 14.200
408 2HB GLN 55 3HB GLN 55 -7.252 -3.357 15.245
409 1HG GLN 55 2HG GLN 55 -7.007 -1.776 13.301
410 2HG GLN 55 3HG GLN 55 -8.122 -2.806 12.386
411 1HE2 GLN 55 1HE2 GLN 55 -10.236 -3.336 13.714
412 2HE2 GLN 55 2HE2 GLN 55 -10.932 -1.981 14.584
413 H SER 56 H SER 56 -3.921 -5.817 13.523
414 HA SER 56 HA SER 56 -3.074 -5.854 16.209
415 1HB SER 56 2HB SER 56 -0.854 -6.434 15.248
416 2HB SER 56 3HB SER 56 -2.176 -7.358 14.530
417 HG SER 56 HG SER 56 -0.725 -5.168 13.451
418 H GLY 57 H GLY 57 -2.642 -3.312 13.727
419 1HA GLY 57 1HA GLY 57 -1.860 -1.137 14.058
420 2HA GLY 57 2HA GLY 57 -1.124 -1.577 15.611
421 H TYR 58 H TYR 58 -1.053 -3.223 12.449
422 HA TYR 58 HA TYR 58 1.637 -2.648 11.711
423 1HB TYR 58 2HB TYR 58 1.246 -5.206 13.325
424 2HB TYR 58 3HB TYR 58 2.347 -5.175 11.971
425 HD1 TYR 58 HD1 TYR 58 2.069 -4.451 15.473
426 HD2 TYR 58 HD2 TYR 58 4.236 -3.529 11.874
427 HE1 TYR 58 HE1 TYR 58 3.973 -3.638 16.828
428 HE2 TYR 58 HE2 TYR 58 6.122 -2.640 13.227
429 HH TYR 58 HH TYR 58 6.065 -2.669 16.803
430 H LEU 59 H LEU 59 1.932 -3.035 9.715
431 HA LEU 59 HA LEU 59 -0.004 -4.689 8.222
432 1HB LEU 59 2HB LEU 59 1.720 -2.353 7.634
433 2HB LEU 59 3HB LEU 59 1.965 -3.642 6.463
434 HG LEU 59 HG LEU 59 0.228 -2.170 5.752
435 1HD1 LEU 59 1HD1 LEU 59 -0.987 -3.928 4.850
436 2HD1 LEU 59 2HD1 LEU 59 0.190 -4.910 5.685
437 3HD1 LEU 59 3HD1 LEU 59 -1.381 -4.615 6.435
438 1HD2 LEU 59 1HD2 LEU 59 -1.849 -1.793 6.896
439 2HD2 LEU 59 2HD2 LEU 59 -1.419 -2.932 8.185
440 3HD2 LEU 59 3HD2 LEU 59 -0.521 -1.416 7.995
441 H ASP 60 H ASP 60 0.626 -6.473 9.436
442 HA ASP 60 HA ASP 60 3.230 -7.623 9.177
443 1HB ASP 60 2HB ASP 60 0.723 -9.237 9.663
444 2HB ASP 60 3HB ASP 60 2.377 -9.478 10.270
445 H GLU 61 H GLU 61 3.763 -9.599 7.987
446 HA GLU 61 HA GLU 61 3.749 -9.115 5.301
447 1HB GLU 61 2HB GLU 61 4.167 -11.773 6.737
448 2HB GLU 61 3HB GLU 61 4.634 -11.450 5.062
449 1HG GLU 61 2HG GLU 61 6.205 -9.742 5.734
450 2HG GLU 61 3HG GLU 61 5.696 -9.824 7.424
451 H GLU 62 H GLU 62 1.696 -11.583 6.900
452 HA GLU 62 HA GLU 62 0.659 -12.637 4.494
453 1HB GLU 62 2HB GLU 62 0.615 -13.486 7.005
454 2HB GLU 62 3HB GLU 62 -0.954 -12.681 7.080
455 1HG GLU 62 2HG GLU 62 -0.166 -14.793 5.006
456 2HG GLU 62 3HG GLU 62 -0.912 -15.172 6.561
457 H GLU 63 H GLU 63 -0.685 -10.127 6.665
458 HA GLU 63 HA GLU 63 -3.074 -9.568 5.275
459 1HB GLU 63 2HB GLU 63 -1.178 -7.710 6.739
460 2HB GLU 63 3HB GLU 63 -2.866 -7.337 6.387
461 1HG GLU 63 2HG GLU 63 -3.697 -8.871 7.942
462 2HG GLU 63 3HG GLU 63 -2.252 -9.887 7.951
463 H LEU 64 H LEU 64 0.275 -8.465 4.730
464 HA LEU 64 HA LEU 64 -0.280 -6.491 2.840
465 1HB LEU 64 2HB LEU 64 1.968 -7.341 4.025
466 2HB LEU 64 3HB LEU 64 2.159 -8.215 2.502
467 HG LEU 64 HG LEU 64 2.025 -6.025 1.283
468 1HD1 LEU 64 1HD1 LEU 64 2.031 -4.856 4.116
469 2HD1 LEU 64 2HD1 LEU 64 2.370 -3.932 2.642
470 3HD1 LEU 64 3HD1 LEU 64 0.765 -4.609 2.894
471 1HD2 LEU 64 1HD2 LEU 64 4.190 -7.050 2.049
472 2HD2 LEU 64 2HD2 LEU 64 4.256 -5.278 1.965
473 3HD2 LEU 64 3HD2 LEU 64 4.089 -6.092 3.536
474 H LYS 65 H LYS 65 -0.235 -10.006 2.497
475 HA LYS 65 HA LYS 65 -0.335 -10.216 -0.357
476 1HB LYS 65 2HB LYS 65 0.101 -12.001 1.484
477 2HB LYS 65 3HB LYS 65 -1.679 -11.995 1.632
478 1HG LYS 65 2HG LYS 65 -1.943 -12.824 -0.627
479 2HG LYS 65 3HG LYS 65 -0.201 -12.708 -0.915
480 1HD LYS 65 2HD LYS 65 -0.995 -15.031 -0.366
481 2HD LYS 65 3HD LYS 65 0.258 -14.426 0.737
482 1HE LYS 65 2HE LYS 65 -1.411 -13.904 2.461
483 2HE LYS 65 3HE LYS 65 -2.744 -14.315 1.369
484 1HZ LYS 65 1HZ LYS 65 -0.707 -16.158 2.436
485 2HZ LYS 65 2HZ LYS 65 -2.201 -15.896 3.036
486 3HZ LYS 65 3HZ LYS 65 -2.040 -16.597 1.540
487 H PHE 66 H PHE 66 -2.630 -8.927 1.864
488 HA PHE 66 HA PHE 66 -4.808 -9.042 -0.169
489 1HB PHE 66 2HB PHE 66 -4.775 -9.738 2.741
490 2HB PHE 66 3HB PHE 66 -6.065 -8.663 2.282
491 HD1 PHE 66 1HD PHE 66 -4.522 -11.931 1.307
492 HD2 PHE 66 2HD PHE 66 -8.053 -9.455 1.242
493 HE1 PHE 66 1HE PHE 66 -5.849 -13.817 0.384
494 HE2 PHE 66 2HE PHE 66 -9.368 -11.350 0.376
495 HZ PHE 66 HZ PHE 66 -8.273 -13.527 -0.074
496 H PHE 67 H PHE 67 -2.492 -7.089 0.586
497 HA PHE 67 HA PHE 67 -3.342 -4.896 2.002
498 1HB PHE 67 2HB PHE 67 -1.075 -5.181 1.262
499 2HB PHE 67 3HB PHE 67 -1.513 -5.120 -0.426
500 HD1 PHE 67 1HD PHE 67 -1.136 -3.148 2.696
501 HD2 PHE 67 2HD PHE 67 -1.579 -2.997 -1.581
502 HE1 PHE 67 1HE PHE 67 -0.643 -0.722 2.733
503 HE2 PHE 67 2HE PHE 67 -1.127 -0.581 -1.548
504 HZ PHE 67 HZ PHE 67 -0.657 0.582 0.612
505 H LEU 68 H LEU 68 -3.339 -4.863 -1.591
506 HA LEU 68 HA LEU 68 -5.040 -2.544 -1.680
507 1HB LEU 68 2HB LEU 68 -3.116 -3.601 -3.271
508 2HB LEU 68 3HB LEU 68 -4.515 -4.357 -3.989
509 HG LEU 68 HG LEU 68 -3.826 -2.421 -5.238
510 1HD1 LEU 68 1HD1 LEU 68 -6.286 -2.829 -5.029
511 2HD1 LEU 68 2HD1 LEU 68 -6.310 -1.616 -3.736
512 3HD1 LEU 68 3HD1 LEU 68 -5.863 -1.141 -5.384
513 1HD2 LEU 68 1HD2 LEU 68 -4.179 -0.743 -2.716
514 2HD2 LEU 68 2HD2 LEU 68 -2.637 -1.206 -3.468
515 3HD2 LEU 68 3HD2 LEU 68 -3.767 -0.153 -4.334
516 H GLN 69 H GLN 69 -5.525 -5.948 -1.560
517 HA GLN 69 HA GLN 69 -8.098 -6.138 -2.676
518 1HB GLN 69 2HB GLN 69 -6.145 -7.937 -1.840
519 2HB GLN 69 3HB GLN 69 -7.395 -8.189 -0.640
520 1HG GLN 69 2HG GLN 69 -8.988 -8.779 -2.333
521 2HG GLN 69 3HG GLN 69 -7.972 -8.111 -3.622
522 1HE2 GLN 69 1HE2 GLN 69 -6.226 -9.306 -4.517
523 2HE2 GLN 69 2HE2 GLN 69 -6.074 -11.007 -4.172
524 H LYS 70 H LYS 70 -7.318 -4.463 0.103
525 HA LYS 70 HA LYS 70 -9.951 -4.865 1.385
526 1HB LYS 70 2HB LYS 70 -7.523 -3.247 1.916
527 2HB LYS 70 3HB LYS 70 -9.007 -2.311 2.043
528 1HG LYS 70 2HG LYS 70 -8.546 -3.203 4.185
529 2HG LYS 70 3HG LYS 70 -9.994 -3.968 3.568
530 1HD LYS 70 2HD LYS 70 -7.687 -5.554 2.754
531 2HD LYS 70 3HD LYS 70 -7.510 -5.160 4.469
532 1HE LYS 70 2HE LYS 70 -9.795 -6.035 4.927
533 2HE LYS 70 3HE LYS 70 -10.013 -6.406 3.208
534 1HZ LYS 70 1HZ LYS 70 -7.955 -7.613 4.929
535 2HZ LYS 70 2HZ LYS 70 -9.369 -8.328 4.475
536 3HZ LYS 70 3HZ LYS 70 -8.229 -7.962 3.344
537 H PHE 71 H PHE 71 -8.520 -3.013 -1.238
538 HA PHE 71 HA PHE 71 -10.827 -1.163 -1.411
539 1HB PHE 71 2HB PHE 71 -8.357 -1.315 -3.145
540 2HB PHE 71 3HB PHE 71 -9.498 -0.016 -3.020
541 HD1 PHE 71 1HD PHE 71 -6.665 0.495 -2.967
542 HD2 PHE 71 2HD PHE 71 -9.235 -0.518 0.341
543 HE1 PHE 71 1HE PHE 71 -5.280 1.884 -1.462
544 HE2 PHE 71 2HE PHE 71 -7.749 0.735 1.860
545 HZ PHE 71 HZ PHE 71 -5.868 2.065 0.942
546 H GLU 72 H GLU 72 -8.912 -3.371 -3.463
547 HA GLU 72 HA GLU 72 -11.147 -3.624 -5.420
548 1HB GLU 72 2HB GLU 72 -8.511 -3.059 -5.857
549 2HB GLU 72 3HB GLU 72 -8.422 -4.821 -5.866
550 1HG GLU 72 2HG GLU 72 -8.718 -4.102 -8.125
551 2HG GLU 72 3HG GLU 72 -10.321 -4.688 -7.676
552 H SER 73 H SER 73 -10.687 -6.085 -6.416
553 HA SER 73 HA SER 73 -10.461 -8.027 -4.179
554 1HB SER 73 2HB SER 73 -12.688 -8.044 -6.268
555 2HB SER 73 3HB SER 73 -12.456 -9.222 -4.962
556 HG SER 73 HG SER 73 -14.023 -7.546 -4.488
557 H GLY 74 H GLY 74 -8.388 -7.481 -5.813
558 1HA GLY 74 1HA GLY 74 -7.221 -9.669 -6.696
559 2HA GLY 74 2HA GLY 74 -8.389 -9.485 -8.016
560 H ALA 75 H ALA 75 -6.114 -7.383 -6.131
561 HA ALA 75 HA ALA 75 -5.616 -5.771 -8.569
562 1HB ALA 75 1HB ALA 75 -6.139 -4.665 -6.453
563 2HB ALA 75 2HB ALA 75 -4.769 -5.446 -5.680
564 3HB ALA 75 3HB ALA 75 -4.482 -4.270 -6.981
565 H ARG 76 H ARG 76 -3.074 -6.263 -6.189
566 HA ARG 76 HA ARG 76 -1.617 -8.128 -7.939
567 1HB ARG 76 2HB ARG 76 -1.209 -5.454 -8.423
568 2HB ARG 76 3HB ARG 76 -0.144 -5.650 -7.034
569 1HG ARG 76 2HG ARG 76 1.260 -6.201 -8.720
570 2HG ARG 76 3HG ARG 76 0.722 -7.800 -8.284
571 1HD ARG 76 2HD ARG 76 -0.148 -8.121 -10.428
572 2HD ARG 76 3HD ARG 76 -1.225 -6.770 -10.203
573 HE ARG 76 HE ARG 76 0.134 -5.433 -11.524
574 1HH1 ARG 76 2HH2 ARG 76 1.857 -8.270 -10.505
575 2HH1 ARG 76 1HH2 ARG 76 3.446 -7.595 -10.617
576 1HH2 ARG 76 2HH1 ARG 76 2.239 -4.509 -12.014
577 2HH2 ARG 76 1HH1 ARG 76 3.644 -5.311 -11.322
578 H GLU 77 H GLU 77 -2.821 -8.196 -5.292
579 HA GLU 77 HA GLU 77 -0.856 -7.744 -3.247
580 1HB GLU 77 2HB GLU 77 -3.366 -9.376 -2.930
581 2HB GLU 77 3HB GLU 77 -2.525 -8.287 -1.808
582 1HG GLU 77 2HG GLU 77 -4.267 -6.993 -2.357
583 2HG GLU 77 3HG GLU 77 -3.170 -6.418 -3.596
584 H LEU 78 H LEU 78 -2.175 -10.391 -5.059
585 HA LEU 78 HA LEU 78 -1.174 -12.668 -3.920
586 1HB LEU 78 2HB LEU 78 -1.144 -12.374 -6.942
587 2HB LEU 78 3HB LEU 78 -1.473 -13.779 -5.949
588 HG LEU 78 HG LEU 78 -3.511 -13.326 -6.765
589 1HD1 LEU 78 1HD1 LEU 78 -3.600 -13.299 -4.245
590 2HD1 LEU 78 2HD1 LEU 78 -3.778 -11.532 -4.328
591 3HD1 LEU 78 3HD1 LEU 78 -4.987 -12.578 -5.081
592 1HD2 LEU 78 1HD2 LEU 78 -4.521 -11.255 -7.328
593 2HD2 LEU 78 2HD2 LEU 78 -3.286 -10.305 -6.514
594 3HD2 LEU 78 3HD2 LEU 78 -2.858 -11.223 -7.952
595 H THR 79 H THR 79 0.528 -10.772 -6.517
596 HA THR 79 HA THR 79 2.730 -12.494 -6.698
597 HB THR 79 HB THR 79 2.683 -9.496 -7.177
598 HG1 THR 79 1HG THR 79 2.626 -10.670 -9.391
599 1HG2 THR 79 1HG2 THR 79 4.408 -11.718 -8.423
600 2HG2 THR 79 2HG2 THR 79 4.557 -9.977 -8.749
601 3HG2 THR 79 3HG2 THR 79 5.000 -10.636 -7.171
602 H GLU 80 H GLU 80 4.134 -13.008 -5.157
603 HA GLU 80 HA GLU 80 4.344 -11.547 -2.729
604 1HB GLU 80 2HB GLU 80 6.481 -13.491 -3.633
605 2HB GLU 80 3HB GLU 80 5.899 -13.073 -2.006
606 1HG GLU 80 2HG GLU 80 4.854 -15.095 -2.251
607 2HG GLU 80 3HG GLU 80 3.593 -14.083 -2.960
608 H SER 81 H SER 81 6.568 -11.724 -5.594
609 HA SER 81 HA SER 81 8.612 -10.108 -4.718
610 1HB SER 81 2HB SER 81 7.478 -9.915 -7.541
611 2HB SER 81 3HB SER 81 9.158 -9.865 -7.014
612 HG SER 81 HG SER 81 8.515 -11.931 -7.852
613 H GLU 82 H GLU 82 5.750 -8.982 -6.567
614 HA GLU 82 HA GLU 82 6.191 -6.266 -6.330
615 1HB GLU 82 2HB GLU 82 4.163 -7.979 -7.361
616 2HB GLU 82 3HB GLU 82 3.324 -6.952 -6.214
617 1HG GLU 82 2HG GLU 82 3.170 -5.555 -7.940
618 2HG GLU 82 3HG GLU 82 4.814 -5.089 -7.489
619 H THR 83 H THR 83 4.205 -8.381 -4.160
620 HA THR 83 HA THR 83 3.449 -6.286 -2.508
621 HB THR 83 HB THR 83 2.958 -8.993 -2.522
622 HG1 THR 83 1HG THR 83 1.747 -8.293 -0.524
623 1HG2 THR 83 1HG2 THR 83 4.126 -8.406 0.228
624 2HG2 THR 83 2HG2 THR 83 3.230 -9.849 -0.261
625 3HG2 THR 83 3HG2 THR 83 4.825 -9.543 -0.945
626 H LYS 84 H LYS 84 6.402 -8.264 -2.540
627 HA LYS 84 HA LYS 84 7.546 -7.217 -0.127
628 1HB LYS 84 2HB LYS 84 8.688 -8.818 -2.418
629 2HB LYS 84 3HB LYS 84 9.673 -8.244 -1.068
630 1HG LYS 84 2HG LYS 84 8.420 -9.463 0.551
631 2HG LYS 84 3HG LYS 84 7.121 -9.816 -0.594
632 1HD LYS 84 2HD LYS 84 8.637 -11.187 -1.961
633 2HD LYS 84 3HD LYS 84 9.974 -10.856 -0.835
634 1HE LYS 84 2HE LYS 84 8.740 -11.963 1.002
635 2HE LYS 84 3HE LYS 84 7.332 -12.198 -0.044
636 1HZ LYS 84 1HZ LYS 84 9.971 -13.433 -0.464
637 2HZ LYS 84 2HZ LYS 84 8.638 -14.181 0.144
638 3HZ LYS 84 3HZ LYS 84 8.641 -13.656 -1.413
639 H SER 85 H SER 85 7.593 -6.125 -3.528
640 HA SER 85 HA SER 85 9.571 -4.133 -3.247
641 1HB SER 85 2HB SER 85 6.996 -3.823 -4.846
642 2HB SER 85 3HB SER 85 8.535 -3.000 -5.095
643 HG SER 85 HG SER 85 8.280 -4.820 -6.486
644 H LEU 86 H LEU 86 6.061 -4.039 -2.420
645 HA LEU 86 HA LEU 86 6.194 -1.401 -1.201
646 1HB LEU 86 2HB LEU 86 4.225 -3.702 -0.876
647 2HB LEU 86 3HB LEU 86 4.221 -2.289 0.162
648 HG LEU 86 HG LEU 86 4.271 -1.050 -2.293
649 1HD1 LEU 86 1HD1 LEU 86 4.009 -3.213 -3.504
650 2HD1 LEU 86 2HD1 LEU 86 2.511 -3.526 -2.595
651 3HD1 LEU 86 3HD1 LEU 86 2.605 -2.151 -3.714
652 1HD2 LEU 86 1HD2 LEU 86 1.883 -1.960 -0.634
653 2HD2 LEU 86 2HD2 LEU 86 2.821 -0.461 -0.443
654 3HD2 LEU 86 3HD2 LEU 86 1.834 -0.711 -1.891
655 H MET 87 H MET 87 6.152 -4.685 0.301
656 HA MET 87 HA MET 87 6.536 -3.986 2.864
657 1HB MET 87 2HB MET 87 6.426 -6.375 1.851
658 2HB MET 87 3HB MET 87 8.180 -6.251 1.704
659 1HG MET 87 2HG MET 87 8.191 -5.678 4.233
660 2HG MET 87 3HG MET 87 6.510 -6.204 4.224
661 1HE MET 87 1HE MET 87 10.206 -8.901 3.618
662 2HE MET 87 2HE MET 87 9.776 -7.697 2.386
663 3HE MET 87 3HE MET 87 10.256 -7.170 4.018
664 H ALA 88 H ALA 88 9.183 -4.525 0.594
665 HA ALA 88 HA ALA 88 11.445 -4.300 2.120
666 1HB ALA 88 1HB ALA 88 12.509 -3.576 -0.080
667 2HB ALA 88 2HB ALA 88 11.478 -5.017 -0.199
668 3HB ALA 88 3HB ALA 88 10.868 -3.471 -0.773
669 H ALA 89 H ALA 89 10.062 -1.585 0.195
670 HA ALA 89 HA ALA 89 11.766 0.369 1.466
671 1HB ALA 89 1HB ALA 89 9.203 0.682 -0.133
672 2HB ALA 89 2HB ALA 89 10.258 2.023 0.382
673 3HB ALA 89 3HB ALA 89 10.891 0.796 -0.724
674 H ALA 90 H ALA 90 8.267 -0.488 1.887
675 HA ALA 90 HA ALA 90 7.620 1.503 3.763
676 1HB ALA 90 1HB ALA 90 5.997 -0.048 2.674
677 2HB ALA 90 2HB ALA 90 6.638 -1.374 3.680
678 3HB ALA 90 3HB ALA 90 5.821 0.007 4.442
679 H ASP 91 H ASP 91 9.173 -1.647 4.289
680 HA ASP 91 HA ASP 91 9.161 -1.485 7.147
681 1HB ASP 91 2HB ASP 91 9.290 -3.642 5.994
682 2HB ASP 91 3HB ASP 91 10.802 -3.176 5.194
683 H ASN 92 H ASN 92 11.739 -1.163 4.675
684 HA ASN 92 HA ASN 92 13.874 -0.490 4.796
685 1HB ASN 92 2HB ASN 92 14.223 1.850 5.251
686 2HB ASN 92 3HB ASN 92 12.717 1.611 4.392
687 1HD2 ASN 92 1HD2 ASN 92 13.899 1.836 7.824
688 2HD2 ASN 92 2HD2 ASN 92 12.547 2.823 8.359
689 H ASP 93 H ASP 93 13.111 -2.125 7.217
690 HA ASP 93 HA ASP 93 15.282 -1.177 9.083
691 1HB ASP 93 2HB ASP 93 12.960 -3.101 9.535
692 2HB ASP 93 3HB ASP 93 14.236 -2.732 10.691
693 H GLY 94 H GLY 94 13.854 -3.935 7.395
694 1HA GLY 94 1HA GLY 94 15.006 -5.851 6.537
695 2HA GLY 94 2HA GLY 94 16.301 -5.611 7.723
696 H ASP 95 H ASP 95 12.723 -5.340 8.231
697 HA ASP 95 HA ASP 95 12.831 -7.886 9.782
698 1HB ASP 95 2HB ASP 95 11.791 -7.151 11.650
699 2HB ASP 95 3HB ASP 95 12.949 -5.857 11.334
700 H GLY 96 H GLY 96 10.535 -5.502 8.332
701 1HA GLY 96 1HA GLY 96 9.365 -6.256 6.351
702 2HA GLY 96 2HA GLY 96 9.150 -7.856 7.063
703 H LYS 97 H LYS 97 8.582 -6.427 9.784
704 HA LYS 97 HA LYS 97 5.691 -6.098 9.375
705 1HB LYS 97 2HB LYS 97 7.445 -6.033 11.853
706 2HB LYS 97 3HB LYS 97 5.689 -5.901 11.855
707 1HG LYS 97 2HG LYS 97 5.358 -8.123 11.500
708 2HG LYS 97 3HG LYS 97 6.651 -8.243 10.304
709 1HD LYS 97 2HD LYS 97 8.349 -8.144 12.135
710 2HD LYS 97 3HD LYS 97 7.017 -8.221 13.319
711 1HE LYS 97 2HE LYS 97 6.281 -10.397 12.330
712 2HE LYS 97 3HE LYS 97 7.561 -10.289 11.109
713 1HZ LYS 97 1HZ LYS 97 9.180 -10.399 12.861
714 2HZ LYS 97 2HZ LYS 97 8.000 -10.526 14.007
715 3HZ LYS 97 3HZ LYS 97 8.196 -11.717 12.885
716 H ILE 98 H ILE 98 4.758 -4.201 9.258
717 HA ILE 98 HA ILE 98 6.425 -1.719 9.258
718 HB ILE 98 HB ILE 98 4.252 -2.820 7.462
719 1HG1 ILE 98 2HG1 ILE 98 6.895 -1.810 6.478
720 2HG1 ILE 98 3HG1 ILE 98 6.939 -3.336 7.347
721 1HG2 ILE 98 1HG2 ILE 98 5.538 -0.055 7.410
722 2HG2 ILE 98 2HG2 ILE 98 4.557 -0.766 6.113
723 3HG2 ILE 98 3HG2 ILE 98 3.822 -0.443 7.682
724 1HD1 ILE 98 1HD1 ILE 98 5.233 -4.295 5.855
725 2HD1 ILE 98 2HD1 ILE 98 5.201 -2.782 4.919
726 3HD1 ILE 98 3HD1 ILE 98 6.697 -3.752 5.015
727 H GLY 99 H GLY 99 5.848 -0.664 11.155
728 1HA GLY 99 1HA GLY 99 3.174 -0.479 12.185
729 2HA GLY 99 2HA GLY 99 4.521 0.643 12.468
730 H ALA 100 H ALA 100 1.852 1.531 12.091
731 HA ALA 100 HA ALA 100 1.277 2.349 9.417
732 1HB ALA 100 1HB ALA 100 0.548 3.685 12.057
733 2HB ALA 100 2HB ALA 100 -0.183 4.015 10.469
734 3HB ALA 100 3HB ALA 100 -0.392 2.419 11.222
735 H GLU 101 H GLU 101 3.295 3.738 12.016
736 HA GLU 101 HA GLU 101 3.774 6.201 10.725
737 1HB GLU 101 2HB GLU 101 5.399 4.773 12.871
738 2HB GLU 101 3HB GLU 101 5.589 6.461 12.370
739 1HG GLU 101 2HG GLU 101 3.185 6.886 12.930
740 2HG GLU 101 3HG GLU 101 3.051 5.236 13.568
741 H GLU 102 H GLU 102 5.745 3.165 10.773
742 HA GLU 102 HA GLU 102 7.840 3.889 9.036
743 1HB GLU 102 2HB GLU 102 6.245 1.300 9.299
744 2HB GLU 102 3HB GLU 102 7.671 1.466 8.287
745 1HG GLU 102 2HG GLU 102 9.109 1.835 10.133
746 2HG GLU 102 3HG GLU 102 7.758 2.019 11.266
747 H PHE 103 H PHE 103 4.574 2.617 8.228
748 HA PHE 103 HA PHE 103 5.090 2.731 5.447
749 1HB PHE 103 2HB PHE 103 3.197 1.573 7.010
750 2HB PHE 103 3HB PHE 103 2.234 2.845 6.336
751 HD1 PHE 103 1HD PHE 103 3.876 2.694 3.503
752 HD2 PHE 103 2HD PHE 103 1.848 -0.163 6.035
753 HE1 PHE 103 1HE PHE 103 3.589 1.185 1.588
754 HE2 PHE 103 2HE PHE 103 1.678 -1.718 4.102
755 HZ PHE 103 HZ PHE 103 2.495 -1.033 1.879
756 H GLN 104 H GLN 104 3.378 5.017 7.577
757 HA GLN 104 HA GLN 104 2.556 7.063 5.742
758 1HB GLN 104 2HB GLN 104 1.956 6.904 8.149
759 2HB GLN 104 3HB GLN 104 3.624 7.331 8.576
760 1HG GLN 104 2HG GLN 104 3.302 9.467 7.182
761 2HG GLN 104 3HG GLN 104 1.588 9.040 7.098
762 1HE2 GLN 104 1HE2 GLN 104 1.245 8.012 9.774
763 2HE2 GLN 104 2HE2 GLN 104 1.503 9.352 10.882
764 H GLU 105 H GLU 105 5.697 6.739 7.586
765 HA GLU 105 HA GLU 105 7.003 8.932 6.457
766 1HB GLU 105 2HB GLU 105 7.831 6.345 7.712
767 2HB GLU 105 3HB GLU 105 9.032 7.035 6.631
768 1HG GLU 105 2HG GLU 105 7.726 8.690 8.820
769 2HG GLU 105 3HG GLU 105 9.211 7.748 9.049
770 H MET 106 H MET 106 6.929 5.559 5.196
771 HA MET 106 HA MET 106 8.504 6.247 2.954
772 1HB MET 106 2HB MET 106 7.518 3.876 3.975
773 2HB MET 106 3HB MET 106 6.581 4.029 2.484
774 1HG MET 106 2HG MET 106 8.609 2.855 1.979
775 2HG MET 106 3HG MET 106 8.807 4.462 1.282
776 1HE MET 106 1HE MET 106 10.592 6.244 2.100
777 2HE MET 106 2HE MET 106 12.130 5.499 2.582
778 3HE MET 106 3HE MET 106 11.296 4.932 1.117
779 H VAL 107 H VAL 107 4.955 6.119 3.287
780 HA VAL 107 HA VAL 107 4.360 6.956 0.620
781 HB VAL 107 HB VAL 107 2.834 7.124 3.235
782 1HG1 VAL 107 1HG1 VAL 107 0.835 7.658 1.796
783 2HG1 VAL 107 2HG1 VAL 107 1.984 8.990 1.941
784 3HG1 VAL 107 3HG1 VAL 107 1.947 7.999 0.460
785 1HG2 VAL 107 1HG2 VAL 107 3.133 4.871 2.175
786 2HG2 VAL 107 2HG2 VAL 107 1.439 5.423 2.123
787 3HG2 VAL 107 3HG2 VAL 107 2.436 5.514 0.674
788 H HIS 108 H HIS 108 5.325 8.805 3.484
789 HA HIS 108 HA HIS 108 4.239 11.277 2.711
790 1HB HIS 108 2HB HIS 108 4.752 10.701 5.008
791 2HB HIS 108 3HB HIS 108 6.472 10.536 4.636
792 HD1 HIS 108 1HD HIS 108 4.935 13.645 3.199
793 HD2 HIS 108 2HD HIS 108 6.892 12.297 6.667
794 HE1 HIS 108 1HE HIS 108 5.559 15.733 4.550
795 H SER 109 H SER 109 7.020 9.496 1.735
796 HA SER 109 HA SER 109 8.803 11.467 0.939
797 1HB SER 109 2HB SER 109 9.324 9.030 1.046
798 2HB SER 109 3HB SER 109 8.231 8.773 -0.338
799 HG SER 109 HG SER 109 9.654 10.521 -1.312
Start of MODEL 9
1 1H MET 1 H1 MET 1 -17.357 6.113 5.070
2 2H MET 1 H2 MET 1 -18.463 7.328 4.784
3 3H MET 1 H3 MET 1 -18.656 5.809 4.120
4 HA MET 1 HA MET 1 -17.680 6.787 2.312
5 1HB MET 1 2HB MET 1 -15.837 8.371 4.167
6 2HB MET 1 3HB MET 1 -16.094 8.572 2.428
7 1HG MET 1 2HG MET 1 -17.306 10.347 3.403
8 2HG MET 1 3HG MET 1 -18.530 9.143 2.997
9 1HE MET 1 1HE MET 1 -20.260 10.356 6.196
10 2HE MET 1 2HE MET 1 -19.670 11.215 4.753
11 3HE MET 1 3HE MET 1 -20.486 9.639 4.584
12 H SER 2 H SER 2 -15.374 6.439 1.394
13 HA SER 2 HA SER 2 -13.510 5.035 3.035
14 1HB SER 2 2HB SER 2 -15.116 3.139 2.512
15 2HB SER 2 3HB SER 2 -14.844 3.450 0.788
16 HG SER 2 HG SER 2 -13.052 2.477 2.747
17 H ILE 3 H ILE 3 -11.824 4.178 1.312
18 HA ILE 3 HA ILE 3 -10.757 6.560 0.174
19 HB ILE 3 HB ILE 3 -8.888 5.264 -0.403
20 1HG1 ILE 3 2HG1 ILE 3 -9.296 2.596 -0.083
21 2HG1 ILE 3 3HG1 ILE 3 -10.842 2.990 -0.771
22 1HG2 ILE 3 1HG2 ILE 3 -9.594 5.403 2.046
23 2HG2 ILE 3 2HG2 ILE 3 -10.014 3.683 1.931
24 3HG2 ILE 3 3HG2 ILE 3 -8.357 4.204 1.615
25 1HD1 ILE 3 1HD1 ILE 3 -9.146 2.335 -2.461
26 2HD1 ILE 3 2HD1 ILE 3 -9.665 4.008 -2.752
27 3HD1 ILE 3 3HD1 ILE 3 -8.107 3.681 -1.966
28 H THR 4 H THR 4 -12.798 4.048 -1.084
29 HA THR 4 HA THR 4 -12.427 4.440 -3.826
30 HB THR 4 HB THR 4 -13.402 2.495 -2.308
31 HG1 THR 4 1HG THR 4 -12.958 2.631 -4.483
32 1HG2 THR 4 1HG2 THR 4 -16.022 3.721 -3.234
33 2HG2 THR 4 2HG2 THR 4 -15.761 2.251 -2.279
34 3HG2 THR 4 3HG2 THR 4 -15.436 3.842 -1.559
35 H ASP 5 H ASP 5 -13.875 6.459 -1.499
36 HA ASP 5 HA ASP 5 -15.497 7.919 -3.514
37 1HB ASP 5 2HB ASP 5 -16.800 6.328 -1.986
38 2HB ASP 5 3HB ASP 5 -16.237 7.306 -0.618
39 H VAL 6 H VAL 6 -12.733 8.354 -2.529
40 HA VAL 6 HA VAL 6 -13.248 11.135 -1.501
41 HB VAL 6 HB VAL 6 -11.365 11.242 -0.152
42 1HG1 VAL 6 1HG1 VAL 6 -12.008 9.972 1.686
43 2HG1 VAL 6 2HG1 VAL 6 -13.499 10.083 0.732
44 3HG1 VAL 6 3HG1 VAL 6 -12.515 8.603 0.694
45 1HG2 VAL 6 1HG2 VAL 6 -9.986 9.176 0.421
46 2HG2 VAL 6 2HG2 VAL 6 -10.592 8.470 -1.086
47 3HG2 VAL 6 3HG2 VAL 6 -9.628 9.963 -1.115
48 H LEU 7 H LEU 7 -10.752 9.163 -3.108
49 HA LEU 7 HA LEU 7 -10.341 10.984 -5.279
50 1HB LEU 7 2HB LEU 7 -9.286 12.405 -3.508
51 2HB LEU 7 3HB LEU 7 -8.310 11.034 -2.990
52 HG LEU 7 HG LEU 7 -7.323 11.032 -5.386
53 1HD1 LEU 7 1HD1 LEU 7 -9.020 12.482 -6.460
54 2HD1 LEU 7 2HD1 LEU 7 -8.545 13.822 -5.393
55 3HD1 LEU 7 3HD1 LEU 7 -7.395 13.168 -6.580
56 1HD2 LEU 7 1HD2 LEU 7 -5.709 12.777 -4.825
57 2HD2 LEU 7 2HD2 LEU 7 -6.786 13.385 -3.546
58 3HD2 LEU 7 3HD2 LEU 7 -6.071 11.760 -3.425
59 H SER 8 H SER 8 -8.459 8.909 -3.040
60 HA SER 8 HA SER 8 -6.791 7.619 -4.596
61 1HB SER 8 2HB SER 8 -8.414 6.307 -2.414
62 2HB SER 8 3HB SER 8 -6.829 5.769 -3.020
63 HG SER 8 HG SER 8 -5.977 7.781 -2.391
64 H ALA 9 H ALA 9 -10.264 6.728 -4.520
65 HA ALA 9 HA ALA 9 -10.321 4.399 -5.951
66 1HB ALA 9 1HB ALA 9 -12.040 6.758 -6.842
67 2HB ALA 9 2HB ALA 9 -12.518 5.061 -6.614
68 3HB ALA 9 3HB ALA 9 -12.208 6.121 -5.216
69 H ASP 10 H ASP 10 -9.671 7.628 -7.395
70 HA ASP 10 HA ASP 10 -9.617 6.602 -10.122
71 1HB ASP 10 2HB ASP 10 -10.171 8.970 -9.410
72 2HB ASP 10 3HB ASP 10 -8.457 9.194 -9.017
73 H ASP 11 H ASP 11 -7.274 7.373 -7.556
74 HA ASP 11 HA ASP 11 -4.907 7.145 -9.101
75 1HB ASP 11 2HB ASP 11 -5.279 6.740 -6.100
76 2HB ASP 11 3HB ASP 11 -3.792 7.066 -6.981
77 H ILE 12 H ILE 12 -6.657 4.781 -6.989
78 HA ILE 12 HA ILE 12 -4.855 2.693 -7.282
79 HB ILE 12 HB ILE 12 -6.550 1.245 -6.551
80 1HG1 ILE 12 2HG1 ILE 12 -8.473 3.520 -6.625
81 2HG1 ILE 12 3HG1 ILE 12 -8.529 2.114 -7.694
82 1HG2 ILE 12 1HG2 ILE 12 -6.403 3.834 -4.969
83 2HG2 ILE 12 2HG2 ILE 12 -6.908 2.269 -4.333
84 3HG2 ILE 12 3HG2 ILE 12 -5.256 2.490 -4.929
85 1HD1 ILE 12 1HD1 ILE 12 -10.154 1.696 -6.054
86 2HD1 ILE 12 2HD1 ILE 12 -8.775 0.675 -5.608
87 3HD1 ILE 12 3HD1 ILE 12 -9.097 2.191 -4.729
88 H ALA 13 H ALA 13 -7.678 3.643 -9.280
89 HA ALA 13 HA ALA 13 -7.622 1.446 -11.041
90 1HB ALA 13 1HB ALA 13 -8.346 4.321 -11.756
91 2HB ALA 13 2HB ALA 13 -8.856 2.842 -12.584
92 3HB ALA 13 3HB ALA 13 -9.419 3.170 -10.933
93 H ALA 14 H ALA 14 -5.826 4.582 -11.223
94 HA ALA 14 HA ALA 14 -4.346 3.913 -13.589
95 1HB ALA 14 1HB ALA 14 -2.691 5.556 -12.841
96 2HB ALA 14 2HB ALA 14 -4.351 6.200 -12.708
97 3HB ALA 14 3HB ALA 14 -3.475 5.663 -11.256
98 H ALA 15 H ALA 15 -3.504 3.505 -10.119
99 HA ALA 15 HA ALA 15 -0.990 2.444 -10.392
100 1HB ALA 15 1HB ALA 15 -2.304 3.149 -8.259
101 2HB ALA 15 2HB ALA 15 -2.920 1.488 -8.249
102 3HB ALA 15 3HB ALA 15 -1.173 1.798 -8.165
103 H LEU 16 H LEU 16 -4.085 0.752 -10.400
104 HA LEU 16 HA LEU 16 -3.195 -1.898 -10.524
105 1HB LEU 16 2HB LEU 16 -5.542 -0.991 -10.170
106 2HB LEU 16 3HB LEU 16 -5.641 -0.685 -11.897
107 HG LEU 16 HG LEU 16 -6.863 -2.636 -11.230
108 1HD1 LEU 16 1HD1 LEU 16 -6.224 -4.184 -12.869
109 2HD1 LEU 16 2HD1 LEU 16 -5.673 -2.614 -13.485
110 3HD1 LEU 16 3HD1 LEU 16 -4.515 -3.765 -12.768
111 1HD2 LEU 16 1HD2 LEU 16 -5.883 -4.647 -10.311
112 2HD2 LEU 16 2HD2 LEU 16 -4.265 -3.924 -10.304
113 3HD2 LEU 16 3HD2 LEU 16 -5.536 -3.274 -9.243
114 H GLN 17 H GLN 17 -3.552 0.609 -13.045
115 HA GLN 17 HA GLN 17 -3.054 -1.290 -15.228
116 1HB GLN 17 2HB GLN 17 -3.656 1.660 -15.071
117 2HB GLN 17 3HB GLN 17 -3.059 0.909 -16.569
118 1HG GLN 17 2HG GLN 17 -4.883 -0.660 -16.633
119 2HG GLN 17 3HG GLN 17 -5.430 -0.209 -15.012
120 1HE2 GLN 17 1HE2 GLN 17 -4.455 2.465 -17.079
121 2HE2 GLN 17 2HE2 GLN 17 -6.093 2.963 -17.462
122 H GLU 18 H GLU 18 -1.222 1.236 -13.460
123 HA GLU 18 HA GLU 18 1.029 1.043 -15.233
124 1HB GLU 18 2HB GLU 18 2.039 2.643 -13.935
125 2HB GLU 18 3HB GLU 18 0.343 2.933 -13.689
126 1HG GLU 18 2HG GLU 18 1.134 3.201 -11.592
127 2HG GLU 18 3HG GLU 18 0.641 1.507 -11.509
128 H CYS 19 H CYS 19 0.201 -0.570 -12.150
129 HA CYS 19 HA CYS 19 2.536 -2.365 -12.292
130 1HB CYS 19 2HB CYS 19 0.154 -2.275 -10.393
131 2HB CYS 19 3HB CYS 19 1.586 -3.309 -10.223
132 HG CYS 19 HG CYS 19 1.667 -0.022 -10.461
133 H ARG 20 H ARG 20 0.988 -2.624 -14.656
134 HA ARG 20 HA ARG 20 -0.877 -4.902 -14.274
135 1HB ARG 20 2HB ARG 20 -0.193 -3.076 -16.510
136 2HB ARG 20 3HB ARG 20 -0.325 -4.758 -16.999
137 1HG ARG 20 2HG ARG 20 -2.512 -5.019 -16.114
138 2HG ARG 20 3HG ARG 20 -2.477 -3.431 -15.331
139 1HD ARG 20 2HD ARG 20 -2.424 -2.293 -17.468
140 2HD ARG 20 3HD ARG 20 -2.178 -3.831 -18.334
141 HE ARG 20 HE ARG 20 -4.583 -4.022 -16.840
142 1HH1 ARG 20 2HH2 ARG 20 -3.298 -2.260 -19.591
143 2HH1 ARG 20 1HH2 ARG 20 -4.775 -2.234 -20.506
144 1HH2 ARG 20 2HH1 ARG 20 -6.585 -4.064 -18.028
145 2HH2 ARG 20 1HH1 ARG 20 -6.703 -3.287 -19.572
146 H ASP 21 H ASP 21 2.253 -4.263 -15.885
147 HA ASP 21 HA ASP 21 2.661 -7.001 -16.559
148 1HB ASP 21 2HB ASP 21 4.259 -4.435 -16.688
149 2HB ASP 21 3HB ASP 21 5.094 -5.964 -16.881
150 HA PRO 22 HA PRO 22 4.043 -8.429 -12.662
151 1HB PRO 22 2HB PRO 22 5.696 -10.540 -13.311
152 2HB PRO 22 3HB PRO 22 3.919 -10.593 -13.439
153 1HG PRO 22 2HG PRO 22 5.932 -10.012 -15.620
154 2HG PRO 22 3HG PRO 22 4.521 -11.109 -15.701
155 1HD PRO 22 2HD PRO 22 4.458 -8.574 -16.711
156 2HD PRO 22 3HD PRO 22 3.021 -9.269 -15.906
157 H ASP 23 H ASP 23 5.542 -8.010 -11.233
158 HA ASP 23 HA ASP 23 7.235 -7.240 -10.188
159 1HB ASP 23 2HB ASP 23 8.312 -9.281 -11.251
160 2HB ASP 23 3HB ASP 23 9.051 -8.197 -12.440
161 H THR 24 H THR 24 5.869 -5.392 -11.739
162 HA THR 24 HA THR 24 7.916 -3.437 -12.776
163 HB THR 24 HB THR 24 4.894 -3.382 -13.136
164 HG1 THR 24 1HG THR 24 5.581 -5.084 -14.227
165 1HG2 THR 24 1HG2 THR 24 5.924 -1.161 -13.462
166 2HG2 THR 24 2HG2 THR 24 7.150 -1.877 -14.541
167 3HG2 THR 24 3HG2 THR 24 5.439 -1.855 -15.015
168 H PHE 25 H PHE 25 5.479 -4.063 -10.341
169 HA PHE 25 HA PHE 25 4.828 -1.525 -9.422
170 1HB PHE 25 2HB PHE 25 3.958 -3.871 -8.957
171 2HB PHE 25 3HB PHE 25 5.243 -4.049 -7.767
172 HD1 PHE 25 1HD PHE 25 1.953 -3.989 -7.916
173 HD2 PHE 25 2HD PHE 25 5.044 -1.480 -6.227
174 HE1 PHE 25 1HE PHE 25 0.360 -3.146 -6.239
175 HE2 PHE 25 2HE PHE 25 3.380 -0.520 -4.687
176 HZ PHE 25 HZ PHE 25 1.063 -1.407 -4.625
177 H GLU 26 H GLU 26 5.965 0.016 -8.367
178 HA GLU 26 HA GLU 26 8.476 -0.681 -6.909
179 1HB GLU 26 2HB GLU 26 7.907 1.444 -8.899
180 2HB GLU 26 3HB GLU 26 8.704 2.002 -7.436
181 1HG GLU 26 2HG GLU 26 10.481 0.255 -7.790
182 2HG GLU 26 3HG GLU 26 9.776 -0.043 -9.391
183 HA PRO 27 HA PRO 27 6.275 1.120 -3.510
184 1HB PRO 27 2HB PRO 27 8.322 2.264 -2.049
185 2HB PRO 27 3HB PRO 27 7.933 0.526 -2.075
186 1HG PRO 27 2HG PRO 27 10.153 1.945 -3.534
187 2HG PRO 27 3HG PRO 27 10.140 0.304 -2.836
188 1HD PRO 27 2HD PRO 27 9.811 0.834 -5.514
189 2HD PRO 27 3HD PRO 27 9.181 -0.616 -4.689
190 H GLN 28 H GLN 28 8.975 3.397 -4.309
191 HA GLN 28 HA GLN 28 7.489 5.696 -3.641
192 1HB GLN 28 2HB GLN 28 9.967 5.366 -5.356
193 2HB GLN 28 3HB GLN 28 9.291 6.931 -4.868
194 1HG GLN 28 2HG GLN 28 9.481 6.325 -2.488
195 2HG GLN 28 3HG GLN 28 10.186 4.759 -2.911
196 1HE2 GLN 28 1HE2 GLN 28 12.194 5.029 -4.537
197 2HE2 GLN 28 2HE2 GLN 28 13.317 6.273 -4.017
198 H LYS 29 H LYS 29 7.846 4.031 -6.756
199 HA LYS 29 HA LYS 29 6.488 5.930 -8.380
200 1HB LYS 29 2HB LYS 29 7.796 3.859 -9.139
201 2HB LYS 29 3HB LYS 29 6.363 2.914 -8.665
202 1HG LYS 29 2HG LYS 29 5.047 4.521 -10.194
203 2HG LYS 29 3HG LYS 29 6.605 4.989 -10.874
204 1HD LYS 29 2HD LYS 29 5.534 2.103 -10.745
205 2HD LYS 29 3HD LYS 29 5.172 3.239 -12.020
206 1HE LYS 29 2HE LYS 29 6.777 2.024 -13.019
207 2HE LYS 29 3HE LYS 29 7.698 3.434 -12.476
208 1HZ LYS 29 1HZ LYS 29 7.622 0.796 -11.094
209 2HZ LYS 29 2HZ LYS 29 8.800 1.308 -12.106
210 3HZ LYS 29 3HZ LYS 29 8.615 2.090 -10.728
211 H PHE 30 H PHE 30 5.172 2.882 -6.897
212 HA PHE 30 HA PHE 30 2.502 3.356 -7.562
213 1HB PHE 30 2HB PHE 30 3.315 1.193 -6.859
214 2HB PHE 30 3HB PHE 30 3.726 1.814 -5.256
215 HD1 PHE 30 1HD PHE 30 1.000 0.655 -7.439
216 HD2 PHE 30 2HD PHE 30 1.995 2.274 -3.564
217 HE1 PHE 30 1HE PHE 30 -1.251 0.057 -6.598
218 HE2 PHE 30 2HE PHE 30 -0.285 1.749 -2.758
219 HZ PHE 30 HZ PHE 30 -1.944 0.721 -4.310
220 H PHE 31 H PHE 31 4.280 4.161 -4.634
221 HA PHE 31 HA PHE 31 2.452 5.161 -2.860
222 1HB PHE 31 2HB PHE 31 4.750 4.993 -2.283
223 2HB PHE 31 3HB PHE 31 5.244 5.927 -3.690
224 HD1 PHE 31 1HD PHE 31 2.745 6.685 -1.035
225 HD2 PHE 31 2HD PHE 31 6.400 7.856 -3.018
226 HE1 PHE 31 1HE PHE 31 2.739 8.795 0.143
227 HE2 PHE 31 2HE PHE 31 6.588 9.811 -1.490
228 HZ PHE 31 HZ PHE 31 4.804 10.254 0.172
229 H GLN 32 H GLN 32 4.056 7.062 -5.486
230 HA GLN 32 HA GLN 32 2.330 9.358 -4.974
231 1HB GLN 32 2HB GLN 32 4.629 8.733 -6.779
232 2HB GLN 32 3HB GLN 32 3.446 9.909 -7.383
233 1HG GLN 32 2HG GLN 32 3.677 11.300 -5.422
234 2HG GLN 32 3HG GLN 32 4.671 10.087 -4.599
235 1HE2 GLN 32 1HE2 GLN 32 4.780 11.570 -7.920
236 2HE2 GLN 32 2HE2 GLN 32 6.450 12.088 -7.757
237 H THR 33 H THR 33 2.459 6.719 -7.454
238 HA THR 33 HA THR 33 0.431 7.736 -9.048
239 HB THR 33 HB THR 33 2.094 5.479 -9.079
240 HG1 THR 33 1HG THR 33 -0.132 6.235 -10.554
241 1HG2 THR 33 1HG2 THR 33 0.786 3.537 -9.368
242 2HG2 THR 33 2HG2 THR 33 0.287 4.146 -7.796
243 3HG2 THR 33 3HG2 THR 33 -0.734 4.443 -9.216
244 H SER 34 H SER 34 0.239 6.112 -6.001
245 HA SER 34 HA SER 34 -2.564 5.443 -6.171
246 1HB SER 34 2HB SER 34 -0.854 3.989 -5.186
247 2HB SER 34 3HB SER 34 -0.574 5.173 -3.898
248 HG SER 34 HG SER 34 -2.057 3.389 -3.431
249 H GLY 35 H GLY 35 -0.763 8.276 -5.345
250 1HA GLY 35 1HA GLY 35 -1.645 10.351 -4.878
251 2HA GLY 35 2HA GLY 35 -3.234 9.641 -4.555
252 H LEU 36 H LEU 36 -1.061 7.805 -2.884
253 HA LEU 36 HA LEU 36 -2.012 8.599 -0.348
254 1HB LEU 36 2HB LEU 36 0.362 6.877 -1.146
255 2HB LEU 36 3HB LEU 36 -0.434 6.918 0.431
256 HG LEU 36 HG LEU 36 -1.835 6.006 -2.079
257 1HD1 LEU 36 1HD1 LEU 36 0.026 4.503 -1.456
258 2HD1 LEU 36 2HD1 LEU 36 -0.583 4.428 0.211
259 3HD1 LEU 36 3HD1 LEU 36 -1.541 3.743 -1.119
260 1HD2 LEU 36 1HD2 LEU 36 -3.424 6.838 -0.417
261 2HD2 LEU 36 2HD2 LEU 36 -3.471 5.075 -0.450
262 3HD2 LEU 36 3HD2 LEU 36 -2.618 5.906 0.866
263 H SER 37 H SER 37 0.827 9.560 -2.251
264 HA SER 37 HA SER 37 2.289 10.936 -0.183
265 1HB SER 37 2HB SER 37 3.289 12.083 -2.161
266 2HB SER 37 3HB SER 37 3.233 10.331 -2.408
267 HG SER 37 HG SER 37 1.463 12.242 -3.503
268 H LYS 38 H LYS 38 -0.606 11.736 -2.054
269 HA LYS 38 HA LYS 38 -0.272 14.588 -1.438
270 1HB LYS 38 2HB LYS 38 -1.353 13.342 -3.629
271 2HB LYS 38 3HB LYS 38 -2.805 13.558 -2.681
272 1HG LYS 38 2HG LYS 38 -1.397 16.050 -2.499
273 2HG LYS 38 3HG LYS 38 -1.227 15.526 -4.179
274 1HD LYS 38 2HD LYS 38 -3.680 15.339 -4.369
275 2HD LYS 38 3HD LYS 38 -3.853 15.702 -2.633
276 1HE LYS 38 2HE LYS 38 -2.761 17.929 -2.996
277 2HE LYS 38 3HE LYS 38 -2.661 17.590 -4.731
278 1HZ LYS 38 1HZ LYS 38 -5.147 17.804 -3.161
279 2HZ LYS 38 2HZ LYS 38 -4.545 18.951 -4.172
280 3HZ LYS 38 3HZ LYS 38 -5.062 17.513 -4.781
281 H MET 39 H MET 39 -2.068 11.682 -0.505
282 HA MET 39 HA MET 39 -4.003 12.955 1.109
283 1HB MET 39 2HB MET 39 -2.711 10.229 1.033
284 2HB MET 39 3HB MET 39 -3.602 10.665 2.471
285 1HG MET 39 2HG MET 39 -5.587 11.219 1.142
286 2HG MET 39 3HG MET 39 -4.750 10.702 -0.334
287 1HE MET 39 1HE MET 39 -7.626 9.687 1.262
288 2HE MET 39 2HE MET 39 -7.168 9.470 -0.440
289 3HE MET 39 3HE MET 39 -7.591 8.053 0.557
290 H SER 40 H SER 40 -3.772 14.206 2.944
291 HA SER 40 HA SER 40 -1.325 14.635 4.283
292 1HB SER 40 2HB SER 40 -4.144 14.882 5.423
293 2HB SER 40 3HB SER 40 -2.711 15.812 5.902
294 HG SER 40 HG SER 40 -2.715 16.629 3.699
295 H ALA 41 H ALA 41 -0.703 13.951 6.453
296 HA ALA 41 HA ALA 41 -0.640 11.306 7.103
297 1HB ALA 41 1HB ALA 41 -0.784 13.649 9.044
298 2HB ALA 41 2HB ALA 41 -0.219 12.011 9.433
299 3HB ALA 41 3HB ALA 41 0.677 12.996 8.272
300 H ASN 42 H ASN 42 -3.186 13.612 7.986
301 HA ASN 42 HA ASN 42 -4.850 12.147 9.652
302 1HB ASN 42 2HB ASN 42 -5.845 13.828 7.314
303 2HB ASN 42 3HB ASN 42 -6.697 13.467 8.816
304 1HD2 ASN 42 1HD2 ASN 42 -5.686 16.051 7.421
305 2HD2 ASN 42 2HD2 ASN 42 -4.808 16.870 8.701
306 H GLN 43 H GLN 43 -4.902 12.169 6.056
307 HA GLN 43 HA GLN 43 -7.017 10.170 5.932
308 1HB GLN 43 2HB GLN 43 -5.244 11.418 3.793
309 2HB GLN 43 3HB GLN 43 -6.570 10.289 3.479
310 1HG GLN 43 2HG GLN 43 -6.799 13.062 4.730
311 2HG GLN 43 3HG GLN 43 -7.282 12.605 3.094
312 1HE2 GLN 43 1HE2 GLN 43 -8.865 10.505 3.146
313 2HE2 GLN 43 2HE2 GLN 43 -10.164 10.677 4.312
314 H VAL 44 H VAL 44 -3.416 10.228 5.455
315 HA VAL 44 HA VAL 44 -3.193 7.574 4.493
316 HB VAL 44 HB VAL 44 -1.343 9.302 6.206
317 1HG1 VAL 44 1HG1 VAL 44 -0.574 6.994 6.361
318 2HG1 VAL 44 2HG1 VAL 44 -0.750 6.796 4.603
319 3HG1 VAL 44 3HG1 VAL 44 0.474 7.913 5.268
320 1HG2 VAL 44 1HG2 VAL 44 -0.271 9.886 4.082
321 2HG2 VAL 44 2HG2 VAL 44 -1.407 8.839 3.189
322 3HG2 VAL 44 3HG2 VAL 44 -1.971 10.299 3.998
323 H LYS 45 H LYS 45 -3.208 8.879 7.833
324 HA LYS 45 HA LYS 45 -2.875 6.383 9.160
325 1HB LYS 45 2HB LYS 45 -2.597 8.760 10.077
326 2HB LYS 45 3HB LYS 45 -4.359 8.800 10.215
327 1HG LYS 45 2HG LYS 45 -3.622 6.371 11.469
328 2HG LYS 45 3HG LYS 45 -2.271 7.450 11.827
329 1HD LYS 45 2HD LYS 45 -4.186 9.171 12.464
330 2HD LYS 45 3HD LYS 45 -5.202 7.714 12.541
331 1HE LYS 45 2HE LYS 45 -3.532 6.726 14.182
332 2HE LYS 45 3HE LYS 45 -2.603 8.234 14.089
333 1HZ LYS 45 1HZ LYS 45 -4.550 9.390 14.941
334 2HZ LYS 45 2HZ LYS 45 -5.344 7.958 15.120
335 3HZ LYS 45 3HZ LYS 45 -3.985 8.262 15.993
336 H ASP 46 H ASP 46 -5.798 8.275 8.125
337 HA ASP 46 HA ASP 46 -7.618 6.529 9.334
338 1HB ASP 46 2HB ASP 46 -8.049 8.862 8.311
339 2HB ASP 46 3HB ASP 46 -8.253 8.034 6.761
340 H VAL 47 H VAL 47 -6.555 6.586 5.898
341 HA VAL 47 HA VAL 47 -7.870 4.230 5.101
342 HB VAL 47 HB VAL 47 -6.417 4.134 3.203
343 1HG1 VAL 47 1HG1 VAL 47 -7.025 6.136 2.186
344 2HG1 VAL 47 2HG1 VAL 47 -8.164 6.052 3.554
345 3HG1 VAL 47 3HG1 VAL 47 -6.752 7.102 3.632
346 1HG2 VAL 47 1HG2 VAL 47 -4.550 5.625 2.803
347 2HG2 VAL 47 2HG2 VAL 47 -4.663 6.116 4.499
348 3HG2 VAL 47 3HG2 VAL 47 -4.219 4.447 4.087
349 H PHE 48 H PHE 48 -4.585 4.609 6.556
350 HA PHE 48 HA PHE 48 -3.787 1.944 6.629
351 1HB PHE 48 2HB PHE 48 -2.201 3.270 7.549
352 2HB PHE 48 3HB PHE 48 -3.345 4.291 8.377
353 HD1 PHE 48 1HD PHE 48 -3.674 4.110 10.700
354 HD2 PHE 48 2HD PHE 48 -2.035 0.777 8.520
355 HE1 PHE 48 1HE PHE 48 -3.739 2.745 12.755
356 HE2 PHE 48 2HE PHE 48 -2.205 -0.618 10.563
357 HZ PHE 48 HZ PHE 48 -3.094 0.354 12.670
358 H ARG 49 H ARG 49 -6.188 3.473 8.878
359 HA ARG 49 HA ARG 49 -6.595 1.080 10.399
360 1HB ARG 49 2HB ARG 49 -8.563 3.339 9.881
361 2HB ARG 49 3HB ARG 49 -8.727 2.072 11.093
362 1HG ARG 49 2HG ARG 49 -6.626 2.799 12.186
363 2HG ARG 49 3HG ARG 49 -6.497 4.148 11.050
364 1HD ARG 49 2HD ARG 49 -8.783 3.615 12.986
365 2HD ARG 49 3HD ARG 49 -7.516 4.848 13.182
366 HE ARG 49 HE ARG 49 -8.792 5.325 10.676
367 1HH1 ARG 49 2HH2 ARG 49 -9.660 5.334 14.091
368 2HH1 ARG 49 1HH2 ARG 49 -10.878 6.565 13.937
369 1HH2 ARG 49 2HH1 ARG 49 -10.421 6.864 10.423
370 2HH2 ARG 49 1HH1 ARG 49 -11.266 7.549 11.780
371 H PHE 50 H PHE 50 -7.854 2.030 7.214
372 HA PHE 50 HA PHE 50 -9.886 -0.099 7.198
373 1HB PHE 50 2HB PHE 50 -8.862 1.857 5.149
374 2HB PHE 50 3HB PHE 50 -9.597 0.365 4.618
375 HD1 PHE 50 1HD PHE 50 -11.945 -0.122 4.896
376 HD2 PHE 50 2HD PHE 50 -10.268 3.526 6.480
377 HE1 PHE 50 1HE PHE 50 -14.219 0.841 5.089
378 HE2 PHE 50 2HE PHE 50 -12.544 4.493 6.643
379 HZ PHE 50 HZ PHE 50 -14.523 3.168 5.918
380 H ILE 51 H ILE 51 -6.433 0.221 6.369
381 HA ILE 51 HA ILE 51 -6.416 -2.408 5.055
382 HB ILE 51 HB ILE 51 -4.006 -0.719 5.797
383 1HG1 ILE 51 2HG1 ILE 51 -5.419 0.728 4.434
384 2HG1 ILE 51 3HG1 ILE 51 -4.068 0.167 3.499
385 1HG2 ILE 51 1HG2 ILE 51 -3.044 -2.684 4.966
386 2HG2 ILE 51 2HG2 ILE 51 -4.459 -3.105 3.987
387 3HG2 ILE 51 3HG2 ILE 51 -3.329 -1.865 3.461
388 1HD1 ILE 51 1HD1 ILE 51 -6.980 -0.551 3.237
389 2HD1 ILE 51 2HD1 ILE 51 -5.764 -0.138 2.003
390 3HD1 ILE 51 3HD1 ILE 51 -5.776 -1.743 2.702
391 H ASP 52 H ASP 52 -4.198 -3.694 6.066
392 HA ASP 52 HA ASP 52 -3.355 -5.012 7.652
393 1HB ASP 52 2HB ASP 52 -3.324 -2.923 9.086
394 2HB ASP 52 3HB ASP 52 -4.852 -3.444 9.783
395 H ASN 53 H ASN 53 -6.677 -4.233 8.504
396 HA ASN 53 HA ASN 53 -8.574 -5.488 8.168
397 1HB ASN 53 2HB ASN 53 -7.264 -7.269 6.821
398 2HB ASN 53 3HB ASN 53 -7.070 -8.131 8.352
399 1HD2 ASN 53 1HD2 ASN 53 -8.772 -9.485 8.946
400 2HD2 ASN 53 2HD2 ASN 53 -10.355 -9.440 8.193
401 H ASP 54 H ASP 54 -6.139 -7.141 10.265
402 HA ASP 54 HA ASP 54 -7.714 -7.452 12.529
403 1HB ASP 54 2HB ASP 54 -5.108 -6.656 13.406
404 2HB ASP 54 3HB ASP 54 -5.808 -8.261 13.384
405 H GLN 55 H GLN 55 -6.188 -4.542 11.320
406 HA GLN 55 HA GLN 55 -5.848 -2.479 12.140
407 1HB GLN 55 2HB GLN 55 -8.424 -3.048 13.671
408 2HB GLN 55 3HB GLN 55 -7.488 -1.580 13.950
409 1HG GLN 55 2HG GLN 55 -7.650 -0.941 11.624
410 2HG GLN 55 3HG GLN 55 -8.591 -2.399 11.250
411 1HE2 GLN 55 1HE2 GLN 55 -9.882 -0.279 10.508
412 2HE2 GLN 55 2HE2 GLN 55 -11.131 0.223 11.656
413 H SER 56 H SER 56 -4.089 -4.250 12.898
414 HA SER 56 HA SER 56 -3.763 -4.136 15.861
415 1HB SER 56 2HB SER 56 -1.841 -5.629 15.485
416 2HB SER 56 3HB SER 56 -3.388 -6.342 15.018
417 HG SER 56 HG SER 56 -2.878 -6.186 12.938
418 H GLY 57 H GLY 57 -2.234 -3.251 12.747
419 1HA GLY 57 1HA GLY 57 -1.218 -0.983 12.650
420 2HA GLY 57 2HA GLY 57 -0.499 -1.247 14.235
421 H TYR 58 H TYR 58 0.194 -4.042 13.720
422 HA TYR 58 HA TYR 58 2.629 -3.770 12.033
423 1HB TYR 58 2HB TYR 58 1.369 -6.036 13.609
424 2HB TYR 58 3HB TYR 58 2.704 -6.235 12.481
425 HD1 TYR 58 HD1 TYR 58 4.806 -6.400 13.432
426 HD2 TYR 58 HD2 TYR 58 1.872 -3.889 15.360
427 HE1 TYR 58 HE1 TYR 58 6.491 -5.700 15.101
428 HE2 TYR 58 HE2 TYR 58 3.574 -3.160 16.991
429 HH TYR 58 HH TYR 58 6.951 -4.303 16.892
430 H LEU 59 H LEU 59 2.256 -3.504 9.962
431 HA LEU 59 HA LEU 59 0.230 -5.132 8.543
432 1HB LEU 59 2HB LEU 59 2.113 -2.876 7.769
433 2HB LEU 59 3HB LEU 59 1.445 -3.959 6.544
434 HG LEU 59 HG LEU 59 0.155 -1.843 6.822
435 1HD1 LEU 59 1HD1 LEU 59 -0.888 -3.707 5.752
436 2HD1 LEU 59 2HD1 LEU 59 -1.309 -4.450 7.301
437 3HD1 LEU 59 3HD1 LEU 59 -2.049 -2.914 6.846
438 1HD2 LEU 59 1HD2 LEU 59 0.320 -1.590 9.271
439 2HD2 LEU 59 2HD2 LEU 59 -1.339 -1.520 8.650
440 3HD2 LEU 59 3HD2 LEU 59 -0.780 -2.981 9.478
441 H ASP 60 H ASP 60 1.027 -7.034 9.252
442 HA ASP 60 HA ASP 60 3.763 -7.863 8.873
443 1HB ASP 60 2HB ASP 60 1.377 -9.698 9.239
444 2HB ASP 60 3HB ASP 60 3.073 -9.926 9.719
445 H GLU 61 H GLU 61 4.517 -9.415 7.318
446 HA GLU 61 HA GLU 61 4.152 -8.720 4.714
447 1HB GLU 61 2HB GLU 61 5.000 -11.459 5.758
448 2HB GLU 61 3HB GLU 61 5.290 -10.852 4.126
449 1HG GLU 61 2HG GLU 61 6.714 -9.059 4.971
450 2HG GLU 61 3HG GLU 61 6.389 -9.502 6.646
451 H GLU 62 H GLU 62 2.544 -11.471 6.312
452 HA GLU 62 HA GLU 62 1.243 -12.516 4.054
453 1HB GLU 62 2HB GLU 62 1.494 -13.428 6.532
454 2HB GLU 62 3HB GLU 62 -0.005 -12.536 6.830
455 1HG GLU 62 2HG GLU 62 -0.692 -14.731 6.316
456 2HG GLU 62 3HG GLU 62 -0.950 -13.870 4.791
457 H GLU 63 H GLU 63 0.254 -9.798 6.199
458 HA GLU 63 HA GLU 63 -2.448 -9.657 5.100
459 1HB GLU 63 2HB GLU 63 -0.742 -7.694 6.631
460 2HB GLU 63 3HB GLU 63 -2.468 -7.479 6.327
461 1HG GLU 63 2HG GLU 63 -3.139 -9.077 7.810
462 2HG GLU 63 3HG GLU 63 -1.772 -10.156 7.529
463 H LEU 64 H LEU 64 0.744 -8.358 4.331
464 HA LEU 64 HA LEU 64 -0.109 -6.409 2.478
465 1HB LEU 64 2HB LEU 64 2.360 -7.443 3.345
466 2HB LEU 64 3HB LEU 64 2.362 -7.695 1.599
467 HG LEU 64 HG LEU 64 1.596 -5.035 2.898
468 1HD1 LEU 64 1HD1 LEU 64 3.930 -4.301 2.538
469 2HD1 LEU 64 2HD1 LEU 64 3.807 -5.596 3.742
470 3HD1 LEU 64 3HD1 LEU 64 4.372 -5.967 2.099
471 1HD2 LEU 64 1HD2 LEU 64 2.170 -4.070 0.750
472 2HD2 LEU 64 2HD2 LEU 64 2.821 -5.611 0.164
473 3HD2 LEU 64 3HD2 LEU 64 1.078 -5.427 0.429
474 H LYS 65 H LYS 65 -0.074 -9.934 2.279
475 HA LYS 65 HA LYS 65 -0.480 -10.228 -0.519
476 1HB LYS 65 2HB LYS 65 0.029 -11.990 1.300
477 2HB LYS 65 3HB LYS 65 -1.728 -11.958 1.606
478 1HG LYS 65 2HG LYS 65 -2.232 -12.808 -0.573
479 2HG LYS 65 3HG LYS 65 -0.560 -12.568 -1.110
480 1HD LYS 65 2HD LYS 65 -0.925 -14.924 -0.631
481 2HD LYS 65 3HD LYS 65 0.239 -14.238 0.514
482 1HE LYS 65 2HE LYS 65 -1.611 -14.040 2.224
483 2HE LYS 65 3HE LYS 65 -2.717 -14.820 1.074
484 1HZ LYS 65 1HZ LYS 65 -1.152 -16.749 1.195
485 2HZ LYS 65 2HZ LYS 65 -0.283 -15.896 2.322
486 3HZ LYS 65 3HZ LYS 65 -1.790 -16.345 2.670
487 H PHE 66 H PHE 66 -2.540 -8.689 1.783
488 HA PHE 66 HA PHE 66 -4.682 -8.648 -0.255
489 1HB PHE 66 2HB PHE 66 -4.943 -9.239 2.716
490 2HB PHE 66 3HB PHE 66 -6.257 -8.455 1.871
491 HD1 PHE 66 1HD PHE 66 -4.229 -11.588 1.881
492 HD2 PHE 66 2HD PHE 66 -7.839 -9.621 0.570
493 HE1 PHE 66 1HE PHE 66 -5.063 -13.725 0.931
494 HE2 PHE 66 2HE PHE 66 -8.663 -11.754 -0.367
495 HZ PHE 66 HZ PHE 66 -7.267 -13.806 -0.218
496 H PHE 67 H PHE 67 -2.362 -6.815 0.541
497 HA PHE 67 HA PHE 67 -3.298 -4.593 2.004
498 1HB PHE 67 2HB PHE 67 -1.009 -4.724 1.576
499 2HB PHE 67 3HB PHE 67 -1.215 -4.954 -0.152
500 HD1 PHE 67 1HD PHE 67 -1.111 -3.097 -1.626
501 HD2 PHE 67 2HD PHE 67 -1.304 -2.466 2.627
502 HE1 PHE 67 1HE PHE 67 -0.849 -0.671 -1.982
503 HE2 PHE 67 2HE PHE 67 -1.056 -0.023 2.277
504 HZ PHE 67 HZ PHE 67 -0.835 0.887 -0.030
505 H LEU 68 H LEU 68 -3.050 -4.689 -1.589
506 HA LEU 68 HA LEU 68 -4.919 -2.512 -1.776
507 1HB LEU 68 2HB LEU 68 -2.811 -3.042 -3.189
508 2HB LEU 68 3HB LEU 68 -3.871 -4.166 -4.050
509 HG LEU 68 HG LEU 68 -5.232 -2.369 -4.885
510 1HD1 LEU 68 1HD1 LEU 68 -4.469 0.011 -4.465
511 2HD1 LEU 68 2HD1 LEU 68 -5.138 -0.794 -3.039
512 3HD1 LEU 68 3HD1 LEU 68 -3.391 -0.614 -3.186
513 1HD2 LEU 68 1HD2 LEU 68 -3.550 -1.371 -6.344
514 2HD2 LEU 68 2HD2 LEU 68 -2.269 -1.671 -5.145
515 3HD2 LEU 68 3HD2 LEU 68 -3.008 -3.021 -5.992
516 H GLN 69 H GLN 69 -5.329 -5.916 -1.642
517 HA GLN 69 HA GLN 69 -7.591 -6.352 -3.309
518 1HB GLN 69 2HB GLN 69 -6.901 -7.529 -0.574
519 2HB GLN 69 3HB GLN 69 -8.278 -8.053 -1.539
520 1HG GLN 69 2HG GLN 69 -5.376 -8.224 -2.408
521 2HG GLN 69 3HG GLN 69 -6.349 -9.567 -1.808
522 1HE2 GLN 69 1HE2 GLN 69 -4.994 -9.147 -4.465
523 2HE2 GLN 69 2HE2 GLN 69 -6.264 -9.416 -5.631
524 H LYS 70 H LYS 70 -7.487 -5.364 0.148
525 HA LYS 70 HA LYS 70 -10.332 -4.694 0.118
526 1HB LYS 70 2HB LYS 70 -10.019 -4.191 2.450
527 2HB LYS 70 3HB LYS 70 -9.199 -5.705 2.012
528 1HG LYS 70 2HG LYS 70 -7.110 -4.007 1.693
529 2HG LYS 70 3HG LYS 70 -8.030 -3.049 2.838
530 1HD LYS 70 2HD LYS 70 -7.030 -5.923 3.215
531 2HD LYS 70 3HD LYS 70 -6.341 -4.467 3.897
532 1HE LYS 70 2HE LYS 70 -7.562 -5.298 5.687
533 2HE LYS 70 3HE LYS 70 -8.629 -4.057 5.036
534 1HZ LYS 70 1HZ LYS 70 -9.696 -6.217 5.585
535 2HZ LYS 70 2HZ LYS 70 -9.968 -5.675 4.047
536 3HZ LYS 70 3HZ LYS 70 -8.893 -6.891 4.342
537 H PHE 71 H PHE 71 -9.165 -3.281 -1.884
538 HA PHE 71 HA PHE 71 -9.642 -0.469 -1.209
539 1HB PHE 71 2HB PHE 71 -6.954 -1.526 -1.534
540 2HB PHE 71 3HB PHE 71 -7.357 -0.566 -2.951
541 HD1 PHE 71 1HD PHE 71 -5.856 1.250 -2.714
542 HD2 PHE 71 2HD PHE 71 -8.212 0.047 0.689
543 HE1 PHE 71 1HE PHE 71 -4.987 3.160 -1.448
544 HE2 PHE 71 2HE PHE 71 -7.334 1.965 1.958
545 HZ PHE 71 HZ PHE 71 -5.725 3.546 0.894
546 H GLU 72 H GLU 72 -8.388 -2.708 -3.739
547 HA GLU 72 HA GLU 72 -10.277 -1.528 -5.722
548 1HB GLU 72 2HB GLU 72 -7.799 -1.518 -6.157
549 2HB GLU 72 3HB GLU 72 -7.833 -3.287 -6.142
550 1HG GLU 72 2HG GLU 72 -7.877 -2.627 -8.419
551 2HG GLU 72 3HG GLU 72 -9.535 -3.127 -8.076
552 H SER 73 H SER 73 -9.205 -4.690 -4.385
553 HA SER 73 HA SER 73 -10.142 -6.698 -4.306
554 1HB SER 73 2HB SER 73 -12.540 -5.761 -5.915
555 2HB SER 73 3HB SER 73 -12.335 -7.277 -5.048
556 HG SER 73 HG SER 73 -13.194 -4.984 -4.059
557 H GLY 74 H GLY 74 -8.844 -7.970 -5.361
558 1HA GLY 74 1HA GLY 74 -8.193 -9.417 -7.073
559 2HA GLY 74 2HA GLY 74 -9.206 -8.551 -8.238
560 H ALA 75 H ALA 75 -6.747 -7.285 -5.992
561 HA ALA 75 HA ALA 75 -5.314 -5.932 -8.172
562 1HB ALA 75 1HB ALA 75 -4.912 -5.881 -5.168
563 2HB ALA 75 2HB ALA 75 -4.183 -4.792 -6.379
564 3HB ALA 75 3HB ALA 75 -5.923 -4.752 -6.095
565 H ARG 76 H ARG 76 -2.710 -6.162 -6.480
566 HA ARG 76 HA ARG 76 -1.883 -8.396 -8.255
567 1HB ARG 76 2HB ARG 76 -1.215 -5.884 -8.617
568 2HB ARG 76 3HB ARG 76 -0.135 -6.122 -7.242
569 1HG ARG 76 2HG ARG 76 0.992 -6.395 -9.393
570 2HG ARG 76 3HG ARG 76 1.060 -7.908 -8.488
571 1HD ARG 76 2HD ARG 76 -0.555 -8.963 -9.913
572 2HD ARG 76 3HD ARG 76 -1.232 -7.414 -10.419
573 HE ARG 76 HE ARG 76 0.633 -6.972 -11.826
574 1HH1 ARG 76 2HH2 ARG 76 1.209 -10.100 -10.295
575 2HH1 ARG 76 1HH2 ARG 76 1.696 -10.886 -11.768
576 1HH2 ARG 76 2HH1 ARG 76 1.283 -8.005 -13.775
577 2HH2 ARG 76 1HH1 ARG 76 2.017 -9.580 -13.724
578 H GLU 77 H GLU 77 -2.110 -7.491 -5.092
579 HA GLU 77 HA GLU 77 -0.096 -7.936 -3.604
580 1HB GLU 77 2HB GLU 77 -2.638 -9.365 -2.819
581 2HB GLU 77 3HB GLU 77 -1.542 -8.370 -1.837
582 1HG GLU 77 2HG GLU 77 -3.699 -7.510 -3.780
583 2HG GLU 77 3HG GLU 77 -3.467 -7.067 -2.083
584 H LEU 78 H LEU 78 -1.922 -10.628 -4.883
585 HA LEU 78 HA LEU 78 -0.716 -12.828 -3.694
586 1HB LEU 78 2HB LEU 78 -1.462 -12.790 -6.636
587 2HB LEU 78 3HB LEU 78 -1.404 -14.147 -5.523
588 HG LEU 78 HG LEU 78 -3.624 -13.842 -5.764
589 1HD1 LEU 78 1HD1 LEU 78 -3.162 -12.067 -3.333
590 2HD1 LEU 78 2HD1 LEU 78 -4.603 -13.019 -3.715
591 3HD1 LEU 78 3HD1 LEU 78 -3.075 -13.843 -3.350
592 1HD2 LEU 78 1HD2 LEU 78 -3.445 -11.672 -7.049
593 2HD2 LEU 78 2HD2 LEU 78 -4.896 -11.918 -6.072
594 3HD2 LEU 78 3HD2 LEU 78 -3.642 -10.823 -5.503
595 H THR 79 H THR 79 0.588 -10.898 -6.472
596 HA THR 79 HA THR 79 2.878 -12.638 -6.833
597 HB THR 79 HB THR 79 2.705 -9.675 -7.479
598 HG1 THR 79 1HG THR 79 2.806 -11.056 -9.607
599 1HG2 THR 79 1HG2 THR 79 4.623 -10.311 -9.032
600 2HG2 THR 79 2HG2 THR 79 5.032 -10.697 -7.366
601 3HG2 THR 79 3HG2 THR 79 4.507 -11.975 -8.453
602 H GLU 80 H GLU 80 4.131 -12.998 -5.140
603 HA GLU 80 HA GLU 80 4.501 -11.343 -2.905
604 1HB GLU 80 2HB GLU 80 6.462 -12.687 -2.387
605 2HB GLU 80 3HB GLU 80 5.053 -13.653 -2.815
606 1HG GLU 80 2HG GLU 80 6.025 -13.954 -5.148
607 2HG GLU 80 3HG GLU 80 7.484 -13.114 -4.585
608 H SER 81 H SER 81 6.596 -11.507 -5.899
609 HA SER 81 HA SER 81 8.433 -9.618 -5.263
610 1HB SER 81 2HB SER 81 7.188 -9.593 -8.025
611 2HB SER 81 3HB SER 81 8.874 -9.456 -7.533
612 HG SER 81 HG SER 81 8.512 -11.538 -8.275
613 H GLU 82 H GLU 82 5.273 -8.830 -6.869
614 HA GLU 82 HA GLU 82 5.812 -6.068 -6.935
615 1HB GLU 82 2HB GLU 82 3.081 -7.390 -7.038
616 2HB GLU 82 3HB GLU 82 3.516 -5.812 -7.665
617 1HG GLU 82 2HG GLU 82 5.312 -7.748 -8.880
618 2HG GLU 82 3HG GLU 82 3.649 -8.345 -8.986
619 H THR 83 H THR 83 4.044 -8.101 -4.551
620 HA THR 83 HA THR 83 3.214 -5.895 -2.934
621 HB THR 83 HB THR 83 2.871 -8.673 -2.863
622 HG1 THR 83 1HG THR 83 1.763 -7.874 -0.787
623 1HG2 THR 83 1HG2 THR 83 4.806 -9.066 -1.357
624 2HG2 THR 83 2HG2 THR 83 4.154 -7.862 -0.218
625 3HG2 THR 83 3HG2 THR 83 3.268 -9.358 -0.556
626 H LYS 84 H LYS 84 6.107 -7.920 -3.018
627 HA LYS 84 HA LYS 84 7.369 -6.943 -0.704
628 1HB LYS 84 2HB LYS 84 7.983 -9.044 -1.500
629 2HB LYS 84 3HB LYS 84 8.351 -8.473 -3.122
630 1HG LYS 84 2HG LYS 84 9.951 -7.602 -0.697
631 2HG LYS 84 3HG LYS 84 10.287 -9.068 -1.628
632 1HD LYS 84 2HD LYS 84 10.000 -7.094 -3.621
633 2HD LYS 84 3HD LYS 84 10.860 -6.254 -2.325
634 1HE LYS 84 2HE LYS 84 12.647 -7.893 -2.356
635 2HE LYS 84 3HE LYS 84 11.739 -8.933 -3.473
636 1HZ LYS 84 1HZ LYS 84 12.698 -6.225 -4.117
637 2HZ LYS 84 2HZ LYS 84 13.381 -7.633 -4.629
638 3HZ LYS 84 3HZ LYS 84 11.869 -7.223 -5.128
639 H SER 85 H SER 85 7.392 -5.742 -4.083
640 HA SER 85 HA SER 85 9.357 -3.784 -3.818
641 1HB SER 85 2HB SER 85 6.686 -3.518 -5.256
642 2HB SER 85 3HB SER 85 8.127 -2.525 -5.493
643 HG SER 85 HG SER 85 8.120 -4.137 -7.011
644 H LEU 86 H LEU 86 5.953 -3.684 -2.585
645 HA LEU 86 HA LEU 86 6.309 -1.002 -1.484
646 1HB LEU 86 2HB LEU 86 4.212 -3.149 -1.237
647 2HB LEU 86 3HB LEU 86 4.335 -1.976 0.071
648 HG LEU 86 HG LEU 86 4.234 -1.075 -2.794
649 1HD1 LEU 86 1HD1 LEU 86 1.885 -1.709 -0.947
650 2HD1 LEU 86 2HD1 LEU 86 1.749 -0.798 -2.465
651 3HD1 LEU 86 3HD1 LEU 86 2.262 -2.500 -2.492
652 1HD2 LEU 86 1HD2 LEU 86 3.324 0.989 -1.824
653 2HD2 LEU 86 2HD2 LEU 86 3.302 0.258 -0.209
654 3HD2 LEU 86 3HD2 LEU 86 4.846 0.606 -1.011
655 H MET 87 H MET 87 6.237 -4.318 -0.086
656 HA MET 87 HA MET 87 6.862 -3.757 2.464
657 1HB MET 87 2HB MET 87 6.627 -6.078 1.389
658 2HB MET 87 3HB MET 87 8.360 -5.960 1.028
659 1HG MET 87 2HG MET 87 8.418 -5.373 3.686
660 2HG MET 87 3HG MET 87 6.989 -6.401 3.637
661 1HE MET 87 1HE MET 87 8.637 -9.736 2.253
662 2HE MET 87 2HE MET 87 7.110 -8.924 2.650
663 3HE MET 87 3HE MET 87 8.016 -8.450 1.193
664 H ALA 88 H ALA 88 9.226 -3.976 -0.118
665 HA ALA 88 HA ALA 88 11.652 -3.895 1.201
666 1HB ALA 88 1HB ALA 88 10.740 -3.026 -1.574
667 2HB ALA 88 2HB ALA 88 12.453 -2.989 -1.080
668 3HB ALA 88 3HB ALA 88 11.545 -4.513 -1.082
669 H ALA 89 H ALA 89 9.721 -1.086 0.045
670 HA ALA 89 HA ALA 89 11.778 0.785 1.131
671 1HB ALA 89 1HB ALA 89 10.282 2.535 0.248
672 2HB ALA 89 2HB ALA 89 10.770 1.368 -0.993
673 3HB ALA 89 3HB ALA 89 9.139 1.267 -0.248
674 H ALA 90 H ALA 90 8.411 -0.300 1.710
675 HA ALA 90 HA ALA 90 7.712 1.578 3.712
676 1HB ALA 90 1HB ALA 90 6.086 0.089 2.641
677 2HB ALA 90 2HB ALA 90 6.900 -1.327 3.348
678 3HB ALA 90 3HB ALA 90 6.079 -0.157 4.407
679 H ASP 91 H ASP 91 9.329 -1.633 3.979
680 HA ASP 91 HA ASP 91 9.571 -1.381 6.825
681 1HB ASP 91 2HB ASP 91 9.461 -3.606 5.692
682 2HB ASP 91 3HB ASP 91 11.069 -3.307 5.024
683 H ASN 92 H ASN 92 10.495 0.763 6.831
684 HA ASN 92 HA ASN 92 13.226 1.177 5.863
685 1HB ASN 92 2HB ASN 92 13.040 3.382 6.909
686 2HB ASN 92 3HB ASN 92 11.688 3.000 5.837
687 1HD2 ASN 92 1HD2 ASN 92 10.601 4.819 7.006
688 2HD2 ASN 92 2HD2 ASN 92 9.813 4.439 8.526
689 H ASP 93 H ASP 93 13.227 -1.089 7.381
690 HA ASP 93 HA ASP 93 14.906 -0.425 9.773
691 1HB ASP 93 2HB ASP 93 12.748 -2.554 9.436
692 2HB ASP 93 3HB ASP 93 14.024 -2.674 10.644
693 H GLY 94 H GLY 94 13.791 -3.079 7.621
694 1HA GLY 94 1HA GLY 94 15.237 -4.475 6.295
695 2HA GLY 94 2HA GLY 94 16.570 -4.180 7.422
696 H ASP 95 H ASP 95 13.100 -4.918 7.963
697 HA ASP 95 HA ASP 95 13.808 -7.544 9.151
698 1HB ASP 95 2HB ASP 95 12.259 -7.330 10.939
699 2HB ASP 95 3HB ASP 95 13.459 -6.039 11.034
700 H GLY 96 H GLY 96 10.799 -5.701 8.267
701 1HA GLY 96 1HA GLY 96 9.856 -6.457 6.014
702 2HA GLY 96 2HA GLY 96 9.898 -8.091 6.687
703 H LYS 97 H LYS 97 9.279 -6.870 9.440
704 HA LYS 97 HA LYS 97 6.346 -6.887 9.276
705 1HB LYS 97 2HB LYS 97 8.240 -6.625 11.655
706 2HB LYS 97 3HB LYS 97 6.476 -6.762 11.693
707 1HG LYS 97 2HG LYS 97 6.913 -8.975 10.292
708 2HG LYS 97 3HG LYS 97 8.553 -8.829 10.952
709 1HD LYS 97 2HD LYS 97 7.466 -8.701 13.287
710 2HD LYS 97 3HD LYS 97 5.903 -8.937 12.492
711 1HE LYS 97 2HE LYS 97 6.509 -11.080 13.304
712 2HE LYS 97 3HE LYS 97 6.745 -11.127 11.552
713 1HZ LYS 97 1HZ LYS 97 8.575 -12.129 12.698
714 2HZ LYS 97 2HZ LYS 97 9.111 -10.764 11.956
715 3HZ LYS 97 3HZ LYS 97 8.856 -10.773 13.584
716 H ILE 98 H ILE 98 5.561 -5.018 8.523
717 HA ILE 98 HA ILE 98 6.993 -2.463 8.931
718 HB ILE 98 HB ILE 98 4.834 -3.508 7.112
719 1HG1 ILE 98 2HG1 ILE 98 7.395 -2.084 6.385
720 2HG1 ILE 98 3HG1 ILE 98 7.499 -3.763 6.912
721 1HG2 ILE 98 1HG2 ILE 98 4.700 -1.337 6.034
722 2HG2 ILE 98 2HG2 ILE 98 4.223 -1.159 7.723
723 3HG2 ILE 98 3HG2 ILE 98 5.827 -0.626 7.192
724 1HD1 ILE 98 1HD1 ILE 98 5.711 -2.859 4.629
725 2HD1 ILE 98 2HD1 ILE 98 7.363 -3.512 4.505
726 3HD1 ILE 98 3HD1 ILE 98 6.054 -4.525 5.158
727 H GLY 99 H GLY 99 6.445 -1.372 10.820
728 1HA GLY 99 1HA GLY 99 3.858 -1.643 12.081
729 2HA GLY 99 2HA GLY 99 5.062 -0.391 12.392
730 H ALA 100 H ALA 100 2.282 0.117 12.371
731 HA ALA 100 HA ALA 100 1.305 1.394 10.040
732 1HB ALA 100 1HB ALA 100 0.903 2.193 12.959
733 2HB ALA 100 2HB ALA 100 -0.104 2.676 11.575
734 3HB ALA 100 3HB ALA 100 -0.046 0.978 12.075
735 H GLU 101 H GLU 101 3.468 2.424 12.656
736 HA GLU 101 HA GLU 101 4.005 5.039 11.919
737 1HB GLU 101 2HB GLU 101 6.129 4.736 13.151
738 2HB GLU 101 3HB GLU 101 4.686 4.175 14.003
739 1HG GLU 101 2HG GLU 101 5.364 1.831 12.881
740 2HG GLU 101 3HG GLU 101 6.962 2.589 12.878
741 H GLU 102 H GLU 102 5.857 2.106 10.930
742 HA GLU 102 HA GLU 102 7.552 3.274 9.057
743 1HB GLU 102 2HB GLU 102 6.278 0.511 9.011
744 2HB GLU 102 3HB GLU 102 7.675 1.014 8.055
745 1HG GLU 102 2HG GLU 102 8.935 1.462 10.144
746 2HG GLU 102 3HG GLU 102 7.560 0.914 11.107
747 H PHE 103 H PHE 103 4.251 1.957 8.503
748 HA PHE 103 HA PHE 103 4.090 2.640 5.763
749 1HB PHE 103 2HB PHE 103 2.185 1.818 7.825
750 2HB PHE 103 3HB PHE 103 1.472 3.012 6.762
751 HD1 PHE 103 1HD PHE 103 1.706 2.676 4.190
752 HD2 PHE 103 2HD PHE 103 2.251 -0.452 7.094
753 HE1 PHE 103 1HE PHE 103 1.494 0.973 2.395
754 HE2 PHE 103 2HE PHE 103 2.223 -2.141 5.266
755 HZ PHE 103 HZ PHE 103 1.763 -1.439 2.931
756 H GLN 104 H GLN 104 2.838 4.654 8.507
757 HA GLN 104 HA GLN 104 2.055 6.870 6.819
758 1HB GLN 104 2HB GLN 104 1.351 6.380 9.256
759 2HB GLN 104 3HB GLN 104 2.901 7.115 9.714
760 1HG GLN 104 2HG GLN 104 2.154 9.106 8.168
761 2HG GLN 104 3HG GLN 104 0.552 8.371 8.220
762 1HE2 GLN 104 1HE2 GLN 104 -0.166 7.848 10.629
763 2HE2 GLN 104 2HE2 GLN 104 0.180 9.152 11.767
764 H GLU 105 H GLU 105 5.202 6.053 8.418
765 HA GLU 105 HA GLU 105 6.505 8.502 7.805
766 1HB GLU 105 2HB GLU 105 7.407 5.644 8.251
767 2HB GLU 105 3HB GLU 105 8.561 6.802 7.601
768 1HG GLU 105 2HG GLU 105 6.973 7.380 10.129
769 2HG GLU 105 3HG GLU 105 8.532 6.542 10.139
770 H MET 106 H MET 106 6.471 5.408 5.927
771 HA MET 106 HA MET 106 7.915 6.462 3.733
772 1HB MET 106 2HB MET 106 7.455 4.044 4.255
773 2HB MET 106 3HB MET 106 5.810 4.237 3.632
774 1HG MET 106 2HG MET 106 8.325 4.878 2.045
775 2HG MET 106 3HG MET 106 7.587 3.284 2.035
776 1HE MET 106 1HE MET 106 7.943 6.435 0.163
777 2HE MET 106 2HE MET 106 8.318 4.835 -0.537
778 3HE MET 106 3HE MET 106 7.044 5.849 -1.251
779 H VAL 107 H VAL 107 4.418 6.150 4.281
780 HA VAL 107 HA VAL 107 3.727 7.261 1.767
781 HB VAL 107 HB VAL 107 2.083 6.658 4.236
782 1HG1 VAL 107 1HG1 VAL 107 0.167 6.774 2.570
783 2HG1 VAL 107 2HG1 VAL 107 0.898 8.343 2.950
784 3HG1 VAL 107 3HG1 VAL 107 1.322 7.533 1.442
785 1HG2 VAL 107 1HG2 VAL 107 1.347 4.723 2.896
786 2HG2 VAL 107 2HG2 VAL 107 2.375 5.233 1.544
787 3HG2 VAL 107 3HG2 VAL 107 3.109 4.676 3.058
788 H HIS 108 H HIS 108 4.245 8.831 4.942
789 HA HIS 108 HA HIS 108 3.079 11.315 3.835
790 1HB HIS 108 2HB HIS 108 2.533 10.469 6.147
791 2HB HIS 108 3HB HIS 108 4.158 10.975 6.622
792 HD1 HIS 108 1HD HIS 108 1.530 12.828 4.410
793 HD2 HIS 108 2HD HIS 108 3.809 13.227 7.929
794 HE1 HIS 108 1HE HIS 108 1.109 15.188 5.297
795 H SER 109 H SER 109 5.798 9.884 3.130
796 HA SER 109 HA SER 109 7.800 11.746 3.996
797 1HB SER 109 2HB SER 109 8.080 9.264 3.348
798 2HB SER 109 3HB SER 109 7.946 9.792 1.661
799 HG SER 109 HG SER 109 9.830 10.754 3.568
Start of MODEL 10
1 1H MET 1 H1 MET 1 -17.958 5.411 3.671
2 2H MET 1 H2 MET 1 -18.329 6.687 2.675
3 3H MET 1 H3 MET 1 -17.805 5.255 2.043
4 HA MET 1 HA MET 1 -16.000 6.810 2.014
5 1HB MET 1 2HB MET 1 -16.523 6.883 5.022
6 2HB MET 1 3HB MET 1 -15.078 7.521 4.229
7 1HG MET 1 2HG MET 1 -16.422 9.165 3.000
8 2HG MET 1 3HG MET 1 -17.914 8.482 3.658
9 1HE MET 1 1HE MET 1 -14.522 9.278 5.652
10 2HE MET 1 2HE MET 1 -14.709 10.581 4.446
11 3HE MET 1 3HE MET 1 -14.927 10.924 6.177
12 H SER 2 H SER 2 -14.428 5.348 1.479
13 HA SER 2 HA SER 2 -13.063 3.747 3.362
14 1HB SER 2 2HB SER 2 -15.141 2.271 3.195
15 2HB SER 2 3HB SER 2 -14.785 2.079 1.465
16 HG SER 2 HG SER 2 -13.861 0.403 2.712
17 H ILE 3 H ILE 3 -12.216 5.628 1.696
18 HA ILE 3 HA ILE 3 -10.828 6.250 0.136
19 HB ILE 3 HB ILE 3 -8.977 5.150 -0.207
20 1HG1 ILE 3 2HG1 ILE 3 -8.875 2.542 -0.355
21 2HG1 ILE 3 3HG1 ILE 3 -10.501 2.672 -1.001
22 1HG2 ILE 3 1HG2 ILE 3 -9.645 4.861 2.198
23 2HG2 ILE 3 2HG2 ILE 3 -10.031 3.169 1.829
24 3HG2 ILE 3 3HG2 ILE 3 -8.393 3.762 1.605
25 1HD1 ILE 3 1HD1 ILE 3 -7.954 3.999 -2.023
26 2HD1 ILE 3 2HD1 ILE 3 -8.843 2.681 -2.790
27 3HD1 ILE 3 3HD1 ILE 3 -9.558 4.304 -2.732
28 H THR 4 H THR 4 -12.516 3.395 -1.090
29 HA THR 4 HA THR 4 -12.694 3.430 -3.628
30 HB THR 4 HB THR 4 -13.693 1.923 -1.873
31 HG1 THR 4 1HG THR 4 -14.133 2.106 -4.161
32 1HG2 THR 4 1HG2 THR 4 -14.991 3.660 -0.579
33 2HG2 THR 4 2HG2 THR 4 -16.107 3.794 -1.958
34 3HG2 THR 4 3HG2 THR 4 -15.957 2.261 -1.088
35 H ASP 5 H ASP 5 -14.260 5.928 -1.690
36 HA ASP 5 HA ASP 5 -14.664 7.362 -4.151
37 1HB ASP 5 2HB ASP 5 -16.869 6.224 -3.894
38 2HB ASP 5 3HB ASP 5 -17.054 6.954 -2.285
39 H VAL 6 H VAL 6 -12.733 7.768 -2.592
40 HA VAL 6 HA VAL 6 -13.401 10.297 -1.074
41 HB VAL 6 HB VAL 6 -11.060 8.381 -0.715
42 1HG1 VAL 6 1HG1 VAL 6 -10.310 10.676 -0.310
43 2HG1 VAL 6 2HG1 VAL 6 -11.724 10.983 0.722
44 3HG1 VAL 6 3HG1 VAL 6 -10.479 9.821 1.225
45 1HG2 VAL 6 1HG2 VAL 6 -13.176 7.517 0.259
46 2HG2 VAL 6 2HG2 VAL 6 -12.058 8.022 1.536
47 3HG2 VAL 6 3HG2 VAL 6 -13.425 9.063 1.094
48 H LEU 7 H LEU 7 -10.784 8.766 -2.929
49 HA LEU 7 HA LEU 7 -10.507 10.861 -4.868
50 1HB LEU 7 2HB LEU 7 -9.469 12.218 -3.184
51 2HB LEU 7 3HB LEU 7 -8.635 10.839 -2.465
52 HG LEU 7 HG LEU 7 -7.126 10.677 -4.421
53 1HD1 LEU 7 1HD1 LEU 7 -8.572 13.164 -5.435
54 2HD1 LEU 7 2HD1 LEU 7 -7.080 12.467 -6.106
55 3HD1 LEU 7 3HD1 LEU 7 -8.589 11.560 -6.205
56 1HD2 LEU 7 1HD2 LEU 7 -5.861 12.724 -4.008
57 2HD2 LEU 7 2HD2 LEU 7 -7.270 13.444 -3.190
58 3HD2 LEU 7 3HD2 LEU 7 -6.473 12.003 -2.514
59 H SER 8 H SER 8 -8.536 8.609 -2.887
60 HA SER 8 HA SER 8 -6.787 7.778 -4.791
61 1HB SER 8 2HB SER 8 -6.800 5.680 -3.115
62 2HB SER 8 3HB SER 8 -6.060 7.243 -2.769
63 HG SER 8 HG SER 8 -7.472 6.587 -1.073
64 H ALA 9 H ALA 9 -10.117 6.793 -4.592
65 HA ALA 9 HA ALA 9 -10.118 4.343 -5.946
66 1HB ALA 9 1HB ALA 9 -12.047 5.577 -4.975
67 2HB ALA 9 2HB ALA 9 -11.995 6.718 -6.333
68 3HB ALA 9 3HB ALA 9 -12.373 5.004 -6.632
69 H ASP 10 H ASP 10 -9.682 7.663 -7.303
70 HA ASP 10 HA ASP 10 -9.722 6.701 -10.071
71 1HB ASP 10 2HB ASP 10 -10.299 9.036 -9.403
72 2HB ASP 10 3HB ASP 10 -8.613 9.291 -8.911
73 H ASP 11 H ASP 11 -7.323 7.434 -7.554
74 HA ASP 11 HA ASP 11 -5.030 7.331 -9.208
75 1HB ASP 11 2HB ASP 11 -5.242 6.887 -6.201
76 2HB ASP 11 3HB ASP 11 -3.810 7.300 -7.145
77 H ILE 12 H ILE 12 -6.601 4.812 -7.118
78 HA ILE 12 HA ILE 12 -4.732 2.798 -7.617
79 HB ILE 12 HB ILE 12 -6.434 1.255 -7.019
80 1HG1 ILE 12 2HG1 ILE 12 -8.331 3.542 -6.894
81 2HG1 ILE 12 3HG1 ILE 12 -8.414 2.189 -8.028
82 1HG2 ILE 12 1HG2 ILE 12 -6.692 1.969 -4.683
83 2HG2 ILE 12 2HG2 ILE 12 -5.080 2.320 -5.308
84 3HG2 ILE 12 3HG2 ILE 12 -6.260 3.624 -5.135
85 1HD1 ILE 12 1HD1 ILE 12 -8.923 2.123 -5.060
86 2HD1 ILE 12 2HD1 ILE 12 -10.034 1.748 -6.383
87 3HD1 ILE 12 3HD1 ILE 12 -8.682 0.650 -6.047
88 H ALA 13 H ALA 13 -7.560 3.881 -9.536
89 HA ALA 13 HA ALA 13 -7.502 1.742 -11.423
90 1HB ALA 13 1HB ALA 13 -9.380 3.349 -11.197
91 2HB ALA 13 2HB ALA 13 -8.376 4.612 -11.933
92 3HB ALA 13 3HB ALA 13 -8.801 3.173 -12.862
93 H ALA 14 H ALA 14 -5.790 4.898 -11.298
94 HA ALA 14 HA ALA 14 -4.303 4.531 -13.713
95 1HB ALA 14 1HB ALA 14 -2.811 6.224 -12.886
96 2HB ALA 14 2HB ALA 14 -4.467 6.678 -12.445
97 3HB ALA 14 3HB ALA 14 -3.367 6.018 -11.224
98 H ALA 15 H ALA 15 -3.379 3.808 -10.315
99 HA ALA 15 HA ALA 15 -0.853 2.739 -10.709
100 1HB ALA 15 1HB ALA 15 -1.115 1.678 -8.560
101 2HB ALA 15 2HB ALA 15 -1.961 3.241 -8.487
102 3HB ALA 15 3HB ALA 15 -2.882 1.740 -8.671
103 H LEU 16 H LEU 16 -3.952 1.084 -10.793
104 HA LEU 16 HA LEU 16 -3.113 -1.558 -11.101
105 1HB LEU 16 2HB LEU 16 -5.544 0.010 -11.956
106 2HB LEU 16 3HB LEU 16 -5.317 -1.559 -12.713
107 HG LEU 16 HG LEU 16 -5.407 -1.195 -9.698
108 1HD1 LEU 16 1HD1 LEU 16 -7.584 -1.990 -11.694
109 2HD1 LEU 16 2HD1 LEU 16 -7.722 -2.096 -9.927
110 3HD1 LEU 16 3HD1 LEU 16 -7.549 -0.515 -10.701
111 1HD2 LEU 16 1HD2 LEU 16 -5.885 -3.652 -9.768
112 2HD2 LEU 16 2HD2 LEU 16 -5.647 -3.646 -11.524
113 3HD2 LEU 16 3HD2 LEU 16 -4.288 -3.306 -10.436
114 H GLN 17 H GLN 17 -3.349 1.063 -13.515
115 HA GLN 17 HA GLN 17 -2.796 -0.806 -15.744
116 1HB GLN 17 2HB GLN 17 -3.921 1.902 -15.469
117 2HB GLN 17 3HB GLN 17 -2.611 1.840 -16.646
118 1HG GLN 17 2HG GLN 17 -4.517 1.415 -17.894
119 2HG GLN 17 3HG GLN 17 -3.754 -0.161 -17.725
120 1HE2 GLN 17 1HE2 GLN 17 -4.738 -0.793 -15.027
121 2HE2 GLN 17 2HE2 GLN 17 -6.474 -0.981 -15.177
122 H GLU 18 H GLU 18 -1.211 1.858 -13.966
123 HA GLU 18 HA GLU 18 0.987 1.872 -15.774
124 1HB GLU 18 2HB GLU 18 1.782 3.658 -14.622
125 2HB GLU 18 3HB GLU 18 0.047 3.722 -14.328
126 1HG GLU 18 2HG GLU 18 0.583 4.056 -12.203
127 2HG GLU 18 3HG GLU 18 0.842 2.305 -12.119
128 H CYS 19 H CYS 19 0.400 0.012 -12.841
129 HA CYS 19 HA CYS 19 3.009 -1.445 -13.221
130 1HB CYS 19 2HB CYS 19 1.312 -0.975 -10.778
131 2HB CYS 19 3HB CYS 19 2.581 -2.219 -10.910
132 HG CYS 19 HG CYS 19 2.931 1.067 -11.393
133 H ARG 20 H ARG 20 1.067 -1.960 -15.140
134 HA ARG 20 HA ARG 20 -0.707 -4.142 -14.302
135 1HB ARG 20 2HB ARG 20 -0.210 -2.586 -16.770
136 2HB ARG 20 3HB ARG 20 -0.216 -4.282 -17.136
137 1HG ARG 20 2HG ARG 20 -2.446 -2.976 -15.557
138 2HG ARG 20 3HG ARG 20 -2.458 -3.082 -17.310
139 1HD ARG 20 2HD ARG 20 -2.258 -5.463 -15.415
140 2HD ARG 20 3HD ARG 20 -3.766 -4.846 -16.127
141 HE ARG 20 HE ARG 20 -1.936 -5.259 -18.237
142 1HH1 ARG 20 2HH2 ARG 20 -3.723 -7.174 -15.892
143 2HH1 ARG 20 1HH2 ARG 20 -3.851 -8.596 -16.882
144 1HH2 ARG 20 2HH1 ARG 20 -2.104 -7.102 -19.615
145 2HH2 ARG 20 1HH1 ARG 20 -2.912 -8.537 -19.078
146 H ASP 21 H ASP 21 2.548 -3.769 -15.555
147 HA ASP 21 HA ASP 21 2.801 -6.505 -16.441
148 1HB ASP 21 2HB ASP 21 4.557 -4.024 -16.386
149 2HB ASP 21 3HB ASP 21 5.186 -5.591 -16.859
150 HA PRO 22 HA PRO 22 3.900 -8.170 -12.604
151 1HB PRO 22 2HB PRO 22 5.684 -10.172 -13.173
152 2HB PRO 22 3HB PRO 22 3.936 -10.252 -13.533
153 1HG PRO 22 2HG PRO 22 6.169 -9.438 -15.409
154 2HG PRO 22 3HG PRO 22 4.855 -10.612 -15.724
155 1HD PRO 22 2HD PRO 22 4.679 -8.054 -16.604
156 2HD PRO 22 3HD PRO 22 3.237 -8.849 -15.900
157 H ASP 23 H ASP 23 5.419 -8.179 -10.987
158 HA ASP 23 HA ASP 23 6.924 -7.159 -9.716
159 1HB ASP 23 2HB ASP 23 8.632 -8.389 -11.914
160 2HB ASP 23 3HB ASP 23 9.208 -7.952 -10.304
161 H THR 24 H THR 24 5.775 -5.158 -11.149
162 HA THR 24 HA THR 24 8.021 -3.334 -11.909
163 HB THR 24 HB THR 24 5.099 -3.079 -12.778
164 HG1 THR 24 1HG THR 24 5.792 -4.888 -13.711
165 1HG2 THR 24 1HG2 THR 24 7.661 -1.859 -13.911
166 2HG2 THR 24 2HG2 THR 24 6.027 -1.651 -14.573
167 3HG2 THR 24 3HG2 THR 24 6.423 -0.972 -12.988
168 H PHE 25 H PHE 25 5.403 -3.818 -9.737
169 HA PHE 25 HA PHE 25 4.813 -1.226 -9.037
170 1HB PHE 25 2HB PHE 25 4.587 -3.918 -7.887
171 2HB PHE 25 3HB PHE 25 4.818 -2.728 -6.665
172 HD1 PHE 25 1HD PHE 25 2.383 -4.279 -8.785
173 HD2 PHE 25 2HD PHE 25 3.339 -0.478 -7.020
174 HE1 PHE 25 1HE PHE 25 0.049 -3.549 -9.112
175 HE2 PHE 25 2HE PHE 25 1.044 0.304 -7.515
176 HZ PHE 25 HZ PHE 25 -0.630 -1.243 -8.477
177 H GLU 26 H GLU 26 6.164 0.408 -8.487
178 HA GLU 26 HA GLU 26 8.493 -0.107 -6.712
179 1HB GLU 26 2HB GLU 26 8.018 1.747 -8.972
180 2HB GLU 26 3HB GLU 26 8.509 2.583 -7.502
181 1HG GLU 26 2HG GLU 26 10.419 0.657 -7.511
182 2HG GLU 26 3HG GLU 26 10.109 0.822 -9.242
183 HA PRO 27 HA PRO 27 6.427 1.744 -3.354
184 1HB PRO 27 2HB PRO 27 8.420 2.985 -1.916
185 2HB PRO 27 3HB PRO 27 8.212 1.224 -2.110
186 1HG PRO 27 2HG PRO 27 10.095 3.023 -3.680
187 2HG PRO 27 3HG PRO 27 10.457 1.465 -2.917
188 1HD PRO 27 2HD PRO 27 9.856 1.689 -5.542
189 2HD PRO 27 3HD PRO 27 9.361 0.259 -4.588
190 H GLN 28 H GLN 28 8.768 4.415 -3.881
191 HA GLN 28 HA GLN 28 7.000 6.502 -3.354
192 1HB GLN 28 2HB GLN 28 9.472 6.428 -5.116
193 2HB GLN 28 3HB GLN 28 8.619 7.912 -4.649
194 1HG GLN 28 2HG GLN 28 8.975 7.444 -2.272
195 2HG GLN 28 3HG GLN 28 9.797 5.924 -2.649
196 1HE2 GLN 28 1HE2 GLN 28 11.915 6.032 -3.784
197 2HE2 GLN 28 2HE2 GLN 28 12.850 7.509 -3.621
198 H LYS 29 H LYS 29 7.734 5.010 -6.467
199 HA LYS 29 HA LYS 29 6.119 6.404 -8.221
200 1HB LYS 29 2HB LYS 29 7.638 4.517 -8.774
201 2HB LYS 29 3HB LYS 29 6.522 3.414 -7.955
202 1HG LYS 29 2HG LYS 29 6.329 3.148 -10.284
203 2HG LYS 29 3HG LYS 29 4.811 3.757 -9.671
204 1HD LYS 29 2HD LYS 29 6.953 5.569 -10.923
205 2HD LYS 29 3HD LYS 29 5.793 4.633 -11.876
206 1HE LYS 29 2HE LYS 29 4.044 5.820 -10.178
207 2HE LYS 29 3HE LYS 29 5.286 7.086 -10.214
208 1HZ LYS 29 1HZ LYS 29 5.034 7.046 -12.644
209 2HZ LYS 29 2HZ LYS 29 3.926 5.838 -12.498
210 3HZ LYS 29 3HZ LYS 29 3.566 7.312 -11.909
211 H PHE 30 H PHE 30 5.053 3.470 -6.308
212 HA PHE 30 HA PHE 30 2.351 3.814 -7.046
213 1HB PHE 30 2HB PHE 30 3.336 1.699 -6.238
214 2HB PHE 30 3HB PHE 30 3.505 2.392 -4.628
215 HD1 PHE 30 1HD PHE 30 0.413 2.921 -6.695
216 HD2 PHE 30 2HD PHE 30 2.263 0.441 -3.713
217 HE1 PHE 30 1HE PHE 30 -1.779 1.958 -6.139
218 HE2 PHE 30 2HE PHE 30 0.072 -0.594 -3.231
219 HZ PHE 30 HZ PHE 30 -1.964 0.198 -4.409
220 H PHE 31 H PHE 31 4.180 4.986 -4.174
221 HA PHE 31 HA PHE 31 1.988 5.935 -2.683
222 1HB PHE 31 2HB PHE 31 4.683 7.301 -2.851
223 2HB PHE 31 3HB PHE 31 3.528 7.353 -1.524
224 HD1 PHE 31 1HD PHE 31 6.403 6.799 -1.135
225 HD2 PHE 31 2HD PHE 31 3.041 4.146 -1.674
226 HE1 PHE 31 1HE PHE 31 7.688 4.963 -0.126
227 HE2 PHE 31 2HE PHE 31 4.253 2.395 -0.429
228 HZ PHE 31 HZ PHE 31 6.613 2.744 0.255
229 H GLN 32 H GLN 32 3.718 7.489 -5.428
230 HA GLN 32 HA GLN 32 2.028 9.891 -5.236
231 1HB GLN 32 2HB GLN 32 4.339 9.968 -6.101
232 2HB GLN 32 3HB GLN 32 3.819 9.023 -7.513
233 1HG GLN 32 2HG GLN 32 2.239 10.800 -8.155
234 2HG GLN 32 3HG GLN 32 2.501 11.641 -6.621
235 1HE2 GLN 32 1HE2 GLN 32 4.887 10.257 -8.963
236 2HE2 GLN 32 2HE2 GLN 32 5.699 11.796 -9.214
237 H THR 33 H THR 33 2.190 7.039 -7.440
238 HA THR 33 HA THR 33 0.055 7.990 -9.005
239 HB THR 33 HB THR 33 2.032 5.953 -9.137
240 HG1 THR 33 1HG THR 33 -0.064 6.673 -10.802
241 1HG2 THR 33 1HG2 THR 33 -0.648 4.735 -9.733
242 2HG2 THR 33 2HG2 THR 33 0.967 3.988 -9.855
243 3HG2 THR 33 3HG2 THR 33 0.287 4.356 -8.268
244 H SER 34 H SER 34 0.003 6.381 -5.977
245 HA SER 34 HA SER 34 -2.787 5.520 -6.241
246 1HB SER 34 2HB SER 34 -0.888 4.236 -5.108
247 2HB SER 34 3HB SER 34 -1.065 5.348 -3.757
248 HG SER 34 HG SER 34 -2.302 3.355 -3.638
249 H GLY 35 H GLY 35 -1.187 8.442 -5.568
250 1HA GLY 35 1HA GLY 35 -2.060 10.432 -4.836
251 2HA GLY 35 2HA GLY 35 -3.566 9.628 -4.379
252 H LEU 36 H LEU 36 -1.948 7.652 -2.753
253 HA LEU 36 HA LEU 36 -2.201 8.430 -0.238
254 1HB LEU 36 2HB LEU 36 -0.385 6.547 -1.682
255 2HB LEU 36 3HB LEU 36 0.099 6.907 -0.044
256 HG LEU 36 HG LEU 36 -1.280 4.896 -0.231
257 1HD1 LEU 36 1HD1 LEU 36 -1.124 6.374 1.838
258 2HD1 LEU 36 2HD1 LEU 36 -2.749 6.968 1.433
259 3HD1 LEU 36 3HD1 LEU 36 -2.478 5.244 1.760
260 1HD2 LEU 36 1HD2 LEU 36 -2.862 5.553 -1.989
261 2HD2 LEU 36 2HD2 LEU 36 -3.713 5.031 -0.529
262 3HD2 LEU 36 3HD2 LEU 36 -3.609 6.754 -0.918
263 H SER 37 H SER 37 0.808 9.212 -2.064
264 HA SER 37 HA SER 37 2.060 10.466 0.234
265 1HB SER 37 2HB SER 37 3.626 11.417 -1.465
266 2HB SER 37 3HB SER 37 3.465 9.666 -1.582
267 HG SER 37 HG SER 37 1.993 9.943 -3.278
268 H LYS 38 H LYS 38 -0.384 11.544 -1.992
269 HA LYS 38 HA LYS 38 0.234 14.382 -1.600
270 1HB LYS 38 2HB LYS 38 -0.930 13.147 -3.717
271 2HB LYS 38 3HB LYS 38 -2.378 13.434 -2.761
272 1HG LYS 38 2HG LYS 38 -1.310 15.882 -2.502
273 2HG LYS 38 3HG LYS 38 -0.443 15.409 -3.976
274 1HD LYS 38 2HD LYS 38 -2.694 14.890 -5.029
275 2HD LYS 38 3HD LYS 38 -3.463 15.460 -3.529
276 1HE LYS 38 2HE LYS 38 -2.185 17.679 -3.871
277 2HE LYS 38 3HE LYS 38 -1.758 17.084 -5.484
278 1HZ LYS 38 1HZ LYS 38 -4.487 17.530 -4.455
279 2HZ LYS 38 2HZ LYS 38 -3.691 18.475 -5.537
280 3HZ LYS 38 3HZ LYS 38 -4.132 16.945 -5.954
281 H MET 39 H MET 39 -1.924 11.749 -0.596
282 HA MET 39 HA MET 39 -3.662 13.361 0.976
283 1HB MET 39 2HB MET 39 -2.938 10.416 0.996
284 2HB MET 39 3HB MET 39 -4.097 11.083 2.115
285 1HG MET 39 2HG MET 39 -4.407 11.342 -0.906
286 2HG MET 39 3HG MET 39 -4.976 9.970 0.032
287 1HE MET 39 1HE MET 39 -5.525 13.637 -0.926
288 2HE MET 39 2HE MET 39 -7.100 14.012 -0.196
289 3HE MET 39 3HE MET 39 -5.652 14.062 0.806
290 H SER 40 H SER 40 -3.601 13.885 3.189
291 HA SER 40 HA SER 40 -0.903 14.173 4.246
292 1HB SER 40 2HB SER 40 -2.131 15.319 6.114
293 2HB SER 40 3HB SER 40 -2.465 15.989 4.511
294 HG SER 40 HG SER 40 -4.489 15.453 4.774
295 H ALA 41 H ALA 41 -0.326 13.460 6.410
296 HA ALA 41 HA ALA 41 -0.446 10.791 6.957
297 1HB ALA 41 1HB ALA 41 -0.321 13.037 9.011
298 2HB ALA 41 2HB ALA 41 0.214 11.361 9.253
299 3HB ALA 41 3HB ALA 41 1.056 12.397 8.087
300 H ASN 42 H ASN 42 -2.884 13.190 7.878
301 HA ASN 42 HA ASN 42 -4.513 11.663 9.623
302 1HB ASN 42 2HB ASN 42 -4.819 14.060 7.895
303 2HB ASN 42 3HB ASN 42 -6.285 13.095 7.963
304 1HD2 ASN 42 1HD2 ASN 42 -3.805 14.531 10.174
305 2HD2 ASN 42 2HD2 ASN 42 -4.976 14.855 11.438
306 H GLN 43 H GLN 43 -4.677 11.912 6.027
307 HA GLN 43 HA GLN 43 -6.791 9.904 5.952
308 1HB GLN 43 2HB GLN 43 -5.444 11.693 3.986
309 2HB GLN 43 3HB GLN 43 -5.906 10.115 3.349
310 1HG GLN 43 2HG GLN 43 -7.784 12.023 4.802
311 2HG GLN 43 3HG GLN 43 -7.691 11.829 3.049
312 1HE2 GLN 43 1HE2 GLN 43 -7.586 9.056 2.677
313 2HE2 GLN 43 2HE2 GLN 43 -9.021 8.335 3.386
314 H VAL 44 H VAL 44 -3.203 9.950 5.308
315 HA VAL 44 HA VAL 44 -3.193 7.286 4.336
316 HB VAL 44 HB VAL 44 -1.022 8.799 5.843
317 1HG1 VAL 44 1HG1 VAL 44 0.458 7.194 4.460
318 2HG1 VAL 44 2HG1 VAL 44 -0.407 6.492 5.828
319 3HG1 VAL 44 3HG1 VAL 44 -1.016 6.270 4.162
320 1HG2 VAL 44 1HG2 VAL 44 -0.167 9.236 3.497
321 2HG2 VAL 44 2HG2 VAL 44 -1.691 8.588 2.871
322 3HG2 VAL 44 3HG2 VAL 44 -1.673 10.057 3.855
323 H LYS 45 H LYS 45 -3.121 8.569 7.706
324 HA LYS 45 HA LYS 45 -2.780 6.040 8.968
325 1HB LYS 45 2HB LYS 45 -2.476 8.234 10.075
326 2HB LYS 45 3HB LYS 45 -4.234 8.474 10.050
327 1HG LYS 45 2HG LYS 45 -4.484 6.359 11.394
328 2HG LYS 45 3HG LYS 45 -2.713 6.201 11.395
329 1HD LYS 45 2HD LYS 45 -2.597 8.484 12.531
330 2HD LYS 45 3HD LYS 45 -4.361 8.506 12.546
331 1HE LYS 45 2HE LYS 45 -3.640 7.821 14.731
332 2HE LYS 45 3HE LYS 45 -4.373 6.421 13.943
333 1HZ LYS 45 1HZ LYS 45 -2.140 5.623 13.460
334 2HZ LYS 45 2HZ LYS 45 -1.468 6.940 14.177
335 3HZ LYS 45 3HZ LYS 45 -2.325 5.866 15.072
336 H ASP 46 H ASP 46 -5.748 7.934 8.096
337 HA ASP 46 HA ASP 46 -7.628 6.114 9.124
338 1HB ASP 46 2HB ASP 46 -8.179 8.391 8.319
339 2HB ASP 46 3HB ASP 46 -7.944 7.858 6.645
340 H VAL 47 H VAL 47 -6.480 6.322 5.707
341 HA VAL 47 HA VAL 47 -7.751 3.921 4.910
342 HB VAL 47 HB VAL 47 -6.449 3.921 2.942
343 1HG1 VAL 47 1HG1 VAL 47 -8.095 5.899 3.437
344 2HG1 VAL 47 2HG1 VAL 47 -6.624 6.877 3.476
345 3HG1 VAL 47 3HG1 VAL 47 -7.025 5.973 2.018
346 1HG2 VAL 47 1HG2 VAL 47 -4.493 5.671 4.291
347 2HG2 VAL 47 2HG2 VAL 47 -4.213 4.071 3.575
348 3HG2 VAL 47 3HG2 VAL 47 -4.579 5.459 2.530
349 H PHE 48 H PHE 48 -4.416 4.451 6.182
350 HA PHE 48 HA PHE 48 -3.403 1.877 6.066
351 1HB PHE 48 2HB PHE 48 -1.988 3.588 6.848
352 2HB PHE 48 3HB PHE 48 -3.061 3.984 8.182
353 HD1 PHE 48 1HD PHE 48 -3.287 2.538 10.169
354 HD2 PHE 48 2HD PHE 48 -0.470 1.644 7.023
355 HE1 PHE 48 1HE PHE 48 -2.340 0.684 11.523
356 HE2 PHE 48 2HE PHE 48 0.653 0.014 8.506
357 HZ PHE 48 HZ PHE 48 -0.340 -0.519 10.745
358 H ARG 49 H ARG 49 -5.619 3.164 8.654
359 HA ARG 49 HA ARG 49 -5.682 0.734 10.138
360 1HB ARG 49 2HB ARG 49 -7.880 2.806 9.734
361 2HB ARG 49 3HB ARG 49 -7.983 1.419 10.818
362 1HG ARG 49 2HG ARG 49 -5.888 2.245 11.996
363 2HG ARG 49 3HG ARG 49 -5.975 3.702 10.992
364 1HD ARG 49 2HD ARG 49 -7.056 4.156 13.128
365 2HD ARG 49 3HD ARG 49 -8.265 4.135 11.821
366 HE ARG 49 HE ARG 49 -7.894 1.550 13.118
367 1HH1 ARG 49 2HH2 ARG 49 -9.604 4.618 13.397
368 2HH1 ARG 49 1HH2 ARG 49 -10.935 3.987 14.314
369 1HH2 ARG 49 2HH1 ARG 49 -9.652 0.658 14.317
370 2HH2 ARG 49 1HH1 ARG 49 -10.947 1.669 14.861
371 H PHE 50 H PHE 50 -7.473 1.653 7.167
372 HA PHE 50 HA PHE 50 -9.177 -0.673 7.230
373 1HB PHE 50 2HB PHE 50 -9.145 1.667 5.776
374 2HB PHE 50 3HB PHE 50 -8.532 0.533 4.588
375 HD1 PHE 50 1HD PHE 50 -9.940 -1.665 4.230
376 HD2 PHE 50 2HD PHE 50 -11.448 1.814 6.289
377 HE1 PHE 50 1HE PHE 50 -12.250 -2.525 3.998
378 HE2 PHE 50 2HE PHE 50 -13.749 0.932 6.085
379 HZ PHE 50 HZ PHE 50 -14.156 -1.255 4.972
380 H ILE 51 H ILE 51 -5.960 0.086 5.823
381 HA ILE 51 HA ILE 51 -5.728 -2.485 4.511
382 HB ILE 51 HB ILE 51 -3.555 -0.497 5.209
383 1HG1 ILE 51 2HG1 ILE 51 -3.436 -0.345 2.680
384 2HG1 ILE 51 3HG1 ILE 51 -4.946 -1.256 2.570
385 1HG2 ILE 51 1HG2 ILE 51 -2.142 -1.852 3.673
386 2HG2 ILE 51 2HG2 ILE 51 -2.623 -2.787 5.067
387 3HG2 ILE 51 3HG2 ILE 51 -3.451 -3.047 3.535
388 1HD1 ILE 51 1HD1 ILE 51 -5.072 1.264 2.324
389 2HD1 ILE 51 2HD1 ILE 51 -6.132 0.610 3.578
390 3HD1 ILE 51 3HD1 ILE 51 -4.567 1.394 4.001
391 H ASP 52 H ASP 52 -4.787 -1.346 7.779
392 HA ASP 52 HA ASP 52 -3.554 -3.867 8.525
393 1HB ASP 52 2HB ASP 52 -2.954 -1.590 9.479
394 2HB ASP 52 3HB ASP 52 -4.486 -1.608 10.331
395 H ASN 53 H ASN 53 -5.630 -4.881 7.603
396 HA ASN 53 HA ASN 53 -8.013 -5.225 9.126
397 1HB ASN 53 2HB ASN 53 -6.425 -6.973 7.256
398 2HB ASN 53 3HB ASN 53 -7.454 -7.809 8.411
399 1HD2 ASN 53 1HD2 ASN 53 -9.067 -8.604 7.069
400 2HD2 ASN 53 2HD2 ASN 53 -10.120 -7.537 6.158
401 H ASP 54 H ASP 54 -8.480 -6.435 10.926
402 HA ASP 54 HA ASP 54 -8.223 -7.466 12.888
403 1HB ASP 54 2HB ASP 54 -6.862 -9.184 13.066
404 2HB ASP 54 3HB ASP 54 -6.198 -8.794 11.488
405 H GLN 55 H GLN 55 -5.813 -5.066 11.903
406 HA GLN 55 HA GLN 55 -4.749 -3.456 12.971
407 1HB GLN 55 2HB GLN 55 -7.060 -3.405 14.906
408 2HB GLN 55 3HB GLN 55 -5.866 -2.149 14.585
409 1HG GLN 55 2HG GLN 55 -7.719 -1.418 13.406
410 2HG GLN 55 3HG GLN 55 -6.649 -2.066 12.177
411 1HE2 GLN 55 1HE2 GLN 55 -9.015 -3.661 14.443
412 2HE2 GLN 55 2HE2 GLN 55 -10.032 -4.288 13.158
413 H SER 56 H SER 56 -3.966 -6.110 13.615
414 HA SER 56 HA SER 56 -3.256 -6.752 16.112
415 1HB SER 56 2HB SER 56 -1.042 -7.571 15.158
416 2HB SER 56 3HB SER 56 -2.481 -8.183 14.378
417 HG SER 56 HG SER 56 -0.673 -7.402 12.972
418 H GLY 57 H GLY 57 -2.001 -3.984 14.368
419 1HA GLY 57 1HA GLY 57 -0.802 -2.205 15.606
420 2HA GLY 57 2HA GLY 57 0.087 -3.477 16.462
421 H TYR 58 H TYR 58 -0.161 -5.064 13.693
422 HA TYR 58 HA TYR 58 1.912 -3.572 12.210
423 1HB TYR 58 2HB TYR 58 2.150 -6.443 13.165
424 2HB TYR 58 3HB TYR 58 3.187 -5.702 11.954
425 HD1 TYR 58 HD1 TYR 58 4.568 -3.631 12.574
426 HD2 TYR 58 HD2 TYR 58 2.634 -6.129 15.510
427 HE1 TYR 58 HE1 TYR 58 5.986 -2.646 14.341
428 HE2 TYR 58 HE2 TYR 58 4.062 -5.139 17.281
429 HH TYR 58 HH TYR 58 6.427 -2.550 16.608
430 H LEU 59 H LEU 59 2.279 -4.218 10.166
431 HA LEU 59 HA LEU 59 0.128 -5.725 8.746
432 1HB LEU 59 2HB LEU 59 2.237 -3.710 7.868
433 2HB LEU 59 3HB LEU 59 1.453 -4.815 6.728
434 HG LEU 59 HG LEU 59 0.463 -2.523 6.832
435 1HD1 LEU 59 1HD1 LEU 59 -1.903 -3.370 6.931
436 2HD1 LEU 59 2HD1 LEU 59 -0.831 -4.261 5.814
437 3HD1 LEU 59 3HD1 LEU 59 -1.303 -4.955 7.373
438 1HD2 LEU 59 1HD2 LEU 59 0.565 -2.278 9.339
439 2HD2 LEU 59 2HD2 LEU 59 -1.004 -1.918 8.580
440 3HD2 LEU 59 3HD2 LEU 59 -0.790 -3.435 9.446
441 H ASP 60 H ASP 60 1.015 -7.445 10.047
442 HA ASP 60 HA ASP 60 3.485 -8.667 9.625
443 1HB ASP 60 2HB ASP 60 0.795 -10.057 9.927
444 2HB ASP 60 3HB ASP 60 2.392 -10.606 10.481
445 H GLU 61 H GLU 61 4.193 -10.241 8.033
446 HA GLU 61 HA GLU 61 4.012 -9.236 5.623
447 1HB GLU 61 2HB GLU 61 5.565 -11.157 6.712
448 2HB GLU 61 3HB GLU 61 4.571 -12.205 5.701
449 1HG GLU 61 2HG GLU 61 5.251 -10.043 4.030
450 2HG GLU 61 3HG GLU 61 6.709 -10.310 5.000
451 H GLU 62 H GLU 62 2.248 -12.292 6.381
452 HA GLU 62 HA GLU 62 0.973 -12.622 3.904
453 1HB GLU 62 2HB GLU 62 0.047 -13.346 6.719
454 2HB GLU 62 3HB GLU 62 -0.761 -13.870 5.239
455 1HG GLU 62 2HG GLU 62 1.325 -14.978 4.470
456 2HG GLU 62 3HG GLU 62 2.145 -14.488 5.961
457 H GLU 63 H GLU 63 0.225 -10.340 6.489
458 HA GLU 63 HA GLU 63 -2.448 -9.706 5.544
459 1HB GLU 63 2HB GLU 63 -1.260 -9.424 7.926
460 2HB GLU 63 3HB GLU 63 -0.774 -7.862 7.250
461 1HG GLU 63 2HG GLU 63 -3.191 -7.376 6.780
462 2HG GLU 63 3HG GLU 63 -3.614 -8.938 7.535
463 H LEU 64 H LEU 64 0.852 -8.395 5.287
464 HA LEU 64 HA LEU 64 0.396 -6.105 3.716
465 1HB LEU 64 2HB LEU 64 2.613 -7.248 4.754
466 2HB LEU 64 3HB LEU 64 2.770 -7.854 3.109
467 HG LEU 64 HG LEU 64 4.087 -5.951 3.243
468 1HD1 LEU 64 1HD1 LEU 64 2.677 -5.960 1.177
469 2HD1 LEU 64 2HD1 LEU 64 1.572 -4.814 1.984
470 3HD1 LEU 64 3HD1 LEU 64 3.249 -4.357 1.664
471 1HD2 LEU 64 1HD2 LEU 64 1.786 -4.411 4.490
472 2HD2 LEU 64 2HD2 LEU 64 3.257 -4.999 5.313
473 3HD2 LEU 64 3HD2 LEU 64 3.370 -3.749 4.062
474 H LYS 65 H LYS 65 0.577 -9.539 2.770
475 HA LYS 65 HA LYS 65 0.351 -9.360 -0.050
476 1HB LYS 65 2HB LYS 65 0.259 -11.381 1.714
477 2HB LYS 65 3HB LYS 65 -1.464 -11.306 1.280
478 1HG LYS 65 2HG LYS 65 -0.740 -11.350 -1.154
479 2HG LYS 65 3HG LYS 65 0.925 -11.571 -0.605
480 1HD LYS 65 2HD LYS 65 -1.426 -13.472 -0.334
481 2HD LYS 65 3HD LYS 65 0.122 -13.715 -1.172
482 1HE LYS 65 2HE LYS 65 1.234 -13.484 1.175
483 2HE LYS 65 3HE LYS 65 -0.407 -13.626 1.841
484 1HZ LYS 65 1HZ LYS 65 0.659 -15.714 1.824
485 2HZ LYS 65 2HZ LYS 65 -0.554 -15.771 0.716
486 3HZ LYS 65 3HZ LYS 65 1.017 -15.625 0.224
487 H PHE 66 H PHE 66 -2.410 -9.274 2.260
488 HA PHE 66 HA PHE 66 -4.264 -8.385 0.154
489 1HB PHE 66 2HB PHE 66 -4.419 -9.145 3.072
490 2HB PHE 66 3HB PHE 66 -5.602 -7.983 2.534
491 HD1 PHE 66 1HD PHE 66 -7.577 -8.476 1.478
492 HD2 PHE 66 2HD PHE 66 -4.411 -11.402 1.668
493 HE1 PHE 66 1HE PHE 66 -9.126 -10.201 0.647
494 HE2 PHE 66 2HE PHE 66 -5.979 -13.129 0.823
495 HZ PHE 66 HZ PHE 66 -8.333 -12.531 0.307
496 H PHE 67 H PHE 67 -2.382 -6.567 -0.124
497 HA PHE 67 HA PHE 67 -2.967 -4.200 1.570
498 1HB PHE 67 2HB PHE 67 -0.713 -4.551 1.089
499 2HB PHE 67 3HB PHE 67 -0.987 -4.795 -0.626
500 HD1 PHE 67 1HD PHE 67 0.940 -3.267 -0.916
501 HD2 PHE 67 2HD PHE 67 -2.647 -1.907 1.068
502 HE1 PHE 67 1HE PHE 67 1.715 -0.927 -1.086
503 HE2 PHE 67 2HE PHE 67 -1.883 0.426 0.838
504 HZ PHE 67 HZ PHE 67 0.281 0.931 -0.287
505 H LEU 68 H LEU 68 -2.876 -4.766 -1.979
506 HA LEU 68 HA LEU 68 -4.502 -2.465 -2.495
507 1HB LEU 68 2HB LEU 68 -3.767 -4.803 -4.300
508 2HB LEU 68 3HB LEU 68 -4.558 -3.289 -4.786
509 HG LEU 68 HG LEU 68 -2.481 -2.077 -3.856
510 1HD1 LEU 68 1HD1 LEU 68 -1.271 -3.843 -2.709
511 2HD1 LEU 68 2HD1 LEU 68 -1.362 -4.910 -4.130
512 3HD1 LEU 68 3HD1 LEU 68 -0.362 -3.446 -4.156
513 1HD2 LEU 68 1HD2 LEU 68 -1.325 -2.359 -6.011
514 2HD2 LEU 68 2HD2 LEU 68 -2.257 -3.835 -6.337
515 3HD2 LEU 68 3HD2 LEU 68 -3.074 -2.257 -6.254
516 H GLN 69 H GLN 69 -5.267 -5.818 -1.866
517 HA GLN 69 HA GLN 69 -7.856 -5.837 -3.105
518 1HB GLN 69 2HB GLN 69 -6.126 -7.753 -2.271
519 2HB GLN 69 3HB GLN 69 -7.194 -7.732 -0.880
520 1HG GLN 69 2HG GLN 69 -8.065 -9.385 -2.334
521 2HG GLN 69 3HG GLN 69 -9.142 -7.999 -2.548
522 1HE2 GLN 69 1HE2 GLN 69 -7.018 -10.233 -4.142
523 2HE2 GLN 69 2HE2 GLN 69 -6.962 -9.442 -5.701
524 H LYS 70 H LYS 70 -6.966 -4.062 -0.412
525 HA LYS 70 HA LYS 70 -9.593 -4.259 0.917
526 1HB LYS 70 2HB LYS 70 -7.229 -2.352 1.065
527 2HB LYS 70 3HB LYS 70 -8.829 -1.857 1.624
528 1HG LYS 70 2HG LYS 70 -7.790 -2.661 3.520
529 2HG LYS 70 3HG LYS 70 -8.965 -3.894 3.073
530 1HD LYS 70 2HD LYS 70 -7.005 -5.171 1.978
531 2HD LYS 70 3HD LYS 70 -5.938 -3.954 2.694
532 1HE LYS 70 2HE LYS 70 -7.252 -4.578 4.937
533 2HE LYS 70 3HE LYS 70 -7.732 -6.024 4.036
534 1HZ LYS 70 1HZ LYS 70 -5.173 -6.172 3.685
535 2HZ LYS 70 2HZ LYS 70 -5.104 -5.169 4.975
536 3HZ LYS 70 3HZ LYS 70 -5.809 -6.635 5.142
537 H PHE 71 H PHE 71 -8.122 -2.657 -1.879
538 HA PHE 71 HA PHE 71 -10.361 -0.752 -2.100
539 1HB PHE 71 2HB PHE 71 -8.098 -1.002 -4.072
540 2HB PHE 71 3HB PHE 71 -9.038 0.398 -3.590
541 HD1 PHE 71 1HD PHE 71 -5.887 -0.250 -3.793
542 HD2 PHE 71 2HD PHE 71 -8.700 0.171 -0.549
543 HE1 PHE 71 1HE PHE 71 -4.055 0.476 -2.293
544 HE2 PHE 71 2HE PHE 71 -6.874 0.869 0.946
545 HZ PHE 71 HZ PHE 71 -4.531 1.036 0.073
546 H GLU 72 H GLU 72 -8.689 -3.194 -4.107
547 HA GLU 72 HA GLU 72 -11.056 -3.332 -5.922
548 1HB GLU 72 2HB GLU 72 -8.333 -3.097 -6.485
549 2HB GLU 72 3HB GLU 72 -8.602 -4.846 -6.594
550 1HG GLU 72 2HG GLU 72 -8.880 -3.853 -8.773
551 2HG GLU 72 3HG GLU 72 -10.478 -4.379 -8.228
552 H SER 73 H SER 73 -11.383 -5.639 -6.803
553 HA SER 73 HA SER 73 -11.118 -7.671 -4.634
554 1HB SER 73 2HB SER 73 -12.973 -8.786 -5.992
555 2HB SER 73 3HB SER 73 -13.407 -7.233 -5.253
556 HG SER 73 HG SER 73 -12.702 -7.693 -7.968
557 H GLY 74 H GLY 74 -9.679 -6.765 -7.586
558 1HA GLY 74 1HA GLY 74 -8.497 -9.490 -7.901
559 2HA GLY 74 2HA GLY 74 -9.204 -8.671 -9.302
560 H ALA 75 H ALA 75 -7.408 -7.248 -6.565
561 HA ALA 75 HA ALA 75 -5.488 -5.983 -8.396
562 1HB ALA 75 1HB ALA 75 -5.716 -5.841 -5.368
563 2HB ALA 75 2HB ALA 75 -4.715 -4.815 -6.434
564 3HB ALA 75 3HB ALA 75 -6.457 -4.703 -6.517
565 H ARG 76 H ARG 76 -3.208 -5.887 -7.169
566 HA ARG 76 HA ARG 76 -2.149 -8.424 -8.014
567 1HB ARG 76 2HB ARG 76 -1.538 -5.931 -8.618
568 2HB ARG 76 3HB ARG 76 -0.610 -5.963 -7.120
569 1HG ARG 76 2HG ARG 76 0.840 -6.421 -8.899
570 2HG ARG 76 3HG ARG 76 0.672 -7.955 -8.063
571 1HD ARG 76 2HD ARG 76 -0.651 -8.904 -9.826
572 2HD ARG 76 3HD ARG 76 -1.147 -7.301 -10.405
573 HE ARG 76 HE ARG 76 1.710 -7.647 -10.488
574 1HH1 ARG 76 2HH2 ARG 76 -1.097 -8.274 -12.614
575 2HH1 ARG 76 1HH2 ARG 76 -0.311 -7.328 -13.896
576 1HH2 ARG 76 2HH1 ARG 76 2.486 -6.478 -12.025
577 2HH2 ARG 76 1HH1 ARG 76 1.707 -6.425 -13.612
578 H GLU 77 H GLU 77 -3.290 -8.330 -5.183
579 HA GLU 77 HA GLU 77 -1.266 -8.108 -3.230
580 1HB GLU 77 2HB GLU 77 -2.829 -9.915 -2.089
581 2HB GLU 77 3HB GLU 77 -3.351 -8.243 -2.293
582 1HG GLU 77 2HG GLU 77 -4.914 -8.669 -3.865
583 2HG GLU 77 3HG GLU 77 -4.263 -10.189 -4.405
584 H LEU 78 H LEU 78 -2.517 -11.009 -4.644
585 HA LEU 78 HA LEU 78 -0.923 -12.965 -3.737
586 1HB LEU 78 2HB LEU 78 -1.767 -12.931 -6.659
587 2HB LEU 78 3HB LEU 78 -1.424 -14.317 -5.635
588 HG LEU 78 HG LEU 78 -3.660 -14.443 -5.636
589 1HD1 LEU 78 1HD1 LEU 78 -3.038 -14.176 -3.273
590 2HD1 LEU 78 2HD1 LEU 78 -3.445 -12.449 -3.350
591 3HD1 LEU 78 3HD1 LEU 78 -4.696 -13.661 -3.619
592 1HD2 LEU 78 1HD2 LEU 78 -4.278 -12.791 -7.114
593 2HD2 LEU 78 2HD2 LEU 78 -5.202 -12.395 -5.655
594 3HD2 LEU 78 3HD2 LEU 78 -3.750 -11.464 -6.089
595 H THR 79 H THR 79 0.154 -10.662 -6.328
596 HA THR 79 HA THR 79 2.447 -12.345 -6.911
597 HB THR 79 HB THR 79 2.326 -9.394 -7.415
598 HG1 THR 79 1HG THR 79 2.028 -10.344 -9.551
599 1HG2 THR 79 1HG2 THR 79 4.063 -10.110 -9.170
600 2HG2 THR 79 2HG2 THR 79 4.583 -10.574 -7.553
601 3HG2 THR 79 3HG2 THR 79 3.873 -11.772 -8.633
602 H GLU 80 H GLU 80 3.548 -12.785 -5.294
603 HA GLU 80 HA GLU 80 3.998 -11.198 -2.962
604 1HB GLU 80 2HB GLU 80 4.071 -13.503 -2.823
605 2HB GLU 80 3HB GLU 80 5.457 -13.656 -3.942
606 1HG GLU 80 2HG GLU 80 6.873 -12.479 -2.241
607 2HG GLU 80 3HG GLU 80 5.469 -12.395 -1.159
608 H SER 81 H SER 81 6.108 -11.592 -5.931
609 HA SER 81 HA SER 81 8.171 -9.915 -5.188
610 1HB SER 81 2HB SER 81 6.726 -9.788 -7.863
611 2HB SER 81 3HB SER 81 8.388 -9.311 -7.516
612 HG SER 81 HG SER 81 8.357 -11.281 -8.442
613 H GLU 82 H GLU 82 4.958 -8.846 -6.481
614 HA GLU 82 HA GLU 82 5.731 -6.081 -6.569
615 1HB GLU 82 2HB GLU 82 2.953 -7.302 -6.633
616 2HB GLU 82 3HB GLU 82 3.400 -5.695 -7.174
617 1HG GLU 82 2HG GLU 82 5.093 -7.714 -8.521
618 2HG GLU 82 3HG GLU 82 3.383 -8.089 -8.691
619 H THR 83 H THR 83 3.746 -8.074 -4.355
620 HA THR 83 HA THR 83 3.046 -6.046 -2.513
621 HB THR 83 HB THR 83 2.883 -8.952 -2.678
622 HG1 THR 83 1HG THR 83 1.489 -7.852 -0.735
623 1HG2 THR 83 1HG2 THR 83 4.486 -9.195 -0.843
624 2HG2 THR 83 2HG2 THR 83 3.624 -7.960 0.108
625 3HG2 THR 83 3HG2 THR 83 2.854 -9.505 -0.281
626 H LYS 84 H LYS 84 5.830 -8.208 -2.701
627 HA LYS 84 HA LYS 84 6.993 -7.359 -0.268
628 1HB LYS 84 2HB LYS 84 7.196 -9.607 -1.215
629 2HB LYS 84 3HB LYS 84 8.233 -9.001 -2.527
630 1HG LYS 84 2HG LYS 84 8.886 -8.482 0.363
631 2HG LYS 84 3HG LYS 84 9.176 -10.091 -0.297
632 1HD LYS 84 2HD LYS 84 10.875 -9.426 -1.702
633 2HD LYS 84 3HD LYS 84 10.263 -7.784 -1.899
634 1HE LYS 84 2HE LYS 84 10.884 -7.257 0.470
635 2HE LYS 84 3HE LYS 84 11.593 -8.874 0.626
636 1HZ LYS 84 1HZ LYS 84 13.219 -7.180 0.112
637 2HZ LYS 84 2HZ LYS 84 13.142 -8.281 -1.111
638 3HZ LYS 84 3HZ LYS 84 12.445 -6.798 -1.287
639 H SER 85 H SER 85 7.425 -6.337 -3.649
640 HA SER 85 HA SER 85 9.715 -4.702 -3.329
641 1HB SER 85 2HB SER 85 8.559 -5.204 -5.514
642 2HB SER 85 3HB SER 85 7.248 -4.111 -5.033
643 HG SER 85 HG SER 85 8.632 -2.871 -6.153
644 H LEU 86 H LEU 86 6.205 -3.974 -2.855
645 HA LEU 86 HA LEU 86 6.698 -1.363 -1.788
646 1HB LEU 86 2HB LEU 86 4.357 -3.261 -1.832
647 2HB LEU 86 3HB LEU 86 4.327 -1.963 -0.641
648 HG LEU 86 HG LEU 86 3.209 -1.464 -2.831
649 1HD1 LEU 86 1HD1 LEU 86 5.409 0.347 -1.733
650 2HD1 LEU 86 2HD1 LEU 86 4.267 0.881 -2.960
651 3HD1 LEU 86 3HD1 LEU 86 3.680 0.350 -1.375
652 1HD2 LEU 86 1HD2 LEU 86 4.476 -0.823 -4.766
653 2HD2 LEU 86 2HD2 LEU 86 6.017 -1.167 -3.970
654 3HD2 LEU 86 3HD2 LEU 86 4.885 -2.491 -4.329
655 H MET 87 H MET 87 6.094 -4.488 -0.066
656 HA MET 87 HA MET 87 6.546 -3.570 2.491
657 1HB MET 87 2HB MET 87 6.006 -5.972 1.726
658 2HB MET 87 3HB MET 87 7.757 -6.183 1.550
659 1HG MET 87 2HG MET 87 7.973 -5.403 3.997
660 2HG MET 87 3HG MET 87 6.213 -5.435 4.050
661 1HE MET 87 1HE MET 87 8.867 -7.994 2.550
662 2HE MET 87 2HE MET 87 9.493 -7.473 4.131
663 3HE MET 87 3HE MET 87 8.913 -9.142 3.905
664 H ALA 88 H ALA 88 9.033 -4.394 0.076
665 HA ALA 88 HA ALA 88 11.287 -4.523 1.682
666 1HB ALA 88 1HB ALA 88 12.580 -4.139 -0.360
667 2HB ALA 88 2HB ALA 88 11.188 -5.163 -0.755
668 3HB ALA 88 3HB ALA 88 11.172 -3.453 -1.179
669 H ALA 89 H ALA 89 9.879 -1.671 0.075
670 HA ALA 89 HA ALA 89 11.971 0.094 1.216
671 1HB ALA 89 1HB ALA 89 10.839 1.831 -0.110
672 2HB ALA 89 2HB ALA 89 11.287 0.411 -1.083
673 3HB ALA 89 3HB ALA 89 9.599 0.639 -0.564
674 H ALA 90 H ALA 90 8.414 -0.473 1.520
675 HA ALA 90 HA ALA 90 7.842 1.666 3.316
676 1HB ALA 90 1HB ALA 90 5.947 0.217 4.026
677 2HB ALA 90 2HB ALA 90 6.074 0.342 2.252
678 3HB ALA 90 3HB ALA 90 6.647 -1.118 3.093
679 H ASP 91 H ASP 91 9.084 -1.651 3.895
680 HA ASP 91 HA ASP 91 9.108 -1.265 6.740
681 1HB ASP 91 2HB ASP 91 8.937 -3.534 5.670
682 2HB ASP 91 3HB ASP 91 10.626 -3.376 5.150
683 H ASN 92 H ASN 92 10.528 0.239 7.558
684 HA ASN 92 HA ASN 92 13.109 0.714 6.083
685 1HB ASN 92 2HB ASN 92 13.212 2.911 6.936
686 2HB ASN 92 3HB ASN 92 11.701 2.645 6.063
687 1HD2 ASN 92 1HD2 ASN 92 10.380 4.184 7.028
688 2HD2 ASN 92 2HD2 ASN 92 10.057 4.231 8.751
689 H ASP 93 H ASP 93 12.054 -1.136 8.512
690 HA ASP 93 HA ASP 93 14.347 -0.783 10.345
691 1HB ASP 93 2HB ASP 93 12.292 -3.025 10.018
692 2HB ASP 93 3HB ASP 93 13.591 -3.005 11.203
693 H GLY 94 H GLY 94 13.136 -3.068 7.870
694 1HA GLY 94 1HA GLY 94 14.410 -4.532 6.489
695 2HA GLY 94 2HA GLY 94 15.825 -4.303 7.531
696 H ASP 95 H ASP 95 12.378 -4.883 8.318
697 HA ASP 95 HA ASP 95 13.082 -7.519 9.541
698 1HB ASP 95 2HB ASP 95 12.140 -7.137 11.531
699 2HB ASP 95 3HB ASP 95 12.720 -5.503 11.220
700 H GLY 96 H GLY 96 10.341 -5.444 8.455
701 1HA GLY 96 1HA GLY 96 9.369 -6.297 6.326
702 2HA GLY 96 2HA GLY 96 9.129 -7.859 7.121
703 H LYS 97 H LYS 97 8.320 -6.995 9.687
704 HA LYS 97 HA LYS 97 5.546 -6.401 9.318
705 1HB LYS 97 2HB LYS 97 7.348 -6.156 11.733
706 2HB LYS 97 3HB LYS 97 5.595 -6.041 11.785
707 1HG LYS 97 2HG LYS 97 5.290 -8.265 11.748
708 2HG LYS 97 3HG LYS 97 6.379 -8.492 10.387
709 1HD LYS 97 2HD LYS 97 7.059 -9.737 12.408
710 2HD LYS 97 3HD LYS 97 8.313 -8.658 11.799
711 1HE LYS 97 2HE LYS 97 6.522 -7.407 13.837
712 2HE LYS 97 3HE LYS 97 7.402 -8.809 14.449
713 1HZ LYS 97 1HZ LYS 97 8.814 -6.674 13.003
714 2HZ LYS 97 2HZ LYS 97 8.565 -6.599 14.640
715 3HZ LYS 97 3HZ LYS 97 9.439 -7.812 13.941
716 H ILE 98 H ILE 98 4.809 -4.532 8.590
717 HA ILE 98 HA ILE 98 6.215 -1.960 9.109
718 HB ILE 98 HB ILE 98 4.246 -2.985 7.082
719 1HG1 ILE 98 2HG1 ILE 98 6.669 -1.275 6.533
720 2HG1 ILE 98 3HG1 ILE 98 6.933 -2.943 7.056
721 1HG2 ILE 98 1HG2 ILE 98 4.063 -0.708 6.120
722 2HG2 ILE 98 2HG2 ILE 98 3.247 -0.850 7.677
723 3HG2 ILE 98 3HG2 ILE 98 4.827 -0.039 7.570
724 1HD1 ILE 98 1HD1 ILE 98 6.860 -2.871 4.651
725 2HD1 ILE 98 2HD1 ILE 98 5.492 -3.794 5.299
726 3HD1 ILE 98 3HD1 ILE 98 5.228 -2.153 4.673
727 H GLY 99 H GLY 99 5.019 -0.168 9.857
728 1HA GLY 99 1HA GLY 99 2.488 -0.714 11.346
729 2HA GLY 99 2HA GLY 99 3.835 0.178 12.084
730 H ALA 100 H ALA 100 1.683 1.672 12.028
731 HA ALA 100 HA ALA 100 0.893 2.870 9.568
732 1HB ALA 100 1HB ALA 100 -0.178 4.531 10.941
733 2HB ALA 100 2HB ALA 100 -0.443 2.934 11.673
734 3HB ALA 100 3HB ALA 100 0.765 4.036 12.370
735 H GLU 101 H GLU 101 3.157 3.908 12.122
736 HA GLU 101 HA GLU 101 3.996 6.234 10.857
737 1HB GLU 101 2HB GLU 101 4.930 4.544 13.113
738 2HB GLU 101 3HB GLU 101 6.264 5.292 12.252
739 1HG GLU 101 2HG GLU 101 5.919 7.197 13.308
740 2HG GLU 101 3HG GLU 101 4.329 7.384 12.599
741 H GLU 102 H GLU 102 5.955 3.200 10.870
742 HA GLU 102 HA GLU 102 7.685 3.664 8.870
743 1HB GLU 102 2HB GLU 102 6.401 1.251 9.934
744 2HB GLU 102 3HB GLU 102 6.765 1.067 8.208
745 1HG GLU 102 2HG GLU 102 9.079 1.718 8.595
746 2HG GLU 102 3HG GLU 102 8.779 1.861 10.339
747 H PHE 103 H PHE 103 4.278 2.691 8.226
748 HA PHE 103 HA PHE 103 4.573 2.672 5.379
749 1HB PHE 103 2HB PHE 103 2.753 1.572 6.669
750 2HB PHE 103 3HB PHE 103 2.084 3.146 7.063
751 HD1 PHE 103 1HD PHE 103 3.031 0.939 4.169
752 HD2 PHE 103 2HD PHE 103 0.527 4.168 5.552
753 HE1 PHE 103 1HE PHE 103 1.752 0.857 2.049
754 HE2 PHE 103 2HE PHE 103 -0.782 4.044 3.447
755 HZ PHE 103 HZ PHE 103 -0.146 2.431 1.678
756 H GLN 104 H GLN 104 3.262 5.208 7.593
757 HA GLN 104 HA GLN 104 2.709 7.113 5.536
758 1HB GLN 104 2HB GLN 104 1.591 7.360 7.589
759 2HB GLN 104 3HB GLN 104 3.108 7.424 8.501
760 1HG GLN 104 2HG GLN 104 2.059 9.628 8.246
761 2HG GLN 104 3HG GLN 104 3.694 9.574 7.541
762 1HE2 GLN 104 1HE2 GLN 104 2.850 11.681 6.588
763 2HE2 GLN 104 2HE2 GLN 104 1.952 11.524 5.080
764 H GLU 105 H GLU 105 5.636 6.777 7.726
765 HA GLU 105 HA GLU 105 7.156 8.867 6.811
766 1HB GLU 105 2HB GLU 105 7.892 6.019 7.579
767 2HB GLU 105 3HB GLU 105 9.119 7.079 6.885
768 1HG GLU 105 2HG GLU 105 9.369 7.331 9.191
769 2HG GLU 105 3HG GLU 105 8.576 8.813 8.653
770 H MET 106 H MET 106 7.039 5.625 5.221
771 HA MET 106 HA MET 106 8.693 6.557 3.080
772 1HB MET 106 2HB MET 106 7.694 4.049 3.922
773 2HB MET 106 3HB MET 106 7.003 4.284 2.314
774 1HG MET 106 2HG MET 106 9.182 3.227 2.082
775 2HG MET 106 3HG MET 106 9.328 4.888 1.506
776 1HE MET 106 1HE MET 106 11.897 5.006 1.576
777 2HE MET 106 2HE MET 106 12.875 4.380 2.923
778 3HE MET 106 3HE MET 106 11.875 3.266 1.962
779 H VAL 107 H VAL 107 5.145 6.181 3.330
780 HA VAL 107 HA VAL 107 4.500 7.098 0.725
781 HB VAL 107 HB VAL 107 3.032 7.155 3.364
782 1HG1 VAL 107 1HG1 VAL 107 0.967 7.588 2.018
783 2HG1 VAL 107 2HG1 VAL 107 2.042 8.978 2.132
784 3HG1 VAL 107 3HG1 VAL 107 2.018 8.002 0.642
785 1HG2 VAL 107 1HG2 VAL 107 2.621 5.519 0.822
786 2HG2 VAL 107 2HG2 VAL 107 3.479 4.928 2.254
787 3HG2 VAL 107 3HG2 VAL 107 1.758 5.324 2.359
788 H HIS 108 H HIS 108 5.403 8.929 3.593
789 HA HIS 108 HA HIS 108 4.399 11.457 2.744
790 1HB HIS 108 2HB HIS 108 4.708 10.807 5.094
791 2HB HIS 108 3HB HIS 108 6.443 10.652 4.852
792 HD1 HIS 108 1HD HIS 108 4.097 13.641 4.010
793 HD2 HIS 108 2HD HIS 108 7.513 12.556 6.215
794 HE1 HIS 108 1HE HIS 108 4.926 15.762 5.175
795 H SER 109 H SER 109 7.264 9.622 2.099
796 HA SER 109 HA SER 109 9.132 11.731 1.735
797 1HB SER 109 2HB SER 109 9.715 9.308 2.097
798 2HB SER 109 3HB SER 109 9.136 8.985 0.442
799 HG SER 109 HG SER 109 10.618 10.769 -0.143
Start of MODEL 11
1 1H MET 1 H1 MET 1 -16.608 4.409 0.277
2 2H MET 1 H2 MET 1 -18.176 3.970 0.493
3 3H MET 1 H3 MET 1 -17.562 5.259 1.300
4 HA MET 1 HA MET 1 -17.841 3.459 2.753
5 1HB MET 1 2HB MET 1 -16.929 1.364 2.549
6 2HB MET 1 3HB MET 1 -17.471 1.706 0.908
7 1HG MET 1 2HG MET 1 -15.075 2.225 0.304
8 2HG MET 1 3HG MET 1 -14.614 1.787 1.972
9 1HE MET 1 1HE MET 1 -13.044 -1.099 0.131
10 2HE MET 1 2HE MET 1 -13.204 0.499 -0.617
11 3HE MET 1 3HE MET 1 -12.784 0.362 1.107
12 H SER 2 H SER 2 -14.605 4.032 1.279
13 HA SER 2 HA SER 2 -13.907 5.803 3.410
14 1HB SER 2 2HB SER 2 -12.495 3.083 3.249
15 2HB SER 2 3HB SER 2 -11.807 4.511 4.047
16 HG SER 2 HG SER 2 -14.378 3.955 4.832
17 H ILE 3 H ILE 3 -11.587 3.834 1.536
18 HA ILE 3 HA ILE 3 -10.533 6.270 0.454
19 HB ILE 3 HB ILE 3 -8.720 5.014 -0.245
20 1HG1 ILE 3 2HG1 ILE 3 -9.004 2.345 -0.011
21 2HG1 ILE 3 3HG1 ILE 3 -10.626 2.700 -0.560
22 1HG2 ILE 3 1HG2 ILE 3 -8.064 3.809 1.685
23 2HG2 ILE 3 2HG2 ILE 3 -9.199 5.053 2.249
24 3HG2 ILE 3 3HG2 ILE 3 -9.714 3.362 2.118
25 1HD1 ILE 3 1HD1 ILE 3 -9.144 2.213 -2.463
26 2HD1 ILE 3 2HD1 ILE 3 -9.562 3.931 -2.548
27 3HD1 ILE 3 3HD1 ILE 3 -7.980 3.431 -1.919
28 H THR 4 H THR 4 -12.584 3.702 -0.838
29 HA THR 4 HA THR 4 -12.193 4.129 -3.531
30 HB THR 4 HB THR 4 -13.481 2.300 -2.084
31 HG1 THR 4 1HG THR 4 -12.888 2.370 -4.251
32 1HG2 THR 4 1HG2 THR 4 -15.413 3.827 -1.471
33 2HG2 THR 4 2HG2 THR 4 -15.862 3.838 -3.192
34 3HG2 THR 4 3HG2 THR 4 -15.869 2.315 -2.291
35 H ASP 5 H ASP 5 -14.015 6.036 -1.256
36 HA ASP 5 HA ASP 5 -15.120 7.709 -3.457
37 1HB ASP 5 2HB ASP 5 -16.850 6.279 -2.359
38 2HB ASP 5 3HB ASP 5 -16.426 7.012 -0.791
39 H VAL 6 H VAL 6 -12.680 8.210 -2.728
40 HA VAL 6 HA VAL 6 -12.994 10.719 -1.165
41 HB VAL 6 HB VAL 6 -11.922 8.698 0.150
42 1HG1 VAL 6 1HG1 VAL 6 -10.023 8.274 -1.475
43 2HG1 VAL 6 2HG1 VAL 6 -9.376 9.864 -1.024
44 3HG1 VAL 6 3HG1 VAL 6 -9.552 8.591 0.191
45 1HG2 VAL 6 1HG2 VAL 6 -10.797 11.516 0.221
46 2HG2 VAL 6 2HG2 VAL 6 -12.264 10.937 1.044
47 3HG2 VAL 6 3HG2 VAL 6 -10.680 10.310 1.522
48 H LEU 7 H LEU 7 -10.783 8.914 -3.266
49 HA LEU 7 HA LEU 7 -10.407 10.930 -5.218
50 1HB LEU 7 2HB LEU 7 -9.260 12.251 -3.511
51 2HB LEU 7 3HB LEU 7 -8.372 10.847 -2.950
52 HG LEU 7 HG LEU 7 -7.683 11.079 -5.705
53 1HD1 LEU 7 1HD1 LEU 7 -6.905 13.368 -5.928
54 2HD1 LEU 7 2HD1 LEU 7 -8.667 13.326 -5.729
55 3HD1 LEU 7 3HD1 LEU 7 -7.631 13.802 -4.363
56 1HD2 LEU 7 1HD2 LEU 7 -5.479 11.557 -4.830
57 2HD2 LEU 7 2HD2 LEU 7 -6.152 12.054 -3.259
58 3HD2 LEU 7 3HD2 LEU 7 -6.254 10.359 -3.787
59 H SER 8 H SER 8 -8.385 8.712 -3.281
60 HA SER 8 HA SER 8 -6.800 7.748 -5.165
61 1HB SER 8 2HB SER 8 -7.799 6.366 -2.682
62 2HB SER 8 3HB SER 8 -6.561 5.648 -3.729
63 HG SER 8 HG SER 8 -5.224 7.356 -3.417
64 H ALA 9 H ALA 9 -10.150 6.845 -5.261
65 HA ALA 9 HA ALA 9 -10.007 4.367 -6.640
66 1HB ALA 9 1HB ALA 9 -12.096 5.187 -7.753
67 2HB ALA 9 2HB ALA 9 -12.109 5.311 -5.985
68 3HB ALA 9 3HB ALA 9 -11.839 6.767 -6.976
69 H ASP 10 H ASP 10 -9.553 7.752 -7.813
70 HA ASP 10 HA ASP 10 -9.256 6.974 -10.595
71 1HB ASP 10 2HB ASP 10 -9.907 9.255 -9.837
72 2HB ASP 10 3HB ASP 10 -8.293 9.471 -9.130
73 H ASP 11 H ASP 11 -7.082 7.560 -7.856
74 HA ASP 11 HA ASP 11 -4.665 7.518 -9.357
75 1HB ASP 11 2HB ASP 11 -5.089 7.046 -6.389
76 2HB ASP 11 3HB ASP 11 -3.600 7.530 -7.200
77 H ILE 12 H ILE 12 -6.440 4.947 -7.488
78 HA ILE 12 HA ILE 12 -4.501 2.954 -7.986
79 HB ILE 12 HB ILE 12 -6.127 1.384 -7.453
80 1HG1 ILE 12 2HG1 ILE 12 -8.163 3.527 -7.236
81 2HG1 ILE 12 3HG1 ILE 12 -8.155 2.223 -8.421
82 1HG2 ILE 12 1HG2 ILE 12 -6.396 1.934 -5.100
83 2HG2 ILE 12 2HG2 ILE 12 -4.835 2.499 -5.694
84 3HG2 ILE 12 3HG2 ILE 12 -6.154 3.652 -5.443
85 1HD1 ILE 12 1HD1 ILE 12 -9.753 1.653 -6.754
86 2HD1 ILE 12 2HD1 ILE 12 -8.357 0.583 -6.519
87 3HD1 ILE 12 3HD1 ILE 12 -8.626 1.974 -5.432
88 H ALA 13 H ALA 13 -7.367 4.082 -9.854
89 HA ALA 13 HA ALA 13 -7.231 2.102 -11.871
90 1HB ALA 13 1HB ALA 13 -8.408 3.634 -13.303
91 2HB ALA 13 2HB ALA 13 -9.059 3.781 -11.659
92 3HB ALA 13 3HB ALA 13 -7.969 5.024 -12.307
93 H ALA 14 H ALA 14 -5.455 5.230 -11.604
94 HA ALA 14 HA ALA 14 -3.783 4.875 -13.898
95 1HB ALA 14 1HB ALA 14 -2.994 6.193 -11.277
96 2HB ALA 14 2HB ALA 14 -2.255 6.411 -12.866
97 3HB ALA 14 3HB ALA 14 -3.917 6.971 -12.578
98 H ALA 15 H ALA 15 -3.101 3.921 -10.490
99 HA ALA 15 HA ALA 15 -0.606 2.764 -10.840
100 1HB ALA 15 1HB ALA 15 -1.066 1.455 -8.854
101 2HB ALA 15 2HB ALA 15 -1.775 3.074 -8.633
102 3HB ALA 15 3HB ALA 15 -2.806 1.686 -9.024
103 H LEU 16 H LEU 16 -3.762 1.245 -11.184
104 HA LEU 16 HA LEU 16 -3.041 -1.389 -11.598
105 1HB LEU 16 2HB LEU 16 -5.320 -0.411 -11.214
106 2HB LEU 16 3HB LEU 16 -5.362 0.115 -12.892
107 HG LEU 16 HG LEU 16 -6.721 -1.830 -12.425
108 1HD1 LEU 16 1HD1 LEU 16 -4.511 -2.842 -14.223
109 2HD1 LEU 16 2HD1 LEU 16 -6.246 -3.148 -14.295
110 3HD1 LEU 16 3HD1 LEU 16 -5.626 -1.536 -14.699
111 1HD2 LEU 16 1HD2 LEU 16 -5.847 -4.010 -11.850
112 2HD2 LEU 16 2HD2 LEU 16 -4.187 -3.390 -11.801
113 3HD2 LEU 16 3HD2 LEU 16 -5.386 -2.836 -10.608
114 H GLN 17 H GLN 17 -3.107 1.336 -13.934
115 HA GLN 17 HA GLN 17 -2.532 -0.542 -16.148
116 1HB GLN 17 2HB GLN 17 -4.199 1.318 -16.361
117 2HB GLN 17 3HB GLN 17 -2.837 2.456 -16.375
118 1HG GLN 17 2HG GLN 17 -1.857 1.214 -18.309
119 2HG GLN 17 3HG GLN 17 -3.209 0.070 -18.263
120 1HE2 GLN 17 1HE2 GLN 17 -2.222 2.116 -20.356
121 2HE2 GLN 17 2HE2 GLN 17 -3.706 2.962 -20.762
122 H GLU 18 H GLU 18 -1.058 2.278 -14.535
123 HA GLU 18 HA GLU 18 1.355 2.540 -15.902
124 1HB GLU 18 2HB GLU 18 0.665 4.152 -14.300
125 2HB GLU 18 3HB GLU 18 0.523 2.951 -13.012
126 1HG GLU 18 2HG GLU 18 2.407 4.452 -12.702
127 2HG GLU 18 3HG GLU 18 2.906 2.759 -12.798
128 H CYS 19 H CYS 19 0.624 0.405 -13.105
129 HA CYS 19 HA CYS 19 3.109 -1.184 -13.692
130 1HB CYS 19 2HB CYS 19 1.482 -0.875 -11.128
131 2HB CYS 19 3HB CYS 19 2.881 -1.943 -11.349
132 HG CYS 19 HG CYS 19 4.579 -0.101 -11.957
133 H ARG 20 H ARG 20 1.134 -1.763 -15.506
134 HA ARG 20 HA ARG 20 -0.747 -3.756 -14.392
135 1HB ARG 20 2HB ARG 20 -1.167 -2.270 -16.391
136 2HB ARG 20 3HB ARG 20 0.011 -3.225 -17.298
137 1HG ARG 20 2HG ARG 20 -1.429 -5.255 -16.863
138 2HG ARG 20 3HG ARG 20 -2.583 -4.199 -16.007
139 1HD ARG 20 2HD ARG 20 -2.836 -2.823 -18.039
140 2HD ARG 20 3HD ARG 20 -1.667 -3.873 -18.887
141 HE ARG 20 HE ARG 20 -3.866 -5.392 -17.803
142 1HH1 ARG 20 2HH2 ARG 20 -3.050 -3.226 -20.456
143 2HH1 ARG 20 1HH2 ARG 20 -4.180 -3.897 -21.591
144 1HH2 ARG 20 2HH1 ARG 20 -5.390 -6.332 -19.281
145 2HH2 ARG 20 1HH1 ARG 20 -5.553 -5.710 -20.890
146 H ASP 21 H ASP 21 2.040 -3.819 -16.630
147 HA ASP 21 HA ASP 21 2.315 -6.493 -16.956
148 1HB ASP 21 2HB ASP 21 4.269 -4.166 -16.930
149 2HB ASP 21 3HB ASP 21 4.826 -5.795 -17.275
150 HA PRO 22 HA PRO 22 3.334 -8.236 -13.075
151 1HB PRO 22 2HB PRO 22 4.922 -10.376 -13.738
152 2HB PRO 22 3HB PRO 22 3.157 -10.301 -14.004
153 1HG PRO 22 2HG PRO 22 5.348 -9.672 -15.997
154 2HG PRO 22 3HG PRO 22 3.921 -10.728 -16.238
155 1HD PRO 22 2HD PRO 22 3.926 -8.168 -17.098
156 2HD PRO 22 3HD PRO 22 2.454 -8.839 -16.332
157 H ASP 23 H ASP 23 5.000 -8.353 -11.509
158 HA ASP 23 HA ASP 23 6.738 -7.820 -10.402
159 1HB ASP 23 2HB ASP 23 7.893 -9.224 -12.150
160 2HB ASP 23 3HB ASP 23 8.418 -7.720 -12.931
161 H THR 24 H THR 24 5.905 -5.582 -12.965
162 HA THR 24 HA THR 24 7.852 -3.650 -12.624
163 HB THR 24 HB THR 24 5.055 -3.142 -13.716
164 HG1 THR 24 1HG THR 24 5.367 -4.917 -14.756
165 1HG2 THR 24 1HG2 THR 24 6.556 -1.223 -14.037
166 2HG2 THR 24 2HG2 THR 24 7.827 -2.294 -14.668
167 3HG2 THR 24 3HG2 THR 24 6.322 -2.053 -15.574
168 H PHE 25 H PHE 25 6.508 -4.147 -9.937
169 HA PHE 25 HA PHE 25 4.812 -1.774 -9.767
170 1HB PHE 25 2HB PHE 25 3.969 -4.114 -9.350
171 2HB PHE 25 3HB PHE 25 4.659 -3.966 -7.732
172 HD1 PHE 25 1HD PHE 25 3.616 -0.663 -8.380
173 HD2 PHE 25 2HD PHE 25 1.943 -4.597 -7.789
174 HE1 PHE 25 1HE PHE 25 1.366 0.285 -8.348
175 HE2 PHE 25 2HE PHE 25 -0.300 -3.579 -7.490
176 HZ PHE 25 HZ PHE 25 -0.598 -1.133 -7.787
177 H GLU 26 H GLU 26 6.582 -0.284 -9.382
178 HA GLU 26 HA GLU 26 8.514 -0.698 -7.308
179 1HB GLU 26 2HB GLU 26 7.852 1.463 -9.278
180 2HB GLU 26 3HB GLU 26 8.599 2.006 -7.773
181 1HG GLU 26 2HG GLU 26 10.453 0.360 -8.145
182 2HG GLU 26 3HG GLU 26 9.769 0.042 -9.753
183 HA PRO 27 HA PRO 27 6.111 0.761 -3.951
184 1HB PRO 27 2HB PRO 27 8.059 1.781 -2.217
185 2HB PRO 27 3HB PRO 27 7.707 0.058 -2.403
186 1HG PRO 27 2HG PRO 27 9.946 1.614 -3.675
187 2HG PRO 27 3HG PRO 27 9.961 -0.051 -3.046
188 1HD PRO 27 2HD PRO 27 9.747 0.528 -5.716
189 2HD PRO 27 3HD PRO 27 8.984 -0.911 -4.977
190 H GLN 28 H GLN 28 8.837 3.155 -4.295
191 HA GLN 28 HA GLN 28 7.432 5.320 -3.496
192 1HB GLN 28 2HB GLN 28 10.035 4.807 -4.443
193 2HB GLN 28 3HB GLN 28 9.384 5.937 -5.636
194 1HG GLN 28 2HG GLN 28 8.556 7.257 -3.576
195 2HG GLN 28 3HG GLN 28 9.655 6.262 -2.621
196 1HE2 GLN 28 1HE2 GLN 28 11.430 7.591 -2.128
197 2HE2 GLN 28 2HE2 GLN 28 12.225 8.615 -3.308
198 H LYS 29 H LYS 29 7.705 4.006 -6.797
199 HA LYS 29 HA LYS 29 6.217 6.018 -8.122
200 1HB LYS 29 2HB LYS 29 7.542 4.293 -9.285
201 2HB LYS 29 3HB LYS 29 6.368 3.055 -8.793
202 1HG LYS 29 2HG LYS 29 4.853 3.667 -10.384
203 2HG LYS 29 3HG LYS 29 5.063 5.384 -10.055
204 1HD LYS 29 2HD LYS 29 5.672 5.020 -12.282
205 2HD LYS 29 3HD LYS 29 7.145 5.434 -11.392
206 1HE LYS 29 2HE LYS 29 8.008 3.225 -11.542
207 2HE LYS 29 3HE LYS 29 6.404 2.513 -11.805
208 1HZ LYS 29 1HZ LYS 29 7.799 4.178 -13.776
209 2HZ LYS 29 2HZ LYS 29 7.650 2.534 -13.821
210 3HZ LYS 29 3HZ LYS 29 6.310 3.488 -13.936
211 H PHE 30 H PHE 30 5.049 2.792 -6.846
212 HA PHE 30 HA PHE 30 2.389 3.243 -7.487
213 1HB PHE 30 2HB PHE 30 3.209 1.057 -6.764
214 2HB PHE 30 3HB PHE 30 3.523 1.677 -5.152
215 HD1 PHE 30 1HD PHE 30 2.116 0.171 -3.899
216 HD2 PHE 30 2HD PHE 30 0.419 2.296 -7.235
217 HE1 PHE 30 1HE PHE 30 -0.146 -0.290 -3.041
218 HE2 PHE 30 2HE PHE 30 -1.842 1.695 -6.449
219 HZ PHE 30 HZ PHE 30 -2.132 0.584 -4.263
220 H PHE 31 H PHE 31 4.085 3.938 -4.481
221 HA PHE 31 HA PHE 31 2.227 5.048 -2.787
222 1HB PHE 31 2HB PHE 31 4.376 4.797 -1.951
223 2HB PHE 31 3HB PHE 31 5.132 5.449 -3.387
224 HD1 PHE 31 1HD PHE 31 2.612 6.822 -1.000
225 HD2 PHE 31 2HD PHE 31 6.357 7.400 -3.047
226 HE1 PHE 31 1HE PHE 31 2.775 9.078 -0.116
227 HE2 PHE 31 2HE PHE 31 6.676 9.560 -1.858
228 HZ PHE 31 HZ PHE 31 4.908 10.389 -0.324
229 H GLN 32 H GLN 32 4.029 6.896 -5.354
230 HA GLN 32 HA GLN 32 2.533 9.295 -4.773
231 1HB GLN 32 2HB GLN 32 4.789 9.372 -5.718
232 2HB GLN 32 3HB GLN 32 4.233 8.568 -7.198
233 1HG GLN 32 2HG GLN 32 2.752 10.450 -7.724
234 2HG GLN 32 3HG GLN 32 3.119 11.228 -6.179
235 1HE2 GLN 32 1HE2 GLN 32 5.549 11.729 -5.808
236 2HE2 GLN 32 2HE2 GLN 32 6.396 12.327 -7.223
237 H THR 33 H THR 33 2.415 6.775 -7.352
238 HA THR 33 HA THR 33 0.453 8.065 -8.844
239 HB THR 33 HB THR 33 2.243 6.035 -9.267
240 HG1 THR 33 1HG THR 33 -0.086 6.731 -10.577
241 1HG2 THR 33 1HG2 THR 33 1.156 3.987 -9.775
242 2HG2 THR 33 2HG2 THR 33 0.609 4.381 -8.130
243 3HG2 THR 33 3HG2 THR 33 -0.454 4.690 -9.512
244 H SER 34 H SER 34 0.140 6.103 -5.999
245 HA SER 34 HA SER 34 -2.679 5.523 -6.411
246 1HB SER 34 2HB SER 34 -2.518 4.498 -4.154
247 2HB SER 34 3HB SER 34 -1.333 3.873 -5.312
248 HG SER 34 HG SER 34 0.255 5.067 -4.351
249 H GLY 35 H GLY 35 -0.829 8.184 -5.219
250 1HA GLY 35 1HA GLY 35 -1.657 10.246 -4.736
251 2HA GLY 35 2HA GLY 35 -3.311 9.610 -4.567
252 H LEU 36 H LEU 36 -1.074 7.726 -2.827
253 HA LEU 36 HA LEU 36 -2.145 8.570 -0.299
254 1HB LEU 36 2HB LEU 36 0.220 6.791 -0.977
255 2HB LEU 36 3HB LEU 36 -0.618 6.902 0.576
256 HG LEU 36 HG LEU 36 -1.889 5.902 -1.988
257 1HD1 LEU 36 1HD1 LEU 36 -1.821 3.713 -0.890
258 2HD1 LEU 36 2HD1 LEU 36 -0.184 4.372 -1.037
259 3HD1 LEU 36 3HD1 LEU 36 -1.022 4.424 0.530
260 1HD2 LEU 36 1HD2 LEU 36 -3.720 5.148 -0.462
261 2HD2 LEU 36 2HD2 LEU 36 -3.005 6.152 0.819
262 3HD2 LEU 36 3HD2 LEU 36 -3.619 6.892 -0.685
263 H SER 37 H SER 37 0.750 9.475 -2.185
264 HA SER 37 HA SER 37 2.060 11.141 -0.237
265 1HB SER 37 2HB SER 37 2.740 12.354 -2.363
266 2HB SER 37 3HB SER 37 3.060 10.616 -2.437
267 HG SER 37 HG SER 37 1.957 11.454 -4.312
268 H LYS 38 H LYS 38 -0.859 11.523 -2.160
269 HA LYS 38 HA LYS 38 -0.811 14.434 -1.994
270 1HB LYS 38 2HB LYS 38 -1.473 12.708 -3.940
271 2HB LYS 38 3HB LYS 38 -3.075 12.831 -3.223
272 1HG LYS 38 2HG LYS 38 -3.259 15.122 -3.796
273 2HG LYS 38 3HG LYS 38 -1.514 15.340 -3.900
274 1HD LYS 38 2HD LYS 38 -2.514 15.444 -6.092
275 2HD LYS 38 3HD LYS 38 -1.340 14.143 -5.984
276 1HE LYS 38 2HE LYS 38 -4.236 13.442 -5.471
277 2HE LYS 38 3HE LYS 38 -3.820 13.907 -7.121
278 1HZ LYS 38 1HZ LYS 38 -2.465 11.744 -5.674
279 2HZ LYS 38 2HZ LYS 38 -3.643 11.487 -6.754
280 3HZ LYS 38 3HZ LYS 38 -2.246 12.150 -7.248
281 H MET 39 H MET 39 -2.345 11.661 -0.533
282 HA MET 39 HA MET 39 -4.652 12.703 0.468
283 1HB MET 39 2HB MET 39 -2.769 10.494 1.187
284 2HB MET 39 3HB MET 39 -3.862 10.958 2.459
285 1HG MET 39 2HG MET 39 -5.792 10.702 0.933
286 2HG MET 39 3HG MET 39 -4.678 10.181 -0.347
287 1HE MET 39 1HE MET 39 -7.321 8.483 0.829
288 2HE MET 39 2HE MET 39 -6.337 8.376 -0.643
289 3HE MET 39 3HE MET 39 -6.546 6.940 0.375
290 H SER 40 H SER 40 -1.698 12.482 2.454
291 HA SER 40 HA SER 40 -0.913 14.330 3.884
292 1HB SER 40 2HB SER 40 -2.893 15.765 3.905
293 2HB SER 40 3HB SER 40 -3.864 14.482 4.676
294 HG SER 40 HG SER 40 -2.953 16.136 6.107
295 H ALA 41 H ALA 41 -0.213 13.733 5.985
296 HA ALA 41 HA ALA 41 -0.203 11.112 6.908
297 1HB ALA 41 1HB ALA 41 0.154 12.153 9.187
298 2HB ALA 41 2HB ALA 41 1.235 12.748 7.927
299 3HB ALA 41 3HB ALA 41 -0.149 13.738 8.453
300 H ASN 42 H ASN 42 -2.699 13.592 7.355
301 HA ASN 42 HA ASN 42 -4.182 12.311 9.450
302 1HB ASN 42 2HB ASN 42 -5.191 14.142 7.223
303 2HB ASN 42 3HB ASN 42 -6.056 13.743 8.715
304 1HD2 ASN 42 1HD2 ASN 42 -5.309 16.414 7.765
305 2HD2 ASN 42 2HD2 ASN 42 -4.218 17.064 8.977
306 H GLN 43 H GLN 43 -4.853 12.432 5.931
307 HA GLN 43 HA GLN 43 -6.923 10.459 6.019
308 1HB GLN 43 2HB GLN 43 -5.257 11.747 3.857
309 2HB GLN 43 3HB GLN 43 -6.326 10.398 3.453
310 1HG GLN 43 2HG GLN 43 -7.132 13.046 4.739
311 2HG GLN 43 3HG GLN 43 -7.387 12.594 3.049
312 1HE2 GLN 43 1HE2 GLN 43 -8.326 9.899 3.348
313 2HE2 GLN 43 2HE2 GLN 43 -9.855 9.984 4.205
314 H VAL 44 H VAL 44 -3.368 10.233 5.430
315 HA VAL 44 HA VAL 44 -3.425 7.520 4.603
316 HB VAL 44 HB VAL 44 -1.276 9.229 5.908
317 1HG1 VAL 44 1HG1 VAL 44 -0.992 6.580 4.430
318 2HG1 VAL 44 2HG1 VAL 44 0.333 7.641 4.960
319 3HG1 VAL 44 3HG1 VAL 44 -0.679 6.830 6.165
320 1HG2 VAL 44 1HG2 VAL 44 -2.219 9.924 3.598
321 2HG2 VAL 44 2HG2 VAL 44 -0.493 9.628 3.676
322 3HG2 VAL 44 3HG2 VAL 44 -1.593 8.409 2.982
323 H LYS 45 H LYS 45 -3.121 9.055 7.864
324 HA LYS 45 HA LYS 45 -2.822 6.632 9.323
325 1HB LYS 45 2HB LYS 45 -2.417 8.918 10.201
326 2HB LYS 45 3HB LYS 45 -4.167 9.203 10.234
327 1HG LYS 45 2HG LYS 45 -4.409 7.217 11.746
328 2HG LYS 45 3HG LYS 45 -2.658 7.027 11.764
329 1HD LYS 45 2HD LYS 45 -4.302 9.421 12.739
330 2HD LYS 45 3HD LYS 45 -3.533 8.220 13.774
331 1HE LYS 45 2HE LYS 45 -2.160 10.329 12.038
332 2HE LYS 45 3HE LYS 45 -2.221 10.246 13.800
333 1HZ LYS 45 1HZ LYS 45 -0.733 8.499 11.965
334 2HZ LYS 45 2HZ LYS 45 -0.143 9.456 13.134
335 3HZ LYS 45 3HZ LYS 45 -0.964 8.096 13.556
336 H ASP 46 H ASP 46 -5.744 8.447 8.228
337 HA ASP 46 HA ASP 46 -7.630 6.642 9.363
338 1HB ASP 46 2HB ASP 46 -7.744 8.810 7.360
339 2HB ASP 46 3HB ASP 46 -8.937 7.525 7.146
340 H VAL 47 H VAL 47 -6.403 6.610 5.966
341 HA VAL 47 HA VAL 47 -7.767 4.227 5.366
342 HB VAL 47 HB VAL 47 -6.524 3.974 3.423
343 1HG1 VAL 47 1HG1 VAL 47 -6.934 5.968 2.353
344 2HG1 VAL 47 2HG1 VAL 47 -7.949 6.139 3.799
345 3HG1 VAL 47 3HG1 VAL 47 -6.384 6.964 3.695
346 1HG2 VAL 47 1HG2 VAL 47 -4.476 5.235 2.852
347 2HG2 VAL 47 2HG2 VAL 47 -4.349 5.652 4.569
348 3HG2 VAL 47 3HG2 VAL 47 -4.250 3.961 4.063
349 H PHE 48 H PHE 48 -4.511 4.623 6.775
350 HA PHE 48 HA PHE 48 -3.616 2.008 6.941
351 1HB PHE 48 2HB PHE 48 -2.135 3.511 7.795
352 2HB PHE 48 3HB PHE 48 -3.348 4.393 8.694
353 HD1 PHE 48 1HD PHE 48 -1.558 1.088 8.685
354 HD2 PHE 48 2HD PHE 48 -3.746 4.008 10.982
355 HE1 PHE 48 1HE PHE 48 -1.401 -0.363 10.689
356 HE2 PHE 48 2HE PHE 48 -3.638 2.523 12.964
357 HZ PHE 48 HZ PHE 48 -2.535 0.303 12.793
358 H ARG 49 H ARG 49 -6.197 3.469 9.021
359 HA ARG 49 HA ARG 49 -6.448 1.204 10.771
360 1HB ARG 49 2HB ARG 49 -8.524 3.213 9.850
361 2HB ARG 49 3HB ARG 49 -8.752 2.087 11.178
362 1HG ARG 49 2HG ARG 49 -7.454 3.218 12.645
363 2HG ARG 49 3HG ARG 49 -6.277 3.708 11.425
364 1HD ARG 49 2HD ARG 49 -7.164 5.743 11.221
365 2HD ARG 49 3HD ARG 49 -8.756 5.107 10.852
366 HE ARG 49 HE ARG 49 -9.451 5.694 12.901
367 1HH1 ARG 49 2HH2 ARG 49 -5.990 5.303 13.008
368 2HH1 ARG 49 1HH2 ARG 49 -5.741 6.073 14.554
369 1HH2 ARG 49 2HH1 ARG 49 -9.222 6.798 14.929
370 2HH2 ARG 49 1HH1 ARG 49 -7.665 6.963 15.673
371 H PHE 50 H PHE 50 -7.745 1.915 7.529
372 HA PHE 50 HA PHE 50 -9.576 -0.353 7.528
373 1HB PHE 50 2HB PHE 50 -9.557 1.966 6.166
374 2HB PHE 50 3HB PHE 50 -8.644 1.009 5.012
375 HD1 PHE 50 1HD PHE 50 -11.811 1.166 7.009
376 HD2 PHE 50 2HD PHE 50 -9.886 -0.428 3.496
377 HE1 PHE 50 1HE PHE 50 -13.996 0.347 6.187
378 HE2 PHE 50 2HE PHE 50 -12.075 -1.307 2.706
379 HZ PHE 50 HZ PHE 50 -14.136 -0.889 4.032
380 H ILE 51 H ILE 51 -6.255 0.379 6.503
381 HA ILE 51 HA ILE 51 -5.841 -2.046 5.013
382 HB ILE 51 HB ILE 51 -3.743 -0.354 6.439
383 1HG1 ILE 51 2HG1 ILE 51 -4.574 1.222 4.967
384 2HG1 ILE 51 3HG1 ILE 51 -3.329 0.462 4.011
385 1HG2 ILE 51 1HG2 ILE 51 -2.876 -2.504 5.895
386 2HG2 ILE 51 2HG2 ILE 51 -3.550 -2.453 4.267
387 3HG2 ILE 51 3HG2 ILE 51 -2.220 -1.364 4.725
388 1HD1 ILE 51 1HD1 ILE 51 -5.173 -0.966 2.948
389 2HD1 ILE 51 2HD1 ILE 51 -6.342 0.076 3.783
390 3HD1 ILE 51 3HD1 ILE 51 -5.209 0.777 2.623
391 H ASP 52 H ASP 52 -4.974 -1.172 8.410
392 HA ASP 52 HA ASP 52 -4.093 -3.895 8.963
393 1HB ASP 52 2HB ASP 52 -3.297 -1.612 9.990
394 2HB ASP 52 3HB ASP 52 -4.604 -1.861 11.144
395 H ASN 53 H ASN 53 -6.175 -4.641 8.061
396 HA ASN 53 HA ASN 53 -8.732 -4.274 8.957
397 1HB ASN 53 2HB ASN 53 -7.984 -5.591 7.006
398 2HB ASN 53 3HB ASN 53 -7.427 -6.887 8.056
399 1HD2 ASN 53 1HD2 ASN 53 -9.027 -8.230 9.163
400 2HD2 ASN 53 2HD2 ASN 53 -10.682 -8.254 8.590
401 H ASP 54 H ASP 54 -6.288 -6.405 10.353
402 HA ASP 54 HA ASP 54 -7.985 -7.658 12.365
403 1HB ASP 54 2HB ASP 54 -5.798 -8.684 12.954
404 2HB ASP 54 3HB ASP 54 -6.110 -8.818 11.211
405 H GLN 55 H GLN 55 -6.025 -4.759 12.081
406 HA GLN 55 HA GLN 55 -5.305 -3.203 13.430
407 1HB GLN 55 2HB GLN 55 -7.883 -4.016 14.663
408 2HB GLN 55 3HB GLN 55 -6.840 -3.057 15.707
409 1HG GLN 55 2HG GLN 55 -6.590 -1.337 13.974
410 2HG GLN 55 3HG GLN 55 -7.649 -2.251 12.888
411 1HE2 GLN 55 1HE2 GLN 55 -9.851 -2.899 14.021
412 2HE2 GLN 55 2HE2 GLN 55 -10.617 -1.584 14.904
413 H SER 56 H SER 56 -3.948 -5.823 13.691
414 HA SER 56 HA SER 56 -2.934 -5.999 16.348
415 1HB SER 56 2HB SER 56 -0.960 -6.992 15.370
416 2HB SER 56 3HB SER 56 -2.402 -7.669 14.609
417 HG SER 56 HG SER 56 -0.573 -7.014 13.209
418 H GLY 57 H GLY 57 -2.284 -3.743 13.692
419 1HA GLY 57 1HA GLY 57 -1.166 -1.666 13.833
420 2HA GLY 57 2HA GLY 57 -0.493 -2.090 15.412
421 H TYR 58 H TYR 58 -0.115 -4.844 13.572
422 HA TYR 58 HA TYR 58 2.460 -3.996 12.323
423 1HB TYR 58 2HB TYR 58 1.734 -6.620 13.646
424 2HB TYR 58 3HB TYR 58 3.018 -6.454 12.456
425 HD1 TYR 58 HD1 TYR 58 2.230 -6.044 15.961
426 HD2 TYR 58 HD2 TYR 58 4.893 -4.772 12.816
427 HE1 TYR 58 HE1 TYR 58 3.904 -5.334 17.652
428 HE2 TYR 58 HE2 TYR 58 6.549 -4.054 14.500
429 HH TYR 58 HH TYR 58 7.030 -3.862 16.745
430 H LEU 59 H LEU 59 2.754 -4.438 10.300
431 HA LEU 59 HA LEU 59 0.662 -5.774 8.697
432 1HB LEU 59 2HB LEU 59 2.014 -3.107 8.509
433 2HB LEU 59 3HB LEU 59 1.936 -3.995 6.990
434 HG LEU 59 HG LEU 59 -0.537 -3.746 8.730
435 1HD1 LEU 59 1HD1 LEU 59 0.323 -1.797 6.555
436 2HD1 LEU 59 2HD1 LEU 59 -1.209 -1.783 7.455
437 3HD1 LEU 59 3HD1 LEU 59 0.309 -1.442 8.300
438 1HD2 LEU 59 1HD2 LEU 59 -0.427 -5.419 6.838
439 2HD2 LEU 59 2HD2 LEU 59 -1.624 -4.168 6.535
440 3HD2 LEU 59 3HD2 LEU 59 -0.024 -4.098 5.748
441 H ASP 60 H ASP 60 1.974 -7.552 9.523
442 HA ASP 60 HA ASP 60 4.437 -8.294 8.422
443 1HB ASP 60 2HB ASP 60 1.988 -10.028 8.981
444 2HB ASP 60 3HB ASP 60 3.671 -10.576 8.932
445 H GLU 61 H GLU 61 4.910 -9.783 6.646
446 HA GLU 61 HA GLU 61 4.030 -8.924 4.188
447 1HB GLU 61 2HB GLU 61 5.316 -11.572 4.957
448 2HB GLU 61 3HB GLU 61 5.075 -11.027 3.289
449 1HG GLU 61 2HG GLU 61 6.373 -8.975 3.734
450 2HG GLU 61 3HG GLU 61 6.682 -9.508 5.395
451 H GLU 62 H GLU 62 2.739 -11.812 5.944
452 HA GLU 62 HA GLU 62 0.968 -12.574 3.857
453 1HB GLU 62 2HB GLU 62 0.886 -13.047 6.861
454 2HB GLU 62 3HB GLU 62 -0.345 -13.668 5.749
455 1HG GLU 62 2HG GLU 62 1.386 -14.818 4.413
456 2HG GLU 62 3HG GLU 62 2.641 -14.260 5.534
457 H GLU 63 H GLU 63 0.588 -10.022 6.356
458 HA GLU 63 HA GLU 63 -2.204 -9.528 5.653
459 1HB GLU 63 2HB GLU 63 -0.143 -7.788 7.074
460 2HB GLU 63 3HB GLU 63 -1.807 -7.322 6.702
461 1HG GLU 63 2HG GLU 63 -2.658 -9.220 8.043
462 2HG GLU 63 3HG GLU 63 -0.994 -9.644 8.494
463 H LEU 64 H LEU 64 1.016 -8.230 4.634
464 HA LEU 64 HA LEU 64 -0.070 -6.357 2.752
465 1HB LEU 64 2HB LEU 64 2.597 -7.803 2.772
466 2HB LEU 64 3HB LEU 64 2.052 -6.789 1.440
467 HG LEU 64 HG LEU 64 1.736 -4.869 2.986
468 1HD1 LEU 64 1HD1 LEU 64 3.276 -6.642 4.935
469 2HD1 LEU 64 2HD1 LEU 64 2.976 -4.909 5.127
470 3HD1 LEU 64 3HD1 LEU 64 1.616 -6.040 5.171
471 1HD2 LEU 64 1HD2 LEU 64 4.523 -6.081 2.827
472 2HD2 LEU 64 2HD2 LEU 64 3.729 -5.155 1.534
473 3HD2 LEU 64 3HD2 LEU 64 4.146 -4.360 3.058
474 H LYS 65 H LYS 65 0.384 -9.872 2.525
475 HA LYS 65 HA LYS 65 -0.327 -9.997 -0.254
476 1HB LYS 65 2HB LYS 65 0.860 -11.713 1.406
477 2HB LYS 65 3HB LYS 65 -0.777 -12.382 1.492
478 1HG LYS 65 2HG LYS 65 -0.761 -12.428 -1.079
479 2HG LYS 65 3HG LYS 65 0.897 -11.818 -1.000
480 1HD LYS 65 2HD LYS 65 1.174 -14.074 -1.378
481 2HD LYS 65 3HD LYS 65 1.539 -13.852 0.342
482 1HE LYS 65 2HE LYS 65 -0.799 -14.675 0.880
483 2HE LYS 65 3HE LYS 65 -1.087 -14.883 -0.856
484 1HZ LYS 65 1HZ LYS 65 0.797 -16.421 -0.886
485 2HZ LYS 65 2HZ LYS 65 0.922 -16.302 0.753
486 3HZ LYS 65 3HZ LYS 65 -0.437 -16.944 0.089
487 H PHE 66 H PHE 66 -2.296 -9.022 2.265
488 HA PHE 66 HA PHE 66 -4.530 -9.252 0.475
489 1HB PHE 66 2HB PHE 66 -4.756 -11.318 1.880
490 2HB PHE 66 3HB PHE 66 -4.762 -10.325 3.331
491 HD1 PHE 66 1HD PHE 66 -6.814 -9.245 4.074
492 HD2 PHE 66 2HD PHE 66 -6.658 -11.232 0.253
493 HE1 PHE 66 1HE PHE 66 -9.279 -9.094 3.896
494 HE2 PHE 66 2HE PHE 66 -9.135 -11.085 0.083
495 HZ PHE 66 HZ PHE 66 -10.443 -9.981 1.880
496 H PHE 67 H PHE 67 -3.708 -7.142 0.459
497 HA PHE 67 HA PHE 67 -4.451 -5.245 2.668
498 1HB PHE 67 2HB PHE 67 -2.140 -5.233 2.736
499 2HB PHE 67 3HB PHE 67 -1.983 -5.589 1.021
500 HD1 PHE 67 1HD PHE 67 -0.133 -4.098 0.817
501 HD2 PHE 67 2HD PHE 67 -4.006 -2.633 2.018
502 HE1 PHE 67 1HE PHE 67 0.491 -1.824 0.070
503 HE2 PHE 67 2HE PHE 67 -3.403 -0.379 1.202
504 HZ PHE 67 HZ PHE 67 -1.176 0.022 0.174
505 H LEU 68 H LEU 68 -3.848 -5.602 -0.865
506 HA LEU 68 HA LEU 68 -5.246 -3.103 -1.493
507 1HB LEU 68 2HB LEU 68 -3.673 -5.169 -3.027
508 2HB LEU 68 3HB LEU 68 -4.943 -4.270 -3.864
509 HG LEU 68 HG LEU 68 -2.785 -3.333 -4.245
510 1HD1 LEU 68 1HD1 LEU 68 -4.179 -1.330 -2.475
511 2HD1 LEU 68 2HD1 LEU 68 -3.419 -1.118 -4.064
512 3HD1 LEU 68 3HD1 LEU 68 -4.974 -1.939 -3.950
513 1HD2 LEU 68 1HD2 LEU 68 -2.663 -2.767 -1.266
514 2HD2 LEU 68 2HD2 LEU 68 -1.688 -3.983 -2.117
515 3HD2 LEU 68 3HD2 LEU 68 -1.471 -2.258 -2.478
516 H GLN 69 H GLN 69 -6.029 -6.542 -1.203
517 HA GLN 69 HA GLN 69 -8.365 -6.494 -2.734
518 1HB GLN 69 2HB GLN 69 -7.928 -8.082 -0.211
519 2HB GLN 69 3HB GLN 69 -9.286 -8.300 -1.315
520 1HG GLN 69 2HG GLN 69 -6.388 -8.899 -1.892
521 2HG GLN 69 3HG GLN 69 -7.701 -10.015 -1.709
522 1HE2 GLN 69 1HE2 GLN 69 -5.915 -8.224 -3.966
523 2HE2 GLN 69 2HE2 GLN 69 -6.625 -8.990 -5.355
524 H LYS 70 H LYS 70 -7.823 -4.596 0.102
525 HA LYS 70 HA LYS 70 -10.653 -4.198 0.770
526 1HB LYS 70 2HB LYS 70 -8.047 -2.784 1.385
527 2HB LYS 70 3HB LYS 70 -9.549 -1.871 1.478
528 1HG LYS 70 2HG LYS 70 -9.024 -2.751 3.653
529 2HG LYS 70 3HG LYS 70 -10.536 -3.421 3.021
530 1HD LYS 70 2HD LYS 70 -9.221 -5.529 2.367
531 2HD LYS 70 3HD LYS 70 -7.789 -4.768 3.073
532 1HE LYS 70 2HE LYS 70 -8.696 -6.242 4.737
533 2HE LYS 70 3HE LYS 70 -9.020 -4.577 5.260
534 1HZ LYS 70 1HZ LYS 70 -10.892 -5.955 5.586
535 2HZ LYS 70 2HZ LYS 70 -11.274 -4.839 4.444
536 3HZ LYS 70 3HZ LYS 70 -10.965 -6.399 3.995
537 H PHE 71 H PHE 71 -8.293 -2.756 -1.502
538 HA PHE 71 HA PHE 71 -10.017 -0.478 -2.096
539 1HB PHE 71 2HB PHE 71 -7.477 -1.510 -3.417
540 2HB PHE 71 3HB PHE 71 -8.281 0.008 -3.784
541 HD1 PHE 71 1HD PHE 71 -8.537 -0.270 -0.243
542 HD2 PHE 71 2HD PHE 71 -5.709 0.535 -3.404
543 HE1 PHE 71 1HE PHE 71 -7.142 0.981 1.325
544 HE2 PHE 71 2HE PHE 71 -4.314 1.820 -1.812
545 HZ PHE 71 HZ PHE 71 -5.030 2.062 0.554
546 H GLU 72 H GLU 72 -9.106 -3.546 -3.685
547 HA GLU 72 HA GLU 72 -11.379 -3.293 -5.566
548 1HB GLU 72 2HB GLU 72 -9.853 -3.876 -7.459
549 2HB GLU 72 3HB GLU 72 -9.502 -2.284 -6.787
550 1HG GLU 72 2HG GLU 72 -7.568 -3.124 -5.570
551 2HG GLU 72 3HG GLU 72 -7.999 -4.796 -5.965
552 H SER 73 H SER 73 -11.227 -5.528 -6.942
553 HA SER 73 HA SER 73 -10.877 -7.713 -4.908
554 1HB SER 73 2HB SER 73 -12.817 -7.651 -7.234
555 2HB SER 73 3HB SER 73 -12.762 -8.784 -5.871
556 HG SER 73 HG SER 73 -14.352 -7.159 -5.549
557 H GLY 74 H GLY 74 -8.909 -6.646 -7.092
558 1HA GLY 74 1HA GLY 74 -8.017 -9.285 -7.936
559 2HA GLY 74 2HA GLY 74 -8.737 -8.340 -9.256
560 H ALA 75 H ALA 75 -6.801 -7.264 -6.430
561 HA ALA 75 HA ALA 75 -5.135 -5.639 -8.117
562 1HB ALA 75 1HB ALA 75 -4.292 -4.737 -6.169
563 2HB ALA 75 2HB ALA 75 -5.889 -5.282 -5.632
564 3HB ALA 75 3HB ALA 75 -4.463 -6.250 -5.266
565 H ARG 76 H ARG 76 -2.705 -6.095 -6.504
566 HA ARG 76 HA ARG 76 -1.618 -8.438 -8.005
567 1HB ARG 76 2HB ARG 76 -0.992 -5.919 -8.458
568 2HB ARG 76 3HB ARG 76 -0.074 -6.079 -6.955
569 1HG ARG 76 2HG ARG 76 1.444 -6.594 -8.546
570 2HG ARG 76 3HG ARG 76 1.017 -8.204 -8.066
571 1HD ARG 76 2HD ARG 76 -0.047 -8.675 -10.119
572 2HD ARG 76 3HD ARG 76 -0.566 -7.039 -10.375
573 HE ARG 76 HE ARG 76 2.224 -8.123 -10.689
574 1HH1 ARG 76 2HH2 ARG 76 0.064 -5.342 -11.001
575 2HH1 ARG 76 1HH2 ARG 76 1.273 -4.339 -11.706
576 1HH2 ARG 76 2HH1 ARG 76 3.764 -6.828 -11.263
577 2HH2 ARG 76 1HH1 ARG 76 3.409 -5.529 -12.428
578 H GLU 77 H GLU 77 -2.372 -7.491 -4.792
579 HA GLU 77 HA GLU 77 -0.116 -7.967 -3.319
580 1HB GLU 77 2HB GLU 77 -1.563 -8.542 -1.471
581 2HB GLU 77 3HB GLU 77 -1.986 -7.083 -2.352
582 1HG GLU 77 2HG GLU 77 -3.525 -9.010 -3.692
583 2HG GLU 77 3HG GLU 77 -3.501 -9.629 -2.037
584 H LEU 78 H LEU 78 -2.270 -10.332 -4.675
585 HA LEU 78 HA LEU 78 -1.488 -12.770 -3.802
586 1HB LEU 78 2HB LEU 78 -1.506 -12.293 -6.795
587 2HB LEU 78 3HB LEU 78 -1.997 -13.702 -5.875
588 HG LEU 78 HG LEU 78 -3.967 -12.918 -6.634
589 1HD1 LEU 78 1HD1 LEU 78 -3.921 -11.383 -4.004
590 2HD1 LEU 78 2HD1 LEU 78 -5.317 -12.035 -4.862
591 3HD1 LEU 78 3HD1 LEU 78 -4.116 -13.139 -4.163
592 1HD2 LEU 78 1HD2 LEU 78 -4.705 -10.706 -6.997
593 2HD2 LEU 78 2HD2 LEU 78 -3.359 -9.989 -6.119
594 3HD2 LEU 78 3HD2 LEU 78 -3.060 -10.832 -7.645
595 H THR 79 H THR 79 0.415 -10.802 -6.211
596 HA THR 79 HA THR 79 2.427 -12.882 -6.345
597 HB THR 79 HB THR 79 2.744 -10.083 -7.447
598 HG1 THR 79 1HG THR 79 2.098 -11.230 -9.353
599 1HG2 THR 79 1HG2 THR 79 4.755 -11.564 -7.463
600 2HG2 THR 79 2HG2 THR 79 3.809 -12.871 -8.205
601 3HG2 THR 79 3HG2 THR 79 4.144 -11.386 -9.107
602 H GLU 80 H GLU 80 3.930 -13.131 -4.975
603 HA GLU 80 HA GLU 80 4.342 -11.395 -2.786
604 1HB GLU 80 2HB GLU 80 6.101 -13.691 -3.683
605 2HB GLU 80 3HB GLU 80 6.145 -12.809 -2.137
606 1HG GLU 80 2HG GLU 80 4.918 -14.742 -1.648
607 2HG GLU 80 3HG GLU 80 3.718 -13.452 -1.767
608 H SER 81 H SER 81 6.106 -11.570 -5.889
609 HA SER 81 HA SER 81 8.379 -10.076 -5.096
610 1HB SER 81 2HB SER 81 8.048 -11.287 -7.333
611 2HB SER 81 3HB SER 81 7.160 -9.849 -7.878
612 HG SER 81 HG SER 81 9.176 -9.294 -8.364
613 H GLU 82 H GLU 82 5.464 -8.775 -6.847
614 HA GLU 82 HA GLU 82 5.978 -6.086 -6.433
615 1HB GLU 82 2HB GLU 82 3.335 -7.606 -6.641
616 2HB GLU 82 3HB GLU 82 3.494 -5.847 -6.642
617 1HG GLU 82 2HG GLU 82 3.510 -6.220 -8.900
618 2HG GLU 82 3HG GLU 82 5.246 -6.271 -8.609
619 H THR 83 H THR 83 4.223 -8.339 -4.204
620 HA THR 83 HA THR 83 3.489 -6.345 -2.329
621 HB THR 83 HB THR 83 3.848 -9.319 -2.283
622 HG1 THR 83 1HG THR 83 1.843 -8.002 -0.969
623 1HG2 THR 83 1HG2 THR 83 3.272 -9.378 0.177
624 2HG2 THR 83 2HG2 THR 83 4.947 -8.948 -0.169
625 3HG2 THR 83 3HG2 THR 83 3.789 -7.681 0.280
626 H LYS 84 H LYS 84 6.427 -8.349 -2.633
627 HA LYS 84 HA LYS 84 7.634 -7.387 -0.283
628 1HB LYS 84 2HB LYS 84 8.069 -9.542 -1.383
629 2HB LYS 84 3HB LYS 84 8.968 -8.730 -2.678
630 1HG LYS 84 2HG LYS 84 9.679 -8.188 0.210
631 2HG LYS 84 3HG LYS 84 10.047 -9.781 -0.451
632 1HD LYS 84 2HD LYS 84 11.429 -8.891 -2.191
633 2HD LYS 84 3HD LYS 84 10.983 -7.216 -1.828
634 1HE LYS 84 2HE LYS 84 12.164 -7.161 0.211
635 2HE LYS 84 3HE LYS 84 12.234 -8.924 0.346
636 1HZ LYS 84 1HZ LYS 84 13.709 -7.350 -1.655
637 2HZ LYS 84 2HZ LYS 84 14.340 -7.988 -0.274
638 3HZ LYS 84 3HZ LYS 84 13.774 -8.984 -1.451
639 H SER 85 H SER 85 7.754 -6.295 -3.649
640 HA SER 85 HA SER 85 9.772 -4.326 -3.442
641 1HB SER 85 2HB SER 85 7.230 -4.202 -5.131
642 2HB SER 85 3HB SER 85 8.728 -3.313 -5.388
643 HG SER 85 HG SER 85 8.430 -6.154 -5.463
644 H LEU 86 H LEU 86 6.240 -4.163 -2.681
645 HA LEU 86 HA LEU 86 6.411 -1.448 -1.681
646 1HB LEU 86 2HB LEU 86 4.357 -3.612 -1.641
647 2HB LEU 86 3HB LEU 86 4.282 -2.438 -0.330
648 HG LEU 86 HG LEU 86 2.876 -1.834 -2.263
649 1HD1 LEU 86 1HD1 LEU 86 3.764 -0.141 -0.669
650 2HD1 LEU 86 2HD1 LEU 86 5.097 0.213 -1.777
651 3HD1 LEU 86 3HD1 LEU 86 3.444 0.534 -2.261
652 1HD2 LEU 86 1HD2 LEU 86 4.275 -2.733 -4.069
653 2HD2 LEU 86 2HD2 LEU 86 3.902 -1.033 -4.373
654 3HD2 LEU 86 3HD2 LEU 86 5.502 -1.487 -3.793
655 H MET 87 H MET 87 6.336 -4.569 0.038
656 HA MET 87 HA MET 87 6.781 -3.728 2.571
657 1HB MET 87 2HB MET 87 6.584 -6.130 1.711
658 2HB MET 87 3HB MET 87 8.299 -6.035 1.325
659 1HG MET 87 2HG MET 87 8.258 -5.240 4.003
660 2HG MET 87 3HG MET 87 6.973 -6.437 3.915
661 1HE MET 87 1HE MET 87 10.741 -5.627 3.704
662 2HE MET 87 2HE MET 87 11.462 -7.150 3.135
663 3HE MET 87 3HE MET 87 10.500 -6.155 2.019
664 H ALA 88 H ALA 88 9.265 -4.109 0.068
665 HA ALA 88 HA ALA 88 11.585 -3.835 1.546
666 1HB ALA 88 1HB ALA 88 11.028 -2.961 -1.325
667 2HB ALA 88 2HB ALA 88 12.635 -3.232 -0.619
668 3HB ALA 88 3HB ALA 88 11.494 -4.581 -0.803
669 H ALA 89 H ALA 89 9.618 -1.197 0.104
670 HA ALA 89 HA ALA 89 11.516 0.851 1.117
671 1HB ALA 89 1HB ALA 89 8.842 1.112 -0.273
672 2HB ALA 89 2HB ALA 89 9.962 2.443 0.086
673 3HB ALA 89 3HB ALA 89 10.445 1.180 -1.064
674 H ALA 90 H ALA 90 8.205 -0.359 1.738
675 HA ALA 90 HA ALA 90 7.423 1.593 3.690
676 1HB ALA 90 1HB ALA 90 5.716 -0.074 4.233
677 2HB ALA 90 2HB ALA 90 5.943 -0.027 2.457
678 3HB ALA 90 3HB ALA 90 6.658 -1.343 3.418
679 H ASP 91 H ASP 91 9.168 -1.520 4.033
680 HA ASP 91 HA ASP 91 9.197 -1.305 6.886
681 1HB ASP 91 2HB ASP 91 9.310 -3.491 5.757
682 2HB ASP 91 3HB ASP 91 10.897 -3.069 5.082
683 H ASN 92 H ASN 92 10.149 0.739 7.370
684 HA ASN 92 HA ASN 92 12.727 1.511 6.093
685 1HB ASN 92 2HB ASN 92 10.976 2.961 8.115
686 2HB ASN 92 3HB ASN 92 12.505 3.569 7.473
687 1HD2 ASN 92 1HD2 ASN 92 9.254 2.451 6.288
688 2HD2 ASN 92 2HD2 ASN 92 9.246 3.622 4.993
689 H ASP 93 H ASP 93 12.929 -0.883 7.502
690 HA ASP 93 HA ASP 93 14.618 -0.161 9.863
691 1HB ASP 93 2HB ASP 93 12.608 -2.453 9.619
692 2HB ASP 93 3HB ASP 93 13.915 -2.425 10.797
693 H GLY 94 H GLY 94 13.627 -2.823 7.680
694 1HA GLY 94 1HA GLY 94 15.115 -4.181 6.370
695 2HA GLY 94 2HA GLY 94 16.446 -3.814 7.481
696 H ASP 95 H ASP 95 13.011 -4.678 8.076
697 HA ASP 95 HA ASP 95 13.860 -7.248 9.318
698 1HB ASP 95 2HB ASP 95 12.766 -6.999 11.265
699 2HB ASP 95 3HB ASP 95 13.296 -5.332 11.045
700 H GLY 96 H GLY 96 10.993 -5.352 8.214
701 1HA GLY 96 1HA GLY 96 10.054 -6.184 6.082
702 2HA GLY 96 2HA GLY 96 9.991 -7.806 6.786
703 H LYS 97 H LYS 97 9.218 -6.753 9.510
704 HA LYS 97 HA LYS 97 6.325 -6.658 9.053
705 1HB LYS 97 2HB LYS 97 8.010 -6.318 11.564
706 2HB LYS 97 3HB LYS 97 6.247 -6.382 11.520
707 1HG LYS 97 2HG LYS 97 6.199 -8.624 10.776
708 2HG LYS 97 3HG LYS 97 7.927 -8.636 10.367
709 1HD LYS 97 2HD LYS 97 8.609 -8.423 12.646
710 2HD LYS 97 3HD LYS 97 6.949 -8.211 13.222
711 1HE LYS 97 2HE LYS 97 7.947 -10.727 11.786
712 2HE LYS 97 3HE LYS 97 7.977 -10.543 13.547
713 1HZ LYS 97 1HZ LYS 97 5.580 -10.279 13.509
714 2HZ LYS 97 2HZ LYS 97 5.517 -10.394 11.905
715 3HZ LYS 97 3HZ LYS 97 5.984 -11.694 12.772
716 H ILE 98 H ILE 98 5.379 -4.822 8.406
717 HA ILE 98 HA ILE 98 6.590 -2.169 9.021
718 HB ILE 98 HB ILE 98 4.347 -3.156 7.242
719 1HG1 ILE 98 2HG1 ILE 98 6.600 -1.602 6.113
720 2HG1 ILE 98 3HG1 ILE 98 7.159 -3.056 6.921
721 1HG2 ILE 98 1HG2 ILE 98 5.238 -0.277 7.645
722 2HG2 ILE 98 2HG2 ILE 98 4.277 -0.866 6.282
723 3HG2 ILE 98 3HG2 ILE 98 3.610 -0.958 7.914
724 1HD1 ILE 98 1HD1 ILE 98 6.752 -3.586 4.674
725 2HD1 ILE 98 2HD1 ILE 98 5.523 -4.422 5.635
726 3HD1 ILE 98 3HD1 ILE 98 5.085 -2.950 4.720
727 H GLY 99 H GLY 99 4.968 -0.521 9.822
728 1HA GLY 99 1HA GLY 99 2.730 -1.520 11.388
729 2HA GLY 99 2HA GLY 99 4.016 -0.693 12.312
730 H ALA 100 H ALA 100 1.798 0.690 12.454
731 HA ALA 100 HA ALA 100 0.848 2.169 10.262
732 1HB ALA 100 1HB ALA 100 1.025 3.131 13.150
733 2HB ALA 100 2HB ALA 100 -0.131 3.637 11.897
734 3HB ALA 100 3HB ALA 100 -0.194 1.989 12.565
735 H GLU 101 H GLU 101 3.386 2.872 12.654
736 HA GLU 101 HA GLU 101 3.910 5.459 11.829
737 1HB GLU 101 2HB GLU 101 4.602 4.430 13.980
738 2HB GLU 101 3HB GLU 101 5.908 3.560 13.160
739 1HG GLU 101 2HG GLU 101 7.040 5.620 12.643
740 2HG GLU 101 3HG GLU 101 5.609 6.591 13.024
741 H GLU 102 H GLU 102 5.967 2.566 11.080
742 HA GLU 102 HA GLU 102 7.546 3.587 9.064
743 1HB GLU 102 2HB GLU 102 6.255 0.862 9.387
744 2HB GLU 102 3HB GLU 102 7.406 1.217 8.101
745 1HG GLU 102 2HG GLU 102 9.114 1.841 9.771
746 2HG GLU 102 3HG GLU 102 7.989 1.442 11.081
747 H PHE 103 H PHE 103 4.171 2.339 8.656
748 HA PHE 103 HA PHE 103 4.218 2.548 5.806
749 1HB PHE 103 2HB PHE 103 2.562 1.350 7.434
750 2HB PHE 103 3HB PHE 103 1.685 2.866 7.443
751 HD1 PHE 103 1HD PHE 103 2.038 -0.285 5.873
752 HD2 PHE 103 2HD PHE 103 1.167 3.843 4.951
753 HE1 PHE 103 1HE PHE 103 0.897 -0.988 3.796
754 HE2 PHE 103 2HE PHE 103 0.028 3.119 2.870
755 HZ PHE 103 HZ PHE 103 -0.093 0.713 2.286
756 H GLN 104 H GLN 104 2.938 4.759 8.314
757 HA GLN 104 HA GLN 104 2.135 6.888 6.530
758 1HB GLN 104 2HB GLN 104 1.423 6.373 8.989
759 2HB GLN 104 3HB GLN 104 2.922 7.209 9.433
760 1HG GLN 104 2HG GLN 104 2.023 9.125 7.879
761 2HG GLN 104 3HG GLN 104 0.484 8.258 7.930
762 1HE2 GLN 104 1HE2 GLN 104 2.575 10.441 9.559
763 2HE2 GLN 104 2HE2 GLN 104 1.666 10.600 11.041
764 H GLU 105 H GLU 105 5.268 6.100 8.143
765 HA GLU 105 HA GLU 105 6.514 8.595 7.500
766 1HB GLU 105 2HB GLU 105 7.582 5.780 7.999
767 2HB GLU 105 3HB GLU 105 8.645 7.126 7.597
768 1HG GLU 105 2HG GLU 105 6.708 7.262 9.947
769 2HG GLU 105 3HG GLU 105 8.396 6.750 10.078
770 H MET 106 H MET 106 6.520 5.424 5.784
771 HA MET 106 HA MET 106 8.076 6.299 3.608
772 1HB MET 106 2HB MET 106 7.142 3.921 4.275
773 2HB MET 106 3HB MET 106 5.793 4.334 3.225
774 1HG MET 106 2HG MET 106 8.730 3.986 2.497
775 2HG MET 106 3HG MET 106 7.337 3.034 2.002
776 1HE MET 106 1HE MET 106 8.796 6.763 1.570
777 2HE MET 106 2HE MET 106 9.856 5.513 0.886
778 3HE MET 106 3HE MET 106 8.986 6.638 -0.181
779 H VAL 107 H VAL 107 4.527 6.162 4.034
780 HA VAL 107 HA VAL 107 3.958 7.355 1.523
781 HB VAL 107 HB VAL 107 2.282 6.863 3.995
782 1HG1 VAL 107 1HG1 VAL 107 0.334 7.176 2.521
783 2HG1 VAL 107 2HG1 VAL 107 1.236 8.684 2.698
784 3HG1 VAL 107 3HG1 VAL 107 1.411 7.728 1.215
785 1HG2 VAL 107 1HG2 VAL 107 3.110 4.821 2.807
786 2HG2 VAL 107 2HG2 VAL 107 1.366 5.030 2.589
787 3HG2 VAL 107 3HG2 VAL 107 2.479 5.461 1.280
788 H HIS 108 H HIS 108 4.443 8.896 4.742
789 HA HIS 108 HA HIS 108 3.324 11.383 3.678
790 1HB HIS 108 2HB HIS 108 2.968 10.601 6.006
791 2HB HIS 108 3HB HIS 108 4.662 10.980 6.355
792 HD1 HIS 108 1HD HIS 108 4.663 13.261 7.595
793 HD2 HIS 108 2HD HIS 108 1.699 12.927 4.628
794 HE1 HIS 108 1HE HIS 108 3.309 15.433 7.656
795 H SER 109 H SER 109 6.107 9.896 2.934
796 HA SER 109 HA SER 109 8.025 11.998 3.460
797 1HB SER 109 2HB SER 109 8.656 9.572 3.329
798 2HB SER 109 3HB SER 109 8.171 9.586 1.615
799 HG SER 109 HG SER 109 9.657 11.478 1.513
Start of MODEL 12
1 1H MET 1 H1 MET 1 -17.787 3.280 4.380
2 2H MET 1 H2 MET 1 -19.129 3.263 3.387
3 3H MET 1 H3 MET 1 -18.053 1.987 3.425
4 HA MET 1 HA MET 1 -17.740 3.296 1.462
5 1HB MET 1 2HB MET 1 -16.835 5.416 3.489
6 2HB MET 1 3HB MET 1 -16.697 5.517 1.732
7 1HG MET 1 2HG MET 1 -19.207 5.690 3.395
8 2HG MET 1 3HG MET 1 -18.528 6.839 2.244
9 1HE MET 1 1HE MET 1 -21.824 6.087 0.429
10 2HE MET 1 2HE MET 1 -21.538 6.371 2.166
11 3HE MET 1 3HE MET 1 -20.653 7.323 0.942
12 H SER 2 H SER 2 -15.352 4.098 0.900
13 HA SER 2 HA SER 2 -13.283 2.813 2.482
14 1HB SER 2 2HB SER 2 -13.662 2.006 -0.441
15 2HB SER 2 3HB SER 2 -12.540 1.317 0.745
16 HG SER 2 HG SER 2 -14.362 -0.016 0.398
17 H ILE 3 H ILE 3 -11.166 3.317 1.192
18 HA ILE 3 HA ILE 3 -10.812 6.015 0.786
19 HB ILE 3 HB ILE 3 -8.686 5.528 -0.052
20 1HG1 ILE 3 2HG1 ILE 3 -9.174 3.991 -1.890
21 2HG1 ILE 3 3HG1 ILE 3 -7.846 3.467 -0.877
22 1HG2 ILE 3 1HG2 ILE 3 -9.155 4.877 2.298
23 2HG2 ILE 3 2HG2 ILE 3 -9.331 3.191 1.799
24 3HG2 ILE 3 3HG2 ILE 3 -7.786 4.008 1.560
25 1HD1 ILE 3 1HD1 ILE 3 -9.187 1.690 0.084
26 2HD1 ILE 3 2HD1 ILE 3 -10.666 2.299 -0.703
27 3HD1 ILE 3 3HD1 ILE 3 -9.357 1.669 -1.680
28 H THR 4 H THR 4 -12.009 3.682 -1.538
29 HA THR 4 HA THR 4 -11.788 4.894 -3.949
30 HB THR 4 HB THR 4 -12.882 2.665 -3.077
31 HG1 THR 4 1HG THR 4 -12.560 3.043 -5.116
32 1HG2 THR 4 1HG2 THR 4 -14.808 3.657 -1.829
33 2HG2 THR 4 2HG2 THR 4 -15.445 4.268 -3.379
34 3HG2 THR 4 3HG2 THR 4 -15.270 2.529 -3.112
35 H ASP 5 H ASP 5 -14.122 5.632 -1.318
36 HA ASP 5 HA ASP 5 -15.459 7.645 -2.947
37 1HB ASP 5 2HB ASP 5 -16.719 5.999 -1.548
38 2HB ASP 5 3HB ASP 5 -15.967 6.704 -0.100
39 H VAL 6 H VAL 6 -12.877 8.343 -2.606
40 HA VAL 6 HA VAL 6 -13.107 10.847 -1.026
41 HB VAL 6 HB VAL 6 -10.630 9.065 -0.815
42 1HG1 VAL 6 1HG1 VAL 6 -11.450 11.662 0.551
43 2HG1 VAL 6 2HG1 VAL 6 -10.023 10.703 0.973
44 3HG1 VAL 6 3HG1 VAL 6 -10.133 11.454 -0.625
45 1HG2 VAL 6 1HG2 VAL 6 -12.420 7.991 0.476
46 2HG2 VAL 6 2HG2 VAL 6 -11.236 8.732 1.551
47 3HG2 VAL 6 3HG2 VAL 6 -12.793 9.538 1.272
48 H LEU 7 H LEU 7 -10.897 8.937 -3.051
49 HA LEU 7 HA LEU 7 -10.751 10.818 -5.221
50 1HB LEU 7 2HB LEU 7 -9.446 12.148 -3.536
51 2HB LEU 7 3HB LEU 7 -8.446 10.736 -3.218
52 HG LEU 7 HG LEU 7 -7.888 10.893 -5.816
53 1HD1 LEU 7 1HD1 LEU 7 -9.544 12.671 -6.315
54 2HD1 LEU 7 2HD1 LEU 7 -8.687 13.764 -5.203
55 3HD1 LEU 7 3HD1 LEU 7 -7.880 13.168 -6.669
56 1HD2 LEU 7 1HD2 LEU 7 -5.982 12.329 -5.285
57 2HD2 LEU 7 2HD2 LEU 7 -6.769 12.856 -3.777
58 3HD2 LEU 7 3HD2 LEU 7 -6.267 11.162 -3.988
59 H SER 8 H SER 8 -8.854 8.550 -3.244
60 HA SER 8 HA SER 8 -7.135 7.561 -4.918
61 1HB SER 8 2HB SER 8 -8.551 5.968 -2.792
62 2HB SER 8 3HB SER 8 -6.918 5.657 -3.435
63 HG SER 8 HG SER 8 -6.353 7.773 -2.732
64 H ALA 9 H ALA 9 -10.500 6.710 -5.352
65 HA ALA 9 HA ALA 9 -10.216 4.222 -6.710
66 1HB ALA 9 1HB ALA 9 -12.083 6.581 -7.299
67 2HB ALA 9 2HB ALA 9 -12.294 4.919 -7.888
68 3HB ALA 9 3HB ALA 9 -12.421 5.273 -6.157
69 H ASP 10 H ASP 10 -9.849 7.608 -7.873
70 HA ASP 10 HA ASP 10 -9.436 6.836 -10.626
71 1HB ASP 10 2HB ASP 10 -10.194 9.098 -9.745
72 2HB ASP 10 3HB ASP 10 -8.517 9.393 -9.251
73 H ASP 11 H ASP 11 -7.353 7.477 -7.837
74 HA ASP 11 HA ASP 11 -4.842 7.541 -9.183
75 1HB ASP 11 2HB ASP 11 -5.540 6.867 -6.283
76 2HB ASP 11 3HB ASP 11 -3.944 7.152 -6.937
77 H ILE 12 H ILE 12 -6.567 4.907 -7.341
78 HA ILE 12 HA ILE 12 -4.619 2.989 -7.940
79 HB ILE 12 HB ILE 12 -6.075 1.373 -7.263
80 1HG1 ILE 12 2HG1 ILE 12 -8.313 3.331 -7.134
81 2HG1 ILE 12 3HG1 ILE 12 -8.202 1.904 -8.164
82 1HG2 ILE 12 1HG2 ILE 12 -6.468 3.555 -5.228
83 2HG2 ILE 12 2HG2 ILE 12 -6.053 1.843 -5.006
84 3HG2 ILE 12 3HG2 ILE 12 -4.855 2.958 -5.652
85 1HD1 ILE 12 1HD1 ILE 12 -9.674 1.383 -6.349
86 2HD1 ILE 12 2HD1 ILE 12 -8.169 0.480 -6.090
87 3HD1 ILE 12 3HD1 ILE 12 -8.512 1.953 -5.143
88 H ALA 13 H ALA 13 -7.609 3.910 -9.682
89 HA ALA 13 HA ALA 13 -7.505 1.903 -11.661
90 1HB ALA 13 1HB ALA 13 -8.744 3.435 -13.092
91 2HB ALA 13 2HB ALA 13 -9.369 3.493 -11.433
92 3HB ALA 13 3HB ALA 13 -8.340 4.805 -12.044
93 H ALA 14 H ALA 14 -5.748 5.068 -11.568
94 HA ALA 14 HA ALA 14 -4.288 4.605 -13.998
95 1HB ALA 14 1HB ALA 14 -4.431 6.818 -12.933
96 2HB ALA 14 2HB ALA 14 -3.461 6.242 -11.561
97 3HB ALA 14 3HB ALA 14 -2.743 6.314 -13.180
98 H ALA 15 H ALA 15 -3.266 4.107 -10.585
99 HA ALA 15 HA ALA 15 -0.786 3.102 -10.874
100 1HB ALA 15 1HB ALA 15 -0.993 2.271 -8.703
101 2HB ALA 15 2HB ALA 15 -2.176 3.576 -8.744
102 3HB ALA 15 3HB ALA 15 -2.720 1.896 -8.870
103 H LEU 16 H LEU 16 -3.793 1.299 -10.938
104 HA LEU 16 HA LEU 16 -2.962 -1.319 -11.178
105 1HB LEU 16 2HB LEU 16 -5.268 -0.903 -10.794
106 2HB LEU 16 3HB LEU 16 -5.361 0.236 -12.135
107 HG LEU 16 HG LEU 16 -5.228 -1.602 -13.780
108 1HD1 LEU 16 1HD1 LEU 16 -4.069 -3.328 -12.372
109 2HD1 LEU 16 2HD1 LEU 16 -5.515 -3.428 -11.347
110 3HD1 LEU 16 3HD1 LEU 16 -5.593 -3.917 -13.052
111 1HD2 LEU 16 1HD2 LEU 16 -7.512 -2.372 -13.431
112 2HD2 LEU 16 2HD2 LEU 16 -7.457 -1.848 -11.734
113 3HD2 LEU 16 3HD2 LEU 16 -7.365 -0.651 -13.043
114 H GLN 17 H GLN 17 -3.211 1.220 -13.644
115 HA GLN 17 HA GLN 17 -2.886 -0.696 -15.842
116 1HB GLN 17 2HB GLN 17 -4.547 1.247 -15.677
117 2HB GLN 17 3HB GLN 17 -3.204 2.316 -16.070
118 1HG GLN 17 2HG GLN 17 -3.971 -0.124 -17.763
119 2HG GLN 17 3HG GLN 17 -4.783 1.435 -17.929
120 1HE2 GLN 17 1HE2 GLN 17 -3.869 0.843 -20.221
121 2HE2 GLN 17 2HE2 GLN 17 -2.327 1.608 -20.566
122 H GLU 18 H GLU 18 -1.178 2.097 -14.341
123 HA GLU 18 HA GLU 18 0.990 2.056 -16.162
124 1HB GLU 18 2HB GLU 18 1.929 3.725 -14.939
125 2HB GLU 18 3HB GLU 18 0.244 3.868 -14.439
126 1HG GLU 18 2HG GLU 18 0.835 2.618 -12.347
127 2HG GLU 18 3HG GLU 18 2.531 2.627 -12.847
128 H CYS 19 H CYS 19 0.553 0.400 -13.022
129 HA CYS 19 HA CYS 19 2.997 -1.284 -13.485
130 1HB CYS 19 2HB CYS 19 1.336 -0.651 -11.021
131 2HB CYS 19 3HB CYS 19 2.590 -1.902 -11.097
132 HG CYS 19 HG CYS 19 3.463 0.208 -9.871
133 H ARG 20 H ARG 20 1.250 -2.098 -15.335
134 HA ARG 20 HA ARG 20 -0.545 -4.110 -14.066
135 1HB ARG 20 2HB ARG 20 -1.374 -2.463 -15.755
136 2HB ARG 20 3HB ARG 20 -0.466 -3.323 -16.992
137 1HG ARG 20 2HG ARG 20 -1.873 -5.196 -16.872
138 2HG ARG 20 3HG ARG 20 -2.289 -4.919 -15.177
139 1HD ARG 20 2HD ARG 20 -3.656 -2.989 -15.734
140 2HD ARG 20 3HD ARG 20 -3.337 -3.183 -17.456
141 HE ARG 20 HE ARG 20 -5.166 -4.658 -15.721
142 1HH1 ARG 20 2HH2 ARG 20 -3.264 -4.952 -18.656
143 2HH1 ARG 20 1HH2 ARG 20 -4.283 -6.134 -19.423
144 1HH2 ARG 20 2HH1 ARG 20 -6.538 -6.276 -16.652
145 2HH2 ARG 20 1HH1 ARG 20 -6.188 -6.924 -18.221
146 H ASP 21 H ASP 21 2.608 -4.095 -15.136
147 HA ASP 21 HA ASP 21 2.496 -6.762 -16.416
148 1HB ASP 21 2HB ASP 21 4.439 -4.440 -16.414
149 2HB ASP 21 3HB ASP 21 4.972 -6.045 -16.899
150 HA PRO 22 HA PRO 22 4.037 -8.831 -12.924
151 1HB PRO 22 2HB PRO 22 5.764 -10.730 -13.878
152 2HB PRO 22 3HB PRO 22 3.994 -10.788 -14.113
153 1HG PRO 22 2HG PRO 22 6.070 -9.714 -16.044
154 2HG PRO 22 3HG PRO 22 4.755 -10.874 -16.395
155 1HD PRO 22 2HD PRO 22 4.464 -8.244 -16.941
156 2HD PRO 22 3HD PRO 22 3.100 -9.153 -16.234
157 H ASP 23 H ASP 23 5.310 -8.063 -11.450
158 HA ASP 23 HA ASP 23 7.003 -7.392 -10.219
159 1HB ASP 23 2HB ASP 23 8.782 -8.685 -12.316
160 2HB ASP 23 3HB ASP 23 9.335 -8.047 -10.768
161 H THR 24 H THR 24 5.838 -5.455 -11.361
162 HA THR 24 HA THR 24 7.950 -3.599 -12.453
163 HB THR 24 HB THR 24 5.019 -3.183 -13.062
164 HG1 THR 24 1HG THR 24 5.313 -5.147 -13.839
165 1HG2 THR 24 1HG2 THR 24 6.605 -1.344 -13.634
166 2HG2 THR 24 2HG2 THR 24 7.590 -2.498 -14.562
167 3HG2 THR 24 3HG2 THR 24 5.944 -2.108 -15.089
168 H PHE 25 H PHE 25 5.669 -4.150 -9.907
169 HA PHE 25 HA PHE 25 4.836 -1.544 -9.339
170 1HB PHE 25 2HB PHE 25 3.882 -3.684 -8.526
171 2HB PHE 25 3HB PHE 25 5.311 -3.964 -7.549
172 HD1 PHE 25 1HD PHE 25 1.983 -2.699 -7.536
173 HD2 PHE 25 2HD PHE 25 5.830 -2.240 -5.630
174 HE1 PHE 25 1HE PHE 25 0.914 -1.674 -5.554
175 HE2 PHE 25 2HE PHE 25 4.789 -0.979 -3.820
176 HZ PHE 25 HZ PHE 25 2.303 -0.720 -3.741
177 H GLU 26 H GLU 26 6.403 0.087 -9.127
178 HA GLU 26 HA GLU 26 8.657 -0.315 -7.269
179 1HB GLU 26 2HB GLU 26 7.996 1.705 -9.325
180 2HB GLU 26 3HB GLU 26 8.437 2.408 -7.763
181 1HG GLU 26 2HG GLU 26 10.496 0.765 -7.879
182 2HG GLU 26 3HG GLU 26 10.146 0.810 -9.613
183 HA PRO 27 HA PRO 27 6.147 0.932 -3.831
184 1HB PRO 27 2HB PRO 27 8.050 1.906 -2.087
185 2HB PRO 27 3HB PRO 27 7.784 0.178 -2.436
186 1HG PRO 27 2HG PRO 27 9.948 1.954 -3.550
187 2HG PRO 27 3HG PRO 27 10.035 0.242 -3.060
188 1HD PRO 27 2HD PRO 27 9.785 1.041 -5.659
189 2HD PRO 27 3HD PRO 27 9.174 -0.522 -5.035
190 H GLN 28 H GLN 28 8.749 3.415 -4.153
191 HA GLN 28 HA GLN 28 7.171 5.551 -3.318
192 1HB GLN 28 2HB GLN 28 9.677 5.436 -5.007
193 2HB GLN 28 3HB GLN 28 8.925 6.971 -4.536
194 1HG GLN 28 2HG GLN 28 9.152 6.487 -2.179
195 2HG GLN 28 3HG GLN 28 9.664 4.826 -2.503
196 1HE2 GLN 28 1HE2 GLN 28 10.665 8.267 -2.939
197 2HE2 GLN 28 2HE2 GLN 28 12.377 7.885 -2.982
198 H LYS 29 H LYS 29 7.760 4.327 -6.607
199 HA LYS 29 HA LYS 29 6.287 6.185 -8.101
200 1HB LYS 29 2HB LYS 29 7.691 4.227 -8.959
201 2HB LYS 29 3HB LYS 29 6.321 3.176 -8.576
202 1HG LYS 29 2HG LYS 29 5.875 3.589 -10.784
203 2HG LYS 29 3HG LYS 29 4.964 4.909 -10.065
204 1HD LYS 29 2HD LYS 29 7.318 6.218 -10.334
205 2HD LYS 29 3HD LYS 29 7.693 4.884 -11.418
206 1HE LYS 29 2HE LYS 29 6.821 6.677 -12.770
207 2HE LYS 29 3HE LYS 29 5.588 5.402 -12.732
208 1HZ LYS 29 1HZ LYS 29 4.673 7.602 -12.405
209 2HZ LYS 29 2HZ LYS 29 4.353 6.621 -11.151
210 3HZ LYS 29 3HZ LYS 29 5.536 7.790 -11.015
211 H PHE 30 H PHE 30 5.024 2.974 -6.956
212 HA PHE 30 HA PHE 30 2.361 3.484 -7.677
213 1HB PHE 30 2HB PHE 30 3.376 1.259 -7.141
214 2HB PHE 30 3HB PHE 30 3.364 1.685 -5.438
215 HD1 PHE 30 1HD PHE 30 1.131 2.020 -4.250
216 HD2 PHE 30 2HD PHE 30 1.386 0.522 -8.291
217 HE1 PHE 30 1HE PHE 30 -1.237 1.309 -4.144
218 HE2 PHE 30 2HE PHE 30 -0.933 -0.327 -8.116
219 HZ PHE 30 HZ PHE 30 -2.280 0.155 -6.089
220 H PHE 31 H PHE 31 4.098 4.229 -4.731
221 HA PHE 31 HA PHE 31 2.006 4.922 -2.962
222 1HB PHE 31 2HB PHE 31 4.076 4.660 -1.953
223 2HB PHE 31 3HB PHE 31 4.931 5.421 -3.276
224 HD1 PHE 31 1HD PHE 31 2.257 6.631 -0.965
225 HD2 PHE 31 2HD PHE 31 6.060 7.383 -2.864
226 HE1 PHE 31 1HE PHE 31 2.379 8.884 0.035
227 HE2 PHE 31 2HE PHE 31 6.232 9.531 -1.681
228 HZ PHE 31 HZ PHE 31 4.456 10.207 -0.089
229 H GLN 32 H GLN 32 4.022 7.071 -5.104
230 HA GLN 32 HA GLN 32 2.448 9.407 -4.477
231 1HB GLN 32 2HB GLN 32 4.277 8.736 -6.833
232 2HB GLN 32 3HB GLN 32 3.431 10.285 -6.649
233 1HG GLN 32 2HG GLN 32 4.486 10.555 -4.397
234 2HG GLN 32 3HG GLN 32 5.449 9.103 -4.720
235 1HE2 GLN 32 1HE2 GLN 32 4.774 12.448 -5.795
236 2HE2 GLN 32 2HE2 GLN 32 6.300 12.658 -6.642
237 H THR 33 H THR 33 2.387 6.975 -7.110
238 HA THR 33 HA THR 33 0.418 8.245 -8.558
239 HB THR 33 HB THR 33 2.081 5.892 -8.702
240 HG1 THR 33 1HG THR 33 0.567 6.370 -10.722
241 1HG2 THR 33 1HG2 THR 33 0.088 4.497 -8.087
242 2HG2 THR 33 2HG2 THR 33 -0.725 5.183 -9.523
243 3HG2 THR 33 3HG2 THR 33 0.771 4.233 -9.687
244 H SER 34 H SER 34 0.145 6.038 -5.850
245 HA SER 34 HA SER 34 -2.658 5.545 -6.157
246 1HB SER 34 2HB SER 34 -1.202 4.021 -4.916
247 2HB SER 34 3HB SER 34 -0.854 5.291 -3.723
248 HG SER 34 HG SER 34 -3.273 5.326 -3.508
249 H GLY 35 H GLY 35 -0.951 8.389 -5.529
250 1HA GLY 35 1HA GLY 35 -1.726 10.475 -4.970
251 2HA GLY 35 2HA GLY 35 -3.324 9.805 -4.609
252 H LEU 36 H LEU 36 -0.879 8.033 -3.000
253 HA LEU 36 HA LEU 36 -2.070 8.850 -0.544
254 1HB LEU 36 2HB LEU 36 -0.272 6.701 -1.477
255 2HB LEU 36 3HB LEU 36 0.063 7.200 0.169
256 HG LEU 36 HG LEU 36 -2.729 6.549 -0.808
257 1HD1 LEU 36 1HD1 LEU 36 -2.448 4.377 0.380
258 2HD1 LEU 36 2HD1 LEU 36 -1.358 4.529 -1.012
259 3HD1 LEU 36 3HD1 LEU 36 -0.729 4.753 0.636
260 1HD2 LEU 36 1HD2 LEU 36 -1.843 6.346 2.073
261 2HD2 LEU 36 2HD2 LEU 36 -2.160 7.955 1.427
262 3HD2 LEU 36 3HD2 LEU 36 -3.430 6.739 1.377
263 H SER 37 H SER 37 0.808 9.881 -2.240
264 HA SER 37 HA SER 37 2.132 11.266 -0.061
265 1HB SER 37 2HB SER 37 3.103 12.545 -2.018
266 2HB SER 37 3HB SER 37 3.245 10.804 -2.231
267 HG SER 37 HG SER 37 1.213 12.397 -3.391
268 H LYS 38 H LYS 38 -0.813 11.841 -1.898
269 HA LYS 38 HA LYS 38 -0.772 14.747 -1.323
270 1HB LYS 38 2HB LYS 38 -1.743 13.232 -3.538
271 2HB LYS 38 3HB LYS 38 -3.173 13.698 -2.624
272 1HG LYS 38 2HG LYS 38 -2.836 15.468 -4.131
273 2HG LYS 38 3HG LYS 38 -2.230 16.085 -2.587
274 1HD LYS 38 2HD LYS 38 0.117 15.355 -3.358
275 2HD LYS 38 3HD LYS 38 -0.617 14.952 -4.923
276 1HE LYS 38 2HE LYS 38 -1.433 17.369 -5.059
277 2HE LYS 38 3HE LYS 38 -0.511 17.705 -3.584
278 1HZ LYS 38 1HZ LYS 38 0.605 16.782 -6.152
279 2HZ LYS 38 2HZ LYS 38 0.724 18.297 -5.526
280 3HZ LYS 38 3HZ LYS 38 1.483 17.044 -4.783
281 H MET 39 H MET 39 -2.327 11.620 -0.494
282 HA MET 39 HA MET 39 -4.315 12.821 1.200
283 1HB MET 39 2HB MET 39 -2.953 10.131 1.113
284 2HB MET 39 3HB MET 39 -3.924 10.562 2.507
285 1HG MET 39 2HG MET 39 -5.829 11.143 1.030
286 2HG MET 39 3HG MET 39 -4.901 10.574 -0.369
287 1HE MET 39 1HE MET 39 -7.907 9.724 0.847
288 2HE MET 39 2HE MET 39 -7.245 9.363 -0.762
289 3HE MET 39 3HE MET 39 -7.873 8.044 0.261
290 H SER 40 H SER 40 -4.248 13.790 3.168
291 HA SER 40 HA SER 40 -1.682 14.519 4.279
292 1HB SER 40 2HB SER 40 -2.912 15.716 5.956
293 2HB SER 40 3HB SER 40 -3.697 15.995 4.402
294 HG SER 40 HG SER 40 -5.329 14.588 5.009
295 H ALA 41 H ALA 41 -0.934 14.011 6.457
296 HA ALA 41 HA ALA 41 -0.611 11.418 7.188
297 1HB ALA 41 1HB ALA 41 0.608 13.275 8.194
298 2HB ALA 41 2HB ALA 41 -0.860 13.823 9.038
299 3HB ALA 41 3HB ALA 41 -0.117 12.271 9.467
300 H ASN 42 H ASN 42 -3.379 13.434 8.046
301 HA ASN 42 HA ASN 42 -4.677 11.761 9.939
302 1HB ASN 42 2HB ASN 42 -6.153 13.465 7.884
303 2HB ASN 42 3HB ASN 42 -6.642 13.027 9.517
304 1HD2 ASN 42 1HD2 ASN 42 -4.802 15.233 7.499
305 2HD2 ASN 42 2HD2 ASN 42 -4.315 16.302 8.814
306 H GLN 43 H GLN 43 -5.182 12.104 6.403
307 HA GLN 43 HA GLN 43 -7.028 9.912 6.192
308 1HB GLN 43 2HB GLN 43 -5.377 11.511 4.193
309 2HB GLN 43 3HB GLN 43 -6.312 10.109 3.687
310 1HG GLN 43 2HG GLN 43 -7.435 12.591 5.053
311 2HG GLN 43 3HG GLN 43 -7.573 12.195 3.334
312 1HE2 GLN 43 1HE2 GLN 43 -8.237 9.419 3.440
313 2HE2 GLN 43 2HE2 GLN 43 -9.776 9.273 4.262
314 H VAL 44 H VAL 44 -3.444 10.189 5.693
315 HA VAL 44 HA VAL 44 -3.110 7.610 4.601
316 HB VAL 44 HB VAL 44 -1.335 9.378 6.359
317 1HG1 VAL 44 1HG1 VAL 44 -0.402 7.152 6.465
318 2HG1 VAL 44 2HG1 VAL 44 -0.659 6.925 4.722
319 3HG1 VAL 44 3HG1 VAL 44 0.539 8.109 5.312
320 1HG2 VAL 44 1HG2 VAL 44 -2.098 10.345 4.123
321 2HG2 VAL 44 2HG2 VAL 44 -0.360 10.157 4.283
322 3HG2 VAL 44 3HG2 VAL 44 -1.318 8.994 3.335
323 H LYS 45 H LYS 45 -3.089 8.738 8.034
324 HA LYS 45 HA LYS 45 -2.591 6.070 8.998
325 1HB LYS 45 2HB LYS 45 -1.867 8.056 10.075
326 2HB LYS 45 3HB LYS 45 -3.551 8.501 10.502
327 1HG LYS 45 2HG LYS 45 -3.719 6.704 12.045
328 2HG LYS 45 3HG LYS 45 -2.423 5.789 11.273
329 1HD LYS 45 2HD LYS 45 -1.765 6.695 13.463
330 2HD LYS 45 3HD LYS 45 -0.696 7.177 12.153
331 1HE LYS 45 2HE LYS 45 -2.935 8.961 13.247
332 2HE LYS 45 3HE LYS 45 -1.280 8.959 13.872
333 1HZ LYS 45 1HZ LYS 45 -2.105 9.754 11.163
334 2HZ LYS 45 2HZ LYS 45 -1.404 10.678 12.323
335 3HZ LYS 45 3HZ LYS 45 -0.548 9.486 11.561
336 H ASP 46 H ASP 46 -5.583 7.928 8.295
337 HA ASP 46 HA ASP 46 -7.374 6.038 9.498
338 1HB ASP 46 2HB ASP 46 -8.132 8.248 8.771
339 2HB ASP 46 3HB ASP 46 -7.811 7.830 7.078
340 H VAL 47 H VAL 47 -6.347 6.343 6.049
341 HA VAL 47 HA VAL 47 -7.533 3.996 5.174
342 HB VAL 47 HB VAL 47 -6.151 4.014 3.247
343 1HG1 VAL 47 1HG1 VAL 47 -6.401 6.963 3.774
344 2HG1 VAL 47 2HG1 VAL 47 -6.768 6.044 2.328
345 3HG1 VAL 47 3HG1 VAL 47 -7.852 5.962 3.738
346 1HG2 VAL 47 1HG2 VAL 47 -4.281 5.365 2.820
347 2HG2 VAL 47 2HG2 VAL 47 -4.319 5.951 4.489
348 3HG2 VAL 47 3HG2 VAL 47 -3.923 4.251 4.137
349 H PHE 48 H PHE 48 -4.230 4.357 6.545
350 HA PHE 48 HA PHE 48 -3.299 1.745 6.525
351 1HB PHE 48 2HB PHE 48 -1.909 3.327 7.482
352 2HB PHE 48 3HB PHE 48 -3.165 3.970 8.509
353 HD1 PHE 48 1HD PHE 48 -0.838 1.072 8.139
354 HD2 PHE 48 2HD PHE 48 -3.458 3.278 10.740
355 HE1 PHE 48 1HE PHE 48 -0.343 -0.496 10.035
356 HE2 PHE 48 2HE PHE 48 -3.185 1.543 12.501
357 HZ PHE 48 HZ PHE 48 -1.698 -0.406 12.081
358 H ARG 49 H ARG 49 -5.762 3.042 8.837
359 HA ARG 49 HA ARG 49 -6.037 0.531 10.265
360 1HB ARG 49 2HB ARG 49 -7.923 2.917 10.092
361 2HB ARG 49 3HB ARG 49 -8.054 1.577 11.236
362 1HG ARG 49 2HG ARG 49 -5.947 2.153 12.289
363 2HG ARG 49 3HG ARG 49 -5.602 3.344 11.040
364 1HD ARG 49 2HD ARG 49 -6.322 4.658 12.859
365 2HD ARG 49 3HD ARG 49 -7.603 4.659 11.666
366 HE ARG 49 HE ARG 49 -9.014 3.608 13.123
367 1HH1 ARG 49 2HH2 ARG 49 -5.726 3.094 14.225
368 2HH1 ARG 49 1HH2 ARG 49 -6.144 2.539 15.819
369 1HH2 ARG 49 2HH1 ARG 49 -9.644 2.875 15.235
370 2HH2 ARG 49 1HH1 ARG 49 -8.447 2.399 16.392
371 H PHE 50 H PHE 50 -7.531 1.982 7.400
372 HA PHE 50 HA PHE 50 -9.738 0.139 7.210
373 1HB PHE 50 2HB PHE 50 -9.341 2.403 5.959
374 2HB PHE 50 3HB PHE 50 -8.432 1.446 4.798
375 HD1 PHE 50 1HD PHE 50 -9.605 -0.147 3.298
376 HD2 PHE 50 2HD PHE 50 -11.755 2.095 6.293
377 HE1 PHE 50 1HE PHE 50 -11.745 -0.852 2.286
378 HE2 PHE 50 2HE PHE 50 -13.899 1.392 5.263
379 HZ PHE 50 HZ PHE 50 -13.903 -0.091 3.280
380 H ILE 51 H ILE 51 -6.356 0.141 6.064
381 HA ILE 51 HA ILE 51 -6.781 -2.342 4.598
382 HB ILE 51 HB ILE 51 -4.168 -0.889 5.028
383 1HG1 ILE 51 2HG1 ILE 51 -5.599 0.702 3.926
384 2HG1 ILE 51 3HG1 ILE 51 -4.521 0.021 2.740
385 1HG2 ILE 51 1HG2 ILE 51 -3.792 -2.120 2.763
386 2HG2 ILE 51 2HG2 ILE 51 -3.744 -3.110 4.234
387 3HG2 ILE 51 3HG2 ILE 51 -5.178 -3.108 3.189
388 1HD1 ILE 51 1HD1 ILE 51 -7.447 -0.738 3.154
389 2HD1 ILE 51 2HD1 ILE 51 -6.795 0.265 1.860
390 3HD1 ILE 51 3HD1 ILE 51 -6.374 -1.461 1.940
391 H ASP 52 H ASP 52 -4.890 -1.567 7.615
392 HA ASP 52 HA ASP 52 -4.322 -4.436 8.029
393 1HB ASP 52 2HB ASP 52 -2.867 -2.560 8.922
394 2HB ASP 52 3HB ASP 52 -4.126 -2.214 10.101
395 H ASN 53 H ASN 53 -6.570 -4.880 7.481
396 HA ASN 53 HA ASN 53 -8.893 -4.047 8.780
397 1HB ASN 53 2HB ASN 53 -8.960 -5.219 6.704
398 2HB ASN 53 3HB ASN 53 -8.118 -6.625 7.370
399 1HD2 ASN 53 1HD2 ASN 53 -9.283 -8.197 8.583
400 2HD2 ASN 53 2HD2 ASN 53 -11.037 -8.169 8.627
401 H ASP 54 H ASP 54 -6.594 -6.528 9.712
402 HA ASP 54 HA ASP 54 -7.977 -7.787 11.884
403 1HB ASP 54 2HB ASP 54 -5.615 -8.474 12.439
404 2HB ASP 54 3HB ASP 54 -6.114 -8.872 10.791
405 H GLN 55 H GLN 55 -6.302 -4.737 11.465
406 HA GLN 55 HA GLN 55 -5.489 -3.183 12.805
407 1HB GLN 55 2HB GLN 55 -8.152 -3.799 14.064
408 2HB GLN 55 3HB GLN 55 -7.057 -2.682 14.897
409 1HG GLN 55 2HG GLN 55 -6.802 -1.330 12.841
410 2HG GLN 55 3HG GLN 55 -7.967 -2.371 12.010
411 1HE2 GLN 55 1HE2 GLN 55 -10.162 -2.560 13.154
412 2HE2 GLN 55 2HE2 GLN 55 -10.796 -1.090 13.875
413 H SER 56 H SER 56 -3.901 -4.892 12.914
414 HA SER 56 HA SER 56 -3.250 -5.922 15.625
415 1HB SER 56 2HB SER 56 -1.219 -6.773 14.513
416 2HB SER 56 3HB SER 56 -2.698 -7.319 13.718
417 HG SER 56 HG SER 56 -2.235 -5.189 12.403
418 H GLY 57 H GLY 57 -2.266 -3.455 13.225
419 1HA GLY 57 1HA GLY 57 -1.339 -1.305 14.154
420 2HA GLY 57 2HA GLY 57 -0.359 -2.271 15.252
421 H TYR 58 H TYR 58 -0.008 -4.381 13.023
422 HA TYR 58 HA TYR 58 2.132 -2.944 11.521
423 1HB TYR 58 2HB TYR 58 2.211 -5.604 12.959
424 2HB TYR 58 3HB TYR 58 3.255 -5.263 11.592
425 HD1 TYR 58 HD1 TYR 58 2.407 -4.040 15.035
426 HD2 TYR 58 HD2 TYR 58 5.240 -4.009 11.795
427 HE1 TYR 58 HE1 TYR 58 4.046 -2.866 16.473
428 HE2 TYR 58 HE2 TYR 58 6.860 -2.783 13.215
429 HH TYR 58 HH TYR 58 6.149 -1.899 16.597
430 H LEU 59 H LEU 59 2.288 -3.327 9.381
431 HA LEU 59 HA LEU 59 0.295 -5.154 8.108
432 1HB LEU 59 2HB LEU 59 2.233 -3.102 7.002
433 2HB LEU 59 3HB LEU 59 1.458 -4.329 6.001
434 HG LEU 59 HG LEU 59 0.317 -2.192 5.863
435 1HD1 LEU 59 1HD1 LEU 59 -0.969 -4.285 5.493
436 2HD1 LEU 59 2HD1 LEU 59 -1.491 -4.254 7.197
437 3HD1 LEU 59 3HD1 LEU 59 -1.963 -2.952 6.106
438 1HD2 LEU 59 1HD2 LEU 59 -0.491 -2.576 8.766
439 2HD2 LEU 59 2HD2 LEU 59 0.728 -1.412 8.178
440 3HD2 LEU 59 3HD2 LEU 59 -0.974 -1.275 7.669
441 H ASP 60 H ASP 60 1.269 -6.846 9.384
442 HA ASP 60 HA ASP 60 3.775 -8.002 8.929
443 1HB ASP 60 2HB ASP 60 1.288 -9.712 9.091
444 2HB ASP 60 3HB ASP 60 2.863 -9.935 9.869
445 H GLU 61 H GLU 61 4.383 -9.802 7.445
446 HA GLU 61 HA GLU 61 4.080 -9.251 4.783
447 1HB GLU 61 2HB GLU 61 4.837 -11.817 6.229
448 2HB GLU 61 3HB GLU 61 4.659 -11.807 4.472
449 1HG GLU 61 2HG GLU 61 6.180 -9.934 4.255
450 2HG GLU 61 3HG GLU 61 6.465 -9.899 6.014
451 H GLU 62 H GLU 62 2.190 -11.891 6.369
452 HA GLU 62 HA GLU 62 0.488 -12.320 4.241
453 1HB GLU 62 2HB GLU 62 0.461 -12.780 7.214
454 2HB GLU 62 3HB GLU 62 -1.155 -12.692 6.525
455 1HG GLU 62 2HG GLU 62 -0.219 -15.006 6.655
456 2HG GLU 62 3HG GLU 62 -0.748 -14.507 5.044
457 H GLU 63 H GLU 63 0.175 -9.512 6.459
458 HA GLU 63 HA GLU 63 -2.515 -8.962 5.433
459 1HB GLU 63 2HB GLU 63 -0.598 -7.530 7.223
460 2HB GLU 63 3HB GLU 63 -1.596 -6.508 6.174
461 1HG GLU 63 2HG GLU 63 -2.859 -6.817 8.163
462 2HG GLU 63 3HG GLU 63 -3.651 -7.747 6.913
463 H LEU 64 H LEU 64 0.820 -8.215 4.511
464 HA LEU 64 HA LEU 64 -0.036 -6.665 2.165
465 1HB LEU 64 2HB LEU 64 2.663 -7.919 2.737
466 2HB LEU 64 3HB LEU 64 2.281 -6.697 1.521
467 HG LEU 64 HG LEU 64 2.082 -6.258 4.531
468 1HD1 LEU 64 1HD1 LEU 64 4.095 -4.920 4.229
469 2HD1 LEU 64 2HD1 LEU 64 4.381 -6.594 3.717
470 3HD1 LEU 64 3HD1 LEU 64 4.140 -5.321 2.496
471 1HD2 LEU 64 1HD2 LEU 64 1.734 -4.397 2.126
472 2HD2 LEU 64 2HD2 LEU 64 0.524 -4.775 3.374
473 3HD2 LEU 64 3HD2 LEU 64 1.961 -3.828 3.787
474 H LYS 65 H LYS 65 -0.786 -9.788 2.763
475 HA LYS 65 HA LYS 65 -0.433 -10.538 -0.096
476 1HB LYS 65 2HB LYS 65 0.032 -12.146 1.829
477 2HB LYS 65 3HB LYS 65 -1.720 -12.132 2.128
478 1HG LYS 65 2HG LYS 65 -2.201 -13.200 0.065
479 2HG LYS 65 3HG LYS 65 -0.604 -12.816 -0.598
480 1HD LYS 65 2HD LYS 65 -0.656 -15.172 -0.012
481 2HD LYS 65 3HD LYS 65 0.490 -14.300 1.014
482 1HE LYS 65 2HE LYS 65 -1.361 -14.192 2.801
483 2HE LYS 65 3HE LYS 65 -2.298 -15.294 1.781
484 1HZ LYS 65 1HZ LYS 65 0.346 -15.766 3.028
485 2HZ LYS 65 2HZ LYS 65 -1.048 -16.440 3.480
486 3HZ LYS 65 3HZ LYS 65 -0.387 -16.851 2.021
487 H PHE 66 H PHE 66 -2.398 -8.579 1.807
488 HA PHE 66 HA PHE 66 -4.587 -8.809 -0.133
489 1HB PHE 66 2HB PHE 66 -4.970 -8.959 2.894
490 2HB PHE 66 3HB PHE 66 -6.271 -8.843 1.719
491 HD1 PHE 66 1HD PHE 66 -3.919 -11.101 3.374
492 HD2 PHE 66 2HD PHE 66 -6.862 -10.756 0.236
493 HE1 PHE 66 1HE PHE 66 -4.123 -13.562 3.288
494 HE2 PHE 66 2HE PHE 66 -7.035 -13.221 0.129
495 HZ PHE 66 HZ PHE 66 -5.668 -14.634 1.649
496 H PHE 67 H PHE 67 -2.515 -6.730 0.325
497 HA PHE 67 HA PHE 67 -3.632 -4.600 1.921
498 1HB PHE 67 2HB PHE 67 -1.311 -4.698 1.641
499 2HB PHE 67 3HB PHE 67 -1.387 -4.793 -0.087
500 HD1 PHE 67 1HD PHE 67 -1.207 -2.965 -1.477
501 HD2 PHE 67 2HD PHE 67 -1.515 -2.457 2.763
502 HE1 PHE 67 1HE PHE 67 -0.943 -0.514 -1.770
503 HE2 PHE 67 2HE PHE 67 -1.233 -0.008 2.501
504 HZ PHE 67 HZ PHE 67 -0.982 0.980 0.222
505 H LEU 68 H LEU 68 -3.196 -4.524 -1.700
506 HA LEU 68 HA LEU 68 -5.328 -2.667 -2.036
507 1HB LEU 68 2HB LEU 68 -3.888 -4.484 -3.954
508 2HB LEU 68 3HB LEU 68 -5.121 -3.320 -4.479
509 HG LEU 68 HG LEU 68 -2.834 -2.366 -2.787
510 1HD1 LEU 68 1HD1 LEU 68 -1.465 -1.951 -4.733
511 2HD1 LEU 68 2HD1 LEU 68 -1.820 -3.678 -4.646
512 3HD1 LEU 68 3HD1 LEU 68 -2.696 -2.657 -5.809
513 1HD2 LEU 68 1HD2 LEU 68 -4.747 -0.849 -3.268
514 2HD2 LEU 68 2HD2 LEU 68 -3.220 -0.260 -3.917
515 3HD2 LEU 68 3HD2 LEU 68 -4.415 -1.010 -5.001
516 H GLN 69 H GLN 69 -5.524 -6.081 -1.505
517 HA GLN 69 HA GLN 69 -7.896 -6.644 -2.973
518 1HB GLN 69 2HB GLN 69 -6.853 -7.798 -0.378
519 2HB GLN 69 3HB GLN 69 -8.276 -8.429 -1.203
520 1HG GLN 69 2HG GLN 69 -5.573 -8.192 -2.576
521 2HG GLN 69 3HG GLN 69 -6.068 -9.643 -1.698
522 1HE2 GLN 69 1HE2 GLN 69 -5.366 -9.302 -4.608
523 2HE2 GLN 69 2HE2 GLN 69 -6.769 -9.967 -5.386
524 H LYS 70 H LYS 70 -7.450 -4.887 0.116
525 HA LYS 70 HA LYS 70 -10.393 -4.742 0.495
526 1HB LYS 70 2HB LYS 70 -8.086 -3.559 2.083
527 2HB LYS 70 3HB LYS 70 -9.790 -3.206 2.363
528 1HG LYS 70 2HG LYS 70 -9.407 -4.830 3.909
529 2HG LYS 70 3HG LYS 70 -10.194 -5.719 2.597
530 1HD LYS 70 2HD LYS 70 -7.908 -6.512 1.846
531 2HD LYS 70 3HD LYS 70 -7.183 -5.525 3.118
532 1HE LYS 70 2HE LYS 70 -7.167 -7.714 3.977
533 2HE LYS 70 3HE LYS 70 -8.481 -6.893 4.823
534 1HZ LYS 70 1HZ LYS 70 -8.769 -8.738 2.537
535 2HZ LYS 70 2HZ LYS 70 -9.130 -9.070 4.103
536 3HZ LYS 70 3HZ LYS 70 -10.018 -7.959 3.276
537 H PHE 71 H PHE 71 -8.081 -3.068 -1.421
538 HA PHE 71 HA PHE 71 -9.567 -0.520 -1.370
539 1HB PHE 71 2HB PHE 71 -7.311 -1.563 -3.134
540 2HB PHE 71 3HB PHE 71 -8.251 -0.154 -3.525
541 HD1 PHE 71 1HD PHE 71 -7.267 1.884 -3.084
542 HD2 PHE 71 2HD PHE 71 -6.390 -1.427 -0.465
543 HE1 PHE 71 1HE PHE 71 -5.298 3.096 -2.217
544 HE2 PHE 71 2HE PHE 71 -4.378 -0.237 0.349
545 HZ PHE 71 HZ PHE 71 -3.847 2.044 -0.496
546 H GLU 72 H GLU 72 -8.975 -3.250 -3.597
547 HA GLU 72 HA GLU 72 -11.441 -2.489 -5.131
548 1HB GLU 72 2HB GLU 72 -9.269 -2.011 -6.240
549 2HB GLU 72 3HB GLU 72 -8.848 -3.725 -6.160
550 1HG GLU 72 2HG GLU 72 -9.693 -3.200 -8.368
551 2HG GLU 72 3HG GLU 72 -10.884 -4.230 -7.566
552 H SER 73 H SER 73 -9.281 -5.317 -4.725
553 HA SER 73 HA SER 73 -9.880 -7.430 -3.943
554 1HB SER 73 2HB SER 73 -12.265 -6.894 -3.472
555 2HB SER 73 3HB SER 73 -12.626 -7.157 -5.197
556 HG SER 73 HG SER 73 -11.916 -9.285 -4.950
557 H GLY 74 H GLY 74 -8.741 -8.698 -5.157
558 1HA GLY 74 1HA GLY 74 -8.110 -9.998 -7.029
559 2HA GLY 74 2HA GLY 74 -9.182 -9.061 -8.073
560 H ALA 75 H ALA 75 -6.940 -7.479 -5.866
561 HA ALA 75 HA ALA 75 -5.461 -6.279 -8.129
562 1HB ALA 75 1HB ALA 75 -4.541 -4.811 -6.369
563 2HB ALA 75 2HB ALA 75 -6.314 -4.818 -6.355
564 3HB ALA 75 3HB ALA 75 -5.419 -5.759 -5.140
565 H ARG 76 H ARG 76 -3.074 -5.963 -7.587
566 HA ARG 76 HA ARG 76 -1.828 -8.276 -8.295
567 1HB ARG 76 2HB ARG 76 -1.151 -5.754 -8.453
568 2HB ARG 76 3HB ARG 76 -0.361 -6.029 -6.904
569 1HG ARG 76 2HG ARG 76 1.355 -6.344 -8.399
570 2HG ARG 76 3HG ARG 76 0.906 -7.997 -8.100
571 1HD ARG 76 2HD ARG 76 0.320 -8.387 -10.230
572 2HD ARG 76 3HD ARG 76 -0.642 -6.922 -10.382
573 HE ARG 76 HE ARG 76 2.226 -7.284 -11.028
574 1HH1 ARG 76 2HH2 ARG 76 -0.026 -4.902 -9.860
575 2HH1 ARG 76 1HH2 ARG 76 0.641 -3.623 -10.848
576 1HH2 ARG 76 2HH1 ARG 76 3.322 -5.626 -11.996
577 2HH2 ARG 76 1HH1 ARG 76 2.900 -3.960 -11.641
578 H GLU 77 H GLU 77 -2.592 -7.586 -5.043
579 HA GLU 77 HA GLU 77 -0.557 -8.128 -3.391
580 1HB GLU 77 2HB GLU 77 -3.359 -9.375 -3.206
581 2HB GLU 77 3HB GLU 77 -2.201 -9.140 -1.893
582 1HG GLU 77 2HG GLU 77 -3.522 -6.855 -3.450
583 2HG GLU 77 3HG GLU 77 -3.832 -7.368 -1.789
584 H LEU 78 H LEU 78 -2.320 -10.638 -5.091
585 HA LEU 78 HA LEU 78 -1.232 -12.938 -3.972
586 1HB LEU 78 2HB LEU 78 -1.757 -12.588 -6.949
587 2HB LEU 78 3HB LEU 78 -1.688 -14.083 -6.028
588 HG LEU 78 HG LEU 78 -3.921 -13.828 -6.312
589 1HD1 LEU 78 1HD1 LEU 78 -3.443 -14.109 -3.881
590 2HD1 LEU 78 2HD1 LEU 78 -3.575 -12.349 -3.656
591 3HD1 LEU 78 3HD1 LEU 78 -4.981 -13.279 -4.188
592 1HD2 LEU 78 1HD2 LEU 78 -5.231 -11.932 -6.464
593 2HD2 LEU 78 2HD2 LEU 78 -4.119 -10.932 -5.536
594 3HD2 LEU 78 3HD2 LEU 78 -3.711 -11.400 -7.202
595 H THR 79 H THR 79 0.378 -10.827 -6.433
596 HA THR 79 HA THR 79 2.568 -12.687 -6.782
597 HB THR 79 HB THR 79 2.534 -9.723 -7.377
598 HG1 THR 79 1HG THR 79 2.384 -10.903 -9.535
599 1HG2 THR 79 1HG2 THR 79 4.345 -10.432 -9.028
600 2HG2 THR 79 2HG2 THR 79 4.814 -10.815 -7.374
601 3HG2 THR 79 3HG2 THR 79 4.201 -12.087 -8.432
602 H GLU 80 H GLU 80 3.833 -13.145 -5.197
603 HA GLU 80 HA GLU 80 4.198 -11.656 -2.817
604 1HB GLU 80 2HB GLU 80 6.097 -13.762 -3.928
605 2HB GLU 80 3HB GLU 80 5.923 -13.192 -2.258
606 1HG GLU 80 2HG GLU 80 4.676 -15.120 -2.144
607 2HG GLU 80 3HG GLU 80 3.397 -13.968 -2.538
608 H SER 81 H SER 81 6.267 -11.835 -5.791
609 HA SER 81 HA SER 81 8.371 -10.249 -5.021
610 1HB SER 81 2HB SER 81 7.016 -10.022 -7.725
611 2HB SER 81 3HB SER 81 8.739 -9.907 -7.368
612 HG SER 81 HG SER 81 8.059 -11.919 -8.253
613 H GLU 82 H GLU 82 5.294 -9.061 -6.516
614 HA GLU 82 HA GLU 82 6.122 -6.333 -6.540
615 1HB GLU 82 2HB GLU 82 3.287 -7.391 -6.638
616 2HB GLU 82 3HB GLU 82 3.873 -5.868 -7.295
617 1HG GLU 82 2HG GLU 82 5.346 -8.173 -8.474
618 2HG GLU 82 3HG GLU 82 3.596 -8.333 -8.622
619 H THR 83 H THR 83 4.184 -8.335 -4.312
620 HA THR 83 HA THR 83 3.404 -6.357 -2.411
621 HB THR 83 HB THR 83 3.735 -9.341 -2.525
622 HG1 THR 83 1HG THR 83 1.781 -8.280 -1.055
623 1HG2 THR 83 1HG2 THR 83 3.260 -9.600 -0.103
624 2HG2 THR 83 2HG2 THR 83 4.915 -9.098 -0.421
625 3HG2 THR 83 3HG2 THR 83 3.725 -7.906 0.155
626 H LYS 84 H LYS 84 6.291 -8.442 -2.668
627 HA LYS 84 HA LYS 84 7.380 -7.375 -0.282
628 1HB LYS 84 2HB LYS 84 7.682 -9.673 -1.142
629 2HB LYS 84 3HB LYS 84 8.787 -9.069 -2.389
630 1HG LYS 84 2HG LYS 84 10.462 -8.676 -0.857
631 2HG LYS 84 3HG LYS 84 9.322 -8.164 0.394
632 1HD LYS 84 2HD LYS 84 8.614 -10.500 0.770
633 2HD LYS 84 3HD LYS 84 9.825 -11.069 -0.394
634 1HE LYS 84 2HE LYS 84 11.622 -10.589 1.054
635 2HE LYS 84 3HE LYS 84 10.744 -9.332 1.914
636 1HZ LYS 84 1HZ LYS 84 10.237 -12.223 2.210
637 2HZ LYS 84 2HZ LYS 84 10.940 -11.229 3.314
638 3HZ LYS 84 3HZ LYS 84 9.367 -11.067 2.950
639 H SER 85 H SER 85 7.643 -6.412 -3.643
640 HA SER 85 HA SER 85 9.808 -4.564 -3.354
641 1HB SER 85 2HB SER 85 7.385 -4.357 -5.195
642 2HB SER 85 3HB SER 85 8.923 -3.506 -5.354
643 HG SER 85 HG SER 85 8.579 -6.341 -5.399
644 H LEU 86 H LEU 86 6.252 -4.272 -2.759
645 HA LEU 86 HA LEU 86 6.373 -1.561 -1.776
646 1HB LEU 86 2HB LEU 86 4.311 -3.100 -2.372
647 2HB LEU 86 3HB LEU 86 4.409 -3.593 -0.686
648 HG LEU 86 HG LEU 86 3.992 -0.764 -1.740
649 1HD1 LEU 86 1HD1 LEU 86 1.781 -0.976 -0.761
650 2HD1 LEU 86 2HD1 LEU 86 2.041 -2.329 -1.877
651 3HD1 LEU 86 3HD1 LEU 86 2.165 -2.589 -0.127
652 1HD2 LEU 86 1HD2 LEU 86 5.262 -0.498 0.264
653 2HD2 LEU 86 2HD2 LEU 86 3.577 -0.164 0.654
654 3HD2 LEU 86 3HD2 LEU 86 4.289 -1.721 1.127
655 H MET 87 H MET 87 6.187 -4.684 0.052
656 HA MET 87 HA MET 87 6.687 -3.719 2.527
657 1HB MET 87 2HB MET 87 6.329 -6.181 1.804
658 2HB MET 87 3HB MET 87 8.097 -6.263 1.656
659 1HG MET 87 2HG MET 87 8.226 -5.365 4.059
660 2HG MET 87 3HG MET 87 6.462 -5.491 4.076
661 1HE MET 87 1HE MET 87 9.018 -8.163 2.700
662 2HE MET 87 2HE MET 87 9.818 -7.346 4.070
663 3HE MET 87 3HE MET 87 9.303 -9.044 4.228
664 H ALA 88 H ALA 88 9.247 -4.577 0.214
665 HA ALA 88 HA ALA 88 11.503 -4.384 1.784
666 1HB ALA 88 1HB ALA 88 11.593 -5.301 -0.446
667 2HB ALA 88 2HB ALA 88 11.083 -3.767 -1.173
668 3HB ALA 88 3HB ALA 88 12.684 -3.909 -0.406
669 H ALA 89 H ALA 89 9.786 -1.707 0.157
670 HA ALA 89 HA ALA 89 11.826 0.246 1.115
671 1HB ALA 89 1HB ALA 89 9.372 0.510 -0.632
672 2HB ALA 89 2HB ALA 89 10.452 1.856 -0.186
673 3HB ALA 89 3HB ALA 89 11.088 0.503 -1.143
674 H ALA 90 H ALA 90 8.420 -0.716 1.646
675 HA ALA 90 HA ALA 90 7.673 1.441 3.365
676 1HB ALA 90 1HB ALA 90 6.112 -0.304 2.394
677 2HB ALA 90 2HB ALA 90 6.876 -1.507 3.433
678 3HB ALA 90 3HB ALA 90 5.959 -0.174 4.168
679 H ASP 91 H ASP 91 9.279 -1.679 4.057
680 HA ASP 91 HA ASP 91 9.413 -1.220 6.884
681 1HB ASP 91 2HB ASP 91 9.682 -3.500 6.113
682 2HB ASP 91 3HB ASP 91 10.986 -3.021 5.005
683 H ASN 92 H ASN 92 10.699 0.277 7.857
684 HA ASN 92 HA ASN 92 13.091 1.303 6.330
685 1HB ASN 92 2HB ASN 92 12.958 3.350 7.472
686 2HB ASN 92 3HB ASN 92 11.394 2.988 6.737
687 1HD2 ASN 92 1HD2 ASN 92 10.722 4.727 8.242
688 2HD2 ASN 92 2HD2 ASN 92 10.279 4.260 9.892
689 H ASP 93 H ASP 93 12.615 -1.105 8.397
690 HA ASP 93 HA ASP 93 14.933 -0.454 10.183
691 1HB ASP 93 2HB ASP 93 13.123 -2.881 10.050
692 2HB ASP 93 3HB ASP 93 14.485 -2.686 11.144
693 H GLY 94 H GLY 94 13.829 -2.919 7.766
694 1HA GLY 94 1HA GLY 94 15.262 -4.255 6.406
695 2HA GLY 94 2HA GLY 94 16.627 -3.943 7.492
696 H ASP 95 H ASP 95 13.202 -4.808 7.982
697 HA ASP 95 HA ASP 95 13.921 -7.369 9.269
698 1HB ASP 95 2HB ASP 95 12.231 -7.089 11.001
699 2HB ASP 95 3HB ASP 95 13.602 -5.998 11.161
700 H GLY 96 H GLY 96 11.034 -5.465 8.436
701 1HA GLY 96 1HA GLY 96 10.018 -6.319 6.199
702 2HA GLY 96 2HA GLY 96 9.809 -7.846 7.084
703 H LYS 97 H LYS 97 9.126 -7.013 9.607
704 HA LYS 97 HA LYS 97 6.408 -6.344 9.450
705 1HB LYS 97 2HB LYS 97 6.438 -6.122 11.829
706 2HB LYS 97 3HB LYS 97 7.522 -7.435 11.375
707 1HG LYS 97 2HG LYS 97 9.450 -5.834 11.615
708 2HG LYS 97 3HG LYS 97 8.316 -4.628 12.250
709 1HD LYS 97 2HD LYS 97 7.641 -6.325 14.003
710 2HD LYS 97 3HD LYS 97 8.990 -7.341 13.485
711 1HE LYS 97 2HE LYS 97 9.324 -4.429 14.397
712 2HE LYS 97 3HE LYS 97 9.330 -5.781 15.535
713 1HZ LYS 97 1HZ LYS 97 11.541 -5.129 14.888
714 2HZ LYS 97 2HZ LYS 97 11.255 -6.668 14.371
715 3HZ LYS 97 3HZ LYS 97 11.227 -5.398 13.325
716 H ILE 98 H ILE 98 5.334 -4.472 9.145
717 HA ILE 98 HA ILE 98 6.806 -1.862 9.071
718 HB ILE 98 HB ILE 98 4.708 -3.152 7.347
719 1HG1 ILE 98 2HG1 ILE 98 7.031 -1.513 6.359
720 2HG1 ILE 98 3HG1 ILE 98 7.437 -3.041 7.138
721 1HG2 ILE 98 1HG2 ILE 98 4.442 -1.047 6.096
722 2HG2 ILE 98 2HG2 ILE 98 3.786 -0.890 7.719
723 3HG2 ILE 98 3HG2 ILE 98 5.362 -0.174 7.324
724 1HD1 ILE 98 1HD1 ILE 98 7.162 -3.398 4.788
725 2HD1 ILE 98 2HD1 ILE 98 5.897 -4.252 5.715
726 3HD1 ILE 98 3HD1 ILE 98 5.491 -2.768 4.822
727 H GLY 99 H GLY 99 6.295 -0.851 10.948
728 1HA GLY 99 1HA GLY 99 3.710 -1.081 12.250
729 2HA GLY 99 2HA GLY 99 4.932 0.173 12.525
730 H ALA 100 H ALA 100 2.139 0.712 12.445
731 HA ALA 100 HA ALA 100 1.203 1.969 10.104
732 1HB ALA 100 1HB ALA 100 1.025 3.136 12.922
733 2HB ALA 100 2HB ALA 100 -0.118 3.330 11.574
734 3HB ALA 100 3HB ALA 100 0.046 1.764 12.398
735 H GLU 101 H GLU 101 3.572 2.937 12.530
736 HA GLU 101 HA GLU 101 4.000 5.556 11.702
737 1HB GLU 101 2HB GLU 101 4.699 4.377 13.853
738 2HB GLU 101 3HB GLU 101 6.109 3.751 12.986
739 1HG GLU 101 2HG GLU 101 6.947 6.003 12.657
740 2HG GLU 101 3HG GLU 101 5.407 6.715 13.180
741 H GLU 102 H GLU 102 5.898 2.588 10.876
742 HA GLU 102 HA GLU 102 7.613 3.682 8.945
743 1HB GLU 102 2HB GLU 102 6.359 0.902 8.985
744 2HB GLU 102 3HB GLU 102 7.787 1.405 8.070
745 1HG GLU 102 2HG GLU 102 8.897 1.975 10.266
746 2HG GLU 102 3HG GLU 102 7.529 1.238 11.107
747 H PHE 103 H PHE 103 4.307 2.332 8.540
748 HA PHE 103 HA PHE 103 4.119 2.704 5.747
749 1HB PHE 103 2HB PHE 103 2.510 1.403 7.024
750 2HB PHE 103 3HB PHE 103 1.911 2.852 7.818
751 HD1 PHE 103 1HD PHE 103 0.230 4.220 6.786
752 HD2 PHE 103 2HD PHE 103 2.342 1.299 4.421
753 HE1 PHE 103 1HE PHE 103 -1.453 4.464 4.980
754 HE2 PHE 103 2HE PHE 103 0.732 1.636 2.572
755 HZ PHE 103 HZ PHE 103 -1.215 3.163 2.873
756 H GLN 104 H GLN 104 2.978 4.998 8.317
757 HA GLN 104 HA GLN 104 2.284 7.128 6.518
758 1HB GLN 104 2HB GLN 104 1.672 6.894 8.987
759 2HB GLN 104 3HB GLN 104 3.300 7.508 9.348
760 1HG GLN 104 2HG GLN 104 2.770 9.501 7.859
761 2HG GLN 104 3HG GLN 104 1.133 8.876 7.670
762 1HE2 GLN 104 1HE2 GLN 104 2.887 11.123 9.310
763 2HE2 GLN 104 2HE2 GLN 104 1.904 11.288 10.747
764 H GLU 105 H GLU 105 5.418 6.200 8.013
765 HA GLU 105 HA GLU 105 6.862 8.485 7.276
766 1HB GLU 105 2HB GLU 105 7.552 6.583 8.810
767 2HB GLU 105 3HB GLU 105 8.019 5.659 7.373
768 1HG GLU 105 2HG GLU 105 9.124 8.457 7.703
769 2HG GLU 105 3HG GLU 105 9.727 7.175 8.757
770 H MET 106 H MET 106 6.694 5.333 5.448
771 HA MET 106 HA MET 106 8.018 6.434 3.168
772 1HB MET 106 2HB MET 106 7.181 4.617 1.852
773 2HB MET 106 3HB MET 106 7.859 4.037 3.370
774 1HG MET 106 2HG MET 106 5.765 3.455 4.246
775 2HG MET 106 3HG MET 106 4.876 4.445 3.095
776 1HE MET 106 1HE MET 106 4.355 3.926 0.614
777 2HE MET 106 2HE MET 106 6.057 3.588 0.202
778 3HE MET 106 3HE MET 106 4.804 2.390 -0.167
779 H VAL 107 H VAL 107 4.563 6.302 4.063
780 HA VAL 107 HA VAL 107 3.695 7.351 1.585
781 HB VAL 107 HB VAL 107 2.304 6.981 4.233
782 1HG1 VAL 107 1HG1 VAL 107 1.260 8.127 1.644
783 2HG1 VAL 107 2HG1 VAL 107 0.199 7.369 2.810
784 3HG1 VAL 107 3HG1 VAL 107 1.134 8.817 3.256
785 1HG2 VAL 107 1HG2 VAL 107 2.785 4.901 2.948
786 2HG2 VAL 107 2HG2 VAL 107 1.066 5.256 2.940
787 3HG2 VAL 107 3HG2 VAL 107 2.043 5.617 1.506
788 H HIS 108 H HIS 108 5.090 8.993 4.335
789 HA HIS 108 HA HIS 108 3.863 11.526 3.717
790 1HB HIS 108 2HB HIS 108 4.754 10.964 5.944
791 2HB HIS 108 3HB HIS 108 6.378 10.762 5.280
792 HD1 HIS 108 1HD HIS 108 5.065 13.856 3.835
793 HD2 HIS 108 2HD HIS 108 6.893 12.560 7.382
794 HE1 HIS 108 1HE HIS 108 5.889 15.961 5.042
795 H SER 109 H SER 109 6.430 9.685 2.323
796 HA SER 109 HA SER 109 8.381 11.552 1.836
797 1HB SER 109 2HB SER 109 8.554 9.083 1.654
798 2HB SER 109 3HB SER 109 7.704 9.145 0.104
799 HG SER 109 HG SER 109 9.948 10.772 0.438
Start of MODEL 13
1 1H MET 1 H1 MET 1 -17.837 4.673 5.093
2 2H MET 1 H2 MET 1 -19.023 5.680 4.506
3 3H MET 1 H3 MET 1 -19.011 4.047 4.146
4 HA MET 1 HA MET 1 -18.102 4.984 2.212
5 1HB MET 1 2HB MET 1 -16.193 6.581 3.967
6 2HB MET 1 3HB MET 1 -16.469 6.710 2.227
7 1HG MET 1 2HG MET 1 -17.524 8.583 3.143
8 2HG MET 1 3HG MET 1 -18.845 7.473 2.778
9 1HE MET 1 1HE MET 1 -20.527 8.834 4.346
10 2HE MET 1 2HE MET 1 -20.111 9.336 6.005
11 3HE MET 1 3HE MET 1 -19.212 10.004 4.624
12 H SER 2 H SER 2 -15.733 4.766 1.449
13 HA SER 2 HA SER 2 -13.857 3.575 3.200
14 1HB SER 2 2HB SER 2 -14.858 1.449 2.573
15 2HB SER 2 3HB SER 2 -14.860 1.884 0.854
16 HG SER 2 HG SER 2 -13.048 0.541 1.595
17 H ILE 3 H ILE 3 -11.915 3.136 1.482
18 HA ILE 3 HA ILE 3 -11.127 5.771 0.774
19 HB ILE 3 HB ILE 3 -9.111 4.747 -0.097
20 1HG1 ILE 3 2HG1 ILE 3 -9.148 2.070 0.192
21 2HG1 ILE 3 3HG1 ILE 3 -10.821 2.253 -0.322
22 1HG2 ILE 3 1HG2 ILE 3 -10.071 3.102 2.273
23 2HG2 ILE 3 2HG2 ILE 3 -8.420 3.607 1.883
24 3HG2 ILE 3 3HG2 ILE 3 -9.620 4.817 2.378
25 1HD1 ILE 3 1HD1 ILE 3 -9.411 1.814 -2.243
26 2HD1 ILE 3 2HD1 ILE 3 -9.931 3.490 -2.380
27 3HD1 ILE 3 3HD1 ILE 3 -8.292 3.108 -1.788
28 H THR 4 H THR 4 -12.728 3.271 -1.133
29 HA THR 4 HA THR 4 -12.421 4.192 -3.691
30 HB THR 4 HB THR 4 -13.392 2.054 -2.722
31 HG1 THR 4 1HG THR 4 -13.407 2.673 -4.770
32 1HG2 THR 4 1HG2 THR 4 -16.045 3.531 -2.593
33 2HG2 THR 4 2HG2 THR 4 -15.711 1.829 -2.239
34 3HG2 THR 4 3HG2 THR 4 -15.087 3.088 -1.159
35 H ASP 5 H ASP 5 -14.574 5.295 -1.097
36 HA ASP 5 HA ASP 5 -16.024 7.193 -2.852
37 1HB ASP 5 2HB ASP 5 -17.275 5.485 -1.564
38 2HB ASP 5 3HB ASP 5 -16.535 6.074 -0.064
39 H VAL 6 H VAL 6 -13.352 7.763 -2.280
40 HA VAL 6 HA VAL 6 -13.602 10.293 -0.721
41 HB VAL 6 HB VAL 6 -11.317 8.274 -0.482
42 1HG1 VAL 6 1HG1 VAL 6 -10.344 9.854 1.139
43 2HG1 VAL 6 2HG1 VAL 6 -10.417 10.560 -0.478
44 3HG1 VAL 6 3HG1 VAL 6 -11.608 11.041 0.750
45 1HG2 VAL 6 1HG2 VAL 6 -13.300 9.295 1.591
46 2HG2 VAL 6 2HG2 VAL 6 -13.276 7.670 0.880
47 3HG2 VAL 6 3HG2 VAL 6 -11.935 8.197 1.902
48 H LEU 7 H LEU 7 -11.376 8.379 -2.728
49 HA LEU 7 HA LEU 7 -11.271 10.218 -4.926
50 1HB LEU 7 2HB LEU 7 -10.000 11.687 -3.493
51 2HB LEU 7 3HB LEU 7 -9.052 10.354 -2.851
52 HG LEU 7 HG LEU 7 -8.612 10.384 -5.714
53 1HD1 LEU 7 1HD1 LEU 7 -8.262 13.119 -4.437
54 2HD1 LEU 7 2HD1 LEU 7 -7.662 12.607 -6.028
55 3HD1 LEU 7 3HD1 LEU 7 -9.408 12.701 -5.732
56 1HD2 LEU 7 1HD2 LEU 7 -6.786 11.317 -3.474
57 2HD2 LEU 7 2HD2 LEU 7 -7.045 9.612 -3.914
58 3HD2 LEU 7 3HD2 LEU 7 -6.313 10.729 -5.077
59 H SER 8 H SER 8 -9.428 7.915 -2.932
60 HA SER 8 HA SER 8 -7.713 7.005 -4.668
61 1HB SER 8 2HB SER 8 -9.082 5.613 -2.360
62 2HB SER 8 3HB SER 8 -7.769 4.819 -3.263
63 HG SER 8 HG SER 8 -6.440 6.445 -2.848
64 H ALA 9 H ALA 9 -11.050 6.099 -5.077
65 HA ALA 9 HA ALA 9 -10.757 3.763 -6.658
66 1HB ALA 9 1HB ALA 9 -12.631 6.149 -6.972
67 2HB ALA 9 2HB ALA 9 -12.816 4.590 -7.808
68 3HB ALA 9 3HB ALA 9 -12.947 4.667 -6.041
69 H ASP 10 H ASP 10 -10.209 7.210 -7.495
70 HA ASP 10 HA ASP 10 -9.662 6.703 -10.300
71 1HB ASP 10 2HB ASP 10 -10.395 8.897 -9.374
72 2HB ASP 10 3HB ASP 10 -8.853 9.034 -8.508
73 H ASP 11 H ASP 11 -7.785 6.837 -7.305
74 HA ASP 11 HA ASP 11 -5.210 6.964 -8.527
75 1HB ASP 11 2HB ASP 11 -4.412 7.145 -6.506
76 2HB ASP 11 3HB ASP 11 -6.040 7.456 -6.033
77 H ILE 12 H ILE 12 -7.133 4.219 -7.196
78 HA ILE 12 HA ILE 12 -5.220 2.337 -7.872
79 HB ILE 12 HB ILE 12 -6.954 0.680 -7.656
80 1HG1 ILE 12 2HG1 ILE 12 -8.854 2.966 -7.295
81 2HG1 ILE 12 3HG1 ILE 12 -8.879 1.810 -8.635
82 1HG2 ILE 12 1HG2 ILE 12 -5.712 1.640 -5.724
83 2HG2 ILE 12 2HG2 ILE 12 -7.049 2.768 -5.446
84 3HG2 ILE 12 3HG2 ILE 12 -7.303 1.021 -5.285
85 1HD1 ILE 12 1HD1 ILE 12 -10.611 1.179 -7.131
86 2HD1 ILE 12 2HD1 ILE 12 -9.307 0.001 -6.931
87 3HD1 ILE 12 3HD1 ILE 12 -9.547 1.286 -5.722
88 H ALA 13 H ALA 13 -7.889 3.675 -9.828
89 HA ALA 13 HA ALA 13 -7.603 1.995 -12.094
90 1HB ALA 13 1HB ALA 13 -8.595 3.845 -13.373
91 2HB ALA 13 2HB ALA 13 -9.462 3.553 -11.850
92 3HB ALA 13 3HB ALA 13 -8.368 4.941 -12.002
93 H ALA 14 H ALA 14 -5.838 5.041 -11.260
94 HA ALA 14 HA ALA 14 -4.093 5.017 -13.550
95 1HB ALA 14 1HB ALA 14 -2.655 6.468 -12.251
96 2HB ALA 14 2HB ALA 14 -4.351 6.963 -12.075
97 3HB ALA 14 3HB ALA 14 -3.537 6.096 -10.760
98 H ALA 15 H ALA 15 -3.405 3.842 -10.219
99 HA ALA 15 HA ALA 15 -0.884 2.774 -10.741
100 1HB ALA 15 1HB ALA 15 -1.172 1.473 -8.717
101 2HB ALA 15 2HB ALA 15 -1.926 3.054 -8.459
102 3HB ALA 15 3HB ALA 15 -2.941 1.640 -8.794
103 H LEU 16 H LEU 16 -4.028 1.201 -11.015
104 HA LEU 16 HA LEU 16 -3.333 -1.381 -11.674
105 1HB LEU 16 2HB LEU 16 -5.551 -0.942 -11.227
106 2HB LEU 16 3HB LEU 16 -5.669 0.374 -12.385
107 HG LEU 16 HG LEU 16 -5.123 -2.248 -13.661
108 1HD1 LEU 16 1HD1 LEU 16 -7.460 -3.011 -13.432
109 2HD1 LEU 16 2HD1 LEU 16 -6.606 -3.041 -11.878
110 3HD1 LEU 16 3HD1 LEU 16 -7.762 -1.739 -12.229
111 1HD2 LEU 16 1HD2 LEU 16 -5.751 0.052 -14.700
112 2HD2 LEU 16 2HD2 LEU 16 -6.680 -1.355 -15.271
113 3HD2 LEU 16 3HD2 LEU 16 -7.375 -0.227 -14.087
114 H GLN 17 H GLN 17 -3.386 1.431 -13.947
115 HA GLN 17 HA GLN 17 -2.516 -0.392 -16.150
116 1HB GLN 17 2HB GLN 17 -3.348 2.501 -16.094
117 2HB GLN 17 3HB GLN 17 -2.551 1.761 -17.490
118 1HG GLN 17 2HG GLN 17 -4.687 0.010 -16.547
119 2HG GLN 17 3HG GLN 17 -5.318 1.633 -16.824
120 1HE2 GLN 17 1HE2 GLN 17 -5.827 2.129 -18.947
121 2HE2 GLN 17 2HE2 GLN 17 -5.370 1.146 -20.323
122 H GLU 18 H GLU 18 -1.279 2.441 -14.337
123 HA GLU 18 HA GLU 18 1.167 2.751 -15.634
124 1HB GLU 18 2HB GLU 18 0.213 4.305 -13.990
125 2HB GLU 18 3HB GLU 18 0.440 3.120 -12.701
126 1HG GLU 18 2HG GLU 18 2.094 4.809 -12.530
127 2HG GLU 18 3HG GLU 18 2.913 3.307 -12.992
128 H CYS 19 H CYS 19 0.384 0.566 -12.903
129 HA CYS 19 HA CYS 19 2.961 -0.917 -13.311
130 1HB CYS 19 2HB CYS 19 1.266 -0.609 -10.796
131 2HB CYS 19 3HB CYS 19 2.700 -1.643 -10.981
132 HG CYS 19 HG CYS 19 2.524 1.600 -11.436
133 H ARG 20 H ARG 20 1.190 -1.565 -15.175
134 HA ARG 20 HA ARG 20 -0.733 -3.602 -14.238
135 1HB ARG 20 2HB ARG 20 -1.431 -2.337 -16.049
136 2HB ARG 20 3HB ARG 20 0.111 -2.477 -16.914
137 1HG ARG 20 2HG ARG 20 -0.323 -4.763 -17.492
138 2HG ARG 20 3HG ARG 20 -1.746 -4.836 -16.416
139 1HD ARG 20 2HD ARG 20 -2.928 -3.209 -17.763
140 2HD ARG 20 3HD ARG 20 -1.475 -2.883 -18.743
141 HE ARG 20 HE ARG 20 -1.924 -5.602 -19.020
142 1HH1 ARG 20 2HH2 ARG 20 -3.642 -2.591 -19.761
143 2HH1 ARG 20 1HH2 ARG 20 -4.497 -3.233 -21.127
144 1HH2 ARG 20 2HH1 ARG 20 -3.025 -6.474 -20.849
145 2HH2 ARG 20 1HH1 ARG 20 -4.123 -5.504 -21.774
146 H ASP 21 H ASP 21 2.178 -3.484 -16.290
147 HA ASP 21 HA ASP 21 2.373 -6.194 -16.786
148 1HB ASP 21 2HB ASP 21 4.333 -3.869 -16.804
149 2HB ASP 21 3HB ASP 21 4.896 -5.488 -17.150
150 HA PRO 22 HA PRO 22 3.509 -7.994 -13.034
151 1HB PRO 22 2HB PRO 22 4.957 -10.215 -13.741
152 2HB PRO 22 3HB PRO 22 3.201 -10.040 -14.034
153 1HG PRO 22 2HG PRO 22 5.458 -9.476 -15.976
154 2HG PRO 22 3HG PRO 22 3.997 -10.468 -16.265
155 1HD PRO 22 2HD PRO 22 4.122 -7.874 -17.059
156 2HD PRO 22 3HD PRO 22 2.610 -8.522 -16.353
157 H ASP 23 H ASP 23 4.939 -7.539 -11.533
158 HA ASP 23 HA ASP 23 6.675 -6.991 -10.389
159 1HB ASP 23 2HB ASP 23 8.353 -8.325 -12.538
160 2HB ASP 23 3HB ASP 23 8.940 -7.816 -10.950
161 H THR 24 H THR 24 5.526 -5.070 -12.089
162 HA THR 24 HA THR 24 7.816 -3.242 -12.693
163 HB THR 24 HB THR 24 4.889 -2.799 -13.383
164 HG1 THR 24 1HG THR 24 5.368 -4.597 -14.423
165 1HG2 THR 24 1HG2 THR 24 5.893 -1.470 -15.261
166 2HG2 THR 24 2HG2 THR 24 6.226 -0.765 -13.677
167 3HG2 THR 24 3HG2 THR 24 7.492 -1.687 -14.525
168 H PHE 25 H PHE 25 6.005 -4.075 -10.075
169 HA PHE 25 HA PHE 25 4.944 -1.530 -9.308
170 1HB PHE 25 2HB PHE 25 4.647 -4.120 -8.448
171 2HB PHE 25 3HB PHE 25 5.597 -3.473 -7.143
172 HD1 PHE 25 1HD PHE 25 2.457 -3.086 -9.107
173 HD2 PHE 25 2HD PHE 25 4.609 -1.803 -5.597
174 HE1 PHE 25 1HE PHE 25 0.330 -2.360 -8.078
175 HE2 PHE 25 2HE PHE 25 2.482 -0.918 -4.660
176 HZ PHE 25 HZ PHE 25 0.335 -1.438 -5.761
177 H GLU 26 H GLU 26 5.800 0.050 -8.047
178 HA GLU 26 HA GLU 26 8.363 -0.409 -6.662
179 1HB GLU 26 2HB GLU 26 7.850 1.606 -8.805
180 2HB GLU 26 3HB GLU 26 8.478 2.273 -7.294
181 1HG GLU 26 2HG GLU 26 10.244 0.247 -7.583
182 2HG GLU 26 3HG GLU 26 9.826 0.529 -9.281
183 HA PRO 27 HA PRO 27 6.077 1.229 -3.308
184 1HB PRO 27 2HB PRO 27 8.099 2.287 -1.715
185 2HB PRO 27 3HB PRO 27 7.722 0.555 -1.895
186 1HG PRO 27 2HG PRO 27 9.922 2.113 -3.248
187 2HG PRO 27 3HG PRO 27 9.946 0.440 -2.617
188 1HD PRO 27 2HD PRO 27 9.648 0.994 -5.255
189 2HD PRO 27 3HD PRO 27 8.940 -0.438 -4.447
190 H GLN 28 H GLN 28 8.692 3.666 -3.757
191 HA GLN 28 HA GLN 28 7.151 5.928 -3.149
192 1HB GLN 28 2HB GLN 28 9.618 5.571 -4.868
193 2HB GLN 28 3HB GLN 28 8.943 7.160 -4.459
194 1HG GLN 28 2HG GLN 28 9.237 6.793 -2.090
195 2HG GLN 28 3HG GLN 28 9.650 5.093 -2.328
196 1HE2 GLN 28 1HE2 GLN 28 10.912 8.383 -2.371
197 2HE2 GLN 28 2HE2 GLN 28 12.566 7.899 -2.700
198 H LYS 29 H LYS 29 7.765 4.481 -6.325
199 HA LYS 29 HA LYS 29 6.264 6.144 -7.981
200 1HB LYS 29 2HB LYS 29 7.667 4.118 -8.633
201 2HB LYS 29 3HB LYS 29 6.329 3.111 -8.049
202 1HG LYS 29 2HG LYS 29 5.787 3.157 -10.241
203 2HG LYS 29 3HG LYS 29 4.884 4.582 -9.717
204 1HD LYS 29 2HD LYS 29 7.021 5.939 -10.401
205 2HD LYS 29 3HD LYS 29 7.553 4.422 -11.164
206 1HE LYS 29 2HE LYS 29 5.110 4.397 -12.187
207 2HE LYS 29 3HE LYS 29 5.061 6.111 -11.763
208 1HZ LYS 29 1HZ LYS 29 5.631 5.581 -13.987
209 2HZ LYS 29 2HZ LYS 29 6.862 6.464 -13.295
210 3HZ LYS 29 3HZ LYS 29 7.024 4.828 -13.555
211 H PHE 30 H PHE 30 5.056 3.168 -6.255
212 HA PHE 30 HA PHE 30 2.356 3.534 -6.953
213 1HB PHE 30 2HB PHE 30 3.271 1.431 -6.122
214 2HB PHE 30 3HB PHE 30 3.556 2.143 -4.535
215 HD1 PHE 30 1HD PHE 30 1.807 2.062 -2.887
216 HD2 PHE 30 2HD PHE 30 0.878 1.349 -7.041
217 HE1 PHE 30 1HE PHE 30 -0.524 1.470 -2.270
218 HE2 PHE 30 2HE PHE 30 -1.456 0.795 -6.414
219 HZ PHE 30 HZ PHE 30 -2.170 0.904 -4.042
220 H PHE 31 H PHE 31 4.131 4.668 -4.013
221 HA PHE 31 HA PHE 31 1.916 5.727 -2.646
222 1HB PHE 31 2HB PHE 31 4.683 6.958 -2.725
223 2HB PHE 31 3HB PHE 31 3.494 7.096 -1.437
224 HD1 PHE 31 1HD PHE 31 2.781 3.947 -1.555
225 HD2 PHE 31 2HD PHE 31 6.354 6.302 -1.051
226 HE1 PHE 31 1HE PHE 31 3.877 2.051 -0.432
227 HE2 PHE 31 2HE PHE 31 7.500 4.349 -0.072
228 HZ PHE 31 HZ PHE 31 6.255 2.221 0.293
229 H GLN 32 H GLN 32 3.832 7.206 -5.287
230 HA GLN 32 HA GLN 32 2.348 9.739 -5.141
231 1HB GLN 32 2HB GLN 32 4.369 8.570 -7.071
232 2HB GLN 32 3HB GLN 32 3.466 10.060 -7.409
233 1HG GLN 32 2HG GLN 32 4.289 11.099 -5.352
234 2HG GLN 32 3HG GLN 32 5.107 9.606 -4.876
235 1HE2 GLN 32 1HE2 GLN 32 4.959 11.458 -8.007
236 2HE2 GLN 32 2HE2 GLN 32 6.706 11.600 -8.132
237 H THR 33 H THR 33 2.356 6.891 -7.391
238 HA THR 33 HA THR 33 0.487 8.020 -9.092
239 HB THR 33 HB THR 33 2.107 5.762 -9.077
240 HG1 THR 33 1HG THR 33 0.015 6.602 -10.685
241 1HG2 THR 33 1HG2 THR 33 0.361 4.369 -7.893
242 2HG2 THR 33 2HG2 THR 33 -0.732 4.731 -9.253
243 3HG2 THR 33 3HG2 THR 33 0.774 3.825 -9.523
244 H SER 34 H SER 34 0.068 5.982 -6.236
245 HA SER 34 HA SER 34 -2.751 5.747 -6.508
246 1HB SER 34 2HB SER 34 -0.980 5.125 -4.130
247 2HB SER 34 3HB SER 34 -2.595 4.469 -4.463
248 HG SER 34 HG SER 34 -0.600 3.255 -5.181
249 H GLY 35 H GLY 35 -0.924 8.473 -5.563
250 1HA GLY 35 1HA GLY 35 -1.802 10.486 -4.859
251 2HA GLY 35 2HA GLY 35 -3.366 9.711 -4.575
252 H LEU 36 H LEU 36 -1.856 7.677 -2.839
253 HA LEU 36 HA LEU 36 -2.301 8.638 -0.353
254 1HB LEU 36 2HB LEU 36 -0.718 6.405 -1.579
255 2HB LEU 36 3HB LEU 36 -0.492 6.689 0.124
256 HG LEU 36 HG LEU 36 -3.263 6.427 -1.092
257 1HD1 LEU 36 1HD1 LEU 36 -2.047 4.353 -1.573
258 2HD1 LEU 36 2HD1 LEU 36 -1.527 4.234 0.124
259 3HD1 LEU 36 3HD1 LEU 36 -3.246 4.076 -0.297
260 1HD2 LEU 36 1HD2 LEU 36 -3.989 5.973 1.161
261 2HD2 LEU 36 2HD2 LEU 36 -2.318 5.918 1.767
262 3HD2 LEU 36 3HD2 LEU 36 -3.041 7.450 1.260
263 H SER 37 H SER 37 0.658 9.147 -2.217
264 HA SER 37 HA SER 37 2.161 10.373 -0.031
265 1HB SER 37 2HB SER 37 3.423 9.563 -1.906
266 2HB SER 37 3HB SER 37 2.333 10.372 -3.053
267 HG SER 37 HG SER 37 4.465 11.402 -1.626
268 H LYS 38 H LYS 38 -0.415 11.464 -2.129
269 HA LYS 38 HA LYS 38 0.192 14.308 -1.731
270 1HB LYS 38 2HB LYS 38 -1.328 12.764 -3.676
271 2HB LYS 38 3HB LYS 38 -2.447 13.792 -2.794
272 1HG LYS 38 2HG LYS 38 -1.704 15.104 -4.625
273 2HG LYS 38 3HG LYS 38 -0.815 15.721 -3.228
274 1HD LYS 38 2HD LYS 38 0.937 13.784 -4.049
275 2HD LYS 38 3HD LYS 38 0.115 14.085 -5.589
276 1HE LYS 38 2HE LYS 38 0.635 16.583 -5.230
277 2HE LYS 38 3HE LYS 38 1.588 16.099 -3.814
278 1HZ LYS 38 1HZ LYS 38 2.994 16.353 -5.693
279 2HZ LYS 38 2HZ LYS 38 2.951 14.757 -5.302
280 3HZ LYS 38 3HZ LYS 38 2.103 15.313 -6.604
281 H MET 39 H MET 39 -1.888 11.653 -0.590
282 HA MET 39 HA MET 39 -3.474 13.301 1.142
283 1HB MET 39 2HB MET 39 -2.917 10.353 0.825
284 2HB MET 39 3HB MET 39 -3.704 10.914 2.278
285 1HG MET 39 2HG MET 39 -5.458 12.030 0.932
286 2HG MET 39 3HG MET 39 -4.675 11.469 -0.554
287 1HE MET 39 1HE MET 39 -7.812 11.085 0.322
288 2HE MET 39 2HE MET 39 -7.094 10.675 -1.254
289 3HE MET 39 3HE MET 39 -8.044 9.459 -0.370
290 H SER 40 H SER 40 -2.739 14.335 2.935
291 HA SER 40 HA SER 40 -0.123 13.879 4.022
292 1HB SER 40 2HB SER 40 -1.469 16.015 4.258
293 2HB SER 40 3HB SER 40 -2.505 15.151 5.421
294 HG SER 40 HG SER 40 0.274 15.723 5.628
295 H ALA 41 H ALA 41 0.266 13.189 6.242
296 HA ALA 41 HA ALA 41 -0.154 10.582 6.862
297 1HB ALA 41 1HB ALA 41 1.402 12.106 8.033
298 2HB ALA 41 2HB ALA 41 0.037 12.885 8.856
299 3HB ALA 41 3HB ALA 41 0.412 11.181 9.186
300 H ASN 42 H ASN 42 -2.212 13.264 7.903
301 HA ASN 42 HA ASN 42 -4.133 12.213 9.522
302 1HB ASN 42 2HB ASN 42 -4.709 13.956 7.092
303 2HB ASN 42 3HB ASN 42 -5.708 13.806 8.545
304 1HD2 ASN 42 1HD2 ASN 42 -4.748 16.289 7.535
305 2HD2 ASN 42 2HD2 ASN 42 -3.572 16.916 8.678
306 H GLN 43 H GLN 43 -4.172 11.982 5.933
307 HA GLN 43 HA GLN 43 -6.645 10.384 5.972
308 1HB GLN 43 2HB GLN 43 -4.923 11.739 3.922
309 2HB GLN 43 3HB GLN 43 -5.800 10.301 3.398
310 1HG GLN 43 2HG GLN 43 -7.061 12.741 4.718
311 2HG GLN 43 3HG GLN 43 -7.038 12.426 2.977
312 1HE2 GLN 43 1HE2 GLN 43 -7.672 9.711 2.776
313 2HE2 GLN 43 2HE2 GLN 43 -9.266 9.461 3.474
314 H VAL 44 H VAL 44 -3.061 9.856 5.584
315 HA VAL 44 HA VAL 44 -3.413 7.214 4.600
316 HB VAL 44 HB VAL 44 -1.073 8.310 6.213
317 1HG1 VAL 44 1HG1 VAL 44 0.216 6.715 4.841
318 2HG1 VAL 44 2HG1 VAL 44 -1.125 5.819 5.587
319 3HG1 VAL 44 3HG1 VAL 44 -1.229 6.328 3.890
320 1HG2 VAL 44 1HG2 VAL 44 -1.672 8.642 3.237
321 2HG2 VAL 44 2HG2 VAL 44 -1.442 9.933 4.425
322 3HG2 VAL 44 3HG2 VAL 44 -0.086 8.918 3.981
323 H LYS 45 H LYS 45 -3.399 8.654 7.877
324 HA LYS 45 HA LYS 45 -3.459 6.280 9.415
325 1HB LYS 45 2HB LYS 45 -3.197 8.625 10.235
326 2HB LYS 45 3HB LYS 45 -4.952 8.824 10.065
327 1HG LYS 45 2HG LYS 45 -5.348 6.969 11.626
328 2HG LYS 45 3HG LYS 45 -3.606 6.637 11.711
329 1HD LYS 45 2HD LYS 45 -3.198 8.891 12.628
330 2HD LYS 45 3HD LYS 45 -4.939 9.248 12.557
331 1HE LYS 45 2HE LYS 45 -5.423 7.463 14.172
332 2HE LYS 45 3HE LYS 45 -3.732 6.926 14.151
333 1HZ LYS 45 1HZ LYS 45 -4.658 9.543 15.135
334 2HZ LYS 45 2HZ LYS 45 -4.212 8.266 16.070
335 3HZ LYS 45 3HZ LYS 45 -3.099 9.014 15.123
336 H ASP 46 H ASP 46 -6.231 8.129 8.008
337 HA ASP 46 HA ASP 46 -8.247 6.350 8.857
338 1HB ASP 46 2HB ASP 46 -8.019 8.381 6.642
339 2HB ASP 46 3HB ASP 46 -9.309 7.180 6.541
340 H VAL 47 H VAL 47 -6.398 6.284 5.734
341 HA VAL 47 HA VAL 47 -7.703 3.883 4.940
342 HB VAL 47 HB VAL 47 -6.313 3.595 3.192
343 1HG1 VAL 47 1HG1 VAL 47 -6.033 6.579 3.550
344 2HG1 VAL 47 2HG1 VAL 47 -6.258 5.653 2.060
345 3HG1 VAL 47 3HG1 VAL 47 -7.585 5.784 3.225
346 1HG2 VAL 47 1HG2 VAL 47 -4.122 4.404 2.787
347 2HG2 VAL 47 2HG2 VAL 47 -4.061 5.179 4.371
348 3HG2 VAL 47 3HG2 VAL 47 -4.125 3.413 4.236
349 H PHE 48 H PHE 48 -4.652 4.290 6.780
350 HA PHE 48 HA PHE 48 -3.798 1.678 6.981
351 1HB PHE 48 2HB PHE 48 -3.732 3.959 8.955
352 2HB PHE 48 3HB PHE 48 -3.228 2.366 9.470
353 HD1 PHE 48 1HD PHE 48 -1.636 1.081 7.713
354 HD2 PHE 48 2HD PHE 48 -1.860 5.332 8.420
355 HE1 PHE 48 1HE PHE 48 0.766 1.315 7.199
356 HE2 PHE 48 2HE PHE 48 0.498 5.564 7.837
357 HZ PHE 48 HZ PHE 48 1.848 3.568 7.398
358 H ARG 49 H ARG 49 -6.327 3.190 9.066
359 HA ARG 49 HA ARG 49 -6.692 0.798 10.616
360 1HB ARG 49 2HB ARG 49 -8.707 3.021 10.074
361 2HB ARG 49 3HB ARG 49 -8.825 1.729 11.289
362 1HG ARG 49 2HG ARG 49 -6.481 2.572 12.085
363 2HG ARG 49 3HG ARG 49 -6.852 4.037 11.176
364 1HD ARG 49 2HD ARG 49 -8.148 4.812 12.841
365 2HD ARG 49 3HD ARG 49 -9.164 3.363 12.779
366 HE ARG 49 HE ARG 49 -6.693 2.799 14.135
367 1HH1 ARG 49 2HH2 ARG 49 -9.795 4.390 14.611
368 2HH1 ARG 49 1HH2 ARG 49 -9.851 4.147 16.329
369 1HH2 ARG 49 2HH1 ARG 49 -6.708 2.452 16.412
370 2HH2 ARG 49 1HH1 ARG 49 -8.021 3.035 17.380
371 H PHE 50 H PHE 50 -7.837 1.658 7.402
372 HA PHE 50 HA PHE 50 -9.741 -0.555 7.307
373 1HB PHE 50 2HB PHE 50 -9.734 1.630 5.882
374 2HB PHE 50 3HB PHE 50 -8.533 0.815 4.893
375 HD1 PHE 50 1HD PHE 50 -11.921 0.315 6.441
376 HD2 PHE 50 2HD PHE 50 -9.408 -0.372 3.006
377 HE1 PHE 50 1HE PHE 50 -13.830 -0.718 5.252
378 HE2 PHE 50 2HE PHE 50 -11.349 -1.339 1.798
379 HZ PHE 50 HZ PHE 50 -13.531 -1.606 2.948
380 H ILE 51 H ILE 51 -6.327 0.076 6.415
381 HA ILE 51 HA ILE 51 -5.983 -2.387 5.016
382 HB ILE 51 HB ILE 51 -3.742 -0.829 6.318
383 1HG1 ILE 51 2HG1 ILE 51 -4.659 0.871 5.045
384 2HG1 ILE 51 3HG1 ILE 51 -3.477 0.173 3.984
385 1HG2 ILE 51 1HG2 ILE 51 -3.135 -3.063 5.469
386 2HG2 ILE 51 2HG2 ILE 51 -3.865 -2.681 3.904
387 3HG2 ILE 51 3HG2 ILE 51 -2.422 -1.805 4.458
388 1HD1 ILE 51 1HD1 ILE 51 -5.467 0.693 2.744
389 2HD1 ILE 51 2HD1 ILE 51 -5.361 -1.082 2.813
390 3HD1 ILE 51 3HD1 ILE 51 -6.507 -0.206 3.837
391 H ASP 52 H ASP 52 -5.056 -1.514 8.406
392 HA ASP 52 HA ASP 52 -4.342 -4.264 9.140
393 1HB ASP 52 2HB ASP 52 -4.634 -1.666 10.605
394 2HB ASP 52 3HB ASP 52 -4.981 -3.126 11.512
395 H ASN 53 H ASN 53 -6.156 -5.143 7.984
396 HA ASN 53 HA ASN 53 -8.859 -4.838 8.867
397 1HB ASN 53 2HB ASN 53 -8.022 -5.822 6.688
398 2HB ASN 53 3HB ASN 53 -7.648 -7.312 7.573
399 1HD2 ASN 53 1HD2 ASN 53 -9.431 -8.629 8.290
400 2HD2 ASN 53 2HD2 ASN 53 -11.061 -8.343 7.719
401 H ASP 54 H ASP 54 -6.134 -6.777 10.027
402 HA ASP 54 HA ASP 54 -7.629 -8.363 11.915
403 1HB ASP 54 2HB ASP 54 -5.495 -8.936 12.844
404 2HB ASP 54 3HB ASP 54 -5.410 -9.023 11.081
405 H GLN 55 H GLN 55 -5.807 -5.375 12.065
406 HA GLN 55 HA GLN 55 -6.548 -3.364 12.970
407 1HB GLN 55 2HB GLN 55 -8.079 -2.919 14.496
408 2HB GLN 55 3HB GLN 55 -8.752 -4.296 13.637
409 1HG GLN 55 2HG GLN 55 -8.986 -5.387 15.593
410 2HG GLN 55 3HG GLN 55 -7.241 -5.328 15.846
411 1HE2 GLN 55 1HE2 GLN 55 -10.001 -2.975 16.004
412 2HE2 GLN 55 2HE2 GLN 55 -9.557 -2.364 17.594
413 H SER 56 H SER 56 -4.268 -5.397 13.609
414 HA SER 56 HA SER 56 -3.675 -4.859 16.388
415 1HB SER 56 2HB SER 56 -1.442 -5.926 15.801
416 2HB SER 56 3HB SER 56 -2.907 -6.900 15.615
417 HG SER 56 HG SER 56 -2.465 -7.146 13.655
418 H GLY 57 H GLY 57 -2.463 -3.417 13.316
419 1HA GLY 57 1HA GLY 57 -1.914 -1.029 13.423
420 2HA GLY 57 2HA GLY 57 -1.125 -1.282 14.981
421 H TYR 58 H TYR 58 -0.029 -3.934 13.967
422 HA TYR 58 HA TYR 58 2.315 -2.929 12.472
423 1HB TYR 58 2HB TYR 58 1.569 -5.707 13.449
424 2HB TYR 58 3HB TYR 58 3.056 -5.286 12.608
425 HD1 TYR 58 HD1 TYR 58 1.426 -5.450 15.831
426 HD2 TYR 58 HD2 TYR 58 4.620 -3.531 13.661
427 HE1 TYR 58 HE1 TYR 58 2.463 -4.744 17.972
428 HE2 TYR 58 HE2 TYR 58 5.650 -2.826 15.798
429 HH TYR 58 HH TYR 58 5.456 -2.799 18.096
430 H LEU 59 H LEU 59 2.540 -3.225 10.302
431 HA LEU 59 HA LEU 59 0.290 -4.487 8.772
432 1HB LEU 59 2HB LEU 59 2.478 -2.534 7.990
433 2HB LEU 59 3HB LEU 59 1.526 -3.440 6.815
434 HG LEU 59 HG LEU 59 0.631 -1.213 7.064
435 1HD1 LEU 59 1HD1 LEU 59 -0.910 -3.105 6.587
436 2HD1 LEU 59 2HD1 LEU 59 -1.356 -3.134 8.312
437 3HD1 LEU 59 3HD1 LEU 59 -1.680 -1.698 7.342
438 1HD2 LEU 59 1HD2 LEU 59 0.054 -1.834 9.981
439 2HD2 LEU 59 2HD2 LEU 59 1.296 -0.714 9.393
440 3HD2 LEU 59 3HD2 LEU 59 -0.434 -0.400 9.105
441 H ASP 60 H ASP 60 1.027 -6.378 9.850
442 HA ASP 60 HA ASP 60 3.535 -7.594 9.448
443 1HB ASP 60 2HB ASP 60 0.987 -9.202 9.648
444 2HB ASP 60 3HB ASP 60 2.569 -9.450 10.414
445 H GLU 61 H GLU 61 4.023 -9.493 7.929
446 HA GLU 61 HA GLU 61 3.934 -8.721 5.356
447 1HB GLU 61 2HB GLU 61 5.155 -10.697 6.617
448 2HB GLU 61 3HB GLU 61 3.895 -11.703 5.911
449 1HG GLU 61 2HG GLU 61 5.273 -9.784 4.028
450 2HG GLU 61 3HG GLU 61 6.278 -11.007 4.802
451 H GLU 62 H GLU 62 1.679 -11.193 6.719
452 HA GLU 62 HA GLU 62 0.105 -11.453 4.472
453 1HB GLU 62 2HB GLU 62 -0.608 -11.766 7.424
454 2HB GLU 62 3HB GLU 62 -1.654 -12.257 6.087
455 1HG GLU 62 2HG GLU 62 -0.582 -14.245 6.405
456 2HG GLU 62 3HG GLU 62 0.571 -13.517 5.256
457 H GLU 63 H GLU 63 -0.088 -8.647 6.693
458 HA GLU 63 HA GLU 63 -2.686 -7.817 5.655
459 1HB GLU 63 2HB GLU 63 -0.577 -6.567 7.323
460 2HB GLU 63 3HB GLU 63 -1.233 -5.477 6.104
461 1HG GLU 63 2HG GLU 63 -2.596 -5.142 7.950
462 2HG GLU 63 3HG GLU 63 -3.581 -6.135 6.874
463 H LEU 64 H LEU 64 0.692 -7.555 4.648
464 HA LEU 64 HA LEU 64 0.055 -6.005 2.272
465 1HB LEU 64 2HB LEU 64 2.400 -6.607 3.801
466 2HB LEU 64 3HB LEU 64 2.683 -7.277 2.207
467 HG LEU 64 HG LEU 64 1.876 -4.408 2.860
468 1HD1 LEU 64 1HD1 LEU 64 4.499 -5.598 1.857
469 2HD1 LEU 64 2HD1 LEU 64 4.190 -3.875 2.144
470 3HD1 LEU 64 3HD1 LEU 64 4.197 -5.010 3.506
471 1HD2 LEU 64 1HD2 LEU 64 2.657 -5.597 0.150
472 2HD2 LEU 64 2HD2 LEU 64 1.027 -5.053 0.581
473 3HD2 LEU 64 3HD2 LEU 64 2.351 -3.890 0.521
474 H LYS 65 H LYS 65 -0.909 -8.996 2.948
475 HA LYS 65 HA LYS 65 -0.545 -10.005 0.175
476 1HB LYS 65 2HB LYS 65 -0.008 -11.431 2.215
477 2HB LYS 65 3HB LYS 65 -1.756 -11.389 2.567
478 1HG LYS 65 2HG LYS 65 -2.278 -12.651 0.605
479 2HG LYS 65 3HG LYS 65 -0.640 -12.436 -0.036
480 1HD LYS 65 2HD LYS 65 -0.871 -14.685 0.899
481 2HD LYS 65 3HD LYS 65 0.317 -13.733 1.802
482 1HE LYS 65 2HE LYS 65 -1.498 -13.269 3.552
483 2HE LYS 65 3HE LYS 65 -2.555 -14.374 2.661
484 1HZ LYS 65 1HZ LYS 65 -1.432 -15.390 4.521
485 2HZ LYS 65 2HZ LYS 65 -0.907 -16.100 3.129
486 3HZ LYS 65 3HZ LYS 65 0.039 -15.007 3.925
487 H PHE 66 H PHE 66 -2.532 -7.918 1.962
488 HA PHE 66 HA PHE 66 -4.524 -8.231 -0.145
489 1HB PHE 66 2HB PHE 66 -6.455 -8.254 1.446
490 2HB PHE 66 3HB PHE 66 -5.505 -9.720 1.387
491 HD1 PHE 66 1HD PHE 66 -4.403 -10.574 3.350
492 HD2 PHE 66 2HD PHE 66 -6.127 -6.620 3.434
493 HE1 PHE 66 1HE PHE 66 -4.396 -10.610 5.828
494 HE2 PHE 66 2HE PHE 66 -5.934 -6.611 5.897
495 HZ PHE 66 HZ PHE 66 -5.285 -8.686 7.102
496 H PHE 67 H PHE 67 -2.533 -6.150 0.557
497 HA PHE 67 HA PHE 67 -3.745 -3.954 1.914
498 1HB PHE 67 2HB PHE 67 -1.367 -4.113 1.595
499 2HB PHE 67 3HB PHE 67 -1.531 -4.118 -0.143
500 HD1 PHE 67 1HD PHE 67 -3.479 -1.595 1.765
501 HD2 PHE 67 2HD PHE 67 0.158 -2.471 -0.339
502 HE1 PHE 67 1HE PHE 67 -2.867 0.813 1.815
503 HE2 PHE 67 2HE PHE 67 0.790 -0.067 -0.266
504 HZ PHE 67 HZ PHE 67 -0.724 1.576 0.835
505 H LEU 68 H LEU 68 -3.242 -4.287 -1.684
506 HA LEU 68 HA LEU 68 -5.358 -2.359 -2.159
507 1HB LEU 68 2HB LEU 68 -3.647 -4.067 -3.972
508 2HB LEU 68 3HB LEU 68 -4.954 -2.994 -4.538
509 HG LEU 68 HG LEU 68 -3.748 -1.074 -3.414
510 1HD1 LEU 68 1HD1 LEU 68 -2.132 -2.430 -2.052
511 2HD1 LEU 68 2HD1 LEU 68 -1.362 -2.959 -3.568
512 3HD1 LEU 68 3HD1 LEU 68 -1.347 -1.258 -3.090
513 1HD2 LEU 68 1HD2 LEU 68 -1.950 -1.328 -5.444
514 2HD2 LEU 68 2HD2 LEU 68 -3.077 -2.587 -5.910
515 3HD2 LEU 68 3HD2 LEU 68 -3.659 -0.923 -5.697
516 H GLN 69 H GLN 69 -5.420 -5.811 -1.740
517 HA GLN 69 HA GLN 69 -7.638 -6.541 -3.396
518 1HB GLN 69 2HB GLN 69 -6.772 -7.487 -0.660
519 2HB GLN 69 3HB GLN 69 -8.120 -8.210 -1.527
520 1HG GLN 69 2HG GLN 69 -5.368 -8.017 -2.785
521 2HG GLN 69 3HG GLN 69 -5.842 -9.376 -1.750
522 1HE2 GLN 69 1HE2 GLN 69 -5.433 -8.608 -4.955
523 2HE2 GLN 69 2HE2 GLN 69 -6.698 -9.615 -5.583
524 H LYS 70 H LYS 70 -7.464 -4.750 -0.320
525 HA LYS 70 HA LYS 70 -10.262 -4.782 0.264
526 1HB LYS 70 2HB LYS 70 -8.346 -2.516 0.918
527 2HB LYS 70 3HB LYS 70 -9.827 -3.003 1.742
528 1HG LYS 70 2HG LYS 70 -8.348 -5.319 1.996
529 2HG LYS 70 3HG LYS 70 -7.070 -4.096 1.908
530 1HD LYS 70 2HD LYS 70 -7.538 -4.231 4.214
531 2HD LYS 70 3HD LYS 70 -8.385 -2.778 3.670
532 1HE LYS 70 2HE LYS 70 -10.415 -4.570 3.315
533 2HE LYS 70 3HE LYS 70 -9.449 -5.506 4.458
534 1HZ LYS 70 1HZ LYS 70 -10.895 -4.333 5.757
535 2HZ LYS 70 2HZ LYS 70 -9.532 -3.414 5.853
536 3HZ LYS 70 3HZ LYS 70 -10.757 -2.911 4.884
537 H PHE 71 H PHE 71 -8.434 -3.071 -2.161
538 HA PHE 71 HA PHE 71 -10.473 -0.956 -2.530
539 1HB PHE 71 2HB PHE 71 -7.889 -1.294 -4.055
540 2HB PHE 71 3HB PHE 71 -8.869 0.145 -3.833
541 HD1 PHE 71 1HD PHE 71 -8.977 -0.427 -0.600
542 HD2 PHE 71 2HD PHE 71 -5.927 0.095 -3.607
543 HE1 PHE 71 1HE PHE 71 -7.338 0.161 1.151
544 HE2 PHE 71 2HE PHE 71 -4.321 0.770 -1.853
545 HZ PHE 71 HZ PHE 71 -4.996 0.753 0.520
546 H GLU 72 H GLU 72 -8.736 -3.563 -4.306
547 HA GLU 72 HA GLU 72 -10.811 -3.550 -6.436
548 1HB GLU 72 2HB GLU 72 -8.818 -2.091 -6.974
549 2HB GLU 72 3HB GLU 72 -7.797 -3.511 -6.909
550 1HG GLU 72 2HG GLU 72 -10.216 -3.569 -8.723
551 2HG GLU 72 3HG GLU 72 -8.826 -2.580 -9.186
552 H SER 73 H SER 73 -11.202 -5.610 -7.295
553 HA SER 73 HA SER 73 -10.956 -7.641 -5.369
554 1HB SER 73 2HB SER 73 -11.988 -8.959 -7.432
555 2HB SER 73 3HB SER 73 -12.897 -7.646 -6.665
556 HG SER 73 HG SER 73 -11.201 -7.192 -8.904
557 H GLY 74 H GLY 74 -8.990 -6.997 -8.224
558 1HA GLY 74 1HA GLY 74 -7.576 -9.636 -7.942
559 2HA GLY 74 2HA GLY 74 -7.930 -8.821 -9.473
560 H ALA 75 H ALA 75 -7.069 -6.873 -6.664
561 HA ALA 75 HA ALA 75 -4.865 -5.703 -8.019
562 1HB ALA 75 1HB ALA 75 -5.380 -5.791 -5.017
563 2HB ALA 75 2HB ALA 75 -4.355 -4.654 -5.940
564 3HB ALA 75 3HB ALA 75 -6.116 -4.624 -6.141
565 H ARG 76 H ARG 76 -2.626 -5.784 -7.472
566 HA ARG 76 HA ARG 76 -1.811 -8.401 -7.875
567 1HB ARG 76 2HB ARG 76 -0.838 -6.039 -8.647
568 2HB ARG 76 3HB ARG 76 0.164 -6.215 -7.209
569 1HG ARG 76 2HG ARG 76 1.517 -7.427 -8.490
570 2HG ARG 76 3HG ARG 76 0.406 -8.730 -8.283
571 1HD ARG 76 2HD ARG 76 0.262 -8.821 -10.544
572 2HD ARG 76 3HD ARG 76 -0.898 -7.513 -10.403
573 HE ARG 76 HE ARG 76 2.041 -7.286 -10.993
574 1HH1 ARG 76 2HH2 ARG 76 -1.107 -5.550 -11.095
575 2HH1 ARG 76 1HH2 ARG 76 -0.277 -4.129 -11.737
576 1HH2 ARG 76 2HH1 ARG 76 2.886 -5.525 -11.677
577 2HH2 ARG 76 1HH1 ARG 76 1.906 -4.116 -12.157
578 H GLU 77 H GLU 77 -2.683 -7.859 -4.936
579 HA GLU 77 HA GLU 77 -0.481 -7.964 -3.208
580 1HB GLU 77 2HB GLU 77 -3.244 -9.198 -2.861
581 2HB GLU 77 3HB GLU 77 -2.057 -8.843 -1.597
582 1HG GLU 77 2HG GLU 77 -3.272 -6.683 -3.402
583 2HG GLU 77 3HG GLU 77 -3.798 -7.057 -1.765
584 H LEU 78 H LEU 78 -2.195 -10.478 -4.890
585 HA LEU 78 HA LEU 78 -1.058 -12.763 -3.764
586 1HB LEU 78 2HB LEU 78 -1.489 -12.719 -6.743
587 2HB LEU 78 3HB LEU 78 -1.741 -13.998 -5.573
588 HG LEU 78 HG LEU 78 -3.863 -13.531 -6.129
589 1HD1 LEU 78 1HD1 LEU 78 -5.074 -12.488 -4.407
590 2HD1 LEU 78 2HD1 LEU 78 -3.612 -13.135 -3.639
591 3HD1 LEU 78 3HD1 LEU 78 -3.767 -11.395 -3.972
592 1HD2 LEU 78 1HD2 LEU 78 -4.807 -11.351 -6.733
593 2HD2 LEU 78 2HD2 LEU 78 -3.245 -10.575 -6.429
594 3HD2 LEU 78 3HD2 LEU 78 -3.385 -11.766 -7.714
595 H THR 79 H THR 79 0.454 -10.513 -6.162
596 HA THR 79 HA THR 79 2.545 -12.459 -6.762
597 HB THR 79 HB THR 79 2.554 -9.506 -7.425
598 HG1 THR 79 1HG THR 79 2.273 -10.757 -9.525
599 1HG2 THR 79 1HG2 THR 79 4.262 -10.322 -9.120
600 2HG2 THR 79 2HG2 THR 79 4.803 -10.623 -7.473
601 3HG2 THR 79 3HG2 THR 79 4.135 -11.944 -8.436
602 H GLU 80 H GLU 80 3.797 -12.968 -5.209
603 HA GLU 80 HA GLU 80 4.327 -11.541 -2.851
604 1HB GLU 80 2HB GLU 80 6.100 -13.153 -2.426
605 2HB GLU 80 3HB GLU 80 4.624 -13.915 -3.016
606 1HG GLU 80 2HG GLU 80 5.704 -13.986 -5.346
607 2HG GLU 80 3HG GLU 80 7.212 -13.466 -4.562
608 H SER 81 H SER 81 6.212 -11.595 -5.888
609 HA SER 81 HA SER 81 8.357 -9.967 -5.014
610 1HB SER 81 2HB SER 81 7.167 -10.366 -7.774
611 2HB SER 81 3HB SER 81 8.650 -9.457 -7.462
612 HG SER 81 HG SER 81 8.133 -12.198 -6.922
613 H GLU 82 H GLU 82 5.343 -8.850 -6.758
614 HA GLU 82 HA GLU 82 5.987 -6.111 -6.535
615 1HB GLU 82 2HB GLU 82 3.196 -7.338 -6.624
616 2HB GLU 82 3HB GLU 82 3.664 -5.674 -6.966
617 1HG GLU 82 2HG GLU 82 5.401 -6.961 -8.636
618 2HG GLU 82 3HG GLU 82 4.120 -8.176 -8.586
619 H THR 83 H THR 83 4.046 -8.225 -4.346
620 HA THR 83 HA THR 83 3.447 -6.283 -2.522
621 HB THR 83 HB THR 83 3.728 -9.244 -2.414
622 HG1 THR 83 1HG THR 83 1.798 -7.929 -1.001
623 1HG2 THR 83 1HG2 THR 83 4.921 -8.910 -0.324
624 2HG2 THR 83 2HG2 THR 83 3.763 -7.664 0.186
625 3HG2 THR 83 3HG2 THR 83 3.252 -9.354 0.036
626 H LYS 84 H LYS 84 6.389 -8.309 -2.788
627 HA LYS 84 HA LYS 84 7.692 -7.357 -0.477
628 1HB LYS 84 2HB LYS 84 8.668 -8.861 -2.896
629 2HB LYS 84 3HB LYS 84 9.773 -8.385 -1.607
630 1HG LYS 84 2HG LYS 84 7.201 -9.810 -0.907
631 2HG LYS 84 3HG LYS 84 8.581 -10.737 -1.517
632 1HD LYS 84 2HD LYS 84 9.919 -10.254 0.360
633 2HD LYS 84 3HD LYS 84 9.046 -8.773 0.734
634 1HE LYS 84 2HE LYS 84 8.564 -10.504 2.417
635 2HE LYS 84 3HE LYS 84 7.112 -9.972 1.566
636 1HZ LYS 84 1HZ LYS 84 7.058 -12.256 1.792
637 2HZ LYS 84 2HZ LYS 84 7.281 -11.976 0.205
638 3HZ LYS 84 3HZ LYS 84 8.549 -12.507 1.128
639 H SER 85 H SER 85 7.655 -6.126 -3.801
640 HA SER 85 HA SER 85 9.687 -4.190 -3.580
641 1HB SER 85 2HB SER 85 8.322 -4.789 -5.633
642 2HB SER 85 3HB SER 85 7.030 -3.749 -4.996
643 HG SER 85 HG SER 85 8.560 -2.724 -6.470
644 H LEU 86 H LEU 86 6.244 -4.025 -2.504
645 HA LEU 86 HA LEU 86 6.495 -1.356 -1.383
646 1HB LEU 86 2HB LEU 86 4.535 -3.628 -0.882
647 2HB LEU 86 3HB LEU 86 4.436 -2.085 -0.049
648 HG LEU 86 HG LEU 86 4.501 -2.171 -3.083
649 1HD1 LEU 86 1HD1 LEU 86 1.963 -2.194 -2.944
650 2HD1 LEU 86 2HD1 LEU 86 2.716 -3.708 -2.418
651 3HD1 LEU 86 3HD1 LEU 86 2.133 -2.530 -1.224
652 1HD2 LEU 86 1HD2 LEU 86 3.329 -0.017 -2.811
653 2HD2 LEU 86 2HD2 LEU 86 3.198 -0.272 -1.064
654 3HD2 LEU 86 3HD2 LEU 86 4.780 0.015 -1.807
655 H MET 87 H MET 87 6.375 -4.606 0.144
656 HA MET 87 HA MET 87 7.006 -4.074 2.737
657 1HB MET 87 2HB MET 87 6.754 -6.347 1.585
658 2HB MET 87 3HB MET 87 8.442 -6.162 1.083
659 1HG MET 87 2HG MET 87 8.612 -7.540 2.832
660 2HG MET 87 3HG MET 87 9.039 -6.007 3.580
661 1HE MET 87 1HE MET 87 7.651 -9.189 4.350
662 2HE MET 87 2HE MET 87 8.746 -8.211 5.330
663 3HE MET 87 3HE MET 87 7.148 -8.687 5.982
664 H ALA 88 H ALA 88 9.403 -4.391 0.138
665 HA ALA 88 HA ALA 88 11.761 -4.296 1.540
666 1HB ALA 88 1HB ALA 88 11.646 -4.976 -0.783
667 2HB ALA 88 2HB ALA 88 11.101 -3.375 -1.295
668 3HB ALA 88 3HB ALA 88 12.755 -3.598 -0.673
669 H ALA 89 H ALA 89 10.024 -1.478 0.120
670 HA ALA 89 HA ALA 89 12.034 0.382 1.232
671 1HB ALA 89 1HB ALA 89 11.073 0.989 -0.851
672 2HB ALA 89 2HB ALA 89 9.408 0.816 -0.208
673 3HB ALA 89 3HB ALA 89 10.470 2.126 0.362
674 H ALA 90 H ALA 90 8.607 -0.542 1.878
675 HA ALA 90 HA ALA 90 8.065 1.430 3.836
676 1HB ALA 90 1HB ALA 90 6.299 -0.146 4.565
677 2HB ALA 90 2HB ALA 90 6.384 -0.061 2.787
678 3HB ALA 90 3HB ALA 90 7.074 -1.453 3.646
679 H ASP 91 H ASP 91 9.652 -1.770 4.112
680 HA ASP 91 HA ASP 91 9.808 -1.577 6.972
681 1HB ASP 91 2HB ASP 91 9.676 -3.752 5.696
682 2HB ASP 91 3HB ASP 91 11.373 -3.511 5.226
683 H ASN 92 H ASN 92 11.129 -0.071 7.856
684 HA ASN 92 HA ASN 92 13.633 0.768 6.416
685 1HB ASN 92 2HB ASN 92 12.019 2.143 8.598
686 2HB ASN 92 3HB ASN 92 13.565 2.710 7.967
687 1HD2 ASN 92 1HD2 ASN 92 10.207 1.870 6.768
688 2HD2 ASN 92 2HD2 ASN 92 10.274 3.105 5.550
689 H ASP 93 H ASP 93 13.288 -1.756 7.943
690 HA ASP 93 HA ASP 93 15.394 -1.355 10.053
691 1HB ASP 93 2HB ASP 93 13.145 -3.400 9.910
692 2HB ASP 93 3HB ASP 93 14.483 -3.454 11.056
693 H GLY 94 H GLY 94 13.902 -3.634 7.731
694 1HA GLY 94 1HA GLY 94 15.014 -5.226 6.355
695 2HA GLY 94 2HA GLY 94 16.485 -5.084 7.336
696 H ASP 95 H ASP 95 13.024 -5.311 8.330
697 HA ASP 95 HA ASP 95 13.555 -8.010 9.473
698 1HB ASP 95 2HB ASP 95 12.093 -7.592 11.340
699 2HB ASP 95 3HB ASP 95 13.590 -6.661 11.382
700 H GLY 96 H GLY 96 10.788 -5.807 8.837
701 1HA GLY 96 1HA GLY 96 9.501 -6.479 6.757
702 2HA GLY 96 2HA GLY 96 9.451 -8.125 7.433
703 H LYS 97 H LYS 97 9.132 -7.239 10.206
704 HA LYS 97 HA LYS 97 6.339 -6.615 10.392
705 1HB LYS 97 2HB LYS 97 6.761 -6.130 12.733
706 2HB LYS 97 3HB LYS 97 7.396 -7.695 12.218
707 1HG LYS 97 2HG LYS 97 9.694 -6.716 12.143
708 2HG LYS 97 3HG LYS 97 9.046 -5.191 12.781
709 1HD LYS 97 2HD LYS 97 8.101 -6.502 14.724
710 2HD LYS 97 3HD LYS 97 8.988 -7.916 14.153
711 1HE LYS 97 2HE LYS 97 10.192 -5.225 15.007
712 2HE LYS 97 3HE LYS 97 10.152 -6.696 15.994
713 1HZ LYS 97 1HZ LYS 97 11.546 -7.732 14.232
714 2HZ LYS 97 2HZ LYS 97 11.624 -6.253 13.505
715 3HZ LYS 97 3HZ LYS 97 12.272 -6.442 14.971
716 H ILE 98 H ILE 98 5.702 -4.913 9.230
717 HA ILE 98 HA ILE 98 7.084 -2.300 9.409
718 HB ILE 98 HB ILE 98 4.881 -3.413 7.669
719 1HG1 ILE 98 2HG1 ILE 98 7.501 -2.201 6.756
720 2HG1 ILE 98 3HG1 ILE 98 7.503 -3.854 7.361
721 1HG2 ILE 98 1HG2 ILE 98 5.997 -0.583 7.779
722 2HG2 ILE 98 2HG2 ILE 98 5.068 -1.234 6.436
723 3HG2 ILE 98 3HG2 ILE 98 4.309 -1.068 8.025
724 1HD1 ILE 98 1HD1 ILE 98 5.798 -4.517 5.733
725 2HD1 ILE 98 2HD1 ILE 98 5.785 -2.879 5.049
726 3HD1 ILE 98 3HD1 ILE 98 7.263 -3.863 4.969
727 H GLY 99 H GLY 99 6.002 -0.516 10.221
728 1HA GLY 99 1HA GLY 99 3.577 -0.974 11.934
729 2HA GLY 99 2HA GLY 99 4.923 0.094 12.373
730 H ALA 100 H ALA 100 2.425 1.185 12.312
731 HA ALA 100 HA ALA 100 1.576 2.229 9.820
732 1HB ALA 100 1HB ALA 100 0.147 2.247 11.805
733 2HB ALA 100 2HB ALA 100 1.257 3.385 12.615
734 3HB ALA 100 3HB ALA 100 0.368 3.887 11.157
735 H GLU 101 H GLU 101 3.698 3.578 12.404
736 HA GLU 101 HA GLU 101 4.331 5.932 11.127
737 1HB GLU 101 2HB GLU 101 6.358 5.988 12.572
738 2HB GLU 101 3HB GLU 101 4.823 5.680 13.388
739 1HG GLU 101 2HG GLU 101 5.418 3.165 13.255
740 2HG GLU 101 3HG GLU 101 7.042 3.709 12.797
741 H GLU 102 H GLU 102 6.205 2.907 10.998
742 HA GLU 102 HA GLU 102 8.157 3.548 9.136
743 1HB GLU 102 2HB GLU 102 6.909 1.089 10.133
744 2HB GLU 102 3HB GLU 102 7.421 0.934 8.440
745 1HG GLU 102 2HG GLU 102 9.689 1.677 9.094
746 2HG GLU 102 3HG GLU 102 9.191 1.661 10.792
747 H PHE 103 H PHE 103 4.812 2.314 8.334
748 HA PHE 103 HA PHE 103 5.432 2.592 5.502
749 1HB PHE 103 2HB PHE 103 3.173 1.562 7.020
750 2HB PHE 103 3HB PHE 103 2.643 2.613 5.692
751 HD1 PHE 103 1HD PHE 103 2.638 -0.600 6.250
752 HD2 PHE 103 2HD PHE 103 4.279 2.230 3.447
753 HE1 PHE 103 1HE PHE 103 2.390 -2.261 4.433
754 HE2 PHE 103 2HE PHE 103 4.003 0.575 1.626
755 HZ PHE 103 HZ PHE 103 3.045 -1.669 2.110
756 H GLN 104 H GLN 104 3.860 4.734 7.891
757 HA GLN 104 HA GLN 104 2.671 6.651 6.084
758 1HB GLN 104 2HB GLN 104 2.358 6.459 8.654
759 2HB GLN 104 3HB GLN 104 3.903 7.289 8.786
760 1HG GLN 104 2HG GLN 104 2.417 8.783 6.857
761 2HG GLN 104 3HG GLN 104 1.236 8.313 8.078
762 1HE2 GLN 104 1HE2 GLN 104 3.797 10.458 7.272
763 2HE2 GLN 104 2HE2 GLN 104 3.934 11.234 8.843
764 H GLU 105 H GLU 105 5.951 6.555 7.707
765 HA GLU 105 HA GLU 105 6.955 8.894 6.518
766 1HB GLU 105 2HB GLU 105 8.216 6.276 7.403
767 2HB GLU 105 3HB GLU 105 9.211 7.477 6.575
768 1HG GLU 105 2HG GLU 105 7.550 8.308 8.971
769 2HG GLU 105 3HG GLU 105 9.126 7.525 9.159
770 H MET 106 H MET 106 7.136 5.551 5.225
771 HA MET 106 HA MET 106 8.402 6.354 2.817
772 1HB MET 106 2HB MET 106 7.483 3.886 3.977
773 2HB MET 106 3HB MET 106 6.886 3.963 2.320
774 1HG MET 106 2HG MET 106 9.147 2.981 2.403
775 2HG MET 106 3HG MET 106 9.172 4.510 1.523
776 1HE MET 106 1HE MET 106 11.764 4.812 1.628
777 2HE MET 106 2HE MET 106 12.709 4.578 3.118
778 3HE MET 106 3HE MET 106 11.861 3.203 2.384
779 H VAL 107 H VAL 107 4.956 5.612 3.343
780 HA VAL 107 HA VAL 107 3.974 6.292 0.818
781 HB VAL 107 HB VAL 107 2.736 6.458 3.581
782 1HG1 VAL 107 1HG1 VAL 107 0.543 6.597 2.279
783 2HG1 VAL 107 2HG1 VAL 107 1.494 8.086 2.321
784 3HG1 VAL 107 3HG1 VAL 107 1.527 7.064 0.870
785 1HG2 VAL 107 1HG2 VAL 107 1.549 4.452 2.828
786 2HG2 VAL 107 2HG2 VAL 107 2.246 4.600 1.202
787 3HG2 VAL 107 3HG2 VAL 107 3.284 4.194 2.578
788 H HIS 108 H HIS 108 4.701 8.434 3.571
789 HA HIS 108 HA HIS 108 3.373 10.691 2.475
790 1HB HIS 108 2HB HIS 108 3.590 10.262 4.856
791 2HB HIS 108 3HB HIS 108 5.356 10.419 4.752
792 HD1 HIS 108 1HD HIS 108 5.832 12.564 6.070
793 HD2 HIS 108 2HD HIS 108 2.449 12.803 3.576
794 HE1 HIS 108 1HE HIS 108 4.848 14.904 6.385
795 H SER 109 H SER 109 6.376 9.200 1.765
796 HA SER 109 HA SER 109 7.982 11.516 1.303
797 1HB SER 109 2HB SER 109 8.915 9.223 1.678
798 2HB SER 109 3HB SER 109 8.223 8.737 0.108
799 HG SER 109 HG SER 109 9.410 10.671 -0.688
Start of MODEL 14
1 1H MET 1 H1 MET 1 -18.896 9.234 1.761
2 2H MET 1 H2 MET 1 -19.975 8.911 0.522
3 3H MET 1 H3 MET 1 -19.724 7.828 1.762
4 HA MET 1 HA MET 1 -18.602 7.081 -0.185
5 1HB MET 1 2HB MET 1 -16.973 9.654 0.216
6 2HB MET 1 3HB MET 1 -16.614 8.372 -0.923
7 1HG MET 1 2HG MET 1 -18.970 10.280 -1.018
8 2HG MET 1 3HG MET 1 -17.654 10.108 -2.181
9 1HE MET 1 1HE MET 1 -20.819 10.238 -2.899
10 2HE MET 1 2HE MET 1 -19.518 10.148 -4.118
11 3HE MET 1 3HE MET 1 -20.874 8.999 -4.176
12 H SER 2 H SER 2 -16.328 6.238 -0.036
13 HA SER 2 HA SER 2 -15.133 6.301 2.661
14 1HB SER 2 2HB SER 2 -15.734 3.752 1.080
15 2HB SER 2 3HB SER 2 -14.890 3.850 2.642
16 HG SER 2 HG SER 2 -17.122 3.341 2.886
17 H ILE 3 H ILE 3 -12.928 4.960 2.244
18 HA ILE 3 HA ILE 3 -11.262 6.441 0.660
19 HB ILE 3 HB ILE 3 -9.622 4.643 0.875
20 1HG1 ILE 3 2HG1 ILE 3 -10.596 2.590 2.334
21 2HG1 ILE 3 3HG1 ILE 3 -12.045 2.903 1.391
22 1HG2 ILE 3 1HG2 ILE 3 -11.354 4.793 3.369
23 2HG2 ILE 3 2HG2 ILE 3 -9.612 4.515 3.275
24 3HG2 ILE 3 3HG2 ILE 3 -10.276 6.096 2.812
25 1HD1 ILE 3 1HD1 ILE 3 -9.296 2.003 0.540
26 2HD1 ILE 3 2HD1 ILE 3 -10.869 1.288 0.139
27 3HD1 ILE 3 3HD1 ILE 3 -10.336 2.778 -0.666
28 H THR 4 H THR 4 -13.136 3.624 -0.429
29 HA THR 4 HA THR 4 -12.010 3.595 -3.114
30 HB THR 4 HB THR 4 -12.330 1.440 -2.188
31 HG1 THR 4 1HG THR 4 -14.655 2.184 -3.519
32 1HG2 THR 4 1HG2 THR 4 -13.663 1.790 -0.172
33 2HG2 THR 4 2HG2 THR 4 -15.044 2.383 -1.141
34 3HG2 THR 4 3HG2 THR 4 -14.540 0.688 -1.225
35 H ASP 5 H ASP 5 -12.800 6.015 -2.786
36 HA ASP 5 HA ASP 5 -14.629 6.577 -4.749
37 1HB ASP 5 2HB ASP 5 -15.972 6.380 -2.052
38 2HB ASP 5 3HB ASP 5 -16.347 7.799 -3.052
39 H VAL 6 H VAL 6 -13.689 7.649 -1.509
40 HA VAL 6 HA VAL 6 -13.959 10.316 -1.641
41 HB VAL 6 HB VAL 6 -12.777 8.565 0.131
42 1HG1 VAL 6 1HG1 VAL 6 -10.673 9.358 0.909
43 2HG1 VAL 6 2HG1 VAL 6 -10.521 8.748 -0.739
44 3HG1 VAL 6 3HG1 VAL 6 -10.550 10.509 -0.425
45 1HG2 VAL 6 1HG2 VAL 6 -14.160 10.494 0.708
46 2HG2 VAL 6 2HG2 VAL 6 -12.688 10.437 1.693
47 3HG2 VAL 6 3HG2 VAL 6 -12.801 11.585 0.341
48 H LEU 7 H LEU 7 -11.278 8.559 -2.974
49 HA LEU 7 HA LEU 7 -10.368 10.534 -4.826
50 1HB LEU 7 2HB LEU 7 -9.595 11.718 -2.829
51 2HB LEU 7 3HB LEU 7 -8.910 10.252 -2.153
52 HG LEU 7 HG LEU 7 -7.697 10.636 -4.758
53 1HD1 LEU 7 1HD1 LEU 7 -7.687 13.056 -2.893
54 2HD1 LEU 7 2HD1 LEU 7 -6.657 12.862 -4.337
55 3HD1 LEU 7 3HD1 LEU 7 -8.426 12.991 -4.507
56 1HD2 LEU 7 1HD2 LEU 7 -6.573 11.059 -1.958
57 2HD2 LEU 7 2HD2 LEU 7 -6.696 9.480 -2.778
58 3HD2 LEU 7 3HD2 LEU 7 -5.649 10.740 -3.438
59 H SER 8 H SER 8 -9.036 8.157 -2.487
60 HA SER 8 HA SER 8 -7.138 7.054 -3.966
61 1HB SER 8 2HB SER 8 -8.789 5.441 -2.027
62 2HB SER 8 3HB SER 8 -7.041 5.353 -2.363
63 HG SER 8 HG SER 8 -6.841 7.436 -1.481
64 H ALA 9 H ALA 9 -10.566 6.233 -4.383
65 HA ALA 9 HA ALA 9 -10.387 3.857 -5.879
66 1HB ALA 9 1HB ALA 9 -12.519 4.769 -5.284
67 2HB ALA 9 2HB ALA 9 -12.210 6.269 -6.193
68 3HB ALA 9 3HB ALA 9 -12.435 4.726 -7.047
69 H ASP 10 H ASP 10 -9.856 7.243 -6.993
70 HA ASP 10 HA ASP 10 -9.584 6.515 -9.784
71 1HB ASP 10 2HB ASP 10 -10.219 8.779 -8.798
72 2HB ASP 10 3HB ASP 10 -8.524 8.984 -8.337
73 H ASP 11 H ASP 11 -7.429 7.006 -7.002
74 HA ASP 11 HA ASP 11 -4.964 6.953 -8.449
75 1HB ASP 11 2HB ASP 11 -5.489 6.330 -5.507
76 2HB ASP 11 3HB ASP 11 -3.947 6.662 -6.297
77 H ILE 12 H ILE 12 -6.707 4.416 -6.523
78 HA ILE 12 HA ILE 12 -4.896 2.367 -7.159
79 HB ILE 12 HB ILE 12 -6.529 0.839 -6.489
80 1HG1 ILE 12 2HG1 ILE 12 -8.468 3.076 -6.540
81 2HG1 ILE 12 3HG1 ILE 12 -8.567 1.544 -7.403
82 1HG2 ILE 12 1HG2 ILE 12 -5.154 2.076 -4.842
83 2HG2 ILE 12 2HG2 ILE 12 -6.521 3.159 -4.546
84 3HG2 ILE 12 3HG2 ILE 12 -6.652 1.428 -4.182
85 1HD1 ILE 12 1HD1 ILE 12 -10.136 1.356 -5.663
86 2HD1 ILE 12 2HD1 ILE 12 -8.731 0.457 -5.059
87 3HD1 ILE 12 3HD1 ILE 12 -9.051 2.123 -4.492
88 H ALA 13 H ALA 13 -7.875 3.455 -8.909
89 HA ALA 13 HA ALA 13 -7.819 1.491 -10.916
90 1HB ALA 13 1HB ALA 13 -8.646 4.415 -11.051
91 2HB ALA 13 2HB ALA 13 -8.882 3.255 -12.368
92 3HB ALA 13 3HB ALA 13 -9.668 2.987 -10.797
93 H ALA 14 H ALA 14 -5.902 4.552 -10.722
94 HA ALA 14 HA ALA 14 -4.450 4.060 -13.159
95 1HB ALA 14 1HB ALA 14 -3.481 5.548 -10.688
96 2HB ALA 14 2HB ALA 14 -2.789 5.609 -12.315
97 3HB ALA 14 3HB ALA 14 -4.425 6.249 -12.020
98 H ALA 15 H ALA 15 -3.619 3.306 -9.737
99 HA ALA 15 HA ALA 15 -1.124 2.220 -10.120
100 1HB ALA 15 1HB ALA 15 -3.076 1.134 -8.060
101 2HB ALA 15 2HB ALA 15 -1.314 1.320 -7.953
102 3HB ALA 15 3HB ALA 15 -2.359 2.748 -7.909
103 H LEU 16 H LEU 16 -4.230 0.608 -10.248
104 HA LEU 16 HA LEU 16 -3.538 -2.056 -10.633
105 1HB LEU 16 2HB LEU 16 -5.799 -1.569 -10.297
106 2HB LEU 16 3HB LEU 16 -5.799 -0.265 -11.474
107 HG LEU 16 HG LEU 16 -5.760 -1.857 -13.340
108 1HD1 LEU 16 1HD1 LEU 16 -4.671 -3.816 -12.214
109 2HD1 LEU 16 2HD1 LEU 16 -6.108 -4.002 -11.189
110 3HD1 LEU 16 3HD1 LEU 16 -6.226 -4.237 -12.945
111 1HD2 LEU 16 1HD2 LEU 16 -8.088 -2.560 -13.072
112 2HD2 LEU 16 2HD2 LEU 16 -7.982 -2.328 -11.313
113 3HD2 LEU 16 3HD2 LEU 16 -7.860 -0.935 -12.402
114 H GLN 17 H GLN 17 -3.726 0.603 -13.037
115 HA GLN 17 HA GLN 17 -2.879 -1.203 -15.214
116 1HB GLN 17 2HB GLN 17 -3.883 1.630 -15.032
117 2HB GLN 17 3HB GLN 17 -2.866 1.176 -16.408
118 1HG GLN 17 2HG GLN 17 -4.324 -0.730 -16.933
119 2HG GLN 17 3HG GLN 17 -5.401 -0.295 -15.594
120 1HE2 GLN 17 1HE2 GLN 17 -6.686 1.666 -15.804
121 2HE2 GLN 17 2HE2 GLN 17 -6.905 2.413 -17.380
122 H GLU 18 H GLU 18 -1.311 1.215 -13.086
123 HA GLU 18 HA GLU 18 0.999 1.281 -14.855
124 1HB GLU 18 2HB GLU 18 1.971 2.769 -13.480
125 2HB GLU 18 3HB GLU 18 0.260 3.057 -13.264
126 1HG GLU 18 2HG GLU 18 0.848 3.164 -11.131
127 2HG GLU 18 3HG GLU 18 0.626 1.402 -11.166
128 H CYS 19 H CYS 19 0.054 -0.673 -12.046
129 HA CYS 19 HA CYS 19 2.421 -2.445 -12.320
130 1HB CYS 19 2HB CYS 19 0.117 -2.248 -10.344
131 2HB CYS 19 3HB CYS 19 1.245 -3.610 -10.353
132 HG CYS 19 HG CYS 19 2.233 -0.471 -10.206
133 H ARG 20 H ARG 20 0.693 -2.442 -14.672
134 HA ARG 20 HA ARG 20 -0.869 -4.930 -14.479
135 1HB ARG 20 2HB ARG 20 -1.371 -4.872 -16.683
136 2HB ARG 20 3HB ARG 20 -1.485 -3.196 -16.174
137 1HG ARG 20 2HG ARG 20 0.987 -4.321 -17.665
138 2HG ARG 20 3HG ARG 20 -0.468 -3.779 -18.485
139 1HD ARG 20 2HD ARG 20 -0.417 -1.679 -17.547
140 2HD ARG 20 3HD ARG 20 1.044 -2.006 -16.534
141 HE ARG 20 HE ARG 20 2.148 -2.423 -18.829
142 1HH1 ARG 20 2HH2 ARG 20 0.338 0.178 -17.387
143 2HH1 ARG 20 1HH2 ARG 20 0.670 1.387 -18.601
144 1HH2 ARG 20 2HH1 ARG 20 2.478 -0.926 -20.663
145 2HH2 ARG 20 1HH1 ARG 20 1.969 0.735 -20.537
146 H ASP 21 H ASP 21 2.339 -3.884 -15.457
147 HA ASP 21 HA ASP 21 3.114 -6.481 -16.490
148 1HB ASP 21 2HB ASP 21 4.381 -3.737 -16.202
149 2HB ASP 21 3HB ASP 21 5.342 -5.151 -16.666
150 HA PRO 22 HA PRO 22 4.426 -7.996 -12.526
151 1HB PRO 22 2HB PRO 22 6.178 -9.993 -13.198
152 2HB PRO 22 3HB PRO 22 4.436 -10.121 -13.559
153 1HG PRO 22 2HG PRO 22 6.642 -9.163 -15.403
154 2HG PRO 22 3HG PRO 22 5.397 -10.401 -15.753
155 1HD PRO 22 2HD PRO 22 5.095 -7.825 -16.566
156 2HD PRO 22 3HD PRO 22 3.694 -8.736 -15.929
157 H ASP 23 H ASP 23 6.072 -8.022 -10.977
158 HA ASP 23 HA ASP 23 7.633 -7.063 -9.860
159 1HB ASP 23 2HB ASP 23 9.329 -7.652 -12.327
160 2HB ASP 23 3HB ASP 23 9.944 -7.402 -10.693
161 H THR 24 H THR 24 6.158 -5.169 -11.801
162 HA THR 24 HA THR 24 8.132 -3.094 -12.430
163 HB THR 24 HB THR 24 5.150 -3.410 -12.934
164 HG1 THR 24 1HG THR 24 5.855 -4.050 -14.901
165 1HG2 THR 24 1HG2 THR 24 5.415 -1.573 -14.594
166 2HG2 THR 24 2HG2 THR 24 5.562 -1.014 -12.926
167 3HG2 THR 24 3HG2 THR 24 7.024 -1.227 -13.920
168 H PHE 25 H PHE 25 5.775 -3.789 -9.983
169 HA PHE 25 HA PHE 25 5.065 -1.288 -8.994
170 1HB PHE 25 2HB PHE 25 4.342 -3.621 -8.288
171 2HB PHE 25 3HB PHE 25 5.839 -3.734 -7.370
172 HD1 PHE 25 1HD PHE 25 2.429 -3.181 -7.029
173 HD2 PHE 25 2HD PHE 25 6.214 -1.583 -5.675
174 HE1 PHE 25 1HE PHE 25 1.344 -2.263 -5.012
175 HE2 PHE 25 2HE PHE 25 5.081 -0.498 -3.803
176 HZ PHE 25 HZ PHE 25 2.638 -0.863 -3.441
177 H GLU 26 H GLU 26 6.268 0.357 -8.302
178 HA GLU 26 HA GLU 26 8.831 -0.160 -6.855
179 1HB GLU 26 2HB GLU 26 8.248 1.722 -9.041
180 2HB GLU 26 3HB GLU 26 8.671 2.580 -7.562
181 1HG GLU 26 2HG GLU 26 10.698 0.716 -7.624
182 2HG GLU 26 3HG GLU 26 10.389 0.982 -9.339
183 HA PRO 27 HA PRO 27 6.775 1.364 -3.326
184 1HB PRO 27 2HB PRO 27 8.747 2.587 -1.854
185 2HB PRO 27 3HB PRO 27 8.616 0.829 -2.129
186 1HG PRO 27 2HG PRO 27 10.390 2.783 -3.647
187 2HG PRO 27 3HG PRO 27 10.841 1.205 -2.996
188 1HD PRO 27 2HD PRO 27 10.174 1.512 -5.571
189 2HD PRO 27 3HD PRO 27 9.713 0.036 -4.670
190 H GLN 28 H GLN 28 9.061 4.089 -4.010
191 HA GLN 28 HA GLN 28 7.304 6.147 -3.220
192 1HB GLN 28 2HB GLN 28 9.641 6.136 -5.165
193 2HB GLN 28 3HB GLN 28 8.798 7.603 -4.638
194 1HG GLN 28 2HG GLN 28 9.327 7.150 -2.294
195 2HG GLN 28 3HG GLN 28 10.148 5.643 -2.724
196 1HE2 GLN 28 1HE2 GLN 28 12.008 5.921 -4.417
197 2HE2 GLN 28 2HE2 GLN 28 13.006 7.341 -4.164
198 H LYS 29 H LYS 29 7.888 4.762 -6.441
199 HA LYS 29 HA LYS 29 6.145 6.239 -8.021
200 1HB LYS 29 2HB LYS 29 7.663 4.344 -8.781
201 2HB LYS 29 3HB LYS 29 6.511 3.208 -8.067
202 1HG LYS 29 2HG LYS 29 5.897 3.185 -10.304
203 2HG LYS 29 3HG LYS 29 4.730 4.287 -9.603
204 1HD LYS 29 2HD LYS 29 6.663 6.097 -10.243
205 2HD LYS 29 3HD LYS 29 7.104 4.813 -11.382
206 1HE LYS 29 2HE LYS 29 4.720 4.821 -12.228
207 2HE LYS 29 3HE LYS 29 4.346 6.130 -11.094
208 1HZ LYS 29 1HZ LYS 29 6.200 6.206 -13.373
209 2HZ LYS 29 2HZ LYS 29 4.772 7.010 -13.219
210 3HZ LYS 29 3HZ LYS 29 6.057 7.431 -12.275
211 H PHE 30 H PHE 30 5.309 3.147 -6.322
212 HA PHE 30 HA PHE 30 2.571 3.324 -6.878
213 1HB PHE 30 2HB PHE 30 3.686 1.258 -6.223
214 2HB PHE 30 3HB PHE 30 3.993 1.901 -4.608
215 HD1 PHE 30 1HD PHE 30 2.184 2.066 -2.955
216 HD2 PHE 30 2HD PHE 30 1.429 0.638 -6.961
217 HE1 PHE 30 1HE PHE 30 -0.086 1.334 -2.271
218 HE2 PHE 30 2HE PHE 30 -0.828 -0.110 -6.256
219 HZ PHE 30 HZ PHE 30 -1.638 0.390 -3.976
220 H PHE 31 H PHE 31 4.380 4.461 -3.973
221 HA PHE 31 HA PHE 31 2.106 5.149 -2.454
222 1HB PHE 31 2HB PHE 31 4.884 6.391 -2.466
223 2HB PHE 31 3HB PHE 31 3.648 6.715 -1.252
224 HD1 PHE 31 1HD PHE 31 2.473 4.246 -0.455
225 HD2 PHE 31 2HD PHE 31 6.595 5.202 -1.308
226 HE1 PHE 31 1HE PHE 31 3.212 2.707 1.317
227 HE2 PHE 31 2HE PHE 31 7.317 3.512 0.334
228 HZ PHE 31 HZ PHE 31 5.632 2.362 1.746
229 H GLN 32 H GLN 32 3.783 7.042 -5.013
230 HA GLN 32 HA GLN 32 1.902 9.276 -4.641
231 1HB GLN 32 2HB GLN 32 4.161 8.674 -6.503
232 2HB GLN 32 3HB GLN 32 2.811 9.592 -7.185
233 1HG GLN 32 2HG GLN 32 2.914 11.183 -5.259
234 2HG GLN 32 3HG GLN 32 4.386 10.368 -4.700
235 1HE2 GLN 32 1HE2 GLN 32 6.194 10.250 -6.427
236 2HE2 GLN 32 2HE2 GLN 32 6.358 11.665 -7.459
237 H THR 33 H THR 33 2.171 6.507 -6.955
238 HA THR 33 HA THR 33 0.063 7.338 -8.559
239 HB THR 33 HB THR 33 1.958 5.244 -8.545
240 HG1 THR 33 1HG THR 33 -0.158 5.924 -10.211
241 1HG2 THR 33 1HG2 THR 33 0.290 3.751 -7.364
242 2HG2 THR 33 2HG2 THR 33 -0.750 3.987 -8.791
243 3HG2 THR 33 3HG2 THR 33 0.839 3.200 -8.937
244 H SER 34 H SER 34 0.054 5.597 -5.564
245 HA SER 34 HA SER 34 -2.726 4.760 -5.735
246 1HB SER 34 2HB SER 34 -0.840 3.344 -4.881
247 2HB SER 34 3HB SER 34 -0.716 4.422 -3.480
248 HG SER 34 HG SER 34 -2.040 2.545 -3.138
249 H GLY 35 H GLY 35 -1.215 7.670 -4.996
250 1HA GLY 35 1HA GLY 35 -2.415 9.573 -4.460
251 2HA GLY 35 2HA GLY 35 -3.695 8.612 -3.705
252 H LEU 36 H LEU 36 -2.024 7.016 -2.072
253 HA LEU 36 HA LEU 36 -1.945 8.079 0.331
254 1HB LEU 36 2HB LEU 36 -0.091 6.086 -0.976
255 2HB LEU 36 3HB LEU 36 0.275 6.657 0.637
256 HG LEU 36 HG LEU 36 -2.259 6.127 1.159
257 1HD1 LEU 36 1HD1 LEU 36 -1.682 4.210 -1.129
258 2HD1 LEU 36 2HD1 LEU 36 -3.033 4.084 0.015
259 3HD1 LEU 36 3HD1 LEU 36 -2.952 5.461 -1.080
260 1HD2 LEU 36 1HD2 LEU 36 -1.602 3.929 1.951
261 2HD2 LEU 36 2HD2 LEU 36 -0.147 3.954 0.921
262 3HD2 LEU 36 3HD2 LEU 36 -0.317 5.105 2.266
263 H SER 37 H SER 37 0.935 8.656 -1.809
264 HA SER 37 HA SER 37 2.269 10.124 0.307
265 1HB SER 37 2HB SER 37 3.411 8.936 -1.599
266 2HB SER 37 3HB SER 37 2.848 10.235 -2.670
267 HG SER 37 HG SER 37 4.512 10.514 -0.365
268 H LYS 38 H LYS 38 -0.157 10.989 -2.034
269 HA LYS 38 HA LYS 38 0.393 13.856 -1.871
270 1HB LYS 38 2HB LYS 38 -0.714 12.241 -3.825
271 2HB LYS 38 3HB LYS 38 -2.168 12.879 -3.069
272 1HG LYS 38 2HG LYS 38 0.178 14.521 -4.129
273 2HG LYS 38 3HG LYS 38 -1.317 14.166 -5.017
274 1HD LYS 38 2HD LYS 38 -2.660 15.409 -3.362
275 2HD LYS 38 3HD LYS 38 -1.244 15.646 -2.339
276 1HE LYS 38 2HE LYS 38 -1.730 17.693 -3.545
277 2HE LYS 38 3HE LYS 38 -0.141 17.047 -3.970
278 1HZ LYS 38 1HZ LYS 38 -2.587 16.751 -5.594
279 2HZ LYS 38 2HZ LYS 38 -1.353 17.797 -5.894
280 3HZ LYS 38 3HZ LYS 38 -1.095 16.179 -5.993
281 H MET 39 H MET 39 -1.800 11.330 -0.696
282 HA MET 39 HA MET 39 -3.671 12.942 0.648
283 1HB MET 39 2HB MET 39 -2.756 10.082 0.806
284 2HB MET 39 3HB MET 39 -3.613 10.706 2.197
285 1HG MET 39 2HG MET 39 -5.484 11.400 0.756
286 2HG MET 39 3HG MET 39 -4.679 10.652 -0.639
287 1HE MET 39 1HE MET 39 -7.596 10.251 1.200
288 2HE MET 39 2HE MET 39 -7.477 9.575 -0.437
289 3HE MET 39 3HE MET 39 -7.893 8.520 0.927
290 H SER 40 H SER 40 -3.768 13.777 2.783
291 HA SER 40 HA SER 40 -1.363 14.425 4.113
292 1HB SER 40 2HB SER 40 -4.150 14.220 5.334
293 2HB SER 40 3HB SER 40 -2.843 15.325 5.797
294 HG SER 40 HG SER 40 -3.070 16.221 3.631
295 H ALA 41 H ALA 41 -0.447 13.547 5.977
296 HA ALA 41 HA ALA 41 -0.166 10.928 6.607
297 1HB ALA 41 1HB ALA 41 -0.370 13.331 8.472
298 2HB ALA 41 2HB ALA 41 0.205 11.737 8.978
299 3HB ALA 41 3HB ALA 41 1.099 12.645 7.736
300 H ASN 42 H ASN 42 -2.817 13.021 7.760
301 HA ASN 42 HA ASN 42 -4.129 11.280 9.517
302 1HB ASN 42 2HB ASN 42 -5.491 13.230 7.601
303 2HB ASN 42 3HB ASN 42 -6.090 12.661 9.160
304 1HD2 ASN 42 1HD2 ASN 42 -5.544 13.946 10.968
305 2HD2 ASN 42 2HD2 ASN 42 -4.349 15.230 10.905
306 H GLN 43 H GLN 43 -4.789 11.783 6.019
307 HA GLN 43 HA GLN 43 -6.811 9.736 5.833
308 1HB GLN 43 2HB GLN 43 -5.138 11.076 3.696
309 2HB GLN 43 3HB GLN 43 -6.548 10.037 3.423
310 1HG GLN 43 2HG GLN 43 -6.549 12.711 4.894
311 2HG GLN 43 3HG GLN 43 -7.115 12.434 3.248
312 1HE2 GLN 43 1HE2 GLN 43 -8.891 10.611 3.068
313 2HE2 GLN 43 2HE2 GLN 43 -10.109 10.678 4.329
314 H VAL 44 H VAL 44 -3.201 9.783 5.327
315 HA VAL 44 HA VAL 44 -3.076 7.164 4.192
316 HB VAL 44 HB VAL 44 -1.121 8.881 5.785
317 1HG1 VAL 44 1HG1 VAL 44 0.667 7.419 4.904
318 2HG1 VAL 44 2HG1 VAL 44 -0.368 6.576 6.054
319 3HG1 VAL 44 3HG1 VAL 44 -0.565 6.281 4.312
320 1HG2 VAL 44 1HG2 VAL 44 -1.871 9.739 3.540
321 2HG2 VAL 44 2HG2 VAL 44 -0.156 9.359 3.604
322 3HG2 VAL 44 3HG2 VAL 44 -1.290 8.232 2.817
323 H LYS 45 H LYS 45 -2.981 8.364 7.587
324 HA LYS 45 HA LYS 45 -2.476 5.775 8.688
325 1HB LYS 45 2HB LYS 45 -1.951 8.006 9.659
326 2HB LYS 45 3HB LYS 45 -3.655 8.206 10.092
327 1HG LYS 45 2HG LYS 45 -3.542 6.414 11.677
328 2HG LYS 45 3HG LYS 45 -2.058 5.755 10.952
329 1HD LYS 45 2HD LYS 45 -0.794 7.748 11.588
330 2HD LYS 45 3HD LYS 45 -2.232 8.467 12.335
331 1HE LYS 45 2HE LYS 45 -2.265 6.697 14.038
332 2HE LYS 45 3HE LYS 45 -0.981 5.806 13.198
333 1HZ LYS 45 1HZ LYS 45 0.518 7.612 13.638
334 2HZ LYS 45 2HZ LYS 45 -0.652 8.464 14.421
335 3HZ LYS 45 3HZ LYS 45 -0.106 7.042 15.045
336 H ASP 46 H ASP 46 -5.493 7.668 8.165
337 HA ASP 46 HA ASP 46 -7.307 5.774 9.240
338 1HB ASP 46 2HB ASP 46 -7.514 7.941 7.141
339 2HB ASP 46 3HB ASP 46 -8.832 6.785 7.345
340 H VAL 47 H VAL 47 -6.278 6.131 5.771
341 HA VAL 47 HA VAL 47 -7.644 3.808 4.942
342 HB VAL 47 HB VAL 47 -6.378 3.782 2.939
343 1HG1 VAL 47 1HG1 VAL 47 -6.384 6.696 3.061
344 2HG1 VAL 47 2HG1 VAL 47 -7.382 5.592 2.115
345 3HG1 VAL 47 3HG1 VAL 47 -7.848 6.003 3.776
346 1HG2 VAL 47 1HG2 VAL 47 -4.421 5.610 4.152
347 2HG2 VAL 47 2HG2 VAL 47 -4.114 3.951 3.605
348 3HG2 VAL 47 3HG2 VAL 47 -4.498 5.218 2.427
349 H PHE 48 H PHE 48 -4.278 4.150 6.140
350 HA PHE 48 HA PHE 48 -3.431 1.490 6.069
351 1HB PHE 48 2HB PHE 48 -2.101 3.427 6.842
352 2HB PHE 48 3HB PHE 48 -2.965 3.397 8.370
353 HD1 PHE 48 1HD PHE 48 -0.491 1.711 6.239
354 HD2 PHE 48 2HD PHE 48 -2.672 1.438 9.941
355 HE1 PHE 48 1HE PHE 48 1.244 0.192 7.144
356 HE2 PHE 48 2HE PHE 48 -1.009 -0.188 10.778
357 HZ PHE 48 HZ PHE 48 1.015 -0.724 9.443
358 H ARG 49 H ARG 49 -5.177 3.019 8.858
359 HA ARG 49 HA ARG 49 -5.602 0.604 10.249
360 1HB ARG 49 2HB ARG 49 -6.987 3.302 10.300
361 2HB ARG 49 3HB ARG 49 -7.580 1.936 11.259
362 1HG ARG 49 2HG ARG 49 -5.363 1.631 12.276
363 2HG ARG 49 3HG ARG 49 -4.750 3.059 11.413
364 1HD ARG 49 2HD ARG 49 -6.168 4.531 12.633
365 2HD ARG 49 3HD ARG 49 -7.235 3.203 13.149
366 HE ARG 49 HE ARG 49 -4.650 2.680 14.165
367 1HH1 ARG 49 2HH2 ARG 49 -7.311 4.925 14.637
368 2HH1 ARG 49 1HH2 ARG 49 -7.155 5.033 16.363
369 1HH2 ARG 49 2HH1 ARG 49 -4.407 2.751 16.467
370 2HH2 ARG 49 1HH1 ARG 49 -5.420 3.780 17.425
371 H PHE 50 H PHE 50 -7.667 2.018 7.664
372 HA PHE 50 HA PHE 50 -9.801 0.106 8.114
373 1HB PHE 50 2HB PHE 50 -8.985 1.799 5.736
374 2HB PHE 50 3HB PHE 50 -10.221 0.561 5.587
375 HD1 PHE 50 1HD PHE 50 -12.216 0.555 7.204
376 HD2 PHE 50 2HD PHE 50 -9.670 3.983 6.576
377 HE1 PHE 50 1HE PHE 50 -13.993 2.043 8.076
378 HE2 PHE 50 2HE PHE 50 -11.424 5.455 7.512
379 HZ PHE 50 HZ PHE 50 -13.601 4.496 8.235
380 H ILE 51 H ILE 51 -6.981 0.097 5.879
381 HA ILE 51 HA ILE 51 -7.783 -2.485 4.827
382 HB ILE 51 HB ILE 51 -5.240 -0.911 4.396
383 1HG1 ILE 51 2HG1 ILE 51 -7.199 0.474 3.776
384 2HG1 ILE 51 3HG1 ILE 51 -6.243 -0.006 2.397
385 1HG2 ILE 51 1HG2 ILE 51 -6.554 -3.204 2.869
386 2HG2 ILE 51 2HG2 ILE 51 -5.291 -2.187 2.174
387 3HG2 ILE 51 3HG2 ILE 51 -4.952 -3.185 3.603
388 1HD1 ILE 51 1HD1 ILE 51 -8.657 -0.085 1.961
389 2HD1 ILE 51 2HD1 ILE 51 -7.970 -1.708 1.830
390 3HD1 ILE 51 3HD1 ILE 51 -8.899 -1.235 3.279
391 H ASP 52 H ASP 52 -5.763 -1.442 7.400
392 HA ASP 52 HA ASP 52 -4.028 -3.455 8.002
393 1HB ASP 52 2HB ASP 52 -4.375 -1.270 9.196
394 2HB ASP 52 3HB ASP 52 -5.870 -1.928 9.890
395 H ASN 53 H ASN 53 -7.495 -3.559 8.303
396 HA ASN 53 HA ASN 53 -8.876 -5.272 8.133
397 1HB ASN 53 2HB ASN 53 -7.059 -6.277 6.725
398 2HB ASN 53 3HB ASN 53 -6.480 -7.164 8.138
399 1HD2 ASN 53 1HD2 ASN 53 -9.696 -6.523 6.545
400 2HD2 ASN 53 2HD2 ASN 53 -10.152 -8.217 6.563
401 H ASP 54 H ASP 54 -6.300 -6.256 10.386
402 HA ASP 54 HA ASP 54 -8.151 -7.392 12.357
403 1HB ASP 54 2HB ASP 54 -6.108 -7.428 13.803
404 2HB ASP 54 3HB ASP 54 -5.947 -8.325 12.288
405 H GLN 55 H GLN 55 -6.335 -4.466 11.844
406 HA GLN 55 HA GLN 55 -6.759 -2.282 12.273
407 1HB GLN 55 2HB GLN 55 -8.552 -1.370 13.208
408 2HB GLN 55 3HB GLN 55 -9.206 -2.940 12.777
409 1HG GLN 55 2HG GLN 55 -8.597 -3.544 15.312
410 2HG GLN 55 3HG GLN 55 -8.485 -1.799 15.481
411 1HE2 GLN 55 1HE2 GLN 55 -10.318 -1.151 16.559
412 2HE2 GLN 55 2HE2 GLN 55 -11.938 -1.644 16.094
413 H SER 56 H SER 56 -4.853 -4.242 13.288
414 HA SER 56 HA SER 56 -4.402 -3.689 16.118
415 1HB SER 56 2HB SER 56 -2.455 -5.146 15.840
416 2HB SER 56 3HB SER 56 -3.920 -5.879 15.164
417 HG SER 56 HG SER 56 -2.731 -6.101 13.457
418 H GLY 57 H GLY 57 -3.298 -2.261 13.124
419 1HA GLY 57 1HA GLY 57 -2.082 -0.280 12.935
420 2HA GLY 57 2HA GLY 57 -1.374 -0.490 14.538
421 H TYR 58 H TYR 58 -1.458 -3.170 12.195
422 HA TYR 58 HA TYR 58 1.397 -2.786 11.478
423 1HB TYR 58 2HB TYR 58 0.281 -5.135 13.043
424 2HB TYR 58 3HB TYR 58 1.731 -5.259 12.056
425 HD1 TYR 58 HD1 TYR 58 0.522 -4.342 15.306
426 HD2 TYR 58 HD2 TYR 58 3.654 -3.605 12.437
427 HE1 TYR 58 HE1 TYR 58 2.007 -3.527 17.123
428 HE2 TYR 58 HE2 TYR 58 5.107 -2.732 14.236
429 HH TYR 58 HH TYR 58 5.307 -2.312 16.492
430 H LEU 59 H LEU 59 1.796 -3.281 9.499
431 HA LEU 59 HA LEU 59 -0.135 -4.838 7.833
432 1HB LEU 59 2HB LEU 59 1.438 -2.298 7.442
433 2HB LEU 59 3HB LEU 59 1.295 -3.355 6.050
434 HG LEU 59 HG LEU 59 -0.455 -1.530 6.275
435 1HD1 LEU 59 1HD1 LEU 59 -1.198 -4.438 5.826
436 2HD1 LEU 59 2HD1 LEU 59 -2.232 -3.054 5.437
437 3HD1 LEU 59 3HD1 LEU 59 -0.640 -3.242 4.638
438 1HD2 LEU 59 1HD2 LEU 59 -1.884 -3.512 8.067
439 2HD2 LEU 59 2HD2 LEU 59 -1.047 -2.136 8.750
440 3HD2 LEU 59 3HD2 LEU 59 -2.375 -1.864 7.614
441 H ASP 60 H ASP 60 1.104 -6.562 9.019
442 HA ASP 60 HA ASP 60 3.647 -7.396 8.373
443 1HB ASP 60 2HB ASP 60 1.119 -9.103 8.480
444 2HB ASP 60 3HB ASP 60 2.766 -9.639 8.842
445 H GLU 61 H GLU 61 4.447 -8.997 6.746
446 HA GLU 61 HA GLU 61 4.301 -8.536 4.179
447 1HB GLU 61 2HB GLU 61 5.670 -10.195 5.496
448 2HB GLU 61 3HB GLU 61 4.354 -11.367 5.346
449 1HG GLU 61 2HG GLU 61 5.285 -10.013 2.831
450 2HG GLU 61 3HG GLU 61 6.417 -11.058 3.683
451 H GLU 62 H GLU 62 2.179 -10.923 5.778
452 HA GLU 62 HA GLU 62 0.837 -11.689 3.449
453 1HB GLU 62 2HB GLU 62 0.981 -12.713 5.938
454 2HB GLU 62 3HB GLU 62 -0.545 -11.839 6.149
455 1HG GLU 62 2HG GLU 62 -1.406 -13.057 4.116
456 2HG GLU 62 3HG GLU 62 0.120 -13.967 4.067
457 H GLU 63 H GLU 63 -0.043 -9.210 5.891
458 HA GLU 63 HA GLU 63 -2.608 -8.617 4.729
459 1HB GLU 63 2HB GLU 63 -0.774 -6.868 6.423
460 2HB GLU 63 3HB GLU 63 -2.468 -6.550 6.001
461 1HG GLU 63 2HG GLU 63 -3.083 -8.758 7.102
462 2HG GLU 63 3HG GLU 63 -1.407 -8.869 7.683
463 H LEU 64 H LEU 64 0.706 -7.335 4.257
464 HA LEU 64 HA LEU 64 -0.016 -5.378 2.325
465 1HB LEU 64 2HB LEU 64 2.481 -6.761 3.133
466 2HB LEU 64 3HB LEU 64 2.459 -6.135 1.482
467 HG LEU 64 HG LEU 64 1.596 -4.416 3.825
468 1HD1 LEU 64 1HD1 LEU 64 3.885 -5.147 4.293
469 2HD1 LEU 64 2HD1 LEU 64 4.392 -4.706 2.646
470 3HD1 LEU 64 3HD1 LEU 64 3.863 -3.447 3.784
471 1HD2 LEU 64 1HD2 LEU 64 2.135 -2.593 2.284
472 2HD2 LEU 64 2HD2 LEU 64 2.720 -3.746 1.061
473 3HD2 LEU 64 3HD2 LEU 64 0.998 -3.666 1.464
474 H LYS 65 H LYS 65 0.904 -8.788 1.952
475 HA LYS 65 HA LYS 65 0.590 -9.027 -0.842
476 1HB LYS 65 2HB LYS 65 1.772 -10.521 0.875
477 2HB LYS 65 3HB LYS 65 0.172 -11.223 1.182
478 1HG LYS 65 2HG LYS 65 0.071 -12.109 -1.076
479 2HG LYS 65 3HG LYS 65 1.396 -11.063 -1.600
480 1HD LYS 65 2HD LYS 65 2.289 -13.286 -1.350
481 2HD LYS 65 3HD LYS 65 2.987 -12.201 -0.144
482 1HE LYS 65 2HE LYS 65 1.031 -13.191 1.415
483 2HE LYS 65 3HE LYS 65 1.049 -14.499 0.232
484 1HZ LYS 65 1HZ LYS 65 3.269 -13.491 1.911
485 2HZ LYS 65 2HZ LYS 65 2.512 -14.922 2.078
486 3HZ LYS 65 3HZ LYS 65 3.489 -14.654 0.769
487 H PHE 66 H PHE 66 -1.824 -8.828 1.647
488 HA PHE 66 HA PHE 66 -3.883 -9.066 -0.507
489 1HB PHE 66 2HB PHE 66 -4.162 -9.936 2.385
490 2HB PHE 66 3HB PHE 66 -5.427 -9.998 1.161
491 HD1 PHE 66 1HD PHE 66 -4.839 -11.416 -1.038
492 HD2 PHE 66 2HD PHE 66 -2.887 -11.886 2.779
493 HE1 PHE 66 1HE PHE 66 -4.105 -13.681 -1.690
494 HE2 PHE 66 2HE PHE 66 -2.117 -14.138 2.101
495 HZ PHE 66 HZ PHE 66 -2.724 -15.044 -0.134
496 H PHE 67 H PHE 67 -2.585 -6.659 0.021
497 HA PHE 67 HA PHE 67 -4.146 -5.068 1.867
498 1HB PHE 67 2HB PHE 67 -1.800 -4.704 1.473
499 2HB PHE 67 3HB PHE 67 -2.045 -4.274 -0.193
500 HD1 PHE 67 1HD PHE 67 -2.479 -3.293 3.299
501 HD2 PHE 67 2HD PHE 67 -2.854 -1.988 -0.749
502 HE1 PHE 67 1HE PHE 67 -2.639 -0.920 4.088
503 HE2 PHE 67 2HE PHE 67 -3.185 0.346 0.006
504 HZ PHE 67 HZ PHE 67 -3.071 0.890 2.437
505 H LEU 68 H LEU 68 -3.541 -4.286 -1.602
506 HA LEU 68 HA LEU 68 -5.843 -2.710 -1.797
507 1HB LEU 68 2HB LEU 68 -4.284 -4.097 -3.961
508 2HB LEU 68 3HB LEU 68 -5.472 -2.815 -4.280
509 HG LEU 68 HG LEU 68 -2.861 -2.531 -2.787
510 1HD1 LEU 68 1HD1 LEU 68 -2.958 -2.928 -5.383
511 2HD1 LEU 68 2HD1 LEU 68 -3.465 -1.241 -5.436
512 3HD1 LEU 68 3HD1 LEU 68 -1.909 -1.712 -4.697
513 1HD2 LEU 68 1HD2 LEU 68 -3.265 -0.159 -2.699
514 2HD2 LEU 68 2HD2 LEU 68 -4.737 -0.306 -3.685
515 3HD2 LEU 68 3HD2 LEU 68 -4.686 -0.916 -2.023
516 H GLN 69 H GLN 69 -5.812 -6.080 -1.658
517 HA GLN 69 HA GLN 69 -7.995 -6.875 -3.261
518 1HB GLN 69 2HB GLN 69 -7.267 -7.700 -0.410
519 2HB GLN 69 3HB GLN 69 -8.386 -8.564 -1.475
520 1HG GLN 69 2HG GLN 69 -5.402 -8.134 -1.983
521 2HG GLN 69 3HG GLN 69 -6.192 -9.618 -1.446
522 1HE2 GLN 69 1HE2 GLN 69 -5.194 -7.821 -4.209
523 2HE2 GLN 69 2HE2 GLN 69 -5.953 -8.875 -5.391
524 H LYS 70 H LYS 70 -8.127 -5.595 0.143
525 HA LYS 70 HA LYS 70 -11.062 -5.296 -0.186
526 1HB LYS 70 2HB LYS 70 -11.165 -4.932 2.140
527 2HB LYS 70 3HB LYS 70 -10.087 -6.295 1.849
528 1HG LYS 70 2HG LYS 70 -8.338 -4.110 1.888
529 2HG LYS 70 3HG LYS 70 -9.575 -3.634 3.041
530 1HD LYS 70 2HD LYS 70 -7.898 -4.704 4.283
531 2HD LYS 70 3HD LYS 70 -9.226 -5.875 4.230
532 1HE LYS 70 2HE LYS 70 -8.017 -7.293 2.736
533 2HE LYS 70 3HE LYS 70 -7.057 -5.944 2.124
534 1HZ LYS 70 1HZ LYS 70 -5.650 -7.135 3.339
535 2HZ LYS 70 2HZ LYS 70 -5.978 -5.860 4.345
536 3HZ LYS 70 3HZ LYS 70 -6.644 -7.345 4.649
537 H PHE 71 H PHE 71 -9.941 -3.770 -2.037
538 HA PHE 71 HA PHE 71 -10.232 -0.965 -1.165
539 1HB PHE 71 2HB PHE 71 -7.791 -2.061 -0.868
540 2HB PHE 71 3HB PHE 71 -7.666 -1.631 -2.580
541 HD1 PHE 71 1HD PHE 71 -6.203 -0.648 0.114
542 HD2 PHE 71 2HD PHE 71 -9.123 0.983 -2.603
543 HE1 PHE 71 1HE PHE 71 -5.373 1.638 0.585
544 HE2 PHE 71 2HE PHE 71 -8.133 3.217 -2.322
545 HZ PHE 71 HZ PHE 71 -6.291 3.577 -0.664
546 H GLU 72 H GLU 72 -8.920 -2.986 -3.819
547 HA GLU 72 HA GLU 72 -10.688 -1.642 -5.817
548 1HB GLU 72 2HB GLU 72 -8.193 -1.525 -6.159
549 2HB GLU 72 3HB GLU 72 -8.155 -3.292 -6.156
550 1HG GLU 72 2HG GLU 72 -8.047 -2.659 -8.411
551 2HG GLU 72 3HG GLU 72 -9.714 -3.197 -8.204
552 H SER 73 H SER 73 -9.638 -4.772 -4.427
553 HA SER 73 HA SER 73 -10.568 -6.800 -4.417
554 1HB SER 73 2HB SER 73 -12.749 -7.232 -4.778
555 2HB SER 73 3HB SER 73 -12.836 -5.474 -4.634
556 HG SER 73 HG SER 73 -12.554 -5.519 -7.006
557 H GLY 74 H GLY 74 -9.118 -8.035 -5.349
558 1HA GLY 74 1HA GLY 74 -8.043 -9.252 -7.011
559 2HA GLY 74 2HA GLY 74 -9.226 -8.666 -8.194
560 H ALA 75 H ALA 75 -6.951 -6.991 -6.014
561 HA ALA 75 HA ALA 75 -5.894 -5.272 -8.141
562 1HB ALA 75 1HB ALA 75 -6.328 -4.521 -5.800
563 2HB ALA 75 2HB ALA 75 -5.068 -5.641 -5.255
564 3HB ALA 75 3HB ALA 75 -4.658 -4.258 -6.319
565 H ARG 76 H ARG 76 -3.095 -5.445 -6.796
566 HA ARG 76 HA ARG 76 -2.257 -7.607 -8.607
567 1HB ARG 76 2HB ARG 76 -1.548 -5.305 -9.113
568 2HB ARG 76 3HB ARG 76 -0.704 -5.212 -7.555
569 1HG ARG 76 2HG ARG 76 0.767 -5.732 -9.514
570 2HG ARG 76 3HG ARG 76 0.862 -6.943 -8.228
571 1HD ARG 76 2HD ARG 76 -0.560 -8.487 -9.500
572 2HD ARG 76 3HD ARG 76 -0.912 -7.239 -10.705
573 HE ARG 76 HE ARG 76 1.749 -8.535 -10.095
574 1HH1 ARG 76 2HH2 ARG 76 0.284 -6.348 -12.367
575 2HH1 ARG 76 1HH2 ARG 76 0.716 -7.263 -13.778
576 1HH2 ARG 76 2HH1 ARG 76 2.826 -9.263 -11.740
577 2HH2 ARG 76 1HH1 ARG 76 2.398 -8.993 -13.436
578 H GLU 77 H GLU 77 -1.819 -6.471 -5.339
579 HA GLU 77 HA GLU 77 0.091 -7.432 -4.087
580 1HB GLU 77 2HB GLU 77 -2.474 -8.441 -2.901
581 2HB GLU 77 3HB GLU 77 -1.134 -7.551 -2.154
582 1HG GLU 77 2HG GLU 77 -3.387 -6.477 -3.898
583 2HG GLU 77 3HG GLU 77 -3.095 -6.210 -2.180
584 H LEU 78 H LEU 78 -2.146 -9.759 -5.420
585 HA LEU 78 HA LEU 78 -1.486 -12.186 -4.275
586 1HB LEU 78 2HB LEU 78 -1.645 -11.857 -7.287
587 2HB LEU 78 3HB LEU 78 -2.050 -13.242 -6.292
588 HG LEU 78 HG LEU 78 -4.088 -12.563 -6.937
589 1HD1 LEU 78 1HD1 LEU 78 -5.345 -11.561 -5.147
590 2HD1 LEU 78 2HD1 LEU 78 -4.103 -12.622 -4.458
591 3HD1 LEU 78 3HD1 LEU 78 -3.893 -10.857 -4.422
592 1HD2 LEU 78 1HD2 LEU 78 -3.315 -10.514 -8.126
593 2HD2 LEU 78 2HD2 LEU 78 -4.917 -10.404 -7.389
594 3HD2 LEU 78 3HD2 LEU 78 -3.548 -9.602 -6.622
595 H THR 79 H THR 79 0.427 -10.330 -6.769
596 HA THR 79 HA THR 79 2.451 -12.409 -6.809
597 HB THR 79 HB THR 79 2.983 -9.543 -7.580
598 HG1 THR 79 1HG THR 79 2.660 -10.149 -9.605
599 1HG2 THR 79 1HG2 THR 79 4.587 -10.839 -9.160
600 2HG2 THR 79 2HG2 THR 79 4.957 -10.906 -7.442
601 3HG2 THR 79 3HG2 THR 79 4.182 -12.284 -8.245
602 H GLU 80 H GLU 80 4.005 -12.713 -5.426
603 HA GLU 80 HA GLU 80 4.289 -11.045 -3.080
604 1HB GLU 80 2HB GLU 80 6.012 -12.586 -2.345
605 2HB GLU 80 3HB GLU 80 4.472 -13.339 -2.757
606 1HG GLU 80 2HG GLU 80 5.426 -14.135 -4.923
607 2HG GLU 80 3HG GLU 80 6.980 -13.394 -4.489
608 H SER 81 H SER 81 6.341 -11.461 -6.037
609 HA SER 81 HA SER 81 8.364 -9.645 -5.430
610 1HB SER 81 2HB SER 81 6.916 -10.076 -8.084
611 2HB SER 81 3HB SER 81 8.223 -8.926 -7.864
612 HG SER 81 HG SER 81 9.136 -10.693 -8.527
613 H GLU 82 H GLU 82 5.463 -8.516 -7.325
614 HA GLU 82 HA GLU 82 5.826 -5.912 -7.013
615 1HB GLU 82 2HB GLU 82 3.146 -7.382 -7.021
616 2HB GLU 82 3HB GLU 82 3.329 -5.646 -7.182
617 1HG GLU 82 2HG GLU 82 3.071 -6.365 -9.395
618 2HG GLU 82 3HG GLU 82 4.787 -6.020 -9.224
619 H THR 83 H THR 83 4.150 -7.970 -4.555
620 HA THR 83 HA THR 83 3.521 -5.783 -2.874
621 HB THR 83 HB THR 83 3.703 -8.770 -2.538
622 HG1 THR 83 1HG THR 83 1.721 -7.170 -1.461
623 1HG2 THR 83 1HG2 THR 83 3.675 -6.845 -0.190
624 2HG2 THR 83 2HG2 THR 83 3.051 -8.507 -0.095
625 3HG2 THR 83 3HG2 THR 83 4.757 -8.229 -0.444
626 H LYS 84 H LYS 84 6.341 -7.958 -3.036
627 HA LYS 84 HA LYS 84 7.495 -6.952 -0.677
628 1HB LYS 84 2HB LYS 84 7.945 -9.182 -1.547
629 2HB LYS 84 3HB LYS 84 8.871 -8.502 -2.905
630 1HG LYS 84 2HG LYS 84 10.528 -7.604 -1.411
631 2HG LYS 84 3HG LYS 84 9.461 -7.778 -0.024
632 1HD LYS 84 2HD LYS 84 10.949 -9.525 0.348
633 2HD LYS 84 3HD LYS 84 9.532 -10.302 -0.340
634 1HE LYS 84 2HE LYS 84 11.411 -11.298 -1.406
635 2HE LYS 84 3HE LYS 84 10.678 -10.238 -2.618
636 1HZ LYS 84 1HZ LYS 84 13.019 -9.572 -0.940
637 2HZ LYS 84 2HZ LYS 84 13.080 -10.038 -2.516
638 3HZ LYS 84 3HZ LYS 84 12.377 -8.608 -2.111
639 H SER 85 H SER 85 7.769 -5.915 -4.088
640 HA SER 85 HA SER 85 9.829 -4.046 -3.792
641 1HB SER 85 2HB SER 85 7.274 -3.688 -5.386
642 2HB SER 85 3HB SER 85 8.865 -2.955 -5.688
643 HG SER 85 HG SER 85 9.649 -4.982 -6.221
644 H LEU 86 H LEU 86 6.450 -3.859 -2.598
645 HA LEU 86 HA LEU 86 6.735 -1.076 -1.690
646 1HB LEU 86 2HB LEU 86 4.543 -2.550 -2.183
647 2HB LEU 86 3HB LEU 86 4.723 -2.987 -0.497
648 HG LEU 86 HG LEU 86 4.467 -0.164 -1.623
649 1HD1 LEU 86 1HD1 LEU 86 2.307 -0.099 -0.708
650 2HD1 LEU 86 2HD1 LEU 86 2.378 -1.728 -1.418
651 3HD1 LEU 86 3HD1 LEU 86 2.587 -1.507 0.319
652 1HD2 LEU 86 1HD2 LEU 86 5.882 0.059 0.285
653 2HD2 LEU 86 2HD2 LEU 86 4.248 0.455 0.827
654 3HD2 LEU 86 3HD2 LEU 86 4.934 -1.129 1.222
655 H MET 87 H MET 87 6.484 -4.281 -0.106
656 HA MET 87 HA MET 87 6.990 -3.556 2.469
657 1HB MET 87 2HB MET 87 6.440 -5.873 1.708
658 2HB MET 87 3HB MET 87 8.111 -6.032 1.145
659 1HG MET 87 2HG MET 87 8.337 -5.225 3.850
660 2HG MET 87 3HG MET 87 7.063 -6.432 3.825
661 1HE MET 87 1HE MET 87 7.844 -8.442 1.602
662 2HE MET 87 2HE MET 87 8.912 -9.573 2.471
663 3HE MET 87 3HE MET 87 7.449 -8.941 3.261
664 H ALA 88 H ALA 88 9.491 -4.507 0.161
665 HA ALA 88 HA ALA 88 11.846 -4.372 1.510
666 1HB ALA 88 1HB ALA 88 11.199 -3.439 -1.326
667 2HB ALA 88 2HB ALA 88 12.839 -3.765 -0.719
668 3HB ALA 88 3HB ALA 88 11.649 -5.075 -0.821
669 H ALA 89 H ALA 89 9.960 -1.544 0.402
670 HA ALA 89 HA ALA 89 12.210 0.277 1.144
671 1HB ALA 89 1HB ALA 89 9.608 1.120 -0.099
672 2HB ALA 89 2HB ALA 89 11.225 1.847 -0.250
673 3HB ALA 89 3HB ALA 89 10.863 0.305 -1.064
674 H ALA 90 H ALA 90 8.760 -0.374 1.747
675 HA ALA 90 HA ALA 90 8.174 1.645 3.680
676 1HB ALA 90 1HB ALA 90 6.387 0.049 4.323
677 2HB ALA 90 2HB ALA 90 6.513 0.259 2.550
678 3HB ALA 90 3HB ALA 90 7.166 -1.196 3.316
679 H ASP 91 H ASP 91 9.578 -1.602 4.008
680 HA ASP 91 HA ASP 91 9.666 -1.558 6.860
681 1HB ASP 91 2HB ASP 91 9.466 -3.613 5.450
682 2HB ASP 91 3HB ASP 91 11.123 -3.361 4.882
683 H ASN 92 H ASN 92 10.716 0.590 6.969
684 HA ASN 92 HA ASN 92 13.396 0.992 5.944
685 1HB ASN 92 2HB ASN 92 13.243 3.188 6.957
686 2HB ASN 92 3HB ASN 92 11.784 2.804 6.035
687 1HD2 ASN 92 1HD2 ASN 92 11.677 4.891 7.849
688 2HD2 ASN 92 2HD2 ASN 92 10.684 4.398 9.210
689 H ASP 93 H ASP 93 13.724 -1.202 7.342
690 HA ASP 93 HA ASP 93 15.672 -0.588 9.390
691 1HB ASP 93 2HB ASP 93 14.552 -1.954 11.161
692 2HB ASP 93 3HB ASP 93 13.794 -0.392 10.840
693 H GLY 94 H GLY 94 13.590 -3.176 7.982
694 1HA GLY 94 1HA GLY 94 14.547 -4.731 6.396
695 2HA GLY 94 2HA GLY 94 16.126 -4.587 7.163
696 H ASP 95 H ASP 95 12.820 -5.255 8.153
697 HA ASP 95 HA ASP 95 13.613 -7.820 9.454
698 1HB ASP 95 2HB ASP 95 12.576 -7.419 11.422
699 2HB ASP 95 3HB ASP 95 13.086 -5.765 11.071
700 H GLY 96 H GLY 96 10.919 -5.830 8.128
701 1HA GLY 96 1HA GLY 96 9.815 -6.783 6.168
702 2HA GLY 96 2HA GLY 96 9.616 -8.308 7.044
703 H LYS 97 H LYS 97 9.031 -6.943 9.652
704 HA LYS 97 HA LYS 97 6.160 -6.627 9.279
705 1HB LYS 97 2HB LYS 97 7.965 -6.207 11.691
706 2HB LYS 97 3HB LYS 97 6.209 -6.205 11.744
707 1HG LYS 97 2HG LYS 97 7.619 -8.621 10.564
708 2HG LYS 97 3HG LYS 97 7.632 -8.392 12.308
709 1HD LYS 97 2HD LYS 97 5.246 -8.397 12.467
710 2HD LYS 97 3HD LYS 97 5.035 -8.262 10.717
711 1HE LYS 97 2HE LYS 97 5.850 -10.486 10.326
712 2HE LYS 97 3HE LYS 97 6.398 -10.675 12.003
713 1HZ LYS 97 1HZ LYS 97 4.137 -10.657 12.718
714 2HZ LYS 97 2HZ LYS 97 3.585 -10.245 11.262
715 3HZ LYS 97 3HZ LYS 97 4.223 -11.750 11.481
716 H ILE 98 H ILE 98 5.107 -4.733 8.953
717 HA ILE 98 HA ILE 98 6.645 -2.168 9.061
718 HB ILE 98 HB ILE 98 4.716 -3.358 7.081
719 1HG1 ILE 98 2HG1 ILE 98 7.295 -1.844 6.583
720 2HG1 ILE 98 3HG1 ILE 98 7.358 -3.538 7.069
721 1HG2 ILE 98 1HG2 ILE 98 3.850 -1.080 7.494
722 2HG2 ILE 98 2HG2 ILE 98 5.483 -0.413 7.264
723 3HG2 ILE 98 3HG2 ILE 98 4.628 -1.199 5.925
724 1HD1 ILE 98 1HD1 ILE 98 5.808 -2.570 4.647
725 2HD1 ILE 98 2HD1 ILE 98 7.434 -3.259 4.641
726 3HD1 ILE 98 3HD1 ILE 98 6.064 -4.251 5.175
727 H GLY 99 H GLY 99 5.982 -0.925 10.641
728 1HA GLY 99 1HA GLY 99 3.296 -1.147 11.841
729 2HA GLY 99 2HA GLY 99 4.609 -0.058 12.314
730 H ALA 100 H ALA 100 2.015 0.900 12.137
731 HA ALA 100 HA ALA 100 1.399 2.235 9.673
732 1HB ALA 100 1HB ALA 100 0.031 3.693 10.985
733 2HB ALA 100 2HB ALA 100 -0.168 2.059 11.639
734 3HB ALA 100 3HB ALA 100 0.860 3.228 12.496
735 H GLU 101 H GLU 101 3.547 2.996 12.383
736 HA GLU 101 HA GLU 101 4.342 5.561 11.602
737 1HB GLU 101 2HB GLU 101 5.777 3.344 13.121
738 2HB GLU 101 3HB GLU 101 6.377 5.004 13.006
739 1HG GLU 101 2HG GLU 101 4.569 5.903 14.217
740 2HG GLU 101 3HG GLU 101 3.516 4.515 13.946
741 H GLU 102 H GLU 102 6.276 2.544 11.078
742 HA GLU 102 HA GLU 102 8.062 3.334 9.201
743 1HB GLU 102 2HB GLU 102 6.477 0.729 9.022
744 2HB GLU 102 3HB GLU 102 8.036 1.082 8.277
745 1HG GLU 102 2HG GLU 102 8.974 1.427 10.614
746 2HG GLU 102 3HG GLU 102 7.468 0.752 11.254
747 H PHE 103 H PHE 103 4.683 2.362 8.447
748 HA PHE 103 HA PHE 103 5.015 2.717 5.630
749 1HB PHE 103 2HB PHE 103 3.265 1.381 6.965
750 2HB PHE 103 3HB PHE 103 2.353 2.877 7.071
751 HD1 PHE 103 1HD PHE 103 0.937 3.485 5.178
752 HD2 PHE 103 2HD PHE 103 4.033 0.539 4.661
753 HE1 PHE 103 1HE PHE 103 -0.257 2.555 3.215
754 HE2 PHE 103 2HE PHE 103 2.871 -0.344 2.667
755 HZ PHE 103 HZ PHE 103 0.702 0.642 1.950
756 H GLN 104 H GLN 104 3.431 4.847 8.063
757 HA GLN 104 HA GLN 104 2.648 6.984 6.297
758 1HB GLN 104 2HB GLN 104 1.970 6.533 8.773
759 2HB GLN 104 3HB GLN 104 3.497 7.339 9.184
760 1HG GLN 104 2HG GLN 104 2.615 9.212 7.544
761 2HG GLN 104 3HG GLN 104 1.051 8.406 7.717
762 1HE2 GLN 104 1HE2 GLN 104 2.972 10.848 8.927
763 2HE2 GLN 104 2HE2 GLN 104 2.244 11.007 10.516
764 H GLU 105 H GLU 105 5.706 6.442 8.210
765 HA GLU 105 HA GLU 105 7.083 8.726 7.379
766 1HB GLU 105 2HB GLU 105 7.904 5.916 8.133
767 2HB GLU 105 3HB GLU 105 9.095 6.938 7.336
768 1HG GLU 105 2HG GLU 105 9.371 7.176 9.704
769 2HG GLU 105 3HG GLU 105 8.786 8.704 9.044
770 H MET 106 H MET 106 7.209 5.513 5.708
771 HA MET 106 HA MET 106 8.767 6.557 3.623
772 1HB MET 106 2HB MET 106 7.879 4.032 4.327
773 2HB MET 106 3HB MET 106 7.066 4.295 2.789
774 1HG MET 106 2HG MET 106 10.064 4.350 3.375
775 2HG MET 106 3HG MET 106 9.149 3.183 2.440
776 1HE MET 106 1HE MET 106 11.204 6.807 0.733
777 2HE MET 106 2HE MET 106 10.299 7.082 2.222
778 3HE MET 106 3HE MET 106 11.614 5.882 2.193
779 H VAL 107 H VAL 107 5.242 6.197 3.857
780 HA VAL 107 HA VAL 107 4.500 7.096 1.266
781 HB VAL 107 HB VAL 107 3.139 7.269 3.988
782 1HG1 VAL 107 1HG1 VAL 107 2.100 7.949 1.228
783 2HG1 VAL 107 2HG1 VAL 107 1.034 7.569 2.593
784 3HG1 VAL 107 3HG1 VAL 107 2.082 8.991 2.669
785 1HG2 VAL 107 1HG2 VAL 107 1.898 5.356 3.327
786 2HG2 VAL 107 2HG2 VAL 107 2.416 5.500 1.639
787 3HG2 VAL 107 3HG2 VAL 107 3.564 4.960 2.876
788 H HIS 108 H HIS 108 5.085 8.891 4.298
789 HA HIS 108 HA HIS 108 4.084 11.365 3.347
790 1HB HIS 108 2HB HIS 108 3.955 10.740 5.669
791 2HB HIS 108 3HB HIS 108 5.723 10.637 5.786
792 HD1 HIS 108 1HD HIS 108 6.934 12.808 6.493
793 HD2 HIS 108 2HD HIS 108 2.932 13.331 5.305
794 HE1 HIS 108 1HE HIS 108 6.300 15.211 7.090
795 H SER 109 H SER 109 7.123 9.741 3.123
796 HA SER 109 HA SER 109 8.995 11.795 3.077
797 1HB SER 109 2HB SER 109 9.458 9.316 3.133
798 2HB SER 109 3HB SER 109 8.990 9.257 1.412
799 HG SER 109 HG SER 109 10.596 11.016 1.195
Start of MODEL 15
1 1H MET 1 H1 MET 1 -15.587 -0.057 2.105
2 2H MET 1 H2 MET 1 -16.377 0.031 0.652
3 3H MET 1 H3 MET 1 -14.907 0.758 0.852
4 HA MET 1 HA MET 1 -16.701 2.389 0.956
5 1HB MET 1 2HB MET 1 -17.478 0.659 3.335
6 2HB MET 1 3HB MET 1 -18.090 2.294 3.054
7 1HG MET 1 2HG MET 1 -19.233 1.636 1.053
8 2HG MET 1 3HG MET 1 -18.392 0.083 0.979
9 1HE MET 1 1HE MET 1 -21.439 0.215 0.507
10 2HE MET 1 2HE MET 1 -20.476 -1.285 0.524
11 3HE MET 1 3HE MET 1 -21.966 -1.174 1.487
12 H SER 2 H SER 2 -15.226 3.919 1.322
13 HA SER 2 HA SER 2 -14.287 5.260 3.272
14 1HB SER 2 2HB SER 2 -12.545 2.747 3.413
15 2HB SER 2 3HB SER 2 -11.989 4.351 3.923
16 HG SER 2 HG SER 2 -14.214 2.951 4.940
17 H ILE 3 H ILE 3 -11.864 3.352 1.459
18 HA ILE 3 HA ILE 3 -10.875 5.790 0.319
19 HB ILE 3 HB ILE 3 -9.070 4.523 -0.471
20 1HG1 ILE 3 2HG1 ILE 3 -9.290 1.884 -0.077
21 2HG1 ILE 3 3HG1 ILE 3 -10.969 2.172 -0.486
22 1HG2 ILE 3 1HG2 ILE 3 -9.448 4.741 2.018
23 2HG2 ILE 3 2HG2 ILE 3 -9.915 3.031 2.036
24 3HG2 ILE 3 3HG2 ILE 3 -8.292 3.495 1.501
25 1HD1 ILE 3 1HD1 ILE 3 -10.157 3.256 -2.661
26 2HD1 ILE 3 2HD1 ILE 3 -8.501 2.863 -2.164
27 3HD1 ILE 3 3HD1 ILE 3 -9.669 1.570 -2.487
28 H THR 4 H THR 4 -12.972 3.180 -0.965
29 HA THR 4 HA THR 4 -12.626 3.650 -3.658
30 HB THR 4 HB THR 4 -13.299 1.536 -2.530
31 HG1 THR 4 1HG THR 4 -14.898 2.905 -4.251
32 1HG2 THR 4 1HG2 THR 4 -14.772 2.487 -0.687
33 2HG2 THR 4 2HG2 THR 4 -15.945 2.969 -1.925
34 3HG2 THR 4 3HG2 THR 4 -15.588 1.257 -1.675
35 H ASP 5 H ASP 5 -14.078 5.697 -1.333
36 HA ASP 5 HA ASP 5 -15.544 7.144 -3.403
37 1HB ASP 5 2HB ASP 5 -17.201 5.505 -2.480
38 2HB ASP 5 3HB ASP 5 -16.922 6.169 -0.856
39 H VAL 6 H VAL 6 -13.320 7.987 -2.672
40 HA VAL 6 HA VAL 6 -13.908 10.333 -1.016
41 HB VAL 6 HB VAL 6 -12.898 8.545 0.503
42 1HG1 VAL 6 1HG1 VAL 6 -11.010 7.839 -1.023
43 2HG1 VAL 6 2HG1 VAL 6 -10.249 9.414 -0.721
44 3HG1 VAL 6 3HG1 VAL 6 -10.516 8.291 0.612
45 1HG2 VAL 6 1HG2 VAL 6 -11.592 11.281 0.318
46 2HG2 VAL 6 2HG2 VAL 6 -13.114 10.880 1.144
47 3HG2 VAL 6 3HG2 VAL 6 -11.584 10.215 1.741
48 H LEU 7 H LEU 7 -11.467 8.640 -2.914
49 HA LEU 7 HA LEU 7 -11.083 10.610 -4.909
50 1HB LEU 7 2HB LEU 7 -10.053 12.079 -3.433
51 2HB LEU 7 3HB LEU 7 -9.331 10.813 -2.452
52 HG LEU 7 HG LEU 7 -8.243 10.893 -5.218
53 1HD1 LEU 7 1HD1 LEU 7 -8.617 13.298 -4.970
54 2HD1 LEU 7 2HD1 LEU 7 -7.820 13.276 -3.377
55 3HD1 LEU 7 3HD1 LEU 7 -6.890 12.909 -4.845
56 1HD2 LEU 7 1HD2 LEU 7 -6.108 10.846 -3.938
57 2HD2 LEU 7 2HD2 LEU 7 -6.995 11.096 -2.426
58 3HD2 LEU 7 3HD2 LEU 7 -7.192 9.591 -3.340
59 H SER 8 H SER 8 -9.407 8.220 -2.821
60 HA SER 8 HA SER 8 -7.596 7.276 -4.441
61 1HB SER 8 2HB SER 8 -9.123 5.465 -2.605
62 2HB SER 8 3HB SER 8 -7.396 5.425 -2.997
63 HG SER 8 HG SER 8 -7.237 7.515 -2.016
64 H ALA 9 H ALA 9 -10.977 6.504 -4.998
65 HA ALA 9 HA ALA 9 -10.664 4.148 -6.562
66 1HB ALA 9 1HB ALA 9 -12.584 6.493 -6.905
67 2HB ALA 9 2HB ALA 9 -12.772 4.888 -7.649
68 3HB ALA 9 3HB ALA 9 -12.854 5.059 -5.884
69 H ASP 10 H ASP 10 -10.146 7.607 -7.413
70 HA ASP 10 HA ASP 10 -9.685 6.969 -10.231
71 1HB ASP 10 2HB ASP 10 -10.601 9.157 -9.310
72 2HB ASP 10 3HB ASP 10 -8.953 9.524 -8.764
73 H ASP 11 H ASP 11 -7.796 7.445 -7.277
74 HA ASP 11 HA ASP 11 -5.164 7.655 -8.314
75 1HB ASP 11 2HB ASP 11 -6.123 6.243 -5.749
76 2HB ASP 11 3HB ASP 11 -4.498 6.606 -6.149
77 H ILE 12 H ILE 12 -7.073 4.807 -7.191
78 HA ILE 12 HA ILE 12 -5.075 3.002 -7.881
79 HB ILE 12 HB ILE 12 -6.691 1.290 -7.647
80 1HG1 ILE 12 2HG1 ILE 12 -8.783 3.370 -7.259
81 2HG1 ILE 12 3HG1 ILE 12 -8.688 2.239 -8.613
82 1HG2 ILE 12 1HG2 ILE 12 -7.101 1.591 -5.254
83 2HG2 ILE 12 2HG2 ILE 12 -5.510 2.204 -5.710
84 3HG2 ILE 12 3HG2 ILE 12 -6.838 3.332 -5.408
85 1HD1 ILE 12 1HD1 ILE 12 -10.347 1.410 -7.132
86 2HD1 ILE 12 2HD1 ILE 12 -8.934 0.354 -6.948
87 3HD1 ILE 12 3HD1 ILE 12 -9.307 1.590 -5.715
88 H ALA 13 H ALA 13 -7.859 4.235 -9.779
89 HA ALA 13 HA ALA 13 -7.628 2.552 -12.007
90 1HB ALA 13 1HB ALA 13 -8.690 4.292 -13.295
91 2HB ALA 13 2HB ALA 13 -9.418 4.249 -11.678
92 3HB ALA 13 3HB ALA 13 -8.264 5.528 -12.106
93 H ALA 14 H ALA 14 -5.767 5.568 -11.295
94 HA ALA 14 HA ALA 14 -4.117 5.437 -13.630
95 1HB ALA 14 1HB ALA 14 -4.192 7.444 -12.265
96 2HB ALA 14 2HB ALA 14 -3.475 6.598 -10.882
97 3HB ALA 14 3HB ALA 14 -2.525 6.832 -12.363
98 H ALA 15 H ALA 15 -3.340 4.322 -10.285
99 HA ALA 15 HA ALA 15 -0.918 3.104 -10.745
100 1HB ALA 15 1HB ALA 15 -1.370 1.752 -8.770
101 2HB ALA 15 2HB ALA 15 -1.960 3.408 -8.523
102 3HB ALA 15 3HB ALA 15 -3.105 2.098 -8.890
103 H LEU 16 H LEU 16 -4.111 1.714 -11.217
104 HA LEU 16 HA LEU 16 -3.418 -0.925 -11.759
105 1HB LEU 16 2HB LEU 16 -5.806 0.797 -12.211
106 2HB LEU 16 3HB LEU 16 -5.642 -0.443 -13.424
107 HG LEU 16 HG LEU 16 -7.113 -1.135 -11.650
108 1HD1 LEU 16 1HD1 LEU 16 -6.256 -3.354 -11.301
109 2HD1 LEU 16 2HD1 LEU 16 -5.827 -2.816 -12.933
110 3HD1 LEU 16 3HD1 LEU 16 -4.595 -2.844 -11.651
111 1HD2 LEU 16 1HD2 LEU 16 -4.721 -0.954 -9.777
112 2HD2 LEU 16 2HD2 LEU 16 -6.238 -0.028 -9.707
113 3HD2 LEU 16 3HD2 LEU 16 -6.260 -1.766 -9.416
114 H GLN 17 H GLN 17 -3.333 1.915 -13.860
115 HA GLN 17 HA GLN 17 -2.833 0.254 -16.255
116 1HB GLN 17 2HB GLN 17 -4.335 2.229 -16.352
117 2HB GLN 17 3HB GLN 17 -2.956 3.277 -16.004
118 1HG GLN 17 2HG GLN 17 -2.344 1.413 -18.221
119 2HG GLN 17 3HG GLN 17 -3.839 2.290 -18.525
120 1HE2 GLN 17 1HE2 GLN 17 -0.441 2.925 -17.388
121 2HE2 GLN 17 2HE2 GLN 17 -0.335 4.463 -18.226
122 H GLU 18 H GLU 18 -1.152 2.607 -14.095
123 HA GLU 18 HA GLU 18 1.173 2.673 -15.769
124 1HB GLU 18 2HB GLU 18 2.050 4.200 -14.310
125 2HB GLU 18 3HB GLU 18 0.323 4.398 -14.124
126 1HG GLU 18 2HG GLU 18 0.763 4.393 -11.962
127 2HG GLU 18 3HG GLU 18 0.746 2.637 -12.100
128 H CYS 19 H CYS 19 0.286 0.671 -12.974
129 HA CYS 19 HA CYS 19 2.636 -1.133 -13.549
130 1HB CYS 19 2HB CYS 19 1.263 -0.462 -10.933
131 2HB CYS 19 3HB CYS 19 2.236 -1.928 -11.192
132 HG CYS 19 HG CYS 19 3.092 1.226 -11.406
133 H ARG 20 H ARG 20 1.007 -1.688 -15.339
134 HA ARG 20 HA ARG 20 -1.280 -3.303 -14.412
135 1HB ARG 20 2HB ARG 20 -1.272 -1.675 -16.324
136 2HB ARG 20 3HB ARG 20 -0.343 -2.861 -17.258
137 1HG ARG 20 2HG ARG 20 -2.216 -4.468 -17.059
138 2HG ARG 20 3HG ARG 20 -3.063 -3.363 -15.950
139 1HD ARG 20 2HD ARG 20 -3.111 -1.631 -17.719
140 2HD ARG 20 3HD ARG 20 -2.398 -2.789 -18.872
141 HE ARG 20 HE ARG 20 -4.621 -4.090 -17.862
142 1HH1 ARG 20 2HH2 ARG 20 -4.070 -1.030 -19.519
143 2HH1 ARG 20 1HH2 ARG 20 -5.668 -0.899 -20.185
144 1HH2 ARG 20 2HH1 ARG 20 -6.757 -3.985 -18.771
145 2HH2 ARG 20 1HH1 ARG 20 -7.219 -2.648 -19.772
146 H ASP 21 H ASP 21 1.741 -3.762 -16.303
147 HA ASP 21 HA ASP 21 1.522 -6.612 -16.521
148 1HB ASP 21 2HB ASP 21 4.207 -6.109 -16.789
149 2HB ASP 21 3HB ASP 21 3.014 -5.996 -18.111
150 HA PRO 22 HA PRO 22 2.695 -7.507 -12.328
151 1HB PRO 22 2HB PRO 22 3.426 -10.110 -12.458
152 2HB PRO 22 3HB PRO 22 1.741 -9.577 -12.730
153 1HG PRO 22 2HG PRO 22 3.859 -10.141 -14.829
154 2HG PRO 22 3HG PRO 22 2.195 -10.795 -14.764
155 1HD PRO 22 2HD PRO 22 2.815 -8.615 -16.274
156 2HD PRO 22 3HD PRO 22 1.266 -8.689 -15.377
157 H ASP 23 H ASP 23 4.476 -7.409 -11.026
158 HA ASP 23 HA ASP 23 6.532 -7.657 -10.232
159 1HB ASP 23 2HB ASP 23 6.865 -9.534 -12.002
160 2HB ASP 23 3HB ASP 23 7.827 -8.317 -12.862
161 H THR 24 H THR 24 5.248 -5.527 -12.297
162 HA THR 24 HA THR 24 7.463 -3.763 -12.694
163 HB THR 24 HB THR 24 4.518 -3.302 -13.230
164 HG1 THR 24 1HG THR 24 5.020 -4.097 -15.209
165 1HG2 THR 24 1HG2 THR 24 7.057 -2.040 -14.368
166 2HG2 THR 24 2HG2 THR 24 5.435 -1.852 -15.054
167 3HG2 THR 24 3HG2 THR 24 5.779 -1.192 -13.461
168 H PHE 25 H PHE 25 5.772 -4.323 -9.732
169 HA PHE 25 HA PHE 25 4.774 -1.637 -9.587
170 1HB PHE 25 2HB PHE 25 3.633 -3.800 -8.951
171 2HB PHE 25 3HB PHE 25 4.481 -3.699 -7.411
172 HD1 PHE 25 1HD PHE 25 3.504 -0.344 -8.527
173 HD2 PHE 25 2HD PHE 25 1.997 -3.921 -6.656
174 HE1 PHE 25 1HE PHE 25 1.257 0.606 -8.541
175 HE2 PHE 25 2HE PHE 25 -0.265 -2.919 -6.600
176 HZ PHE 25 HZ PHE 25 -0.649 -0.651 -7.538
177 H GLU 26 H GLU 26 6.702 -0.382 -9.411
178 HA GLU 26 HA GLU 26 8.527 -0.623 -7.247
179 1HB GLU 26 2HB GLU 26 7.918 1.475 -9.292
180 2HB GLU 26 3HB GLU 26 8.655 2.038 -7.786
181 1HG GLU 26 2HG GLU 26 10.461 0.282 -8.110
182 2HG GLU 26 3HG GLU 26 9.842 0.096 -9.764
183 HA PRO 27 HA PRO 27 5.952 0.823 -4.047
184 1HB PRO 27 2HB PRO 27 7.816 1.631 -2.109
185 2HB PRO 27 3HB PRO 27 7.398 -0.058 -2.494
186 1HG PRO 27 2HG PRO 27 9.776 1.518 -3.478
187 2HG PRO 27 3HG PRO 27 9.695 -0.194 -2.967
188 1HD PRO 27 2HD PRO 27 9.685 0.544 -5.586
189 2HD PRO 27 3HD PRO 27 8.815 -0.897 -4.973
190 H GLN 28 H GLN 28 8.758 3.200 -4.153
191 HA GLN 28 HA GLN 28 7.359 5.396 -3.432
192 1HB GLN 28 2HB GLN 28 9.980 4.813 -4.070
193 2HB GLN 28 3HB GLN 28 9.506 5.764 -5.488
194 1HG GLN 28 2HG GLN 28 8.501 7.377 -3.791
195 2HG GLN 28 3HG GLN 28 9.377 6.497 -2.532
196 1HE2 GLN 28 1HE2 GLN 28 10.798 8.269 -1.940
197 2HE2 GLN 28 2HE2 GLN 28 12.007 8.851 -3.062
198 H LYS 29 H LYS 29 7.801 4.031 -6.689
199 HA LYS 29 HA LYS 29 6.534 6.011 -8.236
200 1HB LYS 29 2HB LYS 29 7.778 3.960 -9.072
201 2HB LYS 29 3HB LYS 29 6.344 3.005 -8.679
202 1HG LYS 29 2HG LYS 29 5.521 3.495 -10.730
203 2HG LYS 29 3HG LYS 29 5.296 5.142 -10.188
204 1HD LYS 29 2HD LYS 29 6.596 5.419 -12.093
205 2HD LYS 29 3HD LYS 29 7.796 5.520 -10.792
206 1HE LYS 29 2HE LYS 29 7.696 2.756 -11.357
207 2HE LYS 29 3HE LYS 29 7.369 3.468 -12.938
208 1HZ LYS 29 1HZ LYS 29 9.744 3.678 -11.231
209 2HZ LYS 29 2HZ LYS 29 9.661 3.162 -12.730
210 3HZ LYS 29 3HZ LYS 29 9.507 4.788 -12.453
211 H PHE 30 H PHE 30 5.074 2.966 -6.932
212 HA PHE 30 HA PHE 30 2.450 3.475 -7.658
213 1HB PHE 30 2HB PHE 30 3.166 1.324 -6.878
214 2HB PHE 30 3HB PHE 30 3.682 1.965 -5.335
215 HD1 PHE 30 1HD PHE 30 0.417 2.490 -7.163
216 HD2 PHE 30 2HD PHE 30 2.417 0.885 -3.688
217 HE1 PHE 30 1HE PHE 30 -1.750 2.277 -6.010
218 HE2 PHE 30 2HE PHE 30 0.254 0.770 -2.508
219 HZ PHE 30 HZ PHE 30 -1.833 1.547 -3.650
220 H PHE 31 H PHE 31 4.005 4.100 -4.548
221 HA PHE 31 HA PHE 31 2.098 5.325 -3.008
222 1HB PHE 31 2HB PHE 31 4.205 4.921 -2.084
223 2HB PHE 31 3HB PHE 31 5.053 5.651 -3.431
224 HD1 PHE 31 1HD PHE 31 2.426 6.881 -1.104
225 HD2 PHE 31 2HD PHE 31 6.293 7.542 -2.872
226 HE1 PHE 31 1HE PHE 31 2.552 9.124 -0.066
227 HE2 PHE 31 2HE PHE 31 6.518 9.651 -1.580
228 HZ PHE 31 HZ PHE 31 4.698 10.334 -0.023
229 H GLN 32 H GLN 32 4.195 7.043 -5.379
230 HA GLN 32 HA GLN 32 2.866 9.564 -5.039
231 1HB GLN 32 2HB GLN 32 5.289 9.160 -5.783
232 2HB GLN 32 3HB GLN 32 4.625 8.682 -7.351
233 1HG GLN 32 2HG GLN 32 3.375 11.034 -7.210
234 2HG GLN 32 3HG GLN 32 4.565 11.382 -5.954
235 1HE2 GLN 32 1HE2 GLN 32 4.260 10.190 -9.350
236 2HE2 GLN 32 2HE2 GLN 32 5.733 10.967 -9.908
237 H THR 33 H THR 33 2.613 6.831 -7.434
238 HA THR 33 HA THR 33 1.261 8.357 -9.317
239 HB THR 33 HB THR 33 2.415 5.989 -9.615
240 HG1 THR 33 1HG THR 33 0.091 7.095 -10.622
241 1HG2 THR 33 1HG2 THR 33 0.598 4.764 -8.122
242 2HG2 THR 33 2HG2 THR 33 -0.489 5.088 -9.465
243 3HG2 THR 33 3HG2 THR 33 0.968 4.106 -9.697
244 H SER 34 H SER 34 0.059 6.345 -6.620
245 HA SER 34 HA SER 34 -2.691 6.688 -7.245
246 1HB SER 34 2HB SER 34 -1.173 6.349 -4.617
247 2HB SER 34 3HB SER 34 -2.934 6.462 -4.657
248 HG SER 34 HG SER 34 -2.841 4.709 -6.229
249 H GLY 35 H GLY 35 -0.402 8.562 -5.206
250 1HA GLY 35 1HA GLY 35 -0.409 10.972 -5.175
251 2HA GLY 35 2HA GLY 35 -2.177 10.977 -5.276
252 H LEU 36 H LEU 36 -0.577 8.524 -3.242
253 HA LEU 36 HA LEU 36 -1.914 9.501 -0.904
254 1HB LEU 36 2HB LEU 36 0.383 7.570 -1.152
255 2HB LEU 36 3HB LEU 36 -0.643 7.810 0.270
256 HG LEU 36 HG LEU 36 -2.188 7.110 -2.157
257 1HD1 LEU 36 1HD1 LEU 36 -0.154 5.779 -2.600
258 2HD1 LEU 36 2HD1 LEU 36 -0.233 5.093 -0.966
259 3HD1 LEU 36 3HD1 LEU 36 -1.512 4.738 -2.149
260 1HD2 LEU 36 1HD2 LEU 36 -3.136 7.180 0.144
261 2HD2 LEU 36 2HD2 LEU 36 -3.263 5.565 -0.581
262 3HD2 LEU 36 3HD2 LEU 36 -2.015 5.891 0.637
263 H SER 37 H SER 37 1.160 10.217 -2.467
264 HA SER 37 HA SER 37 2.513 11.483 -0.227
265 1HB SER 37 2HB SER 37 3.567 10.813 -2.506
266 2HB SER 37 3HB SER 37 2.701 12.175 -3.191
267 HG SER 37 HG SER 37 4.871 12.258 -1.328
268 H LYS 38 H LYS 38 -0.353 12.325 -1.993
269 HA LYS 38 HA LYS 38 -0.077 15.169 -1.285
270 1HB LYS 38 2HB LYS 38 -1.117 13.885 -3.611
271 2HB LYS 38 3HB LYS 38 -2.506 14.460 -2.711
272 1HG LYS 38 2HG LYS 38 -1.846 16.182 -4.217
273 2HG LYS 38 3HG LYS 38 -1.438 16.751 -2.598
274 1HD LYS 38 2HD LYS 38 0.764 15.240 -3.908
275 2HD LYS 38 3HD LYS 38 0.237 16.629 -4.865
276 1HE LYS 38 2HE LYS 38 0.654 18.167 -3.008
277 2HE LYS 38 3HE LYS 38 1.071 16.839 -1.922
278 1HZ LYS 38 1HZ LYS 38 2.934 16.314 -3.302
279 2HZ LYS 38 2HZ LYS 38 2.589 17.568 -4.322
280 3HZ LYS 38 3HZ LYS 38 3.014 17.860 -2.760
281 H MET 39 H MET 39 -1.665 12.137 -0.460
282 HA MET 39 HA MET 39 -3.752 13.424 1.088
283 1HB MET 39 2HB MET 39 -2.622 10.624 0.997
284 2HB MET 39 3HB MET 39 -3.865 11.100 2.131
285 1HG MET 39 2HG MET 39 -4.210 11.402 -0.882
286 2HG MET 39 3HG MET 39 -4.667 9.988 0.061
287 1HE MET 39 1HE MET 39 -5.823 13.301 -1.325
288 2HE MET 39 2HE MET 39 -7.213 13.739 -0.312
289 3HE MET 39 3HE MET 39 -5.583 14.056 0.271
290 H SER 40 H SER 40 -3.759 14.144 3.132
291 HA SER 40 HA SER 40 -1.307 14.571 4.539
292 1HB SER 40 2HB SER 40 -4.229 14.726 5.410
293 2HB SER 40 3HB SER 40 -2.871 15.265 6.413
294 HG SER 40 HG SER 40 -2.322 16.731 4.741
295 H ALA 41 H ALA 41 -0.539 13.651 6.415
296 HA ALA 41 HA ALA 41 -0.412 11.023 6.987
297 1HB ALA 41 1HB ALA 41 -0.540 13.298 9.005
298 2HB ALA 41 2HB ALA 41 0.096 11.673 9.322
299 3HB ALA 41 3HB ALA 41 0.904 12.720 8.140
300 H ASN 42 H ASN 42 -2.996 13.196 8.097
301 HA ASN 42 HA ASN 42 -4.474 11.540 9.795
302 1HB ASN 42 2HB ASN 42 -5.623 13.450 7.712
303 2HB ASN 42 3HB ASN 42 -6.424 12.880 9.181
304 1HD2 ASN 42 1HD2 ASN 42 -5.576 15.663 8.149
305 2HD2 ASN 42 2HD2 ASN 42 -4.664 16.321 9.494
306 H GLN 43 H GLN 43 -4.840 11.876 6.220
307 HA GLN 43 HA GLN 43 -6.950 9.908 6.181
308 1HB GLN 43 2HB GLN 43 -6.435 12.035 4.636
309 2HB GLN 43 3HB GLN 43 -5.695 10.798 3.619
310 1HG GLN 43 2HG GLN 43 -8.540 10.618 4.767
311 2HG GLN 43 3HG GLN 43 -8.154 11.392 3.234
312 1HE2 GLN 43 1HE2 GLN 43 -9.204 8.355 4.530
313 2HE2 GLN 43 2HE2 GLN 43 -8.835 7.510 3.053
314 H VAL 44 H VAL 44 -3.427 10.036 5.489
315 HA VAL 44 HA VAL 44 -3.161 7.450 4.340
316 HB VAL 44 HB VAL 44 -1.333 9.216 6.010
317 1HG1 VAL 44 1HG1 VAL 44 -0.432 6.955 6.115
318 2HG1 VAL 44 2HG1 VAL 44 -0.644 6.775 4.357
319 3HG1 VAL 44 3HG1 VAL 44 0.527 7.946 5.006
320 1HG2 VAL 44 1HG2 VAL 44 -0.405 9.908 3.868
321 2HG2 VAL 44 2HG2 VAL 44 -1.440 8.752 2.995
322 3HG2 VAL 44 3HG2 VAL 44 -2.142 10.159 3.790
323 H LYS 45 H LYS 45 -3.219 8.571 7.785
324 HA LYS 45 HA LYS 45 -2.714 5.952 8.815
325 1HB LYS 45 2HB LYS 45 -2.402 8.248 9.951
326 2HB LYS 45 3HB LYS 45 -4.112 8.107 10.399
327 1HG LYS 45 2HG LYS 45 -3.530 5.842 11.422
328 2HG LYS 45 3HG LYS 45 -1.837 6.148 10.985
329 1HD LYS 45 2HD LYS 45 -1.984 8.308 12.343
330 2HD LYS 45 3HD LYS 45 -3.564 7.737 12.922
331 1HE LYS 45 2HE LYS 45 -2.401 5.618 13.744
332 2HE LYS 45 3HE LYS 45 -0.856 6.332 13.256
333 1HZ LYS 45 1HZ LYS 45 -1.244 6.659 15.569
334 2HZ LYS 45 2HZ LYS 45 -1.273 8.122 14.823
335 3HZ LYS 45 3HZ LYS 45 -2.681 7.410 15.301
336 H ASP 46 H ASP 46 -5.713 7.837 8.232
337 HA ASP 46 HA ASP 46 -7.661 5.998 9.115
338 1HB ASP 46 2HB ASP 46 -8.324 8.178 8.415
339 2HB ASP 46 3HB ASP 46 -7.544 7.980 6.846
340 H VAL 47 H VAL 47 -6.393 6.247 5.721
341 HA VAL 47 HA VAL 47 -7.540 3.820 4.916
342 HB VAL 47 HB VAL 47 -6.083 3.765 3.013
343 1HG1 VAL 47 1HG1 VAL 47 -6.605 6.695 3.386
344 2HG1 VAL 47 2HG1 VAL 47 -6.891 5.677 1.975
345 3HG1 VAL 47 3HG1 VAL 47 -7.963 5.566 3.393
346 1HG2 VAL 47 1HG2 VAL 47 -4.341 5.408 2.587
347 2HG2 VAL 47 2HG2 VAL 47 -4.497 5.900 4.280
348 3HG2 VAL 47 3HG2 VAL 47 -3.908 4.271 3.881
349 H PHE 48 H PHE 48 -4.241 4.299 6.309
350 HA PHE 48 HA PHE 48 -3.277 1.696 6.290
351 1HB PHE 48 2HB PHE 48 -1.924 3.381 7.208
352 2HB PHE 48 3HB PHE 48 -3.089 3.795 8.433
353 HD1 PHE 48 1HD PHE 48 -3.407 2.499 10.460
354 HD2 PHE 48 2HD PHE 48 -0.543 1.296 7.475
355 HE1 PHE 48 1HE PHE 48 -2.644 0.657 11.934
356 HE2 PHE 48 2HE PHE 48 0.325 -0.448 9.030
357 HZ PHE 48 HZ PHE 48 -0.769 -0.809 11.225
358 H ARG 49 H ARG 49 -5.585 3.027 8.761
359 HA ARG 49 HA ARG 49 -5.793 0.515 10.145
360 1HB ARG 49 2HB ARG 49 -7.791 2.806 9.980
361 2HB ARG 49 3HB ARG 49 -7.897 1.414 11.068
362 1HG ARG 49 2HG ARG 49 -5.602 2.061 11.993
363 2HG ARG 49 3HG ARG 49 -5.714 3.538 11.028
364 1HD ARG 49 2HD ARG 49 -6.475 4.100 13.218
365 2HD ARG 49 3HD ARG 49 -7.896 4.054 12.145
366 HE ARG 49 HE ARG 49 -7.396 1.497 13.414
367 1HH1 ARG 49 2HH2 ARG 49 -8.811 4.665 13.996
368 2HH1 ARG 49 1HH2 ARG 49 -9.845 4.160 15.295
369 1HH2 ARG 49 2HH1 ARG 49 -8.739 0.767 15.147
370 2HH2 ARG 49 1HH1 ARG 49 -9.790 1.871 15.968
371 H PHE 50 H PHE 50 -7.499 1.808 7.304
372 HA PHE 50 HA PHE 50 -9.494 -0.287 7.225
373 1HB PHE 50 2HB PHE 50 -9.471 2.032 6.039
374 2HB PHE 50 3HB PHE 50 -8.503 1.237 4.803
375 HD1 PHE 50 1HD PHE 50 -9.538 -0.507 3.344
376 HD2 PHE 50 2HD PHE 50 -11.804 1.435 6.459
377 HE1 PHE 50 1HE PHE 50 -11.636 -1.465 2.423
378 HE2 PHE 50 2HE PHE 50 -13.876 0.401 5.597
379 HZ PHE 50 HZ PHE 50 -13.794 -1.098 3.620
380 H ILE 51 H ILE 51 -6.162 0.086 6.025
381 HA ILE 51 HA ILE 51 -6.180 -2.347 4.474
382 HB ILE 51 HB ILE 51 -3.724 -1.063 5.678
383 1HG1 ILE 51 2HG1 ILE 51 -4.508 0.765 4.467
384 2HG1 ILE 51 3HG1 ILE 51 -3.429 -0.035 3.364
385 1HG2 ILE 51 1HG2 ILE 51 -2.623 -2.150 3.754
386 2HG2 ILE 51 2HG2 ILE 51 -3.508 -3.360 4.690
387 3HG2 ILE 51 3HG2 ILE 51 -4.202 -2.741 3.196
388 1HD1 ILE 51 1HD1 ILE 51 -5.406 0.730 2.211
389 2HD1 ILE 51 2HD1 ILE 51 -5.371 -1.041 2.164
390 3HD1 ILE 51 3HD1 ILE 51 -6.478 -0.194 3.268
391 H ASP 52 H ASP 52 -4.968 -1.565 7.781
392 HA ASP 52 HA ASP 52 -4.195 -4.307 8.208
393 1HB ASP 52 2HB ASP 52 -3.084 -2.153 9.160
394 2HB ASP 52 3HB ASP 52 -4.303 -2.240 10.439
395 H ASN 53 H ASN 53 -6.477 -4.861 7.612
396 HA ASN 53 HA ASN 53 -8.766 -4.503 9.067
397 1HB ASN 53 2HB ASN 53 -8.632 -5.509 6.860
398 2HB ASN 53 3HB ASN 53 -7.823 -6.942 7.505
399 1HD2 ASN 53 1HD2 ASN 53 -9.083 -8.572 8.555
400 2HD2 ASN 53 2HD2 ASN 53 -10.835 -8.508 8.537
401 H ASP 54 H ASP 54 -6.120 -6.687 9.924
402 HA ASP 54 HA ASP 54 -7.602 -8.331 11.810
403 1HB ASP 54 2HB ASP 54 -5.381 -9.208 12.291
404 2HB ASP 54 3HB ASP 54 -5.550 -9.066 10.531
405 H GLN 55 H GLN 55 -5.713 -5.348 11.830
406 HA GLN 55 HA GLN 55 -5.311 -3.777 13.258
407 1HB GLN 55 2HB GLN 55 -6.914 -3.084 14.631
408 2HB GLN 55 3HB GLN 55 -7.808 -4.388 13.862
409 1HG GLN 55 2HG GLN 55 -6.976 -5.813 15.942
410 2HG GLN 55 3HG GLN 55 -6.621 -4.233 16.647
411 1HE2 GLN 55 1HE2 GLN 55 -8.359 -5.819 17.964
412 2HE2 GLN 55 2HE2 GLN 55 -9.979 -5.160 17.805
413 H SER 56 H SER 56 -3.718 -6.445 13.495
414 HA SER 56 HA SER 56 -2.682 -6.698 16.029
415 1HB SER 56 2HB SER 56 -0.543 -7.326 15.067
416 2HB SER 56 3HB SER 56 -1.857 -8.067 14.159
417 HG SER 56 HG SER 56 -0.007 -6.999 12.958
418 H GLY 57 H GLY 57 -2.296 -3.914 13.926
419 1HA GLY 57 1HA GLY 57 -1.654 -1.759 14.879
420 2HA GLY 57 2HA GLY 57 -0.490 -2.579 15.929
421 H TYR 58 H TYR 58 0.079 -4.524 13.606
422 HA TYR 58 HA TYR 58 1.901 -2.758 12.066
423 1HB TYR 58 2HB TYR 58 2.303 -5.555 13.155
424 2HB TYR 58 3HB TYR 58 3.373 -4.792 11.983
425 HD1 TYR 58 HD1 TYR 58 4.802 -2.869 12.633
426 HD2 TYR 58 HD2 TYR 58 2.200 -4.775 15.495
427 HE1 TYR 58 HE1 TYR 58 5.720 -1.431 14.426
428 HE2 TYR 58 HE2 TYR 58 3.146 -3.365 17.291
429 HH TYR 58 HH TYR 58 4.565 -1.616 17.805
430 H LEU 59 H LEU 59 1.887 -2.970 9.923
431 HA LEU 59 HA LEU 59 0.016 -4.821 8.582
432 1HB LEU 59 2HB LEU 59 1.616 -2.413 7.794
433 2HB LEU 59 3HB LEU 59 1.512 -3.682 6.580
434 HG LEU 59 HG LEU 59 -0.939 -2.592 7.979
435 1HD1 LEU 59 1HD1 LEU 59 0.197 -1.802 5.260
436 2HD1 LEU 59 2HD1 LEU 59 -1.326 -1.227 5.966
437 3HD1 LEU 59 3HD1 LEU 59 0.229 -0.783 6.697
438 1HD2 LEU 59 1HD2 LEU 59 -2.197 -3.785 6.422
439 2HD2 LEU 59 2HD2 LEU 59 -0.879 -3.883 5.232
440 3HD2 LEU 59 3HD2 LEU 59 -0.873 -4.922 6.651
441 H ASP 60 H ASP 60 1.018 -6.558 9.797
442 HA ASP 60 HA ASP 60 3.700 -7.388 9.186
443 1HB ASP 60 2HB ASP 60 1.325 -9.078 10.046
444 2HB ASP 60 3HB ASP 60 3.031 -9.523 10.125
445 H GLU 61 H GLU 61 4.201 -9.316 7.838
446 HA GLU 61 HA GLU 61 3.772 -8.749 5.207
447 1HB GLU 61 2HB GLU 61 4.601 -11.382 6.466
448 2HB GLU 61 3HB GLU 61 4.659 -11.046 4.729
449 1HG GLU 61 2HG GLU 61 6.136 -9.114 5.105
450 2HG GLU 61 3HG GLU 61 6.145 -9.428 6.847
451 H GLU 62 H GLU 62 1.787 -11.019 7.140
452 HA GLU 62 HA GLU 62 0.587 -12.202 4.816
453 1HB GLU 62 2HB GLU 62 0.726 -13.222 7.172
454 2HB GLU 62 3HB GLU 62 -0.606 -12.149 7.638
455 1HG GLU 62 2HG GLU 62 -2.009 -13.156 5.834
456 2HG GLU 62 3HG GLU 62 -0.651 -14.203 5.369
457 H GLU 63 H GLU 63 -0.669 -9.701 7.134
458 HA GLU 63 HA GLU 63 -2.951 -9.095 5.558
459 1HB GLU 63 2HB GLU 63 -1.394 -7.115 7.257
460 2HB GLU 63 3HB GLU 63 -3.097 -7.039 6.766
461 1HG GLU 63 2HG GLU 63 -3.418 -8.000 8.805
462 2HG GLU 63 3HG GLU 63 -3.110 -9.500 7.955
463 H LEU 64 H LEU 64 0.432 -8.034 5.232
464 HA LEU 64 HA LEU 64 0.045 -6.163 3.167
465 1HB LEU 64 2HB LEU 64 2.260 -7.444 4.347
466 2HB LEU 64 3HB LEU 64 2.363 -7.864 2.638
467 HG LEU 64 HG LEU 64 1.993 -5.288 2.251
468 1HD1 LEU 64 1HD1 LEU 64 1.360 -4.932 4.706
469 2HD1 LEU 64 2HD1 LEU 64 3.033 -5.313 5.134
470 3HD1 LEU 64 3HD1 LEU 64 2.687 -3.880 4.152
471 1HD2 LEU 64 1HD2 LEU 64 4.554 -6.361 3.492
472 2HD2 LEU 64 2HD2 LEU 64 4.121 -6.351 1.767
473 3HD2 LEU 64 3HD2 LEU 64 4.406 -4.823 2.610
474 H LYS 65 H LYS 65 -0.071 -9.731 3.014
475 HA LYS 65 HA LYS 65 -0.241 -9.986 0.175
476 1HB LYS 65 2HB LYS 65 0.097 -11.794 2.002
477 2HB LYS 65 3HB LYS 65 -1.678 -11.741 2.143
478 1HG LYS 65 2HG LYS 65 -1.929 -12.427 -0.197
479 2HG LYS 65 3HG LYS 65 -0.179 -12.365 -0.422
480 1HD LYS 65 2HD LYS 65 -0.947 -14.663 -0.099
481 2HD LYS 65 3HD LYS 65 0.124 -14.170 1.227
482 1HE LYS 65 2HE LYS 65 -1.828 -13.805 2.719
483 2HE LYS 65 3HE LYS 65 -2.937 -14.140 1.373
484 1HZ LYS 65 1HZ LYS 65 -1.045 -16.043 2.592
485 2HZ LYS 65 2HZ LYS 65 -2.658 -15.981 2.879
486 3HZ LYS 65 3HZ LYS 65 -2.112 -16.393 1.380
487 H PHE 66 H PHE 66 -2.438 -8.443 2.330
488 HA PHE 66 HA PHE 66 -4.438 -8.371 0.160
489 1HB PHE 66 2HB PHE 66 -4.950 -8.689 3.142
490 2HB PHE 66 3HB PHE 66 -6.183 -8.128 2.032
491 HD1 PHE 66 1HD PHE 66 -4.235 -11.087 3.065
492 HD2 PHE 66 2HD PHE 66 -7.310 -9.567 0.448
493 HE1 PHE 66 1HE PHE 66 -4.974 -13.401 2.552
494 HE2 PHE 66 2HE PHE 66 -7.885 -11.868 -0.228
495 HZ PHE 66 HZ PHE 66 -6.735 -13.799 0.834
496 H PHE 67 H PHE 67 -2.131 -6.600 0.830
497 HA PHE 67 HA PHE 67 -3.016 -4.359 2.256
498 1HB PHE 67 2HB PHE 67 -0.667 -4.949 1.379
499 2HB PHE 67 3HB PHE 67 -1.121 -4.143 -0.089
500 HD1 PHE 67 1HD PHE 67 0.422 -3.716 3.017
501 HD2 PHE 67 2HD PHE 67 -2.023 -1.657 0.150
502 HE1 PHE 67 1HE PHE 67 1.812 -1.686 3.298
503 HE2 PHE 67 2HE PHE 67 -0.701 0.406 0.502
504 HZ PHE 67 HZ PHE 67 1.334 0.324 1.949
505 H LEU 68 H LEU 68 -2.794 -4.604 -1.329
506 HA LEU 68 HA LEU 68 -4.815 -2.468 -1.650
507 1HB LEU 68 2HB LEU 68 -3.216 -3.985 -3.711
508 2HB LEU 68 3HB LEU 68 -4.122 -2.487 -3.973
509 HG LEU 68 HG LEU 68 -1.692 -2.757 -2.125
510 1HD1 LEU 68 1HD1 LEU 68 -0.453 -1.575 -3.839
511 2HD1 LEU 68 2HD1 LEU 68 -1.115 -3.073 -4.493
512 3HD1 LEU 68 3HD1 LEU 68 -1.883 -1.523 -4.896
513 1HD2 LEU 68 1HD2 LEU 68 -1.751 -0.320 -2.068
514 2HD2 LEU 68 2HD2 LEU 68 -3.140 -0.301 -3.182
515 3HD2 LEU 68 3HD2 LEU 68 -3.320 -0.901 -1.523
516 H GLN 69 H GLN 69 -4.916 -5.865 -1.452
517 HA GLN 69 HA GLN 69 -7.043 -6.520 -3.227
518 1HB GLN 69 2HB GLN 69 -6.437 -7.476 -0.409
519 2HB GLN 69 3HB GLN 69 -7.677 -8.190 -1.443
520 1HG GLN 69 2HG GLN 69 -4.748 -8.087 -2.259
521 2HG GLN 69 3HG GLN 69 -5.501 -9.459 -1.445
522 1HE2 GLN 69 1HE2 GLN 69 -5.210 -7.813 -4.533
523 2HE2 GLN 69 2HE2 GLN 69 -6.191 -9.015 -5.389
524 H LYS 70 H LYS 70 -7.039 -4.738 -0.134
525 HA LYS 70 HA LYS 70 -9.845 -4.793 0.303
526 1HB LYS 70 2HB LYS 70 -8.145 -2.356 0.879
527 2HB LYS 70 3HB LYS 70 -9.566 -2.910 1.743
528 1HG LYS 70 2HG LYS 70 -6.728 -3.963 1.816
529 2HG LYS 70 3HG LYS 70 -7.655 -3.237 3.108
530 1HD LYS 70 2HD LYS 70 -8.139 -6.023 1.946
531 2HD LYS 70 3HD LYS 70 -7.239 -5.614 3.397
532 1HE LYS 70 2HE LYS 70 -9.295 -6.261 4.262
533 2HE LYS 70 3HE LYS 70 -9.343 -4.495 4.332
534 1HZ LYS 70 1HZ LYS 70 -10.589 -6.189 2.257
535 2HZ LYS 70 2HZ LYS 70 -11.378 -5.449 3.496
536 3HZ LYS 70 3HZ LYS 70 -10.669 -4.546 2.319
537 H PHE 71 H PHE 71 -7.913 -3.047 -2.056
538 HA PHE 71 HA PHE 71 -10.062 -1.143 -2.720
539 1HB PHE 71 2HB PHE 71 -7.427 -1.615 -4.158
540 2HB PHE 71 3HB PHE 71 -8.507 -0.240 -4.278
541 HD1 PHE 71 1HD PHE 71 -5.678 0.179 -3.971
542 HD2 PHE 71 2HD PHE 71 -8.662 -0.402 -0.906
543 HE1 PHE 71 1HE PHE 71 -4.384 1.603 -2.408
544 HE2 PHE 71 2HE PHE 71 -7.236 0.783 0.704
545 HZ PHE 71 HZ PHE 71 -5.106 1.831 -0.045
546 H GLU 72 H GLU 72 -8.143 -3.750 -4.328
547 HA GLU 72 HA GLU 72 -10.474 -4.331 -6.081
548 1HB GLU 72 2HB GLU 72 -8.739 -2.594 -7.011
549 2HB GLU 72 3HB GLU 72 -7.686 -3.984 -7.242
550 1HG GLU 72 2HG GLU 72 -8.780 -4.517 -9.154
551 2HG GLU 72 3HG GLU 72 -10.340 -4.586 -8.323
552 H SER 73 H SER 73 -10.745 -6.524 -6.313
553 HA SER 73 HA SER 73 -9.277 -8.392 -4.812
554 1HB SER 73 2HB SER 73 -10.535 -10.026 -6.367
555 2HB SER 73 3HB SER 73 -11.503 -8.883 -5.421
556 HG SER 73 HG SER 73 -10.826 -8.668 -8.168
557 H GLY 74 H GLY 74 -8.618 -7.075 -7.974
558 1HA GLY 74 1HA GLY 74 -6.561 -9.193 -8.550
559 2HA GLY 74 2HA GLY 74 -7.347 -8.154 -9.734
560 H ALA 75 H ALA 75 -6.412 -6.603 -6.704
561 HA ALA 75 HA ALA 75 -5.005 -4.624 -7.989
562 1HB ALA 75 1HB ALA 75 -5.811 -4.371 -5.713
563 2HB ALA 75 2HB ALA 75 -4.634 -5.562 -5.114
564 3HB ALA 75 3HB ALA 75 -4.082 -4.018 -5.811
565 H ARG 76 H ARG 76 -3.252 -7.063 -5.955
566 HA ARG 76 HA ARG 76 -1.412 -7.719 -8.012
567 1HB ARG 76 2HB ARG 76 -0.771 -5.190 -7.081
568 2HB ARG 76 3HB ARG 76 0.080 -6.164 -5.895
569 1HG ARG 76 2HG ARG 76 1.603 -5.865 -7.583
570 2HG ARG 76 3HG ARG 76 1.055 -7.526 -7.810
571 1HD ARG 76 2HD ARG 76 -0.158 -6.969 -9.781
572 2HD ARG 76 3HD ARG 76 -0.351 -5.265 -9.298
573 HE ARG 76 HE ARG 76 2.423 -5.861 -9.559
574 1HH1 ARG 76 2HH2 ARG 76 -0.389 -5.640 -11.599
575 2HH1 ARG 76 1HH2 ARG 76 0.465 -5.047 -12.977
576 1HH2 ARG 76 2HH1 ARG 76 3.498 -4.910 -10.995
577 2HH2 ARG 76 1HH1 ARG 76 2.878 -4.511 -12.592
578 H GLU 77 H GLU 77 -1.575 -7.131 -4.614
579 HA GLU 77 HA GLU 77 0.239 -8.328 -3.376
580 1HB GLU 77 2HB GLU 77 -2.480 -9.015 -2.305
581 2HB GLU 77 3HB GLU 77 -1.045 -8.402 -1.456
582 1HG GLU 77 2HG GLU 77 -3.083 -6.883 -3.122
583 2HG GLU 77 3HG GLU 77 -2.642 -6.672 -1.427
584 H LEU 78 H LEU 78 -2.264 -10.262 -4.777
585 HA LEU 78 HA LEU 78 -1.981 -12.864 -4.091
586 1HB LEU 78 2HB LEU 78 -1.706 -12.006 -6.996
587 2HB LEU 78 3HB LEU 78 -2.425 -13.457 -6.327
588 HG LEU 78 HG LEU 78 -4.230 -12.330 -7.041
589 1HD1 LEU 78 1HD1 LEU 78 -4.146 -11.213 -4.205
590 2HD1 LEU 78 2HD1 LEU 78 -5.565 -11.543 -5.209
591 3HD1 LEU 78 3HD1 LEU 78 -4.558 -12.887 -4.642
592 1HD2 LEU 78 1HD2 LEU 78 -4.697 -10.069 -7.193
593 2HD2 LEU 78 2HD2 LEU 78 -3.496 -9.590 -6.007
594 3HD2 LEU 78 3HD2 LEU 78 -2.983 -10.188 -7.602
595 H THR 79 H THR 79 0.409 -11.057 -6.139
596 HA THR 79 HA THR 79 2.220 -13.392 -6.139
597 HB THR 79 HB THR 79 2.283 -12.477 -8.211
598 HG1 THR 79 1HG THR 79 4.254 -11.277 -8.325
599 1HG2 THR 79 1HG2 THR 79 0.989 -10.493 -8.064
600 2HG2 THR 79 2HG2 THR 79 2.181 -9.702 -6.997
601 3HG2 THR 79 3HG2 THR 79 2.556 -10.024 -8.706
602 H GLU 80 H GLU 80 3.629 -13.750 -4.574
603 HA GLU 80 HA GLU 80 4.093 -12.063 -2.397
604 1HB GLU 80 2HB GLU 80 5.902 -13.478 -1.795
605 2HB GLU 80 3HB GLU 80 4.562 -14.477 -2.339
606 1HG GLU 80 2HG GLU 80 5.702 -15.070 -4.369
607 2HG GLU 80 3HG GLU 80 6.905 -13.788 -4.183
608 H SER 81 H SER 81 5.599 -12.061 -5.592
609 HA SER 81 HA SER 81 8.033 -10.787 -4.916
610 1HB SER 81 2HB SER 81 7.431 -11.869 -7.158
611 2HB SER 81 3HB SER 81 6.560 -10.375 -7.557
612 HG SER 81 HG SER 81 8.544 -9.948 -8.266
613 H GLU 82 H GLU 82 5.008 -9.336 -6.241
614 HA GLU 82 HA GLU 82 5.925 -6.668 -5.958
615 1HB GLU 82 2HB GLU 82 3.088 -7.706 -6.155
616 2HB GLU 82 3HB GLU 82 3.623 -6.049 -6.467
617 1HG GLU 82 2HG GLU 82 4.924 -8.279 -8.086
618 2HG GLU 82 3HG GLU 82 3.275 -7.805 -8.453
619 H THR 83 H THR 83 3.840 -8.723 -3.837
620 HA THR 83 HA THR 83 3.369 -6.853 -1.767
621 HB THR 83 HB THR 83 3.639 -9.843 -1.892
622 HG1 THR 83 1HG THR 83 1.679 -8.307 -0.585
623 1HG2 THR 83 1HG2 THR 83 3.550 -8.296 0.722
624 2HG2 THR 83 2HG2 THR 83 3.126 -10.007 0.549
625 3HG2 THR 83 3HG2 THR 83 4.783 -9.479 0.239
626 H LYS 84 H LYS 84 6.292 -8.960 -2.266
627 HA LYS 84 HA LYS 84 7.567 -7.754 0.010
628 1HB LYS 84 2HB LYS 84 8.566 -9.640 -2.111
629 2HB LYS 84 3HB LYS 84 9.631 -8.915 -0.893
630 1HG LYS 84 2HG LYS 84 8.126 -9.712 0.934
631 2HG LYS 84 3HG LYS 84 7.153 -10.578 -0.259
632 1HD LYS 84 2HD LYS 84 10.159 -11.007 0.109
633 2HD LYS 84 3HD LYS 84 8.936 -11.889 1.047
634 1HE LYS 84 2HE LYS 84 7.917 -12.798 -0.960
635 2HE LYS 84 3HE LYS 84 8.983 -11.875 -2.023
636 1HZ LYS 84 1HZ LYS 84 10.794 -13.201 -1.330
637 2HZ LYS 84 2HZ LYS 84 9.906 -13.943 -0.144
638 3HZ LYS 84 3HZ LYS 84 9.517 -14.184 -1.717
639 H SER 85 H SER 85 7.622 -6.891 -3.476
640 HA SER 85 HA SER 85 9.670 -4.963 -3.307
641 1HB SER 85 2HB SER 85 7.066 -4.671 -4.875
642 2HB SER 85 3HB SER 85 8.627 -3.929 -5.224
643 HG SER 85 HG SER 85 9.431 -6.166 -5.403
644 H LEU 86 H LEU 86 6.170 -4.720 -2.494
645 HA LEU 86 HA LEU 86 6.282 -2.006 -1.606
646 1HB LEU 86 2HB LEU 86 4.270 -3.784 -2.013
647 2HB LEU 86 3HB LEU 86 4.351 -3.865 -0.254
648 HG LEU 86 HG LEU 86 3.987 -1.365 -1.971
649 1HD1 LEU 86 1HD1 LEU 86 2.031 -2.799 -0.126
650 2HD1 LEU 86 2HD1 LEU 86 1.707 -1.337 -1.081
651 3HD1 LEU 86 3HD1 LEU 86 2.017 -2.876 -1.899
652 1HD2 LEU 86 1HD2 LEU 86 3.478 -0.210 0.187
653 2HD2 LEU 86 2HD2 LEU 86 4.018 -1.654 1.068
654 3HD2 LEU 86 3HD2 LEU 86 5.163 -0.720 0.078
655 H MET 87 H MET 87 6.322 -5.060 0.285
656 HA MET 87 HA MET 87 6.808 -4.110 2.785
657 1HB MET 87 2HB MET 87 6.552 -6.561 2.049
658 2HB MET 87 3HB MET 87 8.259 -6.507 1.630
659 1HG MET 87 2HG MET 87 8.531 -5.686 4.168
660 2HG MET 87 3HG MET 87 6.964 -6.478 4.331
661 1HE MET 87 1HE MET 87 10.989 -8.509 3.347
662 2HE MET 87 2HE MET 87 10.233 -7.425 2.162
663 3HE MET 87 3HE MET 87 10.771 -6.789 3.737
664 H ALA 88 H ALA 88 9.288 -4.893 0.383
665 HA ALA 88 HA ALA 88 11.609 -4.623 1.826
666 1HB ALA 88 1HB ALA 88 11.567 -5.592 -0.395
667 2HB ALA 88 2HB ALA 88 11.042 -4.066 -1.122
668 3HB ALA 88 3HB ALA 88 12.675 -4.209 -0.426
669 H ALA 89 H ALA 89 9.837 -2.025 0.100
670 HA ALA 89 HA ALA 89 11.803 0.000 0.993
671 1HB ALA 89 1HB ALA 89 10.839 0.338 -1.150
672 2HB ALA 89 2HB ALA 89 9.176 0.214 -0.504
673 3HB ALA 89 3HB ALA 89 10.213 1.594 -0.067
674 H ALA 90 H ALA 90 8.358 -0.834 1.636
675 HA ALA 90 HA ALA 90 7.694 1.226 3.407
676 1HB ALA 90 1HB ALA 90 6.851 -1.696 3.481
677 2HB ALA 90 2HB ALA 90 6.002 -0.348 4.266
678 3HB ALA 90 3HB ALA 90 6.099 -0.426 2.488
679 H ASP 91 H ASP 91 9.297 -1.888 4.161
680 HA ASP 91 HA ASP 91 9.405 -1.326 6.982
681 1HB ASP 91 2HB ASP 91 9.367 -3.644 6.109
682 2HB ASP 91 3HB ASP 91 10.950 -3.384 5.358
683 H ASN 92 H ASN 92 10.315 0.844 6.845
684 HA ASN 92 HA ASN 92 13.074 1.182 5.914
685 1HB ASN 92 2HB ASN 92 12.885 3.461 6.749
686 2HB ASN 92 3HB ASN 92 11.558 3.012 5.674
687 1HD2 ASN 92 1HD2 ASN 92 11.087 5.333 7.202
688 2HD2 ASN 92 2HD2 ASN 92 9.998 4.879 8.467
689 H ASP 93 H ASP 93 13.225 -0.928 7.458
690 HA ASP 93 HA ASP 93 14.787 -0.078 9.858
691 1HB ASP 93 2HB ASP 93 12.707 -2.310 9.715
692 2HB ASP 93 3HB ASP 93 13.937 -2.191 10.970
693 H GLY 94 H GLY 94 13.718 -2.943 7.974
694 1HA GLY 94 1HA GLY 94 15.206 -4.489 6.863
695 2HA GLY 94 2HA GLY 94 16.491 -4.075 8.008
696 H ASP 95 H ASP 95 12.989 -4.734 8.472
697 HA ASP 95 HA ASP 95 13.624 -7.236 9.930
698 1HB ASP 95 2HB ASP 95 12.034 -6.854 11.662
699 2HB ASP 95 3HB ASP 95 13.264 -5.588 11.677
700 H GLY 96 H GLY 96 10.764 -5.371 8.693
701 1HA GLY 96 1HA GLY 96 9.891 -6.281 6.511
702 2HA GLY 96 2HA GLY 96 9.861 -7.872 7.278
703 H LYS 97 H LYS 97 9.140 -6.295 9.888
704 HA LYS 97 HA LYS 97 6.216 -6.566 9.617
705 1HB LYS 97 2HB LYS 97 7.948 -5.847 12.012
706 2HB LYS 97 3HB LYS 97 6.246 -6.317 12.028
707 1HG LYS 97 2HG LYS 97 6.849 -8.613 11.337
708 2HG LYS 97 3HG LYS 97 8.535 -8.133 11.101
709 1HD LYS 97 2HD LYS 97 8.672 -9.124 13.188
710 2HD LYS 97 3HD LYS 97 8.601 -7.406 13.534
711 1HE LYS 97 2HE LYS 97 7.064 -8.203 15.084
712 2HE LYS 97 3HE LYS 97 5.977 -7.799 13.747
713 1HZ LYS 97 1HZ LYS 97 5.488 -9.938 14.605
714 2HZ LYS 97 2HZ LYS 97 6.062 -10.110 13.081
715 3HZ LYS 97 3HZ LYS 97 7.029 -10.474 14.374
716 H ILE 98 H ILE 98 5.240 -4.731 8.818
717 HA ILE 98 HA ILE 98 6.587 -2.089 9.097
718 HB ILE 98 HB ILE 98 4.507 -3.266 7.257
719 1HG1 ILE 98 2HG1 ILE 98 6.993 -1.923 6.286
720 2HG1 ILE 98 3HG1 ILE 98 7.273 -3.392 7.207
721 1HG2 ILE 98 1HG2 ILE 98 5.481 -0.390 7.201
722 2HG2 ILE 98 2HG2 ILE 98 4.437 -1.186 6.015
723 3HG2 ILE 98 3HG2 ILE 98 3.843 -0.915 7.657
724 1HD1 ILE 98 1HD1 ILE 98 5.481 -3.209 4.769
725 2HD1 ILE 98 2HD1 ILE 98 7.114 -3.920 4.902
726 3HD1 ILE 98 3HD1 ILE 98 5.753 -4.665 5.762
727 H GLY 99 H GLY 99 5.564 -0.392 10.177
728 1HA GLY 99 1HA GLY 99 2.959 -0.995 11.549
729 2HA GLY 99 2HA GLY 99 4.261 -0.023 12.238
730 H ALA 100 H ALA 100 1.927 1.200 12.250
731 HA ALA 100 HA ALA 100 1.137 2.557 9.862
732 1HB ALA 100 1HB ALA 100 0.878 3.528 12.730
733 2HB ALA 100 2HB ALA 100 -0.051 4.058 11.302
734 3HB ALA 100 3HB ALA 100 -0.249 2.409 11.927
735 H GLU 101 H GLU 101 3.518 3.270 12.441
736 HA GLU 101 HA GLU 101 4.317 5.803 11.526
737 1HB GLU 101 2HB GLU 101 5.789 3.611 13.051
738 2HB GLU 101 3HB GLU 101 6.563 5.139 12.610
739 1HG GLU 101 2HG GLU 101 4.829 6.425 13.764
740 2HG GLU 101 3HG GLU 101 3.979 4.934 14.219
741 H GLU 102 H GLU 102 5.972 2.667 10.864
742 HA GLU 102 HA GLU 102 7.745 3.507 8.933
743 1HB GLU 102 2HB GLU 102 6.265 0.861 8.830
744 2HB GLU 102 3HB GLU 102 7.874 1.228 8.208
745 1HG GLU 102 2HG GLU 102 8.644 1.658 10.558
746 2HG GLU 102 3HG GLU 102 7.079 1.099 11.170
747 H PHE 103 H PHE 103 4.357 2.453 8.420
748 HA PHE 103 HA PHE 103 4.373 2.674 5.575
749 1HB PHE 103 2HB PHE 103 2.703 1.359 6.678
750 2HB PHE 103 3HB PHE 103 2.169 2.722 7.651
751 HD1 PHE 103 1HD PHE 103 0.378 4.076 6.936
752 HD2 PHE 103 2HD PHE 103 2.517 1.736 4.021
753 HE1 PHE 103 1HE PHE 103 -1.330 4.635 5.221
754 HE2 PHE 103 2HE PHE 103 0.889 2.465 2.280
755 HZ PHE 103 HZ PHE 103 -1.090 3.803 2.906
756 H GLN 104 H GLN 104 3.124 4.978 8.060
757 HA GLN 104 HA GLN 104 2.401 7.129 6.316
758 1HB GLN 104 2HB GLN 104 1.836 6.910 8.744
759 2HB GLN 104 3HB GLN 104 3.521 7.309 9.136
760 1HG GLN 104 2HG GLN 104 3.217 9.466 7.809
761 2HG GLN 104 3HG GLN 104 1.508 9.051 7.633
762 1HE2 GLN 104 1HE2 GLN 104 0.724 8.188 10.112
763 2HE2 GLN 104 2HE2 GLN 104 1.029 9.452 11.301
764 H GLU 105 H GLU 105 5.550 6.237 7.845
765 HA GLU 105 HA GLU 105 7.046 8.460 7.058
766 1HB GLU 105 2HB GLU 105 7.560 5.912 8.242
767 2HB GLU 105 3HB GLU 105 8.605 5.985 6.833
768 1HG GLU 105 2HG GLU 105 8.426 8.241 8.887
769 2HG GLU 105 3HG GLU 105 9.534 6.880 9.053
770 H MET 106 H MET 106 6.703 5.335 5.264
771 HA MET 106 HA MET 106 8.031 6.241 2.897
772 1HB MET 106 2HB MET 106 6.292 3.960 3.610
773 2HB MET 106 3HB MET 106 6.119 4.505 1.936
774 1HG MET 106 2HG MET 106 7.848 2.863 2.019
775 2HG MET 106 3HG MET 106 8.562 4.400 1.601
776 1HE MET 106 1HE MET 106 10.133 5.867 3.375
777 2HE MET 106 2HE MET 106 11.370 4.785 4.023
778 3HE MET 106 3HE MET 106 10.911 4.663 2.313
779 H VAL 107 H VAL 107 4.601 6.248 3.806
780 HA VAL 107 HA VAL 107 3.851 7.459 1.372
781 HB VAL 107 HB VAL 107 2.291 6.820 3.876
782 1HG1 VAL 107 1HG1 VAL 107 0.288 7.022 2.351
783 2HG1 VAL 107 2HG1 VAL 107 1.047 8.575 2.735
784 3HG1 VAL 107 3HG1 VAL 107 1.351 7.795 1.170
785 1HG2 VAL 107 1HG2 VAL 107 1.417 5.041 2.314
786 2HG2 VAL 107 2HG2 VAL 107 2.593 5.546 1.105
787 3HG2 VAL 107 3HG2 VAL 107 3.143 4.853 2.642
788 H HIS 108 H HIS 108 5.226 8.920 4.079
789 HA HIS 108 HA HIS 108 4.043 11.553 3.611
790 1HB HIS 108 2HB HIS 108 4.551 10.867 5.870
791 2HB HIS 108 3HB HIS 108 6.207 10.435 5.437
792 HD1 HIS 108 1HD HIS 108 4.107 13.699 5.563
793 HD2 HIS 108 2HD HIS 108 7.984 12.156 6.109
794 HE1 HIS 108 1HE HIS 108 5.543 15.617 6.461
795 H SER 109 H SER 109 6.414 9.651 2.056
796 HA SER 109 HA SER 109 8.506 11.579 1.894
797 1HB SER 109 2HB SER 109 8.793 9.091 1.784
798 2HB SER 109 3HB SER 109 8.051 9.129 0.170
799 HG SER 109 HG SER 109 9.707 10.899 -0.156
Start of MODEL 16
1 1H MET 1 H1 MET 1 -17.590 7.615 2.333
2 2H MET 1 H2 MET 1 -19.000 7.106 1.593
3 3H MET 1 H3 MET 1 -18.289 6.223 2.814
4 HA MET 1 HA MET 1 -17.783 5.170 0.737
5 1HB MET 1 2HB MET 1 -16.394 7.822 0.087
6 2HB MET 1 3HB MET 1 -16.422 6.314 -0.833
7 1HG MET 1 2HG MET 1 -18.711 8.235 -0.458
8 2HG MET 1 3HG MET 1 -17.901 7.744 -1.946
9 1HE MET 1 1HE MET 1 -20.117 7.285 -3.214
10 2HE MET 1 2HE MET 1 -21.460 6.332 -2.543
11 3HE MET 1 3HE MET 1 -21.005 7.879 -1.784
12 H SER 2 H SER 2 -15.535 4.444 0.189
13 HA SER 2 HA SER 2 -13.859 4.558 2.676
14 1HB SER 2 2HB SER 2 -13.910 2.508 0.419
15 2HB SER 2 3HB SER 2 -12.892 2.447 1.875
16 HG SER 2 HG SER 2 -15.724 2.453 1.839
17 H ILE 3 H ILE 3 -11.437 3.921 1.659
18 HA ILE 3 HA ILE 3 -10.501 6.384 0.711
19 HB ILE 3 HB ILE 3 -8.363 5.384 0.607
20 1HG1 ILE 3 2HG1 ILE 3 -8.318 2.729 0.966
21 2HG1 ILE 3 3HG1 ILE 3 -9.807 2.797 0.035
22 1HG2 ILE 3 1HG2 ILE 3 -9.887 3.824 2.746
23 2HG2 ILE 3 2HG2 ILE 3 -8.186 4.228 2.723
24 3HG2 ILE 3 3HG2 ILE 3 -9.385 5.527 2.870
25 1HD1 ILE 3 1HD1 ILE 3 -7.014 3.769 -0.733
26 2HD1 ILE 3 2HD1 ILE 3 -7.987 2.509 -1.523
27 3HD1 ILE 3 3HD1 ILE 3 -8.441 4.192 -1.688
28 H THR 4 H THR 4 -11.717 3.580 -1.112
29 HA THR 4 HA THR 4 -10.387 4.292 -3.597
30 HB THR 4 HB THR 4 -10.272 1.996 -2.939
31 HG1 THR 4 1HG THR 4 -12.472 2.389 -4.575
32 1HG2 THR 4 1HG2 THR 4 -13.230 2.249 -2.222
33 2HG2 THR 4 2HG2 THR 4 -12.479 0.690 -2.549
34 3HG2 THR 4 3HG2 THR 4 -11.891 1.650 -1.202
35 H ASP 5 H ASP 5 -11.854 6.359 -2.991
36 HA ASP 5 HA ASP 5 -14.099 6.581 -4.843
37 1HB ASP 5 2HB ASP 5 -14.543 6.130 -1.876
38 2HB ASP 5 3HB ASP 5 -15.615 7.217 -2.781
39 H VAL 6 H VAL 6 -12.967 7.633 -1.663
40 HA VAL 6 HA VAL 6 -13.653 10.297 -1.617
41 HB VAL 6 HB VAL 6 -11.368 8.702 -0.423
42 1HG1 VAL 6 1HG1 VAL 6 -10.413 10.940 -0.490
43 2HG1 VAL 6 2HG1 VAL 6 -11.921 11.638 0.153
44 3HG1 VAL 6 3HG1 VAL 6 -10.927 10.556 1.154
45 1HG2 VAL 6 1HG2 VAL 6 -13.755 10.078 0.882
46 2HG2 VAL 6 2HG2 VAL 6 -13.798 8.408 0.314
47 3HG2 VAL 6 3HG2 VAL 6 -12.673 8.868 1.604
48 H LEU 7 H LEU 7 -10.825 8.863 -3.104
49 HA LEU 7 HA LEU 7 -10.553 10.909 -5.094
50 1HB LEU 7 2HB LEU 7 -9.463 12.262 -3.507
51 2HB LEU 7 3HB LEU 7 -8.694 10.881 -2.717
52 HG LEU 7 HG LEU 7 -7.075 10.635 -4.468
53 1HD1 LEU 7 1HD1 LEU 7 -8.377 11.186 -6.490
54 2HD1 LEU 7 2HD1 LEU 7 -8.469 12.885 -5.980
55 3HD1 LEU 7 3HD1 LEU 7 -6.906 12.138 -6.398
56 1HD2 LEU 7 1HD2 LEU 7 -7.361 13.119 -2.975
57 2HD2 LEU 7 2HD2 LEU 7 -5.903 12.180 -3.370
58 3HD2 LEU 7 3HD2 LEU 7 -6.489 13.402 -4.487
59 H SER 8 H SER 8 -8.649 8.570 -3.164
60 HA SER 8 HA SER 8 -6.991 7.719 -4.986
61 1HB SER 8 2HB SER 8 -7.701 5.484 -3.293
62 2HB SER 8 3HB SER 8 -6.235 6.463 -3.348
63 HG SER 8 HG SER 8 -8.638 6.941 -1.919
64 H ALA 9 H ALA 9 -10.320 6.919 -5.367
65 HA ALA 9 HA ALA 9 -10.184 4.460 -6.817
66 1HB ALA 9 1HB ALA 9 -12.331 5.455 -6.248
67 2HB ALA 9 2HB ALA 9 -11.949 6.923 -7.170
68 3HB ALA 9 3HB ALA 9 -12.185 5.373 -8.005
69 H ASP 10 H ASP 10 -9.682 7.893 -7.807
70 HA ASP 10 HA ASP 10 -9.296 7.262 -10.601
71 1HB ASP 10 2HB ASP 10 -9.975 9.500 -9.725
72 2HB ASP 10 3HB ASP 10 -8.376 9.680 -8.978
73 H ASP 11 H ASP 11 -7.194 7.624 -7.767
74 HA ASP 11 HA ASP 11 -4.717 7.633 -9.175
75 1HB ASP 11 2HB ASP 11 -5.331 6.947 -6.270
76 2HB ASP 11 3HB ASP 11 -3.760 7.269 -6.986
77 H ILE 12 H ILE 12 -6.517 4.989 -7.398
78 HA ILE 12 HA ILE 12 -4.681 2.997 -8.119
79 HB ILE 12 HB ILE 12 -6.301 1.428 -7.594
80 1HG1 ILE 12 2HG1 ILE 12 -8.321 3.584 -7.325
81 2HG1 ILE 12 3HG1 ILE 12 -8.349 2.236 -8.461
82 1HG2 ILE 12 1HG2 ILE 12 -4.954 2.492 -5.830
83 2HG2 ILE 12 2HG2 ILE 12 -6.293 3.593 -5.478
84 3HG2 ILE 12 3HG2 ILE 12 -6.481 1.850 -5.225
85 1HD1 ILE 12 1HD1 ILE 12 -8.746 2.105 -5.451
86 2HD1 ILE 12 2HD1 ILE 12 -9.905 1.734 -6.734
87 3HD1 ILE 12 3HD1 ILE 12 -8.508 0.672 -6.488
88 H ALA 13 H ALA 13 -7.616 4.236 -9.823
89 HA ALA 13 HA ALA 13 -7.559 2.406 -11.956
90 1HB ALA 13 1HB ALA 13 -8.682 4.104 -13.287
91 2HB ALA 13 2HB ALA 13 -9.341 4.075 -11.640
92 3HB ALA 13 3HB ALA 13 -8.233 5.371 -12.136
93 H ALA 14 H ALA 14 -5.696 5.495 -11.648
94 HA ALA 14 HA ALA 14 -4.222 5.178 -14.070
95 1HB ALA 14 1HB ALA 14 -3.350 6.538 -11.480
96 2HB ALA 14 2HB ALA 14 -2.613 6.742 -13.079
97 3HB ALA 14 3HB ALA 14 -4.282 7.279 -12.795
98 H ALA 15 H ALA 15 -3.243 4.358 -10.738
99 HA ALA 15 HA ALA 15 -0.793 3.206 -11.095
100 1HB ALA 15 1HB ALA 15 -2.771 2.003 -9.140
101 2HB ALA 15 2HB ALA 15 -1.059 2.420 -8.914
102 3HB ALA 15 3HB ALA 15 -2.262 3.687 -8.948
103 H LEU 16 H LEU 16 -3.910 1.681 -11.328
104 HA LEU 16 HA LEU 16 -3.171 -1.004 -11.608
105 1HB LEU 16 2HB LEU 16 -5.410 -0.311 -11.054
106 2HB LEU 16 3HB LEU 16 -5.602 0.563 -12.569
107 HG LEU 16 HG LEU 16 -6.872 -1.542 -12.328
108 1HD1 LEU 16 1HD1 LEU 16 -6.705 -2.268 -14.564
109 2HD1 LEU 16 2HD1 LEU 16 -6.366 -0.529 -14.554
110 3HD1 LEU 16 3HD1 LEU 16 -5.046 -1.701 -14.743
111 1HD2 LEU 16 1HD2 LEU 16 -5.810 -3.711 -12.625
112 2HD2 LEU 16 2HD2 LEU 16 -4.200 -2.969 -12.639
113 3HD2 LEU 16 3HD2 LEU 16 -5.196 -2.907 -11.169
114 H GLN 17 H GLN 17 -3.322 1.691 -13.972
115 HA GLN 17 HA GLN 17 -3.093 -0.261 -16.212
116 1HB GLN 17 2HB GLN 17 -4.622 1.624 -16.470
117 2HB GLN 17 3HB GLN 17 -3.288 2.774 -16.274
118 1HG GLN 17 2HG GLN 17 -2.178 1.950 -18.278
119 2HG GLN 17 3HG GLN 17 -3.303 0.592 -18.416
120 1HE2 GLN 17 1HE2 GLN 17 -5.754 1.365 -18.489
121 2HE2 GLN 17 2HE2 GLN 17 -6.022 2.670 -19.632
122 H GLU 18 H GLU 18 -1.345 2.465 -14.696
123 HA GLU 18 HA GLU 18 0.802 2.401 -16.513
124 1HB GLU 18 2HB GLU 18 1.732 4.113 -15.210
125 2HB GLU 18 3HB GLU 18 -0.022 4.262 -15.085
126 1HG GLU 18 2HG GLU 18 0.426 4.570 -12.900
127 2HG GLU 18 3HG GLU 18 0.302 2.805 -12.905
128 H CYS 19 H CYS 19 0.340 0.655 -13.434
129 HA CYS 19 HA CYS 19 2.665 -1.108 -14.198
130 1HB CYS 19 2HB CYS 19 1.699 -0.352 -11.458
131 2HB CYS 19 3HB CYS 19 2.812 -1.694 -11.838
132 HG CYS 19 HG CYS 19 3.173 1.529 -12.187
133 H ARG 20 H ARG 20 0.530 -1.802 -15.597
134 HA ARG 20 HA ARG 20 -1.185 -3.573 -14.010
135 1HB ARG 20 2HB ARG 20 -1.730 -2.247 -16.229
136 2HB ARG 20 3HB ARG 20 -1.108 -3.696 -17.017
137 1HG ARG 20 2HG ARG 20 -2.786 -5.077 -15.802
138 2HG ARG 20 3HG ARG 20 -3.243 -3.690 -14.818
139 1HD ARG 20 2HD ARG 20 -4.950 -3.873 -16.348
140 2HD ARG 20 3HD ARG 20 -3.977 -2.500 -16.925
141 HE ARG 20 HE ARG 20 -2.985 -4.796 -18.208
142 1HH1 ARG 20 2HH2 ARG 20 -5.962 -2.931 -18.105
143 2HH1 ARG 20 1HH2 ARG 20 -6.596 -3.500 -19.619
144 1HH2 ARG 20 2HH1 ARG 20 -3.795 -5.632 -20.224
145 2HH2 ARG 20 1HH1 ARG 20 -5.310 -5.080 -20.862
146 H ASP 21 H ASP 21 1.965 -3.919 -14.967
147 HA ASP 21 HA ASP 21 1.694 -6.715 -15.885
148 1HB ASP 21 2HB ASP 21 3.466 -4.380 -16.545
149 2HB ASP 21 3HB ASP 21 4.103 -6.016 -16.780
150 HA PRO 22 HA PRO 22 3.413 -8.531 -12.490
151 1HB PRO 22 2HB PRO 22 5.067 -10.538 -13.430
152 2HB PRO 22 3HB PRO 22 3.283 -10.562 -13.530
153 1HG PRO 22 2HG PRO 22 5.241 -9.675 -15.664
154 2HG PRO 22 3HG PRO 22 3.866 -10.805 -15.845
155 1HD PRO 22 2HD PRO 22 3.611 -8.220 -16.546
156 2HD PRO 22 3HD PRO 22 2.285 -9.018 -15.656
157 H ASP 23 H ASP 23 4.781 -7.700 -11.068
158 HA ASP 23 HA ASP 23 6.557 -7.029 -10.004
159 1HB ASP 23 2HB ASP 23 7.402 -9.253 -11.370
160 2HB ASP 23 3HB ASP 23 8.598 -8.085 -11.927
161 H THR 24 H THR 24 5.503 -5.479 -12.460
162 HA THR 24 HA THR 24 7.675 -3.701 -13.158
163 HB THR 24 HB THR 24 4.665 -3.431 -13.515
164 HG1 THR 24 1HG THR 24 5.188 -4.403 -15.542
165 1HG2 THR 24 1HG2 THR 24 6.994 -2.169 -15.028
166 2HG2 THR 24 2HG2 THR 24 5.305 -2.148 -15.570
167 3HG2 THR 24 3HG2 THR 24 5.755 -1.314 -14.084
168 H PHE 25 H PHE 25 5.689 -3.969 -10.380
169 HA PHE 25 HA PHE 25 5.010 -1.166 -10.301
170 1HB PHE 25 2HB PHE 25 3.664 -3.432 -9.849
171 2HB PHE 25 3HB PHE 25 4.125 -3.124 -8.205
172 HD1 PHE 25 1HD PHE 25 1.366 -3.343 -9.395
173 HD2 PHE 25 2HD PHE 25 3.813 0.160 -8.893
174 HE1 PHE 25 1HE PHE 25 -0.663 -1.989 -9.162
175 HE2 PHE 25 2HE PHE 25 1.770 1.544 -8.947
176 HZ PHE 25 HZ PHE 25 -0.483 0.436 -8.900
177 H GLU 26 H GLU 26 6.733 0.107 -9.500
178 HA GLU 26 HA GLU 26 8.390 -0.804 -7.295
179 1HB GLU 26 2HB GLU 26 8.484 1.370 -9.302
180 2HB GLU 26 3HB GLU 26 8.796 1.975 -7.686
181 1HG GLU 26 2HG GLU 26 10.474 -0.143 -7.604
182 2HG GLU 26 3HG GLU 26 10.447 0.144 -9.346
183 HA PRO 27 HA PRO 27 6.027 0.880 -4.066
184 1HB PRO 27 2HB PRO 27 7.867 1.676 -2.151
185 2HB PRO 27 3HB PRO 27 7.486 -0.019 -2.532
186 1HG PRO 27 2HG PRO 27 9.860 1.573 -3.476
187 2HG PRO 27 3HG PRO 27 9.770 -0.147 -3.006
188 1HD PRO 27 2HD PRO 27 9.771 0.717 -5.609
189 2HD PRO 27 3HD PRO 27 9.006 -0.805 -5.067
190 H GLN 28 H GLN 28 8.859 3.147 -4.341
191 HA GLN 28 HA GLN 28 7.403 5.443 -3.526
192 1HB GLN 28 2HB GLN 28 9.962 5.103 -5.125
193 2HB GLN 28 3HB GLN 28 9.293 6.692 -4.707
194 1HG GLN 28 2HG GLN 28 9.338 6.164 -2.326
195 2HG GLN 28 3HG GLN 28 9.922 4.526 -2.654
196 1HE2 GLN 28 1HE2 GLN 28 10.806 8.001 -3.220
197 2HE2 GLN 28 2HE2 GLN 28 12.529 7.708 -3.073
198 H LYS 29 H LYS 29 7.933 4.022 -6.737
199 HA LYS 29 HA LYS 29 6.611 5.979 -8.295
200 1HB LYS 29 2HB LYS 29 7.867 4.147 -9.311
201 2HB LYS 29 3HB LYS 29 6.792 2.957 -8.574
202 1HG LYS 29 2HG LYS 29 6.290 3.166 -10.899
203 2HG LYS 29 3HG LYS 29 4.916 3.657 -9.952
204 1HD LYS 29 2HD LYS 29 6.618 6.012 -10.595
205 2HD LYS 29 3HD LYS 29 6.328 5.030 -12.021
206 1HE LYS 29 2HE LYS 29 4.467 6.316 -12.229
207 2HE LYS 29 3HE LYS 29 3.809 5.034 -11.219
208 1HZ LYS 29 1HZ LYS 29 4.195 6.426 -9.293
209 2HZ LYS 29 2HZ LYS 29 4.591 7.682 -10.296
210 3HZ LYS 29 3HZ LYS 29 3.092 6.971 -10.370
211 H PHE 30 H PHE 30 5.259 2.922 -6.917
212 HA PHE 30 HA PHE 30 2.628 3.331 -7.667
213 1HB PHE 30 2HB PHE 30 3.559 1.213 -6.814
214 2HB PHE 30 3HB PHE 30 3.728 1.900 -5.208
215 HD1 PHE 30 1HD PHE 30 2.607 -0.393 -4.824
216 HD2 PHE 30 2HD PHE 30 0.569 2.817 -6.851
217 HE1 PHE 30 1HE PHE 30 0.427 -1.466 -4.365
218 HE2 PHE 30 2HE PHE 30 -1.592 1.777 -6.336
219 HZ PHE 30 HZ PHE 30 -1.663 -0.380 -5.135
220 H PHE 31 H PHE 31 4.113 4.039 -4.551
221 HA PHE 31 HA PHE 31 2.285 5.101 -2.919
222 1HB PHE 31 2HB PHE 31 4.534 4.896 -2.239
223 2HB PHE 31 3HB PHE 31 5.125 5.793 -3.625
224 HD1 PHE 31 1HD PHE 31 6.275 7.717 -2.971
225 HD2 PHE 31 2HD PHE 31 2.581 6.617 -1.025
226 HE1 PHE 31 1HE PHE 31 6.323 9.820 -1.669
227 HE2 PHE 31 2HE PHE 31 2.503 8.850 0.014
228 HZ PHE 31 HZ PHE 31 4.482 10.293 -0.031
229 H GLN 32 H GLN 32 4.098 7.276 -5.184
230 HA GLN 32 HA GLN 32 2.340 9.503 -4.715
231 1HB GLN 32 2HB GLN 32 4.476 8.820 -6.748
232 2HB GLN 32 3HB GLN 32 3.375 10.170 -7.078
233 1HG GLN 32 2HG GLN 32 3.956 11.281 -5.020
234 2HG GLN 32 3HG GLN 32 4.942 9.906 -4.490
235 1HE2 GLN 32 1HE2 GLN 32 4.653 12.057 -7.415
236 2HE2 GLN 32 2HE2 GLN 32 6.390 12.266 -7.577
237 H THR 33 H THR 33 2.451 6.957 -7.207
238 HA THR 33 HA THR 33 0.429 8.058 -8.843
239 HB THR 33 HB THR 33 2.082 5.628 -8.698
240 HG1 THR 33 1HG THR 33 0.517 6.691 -10.733
241 1HG2 THR 33 1HG2 THR 33 0.797 4.100 -9.899
242 2HG2 THR 33 2HG2 THR 33 0.013 4.399 -8.345
243 3HG2 THR 33 3HG2 THR 33 -0.651 5.145 -9.825
244 H SER 34 H SER 34 0.247 6.135 -5.945
245 HA SER 34 HA SER 34 -2.561 5.440 -6.269
246 1HB SER 34 2HB SER 34 -0.922 3.945 -5.153
247 2HB SER 34 3HB SER 34 -0.689 5.150 -3.889
248 HG SER 34 HG SER 34 -3.121 4.978 -3.717
249 H GLY 35 H GLY 35 -0.864 8.254 -5.434
250 1HA GLY 35 1HA GLY 35 -1.809 10.310 -4.908
251 2HA GLY 35 2HA GLY 35 -3.355 9.531 -4.529
252 H LEU 36 H LEU 36 -0.905 7.822 -2.986
253 HA LEU 36 HA LEU 36 -2.003 8.502 -0.450
254 1HB LEU 36 2HB LEU 36 0.391 6.857 -1.298
255 2HB LEU 36 3HB LEU 36 -0.279 6.892 0.331
256 HG LEU 36 HG LEU 36 -1.825 5.953 -2.083
257 1HD1 LEU 36 1HD1 LEU 36 -0.484 4.377 0.159
258 2HD1 LEU 36 2HD1 LEU 36 -1.455 3.698 -1.167
259 3HD1 LEU 36 3HD1 LEU 36 0.098 4.474 -1.517
260 1HD2 LEU 36 1HD2 LEU 36 -3.375 6.731 -0.405
261 2HD2 LEU 36 2HD2 LEU 36 -3.334 4.972 -0.326
262 3HD2 LEU 36 3HD2 LEU 36 -2.462 5.926 0.892
263 H SER 37 H SER 37 0.620 9.835 -2.280
264 HA SER 37 HA SER 37 2.011 11.158 -0.052
265 1HB SER 37 2HB SER 37 2.999 10.630 -2.390
266 2HB SER 37 3HB SER 37 1.960 11.910 -3.003
267 HG SER 37 HG SER 37 4.154 12.189 -1.181
268 H LYS 38 H LYS 38 -0.913 11.682 -1.911
269 HA LYS 38 HA LYS 38 -1.030 14.572 -1.325
270 1HB LYS 38 2HB LYS 38 -2.013 12.892 -3.442
271 2HB LYS 38 3HB LYS 38 -3.422 13.454 -2.540
272 1HG LYS 38 2HG LYS 38 -2.568 15.806 -2.756
273 2HG LYS 38 3HG LYS 38 -1.207 15.181 -3.718
274 1HD LYS 38 2HD LYS 38 -2.905 14.156 -5.303
275 2HD LYS 38 3HD LYS 38 -4.182 14.975 -4.381
276 1HE LYS 38 2HE LYS 38 -3.096 17.186 -4.893
277 2HE LYS 38 3HE LYS 38 -1.852 16.339 -5.831
278 1HZ LYS 38 1HZ LYS 38 -3.601 15.549 -7.296
279 2HZ LYS 38 2HZ LYS 38 -4.734 16.386 -6.447
280 3HZ LYS 38 3HZ LYS 38 -3.550 17.192 -7.254
281 H MET 39 H MET 39 -2.487 11.380 -0.500
282 HA MET 39 HA MET 39 -4.543 12.350 1.168
283 1HB MET 39 2HB MET 39 -2.804 9.877 1.162
284 2HB MET 39 3HB MET 39 -4.013 10.105 2.397
285 1HG MET 39 2HG MET 39 -4.507 8.739 0.212
286 2HG MET 39 3HG MET 39 -5.763 9.639 1.039
287 1HE MET 39 1HE MET 39 -6.573 11.764 0.536
288 2HE MET 39 2HE MET 39 -6.016 12.802 -0.802
289 3HE MET 39 3HE MET 39 -7.387 11.691 -1.021
290 H SER 40 H SER 40 -4.631 13.327 3.060
291 HA SER 40 HA SER 40 -2.261 14.332 4.357
292 1HB SER 40 2HB SER 40 -4.391 15.533 4.473
293 2HB SER 40 3HB SER 40 -5.180 14.137 5.229
294 HG SER 40 HG SER 40 -3.214 15.851 6.328
295 H ALA 41 H ALA 41 -1.473 13.757 6.460
296 HA ALA 41 HA ALA 41 -0.916 11.174 7.155
297 1HB ALA 41 1HB ALA 41 0.075 13.116 8.271
298 2HB ALA 41 2HB ALA 41 -1.481 13.497 9.048
299 3HB ALA 41 3HB ALA 41 -0.618 12.005 9.471
300 H ASN 42 H ASN 42 -3.799 13.016 8.088
301 HA ASN 42 HA ASN 42 -5.205 11.253 9.739
302 1HB ASN 42 2HB ASN 42 -6.311 12.988 7.465
303 2HB ASN 42 3HB ASN 42 -7.246 12.282 8.785
304 1HD2 ASN 42 1HD2 ASN 42 -4.974 14.889 7.872
305 2HD2 ASN 42 2HD2 ASN 42 -5.135 15.712 9.408
306 H GLN 43 H GLN 43 -5.410 11.437 6.167
307 HA GLN 43 HA GLN 43 -7.150 9.132 5.924
308 1HB GLN 43 2HB GLN 43 -5.708 10.987 4.038
309 2HB GLN 43 3HB GLN 43 -6.445 9.494 3.430
310 1HG GLN 43 2HG GLN 43 -8.607 10.071 4.062
311 2HG GLN 43 3HG GLN 43 -8.084 11.300 5.222
312 1HE2 GLN 43 1HE2 GLN 43 -10.054 11.595 3.061
313 2HE2 GLN 43 2HE2 GLN 43 -9.442 12.901 2.066
314 H VAL 44 H VAL 44 -3.573 9.692 5.599
315 HA VAL 44 HA VAL 44 -3.033 7.116 4.499
316 HB VAL 44 HB VAL 44 -1.421 9.081 6.205
317 1HG1 VAL 44 1HG1 VAL 44 -0.303 6.931 6.369
318 2HG1 VAL 44 2HG1 VAL 44 -0.477 6.688 4.615
319 3HG1 VAL 44 3HG1 VAL 44 0.574 7.982 5.242
320 1HG2 VAL 44 1HG2 VAL 44 -0.479 9.818 4.071
321 2HG2 VAL 44 2HG2 VAL 44 -1.424 8.590 3.191
322 3HG2 VAL 44 3HG2 VAL 44 -2.227 9.943 3.979
323 H LYS 45 H LYS 45 -3.158 8.304 7.885
324 HA LYS 45 HA LYS 45 -2.479 5.812 9.075
325 1HB LYS 45 2HB LYS 45 -2.476 8.193 9.997
326 2HB LYS 45 3HB LYS 45 -4.190 7.986 10.347
327 1HG LYS 45 2HG LYS 45 -3.730 6.655 12.171
328 2HG LYS 45 3HG LYS 45 -2.448 5.761 11.331
329 1HD LYS 45 2HD LYS 45 -0.912 7.657 11.540
330 2HD LYS 45 3HD LYS 45 -2.156 8.614 12.368
331 1HE LYS 45 2HE LYS 45 -2.124 7.064 14.273
332 2HE LYS 45 3HE LYS 45 -1.025 5.971 13.412
333 1HZ LYS 45 1HZ LYS 45 0.174 7.343 14.952
334 2HZ LYS 45 2HZ LYS 45 0.629 7.717 13.414
335 3HZ LYS 45 3HZ LYS 45 -0.373 8.721 14.242
336 H ASP 46 H ASP 46 -5.570 7.301 8.070
337 HA ASP 46 HA ASP 46 -7.277 5.273 9.037
338 1HB ASP 46 2HB ASP 46 -7.849 7.606 8.082
339 2HB ASP 46 3HB ASP 46 -7.797 6.832 6.486
340 H VAL 47 H VAL 47 -5.770 5.591 5.750
341 HA VAL 47 HA VAL 47 -6.845 3.219 4.748
342 HB VAL 47 HB VAL 47 -5.575 3.302 2.926
343 1HG1 VAL 47 1HG1 VAL 47 -5.917 5.321 2.040
344 2HG1 VAL 47 2HG1 VAL 47 -6.720 5.658 3.586
345 3HG1 VAL 47 3HG1 VAL 47 -5.046 6.176 3.305
346 1HG2 VAL 47 1HG2 VAL 47 -3.321 3.043 3.764
347 2HG2 VAL 47 2HG2 VAL 47 -3.440 4.271 2.503
348 3HG2 VAL 47 3HG2 VAL 47 -3.287 4.773 4.187
349 H PHE 48 H PHE 48 -3.749 3.786 6.397
350 HA PHE 48 HA PHE 48 -2.640 1.233 6.645
351 1HB PHE 48 2HB PHE 48 -1.473 3.058 7.421
352 2HB PHE 48 3HB PHE 48 -2.760 3.605 8.454
353 HD1 PHE 48 1HD PHE 48 -0.031 1.116 8.122
354 HD2 PHE 48 2HD PHE 48 -3.067 2.794 10.661
355 HE1 PHE 48 1HE PHE 48 0.850 -0.175 10.063
356 HE2 PHE 48 2HE PHE 48 -2.409 1.232 12.491
357 HZ PHE 48 HZ PHE 48 -0.445 -0.258 12.167
358 H ARG 49 H ARG 49 -5.113 2.608 8.954
359 HA ARG 49 HA ARG 49 -5.460 0.051 10.238
360 1HB ARG 49 2HB ARG 49 -7.063 2.615 10.280
361 2HB ARG 49 3HB ARG 49 -7.656 1.142 11.068
362 1HG ARG 49 2HG ARG 49 -5.585 0.952 12.405
363 2HG ARG 49 3HG ARG 49 -4.951 2.391 11.600
364 1HD ARG 49 2HD ARG 49 -5.708 3.115 13.693
365 2HD ARG 49 3HD ARG 49 -6.874 3.711 12.484
366 HE ARG 49 HE ARG 49 -7.755 1.177 13.539
367 1HH1 ARG 49 2HH2 ARG 49 -7.391 4.548 14.475
368 2HH1 ARG 49 1HH2 ARG 49 -8.568 4.501 15.753
369 1HH2 ARG 49 2HH1 ARG 49 -9.267 1.037 15.216
370 2HH2 ARG 49 1HH1 ARG 49 -9.731 2.437 16.155
371 H PHE 50 H PHE 50 -7.136 1.506 7.449
372 HA PHE 50 HA PHE 50 -9.291 -0.363 7.290
373 1HB PHE 50 2HB PHE 50 -7.952 1.512 5.432
374 2HB PHE 50 3HB PHE 50 -8.587 0.097 4.642
375 HD1 PHE 50 1HD PHE 50 -10.988 -0.357 4.512
376 HD2 PHE 50 2HD PHE 50 -9.483 3.204 6.449
377 HE1 PHE 50 1HE PHE 50 -13.184 0.759 4.197
378 HE2 PHE 50 2HE PHE 50 -11.676 4.281 6.158
379 HZ PHE 50 HZ PHE 50 -13.528 3.080 5.010
380 H ILE 51 H ILE 51 -5.904 -0.533 6.051
381 HA ILE 51 HA ILE 51 -6.370 -3.210 5.038
382 HB ILE 51 HB ILE 51 -3.829 -1.643 5.356
383 1HG1 ILE 51 2HG1 ILE 51 -4.009 -2.371 2.748
384 2HG1 ILE 51 3HG1 ILE 51 -5.718 -2.433 3.085
385 1HG2 ILE 51 1HG2 ILE 51 -2.778 -3.613 4.129
386 2HG2 ILE 51 2HG2 ILE 51 -3.253 -3.954 5.786
387 3HG2 ILE 51 3HG2 ILE 51 -4.261 -4.527 4.431
388 1HD1 ILE 51 1HD1 ILE 51 -5.772 -0.100 3.568
389 2HD1 ILE 51 2HD1 ILE 51 -3.994 -0.006 3.759
390 3HD1 ILE 51 3HD1 ILE 51 -4.694 -0.285 2.165
391 H ASP 52 H ASP 52 -4.808 -1.998 8.033
392 HA ASP 52 HA ASP 52 -4.184 -4.654 8.952
393 1HB ASP 52 2HB ASP 52 -2.991 -2.545 9.650
394 2HB ASP 52 3HB ASP 52 -4.400 -2.122 10.623
395 H ASN 53 H ASN 53 -6.354 -5.424 8.365
396 HA ASN 53 HA ASN 53 -8.786 -4.879 9.636
397 1HB ASN 53 2HB ASN 53 -8.620 -6.225 7.648
398 2HB ASN 53 3HB ASN 53 -7.612 -7.434 8.461
399 1HD2 ASN 53 1HD2 ASN 53 -8.652 -9.216 9.332
400 2HD2 ASN 53 2HD2 ASN 53 -10.387 -9.297 9.563
401 H ASP 54 H ASP 54 -6.114 -7.043 10.632
402 HA ASP 54 HA ASP 54 -7.460 -8.152 12.929
403 1HB ASP 54 2HB ASP 54 -5.146 -8.948 13.438
404 2HB ASP 54 3HB ASP 54 -5.731 -9.401 11.832
405 H GLN 55 H GLN 55 -6.089 -5.046 12.278
406 HA GLN 55 HA GLN 55 -5.368 -3.339 13.533
407 1HB GLN 55 2HB GLN 55 -7.809 -4.379 14.910
408 2HB GLN 55 3HB GLN 55 -6.871 -3.148 15.767
409 1HG GLN 55 2HG GLN 55 -6.893 -1.694 13.757
410 2HG GLN 55 3HG GLN 55 -7.965 -2.848 12.945
411 1HE2 GLN 55 1HE2 GLN 55 -9.774 -3.524 14.930
412 2HE2 GLN 55 2HE2 GLN 55 -10.638 -2.100 15.471
413 H SER 56 H SER 56 -3.427 -4.786 13.603
414 HA SER 56 HA SER 56 -2.660 -5.600 16.375
415 1HB SER 56 2HB SER 56 -0.742 -6.646 15.324
416 2HB SER 56 3HB SER 56 -2.240 -7.208 14.580
417 HG SER 56 HG SER 56 -0.208 -5.573 13.565
418 H GLY 57 H GLY 57 -2.387 -3.055 14.004
419 1HA GLY 57 1HA GLY 57 -1.369 -0.985 14.225
420 2HA GLY 57 2HA GLY 57 -0.498 -1.501 15.676
421 H TYR 58 H TYR 58 -0.577 -3.618 12.865
422 HA TYR 58 HA TYR 58 2.015 -2.733 11.810
423 1HB TYR 58 2HB TYR 58 1.682 -5.455 13.120
424 2HB TYR 58 3HB TYR 58 2.924 -5.063 11.949
425 HD1 TYR 58 HD1 TYR 58 4.768 -3.542 12.455
426 HD2 TYR 58 HD2 TYR 58 1.800 -4.527 15.421
427 HE1 TYR 58 HE1 TYR 58 6.196 -2.540 14.220
428 HE2 TYR 58 HE2 TYR 58 3.216 -3.520 17.178
429 HH TYR 58 HH TYR 58 5.172 -2.382 17.636
430 H LEU 59 H LEU 59 2.088 -2.930 9.767
431 HA LEU 59 HA LEU 59 0.223 -4.648 8.203
432 1HB LEU 59 2HB LEU 59 2.300 -2.530 7.610
433 2HB LEU 59 3HB LEU 59 1.896 -3.716 6.376
434 HG LEU 59 HG LEU 59 0.697 -1.375 6.479
435 1HD1 LEU 59 1HD1 LEU 59 0.245 -3.086 4.794
436 2HD1 LEU 59 2HD1 LEU 59 -0.801 -3.957 5.938
437 3HD1 LEU 59 3HD1 LEU 59 -1.255 -2.335 5.357
438 1HD2 LEU 59 1HD2 LEU 59 -1.416 -1.308 7.616
439 2HD2 LEU 59 2HD2 LEU 59 -1.271 -2.987 8.157
440 3HD2 LEU 59 3HD2 LEU 59 -0.204 -1.750 8.826
441 H ASP 60 H ASP 60 0.823 -6.428 9.375
442 HA ASP 60 HA ASP 60 3.494 -7.604 9.206
443 1HB ASP 60 2HB ASP 60 0.873 -9.082 9.609
444 2HB ASP 60 3HB ASP 60 2.490 -9.553 10.133
445 H GLU 61 H GLU 61 3.747 -9.736 7.824
446 HA GLU 61 HA GLU 61 3.665 -8.999 5.226
447 1HB GLU 61 2HB GLU 61 4.823 -11.090 6.610
448 2HB GLU 61 3HB GLU 61 3.546 -11.954 5.748
449 1HG GLU 61 2HG GLU 61 4.487 -10.405 3.754
450 2HG GLU 61 3HG GLU 61 5.967 -10.509 4.706
451 H GLU 62 H GLU 62 1.259 -11.070 6.852
452 HA GLU 62 HA GLU 62 0.032 -11.936 4.499
453 1HB GLU 62 2HB GLU 62 -2.023 -11.970 6.404
454 2HB GLU 62 3HB GLU 62 -0.961 -13.286 5.882
455 1HG GLU 62 2HG GLU 62 0.648 -12.731 7.617
456 2HG GLU 62 3HG GLU 62 -0.402 -11.380 8.156
457 H GLU 63 H GLU 63 -0.818 -9.067 6.528
458 HA GLU 63 HA GLU 63 -2.940 -8.136 5.038
459 1HB GLU 63 2HB GLU 63 -0.657 -6.467 6.176
460 2HB GLU 63 3HB GLU 63 -2.208 -5.862 5.575
461 1HG GLU 63 2HG GLU 63 -2.636 -5.988 7.833
462 2HG GLU 63 3HG GLU 63 -3.289 -7.542 7.295
463 H LEU 64 H LEU 64 0.471 -8.075 4.029
464 HA LEU 64 HA LEU 64 -0.050 -6.319 1.759
465 1HB LEU 64 2HB LEU 64 2.235 -8.259 2.069
466 2HB LEU 64 3HB LEU 64 2.142 -6.819 1.041
467 HG LEU 64 HG LEU 64 2.228 -6.888 4.093
468 1HD1 LEU 64 1HD1 LEU 64 4.198 -5.617 2.186
469 2HD1 LEU 64 2HD1 LEU 64 4.358 -6.006 3.916
470 3HD1 LEU 64 3HD1 LEU 64 4.338 -7.314 2.715
471 1HD2 LEU 64 1HD2 LEU 64 2.408 -4.391 3.914
472 2HD2 LEU 64 2HD2 LEU 64 1.981 -4.504 2.194
473 3HD2 LEU 64 3HD2 LEU 64 0.813 -4.991 3.443
474 H LYS 65 H LYS 65 -0.358 -9.743 2.464
475 HA LYS 65 HA LYS 65 -0.782 -10.556 -0.283
476 1HB LYS 65 2HB LYS 65 -0.080 -11.998 1.783
477 2HB LYS 65 3HB LYS 65 -1.822 -12.007 2.137
478 1HG LYS 65 2HG LYS 65 -2.272 -13.019 -0.078
479 2HG LYS 65 3HG LYS 65 -0.547 -12.953 -0.456
480 1HD LYS 65 2HD LYS 65 -1.245 -15.194 0.259
481 2HD LYS 65 3HD LYS 65 -0.029 -14.510 1.353
482 1HE LYS 65 2HE LYS 65 -1.695 -14.011 3.051
483 2HE LYS 65 3HE LYS 65 -3.030 -14.350 1.931
484 1HZ LYS 65 1HZ LYS 65 -2.378 -16.649 1.962
485 2HZ LYS 65 2HZ LYS 65 -1.099 -16.325 2.954
486 3HZ LYS 65 3HZ LYS 65 -2.634 -16.115 3.498
487 H PHE 66 H PHE 66 -2.621 -8.537 1.821
488 HA PHE 66 HA PHE 66 -4.632 -8.681 -0.268
489 1HB PHE 66 2HB PHE 66 -6.545 -8.642 1.416
490 2HB PHE 66 3HB PHE 66 -5.712 -10.153 1.161
491 HD1 PHE 66 1HD PHE 66 -4.769 -11.366 2.956
492 HD2 PHE 66 2HD PHE 66 -5.709 -7.215 3.592
493 HE1 PHE 66 1HE PHE 66 -4.500 -11.660 5.400
494 HE2 PHE 66 2HE PHE 66 -5.466 -7.536 6.024
495 HZ PHE 66 HZ PHE 66 -4.883 -9.756 6.934
496 H PHE 67 H PHE 67 -2.813 -6.628 -0.114
497 HA PHE 67 HA PHE 67 -3.659 -4.541 1.717
498 1HB PHE 67 2HB PHE 67 -1.398 -4.668 1.298
499 2HB PHE 67 3HB PHE 67 -1.567 -4.813 -0.434
500 HD1 PHE 67 1HD PHE 67 -1.841 -2.409 2.427
501 HD2 PHE 67 2HD PHE 67 -1.075 -2.968 -1.761
502 HE1 PHE 67 1HE PHE 67 -1.394 0.011 2.204
503 HE2 PHE 67 2HE PHE 67 -0.416 -0.580 -1.946
504 HZ PHE 67 HZ PHE 67 -0.641 0.931 0.010
505 H LEU 68 H LEU 68 -3.522 -4.511 -1.861
506 HA LEU 68 HA LEU 68 -5.626 -2.474 -2.059
507 1HB LEU 68 2HB LEU 68 -3.711 -3.795 -3.901
508 2HB LEU 68 3HB LEU 68 -5.330 -3.596 -4.576
509 HG LEU 68 HG LEU 68 -5.293 -1.211 -4.056
510 1HD1 LEU 68 1HD1 LEU 68 -2.373 -1.719 -3.357
511 2HD1 LEU 68 2HD1 LEU 68 -3.168 -0.126 -3.416
512 3HD1 LEU 68 3HD1 LEU 68 -3.622 -1.293 -2.172
513 1HD2 LEU 68 1HD2 LEU 68 -2.999 -2.208 -5.776
514 2HD2 LEU 68 2HD2 LEU 68 -4.698 -2.089 -6.265
515 3HD2 LEU 68 3HD2 LEU 68 -3.798 -0.616 -5.892
516 H GLN 69 H GLN 69 -5.682 -5.853 -1.575
517 HA GLN 69 HA GLN 69 -7.843 -6.577 -3.168
518 1HB GLN 69 2HB GLN 69 -6.388 -7.834 -1.123
519 2HB GLN 69 3HB GLN 69 -8.008 -7.809 -0.489
520 1HG GLN 69 2HG GLN 69 -8.416 -9.646 -1.669
521 2HG GLN 69 3HG GLN 69 -8.380 -8.682 -3.145
522 1HE2 GLN 69 1HE2 GLN 69 -6.895 -9.420 -4.710
523 2HE2 GLN 69 2HE2 GLN 69 -5.516 -10.402 -4.294
524 H LYS 70 H LYS 70 -7.749 -4.608 -0.326
525 HA LYS 70 HA LYS 70 -10.674 -4.650 0.112
526 1HB LYS 70 2HB LYS 70 -8.928 -2.812 1.660
527 2HB LYS 70 3HB LYS 70 -10.271 -3.833 2.181
528 1HG LYS 70 2HG LYS 70 -8.641 -5.842 1.923
529 2HG LYS 70 3HG LYS 70 -7.382 -4.625 1.640
530 1HD LYS 70 2HD LYS 70 -7.063 -4.838 3.834
531 2HD LYS 70 3HD LYS 70 -8.260 -3.531 3.841
532 1HE LYS 70 2HE LYS 70 -9.174 -4.885 5.460
533 2HE LYS 70 3HE LYS 70 -9.994 -5.557 4.045
534 1HZ LYS 70 1HZ LYS 70 -8.192 -7.244 3.995
535 2HZ LYS 70 2HZ LYS 70 -7.567 -6.594 5.369
536 3HZ LYS 70 3HZ LYS 70 -9.056 -7.290 5.396
537 H PHE 71 H PHE 71 -8.330 -2.898 -1.718
538 HA PHE 71 HA PHE 71 -9.852 -0.354 -1.768
539 1HB PHE 71 2HB PHE 71 -7.398 -1.290 -3.311
540 2HB PHE 71 3HB PHE 71 -8.191 0.262 -3.494
541 HD1 PHE 71 1HD PHE 71 -5.667 0.855 -3.254
542 HD2 PHE 71 2HD PHE 71 -8.204 -0.396 0.016
543 HE1 PHE 71 1HE PHE 71 -4.134 1.927 -1.653
544 HE2 PHE 71 2HE PHE 71 -6.752 0.816 1.577
545 HZ PHE 71 HZ PHE 71 -4.676 1.934 0.772
546 H GLU 72 H GLU 72 -8.635 -2.735 -4.166
547 HA GLU 72 HA GLU 72 -10.900 -1.993 -5.972
548 1HB GLU 72 2HB GLU 72 -8.563 -1.716 -6.785
549 2HB GLU 72 3HB GLU 72 -8.280 -3.447 -6.548
550 1HG GLU 72 2HG GLU 72 -8.752 -3.019 -8.886
551 2HG GLU 72 3HG GLU 72 -10.114 -3.923 -8.213
552 H SER 73 H SER 73 -9.082 -4.781 -4.699
553 HA SER 73 HA SER 73 -9.708 -6.862 -4.170
554 1HB SER 73 2HB SER 73 -12.211 -5.783 -3.967
555 2HB SER 73 3HB SER 73 -12.445 -6.994 -5.241
556 HG SER 73 HG SER 73 -11.276 -7.277 -2.651
557 H GLY 74 H GLY 74 -8.558 -8.112 -5.289
558 1HA GLY 74 1HA GLY 74 -8.064 -9.662 -7.005
559 2HA GLY 74 2HA GLY 74 -9.198 -8.861 -8.100
560 H ALA 75 H ALA 75 -6.769 -7.203 -6.112
561 HA ALA 75 HA ALA 75 -5.287 -6.237 -8.487
562 1HB ALA 75 1HB ALA 75 -4.200 -4.774 -6.793
563 2HB ALA 75 2HB ALA 75 -5.962 -4.638 -6.761
564 3HB ALA 75 3HB ALA 75 -5.142 -5.609 -5.526
565 H ARG 76 H ARG 76 -2.763 -6.137 -6.788
566 HA ARG 76 HA ARG 76 -1.909 -8.615 -8.095
567 1HB ARG 76 2HB ARG 76 -0.889 -6.134 -8.302
568 2HB ARG 76 3HB ARG 76 -0.038 -6.634 -6.839
569 1HG ARG 76 2HG ARG 76 1.453 -7.626 -8.236
570 2HG ARG 76 3HG ARG 76 0.269 -8.885 -8.407
571 1HD ARG 76 2HD ARG 76 0.461 -8.459 -10.614
572 2HD ARG 76 3HD ARG 76 -0.809 -7.309 -10.282
573 HE ARG 76 HE ARG 76 2.101 -6.524 -10.128
574 1HH1 ARG 76 2HH2 ARG 76 -1.097 -5.243 -10.658
575 2HH1 ARG 76 1HH2 ARG 76 -0.451 -3.895 -11.599
576 1HH2 ARG 76 2HH1 ARG 76 2.739 -5.107 -11.950
577 2HH2 ARG 76 1HH1 ARG 76 1.677 -3.704 -12.015
578 H GLU 77 H GLU 77 -2.714 -7.794 -5.011
579 HA GLU 77 HA GLU 77 -0.984 -8.240 -3.192
580 1HB GLU 77 2HB GLU 77 -3.472 -9.866 -2.779
581 2HB GLU 77 3HB GLU 77 -2.582 -8.774 -1.705
582 1HG GLU 77 2HG GLU 77 -4.437 -8.000 -3.985
583 2HG GLU 77 3HG GLU 77 -4.580 -7.627 -2.274
584 H LEU 78 H LEU 78 -2.252 -10.899 -4.998
585 HA LEU 78 HA LEU 78 -1.111 -13.111 -3.672
586 1HB LEU 78 2HB LEU 78 -1.480 -13.058 -6.676
587 2HB LEU 78 3HB LEU 78 -1.636 -14.391 -5.545
588 HG LEU 78 HG LEU 78 -3.783 -13.938 -6.232
589 1HD1 LEU 78 1HD1 LEU 78 -3.629 -14.176 -3.770
590 2HD1 LEU 78 2HD1 LEU 78 -3.639 -12.412 -3.595
591 3HD1 LEU 78 3HD1 LEU 78 -5.042 -13.234 -4.286
592 1HD2 LEU 78 1HD2 LEU 78 -4.742 -12.010 -6.875
593 2HD2 LEU 78 2HD2 LEU 78 -4.039 -11.045 -5.584
594 3HD2 LEU 78 3HD2 LEU 78 -3.065 -11.446 -7.009
595 H THR 79 H THR 79 0.273 -11.046 -6.292
596 HA THR 79 HA THR 79 2.588 -12.644 -6.773
597 HB THR 79 HB THR 79 2.213 -9.658 -7.198
598 HG1 THR 79 1HG THR 79 2.075 -10.671 -9.381
599 1HG2 THR 79 1HG2 THR 79 4.624 -10.489 -7.330
600 2HG2 THR 79 2HG2 THR 79 4.105 -11.650 -8.551
601 3HG2 THR 79 3HG2 THR 79 4.001 -9.905 -8.870
602 H GLU 80 H GLU 80 3.944 -13.084 -5.266
603 HA GLU 80 HA GLU 80 4.223 -11.534 -2.884
604 1HB GLU 80 2HB GLU 80 6.189 -13.680 -3.684
605 2HB GLU 80 3HB GLU 80 5.708 -13.058 -2.085
606 1HG GLU 80 2HG GLU 80 4.521 -15.028 -2.136
607 2HG GLU 80 3HG GLU 80 3.300 -13.919 -2.759
608 H SER 81 H SER 81 6.327 -11.768 -5.830
609 HA SER 81 HA SER 81 8.494 -10.269 -4.965
610 1HB SER 81 2HB SER 81 7.156 -9.868 -7.685
611 2HB SER 81 3HB SER 81 8.831 -9.571 -7.226
612 HG SER 81 HG SER 81 8.671 -11.469 -8.295
613 H GLU 82 H GLU 82 5.437 -9.038 -6.318
614 HA GLU 82 HA GLU 82 6.132 -6.267 -6.193
615 1HB GLU 82 2HB GLU 82 4.569 -7.176 -7.769
616 2HB GLU 82 3HB GLU 82 3.481 -7.757 -6.490
617 1HG GLU 82 2HG GLU 82 2.779 -5.627 -5.884
618 2HG GLU 82 3HG GLU 82 4.180 -4.818 -6.627
619 H THR 83 H THR 83 4.076 -8.417 -4.189
620 HA THR 83 HA THR 83 3.240 -6.524 -2.368
621 HB THR 83 HB THR 83 3.260 -9.420 -2.574
622 HG1 THR 83 1HG THR 83 1.611 -8.150 -0.816
623 1HG2 THR 83 1HG2 THR 83 2.969 -10.003 -0.199
624 2HG2 THR 83 2HG2 THR 83 4.646 -9.682 -0.642
625 3HG2 THR 83 3HG2 THR 83 3.723 -8.465 0.265
626 H LYS 84 H LYS 84 6.145 -8.538 -2.429
627 HA LYS 84 HA LYS 84 7.343 -7.633 -0.020
628 1HB LYS 84 2HB LYS 84 7.755 -9.802 -1.011
629 2HB LYS 84 3HB LYS 84 8.516 -9.065 -2.432
630 1HG LYS 84 2HG LYS 84 10.466 -8.716 -1.382
631 2HG LYS 84 3HG LYS 84 9.696 -8.144 0.112
632 1HD LYS 84 2HD LYS 84 9.171 -10.401 0.816
633 2HD LYS 84 3HD LYS 84 9.851 -11.079 -0.681
634 1HE LYS 84 2HE LYS 84 12.090 -10.314 -0.095
635 2HE LYS 84 3HE LYS 84 11.475 -9.377 1.278
636 1HZ LYS 84 1HZ LYS 84 12.440 -11.452 1.974
637 2HZ LYS 84 2HZ LYS 84 10.838 -11.407 2.345
638 3HZ LYS 84 3HZ LYS 84 11.362 -12.312 1.075
639 H SER 85 H SER 85 7.601 -6.516 -3.425
640 HA SER 85 HA SER 85 9.719 -4.682 -3.059
641 1HB SER 85 2HB SER 85 8.598 -5.345 -5.262
642 2HB SER 85 3HB SER 85 7.293 -4.218 -4.851
643 HG SER 85 HG SER 85 10.035 -3.653 -5.273
644 H LEU 86 H LEU 86 6.167 -4.296 -2.616
645 HA LEU 86 HA LEU 86 6.274 -1.643 -1.591
646 1HB LEU 86 2HB LEU 86 4.243 -3.154 -2.294
647 2HB LEU 86 3HB LEU 86 4.247 -3.670 -0.614
648 HG LEU 86 HG LEU 86 2.632 -1.929 -1.000
649 1HD1 LEU 86 1HD1 LEU 86 3.154 -0.363 0.741
650 2HD1 LEU 86 2HD1 LEU 86 3.840 -1.933 1.205
651 3HD1 LEU 86 3HD1 LEU 86 4.890 -0.644 0.566
652 1HD2 LEU 86 1HD2 LEU 86 3.079 0.263 -1.807
653 2HD2 LEU 86 2HD2 LEU 86 4.831 0.031 -1.766
654 3HD2 LEU 86 3HD2 LEU 86 3.849 -0.858 -2.946
655 H MET 87 H MET 87 6.152 -4.774 0.194
656 HA MET 87 HA MET 87 6.590 -3.868 2.726
657 1HB MET 87 2HB MET 87 6.390 -6.301 1.783
658 2HB MET 87 3HB MET 87 8.155 -6.291 1.757
659 1HG MET 87 2HG MET 87 8.210 -5.860 4.189
660 2HG MET 87 3HG MET 87 6.464 -5.659 4.185
661 1HE MET 87 1HE MET 87 5.419 -7.291 5.742
662 2HE MET 87 2HE MET 87 6.171 -8.849 6.141
663 3HE MET 87 3HE MET 87 7.064 -7.357 6.395
664 H ALA 88 H ALA 88 9.116 -4.400 0.297
665 HA ALA 88 HA ALA 88 11.373 -4.234 1.920
666 1HB ALA 88 1HB ALA 88 12.593 -3.890 -0.216
667 2HB ALA 88 2HB ALA 88 11.375 -5.171 -0.355
668 3HB ALA 88 3HB ALA 88 11.056 -3.577 -1.046
669 H ALA 89 H ALA 89 9.743 -1.633 0.061
670 HA ALA 89 HA ALA 89 11.670 0.376 1.077
671 1HB ALA 89 1HB ALA 89 9.207 0.605 -0.652
672 2HB ALA 89 2HB ALA 89 10.294 1.955 -0.245
673 3HB ALA 89 3HB ALA 89 10.913 0.587 -1.193
674 H ALA 90 H ALA 90 8.309 -0.679 1.739
675 HA ALA 90 HA ALA 90 7.625 1.544 3.468
676 1HB ALA 90 1HB ALA 90 6.683 -1.351 3.429
677 2HB ALA 90 2HB ALA 90 5.891 -0.010 4.284
678 3HB ALA 90 3HB ALA 90 5.966 -0.008 2.500
679 H ASP 91 H ASP 91 9.288 -1.595 4.043
680 HA ASP 91 HA ASP 91 9.341 -1.229 6.867
681 1HB ASP 91 2HB ASP 91 9.729 -3.457 5.958
682 2HB ASP 91 3HB ASP 91 11.139 -2.878 5.048
683 H ASN 92 H ASN 92 10.481 0.281 7.946
684 HA ASN 92 HA ASN 92 12.826 1.610 6.605
685 1HB ASN 92 2HB ASN 92 10.755 2.534 8.604
686 2HB ASN 92 3HB ASN 92 12.347 3.298 8.541
687 1HD2 ASN 92 1HD2 ASN 92 11.248 5.275 7.959
688 2HD2 ASN 92 2HD2 ASN 92 10.812 5.522 6.278
689 H ASP 93 H ASP 93 12.474 -1.041 8.442
690 HA ASP 93 HA ASP 93 14.753 -0.316 10.253
691 1HB ASP 93 2HB ASP 93 12.982 -2.782 10.233
692 2HB ASP 93 3HB ASP 93 14.333 -2.487 11.322
693 H GLY 94 H GLY 94 13.659 -2.926 7.989
694 1HA GLY 94 1HA GLY 94 15.123 -4.273 6.647
695 2HA GLY 94 2HA GLY 94 16.485 -3.884 7.710
696 H ASP 95 H ASP 95 13.101 -4.822 8.234
697 HA ASP 95 HA ASP 95 13.858 -7.270 9.732
698 1HB ASP 95 2HB ASP 95 12.196 -6.877 11.436
699 2HB ASP 95 3HB ASP 95 13.422 -5.611 11.453
700 H GLY 96 H GLY 96 11.205 -5.397 8.331
701 1HA GLY 96 1HA GLY 96 10.191 -6.475 6.239
702 2HA GLY 96 2HA GLY 96 9.862 -7.868 7.291
703 H LYS 97 H LYS 97 8.928 -7.122 9.521
704 HA LYS 97 HA LYS 97 6.317 -6.283 9.182
705 1HB LYS 97 2HB LYS 97 6.258 -5.979 11.645
706 2HB LYS 97 3HB LYS 97 7.032 -7.487 11.140
707 1HG LYS 97 2HG LYS 97 9.274 -6.430 11.460
708 2HG LYS 97 3HG LYS 97 8.482 -4.950 12.016
709 1HD LYS 97 2HD LYS 97 7.477 -6.219 13.898
710 2HD LYS 97 3HD LYS 97 8.323 -7.685 13.339
711 1HE LYS 97 2HE LYS 97 10.520 -6.498 13.568
712 2HE LYS 97 3HE LYS 97 9.681 -5.040 14.111
713 1HZ LYS 97 1HZ LYS 97 9.738 -7.619 15.524
714 2HZ LYS 97 2HZ LYS 97 10.562 -6.254 15.926
715 3HZ LYS 97 3HZ LYS 97 8.920 -6.274 16.025
716 H ILE 98 H ILE 98 5.197 -4.380 9.114
717 HA ILE 98 HA ILE 98 6.764 -1.824 9.111
718 HB ILE 98 HB ILE 98 4.581 -2.955 7.398
719 1HG1 ILE 98 2HG1 ILE 98 6.888 -1.447 6.280
720 2HG1 ILE 98 3HG1 ILE 98 7.362 -2.876 7.179
721 1HG2 ILE 98 1HG2 ILE 98 3.823 -0.648 7.880
722 2HG2 ILE 98 2HG2 ILE 98 5.422 -0.028 7.424
723 3HG2 ILE 98 3HG2 ILE 98 4.394 -0.818 6.221
724 1HD1 ILE 98 1HD1 ILE 98 7.052 -3.461 4.891
725 2HD1 ILE 98 2HD1 ILE 98 5.804 -4.262 5.872
726 3HD1 ILE 98 3HD1 ILE 98 5.377 -2.842 4.883
727 H GLY 99 H GLY 99 6.410 -0.844 11.018
728 1HA GLY 99 1HA GLY 99 3.846 -0.863 12.402
729 2HA GLY 99 2HA GLY 99 5.194 0.253 12.676
730 H ALA 100 H ALA 100 2.615 1.250 12.807
731 HA ALA 100 HA ALA 100 1.681 2.369 10.331
732 1HB ALA 100 1HB ALA 100 1.304 3.741 13.003
733 2HB ALA 100 2HB ALA 100 0.222 3.667 11.585
734 3HB ALA 100 3HB ALA 100 0.436 2.249 12.626
735 H GLU 101 H GLU 101 4.016 3.428 12.790
736 HA GLU 101 HA GLU 101 4.645 5.956 11.771
737 1HB GLU 101 2HB GLU 101 6.288 3.837 13.216
738 2HB GLU 101 3HB GLU 101 6.943 5.430 12.809
739 1HG GLU 101 2HG GLU 101 5.299 6.575 14.119
740 2HG GLU 101 3HG GLU 101 4.332 5.108 14.358
741 H GLU 102 H GLU 102 6.171 2.782 10.954
742 HA GLU 102 HA GLU 102 7.899 3.706 8.947
743 1HB GLU 102 2HB GLU 102 6.456 1.024 9.078
744 2HB GLU 102 3HB GLU 102 7.927 1.404 8.174
745 1HG GLU 102 2HG GLU 102 9.028 1.962 10.392
746 2HG GLU 102 3HG GLU 102 7.593 1.325 11.217
747 H PHE 103 H PHE 103 4.565 2.417 8.627
748 HA PHE 103 HA PHE 103 4.354 2.692 5.824
749 1HB PHE 103 2HB PHE 103 2.780 1.428 7.243
750 2HB PHE 103 3HB PHE 103 2.160 2.927 7.919
751 HD1 PHE 103 1HD PHE 103 2.463 0.914 4.783
752 HD2 PHE 103 2HD PHE 103 0.581 4.308 6.668
753 HE1 PHE 103 1HE PHE 103 0.865 1.080 2.900
754 HE2 PHE 103 2HE PHE 103 -1.083 4.394 4.843
755 HZ PHE 103 HZ PHE 103 -0.933 2.802 2.935
756 H GLN 104 H GLN 104 3.222 4.995 8.344
757 HA GLN 104 HA GLN 104 2.373 7.107 6.613
758 1HB GLN 104 2HB GLN 104 1.826 6.845 9.034
759 2HB GLN 104 3HB GLN 104 3.490 7.316 9.437
760 1HG GLN 104 2HG GLN 104 3.141 9.471 8.228
761 2HG GLN 104 3HG GLN 104 1.487 8.986 7.840
762 1HE2 GLN 104 1HE2 GLN 104 2.344 11.351 9.334
763 2HE2 GLN 104 2HE2 GLN 104 1.616 11.217 10.923
764 H GLU 105 H GLU 105 5.633 6.446 8.112
765 HA GLU 105 HA GLU 105 6.945 8.738 7.168
766 1HB GLU 105 2HB GLU 105 7.821 5.908 7.806
767 2HB GLU 105 3HB GLU 105 8.942 6.953 6.956
768 1HG GLU 105 2HG GLU 105 7.595 7.839 9.533
769 2HG GLU 105 3HG GLU 105 9.149 6.991 9.480
770 H MET 106 H MET 106 6.766 5.524 5.526
771 HA MET 106 HA MET 106 8.080 6.428 3.186
772 1HB MET 106 2HB MET 106 7.094 3.991 4.035
773 2HB MET 106 3HB MET 106 5.929 4.387 2.769
774 1HG MET 106 2HG MET 106 8.940 4.093 2.568
775 2HG MET 106 3HG MET 106 7.706 3.114 1.783
776 1HE MET 106 1HE MET 106 9.972 6.156 1.654
777 2HE MET 106 2HE MET 106 10.461 4.761 0.661
778 3HE MET 106 3HE MET 106 10.055 6.315 -0.107
779 H VAL 107 H VAL 107 4.617 6.206 3.990
780 HA VAL 107 HA VAL 107 3.754 7.308 1.537
781 HB VAL 107 HB VAL 107 2.308 6.806 4.144
782 1HG1 VAL 107 1HG1 VAL 107 1.334 7.701 1.430
783 2HG1 VAL 107 2HG1 VAL 107 0.261 6.896 2.580
784 3HG1 VAL 107 3HG1 VAL 107 0.998 8.461 2.987
785 1HG2 VAL 107 1HG2 VAL 107 3.187 4.781 2.915
786 2HG2 VAL 107 2HG2 VAL 107 1.425 4.866 2.896
787 3HG2 VAL 107 3HG2 VAL 107 2.346 5.337 1.458
788 H HIS 108 H HIS 108 5.038 8.935 4.302
789 HA HIS 108 HA HIS 108 3.755 11.480 3.675
790 1HB HIS 108 2HB HIS 108 4.199 10.900 5.966
791 2HB HIS 108 3HB HIS 108 5.909 10.612 5.632
792 HD1 HIS 108 1HD HIS 108 7.438 12.816 5.283
793 HD2 HIS 108 2HD HIS 108 3.476 13.375 6.577
794 HE1 HIS 108 1HE HIS 108 7.317 15.172 6.273
795 H SER 109 H SER 109 6.217 9.674 2.232
796 HA SER 109 HA SER 109 8.195 11.736 1.845
797 1HB SER 109 2HB SER 109 8.664 9.278 1.919
798 2HB SER 109 3HB SER 109 7.808 9.114 0.369
799 HG SER 109 HG SER 109 9.285 10.822 -0.352
Start of MODEL 17
1 1H MET 1 H1 MET 1 -15.011 2.837 -1.228
2 2H MET 1 H2 MET 1 -16.584 2.456 -1.422
3 3H MET 1 H3 MET 1 -16.192 3.892 -0.808
4 HA MET 1 HA MET 1 -17.099 2.296 0.739
5 1HB MET 1 2HB MET 1 -15.643 0.420 -0.341
6 2HB MET 1 3HB MET 1 -14.328 1.012 0.684
7 1HG MET 1 2HG MET 1 -15.466 -0.838 1.724
8 2HG MET 1 3HG MET 1 -15.778 0.614 2.690
9 1HE MET 1 1HE MET 1 -18.193 1.894 2.640
10 2HE MET 1 2HE MET 1 -19.534 0.753 2.838
11 3HE MET 1 3HE MET 1 -18.070 0.581 3.832
12 H SER 2 H SER 2 -13.628 3.257 0.661
13 HA SER 2 HA SER 2 -14.223 5.384 2.584
14 1HB SER 2 2HB SER 2 -12.128 3.249 3.261
15 2HB SER 2 3HB SER 2 -12.437 4.755 4.144
16 HG SER 2 HG SER 2 -14.775 3.635 3.938
17 H ILE 3 H ILE 3 -11.297 3.714 1.267
18 HA ILE 3 HA ILE 3 -10.221 6.237 0.426
19 HB ILE 3 HB ILE 3 -8.456 5.122 -0.448
20 1HG1 ILE 3 2HG1 ILE 3 -8.640 2.402 -0.195
21 2HG1 ILE 3 3HG1 ILE 3 -10.267 2.730 -0.722
22 1HG2 ILE 3 1HG2 ILE 3 -8.822 5.095 2.051
23 2HG2 ILE 3 2HG2 ILE 3 -9.295 3.394 1.934
24 3HG2 ILE 3 3HG2 ILE 3 -7.662 3.884 1.457
25 1HD1 ILE 3 1HD1 ILE 3 -8.740 2.221 -2.605
26 2HD1 ILE 3 2HD1 ILE 3 -9.295 3.894 -2.757
27 3HD1 ILE 3 3HD1 ILE 3 -7.667 3.543 -2.129
28 H THR 4 H THR 4 -12.118 3.722 -1.169
29 HA THR 4 HA THR 4 -11.649 4.719 -3.785
30 HB THR 4 HB THR 4 -13.147 3.099 -4.509
31 HG1 THR 4 1HG THR 4 -14.896 3.312 -3.306
32 1HG2 THR 4 1HG2 THR 4 -11.942 1.821 -2.026
33 2HG2 THR 4 2HG2 THR 4 -12.365 1.052 -3.556
34 3HG2 THR 4 3HG2 THR 4 -11.030 2.208 -3.507
35 H ASP 5 H ASP 5 -13.496 6.173 -1.360
36 HA ASP 5 HA ASP 5 -15.406 7.409 -3.308
37 1HB ASP 5 2HB ASP 5 -15.381 7.102 -0.295
38 2HB ASP 5 3HB ASP 5 -16.341 8.350 -1.102
39 H VAL 6 H VAL 6 -12.696 8.163 -1.129
40 HA VAL 6 HA VAL 6 -13.238 10.973 -1.132
41 HB VAL 6 HB VAL 6 -10.965 11.162 -0.076
42 1HG1 VAL 6 1HG1 VAL 6 -11.668 9.962 1.986
43 2HG1 VAL 6 2HG1 VAL 6 -13.007 10.861 1.249
44 3HG1 VAL 6 3HG1 VAL 6 -12.909 9.102 1.057
45 1HG2 VAL 6 1HG2 VAL 6 -10.884 8.167 -0.251
46 2HG2 VAL 6 2HG2 VAL 6 -9.786 9.268 -1.114
47 3HG2 VAL 6 3HG2 VAL 6 -9.774 9.201 0.650
48 H LEU 7 H LEU 7 -10.981 9.031 -3.027
49 HA LEU 7 HA LEU 7 -10.727 10.852 -5.223
50 1HB LEU 7 2HB LEU 7 -9.468 12.289 -3.702
51 2HB LEU 7 3HB LEU 7 -8.554 10.925 -3.081
52 HG LEU 7 HG LEU 7 -8.097 10.988 -5.929
53 1HD1 LEU 7 1HD1 LEU 7 -7.150 13.203 -6.245
54 2HD1 LEU 7 2HD1 LEU 7 -8.892 13.312 -5.925
55 3HD1 LEU 7 3HD1 LEU 7 -7.722 13.715 -4.644
56 1HD2 LEU 7 1HD2 LEU 7 -6.336 11.869 -3.606
57 2HD2 LEU 7 2HD2 LEU 7 -6.518 10.195 -4.175
58 3HD2 LEU 7 3HD2 LEU 7 -5.770 11.411 -5.220
59 H SER 8 H SER 8 -8.736 8.736 -3.164
60 HA SER 8 HA SER 8 -7.094 7.596 -4.799
61 1HB SER 8 2HB SER 8 -8.430 6.074 -2.591
62 2HB SER 8 3HB SER 8 -6.764 5.907 -3.183
63 HG SER 8 HG SER 8 -6.408 8.069 -2.518
64 H ALA 9 H ALA 9 -10.482 6.751 -5.029
65 HA ALA 9 HA ALA 9 -10.392 4.228 -6.342
66 1HB ALA 9 1HB ALA 9 -12.533 4.851 -6.051
67 2HB ALA 9 2HB ALA 9 -12.234 6.586 -6.355
68 3HB ALA 9 3HB ALA 9 -12.354 5.432 -7.697
69 H ASP 10 H ASP 10 -9.954 7.569 -7.661
70 HA ASP 10 HA ASP 10 -9.714 6.636 -10.394
71 1HB ASP 10 2HB ASP 10 -10.370 8.957 -9.704
72 2HB ASP 10 3HB ASP 10 -8.706 9.230 -9.149
73 H ASP 11 H ASP 11 -7.477 7.363 -7.740
74 HA ASP 11 HA ASP 11 -5.075 7.247 -9.191
75 1HB ASP 11 2HB ASP 11 -5.502 6.683 -6.227
76 2HB ASP 11 3HB ASP 11 -4.061 7.284 -7.057
77 H ILE 12 H ILE 12 -6.832 4.744 -7.224
78 HA ILE 12 HA ILE 12 -4.937 2.712 -7.735
79 HB ILE 12 HB ILE 12 -6.589 1.186 -7.076
80 1HG1 ILE 12 2HG1 ILE 12 -8.539 3.396 -6.812
81 2HG1 ILE 12 3HG1 ILE 12 -8.616 2.117 -8.029
82 1HG2 ILE 12 1HG2 ILE 12 -6.321 3.596 -5.248
83 2HG2 ILE 12 2HG2 ILE 12 -6.810 1.989 -4.714
84 3HG2 ILE 12 3HG2 ILE 12 -5.206 2.237 -5.409
85 1HD1 ILE 12 1HD1 ILE 12 -9.065 1.869 -5.055
86 2HD1 ILE 12 2HD1 ILE 12 -10.188 1.542 -6.377
87 3HD1 ILE 12 3HD1 ILE 12 -8.805 0.465 -6.128
88 H ALA 13 H ALA 13 -7.846 3.812 -9.549
89 HA ALA 13 HA ALA 13 -7.771 1.770 -11.515
90 1HB ALA 13 1HB ALA 13 -9.596 3.435 -11.309
91 2HB ALA 13 2HB ALA 13 -8.530 4.678 -11.997
92 3HB ALA 13 3HB ALA 13 -8.975 3.267 -12.964
93 H ALA 14 H ALA 14 -5.977 4.912 -11.407
94 HA ALA 14 HA ALA 14 -4.467 4.477 -13.777
95 1HB ALA 14 1HB ALA 14 -3.590 5.972 -11.270
96 2HB ALA 14 2HB ALA 14 -2.859 6.074 -12.879
97 3HB ALA 14 3HB ALA 14 -4.525 6.643 -12.621
98 H ALA 15 H ALA 15 -3.501 3.788 -10.383
99 HA ALA 15 HA ALA 15 -1.064 2.609 -10.716
100 1HB ALA 15 1HB ALA 15 -2.285 3.084 -8.527
101 2HB ALA 15 2HB ALA 15 -3.169 1.575 -8.775
102 3HB ALA 15 3HB ALA 15 -1.410 1.540 -8.602
103 H LEU 16 H LEU 16 -4.219 1.067 -10.834
104 HA LEU 16 HA LEU 16 -3.489 -1.595 -11.195
105 1HB LEU 16 2HB LEU 16 -5.696 -1.213 -10.614
106 2HB LEU 16 3HB LEU 16 -5.953 0.029 -11.827
107 HG LEU 16 HG LEU 16 -5.419 -2.688 -12.942
108 1HD1 LEU 16 1HD1 LEU 16 -6.839 -3.310 -11.054
109 2HD1 LEU 16 2HD1 LEU 16 -8.003 -2.034 -11.479
110 3HD1 LEU 16 3HD1 LEU 16 -7.746 -3.409 -12.573
111 1HD2 LEU 16 1HD2 LEU 16 -7.612 -0.618 -13.469
112 2HD2 LEU 16 2HD2 LEU 16 -6.045 -0.587 -14.276
113 3HD2 LEU 16 3HD2 LEU 16 -7.133 -1.961 -14.526
114 H GLN 17 H GLN 17 -3.822 1.058 -13.593
115 HA GLN 17 HA GLN 17 -3.551 -0.880 -15.799
116 1HB GLN 17 2HB GLN 17 -4.519 1.860 -15.546
117 2HB GLN 17 3HB GLN 17 -3.347 1.712 -16.865
118 1HG GLN 17 2HG GLN 17 -4.585 -0.121 -17.871
119 2HG GLN 17 3HG GLN 17 -5.683 -0.209 -16.488
120 1HE2 GLN 17 1HE2 GLN 17 -4.547 2.220 -18.931
121 2HE2 GLN 17 2HE2 GLN 17 -6.150 2.903 -19.153
122 H GLU 18 H GLU 18 -1.649 1.736 -14.285
123 HA GLU 18 HA GLU 18 0.477 1.540 -16.156
124 1HB GLU 18 2HB GLU 18 1.516 3.183 -14.930
125 2HB GLU 18 3HB GLU 18 -0.180 3.421 -14.506
126 1HG GLU 18 2HG GLU 18 0.243 2.123 -12.398
127 2HG GLU 18 3HG GLU 18 1.971 2.111 -12.826
128 H CYS 19 H CYS 19 -0.127 -0.144 -13.063
129 HA CYS 19 HA CYS 19 2.310 -1.829 -13.494
130 1HB CYS 19 2HB CYS 19 0.503 -1.591 -11.057
131 2HB CYS 19 3HB CYS 19 1.970 -2.578 -11.205
132 HG CYS 19 HG CYS 19 1.665 0.677 -11.465
133 H ARG 20 H ARG 20 0.336 -2.298 -15.415
134 HA ARG 20 HA ARG 20 -1.413 -4.503 -14.569
135 1HB ARG 20 2HB ARG 20 -0.729 -3.122 -17.128
136 2HB ARG 20 3HB ARG 20 -1.118 -4.840 -17.278
137 1HG ARG 20 2HG ARG 20 -3.252 -4.600 -16.219
138 2HG ARG 20 3HG ARG 20 -2.846 -2.979 -15.674
139 1HD ARG 20 2HD ARG 20 -4.306 -2.604 -17.477
140 2HD ARG 20 3HD ARG 20 -2.687 -2.206 -18.026
141 HE ARG 20 HE ARG 20 -2.719 -3.941 -19.540
142 1HH1 ARG 20 2HH2 ARG 20 -5.311 -4.435 -17.217
143 2HH1 ARG 20 1HH2 ARG 20 -6.220 -5.557 -18.181
144 1HH2 ARG 20 2HH1 ARG 20 -3.877 -5.449 -20.877
145 2HH2 ARG 20 1HH1 ARG 20 -5.348 -6.174 -20.313
146 H ASP 21 H ASP 21 1.558 -4.139 -16.475
147 HA ASP 21 HA ASP 21 2.126 -6.790 -16.868
148 1HB ASP 21 2HB ASP 21 3.816 -4.262 -16.801
149 2HB ASP 21 3HB ASP 21 4.463 -5.814 -17.317
150 HA PRO 22 HA PRO 22 3.373 -8.215 -12.897
151 1HB PRO 22 2HB PRO 22 5.081 -10.293 -13.513
152 2HB PRO 22 3HB PRO 22 3.313 -10.368 -13.762
153 1HG PRO 22 2HG PRO 22 5.432 -9.641 -15.803
154 2HG PRO 22 3HG PRO 22 4.107 -10.829 -15.986
155 1HD PRO 22 2HD PRO 22 3.886 -8.309 -16.945
156 2HD PRO 22 3HD PRO 22 2.478 -9.084 -16.157
157 H ASP 23 H ASP 23 5.089 -8.135 -11.404
158 HA ASP 23 HA ASP 23 6.791 -7.193 -10.404
159 1HB ASP 23 2HB ASP 23 7.775 -9.123 -11.738
160 2HB ASP 23 3HB ASP 23 8.406 -7.920 -12.875
161 H THR 24 H THR 24 5.338 -5.376 -12.522
162 HA THR 24 HA THR 24 7.363 -3.304 -13.003
163 HB THR 24 HB THR 24 4.354 -3.260 -13.478
164 HG1 THR 24 1HG THR 24 5.155 -4.967 -14.585
165 1HG2 THR 24 1HG2 THR 24 4.962 -1.703 -15.324
166 2HG2 THR 24 2HG2 THR 24 5.332 -1.021 -13.736
167 3HG2 THR 24 3HG2 THR 24 6.640 -1.687 -14.745
168 H PHE 25 H PHE 25 5.425 -4.234 -10.399
169 HA PHE 25 HA PHE 25 4.422 -1.679 -9.548
170 1HB PHE 25 2HB PHE 25 3.464 -3.981 -9.159
171 2HB PHE 25 3HB PHE 25 4.758 -4.252 -8.001
172 HD1 PHE 25 1HD PHE 25 1.511 -2.663 -8.612
173 HD2 PHE 25 2HD PHE 25 4.865 -2.832 -5.912
174 HE1 PHE 25 1HE PHE 25 0.079 -1.847 -6.769
175 HE2 PHE 25 2HE PHE 25 3.480 -1.788 -4.148
176 HZ PHE 25 HZ PHE 25 1.051 -1.443 -4.517
177 H GLU 26 H GLU 26 5.655 -0.109 -8.696
178 HA GLU 26 HA GLU 26 8.050 -0.776 -7.046
179 1HB GLU 26 2HB GLU 26 7.447 1.451 -8.998
180 2HB GLU 26 3HB GLU 26 8.575 1.734 -7.664
181 1HG GLU 26 2HG GLU 26 9.924 -0.218 -8.425
182 2HG GLU 26 3HG GLU 26 8.842 -0.381 -9.824
183 HA PRO 27 HA PRO 27 5.986 0.896 -3.555
184 1HB PRO 27 2HB PRO 27 8.087 1.979 -2.080
185 2HB PRO 27 3HB PRO 27 7.716 0.255 -2.224
186 1HG PRO 27 2HG PRO 27 9.781 1.808 -3.794
187 2HG PRO 27 3HG PRO 27 9.922 0.181 -3.072
188 1HD PRO 27 2HD PRO 27 9.432 0.490 -5.689
189 2HD PRO 27 3HD PRO 27 8.668 -0.819 -4.740
190 H GLN 28 H GLN 28 8.562 3.437 -3.852
191 HA GLN 28 HA GLN 28 7.065 5.503 -3.106
192 1HB GLN 28 2HB GLN 28 9.675 5.106 -3.785
193 2HB GLN 28 3HB GLN 28 9.142 5.956 -5.249
194 1HG GLN 28 2HG GLN 28 8.058 7.598 -3.648
195 2HG GLN 28 3HG GLN 28 8.964 6.834 -2.339
196 1HE2 GLN 28 1HE2 GLN 28 10.951 7.820 -1.883
197 2HE2 GLN 28 2HE2 GLN 28 11.899 8.698 -3.066
198 H LYS 29 H LYS 29 7.536 4.344 -6.410
199 HA LYS 29 HA LYS 29 6.007 6.142 -7.911
200 1HB LYS 29 2HB LYS 29 7.394 4.220 -8.793
201 2HB LYS 29 3HB LYS 29 6.188 3.107 -8.155
202 1HG LYS 29 2HG LYS 29 5.666 3.239 -10.409
203 2HG LYS 29 3HG LYS 29 4.472 4.307 -9.668
204 1HD LYS 29 2HD LYS 29 6.128 6.241 -10.212
205 2HD LYS 29 3HD LYS 29 7.031 5.032 -11.158
206 1HE LYS 29 2HE LYS 29 4.845 4.522 -12.387
207 2HE LYS 29 3HE LYS 29 4.105 5.873 -11.501
208 1HZ LYS 29 1HZ LYS 29 5.670 7.335 -12.561
209 2HZ LYS 29 2HZ LYS 29 6.342 6.073 -13.394
210 3HZ LYS 29 3HZ LYS 29 4.770 6.496 -13.657
211 H PHE 30 H PHE 30 4.851 2.984 -6.571
212 HA PHE 30 HA PHE 30 2.149 3.340 -7.073
213 1HB PHE 30 2HB PHE 30 3.112 1.199 -6.496
214 2HB PHE 30 3HB PHE 30 3.553 1.771 -4.887
215 HD1 PHE 30 1HD PHE 30 1.991 1.663 -3.086
216 HD2 PHE 30 2HD PHE 30 0.631 1.170 -7.145
217 HE1 PHE 30 1HE PHE 30 -0.298 1.189 -2.265
218 HE2 PHE 30 2HE PHE 30 -1.658 0.736 -6.309
219 HZ PHE 30 HZ PHE 30 -2.115 0.698 -3.876
220 H PHE 31 H PHE 31 3.985 4.387 -4.163
221 HA PHE 31 HA PHE 31 1.800 5.130 -2.543
222 1HB PHE 31 2HB PHE 31 4.440 6.629 -2.781
223 2HB PHE 31 3HB PHE 31 3.296 6.705 -1.447
224 HD1 PHE 31 1HD PHE 31 6.017 6.370 -0.828
225 HD2 PHE 31 2HD PHE 31 3.069 3.363 -1.778
226 HE1 PHE 31 1HE PHE 31 7.290 4.700 0.454
227 HE2 PHE 31 2HE PHE 31 4.314 1.724 -0.421
228 HZ PHE 31 HZ PHE 31 6.440 2.374 0.696
229 H GLN 32 H GLN 32 3.575 7.145 -4.972
230 HA GLN 32 HA GLN 32 1.674 9.320 -4.523
231 1HB GLN 32 2HB GLN 32 4.069 9.700 -5.149
232 2HB GLN 32 3HB GLN 32 3.705 9.089 -6.775
233 1HG GLN 32 2HG GLN 32 2.153 10.894 -7.196
234 2HG GLN 32 3HG GLN 32 2.063 11.313 -5.483
235 1HE2 GLN 32 1HE2 GLN 32 5.114 10.721 -7.274
236 2HE2 GLN 32 2HE2 GLN 32 5.688 12.368 -7.102
237 H THR 33 H THR 33 2.061 6.721 -6.971
238 HA THR 33 HA THR 33 0.154 7.700 -8.748
239 HB THR 33 HB THR 33 1.890 5.395 -8.418
240 HG1 THR 33 1HG THR 33 0.412 5.837 -10.610
241 1HG2 THR 33 1HG2 THR 33 -0.094 4.009 -7.896
242 2HG2 THR 33 2HG2 THR 33 -0.846 4.612 -9.403
243 3HG2 THR 33 3HG2 THR 33 0.651 3.658 -9.461
244 H SER 34 H SER 34 -0.225 5.758 -5.820
245 HA SER 34 HA SER 34 -3.070 5.390 -6.280
246 1HB SER 34 2HB SER 34 -1.459 4.968 -3.741
247 2HB SER 34 3HB SER 34 -3.080 4.329 -4.128
248 HG SER 34 HG SER 34 -0.580 3.710 -5.302
249 H GLY 35 H GLY 35 -1.239 8.038 -5.550
250 1HA GLY 35 1HA GLY 35 -1.810 10.149 -4.788
251 2HA GLY 35 2HA GLY 35 -3.437 9.574 -4.402
252 H LEU 36 H LEU 36 -1.283 7.418 -2.967
253 HA LEU 36 HA LEU 36 -2.219 8.236 -0.403
254 1HB LEU 36 2HB LEU 36 -0.702 5.921 -1.563
255 2HB LEU 36 3HB LEU 36 -0.263 6.359 0.066
256 HG LEU 36 HG LEU 36 -2.869 6.433 0.480
257 1HD1 LEU 36 1HD1 LEU 36 -3.517 6.022 -1.854
258 2HD1 LEU 36 2HD1 LEU 36 -2.734 4.420 -1.775
259 3HD1 LEU 36 3HD1 LEU 36 -4.136 4.786 -0.754
260 1HD2 LEU 36 1HD2 LEU 36 -2.796 4.055 1.186
261 2HD2 LEU 36 2HD2 LEU 36 -1.302 3.829 0.252
262 3HD2 LEU 36 3HD2 LEU 36 -1.324 4.923 1.654
263 H SER 37 H SER 37 0.831 8.846 -2.136
264 HA SER 37 HA SER 37 1.991 9.982 0.332
265 1HB SER 37 2HB SER 37 3.861 10.692 -0.966
266 2HB SER 37 3HB SER 37 3.499 9.031 -1.422
267 HG SER 37 HG SER 37 3.887 10.536 -3.169
268 H LYS 38 H LYS 38 -0.371 11.035 -1.853
269 HA LYS 38 HA LYS 38 0.225 13.906 -1.435
270 1HB LYS 38 2HB LYS 38 -1.172 12.373 -3.492
271 2HB LYS 38 3HB LYS 38 -2.310 13.460 -2.695
272 1HG LYS 38 2HG LYS 38 -1.330 14.670 -4.507
273 2HG LYS 38 3HG LYS 38 -0.684 15.330 -3.003
274 1HD LYS 38 2HD LYS 38 1.126 13.239 -3.710
275 2HD LYS 38 3HD LYS 38 0.652 13.928 -5.254
276 1HE LYS 38 2HE LYS 38 1.213 16.227 -3.746
277 2HE LYS 38 3HE LYS 38 2.315 15.042 -3.031
278 1HZ LYS 38 1HZ LYS 38 3.118 14.616 -5.304
279 2HZ LYS 38 2HZ LYS 38 2.143 15.812 -5.869
280 3HZ LYS 38 3HZ LYS 38 3.362 16.174 -4.823
281 H MET 39 H MET 39 -1.935 11.248 -0.496
282 HA MET 39 HA MET 39 -3.678 12.745 1.183
283 1HB MET 39 2HB MET 39 -2.647 9.902 1.322
284 2HB MET 39 3HB MET 39 -3.834 10.547 2.427
285 1HG MET 39 2HG MET 39 -4.166 10.371 -0.592
286 2HG MET 39 3HG MET 39 -4.831 9.277 0.616
287 1HE MET 39 1HE MET 39 -5.387 12.238 -1.577
288 2HE MET 39 2HE MET 39 -6.746 13.122 -0.850
289 3HE MET 39 3HE MET 39 -5.112 13.349 -0.224
290 H SER 40 H SER 40 -3.498 13.681 3.046
291 HA SER 40 HA SER 40 -0.922 14.148 4.224
292 1HB SER 40 2HB SER 40 -3.623 14.689 5.517
293 2HB SER 40 3HB SER 40 -2.118 15.617 5.681
294 HG SER 40 HG SER 40 -2.394 15.998 3.323
295 H ALA 41 H ALA 41 -0.346 13.622 6.467
296 HA ALA 41 HA ALA 41 -0.305 11.040 7.261
297 1HB ALA 41 1HB ALA 41 0.974 12.812 8.356
298 2HB ALA 41 2HB ALA 41 -0.508 13.467 9.092
299 3HB ALA 41 3HB ALA 41 0.086 11.863 9.563
300 H ASN 42 H ASN 42 -2.895 13.331 8.108
301 HA ASN 42 HA ASN 42 -4.500 11.794 9.802
302 1HB ASN 42 2HB ASN 42 -5.525 13.584 7.549
303 2HB ASN 42 3HB ASN 42 -6.381 13.138 9.028
304 1HD2 ASN 42 1HD2 ASN 42 -5.208 15.785 7.718
305 2HD2 ASN 42 2HD2 ASN 42 -4.409 16.530 9.088
306 H GLN 43 H GLN 43 -4.697 11.964 6.227
307 HA GLN 43 HA GLN 43 -6.738 9.922 6.009
308 1HB GLN 43 2HB GLN 43 -5.031 11.545 4.137
309 2HB GLN 43 3HB GLN 43 -5.697 10.026 3.529
310 1HG GLN 43 2HG GLN 43 -7.451 12.083 4.906
311 2HG GLN 43 3HG GLN 43 -7.083 12.171 3.178
312 1HE2 GLN 43 1HE2 GLN 43 -9.694 11.561 4.714
313 2HE2 GLN 43 2HE2 GLN 43 -10.245 10.095 3.927
314 H VAL 44 H VAL 44 -3.107 9.989 5.703
315 HA VAL 44 HA VAL 44 -2.963 7.324 4.760
316 HB VAL 44 HB VAL 44 -0.931 8.972 6.284
317 1HG1 VAL 44 1HG1 VAL 44 0.697 7.419 5.135
318 2HG1 VAL 44 2HG1 VAL 44 -0.263 6.607 6.389
319 3HG1 VAL 44 3HG1 VAL 44 -0.665 6.391 4.666
320 1HG2 VAL 44 1HG2 VAL 44 -0.016 9.411 4.035
321 2HG2 VAL 44 2HG2 VAL 44 -1.272 8.399 3.297
322 3HG2 VAL 44 3HG2 VAL 44 -1.701 9.927 4.072
323 H LYS 45 H LYS 45 -3.217 8.657 8.064
324 HA LYS 45 HA LYS 45 -2.871 6.179 9.440
325 1HB LYS 45 2HB LYS 45 -2.715 8.554 10.360
326 2HB LYS 45 3HB LYS 45 -4.490 8.537 10.427
327 1HG LYS 45 2HG LYS 45 -4.341 6.452 11.826
328 2HG LYS 45 3HG LYS 45 -2.584 6.580 11.790
329 1HD LYS 45 2HD LYS 45 -3.687 9.161 12.597
330 2HD LYS 45 3HD LYS 45 -4.510 7.912 13.511
331 1HE LYS 45 2HE LYS 45 -2.609 8.590 14.809
332 2HE LYS 45 3HE LYS 45 -2.262 6.969 14.195
333 1HZ LYS 45 1HZ LYS 45 -0.944 8.044 12.434
334 2HZ LYS 45 2HZ LYS 45 -1.245 9.514 13.100
335 3HZ LYS 45 3HZ LYS 45 -0.377 8.397 13.938
336 H ASP 46 H ASP 46 -5.803 7.947 8.261
337 HA ASP 46 HA ASP 46 -7.715 6.075 9.240
338 1HB ASP 46 2HB ASP 46 -7.836 7.907 6.801
339 2HB ASP 46 3HB ASP 46 -9.200 6.992 7.449
340 H VAL 47 H VAL 47 -6.249 6.299 5.957
341 HA VAL 47 HA VAL 47 -7.444 3.915 5.029
342 HB VAL 47 HB VAL 47 -6.040 3.939 3.165
343 1HG1 VAL 47 1HG1 VAL 47 -6.549 6.002 2.247
344 2HG1 VAL 47 2HG1 VAL 47 -7.641 5.993 3.655
345 3HG1 VAL 47 3HG1 VAL 47 -6.131 6.902 3.692
346 1HG2 VAL 47 1HG2 VAL 47 -3.828 4.048 3.982
347 2HG2 VAL 47 2HG2 VAL 47 -4.065 5.472 2.947
348 3HG2 VAL 47 3HG2 VAL 47 -4.156 5.628 4.712
349 H PHE 48 H PHE 48 -4.217 4.399 6.590
350 HA PHE 48 HA PHE 48 -3.254 1.803 6.790
351 1HB PHE 48 2HB PHE 48 -1.935 3.455 7.691
352 2HB PHE 48 3HB PHE 48 -3.221 4.126 8.655
353 HD1 PHE 48 1HD PHE 48 -3.940 3.180 10.785
354 HD2 PHE 48 2HD PHE 48 -0.597 1.566 8.594
355 HE1 PHE 48 1HE PHE 48 -3.491 1.589 12.638
356 HE2 PHE 48 2HE PHE 48 0.061 0.286 10.622
357 HZ PHE 48 HZ PHE 48 -1.528 0.071 12.514
358 H ARG 49 H ARG 49 -5.715 3.254 9.049
359 HA ARG 49 HA ARG 49 -6.155 0.775 10.416
360 1HB ARG 49 2HB ARG 49 -7.748 3.347 10.166
361 2HB ARG 49 3HB ARG 49 -8.518 1.891 10.805
362 1HG ARG 49 2HG ARG 49 -6.632 1.631 12.435
363 2HG ARG 49 3HG ARG 49 -6.039 3.228 11.933
364 1HD ARG 49 2HD ARG 49 -8.137 4.272 12.733
365 2HD ARG 49 3HD ARG 49 -8.888 2.693 12.904
366 HE ARG 49 HE ARG 49 -7.955 2.320 14.908
367 1HH1 ARG 49 2HH2 ARG 49 -6.236 4.962 13.372
368 2HH1 ARG 49 1HH2 ARG 49 -5.280 5.396 14.764
369 1HH2 ARG 49 2HH1 ARG 49 -6.716 2.831 16.787
370 2HH2 ARG 49 1HH1 ARG 49 -5.565 4.126 16.769
371 H PHE 50 H PHE 50 -7.566 2.044 7.405
372 HA PHE 50 HA PHE 50 -9.634 0.031 7.270
373 1HB PHE 50 2HB PHE 50 -9.463 2.277 6.014
374 2HB PHE 50 3HB PHE 50 -8.384 1.447 4.897
375 HD1 PHE 50 1HD PHE 50 -11.806 1.380 6.417
376 HD2 PHE 50 2HD PHE 50 -9.327 0.084 3.130
377 HE1 PHE 50 1HE PHE 50 -13.798 0.471 5.274
378 HE2 PHE 50 2HE PHE 50 -11.337 -0.807 1.975
379 HZ PHE 50 HZ PHE 50 -13.559 -0.685 3.084
380 H ILE 51 H ILE 51 -6.192 0.140 6.445
381 HA ILE 51 HA ILE 51 -6.286 -2.343 4.923
382 HB ILE 51 HB ILE 51 -3.818 -1.040 6.097
383 1HG1 ILE 51 2HG1 ILE 51 -4.388 0.752 4.860
384 2HG1 ILE 51 3HG1 ILE 51 -3.486 -0.163 3.698
385 1HG2 ILE 51 1HG2 ILE 51 -4.331 -2.952 3.777
386 2HG2 ILE 51 2HG2 ILE 51 -2.741 -2.243 4.152
387 3HG2 ILE 51 3HG2 ILE 51 -3.520 -3.350 5.281
388 1HD1 ILE 51 1HD1 ILE 51 -5.638 -0.987 2.683
389 2HD1 ILE 51 2HD1 ILE 51 -6.535 0.049 3.808
390 3HD1 ILE 51 3HD1 ILE 51 -5.427 0.782 2.662
391 H ASP 52 H ASP 52 -5.099 -1.427 8.220
392 HA ASP 52 HA ASP 52 -4.210 -4.097 8.845
393 1HB ASP 52 2HB ASP 52 -3.381 -1.936 9.917
394 2HB ASP 52 3HB ASP 52 -4.863 -1.907 10.862
395 H ASN 53 H ASN 53 -6.169 -5.093 8.037
396 HA ASN 53 HA ASN 53 -8.748 -4.709 8.946
397 1HB ASN 53 2HB ASN 53 -7.946 -5.941 6.913
398 2HB ASN 53 3HB ASN 53 -7.549 -7.329 7.931
399 1HD2 ASN 53 1HD2 ASN 53 -9.443 -8.369 9.123
400 2HD2 ASN 53 2HD2 ASN 53 -11.013 -8.275 8.353
401 H ASP 54 H ASP 54 -6.191 -6.653 10.394
402 HA ASP 54 HA ASP 54 -7.832 -7.986 12.416
403 1HB ASP 54 2HB ASP 54 -5.559 -8.543 13.302
404 2HB ASP 54 3HB ASP 54 -5.683 -8.962 11.586
405 H GLN 55 H GLN 55 -6.178 -4.905 12.047
406 HA GLN 55 HA GLN 55 -5.904 -3.175 13.448
407 1HB GLN 55 2HB GLN 55 -8.100 -2.755 13.350
408 2HB GLN 55 3HB GLN 55 -8.610 -4.215 14.200
409 1HG GLN 55 2HG GLN 55 -8.153 -3.399 16.267
410 2HG GLN 55 3HG GLN 55 -6.986 -2.177 15.694
411 1HE2 GLN 55 1HE2 GLN 55 -10.479 -3.011 15.394
412 2HE2 GLN 55 2HE2 GLN 55 -11.038 -1.346 15.453
413 H SER 56 H SER 56 -3.945 -4.048 14.100
414 HA SER 56 HA SER 56 -3.852 -4.919 17.006
415 1HB SER 56 2HB SER 56 -1.575 -5.879 16.289
416 2HB SER 56 3HB SER 56 -3.013 -6.763 15.742
417 HG SER 56 HG SER 56 -2.793 -6.072 13.783
418 H GLY 57 H GLY 57 -1.733 -3.816 14.576
419 1HA GLY 57 1HA GLY 57 -1.269 -1.171 14.722
420 2HA GLY 57 2HA GLY 57 -0.502 -1.669 16.241
421 H TYR 58 H TYR 58 -0.515 -3.497 13.116
422 HA TYR 58 HA TYR 58 2.149 -2.884 12.385
423 1HB TYR 58 2HB TYR 58 1.602 -5.508 13.805
424 2HB TYR 58 3HB TYR 58 2.832 -5.361 12.560
425 HD1 TYR 58 HD1 TYR 58 4.631 -3.477 12.819
426 HD2 TYR 58 HD2 TYR 58 2.306 -5.090 16.070
427 HE1 TYR 58 HE1 TYR 58 6.279 -2.591 14.427
428 HE2 TYR 58 HE2 TYR 58 3.999 -4.265 17.675
429 HH TYR 58 HH TYR 58 5.962 -3.076 17.953
430 H LEU 59 H LEU 59 2.166 -3.174 10.260
431 HA LEU 59 HA LEU 59 0.049 -4.722 8.843
432 1HB LEU 59 2HB LEU 59 2.021 -2.560 8.058
433 2HB LEU 59 3HB LEU 59 1.418 -3.685 6.841
434 HG LEU 59 HG LEU 59 0.193 -1.470 7.070
435 1HD1 LEU 59 1HD1 LEU 59 -1.430 -4.051 7.275
436 2HD1 LEU 59 2HD1 LEU 59 -2.020 -2.473 6.730
437 3HD1 LEU 59 3HD1 LEU 59 -0.767 -3.316 5.797
438 1HD2 LEU 59 1HD2 LEU 59 0.072 -1.566 9.588
439 2HD2 LEU 59 2HD2 LEU 59 -1.462 -1.193 8.765
440 3HD2 LEU 59 3HD2 LEU 59 -1.182 -2.809 9.433
441 H ASP 60 H ASP 60 0.905 -6.508 9.973
442 HA ASP 60 HA ASP 60 3.481 -7.601 9.710
443 1HB ASP 60 2HB ASP 60 0.954 -9.274 9.687
444 2HB ASP 60 3HB ASP 60 2.501 -9.565 10.507
445 H GLU 61 H GLU 61 4.493 -8.719 7.952
446 HA GLU 61 HA GLU 61 3.997 -7.761 5.482
447 1HB GLU 61 2HB GLU 61 5.239 -10.478 5.966
448 2HB GLU 61 3HB GLU 61 5.402 -9.435 4.539
449 1HG GLU 61 2HG GLU 61 7.231 -8.641 5.609
450 2HG GLU 61 3HG GLU 61 6.092 -7.644 6.492
451 H GLU 62 H GLU 62 2.784 -10.909 6.642
452 HA GLU 62 HA GLU 62 1.791 -11.848 4.187
453 1HB GLU 62 2HB GLU 62 2.175 -13.190 6.236
454 2HB GLU 62 3HB GLU 62 0.714 -12.503 6.969
455 1HG GLU 62 2HG GLU 62 -0.691 -13.585 5.359
456 2HG GLU 62 3HG GLU 62 0.665 -13.900 4.261
457 H GLU 63 H GLU 63 0.359 -9.475 6.425
458 HA GLU 63 HA GLU 63 -2.301 -9.586 5.302
459 1HB GLU 63 2HB GLU 63 -0.834 -7.346 6.737
460 2HB GLU 63 3HB GLU 63 -2.577 -7.431 6.455
461 1HG GLU 63 2HG GLU 63 -2.779 -9.453 7.812
462 2HG GLU 63 3HG GLU 63 -1.022 -9.549 8.042
463 H LEU 64 H LEU 64 0.746 -7.943 4.425
464 HA LEU 64 HA LEU 64 -0.496 -6.110 2.575
465 1HB LEU 64 2HB LEU 64 2.361 -7.116 2.664
466 2HB LEU 64 3HB LEU 64 1.765 -5.816 1.640
467 HG LEU 64 HG LEU 64 1.623 -5.756 4.696
468 1HD1 LEU 64 1HD1 LEU 64 3.495 -4.168 4.529
469 2HD1 LEU 64 2HD1 LEU 64 3.933 -5.786 3.946
470 3HD1 LEU 64 3HD1 LEU 64 3.615 -4.482 2.780
471 1HD2 LEU 64 1HD2 LEU 64 1.308 -3.276 4.264
472 2HD2 LEU 64 2HD2 LEU 64 1.095 -3.650 2.543
473 3HD2 LEU 64 3HD2 LEU 64 -0.053 -4.271 3.747
474 H LYS 65 H LYS 65 0.426 -9.500 2.426
475 HA LYS 65 HA LYS 65 0.203 -9.785 -0.414
476 1HB LYS 65 2HB LYS 65 1.229 -11.410 1.207
477 2HB LYS 65 3HB LYS 65 -0.413 -11.890 1.685
478 1HG LYS 65 2HG LYS 65 -0.931 -12.749 -0.449
479 2HG LYS 65 3HG LYS 65 0.511 -12.029 -1.192
480 1HD LYS 65 2HD LYS 65 1.992 -13.481 -0.031
481 2HD LYS 65 3HD LYS 65 0.717 -14.055 1.071
482 1HE LYS 65 2HE LYS 65 -0.420 -15.242 -0.662
483 2HE LYS 65 3HE LYS 65 0.510 -14.448 -1.948
484 1HZ LYS 65 1HZ LYS 65 1.789 -16.251 -0.005
485 2HZ LYS 65 2HZ LYS 65 1.214 -16.726 -1.480
486 3HZ LYS 65 3HZ LYS 65 2.397 -15.646 -1.425
487 H PHE 66 H PHE 66 -2.206 -8.830 1.838
488 HA PHE 66 HA PHE 66 -4.166 -9.065 -0.346
489 1HB PHE 66 2HB PHE 66 -4.419 -10.901 1.492
490 2HB PHE 66 3HB PHE 66 -4.973 -9.593 2.527
491 HD1 PHE 66 1HD PHE 66 -5.602 -11.501 -0.613
492 HD2 PHE 66 2HD PHE 66 -7.258 -8.731 2.242
493 HE1 PHE 66 1HE PHE 66 -7.839 -11.753 -1.663
494 HE2 PHE 66 2HE PHE 66 -9.499 -9.003 1.201
495 HZ PHE 66 HZ PHE 66 -9.786 -10.501 -0.761
496 H PHE 67 H PHE 67 -2.428 -6.863 0.424
497 HA PHE 67 HA PHE 67 -4.051 -5.010 2.005
498 1HB PHE 67 2HB PHE 67 -1.882 -4.484 2.260
499 2HB PHE 67 3HB PHE 67 -1.426 -4.921 0.608
500 HD1 PHE 67 1HD PHE 67 -4.030 -2.410 1.701
501 HD2 PHE 67 2HD PHE 67 -0.269 -3.123 -0.270
502 HE1 PHE 67 1HE PHE 67 -3.872 -0.022 1.141
503 HE2 PHE 67 2HE PHE 67 -0.153 -0.728 -0.873
504 HZ PHE 67 HZ PHE 67 -1.929 0.845 -0.128
505 H LEU 68 H LEU 68 -2.847 -4.478 -1.320
506 HA LEU 68 HA LEU 68 -4.769 -2.496 -1.833
507 1HB LEU 68 2HB LEU 68 -2.479 -3.006 -2.773
508 2HB LEU 68 3HB LEU 68 -3.277 -4.129 -3.852
509 HG LEU 68 HG LEU 68 -3.549 -1.121 -3.790
510 1HD1 LEU 68 1HD1 LEU 68 -1.321 -1.905 -4.440
511 2HD1 LEU 68 2HD1 LEU 68 -2.006 -3.130 -5.513
512 3HD1 LEU 68 3HD1 LEU 68 -2.172 -1.430 -5.934
513 1HD2 LEU 68 1HD2 LEU 68 -4.330 -2.844 -6.167
514 2HD2 LEU 68 2HD2 LEU 68 -5.545 -2.324 -4.990
515 3HD2 LEU 68 3HD2 LEU 68 -4.624 -1.131 -5.898
516 H GLN 69 H GLN 69 -5.073 -5.969 -2.112
517 HA GLN 69 HA GLN 69 -7.321 -6.334 -3.782
518 1HB GLN 69 2HB GLN 69 -6.583 -7.560 -1.084
519 2HB GLN 69 3HB GLN 69 -7.922 -8.133 -2.079
520 1HG GLN 69 2HG GLN 69 -5.020 -8.035 -2.998
521 2HG GLN 69 3HG GLN 69 -5.828 -9.468 -2.377
522 1HE2 GLN 69 1HE2 GLN 69 -4.688 -8.656 -5.170
523 2HE2 GLN 69 2HE2 GLN 69 -6.028 -9.001 -6.247
524 H LYS 70 H LYS 70 -7.188 -4.870 -0.476
525 HA LYS 70 HA LYS 70 -10.009 -4.692 -0.067
526 1HB LYS 70 2HB LYS 70 -7.597 -3.432 1.147
527 2HB LYS 70 3HB LYS 70 -8.916 -2.298 0.967
528 1HG LYS 70 2HG LYS 70 -9.242 -3.168 3.073
529 2HG LYS 70 3HG LYS 70 -10.442 -3.975 2.042
530 1HD LYS 70 2HD LYS 70 -8.424 -5.792 1.838
531 2HD LYS 70 3HD LYS 70 -7.928 -5.066 3.364
532 1HE LYS 70 2HE LYS 70 -10.584 -6.389 2.667
533 2HE LYS 70 3HE LYS 70 -9.376 -7.005 3.803
534 1HZ LYS 70 1HZ LYS 70 -9.919 -5.273 5.314
535 2HZ LYS 70 2HZ LYS 70 -10.882 -4.485 4.220
536 3HZ LYS 70 3HZ LYS 70 -11.291 -5.949 4.864
537 H PHE 71 H PHE 71 -7.780 -2.782 -2.022
538 HA PHE 71 HA PHE 71 -9.686 -0.608 -2.503
539 1HB PHE 71 2HB PHE 71 -7.047 -1.209 -3.878
540 2HB PHE 71 3HB PHE 71 -7.974 0.261 -3.927
541 HD1 PHE 71 1HD PHE 71 -5.227 0.528 -3.509
542 HD2 PHE 71 2HD PHE 71 -8.279 -0.280 -0.568
543 HE1 PHE 71 1HE PHE 71 -4.001 1.894 -1.853
544 HE2 PHE 71 2HE PHE 71 -7.029 1.026 1.083
545 HZ PHE 71 HZ PHE 71 -4.939 2.215 0.430
546 H GLU 72 H GLU 72 -8.107 -3.270 -4.374
547 HA GLU 72 HA GLU 72 -10.417 -3.403 -6.153
548 1HB GLU 72 2HB GLU 72 -8.461 -1.641 -6.926
549 2HB GLU 72 3HB GLU 72 -7.801 -3.129 -7.605
550 1HG GLU 72 2HG GLU 72 -10.590 -1.975 -8.101
551 2HG GLU 72 3HG GLU 72 -9.230 -1.965 -9.237
552 H SER 73 H SER 73 -10.616 -5.390 -7.091
553 HA SER 73 HA SER 73 -9.377 -7.631 -5.749
554 1HB SER 73 2HB SER 73 -11.711 -7.565 -6.693
555 2HB SER 73 3HB SER 73 -11.011 -7.577 -8.321
556 HG SER 73 HG SER 73 -9.883 -9.578 -7.470
557 H GLY 74 H GLY 74 -8.665 -5.801 -8.658
558 1HA GLY 74 1HA GLY 74 -7.020 -7.884 -9.944
559 2HA GLY 74 2HA GLY 74 -7.458 -6.284 -10.561
560 H ALA 75 H ALA 75 -6.410 -6.180 -7.298
561 HA ALA 75 HA ALA 75 -4.020 -4.756 -7.740
562 1HB ALA 75 1HB ALA 75 -5.286 -4.738 -5.633
563 2HB ALA 75 2HB ALA 75 -5.001 -6.461 -5.409
564 3HB ALA 75 3HB ALA 75 -3.623 -5.357 -5.389
565 H ARG 76 H ARG 76 -1.871 -5.578 -6.728
566 HA ARG 76 HA ARG 76 -1.080 -7.932 -8.335
567 1HB ARG 76 2HB ARG 76 0.596 -5.941 -6.753
568 2HB ARG 76 3HB ARG 76 1.163 -7.204 -7.854
569 1HG ARG 76 2HG ARG 76 -0.430 -4.722 -8.575
570 2HG ARG 76 3HG ARG 76 1.246 -5.076 -8.971
571 1HD ARG 76 2HD ARG 76 -1.254 -6.441 -10.061
572 2HD ARG 76 3HD ARG 76 -0.083 -5.448 -10.933
573 HE ARG 76 HE ARG 76 1.317 -7.722 -9.844
574 1HH1 ARG 76 2HH2 ARG 76 -0.982 -6.881 -12.348
575 2HH1 ARG 76 1HH2 ARG 76 -0.398 -8.039 -13.476
576 1HH2 ARG 76 2HH1 ARG 76 1.856 -9.394 -11.025
577 2HH2 ARG 76 1HH1 ARG 76 1.053 -9.849 -12.534
578 H GLU 77 H GLU 77 -1.367 -6.958 -4.993
579 HA GLU 77 HA GLU 77 0.141 -7.995 -3.446
580 1HB GLU 77 2HB GLU 77 -2.612 -9.040 -2.833
581 2HB GLU 77 3HB GLU 77 -1.393 -8.304 -1.785
582 1HG GLU 77 2HG GLU 77 -3.170 -6.896 -3.787
583 2HG GLU 77 3HG GLU 77 -3.176 -6.771 -2.025
584 H LEU 78 H LEU 78 -1.926 -10.250 -5.077
585 HA LEU 78 HA LEU 78 -1.451 -12.721 -3.965
586 1HB LEU 78 2HB LEU 78 -1.405 -12.366 -6.978
587 2HB LEU 78 3HB LEU 78 -2.042 -13.675 -6.007
588 HG LEU 78 HG LEU 78 -3.910 -12.721 -6.836
589 1HD1 LEU 78 1HD1 LEU 78 -5.188 -11.691 -5.100
590 2HD1 LEU 78 2HD1 LEU 78 -4.077 -12.850 -4.349
591 3HD1 LEU 78 3HD1 LEU 78 -3.748 -11.106 -4.261
592 1HD2 LEU 78 1HD2 LEU 78 -3.143 -9.833 -6.353
593 2HD2 LEU 78 2HD2 LEU 78 -2.716 -10.714 -7.829
594 3HD2 LEU 78 3HD2 LEU 78 -4.403 -10.507 -7.368
595 H THR 79 H THR 79 0.549 -11.082 -6.538
596 HA THR 79 HA THR 79 2.606 -13.114 -6.334
597 HB THR 79 HB THR 79 3.325 -10.462 -7.409
598 HG1 THR 79 1HG THR 79 2.140 -10.377 -8.944
599 1HG2 THR 79 1HG2 THR 79 4.807 -12.421 -7.663
600 2HG2 THR 79 2HG2 THR 79 3.535 -13.264 -8.580
601 3HG2 THR 79 3HG2 THR 79 4.281 -11.787 -9.230
602 H GLU 80 H GLU 80 4.240 -13.078 -5.087
603 HA GLU 80 HA GLU 80 4.419 -11.188 -2.946
604 1HB GLU 80 2HB GLU 80 6.404 -13.375 -3.594
605 2HB GLU 80 3HB GLU 80 6.270 -12.376 -2.120
606 1HG GLU 80 2HG GLU 80 5.201 -14.365 -1.528
607 2HG GLU 80 3HG GLU 80 3.883 -13.234 -1.864
608 H SER 81 H SER 81 6.231 -11.532 -6.037
609 HA SER 81 HA SER 81 8.339 -9.782 -5.491
610 1HB SER 81 2HB SER 81 6.825 -10.109 -8.119
611 2HB SER 81 3HB SER 81 8.458 -9.466 -7.919
612 HG SER 81 HG SER 81 9.144 -11.462 -7.275
613 H GLU 82 H GLU 82 5.347 -8.716 -7.306
614 HA GLU 82 HA GLU 82 5.679 -6.037 -6.988
615 1HB GLU 82 2HB GLU 82 3.074 -7.613 -6.806
616 2HB GLU 82 3HB GLU 82 3.186 -5.866 -7.055
617 1HG GLU 82 2HG GLU 82 2.971 -6.512 -9.250
618 2HG GLU 82 3HG GLU 82 4.730 -6.589 -9.129
619 H THR 83 H THR 83 3.919 -8.138 -4.601
620 HA THR 83 HA THR 83 3.251 -5.946 -3.017
621 HB THR 83 HB THR 83 2.429 -8.440 -2.976
622 HG1 THR 83 1HG THR 83 1.630 -7.966 -0.844
623 1HG2 THR 83 1HG2 THR 83 4.115 -8.469 -0.438
624 2HG2 THR 83 2HG2 THR 83 3.055 -9.744 -1.072
625 3HG2 THR 83 3HG2 THR 83 4.565 -9.353 -1.901
626 H LYS 84 H LYS 84 6.103 -8.090 -2.887
627 HA LYS 84 HA LYS 84 7.212 -6.994 -0.496
628 1HB LYS 84 2HB LYS 84 8.462 -8.571 -2.759
629 2HB LYS 84 3HB LYS 84 9.371 -8.043 -1.350
630 1HG LYS 84 2HG LYS 84 6.788 -9.544 -0.899
631 2HG LYS 84 3HG LYS 84 8.234 -10.434 -1.385
632 1HD LYS 84 2HD LYS 84 9.480 -9.670 0.524
633 2HD LYS 84 3HD LYS 84 8.215 -8.516 0.986
634 1HE LYS 84 2HE LYS 84 6.649 -10.307 1.512
635 2HE LYS 84 3HE LYS 84 7.761 -11.534 0.883
636 1HZ LYS 84 1HZ LYS 84 9.271 -11.003 2.674
637 2HZ LYS 84 2HZ LYS 84 8.245 -9.860 3.270
638 3HZ LYS 84 3HZ LYS 84 7.805 -11.433 3.271
639 H SER 85 H SER 85 7.299 -5.994 -3.894
640 HA SER 85 HA SER 85 9.356 -4.078 -3.701
641 1HB SER 85 2HB SER 85 7.652 -4.772 -5.683
642 2HB SER 85 3HB SER 85 6.868 -3.277 -5.144
643 HG SER 85 HG SER 85 8.440 -2.991 -6.774
644 H LEU 86 H LEU 86 5.919 -3.873 -2.613
645 HA LEU 86 HA LEU 86 6.156 -1.166 -1.584
646 1HB LEU 86 2HB LEU 86 3.997 -2.227 -2.109
647 2HB LEU 86 3HB LEU 86 4.183 -3.340 -0.771
648 HG LEU 86 HG LEU 86 4.621 -0.549 0.085
649 1HD1 LEU 86 1HD1 LEU 86 3.064 -0.021 -1.716
650 2HD1 LEU 86 2HD1 LEU 86 1.967 -1.307 -1.180
651 3HD1 LEU 86 3HD1 LEU 86 2.228 0.128 -0.156
652 1HD2 LEU 86 1HD2 LEU 86 4.213 -2.426 1.638
653 2HD2 LEU 86 2HD2 LEU 86 2.968 -1.180 1.797
654 3HD2 LEU 86 3HD2 LEU 86 2.607 -2.678 0.916
655 H MET 87 H MET 87 6.031 -4.386 -0.032
656 HA MET 87 HA MET 87 6.439 -3.649 2.564
657 1HB MET 87 2HB MET 87 5.995 -5.963 1.537
658 2HB MET 87 3HB MET 87 7.757 -6.127 1.406
659 1HG MET 87 2HG MET 87 6.225 -5.633 3.964
660 2HG MET 87 3HG MET 87 6.772 -7.210 3.422
661 1HE MET 87 1HE MET 87 10.649 -6.950 3.902
662 2HE MET 87 2HE MET 87 9.293 -8.034 3.540
663 3HE MET 87 3HE MET 87 9.749 -6.747 2.384
664 H ALA 88 H ALA 88 9.018 -4.635 0.364
665 HA ALA 88 HA ALA 88 11.354 -4.430 1.708
666 1HB ALA 88 1HB ALA 88 11.203 -5.129 -0.632
667 2HB ALA 88 2HB ALA 88 10.712 -3.504 -1.135
668 3HB ALA 88 3HB ALA 88 12.352 -3.784 -0.512
669 H ALA 89 H ALA 89 9.627 -1.647 0.217
670 HA ALA 89 HA ALA 89 11.724 0.201 1.162
671 1HB ALA 89 1HB ALA 89 9.103 0.792 -0.244
672 2HB ALA 89 2HB ALA 89 10.505 1.874 -0.054
673 3HB ALA 89 3HB ALA 89 10.657 0.426 -1.042
674 H ALA 90 H ALA 90 8.232 -0.400 1.746
675 HA ALA 90 HA ALA 90 7.675 1.591 3.664
676 1HB ALA 90 1HB ALA 90 5.892 0.045 4.393
677 2HB ALA 90 2HB ALA 90 5.977 0.163 2.614
678 3HB ALA 90 3HB ALA 90 6.646 -1.256 3.449
679 H ASP 91 H ASP 91 9.195 -1.623 4.153
680 HA ASP 91 HA ASP 91 9.185 -1.354 7.013
681 1HB ASP 91 2HB ASP 91 9.209 -3.557 5.886
682 2HB ASP 91 3HB ASP 91 10.830 -3.229 5.265
683 H ASN 92 H ASN 92 10.120 0.765 7.266
684 HA ASN 92 HA ASN 92 12.854 1.330 6.405
685 1HB ASN 92 2HB ASN 92 11.197 2.785 8.500
686 2HB ASN 92 3HB ASN 92 12.685 3.356 7.745
687 1HD2 ASN 92 1HD2 ASN 92 9.247 2.945 7.322
688 2HD2 ASN 92 2HD2 ASN 92 9.124 3.868 5.854
689 H ASP 93 H ASP 93 12.788 -1.143 7.821
690 HA ASP 93 HA ASP 93 14.548 -0.525 10.158
691 1HB ASP 93 2HB ASP 93 12.490 -2.761 9.864
692 2HB ASP 93 3HB ASP 93 13.869 -2.866 10.953
693 H GLY 94 H GLY 94 13.485 -3.015 7.798
694 1HA GLY 94 1HA GLY 94 14.875 -4.405 6.467
695 2HA GLY 94 2HA GLY 94 16.279 -4.028 7.482
696 H ASP 95 H ASP 95 12.895 -4.844 8.329
697 HA ASP 95 HA ASP 95 13.799 -7.371 9.629
698 1HB ASP 95 2HB ASP 95 12.759 -7.033 11.578
699 2HB ASP 95 3HB ASP 95 13.135 -5.345 11.240
700 H GLY 96 H GLY 96 10.878 -5.571 8.493
701 1HA GLY 96 1HA GLY 96 9.822 -6.871 6.517
702 2HA GLY 96 2HA GLY 96 9.657 -8.171 7.698
703 H LYS 97 H LYS 97 8.930 -7.001 10.040
704 HA LYS 97 HA LYS 97 6.123 -6.556 9.564
705 1HB LYS 97 2HB LYS 97 7.897 -6.227 12.010
706 2HB LYS 97 3HB LYS 97 6.138 -6.060 12.046
707 1HG LYS 97 2HG LYS 97 5.765 -8.285 11.960
708 2HG LYS 97 3HG LYS 97 6.985 -8.556 10.710
709 1HD LYS 97 2HD LYS 97 8.789 -8.529 12.264
710 2HD LYS 97 3HD LYS 97 7.732 -8.043 13.609
711 1HE LYS 97 2HE LYS 97 6.532 -10.158 13.535
712 2HE LYS 97 3HE LYS 97 7.337 -10.632 12.026
713 1HZ LYS 97 1HZ LYS 97 9.394 -10.758 13.182
714 2HZ LYS 97 2HZ LYS 97 8.720 -10.240 14.594
715 3HZ LYS 97 3HZ LYS 97 8.288 -11.699 13.960
716 H ILE 98 H ILE 98 5.334 -4.699 8.738
717 HA ILE 98 HA ILE 98 6.677 -2.090 9.242
718 HB ILE 98 HB ILE 98 4.491 -3.089 7.403
719 1HG1 ILE 98 2HG1 ILE 98 6.900 -1.563 6.490
720 2HG1 ILE 98 3HG1 ILE 98 7.232 -3.165 7.150
721 1HG2 ILE 98 1HG2 ILE 98 5.399 -0.206 7.781
722 2HG2 ILE 98 2HG2 ILE 98 4.432 -0.806 6.420
723 3HG2 ILE 98 3HG2 ILE 98 3.767 -0.861 8.057
724 1HD1 ILE 98 1HD1 ILE 98 6.914 -3.310 4.770
725 2HD1 ILE 98 2HD1 ILE 98 5.634 -4.191 5.631
726 3HD1 ILE 98 3HD1 ILE 98 5.282 -2.604 4.896
727 H GLY 99 H GLY 99 5.525 -0.414 10.296
728 1HA GLY 99 1HA GLY 99 2.940 -1.077 11.622
729 2HA GLY 99 2HA GLY 99 4.254 -0.297 12.526
730 H ALA 100 H ALA 100 2.196 1.262 12.623
731 HA ALA 100 HA ALA 100 1.348 2.547 10.223
732 1HB ALA 100 1HB ALA 100 0.144 4.033 11.588
733 2HB ALA 100 2HB ALA 100 0.100 2.489 12.458
734 3HB ALA 100 3HB ALA 100 1.207 3.765 12.998
735 H GLU 101 H GLU 101 3.765 3.404 12.722
736 HA GLU 101 HA GLU 101 4.443 5.888 11.608
737 1HB GLU 101 2HB GLU 101 5.769 4.005 13.546
738 2HB GLU 101 3HB GLU 101 6.724 5.340 12.878
739 1HG GLU 101 2HG GLU 101 5.233 7.001 13.660
740 2HG GLU 101 3HG GLU 101 3.926 5.846 13.966
741 H GLU 102 H GLU 102 6.391 2.836 11.210
742 HA GLU 102 HA GLU 102 8.001 3.620 9.135
743 1HB GLU 102 2HB GLU 102 6.539 0.995 9.559
744 2HB GLU 102 3HB GLU 102 7.711 1.209 8.266
745 1HG GLU 102 2HG GLU 102 9.467 1.768 9.905
746 2HG GLU 102 3HG GLU 102 8.326 1.498 11.231
747 H PHE 103 H PHE 103 4.611 2.421 8.757
748 HA PHE 103 HA PHE 103 4.684 2.449 5.910
749 1HB PHE 103 2HB PHE 103 3.009 1.210 7.254
750 2HB PHE 103 3HB PHE 103 2.299 2.726 7.785
751 HD1 PHE 103 1HD PHE 103 0.384 3.471 6.591
752 HD2 PHE 103 2HD PHE 103 3.272 0.979 4.570
753 HE1 PHE 103 1HE PHE 103 -1.112 3.323 4.621
754 HE2 PHE 103 2HE PHE 103 1.802 0.902 2.578
755 HZ PHE 103 HZ PHE 103 -0.410 2.030 2.613
756 H GLN 104 H GLN 104 3.385 4.834 8.255
757 HA GLN 104 HA GLN 104 2.527 6.751 6.325
758 1HB GLN 104 2HB GLN 104 1.772 6.576 8.687
759 2HB GLN 104 3HB GLN 104 3.344 7.205 9.221
760 1HG GLN 104 2HG GLN 104 2.914 9.297 7.948
761 2HG GLN 104 3HG GLN 104 1.409 8.619 7.320
762 1HE2 GLN 104 1HE2 GLN 104 3.037 9.741 10.291
763 2HE2 GLN 104 2HE2 GLN 104 1.551 10.054 11.169
764 H GLU 105 H GLU 105 5.648 6.453 8.150
765 HA GLU 105 HA GLU 105 6.947 8.745 7.199
766 1HB GLU 105 2HB GLU 105 7.968 5.930 7.819
767 2HB GLU 105 3HB GLU 105 9.037 7.237 7.324
768 1HG GLU 105 2HG GLU 105 8.309 8.634 9.220
769 2HG GLU 105 3HG GLU 105 7.240 7.341 9.785
770 H MET 106 H MET 106 7.005 5.449 5.739
771 HA MET 106 HA MET 106 8.461 6.398 3.462
772 1HB MET 106 2HB MET 106 7.384 3.864 4.430
773 2HB MET 106 3HB MET 106 7.138 3.996 2.699
774 1HG MET 106 2HG MET 106 9.859 4.724 3.841
775 2HG MET 106 3HG MET 106 9.368 3.055 3.736
776 1HE MET 106 1HE MET 106 9.013 6.180 1.199
777 2HE MET 106 2HE MET 106 10.693 6.126 1.783
778 3HE MET 106 3HE MET 106 10.315 5.710 0.096
779 H VAL 107 H VAL 107 4.971 5.662 3.855
780 HA VAL 107 HA VAL 107 4.169 6.356 1.241
781 HB VAL 107 HB VAL 107 2.727 6.495 3.905
782 1HG1 VAL 107 1HG1 VAL 107 1.663 6.987 1.104
783 2HG1 VAL 107 2HG1 VAL 107 0.627 6.583 2.494
784 3HG1 VAL 107 3HG1 VAL 107 1.560 8.082 2.499
785 1HG2 VAL 107 1HG2 VAL 107 1.651 4.465 3.104
786 2HG2 VAL 107 2HG2 VAL 107 2.448 4.598 1.523
787 3HG2 VAL 107 3HG2 VAL 107 3.398 4.220 2.965
788 H HIS 108 H HIS 108 4.878 8.479 4.035
789 HA HIS 108 HA HIS 108 3.698 10.827 2.937
790 1HB HIS 108 2HB HIS 108 4.045 10.540 5.315
791 2HB HIS 108 3HB HIS 108 5.793 10.366 5.091
792 HD1 HIS 108 1HD HIS 108 3.677 13.228 3.582
793 HD2 HIS 108 2HD HIS 108 6.564 12.406 6.532
794 HE1 HIS 108 1HE HIS 108 4.359 15.478 4.596
795 H SER 109 H SER 109 6.605 9.076 2.250
796 HA SER 109 HA SER 109 8.250 11.265 1.496
797 1HB SER 109 2HB SER 109 8.926 8.857 2.142
798 2HB SER 109 3HB SER 109 8.491 8.422 0.473
799 HG SER 109 HG SER 109 10.323 10.487 1.104
Start of MODEL 18
1 1H MET 1 H1 MET 1 -18.012 8.872 4.154
2 2H MET 1 H2 MET 1 -19.426 8.377 3.425
3 3H MET 1 H3 MET 1 -18.506 7.332 4.354
4 HA MET 1 HA MET 1 -18.309 7.021 1.912
5 1HB MET 1 2HB MET 1 -16.528 9.473 2.404
6 2HB MET 1 3HB MET 1 -16.502 8.479 0.944
7 1HG MET 1 2HG MET 1 -18.906 10.091 1.857
8 2HG MET 1 3HG MET 1 -17.776 10.512 0.565
9 1HE MET 1 1HE MET 1 -19.942 10.893 -0.928
10 2HE MET 1 2HE MET 1 -21.083 9.595 -1.347
11 3HE MET 1 3HE MET 1 -21.061 10.252 0.308
12 H SER 2 H SER 2 -15.797 6.539 1.227
13 HA SER 2 HA SER 2 -13.981 6.241 3.328
14 1HB SER 2 2HB SER 2 -15.322 4.203 3.906
15 2HB SER 2 3HB SER 2 -15.128 3.618 2.244
16 HG SER 2 HG SER 2 -13.167 3.915 4.269
17 H ILE 3 H ILE 3 -12.263 4.561 2.136
18 HA ILE 3 HA ILE 3 -10.961 6.100 0.234
19 HB ILE 3 HB ILE 3 -9.685 4.000 -0.290
20 1HG1 ILE 3 2HG1 ILE 3 -11.150 2.579 1.950
21 2HG1 ILE 3 3HG1 ILE 3 -11.841 2.447 0.335
22 1HG2 ILE 3 1HG2 ILE 3 -9.202 5.538 1.577
23 2HG2 ILE 3 2HG2 ILE 3 -10.256 4.590 2.645
24 3HG2 ILE 3 3HG2 ILE 3 -8.770 3.867 2.008
25 1HD1 ILE 3 1HD1 ILE 3 -9.908 1.510 -0.582
26 2HD1 ILE 3 2HD1 ILE 3 -8.930 1.837 0.860
27 3HD1 ILE 3 3HD1 ILE 3 -10.232 0.620 0.909
28 H THR 4 H THR 4 -13.309 3.555 -0.387
29 HA THR 4 HA THR 4 -13.187 3.107 -3.009
30 HB THR 4 HB THR 4 -14.404 1.899 -1.183
31 HG1 THR 4 1HG THR 4 -15.094 2.554 -3.602
32 1HG2 THR 4 1HG2 THR 4 -16.581 4.019 -1.548
33 2HG2 THR 4 2HG2 THR 4 -16.640 2.576 -0.526
34 3HG2 THR 4 3HG2 THR 4 -15.544 3.909 -0.110
35 H ASP 5 H ASP 5 -14.443 6.031 -1.447
36 HA ASP 5 HA ASP 5 -14.915 7.205 -4.061
37 1HB ASP 5 2HB ASP 5 -17.078 6.009 -3.489
38 2HB ASP 5 3HB ASP 5 -17.222 7.053 -2.062
39 H VAL 6 H VAL 6 -12.942 7.799 -2.419
40 HA VAL 6 HA VAL 6 -13.619 10.505 -1.291
41 HB VAL 6 HB VAL 6 -11.701 8.324 -0.447
42 1HG1 VAL 6 1HG1 VAL 6 -10.181 10.211 -0.563
43 2HG1 VAL 6 2HG1 VAL 6 -11.372 11.276 0.221
44 3HG1 VAL 6 3HG1 VAL 6 -10.623 9.939 1.122
45 1HG2 VAL 6 1HG2 VAL 6 -14.048 8.717 0.503
46 2HG2 VAL 6 2HG2 VAL 6 -12.724 8.665 1.692
47 3HG2 VAL 6 3HG2 VAL 6 -13.428 10.220 1.191
48 H LEU 7 H LEU 7 -11.015 8.640 -2.815
49 HA LEU 7 HA LEU 7 -10.432 10.576 -4.881
50 1HB LEU 7 2HB LEU 7 -9.377 11.798 -2.979
51 2HB LEU 7 3HB LEU 7 -8.556 10.329 -2.477
52 HG LEU 7 HG LEU 7 -7.613 10.519 -5.065
53 1HD1 LEU 7 1HD1 LEU 7 -8.807 12.659 -5.445
54 2HD1 LEU 7 2HD1 LEU 7 -7.929 13.380 -4.077
55 3HD1 LEU 7 3HD1 LEU 7 -7.043 12.840 -5.519
56 1HD2 LEU 7 1HD2 LEU 7 -5.572 11.455 -4.069
57 2HD2 LEU 7 2HD2 LEU 7 -6.476 11.848 -2.591
58 3HD2 LEU 7 3HD2 LEU 7 -6.253 10.155 -3.076
59 H SER 8 H SER 8 -8.897 8.244 -2.671
60 HA SER 8 HA SER 8 -7.117 7.233 -4.256
61 1HB SER 8 2HB SER 8 -8.665 5.831 -2.035
62 2HB SER 8 3HB SER 8 -7.110 5.254 -2.675
63 HG SER 8 HG SER 8 -6.166 7.144 -2.103
64 H ALA 9 H ALA 9 -10.483 6.223 -4.508
65 HA ALA 9 HA ALA 9 -10.202 3.850 -5.983
66 1HB ALA 9 1HB ALA 9 -12.338 4.778 -5.218
67 2HB ALA 9 2HB ALA 9 -12.206 6.115 -6.380
68 3HB ALA 9 3HB ALA 9 -12.389 4.442 -6.960
69 H ASP 10 H ASP 10 -9.823 7.235 -7.113
70 HA ASP 10 HA ASP 10 -9.436 6.492 -9.900
71 1HB ASP 10 2HB ASP 10 -10.243 8.723 -9.169
72 2HB ASP 10 3HB ASP 10 -8.683 9.024 -8.377
73 H ASP 11 H ASP 11 -7.416 6.923 -7.026
74 HA ASP 11 HA ASP 11 -4.901 7.075 -8.357
75 1HB ASP 11 2HB ASP 11 -4.007 7.266 -6.385
76 2HB ASP 11 3HB ASP 11 -5.615 7.576 -5.819
77 H ILE 12 H ILE 12 -6.680 4.328 -6.818
78 HA ILE 12 HA ILE 12 -4.730 2.497 -7.538
79 HB ILE 12 HB ILE 12 -6.326 0.792 -7.147
80 1HG1 ILE 12 2HG1 ILE 12 -8.408 2.755 -6.311
81 2HG1 ILE 12 3HG1 ILE 12 -8.405 2.098 -7.959
82 1HG2 ILE 12 1HG2 ILE 12 -6.496 1.175 -4.754
83 2HG2 ILE 12 2HG2 ILE 12 -5.003 1.910 -5.343
84 3HG2 ILE 12 3HG2 ILE 12 -6.404 2.933 -4.991
85 1HD1 ILE 12 1HD1 ILE 12 -8.587 -0.168 -7.168
86 2HD1 ILE 12 2HD1 ILE 12 -8.489 0.364 -5.480
87 3HD1 ILE 12 3HD1 ILE 12 -9.890 0.817 -6.472
88 H ALA 13 H ALA 13 -7.552 3.666 -9.344
89 HA ALA 13 HA ALA 13 -7.429 1.851 -11.520
90 1HB ALA 13 1HB ALA 13 -8.166 4.805 -11.639
91 2HB ALA 13 2HB ALA 13 -8.553 3.563 -12.837
92 3HB ALA 13 3HB ALA 13 -9.260 3.473 -11.212
93 H ALA 14 H ALA 14 -5.653 4.956 -11.030
94 HA ALA 14 HA ALA 14 -4.114 4.773 -13.433
95 1HB ALA 14 1HB ALA 14 -4.305 6.839 -12.120
96 2HB ALA 14 2HB ALA 14 -3.376 6.112 -10.793
97 3HB ALA 14 3HB ALA 14 -2.607 6.384 -12.368
98 H ALA 15 H ALA 15 -3.157 3.890 -10.067
99 HA ALA 15 HA ALA 15 -0.627 2.893 -10.578
100 1HB ALA 15 1HB ALA 15 -0.918 1.581 -8.522
101 2HB ALA 15 2HB ALA 15 -1.495 3.250 -8.309
102 3HB ALA 15 3HB ALA 15 -2.656 1.924 -8.532
103 H LEU 16 H LEU 16 -3.674 1.171 -10.596
104 HA LEU 16 HA LEU 16 -2.822 -1.442 -11.103
105 1HB LEU 16 2HB LEU 16 -5.377 0.050 -11.607
106 2HB LEU 16 3HB LEU 16 -5.126 -1.360 -12.598
107 HG LEU 16 HG LEU 16 -4.906 -2.845 -10.759
108 1HD1 LEU 16 1HD1 LEU 16 -3.865 -1.297 -9.048
109 2HD1 LEU 16 2HD1 LEU 16 -5.465 -0.559 -8.835
110 3HD1 LEU 16 3HD1 LEU 16 -5.221 -2.260 -8.446
111 1HD2 LEU 16 1HD2 LEU 16 -7.226 -2.679 -9.899
112 2HD2 LEU 16 2HD2 LEU 16 -7.311 -0.992 -10.446
113 3HD2 LEU 16 3HD2 LEU 16 -7.158 -2.305 -11.630
114 H GLN 17 H GLN 17 -3.117 1.253 -13.416
115 HA GLN 17 HA GLN 17 -2.572 -0.556 -15.686
116 1HB GLN 17 2HB GLN 17 -4.142 1.324 -15.880
117 2HB GLN 17 3HB GLN 17 -2.831 2.480 -15.624
118 1HG GLN 17 2HG GLN 17 -2.547 0.398 -17.825
119 2HG GLN 17 3HG GLN 17 -3.680 1.727 -18.048
120 1HE2 GLN 17 1HE2 GLN 17 -0.177 1.041 -17.449
121 2HE2 GLN 17 2HE2 GLN 17 0.333 2.567 -18.156
122 H GLU 18 H GLU 18 -0.963 2.045 -13.786
123 HA GLU 18 HA GLU 18 1.257 2.101 -15.566
124 1HB GLU 18 2HB GLU 18 2.001 3.887 -14.397
125 2HB GLU 18 3HB GLU 18 0.279 3.914 -14.081
126 1HG GLU 18 2HG GLU 18 0.877 4.237 -11.954
127 2HG GLU 18 3HG GLU 18 1.059 2.477 -11.907
128 H CYS 19 H CYS 19 0.698 0.245 -12.633
129 HA CYS 19 HA CYS 19 3.264 -1.252 -13.072
130 1HB CYS 19 2HB CYS 19 1.799 -0.680 -10.469
131 2HB CYS 19 3HB CYS 19 3.057 -1.915 -10.708
132 HG CYS 19 HG CYS 19 3.306 1.349 -11.033
133 H ARG 20 H ARG 20 1.057 -1.749 -14.713
134 HA ARG 20 HA ARG 20 -0.611 -3.874 -13.641
135 1HB ARG 20 2HB ARG 20 -1.007 -2.433 -15.748
136 2HB ARG 20 3HB ARG 20 0.120 -3.541 -16.550
137 1HG ARG 20 2HG ARG 20 -1.383 -5.443 -15.663
138 2HG ARG 20 3HG ARG 20 -2.508 -4.183 -15.126
139 1HD ARG 20 2HD ARG 20 -2.693 -3.388 -17.496
140 2HD ARG 20 3HD ARG 20 -1.491 -4.588 -17.964
141 HE ARG 20 HE ARG 20 -3.021 -6.261 -17.954
142 1HH1 ARG 20 2HH2 ARG 20 -4.403 -3.525 -16.231
143 2HH1 ARG 20 1HH2 ARG 20 -6.001 -4.193 -16.084
144 1HH2 ARG 20 2HH1 ARG 20 -5.102 -7.239 -17.716
145 2HH2 ARG 20 1HH1 ARG 20 -6.390 -6.386 -16.931
146 H ASP 21 H ASP 21 2.559 -3.581 -15.044
147 HA ASP 21 HA ASP 21 2.825 -6.283 -15.939
148 1HB ASP 21 2HB ASP 21 4.522 -3.771 -15.837
149 2HB ASP 21 3HB ASP 21 5.222 -5.288 -16.414
150 HA PRO 22 HA PRO 22 4.386 -8.248 -12.408
151 1HB PRO 22 2HB PRO 22 6.150 -10.112 -13.363
152 2HB PRO 22 3HB PRO 22 4.397 -10.198 -13.692
153 1HG PRO 22 2HG PRO 22 6.528 -9.011 -15.483
154 2HG PRO 22 3HG PRO 22 5.280 -10.212 -15.929
155 1HD PRO 22 2HD PRO 22 4.909 -7.579 -16.411
156 2HD PRO 22 3HD PRO 22 3.549 -8.565 -15.804
157 H ASP 23 H ASP 23 6.011 -8.057 -10.842
158 HA ASP 23 HA ASP 23 7.680 -7.265 -9.782
159 1HB ASP 23 2HB ASP 23 9.269 -7.728 -12.354
160 2HB ASP 23 3HB ASP 23 9.954 -7.525 -10.745
161 H THR 24 H THR 24 6.246 -5.264 -11.901
162 HA THR 24 HA THR 24 8.301 -3.221 -12.148
163 HB THR 24 HB THR 24 5.389 -3.194 -13.016
164 HG1 THR 24 1HG THR 24 6.279 -3.938 -14.955
165 1HG2 THR 24 1HG2 THR 24 7.832 -1.618 -13.960
166 2HG2 THR 24 2HG2 THR 24 6.298 -1.703 -14.853
167 3HG2 THR 24 3HG2 THR 24 6.338 -0.949 -13.261
168 H PHE 25 H PHE 25 6.120 -3.927 -9.712
169 HA PHE 25 HA PHE 25 5.233 -1.315 -8.990
170 1HB PHE 25 2HB PHE 25 5.423 -3.983 -7.746
171 2HB PHE 25 3HB PHE 25 5.668 -2.680 -6.623
172 HD1 PHE 25 1HD PHE 25 3.242 -3.961 -9.173
173 HD2 PHE 25 2HD PHE 25 3.855 -1.342 -5.796
174 HE1 PHE 25 1HE PHE 25 0.826 -3.439 -9.134
175 HE2 PHE 25 2HE PHE 25 1.421 -0.900 -5.704
176 HZ PHE 25 HZ PHE 25 -0.094 -1.908 -7.396
177 H GLU 26 H GLU 26 6.622 0.394 -8.688
178 HA GLU 26 HA GLU 26 9.044 -0.054 -6.992
179 1HB GLU 26 2HB GLU 26 8.468 1.895 -9.157
180 2HB GLU 26 3HB GLU 26 9.122 2.608 -7.673
181 1HG GLU 26 2HG GLU 26 11.029 2.193 -8.847
182 2HG GLU 26 3HG GLU 26 10.965 0.763 -7.819
183 HA PRO 27 HA PRO 27 6.760 1.541 -3.616
184 1HB PRO 27 2HB PRO 27 8.711 2.654 -2.016
185 2HB PRO 27 3HB PRO 27 8.459 0.908 -2.290
186 1HG PRO 27 2HG PRO 27 10.507 2.701 -3.649
187 2HG PRO 27 3HG PRO 27 10.752 1.085 -2.978
188 1HD PRO 27 2HD PRO 27 10.319 1.467 -5.618
189 2HD PRO 27 3HD PRO 27 9.711 0.022 -4.757
190 H GLN 28 H GLN 28 9.292 4.023 -4.268
191 HA GLN 28 HA GLN 28 7.724 6.232 -3.567
192 1HB GLN 28 2HB GLN 28 10.176 5.941 -5.311
193 2HB GLN 28 3HB GLN 28 9.493 7.517 -4.876
194 1HG GLN 28 2HG GLN 28 9.933 7.251 -2.575
195 2HG GLN 28 3HG GLN 28 10.091 5.498 -2.689
196 1HE2 GLN 28 1HE2 GLN 28 11.826 8.551 -3.073
197 2HE2 GLN 28 2HE2 GLN 28 13.383 7.789 -3.340
198 H LYS 29 H LYS 29 8.025 4.487 -6.605
199 HA LYS 29 HA LYS 29 6.643 6.305 -8.315
200 1HB LYS 29 2HB LYS 29 8.060 4.295 -8.972
201 2HB LYS 29 3HB LYS 29 6.730 3.261 -8.443
202 1HG LYS 29 2HG LYS 29 6.352 3.368 -10.682
203 2HG LYS 29 3HG LYS 29 5.276 4.654 -10.134
204 1HD LYS 29 2HD LYS 29 7.201 6.309 -10.551
205 2HD LYS 29 3HD LYS 29 8.118 4.977 -11.262
206 1HE LYS 29 2HE LYS 29 5.455 6.119 -12.232
207 2HE LYS 29 3HE LYS 29 7.034 6.323 -13.007
208 1HZ LYS 29 1HZ LYS 29 5.173 4.225 -13.177
209 2HZ LYS 29 2HZ LYS 29 6.464 4.499 -14.154
210 3HZ LYS 29 3HZ LYS 29 6.627 3.603 -12.771
211 H PHE 30 H PHE 30 5.429 3.229 -6.817
212 HA PHE 30 HA PHE 30 2.738 3.640 -7.447
213 1HB PHE 30 2HB PHE 30 3.494 1.478 -6.735
214 2HB PHE 30 3HB PHE 30 4.053 2.105 -5.185
215 HD1 PHE 30 1HD PHE 30 2.616 2.054 -3.292
216 HD2 PHE 30 2HD PHE 30 0.907 1.882 -7.231
217 HE1 PHE 30 1HE PHE 30 0.386 1.664 -2.293
218 HE2 PHE 30 2HE PHE 30 -1.365 1.612 -6.210
219 HZ PHE 30 HZ PHE 30 -1.617 1.524 -3.763
220 H PHE 31 H PHE 31 4.512 4.478 -4.513
221 HA PHE 31 HA PHE 31 2.719 5.652 -2.817
222 1HB PHE 31 2HB PHE 31 5.011 5.469 -2.225
223 2HB PHE 31 3HB PHE 31 5.516 6.268 -3.705
224 HD1 PHE 31 1HD PHE 31 3.092 7.315 -1.096
225 HD2 PHE 31 2HD PHE 31 6.738 8.223 -3.222
226 HE1 PHE 31 1HE PHE 31 3.149 9.531 -0.104
227 HE2 PHE 31 2HE PHE 31 6.994 10.291 -1.879
228 HZ PHE 31 HZ PHE 31 5.232 10.926 -0.250
229 H GLN 32 H GLN 32 4.355 7.395 -5.561
230 HA GLN 32 HA GLN 32 2.808 9.780 -5.021
231 1HB GLN 32 2HB GLN 32 5.139 9.778 -5.977
232 2HB GLN 32 3HB GLN 32 4.459 9.152 -7.493
233 1HG GLN 32 2HG GLN 32 2.910 11.169 -7.533
234 2HG GLN 32 3HG GLN 32 3.739 11.781 -6.098
235 1HE2 GLN 32 1HE2 GLN 32 6.010 12.462 -6.329
236 2HE2 GLN 32 2HE2 GLN 32 6.613 12.862 -7.930
237 H THR 33 H THR 33 2.732 7.145 -7.538
238 HA THR 33 HA THR 33 0.750 8.312 -9.094
239 HB THR 33 HB THR 33 2.383 6.074 -9.250
240 HG1 THR 33 1HG THR 33 0.099 6.826 -10.629
241 1HG2 THR 33 1HG2 THR 33 0.689 4.672 -7.924
242 2HG2 THR 33 2HG2 THR 33 -0.438 4.977 -9.263
243 3HG2 THR 33 3HG2 THR 33 1.088 4.112 -9.545
244 H SER 34 H SER 34 0.560 6.424 -6.175
245 HA SER 34 HA SER 34 -2.242 5.919 -6.297
246 1HB SER 34 2HB SER 34 -0.631 4.385 -5.293
247 2HB SER 34 3HB SER 34 -0.199 5.572 -4.050
248 HG SER 34 HG SER 34 -2.839 4.600 -4.411
249 H GLY 35 H GLY 35 -0.358 8.745 -5.449
250 1HA GLY 35 1HA GLY 35 -1.187 10.814 -4.912
251 2HA GLY 35 2HA GLY 35 -2.810 10.132 -4.717
252 H LEU 36 H LEU 36 -0.649 8.272 -2.963
253 HA LEU 36 HA LEU 36 -1.605 9.001 -0.402
254 1HB LEU 36 2HB LEU 36 0.838 7.456 -1.345
255 2HB LEU 36 3HB LEU 36 0.231 7.442 0.305
256 HG LEU 36 HG LEU 36 -1.383 6.463 -2.065
257 1HD1 LEU 36 1HD1 LEU 36 -0.842 4.213 -1.255
258 2HD1 LEU 36 2HD1 LEU 36 0.638 5.083 -1.680
259 3HD1 LEU 36 3HD1 LEU 36 0.184 4.894 0.027
260 1HD2 LEU 36 1HD2 LEU 36 -2.765 5.382 -0.307
261 2HD2 LEU 36 2HD2 LEU 36 -1.823 6.219 0.946
262 3HD2 LEU 36 3HD2 LEU 36 -2.827 7.142 -0.196
263 H SER 37 H SER 37 1.203 10.030 -2.321
264 HA SER 37 HA SER 37 2.530 11.623 -0.322
265 1HB SER 37 2HB SER 37 3.400 10.912 -2.671
266 2HB SER 37 3HB SER 37 2.290 12.101 -3.348
267 HG SER 37 HG SER 37 4.307 12.723 -1.446
268 H LYS 38 H LYS 38 -0.447 12.159 -2.185
269 HA LYS 38 HA LYS 38 -0.205 15.052 -1.794
270 1HB LYS 38 2HB LYS 38 -1.328 13.693 -3.869
271 2HB LYS 38 3HB LYS 38 -2.751 13.877 -2.839
272 1HG LYS 38 2HG LYS 38 -2.022 16.373 -2.623
273 2HG LYS 38 3HG LYS 38 -0.926 16.033 -3.976
274 1HD LYS 38 2HD LYS 38 -2.940 15.282 -5.318
275 2HD LYS 38 3HD LYS 38 -3.964 15.752 -3.941
276 1HE LYS 38 2HE LYS 38 -2.934 18.099 -4.112
277 2HE LYS 38 3HE LYS 38 -2.157 17.577 -5.614
278 1HZ LYS 38 1HZ LYS 38 -4.369 17.169 -6.510
279 2HZ LYS 38 2HZ LYS 38 -5.059 17.694 -5.109
280 3HZ LYS 38 3HZ LYS 38 -4.190 18.733 -6.037
281 H MET 39 H MET 39 -1.893 12.137 -0.671
282 HA MET 39 HA MET 39 -3.755 13.567 0.981
283 1HB MET 39 2HB MET 39 -2.871 10.701 0.716
284 2HB MET 39 3HB MET 39 -3.901 11.184 2.050
285 1HG MET 39 2HG MET 39 -4.614 11.708 -0.872
286 2HG MET 39 3HG MET 39 -5.105 10.303 0.067
287 1HE MET 39 1HE MET 39 -6.367 13.621 -1.191
288 2HE MET 39 2HE MET 39 -7.269 14.311 0.168
289 3HE MET 39 3HE MET 39 -5.507 14.394 0.155
290 H SER 40 H SER 40 -3.695 14.243 3.053
291 HA SER 40 HA SER 40 -1.175 14.616 4.315
292 1HB SER 40 2HB SER 40 -3.931 14.841 5.589
293 2HB SER 40 3HB SER 40 -2.478 15.796 5.947
294 HG SER 40 HG SER 40 -2.698 16.450 3.620
295 H ALA 41 H ALA 41 -0.427 13.743 6.338
296 HA ALA 41 HA ALA 41 -0.480 11.091 6.880
297 1HB ALA 41 1HB ALA 41 0.990 12.562 8.088
298 2HB ALA 41 2HB ALA 41 -0.375 13.360 8.904
299 3HB ALA 41 3HB ALA 41 0.024 11.664 9.258
300 H ASN 42 H ASN 42 -2.907 13.418 8.023
301 HA ASN 42 HA ASN 42 -4.494 11.892 9.716
302 1HB ASN 42 2HB ASN 42 -5.562 13.745 7.543
303 2HB ASN 42 3HB ASN 42 -6.365 13.300 9.052
304 1HD2 ASN 42 1HD2 ASN 42 -5.281 15.956 7.782
305 2HD2 ASN 42 2HD2 ASN 42 -4.362 16.649 9.102
306 H GLN 43 H GLN 43 -4.794 12.083 6.129
307 HA GLN 43 HA GLN 43 -6.943 10.110 6.103
308 1HB GLN 43 2HB GLN 43 -5.693 11.959 4.166
309 2HB GLN 43 3HB GLN 43 -5.962 10.364 3.478
310 1HG GLN 43 2HG GLN 43 -8.080 12.027 4.905
311 2HG GLN 43 3HG GLN 43 -7.909 11.897 3.154
312 1HE2 GLN 43 1HE2 GLN 43 -7.567 9.206 2.628
313 2HE2 GLN 43 2HE2 GLN 43 -8.922 8.308 3.291
314 H VAL 44 H VAL 44 -3.357 10.141 5.500
315 HA VAL 44 HA VAL 44 -3.314 7.536 4.378
316 HB VAL 44 HB VAL 44 -1.252 9.157 5.920
317 1HG1 VAL 44 1HG1 VAL 44 0.418 7.798 4.831
318 2HG1 VAL 44 2HG1 VAL 44 -0.633 6.738 5.765
319 3HG1 VAL 44 3HG1 VAL 44 -0.836 6.836 4.003
320 1HG2 VAL 44 1HG2 VAL 44 -2.227 10.245 3.795
321 2HG2 VAL 44 2HG2 VAL 44 -0.509 9.946 3.750
322 3HG2 VAL 44 3HG2 VAL 44 -1.633 8.857 2.900
323 H LYS 45 H LYS 45 -3.260 8.766 7.733
324 HA LYS 45 HA LYS 45 -2.803 6.244 8.985
325 1HB LYS 45 2HB LYS 45 -2.475 8.508 10.004
326 2HB LYS 45 3HB LYS 45 -4.233 8.647 10.183
327 1HG LYS 45 2HG LYS 45 -4.247 6.617 11.593
328 2HG LYS 45 3HG LYS 45 -2.511 6.385 11.292
329 1HD LYS 45 2HD LYS 45 -2.188 8.762 12.272
330 2HD LYS 45 3HD LYS 45 -3.826 8.613 12.902
331 1HE LYS 45 2HE LYS 45 -1.411 6.800 13.466
332 2HE LYS 45 3HE LYS 45 -2.122 7.968 14.587
333 1HZ LYS 45 1HZ LYS 45 -2.821 5.747 15.075
334 2HZ LYS 45 2HZ LYS 45 -4.123 6.633 14.598
335 3HZ LYS 45 3HZ LYS 45 -3.436 5.540 13.566
336 H ASP 46 H ASP 46 -5.804 8.105 8.160
337 HA ASP 46 HA ASP 46 -7.640 6.226 9.187
338 1HB ASP 46 2HB ASP 46 -8.293 8.464 8.380
339 2HB ASP 46 3HB ASP 46 -7.995 7.956 6.706
340 H VAL 47 H VAL 47 -6.466 6.437 5.766
341 HA VAL 47 HA VAL 47 -7.666 4.035 4.978
342 HB VAL 47 HB VAL 47 -6.364 3.985 3.037
343 1HG1 VAL 47 1HG1 VAL 47 -6.488 6.949 3.520
344 2HG1 VAL 47 2HG1 VAL 47 -6.886 6.024 2.077
345 3HG1 VAL 47 3HG1 VAL 47 -7.970 5.984 3.490
346 1HG2 VAL 47 1HG2 VAL 47 -4.110 4.119 3.754
347 2HG2 VAL 47 2HG2 VAL 47 -4.416 5.427 2.599
348 3HG2 VAL 47 3HG2 VAL 47 -4.391 5.769 4.338
349 H PHE 48 H PHE 48 -4.353 4.507 6.348
350 HA PHE 48 HA PHE 48 -3.495 1.855 6.421
351 1HB PHE 48 2HB PHE 48 -1.906 3.255 7.266
352 2HB PHE 48 3HB PHE 48 -3.056 4.220 8.159
353 HD1 PHE 48 1HD PHE 48 -1.605 0.755 8.219
354 HD2 PHE 48 2HD PHE 48 -3.227 4.037 10.478
355 HE1 PHE 48 1HE PHE 48 -1.581 -0.640 10.272
356 HE2 PHE 48 2HE PHE 48 -3.317 2.589 12.499
357 HZ PHE 48 HZ PHE 48 -2.578 0.212 12.352
358 H ARG 49 H ARG 49 -5.689 3.412 8.866
359 HA ARG 49 HA ARG 49 -6.020 0.991 10.363
360 1HB ARG 49 2HB ARG 49 -7.883 3.370 10.088
361 2HB ARG 49 3HB ARG 49 -8.059 2.077 11.284
362 1HG ARG 49 2HG ARG 49 -5.941 2.630 12.338
363 2HG ARG 49 3HG ARG 49 -5.544 3.768 11.053
364 1HD ARG 49 2HD ARG 49 -6.292 5.159 12.761
365 2HD ARG 49 3HD ARG 49 -7.659 5.050 11.637
366 HE ARG 49 HE ARG 49 -7.859 2.998 13.642
367 1HH1 ARG 49 2HH2 ARG 49 -8.423 6.425 13.087
368 2HH1 ARG 49 1HH2 ARG 49 -9.284 6.716 14.563
369 1HH2 ARG 49 2HH1 ARG 49 -8.994 3.321 15.643
370 2HH2 ARG 49 1HH1 ARG 49 -9.647 4.877 16.047
371 H PHE 50 H PHE 50 -7.915 2.323 7.589
372 HA PHE 50 HA PHE 50 -9.961 0.287 7.742
373 1HB PHE 50 2HB PHE 50 -9.064 2.217 5.605
374 2HB PHE 50 3HB PHE 50 -10.113 0.880 5.181
375 HD1 PHE 50 1HD PHE 50 -9.923 3.683 7.713
376 HD2 PHE 50 2HD PHE 50 -12.440 1.138 5.296
377 HE1 PHE 50 1HE PHE 50 -11.873 5.038 8.321
378 HE2 PHE 50 2HE PHE 50 -14.415 2.449 5.999
379 HZ PHE 50 HZ PHE 50 -14.133 4.433 7.484
380 H ILE 51 H ILE 51 -6.786 0.409 6.087
381 HA ILE 51 HA ILE 51 -7.338 -2.069 4.748
382 HB ILE 51 HB ILE 51 -4.823 -0.423 4.756
383 1HG1 ILE 51 2HG1 ILE 51 -6.624 0.870 3.732
384 2HG1 ILE 51 3HG1 ILE 51 -5.576 0.246 2.480
385 1HG2 ILE 51 1HG2 ILE 51 -4.233 -2.657 4.091
386 2HG2 ILE 51 2HG2 ILE 51 -5.728 -2.868 3.159
387 3HG2 ILE 51 3HG2 ILE 51 -4.492 -1.755 2.585
388 1HD1 ILE 51 1HD1 ILE 51 -8.353 -0.753 3.244
389 2HD1 ILE 51 2HD1 ILE 51 -7.848 0.068 1.767
390 3HD1 ILE 51 3HD1 ILE 51 -7.289 -1.575 2.071
391 H ASP 52 H ASP 52 -5.336 -1.142 7.558
392 HA ASP 52 HA ASP 52 -4.302 -3.777 8.131
393 1HB ASP 52 2HB ASP 52 -3.296 -1.749 9.054
394 2HB ASP 52 3HB ASP 52 -4.778 -1.378 9.940
395 H ASN 53 H ASN 53 -6.256 -4.844 7.543
396 HA ASN 53 HA ASN 53 -8.588 -4.970 9.266
397 1HB ASN 53 2HB ASN 53 -7.743 -6.345 6.959
398 2HB ASN 53 3HB ASN 53 -7.558 -7.570 8.205
399 1HD2 ASN 53 1HD2 ASN 53 -9.377 -8.906 7.951
400 2HD2 ASN 53 2HD2 ASN 53 -11.014 -8.296 7.800
401 H ASP 54 H ASP 54 -8.852 -6.564 11.074
402 HA ASP 54 HA ASP 54 -8.159 -7.566 12.967
403 1HB ASP 54 2HB ASP 54 -6.565 -9.061 12.798
404 2HB ASP 54 3HB ASP 54 -6.067 -8.429 11.246
405 H GLN 55 H GLN 55 -5.855 -5.020 11.914
406 HA GLN 55 HA GLN 55 -5.036 -3.250 12.984
407 1HB GLN 55 2HB GLN 55 -7.704 -3.377 14.301
408 2HB GLN 55 3HB GLN 55 -6.479 -2.412 15.122
409 1HG GLN 55 2HG GLN 55 -6.047 -1.063 13.179
410 2HG GLN 55 3HG GLN 55 -7.092 -2.072 12.180
411 1HE2 GLN 55 1HE2 GLN 55 -9.420 -2.285 12.963
412 2HE2 GLN 55 2HE2 GLN 55 -10.181 -0.788 13.477
413 H SER 56 H SER 56 -3.946 -5.700 13.409
414 HA SER 56 HA SER 56 -3.167 -6.371 15.954
415 1HB SER 56 2HB SER 56 -0.967 -7.022 14.952
416 2HB SER 56 3HB SER 56 -2.344 -7.672 14.093
417 HG SER 56 HG SER 56 -0.536 -6.690 12.855
418 H GLY 57 H GLY 57 -2.243 -3.534 14.111
419 1HA GLY 57 1HA GLY 57 -1.303 -1.594 15.435
420 2HA GLY 57 2HA GLY 57 -0.154 -2.759 16.114
421 H TYR 58 H TYR 58 -0.271 -4.256 13.387
422 HA TYR 58 HA TYR 58 1.572 -2.468 11.874
423 1HB TYR 58 2HB TYR 58 1.957 -5.401 12.548
424 2HB TYR 58 3HB TYR 58 2.965 -4.454 11.462
425 HD1 TYR 58 HD1 TYR 58 1.909 -4.832 15.035
426 HD2 TYR 58 HD2 TYR 58 4.786 -3.137 12.313
427 HE1 TYR 58 HE1 TYR 58 3.158 -3.883 16.945
428 HE2 TYR 58 HE2 TYR 58 6.003 -2.135 14.223
429 HH TYR 58 HH TYR 58 4.882 -2.484 17.597
430 H LEU 59 H LEU 59 1.704 -2.757 9.738
431 HA LEU 59 HA LEU 59 -0.251 -4.493 8.346
432 1HB LEU 59 2HB LEU 59 1.698 -2.372 7.422
433 2HB LEU 59 3HB LEU 59 1.009 -3.564 6.313
434 HG LEU 59 HG LEU 59 -0.830 -1.972 8.127
435 1HD1 LEU 59 1HD1 LEU 59 0.482 -0.259 7.039
436 2HD1 LEU 59 2HD1 LEU 59 0.320 -1.068 5.461
437 3HD1 LEU 59 3HD1 LEU 59 -1.107 -0.356 6.243
438 1HD2 LEU 59 1HD2 LEU 59 -1.739 -3.918 6.801
439 2HD2 LEU 59 2HD2 LEU 59 -2.450 -2.370 6.336
440 3HD2 LEU 59 3HD2 LEU 59 -1.200 -3.115 5.318
441 H ASP 60 H ASP 60 0.490 -6.192 9.477
442 HA ASP 60 HA ASP 60 3.140 -7.275 9.350
443 1HB ASP 60 2HB ASP 60 0.927 -9.216 9.542
444 2HB ASP 60 3HB ASP 60 2.287 -8.895 10.628
445 H GLU 61 H GLU 61 3.996 -8.911 7.769
446 HA GLU 61 HA GLU 61 3.668 -8.329 5.217
447 1HB GLU 61 2HB GLU 61 5.380 -9.787 6.440
448 2HB GLU 61 3HB GLU 61 4.319 -11.162 6.120
449 1HG GLU 61 2HG GLU 61 4.842 -9.436 3.755
450 2HG GLU 61 3HG GLU 61 6.294 -10.102 4.508
451 H GLU 62 H GLU 62 2.040 -11.161 6.610
452 HA GLU 62 HA GLU 62 0.676 -12.029 4.361
453 1HB GLU 62 2HB GLU 62 0.841 -13.141 6.670
454 2HB GLU 62 3HB GLU 62 -0.435 -12.038 7.216
455 1HG GLU 62 2HG GLU 62 -1.937 -12.996 5.422
456 2HG GLU 62 3HG GLU 62 -0.619 -14.112 4.997
457 H GLU 63 H GLU 63 -0.032 -9.212 6.367
458 HA GLU 63 HA GLU 63 -2.746 -8.886 5.492
459 1HB GLU 63 2HB GLU 63 -1.409 -7.981 7.553
460 2HB GLU 63 3HB GLU 63 -0.973 -6.636 6.495
461 1HG GLU 63 2HG GLU 63 -3.228 -5.901 6.347
462 2HG GLU 63 3HG GLU 63 -3.879 -7.491 6.814
463 H LEU 64 H LEU 64 0.458 -7.622 4.453
464 HA LEU 64 HA LEU 64 -0.753 -5.899 2.537
465 1HB LEU 64 2HB LEU 64 1.722 -5.912 3.464
466 2HB LEU 64 3HB LEU 64 2.029 -6.820 1.974
467 HG LEU 64 HG LEU 64 0.438 -4.775 1.020
468 1HD1 LEU 64 1HD1 LEU 64 2.084 -3.521 3.258
469 2HD1 LEU 64 2HD1 LEU 64 1.024 -2.674 2.113
470 3HD1 LEU 64 3HD1 LEU 64 0.327 -3.769 3.321
471 1HD2 LEU 64 1HD2 LEU 64 2.422 -3.528 0.328
472 2HD2 LEU 64 2HD2 LEU 64 3.443 -4.649 1.239
473 3HD2 LEU 64 3HD2 LEU 64 2.439 -5.237 -0.104
474 H LYS 65 H LYS 65 0.249 -9.232 2.585
475 HA LYS 65 HA LYS 65 -0.039 -9.960 -0.114
476 1HB LYS 65 2HB LYS 65 0.686 -11.243 2.103
477 2HB LYS 65 3HB LYS 65 -1.010 -11.777 2.050
478 1HG LYS 65 2HG LYS 65 -0.686 -12.894 -0.048
479 2HG LYS 65 3HG LYS 65 0.882 -12.113 -0.281
480 1HD LYS 65 2HD LYS 65 1.330 -14.384 0.468
481 2HD LYS 65 3HD LYS 65 1.829 -13.220 1.683
482 1HE LYS 65 2HE LYS 65 0.825 -14.918 2.948
483 2HE LYS 65 3HE LYS 65 -0.399 -13.656 2.891
484 1HZ LYS 65 1HZ LYS 65 -0.350 -16.090 1.251
485 2HZ LYS 65 2HZ LYS 65 -1.354 -15.763 2.513
486 3HZ LYS 65 3HZ LYS 65 -1.478 -14.891 1.122
487 H PHE 66 H PHE 66 -2.569 -8.637 1.869
488 HA PHE 66 HA PHE 66 -4.344 -9.167 -0.434
489 1HB PHE 66 2HB PHE 66 -6.292 -9.452 1.060
490 2HB PHE 66 3HB PHE 66 -5.143 -10.768 1.093
491 HD1 PHE 66 1HD PHE 66 -6.365 -7.809 3.043
492 HD2 PHE 66 2HD PHE 66 -4.029 -11.430 3.136
493 HE1 PHE 66 1HE PHE 66 -6.353 -7.756 5.523
494 HE2 PHE 66 2HE PHE 66 -4.135 -11.433 5.604
495 HZ PHE 66 HZ PHE 66 -5.307 -9.607 6.806
496 H PHE 67 H PHE 67 -2.626 -6.898 0.414
497 HA PHE 67 HA PHE 67 -4.003 -4.809 1.638
498 1HB PHE 67 2HB PHE 67 -1.730 -4.617 1.275
499 2HB PHE 67 3HB PHE 67 -1.813 -4.898 -0.455
500 HD1 PHE 67 1HD PHE 67 -1.855 -3.010 -1.931
501 HD2 PHE 67 2HD PHE 67 -2.308 -2.470 2.314
502 HE1 PHE 67 1HE PHE 67 -1.691 -0.562 -2.225
503 HE2 PHE 67 2HE PHE 67 -2.237 -0.008 2.007
504 HZ PHE 67 HZ PHE 67 -1.964 0.953 -0.273
505 H LEU 68 H LEU 68 -3.588 -4.917 -1.952
506 HA LEU 68 HA LEU 68 -5.483 -2.813 -2.276
507 1HB LEU 68 2HB LEU 68 -3.366 -3.642 -3.642
508 2HB LEU 68 3HB LEU 68 -4.519 -4.661 -4.448
509 HG LEU 68 HG LEU 68 -4.121 -2.750 -5.787
510 1HD1 LEU 68 1HD1 LEU 68 -6.570 -3.342 -5.560
511 2HD1 LEU 68 2HD1 LEU 68 -6.689 -2.000 -4.396
512 3HD1 LEU 68 3HD1 LEU 68 -6.241 -1.674 -6.074
513 1HD2 LEU 68 1HD2 LEU 68 -4.674 -0.953 -3.388
514 2HD2 LEU 68 2HD2 LEU 68 -3.082 -1.315 -4.090
515 3HD2 LEU 68 3HD2 LEU 68 -4.285 -0.432 -5.038
516 H GLN 69 H GLN 69 -5.645 -6.298 -2.307
517 HA GLN 69 HA GLN 69 -8.062 -6.923 -3.405
518 1HB GLN 69 2HB GLN 69 -6.137 -8.226 -1.845
519 2HB GLN 69 3HB GLN 69 -7.549 -8.308 -0.817
520 1HG GLN 69 2HG GLN 69 -8.786 -9.502 -2.504
521 2HG GLN 69 3HG GLN 69 -7.579 -9.159 -3.750
522 1HE2 GLN 69 1HE2 GLN 69 -5.543 -10.353 -3.806
523 2HE2 GLN 69 2HE2 GLN 69 -5.334 -11.749 -2.802
524 H LYS 70 H LYS 70 -7.480 -5.457 -0.177
525 HA LYS 70 HA LYS 70 -10.207 -5.691 0.736
526 1HB LYS 70 2HB LYS 70 -8.107 -3.590 1.397
527 2HB LYS 70 3HB LYS 70 -9.620 -3.858 2.256
528 1HG LYS 70 2HG LYS 70 -8.628 -6.376 2.473
529 2HG LYS 70 3HG LYS 70 -7.108 -5.497 2.164
530 1HD LYS 70 2HD LYS 70 -7.274 -5.558 4.499
531 2HD LYS 70 3HD LYS 70 -7.691 -3.935 3.956
532 1HE LYS 70 2HE LYS 70 -10.210 -4.754 4.146
533 2HE LYS 70 3HE LYS 70 -9.514 -6.107 5.029
534 1HZ LYS 70 1HZ LYS 70 -8.448 -4.300 6.449
535 2HZ LYS 70 2HZ LYS 70 -9.500 -3.243 5.803
536 3HZ LYS 70 3HZ LYS 70 -10.055 -4.568 6.633
537 H PHE 71 H PHE 71 -8.625 -3.557 -1.535
538 HA PHE 71 HA PHE 71 -10.636 -1.434 -1.394
539 1HB PHE 71 2HB PHE 71 -7.999 -1.475 -2.038
540 2HB PHE 71 3HB PHE 71 -8.674 -1.687 -3.650
541 HD1 PHE 71 1HD PHE 71 -11.046 0.046 -3.711
542 HD2 PHE 71 2HD PHE 71 -7.090 0.661 -2.082
543 HE1 PHE 71 1HE PHE 71 -11.282 2.481 -4.016
544 HE2 PHE 71 2HE PHE 71 -7.370 3.084 -2.318
545 HZ PHE 71 HZ PHE 71 -9.551 4.013 -3.153
546 H GLU 72 H GLU 72 -9.432 -3.855 -3.742
547 HA GLU 72 HA GLU 72 -11.906 -3.532 -5.390
548 1HB GLU 72 2HB GLU 72 -9.642 -2.939 -6.315
549 2HB GLU 72 3HB GLU 72 -9.167 -4.620 -6.146
550 1HG GLU 72 2HG GLU 72 -11.699 -4.558 -7.573
551 2HG GLU 72 3HG GLU 72 -10.697 -3.265 -8.239
552 H SER 73 H SER 73 -10.532 -6.315 -6.438
553 HA SER 73 HA SER 73 -11.183 -8.042 -4.180
554 1HB SER 73 2HB SER 73 -12.982 -9.312 -5.470
555 2HB SER 73 3HB SER 73 -13.430 -7.710 -4.870
556 HG SER 73 HG SER 73 -14.071 -7.900 -7.019
557 H GLY 74 H GLY 74 -9.341 -7.712 -7.054
558 1HA GLY 74 1HA GLY 74 -7.975 -10.177 -6.369
559 2HA GLY 74 2HA GLY 74 -8.890 -10.255 -7.897
560 H ALA 75 H ALA 75 -6.604 -8.008 -6.104
561 HA ALA 75 HA ALA 75 -5.983 -6.756 -8.701
562 1HB ALA 75 1HB ALA 75 -6.612 -5.429 -6.713
563 2HB ALA 75 2HB ALA 75 -5.149 -5.970 -5.902
564 3HB ALA 75 3HB ALA 75 -5.008 -5.004 -7.375
565 H ARG 76 H ARG 76 -3.415 -6.783 -6.339
566 HA ARG 76 HA ARG 76 -1.983 -8.962 -7.681
567 1HB ARG 76 2HB ARG 76 -1.845 -6.760 -9.118
568 2HB ARG 76 3HB ARG 76 -0.898 -6.109 -7.781
569 1HG ARG 76 2HG ARG 76 0.778 -6.883 -9.052
570 2HG ARG 76 3HG ARG 76 0.537 -8.354 -8.128
571 1HD ARG 76 2HD ARG 76 -0.953 -9.225 -9.981
572 2HD ARG 76 3HD ARG 76 -0.679 -7.714 -10.890
573 HE ARG 76 HE ARG 76 1.859 -8.584 -10.348
574 1HH1 ARG 76 2HH2 ARG 76 -0.803 -10.101 -12.086
575 2HH1 ARG 76 1HH2 ARG 76 0.223 -11.256 -12.896
576 1HH2 ARG 76 2HH1 ARG 76 3.126 -9.964 -11.253
577 2HH2 ARG 76 1HH1 ARG 76 2.628 -11.181 -12.429
578 H GLU 77 H GLU 77 -2.780 -9.015 -5.223
579 HA GLU 77 HA GLU 77 -0.607 -8.200 -3.399
580 1HB GLU 77 2HB GLU 77 -3.049 -9.729 -2.564
581 2HB GLU 77 3HB GLU 77 -2.158 -8.433 -1.757
582 1HG GLU 77 2HG GLU 77 -4.154 -7.434 -2.303
583 2HG GLU 77 3HG GLU 77 -3.146 -6.873 -3.627
584 H LEU 78 H LEU 78 -1.807 -10.823 -5.274
585 HA LEU 78 HA LEU 78 -0.799 -13.012 -3.755
586 1HB LEU 78 2HB LEU 78 -1.304 -12.982 -6.757
587 2HB LEU 78 3HB LEU 78 -1.224 -14.362 -5.669
588 HG LEU 78 HG LEU 78 -3.449 -14.256 -5.885
589 1HD1 LEU 78 1HD1 LEU 78 -4.578 -13.334 -4.020
590 2HD1 LEU 78 2HD1 LEU 78 -2.981 -13.847 -3.460
591 3HD1 LEU 78 3HD1 LEU 78 -3.324 -12.121 -3.731
592 1HD2 LEU 78 1HD2 LEU 78 -3.641 -12.548 -7.494
593 2HD2 LEU 78 2HD2 LEU 78 -4.795 -12.161 -6.208
594 3HD2 LEU 78 3HD2 LEU 78 -3.278 -11.255 -6.346
595 H THR 79 H THR 79 0.688 -11.071 -6.495
596 HA THR 79 HA THR 79 2.884 -12.876 -6.626
597 HB THR 79 HB THR 79 3.452 -10.003 -7.205
598 HG1 THR 79 1HG THR 79 2.632 -10.170 -9.126
599 1HG2 THR 79 1HG2 THR 79 3.994 -12.584 -8.738
600 2HG2 THR 79 2HG2 THR 79 4.749 -11.009 -9.017
601 3HG2 THR 79 3HG2 THR 79 5.106 -11.905 -7.543
602 H GLU 80 H GLU 80 4.502 -13.097 -5.379
603 HA GLU 80 HA GLU 80 4.836 -11.715 -2.863
604 1HB GLU 80 2HB GLU 80 6.912 -12.980 -2.659
605 2HB GLU 80 3HB GLU 80 5.532 -14.000 -3.073
606 1HG GLU 80 2HG GLU 80 6.290 -14.094 -5.454
607 2HG GLU 80 3HG GLU 80 7.658 -13.034 -5.058
608 H SER 81 H SER 81 6.324 -11.424 -6.084
609 HA SER 81 HA SER 81 8.270 -9.559 -5.284
610 1HB SER 81 2HB SER 81 7.971 -10.980 -7.545
611 2HB SER 81 3HB SER 81 7.402 -9.418 -8.133
612 HG SER 81 HG SER 81 9.566 -9.526 -8.370
613 H GLU 82 H GLU 82 5.320 -8.721 -7.277
614 HA GLU 82 HA GLU 82 5.367 -6.068 -6.818
615 1HB GLU 82 2HB GLU 82 2.866 -7.805 -7.008
616 2HB GLU 82 3HB GLU 82 2.885 -6.046 -7.041
617 1HG GLU 82 2HG GLU 82 2.867 -6.638 -9.319
618 2HG GLU 82 3HG GLU 82 4.517 -6.141 -8.993
619 H THR 83 H THR 83 3.956 -8.450 -4.436
620 HA THR 83 HA THR 83 3.227 -6.462 -2.669
621 HB THR 83 HB THR 83 4.134 -9.326 -2.186
622 HG1 THR 83 1HG THR 83 1.780 -8.484 -1.254
623 1HG2 THR 83 1HG2 THR 83 3.213 -7.355 -0.041
624 2HG2 THR 83 2HG2 THR 83 3.294 -9.114 0.162
625 3HG2 THR 83 3HG2 THR 83 4.774 -8.193 -0.068
626 H LYS 84 H LYS 84 6.320 -8.330 -2.726
627 HA LYS 84 HA LYS 84 7.419 -7.100 -0.470
628 1HB LYS 84 2HB LYS 84 9.345 -8.302 -0.779
629 2HB LYS 84 3HB LYS 84 8.144 -9.314 -1.568
630 1HG LYS 84 2HG LYS 84 8.877 -8.060 -3.740
631 2HG LYS 84 3HG LYS 84 10.248 -7.467 -2.802
632 1HD LYS 84 2HD LYS 84 10.925 -9.827 -2.359
633 2HD LYS 84 3HD LYS 84 9.538 -10.378 -3.329
634 1HE LYS 84 2HE LYS 84 10.466 -8.949 -5.261
635 2HE LYS 84 3HE LYS 84 11.909 -8.679 -4.292
636 1HZ LYS 84 1HZ LYS 84 12.306 -11.042 -4.346
637 2HZ LYS 84 2HZ LYS 84 10.900 -11.312 -5.167
638 3HZ LYS 84 3HZ LYS 84 12.112 -10.474 -5.884
639 H SER 85 H SER 85 7.479 -6.061 -3.834
640 HA SER 85 HA SER 85 9.447 -4.084 -3.771
641 1HB SER 85 2HB SER 85 6.598 -3.819 -4.859
642 2HB SER 85 3HB SER 85 8.023 -2.874 -5.329
643 HG SER 85 HG SER 85 7.618 -5.690 -5.689
644 H LEU 86 H LEU 86 6.127 -3.948 -2.406
645 HA LEU 86 HA LEU 86 6.647 -1.324 -1.165
646 1HB LEU 86 2HB LEU 86 4.306 -3.234 -1.260
647 2HB LEU 86 3HB LEU 86 4.382 -1.988 -0.005
648 HG LEU 86 HG LEU 86 4.856 -1.213 -2.890
649 1HD1 LEU 86 1HD1 LEU 86 2.751 -2.480 -2.923
650 2HD1 LEU 86 2HD1 LEU 86 2.119 -1.502 -1.579
651 3HD1 LEU 86 3HD1 LEU 86 2.456 -0.750 -3.155
652 1HD2 LEU 86 1HD2 LEU 86 5.263 0.377 -0.904
653 2HD2 LEU 86 2HD2 LEU 86 4.132 0.955 -2.122
654 3HD2 LEU 86 3HD2 LEU 86 3.522 0.293 -0.591
655 H MET 87 H MET 87 6.050 -4.749 -0.046
656 HA MET 87 HA MET 87 6.564 -4.152 2.579
657 1HB MET 87 2HB MET 87 5.957 -6.473 1.231
658 2HB MET 87 3HB MET 87 7.588 -6.836 1.842
659 1HG MET 87 2HG MET 87 6.037 -7.510 3.537
660 2HG MET 87 3HG MET 87 6.779 -6.016 4.101
661 1HE MET 87 1HE MET 87 3.085 -6.098 5.443
662 2HE MET 87 2HE MET 87 4.786 -6.546 5.767
663 3HE MET 87 3HE MET 87 4.288 -4.849 5.731
664 H ALA 88 H ALA 88 8.998 -4.226 0.192
665 HA ALA 88 HA ALA 88 11.299 -4.693 1.910
666 1HB ALA 88 1HB ALA 88 10.964 -3.800 -1.014
667 2HB ALA 88 2HB ALA 88 12.523 -4.116 -0.217
668 3HB ALA 88 3HB ALA 88 11.342 -5.422 -0.426
669 H ALA 89 H ALA 89 10.122 -1.919 -0.071
670 HA ALA 89 HA ALA 89 12.086 -0.163 1.187
671 1HB ALA 89 1HB ALA 89 11.086 1.528 -0.351
672 2HB ALA 89 2HB ALA 89 11.652 0.040 -1.152
673 3HB ALA 89 3HB ALA 89 9.914 0.280 -0.844
674 H ALA 90 H ALA 90 8.544 -0.688 1.516
675 HA ALA 90 HA ALA 90 8.062 1.652 3.151
676 1HB ALA 90 1HB ALA 90 6.131 0.360 3.982
677 2HB ALA 90 2HB ALA 90 6.209 0.323 2.199
678 3HB ALA 90 3HB ALA 90 6.745 -1.080 3.157
679 H ASP 91 H ASP 91 9.252 -1.658 3.767
680 HA ASP 91 HA ASP 91 9.347 -1.415 6.613
681 1HB ASP 91 2HB ASP 91 9.400 -3.613 5.584
682 2HB ASP 91 3HB ASP 91 10.833 -3.228 4.632
683 H ASN 92 H ASN 92 11.877 -1.402 4.178
684 HA ASN 92 HA ASN 92 14.061 -0.847 4.208
685 1HB ASN 92 2HB ASN 92 14.559 1.522 4.373
686 2HB ASN 92 3HB ASN 92 13.088 1.224 3.464
687 1HD2 ASN 92 1HD2 ASN 92 11.079 1.983 4.289
688 2HD2 ASN 92 2HD2 ASN 92 10.976 2.976 5.736
689 H ASP 93 H ASP 93 13.174 -2.055 6.808
690 HA ASP 93 HA ASP 93 15.311 -1.044 8.652
691 1HB ASP 93 2HB ASP 93 13.143 -3.178 8.979
692 2HB ASP 93 3HB ASP 93 14.387 -2.800 10.165
693 H GLY 94 H GLY 94 14.077 -3.814 6.845
694 1HA GLY 94 1HA GLY 94 15.333 -5.683 5.997
695 2HA GLY 94 2HA GLY 94 16.575 -5.409 7.230
696 H ASP 95 H ASP 95 12.964 -5.297 7.576
697 HA ASP 95 HA ASP 95 13.109 -7.882 9.036
698 1HB ASP 95 2HB ASP 95 11.784 -7.291 10.843
699 2HB ASP 95 3HB ASP 95 13.132 -6.155 10.772
700 H GLY 96 H GLY 96 10.645 -5.549 7.791
701 1HA GLY 96 1HA GLY 96 9.527 -6.261 5.696
702 2HA GLY 96 2HA GLY 96 9.358 -7.880 6.373
703 H LYS 97 H LYS 97 8.755 -6.680 9.130
704 HA LYS 97 HA LYS 97 5.856 -6.386 8.749
705 1HB LYS 97 2HB LYS 97 5.851 -6.139 11.241
706 2HB LYS 97 3HB LYS 97 6.437 -7.695 10.632
707 1HG LYS 97 2HG LYS 97 8.749 -7.066 11.030
708 2HG LYS 97 3HG LYS 97 8.256 -5.423 11.505
709 1HD LYS 97 2HD LYS 97 7.074 -6.386 13.458
710 2HD LYS 97 3HD LYS 97 7.640 -8.007 12.970
711 1HE LYS 97 2HE LYS 97 10.020 -7.180 13.066
712 2HE LYS 97 3HE LYS 97 9.440 -5.591 13.583
713 1HZ LYS 97 1HZ LYS 97 8.568 -6.625 15.566
714 2HZ LYS 97 2HZ LYS 97 9.125 -8.102 15.085
715 3HZ LYS 97 3HZ LYS 97 10.184 -6.889 15.418
716 H ILE 98 H ILE 98 4.862 -4.437 8.539
717 HA ILE 98 HA ILE 98 6.541 -1.973 8.811
718 HB ILE 98 HB ILE 98 4.564 -2.898 6.756
719 1HG1 ILE 98 2HG1 ILE 98 7.178 -1.502 6.245
720 2HG1 ILE 98 3HG1 ILE 98 7.306 -3.141 6.876
721 1HG2 ILE 98 1HG2 ILE 98 4.694 -0.721 5.672
722 2HG2 ILE 98 2HG2 ILE 98 3.958 -0.532 7.268
723 3HG2 ILE 98 3HG2 ILE 98 5.655 -0.064 6.992
724 1HD1 ILE 98 1HD1 ILE 98 5.601 -2.537 4.447
725 2HD1 ILE 98 2HD1 ILE 98 7.342 -2.932 4.376
726 3HD1 ILE 98 3HD1 ILE 98 6.209 -4.084 5.066
727 H GLY 99 H GLY 99 5.991 -1.074 10.711
728 1HA GLY 99 1HA GLY 99 3.392 -1.133 11.896
729 2HA GLY 99 2HA GLY 99 4.677 0.044 12.210
730 H ALA 100 H ALA 100 1.959 0.730 12.172
731 HA ALA 100 HA ALA 100 1.022 2.059 9.859
732 1HB ALA 100 1HB ALA 100 -0.136 1.871 12.091
733 2HB ALA 100 2HB ALA 100 0.990 3.071 12.741
734 3HB ALA 100 3HB ALA 100 -0.115 3.523 11.421
735 H GLU 101 H GLU 101 3.402 2.920 12.341
736 HA GLU 101 HA GLU 101 3.993 5.501 11.504
737 1HB GLU 101 2HB GLU 101 4.663 4.077 13.648
738 2HB GLU 101 3HB GLU 101 6.157 3.778 12.748
739 1HG GLU 101 2HG GLU 101 6.550 6.206 12.604
740 2HG GLU 101 3HG GLU 101 4.968 6.533 13.333
741 H GLU 102 H GLU 102 5.805 2.457 10.724
742 HA GLU 102 HA GLU 102 7.613 3.477 8.856
743 1HB GLU 102 2HB GLU 102 6.186 0.797 8.977
744 2HB GLU 102 3HB GLU 102 7.554 1.138 7.904
745 1HG GLU 102 2HG GLU 102 9.047 1.464 9.750
746 2HG GLU 102 3HG GLU 102 7.731 1.430 10.933
747 H PHE 103 H PHE 103 4.248 2.321 8.284
748 HA PHE 103 HA PHE 103 4.247 2.730 5.464
749 1HB PHE 103 2HB PHE 103 2.567 1.423 6.703
750 2HB PHE 103 3HB PHE 103 1.943 2.882 7.447
751 HD1 PHE 103 1HD PHE 103 2.361 1.095 4.192
752 HD2 PHE 103 2HD PHE 103 0.332 4.263 6.304
753 HE1 PHE 103 1HE PHE 103 0.758 1.326 2.314
754 HE2 PHE 103 2HE PHE 103 -1.307 4.444 4.452
755 HZ PHE 103 HZ PHE 103 -1.073 3.008 2.436
756 H GLN 104 H GLN 104 3.101 4.904 8.076
757 HA GLN 104 HA GLN 104 2.463 7.170 6.403
758 1HB GLN 104 2HB GLN 104 2.817 6.644 9.338
759 2HB GLN 104 3HB GLN 104 2.903 8.320 8.772
760 1HG GLN 104 2HG GLN 104 0.852 8.278 7.715
761 2HG GLN 104 3HG GLN 104 0.733 6.507 7.744
762 1HE2 GLN 104 1HE2 GLN 104 1.188 9.127 10.197
763 2HE2 GLN 104 2HE2 GLN 104 0.101 8.409 11.371
764 H GLU 105 H GLU 105 5.592 6.085 7.877
765 HA GLU 105 HA GLU 105 6.926 8.564 7.306
766 1HB GLU 105 2HB GLU 105 7.873 5.689 7.644
767 2HB GLU 105 3HB GLU 105 8.983 6.957 7.121
768 1HG GLU 105 2HG GLU 105 7.298 7.251 9.638
769 2HG GLU 105 3HG GLU 105 8.913 6.525 9.624
770 H MET 106 H MET 106 6.714 5.478 5.439
771 HA MET 106 HA MET 106 8.125 6.458 3.216
772 1HB MET 106 2HB MET 106 7.657 4.079 3.578
773 2HB MET 106 3HB MET 106 5.933 4.358 3.302
774 1HG MET 106 2HG MET 106 6.858 3.364 1.378
775 2HG MET 106 3HG MET 106 6.436 5.005 0.924
776 1HE MET 106 1HE MET 106 8.913 6.937 1.264
777 2HE MET 106 2HE MET 106 9.854 6.473 -0.150
778 3HE MET 106 3HE MET 106 8.084 6.588 -0.271
779 H VAL 107 H VAL 107 4.639 6.550 3.965
780 HA VAL 107 HA VAL 107 3.967 7.780 1.450
781 HB VAL 107 HB VAL 107 2.423 7.240 3.982
782 1HG1 VAL 107 1HG1 VAL 107 1.645 8.667 1.426
783 2HG1 VAL 107 2HG1 VAL 107 0.439 7.879 2.461
784 3HG1 VAL 107 3HG1 VAL 107 1.422 9.213 3.092
785 1HG2 VAL 107 1HG2 VAL 107 3.006 5.278 2.554
786 2HG2 VAL 107 2HG2 VAL 107 1.268 5.607 2.532
787 3HG2 VAL 107 3HG2 VAL 107 2.278 6.090 1.154
788 H HIS 108 H HIS 108 4.082 9.173 4.815
789 HA HIS 108 HA HIS 108 3.250 11.750 3.762
790 1HB HIS 108 2HB HIS 108 2.879 10.749 6.131
791 2HB HIS 108 3HB HIS 108 4.543 11.219 6.472
792 HD1 HIS 108 1HD HIS 108 4.353 13.326 7.944
793 HD2 HIS 108 2HD HIS 108 1.503 13.133 4.857
794 HE1 HIS 108 1HE HIS 108 2.857 15.383 8.198
795 H SER 109 H SER 109 6.185 10.067 3.923
796 HA SER 109 HA SER 109 8.134 11.986 3.911
797 1HB SER 109 2HB SER 109 8.609 9.574 3.360
798 2HB SER 109 3HB SER 109 7.848 9.836 1.770
799 HG SER 109 HG SER 109 9.500 11.656 1.728
Start of MODEL 19
1 1H MET 1 H1 MET 1 -17.645 4.300 -1.310
2 2H MET 1 H2 MET 1 -19.256 4.272 -0.966
3 3H MET 1 H3 MET 1 -18.369 5.610 -0.675
4 HA MET 1 HA MET 1 -18.739 4.542 1.380
5 1HB MET 1 2HB MET 1 -17.690 2.081 -0.055
6 2HB MET 1 3HB MET 1 -17.652 2.226 1.713
7 1HG MET 1 2HG MET 1 -20.014 2.592 1.846
8 2HG MET 1 3HG MET 1 -20.202 2.434 0.091
9 1HE MET 1 1HE MET 1 -21.685 -0.755 2.161
10 2HE MET 1 2HE MET 1 -21.309 0.786 2.959
11 3HE MET 1 3HE MET 1 -22.160 0.779 1.392
12 H SER 2 H SER 2 -15.779 2.830 0.926
13 HA SER 2 HA SER 2 -14.579 4.747 2.725
14 1HB SER 2 2HB SER 2 -13.369 2.189 1.590
15 2HB SER 2 3HB SER 2 -13.030 2.987 3.148
16 HG SER 2 HG SER 2 -14.417 1.289 3.511
17 H ILE 3 H ILE 3 -11.850 3.951 1.667
18 HA ILE 3 HA ILE 3 -11.065 6.188 0.356
19 HB ILE 3 HB ILE 3 -9.036 5.105 -0.118
20 1HG1 ILE 3 2HG1 ILE 3 -9.039 2.470 0.205
21 2HG1 ILE 3 3HG1 ILE 3 -10.675 2.577 -0.412
22 1HG2 ILE 3 1HG2 ILE 3 -10.094 3.439 2.205
23 2HG2 ILE 3 2HG2 ILE 3 -8.472 4.056 1.935
24 3HG2 ILE 3 3HG2 ILE 3 -9.788 5.185 2.324
25 1HD1 ILE 3 1HD1 ILE 3 -9.143 2.164 -2.254
26 2HD1 ILE 3 2HD1 ILE 3 -9.648 3.832 -2.451
27 3HD1 ILE 3 3HD1 ILE 3 -8.066 3.472 -1.736
28 H THR 4 H THR 4 -12.778 3.452 -1.161
29 HA THR 4 HA THR 4 -11.943 3.739 -3.804
30 HB THR 4 HB THR 4 -12.720 1.656 -2.683
31 HG1 THR 4 1HG THR 4 -14.113 2.878 -4.688
32 1HG2 THR 4 1HG2 THR 4 -15.487 2.974 -2.587
33 2HG2 THR 4 2HG2 THR 4 -15.084 1.307 -2.158
34 3HG2 THR 4 3HG2 THR 4 -14.515 2.634 -1.142
35 H ASP 5 H ASP 5 -13.925 5.671 -1.803
36 HA ASP 5 HA ASP 5 -15.388 6.909 -4.082
37 1HB ASP 5 2HB ASP 5 -16.663 5.316 -2.709
38 2HB ASP 5 3HB ASP 5 -16.221 6.235 -1.237
39 H VAL 6 H VAL 6 -12.844 7.331 -2.049
40 HA VAL 6 HA VAL 6 -13.455 10.134 -1.252
41 HB VAL 6 HB VAL 6 -11.060 8.321 -0.759
42 1HG1 VAL 6 1HG1 VAL 6 -10.207 10.601 -0.935
43 2HG1 VAL 6 2HG1 VAL 6 -11.521 11.207 0.097
44 3HG1 VAL 6 3HG1 VAL 6 -10.278 10.129 0.764
45 1HG2 VAL 6 1HG2 VAL 6 -11.797 8.419 1.573
46 2HG2 VAL 6 2HG2 VAL 6 -13.120 9.525 1.144
47 3HG2 VAL 6 3HG2 VAL 6 -13.144 7.850 0.575
48 H LEU 7 H LEU 7 -10.914 8.390 -3.085
49 HA LEU 7 HA LEU 7 -10.799 10.313 -5.249
50 1HB LEU 7 2HB LEU 7 -9.725 11.746 -3.595
51 2HB LEU 7 3HB LEU 7 -8.700 10.430 -3.045
52 HG LEU 7 HG LEU 7 -8.153 10.675 -5.843
53 1HD1 LEU 7 1HD1 LEU 7 -8.177 13.403 -4.506
54 2HD1 LEU 7 2HD1 LEU 7 -7.498 12.997 -6.096
55 3HD1 LEU 7 3HD1 LEU 7 -9.246 12.876 -5.829
56 1HD2 LEU 7 1HD2 LEU 7 -5.940 11.358 -5.069
57 2HD2 LEU 7 2HD2 LEU 7 -6.580 11.706 -3.446
58 3HD2 LEU 7 3HD2 LEU 7 -6.555 10.038 -4.066
59 H SER 8 H SER 8 -8.619 8.264 -3.307
60 HA SER 8 HA SER 8 -6.883 7.346 -4.979
61 1HB SER 8 2HB SER 8 -8.238 5.661 -2.884
62 2HB SER 8 3HB SER 8 -6.610 5.394 -3.557
63 HG SER 8 HG SER 8 -6.001 7.407 -2.764
64 H ALA 9 H ALA 9 -10.204 6.240 -5.312
65 HA ALA 9 HA ALA 9 -9.874 3.834 -6.763
66 1HB ALA 9 1HB ALA 9 -11.880 6.095 -7.112
67 2HB ALA 9 2HB ALA 9 -12.032 4.462 -7.804
68 3HB ALA 9 3HB ALA 9 -12.032 4.680 -6.045
69 H ASP 10 H ASP 10 -9.696 7.271 -7.865
70 HA ASP 10 HA ASP 10 -9.393 6.582 -10.666
71 1HB ASP 10 2HB ASP 10 -10.178 8.797 -9.782
72 2HB ASP 10 3HB ASP 10 -8.531 9.114 -9.202
73 H ASP 11 H ASP 11 -7.201 7.237 -7.947
74 HA ASP 11 HA ASP 11 -4.809 7.396 -9.438
75 1HB ASP 11 2HB ASP 11 -5.165 6.688 -6.497
76 2HB ASP 11 3HB ASP 11 -3.764 7.407 -7.299
77 H ILE 12 H ILE 12 -6.327 4.674 -7.572
78 HA ILE 12 HA ILE 12 -4.287 2.832 -8.143
79 HB ILE 12 HB ILE 12 -5.816 1.138 -7.617
80 1HG1 ILE 12 2HG1 ILE 12 -7.951 3.180 -7.342
81 2HG1 ILE 12 3HG1 ILE 12 -7.906 1.879 -8.536
82 1HG2 ILE 12 1HG2 ILE 12 -6.029 1.638 -5.265
83 2HG2 ILE 12 2HG2 ILE 12 -4.550 2.372 -5.877
84 3HG2 ILE 12 3HG2 ILE 12 -5.975 3.382 -5.580
85 1HD1 ILE 12 1HD1 ILE 12 -9.433 1.213 -6.832
86 2HD1 ILE 12 2HD1 ILE 12 -7.975 0.226 -6.631
87 3HD1 ILE 12 3HD1 ILE 12 -8.292 1.596 -5.535
88 H ALA 13 H ALA 13 -7.195 3.778 -10.015
89 HA ALA 13 HA ALA 13 -6.946 1.826 -12.042
90 1HB ALA 13 1HB ALA 13 -8.190 3.286 -13.473
91 2HB ALA 13 2HB ALA 13 -8.849 3.420 -11.830
92 3HB ALA 13 3HB ALA 13 -7.814 4.703 -12.493
93 H ALA 14 H ALA 14 -5.254 4.997 -11.697
94 HA ALA 14 HA ALA 14 -3.661 4.721 -14.064
95 1HB ALA 14 1HB ALA 14 -2.183 6.376 -13.087
96 2HB ALA 14 2HB ALA 14 -3.876 6.849 -12.834
97 3HB ALA 14 3HB ALA 14 -2.920 6.184 -11.494
98 H ALA 15 H ALA 15 -2.833 3.965 -10.647
99 HA ALA 15 HA ALA 15 -0.344 2.854 -10.903
100 1HB ALA 15 1HB ALA 15 -2.466 1.709 -9.076
101 2HB ALA 15 2HB ALA 15 -0.707 1.732 -8.850
102 3HB ALA 15 3HB ALA 15 -1.627 3.244 -8.777
103 H LEU 16 H LEU 16 -3.437 1.324 -11.432
104 HA LEU 16 HA LEU 16 -2.647 -1.367 -11.718
105 1HB LEU 16 2HB LEU 16 -4.860 -1.070 -11.214
106 2HB LEU 16 3HB LEU 16 -5.105 0.238 -12.355
107 HG LEU 16 HG LEU 16 -4.574 -2.462 -13.548
108 1HD1 LEU 16 1HD1 LEU 16 -6.972 -3.028 -13.364
109 2HD1 LEU 16 2HD1 LEU 16 -6.166 -3.022 -11.785
110 3HD1 LEU 16 3HD1 LEU 16 -7.209 -1.662 -12.254
111 1HD2 LEU 16 1HD2 LEU 16 -6.618 -0.274 -14.191
112 2HD2 LEU 16 2HD2 LEU 16 -4.991 -0.277 -14.864
113 3HD2 LEU 16 3HD2 LEU 16 -6.100 -1.604 -15.245
114 H GLN 17 H GLN 17 -2.700 1.319 -14.025
115 HA GLN 17 HA GLN 17 -2.288 -0.554 -16.300
116 1HB GLN 17 2HB GLN 17 -3.522 2.079 -15.979
117 2HB GLN 17 3HB GLN 17 -2.316 2.075 -17.274
118 1HG GLN 17 2HG GLN 17 -3.362 0.262 -18.418
119 2HG GLN 17 3HG GLN 17 -4.386 -0.135 -17.035
120 1HE2 GLN 17 1HE2 GLN 17 -6.483 0.286 -17.562
121 2HE2 GLN 17 2HE2 GLN 17 -7.015 1.747 -18.375
122 H GLU 18 H GLU 18 -0.708 2.128 -14.552
123 HA GLU 18 HA GLU 18 1.533 2.129 -16.339
124 1HB GLU 18 2HB GLU 18 2.414 3.812 -14.973
125 2HB GLU 18 3HB GLU 18 0.644 4.000 -14.923
126 1HG GLU 18 2HG GLU 18 0.623 2.808 -12.760
127 2HG GLU 18 3HG GLU 18 2.395 2.851 -12.744
128 H CYS 19 H CYS 19 0.838 0.368 -13.314
129 HA CYS 19 HA CYS 19 3.431 -1.120 -13.609
130 1HB CYS 19 2HB CYS 19 1.530 -0.973 -11.230
131 2HB CYS 19 3HB CYS 19 3.092 -1.802 -11.304
132 HG CYS 19 HG CYS 19 4.466 0.368 -11.848
133 H ARG 20 H ARG 20 1.896 -1.897 -15.599
134 HA ARG 20 HA ARG 20 -0.406 -3.461 -14.876
135 1HB ARG 20 2HB ARG 20 0.609 -2.314 -17.239
136 2HB ARG 20 3HB ARG 20 0.739 -4.031 -17.555
137 1HG ARG 20 2HG ARG 20 -1.781 -2.638 -16.584
138 2HG ARG 20 3HG ARG 20 -1.427 -2.955 -18.282
139 1HD ARG 20 2HD ARG 20 -1.698 -5.074 -16.102
140 2HD ARG 20 3HD ARG 20 -2.975 -4.593 -17.239
141 HE ARG 20 HE ARG 20 -0.687 -5.277 -18.761
142 1HH1 ARG 20 2HH2 ARG 20 -2.934 -6.860 -16.584
143 2HH1 ARG 20 1HH2 ARG 20 -2.952 -8.387 -17.411
144 1HH2 ARG 20 2HH1 ARG 20 -0.613 -7.300 -19.882
145 2HH2 ARG 20 1HH1 ARG 20 -1.602 -8.627 -19.368
146 H ASP 21 H ASP 21 2.779 -4.254 -16.166
147 HA ASP 21 HA ASP 21 2.502 -7.117 -15.902
148 1HB ASP 21 2HB ASP 21 4.602 -5.094 -16.725
149 2HB ASP 21 3HB ASP 21 5.176 -6.621 -16.135
150 HA PRO 22 HA PRO 22 2.697 -7.481 -11.682
151 1HB PRO 22 2HB PRO 22 4.335 -9.703 -11.214
152 2HB PRO 22 3HB PRO 22 2.655 -9.768 -11.827
153 1HG PRO 22 2HG PRO 22 5.215 -9.864 -13.428
154 2HG PRO 22 3HG PRO 22 3.777 -10.906 -13.583
155 1HD PRO 22 2HD PRO 22 4.160 -8.814 -15.241
156 2HD PRO 22 3HD PRO 22 2.519 -9.141 -14.602
157 H ASP 23 H ASP 23 6.133 -8.339 -12.340
158 HA ASP 23 HA ASP 23 6.816 -6.664 -10.136
159 1HB ASP 23 2HB ASP 23 9.174 -7.408 -10.727
160 2HB ASP 23 3HB ASP 23 8.021 -8.725 -10.483
161 H THR 24 H THR 24 5.554 -4.924 -11.775
162 HA THR 24 HA THR 24 7.764 -3.140 -12.764
163 HB THR 24 HB THR 24 4.937 -3.056 -13.852
164 HG1 THR 24 1HG THR 24 5.622 -5.063 -14.287
165 1HG2 THR 24 1HG2 THR 24 6.125 -2.137 -15.860
166 2HG2 THR 24 2HG2 THR 24 6.299 -1.096 -14.444
167 3HG2 THR 24 3HG2 THR 24 7.642 -2.147 -14.942
168 H PHE 25 H PHE 25 6.595 -3.472 -10.078
169 HA PHE 25 HA PHE 25 5.225 -0.842 -9.668
170 1HB PHE 25 2HB PHE 25 3.925 -2.712 -9.004
171 2HB PHE 25 3HB PHE 25 5.270 -3.415 -8.095
172 HD1 PHE 25 1HD PHE 25 6.196 -2.124 -6.064
173 HD2 PHE 25 2HD PHE 25 2.266 -1.628 -7.756
174 HE1 PHE 25 1HE PHE 25 5.377 -1.271 -3.900
175 HE2 PHE 25 2HE PHE 25 1.423 -0.914 -5.548
176 HZ PHE 25 HZ PHE 25 2.978 -0.642 -3.647
177 H GLU 26 H GLU 26 6.195 0.622 -8.433
178 HA GLU 26 HA GLU 26 8.559 -0.122 -6.836
179 1HB GLU 26 2HB GLU 26 8.282 2.055 -8.883
180 2HB GLU 26 3HB GLU 26 9.076 2.503 -7.366
181 1HG GLU 26 2HG GLU 26 9.910 0.040 -8.942
182 2HG GLU 26 3HG GLU 26 10.613 1.646 -9.207
183 HA PRO 27 HA PRO 27 5.910 1.415 -3.685
184 1HB PRO 27 2HB PRO 27 7.797 2.214 -1.779
185 2HB PRO 27 3HB PRO 27 7.225 0.551 -2.066
186 1HG PRO 27 2HG PRO 27 9.778 1.834 -2.976
187 2HG PRO 27 3HG PRO 27 9.465 0.121 -2.538
188 1HD PRO 27 2HD PRO 27 9.692 1.011 -5.090
189 2HD PRO 27 3HD PRO 27 8.750 -0.428 -4.606
190 H GLN 28 H GLN 28 8.771 3.606 -3.946
191 HA GLN 28 HA GLN 28 7.513 5.975 -3.123
192 1HB GLN 28 2HB GLN 28 9.815 5.511 -5.036
193 2HB GLN 28 3HB GLN 28 9.322 7.116 -4.464
194 1HG GLN 28 2HG GLN 28 9.721 6.546 -2.159
195 2HG GLN 28 3HG GLN 28 10.026 4.849 -2.545
196 1HE2 GLN 28 1HE2 GLN 28 11.901 4.470 -4.204
197 2HE2 GLN 28 2HE2 GLN 28 13.307 5.478 -3.927
198 H LYS 29 H LYS 29 7.913 4.765 -6.426
199 HA LYS 29 HA LYS 29 6.420 6.590 -7.928
200 1HB LYS 29 2HB LYS 29 7.747 4.610 -8.743
201 2HB LYS 29 3HB LYS 29 6.504 3.551 -8.128
202 1HG LYS 29 2HG LYS 29 6.021 3.575 -10.325
203 2HG LYS 29 3HG LYS 29 4.860 4.775 -9.748
204 1HD LYS 29 2HD LYS 29 6.349 6.603 -10.531
205 2HD LYS 29 3HD LYS 29 7.644 5.440 -10.826
206 1HE LYS 29 2HE LYS 29 6.951 5.662 -12.970
207 2HE LYS 29 3HE LYS 29 5.938 4.297 -12.501
208 1HZ LYS 29 1HZ LYS 29 5.045 7.125 -12.535
209 2HZ LYS 29 2HZ LYS 29 4.710 5.987 -13.673
210 3HZ LYS 29 3HZ LYS 29 4.084 5.818 -12.233
211 H PHE 30 H PHE 30 5.204 3.523 -6.490
212 HA PHE 30 HA PHE 30 2.511 3.860 -7.007
213 1HB PHE 30 2HB PHE 30 3.346 1.736 -6.370
214 2HB PHE 30 3HB PHE 30 3.974 2.343 -4.848
215 HD1 PHE 30 1HD PHE 30 0.758 1.751 -6.682
216 HD2 PHE 30 2HD PHE 30 2.692 2.355 -2.879
217 HE1 PHE 30 1HE PHE 30 -1.355 1.188 -5.519
218 HE2 PHE 30 2HE PHE 30 0.571 1.855 -1.716
219 HZ PHE 30 HZ PHE 30 -1.448 1.223 -3.017
220 H PHE 31 H PHE 31 4.253 5.022 -4.028
221 HA PHE 31 HA PHE 31 1.925 5.770 -2.627
222 1HB PHE 31 2HB PHE 31 4.537 7.319 -2.630
223 2HB PHE 31 3HB PHE 31 3.326 7.284 -1.354
224 HD1 PHE 31 1HD PHE 31 6.367 6.689 -1.256
225 HD2 PHE 31 2HD PHE 31 2.831 4.233 -1.257
226 HE1 PHE 31 1HE PHE 31 7.683 4.798 -0.388
227 HE2 PHE 31 2HE PHE 31 4.092 2.433 -0.123
228 HZ PHE 31 HZ PHE 31 6.525 2.683 0.293
229 H GLN 32 H GLN 32 3.813 7.668 -5.008
230 HA GLN 32 HA GLN 32 2.025 9.948 -4.781
231 1HB GLN 32 2HB GLN 32 4.490 9.923 -5.501
232 2HB GLN 32 3HB GLN 32 3.909 9.391 -7.090
233 1HG GLN 32 2HG GLN 32 2.590 11.461 -7.309
234 2HG GLN 32 3HG GLN 32 2.902 11.881 -5.617
235 1HE2 GLN 32 1HE2 GLN 32 5.261 10.718 -8.100
236 2HE2 GLN 32 2HE2 GLN 32 6.256 12.161 -7.982
237 H THR 33 H THR 33 2.382 7.197 -7.069
238 HA THR 33 HA THR 33 0.468 8.088 -8.907
239 HB THR 33 HB THR 33 2.285 5.844 -8.488
240 HG1 THR 33 1HG THR 33 0.848 6.411 -10.733
241 1HG2 THR 33 1HG2 THR 33 1.171 4.093 -9.647
242 2HG2 THR 33 2HG2 THR 33 0.360 4.381 -8.101
243 3HG2 THR 33 3HG2 THR 33 -0.368 4.978 -9.621
244 H SER 34 H SER 34 0.124 6.233 -5.982
245 HA SER 34 HA SER 34 -2.639 5.488 -6.507
246 1HB SER 34 2HB SER 34 -0.918 4.069 -5.345
247 2HB SER 34 3HB SER 34 -0.970 5.192 -3.979
248 HG SER 34 HG SER 34 -2.345 3.342 -3.757
249 H GLY 35 H GLY 35 -1.096 8.343 -5.670
250 1HA GLY 35 1HA GLY 35 -1.978 10.355 -4.950
251 2HA GLY 35 2HA GLY 35 -3.534 9.573 -4.638
252 H LEU 36 H LEU 36 -1.672 7.575 -3.033
253 HA LEU 36 HA LEU 36 -2.423 8.310 -0.481
254 1HB LEU 36 2HB LEU 36 -0.387 6.433 -1.709
255 2HB LEU 36 3HB LEU 36 -0.507 6.571 0.020
256 HG LEU 36 HG LEU 36 -2.867 5.852 -1.767
257 1HD1 LEU 36 1HD1 LEU 36 -1.089 4.121 -1.840
258 2HD1 LEU 36 2HD1 LEU 36 -1.084 4.051 -0.067
259 3HD1 LEU 36 3HD1 LEU 36 -2.524 3.543 -0.977
260 1HD2 LEU 36 1HD2 LEU 36 -3.633 6.761 0.400
261 2HD2 LEU 36 2HD2 LEU 36 -3.859 5.017 0.383
262 3HD2 LEU 36 3HD2 LEU 36 -2.488 5.717 1.266
263 H SER 37 H SER 37 0.594 9.160 -2.192
264 HA SER 37 HA SER 37 1.815 10.368 0.162
265 1HB SER 37 2HB SER 37 3.172 9.702 -1.807
266 2HB SER 37 3HB SER 37 2.286 10.882 -2.804
267 HG SER 37 HG SER 37 4.438 11.262 -1.329
268 H LYS 38 H LYS 38 -0.665 11.423 -2.081
269 HA LYS 38 HA LYS 38 -0.204 14.263 -1.499
270 1HB LYS 38 2HB LYS 38 -1.267 13.016 -3.688
271 2HB LYS 38 3HB LYS 38 -2.744 13.329 -2.789
272 1HG LYS 38 2HG LYS 38 -2.084 15.711 -2.540
273 2HG LYS 38 3HG LYS 38 -0.621 15.419 -3.495
274 1HD LYS 38 2HD LYS 38 -1.733 15.299 -5.489
275 2HD LYS 38 3HD LYS 38 -3.164 14.527 -4.783
276 1HE LYS 38 2HE LYS 38 -3.880 16.664 -3.775
277 2HE LYS 38 3HE LYS 38 -2.453 17.484 -4.435
278 1HZ LYS 38 1HZ LYS 38 -4.569 16.197 -6.041
279 2HZ LYS 38 2HZ LYS 38 -4.439 17.812 -5.759
280 3HZ LYS 38 3HZ LYS 38 -3.281 17.036 -6.632
281 H MET 39 H MET 39 -2.240 11.490 -0.639
282 HA MET 39 HA MET 39 -4.062 12.883 0.997
283 1HB MET 39 2HB MET 39 -2.979 10.050 0.950
284 2HB MET 39 3HB MET 39 -3.941 10.573 2.308
285 1HG MET 39 2HG MET 39 -5.768 11.245 0.773
286 2HG MET 39 3HG MET 39 -4.823 10.634 -0.599
287 1HE MET 39 1HE MET 39 -7.128 9.360 -1.154
288 2HE MET 39 2HE MET 39 -7.866 8.145 -0.078
289 3HE MET 39 3HE MET 39 -7.882 9.866 0.379
290 H SER 40 H SER 40 -3.692 14.049 2.894
291 HA SER 40 HA SER 40 -1.142 14.256 4.072
292 1HB SER 40 2HB SER 40 -3.833 14.810 5.389
293 2HB SER 40 3HB SER 40 -2.283 15.600 5.735
294 HG SER 40 HG SER 40 -2.367 16.326 3.486
295 H ALA 41 H ALA 41 -0.501 13.652 6.239
296 HA ALA 41 HA ALA 41 -0.459 11.064 6.988
297 1HB ALA 41 1HB ALA 41 0.020 11.876 9.300
298 2HB ALA 41 2HB ALA 41 0.890 12.794 8.055
299 3HB ALA 41 3HB ALA 41 -0.550 13.488 8.835
300 H ASN 42 H ASN 42 -3.018 13.359 7.914
301 HA ASN 42 HA ASN 42 -4.544 11.810 9.688
302 1HB ASN 42 2HB ASN 42 -5.628 13.610 7.470
303 2HB ASN 42 3HB ASN 42 -6.483 13.108 8.933
304 1HD2 ASN 42 1HD2 ASN 42 -5.330 15.812 7.706
305 2HD2 ASN 42 2HD2 ASN 42 -4.566 16.528 9.110
306 H GLN 43 H GLN 43 -4.827 11.952 6.112
307 HA GLN 43 HA GLN 43 -6.845 9.877 6.006
308 1HB GLN 43 2HB GLN 43 -5.304 11.536 4.033
309 2HB GLN 43 3HB GLN 43 -5.915 9.979 3.470
310 1HG GLN 43 2HG GLN 43 -7.713 11.986 4.873
311 2HG GLN 43 3HG GLN 43 -7.429 11.998 3.122
312 1HE2 GLN 43 1HE2 GLN 43 -9.969 11.720 3.434
313 2HE2 GLN 43 2HE2 GLN 43 -10.487 10.045 3.376
314 H VAL 44 H VAL 44 -3.219 9.977 5.458
315 HA VAL 44 HA VAL 44 -3.117 7.312 4.548
316 HB VAL 44 HB VAL 44 -1.032 9.000 5.969
317 1HG1 VAL 44 1HG1 VAL 44 -0.773 6.445 4.318
318 2HG1 VAL 44 2HG1 VAL 44 0.578 7.500 4.769
319 3HG1 VAL 44 3HG1 VAL 44 -0.325 6.643 6.031
320 1HG2 VAL 44 1HG2 VAL 44 -0.256 9.457 3.665
321 2HG2 VAL 44 2HG2 VAL 44 -1.552 8.434 3.007
322 3HG2 VAL 44 3HG2 VAL 44 -1.940 9.952 3.822
323 H LYS 45 H LYS 45 -3.057 8.610 7.904
324 HA LYS 45 HA LYS 45 -2.682 6.092 9.207
325 1HB LYS 45 2HB LYS 45 -2.365 8.276 10.291
326 2HB LYS 45 3HB LYS 45 -4.096 8.592 10.146
327 1HG LYS 45 2HG LYS 45 -3.888 6.034 11.418
328 2HG LYS 45 3HG LYS 45 -2.633 7.017 12.157
329 1HD LYS 45 2HD LYS 45 -5.544 7.896 11.803
330 2HD LYS 45 3HD LYS 45 -4.936 7.094 13.262
331 1HE LYS 45 2HE LYS 45 -3.392 8.896 13.748
332 2HE LYS 45 3HE LYS 45 -3.693 9.672 12.188
333 1HZ LYS 45 1HZ LYS 45 -5.935 10.094 12.853
334 2HZ LYS 45 2HZ LYS 45 -5.696 9.381 14.318
335 3HZ LYS 45 3HZ LYS 45 -4.880 10.757 13.933
336 H ASP 46 H ASP 46 -5.668 7.961 8.329
337 HA ASP 46 HA ASP 46 -7.479 6.121 9.484
338 1HB ASP 46 2HB ASP 46 -7.903 8.027 7.151
339 2HB ASP 46 3HB ASP 46 -9.180 7.219 8.064
340 H VAL 47 H VAL 47 -6.398 6.344 6.055
341 HA VAL 47 HA VAL 47 -7.721 3.968 5.232
342 HB VAL 47 HB VAL 47 -6.402 3.968 3.261
343 1HG1 VAL 47 1HG1 VAL 47 -6.753 6.912 3.870
344 2HG1 VAL 47 2HG1 VAL 47 -7.005 6.053 2.353
345 3HG1 VAL 47 3HG1 VAL 47 -8.139 5.835 3.707
346 1HG2 VAL 47 1HG2 VAL 47 -4.548 5.804 4.657
347 2HG2 VAL 47 2HG2 VAL 47 -4.163 4.231 3.936
348 3HG2 VAL 47 3HG2 VAL 47 -4.557 5.613 2.894
349 H PHE 48 H PHE 48 -4.353 4.431 6.510
350 HA PHE 48 HA PHE 48 -3.443 1.799 6.507
351 1HB PHE 48 2HB PHE 48 -1.986 3.460 7.217
352 2HB PHE 48 3HB PHE 48 -3.055 4.016 8.478
353 HD1 PHE 48 1HD PHE 48 -3.406 2.767 10.576
354 HD2 PHE 48 2HD PHE 48 -0.479 1.566 7.644
355 HE1 PHE 48 1HE PHE 48 -2.491 1.103 12.170
356 HE2 PHE 48 2HE PHE 48 0.614 0.145 9.347
357 HZ PHE 48 HZ PHE 48 -0.484 -0.233 11.551
358 H ARG 49 H ARG 49 -5.640 3.276 8.987
359 HA ARG 49 HA ARG 49 -5.933 0.816 10.440
360 1HB ARG 49 2HB ARG 49 -7.686 3.294 10.279
361 2HB ARG 49 3HB ARG 49 -8.109 1.866 11.238
362 1HG ARG 49 2HG ARG 49 -5.929 1.997 12.419
363 2HG ARG 49 3HG ARG 49 -5.562 3.502 11.550
364 1HD ARG 49 2HD ARG 49 -7.436 4.632 12.553
365 2HD ARG 49 3HD ARG 49 -8.086 3.149 13.243
366 HE ARG 49 HE ARG 49 -5.866 4.787 14.225
367 1HH1 ARG 49 2HH2 ARG 49 -7.414 1.527 14.508
368 2HH1 ARG 49 1HH2 ARG 49 -6.774 1.266 16.070
369 1HH2 ARG 49 2HH1 ARG 49 -4.981 4.316 16.292
370 2HH2 ARG 49 1HH1 ARG 49 -5.357 2.824 17.085
371 H PHE 50 H PHE 50 -7.629 2.000 7.509
372 HA PHE 50 HA PHE 50 -9.592 -0.134 7.588
373 1HB PHE 50 2HB PHE 50 -9.786 2.039 6.304
374 2HB PHE 50 3HB PHE 50 -8.591 1.413 5.174
375 HD1 PHE 50 1HD PHE 50 -11.805 0.251 6.802
376 HD2 PHE 50 2HD PHE 50 -9.511 0.600 3.162
377 HE1 PHE 50 1HE PHE 50 -13.667 -0.762 5.527
378 HE2 PHE 50 2HE PHE 50 -11.410 -0.363 1.883
379 HZ PHE 50 HZ PHE 50 -13.469 -1.082 3.064
380 H ILE 51 H ILE 51 -6.248 0.227 6.403
381 HA ILE 51 HA ILE 51 -6.217 -2.267 4.980
382 HB ILE 51 HB ILE 51 -3.786 -0.945 6.212
383 1HG1 ILE 51 2HG1 ILE 51 -4.635 0.794 4.859
384 2HG1 ILE 51 3HG1 ILE 51 -3.374 0.014 3.944
385 1HG2 ILE 51 1HG2 ILE 51 -3.509 -3.283 5.427
386 2HG2 ILE 51 2HG2 ILE 51 -4.159 -2.835 3.851
387 3HG2 ILE 51 3HG2 ILE 51 -2.625 -2.129 4.426
388 1HD1 ILE 51 1HD1 ILE 51 -5.243 0.577 2.539
389 2HD1 ILE 51 2HD1 ILE 51 -5.115 -1.187 2.595
390 3HD1 ILE 51 3HD1 ILE 51 -6.378 -0.349 3.535
391 H ASP 52 H ASP 52 -4.920 -1.464 8.298
392 HA ASP 52 HA ASP 52 -4.251 -4.254 8.680
393 1HB ASP 52 2HB ASP 52 -3.075 -2.224 9.805
394 2HB ASP 52 3HB ASP 52 -4.336 -2.324 11.036
395 H ASN 53 H ASN 53 -6.369 -4.961 8.076
396 HA ASN 53 HA ASN 53 -8.774 -4.450 9.356
397 1HB ASN 53 2HB ASN 53 -8.523 -5.505 7.190
398 2HB ASN 53 3HB ASN 53 -7.799 -6.949 7.910
399 1HD2 ASN 53 1HD2 ASN 53 -9.169 -8.578 8.720
400 2HD2 ASN 53 2HD2 ASN 53 -10.917 -8.433 8.680
401 H ASP 54 H ASP 54 -6.219 -6.692 10.336
402 HA ASP 54 HA ASP 54 -7.788 -8.088 12.353
403 1HB ASP 54 2HB ASP 54 -5.642 -9.117 12.855
404 2HB ASP 54 3HB ASP 54 -5.905 -9.141 11.104
405 H GLN 55 H GLN 55 -6.041 -5.090 12.061
406 HA GLN 55 HA GLN 55 -5.236 -3.567 13.446
407 1HB GLN 55 2HB GLN 55 -7.944 -4.240 14.529
408 2HB GLN 55 3HB GLN 55 -6.924 -3.197 15.529
409 1HG GLN 55 2HG GLN 55 -6.503 -1.735 13.515
410 2HG GLN 55 3HG GLN 55 -7.764 -2.645 12.665
411 1HE2 GLN 55 1HE2 GLN 55 -9.734 -2.962 14.548
412 2HE2 GLN 55 2HE2 GLN 55 -10.319 -1.392 15.068
413 H SER 56 H SER 56 -3.494 -5.149 13.679
414 HA SER 56 HA SER 56 -2.995 -5.794 16.583
415 1HB SER 56 2HB SER 56 -0.761 -6.657 15.506
416 2HB SER 56 3HB SER 56 -2.230 -7.640 15.473
417 HG SER 56 HG SER 56 -2.374 -7.497 13.501
418 H GLY 57 H GLY 57 -1.996 -3.830 13.776
419 1HA GLY 57 1HA GLY 57 -0.892 -1.709 14.003
420 2HA GLY 57 2HA GLY 57 -0.262 -2.162 15.588
421 H TYR 58 H TYR 58 -0.124 -4.617 13.105
422 HA TYR 58 HA TYR 58 2.408 -3.627 12.015
423 1HB TYR 58 2HB TYR 58 2.037 -6.408 13.180
424 2HB TYR 58 3HB TYR 58 3.237 -6.042 11.951
425 HD1 TYR 58 HD1 TYR 58 3.001 -6.573 15.328
426 HD2 TYR 58 HD2 TYR 58 4.693 -3.786 12.506
427 HE1 TYR 58 HE1 TYR 58 4.839 -6.092 16.903
428 HE2 TYR 58 HE2 TYR 58 6.517 -3.282 14.100
429 HH TYR 58 HH TYR 58 6.771 -4.891 17.276
430 H LEU 59 H LEU 59 2.485 -3.828 9.917
431 HA LEU 59 HA LEU 59 0.409 -5.308 8.381
432 1HB LEU 59 2HB LEU 59 2.397 -3.100 7.844
433 2HB LEU 59 3HB LEU 59 1.959 -4.140 6.493
434 HG LEU 59 HG LEU 59 0.676 -2.062 6.625
435 1HD1 LEU 59 1HD1 LEU 59 -0.158 -4.186 5.503
436 2HD1 LEU 59 2HD1 LEU 59 -1.144 -4.477 6.960
437 3HD1 LEU 59 3HD1 LEU 59 -1.381 -3.011 6.010
438 1HD2 LEU 59 1HD2 LEU 59 -1.057 -1.723 8.261
439 2HD2 LEU 59 2HD2 LEU 59 -0.756 -3.300 9.007
440 3HD2 LEU 59 3HD2 LEU 59 0.460 -2.035 9.151
441 H ASP 60 H ASP 60 1.436 -7.261 9.525
442 HA ASP 60 HA ASP 60 3.936 -8.227 8.721
443 1HB ASP 60 2HB ASP 60 1.444 -9.876 9.299
444 2HB ASP 60 3HB ASP 60 3.138 -10.344 9.551
445 H GLU 61 H GLU 61 4.276 -10.184 7.315
446 HA GLU 61 HA GLU 61 3.936 -9.602 4.671
447 1HB GLU 61 2HB GLU 61 5.347 -11.413 6.035
448 2HB GLU 61 3HB GLU 61 4.115 -12.515 5.448
449 1HG GLU 61 2HG GLU 61 5.374 -10.591 3.454
450 2HG GLU 61 3HG GLU 61 6.387 -11.824 4.169
451 H GLU 62 H GLU 62 1.919 -11.814 6.599
452 HA GLU 62 HA GLU 62 0.255 -12.416 4.355
453 1HB GLU 62 2HB GLU 62 0.799 -13.753 6.668
454 2HB GLU 62 3HB GLU 62 -0.745 -13.025 7.150
455 1HG GLU 62 2HG GLU 62 -1.813 -13.997 5.164
456 2HG GLU 62 3HG GLU 62 -0.204 -14.536 4.580
457 H GLU 63 H GLU 63 0.237 -9.731 6.500
458 HA GLU 63 HA GLU 63 -2.542 -8.977 5.928
459 1HB GLU 63 2HB GLU 63 -0.357 -7.899 7.552
460 2HB GLU 63 3HB GLU 63 -0.910 -6.680 6.400
461 1HG GLU 63 2HG GLU 63 -2.261 -6.383 8.283
462 2HG GLU 63 3HG GLU 63 -3.307 -7.243 7.166
463 H LEU 64 H LEU 64 0.749 -8.240 4.820
464 HA LEU 64 HA LEU 64 0.153 -6.506 2.723
465 1HB LEU 64 2HB LEU 64 2.448 -7.925 3.645
466 2HB LEU 64 3HB LEU 64 2.269 -8.388 1.962
467 HG LEU 64 HG LEU 64 3.727 -6.525 2.106
468 1HD1 LEU 64 1HD1 LEU 64 1.180 -5.174 1.173
469 2HD1 LEU 64 2HD1 LEU 64 2.829 -5.067 0.532
470 3HD1 LEU 64 3HD1 LEU 64 1.887 -6.532 0.286
471 1HD2 LEU 64 1HD2 LEU 64 1.577 -4.946 3.589
472 2HD2 LEU 64 2HD2 LEU 64 2.988 -5.709 4.344
473 3HD2 LEU 64 3HD2 LEU 64 3.211 -4.403 3.168
474 H LYS 65 H LYS 65 0.154 -10.052 2.726
475 HA LYS 65 HA LYS 65 -0.510 -10.558 0.082
476 1HB LYS 65 2HB LYS 65 0.118 -12.171 1.902
477 2HB LYS 65 3HB LYS 65 -1.565 -12.119 2.454
478 1HG LYS 65 2HG LYS 65 -2.332 -13.136 0.364
479 2HG LYS 65 3HG LYS 65 -0.746 -12.879 -0.377
480 1HD LYS 65 2HD LYS 65 -0.878 -15.198 0.159
481 2HD LYS 65 3HD LYS 65 0.259 -14.449 1.294
482 1HE LYS 65 2HE LYS 65 -1.718 -14.288 2.935
483 2HE LYS 65 3HE LYS 65 -2.647 -15.291 1.833
484 1HZ LYS 65 1HZ LYS 65 -0.064 -16.103 3.012
485 2HZ LYS 65 2HZ LYS 65 -1.468 -16.459 3.699
486 3HZ LYS 65 3HZ LYS 65 -1.125 -17.078 2.211
487 H PHE 66 H PHE 66 -2.621 -8.763 2.183
488 HA PHE 66 HA PHE 66 -4.573 -8.909 -0.041
489 1HB PHE 66 2HB PHE 66 -6.468 -8.863 1.498
490 2HB PHE 66 3HB PHE 66 -5.535 -10.334 1.618
491 HD1 PHE 66 1HD PHE 66 -4.557 -11.023 3.719
492 HD2 PHE 66 2HD PHE 66 -6.104 -7.011 3.343
493 HE1 PHE 66 1HE PHE 66 -4.557 -10.771 6.182
494 HE2 PHE 66 2HE PHE 66 -5.965 -6.744 5.794
495 HZ PHE 66 HZ PHE 66 -5.332 -8.677 7.223
496 H PHE 67 H PHE 67 -2.412 -6.949 0.950
497 HA PHE 67 HA PHE 67 -3.334 -4.787 2.321
498 1HB PHE 67 2HB PHE 67 -1.117 -4.738 1.884
499 2HB PHE 67 3HB PHE 67 -1.282 -5.168 0.198
500 HD1 PHE 67 1HD PHE 67 -0.442 -3.545 -1.244
501 HD2 PHE 67 2HD PHE 67 -2.562 -2.295 2.274
502 HE1 PHE 67 1HE PHE 67 -0.011 -1.174 -1.824
503 HE2 PHE 67 2HE PHE 67 -2.184 0.077 1.679
504 HZ PHE 67 HZ PHE 67 -0.924 0.646 -0.380
505 H LEU 68 H LEU 68 -3.249 -4.403 -1.257
506 HA LEU 68 HA LEU 68 -5.270 -2.287 -1.169
507 1HB LEU 68 2HB LEU 68 -4.028 -3.871 -3.398
508 2HB LEU 68 3HB LEU 68 -5.174 -2.595 -3.704
509 HG LEU 68 HG LEU 68 -2.892 -1.741 -2.034
510 1HD1 LEU 68 1HD1 LEU 68 -1.714 -3.411 -3.420
511 2HD1 LEU 68 2HD1 LEU 68 -2.395 -2.691 -4.891
512 3HD1 LEU 68 3HD1 LEU 68 -1.241 -1.777 -3.896
513 1HD2 LEU 68 1HD2 LEU 68 -4.469 -0.689 -4.385
514 2HD2 LEU 68 2HD2 LEU 68 -3.973 0.095 -2.866
515 3HD2 LEU 68 3HD2 LEU 68 -2.826 -0.120 -4.186
516 H GLN 69 H GLN 69 -5.718 -5.605 -0.707
517 HA GLN 69 HA GLN 69 -7.799 -6.025 -2.665
518 1HB GLN 69 2HB GLN 69 -6.198 -7.666 -1.289
519 2HB GLN 69 3HB GLN 69 -7.613 -7.767 -0.234
520 1HG GLN 69 2HG GLN 69 -8.920 -8.708 -2.019
521 2HG GLN 69 3HG GLN 69 -7.784 -8.134 -3.256
522 1HE2 GLN 69 1HE2 GLN 69 -6.450 -9.626 -4.109
523 2HE2 GLN 69 2HE2 GLN 69 -5.829 -11.019 -3.251
524 H LYS 70 H LYS 70 -7.639 -4.505 0.433
525 HA LYS 70 HA LYS 70 -10.477 -4.454 1.039
526 1HB LYS 70 2HB LYS 70 -8.044 -2.797 1.793
527 2HB LYS 70 3HB LYS 70 -9.637 -2.070 1.938
528 1HG LYS 70 2HG LYS 70 -9.281 -2.933 4.041
529 2HG LYS 70 3HG LYS 70 -10.415 -4.030 3.283
530 1HD LYS 70 2HD LYS 70 -7.926 -5.214 2.670
531 2HD LYS 70 3HD LYS 70 -7.590 -4.403 4.195
532 1HE LYS 70 2HE LYS 70 -8.311 -6.574 4.830
533 2HE LYS 70 3HE LYS 70 -9.700 -5.525 5.143
534 1HZ LYS 70 1HZ LYS 70 -10.605 -6.267 3.016
535 2HZ LYS 70 2HZ LYS 70 -9.307 -7.249 2.780
536 3HZ LYS 70 3HZ LYS 70 -10.337 -7.537 4.028
537 H PHE 71 H PHE 71 -8.456 -2.890 -1.395
538 HA PHE 71 HA PHE 71 -10.498 -0.835 -1.976
539 1HB PHE 71 2HB PHE 71 -7.852 -1.320 -3.390
540 2HB PHE 71 3HB PHE 71 -8.905 0.067 -3.489
541 HD1 PHE 71 1HD PHE 71 -8.937 -0.380 -0.031
542 HD2 PHE 71 2HD PHE 71 -6.291 0.710 -3.250
543 HE1 PHE 71 1HE PHE 71 -7.472 0.770 1.563
544 HE2 PHE 71 2HE PHE 71 -4.937 2.051 -1.665
545 HZ PHE 71 HZ PHE 71 -5.512 2.071 0.747
546 H GLU 72 H GLU 72 -8.593 -3.291 -3.794
547 HA GLU 72 HA GLU 72 -10.840 -3.520 -5.760
548 1HB GLU 72 2HB GLU 72 -8.378 -2.457 -6.312
549 2HB GLU 72 3HB GLU 72 -8.037 -4.167 -6.582
550 1HG GLU 72 2HG GLU 72 -8.700 -3.529 -8.673
551 2HG GLU 72 3HG GLU 72 -10.253 -4.091 -8.039
552 H SER 73 H SER 73 -11.745 -5.552 -5.687
553 HA SER 73 HA SER 73 -10.948 -7.654 -4.043
554 1HB SER 73 2HB SER 73 -12.394 -9.009 -5.730
555 2HB SER 73 3HB SER 73 -13.143 -7.643 -4.885
556 HG SER 73 HG SER 73 -12.148 -7.646 -7.545
557 H GLY 74 H GLY 74 -9.802 -6.818 -7.228
558 1HA GLY 74 1HA GLY 74 -8.129 -9.308 -7.428
559 2HA GLY 74 2HA GLY 74 -8.799 -8.436 -8.812
560 H ALA 75 H ALA 75 -7.477 -6.809 -5.901
561 HA ALA 75 HA ALA 75 -5.455 -5.429 -7.409
562 1HB ALA 75 1HB ALA 75 -6.419 -4.634 -5.208
563 2HB ALA 75 2HB ALA 75 -5.511 -5.926 -4.408
564 3HB ALA 75 3HB ALA 75 -4.667 -4.641 -5.318
565 H ARG 76 H ARG 76 -3.043 -5.701 -6.188
566 HA ARG 76 HA ARG 76 -2.271 -8.004 -7.808
567 1HB ARG 76 2HB ARG 76 -1.332 -5.424 -7.733
568 2HB ARG 76 3HB ARG 76 -0.295 -6.124 -6.513
569 1HG ARG 76 2HG ARG 76 0.973 -6.717 -8.248
570 2HG ARG 76 3HG ARG 76 -0.069 -8.090 -8.351
571 1HD ARG 76 2HD ARG 76 -0.076 -7.314 -10.570
572 2HD ARG 76 3HD ARG 76 -1.618 -6.776 -9.962
573 HE ARG 76 HE ARG 76 0.884 -5.142 -10.401
574 1HH1 ARG 76 2HH2 ARG 76 -2.502 -4.979 -9.460
575 2HH1 ARG 76 1HH2 ARG 76 -2.623 -3.267 -9.753
576 1HH2 ARG 76 2HH1 ARG 76 0.654 -3.099 -11.110
577 2HH2 ARG 76 1HH1 ARG 76 -0.689 -2.102 -10.615
578 H GLU 77 H GLU 77 -2.839 -7.613 -4.621
579 HA GLU 77 HA GLU 77 -0.718 -8.107 -3.201
580 1HB GLU 77 2HB GLU 77 -3.200 -9.580 -2.347
581 2HB GLU 77 3HB GLU 77 -2.047 -8.605 -1.410
582 1HG GLU 77 2HG GLU 77 -4.287 -7.665 -3.229
583 2HG GLU 77 3HG GLU 77 -4.004 -7.282 -1.543
584 H LEU 78 H LEU 78 -2.265 -10.572 -5.016
585 HA LEU 78 HA LEU 78 -0.971 -12.903 -4.036
586 1HB LEU 78 2HB LEU 78 -1.766 -12.527 -6.937
587 2HB LEU 78 3HB LEU 78 -1.662 -14.002 -5.987
588 HG LEU 78 HG LEU 78 -3.892 -13.791 -6.089
589 1HD1 LEU 78 1HD1 LEU 78 -3.606 -11.961 -3.684
590 2HD1 LEU 78 2HD1 LEU 78 -4.903 -13.089 -4.072
591 3HD1 LEU 78 3HD1 LEU 78 -3.296 -13.711 -3.668
592 1HD2 LEU 78 1HD2 LEU 78 -4.155 -11.938 -7.466
593 2HD2 LEU 78 2HD2 LEU 78 -5.158 -11.595 -6.050
594 3HD2 LEU 78 3HD2 LEU 78 -3.599 -10.779 -6.264
595 H THR 79 H THR 79 0.107 -10.493 -6.494
596 HA THR 79 HA THR 79 2.443 -11.978 -7.330
597 HB THR 79 HB THR 79 1.869 -8.990 -7.461
598 HG1 THR 79 1HG THR 79 2.098 -10.063 -9.801
599 1HG2 THR 79 1HG2 THR 79 4.311 -9.522 -7.541
600 2HG2 THR 79 2HG2 THR 79 4.024 -10.645 -8.864
601 3HG2 THR 79 3HG2 THR 79 3.717 -8.900 -9.070
602 H GLU 80 H GLU 80 3.782 -12.601 -5.773
603 HA GLU 80 HA GLU 80 4.356 -11.235 -3.369
604 1HB GLU 80 2HB GLU 80 6.335 -12.615 -3.183
605 2HB GLU 80 3HB GLU 80 4.905 -13.553 -3.613
606 1HG GLU 80 2HG GLU 80 5.676 -13.685 -5.974
607 2HG GLU 80 3HG GLU 80 7.089 -12.687 -5.576
608 H SER 81 H SER 81 5.909 -10.873 -6.636
609 HA SER 81 HA SER 81 7.947 -9.212 -5.986
610 1HB SER 81 2HB SER 81 6.352 -8.477 -8.422
611 2HB SER 81 3HB SER 81 8.081 -8.769 -8.199
612 HG SER 81 HG SER 81 7.127 -10.509 -9.309
613 H GLU 82 H GLU 82 4.742 -7.742 -7.067
614 HA GLU 82 HA GLU 82 5.372 -5.175 -6.184
615 1HB GLU 82 2HB GLU 82 2.578 -6.416 -6.189
616 2HB GLU 82 3HB GLU 82 3.023 -4.711 -6.112
617 1HG GLU 82 2HG GLU 82 4.311 -5.303 -8.392
618 2HG GLU 82 3HG GLU 82 3.145 -6.603 -8.450
619 H THR 83 H THR 83 3.688 -7.834 -4.398
620 HA THR 83 HA THR 83 3.017 -6.298 -2.276
621 HB THR 83 HB THR 83 3.139 -9.163 -2.757
622 HG1 THR 83 1HG THR 83 1.595 -8.196 -0.736
623 1HG2 THR 83 1HG2 THR 83 3.011 -9.916 -0.387
624 2HG2 THR 83 2HG2 THR 83 4.638 -9.497 -0.895
625 3HG2 THR 83 3HG2 THR 83 3.718 -8.372 0.127
626 H LYS 84 H LYS 84 6.014 -8.177 -2.760
627 HA LYS 84 HA LYS 84 7.222 -7.515 -0.251
628 1HB LYS 84 2HB LYS 84 8.477 -8.626 -2.772
629 2HB LYS 84 3HB LYS 84 9.281 -8.574 -1.211
630 1HG LYS 84 2HG LYS 84 6.670 -10.104 -1.465
631 2HG LYS 84 3HG LYS 84 8.126 -10.745 -2.181
632 1HD LYS 84 2HD LYS 84 7.796 -11.785 -0.118
633 2HD LYS 84 3HD LYS 84 9.250 -10.804 0.023
634 1HE LYS 84 2HE LYS 84 6.497 -9.831 0.958
635 2HE LYS 84 3HE LYS 84 7.461 -10.912 1.956
636 1HZ LYS 84 1HZ LYS 84 9.174 -9.343 2.106
637 2HZ LYS 84 2HZ LYS 84 8.477 -8.324 1.016
638 3HZ LYS 84 3HZ LYS 84 7.766 -8.582 2.477
639 H SER 85 H SER 85 7.443 -6.113 -3.569
640 HA SER 85 HA SER 85 9.538 -4.294 -3.023
641 1HB SER 85 2HB SER 85 7.137 -4.029 -4.872
642 2HB SER 85 3HB SER 85 8.545 -2.944 -4.860
643 HG SER 85 HG SER 85 8.826 -4.575 -6.396
644 H LEU 86 H LEU 86 5.957 -3.908 -2.593
645 HA LEU 86 HA LEU 86 6.054 -1.286 -1.453
646 1HB LEU 86 2HB LEU 86 3.916 -2.466 -2.075
647 2HB LEU 86 3HB LEU 86 4.184 -3.575 -0.743
648 HG LEU 86 HG LEU 86 4.318 -1.299 0.707
649 1HD1 LEU 86 1HD1 LEU 86 4.055 0.148 -1.353
650 2HD1 LEU 86 2HD1 LEU 86 2.409 -0.518 -1.511
651 3HD1 LEU 86 3HD1 LEU 86 2.848 0.412 -0.076
652 1HD2 LEU 86 1HD2 LEU 86 1.892 -2.807 -0.253
653 2HD2 LEU 86 2HD2 LEU 86 2.762 -2.941 1.291
654 3HD2 LEU 86 3HD2 LEU 86 1.772 -1.517 0.963
655 H MET 87 H MET 87 5.918 -4.493 0.178
656 HA MET 87 HA MET 87 6.346 -3.678 2.746
657 1HB MET 87 2HB MET 87 6.136 -6.074 1.482
658 2HB MET 87 3HB MET 87 7.845 -6.142 1.912
659 1HG MET 87 2HG MET 87 7.274 -5.901 4.256
660 2HG MET 87 3HG MET 87 5.577 -5.555 3.868
661 1HE MET 87 1HE MET 87 5.866 -7.625 6.003
662 2HE MET 87 2HE MET 87 6.291 -9.288 5.522
663 3HE MET 87 3HE MET 87 7.522 -8.019 5.456
664 H ALA 88 H ALA 88 8.917 -4.371 0.389
665 HA ALA 88 HA ALA 88 11.165 -4.258 2.016
666 1HB ALA 88 1HB ALA 88 10.848 -3.543 -0.936
667 2HB ALA 88 2HB ALA 88 12.400 -3.807 -0.115
668 3HB ALA 88 3HB ALA 88 11.236 -5.135 -0.259
669 H ALA 89 H ALA 89 9.727 -1.559 0.078
670 HA ALA 89 HA ALA 89 11.642 0.351 1.224
671 1HB ALA 89 1HB ALA 89 9.084 0.748 -0.334
672 2HB ALA 89 2HB ALA 89 10.175 2.060 0.170
673 3HB ALA 89 3HB ALA 89 10.777 0.819 -0.940
674 H ALA 90 H ALA 90 8.159 -0.429 1.719
675 HA ALA 90 HA ALA 90 7.472 1.557 3.570
676 1HB ALA 90 1HB ALA 90 5.832 0.015 2.613
677 2HB ALA 90 2HB ALA 90 6.611 -1.353 3.454
678 3HB ALA 90 3HB ALA 90 5.810 -0.086 4.392
679 H ASP 91 H ASP 91 9.266 -1.451 4.062
680 HA ASP 91 HA ASP 91 9.257 -1.294 6.917
681 1HB ASP 91 2HB ASP 91 9.347 -3.434 5.765
682 2HB ASP 91 3HB ASP 91 10.815 -2.942 4.885
683 H ASN 92 H ASN 92 10.462 0.185 8.046
684 HA ASN 92 HA ASN 92 12.907 1.421 6.921
685 1HB ASN 92 2HB ASN 92 11.480 1.715 9.594
686 2HB ASN 92 3HB ASN 92 12.925 2.617 9.146
687 1HD2 ASN 92 1HD2 ASN 92 12.761 4.523 8.125
688 2HD2 ASN 92 2HD2 ASN 92 11.192 5.237 7.857
689 H ASP 93 H ASP 93 13.155 -1.490 7.333
690 HA ASP 93 HA ASP 93 15.331 -1.507 9.407
691 1HB ASP 93 2HB ASP 93 12.982 -3.419 9.327
692 2HB ASP 93 3HB ASP 93 14.458 -3.702 10.240
693 H GLY 94 H GLY 94 13.557 -3.559 7.035
694 1HA GLY 94 1HA GLY 94 14.478 -5.179 5.598
695 2HA GLY 94 2HA GLY 94 16.056 -5.051 6.394
696 H ASP 95 H ASP 95 12.763 -5.227 7.758
697 HA ASP 95 HA ASP 95 13.291 -7.899 8.932
698 1HB ASP 95 2HB ASP 95 11.810 -7.394 10.799
699 2HB ASP 95 3HB ASP 95 13.330 -6.509 10.819
700 H GLY 96 H GLY 96 10.595 -5.646 8.348
701 1HA GLY 96 1HA GLY 96 9.164 -6.297 6.320
702 2HA GLY 96 2HA GLY 96 9.044 -7.890 7.099
703 H LYS 97 H LYS 97 9.027 -6.708 9.843
704 HA LYS 97 HA LYS 97 6.183 -6.285 10.086
705 1HB LYS 97 2HB LYS 97 6.511 -6.092 12.399
706 2HB LYS 97 3HB LYS 97 7.664 -7.302 11.845
707 1HG LYS 97 2HG LYS 97 9.414 -5.469 11.842
708 2HG LYS 97 3HG LYS 97 8.235 -4.416 12.636
709 1HD LYS 97 2HD LYS 97 8.039 -6.093 14.467
710 2HD LYS 97 3HD LYS 97 9.322 -7.057 13.734
711 1HE LYS 97 2HE LYS 97 9.744 -4.110 14.444
712 2HE LYS 97 3HE LYS 97 9.871 -5.357 15.687
713 1HZ LYS 97 1HZ LYS 97 12.000 -4.799 14.706
714 2HZ LYS 97 2HZ LYS 97 11.640 -6.380 14.410
715 3HZ LYS 97 3HZ LYS 97 11.496 -5.244 13.237
716 H ILE 98 H ILE 98 5.127 -4.428 9.640
717 HA ILE 98 HA ILE 98 6.630 -1.841 9.404
718 HB ILE 98 HB ILE 98 4.591 -3.237 7.678
719 1HG1 ILE 98 2HG1 ILE 98 7.016 -1.724 6.724
720 2HG1 ILE 98 3HG1 ILE 98 7.237 -3.321 7.441
721 1HG2 ILE 98 1HG2 ILE 98 5.298 -0.269 7.529
722 2HG2 ILE 98 2HG2 ILE 98 4.362 -1.177 6.332
723 3HG2 ILE 98 3HG2 ILE 98 3.702 -0.932 7.940
724 1HD1 ILE 98 1HD1 ILE 98 5.636 -4.300 5.850
725 2HD1 ILE 98 2HD1 ILE 98 5.436 -2.722 5.059
726 3HD1 ILE 98 3HD1 ILE 98 7.016 -3.531 5.043
727 H GLY 99 H GLY 99 5.959 -0.442 10.902
728 1HA GLY 99 1HA GLY 99 3.281 -0.636 12.152
729 2HA GLY 99 2HA GLY 99 4.601 0.470 12.570
730 H ALA 100 H ALA 100 2.196 1.630 12.429
731 HA ALA 100 HA ALA 100 1.399 2.635 9.863
732 1HB ALA 100 1HB ALA 100 0.001 2.762 11.964
733 2HB ALA 100 2HB ALA 100 1.111 4.005 12.569
734 3HB ALA 100 3HB ALA 100 0.164 4.293 11.089
735 H GLU 101 H GLU 101 3.671 3.778 12.365
736 HA GLU 101 HA GLU 101 4.415 6.184 11.151
737 1HB GLU 101 2HB GLU 101 5.959 4.268 12.949
738 2HB GLU 101 3HB GLU 101 6.509 5.901 12.539
739 1HG GLU 101 2HG GLU 101 4.637 6.930 13.614
740 2HG GLU 101 3HG GLU 101 3.746 5.412 13.762
741 H GLU 102 H GLU 102 6.110 2.983 10.925
742 HA GLU 102 HA GLU 102 7.953 3.639 8.991
743 1HB GLU 102 2HB GLU 102 6.431 0.985 9.128
744 2HB GLU 102 3HB GLU 102 7.956 1.298 8.306
745 1HG GLU 102 2HG GLU 102 8.950 1.896 10.566
746 2HG GLU 102 3HG GLU 102 7.505 1.195 11.307
747 H PHE 103 H PHE 103 4.598 2.492 8.439
748 HA PHE 103 HA PHE 103 4.760 2.530 5.618
749 1HB PHE 103 2HB PHE 103 2.992 1.461 7.167
750 2HB PHE 103 3HB PHE 103 2.200 3.029 7.185
751 HD1 PHE 103 1HD PHE 103 3.642 0.475 4.845
752 HD2 PHE 103 2HD PHE 103 0.558 3.425 5.444
753 HE1 PHE 103 1HE PHE 103 2.613 -0.179 2.700
754 HE2 PHE 103 2HE PHE 103 -0.514 2.718 3.322
755 HZ PHE 103 HZ PHE 103 0.522 0.928 1.934
756 H GLN 104 H GLN 104 3.443 5.018 7.815
757 HA GLN 104 HA GLN 104 2.593 6.937 5.871
758 1HB GLN 104 2HB GLN 104 1.873 6.790 8.213
759 2HB GLN 104 3HB GLN 104 3.467 7.356 8.749
760 1HG GLN 104 2HG GLN 104 3.131 9.496 7.601
761 2HG GLN 104 3HG GLN 104 1.687 8.882 6.790
762 1HE2 GLN 104 1HE2 GLN 104 3.001 9.676 10.047
763 2HE2 GLN 104 2HE2 GLN 104 1.423 9.948 10.765
764 H GLU 105 H GLU 105 5.758 6.612 7.678
765 HA GLU 105 HA GLU 105 7.042 8.905 6.676
766 1HB GLU 105 2HB GLU 105 8.081 6.095 7.272
767 2HB GLU 105 3HB GLU 105 9.120 7.391 6.676
768 1HG GLU 105 2HG GLU 105 8.587 8.784 8.627
769 2HG GLU 105 3HG GLU 105 7.528 7.511 9.264
770 H MET 106 H MET 106 6.935 5.615 5.234
771 HA MET 106 HA MET 106 8.353 6.435 2.895
772 1HB MET 106 2HB MET 106 7.363 3.983 3.985
773 2HB MET 106 3HB MET 106 6.626 4.135 2.397
774 1HG MET 106 2HG MET 106 8.757 3.002 2.208
775 2HG MET 106 3HG MET 106 8.876 4.559 1.404
776 1HE MET 106 1HE MET 106 9.462 2.801 4.790
777 2HE MET 106 2HE MET 106 10.880 3.653 5.420
778 3HE MET 106 3HE MET 106 9.281 4.434 5.450
779 H VAL 107 H VAL 107 4.858 5.863 3.419
780 HA VAL 107 HA VAL 107 3.976 6.568 0.860
781 HB VAL 107 HB VAL 107 2.640 6.762 3.564
782 1HG1 VAL 107 1HG1 VAL 107 1.493 7.325 0.807
783 2HG1 VAL 107 2HG1 VAL 107 0.488 6.932 2.220
784 3HG1 VAL 107 3HG1 VAL 107 1.469 8.400 2.219
785 1HG2 VAL 107 1HG2 VAL 107 3.183 4.475 2.602
786 2HG2 VAL 107 2HG2 VAL 107 1.446 4.777 2.783
787 3HG2 VAL 107 3HG2 VAL 107 2.204 4.894 1.186
788 H HIS 108 H HIS 108 4.903 8.712 3.531
789 HA HIS 108 HA HIS 108 3.723 11.092 2.538
790 1HB HIS 108 2HB HIS 108 4.248 10.960 4.837
791 2HB HIS 108 3HB HIS 108 5.886 10.390 4.530
792 HD1 HIS 108 1HD HIS 108 7.746 12.164 3.865
793 HD2 HIS 108 2HD HIS 108 3.980 13.627 5.039
794 HE1 HIS 108 1HE HIS 108 8.077 14.619 4.497
795 H SER 109 H SER 109 6.495 9.220 1.571
796 HA SER 109 HA SER 109 8.050 11.434 0.629
797 1HB SER 109 2HB SER 109 9.065 9.262 1.391
798 2HB SER 109 3HB SER 109 8.361 8.499 -0.058
799 HG SER 109 HG SER 109 9.430 10.256 -1.228
Start of MODEL 20
1 1H MET 1 H1 MET 1 -18.420 5.531 0.654
2 2H MET 1 H2 MET 1 -19.767 4.669 0.839
3 3H MET 1 H3 MET 1 -18.882 5.101 2.154
4 HA MET 1 HA MET 1 -18.646 2.741 1.679
5 1HB MET 1 2HB MET 1 -17.645 3.762 -0.963
6 2HB MET 1 3HB MET 1 -17.054 2.239 -0.272
7 1HG MET 1 2HG MET 1 -19.346 1.401 -0.054
8 2HG MET 1 3HG MET 1 -19.962 2.864 -0.846
9 1HE MET 1 1HE MET 1 -20.473 -0.258 -1.650
10 2HE MET 1 2HE MET 1 -21.266 1.132 -2.436
11 3HE MET 1 3HE MET 1 -20.438 -0.097 -3.421
12 H SER 2 H SER 2 -15.676 3.942 0.363
13 HA SER 2 HA SER 2 -14.455 4.098 3.032
14 1HB SER 2 2HB SER 2 -14.421 1.679 2.554
15 2HB SER 2 3HB SER 2 -13.701 1.968 0.959
16 HG SER 2 HG SER 2 -12.230 1.395 2.752
17 H ILE 3 H ILE 3 -11.868 3.824 1.688
18 HA ILE 3 HA ILE 3 -11.319 6.450 0.956
19 HB ILE 3 HB ILE 3 -9.234 5.786 0.279
20 1HG1 ILE 3 2HG1 ILE 3 -9.839 4.240 -1.576
21 2HG1 ILE 3 3HG1 ILE 3 -8.505 3.782 -0.575
22 1HG2 ILE 3 1HG2 ILE 3 -10.059 3.526 2.170
23 2HG2 ILE 3 2HG2 ILE 3 -8.453 4.162 1.895
24 3HG2 ILE 3 3HG2 ILE 3 -9.702 5.195 2.631
25 1HD1 ILE 3 1HD1 ILE 3 -11.342 2.641 -0.241
26 2HD1 ILE 3 2HD1 ILE 3 -10.115 1.921 -1.270
27 3HD1 ILE 3 3HD1 ILE 3 -9.851 2.006 0.482
28 H THR 4 H THR 4 -12.796 3.965 -1.084
29 HA THR 4 HA THR 4 -12.133 4.976 -3.612
30 HB THR 4 HB THR 4 -13.334 2.776 -2.680
31 HG1 THR 4 1HG THR 4 -12.599 2.980 -4.632
32 1HG2 THR 4 1HG2 THR 4 -15.430 3.836 -1.921
33 2HG2 THR 4 2HG2 THR 4 -15.774 4.341 -3.596
34 3HG2 THR 4 3HG2 THR 4 -15.682 2.622 -3.185
35 H ASP 5 H ASP 5 -14.482 5.868 -1.184
36 HA ASP 5 HA ASP 5 -16.060 7.689 -2.848
37 1HB ASP 5 2HB ASP 5 -16.857 5.843 -1.276
38 2HB ASP 5 3HB ASP 5 -16.250 6.820 0.078
39 H VAL 6 H VAL 6 -13.396 8.482 -2.562
40 HA VAL 6 HA VAL 6 -13.578 10.974 -0.971
41 HB VAL 6 HB VAL 6 -11.201 9.067 -0.699
42 1HG1 VAL 6 1HG1 VAL 6 -11.835 11.672 0.732
43 2HG1 VAL 6 2HG1 VAL 6 -10.430 10.624 1.017
44 3HG1 VAL 6 3HG1 VAL 6 -10.606 11.463 -0.531
45 1HG2 VAL 6 1HG2 VAL 6 -13.381 9.702 1.325
46 2HG2 VAL 6 2HG2 VAL 6 -13.076 8.129 0.551
47 3HG2 VAL 6 3HG2 VAL 6 -11.880 8.812 1.662
48 H LEU 7 H LEU 7 -11.229 9.040 -2.851
49 HA LEU 7 HA LEU 7 -11.008 10.934 -5.034
50 1HB LEU 7 2HB LEU 7 -9.731 12.202 -3.283
51 2HB LEU 7 3HB LEU 7 -8.775 10.764 -2.951
52 HG LEU 7 HG LEU 7 -8.107 10.926 -5.516
53 1HD1 LEU 7 1HD1 LEU 7 -9.720 12.727 -6.072
54 2HD1 LEU 7 2HD1 LEU 7 -8.900 13.804 -4.920
55 3HD1 LEU 7 3HD1 LEU 7 -8.040 13.213 -6.358
56 1HD2 LEU 7 1HD2 LEU 7 -7.024 12.855 -3.435
57 2HD2 LEU 7 2HD2 LEU 7 -6.546 11.154 -3.653
58 3HD2 LEU 7 3HD2 LEU 7 -6.195 12.328 -4.921
59 H SER 8 H SER 8 -9.124 8.669 -3.045
60 HA SER 8 HA SER 8 -7.322 7.695 -4.541
61 1HB SER 8 2HB SER 8 -8.922 5.875 -2.774
62 2HB SER 8 3HB SER 8 -7.157 5.939 -3.014
63 HG SER 8 HG SER 8 -7.662 7.075 -1.107
64 H ALA 9 H ALA 9 -10.665 6.722 -5.101
65 HA ALA 9 HA ALA 9 -10.412 4.299 -6.507
66 1HB ALA 9 1HB ALA 9 -12.571 5.349 -5.943
67 2HB ALA 9 2HB ALA 9 -12.213 6.701 -7.038
68 3HB ALA 9 3HB ALA 9 -12.459 5.066 -7.690
69 H ASP 10 H ASP 10 -9.988 7.679 -7.684
70 HA ASP 10 HA ASP 10 -9.626 6.943 -10.449
71 1HB ASP 10 2HB ASP 10 -10.227 9.225 -9.525
72 2HB ASP 10 3HB ASP 10 -8.547 9.395 -8.990
73 H ASP 11 H ASP 11 -7.447 7.518 -7.691
74 HA ASP 11 HA ASP 11 -5.024 7.443 -9.122
75 1HB ASP 11 2HB ASP 11 -5.412 6.818 -6.166
76 2HB ASP 11 3HB ASP 11 -4.008 7.519 -6.990
77 H ILE 12 H ILE 12 -6.754 4.927 -7.166
78 HA ILE 12 HA ILE 12 -4.852 2.906 -7.671
79 HB ILE 12 HB ILE 12 -6.446 1.381 -6.922
80 1HG1 ILE 12 2HG1 ILE 12 -8.456 3.565 -6.884
81 2HG1 ILE 12 3HG1 ILE 12 -8.521 2.078 -7.826
82 1HG2 ILE 12 1HG2 ILE 12 -6.544 2.117 -4.614
83 2HG2 ILE 12 2HG2 ILE 12 -5.062 2.717 -5.351
84 3HG2 ILE 12 3HG2 ILE 12 -6.431 3.816 -5.111
85 1HD1 ILE 12 1HD1 ILE 12 -8.829 2.361 -4.812
86 2HD1 ILE 12 2HD1 ILE 12 -10.025 1.809 -5.994
87 3HD1 ILE 12 3HD1 ILE 12 -8.614 0.800 -5.643
88 H ALA 13 H ALA 13 -7.815 3.892 -9.458
89 HA ALA 13 HA ALA 13 -7.728 1.822 -11.385
90 1HB ALA 13 1HB ALA 13 -9.603 3.393 -11.178
91 2HB ALA 13 2HB ALA 13 -8.595 4.710 -11.814
92 3HB ALA 13 3HB ALA 13 -8.983 3.319 -12.838
93 H ALA 14 H ALA 14 -6.037 5.028 -11.398
94 HA ALA 14 HA ALA 14 -4.593 4.586 -13.818
95 1HB ALA 14 1HB ALA 14 -4.657 6.779 -12.717
96 2HB ALA 14 2HB ALA 14 -3.703 6.148 -11.357
97 3HB ALA 14 3HB ALA 14 -2.982 6.229 -12.974
98 H ALA 15 H ALA 15 -3.606 3.923 -10.422
99 HA ALA 15 HA ALA 15 -1.116 2.844 -10.861
100 1HB ALA 15 1HB ALA 15 -1.244 2.034 -8.675
101 2HB ALA 15 2HB ALA 15 -2.399 3.365 -8.631
102 3HB ALA 15 3HB ALA 15 -2.988 1.702 -8.758
103 H LEU 16 H LEU 16 -4.255 1.191 -10.913
104 HA LEU 16 HA LEU 16 -3.395 -1.433 -11.317
105 1HB LEU 16 2HB LEU 16 -5.586 -1.159 -10.720
106 2HB LEU 16 3HB LEU 16 -5.920 0.103 -11.886
107 HG LEU 16 HG LEU 16 -5.341 -2.647 -12.969
108 1HD1 LEU 16 1HD1 LEU 16 -7.737 -3.231 -12.705
109 2HD1 LEU 16 2HD1 LEU 16 -6.900 -3.118 -11.146
110 3HD1 LEU 16 3HD1 LEU 16 -7.967 -1.800 -11.677
111 1HD2 LEU 16 1HD2 LEU 16 -5.787 -0.624 -14.458
112 2HD2 LEU 16 2HD2 LEU 16 -6.979 -1.914 -14.660
113 3HD2 LEU 16 3HD2 LEU 16 -7.376 -0.473 -13.704
114 H GLN 17 H GLN 17 -3.574 1.255 -13.641
115 HA GLN 17 HA GLN 17 -3.013 -0.613 -15.881
116 1HB GLN 17 2HB GLN 17 -4.149 2.093 -15.668
117 2HB GLN 17 3HB GLN 17 -2.922 1.942 -16.937
118 1HG GLN 17 2HG GLN 17 -4.041 0.014 -17.904
119 2HG GLN 17 3HG GLN 17 -5.233 -0.013 -16.601
120 1HE2 GLN 17 1HE2 GLN 17 -7.144 1.093 -16.954
121 2HE2 GLN 17 2HE2 GLN 17 -7.364 2.247 -18.257
122 H GLU 18 H GLU 18 -1.378 2.041 -14.082
123 HA GLU 18 HA GLU 18 0.953 1.970 -15.717
124 1HB GLU 18 2HB GLU 18 1.804 3.552 -14.350
125 2HB GLU 18 3HB GLU 18 0.133 3.668 -13.869
126 1HG GLU 18 2HG GLU 18 1.298 3.774 -11.889
127 2HG GLU 18 3HG GLU 18 0.786 2.089 -11.887
128 H CYS 19 H CYS 19 0.094 0.227 -12.762
129 HA CYS 19 HA CYS 19 2.532 -1.400 -12.801
130 1HB CYS 19 2HB CYS 19 1.409 -0.159 -10.755
131 2HB CYS 19 3HB CYS 19 0.287 -1.532 -10.772
132 HG CYS 19 HG CYS 19 3.569 -1.468 -10.737
133 H ARG 20 H ARG 20 0.672 -1.870 -14.957
134 HA ARG 20 HA ARG 20 -1.170 -4.060 -14.349
135 1HB ARG 20 2HB ARG 20 -1.552 -2.481 -16.131
136 2HB ARG 20 3HB ARG 20 -0.051 -2.985 -16.923
137 1HG ARG 20 2HG ARG 20 -1.084 -5.369 -17.023
138 2HG ARG 20 3HG ARG 20 -2.571 -4.652 -16.372
139 1HD ARG 20 2HD ARG 20 -2.715 -4.753 -18.784
140 2HD ARG 20 3HD ARG 20 -2.541 -3.047 -18.268
141 HE ARG 20 HE ARG 20 0.077 -4.106 -18.705
142 1HH1 ARG 20 2HH2 ARG 20 -2.682 -3.183 -20.682
143 2HH1 ARG 20 1HH2 ARG 20 -1.724 -2.867 -22.102
144 1HH2 ARG 20 2HH1 ARG 20 1.286 -3.764 -20.330
145 2HH2 ARG 20 1HH1 ARG 20 0.727 -3.256 -21.928
146 H ASP 21 H ASP 21 2.108 -3.602 -15.684
147 HA ASP 21 HA ASP 21 2.185 -6.299 -16.730
148 1HB ASP 21 2HB ASP 21 3.853 -3.786 -16.972
149 2HB ASP 21 3HB ASP 21 4.526 -5.326 -17.447
150 HA PRO 22 HA PRO 22 3.770 -8.168 -13.297
151 1HB PRO 22 2HB PRO 22 5.487 -10.137 -14.120
152 2HB PRO 22 3HB PRO 22 3.729 -10.165 -14.424
153 1HG PRO 22 2HG PRO 22 5.883 -9.173 -16.311
154 2HG PRO 22 3HG PRO 22 4.574 -10.339 -16.673
155 1HD PRO 22 2HD PRO 22 4.307 -7.718 -17.306
156 2HD PRO 22 3HD PRO 22 2.919 -8.603 -16.605
157 H ASP 23 H ASP 23 5.375 -8.198 -11.758
158 HA ASP 23 HA ASP 23 6.994 -7.330 -10.544
159 1HB ASP 23 2HB ASP 23 8.611 -8.269 -12.906
160 2HB ASP 23 3HB ASP 23 9.254 -7.867 -11.304
161 H THR 24 H THR 24 5.662 -5.208 -11.590
162 HA THR 24 HA THR 24 7.762 -3.212 -12.397
163 HB THR 24 HB THR 24 4.828 -2.960 -13.173
164 HG1 THR 24 1HG THR 24 5.354 -4.719 -14.167
165 1HG2 THR 24 1HG2 THR 24 5.813 -1.600 -15.011
166 2HG2 THR 24 2HG2 THR 24 6.226 -0.880 -13.453
167 3HG2 THR 24 3HG2 THR 24 7.434 -1.841 -14.339
168 H PHE 25 H PHE 25 6.236 -4.097 -9.624
169 HA PHE 25 HA PHE 25 4.922 -1.558 -8.970
170 1HB PHE 25 2HB PHE 25 4.230 -3.924 -8.330
171 2HB PHE 25 3HB PHE 25 5.480 -3.871 -7.098
172 HD1 PHE 25 1HD PHE 25 2.081 -3.600 -7.625
173 HD2 PHE 25 2HD PHE 25 5.257 -1.483 -5.594
174 HE1 PHE 25 1HE PHE 25 0.458 -2.711 -5.993
175 HE2 PHE 25 2HE PHE 25 3.586 -0.497 -4.066
176 HZ PHE 25 HZ PHE 25 1.201 -1.149 -4.224
177 H GLU 26 H GLU 26 6.753 -0.137 -9.247
178 HA GLU 26 HA GLU 26 8.913 -0.188 -7.310
179 1HB GLU 26 2HB GLU 26 8.026 1.630 -9.443
180 2HB GLU 26 3HB GLU 26 8.347 2.495 -7.939
181 1HG GLU 26 2HG GLU 26 10.623 1.194 -7.914
182 2HG GLU 26 3HG GLU 26 10.305 1.023 -9.647
183 HA PRO 27 HA PRO 27 6.351 1.032 -3.880
184 1HB PRO 27 2HB PRO 27 8.228 2.101 -2.132
185 2HB PRO 27 3HB PRO 27 8.002 0.359 -2.440
186 1HG PRO 27 2HG PRO 27 10.085 2.183 -3.649
187 2HG PRO 27 3HG PRO 27 10.279 0.518 -3.049
188 1HD PRO 27 2HD PRO 27 9.997 1.074 -5.684
189 2HD PRO 27 3HD PRO 27 9.349 -0.425 -4.952
190 H GLN 28 H GLN 28 8.866 3.558 -4.499
191 HA GLN 28 HA GLN 28 7.264 5.707 -3.606
192 1HB GLN 28 2HB GLN 28 9.668 5.638 -5.460
193 2HB GLN 28 3HB GLN 28 8.902 7.130 -4.883
194 1HG GLN 28 2HG GLN 28 9.254 6.451 -2.534
195 2HG GLN 28 3HG GLN 28 10.071 4.973 -3.063
196 1HE2 GLN 28 1HE2 GLN 28 11.979 5.436 -4.711
197 2HE2 GLN 28 2HE2 GLN 28 13.010 6.772 -4.225
198 H LYS 29 H LYS 29 7.831 4.442 -6.913
199 HA LYS 29 HA LYS 29 6.239 6.192 -8.383
200 1HB LYS 29 2HB LYS 29 7.640 4.227 -9.201
201 2HB LYS 29 3HB LYS 29 6.278 3.174 -8.786
202 1HG LYS 29 2HG LYS 29 5.473 3.563 -10.861
203 2HG LYS 29 3HG LYS 29 5.079 5.191 -10.327
204 1HD LYS 29 2HD LYS 29 6.396 5.506 -12.260
205 2HD LYS 29 3HD LYS 29 7.506 5.830 -10.917
206 1HE LYS 29 2HE LYS 29 7.771 3.043 -11.340
207 2HE LYS 29 3HE LYS 29 7.481 3.652 -12.967
208 1HZ LYS 29 1HZ LYS 29 9.788 3.610 -12.532
209 2HZ LYS 29 2HZ LYS 29 9.400 5.215 -12.471
210 3HZ LYS 29 3HZ LYS 29 9.672 4.310 -11.105
211 H PHE 30 H PHE 30 5.145 3.065 -6.899
212 HA PHE 30 HA PHE 30 2.460 3.464 -7.626
213 1HB PHE 30 2HB PHE 30 3.700 1.326 -6.937
214 2HB PHE 30 3HB PHE 30 3.338 1.771 -5.274
215 HD1 PHE 30 1HD PHE 30 2.163 0.296 -8.366
216 HD2 PHE 30 2HD PHE 30 0.798 2.094 -4.681
217 HE1 PHE 30 1HE PHE 30 -0.074 -0.709 -8.690
218 HE2 PHE 30 2HE PHE 30 -1.459 1.172 -5.077
219 HZ PHE 30 HZ PHE 30 -1.891 -0.235 -7.106
220 H PHE 31 H PHE 31 4.168 4.243 -4.622
221 HA PHE 31 HA PHE 31 2.137 5.121 -2.910
222 1HB PHE 31 2HB PHE 31 4.165 5.238 -1.867
223 2HB PHE 31 3HB PHE 31 5.025 5.631 -3.333
224 HD1 PHE 31 1HD PHE 31 6.082 7.724 -3.519
225 HD2 PHE 31 2HD PHE 31 2.626 7.263 -0.979
226 HE1 PHE 31 1HE PHE 31 6.322 10.054 -2.796
227 HE2 PHE 31 2HE PHE 31 3.016 9.554 -0.120
228 HZ PHE 31 HZ PHE 31 4.820 10.960 -1.037
229 H GLN 32 H GLN 32 3.872 7.003 -5.438
230 HA GLN 32 HA GLN 32 2.322 9.332 -4.853
231 1HB GLN 32 2HB GLN 32 4.756 8.981 -5.947
232 2HB GLN 32 3HB GLN 32 3.828 9.159 -7.445
233 1HG GLN 32 2HG GLN 32 2.936 11.336 -6.581
234 2HG GLN 32 3HG GLN 32 3.784 11.066 -5.050
235 1HE2 GLN 32 1HE2 GLN 32 4.431 11.455 -8.575
236 2HE2 GLN 32 2HE2 GLN 32 6.004 12.194 -8.318
237 H THR 33 H THR 33 2.345 6.916 -7.530
238 HA THR 33 HA THR 33 0.337 8.041 -9.068
239 HB THR 33 HB THR 33 2.002 5.804 -9.249
240 HG1 THR 33 1HG THR 33 -0.194 6.663 -10.689
241 1HG2 THR 33 1HG2 THR 33 -0.814 4.737 -9.368
242 2HG2 THR 33 2HG2 THR 33 0.700 3.867 -9.674
243 3HG2 THR 33 3HG2 THR 33 0.295 4.352 -8.031
244 H SER 34 H SER 34 0.124 5.991 -6.197
245 HA SER 34 HA SER 34 -2.719 5.582 -6.501
246 1HB SER 34 2HB SER 34 -1.205 3.860 -5.590
247 2HB SER 34 3HB SER 34 -0.888 4.893 -4.181
248 HG SER 34 HG SER 34 -3.341 4.870 -4.055
249 H GLY 35 H GLY 35 -0.944 8.283 -5.378
250 1HA GLY 35 1HA GLY 35 -1.947 10.261 -4.755
251 2HA GLY 35 2HA GLY 35 -3.484 9.429 -4.495
252 H LEU 36 H LEU 36 -1.188 7.680 -2.843
253 HA LEU 36 HA LEU 36 -2.038 8.438 -0.224
254 1HB LEU 36 2HB LEU 36 0.203 6.789 -1.411
255 2HB LEU 36 3HB LEU 36 0.172 7.118 0.307
256 HG LEU 36 HG LEU 36 -0.784 4.937 -0.422
257 1HD1 LEU 36 1HD1 LEU 36 -1.152 5.885 1.820
258 2HD1 LEU 36 2HD1 LEU 36 -2.628 6.697 1.243
259 3HD1 LEU 36 3HD1 LEU 36 -2.524 4.924 1.260
260 1HD2 LEU 36 1HD2 LEU 36 -3.232 6.565 -1.231
261 2HD2 LEU 36 2HD2 LEU 36 -2.125 5.713 -2.331
262 3HD2 LEU 36 3HD2 LEU 36 -3.093 4.801 -1.166
263 H SER 37 H SER 37 0.489 9.600 -2.380
264 HA SER 37 HA SER 37 2.000 11.324 -0.669
265 1HB SER 37 2HB SER 37 2.274 12.587 -2.828
266 2HB SER 37 3HB SER 37 2.652 10.865 -2.984
267 HG SER 37 HG SER 37 0.887 10.567 -4.206
268 H LYS 38 H LYS 38 -1.225 11.673 -2.116
269 HA LYS 38 HA LYS 38 -1.134 14.517 -1.489
270 1HB LYS 38 2HB LYS 38 -1.976 13.297 -3.722
271 2HB LYS 38 3HB LYS 38 -3.492 13.199 -2.833
272 1HG LYS 38 2HG LYS 38 -2.532 15.884 -2.483
273 2HG LYS 38 3HG LYS 38 -2.191 15.462 -4.168
274 1HD LYS 38 2HD LYS 38 -4.593 14.777 -4.429
275 2HD LYS 38 3HD LYS 38 -4.876 15.259 -2.737
276 1HE LYS 38 2HE LYS 38 -4.101 17.590 -3.304
277 2HE LYS 38 3HE LYS 38 -3.907 17.095 -4.994
278 1HZ LYS 38 1HZ LYS 38 -6.440 17.119 -3.489
279 2HZ LYS 38 2HZ LYS 38 -5.982 18.204 -4.636
280 3HZ LYS 38 3HZ LYS 38 -6.270 16.641 -5.057
281 H MET 39 H MET 39 -2.619 11.498 -0.534
282 HA MET 39 HA MET 39 -4.906 12.322 0.721
283 1HB MET 39 2HB MET 39 -2.945 10.091 1.218
284 2HB MET 39 3HB MET 39 -4.335 10.232 2.256
285 1HG MET 39 2HG MET 39 -4.615 10.030 -0.760
286 2HG MET 39 3HG MET 39 -4.521 8.655 0.328
287 1HE MET 39 1HE MET 39 -8.231 11.195 -0.408
288 2HE MET 39 2HE MET 39 -6.997 12.047 0.517
289 3HE MET 39 3HE MET 39 -6.632 11.450 -1.131
290 H SER 40 H SER 40 -1.735 12.158 2.338
291 HA SER 40 HA SER 40 -0.832 13.613 3.834
292 1HB SER 40 2HB SER 40 -3.597 14.408 4.841
293 2HB SER 40 3HB SER 40 -2.038 15.053 5.339
294 HG SER 40 HG SER 40 -1.961 15.362 2.795
295 H ALA 41 H ALA 41 -0.201 13.160 5.953
296 HA ALA 41 HA ALA 41 -0.008 10.593 6.687
297 1HB ALA 41 1HB ALA 41 0.547 11.377 8.968
298 2HB ALA 41 2HB ALA 41 1.272 12.415 7.732
299 3HB ALA 41 3HB ALA 41 -0.177 12.955 8.604
300 H ASN 42 H ASN 42 -2.756 12.609 7.411
301 HA ASN 42 HA ASN 42 -3.776 11.013 9.657
302 1HB ASN 42 2HB ASN 42 -5.146 13.140 7.946
303 2HB ASN 42 3HB ASN 42 -5.810 12.414 9.417
304 1HD2 ASN 42 1HD2 ASN 42 -4.994 15.287 8.712
305 2HD2 ASN 42 2HD2 ASN 42 -3.909 15.722 10.019
306 H GLN 43 H GLN 43 -4.863 11.649 6.313
307 HA GLN 43 HA GLN 43 -6.829 9.578 6.147
308 1HB GLN 43 2HB GLN 43 -5.134 11.089 4.153
309 2HB GLN 43 3HB GLN 43 -6.236 9.812 3.628
310 1HG GLN 43 2HG GLN 43 -7.095 12.253 5.251
311 2HG GLN 43 3HG GLN 43 -7.173 12.156 3.488
312 1HE2 GLN 43 1HE2 GLN 43 -8.216 9.809 2.799
313 2HE2 GLN 43 2HE2 GLN 43 -9.767 9.544 3.584
314 H VAL 44 H VAL 44 -3.314 9.679 5.276
315 HA VAL 44 HA VAL 44 -3.154 7.082 4.220
316 HB VAL 44 HB VAL 44 -1.139 8.812 5.707
317 1HG1 VAL 44 1HG1 VAL 44 -0.307 6.496 5.801
318 2HG1 VAL 44 2HG1 VAL 44 -0.584 6.325 4.052
319 3HG1 VAL 44 3HG1 VAL 44 0.628 7.471 4.669
320 1HG2 VAL 44 1HG2 VAL 44 -2.103 9.679 3.506
321 2HG2 VAL 44 2HG2 VAL 44 -0.358 9.434 3.503
322 3HG2 VAL 44 3HG2 VAL 44 -1.434 8.252 2.724
323 H LYS 45 H LYS 45 -2.712 8.129 7.665
324 HA LYS 45 HA LYS 45 -2.185 5.498 8.651
325 1HB LYS 45 2HB LYS 45 -1.585 7.427 9.898
326 2HB LYS 45 3HB LYS 45 -3.241 8.029 9.929
327 1HG LYS 45 2HG LYS 45 -3.033 5.292 11.066
328 2HG LYS 45 3HG LYS 45 -1.972 6.444 11.864
329 1HD LYS 45 2HD LYS 45 -3.813 8.015 12.208
330 2HD LYS 45 3HD LYS 45 -4.930 6.980 11.300
331 1HE LYS 45 2HE LYS 45 -4.865 5.256 12.971
332 2HE LYS 45 3HE LYS 45 -3.522 6.034 13.834
333 1HZ LYS 45 1HZ LYS 45 -5.669 6.459 14.867
334 2HZ LYS 45 2HZ LYS 45 -4.966 7.854 14.354
335 3HZ LYS 45 3HZ LYS 45 -6.208 7.201 13.487
336 H ASP 46 H ASP 46 -5.268 7.354 8.246
337 HA ASP 46 HA ASP 46 -6.850 5.303 9.480
338 1HB ASP 46 2HB ASP 46 -7.637 7.510 7.554
339 2HB ASP 46 3HB ASP 46 -8.768 6.472 8.433
340 H VAL 47 H VAL 47 -6.128 5.892 5.987
341 HA VAL 47 HA VAL 47 -7.542 3.628 5.062
342 HB VAL 47 HB VAL 47 -6.498 3.745 3.032
343 1HG1 VAL 47 1HG1 VAL 47 -6.297 6.663 3.694
344 2HG1 VAL 47 2HG1 VAL 47 -6.968 5.878 2.285
345 3HG1 VAL 47 3HG1 VAL 47 -7.860 5.838 3.827
346 1HG2 VAL 47 1HG2 VAL 47 -4.553 5.011 2.405
347 2HG2 VAL 47 2HG2 VAL 47 -4.233 5.304 4.116
348 3HG2 VAL 47 3HG2 VAL 47 -4.171 3.651 3.477
349 H PHE 48 H PHE 48 -4.148 3.932 6.244
350 HA PHE 48 HA PHE 48 -3.304 1.267 5.891
351 1HB PHE 48 2HB PHE 48 -1.766 2.874 6.647
352 2HB PHE 48 3HB PHE 48 -2.708 3.271 8.059
353 HD1 PHE 48 1HD PHE 48 -0.066 1.154 6.828
354 HD2 PHE 48 2HD PHE 48 -3.058 1.562 9.914
355 HE1 PHE 48 1HE PHE 48 1.232 -0.344 8.328
356 HE2 PHE 48 2HE PHE 48 -1.987 -0.268 11.178
357 HZ PHE 48 HZ PHE 48 0.272 -1.065 10.484
358 H ARG 49 H ARG 49 -5.215 2.634 8.669
359 HA ARG 49 HA ARG 49 -5.547 -0.008 9.734
360 1HB ARG 49 2HB ARG 49 -6.491 2.687 10.549
361 2HB ARG 49 3HB ARG 49 -7.597 1.356 10.913
362 1HG ARG 49 2HG ARG 49 -5.615 0.061 11.845
363 2HG ARG 49 3HG ARG 49 -4.684 1.565 11.782
364 1HD ARG 49 2HD ARG 49 -6.020 2.549 13.480
365 2HD ARG 49 3HD ARG 49 -7.374 1.438 13.173
366 HE ARG 49 HE ARG 49 -5.142 -0.111 13.999
367 1HH1 ARG 49 2HH2 ARG 49 -7.515 2.122 15.294
368 2HH1 ARG 49 1HH2 ARG 49 -7.486 1.495 16.911
369 1HH2 ARG 49 2HH1 ARG 49 -5.332 -1.205 16.049
370 2HH2 ARG 49 1HH1 ARG 49 -6.142 -0.414 17.358
371 H PHE 50 H PHE 50 -7.587 1.767 7.402
372 HA PHE 50 HA PHE 50 -9.737 -0.128 7.472
373 1HB PHE 50 2HB PHE 50 -8.622 1.612 5.267
374 2HB PHE 50 3HB PHE 50 -9.783 0.364 4.904
375 HD1 PHE 50 1HD PHE 50 -9.398 3.682 6.449
376 HD2 PHE 50 2HD PHE 50 -12.088 0.383 5.749
377 HE1 PHE 50 1HE PHE 50 -11.323 5.167 6.862
378 HE2 PHE 50 2HE PHE 50 -14.019 1.893 6.121
379 HZ PHE 50 HZ PHE 50 -13.643 4.287 6.676
380 H ILE 51 H ILE 51 -6.502 -0.321 5.910
381 HA ILE 51 HA ILE 51 -7.195 -2.881 4.668
382 HB ILE 51 HB ILE 51 -4.654 -1.241 4.760
383 1HG1 ILE 51 2HG1 ILE 51 -4.917 -1.439 2.265
384 2HG1 ILE 51 3HG1 ILE 51 -6.424 -2.312 2.507
385 1HG2 ILE 51 1HG2 ILE 51 -3.737 -3.069 3.270
386 2HG2 ILE 51 2HG2 ILE 51 -3.854 -3.529 4.956
387 3HG2 ILE 51 3HG2 ILE 51 -5.063 -4.102 3.773
388 1HD1 ILE 51 1HD1 ILE 51 -5.832 0.592 3.176
389 2HD1 ILE 51 2HD1 ILE 51 -6.846 -0.020 1.866
390 3HD1 ILE 51 3HD1 ILE 51 -7.391 -0.207 3.531
391 H ASP 52 H ASP 52 -5.224 -1.907 7.493
392 HA ASP 52 HA ASP 52 -4.340 -4.549 8.205
393 1HB ASP 52 2HB ASP 52 -3.160 -2.548 8.982
394 2HB ASP 52 3HB ASP 52 -4.594 -2.025 9.870
395 H ASN 53 H ASN 53 -6.275 -5.605 7.837
396 HA ASN 53 HA ASN 53 -8.774 -5.389 8.807
397 1HB ASN 53 2HB ASN 53 -8.088 -7.153 7.309
398 2HB ASN 53 3HB ASN 53 -7.128 -7.942 8.566
399 1HD2 ASN 53 1HD2 ASN 53 -8.160 -9.338 10.035
400 2HD2 ASN 53 2HD2 ASN 53 -9.880 -9.689 9.934
401 H ASP 54 H ASP 54 -6.351 -7.319 10.611
402 HA ASP 54 HA ASP 54 -7.810 -7.640 12.989
403 1HB ASP 54 2HB ASP 54 -5.195 -7.795 13.841
404 2HB ASP 54 3HB ASP 54 -6.116 -9.099 13.106
405 H GLN 55 H GLN 55 -6.420 -4.706 11.859
406 HA GLN 55 HA GLN 55 -5.896 -2.740 12.775
407 1HB GLN 55 2HB GLN 55 -8.207 -3.687 14.469
408 2HB GLN 55 3HB GLN 55 -7.321 -2.283 15.035
409 1HG GLN 55 2HG GLN 55 -7.608 -1.251 12.738
410 2HG GLN 55 3HG GLN 55 -8.750 -2.552 12.382
411 1HE2 GLN 55 1HE2 GLN 55 -10.699 -2.692 13.827
412 2HE2 GLN 55 2HE2 GLN 55 -11.243 -1.247 14.664
413 H SER 56 H SER 56 -4.133 -4.901 13.381
414 HA SER 56 HA SER 56 -3.296 -4.822 16.146
415 1HB SER 56 2HB SER 56 -1.142 -5.796 14.943
416 2HB SER 56 3HB SER 56 -2.618 -6.749 15.103
417 HG SER 56 HG SER 56 -3.006 -6.649 13.089
418 H GLY 57 H GLY 57 -2.826 -2.717 13.389
419 1HA GLY 57 1HA GLY 57 -1.874 -0.566 13.470
420 2HA GLY 57 2HA GLY 57 -1.017 -0.947 14.968
421 H TYR 58 H TYR 58 -1.039 -3.386 12.485
422 HA TYR 58 HA TYR 58 1.703 -2.735 11.540
423 1HB TYR 58 2HB TYR 58 0.837 -5.316 12.878
424 2HB TYR 58 3HB TYR 58 2.291 -5.133 11.904
425 HD1 TYR 58 HD1 TYR 58 4.095 -3.497 12.600
426 HD2 TYR 58 HD2 TYR 58 0.832 -4.594 15.191
427 HE1 TYR 58 HE1 TYR 58 5.307 -2.540 14.544
428 HE2 TYR 58 HE2 TYR 58 2.036 -3.646 17.123
429 HH TYR 58 HH TYR 58 3.933 -2.550 17.843
430 H LEU 59 H LEU 59 1.738 -2.855 9.443
431 HA LEU 59 HA LEU 59 0.066 -4.766 7.913
432 1HB LEU 59 2HB LEU 59 2.314 -2.868 7.174
433 2HB LEU 59 3HB LEU 59 1.736 -4.141 6.112
434 HG LEU 59 HG LEU 59 0.794 -1.475 6.378
435 1HD1 LEU 59 1HD1 LEU 59 1.078 -2.725 4.291
436 2HD1 LEU 59 2HD1 LEU 59 -0.302 -3.762 4.726
437 3HD1 LEU 59 3HD1 LEU 59 -0.552 -2.033 4.434
438 1HD2 LEU 59 1HD2 LEU 59 -0.900 -2.364 8.088
439 2HD2 LEU 59 2HD2 LEU 59 -1.590 -1.654 6.629
440 3HD2 LEU 59 3HD2 LEU 59 -1.511 -3.407 6.800
441 H ASP 60 H ASP 60 0.588 -6.496 9.234
442 HA ASP 60 HA ASP 60 3.341 -7.487 9.529
443 1HB ASP 60 2HB ASP 60 0.833 -9.182 9.600
444 2HB ASP 60 3HB ASP 60 2.407 -9.453 10.368
445 H GLU 61 H GLU 61 3.896 -9.573 8.328
446 HA GLU 61 HA GLU 61 4.212 -9.212 5.673
447 1HB GLU 61 2HB GLU 61 3.871 -11.888 7.053
448 2HB GLU 61 3HB GLU 61 4.591 -11.597 5.463
449 1HG GLU 61 2HG GLU 61 6.515 -11.457 6.619
450 2HG GLU 61 3HG GLU 61 6.047 -9.795 6.927
451 H GLU 62 H GLU 62 1.481 -11.078 7.065
452 HA GLU 62 HA GLU 62 0.496 -11.742 4.481
453 1HB GLU 62 2HB GLU 62 0.139 -12.964 6.775
454 2HB GLU 62 3HB GLU 62 -1.256 -11.885 6.965
455 1HG GLU 62 2HG GLU 62 -2.183 -12.723 4.833
456 2HG GLU 62 3HG GLU 62 -0.694 -13.652 4.548
457 H GLU 63 H GLU 63 -0.039 -8.779 6.357
458 HA GLU 63 HA GLU 63 -2.510 -8.080 5.023
459 1HB GLU 63 2HB GLU 63 -0.316 -6.464 6.353
460 2HB GLU 63 3HB GLU 63 -1.386 -5.684 5.192
461 1HG GLU 63 2HG GLU 63 -2.536 -5.269 7.082
462 2HG GLU 63 3HG GLU 63 -3.387 -6.684 6.489
463 H LEU 64 H LEU 64 0.948 -7.912 4.082
464 HA LEU 64 HA LEU 64 0.364 -6.386 1.694
465 1HB LEU 64 2HB LEU 64 2.768 -8.112 2.313
466 2HB LEU 64 3HB LEU 64 2.566 -6.986 0.962
467 HG LEU 64 HG LEU 64 1.899 -5.476 3.290
468 1HD1 LEU 64 1HD1 LEU 64 3.939 -5.645 4.637
469 2HD1 LEU 64 2HD1 LEU 64 3.089 -7.199 4.626
470 3HD1 LEU 64 3HD1 LEU 64 4.523 -6.964 3.601
471 1HD2 LEU 64 1HD2 LEU 64 2.884 -4.599 1.228
472 2HD2 LEU 64 2HD2 LEU 64 3.885 -4.168 2.631
473 3HD2 LEU 64 3HD2 LEU 64 4.394 -5.478 1.544
474 H LYS 65 H LYS 65 -0.214 -9.721 2.512
475 HA LYS 65 HA LYS 65 -0.276 -10.606 -0.282
476 1HB LYS 65 2HB LYS 65 0.331 -12.065 1.678
477 2HB LYS 65 3HB LYS 65 -1.363 -11.977 2.187
478 1HG LYS 65 2HG LYS 65 -2.069 -13.069 0.063
479 2HG LYS 65 3HG LYS 65 -0.406 -12.979 -0.532
480 1HD LYS 65 2HD LYS 65 -0.683 -15.212 0.204
481 2HD LYS 65 3HD LYS 65 0.296 -14.401 1.435
482 1HE LYS 65 2HE LYS 65 -1.996 -13.999 2.675
483 2HE LYS 65 3HE LYS 65 -2.674 -15.163 1.543
484 1HZ LYS 65 1HZ LYS 65 -1.273 -16.833 2.484
485 2HZ LYS 65 2HZ LYS 65 -0.398 -15.713 3.337
486 3HZ LYS 65 3HZ LYS 65 -1.921 -15.980 3.752
487 H PHE 66 H PHE 66 -2.332 -8.777 1.822
488 HA PHE 66 HA PHE 66 -4.434 -8.884 -0.208
489 1HB PHE 66 2HB PHE 66 -4.894 -9.492 2.746
490 2HB PHE 66 3HB PHE 66 -6.179 -8.916 1.691
491 HD1 PHE 66 1HD PHE 66 -3.994 -11.816 2.387
492 HD2 PHE 66 2HD PHE 66 -7.402 -10.284 0.239
493 HE1 PHE 66 1HE PHE 66 -4.815 -14.131 1.999
494 HE2 PHE 66 2HE PHE 66 -8.169 -12.587 -0.208
495 HZ PHE 66 HZ PHE 66 -6.874 -14.520 0.664
496 H PHE 67 H PHE 67 -2.884 -6.838 -0.233
497 HA PHE 67 HA PHE 67 -3.584 -4.773 1.741
498 1HB PHE 67 2HB PHE 67 -1.343 -4.929 1.497
499 2HB PHE 67 3HB PHE 67 -1.365 -5.249 -0.211
500 HD1 PHE 67 1HD PHE 67 -0.366 -3.610 -1.525
501 HD2 PHE 67 2HD PHE 67 -2.036 -2.500 2.269
502 HE1 PHE 67 1HE PHE 67 0.452 -1.288 -1.818
503 HE2 PHE 67 2HE PHE 67 -1.470 -0.146 1.861
504 HZ PHE 67 HZ PHE 67 -0.214 0.484 -0.205
505 H LEU 68 H LEU 68 -3.141 -4.366 -1.818
506 HA LEU 68 HA LEU 68 -5.453 -2.628 -1.945
507 1HB LEU 68 2HB LEU 68 -3.624 -3.776 -4.057
508 2HB LEU 68 3HB LEU 68 -5.182 -3.111 -4.508
509 HG LEU 68 HG LEU 68 -4.535 -0.937 -3.421
510 1HD1 LEU 68 1HD1 LEU 68 -1.787 -2.257 -3.434
511 2HD1 LEU 68 2HD1 LEU 68 -2.107 -0.529 -3.152
512 3HD1 LEU 68 3HD1 LEU 68 -2.699 -1.735 -2.001
513 1HD2 LEU 68 1HD2 LEU 68 -2.813 -1.906 -5.711
514 2HD2 LEU 68 2HD2 LEU 68 -4.514 -1.408 -5.862
515 3HD2 LEU 68 3HD2 LEU 68 -3.312 -0.230 -5.335
516 H GLN 69 H GLN 69 -5.383 -5.914 -1.558
517 HA GLN 69 HA GLN 69 -7.652 -6.563 -3.148
518 1HB GLN 69 2HB GLN 69 -5.978 -7.912 -1.294
519 2HB GLN 69 3HB GLN 69 -7.591 -8.037 -0.623
520 1HG GLN 69 2HG GLN 69 -7.997 -9.733 -2.029
521 2HG GLN 69 3HG GLN 69 -7.855 -8.656 -3.408
522 1HE2 GLN 69 1HE2 GLN 69 -6.266 -9.181 -4.916
523 2HE2 GLN 69 2HE2 GLN 69 -4.932 -10.246 -4.525
524 H LYS 70 H LYS 70 -7.360 -4.645 -0.210
525 HA LYS 70 HA LYS 70 -10.354 -4.593 0.010
526 1HB LYS 70 2HB LYS 70 -8.252 -3.252 1.727
527 2HB LYS 70 3HB LYS 70 -9.991 -3.008 1.838
528 1HG LYS 70 2HG LYS 70 -9.767 -4.567 3.460
529 2HG LYS 70 3HG LYS 70 -10.118 -5.637 2.094
530 1HD LYS 70 2HD LYS 70 -7.641 -6.004 1.811
531 2HD LYS 70 3HD LYS 70 -7.352 -4.867 3.137
532 1HE LYS 70 2HE LYS 70 -8.783 -6.476 4.598
533 2HE LYS 70 3HE LYS 70 -8.600 -7.630 3.268
534 1HZ LYS 70 1HZ LYS 70 -6.135 -7.169 3.506
535 2HZ LYS 70 2HZ LYS 70 -6.492 -6.380 4.914
536 3HZ LYS 70 3HZ LYS 70 -6.838 -7.987 4.775
537 H PHE 71 H PHE 71 -7.548 -2.474 -0.819
538 HA PHE 71 HA PHE 71 -9.040 -0.136 -1.183
539 1HB PHE 71 2HB PHE 71 -6.580 -1.070 -2.700
540 2HB PHE 71 3HB PHE 71 -7.301 0.481 -2.928
541 HD1 PHE 71 1HD PHE 71 -4.608 -0.930 -1.069
542 HD2 PHE 71 2HD PHE 71 -7.818 1.883 -0.931
543 HE1 PHE 71 1HE PHE 71 -3.228 0.561 0.271
544 HE2 PHE 71 2HE PHE 71 -6.453 3.372 0.558
545 HZ PHE 71 HZ PHE 71 -4.133 2.700 1.135
546 H GLU 72 H GLU 72 -8.322 -2.661 -3.586
547 HA GLU 72 HA GLU 72 -10.321 -1.478 -5.472
548 1HB GLU 72 2HB GLU 72 -8.008 -1.436 -6.295
549 2HB GLU 72 3HB GLU 72 -7.828 -3.166 -5.993
550 1HG GLU 72 2HG GLU 72 -8.228 -2.747 -8.359
551 2HG GLU 72 3HG GLU 72 -9.606 -3.627 -7.694
552 H SER 73 H SER 73 -8.797 -4.601 -4.728
553 HA SER 73 HA SER 73 -9.907 -6.639 -4.143
554 1HB SER 73 2HB SER 73 -12.204 -5.798 -5.946
555 2HB SER 73 3HB SER 73 -12.010 -7.337 -5.106
556 HG SER 73 HG SER 73 -12.328 -4.787 -3.957
557 H GLY 74 H GLY 74 -8.578 -7.988 -5.129
558 1HA GLY 74 1HA GLY 74 -7.689 -9.346 -6.784
559 2HA GLY 74 2HA GLY 74 -8.903 -8.717 -7.906
560 H ALA 75 H ALA 75 -6.364 -7.004 -6.053
561 HA ALA 75 HA ALA 75 -5.352 -5.711 -8.490
562 1HB ALA 75 1HB ALA 75 -5.737 -4.328 -6.588
563 2HB ALA 75 2HB ALA 75 -4.783 -5.380 -5.536
564 3HB ALA 75 3HB ALA 75 -3.985 -4.428 -6.819
565 H ARG 76 H ARG 76 -2.800 -6.148 -6.260
566 HA ARG 76 HA ARG 76 -1.537 -8.056 -8.192
567 1HB ARG 76 2HB ARG 76 -0.949 -5.404 -7.878
568 2HB ARG 76 3HB ARG 76 0.042 -6.075 -6.584
569 1HG ARG 76 2HG ARG 76 1.378 -5.964 -8.523
570 2HG ARG 76 3HG ARG 76 1.039 -7.667 -8.264
571 1HD ARG 76 2HD ARG 76 -0.064 -7.850 -10.312
572 2HD ARG 76 3HD ARG 76 -1.105 -6.490 -9.930
573 HE ARG 76 HE ARG 76 0.163 -5.091 -11.267
574 1HH1 ARG 76 2HH2 ARG 76 2.057 -8.041 -10.745
575 2HH1 ARG 76 1HH2 ARG 76 3.560 -7.112 -10.878
576 1HH2 ARG 76 2HH1 ARG 76 2.192 -4.055 -11.537
577 2HH2 ARG 76 1HH1 ARG 76 3.636 -5.056 -11.318
578 H GLU 77 H GLU 77 -2.473 -7.662 -5.024
579 HA GLU 77 HA GLU 77 -0.517 -8.070 -3.402
580 1HB GLU 77 2HB GLU 77 -3.040 -9.542 -2.730
581 2HB GLU 77 3HB GLU 77 -1.984 -8.521 -1.738
582 1HG GLU 77 2HG GLU 77 -4.066 -7.666 -3.772
583 2HG GLU 77 3HG GLU 77 -3.931 -7.245 -2.073
584 H LEU 78 H LEU 78 -2.022 -10.665 -5.108
585 HA LEU 78 HA LEU 78 -0.883 -12.923 -3.858
586 1HB LEU 78 2HB LEU 78 -1.440 -12.710 -6.838
587 2HB LEU 78 3HB LEU 78 -1.364 -14.149 -5.832
588 HG LEU 78 HG LEU 78 -3.584 -13.983 -6.097
589 1HD1 LEU 78 1HD1 LEU 78 -4.717 -13.230 -4.111
590 2HD1 LEU 78 2HD1 LEU 78 -3.160 -13.940 -3.658
591 3HD1 LEU 78 3HD1 LEU 78 -3.378 -12.176 -3.653
592 1HD2 LEU 78 1HD2 LEU 78 -3.584 -11.934 -7.439
593 2HD2 LEU 78 2HD2 LEU 78 -4.964 -12.042 -6.338
594 3HD2 LEU 78 3HD2 LEU 78 -3.630 -10.945 -5.972
595 H THR 79 H THR 79 0.533 -10.763 -6.400
596 HA THR 79 HA THR 79 2.753 -12.519 -6.925
597 HB THR 79 HB THR 79 2.613 -9.512 -7.405
598 HG1 THR 79 1HG THR 79 2.446 -10.886 -9.580
599 1HG2 THR 79 1HG2 THR 79 4.300 -11.779 -8.611
600 2HG2 THR 79 2HG2 THR 79 4.330 -10.095 -9.156
601 3HG2 THR 79 3HG2 THR 79 4.909 -10.517 -7.540
602 H GLU 80 H GLU 80 4.002 -13.082 -5.284
603 HA GLU 80 HA GLU 80 4.454 -11.549 -2.959
604 1HB GLU 80 2HB GLU 80 6.331 -13.711 -3.950
605 2HB GLU 80 3HB GLU 80 6.045 -13.108 -2.306
606 1HG GLU 80 2HG GLU 80 4.793 -15.028 -2.237
607 2HG GLU 80 3HG GLU 80 3.543 -13.895 -2.759
608 H SER 81 H SER 81 6.294 -11.709 -6.020
609 HA SER 81 HA SER 81 8.621 -10.336 -5.234
610 1HB SER 81 2HB SER 81 8.241 -11.454 -7.453
611 2HB SER 81 3HB SER 81 7.195 -10.107 -7.928
612 HG SER 81 HG SER 81 9.153 -9.683 -8.687
613 H GLU 82 H GLU 82 5.603 -8.948 -6.609
614 HA GLU 82 HA GLU 82 6.384 -6.222 -6.395
615 1HB GLU 82 2HB GLU 82 3.602 -7.477 -6.421
616 2HB GLU 82 3HB GLU 82 3.972 -5.806 -6.821
617 1HG GLU 82 2HG GLU 82 5.170 -8.136 -8.415
618 2HG GLU 82 3HG GLU 82 3.570 -7.473 -8.724
619 H THR 83 H THR 83 4.331 -8.344 -4.357
620 HA THR 83 HA THR 83 3.742 -6.496 -2.400
621 HB THR 83 HB THR 83 3.741 -9.439 -2.643
622 HG1 THR 83 1HG THR 83 1.943 -8.190 -1.049
623 1HG2 THR 83 1HG2 THR 83 3.303 -9.879 -0.240
624 2HG2 THR 83 2HG2 THR 83 5.003 -9.635 -0.649
625 3HG2 THR 83 3HG2 THR 83 4.101 -8.342 0.157
626 H LYS 84 H LYS 84 6.643 -8.555 -2.721
627 HA LYS 84 HA LYS 84 7.869 -7.756 -0.268
628 1HB LYS 84 2HB LYS 84 8.951 -9.093 -2.770
629 2HB LYS 84 3HB LYS 84 9.957 -8.777 -1.365
630 1HG LYS 84 2HG LYS 84 7.385 -10.250 -0.844
631 2HG LYS 84 3HG LYS 84 8.610 -11.088 -1.789
632 1HD LYS 84 2HD LYS 84 8.882 -11.670 0.525
633 2HD LYS 84 3HD LYS 84 10.292 -10.752 -0.033
634 1HE LYS 84 2HE LYS 84 9.387 -8.695 1.051
635 2HE LYS 84 3HE LYS 84 7.939 -9.592 1.549
636 1HZ LYS 84 1HZ LYS 84 9.387 -10.960 2.919
637 2HZ LYS 84 2HZ LYS 84 10.703 -10.077 2.449
638 3HZ LYS 84 3HZ LYS 84 9.483 -9.359 3.291
639 H SER 85 H SER 85 8.147 -6.571 -3.641
640 HA SER 85 HA SER 85 10.172 -4.659 -3.290
641 1HB SER 85 2HB SER 85 9.007 -5.191 -5.463
642 2HB SER 85 3HB SER 85 7.601 -4.277 -4.898
643 HG SER 85 HG SER 85 8.711 -2.824 -5.981
644 H LEU 86 H LEU 86 6.629 -4.342 -2.678
645 HA LEU 86 HA LEU 86 6.888 -1.726 -1.594
646 1HB LEU 86 2HB LEU 86 4.803 -2.905 -2.480
647 2HB LEU 86 3HB LEU 86 4.641 -3.659 -0.898
648 HG LEU 86 HG LEU 86 3.254 -1.605 -1.384
649 1HD1 LEU 86 1HD1 LEU 86 5.061 -1.329 1.045
650 2HD1 LEU 86 2HD1 LEU 86 3.497 -0.545 0.779
651 3HD1 LEU 86 3HD1 LEU 86 3.584 -2.309 0.932
652 1HD2 LEU 86 1HD2 LEU 86 4.133 0.584 -1.417
653 2HD2 LEU 86 2HD2 LEU 86 5.737 0.067 -0.881
654 3HD2 LEU 86 3HD2 LEU 86 5.176 -0.341 -2.515
655 H MET 87 H MET 87 6.511 -4.888 0.168
656 HA MET 87 HA MET 87 6.888 -3.963 2.716
657 1HB MET 87 2HB MET 87 6.573 -6.383 2.124
658 2HB MET 87 3HB MET 87 8.284 -6.457 1.665
659 1HG MET 87 2HG MET 87 8.862 -5.661 4.019
660 2HG MET 87 3HG MET 87 7.159 -5.832 4.425
661 1HE MET 87 1HE MET 87 6.720 -9.696 4.494
662 2HE MET 87 2HE MET 87 6.014 -8.117 4.894
663 3HE MET 87 3HE MET 87 6.286 -8.566 3.187
664 H ALA 88 H ALA 88 9.487 -4.670 0.402
665 HA ALA 88 HA ALA 88 11.707 -4.471 2.048
666 1HB ALA 88 1HB ALA 88 11.421 -3.871 -0.932
667 2HB ALA 88 2HB ALA 88 12.964 -4.111 -0.084
668 3HB ALA 88 3HB ALA 88 11.788 -5.434 -0.191
669 H ALA 89 H ALA 89 10.161 -1.850 0.131
670 HA ALA 89 HA ALA 89 12.109 0.117 1.147
671 1HB ALA 89 1HB ALA 89 11.315 0.309 -1.107
672 2HB ALA 89 2HB ALA 89 9.620 0.431 -0.553
673 3HB ALA 89 3HB ALA 89 10.786 1.722 -0.170
674 H ALA 90 H ALA 90 8.697 -0.788 1.783
675 HA ALA 90 HA ALA 90 8.091 1.481 3.460
676 1HB ALA 90 1HB ALA 90 6.949 -1.333 3.298
677 2HB ALA 90 2HB ALA 90 6.242 -0.001 4.237
678 3HB ALA 90 3HB ALA 90 6.344 0.114 2.461
679 H ASP 91 H ASP 91 9.412 -1.787 4.240
680 HA ASP 91 HA ASP 91 9.289 -1.330 7.054
681 1HB ASP 91 2HB ASP 91 9.505 -3.610 6.075
682 2HB ASP 91 3HB ASP 91 11.155 -3.209 5.553
683 H ASN 92 H ASN 92 10.515 0.030 8.221
684 HA ASN 92 HA ASN 92 12.927 1.209 6.890
685 1HB ASN 92 2HB ASN 92 10.714 2.501 7.810
686 2HB ASN 92 3HB ASN 92 11.721 2.562 9.259
687 1HD2 ASN 92 1HD2 ASN 92 11.693 3.174 5.715
688 2HD2 ASN 92 2HD2 ASN 92 12.833 4.510 5.772
689 H ASP 93 H ASP 93 12.572 -1.333 8.718
690 HA ASP 93 HA ASP 93 14.614 -0.641 10.807
691 1HB ASP 93 2HB ASP 93 12.734 -3.024 10.496
692 2HB ASP 93 3HB ASP 93 13.968 -2.848 11.746
693 H GLY 94 H GLY 94 13.726 -2.875 8.212
694 1HA GLY 94 1HA GLY 94 15.136 -4.289 6.912
695 2HA GLY 94 2HA GLY 94 16.436 -4.120 8.107
696 H ASP 95 H ASP 95 12.903 -4.631 8.643
697 HA ASP 95 HA ASP 95 13.532 -7.308 9.832
698 1HB ASP 95 2HB ASP 95 12.455 -6.974 11.722
699 2HB ASP 95 3HB ASP 95 12.859 -5.285 11.447
700 H GLY 96 H GLY 96 10.670 -5.411 8.628
701 1HA GLY 96 1HA GLY 96 9.871 -6.370 6.414
702 2HA GLY 96 2HA GLY 96 9.718 -7.910 7.277
703 H LYS 97 H LYS 97 8.828 -6.854 9.837
704 HA LYS 97 HA LYS 97 5.997 -6.588 9.255
705 1HB LYS 97 2HB LYS 97 7.532 -6.242 11.871
706 2HB LYS 97 3HB LYS 97 5.793 -6.430 11.670
707 1HG LYS 97 2HG LYS 97 6.577 -8.692 10.374
708 2HG LYS 97 3HG LYS 97 8.040 -8.436 11.326
709 1HD LYS 97 2HD LYS 97 6.696 -9.868 12.652
710 2HD LYS 97 3HD LYS 97 6.497 -8.255 13.378
711 1HE LYS 97 2HE LYS 97 4.396 -8.072 11.764
712 2HE LYS 97 3HE LYS 97 4.591 -9.805 11.541
713 1HZ LYS 97 1HZ LYS 97 2.999 -9.059 13.173
714 2HZ LYS 97 2HZ LYS 97 4.089 -10.154 13.785
715 3HZ LYS 97 3HZ LYS 97 4.191 -8.532 14.152
716 H ILE 98 H ILE 98 4.946 -4.670 8.863
717 HA ILE 98 HA ILE 98 6.572 -2.175 9.093
718 HB ILE 98 HB ILE 98 4.548 -3.270 7.193
719 1HG1 ILE 98 2HG1 ILE 98 7.091 -1.768 6.580
720 2HG1 ILE 98 3HG1 ILE 98 7.219 -3.418 7.186
721 1HG2 ILE 98 1HG2 ILE 98 3.742 -0.946 7.620
722 2HG2 ILE 98 2HG2 ILE 98 5.384 -0.338 7.305
723 3HG2 ILE 98 3HG2 ILE 98 4.463 -1.181 6.036
724 1HD1 ILE 98 1HD1 ILE 98 5.789 -4.252 5.393
725 2HD1 ILE 98 2HD1 ILE 98 5.645 -2.616 4.714
726 3HD1 ILE 98 3HD1 ILE 98 7.239 -3.409 4.798
727 H GLY 99 H GLY 99 6.135 -1.063 10.888
728 1HA GLY 99 1HA GLY 99 3.549 -0.961 12.182
729 2HA GLY 99 2HA GLY 99 4.873 0.203 12.361
730 H ALA 100 H ALA 100 2.026 0.831 12.174
731 HA ALA 100 HA ALA 100 1.370 2.036 9.667
732 1HB ALA 100 1HB ALA 100 0.736 3.178 12.414
733 2HB ALA 100 2HB ALA 100 -0.146 3.417 10.885
734 3HB ALA 100 3HB ALA 100 -0.169 1.839 11.686
735 H GLU 101 H GLU 101 3.441 3.037 12.324
736 HA GLU 101 HA GLU 101 4.013 5.626 11.510
737 1HB GLU 101 2HB GLU 101 4.543 4.329 13.666
738 2HB GLU 101 3HB GLU 101 6.039 3.801 12.887
739 1HG GLU 101 2HG GLU 101 6.793 6.109 12.704
740 2HG GLU 101 3HG GLU 101 5.208 6.723 13.205
741 H GLU 102 H GLU 102 6.028 2.684 10.882
742 HA GLU 102 HA GLU 102 7.817 3.652 9.019
743 1HB GLU 102 2HB GLU 102 6.402 0.945 9.004
744 2HB GLU 102 3HB GLU 102 7.872 1.346 8.111
745 1HG GLU 102 2HG GLU 102 9.059 1.785 10.229
746 2HG GLU 102 3HG GLU 102 7.610 1.362 11.153
747 H PHE 103 H PHE 103 4.536 2.363 8.349
748 HA PHE 103 HA PHE 103 4.733 2.697 5.536
749 1HB PHE 103 2HB PHE 103 2.921 1.508 7.144
750 2HB PHE 103 3HB PHE 103 2.037 3.000 6.876
751 HD1 PHE 103 1HD PHE 103 0.543 2.928 4.943
752 HD2 PHE 103 2HD PHE 103 4.140 0.578 4.931
753 HE1 PHE 103 1HE PHE 103 -0.241 1.710 2.931
754 HE2 PHE 103 2HE PHE 103 3.249 -0.817 3.099
755 HZ PHE 103 HZ PHE 103 1.105 -0.213 2.037
756 H GLN 104 H GLN 104 3.316 4.835 7.995
757 HA GLN 104 HA GLN 104 2.512 6.942 6.226
758 1HB GLN 104 2HB GLN 104 1.592 6.567 8.440
759 2HB GLN 104 3HB GLN 104 3.137 6.922 9.211
760 1HG GLN 104 2HG GLN 104 1.864 8.966 7.359
761 2HG GLN 104 3HG GLN 104 1.186 8.731 8.970
762 1HE2 GLN 104 1HE2 GLN 104 3.083 10.862 7.475
763 2HE2 GLN 104 2HE2 GLN 104 4.202 11.230 8.774
764 H GLU 105 H GLU 105 5.657 6.283 7.899
765 HA GLU 105 HA GLU 105 6.928 8.670 6.987
766 1HB GLU 105 2HB GLU 105 8.017 5.875 7.571
767 2HB GLU 105 3HB GLU 105 9.030 7.229 7.084
768 1HG GLU 105 2HG GLU 105 8.285 8.576 8.976
769 2HG GLU 105 3HG GLU 105 7.198 7.285 9.518
770 H MET 106 H MET 106 6.993 5.371 5.502
771 HA MET 106 HA MET 106 8.512 6.125 3.279
772 1HB MET 106 2HB MET 106 7.804 3.759 4.045
773 2HB MET 106 3HB MET 106 6.323 4.019 3.120
774 1HG MET 106 2HG MET 106 8.361 4.774 1.318
775 2HG MET 106 3HG MET 106 9.087 3.464 2.231
776 1HE MET 106 1HE MET 106 6.503 4.588 -0.413
777 2HE MET 106 2HE MET 106 5.466 3.157 -0.612
778 3HE MET 106 3HE MET 106 5.376 4.117 0.883
779 H VAL 107 H VAL 107 5.012 6.227 3.755
780 HA VAL 107 HA VAL 107 4.375 7.237 1.120
781 HB VAL 107 HB VAL 107 2.895 7.101 3.777
782 1HG1 VAL 107 1HG1 VAL 107 1.916 8.139 1.106
783 2HG1 VAL 107 2HG1 VAL 107 0.847 7.600 2.400
784 3HG1 VAL 107 3HG1 VAL 107 1.890 9.002 2.651
785 1HG2 VAL 107 1HG2 VAL 107 3.377 4.977 2.561
786 2HG2 VAL 107 2HG2 VAL 107 1.644 5.335 2.626
787 3HG2 VAL 107 3HG2 VAL 107 2.562 5.632 1.130
788 H HIS 108 H HIS 108 4.055 8.925 4.293
789 HA HIS 108 HA HIS 108 3.446 11.361 3.178
790 1HB HIS 108 2HB HIS 108 3.117 10.782 5.519
791 2HB HIS 108 3HB HIS 108 4.873 10.813 5.802
792 HD1 HIS 108 1HD HIS 108 6.098 13.244 5.747
793 HD2 HIS 108 2HD HIS 108 1.885 13.160 5.579
794 HE1 HIS 108 1HE HIS 108 5.282 15.554 6.461
795 H SER 109 H SER 109 6.599 10.039 4.065
796 HA SER 109 HA SER 109 8.690 10.757 3.875
797 1HB SER 109 2HB SER 109 7.680 10.639 1.421
798 2HB SER 109 3HB SER 109 8.000 12.385 1.433
799 HG SER 109 HG SER 109 9.755 11.128 0.614
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