Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
6847 | 1jn7 RC | 5096 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1HT GLY 1 -13.782 -5.458 -9.330
2 2H GLY 1 2HT GLY 1 -14.463 -6.718 -8.431
3 3H GLY 1 3HT GLY 1 -13.436 -7.065 -9.729
4 1HA GLY 1 1HA GLY 1 -12.767 -6.040 -7.053
5 2HA GLY 1 2HA GLY 1 -12.056 -7.390 -7.924
6 H SER 2 H SER 2 -11.899 -5.765 -10.415
7 HA SER 2 HA SER 2 -10.256 -3.507 -9.938
8 1HB SER 2 2HB SER 2 -8.675 -5.262 -9.192
9 2HB SER 2 1HB SER 2 -8.798 -6.025 -10.777
10 HG SER 2 HG SER 2 -7.002 -4.717 -10.793
11 H ALA 3 H ALA 3 -8.696 -3.431 -12.169
12 HA ALA 3 HA ALA 3 -8.745 -2.970 -14.395
13 1HB ALA 3 1HB ALA 3 -8.946 -5.322 -14.739
14 2HB ALA 3 2HB ALA 3 -10.065 -4.524 -15.843
15 3HB ALA 3 3HB ALA 3 -10.670 -5.287 -14.373
16 H ALA 4 H ALA 4 -10.100 -1.158 -13.013
17 HA ALA 4 HA ALA 4 -11.921 -0.087 -14.873
18 1HB ALA 4 1HB ALA 4 -13.118 -1.472 -12.496
19 2HB ALA 4 2HB ALA 4 -13.572 -1.594 -14.195
20 3HB ALA 4 3HB ALA 4 -13.936 -0.126 -13.288
21 H GLU 5 H GLU 5 -11.933 -0.062 -11.310
22 HA GLU 5 HA GLU 5 -10.357 2.075 -10.743
23 1HB GLU 5 2HB GLU 5 -12.156 3.924 -10.520
24 2HB GLU 5 1HB GLU 5 -11.450 3.628 -12.102
25 1HG GLU 5 2HG GLU 5 -13.390 2.937 -12.982
26 2HG GLU 5 1HG GLU 5 -13.861 2.064 -11.525
27 H VAL 6 H VAL 6 -10.630 0.143 -9.190
28 HA VAL 6 HA VAL 6 -12.529 0.927 -7.075
29 HB VAL 6 HB VAL 6 -11.557 -1.884 -7.589
30 1HG1 VAL 6 1HG1 VAL 6 -13.631 -2.333 -6.117
31 2HG1 VAL 6 2HG1 VAL 6 -13.470 -0.641 -5.649
32 3HG1 VAL 6 3HG1 VAL 6 -12.149 -1.770 -5.345
33 1HG2 VAL 6 1HG2 VAL 6 -12.923 -1.620 -9.408
34 2HG2 VAL 6 2HG2 VAL 6 -13.923 -0.400 -8.618
35 3HG2 VAL 6 3HG2 VAL 6 -14.111 -2.102 -8.197
36 H MET 7 H MET 7 -11.838 0.406 -4.880
37 HA MET 7 HA MET 7 -10.357 0.455 -3.155
38 1HB MET 7 2HB MET 7 -9.465 -1.558 -4.739
39 2HB MET 7 1HB MET 7 -8.054 -0.508 -4.735
40 1HG MET 7 2HG MET 7 -7.517 -1.643 -2.887
41 2HG MET 7 1HG MET 7 -8.646 -0.538 -2.105
42 1HE MET 7 1HE MET 7 -9.677 -4.665 -3.699
43 2HE MET 7 2HE MET 7 -8.182 -4.613 -2.767
44 3HE MET 7 3HE MET 7 -8.367 -3.593 -4.193
45 H LYS 8 H LYS 8 -8.114 1.339 -2.521
46 HA LYS 8 HA LYS 8 -7.153 3.432 -4.299
47 1HB LYS 8 2HB LYS 8 -8.903 4.596 -3.127
48 2HB LYS 8 1HB LYS 8 -8.350 3.975 -1.578
49 1HG LYS 8 2HG LYS 8 -6.223 5.248 -1.927
50 2HG LYS 8 1HG LYS 8 -6.976 5.989 -3.340
51 1HD LYS 8 2HD LYS 8 -7.173 7.425 -1.370
52 2HD LYS 8 1HD LYS 8 -8.757 6.884 -1.926
53 1HE LYS 8 2HE LYS 8 -7.468 5.157 0.076
54 2HE LYS 8 1HE LYS 8 -7.912 6.766 0.646
55 1HZ LYS 8 1HZ LYS 8 -9.919 5.312 -0.890
56 2HZ LYS 8 2HZ LYS 8 -10.108 6.329 0.448
57 3HZ LYS 8 3HZ LYS 8 -9.590 4.734 0.666
58 H LYS 9 H LYS 9 -6.832 2.955 -0.796
59 HA LYS 9 HA LYS 9 -4.050 2.104 -1.188
60 1HB LYS 9 2HB LYS 9 -4.938 4.269 0.731
61 2HB LYS 9 1HB LYS 9 -3.311 3.621 0.603
62 1HG LYS 9 2HG LYS 9 -2.809 4.917 -1.134
63 2HG LYS 9 1HG LYS 9 -4.346 4.594 -1.937
64 1HD LYS 9 2HD LYS 9 -4.414 6.887 -1.490
65 2HD LYS 9 1HD LYS 9 -5.364 6.173 -0.186
66 1HE LYS 9 2HE LYS 9 -3.059 6.144 1.060
67 2HE LYS 9 1HE LYS 9 -2.643 7.396 -0.108
68 1HZ LYS 9 1HZ LYS 9 -3.505 8.647 1.574
69 2HZ LYS 9 2HZ LYS 9 -4.607 7.462 2.067
70 3HZ LYS 9 3HZ LYS 9 -4.916 8.380 0.680
71 H TYR 10 H TYR 10 -5.921 0.287 -0.668
72 HA TYR 10 HA TYR 10 -5.201 -0.640 1.975
73 1HB TYR 10 2HB TYR 10 -7.158 0.647 2.555
74 2HB TYR 10 1HB TYR 10 -8.077 -0.066 1.235
75 HD1 TYR 10 1HD TYR 10 -7.169 -0.334 4.681
76 HD2 TYR 10 2HD TYR 10 -8.558 -2.576 1.345
77 HE1 TYR 10 1HE TYR 10 -7.976 -2.085 6.205
78 HE2 TYR 10 2HE TYR 10 -9.371 -4.335 2.859
79 HH TYR 10 HH TYR 10 -10.059 -4.569 5.209
80 H CYS 11 H CYS 11 -5.019 -2.815 2.017
81 HA CYS 11 HA CYS 11 -5.816 -4.246 -0.412
82 1HB CYS 11 2HB CYS 11 -3.426 -4.318 0.583
83 2HB CYS 11 1HB CYS 11 -4.110 -5.422 1.765
84 H SER 12 H SER 12 -7.512 -5.531 -0.432
85 HA SER 12 HA SER 12 -8.960 -6.088 1.997
86 1HB SER 12 2HB SER 12 -10.033 -5.540 -0.238
87 2HB SER 12 1HB SER 12 -9.562 -7.156 -0.765
88 HG SER 12 HG SER 12 -11.735 -6.542 0.485
89 H THR 13 H THR 13 -6.666 -7.699 -0.009
90 HA THR 13 HA THR 13 -7.313 -10.355 0.882
91 HB THR 13 HB THR 13 -4.721 -9.546 -0.407
92 HG1 THR 13 1HG THR 13 -6.030 -8.690 -1.859
93 1HG2 THR 13 1HG2 THR 13 -6.118 -11.908 -1.370
94 2HG2 THR 13 2HG2 THR 13 -5.663 -12.002 0.332
95 3HG2 THR 13 3HG2 THR 13 -4.432 -11.695 -0.895
96 H CYS 14 H CYS 14 -4.843 -7.918 1.628
97 HA CYS 14 HA CYS 14 -3.806 -9.656 3.750
98 1HB CYS 14 2HB CYS 14 -2.692 -7.027 2.766
99 2HB CYS 14 1HB CYS 14 -1.900 -8.176 3.839
100 H ASP 15 H ASP 15 -6.158 -7.387 3.448
101 HA ASP 15 HA ASP 15 -7.242 -5.966 4.847
102 1HB ASP 15 2HB ASP 15 -6.032 -7.832 6.896
103 2HB ASP 15 1HB ASP 15 -7.333 -6.691 7.216
104 H ILE 16 H ILE 16 -4.772 -5.014 3.994
105 HA ILE 16 HA ILE 16 -3.730 -3.628 6.376
106 HB ILE 16 HB ILE 16 -2.312 -3.765 3.727
107 1HG1 ILE 16 2HG1 ILE 16 -2.752 -6.074 4.517
108 2HG1 ILE 16 1HG1 ILE 16 -1.040 -5.671 4.542
109 1HG2 ILE 16 1HG2 ILE 16 -1.574 -3.023 6.530
110 2HG2 ILE 16 2HG2 ILE 16 -1.341 -2.115 5.038
111 3HG2 ILE 16 3HG2 ILE 16 -0.340 -3.527 5.377
112 1HD1 ILE 16 1HD1 ILE 16 -2.825 -5.545 6.957
113 2HD1 ILE 16 2HD1 ILE 16 -1.067 -5.407 6.908
114 3HD1 ILE 16 3HD1 ILE 16 -1.843 -6.943 6.521
115 H SER 17 H SER 17 -3.015 -1.370 6.001
116 HA SER 17 HA SER 17 -4.638 -0.029 3.946
117 1HB SER 17 2HB SER 17 -4.500 1.817 5.997
118 2HB SER 17 1HB SER 17 -5.888 0.791 5.637
119 HG SER 17 HG SER 17 -3.812 0.309 7.506
120 H PHE 18 H PHE 18 -3.858 2.055 3.276
121 HA PHE 18 HA PHE 18 -1.074 2.649 3.937
122 1HB PHE 18 2HB PHE 18 -2.196 2.241 1.163
123 2HB PHE 18 1HB PHE 18 -0.657 3.027 1.478
124 HD1 PHE 18 1HD PHE 18 1.019 1.638 2.947
125 HD2 PHE 18 2HD PHE 18 -2.249 -0.017 0.781
126 HE1 PHE 18 1HE PHE 18 2.117 -0.564 2.978
127 HE2 PHE 18 2HE PHE 18 -1.157 -2.221 0.809
128 HZ PHE 18 HZ PHE 18 1.028 -2.498 1.909
129 H ASN 19 H ASN 19 -0.706 4.775 4.179
130 HA ASN 19 HA ASN 19 -2.930 6.599 3.724
131 1HB ASN 19 2HB ASN 19 -0.479 6.618 5.408
132 2HB ASN 19 1HB ASN 19 -1.099 8.178 4.877
133 1HD2 ASN 19 1HD2 ASN 19 -0.971 7.018 7.549
134 2HD2 ASN 19 2HD2 ASN 19 -2.593 7.010 8.144
135 H TYR 20 H TYR 20 -0.853 5.496 1.658
136 HA TYR 20 HA TYR 20 -0.731 7.953 0.151
137 1HB TYR 20 2HB TYR 20 1.740 6.567 1.163
138 2HB TYR 20 1HB TYR 20 1.770 7.524 -0.313
139 HD1 TYR 20 1HD TYR 20 1.269 9.966 -0.206
140 HD2 TYR 20 2HD TYR 20 1.730 7.604 3.302
141 HE1 TYR 20 1HE TYR 20 1.596 12.010 1.121
142 HE2 TYR 20 2HE TYR 20 2.057 9.641 4.638
143 HH TYR 20 HH TYR 20 1.442 12.078 4.463
144 H VAL 21 H VAL 21 -1.265 7.479 -1.871
145 HA VAL 21 HA VAL 21 -1.829 4.975 -2.849
146 HB VAL 21 HB VAL 21 -0.866 7.278 -4.549
147 1HG1 VAL 21 1HG1 VAL 21 -2.207 6.304 -6.294
148 2HG1 VAL 21 2HG1 VAL 21 -2.794 5.053 -5.199
149 3HG1 VAL 21 3HG1 VAL 21 -1.097 5.080 -5.678
150 1HG2 VAL 21 1HG2 VAL 21 -3.532 6.739 -3.273
151 2HG2 VAL 21 2HG2 VAL 21 -3.367 7.753 -4.707
152 3HG2 VAL 21 3HG2 VAL 21 -2.556 8.206 -3.207
153 H LYS 22 H LYS 22 1.251 6.594 -2.698
154 HA LYS 22 HA LYS 22 2.646 4.987 -4.557
155 1HB LYS 22 2HB LYS 22 4.665 5.882 -3.574
156 2HB LYS 22 1HB LYS 22 3.473 7.168 -3.707
157 1HG LYS 22 2HG LYS 22 2.988 6.238 -1.197
158 2HG LYS 22 1HG LYS 22 4.731 6.000 -1.338
159 1HD LYS 22 2HD LYS 22 4.689 8.438 -2.281
160 2HD LYS 22 1HD LYS 22 3.144 8.529 -1.433
161 1HE LYS 22 2HE LYS 22 4.991 9.339 -0.042
162 2HE LYS 22 1HE LYS 22 4.229 7.907 0.652
163 1HZ LYS 22 1HZ LYS 22 6.061 6.648 0.301
164 2HZ LYS 22 2HZ LYS 22 6.836 8.145 0.430
165 3HZ LYS 22 3HZ LYS 22 6.528 7.481 -1.095
166 H THR 23 H THR 23 1.867 4.605 -1.164
167 HA THR 23 HA THR 23 3.615 2.386 -0.744
168 HB THR 23 HB THR 23 1.218 2.662 0.973
169 HG1 THR 23 1HG THR 23 1.932 4.567 1.888
170 1HG2 THR 23 1HG2 THR 23 4.168 2.472 1.515
171 2HG2 THR 23 2HG2 THR 23 2.948 1.218 1.739
172 3HG2 THR 23 3HG2 THR 23 2.936 2.652 2.765
173 H TYR 24 H TYR 24 0.216 2.772 -1.577
174 HA TYR 24 HA TYR 24 -0.495 0.048 -1.397
175 1HB TYR 24 2HB TYR 24 -2.121 1.937 -1.537
176 2HB TYR 24 1HB TYR 24 -1.677 2.149 -3.225
177 HD1 TYR 24 1HD TYR 24 -3.243 1.336 -4.699
178 HD2 TYR 24 2HD TYR 24 -2.617 -0.744 -1.042
179 HE1 TYR 24 1HE TYR 24 -4.939 -0.318 -5.357
180 HE2 TYR 24 2HE TYR 24 -4.310 -2.405 -1.689
181 HH TYR 24 HH TYR 24 -5.579 -2.597 -4.860
182 H LEU 25 H LEU 25 1.092 1.958 -3.826
183 HA LEU 25 HA LEU 25 0.867 0.004 -5.920
184 1HB LEU 25 2HB LEU 25 2.477 2.516 -5.553
185 2HB LEU 25 1HB LEU 25 2.763 1.451 -6.915
186 HG LEU 25 HG LEU 25 -0.026 2.377 -6.436
187 1HD1 LEU 25 1HD1 LEU 25 1.802 4.297 -6.320
188 2HD1 LEU 25 2HD1 LEU 25 0.263 4.513 -7.154
189 3HD1 LEU 25 3HD1 LEU 25 1.718 4.127 -8.073
190 1HD2 LEU 25 1HD2 LEU 25 -0.049 1.059 -8.277
191 2HD2 LEU 25 2HD2 LEU 25 1.644 1.371 -8.658
192 3HD2 LEU 25 3HD2 LEU 25 0.413 2.566 -9.068
193 H ALA 26 H ALA 26 3.323 0.994 -3.593
194 HA ALA 26 HA ALA 26 5.358 -0.732 -4.472
195 1HB ALA 26 1HB ALA 26 5.090 0.097 -1.611
196 2HB ALA 26 2HB ALA 26 5.467 1.287 -2.857
197 3HB ALA 26 3HB ALA 26 6.546 -0.083 -2.590
198 H HIS 27 H HIS 27 2.589 -1.199 -2.378
199 HA HIS 27 HA HIS 27 3.497 -3.653 -1.238
200 1HB HIS 27 2HB HIS 27 1.823 -2.402 -0.052
201 2HB HIS 27 1HB HIS 27 0.744 -2.421 -1.444
202 HD1 HIS 27 1HD HIS 27 2.213 -4.829 1.111
203 HD2 HIS 27 2HD HIS 27 -0.958 -4.521 -1.554
204 HE1 HIS 27 1HE HIS 27 0.751 -6.854 1.507
205 H LYS 28 H LYS 28 1.458 -2.812 -4.001
206 HA LYS 28 HA LYS 28 0.768 -5.511 -4.622
207 1HB LYS 28 2HB LYS 28 -0.282 -3.162 -5.354
208 2HB LYS 28 1HB LYS 28 0.749 -3.436 -6.752
209 1HG LYS 28 2HG LYS 28 -0.388 -5.399 -7.345
210 2HG LYS 28 1HG LYS 28 -1.173 -5.517 -5.769
211 1HD LYS 28 2HD LYS 28 -2.652 -3.772 -6.244
212 2HD LYS 28 1HD LYS 28 -1.656 -3.169 -7.571
213 1HE LYS 28 2HE LYS 28 -2.672 -5.928 -7.844
214 2HE LYS 28 1HE LYS 28 -3.877 -4.644 -7.925
215 1HZ LYS 28 1HZ LYS 28 -2.677 -3.625 -9.716
216 2HZ LYS 28 2HZ LYS 28 -2.950 -5.248 -10.107
217 3HZ LYS 28 3HZ LYS 28 -1.420 -4.751 -9.589
218 H GLN 29 H GLN 29 3.335 -3.324 -5.581
219 HA GLN 29 HA GLN 29 4.326 -5.127 -7.617
220 1HB GLN 29 2HB GLN 29 4.453 -2.454 -7.394
221 2HB GLN 29 1HB GLN 29 5.999 -2.871 -6.665
222 1HG GLN 29 2HG GLN 29 6.679 -2.696 -8.810
223 2HG GLN 29 1HG GLN 29 6.172 -4.384 -8.841
224 1HE2 GLN 29 1HE2 GLN 29 5.925 -1.459 -10.363
225 2HE2 GLN 29 2HE2 GLN 29 4.500 -1.746 -11.296
226 H PHE 30 H PHE 30 4.846 -4.569 -4.250
227 HA PHE 30 HA PHE 30 7.351 -6.100 -4.326
228 1HB PHE 30 2HB PHE 30 7.150 -3.835 -3.115
229 2HB PHE 30 1HB PHE 30 6.244 -4.720 -1.893
230 HD1 PHE 30 1HD PHE 30 9.405 -3.586 -2.802
231 HD2 PHE 30 2HD PHE 30 7.446 -6.950 -1.082
232 HE1 PHE 30 1HE PHE 30 11.517 -4.268 -1.739
233 HE2 PHE 30 2HE PHE 30 9.553 -7.638 -0.016
234 HZ PHE 30 HZ PHE 30 11.592 -6.297 -0.343
235 H TYR 31 H TYR 31 4.296 -5.937 -2.491
236 HA TYR 31 HA TYR 31 4.748 -8.457 -1.216
237 1HB TYR 31 2HB TYR 31 3.275 -6.441 -0.447
238 2HB TYR 31 1HB TYR 31 2.036 -7.196 -1.444
239 HD1 TYR 31 1HD TYR 31 3.940 -7.398 1.648
240 HD2 TYR 31 2HD TYR 31 1.157 -9.422 -0.852
241 HE1 TYR 31 1HE TYR 31 3.379 -8.908 3.506
242 HE2 TYR 31 2HE TYR 31 0.586 -10.937 0.999
243 HH TYR 31 HH TYR 31 0.684 -10.852 3.545
244 H HIS 32 H HIS 32 2.471 -7.372 -3.735
245 HA HIS 32 HA HIS 32 1.915 -10.169 -4.389
246 1HB HIS 32 2HB HIS 32 0.587 -7.632 -5.366
247 2HB HIS 32 1HB HIS 32 0.074 -9.270 -5.757
248 HD1 HIS 32 1HD HIS 32 -1.443 -10.432 -4.073
249 HD2 HIS 32 2HD HIS 32 0.203 -6.900 -2.632
250 HE1 HIS 32 1HE HIS 32 -2.612 -9.942 -1.881
251 H LYS 33 H LYS 33 4.480 -9.219 -5.039
252 HA LYS 33 HA LYS 33 4.710 -10.035 -7.706
253 1HB LYS 33 2HB LYS 33 4.277 -7.161 -7.297
254 2HB LYS 33 1HB LYS 33 5.705 -7.534 -8.252
255 1HG LYS 33 2HG LYS 33 3.356 -9.060 -9.055
256 2HG LYS 33 1HG LYS 33 3.145 -7.316 -9.202
257 1HD LYS 33 2HD LYS 33 4.176 -7.542 -11.179
258 2HD LYS 33 1HD LYS 33 5.656 -7.687 -10.231
259 1HE LYS 33 2HE LYS 33 3.917 -9.995 -11.094
260 2HE LYS 33 1HE LYS 33 5.397 -9.487 -11.906
261 1HZ LYS 33 1HZ LYS 33 6.326 -10.996 -10.552
262 2HZ LYS 33 2HZ LYS 33 5.054 -10.964 -9.438
263 3HZ LYS 33 3HZ LYS 33 6.249 -9.768 -9.390
264 H ASN 34 H ASN 34 6.185 -11.222 -6.239
265 HA ASN 34 HA ASN 34 8.655 -9.757 -5.636
266 1HB ASN 34 2HB ASN 34 9.241 -11.714 -4.243
267 2HB ASN 34 1HB ASN 34 7.709 -10.990 -3.760
268 1HD2 ASN 34 1HD2 ASN 34 8.596 -13.637 -3.199
269 2HD2 ASN 34 2HD2 ASN 34 7.482 -14.723 -3.948
270 H LYS 35 H LYS 35 7.930 -10.525 -8.339
271 HA LYS 35 HA LYS 35 10.392 -11.537 -9.218
272 1HB LYS 35 2HB LYS 35 8.942 -13.592 -8.238
273 2HB LYS 35 1HB LYS 35 8.357 -13.579 -9.897
274 1HG LYS 35 2HG LYS 35 10.165 -15.105 -9.796
275 2HG LYS 35 1HG LYS 35 10.743 -13.670 -10.646
276 1HD LYS 35 2HD LYS 35 12.465 -14.248 -9.143
277 2HD LYS 35 1HD LYS 35 11.633 -12.879 -8.401
278 1HE LYS 35 2HE LYS 35 11.792 -14.292 -6.604
279 2HE LYS 35 1HE LYS 35 10.224 -14.773 -7.251
280 1HZ LYS 35 1HZ LYS 35 12.093 -16.520 -6.676
281 2HZ LYS 35 2HZ LYS 35 12.580 -16.175 -8.259
282 3HZ LYS 35 3HZ LYS 35 11.020 -16.757 -7.963
283 HA PRO 36 HA PRO 36 7.374 -9.551 -12.268
284 1HB PRO 36 2HB PRO 36 8.683 -7.195 -12.567
285 2HB PRO 36 1HB PRO 36 7.451 -7.455 -11.326
286 1HG PRO 36 2HG PRO 36 10.434 -7.538 -11.081
287 2HG PRO 36 1HG PRO 36 9.243 -6.800 -9.994
288 1HD PRO 36 2HD PRO 36 10.376 -9.209 -9.497
289 2HD PRO 36 1HD PRO 36 8.719 -8.811 -8.998
Start of MODEL 2
1 1H GLY 1 1HT GLY 1 -23.098 -1.365 2.352
2 2H GLY 1 2HT GLY 1 -23.407 -0.806 0.785
3 3H GLY 1 3HT GLY 1 -24.163 -0.072 2.109
4 1HA GLY 1 1HA GLY 1 -22.484 1.418 1.587
5 2HA GLY 1 2HA GLY 1 -21.836 0.485 2.926
6 H SER 2 H SER 2 -21.476 -1.891 1.169
7 HA SER 2 HA SER 2 -19.336 -0.957 -0.602
8 1HB SER 2 2HB SER 2 -19.030 -2.643 1.825
9 2HB SER 2 1HB SER 2 -18.114 -3.133 0.400
10 HG SER 2 HG SER 2 -18.004 -0.681 1.802
11 H ALA 3 H ALA 3 -19.739 -1.762 -2.543
12 HA ALA 3 HA ALA 3 -21.196 -4.296 -2.772
13 1HB ALA 3 1HB ALA 3 -20.959 -1.876 -4.454
14 2HB ALA 3 2HB ALA 3 -22.354 -2.909 -4.138
15 3HB ALA 3 3HB ALA 3 -21.126 -3.416 -5.298
16 H ALA 4 H ALA 4 -18.350 -4.162 -2.093
17 HA ALA 4 HA ALA 4 -16.398 -5.212 -2.608
18 1HB ALA 4 1HB ALA 4 -17.733 -6.773 -4.769
19 2HB ALA 4 2HB ALA 4 -18.233 -7.016 -3.094
20 3HB ALA 4 3HB ALA 4 -16.555 -7.294 -3.564
21 H GLU 5 H GLU 5 -15.114 -3.665 -3.470
22 HA GLU 5 HA GLU 5 -14.098 -3.787 -5.983
23 1HB GLU 5 2HB GLU 5 -15.185 -1.678 -7.020
24 2HB GLU 5 1HB GLU 5 -16.047 -3.206 -7.128
25 1HG GLU 5 2HG GLU 5 -17.748 -2.478 -5.876
26 2HG GLU 5 1HG GLU 5 -16.686 -1.644 -4.742
27 H VAL 6 H VAL 6 -12.685 -3.367 -3.972
28 HA VAL 6 HA VAL 6 -12.386 -0.544 -3.331
29 HB VAL 6 HB VAL 6 -12.207 -2.206 -1.525
30 1HG1 VAL 6 1HG1 VAL 6 -9.524 -3.106 -2.308
31 2HG1 VAL 6 2HG1 VAL 6 -10.840 -3.740 -3.296
32 3HG1 VAL 6 3HG1 VAL 6 -10.847 -3.994 -1.551
33 1HG2 VAL 6 1HG2 VAL 6 -9.735 -0.604 -2.147
34 2HG2 VAL 6 2HG2 VAL 6 -10.010 -1.405 -0.600
35 3HG2 VAL 6 3HG2 VAL 6 -11.106 -0.135 -1.143
36 H MET 7 H MET 7 -10.555 0.682 -3.774
37 HA MET 7 HA MET 7 -8.224 -0.301 -5.016
38 1HB MET 7 2HB MET 7 -10.007 -0.541 -6.853
39 2HB MET 7 1HB MET 7 -9.970 1.215 -6.941
40 1HG MET 7 2HG MET 7 -7.409 -0.286 -7.125
41 2HG MET 7 1HG MET 7 -8.488 -0.257 -8.518
42 1HE MET 7 1HE MET 7 -5.267 1.765 -7.479
43 2HE MET 7 2HE MET 7 -6.314 1.376 -6.114
44 3HE MET 7 3HE MET 7 -6.095 3.055 -6.607
45 H LYS 8 H LYS 8 -7.547 1.098 -3.267
46 HA LYS 8 HA LYS 8 -7.058 3.790 -4.216
47 1HB LYS 8 2HB LYS 8 -9.110 4.182 -3.046
48 2HB LYS 8 1HB LYS 8 -8.578 3.229 -1.668
49 1HG LYS 8 2HG LYS 8 -6.836 4.912 -1.212
50 2HG LYS 8 1HG LYS 8 -7.457 5.882 -2.550
51 1HD LYS 8 2HD LYS 8 -9.355 5.009 -0.430
52 2HD LYS 8 1HD LYS 8 -8.225 6.314 -0.060
53 1HE LYS 8 2HE LYS 8 -9.018 7.457 -2.149
54 2HE LYS 8 1HE LYS 8 -10.271 6.223 -2.270
55 1HZ LYS 8 1HZ LYS 8 -11.195 8.108 -1.188
56 2HZ LYS 8 2HZ LYS 8 -9.911 8.204 -0.091
57 3HZ LYS 8 3HZ LYS 8 -10.998 6.911 -0.009
58 H LYS 9 H LYS 9 -6.872 2.652 -0.875
59 HA LYS 9 HA LYS 9 -4.009 2.163 -1.124
60 1HB LYS 9 2HB LYS 9 -5.206 4.316 0.622
61 2HB LYS 9 1HB LYS 9 -3.603 3.652 0.890
62 1HG LYS 9 2HG LYS 9 -2.792 5.145 -0.520
63 2HG LYS 9 1HG LYS 9 -3.690 4.361 -1.819
64 1HD LYS 9 2HD LYS 9 -5.029 6.129 -2.007
65 2HD LYS 9 1HD LYS 9 -5.471 6.015 -0.304
66 1HE LYS 9 2HE LYS 9 -2.832 7.107 -0.545
67 2HE LYS 9 1HE LYS 9 -3.944 8.014 -1.568
68 1HZ LYS 9 1HZ LYS 9 -4.036 7.617 1.354
69 2HZ LYS 9 2HZ LYS 9 -5.430 8.044 0.496
70 3HZ LYS 9 3HZ LYS 9 -4.080 9.063 0.477
71 H TYR 10 H TYR 10 -5.937 0.280 -0.692
72 HA TYR 10 HA TYR 10 -5.182 -0.712 1.921
73 1HB TYR 10 2HB TYR 10 -7.307 0.665 2.220
74 2HB TYR 10 1HB TYR 10 -8.121 -0.559 1.251
75 HD1 TYR 10 1HD TYR 10 -7.281 0.420 4.519
76 HD2 TYR 10 2HD TYR 10 -7.783 -3.038 2.092
77 HE1 TYR 10 1HE TYR 10 -7.622 -0.939 6.538
78 HE2 TYR 10 2HE TYR 10 -8.127 -4.408 4.105
79 HH TYR 10 HH TYR 10 -7.237 -3.737 6.961
80 H CYS 11 H CYS 11 -4.973 -2.890 1.911
81 HA CYS 11 HA CYS 11 -5.566 -4.244 -0.595
82 1HB CYS 11 2HB CYS 11 -3.334 -4.442 0.599
83 2HB CYS 11 1HB CYS 11 -4.162 -5.433 1.794
84 H SER 12 H SER 12 -7.220 -5.535 -0.908
85 HA SER 12 HA SER 12 -9.019 -6.154 1.280
86 1HB SER 12 2HB SER 12 -9.504 -5.450 -1.284
87 2HB SER 12 1HB SER 12 -9.588 -7.206 -1.430
88 HG SER 12 HG SER 12 -11.054 -7.054 0.459
89 H THR 13 H THR 13 -6.320 -7.510 0.843
90 HA THR 13 HA THR 13 -7.327 -10.244 1.096
91 HB THR 13 HB THR 13 -4.851 -9.440 -0.438
92 HG1 THR 13 1HG THR 13 -6.841 -9.033 -1.535
93 1HG2 THR 13 1HG2 THR 13 -4.310 -11.602 -0.748
94 2HG2 THR 13 2HG2 THR 13 -5.986 -12.146 -0.691
95 3HG2 THR 13 3HG2 THR 13 -5.124 -11.786 0.804
96 H CYS 14 H CYS 14 -4.834 -7.879 1.828
97 HA CYS 14 HA CYS 14 -3.750 -9.669 3.890
98 1HB CYS 14 2HB CYS 14 -2.628 -7.057 2.862
99 2HB CYS 14 1HB CYS 14 -1.838 -8.160 3.982
100 H ASP 15 H ASP 15 -6.103 -7.416 3.675
101 HA ASP 15 HA ASP 15 -7.169 -6.028 5.118
102 1HB ASP 15 2HB ASP 15 -5.807 -7.839 7.119
103 2HB ASP 15 1HB ASP 15 -7.112 -6.722 7.500
104 H ILE 16 H ILE 16 -4.793 -4.998 4.128
105 HA ILE 16 HA ILE 16 -3.728 -3.508 6.439
106 HB ILE 16 HB ILE 16 -2.281 -3.779 3.818
107 1HG1 ILE 16 2HG1 ILE 16 -2.707 -6.049 4.696
108 2HG1 ILE 16 1HG1 ILE 16 -1.000 -5.630 4.754
109 1HG2 ILE 16 1HG2 ILE 16 -0.323 -3.419 5.422
110 2HG2 ILE 16 2HG2 ILE 16 -1.545 -2.948 6.604
111 3HG2 ILE 16 3HG2 ILE 16 -1.379 -2.044 5.099
112 1HD1 ILE 16 1HD1 ILE 16 -1.937 -6.826 6.763
113 2HD1 ILE 16 2HD1 ILE 16 -2.815 -5.339 7.124
114 3HD1 ILE 16 3HD1 ILE 16 -1.051 -5.336 7.087
115 H SER 17 H SER 17 -3.041 -1.278 5.950
116 HA SER 17 HA SER 17 -4.576 -0.064 3.757
117 1HB SER 17 2HB SER 17 -5.700 0.152 6.047
118 2HB SER 17 1HB SER 17 -4.361 1.214 6.485
119 HG SER 17 HG SER 17 -5.186 2.741 5.291
120 H PHE 18 H PHE 18 -3.841 2.181 3.267
121 HA PHE 18 HA PHE 18 -1.071 2.712 4.009
122 1HB PHE 18 2HB PHE 18 -2.115 2.456 1.185
123 2HB PHE 18 1HB PHE 18 -0.564 3.174 1.594
124 HD1 PHE 18 1HD PHE 18 1.091 1.701 2.907
125 HD2 PHE 18 2HD PHE 18 -2.299 0.181 0.832
126 HE1 PHE 18 1HE PHE 18 2.120 -0.534 2.870
127 HE2 PHE 18 2HE PHE 18 -1.277 -2.056 0.792
128 HZ PHE 18 HZ PHE 18 0.934 -2.417 1.813
129 H ASN 19 H ASN 19 -0.590 4.840 4.169
130 HA ASN 19 HA ASN 19 -2.805 6.711 3.869
131 1HB ASN 19 2HB ASN 19 -0.987 6.434 5.856
132 2HB ASN 19 1HB ASN 19 -0.201 7.680 4.892
133 1HD2 ASN 19 1HD2 ASN 19 -2.942 6.872 6.855
134 2HD2 ASN 19 2HD2 ASN 19 -3.539 8.481 7.046
135 H TYR 20 H TYR 20 -0.805 5.571 1.718
136 HA TYR 20 HA TYR 20 -0.752 8.010 0.175
137 1HB TYR 20 2HB TYR 20 1.744 6.698 1.193
138 2HB TYR 20 1HB TYR 20 1.755 7.492 -0.377
139 HD1 TYR 20 1HD TYR 20 1.461 9.917 -0.547
140 HD2 TYR 20 2HD TYR 20 1.590 7.974 3.236
141 HE1 TYR 20 1HE TYR 20 1.826 12.088 0.550
142 HE2 TYR 20 2HE TYR 20 1.956 10.139 4.343
143 HH TYR 20 HH TYR 20 2.841 12.918 2.697
144 H VAL 21 H VAL 21 -1.260 7.537 -1.862
145 HA VAL 21 HA VAL 21 -1.893 5.012 -2.774
146 HB VAL 21 HB VAL 21 -0.937 7.252 -4.557
147 1HG1 VAL 21 1HG1 VAL 21 -1.245 5.443 -5.949
148 2HG1 VAL 21 2HG1 VAL 21 -2.849 6.175 -5.976
149 3HG1 VAL 21 3HG1 VAL 21 -2.540 4.766 -4.961
150 1HG2 VAL 21 1HG2 VAL 21 -3.437 7.794 -4.630
151 2HG2 VAL 21 2HG2 VAL 21 -2.536 8.291 -3.197
152 3HG2 VAL 21 3HG2 VAL 21 -3.555 6.852 -3.144
153 H LYS 22 H LYS 22 1.197 6.622 -2.741
154 HA LYS 22 HA LYS 22 2.541 4.966 -4.592
155 1HB LYS 22 2HB LYS 22 3.368 6.855 -2.437
156 2HB LYS 22 1HB LYS 22 4.575 5.744 -3.071
157 1HG LYS 22 2HG LYS 22 2.940 7.592 -4.792
158 2HG LYS 22 1HG LYS 22 4.538 7.988 -4.157
159 1HD LYS 22 2HD LYS 22 5.350 5.855 -5.266
160 2HD LYS 22 1HD LYS 22 3.792 5.809 -6.094
161 1HE LYS 22 2HE LYS 22 5.674 8.161 -6.188
162 2HE LYS 22 1HE LYS 22 5.657 6.873 -7.392
163 1HZ LYS 22 1HZ LYS 22 4.279 9.044 -7.742
164 2HZ LYS 22 2HZ LYS 22 3.144 8.254 -6.769
165 3HZ LYS 22 3HZ LYS 22 3.652 7.546 -8.219
166 H THR 23 H THR 23 1.918 4.708 -1.144
167 HA THR 23 HA THR 23 3.652 2.490 -0.719
168 HB THR 23 HB THR 23 1.296 2.812 1.047
169 HG1 THR 23 1HG THR 23 1.875 4.764 1.799
170 1HG2 THR 23 1HG2 THR 23 3.103 1.377 1.747
171 2HG2 THR 23 2HG2 THR 23 2.997 2.781 2.808
172 3HG2 THR 23 3HG2 THR 23 4.254 2.701 1.574
173 H TYR 24 H TYR 24 0.228 2.838 -1.469
174 HA TYR 24 HA TYR 24 -0.446 0.106 -1.205
175 1HB TYR 24 2HB TYR 24 -2.080 2.012 -1.314
176 2HB TYR 24 1HB TYR 24 -1.742 2.134 -3.035
177 HD1 TYR 24 1HD TYR 24 -3.667 1.458 -4.142
178 HD2 TYR 24 2HD TYR 24 -2.252 -0.860 -0.867
179 HE1 TYR 24 1HE TYR 24 -5.392 -0.234 -4.602
180 HE2 TYR 24 2HE TYR 24 -3.973 -2.559 -1.318
181 HH TYR 24 HH TYR 24 -5.702 -2.713 -4.163
182 H LEU 25 H LEU 25 1.040 1.984 -3.717
183 HA LEU 25 HA LEU 25 0.719 0.011 -5.781
184 1HB LEU 25 2HB LEU 25 2.419 2.484 -5.518
185 2HB LEU 25 1HB LEU 25 2.534 1.421 -6.907
186 HG LEU 25 HG LEU 25 0.088 2.961 -6.038
187 1HD1 LEU 25 1HD1 LEU 25 0.487 3.939 -8.392
188 2HD1 LEU 25 2HD1 LEU 25 2.129 3.328 -8.194
189 3HD1 LEU 25 3HD1 LEU 25 1.483 4.508 -7.054
190 1HD2 LEU 25 1HD2 LEU 25 0.509 0.831 -8.087
191 2HD2 LEU 25 2HD2 LEU 25 -0.661 2.118 -8.385
192 3HD2 LEU 25 3HD2 LEU 25 -0.840 1.071 -6.977
193 H ALA 26 H ALA 26 3.265 0.992 -3.550
194 HA ALA 26 HA ALA 26 5.265 -0.734 -4.494
195 1HB ALA 26 1HB ALA 26 5.224 1.267 -2.703
196 2HB ALA 26 2HB ALA 26 6.529 0.085 -2.813
197 3HB ALA 26 3HB ALA 26 5.254 -0.119 -1.612
198 H HIS 27 H HIS 27 2.556 -1.222 -2.325
199 HA HIS 27 HA HIS 27 3.492 -3.670 -1.211
200 1HB HIS 27 2HB HIS 27 1.805 -2.424 -0.026
201 2HB HIS 27 1HB HIS 27 0.715 -2.492 -1.407
202 HD1 HIS 27 1HD HIS 27 2.267 -4.824 1.169
203 HD2 HIS 27 2HD HIS 27 -0.940 -4.628 -1.462
204 HE1 HIS 27 1HE HIS 27 0.851 -6.872 1.618
205 H LYS 28 H LYS 28 1.408 -2.870 -3.957
206 HA LYS 28 HA LYS 28 0.793 -5.597 -4.566
207 1HB LYS 28 2HB LYS 28 -0.408 -3.325 -5.237
208 2HB LYS 28 1HB LYS 28 0.629 -3.468 -6.650
209 1HG LYS 28 2HG LYS 28 -1.131 -4.614 -7.457
210 2HG LYS 28 1HG LYS 28 -0.370 -5.951 -6.592
211 1HD LYS 28 2HD LYS 28 -1.821 -5.612 -4.697
212 2HD LYS 28 1HD LYS 28 -2.509 -4.165 -5.437
213 1HE LYS 28 2HE LYS 28 -2.825 -7.030 -6.289
214 2HE LYS 28 1HE LYS 28 -4.079 -5.890 -5.801
215 1HZ LYS 28 1HZ LYS 28 -2.484 -5.843 -8.302
216 2HZ LYS 28 2HZ LYS 28 -3.488 -4.573 -7.813
217 3HZ LYS 28 3HZ LYS 28 -4.151 -6.092 -8.150
218 H GLN 29 H GLN 29 3.236 -3.295 -5.584
219 HA GLN 29 HA GLN 29 4.243 -5.044 -7.659
220 1HB GLN 29 2HB GLN 29 4.277 -2.353 -7.370
221 2HB GLN 29 1HB GLN 29 5.882 -2.751 -6.774
222 1HG GLN 29 2HG GLN 29 6.250 -2.379 -9.016
223 2HG GLN 29 1HG GLN 29 6.097 -4.133 -8.939
224 1HE2 GLN 29 1HE2 GLN 29 5.753 -3.383 -11.328
225 2HE2 GLN 29 2HE2 GLN 29 4.099 -3.234 -11.800
226 H PHE 30 H PHE 30 4.701 -4.713 -4.303
227 HA PHE 30 HA PHE 30 7.301 -6.088 -4.475
228 1HB PHE 30 2HB PHE 30 7.117 -3.817 -3.273
229 2HB PHE 30 1HB PHE 30 6.274 -4.706 -2.008
230 HD1 PHE 30 1HD PHE 30 9.395 -4.978 -4.039
231 HD2 PHE 30 2HD PHE 30 7.525 -5.465 -0.247
232 HE1 PHE 30 1HE PHE 30 11.558 -5.623 -3.059
233 HE2 PHE 30 2HE PHE 30 9.684 -6.111 0.740
234 HZ PHE 30 HZ PHE 30 11.705 -6.191 -0.667
235 H TYR 31 H TYR 31 4.313 -5.960 -2.530
236 HA TYR 31 HA TYR 31 4.857 -8.457 -1.243
237 1HB TYR 31 2HB TYR 31 3.292 -6.389 -0.577
238 2HB TYR 31 1HB TYR 31 2.078 -7.404 -1.347
239 HD1 TYR 31 1HD TYR 31 4.610 -7.332 1.359
240 HD2 TYR 31 2HD TYR 31 1.170 -9.270 -0.226
241 HE1 TYR 31 1HE TYR 31 4.401 -8.641 3.430
242 HE2 TYR 31 2HE TYR 31 0.950 -10.583 1.841
243 HH TYR 31 HH TYR 31 1.993 -9.948 4.545
244 H HIS 32 H HIS 32 2.464 -7.444 -3.683
245 HA HIS 32 HA HIS 32 1.924 -10.253 -4.284
246 1HB HIS 32 2HB HIS 32 0.556 -7.737 -5.258
247 2HB HIS 32 1HB HIS 32 0.047 -9.379 -5.632
248 HD1 HIS 32 1HD HIS 32 -1.445 -10.534 -3.920
249 HD2 HIS 32 2HD HIS 32 0.242 -7.008 -2.511
250 HE1 HIS 32 1HE HIS 32 -2.572 -10.038 -1.706
251 H LYS 33 H LYS 33 4.459 -9.422 -5.023
252 HA LYS 33 HA LYS 33 4.519 -10.152 -7.749
253 1HB LYS 33 2HB LYS 33 3.904 -7.521 -7.517
254 2HB LYS 33 1HB LYS 33 5.659 -7.432 -7.548
255 1HG LYS 33 2HG LYS 33 3.892 -8.696 -9.633
256 2HG LYS 33 1HG LYS 33 4.773 -7.173 -9.776
257 1HD LYS 33 2HD LYS 33 6.167 -9.777 -9.224
258 2HD LYS 33 1HD LYS 33 5.813 -9.235 -10.865
259 1HE LYS 33 2HE LYS 33 7.239 -7.407 -10.702
260 2HE LYS 33 1HE LYS 33 7.225 -7.431 -8.939
261 1HZ LYS 33 1HZ LYS 33 8.829 -8.997 -8.856
262 2HZ LYS 33 2HZ LYS 33 9.235 -8.370 -10.374
263 3HZ LYS 33 3HZ LYS 33 8.314 -9.784 -10.263
264 H ASN 34 H ASN 34 5.739 -11.147 -5.502
265 HA ASN 34 HA ASN 34 8.434 -11.297 -6.308
266 1HB ASN 34 2HB ASN 34 8.459 -9.022 -5.256
267 2HB ASN 34 1HB ASN 34 8.020 -9.777 -3.727
268 1HD2 ASN 34 1HD2 ASN 34 10.021 -8.775 -3.002
269 2HD2 ASN 34 2HD2 ASN 34 11.512 -9.612 -3.249
270 H LYS 35 H LYS 35 6.301 -13.059 -5.648
271 HA LYS 35 HA LYS 35 5.912 -15.017 -4.559
272 1HB LYS 35 2HB LYS 35 8.531 -15.042 -5.080
273 2HB LYS 35 1HB LYS 35 8.618 -15.038 -3.324
274 1HG LYS 35 2HG LYS 35 8.692 -17.297 -4.027
275 2HG LYS 35 1HG LYS 35 7.094 -17.025 -3.333
276 1HD LYS 35 2HD LYS 35 6.145 -16.784 -5.560
277 2HD LYS 35 1HD LYS 35 7.745 -16.981 -6.279
278 1HE LYS 35 2HE LYS 35 7.089 -19.133 -6.462
279 2HE LYS 35 1HE LYS 35 7.636 -19.213 -4.788
280 1HZ LYS 35 1HZ LYS 35 4.860 -18.926 -5.779
281 2HZ LYS 35 2HZ LYS 35 5.283 -18.643 -4.166
282 3HZ LYS 35 3HZ LYS 35 5.507 -20.177 -4.842
283 HA PRO 36 HA PRO 36 5.136 -12.810 -0.583
284 1HB PRO 36 2HB PRO 36 2.544 -13.586 -0.379
285 2HB PRO 36 1HB PRO 36 3.052 -12.177 -1.318
286 1HG PRO 36 2HG PRO 36 2.402 -14.945 -2.257
287 2HG PRO 36 1HG PRO 36 1.941 -13.386 -2.966
288 1HD PRO 36 2HD PRO 36 3.985 -14.877 -3.931
289 2HD PRO 36 1HD PRO 36 3.987 -13.103 -3.989
Start of MODEL 3
1 1H GLY 1 1HT GLY 1 -13.850 5.367 -14.690
2 2H GLY 1 2HT GLY 1 -15.056 4.699 -15.669
3 3H GLY 1 3HT GLY 1 -14.440 3.815 -14.364
4 1HA GLY 1 1HA GLY 1 -16.084 6.281 -14.233
5 2HA GLY 1 2HA GLY 1 -16.575 4.665 -13.751
6 H SER 2 H SER 2 -16.128 3.959 -11.727
7 HA SER 2 HA SER 2 -14.084 5.082 -10.090
8 1HB SER 2 2HB SER 2 -16.239 6.709 -10.174
9 2HB SER 2 1HB SER 2 -16.723 5.637 -8.860
10 HG SER 2 HG SER 2 -15.025 7.660 -8.766
11 H ALA 3 H ALA 3 -14.997 2.487 -10.943
12 HA ALA 3 HA ALA 3 -15.492 1.295 -8.299
13 1HB ALA 3 1HB ALA 3 -17.561 1.236 -9.641
14 2HB ALA 3 2HB ALA 3 -16.942 -0.375 -9.276
15 3HB ALA 3 3HB ALA 3 -16.706 0.318 -10.881
16 H ALA 4 H ALA 4 -12.975 1.704 -9.507
17 HA ALA 4 HA ALA 4 -12.151 -1.090 -9.904
18 1HB ALA 4 1HB ALA 4 -11.027 -0.699 -11.827
19 2HB ALA 4 2HB ALA 4 -10.606 0.953 -11.374
20 3HB ALA 4 3HB ALA 4 -12.218 0.591 -11.991
21 H GLU 5 H GLU 5 -12.038 -0.050 -7.452
22 HA GLU 5 HA GLU 5 -9.516 -0.427 -6.526
23 1HB GLU 5 2HB GLU 5 -9.779 2.239 -7.708
24 2HB GLU 5 1HB GLU 5 -9.212 2.279 -6.045
25 1HG GLU 5 2HG GLU 5 -7.898 0.318 -7.803
26 2HG GLU 5 1HG GLU 5 -7.602 2.016 -8.174
27 H VAL 6 H VAL 6 -11.532 -1.248 -5.317
28 HA VAL 6 HA VAL 6 -13.035 0.414 -3.644
29 HB VAL 6 HB VAL 6 -12.208 -2.417 -3.001
30 1HG1 VAL 6 1HG1 VAL 6 -14.719 -2.228 -2.135
31 2HG1 VAL 6 2HG1 VAL 6 -14.253 -0.534 -1.977
32 3HG1 VAL 6 3HG1 VAL 6 -13.336 -1.783 -1.134
33 1HG2 VAL 6 1HG2 VAL 6 -14.431 -2.958 -4.149
34 2HG2 VAL 6 2HG2 VAL 6 -13.051 -2.582 -5.181
35 3HG2 VAL 6 3HG2 VAL 6 -14.291 -1.363 -4.889
36 H MET 7 H MET 7 -12.477 1.605 -1.949
37 HA MET 7 HA MET 7 -11.331 2.446 -0.174
38 1HB MET 7 2HB MET 7 -10.225 -0.335 0.208
39 2HB MET 7 1HB MET 7 -10.433 0.914 1.427
40 1HG MET 7 2HG MET 7 -12.691 0.567 1.600
41 2HG MET 7 1HG MET 7 -12.825 -0.086 -0.032
42 1HE MET 7 1HE MET 7 -11.069 -2.415 3.545
43 2HE MET 7 2HE MET 7 -11.757 -0.798 3.678
44 3HE MET 7 3HE MET 7 -10.255 -1.046 2.788
45 H LYS 8 H LYS 8 -9.971 3.762 -1.407
46 HA LYS 8 HA LYS 8 -7.646 2.954 -2.717
47 1HB LYS 8 2HB LYS 8 -7.186 5.201 -3.019
48 2HB LYS 8 1HB LYS 8 -8.920 5.228 -2.743
49 1HG LYS 8 2HG LYS 8 -6.796 5.845 -0.697
50 2HG LYS 8 1HG LYS 8 -7.800 7.023 -1.544
51 1HD LYS 8 2HD LYS 8 -8.965 4.822 0.144
52 2HD LYS 8 1HD LYS 8 -8.516 6.392 0.812
53 1HE LYS 8 2HE LYS 8 -10.236 7.468 -0.203
54 2HE LYS 8 1HE LYS 8 -10.197 6.419 -1.620
55 1HZ LYS 8 1HZ LYS 8 -11.517 5.966 0.978
56 2HZ LYS 8 2HZ LYS 8 -11.107 4.657 -0.013
57 3HZ LYS 8 3HZ LYS 8 -12.165 5.848 -0.581
58 H LYS 9 H LYS 9 -5.548 2.696 -2.123
59 HA LYS 9 HA LYS 9 -3.760 2.268 -0.794
60 1HB LYS 9 2HB LYS 9 -4.860 4.139 1.278
61 2HB LYS 9 1HB LYS 9 -3.188 3.853 0.822
62 1HG LYS 9 2HG LYS 9 -3.296 5.242 -0.998
63 2HG LYS 9 1HG LYS 9 -5.041 5.054 -1.176
64 1HD LYS 9 2HD LYS 9 -5.184 6.272 1.090
65 2HD LYS 9 1HD LYS 9 -3.516 6.750 0.771
66 1HE LYS 9 2HE LYS 9 -4.099 8.159 -0.906
67 2HE LYS 9 1HE LYS 9 -5.444 7.148 -1.433
68 1HZ LYS 9 1HZ LYS 9 -5.377 9.189 0.685
69 2HZ LYS 9 2HZ LYS 9 -6.495 7.923 0.785
70 3HZ LYS 9 3HZ LYS 9 -6.512 8.963 -0.550
71 H TYR 10 H TYR 10 -5.735 0.414 -0.601
72 HA TYR 10 HA TYR 10 -5.280 -0.638 2.052
73 1HB TYR 10 2HB TYR 10 -7.402 0.815 2.131
74 2HB TYR 10 1HB TYR 10 -8.143 -0.432 1.134
75 HD1 TYR 10 1HD TYR 10 -7.681 0.657 4.412
76 HD2 TYR 10 2HD TYR 10 -7.781 -2.906 2.090
77 HE1 TYR 10 1HE TYR 10 -8.201 -0.639 6.435
78 HE2 TYR 10 2HE TYR 10 -8.302 -4.212 4.107
79 HH TYR 10 HH TYR 10 -8.000 -2.955 7.241
80 H CYS 11 H CYS 11 -4.886 -2.756 1.874
81 HA CYS 11 HA CYS 11 -5.433 -4.063 -0.654
82 1HB CYS 11 2HB CYS 11 -3.254 -4.301 0.631
83 2HB CYS 11 1HB CYS 11 -4.134 -5.317 1.764
84 H SER 12 H SER 12 -7.068 -5.355 -1.069
85 HA SER 12 HA SER 12 -8.979 -5.982 1.017
86 1HB SER 12 2HB SER 12 -9.389 -5.214 -1.499
87 2HB SER 12 1HB SER 12 -9.348 -6.956 -1.776
88 HG SER 12 HG SER 12 -11.006 -5.639 0.116
89 H THR 13 H THR 13 -6.268 -7.370 0.684
90 HA THR 13 HA THR 13 -7.328 -10.087 0.901
91 HB THR 13 HB THR 13 -4.792 -9.321 -0.555
92 HG1 THR 13 1HG THR 13 -6.845 -8.939 -1.652
93 1HG2 THR 13 1HG2 THR 13 -6.027 -11.987 0.032
94 2HG2 THR 13 2HG2 THR 13 -4.375 -11.446 0.327
95 3HG2 THR 13 3HG2 THR 13 -4.927 -11.733 -1.323
96 H CYS 14 H CYS 14 -4.817 -7.765 1.714
97 HA CYS 14 HA CYS 14 -3.804 -9.575 3.790
98 1HB CYS 14 2HB CYS 14 -2.695 -6.930 2.831
99 2HB CYS 14 1HB CYS 14 -1.933 -8.004 3.998
100 H ASP 15 H ASP 15 -6.123 -7.236 3.500
101 HA ASP 15 HA ASP 15 -7.266 -5.921 4.959
102 1HB ASP 15 2HB ASP 15 -6.635 -8.310 6.297
103 2HB ASP 15 1HB ASP 15 -6.308 -7.024 7.453
104 H ILE 16 H ILE 16 -4.757 -4.994 4.106
105 HA ILE 16 HA ILE 16 -3.790 -3.528 6.472
106 HB ILE 16 HB ILE 16 -2.266 -3.780 3.891
107 1HG1 ILE 16 2HG1 ILE 16 -2.739 -6.054 4.737
108 2HG1 ILE 16 1HG1 ILE 16 -1.030 -5.651 4.854
109 1HG2 ILE 16 1HG2 ILE 16 -0.352 -3.455 5.556
110 2HG2 ILE 16 2HG2 ILE 16 -1.603 -2.979 6.704
111 3HG2 ILE 16 3HG2 ILE 16 -1.383 -2.066 5.212
112 1HD1 ILE 16 1HD1 ILE 16 -2.124 -6.850 6.822
113 2HD1 ILE 16 2HD1 ILE 16 -2.876 -5.296 7.181
114 3HD1 ILE 16 3HD1 ILE 16 -1.119 -5.443 7.171
115 H SER 17 H SER 17 -3.051 -1.299 6.047
116 HA SER 17 HA SER 17 -4.533 -0.020 3.853
117 1HB SER 17 2HB SER 17 -4.657 1.919 5.723
118 2HB SER 17 1HB SER 17 -5.919 0.704 5.519
119 HG SER 17 HG SER 17 -3.728 0.484 7.311
120 H PHE 18 H PHE 18 -3.732 2.173 3.341
121 HA PHE 18 HA PHE 18 -0.953 2.644 4.098
122 1HB PHE 18 2HB PHE 18 -2.007 2.408 1.278
123 2HB PHE 18 1HB PHE 18 -0.454 3.128 1.675
124 HD1 PHE 18 1HD PHE 18 1.322 1.713 2.708
125 HD2 PHE 18 2HD PHE 18 -2.302 0.077 1.192
126 HE1 PHE 18 1HE PHE 18 2.354 -0.520 2.659
127 HE2 PHE 18 2HE PHE 18 -1.277 -2.159 1.142
128 HZ PHE 18 HZ PHE 18 1.053 -2.461 1.875
129 H ASN 19 H ASN 19 -0.434 4.759 4.293
130 HA ASN 19 HA ASN 19 -2.595 6.672 4.169
131 1HB ASN 19 2HB ASN 19 0.147 6.612 5.315
132 2HB ASN 19 1HB ASN 19 -0.515 8.191 4.902
133 1HD2 ASN 19 1HD2 ASN 19 -0.138 8.234 7.345
134 2HD2 ASN 19 2HD2 ASN 19 -1.503 7.826 8.321
135 H TYR 20 H TYR 20 -0.622 5.505 1.853
136 HA TYR 20 HA TYR 20 -0.941 7.884 0.222
137 1HB TYR 20 2HB TYR 20 1.711 6.737 1.011
138 2HB TYR 20 1HB TYR 20 1.521 7.457 -0.584
139 HD1 TYR 20 1HD TYR 20 -0.046 9.792 -0.247
140 HD2 TYR 20 2HD TYR 20 2.834 8.163 2.428
141 HE1 TYR 20 1HE TYR 20 0.316 12.026 0.715
142 HE2 TYR 20 2HE TYR 20 3.202 10.392 3.398
143 HH TYR 20 HH TYR 20 1.392 12.722 3.398
144 H VAL 21 H VAL 21 -1.563 7.352 -1.778
145 HA VAL 21 HA VAL 21 -2.182 4.759 -2.537
146 HB VAL 21 HB VAL 21 -1.511 6.902 -4.545
147 1HG1 VAL 21 1HG1 VAL 21 -2.926 5.786 -5.991
148 2HG1 VAL 21 2HG1 VAL 21 -3.802 4.988 -4.685
149 3HG1 VAL 21 3HG1 VAL 21 -2.177 4.452 -5.113
150 1HG2 VAL 21 1HG2 VAL 21 -2.886 8.158 -3.200
151 2HG2 VAL 21 2HG2 VAL 21 -3.779 6.755 -2.616
152 3HG2 VAL 21 3HG2 VAL 21 -4.076 7.375 -4.239
153 H LYS 22 H LYS 22 0.807 6.519 -2.856
154 HA LYS 22 HA LYS 22 2.052 4.865 -4.782
155 1HB LYS 22 2HB LYS 22 3.223 6.614 -2.612
156 2HB LYS 22 1HB LYS 22 4.180 5.822 -3.858
157 1HG LYS 22 2HG LYS 22 1.969 7.787 -4.414
158 2HG LYS 22 1HG LYS 22 3.681 8.207 -4.321
159 1HD LYS 22 2HD LYS 22 3.946 6.300 -6.087
160 2HD LYS 22 1HD LYS 22 2.229 6.591 -6.373
161 1HE LYS 22 2HE LYS 22 3.921 8.997 -6.255
162 2HE LYS 22 1HE LYS 22 4.232 7.922 -7.617
163 1HZ LYS 22 1HZ LYS 22 1.445 8.558 -7.043
164 2HZ LYS 22 2HZ LYS 22 2.222 8.345 -8.529
165 3HZ LYS 22 3HZ LYS 22 2.392 9.803 -7.688
166 H THR 23 H THR 23 1.803 4.723 -1.274
167 HA THR 23 HA THR 23 3.656 2.608 -0.920
168 HB THR 23 HB THR 23 1.398 2.848 0.985
169 HG1 THR 23 1HG THR 23 2.064 4.834 1.729
170 1HG2 THR 23 1HG2 THR 23 4.378 2.961 1.375
171 2HG2 THR 23 2HG2 THR 23 3.368 1.526 1.550
172 3HG2 THR 23 3HG2 THR 23 3.158 2.891 2.647
173 H TYR 24 H TYR 24 0.167 2.737 -1.396
174 HA TYR 24 HA TYR 24 -0.341 -0.012 -1.043
175 1HB TYR 24 2HB TYR 24 -2.058 1.820 -1.095
176 2HB TYR 24 1HB TYR 24 -1.854 1.890 -2.840
177 HD1 TYR 24 1HD TYR 24 -3.927 1.171 -3.654
178 HD2 TYR 24 2HD TYR 24 -1.963 -1.119 -0.655
179 HE1 TYR 24 1HE TYR 24 -5.602 -0.609 -3.925
180 HE2 TYR 24 2HE TYR 24 -3.630 -2.907 -0.919
181 HH TYR 24 HH TYR 24 -5.700 -3.122 -3.512
182 H LEU 25 H LEU 25 0.890 1.862 -3.696
183 HA LEU 25 HA LEU 25 0.527 -0.177 -5.686
184 1HB LEU 25 2HB LEU 25 1.967 2.443 -5.551
185 2HB LEU 25 1HB LEU 25 2.352 1.325 -6.845
186 HG LEU 25 HG LEU 25 -0.515 1.988 -6.393
187 1HD1 LEU 25 1HD1 LEU 25 1.154 3.806 -8.074
188 2HD1 LEU 25 2HD1 LEU 25 0.975 4.114 -6.348
189 3HD1 LEU 25 3HD1 LEU 25 -0.449 4.069 -7.388
190 1HD2 LEU 25 1HD2 LEU 25 -0.270 0.472 -8.109
191 2HD2 LEU 25 2HD2 LEU 25 1.255 1.171 -8.653
192 3HD2 LEU 25 3HD2 LEU 25 -0.265 2.000 -8.988
193 H ALA 26 H ALA 26 3.181 0.993 -3.677
194 HA ALA 26 HA ALA 26 5.181 -0.693 -4.680
195 1HB ALA 26 1HB ALA 26 5.185 1.356 -2.955
196 2HB ALA 26 2HB ALA 26 6.510 0.199 -3.079
197 3HB ALA 26 3HB ALA 26 5.293 0.015 -1.814
198 H HIS 27 H HIS 27 2.628 -1.202 -2.340
199 HA HIS 27 HA HIS 27 3.691 -3.602 -1.232
200 1HB HIS 27 2HB HIS 27 2.084 -2.439 0.085
201 2HB HIS 27 1HB HIS 27 0.925 -2.391 -1.240
202 HD1 HIS 27 1HD HIS 27 2.452 -4.870 1.202
203 HD2 HIS 27 2HD HIS 27 -0.785 -4.495 -1.373
204 HE1 HIS 27 1HE HIS 27 0.982 -6.888 1.607
205 H LYS 28 H LYS 28 1.472 -2.879 -3.879
206 HA LYS 28 HA LYS 28 0.815 -5.613 -4.394
207 1HB LYS 28 2HB LYS 28 -0.355 -3.304 -5.090
208 2HB LYS 28 1HB LYS 28 0.572 -3.590 -6.556
209 1HG LYS 28 2HG LYS 28 -0.669 -5.390 -7.161
210 2HG LYS 28 1HG LYS 28 -1.013 -5.853 -5.494
211 1HD LYS 28 2HD LYS 28 -2.856 -4.542 -5.369
212 2HD LYS 28 1HD LYS 28 -2.160 -3.286 -6.395
213 1HE LYS 28 2HE LYS 28 -2.612 -4.574 -8.373
214 2HE LYS 28 1HE LYS 28 -3.142 -5.949 -7.407
215 1HZ LYS 28 1HZ LYS 28 -5.118 -4.954 -6.902
216 2HZ LYS 28 2HZ LYS 28 -4.860 -4.300 -8.440
217 3HZ LYS 28 3HZ LYS 28 -4.515 -3.381 -7.063
218 H GLN 29 H GLN 29 3.212 -3.347 -5.594
219 HA GLN 29 HA GLN 29 4.130 -5.169 -7.647
220 1HB GLN 29 2HB GLN 29 4.166 -2.474 -7.470
221 2HB GLN 29 1HB GLN 29 5.794 -2.837 -6.913
222 1HG GLN 29 2HG GLN 29 5.902 -4.326 -9.038
223 2HG GLN 29 1HG GLN 29 4.551 -3.331 -9.579
224 1HE2 GLN 29 1HE2 GLN 29 7.779 -3.016 -8.143
225 2HE2 GLN 29 2HE2 GLN 29 8.237 -1.622 -9.056
226 H PHE 30 H PHE 30 4.745 -4.684 -4.332
227 HA PHE 30 HA PHE 30 7.349 -6.038 -4.553
228 1HB PHE 30 2HB PHE 30 7.156 -3.765 -3.373
229 2HB PHE 30 1HB PHE 30 6.335 -4.641 -2.086
230 HD1 PHE 30 1HD PHE 30 9.264 -5.594 -4.174
231 HD2 PHE 30 2HD PHE 30 7.784 -4.679 -0.291
232 HE1 PHE 30 1HE PHE 30 11.443 -6.201 -3.205
233 HE2 PHE 30 2HE PHE 30 9.961 -5.283 0.686
234 HZ PHE 30 HZ PHE 30 11.793 -6.047 -0.772
235 H TYR 31 H TYR 31 4.421 -5.951 -2.516
236 HA TYR 31 HA TYR 31 5.045 -8.437 -1.244
237 1HB TYR 31 2HB TYR 31 3.461 -6.381 -0.545
238 2HB TYR 31 1HB TYR 31 2.246 -7.450 -1.239
239 HD1 TYR 31 1HD TYR 31 4.555 -6.917 1.528
240 HD2 TYR 31 2HD TYR 31 1.796 -9.642 -0.222
241 HE1 TYR 31 1HE TYR 31 4.485 -8.187 3.631
242 HE2 TYR 31 2HE TYR 31 1.718 -10.920 1.878
243 HH TYR 31 HH TYR 31 3.666 -11.083 4.006
244 H HIS 32 H HIS 32 2.631 -7.451 -3.667
245 HA HIS 32 HA HIS 32 2.030 -10.262 -4.193
246 1HB HIS 32 2HB HIS 32 0.723 -7.735 -5.220
247 2HB HIS 32 1HB HIS 32 0.185 -9.370 -5.586
248 HD1 HIS 32 1HD HIS 32 -1.305 -10.510 -3.855
249 HD2 HIS 32 2HD HIS 32 0.356 -6.946 -2.509
250 HE1 HIS 32 1HE HIS 32 -2.454 -9.971 -1.665
251 H LYS 33 H LYS 33 4.586 -9.501 -4.951
252 HA LYS 33 HA LYS 33 4.596 -10.271 -7.683
253 1HB LYS 33 2HB LYS 33 4.917 -7.390 -7.014
254 2HB LYS 33 1HB LYS 33 5.987 -8.057 -8.239
255 1HG LYS 33 2HG LYS 33 3.694 -9.003 -9.181
256 2HG LYS 33 1HG LYS 33 3.063 -7.602 -8.314
257 1HD LYS 33 2HD LYS 33 5.164 -6.480 -9.583
258 2HD LYS 33 1HD LYS 33 4.731 -7.739 -10.741
259 1HE LYS 33 2HE LYS 33 2.938 -5.576 -9.650
260 2HE LYS 33 1HE LYS 33 3.551 -5.715 -11.297
261 1HZ LYS 33 1HZ LYS 33 1.710 -7.638 -9.979
262 2HZ LYS 33 2HZ LYS 33 2.280 -7.746 -11.567
263 3HZ LYS 33 3HZ LYS 33 1.260 -6.473 -11.122
264 H ASN 34 H ASN 34 5.734 -11.364 -5.438
265 HA ASN 34 HA ASN 34 8.409 -11.716 -6.234
266 1HB ASN 34 2HB ASN 34 8.225 -9.380 -4.903
267 2HB ASN 34 1HB ASN 34 8.455 -10.473 -3.542
268 1HD2 ASN 34 1HD2 ASN 34 9.755 -10.316 -6.841
269 2HD2 ASN 34 2HD2 ASN 34 11.416 -10.375 -6.371
270 H LYS 35 H LYS 35 6.155 -13.312 -5.570
271 HA LYS 35 HA LYS 35 7.377 -15.294 -3.991
272 1HB LYS 35 2HB LYS 35 6.828 -13.765 -2.144
273 2HB LYS 35 1HB LYS 35 5.137 -13.788 -2.627
274 1HG LYS 35 2HG LYS 35 5.543 -16.419 -2.329
275 2HG LYS 35 1HG LYS 35 6.724 -15.801 -1.170
276 1HD LYS 35 2HD LYS 35 3.805 -15.040 -1.241
277 2HD LYS 35 1HD LYS 35 4.511 -16.237 -0.154
278 1HE LYS 35 2HE LYS 35 5.822 -13.599 -0.177
279 2HE LYS 35 1HE LYS 35 4.181 -13.629 0.470
280 1HZ LYS 35 1HZ LYS 35 5.469 -14.061 2.313
281 2HZ LYS 35 2HZ LYS 35 6.588 -15.004 1.465
282 3HZ LYS 35 3HZ LYS 35 5.055 -15.625 1.819
283 HA PRO 36 HA PRO 36 4.007 -16.755 -6.757
284 1HB PRO 36 2HB PRO 36 5.332 -18.960 -7.612
285 2HB PRO 36 1HB PRO 36 5.571 -17.363 -8.330
286 1HG PRO 36 2HG PRO 36 7.241 -18.795 -6.299
287 2HG PRO 36 1HG PRO 36 7.758 -17.868 -7.721
288 1HD PRO 36 2HD PRO 36 7.803 -16.844 -5.212
289 2HD PRO 36 1HD PRO 36 7.506 -15.844 -6.648
Start of MODEL 4
1 1H GLY 1 1HT GLY 1 -18.204 -4.317 8.505
2 2H GLY 1 2HT GLY 1 -18.343 -3.478 7.043
3 3H GLY 1 3HT GLY 1 -19.368 -3.101 8.335
4 1HA GLY 1 1HA GLY 1 -17.758 -1.994 9.513
5 2HA GLY 1 2HA GLY 1 -16.464 -2.865 8.704
6 H SER 2 H SER 2 -19.229 -0.987 7.473
7 HA SER 2 HA SER 2 -19.350 0.754 6.016
8 1HB SER 2 2HB SER 2 -16.755 1.302 7.419
9 2HB SER 2 1HB SER 2 -17.254 2.318 6.066
10 HG SER 2 HG SER 2 -19.100 2.871 7.193
11 H ALA 3 H ALA 3 -19.379 -0.643 4.206
12 HA ALA 3 HA ALA 3 -16.826 -0.856 2.754
13 1HB ALA 3 1HB ALA 3 -18.479 -2.880 3.397
14 2HB ALA 3 2HB ALA 3 -17.436 -2.886 1.976
15 3HB ALA 3 3HB ALA 3 -19.134 -2.436 1.820
16 H ALA 4 H ALA 4 -18.220 1.579 2.734
17 HA ALA 4 HA ALA 4 -19.567 1.662 0.134
18 1HB ALA 4 1HB ALA 4 -19.887 4.140 0.917
19 2HB ALA 4 2HB ALA 4 -19.499 3.472 2.502
20 3HB ALA 4 3HB ALA 4 -20.879 2.851 1.596
21 H GLU 5 H GLU 5 -16.650 1.292 0.453
22 HA GLU 5 HA GLU 5 -15.651 2.657 -1.669
23 1HB GLU 5 2HB GLU 5 -14.231 4.439 -0.443
24 2HB GLU 5 1HB GLU 5 -15.912 4.807 -0.797
25 1HG GLU 5 2HG GLU 5 -16.357 5.121 1.346
26 2HG GLU 5 1HG GLU 5 -15.707 3.537 1.765
27 H VAL 6 H VAL 6 -15.040 0.291 -1.170
28 HA VAL 6 HA VAL 6 -12.678 0.056 0.522
29 HB VAL 6 HB VAL 6 -14.401 -1.706 0.621
30 1HG1 VAL 6 1HG1 VAL 6 -14.575 -1.449 -2.076
31 2HG1 VAL 6 2HG1 VAL 6 -15.203 -2.817 -1.157
32 3HG1 VAL 6 3HG1 VAL 6 -13.623 -2.925 -1.931
33 1HG2 VAL 6 1HG2 VAL 6 -12.494 -2.667 1.365
34 2HG2 VAL 6 2HG2 VAL 6 -11.578 -2.216 -0.073
35 3HG2 VAL 6 3HG2 VAL 6 -12.656 -3.611 -0.116
36 H MET 7 H MET 7 -11.904 1.711 -1.322
37 HA MET 7 HA MET 7 -9.928 0.259 -2.804
38 1HB MET 7 2HB MET 7 -11.906 0.083 -4.301
39 2HB MET 7 1HB MET 7 -11.974 1.838 -4.374
40 1HG MET 7 2HG MET 7 -9.679 1.824 -5.329
41 2HG MET 7 1HG MET 7 -9.766 0.064 -5.387
42 1HE MET 7 1HE MET 7 -10.802 3.070 -8.262
43 2HE MET 7 2HE MET 7 -9.609 1.830 -8.653
44 3HE MET 7 3HE MET 7 -9.476 2.738 -7.147
45 H LYS 8 H LYS 8 -8.658 1.599 -1.402
46 HA LYS 8 HA LYS 8 -7.635 3.890 -2.635
47 1HB LYS 8 2HB LYS 8 -9.701 4.980 -1.953
48 2HB LYS 8 1HB LYS 8 -9.459 4.458 -0.292
49 1HG LYS 8 2HG LYS 8 -7.184 5.791 -0.601
50 2HG LYS 8 1HG LYS 8 -8.148 6.641 -1.809
51 1HD LYS 8 2HD LYS 8 -8.287 7.768 0.342
52 2HD LYS 8 1HD LYS 8 -9.858 7.100 -0.108
53 1HE LYS 8 2HE LYS 8 -9.726 5.399 1.472
54 2HE LYS 8 1HE LYS 8 -7.974 5.535 1.612
55 1HZ LYS 8 1HZ LYS 8 -9.813 7.687 2.485
56 2HZ LYS 8 2HZ LYS 8 -8.173 7.502 2.861
57 3HZ LYS 8 3HZ LYS 8 -9.315 6.442 3.518
58 H LYS 9 H LYS 9 -5.750 2.717 -2.142
59 HA LYS 9 HA LYS 9 -3.890 2.200 -0.939
60 1HB LYS 9 2HB LYS 9 -4.782 4.082 1.219
61 2HB LYS 9 1HB LYS 9 -3.159 3.774 0.621
62 1HG LYS 9 2HG LYS 9 -3.622 4.988 -1.407
63 2HG LYS 9 1HG LYS 9 -5.305 5.206 -0.926
64 1HD LYS 9 2HD LYS 9 -4.363 6.370 1.154
65 2HD LYS 9 1HD LYS 9 -2.837 6.432 0.269
66 1HE LYS 9 2HE LYS 9 -3.579 8.015 -1.161
67 2HE LYS 9 1HE LYS 9 -5.210 7.349 -1.215
68 1HZ LYS 9 1HZ LYS 9 -5.252 8.257 1.231
69 2HZ LYS 9 2HZ LYS 9 -5.590 9.269 -0.082
70 3HZ LYS 9 3HZ LYS 9 -4.059 9.302 0.637
71 H TYR 10 H TYR 10 -5.804 0.356 -0.632
72 HA TYR 10 HA TYR 10 -5.267 -0.667 2.018
73 1HB TYR 10 2HB TYR 10 -7.381 0.754 2.186
74 2HB TYR 10 1HB TYR 10 -8.151 -0.447 1.156
75 HD1 TYR 10 1HD TYR 10 -7.633 0.518 4.463
76 HD2 TYR 10 2HD TYR 10 -7.797 -2.959 2.017
77 HE1 TYR 10 1HE TYR 10 -8.136 -0.846 6.446
78 HE2 TYR 10 2HE TYR 10 -8.302 -4.333 3.993
79 HH TYR 10 HH TYR 10 -7.966 -3.170 7.175
80 H CYS 11 H CYS 11 -4.861 -2.779 1.852
81 HA CYS 11 HA CYS 11 -5.451 -4.116 -0.648
82 1HB CYS 11 2HB CYS 11 -3.244 -4.313 0.600
83 2HB CYS 11 1HB CYS 11 -4.091 -5.341 1.749
84 H SER 12 H SER 12 -7.099 -5.402 -1.015
85 HA SER 12 HA SER 12 -8.937 -6.059 1.128
86 1HB SER 12 2HB SER 12 -9.388 -5.309 -1.419
87 2HB SER 12 1HB SER 12 -9.435 -7.061 -1.620
88 HG SER 12 HG SER 12 -10.954 -7.014 0.213
89 H THR 13 H THR 13 -6.227 -7.411 0.713
90 HA THR 13 HA THR 13 -7.241 -10.144 0.925
91 HB THR 13 HB THR 13 -4.748 -9.329 -0.573
92 HG1 THR 13 1HG THR 13 -7.299 -10.183 -1.439
93 1HG2 THR 13 1HG2 THR 13 -5.817 -11.960 0.248
94 2HG2 THR 13 2HG2 THR 13 -4.151 -11.428 0.018
95 3HG2 THR 13 3HG2 THR 13 -5.152 -11.820 -1.380
96 H CYS 14 H CYS 14 -4.753 -7.790 1.709
97 HA CYS 14 HA CYS 14 -3.661 -9.606 3.738
98 1HB CYS 14 2HB CYS 14 -2.618 -6.938 2.769
99 2HB CYS 14 1HB CYS 14 -1.815 -7.996 3.922
100 H ASP 15 H ASP 15 -6.009 -7.275 3.523
101 HA ASP 15 HA ASP 15 -7.146 -6.013 5.030
102 1HB ASP 15 2HB ASP 15 -6.413 -8.399 6.330
103 2HB ASP 15 1HB ASP 15 -6.110 -7.110 7.490
104 H ILE 16 H ILE 16 -4.703 -4.998 4.119
105 HA ILE 16 HA ILE 16 -3.726 -3.524 6.477
106 HB ILE 16 HB ILE 16 -2.204 -3.766 3.896
107 1HG1 ILE 16 2HG1 ILE 16 -2.640 -6.044 4.753
108 2HG1 ILE 16 1HG1 ILE 16 -0.937 -5.613 4.866
109 1HG2 ILE 16 1HG2 ILE 16 -0.291 -3.397 5.548
110 2HG2 ILE 16 2HG2 ILE 16 -1.544 -2.947 6.705
111 3HG2 ILE 16 3HG2 ILE 16 -1.353 -2.029 5.212
112 1HD1 ILE 16 1HD1 ILE 16 -2.001 -6.819 6.840
113 2HD1 ILE 16 2HD1 ILE 16 -2.790 -5.282 7.192
114 3HD1 ILE 16 3HD1 ILE 16 -1.030 -5.388 7.183
115 H SER 17 H SER 17 -3.025 -1.284 6.035
116 HA SER 17 HA SER 17 -4.541 -0.047 3.839
117 1HB SER 17 2HB SER 17 -4.674 1.901 5.707
118 2HB SER 17 1HB SER 17 -5.929 0.680 5.495
119 HG SER 17 HG SER 17 -3.794 0.643 7.361
120 H PHE 18 H PHE 18 -3.793 2.168 3.324
121 HA PHE 18 HA PHE 18 -1.022 2.711 4.056
122 1HB PHE 18 2HB PHE 18 -2.071 2.402 1.240
123 2HB PHE 18 1HB PHE 18 -0.530 3.154 1.625
124 HD1 PHE 18 1HD PHE 18 1.249 1.773 2.736
125 HD2 PHE 18 2HD PHE 18 -2.314 0.078 1.141
126 HE1 PHE 18 1HE PHE 18 2.312 -0.448 2.726
127 HE2 PHE 18 2HE PHE 18 -1.259 -2.144 1.129
128 HZ PHE 18 HZ PHE 18 1.056 -2.410 1.922
129 H ASN 19 H ASN 19 -0.574 4.848 4.233
130 HA ASN 19 HA ASN 19 -2.801 6.690 3.979
131 1HB ASN 19 2HB ASN 19 -0.129 6.749 5.307
132 2HB ASN 19 1HB ASN 19 -0.890 8.284 4.900
133 1HD2 ASN 19 1HD2 ASN 19 -0.448 6.257 7.340
134 2HD2 ASN 19 2HD2 ASN 19 -1.906 6.499 8.235
135 H TYR 20 H TYR 20 -0.887 5.550 1.724
136 HA TYR 20 HA TYR 20 -1.020 7.951 0.130
137 1HB TYR 20 2HB TYR 20 1.572 6.801 1.079
138 2HB TYR 20 1HB TYR 20 1.488 7.479 -0.543
139 HD1 TYR 20 1HD TYR 20 0.794 9.891 -0.812
140 HD2 TYR 20 2HD TYR 20 1.745 8.197 2.972
141 HE1 TYR 20 1HE TYR 20 1.115 12.148 0.110
142 HE2 TYR 20 2HE TYR 20 2.067 10.449 3.905
143 HH TYR 20 HH TYR 20 2.272 13.236 1.952
144 H VAL 21 H VAL 21 -1.567 7.424 -1.892
145 HA VAL 21 HA VAL 21 -2.135 4.836 -2.701
146 HB VAL 21 HB VAL 21 -1.391 7.048 -4.612
147 1HG1 VAL 21 1HG1 VAL 21 -3.409 4.825 -4.881
148 2HG1 VAL 21 2HG1 VAL 21 -1.768 4.764 -5.524
149 3HG1 VAL 21 3HG1 VAL 21 -2.907 5.969 -6.125
150 1HG2 VAL 21 1HG2 VAL 21 -3.872 6.658 -2.973
151 2HG2 VAL 21 2HG2 VAL 21 -3.915 7.512 -4.515
152 3HG2 VAL 21 3HG2 VAL 21 -2.911 8.119 -3.198
153 H LYS 22 H LYS 22 0.856 6.608 -2.848
154 HA LYS 22 HA LYS 22 2.206 4.987 -4.732
155 1HB LYS 22 2HB LYS 22 3.204 6.770 -2.509
156 2HB LYS 22 1HB LYS 22 4.282 5.931 -3.616
157 1HG LYS 22 2HG LYS 22 4.146 7.850 -4.773
158 2HG LYS 22 1HG LYS 22 2.649 7.140 -5.380
159 1HD LYS 22 2HD LYS 22 1.355 8.347 -3.750
160 2HD LYS 22 1HD LYS 22 2.820 8.950 -2.974
161 1HE LYS 22 2HE LYS 22 3.238 9.804 -5.490
162 2HE LYS 22 1HE LYS 22 1.475 9.834 -5.449
163 1HZ LYS 22 1HZ LYS 22 3.393 11.493 -4.031
164 2HZ LYS 22 2HZ LYS 22 2.039 11.016 -3.138
165 3HZ LYS 22 3HZ LYS 22 1.838 11.866 -4.587
166 H THR 23 H THR 23 1.825 4.821 -1.233
167 HA THR 23 HA THR 23 3.657 2.692 -0.839
168 HB THR 23 HB THR 23 1.355 2.942 1.011
169 HG1 THR 23 1HG THR 23 3.239 5.031 0.664
170 1HG2 THR 23 1HG2 THR 23 3.271 1.606 1.653
171 2HG2 THR 23 2HG2 THR 23 3.103 3.009 2.709
172 3HG2 THR 23 3HG2 THR 23 4.330 2.999 1.442
173 H TYR 24 H TYR 24 0.186 2.847 -1.432
174 HA TYR 24 HA TYR 24 -0.351 0.103 -1.082
175 1HB TYR 24 2HB TYR 24 -2.056 1.956 -1.217
176 2HB TYR 24 1HB TYR 24 -1.791 1.989 -2.955
177 HD1 TYR 24 1HD TYR 24 -3.839 1.266 -3.826
178 HD2 TYR 24 2HD TYR 24 -1.993 -0.974 -0.714
179 HE1 TYR 24 1HE TYR 24 -5.515 -0.509 -4.117
180 HE2 TYR 24 2HE TYR 24 -3.663 -2.755 -0.999
181 HH TYR 24 HH TYR 24 -5.465 -3.197 -3.563
182 H LEU 25 H LEU 25 0.975 1.957 -3.707
183 HA LEU 25 HA LEU 25 0.698 -0.111 -5.683
184 1HB LEU 25 2HB LEU 25 2.228 2.475 -5.551
185 2HB LEU 25 1HB LEU 25 2.459 1.354 -6.878
186 HG LEU 25 HG LEU 25 -0.237 2.488 -6.152
187 1HD1 LEU 25 1HD1 LEU 25 1.441 3.474 -8.425
188 2HD1 LEU 25 2HD1 LEU 25 1.587 4.183 -6.818
189 3HD1 LEU 25 3HD1 LEU 25 0.040 4.227 -7.663
190 1HD2 LEU 25 1HD2 LEU 25 -0.851 1.771 -8.383
191 2HD2 LEU 25 2HD2 LEU 25 -0.211 0.407 -7.466
192 3HD2 LEU 25 3HD2 LEU 25 0.792 1.202 -8.679
193 H ALA 26 H ALA 26 3.263 1.113 -3.593
194 HA ALA 26 HA ALA 26 5.323 -0.551 -4.496
195 1HB ALA 26 1HB ALA 26 5.995 1.254 -3.177
196 2HB ALA 26 2HB ALA 26 6.248 -0.146 -2.135
197 3HB ALA 26 3HB ALA 26 4.830 0.878 -1.906
198 H HIS 27 H HIS 27 2.676 -1.096 -2.263
199 HA HIS 27 HA HIS 27 3.719 -3.497 -1.135
200 1HB HIS 27 2HB HIS 27 2.046 -2.358 0.123
201 2HB HIS 27 1HB HIS 27 0.938 -2.326 -1.245
202 HD1 HIS 27 1HD HIS 27 2.470 -4.838 1.170
203 HD2 HIS 27 2HD HIS 27 -0.777 -4.413 -1.385
204 HE1 HIS 27 1HE HIS 27 1.015 -6.876 1.522
205 H LYS 28 H LYS 28 1.361 -2.834 -3.712
206 HA LYS 28 HA LYS 28 0.861 -5.555 -4.317
207 1HB LYS 28 2HB LYS 28 -0.395 -3.309 -4.984
208 2HB LYS 28 1HB LYS 28 0.591 -3.472 -6.431
209 1HG LYS 28 2HG LYS 28 -0.321 -5.770 -6.713
210 2HG LYS 28 1HG LYS 28 -1.410 -5.448 -5.362
211 1HD LYS 28 2HD LYS 28 -2.666 -4.994 -7.303
212 2HD LYS 28 1HD LYS 28 -2.192 -3.416 -6.671
213 1HE LYS 28 2HE LYS 28 -1.771 -3.244 -8.957
214 2HE LYS 28 1HE LYS 28 -0.189 -3.604 -8.267
215 1HZ LYS 28 1HZ LYS 28 -1.909 -5.792 -9.228
216 2HZ LYS 28 2HZ LYS 28 -0.224 -5.742 -9.085
217 3HZ LYS 28 3HZ LYS 28 -0.991 -4.895 -10.331
218 H GLN 29 H GLN 29 3.344 -3.315 -5.267
219 HA GLN 29 HA GLN 29 4.251 -4.949 -7.475
220 1HB GLN 29 2HB GLN 29 4.417 -2.303 -7.010
221 2HB GLN 29 1HB GLN 29 5.992 -2.806 -6.409
222 1HG GLN 29 2HG GLN 29 6.624 -2.528 -8.534
223 2HG GLN 29 1HG GLN 29 5.918 -4.128 -8.760
224 1HE2 GLN 29 1HE2 GLN 29 3.262 -3.628 -8.730
225 2HE2 GLN 29 2HE2 GLN 29 2.824 -2.612 -10.056
226 H PHE 30 H PHE 30 4.785 -4.863 -4.099
227 HA PHE 30 HA PHE 30 7.272 -6.411 -4.430
228 1HB PHE 30 2HB PHE 30 6.416 -4.409 -2.409
229 2HB PHE 30 1HB PHE 30 7.383 -5.762 -1.836
230 HD1 PHE 30 1HD PHE 30 7.438 -2.566 -3.374
231 HD2 PHE 30 2HD PHE 30 9.590 -6.222 -3.060
232 HE1 PHE 30 1HE PHE 30 9.479 -1.425 -4.138
233 HE2 PHE 30 2HE PHE 30 11.636 -5.088 -3.823
234 HZ PHE 30 HZ PHE 30 11.582 -2.686 -4.364
235 H TYR 31 H TYR 31 4.364 -6.151 -2.387
236 HA TYR 31 HA TYR 31 4.761 -8.724 -1.205
237 1HB TYR 31 2HB TYR 31 3.404 -6.615 -0.364
238 2HB TYR 31 1HB TYR 31 2.082 -7.403 -1.220
239 HD1 TYR 31 1HD TYR 31 4.529 -7.803 1.523
240 HD2 TYR 31 2HD TYR 31 1.000 -9.313 -0.313
241 HE1 TYR 31 1HE TYR 31 4.144 -9.256 3.470
242 HE2 TYR 31 2HE TYR 31 0.606 -10.769 1.629
243 HH TYR 31 HH TYR 31 1.943 -11.806 3.454
244 H HIS 32 H HIS 32 2.846 -7.470 -3.876
245 HA HIS 32 HA HIS 32 1.961 -10.218 -4.463
246 1HB HIS 32 2HB HIS 32 0.701 -7.602 -5.312
247 2HB HIS 32 1HB HIS 32 0.108 -9.205 -5.730
248 HD1 HIS 32 1HD HIS 32 -1.313 -10.420 -3.972
249 HD2 HIS 32 2HD HIS 32 0.356 -6.869 -2.602
250 HE1 HIS 32 1HE HIS 32 -2.424 -9.919 -1.753
251 H LYS 33 H LYS 33 4.468 -9.761 -5.223
252 HA LYS 33 HA LYS 33 4.249 -9.686 -8.131
253 1HB LYS 33 2HB LYS 33 5.026 -7.415 -6.974
254 2HB LYS 33 1HB LYS 33 6.577 -8.243 -6.964
255 1HG LYS 33 2HG LYS 33 5.018 -8.170 -9.495
256 2HG LYS 33 1HG LYS 33 5.861 -6.712 -8.968
257 1HD LYS 33 2HD LYS 33 7.834 -8.475 -8.621
258 2HD LYS 33 1HD LYS 33 6.946 -9.312 -9.896
259 1HE LYS 33 2HE LYS 33 7.474 -7.767 -11.458
260 2HE LYS 33 1HE LYS 33 7.383 -6.428 -10.316
261 1HZ LYS 33 1HZ LYS 33 9.556 -6.609 -9.792
262 2HZ LYS 33 2HZ LYS 33 9.661 -7.304 -11.330
263 3HZ LYS 33 3HZ LYS 33 9.590 -8.293 -9.960
264 H ASN 34 H ASN 34 4.458 -11.994 -6.918
265 HA ASN 34 HA ASN 34 5.672 -13.912 -6.749
266 1HB ASN 34 2HB ASN 34 7.250 -12.294 -8.707
267 2HB ASN 34 1HB ASN 34 7.942 -13.794 -8.095
268 1HD2 ASN 34 1HD2 ASN 34 5.929 -15.498 -7.941
269 2HD2 ASN 34 2HD2 ASN 34 5.182 -15.744 -9.479
270 H LYS 35 H LYS 35 5.948 -11.982 -4.676
271 HA LYS 35 HA LYS 35 8.320 -13.003 -3.422
272 1HB LYS 35 2HB LYS 35 8.801 -10.791 -4.878
273 2HB LYS 35 1HB LYS 35 8.274 -10.037 -3.381
274 1HG LYS 35 2HG LYS 35 10.709 -10.302 -3.501
275 2HG LYS 35 1HG LYS 35 10.001 -11.184 -2.146
276 1HD LYS 35 2HD LYS 35 10.505 -13.216 -3.032
277 2HD LYS 35 1HD LYS 35 10.305 -12.661 -4.695
278 1HE LYS 35 2HE LYS 35 12.462 -11.249 -4.091
279 2HE LYS 35 1HE LYS 35 12.687 -12.548 -2.920
280 1HZ LYS 35 1HZ LYS 35 13.719 -12.814 -5.222
281 2HZ LYS 35 2HZ LYS 35 12.149 -13.134 -5.765
282 3HZ LYS 35 3HZ LYS 35 12.858 -14.129 -4.595
283 HA PRO 36 HA PRO 36 5.535 -12.473 -0.003
284 1HB PRO 36 2HB PRO 36 7.259 -12.966 2.028
285 2HB PRO 36 1HB PRO 36 6.630 -14.240 0.979
286 1HG PRO 36 2HG PRO 36 9.267 -12.829 0.870
287 2HG PRO 36 1HG PRO 36 8.915 -14.556 0.681
288 1HD PRO 36 2HD PRO 36 9.353 -12.917 -1.431
289 2HD PRO 36 1HD PRO 36 8.257 -14.311 -1.514
Start of MODEL 5
1 1H GLY 1 1HT GLY 1 -6.851 3.112 12.464
2 2H GLY 1 2HT GLY 1 -8.077 1.950 12.383
3 3H GLY 1 3HT GLY 1 -7.402 2.363 13.878
4 1HA GLY 1 1HA GLY 1 -9.690 3.343 13.169
5 2HA GLY 1 2HA GLY 1 -8.522 4.324 14.041
6 H SER 2 H SER 2 -6.774 5.213 12.312
7 HA SER 2 HA SER 2 -8.122 7.194 10.863
8 1HB SER 2 2HB SER 2 -5.563 6.876 11.669
9 2HB SER 2 1HB SER 2 -5.389 6.482 9.959
10 HG SER 2 HG SER 2 -5.270 8.815 10.773
11 H ALA 3 H ALA 3 -9.137 7.126 8.977
12 HA ALA 3 HA ALA 3 -9.855 6.460 6.923
13 1HB ALA 3 1HB ALA 3 -7.186 6.712 6.691
14 2HB ALA 3 2HB ALA 3 -8.244 6.257 5.355
15 3HB ALA 3 3HB ALA 3 -7.374 5.014 6.253
16 H ALA 4 H ALA 4 -11.426 5.001 7.490
17 HA ALA 4 HA ALA 4 -10.639 2.166 7.355
18 1HB ALA 4 1HB ALA 4 -11.145 2.243 9.582
19 2HB ALA 4 2HB ALA 4 -12.746 1.907 8.923
20 3HB ALA 4 3HB ALA 4 -12.311 3.552 9.386
21 H GLU 5 H GLU 5 -11.540 3.836 5.218
22 HA GLU 5 HA GLU 5 -13.256 2.257 3.835
23 1HB GLU 5 2HB GLU 5 -14.709 3.849 5.818
24 2HB GLU 5 1HB GLU 5 -15.316 4.068 4.183
25 1HG GLU 5 2HG GLU 5 -14.934 1.305 4.532
26 2HG GLU 5 1HG GLU 5 -15.726 1.897 5.990
27 H VAL 6 H VAL 6 -11.328 3.413 2.767
28 HA VAL 6 HA VAL 6 -12.280 5.886 1.474
29 HB VAL 6 HB VAL 6 -9.404 4.999 1.696
30 1HG1 VAL 6 1HG1 VAL 6 -8.843 7.160 0.908
31 2HG1 VAL 6 2HG1 VAL 6 -10.500 7.735 1.090
32 3HG1 VAL 6 3HG1 VAL 6 -10.108 6.557 -0.163
33 1HG2 VAL 6 1HG2 VAL 6 -10.924 6.963 3.411
34 2HG2 VAL 6 2HG2 VAL 6 -9.176 6.728 3.439
35 3HG2 VAL 6 3HG2 VAL 6 -10.250 5.417 3.929
36 H MET 7 H MET 7 -10.713 2.767 0.983
37 HA MET 7 HA MET 7 -10.478 1.443 -0.850
38 1HB MET 7 2HB MET 7 -12.986 2.108 -0.972
39 2HB MET 7 1HB MET 7 -12.485 3.137 -2.306
40 1HG MET 7 2HG MET 7 -13.063 1.269 -3.456
41 2HG MET 7 1HG MET 7 -11.362 0.915 -3.156
42 1HE MET 7 1HE MET 7 -12.301 -1.858 -3.724
43 2HE MET 7 2HE MET 7 -11.773 -2.590 -2.209
44 3HE MET 7 3HE MET 7 -10.834 -1.283 -2.931
45 H LYS 8 H LYS 8 -8.348 2.249 -1.178
46 HA LYS 8 HA LYS 8 -7.810 3.116 -3.778
47 1HB LYS 8 2HB LYS 8 -6.832 5.375 -3.234
48 2HB LYS 8 1HB LYS 8 -8.588 5.291 -3.203
49 1HG LYS 8 2HG LYS 8 -8.659 5.372 -0.860
50 2HG LYS 8 1HG LYS 8 -6.940 5.001 -0.713
51 1HD LYS 8 2HD LYS 8 -7.235 7.333 -0.262
52 2HD LYS 8 1HD LYS 8 -6.451 7.178 -1.836
53 1HE LYS 8 2HE LYS 8 -9.391 7.244 -1.897
54 2HE LYS 8 1HE LYS 8 -8.619 8.730 -1.347
55 1HZ LYS 8 1HZ LYS 8 -8.467 7.420 -3.968
56 2HZ LYS 8 2HZ LYS 8 -7.149 8.341 -3.443
57 3HZ LYS 8 3HZ LYS 8 -8.674 9.057 -3.594
58 H LYS 9 H LYS 9 -6.705 3.050 -0.431
59 HA LYS 9 HA LYS 9 -4.148 1.960 -1.374
60 1HB LYS 9 2HB LYS 9 -3.794 3.477 1.066
61 2HB LYS 9 1HB LYS 9 -2.906 3.578 -0.446
62 1HG LYS 9 2HG LYS 9 -4.907 4.958 -1.284
63 2HG LYS 9 1HG LYS 9 -5.326 5.109 0.423
64 1HD LYS 9 2HD LYS 9 -2.629 5.693 0.373
65 2HD LYS 9 1HD LYS 9 -3.235 6.430 -1.111
66 1HE LYS 9 2HE LYS 9 -3.270 7.917 0.908
67 2HE LYS 9 1HE LYS 9 -4.818 7.737 0.085
68 1HZ LYS 9 1HZ LYS 9 -4.496 7.453 2.712
69 2HZ LYS 9 2HZ LYS 9 -4.307 5.845 2.223
70 3HZ LYS 9 3HZ LYS 9 -5.723 6.684 1.835
71 H TYR 10 H TYR 10 -6.347 0.501 -0.516
72 HA TYR 10 HA TYR 10 -5.304 -0.651 1.985
73 1HB TYR 10 2HB TYR 10 -7.457 0.672 2.294
74 2HB TYR 10 1HB TYR 10 -8.244 -0.547 1.298
75 HD1 TYR 10 1HD TYR 10 -7.609 0.415 4.573
76 HD2 TYR 10 2HD TYR 10 -7.721 -3.059 2.120
77 HE1 TYR 10 1HE TYR 10 -7.953 -0.978 6.570
78 HE2 TYR 10 2HE TYR 10 -8.067 -4.460 4.109
79 HH TYR 10 HH TYR 10 -8.910 -3.197 7.125
80 H CYS 11 H CYS 11 -4.936 -2.795 1.892
81 HA CYS 11 HA CYS 11 -5.521 -4.151 -0.602
82 1HB CYS 11 2HB CYS 11 -3.310 -4.343 0.636
83 2HB CYS 11 1HB CYS 11 -4.151 -5.359 1.798
84 H SER 12 H SER 12 -7.165 -5.441 -0.961
85 HA SER 12 HA SER 12 -9.000 -6.092 1.186
86 1HB SER 12 2HB SER 12 -9.104 -6.117 -1.793
87 2HB SER 12 1HB SER 12 -10.194 -7.198 -0.923
88 HG SER 12 HG SER 12 -9.964 -4.421 -0.398
89 H THR 13 H THR 13 -6.291 -7.442 0.779
90 HA THR 13 HA THR 13 -7.303 -10.176 0.999
91 HB THR 13 HB THR 13 -4.810 -9.363 -0.502
92 HG1 THR 13 1HG THR 13 -7.353 -10.243 -1.366
93 1HG2 THR 13 1HG2 THR 13 -4.127 -11.451 -0.304
94 2HG2 THR 13 2HG2 THR 13 -5.578 -11.976 -1.157
95 3HG2 THR 13 3HG2 THR 13 -5.574 -11.882 0.604
96 H CYS 14 H CYS 14 -4.816 -7.818 1.776
97 HA CYS 14 HA CYS 14 -3.757 -9.623 3.839
98 1HB CYS 14 2HB CYS 14 -2.636 -6.996 2.848
99 2HB CYS 14 1HB CYS 14 -1.858 -8.095 3.979
100 H ASP 15 H ASP 15 -6.116 -7.371 3.610
101 HA ASP 15 HA ASP 15 -7.200 -5.992 5.052
102 1HB ASP 15 2HB ASP 15 -5.886 -7.838 7.054
103 2HB ASP 15 1HB ASP 15 -7.196 -6.722 7.422
104 H ILE 16 H ILE 16 -4.794 -4.973 4.120
105 HA ILE 16 HA ILE 16 -3.747 -3.531 6.468
106 HB ILE 16 HB ILE 16 -2.285 -3.755 3.850
107 1HG1 ILE 16 2HG1 ILE 16 -2.722 -6.042 4.669
108 2HG1 ILE 16 1HG1 ILE 16 -1.014 -5.629 4.768
109 1HG2 ILE 16 1HG2 ILE 16 -0.333 -3.432 5.463
110 2HG2 ILE 16 2HG2 ILE 16 -1.553 -2.997 6.661
111 3HG2 ILE 16 3HG2 ILE 16 -1.391 -2.049 5.182
112 1HD1 ILE 16 1HD1 ILE 16 -1.156 -5.314 7.125
113 2HD1 ILE 16 2HD1 ILE 16 -1.899 -6.864 6.732
114 3HD1 ILE 16 3HD1 ILE 16 -2.913 -5.466 7.091
115 H SER 17 H SER 17 -3.042 -1.295 6.028
116 HA SER 17 HA SER 17 -4.596 -0.031 3.874
117 1HB SER 17 2HB SER 17 -4.678 1.912 5.738
118 2HB SER 17 1HB SER 17 -5.932 0.683 5.587
119 HG SER 17 HG SER 17 -4.589 1.174 7.713
120 H PHE 18 H PHE 18 -3.825 2.178 3.346
121 HA PHE 18 HA PHE 18 -1.024 2.657 4.019
122 1HB PHE 18 2HB PHE 18 -2.159 2.389 1.235
123 2HB PHE 18 1HB PHE 18 -0.606 3.140 1.572
124 HD1 PHE 18 1HD PHE 18 1.018 1.657 3.045
125 HD2 PHE 18 2HD PHE 18 -2.212 0.164 0.712
126 HE1 PHE 18 1HE PHE 18 2.082 -0.562 2.998
127 HE2 PHE 18 2HE PHE 18 -1.157 -2.058 0.664
128 HZ PHE 18 HZ PHE 18 0.992 -2.423 1.807
129 H ASN 19 H ASN 19 -0.537 4.762 4.267
130 HA ASN 19 HA ASN 19 -2.704 6.682 4.023
131 1HB ASN 19 2HB ASN 19 -0.090 6.589 5.450
132 2HB ASN 19 1HB ASN 19 -0.739 8.173 5.036
133 1HD2 ASN 19 1HD2 ASN 19 -0.432 7.672 7.614
134 2HD2 ASN 19 2HD2 ASN 19 -1.948 7.378 8.390
135 H TYR 20 H TYR 20 -0.786 5.536 1.787
136 HA TYR 20 HA TYR 20 -0.766 7.988 0.269
137 1HB TYR 20 2HB TYR 20 1.761 6.636 1.166
138 2HB TYR 20 1HB TYR 20 1.713 7.502 -0.365
139 HD1 TYR 20 1HD TYR 20 1.133 9.956 -0.354
140 HD2 TYR 20 2HD TYR 20 1.970 7.792 3.212
141 HE1 TYR 20 1HE TYR 20 1.543 12.074 0.827
142 HE2 TYR 20 2HE TYR 20 2.382 9.903 4.404
143 HH TYR 20 HH TYR 20 1.457 12.877 3.252
144 H VAL 21 H VAL 21 -1.298 7.550 -1.776
145 HA VAL 21 HA VAL 21 -1.984 5.032 -2.683
146 HB VAL 21 HB VAL 21 -1.074 7.288 -4.471
147 1HG1 VAL 21 1HG1 VAL 21 -3.027 5.030 -4.909
148 2HG1 VAL 21 2HG1 VAL 21 -1.419 5.171 -5.619
149 3HG1 VAL 21 3HG1 VAL 21 -2.678 6.324 -6.055
150 1HG2 VAL 21 1HG2 VAL 21 -3.664 6.868 -3.008
151 2HG2 VAL 21 2HG2 VAL 21 -3.564 7.844 -4.473
152 3HG2 VAL 21 3HG2 VAL 21 -2.637 8.302 -3.043
153 H LYS 22 H LYS 22 1.111 6.634 -2.738
154 HA LYS 22 HA LYS 22 2.388 4.978 -4.638
155 1HB LYS 22 2HB LYS 22 4.467 5.877 -3.783
156 2HB LYS 22 1HB LYS 22 3.277 7.167 -3.901
157 1HG LYS 22 2HG LYS 22 2.933 6.277 -1.333
158 2HG LYS 22 1HG LYS 22 4.673 6.108 -1.573
159 1HD LYS 22 2HD LYS 22 3.472 8.627 -2.535
160 2HD LYS 22 1HD LYS 22 3.484 8.396 -0.785
161 1HE LYS 22 2HE LYS 22 5.491 9.578 -1.743
162 2HE LYS 22 1HE LYS 22 5.840 8.171 -0.740
163 1HZ LYS 22 1HZ LYS 22 6.365 6.888 -2.604
164 2HZ LYS 22 2HZ LYS 22 7.099 8.381 -2.911
165 3HZ LYS 22 3HZ LYS 22 5.650 7.977 -3.685
166 H THR 23 H THR 23 1.783 4.660 -1.206
167 HA THR 23 HA THR 23 3.569 2.474 -0.808
168 HB THR 23 HB THR 23 1.216 2.727 0.970
169 HG1 THR 23 1HG THR 23 1.768 4.680 1.754
170 1HG2 THR 23 1HG2 THR 23 3.114 1.327 1.594
171 2HG2 THR 23 2HG2 THR 23 2.881 2.658 2.728
172 3HG2 THR 23 3HG2 THR 23 4.172 2.736 1.529
173 H TYR 24 H TYR 24 0.130 2.770 -1.523
174 HA TYR 24 HA TYR 24 -0.507 0.033 -1.295
175 1HB TYR 24 2HB TYR 24 -2.196 1.841 -1.385
176 2HB TYR 24 1HB TYR 24 -1.788 2.121 -3.072
177 HD1 TYR 24 1HD TYR 24 -3.576 1.458 -4.380
178 HD2 TYR 24 2HD TYR 24 -2.377 -1.021 -1.136
179 HE1 TYR 24 1HE TYR 24 -5.232 -0.229 -5.064
180 HE2 TYR 24 2HE TYR 24 -4.027 -2.714 -1.812
181 HH TYR 24 HH TYR 24 -6.413 -2.479 -3.273
182 H LEU 25 H LEU 25 0.947 1.954 -3.796
183 HA LEU 25 HA LEU 25 0.691 -0.022 -5.865
184 1HB LEU 25 2HB LEU 25 2.137 2.576 -5.558
185 2HB LEU 25 1HB LEU 25 2.613 1.490 -6.850
186 HG LEU 25 HG LEU 25 -0.276 2.165 -6.591
187 1HD1 LEU 25 1HD1 LEU 25 0.996 4.309 -6.339
188 2HD1 LEU 25 2HD1 LEU 25 -0.056 4.229 -7.753
189 3HD1 LEU 25 3HD1 LEU 25 1.684 4.011 -7.935
190 1HD2 LEU 25 1HD2 LEU 25 1.178 2.183 -9.158
191 2HD2 LEU 25 2HD2 LEU 25 -0.388 1.485 -8.742
192 3HD2 LEU 25 3HD2 LEU 25 1.099 0.635 -8.317
193 H ALA 26 H ALA 26 3.196 1.019 -3.618
194 HA ALA 26 HA ALA 26 5.237 -0.666 -4.567
195 1HB ALA 26 1HB ALA 26 5.717 1.262 -3.173
196 2HB ALA 26 2HB ALA 26 6.341 -0.207 -2.423
197 3HB ALA 26 3HB ALA 26 4.852 0.524 -1.825
198 H HIS 27 H HIS 27 2.561 -1.176 -2.366
199 HA HIS 27 HA HIS 27 3.567 -3.592 -1.231
200 1HB HIS 27 2HB HIS 27 1.906 -2.383 0.002
201 2HB HIS 27 1HB HIS 27 0.785 -2.418 -1.356
202 HD1 HIS 27 1HD HIS 27 2.351 -4.789 1.174
203 HD2 HIS 27 2HD HIS 27 -0.880 -4.549 -1.424
204 HE1 HIS 27 1HE HIS 27 0.927 -6.834 1.616
205 H LYS 28 H LYS 28 1.461 -2.837 -3.963
206 HA LYS 28 HA LYS 28 0.824 -5.572 -4.519
207 1HB LYS 28 2HB LYS 28 -0.417 -3.354 -5.199
208 2HB LYS 28 1HB LYS 28 0.647 -3.426 -6.597
209 1HG LYS 28 2HG LYS 28 -0.786 -5.915 -5.937
210 2HG LYS 28 1HG LYS 28 -1.776 -4.569 -6.506
211 1HD LYS 28 2HD LYS 28 0.713 -5.177 -8.005
212 2HD LYS 28 1HD LYS 28 -0.635 -6.303 -8.172
213 1HE LYS 28 2HE LYS 28 -0.624 -3.349 -8.766
214 2HE LYS 28 1HE LYS 28 -0.803 -4.673 -9.917
215 1HZ LYS 28 1HZ LYS 28 -2.756 -3.552 -8.053
216 2HZ LYS 28 2HZ LYS 28 -2.843 -5.212 -8.368
217 3HZ LYS 28 3HZ LYS 28 -2.968 -4.103 -9.639
218 H GLN 29 H GLN 29 3.246 -3.284 -5.623
219 HA GLN 29 HA GLN 29 4.238 -5.085 -7.662
220 1HB GLN 29 2HB GLN 29 4.269 -2.374 -7.410
221 2HB GLN 29 1HB GLN 29 5.899 -2.777 -6.891
222 1HG GLN 29 2HG GLN 29 5.845 -4.251 -9.084
223 2HG GLN 29 1HG GLN 29 4.623 -3.069 -9.551
224 1HE2 GLN 29 1HE2 GLN 29 5.282 -0.757 -9.211
225 2HE2 GLN 29 2HE2 GLN 29 6.904 -0.335 -9.628
226 H PHE 30 H PHE 30 4.703 -4.715 -4.329
227 HA PHE 30 HA PHE 30 7.326 -6.047 -4.491
228 1HB PHE 30 2HB PHE 30 7.139 -3.758 -3.336
229 2HB PHE 30 1HB PHE 30 6.295 -4.616 -2.051
230 HD1 PHE 30 1HD PHE 30 9.424 -4.913 -4.064
231 HD2 PHE 30 2HD PHE 30 7.539 -5.351 -0.273
232 HE1 PHE 30 1HE PHE 30 11.586 -5.531 -3.065
233 HE2 PHE 30 2HE PHE 30 9.697 -5.968 0.733
234 HZ PHE 30 HZ PHE 30 11.725 -6.060 -0.662
235 H TYR 31 H TYR 31 4.361 -5.906 -2.511
236 HA TYR 31 HA TYR 31 4.938 -8.378 -1.192
237 1HB TYR 31 2HB TYR 31 3.474 -6.393 -0.377
238 2HB TYR 31 1HB TYR 31 2.200 -7.150 -1.325
239 HD1 TYR 31 1HD TYR 31 4.040 -7.203 1.763
240 HD2 TYR 31 2HD TYR 31 1.522 -9.519 -0.766
241 HE1 TYR 31 1HE TYR 31 3.549 -8.710 3.643
242 HE2 TYR 31 2HE TYR 31 1.024 -11.032 1.108
243 HH TYR 31 HH TYR 31 1.041 -11.007 3.551
244 H HIS 32 H HIS 32 2.608 -7.406 -3.700
245 HA HIS 32 HA HIS 32 2.009 -10.228 -4.199
246 1HB HIS 32 2HB HIS 32 0.681 -7.716 -5.236
247 2HB HIS 32 1HB HIS 32 0.163 -9.357 -5.604
248 HD1 HIS 32 1HD HIS 32 -1.359 -10.487 -3.904
249 HD2 HIS 32 2HD HIS 32 0.328 -6.959 -2.502
250 HE1 HIS 32 1HE HIS 32 -2.509 -9.970 -1.708
251 H LYS 33 H LYS 33 4.555 -9.497 -4.940
252 HA LYS 33 HA LYS 33 4.407 -9.884 -7.826
253 1HB LYS 33 2HB LYS 33 4.682 -7.441 -7.458
254 2HB LYS 33 1HB LYS 33 6.171 -7.768 -6.582
255 1HG LYS 33 2HG LYS 33 7.341 -8.264 -8.472
256 2HG LYS 33 1HG LYS 33 5.916 -8.844 -9.336
257 1HD LYS 33 2HD LYS 33 5.132 -6.420 -9.339
258 2HD LYS 33 1HD LYS 33 6.773 -6.005 -8.839
259 1HE LYS 33 2HE LYS 33 7.431 -7.506 -10.892
260 2HE LYS 33 1HE LYS 33 5.795 -7.122 -11.425
261 1HZ LYS 33 1HZ LYS 33 6.296 -4.923 -11.684
262 2HZ LYS 33 2HZ LYS 33 7.796 -5.603 -12.067
263 3HZ LYS 33 3HZ LYS 33 7.537 -4.936 -10.534
264 H ASN 34 H ASN 34 4.955 -11.804 -5.945
265 HA ASN 34 HA ASN 34 7.573 -12.650 -6.767
266 1HB ASN 34 2HB ASN 34 8.008 -11.167 -4.767
267 2HB ASN 34 1HB ASN 34 7.106 -12.330 -3.798
268 1HD2 ASN 34 1HD2 ASN 34 8.716 -13.077 -2.539
269 2HD2 ASN 34 2HD2 ASN 34 10.105 -13.916 -3.130
270 H LYS 35 H LYS 35 4.988 -13.659 -7.182
271 HA LYS 35 HA LYS 35 3.833 -15.617 -7.166
272 1HB LYS 35 2HB LYS 35 6.546 -16.476 -6.236
273 2HB LYS 35 1HB LYS 35 5.219 -17.630 -6.196
274 1HG LYS 35 2HG LYS 35 5.348 -16.245 -8.731
275 2HG LYS 35 1HG LYS 35 6.866 -17.058 -8.348
276 1HD LYS 35 2HD LYS 35 4.444 -18.636 -7.817
277 2HD LYS 35 1HD LYS 35 4.725 -18.255 -9.517
278 1HE LYS 35 2HE LYS 35 5.817 -20.308 -9.138
279 2HE LYS 35 1HE LYS 35 7.091 -19.091 -9.167
280 1HZ LYS 35 1HZ LYS 35 7.275 -19.158 -6.831
281 2HZ LYS 35 2HZ LYS 35 7.232 -20.773 -7.334
282 3HZ LYS 35 3HZ LYS 35 5.855 -20.061 -6.655
283 HA PRO 36 HA PRO 36 1.888 -15.900 -3.220
284 1HB PRO 36 2HB PRO 36 0.660 -18.313 -3.387
285 2HB PRO 36 1HB PRO 36 0.111 -16.895 -4.287
286 1HG PRO 36 2HG PRO 36 1.790 -19.194 -5.214
287 2HG PRO 36 1HG PRO 36 0.443 -18.387 -6.040
288 1HD PRO 36 2HD PRO 36 3.035 -17.867 -6.629
289 2HD PRO 36 1HD PRO 36 1.762 -16.636 -6.752
Start of MODEL 6
1 1H GLY 1 1HT GLY 1 -13.176 3.886 -7.070
2 2H GLY 1 2HT GLY 1 -13.380 4.300 -5.443
3 3H GLY 1 3HT GLY 1 -14.062 5.265 -6.652
4 1HA GLY 1 1HA GLY 1 -15.296 3.098 -7.315
5 2HA GLY 1 2HA GLY 1 -14.925 2.637 -5.661
6 H SER 2 H SER 2 -15.344 4.681 -4.117
7 HA SER 2 HA SER 2 -16.944 5.895 -3.051
8 1HB SER 2 2HB SER 2 -17.987 7.603 -4.268
9 2HB SER 2 1HB SER 2 -16.560 7.244 -5.238
10 HG SER 2 HG SER 2 -19.250 6.560 -5.715
11 H ALA 3 H ALA 3 -19.412 6.229 -2.883
12 HA ALA 3 HA ALA 3 -21.454 5.297 -2.514
13 1HB ALA 3 1HB ALA 3 -21.398 5.325 -5.044
14 2HB ALA 3 2HB ALA 3 -22.511 4.174 -4.304
15 3HB ALA 3 3HB ALA 3 -20.973 3.615 -4.961
16 H ALA 4 H ALA 4 -19.692 4.263 -0.860
17 HA ALA 4 HA ALA 4 -19.247 2.503 0.511
18 1HB ALA 4 1HB ALA 4 -21.847 1.812 -0.709
19 2HB ALA 4 2HB ALA 4 -21.390 1.958 0.988
20 3HB ALA 4 3HB ALA 4 -20.976 0.500 0.087
21 H GLU 5 H GLU 5 -17.309 2.377 -0.954
22 HA GLU 5 HA GLU 5 -16.428 -0.158 -1.352
23 1HB GLU 5 2HB GLU 5 -18.195 0.663 -3.539
24 2HB GLU 5 1HB GLU 5 -16.614 0.132 -4.095
25 1HG GLU 5 2HG GLU 5 -16.961 -2.014 -3.486
26 2HG GLU 5 1HG GLU 5 -17.955 -1.577 -2.096
27 H VAL 6 H VAL 6 -14.976 1.649 -0.439
28 HA VAL 6 HA VAL 6 -13.353 2.798 -2.614
29 HB VAL 6 HB VAL 6 -13.434 3.715 0.262
30 1HG1 VAL 6 1HG1 VAL 6 -11.345 4.246 -0.805
31 2HG1 VAL 6 2HG1 VAL 6 -12.304 5.721 -0.665
32 3HG1 VAL 6 3HG1 VAL 6 -12.184 4.891 -2.217
33 1HG2 VAL 6 1HG2 VAL 6 -15.478 4.026 -1.508
34 2HG2 VAL 6 2HG2 VAL 6 -14.526 5.479 -1.813
35 3HG2 VAL 6 3HG2 VAL 6 -15.116 5.137 -0.186
36 H MET 7 H MET 7 -11.258 2.249 -2.789
37 HA MET 7 HA MET 7 -9.738 1.207 -0.600
38 1HB MET 7 2HB MET 7 -9.250 -0.943 -2.083
39 2HB MET 7 1HB MET 7 -10.546 -0.910 -0.897
40 1HG MET 7 2HG MET 7 -11.259 -1.909 -3.003
41 2HG MET 7 1HG MET 7 -12.167 -0.444 -2.632
42 1HE MET 7 1HE MET 7 -10.438 -2.063 -5.904
43 2HE MET 7 2HE MET 7 -9.483 -2.163 -4.425
44 3HE MET 7 3HE MET 7 -8.954 -1.121 -5.747
45 H LYS 8 H LYS 8 -8.949 3.323 -1.697
46 HA LYS 8 HA LYS 8 -7.426 2.970 -4.116
47 1HB LYS 8 2HB LYS 8 -6.871 5.272 -3.926
48 2HB LYS 8 1HB LYS 8 -8.542 5.127 -3.401
49 1HG LYS 8 2HG LYS 8 -7.618 5.022 -1.030
50 2HG LYS 8 1HG LYS 8 -6.094 5.572 -1.729
51 1HD LYS 8 2HD LYS 8 -7.342 7.466 -0.887
52 2HD LYS 8 1HD LYS 8 -7.256 7.542 -2.648
53 1HE LYS 8 2HE LYS 8 -9.587 6.098 -1.619
54 2HE LYS 8 1HE LYS 8 -9.537 7.802 -1.169
55 1HZ LYS 8 1HZ LYS 8 -9.862 6.583 -3.794
56 2HZ LYS 8 2HZ LYS 8 -8.941 7.999 -3.731
57 3HZ LYS 8 3HZ LYS 8 -10.536 8.003 -3.168
58 H LYS 9 H LYS 9 -6.826 2.900 -0.679
59 HA LYS 9 HA LYS 9 -4.083 2.022 -1.215
60 1HB LYS 9 2HB LYS 9 -3.406 3.378 0.853
61 2HB LYS 9 1HB LYS 9 -3.654 4.254 -0.649
62 1HG LYS 9 2HG LYS 9 -4.638 5.482 1.164
63 2HG LYS 9 1HG LYS 9 -5.917 4.865 0.119
64 1HD LYS 9 2HD LYS 9 -6.453 3.131 1.662
65 2HD LYS 9 1HD LYS 9 -5.015 3.466 2.629
66 1HE LYS 9 2HE LYS 9 -7.161 5.524 2.203
67 2HE LYS 9 1HE LYS 9 -7.263 4.329 3.496
68 1HZ LYS 9 1HZ LYS 9 -6.106 6.692 3.793
69 2HZ LYS 9 2HZ LYS 9 -4.761 5.799 3.292
70 3HZ LYS 9 3HZ LYS 9 -5.627 5.322 4.663
71 H TYR 10 H TYR 10 -6.212 0.366 -0.653
72 HA TYR 10 HA TYR 10 -5.392 -0.700 1.947
73 1HB TYR 10 2HB TYR 10 -7.552 0.652 2.146
74 2HB TYR 10 1HB TYR 10 -8.304 -0.596 1.160
75 HD1 TYR 10 1HD TYR 10 -7.781 0.458 4.426
76 HD2 TYR 10 2HD TYR 10 -7.792 -3.083 2.066
77 HE1 TYR 10 1HE TYR 10 -8.182 -0.883 6.449
78 HE2 TYR 10 2HE TYR 10 -8.193 -4.432 4.081
79 HH TYR 10 HH TYR 10 -7.685 -3.410 7.110
80 H CYS 11 H CYS 11 -4.986 -2.825 1.842
81 HA CYS 11 HA CYS 11 -5.541 -4.206 -0.643
82 1HB CYS 11 2HB CYS 11 -3.338 -4.368 0.610
83 2HB CYS 11 1HB CYS 11 -4.180 -5.369 1.786
84 H SER 12 H SER 12 -7.167 -5.524 -1.001
85 HA SER 12 HA SER 12 -9.022 -6.153 1.135
86 1HB SER 12 2HB SER 12 -10.191 -7.303 -0.956
87 2HB SER 12 1HB SER 12 -10.253 -5.558 -0.713
88 HG SER 12 HG SER 12 -9.144 -5.313 -2.473
89 H THR 13 H THR 13 -6.295 -7.488 0.783
90 HA THR 13 HA THR 13 -7.287 -10.225 1.051
91 HB THR 13 HB THR 13 -4.784 -9.426 -0.440
92 HG1 THR 13 1HG THR 13 -6.795 -9.063 -1.558
93 1HG2 THR 13 1HG2 THR 13 -4.196 -11.576 -0.655
94 2HG2 THR 13 2HG2 THR 13 -5.866 -12.138 -0.725
95 3HG2 THR 13 3HG2 THR 13 -5.121 -11.773 0.832
96 H CYS 14 H CYS 14 -4.829 -7.829 1.803
97 HA CYS 14 HA CYS 14 -3.758 -9.581 3.899
98 1HB CYS 14 2HB CYS 14 -2.690 -6.946 2.871
99 2HB CYS 14 1HB CYS 14 -1.900 -7.992 4.043
100 H ASP 15 H ASP 15 -6.087 -7.245 3.570
101 HA ASP 15 HA ASP 15 -7.230 -5.914 5.013
102 1HB ASP 15 2HB ASP 15 -6.555 -8.268 6.403
103 2HB ASP 15 1HB ASP 15 -6.265 -6.945 7.527
104 H ILE 16 H ILE 16 -4.744 -4.978 4.121
105 HA ILE 16 HA ILE 16 -3.776 -3.454 6.450
106 HB ILE 16 HB ILE 16 -2.242 -3.760 3.881
107 1HG1 ILE 16 2HG1 ILE 16 -2.707 -6.021 4.750
108 2HG1 ILE 16 1HG1 ILE 16 -1.003 -5.609 4.899
109 1HG2 ILE 16 1HG2 ILE 16 -1.613 -2.882 6.676
110 2HG2 ILE 16 2HG2 ILE 16 -1.341 -2.032 5.154
111 3HG2 ILE 16 3HG2 ILE 16 -0.341 -3.421 5.580
112 1HD1 ILE 16 1HD1 ILE 16 -2.976 -5.357 7.150
113 2HD1 ILE 16 2HD1 ILE 16 -1.219 -5.241 7.236
114 3HD1 ILE 16 3HD1 ILE 16 -1.984 -6.786 6.863
115 H SER 17 H SER 17 -3.046 -1.234 5.968
116 HA SER 17 HA SER 17 -4.465 -0.018 3.702
117 1HB SER 17 2HB SER 17 -4.723 1.925 5.594
118 2HB SER 17 1HB SER 17 -5.974 0.739 5.222
119 HG SER 17 HG SER 17 -4.020 0.569 7.274
120 H PHE 18 H PHE 18 -3.647 2.082 3.082
121 HA PHE 18 HA PHE 18 -0.954 2.686 4.065
122 1HB PHE 18 2HB PHE 18 -1.797 2.433 1.172
123 2HB PHE 18 1HB PHE 18 -0.260 3.096 1.704
124 HD1 PHE 18 1HD PHE 18 1.162 1.532 3.246
125 HD2 PHE 18 2HD PHE 18 -1.957 0.198 0.680
126 HE1 PHE 18 1HE PHE 18 2.114 -0.738 3.275
127 HE2 PHE 18 2HE PHE 18 -1.013 -2.073 0.703
128 HZ PHE 18 HZ PHE 18 1.023 -2.545 2.002
129 H ASN 19 H ASN 19 -0.603 4.796 4.411
130 HA ASN 19 HA ASN 19 -2.765 6.651 3.990
131 1HB ASN 19 2HB ASN 19 -0.173 6.674 5.443
132 2HB ASN 19 1HB ASN 19 -0.818 8.232 4.937
133 1HD2 ASN 19 1HD2 ASN 19 -2.162 5.225 6.268
134 2HD2 ASN 19 2HD2 ASN 19 -3.067 5.990 7.526
135 H TYR 20 H TYR 20 -0.417 5.545 1.972
136 HA TYR 20 HA TYR 20 -0.567 7.968 0.340
137 1HB TYR 20 2HB TYR 20 1.941 6.535 1.174
138 2HB TYR 20 1HB TYR 20 1.881 7.465 -0.320
139 HD1 TYR 20 1HD TYR 20 0.509 9.862 0.232
140 HD2 TYR 20 2HD TYR 20 3.061 7.667 2.835
141 HE1 TYR 20 1HE TYR 20 0.985 11.919 1.491
142 HE2 TYR 20 2HE TYR 20 3.544 9.718 4.101
143 HH TYR 20 HH TYR 20 2.941 12.750 2.990
144 H VAL 21 H VAL 21 -1.274 7.496 -1.625
145 HA VAL 21 HA VAL 21 -1.961 4.987 -2.527
146 HB VAL 21 HB VAL 21 -1.136 7.251 -4.347
147 1HG1 VAL 21 1HG1 VAL 21 -3.000 6.259 -5.747
148 2HG1 VAL 21 2HG1 VAL 21 -2.948 4.871 -4.661
149 3HG1 VAL 21 3HG1 VAL 21 -1.528 5.298 -5.615
150 1HG2 VAL 21 1HG2 VAL 21 -3.489 6.929 -2.566
151 2HG2 VAL 21 2HG2 VAL 21 -3.767 7.589 -4.178
152 3HG2 VAL 21 3HG2 VAL 21 -2.645 8.391 -3.078
153 H LYS 22 H LYS 22 1.127 6.597 -2.700
154 HA LYS 22 HA LYS 22 2.327 4.969 -4.672
155 1HB LYS 22 2HB LYS 22 3.581 6.507 -2.391
156 2HB LYS 22 1HB LYS 22 4.472 5.792 -3.727
157 1HG LYS 22 2HG LYS 22 4.273 7.805 -4.670
158 2HG LYS 22 1HG LYS 22 2.627 7.294 -5.047
159 1HD LYS 22 2HD LYS 22 2.289 8.214 -2.530
160 2HD LYS 22 1HD LYS 22 3.602 9.258 -3.076
161 1HE LYS 22 2HE LYS 22 2.310 10.303 -4.628
162 2HE LYS 22 1HE LYS 22 1.325 8.873 -4.931
163 1HZ LYS 22 1HZ LYS 22 1.102 10.212 -2.330
164 2HZ LYS 22 2HZ LYS 22 -0.065 9.349 -3.200
165 3HZ LYS 22 3HZ LYS 22 0.350 10.920 -3.670
166 H THR 23 H THR 23 1.927 4.626 -1.200
167 HA THR 23 HA THR 23 3.700 2.410 -0.951
168 HB THR 23 HB THR 23 1.487 2.667 0.993
169 HG1 THR 23 1HG THR 23 3.450 4.696 0.753
170 1HG2 THR 23 1HG2 THR 23 4.475 2.646 1.332
171 2HG2 THR 23 2HG2 THR 23 3.406 1.250 1.474
172 3HG2 THR 23 3HG2 THR 23 3.278 2.581 2.626
173 H TYR 24 H TYR 24 0.231 2.767 -1.444
174 HA TYR 24 HA TYR 24 -0.467 0.055 -1.177
175 1HB TYR 24 2HB TYR 24 -2.140 1.842 -1.214
176 2HB TYR 24 1HB TYR 24 -1.734 2.210 -2.884
177 HD1 TYR 24 1HD TYR 24 -3.180 1.407 -4.485
178 HD2 TYR 24 2HD TYR 24 -2.735 -0.779 -0.862
179 HE1 TYR 24 1HE TYR 24 -4.868 -0.205 -5.257
180 HE2 TYR 24 2HE TYR 24 -4.422 -2.397 -1.625
181 HH TYR 24 HH TYR 24 -5.407 -2.694 -4.746
182 H LEU 25 H LEU 25 0.894 1.920 -3.778
183 HA LEU 25 HA LEU 25 0.549 -0.106 -5.786
184 1HB LEU 25 2HB LEU 25 2.213 2.406 -5.653
185 2HB LEU 25 1HB LEU 25 2.245 1.324 -7.034
186 HG LEU 25 HG LEU 25 -0.213 2.755 -6.020
187 1HD1 LEU 25 1HD1 LEU 25 0.010 4.202 -7.921
188 2HD1 LEU 25 2HD1 LEU 25 1.426 3.314 -8.486
189 3HD1 LEU 25 3HD1 LEU 25 1.510 4.252 -6.995
190 1HD2 LEU 25 1HD2 LEU 25 -0.977 0.824 -7.079
191 2HD2 LEU 25 2HD2 LEU 25 0.297 0.874 -8.298
192 3HD2 LEU 25 3HD2 LEU 25 -1.021 2.045 -8.351
193 H ALA 26 H ALA 26 3.136 0.994 -3.667
194 HA ALA 26 HA ALA 26 5.154 -0.698 -4.645
195 1HB ALA 26 1HB ALA 26 6.118 0.895 -3.364
196 2HB ALA 26 2HB ALA 26 5.932 -0.325 -2.105
197 3HB ALA 26 3HB ALA 26 4.754 0.978 -2.251
198 H HIS 27 H HIS 27 2.540 -1.188 -2.366
199 HA HIS 27 HA HIS 27 3.567 -3.589 -1.227
200 1HB HIS 27 2HB HIS 27 1.914 -2.388 0.019
201 2HB HIS 27 1HB HIS 27 0.784 -2.418 -1.330
202 HD1 HIS 27 1HD HIS 27 2.351 -4.790 1.196
203 HD2 HIS 27 2HD HIS 27 -0.881 -4.554 -1.403
204 HE1 HIS 27 1HE HIS 27 0.925 -6.831 1.644
205 H LYS 28 H LYS 28 1.413 -2.877 -3.934
206 HA LYS 28 HA LYS 28 0.800 -5.625 -4.459
207 1HB LYS 28 2HB LYS 28 -0.525 -3.479 -5.114
208 2HB LYS 28 1HB LYS 28 0.551 -3.444 -6.504
209 1HG LYS 28 2HG LYS 28 -1.102 -4.663 -7.428
210 2HG LYS 28 1HG LYS 28 -0.242 -5.991 -6.647
211 1HD LYS 28 2HD LYS 28 -1.760 -6.036 -4.833
212 2HD LYS 28 1HD LYS 28 -2.464 -4.482 -5.291
213 1HE LYS 28 2HE LYS 28 -3.048 -5.742 -7.509
214 2HE LYS 28 1HE LYS 28 -2.854 -7.180 -6.509
215 1HZ LYS 28 1HZ LYS 28 -5.107 -6.631 -6.378
216 2HZ LYS 28 2HZ LYS 28 -4.802 -4.979 -6.185
217 3HZ LYS 28 3HZ LYS 28 -4.456 -6.055 -4.927
218 H GLN 29 H GLN 29 3.175 -3.315 -5.610
219 HA GLN 29 HA GLN 29 4.149 -5.104 -7.667
220 1HB GLN 29 2HB GLN 29 4.156 -2.395 -7.419
221 2HB GLN 29 1HB GLN 29 5.796 -2.778 -6.916
222 1HG GLN 29 2HG GLN 29 6.406 -3.534 -8.977
223 2HG GLN 29 1HG GLN 29 4.767 -4.026 -9.405
224 1HE2 GLN 29 1HE2 GLN 29 6.609 -1.089 -8.643
225 2HE2 GLN 29 2HE2 GLN 29 5.865 -0.103 -9.850
226 H PHE 30 H PHE 30 4.666 -4.722 -4.341
227 HA PHE 30 HA PHE 30 7.296 -6.034 -4.541
228 1HB PHE 30 2HB PHE 30 7.239 -3.784 -3.417
229 2HB PHE 30 1HB PHE 30 6.231 -4.503 -2.166
230 HD1 PHE 30 1HD PHE 30 9.473 -5.130 -3.904
231 HD2 PHE 30 2HD PHE 30 7.264 -5.269 -0.268
232 HE1 PHE 30 1HE PHE 30 11.493 -5.868 -2.709
233 HE2 PHE 30 2HE PHE 30 9.281 -6.006 0.933
234 HZ PHE 30 HZ PHE 30 11.400 -6.307 -0.287
235 H TYR 31 H TYR 31 4.359 -5.917 -2.517
236 HA TYR 31 HA TYR 31 4.982 -8.383 -1.206
237 1HB TYR 31 2HB TYR 31 3.508 -6.414 -0.367
238 2HB TYR 31 1HB TYR 31 2.228 -7.188 -1.297
239 HD1 TYR 31 1HD TYR 31 3.982 -7.128 1.803
240 HD2 TYR 31 2HD TYR 31 1.724 -9.656 -0.768
241 HE1 TYR 31 1HE TYR 31 3.540 -8.642 3.689
242 HE2 TYR 31 2HE TYR 31 1.275 -11.176 1.111
243 HH TYR 31 HH TYR 31 2.219 -11.761 3.274
244 H HIS 32 H HIS 32 2.584 -7.436 -3.660
245 HA HIS 32 HA HIS 32 2.013 -10.262 -4.160
246 1HB HIS 32 2HB HIS 32 0.656 -7.763 -5.190
247 2HB HIS 32 1HB HIS 32 0.144 -9.410 -5.543
248 HD1 HIS 32 1HD HIS 32 -1.316 -10.565 -3.795
249 HD2 HIS 32 2HD HIS 32 0.295 -6.968 -2.480
250 HE1 HIS 32 1HE HIS 32 -2.458 -10.033 -1.599
251 H LYS 33 H LYS 33 4.555 -9.364 -4.929
252 HA LYS 33 HA LYS 33 4.670 -10.270 -7.589
253 1HB LYS 33 2HB LYS 33 3.751 -7.898 -7.873
254 2HB LYS 33 1HB LYS 33 5.336 -7.339 -7.356
255 1HG LYS 33 2HG LYS 33 5.503 -7.292 -9.656
256 2HG LYS 33 1HG LYS 33 6.230 -8.848 -9.253
257 1HD LYS 33 2HD LYS 33 3.665 -9.601 -9.539
258 2HD LYS 33 1HD LYS 33 3.703 -8.237 -10.656
259 1HE LYS 33 2HE LYS 33 5.157 -9.265 -12.080
260 2HE LYS 33 1HE LYS 33 5.934 -10.186 -10.794
261 1HZ LYS 33 1HZ LYS 33 4.453 -11.410 -12.477
262 2HZ LYS 33 2HZ LYS 33 3.158 -10.784 -11.586
263 3HZ LYS 33 3HZ LYS 33 4.292 -11.791 -10.836
264 H ASN 34 H ASN 34 5.952 -10.988 -5.272
265 HA ASN 34 HA ASN 34 8.662 -9.897 -5.457
266 1HB ASN 34 2HB ASN 34 7.241 -10.406 -3.256
267 2HB ASN 34 1HB ASN 34 7.963 -11.998 -3.466
268 1HD2 ASN 34 1HD2 ASN 34 8.848 -11.280 -1.322
269 2HD2 ASN 34 2HD2 ASN 34 10.360 -10.447 -1.341
270 H LYS 35 H LYS 35 7.530 -11.639 -7.524
271 HA LYS 35 HA LYS 35 9.738 -13.461 -7.737
272 1HB LYS 35 2HB LYS 35 7.100 -14.410 -6.856
273 2HB LYS 35 1HB LYS 35 7.756 -15.288 -8.232
274 1HG LYS 35 2HG LYS 35 9.395 -16.244 -7.016
275 2HG LYS 35 1HG LYS 35 9.612 -14.826 -5.989
276 1HD LYS 35 2HD LYS 35 7.033 -16.181 -5.658
277 2HD LYS 35 1HD LYS 35 8.432 -17.157 -5.208
278 1HE LYS 35 2HE LYS 35 7.747 -14.409 -4.170
279 2HE LYS 35 1HE LYS 35 7.609 -15.928 -3.285
280 1HZ LYS 35 1HZ LYS 35 9.617 -15.158 -2.549
281 2HZ LYS 35 2HZ LYS 35 10.017 -14.418 -4.016
282 3HZ LYS 35 3HZ LYS 35 10.129 -16.098 -3.859
283 HA PRO 36 HA PRO 36 8.212 -11.790 -11.753
284 1HB PRO 36 2HB PRO 36 10.695 -11.572 -12.849
285 2HB PRO 36 1HB PRO 36 9.970 -10.317 -11.837
286 1HG PRO 36 2HG PRO 36 11.954 -12.435 -11.100
287 2HG PRO 36 1HG PRO 36 11.926 -10.721 -10.646
288 1HD PRO 36 2HD PRO 36 11.092 -12.669 -8.973
289 2HD PRO 36 1HD PRO 36 10.351 -11.056 -8.991
Start of MODEL 7
1 1H GLY 1 1HT GLY 1 -24.425 -3.235 -7.344
2 2H GLY 1 2HT GLY 1 -24.007 -3.483 -5.725
3 3H GLY 1 3HT GLY 1 -22.818 -3.561 -6.925
4 1HA GLY 1 1HA GLY 1 -24.365 -1.085 -6.593
5 2HA GLY 1 2HA GLY 1 -23.057 -1.434 -5.474
6 H SER 2 H SER 2 -20.967 -2.157 -6.631
7 HA SER 2 HA SER 2 -19.210 -1.581 -7.954
8 1HB SER 2 2HB SER 2 -21.326 -0.969 -10.033
9 2HB SER 2 1HB SER 2 -19.616 -1.285 -10.333
10 HG SER 2 HG SER 2 -21.643 -3.035 -10.030
11 H ALA 3 H ALA 3 -18.063 0.235 -8.877
12 HA ALA 3 HA ALA 3 -17.412 2.415 -8.893
13 1HB ALA 3 1HB ALA 3 -18.879 3.984 -9.781
14 2HB ALA 3 2HB ALA 3 -20.287 3.246 -9.018
15 3HB ALA 3 3HB ALA 3 -19.511 2.454 -10.389
16 H ALA 4 H ALA 4 -17.987 1.110 -6.356
17 HA ALA 4 HA ALA 4 -17.791 3.379 -4.656
18 1HB ALA 4 1HB ALA 4 -20.392 1.877 -4.698
19 2HB ALA 4 2HB ALA 4 -20.121 3.617 -4.797
20 3HB ALA 4 3HB ALA 4 -19.847 2.767 -3.277
21 H GLU 5 H GLU 5 -15.927 1.659 -4.740
22 HA GLU 5 HA GLU 5 -15.460 0.652 -2.264
23 1HB GLU 5 2HB GLU 5 -17.259 -1.110 -3.759
24 2HB GLU 5 1HB GLU 5 -15.823 -1.934 -3.169
25 1HG GLU 5 2HG GLU 5 -16.504 -1.864 -1.044
26 2HG GLU 5 1HG GLU 5 -17.100 -0.210 -1.186
27 H VAL 6 H VAL 6 -13.692 1.752 -3.629
28 HA VAL 6 HA VAL 6 -12.193 -0.151 -5.265
29 HB VAL 6 HB VAL 6 -11.519 2.738 -4.711
30 1HG1 VAL 6 1HG1 VAL 6 -10.203 2.512 -6.796
31 2HG1 VAL 6 2HG1 VAL 6 -10.591 0.793 -6.819
32 3HG1 VAL 6 3HG1 VAL 6 -9.633 1.462 -5.500
33 1HG2 VAL 6 1HG2 VAL 6 -13.069 1.562 -7.017
34 2HG2 VAL 6 2HG2 VAL 6 -12.533 3.238 -6.886
35 3HG2 VAL 6 3HG2 VAL 6 -13.719 2.599 -5.747
36 H MET 7 H MET 7 -12.139 1.364 -2.145
37 HA MET 7 HA MET 7 -10.832 1.043 -0.315
38 1HB MET 7 2HB MET 7 -10.727 -1.391 -1.692
39 2HB MET 7 1HB MET 7 -9.054 -1.025 -1.301
40 1HG MET 7 2HG MET 7 -9.618 -2.131 0.586
41 2HG MET 7 1HG MET 7 -10.114 -0.511 1.070
42 1HE MET 7 1HE MET 7 -13.233 -1.001 2.461
43 2HE MET 7 2HE MET 7 -13.316 0.018 1.023
44 3HE MET 7 3HE MET 7 -11.864 0.022 2.024
45 H LYS 8 H LYS 8 -10.044 3.172 -1.302
46 HA LYS 8 HA LYS 8 -7.611 3.387 -2.650
47 1HB LYS 8 2HB LYS 8 -9.135 5.268 -2.432
48 2HB LYS 8 1HB LYS 8 -8.908 5.288 -0.690
49 1HG LYS 8 2HG LYS 8 -6.458 5.737 -1.162
50 2HG LYS 8 1HG LYS 8 -6.946 6.045 -2.829
51 1HD LYS 8 2HD LYS 8 -8.330 7.432 -0.567
52 2HD LYS 8 1HD LYS 8 -6.777 8.027 -1.158
53 1HE LYS 8 2HE LYS 8 -9.360 7.751 -2.677
54 2HE LYS 8 1HE LYS 8 -8.467 9.228 -2.318
55 1HZ LYS 8 1HZ LYS 8 -6.614 7.963 -3.662
56 2HZ LYS 8 2HZ LYS 8 -7.805 8.871 -4.448
57 3HZ LYS 8 3HZ LYS 8 -7.952 7.189 -4.352
58 H LYS 9 H LYS 9 -5.628 2.851 -2.057
59 HA LYS 9 HA LYS 9 -3.820 2.289 -0.806
60 1HB LYS 9 2HB LYS 9 -4.857 4.178 1.296
61 2HB LYS 9 1HB LYS 9 -3.190 3.778 0.915
62 1HG LYS 9 2HG LYS 9 -3.051 5.321 -0.691
63 2HG LYS 9 1HG LYS 9 -4.663 4.969 -1.312
64 1HD LYS 9 2HD LYS 9 -5.022 7.073 -0.493
65 2HD LYS 9 1HD LYS 9 -5.391 6.131 0.953
66 1HE LYS 9 2HE LYS 9 -3.352 6.646 1.956
67 2HE LYS 9 1HE LYS 9 -2.612 7.114 0.426
68 1HZ LYS 9 1HZ LYS 9 -3.455 8.883 2.171
69 2HZ LYS 9 2HZ LYS 9 -4.911 8.669 1.336
70 3HZ LYS 9 3HZ LYS 9 -3.525 9.172 0.506
71 H TYR 10 H TYR 10 -5.750 0.431 -0.590
72 HA TYR 10 HA TYR 10 -5.243 -0.652 2.040
73 1HB TYR 10 2HB TYR 10 -7.356 0.757 2.231
74 2HB TYR 10 1HB TYR 10 -8.117 -0.406 1.152
75 HD1 TYR 10 1HD TYR 10 -7.596 0.438 4.502
76 HD2 TYR 10 2HD TYR 10 -7.818 -2.941 1.925
77 HE1 TYR 10 1HE TYR 10 -8.126 -0.992 6.432
78 HE2 TYR 10 2HE TYR 10 -8.348 -4.378 3.848
79 HH TYR 10 HH TYR 10 -9.308 -3.203 6.816
80 H CYS 11 H CYS 11 -4.884 -2.780 1.865
81 HA CYS 11 HA CYS 11 -5.400 -4.060 -0.683
82 1HB CYS 11 2HB CYS 11 -3.242 -4.319 0.629
83 2HB CYS 11 1HB CYS 11 -4.143 -5.337 1.745
84 H SER 12 H SER 12 -7.017 -5.371 -1.133
85 HA SER 12 HA SER 12 -8.977 -5.986 0.911
86 1HB SER 12 2HB SER 12 -8.911 -6.027 -2.066
87 2HB SER 12 1HB SER 12 -10.050 -7.106 -1.261
88 HG SER 12 HG SER 12 -9.845 -4.313 -0.795
89 H THR 13 H THR 13 -6.253 -7.379 0.634
90 HA THR 13 HA THR 13 -7.321 -10.093 0.856
91 HB THR 13 HB THR 13 -4.764 -9.343 -0.569
92 HG1 THR 13 1HG THR 13 -6.502 -8.917 -1.886
93 1HG2 THR 13 1HG2 THR 13 -5.342 -11.899 -1.295
94 2HG2 THR 13 2HG2 THR 13 -5.773 -11.896 0.415
95 3HG2 THR 13 3HG2 THR 13 -4.148 -11.428 -0.085
96 H CYS 14 H CYS 14 -4.818 -7.772 1.690
97 HA CYS 14 HA CYS 14 -3.832 -9.568 3.789
98 1HB CYS 14 2HB CYS 14 -2.716 -6.925 2.832
99 2HB CYS 14 1HB CYS 14 -1.966 -7.995 4.011
100 H ASP 15 H ASP 15 -6.142 -7.220 3.456
101 HA ASP 15 HA ASP 15 -7.302 -5.899 4.894
102 1HB ASP 15 2HB ASP 15 -6.714 -8.286 6.247
103 2HB ASP 15 1HB ASP 15 -6.375 -7.004 7.404
104 H ILE 16 H ILE 16 -4.761 -5.005 4.081
105 HA ILE 16 HA ILE 16 -3.827 -3.524 6.451
106 HB ILE 16 HB ILE 16 -2.270 -3.799 3.891
107 1HG1 ILE 16 2HG1 ILE 16 -2.767 -6.064 4.752
108 2HG1 ILE 16 1HG1 ILE 16 -1.056 -5.669 4.881
109 1HG2 ILE 16 1HG2 ILE 16 -0.375 -3.464 5.572
110 2HG2 ILE 16 2HG2 ILE 16 -1.636 -2.983 6.708
111 3HG2 ILE 16 3HG2 ILE 16 -1.401 -2.076 5.213
112 1HD1 ILE 16 1HD1 ILE 16 -1.740 -6.790 6.871
113 2HD1 ILE 16 2HD1 ILE 16 -3.090 -5.678 7.094
114 3HD1 ILE 16 3HD1 ILE 16 -1.433 -5.100 7.266
115 H SER 17 H SER 17 -3.068 -1.302 6.026
116 HA SER 17 HA SER 17 -4.490 -0.020 3.796
117 1HB SER 17 2HB SER 17 -5.772 0.245 5.924
118 2HB SER 17 1HB SER 17 -4.378 1.072 6.619
119 HG SER 17 HG SER 17 -5.355 2.763 5.811
120 H PHE 18 H PHE 18 -3.667 2.163 3.298
121 HA PHE 18 HA PHE 18 -0.919 2.636 4.165
122 1HB PHE 18 2HB PHE 18 -1.870 2.442 1.303
123 2HB PHE 18 1HB PHE 18 -0.319 3.119 1.775
124 HD1 PHE 18 1HD PHE 18 1.339 1.628 2.955
125 HD2 PHE 18 2HD PHE 18 -2.174 0.138 1.071
126 HE1 PHE 18 1HE PHE 18 2.323 -0.628 2.913
127 HE2 PHE 18 2HE PHE 18 -1.198 -2.119 1.027
128 HZ PHE 18 HZ PHE 18 1.052 -2.505 1.948
129 H ASN 19 H ASN 19 -0.373 4.758 4.320
130 HA ASN 19 HA ASN 19 -2.536 6.675 4.144
131 1HB ASN 19 2HB ASN 19 0.254 6.748 5.263
132 2HB ASN 19 1HB ASN 19 -0.665 8.234 5.046
133 1HD2 ASN 19 1HD2 ASN 19 -3.134 7.676 5.775
134 2HD2 ASN 19 2HD2 ASN 19 -3.213 7.126 7.410
135 H TYR 20 H TYR 20 -0.502 5.488 1.910
136 HA TYR 20 HA TYR 20 -0.695 7.894 0.283
137 1HB TYR 20 2HB TYR 20 1.891 6.486 0.935
138 2HB TYR 20 1HB TYR 20 1.705 7.476 -0.508
139 HD1 TYR 20 1HD TYR 20 0.106 9.727 0.486
140 HD2 TYR 20 2HD TYR 20 3.346 7.664 2.316
141 HE1 TYR 20 1HE TYR 20 0.641 11.739 1.795
142 HE2 TYR 20 2HE TYR 20 3.889 9.670 3.629
143 HH TYR 20 HH TYR 20 3.299 12.441 3.086
144 H VAL 21 H VAL 21 -1.566 7.332 -1.599
145 HA VAL 21 HA VAL 21 -2.204 4.767 -2.377
146 HB VAL 21 HB VAL 21 -1.635 6.938 -4.387
147 1HG1 VAL 21 1HG1 VAL 21 -3.925 5.011 -4.425
148 2HG1 VAL 21 2HG1 VAL 21 -2.326 4.507 -4.976
149 3HG1 VAL 21 3HG1 VAL 21 -3.148 5.852 -5.767
150 1HG2 VAL 21 1HG2 VAL 21 -4.199 7.376 -3.924
151 2HG2 VAL 21 2HG2 VAL 21 -2.945 8.187 -2.986
152 3HG2 VAL 21 3HG2 VAL 21 -3.771 6.778 -2.321
153 H LYS 22 H LYS 22 0.785 6.495 -2.808
154 HA LYS 22 HA LYS 22 1.914 4.871 -4.831
155 1HB LYS 22 2HB LYS 22 2.938 6.839 -2.849
156 2HB LYS 22 1HB LYS 22 4.105 5.730 -3.555
157 1HG LYS 22 2HG LYS 22 4.044 7.796 -4.804
158 2HG LYS 22 1HG LYS 22 3.440 6.466 -5.795
159 1HD LYS 22 2HD LYS 22 1.193 7.167 -5.530
160 2HD LYS 22 1HD LYS 22 1.621 8.288 -4.235
161 1HE LYS 22 2HE LYS 22 2.331 9.886 -5.670
162 2HE LYS 22 1HE LYS 22 2.975 8.717 -6.821
163 1HZ LYS 22 1HZ LYS 22 0.374 8.257 -7.072
164 2HZ LYS 22 2HZ LYS 22 1.206 9.388 -8.016
165 3HZ LYS 22 3HZ LYS 22 0.325 9.899 -6.665
166 H THR 23 H THR 23 1.957 4.711 -1.300
167 HA THR 23 HA THR 23 3.735 2.526 -1.107
168 HB THR 23 HB THR 23 1.541 3.069 0.879
169 HG1 THR 23 1HG THR 23 2.697 4.754 1.682
170 1HG2 THR 23 1HG2 THR 23 4.415 2.268 1.260
171 2HG2 THR 23 2HG2 THR 23 3.024 1.188 1.357
172 3HG2 THR 23 3HG2 THR 23 3.212 2.493 2.529
173 H TYR 24 H TYR 24 0.234 2.765 -1.385
174 HA TYR 24 HA TYR 24 -0.368 0.046 -1.005
175 1HB TYR 24 2HB TYR 24 -2.044 1.881 -1.009
176 2HB TYR 24 1HB TYR 24 -1.829 2.042 -2.747
177 HD1 TYR 24 1HD TYR 24 -3.868 1.400 -3.671
178 HD2 TYR 24 2HD TYR 24 -2.094 -1.041 -0.673
179 HE1 TYR 24 1HE TYR 24 -5.595 -0.309 -4.050
180 HE2 TYR 24 2HE TYR 24 -3.815 -2.758 -1.043
181 HH TYR 24 HH TYR 24 -6.627 -2.171 -2.902
182 H LEU 25 H LEU 25 0.800 1.860 -3.735
183 HA LEU 25 HA LEU 25 0.363 -0.224 -5.665
184 1HB LEU 25 2HB LEU 25 2.044 2.285 -5.712
185 2HB LEU 25 1HB LEU 25 1.925 1.182 -7.071
186 HG LEU 25 HG LEU 25 -0.607 2.269 -5.943
187 1HD1 LEU 25 1HD1 LEU 25 -0.120 4.135 -7.792
188 2HD1 LEU 25 2HD1 LEU 25 1.524 3.880 -7.207
189 3HD1 LEU 25 3HD1 LEU 25 0.252 4.358 -6.082
190 1HD2 LEU 25 1HD2 LEU 25 -0.485 0.590 -7.799
191 2HD2 LEU 25 2HD2 LEU 25 0.287 1.831 -8.786
192 3HD2 LEU 25 3HD2 LEU 25 -1.357 2.071 -8.196
193 H ALA 26 H ALA 26 3.070 0.991 -3.763
194 HA ALA 26 HA ALA 26 5.052 -0.701 -4.788
195 1HB ALA 26 1HB ALA 26 5.147 1.374 -3.150
196 2HB ALA 26 2HB ALA 26 6.418 0.152 -3.171
197 3HB ALA 26 3HB ALA 26 5.167 0.099 -1.931
198 H HIS 27 H HIS 27 2.570 -1.181 -2.357
199 HA HIS 27 HA HIS 27 3.660 -3.560 -1.244
200 1HB HIS 27 2HB HIS 27 2.054 -2.409 0.077
201 2HB HIS 27 1HB HIS 27 0.885 -2.373 -1.239
202 HD1 HIS 27 1HD HIS 27 2.418 -4.807 1.236
203 HD2 HIS 27 2HD HIS 27 -0.793 -4.509 -1.381
204 HE1 HIS 27 1HE HIS 27 0.971 -6.842 1.649
205 H LYS 28 H LYS 28 1.393 -2.902 -3.870
206 HA LYS 28 HA LYS 28 0.775 -5.653 -4.345
207 1HB LYS 28 2HB LYS 28 -0.572 -3.526 -4.995
208 2HB LYS 28 1HB LYS 28 0.477 -3.490 -6.406
209 1HG LYS 28 2HG LYS 28 -1.397 -4.638 -7.144
210 2HG LYS 28 1HG LYS 28 -0.253 -5.926 -6.760
211 1HD LYS 28 2HD LYS 28 -2.445 -6.494 -5.904
212 2HD LYS 28 1HD LYS 28 -1.339 -6.196 -4.561
213 1HE LYS 28 2HE LYS 28 -2.844 -3.852 -5.522
214 2HE LYS 28 1HE LYS 28 -3.808 -5.117 -4.762
215 1HZ LYS 28 1HZ LYS 28 -2.915 -4.712 -2.751
216 2HZ LYS 28 2HZ LYS 28 -2.598 -3.185 -3.404
217 3HZ LYS 28 3HZ LYS 28 -1.379 -4.356 -3.364
218 H GLN 29 H GLN 29 3.108 -3.357 -5.616
219 HA GLN 29 HA GLN 29 4.029 -5.194 -7.655
220 1HB GLN 29 2HB GLN 29 4.011 -2.497 -7.526
221 2HB GLN 29 1HB GLN 29 5.654 -2.815 -6.985
222 1HG GLN 29 2HG GLN 29 5.987 -4.188 -9.037
223 2HG GLN 29 1HG GLN 29 4.400 -3.652 -9.588
224 1HE2 GLN 29 1HE2 GLN 29 4.795 -2.322 -11.220
225 2HE2 GLN 29 2HE2 GLN 29 5.859 -0.961 -11.174
226 H PHE 30 H PHE 30 4.693 -4.648 -4.358
227 HA PHE 30 HA PHE 30 7.318 -5.958 -4.612
228 1HB PHE 30 2HB PHE 30 7.131 -3.666 -3.482
229 2HB PHE 30 1HB PHE 30 6.336 -4.511 -2.159
230 HD1 PHE 30 1HD PHE 30 9.317 -5.236 -4.287
231 HD2 PHE 30 2HD PHE 30 7.735 -4.757 -0.366
232 HE1 PHE 30 1HE PHE 30 11.515 -5.803 -3.336
233 HE2 PHE 30 2HE PHE 30 9.930 -5.321 0.593
234 HZ PHE 30 HZ PHE 30 11.823 -5.845 -0.892
235 H TYR 31 H TYR 31 4.429 -5.880 -2.521
236 HA TYR 31 HA TYR 31 5.131 -8.316 -1.195
237 1HB TYR 31 2HB TYR 31 3.601 -6.335 -0.404
238 2HB TYR 31 1HB TYR 31 2.335 -7.242 -1.224
239 HD1 TYR 31 1HD TYR 31 4.189 -6.868 1.786
240 HD2 TYR 31 2HD TYR 31 2.042 -9.714 -0.535
241 HE1 TYR 31 1HE TYR 31 3.928 -8.286 3.778
242 HE2 TYR 31 2HE TYR 31 1.774 -11.140 1.450
243 HH TYR 31 HH TYR 31 2.920 -11.500 3.627
244 H HIS 32 H HIS 32 2.710 -7.442 -3.650
245 HA HIS 32 HA HIS 32 2.124 -10.275 -4.069
246 1HB HIS 32 2HB HIS 32 0.810 -7.787 -5.179
247 2HB HIS 32 1HB HIS 32 0.292 -9.433 -5.526
248 HD1 HIS 32 1HD HIS 32 -1.232 -10.547 -3.814
249 HD2 HIS 32 2HD HIS 32 0.410 -6.973 -2.474
250 HE1 HIS 32 1HE HIS 32 -2.415 -9.988 -1.647
251 H LYS 33 H LYS 33 4.680 -9.543 -4.832
252 HA LYS 33 HA LYS 33 4.773 -10.468 -7.490
253 1HB LYS 33 2HB LYS 33 4.127 -7.851 -7.509
254 2HB LYS 33 1HB LYS 33 5.880 -7.719 -7.468
255 1HG LYS 33 2HG LYS 33 5.308 -7.676 -9.737
256 2HG LYS 33 1HG LYS 33 5.898 -9.313 -9.443
257 1HD LYS 33 2HD LYS 33 3.972 -9.667 -10.695
258 2HD LYS 33 1HD LYS 33 3.413 -9.888 -9.036
259 1HE LYS 33 2HE LYS 33 1.780 -8.482 -9.739
260 2HE LYS 33 1HE LYS 33 2.971 -7.268 -9.274
261 1HZ LYS 33 1HZ LYS 33 3.064 -8.305 -12.009
262 2HZ LYS 33 2HZ LYS 33 3.434 -6.761 -11.428
263 3HZ LYS 33 3HZ LYS 33 1.820 -7.227 -11.616
264 H ASN 34 H ASN 34 5.973 -11.268 -5.154
265 HA ASN 34 HA ASN 34 8.766 -10.398 -5.376
266 1HB ASN 34 2HB ASN 34 7.320 -10.612 -3.141
267 2HB ASN 34 1HB ASN 34 7.900 -12.273 -3.231
268 1HD2 ASN 34 1HD2 ASN 34 8.699 -11.045 -1.101
269 2HD2 ASN 34 2HD2 ASN 34 10.339 -10.513 -1.204
270 H LYS 35 H LYS 35 7.833 -11.979 -7.449
271 HA LYS 35 HA LYS 35 8.371 -13.821 -8.668
272 1HB LYS 35 2HB LYS 35 10.508 -14.133 -6.551
273 2HB LYS 35 1HB LYS 35 10.453 -15.023 -8.066
274 1HG LYS 35 2HG LYS 35 11.800 -13.400 -8.806
275 2HG LYS 35 1HG LYS 35 10.309 -12.470 -8.963
276 1HD LYS 35 2HD LYS 35 11.903 -11.118 -7.799
277 2HD LYS 35 1HD LYS 35 10.677 -11.632 -6.638
278 1HE LYS 35 2HE LYS 35 12.496 -12.143 -5.395
279 2HE LYS 35 1HE LYS 35 12.434 -13.631 -6.337
280 1HZ LYS 35 1HZ LYS 35 14.566 -13.097 -6.746
281 2HZ LYS 35 2HZ LYS 35 14.343 -11.446 -6.448
282 3HZ LYS 35 3HZ LYS 35 13.896 -12.104 -7.941
283 HA PRO 36 HA PRO 36 6.206 -16.456 -5.381
284 1HB PRO 36 2HB PRO 36 3.727 -16.413 -6.487
285 2HB PRO 36 1HB PRO 36 4.275 -15.212 -5.312
286 1HG PRO 36 2HG PRO 36 4.141 -15.017 -8.296
287 2HG PRO 36 1HG PRO 36 3.682 -13.816 -7.076
288 1HD PRO 36 2HD PRO 36 6.031 -13.703 -8.413
289 2HD PRO 36 1HD PRO 36 5.861 -13.141 -6.737
Start of MODEL 8
1 1H GLY 1 1HT GLY 1 -24.589 -3.797 -3.191
2 2H GLY 1 2HT GLY 1 -25.540 -2.604 -2.459
3 3H GLY 1 3HT GLY 1 -23.876 -2.660 -2.158
4 1HA GLY 1 1HA GLY 1 -25.284 -1.813 -4.610
5 2HA GLY 1 2HA GLY 1 -24.093 -0.925 -3.671
6 H SER 2 H SER 2 -22.164 -2.947 -3.378
7 HA SER 2 HA SER 2 -20.331 -3.794 -4.424
8 1HB SER 2 2HB SER 2 -22.422 -5.045 -5.585
9 2HB SER 2 1HB SER 2 -21.729 -4.251 -6.998
10 HG SER 2 HG SER 2 -20.939 -6.478 -6.083
11 H ALA 3 H ALA 3 -20.791 -0.987 -4.567
12 HA ALA 3 HA ALA 3 -18.843 -0.252 -6.464
13 1HB ALA 3 1HB ALA 3 -20.359 1.211 -7.881
14 2HB ALA 3 2HB ALA 3 -21.700 0.258 -7.246
15 3HB ALA 3 3HB ALA 3 -20.429 -0.525 -8.183
16 H ALA 4 H ALA 4 -17.837 1.229 -5.282
17 HA ALA 4 HA ALA 4 -19.276 3.582 -4.394
18 1HB ALA 4 1HB ALA 4 -18.046 3.240 -2.079
19 2HB ALA 4 2HB ALA 4 -18.216 1.540 -2.514
20 3HB ALA 4 3HB ALA 4 -19.645 2.564 -2.385
21 H GLU 5 H GLU 5 -16.196 1.818 -4.312
22 HA GLU 5 HA GLU 5 -14.645 3.518 -5.749
23 1HB GLU 5 2HB GLU 5 -15.214 4.643 -3.105
24 2HB GLU 5 1HB GLU 5 -13.494 4.527 -3.447
25 1HG GLU 5 2HG GLU 5 -15.252 5.681 -5.538
26 2HG GLU 5 1HG GLU 5 -14.914 6.649 -4.105
27 H VAL 6 H VAL 6 -14.340 1.048 -5.797
28 HA VAL 6 HA VAL 6 -12.656 -0.088 -3.769
29 HB VAL 6 HB VAL 6 -14.202 -1.492 -5.063
30 1HG1 VAL 6 1HG1 VAL 6 -12.404 -0.841 -7.394
31 2HG1 VAL 6 2HG1 VAL 6 -14.094 -0.371 -7.203
32 3HG1 VAL 6 3HG1 VAL 6 -13.667 -2.071 -7.397
33 1HG2 VAL 6 1HG2 VAL 6 -12.773 -3.352 -5.315
34 2HG2 VAL 6 2HG2 VAL 6 -12.040 -2.357 -4.057
35 3HG2 VAL 6 3HG2 VAL 6 -11.385 -2.333 -5.694
36 H MET 7 H MET 7 -10.501 -0.937 -4.178
37 HA MET 7 HA MET 7 -8.319 -0.711 -4.778
38 1HB MET 7 2HB MET 7 -9.635 -0.994 -7.116
39 2HB MET 7 1HB MET 7 -8.929 0.597 -7.366
40 1HG MET 7 2HG MET 7 -7.162 -0.529 -8.120
41 2HG MET 7 1HG MET 7 -6.797 -0.792 -6.416
42 1HE MET 7 1HE MET 7 -8.201 -4.083 -5.548
43 2HE MET 7 2HE MET 7 -7.524 -2.521 -5.085
44 3HE MET 7 3HE MET 7 -6.465 -3.801 -5.673
45 H LYS 8 H LYS 8 -7.233 0.759 -3.656
46 HA LYS 8 HA LYS 8 -6.888 3.410 -4.647
47 1HB LYS 8 2HB LYS 8 -8.991 3.854 -3.586
48 2HB LYS 8 1HB LYS 8 -8.502 3.009 -2.126
49 1HG LYS 8 2HG LYS 8 -7.021 4.730 -1.503
50 2HG LYS 8 1HG LYS 8 -7.096 5.477 -3.100
51 1HD LYS 8 2HD LYS 8 -9.576 5.193 -1.447
52 2HD LYS 8 1HD LYS 8 -8.444 6.510 -1.131
53 1HE LYS 8 2HE LYS 8 -9.171 6.116 -3.955
54 2HE LYS 8 1HE LYS 8 -10.485 6.642 -2.905
55 1HZ LYS 8 1HZ LYS 8 -7.853 8.003 -3.003
56 2HZ LYS 8 2HZ LYS 8 -9.281 8.561 -2.286
57 3HZ LYS 8 3HZ LYS 8 -9.164 8.460 -3.971
58 H LYS 9 H LYS 9 -6.828 2.454 -1.241
59 HA LYS 9 HA LYS 9 -3.966 1.976 -1.332
60 1HB LYS 9 2HB LYS 9 -5.082 4.118 0.482
61 2HB LYS 9 1HB LYS 9 -3.397 3.666 0.277
62 1HG LYS 9 2HG LYS 9 -3.366 4.556 -1.949
63 2HG LYS 9 1HG LYS 9 -5.102 4.865 -1.892
64 1HD LYS 9 2HD LYS 9 -4.244 6.200 0.318
65 2HD LYS 9 1HD LYS 9 -2.870 6.407 -0.770
66 1HE LYS 9 2HE LYS 9 -3.975 7.893 -2.005
67 2HE LYS 9 1HE LYS 9 -5.369 6.825 -2.154
68 1HZ LYS 9 1HZ LYS 9 -5.761 9.027 -1.028
69 2HZ LYS 9 2HZ LYS 9 -4.859 8.437 0.277
70 3HZ LYS 9 3HZ LYS 9 -6.292 7.663 -0.179
71 H TYR 10 H TYR 10 -5.926 0.150 -0.825
72 HA TYR 10 HA TYR 10 -5.281 -0.654 1.878
73 1HB TYR 10 2HB TYR 10 -7.332 0.769 2.112
74 2HB TYR 10 1HB TYR 10 -8.183 -0.366 1.070
75 HD1 TYR 10 1HD TYR 10 -7.512 0.494 4.393
76 HD2 TYR 10 2HD TYR 10 -8.041 -2.896 1.879
77 HE1 TYR 10 1HE TYR 10 -8.079 -0.868 6.360
78 HE2 TYR 10 2HE TYR 10 -8.610 -4.267 3.838
79 HH TYR 10 HH TYR 10 -9.489 -3.926 6.133
80 H CYS 11 H CYS 11 -5.007 -2.805 1.957
81 HA CYS 11 HA CYS 11 -5.851 -4.344 -0.392
82 1HB CYS 11 2HB CYS 11 -3.426 -4.323 0.523
83 2HB CYS 11 1HB CYS 11 -4.040 -5.415 1.751
84 H SER 12 H SER 12 -7.550 -5.602 -0.299
85 HA SER 12 HA SER 12 -8.863 -6.152 2.208
86 1HB SER 12 2HB SER 12 -9.750 -7.513 -0.284
87 2HB SER 12 1HB SER 12 -10.703 -6.698 0.956
88 HG SER 12 HG SER 12 -9.744 -4.704 0.068
89 H THR 13 H THR 13 -6.669 -7.759 0.084
90 HA THR 13 HA THR 13 -7.225 -10.416 1.016
91 HB THR 13 HB THR 13 -4.684 -9.575 -0.353
92 HG1 THR 13 1HG THR 13 -6.191 -8.660 -1.648
93 1HG2 THR 13 1HG2 THR 13 -6.143 -11.950 -1.238
94 2HG2 THR 13 2HG2 THR 13 -5.524 -12.032 0.411
95 3HG2 THR 13 3HG2 THR 13 -4.422 -11.715 -0.929
96 H CYS 14 H CYS 14 -4.766 -7.939 1.670
97 HA CYS 14 HA CYS 14 -3.654 -9.652 3.778
98 1HB CYS 14 2HB CYS 14 -2.566 -7.039 2.726
99 2HB CYS 14 1HB CYS 14 -1.743 -8.183 3.778
100 H ASP 15 H ASP 15 -6.039 -7.448 3.539
101 HA ASP 15 HA ASP 15 -7.091 -6.010 4.947
102 1HB ASP 15 2HB ASP 15 -5.730 -7.775 6.990
103 2HB ASP 15 1HB ASP 15 -7.048 -6.661 7.336
104 H ILE 16 H ILE 16 -4.707 -5.003 3.939
105 HA ILE 16 HA ILE 16 -3.540 -3.564 6.228
106 HB ILE 16 HB ILE 16 -2.369 -3.600 3.459
107 1HG1 ILE 16 2HG1 ILE 16 -1.569 -5.483 5.678
108 2HG1 ILE 16 1HG1 ILE 16 -2.681 -5.945 4.393
109 1HG2 ILE 16 1HG2 ILE 16 -1.399 -1.912 4.748
110 2HG2 ILE 16 2HG2 ILE 16 -0.266 -3.258 4.872
111 3HG2 ILE 16 3HG2 ILE 16 -1.372 -2.912 6.200
112 1HD1 ILE 16 1HD1 ILE 16 0.102 -4.937 3.888
113 2HD1 ILE 16 2HD1 ILE 16 -0.999 -5.699 2.741
114 3HD1 ILE 16 3HD1 ILE 16 -0.307 -6.644 4.061
115 H SER 17 H SER 17 -2.980 -1.282 5.840
116 HA SER 17 HA SER 17 -4.746 0.022 3.890
117 1HB SER 17 2HB SER 17 -4.834 1.824 5.902
118 2HB SER 17 1HB SER 17 -6.039 0.553 5.698
119 HG SER 17 HG SER 17 -3.716 0.365 7.319
120 H PHE 18 H PHE 18 -4.015 2.033 3.111
121 HA PHE 18 HA PHE 18 -1.336 2.868 3.929
122 1HB PHE 18 2HB PHE 18 -2.216 2.316 1.090
123 2HB PHE 18 1HB PHE 18 -0.701 3.088 1.537
124 HD1 PHE 18 1HD PHE 18 0.228 1.511 3.780
125 HD2 PHE 18 2HD PHE 18 -1.700 0.255 0.201
126 HE1 PHE 18 1HE PHE 18 1.274 -0.707 3.998
127 HE2 PHE 18 2HE PHE 18 -0.661 -1.964 0.414
128 HZ PHE 18 HZ PHE 18 0.828 -2.449 2.316
129 H ASN 19 H ASN 19 -1.147 5.008 4.123
130 HA ASN 19 HA ASN 19 -3.408 6.672 3.337
131 1HB ASN 19 2HB ASN 19 -1.166 6.919 5.279
132 2HB ASN 19 1HB ASN 19 -1.826 8.409 4.612
133 1HD2 ASN 19 1HD2 ASN 19 -3.800 9.108 5.256
134 2HD2 ASN 19 2HD2 ASN 19 -4.743 8.334 6.480
135 H TYR 20 H TYR 20 -1.018 5.594 1.610
136 HA TYR 20 HA TYR 20 -0.801 8.013 0.027
137 1HB TYR 20 2HB TYR 20 1.579 6.599 1.223
138 2HB TYR 20 1HB TYR 20 1.708 7.636 -0.191
139 HD1 TYR 20 1HD TYR 20 0.544 10.030 0.150
140 HD2 TYR 20 2HD TYR 20 2.027 7.550 3.273
141 HE1 TYR 20 1HE TYR 20 0.749 11.999 1.609
142 HE2 TYR 20 2HE TYR 20 2.236 9.511 4.740
143 HH TYR 20 HH TYR 20 0.751 12.354 4.233
144 H VAL 21 H VAL 21 -1.228 7.468 -1.999
145 HA VAL 21 HA VAL 21 -1.677 4.937 -2.957
146 HB VAL 21 HB VAL 21 -0.624 7.199 -4.657
147 1HG1 VAL 21 1HG1 VAL 21 -2.469 5.989 -6.165
148 2HG1 VAL 21 2HG1 VAL 21 -1.954 4.611 -5.193
149 3HG1 VAL 21 3HG1 VAL 21 -0.773 5.503 -6.153
150 1HG2 VAL 21 1HG2 VAL 21 -3.348 6.715 -3.490
151 2HG2 VAL 21 2HG2 VAL 21 -3.126 7.654 -4.968
152 3HG2 VAL 21 3HG2 VAL 21 -2.379 8.190 -3.463
153 H LYS 22 H LYS 22 1.363 6.596 -2.615
154 HA LYS 22 HA LYS 22 2.906 4.993 -4.353
155 1HB LYS 22 2HB LYS 22 4.839 5.916 -3.226
156 2HB LYS 22 1HB LYS 22 3.650 7.186 -3.474
157 1HG LYS 22 2HG LYS 22 2.953 6.346 -1.008
158 2HG LYS 22 1HG LYS 22 4.687 6.019 -0.983
159 1HD LYS 22 2HD LYS 22 4.232 8.256 -0.145
160 2HD LYS 22 1HD LYS 22 5.123 8.337 -1.666
161 1HE LYS 22 2HE LYS 22 2.430 8.338 -2.398
162 2HE LYS 22 1HE LYS 22 2.522 9.399 -0.992
163 1HZ LYS 22 1HZ LYS 22 4.619 10.255 -2.366
164 2HZ LYS 22 2HZ LYS 22 3.067 10.898 -2.565
165 3HZ LYS 22 3HZ LYS 22 3.647 9.740 -3.651
166 H THR 23 H THR 23 1.925 4.641 -1.002
167 HA THR 23 HA THR 23 3.659 2.439 -0.459
168 HB THR 23 HB THR 23 1.162 2.699 1.107
169 HG1 THR 23 1HG THR 23 1.889 4.612 2.090
170 1HG2 THR 23 1HG2 THR 23 3.408 1.419 1.633
171 2HG2 THR 23 2HG2 THR 23 2.437 2.166 2.902
172 3HG2 THR 23 3HG2 THR 23 3.864 2.995 2.279
173 H TYR 24 H TYR 24 0.318 2.782 -1.508
174 HA TYR 24 HA TYR 24 -0.361 0.039 -1.356
175 1HB TYR 24 2HB TYR 24 -2.019 1.883 -1.541
176 2HB TYR 24 1HB TYR 24 -1.497 2.152 -3.199
177 HD1 TYR 24 1HD TYR 24 -2.200 0.699 -4.974
178 HD2 TYR 24 2HD TYR 24 -3.255 -0.170 -0.945
179 HE1 TYR 24 1HE TYR 24 -3.822 -0.971 -5.765
180 HE2 TYR 24 2HE TYR 24 -4.878 -1.844 -1.725
181 HH TYR 24 HH TYR 24 -5.322 -3.217 -3.662
182 H LEU 25 H LEU 25 1.324 1.984 -3.679
183 HA LEU 25 HA LEU 25 1.190 0.076 -5.819
184 1HB LEU 25 2HB LEU 25 2.866 2.532 -5.331
185 2HB LEU 25 1HB LEU 25 3.093 1.514 -6.741
186 HG LEU 25 HG LEU 25 0.514 2.921 -6.043
187 1HD1 LEU 25 1HD1 LEU 25 2.633 3.626 -8.068
188 2HD1 LEU 25 2HD1 LEU 25 2.246 4.528 -6.603
189 3HD1 LEU 25 3HD1 LEU 25 1.064 4.414 -7.906
190 1HD2 LEU 25 1HD2 LEU 25 -0.051 1.056 -7.335
191 2HD2 LEU 25 2HD2 LEU 25 1.391 1.200 -8.340
192 3HD2 LEU 25 3HD2 LEU 25 0.081 2.370 -8.505
193 H ALA 26 H ALA 26 3.561 0.999 -3.373
194 HA ALA 26 HA ALA 26 5.600 -0.749 -4.199
195 1HB ALA 26 1HB ALA 26 5.014 0.776 -1.711
196 2HB ALA 26 2HB ALA 26 6.399 0.879 -2.798
197 3HB ALA 26 3HB ALA 26 6.260 -0.471 -1.672
198 H HIS 27 H HIS 27 2.742 -1.194 -2.237
199 HA HIS 27 HA HIS 27 3.572 -3.671 -1.077
200 1HB HIS 27 2HB HIS 27 1.872 -2.397 0.059
201 2HB HIS 27 1HB HIS 27 0.841 -2.403 -1.370
202 HD1 HIS 27 1HD HIS 27 2.204 -4.826 1.227
203 HD2 HIS 27 2HD HIS 27 -0.859 -4.502 -1.556
204 HE1 HIS 27 1HE HIS 27 0.727 -6.851 1.554
205 H LYS 28 H LYS 28 1.410 -2.821 -3.773
206 HA LYS 28 HA LYS 28 0.887 -5.531 -4.479
207 1HB LYS 28 2HB LYS 28 -0.308 -3.192 -5.088
208 2HB LYS 28 1HB LYS 28 0.632 -3.432 -6.555
209 1HG LYS 28 2HG LYS 28 -0.416 -5.843 -6.435
210 2HG LYS 28 1HG LYS 28 -1.642 -5.012 -5.475
211 1HD LYS 28 2HD LYS 28 -0.757 -4.229 -8.253
212 2HD LYS 28 1HD LYS 28 -2.242 -5.095 -7.854
213 1HE LYS 28 2HE LYS 28 -3.133 -3.024 -7.864
214 2HE LYS 28 1HE LYS 28 -2.488 -2.968 -6.223
215 1HZ LYS 28 1HZ LYS 28 -1.972 -1.056 -7.854
216 2HZ LYS 28 2HZ LYS 28 -0.814 -2.113 -8.489
217 3HZ LYS 28 3HZ LYS 28 -0.732 -1.647 -6.866
218 H GLN 29 H GLN 29 3.458 -3.339 -5.140
219 HA GLN 29 HA GLN 29 4.377 -4.738 -7.498
220 1HB GLN 29 2HB GLN 29 4.617 -2.227 -7.003
221 2HB GLN 29 1HB GLN 29 5.940 -2.692 -5.945
222 1HG GLN 29 2HG GLN 29 6.591 -4.017 -8.221
223 2HG GLN 29 1HG GLN 29 5.810 -2.575 -8.866
224 1HE2 GLN 29 1HE2 GLN 29 7.223 -1.074 -9.362
225 2HE2 GLN 29 2HE2 GLN 29 8.664 -0.694 -8.489
226 H PHE 30 H PHE 30 4.990 -4.793 -4.072
227 HA PHE 30 HA PHE 30 7.233 -6.649 -4.534
228 1HB PHE 30 2HB PHE 30 7.461 -4.377 -3.192
229 2HB PHE 30 1HB PHE 30 6.829 -5.361 -1.876
230 HD1 PHE 30 1HD PHE 30 9.729 -4.344 -3.594
231 HD2 PHE 30 2HD PHE 30 8.044 -7.630 -1.478
232 HE1 PHE 30 1HE PHE 30 11.987 -5.231 -3.181
233 HE2 PHE 30 2HE PHE 30 10.299 -8.522 -1.059
234 HZ PHE 30 HZ PHE 30 12.273 -7.322 -1.911
235 H TYR 31 H TYR 31 4.367 -6.084 -2.508
236 HA TYR 31 HA TYR 31 4.613 -8.585 -1.146
237 1HB TYR 31 2HB TYR 31 3.218 -6.278 -0.676
238 2HB TYR 31 1HB TYR 31 1.940 -7.366 -1.208
239 HD1 TYR 31 1HD TYR 31 4.459 -6.720 1.378
240 HD2 TYR 31 2HD TYR 31 1.305 -9.285 0.124
241 HE1 TYR 31 1HE TYR 31 4.390 -7.721 3.623
242 HE2 TYR 31 2HE TYR 31 1.226 -10.293 2.366
243 HH TYR 31 HH TYR 31 2.619 -10.577 4.309
244 H HIS 32 H HIS 32 2.903 -7.487 -4.011
245 HA HIS 32 HA HIS 32 1.878 -10.227 -4.354
246 1HB HIS 32 2HB HIS 32 0.719 -7.619 -5.347
247 2HB HIS 32 1HB HIS 32 0.112 -9.208 -5.798
248 HD1 HIS 32 1HD HIS 32 -1.449 -10.368 -4.137
249 HD2 HIS 32 2HD HIS 32 0.310 -6.922 -2.617
250 HE1 HIS 32 1HE HIS 32 -2.624 -9.871 -1.951
251 H LYS 33 H LYS 33 4.437 -8.731 -5.236
252 HA LYS 33 HA LYS 33 5.761 -8.519 -7.092
253 1HB LYS 33 2HB LYS 33 4.482 -11.220 -7.291
254 2HB LYS 33 1HB LYS 33 5.588 -10.682 -8.549
255 1HG LYS 33 2HG LYS 33 6.868 -11.943 -7.025
256 2HG LYS 33 1HG LYS 33 7.272 -10.251 -6.729
257 1HD LYS 33 2HD LYS 33 6.971 -11.444 -4.627
258 2HD LYS 33 1HD LYS 33 5.717 -10.219 -4.832
259 1HE LYS 33 2HE LYS 33 4.906 -12.429 -3.974
260 2HE LYS 33 1HE LYS 33 4.102 -11.859 -5.434
261 1HZ LYS 33 1HZ LYS 33 5.129 -13.442 -6.725
262 2HZ LYS 33 2HZ LYS 33 4.898 -14.297 -5.284
263 3HZ LYS 33 3HZ LYS 33 6.420 -13.658 -5.652
264 H ASN 34 H ASN 34 3.479 -7.019 -7.466
265 HA ASN 34 HA ASN 34 2.236 -5.968 -9.059
266 1HB ASN 34 2HB ASN 34 4.147 -7.212 -11.041
267 2HB ASN 34 1HB ASN 34 3.216 -5.730 -11.236
268 1HD2 ASN 34 1HD2 ASN 34 5.930 -7.223 -9.642
269 2HD2 ASN 34 2HD2 ASN 34 6.715 -5.757 -9.175
270 H LYS 35 H LYS 35 1.462 -8.664 -8.287
271 HA LYS 35 HA LYS 35 -0.597 -9.104 -10.144
272 1HB LYS 35 2HB LYS 35 0.105 -11.276 -11.077
273 2HB LYS 35 1HB LYS 35 1.146 -9.960 -11.601
274 1HG LYS 35 2HG LYS 35 2.907 -11.090 -10.889
275 2HG LYS 35 1HG LYS 35 2.278 -11.018 -9.242
276 1HD LYS 35 2HD LYS 35 2.692 -13.321 -9.853
277 2HD LYS 35 1HD LYS 35 0.954 -13.055 -9.694
278 1HE LYS 35 2HE LYS 35 1.624 -14.414 -11.684
279 2HE LYS 35 1HE LYS 35 0.672 -12.979 -12.059
280 1HZ LYS 35 1HZ LYS 35 2.566 -11.857 -12.837
281 2HZ LYS 35 2HZ LYS 35 2.670 -13.408 -13.506
282 3HZ LYS 35 3HZ LYS 35 3.630 -12.995 -12.176
283 HA PRO 36 HA PRO 36 -1.283 -10.975 -6.012
284 1HB PRO 36 2HB PRO 36 -3.892 -10.271 -5.845
285 2HB PRO 36 1HB PRO 36 -2.579 -9.160 -5.437
286 1HG PRO 36 2HG PRO 36 -4.181 -9.352 -7.958
287 2HG PRO 36 1HG PRO 36 -3.685 -7.909 -7.055
288 1HD PRO 36 2HD PRO 36 -2.393 -8.764 -9.282
289 2HD PRO 36 1HD PRO 36 -1.566 -7.921 -7.958
Start of MODEL 9
1 1H GLY 1 1HT GLY 1 -18.038 -4.508 6.564
2 2H GLY 1 2HT GLY 1 -19.632 -4.550 7.130
3 3H GLY 1 3HT GLY 1 -18.892 -3.066 6.795
4 1HA GLY 1 1HA GLY 1 -19.639 -5.161 4.831
5 2HA GLY 1 2HA GLY 1 -20.403 -3.591 5.024
6 H SER 2 H SER 2 -19.970 -2.552 3.173
7 HA SER 2 HA SER 2 -17.414 -1.505 2.679
8 1HB SER 2 2HB SER 2 -16.669 -3.588 1.860
9 2HB SER 2 1HB SER 2 -18.194 -3.905 1.033
10 HG SER 2 HG SER 2 -16.225 -1.986 0.337
11 H ALA 3 H ALA 3 -17.638 0.305 1.511
12 HA ALA 3 HA ALA 3 -20.213 0.746 0.176
13 1HB ALA 3 1HB ALA 3 -19.803 3.096 0.420
14 2HB ALA 3 2HB ALA 3 -18.147 2.800 0.949
15 3HB ALA 3 3HB ALA 3 -19.500 2.314 1.971
16 H ALA 4 H ALA 4 -19.445 -0.568 -1.654
17 HA ALA 4 HA ALA 4 -18.745 -0.747 -3.809
18 1HB ALA 4 1HB ALA 4 -18.892 2.181 -3.399
19 2HB ALA 4 2HB ALA 4 -19.696 1.159 -4.590
20 3HB ALA 4 3HB ALA 4 -18.006 1.612 -4.814
21 H GLU 5 H GLU 5 -16.619 1.960 -2.981
22 HA GLU 5 HA GLU 5 -14.343 0.748 -2.132
23 1HB GLU 5 2HB GLU 5 -13.047 0.592 -4.370
24 2HB GLU 5 1HB GLU 5 -14.103 -0.737 -3.916
25 1HG GLU 5 2HG GLU 5 -15.448 -0.424 -5.669
26 2HG GLU 5 1HG GLU 5 -15.431 1.330 -5.491
27 H VAL 6 H VAL 6 -14.984 3.060 -1.445
28 HA VAL 6 HA VAL 6 -13.913 5.114 -3.213
29 HB VAL 6 HB VAL 6 -16.029 5.545 -2.022
30 1HG1 VAL 6 1HG1 VAL 6 -16.028 5.952 0.385
31 2HG1 VAL 6 2HG1 VAL 6 -14.332 5.475 0.471
32 3HG1 VAL 6 3HG1 VAL 6 -15.560 4.291 0.021
33 1HG2 VAL 6 1HG2 VAL 6 -14.981 7.699 -0.767
34 2HG2 VAL 6 2HG2 VAL 6 -15.222 7.590 -2.510
35 3HG2 VAL 6 3HG2 VAL 6 -13.638 7.246 -1.817
36 H MET 7 H MET 7 -13.248 3.623 -0.083
37 HA MET 7 HA MET 7 -11.020 5.327 0.502
38 1HB MET 7 2HB MET 7 -12.585 3.780 2.046
39 2HB MET 7 1HB MET 7 -11.237 2.675 1.815
40 1HG MET 7 2HG MET 7 -9.838 4.814 2.480
41 2HG MET 7 1HG MET 7 -11.353 5.260 3.263
42 1HE MET 7 1HE MET 7 -8.205 3.494 5.309
43 2HE MET 7 2HE MET 7 -8.255 4.360 3.773
44 3HE MET 7 3HE MET 7 -8.154 2.599 3.790
45 H LYS 8 H LYS 8 -9.320 5.253 -0.836
46 HA LYS 8 HA LYS 8 -8.439 2.750 -2.004
47 1HB LYS 8 2HB LYS 8 -6.779 4.146 -3.170
48 2HB LYS 8 1HB LYS 8 -8.413 4.759 -3.382
49 1HG LYS 8 2HG LYS 8 -7.993 6.665 -2.248
50 2HG LYS 8 1HG LYS 8 -6.880 5.882 -1.124
51 1HD LYS 8 2HD LYS 8 -5.670 7.443 -2.527
52 2HD LYS 8 1HD LYS 8 -5.185 5.791 -2.915
53 1HE LYS 8 2HE LYS 8 -7.400 7.053 -4.461
54 2HE LYS 8 1HE LYS 8 -5.737 7.522 -4.814
55 1HZ LYS 8 1HZ LYS 8 -7.092 4.986 -5.286
56 2HZ LYS 8 2HZ LYS 8 -5.470 4.897 -4.816
57 3HZ LYS 8 3HZ LYS 8 -5.902 5.765 -6.202
58 H LYS 9 H LYS 9 -5.792 2.792 -2.088
59 HA LYS 9 HA LYS 9 -3.920 2.204 -0.941
60 1HB LYS 9 2HB LYS 9 -4.785 4.120 1.213
61 2HB LYS 9 1HB LYS 9 -3.155 3.696 0.720
62 1HG LYS 9 2HG LYS 9 -3.379 4.920 -1.320
63 2HG LYS 9 1HG LYS 9 -5.090 5.209 -1.009
64 1HD LYS 9 2HD LYS 9 -3.988 6.211 1.253
65 2HD LYS 9 1HD LYS 9 -2.710 6.554 0.084
66 1HE LYS 9 2HE LYS 9 -4.083 7.923 -1.200
67 2HE LYS 9 1HE LYS 9 -5.561 7.233 -0.530
68 1HZ LYS 9 1HZ LYS 9 -5.495 8.590 1.248
69 2HZ LYS 9 2HZ LYS 9 -4.570 9.572 0.228
70 3HZ LYS 9 3HZ LYS 9 -3.807 8.573 1.360
71 H TYR 10 H TYR 10 -5.810 0.364 -0.626
72 HA TYR 10 HA TYR 10 -5.254 -0.680 2.012
73 1HB TYR 10 2HB TYR 10 -7.369 0.732 2.208
74 2HB TYR 10 1HB TYR 10 -8.144 -0.459 1.169
75 HD1 TYR 10 1HD TYR 10 -7.621 0.473 4.481
76 HD2 TYR 10 2HD TYR 10 -7.771 -2.982 2.004
77 HE1 TYR 10 1HE TYR 10 -8.111 -0.913 6.452
78 HE2 TYR 10 2HE TYR 10 -8.262 -4.377 3.968
79 HH TYR 10 HH TYR 10 -9.331 -3.239 6.810
80 H CYS 11 H CYS 11 -4.884 -2.806 1.855
81 HA CYS 11 HA CYS 11 -5.456 -4.123 -0.663
82 1HB CYS 11 2HB CYS 11 -3.264 -4.361 0.597
83 2HB CYS 11 1HB CYS 11 -4.134 -5.366 1.748
84 H SER 12 H SER 12 -7.099 -5.411 -1.056
85 HA SER 12 HA SER 12 -8.984 -6.039 1.053
86 1HB SER 12 2HB SER 12 -10.336 -6.972 -0.883
87 2HB SER 12 1HB SER 12 -9.979 -5.246 -0.959
88 HG SER 12 HG SER 12 -9.359 -5.852 -2.908
89 H THR 13 H THR 13 -6.279 -7.419 0.700
90 HA THR 13 HA THR 13 -7.325 -10.142 0.909
91 HB THR 13 HB THR 13 -4.795 -9.362 -0.548
92 HG1 THR 13 1HG THR 13 -6.358 -8.952 -1.964
93 1HG2 THR 13 1HG2 THR 13 -5.157 -11.835 -1.354
94 2HG2 THR 13 2HG2 THR 13 -5.941 -11.989 0.218
95 3HG2 THR 13 3HG2 THR 13 -4.259 -11.469 0.118
96 H CYS 14 H CYS 14 -4.824 -7.811 1.726
97 HA CYS 14 HA CYS 14 -3.815 -9.626 3.803
98 1HB CYS 14 2HB CYS 14 -2.659 -7.004 2.838
99 2HB CYS 14 1HB CYS 14 -1.907 -8.115 3.977
100 H ASP 15 H ASP 15 -6.149 -7.347 3.543
101 HA ASP 15 HA ASP 15 -7.243 -5.966 4.972
102 1HB ASP 15 2HB ASP 15 -5.977 -7.829 6.988
103 2HB ASP 15 1HB ASP 15 -7.277 -6.698 7.343
104 H ILE 16 H ILE 16 -4.774 -5.016 4.087
105 HA ILE 16 HA ILE 16 -3.761 -3.563 6.444
106 HB ILE 16 HB ILE 16 -2.272 -3.799 3.843
107 1HG1 ILE 16 2HG1 ILE 16 -2.742 -6.082 4.656
108 2HG1 ILE 16 1HG1 ILE 16 -1.032 -5.687 4.769
109 1HG2 ILE 16 1HG2 ILE 16 -1.627 -2.963 6.638
110 2HG2 ILE 16 2HG2 ILE 16 -1.298 -2.135 5.115
111 3HG2 ILE 16 3HG2 ILE 16 -0.352 -3.553 5.572
112 1HD1 ILE 16 1HD1 ILE 16 -1.181 -5.384 7.122
113 2HD1 ILE 16 2HD1 ILE 16 -1.960 -6.915 6.725
114 3HD1 ILE 16 3HD1 ILE 16 -2.940 -5.493 7.080
115 H SER 17 H SER 17 -3.027 -1.330 6.006
116 HA SER 17 HA SER 17 -4.534 -0.055 3.827
117 1HB SER 17 2HB SER 17 -4.659 1.878 5.705
118 2HB SER 17 1HB SER 17 -5.918 0.662 5.493
119 HG SER 17 HG SER 17 -5.275 -0.344 7.274
120 H PHE 18 H PHE 18 -3.752 2.143 3.314
121 HA PHE 18 HA PHE 18 -0.989 2.668 4.079
122 1HB PHE 18 2HB PHE 18 -1.996 2.355 1.248
123 2HB PHE 18 1HB PHE 18 -0.451 3.087 1.656
124 HD1 PHE 18 1HD PHE 18 1.269 1.675 2.851
125 HD2 PHE 18 2HD PHE 18 -2.252 0.044 1.106
126 HE1 PHE 18 1HE PHE 18 2.299 -0.560 2.870
127 HE2 PHE 18 2HE PHE 18 -1.231 -2.194 1.123
128 HZ PHE 18 HZ PHE 18 1.047 -2.498 2.005
129 H ASN 19 H ASN 19 -0.506 4.810 4.198
130 HA ASN 19 HA ASN 19 -2.727 6.663 3.875
131 1HB ASN 19 2HB ASN 19 -0.895 6.446 5.842
132 2HB ASN 19 1HB ASN 19 -0.100 7.649 4.831
133 1HD2 ASN 19 1HD2 ASN 19 -3.442 6.986 5.834
134 2HD2 ASN 19 2HD2 ASN 19 -3.779 8.595 6.366
135 H TYR 20 H TYR 20 -0.822 5.491 1.688
136 HA TYR 20 HA TYR 20 -0.780 7.907 0.115
137 1HB TYR 20 2HB TYR 20 1.734 6.560 1.049
138 2HB TYR 20 1HB TYR 20 1.695 7.375 -0.511
139 HD1 TYR 20 1HD TYR 20 0.218 9.775 -0.115
140 HD2 TYR 20 2HD TYR 20 2.874 7.840 2.588
141 HE1 TYR 20 1HE TYR 20 0.645 11.927 0.997
142 HE2 TYR 20 2HE TYR 20 3.308 9.987 3.707
143 HH TYR 20 HH TYR 20 2.384 12.972 2.383
144 H VAL 21 H VAL 21 -1.384 7.400 -1.890
145 HA VAL 21 HA VAL 21 -2.025 4.838 -2.724
146 HB VAL 21 HB VAL 21 -1.205 6.990 -4.665
147 1HG1 VAL 21 1HG1 VAL 21 -3.481 5.039 -4.868
148 2HG1 VAL 21 2HG1 VAL 21 -1.848 4.640 -5.401
149 3HG1 VAL 21 3HG1 VAL 21 -2.718 5.978 -6.152
150 1HG2 VAL 21 1HG2 VAL 21 -3.534 6.903 -2.817
151 2HG2 VAL 21 2HG2 VAL 21 -3.786 7.508 -4.455
152 3HG2 VAL 21 3HG2 VAL 21 -2.605 8.284 -3.399
153 H LYS 22 H LYS 22 1.017 6.510 -2.825
154 HA LYS 22 HA LYS 22 2.327 4.886 -4.734
155 1HB LYS 22 2HB LYS 22 3.190 7.082 -4.039
156 2HB LYS 22 1HB LYS 22 3.490 6.455 -2.424
157 1HG LYS 22 2HG LYS 22 4.745 5.035 -4.703
158 2HG LYS 22 1HG LYS 22 5.391 6.615 -4.255
159 1HD LYS 22 2HD LYS 22 5.201 5.481 -1.821
160 2HD LYS 22 1HD LYS 22 5.481 4.044 -2.806
161 1HE LYS 22 2HE LYS 22 7.648 4.588 -2.486
162 2HE LYS 22 1HE LYS 22 7.347 5.681 -3.836
163 1HZ LYS 22 1HZ LYS 22 7.358 6.343 -0.947
164 2HZ LYS 22 2HZ LYS 22 6.777 7.399 -2.133
165 3HZ LYS 22 3HZ LYS 22 8.401 6.927 -2.145
166 H THR 23 H THR 23 1.969 4.689 -1.228
167 HA THR 23 HA THR 23 3.703 2.475 -0.886
168 HB THR 23 HB THR 23 1.420 2.866 0.984
169 HG1 THR 23 1HG THR 23 3.470 4.772 0.558
170 1HG2 THR 23 1HG2 THR 23 4.381 2.660 1.471
171 2HG2 THR 23 2HG2 THR 23 3.242 1.316 1.533
172 3HG2 THR 23 3HG2 THR 23 3.105 2.642 2.688
173 H TYR 24 H TYR 24 0.238 2.787 -1.439
174 HA TYR 24 HA TYR 24 -0.408 0.063 -1.100
175 1HB TYR 24 2HB TYR 24 -2.044 1.972 -1.188
176 2HB TYR 24 1HB TYR 24 -1.793 2.032 -2.929
177 HD1 TYR 24 1HD TYR 24 -3.829 1.366 -3.849
178 HD2 TYR 24 2HD TYR 24 -2.134 -0.928 -0.692
179 HE1 TYR 24 1HE TYR 24 -5.571 -0.341 -4.162
180 HE2 TYR 24 2HE TYR 24 -3.870 -2.642 -0.997
181 HH TYR 24 HH TYR 24 -6.648 -2.124 -2.907
182 H LEU 25 H LEU 25 0.945 1.891 -3.728
183 HA LEU 25 HA LEU 25 0.566 -0.148 -5.717
184 1HB LEU 25 2HB LEU 25 2.093 2.426 -5.573
185 2HB LEU 25 1HB LEU 25 2.419 1.295 -6.874
186 HG LEU 25 HG LEU 25 -0.315 2.428 -6.290
187 1HD1 LEU 25 1HD1 LEU 25 1.315 3.274 -8.629
188 2HD1 LEU 25 2HD1 LEU 25 1.637 4.011 -7.060
189 3HD1 LEU 25 3HD1 LEU 25 0.031 4.130 -7.776
190 1HD2 LEU 25 1HD2 LEU 25 -0.786 0.591 -7.542
191 2HD2 LEU 25 2HD2 LEU 25 0.813 0.548 -8.284
192 3HD2 LEU 25 3HD2 LEU 25 -0.391 1.706 -8.850
193 H ALA 26 H ALA 26 3.192 0.959 -3.645
194 HA ALA 26 HA ALA 26 5.180 -0.767 -4.614
195 1HB ALA 26 1HB ALA 26 5.323 1.302 -3.025
196 2HB ALA 26 2HB ALA 26 6.498 -0.007 -2.887
197 3HB ALA 26 3HB ALA 26 5.147 0.089 -1.758
198 H HIS 27 H HIS 27 2.598 -1.207 -2.277
199 HA HIS 27 HA HIS 27 3.610 -3.594 -1.120
200 1HB HIS 27 2HB HIS 27 1.948 -2.411 0.109
201 2HB HIS 27 1HB HIS 27 0.833 -2.416 -1.255
202 HD1 HIS 27 1HD HIS 27 2.309 -4.792 1.313
203 HD2 HIS 27 2HD HIS 27 -0.815 -4.570 -1.413
204 HE1 HIS 27 1HE HIS 27 0.876 -6.838 1.705
205 H LYS 28 H LYS 28 1.399 -2.955 -3.809
206 HA LYS 28 HA LYS 28 0.854 -5.716 -4.304
207 1HB LYS 28 2HB LYS 28 -0.454 -3.521 -5.002
208 2HB LYS 28 1HB LYS 28 0.544 -3.656 -6.442
209 1HG LYS 28 2HG LYS 28 -0.359 -6.179 -6.277
210 2HG LYS 28 1HG LYS 28 -1.709 -5.320 -5.531
211 1HD LYS 28 2HD LYS 28 -2.358 -5.193 -7.713
212 2HD LYS 28 1HD LYS 28 -1.368 -3.734 -7.631
213 1HE LYS 28 2HE LYS 28 0.336 -4.657 -8.854
214 2HE LYS 28 1HE LYS 28 -0.047 -6.302 -8.347
215 1HZ LYS 28 1HZ LYS 28 -0.695 -6.237 -10.556
216 2HZ LYS 28 2HZ LYS 28 -1.332 -4.674 -10.445
217 3HZ LYS 28 3HZ LYS 28 -2.153 -5.973 -9.738
218 H GLN 29 H GLN 29 3.180 -3.379 -5.492
219 HA GLN 29 HA GLN 29 4.168 -5.166 -7.543
220 1HB GLN 29 2HB GLN 29 4.137 -2.456 -7.310
221 2HB GLN 29 1HB GLN 29 5.787 -2.813 -6.822
222 1HG GLN 29 2HG GLN 29 4.698 -4.036 -9.311
223 2HG GLN 29 1HG GLN 29 5.213 -2.350 -9.319
224 1HE2 GLN 29 1HE2 GLN 29 7.414 -1.895 -8.680
225 2HE2 GLN 29 2HE2 GLN 29 8.647 -3.067 -8.981
226 H PHE 30 H PHE 30 4.715 -4.751 -4.222
227 HA PHE 30 HA PHE 30 7.358 -6.034 -4.446
228 1HB PHE 30 2HB PHE 30 7.262 -3.764 -3.338
229 2HB PHE 30 1HB PHE 30 6.320 -4.513 -2.054
230 HD1 PHE 30 1HD PHE 30 9.363 -5.577 -3.932
231 HD2 PHE 30 2HD PHE 30 7.595 -4.707 -0.160
232 HE1 PHE 30 1HE PHE 30 11.444 -6.252 -2.806
233 HE2 PHE 30 2HE PHE 30 9.674 -5.378 0.973
234 HZ PHE 30 HZ PHE 30 11.602 -6.151 -0.351
235 H TYR 31 H TYR 31 4.435 -5.938 -2.407
236 HA TYR 31 HA TYR 31 5.103 -8.367 -1.053
237 1HB TYR 31 2HB TYR 31 3.466 -6.319 -0.441
238 2HB TYR 31 1HB TYR 31 2.283 -7.450 -1.088
239 HD1 TYR 31 1HD TYR 31 4.426 -6.638 1.704
240 HD2 TYR 31 2HD TYR 31 2.043 -9.708 -0.029
241 HE1 TYR 31 1HE TYR 31 4.388 -7.819 3.860
242 HE2 TYR 31 2HE TYR 31 1.999 -10.897 2.122
243 HH TYR 31 HH TYR 31 3.967 -10.618 4.419
244 H HIS 32 H HIS 32 2.755 -7.509 -3.584
245 HA HIS 32 HA HIS 32 2.145 -10.341 -3.964
246 1HB HIS 32 2HB HIS 32 0.899 -7.854 -5.151
247 2HB HIS 32 1HB HIS 32 0.375 -9.497 -5.504
248 HD1 HIS 32 1HD HIS 32 -1.259 -10.549 -3.865
249 HD2 HIS 32 2HD HIS 32 0.468 -7.052 -2.431
250 HE1 HIS 32 1HE HIS 32 -2.484 -9.974 -1.724
251 H LYS 33 H LYS 33 4.689 -8.867 -4.814
252 HA LYS 33 HA LYS 33 6.100 -8.728 -6.605
253 1HB LYS 33 2HB LYS 33 5.500 -11.300 -6.126
254 2HB LYS 33 1HB LYS 33 4.931 -11.186 -7.785
255 1HG LYS 33 2HG LYS 33 7.287 -10.085 -8.170
256 2HG LYS 33 1HG LYS 33 7.692 -10.984 -6.705
257 1HD LYS 33 2HD LYS 33 6.441 -12.923 -8.047
258 2HD LYS 33 1HD LYS 33 7.009 -11.967 -9.419
259 1HE LYS 33 2HE LYS 33 8.877 -13.204 -9.175
260 2HE LYS 33 1HE LYS 33 9.246 -12.030 -7.913
261 1HZ LYS 33 1HZ LYS 33 7.750 -14.514 -7.334
262 2HZ LYS 33 2HZ LYS 33 8.567 -13.503 -6.253
263 3HZ LYS 33 3HZ LYS 33 9.441 -14.475 -7.324
264 H ASN 34 H ASN 34 3.882 -7.153 -7.044
265 HA ASN 34 HA ASN 34 2.718 -6.059 -8.666
266 1HB ASN 34 2HB ASN 34 5.093 -5.976 -9.572
267 2HB ASN 34 1HB ASN 34 4.642 -7.315 -10.623
268 1HD2 ASN 34 1HD2 ASN 34 4.846 -6.212 -12.519
269 2HD2 ASN 34 2HD2 ASN 34 3.797 -4.920 -12.986
270 H LYS 35 H LYS 35 1.897 -8.774 -7.963
271 HA LYS 35 HA LYS 35 -0.113 -9.144 -9.900
272 1HB LYS 35 2HB LYS 35 1.777 -10.036 -11.221
273 2HB LYS 35 1HB LYS 35 2.084 -11.219 -9.958
274 1HG LYS 35 2HG LYS 35 -0.660 -11.182 -11.020
275 2HG LYS 35 1HG LYS 35 0.596 -11.699 -12.147
276 1HD LYS 35 2HD LYS 35 1.334 -13.113 -9.995
277 2HD LYS 35 1HD LYS 35 -0.398 -12.994 -9.678
278 1HE LYS 35 2HE LYS 35 0.271 -15.021 -10.967
279 2HE LYS 35 1HE LYS 35 -0.923 -14.008 -11.778
280 1HZ LYS 35 1HZ LYS 35 0.593 -13.310 -13.334
281 2HZ LYS 35 2HZ LYS 35 1.118 -14.897 -13.078
282 3HZ LYS 35 3HZ LYS 35 1.934 -13.610 -12.347
283 HA PRO 36 HA PRO 36 -0.990 -10.983 -5.782
284 1HB PRO 36 2HB PRO 36 -3.580 -10.190 -5.703
285 2HB PRO 36 1HB PRO 36 -2.244 -9.131 -5.240
286 1HG PRO 36 2HG PRO 36 -3.759 -9.250 -7.820
287 2HG PRO 36 1HG PRO 36 -3.246 -7.831 -6.889
288 1HD PRO 36 2HD PRO 36 -1.901 -8.710 -9.071
289 2HD PRO 36 1HD PRO 36 -1.093 -7.918 -7.704
Start of MODEL 10
1 1H GLY 1 1HT GLY 1 -18.808 -7.737 5.108
2 2H GLY 1 2HT GLY 1 -18.916 -7.657 6.794
3 3H GLY 1 3HT GLY 1 -19.430 -9.047 5.980
4 1HA GLY 1 1HA GLY 1 -17.135 -9.032 7.145
5 2HA GLY 1 2HA GLY 1 -17.326 -9.802 5.577
6 H SER 2 H SER 2 -17.359 -6.330 6.022
7 HA SER 2 HA SER 2 -16.000 -4.676 5.255
8 1HB SER 2 2HB SER 2 -13.651 -6.543 5.359
9 2HB SER 2 1HB SER 2 -13.725 -4.825 5.750
10 HG SER 2 HG SER 2 -14.056 -5.400 7.731
11 H ALA 3 H ALA 3 -17.296 -6.346 3.346
12 HA ALA 3 HA ALA 3 -15.423 -6.051 1.094
13 1HB ALA 3 1HB ALA 3 -16.293 -8.066 0.067
14 2HB ALA 3 2HB ALA 3 -17.399 -8.306 1.419
15 3HB ALA 3 3HB ALA 3 -15.659 -8.432 1.671
16 H ALA 4 H ALA 4 -16.521 -3.952 0.936
17 HA ALA 4 HA ALA 4 -19.179 -4.173 -0.317
18 1HB ALA 4 1HB ALA 4 -19.379 -1.720 0.274
19 2HB ALA 4 2HB ALA 4 -17.937 -1.938 1.266
20 3HB ALA 4 3HB ALA 4 -19.402 -2.852 1.627
21 H GLU 5 H GLU 5 -16.689 -1.640 -0.358
22 HA GLU 5 HA GLU 5 -15.542 -1.952 -2.797
23 1HB GLU 5 2HB GLU 5 -18.340 -1.134 -3.083
24 2HB GLU 5 1HB GLU 5 -17.221 -0.062 -3.912
25 1HG GLU 5 2HG GLU 5 -16.860 -2.977 -4.294
26 2HG GLU 5 1HG GLU 5 -18.252 -2.213 -5.062
27 H VAL 6 H VAL 6 -14.346 -0.940 -0.861
28 HA VAL 6 HA VAL 6 -14.359 1.988 -1.205
29 HB VAL 6 HB VAL 6 -13.594 0.537 1.329
30 1HG1 VAL 6 1HG1 VAL 6 -12.460 2.604 1.232
31 2HG1 VAL 6 2HG1 VAL 6 -13.860 2.875 2.269
32 3HG1 VAL 6 3HG1 VAL 6 -13.878 3.439 0.598
33 1HG2 VAL 6 1HG2 VAL 6 -15.852 0.200 1.384
34 2HG2 VAL 6 2HG2 VAL 6 -16.200 1.608 0.381
35 3HG2 VAL 6 3HG2 VAL 6 -15.779 1.818 2.081
36 H MET 7 H MET 7 -12.812 1.394 -2.950
37 HA MET 7 HA MET 7 -10.225 0.406 -2.148
38 1HB MET 7 2HB MET 7 -11.530 0.258 -4.479
39 2HB MET 7 1HB MET 7 -10.604 1.720 -4.786
40 1HG MET 7 2HG MET 7 -8.542 0.567 -4.448
41 2HG MET 7 1HG MET 7 -9.384 -0.878 -3.890
42 1HE MET 7 1HE MET 7 -9.062 -2.620 -4.987
43 2HE MET 7 2HE MET 7 -8.821 -2.891 -6.713
44 3HE MET 7 3HE MET 7 -10.455 -2.819 -6.052
45 H LYS 8 H LYS 8 -8.658 1.608 -1.319
46 HA LYS 8 HA LYS 8 -7.816 4.079 -2.307
47 1HB LYS 8 2HB LYS 8 -9.697 5.186 -1.454
48 2HB LYS 8 1HB LYS 8 -9.734 4.204 0.003
49 1HG LYS 8 2HG LYS 8 -8.320 5.554 1.104
50 2HG LYS 8 1HG LYS 8 -7.310 5.826 -0.317
51 1HD LYS 8 2HD LYS 8 -8.389 7.892 0.420
52 2HD LYS 8 1HD LYS 8 -8.947 7.415 -1.186
53 1HE LYS 8 2HE LYS 8 -10.492 6.489 1.182
54 2HE LYS 8 1HE LYS 8 -10.633 8.180 0.702
55 1HZ LYS 8 1HZ LYS 8 -11.659 5.810 -0.584
56 2HZ LYS 8 2HZ LYS 8 -10.917 6.898 -1.645
57 3HZ LYS 8 3HZ LYS 8 -12.201 7.410 -0.671
58 H LYS 9 H LYS 9 -5.879 2.862 -2.068
59 HA LYS 9 HA LYS 9 -3.959 2.200 -1.037
60 1HB LYS 9 2HB LYS 9 -4.698 4.111 1.169
61 2HB LYS 9 1HB LYS 9 -3.095 3.665 0.610
62 1HG LYS 9 2HG LYS 9 -3.078 5.250 -0.951
63 2HG LYS 9 1HG LYS 9 -4.718 4.872 -1.480
64 1HD LYS 9 2HD LYS 9 -5.357 6.034 0.798
65 2HD LYS 9 1HD LYS 9 -3.780 6.798 0.590
66 1HE LYS 9 2HE LYS 9 -4.413 7.838 -1.402
67 2HE LYS 9 1HE LYS 9 -5.787 6.758 -1.636
68 1HZ LYS 9 1HZ LYS 9 -5.588 9.184 -0.071
69 2HZ LYS 9 2HZ LYS 9 -6.414 7.919 0.690
70 3HZ LYS 9 3HZ LYS 9 -6.935 8.484 -0.817
71 H TYR 10 H TYR 10 -5.897 0.401 -0.621
72 HA TYR 10 HA TYR 10 -5.195 -0.672 1.983
73 1HB TYR 10 2HB TYR 10 -7.325 0.733 2.229
74 2HB TYR 10 1HB TYR 10 -8.115 -0.502 1.254
75 HD1 TYR 10 1HD TYR 10 -7.319 0.501 4.531
76 HD2 TYR 10 2HD TYR 10 -7.805 -2.970 2.118
77 HE1 TYR 10 1HE TYR 10 -7.695 -0.847 6.553
78 HE2 TYR 10 2HE TYR 10 -8.183 -4.326 4.133
79 HH TYR 10 HH TYR 10 -8.944 -3.096 7.062
80 H CYS 11 H CYS 11 -4.860 -2.803 1.842
81 HA CYS 11 HA CYS 11 -5.450 -4.119 -0.669
82 1HB CYS 11 2HB CYS 11 -3.255 -4.355 0.585
83 2HB CYS 11 1HB CYS 11 -4.124 -5.362 1.738
84 H SER 12 H SER 12 -7.098 -5.404 -1.054
85 HA SER 12 HA SER 12 -8.973 -6.032 1.064
86 1HB SER 12 2HB SER 12 -9.403 -5.277 -1.469
87 2HB SER 12 1HB SER 12 -9.419 -7.025 -1.701
88 HG SER 12 HG SER 12 -10.943 -5.752 0.312
89 H THR 13 H THR 13 -6.268 -7.410 0.695
90 HA THR 13 HA THR 13 -7.310 -10.134 0.905
91 HB THR 13 HB THR 13 -4.790 -9.347 -0.563
92 HG1 THR 13 1HG THR 13 -7.196 -10.446 -1.580
93 1HG2 THR 13 1HG2 THR 13 -4.921 -11.750 -1.353
94 2HG2 THR 13 2HG2 THR 13 -6.018 -12.021 0.002
95 3HG2 THR 13 3HG2 THR 13 -4.366 -11.479 0.300
96 H CYS 14 H CYS 14 -4.811 -7.799 1.714
97 HA CYS 14 HA CYS 14 -3.774 -9.615 3.773
98 1HB CYS 14 2HB CYS 14 -2.667 -6.972 2.808
99 2HB CYS 14 1HB CYS 14 -1.894 -8.056 3.959
100 H ASP 15 H ASP 15 -6.086 -7.265 3.508
101 HA ASP 15 HA ASP 15 -7.212 -5.954 4.982
102 1HB ASP 15 2HB ASP 15 -6.552 -8.339 6.318
103 2HB ASP 15 1HB ASP 15 -6.230 -7.046 7.467
104 H ILE 16 H ILE 16 -4.727 -5.012 4.094
105 HA ILE 16 HA ILE 16 -3.733 -3.544 6.448
106 HB ILE 16 HB ILE 16 -2.232 -3.800 3.855
107 1HG1 ILE 16 2HG1 ILE 16 -2.694 -6.074 4.705
108 2HG1 ILE 16 1HG1 ILE 16 -0.984 -5.668 4.813
109 1HG2 ILE 16 1HG2 ILE 16 -1.339 -2.083 5.165
110 2HG2 ILE 16 2HG2 ILE 16 -0.303 -3.470 5.501
111 3HG2 ILE 16 3HG2 ILE 16 -1.544 -2.995 6.661
112 1HD1 ILE 16 1HD1 ILE 16 -2.031 -6.869 6.786
113 2HD1 ILE 16 2HD1 ILE 16 -2.840 -5.343 7.142
114 3HD1 ILE 16 3HD1 ILE 16 -1.078 -5.428 7.138
115 H SER 17 H SER 17 -2.999 -1.311 6.004
116 HA SER 17 HA SER 17 -4.476 -0.049 3.800
117 1HB SER 17 2HB SER 17 -5.679 0.151 6.027
118 2HB SER 17 1HB SER 17 -4.328 1.141 6.574
119 HG SER 17 HG SER 17 -5.735 2.587 5.774
120 H PHE 18 H PHE 18 -3.706 2.140 3.292
121 HA PHE 18 HA PHE 18 -0.976 2.716 4.140
122 1HB PHE 18 2HB PHE 18 -1.896 2.418 1.276
123 2HB PHE 18 1HB PHE 18 -0.358 3.120 1.750
124 HD1 PHE 18 1HD PHE 18 1.207 1.629 3.164
125 HD2 PHE 18 2HD PHE 18 -2.089 0.151 0.913
126 HE1 PHE 18 1HE PHE 18 2.205 -0.622 3.184
127 HE2 PHE 18 2HE PHE 18 -1.098 -2.100 0.930
128 HZ PHE 18 HZ PHE 18 1.049 -2.490 2.066
129 H ASN 19 H ASN 19 -0.556 4.861 4.313
130 HA ASN 19 HA ASN 19 -2.791 6.676 3.950
131 1HB ASN 19 2HB ASN 19 -0.209 6.736 5.422
132 2HB ASN 19 1HB ASN 19 -0.870 8.284 4.906
133 1HD2 ASN 19 1HD2 ASN 19 -1.278 5.534 6.965
134 2HD2 ASN 19 2HD2 ASN 19 -2.552 6.186 7.932
135 H TYR 20 H TYR 20 -0.772 5.537 1.784
136 HA TYR 20 HA TYR 20 -0.851 7.943 0.183
137 1HB TYR 20 2HB TYR 20 1.721 6.653 1.058
138 2HB TYR 20 1HB TYR 20 1.620 7.561 -0.445
139 HD1 TYR 20 1HD TYR 20 1.194 9.986 -0.403
140 HD2 TYR 20 2HD TYR 20 1.706 7.763 3.188
141 HE1 TYR 20 1HE TYR 20 1.560 12.080 0.833
142 HE2 TYR 20 2HE TYR 20 2.073 9.850 4.435
143 HH TYR 20 HH TYR 20 1.394 12.915 3.131
144 H VAL 21 H VAL 21 -1.540 7.372 -1.765
145 HA VAL 21 HA VAL 21 -2.069 4.806 -2.606
146 HB VAL 21 HB VAL 21 -1.348 7.029 -4.513
147 1HG1 VAL 21 1HG1 VAL 21 -3.367 4.805 -4.774
148 2HG1 VAL 21 2HG1 VAL 21 -1.729 4.743 -5.428
149 3HG1 VAL 21 3HG1 VAL 21 -2.869 5.952 -6.020
150 1HG2 VAL 21 1HG2 VAL 21 -3.817 6.618 -2.859
151 2HG2 VAL 21 2HG2 VAL 21 -3.870 7.487 -4.393
152 3HG2 VAL 21 3HG2 VAL 21 -2.860 8.084 -3.076
153 H LYS 22 H LYS 22 0.929 6.559 -2.746
154 HA LYS 22 HA LYS 22 2.255 4.971 -4.672
155 1HB LYS 22 2HB LYS 22 3.483 6.481 -2.358
156 2HB LYS 22 1HB LYS 22 4.307 5.956 -3.820
157 1HG LYS 22 2HG LYS 22 3.246 7.553 -5.139
158 2HG LYS 22 1HG LYS 22 1.965 7.817 -3.953
159 1HD LYS 22 2HD LYS 22 3.273 9.169 -2.641
160 2HD LYS 22 1HD LYS 22 4.776 8.408 -3.168
161 1HE LYS 22 2HE LYS 22 3.116 10.009 -5.078
162 2HE LYS 22 1HE LYS 22 4.230 10.807 -3.969
163 1HZ LYS 22 1HZ LYS 22 5.306 8.571 -5.486
164 2HZ LYS 22 2HZ LYS 22 6.022 10.049 -5.081
165 3HZ LYS 22 3HZ LYS 22 4.937 9.962 -6.376
166 H THR 23 H THR 23 1.893 4.720 -1.174
167 HA THR 23 HA THR 23 3.696 2.541 -0.875
168 HB THR 23 HB THR 23 1.468 2.818 1.058
169 HG1 THR 23 1HG THR 23 2.095 4.780 1.784
170 1HG2 THR 23 1HG2 THR 23 3.137 1.494 1.913
171 2HG2 THR 23 2HG2 THR 23 3.543 3.072 2.588
172 3HG2 THR 23 3HG2 THR 23 4.422 2.458 1.187
173 H TYR 24 H TYR 24 0.223 2.816 -1.376
174 HA TYR 24 HA TYR 24 -0.400 0.086 -1.051
175 1HB TYR 24 2HB TYR 24 -2.070 1.935 -1.087
176 2HB TYR 24 1HB TYR 24 -1.801 2.101 -2.818
177 HD1 TYR 24 1HD TYR 24 -3.804 1.452 -3.813
178 HD2 TYR 24 2HD TYR 24 -2.133 -0.983 -0.752
179 HE1 TYR 24 1HE TYR 24 -5.519 -0.258 -4.246
180 HE2 TYR 24 2HE TYR 24 -3.841 -2.700 -1.177
181 HH TYR 24 HH TYR 24 -5.562 -2.968 -3.820
182 H LEU 25 H LEU 25 0.902 1.950 -3.679
183 HA LEU 25 HA LEU 25 0.518 -0.072 -5.682
184 1HB LEU 25 2HB LEU 25 1.983 2.529 -5.524
185 2HB LEU 25 1HB LEU 25 2.379 1.412 -6.817
186 HG LEU 25 HG LEU 25 -0.469 2.220 -6.352
187 1HD1 LEU 25 1HD1 LEU 25 0.224 3.880 -8.327
188 2HD1 LEU 25 2HD1 LEU 25 1.730 3.886 -7.410
189 3HD1 LEU 25 3HD1 LEU 25 0.220 4.356 -6.629
190 1HD2 LEU 25 1HD2 LEU 25 -0.833 1.449 -8.485
191 2HD2 LEU 25 2HD2 LEU 25 0.444 0.358 -7.948
192 3HD2 LEU 25 3HD2 LEU 25 0.834 1.728 -8.988
193 H ALA 26 H ALA 26 3.166 1.034 -3.633
194 HA ALA 26 HA ALA 26 5.151 -0.668 -4.645
195 1HB ALA 26 1HB ALA 26 4.797 0.941 -2.178
196 2HB ALA 26 2HB ALA 26 6.088 0.979 -3.381
197 3HB ALA 26 3HB ALA 26 6.043 -0.307 -2.174
198 H HIS 27 H HIS 27 2.568 -1.167 -2.338
199 HA HIS 27 HA HIS 27 3.615 -3.567 -1.213
200 1HB HIS 27 2HB HIS 27 1.985 -2.395 0.071
201 2HB HIS 27 1HB HIS 27 0.842 -2.375 -1.267
202 HD1 HIS 27 1HD HIS 27 2.355 -4.791 1.237
203 HD2 HIS 27 2HD HIS 27 -0.821 -4.520 -1.424
204 HE1 HIS 27 1HE HIS 27 0.918 -6.834 1.632
205 H LYS 28 H LYS 28 1.390 -2.861 -3.870
206 HA LYS 28 HA LYS 28 0.779 -5.604 -4.390
207 1HB LYS 28 2HB LYS 28 -0.429 -3.310 -5.075
208 2HB LYS 28 1HB LYS 28 0.491 -3.585 -6.549
209 1HG LYS 28 2HG LYS 28 -0.722 -5.417 -7.132
210 2HG LYS 28 1HG LYS 28 -1.068 -5.860 -5.459
211 1HD LYS 28 2HD LYS 28 -3.093 -5.114 -6.581
212 2HD LYS 28 1HD LYS 28 -2.645 -3.986 -5.300
213 1HE LYS 28 2HE LYS 28 -1.753 -2.434 -6.884
214 2HE LYS 28 1HE LYS 28 -1.922 -3.597 -8.199
215 1HZ LYS 28 1HZ LYS 28 -3.702 -1.696 -7.689
216 2HZ LYS 28 2HZ LYS 28 -4.357 -2.943 -6.754
217 3HZ LYS 28 3HZ LYS 28 -4.108 -3.170 -8.411
218 H GLN 29 H GLN 29 3.137 -3.301 -5.599
219 HA GLN 29 HA GLN 29 4.062 -5.103 -7.665
220 1HB GLN 29 2HB GLN 29 4.084 -2.391 -7.425
221 2HB GLN 29 1HB GLN 29 5.738 -2.782 -6.972
222 1HG GLN 29 2HG GLN 29 5.837 -2.412 -9.264
223 2HG GLN 29 1HG GLN 29 5.813 -4.168 -9.110
224 1HE2 GLN 29 1HE2 GLN 29 4.483 -5.184 -10.416
225 2HE2 GLN 29 2HE2 GLN 29 3.057 -4.528 -11.138
226 H PHE 30 H PHE 30 4.663 -4.710 -4.353
227 HA PHE 30 HA PHE 30 7.284 -6.030 -4.618
228 1HB PHE 30 2HB PHE 30 7.105 -3.728 -3.461
229 2HB PHE 30 1HB PHE 30 6.361 -4.611 -2.132
230 HD1 PHE 30 1HD PHE 30 9.374 -3.406 -3.417
231 HD2 PHE 30 2HD PHE 30 7.724 -6.740 -1.351
232 HE1 PHE 30 1HE PHE 30 11.607 -3.970 -2.553
233 HE2 PHE 30 2HE PHE 30 9.954 -7.309 -0.481
234 HZ PHE 30 HZ PHE 30 11.899 -5.924 -1.082
235 H TYR 31 H TYR 31 4.399 -5.897 -2.528
236 HA TYR 31 HA TYR 31 5.042 -8.352 -1.209
237 1HB TYR 31 2HB TYR 31 3.536 -6.322 -0.444
238 2HB TYR 31 1HB TYR 31 2.263 -7.252 -1.228
239 HD1 TYR 31 1HD TYR 31 4.801 -7.340 1.462
240 HD2 TYR 31 2HD TYR 31 1.335 -9.171 -0.189
241 HE1 TYR 31 1HE TYR 31 4.570 -8.715 3.488
242 HE2 TYR 31 2HE TYR 31 1.093 -10.550 1.832
243 HH TYR 31 HH TYR 31 2.416 -11.374 3.668
244 H HIS 32 H HIS 32 2.749 -7.418 -3.748
245 HA HIS 32 HA HIS 32 2.079 -10.244 -4.148
246 1HB HIS 32 2HB HIS 32 0.782 -7.732 -5.222
247 2HB HIS 32 1HB HIS 32 0.253 -9.367 -5.598
248 HD1 HIS 32 1HD HIS 32 -1.286 -10.494 -3.907
249 HD2 HIS 32 2HD HIS 32 0.395 -6.964 -2.500
250 HE1 HIS 32 1HE HIS 32 -2.465 -9.961 -1.729
251 H LYS 33 H LYS 33 4.625 -9.622 -4.913
252 HA LYS 33 HA LYS 33 4.460 -10.032 -7.796
253 1HB LYS 33 2HB LYS 33 4.837 -7.598 -7.450
254 2HB LYS 33 1HB LYS 33 6.311 -7.980 -6.570
255 1HG LYS 33 2HG LYS 33 7.435 -8.645 -8.468
256 2HG LYS 33 1HG LYS 33 5.949 -8.996 -9.351
257 1HD LYS 33 2HD LYS 33 6.152 -7.001 -10.320
258 2HD LYS 33 1HD LYS 33 5.808 -6.273 -8.751
259 1HE LYS 33 2HE LYS 33 7.954 -5.671 -8.420
260 2HE LYS 33 1HE LYS 33 8.586 -7.153 -9.133
261 1HZ LYS 33 1HZ LYS 33 8.400 -6.275 -11.280
262 2HZ LYS 33 2HZ LYS 33 9.043 -5.008 -10.362
263 3HZ LYS 33 3HZ LYS 33 7.405 -5.000 -10.782
264 H ASN 34 H ASN 34 4.924 -11.949 -5.886
265 HA ASN 34 HA ASN 34 7.337 -13.098 -6.774
266 1HB ASN 34 2HB ASN 34 8.212 -11.341 -5.169
267 2HB ASN 34 1HB ASN 34 7.437 -12.252 -3.877
268 1HD2 ASN 34 1HD2 ASN 34 8.377 -14.074 -3.121
269 2HD2 ASN 34 2HD2 ASN 34 9.903 -14.673 -3.666
270 H LYS 35 H LYS 35 4.597 -13.818 -6.493
271 HA LYS 35 HA LYS 35 4.843 -16.433 -5.518
272 1HB LYS 35 2HB LYS 35 4.850 -15.357 -3.312
273 2HB LYS 35 1HB LYS 35 3.325 -14.566 -3.686
274 1HG LYS 35 2HG LYS 35 3.357 -17.505 -3.930
275 2HG LYS 35 1HG LYS 35 3.514 -16.849 -2.299
276 1HD LYS 35 2HD LYS 35 1.494 -15.325 -3.277
277 2HD LYS 35 1HD LYS 35 1.211 -16.845 -4.128
278 1HE LYS 35 2HE LYS 35 0.073 -17.389 -2.264
279 2HE LYS 35 1HE LYS 35 1.675 -17.758 -1.628
280 1HZ LYS 35 1HZ LYS 35 1.753 -15.465 -0.754
281 2HZ LYS 35 2HZ LYS 35 0.512 -16.389 -0.071
282 3HZ LYS 35 3HZ LYS 35 0.153 -15.237 -1.256
283 HA PRO 36 HA PRO 36 1.319 -15.687 -8.378
284 1HB PRO 36 2HB PRO 36 1.689 -17.965 -9.806
285 2HB PRO 36 1HB PRO 36 2.578 -16.473 -10.134
286 1HG PRO 36 2HG PRO 36 3.441 -18.894 -8.597
287 2HG PRO 36 1HG PRO 36 4.351 -17.936 -9.779
288 1HD PRO 36 2HD PRO 36 4.686 -17.651 -7.109
289 2HD PRO 36 1HD PRO 36 4.867 -16.297 -8.242
Start of MODEL 11
1 1H GLY 1 1HT GLY 1 -21.538 -11.453 -2.393
2 2H GLY 1 2HT GLY 1 -23.153 -11.296 -1.917
3 3H GLY 1 3HT GLY 1 -21.995 -10.204 -1.346
4 1HA GLY 1 1HA GLY 1 -22.603 -10.491 -4.227
5 2HA GLY 1 2HA GLY 1 -23.498 -9.389 -3.193
6 H SER 2 H SER 2 -22.388 -7.614 -2.230
7 HA SER 2 HA SER 2 -19.672 -7.069 -3.101
8 1HB SER 2 2HB SER 2 -20.776 -6.178 -5.002
9 2HB SER 2 1HB SER 2 -22.051 -5.459 -4.020
10 HG SER 2 HG SER 2 -20.862 -3.745 -3.898
11 H ALA 3 H ALA 3 -19.297 -7.178 -0.833
12 HA ALA 3 HA ALA 3 -20.111 -4.726 0.578
13 1HB ALA 3 1HB ALA 3 -20.684 -5.835 2.500
14 2HB ALA 3 2HB ALA 3 -19.663 -7.226 2.133
15 3HB ALA 3 3HB ALA 3 -21.197 -7.011 1.290
16 H ALA 4 H ALA 4 -17.696 -5.320 -0.940
17 HA ALA 4 HA ALA 4 -15.777 -4.439 0.990
18 1HB ALA 4 1HB ALA 4 -15.513 -6.696 1.584
19 2HB ALA 4 2HB ALA 4 -14.177 -6.356 0.484
20 3HB ALA 4 3HB ALA 4 -15.593 -7.234 -0.093
21 H GLU 5 H GLU 5 -14.371 -3.132 0.015
22 HA GLU 5 HA GLU 5 -12.931 -3.448 -2.262
23 1HB GLU 5 2HB GLU 5 -15.723 -2.831 -2.898
24 2HB GLU 5 1HB GLU 5 -14.586 -1.712 -3.636
25 1HG GLU 5 2HG GLU 5 -13.833 -4.525 -3.889
26 2HG GLU 5 1HG GLU 5 -15.346 -4.099 -4.687
27 H VAL 6 H VAL 6 -12.033 -2.295 -0.247
28 HA VAL 6 HA VAL 6 -12.586 0.391 0.293
29 HB VAL 6 HB VAL 6 -9.876 -0.912 0.546
30 1HG1 VAL 6 1HG1 VAL 6 -9.724 1.423 0.936
31 2HG1 VAL 6 2HG1 VAL 6 -9.735 0.647 2.520
32 3HG1 VAL 6 3HG1 VAL 6 -11.195 1.425 1.909
33 1HG2 VAL 6 1HG2 VAL 6 -12.387 -1.338 2.042
34 2HG2 VAL 6 2HG2 VAL 6 -10.922 -1.151 3.005
35 3HG2 VAL 6 3HG2 VAL 6 -11.019 -2.421 1.785
36 H MET 7 H MET 7 -9.858 -0.915 -1.611
37 HA MET 7 HA MET 7 -8.689 -0.064 -3.373
38 1HB MET 7 2HB MET 7 -11.290 0.464 -3.970
39 2HB MET 7 1HB MET 7 -10.610 2.085 -3.996
40 1HG MET 7 2HG MET 7 -10.128 1.608 -6.121
41 2HG MET 7 1HG MET 7 -8.762 0.729 -5.438
42 1HE MET 7 1HE MET 7 -10.312 -2.919 -5.252
43 2HE MET 7 2HE MET 7 -10.501 -1.673 -4.018
44 3HE MET 7 3HE MET 7 -8.938 -1.909 -4.803
45 H LYS 8 H LYS 8 -7.980 2.198 -4.334
46 HA LYS 8 HA LYS 8 -6.972 4.227 -4.042
47 1HB LYS 8 2HB LYS 8 -8.964 4.852 -2.665
48 2HB LYS 8 1HB LYS 8 -8.119 4.251 -1.246
49 1HG LYS 8 2HG LYS 8 -6.405 5.917 -1.489
50 2HG LYS 8 1HG LYS 8 -7.110 6.468 -3.010
51 1HD LYS 8 2HD LYS 8 -8.963 6.447 -0.733
52 2HD LYS 8 1HD LYS 8 -7.615 7.575 -0.577
53 1HE LYS 8 2HE LYS 8 -8.204 8.695 -2.578
54 2HE LYS 8 1HE LYS 8 -9.336 7.425 -3.040
55 1HZ LYS 8 1HZ LYS 8 -10.892 8.137 -1.523
56 2HZ LYS 8 2HZ LYS 8 -10.221 9.608 -2.017
57 3HZ LYS 8 3HZ LYS 8 -9.759 8.923 -0.542
58 H LYS 9 H LYS 9 -6.834 2.796 -0.775
59 HA LYS 9 HA LYS 9 -4.055 2.094 -1.120
60 1HB LYS 9 2HB LYS 9 -3.432 3.495 0.941
61 2HB LYS 9 1HB LYS 9 -3.591 4.327 -0.596
62 1HG LYS 9 2HG LYS 9 -6.022 4.774 0.181
63 2HG LYS 9 1HG LYS 9 -5.392 4.393 1.785
64 1HD LYS 9 2HD LYS 9 -3.504 6.099 1.032
65 2HD LYS 9 1HD LYS 9 -4.808 6.700 0.005
66 1HE LYS 9 2HE LYS 9 -6.110 6.442 2.358
67 2HE LYS 9 1HE LYS 9 -4.486 6.819 2.931
68 1HZ LYS 9 1HZ LYS 9 -5.621 8.857 2.667
69 2HZ LYS 9 2HZ LYS 9 -6.188 8.444 1.128
70 3HZ LYS 9 3HZ LYS 9 -4.542 8.755 1.368
71 H TYR 10 H TYR 10 -5.867 0.288 -0.692
72 HA TYR 10 HA TYR 10 -5.278 -0.692 1.963
73 1HB TYR 10 2HB TYR 10 -7.295 0.588 2.424
74 2HB TYR 10 1HB TYR 10 -8.130 -0.188 1.084
75 HD1 TYR 10 1HD TYR 10 -7.439 -0.313 4.569
76 HD2 TYR 10 2HD TYR 10 -8.445 -2.747 1.230
77 HE1 TYR 10 1HE TYR 10 -8.244 -2.063 6.096
78 HE2 TYR 10 2HE TYR 10 -9.255 -4.504 2.747
79 HH TYR 10 HH TYR 10 -9.013 -5.233 5.017
80 H CYS 11 H CYS 11 -4.887 -2.818 1.833
81 HA CYS 11 HA CYS 11 -5.471 -4.178 -0.657
82 1HB CYS 11 2HB CYS 11 -3.267 -4.362 0.606
83 2HB CYS 11 1HB CYS 11 -4.123 -5.386 1.754
84 H SER 12 H SER 12 -7.110 -5.477 -1.018
85 HA SER 12 HA SER 12 -8.961 -6.109 1.120
86 1HB SER 12 2HB SER 12 -10.160 -7.225 -0.964
87 2HB SER 12 1HB SER 12 -10.184 -5.478 -0.726
88 HG SER 12 HG SER 12 -9.539 -5.764 -2.796
89 H THR 13 H THR 13 -6.243 -7.463 0.733
90 HA THR 13 HA THR 13 -7.254 -10.194 0.986
91 HB THR 13 HB THR 13 -4.761 -9.400 -0.524
92 HG1 THR 13 1HG THR 13 -6.707 -8.998 -1.669
93 1HG2 THR 13 1HG2 THR 13 -5.041 -11.736 0.735
94 2HG2 THR 13 2HG2 THR 13 -4.213 -11.562 -0.812
95 3HG2 THR 13 3HG2 THR 13 -5.888 -12.111 -0.765
96 H CYS 14 H CYS 14 -4.769 -7.826 1.735
97 HA CYS 14 HA CYS 14 -3.673 -9.605 3.793
98 1HB CYS 14 2HB CYS 14 -2.645 -6.944 2.787
99 2HB CYS 14 1HB CYS 14 -1.836 -7.981 3.956
100 H ASP 15 H ASP 15 -6.015 -7.261 3.527
101 HA ASP 15 HA ASP 15 -7.164 -5.985 5.012
102 1HB ASP 15 2HB ASP 15 -6.454 -8.354 6.345
103 2HB ASP 15 1HB ASP 15 -6.137 -7.057 7.489
104 H ILE 16 H ILE 16 -4.708 -4.994 4.104
105 HA ILE 16 HA ILE 16 -3.745 -3.485 6.446
106 HB ILE 16 HB ILE 16 -2.205 -3.765 3.879
107 1HG1 ILE 16 2HG1 ILE 16 -2.648 -6.032 4.749
108 2HG1 ILE 16 1HG1 ILE 16 -0.946 -5.602 4.888
109 1HG2 ILE 16 1HG2 ILE 16 -1.559 -2.923 6.686
110 2HG2 ILE 16 2HG2 ILE 16 -1.361 -2.015 5.187
111 3HG2 ILE 16 3HG2 ILE 16 -0.302 -3.382 5.536
112 1HD1 ILE 16 1HD1 ILE 16 -2.046 -6.791 6.854
113 2HD1 ILE 16 2HD1 ILE 16 -2.840 -5.250 7.179
114 3HD1 ILE 16 3HD1 ILE 16 -1.080 -5.357 7.201
115 H SER 17 H SER 17 -3.037 -1.256 5.981
116 HA SER 17 HA SER 17 -4.496 -0.039 3.739
117 1HB SER 17 2HB SER 17 -4.658 1.902 5.665
118 2HB SER 17 1HB SER 17 -5.948 0.762 5.283
119 HG SER 17 HG SER 17 -3.947 0.389 7.262
120 H PHE 18 H PHE 18 -3.719 2.145 3.193
121 HA PHE 18 HA PHE 18 -0.980 2.692 4.053
122 1HB PHE 18 2HB PHE 18 -1.929 2.445 1.194
123 2HB PHE 18 1HB PHE 18 -0.386 3.143 1.659
124 HD1 PHE 18 1HD PHE 18 1.293 1.690 2.844
125 HD2 PHE 18 2HD PHE 18 -2.222 0.133 1.020
126 HE1 PHE 18 1HE PHE 18 2.293 -0.559 2.845
127 HE2 PHE 18 2HE PHE 18 -1.230 -2.118 1.018
128 HZ PHE 18 HZ PHE 18 1.029 -2.467 1.932
129 H ASN 19 H ASN 19 -0.525 4.811 4.281
130 HA ASN 19 HA ASN 19 -2.719 6.683 4.001
131 1HB ASN 19 2HB ASN 19 -0.045 6.727 5.342
132 2HB ASN 19 1HB ASN 19 -0.843 8.255 4.983
133 1HD2 ASN 19 1HD2 ASN 19 -3.199 8.309 5.668
134 2HD2 ASN 19 2HD2 ASN 19 -3.555 7.660 7.229
135 H TYR 20 H TYR 20 -0.627 5.561 1.821
136 HA TYR 20 HA TYR 20 -0.751 7.999 0.250
137 1HB TYR 20 2HB TYR 20 1.821 6.662 1.059
138 2HB TYR 20 1HB TYR 20 1.708 7.614 -0.418
139 HD1 TYR 20 1HD TYR 20 1.431 10.028 -0.325
140 HD2 TYR 20 2HD TYR 20 1.717 7.724 3.239
141 HE1 TYR 20 1HE TYR 20 1.834 12.083 0.964
142 HE2 TYR 20 2HE TYR 20 2.120 9.773 4.539
143 HH TYR 20 HH TYR 20 1.632 12.227 4.307
144 H VAL 21 H VAL 21 -1.453 7.488 -1.710
145 HA VAL 21 HA VAL 21 -2.050 4.964 -2.610
146 HB VAL 21 HB VAL 21 -1.265 7.236 -4.436
147 1HG1 VAL 21 1HG1 VAL 21 -2.751 4.683 -4.759
148 2HG1 VAL 21 2HG1 VAL 21 -1.639 5.494 -5.863
149 3HG1 VAL 21 3HG1 VAL 21 -3.292 6.083 -5.684
150 1HG2 VAL 21 1HG2 VAL 21 -2.818 8.344 -3.196
151 2HG2 VAL 21 2HG2 VAL 21 -3.626 6.864 -2.680
152 3HG2 VAL 21 3HG2 VAL 21 -3.907 7.502 -4.299
153 H LYS 22 H LYS 22 0.998 6.644 -2.757
154 HA LYS 22 HA LYS 22 2.261 5.035 -4.705
155 1HB LYS 22 2HB LYS 22 3.549 6.510 -2.402
156 2HB LYS 22 1HB LYS 22 4.347 5.967 -3.871
157 1HG LYS 22 2HG LYS 22 2.213 8.080 -3.666
158 2HG LYS 22 1HG LYS 22 3.930 8.337 -3.984
159 1HD LYS 22 2HD LYS 22 3.491 6.715 -5.992
160 2HD LYS 22 1HD LYS 22 1.813 7.212 -5.764
161 1HE LYS 22 2HE LYS 22 4.185 8.970 -6.360
162 2HE LYS 22 1HE LYS 22 2.796 8.653 -7.398
163 1HZ LYS 22 1HZ LYS 22 2.377 10.728 -6.462
164 2HZ LYS 22 2HZ LYS 22 2.906 10.264 -4.924
165 3HZ LYS 22 3HZ LYS 22 1.439 9.676 -5.526
166 H THR 23 H THR 23 1.873 4.734 -1.223
167 HA THR 23 HA THR 23 3.669 2.546 -0.940
168 HB THR 23 HB THR 23 1.432 2.806 0.983
169 HG1 THR 23 1HG THR 23 3.355 4.855 0.614
170 1HG2 THR 23 1HG2 THR 23 4.418 2.759 1.328
171 2HG2 THR 23 2HG2 THR 23 3.321 1.393 1.525
172 3HG2 THR 23 3HG2 THR 23 3.230 2.764 2.630
173 H TYR 24 H TYR 24 0.197 2.836 -1.458
174 HA TYR 24 HA TYR 24 -0.438 0.108 -1.163
175 1HB TYR 24 2HB TYR 24 -2.118 1.933 -1.215
176 2HB TYR 24 1HB TYR 24 -1.791 2.160 -2.928
177 HD1 TYR 24 1HD TYR 24 -3.662 1.481 -4.112
178 HD2 TYR 24 2HD TYR 24 -2.285 -0.929 -0.887
179 HE1 TYR 24 1HE TYR 24 -5.356 -0.214 -4.662
180 HE2 TYR 24 2HE TYR 24 -3.976 -2.631 -1.428
181 HH TYR 24 HH TYR 24 -5.565 -2.804 -4.273
182 H LEU 25 H LEU 25 0.887 1.983 -3.776
183 HA LEU 25 HA LEU 25 0.559 -0.058 -5.775
184 1HB LEU 25 2HB LEU 25 2.237 2.450 -5.679
185 2HB LEU 25 1HB LEU 25 2.185 1.378 -7.066
186 HG LEU 25 HG LEU 25 -0.332 2.601 -5.977
187 1HD1 LEU 25 1HD1 LEU 25 0.149 4.222 -8.016
188 2HD1 LEU 25 2HD1 LEU 25 1.820 3.898 -7.554
189 3HD1 LEU 25 3HD1 LEU 25 0.700 4.588 -6.381
190 1HD2 LEU 25 1HD2 LEU 25 -0.952 2.367 -8.415
191 2HD2 LEU 25 2HD2 LEU 25 -0.733 0.860 -7.525
192 3HD2 LEU 25 3HD2 LEU 25 0.532 1.434 -8.611
193 H ALA 26 H ALA 26 3.137 1.088 -3.671
194 HA ALA 26 HA ALA 26 5.179 -0.568 -4.646
195 1HB ALA 26 1HB ALA 26 5.729 1.321 -3.276
196 2HB ALA 26 2HB ALA 26 6.264 -0.138 -2.443
197 3HB ALA 26 3HB ALA 26 4.787 0.678 -1.930
198 H HIS 27 H HIS 27 2.649 -1.075 -2.241
199 HA HIS 27 HA HIS 27 3.652 -3.478 -1.162
200 1HB HIS 27 2HB HIS 27 1.922 -2.337 0.030
201 2HB HIS 27 1HB HIS 27 0.845 -2.378 -1.361
202 HD1 HIS 27 1HD HIS 27 2.442 -4.812 1.102
203 HD2 HIS 27 2HD HIS 27 -0.844 -4.476 -1.416
204 HE1 HIS 27 1HE HIS 27 1.019 -6.863 1.509
205 H LYS 28 H LYS 28 1.133 -2.964 -3.638
206 HA LYS 28 HA LYS 28 0.772 -5.658 -4.297
207 1HB LYS 28 2HB LYS 28 -0.503 -3.433 -5.007
208 2HB LYS 28 1HB LYS 28 0.513 -3.593 -6.432
209 1HG LYS 28 2HG LYS 28 -0.577 -5.435 -7.175
210 2HG LYS 28 1HG LYS 28 -0.951 -6.007 -5.547
211 1HD LYS 28 2HD LYS 28 -2.252 -3.484 -6.332
212 2HD LYS 28 1HD LYS 28 -2.767 -4.914 -7.231
213 1HE LYS 28 2HE LYS 28 -4.200 -4.621 -5.318
214 2HE LYS 28 1HE LYS 28 -3.206 -6.059 -5.085
215 1HZ LYS 28 1HZ LYS 28 -3.246 -4.827 -3.062
216 2HZ LYS 28 2HZ LYS 28 -2.806 -3.393 -3.843
217 3HZ LYS 28 3HZ LYS 28 -1.697 -4.665 -3.724
218 H GLN 29 H GLN 29 3.144 -3.311 -5.352
219 HA GLN 29 HA GLN 29 4.183 -5.045 -7.425
220 1HB GLN 29 2HB GLN 29 4.210 -2.317 -7.013
221 2HB GLN 29 1HB GLN 29 5.864 -2.785 -6.641
222 1HG GLN 29 2HG GLN 29 5.651 -2.158 -8.966
223 2HG GLN 29 1HG GLN 29 6.049 -3.869 -8.820
224 1HE2 GLN 29 1HE2 GLN 29 3.780 -1.556 -9.921
225 2HE2 GLN 29 2HE2 GLN 29 2.652 -2.661 -10.623
226 H PHE 30 H PHE 30 4.549 -4.873 -4.092
227 HA PHE 30 HA PHE 30 7.259 -6.012 -4.225
228 1HB PHE 30 2HB PHE 30 5.844 -4.380 -2.156
229 2HB PHE 30 1HB PHE 30 7.097 -5.504 -1.647
230 HD1 PHE 30 1HD PHE 30 6.830 -3.276 -4.622
231 HD2 PHE 30 2HD PHE 30 8.965 -4.288 -1.082
232 HE1 PHE 30 1HE PHE 30 8.550 -1.610 -5.187
233 HE2 PHE 30 2HE PHE 30 10.689 -2.623 -1.641
234 HZ PHE 30 HZ PHE 30 10.483 -1.281 -3.697
235 H TYR 31 H TYR 31 4.305 -6.287 -2.231
236 HA TYR 31 HA TYR 31 4.997 -8.916 -1.342
237 1HB TYR 31 2HB TYR 31 3.386 -6.995 -0.344
238 2HB TYR 31 1HB TYR 31 2.183 -8.019 -1.121
239 HD1 TYR 31 1HD TYR 31 5.072 -8.205 1.231
240 HD2 TYR 31 2HD TYR 31 1.346 -9.863 0.018
241 HE1 TYR 31 1HE TYR 31 5.123 -9.721 3.166
242 HE2 TYR 31 2HE TYR 31 1.386 -11.383 1.949
243 HH TYR 31 HH TYR 31 2.868 -11.066 4.510
244 H HIS 32 H HIS 32 2.581 -7.631 -3.612
245 HA HIS 32 HA HIS 32 1.929 -10.352 -4.452
246 1HB HIS 32 2HB HIS 32 0.683 -7.727 -5.289
247 2HB HIS 32 1HB HIS 32 0.083 -9.332 -5.687
248 HD1 HIS 32 1HD HIS 32 -1.326 -10.529 -3.901
249 HD2 HIS 32 2HD HIS 32 0.327 -6.947 -2.600
250 HE1 HIS 32 1HE HIS 32 -2.433 -9.996 -1.687
251 H LYS 33 H LYS 33 4.504 -9.581 -5.107
252 HA LYS 33 HA LYS 33 4.487 -9.992 -7.930
253 1HB LYS 33 2HB LYS 33 4.130 -7.451 -7.563
254 2HB LYS 33 1HB LYS 33 5.824 -7.436 -7.092
255 1HG LYS 33 2HG LYS 33 5.753 -6.842 -9.373
256 2HG LYS 33 1HG LYS 33 6.342 -8.504 -9.308
257 1HD LYS 33 2HD LYS 33 3.798 -9.086 -9.582
258 2HD LYS 33 1HD LYS 33 3.712 -7.453 -10.247
259 1HE LYS 33 2HE LYS 33 4.072 -9.254 -11.944
260 2HE LYS 33 1HE LYS 33 5.292 -7.980 -11.950
261 1HZ LYS 33 1HZ LYS 33 6.030 -10.432 -12.054
262 2HZ LYS 33 2HZ LYS 33 5.734 -10.439 -10.389
263 3HZ LYS 33 3HZ LYS 33 6.871 -9.369 -11.040
264 H ASN 34 H ASN 34 5.509 -11.489 -5.872
265 HA ASN 34 HA ASN 34 8.216 -11.804 -6.686
266 1HB ASN 34 2HB ASN 34 9.295 -11.385 -4.517
267 2HB ASN 34 1HB ASN 34 8.556 -9.920 -5.156
268 1HD2 ASN 34 1HD2 ASN 34 9.060 -9.708 -2.651
269 2HD2 ASN 34 2HD2 ASN 34 7.673 -9.942 -1.649
270 H LYS 35 H LYS 35 5.804 -13.366 -6.491
271 HA LYS 35 HA LYS 35 6.536 -15.359 -4.457
272 1HB LYS 35 2HB LYS 35 3.970 -14.577 -5.749
273 2HB LYS 35 1HB LYS 35 4.171 -16.263 -5.293
274 1HG LYS 35 2HG LYS 35 4.363 -15.747 -3.021
275 2HG LYS 35 1HG LYS 35 4.677 -14.041 -3.346
276 1HD LYS 35 2HD LYS 35 2.276 -14.195 -4.458
277 2HD LYS 35 1HD LYS 35 2.107 -15.538 -3.325
278 1HE LYS 35 2HE LYS 35 2.880 -12.710 -2.613
279 2HE LYS 35 1HE LYS 35 1.293 -13.436 -2.368
280 1HZ LYS 35 1HZ LYS 35 3.172 -13.379 -0.500
281 2HZ LYS 35 2HZ LYS 35 3.547 -14.865 -1.215
282 3HZ LYS 35 3HZ LYS 35 1.999 -14.597 -0.588
283 HA PRO 36 HA PRO 36 8.014 -17.323 -8.345
284 1HB PRO 36 2HB PRO 36 10.013 -18.722 -7.161
285 2HB PRO 36 1HB PRO 36 10.190 -17.036 -7.661
286 1HG PRO 36 2HG PRO 36 9.617 -18.156 -4.944
287 2HG PRO 36 1HG PRO 36 10.726 -16.851 -5.405
288 1HD PRO 36 2HD PRO 36 8.270 -16.378 -4.364
289 2HD PRO 36 1HD PRO 36 9.034 -15.291 -5.542
Start of MODEL 12
1 1H GLY 1 1HT GLY 1 -18.775 16.123 3.629
2 2H GLY 1 2HT GLY 1 -17.925 17.514 4.077
3 3H GLY 1 3HT GLY 1 -17.096 16.188 3.435
4 1HA GLY 1 1HA GLY 1 -18.838 18.127 2.060
5 2HA GLY 1 2HA GLY 1 -17.200 17.642 1.650
6 H SER 2 H SER 2 -17.559 16.995 -0.428
7 HA SER 2 HA SER 2 -19.731 15.212 -1.082
8 1HB SER 2 2HB SER 2 -19.198 16.728 -2.811
9 2HB SER 2 1HB SER 2 -17.468 16.425 -2.660
10 HG SER 2 HG SER 2 -19.433 14.633 -3.651
11 H ALA 3 H ALA 3 -19.526 13.077 -1.844
12 HA ALA 3 HA ALA 3 -16.954 11.745 -1.479
13 1HB ALA 3 1HB ALA 3 -18.641 11.725 0.613
14 2HB ALA 3 2HB ALA 3 -17.537 10.401 0.239
15 3HB ALA 3 3HB ALA 3 -19.225 10.310 -0.263
16 H ALA 4 H ALA 4 -16.796 11.172 -3.598
17 HA ALA 4 HA ALA 4 -19.046 9.840 -4.895
18 1HB ALA 4 1HB ALA 4 -16.467 11.004 -5.867
19 2HB ALA 4 2HB ALA 4 -18.119 11.379 -6.358
20 3HB ALA 4 3HB ALA 4 -17.370 9.867 -6.870
21 H GLU 5 H GLU 5 -15.613 9.226 -4.194
22 HA GLU 5 HA GLU 5 -15.764 6.674 -3.282
23 1HB GLU 5 2HB GLU 5 -15.070 5.381 -5.413
24 2HB GLU 5 1HB GLU 5 -16.774 5.737 -5.167
25 1HG GLU 5 2HG GLU 5 -16.889 7.065 -6.964
26 2HG GLU 5 1HG GLU 5 -15.309 7.785 -6.661
27 H VAL 6 H VAL 6 -14.081 8.310 -2.443
28 HA VAL 6 HA VAL 6 -11.555 8.115 -3.919
29 HB VAL 6 HB VAL 6 -12.057 9.714 -1.411
30 1HG1 VAL 6 1HG1 VAL 6 -9.951 10.426 -1.606
31 2HG1 VAL 6 2HG1 VAL 6 -10.120 10.703 -3.341
32 3HG1 VAL 6 3HG1 VAL 6 -9.719 9.095 -2.738
33 1HG2 VAL 6 1HG2 VAL 6 -13.547 10.804 -2.745
34 2HG2 VAL 6 2HG2 VAL 6 -12.753 10.298 -4.235
35 3HG2 VAL 6 3HG2 VAL 6 -12.071 11.610 -3.275
36 H MET 7 H MET 7 -12.738 5.839 -2.497
37 HA MET 7 HA MET 7 -11.048 5.478 -0.168
38 1HB MET 7 2HB MET 7 -12.947 3.500 -1.433
39 2HB MET 7 1HB MET 7 -12.247 3.413 0.178
40 1HG MET 7 2HG MET 7 -13.482 5.817 0.290
41 2HG MET 7 1HG MET 7 -14.548 4.943 -0.808
42 1HE MET 7 1HE MET 7 -14.345 6.223 2.195
43 2HE MET 7 2HE MET 7 -14.914 5.119 3.448
44 3HE MET 7 3HE MET 7 -16.025 5.689 2.202
45 H LYS 8 H LYS 8 -8.970 5.066 -0.621
46 HA LYS 8 HA LYS 8 -8.361 2.701 -2.192
47 1HB LYS 8 2HB LYS 8 -6.735 3.780 -3.606
48 2HB LYS 8 1HB LYS 8 -8.282 4.591 -3.799
49 1HG LYS 8 2HG LYS 8 -5.924 5.571 -2.209
50 2HG LYS 8 1HG LYS 8 -6.513 6.215 -3.737
51 1HD LYS 8 2HD LYS 8 -8.751 6.459 -2.325
52 2HD LYS 8 1HD LYS 8 -7.597 6.527 -0.991
53 1HE LYS 8 2HE LYS 8 -7.838 8.360 -3.358
54 2HE LYS 8 1HE LYS 8 -7.929 8.762 -1.644
55 1HZ LYS 8 1HZ LYS 8 -5.819 9.437 -2.157
56 2HZ LYS 8 2HZ LYS 8 -5.568 8.214 -3.300
57 3HZ LYS 8 3HZ LYS 8 -5.504 7.853 -1.648
58 H LYS 9 H LYS 9 -5.780 2.479 -2.163
59 HA LYS 9 HA LYS 9 -3.889 2.148 -0.936
60 1HB LYS 9 2HB LYS 9 -4.780 3.977 1.244
61 2HB LYS 9 1HB LYS 9 -3.180 3.747 0.561
62 1HG LYS 9 2HG LYS 9 -4.214 4.851 -1.550
63 2HG LYS 9 1HG LYS 9 -5.426 5.440 -0.409
64 1HD LYS 9 2HD LYS 9 -2.631 5.764 0.449
65 2HD LYS 9 1HD LYS 9 -3.102 6.716 -0.960
66 1HE LYS 9 2HE LYS 9 -3.406 7.794 1.330
67 2HE LYS 9 1HE LYS 9 -4.776 7.850 0.221
68 1HZ LYS 9 1HZ LYS 9 -4.522 5.699 2.228
69 2HZ LYS 9 2HZ LYS 9 -5.908 6.235 1.422
70 3HZ LYS 9 3HZ LYS 9 -5.211 7.190 2.630
71 H TYR 10 H TYR 10 -5.826 0.298 -0.662
72 HA TYR 10 HA TYR 10 -5.343 -0.673 2.019
73 1HB TYR 10 2HB TYR 10 -7.383 0.674 2.318
74 2HB TYR 10 1HB TYR 10 -8.177 -0.247 1.046
75 HD1 TYR 10 1HD TYR 10 -7.628 0.009 4.526
76 HD2 TYR 10 2HD TYR 10 -8.311 -2.829 1.431
77 HE1 TYR 10 1HE TYR 10 -8.397 -1.621 6.198
78 HE2 TYR 10 2HE TYR 10 -9.083 -4.467 3.095
79 HH TYR 10 HH TYR 10 -8.902 -4.931 5.444
80 H CYS 11 H CYS 11 -5.021 -2.813 1.970
81 HA CYS 11 HA CYS 11 -5.679 -4.232 -0.502
82 1HB CYS 11 2HB CYS 11 -3.350 -4.279 0.617
83 2HB CYS 11 1HB CYS 11 -4.078 -5.387 1.769
84 H SER 12 H SER 12 -7.351 -5.545 -0.635
85 HA SER 12 HA SER 12 -8.940 -6.144 1.689
86 1HB SER 12 2HB SER 12 -10.528 -7.089 0.155
87 2HB SER 12 1HB SER 12 -9.897 -5.618 -0.586
88 HG SER 12 HG SER 12 -9.742 -7.079 -2.175
89 H THR 13 H THR 13 -6.461 -7.704 -0.120
90 HA THR 13 HA THR 13 -7.128 -10.371 0.736
91 HB THR 13 HB THR 13 -4.546 -9.402 -0.494
92 HG1 THR 13 1HG THR 13 -6.905 -10.324 -1.770
93 1HG2 THR 13 1HG2 THR 13 -3.902 -11.511 -0.543
94 2HG2 THR 13 2HG2 THR 13 -5.392 -11.981 -1.361
95 3HG2 THR 13 3HG2 THR 13 -5.327 -11.946 0.401
96 H CYS 14 H CYS 14 -4.763 -7.881 1.619
97 HA CYS 14 HA CYS 14 -3.826 -9.590 3.813
98 1HB CYS 14 2HB CYS 14 -2.681 -6.957 2.873
99 2HB CYS 14 1HB CYS 14 -1.941 -8.094 3.994
100 H ASP 15 H ASP 15 -6.167 -7.329 3.338
101 HA ASP 15 HA ASP 15 -7.344 -5.906 4.656
102 1HB ASP 15 2HB ASP 15 -6.252 -7.742 6.795
103 2HB ASP 15 1HB ASP 15 -7.574 -6.604 7.023
104 H ILE 16 H ILE 16 -4.790 -5.002 3.956
105 HA ILE 16 HA ILE 16 -3.910 -3.560 6.368
106 HB ILE 16 HB ILE 16 -2.342 -3.743 3.808
107 1HG1 ILE 16 2HG1 ILE 16 -2.825 -6.033 4.635
108 2HG1 ILE 16 1HG1 ILE 16 -1.116 -5.626 4.730
109 1HG2 ILE 16 1HG2 ILE 16 -1.749 -2.953 6.637
110 2HG2 ILE 16 2HG2 ILE 16 -1.471 -2.050 5.147
111 3HG2 ILE 16 3HG2 ILE 16 -0.461 -3.443 5.534
112 1HD1 ILE 16 1HD1 ILE 16 -1.351 -5.185 7.114
113 2HD1 ILE 16 2HD1 ILE 16 -1.857 -6.825 6.706
114 3HD1 ILE 16 3HD1 ILE 16 -3.067 -5.580 7.019
115 H SER 17 H SER 17 -3.169 -1.308 5.999
116 HA SER 17 HA SER 17 -4.654 0.008 3.828
117 1HB SER 17 2HB SER 17 -4.780 1.907 5.738
118 2HB SER 17 1HB SER 17 -6.039 0.695 5.505
119 HG SER 17 HG SER 17 -5.285 -0.436 7.214
120 H PHE 18 H PHE 18 -3.858 2.175 3.302
121 HA PHE 18 HA PHE 18 -1.114 2.733 4.114
122 1HB PHE 18 2HB PHE 18 -2.060 2.365 1.267
123 2HB PHE 18 1HB PHE 18 -0.532 3.120 1.695
124 HD1 PHE 18 1HD PHE 18 0.805 1.587 3.537
125 HD2 PHE 18 2HD PHE 18 -1.908 0.209 0.561
126 HE1 PHE 18 1HE PHE 18 1.863 -0.635 3.605
127 HE2 PHE 18 2HE PHE 18 -0.856 -2.014 0.624
128 HZ PHE 18 HZ PHE 18 1.032 -2.439 2.147
129 H ASN 19 H ASN 19 -0.650 4.891 4.191
130 HA ASN 19 HA ASN 19 -2.887 6.703 3.679
131 1HB ASN 19 2HB ASN 19 -0.519 6.735 5.468
132 2HB ASN 19 1HB ASN 19 -1.044 8.296 4.842
133 1HD2 ASN 19 1HD2 ASN 19 -2.287 5.374 6.406
134 2HD2 ASN 19 2HD2 ASN 19 -3.476 6.183 7.363
135 H TYR 20 H TYR 20 -0.842 5.526 1.691
136 HA TYR 20 HA TYR 20 -0.584 7.945 0.137
137 1HB TYR 20 2HB TYR 20 1.805 6.402 1.131
138 2HB TYR 20 1HB TYR 20 1.875 7.392 -0.320
139 HD1 TYR 20 1HD TYR 20 0.900 9.866 0.048
140 HD2 TYR 20 2HD TYR 20 2.498 7.373 3.103
141 HE1 TYR 20 1HE TYR 20 1.358 11.853 1.421
142 HE2 TYR 20 2HE TYR 20 2.960 9.353 4.486
143 HH TYR 20 HH TYR 20 1.627 12.147 4.201
144 H VAL 21 H VAL 21 -1.310 7.399 -1.801
145 HA VAL 21 HA VAL 21 -1.904 4.864 -2.690
146 HB VAL 21 HB VAL 21 -1.076 7.065 -4.576
147 1HG1 VAL 21 1HG1 VAL 21 -2.402 6.024 -6.158
148 2HG1 VAL 21 2HG1 VAL 21 -3.356 5.169 -4.947
149 3HG1 VAL 21 3HG1 VAL 21 -1.707 4.650 -5.297
150 1HG2 VAL 21 1HG2 VAL 21 -3.550 6.807 -2.902
151 2HG2 VAL 21 2HG2 VAL 21 -3.579 7.650 -4.451
152 3HG2 VAL 21 3HG2 VAL 21 -2.524 8.218 -3.158
153 H LYS 22 H LYS 22 1.147 6.517 -2.737
154 HA LYS 22 HA LYS 22 2.462 4.931 -4.671
155 1HB LYS 22 2HB LYS 22 3.687 6.359 -2.304
156 2HB LYS 22 1HB LYS 22 4.524 5.838 -3.759
157 1HG LYS 22 2HG LYS 22 4.199 7.923 -4.472
158 2HG LYS 22 1HG LYS 22 2.540 7.409 -4.781
159 1HD LYS 22 2HD LYS 22 2.313 8.039 -2.192
160 2HD LYS 22 1HD LYS 22 3.633 9.126 -2.629
161 1HE LYS 22 2HE LYS 22 1.973 10.515 -3.237
162 2HE LYS 22 1HE LYS 22 1.935 9.529 -4.699
163 1HZ LYS 22 1HZ LYS 22 0.170 9.323 -2.328
164 2HZ LYS 22 2HZ LYS 22 0.247 8.123 -3.518
165 3HZ LYS 22 3HZ LYS 22 -0.270 9.683 -3.922
166 H THR 23 H THR 23 2.074 4.645 -1.175
167 HA THR 23 HA THR 23 3.791 2.405 -0.886
168 HB THR 23 HB THR 23 1.487 3.222 0.893
169 HG1 THR 23 1HG THR 23 3.008 4.914 0.560
170 1HG2 THR 23 1HG2 THR 23 2.428 0.991 1.380
171 2HG2 THR 23 2HG2 THR 23 2.667 2.157 2.680
172 3HG2 THR 23 3HG2 THR 23 4.006 1.746 1.608
173 H TYR 24 H TYR 24 0.332 2.773 -1.439
174 HA TYR 24 HA TYR 24 -0.358 0.054 -1.158
175 1HB TYR 24 2HB TYR 24 -1.980 1.965 -1.217
176 2HB TYR 24 1HB TYR 24 -1.688 2.101 -2.945
177 HD1 TYR 24 1HD TYR 24 -3.815 1.583 -3.813
178 HD2 TYR 24 2HD TYR 24 -2.012 -1.035 -0.985
179 HE1 TYR 24 1HE TYR 24 -5.572 -0.082 -4.242
180 HE2 TYR 24 2HE TYR 24 -3.764 -2.708 -1.407
181 HH TYR 24 HH TYR 24 -6.585 -2.128 -2.706
182 H LEU 25 H LEU 25 1.031 1.916 -3.746
183 HA LEU 25 HA LEU 25 0.652 -0.088 -5.770
184 1HB LEU 25 2HB LEU 25 2.150 2.492 -5.567
185 2HB LEU 25 1HB LEU 25 2.563 1.376 -6.855
186 HG LEU 25 HG LEU 25 -0.277 2.258 -6.443
187 1HD1 LEU 25 1HD1 LEU 25 1.508 3.645 -8.388
188 2HD1 LEU 25 2HD1 LEU 25 1.476 4.174 -6.706
189 3HD1 LEU 25 3HD1 LEU 25 -0.006 4.186 -7.663
190 1HD2 LEU 25 1HD2 LEU 25 -0.375 0.612 -7.999
191 2HD2 LEU 25 2HD2 LEU 25 1.297 0.843 -8.511
192 3HD2 LEU 25 3HD2 LEU 25 0.042 1.946 -9.074
193 H ALA 26 H ALA 26 3.274 0.968 -3.665
194 HA ALA 26 HA ALA 26 5.246 -0.772 -4.645
195 1HB ALA 26 1HB ALA 26 6.231 0.835 -3.384
196 2HB ALA 26 2HB ALA 26 6.080 -0.403 -2.136
197 3HB ALA 26 3HB ALA 26 4.896 0.901 -2.232
198 H HIS 27 H HIS 27 2.662 -1.185 -2.309
199 HA HIS 27 HA HIS 27 3.640 -3.592 -1.163
200 1HB HIS 27 2HB HIS 27 1.999 -2.381 0.075
201 2HB HIS 27 1HB HIS 27 0.879 -2.375 -1.285
202 HD1 HIS 27 1HD HIS 27 2.340 -4.769 1.275
203 HD2 HIS 27 2HD HIS 27 -0.802 -4.505 -1.428
204 HE1 HIS 27 1HE HIS 27 0.885 -6.799 1.672
205 H LYS 28 H LYS 28 1.451 -2.896 -3.854
206 HA LYS 28 HA LYS 28 0.835 -5.641 -4.356
207 1HB LYS 28 2HB LYS 28 -0.382 -3.379 -5.066
208 2HB LYS 28 1HB LYS 28 0.586 -3.607 -6.516
209 1HG LYS 28 2HG LYS 28 -1.209 -4.780 -7.186
210 2HG LYS 28 1HG LYS 28 -0.439 -6.074 -6.266
211 1HD LYS 28 2HD LYS 28 -2.436 -6.203 -5.234
212 2HD LYS 28 1HD LYS 28 -1.838 -4.821 -4.313
213 1HE LYS 28 2HE LYS 28 -3.614 -4.766 -6.747
214 2HE LYS 28 1HE LYS 28 -4.053 -4.325 -5.098
215 1HZ LYS 28 1HZ LYS 28 -2.021 -2.912 -6.739
216 2HZ LYS 28 2HZ LYS 28 -2.562 -2.460 -5.201
217 3HZ LYS 28 3HZ LYS 28 -3.616 -2.392 -6.521
218 H GLN 29 H GLN 29 3.216 -3.358 -5.554
219 HA GLN 29 HA GLN 29 4.164 -5.183 -7.592
220 1HB GLN 29 2HB GLN 29 4.184 -2.472 -7.390
221 2HB GLN 29 1HB GLN 29 5.826 -2.851 -6.891
222 1HG GLN 29 2HG GLN 29 6.161 -4.104 -8.968
223 2HG GLN 29 1HG GLN 29 4.521 -3.695 -9.469
224 1HE2 GLN 29 1HE2 GLN 29 4.311 -1.982 -10.713
225 2HE2 GLN 29 2HE2 GLN 29 5.444 -0.685 -10.864
226 H PHE 30 H PHE 30 4.735 -4.739 -4.274
227 HA PHE 30 HA PHE 30 7.347 -6.083 -4.499
228 1HB PHE 30 2HB PHE 30 7.164 -3.755 -3.381
229 2HB PHE 30 1HB PHE 30 6.430 -4.624 -2.036
230 HD1 PHE 30 1HD PHE 30 9.408 -3.349 -3.243
231 HD2 PHE 30 2HD PHE 30 7.827 -6.816 -1.348
232 HE1 PHE 30 1HE PHE 30 11.648 -3.896 -2.384
233 HE2 PHE 30 2HE PHE 30 10.064 -7.369 -0.484
234 HZ PHE 30 HZ PHE 30 11.978 -5.908 -1.002
235 H TYR 31 H TYR 31 4.440 -5.902 -2.440
236 HA TYR 31 HA TYR 31 5.073 -8.326 -1.061
237 1HB TYR 31 2HB TYR 31 3.492 -6.246 -0.446
238 2HB TYR 31 1HB TYR 31 2.273 -7.339 -1.093
239 HD1 TYR 31 1HD TYR 31 4.755 -6.843 1.573
240 HD2 TYR 31 2HD TYR 31 1.649 -9.342 0.087
241 HE1 TYR 31 1HE TYR 31 4.684 -8.026 3.728
242 HE2 TYR 31 2HE TYR 31 1.568 -10.531 2.238
243 HH TYR 31 HH TYR 31 2.953 -10.953 4.162
244 H HIS 32 H HIS 32 2.824 -7.457 -3.662
245 HA HIS 32 HA HIS 32 2.132 -10.285 -3.978
246 1HB HIS 32 2HB HIS 32 0.899 -7.790 -5.156
247 2HB HIS 32 1HB HIS 32 0.363 -9.426 -5.520
248 HD1 HIS 32 1HD HIS 32 -1.227 -10.514 -3.852
249 HD2 HIS 32 2HD HIS 32 0.438 -6.970 -2.461
250 HE1 HIS 32 1HE HIS 32 -2.451 -9.942 -1.711
251 H LYS 33 H LYS 33 4.685 -8.850 -4.860
252 HA LYS 33 HA LYS 33 6.079 -8.738 -6.666
253 1HB LYS 33 2HB LYS 33 5.535 -11.281 -6.151
254 2HB LYS 33 1HB LYS 33 4.819 -11.211 -7.756
255 1HG LYS 33 2HG LYS 33 6.934 -11.875 -8.282
256 2HG LYS 33 1HG LYS 33 7.128 -10.124 -8.383
257 1HD LYS 33 2HD LYS 33 7.568 -11.304 -5.719
258 2HD LYS 33 1HD LYS 33 8.748 -11.751 -6.953
259 1HE LYS 33 2HE LYS 33 7.986 -8.963 -6.094
260 2HE LYS 33 1HE LYS 33 9.516 -9.784 -5.790
261 1HZ LYS 33 1HZ LYS 33 8.501 -8.605 -8.274
262 2HZ LYS 33 2HZ LYS 33 9.535 -9.939 -8.384
263 3HZ LYS 33 3HZ LYS 33 10.052 -8.532 -7.601
264 H ASN 34 H ASN 34 3.823 -7.176 -7.074
265 HA ASN 34 HA ASN 34 2.584 -6.125 -8.674
266 1HB ASN 34 2HB ASN 34 4.933 -5.753 -9.481
267 2HB ASN 34 1HB ASN 34 4.725 -7.135 -10.553
268 1HD2 ASN 34 1HD2 ASN 34 4.476 -6.437 -12.542
269 2HD2 ASN 34 2HD2 ASN 34 3.478 -5.119 -13.043
270 H LYS 35 H LYS 35 1.957 -8.943 -8.153
271 HA LYS 35 HA LYS 35 0.315 -9.387 -10.506
272 1HB LYS 35 2HB LYS 35 0.988 -11.796 -10.626
273 2HB LYS 35 1HB LYS 35 2.238 -10.667 -11.131
274 1HG LYS 35 2HG LYS 35 3.398 -12.189 -9.837
275 2HG LYS 35 1HG LYS 35 3.090 -10.868 -8.707
276 1HD LYS 35 2HD LYS 35 1.688 -12.108 -7.440
277 2HD LYS 35 1HD LYS 35 1.014 -12.958 -8.833
278 1HE LYS 35 2HE LYS 35 2.517 -14.637 -8.699
279 2HE LYS 35 1HE LYS 35 3.828 -13.563 -8.213
280 1HZ LYS 35 1HZ LYS 35 1.668 -14.070 -6.300
281 2HZ LYS 35 2HZ LYS 35 3.307 -13.768 -6.018
282 3HZ LYS 35 3HZ LYS 35 2.810 -15.293 -6.554
283 HA PRO 36 HA PRO 36 -2.594 -10.630 -7.432
284 1HB PRO 36 2HB PRO 36 -4.224 -12.239 -8.889
285 2HB PRO 36 1HB PRO 36 -4.210 -10.480 -9.058
286 1HG PRO 36 2HG PRO 36 -2.877 -12.556 -10.754
287 2HG PRO 36 1HG PRO 36 -3.765 -11.104 -11.254
288 1HD PRO 36 2HD PRO 36 -1.062 -11.204 -11.190
289 2HD PRO 36 1HD PRO 36 -1.969 -9.714 -10.856
Start of MODEL 13
1 1H GLY 1 1HT GLY 1 -20.950 3.434 -11.900
2 2H GLY 1 2HT GLY 1 -21.855 2.009 -11.807
3 3H GLY 1 3HT GLY 1 -20.239 1.953 -12.304
4 1HA GLY 1 1HA GLY 1 -19.424 2.448 -10.177
5 2HA GLY 1 2HA GLY 1 -21.018 2.946 -9.630
6 H SER 2 H SER 2 -20.426 0.078 -11.558
7 HA SER 2 HA SER 2 -21.552 -1.546 -9.415
8 1HB SER 2 2HB SER 2 -22.317 -1.675 -11.853
9 2HB SER 2 1HB SER 2 -20.793 -2.502 -12.173
10 HG SER 2 HG SER 2 -22.539 -3.944 -11.719
11 H ALA 3 H ALA 3 -20.583 -3.739 -9.055
12 HA ALA 3 HA ALA 3 -18.861 -5.033 -8.322
13 1HB ALA 3 1HB ALA 3 -18.329 -4.823 -10.823
14 2HB ALA 3 2HB ALA 3 -17.040 -5.362 -9.745
15 3HB ALA 3 3HB ALA 3 -17.070 -3.695 -10.320
16 H ALA 4 H ALA 4 -18.661 -4.141 -6.279
17 HA ALA 4 HA ALA 4 -17.241 -1.749 -5.726
18 1HB ALA 4 1HB ALA 4 -17.867 -2.075 -3.583
19 2HB ALA 4 2HB ALA 4 -17.404 -3.776 -3.591
20 3HB ALA 4 3HB ALA 4 -18.939 -3.277 -4.301
21 H GLU 5 H GLU 5 -15.146 -1.379 -5.256
22 HA GLU 5 HA GLU 5 -13.222 -2.991 -4.225
23 1HB GLU 5 2HB GLU 5 -11.962 -3.646 -6.389
24 2HB GLU 5 1HB GLU 5 -13.306 -4.651 -5.864
25 1HG GLU 5 2HG GLU 5 -14.520 -4.191 -7.681
26 2HG GLU 5 1HG GLU 5 -14.080 -2.484 -7.664
27 H VAL 6 H VAL 6 -13.325 -0.544 -3.762
28 HA VAL 6 HA VAL 6 -12.109 1.235 -5.623
29 HB VAL 6 HB VAL 6 -13.591 2.074 -3.877
30 1HG1 VAL 6 1HG1 VAL 6 -11.603 1.832 -1.721
31 2HG1 VAL 6 2HG1 VAL 6 -12.388 0.329 -2.205
32 3HG1 VAL 6 3HG1 VAL 6 -13.360 1.699 -1.669
33 1HG2 VAL 6 1HG2 VAL 6 -12.058 3.674 -4.743
34 2HG2 VAL 6 2HG2 VAL 6 -10.749 3.059 -3.734
35 3HG2 VAL 6 3HG2 VAL 6 -12.109 3.903 -2.996
36 H MET 7 H MET 7 -10.119 0.571 -6.300
37 HA MET 7 HA MET 7 -8.117 -0.351 -4.452
38 1HB MET 7 2HB MET 7 -8.141 0.200 -7.410
39 2HB MET 7 1HB MET 7 -6.649 -0.182 -6.564
40 1HG MET 7 2HG MET 7 -8.849 -2.036 -6.028
41 2HG MET 7 1HG MET 7 -8.314 -1.998 -7.708
42 1HE MET 7 1HE MET 7 -4.916 -2.961 -7.919
43 2HE MET 7 2HE MET 7 -6.494 -2.619 -8.628
44 3HE MET 7 3HE MET 7 -6.101 -4.254 -8.099
45 H LYS 8 H LYS 8 -8.295 1.658 -3.130
46 HA LYS 8 HA LYS 8 -6.902 3.960 -4.266
47 1HB LYS 8 2HB LYS 8 -8.909 4.534 -3.098
48 2HB LYS 8 1HB LYS 8 -8.449 3.565 -1.705
49 1HG LYS 8 2HG LYS 8 -6.525 5.141 -1.366
50 2HG LYS 8 1HG LYS 8 -7.230 6.159 -2.620
51 1HD LYS 8 2HD LYS 8 -7.832 6.868 -0.320
52 2HD LYS 8 1HD LYS 8 -9.232 6.469 -1.319
53 1HE LYS 8 2HE LYS 8 -8.190 4.186 0.168
54 2HE LYS 8 1HE LYS 8 -8.718 5.508 1.209
55 1HZ LYS 8 1HZ LYS 8 -10.478 3.870 0.669
56 2HZ LYS 8 2HZ LYS 8 -10.384 4.341 -0.952
57 3HZ LYS 8 3HZ LYS 8 -10.872 5.454 0.224
58 H LYS 9 H LYS 9 -6.814 2.694 -0.956
59 HA LYS 9 HA LYS 9 -3.982 2.097 -1.159
60 1HB LYS 9 2HB LYS 9 -3.409 3.595 0.741
61 2HB LYS 9 1HB LYS 9 -3.888 4.463 -0.710
62 1HG LYS 9 2HG LYS 9 -6.256 4.393 0.440
63 2HG LYS 9 1HG LYS 9 -5.283 4.208 1.900
64 1HD LYS 9 2HD LYS 9 -3.971 6.233 1.098
65 2HD LYS 9 1HD LYS 9 -5.262 6.472 -0.081
66 1HE LYS 9 2HE LYS 9 -6.799 6.275 2.037
67 2HE LYS 9 1HE LYS 9 -5.324 6.732 2.888
68 1HZ LYS 9 1HZ LYS 9 -5.253 8.778 1.830
69 2HZ LYS 9 2HZ LYS 9 -6.906 8.571 2.124
70 3HZ LYS 9 3HZ LYS 9 -6.280 8.296 0.576
71 H TYR 10 H TYR 10 -5.879 0.268 -0.763
72 HA TYR 10 HA TYR 10 -5.293 -0.684 1.907
73 1HB TYR 10 2HB TYR 10 -7.325 0.591 2.327
74 2HB TYR 10 1HB TYR 10 -8.140 -0.212 0.991
75 HD1 TYR 10 1HD TYR 10 -7.488 -0.272 4.485
76 HD2 TYR 10 2HD TYR 10 -8.431 -2.773 1.175
77 HE1 TYR 10 1HE TYR 10 -8.299 -2.004 6.031
78 HE2 TYR 10 2HE TYR 10 -9.247 -4.510 2.712
79 HH TYR 10 HH TYR 10 -9.038 -5.200 4.992
80 H CYS 11 H CYS 11 -4.885 -2.809 1.809
81 HA CYS 11 HA CYS 11 -5.437 -4.205 -0.667
82 1HB CYS 11 2HB CYS 11 -3.244 -4.364 0.615
83 2HB CYS 11 1HB CYS 11 -4.103 -5.373 1.771
84 H SER 12 H SER 12 -7.074 -5.503 -1.027
85 HA SER 12 HA SER 12 -8.934 -6.129 1.105
86 1HB SER 12 2HB SER 12 -9.403 -5.401 -1.417
87 2HB SER 12 1HB SER 12 -9.352 -7.146 -1.664
88 HG SER 12 HG SER 12 -10.941 -5.902 0.325
89 H THR 13 H THR 13 -6.215 -7.473 0.754
90 HA THR 13 HA THR 13 -7.217 -10.209 0.998
91 HB THR 13 HB THR 13 -4.706 -9.405 -0.477
92 HG1 THR 13 1HG THR 13 -6.431 -9.005 -1.788
93 1HG2 THR 13 1HG2 THR 13 -5.626 -11.968 0.541
94 2HG2 THR 13 2HG2 THR 13 -4.038 -11.482 -0.053
95 3HG2 THR 13 3HG2 THR 13 -5.291 -11.978 -1.191
96 H CYS 14 H CYS 14 -4.752 -7.828 1.778
97 HA CYS 14 HA CYS 14 -3.707 -9.598 3.875
98 1HB CYS 14 2HB CYS 14 -2.602 -6.970 2.869
99 2HB CYS 14 1HB CYS 14 -1.828 -8.044 4.028
100 H ASP 15 H ASP 15 -6.073 -7.348 3.583
101 HA ASP 15 HA ASP 15 -7.201 -5.983 5.000
102 1HB ASP 15 2HB ASP 15 -5.896 -7.800 7.033
103 2HB ASP 15 1HB ASP 15 -7.219 -6.693 7.378
104 H ILE 16 H ILE 16 -4.781 -4.954 4.102
105 HA ILE 16 HA ILE 16 -3.823 -3.450 6.451
106 HB ILE 16 HB ILE 16 -2.255 -3.731 3.902
107 1HG1 ILE 16 2HG1 ILE 16 -2.718 -6.001 4.751
108 2HG1 ILE 16 1HG1 ILE 16 -1.017 -5.580 4.910
109 1HG2 ILE 16 1HG2 ILE 16 -1.421 -1.993 5.232
110 2HG2 ILE 16 2HG2 ILE 16 -0.372 -3.366 5.587
111 3HG2 ILE 16 3HG2 ILE 16 -1.642 -2.909 6.723
112 1HD1 ILE 16 1HD1 ILE 16 -1.640 -6.687 6.896
113 2HD1 ILE 16 2HD1 ILE 16 -3.095 -5.705 7.070
114 3HD1 ILE 16 3HD1 ILE 16 -1.507 -4.975 7.299
115 H SER 17 H SER 17 -3.113 -1.223 5.980
116 HA SER 17 HA SER 17 -4.556 -0.021 3.718
117 1HB SER 17 2HB SER 17 -4.714 1.938 5.627
118 2HB SER 17 1HB SER 17 -6.008 0.801 5.250
119 HG SER 17 HG SER 17 -4.003 0.357 7.209
120 H PHE 18 H PHE 18 -3.771 2.159 3.158
121 HA PHE 18 HA PHE 18 -1.028 2.697 4.014
122 1HB PHE 18 2HB PHE 18 -1.983 2.417 1.161
123 2HB PHE 18 1HB PHE 18 -0.444 3.140 1.608
124 HD1 PHE 18 1HD PHE 18 1.203 1.700 2.921
125 HD2 PHE 18 2HD PHE 18 -2.192 0.122 0.897
126 HE1 PHE 18 1HE PHE 18 2.233 -0.536 2.943
127 HE2 PHE 18 2HE PHE 18 -1.171 -2.115 0.918
128 HZ PHE 18 HZ PHE 18 1.043 -2.448 1.941
129 H ASN 19 H ASN 19 -0.595 4.808 4.289
130 HA ASN 19 HA ASN 19 -2.763 6.692 3.970
131 1HB ASN 19 2HB ASN 19 -0.131 6.673 5.359
132 2HB ASN 19 1HB ASN 19 -0.792 8.240 4.901
133 1HD2 ASN 19 1HD2 ASN 19 -3.122 8.561 5.523
134 2HD2 ASN 19 2HD2 ASN 19 -3.593 8.000 7.087
135 H TYR 20 H TYR 20 -0.624 5.549 1.820
136 HA TYR 20 HA TYR 20 -0.768 7.966 0.212
137 1HB TYR 20 2HB TYR 20 1.795 6.674 1.098
138 2HB TYR 20 1HB TYR 20 1.710 7.521 -0.443
139 HD1 TYR 20 1HD TYR 20 0.031 9.825 0.160
140 HD2 TYR 20 2HD TYR 20 3.062 7.995 2.519
141 HE1 TYR 20 1HE TYR 20 0.415 11.963 1.312
142 HE2 TYR 20 2HE TYR 20 3.455 10.128 3.678
143 HH TYR 20 HH TYR 20 1.334 12.749 3.474
144 H VAL 21 H VAL 21 -1.397 7.454 -1.776
145 HA VAL 21 HA VAL 21 -2.016 4.915 -2.642
146 HB VAL 21 HB VAL 21 -1.197 7.156 -4.491
147 1HG1 VAL 21 1HG1 VAL 21 -3.455 5.366 -5.114
148 2HG1 VAL 21 2HG1 VAL 21 -1.853 4.628 -5.142
149 3HG1 VAL 21 3HG1 VAL 21 -2.199 6.022 -6.165
150 1HG2 VAL 21 1HG2 VAL 21 -3.556 6.848 -2.729
151 2HG2 VAL 21 2HG2 VAL 21 -3.852 7.425 -4.369
152 3HG2 VAL 21 3HG2 VAL 21 -2.754 8.308 -3.308
153 H LYS 22 H LYS 22 1.040 6.593 -2.810
154 HA LYS 22 HA LYS 22 2.306 4.930 -4.711
155 1HB LYS 22 2HB LYS 22 4.430 5.806 -3.643
156 2HB LYS 22 1HB LYS 22 3.322 7.026 -4.255
157 1HG LYS 22 2HG LYS 22 2.729 7.742 -2.151
158 2HG LYS 22 1HG LYS 22 3.167 6.209 -1.392
159 1HD LYS 22 2HD LYS 22 5.383 7.642 -2.692
160 2HD LYS 22 1HD LYS 22 4.680 8.458 -1.294
161 1HE LYS 22 2HE LYS 22 5.628 5.596 -1.310
162 2HE LYS 22 1HE LYS 22 6.583 6.960 -0.731
163 1HZ LYS 22 1HZ LYS 22 5.637 6.204 1.197
164 2HZ LYS 22 2HZ LYS 22 4.194 5.728 0.454
165 3HZ LYS 22 3HZ LYS 22 4.495 7.368 0.740
166 H THR 23 H THR 23 1.861 4.699 -1.238
167 HA THR 23 HA THR 23 3.680 2.538 -0.872
168 HB THR 23 HB THR 23 1.407 2.818 1.005
169 HG1 THR 23 1HG THR 23 2.047 4.782 1.753
170 1HG2 THR 23 1HG2 THR 23 4.369 2.925 1.498
171 2HG2 THR 23 2HG2 THR 23 3.408 1.446 1.505
172 3HG2 THR 23 3HG2 THR 23 3.090 2.710 2.692
173 H TYR 24 H TYR 24 0.214 2.783 -1.453
174 HA TYR 24 HA TYR 24 -0.398 0.056 -1.110
175 1HB TYR 24 2HB TYR 24 -2.078 1.900 -1.244
176 2HB TYR 24 1HB TYR 24 -1.756 2.019 -2.969
177 HD1 TYR 24 1HD TYR 24 -3.710 1.319 -4.021
178 HD2 TYR 24 2HD TYR 24 -2.148 -0.996 -0.812
179 HE1 TYR 24 1HE TYR 24 -5.399 -0.414 -4.458
180 HE2 TYR 24 2HE TYR 24 -3.832 -2.737 -1.241
181 HH TYR 24 HH TYR 24 -5.396 -3.175 -3.878
182 H LEU 25 H LEU 25 0.960 1.882 -3.742
183 HA LEU 25 HA LEU 25 0.674 -0.202 -5.701
184 1HB LEU 25 2HB LEU 25 2.276 2.349 -5.607
185 2HB LEU 25 1HB LEU 25 2.383 1.228 -6.951
186 HG LEU 25 HG LEU 25 -0.195 2.521 -6.067
187 1HD1 LEU 25 1HD1 LEU 25 1.310 3.336 -8.511
188 2HD1 LEU 25 2HD1 LEU 25 1.731 4.038 -6.948
189 3HD1 LEU 25 3HD1 LEU 25 0.097 4.223 -7.588
190 1HD2 LEU 25 1HD2 LEU 25 -0.672 1.896 -8.557
191 2HD2 LEU 25 2HD2 LEU 25 -0.815 0.675 -7.292
192 3HD2 LEU 25 3HD2 LEU 25 0.626 0.729 -8.308
193 H ALA 26 H ALA 26 3.221 1.011 -3.593
194 HA ALA 26 HA ALA 26 5.286 -0.657 -4.487
195 1HB ALA 26 1HB ALA 26 5.378 1.408 -2.944
196 2HB ALA 26 2HB ALA 26 6.511 0.087 -2.657
197 3HB ALA 26 3HB ALA 26 5.077 0.254 -1.644
198 H HIS 27 H HIS 27 2.644 -1.179 -2.236
199 HA HIS 27 HA HIS 27 3.709 -3.569 -1.099
200 1HB HIS 27 2HB HIS 27 2.076 -2.419 0.191
201 2HB HIS 27 1HB HIS 27 0.936 -2.379 -1.151
202 HD1 HIS 27 1HD HIS 27 2.430 -4.826 1.335
203 HD2 HIS 27 2HD HIS 27 -0.735 -4.518 -1.336
204 HE1 HIS 27 1HE HIS 27 0.983 -6.868 1.706
205 H LYS 28 H LYS 28 1.386 -2.899 -3.693
206 HA LYS 28 HA LYS 28 0.848 -5.647 -4.229
207 1HB LYS 28 2HB LYS 28 -0.299 -3.255 -4.959
208 2HB LYS 28 1HB LYS 28 0.442 -3.788 -6.461
209 1HG LYS 28 2HG LYS 28 -1.265 -5.648 -4.856
210 2HG LYS 28 1HG LYS 28 -1.986 -4.470 -5.954
211 1HD LYS 28 2HD LYS 28 -0.285 -5.448 -7.672
212 2HD LYS 28 1HD LYS 28 -0.248 -6.825 -6.569
213 1HE LYS 28 2HE LYS 28 -1.914 -7.396 -8.089
214 2HE LYS 28 1HE LYS 28 -2.815 -6.745 -6.722
215 1HZ LYS 28 1HZ LYS 28 -2.159 -5.328 -9.248
216 2HZ LYS 28 2HZ LYS 28 -2.899 -4.602 -7.912
217 3HZ LYS 28 3HZ LYS 28 -3.690 -5.844 -8.743
218 H GLN 29 H GLN 29 3.295 -3.405 -5.243
219 HA GLN 29 HA GLN 29 4.131 -5.016 -7.494
220 1HB GLN 29 2HB GLN 29 4.701 -2.353 -6.456
221 2HB GLN 29 1HB GLN 29 6.146 -3.180 -7.019
222 1HG GLN 29 2HG GLN 29 3.818 -3.326 -8.811
223 2HG GLN 29 1HG GLN 29 4.524 -1.725 -8.595
224 1HE2 GLN 29 1HE2 GLN 29 4.567 -2.895 -11.043
225 2HE2 GLN 29 2HE2 GLN 29 6.181 -3.355 -11.455
226 H PHE 30 H PHE 30 4.885 -4.807 -4.126
227 HA PHE 30 HA PHE 30 7.268 -6.482 -4.568
228 1HB PHE 30 2HB PHE 30 6.664 -4.342 -2.596
229 2HB PHE 30 1HB PHE 30 7.643 -5.695 -2.046
230 HD1 PHE 30 1HD PHE 30 7.422 -3.143 -4.737
231 HD2 PHE 30 2HD PHE 30 9.923 -5.727 -2.463
232 HE1 PHE 30 1HE PHE 30 9.408 -2.109 -5.756
233 HE2 PHE 30 2HE PHE 30 11.915 -4.698 -3.476
234 HZ PHE 30 HZ PHE 30 11.660 -2.886 -5.125
235 H TYR 31 H TYR 31 4.463 -6.028 -2.431
236 HA TYR 31 HA TYR 31 4.907 -8.477 -1.024
237 1HB TYR 31 2HB TYR 31 3.477 -6.258 -0.460
238 2HB TYR 31 1HB TYR 31 2.186 -7.307 -1.037
239 HD1 TYR 31 1HD TYR 31 4.406 -6.539 1.691
240 HD2 TYR 31 2HD TYR 31 1.833 -9.530 0.099
241 HE1 TYR 31 1HE TYR 31 4.320 -7.629 3.893
242 HE2 TYR 31 2HE TYR 31 1.739 -10.628 2.296
243 HH TYR 31 HH TYR 31 2.064 -10.028 4.670
244 H HIS 32 H HIS 32 3.059 -7.534 -3.841
245 HA HIS 32 HA HIS 32 2.102 -10.311 -4.082
246 1HB HIS 32 2HB HIS 32 0.876 -7.758 -5.138
247 2HB HIS 32 1HB HIS 32 0.300 -9.372 -5.538
248 HD1 HIS 32 1HD HIS 32 -1.214 -10.524 -3.827
249 HD2 HIS 32 2HD HIS 32 0.467 -6.987 -2.436
250 HE1 HIS 32 1HE HIS 32 -2.388 -9.983 -1.649
251 H LYS 33 H LYS 33 4.654 -8.918 -5.007
252 HA LYS 33 HA LYS 33 5.999 -8.808 -6.847
253 1HB LYS 33 2HB LYS 33 4.406 -11.257 -7.625
254 2HB LYS 33 1HB LYS 33 5.997 -10.821 -8.232
255 1HG LYS 33 2HG LYS 33 5.390 -11.407 -5.343
256 2HG LYS 33 1HG LYS 33 6.020 -12.588 -6.492
257 1HD LYS 33 2HD LYS 33 8.097 -11.703 -6.462
258 2HD LYS 33 1HD LYS 33 7.500 -10.046 -6.350
259 1HE LYS 33 2HE LYS 33 6.776 -11.006 -3.926
260 2HE LYS 33 1HE LYS 33 8.237 -11.947 -4.224
261 1HZ LYS 33 1HZ LYS 33 8.266 -9.035 -4.648
262 2HZ LYS 33 2HZ LYS 33 9.544 -10.071 -4.257
263 3HZ LYS 33 3HZ LYS 33 8.406 -9.652 -3.079
264 H ASN 34 H ASN 34 3.835 -7.093 -7.081
265 HA ASN 34 HA ASN 34 2.619 -5.872 -8.571
266 1HB ASN 34 2HB ASN 34 4.895 -5.540 -9.480
267 2HB ASN 34 1HB ASN 34 4.671 -6.942 -10.521
268 1HD2 ASN 34 1HD2 ASN 34 3.962 -6.572 -12.491
269 2HD2 ASN 34 2HD2 ASN 34 3.143 -5.148 -13.026
270 H LYS 35 H LYS 35 0.903 -7.539 -8.208
271 HA LYS 35 HA LYS 35 -0.813 -8.806 -8.996
272 1HB LYS 35 2HB LYS 35 -0.137 -7.017 -11.058
273 2HB LYS 35 1HB LYS 35 -0.359 -8.576 -11.838
274 1HG LYS 35 2HG LYS 35 -2.356 -7.228 -10.031
275 2HG LYS 35 1HG LYS 35 -2.419 -7.260 -11.794
276 1HD LYS 35 2HD LYS 35 -3.181 -9.380 -11.852
277 2HD LYS 35 1HD LYS 35 -2.147 -9.893 -10.517
278 1HE LYS 35 2HE LYS 35 -4.569 -10.008 -9.994
279 2HE LYS 35 1HE LYS 35 -3.664 -8.955 -8.908
280 1HZ LYS 35 1HZ LYS 35 -5.411 -8.128 -11.159
281 2HZ LYS 35 2HZ LYS 35 -4.411 -7.063 -10.308
282 3HZ LYS 35 3HZ LYS 35 -5.671 -7.859 -9.509
283 HA PRO 36 HA PRO 36 1.834 -12.455 -9.733
284 1HB PRO 36 2HB PRO 36 0.278 -14.178 -8.334
285 2HB PRO 36 1HB PRO 36 1.452 -13.107 -7.561
286 1HG PRO 36 2HG PRO 36 -1.509 -12.776 -7.850
287 2HG PRO 36 1HG PRO 36 -0.483 -12.473 -6.436
288 1HD PRO 36 2HD PRO 36 -1.353 -10.488 -8.063
289 2HD PRO 36 1HD PRO 36 0.210 -10.421 -7.225
Start of MODEL 14
1 1H GLY 1 1HT GLY 1 -17.461 -8.609 7.015
2 2H GLY 1 2HT GLY 1 -17.181 -9.531 8.405
3 3H GLY 1 3HT GLY 1 -18.756 -9.341 7.821
4 1HA GLY 1 1HA GLY 1 -17.260 -11.484 7.330
5 2HA GLY 1 2HA GLY 1 -18.553 -10.931 6.277
6 H SER 2 H SER 2 -17.508 -8.783 5.022
7 HA SER 2 HA SER 2 -14.859 -9.267 4.048
8 1HB SER 2 2HB SER 2 -16.033 -11.027 2.818
9 2HB SER 2 1HB SER 2 -17.197 -9.848 2.215
10 HG SER 2 HG SER 2 -15.735 -9.063 0.861
11 H ALA 3 H ALA 3 -14.008 -7.421 3.297
12 HA ALA 3 HA ALA 3 -13.811 -5.237 2.690
13 1HB ALA 3 1HB ALA 3 -16.191 -6.172 1.206
14 2HB ALA 3 2HB ALA 3 -14.694 -5.452 0.615
15 3HB ALA 3 3HB ALA 3 -15.952 -4.428 1.307
16 H ALA 4 H ALA 4 -13.834 -4.162 4.607
17 HA ALA 4 HA ALA 4 -16.444 -3.123 5.500
18 1HB ALA 4 1HB ALA 4 -15.034 -4.867 6.958
19 2HB ALA 4 2HB ALA 4 -16.026 -3.598 7.675
20 3HB ALA 4 3HB ALA 4 -14.286 -3.367 7.506
21 H GLU 5 H GLU 5 -14.782 -1.848 3.616
22 HA GLU 5 HA GLU 5 -14.761 0.757 4.377
23 1HB GLU 5 2HB GLU 5 -12.225 1.101 4.763
24 2HB GLU 5 1HB GLU 5 -13.212 0.556 6.111
25 1HG GLU 5 2HG GLU 5 -12.323 -1.563 6.084
26 2HG GLU 5 1HG GLU 5 -11.853 -1.460 4.388
27 H VAL 6 H VAL 6 -15.391 0.027 2.078
28 HA VAL 6 HA VAL 6 -13.488 -0.529 0.115
29 HB VAL 6 HB VAL 6 -15.987 1.110 -0.310
30 1HG1 VAL 6 1HG1 VAL 6 -14.177 -0.479 -2.086
31 2HG1 VAL 6 2HG1 VAL 6 -14.812 1.152 -2.308
32 3HG1 VAL 6 3HG1 VAL 6 -15.871 -0.243 -2.516
33 1HG2 VAL 6 1HG2 VAL 6 -16.904 -1.251 -0.906
34 2HG2 VAL 6 2HG2 VAL 6 -16.854 -0.734 0.779
35 3HG2 VAL 6 3HG2 VAL 6 -15.612 -1.819 0.152
36 H MET 7 H MET 7 -11.707 0.635 -0.224
37 HA MET 7 HA MET 7 -11.793 3.223 -1.303
38 1HB MET 7 2HB MET 7 -10.683 4.486 0.506
39 2HB MET 7 1HB MET 7 -12.301 3.961 0.952
40 1HG MET 7 2HG MET 7 -11.555 2.543 2.551
41 2HG MET 7 1HG MET 7 -10.059 2.183 1.692
42 1HE MET 7 1HE MET 7 -11.003 2.716 4.581
43 2HE MET 7 2HE MET 7 -11.136 4.417 5.032
44 3HE MET 7 3HE MET 7 -9.640 3.536 5.344
45 H LYS 8 H LYS 8 -9.808 3.858 -2.141
46 HA LYS 8 HA LYS 8 -7.970 1.875 -2.755
47 1HB LYS 8 2HB LYS 8 -6.764 3.499 -3.889
48 2HB LYS 8 1HB LYS 8 -8.371 4.206 -3.834
49 1HG LYS 8 2HG LYS 8 -6.127 4.881 -1.938
50 2HG LYS 8 1HG LYS 8 -6.576 5.824 -3.358
51 1HD LYS 8 2HD LYS 8 -8.971 5.597 -2.090
52 2HD LYS 8 1HD LYS 8 -7.858 5.650 -0.722
53 1HE LYS 8 2HE LYS 8 -8.210 7.886 -1.023
54 2HE LYS 8 1HE LYS 8 -6.826 7.656 -2.089
55 1HZ LYS 8 1HZ LYS 8 -8.244 8.784 -3.454
56 2HZ LYS 8 2HZ LYS 8 -9.640 8.116 -2.771
57 3HZ LYS 8 3HZ LYS 8 -8.696 7.197 -3.831
58 H LYS 9 H LYS 9 -5.449 2.571 -2.339
59 HA LYS 9 HA LYS 9 -3.774 2.119 -0.864
60 1HB LYS 9 2HB LYS 9 -3.550 3.820 0.905
61 2HB LYS 9 1HB LYS 9 -3.940 4.522 -0.654
62 1HG LYS 9 2HG LYS 9 -6.268 4.770 0.032
63 2HG LYS 9 1HG LYS 9 -5.887 4.049 1.596
64 1HD LYS 9 2HD LYS 9 -5.488 6.126 2.310
65 2HD LYS 9 1HD LYS 9 -4.022 6.076 1.331
66 1HE LYS 9 2HE LYS 9 -6.674 6.917 0.198
67 2HE LYS 9 1HE LYS 9 -5.593 8.058 0.996
68 1HZ LYS 9 1HZ LYS 9 -3.855 7.154 -0.638
69 2HZ LYS 9 2HZ LYS 9 -5.020 8.231 -1.223
70 3HZ LYS 9 3HZ LYS 9 -5.179 6.574 -1.518
71 H TYR 10 H TYR 10 -5.845 0.322 -0.576
72 HA TYR 10 HA TYR 10 -5.386 -0.576 2.136
73 1HB TYR 10 2HB TYR 10 -7.355 0.825 2.469
74 2HB TYR 10 1HB TYR 10 -8.190 0.007 1.152
75 HD1 TYR 10 1HD TYR 10 -6.712 -0.565 4.516
76 HD2 TYR 10 2HD TYR 10 -9.473 -1.906 1.571
77 HE1 TYR 10 1HE TYR 10 -7.617 -2.198 6.117
78 HE2 TYR 10 2HE TYR 10 -10.387 -3.542 3.164
79 HH TYR 10 HH TYR 10 -10.523 -3.818 5.646
80 H CYS 11 H CYS 11 -4.800 -2.631 1.872
81 HA CYS 11 HA CYS 11 -5.697 -4.102 -0.462
82 1HB CYS 11 2HB CYS 11 -3.314 -4.143 0.547
83 2HB CYS 11 1HB CYS 11 -3.985 -5.269 1.714
84 H SER 12 H SER 12 -7.410 -5.346 -0.496
85 HA SER 12 HA SER 12 -8.832 -5.991 1.924
86 1HB SER 12 2HB SER 12 -10.509 -6.972 0.432
87 2HB SER 12 1HB SER 12 -10.038 -5.374 -0.143
88 HG SER 12 HG SER 12 -9.598 -7.872 -1.265
89 H THR 13 H THR 13 -6.529 -7.515 -0.127
90 HA THR 13 HA THR 13 -7.165 -10.207 0.651
91 HB THR 13 HB THR 13 -4.675 -9.152 -0.699
92 HG1 THR 13 1HG THR 13 -6.231 -8.683 -2.108
93 1HG2 THR 13 1HG2 THR 13 -5.788 -11.905 -0.354
94 2HG2 THR 13 2HG2 THR 13 -4.150 -11.322 -0.065
95 3HG2 THR 13 3HG2 THR 13 -4.746 -11.497 -1.716
96 H CYS 14 H CYS 14 -4.718 -7.785 1.517
97 HA CYS 14 HA CYS 14 -3.686 -9.606 3.572
98 1HB CYS 14 2HB CYS 14 -2.592 -6.928 2.696
99 2HB CYS 14 1HB CYS 14 -1.801 -8.089 3.756
100 H ASP 15 H ASP 15 -6.035 -7.300 3.331
101 HA ASP 15 HA ASP 15 -7.166 -5.995 4.807
102 1HB ASP 15 2HB ASP 15 -6.503 -8.408 6.110
103 2HB ASP 15 1HB ASP 15 -6.248 -7.127 7.289
104 H ILE 16 H ILE 16 -4.679 -5.017 3.982
105 HA ILE 16 HA ILE 16 -3.677 -3.654 6.393
106 HB ILE 16 HB ILE 16 -2.251 -3.711 3.745
107 1HG1 ILE 16 2HG1 ILE 16 -2.645 -6.043 4.483
108 2HG1 ILE 16 1HG1 ILE 16 -0.940 -5.606 4.535
109 1HG2 ILE 16 1HG2 ILE 16 -0.280 -3.437 5.355
110 2HG2 ILE 16 2HG2 ILE 16 -1.497 -3.055 6.572
111 3HG2 ILE 16 3HG2 ILE 16 -1.353 -2.056 5.126
112 1HD1 ILE 16 1HD1 ILE 16 -1.069 -5.306 6.935
113 2HD1 ILE 16 2HD1 ILE 16 -1.625 -6.916 6.479
114 3HD1 ILE 16 3HD1 ILE 16 -2.795 -5.668 6.903
115 H SER 17 H SER 17 -3.002 -1.377 6.068
116 HA SER 17 HA SER 17 -4.675 -0.026 4.058
117 1HB SER 17 2HB SER 17 -4.632 1.830 6.007
118 2HB SER 17 1HB SER 17 -5.888 0.598 5.891
119 HG SER 17 HG SER 17 -5.153 0.484 7.951
120 H PHE 18 H PHE 18 -3.963 2.128 3.477
121 HA PHE 18 HA PHE 18 -1.174 2.756 4.033
122 1HB PHE 18 2HB PHE 18 -2.365 2.328 1.290
123 2HB PHE 18 1HB PHE 18 -0.854 3.183 1.558
124 HD1 PHE 18 1HD PHE 18 0.975 1.888 2.868
125 HD2 PHE 18 2HD PHE 18 -2.364 0.048 0.978
126 HE1 PHE 18 1HE PHE 18 2.178 -0.258 2.841
127 HE2 PHE 18 2HE PHE 18 -1.168 -2.101 0.948
128 HZ PHE 18 HZ PHE 18 1.105 -2.257 1.880
129 H ASN 19 H ASN 19 -0.730 4.938 3.941
130 HA ASN 19 HA ASN 19 -3.076 6.673 3.790
131 1HB ASN 19 2HB ASN 19 -0.350 6.944 5.016
132 2HB ASN 19 1HB ASN 19 -1.317 8.380 4.695
133 1HD2 ASN 19 1HD2 ASN 19 -3.470 8.450 5.644
134 2HD2 ASN 19 2HD2 ASN 19 -3.733 7.689 7.172
135 H TYR 20 H TYR 20 -0.571 5.696 1.798
136 HA TYR 20 HA TYR 20 -1.008 8.011 0.056
137 1HB TYR 20 2HB TYR 20 1.686 6.796 0.704
138 2HB TYR 20 1HB TYR 20 1.401 7.980 -0.566
139 HD1 TYR 20 1HD TYR 20 1.295 10.291 -0.074
140 HD2 TYR 20 2HD TYR 20 1.301 7.456 3.098
141 HE1 TYR 20 1HE TYR 20 1.629 12.112 1.545
142 HE2 TYR 20 2HE TYR 20 1.634 9.269 4.725
143 HH TYR 20 HH TYR 20 2.591 12.349 3.877
144 H VAL 21 H VAL 21 -1.607 7.406 -1.917
145 HA VAL 21 HA VAL 21 -2.079 4.821 -2.717
146 HB VAL 21 HB VAL 21 -1.322 7.010 -4.651
147 1HG1 VAL 21 1HG1 VAL 21 -3.476 4.992 -5.078
148 2HG1 VAL 21 2HG1 VAL 21 -1.792 4.520 -5.305
149 3HG1 VAL 21 3HG1 VAL 21 -2.474 5.838 -6.259
150 1HG2 VAL 21 1HG2 VAL 21 -2.892 8.123 -3.372
151 2HG2 VAL 21 2HG2 VAL 21 -3.780 6.648 -2.990
152 3HG2 VAL 21 3HG2 VAL 21 -3.904 7.359 -4.598
153 H LYS 22 H LYS 22 0.906 6.598 -2.808
154 HA LYS 22 HA LYS 22 2.306 4.981 -4.658
155 1HB LYS 22 2HB LYS 22 4.324 6.000 -3.749
156 2HB LYS 22 1HB LYS 22 3.078 7.220 -3.978
157 1HG LYS 22 2HG LYS 22 3.774 7.826 -1.914
158 2HG LYS 22 1HG LYS 22 2.574 6.623 -1.440
159 1HD LYS 22 2HD LYS 22 4.274 5.765 -0.235
160 2HD LYS 22 1HD LYS 22 4.753 5.053 -1.776
161 1HE LYS 22 2HE LYS 22 6.700 6.059 -0.922
162 2HE LYS 22 1HE LYS 22 6.108 7.163 -2.163
163 1HZ LYS 22 1HZ LYS 22 5.634 7.466 0.754
164 2HZ LYS 22 2HZ LYS 22 5.146 8.546 -0.454
165 3HZ LYS 22 3HZ LYS 22 6.792 8.320 -0.137
166 H THR 23 H THR 23 1.810 4.800 -1.176
167 HA THR 23 HA THR 23 3.645 2.696 -0.701
168 HB THR 23 HB THR 23 1.212 2.919 0.996
169 HG1 THR 23 1HG THR 23 1.617 4.904 1.660
170 1HG2 THR 23 1HG2 THR 23 4.131 2.984 1.714
171 2HG2 THR 23 2HG2 THR 23 3.136 1.529 1.666
172 3HG2 THR 23 3HG2 THR 23 2.766 2.814 2.817
173 H TYR 24 H TYR 24 0.205 2.784 -1.469
174 HA TYR 24 HA TYR 24 -0.269 0.014 -1.206
175 1HB TYR 24 2HB TYR 24 -2.003 1.858 -1.341
176 2HB TYR 24 1HB TYR 24 -1.719 1.889 -3.077
177 HD1 TYR 24 1HD TYR 24 -3.734 1.114 -3.974
178 HD2 TYR 24 2HD TYR 24 -1.892 -1.064 -0.817
179 HE1 TYR 24 1HE TYR 24 -5.369 -0.698 -4.278
180 HE2 TYR 24 2HE TYR 24 -3.520 -2.882 -1.112
181 HH TYR 24 HH TYR 24 -5.379 -3.274 -3.767
182 H LEU 25 H LEU 25 1.133 1.970 -3.702
183 HA LEU 25 HA LEU 25 0.909 0.008 -5.785
184 1HB LEU 25 2HB LEU 25 2.291 2.630 -5.447
185 2HB LEU 25 1HB LEU 25 2.858 1.557 -6.712
186 HG LEU 25 HG LEU 25 -0.059 2.162 -6.569
187 1HD1 LEU 25 1HD1 LEU 25 1.828 4.000 -8.000
188 2HD1 LEU 25 2HD1 LEU 25 1.309 4.315 -6.345
189 3HD1 LEU 25 3HD1 LEU 25 0.117 4.227 -7.642
190 1HD2 LEU 25 1HD2 LEU 25 1.948 1.364 -8.628
191 2HD2 LEU 25 2HD2 LEU 25 0.463 2.176 -9.123
192 3HD2 LEU 25 3HD2 LEU 25 0.382 0.647 -8.247
193 H ALA 26 H ALA 26 3.460 1.115 -3.598
194 HA ALA 26 HA ALA 26 5.480 -0.596 -4.519
195 1HB ALA 26 1HB ALA 26 6.008 1.311 -3.137
196 2HB ALA 26 2HB ALA 26 6.560 -0.159 -2.335
197 3HB ALA 26 3HB ALA 26 5.082 0.637 -1.796
198 H HIS 27 H HIS 27 2.830 -1.057 -2.273
199 HA HIS 27 HA HIS 27 3.768 -3.481 -1.132
200 1HB HIS 27 2HB HIS 27 2.063 -2.304 0.053
201 2HB HIS 27 1HB HIS 27 1.011 -2.266 -1.358
202 HD1 HIS 27 1HD HIS 27 2.434 -4.805 1.101
203 HD2 HIS 27 2HD HIS 27 -0.753 -4.304 -1.515
204 HE1 HIS 27 1HE HIS 27 0.927 -6.811 1.420
205 H LYS 28 H LYS 28 1.323 -2.857 -3.652
206 HA LYS 28 HA LYS 28 0.885 -5.542 -4.329
207 1HB LYS 28 2HB LYS 28 -0.286 -3.231 -5.041
208 2HB LYS 28 1HB LYS 28 0.682 -3.510 -6.482
209 1HG LYS 28 2HG LYS 28 -0.462 -5.435 -7.041
210 2HG LYS 28 1HG LYS 28 -1.030 -5.698 -5.391
211 1HD LYS 28 2HD LYS 28 -2.662 -4.020 -5.569
212 2HD LYS 28 1HD LYS 28 -1.909 -3.322 -7.004
213 1HE LYS 28 2HE LYS 28 -4.020 -4.667 -7.384
214 2HE LYS 28 1HE LYS 28 -2.625 -5.106 -8.369
215 1HZ LYS 28 1HZ LYS 28 -2.435 -7.101 -7.370
216 2HZ LYS 28 2HZ LYS 28 -4.078 -6.876 -7.037
217 3HZ LYS 28 3HZ LYS 28 -2.920 -6.532 -5.852
218 H GLN 29 H GLN 29 3.384 -3.296 -5.251
219 HA GLN 29 HA GLN 29 4.350 -4.950 -7.416
220 1HB GLN 29 2HB GLN 29 4.523 -2.294 -6.928
221 2HB GLN 29 1HB GLN 29 6.090 -2.822 -6.334
222 1HG GLN 29 2HG GLN 29 6.862 -3.303 -8.390
223 2HG GLN 29 1HG GLN 29 5.299 -3.885 -8.960
224 1HE2 GLN 29 1HE2 GLN 29 6.413 -2.537 -10.793
225 2HE2 GLN 29 2HE2 GLN 29 5.866 -0.902 -10.907
226 H PHE 30 H PHE 30 4.737 -4.895 -4.040
227 HA PHE 30 HA PHE 30 7.283 -6.359 -4.241
228 1HB PHE 30 2HB PHE 30 6.142 -4.547 -2.167
229 2HB PHE 30 1HB PHE 30 7.193 -5.855 -1.638
230 HD1 PHE 30 1HD PHE 30 7.261 -3.541 -4.565
231 HD2 PHE 30 2HD PHE 30 9.277 -5.047 -1.134
232 HE1 PHE 30 1HE PHE 30 9.229 -2.178 -5.130
233 HE2 PHE 30 2HE PHE 30 11.250 -3.686 -1.692
234 HZ PHE 30 HZ PHE 30 11.227 -2.250 -3.692
235 H TYR 31 H TYR 31 4.346 -6.293 -2.207
236 HA TYR 31 HA TYR 31 4.727 -8.989 -1.334
237 1HB TYR 31 2HB TYR 31 3.357 -6.885 -0.327
238 2HB TYR 31 1HB TYR 31 2.040 -7.781 -1.077
239 HD1 TYR 31 1HD TYR 31 4.438 -7.689 1.648
240 HD2 TYR 31 2HD TYR 31 1.523 -10.081 -0.321
241 HE1 TYR 31 1HE TYR 31 4.359 -9.184 3.597
242 HE2 TYR 31 2HE TYR 31 1.434 -11.584 1.624
243 HH TYR 31 HH TYR 31 2.891 -10.795 4.625
244 H HIS 32 H HIS 32 2.984 -7.458 -3.933
245 HA HIS 32 HA HIS 32 1.870 -10.080 -4.686
246 1HB HIS 32 2HB HIS 32 0.828 -7.323 -5.372
247 2HB HIS 32 1HB HIS 32 0.130 -8.843 -5.924
248 HD1 HIS 32 1HD HIS 32 -1.285 -10.186 -4.206
249 HD2 HIS 32 2HD HIS 32 0.334 -6.664 -2.708
250 HE1 HIS 32 1HE HIS 32 -2.443 -9.751 -1.998
251 H LYS 33 H LYS 33 4.395 -9.831 -5.391
252 HA LYS 33 HA LYS 33 4.249 -9.532 -8.285
253 1HB LYS 33 2HB LYS 33 5.846 -7.818 -6.487
254 2HB LYS 33 1HB LYS 33 6.709 -8.456 -7.879
255 1HG LYS 33 2HG LYS 33 4.157 -6.858 -7.960
256 2HG LYS 33 1HG LYS 33 5.774 -6.267 -8.354
257 1HD LYS 33 2HD LYS 33 5.656 -8.394 -9.991
258 2HD LYS 33 1HD LYS 33 3.942 -7.984 -9.915
259 1HE LYS 33 2HE LYS 33 5.813 -5.736 -10.330
260 2HE LYS 33 1HE LYS 33 5.660 -6.880 -11.663
261 1HZ LYS 33 1HZ LYS 33 3.120 -6.522 -11.166
262 2HZ LYS 33 2HZ LYS 33 3.977 -5.457 -12.161
263 3HZ LYS 33 3HZ LYS 33 3.672 -5.045 -10.550
264 H ASN 34 H ASN 34 4.209 -11.918 -7.579
265 HA ASN 34 HA ASN 34 5.224 -13.948 -7.307
266 1HB ASN 34 2HB ASN 34 7.015 -14.373 -8.924
267 2HB ASN 34 1HB ASN 34 5.721 -13.426 -9.651
268 1HD2 ASN 34 1HD2 ASN 34 9.029 -13.583 -8.899
269 2HD2 ASN 34 2HD2 ASN 34 9.480 -12.022 -9.486
270 H LYS 35 H LYS 35 5.681 -12.912 -5.024
271 HA LYS 35 HA LYS 35 8.366 -12.307 -4.349
272 1HB LYS 35 2HB LYS 35 7.615 -12.638 -2.010
273 2HB LYS 35 1HB LYS 35 6.554 -11.575 -2.924
274 1HG LYS 35 2HG LYS 35 5.329 -13.936 -3.341
275 2HG LYS 35 1HG LYS 35 6.033 -14.221 -1.748
276 1HD LYS 35 2HD LYS 35 4.738 -11.605 -2.059
277 2HD LYS 35 1HD LYS 35 3.646 -12.984 -2.201
278 1HE LYS 35 2HE LYS 35 5.571 -13.110 0.024
279 2HE LYS 35 1HE LYS 35 4.357 -11.837 0.144
280 1HZ LYS 35 1HZ LYS 35 2.838 -13.904 -0.557
281 2HZ LYS 35 2HZ LYS 35 3.152 -13.487 1.052
282 3HZ LYS 35 3HZ LYS 35 4.043 -14.718 0.308
283 HA PRO 36 HA PRO 36 10.221 -16.295 -4.063
284 1HB PRO 36 2HB PRO 36 11.949 -15.955 -1.998
285 2HB PRO 36 1HB PRO 36 12.202 -15.229 -3.590
286 1HG PRO 36 2HG PRO 36 11.090 -13.994 -1.099
287 2HG PRO 36 1HG PRO 36 12.252 -13.322 -2.258
288 1HD PRO 36 2HD PRO 36 9.629 -12.654 -2.274
289 2HD PRO 36 1HD PRO 36 10.605 -12.723 -3.755
Start of MODEL 15
1 1H GLY 1 1HT GLY 1 -12.515 0.594 -12.910
2 2H GLY 1 2HT GLY 1 -13.053 -0.128 -11.477
3 3H GLY 1 3HT GLY 1 -11.408 0.201 -11.692
4 1HA GLY 1 1HA GLY 1 -11.817 2.037 -10.506
5 2HA GLY 1 2HA GLY 1 -12.424 2.643 -12.039
6 H SER 2 H SER 2 -14.806 1.442 -12.353
7 HA SER 2 HA SER 2 -17.001 1.617 -11.785
8 1HB SER 2 2HB SER 2 -17.654 0.719 -9.725
9 2HB SER 2 1HB SER 2 -16.068 -0.007 -9.984
10 HG SER 2 HG SER 2 -16.011 0.765 -7.940
11 H ALA 3 H ALA 3 -15.557 4.030 -12.048
12 HA ALA 3 HA ALA 3 -15.800 6.267 -11.715
13 1HB ALA 3 1HB ALA 3 -18.304 5.700 -10.160
14 2HB ALA 3 2HB ALA 3 -18.239 5.523 -11.914
15 3HB ALA 3 3HB ALA 3 -17.922 7.092 -11.174
16 H ALA 4 H ALA 4 -14.378 7.202 -10.409
17 HA ALA 4 HA ALA 4 -13.317 7.951 -8.541
18 1HB ALA 4 1HB ALA 4 -15.742 8.658 -8.077
19 2HB ALA 4 2HB ALA 4 -14.612 8.628 -6.724
20 3HB ALA 4 3HB ALA 4 -15.768 7.313 -6.936
21 H GLU 5 H GLU 5 -13.258 7.212 -5.933
22 HA GLU 5 HA GLU 5 -13.435 4.631 -5.119
23 1HB GLU 5 2HB GLU 5 -11.323 4.925 -7.126
24 2HB GLU 5 1HB GLU 5 -10.749 4.211 -5.625
25 1HG GLU 5 2HG GLU 5 -13.264 3.108 -6.676
26 2HG GLU 5 1HG GLU 5 -11.827 2.811 -7.652
27 H VAL 6 H VAL 6 -13.679 6.555 -3.559
28 HA VAL 6 HA VAL 6 -11.466 7.863 -2.463
29 HB VAL 6 HB VAL 6 -13.789 8.538 -2.014
30 1HG1 VAL 6 1HG1 VAL 6 -13.990 6.304 -0.023
31 2HG1 VAL 6 2HG1 VAL 6 -14.538 6.107 -1.688
32 3HG1 VAL 6 3HG1 VAL 6 -15.266 7.341 -0.660
33 1HG2 VAL 6 1HG2 VAL 6 -12.613 9.626 -0.438
34 2HG2 VAL 6 2HG2 VAL 6 -11.749 8.173 0.064
35 3HG2 VAL 6 3HG2 VAL 6 -13.376 8.486 0.671
36 H MET 7 H MET 7 -12.957 4.765 -1.626
37 HA MET 7 HA MET 7 -11.256 4.282 0.615
38 1HB MET 7 2HB MET 7 -13.468 3.242 0.426
39 2HB MET 7 1HB MET 7 -12.943 2.364 -1.004
40 1HG MET 7 2HG MET 7 -11.578 0.944 0.207
41 2HG MET 7 1HG MET 7 -11.481 2.045 1.579
42 1HE MET 7 1HE MET 7 -12.747 1.929 3.559
43 2HE MET 7 2HE MET 7 -14.345 1.220 3.792
44 3HE MET 7 3HE MET 7 -14.163 2.688 2.830
45 H LYS 8 H LYS 8 -9.332 4.937 -0.830
46 HA LYS 8 HA LYS 8 -8.277 2.606 -2.264
47 1HB LYS 8 2HB LYS 8 -6.721 4.126 -3.333
48 2HB LYS 8 1HB LYS 8 -8.358 4.740 -3.513
49 1HG LYS 8 2HG LYS 8 -7.967 6.562 -2.227
50 2HG LYS 8 1HG LYS 8 -6.820 5.717 -1.184
51 1HD LYS 8 2HD LYS 8 -5.547 7.292 -2.397
52 2HD LYS 8 1HD LYS 8 -5.229 5.732 -3.157
53 1HE LYS 8 2HE LYS 8 -7.482 7.313 -4.243
54 2HE LYS 8 1HE LYS 8 -5.861 7.937 -4.541
55 1HZ LYS 8 1HZ LYS 8 -5.521 5.382 -5.175
56 2HZ LYS 8 2HZ LYS 8 -5.990 6.557 -6.297
57 3HZ LYS 8 3HZ LYS 8 -7.154 5.555 -5.588
58 H LYS 9 H LYS 9 -5.689 2.730 -2.146
59 HA LYS 9 HA LYS 9 -3.865 2.227 -0.888
60 1HB LYS 9 2HB LYS 9 -4.878 4.104 1.226
61 2HB LYS 9 1HB LYS 9 -3.222 3.782 0.743
62 1HG LYS 9 2HG LYS 9 -3.256 5.324 -0.880
63 2HG LYS 9 1HG LYS 9 -4.902 4.923 -1.370
64 1HD LYS 9 2HD LYS 9 -5.408 6.922 -0.466
65 2HD LYS 9 1HD LYS 9 -5.344 6.041 1.062
66 1HE LYS 9 2HE LYS 9 -3.479 7.096 1.723
67 2HE LYS 9 1HE LYS 9 -2.736 6.978 0.128
68 1HZ LYS 9 1HZ LYS 9 -3.365 9.281 1.077
69 2HZ LYS 9 2HZ LYS 9 -4.932 8.884 0.582
70 3HZ LYS 9 3HZ LYS 9 -3.679 8.947 -0.552
71 H TYR 10 H TYR 10 -5.790 0.362 -0.639
72 HA TYR 10 HA TYR 10 -5.279 -0.673 2.010
73 1HB TYR 10 2HB TYR 10 -7.461 0.764 2.020
74 2HB TYR 10 1HB TYR 10 -8.162 -0.614 1.177
75 HD1 TYR 10 1HD TYR 10 -7.701 0.817 4.309
76 HD2 TYR 10 2HD TYR 10 -7.570 -2.961 2.355
77 HE1 TYR 10 1HE TYR 10 -8.072 -0.304 6.465
78 HE2 TYR 10 2HE TYR 10 -7.942 -4.092 4.507
79 HH TYR 10 HH TYR 10 -7.414 -2.922 7.317
80 H CYS 11 H CYS 11 -4.872 -2.790 1.847
81 HA CYS 11 HA CYS 11 -5.419 -4.118 -0.668
82 1HB CYS 11 2HB CYS 11 -3.230 -4.324 0.604
83 2HB CYS 11 1HB CYS 11 -4.093 -5.342 1.748
84 H SER 12 H SER 12 -7.043 -5.426 -1.066
85 HA SER 12 HA SER 12 -8.928 -6.077 1.036
86 1HB SER 12 2HB SER 12 -10.331 -6.932 -0.831
87 2HB SER 12 1HB SER 12 -9.824 -5.260 -1.068
88 HG SER 12 HG SER 12 -9.236 -6.049 -2.946
89 H THR 13 H THR 13 -6.204 -7.422 0.693
90 HA THR 13 HA THR 13 -7.217 -10.158 0.898
91 HB THR 13 HB THR 13 -4.693 -9.344 -0.551
92 HG1 THR 13 1HG THR 13 -6.738 -8.974 -1.654
93 1HG2 THR 13 1HG2 THR 13 -4.137 -11.505 -0.854
94 2HG2 THR 13 2HG2 THR 13 -5.813 -12.056 -0.838
95 3HG2 THR 13 3HG2 THR 13 -4.989 -11.692 0.679
96 H CYS 14 H CYS 14 -4.748 -7.796 1.726
97 HA CYS 14 HA CYS 14 -3.725 -9.600 3.805
98 1HB CYS 14 2HB CYS 14 -2.598 -6.963 2.849
99 2HB CYS 14 1HB CYS 14 -1.835 -8.067 3.986
100 H ASP 15 H ASP 15 -6.081 -7.342 3.535
101 HA ASP 15 HA ASP 15 -7.205 -5.986 4.963
102 1HB ASP 15 2HB ASP 15 -5.921 -7.836 6.980
103 2HB ASP 15 1HB ASP 15 -7.238 -6.724 7.333
104 H ILE 16 H ILE 16 -4.746 -4.993 4.094
105 HA ILE 16 HA ILE 16 -3.781 -3.523 6.460
106 HB ILE 16 HB ILE 16 -2.241 -3.754 3.889
107 1HG1 ILE 16 2HG1 ILE 16 -2.706 -6.039 4.702
108 2HG1 ILE 16 1HG1 ILE 16 -1.001 -5.629 4.841
109 1HG2 ILE 16 1HG2 ILE 16 -0.349 -3.464 5.618
110 2HG2 ILE 16 2HG2 ILE 16 -1.635 -2.940 6.705
111 3HG2 ILE 16 3HG2 ILE 16 -1.339 -2.065 5.203
112 1HD1 ILE 16 1HD1 ILE 16 -1.820 -6.842 6.792
113 2HD1 ILE 16 2HD1 ILE 16 -2.998 -5.564 7.089
114 3HD1 ILE 16 3HD1 ILE 16 -1.273 -5.219 7.214
115 H SER 17 H SER 17 -3.066 -1.285 6.023
116 HA SER 17 HA SER 17 -4.546 -0.039 3.808
117 1HB SER 17 2HB SER 17 -5.625 0.148 6.168
118 2HB SER 17 1HB SER 17 -4.336 1.308 6.490
119 HG SER 17 HG SER 17 -6.141 2.392 5.701
120 H PHE 18 H PHE 18 -3.776 2.161 3.291
121 HA PHE 18 HA PHE 18 -1.021 2.701 4.090
122 1HB PHE 18 2HB PHE 18 -2.012 2.412 1.250
123 2HB PHE 18 1HB PHE 18 -0.474 3.147 1.675
124 HD1 PHE 18 1HD PHE 18 1.243 1.731 2.875
125 HD2 PHE 18 2HD PHE 18 -2.246 0.101 1.067
126 HE1 PHE 18 1HE PHE 18 2.289 -0.496 2.872
127 HE2 PHE 18 2HE PHE 18 -1.208 -2.129 1.060
128 HZ PHE 18 HZ PHE 18 1.062 -2.430 1.963
129 H ASN 19 H ASN 19 -0.542 4.838 4.228
130 HA ASN 19 HA ASN 19 -2.763 6.694 3.917
131 1HB ASN 19 2HB ASN 19 -0.195 6.686 5.413
132 2HB ASN 19 1HB ASN 19 -0.825 8.252 4.915
133 1HD2 ASN 19 1HD2 ASN 19 -1.109 8.774 7.117
134 2HD2 ASN 19 2HD2 ASN 19 -2.454 8.158 8.010
135 H TYR 20 H TYR 20 -0.825 5.539 1.733
136 HA TYR 20 HA TYR 20 -0.810 7.957 0.163
137 1HB TYR 20 2HB TYR 20 1.721 6.624 1.077
138 2HB TYR 20 1HB TYR 20 1.666 7.486 -0.455
139 HD1 TYR 20 1HD TYR 20 0.186 9.859 -0.003
140 HD2 TYR 20 2HD TYR 20 2.819 7.863 2.678
141 HE1 TYR 20 1HE TYR 20 0.586 11.981 1.174
142 HE2 TYR 20 2HE TYR 20 3.226 9.980 3.863
143 HH TYR 20 HH TYR 20 2.216 13.009 2.614
144 H VAL 21 H VAL 21 -1.476 7.417 -1.805
145 HA VAL 21 HA VAL 21 -2.062 4.860 -2.650
146 HB VAL 21 HB VAL 21 -1.286 7.051 -4.571
147 1HG1 VAL 21 1HG1 VAL 21 -2.586 5.965 -6.133
148 2HG1 VAL 21 2HG1 VAL 21 -3.554 5.139 -4.912
149 3HG1 VAL 21 3HG1 VAL 21 -1.905 4.606 -5.240
150 1HG2 VAL 21 1HG2 VAL 21 -3.957 7.344 -4.328
151 2HG2 VAL 21 2HG2 VAL 21 -2.779 8.310 -3.438
152 3HG2 VAL 21 3HG2 VAL 21 -3.535 6.914 -2.669
153 H LYS 22 H LYS 22 0.964 6.570 -2.798
154 HA LYS 22 HA LYS 22 2.265 4.944 -4.711
155 1HB LYS 22 2HB LYS 22 3.499 6.482 -2.417
156 2HB LYS 22 1HB LYS 22 4.335 5.905 -3.851
157 1HG LYS 22 2HG LYS 22 3.413 7.514 -5.207
158 2HG LYS 22 1HG LYS 22 2.012 7.745 -4.160
159 1HD LYS 22 2HD LYS 22 3.094 9.210 -2.806
160 2HD LYS 22 1HD LYS 22 4.653 8.405 -3.004
161 1HE LYS 22 2HE LYS 22 3.351 10.004 -5.195
162 2HE LYS 22 1HE LYS 22 4.444 10.721 -4.011
163 1HZ LYS 22 1HZ LYS 22 5.026 8.883 -6.206
164 2HZ LYS 22 2HZ LYS 22 5.946 8.718 -4.797
165 3HZ LYS 22 3HZ LYS 22 5.926 10.193 -5.624
166 H THR 23 H THR 23 1.935 4.753 -1.204
167 HA THR 23 HA THR 23 3.708 2.572 -0.858
168 HB THR 23 HB THR 23 1.404 2.948 0.999
169 HG1 THR 23 1HG THR 23 3.552 4.789 0.829
170 1HG2 THR 23 1HG2 THR 23 3.176 2.810 2.704
171 2HG2 THR 23 2HG2 THR 23 4.361 2.594 1.416
172 3HG2 THR 23 3HG2 THR 23 3.099 1.387 1.666
173 H TYR 24 H TYR 24 0.234 2.817 -1.406
174 HA TYR 24 HA TYR 24 -0.362 0.082 -1.073
175 1HB TYR 24 2HB TYR 24 -2.030 1.964 -1.160
176 2HB TYR 24 1HB TYR 24 -1.781 2.028 -2.901
177 HD1 TYR 24 1HD TYR 24 -3.849 1.363 -3.769
178 HD2 TYR 24 2HD TYR 24 -2.027 -0.972 -0.716
179 HE1 TYR 24 1HE TYR 24 -5.564 -0.372 -4.080
180 HE2 TYR 24 2HE TYR 24 -3.735 -2.714 -1.019
181 HH TYR 24 HH TYR 24 -5.383 -3.291 -3.346
182 H LEU 25 H LEU 25 0.965 1.935 -3.698
183 HA LEU 25 HA LEU 25 0.615 -0.106 -5.690
184 1HB LEU 25 2HB LEU 25 2.144 2.473 -5.545
185 2HB LEU 25 1HB LEU 25 2.429 1.351 -6.863
186 HG LEU 25 HG LEU 25 -0.385 2.147 -6.315
187 1HD1 LEU 25 1HD1 LEU 25 0.238 4.321 -6.329
188 2HD1 LEU 25 2HD1 LEU 25 0.267 4.052 -8.073
189 3HD1 LEU 25 3HD1 LEU 25 1.767 3.993 -7.147
190 1HD2 LEU 25 1HD2 LEU 25 -0.142 2.227 -8.939
191 2HD2 LEU 25 2HD2 LEU 25 -0.319 0.698 -8.079
192 3HD2 LEU 25 3HD2 LEU 25 1.276 1.234 -8.605
193 H ALA 26 H ALA 26 3.227 1.033 -3.615
194 HA ALA 26 HA ALA 26 5.239 -0.664 -4.577
195 1HB ALA 26 1HB ALA 26 5.201 1.384 -2.835
196 2HB ALA 26 2HB ALA 26 6.537 0.240 -2.963
197 3HB ALA 26 3HB ALA 26 5.312 0.029 -1.712
198 H HIS 27 H HIS 27 2.639 -1.158 -2.275
199 HA HIS 27 HA HIS 27 3.689 -3.583 -1.189
200 1HB HIS 27 2HB HIS 27 2.123 -2.413 0.170
201 2HB HIS 27 1HB HIS 27 0.944 -2.328 -1.135
202 HD1 HIS 27 1HD HIS 27 2.418 -4.800 1.324
203 HD2 HIS 27 2HD HIS 27 -0.735 -4.475 -1.360
204 HE1 HIS 27 1HE HIS 27 0.965 -6.839 1.683
205 H LYS 28 H LYS 28 1.343 -2.814 -3.727
206 HA LYS 28 HA LYS 28 0.692 -5.538 -4.266
207 1HB LYS 28 2HB LYS 28 -0.544 -3.249 -4.853
208 2HB LYS 28 1HB LYS 28 0.332 -3.458 -6.364
209 1HG LYS 28 2HG LYS 28 -0.669 -5.870 -6.266
210 2HG LYS 28 1HG LYS 28 -1.844 -5.114 -5.188
211 1HD LYS 28 2HD LYS 28 -1.171 -4.064 -7.931
212 2HD LYS 28 1HD LYS 28 -2.506 -5.171 -7.608
213 1HE LYS 28 2HE LYS 28 -3.775 -3.568 -6.648
214 2HE LYS 28 1HE LYS 28 -2.391 -2.777 -5.896
215 1HZ LYS 28 1HZ LYS 28 -2.097 -1.422 -7.654
216 2HZ LYS 28 2HZ LYS 28 -3.736 -1.735 -7.928
217 3HZ LYS 28 3HZ LYS 28 -2.557 -2.587 -8.791
218 H GLN 29 H GLN 29 3.180 -3.366 -5.334
219 HA GLN 29 HA GLN 29 3.896 -4.985 -7.621
220 1HB GLN 29 2HB GLN 29 4.581 -2.350 -6.582
221 2HB GLN 29 1HB GLN 29 5.984 -3.219 -7.188
222 1HG GLN 29 2HG GLN 29 5.167 -1.968 -8.997
223 2HG GLN 29 1HG GLN 29 4.665 -3.632 -9.297
224 1HE2 GLN 29 1HE2 GLN 29 3.677 -0.481 -9.276
225 2HE2 GLN 29 2HE2 GLN 29 1.968 -0.721 -9.200
226 H PHE 30 H PHE 30 4.787 -4.783 -4.278
227 HA PHE 30 HA PHE 30 7.068 -6.576 -4.801
228 1HB PHE 30 2HB PHE 30 6.674 -4.357 -2.875
229 2HB PHE 30 1HB PHE 30 7.561 -5.760 -2.288
230 HD1 PHE 30 1HD PHE 30 7.599 -2.903 -4.540
231 HD2 PHE 30 2HD PHE 30 9.700 -6.382 -3.277
232 HE1 PHE 30 1HE PHE 30 9.637 -2.063 -5.632
233 HE2 PHE 30 2HE PHE 30 11.743 -5.548 -4.366
234 HZ PHE 30 HZ PHE 30 11.713 -3.386 -5.545
235 H TYR 31 H TYR 31 4.449 -5.931 -2.480
236 HA TYR 31 HA TYR 31 4.818 -8.410 -1.107
237 1HB TYR 31 2HB TYR 31 3.607 -6.085 -0.450
238 2HB TYR 31 1HB TYR 31 2.201 -7.049 -0.893
239 HD1 TYR 31 1HD TYR 31 4.799 -6.498 1.571
240 HD2 TYR 31 2HD TYR 31 1.710 -9.152 0.340
241 HE1 TYR 31 1HE TYR 31 4.843 -7.566 3.786
242 HE2 TYR 31 2HE TYR 31 1.744 -10.227 2.552
243 HH TYR 31 HH TYR 31 2.420 -9.762 4.816
244 H HIS 32 H HIS 32 3.509 -7.758 -4.109
245 HA HIS 32 HA HIS 32 2.059 -10.304 -4.050
246 1HB HIS 32 2HB HIS 32 1.003 -7.686 -5.107
247 2HB HIS 32 1HB HIS 32 0.336 -9.241 -5.593
248 HD1 HIS 32 1HD HIS 32 -1.166 -10.465 -3.880
249 HD2 HIS 32 2HD HIS 32 0.490 -6.929 -2.456
250 HE1 HIS 32 1HE HIS 32 -2.368 -9.935 -1.716
251 H LYS 33 H LYS 33 4.672 -9.133 -5.154
252 HA LYS 33 HA LYS 33 4.952 -10.756 -7.368
253 1HB LYS 33 2HB LYS 33 5.049 -8.970 -9.184
254 2HB LYS 33 1HB LYS 33 3.450 -9.476 -8.660
255 1HG LYS 33 2HG LYS 33 3.809 -7.404 -7.008
256 2HG LYS 33 1HG LYS 33 4.814 -6.877 -8.360
257 1HD LYS 33 2HD LYS 33 1.926 -7.731 -8.550
258 2HD LYS 33 1HD LYS 33 2.505 -6.064 -8.559
259 1HE LYS 33 2HE LYS 33 3.033 -8.203 -10.612
260 2HE LYS 33 1HE LYS 33 2.098 -6.723 -10.822
261 1HZ LYS 33 1HZ LYS 33 5.021 -7.040 -10.582
262 2HZ LYS 33 2HZ LYS 33 4.285 -5.559 -10.231
263 3HZ LYS 33 3HZ LYS 33 4.135 -6.231 -11.776
264 H ASN 34 H ASN 34 6.773 -10.816 -5.787
265 HA ASN 34 HA ASN 34 8.762 -8.711 -6.287
266 1HB ASN 34 2HB ASN 34 7.966 -9.671 -3.903
267 2HB ASN 34 1HB ASN 34 9.278 -10.796 -4.240
268 1HD2 ASN 34 1HD2 ASN 34 9.525 -9.221 -2.101
269 2HD2 ASN 34 2HD2 ASN 34 10.698 -7.983 -2.373
270 H LYS 35 H LYS 35 8.178 -10.742 -8.239
271 HA LYS 35 HA LYS 35 9.984 -12.881 -8.204
272 1HB LYS 35 2HB LYS 35 8.754 -11.375 -10.515
273 2HB LYS 35 1HB LYS 35 9.700 -12.845 -10.707
274 1HG LYS 35 2HG LYS 35 8.017 -13.876 -9.047
275 2HG LYS 35 1HG LYS 35 7.009 -12.485 -9.454
276 1HD LYS 35 2HD LYS 35 8.187 -13.911 -11.746
277 2HD LYS 35 1HD LYS 35 6.997 -14.824 -10.816
278 1HE LYS 35 2HE LYS 35 6.095 -13.472 -12.752
279 2HE LYS 35 1HE LYS 35 5.318 -13.206 -11.192
280 1HZ LYS 35 1HZ LYS 35 7.515 -11.474 -12.151
281 2HZ LYS 35 2HZ LYS 35 6.381 -11.157 -10.938
282 3HZ LYS 35 3HZ LYS 35 5.901 -11.171 -12.559
283 HA PRO 36 HA PRO 36 13.906 -11.000 -8.944
284 1HB PRO 36 2HB PRO 36 15.185 -12.989 -10.277
285 2HB PRO 36 1HB PRO 36 14.840 -13.064 -8.545
286 1HG PRO 36 2HG PRO 36 13.361 -14.315 -10.828
287 2HG PRO 36 1HG PRO 36 13.792 -15.015 -9.256
288 1HD PRO 36 2HD PRO 36 11.315 -14.061 -9.798
289 2HD PRO 36 1HD PRO 36 12.033 -13.986 -8.176
Start of MODEL 16
1 1H GLY 1 1HT GLY 1 -16.041 -4.273 -13.776
2 2H GLY 1 2HT GLY 1 -17.367 -4.719 -12.825
3 3H GLY 1 3HT GLY 1 -17.390 -5.001 -14.492
4 1HA GLY 1 1HA GLY 1 -16.935 -7.082 -13.576
5 2HA GLY 1 2HA GLY 1 -15.391 -6.475 -14.154
6 H SER 2 H SER 2 -14.017 -5.361 -12.533
7 HA SER 2 HA SER 2 -14.165 -6.808 -9.991
8 1HB SER 2 2HB SER 2 -11.927 -5.453 -11.479
9 2HB SER 2 1HB SER 2 -11.765 -5.863 -9.771
10 HG SER 2 HG SER 2 -12.438 -8.055 -10.496
11 H ALA 3 H ALA 3 -15.918 -4.598 -10.427
12 HA ALA 3 HA ALA 3 -16.700 -2.749 -9.355
13 1HB ALA 3 1HB ALA 3 -15.377 -2.343 -7.062
14 2HB ALA 3 2HB ALA 3 -14.910 -4.015 -7.373
15 3HB ALA 3 3HB ALA 3 -16.615 -3.584 -7.253
16 H ALA 4 H ALA 4 -14.526 -2.500 -11.281
17 HA ALA 4 HA ALA 4 -13.284 -0.821 -12.192
18 1HB ALA 4 1HB ALA 4 -13.596 1.413 -11.493
19 2HB ALA 4 2HB ALA 4 -14.057 0.920 -9.864
20 3HB ALA 4 3HB ALA 4 -15.139 0.603 -11.220
21 H GLU 5 H GLU 5 -12.933 -0.246 -8.689
22 HA GLU 5 HA GLU 5 -10.577 -1.485 -8.155
23 1HB GLU 5 2HB GLU 5 -8.948 0.516 -8.369
24 2HB GLU 5 1HB GLU 5 -9.303 -0.433 -9.805
25 1HG GLU 5 2HG GLU 5 -10.545 1.237 -10.773
26 2HG GLU 5 1HG GLU 5 -10.931 1.992 -9.227
27 H VAL 6 H VAL 6 -12.374 -1.208 -6.452
28 HA VAL 6 HA VAL 6 -12.690 1.151 -4.993
29 HB VAL 6 HB VAL 6 -14.154 -0.811 -4.734
30 1HG1 VAL 6 1HG1 VAL 6 -12.686 -2.649 -4.783
31 2HG1 VAL 6 2HG1 VAL 6 -13.343 -2.618 -3.147
32 3HG1 VAL 6 3HG1 VAL 6 -11.716 -2.014 -3.455
33 1HG2 VAL 6 1HG2 VAL 6 -13.787 1.016 -2.947
34 2HG2 VAL 6 2HG2 VAL 6 -12.971 -0.256 -2.040
35 3HG2 VAL 6 3HG2 VAL 6 -14.663 -0.447 -2.497
36 H MET 7 H MET 7 -11.897 1.656 -2.827
37 HA MET 7 HA MET 7 -10.256 2.049 -1.302
38 1HB MET 7 2HB MET 7 -8.940 -0.502 -2.229
39 2HB MET 7 1HB MET 7 -8.780 0.286 -0.665
40 1HG MET 7 2HG MET 7 -11.210 -1.111 -1.752
41 2HG MET 7 1HG MET 7 -10.169 -1.649 -0.436
42 1HE MET 7 1HE MET 7 -12.058 -2.105 1.034
43 2HE MET 7 2HE MET 7 -12.702 -0.886 2.133
44 3HE MET 7 3HE MET 7 -10.973 -1.229 2.113
45 H LYS 8 H LYS 8 -8.774 3.574 -1.543
46 HA LYS 8 HA LYS 8 -7.279 3.748 -4.024
47 1HB LYS 8 2HB LYS 8 -6.700 5.977 -3.334
48 2HB LYS 8 1HB LYS 8 -8.415 5.735 -3.034
49 1HG LYS 8 2HG LYS 8 -7.171 4.983 -0.662
50 2HG LYS 8 1HG LYS 8 -6.301 6.421 -1.198
51 1HD LYS 8 2HD LYS 8 -8.018 7.338 0.043
52 2HD LYS 8 1HD LYS 8 -8.686 7.388 -1.590
53 1HE LYS 8 2HE LYS 8 -9.209 4.901 -0.119
54 2HE LYS 8 1HE LYS 8 -9.952 6.339 0.578
55 1HZ LYS 8 1HZ LYS 8 -11.373 6.534 -1.128
56 2HZ LYS 8 2HZ LYS 8 -11.044 4.895 -1.383
57 3HZ LYS 8 3HZ LYS 8 -10.236 6.071 -2.292
58 H LYS 9 H LYS 9 -6.745 2.975 -0.674
59 HA LYS 9 HA LYS 9 -4.093 2.018 -1.282
60 1HB LYS 9 2HB LYS 9 -3.674 3.538 1.067
61 2HB LYS 9 1HB LYS 9 -2.919 3.749 -0.503
62 1HG LYS 9 2HG LYS 9 -4.693 5.269 -1.172
63 2HG LYS 9 1HG LYS 9 -5.500 5.026 0.379
64 1HD LYS 9 2HD LYS 9 -3.987 6.300 1.519
65 2HD LYS 9 1HD LYS 9 -2.663 5.901 0.423
66 1HE LYS 9 2HE LYS 9 -2.952 7.886 -0.535
67 2HE LYS 9 1HE LYS 9 -4.511 7.313 -1.126
68 1HZ LYS 9 1HZ LYS 9 -4.856 9.336 0.049
69 2HZ LYS 9 2HZ LYS 9 -3.988 8.788 1.393
70 3HZ LYS 9 3HZ LYS 9 -5.479 8.088 1.008
71 H TYR 10 H TYR 10 -5.837 0.294 -0.739
72 HA TYR 10 HA TYR 10 -5.237 -0.652 1.931
73 1HB TYR 10 2HB TYR 10 -7.337 0.760 2.124
74 2HB TYR 10 1HB TYR 10 -8.132 -0.421 1.088
75 HD1 TYR 10 1HD TYR 10 -7.589 0.514 4.398
76 HD2 TYR 10 2HD TYR 10 -7.818 -2.947 1.935
77 HE1 TYR 10 1HE TYR 10 -8.111 -0.850 6.376
78 HE2 TYR 10 2HE TYR 10 -8.340 -4.322 3.906
79 HH TYR 10 HH TYR 10 -8.004 -3.155 7.103
80 H CYS 11 H CYS 11 -4.844 -2.778 1.825
81 HA CYS 11 HA CYS 11 -5.462 -4.173 -0.637
82 1HB CYS 11 2HB CYS 11 -3.244 -4.350 0.606
83 2HB CYS 11 1HB CYS 11 -4.091 -5.365 1.768
84 H SER 12 H SER 12 -7.139 -5.421 -0.960
85 HA SER 12 HA SER 12 -8.938 -6.061 1.221
86 1HB SER 12 2HB SER 12 -9.106 -6.026 -1.746
87 2HB SER 12 1HB SER 12 -10.155 -7.163 -0.899
88 HG SER 12 HG SER 12 -10.017 -4.353 -0.544
89 H THR 13 H THR 13 -6.251 -7.429 0.764
90 HA THR 13 HA THR 13 -7.276 -10.159 0.977
91 HB THR 13 HB THR 13 -4.795 -9.350 -0.545
92 HG1 THR 13 1HG THR 13 -6.589 -8.894 -1.773
93 1HG2 THR 13 1HG2 THR 13 -5.653 -11.900 0.491
94 2HG2 THR 13 2HG2 THR 13 -4.133 -11.444 -0.280
95 3HG2 THR 13 3HG2 THR 13 -5.514 -11.923 -1.267
96 H CYS 14 H CYS 14 -4.767 -7.819 1.743
97 HA CYS 14 HA CYS 14 -3.687 -9.648 3.772
98 1HB CYS 14 2HB CYS 14 -2.578 -7.013 2.784
99 2HB CYS 14 1HB CYS 14 -1.789 -8.110 3.910
100 H ASP 15 H ASP 15 -6.051 -7.399 3.605
101 HA ASP 15 HA ASP 15 -7.126 -6.051 5.080
102 1HB ASP 15 2HB ASP 15 -5.759 -7.903 7.039
103 2HB ASP 15 1HB ASP 15 -7.069 -6.802 7.444
104 H ILE 16 H ILE 16 -4.791 -4.950 4.116
105 HA ILE 16 HA ILE 16 -3.739 -3.512 6.464
106 HB ILE 16 HB ILE 16 -2.247 -3.741 3.866
107 1HG1 ILE 16 2HG1 ILE 16 -2.679 -6.028 4.686
108 2HG1 ILE 16 1HG1 ILE 16 -0.976 -5.605 4.803
109 1HG2 ILE 16 1HG2 ILE 16 -1.576 -2.940 6.674
110 2HG2 ILE 16 2HG2 ILE 16 -1.351 -2.037 5.177
111 3HG2 ILE 16 3HG2 ILE 16 -0.321 -3.423 5.534
112 1HD1 ILE 16 1HD1 ILE 16 -2.908 -5.459 7.101
113 2HD1 ILE 16 2HD1 ILE 16 -1.155 -5.274 7.161
114 3HD1 ILE 16 3HD1 ILE 16 -1.863 -6.839 6.761
115 H SER 17 H SER 17 -3.048 -1.273 6.011
116 HA SER 17 HA SER 17 -4.588 -0.040 3.828
117 1HB SER 17 2HB SER 17 -4.720 1.913 5.679
118 2HB SER 17 1HB SER 17 -5.959 0.669 5.513
119 HG SER 17 HG SER 17 -5.151 -0.387 7.245
120 H PHE 18 H PHE 18 -3.842 2.191 3.321
121 HA PHE 18 HA PHE 18 -1.061 2.709 4.028
122 1HB PHE 18 2HB PHE 18 -2.140 2.426 1.222
123 2HB PHE 18 1HB PHE 18 -0.599 3.183 1.594
124 HD1 PHE 18 1HD PHE 18 1.065 1.737 2.985
125 HD2 PHE 18 2HD PHE 18 -2.236 0.168 0.805
126 HE1 PHE 18 1HE PHE 18 2.140 -0.477 2.957
127 HE2 PHE 18 2HE PHE 18 -1.169 -2.047 0.775
128 HZ PHE 18 HZ PHE 18 1.021 -2.373 1.852
129 H ASN 19 H ASN 19 -0.556 4.840 4.151
130 HA ASN 19 HA ASN 19 -2.758 6.709 4.092
131 1HB ASN 19 2HB ASN 19 0.030 6.718 5.128
132 2HB ASN 19 1HB ASN 19 -0.687 8.277 4.732
133 1HD2 ASN 19 1HD2 ASN 19 -0.772 5.532 6.831
134 2HD2 ASN 19 2HD2 ASN 19 -1.869 6.190 7.992
135 H TYR 20 H TYR 20 -0.198 5.783 2.001
136 HA TYR 20 HA TYR 20 -0.821 8.066 0.253
137 1HB TYR 20 2HB TYR 20 1.823 6.977 1.089
138 2HB TYR 20 1HB TYR 20 1.659 7.554 -0.567
139 HD1 TYR 20 1HD TYR 20 2.036 9.795 -1.010
140 HD2 TYR 20 2HD TYR 20 0.972 8.632 2.942
141 HE1 TYR 20 1HE TYR 20 2.386 12.105 -0.241
142 HE2 TYR 20 2HE TYR 20 1.318 10.940 3.721
143 HH TYR 20 HH TYR 20 2.841 13.324 1.786
144 H VAL 21 H VAL 21 -1.417 7.558 -1.764
145 HA VAL 21 HA VAL 21 -2.097 4.995 -2.544
146 HB VAL 21 HB VAL 21 -1.329 7.223 -4.435
147 1HG1 VAL 21 1HG1 VAL 21 -3.140 6.112 -5.829
148 2HG1 VAL 21 2HG1 VAL 21 -3.010 4.748 -4.718
149 3HG1 VAL 21 3HG1 VAL 21 -1.614 5.242 -5.676
150 1HG2 VAL 21 1HG2 VAL 21 -3.816 7.711 -4.368
151 2HG2 VAL 21 2HG2 VAL 21 -2.888 8.181 -2.943
152 3HG2 VAL 21 3HG2 VAL 21 -3.873 6.718 -2.912
153 H LYS 22 H LYS 22 0.960 6.649 -2.796
154 HA LYS 22 HA LYS 22 2.188 4.960 -4.700
155 1HB LYS 22 2HB LYS 22 3.198 6.856 -2.608
156 2HB LYS 22 1HB LYS 22 4.328 5.806 -3.454
157 1HG LYS 22 2HG LYS 22 4.141 6.938 -5.399
158 2HG LYS 22 1HG LYS 22 2.440 7.328 -5.138
159 1HD LYS 22 2HD LYS 22 2.931 9.180 -3.837
160 2HD LYS 22 1HD LYS 22 4.539 8.586 -3.420
161 1HE LYS 22 2HE LYS 22 4.065 9.086 -6.284
162 2HE LYS 22 1HE LYS 22 4.064 10.515 -5.251
163 1HZ LYS 22 1HZ LYS 22 6.235 9.491 -4.337
164 2HZ LYS 22 2HZ LYS 22 6.269 10.308 -5.818
165 3HZ LYS 22 3HZ LYS 22 6.248 8.616 -5.787
166 H THR 23 H THR 23 1.730 4.741 -1.236
167 HA THR 23 HA THR 23 3.569 2.610 -0.826
168 HB THR 23 HB THR 23 1.242 2.845 0.991
169 HG1 THR 23 1HG THR 23 1.361 4.943 0.956
170 1HG2 THR 23 1HG2 THR 23 4.199 2.969 1.518
171 2HG2 THR 23 2HG2 THR 23 3.211 1.511 1.589
172 3HG2 THR 23 3HG2 THR 23 2.917 2.831 2.721
173 H TYR 24 H TYR 24 0.102 2.787 -1.454
174 HA TYR 24 HA TYR 24 -0.460 0.047 -1.149
175 1HB TYR 24 2HB TYR 24 -2.178 1.847 -1.286
176 2HB TYR 24 1HB TYR 24 -1.823 2.014 -3.000
177 HD1 TYR 24 1HD TYR 24 -3.635 1.229 -4.205
178 HD2 TYR 24 2HD TYR 24 -2.300 -0.992 -0.831
179 HE1 TYR 24 1HE TYR 24 -5.276 -0.529 -4.720
180 HE2 TYR 24 2HE TYR 24 -3.936 -2.755 -1.336
181 HH TYR 24 HH TYR 24 -5.300 -3.272 -4.070
182 H LEU 25 H LEU 25 0.908 1.919 -3.740
183 HA LEU 25 HA LEU 25 0.681 -0.145 -5.728
184 1HB LEU 25 2HB LEU 25 2.324 2.385 -5.602
185 2HB LEU 25 1HB LEU 25 2.315 1.305 -6.983
186 HG LEU 25 HG LEU 25 -0.095 2.779 -5.918
187 1HD1 LEU 25 1HD1 LEU 25 0.196 4.375 -7.527
188 2HD1 LEU 25 2HD1 LEU 25 1.131 3.308 -8.575
189 3HD1 LEU 25 3HD1 LEU 25 1.878 4.013 -7.141
190 1HD2 LEU 25 1HD2 LEU 25 -0.817 2.034 -8.361
191 2HD2 LEU 25 2HD2 LEU 25 -1.078 1.007 -6.951
192 3HD2 LEU 25 3HD2 LEU 25 0.302 0.715 -8.011
193 H ALA 26 H ALA 26 3.181 1.071 -3.565
194 HA ALA 26 HA ALA 26 5.280 -0.558 -4.455
195 1HB ALA 26 1HB ALA 26 5.391 1.478 -2.925
196 2HB ALA 26 2HB ALA 26 6.455 0.125 -2.543
197 3HB ALA 26 3HB ALA 26 4.974 0.371 -1.618
198 H HIS 27 H HIS 27 2.602 -1.147 -2.272
199 HA HIS 27 HA HIS 27 3.683 -3.543 -1.147
200 1HB HIS 27 2HB HIS 27 2.031 -2.417 0.143
201 2HB HIS 27 1HB HIS 27 0.901 -2.372 -1.207
202 HD1 HIS 27 1HD HIS 27 2.427 -4.867 1.222
203 HD2 HIS 27 2HD HIS 27 -0.781 -4.490 -1.388
204 HE1 HIS 27 1HE HIS 27 0.977 -6.909 1.576
205 H LYS 28 H LYS 28 1.451 -2.828 -3.799
206 HA LYS 28 HA LYS 28 0.892 -5.571 -4.372
207 1HB LYS 28 2HB LYS 28 -0.427 -3.380 -4.993
208 2HB LYS 28 1HB LYS 28 0.593 -3.416 -6.425
209 1HG LYS 28 2HG LYS 28 -0.267 -5.953 -6.434
210 2HG LYS 28 1HG LYS 28 -1.637 -5.176 -5.638
211 1HD LYS 28 2HD LYS 28 -1.205 -3.449 -7.671
212 2HD LYS 28 1HD LYS 28 -0.686 -4.961 -8.419
213 1HE LYS 28 2HE LYS 28 -2.870 -5.186 -8.903
214 2HE LYS 28 1HE LYS 28 -2.985 -5.750 -7.237
215 1HZ LYS 28 1HZ LYS 28 -4.571 -4.156 -7.186
216 2HZ LYS 28 2HZ LYS 28 -3.864 -3.229 -8.411
217 3HZ LYS 28 3HZ LYS 28 -3.247 -3.161 -6.837
218 H GLN 29 H GLN 29 3.358 -3.313 -5.319
219 HA GLN 29 HA GLN 29 4.253 -4.920 -7.553
220 1HB GLN 29 2HB GLN 29 4.415 -2.279 -7.064
221 2HB GLN 29 1HB GLN 29 5.992 -2.781 -6.472
222 1HG GLN 29 2HG GLN 29 4.901 -3.326 -9.223
223 2HG GLN 29 1HG GLN 29 6.070 -2.074 -8.806
224 1HE2 GLN 29 1HE2 GLN 29 5.840 -4.948 -10.213
225 2HE2 GLN 29 2HE2 GLN 29 7.386 -5.622 -9.837
226 H PHE 30 H PHE 30 4.848 -4.803 -4.173
227 HA PHE 30 HA PHE 30 7.298 -6.399 -4.539
228 1HB PHE 30 2HB PHE 30 6.520 -4.361 -2.516
229 2HB PHE 30 1HB PHE 30 7.509 -5.709 -1.973
230 HD1 PHE 30 1HD PHE 30 7.510 -2.517 -3.504
231 HD2 PHE 30 2HD PHE 30 9.657 -6.186 -3.314
232 HE1 PHE 30 1HE PHE 30 9.518 -1.381 -4.358
233 HE2 PHE 30 2HE PHE 30 11.669 -5.058 -4.168
234 HZ PHE 30 HZ PHE 30 11.602 -2.653 -4.692
235 H TYR 31 H TYR 31 4.396 -6.067 -2.506
236 HA TYR 31 HA TYR 31 4.791 -8.590 -1.218
237 1HB TYR 31 2HB TYR 31 3.354 -6.405 -0.573
238 2HB TYR 31 1HB TYR 31 2.077 -7.397 -1.271
239 HD1 TYR 31 1HD TYR 31 4.609 -7.217 1.410
240 HD2 TYR 31 2HD TYR 31 1.227 -9.303 -0.114
241 HE1 TYR 31 1HE TYR 31 4.418 -8.448 3.531
242 HE2 TYR 31 2HE TYR 31 1.027 -10.538 2.003
243 HH TYR 31 HH TYR 31 3.473 -10.539 4.370
244 H HIS 32 H HIS 32 2.781 -7.442 -3.891
245 HA HIS 32 HA HIS 32 1.947 -10.220 -4.382
246 1HB HIS 32 2HB HIS 32 0.685 -7.632 -5.310
247 2HB HIS 32 1HB HIS 32 0.107 -9.243 -5.724
248 HD1 HIS 32 1HD HIS 32 -1.403 -10.397 -4.021
249 HD2 HIS 32 2HD HIS 32 0.379 -6.939 -2.559
250 HE1 HIS 32 1HE HIS 32 -2.515 -9.905 -1.799
251 H LYS 33 H LYS 33 4.468 -9.735 -5.157
252 HA LYS 33 HA LYS 33 4.288 -10.030 -8.024
253 1HB LYS 33 2HB LYS 33 5.236 -7.558 -6.782
254 2HB LYS 33 1HB LYS 33 6.408 -8.261 -7.888
255 1HG LYS 33 2HG LYS 33 3.639 -8.125 -8.877
256 2HG LYS 33 1HG LYS 33 4.455 -6.579 -8.640
257 1HD LYS 33 2HD LYS 33 5.203 -6.971 -10.737
258 2HD LYS 33 1HD LYS 33 6.404 -7.951 -9.894
259 1HE LYS 33 2HE LYS 33 3.840 -9.267 -10.565
260 2HE LYS 33 1HE LYS 33 4.908 -8.878 -11.913
261 1HZ LYS 33 1HZ LYS 33 5.888 -10.312 -9.520
262 2HZ LYS 33 2HZ LYS 33 6.591 -10.227 -11.056
263 3HZ LYS 33 3HZ LYS 33 5.184 -11.135 -10.820
264 H ASN 34 H ASN 34 4.922 -11.892 -6.109
265 HA ASN 34 HA ASN 34 7.470 -12.788 -7.017
266 1HB ASN 34 2HB ASN 34 8.128 -11.128 -5.251
267 2HB ASN 34 1HB ASN 34 7.285 -12.128 -4.071
268 1HD2 ASN 34 1HD2 ASN 34 10.192 -11.531 -5.592
269 2HD2 ASN 34 2HD2 ASN 34 11.031 -12.969 -5.134
270 H LYS 35 H LYS 35 5.888 -14.432 -7.609
271 HA LYS 35 HA LYS 35 4.940 -16.486 -7.377
272 1HB LYS 35 2HB LYS 35 6.498 -16.650 -4.794
273 2HB LYS 35 1HB LYS 35 5.865 -17.995 -5.732
274 1HG LYS 35 2HG LYS 35 7.461 -17.741 -7.406
275 2HG LYS 35 1HG LYS 35 7.847 -16.090 -6.916
276 1HD LYS 35 2HD LYS 35 8.719 -17.065 -4.756
277 2HD LYS 35 1HD LYS 35 8.558 -18.655 -5.505
278 1HE LYS 35 2HE LYS 35 10.802 -18.022 -5.841
279 2HE LYS 35 1HE LYS 35 9.997 -17.758 -7.388
280 1HZ LYS 35 1HZ LYS 35 11.260 -15.852 -7.057
281 2HZ LYS 35 2HZ LYS 35 10.884 -15.751 -5.411
282 3HZ LYS 35 3HZ LYS 35 9.711 -15.375 -6.570
283 HA PRO 36 HA PRO 36 1.775 -14.760 -4.463
284 1HB PRO 36 2HB PRO 36 -0.321 -15.063 -6.159
285 2HB PRO 36 1HB PRO 36 0.729 -13.640 -6.177
286 1HG PRO 36 2HG PRO 36 0.777 -16.050 -7.952
287 2HG PRO 36 1HG PRO 36 0.953 -14.339 -8.384
288 1HD PRO 36 2HD PRO 36 3.072 -16.009 -8.146
289 2HD PRO 36 1HD PRO 36 3.170 -14.279 -7.756
Start of MODEL 17
1 1H GLY 1 1HT GLY 1 -19.207 6.892 -9.471
2 2H GLY 1 2HT GLY 1 -17.636 7.477 -9.254
3 3H GLY 1 3HT GLY 1 -17.890 6.026 -10.085
4 1HA GLY 1 1HA GLY 1 -18.919 8.645 -11.017
5 2HA GLY 1 2HA GLY 1 -17.377 7.979 -11.531
6 H SER 2 H SER 2 -18.195 8.031 -13.698
7 HA SER 2 HA SER 2 -20.310 6.098 -14.301
8 1HB SER 2 2HB SER 2 -20.113 8.549 -15.261
9 2HB SER 2 1HB SER 2 -19.011 7.784 -16.405
10 HG SER 2 HG SER 2 -21.053 7.682 -17.270
11 H ALA 3 H ALA 3 -17.676 5.232 -13.455
12 HA ALA 3 HA ALA 3 -17.224 3.205 -15.361
13 1HB ALA 3 1HB ALA 3 -16.132 4.642 -16.804
14 2HB ALA 3 2HB ALA 3 -14.796 3.991 -15.855
15 3HB ALA 3 3HB ALA 3 -15.434 5.595 -15.495
16 H ALA 4 H ALA 4 -17.611 3.439 -12.552
17 HA ALA 4 HA ALA 4 -16.854 2.554 -10.598
18 1HB ALA 4 1HB ALA 4 -14.706 1.218 -12.228
19 2HB ALA 4 2HB ALA 4 -16.371 0.642 -12.161
20 3HB ALA 4 3HB ALA 4 -15.394 0.686 -10.694
21 H GLU 5 H GLU 5 -14.982 2.498 -9.077
22 HA GLU 5 HA GLU 5 -12.512 3.582 -9.368
23 1HB GLU 5 2HB GLU 5 -14.568 5.658 -9.578
24 2HB GLU 5 1HB GLU 5 -13.372 5.999 -8.336
25 1HG GLU 5 2HG GLU 5 -12.396 5.133 -10.999
26 2HG GLU 5 1HG GLU 5 -13.052 6.762 -10.841
27 H VAL 6 H VAL 6 -13.007 1.774 -7.730
28 HA VAL 6 HA VAL 6 -13.358 2.984 -5.063
29 HB VAL 6 HB VAL 6 -13.914 0.108 -5.797
30 1HG1 VAL 6 1HG1 VAL 6 -15.079 1.324 -3.383
31 2HG1 VAL 6 2HG1 VAL 6 -13.328 1.107 -3.357
32 3HG1 VAL 6 3HG1 VAL 6 -14.385 -0.279 -3.628
33 1HG2 VAL 6 1HG2 VAL 6 -16.057 0.589 -6.272
34 2HG2 VAL 6 2HG2 VAL 6 -15.443 2.212 -6.588
35 3HG2 VAL 6 3HG2 VAL 6 -16.160 1.831 -5.023
36 H MET 7 H MET 7 -11.084 3.444 -5.025
37 HA MET 7 HA MET 7 -9.555 1.499 -3.701
38 1HB MET 7 2HB MET 7 -7.802 1.094 -5.389
39 2HB MET 7 1HB MET 7 -9.359 0.436 -5.878
40 1HG MET 7 2HG MET 7 -9.549 1.825 -7.636
41 2HG MET 7 1HG MET 7 -8.783 3.171 -6.796
42 1HE MET 7 1HE MET 7 -5.480 3.386 -8.378
43 2HE MET 7 2HE MET 7 -6.325 3.764 -6.877
44 3HE MET 7 3HE MET 7 -7.085 4.115 -8.429
45 H LYS 8 H LYS 8 -7.754 2.384 -2.747
46 HA LYS 8 HA LYS 8 -6.745 4.948 -3.655
47 1HB LYS 8 2HB LYS 8 -8.748 5.302 -2.066
48 2HB LYS 8 1HB LYS 8 -7.669 4.735 -0.800
49 1HG LYS 8 2HG LYS 8 -6.159 6.554 -1.181
50 2HG LYS 8 1HG LYS 8 -7.066 7.066 -2.605
51 1HD LYS 8 2HD LYS 8 -8.226 6.971 0.175
52 2HD LYS 8 1HD LYS 8 -7.495 8.414 -0.531
53 1HE LYS 8 2HE LYS 8 -9.129 8.343 -2.354
54 2HE LYS 8 1HE LYS 8 -9.859 6.904 -1.643
55 1HZ LYS 8 1HZ LYS 8 -10.043 9.688 -0.802
56 2HZ LYS 8 2HZ LYS 8 -9.987 8.528 0.428
57 3HZ LYS 8 3HZ LYS 8 -11.205 8.459 -0.742
58 H LYS 9 H LYS 9 -6.667 2.945 -0.701
59 HA LYS 9 HA LYS 9 -4.005 2.061 -1.139
60 1HB LYS 9 2HB LYS 9 -3.354 3.340 1.153
61 2HB LYS 9 1HB LYS 9 -2.960 3.941 -0.449
62 1HG LYS 9 2HG LYS 9 -3.906 5.672 1.011
63 2HG LYS 9 1HG LYS 9 -4.893 5.385 -0.421
64 1HD LYS 9 2HD LYS 9 -6.556 4.295 0.793
65 2HD LYS 9 1HD LYS 9 -5.479 3.963 2.150
66 1HE LYS 9 2HE LYS 9 -5.455 6.319 2.737
67 2HE LYS 9 1HE LYS 9 -6.463 6.697 1.340
68 1HZ LYS 9 1HZ LYS 9 -7.538 6.421 3.660
69 2HZ LYS 9 2HZ LYS 9 -7.418 4.764 3.341
70 3HZ LYS 9 3HZ LYS 9 -8.309 5.761 2.305
71 H TYR 10 H TYR 10 -5.742 0.336 -0.719
72 HA TYR 10 HA TYR 10 -5.308 -0.650 1.960
73 1HB TYR 10 2HB TYR 10 -7.348 0.719 2.226
74 2HB TYR 10 1HB TYR 10 -8.128 -0.209 0.951
75 HD1 TYR 10 1HD TYR 10 -7.638 0.076 4.433
76 HD2 TYR 10 2HD TYR 10 -8.248 -2.796 1.355
77 HE1 TYR 10 1HE TYR 10 -8.429 -1.541 6.108
78 HE2 TYR 10 2HE TYR 10 -9.041 -4.422 3.021
79 HH TYR 10 HH TYR 10 -9.929 -3.593 6.121
80 H CYS 11 H CYS 11 -4.899 -2.770 1.820
81 HA CYS 11 HA CYS 11 -5.442 -4.131 -0.678
82 1HB CYS 11 2HB CYS 11 -3.263 -4.330 0.619
83 2HB CYS 11 1HB CYS 11 -4.143 -5.339 1.761
84 H SER 12 H SER 12 -7.083 -5.420 -1.068
85 HA SER 12 HA SER 12 -8.977 -6.038 1.036
86 1HB SER 12 2HB SER 12 -10.496 -6.627 -0.694
87 2HB SER 12 1HB SER 12 -9.619 -5.216 -1.287
88 HG SER 12 HG SER 12 -9.757 -6.868 -2.865
89 H THR 13 H THR 13 -6.263 -7.409 0.709
90 HA THR 13 HA THR 13 -7.298 -10.134 0.937
91 HB THR 13 HB THR 13 -4.769 -9.350 -0.518
92 HG1 THR 13 1HG THR 13 -7.299 -10.230 -1.422
93 1HG2 THR 13 1HG2 THR 13 -4.919 -11.780 -1.283
94 2HG2 THR 13 2HG2 THR 13 -5.965 -12.018 0.117
95 3HG2 THR 13 3HG2 THR 13 -4.306 -11.461 0.340
96 H CYS 14 H CYS 14 -4.813 -7.784 1.744
97 HA CYS 14 HA CYS 14 -3.803 -9.570 3.844
98 1HB CYS 14 2HB CYS 14 -2.669 -6.947 2.857
99 2HB CYS 14 1HB CYS 14 -1.913 -8.030 4.019
100 H ASP 15 H ASP 15 -6.139 -7.284 3.534
101 HA ASP 15 HA ASP 15 -7.264 -5.912 4.945
102 1HB ASP 15 2HB ASP 15 -6.013 -7.759 6.984
103 2HB ASP 15 1HB ASP 15 -7.322 -6.632 7.319
104 H ILE 16 H ILE 16 -4.794 -4.946 4.085
105 HA ILE 16 HA ILE 16 -3.841 -3.458 6.445
106 HB ILE 16 HB ILE 16 -2.259 -3.752 3.906
107 1HG1 ILE 16 2HG1 ILE 16 -2.766 -6.018 4.734
108 2HG1 ILE 16 1HG1 ILE 16 -1.061 -5.627 4.915
109 1HG2 ILE 16 1HG2 ILE 16 -1.409 -2.036 5.256
110 2HG2 ILE 16 2HG2 ILE 16 -0.384 -3.428 5.605
111 3HG2 ILE 16 3HG2 ILE 16 -1.652 -2.962 6.737
112 1HD1 ILE 16 1HD1 ILE 16 -1.878 -6.790 6.865
113 2HD1 ILE 16 2HD1 ILE 16 -3.137 -5.576 7.090
114 3HD1 ILE 16 3HD1 ILE 16 -1.441 -5.135 7.284
115 H SER 17 H SER 17 -3.093 -1.243 5.996
116 HA SER 17 HA SER 17 -4.477 0.001 3.721
117 1HB SER 17 2HB SER 17 -4.710 1.957 5.572
118 2HB SER 17 1HB SER 17 -5.962 0.749 5.283
119 HG SER 17 HG SER 17 -5.090 -0.466 7.001
120 H PHE 18 H PHE 18 -3.624 2.134 3.148
121 HA PHE 18 HA PHE 18 -0.893 2.611 4.086
122 1HB PHE 18 2HB PHE 18 -1.810 2.436 1.213
123 2HB PHE 18 1HB PHE 18 -0.263 3.104 1.705
124 HD1 PHE 18 1HD PHE 18 1.443 1.636 2.732
125 HD2 PHE 18 2HD PHE 18 -2.196 0.103 1.146
126 HE1 PHE 18 1HE PHE 18 2.411 -0.627 2.704
127 HE2 PHE 18 2HE PHE 18 -1.236 -2.161 1.114
128 HZ PHE 18 HZ PHE 18 1.071 -2.529 1.895
129 H ASN 19 H ASN 19 -0.393 4.696 4.397
130 HA ASN 19 HA ASN 19 -2.464 6.646 4.333
131 1HB ASN 19 2HB ASN 19 -0.818 8.124 5.307
132 2HB ASN 19 1HB ASN 19 -0.699 6.548 6.071
133 1HD2 ASN 19 1HD2 ASN 19 0.927 8.978 4.364
134 2HD2 ASN 19 2HD2 ASN 19 2.442 8.168 4.176
135 H TYR 20 H TYR 20 -0.356 5.538 1.969
136 HA TYR 20 HA TYR 20 -0.920 7.877 0.311
137 1HB TYR 20 2HB TYR 20 1.766 6.899 1.106
138 2HB TYR 20 1HB TYR 20 1.562 7.367 -0.579
139 HD1 TYR 20 1HD TYR 20 -0.273 9.647 -0.373
140 HD2 TYR 20 2HD TYR 20 3.042 8.585 2.074
141 HE1 TYR 20 1HE TYR 20 0.018 12.008 0.246
142 HE2 TYR 20 2HE TYR 20 3.343 10.944 2.700
143 HH TYR 20 HH TYR 20 1.730 13.495 1.086
144 H VAL 21 H VAL 21 -1.503 7.377 -1.715
145 HA VAL 21 HA VAL 21 -2.161 4.784 -2.464
146 HB VAL 21 HB VAL 21 -1.528 7.017 -4.395
147 1HG1 VAL 21 1HG1 VAL 21 -2.136 4.458 -4.969
148 2HG1 VAL 21 2HG1 VAL 21 -2.590 5.824 -5.989
149 3HG1 VAL 21 3HG1 VAL 21 -3.757 5.143 -4.855
150 1HG2 VAL 21 1HG2 VAL 21 -4.192 7.171 -4.104
151 2HG2 VAL 21 2HG2 VAL 21 -3.059 8.147 -3.168
152 3HG2 VAL 21 3HG2 VAL 21 -3.743 6.679 -2.471
153 H LYS 22 H LYS 22 0.825 6.547 -2.830
154 HA LYS 22 HA LYS 22 2.036 4.900 -4.782
155 1HB LYS 22 2HB LYS 22 3.211 6.679 -2.642
156 2HB LYS 22 1HB LYS 22 4.186 5.850 -3.848
157 1HG LYS 22 2HG LYS 22 3.949 7.746 -5.010
158 2HG LYS 22 1HG LYS 22 2.365 7.089 -5.426
159 1HD LYS 22 2HD LYS 22 1.818 8.267 -3.049
160 2HD LYS 22 1HD LYS 22 3.085 9.332 -3.660
161 1HE LYS 22 2HE LYS 22 1.851 9.843 -5.607
162 2HE LYS 22 1HE LYS 22 0.715 8.524 -5.324
163 1HZ LYS 22 1HZ LYS 22 0.796 11.187 -4.159
164 2HZ LYS 22 2HZ LYS 22 0.367 9.934 -3.107
165 3HZ LYS 22 3HZ LYS 22 -0.532 10.199 -4.515
166 H THR 23 H THR 23 1.761 4.686 -1.290
167 HA THR 23 HA THR 23 3.660 2.576 -1.006
168 HB THR 23 HB THR 23 1.490 2.792 0.990
169 HG1 THR 23 1HG THR 23 1.854 4.813 1.544
170 1HG2 THR 23 1HG2 THR 23 3.546 1.515 1.421
171 2HG2 THR 23 2HG2 THR 23 3.292 2.822 2.578
172 3HG2 THR 23 3HG2 THR 23 4.474 3.008 1.283
173 H TYR 24 H TYR 24 0.165 2.749 -1.402
174 HA TYR 24 HA TYR 24 -0.398 0.020 -1.029
175 1HB TYR 24 2HB TYR 24 -2.122 1.789 -1.079
176 2HB TYR 24 1HB TYR 24 -1.833 2.008 -2.799
177 HD1 TYR 24 1HD TYR 24 -3.743 1.297 -3.906
178 HD2 TYR 24 2HD TYR 24 -2.179 -1.099 -0.758
179 HE1 TYR 24 1HE TYR 24 -5.407 -0.442 -4.411
180 HE2 TYR 24 2HE TYR 24 -3.837 -2.845 -1.255
181 HH TYR 24 HH TYR 24 -5.404 -3.180 -3.952
182 H LEU 25 H LEU 25 0.818 1.851 -3.724
183 HA LEU 25 HA LEU 25 0.468 -0.234 -5.668
184 1HB LEU 25 2HB LEU 25 1.838 2.418 -5.594
185 2HB LEU 25 1HB LEU 25 2.295 1.280 -6.846
186 HG LEU 25 HG LEU 25 -0.576 2.058 -6.408
187 1HD1 LEU 25 1HD1 LEU 25 0.663 4.119 -6.755
188 2HD1 LEU 25 2HD1 LEU 25 -0.300 3.725 -8.180
189 3HD1 LEU 25 3HD1 LEU 25 1.440 3.430 -8.181
190 1HD2 LEU 25 1HD2 LEU 25 -0.311 1.577 -9.026
191 2HD2 LEU 25 2HD2 LEU 25 -0.671 0.313 -7.850
192 3HD2 LEU 25 3HD2 LEU 25 0.984 0.546 -8.414
193 H ALA 26 H ALA 26 3.103 1.002 -3.680
194 HA ALA 26 HA ALA 26 5.136 -0.658 -4.661
195 1HB ALA 26 1HB ALA 26 5.146 1.408 -3.000
196 2HB ALA 26 2HB ALA 26 6.444 0.213 -3.011
197 3HB ALA 26 3HB ALA 26 5.168 0.120 -1.797
198 H HIS 27 H HIS 27 2.566 -1.208 -2.350
199 HA HIS 27 HA HIS 27 3.683 -3.590 -1.232
200 1HB HIS 27 2HB HIS 27 2.090 -2.456 0.112
201 2HB HIS 27 1HB HIS 27 0.914 -2.394 -1.197
202 HD1 HIS 27 1HD HIS 27 2.450 -4.877 1.228
203 HD2 HIS 27 2HD HIS 27 -0.783 -4.513 -1.353
204 HE1 HIS 27 1HE HIS 27 0.987 -6.901 1.629
205 H LYS 28 H LYS 28 1.431 -2.891 -3.858
206 HA LYS 28 HA LYS 28 0.777 -5.627 -4.354
207 1HB LYS 28 2HB LYS 28 -0.506 -3.450 -5.015
208 2HB LYS 28 1HB LYS 28 0.536 -3.479 -6.430
209 1HG LYS 28 2HG LYS 28 -0.844 -6.002 -5.783
210 2HG LYS 28 1HG LYS 28 -1.860 -4.666 -6.329
211 1HD LYS 28 2HD LYS 28 0.631 -5.317 -7.837
212 2HD LYS 28 1HD LYS 28 -0.798 -6.328 -8.056
213 1HE LYS 28 2HE LYS 28 -1.893 -3.865 -8.262
214 2HE LYS 28 1HE LYS 28 -0.283 -3.558 -8.912
215 1HZ LYS 28 1HZ LYS 28 -2.390 -5.335 -9.938
216 2HZ LYS 28 2HZ LYS 28 -0.771 -5.679 -10.287
217 3HZ LYS 28 3HZ LYS 28 -1.444 -4.204 -10.768
218 H GLN 29 H GLN 29 3.179 -3.379 -5.571
219 HA GLN 29 HA GLN 29 4.079 -5.210 -7.625
220 1HB GLN 29 2HB GLN 29 4.118 -2.532 -7.501
221 2HB GLN 29 1HB GLN 29 5.725 -2.860 -6.867
222 1HG GLN 29 2HG GLN 29 5.679 -4.477 -9.043
223 2HG GLN 29 1HG GLN 29 4.673 -3.135 -9.586
224 1HE2 GLN 29 1HE2 GLN 29 5.892 -1.049 -8.231
225 2HE2 GLN 29 2HE2 GLN 29 7.478 -0.812 -8.874
226 H PHE 30 H PHE 30 4.778 -4.600 -4.318
227 HA PHE 30 HA PHE 30 7.353 -6.001 -4.537
228 1HB PHE 30 2HB PHE 30 7.311 -3.780 -3.387
229 2HB PHE 30 1HB PHE 30 6.257 -4.482 -2.163
230 HD1 PHE 30 1HD PHE 30 9.620 -3.936 -3.189
231 HD2 PHE 30 2HD PHE 30 7.139 -6.493 -0.860
232 HE1 PHE 30 1HE PHE 30 11.594 -4.706 -1.936
233 HE2 PHE 30 2HE PHE 30 9.108 -7.266 0.396
234 HZ PHE 30 HZ PHE 30 11.338 -6.372 -0.141
235 H TYR 31 H TYR 31 4.423 -5.932 -2.501
236 HA TYR 31 HA TYR 31 5.059 -8.416 -1.231
237 1HB TYR 31 2HB TYR 31 3.493 -6.385 -0.493
238 2HB TYR 31 1HB TYR 31 2.263 -7.396 -1.243
239 HD1 TYR 31 1HD TYR 31 4.930 -7.422 1.346
240 HD2 TYR 31 2HD TYR 31 1.340 -9.208 -0.077
241 HE1 TYR 31 1HE TYR 31 4.788 -8.762 3.403
242 HE2 TYR 31 2HE TYR 31 1.187 -10.552 1.977
243 HH TYR 31 HH TYR 31 2.741 -9.911 4.715
244 H HIS 32 H HIS 32 2.638 -7.442 -3.654
245 HA HIS 32 HA HIS 32 2.057 -10.258 -4.182
246 1HB HIS 32 2HB HIS 32 0.724 -7.743 -5.205
247 2HB HIS 32 1HB HIS 32 0.200 -9.383 -5.567
248 HD1 HIS 32 1HD HIS 32 -1.282 -10.530 -3.836
249 HD2 HIS 32 2HD HIS 32 0.362 -6.960 -2.490
250 HE1 HIS 32 1HE HIS 32 -2.431 -9.998 -1.644
251 H LYS 33 H LYS 33 4.603 -9.478 -4.945
252 HA LYS 33 HA LYS 33 4.642 -10.277 -7.657
253 1HB LYS 33 2HB LYS 33 4.768 -7.373 -7.074
254 2HB LYS 33 1HB LYS 33 5.942 -7.986 -8.231
255 1HG LYS 33 2HG LYS 33 3.716 -9.138 -9.191
256 2HG LYS 33 1HG LYS 33 3.021 -7.684 -8.469
257 1HD LYS 33 2HD LYS 33 5.432 -7.074 -9.946
258 2HD LYS 33 1HD LYS 33 4.253 -7.905 -10.963
259 1HE LYS 33 2HE LYS 33 3.116 -5.805 -9.264
260 2HE LYS 33 1HE LYS 33 4.281 -5.223 -10.453
261 1HZ LYS 33 1HZ LYS 33 1.941 -5.280 -11.241
262 2HZ LYS 33 2HZ LYS 33 1.978 -6.968 -11.128
263 3HZ LYS 33 3HZ LYS 33 3.009 -6.170 -12.206
264 H ASN 34 H ASN 34 5.834 -11.259 -5.392
265 HA ASN 34 HA ASN 34 8.552 -11.415 -6.193
266 1HB ASN 34 2HB ASN 34 8.556 -9.203 -5.015
267 2HB ASN 34 1HB ASN 34 8.070 -10.038 -3.542
268 1HD2 ASN 34 1HD2 ASN 34 9.631 -10.654 -2.238
269 2HD2 ASN 34 2HD2 ASN 34 11.289 -10.874 -2.668
270 H LYS 35 H LYS 35 6.730 -13.371 -5.923
271 HA LYS 35 HA LYS 35 6.405 -15.435 -5.028
272 1HB LYS 35 2HB LYS 35 8.860 -15.558 -5.101
273 2HB LYS 35 1HB LYS 35 8.945 -14.815 -3.510
274 1HG LYS 35 2HG LYS 35 7.376 -16.876 -2.903
275 2HG LYS 35 1HG LYS 35 8.226 -17.577 -4.282
276 1HD LYS 35 2HD LYS 35 9.761 -18.139 -2.729
277 2HD LYS 35 1HD LYS 35 10.292 -16.468 -2.933
278 1HE LYS 35 2HE LYS 35 10.026 -17.101 -0.564
279 2HE LYS 35 1HE LYS 35 8.965 -15.774 -1.037
280 1HZ LYS 35 1HZ LYS 35 7.850 -18.447 -1.279
281 2HZ LYS 35 2HZ LYS 35 7.129 -17.017 -0.732
282 3HZ LYS 35 3HZ LYS 35 8.130 -17.907 0.301
283 HA PRO 36 HA PRO 36 4.453 -13.537 -1.284
284 1HB PRO 36 2HB PRO 36 1.962 -14.479 -1.799
285 2HB PRO 36 1HB PRO 36 2.578 -12.974 -2.490
286 1HG PRO 36 2HG PRO 36 2.403 -15.695 -3.727
287 2HG PRO 36 1HG PRO 36 2.014 -14.116 -4.436
288 1HD PRO 36 2HD PRO 36 4.344 -15.402 -4.933
289 2HD PRO 36 1HD PRO 36 4.222 -13.632 -4.883
Start of MODEL 18
1 1H GLY 1 1HT GLY 1 -10.044 -7.460 -8.699
2 2H GLY 1 2HT GLY 1 -11.410 -6.493 -8.453
3 3H GLY 1 3HT GLY 1 -10.595 -6.443 -9.934
4 1HA GLY 1 1HA GLY 1 -11.641 -9.023 -9.034
5 2HA GLY 1 2HA GLY 1 -12.789 -7.834 -9.628
6 H SER 2 H SER 2 -13.356 -8.799 -11.521
7 HA SER 2 HA SER 2 -11.215 -9.496 -13.404
8 1HB SER 2 2HB SER 2 -12.802 -11.286 -13.035
9 2HB SER 2 1HB SER 2 -14.156 -10.211 -13.386
10 HG SER 2 HG SER 2 -13.748 -11.350 -15.235
11 H ALA 3 H ALA 3 -11.933 -6.749 -12.857
12 HA ALA 3 HA ALA 3 -12.198 -5.832 -15.546
13 1HB ALA 3 1HB ALA 3 -14.292 -4.859 -15.556
14 2HB ALA 3 2HB ALA 3 -14.415 -4.858 -13.796
15 3HB ALA 3 3HB ALA 3 -14.595 -6.367 -14.692
16 H ALA 4 H ALA 4 -10.361 -5.567 -13.336
17 HA ALA 4 HA ALA 4 -9.046 -3.991 -12.353
18 1HB ALA 4 1HB ALA 4 -8.574 -2.173 -13.611
19 2HB ALA 4 2HB ALA 4 -10.270 -1.727 -13.799
20 3HB ALA 4 3HB ALA 4 -9.580 -3.011 -14.793
21 H GLU 5 H GLU 5 -9.041 -2.270 -10.794
22 HA GLU 5 HA GLU 5 -11.052 -0.663 -9.936
23 1HB GLU 5 2HB GLU 5 -11.646 -3.462 -9.311
24 2HB GLU 5 1HB GLU 5 -11.682 -2.419 -7.897
25 1HG GLU 5 2HG GLU 5 -13.106 -1.506 -10.333
26 2HG GLU 5 1HG GLU 5 -13.813 -2.823 -9.396
27 H VAL 6 H VAL 6 -8.651 -0.032 -9.756
28 HA VAL 6 HA VAL 6 -7.212 -0.929 -7.454
29 HB VAL 6 HB VAL 6 -6.739 1.609 -9.017
30 1HG1 VAL 6 1HG1 VAL 6 -5.171 0.023 -7.037
31 2HG1 VAL 6 2HG1 VAL 6 -5.379 1.770 -7.170
32 3HG1 VAL 6 3HG1 VAL 6 -4.321 0.919 -8.296
33 1HG2 VAL 6 1HG2 VAL 6 -6.150 -1.232 -9.665
34 2HG2 VAL 6 2HG2 VAL 6 -4.945 -0.014 -10.082
35 3HG2 VAL 6 3HG2 VAL 6 -6.580 0.106 -10.731
36 H MET 7 H MET 7 -7.748 -0.444 -5.438
37 HA MET 7 HA MET 7 -9.483 1.740 -4.791
38 1HB MET 7 2HB MET 7 -7.883 0.008 -2.901
39 2HB MET 7 1HB MET 7 -9.293 0.980 -2.504
40 1HG MET 7 2HG MET 7 -10.743 -0.538 -3.317
41 2HG MET 7 1HG MET 7 -9.665 -1.033 -4.622
42 1HE MET 7 1HE MET 7 -9.123 -3.987 -4.276
43 2HE MET 7 2HE MET 7 -7.577 -3.723 -3.469
44 3HE MET 7 3HE MET 7 -8.135 -2.589 -4.698
45 H LYS 8 H LYS 8 -8.833 3.173 -2.849
46 HA LYS 8 HA LYS 8 -6.845 4.942 -3.675
47 1HB LYS 8 2HB LYS 8 -8.746 5.455 -2.118
48 2HB LYS 8 1HB LYS 8 -7.862 4.621 -0.847
49 1HG LYS 8 2HG LYS 8 -6.360 6.304 -0.595
50 2HG LYS 8 1HG LYS 8 -6.443 6.784 -2.290
51 1HD LYS 8 2HD LYS 8 -8.898 7.170 -0.691
52 2HD LYS 8 1HD LYS 8 -7.528 8.208 -0.287
53 1HE LYS 8 2HE LYS 8 -8.981 9.257 -1.948
54 2HE LYS 8 1HE LYS 8 -7.379 8.933 -2.609
55 1HZ LYS 8 1HZ LYS 8 -9.188 8.349 -4.142
56 2HZ LYS 8 2HZ LYS 8 -9.760 7.209 -3.031
57 3HZ LYS 8 3HZ LYS 8 -8.236 7.009 -3.737
58 H LYS 9 H LYS 9 -6.712 2.951 -0.713
59 HA LYS 9 HA LYS 9 -4.094 1.984 -1.247
60 1HB LYS 9 2HB LYS 9 -3.380 3.277 1.050
61 2HB LYS 9 1HB LYS 9 -2.932 3.785 -0.569
62 1HG LYS 9 2HG LYS 9 -3.784 5.630 0.793
63 2HG LYS 9 1HG LYS 9 -4.784 5.336 -0.628
64 1HD LYS 9 2HD LYS 9 -6.531 4.479 0.615
65 2HD LYS 9 1HD LYS 9 -5.483 4.010 1.955
66 1HE LYS 9 2HE LYS 9 -5.560 6.064 2.912
67 2HE LYS 9 1HE LYS 9 -5.651 6.900 1.361
68 1HZ LYS 9 1HZ LYS 9 -7.908 6.719 1.292
69 2HZ LYS 9 2HZ LYS 9 -7.697 6.801 2.968
70 3HZ LYS 9 3HZ LYS 9 -7.955 5.306 2.220
71 H TYR 10 H TYR 10 -5.787 0.273 -0.770
72 HA TYR 10 HA TYR 10 -5.335 -0.680 1.920
73 1HB TYR 10 2HB TYR 10 -7.437 0.756 2.004
74 2HB TYR 10 1HB TYR 10 -8.190 -0.447 0.965
75 HD1 TYR 10 1HD TYR 10 -7.748 0.551 4.277
76 HD2 TYR 10 2HD TYR 10 -7.920 -2.949 1.864
77 HE1 TYR 10 1HE TYR 10 -8.335 -0.781 6.260
78 HE2 TYR 10 2HE TYR 10 -8.509 -4.290 3.840
79 HH TYR 10 HH TYR 10 -8.167 -3.178 6.985
80 H CYS 11 H CYS 11 -4.907 -2.794 1.795
81 HA CYS 11 HA CYS 11 -5.474 -4.190 -0.678
82 1HB CYS 11 2HB CYS 11 -3.276 -4.356 0.592
83 2HB CYS 11 1HB CYS 11 -4.133 -5.357 1.758
84 H SER 12 H SER 12 -7.115 -5.484 -1.029
85 HA SER 12 HA SER 12 -8.968 -6.104 1.111
86 1HB SER 12 2HB SER 12 -9.218 -6.884 -1.795
87 2HB SER 12 1HB SER 12 -10.506 -6.741 -0.598
88 HG SER 12 HG SER 12 -9.938 -4.460 -0.510
89 H THR 13 H THR 13 -6.254 -7.455 0.749
90 HA THR 13 HA THR 13 -7.261 -10.189 0.997
91 HB THR 13 HB THR 13 -4.754 -9.390 -0.488
92 HG1 THR 13 1HG THR 13 -7.207 -10.449 -1.440
93 1HG2 THR 13 1HG2 THR 13 -5.996 -12.119 -0.367
94 2HG2 THR 13 2HG2 THR 13 -4.677 -11.610 0.688
95 3HG2 THR 13 3HG2 THR 13 -4.443 -11.652 -1.059
96 H CYS 14 H CYS 14 -4.786 -7.814 1.767
97 HA CYS 14 HA CYS 14 -3.738 -9.589 3.858
98 1HB CYS 14 2HB CYS 14 -2.630 -6.962 2.850
99 2HB CYS 14 1HB CYS 14 -1.853 -8.039 4.004
100 H ASP 15 H ASP 15 -6.098 -7.331 3.577
101 HA ASP 15 HA ASP 15 -7.212 -5.961 5.000
102 1HB ASP 15 2HB ASP 15 -5.910 -7.790 7.023
103 2HB ASP 15 1HB ASP 15 -7.218 -6.670 7.380
104 H ILE 16 H ILE 16 -4.782 -4.956 4.090
105 HA ILE 16 HA ILE 16 -3.800 -3.457 6.431
106 HB ILE 16 HB ILE 16 -2.258 -3.742 3.868
107 1HG1 ILE 16 2HG1 ILE 16 -2.724 -6.011 4.712
108 2HG1 ILE 16 1HG1 ILE 16 -1.020 -5.599 4.864
109 1HG2 ILE 16 1HG2 ILE 16 -0.370 -3.431 5.603
110 2HG2 ILE 16 2HG2 ILE 16 -1.659 -2.869 6.667
111 3HG2 ILE 16 3HG2 ILE 16 -1.344 -2.035 5.144
112 1HD1 ILE 16 1HD1 ILE 16 -1.659 -6.717 6.847
113 2HD1 ILE 16 2HD1 ILE 16 -3.087 -5.700 7.040
114 3HD1 ILE 16 3HD1 ILE 16 -1.478 -5.011 7.256
115 H SER 17 H SER 17 -3.082 -1.235 5.961
116 HA SER 17 HA SER 17 -4.496 -0.016 3.694
117 1HB SER 17 2HB SER 17 -4.777 1.930 5.556
118 2HB SER 17 1HB SER 17 -6.007 0.706 5.241
119 HG SER 17 HG SER 17 -5.512 -0.289 7.067
120 H PHE 18 H PHE 18 -3.676 2.113 3.104
121 HA PHE 18 HA PHE 18 -0.977 2.678 4.081
122 1HB PHE 18 2HB PHE 18 -1.829 2.453 1.190
123 2HB PHE 18 1HB PHE 18 -0.299 3.131 1.716
124 HD1 PHE 18 1HD PHE 18 1.234 1.608 3.114
125 HD2 PHE 18 2HD PHE 18 -2.049 0.185 0.809
126 HE1 PHE 18 1HE PHE 18 2.212 -0.650 3.120
127 HE2 PHE 18 2HE PHE 18 -1.078 -2.075 0.813
128 HZ PHE 18 HZ PHE 18 1.053 -2.496 1.969
129 H ASN 19 H ASN 19 -0.559 4.787 4.384
130 HA ASN 19 HA ASN 19 -2.696 6.668 4.190
131 1HB ASN 19 2HB ASN 19 -0.950 8.265 5.046
132 2HB ASN 19 1HB ASN 19 -1.207 6.848 6.053
133 1HD2 ASN 19 1HD2 ASN 19 0.996 8.598 4.094
134 2HD2 ASN 19 2HD2 ASN 19 2.377 7.594 4.362
135 H TYR 20 H TYR 20 -0.131 5.717 2.124
136 HA TYR 20 HA TYR 20 -0.694 8.011 0.368
137 1HB TYR 20 2HB TYR 20 1.915 6.790 1.157
138 2HB TYR 20 1HB TYR 20 1.750 7.448 -0.468
139 HD1 TYR 20 1HD TYR 20 0.172 9.833 -0.133
140 HD2 TYR 20 2HD TYR 20 3.192 8.250 2.413
141 HE1 TYR 20 1HE TYR 20 0.618 12.091 0.734
142 HE2 TYR 20 2HE TYR 20 3.645 10.504 3.286
143 HH TYR 20 HH TYR 20 1.583 13.113 2.804
144 H VAL 21 H VAL 21 -1.351 7.523 -1.629
145 HA VAL 21 HA VAL 21 -2.083 4.965 -2.406
146 HB VAL 21 HB VAL 21 -1.363 7.184 -4.323
147 1HG1 VAL 21 1HG1 VAL 21 -3.003 4.691 -4.492
148 2HG1 VAL 21 2HG1 VAL 21 -1.806 5.326 -5.622
149 3HG1 VAL 21 3HG1 VAL 21 -3.398 6.078 -5.508
150 1HG2 VAL 21 1HG2 VAL 21 -2.843 8.362 -3.073
151 2HG2 VAL 21 2HG2 VAL 21 -3.605 6.915 -2.413
152 3HG2 VAL 21 3HG2 VAL 21 -4.010 7.460 -4.040
153 H LYS 22 H LYS 22 0.969 6.614 -2.740
154 HA LYS 22 HA LYS 22 2.125 4.949 -4.707
155 1HB LYS 22 2HB LYS 22 3.052 7.146 -4.098
156 2HB LYS 22 1HB LYS 22 3.472 6.527 -2.507
157 1HG LYS 22 2HG LYS 22 5.430 6.578 -3.903
158 2HG LYS 22 1HG LYS 22 4.989 4.902 -3.565
159 1HD LYS 22 2HD LYS 22 4.291 4.510 -5.726
160 2HD LYS 22 1HD LYS 22 3.946 6.212 -6.035
161 1HE LYS 22 2HE LYS 22 6.084 6.678 -6.623
162 2HE LYS 22 1HE LYS 22 6.764 5.522 -5.478
163 1HZ LYS 22 1HZ LYS 22 5.797 5.073 -8.216
164 2HZ LYS 22 2HZ LYS 22 5.737 3.800 -7.105
165 3HZ LYS 22 3HZ LYS 22 7.218 4.529 -7.478
166 H THR 23 H THR 23 1.817 4.688 -1.223
167 HA THR 23 HA THR 23 3.647 2.528 -0.939
168 HB THR 23 HB THR 23 1.425 2.749 0.999
169 HG1 THR 23 1HG THR 23 2.002 4.721 1.738
170 1HG2 THR 23 1HG2 THR 23 3.233 2.776 2.632
171 2HG2 THR 23 2HG2 THR 23 4.413 2.812 1.321
172 3HG2 THR 23 3HG2 THR 23 3.370 1.405 1.530
173 H TYR 24 H TYR 24 0.160 2.763 -1.401
174 HA TYR 24 HA TYR 24 -0.448 0.034 -1.108
175 1HB TYR 24 2HB TYR 24 -2.167 1.784 -1.150
176 2HB TYR 24 1HB TYR 24 -1.802 2.113 -2.837
177 HD1 TYR 24 1HD TYR 24 -3.577 1.437 -4.154
178 HD2 TYR 24 2HD TYR 24 -2.346 -1.061 -0.938
179 HE1 TYR 24 1HE TYR 24 -5.227 -0.252 -4.842
180 HE2 TYR 24 2HE TYR 24 -3.991 -2.758 -1.617
181 HH TYR 24 HH TYR 24 -5.194 -3.240 -4.164
182 H LEU 25 H LEU 25 0.850 1.910 -3.731
183 HA LEU 25 HA LEU 25 0.528 -0.127 -5.729
184 1HB LEU 25 2HB LEU 25 1.878 2.524 -5.559
185 2HB LEU 25 1HB LEU 25 2.421 1.412 -6.802
186 HG LEU 25 HG LEU 25 -0.447 2.289 -6.478
187 1HD1 LEU 25 1HD1 LEU 25 0.852 4.229 -7.030
188 2HD1 LEU 25 2HD1 LEU 25 0.000 3.691 -8.477
189 3HD1 LEU 25 3HD1 LEU 25 1.719 3.345 -8.286
190 1HD2 LEU 25 1HD2 LEU 25 -0.329 1.508 -8.979
191 2HD2 LEU 25 2HD2 LEU 25 -0.565 0.339 -7.680
192 3HD2 LEU 25 3HD2 LEU 25 1.033 0.553 -8.395
193 H ALA 26 H ALA 26 3.127 1.031 -3.649
194 HA ALA 26 HA ALA 26 5.155 -0.643 -4.634
195 1HB ALA 26 1HB ALA 26 6.396 -0.050 -2.677
196 2HB ALA 26 2HB ALA 26 4.926 0.435 -1.832
197 3HB ALA 26 3HB ALA 26 5.500 1.373 -3.210
198 H HIS 27 H HIS 27 2.551 -1.170 -2.359
199 HA HIS 27 HA HIS 27 3.629 -3.551 -1.211
200 1HB HIS 27 2HB HIS 27 1.987 -2.389 0.069
201 2HB HIS 27 1HB HIS 27 0.844 -2.384 -1.271
202 HD1 HIS 27 1HD HIS 27 2.392 -4.796 1.224
203 HD2 HIS 27 2HD HIS 27 -0.817 -4.526 -1.398
204 HE1 HIS 27 1HE HIS 27 0.963 -6.841 1.635
205 H LYS 28 H LYS 28 1.399 -2.875 -3.871
206 HA LYS 28 HA LYS 28 0.830 -5.632 -4.384
207 1HB LYS 28 2HB LYS 28 -0.402 -3.335 -5.076
208 2HB LYS 28 1HB LYS 28 0.486 -3.651 -6.560
209 1HG LYS 28 2HG LYS 28 -1.111 -5.846 -5.333
210 2HG LYS 28 1HG LYS 28 -1.937 -4.568 -6.226
211 1HD LYS 28 2HD LYS 28 -0.674 -5.046 -8.206
212 2HD LYS 28 1HD LYS 28 0.361 -6.176 -7.330
213 1HE LYS 28 2HE LYS 28 -1.396 -7.737 -7.075
214 2HE LYS 28 1HE LYS 28 -2.611 -6.561 -7.575
215 1HZ LYS 28 1HZ LYS 28 -1.902 -8.300 -9.261
216 2HZ LYS 28 2HZ LYS 28 -0.457 -7.434 -9.402
217 3HZ LYS 28 3HZ LYS 28 -1.928 -6.692 -9.787
218 H GLN 29 H GLN 29 3.180 -3.309 -5.523
219 HA GLN 29 HA GLN 29 4.118 -5.039 -7.645
220 1HB GLN 29 2HB GLN 29 4.134 -2.348 -7.342
221 2HB GLN 29 1HB GLN 29 5.769 -2.731 -6.824
222 1HG GLN 29 2HG GLN 29 5.073 -4.131 -9.252
223 2HG GLN 29 1HG GLN 29 4.872 -2.388 -9.425
224 1HE2 GLN 29 1HE2 GLN 29 7.184 -4.634 -7.925
225 2HE2 GLN 29 2HE2 GLN 29 8.599 -3.848 -8.529
226 H PHE 30 H PHE 30 4.706 -4.713 -4.311
227 HA PHE 30 HA PHE 30 7.305 -6.073 -4.592
228 1HB PHE 30 2HB PHE 30 7.101 -3.769 -3.389
229 2HB PHE 30 1HB PHE 30 6.437 -4.715 -2.061
230 HD1 PHE 30 1HD PHE 30 9.387 -4.534 -4.321
231 HD2 PHE 30 2HD PHE 30 7.859 -5.685 -0.519
232 HE1 PHE 30 1HE PHE 30 11.668 -5.070 -3.571
233 HE2 PHE 30 2HE PHE 30 10.137 -6.223 0.238
234 HZ PHE 30 HZ PHE 30 12.046 -5.916 -1.288
235 H TYR 31 H TYR 31 4.404 -5.927 -2.524
236 HA TYR 31 HA TYR 31 5.015 -8.393 -1.210
237 1HB TYR 31 2HB TYR 31 3.489 -6.337 -0.491
238 2HB TYR 31 1HB TYR 31 2.235 -7.319 -1.239
239 HD1 TYR 31 1HD TYR 31 4.795 -7.275 1.432
240 HD2 TYR 31 2HD TYR 31 1.356 -9.225 -0.139
241 HE1 TYR 31 1HE TYR 31 4.609 -8.596 3.497
242 HE2 TYR 31 2HE TYR 31 1.159 -10.551 1.922
243 HH TYR 31 HH TYR 31 2.497 -9.823 4.712
244 H HIS 32 H HIS 32 2.710 -7.435 -3.736
245 HA HIS 32 HA HIS 32 2.061 -10.259 -4.173
246 1HB HIS 32 2HB HIS 32 0.736 -7.748 -5.214
247 2HB HIS 32 1HB HIS 32 0.209 -9.387 -5.578
248 HD1 HIS 32 1HD HIS 32 -1.286 -10.527 -3.855
249 HD2 HIS 32 2HD HIS 32 0.377 -6.970 -2.494
250 HE1 HIS 32 1HE HIS 32 -2.437 -9.994 -1.663
251 H LYS 33 H LYS 33 4.596 -9.601 -4.955
252 HA LYS 33 HA LYS 33 4.413 -10.019 -7.828
253 1HB LYS 33 2HB LYS 33 5.503 -7.590 -6.567
254 2HB LYS 33 1HB LYS 33 6.547 -8.322 -7.777
255 1HG LYS 33 2HG LYS 33 4.245 -8.361 -9.128
256 2HG LYS 33 1HG LYS 33 3.941 -6.971 -8.084
257 1HD LYS 33 2HD LYS 33 5.943 -5.883 -8.867
258 2HD LYS 33 1HD LYS 33 6.399 -7.312 -9.799
259 1HE LYS 33 2HE LYS 33 4.017 -5.523 -10.266
260 2HE LYS 33 1HE LYS 33 5.454 -5.660 -11.278
261 1HZ LYS 33 1HZ LYS 33 4.798 -8.090 -11.508
262 2HZ LYS 33 2HZ LYS 33 3.853 -6.958 -12.336
263 3HZ LYS 33 3HZ LYS 33 3.289 -7.634 -10.892
264 H ASN 34 H ASN 34 4.947 -12.115 -6.607
265 HA ASN 34 HA ASN 34 7.866 -12.429 -6.652
266 1HB ASN 34 2HB ASN 34 5.984 -13.135 -4.449
267 2HB ASN 34 1HB ASN 34 7.331 -14.223 -4.766
268 1HD2 ASN 34 1HD2 ASN 34 9.392 -12.693 -5.337
269 2HD2 ASN 34 2HD2 ASN 34 9.760 -11.598 -4.052
270 H LYS 35 H LYS 35 5.870 -12.997 -8.657
271 HA LYS 35 HA LYS 35 5.325 -14.618 -10.153
272 1HB LYS 35 2HB LYS 35 7.896 -15.075 -9.576
273 2HB LYS 35 1HB LYS 35 7.218 -16.577 -8.963
274 1HG LYS 35 2HG LYS 35 6.858 -15.518 -11.758
275 2HG LYS 35 1HG LYS 35 7.994 -16.779 -11.275
276 1HD LYS 35 2HD LYS 35 6.330 -18.188 -11.813
277 2HD LYS 35 1HD LYS 35 5.657 -17.729 -10.249
278 1HE LYS 35 2HE LYS 35 4.443 -15.875 -11.430
279 2HE LYS 35 1HE LYS 35 4.977 -16.586 -12.953
280 1HZ LYS 35 1HZ LYS 35 3.539 -18.228 -10.973
281 2HZ LYS 35 2HZ LYS 35 3.660 -18.439 -12.646
282 3HZ LYS 35 3HZ LYS 35 2.679 -17.212 -12.019
283 HA PRO 36 HA PRO 36 2.746 -16.768 -6.941
284 1HB PRO 36 2HB PRO 36 0.355 -16.112 -8.039
285 2HB PRO 36 1HB PRO 36 1.216 -15.052 -6.916
286 1HG PRO 36 2HG PRO 36 1.095 -14.947 -9.906
287 2HG PRO 36 1HG PRO 36 0.984 -13.620 -8.735
288 1HD PRO 36 2HD PRO 36 3.263 -14.189 -10.086
289 2HD PRO 36 1HD PRO 36 3.268 -13.520 -8.441
Start of MODEL 19
1 1H GLY 1 1HT GLY 1 -20.421 5.905 -15.263
2 2H GLY 1 2HT GLY 1 -20.352 4.876 -16.603
3 3H GLY 1 3HT GLY 1 -18.942 5.236 -15.741
4 1HA GLY 1 1HA GLY 1 -21.197 3.969 -14.346
5 2HA GLY 1 2HA GLY 1 -20.152 2.984 -15.359
6 H SER 2 H SER 2 -17.882 2.889 -14.840
7 HA SER 2 HA SER 2 -16.150 2.574 -13.401
8 1HB SER 2 2HB SER 2 -16.115 5.005 -13.256
9 2HB SER 2 1HB SER 2 -17.378 4.976 -12.025
10 HG SER 2 HG SER 2 -15.943 4.462 -10.564
11 H ALA 3 H ALA 3 -15.580 1.895 -11.184
12 HA ALA 3 HA ALA 3 -17.835 0.476 -9.976
13 1HB ALA 3 1HB ALA 3 -15.461 -0.497 -10.686
14 2HB ALA 3 2HB ALA 3 -16.380 -1.143 -9.327
15 3HB ALA 3 3HB ALA 3 -15.065 -0.003 -9.040
16 H ALA 4 H ALA 4 -17.743 3.228 -9.481
17 HA ALA 4 HA ALA 4 -17.977 4.706 -7.767
18 1HB ALA 4 1HB ALA 4 -19.251 3.470 -6.376
19 2HB ALA 4 2HB ALA 4 -17.791 3.456 -5.388
20 3HB ALA 4 3HB ALA 4 -18.161 2.085 -6.433
21 H GLU 5 H GLU 5 -15.825 2.449 -6.081
22 HA GLU 5 HA GLU 5 -13.351 3.442 -6.587
23 1HB GLU 5 2HB GLU 5 -14.916 5.353 -5.012
24 2HB GLU 5 1HB GLU 5 -13.390 4.922 -4.252
25 1HG GLU 5 2HG GLU 5 -12.156 5.978 -5.808
26 2HG GLU 5 1HG GLU 5 -13.256 5.565 -7.121
27 H VAL 6 H VAL 6 -13.758 1.047 -6.040
28 HA VAL 6 HA VAL 6 -13.543 0.494 -3.182
29 HB VAL 6 HB VAL 6 -15.098 -0.856 -4.553
30 1HG1 VAL 6 1HG1 VAL 6 -14.305 -2.450 -6.159
31 2HG1 VAL 6 2HG1 VAL 6 -12.628 -2.013 -5.832
32 3HG1 VAL 6 3HG1 VAL 6 -13.703 -0.854 -6.612
33 1HG2 VAL 6 1HG2 VAL 6 -13.063 -2.834 -3.734
34 2HG2 VAL 6 2HG2 VAL 6 -14.765 -2.706 -3.292
35 3HG2 VAL 6 3HG2 VAL 6 -13.570 -1.672 -2.509
36 H MET 7 H MET 7 -11.339 1.827 -4.305
37 HA MET 7 HA MET 7 -9.214 0.233 -3.402
38 1HB MET 7 2HB MET 7 -8.000 -0.010 -5.594
39 2HB MET 7 1HB MET 7 -9.403 -1.053 -5.401
40 1HG MET 7 2HG MET 7 -9.923 1.537 -6.687
41 2HG MET 7 1HG MET 7 -8.895 0.427 -7.593
42 1HE MET 7 1HE MET 7 -10.821 -2.113 -8.999
43 2HE MET 7 2HE MET 7 -10.500 -2.710 -7.369
44 3HE MET 7 3HE MET 7 -9.303 -1.713 -8.195
45 H LYS 8 H LYS 8 -7.849 1.673 -2.600
46 HA LYS 8 HA LYS 8 -7.045 3.980 -4.163
47 1HB LYS 8 2HB LYS 8 -9.021 4.819 -2.996
48 2HB LYS 8 1HB LYS 8 -8.360 4.285 -1.457
49 1HG LYS 8 2HG LYS 8 -6.510 5.869 -1.704
50 2HG LYS 8 1HG LYS 8 -7.186 6.409 -3.242
51 1HD LYS 8 2HD LYS 8 -9.037 6.452 -0.949
52 2HD LYS 8 1HD LYS 8 -7.694 7.592 -0.865
53 1HE LYS 8 2HE LYS 8 -9.733 8.528 -1.930
54 2HE LYS 8 1HE LYS 8 -8.309 8.563 -2.970
55 1HZ LYS 8 1HZ LYS 8 -9.112 6.728 -4.201
56 2HZ LYS 8 2HZ LYS 8 -10.410 7.803 -4.057
57 3HZ LYS 8 3HZ LYS 8 -10.351 6.417 -3.090
58 H LYS 9 H LYS 9 -6.853 2.356 -1.008
59 HA LYS 9 HA LYS 9 -4.041 2.056 -1.156
60 1HB LYS 9 2HB LYS 9 -3.605 3.525 0.901
61 2HB LYS 9 1HB LYS 9 -3.772 4.326 -0.653
62 1HG LYS 9 2HG LYS 9 -4.963 5.572 1.015
63 2HG LYS 9 1HG LYS 9 -6.123 4.837 -0.092
64 1HD LYS 9 2HD LYS 9 -6.683 3.147 1.487
65 2HD LYS 9 1HD LYS 9 -5.343 3.602 2.541
66 1HE LYS 9 2HE LYS 9 -7.273 5.741 1.918
67 2HE LYS 9 1HE LYS 9 -7.890 4.415 2.903
68 1HZ LYS 9 1HZ LYS 9 -6.693 6.487 3.963
69 2HZ LYS 9 2HZ LYS 9 -5.308 5.570 3.643
70 3HZ LYS 9 3HZ LYS 9 -6.530 4.939 4.626
71 H TYR 10 H TYR 10 -6.095 0.293 -0.691
72 HA TYR 10 HA TYR 10 -5.373 -0.696 1.952
73 1HB TYR 10 2HB TYR 10 -7.507 0.675 2.152
74 2HB TYR 10 1HB TYR 10 -8.280 -0.544 1.145
75 HD1 TYR 10 1HD TYR 10 -7.716 0.454 4.433
76 HD2 TYR 10 2HD TYR 10 -7.879 -3.045 2.019
77 HE1 TYR 10 1HE TYR 10 -8.165 -0.901 6.437
78 HE2 TYR 10 2HE TYR 10 -8.331 -4.409 4.015
79 HH TYR 10 HH TYR 10 -9.144 -3.032 7.037
80 H CYS 11 H CYS 11 -4.936 -2.812 1.837
81 HA CYS 11 HA CYS 11 -5.549 -4.218 -0.620
82 1HB CYS 11 2HB CYS 11 -3.314 -4.354 0.590
83 2HB CYS 11 1HB CYS 11 -4.124 -5.369 1.776
84 H SER 12 H SER 12 -7.195 -5.516 -0.925
85 HA SER 12 HA SER 12 -8.968 -6.173 1.271
86 1HB SER 12 2HB SER 12 -10.188 -7.313 -0.815
87 2HB SER 12 1HB SER 12 -10.294 -5.581 -0.501
88 HG SER 12 HG SER 12 -9.231 -5.225 -2.273
89 H THR 13 H THR 13 -6.256 -7.491 0.815
90 HA THR 13 HA THR 13 -7.224 -10.238 1.061
91 HB THR 13 HB THR 13 -4.769 -9.395 -0.484
92 HG1 THR 13 1HG THR 13 -6.668 -8.992 -1.640
93 1HG2 THR 13 1HG2 THR 13 -5.255 -11.931 -1.246
94 2HG2 THR 13 2HG2 THR 13 -5.715 -12.007 0.455
95 3HG2 THR 13 3HG2 THR 13 -4.096 -11.473 0.002
96 H CYS 14 H CYS 14 -4.758 -7.840 1.790
97 HA CYS 14 HA CYS 14 -3.637 -9.627 3.835
98 1HB CYS 14 2HB CYS 14 -2.568 -6.990 2.814
99 2HB CYS 14 1HB CYS 14 -1.755 -8.074 3.934
100 H ASP 15 H ASP 15 -6.021 -7.392 3.643
101 HA ASP 15 HA ASP 15 -7.106 -6.041 5.106
102 1HB ASP 15 2HB ASP 15 -5.721 -7.864 7.080
103 2HB ASP 15 1HB ASP 15 -7.039 -6.768 7.477
104 H ILE 16 H ILE 16 -4.745 -4.964 4.132
105 HA ILE 16 HA ILE 16 -3.716 -3.480 6.464
106 HB ILE 16 HB ILE 16 -2.225 -3.724 3.867
107 1HG1 ILE 16 2HG1 ILE 16 -2.648 -6.006 4.718
108 2HG1 ILE 16 1HG1 ILE 16 -0.946 -5.574 4.810
109 1HG2 ILE 16 1HG2 ILE 16 -1.538 -2.919 6.673
110 2HG2 ILE 16 2HG2 ILE 16 -1.364 -1.992 5.183
111 3HG2 ILE 16 3HG2 ILE 16 -0.296 -3.360 5.502
112 1HD1 ILE 16 1HD1 ILE 16 -2.877 -5.469 7.113
113 2HD1 ILE 16 2HD1 ILE 16 -1.140 -5.165 7.177
114 3HD1 ILE 16 3HD1 ILE 16 -1.741 -6.779 6.794
115 H SER 17 H SER 17 -3.042 -1.240 5.985
116 HA SER 17 HA SER 17 -4.565 -0.041 3.775
117 1HB SER 17 2HB SER 17 -4.768 1.913 5.630
118 2HB SER 17 1HB SER 17 -5.993 0.666 5.407
119 HG SER 17 HG SER 17 -3.827 0.481 7.231
120 H PHE 18 H PHE 18 -3.829 2.146 3.205
121 HA PHE 18 HA PHE 18 -1.082 2.743 4.000
122 1HB PHE 18 2HB PHE 18 -2.087 2.449 1.165
123 2HB PHE 18 1HB PHE 18 -0.549 3.185 1.587
124 HD1 PHE 18 1HD PHE 18 1.030 1.703 3.064
125 HD2 PHE 18 2HD PHE 18 -2.175 0.204 0.700
126 HE1 PHE 18 1HE PHE 18 2.079 -0.523 3.060
127 HE2 PHE 18 2HE PHE 18 -1.133 -2.024 0.691
128 HZ PHE 18 HZ PHE 18 0.996 -2.391 1.873
129 H ASN 19 H ASN 19 -0.659 4.874 4.194
130 HA ASN 19 HA ASN 19 -2.892 6.708 3.834
131 1HB ASN 19 2HB ASN 19 -0.377 6.709 5.420
132 2HB ASN 19 1HB ASN 19 -1.005 8.275 4.917
133 1HD2 ASN 19 1HD2 ASN 19 -2.664 5.300 5.877
134 2HD2 ASN 19 2HD2 ASN 19 -3.533 6.004 7.193
135 H TYR 20 H TYR 20 -0.856 5.600 1.708
136 HA TYR 20 HA TYR 20 -0.818 8.040 0.170
137 1HB TYR 20 2HB TYR 20 1.692 6.731 1.171
138 2HB TYR 20 1HB TYR 20 1.688 7.593 -0.364
139 HD1 TYR 20 1HD TYR 20 0.512 10.014 -0.184
140 HD2 TYR 20 2HD TYR 20 2.366 7.919 3.022
141 HE1 TYR 20 1HE TYR 20 0.844 12.141 1.005
142 HE2 TYR 20 2HE TYR 20 2.702 10.041 4.221
143 HH TYR 20 HH TYR 20 2.844 12.406 3.772
144 H VAL 21 H VAL 21 -1.373 7.538 -1.842
145 HA VAL 21 HA VAL 21 -1.943 5.011 -2.762
146 HB VAL 21 HB VAL 21 -1.031 7.269 -4.545
147 1HG1 VAL 21 1HG1 VAL 21 -1.285 5.306 -5.824
148 2HG1 VAL 21 2HG1 VAL 21 -2.775 6.221 -6.063
149 3HG1 VAL 21 3HG1 VAL 21 -2.754 4.841 -4.965
150 1HG2 VAL 21 1HG2 VAL 21 -3.161 7.278 -2.690
151 2HG2 VAL 21 2HG2 VAL 21 -3.873 7.122 -4.295
152 3HG2 VAL 21 3HG2 VAL 21 -2.795 8.472 -3.936
153 H LYS 22 H LYS 22 1.120 6.676 -2.747
154 HA LYS 22 HA LYS 22 2.484 5.039 -4.602
155 1HB LYS 22 2HB LYS 22 3.110 7.329 -3.334
156 2HB LYS 22 1HB LYS 22 4.010 6.194 -2.337
157 1HG LYS 22 2HG LYS 22 4.270 6.520 -5.319
158 2HG LYS 22 1HG LYS 22 5.403 7.111 -4.102
159 1HD LYS 22 2HD LYS 22 5.564 4.666 -3.345
160 2HD LYS 22 1HD LYS 22 4.794 4.276 -4.883
161 1HE LYS 22 2HE LYS 22 6.744 5.951 -5.717
162 2HE LYS 22 1HE LYS 22 7.525 5.222 -4.313
163 1HZ LYS 22 1HZ LYS 22 6.800 3.022 -5.324
164 2HZ LYS 22 2HZ LYS 22 8.071 3.837 -6.087
165 3HZ LYS 22 3HZ LYS 22 6.516 3.888 -6.749
166 H THR 23 H THR 23 1.838 4.748 -1.167
167 HA THR 23 HA THR 23 3.641 2.578 -0.746
168 HB THR 23 HB THR 23 1.310 2.857 1.055
169 HG1 THR 23 1HG THR 23 3.230 4.920 0.752
170 1HG2 THR 23 1HG2 THR 23 4.280 2.808 1.515
171 2HG2 THR 23 2HG2 THR 23 3.147 1.479 1.755
172 3HG2 THR 23 3HG2 THR 23 3.060 2.908 2.783
173 H TYR 24 H TYR 24 0.213 2.855 -1.496
174 HA TYR 24 HA TYR 24 -0.415 0.116 -1.176
175 1HB TYR 24 2HB TYR 24 -2.094 1.966 -1.316
176 2HB TYR 24 1HB TYR 24 -1.739 2.104 -3.034
177 HD1 TYR 24 1HD TYR 24 -3.698 1.435 -4.104
178 HD2 TYR 24 2HD TYR 24 -2.143 -0.955 -0.946
179 HE1 TYR 24 1HE TYR 24 -5.377 -0.293 -4.593
180 HE2 TYR 24 2HE TYR 24 -3.818 -2.690 -1.427
181 HH TYR 24 HH TYR 24 -5.398 -3.026 -4.119
182 H LEU 25 H LEU 25 1.023 1.983 -3.723
183 HA LEU 25 HA LEU 25 0.772 -0.042 -5.747
184 1HB LEU 25 2HB LEU 25 2.284 2.541 -5.504
185 2HB LEU 25 1HB LEU 25 2.625 1.439 -6.824
186 HG LEU 25 HG LEU 25 0.828 3.454 -6.952
187 1HD1 LEU 25 1HD1 LEU 25 -0.243 1.925 -8.798
188 2HD1 LEU 25 2HD1 LEU 25 1.118 0.876 -8.404
189 3HD1 LEU 25 3HD1 LEU 25 1.408 2.525 -8.956
190 1HD2 LEU 25 1HD2 LEU 25 -0.616 2.323 -5.260
191 2HD2 LEU 25 2HD2 LEU 25 -0.845 1.007 -6.411
192 3HD2 LEU 25 3HD2 LEU 25 -1.411 2.631 -6.803
193 H ALA 26 H ALA 26 3.277 1.085 -3.538
194 HA ALA 26 HA ALA 26 5.343 -0.584 -4.426
195 1HB ALA 26 1HB ALA 26 4.858 0.625 -1.709
196 2HB ALA 26 2HB ALA 26 5.811 1.316 -3.022
197 3HB ALA 26 3HB ALA 26 6.361 -0.151 -2.211
198 H HIS 27 H HIS 27 2.637 -1.129 -2.262
199 HA HIS 27 HA HIS 27 3.638 -3.558 -1.151
200 1HB HIS 27 2HB HIS 27 1.965 -2.384 0.091
201 2HB HIS 27 1HB HIS 27 0.861 -2.375 -1.280
202 HD1 HIS 27 1HD HIS 27 2.402 -4.844 1.174
203 HD2 HIS 27 2HD HIS 27 -0.834 -4.479 -1.405
204 HE1 HIS 27 1HE HIS 27 0.957 -6.886 1.548
205 H LYS 28 H LYS 28 1.389 -2.810 -3.792
206 HA LYS 28 HA LYS 28 0.842 -5.533 -4.415
207 1HB LYS 28 2HB LYS 28 -0.446 -3.323 -5.038
208 2HB LYS 28 1HB LYS 28 0.595 -3.359 -6.455
209 1HG LYS 28 2HG LYS 28 -0.279 -5.872 -6.537
210 2HG LYS 28 1HG LYS 28 -1.645 -5.135 -5.695
211 1HD LYS 28 2HD LYS 28 -2.278 -3.922 -7.506
212 2HD LYS 28 1HD LYS 28 -0.621 -3.699 -8.070
213 1HE LYS 28 2HE LYS 28 -0.777 -6.282 -8.526
214 2HE LYS 28 1HE LYS 28 -2.509 -5.955 -8.549
215 1HZ LYS 28 1HZ LYS 28 -2.340 -4.688 -10.424
216 2HZ LYS 28 2HZ LYS 28 -1.094 -5.794 -10.717
217 3HZ LYS 28 3HZ LYS 28 -0.731 -4.246 -10.138
218 H GLN 29 H GLN 29 3.345 -3.296 -5.306
219 HA GLN 29 HA GLN 29 4.254 -4.891 -7.542
220 1HB GLN 29 2HB GLN 29 4.440 -2.256 -7.018
221 2HB GLN 29 1HB GLN 29 6.007 -2.785 -6.420
222 1HG GLN 29 2HG GLN 29 4.920 -3.244 -9.190
223 2HG GLN 29 1HG GLN 29 6.144 -2.060 -8.732
224 1HE2 GLN 29 1HE2 GLN 29 7.920 -3.246 -7.286
225 2HE2 GLN 29 2HE2 GLN 29 8.604 -4.636 -8.051
226 H PHE 30 H PHE 30 4.816 -4.809 -4.151
227 HA PHE 30 HA PHE 30 7.251 -6.430 -4.510
228 1HB PHE 30 2HB PHE 30 6.478 -4.403 -2.474
229 2HB PHE 30 1HB PHE 30 7.452 -5.767 -1.939
230 HD1 PHE 30 1HD PHE 30 7.451 -3.667 -5.025
231 HD2 PHE 30 2HD PHE 30 9.641 -5.140 -1.687
232 HE1 PHE 30 1HE PHE 30 9.474 -2.543 -5.860
233 HE2 PHE 30 2HE PHE 30 11.668 -4.018 -2.516
234 HZ PHE 30 HZ PHE 30 11.585 -2.717 -4.605
235 H TYR 31 H TYR 31 4.343 -6.086 -2.484
236 HA TYR 31 HA TYR 31 4.708 -8.629 -1.225
237 1HB TYR 31 2HB TYR 31 3.291 -6.435 -0.560
238 2HB TYR 31 1HB TYR 31 2.007 -7.409 -1.269
239 HD1 TYR 31 1HD TYR 31 4.445 -7.177 1.468
240 HD2 TYR 31 2HD TYR 31 1.229 -9.420 -0.184
241 HE1 TYR 31 1HE TYR 31 4.241 -8.426 3.576
242 HE2 TYR 31 2HE TYR 31 1.015 -10.674 1.920
243 HH TYR 31 HH TYR 31 3.373 -10.559 4.377
244 H HIS 32 H HIS 32 2.749 -7.430 -3.907
245 HA HIS 32 HA HIS 32 1.901 -10.199 -4.443
246 1HB HIS 32 2HB HIS 32 0.610 -7.603 -5.310
247 2HB HIS 32 1HB HIS 32 0.035 -9.213 -5.728
248 HD1 HIS 32 1HD HIS 32 -1.394 -10.426 -3.982
249 HD2 HIS 32 2HD HIS 32 0.295 -6.896 -2.581
250 HE1 HIS 32 1HE HIS 32 -2.490 -9.946 -1.750
251 H LYS 33 H LYS 33 4.403 -9.709 -5.231
252 HA LYS 33 HA LYS 33 4.235 -10.005 -8.077
253 1HB LYS 33 2HB LYS 33 5.068 -7.442 -6.894
254 2HB LYS 33 1HB LYS 33 6.181 -8.084 -8.093
255 1HG LYS 33 2HG LYS 33 3.366 -8.170 -8.891
256 2HG LYS 33 1HG LYS 33 4.014 -6.548 -8.644
257 1HD LYS 33 2HD LYS 33 4.388 -7.075 -10.922
258 2HD LYS 33 1HD LYS 33 5.950 -7.233 -10.116
259 1HE LYS 33 2HE LYS 33 4.314 -9.678 -10.205
260 2HE LYS 33 1HE LYS 33 4.887 -9.097 -11.767
261 1HZ LYS 33 1HZ LYS 33 6.384 -10.215 -9.543
262 2HZ LYS 33 2HZ LYS 33 7.114 -8.910 -10.333
263 3HZ LYS 33 3HZ LYS 33 6.691 -10.295 -11.205
264 H ASN 34 H ASN 34 5.043 -11.748 -6.111
265 HA ASN 34 HA ASN 34 7.625 -12.489 -7.037
266 1HB ASN 34 2HB ASN 34 7.400 -11.061 -4.439
267 2HB ASN 34 1HB ASN 34 8.459 -12.467 -4.490
268 1HD2 ASN 34 1HD2 ASN 34 9.863 -12.468 -6.572
269 2HD2 ASN 34 2HD2 ASN 34 10.675 -10.978 -6.897
270 H LYS 35 H LYS 35 4.991 -13.622 -6.795
271 HA LYS 35 HA LYS 35 5.667 -15.986 -5.182
272 1HB LYS 35 2HB LYS 35 3.988 -14.664 -3.971
273 2HB LYS 35 1HB LYS 35 2.937 -14.702 -5.380
274 1HG LYS 35 2HG LYS 35 2.018 -16.391 -4.173
275 2HG LYS 35 1HG LYS 35 3.219 -17.309 -5.085
276 1HD LYS 35 2HD LYS 35 3.436 -18.031 -2.851
277 2HD LYS 35 1HD LYS 35 4.784 -16.924 -3.122
278 1HE LYS 35 2HE LYS 35 3.149 -15.131 -2.188
279 2HE LYS 35 1HE LYS 35 2.288 -16.518 -1.524
280 1HZ LYS 35 1HZ LYS 35 3.924 -16.941 -0.046
281 2HZ LYS 35 2HZ LYS 35 4.235 -15.290 -0.233
282 3HZ LYS 35 3HZ LYS 35 5.165 -16.424 -1.074
283 HA PRO 36 HA PRO 36 4.792 -17.313 -9.500
284 1HB PRO 36 2HB PRO 36 6.539 -19.389 -9.466
285 2HB PRO 36 1HB PRO 36 7.028 -17.729 -9.829
286 1HG PRO 36 2HG PRO 36 7.252 -19.251 -7.260
287 2HG PRO 36 1HG PRO 36 8.440 -18.188 -8.038
288 1HD PRO 36 2HD PRO 36 6.887 -17.373 -5.977
289 2HD PRO 36 1HD PRO 36 7.418 -16.272 -7.264
Start of MODEL 20
1 1H GLY 1 1HT GLY 1 -22.859 10.173 -9.873
2 2H GLY 1 2HT GLY 1 -24.348 10.972 -9.831
3 3H GLY 1 3HT GLY 1 -24.099 9.598 -8.877
4 1HA GLY 1 1HA GLY 1 -23.330 12.350 -8.407
5 2HA GLY 1 2HA GLY 1 -23.711 11.080 -7.253
6 H SER 2 H SER 2 -21.584 12.876 -6.928
7 HA SER 2 HA SER 2 -19.183 11.340 -7.582
8 1HB SER 2 2HB SER 2 -19.290 13.833 -7.980
9 2HB SER 2 1HB SER 2 -19.334 14.040 -6.228
10 HG SER 2 HG SER 2 -17.291 12.634 -7.603
11 H ALA 3 H ALA 3 -19.565 9.610 -6.117
12 HA ALA 3 HA ALA 3 -18.414 10.038 -3.537
13 1HB ALA 3 1HB ALA 3 -21.348 9.363 -3.686
14 2HB ALA 3 2HB ALA 3 -20.616 10.789 -2.952
15 3HB ALA 3 3HB ALA 3 -20.360 9.198 -2.235
16 H ALA 4 H ALA 4 -17.856 8.430 -5.825
17 HA ALA 4 HA ALA 4 -18.146 5.744 -4.646
18 1HB ALA 4 1HB ALA 4 -19.391 5.373 -6.499
19 2HB ALA 4 2HB ALA 4 -17.805 5.127 -7.229
20 3HB ALA 4 3HB ALA 4 -18.627 6.677 -7.409
21 H GLU 5 H GLU 5 -16.216 5.334 -3.765
22 HA GLU 5 HA GLU 5 -13.989 4.586 -5.122
23 1HB GLU 5 2HB GLU 5 -14.156 7.507 -4.967
24 2HB GLU 5 1HB GLU 5 -12.649 6.869 -4.326
25 1HG GLU 5 2HG GLU 5 -13.457 5.704 -6.884
26 2HG GLU 5 1HG GLU 5 -13.127 7.435 -6.938
27 H VAL 6 H VAL 6 -14.811 3.378 -3.104
28 HA VAL 6 HA VAL 6 -13.614 4.381 -0.635
29 HB VAL 6 HB VAL 6 -15.917 3.474 -0.573
30 1HG1 VAL 6 1HG1 VAL 6 -14.628 0.809 -1.139
31 2HG1 VAL 6 2HG1 VAL 6 -15.593 1.728 -2.293
32 3HG1 VAL 6 3HG1 VAL 6 -16.335 1.113 -0.817
33 1HG2 VAL 6 1HG2 VAL 6 -14.292 1.573 1.039
34 2HG2 VAL 6 2HG2 VAL 6 -15.674 2.561 1.512
35 3HG2 VAL 6 3HG2 VAL 6 -14.086 3.303 1.312
36 H MET 7 H MET 7 -11.811 3.628 -2.680
37 HA MET 7 HA MET 7 -10.157 1.814 -1.229
38 1HB MET 7 2HB MET 7 -9.985 0.059 -2.911
39 2HB MET 7 1HB MET 7 -11.639 0.191 -2.329
40 1HG MET 7 2HG MET 7 -12.258 1.435 -4.325
41 2HG MET 7 1HG MET 7 -10.595 1.345 -4.906
42 1HE MET 7 1HE MET 7 -12.789 -0.892 -7.237
43 2HE MET 7 2HE MET 7 -12.658 0.778 -6.687
44 3HE MET 7 3HE MET 7 -13.883 -0.285 -5.994
45 H LYS 8 H LYS 8 -8.054 2.156 -1.693
46 HA LYS 8 HA LYS 8 -7.016 2.907 -4.186
47 1HB LYS 8 2HB LYS 8 -6.625 5.226 -4.003
48 2HB LYS 8 1HB LYS 8 -8.310 5.009 -3.556
49 1HG LYS 8 2HG LYS 8 -6.100 5.213 -1.528
50 2HG LYS 8 1HG LYS 8 -6.975 6.613 -2.146
51 1HD LYS 8 2HD LYS 8 -8.296 4.240 -0.836
52 2HD LYS 8 1HD LYS 8 -7.850 5.719 0.017
53 1HE LYS 8 2HE LYS 8 -9.232 6.910 -1.813
54 2HE LYS 8 1HE LYS 8 -9.920 5.314 -2.113
55 1HZ LYS 8 1HZ LYS 8 -11.150 6.791 -0.501
56 2HZ LYS 8 2HZ LYS 8 -9.879 6.533 0.585
57 3HZ LYS 8 3HZ LYS 8 -10.805 5.226 0.042
58 H LYS 9 H LYS 9 -6.683 3.105 -0.686
59 HA LYS 9 HA LYS 9 -3.895 2.237 -0.974
60 1HB LYS 9 2HB LYS 9 -3.379 3.680 1.052
61 2HB LYS 9 1HB LYS 9 -3.645 4.532 -0.459
62 1HG LYS 9 2HG LYS 9 -6.077 4.771 0.365
63 2HG LYS 9 1HG LYS 9 -5.410 4.365 1.947
64 1HD LYS 9 2HD LYS 9 -5.453 6.747 1.769
65 2HD LYS 9 1HD LYS 9 -3.770 6.233 1.641
66 1HE LYS 9 2HE LYS 9 -3.727 7.560 -0.166
67 2HE LYS 9 1HE LYS 9 -4.534 6.213 -0.966
68 1HZ LYS 9 1HZ LYS 9 -6.673 7.310 -0.209
69 2HZ LYS 9 2HZ LYS 9 -5.823 8.081 -1.452
70 3HZ LYS 9 3HZ LYS 9 -5.740 8.681 0.127
71 H TYR 10 H TYR 10 -5.780 0.413 -0.609
72 HA TYR 10 HA TYR 10 -5.181 -0.631 2.021
73 1HB TYR 10 2HB TYR 10 -7.286 0.782 2.264
74 2HB TYR 10 1HB TYR 10 -8.082 -0.385 1.213
75 HD1 TYR 10 1HD TYR 10 -7.527 0.491 4.533
76 HD2 TYR 10 2HD TYR 10 -7.718 -2.926 2.006
77 HE1 TYR 10 1HE TYR 10 -8.015 -0.919 6.487
78 HE2 TYR 10 2HE TYR 10 -8.208 -4.346 3.953
79 HH TYR 10 HH TYR 10 -7.861 -3.242 7.167
80 H CYS 11 H CYS 11 -4.813 -2.756 1.847
81 HA CYS 11 HA CYS 11 -5.422 -4.057 -0.667
82 1HB CYS 11 2HB CYS 11 -3.214 -4.293 0.581
83 2HB CYS 11 1HB CYS 11 -4.075 -5.333 1.709
84 H SER 12 H SER 12 -7.081 -5.321 -1.049
85 HA SER 12 HA SER 12 -8.927 -5.982 1.085
86 1HB SER 12 2HB SER 12 -10.091 -7.063 -1.081
87 2HB SER 12 1HB SER 12 -10.212 -5.347 -0.691
88 HG SER 12 HG SER 12 -8.991 -4.882 -2.351
89 H THR 13 H THR 13 -6.231 -7.360 0.652
90 HA THR 13 HA THR 13 -7.276 -10.084 0.841
91 HB THR 13 HB THR 13 -4.780 -9.282 -0.660
92 HG1 THR 13 1HG THR 13 -7.344 -10.100 -1.517
93 1HG2 THR 13 1HG2 THR 13 -5.022 -11.627 0.541
94 2HG2 THR 13 2HG2 THR 13 -4.289 -11.456 -1.054
95 3HG2 THR 13 3HG2 THR 13 -5.966 -11.982 -0.906
96 H CYS 14 H CYS 14 -4.757 -7.768 1.638
97 HA CYS 14 HA CYS 14 -3.678 -9.613 3.646
98 1HB CYS 14 2HB CYS 14 -2.620 -6.942 2.706
99 2HB CYS 14 1HB CYS 14 -1.821 -8.018 3.846
100 H ASP 15 H ASP 15 -6.007 -7.261 3.462
101 HA ASP 15 HA ASP 15 -7.132 -6.005 4.984
102 1HB ASP 15 2HB ASP 15 -6.419 -8.414 6.255
103 2HB ASP 15 1HB ASP 15 -6.109 -7.142 7.429
104 H ILE 16 H ILE 16 -4.683 -5.001 4.082
105 HA ILE 16 HA ILE 16 -3.681 -3.572 6.457
106 HB ILE 16 HB ILE 16 -2.178 -3.784 3.862
107 1HG1 ILE 16 2HG1 ILE 16 -2.622 -6.072 4.674
108 2HG1 ILE 16 1HG1 ILE 16 -0.916 -5.656 4.798
109 1HG2 ILE 16 1HG2 ILE 16 -1.250 -2.098 5.154
110 2HG2 ILE 16 2HG2 ILE 16 -0.262 -3.498 5.570
111 3HG2 ILE 16 3HG2 ILE 16 -1.535 -2.961 6.665
112 1HD1 ILE 16 1HD1 ILE 16 -2.866 -5.533 7.083
113 2HD1 ILE 16 2HD1 ILE 16 -1.119 -5.305 7.160
114 3HD1 ILE 16 3HD1 ILE 16 -1.786 -6.886 6.751
115 H SER 17 H SER 17 -2.966 -1.330 6.042
116 HA SER 17 HA SER 17 -4.504 -0.052 3.884
117 1HB SER 17 2HB SER 17 -4.605 1.876 5.758
118 2HB SER 17 1HB SER 17 -5.853 0.641 5.595
119 HG SER 17 HG SER 17 -4.941 -0.489 7.270
120 H PHE 18 H PHE 18 -3.753 2.181 3.413
121 HA PHE 18 HA PHE 18 -0.971 2.695 4.096
122 1HB PHE 18 2HB PHE 18 -2.058 2.421 1.290
123 2HB PHE 18 1HB PHE 18 -0.512 3.165 1.664
124 HD1 PHE 18 1HD PHE 18 1.297 1.781 2.684
125 HD2 PHE 18 2HD PHE 18 -2.323 0.087 1.225
126 HE1 PHE 18 1HE PHE 18 2.357 -0.439 2.643
127 HE2 PHE 18 2HE PHE 18 -1.271 -2.136 1.182
128 HZ PHE 18 HZ PHE 18 1.070 -2.402 1.891
129 H ASN 19 H ASN 19 -0.444 4.849 4.114
130 HA ASN 19 HA ASN 19 -2.652 6.690 4.191
131 1HB ASN 19 2HB ASN 19 -0.868 8.309 4.895
132 2HB ASN 19 1HB ASN 19 -1.009 6.887 5.918
133 1HD2 ASN 19 1HD2 ASN 19 1.066 8.826 4.162
134 2HD2 ASN 19 2HD2 ASN 19 2.450 7.791 4.154
135 H TYR 20 H TYR 20 -0.272 5.759 1.905
136 HA TYR 20 HA TYR 20 -1.101 7.975 0.166
137 1HB TYR 20 2HB TYR 20 1.650 7.173 0.944
138 2HB TYR 20 1HB TYR 20 1.395 7.619 -0.739
139 HD1 TYR 20 1HD TYR 20 -0.369 9.827 -0.753
140 HD2 TYR 20 2HD TYR 20 2.623 8.893 2.125
141 HE1 TYR 20 1HE TYR 20 -0.217 12.205 -0.148
142 HE2 TYR 20 2HE TYR 20 2.782 11.268 2.739
143 HH TYR 20 HH TYR 20 1.784 13.701 0.954
144 H VAL 21 H VAL 21 -1.671 7.401 -1.844
145 HA VAL 21 HA VAL 21 -2.201 4.782 -2.558
146 HB VAL 21 HB VAL 21 -1.591 6.983 -4.534
147 1HG1 VAL 21 1HG1 VAL 21 -3.186 4.440 -4.658
148 2HG1 VAL 21 2HG1 VAL 21 -1.848 4.950 -5.687
149 3HG1 VAL 21 3HG1 VAL 21 -3.413 5.752 -5.814
150 1HG2 VAL 21 1HG2 VAL 21 -4.111 7.355 -4.396
151 2HG2 VAL 21 2HG2 VAL 21 -3.133 7.971 -3.065
152 3HG2 VAL 21 3HG2 VAL 21 -4.040 6.471 -2.871
153 H LYS 22 H LYS 22 0.744 6.605 -2.850
154 HA LYS 22 HA LYS 22 2.061 4.984 -4.754
155 1HB LYS 22 2HB LYS 22 3.246 6.670 -2.539
156 2HB LYS 22 1HB LYS 22 4.126 6.030 -3.921
157 1HG LYS 22 2HG LYS 22 2.869 7.404 -5.433
158 2HG LYS 22 1HG LYS 22 1.815 7.948 -4.126
159 1HD LYS 22 2HD LYS 22 3.452 9.288 -3.188
160 2HD LYS 22 1HD LYS 22 4.767 8.373 -3.927
161 1HE LYS 22 2HE LYS 22 4.847 10.118 -5.347
162 2HE LYS 22 1HE LYS 22 3.507 9.285 -6.133
163 1HZ LYS 22 1HZ LYS 22 3.004 11.615 -5.778
164 2HZ LYS 22 2HZ LYS 22 3.256 11.450 -4.114
165 3HZ LYS 22 3HZ LYS 22 1.966 10.647 -4.857
166 H THR 23 H THR 23 1.692 4.801 -1.268
167 HA THR 23 HA THR 23 3.608 2.725 -0.897
168 HB THR 23 HB THR 23 1.353 2.935 1.012
169 HG1 THR 23 1HG THR 23 1.433 5.058 0.741
170 1HG2 THR 23 1HG2 THR 23 3.241 3.185 2.629
171 2HG2 THR 23 2HG2 THR 23 4.345 2.949 1.274
172 3HG2 THR 23 3HG2 THR 23 3.221 1.668 1.728
173 H TYR 24 H TYR 24 0.142 2.832 -1.462
174 HA TYR 24 HA TYR 24 -0.370 0.084 -1.074
175 1HB TYR 24 2HB TYR 24 -2.110 1.867 -1.167
176 2HB TYR 24 1HB TYR 24 -1.833 2.002 -2.898
177 HD1 TYR 24 1HD TYR 24 -3.604 1.113 -4.077
178 HD2 TYR 24 2HD TYR 24 -2.263 -0.903 -0.579
179 HE1 TYR 24 1HE TYR 24 -5.247 -0.671 -4.483
180 HE2 TYR 24 2HE TYR 24 -3.901 -2.693 -0.976
181 HH TYR 24 HH TYR 24 -6.460 -2.500 -2.689
182 H LEU 25 H LEU 25 0.891 1.943 -3.726
183 HA LEU 25 HA LEU 25 0.604 -0.132 -5.693
184 1HB LEU 25 2HB LEU 25 1.904 2.545 -5.566
185 2HB LEU 25 1HB LEU 25 2.479 1.421 -6.783
186 HG LEU 25 HG LEU 25 -0.392 2.309 -6.490
187 1HD1 LEU 25 1HD1 LEU 25 0.316 3.349 -8.813
188 2HD1 LEU 25 2HD1 LEU 25 1.902 3.379 -8.042
189 3HD1 LEU 25 3HD1 LEU 25 0.544 4.223 -7.297
190 1HD2 LEU 25 1HD2 LEU 25 -0.421 0.201 -7.508
191 2HD2 LEU 25 2HD2 LEU 25 1.044 0.527 -8.432
192 3HD2 LEU 25 3HD2 LEU 25 -0.463 1.340 -8.854
193 H ALA 26 H ALA 26 3.201 1.119 -3.657
194 HA ALA 26 HA ALA 26 5.249 -0.541 -4.599
195 1HB ALA 26 1HB ALA 26 5.244 1.523 -2.942
196 2HB ALA 26 2HB ALA 26 6.528 0.316 -2.912
197 3HB ALA 26 3HB ALA 26 5.220 0.240 -1.733
198 H HIS 27 H HIS 27 2.674 -1.068 -2.275
199 HA HIS 27 HA HIS 27 3.738 -3.443 -1.140
200 1HB HIS 27 2HB HIS 27 2.039 -2.339 0.104
201 2HB HIS 27 1HB HIS 27 0.945 -2.306 -1.276
202 HD1 HIS 27 1HD HIS 27 2.467 -4.824 1.142
203 HD2 HIS 27 2HD HIS 27 -0.765 -4.393 -1.429
204 HE1 HIS 27 1HE HIS 27 1.012 -6.864 1.480
205 H LYS 28 H LYS 28 1.207 -2.929 -3.598
206 HA LYS 28 HA LYS 28 0.835 -5.637 -4.225
207 1HB LYS 28 2HB LYS 28 -0.540 -3.508 -4.883
208 2HB LYS 28 1HB LYS 28 0.507 -3.496 -6.295
209 1HG LYS 28 2HG LYS 28 -0.253 -5.666 -6.958
210 2HG LYS 28 1HG LYS 28 -1.163 -5.855 -5.457
211 1HD LYS 28 2HD LYS 28 -2.871 -4.562 -6.178
212 2HD LYS 28 1HD LYS 28 -1.804 -3.457 -7.046
213 1HE LYS 28 2HE LYS 28 -1.483 -5.414 -8.693
214 2HE LYS 28 1HE LYS 28 -2.928 -6.088 -7.941
215 1HZ LYS 28 1HZ LYS 28 -3.430 -4.780 -9.930
216 2HZ LYS 28 2HZ LYS 28 -2.763 -3.405 -9.204
217 3HZ LYS 28 3HZ LYS 28 -4.150 -4.117 -8.550
218 H GLN 29 H GLN 29 3.241 -3.331 -5.239
219 HA GLN 29 HA GLN 29 4.187 -4.987 -7.415
220 1HB GLN 29 2HB GLN 29 4.285 -2.317 -6.970
221 2HB GLN 29 1HB GLN 29 5.893 -2.784 -6.437
222 1HG GLN 29 2HG GLN 29 6.564 -3.395 -8.524
223 2HG GLN 29 1HG GLN 29 4.936 -3.831 -9.042
224 1HE2 GLN 29 1HE2 GLN 29 5.361 -2.650 -10.972
225 2HE2 GLN 29 2HE2 GLN 29 5.228 -0.928 -10.994
226 H PHE 30 H PHE 30 4.695 -4.863 -4.053
227 HA PHE 30 HA PHE 30 7.280 -6.246 -4.337
228 1HB PHE 30 2HB PHE 30 6.191 -4.400 -2.273
229 2HB PHE 30 1HB PHE 30 7.264 -5.684 -1.729
230 HD1 PHE 30 1HD PHE 30 7.347 -2.415 -2.260
231 HD2 PHE 30 2HD PHE 30 9.249 -5.905 -3.782
232 HE1 PHE 30 1HE PHE 30 9.293 -1.062 -2.919
233 HE2 PHE 30 2HE PHE 30 11.200 -4.558 -4.443
234 HZ PHE 30 HZ PHE 30 11.223 -2.134 -4.012
235 H TYR 31 H TYR 31 4.354 -6.247 -2.291
236 HA TYR 31 HA TYR 31 4.886 -8.862 -1.268
237 1HB TYR 31 2HB TYR 31 3.453 -6.868 -0.287
238 2HB TYR 31 1HB TYR 31 2.153 -7.666 -1.164
239 HD1 TYR 31 1HD TYR 31 4.744 -8.207 1.438
240 HD2 TYR 31 2HD TYR 31 1.096 -9.569 -0.274
241 HE1 TYR 31 1HE TYR 31 4.463 -9.782 3.305
242 HE2 TYR 31 2HE TYR 31 0.803 -11.147 1.588
243 HH TYR 31 HH TYR 31 1.724 -11.155 4.157
244 H HIS 32 H HIS 32 2.798 -7.552 -3.794
245 HA HIS 32 HA HIS 32 1.961 -10.286 -4.474
246 1HB HIS 32 2HB HIS 32 0.784 -7.642 -5.355
247 2HB HIS 32 1HB HIS 32 0.161 -9.234 -5.776
248 HD1 HIS 32 1HD HIS 32 -1.339 -10.391 -4.051
249 HD2 HIS 32 2HD HIS 32 0.420 -6.898 -2.645
250 HE1 HIS 32 1HE HIS 32 -2.468 -9.862 -1.848
251 H LYS 33 H LYS 33 4.520 -9.781 -5.145
252 HA LYS 33 HA LYS 33 4.387 -9.791 -8.059
253 1HB LYS 33 2HB LYS 33 5.811 -7.773 -6.413
254 2HB LYS 33 1HB LYS 33 6.674 -8.402 -7.810
255 1HG LYS 33 2HG LYS 33 3.921 -7.190 -7.916
256 2HG LYS 33 1HG LYS 33 5.417 -6.318 -8.259
257 1HD LYS 33 2HD LYS 33 5.694 -7.316 -10.273
258 2HD LYS 33 1HD LYS 33 5.029 -8.855 -9.719
259 1HE LYS 33 2HE LYS 33 3.468 -8.056 -11.274
260 2HE LYS 33 1HE LYS 33 2.767 -7.679 -9.701
261 1HZ LYS 33 1HZ LYS 33 4.026 -5.844 -11.643
262 2HZ LYS 33 2HZ LYS 33 3.879 -5.419 -10.013
263 3HZ LYS 33 3HZ LYS 33 2.495 -5.744 -10.930
264 H ASN 34 H ASN 34 4.611 -12.090 -7.098
265 HA ASN 34 HA ASN 34 5.859 -13.987 -6.977
266 1HB ASN 34 2HB ASN 34 8.193 -12.329 -7.943
267 2HB ASN 34 1HB ASN 34 7.973 -14.069 -8.104
268 1HD2 ASN 34 1HD2 ASN 34 8.447 -12.056 -10.149
269 2HD2 ASN 34 2HD2 ASN 34 7.122 -12.168 -11.252
270 H LYS 35 H LYS 35 5.499 -12.763 -4.615
271 HA LYS 35 HA LYS 35 7.640 -13.744 -3.052
272 1HB LYS 35 2HB LYS 35 8.314 -11.336 -4.015
273 2HB LYS 35 1HB LYS 35 7.399 -10.817 -2.607
274 1HG LYS 35 2HG LYS 35 9.672 -12.782 -2.485
275 2HG LYS 35 1HG LYS 35 9.858 -11.044 -2.247
276 1HD LYS 35 2HD LYS 35 7.982 -12.757 -0.626
277 2HD LYS 35 1HD LYS 35 9.639 -12.396 -0.139
278 1HE LYS 35 2HE LYS 35 7.460 -10.374 -0.651
279 2HE LYS 35 1HE LYS 35 8.040 -10.887 0.933
280 1HZ LYS 35 1HZ LYS 35 10.280 -10.067 0.205
281 2HZ LYS 35 2HZ LYS 35 9.113 -8.864 0.433
282 3HZ LYS 35 3HZ LYS 35 9.520 -9.360 -1.132
283 HA PRO 36 HA PRO 36 3.402 -12.941 -1.104
284 1HB PRO 36 2HB PRO 36 2.591 -15.522 -0.928
285 2HB PRO 36 1HB PRO 36 2.271 -14.515 -2.344
286 1HG PRO 36 2HG PRO 36 4.410 -16.567 -1.923
287 2HG PRO 36 1HG PRO 36 3.393 -16.287 -3.349
288 1HD PRO 36 2HD PRO 36 5.947 -15.397 -3.177
289 2HD PRO 36 1HD PRO 36 4.692 -14.533 -4.086