Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
15697 | 1ytr RC | 6561 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H LYS 1 H LYS 1 -4.554 7.938 2.548
2 HA LYS 1 HA LYS 1 -5.684 9.539 3.598
3 2HB LYS 1 2HB LYS 1 -4.248 11.445 4.719
4 2HG LYS 1 2HG LYS 1 -3.565 9.363 6.420
5 2HD LYS 1 2HD LYS 1 -5.951 9.692 7.335
6 2HE LYS 1 2HE LYS 1 -3.724 11.510 7.207
7 1HZ LYS 1 1HZ LYS 1 -4.636 13.460 6.789
8 2HZ LYS 1 2HZ LYS 1 -5.927 12.686 6.158
9 3HZ LYS 1 3HZ LYS 1 -5.949 13.172 7.716
10 H SER 2 H SER 2 -6.117 9.715 1.157
11 HA SER 2 HA SER 2 -5.608 12.479 0.469
12 2HB SER 2 2HB SER 2 -5.194 10.162 -1.472
13 HG SER 2 HG SER 2 -4.501 11.806 -2.922
14 H SER 3 H SER 3 -7.171 9.403 -0.707
15 HA SER 3 HA SER 3 -9.736 10.380 -0.327
16 2HB SER 3 2HB SER 3 -9.462 10.141 -3.265
17 HG SER 3 HG SER 3 -11.366 11.050 -2.799
18 H ALA 4 H ALA 4 -11.394 8.782 -1.144
19 HA ALA 4 HA ALA 4 -12.108 6.712 -1.452
20 1HB ALA 4 1HB ALA 4 -10.572 5.248 -2.995
21 2HB ALA 4 2HB ALA 4 -11.355 6.699 -3.667
22 3HB ALA 4 3HB ALA 4 -9.641 6.752 -3.191
23 H TYR 5 H TYR 5 -12.235 5.213 0.139
24 HA TYR 5 HA TYR 5 -9.696 4.248 1.263
25 2HB TYR 5 2HB TYR 5 -11.403 4.166 3.384
26 HD1 TYR 5 1HD TYR 5 -10.551 7.316 1.512
27 HD2 TYR 5 2HD TYR 5 -9.941 4.924 5.008
28 HE1 TYR 5 1HE TYR 5 -8.991 9.085 2.461
29 HE2 TYR 5 2HE TYR 5 -8.384 6.703 5.944
30 HH TYR 5 HH TYR 5 -7.634 9.617 4.055
31 H SER 6 H SER 6 -10.573 2.704 -0.679
32 HA SER 6 HA SER 6 -12.665 0.983 0.137
33 2HB SER 6 2HB SER 6 -11.940 -0.364 -1.872
34 HG SER 6 HG SER 6 -13.030 2.056 -1.843
35 H LEU 7 H LEU 7 -12.487 -1.230 0.854
36 HA LEU 7 HA LEU 7 -10.301 -1.702 2.565
37 2HB LEU 7 2HB LEU 7 -11.390 -3.806 3.028
38 HG LEU 7 HG LEU 7 -13.468 -1.638 2.618
39 1HD1 LEU 7 1HD1 LEU 7 -13.645 -4.047 4.441
40 2HD1 LEU 7 2HD1 LEU 7 -14.903 -2.834 4.099
41 3HD1 LEU 7 3HD1 LEU 7 -14.387 -3.964 2.825
42 1HD2 LEU 7 1HD2 LEU 7 -11.504 -2.224 4.800
43 2HD2 LEU 7 2HD2 LEU 7 -12.015 -0.667 4.104
44 3HD2 LEU 7 3HD2 LEU 7 -13.094 -1.543 5.217
45 H GLN 8 H GLN 8 -11.396 -3.457 -0.429
46 HA GLN 8 HA GLN 8 -10.256 -4.413 -2.019
47 2HB GLN 8 2HB GLN 8 -7.484 -3.916 -1.431
48 2HG GLN 8 2HG GLN 8 -8.293 -3.958 -3.706
49 1HE2 GLN 8 1HE2 GLN 8 -9.950 -3.861 -5.019
50 2HE2 GLN 8 2HE2 GLN 8 -11.361 -2.872 -4.851
51 H MET 9 H MET 9 -7.706 -5.764 -2.019
52 HA MET 9 HA MET 9 -7.291 -7.221 0.302
53 2HB MET 9 2HB MET 9 -9.476 -8.255 -0.114
54 2HG MET 9 2HG MET 9 -9.141 -7.619 -2.741
55 1HE MET 9 1HE MET 9 -8.110 -9.903 -5.515
56 2HE MET 9 2HE MET 9 -9.706 -9.275 -5.039
57 3HE MET 9 3HE MET 9 -8.266 -8.239 -4.904
58 H GLY 10 H GLY 10 -7.302 -7.182 -3.295
59 1HA GLY 10 1HA GLY 10 -4.499 -8.087 -3.223
60 2HA GLY 10 2HA GLY 10 -5.652 -8.881 -4.276
61 H ALA 11 H ALA 11 -4.890 -5.436 -3.363
62 HA ALA 11 HA ALA 11 -4.016 -4.802 -5.975
63 1HB ALA 11 1HB ALA 11 -5.964 -3.157 -6.376
64 2HB ALA 11 2HB ALA 11 -6.276 -4.883 -6.684
65 3HB ALA 11 3HB ALA 11 -6.863 -4.126 -5.183
66 H THR 12 H THR 12 -6.028 -2.462 -4.274
67 HA THR 12 HA THR 12 -4.158 -0.553 -3.944
68 HB THR 12 HB THR 12 -6.360 -1.243 -1.930
69 HG1 THR 12 1HG THR 12 -6.351 0.272 -4.442
70 1HG2 THR 12 1HG2 THR 12 -5.923 1.528 -2.941
71 2HG2 THR 12 2HG2 THR 12 -6.278 0.974 -1.288
72 3HG2 THR 12 3HG2 THR 12 -4.612 0.908 -1.910
73 H ALA 13 H ALA 13 -4.770 -3.281 -1.661
74 HA ALA 13 HA ALA 13 -3.174 -2.578 0.395
75 1HB ALA 13 1HB ALA 13 -2.612 -5.291 -0.009
76 2HB ALA 13 2HB ALA 13 -3.982 -4.618 0.906
77 3HB ALA 13 3HB ALA 13 -4.183 -5.044 -0.811
78 H ILE 14 H ILE 14 -2.151 -3.960 -2.782
79 HA ILE 14 HA ILE 14 0.461 -4.444 -2.334
80 HB ILE 14 HB ILE 14 -0.858 -3.173 -4.731
81 2HG1 ILE 14 2HG1 ILE 14 -1.744 -5.373 -4.064
82 1HG2 ILE 14 1HG2 ILE 14 1.808 -4.588 -4.744
83 2HG2 ILE 14 2HG2 ILE 14 1.047 -3.627 -6.035
84 3HG2 ILE 14 3HG2 ILE 14 1.660 -2.823 -4.569
85 1HD1 ILE 14 1HD1 ILE 14 -1.130 -6.597 -6.225
86 2HD1 ILE 14 2HD1 ILE 14 -1.752 -4.943 -6.439
87 3HD1 ILE 14 3HD1 ILE 14 -0.005 -5.260 -6.564
88 H LYS 15 H LYS 15 -0.995 -1.212 -3.101
89 HA LYS 15 HA LYS 15 1.346 0.233 -3.081
90 2HB LYS 15 2HB LYS 15 -1.542 0.843 -2.609
91 2HG LYS 15 2HG LYS 15 -0.596 3.341 -2.596
92 2HD LYS 15 2HD LYS 15 -0.314 2.080 0.102
93 2HE LYS 15 2HE LYS 15 -2.199 4.200 -1.037
94 1HZ LYS 15 1HZ LYS 15 -2.626 4.677 1.191
95 2HZ LYS 15 2HZ LYS 15 -2.775 3.054 1.087
96 3HZ LYS 15 3HZ LYS 15 -1.434 3.710 1.748
97 H GLN 16 H GLN 16 -0.729 -0.864 -0.357
98 HA GLN 16 HA GLN 16 0.426 0.613 1.623
99 2HB GLN 16 2HB GLN 16 -1.514 -1.327 1.486
100 2HG GLN 16 2HG GLN 16 0.700 -2.453 3.259
101 1HE2 GLN 16 1HE2 GLN 16 -0.871 -2.564 4.910
102 2HE2 GLN 16 2HE2 GLN 16 -2.138 -3.744 4.890
103 H VAL 17 H VAL 17 1.548 -2.392 0.030
104 HA VAL 17 HA VAL 17 3.478 -3.193 1.808
105 HB VAL 17 HB VAL 17 3.563 -3.238 -1.215
106 1HG1 VAL 17 1HG1 VAL 17 5.158 -4.950 -1.091
107 2HG1 VAL 17 2HG1 VAL 17 5.698 -3.784 0.139
108 3HG1 VAL 17 3HG1 VAL 17 4.834 -5.260 0.632
109 1HG2 VAL 17 1HG2 VAL 17 1.594 -4.300 0.376
110 2HG2 VAL 17 2HG2 VAL 17 2.053 -4.910 -1.232
111 3HG2 VAL 17 3HG2 VAL 17 2.727 -5.666 0.232
112 H LYS 18 H LYS 18 3.557 -0.581 -0.663
113 HA LYS 18 HA LYS 18 6.295 -0.046 -0.434
114 2HB LYS 18 2HB LYS 18 3.959 1.084 -1.745
115 2HG LYS 18 2HG LYS 18 5.314 3.355 -1.972
116 2HD LYS 18 2HD LYS 18 4.089 4.021 0.370
117 2HE LYS 18 2HE LYS 18 2.663 3.245 -2.220
118 1HZ LYS 18 1HZ LYS 18 0.950 4.541 -1.474
119 2HZ LYS 18 2HZ LYS 18 1.375 3.775 -0.095
120 3HZ LYS 18 3HZ LYS 18 1.840 5.321 -0.348
121 H LYS 19 H LYS 19 3.425 0.978 1.443
122 HA LYS 19 HA LYS 19 4.719 3.021 2.866
123 2HB LYS 19 2HB LYS 19 2.151 1.614 2.907
124 2HG LYS 19 2HG LYS 19 1.752 2.588 5.307
125 2HD LYS 19 2HD LYS 19 3.135 0.348 6.166
126 2HE LYS 19 2HE LYS 19 0.483 0.360 4.644
127 1HZ LYS 19 1HZ LYS 19 0.215 -1.383 6.538
128 2HZ LYS 19 2HZ LYS 19 0.860 -1.805 5.098
129 3HZ LYS 19 3HZ LYS 19 1.834 -1.525 6.378
130 H LEU 20 H LEU 20 4.898 -0.467 2.994
131 HA LEU 20 HA LEU 20 5.955 -0.425 5.696
132 2HB LEU 20 2HB LEU 20 4.426 -2.215 4.335
133 HG LEU 20 HG LEU 20 6.525 -2.965 3.059
134 1HD1 LEU 20 1HD1 LEU 20 7.545 -4.805 4.898
135 2HD1 LEU 20 2HD1 LEU 20 8.355 -3.357 4.255
136 3HD1 LEU 20 3HD1 LEU 20 7.455 -3.265 5.787
137 1HD2 LEU 20 1HD2 LEU 20 5.822 -5.468 4.142
138 2HD2 LEU 20 2HD2 LEU 20 4.371 -4.443 4.269
139 3HD2 LEU 20 3HD2 LEU 20 5.163 -4.675 2.692
140 H PHE 21 H PHE 21 7.011 -0.106 2.415
141 HA PHE 21 HA PHE 21 9.617 -1.206 2.871
142 2HB PHE 21 2HB PHE 21 9.529 0.569 0.613
143 HD1 PHE 21 1HD PHE 21 7.521 -2.464 0.322
144 HD2 PHE 21 2HD PHE 21 11.445 -0.862 0.121
145 HE1 PHE 21 1HE PHE 21 8.312 -4.548 -0.832
146 HE2 PHE 21 2HE PHE 21 12.237 -2.945 -1.033
147 HZ PHE 21 HZ PHE 21 10.661 -4.764 -1.496
148 H LYS 22 H LYS 22 7.998 1.816 3.481
149 HA LYS 22 HA LYS 22 9.914 3.698 3.076
150 2HB LYS 22 2HB LYS 22 7.471 3.761 4.094
151 2HG LYS 22 2HG LYS 22 7.598 4.430 6.507
152 2HD LYS 22 2HD LYS 22 8.793 1.784 6.815
153 2HE LYS 22 2HE LYS 22 6.342 1.232 7.336
154 1HZ LYS 22 1HZ LYS 22 6.995 1.891 9.315
155 2HZ LYS 22 2HZ LYS 22 8.110 2.906 8.688
156 3HZ LYS 22 3HZ LYS 22 6.592 3.436 8.971
157 H LYS 23 H LYS 23 9.935 1.006 5.338
158 HA LYS 23 HA LYS 23 12.204 2.178 6.751
159 2HB LYS 23 2HB LYS 23 10.530 1.331 8.217
160 2HG LYS 23 2HG LYS 23 10.259 -0.732 6.160
161 2HD LYS 23 2HD LYS 23 11.597 -1.865 8.181
162 2HE LYS 23 2HE LYS 23 8.722 -1.638 9.171
163 1HZ LYS 23 1HZ LYS 23 9.316 -3.891 9.370
164 2HZ LYS 23 2HZ LYS 23 10.822 -3.553 9.903
165 3HZ LYS 23 3HZ LYS 23 9.529 -3.238 10.851
166 H TRP 24 H TRP 24 11.252 -0.375 4.460
167 HA TRP 24 HA TRP 24 13.638 -1.855 4.619
168 2HB TRP 24 2HB TRP 24 12.903 -2.714 2.379
169 HD1 TRP 24 HD TRP 24 11.555 -2.461 5.871
170 HE1 TRP 24 1HE TRP 24 10.050 -4.525 6.536
171 HE3 TRP 24 3HE TRP 24 11.119 -4.329 1.163
172 HZ2 TRP 24 2HZ TRP 24 8.872 -6.658 5.052
173 HZ3 TRP 24 3HZ TRP 24 9.773 -6.407 0.857
174 HH2 TRP 24 HH TRP 24 8.672 -7.564 2.707
175 H GLY 25 H GLY 25 15.662 -1.199 4.041
176 1HA GLY 25 1HA GLY 25 16.067 0.315 1.618
177 2HA GLY 25 2HA GLY 25 16.390 1.224 3.081
178 H TRP 26 H TRP 26 17.565 -1.182 0.865
179 HA TRP 26 HA TRP 26 19.278 -2.718 2.275
180 2HB TRP 26 2HB TRP 26 18.937 -2.896 -0.121
181 HD1 TRP 26 HD TRP 26 18.691 0.466 0.102
182 HE1 TRP 26 1HE TRP 26 19.498 1.944 -1.930
183 HE3 TRP 26 3HE TRP 26 21.665 -3.091 -1.985
184 HZ2 TRP 26 2HZ TRP 26 21.250 1.471 -4.132
185 HZ3 TRP 26 3HZ TRP 26 22.889 -2.502 -4.075
186 HH2 TRP 26 HH TRP 26 22.718 -0.312 -5.146
Start of MODEL 2
1 1H LYS 1 H LYS 1 -3.689 12.664 7.538
2 HA LYS 1 HA LYS 1 -1.422 11.356 7.950
3 2HB LYS 1 2HB LYS 1 -2.103 11.638 10.783
4 2HG LYS 1 2HG LYS 1 0.482 12.004 9.194
5 2HD LYS 1 2HD LYS 1 0.698 10.948 11.912
6 2HE LYS 1 2HE LYS 1 2.193 12.525 10.101
7 1HZ LYS 1 1HZ LYS 1 2.691 14.242 12.017
8 2HZ LYS 1 2HZ LYS 1 1.645 14.565 10.804
9 3HZ LYS 1 3HZ LYS 1 1.084 14.077 12.258
10 H SER 2 H SER 2 -2.318 9.484 7.267
11 HA SER 2 HA SER 2 -4.071 8.130 8.995
12 2HB SER 2 2HB SER 2 -5.725 7.948 6.792
13 HG SER 2 HG SER 2 -6.614 8.289 8.833
14 H SER 3 H SER 3 -4.618 5.898 8.063
15 HA SER 3 HA SER 3 -2.688 5.225 5.981
16 2HB SER 3 2HB SER 3 -3.184 2.942 7.664
17 HG SER 3 HG SER 3 -0.758 4.203 8.091
18 H ALA 4 H ALA 4 -4.512 5.471 4.457
19 HA ALA 4 HA ALA 4 -5.760 3.076 3.852
20 1HB ALA 4 1HB ALA 4 -7.199 3.269 5.730
21 2HB ALA 4 2HB ALA 4 -7.427 5.017 5.480
22 3HB ALA 4 3HB ALA 4 -8.166 3.854 4.354
23 H TYR 5 H TYR 5 -6.472 3.179 1.729
24 HA TYR 5 HA TYR 5 -7.281 5.690 0.602
25 2HB TYR 5 2HB TYR 5 -5.355 5.524 -1.106
26 HD1 TYR 5 1HD TYR 5 -3.558 4.642 1.969
27 HD2 TYR 5 2HD TYR 5 -5.263 7.845 -0.297
28 HE1 TYR 5 1HE TYR 5 -2.272 6.328 3.372
29 HE2 TYR 5 2HE TYR 5 -3.971 9.520 1.113
30 HH TYR 5 HH TYR 5 -1.835 8.405 3.730
31 H SER 6 H SER 6 -8.927 3.614 0.783
32 HA SER 6 HA SER 6 -10.330 2.618 -0.613
33 2HB SER 6 2HB SER 6 -9.965 2.340 -2.960
34 HG SER 6 HG SER 6 -9.802 4.656 -2.033
35 H LEU 7 H LEU 7 -6.878 1.593 -0.584
36 HA LEU 7 HA LEU 7 -7.206 -1.083 -1.132
37 2HB LEU 7 2HB LEU 7 -5.139 0.578 -0.525
38 HG LEU 7 HG LEU 7 -5.410 -1.382 1.763
39 1HD1 LEU 7 1HD1 LEU 7 -3.120 -1.302 2.205
40 2HD1 LEU 7 2HD1 LEU 7 -3.205 -1.537 0.442
41 3HD1 LEU 7 3HD1 LEU 7 -2.855 0.075 1.110
42 1HD2 LEU 7 1HD2 LEU 7 -5.359 0.405 3.177
43 2HD2 LEU 7 2HD2 LEU 7 -4.395 1.408 2.066
44 3HD2 LEU 7 3HD2 LEU 7 -6.135 1.173 1.771
45 H GLN 8 H GLN 8 -8.772 -2.345 -0.247
46 HA GLN 8 HA GLN 8 -8.538 -3.049 2.441
47 2HB GLN 8 2HB GLN 8 -9.710 -0.805 2.676
48 2HG GLN 8 2HG GLN 8 -11.966 -2.364 1.327
49 1HE2 GLN 8 1HE2 GLN 8 -13.960 -1.713 1.715
50 2HE2 GLN 8 2HE2 GLN 8 -14.434 -0.367 2.696
51 H MET 9 H MET 9 -10.588 -2.828 -0.505
52 HA MET 9 HA MET 9 -11.533 -5.519 0.093
53 2HB MET 9 2HB MET 9 -13.274 -3.740 -0.272
54 2HG MET 9 2HG MET 9 -13.365 -3.186 -2.936
55 1HE MET 9 1HE MET 9 -14.469 -0.243 -0.914
56 2HE MET 9 2HE MET 9 -14.860 -1.681 -1.888
57 3HE MET 9 3HE MET 9 -14.470 -1.855 -0.159
58 H GLY 10 H GLY 10 -9.562 -3.558 -2.048
59 1HA GLY 10 1HA GLY 10 -9.609 -5.149 -4.365
60 2HA GLY 10 2HA GLY 10 -8.344 -4.038 -3.875
61 H ALA 11 H ALA 11 -6.500 -5.256 -4.288
62 HA ALA 11 HA ALA 11 -5.872 -7.281 -2.399
63 1HB ALA 11 1HB ALA 11 -7.355 -8.342 -4.339
64 2HB ALA 11 2HB ALA 11 -5.810 -8.308 -5.222
65 3HB ALA 11 3HB ALA 11 -5.938 -9.201 -3.689
66 H THR 12 H THR 12 -5.040 -6.357 -5.823
67 HA THR 12 HA THR 12 -2.292 -6.569 -5.493
68 HB THR 12 HB THR 12 -4.034 -4.863 -7.348
69 HG1 THR 12 1HG THR 12 -4.179 -7.281 -7.307
70 1HG2 THR 12 1HG2 THR 12 -1.335 -5.871 -8.177
71 2HG2 THR 12 2HG2 THR 12 -2.165 -4.363 -8.630
72 3HG2 THR 12 3HG2 THR 12 -1.328 -4.482 -7.063
73 H ALA 13 H ALA 13 -4.457 -3.719 -5.018
74 HA ALA 13 HA ALA 13 -2.684 -1.749 -4.639
75 1HB ALA 13 1HB ALA 13 -4.372 -1.154 -2.645
76 2HB ALA 13 2HB ALA 13 -4.870 -1.077 -4.352
77 3HB ALA 13 3HB ALA 13 -5.291 -2.497 -3.364
78 H ILE 14 H ILE 14 -3.643 -4.185 -2.120
79 HA ILE 14 HA ILE 14 -2.161 -3.322 -0.040
80 HB ILE 14 HB ILE 14 -2.743 -6.113 -1.011
81 2HG1 ILE 14 2HG1 ILE 14 -4.212 -4.064 0.431
82 1HG2 ILE 14 1HG2 ILE 14 -1.641 -5.359 1.707
83 2HG2 ILE 14 2HG2 ILE 14 -2.060 -6.986 1.123
84 3HG2 ILE 14 3HG2 ILE 14 -0.694 -6.106 0.399
85 1HD1 ILE 14 1HD1 ILE 14 -6.021 -5.902 0.087
86 2HD1 ILE 14 2HD1 ILE 14 -5.299 -5.175 -1.368
87 3HD1 ILE 14 3HD1 ILE 14 -4.761 -6.779 -0.815
88 H LYS 15 H LYS 15 -0.989 -5.380 -2.786
89 HA LYS 15 HA LYS 15 1.604 -5.678 -1.901
90 2HB LYS 15 2HB LYS 15 0.478 -5.532 -4.710
91 2HG LYS 15 2HG LYS 15 2.615 -7.056 -5.052
92 2HD LYS 15 2HD LYS 15 3.452 -4.203 -4.722
93 2HE LYS 15 2HE LYS 15 4.612 -6.040 -6.126
94 1HZ LYS 15 1HZ LYS 15 2.654 -6.911 -7.158
95 2HZ LYS 15 2HZ LYS 15 2.289 -5.470 -7.834
96 3HZ LYS 15 3HZ LYS 15 3.622 -6.283 -8.313
97 H GLN 16 H GLN 16 0.036 -2.968 -3.669
98 HA GLN 16 HA GLN 16 2.293 -1.587 -4.334
99 2HB GLN 16 2HB GLN 16 -0.411 -1.177 -4.576
100 2HG GLN 16 2HG GLN 16 0.641 1.114 -2.858
101 1HE2 GLN 16 1HE2 GLN 16 -0.580 2.852 -2.931
102 2HE2 GLN 16 2HE2 GLN 16 -2.131 3.002 -3.688
103 H VAL 17 H VAL 17 0.575 -1.834 -1.206
104 HA VAL 17 HA VAL 17 1.656 0.309 0.121
105 HB VAL 17 HB VAL 17 1.076 -2.467 1.176
106 1HG1 VAL 17 1HG1 VAL 17 1.107 0.200 2.630
107 2HG1 VAL 17 2HG1 VAL 17 0.727 -1.390 3.334
108 3HG1 VAL 17 3HG1 VAL 17 2.371 -1.049 2.741
109 1HG2 VAL 17 1HG2 VAL 17 -0.684 -0.821 -0.136
110 2HG2 VAL 17 2HG2 VAL 17 -1.133 -2.039 1.080
111 3HG2 VAL 17 3HG2 VAL 17 -0.926 -0.337 1.559
112 H LYS 18 H LYS 18 3.075 -2.924 -0.579
113 HA LYS 18 HA LYS 18 5.345 -2.590 1.026
114 2HB LYS 18 2HB LYS 18 4.316 -4.490 -0.922
115 2HG LYS 18 2HG LYS 18 6.799 -5.385 -1.202
116 2HD LYS 18 2HD LYS 18 6.929 -3.621 -3.274
117 2HE LYS 18 2HE LYS 18 5.178 -5.167 -4.417
118 1HZ LYS 18 1HZ LYS 18 7.408 -6.419 -2.970
119 2HZ LYS 18 2HZ LYS 18 6.690 -6.996 -4.319
120 3HZ LYS 18 3HZ LYS 18 7.552 -5.610 -4.381
121 H LYS 19 H LYS 19 4.511 -1.567 -2.298
122 HA LYS 19 HA LYS 19 7.120 -0.867 -3.058
123 2HB LYS 19 2HB LYS 19 4.391 -0.585 -4.088
124 2HG LYS 19 2HG LYS 19 5.305 1.211 -5.763
125 2HD LYS 19 2HD LYS 19 4.848 2.996 -3.695
126 2HE LYS 19 2HE LYS 19 2.764 1.303 -5.159
127 1HZ LYS 19 1HZ LYS 19 2.002 3.910 -4.725
128 2HZ LYS 19 2HZ LYS 19 1.344 2.563 -4.079
129 3HZ LYS 19 3HZ LYS 19 2.533 3.353 -3.285
130 H LEU 20 H LEU 20 4.802 0.564 -0.868
131 HA LEU 20 HA LEU 20 6.100 3.157 -1.016
132 2HB LEU 20 2HB LEU 20 3.521 2.401 -0.604
133 HG LEU 20 HG LEU 20 4.143 1.727 1.792
134 1HD1 LEU 20 1HD1 LEU 20 5.344 3.162 2.985
135 2HD1 LEU 20 2HD1 LEU 20 5.151 4.438 1.759
136 3HD1 LEU 20 3HD1 LEU 20 3.922 4.230 3.030
137 1HD2 LEU 20 1HD2 LEU 20 1.885 3.083 0.700
138 2HD2 LEU 20 2HD2 LEU 20 1.949 1.914 2.041
139 3HD2 LEU 20 3HD2 LEU 20 2.127 3.654 2.367
140 H PHE 21 H PHE 21 6.368 0.130 0.643
141 HA PHE 21 HA PHE 21 7.447 1.245 3.052
142 2HB PHE 21 2HB PHE 21 8.185 -1.501 2.677
143 HD1 PHE 21 1HD PHE 21 8.334 -1.196 5.096
144 HD2 PHE 21 2HD PHE 21 4.612 -0.889 3.080
145 HE1 PHE 21 1HE PHE 21 7.129 -1.398 7.289
146 HE2 PHE 21 2HE PHE 21 3.408 -1.091 5.272
147 HZ PHE 21 HZ PHE 21 4.680 -1.343 7.351
148 H LYS 22 H LYS 22 8.614 0.508 -0.147
149 HA LYS 22 HA LYS 22 11.161 -0.350 0.251
150 2HB LYS 22 2HB LYS 22 9.759 0.293 -1.901
151 2HG LYS 22 2HG LYS 22 10.810 2.283 -3.006
152 2HD LYS 22 2HD LYS 22 9.804 3.682 -0.648
153 2HE LYS 22 2HE LYS 22 7.850 4.064 -2.288
154 1HZ LYS 22 1HZ LYS 22 10.561 4.864 -2.521
155 2HZ LYS 22 2HZ LYS 22 9.771 4.960 -3.946
156 3HZ LYS 22 3HZ LYS 22 9.201 5.760 -2.642
157 H LYS 23 H LYS 23 9.728 2.736 1.140
158 HA LYS 23 HA LYS 23 12.382 3.852 1.628
159 2HB LYS 23 2HB LYS 23 10.978 5.342 0.428
160 2HG LYS 23 2HG LYS 23 8.880 4.186 2.127
161 2HD LYS 23 2HD LYS 23 9.409 6.732 2.953
162 2HE LYS 23 2HE LYS 23 8.854 7.381 0.432
163 1HZ LYS 23 1HZ LYS 23 6.174 7.330 1.624
164 2HZ LYS 23 2HZ LYS 23 6.577 7.740 0.096
165 3HZ LYS 23 3HZ LYS 23 6.700 6.187 0.584
166 H TRP 24 H TRP 24 9.467 2.568 3.208
167 HA TRP 24 HA TRP 24 10.052 3.543 5.785
168 2HB TRP 24 2HB TRP 24 8.478 1.719 6.497
169 HD1 TRP 24 HD TRP 24 8.494 4.733 4.276
170 HE1 TRP 24 1HE TRP 24 6.161 5.962 4.197
171 HE3 TRP 24 3HE TRP 24 5.861 1.001 6.510
172 HZ2 TRP 24 2HZ TRP 24 3.534 5.251 5.058
173 HZ3 TRP 24 3HZ TRP 24 3.416 1.348 6.853
174 HH2 TRP 24 HH TRP 24 2.252 3.385 6.167
175 H GLY 25 H GLY 25 11.036 2.409 7.580
176 1HA GLY 25 1HA GLY 25 12.046 0.341 8.361
177 2HA GLY 25 2HA GLY 25 12.741 0.131 6.766
178 H TRP 26 H TRP 26 12.709 2.341 9.626
179 HA TRP 26 HA TRP 26 15.563 2.691 9.309
180 2HB TRP 26 2HB TRP 26 14.386 5.291 9.748
181 HD1 TRP 26 HD TRP 26 16.296 3.319 6.946
182 HE1 TRP 26 1HE TRP 26 18.495 4.605 6.259
183 HE3 TRP 26 3HE TRP 26 15.604 7.252 10.093
184 HZ2 TRP 26 2HZ TRP 26 19.672 7.068 7.091
185 HZ3 TRP 26 3HZ TRP 26 17.325 9.055 10.093
186 HH2 TRP 26 HH TRP 26 19.306 9.007 8.660
Start of MODEL 3
1 1H LYS 1 H LYS 1 -7.577 16.251 8.426
2 HA LYS 1 HA LYS 1 -9.499 16.708 6.890
3 2HB LYS 1 2HB LYS 1 -8.106 19.401 6.802
4 2HG LYS 1 2HG LYS 1 -10.563 18.412 5.282
5 2HD LYS 1 2HD LYS 1 -10.281 20.919 5.898
6 2HE LYS 1 2HE LYS 1 -7.697 20.453 4.830
7 1HZ LYS 1 1HZ LYS 1 -8.456 20.713 2.646
8 2HZ LYS 1 2HZ LYS 1 -9.425 21.974 3.015
9 3HZ LYS 1 3HZ LYS 1 -7.802 22.156 3.042
10 H SER 2 H SER 2 -7.872 14.839 6.573
11 HA SER 2 HA SER 2 -6.893 15.037 4.008
12 2HB SER 2 2HB SER 2 -4.778 15.308 6.182
13 HG SER 2 HG SER 2 -3.238 14.718 4.724
14 H SER 3 H SER 3 -7.651 12.986 3.552
15 HA SER 3 HA SER 3 -6.387 10.835 5.005
16 2HB SER 3 2HB SER 3 -8.456 11.015 6.222
17 HG SER 3 HG SER 3 -10.085 10.654 3.919
18 H ALA 4 H ALA 4 -5.931 9.054 3.663
19 HA ALA 4 HA ALA 4 -7.343 8.470 1.321
20 1HB ALA 4 1HB ALA 4 -5.042 10.380 1.091
21 2HB ALA 4 2HB ALA 4 -5.208 9.116 -0.152
22 3HB ALA 4 3HB ALA 4 -6.534 10.270 0.126
23 H TYR 5 H TYR 5 -7.187 6.385 2.273
24 HA TYR 5 HA TYR 5 -4.457 5.317 2.445
25 2HB TYR 5 2HB TYR 5 -6.000 3.463 3.643
26 HD1 TYR 5 1HD TYR 5 -5.875 7.152 4.365
27 HD2 TYR 5 2HD TYR 5 -5.105 3.182 5.759
28 HE1 TYR 5 1HE TYR 5 -4.889 8.090 6.512
29 HE2 TYR 5 2HE TYR 5 -4.121 4.133 7.902
30 HH TYR 5 HH TYR 5 -4.135 7.630 8.495
31 H SER 6 H SER 6 -5.016 5.521 -0.137
32 HA SER 6 HA SER 6 -5.288 4.449 -2.003
33 2HB SER 6 2HB SER 6 -4.997 1.928 -1.992
34 HG SER 6 HG SER 6 -3.114 3.215 -0.219
35 H LEU 7 H LEU 7 -6.743 2.622 -3.181
36 HA LEU 7 HA LEU 7 -9.430 3.041 -2.117
37 2HB LEU 7 2HB LEU 7 -9.359 3.838 -4.271
38 HG LEU 7 HG LEU 7 -7.378 1.719 -4.817
39 1HD1 LEU 7 1HD1 LEU 7 -9.535 1.138 -6.158
40 2HD1 LEU 7 2HD1 LEU 7 -9.070 2.532 -7.161
41 3HD1 LEU 7 3HD1 LEU 7 -7.957 1.154 -6.980
42 1HD2 LEU 7 1HD2 LEU 7 -7.930 4.430 -6.056
43 2HD2 LEU 7 2HD2 LEU 7 -6.779 4.080 -4.744
44 3HD2 LEU 7 3HD2 LEU 7 -6.508 3.407 -6.369
45 H GLN 8 H GLN 8 -7.180 0.481 -3.312
46 HA GLN 8 HA GLN 8 -7.097 -1.656 -2.943
47 2HB GLN 8 2HB GLN 8 -8.835 -2.258 -0.802
48 2HG GLN 8 2HG GLN 8 -6.331 -2.805 -1.209
49 1HE2 GLN 8 1HE2 GLN 8 -5.282 -1.506 1.467
50 2HE2 GLN 8 2HE2 GLN 8 -4.386 -0.129 0.919
51 H MET 9 H MET 9 -7.980 -3.047 -4.405
52 HA MET 9 HA MET 9 -10.895 -3.053 -4.562
53 2HB MET 9 2HB MET 9 -9.630 -2.175 -6.594
54 2HG MET 9 2HG MET 9 -7.787 -4.097 -6.120
55 1HE MET 9 1HE MET 9 -7.199 -6.476 -8.806
56 2HE MET 9 2HE MET 9 -8.583 -6.009 -9.822
57 3HE MET 9 3HE MET 9 -7.505 -4.759 -9.157
58 H GLY 10 H GLY 10 -7.898 -4.935 -4.297
59 1HA GLY 10 1HA GLY 10 -9.434 -7.448 -4.385
60 2HA GLY 10 2HA GLY 10 -7.702 -7.277 -4.587
61 H ALA 11 H ALA 11 -6.375 -7.564 -2.823
62 HA ALA 11 HA ALA 11 -7.069 -6.816 -0.221
63 1HB ALA 11 1HB ALA 11 -6.957 -9.691 0.038
64 2HB ALA 11 2HB ALA 11 -8.225 -8.566 0.582
65 3HB ALA 11 3HB ALA 11 -8.285 -9.247 -1.061
66 H THR 12 H THR 12 -5.466 -9.776 -1.595
67 HA THR 12 HA THR 12 -3.234 -9.807 -0.108
68 HB THR 12 HB THR 12 -2.192 -10.921 -2.098
69 HG1 THR 12 1HG THR 12 -2.859 -9.732 -3.878
70 1HG2 THR 12 1HG2 THR 12 -4.675 -11.664 -0.920
71 2HG2 THR 12 2HG2 THR 12 -4.923 -11.806 -2.677
72 3HG2 THR 12 3HG2 THR 12 -3.606 -12.707 -1.887
73 H ALA 13 H ALA 13 -3.654 -7.782 -3.080
74 HA ALA 13 HA ALA 13 -1.230 -6.677 -3.305
75 1HB ALA 13 1HB ALA 13 -2.730 -5.883 -4.860
76 2HB ALA 13 2HB ALA 13 -4.030 -5.677 -3.662
77 3HB ALA 13 3HB ALA 13 -2.710 -4.486 -3.758
78 H ILE 14 H ILE 14 -3.725 -5.839 -0.837
79 HA ILE 14 HA ILE 14 -2.642 -3.638 0.285
80 HB ILE 14 HB ILE 14 -3.922 -6.014 1.639
81 2HG1 ILE 14 2HG1 ILE 14 -5.327 -5.045 -0.082
82 1HG2 ILE 14 1HG2 ILE 14 -2.957 -4.928 3.437
83 2HG2 ILE 14 2HG2 ILE 14 -3.115 -3.320 2.692
84 3HG2 ILE 14 3HG2 ILE 14 -4.553 -4.146 3.337
85 1HD1 ILE 14 1HD1 ILE 14 -6.031 -5.322 2.596
86 2HD1 ILE 14 2HD1 ILE 14 -6.583 -3.674 2.214
87 3HD1 ILE 14 3HD1 ILE 14 -7.171 -5.053 1.255
88 H LYS 15 H LYS 15 -1.650 -7.068 0.878
89 HA LYS 15 HA LYS 15 0.278 -6.479 2.795
90 2HB LYS 15 2HB LYS 15 -0.801 -8.734 1.951
91 2HG LYS 15 2HG LYS 15 0.423 -8.468 -0.315
92 2HD LYS 15 2HD LYS 15 2.696 -8.587 1.578
93 2HE LYS 15 2HE LYS 15 4.086 -9.944 -0.084
94 1HZ LYS 15 1HZ LYS 15 2.516 -10.793 1.962
95 2HZ LYS 15 2HZ LYS 15 2.224 -11.878 0.775
96 3HZ LYS 15 3HZ LYS 15 3.753 -11.619 1.288
97 H GLN 16 H GLN 16 0.390 -6.537 -0.799
98 HA GLN 16 HA GLN 16 3.100 -6.353 -1.090
99 2HB GLN 16 2HB GLN 16 2.603 -5.373 -3.314
100 2HG GLN 16 2HG GLN 16 0.461 -7.404 -2.534
101 1HE2 GLN 16 1HE2 GLN 16 2.470 -8.652 -4.730
102 2HE2 GLN 16 2HE2 GLN 16 1.703 -8.212 -6.219
103 H VAL 17 H VAL 17 0.768 -3.965 0.042
104 HA VAL 17 HA VAL 17 2.026 -1.606 -0.564
105 HB VAL 17 HB VAL 17 0.559 -2.378 1.967
106 1HG1 VAL 17 1HG1 VAL 17 1.255 -0.318 2.599
107 2HG1 VAL 17 2HG1 VAL 17 1.609 0.194 0.931
108 3HG1 VAL 17 3HG1 VAL 17 -0.064 0.229 1.537
109 1HG2 VAL 17 1HG2 VAL 17 -0.835 -0.887 -0.181
110 2HG2 VAL 17 2HG2 VAL 17 -0.425 -2.576 -0.561
111 3HG2 VAL 17 3HG2 VAL 17 -1.413 -2.201 0.871
112 H LYS 18 H LYS 18 2.683 -3.933 2.114
113 HA LYS 18 HA LYS 18 4.600 -2.338 3.388
114 2HB LYS 18 2HB LYS 18 3.509 -5.023 3.608
115 2HG LYS 18 2HG LYS 18 5.679 -5.699 4.969
116 2HD LYS 18 2HD LYS 18 6.662 -6.476 2.552
117 2HE LYS 18 2HE LYS 18 4.074 -7.496 3.820
118 1HZ LYS 18 1HZ LYS 18 5.998 -9.085 2.316
119 2HZ LYS 18 2HZ LYS 18 4.424 -9.395 2.623
120 3HZ LYS 18 3HZ LYS 18 4.834 -8.265 1.517
121 H LYS 19 H LYS 19 4.717 -4.566 0.602
122 HA LYS 19 HA LYS 19 7.517 -4.783 0.514
123 2HB LYS 19 2HB LYS 19 5.209 -5.526 -1.145
124 2HG LYS 19 2HG LYS 19 6.925 -5.995 -3.082
125 2HD LYS 19 2HD LYS 19 6.581 -3.313 -3.666
126 2HE LYS 19 2HE LYS 19 4.248 -4.075 -4.497
127 1HZ LYS 19 1HZ LYS 19 5.868 -4.324 -6.053
128 2HZ LYS 19 2HZ LYS 19 6.781 -5.339 -5.157
129 3HZ LYS 19 3HZ LYS 19 5.422 -5.885 -5.878
130 H LEU 20 H LEU 20 5.269 -2.223 -0.292
131 HA LEU 20 HA LEU 20 7.221 -0.906 -1.992
132 2HB LEU 20 2HB LEU 20 4.499 -1.043 -2.049
133 HG LEU 20 HG LEU 20 4.431 0.650 -0.120
134 1HD1 LEU 20 1HD1 LEU 20 6.132 2.072 -1.958
135 2HD1 LEU 20 2HD1 LEU 20 4.650 3.008 -1.642
136 3HD1 LEU 20 3HD1 LEU 20 5.674 2.478 -0.286
137 1HD2 LEU 20 1HD2 LEU 20 2.946 2.074 -2.119
138 2HD2 LEU 20 2HD2 LEU 20 2.860 0.328 -2.451
139 3HD2 LEU 20 3HD2 LEU 20 2.365 0.957 -0.861
140 H PHE 21 H PHE 21 6.392 -1.193 1.335
141 HA PHE 21 HA PHE 21 7.129 1.481 2.050
142 2HB PHE 21 2HB PHE 21 7.299 -0.335 4.263
143 HD1 PHE 21 1HD PHE 21 4.014 0.254 2.716
144 HD2 PHE 21 2HD PHE 21 6.896 1.689 5.480
145 HE1 PHE 21 1HE PHE 21 2.324 1.861 3.643
146 HE2 PHE 21 2HE PHE 21 5.205 3.296 6.408
147 HZ PHE 21 HZ PHE 21 2.939 3.364 5.477
148 H LYS 22 H LYS 22 8.790 -1.495 1.323
149 HA LYS 22 HA LYS 22 10.950 -1.374 3.030
150 2HB LYS 22 2HB LYS 22 10.146 -3.028 1.048
151 2HG LYS 22 2HG LYS 22 12.269 -2.998 -0.497
152 2HD LYS 22 2HD LYS 22 9.786 -1.309 -0.680
153 2HE LYS 22 2HE LYS 22 12.128 -0.319 -1.819
154 1HZ LYS 22 1HZ LYS 22 12.415 -1.227 -3.792
155 2HZ LYS 22 2HZ LYS 22 11.409 -2.440 -3.361
156 3HZ LYS 22 3HZ LYS 22 10.829 -1.149 -4.175
157 H LYS 23 H LYS 23 9.966 0.822 0.521
158 HA LYS 23 HA LYS 23 12.661 1.921 0.326
159 2HB LYS 23 2HB LYS 23 11.611 1.588 -1.790
160 2HG LYS 23 2HG LYS 23 9.219 2.616 -0.353
161 2HD LYS 23 2HD LYS 23 8.204 3.647 -2.323
162 2HE LYS 23 2HE LYS 23 10.375 4.795 -0.895
163 1HZ LYS 23 1HZ LYS 23 10.710 4.914 -3.753
164 2HZ LYS 23 2HZ LYS 23 10.877 6.330 -2.957
165 3HZ LYS 23 3HZ LYS 23 11.823 5.058 -2.566
166 H TRP 24 H TRP 24 9.387 2.555 1.596
167 HA TRP 24 HA TRP 24 9.818 5.270 2.199
168 2HB TRP 24 2HB TRP 24 7.881 4.908 3.765
169 HD1 TRP 24 HD TRP 24 8.706 4.946 0.195
170 HE1 TRP 24 1HE TRP 24 6.635 5.365 -1.385
171 HE3 TRP 24 3HE TRP 24 5.162 4.026 3.723
172 HZ2 TRP 24 2HZ TRP 24 3.810 5.266 -0.993
173 HZ3 TRP 24 3HZ TRP 24 2.770 4.209 3.041
174 HH2 TRP 24 HH TRP 24 2.073 4.805 0.776
175 H GLY 25 H GLY 25 10.258 6.220 4.327
176 1HA GLY 25 1HA GLY 25 10.785 5.162 6.694
177 2HA GLY 25 2HA GLY 25 12.205 4.634 5.814
178 H TRP 26 H TRP 26 13.233 6.072 7.573
179 HA TRP 26 HA TRP 26 13.498 8.763 6.447
180 2HB TRP 26 2HB TRP 26 13.129 8.119 9.378
181 HD1 TRP 26 HD TRP 26 15.775 9.729 8.745
182 HE1 TRP 26 1HE TRP 26 16.115 12.267 9.385
183 HE3 TRP 26 3HE TRP 26 10.826 10.860 9.049
184 HZ2 TRP 26 2HZ TRP 26 14.317 14.414 9.934
185 HZ3 TRP 26 3HZ TRP 26 10.205 13.201 9.643
186 HH2 TRP 26 HH TRP 26 11.858 14.948 10.078
Start of MODEL 4
1 1H LYS 1 H LYS 1 -6.875 9.005 11.777
2 HA LYS 1 HA LYS 1 -8.982 8.550 11.147
3 2HB LYS 1 2HB LYS 1 -8.970 8.570 8.298
4 2HG LYS 1 2HG LYS 1 -10.609 9.402 10.322
5 2HD LYS 1 2HD LYS 1 -10.028 12.044 9.056
6 2HE LYS 1 2HE LYS 1 -11.819 11.440 10.854
7 1HZ LYS 1 1HZ LYS 1 -10.044 12.024 12.933
8 2HZ LYS 1 2HZ LYS 1 -11.063 10.758 12.788
9 3HZ LYS 1 3HZ LYS 1 -9.550 10.661 12.181
10 H SER 2 H SER 2 -6.869 7.370 8.432
11 HA SER 2 HA SER 2 -6.286 5.365 7.829
12 2HB SER 2 2HB SER 2 -7.083 3.574 9.894
13 HG SER 2 HG SER 2 -4.576 4.595 10.322
14 H SER 3 H SER 3 -7.454 4.389 6.218
15 HA SER 3 HA SER 3 -9.630 2.774 6.752
16 2HB SER 3 2HB SER 3 -11.163 4.453 5.204
17 HG SER 3 HG SER 3 -11.029 4.637 8.090
18 H ALA 4 H ALA 4 -10.870 2.361 4.448
19 HA ALA 4 HA ALA 4 -8.984 1.368 2.721
20 1HB ALA 4 1HB ALA 4 -11.302 0.628 2.750
21 2HB ALA 4 2HB ALA 4 -11.860 2.236 2.229
22 3HB ALA 4 3HB ALA 4 -10.907 1.222 1.119
23 H TYR 5 H TYR 5 -8.882 2.056 0.263
24 HA TYR 5 HA TYR 5 -8.122 4.882 0.288
25 2HB TYR 5 2HB TYR 5 -7.075 3.904 -1.983
26 HD1 TYR 5 1HD TYR 5 -6.335 1.507 0.721
27 HD2 TYR 5 2HD TYR 5 -5.241 5.223 -1.095
28 HE1 TYR 5 1HE TYR 5 -4.150 1.508 2.022
29 HE2 TYR 5 2HE TYR 5 -3.060 5.211 0.212
30 HH TYR 5 HH TYR 5 -2.121 2.422 2.128
31 H SER 6 H SER 6 -10.690 2.852 -0.661
32 HA SER 6 HA SER 6 -12.229 4.707 -1.733
33 2HB SER 6 2HB SER 6 -11.838 3.870 -4.327
34 HG SER 6 HG SER 6 -10.985 6.139 -2.828
35 H LEU 7 H LEU 7 -10.959 1.408 -1.887
36 HA LEU 7 HA LEU 7 -13.575 0.341 -1.583
37 2HB LEU 7 2HB LEU 7 -12.406 0.484 -4.259
38 HG LEU 7 HG LEU 7 -11.948 -1.925 -3.779
39 1HD1 LEU 7 1HD1 LEU 7 -14.910 -2.403 -3.659
40 2HD1 LEU 7 2HD1 LEU 7 -13.565 -3.452 -3.153
41 3HD1 LEU 7 3HD1 LEU 7 -14.000 -2.029 -2.176
42 1HD2 LEU 7 1HD2 LEU 7 -14.225 -1.893 -5.710
43 2HD2 LEU 7 2HD2 LEU 7 -12.830 -0.834 -6.023
44 3HD2 LEU 7 3HD2 LEU 7 -12.595 -2.590 -5.865
45 H GLN 8 H GLN 8 -10.314 -0.629 -2.876
46 HA GLN 8 HA GLN 8 -8.750 -1.829 -1.880
47 2HB GLN 8 2HB GLN 8 -10.223 -1.218 0.359
48 2HG GLN 8 2HG GLN 8 -9.965 -4.256 0.336
49 1HE2 GLN 8 1HE2 GLN 8 -12.273 -4.609 1.817
50 2HE2 GLN 8 2HE2 GLN 8 -12.064 -3.977 3.417
51 H MET 9 H MET 9 -8.114 -3.931 -2.428
52 HA MET 9 HA MET 9 -10.334 -5.726 -3.045
53 2HB MET 9 2HB MET 9 -7.816 -4.958 -4.538
54 2HG MET 9 2HG MET 9 -8.840 -7.743 -4.232
55 1HE MET 9 1HE MET 9 -11.096 -7.056 -6.357
56 2HE MET 9 2HE MET 9 -10.672 -8.546 -7.235
57 3HE MET 9 3HE MET 9 -10.498 -8.474 -5.464
58 H GLY 10 H GLY 10 -6.829 -5.508 -2.146
59 1HA GLY 10 1HA GLY 10 -6.195 -6.753 -0.147
60 2HA GLY 10 2HA GLY 10 -7.147 -8.096 -0.746
61 H ALA 11 H ALA 11 -4.760 -5.854 -2.333
62 HA ALA 11 HA ALA 11 -2.735 -7.780 -2.519
63 1HB ALA 11 1HB ALA 11 -4.840 -8.266 -4.308
64 2HB ALA 11 2HB ALA 11 -3.609 -7.430 -5.285
65 3HB ALA 11 3HB ALA 11 -3.187 -8.920 -4.409
66 H THR 12 H THR 12 -4.344 -5.109 -4.388
67 HA THR 12 HA THR 12 -1.932 -3.933 -5.221
68 HB THR 12 HB THR 12 -4.705 -2.695 -4.809
69 HG1 THR 12 1HG THR 12 -5.057 -3.646 -6.885
70 1HG2 THR 12 1HG2 THR 12 -2.447 -1.362 -5.590
71 2HG2 THR 12 2HG2 THR 12 -2.921 -2.083 -7.147
72 3HG2 THR 12 3HG2 THR 12 -4.051 -1.015 -6.279
73 H ALA 13 H ALA 13 -4.073 -3.276 -2.385
74 HA ALA 13 HA ALA 13 -2.946 -1.062 -1.376
75 1HB ALA 13 1HB ALA 13 -4.626 -1.797 -0.019
76 2HB ALA 13 2HB ALA 13 -4.207 -3.511 -0.255
77 3HB ALA 13 3HB ALA 13 -3.284 -2.520 0.900
78 H ILE 14 H ILE 14 -1.667 -4.435 -1.012
79 HA ILE 14 HA ILE 14 0.422 -4.017 0.626
80 HB ILE 14 HB ILE 14 0.259 -5.717 -1.859
81 2HG1 ILE 14 2HG1 ILE 14 -1.308 -5.939 0.267
82 1HG2 ILE 14 1HG2 ILE 14 2.417 -6.184 -1.646
83 2HG2 ILE 14 2HG2 ILE 14 2.546 -5.154 -0.201
84 3HG2 ILE 14 3HG2 ILE 14 2.072 -6.861 -0.036
85 1HD1 ILE 14 1HD1 ILE 14 -0.575 -7.593 -1.824
86 2HD1 ILE 14 2HD1 ILE 14 -0.130 -8.576 -0.409
87 3HD1 ILE 14 3HD1 ILE 14 -1.802 -7.995 -0.599
88 H LYS 15 H LYS 15 0.367 -3.367 -2.938
89 HA LYS 15 HA LYS 15 2.924 -2.607 -3.333
90 2HB LYS 15 2HB LYS 15 0.410 -1.332 -4.451
91 2HG LYS 15 2HG LYS 15 2.074 -0.988 -6.438
92 2HD LYS 15 2HD LYS 15 2.963 0.852 -4.284
93 2HE LYS 15 2HE LYS 15 2.460 0.953 -7.055
94 1HZ LYS 15 1HZ LYS 15 0.750 2.991 -6.015
95 2HZ LYS 15 2HZ LYS 15 0.592 2.088 -7.367
96 3HZ LYS 15 3HZ LYS 15 0.114 1.489 -5.925
97 H GLN 16 H GLN 16 0.257 -0.510 -2.046
98 HA GLN 16 HA GLN 16 1.732 1.764 -1.782
99 2HB GLN 16 2HB GLN 16 0.017 1.837 0.412
100 2HG GLN 16 2HG GLN 16 0.243 3.114 -2.015
101 1HE2 GLN 16 1HE2 GLN 16 -3.086 2.815 -1.365
102 2HE2 GLN 16 2HE2 GLN 16 -3.593 2.025 -2.822
103 H VAL 17 H VAL 17 1.432 -1.049 0.451
104 HA VAL 17 HA VAL 17 2.725 0.002 2.640
105 HB VAL 17 HB VAL 17 2.803 -2.815 1.540
106 1HG1 VAL 17 1HG1 VAL 17 3.419 -3.576 3.686
107 2HG1 VAL 17 2HG1 VAL 17 4.480 -2.181 3.374
108 3HG1 VAL 17 3HG1 VAL 17 3.066 -2.003 4.440
109 1HG2 VAL 17 1HG2 VAL 17 0.956 -2.043 3.742
110 2HG2 VAL 17 2HG2 VAL 17 0.550 -1.460 2.111
111 3HG2 VAL 17 3HG2 VAL 17 0.737 -3.204 2.411
112 H LYS 18 H LYS 18 4.035 -1.303 -0.433
113 HA LYS 18 HA LYS 18 6.706 -1.421 0.397
114 2HB LYS 18 2HB LYS 18 5.173 -1.720 -2.063
115 2HG LYS 18 2HG LYS 18 7.456 -1.377 -3.376
116 2HD LYS 18 2HD LYS 18 6.710 1.238 -3.476
117 2HE LYS 18 2HE LYS 18 4.812 0.444 -5.031
118 1HZ LYS 18 1HZ LYS 18 6.913 0.735 -5.970
119 2HZ LYS 18 2HZ LYS 18 7.544 -0.593 -5.257
120 3HZ LYS 18 3HZ LYS 18 6.451 -0.753 -6.460
121 H LYS 19 H LYS 19 4.632 1.214 -0.852
122 HA LYS 19 HA LYS 19 6.724 3.023 -1.337
123 2HB LYS 19 2HB LYS 19 3.802 3.016 -1.323
124 2HG LYS 19 2HG LYS 19 3.866 5.634 -1.225
125 2HD LYS 19 2HD LYS 19 3.989 5.266 1.517
126 2HE LYS 19 2HE LYS 19 1.711 4.455 -0.353
127 1HZ LYS 19 1HZ LYS 19 1.936 4.825 2.499
128 2HZ LYS 19 2HZ LYS 19 0.608 5.459 1.790
129 3HZ LYS 19 3HZ LYS 19 0.926 3.864 1.650
130 H LEU 20 H LEU 20 5.228 1.808 1.581
131 HA LEU 20 HA LEU 20 6.179 4.072 3.132
132 2HB LEU 20 2HB LEU 20 3.966 2.506 3.328
133 HG LEU 20 HG LEU 20 5.433 0.635 4.301
134 1HD1 LEU 20 1HD1 LEU 20 6.117 2.807 6.097
135 2HD1 LEU 20 2HD1 LEU 20 5.458 1.411 6.982
136 3HD1 LEU 20 3HD1 LEU 20 6.860 1.201 5.907
137 1HD2 LEU 20 1HD2 LEU 20 2.839 1.625 5.018
138 2HD2 LEU 20 2HD2 LEU 20 3.428 -0.053 4.948
139 3HD2 LEU 20 3HD2 LEU 20 3.605 0.891 6.446
140 H PHE 21 H PHE 21 7.271 1.024 1.942
141 HA PHE 21 HA PHE 21 8.959 0.390 4.145
142 2HB PHE 21 2HB PHE 21 9.877 -0.719 1.641
143 HD1 PHE 21 1HD PHE 21 10.899 -2.356 3.030
144 HD2 PHE 21 2HD PHE 21 6.693 -1.806 3.159
145 HE1 PHE 21 1HE PHE 21 10.661 -4.477 4.350
146 HE2 PHE 21 2HE PHE 21 6.456 -3.926 4.479
147 HZ PHE 21 HZ PHE 21 8.442 -5.237 5.059
148 H LYS 22 H LYS 22 9.093 2.665 1.521
149 HA LYS 22 HA LYS 22 11.701 2.738 0.792
150 2HB LYS 22 2HB LYS 22 9.594 4.240 0.223
151 2HG LYS 22 2HG LYS 22 10.389 6.629 1.085
152 2HD LYS 22 2HD LYS 22 8.686 4.586 2.546
153 2HE LYS 22 2HE LYS 22 9.778 6.319 4.157
154 1HZ LYS 22 1HZ LYS 22 9.445 8.167 2.585
155 2HZ LYS 22 2HZ LYS 22 7.832 8.063 2.819
156 3HZ LYS 22 3HZ LYS 22 8.814 8.456 4.064
157 H LYS 23 H LYS 23 10.308 3.409 3.955
158 HA LYS 23 HA LYS 23 12.815 4.602 4.845
159 2HB LYS 23 2HB LYS 23 11.025 5.872 5.619
160 2HG LYS 23 2HG LYS 23 9.635 3.227 5.764
161 2HD LYS 23 2HD LYS 23 9.743 4.775 8.114
162 2HE LYS 23 2HE LYS 23 7.132 5.330 8.115
163 1HZ LYS 23 1HZ LYS 23 8.163 7.486 6.802
164 2HZ LYS 23 2HZ LYS 23 8.116 7.261 8.418
165 3HZ LYS 23 3HZ LYS 23 9.445 6.830 7.572
166 H TRP 24 H TRP 24 10.737 1.704 5.199
167 HA TRP 24 HA TRP 24 12.171 0.559 7.320
168 2HB TRP 24 2HB TRP 24 11.074 -1.541 6.584
169 HD1 TRP 24 HD TRP 24 10.057 1.919 7.543
170 HE1 TRP 24 1HE TRP 24 7.706 2.012 8.739
171 HE3 TRP 24 3HE TRP 24 8.670 -2.822 6.338
172 HZ2 TRP 24 2HZ TRP 24 5.578 0.133 9.039
173 HZ3 TRP 24 3HZ TRP 24 6.440 -3.616 7.121
174 HH2 TRP 24 HH TRP 24 4.915 -2.222 8.427
175 H GLY 25 H GLY 25 12.177 -0.249 3.765
176 1HA GLY 25 1HA GLY 25 13.842 -0.914 2.405
177 2HA GLY 25 2HA GLY 25 14.993 -0.255 3.549
178 H TRP 26 H TRP 26 13.831 -3.103 2.107
179 HA TRP 26 HA TRP 26 14.609 -4.787 4.360
180 2HB TRP 26 2HB TRP 26 13.680 -5.953 1.795
181 HD1 TRP 26 HD TRP 26 13.601 -6.008 5.665
182 HE1 TRP 26 1HE TRP 26 12.956 -8.402 6.565
183 HE3 TRP 26 3HE TRP 26 12.503 -7.998 1.116
184 HZ2 TRP 26 2HZ TRP 26 12.077 -10.807 5.302
185 HZ3 TRP 26 3HZ TRP 26 11.759 -10.376 1.038
186 HH2 TRP 26 HH TRP 26 11.540 -11.769 3.034
Start of MODEL 5
1 1H LYS 1 H LYS 1 -10.569 15.956 5.855
2 HA LYS 1 HA LYS 1 -12.782 15.790 6.153
3 2HB LYS 1 2HB LYS 1 -13.255 17.144 4.203
4 2HG LYS 1 2HG LYS 1 -12.253 14.750 2.786
5 2HD LYS 1 2HD LYS 1 -14.831 16.112 1.877
6 2HE LYS 1 2HE LYS 1 -14.106 14.036 0.092
7 1HZ LYS 1 1HZ LYS 1 -14.641 15.653 -1.292
8 2HZ LYS 1 2HZ LYS 1 -14.877 16.629 -0.004
9 3HZ LYS 1 3HZ LYS 1 -13.442 16.640 -0.784
10 H SER 2 H SER 2 -11.497 13.778 6.966
11 HA SER 2 HA SER 2 -11.202 11.605 7.083
12 2HB SER 2 2HB SER 2 -13.369 11.697 8.090
13 HG SER 2 HG SER 2 -14.498 12.921 6.473
14 H SER 3 H SER 3 -9.789 11.417 5.176
15 HA SER 3 HA SER 3 -11.187 10.207 2.919
16 2HB SER 3 2HB SER 3 -8.822 10.845 1.807
17 HG SER 3 HG SER 3 -9.864 13.117 1.518
18 H ALA 4 H ALA 4 -11.009 7.995 3.083
19 HA ALA 4 HA ALA 4 -8.380 6.854 3.235
20 1HB ALA 4 1HB ALA 4 -10.269 5.800 5.310
21 2HB ALA 4 2HB ALA 4 -8.489 5.848 5.304
22 3HB ALA 4 3HB ALA 4 -9.418 7.324 5.662
23 H TYR 5 H TYR 5 -11.855 5.937 3.831
24 HA TYR 5 HA TYR 5 -13.005 4.188 3.021
25 2HB TYR 5 2HB TYR 5 -13.353 4.530 0.568
26 HD1 TYR 5 1HD TYR 5 -12.208 7.477 -0.299
27 HD2 TYR 5 2HD TYR 5 -14.493 5.875 2.944
28 HE1 TYR 5 1HE TYR 5 -13.288 9.749 0.073
29 HE2 TYR 5 2HE TYR 5 -15.565 8.152 3.305
30 HH TYR 5 HH TYR 5 -14.625 10.700 2.687
31 H SER 6 H SER 6 -11.606 2.478 3.897
32 HA SER 6 HA SER 6 -10.477 0.634 3.740
33 2HB SER 6 2HB SER 6 -11.335 0.893 0.840
34 HG SER 6 HG SER 6 -10.170 -0.818 0.295
35 H LEU 7 H LEU 7 -8.376 -0.402 2.884
36 HA LEU 7 HA LEU 7 -6.600 1.725 1.907
37 2HB LEU 7 2HB LEU 7 -4.834 0.748 3.231
38 HG LEU 7 HG LEU 7 -7.308 1.128 4.941
39 1HD1 LEU 7 1HD1 LEU 7 -5.479 -0.127 6.070
40 2HD1 LEU 7 2HD1 LEU 7 -4.402 1.261 5.784
41 3HD1 LEU 7 3HD1 LEU 7 -5.840 1.449 6.816
42 1HD2 LEU 7 1HD2 LEU 7 -5.179 3.068 4.010
43 2HD2 LEU 7 2HD2 LEU 7 -6.925 3.109 3.663
44 3HD2 LEU 7 3HD2 LEU 7 -6.339 3.408 5.317
45 H GLN 8 H GLN 8 -6.807 -1.896 2.207
46 HA GLN 8 HA GLN 8 -6.348 -2.046 -0.627
47 2HB GLN 8 2HB GLN 8 -4.056 -2.026 0.293
48 2HG GLN 8 2HG GLN 8 -3.416 -4.147 1.651
49 1HE2 GLN 8 1HE2 GLN 8 -5.587 -3.686 3.921
50 2HE2 GLN 8 2HE2 GLN 8 -5.024 -2.254 4.716
51 H MET 9 H MET 9 -6.719 -4.308 -1.461
52 HA MET 9 HA MET 9 -7.755 -6.217 0.345
53 2HB MET 9 2HB MET 9 -10.058 -6.139 -1.036
54 2HG MET 9 2HG MET 9 -9.962 -3.839 0.862
55 1HE MET 9 1HE MET 9 -11.094 -6.635 2.985
56 2HE MET 9 2HE MET 9 -11.245 -4.877 3.216
57 3HE MET 9 3HE MET 9 -12.705 -5.883 3.067
58 H GLY 10 H GLY 10 -7.855 -5.026 -3.084
59 1HA GLY 10 1HA GLY 10 -8.214 -7.340 -4.456
60 2HA GLY 10 2HA GLY 10 -7.181 -6.030 -4.989
61 H ALA 11 H ALA 11 -4.904 -6.189 -4.816
62 HA ALA 11 HA ALA 11 -3.609 -8.109 -3.245
63 1HB ALA 11 1HB ALA 11 -4.193 -8.866 -6.126
64 2HB ALA 11 2HB ALA 11 -2.825 -9.551 -5.216
65 3HB ALA 11 3HB ALA 11 -4.492 -9.818 -4.652
66 H THR 12 H THR 12 -3.135 -7.060 -6.691
67 HA THR 12 HA THR 12 -0.523 -6.426 -6.588
68 HB THR 12 HB THR 12 -1.057 -4.870 -8.459
69 HG1 THR 12 1HG THR 12 -3.720 -5.292 -7.296
70 1HG2 THR 12 1HG2 THR 12 -1.640 -7.519 -8.542
71 2HG2 THR 12 2HG2 THR 12 -3.293 -6.877 -8.693
72 3HG2 THR 12 3HG2 THR 12 -2.052 -6.430 -9.888
73 H ALA 13 H ALA 13 -3.211 -4.243 -5.543
74 HA ALA 13 HA ALA 13 -1.885 -1.985 -4.999
75 1HB ALA 13 1HB ALA 13 -4.165 -3.452 -3.777
76 2HB ALA 13 2HB ALA 13 -3.456 -2.159 -2.782
77 3HB ALA 13 3HB ALA 13 -4.078 -1.791 -4.407
78 H ILE 14 H ILE 14 -1.918 -4.957 -2.930
79 HA ILE 14 HA ILE 14 -0.524 -4.056 -0.788
80 HB ILE 14 HB ILE 14 -0.352 -6.721 -2.194
81 2HG1 ILE 14 2HG1 ILE 14 -2.587 -5.704 -1.252
82 1HG2 ILE 14 1HG2 ILE 14 0.458 -7.623 -0.062
83 2HG2 ILE 14 2HG2 ILE 14 1.590 -6.434 -0.751
84 3HG2 ILE 14 3HG2 ILE 14 0.533 -5.975 0.607
85 1HD1 ILE 14 1HD1 ILE 14 -1.722 -8.243 -1.825
86 2HD1 ILE 14 2HD1 ILE 14 -2.123 -8.411 -0.100
87 3HD1 ILE 14 3HD1 ILE 14 -3.364 -7.862 -1.252
88 H LYS 15 H LYS 15 0.894 -5.372 -3.862
89 HA LYS 15 HA LYS 15 3.522 -5.153 -3.271
90 2HB LYS 15 2HB LYS 15 2.052 -4.628 -5.862
91 2HG LYS 15 2HG LYS 15 4.363 -5.195 -6.859
92 2HD LYS 15 2HD LYS 15 4.691 -2.580 -5.450
93 2HE LYS 15 2HE LYS 15 5.845 -3.470 -7.634
94 1HZ LYS 15 1HZ LYS 15 4.152 -2.383 -9.397
95 2HZ LYS 15 2HZ LYS 15 4.344 -3.987 -9.160
96 3HZ LYS 15 3HZ LYS 15 3.123 -3.193 -8.422
97 H GLN 16 H GLN 16 1.279 -2.513 -4.271
98 HA GLN 16 HA GLN 16 3.170 -0.552 -4.549
99 2HB GLN 16 2HB GLN 16 1.311 1.031 -4.243
100 2HG GLN 16 2HG GLN 16 0.147 -1.488 -5.497
101 1HE2 GLN 16 1HE2 GLN 16 -1.338 -1.061 -7.092
102 2HE2 GLN 16 2HE2 GLN 16 -2.099 0.480 -7.312
103 H VAL 17 H VAL 17 1.470 -1.759 -1.611
104 HA VAL 17 HA VAL 17 2.263 0.192 0.165
105 HB VAL 17 HB VAL 17 0.677 -1.844 0.372
106 1HG1 VAL 17 1HG1 VAL 17 2.624 -3.291 1.981
107 2HG1 VAL 17 2HG1 VAL 17 1.511 -3.888 0.727
108 3HG1 VAL 17 3HG1 VAL 17 3.101 -3.233 0.267
109 1HG2 VAL 17 1HG2 VAL 17 0.835 -1.761 2.831
110 2HG2 VAL 17 2HG2 VAL 17 2.424 -0.970 2.699
111 3HG2 VAL 17 3HG2 VAL 17 0.964 -0.140 2.105
112 H LYS 18 H LYS 18 4.062 -2.543 -1.253
113 HA LYS 18 HA LYS 18 6.207 -2.476 0.558
114 2HB LYS 18 2HB LYS 18 5.488 -3.828 -1.920
115 2HG LYS 18 2HG LYS 18 8.072 -4.374 -2.221
116 2HD LYS 18 2HD LYS 18 8.109 -2.104 -3.723
117 2HE LYS 18 2HE LYS 18 6.473 -3.475 -5.310
118 1HZ LYS 18 1HZ LYS 18 8.801 -3.485 -5.616
119 2HZ LYS 18 2HZ LYS 18 9.060 -4.461 -4.334
120 3HZ LYS 18 3HZ LYS 18 8.314 -5.043 -5.665
121 H LYS 19 H LYS 19 5.415 -0.657 -2.422
122 HA LYS 19 HA LYS 19 7.971 0.507 -2.691
123 2HB LYS 19 2HB LYS 19 5.364 0.644 -3.987
124 2HG LYS 19 2HG LYS 19 5.983 2.960 -4.992
125 2HD LYS 19 2HD LYS 19 5.104 4.003 -2.580
126 2HE LYS 19 2HE LYS 19 3.509 2.491 -4.704
127 1HZ LYS 19 1HZ LYS 19 2.731 3.928 -2.352
128 2HZ LYS 19 2HZ LYS 19 1.955 4.395 -3.712
129 3HZ LYS 19 3HZ LYS 19 1.894 2.835 -3.230
130 H LEU 20 H LEU 20 5.378 0.948 -0.440
131 HA LEU 20 HA LEU 20 6.148 3.685 0.139
132 2HB LEU 20 2HB LEU 20 3.762 2.353 0.204
133 HG LEU 20 HG LEU 20 4.470 1.297 2.425
134 1HD1 LEU 20 1HD1 LEU 20 5.287 2.579 4.037
135 2HD1 LEU 20 2HD1 LEU 20 5.062 4.025 3.024
136 3HD1 LEU 20 3HD1 LEU 20 3.753 3.481 4.100
137 1HD2 LEU 20 1HD2 LEU 20 2.078 2.872 3.079
138 2HD2 LEU 20 2HD2 LEU 20 2.041 2.120 1.465
139 3HD2 LEU 20 3HD2 LEU 20 2.294 1.112 2.911
140 H PHE 21 H PHE 21 7.006 0.451 0.999
141 HA PHE 21 HA PHE 21 7.692 0.933 3.698
142 2HB PHE 21 2HB PHE 21 9.294 -1.084 2.253
143 HD1 PHE 21 1HD PHE 21 9.972 -2.099 4.242
144 HD2 PHE 21 2HD PHE 21 5.840 -1.384 3.598
145 HE1 PHE 21 1HE PHE 21 9.422 -3.431 6.297
146 HE2 PHE 21 2HE PHE 21 5.288 -2.715 5.653
147 HZ PHE 21 HZ PHE 21 7.086 -3.723 6.977
148 H LYS 22 H LYS 22 9.121 1.854 0.667
149 HA LYS 22 HA LYS 22 11.794 1.718 1.085
150 2HB LYS 22 2HB LYS 22 10.316 2.710 -0.857
151 2HG LYS 22 2HG LYS 22 10.931 5.284 -0.825
152 2HD LYS 22 2HD LYS 22 8.614 3.951 0.620
153 2HE LYS 22 2HE LYS 22 9.161 6.323 1.536
154 1HZ LYS 22 1HZ LYS 22 8.005 7.880 -0.201
155 2HZ LYS 22 2HZ LYS 22 9.620 7.641 -0.209
156 3HZ LYS 22 3HZ LYS 22 8.670 6.834 -1.265
157 H LYS 23 H LYS 23 9.413 3.633 2.836
158 HA LYS 23 HA LYS 23 11.558 5.155 4.107
159 2HB LYS 23 2HB LYS 23 9.846 6.590 3.371
160 2HG LYS 23 2HG LYS 23 8.096 4.307 4.086
161 2HD LYS 23 2HD LYS 23 7.540 6.183 5.813
162 2HE LYS 23 2HE LYS 23 5.847 7.824 4.636
163 1HZ LYS 23 1HZ LYS 23 8.401 8.076 5.416
164 2HZ LYS 23 2HZ LYS 23 8.463 8.647 3.886
165 3HZ LYS 23 3HZ LYS 23 7.434 9.312 4.966
166 H TRP 24 H TRP 24 9.023 2.695 4.670
167 HA TRP 24 HA TRP 24 9.371 2.663 7.489
168 2HB TRP 24 2HB TRP 24 8.051 0.584 7.363
169 HD1 TRP 24 HD TRP 24 7.685 4.131 6.545
170 HE1 TRP 24 1HE TRP 24 5.182 4.962 6.428
171 HE3 TRP 24 3HE TRP 24 5.605 -0.504 6.332
172 HZ2 TRP 24 2HZ TRP 24 2.671 3.617 6.262
173 HZ3 TRP 24 3HZ TRP 24 3.121 -0.657 6.193
174 HH2 TRP 24 HH TRP 24 1.665 1.307 6.157
175 H GLY 25 H GLY 25 10.069 0.068 5.035
176 1HA GLY 25 1HA GLY 25 12.019 -1.086 4.705
177 2HA GLY 25 2HA GLY 25 12.774 -0.234 6.037
178 H TRP 26 H TRP 26 13.272 -2.905 5.928
179 HA TRP 26 HA TRP 26 11.506 -4.687 6.982
180 2HB TRP 26 2HB TRP 26 13.867 -5.417 8.169
181 HD1 TRP 26 HD TRP 26 12.000 -5.389 4.782
182 HE1 TRP 26 1HE TRP 26 12.158 -7.740 3.592
183 HE3 TRP 26 3HE TRP 26 15.286 -7.429 8.083
184 HZ2 TRP 26 2HZ TRP 26 13.605 -10.134 4.153
185 HZ3 TRP 26 3HZ TRP 26 16.021 -9.778 7.690
186 HH2 TRP 26 HH TRP 26 15.235 -11.121 5.805
Start of MODEL 6
1 1H LYS 1 H LYS 1 -6.381 7.689 4.453
2 HA LYS 1 HA LYS 1 -6.248 9.609 6.509
3 2HB LYS 1 2HB LYS 1 -5.409 10.346 3.754
4 2HG LYS 1 2HG LYS 1 -3.231 10.350 5.484
5 2HD LYS 1 2HD LYS 1 -5.326 12.517 4.987
6 2HE LYS 1 2HE LYS 1 -3.902 13.010 7.003
7 1HZ LYS 1 1HZ LYS 1 -1.897 12.066 5.260
8 2HZ LYS 1 2HZ LYS 1 -1.522 13.553 5.820
9 3HZ LYS 1 3HZ LYS 1 -1.820 12.337 6.869
10 H SER 2 H SER 2 -7.589 9.861 3.134
11 HA SER 2 HA SER 2 -9.810 11.310 4.195
12 2HB SER 2 2HB SER 2 -9.277 13.156 2.335
13 HG SER 2 HG SER 2 -8.605 12.929 5.049
14 H SER 3 H SER 3 -11.395 11.869 2.325
15 HA SER 3 HA SER 3 -12.513 11.323 0.543
16 2HB SER 3 2HB SER 3 -10.015 9.951 -0.539
17 HG SER 3 HG SER 3 -11.849 11.363 -2.176
18 H ALA 4 H ALA 4 -10.199 8.551 1.063
19 HA ALA 4 HA ALA 4 -12.532 6.870 1.625
20 1HB ALA 4 1HB ALA 4 -11.562 5.088 0.235
21 2HB ALA 4 2HB ALA 4 -11.864 6.546 -0.739
22 3HB ALA 4 3HB ALA 4 -10.210 6.156 -0.212
23 H TYR 5 H TYR 5 -12.212 5.383 3.288
24 HA TYR 5 HA TYR 5 -9.504 5.354 4.436
25 2HB TYR 5 2HB TYR 5 -10.729 5.345 6.646
26 HD1 TYR 5 1HD TYR 5 -12.963 7.323 4.421
27 HD2 TYR 5 2HD TYR 5 -9.624 7.402 7.096
28 HE1 TYR 5 1HE TYR 5 -13.029 9.864 4.440
29 HE2 TYR 5 2HE TYR 5 -9.702 9.943 7.106
30 HH TYR 5 HH TYR 5 -11.797 11.681 6.642
31 H SER 6 H SER 6 -9.812 3.393 2.712
32 HA SER 6 HA SER 6 -10.684 1.150 4.361
33 2HB SER 6 2HB SER 6 -11.571 0.029 2.468
34 HG SER 6 HG SER 6 -13.173 1.379 1.914
35 H LEU 7 H LEU 7 -9.283 -0.680 4.406
36 HA LEU 7 HA LEU 7 -6.581 -0.168 4.029
37 2HB LEU 7 2HB LEU 7 -6.519 -2.780 4.186
38 HG LEU 7 HG LEU 7 -6.908 -2.787 6.580
39 1HD1 LEU 7 1HD1 LEU 7 -5.301 -1.112 7.258
40 2HD1 LEU 7 2HD1 LEU 7 -4.816 -1.809 5.693
41 3HD1 LEU 7 3HD1 LEU 7 -5.568 -0.197 5.754
42 1HD2 LEU 7 1HD2 LEU 7 -9.010 -1.351 6.406
43 2HD2 LEU 7 2HD2 LEU 7 -7.945 -1.068 7.803
44 3HD2 LEU 7 3HD2 LEU 7 -7.918 0.054 6.422
45 H GLN 8 H GLN 8 -7.440 -3.179 2.510
46 HA GLN 8 HA GLN 8 -7.020 -1.985 -0.104
47 2HB GLN 8 2HB GLN 8 -5.682 -4.512 -0.100
48 2HG GLN 8 2HG GLN 8 -5.259 -2.202 -1.326
49 1HE2 GLN 8 1HE2 GLN 8 -4.647 -0.199 -1.061
50 2HE2 GLN 8 2HE2 GLN 8 -3.754 0.460 0.268
51 H MET 9 H MET 9 -7.516 -3.682 -1.905
52 HA MET 9 HA MET 9 -9.369 -5.695 -0.981
53 2HB MET 9 2HB MET 9 -10.870 -3.812 -1.351
54 2HG MET 9 2HG MET 9 -9.664 -3.433 -4.125
55 1HE MET 9 1HE MET 9 -11.685 -1.006 -1.144
56 2HE MET 9 2HE MET 9 -9.962 -0.985 -1.587
57 3HE MET 9 3HE MET 9 -11.072 0.223 -2.276
58 H GLY 10 H GLY 10 -7.774 -4.046 -3.781
59 1HA GLY 10 1HA GLY 10 -8.100 -6.056 -5.677
60 2HA GLY 10 2HA GLY 10 -6.815 -4.864 -5.640
61 H ALA 11 H ALA 11 -4.741 -5.405 -4.840
62 HA ALA 11 HA ALA 11 -4.029 -7.437 -3.218
63 1HB ALA 11 1HB ALA 11 -3.285 -8.946 -5.450
64 2HB ALA 11 2HB ALA 11 -4.587 -9.337 -4.300
65 3HB ALA 11 3HB ALA 11 -4.960 -8.458 -5.802
66 H THR 12 H THR 12 -2.934 -7.016 -6.649
67 HA THR 12 HA THR 12 -0.289 -6.808 -6.223
68 HB THR 12 HB THR 12 -1.183 -6.813 -8.463
69 HG1 THR 12 1HG THR 12 0.134 -5.105 -9.196
70 1HG2 THR 12 1HG2 THR 12 -2.321 -4.020 -8.019
71 2HG2 THR 12 2HG2 THR 12 -2.635 -5.136 -9.369
72 3HG2 THR 12 3HG2 THR 12 -3.323 -5.468 -7.761
73 H ALA 13 H ALA 13 -2.620 -4.051 -5.962
74 HA ALA 13 HA ALA 13 -0.970 -1.999 -5.510
75 1HB ALA 13 1HB ALA 13 -3.058 -1.200 -5.215
76 2HB ALA 13 2HB ALA 13 -3.671 -2.788 -4.698
77 3HB ALA 13 3HB ALA 13 -2.907 -1.701 -3.515
78 H ILE 14 H ILE 14 -1.731 -4.661 -3.209
79 HA ILE 14 HA ILE 14 -0.621 -3.683 -0.931
80 HB ILE 14 HB ILE 14 -0.565 -6.483 -2.053
81 2HG1 ILE 14 2HG1 ILE 14 -2.793 -5.313 -1.716
82 1HG2 ILE 14 1HG2 ILE 14 1.159 -6.206 -0.319
83 2HG2 ILE 14 2HG2 ILE 14 -0.079 -5.592 0.802
84 3HG2 ILE 14 3HG2 ILE 14 -0.168 -7.268 0.211
85 1HD1 ILE 14 1HD1 ILE 14 -2.591 -7.784 -1.742
86 2HD1 ILE 14 2HD1 ILE 14 -2.172 -7.772 -0.013
87 3HD1 ILE 14 3HD1 ILE 14 -3.794 -7.262 -0.539
88 H LYS 15 H LYS 15 1.100 -5.421 -3.612
89 HA LYS 15 HA LYS 15 3.609 -5.416 -2.563
90 2HB LYS 15 2HB LYS 15 2.617 -6.317 -4.817
91 2HG LYS 15 2HG LYS 15 2.341 -3.871 -5.662
92 2HD LYS 15 2HD LYS 15 5.290 -4.101 -5.361
93 2HE LYS 15 2HE LYS 15 5.582 -2.566 -7.418
94 1HZ LYS 15 1HZ LYS 15 6.454 -4.666 -7.643
95 2HZ LYS 15 2HZ LYS 15 5.008 -5.423 -7.584
96 3HZ LYS 15 3HZ LYS 15 5.440 -4.589 -8.920
97 H GLN 16 H GLN 16 1.853 -2.719 -4.172
98 HA GLN 16 HA GLN 16 3.965 -0.994 -4.385
99 2HB GLN 16 2HB GLN 16 2.270 0.784 -4.506
100 2HG GLN 16 2HG GLN 16 1.003 -1.753 -5.622
101 1HE2 GLN 16 1HE2 GLN 16 2.317 0.750 -7.559
102 2HE2 GLN 16 2HE2 GLN 16 0.851 1.568 -7.988
103 H VAL 17 H VAL 17 1.758 -1.635 -1.603
104 HA VAL 17 HA VAL 17 2.592 0.417 0.044
105 HB VAL 17 HB VAL 17 0.692 -1.322 0.238
106 1HG1 VAL 17 1HG1 VAL 17 1.143 -3.413 0.884
107 2HG1 VAL 17 2HG1 VAL 17 2.868 -3.048 0.639
108 3HG1 VAL 17 3HG1 VAL 17 2.135 -2.842 2.248
109 1HG2 VAL 17 1HG2 VAL 17 1.020 0.511 1.816
110 2HG2 VAL 17 2HG2 VAL 17 0.564 -0.976 2.681
111 3HG2 VAL 17 3HG2 VAL 17 2.258 -0.429 2.684
112 H LYS 18 H LYS 18 4.125 -2.689 -0.798
113 HA LYS 18 HA LYS 18 5.992 -2.694 1.302
114 2HB LYS 18 2HB LYS 18 5.421 -4.226 -1.114
115 2HG LYS 18 2HG LYS 18 7.899 -5.170 -0.937
116 2HD LYS 18 2HD LYS 18 8.530 -3.137 -2.625
117 2HE LYS 18 2HE LYS 18 7.153 -4.393 -4.388
118 1HZ LYS 18 1HZ LYS 18 8.333 -6.572 -3.151
119 2HZ LYS 18 2HZ LYS 18 8.920 -5.676 -4.385
120 3HZ LYS 18 3HZ LYS 18 9.277 -5.274 -2.844
121 H LYS 19 H LYS 19 5.874 -1.143 -1.918
122 HA LYS 19 HA LYS 19 8.596 -0.392 -1.937
123 2HB LYS 19 2HB LYS 19 6.228 -0.048 -3.599
124 2HG LYS 19 2HG LYS 19 7.316 2.029 -4.723
125 2HD LYS 19 2HD LYS 19 6.296 3.453 -2.574
126 2HE LYS 19 2HE LYS 19 4.781 1.941 -4.755
127 1HZ LYS 19 1HZ LYS 19 2.971 2.896 -3.979
128 2HZ LYS 19 2HZ LYS 19 3.779 3.310 -2.621
129 3HZ LYS 19 3HZ LYS 19 3.675 4.364 -3.863
130 H LEU 20 H LEU 20 5.841 0.668 -0.129
131 HA LEU 20 HA LEU 20 6.942 3.320 0.281
132 2HB LEU 20 2HB LEU 20 4.394 2.353 0.140
133 HG LEU 20 HG LEU 20 4.643 1.452 2.519
134 1HD1 LEU 20 1HD1 LEU 20 5.554 4.135 2.954
135 2HD1 LEU 20 2HD1 LEU 20 4.081 3.852 3.912
136 3HD1 LEU 20 3HD1 LEU 20 5.482 2.769 4.091
137 1HD2 LEU 20 1HD2 LEU 20 2.469 3.409 2.721
138 2HD2 LEU 20 2HD2 LEU 20 2.512 2.541 1.168
139 3HD2 LEU 20 3HD2 LEU 20 2.422 1.631 2.695
140 H PHE 21 H PHE 21 7.207 0.126 1.555
141 HA PHE 21 HA PHE 21 7.630 0.836 4.265
142 2HB PHE 21 2HB PHE 21 9.029 -1.569 3.293
143 HD1 PHE 21 1HD PHE 21 9.268 -2.307 5.511
144 HD2 PHE 21 2HD PHE 21 5.415 -1.267 4.069
145 HE1 PHE 21 1HE PHE 21 8.232 -3.263 7.588
146 HE2 PHE 21 2HE PHE 21 4.380 -2.222 6.146
147 HZ PHE 21 HZ PHE 21 5.800 -3.209 7.880
148 H LYS 22 H LYS 22 9.540 1.082 1.359
149 HA LYS 22 HA LYS 22 12.089 0.661 2.328
150 2HB LYS 22 2HB LYS 22 11.051 1.274 -0.068
151 2HG LYS 22 2HG LYS 22 12.279 3.540 -0.604
152 2HD LYS 22 2HD LYS 22 9.574 3.110 0.647
153 2HE LYS 22 2HE LYS 22 10.953 5.563 1.018
154 1HZ LYS 22 1HZ LYS 22 10.340 5.784 -1.429
155 2HZ LYS 22 2HZ LYS 22 8.803 5.975 -0.910
156 3HZ LYS 22 3HZ LYS 22 9.962 7.019 -0.430
157 H LYS 23 H LYS 23 9.756 3.101 3.155
158 HA LYS 23 HA LYS 23 11.863 4.810 4.246
159 2HB LYS 23 2HB LYS 23 10.226 5.920 2.826
160 2HG LYS 23 2HG LYS 23 8.352 4.268 4.361
161 2HD LYS 23 2HD LYS 23 8.011 7.282 4.360
162 2HE LYS 23 2HE LYS 23 5.722 5.281 4.607
163 1HZ LYS 23 1HZ LYS 23 6.013 7.939 5.246
164 2HZ LYS 23 2HZ LYS 23 5.079 7.904 3.907
165 3HZ LYS 23 3HZ LYS 23 4.632 7.067 5.237
166 H TRP 24 H TRP 24 9.307 2.516 5.067
167 HA TRP 24 HA TRP 24 9.185 3.288 7.817
168 2HB TRP 24 2HB TRP 24 7.960 1.053 7.980
169 HD1 TRP 24 HD TRP 24 7.606 4.513 6.801
170 HE1 TRP 24 1HE TRP 24 5.104 5.310 6.545
171 HE3 TRP 24 3HE TRP 24 5.552 -0.132 7.031
172 HZ2 TRP 24 2HZ TRP 24 2.602 3.938 6.469
173 HZ3 TRP 24 3HZ TRP 24 3.073 -0.316 6.858
174 HH2 TRP 24 HH TRP 24 1.609 1.623 6.586
175 H GLY 25 H GLY 25 10.360 0.303 6.084
176 1HA GLY 25 1HA GLY 25 12.788 0.273 7.642
177 2HA GLY 25 2HA GLY 25 11.639 -0.969 8.103
178 H TRP 26 H TRP 26 12.236 -2.893 7.203
179 HA TRP 26 HA TRP 26 13.659 -2.931 4.710
180 2HB TRP 26 2HB TRP 26 13.583 -5.411 5.084
181 HD1 TRP 26 HD TRP 26 14.452 -2.629 7.676
182 HE1 TRP 26 1HE TRP 26 16.898 -2.961 8.609
183 HE3 TRP 26 3HE TRP 26 15.337 -7.025 5.276
184 HZ2 TRP 26 2HZ TRP 26 18.884 -4.979 8.248
185 HZ3 TRP 26 3HZ TRP 26 17.555 -8.110 5.621
186 HH2 TRP 26 HH TRP 26 19.296 -7.157 7.047
Start of MODEL 7
1 1H LYS 1 H LYS 1 -17.901 9.608 0.585
2 HA LYS 1 HA LYS 1 -16.190 11.373 0.203
3 2HB LYS 1 2HB LYS 1 -17.455 13.328 0.547
4 2HG LYS 1 2HG LYS 1 -18.243 13.660 3.110
5 2HD LYS 1 2HD LYS 1 -19.523 12.974 0.622
6 2HE LYS 1 2HE LYS 1 -20.360 11.341 3.005
7 1HZ LYS 1 1HZ LYS 1 -22.415 12.089 2.905
8 2HZ LYS 1 2HZ LYS 1 -22.096 13.088 1.654
9 3HZ LYS 1 3HZ LYS 1 -22.534 11.540 1.372
10 H SER 2 H SER 2 -14.385 10.497 1.062
11 HA SER 2 HA SER 2 -14.091 10.128 3.803
12 2HB SER 2 2HB SER 2 -14.436 7.535 2.234
13 HG SER 2 HG SER 2 -13.002 7.261 3.994
14 H SER 3 H SER 3 -11.888 9.267 4.316
15 HA SER 3 HA SER 3 -10.201 8.614 2.132
16 2HB SER 3 2HB SER 3 -8.750 10.765 3.247
17 HG SER 3 HG SER 3 -9.777 11.695 1.011
18 H ALA 4 H ALA 4 -9.708 6.735 3.352
19 HA ALA 4 HA ALA 4 -8.516 7.218 5.990
20 1HB ALA 4 1HB ALA 4 -8.936 4.762 6.300
21 2HB ALA 4 2HB ALA 4 -10.419 5.708 6.028
22 3HB ALA 4 3HB ALA 4 -9.727 4.738 4.705
23 H TYR 5 H TYR 5 -6.722 5.446 6.472
24 HA TYR 5 HA TYR 5 -4.578 6.009 4.799
25 2HB TYR 5 2HB TYR 5 -4.849 5.106 7.284
26 HD1 TYR 5 1HD TYR 5 -7.065 3.527 6.691
27 HD2 TYR 5 2HD TYR 5 -2.961 2.318 6.645
28 HE1 TYR 5 1HE TYR 5 -7.765 1.111 7.065
29 HE2 TYR 5 2HE TYR 5 -3.675 -0.093 7.020
30 HH TYR 5 HH TYR 5 -6.047 -1.383 6.402
31 H SER 6 H SER 6 -7.192 3.768 4.384
32 HA SER 6 HA SER 6 -5.814 2.718 2.082
33 2HB SER 6 2HB SER 6 -6.681 0.369 2.691
34 HG SER 6 HG SER 6 -4.604 1.674 4.218
35 H LEU 7 H LEU 7 -7.409 1.557 0.585
36 HA LEU 7 HA LEU 7 -10.182 2.269 1.140
37 2HB LEU 7 2HB LEU 7 -9.747 4.139 -0.076
38 HG LEU 7 HG LEU 7 -7.385 2.875 -0.966
39 1HD1 LEU 7 1HD1 LEU 7 -9.154 3.695 -3.286
40 2HD1 LEU 7 2HD1 LEU 7 -7.401 3.400 -3.388
41 3HD1 LEU 7 3HD1 LEU 7 -8.504 2.073 -2.948
42 1HD2 LEU 7 1HD2 LEU 7 -7.876 5.257 -0.153
43 2HD2 LEU 7 2HD2 LEU 7 -6.663 5.049 -1.438
44 3HD2 LEU 7 3HD2 LEU 7 -8.303 5.609 -1.846
45 H GLN 8 H GLN 8 -7.794 0.651 -1.042
46 HA GLN 8 HA GLN 8 -9.636 -1.590 -1.097
47 2HB GLN 8 2HB GLN 8 -8.555 -1.691 -3.640
48 2HG GLN 8 2HG GLN 8 -11.131 -0.274 -2.806
49 1HE2 GLN 8 1HE2 GLN 8 -12.042 0.671 -4.448
50 2HE2 GLN 8 2HE2 GLN 8 -11.944 0.219 -6.117
51 H MET 9 H MET 9 -8.619 -3.620 -1.017
52 HA MET 9 HA MET 9 -5.702 -3.485 -0.995
53 2HB MET 9 2HB MET 9 -6.467 -3.864 1.284
54 2HG MET 9 2HG MET 9 -7.975 -6.053 1.577
55 1HE MET 9 1HE MET 9 -11.539 -4.146 1.437
56 2HE MET 9 2HE MET 9 -10.842 -4.604 -0.136
57 3HE MET 9 3HE MET 9 -10.765 -5.737 1.235
58 H GLY 10 H GLY 10 -8.660 -5.240 -1.926
59 1HA GLY 10 1HA GLY 10 -8.959 -7.160 -3.110
60 2HA GLY 10 2HA GLY 10 -7.878 -6.341 -4.220
61 H ALA 11 H ALA 11 -5.703 -7.012 -4.443
62 HA ALA 11 HA ALA 11 -4.615 -8.916 -2.593
63 1HB ALA 11 1HB ALA 11 -5.491 -10.714 -3.659
64 2HB ALA 11 2HB ALA 11 -5.942 -9.761 -5.092
65 3HB ALA 11 3HB ALA 11 -4.278 -10.366 -4.914
66 H THR 12 H THR 12 -4.338 -7.808 -6.050
67 HA THR 12 HA THR 12 -1.539 -7.783 -6.049
68 HB THR 12 HB THR 12 -1.905 -6.441 -8.146
69 HG1 THR 12 1HG THR 12 -3.664 -5.122 -7.542
70 1HG2 THR 12 1HG2 THR 12 -3.062 -9.023 -7.593
71 2HG2 THR 12 2HG2 THR 12 -4.236 -8.104 -8.565
72 3HG2 THR 12 3HG2 THR 12 -2.584 -8.362 -9.175
73 H ALA 13 H ALA 13 -3.942 -5.195 -5.316
74 HA ALA 13 HA ALA 13 -2.344 -3.035 -5.163
75 1HB ALA 13 1HB ALA 13 -4.469 -2.450 -4.606
76 2HB ALA 13 2HB ALA 13 -4.788 -4.000 -3.791
77 3HB ALA 13 3HB ALA 13 -3.911 -2.709 -2.936
78 H ILE 14 H ILE 14 -2.726 -5.601 -2.634
79 HA ILE 14 HA ILE 14 -1.247 -4.585 -0.634
80 HB ILE 14 HB ILE 14 -1.308 -7.406 -1.702
81 2HG1 ILE 14 2HG1 ILE 14 -3.430 -6.098 -0.875
82 1HG2 ILE 14 1HG2 ILE 14 -0.498 -6.615 1.096
83 2HG2 ILE 14 2HG2 ILE 14 -0.352 -8.197 0.292
84 3HG2 ILE 14 3HG2 ILE 14 0.687 -6.842 -0.213
85 1HD1 ILE 14 1HD1 ILE 14 -4.406 -8.163 -0.307
86 2HD1 ILE 14 2HD1 ILE 14 -3.001 -8.669 -1.273
87 3HD1 ILE 14 3HD1 ILE 14 -2.934 -8.747 0.504
88 H LYS 15 H LYS 15 0.048 -6.269 -3.571
89 HA LYS 15 HA LYS 15 2.698 -6.221 -2.939
90 2HB LYS 15 2HB LYS 15 1.335 -5.860 -5.621
91 2HG LYS 15 2HG LYS 15 3.606 -6.939 -6.364
92 2HD LYS 15 2HD LYS 15 4.190 -4.141 -5.533
93 2HE LYS 15 2HE LYS 15 4.529 -5.920 -7.838
94 1HZ LYS 15 1HZ LYS 15 4.050 -3.205 -8.666
95 2HZ LYS 15 2HZ LYS 15 3.831 -4.599 -9.487
96 3HZ LYS 15 3HZ LYS 15 2.718 -4.111 -8.396
97 H GLN 16 H GLN 16 0.683 -3.575 -4.345
98 HA GLN 16 HA GLN 16 2.703 -1.806 -4.822
99 2HB GLN 16 2HB GLN 16 0.936 -0.046 -4.620
100 2HG GLN 16 2HG GLN 16 0.336 -2.668 -6.022
101 1HE2 GLN 16 1HE2 GLN 16 -1.009 -1.841 -8.123
102 2HE2 GLN 16 2HE2 GLN 16 -2.575 -1.216 -7.727
103 H VAL 17 H VAL 17 0.955 -2.545 -1.766
104 HA VAL 17 HA VAL 17 1.841 -0.446 -0.228
105 HB VAL 17 HB VAL 17 1.396 -3.331 0.565
106 1HG1 VAL 17 1HG1 VAL 17 1.044 -2.566 2.795
107 2HG1 VAL 17 2HG1 VAL 17 2.576 -1.846 2.247
108 3HG1 VAL 17 3HG1 VAL 17 1.096 -0.859 2.294
109 1HG2 VAL 17 1HG2 VAL 17 -0.421 -1.736 -0.678
110 2HG2 VAL 17 2HG2 VAL 17 -0.842 -3.005 0.498
111 3HG2 VAL 17 3HG2 VAL 17 -0.719 -1.308 1.023
112 H LYS 18 H LYS 18 3.504 -3.465 -1.220
113 HA LYS 18 HA LYS 18 5.688 -3.167 0.521
114 2HB LYS 18 2HB LYS 18 4.860 -4.913 -1.660
115 2HG LYS 18 2HG LYS 18 7.406 -5.624 -1.896
116 2HD LYS 18 2HD LYS 18 7.520 -3.655 -3.773
117 2HE LYS 18 2HE LYS 18 5.843 -5.183 -5.110
118 1HZ LYS 18 1HZ LYS 18 8.132 -5.491 -5.366
119 2HZ LYS 18 2HZ LYS 18 8.327 -6.130 -3.875
120 3HZ LYS 18 3HZ LYS 18 7.544 -6.977 -5.031
121 H LYS 19 H LYS 19 4.885 -1.849 -2.703
122 HA LYS 19 HA LYS 19 7.477 -0.900 -3.263
123 2HB LYS 19 2HB LYS 19 4.799 -0.765 -4.431
124 2HG LYS 19 2HG LYS 19 5.556 1.268 -5.863
125 2HD LYS 19 2HD LYS 19 4.941 2.799 -3.637
126 2HE LYS 19 2HE LYS 19 3.078 1.105 -5.368
127 1HZ LYS 19 1HZ LYS 19 1.463 2.768 -4.722
128 2HZ LYS 19 2HZ LYS 19 1.973 1.923 -3.420
129 3HZ LYS 19 3HZ LYS 19 2.520 3.440 -3.674
130 H LEU 20 H LEU 20 5.041 0.062 -0.998
131 HA LEU 20 HA LEU 20 6.100 2.776 -0.870
132 2HB LEU 20 2HB LEU 20 3.558 1.793 -0.695
133 HG LEU 20 HG LEU 20 4.076 0.996 1.680
134 1HD1 LEU 20 1HD1 LEU 20 4.956 3.731 1.896
135 2HD1 LEU 20 2HD1 LEU 20 3.640 3.414 3.052
136 3HD1 LEU 20 3HD1 LEU 20 5.099 2.395 3.064
137 1HD2 LEU 20 1HD2 LEU 20 1.824 1.095 1.143
138 2HD2 LEU 20 2HD2 LEU 20 1.933 2.159 2.566
139 3HD2 LEU 20 3HD2 LEU 20 1.840 2.862 0.934
140 H PHE 21 H PHE 21 6.576 -0.360 0.454
141 HA PHE 21 HA PHE 21 7.430 0.621 3.032
142 2HB PHE 21 2HB PHE 21 8.249 -2.087 2.490
143 HD1 PHE 21 1HD PHE 21 4.663 -1.542 2.899
144 HD2 PHE 21 2HD PHE 21 8.368 -1.960 4.925
145 HE1 PHE 21 1HE PHE 21 3.439 -1.912 5.059
146 HE2 PHE 21 2HE PHE 21 7.144 -2.330 7.084
147 HZ PHE 21 HZ PHE 21 4.695 -2.302 7.126
148 H LYS 22 H LYS 22 8.758 0.091 -0.147
149 HA LYS 22 HA LYS 22 11.387 -0.566 0.606
150 2HB LYS 22 2HB LYS 22 10.810 -1.080 -1.594
151 2HG LYS 22 2HG LYS 22 8.833 0.294 -1.917
152 2HD LYS 22 2HD LYS 22 10.764 2.515 -1.345
153 2HE LYS 22 2HE LYS 22 9.151 2.507 -3.753
154 1HZ LYS 22 1HZ LYS 22 7.649 4.114 -3.344
155 2HZ LYS 22 2HZ LYS 22 7.626 3.429 -1.862
156 3HZ LYS 22 3HZ LYS 22 8.484 4.795 -2.117
157 H LYS 23 H LYS 23 9.528 2.248 1.103
158 HA LYS 23 HA LYS 23 11.988 3.840 1.332
159 2HB LYS 23 2HB LYS 23 10.615 4.778 -0.393
160 2HG LYS 23 2HG LYS 23 8.428 4.056 1.475
161 2HD LYS 23 2HD LYS 23 8.647 6.705 1.448
162 2HE LYS 23 2HE LYS 23 8.734 6.499 -1.209
163 1HZ LYS 23 1HZ LYS 23 6.842 5.735 -2.009
164 2HZ LYS 23 2HZ LYS 23 6.085 5.778 -0.562
165 3HZ LYS 23 3HZ LYS 23 6.108 7.106 -1.510
166 H TRP 24 H TRP 24 10.109 1.899 3.101
167 HA TRP 24 HA TRP 24 9.777 3.781 5.321
168 2HB TRP 24 2HB TRP 24 8.591 1.646 6.274
169 HD1 TRP 24 HD TRP 24 8.116 4.598 3.977
170 HE1 TRP 24 1HE TRP 24 5.640 5.513 4.008
171 HE3 TRP 24 3HE TRP 24 6.132 0.655 6.501
172 HZ2 TRP 24 2HZ TRP 24 3.186 4.508 5.062
173 HZ3 TRP 24 3HZ TRP 24 3.688 0.700 6.991
174 HH2 TRP 24 HH TRP 24 2.228 2.540 6.314
175 H GLY 25 H GLY 25 10.509 2.969 7.505
176 1HA GLY 25 1HA GLY 25 12.825 1.146 7.262
177 2HA GLY 25 2HA GLY 25 12.913 2.665 8.132
178 H TRP 26 H TRP 26 12.743 2.449 10.314
179 HA TRP 26 HA TRP 26 11.678 0.042 11.425
180 2HB TRP 26 2HB TRP 26 13.576 0.996 12.472
181 HD1 TRP 26 HD TRP 26 11.162 3.880 11.813
182 HE1 TRP 26 1HE TRP 26 12.244 6.215 12.394
183 HE3 TRP 26 3HE TRP 26 15.287 1.988 14.104
184 HZ2 TRP 26 2HZ TRP 26 14.650 6.992 13.717
185 HZ3 TRP 26 3HZ TRP 26 16.955 3.604 15.013
186 HH2 TRP 26 HH TRP 26 16.687 6.027 14.848
Start of MODEL 8
1 1H LYS 1 H LYS 1 -11.574 12.034 9.274
2 HA LYS 1 HA LYS 1 -10.488 10.746 7.803
3 2HB LYS 1 2HB LYS 1 -10.273 13.091 6.981
4 2HG LYS 1 2HG LYS 1 -8.420 13.488 8.914
5 2HD LYS 1 2HD LYS 1 -6.588 13.341 6.546
6 2HE LYS 1 2HE LYS 1 -5.023 12.605 8.459
7 1HZ LYS 1 1HZ LYS 1 -6.386 15.183 8.807
8 2HZ LYS 1 2HZ LYS 1 -4.863 14.815 9.268
9 3HZ LYS 1 3HZ LYS 1 -5.237 14.899 7.680
10 H SER 2 H SER 2 -8.917 9.147 7.539
11 HA SER 2 HA SER 2 -6.464 9.331 8.925
12 2HB SER 2 2HB SER 2 -7.845 8.732 10.855
13 HG SER 2 HG SER 2 -9.163 6.908 10.876
14 H SER 3 H SER 3 -5.615 8.882 6.820
15 HA SER 3 HA SER 3 -4.815 7.599 5.261
16 2HB SER 3 2HB SER 3 -4.820 5.128 5.484
17 HG SER 3 HG SER 3 -4.365 6.677 7.875
18 H ALA 4 H ALA 4 -7.881 5.843 6.163
19 HA ALA 4 HA ALA 4 -9.541 5.112 4.859
20 1HB ALA 4 1HB ALA 4 -9.530 7.889 3.659
21 2HB ALA 4 2HB ALA 4 -10.918 6.873 4.116
22 3HB ALA 4 3HB ALA 4 -9.916 7.632 5.377
23 H TYR 5 H TYR 5 -10.149 6.489 2.152
24 HA TYR 5 HA TYR 5 -9.825 5.998 0.014
25 2HB TYR 5 2HB TYR 5 -7.072 5.652 -0.295
26 HD1 TYR 5 1HD TYR 5 -6.615 8.677 1.158
27 HD2 TYR 5 2HD TYR 5 -8.983 6.932 -1.948
28 HE1 TYR 5 1HE TYR 5 -6.825 10.947 0.032
29 HE2 TYR 5 2HE TYR 5 -9.184 9.207 -3.064
30 HH TYR 5 HH TYR 5 -8.971 11.819 -1.874
31 H SER 6 H SER 6 -10.331 3.752 1.828
32 HA SER 6 HA SER 6 -10.438 1.586 1.750
33 2HB SER 6 2HB SER 6 -10.058 0.376 -0.338
34 HG SER 6 HG SER 6 -10.791 2.700 -1.636
35 H LEU 7 H LEU 7 -9.128 -0.387 2.133
36 HA LEU 7 HA LEU 7 -6.255 0.193 2.289
37 2HB LEU 7 2HB LEU 7 -6.967 0.464 4.492
38 HG LEU 7 HG LEU 7 -9.159 -1.149 3.939
39 1HD1 LEU 7 1HD1 LEU 7 -7.095 -2.726 5.346
40 2HD1 LEU 7 2HD1 LEU 7 -8.713 -2.746 6.087
41 3HD1 LEU 7 3HD1 LEU 7 -8.503 -3.252 4.393
42 1HD2 LEU 7 1HD2 LEU 7 -9.910 -0.551 6.116
43 2HD2 LEU 7 2HD2 LEU 7 -8.245 -0.329 6.704
44 3HD2 LEU 7 3HD2 LEU 7 -8.925 0.801 5.509
45 H GLN 8 H GLN 8 -8.765 -2.429 2.493
46 HA GLN 8 HA GLN 8 -7.008 -3.960 0.744
47 2HB GLN 8 2HB GLN 8 -8.566 -5.017 3.145
48 2HG GLN 8 2HG GLN 8 -7.055 -6.374 0.892
49 1HE2 GLN 8 1HE2 GLN 8 -8.556 -8.665 2.496
50 2HE2 GLN 8 2HE2 GLN 8 -7.332 -9.260 3.566
51 H MET 9 H MET 9 -8.084 -5.318 -0.809
52 HA MET 9 HA MET 9 -10.788 -5.800 -0.815
53 2HB MET 9 2HB MET 9 -11.056 -3.348 -1.113
54 2HG MET 9 2HG MET 9 -9.417 -3.640 -3.671
55 1HE MET 9 1HE MET 9 -9.625 -1.933 -5.317
56 2HE MET 9 2HE MET 9 -11.329 -2.359 -5.028
57 3HE MET 9 3HE MET 9 -10.859 -0.653 -5.222
58 H GLY 10 H GLY 10 -7.824 -5.083 -2.697
59 1HA GLY 10 1HA GLY 10 -8.599 -7.187 -4.626
60 2HA GLY 10 2HA GLY 10 -7.524 -5.845 -4.961
61 H ALA 11 H ALA 11 -5.340 -6.173 -4.765
62 HA ALA 11 HA ALA 11 -4.199 -7.748 -2.745
63 1HB ALA 11 1HB ALA 11 -3.958 -9.072 -5.450
64 2HB ALA 11 2HB ALA 11 -3.636 -9.746 -3.835
65 3HB ALA 11 3HB ALA 11 -5.313 -9.474 -4.367
66 H THR 12 H THR 12 -3.584 -7.204 -6.292
67 HA THR 12 HA THR 12 -0.943 -6.680 -6.208
68 HB THR 12 HB THR 12 -2.059 -6.730 -8.324
69 HG1 THR 12 1HG THR 12 -1.433 -4.590 -9.112
70 1HG2 THR 12 1HG2 THR 12 -4.165 -5.378 -6.973
71 2HG2 THR 12 2HG2 THR 12 -3.567 -4.221 -8.187
72 3HG2 THR 12 3HG2 THR 12 -4.129 -5.831 -8.694
73 H ALA 13 H ALA 13 -3.553 -4.285 -5.480
74 HA ALA 13 HA ALA 13 -2.145 -2.031 -5.184
75 1HB ALA 13 1HB ALA 13 -4.573 -3.196 -4.076
76 2HB ALA 13 2HB ALA 13 -3.788 -2.115 -2.898
77 3HB ALA 13 3HB ALA 13 -4.227 -1.506 -4.512
78 H ILE 14 H ILE 14 -2.304 -4.748 -2.800
79 HA ILE 14 HA ILE 14 -0.915 -3.656 -0.743
80 HB ILE 14 HB ILE 14 -0.842 -6.461 -1.850
81 2HG1 ILE 14 2HG1 ILE 14 -3.058 -5.493 -1.148
82 1HG2 ILE 14 1HG2 ILE 14 -0.052 -5.655 0.951
83 2HG2 ILE 14 2HG2 ILE 14 0.142 -7.232 0.147
84 3HG2 ILE 14 3HG2 ILE 14 1.131 -5.842 -0.366
85 1HD1 ILE 14 1HD1 ILE 14 -3.127 -7.816 -1.036
86 2HD1 ILE 14 2HD1 ILE 14 -1.749 -7.907 0.087
87 3HD1 ILE 14 3HD1 ILE 14 -3.355 -7.426 0.685
88 H LYS 15 H LYS 15 0.498 -5.333 -3.637
89 HA LYS 15 HA LYS 15 3.122 -5.156 -3.038
90 2HB LYS 15 2HB LYS 15 1.706 -4.796 -5.687
91 2HG LYS 15 2HG LYS 15 3.999 -5.549 -6.596
92 2HD LYS 15 2HD LYS 15 4.428 -2.840 -5.407
93 2HE LYS 15 2HE LYS 15 4.963 -4.291 -7.875
94 1HZ LYS 15 1HZ LYS 15 4.502 -2.005 -9.062
95 2HZ LYS 15 2HZ LYS 15 3.419 -3.227 -9.078
96 3HZ LYS 15 3HZ LYS 15 3.236 -1.989 -8.030
97 H GLN 16 H GLN 16 1.001 -2.525 -4.300
98 HA GLN 16 HA GLN 16 2.973 -0.672 -4.717
99 2HB GLN 16 2HB GLN 16 0.236 -0.733 -4.955
100 2HG GLN 16 2HG GLN 16 0.914 1.349 -2.824
101 1HE2 GLN 16 1HE2 GLN 16 -1.100 2.278 -1.943
102 2HE2 GLN 16 2HE2 GLN 16 -2.386 2.682 -3.031
103 H VAL 17 H VAL 17 1.187 -1.544 -1.710
104 HA VAL 17 HA VAL 17 2.043 0.520 -0.100
105 HB VAL 17 HB VAL 17 0.365 -1.414 0.262
106 1HG1 VAL 17 1HG1 VAL 17 1.100 -3.458 0.787
107 2HG1 VAL 17 2HG1 VAL 17 2.727 -2.916 0.310
108 3HG1 VAL 17 3HG1 VAL 17 2.218 -2.814 2.013
109 1HG2 VAL 17 1HG2 VAL 17 0.506 -1.132 2.707
110 2HG2 VAL 17 2HG2 VAL 17 2.132 -0.431 2.529
111 3HG2 VAL 17 3HG2 VAL 17 0.720 0.413 1.850
112 H LYS 18 H LYS 18 3.739 -2.404 -1.244
113 HA LYS 18 HA LYS 18 5.862 -2.268 0.589
114 2HB LYS 18 2HB LYS 18 5.115 -3.803 -1.773
115 2HG LYS 18 2HG LYS 18 7.676 -4.486 -1.977
116 2HD LYS 18 2HD LYS 18 7.838 -2.362 -3.673
117 2HE LYS 18 2HE LYS 18 6.166 -3.796 -5.164
118 1HZ LYS 18 1HZ LYS 18 8.012 -4.819 -5.805
119 2HZ LYS 18 2HZ LYS 18 8.786 -3.930 -4.676
120 3HZ LYS 18 3HZ LYS 18 8.329 -5.461 -4.337
121 H LYS 19 H LYS 19 5.186 -0.690 -2.553
122 HA LYS 19 HA LYS 19 7.793 0.337 -2.883
123 2HB LYS 19 2HB LYS 19 5.211 0.468 -4.228
124 2HG LYS 19 2HG LYS 19 5.943 2.656 -5.425
125 2HD LYS 19 2HD LYS 19 5.084 3.948 -3.129
126 2HE LYS 19 2HE LYS 19 3.452 2.323 -5.138
127 1HZ LYS 19 1HZ LYS 19 1.680 3.763 -4.469
128 2HZ LYS 19 2HZ LYS 19 2.206 2.933 -3.165
129 3HZ LYS 19 3HZ LYS 19 2.615 4.502 -3.353
130 H LEU 20 H LEU 20 5.197 1.085 -0.720
131 HA LEU 20 HA LEU 20 6.076 3.829 -0.376
132 2HB LEU 20 2HB LEU 20 3.637 2.608 -0.227
133 HG LEU 20 HG LEU 20 4.274 1.720 2.085
134 1HD1 LEU 20 1HD1 LEU 20 4.966 4.468 2.457
135 2HD1 LEU 20 2HD1 LEU 20 3.636 4.057 3.565
136 3HD1 LEU 20 3HD1 LEU 20 5.138 3.102 3.584
137 1HD2 LEU 20 1HD2 LEU 20 1.943 3.454 2.553
138 2HD2 LEU 20 2HD2 LEU 20 1.894 2.542 1.025
139 3HD2 LEU 20 3HD2 LEU 20 2.086 1.680 2.570
140 H PHE 21 H PHE 21 6.789 0.652 0.781
141 HA PHE 21 HA PHE 21 7.468 1.345 3.434
142 2HB PHE 21 2HB PHE 21 8.993 -0.861 2.200
143 HD1 PHE 21 1HD PHE 21 9.609 -1.705 4.289
144 HD2 PHE 21 2HD PHE 21 5.515 -0.903 3.511
145 HE1 PHE 21 1HE PHE 21 8.981 -2.819 6.449
146 HE2 PHE 21 2HE PHE 21 4.887 -2.018 5.670
147 HZ PHE 21 HZ PHE 21 6.627 -2.963 7.114
148 H LYS 22 H LYS 22 8.965 1.926 0.352
149 HA LYS 22 HA LYS 22 11.625 1.714 0.818
150 2HB LYS 22 2HB LYS 22 10.210 2.587 -1.227
151 2HG LYS 22 2HG LYS 22 10.942 5.124 -1.421
152 2HD LYS 22 2HD LYS 22 8.551 4.031 0.103
153 2HE LYS 22 2HE LYS 22 9.197 6.448 0.814
154 1HZ LYS 22 1HZ LYS 22 8.937 8.085 -0.729
155 2HZ LYS 22 2HZ LYS 22 9.647 6.940 -1.652
156 3HZ LYS 22 3HZ LYS 22 8.035 7.184 -1.749
157 H LYS 23 H LYS 23 9.314 3.880 2.353
158 HA LYS 23 HA LYS 23 11.510 5.423 3.508
159 2HB LYS 23 2HB LYS 23 9.866 6.855 2.630
160 2HG LYS 23 2HG LYS 23 8.014 4.716 3.525
161 2HD LYS 23 2HD LYS 23 7.541 6.824 5.031
162 2HE LYS 23 2HE LYS 23 7.519 8.085 2.526
163 1HZ LYS 23 1HZ LYS 23 5.472 7.951 1.772
164 2HZ LYS 23 2HZ LYS 23 4.990 7.016 3.021
165 3HZ LYS 23 3HZ LYS 23 4.897 8.643 3.135
166 H TRP 24 H TRP 24 8.869 3.131 4.266
167 HA TRP 24 HA TRP 24 9.173 3.341 7.075
168 2HB TRP 24 2HB TRP 24 7.817 1.274 7.107
169 HD1 TRP 24 HD TRP 24 7.540 4.745 5.930
170 HE1 TRP 24 1HE TRP 24 5.056 5.612 5.728
171 HE3 TRP 24 3HE TRP 24 5.359 0.160 6.222
172 HZ2 TRP 24 2HZ TRP 24 2.514 4.313 5.715
173 HZ3 TRP 24 3HZ TRP 24 2.871 0.047 6.107
174 HH2 TRP 24 HH TRP 24 1.459 2.027 5.862
175 H GLY 25 H GLY 25 9.793 0.437 4.985
176 1HA GLY 25 1HA GLY 25 11.280 -1.247 5.284
177 2HA GLY 25 2HA GLY 25 12.441 0.064 5.210
178 H TRP 26 H TRP 26 10.627 -2.132 7.339
179 HA TRP 26 HA TRP 26 12.118 -1.104 9.642
180 2HB TRP 26 2HB TRP 26 10.321 -3.063 10.496
181 HD1 TRP 26 HD TRP 26 10.942 0.717 10.063
182 HE1 TRP 26 1HE TRP 26 10.073 2.075 12.152
183 HE3 TRP 26 3HE TRP 26 8.631 -3.212 12.314
184 HZ2 TRP 26 2HZ TRP 26 8.552 1.368 14.460
185 HZ3 TRP 26 3HZ TRP 26 7.477 -2.793 14.483
186 HH2 TRP 26 HH TRP 26 7.414 -0.598 15.557
Start of MODEL 9
1 1H LYS 1 H LYS 1 -10.690 17.043 6.579
2 HA LYS 1 HA LYS 1 -9.031 17.109 9.001
3 2HB LYS 1 2HB LYS 1 -10.977 15.696 9.985
4 2HG LYS 1 2HG LYS 1 -12.254 17.911 10.477
5 2HD LYS 1 2HD LYS 1 -9.272 17.551 10.989
6 2HE LYS 1 2HE LYS 1 -10.657 19.985 11.251
7 1HZ LYS 1 1HZ LYS 1 -10.526 18.547 13.808
8 2HZ LYS 1 2HZ LYS 1 -10.696 20.166 13.686
9 3HZ LYS 1 3HZ LYS 1 -11.858 19.176 13.104
10 H SER 2 H SER 2 -11.084 14.841 7.028
11 HA SER 2 HA SER 2 -8.809 13.020 7.156
12 2HB SER 2 2HB SER 2 -11.199 11.599 6.458
13 HG SER 2 HG SER 2 -9.262 10.945 7.805
14 H SER 3 H SER 3 -8.306 11.800 5.201
15 HA SER 3 HA SER 3 -9.228 13.211 2.847
16 2HB SER 3 2HB SER 3 -6.850 13.124 2.944
17 HG SER 3 HG SER 3 -6.015 11.596 4.193
18 H ALA 4 H ALA 4 -8.645 9.829 4.054
19 HA ALA 4 HA ALA 4 -11.034 8.964 2.685
20 1HB ALA 4 1HB ALA 4 -9.700 7.082 1.570
21 2HB ALA 4 2HB ALA 4 -9.530 8.702 0.852
22 3HB ALA 4 3HB ALA 4 -8.246 8.054 1.900
23 H TYR 5 H TYR 5 -11.795 6.908 3.500
24 HA TYR 5 HA TYR 5 -10.226 5.707 5.630
25 2HB TYR 5 2HB TYR 5 -11.639 7.585 6.613
26 HD1 TYR 5 1HD TYR 5 -12.909 8.315 4.330
27 HD2 TYR 5 2HD TYR 5 -14.423 5.588 7.259
28 HE1 TYR 5 1HE TYR 5 -15.283 8.777 3.545
29 HE2 TYR 5 2HE TYR 5 -16.791 6.060 6.464
30 HH TYR 5 HH TYR 5 -17.633 8.636 4.743
31 H SER 6 H SER 6 -10.525 4.454 3.279
32 HA SER 6 HA SER 6 -12.638 2.545 3.881
33 2HB SER 6 2HB SER 6 -13.026 2.261 1.433
34 HG SER 6 HG SER 6 -14.096 4.047 2.832
35 H LEU 7 H LEU 7 -12.184 0.391 2.558
36 HA LEU 7 HA LEU 7 -9.281 -0.020 2.443
37 2HB LEU 7 2HB LEU 7 -10.613 -0.894 4.518
38 HG LEU 7 HG LEU 7 -11.258 -2.956 2.416
39 1HD1 LEU 7 1HD1 LEU 7 -11.574 -4.629 4.160
40 2HD1 LEU 7 2HD1 LEU 7 -9.880 -4.089 4.098
41 3HD1 LEU 7 3HD1 LEU 7 -10.957 -3.494 5.384
42 1HD2 LEU 7 1HD2 LEU 7 -13.066 -2.523 4.694
43 2HD2 LEU 7 2HD2 LEU 7 -12.811 -1.085 3.676
44 3HD2 LEU 7 3HD2 LEU 7 -13.404 -2.597 2.947
45 H GLN 8 H GLN 8 -8.589 -0.791 0.518
46 HA GLN 8 HA GLN 8 -10.111 -2.671 -0.910
47 2HB GLN 8 2HB GLN 8 -9.951 -0.748 -2.944
48 2HG GLN 8 2HG GLN 8 -12.470 -1.102 -1.303
49 1HE2 GLN 8 1HE2 GLN 8 -12.337 -2.788 -4.178
50 2HE2 GLN 8 2HE2 GLN 8 -13.033 -1.627 -5.259
51 H MET 9 H MET 9 -8.523 -3.991 -1.676
52 HA MET 9 HA MET 9 -6.317 -2.767 -3.053
53 2HB MET 9 2HB MET 9 -4.734 -4.337 -1.664
54 2HG MET 9 2HG MET 9 -5.937 -2.196 0.102
55 1HE MET 9 1HE MET 9 -4.708 -0.944 1.335
56 2HE MET 9 2HE MET 9 -3.656 -1.933 2.376
57 3HE MET 9 3HE MET 9 -2.946 -0.699 1.308
58 H GLY 10 H GLY 10 -7.537 -5.902 -1.665
59 1HA GLY 10 1HA GLY 10 -8.361 -7.641 -3.006
60 2HA GLY 10 2HA GLY 10 -7.436 -7.045 -4.370
61 H ALA 11 H ALA 11 -5.164 -7.511 -4.550
62 HA ALA 11 HA ALA 11 -3.957 -9.109 -2.464
63 1HB ALA 11 1HB ALA 11 -4.377 -11.098 -3.417
64 2HB ALA 11 2HB ALA 11 -5.252 -10.304 -4.749
65 3HB ALA 11 3HB ALA 11 -3.495 -10.564 -4.868
66 H THR 12 H THR 12 -3.317 -8.810 -6.013
67 HA THR 12 HA THR 12 -0.667 -8.382 -5.919
68 HB THR 12 HB THR 12 -1.794 -8.604 -8.035
69 HG1 THR 12 1HG THR 12 -0.588 -6.955 -8.954
70 1HG2 THR 12 1HG2 THR 12 -3.184 -5.939 -7.448
71 2HG2 THR 12 2HG2 THR 12 -3.402 -6.960 -8.890
72 3HG2 THR 12 3HG2 THR 12 -3.987 -7.521 -7.305
73 H ALA 13 H ALA 13 -3.172 -5.807 -5.504
74 HA ALA 13 HA ALA 13 -1.665 -3.603 -5.396
75 1HB ALA 13 1HB ALA 13 -3.355 -3.371 -3.159
76 2HB ALA 13 2HB ALA 13 -3.738 -2.925 -4.840
77 3HB ALA 13 3HB ALA 13 -4.167 -4.540 -4.228
78 H ILE 14 H ILE 14 -1.907 -6.141 -2.848
79 HA ILE 14 HA ILE 14 -0.582 -4.924 -0.814
80 HB ILE 14 HB ILE 14 -0.477 -7.790 -1.751
81 2HG1 ILE 14 2HG1 ILE 14 -2.677 -6.516 -1.021
82 1HG2 ILE 14 1HG2 ILE 14 1.454 -7.266 -0.307
83 2HG2 ILE 14 2HG2 ILE 14 0.338 -6.678 0.948
84 3HG2 ILE 14 3HG2 ILE 14 0.307 -8.390 0.462
85 1HD1 ILE 14 1HD1 ILE 14 -2.171 -9.068 -1.404
86 2HD1 ILE 14 2HD1 ILE 14 -2.115 -9.148 0.373
87 3HD1 ILE 14 3HD1 ILE 14 -3.601 -8.610 -0.447
88 H LYS 15 H LYS 15 0.910 -6.775 -3.559
89 HA LYS 15 HA LYS 15 3.518 -6.536 -2.883
90 2HB LYS 15 2HB LYS 15 2.014 -6.736 -5.442
91 2HG LYS 15 2HG LYS 15 4.525 -6.881 -6.418
92 2HD LYS 15 2HD LYS 15 3.304 -4.119 -6.132
93 2HE LYS 15 2HE LYS 15 5.114 -5.531 -7.982
94 1HZ LYS 15 1HZ LYS 15 3.511 -3.776 -9.492
95 2HZ LYS 15 2HZ LYS 15 3.985 -5.299 -9.845
96 3HZ LYS 15 3HZ LYS 15 2.628 -5.048 -8.970
97 H GLN 16 H GLN 16 1.396 -4.041 -4.377
98 HA GLN 16 HA GLN 16 3.345 -2.208 -4.944
99 2HB GLN 16 2HB GLN 16 0.596 -2.313 -5.136
100 2HG GLN 16 2HG GLN 16 1.320 -0.057 -3.206
101 1HE2 GLN 16 1HE2 GLN 16 -0.481 1.205 -2.565
102 2HE2 GLN 16 2HE2 GLN 16 -1.824 1.476 -3.626
103 H VAL 17 H VAL 17 1.554 -2.821 -1.871
104 HA VAL 17 HA VAL 17 2.449 -0.635 -0.445
105 HB VAL 17 HB VAL 17 0.714 -2.468 0.083
106 1HG1 VAL 17 1HG1 VAL 17 3.035 -4.042 0.258
107 2HG1 VAL 17 2HG1 VAL 17 2.495 -3.808 1.938
108 3HG1 VAL 17 3HG1 VAL 17 1.381 -4.497 0.734
109 1HG2 VAL 17 1HG2 VAL 17 1.141 -0.542 1.526
110 2HG2 VAL 17 2HG2 VAL 17 0.884 -2.009 2.501
111 3HG2 VAL 17 3HG2 VAL 17 2.531 -1.378 2.260
112 H LYS 18 H LYS 18 4.076 -3.683 -1.330
113 HA LYS 18 HA LYS 18 6.193 -3.446 0.503
114 2HB LYS 18 2HB LYS 18 5.429 -5.148 -1.744
115 2HG LYS 18 2HG LYS 18 7.966 -5.931 -1.825
116 2HD LYS 18 2HD LYS 18 8.245 -3.942 -3.670
117 2HE LYS 18 2HE LYS 18 6.258 -6.251 -3.913
118 1HZ LYS 18 1HZ LYS 18 6.403 -4.546 -5.712
119 2HZ LYS 18 2HZ LYS 18 7.938 -5.033 -5.981
120 3HZ LYS 18 3HZ LYS 18 6.701 -6.081 -6.181
121 H LYS 19 H LYS 19 5.558 -2.105 -2.752
122 HA LYS 19 HA LYS 19 8.194 -1.185 -3.165
123 2HB LYS 19 2HB LYS 19 5.617 -1.095 -4.519
124 2HG LYS 19 2HG LYS 19 6.404 0.974 -5.883
125 2HD LYS 19 2HD LYS 19 5.562 2.466 -3.708
126 2HE LYS 19 2HE LYS 19 3.178 1.707 -4.542
127 1HZ LYS 19 1HZ LYS 19 3.439 3.086 -6.387
128 2HZ LYS 19 2HZ LYS 19 4.521 3.651 -5.302
129 3HZ LYS 19 3HZ LYS 19 5.026 2.746 -6.564
130 H LEU 20 H LEU 20 5.623 -0.194 -1.069
131 HA LEU 20 HA LEU 20 6.574 2.544 -0.948
132 2HB LEU 20 2HB LEU 20 4.106 1.404 -0.696
133 HG LEU 20 HG LEU 20 4.722 0.674 1.673
134 1HD1 LEU 20 1HD1 LEU 20 5.455 3.454 1.836
135 2HD1 LEU 20 2HD1 LEU 20 4.181 3.087 3.023
136 3HD1 LEU 20 3HD1 LEU 20 5.692 2.145 3.019
137 1HD2 LEU 20 1HD2 LEU 20 2.365 1.507 0.564
138 2HD2 LEU 20 2HD2 LEU 20 2.538 0.738 2.160
139 3HD2 LEU 20 3HD2 LEU 20 2.456 2.511 2.031
140 H PHE 21 H PHE 21 7.230 -0.543 0.449
141 HA PHE 21 HA PHE 21 7.943 0.357 3.037
142 2HB PHE 21 2HB PHE 21 9.381 -2.002 2.005
143 HD1 PHE 21 1HD PHE 21 9.970 -2.608 4.194
144 HD2 PHE 21 2HD PHE 21 5.894 -1.878 3.267
145 HE1 PHE 21 1HE PHE 21 9.300 -3.506 6.440
146 HE2 PHE 21 2HE PHE 21 5.223 -2.775 5.514
147 HZ PHE 21 HZ PHE 21 6.934 -3.579 7.073
148 H LYS 22 H LYS 22 9.443 0.557 -0.104
149 HA LYS 22 HA LYS 22 12.119 0.370 0.545
150 2HB LYS 22 2HB LYS 22 10.744 0.760 -1.725
151 2HG LYS 22 2HG LYS 22 11.717 3.068 -2.535
152 2HD LYS 22 2HD LYS 22 9.232 2.528 -0.924
153 2HE LYS 22 2HE LYS 22 10.453 5.091 -0.866
154 1HZ LYS 22 1HZ LYS 22 8.717 4.768 -3.099
155 2HZ LYS 22 2HZ LYS 22 8.252 5.977 -2.105
156 3HZ LYS 22 3HZ LYS 22 9.751 5.983 -2.754
157 H LYS 23 H LYS 23 9.732 2.690 1.542
158 HA LYS 23 HA LYS 23 11.825 4.603 2.258
159 2HB LYS 23 2HB LYS 23 9.942 5.508 1.003
160 2HG LYS 23 2HG LYS 23 8.408 3.837 2.860
161 2HD LYS 23 2HD LYS 23 7.862 6.816 2.757
162 2HE LYS 23 2HE LYS 23 5.750 4.704 3.376
163 1HZ LYS 23 1HZ LYS 23 5.508 7.575 2.818
164 2HZ LYS 23 2HZ LYS 23 4.339 6.573 3.359
165 3HZ LYS 23 3HZ LYS 23 5.596 6.960 4.328
166 H TRP 24 H TRP 24 9.689 2.120 3.508
167 HA TRP 24 HA TRP 24 9.832 3.076 6.217
168 2HB TRP 24 2HB TRP 24 8.776 0.802 6.661
169 HD1 TRP 24 HD TRP 24 8.052 4.143 5.309
170 HE1 TRP 24 1HE TRP 24 5.492 4.778 5.338
171 HE3 TRP 24 3HE TRP 24 6.351 -0.578 6.133
172 HZ2 TRP 24 2HZ TRP 24 3.095 3.269 5.695
173 HZ3 TRP 24 3HZ TRP 24 3.887 -0.910 6.309
174 HH2 TRP 24 HH TRP 24 2.279 0.919 6.104
175 H GLY 25 H GLY 25 11.802 2.997 7.227
176 1HA GLY 25 1HA GLY 25 13.226 0.442 7.218
177 2HA GLY 25 2HA GLY 25 14.089 1.846 6.619
178 H TRP 26 H TRP 26 13.195 0.053 9.406
179 HA TRP 26 HA TRP 26 13.654 2.323 11.189
180 2HB TRP 26 2HB TRP 26 13.186 0.004 12.687
181 HD1 TRP 26 HD TRP 26 10.620 2.382 10.918
182 HE1 TRP 26 1HE TRP 26 9.319 3.821 12.708
183 HE3 TRP 26 3HE TRP 26 13.110 0.564 14.962
184 HZ2 TRP 26 2HZ TRP 26 9.474 4.032 15.549
185 HZ3 TRP 26 3HZ TRP 26 12.475 1.440 17.207
186 HH2 TRP 26 HH TRP 26 10.725 3.115 17.537
Start of MODEL 10
1 1H LYS 1 H LYS 1 -8.903 11.158 -0.971
2 HA LYS 1 HA LYS 1 -7.913 12.990 0.259
3 2HB LYS 1 2HB LYS 1 -10.726 13.025 1.224
4 2HG LYS 1 2HG LYS 1 -8.819 14.934 0.723
5 2HD LYS 1 2HD LYS 1 -10.642 14.918 -1.725
6 2HE LYS 1 2HE LYS 1 -8.085 16.498 -1.420
7 1HZ LYS 1 1HZ LYS 1 -8.921 17.033 -3.390
8 2HZ LYS 1 2HZ LYS 1 -10.418 16.466 -3.064
9 3HZ LYS 1 3HZ LYS 1 -9.988 17.964 -2.577
10 H SER 2 H SER 2 -8.433 14.234 2.502
11 HA SER 2 HA SER 2 -8.204 14.293 4.664
12 2HB SER 2 2HB SER 2 -8.936 12.439 6.107
13 HG SER 2 HG SER 2 -10.451 13.306 3.917
14 H SER 3 H SER 3 -7.042 10.996 3.624
15 HA SER 3 HA SER 3 -4.385 11.629 3.717
16 2HB SER 3 2HB SER 3 -4.488 11.986 6.091
17 HG SER 3 HG SER 3 -6.512 10.813 6.470
18 H ALA 4 H ALA 4 -6.524 8.971 5.005
19 HA ALA 4 HA ALA 4 -6.759 6.851 4.420
20 1HB ALA 4 1HB ALA 4 -7.494 7.518 2.280
21 2HB ALA 4 2HB ALA 4 -5.870 8.057 1.789
22 3HB ALA 4 3HB ALA 4 -6.224 6.319 1.935
23 H TYR 5 H TYR 5 -5.599 4.873 4.494
24 HA TYR 5 HA TYR 5 -2.899 4.657 3.761
25 2HB TYR 5 2HB TYR 5 -2.830 6.236 5.807
26 HD1 TYR 5 1HD TYR 5 -2.088 3.763 8.094
27 HD2 TYR 5 2HD TYR 5 -5.469 5.860 6.520
28 HE1 TYR 5 1HE TYR 5 -3.402 3.247 10.208
29 HE2 TYR 5 2HE TYR 5 -6.772 5.337 8.639
30 HH TYR 5 HH TYR 5 -6.740 3.644 10.396
31 H SER 6 H SER 6 -4.769 2.976 3.016
32 HA SER 6 HA SER 6 -4.220 0.666 4.653
33 2HB SER 6 2HB SER 6 -6.741 0.006 4.245
34 HG SER 6 HG SER 6 -5.594 1.678 6.228
35 H LEU 7 H LEU 7 -5.773 2.062 1.696
36 HA LEU 7 HA LEU 7 -6.017 1.263 -0.361
37 2HB LEU 7 2HB LEU 7 -3.616 -0.073 -0.853
38 HG LEU 7 HG LEU 7 -4.826 2.261 -1.749
39 1HD1 LEU 7 1HD1 LEU 7 -2.883 3.898 -1.680
40 2HD1 LEU 7 2HD1 LEU 7 -3.826 3.712 -0.182
41 3HD1 LEU 7 3HD1 LEU 7 -2.238 2.923 -0.339
42 1HD2 LEU 7 1HD2 LEU 7 -3.739 0.738 -3.215
43 2HD2 LEU 7 2HD2 LEU 7 -2.903 2.301 -3.373
44 3HD2 LEU 7 3HD2 LEU 7 -2.165 0.989 -2.422
45 H GLN 8 H GLN 8 -7.719 -0.204 -0.197
46 HA GLN 8 HA GLN 8 -6.881 -2.938 -0.444
47 2HB GLN 8 2HB GLN 8 -9.044 -3.262 1.271
48 2HG GLN 8 2HG GLN 8 -6.048 -3.201 1.858
49 1HE2 GLN 8 1HE2 GLN 8 -7.961 -5.807 2.855
50 2HE2 GLN 8 2HE2 GLN 8 -8.069 -5.464 4.550
51 H MET 9 H MET 9 -8.233 -4.096 -1.838
52 HA MET 9 HA MET 9 -10.904 -3.355 -2.246
53 2HB MET 9 2HB MET 9 -9.828 -1.473 -3.490
54 2HG MET 9 2HG MET 9 -8.607 -3.576 -5.327
55 1HE MET 9 1HE MET 9 -6.680 -1.532 -7.541
56 2HE MET 9 2HE MET 9 -7.303 -3.091 -6.952
57 3HE MET 9 3HE MET 9 -8.344 -2.030 -7.930
58 H GLY 10 H GLY 10 -7.920 -4.909 -3.525
59 1HA GLY 10 1HA GLY 10 -9.596 -7.142 -4.506
60 2HA GLY 10 2HA GLY 10 -8.068 -6.651 -5.210
61 H ALA 11 H ALA 11 -6.055 -7.045 -4.052
62 HA ALA 11 HA ALA 11 -5.824 -8.103 -1.538
63 1HB ALA 11 1HB ALA 11 -5.405 -10.551 -2.981
64 2HB ALA 11 2HB ALA 11 -6.527 -10.232 -1.636
65 3HB ALA 11 3HB ALA 11 -7.056 -9.975 -3.316
66 H THR 12 H THR 12 -4.749 -8.746 -4.947
67 HA THR 12 HA THR 12 -2.028 -9.036 -4.231
68 HB THR 12 HB THR 12 -1.722 -9.153 -6.634
69 HG1 THR 12 1HG THR 12 -4.398 -7.960 -6.743
70 1HG2 THR 12 1HG2 THR 12 -3.932 -10.530 -5.414
71 2HG2 THR 12 2HG2 THR 12 -4.485 -9.965 -7.009
72 3HG2 THR 12 3HG2 THR 12 -3.043 -11.001 -6.882
73 H ALA 13 H ALA 13 -3.977 -6.253 -5.448
74 HA ALA 13 HA ALA 13 -2.038 -4.444 -5.921
75 1HB ALA 13 1HB ALA 13 -4.130 -3.590 -6.308
76 2HB ALA 13 2HB ALA 13 -4.829 -4.350 -4.858
77 3HB ALA 13 3HB ALA 13 -3.859 -2.864 -4.706
78 H ILE 14 H ILE 14 -3.300 -5.490 -2.707
79 HA ILE 14 HA ILE 14 -2.098 -3.671 -1.092
80 HB ILE 14 HB ILE 14 -2.494 -6.636 -0.700
81 2HG1 ILE 14 2HG1 ILE 14 -4.466 -5.030 -1.185
82 1HG2 ILE 14 1HG2 ILE 14 -0.904 -4.976 0.871
83 2HG2 ILE 14 2HG2 ILE 14 -2.463 -5.037 1.727
84 3HG2 ILE 14 3HG2 ILE 14 -1.603 -6.545 1.335
85 1HD1 ILE 14 1HD1 ILE 14 -4.847 -6.345 1.483
86 2HD1 ILE 14 2HD1 ILE 14 -5.836 -6.462 0.007
87 3HD1 ILE 14 3HD1 ILE 14 -4.320 -7.385 0.137
88 H LYS 15 H LYS 15 -0.621 -6.726 -2.382
89 HA LYS 15 HA LYS 15 1.815 -6.562 -1.209
90 2HB LYS 15 2HB LYS 15 0.647 -7.859 -3.524
91 2HG LYS 15 2HG LYS 15 3.063 -8.355 -4.438
92 2HD LYS 15 2HD LYS 15 2.542 -5.655 -5.398
93 2HE LYS 15 2HE LYS 15 3.408 -7.707 -6.677
94 1HZ LYS 15 1HZ LYS 15 1.805 -9.286 -6.002
95 2HZ LYS 15 2HZ LYS 15 0.553 -8.372 -6.517
96 3HZ LYS 15 3HZ LYS 15 1.578 -9.037 -7.600
97 H GLN 16 H GLN 16 0.632 -4.762 -4.099
98 HA GLN 16 HA GLN 16 3.024 -3.642 -4.813
99 2HB GLN 16 2HB GLN 16 1.640 -1.884 -5.913
100 2HG GLN 16 2HG GLN 16 0.022 -3.488 -7.106
101 1HE2 GLN 16 1HE2 GLN 16 0.860 -3.975 -8.998
102 2HE2 GLN 16 2HE2 GLN 16 2.530 -4.267 -9.350
103 H VAL 17 H VAL 17 0.593 -2.583 -2.368
104 HA VAL 17 HA VAL 17 1.656 -0.108 -1.780
105 HB VAL 17 HB VAL 17 -0.496 -1.329 -1.019
106 1HG1 VAL 17 1HG1 VAL 17 0.608 -1.808 1.627
107 2HG1 VAL 17 2HG1 VAL 17 -0.402 -2.860 0.607
108 3HG1 VAL 17 3HG1 VAL 17 1.367 -2.859 0.406
109 1HG2 VAL 17 1HG2 VAL 17 0.026 0.999 -0.485
110 2HG2 VAL 17 2HG2 VAL 17 -0.715 0.185 0.913
111 3HG2 VAL 17 3HG2 VAL 17 1.041 0.476 0.880
112 H LYS 18 H LYS 18 2.724 -3.387 -0.870
113 HA LYS 18 HA LYS 18 4.461 -2.588 1.188
114 2HB LYS 18 2HB LYS 18 3.771 -5.020 -0.263
115 2HG LYS 18 2HG LYS 18 6.068 -6.035 0.607
116 2HD LYS 18 2HD LYS 18 7.066 -5.160 -1.764
117 2HE LYS 18 2HE LYS 18 5.595 -6.951 -2.857
118 1HZ LYS 18 1HZ LYS 18 7.558 -7.692 -1.890
119 2HZ LYS 18 2HZ LYS 18 7.036 -7.463 -0.360
120 3HZ LYS 18 3HZ LYS 18 6.419 -8.678 -1.261
121 H LYS 19 H LYS 19 4.758 -2.804 -2.373
122 HA LYS 19 HA LYS 19 7.558 -2.457 -2.413
123 2HB LYS 19 2HB LYS 19 5.365 -2.708 -4.314
124 2HG LYS 19 2HG LYS 19 6.820 -1.578 -6.147
125 2HD LYS 19 2HD LYS 19 5.929 0.818 -5.075
126 2HE LYS 19 2HE LYS 19 4.311 -1.387 -6.439
127 1HZ LYS 19 1HZ LYS 19 2.650 0.000 -6.033
128 2HZ LYS 19 2HZ LYS 19 3.615 1.223 -5.542
129 3HZ LYS 19 3HZ LYS 19 3.324 1.002 -7.133
130 H LEU 20 H LEU 20 4.907 -0.356 -1.677
131 HA LEU 20 HA LEU 20 6.384 2.022 -2.444
132 2HB LEU 20 2HB LEU 20 3.726 1.393 -2.420
133 HG LEU 20 HG LEU 20 3.710 1.758 0.112
134 1HD1 LEU 20 1HD1 LEU 20 3.441 4.585 0.068
135 2HD1 LEU 20 2HD1 LEU 20 4.620 3.591 0.959
136 3HD1 LEU 20 3HD1 LEU 20 5.006 4.179 -0.677
137 1HD2 LEU 20 1HD2 LEU 20 1.533 2.246 -0.078
138 2HD2 LEU 20 2HD2 LEU 20 1.847 3.771 -0.942
139 3HD2 LEU 20 3HD2 LEU 20 1.839 2.229 -1.832
140 H PHE 21 H PHE 21 6.060 -0.150 0.222
141 HA PHE 21 HA PHE 21 6.435 1.733 2.299
142 2HB PHE 21 2HB PHE 21 7.515 -0.975 2.751
143 HD1 PHE 21 1HD PHE 21 3.963 0.106 2.866
144 HD2 PHE 21 2HD PHE 21 7.516 -0.629 5.066
145 HE1 PHE 21 1HE PHE 21 2.692 0.389 5.011
146 HE2 PHE 21 2HE PHE 21 6.245 -0.346 7.213
147 HZ PHE 21 HZ PHE 21 3.848 0.159 7.159
148 H LYS 22 H LYS 22 8.524 0.393 -0.134
149 HA LYS 22 HA LYS 22 10.919 0.091 1.095
150 2HB LYS 22 2HB LYS 22 10.142 -0.052 -1.421
151 2HG LYS 22 2HG LYS 22 11.549 1.870 -2.582
152 2HD LYS 22 2HD LYS 22 8.729 2.082 -1.473
153 2HE LYS 22 2HE LYS 22 9.858 4.399 -1.820
154 1HZ LYS 22 1HZ LYS 22 10.650 3.303 -4.120
155 2HZ LYS 22 2HZ LYS 22 9.340 4.142 -4.614
156 3HZ LYS 22 3HZ LYS 22 10.560 4.911 -3.848
157 H LYS 23 H LYS 23 9.032 3.037 0.701
158 HA LYS 23 HA LYS 23 11.329 4.643 1.519
159 2HB LYS 23 2HB LYS 23 10.261 5.625 -0.321
160 2HG LYS 23 2HG LYS 23 7.805 4.523 0.946
161 2HD LYS 23 2HD LYS 23 7.958 7.360 0.405
162 2HE LYS 23 2HE LYS 23 5.865 7.369 -1.118
163 1HZ LYS 23 1HZ LYS 23 8.577 7.192 -1.755
164 2HZ LYS 23 2HZ LYS 23 7.713 6.491 -2.950
165 3HZ LYS 23 3HZ LYS 23 7.405 8.035 -2.519
166 H TRP 24 H TRP 24 8.177 3.372 2.591
167 HA TRP 24 HA TRP 24 8.046 5.005 4.914
168 2HB TRP 24 2HB TRP 24 6.277 3.384 5.590
169 HD1 TRP 24 HD TRP 24 6.993 5.726 2.778
170 HE1 TRP 24 1HE TRP 24 4.813 6.760 1.710
171 HE3 TRP 24 3HE TRP 24 3.744 2.513 5.007
172 HZ2 TRP 24 2HZ TRP 24 2.037 6.133 1.914
173 HZ3 TRP 24 3HZ TRP 24 1.315 2.792 4.519
174 HH2 TRP 24 HH TRP 24 0.447 4.526 3.032
175 H GLY 25 H GLY 25 8.347 4.220 7.150
176 1HA GLY 25 1HA GLY 25 10.130 1.880 7.364
177 2HA GLY 25 2HA GLY 25 10.602 3.424 8.044
178 H TRP 26 H TRP 26 10.490 3.076 10.251
179 HA TRP 26 HA TRP 26 8.063 1.811 11.281
180 2HB TRP 26 2HB TRP 26 9.629 2.126 13.446
181 HD1 TRP 26 HD TRP 26 7.685 -0.096 11.893
182 HE1 TRP 26 1HE TRP 26 8.272 -2.666 12.018
183 HE3 TRP 26 3HE TRP 26 12.584 0.545 13.097
184 HZ2 TRP 26 2HZ TRP 26 10.665 -4.109 12.594
185 HZ3 TRP 26 3HZ TRP 26 13.976 -1.497 13.423
186 HH2 TRP 26 HH TRP 26 13.090 -3.764 13.191
Start of MODEL 11
1 1H LYS 1 H LYS 1 -9.800 13.439 2.758
2 HA LYS 1 HA LYS 1 -7.465 13.991 1.915
3 2HB LYS 1 2HB LYS 1 -7.853 16.426 2.035
4 2HG LYS 1 2HG LYS 1 -7.301 16.515 4.955
5 2HD LYS 1 2HD LYS 1 -9.555 18.072 4.268
6 2HE LYS 1 2HE LYS 1 -6.903 19.359 3.882
7 1HZ LYS 1 1HZ LYS 1 -8.415 20.839 4.560
8 2HZ LYS 1 2HZ LYS 1 -9.350 19.751 5.339
9 3HZ LYS 1 3HZ LYS 1 -8.007 20.336 6.059
10 H SER 2 H SER 2 -8.323 11.862 3.099
11 HA SER 2 HA SER 2 -7.456 11.962 5.865
12 2HB SER 2 2HB SER 2 -8.630 9.494 4.591
13 HG SER 2 HG SER 2 -8.034 10.232 7.069
14 H SER 3 H SER 3 -6.137 9.975 6.629
15 HA SER 3 HA SER 3 -4.220 9.345 4.525
16 2HB SER 3 2HB SER 3 -3.582 9.112 7.471
17 HG SER 3 HG SER 3 -2.139 9.596 5.029
18 H ALA 4 H ALA 4 -5.694 7.534 3.893
19 HA ALA 4 HA ALA 4 -4.870 5.107 4.973
20 1HB ALA 4 1HB ALA 4 -7.590 4.847 5.670
21 2HB ALA 4 2HB ALA 4 -6.195 4.872 6.774
22 3HB ALA 4 3HB ALA 4 -7.060 6.381 6.401
23 H TYR 5 H TYR 5 -7.983 6.540 3.743
24 HA TYR 5 HA TYR 5 -9.290 5.829 2.059
25 2HB TYR 5 2HB TYR 5 -7.349 5.634 -0.011
26 HD1 TYR 5 1HD TYR 5 -8.520 8.351 2.308
27 HD2 TYR 5 2HD TYR 5 -8.147 6.974 -1.724
28 HE1 TYR 5 1HE TYR 5 -9.759 10.413 1.482
29 HE2 TYR 5 2HE TYR 5 -9.387 9.039 -2.537
30 HH TYR 5 HH TYR 5 -9.777 11.730 -0.738
31 H SER 6 H SER 6 -9.739 3.660 2.922
32 HA SER 6 HA SER 6 -9.865 1.497 2.793
33 2HB SER 6 2HB SER 6 -9.647 0.426 0.562
34 HG SER 6 HG SER 6 -10.667 3.067 0.063
35 H LEU 7 H LEU 7 -8.566 -0.653 2.412
36 HA LEU 7 HA LEU 7 -5.693 -0.190 2.432
37 2HB LEU 7 2HB LEU 7 -5.980 -0.044 4.710
38 HG LEU 7 HG LEU 7 -8.423 -1.464 4.376
39 1HD1 LEU 7 1HD1 LEU 7 -6.453 -2.861 6.194
40 2HD1 LEU 7 2HD1 LEU 7 -8.218 -3.014 6.365
41 3HD1 LEU 7 3HD1 LEU 7 -7.420 -3.550 4.868
42 1HD2 LEU 7 1HD2 LEU 7 -7.042 -0.043 6.644
43 2HD2 LEU 7 2HD2 LEU 7 -8.436 0.476 5.667
44 3HD2 LEU 7 3HD2 LEU 7 -8.625 -0.826 6.866
45 H GLN 8 H GLN 8 -8.409 -2.576 2.675
46 HA GLN 8 HA GLN 8 -6.882 -4.194 0.790
47 2HB GLN 8 2HB GLN 8 -8.770 -5.615 2.615
48 2HG GLN 8 2HG GLN 8 -6.140 -6.704 2.629
49 1HE2 GLN 8 1HE2 GLN 8 -6.485 -8.787 2.706
50 2HE2 GLN 8 2HE2 GLN 8 -7.836 -9.651 2.052
51 H MET 9 H MET 9 -8.036 -5.029 -0.974
52 HA MET 9 HA MET 9 -10.850 -5.131 -0.941
53 2HB MET 9 2HB MET 9 -10.740 -2.720 -1.277
54 2HG MET 9 2HG MET 9 -8.978 -2.953 -3.708
55 1HE MET 9 1HE MET 9 -6.877 -0.348 -2.563
56 2HE MET 9 2HE MET 9 -7.668 0.281 -1.098
57 3HE MET 9 3HE MET 9 -7.251 -1.445 -1.213
58 H GLY 10 H GLY 10 -7.845 -4.865 -2.932
59 1HA GLY 10 1HA GLY 10 -8.968 -6.822 -4.824
60 2HA GLY 10 2HA GLY 10 -7.615 -5.747 -5.111
61 H ALA 11 H ALA 11 -5.506 -6.292 -4.383
62 HA ALA 11 HA ALA 11 -4.730 -8.056 -2.527
63 1HB ALA 11 1HB ALA 11 -5.990 -9.462 -4.799
64 2HB ALA 11 2HB ALA 11 -4.363 -10.058 -4.390
65 3HB ALA 11 3HB ALA 11 -5.640 -10.036 -3.151
66 H THR 12 H THR 12 -4.402 -7.222 -6.016
67 HA THR 12 HA THR 12 -1.565 -7.559 -6.003
68 HB THR 12 HB THR 12 -3.199 -5.937 -7.996
69 HG1 THR 12 1HG THR 12 -4.353 -7.804 -8.266
70 1HG2 THR 12 1HG2 THR 12 -1.675 -6.847 -9.608
71 2HG2 THR 12 2HG2 THR 12 -0.635 -6.436 -8.223
72 3HG2 THR 12 3HG2 THR 12 -1.133 -8.124 -8.492
73 H ALA 13 H ALA 13 -3.790 -4.713 -5.850
74 HA ALA 13 HA ALA 13 -2.009 -2.695 -5.938
75 1HB ALA 13 1HB ALA 13 -4.624 -3.202 -4.643
76 2HB ALA 13 2HB ALA 13 -3.691 -1.865 -3.931
77 3HB ALA 13 3HB ALA 13 -4.097 -1.843 -5.664
78 H ILE 14 H ILE 14 -2.700 -4.866 -3.142
79 HA ILE 14 HA ILE 14 -1.373 -3.646 -1.149
80 HB ILE 14 HB ILE 14 -1.661 -6.520 -1.931
81 2HG1 ILE 14 2HG1 ILE 14 -3.014 -4.576 -0.171
82 1HG2 ILE 14 1HG2 ILE 14 -0.678 -7.205 0.210
83 2HG2 ILE 14 2HG2 ILE 14 0.518 -6.418 -0.848
84 3HG2 ILE 14 3HG2 ILE 14 -0.184 -5.523 0.521
85 1HD1 ILE 14 1HD1 ILE 14 -4.821 -5.467 -1.215
86 2HD1 ILE 14 2HD1 ILE 14 -3.671 -6.343 -2.253
87 3HD1 ILE 14 3HD1 ILE 14 -4.329 -7.125 -0.795
88 H LYS 15 H LYS 15 0.155 -5.782 -3.658
89 HA LYS 15 HA LYS 15 2.728 -5.655 -2.832
90 2HB LYS 15 2HB LYS 15 1.374 -5.944 -5.466
91 2HG LYS 15 2HG LYS 15 3.916 -6.329 -6.267
92 2HD LYS 15 2HD LYS 15 2.954 -3.458 -6.227
93 2HE LYS 15 2HE LYS 15 4.308 -5.340 -8.188
94 1HZ LYS 15 1HZ LYS 15 2.959 -2.803 -8.808
95 2HZ LYS 15 2HZ LYS 15 3.952 -3.608 -9.823
96 3HZ LYS 15 3HZ LYS 15 2.532 -4.275 -9.371
97 H GLN 16 H GLN 16 0.877 -3.154 -4.647
98 HA GLN 16 HA GLN 16 2.977 -1.493 -5.202
99 2HB GLN 16 2HB GLN 16 0.269 -1.444 -5.623
100 2HG GLN 16 2HG GLN 16 0.922 0.868 -3.733
101 1HE2 GLN 16 1HE2 GLN 16 0.311 2.337 -5.359
102 2HE2 GLN 16 2HE2 GLN 16 -1.342 2.561 -5.823
103 H VAL 17 H VAL 17 0.946 -1.756 -2.231
104 HA VAL 17 HA VAL 17 1.878 0.472 -0.903
105 HB VAL 17 HB VAL 17 0.009 -1.228 -0.371
106 1HG1 VAL 17 1HG1 VAL 17 0.517 -3.226 0.491
107 2HG1 VAL 17 2HG1 VAL 17 2.219 -2.897 0.085
108 3HG1 VAL 17 3HG1 VAL 17 1.596 -2.497 1.704
109 1HG2 VAL 17 1HG2 VAL 17 0.482 0.798 0.944
110 2HG2 VAL 17 2HG2 VAL 17 0.006 -0.563 1.989
111 3HG2 VAL 17 3HG2 VAL 17 1.718 -0.090 1.869
112 H LYS 18 H LYS 18 3.373 -2.720 -1.447
113 HA LYS 18 HA LYS 18 5.379 -2.457 0.503
114 2HB LYS 18 2HB LYS 18 4.659 -4.285 -1.657
115 2HG LYS 18 2HG LYS 18 7.149 -5.206 -1.510
116 2HD LYS 18 2HD LYS 18 7.655 -3.391 -3.479
117 2HE LYS 18 2HE LYS 18 5.555 -5.604 -3.675
118 1HZ LYS 18 1HZ LYS 18 7.421 -4.608 -5.707
119 2HZ LYS 18 2HZ LYS 18 6.185 -5.655 -5.918
120 3HZ LYS 18 3HZ LYS 18 5.878 -4.085 -5.591
121 H LYS 19 H LYS 19 5.044 -1.354 -2.886
122 HA LYS 19 HA LYS 19 7.748 -0.613 -3.185
123 2HB LYS 19 2HB LYS 19 5.269 -0.476 -4.708
124 2HG LYS 19 2HG LYS 19 6.266 1.437 -6.161
125 2HD LYS 19 2HD LYS 19 5.384 3.132 -4.160
126 2HE LYS 19 2HE LYS 19 3.016 2.461 -5.096
127 1HZ LYS 19 1HZ LYS 19 3.800 3.335 -7.334
128 2HZ LYS 19 2HZ LYS 19 3.999 4.299 -6.031
129 3HZ LYS 19 3HZ LYS 19 5.272 3.480 -6.642
130 H LEU 20 H LEU 20 5.117 0.684 -1.344
131 HA LEU 20 HA LEU 20 6.240 3.360 -1.350
132 2HB LEU 20 2HB LEU 20 3.685 2.392 -1.194
133 HG LEU 20 HG LEU 20 4.060 1.829 1.254
134 1HD1 LEU 20 1HD1 LEU 20 5.084 3.302 2.555
135 2HD1 LEU 20 2HD1 LEU 20 5.067 4.523 1.261
136 3HD1 LEU 20 3HD1 LEU 20 3.686 4.389 2.376
137 1HD2 LEU 20 1HD2 LEU 20 1.872 2.849 -0.077
138 2HD2 LEU 20 2HD2 LEU 20 1.865 2.110 1.542
139 3HD2 LEU 20 3HD2 LEU 20 1.974 3.878 1.372
140 H PHE 21 H PHE 21 6.537 0.348 0.332
141 HA PHE 21 HA PHE 21 7.118 1.368 2.893
142 2HB PHE 21 2HB PHE 21 8.527 -1.103 2.090
143 HD1 PHE 21 1HD PHE 21 8.954 -1.654 4.323
144 HD2 PHE 21 2HD PHE 21 4.986 -0.716 3.146
145 HE1 PHE 21 1HE PHE 21 8.113 -2.395 6.569
146 HE2 PHE 21 2HE PHE 21 4.145 -1.458 5.391
147 HZ PHE 21 HZ PHE 21 5.718 -2.288 7.076
148 H LYS 22 H LYS 22 8.855 1.412 -0.110
149 HA LYS 22 HA LYS 22 11.450 1.054 0.559
150 2HB LYS 22 2HB LYS 22 10.301 1.737 -1.673
151 2HG LYS 22 2HG LYS 22 10.975 4.198 -2.163
152 2HD LYS 22 2HD LYS 22 8.603 3.268 -0.547
153 2HE LYS 22 2HE LYS 22 9.568 6.062 -0.722
154 1HZ LYS 22 1HZ LYS 22 6.757 5.519 -1.353
155 2HZ LYS 22 2HZ LYS 22 7.507 6.969 -1.308
156 3HZ LYS 22 3HZ LYS 22 7.856 5.905 -2.497
157 H LYS 23 H LYS 23 9.373 3.907 1.266
158 HA LYS 23 HA LYS 23 11.576 5.289 2.496
159 2HB LYS 23 2HB LYS 23 9.798 6.454 1.206
160 2HG LYS 23 2HG LYS 23 8.021 6.021 3.632
161 2HD LYS 23 2HD LYS 23 6.776 6.419 1.010
162 2HE LYS 23 2HE LYS 23 6.783 7.868 3.690
163 1HZ LYS 23 1HZ LYS 23 5.748 9.547 2.744
164 2HZ LYS 23 2HZ LYS 23 6.129 8.960 1.269
165 3HZ LYS 23 3HZ LYS 23 4.699 8.576 1.956
166 H TRP 24 H TRP 24 8.545 3.604 3.523
167 HA TRP 24 HA TRP 24 8.784 4.091 6.236
168 2HB TRP 24 2HB TRP 24 7.402 2.019 6.476
169 HD1 TRP 24 HD TRP 24 7.200 5.405 5.328
170 HE1 TRP 24 1HE TRP 24 4.765 6.286 4.817
171 HE3 TRP 24 3HE TRP 24 5.020 0.816 5.103
172 HZ2 TRP 24 2HZ TRP 24 2.258 4.994 4.386
173 HZ3 TRP 24 3HZ TRP 24 2.575 0.714 4.632
174 HH2 TRP 24 HH TRP 24 1.202 2.706 4.280
175 H GLY 25 H GLY 25 9.692 2.795 7.969
176 1HA GLY 25 1HA GLY 25 12.072 1.303 7.102
177 2HA GLY 25 2HA GLY 25 11.801 2.037 8.670
178 H TRP 26 H TRP 26 10.705 0.900 10.311
179 HA TRP 26 HA TRP 26 9.625 -1.717 9.554
180 2HB TRP 26 2HB TRP 26 10.752 -2.317 11.924
181 HD1 TRP 26 HD TRP 26 12.613 -1.802 8.507
182 HE1 TRP 26 1HE TRP 26 13.442 -4.120 7.559
183 HE3 TRP 26 3HE TRP 26 10.734 -4.620 12.299
184 HZ2 TRP 26 2HZ TRP 26 13.225 -6.812 8.480
185 HZ3 TRP 26 3HZ TRP 26 11.086 -7.085 12.199
186 HH2 TRP 26 HH TRP 26 12.283 -8.186 10.374
Start of MODEL 12
1 1H LYS 1 H LYS 1 -1.326 8.251 5.350
2 HA LYS 1 HA LYS 1 -1.875 5.505 5.958
3 2HB LYS 1 2HB LYS 1 -1.514 6.751 8.520
4 2HG LYS 1 2HG LYS 1 0.369 4.763 8.345
5 2HD LYS 1 2HD LYS 1 -2.355 5.029 9.255
6 2HE LYS 1 2HE LYS 1 -2.968 2.570 9.106
7 1HZ LYS 1 1HZ LYS 1 -2.943 3.183 6.374
8 2HZ LYS 1 2HZ LYS 1 -4.204 3.190 7.412
9 3HZ LYS 1 3HZ LYS 1 -3.293 4.532 7.224
10 H SER 2 H SER 2 -2.320 8.819 7.396
11 HA SER 2 HA SER 2 -4.780 8.589 8.320
12 2HB SER 2 2HB SER 2 -3.961 10.982 6.624
13 HG SER 2 HG SER 2 -6.063 10.558 8.189
14 H SER 3 H SER 3 -4.032 9.554 4.886
15 HA SER 3 HA SER 3 -6.709 9.457 4.107
16 2HB SER 3 2HB SER 3 -5.235 10.770 2.776
17 HG SER 3 HG SER 3 -3.666 8.500 1.998
18 H ALA 4 H ALA 4 -7.957 7.627 4.011
19 HA ALA 4 HA ALA 4 -6.604 5.145 3.203
20 1HB ALA 4 1HB ALA 4 -8.374 4.004 4.554
21 2HB ALA 4 2HB ALA 4 -7.320 5.055 5.530
22 3HB ALA 4 3HB ALA 4 -8.954 5.602 5.083
23 H TYR 5 H TYR 5 -7.078 4.703 1.107
24 HA TYR 5 HA TYR 5 -9.881 4.987 0.305
25 2HB TYR 5 2HB TYR 5 -9.022 5.983 -1.833
26 HD1 TYR 5 1HD TYR 5 -6.451 7.892 -1.195
27 HD2 TYR 5 2HD TYR 5 -10.263 7.153 0.601
28 HE1 TYR 5 1HE TYR 5 -6.436 10.226 -0.185
29 HE2 TYR 5 2HE TYR 5 -10.234 9.489 1.605
30 HH TYR 5 HH TYR 5 -7.864 11.175 2.173
31 H SER 6 H SER 6 -8.870 2.576 1.166
32 HA SER 6 HA SER 6 -7.549 1.138 -0.810
33 2HB SER 6 2HB SER 6 -7.484 0.198 1.350
34 HG SER 6 HG SER 6 -9.125 0.246 2.752
35 H LEU 7 H LEU 7 -8.370 -0.440 -2.348
36 HA LEU 7 HA LEU 7 -11.110 0.175 -3.171
37 2HB LEU 7 2HB LEU 7 -8.593 -0.521 -4.568
38 HG LEU 7 HG LEU 7 -9.879 -2.376 -5.398
39 1HD1 LEU 7 1HD1 LEU 7 -12.097 -2.430 -5.651
40 2HD1 LEU 7 2HD1 LEU 7 -12.110 -0.889 -4.759
41 3HD1 LEU 7 3HD1 LEU 7 -12.126 -0.887 -6.539
42 1HD2 LEU 7 1HD2 LEU 7 -10.400 -1.345 -7.814
43 2HD2 LEU 7 2HD2 LEU 7 -9.440 -0.008 -7.138
44 3HD2 LEU 7 3HD2 LEU 7 -8.750 -1.646 -7.221
45 H GLN 8 H GLN 8 -8.803 -2.569 -2.646
46 HA GLN 8 HA GLN 8 -11.176 -4.199 -2.174
47 2HB GLN 8 2HB GLN 8 -8.573 -5.050 -3.519
48 2HG GLN 8 2HG GLN 8 -10.404 -6.614 -2.012
49 1HE2 GLN 8 1HE2 GLN 8 -12.490 -6.079 -2.942
50 2HE2 GLN 8 2HE2 GLN 8 -13.094 -6.974 -4.295
51 H MET 9 H MET 9 -8.160 -5.845 -1.870
52 HA MET 9 HA MET 9 -7.266 -4.986 0.571
53 2HB MET 9 2HB MET 9 -9.520 -5.709 1.406
54 2HG MET 9 2HG MET 9 -8.657 -8.432 0.317
55 1HE MET 9 1HE MET 9 -12.750 -8.946 1.356
56 2HE MET 9 2HE MET 9 -11.836 -8.462 -0.093
57 3HE MET 9 3HE MET 9 -11.628 -10.094 0.587
58 H GLY 10 H GLY 10 -7.914 -7.690 -1.667
59 1HA GLY 10 1HA GLY 10 -5.285 -8.844 -0.949
60 2HA GLY 10 2HA GLY 10 -6.657 -9.766 -1.534
61 H ALA 11 H ALA 11 -5.432 -6.559 -2.686
62 HA ALA 11 HA ALA 11 -4.103 -7.602 -4.936
63 1HB ALA 11 1HB ALA 11 -5.692 -7.703 -6.539
64 2HB ALA 11 2HB ALA 11 -6.864 -7.735 -5.201
65 3HB ALA 11 3HB ALA 11 -6.458 -6.193 -5.992
66 H THR 12 H THR 12 -6.204 -4.852 -3.825
67 HA THR 12 HA THR 12 -4.434 -2.926 -5.003
68 HB THR 12 HB THR 12 -6.071 -1.342 -4.066
69 HG1 THR 12 1HG THR 12 -7.004 -1.996 -2.169
70 1HG2 THR 12 1HG2 THR 12 -6.855 -3.576 -5.692
71 2HG2 THR 12 2HG2 THR 12 -8.134 -3.350 -4.474
72 3HG2 THR 12 3HG2 THR 12 -7.680 -2.005 -5.547
73 H ALA 13 H ALA 13 -5.130 -4.115 -1.667
74 HA ALA 13 HA ALA 13 -3.558 -2.345 -0.285
75 1HB ALA 13 1HB ALA 13 -4.671 -5.054 0.092
76 2HB ALA 13 2HB ALA 13 -3.212 -4.732 1.059
77 3HB ALA 13 3HB ALA 13 -4.632 -3.669 1.208
78 H ILE 14 H ILE 14 -2.640 -5.198 -2.243
79 HA ILE 14 HA ILE 14 -0.102 -5.644 -1.413
80 HB ILE 14 HB ILE 14 -1.471 -5.785 -4.063
81 2HG1 ILE 14 2HG1 ILE 14 -0.677 -7.616 -1.876
82 1HG2 ILE 14 1HG2 ILE 14 0.773 -5.092 -4.670
83 2HG2 ILE 14 2HG2 ILE 14 1.475 -6.348 -3.621
84 3HG2 ILE 14 3HG2 ILE 14 0.536 -6.813 -5.059
85 1HD1 ILE 14 1HD1 ILE 14 -2.860 -8.204 -2.084
86 2HD1 ILE 14 2HD1 ILE 14 -3.023 -6.843 -3.220
87 3HD1 ILE 14 3HD1 ILE 14 -2.684 -8.478 -3.833
88 H LYS 15 H LYS 15 -1.247 -3.047 -3.652
89 HA LYS 15 HA LYS 15 1.277 -2.018 -4.215
90 2HB LYS 15 2HB LYS 15 -1.120 -1.584 -5.232
91 2HG LYS 15 2HG LYS 15 -1.833 -0.407 -3.037
92 2HD LYS 15 2HD LYS 15 0.429 1.290 -3.914
93 2HE LYS 15 2HE LYS 15 -1.647 2.622 -4.663
94 1HZ LYS 15 1HZ LYS 15 -2.119 3.378 -1.957
95 2HZ LYS 15 2HZ LYS 15 -3.187 3.111 -3.164
96 3HZ LYS 15 3HZ LYS 15 -2.611 1.856 -2.290
97 H GLN 16 H GLN 16 -1.030 -1.418 -1.523
98 HA GLN 16 HA GLN 16 0.210 0.772 -0.455
99 2HB GLN 16 2HB GLN 16 -0.904 0.127 1.668
100 2HG GLN 16 2HG GLN 16 -2.627 -0.639 -0.734
101 1HE2 GLN 16 1HE2 GLN 16 -4.785 -0.514 -0.390
102 2HE2 GLN 16 2HE2 GLN 16 -5.528 -0.322 1.163
103 H VAL 17 H VAL 17 1.208 -2.606 -0.510
104 HA VAL 17 HA VAL 17 2.800 -2.771 1.716
105 HB VAL 17 HB VAL 17 3.286 -3.892 -1.052
106 1HG1 VAL 17 1HG1 VAL 17 4.613 -5.600 0.004
107 2HG1 VAL 17 2HG1 VAL 17 5.242 -4.014 0.512
108 3HG1 VAL 17 3HG1 VAL 17 4.231 -4.968 1.623
109 1HG2 VAL 17 1HG2 VAL 17 1.044 -4.273 0.433
110 2HG2 VAL 17 2HG2 VAL 17 1.724 -5.488 -0.676
111 3HG2 VAL 17 3HG2 VAL 17 2.077 -5.576 1.067
112 H LYS 18 H LYS 18 3.499 -1.296 -1.501
113 HA LYS 18 HA LYS 18 6.191 -0.727 -0.918
114 2HB LYS 18 2HB LYS 18 4.285 -0.270 -3.068
115 2HG LYS 18 2HG LYS 18 5.851 1.688 -3.914
116 2HD LYS 18 2HD LYS 18 4.280 3.298 -2.386
117 2HE LYS 18 2HE LYS 18 2.410 2.785 -4.061
118 1HZ LYS 18 1HZ LYS 18 5.097 3.553 -4.639
119 2HZ LYS 18 2HZ LYS 18 4.273 3.038 -5.952
120 3HZ LYS 18 3HZ LYS 18 3.694 4.276 -5.058
121 H LYS 19 H LYS 19 3.099 0.897 -0.229
122 HA LYS 19 HA LYS 19 4.208 3.399 0.416
123 2HB LYS 19 2HB LYS 19 1.604 2.051 0.578
124 2HG LYS 19 2HG LYS 19 0.805 3.953 2.168
125 2HD LYS 19 2HD LYS 19 1.966 2.458 4.185
126 2HE LYS 19 2HE LYS 19 -0.041 0.829 3.677
127 1HZ LYS 19 1HZ LYS 19 -0.405 2.426 5.266
128 2HZ LYS 19 2HZ LYS 19 -0.213 3.687 4.245
129 3HZ LYS 19 3HZ LYS 19 -1.570 2.779 4.178
130 H LEU 20 H LEU 20 4.341 0.303 1.950
131 HA LEU 20 HA LEU 20 4.859 1.526 4.551
132 2HB LEU 20 2HB LEU 20 3.402 -0.659 3.877
133 HG LEU 20 HG LEU 20 5.602 -1.911 3.389
134 1HD1 LEU 20 1HD1 LEU 20 7.186 -1.699 4.944
135 2HD1 LEU 20 2HD1 LEU 20 6.036 -1.102 6.164
136 3HD1 LEU 20 3HD1 LEU 20 6.232 -2.852 5.907
137 1HD2 LEU 20 1HD2 LEU 20 4.543 -3.721 5.256
138 2HD2 LEU 20 2HD2 LEU 20 3.176 -2.700 4.745
139 3HD2 LEU 20 3HD2 LEU 20 4.139 -3.574 3.529
140 H PHE 21 H PHE 21 6.435 0.435 1.689
141 HA PHE 21 HA PHE 21 8.831 -0.435 2.991
142 2HB PHE 21 2HB PHE 21 9.310 0.254 0.269
143 HD1 PHE 21 1HD PHE 21 11.012 -1.416 0.600
144 HD2 PHE 21 2HD PHE 21 6.907 -2.450 0.897
145 HE1 PHE 21 1HE PHE 21 11.618 -3.850 0.506
146 HE2 PHE 21 2HE PHE 21 7.513 -4.884 0.804
147 HZ PHE 21 HZ PHE 21 9.862 -5.555 0.609
148 H LYS 22 H LYS 22 7.426 2.613 1.987
149 HA LYS 22 HA LYS 22 9.716 4.054 1.393
150 2HB LYS 22 2HB LYS 22 7.748 5.119 0.832
151 2HG LYS 22 2HG LYS 22 6.147 3.794 2.098
152 2HD LYS 22 2HD LYS 22 7.712 4.849 4.418
153 2HE LYS 22 2HE LYS 22 4.979 5.503 4.307
154 1HZ LYS 22 1HZ LYS 22 4.253 3.994 6.172
155 2HZ LYS 22 2HZ LYS 22 4.235 3.359 4.668
156 3HZ LYS 22 3HZ LYS 22 5.438 2.974 5.702
157 H LYS 23 H LYS 23 8.727 2.558 4.340
158 HA LYS 23 HA LYS 23 10.493 4.333 5.867
159 2HB LYS 23 2HB LYS 23 8.307 4.260 6.820
160 2HG LYS 23 2HG LYS 23 8.567 1.289 6.325
161 2HD LYS 23 2HD LYS 23 8.059 1.910 8.857
162 2HE LYS 23 2HE LYS 23 6.038 3.402 7.615
163 1HZ LYS 23 1HZ LYS 23 4.712 1.566 7.148
164 2HZ LYS 23 2HZ LYS 23 5.023 0.827 8.572
165 3HZ LYS 23 3HZ LYS 23 4.086 2.164 8.534
166 H TRP 24 H TRP 24 10.143 1.189 4.405
167 HA TRP 24 HA TRP 24 11.926 -0.180 6.150
168 2HB TRP 24 2HB TRP 24 11.981 -1.784 4.127
169 HD1 TRP 24 HD TRP 24 9.824 -0.571 6.908
170 HE1 TRP 24 1HE TRP 24 8.056 -2.358 7.708
171 HE3 TRP 24 3HE TRP 24 10.390 -3.684 2.928
172 HZ2 TRP 24 2HZ TRP 24 7.113 -4.818 6.612
173 HZ3 TRP 24 3HZ TRP 24 9.007 -5.758 2.870
174 HH2 TRP 24 HH TRP 24 7.412 -6.345 4.628
175 H GLY 25 H GLY 25 14.168 -0.444 5.955
176 1HA GLY 25 1HA GLY 25 15.457 1.303 3.955
177 2HA GLY 25 2HA GLY 25 16.116 0.863 5.519
178 H TRP 26 H TRP 26 16.943 0.458 2.513
179 HA TRP 26 HA TRP 26 17.196 -2.455 2.547
180 2HB TRP 26 2HB TRP 26 18.314 -1.237 0.213
181 HD1 TRP 26 HD TRP 26 15.071 -3.032 1.473
182 HE1 TRP 26 1HE TRP 26 14.479 -5.070 -0.095
183 HE3 TRP 26 3HE TRP 26 18.838 -2.245 -1.851
184 HZ2 TRP 26 2HZ TRP 26 15.628 -6.102 -2.496
185 HZ3 TRP 26 3HZ TRP 26 19.032 -3.814 -3.778
186 HH2 TRP 26 HH TRP 26 17.505 -5.690 -4.128
Start of MODEL 13
1 1H LYS 1 H LYS 1 -16.606 6.362 1.192
2 HA LYS 1 HA LYS 1 -16.467 9.057 0.029
3 2HB LYS 1 2HB LYS 1 -15.142 6.476 -0.834
4 2HG LYS 1 2HG LYS 1 -16.072 8.718 -2.445
5 2HD LYS 1 2HD LYS 1 -13.566 9.332 -1.621
6 2HE LYS 1 2HE LYS 1 -12.910 6.977 -2.698
7 1HZ LYS 1 1HZ LYS 1 -12.163 7.428 -4.981
8 2HZ LYS 1 2HZ LYS 1 -13.789 7.385 -4.838
9 3HZ LYS 1 3HZ LYS 1 -13.020 8.818 -4.982
10 H SER 2 H SER 2 -17.317 5.648 -0.919
11 HA SER 2 HA SER 2 -19.976 6.166 -1.306
12 2HB SER 2 2HB SER 2 -19.266 5.908 -4.079
13 HG SER 2 HG SER 2 -20.269 8.181 -4.019
14 H SER 3 H SER 3 -20.563 4.081 -0.804
15 HA SER 3 HA SER 3 -20.449 1.896 -0.648
16 2HB SER 3 2HB SER 3 -20.903 0.723 -2.739
17 HG SER 3 HG SER 3 -21.841 3.415 -3.185
18 H ALA 4 H ALA 4 -18.160 2.266 0.334
19 HA ALA 4 HA ALA 4 -16.456 0.273 -0.608
20 1HB ALA 4 1HB ALA 4 -14.755 1.391 -1.740
21 2HB ALA 4 2HB ALA 4 -16.196 2.240 -2.348
22 3HB ALA 4 3HB ALA 4 -15.204 2.976 -1.067
23 H TYR 5 H TYR 5 -14.475 0.130 0.762
24 HA TYR 5 HA TYR 5 -14.906 1.598 3.275
25 2HB TYR 5 2HB TYR 5 -13.319 -0.592 3.845
26 HD1 TYR 5 1HD TYR 5 -14.259 -1.488 5.761
27 HD2 TYR 5 2HD TYR 5 -16.833 -0.408 2.519
28 HE1 TYR 5 1HE TYR 5 -16.286 -2.167 7.135
29 HE2 TYR 5 2HE TYR 5 -18.853 -1.091 3.905
30 HH TYR 5 HH TYR 5 -19.019 -2.939 6.053
31 H SER 6 H SER 6 -12.927 1.422 0.530
32 HA SER 6 HA SER 6 -11.101 3.203 1.514
33 2HB SER 6 2HB SER 6 -9.579 0.646 1.171
34 HG SER 6 HG SER 6 -9.357 3.102 2.617
35 H LEU 7 H LEU 7 -9.129 3.394 -0.092
36 HA LEU 7 HA LEU 7 -9.983 3.732 -2.609
37 2HB LEU 7 2HB LEU 7 -7.898 4.593 -1.866
38 HG LEU 7 HG LEU 7 -7.044 1.725 -1.570
39 1HD1 LEU 7 1HD1 LEU 7 -5.056 3.978 -1.876
40 2HD1 LEU 7 2HD1 LEU 7 -4.753 2.224 -1.802
41 3HD1 LEU 7 3HD1 LEU 7 -5.541 2.932 -3.232
42 1HD2 LEU 7 1HD2 LEU 7 -7.331 2.379 0.553
43 2HD2 LEU 7 2HD2 LEU 7 -5.768 3.203 0.341
44 3HD2 LEU 7 3HD2 LEU 7 -7.286 4.109 0.136
45 H GLN 8 H GLN 8 -8.647 0.683 -1.211
46 HA GLN 8 HA GLN 8 -9.990 -0.701 -3.365
47 2HB GLN 8 2HB GLN 8 -7.822 -2.239 -3.392
48 2HG GLN 8 2HG GLN 8 -8.823 -0.700 -5.249
49 1HE2 GLN 8 1HE2 GLN 8 -7.827 0.956 -6.758
50 2HE2 GLN 8 2HE2 GLN 8 -7.283 2.444 -6.058
51 H MET 9 H MET 9 -7.589 -2.431 -1.492
52 HA MET 9 HA MET 9 -8.803 -2.872 0.866
53 2HB MET 9 2HB MET 9 -10.835 -3.697 -0.127
54 2HG MET 9 2HG MET 9 -9.016 -5.234 -2.041
55 1HE MET 9 1HE MET 9 -10.450 -6.568 -4.158
56 2HE MET 9 2HE MET 9 -9.538 -7.312 -2.823
57 3HE MET 9 3HE MET 9 -11.139 -7.948 -3.270
58 H GLY 10 H GLY 10 -7.254 -4.400 -1.986
59 1HA GLY 10 1HA GLY 10 -5.060 -5.300 -0.353
60 2HA GLY 10 2HA GLY 10 -6.062 -6.609 -0.947
61 H ALA 11 H ALA 11 -4.896 -3.450 -2.337
62 HA ALA 11 HA ALA 11 -3.455 -4.920 -4.374
63 1HB ALA 11 1HB ALA 11 -5.480 -4.846 -5.554
64 2HB ALA 11 2HB ALA 11 -5.929 -3.261 -4.879
65 3HB ALA 11 3HB ALA 11 -4.649 -3.374 -6.111
66 H THR 12 H THR 12 -4.512 -1.629 -4.982
67 HA THR 12 HA THR 12 -2.084 -0.511 -5.262
68 HB THR 12 HB THR 12 -3.270 1.639 -4.814
69 HG1 THR 12 1HG THR 12 -5.111 -0.330 -3.662
70 1HG2 THR 12 1HG2 THR 12 -4.013 -0.090 -6.782
71 2HG2 THR 12 2HG2 THR 12 -5.522 -0.073 -5.840
72 3HG2 THR 12 3HG2 THR 12 -4.869 1.445 -6.501
73 H ALA 13 H ALA 13 -3.876 -0.739 -2.125
74 HA ALA 13 HA ALA 13 -2.255 0.623 -0.493
75 1HB ALA 13 1HB ALA 13 -4.105 -1.601 -0.294
76 2HB ALA 13 2HB ALA 13 -2.773 -1.804 0.868
77 3HB ALA 13 3HB ALA 13 -3.754 -0.319 0.890
78 H ILE 14 H ILE 14 -1.604 -2.608 -1.937
79 HA ILE 14 HA ILE 14 0.579 -3.366 -0.507
80 HB ILE 14 HB ILE 14 0.021 -3.645 -3.461
81 2HG1 ILE 14 2HG1 ILE 14 -1.642 -4.536 -1.723
82 1HG2 ILE 14 1HG2 ILE 14 1.576 -5.566 -3.387
83 2HG2 ILE 14 2HG2 ILE 14 2.385 -4.008 -3.093
84 3HG2 ILE 14 3HG2 ILE 14 2.040 -5.102 -1.732
85 1HD1 ILE 14 1HD1 ILE 14 -1.950 -6.641 -2.967
86 2HD1 ILE 14 2HD1 ILE 14 -1.518 -5.331 -4.093
87 3HD1 ILE 14 3HD1 ILE 14 -0.292 -6.527 -3.605
88 H LYS 15 H LYS 15 0.541 -1.197 -3.419
89 HA LYS 15 HA LYS 15 3.209 -0.718 -3.615
90 2HB LYS 15 2HB LYS 15 1.146 0.112 -4.999
91 2HG LYS 15 2HG LYS 15 0.423 1.616 -3.001
92 2HD LYS 15 2HD LYS 15 3.038 2.804 -3.768
93 2HE LYS 15 2HE LYS 15 1.160 4.370 -4.734
94 1HZ LYS 15 1HZ LYS 15 0.854 5.731 -2.365
95 2HZ LYS 15 2HZ LYS 15 -0.313 5.015 -3.254
96 3HZ LYS 15 3HZ LYS 15 0.421 4.189 -2.051
97 H GLN 16 H GLN 16 0.844 0.728 -1.319
98 HA GLN 16 HA GLN 16 2.465 2.679 -0.303
99 2HB GLN 16 2HB GLN 16 0.831 1.393 1.768
100 2HG GLN 16 2HG GLN 16 0.164 3.938 0.267
101 1HE2 GLN 16 1HE2 GLN 16 1.073 2.691 3.482
102 2HE2 GLN 16 2HE2 GLN 16 -0.337 3.226 4.333
103 H VAL 17 H VAL 17 2.193 -0.808 0.599
104 HA VAL 17 HA VAL 17 3.823 -0.760 2.828
105 HB VAL 17 HB VAL 17 2.340 -2.599 1.791
106 1HG1 VAL 17 1HG1 VAL 17 3.039 -3.727 -0.004
107 2HG1 VAL 17 2HG1 VAL 17 4.351 -2.535 -0.172
108 3HG1 VAL 17 3HG1 VAL 17 4.626 -4.038 0.740
109 1HG2 VAL 17 1HG2 VAL 17 3.709 -4.382 2.916
110 2HG2 VAL 17 2HG2 VAL 17 5.011 -3.182 3.105
111 3HG2 VAL 17 3HG2 VAL 17 3.440 -2.923 3.901
112 H LYS 18 H LYS 18 4.596 -0.676 -0.653
113 HA LYS 18 HA LYS 18 7.319 -1.318 -0.380
114 2HB LYS 18 2HB LYS 18 5.482 -0.431 -2.470
115 2HG LYS 18 2HG LYS 18 7.642 0.252 -3.864
116 2HD LYS 18 2HD LYS 18 7.250 2.716 -2.813
117 2HE LYS 18 2HE LYS 18 4.857 1.474 -4.178
118 1HZ LYS 18 1HZ LYS 18 5.951 3.595 -5.509
119 2HZ LYS 18 2HZ LYS 18 4.610 3.611 -4.577
120 3HZ LYS 18 3HZ LYS 18 6.060 3.994 -3.929
121 H LYS 19 H LYS 19 5.431 1.701 -0.060
122 HA LYS 19 HA LYS 19 7.648 3.430 -0.089
123 2HB LYS 19 2HB LYS 19 4.773 3.579 0.346
124 2HG LYS 19 2HG LYS 19 5.104 5.852 1.598
125 2HD LYS 19 2HD LYS 19 5.488 4.274 3.841
126 2HE LYS 19 2HE LYS 19 2.884 3.786 3.439
127 1HZ LYS 19 1HZ LYS 19 2.509 5.796 4.418
128 2HZ LYS 19 2HZ LYS 19 4.091 5.596 4.769
129 3HZ LYS 19 3HZ LYS 19 3.645 6.593 3.556
130 H LEU 20 H LEU 20 6.454 1.123 2.229
131 HA LEU 20 HA LEU 20 7.791 2.468 4.429
132 2HB LEU 20 2HB LEU 20 5.500 0.998 4.271
133 HG LEU 20 HG LEU 20 6.897 -1.132 4.145
134 1HD1 LEU 20 1HD1 LEU 20 8.578 -1.410 5.563
135 2HD1 LEU 20 2HD1 LEU 20 8.152 0.092 6.416
136 3HD1 LEU 20 3HD1 LEU 20 7.413 -1.450 6.908
137 1HD2 LEU 20 1HD2 LEU 20 4.665 -0.475 5.950
138 2HD2 LEU 20 2HD2 LEU 20 4.827 -1.763 4.732
139 3HD2 LEU 20 3HD2 LEU 20 5.531 -1.977 6.353
140 H PHE 21 H PHE 21 8.424 0.187 1.907
141 HA PHE 21 HA PHE 21 10.301 -1.407 3.299
142 2HB PHE 21 2HB PHE 21 10.669 -0.963 0.375
143 HD1 PHE 21 1HD PHE 21 8.413 -3.383 2.044
144 HD2 PHE 21 2HD PHE 21 12.216 -2.735 0.277
145 HE1 PHE 21 1HE PHE 21 8.863 -5.851 2.111
146 HE2 PHE 21 2HE PHE 21 12.667 -5.203 0.344
147 HZ PHE 21 HZ PHE 21 10.986 -6.732 1.259
148 H LYS 22 H LYS 22 10.356 1.850 2.123
149 HA LYS 22 HA LYS 22 12.845 2.232 1.143
150 2HB LYS 22 2HB LYS 22 10.885 3.876 1.670
151 2HG LYS 22 2HG LYS 22 11.695 5.407 3.607
152 2HD LYS 22 2HD LYS 22 10.346 2.715 3.949
153 2HE LYS 22 2HE LYS 22 11.581 4.281 6.076
154 1HZ LYS 22 1HZ LYS 22 8.885 4.779 5.716
155 2HZ LYS 22 2HZ LYS 22 9.015 3.806 7.021
156 3HZ LYS 22 3HZ LYS 22 9.826 5.223 6.975
157 H LYS 23 H LYS 23 11.898 1.720 4.577
158 HA LYS 23 HA LYS 23 14.634 2.031 5.430
159 2HB LYS 23 2HB LYS 23 12.750 2.851 6.797
160 2HG LYS 23 2HG LYS 23 12.151 -0.084 7.354
161 2HD LYS 23 2HD LYS 23 9.921 1.242 8.044
162 2HE LYS 23 2HE LYS 23 12.486 0.775 9.565
163 1HZ LYS 23 1HZ LYS 23 10.097 1.988 10.760
164 2HZ LYS 23 2HZ LYS 23 11.508 1.640 11.504
165 3HZ LYS 23 3HZ LYS 23 11.443 2.838 10.396
166 H TRP 24 H TRP 24 12.161 -0.632 5.363
167 HA TRP 24 HA TRP 24 13.657 -2.681 6.275
168 2HB TRP 24 2HB TRP 24 12.314 -4.121 4.704
169 HD1 TRP 24 HD TRP 24 12.000 -2.048 7.648
170 HE1 TRP 24 1HE TRP 24 9.749 -2.354 8.989
171 HE3 TRP 24 3HE TRP 24 9.489 -4.424 3.919
172 HZ2 TRP 24 2HZ TRP 24 7.226 -3.529 8.355
173 HZ3 TRP 24 3HZ TRP 24 7.135 -5.118 4.362
174 HH2 TRP 24 HH TRP 24 6.003 -4.705 6.489
175 H GLY 25 H GLY 25 15.599 -3.567 5.702
176 1HA GLY 25 1HA GLY 25 16.355 -4.116 3.054
177 2HA GLY 25 2HA GLY 25 17.106 -2.610 3.541
178 H TRP 26 H TRP 26 17.364 -6.014 3.593
179 HA TRP 26 HA TRP 26 18.724 -6.345 6.052
180 2HB TRP 26 2HB TRP 26 17.543 -8.080 4.549
181 HD1 TRP 26 HD TRP 26 19.588 -6.506 2.264
182 HE1 TRP 26 1HE TRP 26 20.648 -7.977 0.346
183 HE3 TRP 26 3HE TRP 26 18.940 -10.971 4.609
184 HZ2 TRP 26 2HZ TRP 26 21.086 -10.779 0.033
185 HZ3 TRP 26 3HZ TRP 26 19.711 -13.026 3.428
186 HH2 TRP 26 HH TRP 26 20.752 -12.980 1.217
Start of MODEL 14
1 1H LYS 1 H LYS 1 -5.941 9.553 -1.214
2 HA LYS 1 HA LYS 1 -3.977 10.305 -2.078
3 2HB LYS 1 2HB LYS 1 -4.371 12.701 -0.335
4 2HG LYS 1 2HG LYS 1 -4.414 12.387 -3.365
5 2HD LYS 1 2HD LYS 1 -3.215 14.780 -2.779
6 2HE LYS 1 2HE LYS 1 -5.966 15.405 -2.719
7 1HZ LYS 1 1HZ LYS 1 -5.609 15.788 -5.029
8 2HZ LYS 1 2HZ LYS 1 -4.259 16.236 -4.226
9 3HZ LYS 1 3HZ LYS 1 -4.284 14.832 -5.059
10 H SER 2 H SER 2 -2.527 8.701 -1.108
11 HA SER 2 HA SER 2 -0.686 8.156 -0.098
12 2HB SER 2 2HB SER 2 -0.436 11.139 0.478
13 HG SER 2 HG SER 2 1.843 10.637 0.742
14 H SER 3 H SER 3 -1.171 6.863 1.655
15 HA SER 3 HA SER 3 -1.732 6.239 3.658
16 2HB SER 3 2HB SER 3 -0.836 8.844 4.883
17 HG SER 3 HG SER 3 0.303 7.334 6.272
18 H ALA 4 H ALA 4 -3.978 6.110 3.751
19 HA ALA 4 HA ALA 4 -5.315 8.424 4.929
20 1HB ALA 4 1HB ALA 4 -7.184 8.176 3.333
21 2HB ALA 4 2HB ALA 4 -5.667 8.570 2.490
22 3HB ALA 4 3HB ALA 4 -6.285 6.902 2.476
23 H TYR 5 H TYR 5 -6.401 5.253 3.549
24 HA TYR 5 HA TYR 5 -6.493 3.930 6.023
25 2HB TYR 5 2HB TYR 5 -9.252 4.044 5.612
26 HD1 TYR 5 1HD TYR 5 -8.912 7.329 6.668
27 HD2 TYR 5 2HD TYR 5 -8.022 3.347 7.954
28 HE1 TYR 5 1HE TYR 5 -8.874 8.111 9.086
29 HE2 TYR 5 2HE TYR 5 -7.986 4.143 10.369
30 HH TYR 5 HH TYR 5 -9.128 6.119 11.628
31 H SER 6 H SER 6 -5.682 3.506 3.230
32 HA SER 6 HA SER 6 -7.330 2.229 1.610
33 2HB SER 6 2HB SER 6 -5.035 2.411 0.991
34 HG SER 6 HG SER 6 -3.680 0.619 2.388
35 H LEU 7 H LEU 7 -8.416 0.233 1.448
36 HA LEU 7 HA LEU 7 -8.628 -1.223 3.945
37 2HB LEU 7 2HB LEU 7 -10.673 -0.571 2.917
38 HG LEU 7 HG LEU 7 -9.487 -1.059 0.429
39 1HD1 LEU 7 1HD1 LEU 7 -11.168 -3.341 1.245
40 2HD1 LEU 7 2HD1 LEU 7 -11.568 -2.634 -0.340
41 3HD1 LEU 7 3HD1 LEU 7 -9.917 -3.217 -0.016
42 1HD2 LEU 7 1HD2 LEU 7 -11.372 0.541 1.299
43 2HD2 LEU 7 2HD2 LEU 7 -11.310 0.060 -0.414
44 3HD2 LEU 7 3HD2 LEU 7 -12.454 -0.736 0.694
45 H GLN 8 H GLN 8 -7.643 -1.716 0.510
46 HA GLN 8 HA GLN 8 -6.462 -3.260 -0.455
47 2HB GLN 8 2HB GLN 8 -4.957 -4.627 1.438
48 2HG GLN 8 2HG GLN 8 -4.540 -2.721 -0.566
49 1HE2 GLN 8 1HE2 GLN 8 -2.662 -1.152 -0.570
50 2HE2 GLN 8 2HE2 GLN 8 -2.655 0.087 0.640
51 H MET 9 H MET 9 -7.449 -5.016 -1.344
52 HA MET 9 HA MET 9 -7.893 -7.309 0.264
53 2HB MET 9 2HB MET 9 -10.428 -7.301 -0.585
54 2HG MET 9 2HG MET 9 -10.091 -5.261 1.577
55 1HE MET 9 1HE MET 9 -11.647 -8.597 3.575
56 2HE MET 9 2HE MET 9 -11.144 -9.376 2.056
57 3HE MET 9 3HE MET 9 -10.007 -8.326 2.937
58 H GLY 10 H GLY 10 -8.648 -5.574 -2.821
59 1HA GLY 10 1HA GLY 10 -9.199 -7.595 -4.530
60 2HA GLY 10 2HA GLY 10 -8.242 -6.191 -4.957
61 H ALA 11 H ALA 11 -5.946 -6.326 -5.081
62 HA ALA 11 HA ALA 11 -4.468 -8.490 -4.124
63 1HB ALA 11 1HB ALA 11 -6.008 -9.359 -6.187
64 2HB ALA 11 2HB ALA 11 -4.593 -8.763 -7.089
65 3HB ALA 11 3HB ALA 11 -4.388 -10.007 -5.832
66 H THR 12 H THR 12 -4.761 -6.360 -7.059
67 HA THR 12 HA THR 12 -2.015 -5.821 -7.224
68 HB THR 12 HB THR 12 -2.791 -4.058 -8.792
69 HG1 THR 12 1HG THR 12 -4.599 -3.128 -7.855
70 1HG2 THR 12 1HG2 THR 12 -4.911 -6.220 -9.026
71 2HG2 THR 12 2HG2 THR 12 -4.008 -5.400 -10.323
72 3HG2 THR 12 3HG2 THR 12 -3.204 -6.629 -9.317
73 H ALA 13 H ALA 13 -4.705 -4.007 -5.627
74 HA ALA 13 HA ALA 13 -3.458 -1.770 -4.857
75 1HB ALA 13 1HB ALA 13 -5.513 -3.566 -3.657
76 2HB ALA 13 2HB ALA 13 -4.802 -2.344 -2.574
77 3HB ALA 13 3HB ALA 13 -5.607 -1.839 -4.079
78 H ILE 14 H ILE 14 -3.123 -5.017 -3.292
79 HA ILE 14 HA ILE 14 -1.582 -4.347 -1.160
80 HB ILE 14 HB ILE 14 -1.433 -6.761 -2.964
81 2HG1 ILE 14 2HG1 ILE 14 -3.631 -6.274 -1.889
82 1HG2 ILE 14 1HG2 ILE 14 -0.195 -7.909 -1.319
83 2HG2 ILE 14 2HG2 ILE 14 0.635 -6.351 -1.547
84 3HG2 ILE 14 3HG2 ILE 14 -0.408 -6.604 -0.127
85 1HD1 ILE 14 1HD1 ILE 14 -2.364 -8.672 -0.529
86 2HD1 ILE 14 2HD1 ILE 14 -4.005 -8.509 -1.199
87 3HD1 ILE 14 3HD1 ILE 14 -2.606 -8.648 -2.293
88 H LYS 15 H LYS 15 -0.418 -5.083 -4.519
89 HA LYS 15 HA LYS 15 2.249 -4.777 -4.115
90 2HB LYS 15 2HB LYS 15 0.404 -4.692 -6.356
91 2HG LYS 15 2HG LYS 15 2.282 -3.600 -7.829
92 2HD LYS 15 2HD LYS 15 1.124 -1.315 -6.431
93 2HE LYS 15 2HE LYS 15 0.887 -2.680 -9.115
94 1HZ LYS 15 1HZ LYS 15 -0.647 -0.413 -9.142
95 2HZ LYS 15 2HZ LYS 15 -1.161 -1.949 -9.350
96 3HZ LYS 15 3HZ LYS 15 -1.187 -1.275 -7.864
97 H GLN 16 H GLN 16 -0.249 -2.215 -4.514
98 HA GLN 16 HA GLN 16 1.451 -0.086 -4.737
99 2HB GLN 16 2HB GLN 16 -0.446 1.284 -4.007
100 2HG GLN 16 2HG GLN 16 -1.633 -1.162 -5.376
101 1HE2 GLN 16 1HE2 GLN 16 -1.068 2.214 -6.261
102 2HE2 GLN 16 2HE2 GLN 16 -2.725 2.709 -6.351
103 H VAL 17 H VAL 17 0.189 -1.746 -1.789
104 HA VAL 17 HA VAL 17 1.146 0.018 0.102
105 HB VAL 17 HB VAL 17 -0.358 -2.075 0.263
106 1HG1 VAL 17 1HG1 VAL 17 2.069 -3.359 -0.319
107 2HG1 VAL 17 2HG1 VAL 17 1.779 -3.669 1.410
108 3HG1 VAL 17 3HG1 VAL 17 0.546 -4.117 0.207
109 1HG2 VAL 17 1HG2 VAL 17 1.674 -1.485 2.443
110 2HG2 VAL 17 2HG2 VAL 17 0.171 -0.581 2.143
111 3HG2 VAL 17 3HG2 VAL 17 0.097 -2.281 2.664
112 H LYS 18 H LYS 18 2.821 -2.449 -1.853
113 HA LYS 18 HA LYS 18 5.173 -2.512 -0.314
114 2HB LYS 18 2HB LYS 18 4.189 -3.588 -2.844
115 2HG LYS 18 2HG LYS 18 6.734 -4.032 -3.473
116 2HD LYS 18 2HD LYS 18 6.591 -1.612 -4.699
117 2HE LYS 18 2HE LYS 18 4.996 -2.728 -6.364
118 1HZ LYS 18 1HZ LYS 18 7.520 -3.662 -5.464
119 2HZ LYS 18 2HZ LYS 18 6.665 -4.832 -6.214
120 3HZ LYS 18 3HZ LYS 18 6.982 -3.430 -6.988
121 H LYS 19 H LYS 19 3.960 -0.394 -2.932
122 HA LYS 19 HA LYS 19 6.424 0.884 -3.405
123 2HB LYS 19 2HB LYS 19 3.657 1.090 -4.287
124 2HG LYS 19 2HG LYS 19 4.071 3.539 -5.051
125 2HD LYS 19 2HD LYS 19 3.527 4.233 -2.427
126 2HE LYS 19 2HE LYS 19 1.086 3.495 -3.095
127 1HZ LYS 19 1HZ LYS 19 2.364 5.688 -3.507
128 2HZ LYS 19 2HZ LYS 19 2.309 5.231 -5.074
129 3HZ LYS 19 3HZ LYS 19 0.924 5.433 -4.233
130 H LEU 20 H LEU 20 4.209 0.945 -0.753
131 HA LEU 20 HA LEU 20 5.117 3.594 0.066
132 2HB LEU 20 2HB LEU 20 2.664 2.413 0.157
133 HG LEU 20 HG LEU 20 3.470 0.983 2.124
134 1HD1 LEU 20 1HD1 LEU 20 3.020 2.899 4.170
135 2HD1 LEU 20 2HD1 LEU 20 4.493 1.960 3.830
136 3HD1 LEU 20 3HD1 LEU 20 4.264 3.559 3.081
137 1HD2 LEU 20 1HD2 LEU 20 1.040 1.962 1.482
138 2HD2 LEU 20 2HD2 LEU 20 1.340 0.873 2.858
139 3HD2 LEU 20 3HD2 LEU 20 1.218 2.630 3.122
140 H PHE 21 H PHE 21 5.868 0.248 0.396
141 HA PHE 21 HA PHE 21 6.713 0.190 3.057
142 2HB PHE 21 2HB PHE 21 8.296 -1.354 1.060
143 HD1 PHE 21 1HD PHE 21 9.220 -2.980 2.398
144 HD2 PHE 21 2HD PHE 21 5.159 -1.914 3.018
145 HE1 PHE 21 1HE PHE 21 9.026 -4.746 4.171
146 HE2 PHE 21 2HE PHE 21 4.966 -3.680 4.791
147 HZ PHE 21 HZ PHE 21 6.902 -5.075 5.346
148 H LYS 22 H LYS 22 8.024 1.784 0.248
149 HA LYS 22 HA LYS 22 10.746 1.695 0.980
150 2HB LYS 22 2HB LYS 22 10.504 2.210 -1.231
151 2HG LYS 22 2HG LYS 22 8.100 2.460 -1.361
152 2HD LYS 22 2HD LYS 22 7.809 3.689 0.812
153 2HE LYS 22 2HE LYS 22 9.408 5.421 0.866
154 1HZ LYS 22 1HZ LYS 22 8.610 5.901 -1.907
155 2HZ LYS 22 2HZ LYS 22 9.452 7.016 -1.062
156 3HZ LYS 22 3HZ LYS 22 10.093 5.538 -1.328
157 H LYS 23 H LYS 23 8.101 3.022 2.570
158 HA LYS 23 HA LYS 23 9.814 5.080 3.780
159 2HB LYS 23 2HB LYS 23 7.882 5.971 2.461
160 2HG LYS 23 2HG LYS 23 6.461 3.997 4.092
161 2HD LYS 23 2HD LYS 23 6.112 6.242 5.399
162 2HE LYS 23 2HE LYS 23 5.588 7.296 2.938
163 1HZ LYS 23 1HZ LYS 23 3.477 7.068 2.358
164 2HZ LYS 23 2HZ LYS 23 3.424 5.765 3.341
165 3HZ LYS 23 3HZ LYS 23 2.906 7.217 3.881
166 H TRP 24 H TRP 24 7.721 2.261 4.159
167 HA TRP 24 HA TRP 24 7.620 2.535 7.029
168 2HB TRP 24 2HB TRP 24 6.651 0.120 6.689
169 HD1 TRP 24 HD TRP 24 5.896 3.726 6.744
170 HE1 TRP 24 1HE TRP 24 3.342 4.274 7.117
171 HE3 TRP 24 3HE TRP 24 4.208 -0.976 5.791
172 HZ2 TRP 24 2HZ TRP 24 0.956 2.715 6.974
173 HZ3 TRP 24 3HZ TRP 24 1.752 -1.377 5.929
174 HH2 TRP 24 HH TRP 24 0.145 0.374 6.496
175 H GLY 25 H GLY 25 8.750 1.146 8.512
176 1HA GLY 25 1HA GLY 25 10.314 -0.386 9.161
177 2HA GLY 25 2HA GLY 25 10.664 -0.766 7.486
178 H TRP 26 H TRP 26 12.972 -0.701 8.254
179 HA TRP 26 HA TRP 26 14.173 1.582 9.252
180 2HB TRP 26 2HB TRP 26 15.230 -0.599 9.248
181 HD1 TRP 26 HD TRP 26 13.456 -0.933 6.373
182 HE1 TRP 26 1HE TRP 26 14.432 -2.455 4.451
183 HE3 TRP 26 3HE TRP 26 18.268 -0.823 8.012
184 HZ2 TRP 26 2HZ TRP 26 17.048 -3.421 3.846
185 HZ3 TRP 26 3HZ TRP 26 19.971 -2.081 6.698
186 HH2 TRP 26 HH TRP 26 19.427 -3.349 4.680
Start of MODEL 15
1 1H LYS 1 H LYS 1 -9.938 5.891 5.774
2 HA LYS 1 HA LYS 1 -8.619 7.741 7.630
3 2HB LYS 1 2HB LYS 1 -7.072 7.350 5.814
4 2HG LYS 1 2HG LYS 1 -9.331 8.243 3.960
5 2HD LYS 1 2HD LYS 1 -6.426 8.079 3.682
6 2HE LYS 1 2HE LYS 1 -8.140 6.358 1.828
7 1HZ LYS 1 1HZ LYS 1 -6.725 7.154 0.327
8 2HZ LYS 1 2HZ LYS 1 -5.671 7.750 1.423
9 3HZ LYS 1 3HZ LYS 1 -5.622 6.168 1.020
10 H SER 2 H SER 2 -10.881 7.371 4.820
11 HA SER 2 HA SER 2 -12.715 9.071 6.224
12 2HB SER 2 2HB SER 2 -11.811 9.783 3.399
13 HG SER 2 HG SER 2 -13.282 11.493 5.161
14 H SER 3 H SER 3 -12.029 7.606 2.957
15 HA SER 3 HA SER 3 -14.366 5.969 3.300
16 2HB SER 3 2HB SER 3 -14.869 6.721 0.741
17 HG SER 3 HG SER 3 -16.468 8.194 1.638
18 H ALA 4 H ALA 4 -14.177 3.986 2.169
19 HA ALA 4 HA ALA 4 -11.961 3.768 0.276
20 1HB ALA 4 1HB ALA 4 -11.340 3.135 2.727
21 2HB ALA 4 2HB ALA 4 -12.355 1.700 2.448
22 3HB ALA 4 3HB ALA 4 -10.930 1.994 1.424
23 H TYR 5 H TYR 5 -12.427 0.728 0.525
24 HA TYR 5 HA TYR 5 -13.577 -0.785 -0.621
25 2HB TYR 5 2HB TYR 5 -16.250 -0.047 -0.414
26 HD1 TYR 5 1HD TYR 5 -14.947 -2.567 -0.173
27 HD2 TYR 5 2HD TYR 5 -15.905 0.212 2.934
28 HE1 TYR 5 1HE TYR 5 -14.976 -4.461 1.523
29 HE2 TYR 5 2HE TYR 5 -15.931 -1.690 4.619
30 HH TYR 5 HH TYR 5 -14.598 -4.195 4.525
31 H SER 6 H SER 6 -12.827 1.911 -1.960
32 HA SER 6 HA SER 6 -14.770 1.703 -4.125
33 2HB SER 6 2HB SER 6 -12.948 4.062 -4.040
34 HG SER 6 HG SER 6 -14.699 3.992 -5.537
35 H LEU 7 H LEU 7 -11.596 0.962 -3.106
36 HA LEU 7 HA LEU 7 -10.874 0.084 -5.709
37 2HB LEU 7 2HB LEU 7 -9.951 2.705 -4.799
38 HG LEU 7 HG LEU 7 -7.885 1.215 -4.421
39 1HD1 LEU 7 1HD1 LEU 7 -7.251 -0.174 -6.026
40 2HD1 LEU 7 2HD1 LEU 7 -8.574 0.398 -7.072
41 3HD1 LEU 7 3HD1 LEU 7 -6.991 1.209 -7.116
42 1HD2 LEU 7 1HD2 LEU 7 -6.477 2.946 -5.037
43 2HD2 LEU 7 2HD2 LEU 7 -7.402 3.319 -6.511
44 3HD2 LEU 7 3HD2 LEU 7 -8.055 3.762 -4.915
45 H GLN 8 H GLN 8 -9.417 1.137 -2.547
46 HA GLN 8 HA GLN 8 -7.719 -1.118 -2.531
47 2HB GLN 8 2HB GLN 8 -7.127 1.045 -1.453
48 2HG GLN 8 2HG GLN 8 -8.924 0.348 0.869
49 1HE2 GLN 8 1HE2 GLN 8 -9.580 3.292 -0.486
50 2HE2 GLN 8 2HE2 GLN 8 -8.486 4.309 0.390
51 H MET 9 H MET 9 -7.716 -2.818 -0.800
52 HA MET 9 HA MET 9 -9.885 -3.219 0.854
53 2HB MET 9 2HB MET 9 -11.214 -3.587 -1.188
54 2HG MET 9 2HG MET 9 -8.904 -4.328 -2.418
55 1HE MET 9 1HE MET 9 -7.956 -7.267 -3.738
56 2HE MET 9 2HE MET 9 -9.595 -7.922 -3.975
57 3HE MET 9 3HE MET 9 -9.261 -6.210 -4.329
58 H GLY 10 H GLY 10 -7.371 -4.689 -1.252
59 1HA GLY 10 1HA GLY 10 -5.954 -5.828 0.868
60 2HA GLY 10 2HA GLY 10 -7.011 -7.065 0.220
61 H ALA 11 H ALA 11 -5.249 -4.326 -1.392
62 HA ALA 11 HA ALA 11 -3.440 -6.167 -2.655
63 1HB ALA 11 1HB ALA 11 -5.890 -5.791 -3.901
64 2HB ALA 11 2HB ALA 11 -4.849 -4.591 -4.703
65 3HB ALA 11 3HB ALA 11 -4.387 -6.310 -4.703
66 H THR 12 H THR 12 -4.801 -2.956 -3.640
67 HA THR 12 HA THR 12 -2.468 -1.717 -4.215
68 HB THR 12 HB THR 12 -3.750 0.371 -3.807
69 HG1 THR 12 1HG THR 12 -5.439 -1.578 -2.399
70 1HG2 THR 12 1HG2 THR 12 -5.297 -0.071 -5.442
71 2HG2 THR 12 2HG2 THR 12 -4.686 -1.742 -5.419
72 3HG2 THR 12 3HG2 THR 12 -6.103 -1.298 -4.437
73 H ALA 13 H ALA 13 -3.963 -1.953 -0.931
74 HA ALA 13 HA ALA 13 -2.338 -0.390 0.509
75 1HB ALA 13 1HB ALA 13 -3.557 -1.406 2.096
76 2HB ALA 13 2HB ALA 13 -4.014 -2.686 0.946
77 3HB ALA 13 3HB ALA 13 -2.543 -2.860 1.933
78 H ILE 14 H ILE 14 -1.568 -3.758 -0.594
79 HA ILE 14 HA ILE 14 0.814 -4.153 0.584
80 HB ILE 14 HB ILE 14 -0.011 -4.785 -2.249
81 2HG1 ILE 14 2HG1 ILE 14 -1.232 -5.621 -0.010
82 1HG2 ILE 14 1HG2 ILE 14 2.505 -4.835 -1.762
83 2HG2 ILE 14 2HG2 ILE 14 2.145 -6.219 -0.702
84 3HG2 ILE 14 3HG2 ILE 14 1.761 -6.304 -2.438
85 1HD1 ILE 14 1HD1 ILE 14 -1.391 -6.255 -2.636
86 2HD1 ILE 14 2HD1 ILE 14 -0.711 -7.781 -2.023
87 3HD1 ILE 14 3HD1 ILE 14 -2.256 -7.174 -1.382
88 H LYS 15 H LYS 15 0.307 -2.328 -2.514
89 HA LYS 15 HA LYS 15 2.859 -1.666 -3.081
90 2HB LYS 15 2HB LYS 15 0.344 0.003 -3.332
91 2HG LYS 15 2HG LYS 15 1.745 1.058 -5.246
92 2HD LYS 15 2HD LYS 15 2.990 1.840 -2.628
93 2HE LYS 15 2HE LYS 15 1.451 3.328 -4.810
94 1HZ LYS 15 1HZ LYS 15 1.244 4.660 -3.000
95 2HZ LYS 15 2HZ LYS 15 2.617 4.145 -2.278
96 3HZ LYS 15 3HZ LYS 15 2.696 5.177 -3.541
97 H GLN 16 H GLN 16 0.713 -0.131 -0.622
98 HA GLN 16 HA GLN 16 2.378 1.938 0.036
99 2HB GLN 16 2HB GLN 16 -0.071 1.065 0.873
100 2HG GLN 16 2HG GLN 16 1.819 0.724 3.251
101 1HE2 GLN 16 1HE2 GLN 16 0.899 0.929 5.149
102 2HE2 GLN 16 2HE2 GLN 16 -0.798 1.053 5.478
103 H VAL 17 H VAL 17 2.327 -1.473 1.196
104 HA VAL 17 HA VAL 17 4.130 -1.244 3.264
105 HB VAL 17 HB VAL 17 2.676 -3.204 2.405
106 1HG1 VAL 17 1HG1 VAL 17 4.999 -4.544 1.277
107 2HG1 VAL 17 2HG1 VAL 17 3.340 -4.409 0.643
108 3HG1 VAL 17 3HG1 VAL 17 4.528 -3.127 0.308
109 1HG2 VAL 17 1HG2 VAL 17 4.067 -4.820 3.613
110 2HG2 VAL 17 2HG2 VAL 17 5.464 -3.724 3.494
111 3HG2 VAL 17 3HG2 VAL 17 4.042 -3.250 4.452
112 H LYS 18 H LYS 18 4.632 -1.294 -0.268
113 HA LYS 18 HA LYS 18 7.402 -1.765 -0.175
114 2HB LYS 18 2HB LYS 18 5.363 -1.123 -2.158
115 2HG LYS 18 2HG LYS 18 7.352 -0.356 -3.749
116 2HD LYS 18 2HD LYS 18 6.841 2.125 -2.751
117 2HE LYS 18 2HE LYS 18 4.486 1.797 -3.951
118 1HZ LYS 18 1HZ LYS 18 5.867 1.519 -6.079
119 2HZ LYS 18 2HZ LYS 18 6.076 2.859 -5.169
120 3HZ LYS 18 3HZ LYS 18 7.160 1.640 -5.089
121 H LYS 19 H LYS 19 5.363 1.169 0.077
122 HA LYS 19 HA LYS 19 7.494 2.993 -0.169
123 2HB LYS 19 2HB LYS 19 4.632 3.044 0.369
124 2HG LYS 19 2HG LYS 19 4.867 5.395 1.448
125 2HD LYS 19 2HD LYS 19 5.521 4.042 3.772
126 2HE LYS 19 2HE LYS 19 2.976 3.350 3.679
127 1HZ LYS 19 1HZ LYS 19 3.375 6.188 3.223
128 2HZ LYS 19 2HZ LYS 19 2.496 5.437 4.376
129 3HZ LYS 19 3HZ LYS 19 4.123 5.502 4.503
130 H LEU 20 H LEU 20 6.585 0.750 2.299
131 HA LEU 20 HA LEU 20 7.934 2.321 4.354
132 2HB LEU 20 2HB LEU 20 5.664 0.814 4.420
133 HG LEU 20 HG LEU 20 7.117 -1.296 4.396
134 1HD1 LEU 20 1HD1 LEU 20 7.683 -1.370 7.179
135 2HD1 LEU 20 2HD1 LEU 20 8.815 -1.464 5.808
136 3HD1 LEU 20 3HD1 LEU 20 8.409 0.117 6.519
137 1HD2 LEU 20 1HD2 LEU 20 5.489 -2.385 5.525
138 2HD2 LEU 20 2HD2 LEU 20 5.589 -1.310 6.940
139 3HD2 LEU 20 3HD2 LEU 20 4.710 -0.786 5.484
140 H PHE 21 H PHE 21 8.515 -0.100 1.971
141 HA PHE 21 HA PHE 21 10.380 -1.684 3.316
142 2HB PHE 21 2HB PHE 21 10.881 -1.076 0.441
143 HD1 PHE 21 1HD PHE 21 12.148 -2.884 -0.197
144 HD2 PHE 21 2HD PHE 21 8.836 -3.540 2.374
145 HE1 PHE 21 1HE PHE 21 12.593 -5.353 -0.252
146 HE2 PHE 21 2HE PHE 21 9.281 -6.010 2.318
147 HZ PHE 21 HZ PHE 21 11.154 -6.887 1.005
148 H LYS 22 H LYS 22 10.521 1.621 2.217
149 HA LYS 22 HA LYS 22 13.289 1.742 1.690
150 2HB LYS 22 2HB LYS 22 12.193 3.505 0.741
151 2HG LYS 22 2HG LYS 22 9.973 3.180 1.650
152 2HD LYS 22 2HD LYS 22 10.690 2.553 3.975
153 2HE LYS 22 2HE LYS 22 12.285 4.141 4.678
154 1HZ LYS 22 1HZ LYS 22 11.799 5.779 3.007
155 2HZ LYS 22 2HZ LYS 22 10.428 6.229 3.768
156 3HZ LYS 22 3HZ LYS 22 11.878 6.498 4.470
157 H LYS 23 H LYS 23 11.636 0.993 4.518
158 HA LYS 23 HA LYS 23 13.835 2.081 6.137
159 2HB LYS 23 2HB LYS 23 11.597 3.110 6.583
160 2HG LYS 23 2HG LYS 23 10.843 0.284 6.714
161 2HD LYS 23 2HD LYS 23 11.226 1.012 9.234
162 2HE LYS 23 2HE LYS 23 8.808 1.904 9.959
163 1HZ LYS 23 1HZ LYS 23 10.140 4.171 9.099
164 2HZ LYS 23 2HZ LYS 23 10.124 3.526 10.599
165 3HZ LYS 23 3HZ LYS 23 11.281 3.087 9.534
166 H TRP 24 H TRP 24 11.894 -0.689 5.115
167 HA TRP 24 HA TRP 24 13.038 -2.402 7.141
168 2HB TRP 24 2HB TRP 24 11.789 -4.144 5.655
169 HD1 TRP 24 HD TRP 24 11.480 -1.767 8.421
170 HE1 TRP 24 1HE TRP 24 9.344 -2.133 9.926
171 HE3 TRP 24 3HE TRP 24 9.048 -4.805 5.149
172 HZ2 TRP 24 2HZ TRP 24 6.932 -3.620 9.588
173 HZ3 TRP 24 3HZ TRP 24 6.808 -5.671 5.814
174 HH2 TRP 24 HH TRP 24 5.747 -5.125 7.947
175 H GLY 25 H GLY 25 12.869 -2.550 3.505
176 1HA GLY 25 1HA GLY 25 15.621 -3.630 3.540
177 2HA GLY 25 2HA GLY 25 14.388 -4.035 2.364
178 H TRP 26 H TRP 26 17.056 -2.011 3.051
179 HA TRP 26 HA TRP 26 16.526 0.391 1.916
180 2HB TRP 26 2HB TRP 26 19.083 -0.945 1.174
181 HD1 TRP 26 HD TRP 26 17.355 2.186 2.706
182 HE1 TRP 26 1HE TRP 26 18.819 4.347 2.315
183 HE3 TRP 26 3HE TRP 26 21.329 -0.239 0.661
184 HZ2 TRP 26 2HZ TRP 26 21.417 4.789 1.219
185 HZ3 TRP 26 3HZ TRP 26 23.290 1.132 -0.041
186 HH2 TRP 26 HH TRP 26 23.374 3.562 0.209
Start of MODEL 16
1 1H LYS 1 H LYS 1 -11.925 5.518 0.794
2 HA LYS 1 HA LYS 1 -10.777 6.110 -1.555
3 2HB LYS 1 2HB LYS 1 -13.119 7.431 -1.859
4 2HG LYS 1 2HG LYS 1 -14.129 5.077 -2.149
5 2HD LYS 1 2HD LYS 1 -12.368 4.442 -3.946
6 2HE LYS 1 2HE LYS 1 -14.364 6.390 -3.919
7 1HZ LYS 1 1HZ LYS 1 -12.986 8.207 -3.755
8 2HZ LYS 1 2HZ LYS 1 -11.791 7.555 -4.657
9 3HZ LYS 1 3HZ LYS 1 -13.166 8.070 -5.373
10 H SER 2 H SER 2 -12.306 8.677 0.521
11 HA SER 2 HA SER 2 -10.313 10.478 -0.617
12 2HB SER 2 2HB SER 2 -12.492 11.157 -1.388
13 HG SER 2 HG SER 2 -14.019 11.816 0.534
14 H SER 3 H SER 3 -12.496 10.007 2.262
15 HA SER 3 HA SER 3 -10.347 11.153 3.863
16 2HB SER 3 2HB SER 3 -12.460 11.247 5.553
17 HG SER 3 HG SER 3 -12.259 13.176 3.414
18 H ALA 4 H ALA 4 -9.307 8.963 3.804
19 HA ALA 4 HA ALA 4 -10.158 7.425 6.063
20 1HB ALA 4 1HB ALA 4 -11.375 5.895 4.953
21 2HB ALA 4 2HB ALA 4 -10.997 6.662 3.391
22 3HB ALA 4 3HB ALA 4 -9.900 5.435 4.070
23 H TYR 5 H TYR 5 -8.574 5.320 6.074
24 HA TYR 5 HA TYR 5 -5.926 6.456 5.530
25 2HB TYR 5 2HB TYR 5 -6.910 5.658 7.867
26 HD1 TYR 5 1HD TYR 5 -8.749 4.076 7.971
27 HD2 TYR 5 2HD TYR 5 -4.847 2.808 6.761
28 HE1 TYR 5 1HE TYR 5 -9.441 1.646 8.260
29 HE2 TYR 5 2HE TYR 5 -5.552 0.383 7.053
30 HH TYR 5 HH TYR 5 -8.606 -0.604 7.160
31 H SER 6 H SER 6 -7.972 4.775 3.755
32 HA SER 6 HA SER 6 -5.894 3.334 2.486
33 2HB SER 6 2HB SER 6 -6.289 1.533 3.946
34 HG SER 6 HG SER 6 -9.042 2.367 3.837
35 H LEU 7 H LEU 7 -6.918 2.079 0.488
36 HA LEU 7 HA LEU 7 -9.398 3.381 -0.342
37 2HB LEU 7 2HB LEU 7 -7.885 4.841 -1.314
38 HG LEU 7 HG LEU 7 -5.911 2.951 -1.088
39 1HD1 LEU 7 1HD1 LEU 7 -5.823 3.334 -4.012
40 2HD1 LEU 7 2HD1 LEU 7 -5.353 1.938 -3.013
41 3HD1 LEU 7 3HD1 LEU 7 -7.063 2.196 -3.431
42 1HD2 LEU 7 1HD2 LEU 7 -4.439 4.609 -1.936
43 2HD2 LEU 7 2HD2 LEU 7 -5.724 5.354 -2.914
44 3HD2 LEU 7 3HD2 LEU 7 -5.778 5.469 -1.139
45 H GLN 8 H GLN 8 -6.802 1.071 -1.417
46 HA GLN 8 HA GLN 8 -8.870 -0.925 -1.655
47 2HB GLN 8 2HB GLN 8 -7.013 -0.865 -3.983
48 2HG GLN 8 2HG GLN 8 -9.989 -0.901 -4.261
49 1HE2 GLN 8 1HE2 GLN 8 -10.347 -1.469 -6.257
50 2HE2 GLN 8 2HE2 GLN 8 -9.324 -2.413 -7.286
51 H MET 9 H MET 9 -7.962 -3.155 -1.811
52 HA MET 9 HA MET 9 -5.130 -3.301 -1.264
53 2HB MET 9 2HB MET 9 -5.662 -3.420 0.999
54 2HG MET 9 2HG MET 9 -8.423 -3.912 -0.067
55 1HE MET 9 1HE MET 9 -10.350 -5.993 1.539
56 2HE MET 9 2HE MET 9 -10.529 -4.681 2.729
57 3HE MET 9 3HE MET 9 -10.285 -4.295 1.008
58 H GLY 10 H GLY 10 -8.260 -5.109 -1.575
59 1HA GLY 10 1HA GLY 10 -8.749 -7.081 -2.545
60 2HA GLY 10 2HA GLY 10 -7.618 -6.584 -3.786
61 H ALA 11 H ALA 11 -5.424 -7.356 -3.763
62 HA ALA 11 HA ALA 11 -4.500 -8.989 -1.623
63 1HB ALA 11 1HB ALA 11 -5.965 -10.211 -3.869
64 2HB ALA 11 2HB ALA 11 -4.338 -10.892 -3.630
65 3HB ALA 11 3HB ALA 11 -5.511 -10.900 -2.292
66 H THR 12 H THR 12 -4.243 -8.477 -5.215
67 HA THR 12 HA THR 12 -1.430 -8.728 -5.230
68 HB THR 12 HB THR 12 -1.732 -7.834 -7.561
69 HG1 THR 12 1HG THR 12 -3.970 -7.160 -8.035
70 1HG2 THR 12 1HG2 THR 12 -2.709 -10.237 -6.682
71 2HG2 THR 12 2HG2 THR 12 -4.225 -9.471 -7.217
72 3HG2 THR 12 3HG2 THR 12 -2.882 -9.687 -8.366
73 H ALA 13 H ALA 13 -3.630 -5.867 -5.110
74 HA ALA 13 HA ALA 13 -1.861 -3.857 -5.386
75 1HB ALA 13 1HB ALA 13 -3.856 -2.892 -4.966
76 2HB ALA 13 2HB ALA 13 -4.426 -4.304 -4.044
77 3HB ALA 13 3HB ALA 13 -3.457 -3.046 -3.239
78 H ILE 14 H ILE 14 -2.337 -5.954 -2.498
79 HA ILE 14 HA ILE 14 -0.868 -4.612 -0.652
80 HB ILE 14 HB ILE 14 -1.007 -7.583 -1.177
81 2HG1 ILE 14 2HG1 ILE 14 -3.201 -6.615 -0.884
82 1HG2 ILE 14 1HG2 ILE 14 -0.081 -8.021 0.887
83 2HG2 ILE 14 2HG2 ILE 14 0.896 -6.638 0.343
84 3HG2 ILE 14 3HG2 ILE 14 -0.422 -6.390 1.513
85 1HD1 ILE 14 1HD1 ILE 14 -3.127 -7.499 1.859
86 2HD1 ILE 14 2HD1 ILE 14 -3.727 -8.377 0.431
87 3HD1 ILE 14 3HD1 ILE 14 -2.018 -8.518 0.910
88 H LYS 15 H LYS 15 0.403 -6.965 -3.111
89 HA LYS 15 HA LYS 15 3.029 -6.898 -2.478
90 2HB LYS 15 2HB LYS 15 1.489 -7.249 -5.004
91 2HG LYS 15 2HG LYS 15 3.976 -7.825 -5.902
92 2HD LYS 15 2HD LYS 15 3.024 -4.941 -6.018
93 2HE LYS 15 2HE LYS 15 3.976 -6.772 -8.257
94 1HZ LYS 15 1HZ LYS 15 2.864 -4.622 -8.699
95 2HZ LYS 15 2HZ LYS 15 4.099 -3.856 -7.957
96 3HZ LYS 15 3HZ LYS 15 4.375 -4.727 -9.311
97 H GLN 16 H GLN 16 1.159 -4.420 -4.307
98 HA GLN 16 HA GLN 16 3.281 -2.880 -5.084
99 2HB GLN 16 2HB GLN 16 0.537 -2.737 -5.303
100 2HG GLN 16 2HG GLN 16 1.475 -0.331 -3.669
101 1HE2 GLN 16 1HE2 GLN 16 0.569 1.430 -4.381
102 2HE2 GLN 16 2HE2 GLN 16 -1.005 1.599 -5.085
103 H VAL 17 H VAL 17 1.437 -2.900 -1.982
104 HA VAL 17 HA VAL 17 2.531 -0.644 -0.840
105 HB VAL 17 HB VAL 17 0.646 -2.244 -0.097
106 1HG1 VAL 17 1HG1 VAL 17 2.324 -3.462 1.937
107 2HG1 VAL 17 2HG1 VAL 17 1.143 -4.212 0.836
108 3HG1 VAL 17 3HG1 VAL 17 2.823 -3.968 0.305
109 1HG2 VAL 17 1HG2 VAL 17 2.544 -1.036 1.945
110 2HG2 VAL 17 2HG2 VAL 17 1.248 -0.178 1.078
111 3HG2 VAL 17 3HG2 VAL 17 0.842 -1.472 2.232
112 H LYS 18 H LYS 18 3.881 -3.914 -1.305
113 HA LYS 18 HA LYS 18 6.021 -3.616 0.493
114 2HB LYS 18 2HB LYS 18 5.093 -5.538 -1.498
115 2HG LYS 18 2HG LYS 18 7.555 -6.541 -1.464
116 2HD LYS 18 2HD LYS 18 7.980 -4.870 -3.574
117 2HE LYS 18 2HE LYS 18 5.789 -7.001 -3.488
118 1HZ LYS 18 1HZ LYS 18 7.558 -6.273 -5.705
119 2HZ LYS 18 2HZ LYS 18 6.208 -7.191 -5.751
120 3HZ LYS 18 3HZ LYS 18 6.091 -5.580 -5.512
121 H LYS 19 H LYS 19 5.496 -2.705 -2.929
122 HA LYS 19 HA LYS 19 8.192 -2.088 -3.456
123 2HB LYS 19 2HB LYS 19 5.616 -1.927 -4.803
124 2HG LYS 19 2HG LYS 19 6.561 -0.134 -6.427
125 2HD LYS 19 2HD LYS 19 5.924 1.695 -4.445
126 2HE LYS 19 2HE LYS 19 4.062 -0.097 -6.075
127 1HZ LYS 19 1HZ LYS 19 3.433 1.677 -4.084
128 2HZ LYS 19 2HZ LYS 19 3.111 2.466 -5.478
129 3HZ LYS 19 3HZ LYS 19 2.412 1.021 -5.176
130 H LEU 20 H LEU 20 5.776 -0.596 -1.485
131 HA LEU 20 HA LEU 20 7.083 2.004 -1.687
132 2HB LEU 20 2HB LEU 20 4.454 1.302 -1.534
133 HG LEU 20 HG LEU 20 4.779 0.785 0.953
134 1HD1 LEU 20 1HD1 LEU 20 4.502 3.441 1.912
135 2HD1 LEU 20 2HD1 LEU 20 5.797 2.267 2.247
136 3HD1 LEU 20 3HD1 LEU 20 5.949 3.394 0.877
137 1HD2 LEU 20 1HD2 LEU 20 2.603 1.274 1.285
138 2HD2 LEU 20 2HD2 LEU 20 2.792 2.974 0.795
139 3HD2 LEU 20 3HD2 LEU 20 2.654 1.702 -0.442
140 H PHE 21 H PHE 21 7.150 -0.934 0.115
141 HA PHE 21 HA PHE 21 7.701 0.060 2.664
142 2HB PHE 21 2HB PHE 21 9.157 -2.384 1.775
143 HD1 PHE 21 1HD PHE 21 5.804 -1.619 3.248
144 HD2 PHE 21 2HD PHE 21 9.623 -3.390 3.787
145 HE1 PHE 21 1HE PHE 21 5.118 -2.402 5.532
146 HE2 PHE 21 2HE PHE 21 8.937 -4.172 6.071
147 HZ PHE 21 HZ PHE 21 6.693 -3.669 6.917
148 H LYS 22 H LYS 22 9.562 0.099 -0.282
149 HA LYS 22 HA LYS 22 12.132 -0.009 0.876
150 2HB LYS 22 2HB LYS 22 12.214 -0.480 -1.357
151 2HG LYS 22 2HG LYS 22 9.926 -0.008 -1.988
152 2HD LYS 22 2HD LYS 22 9.655 2.068 -0.598
153 2HE LYS 22 2HE LYS 22 11.536 3.435 -0.989
154 1HZ LYS 22 1HZ LYS 22 11.109 2.862 -3.835
155 2HZ LYS 22 2HZ LYS 22 12.165 3.986 -3.301
156 3HZ LYS 22 3HZ LYS 22 12.382 2.415 -2.915
157 H LYS 23 H LYS 23 9.637 2.200 1.300
158 HA LYS 23 HA LYS 23 11.576 4.345 1.829
159 2HB LYS 23 2HB LYS 23 9.990 4.809 -0.051
160 2HG LYS 23 2HG LYS 23 8.065 3.941 1.978
161 2HD LYS 23 2HD LYS 23 8.110 6.799 1.338
162 2HE LYS 23 2HE LYS 23 6.100 5.166 -0.037
163 1HZ LYS 23 1HZ LYS 23 4.726 5.563 1.801
164 2HZ LYS 23 2HZ LYS 23 5.214 7.113 1.969
165 3HZ LYS 23 3HZ LYS 23 4.293 6.681 0.692
166 H TRP 24 H TRP 24 8.961 2.262 2.969
167 HA TRP 24 HA TRP 24 8.665 3.765 5.421
168 2HB TRP 24 2HB TRP 24 7.192 1.686 5.941
169 HD1 TRP 24 HD TRP 24 7.281 4.991 4.392
170 HE1 TRP 24 1HE TRP 24 4.903 6.037 3.924
171 HE3 TRP 24 3HE TRP 24 4.682 0.658 4.966
172 HZ2 TRP 24 2HZ TRP 24 2.262 4.958 3.848
173 HZ3 TRP 24 3HZ TRP 24 2.207 0.742 4.677
174 HH2 TRP 24 HH TRP 24 0.997 2.796 4.138
175 H GLY 25 H GLY 25 9.161 2.789 7.541
176 1HA GLY 25 1HA GLY 25 10.800 0.414 7.622
177 2HA GLY 25 2HA GLY 25 11.692 1.899 7.889
178 H TRP 26 H TRP 26 10.888 3.412 9.634
179 HA TRP 26 HA TRP 26 10.515 2.019 12.018
180 2HB TRP 26 2HB TRP 26 11.489 4.358 11.567
181 HD1 TRP 26 HD TRP 26 8.446 4.592 9.963
182 HE1 TRP 26 1HE TRP 26 7.202 6.918 10.023
183 HE3 TRP 26 3HE TRP 26 10.992 6.444 13.956
184 HZ2 TRP 26 2HZ TRP 26 7.416 9.220 11.696
185 HZ3 TRP 26 3HZ TRP 26 10.412 8.738 14.739
186 HH2 TRP 26 HH TRP 26 8.694 10.114 13.678
Start of MODEL 17
1 1H LYS 1 H LYS 1 -3.329 14.372 5.853
2 HA LYS 1 HA LYS 1 -3.138 15.050 3.089
3 2HB LYS 1 2HB LYS 1 -0.610 14.149 3.213
4 2HG LYS 1 2HG LYS 1 -1.396 17.060 3.701
5 2HD LYS 1 2HD LYS 1 0.645 16.967 1.822
6 2HE LYS 1 2HE LYS 1 2.132 17.683 3.742
7 1HZ LYS 1 1HZ LYS 1 -0.563 18.841 3.871
8 2HZ LYS 1 2HZ LYS 1 0.843 19.581 4.251
9 3HZ LYS 1 3HZ LYS 1 0.519 19.192 2.698
10 H SER 2 H SER 2 -1.680 12.688 5.443
11 HA SER 2 HA SER 2 -1.859 10.494 3.923
12 2HB SER 2 2HB SER 2 -2.364 9.318 6.254
13 HG SER 2 HG SER 2 -0.052 10.941 5.644
14 H SER 3 H SER 3 -3.493 9.317 2.977
15 HA SER 3 HA SER 3 -6.167 10.140 3.493
16 2HB SER 3 2HB SER 3 -4.956 8.042 1.643
17 HG SER 3 HG SER 3 -6.938 7.486 1.017
18 H ALA 4 H ALA 4 -4.587 6.855 3.388
19 HA ALA 4 HA ALA 4 -5.479 6.140 5.959
20 1HB ALA 4 1HB ALA 4 -7.239 4.559 5.377
21 2HB ALA 4 2HB ALA 4 -7.683 6.174 4.775
22 3HB ALA 4 3HB ALA 4 -7.060 4.945 3.648
23 H TYR 5 H TYR 5 -5.071 4.666 2.654
24 HA TYR 5 HA TYR 5 -3.836 2.937 1.985
25 2HB TYR 5 2HB TYR 5 -1.396 3.211 2.766
26 HD1 TYR 5 1HD TYR 5 -1.572 3.813 0.330
27 HD2 TYR 5 2HD TYR 5 -2.417 6.630 3.438
28 HE1 TYR 5 1HE TYR 5 -1.332 5.725 -1.328
29 HE2 TYR 5 2HE TYR 5 -2.172 8.532 1.770
30 HH TYR 5 HH TYR 5 -0.889 8.010 -1.384
31 H SER 6 H SER 6 -5.305 1.422 3.188
32 HA SER 6 HA SER 6 -3.720 -0.340 4.692
33 2HB SER 6 2HB SER 6 -4.891 -0.279 6.821
34 HG SER 6 HG SER 6 -4.420 2.491 6.150
35 H LEU 7 H LEU 7 -7.005 0.816 3.759
36 HA LEU 7 HA LEU 7 -8.353 -1.589 4.025
37 2HB LEU 7 2HB LEU 7 -8.967 0.966 3.309
38 HG LEU 7 HG LEU 7 -9.345 -0.774 0.866
39 1HD1 LEU 7 1HD1 LEU 7 -11.061 0.588 0.059
40 2HD1 LEU 7 2HD1 LEU 7 -11.496 0.312 1.763
41 3HD1 LEU 7 3HD1 LEU 7 -10.759 1.855 1.272
42 1HD2 LEU 7 1HD2 LEU 7 -7.831 0.528 -0.101
43 2HD2 LEU 7 2HD2 LEU 7 -8.703 2.000 0.389
44 3HD2 LEU 7 3HD2 LEU 7 -7.516 1.262 1.490
45 H GLN 8 H GLN 8 -7.590 -3.498 3.249
46 HA GLN 8 HA GLN 8 -6.747 -3.455 0.455
47 2HB GLN 8 2HB GLN 8 -5.657 -5.780 1.504
48 2HG GLN 8 2HG GLN 8 -4.383 -3.003 1.435
49 1HE2 GLN 8 1HE2 GLN 8 -2.145 -3.001 1.252
50 2HE2 GLN 8 2HE2 GLN 8 -1.155 -4.324 1.769
51 H MET 9 H MET 9 -8.022 -4.609 -0.935
52 HA MET 9 HA MET 9 -9.336 -6.960 0.062
53 2HB MET 9 2HB MET 9 -11.503 -5.920 -1.181
54 2HG MET 9 2HG MET 9 -11.360 -4.586 1.413
55 1HE MET 9 1HE MET 9 -13.735 -7.591 2.747
56 2HE MET 9 2HE MET 9 -12.604 -8.477 1.698
57 3HE MET 9 3HE MET 9 -11.990 -7.255 2.836
58 H GLY 10 H GLY 10 -8.858 -4.625 -2.658
59 1HA GLY 10 1HA GLY 10 -9.616 -6.231 -4.777
60 2HA GLY 10 2HA GLY 10 -8.412 -4.958 -4.835
61 H ALA 11 H ALA 11 -6.224 -5.470 -4.988
62 HA ALA 11 HA ALA 11 -5.038 -7.784 -4.079
63 1HB ALA 11 1HB ALA 11 -6.589 -8.169 -6.518
64 2HB ALA 11 2HB ALA 11 -4.863 -8.502 -6.794
65 3HB ALA 11 3HB ALA 11 -5.743 -9.369 -5.512
66 H THR 12 H THR 12 -4.832 -6.367 -7.407
67 HA THR 12 HA THR 12 -2.178 -6.011 -7.556
68 HB THR 12 HB THR 12 -2.734 -4.175 -9.156
69 HG1 THR 12 1HG THR 12 -5.144 -3.644 -9.077
70 1HG2 THR 12 1HG2 THR 12 -4.037 -6.775 -9.142
71 2HG2 THR 12 2HG2 THR 12 -5.165 -5.560 -9.786
72 3HG2 THR 12 3HG2 THR 12 -3.571 -5.783 -10.544
73 H ALA 13 H ALA 13 -4.434 -3.573 -6.100
74 HA ALA 13 HA ALA 13 -2.735 -1.626 -5.438
75 1HB ALA 13 1HB ALA 13 -5.226 -2.728 -4.392
76 2HB ALA 13 2HB ALA 13 -4.246 -1.995 -3.099
77 3HB ALA 13 3HB ALA 13 -4.704 -1.032 -4.524
78 H ILE 14 H ILE 14 -2.967 -4.857 -3.888
79 HA ILE 14 HA ILE 14 -1.537 -4.541 -1.639
80 HB ILE 14 HB ILE 14 -1.399 -6.769 -3.670
81 2HG1 ILE 14 2HG1 ILE 14 -3.622 -6.099 -2.574
82 1HG2 ILE 14 1HG2 ILE 14 0.576 -6.686 -2.096
83 2HG2 ILE 14 2HG2 ILE 14 -0.577 -6.946 -0.766
84 3HG2 ILE 14 3HG2 ILE 14 -0.401 -8.173 -2.043
85 1HD1 ILE 14 1HD1 ILE 14 -2.557 -8.917 -2.078
86 2HD1 ILE 14 2HD1 ILE 14 -4.265 -8.445 -2.250
87 3HD1 ILE 14 3HD1 ILE 14 -3.163 -8.326 -3.643
88 H LYS 15 H LYS 15 -0.031 -5.263 -4.873
89 HA LYS 15 HA LYS 15 2.578 -4.966 -4.059
90 2HB LYS 15 2HB LYS 15 3.128 -4.887 -6.352
91 2HG LYS 15 2HG LYS 15 1.359 -6.774 -5.400
92 2HD LYS 15 2HD LYS 15 -0.043 -5.144 -7.434
93 2HE LYS 15 2HE LYS 15 0.865 -7.231 -8.720
94 1HZ LYS 15 1HZ LYS 15 0.333 -8.760 -6.900
95 2HZ LYS 15 2HZ LYS 15 -1.261 -8.490 -7.132
96 3HZ LYS 15 3HZ LYS 15 -0.373 -9.194 -8.307
97 H GLN 16 H GLN 16 0.154 -2.498 -5.019
98 HA GLN 16 HA GLN 16 1.869 -0.376 -5.254
99 2HB GLN 16 2HB GLN 16 -0.900 -0.794 -5.326
100 2HG GLN 16 2HG GLN 16 -0.219 1.357 -3.265
101 1HE2 GLN 16 1HE2 GLN 16 -2.188 2.167 -2.236
102 2HE2 GLN 16 2HE2 GLN 16 -3.608 2.429 -3.195
103 H VAL 17 H VAL 17 0.354 -1.853 -2.347
104 HA VAL 17 HA VAL 17 0.991 0.129 -0.519
105 HB VAL 17 HB VAL 17 -0.455 -2.005 -0.353
106 1HG1 VAL 17 1HG1 VAL 17 2.030 -3.248 -0.559
107 2HG1 VAL 17 2HG1 VAL 17 1.623 -3.375 1.169
108 3HG1 VAL 17 3HG1 VAL 17 0.500 -4.007 -0.059
109 1HG2 VAL 17 1HG2 VAL 17 -0.242 -0.348 1.435
110 2HG2 VAL 17 2HG2 VAL 17 -0.265 -1.997 2.105
111 3HG2 VAL 17 3HG2 VAL 17 1.273 -1.109 1.980
112 H LYS 18 H LYS 18 2.967 -2.417 -2.041
113 HA LYS 18 HA LYS 18 5.115 -2.261 -0.234
114 2HB LYS 18 2HB LYS 18 4.470 -3.588 -2.744
115 2HG LYS 18 2HG LYS 18 7.072 -3.936 -3.107
116 2HD LYS 18 2HD LYS 18 6.946 -1.611 -4.510
117 2HE LYS 18 2HE LYS 18 5.311 -4.132 -5.070
118 1HZ LYS 18 1HZ LYS 18 5.193 -3.405 -7.220
119 2HZ LYS 18 2HZ LYS 18 4.948 -2.005 -6.416
120 3HZ LYS 18 3HZ LYS 18 6.408 -2.324 -7.074
121 H LYS 19 H LYS 19 4.127 -0.366 -3.094
122 HA LYS 19 HA LYS 19 6.599 0.959 -3.402
123 2HB LYS 19 2HB LYS 19 3.939 1.002 -4.588
124 2HG LYS 19 2HG LYS 19 4.402 3.409 -5.489
125 2HD LYS 19 2HD LYS 19 3.485 4.250 -3.015
126 2HE LYS 19 2HE LYS 19 1.175 3.454 -3.955
127 1HZ LYS 19 1HZ LYS 19 1.678 4.975 -5.987
128 2HZ LYS 19 2HZ LYS 19 1.619 5.592 -4.476
129 3HZ LYS 19 3HZ LYS 19 3.062 5.281 -5.175
130 H LEU 20 H LEU 20 4.066 1.143 -1.042
131 HA LEU 20 HA LEU 20 4.722 3.883 -0.345
132 2HB LEU 20 2HB LEU 20 2.406 2.446 -0.283
133 HG LEU 20 HG LEU 20 3.195 1.257 1.819
134 1HD1 LEU 20 1HD1 LEU 20 3.723 3.977 2.613
135 2HD1 LEU 20 2HD1 LEU 20 2.571 3.218 3.737
136 3HD1 LEU 20 3HD1 LEU 20 4.147 2.453 3.427
137 1HD2 LEU 20 1HD2 LEU 20 0.863 2.636 2.834
138 2HD2 LEU 20 2HD2 LEU 20 0.698 2.302 1.093
139 3HD2 LEU 20 3HD2 LEU 20 1.031 0.971 2.228
140 H PHE 21 H PHE 21 5.762 0.654 0.319
141 HA PHE 21 HA PHE 21 6.515 1.029 3.015
142 2HB PHE 21 2HB PHE 21 8.173 -0.830 1.443
143 HD1 PHE 21 1HD PHE 21 8.907 -1.781 3.473
144 HD2 PHE 21 2HD PHE 21 4.747 -1.503 2.677
145 HE1 PHE 21 1HE PHE 21 8.430 -3.250 5.452
146 HE2 PHE 21 2HE PHE 21 4.271 -2.971 4.655
147 HZ PHE 21 HZ PHE 21 6.117 -3.828 6.020
148 H LYS 22 H LYS 22 7.780 2.210 0.010
149 HA LYS 22 HA LYS 22 10.469 2.179 0.303
150 2HB LYS 22 2HB LYS 22 8.918 3.211 -1.517
151 2HG LYS 22 2HG LYS 22 9.152 5.796 -1.330
152 2HD LYS 22 2HD LYS 22 7.184 4.045 0.142
153 2HE LYS 22 2HE LYS 22 7.692 6.906 0.715
154 1HZ LYS 22 1HZ LYS 22 5.016 6.815 0.839
155 2HZ LYS 22 2HZ LYS 22 5.872 7.616 -0.299
156 3HZ LYS 22 3HZ LYS 22 5.303 6.117 -0.609
157 H LYS 23 H LYS 23 8.095 4.284 2.000
158 HA LYS 23 HA LYS 23 10.211 5.677 3.367
159 2HB LYS 23 2HB LYS 23 8.114 6.795 2.648
160 2HG LYS 23 2HG LYS 23 6.774 5.367 4.973
161 2HD LYS 23 2HD LYS 23 5.113 6.235 2.732
162 2HE LYS 23 2HE LYS 23 4.343 5.818 5.089
163 1HZ LYS 23 1HZ LYS 23 5.991 8.191 5.591
164 2HZ LYS 23 2HZ LYS 23 4.811 7.705 6.610
165 3HZ LYS 23 3HZ LYS 23 6.092 6.734 6.322
166 H TRP 24 H TRP 24 7.635 3.257 4.157
167 HA TRP 24 HA TRP 24 8.163 3.022 6.849
168 2HB TRP 24 2HB TRP 24 7.230 0.708 6.579
169 HD1 TRP 24 HD TRP 24 6.271 4.174 6.472
170 HE1 TRP 24 1HE TRP 24 3.670 4.621 6.488
171 HE3 TRP 24 3HE TRP 24 4.920 -0.561 5.200
172 HZ2 TRP 24 2HZ TRP 24 1.391 2.981 5.976
173 HZ3 TRP 24 3HZ TRP 24 2.487 -1.054 4.979
174 HH2 TRP 24 HH TRP 24 0.749 0.625 5.344
175 H GLY 25 H GLY 25 9.385 1.291 8.012
176 1HA GLY 25 1HA GLY 25 11.266 -0.370 6.792
177 2HA GLY 25 2HA GLY 25 12.065 1.150 7.144
178 H TRP 26 H TRP 26 10.709 -1.804 8.468
179 HA TRP 26 HA TRP 26 10.309 -1.255 11.089
180 2HB TRP 26 2HB TRP 26 11.274 -3.603 11.464
181 HD1 TRP 26 HD TRP 26 8.341 -2.051 11.223
182 HE1 TRP 26 1HE TRP 26 6.189 -3.402 10.513
183 HE3 TRP 26 3HE TRP 26 10.838 -5.887 9.005
184 HZ2 TRP 26 2HZ TRP 26 5.780 -5.868 9.135
185 HZ3 TRP 26 3HZ TRP 26 9.486 -7.725 8.003
186 HH2 TRP 26 HH TRP 26 7.043 -7.757 8.042
Start of MODEL 18
1 1H LYS 1 H LYS 1 -1.764 14.656 -1.378
2 HA LYS 1 HA LYS 1 -0.780 12.145 -1.030
3 2HB LYS 1 2HB LYS 1 -1.745 12.500 1.388
4 2HG LYS 1 2HG LYS 1 0.437 13.817 -0.135
5 2HD LYS 1 2HD LYS 1 0.308 14.880 2.613
6 2HE LYS 1 2HE LYS 1 0.888 17.004 1.361
7 1HZ LYS 1 1HZ LYS 1 2.568 15.341 1.990
8 2HZ LYS 1 2HZ LYS 1 2.469 14.687 0.497
9 3HZ LYS 1 3HZ LYS 1 2.994 16.222 0.682
10 H SER 2 H SER 2 -2.029 10.779 -2.506
11 HA SER 2 HA SER 2 -4.759 10.326 -1.867
12 2HB SER 2 2HB SER 2 -4.317 8.332 -3.541
13 HG SER 2 HG SER 2 -3.724 10.667 -4.948
14 H SER 3 H SER 3 -4.509 9.739 0.440
15 HA SER 3 HA SER 3 -3.220 7.168 0.830
16 2HB SER 3 2HB SER 3 -4.286 8.389 3.257
17 HG SER 3 HG SER 3 -2.205 6.961 2.584
18 H ALA 4 H ALA 4 -4.394 5.333 1.499
19 HA ALA 4 HA ALA 4 -7.307 5.702 1.518
20 1HB ALA 4 1HB ALA 4 -7.272 4.064 -0.019
21 2HB ALA 4 2HB ALA 4 -5.511 3.878 0.166
22 3HB ALA 4 3HB ALA 4 -6.618 2.966 1.220
23 H TYR 5 H TYR 5 -8.543 4.304 3.034
24 HA TYR 5 HA TYR 5 -6.937 3.636 5.407
25 2HB TYR 5 2HB TYR 5 -9.421 4.284 6.378
26 HD1 TYR 5 1HD TYR 5 -7.113 6.577 4.488
27 HD2 TYR 5 2HD TYR 5 -8.810 5.481 8.259
28 HE1 TYR 5 1HE TYR 5 -5.833 8.461 5.619
29 HE2 TYR 5 2HE TYR 5 -7.524 7.367 9.378
30 HH TYR 5 HH TYR 5 -5.632 8.698 9.044
31 H SER 6 H SER 6 -6.853 1.408 4.651
32 HA SER 6 HA SER 6 -8.891 -0.123 5.704
33 2HB SER 6 2HB SER 6 -8.880 -0.324 2.672
34 HG SER 6 HG SER 6 -11.081 -1.185 3.227
35 H LEU 7 H LEU 7 -8.561 -2.578 4.908
36 HA LEU 7 HA LEU 7 -5.710 -2.994 5.007
37 2HB LEU 7 2HB LEU 7 -6.283 -5.305 5.407
38 HG LEU 7 HG LEU 7 -8.160 -3.495 6.954
39 1HD1 LEU 7 1HD1 LEU 7 -7.458 -5.654 8.564
40 2HD1 LEU 7 2HD1 LEU 7 -9.032 -5.366 7.781
41 3HD1 LEU 7 3HD1 LEU 7 -7.809 -6.382 6.978
42 1HD2 LEU 7 1HD2 LEU 7 -5.282 -3.849 7.012
43 2HD2 LEU 7 2HD2 LEU 7 -6.307 -2.661 7.853
44 3HD2 LEU 7 3HD2 LEU 7 -6.022 -4.262 8.577
45 H GLN 8 H GLN 8 -8.414 -4.268 2.932
46 HA GLN 8 HA GLN 8 -6.853 -3.735 0.617
47 2HB GLN 8 2HB GLN 8 -5.845 -5.882 1.369
48 2HG GLN 8 2HG GLN 8 -8.654 -7.007 0.942
49 1HE2 GLN 8 1HE2 GLN 8 -8.018 -8.655 -0.373
50 2HE2 GLN 8 2HE2 GLN 8 -6.958 -9.937 0.108
51 H MET 9 H MET 9 -8.112 -4.152 -1.402
52 HA MET 9 HA MET 9 -10.818 -4.978 -1.070
53 2HB MET 9 2HB MET 9 -11.506 -2.643 -2.198
54 2HG MET 9 2HG MET 9 -10.859 -2.174 0.672
55 1HE MET 9 1HE MET 9 -14.570 -2.759 1.252
56 2HE MET 9 2HE MET 9 -15.057 -2.966 -0.448
57 3HE MET 9 3HE MET 9 -13.747 -3.963 0.231
58 H GLY 10 H GLY 10 -8.523 -3.118 -3.186
59 1HA GLY 10 1HA GLY 10 -9.721 -4.088 -5.603
60 2HA GLY 10 2HA GLY 10 -8.249 -3.154 -5.436
61 H ALA 11 H ALA 11 -6.218 -4.185 -5.347
62 HA ALA 11 HA ALA 11 -5.704 -6.776 -4.681
63 1HB ALA 11 1HB ALA 11 -5.530 -7.183 -7.508
64 2HB ALA 11 2HB ALA 11 -6.512 -8.077 -6.321
65 3HB ALA 11 3HB ALA 11 -7.188 -6.647 -7.138
66 H THR 12 H THR 12 -5.114 -4.329 -7.285
67 HA THR 12 HA THR 12 -2.335 -4.879 -7.434
68 HB THR 12 HB THR 12 -4.044 -2.485 -8.290
69 HG1 THR 12 1HG THR 12 -4.202 -3.773 -10.179
70 1HG2 THR 12 1HG2 THR 12 -2.230 -2.119 -9.963
71 2HG2 THR 12 2HG2 THR 12 -1.594 -1.940 -8.309
72 3HG2 THR 12 3HG2 THR 12 -1.283 -3.434 -9.226
73 H ALA 13 H ALA 13 -4.257 -2.301 -5.774
74 HA ALA 13 HA ALA 13 -2.276 -0.779 -4.777
75 1HB ALA 13 1HB ALA 13 -4.281 0.036 -4.082
76 2HB ALA 13 2HB ALA 13 -4.999 -1.585 -3.929
77 3HB ALA 13 3HB ALA 13 -3.972 -0.939 -2.626
78 H ILE 14 H ILE 14 -3.390 -3.975 -3.507
79 HA ILE 14 HA ILE 14 -2.029 -4.158 -1.202
80 HB ILE 14 HB ILE 14 -2.400 -6.234 -3.358
81 2HG1 ILE 14 2HG1 ILE 14 -4.398 -5.054 -2.234
82 1HG2 ILE 14 1HG2 ILE 14 -1.824 -7.938 -1.836
83 2HG2 ILE 14 2HG2 ILE 14 -0.519 -6.733 -1.722
84 3HG2 ILE 14 3HG2 ILE 14 -1.772 -6.808 -0.460
85 1HD1 ILE 14 1HD1 ILE 14 -4.568 -7.980 -1.641
86 2HD1 ILE 14 2HD1 ILE 14 -5.642 -6.952 -2.621
87 3HD1 ILE 14 3HD1 ILE 14 -4.107 -7.542 -3.303
88 H LYS 15 H LYS 15 -0.657 -4.598 -4.517
89 HA LYS 15 HA LYS 15 1.916 -5.259 -3.650
90 2HB LYS 15 2HB LYS 15 0.691 -5.356 -6.005
91 2HG LYS 15 2HG LYS 15 0.764 -2.771 -6.120
92 2HD LYS 15 2HD LYS 15 3.644 -3.441 -5.944
93 2HE LYS 15 2HE LYS 15 3.832 -1.221 -7.567
94 1HZ LYS 15 1HZ LYS 15 4.957 -3.510 -7.578
95 2HZ LYS 15 2HZ LYS 15 3.895 -3.872 -8.765
96 3HZ LYS 15 3HZ LYS 15 4.939 -2.631 -8.954
97 H GLN 16 H GLN 16 0.343 -2.103 -4.430
98 HA GLN 16 HA GLN 16 2.562 -0.535 -4.261
99 2HB GLN 16 2HB GLN 16 0.682 1.143 -3.247
100 2HG GLN 16 2HG GLN 16 0.479 0.067 -6.091
101 1HE2 GLN 16 1HE2 GLN 16 1.396 2.884 -6.697
102 2HE2 GLN 16 2HE2 GLN 16 -0.015 3.875 -6.541
103 H VAL 17 H VAL 17 1.013 -2.385 -1.766
104 HA VAL 17 HA VAL 17 1.382 -0.900 0.493
105 HB VAL 17 HB VAL 17 1.710 -3.858 -0.019
106 1HG1 VAL 17 1HG1 VAL 17 2.741 -3.820 2.013
107 2HG1 VAL 17 2HG1 VAL 17 1.992 -2.277 2.492
108 3HG1 VAL 17 3HG1 VAL 17 1.054 -3.788 2.584
109 1HG2 VAL 17 1HG2 VAL 17 -0.541 -4.088 0.443
110 2HG2 VAL 17 2HG2 VAL 17 -0.610 -2.592 1.405
111 3HG2 VAL 17 3HG2 VAL 17 -0.524 -2.504 -0.371
112 H LYS 18 H LYS 18 3.790 -3.012 -1.206
113 HA LYS 18 HA LYS 18 5.862 -2.440 0.611
114 2HB LYS 18 2HB LYS 18 5.902 -4.443 -0.727
115 2HG LYS 18 2HG LYS 18 4.782 -3.141 -2.757
116 2HD LYS 18 2HD LYS 18 6.830 -1.631 -3.014
117 2HE LYS 18 2HE LYS 18 8.033 -4.251 -4.028
118 1HZ LYS 18 1HZ LYS 18 9.663 -1.938 -3.956
119 2HZ LYS 18 2HZ LYS 18 9.457 -3.023 -5.159
120 3HZ LYS 18 3HZ LYS 18 8.423 -1.768 -5.006
121 H LYS 19 H LYS 19 4.511 -0.776 -2.209
122 HA LYS 19 HA LYS 19 6.734 0.851 -2.748
123 2HB LYS 19 2HB LYS 19 3.897 0.688 -3.536
124 2HG LYS 19 2HG LYS 19 4.211 3.025 -4.658
125 2HD LYS 19 2HD LYS 19 3.678 4.041 -2.137
126 2HE LYS 19 2HE LYS 19 1.917 2.478 -4.073
127 1HZ LYS 19 1HZ LYS 19 1.057 2.564 -1.754
128 2HZ LYS 19 2HZ LYS 19 0.996 4.191 -1.880
129 3HZ LYS 19 3HZ LYS 19 0.090 3.261 -2.871
130 H LEU 20 H LEU 20 4.363 0.802 -0.175
131 HA LEU 20 HA LEU 20 4.915 3.569 0.517
132 2HB LEU 20 2HB LEU 20 2.656 2.111 0.638
133 HG LEU 20 HG LEU 20 3.603 0.757 2.590
134 1HD1 LEU 20 1HD1 LEU 20 4.526 1.838 4.291
135 2HD1 LEU 20 2HD1 LEU 20 4.046 3.409 3.606
136 3HD1 LEU 20 3HD1 LEU 20 2.934 2.530 4.682
137 1HD2 LEU 20 1HD2 LEU 20 1.312 1.651 3.921
138 2HD2 LEU 20 2HD2 LEU 20 1.005 1.979 2.199
139 3HD2 LEU 20 3HD2 LEU 20 1.426 0.333 2.730
140 H PHE 21 H PHE 21 6.128 0.383 1.084
141 HA PHE 21 HA PHE 21 7.087 0.931 3.730
142 2HB PHE 21 2HB PHE 21 8.496 -1.242 2.603
143 HD1 PHE 21 1HD PHE 21 8.453 -1.655 5.024
144 HD2 PHE 21 2HD PHE 21 4.905 -1.831 2.702
145 HE1 PHE 21 1HE PHE 21 7.293 -2.869 6.889
146 HE2 PHE 21 2HE PHE 21 3.745 -3.046 4.567
147 HZ PHE 21 HZ PHE 21 4.953 -3.551 6.638
148 H LYS 22 H LYS 22 8.109 1.600 0.466
149 HA LYS 22 HA LYS 22 10.818 1.408 0.564
150 2HB LYS 22 2HB LYS 22 9.109 2.268 -1.264
151 2HG LYS 22 2HG LYS 22 9.479 4.717 -1.659
152 2HD LYS 22 2HD LYS 22 8.360 4.960 1.028
153 2HE LYS 22 2HE LYS 22 6.237 5.294 -0.376
154 1HZ LYS 22 1HZ LYS 22 8.174 6.965 0.081
155 2HZ LYS 22 2HZ LYS 22 8.326 6.917 -1.544
156 3HZ LYS 22 3HZ LYS 22 6.909 7.371 -0.869
157 H LYS 23 H LYS 23 8.704 3.525 2.411
158 HA LYS 23 HA LYS 23 10.999 5.133 3.236
159 2HB LYS 23 2HB LYS 23 9.127 6.450 2.575
160 2HG LYS 23 2HG LYS 23 7.600 4.290 3.823
161 2HD LYS 23 2HD LYS 23 7.519 6.215 5.609
162 2HE LYS 23 2HE LYS 23 5.288 7.562 4.566
163 1HZ LYS 23 1HZ LYS 23 7.709 8.962 4.198
164 2HZ LYS 23 2HZ LYS 23 6.521 9.223 5.288
165 3HZ LYS 23 3HZ LYS 23 7.716 8.162 5.621
166 H TRP 24 H TRP 24 8.644 2.691 4.334
167 HA TRP 24 HA TRP 24 9.203 2.923 7.079
168 2HB TRP 24 2HB TRP 24 8.223 0.616 7.168
169 HD1 TRP 24 HD TRP 24 7.246 4.031 5.934
170 HE1 TRP 24 1HE TRP 24 4.679 4.538 6.273
171 HE3 TRP 24 3HE TRP 24 5.914 -0.745 7.063
172 HZ2 TRP 24 2HZ TRP 24 2.429 2.922 6.960
173 HZ3 TRP 24 3HZ TRP 24 3.512 -1.195 7.555
174 HH2 TRP 24 HH TRP 24 1.796 0.545 7.517
175 H GLY 25 H GLY 25 11.350 2.876 7.711
176 1HA GLY 25 1HA GLY 25 13.355 1.381 6.420
177 2HA GLY 25 2HA GLY 25 13.446 2.117 8.007
178 H TRP 26 H TRP 26 14.759 -0.233 7.794
179 HA TRP 26 HA TRP 26 13.344 -1.886 9.628
180 2HB TRP 26 2HB TRP 26 13.805 -2.950 6.836
181 HD1 TRP 26 HD TRP 26 14.507 -4.197 10.117
182 HE1 TRP 26 1HE TRP 26 14.045 -6.770 10.477
183 HE3 TRP 26 3HE TRP 26 11.573 -4.783 6.006
184 HZ2 TRP 26 2HZ TRP 26 12.539 -8.718 9.034
185 HZ3 TRP 26 3HZ TRP 26 10.646 -7.052 5.554
186 HH2 TRP 26 HH TRP 26 11.087 -8.981 6.989
Start of MODEL 19
1 1H LYS 1 H LYS 1 -5.822 3.421 11.453
2 HA LYS 1 HA LYS 1 -3.644 1.674 11.604
3 2HB LYS 1 2HB LYS 1 -5.239 -0.212 12.670
4 2HG LYS 1 2HG LYS 1 -3.981 1.320 14.830
5 2HD LYS 1 2HD LYS 1 -3.135 -1.234 13.382
6 2HE LYS 1 2HE LYS 1 -2.620 -0.499 16.283
7 1HZ LYS 1 1HZ LYS 1 -2.271 -2.752 15.556
8 2HZ LYS 1 2HZ LYS 1 -1.279 -2.265 14.354
9 3HZ LYS 1 3HZ LYS 1 -0.835 -2.059 15.912
10 H SER 2 H SER 2 -3.630 1.143 9.489
11 HA SER 2 HA SER 2 -4.329 0.669 7.481
12 2HB SER 2 2HB SER 2 -5.747 -1.295 7.249
13 HG SER 2 HG SER 2 -3.786 -1.882 8.210
14 H SER 3 H SER 3 -5.126 2.702 6.753
15 HA SER 3 HA SER 3 -8.018 2.789 6.634
16 2HB SER 3 2HB SER 3 -6.601 5.399 7.085
17 HG SER 3 HG SER 3 -8.570 5.969 7.970
18 H ALA 4 H ALA 4 -7.929 2.235 4.404
19 HA ALA 4 HA ALA 4 -6.127 3.562 2.641
20 1HB ALA 4 1HB ALA 4 -6.756 1.902 1.245
21 2HB ALA 4 2HB ALA 4 -7.662 1.239 2.626
22 3HB ALA 4 3HB ALA 4 -8.483 2.282 1.440
23 H TYR 5 H TYR 5 -6.882 4.875 0.739
24 HA TYR 5 HA TYR 5 -9.109 6.609 1.572
25 2HB TYR 5 2HB TYR 5 -7.748 8.297 0.170
26 HD1 TYR 5 1HD TYR 5 -7.670 9.707 2.056
27 HD2 TYR 5 2HD TYR 5 -5.379 6.094 2.036
28 HE1 TYR 5 1HE TYR 5 -6.509 10.422 4.202
29 HE2 TYR 5 2HE TYR 5 -4.225 6.822 4.182
30 HH TYR 5 HH TYR 5 -4.335 8.236 5.890
31 H SER 6 H SER 6 -7.824 4.443 -0.844
32 HA SER 6 HA SER 6 -10.028 4.077 -2.225
33 2HB SER 6 2HB SER 6 -9.283 5.686 -4.335
34 HG SER 6 HG SER 6 -11.407 5.412 -2.905
35 H LEU 7 H LEU 7 -6.543 4.647 -2.241
36 HA LEU 7 HA LEU 7 -6.011 3.212 -4.634
37 2HB LEU 7 2HB LEU 7 -4.517 4.578 -2.513
38 HG LEU 7 HG LEU 7 -3.506 2.220 -2.494
39 1HD1 LEU 7 1HD1 LEU 7 -3.629 1.589 -4.774
40 2HD1 LEU 7 2HD1 LEU 7 -2.795 3.069 -5.306
41 3HD1 LEU 7 3HD1 LEU 7 -1.903 1.820 -4.405
42 1HD2 LEU 7 1HD2 LEU 7 -1.948 3.500 -1.545
43 2HD2 LEU 7 2HD2 LEU 7 -1.144 3.513 -3.133
44 3HD2 LEU 7 3HD2 LEU 7 -2.238 4.842 -2.679
45 H GLN 8 H GLN 8 -6.243 2.421 -1.142
46 HA GLN 8 HA GLN 8 -5.703 -0.346 -1.868
47 2HB GLN 8 2HB GLN 8 -5.839 -0.139 0.950
48 2HG GLN 8 2HG GLN 8 -4.131 -1.199 -0.915
49 1HE2 GLN 8 1HE2 GLN 8 -2.633 -0.482 -2.206
50 2HE2 GLN 8 2HE2 GLN 8 -1.489 0.781 -1.900
51 H MET 9 H MET 9 -7.451 -1.669 -2.090
52 HA MET 9 HA MET 9 -9.533 -1.584 -0.188
53 2HB MET 9 2HB MET 9 -11.263 -1.245 -2.215
54 2HG MET 9 2HG MET 9 -10.022 1.376 -1.511
55 1HE MET 9 1HE MET 9 -11.398 1.660 -3.445
56 2HE MET 9 2HE MET 9 -13.174 1.773 -3.481
57 3HE MET 9 3HE MET 9 -12.220 3.012 -2.631
58 H GLY 10 H GLY 10 -8.649 -2.542 -3.576
59 1HA GLY 10 1HA GLY 10 -10.144 -4.738 -3.997
60 2HA GLY 10 2HA GLY 10 -8.463 -4.611 -4.477
61 H ALA 11 H ALA 11 -6.795 -5.601 -3.209
62 HA ALA 11 HA ALA 11 -7.193 -6.710 -0.694
63 1HB ALA 11 1HB ALA 11 -8.355 -8.244 -2.868
64 2HB ALA 11 2HB ALA 11 -7.035 -9.156 -2.101
65 3HB ALA 11 3HB ALA 11 -8.394 -8.562 -1.118
66 H THR 12 H THR 12 -5.726 -7.577 -3.910
67 HA THR 12 HA THR 12 -3.294 -8.451 -2.849
68 HB THR 12 HB THR 12 -2.552 -8.146 -5.244
69 HG1 THR 12 1HG THR 12 -3.934 -6.896 -6.555
70 1HG2 THR 12 1HG2 THR 12 -4.939 -9.132 -6.212
71 2HG2 THR 12 2HG2 THR 12 -3.729 -10.135 -5.376
72 3HG2 THR 12 3HG2 THR 12 -5.118 -9.479 -4.475
73 H ALA 13 H ALA 13 -4.273 -5.198 -4.093
74 HA ALA 13 HA ALA 13 -1.944 -3.878 -3.987
75 1HB ALA 13 1HB ALA 13 -3.680 -2.079 -2.799
76 2HB ALA 13 2HB ALA 13 -3.559 -2.395 -4.547
77 3HB ALA 13 3HB ALA 13 -4.790 -3.234 -3.573
78 H ILE 14 H ILE 14 -4.059 -4.654 -1.150
79 HA ILE 14 HA ILE 14 -2.798 -3.366 0.832
80 HB ILE 14 HB ILE 14 -3.796 -6.216 0.880
81 2HG1 ILE 14 2HG1 ILE 14 -5.882 -5.087 1.782
82 1HG2 ILE 14 1HG2 ILE 14 -4.170 -5.811 3.289
83 2HG2 ILE 14 2HG2 ILE 14 -2.448 -5.775 2.840
84 3HG2 ILE 14 3HG2 ILE 14 -3.321 -4.253 3.140
85 1HD1 ILE 14 1HD1 ILE 14 -6.168 -2.801 1.650
86 2HD1 ILE 14 2HD1 ILE 14 -4.406 -2.812 1.892
87 3HD1 ILE 14 3HD1 ILE 14 -5.077 -2.640 0.253
88 H LYS 15 H LYS 15 -1.700 -6.422 -0.746
89 HA LYS 15 HA LYS 15 0.489 -6.837 0.934
90 2HB LYS 15 2HB LYS 15 0.106 -7.656 -1.962
91 2HG LYS 15 2HG LYS 15 1.531 -9.633 -1.073
92 2HD LYS 15 2HD LYS 15 3.199 -7.129 -1.018
93 2HE LYS 15 2HE LYS 15 3.663 -9.850 -1.508
94 1HZ LYS 15 1HZ LYS 15 3.915 -10.128 -3.716
95 2HZ LYS 15 2HZ LYS 15 2.649 -9.097 -3.776
96 3HZ LYS 15 3HZ LYS 15 4.164 -8.548 -4.041
97 H GLN 16 H GLN 16 0.154 -5.053 -2.196
98 HA GLN 16 HA GLN 16 2.771 -4.443 -2.563
99 2HB GLN 16 2HB GLN 16 1.738 -2.252 -3.623
100 2HG GLN 16 2HG GLN 16 2.386 -4.090 -5.052
101 1HE2 GLN 16 1HE2 GLN 16 2.799 -6.137 -4.762
102 2HE2 GLN 16 2HE2 GLN 16 1.678 -7.388 -4.337
103 H VAL 17 H VAL 17 0.654 -3.410 -0.009
104 HA VAL 17 HA VAL 17 1.524 -0.900 0.606
105 HB VAL 17 HB VAL 17 0.786 -3.235 2.374
106 1HG1 VAL 17 1HG1 VAL 17 1.647 -0.480 3.069
107 2HG1 VAL 17 2HG1 VAL 17 0.183 -1.074 3.889
108 3HG1 VAL 17 3HG1 VAL 17 1.709 -1.981 4.024
109 1HG2 VAL 17 1HG2 VAL 17 -0.836 -2.146 0.632
110 2HG2 VAL 17 2HG2 VAL 17 -1.405 -2.477 2.285
111 3HG2 VAL 17 3HG2 VAL 17 -0.929 -0.826 1.822
112 H LYS 18 H LYS 18 3.021 -4.063 1.566
113 HA LYS 18 HA LYS 18 5.163 -2.854 2.930
114 2HB LYS 18 2HB LYS 18 4.487 -5.112 3.427
115 2HG LYS 18 2HG LYS 18 3.906 -5.531 0.868
116 2HD LYS 18 2HD LYS 18 6.353 -5.257 0.186
117 2HE LYS 18 2HE LYS 18 6.533 -7.821 1.816
118 1HZ LYS 18 1HZ LYS 18 7.448 -7.879 -0.564
119 2HZ LYS 18 2HZ LYS 18 8.638 -6.924 0.018
120 3HZ LYS 18 3HZ LYS 18 8.393 -8.406 0.660
121 H LYS 19 H LYS 19 4.491 -3.566 -0.472
122 HA LYS 19 HA LYS 19 7.155 -3.466 -1.366
123 2HB LYS 19 2HB LYS 19 4.445 -3.474 -2.551
124 2HG LYS 19 2HG LYS 19 5.636 -2.999 -4.835
125 2HD LYS 19 2HD LYS 19 5.495 -0.343 -4.056
126 2HE LYS 19 2HE LYS 19 3.332 -2.352 -4.799
127 1HZ LYS 19 1HZ LYS 19 1.865 -0.574 -5.024
128 2HZ LYS 19 2HZ LYS 19 2.492 -0.392 -3.526
129 3HZ LYS 19 3HZ LYS 19 3.009 0.560 -4.749
130 H LEU 20 H LEU 20 4.884 -1.041 -0.263
131 HA LEU 20 HA LEU 20 6.373 1.083 -1.569
132 2HB LEU 20 2HB LEU 20 3.736 0.763 -1.072
133 HG LEU 20 HG LEU 20 4.146 1.218 1.414
134 1HD1 LEU 20 1HD1 LEU 20 4.111 4.023 1.368
135 2HD1 LEU 20 2HD1 LEU 20 5.408 2.959 1.959
136 3HD1 LEU 20 3HD1 LEU 20 5.432 3.541 0.278
137 1HD2 LEU 20 1HD2 LEU 20 2.124 2.193 -0.402
138 2HD2 LEU 20 2HD2 LEU 20 1.959 1.561 1.254
139 3HD2 LEU 20 3HD2 LEU 20 2.297 3.289 0.990
140 H PHE 21 H PHE 21 6.436 -0.792 1.311
141 HA PHE 21 HA PHE 21 7.470 1.318 2.968
142 2HB PHE 21 2HB PHE 21 8.024 -1.217 4.099
143 HD1 PHE 21 1HD PHE 21 4.475 -0.451 3.563
144 HD2 PHE 21 2HD PHE 21 7.840 0.143 6.080
145 HE1 PHE 21 1HE PHE 21 2.973 0.458 5.357
146 HE2 PHE 21 2HE PHE 21 6.338 1.052 7.873
147 HZ PHE 21 HZ PHE 21 3.922 1.199 7.491
148 H LYS 22 H LYS 22 8.693 -0.919 0.600
149 HA LYS 22 HA LYS 22 11.192 -1.508 1.598
150 2HB LYS 22 2HB LYS 22 9.824 -2.076 -0.674
151 2HG LYS 22 2HG LYS 22 11.511 -1.274 -2.493
152 2HD LYS 22 2HD LYS 22 9.281 0.289 -1.222
153 2HE LYS 22 2HE LYS 22 11.366 1.781 -2.182
154 1HZ LYS 22 1HZ LYS 22 9.667 1.958 -4.460
155 2HZ LYS 22 2HZ LYS 22 11.298 1.982 -4.374
156 3HZ LYS 22 3HZ LYS 22 10.503 0.556 -4.398
157 H LYS 23 H LYS 23 9.820 1.556 0.690
158 HA LYS 23 HA LYS 23 12.451 2.742 0.322
159 2HB LYS 23 2HB LYS 23 10.919 3.492 -1.293
160 2HG LYS 23 2HG LYS 23 8.987 3.425 0.996
161 2HD LYS 23 2HD LYS 23 9.262 5.755 -0.774
162 2HE LYS 23 2HE LYS 23 6.509 5.593 -0.835
163 1HZ LYS 23 1HZ LYS 23 7.419 4.521 -3.192
164 2HZ LYS 23 2HZ LYS 23 7.113 6.094 -2.875
165 3HZ LYS 23 3HZ LYS 23 8.618 5.497 -2.664
166 H TRP 24 H TRP 24 9.697 2.597 2.604
167 HA TRP 24 HA TRP 24 10.622 4.664 4.282
168 2HB TRP 24 2HB TRP 24 9.028 3.764 5.895
169 HD1 TRP 24 HD TRP 24 8.956 4.933 2.409
170 HE1 TRP 24 1HE TRP 24 6.594 5.810 1.625
171 HE3 TRP 24 3HE TRP 24 6.341 2.943 6.290
172 HZ2 TRP 24 2HZ TRP 24 3.957 5.579 2.690
173 HZ3 TRP 24 3HZ TRP 24 3.877 3.315 6.344
174 HH2 TRP 24 HH TRP 24 2.685 4.582 4.626
175 H GLY 25 H GLY 25 11.344 4.186 6.633
176 1HA GLY 25 1HA GLY 25 12.349 2.255 7.926
177 2HA GLY 25 2HA GLY 25 13.406 2.073 6.540
178 H TRP 26 H TRP 26 15.127 3.536 6.181
179 HA TRP 26 HA TRP 26 15.659 5.277 8.469
180 2HB TRP 26 2HB TRP 26 17.730 4.798 6.409
181 HD1 TRP 26 HD TRP 26 17.012 4.413 10.245
182 HE1 TRP 26 1HE TRP 26 19.035 5.353 11.654
183 HE3 TRP 26 3HE TRP 26 19.900 5.652 6.249
184 HZ2 TRP 26 2HZ TRP 26 21.559 6.486 10.955
185 HZ3 TRP 26 3HZ TRP 26 22.130 6.671 6.699
186 HH2 TRP 26 HH TRP 26 22.972 7.091 8.955
Start of MODEL 20
1 1H LYS 1 H LYS 1 -2.628 12.070 1.078
2 HA LYS 1 HA LYS 1 -1.731 14.098 2.188
3 2HB LYS 1 2HB LYS 1 -4.230 13.884 3.609
4 2HG LYS 1 2HG LYS 1 -4.893 15.421 1.624
5 2HD LYS 1 2HD LYS 1 -2.590 15.969 3.527
6 2HE LYS 1 2HE LYS 1 -2.320 17.387 1.438
7 1HZ LYS 1 1HZ LYS 1 -5.067 17.658 1.791
8 2HZ LYS 1 2HZ LYS 1 -4.392 19.137 1.937
9 3HZ LYS 1 3HZ LYS 1 -4.138 18.253 0.588
10 H SER 2 H SER 2 -3.317 11.822 4.543
11 HA SER 2 HA SER 2 -1.783 13.031 6.631
12 2HB SER 2 2HB SER 2 -3.605 10.599 6.823
13 HG SER 2 HG SER 2 -3.420 10.900 8.934
14 H SER 3 H SER 3 -2.230 9.671 5.292
15 HA SER 3 HA SER 3 0.562 9.221 5.487
16 2HB SER 3 2HB SER 3 -1.188 7.405 7.185
17 HG SER 3 HG SER 3 0.662 6.345 7.289
18 H ALA 4 H ALA 4 -2.436 7.159 5.695
19 HA ALA 4 HA ALA 4 -2.736 6.602 3.044
20 1HB ALA 4 1HB ALA 4 -0.810 5.504 2.544
21 2HB ALA 4 2HB ALA 4 -0.429 5.193 4.254
22 3HB ALA 4 3HB ALA 4 -1.574 4.139 3.391
23 H TYR 5 H TYR 5 -4.781 5.821 3.012
24 HA TYR 5 HA TYR 5 -5.540 3.990 5.182
25 2HB TYR 5 2HB TYR 5 -7.849 5.374 4.518
26 HD1 TYR 5 1HD TYR 5 -4.718 6.705 6.127
27 HD2 TYR 5 2HD TYR 5 -8.827 5.608 6.599
28 HE1 TYR 5 1HE TYR 5 -4.619 7.366 8.580
29 HE2 TYR 5 2HE TYR 5 -8.714 6.273 9.051
30 HH TYR 5 HH TYR 5 -5.761 7.699 10.398
31 H SER 6 H SER 6 -4.932 2.392 3.419
32 HA SER 6 HA SER 6 -6.864 2.350 1.271
33 2HB SER 6 2HB SER 6 -4.488 0.511 1.801
34 HG SER 6 HG SER 6 -5.600 -0.548 0.248
35 H LEU 7 H LEU 7 -8.193 0.423 0.854
36 HA LEU 7 HA LEU 7 -8.906 -0.896 3.348
37 2HB LEU 7 2HB LEU 7 -10.786 0.011 2.384
38 HG LEU 7 HG LEU 7 -9.552 -0.626 -0.235
39 1HD1 LEU 7 1HD1 LEU 7 -12.198 -0.342 -0.969
40 2HD1 LEU 7 2HD1 LEU 7 -11.252 -1.848 -1.005
41 3HD1 LEU 7 3HD1 LEU 7 -12.276 -1.474 0.402
42 1HD2 LEU 7 1HD2 LEU 7 -11.498 1.445 -0.347
43 2HD2 LEU 7 2HD2 LEU 7 -10.579 1.641 1.165
44 3HD2 LEU 7 3HD2 LEU 7 -9.723 1.577 -0.395
45 H GLN 8 H GLN 8 -7.752 -1.569 0.009
46 HA GLN 8 HA GLN 8 -6.757 -3.295 -0.853
47 2HB GLN 8 2HB GLN 8 -6.016 -5.109 1.106
48 2HG GLN 8 2HG GLN 8 -4.815 -2.931 -0.404
49 1HE2 GLN 8 1HE2 GLN 8 -2.861 -1.864 0.032
50 2HE2 GLN 8 2HE2 GLN 8 -2.403 -1.389 1.633
51 H MET 9 H MET 9 -7.815 -4.828 -2.035
52 HA MET 9 HA MET 9 -9.237 -6.892 -0.708
53 2HB MET 9 2HB MET 9 -11.361 -6.230 -2.212
54 2HG MET 9 2HG MET 9 -11.189 -4.348 0.088
55 1HE MET 9 1HE MET 9 -12.478 -7.993 -1.008
56 2HE MET 9 2HE MET 9 -12.316 -7.842 0.758
57 3HE MET 9 3HE MET 9 -13.929 -8.006 0.023
58 H GLY 10 H GLY 10 -8.955 -5.099 -3.859
59 1HA GLY 10 1HA GLY 10 -9.448 -6.965 -5.702
60 2HA GLY 10 2HA GLY 10 -8.112 -5.837 -5.838
61 H ALA 11 H ALA 11 -5.954 -6.481 -5.019
62 HA ALA 11 HA ALA 11 -5.204 -8.788 -3.890
63 1HB ALA 11 1HB ALA 11 -4.607 -10.088 -6.148
64 2HB ALA 11 2HB ALA 11 -6.169 -10.318 -5.324
65 3HB ALA 11 3HB ALA 11 -6.056 -9.235 -6.731
66 H THR 12 H THR 12 -4.700 -6.724 -6.801
67 HA THR 12 HA THR 12 -1.862 -6.970 -6.717
68 HB THR 12 HB THR 12 -3.800 -5.038 -8.092
69 HG1 THR 12 1HG THR 12 -3.663 -6.654 -9.657
70 1HG2 THR 12 1HG2 THR 12 -1.069 -5.624 -9.185
71 2HG2 THR 12 2HG2 THR 12 -2.026 -4.128 -9.283
72 3HG2 THR 12 3HG2 THR 12 -1.126 -4.513 -7.797
73 H ALA 13 H ALA 13 -4.202 -4.432 -5.632
74 HA ALA 13 HA ALA 13 -2.508 -2.512 -4.812
75 1HB ALA 13 1HB ALA 13 -4.321 -2.574 -2.744
76 2HB ALA 13 2HB ALA 13 -4.634 -1.869 -4.348
77 3HB ALA 13 3HB ALA 13 -5.161 -3.530 -3.989
78 H ILE 14 H ILE 14 -3.305 -5.572 -3.054
79 HA ILE 14 HA ILE 14 -2.083 -5.183 -0.698
80 HB ILE 14 HB ILE 14 -2.346 -7.552 -2.495
81 2HG1 ILE 14 2HG1 ILE 14 -3.502 -6.671 0.152
82 1HG2 ILE 14 1HG2 ILE 14 -1.392 -9.004 -0.747
83 2HG2 ILE 14 2HG2 ILE 14 -0.181 -7.917 -1.466
84 3HG2 ILE 14 3HG2 ILE 14 -0.854 -7.560 0.142
85 1HD1 ILE 14 1HD1 ILE 14 -4.845 -5.812 -1.571
86 2HD1 ILE 14 2HD1 ILE 14 -4.491 -7.174 -2.661
87 3HD1 ILE 14 3HD1 ILE 14 -5.600 -7.400 -1.287
88 H LYS 15 H LYS 15 -0.459 -5.993 -3.823
89 HA LYS 15 HA LYS 15 2.114 -6.165 -2.745
90 2HB LYS 15 2HB LYS 15 1.056 -6.804 -5.102
91 2HG LYS 15 2HG LYS 15 0.848 -4.286 -5.661
92 2HD LYS 15 2HD LYS 15 3.765 -4.557 -5.228
93 2HE LYS 15 2HE LYS 15 2.804 -4.061 -7.929
94 1HZ LYS 15 1HZ LYS 15 2.723 -1.799 -7.417
95 2HZ LYS 15 2HZ LYS 15 4.086 -1.835 -6.519
96 3HZ LYS 15 3HZ LYS 15 4.173 -2.006 -8.140
97 H GLN 16 H GLN 16 0.231 -3.412 -4.132
98 HA GLN 16 HA GLN 16 2.232 -1.566 -4.143
99 2HB GLN 16 2HB GLN 16 0.104 0.003 -3.518
100 2HG GLN 16 2HG GLN 16 0.137 -1.533 -6.143
101 1HE2 GLN 16 1HE2 GLN 16 0.337 0.455 -7.821
102 2HE2 GLN 16 2HE2 GLN 16 -0.916 1.638 -7.646
103 H VAL 17 H VAL 17 0.761 -3.158 -1.433
104 HA VAL 17 HA VAL 17 0.803 -1.281 0.547
105 HB VAL 17 HB VAL 17 1.513 -4.216 0.569
106 1HG1 VAL 17 1HG1 VAL 17 1.434 -2.218 2.783
107 2HG1 VAL 17 2HG1 VAL 17 0.707 -3.813 3.091
108 3HG1 VAL 17 3HG1 VAL 17 2.415 -3.692 2.600
109 1HG2 VAL 17 1HG2 VAL 17 -1.025 -3.007 1.637
110 2HG2 VAL 17 2HG2 VAL 17 -0.834 -3.270 -0.114
111 3HG2 VAL 17 3HG2 VAL 17 -0.721 -4.646 1.011
112 H LYS 18 H LYS 18 3.551 -3.320 -0.650
113 HA LYS 18 HA LYS 18 5.418 -2.185 1.125
114 2HB LYS 18 2HB LYS 18 5.787 -4.362 0.164
115 2HG LYS 18 2HG LYS 18 4.644 -3.589 -2.106
116 2HD LYS 18 2HD LYS 18 6.529 -1.886 -2.516
117 2HE LYS 18 2HE LYS 18 8.370 -3.536 -1.837
118 1HZ LYS 18 1HZ LYS 18 8.976 -5.151 -3.351
119 2HZ LYS 18 2HZ LYS 18 7.351 -5.304 -3.301
120 3HZ LYS 18 3HZ LYS 18 8.061 -4.547 -4.562
121 H LYS 19 H LYS 19 4.055 -1.206 -1.993
122 HA LYS 19 HA LYS 19 6.101 0.582 -2.710
123 2HB LYS 19 2HB LYS 19 3.364 -0.084 -3.589
124 2HG LYS 19 2HG LYS 19 3.468 2.051 -5.088
125 2HD LYS 19 2HD LYS 19 2.641 3.401 -2.820
126 2HE LYS 19 2HE LYS 19 0.390 2.108 -3.280
127 1HZ LYS 19 1HZ LYS 19 1.634 3.426 -5.580
128 2HZ LYS 19 2HZ LYS 19 0.061 3.442 -5.137
129 3HZ LYS 19 3HZ LYS 19 1.166 4.263 -4.258
130 H LEU 20 H LEU 20 3.575 0.657 -0.288
131 HA LEU 20 HA LEU 20 3.753 3.550 -0.062
132 2HB LEU 20 2HB LEU 20 1.672 1.853 0.192
133 HG LEU 20 HG LEU 20 2.611 1.005 2.414
134 1HD1 LEU 20 1HD1 LEU 20 1.623 2.954 4.147
135 2HD1 LEU 20 2HD1 LEU 20 3.329 2.532 3.861
136 3HD1 LEU 20 3HD1 LEU 20 2.574 3.859 2.945
137 1HD2 LEU 20 1HD2 LEU 20 0.479 0.347 2.402
138 2HD2 LEU 20 2HD2 LEU 20 0.173 1.736 3.472
139 3HD2 LEU 20 3HD2 LEU 20 -0.092 1.888 1.718
140 H PHE 21 H PHE 21 5.314 0.704 1.080
141 HA PHE 21 HA PHE 21 5.963 1.737 3.668
142 2HB PHE 21 2HB PHE 21 7.781 -0.303 2.913
143 HD1 PHE 21 1HD PHE 21 7.754 -0.584 5.304
144 HD2 PHE 21 2HD PHE 21 4.238 -1.259 3.026
145 HE1 PHE 21 1HE PHE 21 6.692 -1.715 7.277
146 HE2 PHE 21 2HE PHE 21 3.177 -2.390 4.999
147 HZ PHE 21 HZ PHE 21 4.417 -2.606 7.101
148 H LYS 22 H LYS 22 7.150 2.145 0.417
149 HA LYS 22 HA LYS 22 9.853 2.453 0.817
150 2HB LYS 22 2HB LYS 22 8.190 2.636 -1.301
151 2HG LYS 22 2HG LYS 22 8.736 5.052 -2.162
152 2HD LYS 22 2HD LYS 22 6.559 4.188 -0.272
153 2HE LYS 22 2HE LYS 22 7.414 6.838 -0.168
154 1HZ LYS 22 1HZ LYS 22 5.943 8.058 -1.469
155 2HZ LYS 22 2HZ LYS 22 6.573 6.964 -2.506
156 3HZ LYS 22 3HZ LYS 22 5.066 6.755 -1.914
157 H LYS 23 H LYS 23 7.194 4.330 2.053
158 HA LYS 23 HA LYS 23 8.939 6.604 2.576
159 2HB LYS 23 2HB LYS 23 6.807 7.198 1.679
160 2HG LYS 23 2HG LYS 23 5.858 5.054 3.480
161 2HD LYS 23 2HD LYS 23 5.059 7.508 4.375
162 2HE LYS 23 2HE LYS 23 2.511 7.032 3.150
163 1HZ LYS 23 1HZ LYS 23 3.475 9.118 3.988
164 2HZ LYS 23 2HZ LYS 23 4.412 9.213 2.654
165 3HZ LYS 23 3HZ LYS 23 2.786 9.276 2.517
166 H TRP 24 H TRP 24 7.255 3.876 4.143
167 HA TRP 24 HA TRP 24 7.666 4.779 6.788
168 2HB TRP 24 2HB TRP 24 7.182 2.406 7.370
169 HD1 TRP 24 HD TRP 24 5.565 5.278 5.728
170 HE1 TRP 24 1HE TRP 24 2.929 5.210 5.812
171 HE3 TRP 24 3HE TRP 24 5.212 0.394 7.100
172 HZ2 TRP 24 2HZ TRP 24 1.034 3.167 6.429
173 HZ3 TRP 24 3HZ TRP 24 2.931 -0.558 7.423
174 HH2 TRP 24 HH TRP 24 0.887 0.744 7.110
175 H GLY 25 H GLY 25 9.290 2.164 4.831
176 1HA GLY 25 1HA GLY 25 11.523 1.723 4.655
177 2HA GLY 25 2HA GLY 25 11.885 2.997 5.800
178 H TRP 26 H TRP 26 13.417 1.055 6.438
179 HA TRP 26 HA TRP 26 13.956 -0.582 7.839
180 2HB TRP 26 2HB TRP 26 11.765 0.588 9.562
181 HD1 TRP 26 HD TRP 26 14.842 -1.738 9.510
182 HE1 TRP 26 1HE TRP 26 15.193 -2.911 11.848
183 HE3 TRP 26 3HE TRP 26 11.289 0.938 11.975
184 HZ2 TRP 26 2HZ TRP 26 13.971 -2.595 14.408
185 HZ3 TRP 26 3HZ TRP 26 10.932 0.443 14.392
186 HH2 TRP 26 HH TRP 26 12.204 -1.254 15.606