NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
581346 |
2mlo   |
19828 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLU 1 H1 GLU 1 1.808 0.001 0.855
2 HA GLU 1 HA GLU 1 1.391 -0.022 -2.063
3 HB2 GLU 1 HB2 GLU 1 3.360 1.487 -0.376
4 HB3 GLU 1 HB3 GLU 1 3.746 1.091 -2.045
5 HG2 GLU 1 HG2 GLU 1 2.859 3.275 -2.050
6 HG3 GLU 1 HG3 GLU 1 1.608 2.220 -2.706
7 H LYS 2 H LYS 2 1.419 -2.373 -1.817
8 HA LYS 2 HA LYS 2 3.632 -3.800 -0.833
9 HB2 LYS 2 HB2 LYS 2 1.638 -4.586 -2.966
10 HB3 LYS 2 HB3 LYS 2 2.744 -5.691 -2.161
11 HG2 LYS 2 HG2 LYS 2 1.633 -4.887 0.013
12 HG3 LYS 2 HG3 LYS 2 0.360 -4.271 -1.043
13 HD2 LYS 2 HD2 LYS 2 0.174 -6.566 -2.020
14 HD3 LYS 2 HD3 LYS 2 1.298 -7.125 -0.779
15 HE2 LYS 2 HE2 LYS 2 -0.764 -7.599 0.161
16 HE3 LYS 2 HE3 LYS 2 -0.371 -6.035 0.874
17 HZ1 LYS 2 HZ1 LYS 2 -1.726 -5.613 -1.548
18 HZ2 LYS 2 HZ2 LYS 2 -2.219 -5.207 0.019
19 HZ3 LYS 2 HZ3 LYS 2 -2.617 -6.718 -0.628
20 H PHE 3 H PHE 3 5.633 -3.342 -1.533
21 HA PHE 3 HA PHE 3 6.177 -2.700 -4.287
22 HB2 PHE 3 HB2 PHE 3 8.435 -2.341 -3.595
23 HB3 PHE 3 HB3 PHE 3 7.404 -1.707 -2.318
24 HD1 PHE 3 HD1 PHE 3 9.775 -4.322 -3.252
25 HD2 PHE 3 HD2 PHE 3 7.286 -2.787 -0.159
26 HE1 PHE 3 HE1 PHE 3 10.954 -5.726 -1.611
27 HE2 PHE 3 HE2 PHE 3 8.461 -4.187 1.487
28 HZ PHE 3 HZ PHE 3 10.297 -5.660 0.762
29 H ARG 4 H ARG 4 6.310 -5.514 -2.256
30 HA ARG 4 HA ARG 4 8.111 -7.117 -3.627
31 HB2 ARG 4 HB2 ARG 4 5.660 -7.711 -2.004
32 HB3 ARG 4 HB3 ARG 4 6.517 -9.015 -2.814
33 HG2 ARG 4 HG2 ARG 4 7.877 -7.092 -0.950
34 HG3 ARG 4 HG3 ARG 4 7.129 -8.595 -0.405
35 HD2 ARG 4 HD2 ARG 4 8.588 -9.878 -1.860
36 HD3 ARG 4 HD3 ARG 4 9.295 -8.392 -2.493
37 HE ARG 4 HE ARG 4 9.609 -8.416 0.290
38 HH11 ARG 4 HH11 ARG 4 10.745 -10.109 -2.532
39 HH12 ARG 4 HH12 ARG 4 12.272 -10.525 -1.828
40 HH21 ARG 4 HH21 ARG 4 11.616 -8.958 1.228
41 HH22 ARG 4 HH22 ARG 4 12.766 -9.871 0.311
42 H ARG 5 H ARG 5 4.825 -6.246 -4.423
43 HA ARG 5 HA ARG 5 4.234 -8.226 -6.301
44 HB2 ARG 5 HB2 ARG 5 2.538 -6.694 -5.475
45 HB3 ARG 5 HB3 ARG 5 3.366 -5.332 -6.217
46 HG2 ARG 5 HG2 ARG 5 1.523 -5.873 -7.600
47 HG3 ARG 5 HG3 ARG 5 2.976 -6.424 -8.438
48 HD2 ARG 5 HD2 ARG 5 1.160 -8.073 -8.556
49 HD3 ARG 5 HD3 ARG 5 2.570 -8.698 -7.702
50 HE ARG 5 HE ARG 5 1.281 -8.911 -5.831
51 HH11 ARG 5 HH11 ARG 5 -0.291 -6.719 -8.031
52 HH12 ARG 5 HH12 ARG 5 -1.734 -6.592 -7.080
53 HH21 ARG 5 HH21 ARG 5 -0.613 -8.753 -4.570
54 HH22 ARG 5 HH22 ARG 5 -1.915 -7.749 -5.111
55 H TYR 6 H TYR 6 6.213 -5.361 -6.538
56 HA TYR 6 HA TYR 6 6.410 -5.452 -9.410
57 HB2 TYR 6 HB2 TYR 6 8.050 -3.908 -7.390
58 HB3 TYR 6 HB3 TYR 6 8.069 -3.658 -9.132
59 HD1 TYR 6 HD1 TYR 6 5.307 -3.643 -9.913
60 HD2 TYR 6 HD2 TYR 6 7.082 -2.070 -6.381
61 HE1 TYR 6 HE1 TYR 6 3.456 -2.036 -9.707
62 HE2 TYR 6 HE2 TYR 6 5.235 -0.460 -6.164
63 HH TYR 6 HH TYR 6 3.497 0.616 -8.093
64 H LEU 7 H LEU 7 8.118 -6.786 -6.705
65 HA LEU 7 HA LEU 7 10.539 -7.382 -8.107
66 HB2 LEU 7 HB2 LEU 7 9.371 -8.036 -5.459
67 HB3 LEU 7 HB3 LEU 7 10.645 -9.090 -6.070
68 HG LEU 7 HG LEU 7 11.554 -7.405 -4.577
69 HD11 LEU 7 HD11 LEU 7 13.410 -7.206 -5.802
70 HD12 LEU 7 HD12 LEU 7 12.585 -6.310 -7.077
71 HD13 LEU 7 HD13 LEU 7 12.517 -8.072 -7.051
72 HD21 LEU 7 HD21 LEU 7 11.461 -5.046 -5.095
73 HD22 LEU 7 HD22 LEU 7 9.823 -5.689 -4.961
74 HD23 LEU 7 HD23 LEU 7 10.519 -5.372 -6.551
75 H SER 8 H SER 8 7.473 -8.958 -7.669
76 HA SER 8 HA SER 8 8.414 -11.528 -8.599
77 HB2 SER 8 HB2 SER 8 5.644 -10.471 -8.000
78 HB3 SER 8 HB3 SER 8 5.968 -12.120 -8.535
79 HG SER 8 HG SER 8 5.867 -11.528 -6.135
80 H VAL 9 H VAL 9 6.303 -8.953 -9.848
81 HA VAL 9 HA VAL 9 5.711 -10.104 -12.320
82 HB VAL 9 HB VAL 9 5.148 -7.875 -13.096
83 HG11 VAL 9 HG11 VAL 9 3.311 -8.201 -11.888
84 HG12 VAL 9 HG12 VAL 9 4.226 -9.005 -10.610
85 HG13 VAL 9 HG13 VAL 9 4.056 -7.249 -10.605
86 HG21 VAL 9 HG21 VAL 9 6.720 -6.970 -10.695
87 HG22 VAL 9 HG22 VAL 9 6.983 -6.562 -12.391
88 HG23 VAL 9 HG23 VAL 9 5.576 -5.927 -11.539
89 H PHE 10 H PHE 10 8.552 -8.406 -11.214
90 HA PHE 10 HA PHE 10 9.699 -7.747 -13.682
91 HB2 PHE 10 HB2 PHE 10 10.571 -6.843 -11.605
92 HB3 PHE 10 HB3 PHE 10 11.025 -8.453 -11.057
93 HD1 PHE 10 HD1 PHE 10 11.586 -6.300 -14.057
94 HD2 PHE 10 HD2 PHE 10 13.251 -8.953 -11.175
95 HE1 PHE 10 HE1 PHE 10 13.803 -6.018 -15.085
96 HE2 PHE 10 HE2 PHE 10 15.472 -8.675 -12.198
97 HZ PHE 10 HZ PHE 10 15.750 -7.207 -14.156
98 H PHE 11 H PHE 11 9.432 -10.773 -12.016
99 HA PHE 11 HA PHE 11 11.436 -12.071 -13.666
100 HB2 PHE 11 HB2 PHE 11 9.745 -12.882 -11.340
101 HB3 PHE 11 HB3 PHE 11 10.394 -14.139 -12.388
102 HD1 PHE 11 HD1 PHE 11 11.703 -10.968 -10.908
103 HD2 PHE 11 HD2 PHE 11 12.262 -15.141 -11.535
104 HE1 PHE 11 HE1 PHE 11 13.845 -10.859 -9.703
105 HE2 PHE 11 HE2 PHE 11 14.404 -15.039 -10.329
106 HZ PHE 11 HZ PHE 11 15.199 -12.896 -9.412
107 H ARG 12 H ARG 12 7.922 -12.213 -13.183
108 HA ARG 12 HA ARG 12 7.363 -14.191 -15.080
109 HB2 ARG 12 HB2 ARG 12 5.603 -11.856 -14.311
110 HB3 ARG 12 HB3 ARG 12 5.074 -13.370 -15.033
111 HG2 ARG 12 HG2 ARG 12 6.474 -13.274 -12.381
112 HG3 ARG 12 HG3 ARG 12 4.726 -13.084 -12.535
113 HD2 ARG 12 HD2 ARG 12 4.805 -15.273 -13.869
114 HD3 ARG 12 HD3 ARG 12 6.426 -15.466 -13.202
115 HE ARG 12 HE ARG 12 4.667 -14.930 -11.096
116 HH11 ARG 12 HH11 ARG 12 5.318 -17.426 -13.433
117 HH12 ARG 12 HH12 ARG 12 4.743 -18.708 -12.419
118 HH21 ARG 12 HH21 ARG 12 3.907 -16.608 -9.751
119 HH22 ARG 12 HH22 ARG 12 3.940 -18.241 -10.325
120 H LYS 13 H LYS 13 8.050 -10.799 -15.436
121 HA LYS 13 HA LYS 13 6.981 -10.309 -17.963
122 HB2 LYS 13 HB2 LYS 13 8.107 -8.692 -16.288
123 HB3 LYS 13 HB3 LYS 13 9.611 -9.153 -17.076
124 HG2 LYS 13 HG2 LYS 13 9.028 -7.243 -18.217
125 HG3 LYS 13 HG3 LYS 13 8.371 -8.507 -19.259
126 HD2 LYS 13 HD2 LYS 13 6.565 -7.106 -19.146
127 HD3 LYS 13 HD3 LYS 13 6.228 -8.149 -17.763
128 HE2 LYS 13 HE2 LYS 13 5.904 -5.972 -16.959
129 HE3 LYS 13 HE3 LYS 13 7.503 -6.429 -16.375
130 HZ1 LYS 13 HZ1 LYS 13 8.469 -5.211 -18.246
131 HZ2 LYS 13 HZ2 LYS 13 7.536 -4.201 -17.261
132 HZ3 LYS 13 HZ3 LYS 13 6.925 -4.735 -18.745
133 H HIS 14 H HIS 14 10.102 -11.692 -17.033
134 HA HIS 14 HA HIS 14 10.769 -12.131 -19.847
135 HB2 HIS 14 HB2 HIS 14 12.370 -12.430 -17.304
136 HB3 HIS 14 HB3 HIS 14 12.971 -12.926 -18.884
137 HD1 HIS 14 HD1 HIS 14 13.632 -11.061 -20.540
138 HD2 HIS 14 HD2 HIS 14 12.282 -9.663 -16.868
139 HE1 HIS 14 HE1 HIS 14 14.242 -8.622 -20.484
140 H ILE 15 H ILE 15 10.989 -14.073 -16.860
141 HA ILE 15 HA ILE 15 11.192 -16.560 -18.044
142 HB ILE 15 HB ILE 15 9.790 -15.909 -15.449
143 HG12 ILE 15 HG12 ILE 15 12.629 -16.859 -15.795
144 HG13 ILE 15 HG13 ILE 15 12.220 -15.146 -15.793
145 HG21 ILE 15 HG21 ILE 15 10.398 -18.244 -14.847
146 HG22 ILE 15 HG22 ILE 15 9.216 -18.129 -16.150
147 HG23 ILE 15 HG23 ILE 15 10.901 -18.497 -16.518
148 HD11 ILE 15 HD11 ILE 15 11.994 -15.094 -13.580
149 HD12 ILE 15 HD12 ILE 15 11.097 -16.611 -13.540
150 HD13 ILE 15 HD13 ILE 15 12.859 -16.630 -13.599
151 H THR 16 H THR 16 8.184 -15.360 -16.550
152 HA THR 16 HA THR 16 6.569 -17.248 -17.942
153 HB THR 16 HB THR 16 5.758 -14.758 -16.429
154 HG1 THR 16 HG1 THR 16 5.678 -17.485 -15.610
155 HG21 THR 16 HG21 THR 16 3.835 -15.180 -17.592
156 HG22 THR 16 HG22 THR 16 3.605 -16.302 -16.252
157 HG23 THR 16 HG23 THR 16 4.206 -16.891 -17.802
Start of MODEL 2
1 H1 GLU 1 H1 GLU 1 -0.802 -1.314 -1.024
2 HA GLU 1 HA GLU 1 0.200 -1.586 -3.738
3 HB2 GLU 1 HB2 GLU 1 0.691 0.850 -2.031
4 HB3 GLU 1 HB3 GLU 1 1.761 0.393 -3.349
5 HG2 GLU 1 HG2 GLU 1 0.386 1.899 -4.385
6 HG3 GLU 1 HG3 GLU 1 -0.427 0.380 -4.757
7 H LYS 2 H LYS 2 1.669 -3.135 -3.619
8 HA LYS 2 HA LYS 2 3.478 -3.190 -1.295
9 HB2 LYS 2 HB2 LYS 2 1.634 -5.029 -1.475
10 HB3 LYS 2 HB3 LYS 2 2.674 -5.703 -2.723
11 HG2 LYS 2 HG2 LYS 2 3.339 -6.835 -0.823
12 HG3 LYS 2 HG3 LYS 2 4.535 -5.542 -0.945
13 HD2 LYS 2 HD2 LYS 2 3.162 -4.212 0.653
14 HD3 LYS 2 HD3 LYS 2 2.111 -5.616 0.850
15 HE2 LYS 2 HE2 LYS 2 3.986 -6.924 1.681
16 HE3 LYS 2 HE3 LYS 2 5.072 -5.559 1.428
17 HZ1 LYS 2 HZ1 LYS 2 4.120 -5.980 3.764
18 HZ2 LYS 2 HZ2 LYS 2 2.706 -5.273 3.162
19 HZ3 LYS 2 HZ3 LYS 2 4.151 -4.394 3.178
20 H PHE 3 H PHE 3 5.489 -2.792 -1.912
21 HA PHE 3 HA PHE 3 6.383 -2.686 -4.548
22 HB2 PHE 3 HB2 PHE 3 8.575 -2.360 -3.662
23 HB3 PHE 3 HB3 PHE 3 7.455 -1.608 -2.530
24 HD1 PHE 3 HD1 PHE 3 9.792 -4.362 -3.072
25 HD2 PHE 3 HD2 PHE 3 7.092 -2.542 -0.331
26 HE1 PHE 3 HE1 PHE 3 10.753 -5.698 -1.244
27 HE2 PHE 3 HE2 PHE 3 8.050 -3.875 1.502
28 HZ PHE 3 HZ PHE 3 9.882 -5.456 1.047
29 H ARG 4 H ARG 4 6.179 -5.355 -2.339
30 HA ARG 4 HA ARG 4 8.035 -7.120 -3.406
31 HB2 ARG 4 HB2 ARG 4 5.358 -7.581 -2.103
32 HB3 ARG 4 HB3 ARG 4 6.393 -8.912 -2.602
33 HG2 ARG 4 HG2 ARG 4 7.296 -6.736 -0.736
34 HG3 ARG 4 HG3 ARG 4 6.561 -8.245 -0.191
35 HD2 ARG 4 HD2 ARG 4 8.997 -8.133 -1.956
36 HD3 ARG 4 HD3 ARG 4 9.082 -8.190 -0.196
37 HE ARG 4 HE ARG 4 7.470 -10.295 -1.205
38 HH11 ARG 4 HH11 ARG 4 10.781 -9.287 -0.831
39 HH12 ARG 4 HH12 ARG 4 11.405 -10.903 -0.796
40 HH21 ARG 4 HH21 ARG 4 8.280 -12.427 -1.161
41 HH22 ARG 4 HH22 ARG 4 9.982 -12.688 -0.985
42 H ARG 5 H ARG 5 4.980 -6.073 -4.669
43 HA ARG 5 HA ARG 5 4.521 -8.199 -6.477
44 HB2 ARG 5 HB2 ARG 5 2.793 -6.557 -5.794
45 HB3 ARG 5 HB3 ARG 5 3.642 -5.315 -6.705
46 HG2 ARG 5 HG2 ARG 5 1.801 -6.096 -8.009
47 HG3 ARG 5 HG3 ARG 5 3.296 -6.660 -8.760
48 HD2 ARG 5 HD2 ARG 5 1.667 -8.443 -8.758
49 HD3 ARG 5 HD3 ARG 5 2.987 -8.846 -7.661
50 HE ARG 5 HE ARG 5 1.514 -8.767 -5.902
51 HH11 ARG 5 HH11 ARG 5 0.036 -7.357 -8.721
52 HH12 ARG 5 HH12 ARG 5 -1.539 -7.257 -8.006
53 HH21 ARG 5 HH21 ARG 5 -0.554 -8.640 -4.949
54 HH22 ARG 5 HH22 ARG 5 -1.873 -7.986 -5.860
55 H TYR 6 H TYR 6 6.077 -5.030 -6.872
56 HA TYR 6 HA TYR 6 6.637 -5.205 -9.597
57 HB2 TYR 6 HB2 TYR 6 8.229 -3.820 -7.430
58 HB3 TYR 6 HB3 TYR 6 8.405 -3.531 -9.157
59 HD1 TYR 6 HD1 TYR 6 5.672 -3.383 -10.114
60 HD2 TYR 6 HD2 TYR 6 7.339 -1.900 -6.491
61 HE1 TYR 6 HE1 TYR 6 3.910 -1.671 -10.010
62 HE2 TYR 6 HE2 TYR 6 5.580 -0.184 -6.377
63 HH TYR 6 HH TYR 6 2.849 -0.208 -8.526
64 H LEU 7 H LEU 7 8.166 -6.711 -6.871
65 HA LEU 7 HA LEU 7 10.585 -7.415 -8.247
66 HB2 LEU 7 HB2 LEU 7 9.358 -8.078 -5.611
67 HB3 LEU 7 HB3 LEU 7 10.680 -9.074 -6.217
68 HG LEU 7 HG LEU 7 11.840 -6.699 -6.488
69 HD11 LEU 7 HD11 LEU 7 9.520 -6.226 -4.752
70 HD12 LEU 7 HD12 LEU 7 10.485 -5.093 -5.699
71 HD13 LEU 7 HD13 LEU 7 11.060 -5.638 -4.123
72 HD21 LEU 7 HD21 LEU 7 12.181 -8.844 -4.887
73 HD22 LEU 7 HD22 LEU 7 11.826 -7.602 -3.686
74 HD23 LEU 7 HD23 LEU 7 13.171 -7.386 -4.806
75 H SER 8 H SER 8 7.462 -8.885 -7.702
76 HA SER 8 HA SER 8 8.262 -11.488 -8.633
77 HB2 SER 8 HB2 SER 8 6.122 -12.183 -8.103
78 HB3 SER 8 HB3 SER 8 6.279 -10.790 -7.033
79 HG SER 8 HG SER 8 5.127 -9.563 -8.532
80 H VAL 9 H VAL 9 6.476 -8.734 -9.960
81 HA VAL 9 HA VAL 9 5.789 -9.923 -12.422
82 HB VAL 9 HB VAL 9 5.347 -7.681 -13.229
83 HG11 VAL 9 HG11 VAL 9 3.884 -6.868 -11.343
84 HG12 VAL 9 HG12 VAL 9 3.640 -8.547 -11.828
85 HG13 VAL 9 HG13 VAL 9 4.556 -8.174 -10.368
86 HG21 VAL 9 HG21 VAL 9 5.868 -5.722 -11.759
87 HG22 VAL 9 HG22 VAL 9 6.880 -6.796 -10.792
88 HG23 VAL 9 HG23 VAL 9 7.280 -6.493 -12.482
89 H PHE 10 H PHE 10 8.697 -8.373 -11.280
90 HA PHE 10 HA PHE 10 9.904 -7.838 -13.767
91 HB2 PHE 10 HB2 PHE 10 10.658 -6.934 -11.554
92 HB3 PHE 10 HB3 PHE 10 11.311 -8.526 -11.182
93 HD1 PHE 10 HD1 PHE 10 11.430 -6.141 -14.055
94 HD2 PHE 10 HD2 PHE 10 13.574 -8.712 -11.426
95 HE1 PHE 10 HE1 PHE 10 13.531 -5.537 -15.184
96 HE2 PHE 10 HE2 PHE 10 15.679 -8.111 -12.550
97 HZ PHE 10 HZ PHE 10 15.659 -6.523 -14.433
98 H PHE 11 H PHE 11 9.517 -10.754 -11.939
99 HA PHE 11 HA PHE 11 11.521 -12.195 -13.471
100 HB2 PHE 11 HB2 PHE 11 9.775 -12.825 -11.130
101 HB3 PHE 11 HB3 PHE 11 10.408 -14.157 -12.091
102 HD1 PHE 11 HD1 PHE 11 12.971 -14.133 -12.517
103 HD2 PHE 11 HD2 PHE 11 11.040 -11.954 -9.412
104 HE1 PHE 11 HE1 PHE 11 15.098 -14.008 -11.287
105 HE2 PHE 11 HE2 PHE 11 13.164 -11.825 -8.177
106 HZ PHE 11 HZ PHE 11 15.196 -12.854 -9.113
107 H ARG 12 H ARG 12 8.002 -12.100 -13.118
108 HA ARG 12 HA ARG 12 7.435 -14.213 -14.901
109 HB2 ARG 12 HB2 ARG 12 5.691 -11.830 -14.253
110 HB3 ARG 12 HB3 ARG 12 5.157 -13.375 -14.901
111 HG2 ARG 12 HG2 ARG 12 6.545 -13.169 -12.251
112 HG3 ARG 12 HG3 ARG 12 4.802 -12.946 -12.417
113 HD2 ARG 12 HD2 ARG 12 6.322 -15.386 -13.331
114 HD3 ARG 12 HD3 ARG 12 5.451 -15.260 -11.803
115 HE ARG 12 HE ARG 12 4.329 -15.756 -14.376
116 HH11 ARG 12 HH11 ARG 12 3.711 -14.261 -11.293
117 HH12 ARG 12 HH12 ARG 12 1.990 -14.418 -11.415
118 HH21 ARG 12 HH21 ARG 12 2.065 -15.968 -14.549
119 HH22 ARG 12 HH22 ARG 12 1.055 -15.390 -13.267
120 H LYS 13 H LYS 13 8.163 -10.843 -15.376
121 HA LYS 13 HA LYS 13 7.129 -10.450 -17.939
122 HB2 LYS 13 HB2 LYS 13 8.261 -8.788 -16.282
123 HB3 LYS 13 HB3 LYS 13 9.748 -9.249 -17.099
124 HG2 LYS 13 HG2 LYS 13 9.110 -7.365 -18.259
125 HG3 LYS 13 HG3 LYS 13 8.454 -8.660 -19.263
126 HD2 LYS 13 HD2 LYS 13 6.769 -6.978 -19.040
127 HD3 LYS 13 HD3 LYS 13 6.273 -8.369 -18.074
128 HE2 LYS 13 HE2 LYS 13 6.860 -7.298 -16.055
129 HE3 LYS 13 HE3 LYS 13 7.765 -6.040 -16.895
130 HZ1 LYS 13 HZ1 LYS 13 4.823 -6.403 -16.832
131 HZ2 LYS 13 HZ2 LYS 13 5.603 -5.333 -17.885
132 HZ3 LYS 13 HZ3 LYS 13 5.716 -5.107 -16.213
133 H HIS 14 H HIS 14 10.387 -11.517 -16.974
134 HA HIS 14 HA HIS 14 11.084 -12.116 -19.719
135 HB2 HIS 14 HB2 HIS 14 12.603 -12.564 -17.141
136 HB3 HIS 14 HB3 HIS 14 13.252 -12.838 -18.755
137 HD1 HIS 14 HD1 HIS 14 13.184 -10.553 -20.320
138 HD2 HIS 14 HD2 HIS 14 13.119 -10.087 -16.192
139 HE1 HIS 14 HE1 HIS 14 13.890 -8.176 -19.900
140 H ILE 15 H ILE 15 10.943 -14.014 -16.700
141 HA ILE 15 HA ILE 15 11.217 -16.526 -17.901
142 HB ILE 15 HB ILE 15 9.747 -15.876 -15.344
143 HG12 ILE 15 HG12 ILE 15 12.627 -16.725 -15.676
144 HG13 ILE 15 HG13 ILE 15 12.131 -15.043 -15.521
145 HG21 ILE 15 HG21 ILE 15 10.266 -18.186 -14.719
146 HG22 ILE 15 HG22 ILE 15 9.263 -18.114 -16.167
147 HG23 ILE 15 HG23 ILE 15 10.989 -18.450 -16.306
148 HD11 ILE 15 HD11 ILE 15 12.937 -16.320 -13.436
149 HD12 ILE 15 HD12 ILE 15 11.504 -15.300 -13.313
150 HD13 ILE 15 HD13 ILE 15 11.332 -17.050 -13.460
151 H THR 16 H THR 16 8.204 -15.335 -16.419
152 HA THR 16 HA THR 16 6.603 -17.136 -17.954
153 HB THR 16 HB THR 16 5.650 -14.751 -16.361
154 HG1 THR 16 HG1 THR 16 5.934 -17.438 -15.461
155 HG21 THR 16 HG21 THR 16 4.345 -17.138 -17.581
156 HG22 THR 16 HG22 THR 16 3.781 -15.470 -17.492
157 HG23 THR 16 HG23 THR 16 3.705 -16.505 -16.065
Start of MODEL 3
1 H1 GLU 1 H1 GLU 1 -1.754 -4.497 -3.777
2 HA GLU 1 HA GLU 1 0.126 -3.340 -5.223
3 HB2 GLU 1 HB2 GLU 1 -0.563 -1.119 -4.376
4 HB3 GLU 1 HB3 GLU 1 -1.930 -2.175 -4.699
5 HG2 GLU 1 HG2 GLU 1 -2.574 -1.350 -2.692
6 HG3 GLU 1 HG3 GLU 1 -1.643 -2.740 -2.137
7 H LYS 2 H LYS 2 1.375 -4.889 -3.039
8 HA LYS 2 HA LYS 2 2.923 -2.987 -1.516
9 HB2 LYS 2 HB2 LYS 2 2.847 -5.979 -1.721
10 HB3 LYS 2 HB3 LYS 2 4.199 -5.186 -0.924
11 HG2 LYS 2 HG2 LYS 2 1.491 -4.354 -0.086
12 HG3 LYS 2 HG3 LYS 2 2.007 -5.980 0.367
13 HD2 LYS 2 HD2 LYS 2 2.822 -4.834 2.160
14 HD3 LYS 2 HD3 LYS 2 4.206 -4.667 1.076
15 HE2 LYS 2 HE2 LYS 2 2.080 -2.614 0.879
16 HE3 LYS 2 HE3 LYS 2 3.080 -2.592 2.330
17 HZ1 LYS 2 HZ1 LYS 2 4.635 -1.563 1.165
18 HZ2 LYS 2 HZ2 LYS 2 3.713 -1.668 -0.250
19 HZ3 LYS 2 HZ3 LYS 2 4.784 -2.912 0.156
20 H PHE 3 H PHE 3 5.431 -3.677 -1.460
21 HA PHE 3 HA PHE 3 6.439 -2.876 -4.026
22 HB2 PHE 3 HB2 PHE 3 8.570 -2.698 -2.957
23 HB3 PHE 3 HB3 PHE 3 7.370 -2.112 -1.810
24 HD1 PHE 3 HD1 PHE 3 6.849 -3.361 0.195
25 HD2 PHE 3 HD2 PHE 3 9.763 -4.759 -2.574
26 HE1 PHE 3 HE1 PHE 3 7.683 -4.949 1.880
27 HE2 PHE 3 HE2 PHE 3 10.601 -6.350 -0.895
28 HZ PHE 3 HZ PHE 3 9.561 -6.447 1.336
29 H ARG 4 H ARG 4 6.168 -5.848 -2.237
30 HA ARG 4 HA ARG 4 8.093 -7.422 -3.460
31 HB2 ARG 4 HB2 ARG 4 5.377 -8.066 -2.340
32 HB3 ARG 4 HB3 ARG 4 6.399 -9.318 -3.032
33 HG2 ARG 4 HG2 ARG 4 7.161 -7.520 -0.740
34 HG3 ARG 4 HG3 ARG 4 6.601 -9.187 -0.596
35 HD2 ARG 4 HD2 ARG 4 8.585 -9.607 -2.300
36 HD3 ARG 4 HD3 ARG 4 9.201 -8.126 -1.569
37 HE ARG 4 HE ARG 4 8.429 -9.850 0.487
38 HH11 ARG 4 HH11 ARG 4 10.812 -9.663 -2.044
39 HH12 ARG 4 HH12 ARG 4 11.991 -10.596 -1.182
40 HH21 ARG 4 HH21 ARG 4 9.972 -11.079 1.631
41 HH22 ARG 4 HH22 ARG 4 11.511 -11.402 0.908
42 H ARG 5 H ARG 5 5.036 -6.289 -4.681
43 HA ARG 5 HA ARG 5 4.673 -8.101 -6.791
44 HB2 ARG 5 HB2 ARG 5 2.938 -6.527 -6.022
45 HB3 ARG 5 HB3 ARG 5 3.879 -5.187 -6.662
46 HG2 ARG 5 HG2 ARG 5 2.051 -5.796 -8.152
47 HG3 ARG 5 HG3 ARG 5 3.620 -6.056 -8.916
48 HD2 ARG 5 HD2 ARG 5 3.481 -8.438 -8.408
49 HD3 ARG 5 HD3 ARG 5 1.929 -8.186 -7.611
50 HE ARG 5 HE ARG 5 1.906 -7.255 -10.305
51 HH11 ARG 5 HH11 ARG 5 1.689 -10.114 -8.330
52 HH12 ARG 5 HH12 ARG 5 0.766 -11.006 -9.494
53 HH21 ARG 5 HH21 ARG 5 0.691 -8.419 -11.845
54 HH22 ARG 5 HH22 ARG 5 0.200 -10.041 -11.493
55 H TYR 6 H TYR 6 6.468 -5.060 -6.608
56 HA TYR 6 HA TYR 6 7.149 -4.911 -9.343
57 HB2 TYR 6 HB2 TYR 6 8.420 -3.734 -6.872
58 HB3 TYR 6 HB3 TYR 6 9.009 -3.399 -8.496
59 HD1 TYR 6 HD1 TYR 6 6.491 -3.139 -10.002
60 HD2 TYR 6 HD2 TYR 6 7.527 -1.715 -6.129
61 HE1 TYR 6 HE1 TYR 6 4.841 -1.331 -10.232
62 HE2 TYR 6 HE2 TYR 6 5.878 0.097 -6.348
63 HH TYR 6 HH TYR 6 4.495 1.168 -7.753
64 H LEU 7 H LEU 7 8.440 -6.729 -6.691
65 HA LEU 7 HA LEU 7 10.922 -7.357 -8.038
66 HB2 LEU 7 HB2 LEU 7 9.685 -7.989 -5.414
67 HB3 LEU 7 HB3 LEU 7 10.905 -9.100 -6.033
68 HG LEU 7 HG LEU 7 11.884 -7.494 -4.492
69 HD11 LEU 7 HD11 LEU 7 12.948 -8.278 -6.794
70 HD12 LEU 7 HD12 LEU 7 13.776 -7.168 -5.704
71 HD13 LEU 7 HD13 LEU 7 12.908 -6.543 -7.106
72 HD21 LEU 7 HD21 LEU 7 11.527 -5.276 -4.533
73 HD22 LEU 7 HD22 LEU 7 10.099 -5.705 -5.474
74 HD23 LEU 7 HD23 LEU 7 11.574 -5.195 -6.294
75 H SER 8 H SER 8 7.745 -8.699 -7.721
76 HA SER 8 HA SER 8 8.533 -11.320 -8.675
77 HB2 SER 8 HB2 SER 8 6.612 -10.794 -7.022
78 HB3 SER 8 HB3 SER 8 5.694 -10.342 -8.458
79 HG SER 8 HG SER 8 5.306 -12.395 -8.623
80 H VAL 9 H VAL 9 6.732 -8.517 -9.882
81 HA VAL 9 HA VAL 9 5.913 -9.503 -12.337
82 HB VAL 9 HB VAL 9 5.901 -7.176 -13.135
83 HG11 VAL 9 HG11 VAL 9 3.952 -7.317 -12.041
84 HG12 VAL 9 HG12 VAL 9 4.690 -8.089 -10.635
85 HG13 VAL 9 HG13 VAL 9 4.740 -6.334 -10.807
86 HG21 VAL 9 HG21 VAL 9 7.722 -6.034 -12.390
87 HG22 VAL 9 HG22 VAL 9 6.568 -5.520 -11.159
88 HG23 VAL 9 HG23 VAL 9 7.708 -6.820 -10.812
89 H PHE 10 H PHE 10 9.067 -8.376 -11.325
90 HA PHE 10 HA PHE 10 10.245 -8.049 -13.852
91 HB2 PHE 10 HB2 PHE 10 11.241 -8.460 -11.080
92 HB3 PHE 10 HB3 PHE 10 12.375 -8.757 -12.393
93 HD1 PHE 10 HD1 PHE 10 9.688 -6.205 -12.062
94 HD2 PHE 10 HD2 PHE 10 13.859 -6.988 -12.376
95 HE1 PHE 10 HE1 PHE 10 10.125 -3.789 -12.223
96 HE2 PHE 10 HE2 PHE 10 14.304 -4.574 -12.536
97 HZ PHE 10 HZ PHE 10 12.436 -2.971 -12.460
98 H PHE 11 H PHE 11 9.515 -10.880 -11.984
99 HA PHE 11 HA PHE 11 11.192 -12.600 -13.619
100 HB2 PHE 11 HB2 PHE 11 9.449 -13.024 -11.212
101 HB3 PHE 11 HB3 PHE 11 9.988 -14.400 -12.169
102 HD1 PHE 11 HD1 PHE 11 11.336 -11.371 -10.470
103 HD2 PHE 11 HD2 PHE 11 11.985 -15.411 -11.640
104 HE1 PHE 11 HE1 PHE 11 13.471 -11.378 -9.247
105 HE2 PHE 11 HE2 PHE 11 14.121 -15.426 -10.418
106 HZ PHE 11 HZ PHE 11 14.867 -13.407 -9.221
107 H ARG 12 H ARG 12 7.758 -11.965 -13.068
108 HA ARG 12 HA ARG 12 6.778 -13.979 -14.793
109 HB2 ARG 12 HB2 ARG 12 5.438 -11.371 -14.056
110 HB3 ARG 12 HB3 ARG 12 4.650 -12.827 -14.650
111 HG2 ARG 12 HG2 ARG 12 6.211 -12.781 -12.087
112 HG3 ARG 12 HG3 ARG 12 4.497 -12.368 -12.165
113 HD2 ARG 12 HD2 ARG 12 4.324 -14.650 -13.442
114 HD3 ARG 12 HD3 ARG 12 5.846 -14.990 -12.620
115 HE ARG 12 HE ARG 12 3.227 -14.845 -11.436
116 HH11 ARG 12 HH11 ARG 12 6.656 -14.627 -10.870
117 HH12 ARG 12 HH12 ARG 12 6.535 -15.020 -9.187
118 HH21 ARG 12 HH21 ARG 12 3.055 -15.364 -9.221
119 HH22 ARG 12 HH22 ARG 12 4.487 -15.440 -8.250
120 H LYS 13 H LYS 13 7.903 -10.718 -15.321
121 HA LYS 13 HA LYS 13 6.795 -10.208 -17.832
122 HB2 LYS 13 HB2 LYS 13 8.055 -8.589 -16.359
123 HB3 LYS 13 HB3 LYS 13 9.541 -9.338 -16.927
124 HG2 LYS 13 HG2 LYS 13 9.402 -7.574 -18.361
125 HG3 LYS 13 HG3 LYS 13 8.526 -8.794 -19.290
126 HD2 LYS 13 HD2 LYS 13 7.245 -6.783 -19.361
127 HD3 LYS 13 HD3 LYS 13 6.407 -7.905 -18.286
128 HE2 LYS 13 HE2 LYS 13 6.906 -6.689 -16.407
129 HE3 LYS 13 HE3 LYS 13 8.372 -6.004 -17.108
130 HZ1 LYS 13 HZ1 LYS 13 7.018 -4.576 -18.490
131 HZ2 LYS 13 HZ2 LYS 13 6.613 -4.351 -16.863
132 HZ3 LYS 13 HZ3 LYS 13 5.600 -5.257 -17.869
133 H HIS 14 H HIS 14 9.926 -11.685 -17.008
134 HA HIS 14 HA HIS 14 10.416 -12.355 -19.786
135 HB2 HIS 14 HB2 HIS 14 11.977 -12.624 -17.239
136 HB3 HIS 14 HB3 HIS 14 12.462 -13.531 -18.669
137 HD1 HIS 14 HD1 HIS 14 12.467 -11.709 -20.910
138 HD2 HIS 14 HD2 HIS 14 13.400 -10.346 -17.097
139 HE1 HIS 14 HE1 HIS 14 13.773 -9.588 -21.255
140 H ILE 15 H ILE 15 10.389 -14.269 -16.772
141 HA ILE 15 HA ILE 15 10.231 -16.771 -17.979
142 HB ILE 15 HB ILE 15 9.101 -15.959 -15.298
143 HG12 ILE 15 HG12 ILE 15 11.768 -17.254 -15.849
144 HG13 ILE 15 HG13 ILE 15 11.574 -15.506 -15.779
145 HG21 ILE 15 HG21 ILE 15 9.570 -18.408 -14.788
146 HG22 ILE 15 HG22 ILE 15 8.178 -18.057 -15.810
147 HG23 ILE 15 HG23 ILE 15 9.678 -18.635 -16.533
148 HD11 ILE 15 HD11 ILE 15 10.698 -15.744 -13.480
149 HD12 ILE 15 HD12 ILE 15 11.046 -17.471 -13.565
150 HD13 ILE 15 HD13 ILE 15 12.362 -16.300 -13.664
151 H THR 16 H THR 16 7.510 -15.294 -16.221
152 HA THR 16 HA THR 16 5.581 -16.894 -17.559
153 HB THR 16 HB THR 16 5.036 -14.341 -16.041
154 HG1 THR 16 HG1 THR 16 5.118 -16.971 -14.959
155 HG21 THR 16 HG21 THR 16 3.327 -15.974 -17.440
156 HG22 THR 16 HG22 THR 16 2.863 -14.899 -16.121
157 HG23 THR 16 HG23 THR 16 3.198 -16.600 -15.797
Start of MODEL 4
1 H1 GLU 1 H1 GLU 1 -0.463 0.170 -2.591
2 HA GLU 1 HA GLU 1 1.861 0.457 -2.373
3 HB2 GLU 1 HB2 GLU 1 2.303 0.735 0.091
4 HB3 GLU 1 HB3 GLU 1 0.901 1.603 -0.519
5 HG2 GLU 1 HG2 GLU 1 0.544 -1.111 0.655
6 HG3 GLU 1 HG3 GLU 1 0.769 0.277 1.718
7 H LYS 2 H LYS 2 1.737 -2.073 -3.246
8 HA LYS 2 HA LYS 2 3.374 -3.636 -1.363
9 HB2 LYS 2 HB2 LYS 2 1.601 -4.491 -3.649
10 HB3 LYS 2 HB3 LYS 2 2.749 -5.579 -2.880
11 HG2 LYS 2 HG2 LYS 2 0.723 -4.120 -1.237
12 HG3 LYS 2 HG3 LYS 2 0.281 -5.586 -2.117
13 HD2 LYS 2 HD2 LYS 2 0.925 -6.512 -0.129
14 HD3 LYS 2 HD3 LYS 2 2.479 -6.507 -0.968
15 HE2 LYS 2 HE2 LYS 2 3.302 -4.766 0.287
16 HE3 LYS 2 HE3 LYS 2 1.700 -4.118 0.634
17 HZ1 LYS 2 HZ1 LYS 2 3.142 -5.470 2.403
18 HZ2 LYS 2 HZ2 LYS 2 2.273 -6.751 1.720
19 HZ3 LYS 2 HZ3 LYS 2 1.450 -5.448 2.416
20 H PHE 3 H PHE 3 5.468 -3.333 -1.767
21 HA PHE 3 HA PHE 3 6.436 -2.702 -4.405
22 HB2 PHE 3 HB2 PHE 3 8.575 -2.421 -3.385
23 HB3 PHE 3 HB3 PHE 3 7.390 -1.765 -2.260
24 HD1 PHE 3 HD1 PHE 3 6.902 -2.891 -0.168
25 HD2 PHE 3 HD2 PHE 3 9.813 -4.420 -2.870
26 HE1 PHE 3 HE1 PHE 3 7.783 -4.346 1.610
27 HE2 PHE 3 HE2 PHE 3 10.698 -5.878 -1.097
28 HZ PHE 3 HZ PHE 3 9.684 -5.842 1.146
29 H ARG 4 H ARG 4 6.169 -5.524 -2.397
30 HA ARG 4 HA ARG 4 8.095 -7.181 -3.533
31 HB2 ARG 4 HB2 ARG 4 5.442 -7.717 -2.231
32 HB3 ARG 4 HB3 ARG 4 6.393 -9.037 -2.899
33 HG2 ARG 4 HG2 ARG 4 7.576 -7.103 -0.942
34 HG3 ARG 4 HG3 ARG 4 6.642 -8.502 -0.411
35 HD2 ARG 4 HD2 ARG 4 8.230 -9.823 -1.991
36 HD3 ARG 4 HD3 ARG 4 9.266 -8.404 -1.842
37 HE ARG 4 HE ARG 4 8.441 -9.292 0.713
38 HH11 ARG 4 HH11 ARG 4 10.578 -10.111 -1.910
39 HH12 ARG 4 HH12 ARG 4 11.716 -10.938 -0.898
40 HH21 ARG 4 HH21 ARG 4 9.931 -10.378 2.056
41 HH22 ARG 4 HH22 ARG 4 11.346 -11.090 1.358
42 H ARG 5 H ARG 5 5.002 -6.154 -4.746
43 HA ARG 5 HA ARG 5 4.624 -8.158 -6.697
44 HB2 ARG 5 HB2 ARG 5 2.871 -6.563 -5.905
45 HB3 ARG 5 HB3 ARG 5 3.682 -5.289 -6.805
46 HG2 ARG 5 HG2 ARG 5 1.773 -6.168 -8.030
47 HG3 ARG 5 HG3 ARG 5 3.283 -6.486 -8.886
48 HD2 ARG 5 HD2 ARG 5 3.246 -8.758 -8.351
49 HD3 ARG 5 HD3 ARG 5 2.095 -8.522 -7.036
50 HE ARG 5 HE ARG 5 1.494 -8.874 -9.828
51 HH11 ARG 5 HH11 ARG 5 0.361 -7.635 -6.778
52 HH12 ARG 5 HH12 ARG 5 -1.314 -7.730 -7.213
53 HH21 ARG 5 HH21 ARG 5 -0.707 -9.003 -10.412
54 HH22 ARG 5 HH22 ARG 5 -1.920 -8.509 -9.280
55 H TYR 6 H TYR 6 6.196 -4.985 -6.818
56 HA TYR 6 HA TYR 6 6.754 -4.937 -9.559
57 HB2 TYR 6 HB2 TYR 6 8.274 -3.698 -7.257
58 HB3 TYR 6 HB3 TYR 6 8.544 -3.311 -8.953
59 HD1 TYR 6 HD1 TYR 6 5.858 -3.102 -10.038
60 HD2 TYR 6 HD2 TYR 6 7.349 -1.819 -6.265
61 HE1 TYR 6 HE1 TYR 6 4.097 -1.389 -9.931
62 HE2 TYR 6 HE2 TYR 6 5.591 -0.103 -6.147
63 HH TYR 6 HH TYR 6 3.643 0.720 -8.834
64 H LEU 7 H LEU 7 8.256 -6.652 -6.949
65 HA LEU 7 HA LEU 7 10.673 -7.253 -8.405
66 HB2 LEU 7 HB2 LEU 7 9.555 -7.898 -5.735
67 HB3 LEU 7 HB3 LEU 7 10.752 -9.006 -6.401
68 HG LEU 7 HG LEU 7 11.796 -7.399 -4.911
69 HD11 LEU 7 HD11 LEU 7 12.577 -7.970 -7.530
70 HD12 LEU 7 HD12 LEU 7 13.599 -7.420 -6.202
71 HD13 LEU 7 HD13 LEU 7 12.887 -6.248 -7.311
72 HD21 LEU 7 HD21 LEU 7 9.992 -5.621 -5.522
73 HD22 LEU 7 HD22 LEU 7 11.137 -5.168 -6.786
74 HD23 LEU 7 HD23 LEU 7 11.624 -5.106 -5.092
75 H SER 8 H SER 8 7.543 -8.673 -7.945
76 HA SER 8 HA SER 8 8.337 -11.274 -8.931
77 HB2 SER 8 HB2 SER 8 6.508 -10.918 -7.225
78 HB3 SER 8 HB3 SER 8 5.527 -10.236 -8.522
79 HG SER 8 HG SER 8 4.985 -12.330 -8.546
80 H VAL 9 H VAL 9 6.572 -8.452 -10.114
81 HA VAL 9 HA VAL 9 5.745 -9.534 -12.576
82 HB VAL 9 HB VAL 9 5.466 -7.213 -13.325
83 HG11 VAL 9 HG11 VAL 9 3.619 -6.924 -12.072
84 HG12 VAL 9 HG12 VAL 9 4.075 -8.481 -11.378
85 HG13 VAL 9 HG13 VAL 9 4.513 -6.984 -10.553
86 HG21 VAL 9 HG21 VAL 9 7.048 -6.608 -10.843
87 HG22 VAL 9 HG22 VAL 9 7.354 -6.087 -12.500
88 HG23 VAL 9 HG23 VAL 9 5.997 -5.410 -11.599
89 H PHE 10 H PHE 10 8.763 -8.117 -11.527
90 HA PHE 10 HA PHE 10 9.882 -7.657 -14.082
91 HB2 PHE 10 HB2 PHE 10 10.825 -6.591 -12.123
92 HB3 PHE 10 HB3 PHE 10 11.201 -8.156 -11.408
93 HD1 PHE 10 HD1 PHE 10 11.916 -6.146 -14.464
94 HD2 PHE 10 HD2 PHE 10 13.330 -8.994 -11.634
95 HE1 PHE 10 HE1 PHE 10 14.137 -6.088 -15.520
96 HE2 PHE 10 HE2 PHE 10 15.554 -8.939 -12.685
97 HZ PHE 10 HZ PHE 10 15.960 -7.486 -14.632
98 H PHE 11 H PHE 11 9.512 -10.498 -12.137
99 HA PHE 11 HA PHE 11 11.441 -12.027 -13.677
100 HB2 PHE 11 HB2 PHE 11 9.725 -12.576 -11.285
101 HB3 PHE 11 HB3 PHE 11 10.384 -13.926 -12.202
102 HD1 PHE 11 HD1 PHE 11 11.725 -10.627 -11.080
103 HD2 PHE 11 HD2 PHE 11 12.196 -14.856 -11.160
104 HE1 PHE 11 HE1 PHE 11 13.851 -10.410 -9.860
105 HE2 PHE 11 HE2 PHE 11 14.322 -14.647 -9.940
106 HZ PHE 11 HZ PHE 11 15.152 -12.422 -9.288
107 H ARG 12 H ARG 12 7.936 -11.863 -13.220
108 HA ARG 12 HA ARG 12 7.237 -14.029 -14.857
109 HB2 ARG 12 HB2 ARG 12 5.658 -11.499 -14.362
110 HB3 ARG 12 HB3 ARG 12 5.012 -13.027 -14.945
111 HG2 ARG 12 HG2 ARG 12 6.456 -12.979 -12.344
112 HG3 ARG 12 HG3 ARG 12 4.811 -12.346 -12.426
113 HD2 ARG 12 HD2 ARG 12 4.324 -14.591 -13.672
114 HD3 ARG 12 HD3 ARG 12 5.804 -15.127 -12.877
115 HE ARG 12 HE ARG 12 4.112 -13.931 -10.977
116 HH11 ARG 12 HH11 ARG 12 4.342 -16.785 -12.958
117 HH12 ARG 12 HH12 ARG 12 3.440 -17.778 -11.862
118 HH21 ARG 12 HH21 ARG 12 2.922 -15.228 -9.525
119 HH22 ARG 12 HH22 ARG 12 2.632 -16.891 -9.910
120 H LYS 13 H LYS 13 8.141 -10.751 -15.610
121 HA LYS 13 HA LYS 13 7.117 -10.520 -18.196
122 HB2 LYS 13 HB2 LYS 13 8.333 -8.782 -16.691
123 HB3 LYS 13 HB3 LYS 13 9.798 -9.393 -17.449
124 HG2 LYS 13 HG2 LYS 13 9.177 -7.506 -18.695
125 HG3 LYS 13 HG3 LYS 13 8.692 -8.895 -19.671
126 HD2 LYS 13 HD2 LYS 13 6.856 -7.451 -19.783
127 HD3 LYS 13 HD3 LYS 13 6.398 -8.633 -18.554
128 HE2 LYS 13 HE2 LYS 13 7.497 -6.880 -16.931
129 HE3 LYS 13 HE3 LYS 13 7.156 -5.765 -18.253
130 HZ1 LYS 13 HZ1 LYS 13 4.987 -7.528 -17.429
131 HZ2 LYS 13 HZ2 LYS 13 4.939 -5.913 -17.930
132 HZ3 LYS 13 HZ3 LYS 13 5.410 -6.295 -16.351
133 H HIS 14 H HIS 14 10.234 -11.812 -17.091
134 HA HIS 14 HA HIS 14 10.885 -12.658 -19.803
135 HB2 HIS 14 HB2 HIS 14 12.502 -13.050 -17.279
136 HB3 HIS 14 HB3 HIS 14 13.069 -13.210 -18.939
137 HD1 HIS 14 HD1 HIS 14 12.887 -10.841 -20.353
138 HD2 HIS 14 HD2 HIS 14 12.997 -10.618 -16.206
139 HE1 HIS 14 HE1 HIS 14 13.559 -8.476 -19.824
140 H ILE 15 H ILE 15 10.989 -14.260 -16.615
141 HA ILE 15 HA ILE 15 11.072 -16.870 -17.513
142 HB ILE 15 HB ILE 15 9.696 -15.864 -15.019
143 HG12 ILE 15 HG12 ILE 15 12.481 -16.993 -15.227
144 HG13 ILE 15 HG13 ILE 15 12.166 -15.273 -15.431
145 HG21 ILE 15 HG21 ILE 15 10.574 -18.282 -14.328
146 HG22 ILE 15 HG22 ILE 15 8.981 -18.018 -15.036
147 HG23 ILE 15 HG23 ILE 15 10.314 -18.571 -16.048
148 HD11 ILE 15 HD11 ILE 15 10.864 -16.119 -13.065
149 HD12 ILE 15 HD12 ILE 15 12.513 -16.740 -13.037
150 HD13 ILE 15 HD13 ILE 15 12.225 -15.012 -13.241
151 H THR 16 H THR 16 8.117 -15.478 -16.097
152 HA THR 16 HA THR 16 6.427 -17.391 -17.334
153 HB THR 16 HB THR 16 5.613 -14.724 -16.166
154 HG1 THR 16 HG1 THR 16 6.837 -16.059 -14.696
155 HG21 THR 16 HG21 THR 16 3.569 -16.299 -15.602
156 HG22 THR 16 HG22 THR 16 4.157 -17.184 -17.009
157 HG23 THR 16 HG23 THR 16 3.693 -15.490 -17.164
Start of MODEL 5
1 H1 GLU 1 H1 GLU 1 -0.200 -2.501 -2.359
2 HA GLU 1 HA GLU 1 1.274 -3.071 -4.814
3 HB2 GLU 1 HB2 GLU 1 1.034 -0.257 -3.748
4 HB3 GLU 1 HB3 GLU 1 1.856 -0.774 -5.214
5 HG2 GLU 1 HG2 GLU 1 -0.360 -1.518 -6.095
6 HG3 GLU 1 HG3 GLU 1 -1.103 -0.763 -4.686
7 H LYS 2 H LYS 2 2.987 -4.102 -4.011
8 HA LYS 2 HA LYS 2 4.555 -2.752 -1.928
9 HB2 LYS 2 HB2 LYS 2 3.966 -5.717 -1.996
10 HB3 LYS 2 HB3 LYS 2 5.024 -4.907 -0.849
11 HG2 LYS 2 HG2 LYS 2 3.172 -3.715 0.105
12 HG3 LYS 2 HG3 LYS 2 2.081 -4.343 -1.132
13 HD2 LYS 2 HD2 LYS 2 2.432 -6.612 -0.301
14 HD3 LYS 2 HD3 LYS 2 3.550 -5.999 0.920
15 HE2 LYS 2 HE2 LYS 2 1.859 -4.978 2.136
16 HE3 LYS 2 HE3 LYS 2 0.760 -4.932 0.759
17 HZ1 LYS 2 HZ1 LYS 2 0.619 -7.381 0.915
18 HZ2 LYS 2 HZ2 LYS 2 0.019 -6.592 2.286
19 HZ3 LYS 2 HZ3 LYS 2 1.542 -7.325 2.331
20 H PHE 3 H PHE 3 6.816 -3.407 -1.877
21 HA PHE 3 HA PHE 3 7.985 -3.443 -4.424
22 HB2 PHE 3 HB2 PHE 3 10.090 -3.586 -3.308
23 HB3 PHE 3 HB3 PHE 3 9.039 -2.617 -2.280
24 HD1 PHE 3 HD1 PHE 3 7.921 -3.754 -0.308
25 HD2 PHE 3 HD2 PHE 3 11.129 -5.503 -2.490
26 HE1 PHE 3 HE1 PHE 3 8.379 -5.262 1.581
27 HE2 PHE 3 HE2 PHE 3 11.592 -7.015 -0.605
28 HZ PHE 3 HZ PHE 3 10.217 -6.894 1.435
29 H ARG 4 H ARG 4 6.997 -6.008 -2.303
30 HA ARG 4 HA ARG 4 8.552 -8.104 -3.343
31 HB2 ARG 4 HB2 ARG 4 5.924 -7.980 -1.901
32 HB3 ARG 4 HB3 ARG 4 6.516 -9.511 -2.530
33 HG2 ARG 4 HG2 ARG 4 8.691 -8.876 -1.238
34 HG3 ARG 4 HG3 ARG 4 7.606 -7.815 -0.337
35 HD2 ARG 4 HD2 ARG 4 6.136 -10.003 -0.216
36 HD3 ARG 4 HD3 ARG 4 7.695 -10.787 -0.467
37 HE ARG 4 HE ARG 4 8.204 -9.069 1.550
38 HH11 ARG 4 HH11 ARG 4 5.732 -11.467 1.041
39 HH12 ARG 4 HH12 ARG 4 5.543 -11.819 2.726
40 HH21 ARG 4 HH21 ARG 4 7.964 -9.523 3.772
41 HH22 ARG 4 HH22 ARG 4 6.813 -10.712 4.279
42 H ARG 5 H ARG 5 5.554 -6.642 -4.425
43 HA ARG 5 HA ARG 5 4.983 -8.664 -6.377
44 HB2 ARG 5 HB2 ARG 5 3.132 -7.427 -5.502
45 HB3 ARG 5 HB3 ARG 5 3.886 -5.892 -5.913
46 HG2 ARG 5 HG2 ARG 5 3.378 -7.765 -8.142
47 HG3 ARG 5 HG3 ARG 5 1.972 -7.012 -7.387
48 HD2 ARG 5 HD2 ARG 5 4.280 -5.275 -8.078
49 HD3 ARG 5 HD3 ARG 5 3.275 -5.873 -9.398
50 HE ARG 5 HE ARG 5 2.608 -3.824 -7.555
51 HH11 ARG 5 HH11 ARG 5 1.239 -6.480 -9.342
52 HH12 ARG 5 HH12 ARG 5 -0.349 -5.791 -9.402
53 HH21 ARG 5 HH21 ARG 5 0.520 -2.907 -7.627
54 HH22 ARG 5 HH22 ARG 5 -0.757 -3.759 -8.426
55 H TYR 6 H TYR 6 6.492 -5.473 -6.402
56 HA TYR 6 HA TYR 6 6.765 -5.291 -9.220
57 HB2 TYR 6 HB2 TYR 6 8.226 -3.904 -6.968
58 HB3 TYR 6 HB3 TYR 6 8.458 -3.511 -8.668
59 HD1 TYR 6 HD1 TYR 6 5.728 -3.600 -9.719
60 HD2 TYR 6 HD2 TYR 6 7.172 -2.060 -6.025
61 HE1 TYR 6 HE1 TYR 6 3.819 -2.052 -9.625
62 HE2 TYR 6 HE2 TYR 6 5.267 -0.509 -5.920
63 HH TYR 6 HH TYR 6 3.680 0.567 -7.524
64 H LEU 7 H LEU 7 8.596 -6.857 -6.730
65 HA LEU 7 HA LEU 7 10.971 -7.185 -8.335
66 HB2 LEU 7 HB2 LEU 7 10.091 -8.234 -5.664
67 HB3 LEU 7 HB3 LEU 7 11.570 -8.795 -6.440
68 HG LEU 7 HG LEU 7 10.975 -5.957 -5.603
69 HD11 LEU 7 HD11 LEU 7 11.424 -7.674 -3.794
70 HD12 LEU 7 HD12 LEU 7 12.495 -6.274 -3.834
71 HD13 LEU 7 HD13 LEU 7 13.044 -7.822 -4.476
72 HD21 LEU 7 HD21 LEU 7 12.447 -5.523 -7.255
73 HD22 LEU 7 HD22 LEU 7 13.063 -7.175 -7.289
74 HD23 LEU 7 HD23 LEU 7 13.630 -6.048 -6.056
75 H SER 8 H SER 8 8.036 -8.925 -7.730
76 HA SER 8 HA SER 8 9.046 -11.416 -8.811
77 HB2 SER 8 HB2 SER 8 6.941 -12.349 -8.263
78 HB3 SER 8 HB3 SER 8 7.278 -11.204 -6.966
79 HG SER 8 HG SER 8 5.273 -11.202 -8.814
80 H VAL 9 H VAL 9 6.749 -8.887 -9.771
81 HA VAL 9 HA VAL 9 5.878 -9.968 -12.174
82 HB VAL 9 HB VAL 9 5.369 -7.676 -12.884
83 HG11 VAL 9 HG11 VAL 9 4.508 -7.218 -10.219
84 HG12 VAL 9 HG12 VAL 9 3.585 -7.865 -11.577
85 HG13 VAL 9 HG13 VAL 9 4.473 -8.956 -10.514
86 HG21 VAL 9 HG21 VAL 9 5.954 -5.946 -10.942
87 HG22 VAL 9 HG22 VAL 9 7.336 -7.028 -10.766
88 HG23 VAL 9 HG23 VAL 9 7.029 -6.233 -12.310
89 H PHE 10 H PHE 10 8.880 -8.363 -11.392
90 HA PHE 10 HA PHE 10 9.737 -7.798 -14.020
91 HB2 PHE 10 HB2 PHE 10 11.009 -7.962 -11.344
92 HB3 PHE 10 HB3 PHE 10 12.080 -8.104 -12.734
93 HD1 PHE 10 HD1 PHE 10 9.028 -6.034 -12.231
94 HD2 PHE 10 HD2 PHE 10 13.234 -6.112 -12.880
95 HE1 PHE 10 HE1 PHE 10 9.033 -3.585 -12.472
96 HE2 PHE 10 HE2 PHE 10 13.246 -3.663 -13.122
97 HZ PHE 10 HZ PHE 10 11.143 -2.397 -12.919
98 H PHE 11 H PHE 11 9.690 -10.705 -12.137
99 HA PHE 11 HA PHE 11 11.528 -12.090 -13.913
100 HB2 PHE 11 HB2 PHE 11 10.141 -12.762 -11.350
101 HB3 PHE 11 HB3 PHE 11 10.719 -14.073 -12.374
102 HD1 PHE 11 HD1 PHE 11 11.992 -10.797 -11.110
103 HD2 PHE 11 HD2 PHE 11 12.774 -14.917 -11.839
104 HE1 PHE 11 HE1 PHE 11 14.249 -10.532 -10.165
105 HE2 PHE 11 HE2 PHE 11 15.032 -14.659 -10.894
106 HZ PHE 11 HZ PHE 11 15.771 -12.465 -10.055
107 H ARG 12 H ARG 12 8.092 -12.130 -13.067
108 HA ARG 12 HA ARG 12 7.365 -14.291 -14.727
109 HB2 ARG 12 HB2 ARG 12 5.629 -11.962 -13.891
110 HB3 ARG 12 HB3 ARG 12 5.081 -13.550 -14.413
111 HG2 ARG 12 HG2 ARG 12 6.785 -13.137 -11.973
112 HG3 ARG 12 HG3 ARG 12 5.021 -13.106 -11.935
113 HD2 ARG 12 HD2 ARG 12 6.427 -15.416 -13.198
114 HD3 ARG 12 HD3 ARG 12 6.324 -15.321 -11.441
115 HE ARG 12 HE ARG 12 4.237 -16.034 -13.228
116 HH11 ARG 12 HH11 ARG 12 4.871 -14.365 -10.239
117 HH12 ARG 12 HH12 ARG 12 3.287 -14.646 -9.595
118 HH21 ARG 12 HH21 ARG 12 2.149 -16.410 -12.391
119 HH22 ARG 12 HH22 ARG 12 1.740 -15.810 -10.820
120 H LYS 13 H LYS 13 7.930 -10.922 -15.356
121 HA LYS 13 HA LYS 13 6.529 -10.648 -17.774
122 HB2 LYS 13 HB2 LYS 13 7.448 -8.747 -16.504
123 HB3 LYS 13 HB3 LYS 13 9.078 -9.272 -16.904
124 HG2 LYS 13 HG2 LYS 13 8.685 -7.584 -18.431
125 HG3 LYS 13 HG3 LYS 13 8.312 -9.041 -19.355
126 HD2 LYS 13 HD2 LYS 13 6.573 -7.483 -19.795
127 HD3 LYS 13 HD3 LYS 13 5.901 -8.701 -18.707
128 HE2 LYS 13 HE2 LYS 13 5.899 -7.254 -16.889
129 HE3 LYS 13 HE3 LYS 13 7.099 -6.185 -17.614
130 HZ1 LYS 13 HZ1 LYS 13 4.774 -5.312 -17.579
131 HZ2 LYS 13 HZ2 LYS 13 4.358 -6.514 -18.694
132 HZ3 LYS 13 HZ3 LYS 13 5.495 -5.334 -19.109
133 H HIS 14 H HIS 14 9.945 -11.464 -17.184
134 HA HIS 14 HA HIS 14 10.364 -12.073 -19.982
135 HB2 HIS 14 HB2 HIS 14 12.137 -12.187 -17.545
136 HB3 HIS 14 HB3 HIS 14 12.665 -12.773 -19.120
137 HD1 HIS 14 HD1 HIS 14 12.198 -10.767 -21.085
138 HD2 HIS 14 HD2 HIS 14 12.927 -9.645 -17.151
139 HE1 HIS 14 HE1 HIS 14 12.957 -8.372 -21.199
140 H ILE 15 H ILE 15 10.776 -13.933 -16.962
141 HA ILE 15 HA ILE 15 11.039 -16.436 -18.169
142 HB ILE 15 HB ILE 15 9.896 -15.829 -15.440
143 HG12 ILE 15 HG12 ILE 15 12.736 -16.586 -16.121
144 HG13 ILE 15 HG13 ILE 15 12.210 -14.910 -16.006
145 HG21 ILE 15 HG21 ILE 15 10.794 -18.345 -16.774
146 HG22 ILE 15 HG22 ILE 15 10.964 -18.165 -15.029
147 HG23 ILE 15 HG23 ILE 15 9.371 -18.051 -15.775
148 HD11 ILE 15 HD11 ILE 15 12.462 -14.950 -13.814
149 HD12 ILE 15 HD12 ILE 15 11.369 -16.327 -13.675
150 HD13 ILE 15 HD13 ILE 15 13.092 -16.592 -13.945
151 H THR 16 H THR 16 8.180 -15.453 -16.287
152 HA THR 16 HA THR 16 6.514 -17.373 -17.579
153 HB THR 16 HB THR 16 5.735 -15.034 -15.826
154 HG1 THR 16 HG1 THR 16 5.471 -17.033 -14.368
155 HG21 THR 16 HG21 THR 16 3.752 -15.644 -16.878
156 HG22 THR 16 HG22 THR 16 3.730 -16.631 -15.417
157 HG23 THR 16 HG23 THR 16 4.202 -17.347 -16.958
Start of MODEL 6
1 H1 GLU 1 H1 GLU 1 0.569 -0.042 -0.874
2 HA GLU 1 HA GLU 1 3.312 0.548 -1.773
3 HB2 GLU 1 HB2 GLU 1 2.170 0.093 0.974
4 HB3 GLU 1 HB3 GLU 1 3.890 -0.079 0.655
5 HG2 GLU 1 HG2 GLU 1 3.837 2.269 -0.256
6 HG3 GLU 1 HG3 GLU 1 2.205 2.393 0.398
7 H LYS 2 H LYS 2 2.943 -1.288 -3.269
8 HA LYS 2 HA LYS 2 3.419 -3.860 -1.909
9 HB2 LYS 2 HB2 LYS 2 1.686 -3.150 -4.221
10 HB3 LYS 2 HB3 LYS 2 2.519 -4.698 -4.281
11 HG2 LYS 2 HG2 LYS 2 0.572 -5.330 -3.285
12 HG3 LYS 2 HG3 LYS 2 1.534 -4.948 -1.855
13 HD2 LYS 2 HD2 LYS 2 0.537 -2.674 -1.858
14 HD3 LYS 2 HD3 LYS 2 -0.496 -3.166 -3.202
15 HE2 LYS 2 HE2 LYS 2 -0.447 -4.752 -0.663
16 HE3 LYS 2 HE3 LYS 2 -1.411 -3.280 -0.776
17 HZ1 LYS 2 HZ1 LYS 2 -1.863 -5.871 -1.960
18 HZ2 LYS 2 HZ2 LYS 2 -2.089 -4.580 -3.030
19 HZ3 LYS 2 HZ3 LYS 2 -2.966 -4.645 -1.585
20 H PHE 3 H PHE 3 5.693 -3.078 -2.017
21 HA PHE 3 HA PHE 3 6.972 -2.908 -4.576
22 HB2 PHE 3 HB2 PHE 3 9.008 -2.620 -3.365
23 HB3 PHE 3 HB3 PHE 3 7.762 -1.760 -2.467
24 HD1 PHE 3 HD1 PHE 3 6.907 -2.666 -0.354
25 HD2 PHE 3 HD2 PHE 3 10.119 -4.516 -2.446
26 HE1 PHE 3 HE1 PHE 3 7.495 -3.930 1.674
27 HE2 PHE 3 HE2 PHE 3 10.712 -5.784 -0.422
28 HZ PHE 3 HZ PHE 3 9.399 -5.492 1.641
29 H ARG 4 H ARG 4 6.285 -5.431 -2.293
30 HA ARG 4 HA ARG 4 8.211 -7.313 -3.152
31 HB2 ARG 4 HB2 ARG 4 5.552 -7.613 -1.760
32 HB3 ARG 4 HB3 ARG 4 6.593 -8.984 -2.121
33 HG2 ARG 4 HG2 ARG 4 7.515 -6.613 -0.522
34 HG3 ARG 4 HG3 ARG 4 6.767 -8.037 0.204
35 HD2 ARG 4 HD2 ARG 4 8.597 -9.299 -1.209
36 HD3 ARG 4 HD3 ARG 4 9.419 -7.742 -1.119
37 HE ARG 4 HE ARG 4 8.518 -8.598 1.440
38 HH11 ARG 4 HH11 ARG 4 11.008 -9.089 -0.942
39 HH12 ARG 4 HH12 ARG 4 12.189 -9.618 0.210
40 HH21 ARG 4 HH21 ARG 4 10.063 -9.293 2.967
41 HH22 ARG 4 HH22 ARG 4 11.650 -9.734 2.434
42 H ARG 5 H ARG 5 5.145 -6.312 -4.426
43 HA ARG 5 HA ARG 5 4.735 -8.617 -6.081
44 HB2 ARG 5 HB2 ARG 5 2.845 -7.253 -5.346
45 HB3 ARG 5 HB3 ARG 5 3.502 -5.859 -6.194
46 HG2 ARG 5 HG2 ARG 5 1.821 -6.668 -7.593
47 HG3 ARG 5 HG3 ARG 5 3.319 -7.267 -8.309
48 HD2 ARG 5 HD2 ARG 5 1.736 -9.055 -8.318
49 HD3 ARG 5 HD3 ARG 5 2.952 -9.415 -7.093
50 HE ARG 5 HE ARG 5 0.849 -8.090 -5.835
51 HH11 ARG 5 HH11 ARG 5 1.436 -11.095 -7.491
52 HH12 ARG 5 HH12 ARG 5 0.234 -11.970 -6.602
53 HH21 ARG 5 HH21 ARG 5 -0.736 -9.231 -4.658
54 HH22 ARG 5 HH22 ARG 5 -1.002 -10.909 -4.992
55 H TYR 6 H TYR 6 5.947 -5.326 -6.604
56 HA TYR 6 HA TYR 6 6.290 -5.451 -9.368
57 HB2 TYR 6 HB2 TYR 6 7.753 -3.904 -7.234
58 HB3 TYR 6 HB3 TYR 6 8.110 -3.709 -8.946
59 HD1 TYR 6 HD1 TYR 6 5.707 -3.532 -10.346
60 HD2 TYR 6 HD2 TYR 6 6.477 -2.193 -6.382
61 HE1 TYR 6 HE1 TYR 6 3.875 -1.903 -10.547
62 HE2 TYR 6 HE2 TYR 6 4.647 -0.561 -6.571
63 HH TYR 6 HH TYR 6 3.413 0.521 -9.217
64 H LEU 7 H LEU 7 8.143 -6.853 -6.797
65 HA LEU 7 HA LEU 7 10.491 -7.351 -8.380
66 HB2 LEU 7 HB2 LEU 7 9.584 -8.398 -5.706
67 HB3 LEU 7 HB3 LEU 7 11.129 -8.809 -6.446
68 HG LEU 7 HG LEU 7 10.334 -5.976 -5.811
69 HD11 LEU 7 HD11 LEU 7 10.311 -7.390 -3.768
70 HD12 LEU 7 HD12 LEU 7 11.554 -6.140 -3.756
71 HD13 LEU 7 HD13 LEU 7 11.992 -7.814 -4.093
72 HD21 LEU 7 HD21 LEU 7 13.139 -6.886 -5.843
73 HD22 LEU 7 HD22 LEU 7 12.419 -5.394 -6.447
74 HD23 LEU 7 HD23 LEU 7 12.312 -6.873 -7.401
75 H SER 8 H SER 8 7.511 -8.995 -7.696
76 HA SER 8 HA SER 8 8.440 -11.559 -8.647
77 HB2 SER 8 HB2 SER 8 5.869 -10.475 -7.587
78 HB3 SER 8 HB3 SER 8 5.812 -11.938 -8.570
79 HG SER 8 HG SER 8 6.082 -12.270 -6.256
80 H VAL 9 H VAL 9 6.417 -8.919 -9.846
81 HA VAL 9 HA VAL 9 5.614 -10.157 -12.248
82 HB VAL 9 HB VAL 9 5.051 -7.910 -13.038
83 HG11 VAL 9 HG11 VAL 9 4.136 -9.109 -10.596
84 HG12 VAL 9 HG12 VAL 9 3.990 -7.353 -10.502
85 HG13 VAL 9 HG13 VAL 9 3.220 -8.234 -11.822
86 HG21 VAL 9 HG21 VAL 9 6.927 -6.637 -12.285
87 HG22 VAL 9 HG22 VAL 9 5.486 -5.971 -11.516
88 HG23 VAL 9 HG23 VAL 9 6.575 -7.010 -10.598
89 H PHE 10 H PHE 10 8.485 -8.373 -11.343
90 HA PHE 10 HA PHE 10 9.494 -7.781 -13.881
91 HB2 PHE 10 HB2 PHE 10 10.376 -6.942 -11.671
92 HB3 PHE 10 HB3 PHE 10 11.152 -8.508 -11.462
93 HD1 PHE 10 HD1 PHE 10 10.819 -6.299 -14.443
94 HD2 PHE 10 HD2 PHE 10 13.424 -8.198 -11.664
95 HE1 PHE 10 HE1 PHE 10 12.762 -5.500 -15.724
96 HE2 PHE 10 HE2 PHE 10 15.371 -7.401 -12.939
97 HZ PHE 10 HZ PHE 10 15.042 -6.050 -14.972
98 H PHE 11 H PHE 11 9.362 -10.764 -12.122
99 HA PHE 11 HA PHE 11 11.295 -12.082 -13.838
100 HB2 PHE 11 HB2 PHE 11 9.737 -12.836 -11.407
101 HB3 PHE 11 HB3 PHE 11 10.305 -14.127 -12.461
102 HD1 PHE 11 HD1 PHE 11 11.746 -10.936 -11.158
103 HD2 PHE 11 HD2 PHE 11 12.206 -15.134 -11.691
104 HE1 PHE 11 HE1 PHE 11 13.960 -10.825 -10.092
105 HE2 PHE 11 HE2 PHE 11 14.421 -15.030 -10.624
106 HZ PHE 11 HZ PHE 11 15.301 -12.873 -9.825
107 H ARG 12 H ARG 12 7.803 -12.124 -13.262
108 HA ARG 12 HA ARG 12 7.179 -14.192 -15.068
109 HB2 ARG 12 HB2 ARG 12 5.454 -11.856 -14.224
110 HB3 ARG 12 HB3 ARG 12 4.884 -13.351 -14.955
111 HG2 ARG 12 HG2 ARG 12 6.384 -13.318 -12.357
112 HG3 ARG 12 HG3 ARG 12 4.633 -13.113 -12.441
113 HD2 ARG 12 HD2 ARG 12 4.525 -15.268 -13.704
114 HD3 ARG 12 HD3 ARG 12 6.245 -15.480 -13.379
115 HE ARG 12 HE ARG 12 4.669 -15.035 -11.017
116 HH11 ARG 12 HH11 ARG 12 5.844 -17.416 -13.270
117 HH12 ARG 12 HH12 ARG 12 5.716 -18.730 -12.148
118 HH21 ARG 12 HH21 ARG 12 4.497 -16.757 -9.531
119 HH22 ARG 12 HH22 ARG 12 4.949 -18.354 -10.022
120 H LYS 13 H LYS 13 7.883 -10.825 -15.520
121 HA LYS 13 HA LYS 13 6.681 -10.378 -18.005
122 HB2 LYS 13 HB2 LYS 13 7.772 -8.671 -16.478
123 HB3 LYS 13 HB3 LYS 13 9.319 -9.207 -17.122
124 HG2 LYS 13 HG2 LYS 13 8.929 -7.441 -18.495
125 HG3 LYS 13 HG3 LYS 13 8.131 -8.709 -19.428
126 HD2 LYS 13 HD2 LYS 13 6.495 -7.100 -19.426
127 HD3 LYS 13 HD3 LYS 13 6.049 -8.009 -17.980
128 HE2 LYS 13 HE2 LYS 13 5.963 -5.772 -17.306
129 HE3 LYS 13 HE3 LYS 13 7.518 -6.347 -16.706
130 HZ1 LYS 13 HZ1 LYS 13 6.946 -4.324 -18.671
131 HZ2 LYS 13 HZ2 LYS 13 8.133 -5.423 -19.167
132 HZ3 LYS 13 HZ3 LYS 13 8.332 -4.555 -17.729
133 H HIS 14 H HIS 14 9.997 -11.446 -17.260
134 HA HIS 14 HA HIS 14 10.502 -12.014 -20.060
135 HB2 HIS 14 HB2 HIS 14 12.176 -12.176 -17.561
136 HB3 HIS 14 HB3 HIS 14 12.738 -12.838 -19.094
137 HD1 HIS 14 HD1 HIS 14 14.488 -11.229 -19.818
138 HD2 HIS 14 HD2 HIS 14 11.035 -9.309 -18.534
139 HE1 HIS 14 HE1 HIS 14 14.854 -8.790 -20.306
140 H ILE 15 H ILE 15 10.755 -13.917 -17.049
141 HA ILE 15 HA ILE 15 10.980 -16.418 -18.239
142 HB ILE 15 HB ILE 15 9.668 -15.776 -15.595
143 HG12 ILE 15 HG12 ILE 15 12.519 -16.640 -16.072
144 HG13 ILE 15 HG13 ILE 15 12.051 -14.945 -15.998
145 HG21 ILE 15 HG21 ILE 15 9.100 -17.964 -15.840
146 HG22 ILE 15 HG22 ILE 15 10.440 -18.306 -16.933
147 HG23 ILE 15 HG23 ILE 15 10.728 -18.178 -15.198
148 HD11 ILE 15 HD11 ILE 15 11.248 -16.724 -13.763
149 HD12 ILE 15 HD12 ILE 15 12.935 -16.226 -13.884
150 HD13 ILE 15 HD13 ILE 15 11.664 -15.010 -13.756
151 H THR 16 H THR 16 8.029 -15.344 -16.561
152 HA THR 16 HA THR 16 6.392 -17.208 -17.958
153 HB THR 16 HB THR 16 5.565 -14.811 -16.309
154 HG1 THR 16 HG1 THR 16 6.050 -17.537 -15.658
155 HG21 THR 16 HG21 THR 16 3.488 -15.287 -16.961
156 HG22 THR 16 HG22 THR 16 3.648 -16.857 -16.174
157 HG23 THR 16 HG23 THR 16 4.049 -16.681 -17.883
Start of MODEL 7
1 H1 GLU 1 H1 GLU 1 3.759 0.800 0.715
2 HA GLU 1 HA GLU 1 1.344 -0.615 -0.208
3 HB2 GLU 1 HB2 GLU 1 3.523 0.575 -1.931
4 HB3 GLU 1 HB3 GLU 1 2.042 -0.187 -2.493
5 HG2 GLU 1 HG2 GLU 1 2.044 2.268 -0.766
6 HG3 GLU 1 HG3 GLU 1 2.104 2.336 -2.527
7 H LYS 2 H LYS 2 2.016 -2.318 -1.958
8 HA LYS 2 HA LYS 2 3.964 -4.061 -0.657
9 HB2 LYS 2 HB2 LYS 2 1.688 -4.472 -2.548
10 HB3 LYS 2 HB3 LYS 2 2.979 -5.666 -2.513
11 HG2 LYS 2 HG2 LYS 2 2.612 -5.905 -0.068
12 HG3 LYS 2 HG3 LYS 2 1.221 -4.829 -0.218
13 HD2 LYS 2 HD2 LYS 2 -0.009 -6.375 -1.423
14 HD3 LYS 2 HD3 LYS 2 1.426 -7.249 -1.962
15 HE2 LYS 2 HE2 LYS 2 1.707 -8.288 0.128
16 HE3 LYS 2 HE3 LYS 2 0.610 -7.164 0.927
17 HZ1 LYS 2 HZ1 LYS 2 -0.074 -9.618 0.094
18 HZ2 LYS 2 HZ2 LYS 2 -0.576 -8.684 -1.225
19 HZ3 LYS 2 HZ3 LYS 2 -1.172 -8.351 0.322
20 H PHE 3 H PHE 3 5.971 -3.451 -1.311
21 HA PHE 3 HA PHE 3 6.555 -2.766 -4.036
22 HB2 PHE 3 HB2 PHE 3 8.811 -2.448 -3.305
23 HB3 PHE 3 HB3 PHE 3 7.763 -1.836 -2.029
24 HD1 PHE 3 HD1 PHE 3 10.075 -4.506 -3.004
25 HD2 PHE 3 HD2 PHE 3 7.657 -2.909 0.114
26 HE1 PHE 3 HE1 PHE 3 11.216 -5.959 -1.379
27 HE2 PHE 3 HE2 PHE 3 8.795 -4.359 1.744
28 HZ PHE 3 HZ PHE 3 10.576 -5.887 0.998
29 H ARG 4 H ARG 4 6.703 -5.637 -2.072
30 HA ARG 4 HA ARG 4 8.500 -7.210 -3.458
31 HB2 ARG 4 HB2 ARG 4 6.773 -7.619 -1.383
32 HB3 ARG 4 HB3 ARG 4 6.045 -8.611 -2.639
33 HG2 ARG 4 HG2 ARG 4 8.709 -9.261 -2.811
34 HG3 ARG 4 HG3 ARG 4 8.456 -9.046 -1.077
35 HD2 ARG 4 HD2 ARG 4 6.436 -10.609 -2.592
36 HD3 ARG 4 HD3 ARG 4 8.005 -11.359 -2.301
37 HE ARG 4 HE ARG 4 5.944 -10.841 -0.366
38 HH11 ARG 4 HH11 ARG 4 9.355 -11.345 -0.851
39 HH12 ARG 4 HH12 ARG 4 9.636 -11.897 0.767
40 HH21 ARG 4 HH21 ARG 4 6.302 -11.565 1.767
41 HH22 ARG 4 HH22 ARG 4 7.899 -12.023 2.255
42 H ARG 5 H ARG 5 5.240 -6.295 -4.320
43 HA ARG 5 HA ARG 5 4.698 -8.201 -6.285
44 HB2 ARG 5 HB2 ARG 5 2.997 -6.668 -5.440
45 HB3 ARG 5 HB3 ARG 5 3.846 -5.304 -6.154
46 HG2 ARG 5 HG2 ARG 5 3.038 -7.515 -7.955
47 HG3 ARG 5 HG3 ARG 5 1.775 -6.453 -7.330
48 HD2 ARG 5 HD2 ARG 5 3.500 -4.585 -8.075
49 HD3 ARG 5 HD3 ARG 5 4.026 -5.858 -9.175
50 HE ARG 5 HE ARG 5 1.182 -5.398 -9.168
51 HH11 ARG 5 HH11 ARG 5 4.246 -4.499 -10.556
52 HH12 ARG 5 HH12 ARG 5 3.551 -3.892 -12.022
53 HH21 ARG 5 HH21 ARG 5 0.256 -4.601 -11.094
54 HH22 ARG 5 HH22 ARG 5 1.281 -3.949 -12.327
55 H TYR 6 H TYR 6 5.928 -4.885 -6.775
56 HA TYR 6 HA TYR 6 6.454 -5.090 -9.490
57 HB2 TYR 6 HB2 TYR 6 7.907 -3.463 -7.395
58 HB3 TYR 6 HB3 TYR 6 8.071 -3.229 -9.131
59 HD1 TYR 6 HD1 TYR 6 5.586 -3.104 -10.311
60 HD2 TYR 6 HD2 TYR 6 6.572 -1.914 -6.347
61 HE1 TYR 6 HE1 TYR 6 3.652 -1.585 -10.293
62 HE2 TYR 6 HE2 TYR 6 4.640 -0.392 -6.317
63 HH TYR 6 HH TYR 6 2.658 0.117 -9.191
64 H LEU 7 H LEU 7 8.225 -6.340 -6.782
65 HA LEU 7 HA LEU 7 10.659 -6.815 -8.237
66 HB2 LEU 7 HB2 LEU 7 9.631 -7.399 -5.515
67 HB3 LEU 7 HB3 LEU 7 10.946 -8.403 -6.123
68 HG LEU 7 HG LEU 7 11.676 -6.491 -4.705
69 HD11 LEU 7 HD11 LEU 7 12.652 -7.247 -7.322
70 HD12 LEU 7 HD12 LEU 7 13.541 -6.934 -5.831
71 HD13 LEU 7 HD13 LEU 7 13.112 -5.598 -6.899
72 HD21 LEU 7 HD21 LEU 7 11.247 -4.610 -6.946
73 HD22 LEU 7 HD22 LEU 7 11.265 -4.322 -5.206
74 HD23 LEU 7 HD23 LEU 7 9.836 -5.019 -5.968
75 H SER 8 H SER 8 7.764 -8.621 -7.447
76 HA SER 8 HA SER 8 8.824 -11.137 -8.363
77 HB2 SER 8 HB2 SER 8 5.971 -10.334 -7.743
78 HB3 SER 8 HB3 SER 8 6.543 -11.982 -8.001
79 HG SER 8 HG SER 8 6.356 -11.131 -5.740
80 H VAL 9 H VAL 9 6.386 -8.837 -9.561
81 HA VAL 9 HA VAL 9 5.683 -10.113 -11.909
82 HB VAL 9 HB VAL 9 5.019 -7.946 -12.784
83 HG11 VAL 9 HG11 VAL 9 4.496 -8.475 -9.879
84 HG12 VAL 9 HG12 VAL 9 3.739 -7.118 -10.715
85 HG13 VAL 9 HG13 VAL 9 3.448 -8.768 -11.267
86 HG21 VAL 9 HG21 VAL 9 5.543 -5.996 -11.034
87 HG22 VAL 9 HG22 VAL 9 6.990 -6.975 -10.802
88 HG23 VAL 9 HG23 VAL 9 6.594 -6.355 -12.404
89 H PHE 10 H PHE 10 8.555 -8.263 -11.168
90 HA PHE 10 HA PHE 10 9.487 -7.755 -13.750
91 HB2 PHE 10 HB2 PHE 10 10.480 -6.762 -11.730
92 HB3 PHE 10 HB3 PHE 10 11.106 -8.339 -11.261
93 HD1 PHE 10 HD1 PHE 10 11.077 -6.532 -14.522
94 HD2 PHE 10 HD2 PHE 10 13.397 -8.297 -11.420
95 HE1 PHE 10 HE1 PHE 10 13.126 -6.097 -15.812
96 HE2 PHE 10 HE2 PHE 10 15.450 -7.864 -12.705
97 HZ PHE 10 HZ PHE 10 15.317 -6.762 -14.904
98 H PHE 11 H PHE 11 9.496 -10.672 -11.852
99 HA PHE 11 HA PHE 11 11.344 -12.037 -13.618
100 HB2 PHE 11 HB2 PHE 11 9.837 -12.800 -11.136
101 HB3 PHE 11 HB3 PHE 11 10.571 -14.044 -12.143
102 HD1 PHE 11 HD1 PHE 11 11.533 -10.730 -10.712
103 HD2 PHE 11 HD2 PHE 11 12.634 -14.769 -11.480
104 HE1 PHE 11 HE1 PHE 11 13.693 -10.349 -9.598
105 HE2 PHE 11 HE2 PHE 11 14.796 -14.395 -10.366
106 HZ PHE 11 HZ PHE 11 15.328 -12.183 -9.424
107 H ARG 12 H ARG 12 7.883 -12.053 -12.901
108 HA ARG 12 HA ARG 12 7.213 -14.207 -14.608
109 HB2 ARG 12 HB2 ARG 12 5.477 -11.898 -13.714
110 HB3 ARG 12 HB3 ARG 12 4.908 -13.424 -14.377
111 HG2 ARG 12 HG2 ARG 12 6.510 -13.218 -11.842
112 HG3 ARG 12 HG3 ARG 12 4.746 -13.202 -11.889
113 HD2 ARG 12 HD2 ARG 12 4.796 -15.394 -13.033
114 HD3 ARG 12 HD3 ARG 12 6.552 -15.409 -12.871
115 HE ARG 12 HE ARG 12 5.685 -15.068 -10.326
116 HH11 ARG 12 HH11 ARG 12 4.962 -17.379 -12.828
117 HH12 ARG 12 HH12 ARG 12 4.626 -18.668 -11.721
118 HH21 ARG 12 HH21 ARG 12 5.244 -16.758 -8.859
119 HH22 ARG 12 HH22 ARG 12 4.785 -18.314 -9.463
120 H LYS 13 H LYS 13 7.798 -10.831 -15.158
121 HA LYS 13 HA LYS 13 6.457 -10.514 -17.609
122 HB2 LYS 13 HB2 LYS 13 7.751 -8.821 -15.991
123 HB3 LYS 13 HB3 LYS 13 9.025 -9.077 -17.176
124 HG2 LYS 13 HG2 LYS 13 8.068 -7.462 -18.359
125 HG3 LYS 13 HG3 LYS 13 6.788 -8.621 -18.724
126 HD2 LYS 13 HD2 LYS 13 6.563 -7.214 -16.139
127 HD3 LYS 13 HD3 LYS 13 6.350 -6.220 -17.583
128 HE2 LYS 13 HE2 LYS 13 4.847 -8.760 -16.957
129 HE3 LYS 13 HE3 LYS 13 4.220 -7.124 -16.764
130 HZ1 LYS 13 HZ1 LYS 13 3.414 -7.610 -18.815
131 HZ2 LYS 13 HZ2 LYS 13 4.680 -8.662 -19.207
132 HZ3 LYS 13 HZ3 LYS 13 4.916 -6.989 -19.283
133 H HIS 14 H HIS 14 9.815 -11.435 -16.894
134 HA HIS 14 HA HIS 14 10.316 -11.973 -19.708
135 HB2 HIS 14 HB2 HIS 14 12.095 -12.180 -17.272
136 HB3 HIS 14 HB3 HIS 14 12.622 -12.526 -18.916
137 HD1 HIS 14 HD1 HIS 14 12.668 -10.459 -20.581
138 HD2 HIS 14 HD2 HIS 14 12.094 -9.523 -16.574
139 HE1 HIS 14 HE1 HIS 14 13.127 -7.993 -20.394
140 H ILE 15 H ILE 15 10.803 -13.826 -16.695
141 HA ILE 15 HA ILE 15 11.117 -16.320 -17.872
142 HB ILE 15 HB ILE 15 9.888 -15.723 -15.178
143 HG12 ILE 15 HG12 ILE 15 12.754 -16.456 -15.760
144 HG13 ILE 15 HG13 ILE 15 12.212 -14.782 -15.713
145 HG21 ILE 15 HG21 ILE 15 9.416 -17.944 -15.419
146 HG22 ILE 15 HG22 ILE 15 10.770 -18.227 -16.513
147 HG23 ILE 15 HG23 ILE 15 11.056 -18.056 -14.781
148 HD11 ILE 15 HD11 ILE 15 12.772 -16.634 -13.542
149 HD12 ILE 15 HD12 ILE 15 12.731 -14.871 -13.552
150 HD13 ILE 15 HD13 ILE 15 11.235 -15.787 -13.365
151 H THR 16 H THR 16 8.180 -15.392 -16.085
152 HA THR 16 HA THR 16 6.596 -17.371 -17.377
153 HB THR 16 HB THR 16 5.662 -14.977 -15.783
154 HG1 THR 16 HG1 THR 16 6.300 -17.638 -14.979
155 HG21 THR 16 HG21 THR 16 3.605 -15.679 -16.267
156 HG22 THR 16 HG22 THR 16 3.967 -17.208 -15.467
157 HG23 THR 16 HG23 THR 16 4.251 -17.030 -17.199
Start of MODEL 8
1 H1 GLU 1 H1 GLU 1 2.299 0.514 0.506
2 HA GLU 1 HA GLU 1 4.402 -0.706 0.364
3 HB2 GLU 1 HB2 GLU 1 4.255 -2.106 2.386
4 HB3 GLU 1 HB3 GLU 1 3.492 -0.539 2.611
5 HG2 GLU 1 HG2 GLU 1 1.315 -1.776 1.968
6 HG3 GLU 1 HG3 GLU 1 2.229 -3.232 2.356
7 H LYS 2 H LYS 2 3.207 -1.619 -1.897
8 HA LYS 2 HA LYS 2 3.498 -4.543 -1.671
9 HB2 LYS 2 HB2 LYS 2 1.185 -3.427 -2.324
10 HB3 LYS 2 HB3 LYS 2 1.936 -3.338 -3.911
11 HG2 LYS 2 HG2 LYS 2 0.899 -5.355 -4.079
12 HG3 LYS 2 HG3 LYS 2 2.459 -5.874 -3.436
13 HD2 LYS 2 HD2 LYS 2 0.255 -5.174 -1.546
14 HD3 LYS 2 HD3 LYS 2 0.226 -6.736 -2.369
15 HE2 LYS 2 HE2 LYS 2 2.656 -6.967 -1.553
16 HE3 LYS 2 HE3 LYS 2 2.259 -5.653 -0.447
17 HZ1 LYS 2 HZ1 LYS 2 0.364 -7.847 -0.514
18 HZ2 LYS 2 HZ2 LYS 2 0.974 -6.981 0.805
19 HZ3 LYS 2 HZ3 LYS 2 1.887 -8.228 0.118
20 H PHE 3 H PHE 3 5.744 -3.069 -2.015
21 HA PHE 3 HA PHE 3 6.415 -2.561 -4.722
22 HB2 PHE 3 HB2 PHE 3 8.676 -2.283 -3.940
23 HB3 PHE 3 HB3 PHE 3 7.592 -1.576 -2.747
24 HD1 PHE 3 HD1 PHE 3 9.879 -4.342 -3.469
25 HD2 PHE 3 HD2 PHE 3 7.356 -2.535 -0.557
26 HE1 PHE 3 HE1 PHE 3 10.911 -5.730 -1.719
27 HE2 PHE 3 HE2 PHE 3 8.384 -3.919 1.198
28 HZ PHE 3 HZ PHE 3 10.164 -5.519 0.618
29 H ARG 4 H ARG 4 6.406 -5.411 -2.754
30 HA ARG 4 HA ARG 4 8.261 -7.030 -4.000
31 HB2 ARG 4 HB2 ARG 4 5.668 -7.555 -2.612
32 HB3 ARG 4 HB3 ARG 4 6.460 -8.881 -3.453
33 HG2 ARG 4 HG2 ARG 4 7.367 -9.152 -1.390
34 HG3 ARG 4 HG3 ARG 4 8.549 -8.035 -2.075
35 HD2 ARG 4 HD2 ARG 4 7.589 -6.186 -0.950
36 HD3 ARG 4 HD3 ARG 4 6.154 -7.111 -0.509
37 HE ARG 4 HE ARG 4 8.648 -7.035 0.886
38 HH11 ARG 4 HH11 ARG 4 5.871 -9.010 0.174
39 HH12 ARG 4 HH12 ARG 4 6.020 -9.966 1.611
40 HH21 ARG 4 HH21 ARG 4 8.854 -8.287 2.782
41 HH22 ARG 4 HH22 ARG 4 7.716 -9.553 3.094
42 H ARG 5 H ARG 5 5.099 -6.041 -5.107
43 HA ARG 5 HA ARG 5 4.665 -7.936 -7.109
44 HB2 ARG 5 HB2 ARG 5 2.947 -6.351 -6.382
45 HB3 ARG 5 HB3 ARG 5 3.872 -5.019 -7.062
46 HG2 ARG 5 HG2 ARG 5 2.089 -5.564 -8.558
47 HG3 ARG 5 HG3 ARG 5 3.615 -6.047 -9.301
48 HD2 ARG 5 HD2 ARG 5 1.831 -7.734 -9.578
49 HD3 ARG 5 HD3 ARG 5 3.231 -8.349 -8.701
50 HE ARG 5 HE ARG 5 1.871 -8.718 -6.911
51 HH11 ARG 5 HH11 ARG 5 0.359 -6.366 -8.984
52 HH12 ARG 5 HH12 ARG 5 -1.105 -6.300 -8.061
53 HH21 ARG 5 HH21 ARG 5 -0.052 -8.640 -5.686
54 HH22 ARG 5 HH22 ARG 5 -1.337 -7.594 -6.184
55 H TYR 6 H TYR 6 6.448 -4.880 -7.192
56 HA TYR 6 HA TYR 6 7.025 -4.946 -9.964
57 HB2 TYR 6 HB2 TYR 6 8.358 -3.514 -7.663
58 HB3 TYR 6 HB3 TYR 6 8.825 -3.286 -9.345
59 HD1 TYR 6 HD1 TYR 6 6.506 -2.976 -10.872
60 HD2 TYR 6 HD2 TYR 6 7.121 -1.759 -6.841
61 HE1 TYR 6 HE1 TYR 6 4.760 -1.263 -11.129
62 HE2 TYR 6 HE2 TYR 6 5.375 -0.044 -7.086
63 HH TYR 6 HH TYR 6 3.823 0.827 -8.414
64 H LEU 7 H LEU 7 8.450 -6.468 -7.198
65 HA LEU 7 HA LEU 7 10.929 -7.118 -8.526
66 HB2 LEU 7 HB2 LEU 7 9.714 -7.722 -5.867
67 HB3 LEU 7 HB3 LEU 7 11.078 -8.683 -6.436
68 HG LEU 7 HG LEU 7 12.435 -6.642 -6.590
69 HD11 LEU 7 HD11 LEU 7 11.308 -4.680 -5.207
70 HD12 LEU 7 HD12 LEU 7 9.844 -5.382 -5.892
71 HD13 LEU 7 HD13 LEU 7 11.131 -4.817 -6.956
72 HD21 LEU 7 HD21 LEU 7 11.388 -7.825 -4.175
73 HD22 LEU 7 HD22 LEU 7 11.858 -6.145 -3.912
74 HD23 LEU 7 HD23 LEU 7 13.030 -7.298 -4.552
75 H SER 8 H SER 8 7.803 -8.546 -8.099
76 HA SER 8 HA SER 8 8.678 -11.195 -8.885
77 HB2 SER 8 HB2 SER 8 6.068 -11.512 -8.934
78 HB3 SER 8 HB3 SER 8 6.912 -11.371 -7.392
79 HG SER 8 HG SER 8 5.918 -9.554 -7.032
80 H VAL 9 H VAL 9 6.718 -8.571 -10.250
81 HA VAL 9 HA VAL 9 5.962 -9.757 -12.636
82 HB VAL 9 HB VAL 9 5.768 -7.497 -13.567
83 HG11 VAL 9 HG11 VAL 9 3.867 -7.401 -12.427
84 HG12 VAL 9 HG12 VAL 9 4.544 -8.460 -11.188
85 HG13 VAL 9 HG13 VAL 9 4.728 -6.711 -11.052
86 HG21 VAL 9 HG21 VAL 9 7.610 -6.868 -11.336
87 HG22 VAL 9 HG22 VAL 9 7.510 -6.177 -12.955
88 HG23 VAL 9 HG23 VAL 9 6.368 -5.674 -11.709
89 H PHE 10 H PHE 10 9.025 -8.315 -11.726
90 HA PHE 10 HA PHE 10 10.169 -8.090 -14.279
91 HB2 PHE 10 HB2 PHE 10 11.188 -8.190 -11.491
92 HB3 PHE 10 HB3 PHE 10 12.347 -8.529 -12.772
93 HD1 PHE 10 HD1 PHE 10 9.493 -6.144 -12.666
94 HD2 PHE 10 HD2 PHE 10 13.708 -6.671 -12.927
95 HE1 PHE 10 HE1 PHE 10 9.768 -3.729 -13.048
96 HE2 PHE 10 HE2 PHE 10 13.990 -4.257 -13.309
97 HZ PHE 10 HZ PHE 10 12.019 -2.782 -13.369
98 H PHE 11 H PHE 11 9.661 -10.821 -12.204
99 HA PHE 11 HA PHE 11 11.473 -12.521 -13.711
100 HB2 PHE 11 HB2 PHE 11 9.747 -12.917 -11.283
101 HB3 PHE 11 HB3 PHE 11 10.430 -14.300 -12.131
102 HD1 PHE 11 HD1 PHE 11 11.523 -10.999 -10.776
103 HD2 PHE 11 HD2 PHE 11 12.438 -15.111 -11.386
104 HE1 PHE 11 HE1 PHE 11 13.629 -10.711 -9.537
105 HE2 PHE 11 HE2 PHE 11 14.546 -14.830 -10.147
106 HZ PHE 11 HZ PHE 11 15.144 -12.627 -9.222
107 H ARG 12 H ARG 12 7.998 -12.115 -13.204
108 HA ARG 12 HA ARG 12 7.183 -14.323 -14.770
109 HB2 ARG 12 HB2 ARG 12 5.645 -11.777 -14.229
110 HB3 ARG 12 HB3 ARG 12 4.972 -13.329 -14.712
111 HG2 ARG 12 HG2 ARG 12 6.520 -12.991 -12.165
112 HG3 ARG 12 HG3 ARG 12 4.784 -12.687 -12.264
113 HD2 ARG 12 HD2 ARG 12 4.716 -15.054 -13.351
114 HD3 ARG 12 HD3 ARG 12 6.284 -15.254 -12.571
115 HE ARG 12 HE ARG 12 4.736 -14.373 -10.554
116 HH11 ARG 12 HH11 ARG 12 4.335 -16.918 -12.895
117 HH12 ARG 12 HH12 ARG 12 3.388 -17.916 -11.841
118 HH21 ARG 12 HH21 ARG 12 3.490 -15.677 -9.157
119 HH22 ARG 12 HH22 ARG 12 2.908 -17.209 -9.716
120 H LYS 13 H LYS 13 8.050 -11.031 -15.544
121 HA LYS 13 HA LYS 13 6.919 -10.801 -18.085
122 HB2 LYS 13 HB2 LYS 13 7.967 -8.938 -16.831
123 HB3 LYS 13 HB3 LYS 13 9.548 -9.648 -17.133
124 HG2 LYS 13 HG2 LYS 13 9.397 -8.013 -18.756
125 HG3 LYS 13 HG3 LYS 13 8.901 -9.468 -19.624
126 HD2 LYS 13 HD2 LYS 13 7.300 -7.897 -20.249
127 HD3 LYS 13 HD3 LYS 13 6.507 -8.786 -18.946
128 HE2 LYS 13 HE2 LYS 13 7.183 -7.019 -17.367
129 HE3 LYS 13 HE3 LYS 13 7.908 -6.125 -18.702
130 HZ1 LYS 13 HZ1 LYS 13 5.101 -6.479 -18.013
131 HZ2 LYS 13 HZ2 LYS 13 5.474 -6.473 -19.663
132 HZ3 LYS 13 HZ3 LYS 13 5.889 -5.148 -18.697
133 H HIS 14 H HIS 14 10.124 -12.014 -17.135
134 HA HIS 14 HA HIS 14 10.670 -12.851 -19.866
135 HB2 HIS 14 HB2 HIS 14 12.264 -12.731 -17.331
136 HB3 HIS 14 HB3 HIS 14 12.814 -13.751 -18.658
137 HD1 HIS 14 HD1 HIS 14 13.901 -12.607 -20.637
138 HD2 HIS 14 HD2 HIS 14 12.255 -9.933 -17.915
139 HE1 HIS 14 HE1 HIS 14 14.715 -10.336 -21.348
140 H ILE 15 H ILE 15 10.921 -14.505 -16.714
141 HA ILE 15 HA ILE 15 10.958 -17.099 -17.670
142 HB ILE 15 HB ILE 15 9.734 -16.147 -15.078
143 HG12 ILE 15 HG12 ILE 15 12.504 -17.261 -15.479
144 HG13 ILE 15 HG13 ILE 15 12.172 -15.538 -15.621
145 HG21 ILE 15 HG21 ILE 15 8.999 -18.340 -15.310
146 HG22 ILE 15 HG22 ILE 15 10.486 -18.857 -16.103
147 HG23 ILE 15 HG23 ILE 15 10.484 -18.511 -14.374
148 HD11 ILE 15 HD11 ILE 15 12.833 -15.683 -13.442
149 HD12 ILE 15 HD12 ILE 15 11.089 -15.866 -13.265
150 HD13 ILE 15 HD13 ILE 15 12.134 -17.286 -13.219
151 H THR 16 H THR 16 8.093 -15.728 -16.059
152 HA THR 16 HA THR 16 6.333 -17.622 -17.234
153 HB THR 16 HB THR 16 5.514 -14.987 -16.011
154 HG1 THR 16 HG1 THR 16 6.364 -17.405 -14.797
155 HG21 THR 16 HG21 THR 16 3.749 -16.276 -17.135
156 HG22 THR 16 HG22 THR 16 3.495 -16.208 -15.392
157 HG23 THR 16 HG23 THR 16 4.139 -17.674 -16.133
Start of MODEL 9
1 H1 GLU 1 H1 GLU 1 2.733 -0.430 1.602
2 HA GLU 1 HA GLU 1 1.309 -0.237 -0.918
3 HB2 GLU 1 HB2 GLU 1 3.356 0.331 -2.194
4 HB3 GLU 1 HB3 GLU 1 2.831 1.628 -1.130
5 HG2 GLU 1 HG2 GLU 1 4.534 0.470 0.526
6 HG3 GLU 1 HG3 GLU 1 5.245 -0.084 -0.989
7 H LYS 2 H LYS 2 2.167 -1.778 -2.537
8 HA LYS 2 HA LYS 2 3.445 -4.088 -1.225
9 HB2 LYS 2 HB2 LYS 2 1.176 -3.938 -3.186
10 HB3 LYS 2 HB3 LYS 2 2.162 -5.390 -3.075
11 HG2 LYS 2 HG2 LYS 2 0.926 -4.218 -0.620
12 HG3 LYS 2 HG3 LYS 2 -0.024 -5.231 -1.710
13 HD2 LYS 2 HD2 LYS 2 1.166 -7.120 -1.211
14 HD3 LYS 2 HD3 LYS 2 2.643 -6.224 -0.847
15 HE2 LYS 2 HE2 LYS 2 0.210 -6.054 0.905
16 HE3 LYS 2 HE3 LYS 2 1.407 -7.332 1.102
17 HZ1 LYS 2 HZ1 LYS 2 1.821 -4.411 1.386
18 HZ2 LYS 2 HZ2 LYS 2 3.098 -5.519 1.301
19 HZ3 LYS 2 HZ3 LYS 2 1.990 -5.601 2.577
20 H PHE 3 H PHE 3 5.379 -2.774 -2.037
21 HA PHE 3 HA PHE 3 5.945 -2.679 -4.810
22 HB2 PHE 3 HB2 PHE 3 8.215 -2.126 -4.151
23 HB3 PHE 3 HB3 PHE 3 7.080 -1.262 -3.119
24 HD1 PHE 3 HD1 PHE 3 9.469 -4.053 -3.275
25 HD2 PHE 3 HD2 PHE 3 6.981 -1.668 -0.778
26 HE1 PHE 3 HE1 PHE 3 10.583 -4.979 -1.286
27 HE2 PHE 3 HE2 PHE 3 8.091 -2.588 1.215
28 HZ PHE 3 HZ PHE 3 9.896 -4.245 0.963
29 H ARG 4 H ARG 4 6.241 -5.152 -2.403
30 HA ARG 4 HA ARG 4 8.206 -6.784 -3.484
31 HB2 ARG 4 HB2 ARG 4 5.711 -7.405 -1.919
32 HB3 ARG 4 HB3 ARG 4 6.816 -8.674 -2.430
33 HG2 ARG 4 HG2 ARG 4 7.651 -8.265 -0.361
34 HG3 ARG 4 HG3 ARG 4 8.594 -7.092 -1.282
35 HD2 ARG 4 HD2 ARG 4 7.336 -5.297 -0.528
36 HD3 ARG 4 HD3 ARG 4 5.958 -6.312 -0.108
37 HE ARG 4 HE ARG 4 8.239 -5.715 1.538
38 HH11 ARG 4 HH11 ARG 4 5.642 -7.953 0.935
39 HH12 ARG 4 HH12 ARG 4 5.627 -8.574 2.552
40 HH21 ARG 4 HH21 ARG 4 8.230 -6.524 3.670
41 HH22 ARG 4 HH22 ARG 4 7.099 -7.760 4.108
42 H ARG 5 H ARG 5 4.963 -6.195 -4.565
43 HA ARG 5 HA ARG 5 4.590 -8.493 -6.151
44 HB2 ARG 5 HB2 ARG 5 2.728 -7.046 -5.569
45 HB3 ARG 5 HB3 ARG 5 3.456 -5.707 -6.446
46 HG2 ARG 5 HG2 ARG 5 1.687 -6.634 -7.765
47 HG3 ARG 5 HG3 ARG 5 3.229 -7.009 -8.538
48 HD2 ARG 5 HD2 ARG 5 1.895 -8.978 -8.627
49 HD3 ARG 5 HD3 ARG 5 3.145 -9.246 -7.412
50 HE ARG 5 HE ARG 5 0.997 -8.284 -6.014
51 HH11 ARG 5 HH11 ARG 5 1.570 -10.972 -8.152
52 HH12 ARG 5 HH12 ARG 5 0.393 -11.993 -7.395
53 HH21 ARG 5 HH21 ARG 5 -0.556 -9.619 -5.009
54 HH22 ARG 5 HH22 ARG 5 -0.816 -11.223 -5.608
55 H TYR 6 H TYR 6 5.989 -5.322 -6.869
56 HA TYR 6 HA TYR 6 6.350 -5.692 -9.627
57 HB2 TYR 6 HB2 TYR 6 7.960 -4.016 -7.690
58 HB3 TYR 6 HB3 TYR 6 8.035 -3.883 -9.443
59 HD1 TYR 6 HD1 TYR 6 5.215 -4.042 -10.212
60 HD2 TYR 6 HD2 TYR 6 7.034 -2.021 -6.940
61 HE1 TYR 6 HE1 TYR 6 3.350 -2.439 -10.174
62 HE2 TYR 6 HE2 TYR 6 5.173 -0.413 -6.891
63 HH TYR 6 HH TYR 6 3.084 0.010 -7.652
64 H LEU 7 H LEU 7 8.152 -6.824 -6.880
65 HA LEU 7 HA LEU 7 10.553 -7.463 -8.275
66 HB2 LEU 7 HB2 LEU 7 9.392 -8.131 -5.612
67 HB3 LEU 7 HB3 LEU 7 10.763 -9.067 -6.204
68 HG LEU 7 HG LEU 7 11.865 -6.723 -6.529
69 HD11 LEU 7 HD11 LEU 7 10.728 -5.607 -4.221
70 HD12 LEU 7 HD12 LEU 7 9.381 -6.040 -5.273
71 HD13 LEU 7 HD13 LEU 7 10.661 -4.984 -5.869
72 HD21 LEU 7 HD21 LEU 7 12.509 -8.550 -4.932
73 HD22 LEU 7 HD22 LEU 7 11.479 -7.770 -3.732
74 HD23 LEU 7 HD23 LEU 7 12.876 -6.914 -4.385
75 H SER 8 H SER 8 7.498 -9.037 -7.842
76 HA SER 8 HA SER 8 8.484 -11.631 -8.680
77 HB2 SER 8 HB2 SER 8 5.604 -10.776 -8.349
78 HB3 SER 8 HB3 SER 8 6.245 -12.419 -8.343
79 HG SER 8 HG SER 8 6.035 -11.938 -6.236
80 H VAL 9 H VAL 9 6.232 -9.186 -9.959
81 HA VAL 9 HA VAL 9 5.667 -10.398 -12.395
82 HB VAL 9 HB VAL 9 5.012 -8.220 -13.216
83 HG11 VAL 9 HG11 VAL 9 3.234 -8.052 -11.851
84 HG12 VAL 9 HG12 VAL 9 3.943 -9.456 -11.050
85 HG13 VAL 9 HG13 VAL 9 4.230 -7.837 -10.412
86 HG21 VAL 9 HG21 VAL 9 6.814 -6.816 -12.634
87 HG22 VAL 9 HG22 VAL 9 5.433 -6.209 -11.721
88 HG23 VAL 9 HG23 VAL 9 6.657 -7.192 -10.918
89 H PHE 10 H PHE 10 8.524 -8.754 -11.336
90 HA PHE 10 HA PHE 10 9.624 -8.020 -13.807
91 HB2 PHE 10 HB2 PHE 10 10.526 -7.222 -11.676
92 HB3 PHE 10 HB3 PHE 10 11.037 -8.856 -11.266
93 HD1 PHE 10 HD1 PHE 10 11.340 -6.956 -14.452
94 HD2 PHE 10 HD2 PHE 10 13.344 -8.817 -11.190
95 HE1 PHE 10 HE1 PHE 10 13.503 -6.549 -15.553
96 HE2 PHE 10 HE2 PHE 10 15.510 -8.412 -12.285
97 HZ PHE 10 HZ PHE 10 15.591 -7.276 -14.469
98 H PHE 11 H PHE 11 9.344 -11.094 -12.238
99 HA PHE 11 HA PHE 11 11.281 -12.358 -14.002
100 HB2 PHE 11 HB2 PHE 11 9.623 -13.316 -11.682
101 HB3 PHE 11 HB3 PHE 11 10.450 -14.456 -12.738
102 HD1 PHE 11 HD1 PHE 11 10.959 -11.635 -10.411
103 HD2 PHE 11 HD2 PHE 11 12.762 -14.852 -12.535
104 HE1 PHE 11 HE1 PHE 11 13.025 -11.331 -9.110
105 HE2 PHE 11 HE2 PHE 11 14.830 -14.555 -11.237
106 HZ PHE 11 HZ PHE 11 14.964 -12.793 -9.521
107 H ARG 12 H ARG 12 7.795 -12.483 -13.347
108 HA ARG 12 HA ARG 12 7.168 -14.407 -15.307
109 HB2 ARG 12 HB2 ARG 12 5.373 -12.204 -14.279
110 HB3 ARG 12 HB3 ARG 12 4.868 -13.718 -15.016
111 HG2 ARG 12 HG2 ARG 12 6.340 -13.466 -12.401
112 HG3 ARG 12 HG3 ARG 12 4.603 -13.725 -12.581
113 HD2 ARG 12 HD2 ARG 12 5.250 -15.792 -13.951
114 HD3 ARG 12 HD3 ARG 12 6.861 -15.579 -13.266
115 HE ARG 12 HE ARG 12 6.080 -16.473 -11.324
116 HH11 ARG 12 HH11 ARG 12 3.374 -15.257 -13.145
117 HH12 ARG 12 HH12 ARG 12 2.189 -15.852 -12.030
118 HH21 ARG 12 HH21 ARG 12 4.529 -17.262 -9.849
119 HH22 ARG 12 HH22 ARG 12 2.847 -16.992 -10.155
120 H LYS 13 H LYS 13 7.437 -10.900 -15.421
121 HA LYS 13 HA LYS 13 6.264 -10.395 -17.886
122 HB2 LYS 13 HB2 LYS 13 7.061 -8.675 -16.256
123 HB3 LYS 13 HB3 LYS 13 8.710 -9.015 -16.765
124 HG2 LYS 13 HG2 LYS 13 6.778 -8.336 -18.896
125 HG3 LYS 13 HG3 LYS 13 7.242 -7.040 -17.792
126 HD2 LYS 13 HD2 LYS 13 9.396 -8.744 -18.930
127 HD3 LYS 13 HD3 LYS 13 8.622 -7.566 -19.993
128 HE2 LYS 13 HE2 LYS 13 9.491 -6.660 -17.300
129 HE3 LYS 13 HE3 LYS 13 10.736 -6.954 -18.513
130 HZ1 LYS 13 HZ1 LYS 13 10.224 -4.756 -18.862
131 HZ2 LYS 13 HZ2 LYS 13 8.580 -4.953 -18.516
132 HZ3 LYS 13 HZ3 LYS 13 9.206 -5.502 -19.989
133 H HIS 14 H HIS 14 9.681 -11.115 -17.181
134 HA HIS 14 HA HIS 14 10.322 -11.302 -19.989
135 HB2 HIS 14 HB2 HIS 14 11.870 -11.622 -17.438
136 HB3 HIS 14 HB3 HIS 14 12.558 -12.171 -18.963
137 HD1 HIS 14 HD1 HIS 14 11.848 -9.937 -20.849
138 HD2 HIS 14 HD2 HIS 14 13.113 -9.272 -16.948
139 HE1 HIS 14 HE1 HIS 14 12.757 -7.592 -20.827
140 H ILE 15 H ILE 15 10.804 -13.620 -17.321
141 HA ILE 15 HA ILE 15 11.143 -15.878 -18.891
142 HB ILE 15 HB ILE 15 9.903 -15.748 -16.139
143 HG12 ILE 15 HG12 ILE 15 12.772 -16.371 -16.814
144 HG13 ILE 15 HG13 ILE 15 12.228 -14.722 -16.526
145 HG21 ILE 15 HG21 ILE 15 9.649 -17.947 -16.281
146 HG22 ILE 15 HG22 ILE 15 10.299 -17.936 -17.920
147 HG23 ILE 15 HG23 ILE 15 11.385 -18.119 -16.542
148 HD11 ILE 15 HD11 ILE 15 11.288 -15.710 -14.315
149 HD12 ILE 15 HD12 ILE 15 12.445 -17.004 -14.625
150 HD13 ILE 15 HD13 ILE 15 13.006 -15.340 -14.459
151 H THR 16 H THR 16 8.190 -15.328 -16.978
152 HA THR 16 HA THR 16 6.636 -17.086 -18.573
153 HB THR 16 HB THR 16 5.450 -14.951 -16.816
154 HG1 THR 16 HG1 THR 16 6.940 -17.232 -16.088
155 HG21 THR 16 HG21 THR 16 3.662 -16.100 -17.612
156 HG22 THR 16 HG22 THR 16 4.085 -17.208 -16.308
157 HG23 THR 16 HG23 THR 16 4.608 -17.547 -17.958
Start of MODEL 10
1 H1 GLU 1 H1 GLU 1 -0.767 -1.678 -4.979
2 HA GLU 1 HA GLU 1 1.406 -0.324 -4.613
3 HB2 GLU 1 HB2 GLU 1 0.589 0.620 -2.469
4 HB3 GLU 1 HB3 GLU 1 -0.667 0.499 -3.692
5 HG2 GLU 1 HG2 GLU 1 -1.804 -0.305 -1.904
6 HG3 GLU 1 HG3 GLU 1 -1.118 -1.811 -2.511
7 H LYS 2 H LYS 2 2.015 -3.187 -4.255
8 HA LYS 2 HA LYS 2 3.489 -3.089 -1.709
9 HB2 LYS 2 HB2 LYS 2 2.441 -5.368 -3.365
10 HB3 LYS 2 HB3 LYS 2 3.733 -5.622 -2.199
11 HG2 LYS 2 HG2 LYS 2 1.162 -4.312 -1.400
12 HG3 LYS 2 HG3 LYS 2 1.320 -6.069 -1.466
13 HD2 LYS 2 HD2 LYS 2 3.369 -5.783 0.015
14 HD3 LYS 2 HD3 LYS 2 2.825 -4.122 0.264
15 HE2 LYS 2 HE2 LYS 2 2.017 -5.472 2.075
16 HE3 LYS 2 HE3 LYS 2 0.649 -5.016 1.061
17 HZ1 LYS 2 HZ1 LYS 2 1.011 -7.479 1.868
18 HZ2 LYS 2 HZ2 LYS 2 1.980 -7.553 0.483
19 HZ3 LYS 2 HZ3 LYS 2 0.347 -7.136 0.350
20 H PHE 3 H PHE 3 5.662 -3.142 -1.692
21 HA PHE 3 HA PHE 3 7.132 -2.554 -4.002
22 HB2 PHE 3 HB2 PHE 3 9.085 -2.690 -2.631
23 HB3 PHE 3 HB3 PHE 3 7.795 -2.049 -1.619
24 HD1 PHE 3 HD1 PHE 3 6.598 -3.644 -0.056
25 HD2 PHE 3 HD2 PHE 3 10.247 -4.615 -2.019
26 HE1 PHE 3 HE1 PHE 3 7.004 -5.427 1.590
27 HE2 PHE 3 HE2 PHE 3 10.660 -6.400 -0.376
28 HZ PHE 3 HZ PHE 3 9.038 -6.807 1.432
29 H ARG 4 H ARG 4 6.300 -5.585 -2.502
30 HA ARG 4 HA ARG 4 8.231 -7.225 -3.731
31 HB2 ARG 4 HB2 ARG 4 5.540 -7.707 -2.507
32 HB3 ARG 4 HB3 ARG 4 6.341 -9.006 -3.381
33 HG2 ARG 4 HG2 ARG 4 7.737 -7.511 -1.193
34 HG3 ARG 4 HG3 ARG 4 6.664 -8.870 -0.849
35 HD2 ARG 4 HD2 ARG 4 8.123 -10.045 -2.704
36 HD3 ARG 4 HD3 ARG 4 9.304 -8.826 -2.225
37 HE ARG 4 HE ARG 4 8.400 -9.977 0.113
38 HH11 ARG 4 HH11 ARG 4 10.020 -11.030 -2.783
39 HH12 ARG 4 HH12 ARG 4 10.873 -12.315 -1.995
40 HH21 ARG 4 HH21 ARG 4 9.518 -11.666 1.162
41 HH22 ARG 4 HH22 ARG 4 10.586 -12.677 0.249
42 H ARG 5 H ARG 5 5.155 -5.965 -4.826
43 HA ARG 5 HA ARG 5 4.684 -7.646 -7.001
44 HB2 ARG 5 HB2 ARG 5 3.029 -6.042 -6.192
45 HB3 ARG 5 HB3 ARG 5 4.051 -4.705 -6.703
46 HG2 ARG 5 HG2 ARG 5 2.255 -5.050 -8.283
47 HG3 ARG 5 HG3 ARG 5 3.808 -5.421 -9.033
48 HD2 ARG 5 HD2 ARG 5 2.060 -7.069 -9.591
49 HD3 ARG 5 HD3 ARG 5 3.429 -7.787 -8.744
50 HE ARG 5 HE ARG 5 1.388 -7.045 -6.921
51 HH11 ARG 5 HH11 ARG 5 2.222 -9.444 -9.301
52 HH12 ARG 5 HH12 ARG 5 1.264 -10.690 -8.572
53 HH21 ARG 5 HH21 ARG 5 0.122 -8.677 -5.951
54 HH22 ARG 5 HH22 ARG 5 0.069 -10.252 -6.667
55 H TYR 6 H TYR 6 6.509 -4.600 -6.851
56 HA TYR 6 HA TYR 6 7.201 -4.489 -9.570
57 HB2 TYR 6 HB2 TYR 6 8.493 -3.333 -7.103
58 HB3 TYR 6 HB3 TYR 6 9.116 -3.030 -8.721
59 HD1 TYR 6 HD1 TYR 6 6.985 -2.424 -10.406
60 HD2 TYR 6 HD2 TYR 6 7.292 -1.569 -6.250
61 HE1 TYR 6 HE1 TYR 6 5.392 -0.570 -10.676
62 HE2 TYR 6 HE2 TYR 6 5.699 0.287 -6.508
63 HH TYR 6 HH TYR 6 5.032 1.842 -8.739
64 H LEU 7 H LEU 7 8.480 -6.335 -6.931
65 HA LEU 7 HA LEU 7 10.930 -7.018 -8.313
66 HB2 LEU 7 HB2 LEU 7 9.708 -7.963 -5.729
67 HB3 LEU 7 HB3 LEU 7 11.236 -8.572 -6.363
68 HG LEU 7 HG LEU 7 10.759 -5.667 -5.724
69 HD11 LEU 7 HD11 LEU 7 12.174 -6.213 -3.686
70 HD12 LEU 7 HD12 LEU 7 11.763 -7.901 -3.985
71 HD13 LEU 7 HD13 LEU 7 10.489 -6.731 -3.646
72 HD21 LEU 7 HD21 LEU 7 12.782 -6.984 -7.122
73 HD22 LEU 7 HD22 LEU 7 13.457 -6.664 -5.525
74 HD23 LEU 7 HD23 LEU 7 12.817 -5.336 -6.493
75 H SER 8 H SER 8 7.736 -8.303 -7.907
76 HA SER 8 HA SER 8 8.436 -10.952 -8.826
77 HB2 SER 8 HB2 SER 8 5.651 -9.812 -8.587
78 HB3 SER 8 HB3 SER 8 6.142 -11.505 -8.524
79 HG SER 8 HG SER 8 7.272 -10.966 -6.562
80 H VAL 9 H VAL 9 6.806 -8.091 -10.120
81 HA VAL 9 HA VAL 9 5.936 -9.097 -12.552
82 HB VAL 9 HB VAL 9 6.159 -6.764 -13.417
83 HG11 VAL 9 HG11 VAL 9 4.119 -7.289 -12.362
84 HG12 VAL 9 HG12 VAL 9 4.850 -7.260 -10.756
85 HG13 VAL 9 HG13 VAL 9 4.634 -5.757 -11.655
86 HG21 VAL 9 HG21 VAL 9 6.826 -5.023 -11.746
87 HG22 VAL 9 HG22 VAL 9 7.447 -6.323 -10.729
88 HG23 VAL 9 HG23 VAL 9 8.152 -6.034 -12.319
89 H PHE 10 H PHE 10 9.130 -7.928 -11.621
90 HA PHE 10 HA PHE 10 10.299 -7.879 -14.169
91 HB2 PHE 10 HB2 PHE 10 11.308 -8.014 -11.374
92 HB3 PHE 10 HB3 PHE 10 12.433 -8.441 -12.659
93 HD1 PHE 10 HD1 PHE 10 12.039 -6.661 -14.777
94 HD2 PHE 10 HD2 PHE 10 11.634 -5.885 -10.612
95 HE1 PHE 10 HE1 PHE 10 12.484 -4.276 -15.182
96 HE2 PHE 10 HE2 PHE 10 12.078 -3.498 -11.010
97 HZ PHE 10 HZ PHE 10 12.503 -2.690 -13.298
98 H PHE 11 H PHE 11 9.539 -10.500 -12.035
99 HA PHE 11 HA PHE 11 11.222 -12.391 -13.457
100 HB2 PHE 11 HB2 PHE 11 9.485 -12.495 -11.029
101 HB3 PHE 11 HB3 PHE 11 9.856 -14.001 -11.862
102 HD1 PHE 11 HD1 PHE 11 11.699 -10.939 -10.773
103 HD2 PHE 11 HD2 PHE 11 11.611 -15.189 -11.006
104 HE1 PHE 11 HE1 PHE 11 13.862 -11.045 -9.606
105 HE2 PHE 11 HE2 PHE 11 13.774 -15.301 -9.839
106 HZ PHE 11 HZ PHE 11 14.902 -13.228 -9.136
107 H ARG 12 H ARG 12 7.758 -11.796 -12.962
108 HA ARG 12 HA ARG 12 6.795 -13.915 -14.519
109 HB2 ARG 12 HB2 ARG 12 5.503 -11.211 -14.121
110 HB3 ARG 12 HB3 ARG 12 4.692 -12.699 -14.591
111 HG2 ARG 12 HG2 ARG 12 6.174 -12.454 -11.995
112 HG3 ARG 12 HG3 ARG 12 4.486 -11.965 -12.166
113 HD2 ARG 12 HD2 ARG 12 4.204 -14.129 -11.487
114 HD3 ARG 12 HD3 ARG 12 4.256 -14.363 -13.234
115 HE ARG 12 HE ARG 12 6.841 -14.640 -12.515
116 HH11 ARG 12 HH11 ARG 12 3.888 -16.067 -11.347
117 HH12 ARG 12 HH12 ARG 12 4.642 -17.553 -10.871
118 HH21 ARG 12 HH21 ARG 12 7.844 -16.591 -11.893
119 HH22 ARG 12 HH22 ARG 12 6.892 -17.850 -11.181
120 H LYS 13 H LYS 13 7.955 -10.733 -15.397
121 HA LYS 13 HA LYS 13 6.944 -10.490 -17.969
122 HB2 LYS 13 HB2 LYS 13 8.421 -8.881 -16.519
123 HB3 LYS 13 HB3 LYS 13 9.756 -9.651 -17.367
124 HG2 LYS 13 HG2 LYS 13 9.314 -7.769 -18.643
125 HG3 LYS 13 HG3 LYS 13 8.469 -9.055 -19.509
126 HD2 LYS 13 HD2 LYS 13 6.902 -7.335 -19.448
127 HD3 LYS 13 HD3 LYS 13 6.427 -8.360 -18.091
128 HE2 LYS 13 HE2 LYS 13 7.504 -6.884 -16.531
129 HE3 LYS 13 HE3 LYS 13 8.185 -5.923 -17.843
130 HZ1 LYS 13 HZ1 LYS 13 6.044 -5.142 -16.629
131 HZ2 LYS 13 HZ2 LYS 13 5.270 -6.238 -17.659
132 HZ3 LYS 13 HZ3 LYS 13 6.172 -4.962 -18.306
133 H HIS 14 H HIS 14 9.981 -12.018 -16.921
134 HA HIS 14 HA HIS 14 10.471 -13.020 -19.601
135 HB2 HIS 14 HB2 HIS 14 12.023 -13.433 -17.037
136 HB3 HIS 14 HB3 HIS 14 12.549 -13.931 -18.642
137 HD1 HIS 14 HD1 HIS 14 12.448 -11.656 -20.385
138 HD2 HIS 14 HD2 HIS 14 13.225 -11.131 -16.338
139 HE1 HIS 14 HE1 HIS 14 13.582 -9.419 -20.203
140 H ILE 15 H ILE 15 10.373 -14.571 -16.387
141 HA ILE 15 HA ILE 15 10.132 -17.187 -17.261
142 HB ILE 15 HB ILE 15 8.929 -15.998 -14.758
143 HG12 ILE 15 HG12 ILE 15 11.568 -17.433 -15.024
144 HG13 ILE 15 HG13 ILE 15 11.432 -15.685 -15.183
145 HG21 ILE 15 HG21 ILE 15 9.642 -18.567 -14.168
146 HG22 ILE 15 HG22 ILE 15 8.011 -18.032 -14.571
147 HG23 ILE 15 HG23 ILE 15 9.047 -18.719 -15.821
148 HD11 ILE 15 HD11 ILE 15 11.742 -17.188 -12.841
149 HD12 ILE 15 HD12 ILE 15 11.483 -15.450 -12.989
150 HD13 ILE 15 HD13 ILE 15 10.104 -16.534 -12.801
151 H THR 16 H THR 16 7.400 -15.415 -15.820
152 HA THR 16 HA THR 16 5.466 -17.114 -17.022
153 HB THR 16 HB THR 16 5.080 -14.392 -15.759
154 HG1 THR 16 HG1 THR 16 4.658 -16.962 -14.609
155 HG21 THR 16 HG21 THR 16 3.265 -16.130 -17.137
156 HG22 THR 16 HG22 THR 16 2.949 -14.566 -16.388
157 HG23 THR 16 HG23 THR 16 2.818 -16.043 -15.434
Start of MODEL 11
1 H1 GLU 1 H1 GLU 1 -0.488 -0.699 -1.646
2 HA GLU 1 HA GLU 1 0.179 -2.240 -3.980
3 HB2 GLU 1 HB2 GLU 1 1.532 0.428 -3.541
4 HB3 GLU 1 HB3 GLU 1 2.027 -0.782 -4.716
5 HG2 GLU 1 HG2 GLU 1 -0.718 0.423 -4.739
6 HG3 GLU 1 HG3 GLU 1 0.648 1.180 -5.556
7 H LYS 2 H LYS 2 2.624 -2.770 -3.926
8 HA LYS 2 HA LYS 2 3.909 -2.620 -1.363
9 HB2 LYS 2 HB2 LYS 2 2.115 -4.512 -1.275
10 HB3 LYS 2 HB3 LYS 2 3.262 -5.409 -2.262
11 HG2 LYS 2 HG2 LYS 2 3.786 -6.079 -0.115
12 HG3 LYS 2 HG3 LYS 2 4.970 -4.808 -0.427
13 HD2 LYS 2 HD2 LYS 2 4.153 -4.367 1.733
14 HD3 LYS 2 HD3 LYS 2 3.315 -3.220 0.685
15 HE2 LYS 2 HE2 LYS 2 1.359 -4.672 0.641
16 HE3 LYS 2 HE3 LYS 2 2.198 -5.852 1.647
17 HZ1 LYS 2 HZ1 LYS 2 0.937 -3.352 2.391
18 HZ2 LYS 2 HZ2 LYS 2 2.424 -3.654 3.139
19 HZ3 LYS 2 HZ3 LYS 2 1.158 -4.765 3.294
20 H PHE 3 H PHE 3 6.066 -3.391 -1.401
21 HA PHE 3 HA PHE 3 7.328 -3.161 -3.937
22 HB2 PHE 3 HB2 PHE 3 8.279 -2.521 -1.645
23 HB3 PHE 3 HB3 PHE 3 8.636 -4.233 -1.442
24 HD1 PHE 3 HD1 PHE 3 8.935 -1.981 -4.396
25 HD2 PHE 3 HD2 PHE 3 10.916 -4.499 -1.593
26 HE1 PHE 3 HE1 PHE 3 11.046 -1.681 -5.623
27 HE2 PHE 3 HE2 PHE 3 13.031 -4.202 -2.816
28 HZ PHE 3 HZ PHE 3 13.097 -2.793 -4.835
29 H ARG 4 H ARG 4 6.348 -5.850 -1.935
30 HA ARG 4 HA ARG 4 7.869 -7.912 -2.967
31 HB2 ARG 4 HB2 ARG 4 5.942 -7.819 -1.136
32 HB3 ARG 4 HB3 ARG 4 4.975 -8.424 -2.475
33 HG2 ARG 4 HG2 ARG 4 7.552 -9.780 -1.910
34 HG3 ARG 4 HG3 ARG 4 6.212 -10.039 -0.790
35 HD2 ARG 4 HD2 ARG 4 4.932 -11.118 -2.356
36 HD3 ARG 4 HD3 ARG 4 5.689 -10.278 -3.709
37 HE ARG 4 HE ARG 4 7.572 -11.963 -2.459
38 HH11 ARG 4 HH11 ARG 4 4.734 -12.088 -4.471
39 HH12 ARG 4 HH12 ARG 4 5.178 -13.580 -5.231
40 HH21 ARG 4 HH21 ARG 4 8.168 -13.928 -3.452
41 HH22 ARG 4 HH22 ARG 4 7.132 -14.626 -4.650
42 H ARG 5 H ARG 5 4.877 -6.514 -4.247
43 HA ARG 5 HA ARG 5 4.543 -8.330 -6.376
44 HB2 ARG 5 HB2 ARG 5 2.744 -6.861 -5.591
45 HB3 ARG 5 HB3 ARG 5 3.639 -5.454 -6.149
46 HG2 ARG 5 HG2 ARG 5 1.916 -5.970 -7.732
47 HG3 ARG 5 HG3 ARG 5 3.486 -6.321 -8.458
48 HD2 ARG 5 HD2 ARG 5 1.766 -8.060 -8.897
49 HD3 ARG 5 HD3 ARG 5 3.203 -8.671 -8.079
50 HE ARG 5 HE ARG 5 1.900 -9.211 -6.280
51 HH11 ARG 5 HH11 ARG 5 0.162 -6.979 -8.309
52 HH12 ARG 5 HH12 ARG 5 -1.319 -7.122 -7.420
53 HH21 ARG 5 HH21 ARG 5 -0.044 -9.408 -5.102
54 HH22 ARG 5 HH22 ARG 5 -1.434 -8.503 -5.596
55 H TYR 6 H TYR 6 6.150 -5.174 -6.189
56 HA TYR 6 HA TYR 6 6.835 -4.977 -8.909
57 HB2 TYR 6 HB2 TYR 6 8.120 -3.787 -6.447
58 HB3 TYR 6 HB3 TYR 6 8.588 -3.365 -8.091
59 HD1 TYR 6 HD1 TYR 6 6.020 -3.180 -9.468
60 HD2 TYR 6 HD2 TYR 6 7.102 -1.899 -5.558
61 HE1 TYR 6 HE1 TYR 6 4.245 -1.479 -9.540
62 HE2 TYR 6 HE2 TYR 6 5.329 -0.196 -5.619
63 HH TYR 6 HH TYR 6 2.949 -0.067 -7.077
64 H LEU 7 H LEU 7 8.220 -6.771 -6.289
65 HA LEU 7 HA LEU 7 10.733 -7.253 -7.630
66 HB2 LEU 7 HB2 LEU 7 9.487 -8.323 -5.112
67 HB3 LEU 7 HB3 LEU 7 11.027 -8.915 -5.732
68 HG LEU 7 HG LEU 7 10.548 -6.020 -5.058
69 HD11 LEU 7 HD11 LEU 7 12.185 -7.231 -3.116
70 HD12 LEU 7 HD12 LEU 7 10.743 -8.234 -3.263
71 HD13 LEU 7 HD13 LEU 7 10.588 -6.515 -2.900
72 HD21 LEU 7 HD21 LEU 7 13.127 -6.304 -4.746
73 HD22 LEU 7 HD22 LEU 7 12.444 -6.097 -6.359
74 HD23 LEU 7 HD23 LEU 7 12.899 -7.705 -5.794
75 H SER 8 H SER 8 7.618 -8.749 -7.405
76 HA SER 8 HA SER 8 8.539 -11.295 -8.439
77 HB2 SER 8 HB2 SER 8 6.744 -11.536 -6.936
78 HB3 SER 8 HB3 SER 8 5.847 -10.197 -7.653
79 HG SER 8 HG SER 8 4.873 -11.955 -8.468
80 H VAL 9 H VAL 9 6.589 -8.554 -9.566
81 HA VAL 9 HA VAL 9 5.878 -9.503 -12.072
82 HB VAL 9 HB VAL 9 5.671 -7.164 -12.773
83 HG11 VAL 9 HG11 VAL 9 3.761 -7.151 -11.643
84 HG12 VAL 9 HG12 VAL 9 4.404 -8.383 -10.556
85 HG13 VAL 9 HG13 VAL 9 4.612 -6.674 -10.175
86 HG21 VAL 9 HG21 VAL 9 7.392 -5.896 -12.010
87 HG22 VAL 9 HG22 VAL 9 6.230 -5.532 -10.734
88 HG23 VAL 9 HG23 VAL 9 7.482 -6.746 -10.468
89 H PHE 10 H PHE 10 8.929 -8.244 -10.942
90 HA PHE 10 HA PHE 10 10.107 -7.725 -13.455
91 HB2 PHE 10 HB2 PHE 10 11.081 -8.072 -10.669
92 HB3 PHE 10 HB3 PHE 10 12.264 -8.268 -11.958
93 HD1 PHE 10 HD1 PHE 10 9.369 -5.949 -11.676
94 HD2 PHE 10 HD2 PHE 10 13.597 -6.384 -11.905
95 HE1 PHE 10 HE1 PHE 10 9.609 -3.504 -11.821
96 HE2 PHE 10 HE2 PHE 10 13.844 -3.940 -12.049
97 HZ PHE 10 HZ PHE 10 11.849 -2.497 -12.006
98 H PHE 11 H PHE 11 9.578 -10.636 -11.654
99 HA PHE 11 HA PHE 11 11.457 -12.183 -13.233
100 HB2 PHE 11 HB2 PHE 11 9.652 -12.760 -10.914
101 HB3 PHE 11 HB3 PHE 11 10.257 -14.097 -11.887
102 HD1 PHE 11 HD1 PHE 11 11.574 -11.002 -10.266
103 HD2 PHE 11 HD2 PHE 11 12.166 -15.122 -11.154
104 HE1 PHE 11 HE1 PHE 11 13.678 -10.971 -8.991
105 HE2 PHE 11 HE2 PHE 11 14.270 -15.098 -9.879
106 HZ PHE 11 HZ PHE 11 15.028 -13.021 -8.795
107 H ARG 12 H ARG 12 7.944 -11.939 -12.808
108 HA ARG 12 HA ARG 12 7.217 -13.948 -14.624
109 HB2 ARG 12 HB2 ARG 12 5.678 -11.432 -13.959
110 HB3 ARG 12 HB3 ARG 12 5.014 -12.912 -14.637
111 HG2 ARG 12 HG2 ARG 12 6.399 -12.878 -11.979
112 HG3 ARG 12 HG3 ARG 12 4.684 -12.498 -12.147
113 HD2 ARG 12 HD2 ARG 12 4.542 -14.742 -11.758
114 HD3 ARG 12 HD3 ARG 12 4.680 -14.755 -13.516
115 HE ARG 12 HE ARG 12 7.255 -14.909 -12.644
116 HH11 ARG 12 HH11 ARG 12 4.359 -16.749 -12.053
117 HH12 ARG 12 HH12 ARG 12 5.204 -18.238 -11.784
118 HH21 ARG 12 HH21 ARG 12 8.378 -16.863 -12.291
119 HH22 ARG 12 HH22 ARG 12 7.490 -18.301 -11.919
120 H LYS 13 H LYS 13 8.090 -10.590 -15.091
121 HA LYS 13 HA LYS 13 7.134 -10.163 -17.666
122 HB2 LYS 13 HB2 LYS 13 8.413 -8.605 -15.954
123 HB3 LYS 13 HB3 LYS 13 9.813 -9.086 -16.903
124 HG2 LYS 13 HG2 LYS 13 8.972 -7.014 -17.753
125 HG3 LYS 13 HG3 LYS 13 8.656 -8.283 -18.938
126 HD2 LYS 13 HD2 LYS 13 6.390 -8.234 -18.587
127 HD3 LYS 13 HD3 LYS 13 6.551 -7.664 -16.924
128 HE2 LYS 13 HE2 LYS 13 6.944 -5.454 -17.605
129 HE3 LYS 13 HE3 LYS 13 7.299 -5.937 -19.263
130 HZ1 LYS 13 HZ1 LYS 13 4.723 -6.798 -18.721
131 HZ2 LYS 13 HZ2 LYS 13 5.191 -5.533 -19.743
132 HZ3 LYS 13 HZ3 LYS 13 4.818 -5.219 -18.123
133 H HIS 14 H HIS 14 10.209 -11.582 -16.614
134 HA HIS 14 HA HIS 14 10.942 -12.166 -19.371
135 HB2 HIS 14 HB2 HIS 14 12.364 -12.487 -16.733
136 HB3 HIS 14 HB3 HIS 14 13.003 -13.168 -18.226
137 HD1 HIS 14 HD1 HIS 14 14.426 -11.659 -19.594
138 HD2 HIS 14 HD2 HIS 14 12.067 -9.561 -16.893
139 HE1 HIS 14 HE1 HIS 14 15.163 -9.262 -19.778
140 H ILE 15 H ILE 15 10.880 -14.102 -16.372
141 HA ILE 15 HA ILE 15 10.918 -16.600 -17.571
142 HB ILE 15 HB ILE 15 9.551 -15.846 -14.985
143 HG12 ILE 15 HG12 ILE 15 12.306 -17.022 -15.317
144 HG13 ILE 15 HG13 ILE 15 12.037 -15.282 -15.302
145 HG21 ILE 15 HG21 ILE 15 8.907 -17.966 -14.868
146 HG22 ILE 15 HG22 ILE 15 9.707 -18.329 -16.396
147 HG23 ILE 15 HG23 ILE 15 10.601 -18.453 -14.881
148 HD11 ILE 15 HD11 ILE 15 12.694 -16.497 -13.120
149 HD12 ILE 15 HD12 ILE 15 11.431 -15.267 -13.079
150 HD13 ILE 15 HD13 ILE 15 10.998 -16.977 -13.077
151 H THR 16 H THR 16 7.997 -15.242 -16.049
152 HA THR 16 HA THR 16 6.255 -16.964 -17.485
153 HB THR 16 HB THR 16 5.613 -14.429 -15.965
154 HG1 THR 16 HG1 THR 16 5.979 -17.115 -15.236
155 HG21 THR 16 HG21 THR 16 3.330 -15.352 -15.842
156 HG22 THR 16 HG22 THR 16 3.819 -16.669 -16.907
157 HG23 THR 16 HG23 THR 16 3.818 -15.008 -17.501
Start of MODEL 12
1 H1 GLU 1 H1 GLU 1 0.265 -0.895 0.891
2 HA GLU 1 HA GLU 1 2.021 -0.287 -1.243
3 HB2 GLU 1 HB2 GLU 1 1.852 0.756 1.132
4 HB3 GLU 1 HB3 GLU 1 2.931 -0.549 1.606
5 HG2 GLU 1 HG2 GLU 1 4.607 0.210 0.053
6 HG3 GLU 1 HG3 GLU 1 3.517 1.449 -0.566
7 H LYS 2 H LYS 2 1.554 -2.810 -1.802
8 HA LYS 2 HA LYS 2 3.548 -4.551 -0.620
9 HB2 LYS 2 HB2 LYS 2 1.256 -5.337 -1.298
10 HB3 LYS 2 HB3 LYS 2 1.736 -5.105 -2.974
11 HG2 LYS 2 HG2 LYS 2 3.550 -6.736 -2.658
12 HG3 LYS 2 HG3 LYS 2 3.000 -6.998 -1.002
13 HD2 LYS 2 HD2 LYS 2 1.208 -7.381 -3.389
14 HD3 LYS 2 HD3 LYS 2 2.214 -8.676 -2.737
15 HE2 LYS 2 HE2 LYS 2 0.354 -7.133 -0.966
16 HE3 LYS 2 HE3 LYS 2 -0.238 -8.474 -1.945
17 HZ1 LYS 2 HZ1 LYS 2 2.125 -8.865 -0.242
18 HZ2 LYS 2 HZ2 LYS 2 0.978 -9.996 -0.760
19 HZ3 LYS 2 HZ3 LYS 2 0.586 -8.893 0.461
20 H PHE 3 H PHE 3 5.419 -3.319 -1.252
21 HA PHE 3 HA PHE 3 6.090 -2.700 -3.901
22 HB2 PHE 3 HB2 PHE 3 7.207 -1.971 -1.670
23 HB3 PHE 3 HB3 PHE 3 8.164 -3.437 -1.856
24 HD1 PHE 3 HD1 PHE 3 7.002 -0.779 -4.207
25 HD2 PHE 3 HD2 PHE 3 10.279 -2.961 -2.588
26 HE1 PHE 3 HE1 PHE 3 8.539 0.421 -5.708
27 HE2 PHE 3 HE2 PHE 3 11.821 -1.763 -4.086
28 HZ PHE 3 HZ PHE 3 10.951 -0.071 -5.649
29 H ARG 4 H ARG 4 6.226 -5.678 -2.130
30 HA ARG 4 HA ARG 4 8.134 -7.110 -3.537
31 HB2 ARG 4 HB2 ARG 4 5.661 -7.844 -2.042
32 HB3 ARG 4 HB3 ARG 4 6.427 -9.080 -3.030
33 HG2 ARG 4 HG2 ARG 4 8.586 -8.269 -1.745
34 HG3 ARG 4 HG3 ARG 4 7.388 -7.762 -0.553
35 HD2 ARG 4 HD2 ARG 4 6.455 -10.066 -0.601
36 HD3 ARG 4 HD3 ARG 4 7.777 -10.535 -1.670
37 HE ARG 4 HE ARG 4 7.903 -10.159 1.165
38 HH11 ARG 4 HH11 ARG 4 9.734 -10.030 -1.793
39 HH12 ARG 4 HH12 ARG 4 11.257 -10.304 -1.015
40 HH21 ARG 4 HH21 ARG 4 9.902 -10.521 2.201
41 HH22 ARG 4 HH22 ARG 4 11.352 -10.584 1.256
42 H ARG 5 H ARG 5 4.912 -6.180 -4.472
43 HA ARG 5 HA ARG 5 4.433 -7.993 -6.536
44 HB2 ARG 5 HB2 ARG 5 2.702 -6.500 -5.715
45 HB3 ARG 5 HB3 ARG 5 3.598 -5.099 -6.288
46 HG2 ARG 5 HG2 ARG 5 1.756 -5.621 -7.776
47 HG3 ARG 5 HG3 ARG 5 3.304 -5.847 -8.593
48 HD2 ARG 5 HD2 ARG 5 3.160 -8.256 -8.195
49 HD3 ARG 5 HD3 ARG 5 1.618 -8.030 -7.371
50 HE ARG 5 HE ARG 5 1.622 -6.984 -10.036
51 HH11 ARG 5 HH11 ARG 5 1.232 -9.865 -8.121
52 HH12 ARG 5 HH12 ARG 5 0.251 -10.672 -9.299
53 HH21 ARG 5 HH21 ARG 5 0.330 -8.036 -11.594
54 HH22 ARG 5 HH22 ARG 5 -0.261 -9.631 -11.274
55 H TYR 6 H TYR 6 6.304 -5.013 -6.488
56 HA TYR 6 HA TYR 6 6.738 -4.912 -9.304
57 HB2 TYR 6 HB2 TYR 6 8.068 -3.564 -6.959
58 HB3 TYR 6 HB3 TYR 6 8.613 -3.312 -8.614
59 HD1 TYR 6 HD1 TYR 6 6.585 -2.730 -10.291
60 HD2 TYR 6 HD2 TYR 6 6.611 -2.003 -6.099
61 HE1 TYR 6 HE1 TYR 6 4.882 -0.980 -10.590
62 HE2 TYR 6 HE2 TYR 6 4.907 -0.253 -6.386
63 HH TYR 6 HH TYR 6 4.026 1.198 -8.074
64 H LEU 7 H LEU 7 8.255 -6.557 -6.660
65 HA LEU 7 HA LEU 7 10.696 -7.132 -8.083
66 HB2 LEU 7 HB2 LEU 7 9.545 -7.838 -5.430
67 HB3 LEU 7 HB3 LEU 7 10.837 -8.845 -6.080
68 HG LEU 7 HG LEU 7 12.251 -6.793 -6.249
69 HD11 LEU 7 HD11 LEU 7 11.318 -4.984 -4.555
70 HD12 LEU 7 HD12 LEU 7 9.772 -5.593 -5.145
71 HD13 LEU 7 HD13 LEU 7 10.948 -4.928 -6.278
72 HD21 LEU 7 HD21 LEU 7 11.450 -8.251 -3.904
73 HD22 LEU 7 HD22 LEU 7 11.924 -6.606 -3.478
74 HD23 LEU 7 HD23 LEU 7 13.044 -7.647 -4.359
75 H SER 8 H SER 8 7.581 -8.589 -7.676
76 HA SER 8 HA SER 8 8.417 -11.200 -8.587
77 HB2 SER 8 HB2 SER 8 5.627 -10.083 -8.217
78 HB3 SER 8 HB3 SER 8 6.042 -11.779 -8.460
79 HG SER 8 HG SER 8 7.272 -11.617 -6.487
80 H VAL 9 H VAL 9 6.570 -8.471 -9.898
81 HA VAL 9 HA VAL 9 5.825 -9.528 -12.341
82 HB VAL 9 HB VAL 9 5.893 -7.180 -13.204
83 HG11 VAL 9 HG11 VAL 9 4.302 -6.307 -11.359
84 HG12 VAL 9 HG12 VAL 9 3.855 -7.759 -12.256
85 HG13 VAL 9 HG13 VAL 9 4.536 -7.897 -10.634
86 HG21 VAL 9 HG21 VAL 9 6.386 -5.400 -11.519
87 HG22 VAL 9 HG22 VAL 9 7.072 -6.651 -10.482
88 HG23 VAL 9 HG23 VAL 9 7.800 -6.310 -12.051
89 H PHE 10 H PHE 10 8.904 -8.089 -11.387
90 HA PHE 10 HA PHE 10 10.107 -7.927 -13.898
91 HB2 PHE 10 HB2 PHE 10 11.081 -8.082 -11.094
92 HB3 PHE 10 HB3 PHE 10 12.250 -8.422 -12.366
93 HD1 PHE 10 HD1 PHE 10 11.803 -6.615 -14.451
94 HD2 PHE 10 HD2 PHE 10 11.280 -5.958 -10.278
95 HE1 PHE 10 HE1 PHE 10 12.131 -4.201 -14.793
96 HE2 PHE 10 HE2 PHE 10 11.606 -3.543 -10.614
97 HZ PHE 10 HZ PHE 10 12.033 -2.661 -12.874
98 H PHE 11 H PHE 11 9.490 -10.658 -11.854
99 HA PHE 11 HA PHE 11 11.297 -12.396 -13.317
100 HB2 PHE 11 HB2 PHE 11 9.533 -12.695 -10.922
101 HB3 PHE 11 HB3 PHE 11 10.031 -14.141 -11.793
102 HD1 PHE 11 HD1 PHE 11 11.658 -10.981 -10.641
103 HD2 PHE 11 HD2 PHE 11 11.814 -15.229 -10.869
104 HE1 PHE 11 HE1 PHE 11 13.801 -10.964 -9.433
105 HE2 PHE 11 HE2 PHE 11 13.957 -15.219 -9.660
106 HZ PHE 11 HZ PHE 11 14.954 -13.084 -8.941
107 H ARG 12 H ARG 12 7.806 -11.964 -12.892
108 HA ARG 12 HA ARG 12 6.990 -14.106 -14.521
109 HB2 ARG 12 HB2 ARG 12 5.526 -11.507 -14.027
110 HB3 ARG 12 HB3 ARG 12 4.814 -13.021 -14.570
111 HG2 ARG 12 HG2 ARG 12 6.212 -12.701 -11.927
112 HG3 ARG 12 HG3 ARG 12 4.475 -12.483 -12.151
113 HD2 ARG 12 HD2 ARG 12 5.932 -14.996 -12.941
114 HD3 ARG 12 HD3 ARG 12 5.221 -14.761 -11.344
115 HE ARG 12 HE ARG 12 3.355 -14.278 -13.456
116 HH11 ARG 12 HH11 ARG 12 4.869 -16.760 -11.539
117 HH12 ARG 12 HH12 ARG 12 3.572 -17.890 -11.743
118 HH21 ARG 12 HH21 ARG 12 1.642 -15.758 -13.731
119 HH22 ARG 12 HH22 ARG 12 1.737 -17.320 -12.990
120 H LYS 13 H LYS 13 8.025 -10.859 -15.259
121 HA LYS 13 HA LYS 13 7.004 -10.580 -17.842
122 HB2 LYS 13 HB2 LYS 13 8.157 -8.814 -16.446
123 HB3 LYS 13 HB3 LYS 13 9.685 -9.550 -16.912
124 HG2 LYS 13 HG2 LYS 13 9.417 -7.774 -18.393
125 HG3 LYS 13 HG3 LYS 13 8.923 -9.192 -19.321
126 HD2 LYS 13 HD2 LYS 13 7.208 -7.743 -19.808
127 HD3 LYS 13 HD3 LYS 13 6.543 -8.574 -18.399
128 HE2 LYS 13 HE2 LYS 13 8.159 -6.101 -17.995
129 HE3 LYS 13 HE3 LYS 13 6.500 -5.951 -18.574
130 HZ1 LYS 13 HZ1 LYS 13 6.156 -7.634 -16.551
131 HZ2 LYS 13 HZ2 LYS 13 6.064 -5.953 -16.380
132 HZ3 LYS 13 HZ3 LYS 13 7.487 -6.768 -15.967
133 H HIS 14 H HIS 14 10.138 -11.892 -16.783
134 HA HIS 14 HA HIS 14 10.754 -12.758 -19.484
135 HB2 HIS 14 HB2 HIS 14 12.251 -12.913 -16.869
136 HB3 HIS 14 HB3 HIS 14 12.839 -13.679 -18.342
137 HD1 HIS 14 HD1 HIS 14 14.098 -12.231 -19.952
138 HD2 HIS 14 HD2 HIS 14 12.091 -10.023 -17.061
139 HE1 HIS 14 HE1 HIS 14 14.873 -9.859 -20.260
140 H ILE 15 H ILE 15 10.680 -14.412 -16.320
141 HA ILE 15 HA ILE 15 10.683 -17.012 -17.287
142 HB ILE 15 HB ILE 15 9.334 -16.008 -14.778
143 HG12 ILE 15 HG12 ILE 15 12.078 -17.232 -15.010
144 HG13 ILE 15 HG13 ILE 15 11.821 -15.496 -15.144
145 HG21 ILE 15 HG21 ILE 15 10.066 -18.455 -14.109
146 HG22 ILE 15 HG22 ILE 15 8.526 -18.138 -14.907
147 HG23 ILE 15 HG23 ILE 15 9.902 -18.722 -15.844
148 HD11 ILE 15 HD11 ILE 15 12.446 -16.619 -12.859
149 HD12 ILE 15 HD12 ILE 15 11.321 -15.263 -12.934
150 HD13 ILE 15 HD13 ILE 15 10.708 -16.911 -12.783
151 H THR 16 H THR 16 7.786 -15.515 -15.857
152 HA THR 16 HA THR 16 6.025 -17.316 -17.175
153 HB THR 16 HB THR 16 5.368 -14.692 -15.821
154 HG1 THR 16 HG1 THR 16 4.956 -17.202 -14.632
155 HG21 THR 16 HG21 THR 16 3.726 -16.896 -16.959
156 HG22 THR 16 HG22 THR 16 3.411 -15.162 -16.913
157 HG23 THR 16 HG23 THR 16 3.177 -16.140 -15.464
Start of MODEL 13
1 H1 GLU 1 H1 GLU 1 3.048 1.092 -2.103
2 HA GLU 1 HA GLU 1 3.783 -0.323 0.017
3 HB2 GLU 1 HB2 GLU 1 1.124 -0.674 -1.379
4 HB3 GLU 1 HB3 GLU 1 1.454 -1.117 0.290
5 HG2 GLU 1 HG2 GLU 1 1.429 1.640 -0.905
6 HG3 GLU 1 HG3 GLU 1 0.326 0.972 0.297
7 H LYS 2 H LYS 2 2.720 -1.811 -3.016
8 HA LYS 2 HA LYS 2 3.270 -4.476 -2.004
9 HB2 LYS 2 HB2 LYS 2 2.089 -3.358 -4.516
10 HB3 LYS 2 HB3 LYS 2 2.704 -5.005 -4.518
11 HG2 LYS 2 HG2 LYS 2 1.077 -5.765 -3.102
12 HG3 LYS 2 HG3 LYS 2 0.836 -4.185 -2.354
13 HD2 LYS 2 HD2 LYS 2 -0.495 -3.423 -4.100
14 HD3 LYS 2 HD3 LYS 2 0.133 -4.623 -5.232
15 HE2 LYS 2 HE2 LYS 2 -1.074 -6.378 -4.130
16 HE3 LYS 2 HE3 LYS 2 -1.561 -5.292 -2.830
17 HZ1 LYS 2 HZ1 LYS 2 -2.308 -4.465 -5.510
18 HZ2 LYS 2 HZ2 LYS 2 -3.192 -4.400 -4.068
19 HZ3 LYS 2 HZ3 LYS 2 -3.089 -5.850 -4.932
20 H PHE 3 H PHE 3 5.587 -3.549 -1.688
21 HA PHE 3 HA PHE 3 7.301 -3.214 -3.886
22 HB2 PHE 3 HB2 PHE 3 7.672 -2.732 -1.346
23 HB3 PHE 3 HB3 PHE 3 8.264 -4.389 -1.299
24 HD1 PHE 3 HD1 PHE 3 8.660 -1.576 -3.721
25 HD2 PHE 3 HD2 PHE 3 10.550 -4.437 -1.200
26 HE1 PHE 3 HE1 PHE 3 10.861 -0.807 -4.505
27 HE2 PHE 3 HE2 PHE 3 12.755 -3.672 -1.979
28 HZ PHE 3 HZ PHE 3 12.913 -1.855 -3.635
29 H ARG 4 H ARG 4 6.701 -6.081 -1.862
30 HA ARG 4 HA ARG 4 8.413 -7.861 -3.095
31 HB2 ARG 4 HB2 ARG 4 6.306 -8.003 -1.222
32 HB3 ARG 4 HB3 ARG 4 5.949 -9.199 -2.460
33 HG2 ARG 4 HG2 ARG 4 7.209 -10.225 -0.693
34 HG3 ARG 4 HG3 ARG 4 8.204 -10.149 -2.148
35 HD2 ARG 4 HD2 ARG 4 9.388 -9.529 -0.031
36 HD3 ARG 4 HD3 ARG 4 9.445 -8.303 -1.298
37 HE ARG 4 HE ARG 4 7.277 -7.918 0.535
38 HH11 ARG 4 HH11 ARG 4 10.672 -7.366 -0.001
39 HH12 ARG 4 HH12 ARG 4 10.747 -5.988 1.046
40 HH21 ARG 4 HH21 ARG 4 7.362 -6.105 1.916
41 HH22 ARG 4 HH22 ARG 4 8.864 -5.272 2.137
42 H ARG 5 H ARG 5 5.242 -6.764 -4.122
43 HA ARG 5 HA ARG 5 4.731 -8.673 -6.105
44 HB2 ARG 5 HB2 ARG 5 3.131 -6.935 -5.199
45 HB3 ARG 5 HB3 ARG 5 3.936 -5.765 -6.235
46 HG2 ARG 5 HG2 ARG 5 2.012 -6.460 -7.397
47 HG3 ARG 5 HG3 ARG 5 3.371 -7.273 -8.175
48 HD2 ARG 5 HD2 ARG 5 1.605 -8.864 -7.920
49 HD3 ARG 5 HD3 ARG 5 2.880 -9.276 -6.774
50 HE ARG 5 HE ARG 5 0.807 -7.609 -5.675
51 HH11 ARG 5 HH11 ARG 5 1.835 -10.872 -6.320
52 HH12 ARG 5 HH12 ARG 5 0.848 -11.567 -5.076
53 HH21 ARG 5 HH21 ARG 5 -0.496 -8.512 -4.035
54 HH22 ARG 5 HH22 ARG 5 -0.478 -10.224 -3.778
55 H TYR 6 H TYR 6 6.263 -5.470 -6.380
56 HA TYR 6 HA TYR 6 6.782 -5.495 -9.104
57 HB2 TYR 6 HB2 TYR 6 8.421 -4.271 -6.876
58 HB3 TYR 6 HB3 TYR 6 8.624 -3.902 -8.585
59 HD1 TYR 6 HD1 TYR 6 5.819 -3.729 -9.484
60 HD2 TYR 6 HD2 TYR 6 7.660 -2.280 -5.932
61 HE1 TYR 6 HE1 TYR 6 4.098 -1.979 -9.313
62 HE2 TYR 6 HE2 TYR 6 5.944 -0.527 -5.751
63 HH TYR 6 HH TYR 6 3.099 -0.573 -7.277
64 H LEU 7 H LEU 7 8.386 -7.172 -6.515
65 HA LEU 7 HA LEU 7 10.740 -7.834 -8.012
66 HB2 LEU 7 HB2 LEU 7 9.598 -8.575 -5.370
67 HB3 LEU 7 HB3 LEU 7 10.814 -9.638 -6.074
68 HG LEU 7 HG LEU 7 11.814 -8.075 -4.500
69 HD11 LEU 7 HD11 LEU 7 12.661 -8.583 -7.097
70 HD12 LEU 7 HD12 LEU 7 13.646 -8.007 -5.753
71 HD13 LEU 7 HD13 LEU 7 12.919 -6.853 -6.870
72 HD21 LEU 7 HD21 LEU 7 11.857 -5.668 -5.003
73 HD22 LEU 7 HD22 LEU 7 10.226 -6.253 -4.673
74 HD23 LEU 7 HD23 LEU 7 10.730 -5.939 -6.333
75 H SER 8 H SER 8 7.713 -9.470 -7.204
76 HA SER 8 HA SER 8 8.415 -11.956 -8.391
77 HB2 SER 8 HB2 SER 8 5.667 -10.815 -7.829
78 HB3 SER 8 HB3 SER 8 6.034 -12.505 -8.170
79 HG SER 8 HG SER 8 7.164 -12.628 -6.253
80 H VAL 9 H VAL 9 6.535 -9.165 -9.515
81 HA VAL 9 HA VAL 9 5.781 -10.223 -12.005
82 HB VAL 9 HB VAL 9 5.305 -7.952 -12.688
83 HG11 VAL 9 HG11 VAL 9 3.534 -7.790 -11.330
84 HG12 VAL 9 HG12 VAL 9 4.185 -9.224 -10.534
85 HG13 VAL 9 HG13 VAL 9 4.539 -7.620 -9.891
86 HG21 VAL 9 HG21 VAL 9 6.908 -7.138 -10.267
87 HG22 VAL 9 HG22 VAL 9 7.315 -6.842 -11.957
88 HG23 VAL 9 HG23 VAL 9 5.920 -6.042 -11.232
89 H PHE 10 H PHE 10 8.735 -8.736 -10.902
90 HA PHE 10 HA PHE 10 9.872 -8.026 -13.354
91 HB2 PHE 10 HB2 PHE 10 10.681 -7.628 -10.892
92 HB3 PHE 10 HB3 PHE 10 11.562 -9.132 -11.140
93 HD1 PHE 10 HD1 PHE 10 13.068 -9.253 -13.234
94 HD2 PHE 10 HD2 PHE 10 11.609 -5.621 -11.563
95 HE1 PHE 10 HE1 PHE 10 14.868 -8.014 -14.365
96 HE2 PHE 10 HE2 PHE 10 13.405 -4.376 -12.692
97 HZ PHE 10 HZ PHE 10 15.037 -5.572 -14.095
98 H PHE 11 H PHE 11 9.502 -11.121 -11.814
99 HA PHE 11 HA PHE 11 11.335 -12.438 -13.640
100 HB2 PHE 11 HB2 PHE 11 9.706 -13.309 -11.280
101 HB3 PHE 11 HB3 PHE 11 10.325 -14.516 -12.403
102 HD1 PHE 11 HD1 PHE 11 11.651 -11.447 -10.735
103 HD2 PHE 11 HD2 PHE 11 12.240 -15.548 -11.708
104 HE1 PHE 11 HE1 PHE 11 13.820 -11.407 -9.574
105 HE2 PHE 11 HE2 PHE 11 14.409 -15.516 -10.548
106 HZ PHE 11 HZ PHE 11 15.203 -13.443 -9.480
107 H ARG 12 H ARG 12 7.863 -12.210 -13.056
108 HA ARG 12 HA ARG 12 7.103 -14.128 -15.005
109 HB2 ARG 12 HB2 ARG 12 5.503 -11.823 -13.879
110 HB3 ARG 12 HB3 ARG 12 4.850 -13.206 -14.746
111 HG2 ARG 12 HG2 ARG 12 6.476 -13.733 -12.322
112 HG3 ARG 12 HG3 ARG 12 4.852 -13.077 -12.110
113 HD2 ARG 12 HD2 ARG 12 4.310 -15.007 -13.882
114 HD3 ARG 12 HD3 ARG 12 5.725 -15.723 -13.111
115 HE ARG 12 HE ARG 12 4.147 -14.929 -11.032
116 HH11 ARG 12 HH11 ARG 12 3.703 -16.964 -13.822
117 HH12 ARG 12 HH12 ARG 12 2.540 -17.991 -13.050
118 HH21 ARG 12 HH21 ARG 12 2.617 -16.273 -10.005
119 HH22 ARG 12 HH22 ARG 12 1.922 -17.596 -10.879
120 H LYS 13 H LYS 13 7.909 -10.751 -15.132
121 HA LYS 13 HA LYS 13 6.686 -10.086 -17.579
122 HB2 LYS 13 HB2 LYS 13 7.607 -8.443 -15.951
123 HB3 LYS 13 HB3 LYS 13 9.230 -8.941 -16.411
124 HG2 LYS 13 HG2 LYS 13 8.925 -7.041 -17.672
125 HG3 LYS 13 HG3 LYS 13 8.474 -8.313 -18.809
126 HD2 LYS 13 HD2 LYS 13 6.729 -6.833 -19.074
127 HD3 LYS 13 HD3 LYS 13 6.075 -7.916 -17.843
128 HE2 LYS 13 HE2 LYS 13 6.273 -6.357 -16.173
129 HE3 LYS 13 HE3 LYS 13 7.612 -5.524 -16.961
130 HZ1 LYS 13 HZ1 LYS 13 5.776 -4.099 -17.137
131 HZ2 LYS 13 HZ2 LYS 13 4.726 -5.344 -17.596
132 HZ3 LYS 13 HZ3 LYS 13 5.918 -4.805 -18.668
133 H HIS 14 H HIS 14 9.849 -11.456 -16.809
134 HA HIS 14 HA HIS 14 10.517 -11.604 -19.650
135 HB2 HIS 14 HB2 HIS 14 12.092 -12.043 -17.122
136 HB3 HIS 14 HB3 HIS 14 12.710 -12.556 -18.690
137 HD1 HIS 14 HD1 HIS 14 12.968 -10.558 -20.499
138 HD2 HIS 14 HD2 HIS 14 12.552 -9.428 -16.523
139 HE1 HIS 14 HE1 HIS 14 13.763 -8.174 -20.391
140 H ILE 15 H ILE 15 10.816 -13.858 -16.899
141 HA ILE 15 HA ILE 15 10.969 -16.189 -18.402
142 HB ILE 15 HB ILE 15 9.792 -15.870 -15.638
143 HG12 ILE 15 HG12 ILE 15 12.489 -16.975 -15.907
144 HG13 ILE 15 HG13 ILE 15 12.364 -15.315 -16.478
145 HG21 ILE 15 HG21 ILE 15 10.192 -18.181 -17.361
146 HG22 ILE 15 HG22 ILE 15 10.975 -18.349 -15.790
147 HG23 ILE 15 HG23 ILE 15 9.245 -18.020 -15.882
148 HD11 ILE 15 HD11 ILE 15 12.637 -16.219 -13.842
149 HD12 ILE 15 HD12 ILE 15 12.388 -14.565 -14.401
150 HD13 ILE 15 HD13 ILE 15 11.002 -15.572 -13.979
151 H THR 16 H THR 16 8.098 -15.277 -16.498
152 HA THR 16 HA THR 16 6.374 -16.990 -17.958
153 HB THR 16 HB THR 16 5.523 -14.635 -16.271
154 HG1 THR 16 HG1 THR 16 5.793 -17.268 -15.285
155 HG21 THR 16 HG21 THR 16 4.192 -17.108 -17.301
156 HG22 THR 16 HG22 THR 16 3.602 -15.447 -17.278
157 HG23 THR 16 HG23 THR 16 3.650 -16.386 -15.786
Start of MODEL 14
1 H1 GLU 1 H1 GLU 1 3.135 -6.457 1.566
2 HA GLU 1 HA GLU 1 3.732 -8.415 -0.463
3 HB2 GLU 1 HB2 GLU 1 1.359 -8.742 -0.614
4 HB3 GLU 1 HB3 GLU 1 1.782 -8.601 1.086
5 HG2 GLU 1 HG2 GLU 1 1.152 -6.131 0.839
6 HG3 GLU 1 HG3 GLU 1 0.375 -6.623 -0.665
7 H LYS 2 H LYS 2 2.778 -5.057 -0.332
8 HA LYS 2 HA LYS 2 1.968 -4.776 -3.027
9 HB2 LYS 2 HB2 LYS 2 1.462 -3.156 -1.192
10 HB3 LYS 2 HB3 LYS 2 3.148 -2.655 -1.224
11 HG2 LYS 2 HG2 LYS 2 2.930 -1.776 -3.421
12 HG3 LYS 2 HG3 LYS 2 1.328 -2.491 -3.612
13 HD2 LYS 2 HD2 LYS 2 0.852 -0.269 -3.128
14 HD3 LYS 2 HD3 LYS 2 0.699 -1.056 -1.555
15 HE2 LYS 2 HE2 LYS 2 2.745 -0.209 -0.805
16 HE3 LYS 2 HE3 LYS 2 3.290 0.171 -2.438
17 HZ1 LYS 2 HZ1 LYS 2 1.433 1.649 -0.709
18 HZ2 LYS 2 HZ2 LYS 2 1.250 1.762 -2.387
19 HZ3 LYS 2 HZ3 LYS 2 2.705 2.228 -1.663
20 H PHE 3 H PHE 3 5.050 -4.025 -1.406
21 HA PHE 3 HA PHE 3 6.392 -3.286 -3.796
22 HB2 PHE 3 HB2 PHE 3 6.966 -2.841 -1.254
23 HB3 PHE 3 HB3 PHE 3 7.899 -4.323 -1.434
24 HD1 PHE 3 HD1 PHE 3 7.398 -0.982 -2.988
25 HD2 PHE 3 HD2 PHE 3 10.048 -4.238 -2.284
26 HE1 PHE 3 HE1 PHE 3 9.241 0.306 -3.987
27 HE2 PHE 3 HE2 PHE 3 11.895 -2.954 -3.281
28 HZ PHE 3 HZ PHE 3 11.493 -0.680 -4.135
29 H ARG 4 H ARG 4 5.918 -6.310 -2.113
30 HA ARG 4 HA ARG 4 7.942 -7.824 -3.332
31 HB2 ARG 4 HB2 ARG 4 5.383 -8.433 -1.940
32 HB3 ARG 4 HB3 ARG 4 6.113 -9.715 -2.896
33 HG2 ARG 4 HG2 ARG 4 6.772 -9.836 -0.549
34 HG3 ARG 4 HG3 ARG 4 8.158 -9.551 -1.603
35 HD2 ARG 4 HD2 ARG 4 8.344 -7.315 -0.948
36 HD3 ARG 4 HD3 ARG 4 6.708 -7.278 -0.292
37 HE ARG 4 HE ARG 4 8.103 -9.145 1.194
38 HH11 ARG 4 HH11 ARG 4 8.313 -5.736 0.516
39 HH12 ARG 4 HH12 ARG 4 9.031 -5.344 2.043
40 HH21 ARG 4 HH21 ARG 4 9.048 -8.641 3.208
41 HH22 ARG 4 HH22 ARG 4 9.450 -6.997 3.573
42 H ARG 5 H ARG 5 4.800 -6.812 -4.449
43 HA ARG 5 HA ARG 5 4.487 -8.655 -6.560
44 HB2 ARG 5 HB2 ARG 5 2.622 -7.320 -5.749
45 HB3 ARG 5 HB3 ARG 5 3.428 -5.841 -6.252
46 HG2 ARG 5 HG2 ARG 5 1.725 -6.379 -7.844
47 HG3 ARG 5 HG3 ARG 5 3.303 -6.623 -8.597
48 HD2 ARG 5 HD2 ARG 5 1.969 -8.478 -9.219
49 HD3 ARG 5 HD3 ARG 5 3.089 -9.058 -7.987
50 HE ARG 5 HE ARG 5 0.851 -8.345 -6.596
51 HH11 ARG 5 HH11 ARG 5 1.519 -10.481 -9.262
52 HH12 ARG 5 HH12 ARG 5 0.240 -11.582 -8.870
53 HH21 ARG 5 HH21 ARG 5 -0.836 -9.787 -6.069
54 HH22 ARG 5 HH22 ARG 5 -1.099 -11.186 -7.054
55 H TYR 6 H TYR 6 6.175 -5.586 -6.309
56 HA TYR 6 HA TYR 6 6.643 -5.195 -9.067
57 HB2 TYR 6 HB2 TYR 6 8.197 -4.227 -6.659
58 HB3 TYR 6 HB3 TYR 6 8.451 -3.658 -8.305
59 HD1 TYR 6 HD1 TYR 6 5.764 -3.304 -9.336
60 HD2 TYR 6 HD2 TYR 6 7.290 -2.471 -5.452
61 HE1 TYR 6 HE1 TYR 6 4.017 -1.601 -9.021
62 HE2 TYR 6 HE2 TYR 6 5.547 -0.767 -5.126
63 HH TYR 6 HH TYR 6 3.850 0.601 -7.481
64 H LEU 7 H LEU 7 8.203 -7.148 -6.648
65 HA LEU 7 HA LEU 7 10.595 -7.609 -8.170
66 HB2 LEU 7 HB2 LEU 7 9.443 -8.608 -5.623
67 HB3 LEU 7 HB3 LEU 7 10.665 -9.600 -6.416
68 HG LEU 7 HG LEU 7 11.561 -8.110 -4.643
69 HD11 LEU 7 HD11 LEU 7 12.552 -8.586 -7.238
70 HD12 LEU 7 HD12 LEU 7 13.464 -8.251 -5.767
71 HD13 LEU 7 HD13 LEU 7 12.974 -6.925 -6.821
72 HD21 LEU 7 HD21 LEU 7 9.978 -6.230 -5.131
73 HD22 LEU 7 HD22 LEU 7 10.949 -5.867 -6.558
74 HD23 LEU 7 HD23 LEU 7 11.667 -5.750 -4.951
75 H SER 8 H SER 8 7.508 -9.212 -7.731
76 HA SER 8 HA SER 8 8.285 -11.609 -9.106
77 HB2 SER 8 HB2 SER 8 5.714 -11.945 -9.127
78 HB3 SER 8 HB3 SER 8 6.546 -11.951 -7.572
79 HG SER 8 HG SER 8 4.556 -10.414 -8.291
80 H VAL 9 H VAL 9 6.281 -8.788 -9.919
81 HA VAL 9 HA VAL 9 5.525 -9.524 -12.486
82 HB VAL 9 HB VAL 9 5.213 -7.146 -12.956
83 HG11 VAL 9 HG11 VAL 9 3.345 -7.506 -11.799
84 HG12 VAL 9 HG12 VAL 9 4.187 -8.521 -10.625
85 HG13 VAL 9 HG13 VAL 9 4.156 -6.769 -10.417
86 HG21 VAL 9 HG21 VAL 9 6.848 -6.773 -10.456
87 HG22 VAL 9 HG22 VAL 9 7.173 -6.152 -12.075
88 HG23 VAL 9 HG23 VAL 9 5.828 -5.505 -11.135
89 H PHE 10 H PHE 10 8.555 -8.220 -11.323
90 HA PHE 10 HA PHE 10 9.630 -7.511 -13.850
91 HB2 PHE 10 HB2 PHE 10 10.459 -6.715 -11.600
92 HB3 PHE 10 HB3 PHE 10 11.193 -8.301 -11.389
93 HD1 PHE 10 HD1 PHE 10 11.002 -5.971 -14.295
94 HD2 PHE 10 HD2 PHE 10 13.472 -8.118 -11.574
95 HE1 PHE 10 HE1 PHE 10 13.000 -5.202 -15.508
96 HE2 PHE 10 HE2 PHE 10 15.474 -7.352 -12.782
97 HZ PHE 10 HZ PHE 10 15.239 -5.893 -14.753
98 H PHE 11 H PHE 11 9.370 -10.496 -12.103
99 HA PHE 11 HA PHE 11 11.295 -11.854 -13.808
100 HB2 PHE 11 HB2 PHE 11 9.745 -12.570 -11.359
101 HB3 PHE 11 HB3 PHE 11 10.297 -13.874 -12.406
102 HD1 PHE 11 HD1 PHE 11 11.938 -10.662 -11.493
103 HD2 PHE 11 HD2 PHE 11 12.026 -14.912 -11.282
104 HE1 PHE 11 HE1 PHE 11 14.160 -10.561 -10.440
105 HE2 PHE 11 HE2 PHE 11 14.247 -14.818 -10.228
106 HZ PHE 11 HZ PHE 11 15.317 -12.640 -9.805
107 H ARG 12 H ARG 12 7.809 -11.828 -13.207
108 HA ARG 12 HA ARG 12 7.044 -13.922 -14.863
109 HB2 ARG 12 HB2 ARG 12 5.552 -11.338 -14.372
110 HB3 ARG 12 HB3 ARG 12 4.850 -12.835 -14.970
111 HG2 ARG 12 HG2 ARG 12 6.086 -13.608 -12.634
112 HG3 ARG 12 HG3 ARG 12 5.445 -12.009 -12.252
113 HD2 ARG 12 HD2 ARG 12 3.244 -12.766 -13.168
114 HD3 ARG 12 HD3 ARG 12 3.924 -14.387 -13.307
115 HE ARG 12 HE ARG 12 2.963 -13.136 -10.938
116 HH11 ARG 12 HH11 ARG 12 5.347 -15.369 -12.142
117 HH12 ARG 12 HH12 ARG 12 5.485 -16.231 -10.645
118 HH21 ARG 12 HH21 ARG 12 3.136 -14.263 -8.962
119 HH22 ARG 12 HH22 ARG 12 4.226 -15.602 -8.838
120 H LYS 13 H LYS 13 8.121 -10.723 -15.663
121 HA LYS 13 HA LYS 13 7.072 -10.367 -18.201
122 HB2 LYS 13 HB2 LYS 13 8.449 -8.721 -16.882
123 HB3 LYS 13 HB3 LYS 13 9.879 -9.620 -17.372
124 HG2 LYS 13 HG2 LYS 13 9.852 -7.958 -18.940
125 HG3 LYS 13 HG3 LYS 13 8.942 -9.216 -19.780
126 HD2 LYS 13 HD2 LYS 13 7.683 -7.261 -20.091
127 HD3 LYS 13 HD3 LYS 13 6.855 -8.122 -18.791
128 HE2 LYS 13 HE2 LYS 13 6.937 -5.963 -17.971
129 HE3 LYS 13 HE3 LYS 13 8.364 -6.692 -17.235
130 HZ1 LYS 13 HZ1 LYS 13 8.215 -4.469 -18.958
131 HZ2 LYS 13 HZ2 LYS 13 9.146 -5.673 -19.698
132 HZ3 LYS 13 HZ3 LYS 13 9.567 -5.102 -18.163
133 H HIS 14 H HIS 14 10.257 -11.772 -17.413
134 HA HIS 14 HA HIS 14 10.501 -12.830 -20.099
135 HB2 HIS 14 HB2 HIS 14 12.359 -13.303 -17.767
136 HB3 HIS 14 HB3 HIS 14 12.723 -13.469 -19.482
137 HD1 HIS 14 HD1 HIS 14 13.704 -11.474 -20.606
138 HD2 HIS 14 HD2 HIS 14 11.931 -10.517 -16.973
139 HE1 HIS 14 HE1 HIS 14 14.272 -9.059 -20.197
140 H ILE 15 H ILE 15 10.730 -14.283 -16.846
141 HA ILE 15 HA ILE 15 10.603 -16.937 -17.597
142 HB ILE 15 HB ILE 15 9.425 -15.714 -15.099
143 HG12 ILE 15 HG12 ILE 15 12.123 -17.023 -15.383
144 HG13 ILE 15 HG13 ILE 15 11.900 -15.300 -15.663
145 HG21 ILE 15 HG21 ILE 15 10.251 -18.176 -14.373
146 HG22 ILE 15 HG22 ILE 15 8.604 -17.799 -14.874
147 HG23 ILE 15 HG23 ILE 15 9.741 -18.487 -16.033
148 HD11 ILE 15 HD11 ILE 15 11.714 -14.843 -13.478
149 HD12 ILE 15 HD12 ILE 15 10.793 -16.308 -13.139
150 HD13 ILE 15 HD13 ILE 15 12.549 -16.385 -13.286
151 H THR 16 H THR 16 7.819 -15.284 -16.118
152 HA THR 16 HA THR 16 5.956 -17.147 -17.181
153 HB THR 16 HB THR 16 5.267 -14.399 -16.145
154 HG1 THR 16 HG1 THR 16 5.032 -15.841 -14.118
155 HG21 THR 16 HG21 THR 16 3.633 -16.748 -15.473
156 HG22 THR 16 HG22 THR 16 3.660 -16.331 -17.185
157 HG23 THR 16 HG23 THR 16 3.142 -15.137 -15.995
Start of MODEL 15
1 H1 GLU 1 H1 GLU 1 -0.718 -2.335 -5.621
2 HA GLU 1 HA GLU 1 1.182 -0.704 -4.770
3 HB2 GLU 1 HB2 GLU 1 -0.210 -0.240 -2.692
4 HB3 GLU 1 HB3 GLU 1 -1.041 -0.119 -4.237
5 HG2 GLU 1 HG2 GLU 1 -2.187 -2.134 -3.908
6 HG3 GLU 1 HG3 GLU 1 -1.113 -2.629 -2.601
7 H LYS 2 H LYS 2 2.718 -2.825 -4.645
8 HA LYS 2 HA LYS 2 3.687 -2.802 -1.932
9 HB2 LYS 2 HB2 LYS 2 1.894 -4.715 -2.281
10 HB3 LYS 2 HB3 LYS 2 3.251 -5.545 -3.033
11 HG2 LYS 2 HG2 LYS 2 3.389 -6.278 -0.860
12 HG3 LYS 2 HG3 LYS 2 4.509 -4.914 -0.850
13 HD2 LYS 2 HD2 LYS 2 2.495 -3.518 -0.087
14 HD3 LYS 2 HD3 LYS 2 1.722 -5.067 0.258
15 HE2 LYS 2 HE2 LYS 2 3.183 -5.568 1.964
16 HE3 LYS 2 HE3 LYS 2 4.464 -4.549 1.308
17 HZ1 LYS 2 HZ1 LYS 2 3.836 -3.061 2.814
18 HZ2 LYS 2 HZ2 LYS 2 2.411 -3.896 3.183
19 HZ3 LYS 2 HZ3 LYS 2 2.443 -2.808 1.888
20 H PHE 3 H PHE 3 5.854 -3.318 -1.783
21 HA PHE 3 HA PHE 3 7.379 -3.092 -4.161
22 HB2 PHE 3 HB2 PHE 3 8.025 -2.369 -1.784
23 HB3 PHE 3 HB3 PHE 3 8.459 -4.055 -1.518
24 HD1 PHE 3 HD1 PHE 3 9.083 -1.279 -3.925
25 HD2 PHE 3 HD2 PHE 3 10.617 -4.720 -1.945
26 HE1 PHE 3 HE1 PHE 3 11.295 -0.861 -4.920
27 HE2 PHE 3 HE2 PHE 3 12.831 -4.307 -2.936
28 HZ PHE 3 HZ PHE 3 13.173 -2.375 -4.424
29 H ARG 4 H ARG 4 6.410 -5.800 -2.152
30 HA ARG 4 HA ARG 4 8.144 -7.746 -3.182
31 HB2 ARG 4 HB2 ARG 4 5.447 -7.855 -1.871
32 HB3 ARG 4 HB3 ARG 4 6.183 -9.320 -2.508
33 HG2 ARG 4 HG2 ARG 4 8.234 -8.598 -1.092
34 HG3 ARG 4 HG3 ARG 4 7.060 -7.597 -0.235
35 HD2 ARG 4 HD2 ARG 4 5.693 -9.864 -0.216
36 HD3 ARG 4 HD3 ARG 4 7.307 -10.556 -0.367
37 HE ARG 4 HE ARG 4 6.172 -9.324 1.952
38 HH11 ARG 4 HH11 ARG 4 9.147 -9.980 0.267
39 HH12 ARG 4 HH12 ARG 4 10.125 -9.903 1.696
40 HH21 ARG 4 HH21 ARG 4 7.448 -9.220 3.839
41 HH22 ARG 4 HH22 ARG 4 9.157 -9.472 3.727
42 H ARG 5 H ARG 5 5.234 -6.336 -4.457
43 HA ARG 5 HA ARG 5 4.647 -8.352 -6.370
44 HB2 ARG 5 HB2 ARG 5 3.009 -6.654 -5.599
45 HB3 ARG 5 HB3 ARG 5 3.932 -5.416 -6.440
46 HG2 ARG 5 HG2 ARG 5 2.294 -5.855 -7.973
47 HG3 ARG 5 HG3 ARG 5 3.555 -6.965 -8.512
48 HD2 ARG 5 HD2 ARG 5 1.511 -8.179 -8.500
49 HD3 ARG 5 HD3 ARG 5 2.457 -8.738 -7.121
50 HE ARG 5 HE ARG 5 0.691 -6.636 -6.384
51 HH11 ARG 5 HH11 ARG 5 0.813 -10.039 -7.105
52 HH12 ARG 5 HH12 ARG 5 -0.571 -10.427 -6.137
53 HH21 ARG 5 HH21 ARG 5 -1.132 -7.133 -5.107
54 HH22 ARG 5 HH22 ARG 5 -1.677 -8.773 -5.002
55 H TYR 6 H TYR 6 6.299 -5.209 -6.627
56 HA TYR 6 HA TYR 6 6.907 -5.330 -9.346
57 HB2 TYR 6 HB2 TYR 6 8.326 -3.972 -7.054
58 HB3 TYR 6 HB3 TYR 6 8.803 -3.759 -8.735
59 HD1 TYR 6 HD1 TYR 6 6.479 -3.360 -10.251
60 HD2 TYR 6 HD2 TYR 6 7.189 -2.148 -6.235
61 HE1 TYR 6 HE1 TYR 6 4.809 -1.572 -10.503
62 HE2 TYR 6 HE2 TYR 6 5.520 -0.357 -6.475
63 HH TYR 6 HH TYR 6 3.484 0.079 -7.934
64 H LEU 7 H LEU 7 8.348 -6.935 -6.633
65 HA LEU 7 HA LEU 7 10.758 -7.669 -8.044
66 HB2 LEU 7 HB2 LEU 7 9.615 -8.504 -5.387
67 HB3 LEU 7 HB3 LEU 7 11.144 -9.105 -6.023
68 HG LEU 7 HG LEU 7 10.562 -6.204 -5.437
69 HD11 LEU 7 HD11 LEU 7 11.883 -6.465 -3.448
70 HD12 LEU 7 HD12 LEU 7 12.182 -8.163 -3.818
71 HD13 LEU 7 HD13 LEU 7 10.554 -7.623 -3.407
72 HD21 LEU 7 HD21 LEU 7 13.308 -6.769 -5.424
73 HD22 LEU 7 HD22 LEU 7 12.407 -5.829 -6.613
74 HD23 LEU 7 HD23 LEU 7 12.656 -7.557 -6.861
75 H SER 8 H SER 8 7.601 -8.992 -7.487
76 HA SER 8 HA SER 8 8.349 -11.664 -8.319
77 HB2 SER 8 HB2 SER 8 6.633 -11.766 -6.755
78 HB3 SER 8 HB3 SER 8 5.811 -10.352 -7.412
79 HG SER 8 HG SER 8 5.892 -12.978 -8.466
80 H VAL 9 H VAL 9 6.809 -8.821 -9.674
81 HA VAL 9 HA VAL 9 5.891 -10.081 -12.063
82 HB VAL 9 HB VAL 9 5.482 -7.840 -12.903
83 HG11 VAL 9 HG11 VAL 9 4.566 -7.164 -10.289
84 HG12 VAL 9 HG12 VAL 9 3.650 -7.814 -11.650
85 HG13 VAL 9 HG13 VAL 9 4.430 -8.908 -10.507
86 HG21 VAL 9 HG21 VAL 9 6.072 -5.891 -11.381
87 HG22 VAL 9 HG22 VAL 9 7.177 -6.998 -10.568
88 HG23 VAL 9 HG23 VAL 9 7.402 -6.625 -12.277
89 H PHE 10 H PHE 10 8.891 -8.654 -11.043
90 HA PHE 10 HA PHE 10 10.048 -8.084 -13.523
91 HB2 PHE 10 HB2 PHE 10 10.886 -7.594 -11.103
92 HB3 PHE 10 HB3 PHE 10 11.674 -9.162 -11.243
93 HD1 PHE 10 HD1 PHE 10 13.216 -9.520 -13.262
94 HD2 PHE 10 HD2 PHE 10 11.910 -5.691 -11.938
95 HE1 PHE 10 HE1 PHE 10 15.097 -8.471 -14.451
96 HE2 PHE 10 HE2 PHE 10 13.788 -4.636 -13.126
97 HZ PHE 10 HZ PHE 10 15.385 -6.025 -14.385
98 H PHE 11 H PHE 11 9.487 -11.096 -11.910
99 HA PHE 11 HA PHE 11 11.322 -12.579 -13.591
100 HB2 PHE 11 HB2 PHE 11 9.415 -13.325 -11.390
101 HB3 PHE 11 HB3 PHE 11 10.148 -14.562 -12.406
102 HD1 PHE 11 HD1 PHE 11 11.047 -11.652 -10.267
103 HD2 PHE 11 HD2 PHE 11 12.204 -15.438 -11.831
104 HE1 PHE 11 HE1 PHE 11 13.054 -11.622 -8.845
105 HE2 PHE 11 HE2 PHE 11 14.213 -15.414 -10.410
106 HZ PHE 11 HZ PHE 11 14.641 -13.504 -8.916
107 H ARG 12 H ARG 12 7.864 -11.998 -13.333
108 HA ARG 12 HA ARG 12 7.140 -13.918 -15.330
109 HB2 ARG 12 HB2 ARG 12 5.559 -11.575 -14.255
110 HB3 ARG 12 HB3 ARG 12 4.912 -12.917 -15.190
111 HG2 ARG 12 HG2 ARG 12 6.363 -13.763 -12.807
112 HG3 ARG 12 HG3 ARG 12 4.964 -12.745 -12.462
113 HD2 ARG 12 HD2 ARG 12 4.659 -14.962 -14.422
114 HD3 ARG 12 HD3 ARG 12 4.743 -15.364 -12.707
115 HE ARG 12 HE ARG 12 2.880 -13.296 -13.075
116 HH11 ARG 12 HH11 ARG 12 3.294 -16.685 -13.755
117 HH12 ARG 12 HH12 ARG 12 1.597 -17.033 -13.723
118 HH21 ARG 12 HH21 ARG 12 0.643 -13.741 -13.030
119 HH22 ARG 12 HH22 ARG 12 0.090 -15.358 -13.312
120 H LYS 13 H LYS 13 8.141 -10.602 -15.328
121 HA LYS 13 HA LYS 13 7.108 -9.893 -17.882
122 HB2 LYS 13 HB2 LYS 13 7.963 -8.372 -15.954
123 HB3 LYS 13 HB3 LYS 13 9.549 -8.632 -16.668
124 HG2 LYS 13 HG2 LYS 13 8.743 -6.606 -17.557
125 HG3 LYS 13 HG3 LYS 13 8.579 -7.806 -18.842
126 HD2 LYS 13 HD2 LYS 13 6.519 -6.820 -18.965
127 HD3 LYS 13 HD3 LYS 13 6.172 -8.088 -17.786
128 HE2 LYS 13 HE2 LYS 13 6.072 -6.614 -16.029
129 HE3 LYS 13 HE3 LYS 13 7.147 -5.451 -16.804
130 HZ1 LYS 13 HZ1 LYS 13 5.414 -4.363 -17.622
131 HZ2 LYS 13 HZ2 LYS 13 4.398 -5.350 -16.697
132 HZ3 LYS 13 HZ3 LYS 13 4.754 -5.767 -18.296
133 H HIS 14 H HIS 14 9.917 -11.604 -16.803
134 HA HIS 14 HA HIS 14 11.019 -11.559 -19.533
135 HB2 HIS 14 HB2 HIS 14 12.298 -11.959 -16.842
136 HB3 HIS 14 HB3 HIS 14 13.091 -12.519 -18.311
137 HD1 HIS 14 HD1 HIS 14 12.366 -10.087 -20.125
138 HD2 HIS 14 HD2 HIS 14 13.911 -9.820 -16.278
139 HE1 HIS 14 HE1 HIS 14 13.463 -7.828 -19.997
140 H ILE 15 H ILE 15 11.105 -13.832 -16.786
141 HA ILE 15 HA ILE 15 11.372 -16.140 -18.331
142 HB ILE 15 HB ILE 15 10.060 -15.936 -15.619
143 HG12 ILE 15 HG12 ILE 15 12.723 -16.871 -15.432
144 HG13 ILE 15 HG13 ILE 15 12.766 -15.437 -16.452
145 HG21 ILE 15 HG21 ILE 15 10.668 -18.250 -15.341
146 HG22 ILE 15 HG22 ILE 15 9.720 -18.075 -16.817
147 HG23 ILE 15 HG23 ILE 15 11.471 -18.265 -16.912
148 HD11 ILE 15 HD11 ILE 15 12.851 -15.434 -13.740
149 HD12 ILE 15 HD12 ILE 15 12.355 -14.069 -14.739
150 HD13 ILE 15 HD13 ILE 15 11.139 -15.141 -14.044
151 H THR 16 H THR 16 8.432 -15.319 -16.495
152 HA THR 16 HA THR 16 6.815 -16.947 -18.231
153 HB THR 16 HB THR 16 5.373 -15.132 -16.438
154 HG1 THR 16 HG1 THR 16 6.209 -16.591 -14.618
155 HG21 THR 16 HG21 THR 16 4.035 -16.947 -16.126
156 HG22 THR 16 HG22 THR 16 5.388 -18.077 -16.093
157 HG23 THR 16 HG23 THR 16 4.797 -17.453 -17.634
Start of MODEL 16
1 H1 GLU 1 H1 GLU 1 3.499 -7.681 -0.979
2 HA GLU 1 HA GLU 1 1.107 -8.334 -2.569
3 HB2 GLU 1 HB2 GLU 1 -0.154 -7.201 -0.714
4 HB3 GLU 1 HB3 GLU 1 0.657 -8.691 -0.253
5 HG2 GLU 1 HG2 GLU 1 2.035 -6.081 0.158
6 HG3 GLU 1 HG3 GLU 1 0.776 -6.594 1.280
7 H LYS 2 H LYS 2 3.294 -5.814 -1.576
8 HA LYS 2 HA LYS 2 1.865 -3.934 -3.340
9 HB2 LYS 2 HB2 LYS 2 3.364 -3.357 -0.781
10 HB3 LYS 2 HB3 LYS 2 2.823 -2.112 -1.900
11 HG2 LYS 2 HG2 LYS 2 0.503 -2.828 -1.557
12 HG3 LYS 2 HG3 LYS 2 1.061 -4.046 -0.407
13 HD2 LYS 2 HD2 LYS 2 2.162 -2.061 0.819
14 HD3 LYS 2 HD3 LYS 2 1.084 -1.057 -0.153
15 HE2 LYS 2 HE2 LYS 2 -0.233 -1.372 1.686
16 HE3 LYS 2 HE3 LYS 2 -0.727 -2.765 0.726
17 HZ1 LYS 2 HZ1 LYS 2 1.551 -3.183 2.475
18 HZ2 LYS 2 HZ2 LYS 2 0.235 -4.195 2.147
19 HZ3 LYS 2 HZ3 LYS 2 0.072 -2.929 3.256
20 H PHE 3 H PHE 3 5.051 -4.027 -1.745
21 HA PHE 3 HA PHE 3 6.308 -3.048 -4.160
22 HB2 PHE 3 HB2 PHE 3 6.913 -2.339 -1.778
23 HB3 PHE 3 HB3 PHE 3 7.715 -3.899 -1.634
24 HD1 PHE 3 HD1 PHE 3 7.755 -0.645 -3.331
25 HD2 PHE 3 HD2 PHE 3 9.792 -4.333 -2.728
26 HE1 PHE 3 HE1 PHE 3 9.772 0.303 -4.373
27 HE2 PHE 3 HE2 PHE 3 11.813 -3.391 -3.768
28 HZ PHE 3 HZ PHE 3 11.805 -1.071 -4.594
29 H ARG 4 H ARG 4 5.987 -6.052 -2.420
30 HA ARG 4 HA ARG 4 8.104 -7.496 -3.533
31 HB2 ARG 4 HB2 ARG 4 5.488 -8.201 -2.296
32 HB3 ARG 4 HB3 ARG 4 6.335 -9.458 -3.189
33 HG2 ARG 4 HG2 ARG 4 6.918 -9.632 -0.879
34 HG3 ARG 4 HG3 ARG 4 8.327 -9.052 -1.770
35 HD2 ARG 4 HD2 ARG 4 8.059 -6.855 -0.971
36 HD3 ARG 4 HD3 ARG 4 6.417 -7.174 -0.413
37 HE ARG 4 HE ARG 4 8.307 -8.825 0.923
38 HH11 ARG 4 HH11 ARG 4 7.019 -5.593 0.824
39 HH12 ARG 4 HH12 ARG 4 7.372 -5.261 2.488
40 HH21 ARG 4 HH21 ARG 4 8.777 -8.401 3.114
41 HH22 ARG 4 HH22 ARG 4 8.373 -6.859 3.789
42 H ARG 5 H ARG 5 5.053 -6.534 -4.873
43 HA ARG 5 HA ARG 5 4.863 -8.420 -6.958
44 HB2 ARG 5 HB2 ARG 5 2.986 -6.993 -6.264
45 HB3 ARG 5 HB3 ARG 5 3.841 -5.576 -6.860
46 HG2 ARG 5 HG2 ARG 5 2.368 -6.037 -8.573
47 HG3 ARG 5 HG3 ARG 5 3.847 -6.828 -9.122
48 HD2 ARG 5 HD2 ARG 5 1.921 -8.274 -9.459
49 HD3 ARG 5 HD3 ARG 5 3.019 -8.965 -8.265
50 HE ARG 5 HE ARG 5 1.166 -7.533 -6.825
51 HH11 ARG 5 HH11 ARG 5 1.101 -10.182 -9.083
52 HH12 ARG 5 HH12 ARG 5 -0.312 -10.907 -8.392
53 HH21 ARG 5 HH21 ARG 5 -0.695 -8.478 -5.906
54 HH22 ARG 5 HH22 ARG 5 -1.333 -9.937 -6.585
55 H TYR 6 H TYR 6 6.534 -5.336 -6.685
56 HA TYR 6 HA TYR 6 7.210 -5.034 -9.405
57 HB2 TYR 6 HB2 TYR 6 8.467 -3.982 -6.873
58 HB3 TYR 6 HB3 TYR 6 9.069 -3.562 -8.472
59 HD1 TYR 6 HD1 TYR 6 6.961 -2.883 -10.120
60 HD2 TYR 6 HD2 TYR 6 7.161 -2.359 -5.902
61 HE1 TYR 6 HE1 TYR 6 5.303 -1.073 -10.272
62 HE2 TYR 6 HE2 TYR 6 5.503 -0.548 -6.043
63 HH TYR 6 HH TYR 6 4.727 1.102 -7.829
64 H LEU 7 H LEU 7 8.522 -6.996 -6.871
65 HA LEU 7 HA LEU 7 11.007 -7.519 -8.259
66 HB2 LEU 7 HB2 LEU 7 9.774 -8.394 -5.688
67 HB3 LEU 7 HB3 LEU 7 11.094 -9.340 -6.373
68 HG LEU 7 HG LEU 7 11.865 -7.754 -4.667
69 HD11 LEU 7 HD11 LEU 7 13.226 -8.435 -6.709
70 HD12 LEU 7 HD12 LEU 7 13.751 -6.998 -5.833
71 HD13 LEU 7 HD13 LEU 7 12.858 -6.832 -7.345
72 HD21 LEU 7 HD21 LEU 7 10.166 -6.019 -5.039
73 HD22 LEU 7 HD22 LEU 7 10.918 -5.626 -6.584
74 HD23 LEU 7 HD23 LEU 7 11.802 -5.362 -5.081
75 H SER 8 H SER 8 7.844 -8.904 -8.010
76 HA SER 8 HA SER 8 8.652 -11.459 -9.116
77 HB2 SER 8 HB2 SER 8 6.708 -10.977 -7.429
78 HB3 SER 8 HB3 SER 8 5.793 -10.578 -8.883
79 HG SER 8 HG SER 8 6.290 -12.670 -9.669
80 H VAL 9 H VAL 9 6.902 -8.569 -10.155
81 HA VAL 9 HA VAL 9 6.073 -9.451 -12.670
82 HB VAL 9 HB VAL 9 5.944 -7.089 -13.309
83 HG11 VAL 9 HG11 VAL 9 4.731 -6.361 -11.037
84 HG12 VAL 9 HG12 VAL 9 4.034 -7.523 -12.169
85 HG13 VAL 9 HG13 VAL 9 4.889 -8.091 -10.735
86 HG21 VAL 9 HG21 VAL 9 6.593 -5.528 -11.242
87 HG22 VAL 9 HG22 VAL 9 7.799 -6.796 -11.021
88 HG23 VAL 9 HG23 VAL 9 7.724 -5.906 -12.542
89 H PHE 10 H PHE 10 9.190 -8.403 -11.539
90 HA PHE 10 HA PHE 10 10.350 -7.856 -14.069
91 HB2 PHE 10 HB2 PHE 10 11.345 -8.258 -11.298
92 HB3 PHE 10 HB3 PHE 10 12.506 -8.481 -12.602
93 HD1 PHE 10 HD1 PHE 10 9.694 -6.070 -12.227
94 HD2 PHE 10 HD2 PHE 10 13.896 -6.643 -12.590
95 HE1 PHE 10 HE1 PHE 10 10.012 -3.634 -12.355
96 HE2 PHE 10 HE2 PHE 10 14.221 -4.207 -12.717
97 HZ PHE 10 HZ PHE 10 12.277 -2.699 -12.601
98 H PHE 11 H PHE 11 9.754 -10.765 -12.282
99 HA PHE 11 HA PHE 11 11.549 -12.351 -13.928
100 HB2 PHE 11 HB2 PHE 11 9.816 -12.910 -11.547
101 HB3 PHE 11 HB3 PHE 11 10.396 -14.244 -12.537
102 HD1 PHE 11 HD1 PHE 11 11.897 -11.095 -11.203
103 HD2 PHE 11 HD2 PHE 11 12.180 -15.324 -11.600
104 HE1 PHE 11 HE1 PHE 11 14.034 -11.063 -9.984
105 HE2 PHE 11 HE2 PHE 11 14.316 -15.299 -10.380
106 HZ PHE 11 HZ PHE 11 15.246 -13.167 -9.570
107 H ARG 12 H ARG 12 8.091 -11.840 -13.471
108 HA ARG 12 HA ARG 12 7.106 -13.892 -15.073
109 HB2 ARG 12 HB2 ARG 12 5.974 -11.117 -14.671
110 HB3 ARG 12 HB3 ARG 12 5.090 -12.487 -15.329
111 HG2 ARG 12 HG2 ARG 12 6.079 -13.444 -12.938
112 HG3 ARG 12 HG3 ARG 12 5.637 -11.775 -12.574
113 HD2 ARG 12 HD2 ARG 12 3.415 -12.239 -13.650
114 HD3 ARG 12 HD3 ARG 12 3.881 -13.937 -13.720
115 HE ARG 12 HE ARG 12 3.502 -14.107 -11.462
116 HH11 ARG 12 HH11 ARG 12 3.553 -10.751 -12.385
117 HH12 ARG 12 HH12 ARG 12 2.980 -10.186 -10.851
118 HH21 ARG 12 HH21 ARG 12 2.747 -13.375 -9.438
119 HH22 ARG 12 HH22 ARG 12 2.522 -11.679 -9.175
120 H LYS 13 H LYS 13 8.653 -10.917 -15.937
121 HA LYS 13 HA LYS 13 7.721 -10.721 -18.605
122 HB2 LYS 13 HB2 LYS 13 8.949 -8.967 -17.137
123 HB3 LYS 13 HB3 LYS 13 10.418 -9.739 -17.720
124 HG2 LYS 13 HG2 LYS 13 10.070 -7.931 -19.158
125 HG3 LYS 13 HG3 LYS 13 9.512 -9.341 -20.062
126 HD2 LYS 13 HD2 LYS 13 7.796 -7.843 -20.429
127 HD3 LYS 13 HD3 LYS 13 7.194 -8.733 -19.029
128 HE2 LYS 13 HE2 LYS 13 8.139 -6.940 -17.576
129 HE3 LYS 13 HE3 LYS 13 8.539 -6.034 -19.035
130 HZ1 LYS 13 HZ1 LYS 13 5.788 -6.926 -18.381
131 HZ2 LYS 13 HZ2 LYS 13 6.259 -5.830 -19.580
132 HZ3 LYS 13 HZ3 LYS 13 6.397 -5.408 -17.948
133 H HIS 14 H HIS 14 10.190 -12.617 -17.071
134 HA HIS 14 HA HIS 14 11.200 -13.494 -19.687
135 HB2 HIS 14 HB2 HIS 14 12.357 -13.652 -16.908
136 HB3 HIS 14 HB3 HIS 14 13.016 -14.583 -18.251
137 HD1 HIS 14 HD1 HIS 14 14.385 -13.323 -20.006
138 HD2 HIS 14 HD2 HIS 14 12.802 -10.867 -17.052
139 HE1 HIS 14 HE1 HIS 14 15.530 -11.102 -20.293
140 H ILE 15 H ILE 15 10.552 -14.960 -16.497
141 HA ILE 15 HA ILE 15 10.277 -17.582 -17.525
142 HB ILE 15 HB ILE 15 9.249 -16.455 -14.918
143 HG12 ILE 15 HG12 ILE 15 11.407 -17.949 -14.267
144 HG13 ILE 15 HG13 ILE 15 11.904 -17.375 -15.855
145 HG21 ILE 15 HG21 ILE 15 9.247 -18.787 -14.155
146 HG22 ILE 15 HG22 ILE 15 8.135 -18.532 -15.499
147 HG23 ILE 15 HG23 ILE 15 9.693 -19.310 -15.780
148 HD11 ILE 15 HD11 ILE 15 12.201 -16.047 -13.465
149 HD12 ILE 15 HD12 ILE 15 12.350 -15.347 -15.077
150 HD13 ILE 15 HD13 ILE 15 10.816 -15.252 -14.213
151 H THR 16 H THR 16 7.743 -15.612 -15.971
152 HA THR 16 HA THR 16 5.633 -17.139 -17.107
153 HB THR 16 HB THR 16 5.252 -14.345 -16.072
154 HG1 THR 16 HG1 THR 16 6.122 -16.614 -14.678
155 HG21 THR 16 HG21 THR 16 3.610 -16.735 -16.533
156 HG22 THR 16 HG22 THR 16 3.147 -15.035 -16.484
157 HG23 THR 16 HG23 THR 16 3.331 -15.942 -14.983
Start of MODEL 17
1 H1 GLU 1 H1 GLU 1 3.144 0.235 0.142
2 HA GLU 1 HA GLU 1 5.066 -0.838 0.753
3 HB2 GLU 1 HB2 GLU 1 3.858 -0.658 3.105
4 HB3 GLU 1 HB3 GLU 1 3.704 -2.397 2.901
5 HG2 GLU 1 HG2 GLU 1 6.084 -2.647 2.735
6 HG3 GLU 1 HG3 GLU 1 6.307 -0.898 2.748
7 H LYS 2 H LYS 2 3.547 -1.830 -1.299
8 HA LYS 2 HA LYS 2 3.773 -4.750 -0.964
9 HB2 LYS 2 HB2 LYS 2 2.116 -4.959 -2.771
10 HB3 LYS 2 HB3 LYS 2 1.477 -4.061 -1.401
11 HG2 LYS 2 HG2 LYS 2 1.617 -2.011 -2.546
12 HG3 LYS 2 HG3 LYS 2 2.641 -2.698 -3.809
13 HD2 LYS 2 HD2 LYS 2 0.596 -2.632 -4.869
14 HD3 LYS 2 HD3 LYS 2 0.591 -4.270 -4.211
15 HE2 LYS 2 HE2 LYS 2 -0.534 -2.026 -2.594
16 HE3 LYS 2 HE3 LYS 2 -1.488 -2.711 -3.908
17 HZ1 LYS 2 HZ1 LYS 2 -0.727 -4.928 -2.679
18 HZ2 LYS 2 HZ2 LYS 2 -2.142 -4.096 -2.272
19 HZ3 LYS 2 HZ3 LYS 2 -0.740 -3.880 -1.351
20 H PHE 3 H PHE 3 5.994 -3.097 -1.583
21 HA PHE 3 HA PHE 3 6.560 -2.886 -4.314
22 HB2 PHE 3 HB2 PHE 3 7.849 -1.919 -2.308
23 HB3 PHE 3 HB3 PHE 3 8.655 -3.482 -2.235
24 HD1 PHE 3 HD1 PHE 3 7.710 -1.095 -4.948
25 HD2 PHE 3 HD2 PHE 3 10.753 -3.458 -3.139
26 HE1 PHE 3 HE1 PHE 3 9.307 -0.345 -6.663
27 HE2 PHE 3 HE2 PHE 3 12.355 -2.712 -4.851
28 HZ PHE 3 HZ PHE 3 11.633 -1.153 -6.616
29 H ARG 4 H ARG 4 6.588 -5.616 -2.180
30 HA ARG 4 HA ARG 4 8.323 -7.358 -3.438
31 HB2 ARG 4 HB2 ARG 4 6.618 -7.563 -1.347
32 HB3 ARG 4 HB3 ARG 4 5.763 -8.533 -2.540
33 HG2 ARG 4 HG2 ARG 4 8.377 -9.411 -2.728
34 HG3 ARG 4 HG3 ARG 4 8.134 -9.150 -1.000
35 HD2 ARG 4 HD2 ARG 4 6.037 -10.584 -2.559
36 HD3 ARG 4 HD3 ARG 4 7.514 -11.443 -2.125
37 HE ARG 4 HE ARG 4 6.717 -10.348 0.219
38 HH11 ARG 4 HH11 ARG 4 5.129 -12.317 -2.173
39 HH12 ARG 4 HH12 ARG 4 4.074 -13.083 -1.032
40 HH21 ARG 4 HH21 ARG 4 5.334 -11.350 1.731
41 HH22 ARG 4 HH22 ARG 4 4.191 -12.532 1.189
42 H ARG 5 H ARG 5 4.968 -6.600 -4.252
43 HA ARG 5 HA ARG 5 4.542 -8.540 -6.205
44 HB2 ARG 5 HB2 ARG 5 2.773 -7.088 -5.282
45 HB3 ARG 5 HB3 ARG 5 3.463 -5.717 -6.141
46 HG2 ARG 5 HG2 ARG 5 1.580 -6.513 -7.370
47 HG3 ARG 5 HG3 ARG 5 3.041 -6.915 -8.274
48 HD2 ARG 5 HD2 ARG 5 2.947 -9.196 -7.267
49 HD3 ARG 5 HD3 ARG 5 1.390 -8.764 -6.560
50 HE ARG 5 HE ARG 5 1.195 -8.254 -9.272
51 HH11 ARG 5 HH11 ARG 5 1.760 -11.001 -7.211
52 HH12 ARG 5 HH12 ARG 5 1.042 -12.136 -8.306
53 HH21 ARG 5 HH21 ARG 5 0.247 -9.738 -10.723
54 HH22 ARG 5 HH22 ARG 5 0.183 -11.416 -10.304
55 H TYR 6 H TYR 6 5.809 -5.236 -6.557
56 HA TYR 6 HA TYR 6 6.165 -5.315 -9.341
57 HB2 TYR 6 HB2 TYR 6 7.501 -3.689 -7.181
58 HB3 TYR 6 HB3 TYR 6 7.854 -3.463 -8.890
59 HD1 TYR 6 HD1 TYR 6 5.443 -3.441 -10.297
60 HD2 TYR 6 HD2 TYR 6 6.125 -2.054 -6.333
61 HE1 TYR 6 HE1 TYR 6 3.512 -1.931 -10.500
62 HE2 TYR 6 HE2 TYR 6 4.196 -0.541 -6.524
63 HH TYR 6 HH TYR 6 2.937 0.523 -9.046
64 H LEU 7 H LEU 7 8.061 -6.576 -6.720
65 HA LEU 7 HA LEU 7 10.470 -6.929 -8.234
66 HB2 LEU 7 HB2 LEU 7 9.539 -8.087 -5.614
67 HB3 LEU 7 HB3 LEU 7 11.135 -8.375 -6.304
68 HG LEU 7 HG LEU 7 10.144 -5.606 -5.681
69 HD11 LEU 7 HD11 LEU 7 10.307 -5.993 -3.507
70 HD12 LEU 7 HD12 LEU 7 11.995 -6.454 -3.729
71 HD13 LEU 7 HD13 LEU 7 10.728 -7.678 -3.811
72 HD21 LEU 7 HD21 LEU 7 12.259 -4.917 -6.116
73 HD22 LEU 7 HD22 LEU 7 12.250 -6.349 -7.145
74 HD23 LEU 7 HD23 LEU 7 12.986 -6.420 -5.544
75 H SER 8 H SER 8 7.700 -8.933 -7.383
76 HA SER 8 HA SER 8 8.788 -11.347 -8.455
77 HB2 SER 8 HB2 SER 8 7.133 -11.804 -6.906
78 HB3 SER 8 HB3 SER 8 6.110 -10.474 -7.449
79 HG SER 8 HG SER 8 6.083 -13.059 -8.206
80 H VAL 9 H VAL 9 6.436 -8.961 -9.633
81 HA VAL 9 HA VAL 9 5.820 -10.207 -12.061
82 HB VAL 9 HB VAL 9 5.007 -8.061 -12.825
83 HG11 VAL 9 HG11 VAL 9 4.113 -7.551 -10.172
84 HG12 VAL 9 HG12 VAL 9 3.259 -8.356 -11.489
85 HG13 VAL 9 HG13 VAL 9 4.267 -9.294 -10.386
86 HG21 VAL 9 HG21 VAL 9 6.845 -6.637 -12.195
87 HG22 VAL 9 HG22 VAL 9 5.365 -6.021 -11.459
88 HG23 VAL 9 HG23 VAL 9 6.527 -6.920 -10.483
89 H PHE 10 H PHE 10 8.566 -8.304 -11.088
90 HA PHE 10 HA PHE 10 9.528 -7.567 -13.625
91 HB2 PHE 10 HB2 PHE 10 10.285 -6.820 -11.245
92 HB3 PHE 10 HB3 PHE 10 11.372 -8.202 -11.344
93 HD1 PHE 10 HD1 PHE 10 12.895 -8.325 -13.423
94 HD2 PHE 10 HD2 PHE 10 10.920 -4.783 -12.132
95 HE1 PHE 10 HE1 PHE 10 14.508 -6.968 -14.692
96 HE2 PHE 10 HE2 PHE 10 12.529 -3.420 -13.399
97 HZ PHE 10 HZ PHE 10 14.325 -4.512 -14.682
98 H PHE 11 H PHE 11 9.714 -10.542 -11.824
99 HA PHE 11 HA PHE 11 11.688 -11.683 -13.628
100 HB2 PHE 11 HB2 PHE 11 10.372 -12.566 -11.091
101 HB3 PHE 11 HB3 PHE 11 11.089 -13.779 -12.147
102 HD1 PHE 11 HD1 PHE 11 12.101 -10.360 -11.036
103 HD2 PHE 11 HD2 PHE 11 13.123 -14.478 -11.368
104 HE1 PHE 11 HE1 PHE 11 14.313 -9.886 -10.069
105 HE2 PHE 11 HE2 PHE 11 15.336 -14.011 -10.401
106 HZ PHE 11 HZ PHE 11 15.934 -11.712 -9.751
107 H ARG 12 H ARG 12 8.272 -12.087 -12.804
108 HA ARG 12 HA ARG 12 7.741 -14.282 -14.469
109 HB2 ARG 12 HB2 ARG 12 5.862 -12.057 -13.654
110 HB3 ARG 12 HB3 ARG 12 5.387 -13.630 -14.279
111 HG2 ARG 12 HG2 ARG 12 7.003 -14.255 -12.134
112 HG3 ARG 12 HG3 ARG 12 6.107 -12.837 -11.585
113 HD2 ARG 12 HD2 ARG 12 4.009 -13.970 -12.311
114 HD3 ARG 12 HD3 ARG 12 4.964 -15.409 -12.663
115 HE ARG 12 HE ARG 12 5.475 -14.631 -10.025
116 HH11 ARG 12 HH11 ARG 12 2.874 -15.895 -11.963
117 HH12 ARG 12 HH12 ARG 12 2.117 -16.722 -10.641
118 HH21 ARG 12 HH21 ARG 12 4.488 -15.714 -8.277
119 HH22 ARG 12 HH22 ARG 12 3.035 -16.617 -8.545
120 H LYS 13 H LYS 13 8.086 -10.892 -15.144
121 HA LYS 13 HA LYS 13 6.730 -10.698 -17.574
122 HB2 LYS 13 HB2 LYS 13 7.689 -8.789 -16.283
123 HB3 LYS 13 HB3 LYS 13 9.290 -9.277 -16.820
124 HG2 LYS 13 HG2 LYS 13 8.695 -7.554 -18.267
125 HG3 LYS 13 HG3 LYS 13 8.378 -9.023 -19.192
126 HD2 LYS 13 HD2 LYS 13 6.465 -7.776 -19.576
127 HD3 LYS 13 HD3 LYS 13 5.976 -8.804 -18.227
128 HE2 LYS 13 HE2 LYS 13 6.376 -7.012 -16.662
129 HE3 LYS 13 HE3 LYS 13 7.026 -5.991 -17.943
130 HZ1 LYS 13 HZ1 LYS 13 4.275 -6.568 -17.258
131 HZ2 LYS 13 HZ2 LYS 13 4.610 -6.597 -18.917
132 HZ3 LYS 13 HZ3 LYS 13 4.942 -5.208 -18.011
133 H HIS 14 H HIS 14 10.120 -11.559 -16.940
134 HA HIS 14 HA HIS 14 10.505 -12.241 -19.746
135 HB2 HIS 14 HB2 HIS 14 12.444 -12.337 -17.426
136 HB3 HIS 14 HB3 HIS 14 12.856 -12.601 -19.118
137 HD1 HIS 14 HD1 HIS 14 13.686 -10.601 -20.307
138 HD2 HIS 14 HD2 HIS 14 11.335 -9.588 -17.035
139 HE1 HIS 14 HE1 HIS 14 13.772 -8.091 -20.168
140 H ILE 15 H ILE 15 11.239 -13.885 -16.664
141 HA ILE 15 HA ILE 15 11.586 -16.433 -17.665
142 HB ILE 15 HB ILE 15 10.381 -15.694 -14.995
143 HG12 ILE 15 HG12 ILE 15 13.252 -16.415 -15.541
144 HG13 ILE 15 HG13 ILE 15 12.686 -14.754 -15.674
145 HG21 ILE 15 HG21 ILE 15 11.373 -18.262 -16.144
146 HG22 ILE 15 HG22 ILE 15 11.562 -17.950 -14.420
147 HG23 ILE 15 HG23 ILE 15 9.954 -17.951 -15.145
148 HD11 ILE 15 HD11 ILE 15 13.665 -15.911 -13.417
149 HD12 ILE 15 HD12 ILE 15 12.638 -14.477 -13.463
150 HD13 ILE 15 HD13 ILE 15 11.924 -16.065 -13.182
151 H THR 16 H THR 16 8.647 -15.528 -15.872
152 HA THR 16 HA THR 16 7.116 -17.641 -16.975
153 HB THR 16 HB THR 16 5.980 -15.144 -15.719
154 HG1 THR 16 HG1 THR 16 6.144 -16.669 -13.777
155 HG21 THR 16 HG21 THR 16 4.049 -16.233 -15.936
156 HG22 THR 16 HG22 THR 16 4.677 -17.511 -14.897
157 HG23 THR 16 HG23 THR 16 4.878 -17.618 -16.646
Start of MODEL 18
1 H1 GLU 1 H1 GLU 1 3.606 -5.294 1.341
2 HA GLU 1 HA GLU 1 4.015 -7.455 -0.551
3 HB2 GLU 1 HB2 GLU 1 2.084 -7.567 0.923
4 HB3 GLU 1 HB3 GLU 1 1.510 -6.014 0.332
5 HG2 GLU 1 HG2 GLU 1 1.294 -7.032 -1.930
6 HG3 GLU 1 HG3 GLU 1 1.687 -8.591 -1.206
7 H LYS 2 H LYS 2 2.942 -4.081 -0.584
8 HA LYS 2 HA LYS 2 2.326 -3.903 -3.312
9 HB2 LYS 2 HB2 LYS 2 2.530 -1.486 -3.028
10 HB3 LYS 2 HB3 LYS 2 1.666 -2.201 -1.673
11 HG2 LYS 2 HG2 LYS 2 3.627 -2.045 -0.282
12 HG3 LYS 2 HG3 LYS 2 4.585 -1.460 -1.645
13 HD2 LYS 2 HD2 LYS 2 2.118 -0.002 -0.765
14 HD3 LYS 2 HD3 LYS 2 3.658 0.250 0.060
15 HE2 LYS 2 HE2 LYS 2 4.644 1.208 -1.794
16 HE3 LYS 2 HE3 LYS 2 3.537 0.423 -2.918
17 HZ1 LYS 2 HZ1 LYS 2 1.897 1.985 -1.442
18 HZ2 LYS 2 HZ2 LYS 2 2.517 2.390 -2.963
19 HZ3 LYS 2 HZ3 LYS 2 3.285 2.944 -1.562
20 H PHE 3 H PHE 3 5.369 -3.734 -1.602
21 HA PHE 3 HA PHE 3 6.835 -2.784 -3.902
22 HB2 PHE 3 HB2 PHE 3 7.424 -2.291 -1.473
23 HB3 PHE 3 HB3 PHE 3 8.003 -3.951 -1.378
24 HD1 PHE 3 HD1 PHE 3 8.329 -1.217 -3.900
25 HD2 PHE 3 HD2 PHE 3 10.289 -4.048 -1.397
26 HE1 PHE 3 HE1 PHE 3 10.505 -0.505 -4.803
27 HE2 PHE 3 HE2 PHE 3 12.467 -3.340 -2.295
28 HZ PHE 3 HZ PHE 3 12.577 -1.565 -4.000
29 H ARG 4 H ARG 4 6.551 -5.824 -2.092
30 HA ARG 4 HA ARG 4 8.387 -7.365 -3.461
31 HB2 ARG 4 HB2 ARG 4 6.723 -7.884 -1.452
32 HB3 ARG 4 HB3 ARG 4 5.780 -8.616 -2.743
33 HG2 ARG 4 HG2 ARG 4 8.655 -9.322 -2.563
34 HG3 ARG 4 HG3 ARG 4 7.559 -9.984 -1.349
35 HD2 ARG 4 HD2 ARG 4 7.065 -10.179 -4.313
36 HD3 ARG 4 HD3 ARG 4 7.918 -11.415 -3.389
37 HE ARG 4 HE ARG 4 5.427 -10.848 -2.186
38 HH11 ARG 4 HH11 ARG 4 6.823 -12.434 -4.953
39 HH12 ARG 4 HH12 ARG 4 5.525 -13.569 -5.121
40 HH21 ARG 4 HH21 ARG 4 3.712 -12.337 -2.397
41 HH22 ARG 4 HH22 ARG 4 3.755 -13.512 -3.667
42 H ARG 5 H ARG 5 5.144 -6.421 -4.408
43 HA ARG 5 HA ARG 5 4.702 -8.196 -6.504
44 HB2 ARG 5 HB2 ARG 5 3.014 -6.622 -5.596
45 HB3 ARG 5 HB3 ARG 5 3.866 -5.294 -6.370
46 HG2 ARG 5 HG2 ARG 5 2.062 -5.811 -7.781
47 HG3 ARG 5 HG3 ARG 5 3.489 -6.499 -8.559
48 HD2 ARG 5 HD2 ARG 5 2.861 -8.662 -8.106
49 HD3 ARG 5 HD3 ARG 5 1.906 -8.201 -6.697
50 HE ARG 5 HE ARG 5 0.794 -7.195 -9.124
51 HH11 ARG 5 HH11 ARG 5 1.060 -10.032 -7.123
52 HH12 ARG 5 HH12 ARG 5 -0.422 -10.729 -7.688
53 HH21 ARG 5 HH21 ARG 5 -1.159 -8.103 -9.875
54 HH22 ARG 5 HH22 ARG 5 -1.683 -9.632 -9.254
55 H TYR 6 H TYR 6 6.285 -5.014 -6.558
56 HA TYR 6 HA TYR 6 6.839 -5.007 -9.325
57 HB2 TYR 6 HB2 TYR 6 8.196 -3.557 -7.045
58 HB3 TYR 6 HB3 TYR 6 8.497 -3.230 -8.748
59 HD1 TYR 6 HD1 TYR 6 5.809 -3.309 -9.898
60 HD2 TYR 6 HD2 TYR 6 7.138 -1.668 -6.205
61 HE1 TYR 6 HE1 TYR 6 3.926 -1.727 -9.931
62 HE2 TYR 6 HE2 TYR 6 5.258 -0.082 -6.226
63 HH TYR 6 HH TYR 6 3.273 0.408 -7.207
64 H LEU 7 H LEU 7 8.403 -6.497 -6.617
65 HA LEU 7 HA LEU 7 10.884 -6.981 -8.017
66 HB2 LEU 7 HB2 LEU 7 9.787 -7.644 -5.326
67 HB3 LEU 7 HB3 LEU 7 11.165 -8.558 -5.937
68 HG LEU 7 HG LEU 7 12.468 -6.506 -6.106
69 HD11 LEU 7 HD11 LEU 7 10.056 -5.133 -4.932
70 HD12 LEU 7 HD12 LEU 7 10.613 -4.976 -6.597
71 HD13 LEU 7 HD13 LEU 7 11.621 -4.395 -5.271
72 HD21 LEU 7 HD21 LEU 7 12.471 -5.926 -3.631
73 HD22 LEU 7 HD22 LEU 7 12.734 -7.619 -4.052
74 HD23 LEU 7 HD23 LEU 7 11.156 -7.091 -3.466
75 H SER 8 H SER 8 7.862 -8.593 -7.509
76 HA SER 8 HA SER 8 8.870 -11.180 -8.346
77 HB2 SER 8 HB2 SER 8 6.406 -11.806 -8.211
78 HB3 SER 8 HB3 SER 8 7.151 -11.281 -6.702
79 HG SER 8 HG SER 8 5.466 -9.783 -8.419
80 H VAL 9 H VAL 9 6.726 -8.657 -9.618
81 HA VAL 9 HA VAL 9 5.926 -9.855 -11.978
82 HB VAL 9 HB VAL 9 5.631 -7.599 -12.897
83 HG11 VAL 9 HG11 VAL 9 4.498 -6.703 -10.596
84 HG12 VAL 9 HG12 VAL 9 3.774 -7.903 -11.669
85 HG13 VAL 9 HG13 VAL 9 4.679 -8.421 -10.246
86 HG21 VAL 9 HG21 VAL 9 7.503 -6.908 -10.699
87 HG22 VAL 9 HG22 VAL 9 7.384 -6.256 -12.333
88 HG23 VAL 9 HG23 VAL 9 6.237 -5.747 -11.095
89 H PHE 10 H PHE 10 9.002 -8.431 -11.151
90 HA PHE 10 HA PHE 10 10.051 -8.084 -13.730
91 HB2 PHE 10 HB2 PHE 10 11.164 -8.313 -10.990
92 HB3 PHE 10 HB3 PHE 10 12.279 -8.622 -12.317
93 HD1 PHE 10 HD1 PHE 10 9.469 -6.198 -12.031
94 HD2 PHE 10 HD2 PHE 10 13.664 -6.782 -12.453
95 HE1 PHE 10 HE1 PHE 10 9.772 -3.776 -12.335
96 HE2 PHE 10 HE2 PHE 10 13.974 -4.360 -12.756
97 HZ PHE 10 HZ PHE 10 12.027 -2.853 -12.696
98 H PHE 11 H PHE 11 9.729 -10.908 -11.704
99 HA PHE 11 HA PHE 11 11.427 -12.535 -13.392
100 HB2 PHE 11 HB2 PHE 11 9.706 -13.189 -10.996
101 HB3 PHE 11 HB3 PHE 11 10.657 -14.388 -11.867
102 HD1 PHE 11 HD1 PHE 11 11.019 -11.113 -10.133
103 HD2 PHE 11 HD2 PHE 11 12.816 -14.824 -11.189
104 HE1 PHE 11 HE1 PHE 11 12.977 -10.555 -8.751
105 HE2 PHE 11 HE2 PHE 11 14.776 -14.272 -9.809
106 HZ PHE 11 HZ PHE 11 14.858 -12.135 -8.587
107 H ARG 12 H ARG 12 8.012 -11.950 -12.886
108 HA ARG 12 HA ARG 12 7.131 -14.155 -14.492
109 HB2 ARG 12 HB2 ARG 12 5.630 -11.686 -13.597
110 HB3 ARG 12 HB3 ARG 12 4.908 -13.131 -14.292
111 HG2 ARG 12 HG2 ARG 12 6.585 -13.428 -11.858
112 HG3 ARG 12 HG3 ARG 12 4.971 -12.734 -11.694
113 HD2 ARG 12 HD2 ARG 12 4.234 -14.780 -13.115
114 HD3 ARG 12 HD3 ARG 12 5.777 -15.466 -12.608
115 HE ARG 12 HE ARG 12 4.479 -14.519 -10.331
116 HH11 ARG 12 HH11 ARG 12 4.051 -16.970 -12.766
117 HH12 ARG 12 HH12 ARG 12 3.193 -18.048 -11.717
118 HH21 ARG 12 HH21 ARG 12 3.349 -15.930 -8.939
119 HH22 ARG 12 HH22 ARG 12 2.793 -17.455 -9.540
120 H LYS 13 H LYS 13 8.081 -10.878 -15.075
121 HA LYS 13 HA LYS 13 6.855 -10.738 -17.689
122 HB2 LYS 13 HB2 LYS 13 7.252 -8.764 -16.118
123 HB3 LYS 13 HB3 LYS 13 8.945 -8.869 -16.582
124 HG2 LYS 13 HG2 LYS 13 8.000 -7.210 -17.951
125 HG3 LYS 13 HG3 LYS 13 8.172 -8.637 -18.976
126 HD2 LYS 13 HD2 LYS 13 6.030 -7.860 -19.470
127 HD3 LYS 13 HD3 LYS 13 5.741 -9.152 -18.303
128 HE2 LYS 13 HE2 LYS 13 5.757 -7.344 -16.522
129 HE3 LYS 13 HE3 LYS 13 5.687 -6.180 -17.844
130 HZ1 LYS 13 HZ1 LYS 13 3.711 -8.365 -17.582
131 HZ2 LYS 13 HZ2 LYS 13 3.592 -6.947 -18.496
132 HZ3 LYS 13 HZ3 LYS 13 3.502 -6.875 -16.809
133 H HIS 14 H HIS 14 9.907 -11.649 -16.318
134 HA HIS 14 HA HIS 14 11.188 -11.694 -18.949
135 HB2 HIS 14 HB2 HIS 14 12.165 -11.791 -16.132
136 HB3 HIS 14 HB3 HIS 14 13.147 -12.558 -17.376
137 HD1 HIS 14 HD1 HIS 14 14.579 -11.057 -18.785
138 HD2 HIS 14 HD2 HIS 14 11.777 -8.952 -16.553
139 HE1 HIS 14 HE1 HIS 14 15.167 -8.631 -19.084
140 H ILE 15 H ILE 15 11.003 -13.915 -16.159
141 HA ILE 15 HA ILE 15 11.614 -16.207 -17.728
142 HB ILE 15 HB ILE 15 10.352 -16.085 -14.986
143 HG12 ILE 15 HG12 ILE 15 12.931 -16.808 -14.574
144 HG13 ILE 15 HG13 ILE 15 13.124 -15.745 -15.964
145 HG21 ILE 15 HG21 ILE 15 11.820 -18.335 -16.356
146 HG22 ILE 15 HG22 ILE 15 11.152 -18.363 -14.725
147 HG23 ILE 15 HG23 ILE 15 10.075 -18.247 -16.117
148 HD11 ILE 15 HD11 ILE 15 13.284 -14.787 -13.564
149 HD12 ILE 15 HD12 ILE 15 12.413 -13.890 -14.808
150 HD13 ILE 15 HD13 ILE 15 11.522 -14.841 -13.619
151 H THR 16 H THR 16 8.607 -15.295 -16.032
152 HA THR 16 HA THR 16 7.077 -17.235 -17.510
153 HB THR 16 HB THR 16 5.916 -15.029 -15.818
154 HG1 THR 16 HG1 THR 16 7.551 -16.108 -14.609
155 HG21 THR 16 HG21 THR 16 5.024 -17.853 -16.413
156 HG22 THR 16 HG22 THR 16 4.341 -16.384 -17.107
157 HG23 THR 16 HG23 THR 16 4.175 -16.703 -15.381
Start of MODEL 19
1 H1 GLU 1 H1 GLU 1 1.000 -0.783 -7.309
2 HA GLU 1 HA GLU 1 0.174 -2.936 -5.577
3 HB2 GLU 1 HB2 GLU 1 2.105 -2.685 -7.861
4 HB3 GLU 1 HB3 GLU 1 2.120 -4.115 -6.839
5 HG2 GLU 1 HG2 GLU 1 0.753 -4.732 -8.595
6 HG3 GLU 1 HG3 GLU 1 -0.394 -4.249 -7.347
7 H LYS 2 H LYS 2 1.605 -4.143 -4.215
8 HA LYS 2 HA LYS 2 3.173 -2.524 -2.514
9 HB2 LYS 2 HB2 LYS 2 2.957 -5.529 -2.747
10 HB3 LYS 2 HB3 LYS 2 3.831 -4.705 -1.463
11 HG2 LYS 2 HG2 LYS 2 0.891 -4.386 -2.029
12 HG3 LYS 2 HG3 LYS 2 1.582 -5.426 -0.783
13 HD2 LYS 2 HD2 LYS 2 2.745 -3.279 0.050
14 HD3 LYS 2 HD3 LYS 2 1.557 -2.431 -0.942
15 HE2 LYS 2 HE2 LYS 2 0.605 -2.531 1.203
16 HE3 LYS 2 HE3 LYS 2 -0.206 -3.796 0.282
17 HZ1 LYS 2 HZ1 LYS 2 0.328 -4.804 2.288
18 HZ2 LYS 2 HZ2 LYS 2 1.855 -4.079 2.376
19 HZ3 LYS 2 HZ3 LYS 2 1.571 -5.320 1.263
20 H PHE 3 H PHE 3 5.422 -2.585 -2.101
21 HA PHE 3 HA PHE 3 7.037 -2.608 -4.422
22 HB2 PHE 3 HB2 PHE 3 8.891 -2.119 -2.923
23 HB3 PHE 3 HB3 PHE 3 7.483 -1.169 -2.459
24 HD1 PHE 3 HD1 PHE 3 9.572 -4.066 -1.570
25 HD2 PHE 3 HD2 PHE 3 6.448 -1.449 -0.342
26 HE1 PHE 3 HE1 PHE 3 9.745 -4.941 0.723
27 HE2 PHE 3 HE2 PHE 3 6.616 -2.319 1.953
28 HZ PHE 3 HZ PHE 3 8.266 -4.068 2.488
29 H ARG 4 H ARG 4 6.344 -4.983 -1.971
30 HA ARG 4 HA ARG 4 8.534 -6.709 -2.495
31 HB2 ARG 4 HB2 ARG 4 5.918 -6.966 -1.075
32 HB3 ARG 4 HB3 ARG 4 6.819 -8.426 -1.458
33 HG2 ARG 4 HG2 ARG 4 8.779 -6.962 -0.356
34 HG3 ARG 4 HG3 ARG 4 7.386 -6.308 0.508
35 HD2 ARG 4 HD2 ARG 4 7.139 -8.168 1.722
36 HD3 ARG 4 HD3 ARG 4 7.327 -9.209 0.311
37 HE ARG 4 HE ARG 4 9.351 -8.492 2.216
38 HH11 ARG 4 HH11 ARG 4 8.745 -9.520 -1.054
39 HH12 ARG 4 HH12 ARG 4 10.313 -10.228 -1.260
40 HH21 ARG 4 HH21 ARG 4 11.418 -9.421 1.957
41 HH22 ARG 4 HH22 ARG 4 11.832 -10.172 0.454
42 H ARG 5 H ARG 5 5.470 -6.190 -4.027
43 HA ARG 5 HA ARG 5 5.409 -8.691 -5.432
44 HB2 ARG 5 HB2 ARG 5 3.349 -7.448 -4.924
45 HB3 ARG 5 HB3 ARG 5 3.895 -6.124 -5.945
46 HG2 ARG 5 HG2 ARG 5 2.287 -7.431 -7.146
47 HG3 ARG 5 HG3 ARG 5 3.874 -7.662 -7.881
48 HD2 ARG 5 HD2 ARG 5 2.580 -9.763 -7.645
49 HD3 ARG 5 HD3 ARG 5 4.126 -9.791 -6.797
50 HE ARG 5 HE ARG 5 2.997 -9.983 -4.814
51 HH11 ARG 5 HH11 ARG 5 0.779 -8.984 -7.304
52 HH12 ARG 5 HH12 ARG 5 -0.627 -9.173 -6.309
53 HH21 ARG 5 HH21 ARG 5 1.154 -10.236 -3.494
54 HH22 ARG 5 HH22 ARG 5 -0.412 -9.885 -4.142
55 H TYR 6 H TYR 6 6.776 -5.547 -5.974
56 HA TYR 6 HA TYR 6 7.063 -5.593 -8.756
57 HB2 TYR 6 HB2 TYR 6 8.431 -4.188 -6.514
58 HB3 TYR 6 HB3 TYR 6 9.220 -4.178 -8.087
59 HD1 TYR 6 HD1 TYR 6 5.644 -3.887 -7.029
60 HD2 TYR 6 HD2 TYR 6 8.918 -2.130 -9.102
61 HE1 TYR 6 HE1 TYR 6 4.192 -2.032 -7.738
62 HE2 TYR 6 HE2 TYR 6 7.476 -0.270 -9.815
63 HH TYR 6 HH TYR 6 4.019 -0.277 -9.179
64 H LEU 7 H LEU 7 8.776 -7.272 -6.254
65 HA LEU 7 HA LEU 7 11.069 -7.935 -7.841
66 HB2 LEU 7 HB2 LEU 7 10.007 -8.744 -5.178
67 HB3 LEU 7 HB3 LEU 7 11.244 -9.741 -5.939
68 HG LEU 7 HG LEU 7 12.240 -8.197 -4.356
69 HD11 LEU 7 HD11 LEU 7 13.243 -8.766 -6.702
70 HD12 LEU 7 HD12 LEU 7 14.007 -7.556 -5.672
71 HD13 LEU 7 HD13 LEU 7 12.973 -7.050 -7.008
72 HD21 LEU 7 HD21 LEU 7 10.289 -6.454 -5.066
73 HD22 LEU 7 HD22 LEU 7 11.670 -5.790 -5.941
74 HD23 LEU 7 HD23 LEU 7 11.756 -6.009 -4.192
75 H SER 8 H SER 8 7.911 -9.268 -7.353
76 HA SER 8 HA SER 8 8.609 -11.841 -8.501
77 HB2 SER 8 HB2 SER 8 5.808 -10.878 -7.952
78 HB3 SER 8 HB3 SER 8 6.420 -12.532 -7.964
79 HG SER 8 HG SER 8 6.700 -12.281 -5.907
80 H VAL 9 H VAL 9 6.563 -9.061 -9.357
81 HA VAL 9 HA VAL 9 5.653 -9.959 -11.825
82 HB VAL 9 HB VAL 9 5.222 -7.650 -12.398
83 HG11 VAL 9 HG11 VAL 9 4.553 -7.135 -9.701
84 HG12 VAL 9 HG12 VAL 9 3.519 -7.771 -10.981
85 HG13 VAL 9 HG13 VAL 9 4.429 -8.876 -9.950
86 HG21 VAL 9 HG21 VAL 9 6.031 -5.933 -10.580
87 HG22 VAL 9 HG22 VAL 9 7.308 -7.125 -10.337
88 HG23 VAL 9 HG23 VAL 9 7.080 -6.388 -11.923
89 H PHE 10 H PHE 10 8.775 -8.789 -10.896
90 HA PHE 10 HA PHE 10 9.755 -7.973 -13.397
91 HB2 PHE 10 HB2 PHE 10 10.935 -7.438 -11.341
92 HB3 PHE 10 HB3 PHE 10 11.222 -9.146 -11.027
93 HD1 PHE 10 HD1 PHE 10 11.672 -6.936 -14.002
94 HD2 PHE 10 HD2 PHE 10 13.432 -9.684 -11.270
95 HE1 PHE 10 HE1 PHE 10 13.794 -6.802 -15.240
96 HE2 PHE 10 HE2 PHE 10 15.557 -9.554 -12.502
97 HZ PHE 10 HZ PHE 10 15.741 -8.111 -14.490
98 H PHE 11 H PHE 11 9.315 -11.122 -11.983
99 HA PHE 11 HA PHE 11 10.898 -12.441 -14.031
100 HB2 PHE 11 HB2 PHE 11 9.268 -13.515 -11.723
101 HB3 PHE 11 HB3 PHE 11 10.161 -14.531 -12.851
102 HD1 PHE 11 HD1 PHE 11 10.573 -11.791 -10.385
103 HD2 PHE 11 HD2 PHE 11 12.416 -14.989 -12.504
104 HE1 PHE 11 HE1 PHE 11 12.593 -11.537 -9.004
105 HE2 PHE 11 HE2 PHE 11 14.439 -14.741 -11.125
106 HZ PHE 11 HZ PHE 11 14.529 -13.014 -9.372
107 H ARG 12 H ARG 12 7.541 -11.860 -13.222
108 HA ARG 12 HA ARG 12 6.484 -13.687 -15.159
109 HB2 ARG 12 HB2 ARG 12 5.136 -11.378 -13.745
110 HB3 ARG 12 HB3 ARG 12 4.322 -12.654 -14.641
111 HG2 ARG 12 HG2 ARG 12 6.112 -13.413 -12.391
112 HG3 ARG 12 HG3 ARG 12 4.523 -12.737 -12.028
113 HD2 ARG 12 HD2 ARG 12 3.714 -14.499 -13.790
114 HD3 ARG 12 HD3 ARG 12 5.237 -15.291 -13.393
115 HE ARG 12 HE ARG 12 3.777 -14.599 -11.052
116 HH11 ARG 12 HH11 ARG 12 3.952 -16.919 -13.641
117 HH12 ARG 12 HH12 ARG 12 3.218 -18.193 -12.724
118 HH21 ARG 12 HH21 ARG 12 2.809 -16.267 -9.834
119 HH22 ARG 12 HH22 ARG 12 2.567 -17.821 -10.560
120 H LYS 13 H LYS 13 7.550 -10.395 -15.175
121 HA LYS 13 HA LYS 13 6.207 -9.733 -17.652
122 HB2 LYS 13 HB2 LYS 13 6.654 -8.056 -15.840
123 HB3 LYS 13 HB3 LYS 13 8.368 -8.189 -16.209
124 HG2 LYS 13 HG2 LYS 13 8.189 -6.765 -17.897
125 HG3 LYS 13 HG3 LYS 13 6.841 -7.664 -18.596
126 HD2 LYS 13 HD2 LYS 13 5.898 -5.591 -18.145
127 HD3 LYS 13 HD3 LYS 13 5.439 -6.543 -16.731
128 HE2 LYS 13 HE2 LYS 13 6.202 -4.459 -15.912
129 HE3 LYS 13 HE3 LYS 13 7.491 -5.618 -15.592
130 HZ1 LYS 13 HZ1 LYS 13 7.585 -3.243 -17.118
131 HZ2 LYS 13 HZ2 LYS 13 7.984 -4.560 -18.103
132 HZ3 LYS 13 HZ3 LYS 13 8.853 -4.275 -16.680
133 H HIS 14 H HIS 14 9.305 -10.918 -16.616
134 HA HIS 14 HA HIS 14 10.470 -10.503 -19.263
135 HB2 HIS 14 HB2 HIS 14 11.539 -11.150 -16.562
136 HB3 HIS 14 HB3 HIS 14 12.438 -11.747 -17.953
137 HD1 HIS 14 HD1 HIS 14 14.233 -10.202 -18.620
138 HD2 HIS 14 HD2 HIS 14 10.979 -8.170 -17.025
139 HE1 HIS 14 HE1 HIS 14 14.868 -7.769 -18.671
140 H ILE 15 H ILE 15 10.281 -13.226 -16.961
141 HA ILE 15 HA ILE 15 10.740 -15.174 -18.992
142 HB ILE 15 HB ILE 15 9.636 -15.571 -16.208
143 HG12 ILE 15 HG12 ILE 15 12.195 -16.431 -16.087
144 HG13 ILE 15 HG13 ILE 15 12.368 -15.142 -17.274
145 HG21 ILE 15 HG21 ILE 15 10.373 -17.878 -16.458
146 HG22 ILE 15 HG22 ILE 15 9.206 -17.456 -17.710
147 HG23 ILE 15 HG23 ILE 15 10.924 -17.536 -18.098
148 HD11 ILE 15 HD11 ILE 15 10.927 -14.618 -14.717
149 HD12 ILE 15 HD12 ILE 15 12.689 -14.640 -14.753
150 HD13 ILE 15 HD13 ILE 15 11.800 -13.501 -15.766
151 H THR 16 H THR 16 7.872 -14.597 -16.944
152 HA THR 16 HA THR 16 6.187 -16.148 -18.672
153 HB THR 16 HB THR 16 5.090 -14.258 -16.622
154 HG1 THR 16 HG1 THR 16 6.268 -16.785 -16.023
155 HG21 THR 16 HG21 THR 16 4.371 -17.067 -17.469
156 HG22 THR 16 HG22 THR 16 3.535 -15.591 -17.950
157 HG23 THR 16 HG23 THR 16 3.512 -16.108 -16.264
Start of MODEL 20
1 H1 GLU 1 H1 GLU 1 0.389 -2.375 1.629
2 HA GLU 1 HA GLU 1 2.103 -0.961 -0.280
3 HB2 GLU 1 HB2 GLU 1 2.722 -2.460 2.266
4 HB3 GLU 1 HB3 GLU 1 3.960 -1.823 1.194
5 HG2 GLU 1 HG2 GLU 1 3.218 0.424 1.573
6 HG3 GLU 1 HG3 GLU 1 1.832 -0.147 2.501
7 H LYS 2 H LYS 2 2.470 -2.002 -2.119
8 HA LYS 2 HA LYS 2 2.970 -4.904 -2.007
9 HB2 LYS 2 HB2 LYS 2 1.469 -3.290 -4.059
10 HB3 LYS 2 HB3 LYS 2 2.123 -4.880 -4.428
11 HG2 LYS 2 HG2 LYS 2 0.287 -4.422 -2.101
12 HG3 LYS 2 HG3 LYS 2 -0.317 -4.746 -3.727
13 HD2 LYS 2 HD2 LYS 2 1.275 -6.787 -3.650
14 HD3 LYS 2 HD3 LYS 2 1.261 -6.526 -1.904
15 HE2 LYS 2 HE2 LYS 2 -1.236 -6.822 -3.561
16 HE3 LYS 2 HE3 LYS 2 -0.431 -8.176 -2.770
17 HZ1 LYS 2 HZ1 LYS 2 -0.780 -6.123 -0.894
18 HZ2 LYS 2 HZ2 LYS 2 -1.474 -7.666 -0.903
19 HZ3 LYS 2 HZ3 LYS 2 -2.262 -6.380 -1.668
20 H PHE 3 H PHE 3 5.204 -3.998 -1.633
21 HA PHE 3 HA PHE 3 6.510 -2.874 -3.963
22 HB2 PHE 3 HB2 PHE 3 7.063 -2.225 -1.578
23 HB3 PHE 3 HB3 PHE 3 7.810 -3.810 -1.403
24 HD1 PHE 3 HD1 PHE 3 7.954 -0.671 -3.367
25 HD2 PHE 3 HD2 PHE 3 10.005 -4.178 -2.101
26 HE1 PHE 3 HE1 PHE 3 10.049 0.222 -4.300
27 HE2 PHE 3 HE2 PHE 3 12.103 -3.291 -3.031
28 HZ PHE 3 HZ PHE 3 12.127 -1.088 -4.131
29 H ARG 4 H ARG 4 6.098 -5.965 -2.444
30 HA ARG 4 HA ARG 4 8.294 -7.300 -3.633
31 HB2 ARG 4 HB2 ARG 4 5.665 -8.491 -2.733
32 HB3 ARG 4 HB3 ARG 4 7.180 -9.352 -2.969
33 HG2 ARG 4 HG2 ARG 4 6.628 -7.247 -0.888
34 HG3 ARG 4 HG3 ARG 4 6.774 -8.985 -0.616
35 HD2 ARG 4 HD2 ARG 4 9.110 -8.792 -1.589
36 HD3 ARG 4 HD3 ARG 4 8.914 -7.045 -1.454
37 HE ARG 4 HE ARG 4 8.387 -8.464 0.990
38 HH11 ARG 4 HH11 ARG 4 10.835 -6.990 -0.999
39 HH12 ARG 4 HH12 ARG 4 11.928 -6.722 0.318
40 HH21 ARG 4 HH21 ARG 4 9.817 -8.116 2.732
41 HH22 ARG 4 HH22 ARG 4 11.349 -7.363 2.440
42 H ARG 5 H ARG 5 5.146 -6.411 -4.773
43 HA ARG 5 HA ARG 5 4.786 -8.258 -6.835
44 HB2 ARG 5 HB2 ARG 5 3.049 -6.680 -6.082
45 HB3 ARG 5 HB3 ARG 5 3.964 -5.349 -6.777
46 HG2 ARG 5 HG2 ARG 5 2.291 -5.824 -8.339
47 HG3 ARG 5 HG3 ARG 5 3.751 -6.563 -8.998
48 HD2 ARG 5 HD2 ARG 5 1.876 -8.078 -9.232
49 HD3 ARG 5 HD3 ARG 5 3.042 -8.732 -8.083
50 HE ARG 5 HE ARG 5 0.944 -7.226 -6.836
51 HH11 ARG 5 HH11 ARG 5 1.855 -10.342 -8.093
52 HH12 ARG 5 HH12 ARG 5 0.729 -11.214 -7.106
53 HH21 ARG 5 HH21 ARG 5 -0.542 -8.363 -5.531
54 HH22 ARG 5 HH22 ARG 5 -0.634 -10.087 -5.650
55 H TYR 6 H TYR 6 6.437 -5.114 -6.856
56 HA TYR 6 HA TYR 6 7.099 -5.082 -9.581
57 HB2 TYR 6 HB2 TYR 6 8.355 -3.775 -7.173
58 HB3 TYR 6 HB3 TYR 6 8.967 -3.517 -8.803
59 HD1 TYR 6 HD1 TYR 6 6.853 -3.036 -10.522
60 HD2 TYR 6 HD2 TYR 6 7.050 -2.055 -6.387
61 HE1 TYR 6 HE1 TYR 6 5.189 -1.259 -10.871
62 HE2 TYR 6 HE2 TYR 6 5.385 -0.276 -6.723
63 HH TYR 6 HH TYR 6 4.361 0.707 -9.888
64 H LEU 7 H LEU 7 8.486 -6.771 -6.893
65 HA LEU 7 HA LEU 7 10.953 -7.395 -8.268
66 HB2 LEU 7 HB2 LEU 7 9.770 -8.059 -5.609
67 HB3 LEU 7 HB3 LEU 7 11.111 -9.022 -6.226
68 HG LEU 7 HG LEU 7 12.243 -6.662 -6.513
69 HD11 LEU 7 HD11 LEU 7 10.594 -5.161 -5.902
70 HD12 LEU 7 HD12 LEU 7 11.529 -5.321 -4.416
71 HD13 LEU 7 HD13 LEU 7 10.001 -6.184 -4.593
72 HD21 LEU 7 HD21 LEU 7 12.781 -8.668 -4.973
73 HD22 LEU 7 HD22 LEU 7 12.021 -7.696 -3.713
74 HD23 LEU 7 HD23 LEU 7 13.435 -7.080 -4.569
75 H SER 8 H SER 8 7.815 -8.795 -7.833
76 HA SER 8 HA SER 8 8.633 -11.436 -8.687
77 HB2 SER 8 HB2 SER 8 5.812 -10.390 -8.398
78 HB3 SER 8 HB3 SER 8 6.341 -12.072 -8.387
79 HG SER 8 HG SER 8 7.616 -11.379 -6.462
80 H VAL 9 H VAL 9 6.854 -8.685 -10.023
81 HA VAL 9 HA VAL 9 6.000 -9.779 -12.419
82 HB VAL 9 HB VAL 9 6.029 -7.493 -13.335
83 HG11 VAL 9 HG11 VAL 9 4.885 -8.147 -10.683
84 HG12 VAL 9 HG12 VAL 9 4.808 -6.461 -11.200
85 HG13 VAL 9 HG13 VAL 9 4.080 -7.723 -12.194
86 HG21 VAL 9 HG21 VAL 9 6.853 -5.634 -11.977
87 HG22 VAL 9 HG22 VAL 9 7.441 -6.774 -10.767
88 HG23 VAL 9 HG23 VAL 9 8.155 -6.754 -12.379
89 H PHE 10 H PHE 10 9.183 -8.695 -11.473
90 HA PHE 10 HA PHE 10 10.356 -8.496 -14.017
91 HB2 PHE 10 HB2 PHE 10 11.359 -8.834 -11.235
92 HB3 PHE 10 HB3 PHE 10 12.476 -9.198 -12.547
93 HD1 PHE 10 HD1 PHE 10 12.154 -7.280 -14.537
94 HD2 PHE 10 HD2 PHE 10 11.691 -6.761 -10.338
95 HE1 PHE 10 HE1 PHE 10 12.647 -4.882 -14.782
96 HE2 PHE 10 HE2 PHE 10 12.183 -4.362 -10.577
97 HZ PHE 10 HZ PHE 10 12.663 -3.420 -12.801
98 H PHE 11 H PHE 11 9.555 -11.231 -12.040
99 HA PHE 11 HA PHE 11 11.173 -13.057 -13.622
100 HB2 PHE 11 HB2 PHE 11 9.334 -13.477 -11.263
101 HB3 PHE 11 HB3 PHE 11 10.152 -14.793 -12.097
102 HD1 PHE 11 HD1 PHE 11 10.865 -11.561 -10.394
103 HD2 PHE 11 HD2 PHE 11 12.234 -15.470 -11.375
104 HE1 PHE 11 HE1 PHE 11 12.849 -11.218 -8.979
105 HE2 PHE 11 HE2 PHE 11 14.219 -15.133 -9.961
106 HZ PHE 11 HZ PHE 11 14.528 -13.005 -8.760
107 H ARG 12 H ARG 12 7.822 -12.117 -13.213
108 HA ARG 12 HA ARG 12 6.764 -14.236 -14.828
109 HB2 ARG 12 HB2 ARG 12 5.468 -11.619 -14.045
110 HB3 ARG 12 HB3 ARG 12 4.648 -13.049 -14.658
111 HG2 ARG 12 HG2 ARG 12 6.264 -13.171 -12.143
112 HG3 ARG 12 HG3 ARG 12 4.602 -12.577 -12.132
113 HD2 ARG 12 HD2 ARG 12 5.516 -15.271 -13.135
114 HD3 ARG 12 HD3 ARG 12 4.705 -14.961 -11.600
115 HE ARG 12 HE ARG 12 3.484 -15.191 -14.171
116 HH11 ARG 12 HH11 ARG 12 3.215 -13.662 -11.055
117 HH12 ARG 12 HH12 ARG 12 1.497 -13.463 -11.156
118 HH21 ARG 12 HH21 ARG 12 1.222 -14.935 -14.315
119 HH22 ARG 12 HH22 ARG 12 0.364 -14.189 -13.010
120 H LYS 13 H LYS 13 8.044 -11.070 -15.403
121 HA LYS 13 HA LYS 13 6.903 -10.821 -18.044
122 HB2 LYS 13 HB2 LYS 13 7.447 -8.876 -16.521
123 HB3 LYS 13 HB3 LYS 13 9.146 -9.194 -16.845
124 HG2 LYS 13 HG2 LYS 13 8.544 -7.471 -18.311
125 HG3 LYS 13 HG3 LYS 13 8.575 -8.931 -19.303
126 HD2 LYS 13 HD2 LYS 13 6.580 -8.054 -19.984
127 HD3 LYS 13 HD3 LYS 13 6.020 -9.015 -18.613
128 HE2 LYS 13 HE2 LYS 13 6.851 -6.170 -18.215
129 HE3 LYS 13 HE3 LYS 13 5.254 -6.539 -18.863
130 HZ1 LYS 13 HZ1 LYS 13 4.654 -6.704 -16.737
131 HZ2 LYS 13 HZ2 LYS 13 6.248 -6.812 -16.181
132 HZ3 LYS 13 HZ3 LYS 13 5.450 -8.197 -16.734
133 H HIS 14 H HIS 14 9.793 -12.081 -16.612
134 HA HIS 14 HA HIS 14 11.106 -12.287 -19.222
135 HB2 HIS 14 HB2 HIS 14 12.031 -12.433 -16.391
136 HB3 HIS 14 HB3 HIS 14 12.939 -13.331 -17.604
137 HD1 HIS 14 HD1 HIS 14 13.000 -11.400 -19.922
138 HD2 HIS 14 HD2 HIS 14 13.520 -10.212 -15.974
139 HE1 HIS 14 HE1 HIS 14 14.250 -9.221 -20.034
140 H ILE 15 H ILE 15 10.686 -14.434 -16.401
141 HA ILE 15 HA ILE 15 11.065 -16.802 -17.915
142 HB ILE 15 HB ILE 15 9.754 -16.498 -15.211
143 HG12 ILE 15 HG12 ILE 15 12.243 -17.484 -14.736
144 HG13 ILE 15 HG13 ILE 15 12.564 -16.440 -16.117
145 HG21 ILE 15 HG21 ILE 15 10.298 -18.839 -14.889
146 HG22 ILE 15 HG22 ILE 15 9.287 -18.640 -16.320
147 HG23 ILE 15 HG23 ILE 15 11.020 -18.914 -16.497
148 HD11 ILE 15 HD11 ILE 15 12.011 -14.529 -14.968
149 HD12 ILE 15 HD12 ILE 15 11.004 -15.391 -13.805
150 HD13 ILE 15 HD13 ILE 15 12.761 -15.508 -13.708
151 H THR 16 H THR 16 8.131 -15.531 -16.328
152 HA THR 16 HA THR 16 6.441 -17.332 -17.811
153 HB THR 16 HB THR 16 5.491 -14.988 -16.173
154 HG1 THR 16 HG1 THR 16 7.065 -16.702 -15.191
155 HG21 THR 16 HG21 THR 16 4.176 -16.981 -17.637
156 HG22 THR 16 HG22 THR 16 3.461 -15.859 -16.481
157 HG23 THR 16 HG23 THR 16 4.007 -17.448 -15.945
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