NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20383 |
2fo8   |
6876 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H HIS 3 H HIS 3 -5.960 -10.164 4.296
2 HA HIS 3 HA HIS 3 -5.188 -9.191 6.957
3 1HB HIS 3 2HB HIS 3 -3.337 -10.590 6.427
4 2HB HIS 3 1HB HIS 3 -3.422 -10.140 4.721
5 HD1 HIS 3 1HD HIS 3 -2.880 -8.156 7.936
6 HD2 HIS 3 2HD HIS 3 -1.281 -8.635 4.120
7 HE1 HIS 3 1HE HIS 3 -1.015 -6.484 7.769
8 HE2 HIS 3 2HE HIS 3 -0.208 -6.645 5.389
9 H LYS 4 H LYS 4 -4.734 -6.998 7.050
10 HA LYS 4 HA LYS 4 -4.980 -5.491 4.551
11 1HB LYS 4 2HB LYS 4 -6.562 -3.938 5.655
12 2HB LYS 4 1HB LYS 4 -7.194 -5.577 5.495
13 1HG LYS 4 2HG LYS 4 -6.678 -6.021 7.837
14 2HG LYS 4 1HG LYS 4 -6.016 -4.396 8.008
15 1HD LYS 4 2HD LYS 4 -8.837 -4.806 7.080
16 2HD LYS 4 1HD LYS 4 -8.440 -4.872 8.796
17 1HE LYS 4 2HE LYS 4 -9.159 -2.648 8.275
18 2HE LYS 4 1HE LYS 4 -7.427 -2.611 8.586
19 1HZ LYS 4 1HZ LYS 4 -8.626 -2.714 5.873
20 2HZ LYS 4 2HZ LYS 4 -6.997 -2.466 6.262
21 3HZ LYS 4 3HZ LYS 4 -8.144 -1.281 6.643
22 H VAL 5 H VAL 5 -3.608 -3.776 4.413
23 HA VAL 5 HA VAL 5 -2.328 -2.944 6.927
24 HB VAL 5 HB VAL 5 -1.158 -3.302 4.214
25 1HG1 VAL 5 1HG1 VAL 5 -0.851 -0.931 4.394
26 2HG1 VAL 5 2HG1 VAL 5 0.682 -1.745 4.721
27 3HG1 VAL 5 3HG1 VAL 5 -0.276 -1.097 6.052
28 1HG2 VAL 5 1HG2 VAL 5 -0.007 -3.425 6.992
29 2HG2 VAL 5 2HG2 VAL 5 0.726 -4.037 5.508
30 3HG2 VAL 5 3HG2 VAL 5 -0.739 -4.789 6.140
31 H THR 6 H THR 6 -1.668 -0.683 7.040
32 HA THR 6 HA THR 6 -3.355 1.264 5.764
33 HB THR 6 HB THR 6 -4.046 1.960 8.238
34 HG1 THR 6 1HG THR 6 -4.461 0.035 9.468
35 1HG2 THR 6 1HG2 THR 6 -6.187 0.824 7.933
36 2HG2 THR 6 2HG2 THR 6 -5.463 -0.249 6.736
37 3HG2 THR 6 3HG2 THR 6 -5.619 1.473 6.391
38 H LYS 7 H LYS 7 -2.860 3.491 7.009
39 HA LYS 7 HA LYS 7 -0.236 4.044 6.406
40 1HB LYS 7 2HB LYS 7 -2.029 5.720 6.669
41 2HB LYS 7 1HB LYS 7 -1.900 5.553 8.413
42 1HG LYS 7 2HG LYS 7 -0.727 7.534 7.489
43 2HG LYS 7 1HG LYS 7 0.315 6.447 8.407
44 1HD LYS 7 2HD LYS 7 1.315 5.587 6.447
45 2HD LYS 7 1HD LYS 7 0.071 6.286 5.406
46 1HE LYS 7 2HE LYS 7 2.147 7.558 5.247
47 2HE LYS 7 1HE LYS 7 0.879 8.538 5.978
48 1HZ LYS 7 1HZ LYS 7 2.899 8.862 7.180
49 2HZ LYS 7 2HZ LYS 7 3.127 7.196 7.380
50 3HZ LYS 7 3HZ LYS 7 1.847 7.971 8.169
51 H ALA 8 H ALA 8 -1.449 3.095 9.639
52 HA ALA 8 HA ALA 8 0.896 3.689 11.079
53 1HB ALA 8 1HB ALA 8 0.108 2.086 12.733
54 2HB ALA 8 2HB ALA 8 -1.044 1.437 11.567
55 3HB ALA 8 3HB ALA 8 -1.222 3.090 12.152
56 H HIS 9 H HIS 9 -0.009 0.943 9.133
57 HA HIS 9 HA HIS 9 2.089 -0.795 9.879
58 1HB HIS 9 2HB HIS 9 0.298 -0.669 7.471
59 2HB HIS 9 1HB HIS 9 1.555 -1.886 7.630
60 HD1 HIS 9 1HD HIS 9 -1.918 -1.255 8.442
61 HD2 HIS 9 2HD HIS 9 1.153 -3.552 10.034
62 HE1 HIS 9 1HE HIS 9 -3.038 -3.140 9.629
63 HE2 HIS 9 2HE HIS 9 -1.171 -4.256 10.920
64 H ASN 10 H ASN 10 2.217 2.102 8.269
65 HA ASN 10 HA ASN 10 4.142 1.901 6.301
66 1HB ASN 10 2HB ASN 10 3.043 4.027 6.961
67 2HB ASN 10 1HB ASN 10 3.947 4.015 8.472
68 1HD2 ASN 10 1HD2 ASN 10 4.009 4.726 5.120
69 2HD2 ASN 10 2HD2 ASN 10 5.592 5.421 5.071
70 H GLY 11 H GLY 11 4.368 1.173 9.624
71 1HA GLY 11 2HA GLY 11 7.195 0.461 9.254
72 2HA GLY 11 1HA GLY 11 6.759 1.432 10.657
73 H ALA 12 H ALA 12 5.407 -1.438 9.019
74 HA ALA 12 HA ALA 12 5.062 -2.638 11.698
75 1HB ALA 12 1HB ALA 12 2.940 -2.299 10.800
76 2HB ALA 12 2HB ALA 12 3.275 -4.007 10.489
77 3HB ALA 12 3HB ALA 12 3.442 -2.820 9.192
78 H THR 13 H THR 13 5.339 -4.851 11.989
79 HA THR 13 HA THR 13 6.434 -6.460 9.790
80 HB THR 13 HB THR 13 7.584 -6.543 12.596
81 HG1 THR 13 1HG THR 13 8.121 -4.842 10.544
82 1HG2 THR 13 1HG2 THR 13 7.733 -8.639 11.335
83 2HG2 THR 13 2HG2 THR 13 9.327 -7.915 11.551
84 3HG2 THR 13 3HG2 THR 13 8.500 -7.782 9.998
85 H LEU 14 H LEU 14 5.038 -8.159 9.599
86 HA LEU 14 HA LEU 14 3.737 -9.273 11.947
87 1HB LEU 14 2HB LEU 14 2.510 -7.187 11.252
88 2HB LEU 14 1HB LEU 14 2.141 -7.983 9.737
89 HG LEU 14 HG LEU 14 0.868 -9.693 10.929
90 1HD1 LEU 14 1HD1 LEU 14 2.190 -9.637 13.000
91 2HD1 LEU 14 2HD1 LEU 14 0.458 -9.493 13.310
92 3HD1 LEU 14 3HD1 LEU 14 1.492 -8.066 13.388
93 1HD2 LEU 14 1HD2 LEU 14 0.091 -6.875 11.683
94 2HD2 LEU 14 2HD2 LEU 14 -0.989 -8.269 11.624
95 3HD2 LEU 14 3HD2 LEU 14 -0.251 -7.661 10.140
96 H THR 15 H THR 15 2.386 -11.139 11.422
97 HA THR 15 HA THR 15 3.092 -12.436 8.878
98 HB THR 15 HB THR 15 1.920 -13.623 11.408
99 HG1 THR 15 1HG THR 15 4.459 -13.075 10.714
100 1HG2 THR 15 1HG2 THR 15 1.178 -14.742 9.323
101 2HG2 THR 15 2HG2 THR 15 2.176 -15.780 10.351
102 3HG2 THR 15 3HG2 THR 15 2.870 -15.031 8.912
103 H VAL 16 H VAL 16 1.387 -13.321 7.555
104 HA VAL 16 HA VAL 16 -1.282 -12.295 8.286
105 HB VAL 16 HB VAL 16 -1.708 -11.496 6.130
106 1HG1 VAL 16 1HG1 VAL 16 -0.273 -10.038 7.424
107 2HG1 VAL 16 2HG1 VAL 16 0.124 -9.919 5.711
108 3HG1 VAL 16 3HG1 VAL 16 1.158 -10.853 6.792
109 1HG2 VAL 16 1HG2 VAL 16 -0.282 -11.815 4.204
110 2HG2 VAL 16 2HG2 VAL 16 -0.820 -13.365 4.852
111 3HG2 VAL 16 3HG2 VAL 16 0.820 -12.796 5.169
112 H ALA 17 H ALA 17 -3.066 -13.387 7.489
113 HA ALA 17 HA ALA 17 -2.585 -16.047 6.338
114 1HB ALA 17 1HB ALA 17 -4.987 -14.815 7.682
115 2HB ALA 17 2HB ALA 17 -3.991 -16.139 8.281
116 3HB ALA 17 3HB ALA 17 -5.023 -16.380 6.871
117 H VAL 18 H VAL 18 -3.480 -16.524 4.319
118 HA VAL 18 HA VAL 18 -4.582 -14.193 2.886
119 HB VAL 18 HB VAL 18 -3.486 -14.877 0.874
120 1HG1 VAL 18 1HG1 VAL 18 -1.099 -14.734 1.506
121 2HG1 VAL 18 2HG1 VAL 18 -1.561 -14.967 3.197
122 3HG1 VAL 18 3HG1 VAL 18 -2.106 -13.532 2.325
123 1HG2 VAL 18 1HG2 VAL 18 -2.053 -16.849 0.737
124 2HG2 VAL 18 2HG2 VAL 18 -3.712 -17.290 1.141
125 3HG2 VAL 18 3HG2 VAL 18 -2.472 -17.274 2.395
126 H GLY 19 H GLY 19 -5.469 -15.192 0.632
127 1HA GLY 19 2HA GLY 19 -6.620 -17.315 -0.115
128 2HA GLY 19 1HA GLY 19 -7.425 -17.252 1.449
129 H GLU 20 H GLU 20 -8.398 -14.947 1.860
130 HA GLU 20 HA GLU 20 -10.215 -14.325 -0.258
131 1HB GLU 20 2HB GLU 20 -9.546 -12.665 2.180
132 2HB GLU 20 1HB GLU 20 -10.962 -12.493 1.155
133 1HG GLU 20 2HG GLU 20 -11.697 -14.746 1.866
134 2HG GLU 20 1HG GLU 20 -10.328 -14.800 2.980
135 H LEU 21 H LEU 21 -7.847 -12.315 1.419
136 HA LEU 21 HA LEU 21 -6.623 -11.314 -0.939
137 1HB LEU 21 2HB LEU 21 -8.660 -10.104 -1.238
138 2HB LEU 21 1HB LEU 21 -8.712 -9.649 0.452
139 HG LEU 21 HG LEU 21 -6.690 -8.240 0.080
140 1HD1 LEU 21 1HD1 LEU 21 -7.205 -8.763 -2.839
141 2HD1 LEU 21 2HD1 LEU 21 -5.898 -9.502 -1.916
142 3HD1 LEU 21 3HD1 LEU 21 -5.944 -7.751 -2.135
143 1HD2 LEU 21 1HD2 LEU 21 -7.881 -6.467 -1.121
144 2HD2 LEU 21 2HD2 LEU 21 -8.911 -7.262 0.070
145 3HD2 LEU 21 3HD2 LEU 21 -9.088 -7.642 -1.644
146 H VAL 22 H VAL 22 -4.681 -10.370 -0.412
147 HA VAL 22 HA VAL 22 -4.382 -9.509 2.378
148 HB VAL 22 HB VAL 22 -2.555 -11.047 0.631
149 1HG1 VAL 22 1HG1 VAL 22 -1.506 -8.756 2.294
150 2HG1 VAL 22 2HG1 VAL 22 -1.235 -9.044 0.578
151 3HG1 VAL 22 3HG1 VAL 22 -0.522 -10.123 1.778
152 1HG2 VAL 22 1HG2 VAL 22 -2.841 -10.650 3.597
153 2HG2 VAL 22 2HG2 VAL 22 -1.761 -11.815 2.825
154 3HG2 VAL 22 3HG2 VAL 22 -3.507 -11.966 2.630
155 H GLU 23 H GLU 23 -4.688 -7.384 2.466
156 HA GLU 23 HA GLU 23 -3.971 -5.872 0.056
157 1HB GLU 23 2HB GLU 23 -5.756 -4.411 0.397
158 2HB GLU 23 1HB GLU 23 -6.408 -6.010 0.708
159 1HG GLU 23 2HG GLU 23 -6.453 -5.643 3.040
160 2HG GLU 23 1HG GLU 23 -5.476 -4.181 2.896
161 H ILE 24 H ILE 24 -3.361 -3.747 0.227
162 HA ILE 24 HA ILE 24 -2.093 -2.893 2.740
163 HB ILE 24 HB ILE 24 -0.897 -2.656 -0.027
164 1HG1 ILE 24 2HG1 ILE 24 -0.884 -5.002 0.807
165 2HG1 ILE 24 1HG1 ILE 24 0.737 -4.338 0.605
166 1HG2 ILE 24 1HG2 ILE 24 1.099 -1.868 1.148
167 2HG2 ILE 24 2HG2 ILE 24 0.230 -1.980 2.679
168 3HG2 ILE 24 3HG2 ILE 24 -0.300 -0.835 1.447
169 1HD1 ILE 24 1HD1 ILE 24 0.836 -3.925 3.022
170 2HD1 ILE 24 2HD1 ILE 24 0.569 -5.625 2.645
171 3HD1 ILE 24 3HD1 ILE 24 -0.774 -4.625 3.200
172 H GLN 25 H GLN 25 -3.430 -1.117 3.175
173 HA GLN 25 HA GLN 25 -4.065 0.578 0.860
174 1HB GLN 25 2HB GLN 25 -6.100 -0.245 1.595
175 2HB GLN 25 1HB GLN 25 -5.668 -0.099 3.300
176 1HG GLN 25 2HG GLN 25 -5.639 2.442 1.919
177 2HG GLN 25 1HG GLN 25 -7.202 1.643 1.797
178 1HE2 GLN 25 1HE2 GLN 25 -4.886 3.095 3.962
179 2HE2 GLN 25 2HE2 GLN 25 -5.960 3.225 5.315
180 H LEU 26 H LEU 26 -3.651 2.683 0.871
181 HA LEU 26 HA LEU 26 -2.578 3.794 3.336
182 1HB LEU 26 2HB LEU 26 -1.996 4.448 0.474
183 2HB LEU 26 1HB LEU 26 -1.711 5.634 1.725
184 HG LEU 26 HG LEU 26 0.347 4.546 1.196
185 1HD1 LEU 26 1HD1 LEU 26 0.133 5.141 3.493
186 2HD1 LEU 26 2HD1 LEU 26 0.959 3.582 3.394
187 3HD1 LEU 26 3HD1 LEU 26 -0.745 3.651 3.847
188 1HD2 LEU 26 1HD2 LEU 26 -1.029 1.949 1.847
189 2HD2 LEU 26 2HD2 LEU 26 0.678 2.148 1.453
190 3HD2 LEU 26 3HD2 LEU 26 -0.556 2.498 0.238
191 HA PRO 27 HA PRO 27 -6.005 6.656 3.216
192 1HB PRO 27 2HB PRO 27 -5.277 8.310 5.133
193 2HB PRO 27 1HB PRO 27 -5.561 6.605 5.522
194 1HG PRO 27 2HG PRO 27 -2.945 7.997 4.979
195 2HG PRO 27 1HG PRO 27 -3.382 6.924 6.326
196 1HD PRO 27 2HD PRO 27 -2.056 6.076 4.102
197 2HD PRO 27 1HD PRO 27 -3.116 5.027 5.065
198 H SER 28 H SER 28 -3.218 7.117 1.753
199 HA SER 28 HA SER 28 -2.343 8.642 0.352
200 1HB SER 28 2HB SER 28 -4.717 9.036 -0.338
201 2HB SER 28 1HB SER 28 -4.803 10.314 0.876
202 HG SER 28 HG SER 28 -2.967 10.224 -1.301
203 H ASN 29 H ASN 29 -3.975 10.540 2.835
204 HA ASN 29 HA ASN 29 -3.321 12.358 4.063
205 1HB ASN 29 2HB ASN 29 -0.449 11.555 3.805
206 2HB ASN 29 1HB ASN 29 -1.250 12.317 5.166
207 1HD2 ASN 29 1HD2 ASN 29 -0.283 9.411 3.698
208 2HD2 ASN 29 2HD2 ASN 29 -0.839 8.330 4.928
209 HA PRO 30 HA PRO 30 -2.296 13.762 -0.323
210 1HB PRO 30 2HB PRO 30 -4.121 15.912 0.713
211 2HB PRO 30 1HB PRO 30 -4.038 15.193 -0.905
212 1HG PRO 30 2HG PRO 30 -5.937 14.355 0.685
213 2HG PRO 30 1HG PRO 30 -4.941 13.142 -0.156
214 1HD PRO 30 2HD PRO 30 -4.740 14.083 2.684
215 2HD PRO 30 1HD PRO 30 -4.706 12.425 2.042
216 H THR 31 H THR 31 -0.416 14.655 -0.638
217 HA THR 31 HA THR 31 0.706 16.373 1.415
218 HB THR 31 HB THR 31 2.845 15.975 0.104
219 HG1 THR 31 1HG THR 31 1.592 13.781 -1.109
220 1HG2 THR 31 1HG2 THR 31 2.209 14.674 2.125
221 2HG2 THR 31 2HG2 THR 31 3.144 13.730 0.964
222 3HG2 THR 31 3HG2 THR 31 1.396 13.504 1.077
223 H THR 32 H THR 32 1.684 16.459 -1.945
224 HA THR 32 HA THR 32 0.653 19.088 -2.472
225 HB THR 32 HB THR 32 2.528 19.545 -0.865
226 HG1 THR 32 1HG THR 32 2.315 21.310 -2.043
227 1HG2 THR 32 1HG2 THR 32 4.026 17.734 -1.508
228 2HG2 THR 32 2HG2 THR 32 4.837 19.293 -1.653
229 3HG2 THR 32 3HG2 THR 32 4.252 18.468 -3.096
230 H GLY 33 H GLY 33 0.970 16.331 -3.598
231 1HA GLY 33 2HA GLY 33 0.881 16.482 -6.193
232 2HA GLY 33 1HA GLY 33 2.585 16.823 -5.975
233 H PHE 34 H PHE 34 3.017 15.127 -3.799
234 HA PHE 34 HA PHE 34 3.568 12.686 -5.010
235 1HB PHE 34 2HB PHE 34 3.233 12.961 -2.035
236 2HB PHE 34 1HB PHE 34 4.424 12.023 -2.933
237 HD1 PHE 34 1HD PHE 34 4.366 14.495 -0.735
238 HD2 PHE 34 2HD PHE 34 5.566 13.910 -4.768
239 HE1 PHE 34 1HE PHE 34 5.949 16.361 -0.533
240 HE2 PHE 34 2HE PHE 34 7.143 15.776 -4.577
241 HZ PHE 34 HZ PHE 34 7.346 17.002 -2.451
242 H ALA 35 H ALA 35 2.601 10.735 -4.991
243 HA ALA 35 HA ALA 35 0.143 10.324 -3.449
244 1HB ALA 35 1HB ALA 35 0.471 9.645 -6.385
245 2HB ALA 35 2HB ALA 35 -0.561 10.920 -5.736
246 3HB ALA 35 3HB ALA 35 -0.921 9.229 -5.384
247 H TRP 36 H TRP 36 -0.265 7.974 -3.111
248 HA TRP 36 HA TRP 36 2.275 6.642 -2.742
249 1HB TRP 36 2HB TRP 36 -0.505 5.661 -2.047
250 2HB TRP 36 1HB TRP 36 1.005 4.839 -1.660
251 HD1 TRP 36 HD TRP 36 -1.239 7.673 -0.436
252 HE1 TRP 36 1HE TRP 36 -0.364 8.423 1.851
253 HE3 TRP 36 3HE TRP 36 3.188 5.112 -0.376
254 HZ2 TRP 36 2HZ TRP 36 1.880 7.955 3.498
255 HZ3 TRP 36 3HZ TRP 36 4.653 5.318 1.588
256 HH2 TRP 36 HH TRP 36 4.012 6.725 3.487
257 H TYR 37 H TYR 37 3.186 5.547 -4.282
258 HA TYR 37 HA TYR 37 1.564 3.536 -5.694
259 1HB TYR 37 2HB TYR 37 3.818 5.236 -6.751
260 2HB TYR 37 1HB TYR 37 3.415 3.691 -7.488
261 HD1 TYR 37 1HD TYR 37 2.461 7.184 -7.125
262 HD2 TYR 37 2HD TYR 37 1.242 3.372 -8.573
263 HE1 TYR 37 1HE TYR 37 0.732 8.266 -8.506
264 HE2 TYR 37 2HE TYR 37 -0.488 4.440 -9.952
265 HH TYR 37 HH TYR 37 -0.523 7.626 -10.714
266 H PHE 38 H PHE 38 3.163 1.643 -6.403
267 HA PHE 38 HA PHE 38 4.686 0.813 -4.178
268 1HB PHE 38 2HB PHE 38 3.961 -0.287 -6.707
269 2HB PHE 38 1HB PHE 38 5.706 -0.426 -6.505
270 HD1 PHE 38 1HD PHE 38 2.530 -1.783 -5.659
271 HD2 PHE 38 2HD PHE 38 6.556 -1.509 -4.328
272 HE1 PHE 38 1HE PHE 38 2.175 -3.739 -4.217
273 HE2 PHE 38 2HE PHE 38 6.213 -3.469 -2.882
274 HZ PHE 38 HZ PHE 38 4.017 -4.589 -2.828
275 H GLU 39 H GLU 39 6.052 1.261 -7.419
276 HA GLU 39 HA GLU 39 8.249 2.781 -6.190
277 1HB GLU 39 2HB GLU 39 9.591 2.186 -8.152
278 2HB GLU 39 1HB GLU 39 8.996 0.751 -7.329
279 1HG GLU 39 2HG GLU 39 7.386 0.339 -9.005
280 2HG GLU 39 1HG GLU 39 7.622 1.932 -9.723
281 H GLY 40 H GLY 40 5.473 3.115 -7.986
282 1HA GLY 40 2HA GLY 40 4.819 5.430 -8.486
283 2HA GLY 40 1HA GLY 40 6.454 5.689 -9.074
284 H GLY 41 H GLY 41 3.292 4.863 -9.908
285 1HA GLY 41 2HA GLY 41 2.395 4.680 -12.046
286 2HA GLY 41 1HA GLY 41 4.028 4.602 -12.695
287 H THR 42 H THR 42 4.619 2.419 -10.694
288 HA THR 42 HA THR 42 3.225 0.215 -12.049
289 HB THR 42 HB THR 42 6.133 0.116 -11.263
290 HG1 THR 42 1HG THR 42 6.672 0.852 -13.244
291 1HG2 THR 42 1HG2 THR 42 4.984 -2.031 -11.567
292 2HG2 THR 42 2HG2 THR 42 6.203 -1.766 -12.813
293 3HG2 THR 42 3HG2 THR 42 4.495 -1.537 -13.188
294 H LYS 43 H LYS 43 2.715 -1.524 -10.832
295 HA LYS 43 HA LYS 43 3.617 -1.578 -8.048
296 1HB LYS 43 2HB LYS 43 1.525 -1.507 -7.128
297 2HB LYS 43 1HB LYS 43 1.263 -0.484 -8.515
298 1HG LYS 43 2HG LYS 43 0.577 -3.410 -8.491
299 2HG LYS 43 1HG LYS 43 -0.553 -2.139 -8.035
300 1HD LYS 43 2HD LYS 43 -0.285 -1.133 -10.268
301 2HD LYS 43 1HD LYS 43 0.802 -2.449 -10.715
302 1HE LYS 43 2HE LYS 43 -1.008 -4.061 -10.329
303 2HE LYS 43 1HE LYS 43 -2.090 -2.737 -9.906
304 1HZ LYS 43 1HZ LYS 43 -0.926 -3.380 -12.547
305 2HZ LYS 43 2HZ LYS 43 -1.556 -1.842 -12.213
306 3HZ LYS 43 3HZ LYS 43 -2.562 -3.209 -12.125
307 H GLU 44 H GLU 44 4.104 -3.594 -7.333
308 HA GLU 44 HA GLU 44 3.200 -5.847 -8.997
309 1HB GLU 44 2HB GLU 44 5.373 -6.921 -8.729
310 2HB GLU 44 1HB GLU 44 5.540 -5.356 -9.510
311 1HG GLU 44 2HG GLU 44 5.902 -5.544 -6.561
312 2HG GLU 44 1HG GLU 44 7.186 -6.119 -7.622
313 H SER 45 H SER 45 2.719 -7.743 -8.022
314 HA SER 45 HA SER 45 2.786 -7.825 -5.055
315 1HB SER 45 2HB SER 45 1.033 -9.668 -5.437
316 2HB SER 45 1HB SER 45 0.530 -8.006 -5.742
317 HG SER 45 HG SER 45 1.573 -9.092 -7.982
318 HA PRO 46 HA PRO 46 5.822 -11.012 -5.691
319 1HB PRO 46 2HB PRO 46 5.334 -11.905 -2.955
320 2HB PRO 46 1HB PRO 46 6.748 -11.080 -3.618
321 1HG PRO 46 2HG PRO 46 5.052 -9.875 -1.887
322 2HG PRO 46 1HG PRO 46 5.899 -8.984 -3.167
323 1HD PRO 46 2HD PRO 46 3.078 -10.018 -3.134
324 2HD PRO 46 1HD PRO 46 3.676 -8.422 -3.647
325 H ASN 47 H ASN 47 5.789 -13.062 -6.382
326 HA ASN 47 HA ASN 47 5.090 -15.157 -6.892
327 1HB ASN 47 2HB ASN 47 3.401 -14.832 -4.404
328 2HB ASN 47 1HB ASN 47 3.509 -16.325 -5.326
329 1HD2 ASN 47 1HD2 ASN 47 4.312 -15.540 -2.539
330 2HD2 ASN 47 2HD2 ASN 47 5.954 -16.057 -2.411
331 H GLU 48 H GLU 48 3.894 -12.867 -8.098
332 HA GLU 48 HA GLU 48 1.105 -13.670 -8.424
333 1HB GLU 48 2HB GLU 48 0.676 -11.566 -9.401
334 2HB GLU 48 1HB GLU 48 1.718 -11.255 -8.023
335 1HG GLU 48 2HG GLU 48 3.562 -10.780 -9.383
336 2HG GLU 48 1HG GLU 48 2.805 -11.500 -10.805
337 H SER 49 H SER 49 0.273 -14.391 -10.180
338 HA SER 49 HA SER 49 1.173 -14.316 -12.791
339 1HB SER 49 2HB SER 49 3.069 -15.733 -11.942
340 2HB SER 49 1HB SER 49 1.891 -16.948 -11.445
341 HG SER 49 HG SER 49 2.804 -16.271 -13.978
342 H MET 50 H MET 50 -0.043 -16.759 -10.528
343 HA MET 50 HA MET 50 -2.476 -17.061 -12.076
344 1HB MET 50 2HB MET 50 -3.093 -18.722 -10.330
345 2HB MET 50 1HB MET 50 -1.595 -19.079 -11.173
346 1HG MET 50 2HG MET 50 -0.302 -18.268 -9.300
347 2HG MET 50 1HG MET 50 -1.775 -17.774 -8.467
348 1HE MET 50 1HE MET 50 0.586 -19.647 -7.275
349 2HE MET 50 2HE MET 50 -0.371 -20.837 -6.392
350 3HE MET 50 3HE MET 50 -0.811 -19.132 -6.328
351 H PHE 51 H PHE 51 -1.291 -15.669 -9.166
352 HA PHE 51 HA PHE 51 -3.864 -14.336 -8.709
353 1HB PHE 51 2HB PHE 51 -1.896 -15.602 -6.852
354 2HB PHE 51 1HB PHE 51 -2.723 -14.155 -6.281
355 HD1 PHE 51 1HD PHE 51 -3.668 -17.260 -8.149
356 HD2 PHE 51 2HD PHE 51 -4.552 -14.579 -4.960
357 HE1 PHE 51 1HE PHE 51 -5.635 -18.613 -7.557
358 HE2 PHE 51 2HE PHE 51 -6.514 -15.933 -4.364
359 HZ PHE 51 HZ PHE 51 -7.060 -17.950 -5.665
360 H THR 52 H THR 52 -3.461 -12.055 -7.655
361 HA THR 52 HA THR 52 -1.043 -10.767 -8.425
362 HB THR 52 HB THR 52 -1.973 -11.356 -10.675
363 HG1 THR 52 1HG THR 52 -0.575 -9.627 -10.648
364 1HG2 THR 52 1HG2 THR 52 -4.099 -9.337 -9.944
365 2HG2 THR 52 2HG2 THR 52 -4.351 -11.069 -10.164
366 3HG2 THR 52 3HG2 THR 52 -3.864 -10.067 -11.531
367 H VAL 53 H VAL 53 -1.379 -8.314 -8.611
368 HA VAL 53 HA VAL 53 -3.040 -7.551 -6.314
369 HB VAL 53 HB VAL 53 -0.646 -7.198 -6.027
370 1HG1 VAL 53 1HG1 VAL 53 0.602 -5.624 -7.415
371 2HG1 VAL 53 2HG1 VAL 53 -0.814 -5.405 -8.444
372 3HG1 VAL 53 3HG1 VAL 53 -0.015 -6.976 -8.369
373 1HG2 VAL 53 1HG2 VAL 53 -2.163 -5.591 -4.971
374 2HG2 VAL 53 2HG2 VAL 53 -2.073 -4.567 -6.402
375 3HG2 VAL 53 3HG2 VAL 53 -0.634 -4.837 -5.422
376 H GLU 54 H GLU 54 -4.537 -5.977 -6.438
377 HA GLU 54 HA GLU 54 -4.820 -4.460 -8.950
378 1HB GLU 54 2HB GLU 54 -7.121 -3.966 -8.185
379 2HB GLU 54 1HB GLU 54 -6.846 -5.698 -8.330
380 1HG GLU 54 2HG GLU 54 -7.120 -6.059 -6.135
381 2HG GLU 54 1HG GLU 54 -6.283 -4.578 -5.682
382 H ASN 55 H ASN 55 -4.848 -2.217 -8.867
383 HA ASN 55 HA ASN 55 -4.233 -1.060 -6.232
384 1HB ASN 55 2HB ASN 55 -2.794 0.590 -7.326
385 2HB ASN 55 1HB ASN 55 -2.199 -1.051 -7.545
386 1HD2 ASN 55 1HD2 ASN 55 -1.630 1.326 -9.109
387 2HD2 ASN 55 2HD2 ASN 55 -2.117 0.976 -10.728
388 H LYS 56 H LYS 56 -5.287 0.690 -5.621
389 HA LYS 56 HA LYS 56 -6.907 2.201 -7.489
390 1HB LYS 56 2HB LYS 56 -8.773 1.716 -5.551
391 2HB LYS 56 1HB LYS 56 -8.733 0.939 -7.131
392 1HG LYS 56 2HG LYS 56 -8.693 -0.981 -6.014
393 2HG LYS 56 1HG LYS 56 -7.027 -0.586 -5.581
394 1HD LYS 56 2HD LYS 56 -7.545 -0.105 -3.463
395 2HD LYS 56 1HD LYS 56 -9.065 0.692 -3.910
396 1HE LYS 56 2HE LYS 56 -8.502 -2.210 -3.487
397 2HE LYS 56 1HE LYS 56 -9.722 -1.201 -2.717
398 1HZ LYS 56 1HZ LYS 56 -10.732 -1.008 -5.022
399 2HZ LYS 56 2HZ LYS 56 -10.887 -2.505 -4.247
400 3HZ LYS 56 3HZ LYS 56 -9.726 -2.301 -5.470
401 H TYR 57 H TYR 57 -6.442 4.198 -6.981
402 HA TYR 57 HA TYR 57 -6.097 4.884 -4.150
403 1HB TYR 57 2HB TYR 57 -4.470 6.664 -5.433
404 2HB TYR 57 1HB TYR 57 -3.939 5.173 -4.657
405 HD1 TYR 57 1HD TYR 57 -4.861 6.679 -7.908
406 HD2 TYR 57 2HD TYR 57 -3.065 3.380 -5.907
407 HE1 TYR 57 1HE TYR 57 -4.017 5.843 -10.062
408 HE2 TYR 57 2HE TYR 57 -2.215 2.538 -8.058
409 HH TYR 57 HH TYR 57 -2.235 4.395 -10.907
410 H PHE 58 H PHE 58 -7.260 6.481 -3.434
411 HA PHE 58 HA PHE 58 -8.504 8.319 -5.354
412 1HB PHE 58 2HB PHE 58 -9.761 6.999 -2.941
413 2HB PHE 58 1HB PHE 58 -10.521 8.283 -3.883
414 HD1 PHE 58 1HD PHE 58 -9.952 4.765 -3.600
415 HD2 PHE 58 2HD PHE 58 -10.967 7.858 -6.343
416 HE1 PHE 58 1HE PHE 58 -10.854 3.085 -5.155
417 HE2 PHE 58 2HE PHE 58 -11.871 6.184 -7.904
418 HZ PHE 58 HZ PHE 58 -11.813 3.795 -7.309
419 HA PRO 59 HA PRO 59 -6.819 11.194 -2.300
420 1HB PRO 59 2HB PRO 59 -6.126 12.993 -4.354
421 2HB PRO 59 1HB PRO 59 -5.046 11.852 -3.554
422 1HG PRO 59 2HG PRO 59 -5.841 11.779 -6.247
423 2HG PRO 59 1HG PRO 59 -5.019 10.488 -5.355
424 1HD PRO 59 2HD PRO 59 -7.920 10.811 -5.986
425 2HD PRO 59 1HD PRO 59 -6.946 9.329 -5.869
426 HA PRO 60 HA PRO 60 -10.894 13.231 -2.679
427 1HB PRO 60 2HB PRO 60 -10.360 13.752 0.144
428 2HB PRO 60 1HB PRO 60 -11.708 12.883 -0.595
429 1HG PRO 60 2HG PRO 60 -9.872 11.572 0.799
430 2HG PRO 60 1HG PRO 60 -10.532 10.879 -0.700
431 1HD PRO 60 2HD PRO 60 -7.955 12.376 -0.289
432 2HD PRO 60 1HD PRO 60 -8.228 10.827 -1.127
433 H ASP 61 H ASP 61 -7.879 14.402 -1.501
434 HA ASP 61 HA ASP 61 -8.681 17.167 -1.883
435 1HB ASP 61 2HB ASP 61 -9.167 16.366 0.544
436 2HB ASP 61 1HB ASP 61 -7.419 16.348 0.729
437 H SER 62 H SER 62 -6.525 18.446 -0.983
438 HA SER 62 HA SER 62 -4.122 17.018 -1.699
439 1HB SER 62 2HB SER 62 -4.998 17.646 -3.906
440 2HB SER 62 1HB SER 62 -5.059 19.336 -3.408
441 HG SER 62 HG SER 62 -2.664 18.868 -2.941
442 H LYS 63 H LYS 63 -5.528 19.186 0.283
443 HA LYS 63 HA LYS 63 -2.916 20.356 0.892
444 1HB LYS 63 2HB LYS 63 -3.771 22.543 1.259
445 2HB LYS 63 1HB LYS 63 -4.321 22.039 -0.329
446 1HG LYS 63 2HG LYS 63 -6.034 21.860 2.134
447 2HG LYS 63 1HG LYS 63 -5.982 23.282 1.095
448 1HD LYS 63 2HD LYS 63 -6.640 21.787 -0.815
449 2HD LYS 63 1HD LYS 63 -6.896 20.492 0.371
450 1HE LYS 63 2HE LYS 63 -8.489 22.009 1.554
451 2HE LYS 63 1HE LYS 63 -8.314 23.159 0.231
452 1HZ LYS 63 1HZ LYS 63 -9.148 21.440 -1.287
453 2HZ LYS 63 2HZ LYS 63 -10.275 21.811 -0.075
454 3HZ LYS 63 3HZ LYS 63 -9.361 20.384 0.023
455 H LEU 64 H LEU 64 -5.722 18.798 1.896
456 HA LEU 64 HA LEU 64 -4.788 18.887 4.664
457 1HB LEU 64 2HB LEU 64 -6.593 20.563 4.423
458 2HB LEU 64 1HB LEU 64 -7.662 19.300 3.844
459 HG LEU 64 HG LEU 64 -7.437 18.161 6.048
460 1HD1 LEU 64 1HD1 LEU 64 -5.973 20.687 6.807
461 2HD1 LEU 64 2HD1 LEU 64 -5.284 19.065 6.724
462 3HD1 LEU 64 3HD1 LEU 64 -6.518 19.438 7.927
463 1HD2 LEU 64 1HD2 LEU 64 -8.427 21.009 6.146
464 2HD2 LEU 64 2HD2 LEU 64 -8.889 19.713 7.248
465 3HD2 LEU 64 3HD2 LEU 64 -9.333 19.624 5.544
466 H LEU 65 H LEU 65 -7.730 17.622 3.206
467 HA LEU 65 HA LEU 65 -7.164 14.986 2.785
468 1HB LEU 65 2HB LEU 65 -6.452 15.011 5.225
469 2HB LEU 65 1HB LEU 65 -8.130 15.314 5.629
470 HG LEU 65 HG LEU 65 -8.651 13.136 4.367
471 1HD1 LEU 65 1HD1 LEU 65 -6.831 11.525 4.268
472 2HD1 LEU 65 2HD1 LEU 65 -5.691 12.776 4.772
473 3HD1 LEU 65 3HD1 LEU 65 -6.525 12.913 3.223
474 1HD2 LEU 65 1HD2 LEU 65 -8.778 13.368 6.797
475 2HD2 LEU 65 2HD2 LEU 65 -7.048 13.048 6.923
476 3HD2 LEU 65 3HD2 LEU 65 -8.138 11.788 6.343
477 H GLY 66 H GLY 66 -8.896 14.342 1.701
478 1HA GLY 66 2HA GLY 66 -11.409 15.740 1.931
479 2HA GLY 66 1HA GLY 66 -11.026 14.446 0.822
480 H ALA 67 H ALA 67 -11.095 14.716 4.359
481 HA ALA 67 HA ALA 67 -12.050 13.456 5.986
482 1HB ALA 67 1HB ALA 67 -14.096 12.235 5.580
483 2HB ALA 67 2HB ALA 67 -13.849 12.348 3.837
484 3HB ALA 67 3HB ALA 67 -14.170 13.805 4.779
485 H GLY 68 H GLY 68 -12.291 11.272 3.186
486 1HA GLY 68 2HA GLY 68 -10.573 9.398 4.688
487 2HA GLY 68 1HA GLY 68 -11.950 8.879 3.730
488 H GLY 69 H GLY 69 -8.883 10.667 3.405
489 1HA GLY 69 2HA GLY 69 -8.407 10.159 0.703
490 2HA GLY 69 1HA GLY 69 -7.153 10.332 1.929
491 H THR 70 H THR 70 -7.670 8.337 -0.418
492 HA THR 70 HA THR 70 -7.135 5.951 1.121
493 HB THR 70 HB THR 70 -9.177 4.935 -0.318
494 HG1 THR 70 1HG THR 70 -10.099 7.486 0.563
495 1HG2 THR 70 1HG2 THR 70 -9.452 6.248 2.397
496 2HG2 THR 70 2HG2 THR 70 -8.668 4.693 2.120
497 3HG2 THR 70 3HG2 THR 70 -10.393 4.883 1.783
498 H GLU 71 H GLU 71 -5.244 5.834 -0.043
499 HA GLU 71 HA GLU 71 -5.529 5.008 -2.860
500 1HB GLU 71 2HB GLU 71 -3.040 5.917 -1.385
501 2HB GLU 71 1HB GLU 71 -3.150 5.533 -3.098
502 1HG GLU 71 2HG GLU 71 -4.756 7.401 -3.363
503 2HG GLU 71 1HG GLU 71 -4.484 7.826 -1.674
504 H HIS 72 H HIS 72 -5.730 2.779 -2.905
505 HA HIS 72 HA HIS 72 -4.213 1.347 -0.822
506 1HB HIS 72 2HB HIS 72 -6.512 -0.046 -2.084
507 2HB HIS 72 1HB HIS 72 -5.825 -0.183 -0.479
508 HD1 HIS 72 1HD HIS 72 -8.338 -0.265 0.272
509 HD2 HIS 72 2HD HIS 72 -7.032 3.379 -1.196
510 HE1 HIS 72 1HE HIS 72 -10.030 1.396 1.020
511 HE2 HIS 72 2HE HIS 72 -9.403 3.511 -0.176
512 H PHE 73 H PHE 73 -3.526 -0.751 -1.241
513 HA PHE 73 HA PHE 73 -3.180 -1.540 -4.051
514 1HB PHE 73 2HB PHE 73 -1.169 -1.306 -1.830
515 2HB PHE 73 1HB PHE 73 -0.895 -2.427 -3.161
516 HD1 PHE 73 1HD PHE 73 -0.123 -1.648 -5.248
517 HD2 PHE 73 2HD PHE 73 -1.445 1.126 -2.307
518 HE1 PHE 73 1HE PHE 73 0.760 0.205 -6.603
519 HE2 PHE 73 2HE PHE 73 -0.562 2.983 -3.656
520 HZ PHE 73 HZ PHE 73 0.541 2.523 -5.808
521 H HIS 74 H HIS 74 -4.313 -3.411 -4.239
522 HA HIS 74 HA HIS 74 -4.543 -5.119 -1.844
523 1HB HIS 74 2HB HIS 74 -6.390 -4.631 -4.166
524 2HB HIS 74 1HB HIS 74 -6.585 -6.024 -3.113
525 HD1 HIS 74 1HD HIS 74 -8.955 -4.888 -2.665
526 HD2 HIS 74 2HD HIS 74 -5.649 -2.878 -1.132
527 HE1 HIS 74 1HE HIS 74 -9.847 -3.334 -0.918
528 HE2 HIS 74 2HE HIS 74 -7.794 -2.465 0.245
529 H VAL 75 H VAL 75 -3.100 -6.822 -1.992
530 HA VAL 75 HA VAL 75 -2.772 -7.984 -4.664
531 HB VAL 75 HB VAL 75 -0.578 -7.691 -4.197
532 1HG1 VAL 75 1HG1 VAL 75 0.426 -7.475 -2.013
533 2HG1 VAL 75 2HG1 VAL 75 -1.104 -7.913 -1.242
534 3HG1 VAL 75 3HG1 VAL 75 -0.975 -6.411 -2.161
535 1HG2 VAL 75 1HG2 VAL 75 -1.029 -10.116 -2.465
536 2HG2 VAL 75 2HG2 VAL 75 0.497 -9.622 -3.199
537 3HG2 VAL 75 3HG2 VAL 75 -0.853 -10.120 -4.222
538 H THR 76 H THR 76 -3.772 -9.751 -5.086
539 HA THR 76 HA THR 76 -4.681 -11.459 -2.879
540 HB THR 76 HB THR 76 -5.549 -11.669 -5.766
541 HG1 THR 76 1HG THR 76 -6.198 -9.630 -5.274
542 1HG2 THR 76 1HG2 THR 76 -7.537 -12.707 -4.786
543 2HG2 THR 76 2HG2 THR 76 -6.880 -12.454 -3.169
544 3HG2 THR 76 3HG2 THR 76 -6.072 -13.554 -4.287
545 H VAL 77 H VAL 77 -3.125 -12.898 -2.473
546 HA VAL 77 HA VAL 77 -2.221 -14.643 -4.636
547 HB VAL 77 HB VAL 77 -0.465 -12.952 -4.556
548 1HG1 VAL 77 1HG1 VAL 77 -0.232 -13.607 -1.622
549 2HG1 VAL 77 2HG1 VAL 77 -0.852 -12.104 -2.305
550 3HG1 VAL 77 3HG1 VAL 77 0.842 -12.543 -2.531
551 1HG2 VAL 77 1HG2 VAL 77 1.470 -14.355 -4.079
552 2HG2 VAL 77 2HG2 VAL 77 0.224 -15.285 -4.914
553 3HG2 VAL 77 3HG2 VAL 77 0.455 -15.477 -3.173
554 H LYS 78 H LYS 78 -1.710 -16.746 -3.916
555 HA LYS 78 HA LYS 78 -1.386 -17.044 -1.044
556 1HB LYS 78 2HB LYS 78 -2.754 -18.906 -0.807
557 2HB LYS 78 1HB LYS 78 -3.703 -17.796 -1.768
558 1HG LYS 78 2HG LYS 78 -2.147 -20.092 -2.935
559 2HG LYS 78 1HG LYS 78 -3.835 -20.199 -2.442
560 1HD LYS 78 2HD LYS 78 -4.463 -18.543 -4.073
561 2HD LYS 78 1HD LYS 78 -2.772 -18.249 -4.487
562 1HE LYS 78 2HE LYS 78 -3.869 -19.676 -6.144
563 2HE LYS 78 1HE LYS 78 -2.557 -20.518 -5.323
564 1HZ LYS 78 1HZ LYS 78 -4.276 -21.527 -3.864
565 2HZ LYS 78 2HZ LYS 78 -4.390 -21.985 -5.490
566 3HZ LYS 78 3HZ LYS 78 -5.472 -20.843 -4.854
567 H ALA 79 H ALA 79 0.700 -17.394 -0.932
568 HA ALA 79 HA ALA 79 1.801 -19.853 -1.766
569 1HB ALA 79 1HB ALA 79 3.548 -19.030 -3.273
570 2HB ALA 79 2HB ALA 79 2.851 -17.410 -3.198
571 3HB ALA 79 3HB ALA 79 1.943 -18.728 -3.939
572 H ALA 80 H ALA 80 3.293 -20.379 -0.293
573 HA ALA 80 HA ALA 80 3.851 -18.810 1.914
574 1HB ALA 80 1HB ALA 80 5.508 -20.467 2.514
575 2HB ALA 80 2HB ALA 80 5.534 -21.077 0.859
576 3HB ALA 80 3HB ALA 80 4.081 -21.256 1.842
577 H GLY 81 H GLY 81 4.686 -16.825 1.670
578 1HA GLY 81 2HA GLY 81 7.502 -16.603 1.056
579 2HA GLY 81 1HA GLY 81 6.451 -15.800 -0.103
580 H THR 82 H THR 82 8.248 -14.301 1.350
581 HA THR 82 HA THR 82 6.555 -13.052 3.404
582 HB THR 82 HB THR 82 9.343 -12.108 2.939
583 HG1 THR 82 1HG THR 82 9.777 -14.275 2.967
584 1HG2 THR 82 1HG2 THR 82 9.251 -11.961 5.420
585 2HG2 THR 82 2HG2 THR 82 7.610 -12.616 5.364
586 3HG2 THR 82 3HG2 THR 82 7.963 -11.052 4.630
587 H HIS 83 H HIS 83 5.664 -11.121 3.056
588 HA HIS 83 HA HIS 83 6.138 -9.882 0.437
589 1HB HIS 83 2HB HIS 83 3.785 -10.724 1.131
590 2HB HIS 83 1HB HIS 83 3.786 -9.377 2.260
591 HD1 HIS 83 1HD HIS 83 5.268 -7.416 0.109
592 HD2 HIS 83 2HD HIS 83 1.736 -9.554 -0.402
593 HE1 HIS 83 1HE HIS 83 3.954 -6.151 -1.624
594 HE2 HIS 83 2HE HIS 83 1.772 -7.392 -1.819
595 H ALA 84 H ALA 84 7.651 -8.324 0.697
596 HA ALA 84 HA ALA 84 7.392 -6.509 2.995
597 1HB ALA 84 1HB ALA 84 9.634 -6.812 0.988
598 2HB ALA 84 2HB ALA 84 9.624 -7.440 2.638
599 3HB ALA 84 3HB ALA 84 9.626 -5.698 2.357
600 H VAL 85 H VAL 85 6.153 -4.804 2.631
601 HA VAL 85 HA VAL 85 5.676 -4.080 -0.186
602 HB VAL 85 HB VAL 85 3.938 -3.135 2.044
603 1HG1 VAL 85 1HG1 VAL 85 2.204 -3.256 0.338
604 2HG1 VAL 85 2HG1 VAL 85 3.362 -3.944 -0.799
605 3HG1 VAL 85 3HG1 VAL 85 3.574 -2.295 -0.215
606 1HG2 VAL 85 1HG2 VAL 85 3.783 -5.892 0.837
607 2HG2 VAL 85 2HG2 VAL 85 2.592 -5.171 1.921
608 3HG2 VAL 85 3HG2 VAL 85 4.225 -5.506 2.502
609 H ASN 86 H ASN 86 7.042 -2.514 -0.706
610 HA ASN 86 HA ASN 86 7.241 -0.183 1.085
611 1HB ASN 86 2HB ASN 86 9.107 -1.156 -1.095
612 2HB ASN 86 1HB ASN 86 9.265 0.405 -0.305
613 1HD2 ASN 86 1HD2 ASN 86 8.365 -2.610 1.273
614 2HD2 ASN 86 2HD2 ASN 86 9.789 -2.733 2.242
615 H LEU 87 H LEU 87 5.689 1.156 0.507
616 HA LEU 87 HA LEU 87 5.162 1.581 -2.352
617 1HB LEU 87 2HB LEU 87 3.476 2.197 0.075
618 2HB LEU 87 1HB LEU 87 3.033 2.611 -1.572
619 HG LEU 87 HG LEU 87 3.471 -0.202 -0.568
620 1HD1 LEU 87 1HD1 LEU 87 1.041 -0.427 -0.766
621 2HD1 LEU 87 2HD1 LEU 87 0.921 1.296 -1.123
622 3HD1 LEU 87 3HD1 LEU 87 1.503 0.759 0.455
623 1HD2 LEU 87 1HD2 LEU 87 3.948 0.062 -2.921
624 2HD2 LEU 87 2HD2 LEU 87 2.376 0.824 -3.167
625 3HD2 LEU 87 3HD2 LEU 87 2.472 -0.867 -2.670
626 H THR 88 H THR 88 5.639 3.490 -3.248
627 HA THR 88 HA THR 88 7.100 5.325 -1.493
628 HB THR 88 HB THR 88 7.301 5.208 -4.504
629 HG1 THR 88 1HG THR 88 7.837 3.161 -3.927
630 1HG2 THR 88 1HG2 THR 88 9.494 6.157 -4.118
631 2HG2 THR 88 2HG2 THR 88 9.310 5.974 -2.374
632 3HG2 THR 88 3HG2 THR 88 8.306 7.131 -3.249
633 H TYR 89 H TYR 89 6.361 7.247 -1.119
634 HA TYR 89 HA TYR 89 3.883 8.132 -2.386
635 1HB TYR 89 2HB TYR 89 4.287 7.924 0.146
636 2HB TYR 89 1HB TYR 89 5.311 9.342 -0.009
637 HD1 TYR 89 1HD TYR 89 2.668 9.594 -2.302
638 HD2 TYR 89 2HD TYR 89 3.565 10.020 1.823
639 HE1 TYR 89 1HE TYR 89 0.695 11.021 -2.029
640 HE2 TYR 89 2HE TYR 89 1.590 11.455 2.110
641 HH TYR 89 HH TYR 89 -0.056 12.581 1.046
642 H MET 90 H MET 90 4.664 8.993 -4.363
643 HA MET 90 HA MET 90 6.388 11.384 -4.114
644 1HB MET 90 2HB MET 90 6.752 9.832 -6.583
645 2HB MET 90 1HB MET 90 7.925 10.718 -5.626
646 1HG MET 90 2HG MET 90 8.240 8.924 -4.153
647 2HG MET 90 1HG MET 90 6.842 8.056 -4.795
648 1HE MET 90 1HE MET 90 7.238 8.700 -7.938
649 2HE MET 90 2HE MET 90 6.732 7.125 -7.326
650 3HE MET 90 3HE MET 90 8.083 7.239 -8.452
651 H ARG 91 H ARG 91 6.335 12.739 -6.005
652 HA ARG 91 HA ARG 91 3.805 13.113 -7.192
653 1HB ARG 91 2HB ARG 91 6.561 14.218 -7.548
654 2HB ARG 91 1HB ARG 91 5.408 14.461 -8.861
655 1HG ARG 91 2HG ARG 91 3.868 15.549 -7.330
656 2HG ARG 91 1HG ARG 91 4.959 15.234 -5.985
657 1HD ARG 91 2HD ARG 91 6.655 16.653 -7.035
658 2HD ARG 91 1HD ARG 91 5.554 16.967 -8.377
659 HE ARG 91 HE ARG 91 4.123 17.722 -6.201
660 1HH1 ARG 91 1HH1 ARG 91 7.276 18.592 -7.456
661 2HH1 ARG 91 2HH1 ARG 91 7.273 20.164 -6.705
662 1HH2 ARG 91 1HH2 ARG 91 4.103 19.770 -5.227
663 2HH2 ARG 91 2HH2 ARG 91 5.465 20.836 -5.427
664 HA PRO 92 HA PRO 92 4.043 9.428 -9.650
665 1HB PRO 92 2HB PRO 92 1.964 10.190 -11.378
666 2HB PRO 92 1HB PRO 92 1.803 9.266 -9.882
667 1HG PRO 92 2HG PRO 92 1.390 12.173 -10.374
668 2HG PRO 92 1HG PRO 92 0.526 11.082 -9.274
669 1HD PRO 92 2HD PRO 92 2.323 12.847 -8.369
670 2HD PRO 92 1HD PRO 92 2.168 11.234 -7.643
671 H TRP 93 H TRP 93 4.182 12.630 -11.103
672 HA TRP 93 HA TRP 93 5.034 11.519 -13.648
673 1HB TRP 93 2HB TRP 93 5.100 13.891 -14.397
674 2HB TRP 93 1HB TRP 93 3.532 13.391 -13.775
675 HD1 TRP 93 HD TRP 93 6.362 15.825 -13.130
676 HE1 TRP 93 1HE TRP 93 5.681 17.448 -11.245
677 HE3 TRP 93 3HE TRP 93 2.077 13.511 -11.594
678 HZ2 TRP 93 2HZ TRP 93 3.588 17.704 -9.362
679 HZ3 TRP 93 3HZ TRP 93 0.790 14.506 -9.751
680 HH2 TRP 93 HH TRP 93 1.527 16.561 -8.658
681 H THR 94 H THR 94 6.567 12.159 -10.788
682 HA THR 94 HA THR 94 9.126 11.835 -11.934
683 HB THR 94 HB THR 94 9.011 14.154 -12.544
684 HG1 THR 94 1HG THR 94 10.721 14.905 -10.827
685 1HG2 THR 94 1HG2 THR 94 7.306 14.927 -10.971
686 2HG2 THR 94 2HG2 THR 94 8.732 15.963 -10.929
687 3HG2 THR 94 3HG2 THR 94 8.461 14.786 -9.645
688 H GLY 95 H GLY 95 7.859 13.505 -9.007
689 1HA GLY 95 2HA GLY 95 7.961 12.850 -6.779
690 2HA GLY 95 1HA GLY 95 8.615 11.301 -7.322
691 HA PRO 96 HA PRO 96 12.042 14.866 -6.577
692 1HB PRO 96 2HB PRO 96 10.875 15.246 -3.862
693 2HB PRO 96 1HB PRO 96 11.690 16.404 -4.907
694 1HG PRO 96 2HG PRO 96 9.051 16.463 -4.629
695 2HG PRO 96 1HG PRO 96 9.818 16.791 -6.194
696 1HD PRO 96 2HD PRO 96 8.366 14.370 -5.266
697 2HD PRO 96 1HD PRO 96 8.464 15.080 -6.890
698 H SER 97 H SER 97 13.849 13.840 -6.019
699 HA SER 97 HA SER 97 13.778 11.173 -5.324
700 1HB SER 97 2HB SER 97 16.150 13.027 -5.088
701 2HB SER 97 1HB SER 97 16.198 11.271 -5.273
702 HG SER 97 HG SER 97 16.430 12.718 -7.228
703 H HIS 98 H HIS 98 14.088 13.926 -3.140
704 HA HIS 98 HA HIS 98 14.199 11.954 -0.957
705 1HB HIS 98 2HB HIS 98 15.715 13.299 0.338
706 2HB HIS 98 1HB HIS 98 16.432 13.009 -1.241
707 HD1 HIS 98 1HD HIS 98 15.209 15.702 1.002
708 HD2 HIS 98 2HD HIS 98 16.669 15.314 -2.873
709 HE1 HIS 98 1HE HIS 98 15.727 18.041 0.236
710 HE2 HIS 98 2HE HIS 98 16.452 17.796 -2.166
711 H ASP 99 H ASP 99 12.102 13.823 -2.313
712 HA ASP 99 HA ASP 99 11.192 15.047 0.221
713 1HB ASP 99 2HB ASP 99 11.625 16.528 -1.851
714 2HB ASP 99 1HB ASP 99 10.147 15.816 -2.496
715 H SER 100 H SER 100 10.833 12.467 -1.667
716 HA SER 100 HA SER 100 7.943 12.191 -1.420
717 1HB SER 100 2HB SER 100 9.984 10.344 -2.682
718 2HB SER 100 1HB SER 100 8.230 10.237 -2.838
719 HG SER 100 HG SER 100 10.010 12.133 -3.929
720 H GLU 101 H GLU 101 6.988 10.786 -0.014
721 HA GLU 101 HA GLU 101 8.678 9.654 2.081
722 1HB GLU 101 2HB GLU 101 6.461 10.910 2.497
723 2HB GLU 101 1HB GLU 101 5.665 9.453 1.917
724 1HG GLU 101 2HG GLU 101 6.899 8.190 3.701
725 2HG GLU 101 1HG GLU 101 7.423 9.744 4.340
726 H ARG 102 H ARG 102 7.752 7.346 2.849
727 HA ARG 102 HA ARG 102 6.732 5.719 0.717
728 1HB ARG 102 2HB ARG 102 9.304 5.862 0.374
729 2HB ARG 102 1HB ARG 102 9.414 4.860 1.816
730 1HG ARG 102 2HG ARG 102 8.048 3.151 0.736
731 2HG ARG 102 1HG ARG 102 7.932 4.153 -0.706
732 1HD ARG 102 2HD ARG 102 10.495 4.070 -0.738
733 2HD ARG 102 1HD ARG 102 10.332 2.734 0.406
734 HE ARG 102 HE ARG 102 8.675 2.353 -1.888
735 1HH1 ARG 102 1HH1 ARG 102 12.000 2.040 -0.781
736 2HH1 ARG 102 2HH1 ARG 102 12.407 0.881 -2.011
737 1HH2 ARG 102 1HH2 ARG 102 9.227 0.823 -3.466
738 2HH2 ARG 102 2HH2 ARG 102 10.846 0.190 -3.529
739 H PHE 103 H PHE 103 5.907 3.881 1.372
740 HA PHE 103 HA PHE 103 5.583 3.528 4.259
741 1HB PHE 103 2HB PHE 103 3.438 3.728 3.447
742 2HB PHE 103 1HB PHE 103 3.875 3.136 1.848
743 HD1 PHE 103 1HD PHE 103 2.796 2.239 5.195
744 HD2 PHE 103 2HD PHE 103 3.917 0.783 1.366
745 HE1 PHE 103 1HE PHE 103 1.900 0.031 5.775
746 HE2 PHE 103 2HE PHE 103 3.019 -1.426 1.934
747 HZ PHE 103 HZ PHE 103 2.014 -1.802 4.142
748 H THR 104 H THR 104 5.717 1.371 5.135
749 HA THR 104 HA THR 104 6.713 -0.719 3.407
750 HB THR 104 HB THR 104 8.426 0.368 5.661
751 HG1 THR 104 1HG THR 104 8.843 1.641 3.937
752 1HG2 THR 104 1HG2 THR 104 10.061 -1.338 4.913
753 2HG2 THR 104 2HG2 THR 104 8.827 -1.998 3.837
754 3HG2 THR 104 3HG2 THR 104 8.584 -2.032 5.583
755 H VAL 105 H VAL 105 5.000 -2.057 4.094
756 HA VAL 105 HA VAL 105 5.236 -2.819 6.920
757 HB VAL 105 HB VAL 105 2.922 -2.415 6.104
758 1HG1 VAL 105 1HG1 VAL 105 1.875 -4.062 4.632
759 2HG1 VAL 105 2HG1 VAL 105 3.445 -4.826 4.382
760 3HG1 VAL 105 3HG1 VAL 105 3.167 -3.177 3.822
761 1HG2 VAL 105 1HG2 VAL 105 1.944 -4.378 7.109
762 2HG2 VAL 105 2HG2 VAL 105 3.406 -3.943 7.987
763 3HG2 VAL 105 3HG2 VAL 105 3.431 -5.292 6.856
764 H TYR 106 H TYR 106 6.044 -4.696 7.504
765 HA TYR 106 HA TYR 106 7.008 -6.506 5.406
766 1HB TYR 106 2HB TYR 106 7.830 -6.167 8.291
767 2HB TYR 106 1HB TYR 106 8.402 -7.462 7.259
768 HD1 TYR 106 1HD TYR 106 9.602 -6.728 5.065
769 HD2 TYR 106 2HD TYR 106 9.027 -4.187 8.426
770 HE1 TYR 106 1HE TYR 106 11.465 -5.313 4.304
771 HE2 TYR 106 2HE TYR 106 10.886 -2.764 7.676
772 HH TYR 106 HH TYR 106 12.278 -3.025 4.570
773 H LEU 107 H LEU 107 5.448 -7.945 5.023
774 HA LEU 107 HA LEU 107 4.223 -9.260 7.349
775 1HB LEU 107 2HB LEU 107 2.101 -9.285 6.250
776 2HB LEU 107 1HB LEU 107 2.692 -7.640 6.252
777 HG LEU 107 HG LEU 107 3.588 -8.452 3.833
778 1HD1 LEU 107 1HD1 LEU 107 2.552 -10.651 4.021
779 2HD1 LEU 107 2HD1 LEU 107 1.819 -9.707 2.723
780 3HD1 LEU 107 3HD1 LEU 107 0.978 -9.895 4.262
781 1HD2 LEU 107 1HD2 LEU 107 1.676 -7.259 2.904
782 2HD2 LEU 107 2HD2 LEU 107 2.342 -6.422 4.306
783 3HD2 LEU 107 3HD2 LEU 107 0.855 -7.359 4.460
784 H LYS 108 H LYS 108 3.658 -11.484 7.020
785 HA LYS 108 HA LYS 108 5.208 -12.705 4.841
786 1HB LYS 108 2HB LYS 108 5.735 -13.360 7.206
787 2HB LYS 108 1HB LYS 108 4.118 -14.028 7.317
788 1HG LYS 108 2HG LYS 108 5.191 -15.923 6.739
789 2HG LYS 108 1HG LYS 108 4.908 -15.277 5.117
790 1HD LYS 108 2HD LYS 108 7.136 -14.291 5.118
791 2HD LYS 108 1HD LYS 108 7.423 -14.925 6.741
792 1HE LYS 108 2HE LYS 108 7.138 -17.212 5.877
793 2HE LYS 108 1HE LYS 108 6.890 -16.559 4.258
794 1HZ LYS 108 1HZ LYS 108 9.367 -16.380 5.888
795 2HZ LYS 108 2HZ LYS 108 9.136 -15.578 4.413
796 3HZ LYS 108 3HZ LYS 108 9.143 -17.273 4.462
797 H ALA 109 H ALA 109 4.016 -13.296 3.120
798 HA ALA 109 HA ALA 109 1.158 -13.814 3.543
799 1HB ALA 109 1HB ALA 109 0.835 -13.233 1.190
800 2HB ALA 109 2HB ALA 109 2.575 -13.014 1.001
801 3HB ALA 109 3HB ALA 109 1.661 -11.929 2.047
802 H ASN 110 H ASN 110 0.385 -15.830 3.205
803 HA ASN 110 HA ASN 110 2.075 -17.734 1.748
804 1HB ASN 110 2HB ASN 110 1.075 -18.385 4.530
805 2HB ASN 110 1HB ASN 110 2.168 -19.334 3.532
806 1HD2 ASN 110 1HD2 ASN 110 1.841 -16.622 5.642
807 2HD2 ASN 110 2HD2 ASN 110 3.527 -16.327 5.858
Start of MODEL 2
1 H HIS 3 H HIS 3 -6.452 -10.046 4.229
2 HA HIS 3 HA HIS 3 -5.671 -9.083 6.853
3 1HB HIS 3 2HB HIS 3 -3.816 -10.602 6.511
4 2HB HIS 3 1HB HIS 3 -3.707 -10.133 4.806
5 HD1 HIS 3 1HD HIS 3 -3.427 -8.340 8.159
6 HD2 HIS 3 2HD HIS 3 -1.661 -8.445 4.382
7 HE1 HIS 3 1HE HIS 3 -1.683 -6.525 8.176
8 HE2 HIS 3 2HE HIS 3 -0.770 -6.479 5.830
9 H LYS 4 H LYS 4 -5.202 -6.890 6.842
10 HA LYS 4 HA LYS 4 -4.838 -5.565 4.262
11 1HB LYS 4 2HB LYS 4 -6.533 -3.882 4.757
12 2HB LYS 4 1HB LYS 4 -7.244 -5.489 4.696
13 1HG LYS 4 2HG LYS 4 -7.153 -5.542 7.188
14 2HG LYS 4 1HG LYS 4 -6.640 -3.851 7.147
15 1HD LYS 4 2HD LYS 4 -9.223 -4.976 6.060
16 2HD LYS 4 1HD LYS 4 -9.034 -3.987 7.510
17 1HE LYS 4 2HE LYS 4 -8.318 -2.105 6.197
18 2HE LYS 4 1HE LYS 4 -8.299 -3.082 4.730
19 1HZ LYS 4 1HZ LYS 4 -10.692 -2.350 6.328
20 2HZ LYS 4 2HZ LYS 4 -10.706 -3.375 4.979
21 3HZ LYS 4 3HZ LYS 4 -10.276 -1.744 4.801
22 H VAL 5 H VAL 5 -3.537 -3.755 4.347
23 HA VAL 5 HA VAL 5 -2.512 -3.066 7.017
24 HB VAL 5 HB VAL 5 -1.148 -3.180 4.371
25 1HG1 VAL 5 1HG1 VAL 5 -0.943 -0.819 4.765
26 2HG1 VAL 5 2HG1 VAL 5 0.598 -1.601 5.140
27 3HG1 VAL 5 3HG1 VAL 5 -0.484 -1.102 6.443
28 1HG2 VAL 5 1HG2 VAL 5 0.689 -3.926 5.752
29 2HG2 VAL 5 2HG2 VAL 5 -0.778 -4.818 6.165
30 3HG2 VAL 5 3HG2 VAL 5 -0.208 -3.513 7.212
31 H THR 6 H THR 6 -2.652 -1.104 7.803
32 HA THR 6 HA THR 6 -3.602 1.088 6.103
33 HB THR 6 HB THR 6 -4.079 2.042 8.552
34 HG1 THR 6 1HG THR 6 -4.453 0.480 10.018
35 1HG2 THR 6 1HG2 THR 6 -5.744 1.893 6.828
36 2HG2 THR 6 2HG2 THR 6 -6.405 1.159 8.293
37 3HG2 THR 6 3HG2 THR 6 -5.816 0.135 6.979
38 H LYS 7 H LYS 7 -2.873 3.276 7.026
39 HA LYS 7 HA LYS 7 -0.337 3.748 6.321
40 1HB LYS 7 2HB LYS 7 -1.989 5.480 6.747
41 2HB LYS 7 1HB LYS 7 -1.807 5.249 8.480
42 1HG LYS 7 2HG LYS 7 -0.601 7.229 7.527
43 2HG LYS 7 1HG LYS 7 0.402 6.111 8.455
44 1HD LYS 7 2HD LYS 7 1.325 5.165 6.477
45 2HD LYS 7 1HD LYS 7 0.158 6.006 5.447
46 1HE LYS 7 2HE LYS 7 2.451 7.003 5.451
47 2HE LYS 7 1HE LYS 7 1.180 8.123 5.930
48 1HZ LYS 7 1HZ LYS 7 2.723 6.636 7.970
49 2HZ LYS 7 2HZ LYS 7 1.864 8.095 8.129
50 3HZ LYS 7 3HZ LYS 7 3.335 8.063 7.285
51 H ALA 8 H ALA 8 -1.195 3.011 9.728
52 HA ALA 8 HA ALA 8 1.263 3.654 10.885
53 1HB ALA 8 1HB ALA 8 0.607 2.223 12.739
54 2HB ALA 8 2HB ALA 8 -0.627 1.463 11.733
55 3HB ALA 8 3HB ALA 8 -0.767 3.166 12.163
56 H HIS 9 H HIS 9 0.322 0.809 9.112
57 HA HIS 9 HA HIS 9 2.444 -0.881 9.918
58 1HB HIS 9 2HB HIS 9 0.785 -0.917 7.411
59 2HB HIS 9 1HB HIS 9 1.918 -2.178 7.872
60 HD1 HIS 9 1HD HIS 9 -1.445 -0.831 8.582
61 HD2 HIS 9 2HD HIS 9 1.049 -3.829 10.006
62 HE1 HIS 9 1HE HIS 9 -2.956 -2.466 9.750
63 HE2 HIS 9 2HE HIS 9 -1.426 -4.245 10.675
64 H ASN 10 H ASN 10 2.533 1.948 8.215
65 HA ASN 10 HA ASN 10 4.454 1.760 6.273
66 1HB ASN 10 2HB ASN 10 3.419 3.884 6.945
67 2HB ASN 10 1HB ASN 10 4.261 3.825 8.492
68 1HD2 ASN 10 1HD2 ASN 10 4.493 4.514 5.128
69 2HD2 ASN 10 2HD2 ASN 10 6.079 5.208 5.156
70 H GLY 11 H GLY 11 4.707 0.929 9.587
71 1HA GLY 11 2HA GLY 11 7.506 0.147 9.126
72 2HA GLY 11 1HA GLY 11 7.124 1.055 10.582
73 H ALA 12 H ALA 12 5.686 -1.723 8.832
74 HA ALA 12 HA ALA 12 5.250 -2.977 11.470
75 1HB ALA 12 1HB ALA 12 3.360 -2.417 9.730
76 2HB ALA 12 2HB ALA 12 3.303 -3.873 10.726
77 3HB ALA 12 3HB ALA 12 3.855 -3.977 9.056
78 H THR 13 H THR 13 5.465 -5.210 11.741
79 HA THR 13 HA THR 13 6.617 -6.821 9.593
80 HB THR 13 HB THR 13 7.862 -6.765 12.364
81 HG1 THR 13 1HG THR 13 8.311 -5.199 10.168
82 1HG2 THR 13 1HG2 THR 13 7.999 -8.933 11.222
83 2HG2 THR 13 2HG2 THR 13 9.588 -8.177 11.344
84 3HG2 THR 13 3HG2 THR 13 8.710 -8.150 9.813
85 H LEU 14 H LEU 14 5.034 -8.364 9.452
86 HA LEU 14 HA LEU 14 4.024 -9.650 11.875
87 1HB LEU 14 2HB LEU 14 2.451 -7.894 10.049
88 2HB LEU 14 1HB LEU 14 1.660 -9.278 10.782
89 HG LEU 14 HG LEU 14 3.038 -7.074 12.313
90 1HD1 LEU 14 1HD1 LEU 14 1.009 -6.295 11.178
91 2HD1 LEU 14 2HD1 LEU 14 0.796 -6.366 12.928
92 3HD1 LEU 14 3HD1 LEU 14 0.100 -7.621 11.904
93 1HD2 LEU 14 1HD2 LEU 14 1.357 -9.416 13.191
94 2HD2 LEU 14 2HD2 LEU 14 1.960 -8.133 14.246
95 3HD2 LEU 14 3HD2 LEU 14 3.093 -9.222 13.440
96 H THR 15 H THR 15 2.572 -11.480 11.419
97 HA THR 15 HA THR 15 3.084 -12.717 8.803
98 HB THR 15 HB THR 15 2.126 -13.880 11.416
99 HG1 THR 15 1HG THR 15 4.425 -13.563 11.034
100 1HG2 THR 15 1HG2 THR 15 0.881 -14.772 9.408
101 2HG2 THR 15 2HG2 THR 15 1.788 -15.980 10.334
102 3HG2 THR 15 3HG2 THR 15 2.435 -15.371 8.810
103 H VAL 16 H VAL 16 1.472 -13.090 7.399
104 HA VAL 16 HA VAL 16 -1.268 -12.484 8.267
105 HB VAL 16 HB VAL 16 -1.688 -11.473 6.081
106 1HG1 VAL 16 1HG1 VAL 16 -1.001 -10.065 7.939
107 2HG1 VAL 16 2HG1 VAL 16 -0.299 -9.450 6.443
108 3HG1 VAL 16 3HG1 VAL 16 0.696 -10.366 7.575
109 1HG2 VAL 16 1HG2 VAL 16 -0.126 -12.625 4.684
110 2HG2 VAL 16 2HG2 VAL 16 1.246 -11.994 5.599
111 3HG2 VAL 16 3HG2 VAL 16 0.249 -10.903 4.629
112 H ALA 17 H ALA 17 -2.953 -13.594 7.218
113 HA ALA 17 HA ALA 17 -2.146 -16.040 5.819
114 1HB ALA 17 1HB ALA 17 -3.509 -16.443 7.769
115 2HB ALA 17 2HB ALA 17 -4.471 -16.785 6.328
116 3HB ALA 17 3HB ALA 17 -4.709 -15.276 7.213
117 H VAL 18 H VAL 18 -2.992 -16.478 3.768
118 HA VAL 18 HA VAL 18 -4.449 -14.229 2.537
119 HB VAL 18 HB VAL 18 -3.311 -14.632 0.443
120 1HG1 VAL 18 1HG1 VAL 18 -0.928 -14.118 1.209
121 2HG1 VAL 18 2HG1 VAL 18 -1.583 -14.180 2.854
122 3HG1 VAL 18 3HG1 VAL 18 -2.214 -13.010 1.695
123 1HG2 VAL 18 1HG2 VAL 18 -1.432 -16.193 0.281
124 2HG2 VAL 18 2HG2 VAL 18 -2.954 -17.020 0.612
125 3HG2 VAL 18 3HG2 VAL 18 -1.784 -16.775 1.908
126 H GLY 19 H GLY 19 -5.230 -15.069 0.223
127 1HA GLY 19 2HA GLY 19 -6.153 -17.220 -0.746
128 2HA GLY 19 1HA GLY 19 -6.930 -17.402 0.825
129 H GLU 20 H GLU 20 -8.143 -15.283 1.483
130 HA GLU 20 HA GLU 20 -10.103 -14.691 -0.490
131 1HB GLU 20 2HB GLU 20 -9.487 -13.223 2.084
132 2HB GLU 20 1HB GLU 20 -10.942 -13.031 1.117
133 1HG GLU 20 2HG GLU 20 -11.452 -15.431 1.526
134 2HG GLU 20 1HG GLU 20 -10.082 -15.474 2.638
135 H LEU 21 H LEU 21 -8.097 -12.371 1.237
136 HA LEU 21 HA LEU 21 -6.999 -11.172 -1.097
137 1HB LEU 21 2HB LEU 21 -9.201 -10.260 -1.365
138 2HB LEU 21 1HB LEU 21 -9.293 -9.839 0.332
139 HG LEU 21 HG LEU 21 -7.508 -8.148 -0.024
140 1HD1 LEU 21 1HD1 LEU 21 -7.885 -8.809 -2.940
141 2HD1 LEU 21 2HD1 LEU 21 -6.458 -9.194 -1.977
142 3HD1 LEU 21 3HD1 LEU 21 -6.890 -7.512 -2.278
143 1HD2 LEU 21 1HD2 LEU 21 -9.862 -7.516 -0.073
144 2HD2 LEU 21 2HD2 LEU 21 -9.928 -7.864 -1.800
145 3HD2 LEU 21 3HD2 LEU 21 -8.919 -6.546 -1.203
146 H VAL 22 H VAL 22 -5.175 -10.104 -0.526
147 HA VAL 22 HA VAL 22 -5.000 -9.177 2.258
148 HB VAL 22 HB VAL 22 -2.972 -10.672 0.635
149 1HG1 VAL 22 1HG1 VAL 22 -1.176 -9.799 2.175
150 2HG1 VAL 22 2HG1 VAL 22 -2.282 -8.494 2.611
151 3HG1 VAL 22 3HG1 VAL 22 -1.724 -8.654 0.949
152 1HG2 VAL 22 1HG2 VAL 22 -4.215 -11.749 2.407
153 2HG2 VAL 22 2HG2 VAL 22 -3.688 -10.517 3.553
154 3HG2 VAL 22 3HG2 VAL 22 -2.510 -11.626 2.844
155 H GLU 23 H GLU 23 -5.137 -7.029 2.318
156 HA GLU 23 HA GLU 23 -4.177 -5.612 -0.074
157 1HB GLU 23 2HB GLU 23 -5.893 -4.101 0.010
158 2HB GLU 23 1HB GLU 23 -6.695 -5.567 0.553
159 1HG GLU 23 2HG GLU 23 -6.678 -4.845 2.807
160 2HG GLU 23 1HG GLU 23 -5.590 -3.508 2.438
161 H ILE 24 H ILE 24 -3.428 -3.498 0.166
162 HA ILE 24 HA ILE 24 -2.293 -2.795 2.782
163 HB ILE 24 HB ILE 24 -0.863 -2.579 0.128
164 1HG1 ILE 24 2HG1 ILE 24 -1.061 -4.935 0.905
165 2HG1 ILE 24 1HG1 ILE 24 0.605 -4.370 0.841
166 1HG2 ILE 24 1HG2 ILE 24 0.096 -2.046 2.927
167 2HG2 ILE 24 2HG2 ILE 24 -0.261 -0.833 1.697
168 3HG2 ILE 24 3HG2 ILE 24 1.081 -1.955 1.466
169 1HD1 ILE 24 1HD1 ILE 24 0.168 -5.703 2.833
170 2HD1 ILE 24 2HD1 ILE 24 -1.093 -4.569 3.325
171 3HD1 ILE 24 3HD1 ILE 24 0.589 -4.043 3.254
172 H GLN 25 H GLN 25 -3.472 -0.959 3.219
173 HA GLN 25 HA GLN 25 -4.005 0.825 0.946
174 1HB GLN 25 2HB GLN 25 -6.034 0.005 1.876
175 2HB GLN 25 1HB GLN 25 -5.521 0.377 3.519
176 1HG GLN 25 2HG GLN 25 -5.611 2.649 1.672
177 2HG GLN 25 1HG GLN 25 -7.168 1.898 2.003
178 1HE2 GLN 25 1HE2 GLN 25 -4.471 2.177 4.305
179 2HE2 GLN 25 2HE2 GLN 25 -5.308 3.226 5.398
180 H LEU 26 H LEU 26 -3.466 2.896 0.992
181 HA LEU 26 HA LEU 26 -2.314 3.963 3.471
182 1HB LEU 26 2HB LEU 26 -1.569 4.372 0.604
183 2HB LEU 26 1HB LEU 26 -1.331 5.688 1.733
184 HG LEU 26 HG LEU 26 0.727 4.508 1.477
185 1HD1 LEU 26 1HD1 LEU 26 -0.560 3.905 4.123
186 2HD1 LEU 26 2HD1 LEU 26 0.339 5.357 3.676
187 3HD1 LEU 26 3HD1 LEU 26 1.170 3.804 3.798
188 1HD2 LEU 26 1HD2 LEU 26 -0.083 2.371 0.692
189 2HD2 LEU 26 2HD2 LEU 26 -0.788 2.028 2.271
190 3HD2 LEU 26 3HD2 LEU 26 0.962 2.136 2.092
191 HA PRO 27 HA PRO 27 -5.663 6.863 3.222
192 1HB PRO 27 2HB PRO 27 -4.899 8.631 5.037
193 2HB PRO 27 1HB PRO 27 -5.260 6.963 5.519
194 1HG PRO 27 2HG PRO 27 -2.577 8.244 4.998
195 2HG PRO 27 1HG PRO 27 -3.088 7.193 6.346
196 1HD PRO 27 2HD PRO 27 -1.725 6.294 4.155
197 2HD PRO 27 1HD PRO 27 -2.809 5.278 5.127
198 H SER 28 H SER 28 -2.879 7.266 1.739
199 HA SER 28 HA SER 28 -1.928 8.742 0.346
200 1HB SER 28 2HB SER 28 -4.298 9.200 -0.400
201 2HB SER 28 1HB SER 28 -4.326 10.528 0.769
202 HG SER 28 HG SER 28 -2.588 10.239 -1.465
203 H ASN 29 H ASN 29 -3.430 10.276 3.114
204 HA ASN 29 HA ASN 29 -2.782 11.962 4.514
205 1HB ASN 29 2HB ASN 29 0.094 11.601 3.788
206 2HB ASN 29 1HB ASN 29 -0.624 11.917 5.354
207 1HD2 ASN 29 1HD2 ASN 29 0.453 9.570 3.148
208 2HD2 ASN 29 2HD2 ASN 29 0.167 8.179 4.131
209 HA PRO 30 HA PRO 30 -2.482 14.052 0.318
210 1HB PRO 30 2HB PRO 30 -4.504 15.779 1.684
211 2HB PRO 30 1HB PRO 30 -4.493 15.139 0.033
212 1HG PRO 30 2HG PRO 30 -6.052 13.996 1.812
213 2HG PRO 30 1HG PRO 30 -5.064 12.976 0.744
214 1HD PRO 30 2HD PRO 30 -4.562 13.745 3.598
215 2HD PRO 30 1HD PRO 30 -4.437 12.149 2.826
216 H THR 31 H THR 31 -0.494 14.897 0.480
217 HA THR 31 HA THR 31 -0.150 17.325 2.095
218 HB THR 31 HB THR 31 1.491 15.827 2.769
219 HG1 THR 31 1HG THR 31 2.311 17.940 1.840
220 1HG2 THR 31 1HG2 THR 31 1.824 15.058 -0.132
221 2HG2 THR 31 2HG2 THR 31 1.180 14.061 1.177
222 3HG2 THR 31 3HG2 THR 31 2.890 14.505 1.161
223 H THR 32 H THR 32 0.170 16.019 -1.158
224 HA THR 32 HA THR 32 -0.185 18.477 -2.438
225 HB THR 32 HB THR 32 2.079 18.984 -1.568
226 HG1 THR 32 1HG THR 32 1.773 20.032 -3.452
227 1HG2 THR 32 1HG2 THR 32 2.979 16.637 -3.236
228 2HG2 THR 32 2HG2 THR 32 2.968 16.711 -1.473
229 3HG2 THR 32 3HG2 THR 32 4.034 17.773 -2.394
230 H GLY 33 H GLY 33 1.416 17.877 -4.785
231 1HA GLY 33 2HA GLY 33 -0.228 16.152 -6.198
232 2HA GLY 33 1HA GLY 33 1.418 16.550 -6.661
233 H PHE 34 H PHE 34 2.467 15.350 -4.147
234 HA PHE 34 HA PHE 34 3.200 12.834 -4.665
235 1HB PHE 34 2HB PHE 34 2.338 14.001 -2.027
236 2HB PHE 34 1HB PHE 34 3.029 12.392 -2.159
237 HD1 PHE 34 1HD PHE 34 4.359 14.147 -0.407
238 HD2 PHE 34 2HD PHE 34 4.672 13.913 -4.640
239 HE1 PHE 34 1HE PHE 34 6.598 15.141 -0.290
240 HE2 PHE 34 2HE PHE 34 6.917 14.903 -4.533
241 HZ PHE 34 HZ PHE 34 7.912 15.445 -2.306
242 H ALA 35 H ALA 35 2.413 10.859 -4.754
243 HA ALA 35 HA ALA 35 -0.069 10.195 -3.397
244 1HB ALA 35 1HB ALA 35 -0.999 9.079 -5.374
245 2HB ALA 35 2HB ALA 35 0.387 9.593 -6.337
246 3HB ALA 35 3HB ALA 35 -0.743 10.793 -5.707
247 H TRP 36 H TRP 36 -0.269 7.842 -3.107
248 HA TRP 36 HA TRP 36 2.365 6.663 -2.784
249 1HB TRP 36 2HB TRP 36 -0.354 5.632 -1.961
250 2HB TRP 36 1HB TRP 36 1.172 4.819 -1.634
251 HD1 TRP 36 HD TRP 36 -0.955 7.768 -0.437
252 HE1 TRP 36 1HE TRP 36 -0.030 8.540 1.816
253 HE3 TRP 36 3HE TRP 36 3.339 5.002 -0.340
254 HZ2 TRP 36 2HZ TRP 36 2.210 8.040 3.451
255 HZ3 TRP 36 3HZ TRP 36 4.835 5.209 1.602
256 HH2 TRP 36 HH TRP 36 4.279 6.703 3.464
257 H TYR 37 H TYR 37 3.272 5.359 -4.170
258 HA TYR 37 HA TYR 37 1.803 3.250 -5.436
259 1HB TYR 37 2HB TYR 37 2.819 3.923 -7.737
260 2HB TYR 37 1HB TYR 37 1.328 4.680 -7.197
261 HD1 TYR 37 1HD TYR 37 4.783 5.464 -6.113
262 HD2 TYR 37 2HD TYR 37 1.391 6.782 -8.302
263 HE1 TYR 37 1HE TYR 37 5.842 7.635 -6.452
264 HE2 TYR 37 2HE TYR 37 2.454 8.955 -8.649
265 HH TYR 37 HH TYR 37 5.726 9.464 -8.100
266 H PHE 38 H PHE 38 3.169 1.529 -6.122
267 HA PHE 38 HA PHE 38 5.297 1.017 -4.460
268 1HB PHE 38 2HB PHE 38 4.220 -0.236 -6.845
269 2HB PHE 38 1HB PHE 38 5.968 -0.404 -6.723
270 HD1 PHE 38 1HD PHE 38 2.775 -1.511 -5.508
271 HD2 PHE 38 2HD PHE 38 6.947 -1.486 -4.693
272 HE1 PHE 38 1HE PHE 38 2.467 -3.362 -3.921
273 HE2 PHE 38 2HE PHE 38 6.651 -3.343 -3.104
274 HZ PHE 38 HZ PHE 38 4.451 -4.326 -2.760
275 H GLU 39 H GLU 39 5.916 1.279 -7.951
276 HA GLU 39 HA GLU 39 8.509 2.450 -7.287
277 1HB GLU 39 2HB GLU 39 7.514 1.476 -9.965
278 2HB GLU 39 1HB GLU 39 9.162 1.931 -9.568
279 1HG GLU 39 2HG GLU 39 9.282 0.042 -8.004
280 2HG GLU 39 1HG GLU 39 7.648 -0.430 -8.482
281 H GLY 40 H GLY 40 5.452 3.281 -8.402
282 1HA GLY 40 2HA GLY 40 4.946 5.670 -8.646
283 2HA GLY 40 1HA GLY 40 6.490 5.838 -9.476
284 H GLY 41 H GLY 41 3.217 4.667 -9.711
285 1HA GLY 41 2HA GLY 41 1.930 4.652 -11.670
286 2HA GLY 41 1HA GLY 41 3.402 4.786 -12.619
287 H THR 42 H THR 42 4.361 2.562 -10.648
288 HA THR 42 HA THR 42 3.055 0.299 -11.990
289 HB THR 42 HB THR 42 5.988 0.380 -11.306
290 HG1 THR 42 1HG THR 42 4.648 1.119 -13.705
291 1HG2 THR 42 1HG2 THR 42 6.119 -1.485 -12.904
292 2HG2 THR 42 2HG2 THR 42 4.372 -1.403 -13.128
293 3HG2 THR 42 3HG2 THR 42 5.038 -1.847 -11.558
294 H LYS 43 H LYS 43 2.666 -1.470 -10.723
295 HA LYS 43 HA LYS 43 3.652 -1.473 -7.974
296 1HB LYS 43 2HB LYS 43 1.600 -1.366 -6.946
297 2HB LYS 43 1HB LYS 43 1.286 -0.334 -8.318
298 1HG LYS 43 2HG LYS 43 0.540 -3.246 -8.214
299 2HG LYS 43 1HG LYS 43 -0.549 -1.918 -7.822
300 1HD LYS 43 2HD LYS 43 -0.360 -1.048 -10.071
301 2HD LYS 43 1HD LYS 43 0.843 -2.273 -10.477
302 1HE LYS 43 2HE LYS 43 -0.872 -4.017 -10.015
303 2HE LYS 43 1HE LYS 43 -2.057 -2.731 -9.790
304 1HZ LYS 43 1HZ LYS 43 -1.508 -1.991 -12.090
305 2HZ LYS 43 2HZ LYS 43 -2.256 -3.510 -12.000
306 3HZ LYS 43 3HZ LYS 43 -0.585 -3.406 -12.272
307 H GLU 44 H GLU 44 3.867 -3.554 -7.104
308 HA GLU 44 HA GLU 44 3.008 -5.798 -8.775
309 1HB GLU 44 2HB GLU 44 5.254 -6.800 -8.710
310 2HB GLU 44 1HB GLU 44 5.254 -5.258 -9.553
311 1HG GLU 44 2HG GLU 44 6.193 -4.154 -7.623
312 2HG GLU 44 1HG GLU 44 6.101 -5.648 -6.693
313 H SER 45 H SER 45 3.133 -7.873 -7.729
314 HA SER 45 HA SER 45 3.417 -7.742 -4.785
315 1HB SER 45 2HB SER 45 1.151 -8.433 -5.647
316 2HB SER 45 1HB SER 45 1.917 -9.835 -6.390
317 HG SER 45 HG SER 45 1.312 -10.608 -4.479
318 HA PRO 46 HA PRO 46 7.063 -10.172 -5.529
319 1HB PRO 46 2HB PRO 46 6.948 -10.862 -2.680
320 2HB PRO 46 1HB PRO 46 8.159 -9.921 -3.554
321 1HG PRO 46 2HG PRO 46 6.445 -8.782 -1.808
322 2HG PRO 46 1HG PRO 46 7.031 -7.936 -3.252
323 1HD PRO 46 2HD PRO 46 4.402 -9.303 -2.791
324 2HD PRO 46 1HD PRO 46 4.739 -7.761 -3.608
325 H ASN 47 H ASN 47 4.054 -11.322 -4.691
326 HA ASN 47 HA ASN 47 4.957 -14.130 -4.634
327 1HB ASN 47 2HB ASN 47 2.470 -12.965 -3.356
328 2HB ASN 47 1HB ASN 47 2.982 -14.648 -3.281
329 1HD2 ASN 47 1HD2 ASN 47 4.664 -15.224 -1.933
330 2HD2 ASN 47 2HD2 ASN 47 5.276 -14.159 -0.719
331 H GLU 48 H GLU 48 3.717 -12.008 -6.729
332 HA GLU 48 HA GLU 48 1.301 -13.440 -7.411
333 1HB GLU 48 2HB GLU 48 0.826 -11.680 -8.962
334 2HB GLU 48 1HB GLU 48 1.357 -10.978 -7.442
335 1HG GLU 48 2HG GLU 48 3.457 -10.379 -8.360
336 2HG GLU 48 1HG GLU 48 3.149 -11.310 -9.829
337 H SER 49 H SER 49 1.679 -15.349 -8.275
338 HA SER 49 HA SER 49 3.182 -15.421 -10.807
339 1HB SER 49 2HB SER 49 4.435 -16.567 -9.014
340 2HB SER 49 1HB SER 49 3.045 -17.606 -8.711
341 HG SER 49 HG SER 49 3.324 -18.107 -11.101
342 H MET 50 H MET 50 0.239 -15.395 -9.646
343 HA MET 50 HA MET 50 -1.016 -16.707 -11.804
344 1HB MET 50 2HB MET 50 -2.211 -18.469 -10.614
345 2HB MET 50 1HB MET 50 -0.481 -18.735 -10.601
346 1HG MET 50 2HG MET 50 -0.389 -17.871 -8.287
347 2HG MET 50 1HG MET 50 -2.149 -17.693 -8.307
348 1HE MET 50 1HE MET 50 -2.383 -19.150 -6.145
349 2HE MET 50 2HE MET 50 -0.630 -19.327 -6.065
350 3HE MET 50 3HE MET 50 -1.666 -20.750 -5.940
351 H PHE 51 H PHE 51 -1.160 -15.588 -8.551
352 HA PHE 51 HA PHE 51 -3.680 -14.187 -9.044
353 1HB PHE 51 2HB PHE 51 -2.309 -15.330 -6.679
354 2HB PHE 51 1HB PHE 51 -3.133 -13.800 -6.405
355 HD1 PHE 51 1HD PHE 51 -3.792 -17.029 -8.170
356 HD2 PHE 51 2HD PHE 51 -5.287 -13.963 -5.621
357 HE1 PHE 51 1HE PHE 51 -5.917 -18.250 -7.949
358 HE2 PHE 51 2HE PHE 51 -7.415 -15.181 -5.401
359 HZ PHE 51 HZ PHE 51 -7.764 -17.273 -6.589
360 H THR 52 H THR 52 -3.554 -11.827 -7.896
361 HA THR 52 HA THR 52 -1.047 -10.547 -8.503
362 HB THR 52 HB THR 52 -1.960 -11.167 -10.775
363 HG1 THR 52 1HG THR 52 -0.443 -9.501 -10.638
364 1HG2 THR 52 1HG2 THR 52 -3.742 -9.738 -11.690
365 2HG2 THR 52 2HG2 THR 52 -3.992 -9.039 -10.090
366 3HG2 THR 52 3HG2 THR 52 -4.325 -10.748 -10.366
367 H VAL 53 H VAL 53 -1.415 -8.088 -8.801
368 HA VAL 53 HA VAL 53 -2.972 -7.251 -6.460
369 HB VAL 53 HB VAL 53 -0.878 -5.683 -7.971
370 1HG1 VAL 53 1HG1 VAL 53 -0.695 -4.413 -5.873
371 2HG1 VAL 53 2HG1 VAL 53 -2.019 -5.364 -5.200
372 3HG1 VAL 53 3HG1 VAL 53 -2.305 -4.311 -6.586
373 1HG2 VAL 53 1HG2 VAL 53 0.120 -7.741 -7.183
374 2HG2 VAL 53 2HG2 VAL 53 -0.497 -7.435 -5.559
375 3HG2 VAL 53 3HG2 VAL 53 0.714 -6.362 -6.259
376 H GLU 54 H GLU 54 -4.666 -5.931 -6.644
377 HA GLU 54 HA GLU 54 -4.996 -4.365 -9.114
378 1HB GLU 54 2HB GLU 54 -7.403 -4.145 -8.357
379 2HB GLU 54 1HB GLU 54 -6.910 -5.757 -8.858
380 1HG GLU 54 2HG GLU 54 -7.398 -6.620 -6.874
381 2HG GLU 54 1HG GLU 54 -6.516 -5.354 -6.023
382 H ASN 55 H ASN 55 -4.734 -2.222 -8.946
383 HA ASN 55 HA ASN 55 -4.422 -1.127 -6.240
384 1HB ASN 55 2HB ASN 55 -3.082 0.624 -7.217
385 2HB ASN 55 1HB ASN 55 -2.451 -0.947 -7.701
386 1HD2 ASN 55 1HD2 ASN 55 -2.048 1.618 -8.960
387 2HD2 ASN 55 2HD2 ASN 55 -2.647 1.475 -10.579
388 H LYS 56 H LYS 56 -5.276 0.937 -5.729
389 HA LYS 56 HA LYS 56 -7.005 2.322 -7.530
390 1HB LYS 56 2HB LYS 56 -9.121 1.984 -6.421
391 2HB LYS 56 1HB LYS 56 -8.473 0.420 -6.880
392 1HG LYS 56 2HG LYS 56 -8.265 1.555 -4.105
393 2HG LYS 56 1HG LYS 56 -9.561 0.487 -4.644
394 1HD LYS 56 2HD LYS 56 -6.626 -0.174 -4.701
395 2HD LYS 56 1HD LYS 56 -7.744 -0.705 -3.446
396 1HE LYS 56 2HE LYS 56 -7.578 -1.515 -6.330
397 2HE LYS 56 1HE LYS 56 -7.602 -2.521 -4.885
398 1HZ LYS 56 1HZ LYS 56 -9.962 -1.820 -4.576
399 2HZ LYS 56 2HZ LYS 56 -9.683 -2.743 -5.975
400 3HZ LYS 56 3HZ LYS 56 -9.893 -1.066 -6.098
401 H TYR 57 H TYR 57 -6.487 4.340 -7.066
402 HA TYR 57 HA TYR 57 -5.909 4.994 -4.255
403 1HB TYR 57 2HB TYR 57 -4.995 6.687 -6.508
404 2HB TYR 57 1HB TYR 57 -4.310 6.521 -4.908
405 HD1 TYR 57 1HD TYR 57 -3.493 6.025 -8.157
406 HD2 TYR 57 2HD TYR 57 -3.726 3.811 -4.531
407 HE1 TYR 57 1HE TYR 57 -1.832 4.435 -9.019
408 HE2 TYR 57 2HE TYR 57 -2.062 2.222 -5.387
409 HH TYR 57 HH TYR 57 -1.201 1.447 -7.535
410 H PHE 58 H PHE 58 -7.460 6.167 -3.301
411 HA PHE 58 HA PHE 58 -8.995 8.007 -5.000
412 1HB PHE 58 2HB PHE 58 -9.688 6.809 -2.319
413 2HB PHE 58 1HB PHE 58 -10.683 7.977 -3.178
414 HD1 PHE 58 1HD PHE 58 -9.416 4.530 -3.188
415 HD2 PHE 58 2HD PHE 58 -12.046 7.325 -5.033
416 HE1 PHE 58 1HE PHE 58 -10.526 2.690 -4.382
417 HE2 PHE 58 2HE PHE 58 -13.156 5.485 -6.234
418 HZ PHE 58 HZ PHE 58 -12.412 3.185 -5.920
419 HA PRO 59 HA PRO 59 -6.780 11.117 -2.551
420 1HB PRO 59 2HB PRO 59 -6.979 12.737 -4.947
421 2HB PRO 59 1HB PRO 59 -5.527 12.103 -4.170
422 1HG PRO 59 2HG PRO 59 -6.380 11.247 -6.598
423 2HG PRO 59 1HG PRO 59 -5.497 10.207 -5.457
424 1HD PRO 59 2HD PRO 59 -8.463 10.377 -5.947
425 2HD PRO 59 1HD PRO 59 -7.428 8.936 -5.814
426 HA PRO 60 HA PRO 60 -10.694 13.165 -1.995
427 1HB PRO 60 2HB PRO 60 -10.159 14.230 0.407
428 2HB PRO 60 1HB PRO 60 -10.403 12.496 0.186
429 1HG PRO 60 2HG PRO 60 -7.916 13.997 0.706
430 2HG PRO 60 1HG PRO 60 -8.308 12.309 1.063
431 1HD PRO 60 2HD PRO 60 -6.800 13.341 -1.138
432 2HD PRO 60 1HD PRO 60 -7.235 11.649 -0.814
433 H ASP 61 H ASP 61 -7.695 14.703 -2.474
434 HA ASP 61 HA ASP 61 -8.725 17.158 -3.328
435 1HB ASP 61 2HB ASP 61 -9.318 17.515 -0.994
436 2HB ASP 61 1HB ASP 61 -7.667 17.160 -0.494
437 H SER 62 H SER 62 -5.979 16.172 -1.327
438 HA SER 62 HA SER 62 -3.835 15.698 -1.813
439 1HB SER 62 2HB SER 62 -4.609 16.171 -4.690
440 2HB SER 62 1HB SER 62 -3.076 15.489 -4.142
441 HG SER 62 HG SER 62 -4.022 13.644 -3.779
442 H LYS 63 H LYS 63 -5.039 18.651 -1.744
443 HA LYS 63 HA LYS 63 -2.292 19.590 -1.576
444 1HB LYS 63 2HB LYS 63 -2.637 21.667 -2.696
445 2HB LYS 63 1HB LYS 63 -3.154 20.394 -3.783
446 1HG LYS 63 2HG LYS 63 -5.059 21.997 -2.096
447 2HG LYS 63 1HG LYS 63 -4.581 22.455 -3.730
448 1HD LYS 63 2HD LYS 63 -5.411 20.226 -4.503
449 2HD LYS 63 1HD LYS 63 -6.052 19.968 -2.873
450 1HE LYS 63 2HE LYS 63 -7.329 22.106 -3.141
451 2HE LYS 63 1HE LYS 63 -6.811 22.138 -4.827
452 1HZ LYS 63 1HZ LYS 63 -8.472 20.059 -3.513
453 2HZ LYS 63 2HZ LYS 63 -7.891 19.950 -5.101
454 3HZ LYS 63 3HZ LYS 63 -8.982 21.179 -4.679
455 H LEU 64 H LEU 64 -4.515 18.702 0.087
456 HA LEU 64 HA LEU 64 -4.132 20.332 2.312
457 1HB LEU 64 2HB LEU 64 -5.655 21.821 0.928
458 2HB LEU 64 1HB LEU 64 -6.896 20.598 1.136
459 HG LEU 64 HG LEU 64 -6.828 20.936 3.568
460 1HD1 LEU 64 1HD1 LEU 64 -4.492 21.615 3.773
461 2HD1 LEU 64 2HD1 LEU 64 -5.567 22.797 4.517
462 3HD1 LEU 64 3HD1 LEU 64 -4.852 23.125 2.939
463 1HD2 LEU 64 1HD2 LEU 64 -7.825 23.178 3.597
464 2HD2 LEU 64 2HD2 LEU 64 -8.410 22.220 2.239
465 3HD2 LEU 64 3HD2 LEU 64 -7.196 23.473 1.977
466 H LEU 65 H LEU 65 -7.281 19.050 1.448
467 HA LEU 65 HA LEU 65 -7.068 16.361 1.884
468 1HB LEU 65 2HB LEU 65 -6.501 17.563 4.308
469 2HB LEU 65 1HB LEU 65 -8.213 17.213 4.450
470 HG LEU 65 HG LEU 65 -6.010 15.206 3.918
471 1HD1 LEU 65 1HD1 LEU 65 -6.114 16.023 6.217
472 2HD1 LEU 65 2HD1 LEU 65 -6.617 14.336 6.103
473 3HD1 LEU 65 3HD1 LEU 65 -7.827 15.604 6.289
474 1HD2 LEU 65 1HD2 LEU 65 -7.741 13.499 4.095
475 2HD2 LEU 65 2HD2 LEU 65 -8.043 14.570 2.727
476 3HD2 LEU 65 3HD2 LEU 65 -8.980 14.751 4.211
477 H GLY 66 H GLY 66 -8.964 15.497 1.313
478 1HA GLY 66 2HA GLY 66 -11.258 17.253 0.988
479 2HA GLY 66 1HA GLY 66 -11.089 15.627 0.354
480 H ALA 67 H ALA 67 -10.613 14.089 2.445
481 HA ALA 67 HA ALA 67 -12.169 14.587 4.761
482 1HB ALA 67 1HB ALA 67 -13.997 13.056 4.393
483 2HB ALA 67 2HB ALA 67 -13.395 12.666 2.783
484 3HB ALA 67 3HB ALA 67 -14.012 14.284 3.126
485 H GLY 68 H GLY 68 -11.712 11.741 2.702
486 1HA GLY 68 2HA GLY 68 -9.817 10.669 4.673
487 2HA GLY 68 1HA GLY 68 -11.210 9.702 4.200
488 H GLY 69 H GLY 69 -8.103 10.907 3.277
489 1HA GLY 69 2HA GLY 69 -8.109 10.102 0.563
490 2HA GLY 69 1HA GLY 69 -6.678 10.282 1.576
491 H THR 70 H THR 70 -7.617 8.146 -0.396
492 HA THR 70 HA THR 70 -6.963 5.898 1.291
493 HB THR 70 HB THR 70 -9.081 4.733 0.150
494 HG1 THR 70 1HG THR 70 -9.913 7.411 0.675
495 1HG2 THR 70 1HG2 THR 70 -9.244 6.393 2.671
496 2HG2 THR 70 2HG2 THR 70 -8.443 4.825 2.561
497 3HG2 THR 70 3HG2 THR 70 -10.187 4.951 2.293
498 H GLU 71 H GLU 71 -5.180 5.734 0.011
499 HA GLU 71 HA GLU 71 -5.608 4.870 -2.767
500 1HB GLU 71 2HB GLU 71 -3.021 5.658 -1.403
501 2HB GLU 71 1HB GLU 71 -3.239 5.319 -3.117
502 1HG GLU 71 2HG GLU 71 -4.797 7.251 -3.235
503 2HG GLU 71 1HG GLU 71 -4.382 7.626 -1.563
504 H HIS 72 H HIS 72 -5.859 2.726 -2.873
505 HA HIS 72 HA HIS 72 -4.641 1.100 -0.738
506 1HB HIS 72 2HB HIS 72 -6.911 0.376 -2.574
507 2HB HIS 72 1HB HIS 72 -6.299 -0.594 -1.251
508 HD1 HIS 72 1HD HIS 72 -8.065 -0.675 0.426
509 HD2 HIS 72 2HD HIS 72 -7.627 3.142 -1.148
510 HE1 HIS 72 1HE HIS 72 -9.907 0.679 1.412
511 HE2 HIS 72 2HE HIS 72 -9.774 2.913 0.285
512 H PHE 73 H PHE 73 -3.578 -0.737 -1.171
513 HA PHE 73 HA PHE 73 -3.177 -1.526 -3.978
514 1HB PHE 73 2HB PHE 73 -1.309 -1.502 -1.614
515 2HB PHE 73 1HB PHE 73 -0.997 -2.537 -3.007
516 HD1 PHE 73 1HD PHE 73 0.158 -1.691 -4.817
517 HD2 PHE 73 2HD PHE 73 -1.666 0.999 -2.073
518 HE1 PHE 73 1HE PHE 73 1.209 0.206 -5.985
519 HE2 PHE 73 2HE PHE 73 -0.607 2.900 -3.222
520 HZ PHE 73 HZ PHE 73 0.832 2.522 -5.151
521 H HIS 74 H HIS 74 -4.489 -3.237 -4.265
522 HA HIS 74 HA HIS 74 -4.937 -5.050 -1.982
523 1HB HIS 74 2HB HIS 74 -6.510 -4.423 -4.479
524 2HB HIS 74 1HB HIS 74 -6.824 -5.878 -3.552
525 HD1 HIS 74 1HD HIS 74 -9.226 -4.977 -3.181
526 HD2 HIS 74 2HD HIS 74 -6.237 -2.643 -1.463
527 HE1 HIS 74 1HE HIS 74 -10.393 -3.474 -1.541
528 HE2 HIS 74 2HE HIS 74 -8.522 -2.344 -0.298
529 H VAL 75 H VAL 75 -3.515 -6.710 -2.045
530 HA VAL 75 HA VAL 75 -2.930 -7.801 -4.695
531 HB VAL 75 HB VAL 75 -0.893 -8.669 -3.938
532 1HG1 VAL 75 1HG1 VAL 75 -0.859 -6.229 -4.123
533 2HG1 VAL 75 2HG1 VAL 75 0.313 -6.825 -2.948
534 3HG1 VAL 75 3HG1 VAL 75 -1.199 -6.101 -2.398
535 1HG2 VAL 75 1HG2 VAL 75 -0.200 -8.750 -1.566
536 2HG2 VAL 75 2HG2 VAL 75 -1.583 -9.784 -1.947
537 3HG2 VAL 75 3HG2 VAL 75 -1.838 -8.243 -1.120
538 H THR 76 H THR 76 -4.041 -9.453 -5.242
539 HA THR 76 HA THR 76 -5.231 -11.157 -3.177
540 HB THR 76 HB THR 76 -5.885 -11.177 -6.134
541 HG1 THR 76 1HG THR 76 -6.247 -9.123 -4.604
542 1HG2 THR 76 1HG2 THR 76 -8.038 -12.081 -5.345
543 2HG2 THR 76 2HG2 THR 76 -7.438 -12.027 -3.686
544 3HG2 THR 76 3HG2 THR 76 -6.677 -13.097 -4.866
545 H VAL 77 H VAL 77 -3.852 -12.755 -2.722
546 HA VAL 77 HA VAL 77 -2.845 -14.449 -4.847
547 HB VAL 77 HB VAL 77 -1.093 -12.783 -4.797
548 1HG1 VAL 77 1HG1 VAL 77 0.171 -12.267 -2.763
549 2HG1 VAL 77 2HG1 VAL 77 -0.925 -13.285 -1.827
550 3HG1 VAL 77 3HG1 VAL 77 -1.528 -11.821 -2.608
551 1HG2 VAL 77 1HG2 VAL 77 -0.197 -15.250 -3.302
552 2HG2 VAL 77 2HG2 VAL 77 0.846 -14.150 -4.205
553 3HG2 VAL 77 3HG2 VAL 77 -0.371 -15.105 -5.053
554 H LYS 78 H LYS 78 -2.317 -16.507 -4.150
555 HA LYS 78 HA LYS 78 -2.072 -16.898 -1.273
556 1HB LYS 78 2HB LYS 78 -3.129 -19.093 -1.421
557 2HB LYS 78 1HB LYS 78 -4.222 -17.794 -1.854
558 1HG LYS 78 2HG LYS 78 -2.773 -19.155 -4.052
559 2HG LYS 78 1HG LYS 78 -4.058 -20.052 -3.240
560 1HD LYS 78 2HD LYS 78 -4.290 -17.384 -4.629
561 2HD LYS 78 1HD LYS 78 -4.950 -18.929 -5.167
562 1HE LYS 78 2HE LYS 78 -5.747 -17.463 -2.651
563 2HE LYS 78 1HE LYS 78 -6.687 -17.547 -4.142
564 1HZ LYS 78 1HZ LYS 78 -7.535 -19.145 -2.596
565 2HZ LYS 78 2HZ LYS 78 -5.999 -19.815 -2.347
566 3HZ LYS 78 3HZ LYS 78 -6.763 -19.985 -3.855
567 H ALA 79 H ALA 79 0.074 -17.173 -1.099
568 HA ALA 79 HA ALA 79 1.273 -19.507 -2.193
569 1HB ALA 79 1HB ALA 79 2.296 -16.859 -3.205
570 2HB ALA 79 2HB ALA 79 1.409 -18.043 -4.164
571 3HB ALA 79 3HB ALA 79 3.005 -18.441 -3.529
572 H ALA 80 H ALA 80 2.707 -20.217 -0.773
573 HA ALA 80 HA ALA 80 3.300 -18.833 1.591
574 1HB ALA 80 1HB ALA 80 4.769 -21.170 0.385
575 2HB ALA 80 2HB ALA 80 3.344 -21.266 1.420
576 3HB ALA 80 3HB ALA 80 4.861 -20.637 2.063
577 H GLY 81 H GLY 81 4.261 -16.943 1.461
578 1HA GLY 81 2HA GLY 81 7.053 -16.779 0.811
579 2HA GLY 81 1HA GLY 81 6.023 -15.940 -0.347
580 H THR 82 H THR 82 7.801 -14.456 1.104
581 HA THR 82 HA THR 82 6.108 -13.267 3.181
582 HB THR 82 HB THR 82 8.942 -12.411 2.638
583 HG1 THR 82 1HG THR 82 8.675 -14.803 3.010
584 1HG2 THR 82 1HG2 THR 82 7.164 -12.456 5.080
585 2HG2 THR 82 2HG2 THR 82 7.612 -11.034 4.136
586 3HG2 THR 82 3HG2 THR 82 8.841 -11.900 5.060
587 H HIS 83 H HIS 83 5.229 -11.272 2.945
588 HA HIS 83 HA HIS 83 5.501 -10.100 0.267
589 1HB HIS 83 2HB HIS 83 3.185 -10.893 1.274
590 2HB HIS 83 1HB HIS 83 3.284 -9.388 2.170
591 HD1 HIS 83 1HD HIS 83 3.563 -7.174 0.675
592 HD2 HIS 83 2HD HIS 83 2.215 -10.572 -1.291
593 HE1 HIS 83 1HE HIS 83 2.590 -6.335 -1.476
594 HE2 HIS 83 2HE HIS 83 1.879 -8.435 -2.714
595 H ALA 84 H ALA 84 7.042 -8.588 0.362
596 HA ALA 84 HA ALA 84 7.049 -6.724 2.623
597 1HB ALA 84 1HB ALA 84 9.285 -6.081 1.860
598 2HB ALA 84 2HB ALA 84 9.134 -7.175 0.484
599 3HB ALA 84 3HB ALA 84 9.185 -7.822 2.124
600 H VAL 85 H VAL 85 5.961 -4.911 2.333
601 HA VAL 85 HA VAL 85 5.372 -4.110 -0.441
602 HB VAL 85 HB VAL 85 3.846 -3.110 1.932
603 1HG1 VAL 85 1HG1 VAL 85 3.107 -3.675 -0.934
604 2HG1 VAL 85 2HG1 VAL 85 3.388 -2.091 -0.208
605 3HG1 VAL 85 3HG1 VAL 85 2.006 -3.063 0.299
606 1HG2 VAL 85 1HG2 VAL 85 2.319 -5.021 1.754
607 2HG2 VAL 85 2HG2 VAL 85 3.943 -5.513 2.252
608 3HG2 VAL 85 3HG2 VAL 85 3.410 -5.772 0.590
609 H ASN 86 H ASN 86 6.871 -2.650 -0.999
610 HA ASN 86 HA ASN 86 7.318 -0.349 0.798
611 1HB ASN 86 2HB ASN 86 8.967 -1.445 -1.502
612 2HB ASN 86 1HB ASN 86 9.285 0.108 -0.748
613 1HD2 ASN 86 1HD2 ASN 86 8.258 -2.727 1.041
614 2HD2 ASN 86 2HD2 ASN 86 9.755 -2.969 1.869
615 H LEU 87 H LEU 87 5.824 1.101 0.330
616 HA LEU 87 HA LEU 87 5.120 1.559 -2.490
617 1HB LEU 87 2HB LEU 87 3.578 2.122 0.042
618 2HB LEU 87 1HB LEU 87 3.048 2.577 -1.568
619 HG LEU 87 HG LEU 87 3.532 -0.277 -0.678
620 1HD1 LEU 87 1HD1 LEU 87 0.948 1.241 -1.038
621 2HD1 LEU 87 2HD1 LEU 87 1.635 0.716 0.502
622 3HD1 LEU 87 3HD1 LEU 87 1.103 -0.480 -0.682
623 1HD2 LEU 87 1HD2 LEU 87 2.444 -0.840 -2.759
624 2HD2 LEU 87 2HD2 LEU 87 3.863 0.165 -3.066
625 3HD2 LEU 87 3HD2 LEU 87 2.248 0.869 -3.148
626 H THR 88 H THR 88 5.541 3.511 -3.372
627 HA THR 88 HA THR 88 7.029 5.329 -1.628
628 HB THR 88 HB THR 88 7.140 5.252 -4.642
629 HG1 THR 88 1HG THR 88 7.988 3.329 -4.353
630 1HG2 THR 88 1HG2 THR 88 9.063 6.193 -2.500
631 2HG2 THR 88 2HG2 THR 88 8.130 7.221 -3.588
632 3HG2 THR 88 3HG2 THR 88 9.402 6.182 -4.231
633 H TYR 89 H TYR 89 6.437 7.347 -1.340
634 HA TYR 89 HA TYR 89 3.906 8.214 -2.549
635 1HB TYR 89 2HB TYR 89 4.128 7.940 -0.048
636 2HB TYR 89 1HB TYR 89 5.297 9.251 -0.070
637 HD1 TYR 89 1HD TYR 89 2.089 8.929 -1.908
638 HD2 TYR 89 2HD TYR 89 4.270 10.972 1.108
639 HE1 TYR 89 1HE TYR 89 0.244 10.529 -1.671
640 HE2 TYR 89 2HE TYR 89 2.433 12.578 1.353
641 HH TYR 89 HH TYR 89 -0.644 12.061 0.024
642 H MET 90 H MET 90 4.679 9.136 -4.454
643 HA MET 90 HA MET 90 6.516 11.437 -4.115
644 1HB MET 90 2HB MET 90 6.534 9.892 -6.677
645 2HB MET 90 1HB MET 90 7.782 10.909 -5.985
646 1HG MET 90 2HG MET 90 8.332 9.196 -4.373
647 2HG MET 90 1HG MET 90 7.032 8.177 -4.992
648 1HE MET 90 1HE MET 90 7.066 6.983 -7.381
649 2HE MET 90 2HE MET 90 8.322 7.270 -8.590
650 3HE MET 90 3HE MET 90 7.211 8.570 -8.147
651 H ARG 91 H ARG 91 6.439 12.790 -6.220
652 HA ARG 91 HA ARG 91 3.659 13.042 -7.069
653 1HB ARG 91 2HB ARG 91 5.753 14.900 -6.651
654 2HB ARG 91 1HB ARG 91 5.556 14.802 -8.398
655 1HG ARG 91 2HG ARG 91 3.167 15.304 -8.152
656 2HG ARG 91 1HG ARG 91 3.402 15.471 -6.413
657 1HD ARG 91 2HD ARG 91 4.770 17.130 -8.526
658 2HD ARG 91 1HD ARG 91 3.373 17.637 -7.583
659 HE ARG 91 HE ARG 91 5.158 17.055 -5.663
660 1HH1 ARG 91 1HH1 ARG 91 5.380 18.982 -8.579
661 2HH1 ARG 91 2HH1 ARG 91 6.580 20.056 -7.928
662 1HH2 ARG 91 1HH2 ARG 91 6.720 18.514 -4.786
663 2HH2 ARG 91 2HH2 ARG 91 7.326 19.804 -5.791
664 HA PRO 92 HA PRO 92 4.469 9.967 -10.090
665 1HB PRO 92 2HB PRO 92 2.468 10.983 -11.854
666 2HB PRO 92 1HB PRO 92 2.348 9.623 -10.738
667 1HG PRO 92 2HG PRO 92 1.440 12.417 -10.413
668 2HG PRO 92 1HG PRO 92 0.836 10.939 -9.642
669 1HD PRO 92 2HD PRO 92 2.278 12.783 -8.308
670 2HD PRO 92 1HD PRO 92 2.404 11.050 -7.942
671 H TRP 93 H TRP 93 3.882 13.237 -11.416
672 HA TRP 93 HA TRP 93 5.349 12.610 -13.807
673 1HB TRP 93 2HB TRP 93 4.897 15.024 -14.372
674 2HB TRP 93 1HB TRP 93 3.470 14.035 -14.084
675 HD1 TRP 93 HD TRP 93 5.378 17.014 -12.702
676 HE1 TRP 93 1HE TRP 93 3.962 18.142 -10.867
677 HE3 TRP 93 3HE TRP 93 1.687 13.510 -12.277
678 HZ2 TRP 93 2HZ TRP 93 1.590 17.604 -9.437
679 HZ3 TRP 93 3HZ TRP 93 -0.115 13.887 -10.647
680 HH2 TRP 93 HH TRP 93 -0.163 15.896 -9.260
681 H THR 94 H THR 94 6.438 13.292 -10.805
682 HA THR 94 HA THR 94 9.037 13.976 -11.791
683 HB THR 94 HB THR 94 8.377 16.224 -11.736
684 HG1 THR 94 1HG THR 94 9.351 16.925 -9.533
685 1HG2 THR 94 1HG2 THR 94 7.184 17.283 -9.866
686 2HG2 THR 94 2HG2 THR 94 7.053 15.714 -9.071
687 3HG2 THR 94 3HG2 THR 94 6.238 15.996 -10.611
688 H GLY 95 H GLY 95 7.632 14.604 -8.584
689 1HA GLY 95 2HA GLY 95 7.839 13.446 -6.585
690 2HA GLY 95 1HA GLY 95 8.547 12.109 -7.499
691 HA PRO 96 HA PRO 96 11.923 15.649 -6.220
692 1HB PRO 96 2HB PRO 96 11.067 15.952 -3.512
693 2HB PRO 96 1HB PRO 96 11.147 17.184 -4.761
694 1HG PRO 96 2HG PRO 96 8.833 15.600 -3.842
695 2HG PRO 96 1HG PRO 96 8.885 17.232 -4.534
696 1HD PRO 96 2HD PRO 96 7.984 15.160 -5.952
697 2HD PRO 96 1HD PRO 96 8.966 16.434 -6.713
698 H SER 97 H SER 97 13.687 14.594 -5.710
699 HA SER 97 HA SER 97 13.646 11.871 -5.239
700 1HB SER 97 2HB SER 97 15.978 13.734 -4.780
701 2HB SER 97 1HB SER 97 16.058 12.011 -5.146
702 HG SER 97 HG SER 97 14.914 12.592 -7.150
703 H HIS 98 H HIS 98 14.170 14.493 -2.896
704 HA HIS 98 HA HIS 98 14.478 12.420 -0.812
705 1HB HIS 98 2HB HIS 98 15.237 15.337 -0.601
706 2HB HIS 98 1HB HIS 98 15.588 14.069 0.562
707 HD1 HIS 98 1HD HIS 98 17.447 16.038 -1.405
708 HD2 HIS 98 2HD HIS 98 17.050 11.898 -1.359
709 HE1 HIS 98 1HE HIS 98 19.540 15.142 -2.480
710 HE2 HIS 98 2HE HIS 98 19.187 12.650 -2.615
711 H ASP 99 H ASP 99 12.102 14.208 -2.115
712 HA ASP 99 HA ASP 99 11.037 15.154 0.459
713 1HB ASP 99 2HB ASP 99 11.234 16.755 -1.467
714 2HB ASP 99 1HB ASP 99 10.038 15.792 -2.334
715 H SER 100 H SER 100 10.796 12.719 -1.830
716 HA SER 100 HA SER 100 8.036 12.086 -1.556
717 1HB SER 100 2HB SER 100 8.965 9.842 -2.569
718 2HB SER 100 1HB SER 100 8.910 11.305 -3.553
719 HG SER 100 HG SER 100 11.031 11.411 -3.548
720 H GLU 101 H GLU 101 7.045 10.815 -0.150
721 HA GLU 101 HA GLU 101 8.530 9.692 2.090
722 1HB GLU 101 2HB GLU 101 6.482 10.934 2.555
723 2HB GLU 101 1HB GLU 101 5.570 9.906 1.465
724 1HG GLU 101 2HG GLU 101 5.093 9.364 3.771
725 2HG GLU 101 1HG GLU 101 5.887 8.014 2.966
726 H ARG 102 H ARG 102 7.849 7.361 2.762
727 HA ARG 102 HA ARG 102 6.838 5.719 0.627
728 1HB ARG 102 2HB ARG 102 9.350 5.988 0.198
729 2HB ARG 102 1HB ARG 102 9.599 5.047 1.662
730 1HG ARG 102 2HG ARG 102 8.556 3.137 0.712
731 2HG ARG 102 1HG ARG 102 7.979 4.059 -0.673
732 1HD ARG 102 2HD ARG 102 10.465 4.527 -1.129
733 2HD ARG 102 1HD ARG 102 10.772 3.196 -0.017
734 HE ARG 102 HE ARG 102 9.066 2.814 -2.406
735 1HH1 ARG 102 1HH1 ARG 102 11.763 1.884 -0.384
736 2HH1 ARG 102 2HH1 ARG 102 12.272 0.579 -1.412
737 1HH2 ARG 102 1HH2 ARG 102 9.698 1.088 -3.761
738 2HH2 ARG 102 2HH2 ARG 102 11.099 0.138 -3.360
739 H PHE 103 H PHE 103 6.055 3.854 1.258
740 HA PHE 103 HA PHE 103 5.794 3.431 4.148
741 1HB PHE 103 2HB PHE 103 3.665 3.783 3.267
742 2HB PHE 103 1HB PHE 103 4.048 2.986 1.751
743 HD1 PHE 103 1HD PHE 103 2.839 2.600 5.130
744 HD2 PHE 103 2HD PHE 103 4.015 0.556 1.593
745 HE1 PHE 103 1HE PHE 103 1.735 0.562 5.939
746 HE2 PHE 103 2HE PHE 103 2.918 -1.484 2.397
747 HZ PHE 103 HZ PHE 103 1.776 -1.479 4.571
748 H THR 104 H THR 104 5.812 1.201 4.919
749 HA THR 104 HA THR 104 6.696 -0.846 3.128
750 HB THR 104 HB THR 104 8.625 0.230 5.201
751 HG1 THR 104 1HG THR 104 8.345 0.799 2.669
752 1HG2 THR 104 1HG2 THR 104 10.093 -1.630 4.569
753 2HG2 THR 104 2HG2 THR 104 8.822 -2.281 3.535
754 3HG2 THR 104 3HG2 THR 104 8.586 -2.211 5.281
755 H VAL 105 H VAL 105 5.010 -2.107 3.866
756 HA VAL 105 HA VAL 105 5.242 -2.887 6.684
757 HB VAL 105 HB VAL 105 2.962 -2.302 5.856
758 1HG1 VAL 105 1HG1 VAL 105 1.778 -3.915 4.441
759 2HG1 VAL 105 2HG1 VAL 105 3.294 -4.780 4.181
760 3HG1 VAL 105 3HG1 VAL 105 3.110 -3.126 3.594
761 1HG2 VAL 105 1HG2 VAL 105 2.936 -3.589 7.762
762 2HG2 VAL 105 2HG2 VAL 105 3.596 -5.007 6.949
763 3HG2 VAL 105 3HG2 VAL 105 1.924 -4.520 6.662
764 H TYR 106 H TYR 106 6.074 -4.770 7.231
765 HA TYR 106 HA TYR 106 6.737 -6.680 5.105
766 1HB TYR 106 2HB TYR 106 7.873 -6.322 7.878
767 2HB TYR 106 1HB TYR 106 8.235 -7.690 6.843
768 HD1 TYR 106 1HD TYR 106 9.259 -7.151 4.528
769 HD2 TYR 106 2HD TYR 106 9.188 -4.419 7.782
770 HE1 TYR 106 1HE TYR 106 11.067 -5.864 3.478
771 HE2 TYR 106 2HE TYR 106 10.998 -3.123 6.745
772 HH TYR 106 HH TYR 106 11.982 -3.600 3.513
773 H LEU 107 H LEU 107 5.291 -8.243 4.921
774 HA LEU 107 HA LEU 107 4.350 -9.510 7.393
775 1HB LEU 107 2HB LEU 107 2.496 -9.243 5.072
776 2HB LEU 107 1HB LEU 107 2.127 -9.534 6.752
777 HG LEU 107 HG LEU 107 3.349 -6.927 6.246
778 1HD1 LEU 107 1HD1 LEU 107 2.040 -7.154 4.203
779 2HD1 LEU 107 2HD1 LEU 107 1.320 -5.965 5.290
780 3HD1 LEU 107 3HD1 LEU 107 0.616 -7.577 5.155
781 1HD2 LEU 107 1HD2 LEU 107 2.444 -7.581 8.410
782 2HD2 LEU 107 2HD2 LEU 107 0.863 -7.861 7.679
783 3HD2 LEU 107 3HD2 LEU 107 1.531 -6.230 7.737
784 H LYS 108 H LYS 108 3.656 -11.731 7.047
785 HA LYS 108 HA LYS 108 5.047 -12.909 4.747
786 1HB LYS 108 2HB LYS 108 5.881 -13.795 6.785
787 2HB LYS 108 1HB LYS 108 4.264 -14.048 7.424
788 1HG LYS 108 2HG LYS 108 3.918 -15.944 6.199
789 2HG LYS 108 1HG LYS 108 5.026 -15.446 4.918
790 1HD LYS 108 2HD LYS 108 6.929 -15.960 6.291
791 2HD LYS 108 1HD LYS 108 5.904 -16.222 7.701
792 1HE LYS 108 2HE LYS 108 5.797 -17.889 5.194
793 2HE LYS 108 1HE LYS 108 6.741 -18.310 6.619
794 1HZ LYS 108 1HZ LYS 108 4.540 -18.141 7.863
795 2HZ LYS 108 2HZ LYS 108 4.766 -19.482 6.854
796 3HZ LYS 108 3HZ LYS 108 3.802 -18.193 6.337
797 H ALA 109 H ALA 109 3.831 -13.561 3.109
798 HA ALA 109 HA ALA 109 0.936 -13.719 3.565
799 1HB ALA 109 1HB ALA 109 1.678 -11.996 1.983
800 2HB ALA 109 2HB ALA 109 0.707 -13.230 1.180
801 3HB ALA 109 3HB ALA 109 2.461 -13.237 1.003
802 H ASN 110 H ASN 110 -0.110 -15.571 3.272
803 HA ASN 110 HA ASN 110 0.532 -17.719 1.664
804 1HB ASN 110 2HB ASN 110 1.676 -19.301 3.151
805 2HB ASN 110 1HB ASN 110 2.674 -17.885 2.870
806 1HD2 ASN 110 1HD2 ASN 110 1.572 -16.106 4.719
807 2HD2 ASN 110 2HD2 ASN 110 1.830 -16.715 6.314
Start of MODEL 3
1 H HIS 3 H HIS 3 -5.955 -10.040 4.456
2 HA HIS 3 HA HIS 3 -4.941 -9.405 7.121
3 1HB HIS 3 2HB HIS 3 -3.049 -10.624 6.422
4 2HB HIS 3 1HB HIS 3 -3.324 -10.195 4.729
5 HD1 HIS 3 1HD HIS 3 -2.511 -8.215 7.890
6 HD2 HIS 3 2HD HIS 3 -1.400 -8.517 3.880
7 HE1 HIS 3 1HE HIS 3 -0.871 -6.371 7.505
8 HE2 HIS 3 2HE HIS 3 -0.345 -6.450 5.045
9 H LYS 4 H LYS 4 -4.474 -7.205 7.363
10 HA LYS 4 HA LYS 4 -5.105 -5.498 5.052
11 1HB LYS 4 2HB LYS 4 -7.076 -5.898 6.512
12 2HB LYS 4 1HB LYS 4 -6.189 -5.186 7.853
13 1HG LYS 4 2HG LYS 4 -7.358 -3.363 7.209
14 2HG LYS 4 1HG LYS 4 -5.953 -3.183 6.144
15 1HD LYS 4 2HD LYS 4 -7.129 -4.083 4.295
16 2HD LYS 4 1HD LYS 4 -8.444 -4.662 5.320
17 1HE LYS 4 2HE LYS 4 -8.912 -2.253 5.885
18 2HE LYS 4 1HE LYS 4 -7.770 -1.814 4.615
19 1HZ LYS 4 1HZ LYS 4 -9.141 -2.895 2.992
20 2HZ LYS 4 2HZ LYS 4 -10.114 -1.825 3.887
21 3HZ LYS 4 3HZ LYS 4 -10.185 -3.486 4.188
22 H VAL 5 H VAL 5 -3.720 -3.818 4.819
23 HA VAL 5 HA VAL 5 -2.336 -2.894 7.238
24 HB VAL 5 HB VAL 5 -1.226 -3.212 4.474
25 1HG1 VAL 5 1HG1 VAL 5 -0.475 -1.007 6.370
26 2HG1 VAL 5 2HG1 VAL 5 -0.980 -0.857 4.686
27 3HG1 VAL 5 3HG1 VAL 5 0.577 -1.592 5.081
28 1HG2 VAL 5 1HG2 VAL 5 -0.027 -3.395 7.229
29 2HG2 VAL 5 2HG2 VAL 5 0.723 -3.893 5.713
30 3HG2 VAL 5 3HG2 VAL 5 -0.692 -4.755 6.319
31 H THR 6 H THR 6 -2.844 -1.017 7.906
32 HA THR 6 HA THR 6 -3.716 1.065 6.038
33 HB THR 6 HB THR 6 -4.381 2.138 8.381
34 HG1 THR 6 1HG THR 6 -4.905 0.611 9.895
35 1HG2 THR 6 1HG2 THR 6 -6.646 1.190 8.068
36 2HG2 THR 6 2HG2 THR 6 -5.976 0.032 6.916
37 3HG2 THR 6 3HG2 THR 6 -5.931 1.763 6.559
38 H LYS 7 H LYS 7 -3.111 3.308 6.930
39 HA LYS 7 HA LYS 7 -0.580 3.895 6.371
40 1HB LYS 7 2HB LYS 7 -2.345 5.537 6.728
41 2HB LYS 7 1HB LYS 7 -2.231 5.301 8.463
42 1HG LYS 7 2HG LYS 7 -1.108 7.352 7.531
43 2HG LYS 7 1HG LYS 7 -0.118 6.327 8.568
44 1HD LYS 7 2HD LYS 7 0.998 5.377 6.669
45 2HD LYS 7 1HD LYS 7 -0.093 6.195 5.547
46 1HE LYS 7 2HE LYS 7 2.218 7.219 5.884
47 2HE LYS 7 1HE LYS 7 0.836 8.305 6.024
48 1HZ LYS 7 1HZ LYS 7 2.737 8.320 7.798
49 2HZ LYS 7 2HZ LYS 7 1.863 7.021 8.462
50 3HZ LYS 7 3HZ LYS 7 1.116 8.532 8.260
51 H ALA 8 H ALA 8 -1.564 3.092 9.734
52 HA ALA 8 HA ALA 8 0.802 3.759 11.035
53 1HB ALA 8 1HB ALA 8 0.135 2.230 12.780
54 2HB ALA 8 2HB ALA 8 -0.974 1.413 11.681
55 3HB ALA 8 3HB ALA 8 -1.280 3.083 12.164
56 H HIS 9 H HIS 9 0.091 0.960 9.094
57 HA HIS 9 HA HIS 9 2.243 -0.658 9.994
58 1HB HIS 9 2HB HIS 9 0.665 -0.749 7.437
59 2HB HIS 9 1HB HIS 9 1.854 -1.956 7.909
60 HD1 HIS 9 1HD HIS 9 -1.588 -0.790 8.568
61 HD2 HIS 9 2HD HIS 9 1.019 -3.681 10.001
62 HE1 HIS 9 1HE HIS 9 -3.041 -2.493 9.714
63 HE2 HIS 9 2HE HIS 9 -1.443 -4.256 10.561
64 H ASN 10 H ASN 10 2.266 2.185 8.305
65 HA ASN 10 HA ASN 10 4.321 2.130 6.507
66 1HB ASN 10 2HB ASN 10 3.204 4.199 7.120
67 2HB ASN 10 1HB ASN 10 3.822 4.095 8.766
68 1HD2 ASN 10 1HD2 ASN 10 5.694 3.481 5.855
69 2HD2 ASN 10 2HD2 ASN 10 6.738 4.844 6.020
70 H GLY 11 H GLY 11 4.380 1.283 9.835
71 1HA GLY 11 2HA GLY 11 7.225 0.572 9.587
72 2HA GLY 11 1HA GLY 11 6.692 1.446 11.017
73 H ALA 12 H ALA 12 5.519 -1.352 9.109
74 HA ALA 12 HA ALA 12 5.076 -2.738 11.688
75 1HB ALA 12 1HB ALA 12 2.967 -2.346 10.752
76 2HB ALA 12 2HB ALA 12 3.327 -4.031 10.361
77 3HB ALA 12 3HB ALA 12 3.513 -2.774 9.135
78 H THR 13 H THR 13 5.495 -4.919 11.860
79 HA THR 13 HA THR 13 6.566 -6.403 9.575
80 HB THR 13 HB THR 13 8.023 -6.277 12.236
81 HG1 THR 13 1HG THR 13 8.117 -4.605 10.158
82 1HG2 THR 13 1HG2 THR 13 8.725 -7.633 9.628
83 2HG2 THR 13 2HG2 THR 13 8.227 -8.437 11.115
84 3HG2 THR 13 3HG2 THR 13 9.759 -7.563 11.055
85 H LEU 14 H LEU 14 5.189 -8.116 9.505
86 HA LEU 14 HA LEU 14 4.692 -9.751 11.792
87 1HB LEU 14 2HB LEU 14 2.327 -9.392 12.047
88 2HB LEU 14 1HB LEU 14 3.190 -7.899 12.306
89 HG LEU 14 HG LEU 14 1.237 -7.291 11.184
90 1HD1 LEU 14 1HD1 LEU 14 3.358 -7.474 9.071
91 2HD1 LEU 14 2HD1 LEU 14 3.131 -6.167 10.233
92 3HD1 LEU 14 3HD1 LEU 14 1.913 -6.464 8.992
93 1HD2 LEU 14 1HD2 LEU 14 0.467 -9.459 10.482
94 2HD2 LEU 14 2HD2 LEU 14 1.710 -9.528 9.233
95 3HD2 LEU 14 3HD2 LEU 14 0.417 -8.333 9.125
96 H THR 15 H THR 15 3.063 -11.517 11.282
97 HA THR 15 HA THR 15 3.456 -12.350 8.491
98 HB THR 15 HB THR 15 2.709 -13.988 10.921
99 HG1 THR 15 1HG THR 15 4.893 -13.228 10.897
100 1HG2 THR 15 1HG2 THR 15 3.458 -14.910 8.144
101 2HG2 THR 15 2HG2 THR 15 1.804 -14.831 8.758
102 3HG2 THR 15 3HG2 THR 15 2.979 -15.926 9.507
103 H VAL 16 H VAL 16 1.728 -13.105 7.236
104 HA VAL 16 HA VAL 16 -0.939 -12.424 8.286
105 HB VAL 16 HB VAL 16 -1.557 -11.360 6.292
106 1HG1 VAL 16 1HG1 VAL 16 0.110 -9.598 6.018
107 2HG1 VAL 16 2HG1 VAL 16 1.307 -10.601 6.839
108 3HG1 VAL 16 3HG1 VAL 16 -0.106 -10.018 7.717
109 1HG2 VAL 16 1HG2 VAL 16 0.986 -12.337 5.011
110 2HG2 VAL 16 2HG2 VAL 16 -0.228 -11.300 4.258
111 3HG2 VAL 16 3HG2 VAL 16 -0.636 -12.959 4.700
112 H ALA 17 H ALA 17 -2.649 -13.698 7.601
113 HA ALA 17 HA ALA 17 -2.015 -15.996 5.890
114 1HB ALA 17 1HB ALA 17 -3.088 -16.575 7.990
115 2HB ALA 17 2HB ALA 17 -4.212 -16.859 6.658
116 3HB ALA 17 3HB ALA 17 -4.382 -15.423 7.670
117 H VAL 18 H VAL 18 -2.819 -16.033 3.831
118 HA VAL 18 HA VAL 18 -4.730 -13.887 3.168
119 HB VAL 18 HB VAL 18 -3.290 -15.342 1.006
120 1HG1 VAL 18 1HG1 VAL 18 -4.977 -13.695 0.441
121 2HG1 VAL 18 2HG1 VAL 18 -3.383 -13.132 -0.062
122 3HG1 VAL 18 3HG1 VAL 18 -4.132 -12.473 1.393
123 1HG2 VAL 18 1HG2 VAL 18 -1.459 -13.579 1.206
124 2HG2 VAL 18 2HG2 VAL 18 -1.407 -14.949 2.307
125 3HG2 VAL 18 3HG2 VAL 18 -1.999 -13.382 2.881
126 H GLY 19 H GLY 19 -4.971 -15.445 0.524
127 1HA GLY 19 2HA GLY 19 -6.074 -17.541 -0.057
128 2HA GLY 19 1HA GLY 19 -6.886 -17.475 1.505
129 H GLU 20 H GLU 20 -7.861 -15.022 1.704
130 HA GLU 20 HA GLU 20 -9.820 -14.836 -0.439
131 1HB GLU 20 2HB GLU 20 -9.561 -12.930 1.876
132 2HB GLU 20 1HB GLU 20 -10.996 -13.321 0.941
133 1HG GLU 20 2HG GLU 20 -11.148 -15.477 1.976
134 2HG GLU 20 1HG GLU 20 -9.607 -15.226 2.806
135 H LEU 21 H LEU 21 -7.961 -12.374 1.302
136 HA LEU 21 HA LEU 21 -6.840 -11.243 -1.098
137 1HB LEU 21 2HB LEU 21 -9.382 -10.517 -0.540
138 2HB LEU 21 1HB LEU 21 -8.522 -9.380 0.473
139 HG LEU 21 HG LEU 21 -8.439 -9.636 -2.531
140 1HD1 LEU 21 1HD1 LEU 21 -9.176 -7.313 -2.471
141 2HD1 LEU 21 2HD1 LEU 21 -9.171 -7.356 -0.709
142 3HD1 LEU 21 3HD1 LEU 21 -10.296 -8.370 -1.612
143 1HD2 LEU 21 1HD2 LEU 21 -6.154 -9.291 -1.809
144 2HD2 LEU 21 2HD2 LEU 21 -6.659 -7.927 -0.804
145 3HD2 LEU 21 3HD2 LEU 21 -6.795 -7.828 -2.560
146 H VAL 22 H VAL 22 -4.955 -10.187 -0.537
147 HA VAL 22 HA VAL 22 -4.663 -9.426 2.283
148 HB VAL 22 HB VAL 22 -2.843 -10.799 0.502
149 1HG1 VAL 22 1HG1 VAL 22 -0.787 -9.574 0.959
150 2HG1 VAL 22 2HG1 VAL 22 -1.693 -8.309 1.789
151 3HG1 VAL 22 3HG1 VAL 22 -1.903 -8.554 0.055
152 1HG2 VAL 22 1HG2 VAL 22 -1.644 -11.182 2.606
153 2HG2 VAL 22 2HG2 VAL 22 -3.374 -11.491 2.743
154 3HG2 VAL 22 3HG2 VAL 22 -2.690 -10.006 3.402
155 H GLU 23 H GLU 23 -4.844 -7.342 2.706
156 HA GLU 23 HA GLU 23 -4.719 -5.482 0.440
157 1HB GLU 23 2HB GLU 23 -6.178 -5.352 3.063
158 2HB GLU 23 1HB GLU 23 -5.977 -3.950 2.028
159 1HG GLU 23 2HG GLU 23 -7.098 -5.267 0.210
160 2HG GLU 23 1HG GLU 23 -7.481 -6.476 1.438
161 H ILE 24 H ILE 24 -3.441 -3.803 0.397
162 HA ILE 24 HA ILE 24 -2.174 -2.864 2.883
163 HB ILE 24 HB ILE 24 -0.940 -2.770 0.117
164 1HG1 ILE 24 2HG1 ILE 24 -0.971 -5.077 1.017
165 2HG1 ILE 24 1HG1 ILE 24 0.665 -4.435 0.897
166 1HG2 ILE 24 1HG2 ILE 24 1.078 -2.035 1.344
167 2HG2 ILE 24 2HG2 ILE 24 0.114 -1.969 2.820
168 3HG2 ILE 24 3HG2 ILE 24 -0.271 -0.905 1.467
169 1HD1 ILE 24 1HD1 ILE 24 0.315 -5.677 2.964
170 2HD1 ILE 24 2HD1 ILE 24 -0.981 -4.565 3.410
171 3HD1 ILE 24 3HD1 ILE 24 0.677 -3.979 3.276
172 H GLN 25 H GLN 25 -3.434 -1.060 3.274
173 HA GLN 25 HA GLN 25 -4.099 0.588 0.930
174 1HB GLN 25 2HB GLN 25 -6.138 -0.232 1.673
175 2HB GLN 25 1HB GLN 25 -5.698 -0.095 3.377
176 1HG GLN 25 2HG GLN 25 -5.716 2.427 1.932
177 2HG GLN 25 1HG GLN 25 -7.281 1.616 1.960
178 1HE2 GLN 25 1HE2 GLN 25 -4.810 3.117 3.911
179 2HE2 GLN 25 2HE2 GLN 25 -5.756 3.258 5.348
180 H LEU 26 H LEU 26 -3.653 2.687 0.933
181 HA LEU 26 HA LEU 26 -2.626 3.828 3.411
182 1HB LEU 26 2HB LEU 26 -1.823 4.253 0.577
183 2HB LEU 26 1HB LEU 26 -1.661 5.586 1.699
184 HG LEU 26 HG LEU 26 0.447 4.458 1.479
185 1HD1 LEU 26 1HD1 LEU 26 0.874 3.804 3.836
186 2HD1 LEU 26 2HD1 LEU 26 -0.863 3.926 4.132
187 3HD1 LEU 26 3HD1 LEU 26 0.052 5.356 3.647
188 1HD2 LEU 26 1HD2 LEU 26 0.763 2.120 2.126
189 2HD2 LEU 26 2HD2 LEU 26 -0.336 2.275 0.754
190 3HD2 LEU 26 3HD2 LEU 26 -0.979 1.955 2.364
191 HA PRO 27 HA PRO 27 -6.026 6.710 2.983
192 1HB PRO 27 2HB PRO 27 -5.489 8.430 4.870
193 2HB PRO 27 1HB PRO 27 -5.678 6.718 5.328
194 1HG PRO 27 2HG PRO 27 -3.095 8.197 4.752
195 2HG PRO 27 1HG PRO 27 -3.509 7.241 6.196
196 1HD PRO 27 2HD PRO 27 -2.115 6.216 4.104
197 2HD PRO 27 1HD PRO 27 -3.215 5.229 5.091
198 H SER 28 H SER 28 -3.146 7.092 1.727
199 HA SER 28 HA SER 28 -2.217 8.483 0.245
200 1HB SER 28 2HB SER 28 -4.556 10.358 0.518
201 2HB SER 28 1HB SER 28 -3.530 10.084 -0.894
202 HG SER 28 HG SER 28 -4.574 8.311 -1.365
203 H ASN 29 H ASN 29 -3.706 10.251 2.901
204 HA ASN 29 HA ASN 29 -3.036 12.073 4.124
205 1HB ASN 29 2HB ASN 29 -0.167 11.548 3.496
206 2HB ASN 29 1HB ASN 29 -0.884 12.060 5.009
207 1HD2 ASN 29 1HD2 ASN 29 0.097 9.475 3.043
208 2HD2 ASN 29 2HD2 ASN 29 -0.218 8.196 4.152
209 HA PRO 30 HA PRO 30 -2.540 13.802 -0.220
210 1HB PRO 30 2HB PRO 30 -4.570 15.648 0.952
211 2HB PRO 30 1HB PRO 30 -4.514 14.906 -0.655
212 1HG PRO 30 2HG PRO 30 -6.157 13.908 1.134
213 2HG PRO 30 1HG PRO 30 -5.157 12.805 0.166
214 1HD PRO 30 2HD PRO 30 -4.752 13.724 2.982
215 2HD PRO 30 1HD PRO 30 -4.618 12.089 2.302
216 H THR 31 H THR 31 -0.576 14.670 -0.114
217 HA THR 31 HA THR 31 -0.203 17.157 1.381
218 HB THR 31 HB THR 31 1.631 15.947 1.945
219 HG1 THR 31 1HG THR 31 3.276 16.924 1.001
220 1HG2 THR 31 1HG2 THR 31 2.760 14.292 0.443
221 2HG2 THR 31 2HG2 THR 31 1.494 14.585 -0.752
222 3HG2 THR 31 3HG2 THR 31 1.082 13.897 0.824
223 H THR 32 H THR 32 0.324 15.819 -1.871
224 HA THR 32 HA THR 32 -0.379 18.271 -3.136
225 HB THR 32 HB THR 32 1.896 18.865 -2.367
226 HG1 THR 32 1HG THR 32 1.007 19.540 -4.496
227 1HG2 THR 32 1HG2 THR 32 3.862 17.755 -3.303
228 2HG2 THR 32 2HG2 THR 32 2.821 16.571 -4.094
229 3HG2 THR 32 3HG2 THR 32 2.896 16.641 -2.333
230 H GLY 33 H GLY 33 1.363 17.588 -5.505
231 1HA GLY 33 2HA GLY 33 -0.302 15.862 -6.920
232 2HA GLY 33 1HA GLY 33 1.358 16.219 -7.351
233 H PHE 34 H PHE 34 2.326 15.123 -4.791
234 HA PHE 34 HA PHE 34 3.028 12.598 -5.043
235 1HB PHE 34 2HB PHE 34 2.030 14.079 -2.654
236 2HB PHE 34 1HB PHE 34 2.452 12.378 -2.498
237 HD1 PHE 34 1HD PHE 34 4.207 12.824 -0.948
238 HD2 PHE 34 2HD PHE 34 4.226 14.570 -4.823
239 HE1 PHE 34 1HE PHE 34 6.570 13.416 -0.667
240 HE2 PHE 34 2HE PHE 34 6.596 15.158 -4.553
241 HZ PHE 34 HZ PHE 34 7.770 14.580 -2.474
242 H ALA 35 H ALA 35 2.281 10.633 -5.091
243 HA ALA 35 HA ALA 35 -0.279 9.957 -3.908
244 1HB ALA 35 1HB ALA 35 -0.966 8.681 -5.916
245 2HB ALA 35 2HB ALA 35 0.443 9.297 -6.778
246 3HB ALA 35 3HB ALA 35 -0.826 10.406 -6.260
247 H TRP 36 H TRP 36 -0.350 7.672 -3.329
248 HA TRP 36 HA TRP 36 2.318 6.651 -2.839
249 1HB TRP 36 2HB TRP 36 -0.366 5.467 -2.060
250 2HB TRP 36 1HB TRP 36 1.202 4.767 -1.667
251 HD1 TRP 36 HD TRP 36 -1.164 7.575 -0.598
252 HE1 TRP 36 1HE TRP 36 -0.377 8.427 1.680
253 HE3 TRP 36 3HE TRP 36 3.319 5.132 -0.317
254 HZ2 TRP 36 2HZ TRP 36 1.823 8.100 3.401
255 HZ3 TRP 36 3HZ TRP 36 4.721 5.458 1.678
256 HH2 TRP 36 HH TRP 36 3.986 6.920 3.509
257 H TYR 37 H TYR 37 3.334 5.641 -4.411
258 HA TYR 37 HA TYR 37 1.904 3.424 -5.731
259 1HB TYR 37 2HB TYR 37 4.120 5.189 -6.752
260 2HB TYR 37 1HB TYR 37 3.832 3.594 -7.436
261 HD1 TYR 37 1HD TYR 37 2.538 6.991 -7.064
262 HD2 TYR 37 2HD TYR 37 1.875 3.158 -8.795
263 HE1 TYR 37 1HE TYR 37 0.812 7.957 -8.540
264 HE2 TYR 37 2HE TYR 37 0.156 4.109 -10.271
265 HH TYR 37 HH TYR 37 -0.267 7.457 -10.700
266 H PHE 38 H PHE 38 3.707 1.653 -6.377
267 HA PHE 38 HA PHE 38 5.130 0.934 -4.029
268 1HB PHE 38 2HB PHE 38 4.732 -0.173 -6.684
269 2HB PHE 38 1HB PHE 38 6.382 -0.375 -6.117
270 HD1 PHE 38 1HD PHE 38 3.006 -1.528 -5.908
271 HD2 PHE 38 2HD PHE 38 6.751 -1.538 -3.891
272 HE1 PHE 38 1HE PHE 38 2.274 -3.464 -4.577
273 HE2 PHE 38 2HE PHE 38 6.029 -3.478 -2.555
274 HZ PHE 38 HZ PHE 38 3.788 -4.447 -2.900
275 H GLU 39 H GLU 39 6.672 1.318 -7.191
276 HA GLU 39 HA GLU 39 8.800 2.879 -5.892
277 1HB GLU 39 2HB GLU 39 8.849 1.423 -8.547
278 2HB GLU 39 1HB GLU 39 10.209 2.241 -7.792
279 1HG GLU 39 2HG GLU 39 8.777 -0.181 -6.723
280 2HG GLU 39 1HG GLU 39 10.357 -0.163 -7.506
281 H GLY 40 H GLY 40 6.043 3.440 -7.386
282 1HA GLY 40 2HA GLY 40 5.277 5.470 -8.276
283 2HA GLY 40 1HA GLY 40 6.942 5.931 -8.602
284 H GLY 41 H GLY 41 4.087 4.950 -9.986
285 1HA GLY 41 2HA GLY 41 3.649 4.666 -12.257
286 2HA GLY 41 1HA GLY 41 5.376 4.526 -12.548
287 H THR 42 H THR 42 5.384 2.477 -10.267
288 HA THR 42 HA THR 42 4.215 0.231 -11.747
289 HB THR 42 HB THR 42 6.196 -1.049 -10.586
290 HG1 THR 42 1HG THR 42 7.825 1.044 -11.300
291 1HG2 THR 42 1HG2 THR 42 5.745 -1.082 -12.972
292 2HG2 THR 42 2HG2 THR 42 7.473 -0.866 -12.690
293 3HG2 THR 42 3HG2 THR 42 6.476 0.511 -13.159
294 H LYS 43 H LYS 43 3.201 -1.267 -10.632
295 HA LYS 43 HA LYS 43 3.790 -1.575 -7.796
296 1HB LYS 43 2HB LYS 43 1.070 -2.135 -8.002
297 2HB LYS 43 1HB LYS 43 1.796 -0.803 -7.130
298 1HG LYS 43 2HG LYS 43 0.107 0.106 -8.504
299 2HG LYS 43 1HG LYS 43 1.647 0.525 -9.253
300 1HD LYS 43 2HD LYS 43 1.377 -1.354 -10.816
301 2HD LYS 43 1HD LYS 43 -0.181 -1.728 -10.079
302 1HE LYS 43 2HE LYS 43 -1.066 0.410 -10.766
303 2HE LYS 43 1HE LYS 43 0.508 0.891 -11.398
304 1HZ LYS 43 1HZ LYS 43 -1.076 0.105 -13.114
305 2HZ LYS 43 2HZ LYS 43 -1.035 -1.437 -12.409
306 3HZ LYS 43 3HZ LYS 43 0.370 -0.771 -13.077
307 H GLU 44 H GLU 44 4.176 -3.665 -7.361
308 HA GLU 44 HA GLU 44 2.922 -5.682 -9.094
309 1HB GLU 44 2HB GLU 44 5.009 -7.007 -9.020
310 2HB GLU 44 1HB GLU 44 5.212 -5.470 -9.842
311 1HG GLU 44 2HG GLU 44 5.936 -5.800 -6.955
312 2HG GLU 44 1HG GLU 44 7.048 -6.255 -8.243
313 H SER 45 H SER 45 2.647 -7.763 -8.182
314 HA SER 45 HA SER 45 2.698 -7.778 -5.221
315 1HB SER 45 2HB SER 45 0.887 -9.557 -5.527
316 2HB SER 45 1HB SER 45 0.431 -7.898 -5.918
317 HG SER 45 HG SER 45 1.488 -9.317 -8.031
318 HA PRO 46 HA PRO 46 5.745 -11.065 -5.709
319 1HB PRO 46 2HB PRO 46 4.829 -11.654 -2.943
320 2HB PRO 46 1HB PRO 46 6.467 -11.407 -3.556
321 1HG PRO 46 2HG PRO 46 5.239 -9.524 -2.115
322 2HG PRO 46 1HG PRO 46 6.287 -9.099 -3.483
323 1HD PRO 46 2HD PRO 46 3.302 -9.127 -3.314
324 2HD PRO 46 1HD PRO 46 4.378 -8.004 -4.172
325 H ASN 47 H ASN 47 5.298 -12.869 -6.744
326 HA ASN 47 HA ASN 47 4.646 -15.012 -7.095
327 1HB ASN 47 2HB ASN 47 3.106 -14.688 -4.532
328 2HB ASN 47 1HB ASN 47 3.148 -16.180 -5.460
329 1HD2 ASN 47 1HD2 ASN 47 4.101 -15.495 -2.739
330 2HD2 ASN 47 2HD2 ASN 47 5.762 -15.970 -2.711
331 H GLU 48 H GLU 48 3.280 -12.632 -8.122
332 HA GLU 48 HA GLU 48 0.514 -13.334 -8.363
333 1HB GLU 48 2HB GLU 48 0.357 -11.402 -9.815
334 2HB GLU 48 1HB GLU 48 1.325 -11.016 -8.400
335 1HG GLU 48 2HG GLU 48 3.356 -11.182 -9.672
336 2HG GLU 48 1HG GLU 48 2.455 -11.689 -11.101
337 H SER 49 H SER 49 1.795 -15.569 -9.102
338 HA SER 49 HA SER 49 2.161 -15.629 -11.978
339 1HB SER 49 2HB SER 49 2.297 -17.849 -9.927
340 2HB SER 49 1HB SER 49 2.781 -17.979 -11.618
341 HG SER 49 HG SER 49 4.133 -15.979 -10.917
342 H MET 50 H MET 50 -0.203 -16.686 -9.618
343 HA MET 50 HA MET 50 -2.005 -17.422 -11.821
344 1HB MET 50 2HB MET 50 -3.020 -19.120 -10.428
345 2HB MET 50 1HB MET 50 -1.306 -19.418 -10.628
346 1HG MET 50 2HG MET 50 -2.583 -18.177 -8.199
347 2HG MET 50 1HG MET 50 -2.109 -19.867 -8.345
348 1HE MET 50 1HE MET 50 0.522 -18.420 -5.815
349 2HE MET 50 2HE MET 50 -0.685 -19.674 -6.098
350 3HE MET 50 3HE MET 50 -1.185 -17.990 -5.948
351 H PHE 51 H PHE 51 -1.512 -16.006 -8.722
352 HA PHE 51 HA PHE 51 -4.178 -14.811 -8.757
353 1HB PHE 51 2HB PHE 51 -2.316 -15.662 -6.636
354 2HB PHE 51 1HB PHE 51 -3.074 -14.099 -6.335
355 HD1 PHE 51 1HD PHE 51 -4.217 -17.342 -7.805
356 HD2 PHE 51 2HD PHE 51 -4.890 -14.279 -4.920
357 HE1 PHE 51 1HE PHE 51 -6.269 -18.486 -7.076
358 HE2 PHE 51 2HE PHE 51 -6.940 -15.424 -4.188
359 HZ PHE 51 HZ PHE 51 -7.633 -17.523 -5.264
360 H THR 52 H THR 52 -3.917 -12.334 -7.733
361 HA THR 52 HA THR 52 -1.929 -11.086 -9.422
362 HB THR 52 HB THR 52 -3.600 -11.839 -11.039
363 HG1 THR 52 1HG THR 52 -2.537 -9.778 -11.353
364 1HG2 THR 52 1HG2 THR 52 -5.542 -10.158 -9.441
365 2HG2 THR 52 2HG2 THR 52 -5.564 -11.912 -9.611
366 3HG2 THR 52 3HG2 THR 52 -5.880 -10.889 -11.012
367 H VAL 53 H VAL 53 -2.270 -8.685 -9.503
368 HA VAL 53 HA VAL 53 -3.164 -7.851 -6.838
369 HB VAL 53 HB VAL 53 -0.698 -7.715 -7.495
370 1HG1 VAL 53 1HG1 VAL 53 -0.930 -6.765 -9.708
371 2HG1 VAL 53 2HG1 VAL 53 -0.005 -5.678 -8.672
372 3HG1 VAL 53 3HG1 VAL 53 -1.695 -5.325 -9.034
373 1HG2 VAL 53 1HG2 VAL 53 -2.057 -5.233 -6.483
374 2HG2 VAL 53 2HG2 VAL 53 -0.382 -5.710 -6.193
375 3HG2 VAL 53 3HG2 VAL 53 -1.704 -6.677 -5.534
376 H GLU 54 H GLU 54 -4.227 -5.913 -6.575
377 HA GLU 54 HA GLU 54 -5.188 -4.556 -8.999
378 1HB GLU 54 2HB GLU 54 -7.150 -5.510 -8.269
379 2HB GLU 54 1HB GLU 54 -6.673 -5.490 -6.577
380 1HG GLU 54 2HG GLU 54 -7.007 -3.046 -6.558
381 2HG GLU 54 1HG GLU 54 -7.563 -3.134 -8.227
382 H ASN 55 H ASN 55 -5.271 -2.354 -8.928
383 HA ASN 55 HA ASN 55 -4.278 -1.094 -6.462
384 1HB ASN 55 2HB ASN 55 -3.043 0.535 -7.720
385 2HB ASN 55 1HB ASN 55 -2.507 -1.072 -8.195
386 1HD2 ASN 55 1HD2 ASN 55 -3.067 -1.853 -10.257
387 2HD2 ASN 55 2HD2 ASN 55 -3.557 -0.787 -11.532
388 H LYS 56 H LYS 56 -5.368 0.632 -5.760
389 HA LYS 56 HA LYS 56 -7.333 1.933 -7.420
390 1HB LYS 56 2HB LYS 56 -9.006 1.281 -5.395
391 2HB LYS 56 1HB LYS 56 -8.946 0.436 -6.934
392 1HG LYS 56 2HG LYS 56 -8.709 -1.389 -5.664
393 2HG LYS 56 1HG LYS 56 -7.027 -0.869 -5.541
394 1HD LYS 56 2HD LYS 56 -8.010 -1.446 -3.356
395 2HD LYS 56 1HD LYS 56 -7.473 0.234 -3.443
396 1HE LYS 56 2HE LYS 56 -9.720 -0.186 -2.355
397 2HE LYS 56 1HE LYS 56 -9.672 1.033 -3.620
398 1HZ LYS 56 1HZ LYS 56 -10.578 -0.597 -5.176
399 2HZ LYS 56 2HZ LYS 56 -11.602 -0.426 -3.836
400 3HZ LYS 56 3HZ LYS 56 -10.595 -1.779 -3.960
401 H TYR 57 H TYR 57 -6.808 3.932 -6.976
402 HA TYR 57 HA TYR 57 -6.425 4.673 -4.162
403 1HB TYR 57 2HB TYR 57 -5.198 6.326 -6.258
404 2HB TYR 57 1HB TYR 57 -4.655 5.984 -4.628
405 HD1 TYR 57 1HD TYR 57 -4.404 5.065 -8.115
406 HD2 TYR 57 2HD TYR 57 -3.470 3.838 -4.153
407 HE1 TYR 57 1HE TYR 57 -2.743 3.485 -9.001
408 HE2 TYR 57 2HE TYR 57 -1.811 2.255 -5.029
409 HH TYR 57 HH TYR 57 -1.241 1.097 -7.014
410 H PHE 58 H PHE 58 -7.440 6.470 -3.422
411 HA PHE 58 HA PHE 58 -8.904 8.082 -5.406
412 1HB PHE 58 2HB PHE 58 -9.700 7.347 -2.583
413 2HB PHE 58 1HB PHE 58 -10.533 8.560 -3.549
414 HD1 PHE 58 1HD PHE 58 -9.732 4.960 -3.305
415 HD2 PHE 58 2HD PHE 58 -12.118 7.944 -5.179
416 HE1 PHE 58 1HE PHE 58 -11.163 3.204 -4.266
417 HE2 PHE 58 2HE PHE 58 -13.549 6.194 -6.148
418 HZ PHE 58 HZ PHE 58 -13.074 3.820 -5.693
419 HA PRO 59 HA PRO 59 -6.329 11.263 -3.417
420 1HB PRO 59 2HB PRO 59 -6.271 12.413 -6.088
421 2HB PRO 59 1HB PRO 59 -4.921 11.822 -5.113
422 1HG PRO 59 2HG PRO 59 -5.720 10.569 -7.372
423 2HG PRO 59 1HG PRO 59 -5.055 9.693 -5.973
424 1HD PRO 59 2HD PRO 59 -7.948 10.111 -6.727
425 2HD PRO 59 1HD PRO 59 -7.116 8.604 -6.275
426 HA PRO 60 HA PRO 60 -9.924 13.856 -2.963
427 1HB PRO 60 2HB PRO 60 -7.867 15.765 -1.996
428 2HB PRO 60 1HB PRO 60 -9.358 15.217 -1.218
429 1HG PRO 60 2HG PRO 60 -7.086 14.288 -0.345
430 2HG PRO 60 1HG PRO 60 -8.422 13.150 -0.623
431 1HD PRO 60 2HD PRO 60 -6.078 13.744 -2.424
432 2HD PRO 60 1HD PRO 60 -6.706 12.163 -1.898
433 H ASP 61 H ASP 61 -9.948 16.481 -2.950
434 HA ASP 61 HA ASP 61 -9.064 17.740 -5.347
435 1HB ASP 61 2HB ASP 61 -10.710 16.091 -6.302
436 2HB ASP 61 1HB ASP 61 -11.949 16.794 -5.252
437 H SER 62 H SER 62 -12.087 17.507 -3.604
438 HA SER 62 HA SER 62 -11.576 19.747 -1.940
439 1HB SER 62 2HB SER 62 -13.630 21.006 -2.826
440 2HB SER 62 1HB SER 62 -12.175 21.074 -3.823
441 HG SER 62 HG SER 62 -13.076 19.771 -5.290
442 H LYS 63 H LYS 63 -14.566 18.493 -3.331
443 HA LYS 63 HA LYS 63 -15.645 18.013 -0.694
444 1HB LYS 63 2HB LYS 63 -17.700 17.360 -2.077
445 2HB LYS 63 1HB LYS 63 -17.168 19.033 -2.150
446 1HG LYS 63 2HG LYS 63 -17.747 18.333 -4.350
447 2HG LYS 63 1HG LYS 63 -15.994 18.507 -4.277
448 1HD LYS 63 2HD LYS 63 -15.784 16.063 -3.951
449 2HD LYS 63 1HD LYS 63 -17.549 15.926 -4.109
450 1HE LYS 63 2HE LYS 63 -15.605 16.868 -6.213
451 2HE LYS 63 1HE LYS 63 -16.572 15.394 -6.234
452 1HZ LYS 63 1HZ LYS 63 -17.708 16.880 -7.613
453 2HZ LYS 63 2HZ LYS 63 -17.483 18.191 -6.559
454 3HZ LYS 63 3HZ LYS 63 -18.567 16.951 -6.147
455 H LEU 64 H LEU 64 -13.940 16.169 -2.923
456 HA LEU 64 HA LEU 64 -15.253 13.704 -2.893
457 1HB LEU 64 2HB LEU 64 -12.320 14.352 -3.130
458 2HB LEU 64 1HB LEU 64 -12.963 12.738 -3.341
459 HG LEU 64 HG LEU 64 -13.590 15.133 -5.068
460 1HD1 LEU 64 1HD1 LEU 64 -12.387 13.885 -6.791
461 2HD1 LEU 64 2HD1 LEU 64 -12.019 12.619 -5.620
462 3HD1 LEU 64 3HD1 LEU 64 -11.348 14.237 -5.410
463 1HD2 LEU 64 1HD2 LEU 64 -14.787 13.513 -6.482
464 2HD2 LEU 64 2HD2 LEU 64 -15.532 13.695 -4.894
465 3HD2 LEU 64 3HD2 LEU 64 -14.544 12.277 -5.247
466 H LEU 65 H LEU 65 -12.538 14.799 -0.926
467 HA LEU 65 HA LEU 65 -13.490 13.601 1.407
468 1HB LEU 65 2HB LEU 65 -12.937 11.495 0.707
469 2HB LEU 65 1HB LEU 65 -11.663 12.065 -0.335
470 HG LEU 65 HG LEU 65 -10.090 12.107 1.480
471 1HD1 LEU 65 1HD1 LEU 65 -12.372 11.341 3.305
472 2HD1 LEU 65 2HD1 LEU 65 -11.505 12.879 3.318
473 3HD1 LEU 65 3HD1 LEU 65 -10.657 11.384 3.745
474 1HD2 LEU 65 1HD2 LEU 65 -11.773 9.617 1.582
475 2HD2 LEU 65 2HD2 LEU 65 -10.076 9.755 2.043
476 3HD2 LEU 65 3HD2 LEU 65 -10.558 9.990 0.363
477 H GLY 66 H GLY 66 -10.412 14.299 -0.152
478 1HA GLY 66 2HA GLY 66 -9.291 16.322 -0.093
479 2HA GLY 66 1HA GLY 66 -10.448 16.890 1.089
480 H ALA 67 H ALA 67 -10.196 15.583 3.249
481 HA ALA 67 HA ALA 67 -7.805 16.562 4.365
482 1HB ALA 67 1HB ALA 67 -9.736 14.549 5.483
483 2HB ALA 67 2HB ALA 67 -9.885 16.303 5.610
484 3HB ALA 67 3HB ALA 67 -8.548 15.469 6.406
485 H GLY 68 H GLY 68 -8.867 13.170 4.403
486 1HA GLY 68 2HA GLY 68 -6.115 12.405 3.689
487 2HA GLY 68 1HA GLY 68 -6.958 11.605 5.013
488 H GLY 69 H GLY 69 -6.299 11.566 1.729
489 1HA GLY 69 2HA GLY 69 -8.719 10.571 0.661
490 2HA GLY 69 1HA GLY 69 -7.141 10.482 -0.100
491 H THR 70 H THR 70 -7.519 8.404 -0.877
492 HA THR 70 HA THR 70 -6.952 6.324 1.013
493 HB THR 70 HB THR 70 -9.042 5.074 -0.191
494 HG1 THR 70 1HG THR 70 -9.630 7.814 0.027
495 1HG2 THR 70 1HG2 THR 70 -10.135 5.256 1.979
496 2HG2 THR 70 2HG2 THR 70 -9.095 6.620 2.398
497 3HG2 THR 70 3HG2 THR 70 -8.396 5.015 2.170
498 H GLU 71 H GLU 71 -5.108 6.147 -0.285
499 HA GLU 71 HA GLU 71 -5.521 4.965 -2.946
500 1HB GLU 71 2HB GLU 71 -2.996 5.886 -1.559
501 2HB GLU 71 1HB GLU 71 -3.090 5.281 -3.207
502 1HG GLU 71 2HG GLU 71 -4.478 7.161 -3.845
503 2HG GLU 71 1HG GLU 71 -4.465 7.752 -2.183
504 H HIS 72 H HIS 72 -5.805 2.758 -2.850
505 HA HIS 72 HA HIS 72 -4.262 1.378 -0.751
506 1HB HIS 72 2HB HIS 72 -6.559 -0.064 -1.950
507 2HB HIS 72 1HB HIS 72 -5.874 -0.140 -0.339
508 HD1 HIS 72 1HD HIS 72 -8.398 -0.233 0.374
509 HD2 HIS 72 2HD HIS 72 -7.110 3.392 -1.146
510 HE1 HIS 72 1HE HIS 72 -10.136 1.418 1.031
511 HE2 HIS 72 2HE HIS 72 -9.520 3.522 -0.193
512 H PHE 73 H PHE 73 -3.359 -0.559 -1.147
513 HA PHE 73 HA PHE 73 -3.119 -1.449 -3.940
514 1HB PHE 73 2HB PHE 73 -1.233 -1.523 -1.593
515 2HB PHE 73 1HB PHE 73 -1.005 -2.594 -2.971
516 HD1 PHE 73 1HD PHE 73 0.124 -1.841 -4.854
517 HD2 PHE 73 2HD PHE 73 -1.346 0.982 -2.035
518 HE1 PHE 73 1HE PHE 73 1.311 -0.041 -6.042
519 HE2 PHE 73 2HE PHE 73 -0.154 2.785 -3.209
520 HZ PHE 73 HZ PHE 73 1.151 2.289 -5.213
521 H HIS 74 H HIS 74 -4.168 -3.303 -4.339
522 HA HIS 74 HA HIS 74 -4.803 -5.030 -2.031
523 1HB HIS 74 2HB HIS 74 -6.357 -4.333 -4.503
524 2HB HIS 74 1HB HIS 74 -6.678 -5.830 -3.644
525 HD1 HIS 74 1HD HIS 74 -9.073 -4.659 -3.436
526 HD2 HIS 74 2HD HIS 74 -6.018 -2.962 -1.173
527 HE1 HIS 74 1HE HIS 74 -10.215 -3.394 -1.597
528 HE2 HIS 74 2HE HIS 74 -8.344 -2.726 -0.055
529 H VAL 75 H VAL 75 -3.278 -6.676 -2.112
530 HA VAL 75 HA VAL 75 -2.930 -7.899 -4.752
531 HB VAL 75 HB VAL 75 -0.742 -7.634 -4.286
532 1HG1 VAL 75 1HG1 VAL 75 -1.207 -6.354 -2.215
533 2HG1 VAL 75 2HG1 VAL 75 0.279 -7.309 -2.177
534 3HG1 VAL 75 3HG1 VAL 75 -1.162 -7.878 -1.322
535 1HG2 VAL 75 1HG2 VAL 75 -1.236 -10.044 -2.541
536 2HG2 VAL 75 2HG2 VAL 75 0.297 -9.588 -3.286
537 3HG2 VAL 75 3HG2 VAL 75 -1.072 -10.056 -4.301
538 H THR 76 H THR 76 -3.977 -9.612 -5.147
539 HA THR 76 HA THR 76 -4.945 -11.265 -2.923
540 HB THR 76 HB THR 76 -5.859 -11.351 -5.810
541 HG1 THR 76 1HG THR 76 -6.150 -9.259 -4.586
542 1HG2 THR 76 1HG2 THR 76 -7.162 -12.266 -3.241
543 2HG2 THR 76 2HG2 THR 76 -6.434 -13.308 -4.463
544 3HG2 THR 76 3HG2 THR 76 -7.875 -12.372 -4.852
545 H VAL 77 H VAL 77 -3.402 -12.731 -2.529
546 HA VAL 77 HA VAL 77 -2.708 -14.602 -4.641
547 HB VAL 77 HB VAL 77 -0.920 -12.910 -4.789
548 1HG1 VAL 77 1HG1 VAL 77 -0.359 -13.603 -1.906
549 2HG1 VAL 77 2HG1 VAL 77 -0.990 -12.068 -2.504
550 3HG1 VAL 77 3HG1 VAL 77 0.642 -12.578 -2.934
551 1HG2 VAL 77 1HG2 VAL 77 0.994 -14.403 -4.553
552 2HG2 VAL 77 2HG2 VAL 77 -0.385 -15.248 -5.261
553 3HG2 VAL 77 3HG2 VAL 77 0.029 -15.498 -3.563
554 H LYS 78 H LYS 78 -2.323 -16.670 -3.827
555 HA LYS 78 HA LYS 78 -1.753 -16.803 -0.975
556 1HB LYS 78 2HB LYS 78 -3.159 -18.612 -0.539
557 2HB LYS 78 1HB LYS 78 -4.137 -17.495 -1.465
558 1HG LYS 78 2HG LYS 78 -2.793 -19.924 -2.631
559 2HG LYS 78 1HG LYS 78 -4.453 -19.892 -2.044
560 1HD LYS 78 2HD LYS 78 -5.018 -18.197 -3.699
561 2HD LYS 78 1HD LYS 78 -3.344 -18.175 -4.261
562 1HE LYS 78 2HE LYS 78 -4.719 -19.526 -5.739
563 2HE LYS 78 1HE LYS 78 -3.537 -20.532 -4.905
564 1HZ LYS 78 1HZ LYS 78 -5.270 -21.217 -3.358
565 2HZ LYS 78 2HZ LYS 78 -5.700 -21.583 -4.959
566 3HZ LYS 78 3HZ LYS 78 -6.407 -20.255 -4.177
567 H ALA 79 H ALA 79 0.293 -17.241 -0.950
568 HA ALA 79 HA ALA 79 1.249 -19.782 -1.778
569 1HB ALA 79 1HB ALA 79 2.389 -17.382 -3.221
570 2HB ALA 79 2HB ALA 79 1.369 -18.620 -3.954
571 3HB ALA 79 3HB ALA 79 2.970 -19.042 -3.347
572 H ALA 80 H ALA 80 3.273 -20.256 -0.798
573 HA ALA 80 HA ALA 80 3.619 -18.750 1.623
574 1HB ALA 80 1HB ALA 80 3.752 -21.204 1.576
575 2HB ALA 80 2HB ALA 80 5.207 -20.467 2.249
576 3HB ALA 80 3HB ALA 80 5.217 -21.092 0.601
577 H GLY 81 H GLY 81 4.411 -16.766 1.147
578 1HA GLY 81 2HA GLY 81 7.276 -16.645 0.576
579 2HA GLY 81 1HA GLY 81 6.216 -15.780 -0.532
580 H THR 82 H THR 82 8.097 -14.368 0.906
581 HA THR 82 HA THR 82 6.515 -13.141 3.057
582 HB THR 82 HB THR 82 9.336 -12.351 2.357
583 HG1 THR 82 1HG THR 82 10.043 -14.198 3.122
584 1HG2 THR 82 1HG2 THR 82 7.704 -12.325 4.900
585 2HG2 THR 82 2HG2 THR 82 8.113 -10.927 3.905
586 3HG2 THR 82 3HG2 THR 82 9.382 -11.796 4.768
587 H HIS 83 H HIS 83 5.615 -11.206 2.814
588 HA HIS 83 HA HIS 83 5.881 -9.933 0.177
589 1HB HIS 83 2HB HIS 83 3.604 -10.845 1.063
590 2HB HIS 83 1HB HIS 83 3.650 -9.469 2.152
591 HD1 HIS 83 1HD HIS 83 4.328 -7.124 0.544
592 HD2 HIS 83 2HD HIS 83 2.004 -10.200 -1.013
593 HE1 HIS 83 1HE HIS 83 3.035 -6.091 -1.352
594 HE2 HIS 83 2HE HIS 83 1.537 -7.941 -2.189
595 H ALA 84 H ALA 84 7.424 -8.386 0.409
596 HA ALA 84 HA ALA 84 7.246 -6.606 2.732
597 1HB ALA 84 1HB ALA 84 9.465 -7.536 2.238
598 2HB ALA 84 2HB ALA 84 9.450 -5.784 2.044
599 3HB ALA 84 3HB ALA 84 9.402 -6.830 0.624
600 H VAL 85 H VAL 85 6.273 -4.693 2.505
601 HA VAL 85 HA VAL 85 5.703 -3.833 -0.260
602 HB VAL 85 HB VAL 85 4.029 -2.936 2.033
603 1HG1 VAL 85 1HG1 VAL 85 3.400 -3.581 -0.840
604 2HG1 VAL 85 2HG1 VAL 85 3.676 -1.973 -0.171
605 3HG1 VAL 85 3HG1 VAL 85 2.273 -2.911 0.340
606 1HG2 VAL 85 1HG2 VAL 85 2.574 -4.888 1.823
607 2HG2 VAL 85 2HG2 VAL 85 4.187 -5.334 2.386
608 3HG2 VAL 85 3HG2 VAL 85 3.727 -5.624 0.707
609 H ASN 86 H ASN 86 7.263 -2.359 -0.618
610 HA ASN 86 HA ASN 86 7.386 -0.052 1.224
611 1HB ASN 86 2HB ASN 86 9.318 -0.946 -0.943
612 2HB ASN 86 1HB ASN 86 9.470 0.552 -0.039
613 1HD2 ASN 86 1HD2 ASN 86 8.477 -2.544 1.308
614 2HD2 ASN 86 2HD2 ASN 86 9.872 -2.760 2.305
615 H LEU 87 H LEU 87 5.859 1.302 0.617
616 HA LEU 87 HA LEU 87 5.392 1.725 -2.249
617 1HB LEU 87 2HB LEU 87 3.646 2.340 0.138
618 2HB LEU 87 1HB LEU 87 3.232 2.695 -1.531
619 HG LEU 87 HG LEU 87 3.742 -0.101 -0.514
620 1HD1 LEU 87 1HD1 LEU 87 1.342 -0.392 -0.469
621 2HD1 LEU 87 2HD1 LEU 87 1.103 1.285 -0.959
622 3HD1 LEU 87 3HD1 LEU 87 1.806 0.917 0.618
623 1HD2 LEU 87 1HD2 LEU 87 2.651 -0.765 -2.566
624 2HD2 LEU 87 2HD2 LEU 87 4.064 0.235 -2.903
625 3HD2 LEU 87 3HD2 LEU 87 2.445 0.927 -3.022
626 H THR 88 H THR 88 5.944 3.599 -3.127
627 HA THR 88 HA THR 88 7.139 5.572 -1.327
628 HB THR 88 HB THR 88 7.594 5.350 -4.303
629 HG1 THR 88 1HG THR 88 8.257 3.385 -3.540
630 1HG2 THR 88 1HG2 THR 88 8.321 7.429 -3.183
631 2HG2 THR 88 2HG2 THR 88 9.694 6.487 -3.764
632 3HG2 THR 88 3HG2 THR 88 9.274 6.472 -2.051
633 H TYR 89 H TYR 89 6.085 7.303 -0.957
634 HA TYR 89 HA TYR 89 3.783 8.104 -2.515
635 1HB TYR 89 2HB TYR 89 3.911 8.036 0.032
636 2HB TYR 89 1HB TYR 89 4.970 9.434 -0.070
637 HD1 TYR 89 1HD TYR 89 2.206 9.096 -2.414
638 HD2 TYR 89 2HD TYR 89 3.437 10.731 1.301
639 HE1 TYR 89 1HE TYR 89 0.234 10.553 -2.416
640 HE2 TYR 89 2HE TYR 89 1.469 12.197 1.311
641 HH TYR 89 HH TYR 89 -1.138 11.782 -0.875
642 H MET 90 H MET 90 4.457 9.049 -4.407
643 HA MET 90 HA MET 90 6.114 11.473 -4.148
644 1HB MET 90 2HB MET 90 6.542 9.809 -6.574
645 2HB MET 90 1HB MET 90 7.634 10.920 -5.772
646 1HG MET 90 2HG MET 90 8.120 9.302 -4.068
647 2HG MET 90 1HG MET 90 6.934 8.186 -4.745
648 1HE MET 90 1HE MET 90 7.169 7.090 -7.177
649 2HE MET 90 2HE MET 90 8.527 7.418 -8.255
650 3HE MET 90 3HE MET 90 7.391 8.705 -7.853
651 H ARG 91 H ARG 91 5.990 12.823 -6.078
652 HA ARG 91 HA ARG 91 3.425 12.979 -7.299
653 1HB ARG 91 2HB ARG 91 5.956 14.466 -7.299
654 2HB ARG 91 1HB ARG 91 5.191 14.419 -8.886
655 1HG ARG 91 2HG ARG 91 3.248 15.500 -8.105
656 2HG ARG 91 1HG ARG 91 3.674 15.213 -6.418
657 1HD ARG 91 2HD ARG 91 5.407 16.891 -8.207
658 2HD ARG 91 1HD ARG 91 4.007 17.576 -7.383
659 HE ARG 91 HE ARG 91 5.648 16.206 -5.530
660 1HH1 ARG 91 1HH1 ARG 91 5.535 19.110 -7.456
661 2HH1 ARG 91 2HH1 ARG 91 6.478 20.051 -6.338
662 1HH2 ARG 91 1HH2 ARG 91 6.911 17.443 -4.021
663 2HH2 ARG 91 2HH2 ARG 91 7.279 19.099 -4.403
664 HA PRO 92 HA PRO 92 4.260 9.223 -9.544
665 1HB PRO 92 2HB PRO 92 2.262 9.715 -11.487
666 2HB PRO 92 1HB PRO 92 2.125 8.733 -10.029
667 1HG PRO 92 2HG PRO 92 1.294 11.542 -10.505
668 2HG PRO 92 1HG PRO 92 0.582 10.320 -9.438
669 1HD PRO 92 2HD PRO 92 2.019 12.354 -8.462
670 2HD PRO 92 1HD PRO 92 2.123 10.729 -7.748
671 H TRP 93 H TRP 93 3.896 12.233 -11.393
672 HA TRP 93 HA TRP 93 5.080 11.065 -13.737
673 1HB TRP 93 2HB TRP 93 4.872 13.376 -14.665
674 2HB TRP 93 1HB TRP 93 3.362 12.694 -14.074
675 HD1 TRP 93 HD TRP 93 5.815 15.519 -13.443
676 HE1 TRP 93 1HE TRP 93 4.815 17.141 -11.706
677 HE3 TRP 93 3HE TRP 93 1.767 12.758 -12.022
678 HZ2 TRP 93 2HZ TRP 93 2.579 17.229 -9.977
679 HZ3 TRP 93 3HZ TRP 93 0.245 13.671 -10.325
680 HH2 TRP 93 HH TRP 93 0.640 15.866 -9.323
681 H THR 94 H THR 94 6.442 12.119 -10.923
682 HA THR 94 HA THR 94 9.054 12.153 -12.074
683 HB THR 94 HB THR 94 8.655 14.437 -12.593
684 HG1 THR 94 1HG THR 94 10.688 14.000 -11.554
685 1HG2 THR 94 1HG2 THR 94 7.708 14.821 -9.753
686 2HG2 THR 94 2HG2 THR 94 6.707 14.864 -11.205
687 3HG2 THR 94 3HG2 THR 94 7.930 16.105 -10.939
688 H GLY 95 H GLY 95 7.541 13.497 -9.113
689 1HA GLY 95 2HA GLY 95 7.712 12.845 -6.907
690 2HA GLY 95 1HA GLY 95 8.437 11.338 -7.482
691 HA PRO 96 HA PRO 96 11.767 15.082 -6.836
692 1HB PRO 96 2HB PRO 96 10.301 15.606 -4.274
693 2HB PRO 96 1HB PRO 96 11.295 16.698 -5.235
694 1HG PRO 96 2HG PRO 96 8.676 16.844 -5.379
695 2HG PRO 96 1HG PRO 96 9.657 17.005 -6.843
696 1HD PRO 96 2HD PRO 96 7.973 14.736 -5.928
697 2HD PRO 96 1HD PRO 96 8.369 15.260 -7.577
698 H SER 97 H SER 97 13.375 13.733 -6.407
699 HA SER 97 HA SER 97 13.181 11.568 -4.548
700 1HB SER 97 2HB SER 97 15.643 12.593 -5.977
701 2HB SER 97 1HB SER 97 15.389 10.975 -5.320
702 HG SER 97 HG SER 97 14.818 10.638 -7.350
703 H HIS 98 H HIS 98 12.664 13.512 -2.973
704 HA HIS 98 HA HIS 98 14.588 13.569 -0.940
705 1HB HIS 98 2HB HIS 98 15.380 15.833 -0.967
706 2HB HIS 98 1HB HIS 98 15.693 15.177 -2.569
707 HD1 HIS 98 1HD HIS 98 13.919 17.875 -0.795
708 HD2 HIS 98 2HD HIS 98 13.949 16.229 -4.618
709 HE1 HIS 98 1HE HIS 98 12.711 19.534 -2.260
710 HE2 HIS 98 2HE HIS 98 12.653 18.475 -4.553
711 H ASP 99 H ASP 99 11.681 14.519 -2.458
712 HA ASP 99 HA ASP 99 10.672 15.784 0.000
713 1HB ASP 99 2HB ASP 99 10.619 17.172 -2.026
714 2HB ASP 99 1HB ASP 99 9.697 15.939 -2.869
715 H SER 100 H SER 100 10.574 13.029 -1.933
716 HA SER 100 HA SER 100 7.870 12.240 -1.570
717 1HB SER 100 2HB SER 100 8.816 10.011 -2.413
718 2HB SER 100 1HB SER 100 8.948 11.406 -3.486
719 HG SER 100 HG SER 100 10.892 9.910 -2.877
720 H GLU 101 H GLU 101 6.972 10.800 -0.194
721 HA GLU 101 HA GLU 101 8.592 9.921 2.099
722 1HB GLU 101 2HB GLU 101 6.604 11.298 2.624
723 2HB GLU 101 1HB GLU 101 5.582 10.141 1.789
724 1HG GLU 101 2HG GLU 101 5.482 9.940 4.236
725 2HG GLU 101 1HG GLU 101 6.030 8.464 3.446
726 H ARG 102 H ARG 102 7.752 7.646 2.952
727 HA ARG 102 HA ARG 102 6.805 5.922 0.828
728 1HB ARG 102 2HB ARG 102 9.351 6.231 0.570
729 2HB ARG 102 1HB ARG 102 9.503 5.322 2.062
730 1HG ARG 102 2HG ARG 102 8.516 3.377 1.045
731 2HG ARG 102 1HG ARG 102 8.171 4.283 -0.432
732 1HD ARG 102 2HD ARG 102 10.661 4.699 -0.604
733 2HD ARG 102 1HD ARG 102 10.861 3.519 0.689
734 HE ARG 102 HE ARG 102 9.384 2.636 -1.677
735 1HH1 ARG 102 1HH1 ARG 102 12.430 2.748 0.053
736 2HH1 ARG 102 2HH1 ARG 102 13.124 1.411 -0.812
737 1HH2 ARG 102 1HH2 ARG 102 10.317 0.881 -2.860
738 2HH2 ARG 102 2HH2 ARG 102 11.921 0.350 -2.449
739 H PHE 103 H PHE 103 5.922 4.131 1.512
740 HA PHE 103 HA PHE 103 5.587 3.766 4.406
741 1HB PHE 103 2HB PHE 103 3.443 4.014 3.550
742 2HB PHE 103 1HB PHE 103 3.879 3.336 1.987
743 HD1 PHE 103 1HD PHE 103 2.697 2.650 5.346
744 HD2 PHE 103 2HD PHE 103 3.895 0.946 1.641
745 HE1 PHE 103 1HE PHE 103 1.674 0.516 5.998
746 HE2 PHE 103 2HE PHE 103 2.879 -1.191 2.287
747 HZ PHE 103 HZ PHE 103 1.769 -1.404 4.466
748 H THR 104 H THR 104 5.572 1.515 5.202
749 HA THR 104 HA THR 104 6.632 -0.510 3.468
750 HB THR 104 HB THR 104 8.373 0.573 5.699
751 HG1 THR 104 1HG THR 104 8.241 1.151 3.078
752 1HG2 THR 104 1HG2 THR 104 8.780 -1.804 3.886
753 2HG2 THR 104 2HG2 THR 104 8.475 -1.850 5.622
754 3HG2 THR 104 3HG2 THR 104 9.977 -1.156 5.012
755 H VAL 105 H VAL 105 4.929 -1.853 4.134
756 HA VAL 105 HA VAL 105 5.192 -2.708 6.934
757 HB VAL 105 HB VAL 105 2.871 -2.283 6.197
758 1HG1 VAL 105 1HG1 VAL 105 1.798 -3.764 4.586
759 2HG1 VAL 105 2HG1 VAL 105 3.342 -4.558 4.276
760 3HG1 VAL 105 3HG1 VAL 105 3.120 -2.863 3.842
761 1HG2 VAL 105 1HG2 VAL 105 3.348 -3.934 7.945
762 2HG2 VAL 105 2HG2 VAL 105 3.432 -5.202 6.725
763 3HG2 VAL 105 3HG2 VAL 105 1.911 -4.354 7.017
764 H TYR 106 H TYR 106 6.067 -4.584 7.440
765 HA TYR 106 HA TYR 106 7.035 -6.294 5.257
766 1HB TYR 106 2HB TYR 106 7.891 -6.111 8.148
767 2HB TYR 106 1HB TYR 106 8.526 -7.258 6.988
768 HD1 TYR 106 1HD TYR 106 9.579 -6.202 4.835
769 HD2 TYR 106 2HD TYR 106 9.029 -4.119 8.503
770 HE1 TYR 106 1HE TYR 106 11.283 -4.568 4.153
771 HE2 TYR 106 2HE TYR 106 10.732 -2.477 7.829
772 HH TYR 106 HH TYR 106 12.743 -2.440 6.246
773 H LEU 107 H LEU 107 5.544 -7.823 4.867
774 HA LEU 107 HA LEU 107 4.427 -9.217 7.195
775 1HB LEU 107 2HB LEU 107 2.269 -9.310 6.138
776 2HB LEU 107 1HB LEU 107 2.791 -7.646 6.245
777 HG LEU 107 HG LEU 107 3.664 -8.454 3.735
778 1HD1 LEU 107 1HD1 LEU 107 2.305 -10.466 3.875
779 2HD1 LEU 107 2HD1 LEU 107 1.660 -9.352 2.667
780 3HD1 LEU 107 3HD1 LEU 107 0.882 -9.491 4.244
781 1HD2 LEU 107 1HD2 LEU 107 1.162 -6.973 4.512
782 2HD2 LEU 107 2HD2 LEU 107 1.951 -6.925 2.935
783 3HD2 LEU 107 3HD2 LEU 107 2.775 -6.274 4.351
784 H LYS 108 H LYS 108 3.859 -11.427 6.837
785 HA LYS 108 HA LYS 108 5.331 -12.631 4.584
786 1HB LYS 108 2HB LYS 108 6.005 -13.392 6.825
787 2HB LYS 108 1HB LYS 108 4.349 -13.858 7.167
788 1HG LYS 108 2HG LYS 108 5.298 -15.872 6.606
789 2HG LYS 108 1HG LYS 108 4.599 -15.350 5.068
790 1HD LYS 108 2HD LYS 108 6.757 -14.498 4.352
791 2HD LYS 108 1HD LYS 108 7.466 -14.965 5.896
792 1HE LYS 108 2HE LYS 108 6.232 -16.857 3.899
793 2HE LYS 108 1HE LYS 108 7.959 -16.578 4.101
794 1HZ LYS 108 1HZ LYS 108 7.365 -18.543 5.278
795 2HZ LYS 108 2HZ LYS 108 6.101 -17.764 6.091
796 3HZ LYS 108 3HZ LYS 108 7.710 -17.345 6.428
797 H ALA 109 H ALA 109 4.096 -13.311 2.911
798 HA ALA 109 HA ALA 109 1.213 -13.510 3.400
799 1HB ALA 109 1HB ALA 109 1.901 -11.788 1.792
800 2HB ALA 109 2HB ALA 109 0.911 -13.027 1.027
801 3HB ALA 109 3HB ALA 109 2.659 -13.027 0.794
802 H ASN 110 H ASN 110 0.202 -15.388 3.190
803 HA ASN 110 HA ASN 110 1.167 -17.458 1.455
804 1HB ASN 110 2HB ASN 110 1.442 -19.145 3.273
805 2HB ASN 110 1HB ASN 110 2.662 -17.877 3.304
806 1HD2 ASN 110 1HD2 ASN 110 2.585 -16.317 4.943
807 2HD2 ASN 110 2HD2 ASN 110 1.700 -16.575 6.401
Start of MODEL 4
1 H HIS 3 H HIS 3 -6.656 -9.993 4.514
2 HA HIS 3 HA HIS 3 -5.716 -9.058 7.107
3 1HB HIS 3 2HB HIS 3 -3.948 -10.643 6.680
4 2HB HIS 3 1HB HIS 3 -3.937 -10.241 4.961
5 HD1 HIS 3 1HD HIS 3 -3.249 -8.408 8.236
6 HD2 HIS 3 2HD HIS 3 -1.855 -8.645 4.314
7 HE1 HIS 3 1HE HIS 3 -1.422 -6.691 8.063
8 HE2 HIS 3 2HE HIS 3 -0.699 -6.744 5.650
9 H LYS 4 H LYS 4 -5.134 -6.852 7.019
10 HA LYS 4 HA LYS 4 -4.736 -5.666 4.383
11 1HB LYS 4 2HB LYS 4 -6.275 -3.847 4.757
12 2HB LYS 4 1HB LYS 4 -7.141 -5.372 4.883
13 1HG LYS 4 2HG LYS 4 -7.226 -5.208 7.261
14 2HG LYS 4 1HG LYS 4 -6.135 -3.821 7.255
15 1HD LYS 4 2HD LYS 4 -8.452 -3.122 7.576
16 2HD LYS 4 1HD LYS 4 -7.797 -2.498 6.061
17 1HE LYS 4 2HE LYS 4 -8.873 -4.464 4.917
18 2HE LYS 4 1HE LYS 4 -9.686 -4.806 6.444
19 1HZ LYS 4 1HZ LYS 4 -10.646 -2.564 6.358
20 2HZ LYS 4 2HZ LYS 4 -11.122 -3.525 5.040
21 3HZ LYS 4 3HZ LYS 4 -9.937 -2.327 4.836
22 H VAL 5 H VAL 5 -3.565 -3.710 4.414
23 HA VAL 5 HA VAL 5 -2.416 -3.023 7.034
24 HB VAL 5 HB VAL 5 -1.113 -3.213 4.362
25 1HG1 VAL 5 1HG1 VAL 5 -0.424 -1.096 6.380
26 2HG1 VAL 5 2HG1 VAL 5 -0.856 -0.864 4.687
27 3HG1 VAL 5 3HG1 VAL 5 0.673 -1.641 5.113
28 1HG2 VAL 5 1HG2 VAL 5 -0.083 -3.501 7.177
29 2HG2 VAL 5 2HG2 VAL 5 0.734 -3.998 5.695
30 3HG2 VAL 5 3HG2 VAL 5 -0.742 -4.822 6.205
31 H THR 6 H THR 6 -2.670 -1.063 7.777
32 HA THR 6 HA THR 6 -3.541 1.080 5.985
33 HB THR 6 HB THR 6 -4.228 2.102 8.338
34 HG1 THR 6 1HG THR 6 -5.097 -0.384 9.052
35 1HG2 THR 6 1HG2 THR 6 -5.746 1.742 6.466
36 2HG2 THR 6 2HG2 THR 6 -6.494 1.181 7.963
37 3HG2 THR 6 3HG2 THR 6 -5.812 0.016 6.828
38 H LYS 7 H LYS 7 -2.900 3.316 7.033
39 HA LYS 7 HA LYS 7 -0.375 3.842 6.344
40 1HB LYS 7 2HB LYS 7 -2.018 5.553 6.852
41 2HB LYS 7 1HB LYS 7 -1.857 5.224 8.570
42 1HG LYS 7 2HG LYS 7 -0.651 7.256 7.726
43 2HG LYS 7 1HG LYS 7 0.335 6.109 8.633
44 1HD LYS 7 2HD LYS 7 1.303 5.248 6.622
45 2HD LYS 7 1HD LYS 7 0.182 6.170 5.613
46 1HE LYS 7 2HE LYS 7 2.449 7.167 5.725
47 2HE LYS 7 1HE LYS 7 1.194 8.245 6.327
48 1HZ LYS 7 1HZ LYS 7 2.882 6.564 8.104
49 2HZ LYS 7 2HZ LYS 7 1.842 7.821 8.558
50 3HZ LYS 7 3HZ LYS 7 3.258 8.165 7.694
51 H ALA 8 H ALA 8 -1.179 3.015 9.760
52 HA ALA 8 HA ALA 8 1.313 3.663 10.842
53 1HB ALA 8 1HB ALA 8 -0.664 3.198 12.200
54 2HB ALA 8 2HB ALA 8 0.731 2.257 12.726
55 3HB ALA 8 3HB ALA 8 -0.543 1.488 11.781
56 H HIS 9 H HIS 9 0.305 0.783 9.151
57 HA HIS 9 HA HIS 9 2.468 -0.888 9.881
58 1HB HIS 9 2HB HIS 9 0.782 -0.918 7.391
59 2HB HIS 9 1HB HIS 9 1.915 -2.180 7.842
60 HD1 HIS 9 1HD HIS 9 -1.459 -0.890 8.494
61 HD2 HIS 9 2HD HIS 9 1.066 -3.774 10.061
62 HE1 HIS 9 1HE HIS 9 -2.960 -2.533 9.654
63 HE2 HIS 9 2HE HIS 9 -1.366 -4.051 10.898
64 H ASN 10 H ASN 10 2.471 1.936 8.138
65 HA ASN 10 HA ASN 10 4.365 1.808 6.185
66 1HB ASN 10 2HB ASN 10 3.381 3.917 6.853
67 2HB ASN 10 1HB ASN 10 4.107 3.797 8.455
68 1HD2 ASN 10 1HD2 ASN 10 4.627 4.591 5.132
69 2HD2 ASN 10 2HD2 ASN 10 6.193 5.293 5.331
70 H GLY 11 H GLY 11 4.720 1.003 9.514
71 1HA GLY 11 2HA GLY 11 7.533 0.279 9.005
72 2HA GLY 11 1HA GLY 11 7.143 1.195 10.457
73 H ALA 12 H ALA 12 5.734 -1.625 8.761
74 HA ALA 12 HA ALA 12 5.522 -2.925 11.408
75 1HB ALA 12 1HB ALA 12 3.341 -2.401 10.734
76 2HB ALA 12 2HB ALA 12 3.536 -4.116 10.348
77 3HB ALA 12 3HB ALA 12 3.648 -2.900 9.073
78 H THR 13 H THR 13 5.683 -5.168 11.536
79 HA THR 13 HA THR 13 6.336 -6.729 9.161
80 HB THR 13 HB THR 13 8.064 -6.790 11.654
81 HG1 THR 13 1HG THR 13 8.195 -5.291 9.410
82 1HG2 THR 13 1HG2 THR 13 8.319 -8.321 9.059
83 2HG2 THR 13 2HG2 THR 13 7.778 -8.996 10.595
84 3HG2 THR 13 3HG2 THR 13 9.430 -8.398 10.427
85 H LEU 14 H LEU 14 4.843 -8.310 9.194
86 HA LEU 14 HA LEU 14 4.137 -9.663 11.648
87 1HB LEU 14 2HB LEU 14 1.728 -9.083 11.423
88 2HB LEU 14 1HB LEU 14 2.764 -7.753 11.899
89 HG LEU 14 HG LEU 14 2.742 -7.085 9.417
90 1HD1 LEU 14 1HD1 LEU 14 0.319 -8.866 9.464
91 2HD1 LEU 14 2HD1 LEU 14 1.822 -9.201 8.607
92 3HD1 LEU 14 3HD1 LEU 14 0.830 -7.817 8.138
93 1HD2 LEU 14 1HD2 LEU 14 1.615 -5.809 11.140
94 2HD2 LEU 14 2HD2 LEU 14 0.240 -6.910 11.088
95 3HD2 LEU 14 3HD2 LEU 14 0.607 -5.892 9.693
96 H THR 15 H THR 15 2.415 -11.344 11.265
97 HA THR 15 HA THR 15 2.830 -12.553 8.617
98 HB THR 15 HB THR 15 1.991 -13.783 11.248
99 HG1 THR 15 1HG THR 15 4.239 -13.422 11.031
100 1HG2 THR 15 1HG2 THR 15 1.864 -15.916 10.126
101 2HG2 THR 15 2HG2 THR 15 2.346 -15.181 8.595
102 3HG2 THR 15 3HG2 THR 15 0.780 -14.778 9.310
103 H VAL 16 H VAL 16 1.082 -13.342 7.428
104 HA VAL 16 HA VAL 16 -1.582 -12.489 8.349
105 HB VAL 16 HB VAL 16 -2.136 -11.550 6.291
106 1HG1 VAL 16 1HG1 VAL 16 -0.339 -9.966 5.756
107 2HG1 VAL 16 2HG1 VAL 16 0.784 -10.943 6.703
108 3HG1 VAL 16 3HG1 VAL 16 -0.576 -10.144 7.494
109 1HG2 VAL 16 1HG2 VAL 16 -0.832 -11.781 4.235
110 2HG2 VAL 16 2HG2 VAL 16 -1.415 -13.334 4.834
111 3HG2 VAL 16 3HG2 VAL 16 0.271 -12.872 5.072
112 H ALA 17 H ALA 17 -3.347 -13.649 7.388
113 HA ALA 17 HA ALA 17 -2.626 -16.230 6.176
114 1HB ALA 17 1HB ALA 17 -5.004 -16.831 6.733
115 2HB ALA 17 2HB ALA 17 -5.123 -15.292 7.589
116 3HB ALA 17 3HB ALA 17 -3.982 -16.520 8.137
117 H VAL 18 H VAL 18 -3.008 -16.429 4.025
118 HA VAL 18 HA VAL 18 -4.622 -14.296 2.786
119 HB VAL 18 HB VAL 18 -3.504 -14.746 0.695
120 1HG1 VAL 18 1HG1 VAL 18 -1.102 -14.273 1.466
121 2HG1 VAL 18 2HG1 VAL 18 -1.783 -14.274 3.100
122 3HG1 VAL 18 3HG1 VAL 18 -2.371 -13.123 1.898
123 1HG2 VAL 18 1HG2 VAL 18 -1.665 -16.338 0.517
124 2HG2 VAL 18 2HG2 VAL 18 -3.176 -17.151 0.929
125 3HG2 VAL 18 3HG2 VAL 18 -1.958 -16.869 2.172
126 H GLY 19 H GLY 19 -5.149 -15.431 0.348
127 1HA GLY 19 2HA GLY 19 -6.231 -17.432 -0.545
128 2HA GLY 19 1HA GLY 19 -6.893 -17.703 1.064
129 H GLU 20 H GLU 20 -7.961 -15.447 1.836
130 HA GLU 20 HA GLU 20 -10.188 -15.026 0.079
131 1HB GLU 20 2HB GLU 20 -9.443 -13.530 2.605
132 2HB GLU 20 1HB GLU 20 -11.013 -13.526 1.815
133 1HG GLU 20 2HG GLU 20 -9.701 -15.934 3.054
134 2HG GLU 20 1HG GLU 20 -10.953 -14.952 3.810
135 H LEU 21 H LEU 21 -8.196 -12.577 1.671
136 HA LEU 21 HA LEU 21 -7.196 -11.446 -0.743
137 1HB LEU 21 2HB LEU 21 -9.462 -10.567 -0.892
138 2HB LEU 21 1HB LEU 21 -9.370 -9.973 0.750
139 HG LEU 21 HG LEU 21 -7.659 -8.348 0.083
140 1HD1 LEU 21 1HD1 LEU 21 -6.634 -9.594 -1.752
141 2HD1 LEU 21 2HD1 LEU 21 -7.134 -7.987 -2.274
142 3HD1 LEU 21 3HD1 LEU 21 -8.100 -9.396 -2.713
143 1HD2 LEU 21 1HD2 LEU 21 -9.104 -6.904 -1.266
144 2HD2 LEU 21 2HD2 LEU 21 -9.999 -7.699 0.030
145 3HD2 LEU 21 3HD2 LEU 21 -10.139 -8.286 -1.627
146 H VAL 22 H VAL 22 -5.368 -10.291 -0.298
147 HA VAL 22 HA VAL 22 -5.061 -9.418 2.498
148 HB VAL 22 HB VAL 22 -3.124 -10.846 0.744
149 1HG1 VAL 22 1HG1 VAL 22 -2.336 -8.548 2.525
150 2HG1 VAL 22 2HG1 VAL 22 -1.862 -8.846 0.856
151 3HG1 VAL 22 3HG1 VAL 22 -1.234 -9.871 2.147
152 1HG2 VAL 22 1HG2 VAL 22 -2.411 -11.711 2.927
153 2HG2 VAL 22 2HG2 VAL 22 -4.141 -11.915 2.650
154 3HG2 VAL 22 3HG2 VAL 22 -3.563 -10.634 3.716
155 H GLU 23 H GLU 23 -5.145 -7.319 2.723
156 HA GLU 23 HA GLU 23 -4.845 -5.700 0.300
157 1HB GLU 23 2HB GLU 23 -6.191 -5.005 2.905
158 2HB GLU 23 1HB GLU 23 -6.143 -4.006 1.462
159 1HG GLU 23 2HG GLU 23 -7.490 -5.635 0.271
160 2HG GLU 23 1HG GLU 23 -7.494 -6.685 1.689
161 H ILE 24 H ILE 24 -3.871 -3.762 0.334
162 HA ILE 24 HA ILE 24 -2.484 -2.848 2.748
163 HB ILE 24 HB ILE 24 -1.409 -2.613 -0.084
164 1HG1 ILE 24 2HG1 ILE 24 -1.154 -4.899 0.845
165 2HG1 ILE 24 1HG1 ILE 24 0.392 -4.097 0.586
166 1HG2 ILE 24 1HG2 ILE 24 -0.907 -0.675 1.300
167 2HG2 ILE 24 2HG2 ILE 24 0.553 -1.601 0.953
168 3HG2 ILE 24 3HG2 ILE 24 -0.215 -1.727 2.536
169 1HD1 ILE 24 1HD1 ILE 24 -1.033 -4.475 3.210
170 2HD1 ILE 24 2HD1 ILE 24 0.451 -3.547 2.995
171 3HD1 ILE 24 3HD1 ILE 24 0.441 -5.279 2.667
172 H GLN 25 H GLN 25 -3.048 -0.709 3.163
173 HA GLN 25 HA GLN 25 -4.013 0.875 0.927
174 1HB GLN 25 2HB GLN 25 -6.075 0.062 1.571
175 2HB GLN 25 1HB GLN 25 -5.679 0.096 3.292
176 1HG GLN 25 2HG GLN 25 -5.561 2.709 2.070
177 2HG GLN 25 1HG GLN 25 -7.140 1.957 1.858
178 1HE2 GLN 25 1HE2 GLN 25 -4.860 3.221 4.164
179 2HE2 GLN 25 2HE2 GLN 25 -5.939 3.260 5.514
180 H LEU 26 H LEU 26 -3.505 2.909 1.023
181 HA LEU 26 HA LEU 26 -2.416 3.911 3.523
182 1HB LEU 26 2HB LEU 26 -1.749 4.472 0.676
183 2HB LEU 26 1HB LEU 26 -1.521 5.749 1.845
184 HG LEU 26 HG LEU 26 0.563 4.635 1.505
185 1HD1 LEU 26 1HD1 LEU 26 0.198 5.375 3.753
186 2HD1 LEU 26 2HD1 LEU 26 1.069 3.840 3.785
187 3HD1 LEU 26 3HD1 LEU 26 -0.658 3.882 4.147
188 1HD2 LEU 26 1HD2 LEU 26 -0.278 2.517 0.646
189 2HD2 LEU 26 2HD2 LEU 26 -0.853 2.084 2.258
190 3HD2 LEU 26 3HD2 LEU 26 0.876 2.255 1.957
191 HA PRO 27 HA PRO 27 -5.736 6.887 3.361
192 1HB PRO 27 2HB PRO 27 -4.987 8.539 5.277
193 2HB PRO 27 1HB PRO 27 -5.299 6.838 5.667
194 1HG PRO 27 2HG PRO 27 -2.666 8.235 5.221
195 2HG PRO 27 1HG PRO 27 -3.127 7.056 6.476
196 1HD PRO 27 2HD PRO 27 -1.780 6.435 4.144
197 2HD PRO 27 1HD PRO 27 -2.695 5.276 5.131
198 H SER 28 H SER 28 -2.935 7.298 1.903
199 HA SER 28 HA SER 28 -2.017 8.788 0.502
200 1HB SER 28 2HB SER 28 -4.337 9.222 -0.274
201 2HB SER 28 1HB SER 28 -4.490 10.465 0.968
202 HG SER 28 HG SER 28 -2.603 10.445 -1.170
203 H ASN 29 H ASN 29 -3.577 10.611 3.077
204 HA ASN 29 HA ASN 29 -2.899 12.417 4.311
205 1HB ASN 29 2HB ASN 29 -0.047 11.561 4.208
206 2HB ASN 29 1HB ASN 29 -0.990 12.134 5.568
207 1HD2 ASN 29 1HD2 ASN 29 0.181 9.437 3.888
208 2HD2 ASN 29 2HD2 ASN 29 -0.500 8.219 4.912
209 HA PRO 30 HA PRO 30 -1.393 13.805 0.023
210 1HB PRO 30 2HB PRO 30 -3.438 15.882 0.694
211 2HB PRO 30 1HB PRO 30 -3.096 15.098 -0.857
212 1HG PRO 30 2HG PRO 30 -5.173 14.285 0.527
213 2HG PRO 30 1HG PRO 30 -4.076 13.079 -0.182
214 1HD PRO 30 2HD PRO 30 -4.246 14.019 2.652
215 2HD PRO 30 1HD PRO 30 -4.064 12.371 2.021
216 H THR 31 H THR 31 0.539 14.581 0.277
217 HA THR 31 HA THR 31 1.078 16.830 2.021
218 HB THR 31 HB THR 31 3.367 16.358 1.709
219 HG1 THR 31 1HG THR 31 4.157 15.189 -0.079
220 1HG2 THR 31 1HG2 THR 31 2.023 13.674 1.276
221 2HG2 THR 31 2HG2 THR 31 2.119 14.509 2.834
222 3HG2 THR 31 3HG2 THR 31 3.594 13.968 2.033
223 H THR 32 H THR 32 1.002 16.024 -1.379
224 HA THR 32 HA THR 32 0.089 18.427 -2.344
225 HB THR 32 HB THR 32 2.181 19.474 -1.688
226 HG1 THR 32 1HG THR 32 1.397 20.269 -3.629
227 1HG2 THR 32 1HG2 THR 32 3.635 17.527 -1.625
228 2HG2 THR 32 2HG2 THR 32 4.339 18.801 -2.625
229 3HG2 THR 32 3HG2 THR 32 3.569 17.406 -3.382
230 H GLY 33 H GLY 33 2.173 18.021 -4.726
231 1HA GLY 33 2HA GLY 33 0.525 16.473 -6.363
232 2HA GLY 33 1HA GLY 33 2.209 16.830 -6.692
233 H PHE 34 H PHE 34 3.256 15.448 -4.378
234 HA PHE 34 HA PHE 34 3.666 12.884 -5.255
235 1HB PHE 34 2HB PHE 34 3.548 13.706 -2.354
236 2HB PHE 34 1HB PHE 34 4.448 12.359 -3.032
237 HD1 PHE 34 1HD PHE 34 4.550 15.740 -2.033
238 HD2 PHE 34 2HD PHE 34 6.312 12.957 -4.710
239 HE1 PHE 34 1HE PHE 34 6.521 17.194 -2.239
240 HE2 PHE 34 2HE PHE 34 8.280 14.399 -4.920
241 HZ PHE 34 HZ PHE 34 8.390 16.522 -3.687
242 H ALA 35 H ALA 35 2.839 10.866 -4.762
243 HA ALA 35 HA ALA 35 0.477 10.562 -3.101
244 1HB ALA 35 1HB ALA 35 -0.875 9.562 -4.873
245 2HB ALA 35 2HB ALA 35 0.411 9.852 -6.046
246 3HB ALA 35 3HB ALA 35 -0.437 11.215 -5.313
247 H TRP 36 H TRP 36 -0.094 8.181 -2.915
248 HA TRP 36 HA TRP 36 2.395 6.718 -2.637
249 1HB TRP 36 2HB TRP 36 -0.419 5.894 -1.878
250 2HB TRP 36 1HB TRP 36 1.041 4.970 -1.546
251 HD1 TRP 36 HD TRP 36 -1.028 7.842 -0.199
252 HE1 TRP 36 1HE TRP 36 -0.071 8.523 2.075
253 HE3 TRP 36 3HE TRP 36 3.327 5.198 -0.343
254 HZ2 TRP 36 2HZ TRP 36 2.208 7.987 3.629
255 HZ3 TRP 36 3HZ TRP 36 4.858 5.330 1.567
256 HH2 TRP 36 HH TRP 36 4.316 6.714 3.519
257 H TYR 37 H TYR 37 3.190 5.512 -4.191
258 HA TYR 37 HA TYR 37 1.592 3.370 -5.226
259 1HB TYR 37 2HB TYR 37 2.543 3.845 -7.602
260 2HB TYR 37 1HB TYR 37 1.089 4.678 -7.081
261 HD1 TYR 37 1HD TYR 37 1.017 6.922 -7.751
262 HD2 TYR 37 2HD TYR 37 4.746 5.175 -6.715
263 HE1 TYR 37 1HE TYR 37 2.140 9.031 -8.251
264 HE2 TYR 37 2HE TYR 37 5.863 7.278 -7.207
265 HH TYR 37 HH TYR 37 4.250 10.162 -7.631
266 H PHE 38 H PHE 38 2.909 1.586 -5.990
267 HA PHE 38 HA PHE 38 4.885 0.937 -4.267
268 1HB PHE 38 2HB PHE 38 4.000 -0.130 -6.797
269 2HB PHE 38 1HB PHE 38 5.738 -0.321 -6.588
270 HD1 PHE 38 1HD PHE 38 2.479 -1.484 -5.631
271 HD2 PHE 38 2HD PHE 38 6.591 -1.517 -4.560
272 HE1 PHE 38 1HE PHE 38 2.081 -3.444 -4.197
273 HE2 PHE 38 2HE PHE 38 6.209 -3.480 -3.130
274 HZ PHE 38 HZ PHE 38 3.954 -4.422 -2.908
275 H GLU 39 H GLU 39 5.792 1.661 -7.648
276 HA GLU 39 HA GLU 39 7.983 3.277 -6.593
277 1HB GLU 39 2HB GLU 39 9.549 2.199 -8.236
278 2HB GLU 39 1HB GLU 39 9.074 1.204 -6.869
279 1HG GLU 39 2HG GLU 39 7.501 -0.002 -8.261
280 2HG GLU 39 1HG GLU 39 7.897 1.034 -9.634
281 H GLY 40 H GLY 40 5.371 3.495 -8.321
282 1HA GLY 40 2HA GLY 40 5.360 5.863 -9.221
283 2HA GLY 40 1HA GLY 40 6.694 5.341 -10.237
284 H GLY 41 H GLY 41 3.246 5.106 -9.657
285 1HA GLY 41 2HA GLY 41 1.512 4.391 -10.988
286 2HA GLY 41 1HA GLY 41 2.541 4.832 -12.343
287 H THR 42 H THR 42 3.889 2.544 -10.278
288 HA THR 42 HA THR 42 3.091 0.282 -11.962
289 HB THR 42 HB THR 42 5.959 0.754 -11.145
290 HG1 THR 42 1HG THR 42 5.174 2.435 -12.611
291 1HG2 THR 42 1HG2 THR 42 6.447 -0.884 -12.879
292 2HG2 THR 42 2HG2 THR 42 4.734 -0.992 -13.279
293 3HG2 THR 42 3HG2 THR 42 5.309 -1.546 -11.707
294 H LYS 43 H LYS 43 3.015 -1.659 -10.844
295 HA LYS 43 HA LYS 43 3.723 -1.620 -8.011
296 1HB LYS 43 2HB LYS 43 1.635 -1.405 -7.265
297 2HB LYS 43 1HB LYS 43 1.181 -0.966 -8.895
298 1HG LYS 43 2HG LYS 43 1.167 -3.822 -7.963
299 2HG LYS 43 1HG LYS 43 -0.223 -2.750 -7.791
300 1HD LYS 43 2HD LYS 43 -0.399 -2.469 -10.158
301 2HD LYS 43 1HD LYS 43 1.141 -3.287 -10.424
302 1HE LYS 43 2HE LYS 43 0.104 -5.341 -9.412
303 2HE LYS 43 1HE LYS 43 -1.439 -4.490 -9.449
304 1HZ LYS 43 1HZ LYS 43 -1.225 -5.877 -11.384
305 2HZ LYS 43 2HZ LYS 43 0.258 -5.168 -11.789
306 3HZ LYS 43 3HZ LYS 43 -1.167 -4.252 -11.867
307 H GLU 44 H GLU 44 4.176 -3.651 -7.174
308 HA GLU 44 HA GLU 44 3.612 -5.972 -8.868
309 1HB GLU 44 2HB GLU 44 5.879 -6.826 -8.619
310 2HB GLU 44 1HB GLU 44 5.898 -5.259 -9.414
311 1HG GLU 44 2HG GLU 44 6.704 -4.176 -7.477
312 2HG GLU 44 1HG GLU 44 6.376 -5.582 -6.467
313 H SER 45 H SER 45 3.488 -7.961 -7.781
314 HA SER 45 HA SER 45 3.506 -7.808 -4.837
315 1HB SER 45 2HB SER 45 1.442 -8.676 -5.999
316 2HB SER 45 1HB SER 45 2.403 -10.029 -6.589
317 HG SER 45 HG SER 45 1.629 -10.834 -4.767
318 HA PRO 46 HA PRO 46 7.404 -9.939 -5.002
319 1HB PRO 46 2HB PRO 46 7.010 -10.591 -2.184
320 2HB PRO 46 1HB PRO 46 8.179 -9.495 -2.922
321 1HG PRO 46 2HG PRO 46 6.107 -8.619 -1.421
322 2HG PRO 46 1HG PRO 46 6.771 -7.685 -2.774
323 1HD PRO 46 2HD PRO 46 4.306 -9.390 -2.674
324 2HD PRO 46 1HD PRO 46 4.550 -7.803 -3.437
325 H ASN 47 H ASN 47 4.794 -11.485 -5.413
326 HA ASN 47 HA ASN 47 5.864 -14.055 -5.598
327 1HB ASN 47 2HB ASN 47 5.562 -13.841 -3.041
328 2HB ASN 47 1HB ASN 47 3.839 -13.941 -3.378
329 1HD2 ASN 47 1HD2 ASN 47 3.708 -15.867 -2.201
330 2HD2 ASN 47 2HD2 ASN 47 4.280 -17.365 -2.848
331 H GLU 48 H GLU 48 4.574 -12.504 -7.352
332 HA GLU 48 HA GLU 48 1.910 -13.732 -7.555
333 1HB GLU 48 2HB GLU 48 1.140 -11.846 -8.788
334 2HB GLU 48 1HB GLU 48 1.914 -11.255 -7.327
335 1HG GLU 48 2HG GLU 48 3.785 -10.469 -8.510
336 2HG GLU 48 1HG GLU 48 3.330 -11.355 -9.967
337 H SER 49 H SER 49 1.727 -15.206 -8.989
338 HA SER 49 HA SER 49 2.894 -14.816 -11.632
339 1HB SER 49 2HB SER 49 4.383 -16.381 -10.348
340 2HB SER 49 1HB SER 49 3.012 -17.473 -10.176
341 HG SER 49 HG SER 49 4.070 -16.588 -12.658
342 H MET 50 H MET 50 0.681 -16.576 -9.534
343 HA MET 50 HA MET 50 -1.158 -16.879 -11.791
344 1HB MET 50 2HB MET 50 -2.272 -18.609 -10.553
345 2HB MET 50 1HB MET 50 -0.555 -18.939 -10.642
346 1HG MET 50 2HG MET 50 -2.040 -17.842 -8.263
347 2HG MET 50 1HG MET 50 -1.439 -19.484 -8.450
348 1HE MET 50 1HE MET 50 -0.859 -17.693 -5.905
349 2HE MET 50 2HE MET 50 0.857 -18.002 -5.643
350 3HE MET 50 3HE MET 50 -0.218 -19.326 -6.092
351 H PHE 51 H PHE 51 -0.830 -15.685 -8.544
352 HA PHE 51 HA PHE 51 -3.384 -14.265 -8.792
353 1HB PHE 51 2HB PHE 51 -1.862 -15.373 -6.474
354 2HB PHE 51 1HB PHE 51 -2.838 -13.935 -6.203
355 HD1 PHE 51 1HD PHE 51 -3.155 -17.254 -7.895
356 HD2 PHE 51 2HD PHE 51 -4.982 -14.281 -5.458
357 HE1 PHE 51 1HE PHE 51 -5.139 -18.684 -7.646
358 HE2 PHE 51 2HE PHE 51 -6.974 -15.705 -5.211
359 HZ PHE 51 HZ PHE 51 -7.100 -17.856 -6.368
360 H THR 52 H THR 52 -3.225 -11.978 -7.613
361 HA THR 52 HA THR 52 -0.766 -10.631 -8.208
362 HB THR 52 HB THR 52 -1.523 -11.242 -10.479
363 HG1 THR 52 1HG THR 52 -0.284 -9.400 -10.395
364 1HG2 THR 52 1HG2 THR 52 -3.473 -10.104 -11.442
365 2HG2 THR 52 2HG2 THR 52 -3.866 -9.451 -9.853
366 3HG2 THR 52 3HG2 THR 52 -3.926 -11.193 -10.129
367 H VAL 53 H VAL 53 -1.200 -8.188 -8.503
368 HA VAL 53 HA VAL 53 -2.813 -7.388 -6.184
369 HB VAL 53 HB VAL 53 -0.744 -5.765 -7.672
370 1HG1 VAL 53 1HG1 VAL 53 -0.574 -4.502 -5.587
371 2HG1 VAL 53 2HG1 VAL 53 -1.846 -5.500 -4.883
372 3HG1 VAL 53 3HG1 VAL 53 -2.204 -4.454 -6.258
373 1HG2 VAL 53 1HG2 VAL 53 0.338 -7.781 -6.940
374 2HG2 VAL 53 2HG2 VAL 53 -0.323 -7.585 -5.316
375 3HG2 VAL 53 3HG2 VAL 53 0.857 -6.429 -5.931
376 H GLU 54 H GLU 54 -4.379 -5.848 -6.312
377 HA GLU 54 HA GLU 54 -4.851 -4.504 -8.894
378 1HB GLU 54 2HB GLU 54 -7.121 -4.023 -8.014
379 2HB GLU 54 1HB GLU 54 -6.804 -5.751 -8.106
380 1HG GLU 54 2HG GLU 54 -6.570 -5.945 -5.787
381 2HG GLU 54 1HG GLU 54 -6.379 -4.209 -5.571
382 H ASN 55 H ASN 55 -4.541 -2.312 -8.970
383 HA ASN 55 HA ASN 55 -4.014 -1.046 -6.375
384 1HB ASN 55 2HB ASN 55 -2.499 0.446 -7.260
385 2HB ASN 55 1HB ASN 55 -2.115 -1.060 -8.074
386 1HD2 ASN 55 1HD2 ASN 55 -4.267 -0.840 -10.070
387 2HD2 ASN 55 2HD2 ASN 55 -3.794 0.434 -11.126
388 H LYS 56 H LYS 56 -5.071 0.663 -5.696
389 HA LYS 56 HA LYS 56 -6.972 2.041 -7.363
390 1HB LYS 56 2HB LYS 56 -8.752 1.225 -5.517
391 2HB LYS 56 1HB LYS 56 -8.552 0.437 -7.076
392 1HG LYS 56 2HG LYS 56 -8.343 -1.427 -5.857
393 2HG LYS 56 1HG LYS 56 -6.699 -0.853 -5.577
394 1HD LYS 56 2HD LYS 56 -7.814 -1.545 -3.496
395 2HD LYS 56 1HD LYS 56 -7.380 0.167 -3.484
396 1HE LYS 56 2HE LYS 56 -9.661 -0.393 -2.593
397 2HE LYS 56 1HE LYS 56 -9.604 0.833 -3.851
398 1HZ LYS 56 1HZ LYS 56 -10.264 -2.031 -4.309
399 2HZ LYS 56 2HZ LYS 56 -10.329 -0.790 -5.464
400 3HZ LYS 56 3HZ LYS 56 -11.409 -0.792 -4.159
401 H TYR 57 H TYR 57 -6.476 4.018 -6.698
402 HA TYR 57 HA TYR 57 -6.505 4.491 -3.818
403 1HB TYR 57 2HB TYR 57 -4.630 6.236 -4.436
404 2HB TYR 57 1HB TYR 57 -4.266 4.584 -3.993
405 HD1 TYR 57 1HD TYR 57 -4.689 6.797 -6.956
406 HD2 TYR 57 2HD TYR 57 -3.063 3.197 -5.380
407 HE1 TYR 57 1HE TYR 57 -3.396 6.478 -9.022
408 HE2 TYR 57 2HE TYR 57 -1.775 2.866 -7.445
409 HH TYR 57 HH TYR 57 -1.916 3.559 -9.829
410 H PHE 58 H PHE 58 -7.532 6.194 -3.131
411 HA PHE 58 HA PHE 58 -8.478 8.220 -5.039
412 1HB PHE 58 2HB PHE 58 -10.178 6.728 -3.018
413 2HB PHE 58 1HB PHE 58 -10.735 8.040 -4.060
414 HD1 PHE 58 1HD PHE 58 -10.104 4.511 -3.772
415 HD2 PHE 58 2HD PHE 58 -10.833 7.667 -6.536
416 HE1 PHE 58 1HE PHE 58 -10.716 2.861 -5.488
417 HE2 PHE 58 2HE PHE 58 -11.449 6.019 -8.258
418 HZ PHE 58 HZ PHE 58 -11.391 3.613 -7.734
419 HA PRO 59 HA PRO 59 -7.031 10.587 -1.366
420 1HB PRO 59 2HB PRO 59 -7.245 12.682 -3.480
421 2HB PRO 59 1HB PRO 59 -5.944 12.381 -2.320
422 1HG PRO 59 2HG PRO 59 -5.587 11.692 -4.829
423 2HG PRO 59 1HG PRO 59 -5.107 10.568 -3.550
424 1HD PRO 59 2HD PRO 59 -7.613 10.547 -5.218
425 2HD PRO 59 1HD PRO 59 -6.499 9.207 -4.857
426 HA PRO 60 HA PRO 60 -10.589 12.531 0.322
427 1HB PRO 60 2HB PRO 60 -9.470 15.218 -0.377
428 2HB PRO 60 1HB PRO 60 -10.232 14.670 1.127
429 1HG PRO 60 2HG PRO 60 -7.609 14.796 1.002
430 2HG PRO 60 1HG PRO 60 -8.389 13.378 1.733
431 1HD PRO 60 2HD PRO 60 -7.089 13.656 -0.945
432 2HD PRO 60 1HD PRO 60 -7.096 12.274 0.171
433 H ASP 61 H ASP 61 -12.354 14.072 0.059
434 HA ASP 61 HA ASP 61 -13.233 14.988 -2.472
435 1HB ASP 61 2HB ASP 61 -13.332 12.585 -3.012
436 2HB ASP 61 1HB ASP 61 -14.233 12.294 -1.524
437 H SER 62 H SER 62 -14.857 13.048 -0.059
438 HA SER 62 HA SER 62 -15.487 15.082 1.737
439 1HB SER 62 2HB SER 62 -17.025 15.852 -0.040
440 2HB SER 62 1HB SER 62 -17.782 14.261 -0.070
441 HG SER 62 HG SER 62 -17.771 16.146 2.063
442 H LYS 63 H LYS 63 -17.799 12.654 0.726
443 HA LYS 63 HA LYS 63 -17.579 11.265 3.238
444 1HB LYS 63 2HB LYS 63 -19.452 9.976 2.528
445 2HB LYS 63 1HB LYS 63 -19.746 11.621 1.994
446 1HG LYS 63 2HG LYS 63 -18.907 9.268 0.317
447 2HG LYS 63 1HG LYS 63 -20.424 10.165 0.245
448 1HD LYS 63 2HD LYS 63 -19.103 12.181 -0.416
449 2HD LYS 63 1HD LYS 63 -17.668 11.137 -0.501
450 1HE LYS 63 2HE LYS 63 -18.606 9.885 -2.296
451 2HE LYS 63 1HE LYS 63 -20.198 10.610 -2.069
452 1HZ LYS 63 1HZ LYS 63 -19.045 11.568 -3.968
453 2HZ LYS 63 2HZ LYS 63 -17.761 12.060 -2.974
454 3HZ LYS 63 3HZ LYS 63 -19.303 12.737 -2.769
455 H LEU 64 H LEU 64 -16.224 10.943 0.083
456 HA LEU 64 HA LEU 64 -15.582 8.248 -0.047
457 1HB LEU 64 2HB LEU 64 -15.090 9.942 -1.821
458 2HB LEU 64 1HB LEU 64 -13.783 10.545 -0.816
459 HG LEU 64 HG LEU 64 -12.649 8.369 -0.984
460 1HD1 LEU 64 1HD1 LEU 64 -13.416 6.725 -2.627
461 2HD1 LEU 64 2HD1 LEU 64 -14.872 7.679 -2.899
462 3HD1 LEU 64 3HD1 LEU 64 -14.586 6.937 -1.324
463 1HD2 LEU 64 1HD2 LEU 64 -11.965 8.591 -3.313
464 2HD2 LEU 64 2HD2 LEU 64 -12.102 10.167 -2.533
465 3HD2 LEU 64 3HD2 LEU 64 -13.365 9.613 -3.632
466 H LEU 65 H LEU 65 -13.769 10.912 1.379
467 HA LEU 65 HA LEU 65 -13.181 9.350 3.642
468 1HB LEU 65 2HB LEU 65 -11.399 8.794 1.789
469 2HB LEU 65 1HB LEU 65 -10.722 10.341 2.245
470 HG LEU 65 HG LEU 65 -9.523 8.568 3.356
471 1HD1 LEU 65 1HD1 LEU 65 -9.751 10.608 4.627
472 2HD1 LEU 65 2HD1 LEU 65 -9.795 9.212 5.708
473 3HD1 LEU 65 3HD1 LEU 65 -11.288 10.057 5.293
474 1HD2 LEU 65 1HD2 LEU 65 -12.170 7.747 4.545
475 2HD2 LEU 65 2HD2 LEU 65 -10.594 7.051 4.930
476 3HD2 LEU 65 3HD2 LEU 65 -11.269 6.868 3.309
477 H GLY 66 H GLY 66 -11.615 12.026 2.011
478 1HA GLY 66 2HA GLY 66 -11.796 14.314 2.385
479 2HA GLY 66 1HA GLY 66 -12.932 13.979 3.681
480 H ALA 67 H ALA 67 -11.744 12.663 5.524
481 HA ALA 67 HA ALA 67 -10.233 14.469 6.952
482 1HB ALA 67 1HB ALA 67 -9.755 12.638 8.487
483 2HB ALA 67 2HB ALA 67 -10.239 11.469 7.256
484 3HB ALA 67 3HB ALA 67 -11.429 12.578 7.936
485 H GLY 68 H GLY 68 -9.083 11.809 4.939
486 1HA GLY 68 2HA GLY 68 -6.456 13.086 4.881
487 2HA GLY 68 1HA GLY 68 -6.538 11.408 5.399
488 H GLY 69 H GLY 69 -8.179 10.190 3.771
489 1HA GLY 69 2HA GLY 69 -8.617 10.392 1.231
490 2HA GLY 69 1HA GLY 69 -6.859 10.505 1.170
491 H THR 70 H THR 70 -7.456 8.456 -0.230
492 HA THR 70 HA THR 70 -6.955 6.175 1.453
493 HB THR 70 HB THR 70 -9.066 5.236 -0.114
494 HG1 THR 70 1HG THR 70 -9.649 7.529 -0.296
495 1HG2 THR 70 1HG2 THR 70 -8.422 4.465 2.104
496 2HG2 THR 70 2HG2 THR 70 -10.128 4.923 2.097
497 3HG2 THR 70 3HG2 THR 70 -8.923 6.001 2.809
498 H GLU 71 H GLU 71 -5.048 6.086 0.236
499 HA GLU 71 HA GLU 71 -5.381 5.261 -2.556
500 1HB GLU 71 2HB GLU 71 -2.907 6.165 -1.064
501 2HB GLU 71 1HB GLU 71 -2.943 5.681 -2.754
502 1HG GLU 71 2HG GLU 71 -4.617 7.530 -3.125
503 2HG GLU 71 1HG GLU 71 -4.238 8.079 -1.495
504 H HIS 72 H HIS 72 -5.613 3.044 -2.694
505 HA HIS 72 HA HIS 72 -4.097 1.509 -0.687
506 1HB HIS 72 2HB HIS 72 -6.363 0.102 -1.926
507 2HB HIS 72 1HB HIS 72 -5.746 0.068 -0.288
508 HD1 HIS 72 1HD HIS 72 -8.162 0.019 0.559
509 HD2 HIS 72 2HD HIS 72 -7.129 3.494 -1.448
510 HE1 HIS 72 1HE HIS 72 -10.027 1.608 0.970
511 HE2 HIS 72 2HE HIS 72 -9.541 3.587 -0.504
512 H PHE 73 H PHE 73 -3.628 -0.657 -1.191
513 HA PHE 73 HA PHE 73 -3.297 -1.367 -4.008
514 1HB PHE 73 2HB PHE 73 -1.184 -1.081 -1.891
515 2HB PHE 73 1HB PHE 73 -0.969 -2.258 -3.185
516 HD1 PHE 73 1HD PHE 73 -0.486 -1.539 -5.439
517 HD2 PHE 73 2HD PHE 73 -1.234 1.300 -2.355
518 HE1 PHE 73 1HE PHE 73 0.396 0.252 -6.874
519 HE2 PHE 73 2HE PHE 73 -0.359 3.095 -3.790
520 HZ PHE 73 HZ PHE 73 0.420 2.551 -6.096
521 H HIS 74 H HIS 74 -4.569 -3.201 -4.046
522 HA HIS 74 HA HIS 74 -4.550 -4.890 -1.624
523 1HB HIS 74 2HB HIS 74 -6.556 -4.767 -3.888
524 2HB HIS 74 1HB HIS 74 -6.646 -5.875 -2.530
525 HD1 HIS 74 1HD HIS 74 -9.042 -4.307 -2.843
526 HD2 HIS 74 2HD HIS 74 -5.769 -2.748 -0.794
527 HE1 HIS 74 1HE HIS 74 -9.970 -2.551 -1.320
528 HE2 HIS 74 2HE HIS 74 -8.026 -1.897 0.129
529 H VAL 75 H VAL 75 -3.515 -6.805 -1.728
530 HA VAL 75 HA VAL 75 -2.974 -7.813 -4.430
531 HB VAL 75 HB VAL 75 -1.021 -8.912 -3.667
532 1HG1 VAL 75 1HG1 VAL 75 -1.091 -6.273 -2.216
533 2HG1 VAL 75 2HG1 VAL 75 -0.790 -6.480 -3.940
534 3HG1 VAL 75 3HG1 VAL 75 0.347 -7.140 -2.764
535 1HG2 VAL 75 1HG2 VAL 75 -0.325 -8.993 -1.318
536 2HG2 VAL 75 2HG2 VAL 75 -1.834 -9.864 -1.615
537 3HG2 VAL 75 3HG2 VAL 75 -1.871 -8.267 -0.859
538 H THR 76 H THR 76 -4.038 -9.513 -5.071
539 HA THR 76 HA THR 76 -5.342 -11.210 -3.063
540 HB THR 76 HB THR 76 -5.796 -11.266 -6.061
541 HG1 THR 76 1HG THR 76 -6.464 -9.315 -4.330
542 1HG2 THR 76 1HG2 THR 76 -7.500 -12.151 -3.726
543 2HG2 THR 76 2HG2 THR 76 -6.593 -13.210 -4.803
544 3HG2 THR 76 3HG2 THR 76 -7.945 -12.269 -5.430
545 H VAL 77 H VAL 77 -3.948 -12.759 -2.491
546 HA VAL 77 HA VAL 77 -2.814 -14.465 -4.545
547 HB VAL 77 HB VAL 77 -1.039 -12.855 -4.338
548 1HG1 VAL 77 1HG1 VAL 77 -1.657 -11.836 -2.226
549 2HG1 VAL 77 2HG1 VAL 77 0.031 -12.340 -2.179
550 3HG1 VAL 77 3HG1 VAL 77 -1.200 -13.301 -1.357
551 1HG2 VAL 77 1HG2 VAL 77 -0.325 -15.295 -2.706
552 2HG2 VAL 77 2HG2 VAL 77 0.813 -14.229 -3.531
553 3HG2 VAL 77 3HG2 VAL 77 -0.326 -15.195 -4.469
554 H LYS 78 H LYS 78 -2.621 -16.560 -3.871
555 HA LYS 78 HA LYS 78 -2.433 -16.997 -0.992
556 1HB LYS 78 2HB LYS 78 -3.616 -19.301 -1.653
557 2HB LYS 78 1HB LYS 78 -4.506 -17.884 -1.126
558 1HG LYS 78 2HG LYS 78 -5.696 -18.633 -2.972
559 2HG LYS 78 1HG LYS 78 -4.716 -17.322 -3.621
560 1HD LYS 78 2HD LYS 78 -4.712 -19.211 -5.141
561 2HD LYS 78 1HD LYS 78 -3.100 -18.969 -4.469
562 1HE LYS 78 2HE LYS 78 -3.722 -21.341 -4.551
563 2HE LYS 78 1HE LYS 78 -3.455 -20.784 -2.900
564 1HZ LYS 78 1HZ LYS 78 -5.443 -22.220 -3.211
565 2HZ LYS 78 2HZ LYS 78 -6.146 -20.985 -4.142
566 3HZ LYS 78 3HZ LYS 78 -5.775 -20.716 -2.509
567 H ALA 79 H ALA 79 -0.364 -17.425 -0.803
568 HA ALA 79 HA ALA 79 0.707 -19.860 -1.775
569 1HB ALA 79 1HB ALA 79 1.868 -17.320 -2.928
570 2HB ALA 79 2HB ALA 79 0.985 -18.554 -3.830
571 3HB ALA 79 3HB ALA 79 2.548 -18.938 -3.110
572 H ALA 80 H ALA 80 2.582 -20.431 -0.647
573 HA ALA 80 HA ALA 80 3.004 -18.979 1.791
574 1HB ALA 80 1HB ALA 80 3.068 -21.427 1.715
575 2HB ALA 80 2HB ALA 80 4.561 -20.751 2.361
576 3HB ALA 80 3HB ALA 80 4.513 -21.354 0.704
577 H GLY 81 H GLY 81 3.811 -16.992 1.242
578 1HA GLY 81 2HA GLY 81 6.659 -16.906 0.622
579 2HA GLY 81 1HA GLY 81 5.594 -16.109 -0.534
580 H THR 82 H THR 82 7.465 -14.602 0.803
581 HA THR 82 HA THR 82 5.913 -13.332 2.953
582 HB THR 82 HB THR 82 8.699 -12.455 2.339
583 HG1 THR 82 1HG THR 82 8.752 -14.792 2.300
584 1HG2 THR 82 1HG2 THR 82 8.760 -12.322 4.815
585 2HG2 THR 82 2HG2 THR 82 7.106 -12.939 4.864
586 3HG2 THR 82 3HG2 THR 82 7.444 -11.375 4.118
587 H HIS 83 H HIS 83 5.128 -11.298 2.744
588 HA HIS 83 HA HIS 83 5.354 -10.124 0.059
589 1HB HIS 83 2HB HIS 83 3.056 -10.875 1.105
590 2HB HIS 83 1HB HIS 83 3.219 -9.401 2.052
591 HD1 HIS 83 1HD HIS 83 3.487 -7.136 0.604
592 HD2 HIS 83 2HD HIS 83 1.990 -10.460 -1.388
593 HE1 HIS 83 1HE HIS 83 2.430 -6.222 -1.486
594 HE2 HIS 83 2HE HIS 83 1.625 -8.277 -2.741
595 H ALA 84 H ALA 84 6.913 -8.593 0.100
596 HA ALA 84 HA ALA 84 7.006 -6.754 2.384
597 1HB ALA 84 1HB ALA 84 9.178 -6.040 1.488
598 2HB ALA 84 2HB ALA 84 8.974 -7.148 0.129
599 3HB ALA 84 3HB ALA 84 9.134 -7.782 1.767
600 H VAL 85 H VAL 85 5.949 -4.912 2.199
601 HA VAL 85 HA VAL 85 5.148 -4.062 -0.505
602 HB VAL 85 HB VAL 85 3.845 -3.136 2.032
603 1HG1 VAL 85 1HG1 VAL 85 2.911 -3.374 -0.820
604 2HG1 VAL 85 2HG1 VAL 85 3.341 -1.891 0.033
605 3HG1 VAL 85 3HG1 VAL 85 1.922 -2.816 0.531
606 1HG2 VAL 85 1HG2 VAL 85 3.158 -5.627 0.478
607 2HG2 VAL 85 2HG2 VAL 85 2.194 -4.927 1.780
608 3HG2 VAL 85 3HG2 VAL 85 3.806 -5.562 2.120
609 H ASN 86 H ASN 86 6.552 -2.563 -1.189
610 HA ASN 86 HA ASN 86 7.115 -0.296 0.619
611 1HB ASN 86 2HB ASN 86 8.667 -1.084 -1.864
612 2HB ASN 86 1HB ASN 86 9.105 0.146 -0.686
613 1HD2 ASN 86 1HD2 ASN 86 8.201 -1.678 1.516
614 2HD2 ASN 86 2HD2 ASN 86 9.509 -2.802 1.695
615 H LEU 87 H LEU 87 5.595 1.139 0.226
616 HA LEU 87 HA LEU 87 4.847 1.686 -2.564
617 1HB LEU 87 2HB LEU 87 3.371 2.249 0.013
618 2HB LEU 87 1HB LEU 87 2.806 2.703 -1.585
619 HG LEU 87 HG LEU 87 3.243 -0.147 -0.639
620 1HD1 LEU 87 1HD1 LEU 87 1.343 0.923 0.460
621 2HD1 LEU 87 2HD1 LEU 87 0.816 -0.305 -0.693
622 3HD1 LEU 87 3HD1 LEU 87 0.700 1.405 -1.112
623 1HD2 LEU 87 1HD2 LEU 87 2.068 0.946 -3.188
624 2HD2 LEU 87 2HD2 LEU 87 2.143 -0.753 -2.719
625 3HD2 LEU 87 3HD2 LEU 87 3.629 0.145 -3.023
626 H THR 88 H THR 88 5.441 3.601 -3.417
627 HA THR 88 HA THR 88 6.891 5.386 -1.598
628 HB THR 88 HB THR 88 7.169 5.287 -4.601
629 HG1 THR 88 1HG THR 88 7.806 3.288 -4.093
630 1HG2 THR 88 1HG2 THR 88 9.061 6.166 -2.405
631 2HG2 THR 88 2HG2 THR 88 8.104 7.254 -3.410
632 3HG2 THR 88 3HG2 THR 88 9.362 6.257 -4.143
633 H TYR 89 H TYR 89 6.341 7.423 -1.343
634 HA TYR 89 HA TYR 89 3.906 8.358 -2.666
635 1HB TYR 89 2HB TYR 89 4.152 8.293 -0.133
636 2HB TYR 89 1HB TYR 89 5.344 9.577 -0.294
637 HD1 TYR 89 1HD TYR 89 1.788 8.726 -0.787
638 HD2 TYR 89 2HD TYR 89 4.676 11.829 -0.599
639 HE1 TYR 89 1HE TYR 89 -0.018 10.389 -0.754
640 HE2 TYR 89 2HE TYR 89 2.879 13.500 -0.560
641 HH TYR 89 HH TYR 89 0.250 13.359 -1.554
642 H MET 90 H MET 90 4.818 8.989 -4.670
643 HA MET 90 HA MET 90 6.722 11.259 -4.526
644 1HB MET 90 2HB MET 90 6.560 9.522 -6.961
645 2HB MET 90 1HB MET 90 7.865 10.558 -6.428
646 1HG MET 90 2HG MET 90 8.433 8.992 -4.674
647 2HG MET 90 1HG MET 90 7.103 7.941 -5.174
648 1HE MET 90 1HE MET 90 8.266 6.979 -8.841
649 2HE MET 90 2HE MET 90 7.221 8.318 -8.356
650 3HE MET 90 3HE MET 90 7.014 6.724 -7.618
651 H ARG 91 H ARG 91 6.641 12.568 -6.624
652 HA ARG 91 HA ARG 91 3.876 12.982 -7.423
653 1HB ARG 91 2HB ARG 91 6.086 14.678 -7.198
654 2HB ARG 91 1HB ARG 91 5.935 14.421 -8.934
655 1HG ARG 91 2HG ARG 91 3.511 15.076 -8.720
656 2HG ARG 91 1HG ARG 91 3.883 15.564 -7.069
657 1HD ARG 91 2HD ARG 91 5.191 16.653 -9.558
658 2HD ARG 91 1HD ARG 91 3.941 17.463 -8.619
659 HE ARG 91 HE ARG 91 6.690 16.937 -7.697
660 1HH1 ARG 91 1HH1 ARG 91 3.676 18.701 -7.501
661 2HH1 ARG 91 2HH1 ARG 91 4.309 19.919 -6.425
662 1HH2 ARG 91 1HH2 ARG 91 7.530 18.537 -6.273
663 2HH2 ARG 91 2HH2 ARG 91 6.488 19.804 -5.716
664 HA PRO 92 HA PRO 92 4.178 9.641 -10.201
665 1HB PRO 92 2HB PRO 92 2.111 10.495 -11.906
666 2HB PRO 92 1HB PRO 92 1.949 9.482 -10.472
667 1HG PRO 92 2HG PRO 92 1.549 12.423 -10.766
668 2HG PRO 92 1HG PRO 92 0.650 11.257 -9.776
669 1HD PRO 92 2HD PRO 92 2.412 12.917 -8.675
670 2HD PRO 92 1HD PRO 92 2.288 11.230 -8.124
671 H TRP 93 H TRP 93 4.347 12.902 -11.555
672 HA TRP 93 HA TRP 93 5.366 11.753 -14.053
673 1HB TRP 93 2HB TRP 93 5.035 14.060 -14.984
674 2HB TRP 93 1HB TRP 93 3.560 13.256 -14.466
675 HD1 TRP 93 HD TRP 93 5.811 16.217 -13.625
676 HE1 TRP 93 1HE TRP 93 4.573 17.763 -11.977
677 HE3 TRP 93 3HE TRP 93 1.790 13.241 -12.626
678 HZ2 TRP 93 2HZ TRP 93 2.182 17.710 -10.453
679 HZ3 TRP 93 3HZ TRP 93 0.077 14.050 -11.066
680 HH2 TRP 93 HH TRP 93 0.264 16.243 -10.004
681 H THR 94 H THR 94 6.753 12.449 -11.311
682 HA THR 94 HA THR 94 9.268 13.069 -12.480
683 HB THR 94 HB THR 94 8.609 15.333 -12.595
684 HG1 THR 94 1HG THR 94 10.603 14.671 -11.136
685 1HG2 THR 94 1HG2 THR 94 6.598 15.229 -11.220
686 2HG2 THR 94 2HG2 THR 94 7.616 16.584 -10.731
687 3HG2 THR 94 3HG2 THR 94 7.584 15.110 -9.762
688 H GLY 95 H GLY 95 7.640 13.588 -9.341
689 1HA GLY 95 2HA GLY 95 8.099 12.818 -7.232
690 2HA GLY 95 1HA GLY 95 8.822 11.415 -8.029
691 HA PRO 96 HA PRO 96 12.103 15.257 -7.265
692 1HB PRO 96 2HB PRO 96 10.758 15.398 -4.585
693 2HB PRO 96 1HB PRO 96 11.680 16.633 -5.440
694 1HG PRO 96 2HG PRO 96 9.012 16.642 -5.452
695 2HG PRO 96 1HG PRO 96 9.957 17.160 -6.858
696 1HD PRO 96 2HD PRO 96 8.316 14.753 -6.497
697 2HD PRO 96 1HD PRO 96 8.897 15.506 -7.993
698 H SER 97 H SER 97 13.963 14.393 -6.737
699 HA SER 97 HA SER 97 14.433 11.813 -6.382
700 1HB SER 97 2HB SER 97 16.673 12.530 -5.318
701 2HB SER 97 1HB SER 97 16.267 13.135 -6.923
702 HG SER 97 HG SER 97 16.620 15.015 -6.050
703 H HIS 98 H HIS 98 14.770 13.954 -3.512
704 HA HIS 98 HA HIS 98 14.009 11.587 -1.924
705 1HB HIS 98 2HB HIS 98 16.505 12.379 -1.874
706 2HB HIS 98 1HB HIS 98 15.888 13.648 -0.821
707 HD1 HIS 98 1HD HIS 98 15.391 13.021 1.591
708 HD2 HIS 98 2HD HIS 98 16.219 9.729 -0.811
709 HE1 HIS 98 1HE HIS 98 15.623 11.077 3.164
710 HE2 HIS 98 2HE HIS 98 15.906 9.067 1.674
711 H ASP 99 H ASP 99 12.308 13.723 -2.908
712 HA ASP 99 HA ASP 99 11.550 14.973 -0.340
713 1HB ASP 99 2HB ASP 99 11.897 16.409 -2.443
714 2HB ASP 99 1HB ASP 99 10.411 15.675 -3.049
715 H SER 100 H SER 100 11.001 12.393 -2.222
716 HA SER 100 HA SER 100 8.133 12.166 -1.859
717 1HB SER 100 2HB SER 100 10.128 10.211 -3.032
718 2HB SER 100 1HB SER 100 8.372 10.126 -3.169
719 HG SER 100 HG SER 100 10.189 11.813 -4.469
720 H GLU 101 H GLU 101 7.147 10.720 -0.466
721 HA GLU 101 HA GLU 101 8.816 9.689 1.709
722 1HB GLU 101 2HB GLU 101 6.628 11.034 2.036
723 2HB GLU 101 1HB GLU 101 5.804 9.557 1.563
724 1HG GLU 101 2HG GLU 101 6.983 8.393 3.424
725 2HG GLU 101 1HG GLU 101 7.596 9.961 3.942
726 H ARG 102 H ARG 102 7.773 7.421 2.588
727 HA ARG 102 HA ARG 102 6.828 5.707 0.500
728 1HB ARG 102 2HB ARG 102 9.375 5.953 0.134
729 2HB ARG 102 1HB ARG 102 9.549 4.990 1.595
730 1HG ARG 102 2HG ARG 102 8.434 3.133 0.583
731 2HG ARG 102 1HG ARG 102 8.011 4.096 -0.832
732 1HD ARG 102 2HD ARG 102 10.541 4.423 -1.114
733 2HD ARG 102 1HD ARG 102 10.703 3.082 0.020
734 HE ARG 102 HE ARG 102 9.032 2.679 -2.356
735 1HH1 ARG 102 1HH1 ARG 102 12.054 2.098 -0.681
736 2HH1 ARG 102 2HH1 ARG 102 12.525 0.776 -1.712
737 1HH2 ARG 102 1HH2 ARG 102 9.636 0.957 -3.719
738 2HH2 ARG 102 2HH2 ARG 102 11.123 0.107 -3.440
739 H PHE 103 H PHE 103 5.994 3.886 1.188
740 HA PHE 103 HA PHE 103 5.774 3.479 4.084
741 1HB PHE 103 2HB PHE 103 3.616 3.799 3.312
742 2HB PHE 103 1HB PHE 103 3.973 3.138 1.726
743 HD1 PHE 103 1HD PHE 103 2.930 2.424 5.126
744 HD2 PHE 103 2HD PHE 103 3.855 0.760 1.327
745 HE1 PHE 103 1HE PHE 103 1.853 0.324 5.793
746 HE2 PHE 103 2HE PHE 103 2.774 -1.344 1.985
747 HZ PHE 103 HZ PHE 103 1.759 -1.563 4.185
748 H THR 104 H THR 104 5.797 1.249 4.869
749 HA THR 104 HA THR 104 6.635 -0.815 3.063
750 HB THR 104 HB THR 104 8.611 0.275 5.083
751 HG1 THR 104 1HG THR 104 8.335 0.904 2.629
752 1HG2 THR 104 1HG2 THR 104 8.752 -2.296 3.503
753 2HG2 THR 104 2HG2 THR 104 8.563 -2.160 5.249
754 3HG2 THR 104 3HG2 THR 104 10.057 -1.621 4.482
755 H VAL 105 H VAL 105 4.976 -2.099 3.828
756 HA VAL 105 HA VAL 105 5.342 -2.938 6.625
757 HB VAL 105 HB VAL 105 3.001 -2.345 6.012
758 1HG1 VAL 105 1HG1 VAL 105 3.014 -3.047 3.694
759 2HG1 VAL 105 2HG1 VAL 105 1.729 -3.867 4.580
760 3HG1 VAL 105 3HG1 VAL 105 3.215 -4.730 4.183
761 1HG2 VAL 105 1HG2 VAL 105 3.360 -5.273 6.634
762 2HG2 VAL 105 2HG2 VAL 105 1.977 -4.257 7.052
763 3HG2 VAL 105 3HG2 VAL 105 3.545 -3.965 7.801
764 H TYR 106 H TYR 106 6.053 -4.894 7.090
765 HA TYR 106 HA TYR 106 6.626 -6.728 4.878
766 1HB TYR 106 2HB TYR 106 7.766 -6.564 7.673
767 2HB TYR 106 1HB TYR 106 8.097 -7.871 6.549
768 HD1 TYR 106 1HD TYR 106 9.154 -7.228 4.285
769 HD2 TYR 106 2HD TYR 106 9.113 -4.663 7.679
770 HE1 TYR 106 1HE TYR 106 11.040 -5.966 3.345
771 HE2 TYR 106 2HE TYR 106 10.998 -3.390 6.746
772 HH TYR 106 HH TYR 106 12.003 -3.681 3.536
773 H LEU 107 H LEU 107 4.912 -7.985 4.616
774 HA LEU 107 HA LEU 107 3.795 -9.246 7.021
775 1HB LEU 107 2HB LEU 107 1.609 -9.160 6.076
776 2HB LEU 107 1HB LEU 107 2.285 -7.552 5.982
777 HG LEU 107 HG LEU 107 2.949 -8.426 3.533
778 1HD1 LEU 107 1HD1 LEU 107 1.088 -9.689 2.584
779 2HD1 LEU 107 2HD1 LEU 107 0.367 -9.844 4.185
780 3HD1 LEU 107 3HD1 LEU 107 1.915 -10.615 3.837
781 1HD2 LEU 107 1HD2 LEU 107 0.979 -7.224 2.729
782 2HD2 LEU 107 2HD2 LEU 107 1.759 -6.374 4.063
783 3HD2 LEU 107 3HD2 LEU 107 0.279 -7.290 4.346
784 H LYS 108 H LYS 108 3.287 -11.470 6.818
785 HA LYS 108 HA LYS 108 4.698 -12.692 4.548
786 1HB LYS 108 2HB LYS 108 5.404 -13.253 6.915
787 2HB LYS 108 1HB LYS 108 3.851 -14.055 7.093
788 1HG LYS 108 2HG LYS 108 4.490 -15.366 5.002
789 2HG LYS 108 1HG LYS 108 6.132 -14.786 5.308
790 1HD LYS 108 2HD LYS 108 5.998 -15.731 7.593
791 2HD LYS 108 1HD LYS 108 4.415 -16.400 7.189
792 1HE LYS 108 2HE LYS 108 5.439 -17.696 5.382
793 2HE LYS 108 1HE LYS 108 7.019 -17.041 5.816
794 1HZ LYS 108 1HZ LYS 108 6.660 -18.028 8.066
795 2HZ LYS 108 2HZ LYS 108 6.833 -19.161 6.818
796 3HZ LYS 108 3HZ LYS 108 5.293 -18.819 7.449
797 H ALA 109 H ALA 109 3.601 -13.832 3.074
798 HA ALA 109 HA ALA 109 0.690 -13.868 3.429
799 1HB ALA 109 1HB ALA 109 2.363 -13.917 0.919
800 2HB ALA 109 2HB ALA 109 1.492 -12.526 1.565
801 3HB ALA 109 3HB ALA 109 0.603 -13.928 0.969
802 H ASN 110 H ASN 110 -0.383 -15.717 3.488
803 HA ASN 110 HA ASN 110 0.125 -18.054 2.124
804 1HB ASN 110 2HB ASN 110 1.076 -19.582 3.777
805 2HB ASN 110 1HB ASN 110 2.205 -18.280 3.439
806 1HD2 ASN 110 1HD2 ASN 110 1.374 -16.271 5.067
807 2HD2 ASN 110 2HD2 ASN 110 1.436 -16.767 6.721
Start of MODEL 5
1 H HIS 3 H HIS 3 -6.138 -9.975 4.193
2 HA HIS 3 HA HIS 3 -5.469 -9.059 6.893
3 1HB HIS 3 2HB HIS 3 -3.613 -10.518 6.543
4 2HB HIS 3 1HB HIS 3 -3.566 -10.133 4.819
5 HD1 HIS 3 1HD HIS 3 -3.058 -8.228 8.076
6 HD2 HIS 3 2HD HIS 3 -1.497 -8.502 4.221
7 HE1 HIS 3 1HE HIS 3 -1.178 -6.560 7.988
8 HE2 HIS 3 2HE HIS 3 -0.200 -6.798 5.678
9 H LYS 4 H LYS 4 -5.067 -6.839 6.960
10 HA LYS 4 HA LYS 4 -4.706 -5.478 4.388
11 1HB LYS 4 2HB LYS 4 -6.378 -3.843 4.829
12 2HB LYS 4 1HB LYS 4 -7.120 -5.421 5.078
13 1HG LYS 4 2HG LYS 4 -7.076 -5.179 7.426
14 2HG LYS 4 1HG LYS 4 -6.008 -3.778 7.334
15 1HD LYS 4 2HD LYS 4 -7.854 -2.594 6.095
16 2HD LYS 4 1HD LYS 4 -8.901 -3.953 6.512
17 1HE LYS 4 2HE LYS 4 -8.529 -3.547 8.875
18 2HE LYS 4 1HE LYS 4 -7.411 -2.239 8.495
19 1HZ LYS 4 1HZ LYS 4 -9.509 -1.307 9.054
20 2HZ LYS 4 2HZ LYS 4 -10.327 -2.307 7.959
21 3HZ LYS 4 3HZ LYS 4 -9.289 -1.093 7.387
22 H VAL 5 H VAL 5 -3.513 -3.584 4.477
23 HA VAL 5 HA VAL 5 -2.362 -2.952 7.104
24 HB VAL 5 HB VAL 5 -1.101 -3.065 4.411
25 1HG1 VAL 5 1HG1 VAL 5 -0.407 -0.939 6.417
26 2HG1 VAL 5 2HG1 VAL 5 -0.879 -0.716 4.731
27 3HG1 VAL 5 3HG1 VAL 5 0.670 -1.470 5.125
28 1HG2 VAL 5 1HG2 VAL 5 -0.030 -3.368 7.209
29 2HG2 VAL 5 2HG2 VAL 5 0.797 -3.797 5.711
30 3HG2 VAL 5 3HG2 VAL 5 -0.647 -4.685 6.204
31 H THR 6 H THR 6 -2.550 -0.981 7.895
32 HA THR 6 HA THR 6 -3.517 1.191 6.177
33 HB THR 6 HB THR 6 -4.029 2.189 8.578
34 HG1 THR 6 1HG THR 6 -4.875 0.210 9.786
35 1HG2 THR 6 1HG2 THR 6 -5.712 0.154 7.108
36 2HG2 THR 6 2HG2 THR 6 -5.706 1.904 6.875
37 3HG2 THR 6 3HG2 THR 6 -6.322 1.215 8.379
38 H LYS 7 H LYS 7 -2.800 3.400 7.125
39 HA LYS 7 HA LYS 7 -0.247 3.860 6.420
40 1HB LYS 7 2HB LYS 7 -1.959 5.586 6.818
41 2HB LYS 7 1HB LYS 7 -1.710 5.416 8.549
42 1HG LYS 7 2HG LYS 7 -0.569 7.374 7.482
43 2HG LYS 7 1HG LYS 7 0.486 6.307 8.411
44 1HD LYS 7 2HD LYS 7 1.363 5.315 6.440
45 2HD LYS 7 1HD LYS 7 0.134 6.074 5.425
46 1HE LYS 7 2HE LYS 7 2.384 7.140 5.286
47 2HE LYS 7 1HE LYS 7 1.095 8.238 5.769
48 1HZ LYS 7 1HZ LYS 7 2.573 6.918 7.910
49 2HZ LYS 7 2HZ LYS 7 1.959 8.498 7.827
50 3HZ LYS 7 3HZ LYS 7 3.405 8.101 7.027
51 H ALA 8 H ALA 8 -1.205 3.190 9.803
52 HA ALA 8 HA ALA 8 1.178 3.702 11.097
53 1HB ALA 8 1HB ALA 8 -0.881 3.068 12.248
54 2HB ALA 8 2HB ALA 8 0.485 2.087 12.785
55 3HB ALA 8 3HB ALA 8 -0.699 1.413 11.664
56 H HIS 9 H HIS 9 0.335 0.933 9.151
57 HA HIS 9 HA HIS 9 2.470 -0.754 9.923
58 1HB HIS 9 2HB HIS 9 0.789 -0.723 7.434
59 2HB HIS 9 1HB HIS 9 1.970 -1.970 7.803
60 HD1 HIS 9 1HD HIS 9 -1.399 -0.728 8.746
61 HD2 HIS 9 2HD HIS 9 1.175 -3.813 9.773
62 HE1 HIS 9 1HE HIS 9 -2.844 -2.488 9.803
63 HE2 HIS 9 2HE HIS 9 -1.209 -4.187 10.715
64 H ASN 10 H ASN 10 2.551 2.123 8.271
65 HA ASN 10 HA ASN 10 4.500 1.989 6.354
66 1HB ASN 10 2HB ASN 10 3.520 4.114 7.033
67 2HB ASN 10 1HB ASN 10 4.227 3.969 8.642
68 1HD2 ASN 10 1HD2 ASN 10 5.901 3.277 5.622
69 2HD2 ASN 10 2HD2 ASN 10 7.021 4.584 5.733
70 H GLY 11 H GLY 11 4.708 1.154 9.692
71 1HA GLY 11 2HA GLY 11 7.479 0.264 9.258
72 2HA GLY 11 1HA GLY 11 7.115 1.201 10.704
73 H ALA 12 H ALA 12 5.649 -1.558 8.952
74 HA ALA 12 HA ALA 12 5.203 -2.821 11.588
75 1HB ALA 12 1HB ALA 12 3.292 -3.979 10.392
76 2HB ALA 12 2HB ALA 12 3.541 -2.800 9.100
77 3HB ALA 12 3HB ALA 12 3.111 -2.257 10.722
78 H THR 13 H THR 13 5.130 -5.116 11.685
79 HA THR 13 HA THR 13 6.153 -6.706 9.469
80 HB THR 13 HB THR 13 7.532 -6.841 12.164
81 HG1 THR 13 1HG THR 13 7.994 -5.199 9.972
82 1HG2 THR 13 1HG2 THR 13 8.243 -8.001 9.467
83 2HG2 THR 13 2HG2 THR 13 7.585 -8.899 10.836
84 3HG2 THR 13 3HG2 THR 13 9.187 -8.173 10.946
85 H LEU 14 H LEU 14 4.714 -8.370 9.387
86 HA LEU 14 HA LEU 14 3.918 -9.777 11.771
87 1HB LEU 14 2HB LEU 14 1.579 -9.331 11.707
88 2HB LEU 14 1HB LEU 14 2.418 -7.795 11.786
89 HG LEU 14 HG LEU 14 1.361 -8.950 9.206
90 1HD1 LEU 14 1HD1 LEU 14 0.045 -6.986 11.079
91 2HD1 LEU 14 2HD1 LEU 14 -0.496 -8.633 10.752
92 3HD1 LEU 14 3HD1 LEU 14 -0.531 -7.421 9.471
93 1HD2 LEU 14 1HD2 LEU 14 1.616 -6.703 8.373
94 2HD2 LEU 14 2HD2 LEU 14 3.148 -7.239 9.071
95 3HD2 LEU 14 3HD2 LEU 14 2.110 -6.130 9.966
96 H THR 15 H THR 15 2.341 -11.545 11.279
97 HA THR 15 HA THR 15 2.827 -12.602 8.576
98 HB THR 15 HB THR 15 2.030 -14.036 11.116
99 HG1 THR 15 1HG THR 15 4.317 -13.299 10.619
100 1HG2 THR 15 1HG2 THR 15 2.108 -16.090 9.845
101 2HG2 THR 15 2HG2 THR 15 2.582 -15.212 8.390
102 3HG2 THR 15 3HG2 THR 15 0.968 -14.981 9.069
103 H VAL 16 H VAL 16 1.132 -13.307 7.287
104 HA VAL 16 HA VAL 16 -1.559 -12.566 8.238
105 HB VAL 16 HB VAL 16 -2.050 -11.401 6.290
106 1HG1 VAL 16 1HG1 VAL 16 -0.211 -9.796 5.972
107 2HG1 VAL 16 2HG1 VAL 16 0.872 -10.893 6.829
108 3HG1 VAL 16 3HG1 VAL 16 -0.492 -10.161 7.674
109 1HG2 VAL 16 1HG2 VAL 16 -1.288 -13.068 4.681
110 2HG2 VAL 16 2HG2 VAL 16 0.381 -12.563 4.957
111 3HG2 VAL 16 3HG2 VAL 16 -0.771 -11.441 4.232
112 H ALA 17 H ALA 17 -3.289 -13.749 7.388
113 HA ALA 17 HA ALA 17 -2.560 -16.224 5.982
114 1HB ALA 17 1HB ALA 17 -5.029 -15.462 7.538
115 2HB ALA 17 2HB ALA 17 -3.769 -16.584 8.044
116 3HB ALA 17 3HB ALA 17 -4.818 -16.994 6.687
117 H VAL 18 H VAL 18 -2.918 -16.250 3.853
118 HA VAL 18 HA VAL 18 -4.629 -14.138 2.741
119 HB VAL 18 HB VAL 18 -3.518 -14.502 0.619
120 1HG1 VAL 18 1HG1 VAL 18 -2.421 -12.902 1.907
121 2HG1 VAL 18 2HG1 VAL 18 -1.133 -13.988 1.369
122 3HG1 VAL 18 3HG1 VAL 18 -1.765 -14.103 3.017
123 1HG2 VAL 18 1HG2 VAL 18 -1.982 -16.670 2.035
124 2HG2 VAL 18 2HG2 VAL 18 -1.620 -16.054 0.424
125 3HG2 VAL 18 3HG2 VAL 18 -3.145 -16.888 0.728
126 H GLY 19 H GLY 19 -5.230 -15.065 0.297
127 1HA GLY 19 2HA GLY 19 -6.105 -17.243 -0.637
128 2HA GLY 19 1HA GLY 19 -6.975 -17.374 0.889
129 H GLU 20 H GLU 20 -7.868 -14.847 1.280
130 HA GLU 20 HA GLU 20 -9.864 -14.568 -0.814
131 1HB GLU 20 2HB GLU 20 -9.609 -12.838 1.636
132 2HB GLU 20 1HB GLU 20 -11.054 -13.198 0.700
133 1HG GLU 20 2HG GLU 20 -11.157 -15.410 1.567
134 2HG GLU 20 1HG GLU 20 -9.568 -15.249 2.316
135 H LEU 21 H LEU 21 -7.944 -12.221 1.043
136 HA LEU 21 HA LEU 21 -6.865 -10.943 -1.264
137 1HB LEU 21 2HB LEU 21 -9.136 -10.143 -1.506
138 2HB LEU 21 1HB LEU 21 -9.180 -9.663 0.181
139 HG LEU 21 HG LEU 21 -7.496 -7.924 -0.277
140 1HD1 LEU 21 1HD1 LEU 21 -6.864 -7.381 -2.550
141 2HD1 LEU 21 2HD1 LEU 21 -7.805 -8.741 -3.162
142 3HD1 LEU 21 3HD1 LEU 21 -6.383 -9.034 -2.162
143 1HD2 LEU 21 1HD2 LEU 21 -8.969 -6.436 -1.534
144 2HD2 LEU 21 2HD2 LEU 21 -9.876 -7.399 -0.367
145 3HD2 LEU 21 3HD2 LEU 21 -9.913 -7.823 -2.079
146 H VAL 22 H VAL 22 -4.983 -10.079 -0.619
147 HA VAL 22 HA VAL 22 -4.869 -9.157 2.161
148 HB VAL 22 HB VAL 22 -2.858 -10.572 0.499
149 1HG1 VAL 22 1HG1 VAL 22 -2.076 -8.353 2.405
150 2HG1 VAL 22 2HG1 VAL 22 -1.682 -8.458 0.689
151 3HG1 VAL 22 3HG1 VAL 22 -0.980 -9.607 1.830
152 1HG2 VAL 22 1HG2 VAL 22 -3.404 -10.320 3.450
153 2HG2 VAL 22 2HG2 VAL 22 -2.256 -11.434 2.708
154 3HG2 VAL 22 3HG2 VAL 22 -3.982 -11.597 2.379
155 H GLU 23 H GLU 23 -4.975 -7.086 2.452
156 HA GLU 23 HA GLU 23 -4.511 -5.345 0.139
157 1HB GLU 23 2HB GLU 23 -6.066 -4.832 2.673
158 2HB GLU 23 1HB GLU 23 -5.856 -3.688 1.355
159 1HG GLU 23 2HG GLU 23 -7.029 -5.276 -0.137
160 2HG GLU 23 1HG GLU 23 -7.334 -6.304 1.265
161 H ILE 24 H ILE 24 -3.481 -3.444 0.313
162 HA ILE 24 HA ILE 24 -2.124 -2.736 2.820
163 HB ILE 24 HB ILE 24 -0.947 -2.507 0.035
164 1HG1 ILE 24 2HG1 ILE 24 -0.861 -4.807 0.890
165 2HG1 ILE 24 1HG1 ILE 24 0.751 -4.101 0.823
166 1HG2 ILE 24 1HG2 ILE 24 0.194 -1.722 2.710
167 2HG2 ILE 24 2HG2 ILE 24 -0.360 -0.620 1.449
168 3HG2 ILE 24 3HG2 ILE 24 1.045 -1.649 1.166
169 1HD1 ILE 24 1HD1 ILE 24 0.428 -5.379 2.857
170 2HD1 ILE 24 2HD1 ILE 24 -0.959 -4.375 3.284
171 3HD1 ILE 24 3HD1 ILE 24 0.657 -3.670 3.222
172 H GLN 25 H GLN 25 -3.348 -0.967 3.375
173 HA GLN 25 HA GLN 25 -4.133 0.797 1.167
174 1HB GLN 25 2HB GLN 25 -6.060 -0.277 2.023
175 2HB GLN 25 1HB GLN 25 -5.611 0.081 3.690
176 1HG GLN 25 2HG GLN 25 -5.819 2.441 2.031
177 2HG GLN 25 1HG GLN 25 -7.317 1.515 2.079
178 1HE2 GLN 25 1HE2 GLN 25 -5.042 3.353 3.979
179 2HE2 GLN 25 2HE2 GLN 25 -6.056 3.531 5.367
180 H LEU 26 H LEU 26 -3.656 2.820 1.223
181 HA LEU 26 HA LEU 26 -2.396 3.939 3.622
182 1HB LEU 26 2HB LEU 26 -2.022 4.471 0.702
183 2HB LEU 26 1HB LEU 26 -1.609 5.697 1.874
184 HG LEU 26 HG LEU 26 0.383 4.562 1.293
185 1HD1 LEU 26 1HD1 LEU 26 1.071 3.500 3.438
186 2HD1 LEU 26 2HD1 LEU 26 -0.602 3.651 3.981
187 3HD1 LEU 26 3HD1 LEU 26 0.339 5.098 3.605
188 1HD2 LEU 26 1HD2 LEU 26 -1.028 1.988 1.954
189 2HD2 LEU 26 2HD2 LEU 26 0.665 2.147 1.489
190 3HD2 LEU 26 3HD2 LEU 26 -0.609 2.557 0.337
191 HA PRO 27 HA PRO 27 -5.743 6.927 3.516
192 1HB PRO 27 2HB PRO 27 -4.824 8.712 5.255
193 2HB PRO 27 1HB PRO 27 -5.202 7.067 5.786
194 1HG PRO 27 2HG PRO 27 -2.530 8.299 5.162
195 2HG PRO 27 1HG PRO 27 -3.001 7.198 6.490
196 1HD PRO 27 2HD PRO 27 -1.759 6.430 4.131
197 2HD PRO 27 1HD PRO 27 -2.655 5.351 5.218
198 H SER 28 H SER 28 -3.025 7.181 1.869
199 HA SER 28 HA SER 28 -2.123 8.570 0.350
200 1HB SER 28 2HB SER 28 -4.505 9.021 -0.296
201 2HB SER 28 1HB SER 28 -4.493 10.385 0.820
202 HG SER 28 HG SER 28 -2.790 10.041 -1.437
203 H ASN 29 H ASN 29 -3.545 10.475 2.943
204 HA ASN 29 HA ASN 29 -2.824 12.318 4.082
205 1HB ASN 29 2HB ASN 29 0.039 11.532 3.750
206 2HB ASN 29 1HB ASN 29 -0.788 12.144 5.169
207 1HD2 ASN 29 1HD2 ASN 29 0.142 9.366 3.398
208 2HD2 ASN 29 2HD2 ASN 29 -0.336 8.192 4.578
209 HA PRO 30 HA PRO 30 -1.848 13.592 -0.325
210 1HB PRO 30 2HB PRO 30 -3.760 15.756 0.421
211 2HB PRO 30 1HB PRO 30 -3.683 14.776 -1.050
212 1HG PRO 30 2HG PRO 30 -5.533 14.242 0.748
213 2HG PRO 30 1HG PRO 30 -4.624 12.908 0.003
214 1HD PRO 30 2HD PRO 30 -4.238 14.170 2.694
215 2HD PRO 30 1HD PRO 30 -4.278 12.448 2.257
216 H THR 31 H THR 31 0.106 14.423 -0.425
217 HA THR 31 HA THR 31 0.803 16.784 1.133
218 HB THR 31 HB THR 31 3.070 16.303 0.649
219 HG1 THR 31 1HG THR 31 3.700 14.914 -1.046
220 1HG2 THR 31 1HG2 THR 31 1.954 14.597 2.095
221 2HG2 THR 31 2HG2 THR 31 3.357 13.971 1.229
222 3HG2 THR 31 3HG2 THR 31 1.728 13.584 0.660
223 H THR 32 H THR 32 0.568 15.724 -2.220
224 HA THR 32 HA THR 32 -0.330 18.078 -3.332
225 HB THR 32 HB THR 32 1.749 19.161 -2.746
226 HG1 THR 32 1HG THR 32 1.849 20.089 -4.636
227 1HG2 THR 32 1HG2 THR 32 3.163 17.193 -2.466
228 2HG2 THR 32 2HG2 THR 32 3.932 18.384 -3.515
229 3HG2 THR 32 3HG2 THR 32 3.182 16.949 -4.213
230 H GLY 33 H GLY 33 1.703 17.580 -5.700
231 1HA GLY 33 2HA GLY 33 0.109 15.843 -7.209
232 2HA GLY 33 1HA GLY 33 1.749 16.296 -7.609
233 H PHE 34 H PHE 34 2.469 15.075 -4.895
234 HA PHE 34 HA PHE 34 3.234 12.505 -5.779
235 1HB PHE 34 2HB PHE 34 3.173 13.707 -2.999
236 2HB PHE 34 1HB PHE 34 3.974 12.204 -3.428
237 HD1 PHE 34 1HD PHE 34 3.932 15.732 -4.679
238 HD2 PHE 34 2HD PHE 34 6.240 12.334 -3.600
239 HE1 PHE 34 1HE PHE 34 5.957 16.969 -5.198
240 HE2 PHE 34 2HE PHE 34 8.294 13.578 -4.115
241 HZ PHE 34 HZ PHE 34 8.159 15.898 -4.913
242 H ALA 35 H ALA 35 2.372 10.516 -5.339
243 HA ALA 35 HA ALA 35 0.175 10.230 -3.444
244 1HB ALA 35 1HB ALA 35 -0.082 9.428 -6.355
245 2HB ALA 35 2HB ALA 35 -0.964 10.731 -5.559
246 3HB ALA 35 3HB ALA 35 -1.246 9.056 -5.082
247 H TRP 36 H TRP 36 -0.272 7.856 -3.036
248 HA TRP 36 HA TRP 36 2.283 6.588 -2.753
249 1HB TRP 36 2HB TRP 36 -0.470 5.555 -1.999
250 2HB TRP 36 1HB TRP 36 1.051 4.724 -1.669
251 HD1 TRP 36 HD TRP 36 -1.154 7.533 -0.333
252 HE1 TRP 36 1HE TRP 36 -0.192 8.284 1.916
253 HE3 TRP 36 3HE TRP 36 3.310 5.048 -0.483
254 HZ2 TRP 36 2HZ TRP 36 2.136 7.871 3.446
255 HZ3 TRP 36 3HZ TRP 36 4.853 5.283 1.410
256 HH2 TRP 36 HH TRP 36 4.280 6.675 3.341
257 H TYR 37 H TYR 37 3.252 5.462 -4.238
258 HA TYR 37 HA TYR 37 1.697 3.466 -5.746
259 1HB TYR 37 2HB TYR 37 3.925 5.248 -6.696
260 2HB TYR 37 1HB TYR 37 3.629 3.690 -7.460
261 HD1 TYR 37 1HD TYR 37 2.639 7.111 -7.204
262 HD2 TYR 37 2HD TYR 37 1.370 3.268 -8.517
263 HE1 TYR 37 1HE TYR 37 0.906 8.166 -8.604
264 HE2 TYR 37 2HE TYR 37 -0.362 4.309 -9.923
265 HH TYR 37 HH TYR 37 -0.415 7.611 -10.638
266 H PHE 38 H PHE 38 3.474 1.707 -6.582
267 HA PHE 38 HA PHE 38 5.051 0.915 -4.324
268 1HB PHE 38 2HB PHE 38 4.383 -0.198 -6.943
269 2HB PHE 38 1HB PHE 38 6.037 -0.513 -6.447
270 HD1 PHE 38 1HD PHE 38 2.588 -1.416 -6.052
271 HD2 PHE 38 2HD PHE 38 6.428 -1.653 -4.232
272 HE1 PHE 38 1HE PHE 38 1.801 -3.267 -4.635
273 HE2 PHE 38 2HE PHE 38 5.647 -3.504 -2.814
274 HZ PHE 38 HZ PHE 38 3.330 -4.312 -3.011
275 H GLU 39 H GLU 39 6.256 1.236 -7.647
276 HA GLU 39 HA GLU 39 8.567 2.706 -6.585
277 1HB GLU 39 2HB GLU 39 8.271 1.215 -9.196
278 2HB GLU 39 1HB GLU 39 9.716 2.066 -8.675
279 1HG GLU 39 2HG GLU 39 9.756 0.527 -6.681
280 2HG GLU 39 1HG GLU 39 8.505 -0.412 -7.496
281 H GLY 40 H GLY 40 5.687 3.304 -7.993
282 1HA GLY 40 2HA GLY 40 5.138 5.615 -8.487
283 2HA GLY 40 1HA GLY 40 6.718 5.769 -9.243
284 H GLY 41 H GLY 41 3.433 5.083 -9.713
285 1HA GLY 41 2HA GLY 41 2.227 4.732 -11.654
286 2HA GLY 41 1HA GLY 41 3.736 4.842 -12.554
287 H THR 42 H THR 42 4.169 2.686 -10.125
288 HA THR 42 HA THR 42 3.400 0.373 -11.753
289 HB THR 42 HB THR 42 5.601 -0.580 -10.618
290 HG1 THR 42 1HG THR 42 6.915 1.664 -11.310
291 1HG2 THR 42 1HG2 THR 42 5.111 -0.679 -12.989
292 2HG2 THR 42 2HG2 THR 42 6.773 -0.145 -12.745
293 3HG2 THR 42 3HG2 THR 42 5.526 1.026 -13.178
294 H LYS 43 H LYS 43 2.698 -1.372 -10.671
295 HA LYS 43 HA LYS 43 3.442 -1.624 -7.872
296 1HB LYS 43 2HB LYS 43 1.101 -2.550 -7.447
297 2HB LYS 43 1HB LYS 43 1.309 -0.813 -7.487
298 1HG LYS 43 2HG LYS 43 -0.637 -1.137 -8.680
299 2HG LYS 43 1HG LYS 43 0.576 -1.010 -9.952
300 1HD LYS 43 2HD LYS 43 0.669 -3.498 -10.025
301 2HD LYS 43 1HD LYS 43 -0.653 -3.543 -8.858
302 1HE LYS 43 2HE LYS 43 -2.085 -2.345 -10.425
303 2HE LYS 43 1HE LYS 43 -0.761 -2.265 -11.587
304 1HZ LYS 43 1HZ LYS 43 -2.292 -4.059 -12.111
305 2HZ LYS 43 2HZ LYS 43 -2.037 -4.759 -10.588
306 3HZ LYS 43 3HZ LYS 43 -0.767 -4.682 -11.705
307 H GLU 44 H GLU 44 4.118 -3.590 -7.355
308 HA GLU 44 HA GLU 44 3.381 -5.847 -9.067
309 1HB GLU 44 2HB GLU 44 5.725 -6.637 -9.033
310 2HB GLU 44 1HB GLU 44 5.541 -5.107 -9.875
311 1HG GLU 44 2HG GLU 44 6.363 -3.924 -7.893
312 2HG GLU 44 1HG GLU 44 6.562 -5.467 -7.066
313 H SER 45 H SER 45 3.518 -7.895 -8.073
314 HA SER 45 HA SER 45 3.767 -7.814 -5.128
315 1HB SER 45 2HB SER 45 1.423 -8.171 -5.982
316 2HB SER 45 1HB SER 45 1.984 -9.665 -6.733
317 HG SER 45 HG SER 45 1.315 -10.383 -4.829
318 HA PRO 46 HA PRO 46 7.105 -10.614 -5.873
319 1HB PRO 46 2HB PRO 46 6.855 -11.511 -3.101
320 2HB PRO 46 1HB PRO 46 8.147 -10.584 -3.863
321 1HG PRO 46 2HG PRO 46 6.448 -9.494 -2.063
322 2HG PRO 46 1HG PRO 46 7.154 -8.563 -3.397
323 1HD PRO 46 2HD PRO 46 4.411 -9.750 -3.157
324 2HD PRO 46 1HD PRO 46 4.908 -8.177 -3.817
325 H ASN 47 H ASN 47 3.993 -11.639 -5.084
326 HA ASN 47 HA ASN 47 4.743 -14.467 -5.431
327 1HB ASN 47 2HB ASN 47 2.698 -13.280 -3.549
328 2HB ASN 47 1HB ASN 47 2.696 -14.982 -3.993
329 1HD2 ASN 47 1HD2 ASN 47 3.016 -15.592 -1.855
330 2HD2 ASN 47 2HD2 ASN 47 4.546 -15.420 -1.075
331 H GLU 48 H GLU 48 3.836 -12.453 -7.430
332 HA GLU 48 HA GLU 48 1.099 -13.330 -7.915
333 1HB GLU 48 2HB GLU 48 0.892 -11.479 -9.466
334 2HB GLU 48 1HB GLU 48 1.472 -10.926 -7.908
335 1HG GLU 48 2HG GLU 48 3.696 -10.663 -8.769
336 2HG GLU 48 1HG GLU 48 3.215 -11.361 -10.318
337 H SER 49 H SER 49 1.850 -15.437 -8.471
338 HA SER 49 HA SER 49 2.974 -15.732 -11.147
339 1HB SER 49 2HB SER 49 2.758 -18.211 -10.519
340 2HB SER 49 1HB SER 49 3.882 -17.255 -9.552
341 HG SER 49 HG SER 49 2.500 -18.559 -8.246
342 H MET 50 H MET 50 0.201 -16.906 -9.325
343 HA MET 50 HA MET 50 -1.392 -17.126 -11.793
344 1HB MET 50 2HB MET 50 -2.878 -18.579 -10.363
345 2HB MET 50 1HB MET 50 -1.275 -19.219 -10.693
346 1HG MET 50 2HG MET 50 -0.526 -18.460 -8.487
347 2HG MET 50 1HG MET 50 -2.143 -17.847 -8.153
348 1HE MET 50 1HE MET 50 -0.470 -19.852 -6.293
349 2HE MET 50 2HE MET 50 -1.765 -20.935 -5.781
350 3HE MET 50 3HE MET 50 -2.054 -19.196 -5.882
351 H PHE 51 H PHE 51 -1.143 -15.819 -8.640
352 HA PHE 51 HA PHE 51 -3.621 -14.291 -8.908
353 1HB PHE 51 2HB PHE 51 -1.968 -15.255 -6.607
354 2HB PHE 51 1HB PHE 51 -2.922 -13.791 -6.394
355 HD1 PHE 51 1HD PHE 51 -3.299 -17.283 -7.660
356 HD2 PHE 51 2HD PHE 51 -5.069 -13.997 -5.615
357 HE1 PHE 51 1HE PHE 51 -5.293 -18.649 -7.201
358 HE2 PHE 51 2HE PHE 51 -7.067 -15.358 -5.156
359 HZ PHE 51 HZ PHE 51 -7.181 -17.686 -5.947
360 H THR 52 H THR 52 -3.260 -11.926 -7.862
361 HA THR 52 HA THR 52 -0.727 -10.816 -8.649
362 HB THR 52 HB THR 52 -1.749 -11.345 -10.841
363 HG1 THR 52 1HG THR 52 -0.299 -9.549 -10.660
364 1HG2 THR 52 1HG2 THR 52 -3.658 -10.025 -11.632
365 2HG2 THR 52 2HG2 THR 52 -3.820 -9.295 -10.034
366 3HG2 THR 52 3HG2 THR 52 -4.102 -11.022 -10.247
367 H VAL 53 H VAL 53 -0.841 -8.383 -8.799
368 HA VAL 53 HA VAL 53 -2.411 -7.417 -6.519
369 HB VAL 53 HB VAL 53 -0.051 -7.141 -6.195
370 1HG1 VAL 53 1HG1 VAL 53 1.373 -5.894 -7.757
371 2HG1 VAL 53 2HG1 VAL 53 0.012 -5.750 -8.871
372 3HG1 VAL 53 3HG1 VAL 53 0.685 -7.337 -8.501
373 1HG2 VAL 53 1HG2 VAL 53 -1.227 -4.483 -7.017
374 2HG2 VAL 53 2HG2 VAL 53 0.175 -4.713 -5.971
375 3HG2 VAL 53 3HG2 VAL 53 -1.417 -5.259 -5.444
376 H GLU 54 H GLU 54 -3.779 -5.755 -6.685
377 HA GLU 54 HA GLU 54 -4.057 -4.328 -9.246
378 1HB GLU 54 2HB GLU 54 -6.550 -4.351 -8.744
379 2HB GLU 54 1HB GLU 54 -5.853 -5.896 -9.221
380 1HG GLU 54 2HG GLU 54 -5.693 -6.495 -6.812
381 2HG GLU 54 1HG GLU 54 -6.559 -5.008 -6.435
382 H ASN 55 H ASN 55 -4.566 -2.140 -9.065
383 HA ASN 55 HA ASN 55 -4.317 -1.124 -6.311
384 1HB ASN 55 2HB ASN 55 -3.434 0.954 -7.255
385 2HB ASN 55 1HB ASN 55 -2.463 -0.433 -7.733
386 1HD2 ASN 55 1HD2 ASN 55 -4.663 2.039 -8.807
387 2HD2 ASN 55 2HD2 ASN 55 -4.409 1.803 -10.500
388 H LYS 56 H LYS 56 -5.732 0.246 -5.466
389 HA LYS 56 HA LYS 56 -7.453 1.806 -7.155
390 1HB LYS 56 2HB LYS 56 -9.459 1.125 -5.620
391 2HB LYS 56 1HB LYS 56 -9.063 0.177 -7.037
392 1HG LYS 56 2HG LYS 56 -9.408 -1.472 -5.502
393 2HG LYS 56 1HG LYS 56 -7.671 -1.240 -5.333
394 1HD LYS 56 2HD LYS 56 -8.817 -1.441 -3.164
395 2HD LYS 56 1HD LYS 56 -8.012 0.112 -3.356
396 1HE LYS 56 2HE LYS 56 -10.266 0.243 -2.326
397 2HE LYS 56 1HE LYS 56 -10.058 1.219 -3.771
398 1HZ LYS 56 1HZ LYS 56 -12.193 -0.008 -3.660
399 2HZ LYS 56 2HZ LYS 56 -11.331 -1.466 -3.758
400 3HZ LYS 56 3HZ LYS 56 -11.284 -0.366 -5.047
401 H TYR 57 H TYR 57 -6.952 3.730 -6.463
402 HA TYR 57 HA TYR 57 -6.696 4.145 -3.570
403 1HB TYR 57 2HB TYR 57 -4.909 5.898 -4.268
404 2HB TYR 57 1HB TYR 57 -4.461 4.207 -4.150
405 HD1 TYR 57 1HD TYR 57 -5.722 6.635 -6.713
406 HD2 TYR 57 2HD TYR 57 -3.183 3.331 -5.823
407 HE1 TYR 57 1HE TYR 57 -4.806 6.734 -8.991
408 HE2 TYR 57 2HE TYR 57 -2.270 3.419 -8.109
409 HH TYR 57 HH TYR 57 -2.945 4.250 -10.336
410 H PHE 58 H PHE 58 -7.215 6.240 -2.793
411 HA PHE 58 HA PHE 58 -8.794 7.792 -4.719
412 1HB PHE 58 2HB PHE 58 -9.845 6.279 -2.699
413 2HB PHE 58 1HB PHE 58 -9.750 7.870 -1.947
414 HD1 PHE 58 1HD PHE 58 -10.829 6.241 -5.108
415 HD2 PHE 58 2HD PHE 58 -11.503 9.343 -2.270
416 HE1 PHE 58 1HE PHE 58 -12.878 6.894 -6.309
417 HE2 PHE 58 2HE PHE 58 -13.551 10.001 -3.467
418 HZ PHE 58 HZ PHE 58 -14.239 8.774 -5.488
419 HA PRO 59 HA PRO 59 -6.584 11.268 -2.862
420 1HB PRO 59 2HB PRO 59 -6.410 12.313 -5.535
421 2HB PRO 59 1HB PRO 59 -5.091 11.722 -4.522
422 1HG PRO 59 2HG PRO 59 -5.905 10.491 -6.834
423 2HG PRO 59 1HG PRO 59 -5.101 9.652 -5.490
424 1HD PRO 59 2HD PRO 59 -8.036 9.832 -6.122
425 2HD PRO 59 1HD PRO 59 -7.070 8.409 -5.659
426 HA PRO 60 HA PRO 60 -10.696 12.956 -3.041
427 1HB PRO 60 2HB PRO 60 -10.054 14.699 -0.885
428 2HB PRO 60 1HB PRO 60 -10.907 13.161 -0.838
429 1HG PRO 60 2HG PRO 60 -8.417 13.606 0.258
430 2HG PRO 60 1HG PRO 60 -9.055 12.016 -0.192
431 1HD PRO 60 2HD PRO 60 -7.172 13.801 -1.672
432 2HD PRO 60 1HD PRO 60 -7.149 12.030 -1.497
433 H ASP 61 H ASP 61 -8.929 15.732 -1.791
434 HA ASP 61 HA ASP 61 -9.960 17.343 -3.999
435 1HB ASP 61 2HB ASP 61 -8.233 18.612 -1.971
436 2HB ASP 61 1HB ASP 61 -9.794 19.141 -2.600
437 H SER 62 H SER 62 -7.136 15.971 -2.698
438 HA SER 62 HA SER 62 -4.983 15.861 -3.243
439 1HB SER 62 2HB SER 62 -5.901 16.967 -5.907
440 2HB SER 62 1HB SER 62 -4.321 16.246 -5.597
441 HG SER 62 HG SER 62 -6.582 15.013 -6.244
442 H LYS 63 H LYS 63 -6.446 18.511 -2.478
443 HA LYS 63 HA LYS 63 -3.974 20.085 -2.596
444 1HB LYS 63 2HB LYS 63 -5.405 22.138 -2.521
445 2HB LYS 63 1HB LYS 63 -5.541 21.216 -4.005
446 1HG LYS 63 2HG LYS 63 -7.725 21.863 -3.502
447 2HG LYS 63 1HG LYS 63 -7.636 20.183 -2.977
448 1HD LYS 63 2HD LYS 63 -7.432 20.830 -0.681
449 2HD LYS 63 1HD LYS 63 -7.242 22.534 -1.127
450 1HE LYS 63 2HE LYS 63 -9.550 22.411 -2.125
451 2HE LYS 63 1HE LYS 63 -9.706 20.820 -1.379
452 1HZ LYS 63 1HZ LYS 63 -9.336 23.429 -0.009
453 2HZ LYS 63 2HZ LYS 63 -9.204 21.939 0.782
454 3HZ LYS 63 3HZ LYS 63 -10.678 22.392 0.087
455 H LEU 64 H LEU 64 -6.215 18.508 -0.653
456 HA LEU 64 HA LEU 64 -4.980 19.610 1.717
457 1HB LEU 64 2HB LEU 64 -6.903 21.096 1.354
458 2HB LEU 64 1HB LEU 64 -7.971 19.701 1.362
459 HG LEU 64 HG LEU 64 -7.313 19.247 3.709
460 1HD1 LEU 64 1HD1 LEU 64 -5.856 21.872 3.468
461 2HD1 LEU 64 2HD1 LEU 64 -5.117 20.284 3.680
462 3HD1 LEU 64 3HD1 LEU 64 -6.117 20.970 4.961
463 1HD2 LEU 64 1HD2 LEU 64 -8.577 21.069 4.700
464 2HD2 LEU 64 2HD2 LEU 64 -9.329 20.541 3.195
465 3HD2 LEU 64 3HD2 LEU 64 -8.378 22.027 3.235
466 H LEU 65 H LEU 65 -8.079 17.926 1.554
467 HA LEU 65 HA LEU 65 -7.172 15.358 2.104
468 1HB LEU 65 2HB LEU 65 -6.866 17.132 4.303
469 2HB LEU 65 1HB LEU 65 -8.153 16.008 4.688
470 HG LEU 65 HG LEU 65 -5.337 15.261 3.893
471 1HD1 LEU 65 1HD1 LEU 65 -5.504 16.206 6.143
472 2HD1 LEU 65 2HD1 LEU 65 -5.146 14.480 6.195
473 3HD1 LEU 65 3HD1 LEU 65 -6.781 15.051 6.534
474 1HD2 LEU 65 1HD2 LEU 65 -6.017 12.978 4.463
475 2HD2 LEU 65 2HD2 LEU 65 -6.932 13.617 3.098
476 3HD2 LEU 65 3HD2 LEU 65 -7.673 13.535 4.698
477 H GLY 66 H GLY 66 -8.819 14.398 1.220
478 1HA GLY 66 2HA GLY 66 -11.561 15.136 1.703
479 2HA GLY 66 1HA GLY 66 -10.990 13.757 0.790
480 H ALA 67 H ALA 67 -11.020 14.959 4.111
481 HA ALA 67 HA ALA 67 -11.480 13.952 6.110
482 1HB ALA 67 1HB ALA 67 -12.600 11.813 6.239
483 2HB ALA 67 2HB ALA 67 -12.237 11.482 4.544
484 3HB ALA 67 3HB ALA 67 -13.349 12.785 4.971
485 H GLY 68 H GLY 68 -10.283 11.303 4.085
486 1HA GLY 68 2HA GLY 68 -7.664 11.452 5.321
487 2HA GLY 68 1HA GLY 68 -8.579 9.992 5.681
488 H GLY 69 H GLY 69 -8.677 11.788 2.655
489 1HA GLY 69 2HA GLY 69 -8.467 11.019 0.482
490 2HA GLY 69 1HA GLY 69 -6.917 10.410 1.056
491 H THR 70 H THR 70 -6.849 8.377 0.092
492 HA THR 70 HA THR 70 -6.787 6.526 1.802
493 HB THR 70 HB THR 70 -9.673 6.144 0.928
494 HG1 THR 70 1HG THR 70 -9.444 7.842 2.505
495 1HG2 THR 70 1HG2 THR 70 -7.935 4.713 2.940
496 2HG2 THR 70 2HG2 THR 70 -8.461 4.072 1.379
497 3HG2 THR 70 3HG2 THR 70 -9.646 4.394 2.648
498 H GLU 71 H GLU 71 -5.282 5.893 0.445
499 HA GLU 71 HA GLU 71 -5.999 4.997 -2.256
500 1HB GLU 71 2HB GLU 71 -3.313 5.708 -1.051
501 2HB GLU 71 1HB GLU 71 -3.585 5.235 -2.722
502 1HG GLU 71 2HG GLU 71 -5.073 7.234 -2.950
503 2HG GLU 71 1HG GLU 71 -4.533 7.729 -1.347
504 H HIS 72 H HIS 72 -6.168 2.802 -2.506
505 HA HIS 72 HA HIS 72 -4.765 1.172 -0.489
506 1HB HIS 72 2HB HIS 72 -7.035 0.195 -2.181
507 2HB HIS 72 1HB HIS 72 -6.355 -0.542 -0.752
508 HD1 HIS 72 1HD HIS 72 -8.516 -0.715 0.463
509 HD2 HIS 72 2HD HIS 72 -7.603 3.199 -0.628
510 HE1 HIS 72 1HE HIS 72 -10.226 0.707 1.558
511 HE2 HIS 72 2HE HIS 72 -9.851 3.022 0.672
512 H PHE 73 H PHE 73 -3.523 -0.474 -1.044
513 HA PHE 73 HA PHE 73 -3.261 -1.170 -3.886
514 1HB PHE 73 2HB PHE 73 -1.285 -0.958 -1.654
515 2HB PHE 73 1HB PHE 73 -0.988 -2.134 -2.934
516 HD1 PHE 73 1HD PHE 73 0.188 -1.447 -4.796
517 HD2 PHE 73 2HD PHE 73 -1.933 1.442 -2.499
518 HE1 PHE 73 1HE PHE 73 1.116 0.351 -6.198
519 HE2 PHE 73 2HE PHE 73 -1.007 3.242 -3.898
520 HZ PHE 73 HZ PHE 73 0.446 2.679 -5.816
521 H HIS 74 H HIS 74 -4.231 -3.015 -4.322
522 HA HIS 74 HA HIS 74 -4.731 -4.891 -2.113
523 1HB HIS 74 2HB HIS 74 -6.181 -4.268 -4.672
524 2HB HIS 74 1HB HIS 74 -6.443 -5.796 -3.850
525 HD1 HIS 74 1HD HIS 74 -8.918 -5.100 -3.545
526 HD2 HIS 74 2HD HIS 74 -6.189 -2.655 -1.546
527 HE1 HIS 74 1HE HIS 74 -10.260 -3.795 -1.888
528 HE2 HIS 74 2HE HIS 74 -8.543 -2.640 -0.471
529 H VAL 75 H VAL 75 -3.282 -6.574 -2.117
530 HA VAL 75 HA VAL 75 -2.687 -7.673 -4.770
531 HB VAL 75 HB VAL 75 -0.770 -8.789 -3.951
532 1HG1 VAL 75 1HG1 VAL 75 -0.782 -6.082 -2.634
533 2HG1 VAL 75 2HG1 VAL 75 -0.463 -6.398 -4.341
534 3HG1 VAL 75 3HG1 VAL 75 0.639 -7.017 -3.110
535 1HG2 VAL 75 1HG2 VAL 75 -1.647 -8.043 -1.177
536 2HG2 VAL 75 2HG2 VAL 75 -0.082 -8.770 -1.582
537 3HG2 VAL 75 3HG2 VAL 75 -1.581 -9.660 -1.886
538 H THR 76 H THR 76 -3.823 -9.308 -5.363
539 HA THR 76 HA THR 76 -5.259 -10.872 -3.342
540 HB THR 76 HB THR 76 -5.712 -10.950 -6.335
541 HG1 THR 76 1HG THR 76 -6.269 -8.897 -6.047
542 1HG2 THR 76 1HG2 THR 76 -7.964 -11.682 -5.678
543 2HG2 THR 76 2HG2 THR 76 -7.505 -11.561 -3.979
544 3HG2 THR 76 3HG2 THR 76 -6.723 -12.750 -5.022
545 H VAL 77 H VAL 77 -3.995 -12.521 -2.753
546 HA VAL 77 HA VAL 77 -2.963 -14.341 -4.739
547 HB VAL 77 HB VAL 77 -1.151 -12.747 -4.732
548 1HG1 VAL 77 1HG1 VAL 77 0.080 -12.177 -2.681
549 2HG1 VAL 77 2HG1 VAL 77 -1.119 -13.056 -1.734
550 3HG1 VAL 77 3HG1 VAL 77 -1.593 -11.619 -2.638
551 1HG2 VAL 77 1HG2 VAL 77 0.707 -14.148 -4.000
552 2HG2 VAL 77 2HG2 VAL 77 -0.526 -15.111 -4.815
553 3HG2 VAL 77 3HG2 VAL 77 -0.402 -15.143 -3.053
554 H LYS 78 H LYS 78 -2.822 -16.369 -3.962
555 HA LYS 78 HA LYS 78 -2.409 -16.667 -1.090
556 1HB LYS 78 2HB LYS 78 -3.584 -18.988 -1.503
557 2HB LYS 78 1HB LYS 78 -4.509 -17.544 -1.140
558 1HG LYS 78 2HG LYS 78 -5.705 -18.457 -2.863
559 2HG LYS 78 1HG LYS 78 -4.681 -17.306 -3.712
560 1HD LYS 78 2HD LYS 78 -4.763 -19.387 -4.933
561 2HD LYS 78 1HD LYS 78 -3.139 -19.147 -4.297
562 1HE LYS 78 2HE LYS 78 -5.210 -20.835 -2.901
563 2HE LYS 78 1HE LYS 78 -4.115 -21.485 -4.116
564 1HZ LYS 78 1HZ LYS 78 -2.242 -20.822 -2.731
565 2HZ LYS 78 2HZ LYS 78 -3.278 -21.865 -1.889
566 3HZ LYS 78 3HZ LYS 78 -3.300 -20.204 -1.561
567 H ALA 79 H ALA 79 -0.319 -17.054 -1.004
568 HA ALA 79 HA ALA 79 0.759 -19.461 -2.056
569 1HB ALA 79 1HB ALA 79 0.859 -18.103 -4.105
570 2HB ALA 79 2HB ALA 79 2.471 -18.500 -3.509
571 3HB ALA 79 3HB ALA 79 1.805 -16.889 -3.244
572 H ALA 80 H ALA 80 2.587 -20.051 -0.964
573 HA ALA 80 HA ALA 80 2.991 -18.683 1.506
574 1HB ALA 80 1HB ALA 80 2.969 -21.112 1.378
575 2HB ALA 80 2HB ALA 80 4.499 -20.528 2.032
576 3HB ALA 80 3HB ALA 80 4.408 -21.081 0.360
577 H GLY 81 H GLY 81 3.990 -16.766 1.296
578 1HA GLY 81 2HA GLY 81 6.844 -16.791 0.968
579 2HA GLY 81 1HA GLY 81 6.024 -15.943 -0.340
580 H THR 82 H THR 82 7.736 -14.538 1.342
581 HA THR 82 HA THR 82 5.885 -13.202 3.180
582 HB THR 82 HB THR 82 8.845 -12.649 2.987
583 HG1 THR 82 1HG THR 82 8.697 -14.841 3.448
584 1HG2 THR 82 1HG2 THR 82 7.500 -11.032 4.239
585 2HG2 THR 82 2HG2 THR 82 8.530 -11.959 5.331
586 3HG2 THR 82 3HG2 THR 82 6.810 -12.339 5.203
587 H HIS 83 H HIS 83 5.208 -11.183 2.892
588 HA HIS 83 HA HIS 83 5.744 -10.044 0.240
589 1HB HIS 83 2HB HIS 83 3.347 -10.781 1.071
590 2HB HIS 83 1HB HIS 83 3.410 -9.284 1.984
591 HD1 HIS 83 1HD HIS 83 4.054 -7.097 0.398
592 HD2 HIS 83 2HD HIS 83 2.289 -10.400 -1.403
593 HE1 HIS 83 1HE HIS 83 3.099 -6.237 -1.759
594 HE2 HIS 83 2HE HIS 83 2.156 -8.292 -2.907
595 H ALA 84 H ALA 84 7.310 -8.532 0.459
596 HA ALA 84 HA ALA 84 7.147 -6.688 2.731
597 1HB ALA 84 1HB ALA 84 9.420 -6.008 2.118
598 2HB ALA 84 2HB ALA 84 9.371 -7.089 0.727
599 3HB ALA 84 3HB ALA 84 9.323 -7.753 2.358
600 H VAL 85 H VAL 85 6.092 -4.876 2.421
601 HA VAL 85 HA VAL 85 5.579 -4.069 -0.370
602 HB VAL 85 HB VAL 85 3.970 -3.092 1.952
603 1HG1 VAL 85 1HG1 VAL 85 2.176 -3.078 0.269
604 2HG1 VAL 85 2HG1 VAL 85 3.328 -3.668 -0.929
605 3HG1 VAL 85 3HG1 VAL 85 3.556 -2.082 -0.192
606 1HG2 VAL 85 1HG2 VAL 85 3.558 -5.749 0.596
607 2HG2 VAL 85 2HG2 VAL 85 2.483 -5.010 1.783
608 3HG2 VAL 85 3HG2 VAL 85 4.109 -5.512 2.256
609 H ASN 86 H ASN 86 7.093 -2.588 -0.866
610 HA ASN 86 HA ASN 86 7.379 -0.264 0.928
611 1HB ASN 86 2HB ASN 86 9.199 -1.305 -1.261
612 2HB ASN 86 1HB ASN 86 9.417 0.252 -0.479
613 1HD2 ASN 86 1HD2 ASN 86 8.435 -2.743 1.104
614 2HD2 ASN 86 2HD2 ASN 86 9.857 -2.899 2.069
615 H LEU 87 H LEU 87 5.883 1.145 0.367
616 HA LEU 87 HA LEU 87 5.305 1.561 -2.482
617 1HB LEU 87 2HB LEU 87 3.681 2.206 -0.022
618 2HB LEU 87 1HB LEU 87 3.218 2.636 -1.659
619 HG LEU 87 HG LEU 87 3.632 -0.215 -0.750
620 1HD1 LEU 87 1HD1 LEU 87 1.786 0.836 0.482
621 2HD1 LEU 87 2HD1 LEU 87 1.210 -0.372 -0.670
622 3HD1 LEU 87 3HD1 LEU 87 1.067 1.345 -1.050
623 1HD2 LEU 87 1HD2 LEU 87 2.416 -0.741 -2.781
624 2HD2 LEU 87 2HD2 LEU 87 3.895 0.153 -3.128
625 3HD2 LEU 87 3HD2 LEU 87 2.334 0.975 -3.184
626 H THR 88 H THR 88 5.841 3.427 -3.411
627 HA THR 88 HA THR 88 7.083 5.456 -1.701
628 HB THR 88 HB THR 88 7.399 5.189 -4.692
629 HG1 THR 88 1HG THR 88 8.235 3.301 -4.053
630 1HG2 THR 88 1HG2 THR 88 9.503 6.382 -4.268
631 2HG2 THR 88 2HG2 THR 88 9.138 6.421 -2.543
632 3HG2 THR 88 3HG2 THR 88 8.124 7.310 -3.679
633 H TYR 89 H TYR 89 6.066 7.272 -1.393
634 HA TYR 89 HA TYR 89 3.713 8.003 -2.933
635 1HB TYR 89 2HB TYR 89 3.814 8.092 -0.413
636 2HB TYR 89 1HB TYR 89 4.995 9.385 -0.557
637 HD1 TYR 89 1HD TYR 89 1.476 8.473 -0.988
638 HD2 TYR 89 2HD TYR 89 4.319 11.617 -1.158
639 HE1 TYR 89 1HE TYR 89 -0.353 10.106 -1.054
640 HE2 TYR 89 2HE TYR 89 2.496 13.259 -1.224
641 HH TYR 89 HH TYR 89 -0.135 13.021 -2.119
642 H MET 90 H MET 90 4.306 8.860 -4.875
643 HA MET 90 HA MET 90 6.237 11.094 -4.878
644 1HB MET 90 2HB MET 90 6.150 8.800 -6.828
645 2HB MET 90 1HB MET 90 7.112 10.247 -7.035
646 1HG MET 90 2HG MET 90 8.325 9.670 -4.964
647 2HG MET 90 1HG MET 90 7.412 8.162 -4.909
648 1HE MET 90 1HE MET 90 7.242 8.162 -8.298
649 2HE MET 90 2HE MET 90 7.269 6.672 -7.350
650 3HE MET 90 3HE MET 90 8.450 6.919 -8.636
651 H ARG 91 H ARG 91 5.992 12.588 -6.592
652 HA ARG 91 HA ARG 91 3.535 12.829 -7.963
653 1HB ARG 91 2HB ARG 91 6.229 14.090 -8.140
654 2HB ARG 91 1HB ARG 91 5.283 14.102 -9.632
655 1HG ARG 91 2HG ARG 91 3.435 15.184 -8.421
656 2HG ARG 91 1HG ARG 91 4.440 15.228 -6.972
657 1HD ARG 91 2HD ARG 91 6.050 16.652 -8.096
658 2HD ARG 91 1HD ARG 91 5.132 16.544 -9.599
659 HE ARG 91 HE ARG 91 3.319 17.542 -7.868
660 1HH1 ARG 91 1HH1 ARG 91 6.570 18.518 -8.737
661 2HH1 ARG 91 2HH1 ARG 91 6.305 20.190 -8.348
662 1HH2 ARG 91 1HH2 ARG 91 2.953 19.723 -7.383
663 2HH2 ARG 91 2HH2 ARG 91 4.237 20.884 -7.589
664 HA PRO 92 HA PRO 92 4.121 8.939 -10.025
665 1HB PRO 92 2HB PRO 92 2.196 9.507 -12.038
666 2HB PRO 92 1HB PRO 92 1.955 8.599 -10.544
667 1HG PRO 92 2HG PRO 92 1.332 11.433 -11.155
668 2HG PRO 92 1HG PRO 92 0.538 10.315 -10.032
669 1HD PRO 92 2HD PRO 92 2.121 12.302 -9.166
670 2HD PRO 92 1HD PRO 92 2.064 10.729 -8.345
671 H TRP 93 H TRP 93 4.172 11.940 -11.904
672 HA TRP 93 HA TRP 93 5.364 10.574 -14.169
673 1HB TRP 93 2HB TRP 93 5.349 12.864 -15.212
674 2HB TRP 93 1HB TRP 93 3.769 12.237 -14.764
675 HD1 TRP 93 HD TRP 93 6.183 15.063 -14.038
676 HE1 TRP 93 1HE TRP 93 5.035 16.790 -12.502
677 HE3 TRP 93 3HE TRP 93 1.984 12.407 -12.838
678 HZ2 TRP 93 2HZ TRP 93 2.663 16.987 -10.994
679 HZ3 TRP 93 3HZ TRP 93 0.326 13.436 -11.344
680 HH2 TRP 93 HH TRP 93 0.659 15.680 -10.441
681 H THR 94 H THR 94 6.570 11.724 -11.323
682 HA THR 94 HA THR 94 9.252 11.591 -12.287
683 HB THR 94 HB THR 94 9.035 13.846 -12.956
684 HG1 THR 94 1HG THR 94 10.798 13.199 -11.268
685 1HG2 THR 94 1HG2 THR 94 6.961 14.410 -11.798
686 2HG2 THR 94 2HG2 THR 94 8.191 15.643 -11.519
687 3HG2 THR 94 3HG2 THR 94 7.823 14.465 -10.260
688 H GLY 95 H GLY 95 7.667 13.204 -9.488
689 1HA GLY 95 2HA GLY 95 7.779 12.702 -7.219
690 2HA GLY 95 1HA GLY 95 8.471 11.139 -7.679
691 HA PRO 96 HA PRO 96 11.909 14.931 -7.364
692 1HB PRO 96 2HB PRO 96 10.250 15.543 -4.930
693 2HB PRO 96 1HB PRO 96 11.379 16.582 -5.794
694 1HG PRO 96 2HG PRO 96 8.763 16.754 -6.238
695 2HG PRO 96 1HG PRO 96 9.933 16.941 -7.555
696 1HD PRO 96 2HD PRO 96 8.052 14.746 -7.029
697 2HD PRO 96 1HD PRO 96 8.902 15.165 -8.528
698 H SER 97 H SER 97 13.543 13.726 -6.791
699 HA SER 97 HA SER 97 13.582 11.343 -5.562
700 1HB SER 97 2HB SER 97 16.046 11.876 -5.075
701 2HB SER 97 1HB SER 97 15.494 12.008 -6.746
702 HG SER 97 HG SER 97 16.703 13.832 -6.199
703 H HIS 98 H HIS 98 14.420 14.369 -3.839
704 HA HIS 98 HA HIS 98 14.355 12.809 -1.361
705 1HB HIS 98 2HB HIS 98 15.636 14.580 -0.323
706 2HB HIS 98 1HB HIS 98 16.415 14.101 -1.822
707 HD1 HIS 98 1HD HIS 98 14.720 16.974 -0.151
708 HD2 HIS 98 2HD HIS 98 16.420 16.071 -3.845
709 HE1 HIS 98 1HE HIS 98 14.967 19.172 -1.343
710 HE2 HIS 98 2HE HIS 98 15.963 18.607 -3.591
711 H ASP 99 H ASP 99 11.963 13.975 -2.889
712 HA ASP 99 HA ASP 99 10.870 15.402 -0.545
713 1HB ASP 99 2HB ASP 99 11.276 16.772 -2.708
714 2HB ASP 99 1HB ASP 99 9.878 15.906 -3.342
715 H SER 100 H SER 100 10.863 12.591 -2.000
716 HA SER 100 HA SER 100 7.979 12.152 -2.036
717 1HB SER 100 2HB SER 100 10.243 10.333 -2.891
718 2HB SER 100 1HB SER 100 8.521 10.033 -3.138
719 HG SER 100 HG SER 100 10.105 12.102 -4.268
720 H GLU 101 H GLU 101 6.992 10.569 -0.803
721 HA GLU 101 HA GLU 101 8.437 9.773 1.632
722 1HB GLU 101 2HB GLU 101 6.390 11.029 2.019
723 2HB GLU 101 1HB GLU 101 5.481 9.942 0.983
724 1HG GLU 101 2HG GLU 101 4.974 9.482 3.280
725 2HG GLU 101 1HG GLU 101 5.858 8.124 2.595
726 H ARG 102 H ARG 102 7.849 7.499 2.465
727 HA ARG 102 HA ARG 102 6.833 5.686 0.464
728 1HB ARG 102 2HB ARG 102 9.325 5.923 -0.004
729 2HB ARG 102 1HB ARG 102 9.610 5.163 1.556
730 1HG ARG 102 2HG ARG 102 8.549 3.145 0.847
731 2HG ARG 102 1HG ARG 102 8.002 3.898 -0.649
732 1HD ARG 102 2HD ARG 102 10.515 4.271 -1.112
733 2HD ARG 102 1HD ARG 102 10.766 3.053 0.144
734 HE ARG 102 HE ARG 102 8.881 2.222 -1.846
735 1HH1 ARG 102 1HH1 ARG 102 12.309 2.437 -1.141
736 2HH1 ARG 102 2HH1 ARG 102 12.735 1.159 -2.241
737 1HH2 ARG 102 1HH2 ARG 102 9.446 0.562 -3.295
738 2HH2 ARG 102 2HH2 ARG 102 11.106 0.095 -3.469
739 H PHE 103 H PHE 103 5.992 3.920 1.241
740 HA PHE 103 HA PHE 103 5.834 3.588 4.153
741 1HB PHE 103 2HB PHE 103 3.647 3.850 3.445
742 2HB PHE 103 1HB PHE 103 3.974 3.192 1.850
743 HD1 PHE 103 1HD PHE 103 2.976 2.486 5.259
744 HD2 PHE 103 2HD PHE 103 3.942 0.795 1.481
745 HE1 PHE 103 1HE PHE 103 1.934 0.376 5.944
746 HE2 PHE 103 2HE PHE 103 2.897 -1.319 2.159
747 HZ PHE 103 HZ PHE 103 1.935 -1.548 4.389
748 H THR 104 H THR 104 5.788 1.320 4.951
749 HA THR 104 HA THR 104 6.716 -0.735 3.189
750 HB THR 104 HB THR 104 8.612 0.401 5.259
751 HG1 THR 104 1HG THR 104 8.348 0.878 2.690
752 1HG2 THR 104 1HG2 THR 104 8.849 -2.150 3.662
753 2HG2 THR 104 2HG2 THR 104 8.641 -2.023 5.410
754 3HG2 THR 104 3HG2 THR 104 10.126 -1.442 4.652
755 H VAL 105 H VAL 105 5.048 -2.040 3.949
756 HA VAL 105 HA VAL 105 5.353 -2.829 6.765
757 HB VAL 105 HB VAL 105 3.036 -2.326 6.050
758 1HG1 VAL 105 1HG1 VAL 105 3.383 -4.712 4.242
759 2HG1 VAL 105 2HG1 VAL 105 3.197 -3.036 3.726
760 3HG1 VAL 105 3HG1 VAL 105 1.871 -3.857 4.548
761 1HG2 VAL 105 1HG2 VAL 105 3.453 -5.244 6.683
762 2HG2 VAL 105 2HG2 VAL 105 2.011 -4.283 7.018
763 3HG2 VAL 105 3HG2 VAL 105 3.518 -3.937 7.862
764 H TYR 106 H TYR 106 6.058 -4.778 7.323
765 HA TYR 106 HA TYR 106 6.812 -6.646 5.189
766 1HB TYR 106 2HB TYR 106 7.705 -6.433 8.063
767 2HB TYR 106 1HB TYR 106 8.159 -7.740 6.989
768 HD1 TYR 106 1HD TYR 106 9.763 -7.360 5.180
769 HD2 TYR 106 2HD TYR 106 8.673 -4.236 7.852
770 HE1 TYR 106 1HE TYR 106 11.671 -6.029 4.393
771 HE2 TYR 106 2HE TYR 106 10.584 -2.898 7.077
772 HH TYR 106 HH TYR 106 12.696 -3.145 5.982
773 H LEU 107 H LEU 107 5.125 -7.946 4.826
774 HA LEU 107 HA LEU 107 3.895 -9.240 7.165
775 1HB LEU 107 2HB LEU 107 1.749 -9.145 6.125
776 2HB LEU 107 1HB LEU 107 2.421 -7.532 6.087
777 HG LEU 107 HG LEU 107 3.209 -8.414 3.657
778 1HD1 LEU 107 1HD1 LEU 107 1.349 -9.604 2.620
779 2HD1 LEU 107 2HD1 LEU 107 0.560 -9.744 4.192
780 3HD1 LEU 107 3HD1 LEU 107 2.095 -10.562 3.900
781 1HD2 LEU 107 1HD2 LEU 107 2.061 -6.326 4.152
782 2HD2 LEU 107 2HD2 LEU 107 0.540 -7.198 4.331
783 3HD2 LEU 107 3HD2 LEU 107 1.342 -7.139 2.762
784 H LYS 108 H LYS 108 3.374 -11.470 6.868
785 HA LYS 108 HA LYS 108 4.757 -12.639 4.545
786 1HB LYS 108 2HB LYS 108 5.474 -13.347 6.847
787 2HB LYS 108 1HB LYS 108 3.883 -14.070 7.053
788 1HG LYS 108 2HG LYS 108 4.337 -15.410 4.978
789 2HG LYS 108 1HG LYS 108 5.998 -14.826 5.058
790 1HD LYS 108 2HD LYS 108 4.611 -16.328 7.275
791 2HD LYS 108 1HD LYS 108 5.698 -17.058 6.093
792 1HE LYS 108 2HE LYS 108 6.461 -14.806 7.944
793 2HE LYS 108 1HE LYS 108 6.777 -16.509 8.271
794 1HZ LYS 108 1HZ LYS 108 8.183 -16.634 6.360
795 2HZ LYS 108 2HZ LYS 108 8.684 -15.310 7.295
796 3HZ LYS 108 3HZ LYS 108 7.789 -15.055 5.881
797 H ALA 109 H ALA 109 3.611 -13.583 2.995
798 HA ALA 109 HA ALA 109 0.701 -13.703 3.383
799 1HB ALA 109 1HB ALA 109 0.583 -13.556 0.927
800 2HB ALA 109 2HB ALA 109 2.344 -13.495 0.860
801 3HB ALA 109 3HB ALA 109 1.446 -12.189 1.632
802 H ASN 110 H ASN 110 -0.338 -15.586 3.271
803 HA ASN 110 HA ASN 110 0.269 -17.812 1.773
804 1HB ASN 110 2HB ASN 110 1.307 -19.396 3.323
805 2HB ASN 110 1HB ASN 110 2.372 -18.037 3.019
806 1HD2 ASN 110 1HD2 ASN 110 1.409 -16.159 4.802
807 2HD2 ASN 110 2HD2 ASN 110 1.608 -16.744 6.414
Start of MODEL 6
1 H HIS 3 H HIS 3 -6.068 -10.078 4.561
2 HA HIS 3 HA HIS 3 -5.244 -8.886 7.126
3 1HB HIS 3 2HB HIS 3 -3.504 -10.450 6.640
4 2HB HIS 3 1HB HIS 3 -3.601 -10.086 4.913
5 HD1 HIS 3 1HD HIS 3 -2.723 -8.126 8.076
6 HD2 HIS 3 2HD HIS 3 -1.539 -8.576 4.101
7 HE1 HIS 3 1HE HIS 3 -0.802 -6.536 7.753
8 HE2 HIS 3 2HE HIS 3 -0.229 -6.689 5.304
9 H LYS 4 H LYS 4 -5.045 -6.723 7.106
10 HA LYS 4 HA LYS 4 -4.877 -5.387 4.501
11 1HB LYS 4 2HB LYS 4 -6.507 -3.731 5.216
12 2HB LYS 4 1HB LYS 4 -7.200 -5.349 5.307
13 1HG LYS 4 2HG LYS 4 -7.014 -5.394 7.671
14 2HG LYS 4 1HG LYS 4 -6.028 -3.932 7.687
15 1HD LYS 4 2HD LYS 4 -7.957 -2.655 6.826
16 2HD LYS 4 1HD LYS 4 -8.934 -4.126 6.890
17 1HE LYS 4 2HE LYS 4 -8.645 -4.263 9.283
18 2HE LYS 4 1HE LYS 4 -7.547 -2.884 9.263
19 1HZ LYS 4 1HZ LYS 4 -10.427 -2.801 8.521
20 2HZ LYS 4 2HZ LYS 4 -9.368 -1.471 8.549
21 3HZ LYS 4 3HZ LYS 4 -9.769 -2.269 9.992
22 H VAL 5 H VAL 5 -3.604 -3.557 4.445
23 HA VAL 5 HA VAL 5 -2.391 -2.810 7.021
24 HB VAL 5 HB VAL 5 -1.173 -2.978 4.301
25 1HG1 VAL 5 1HG1 VAL 5 0.647 -1.434 5.044
26 2HG1 VAL 5 2HG1 VAL 5 -0.427 -0.897 6.340
27 3HG1 VAL 5 3HG1 VAL 5 -0.883 -0.639 4.657
28 1HG2 VAL 5 1HG2 VAL 5 -0.105 -3.352 7.092
29 2HG2 VAL 5 2HG2 VAL 5 0.716 -3.769 5.590
30 3HG2 VAL 5 3HG2 VAL 5 -0.747 -4.636 6.063
31 H THR 6 H THR 6 -2.679 -0.884 7.785
32 HA THR 6 HA THR 6 -3.552 1.274 6.011
33 HB THR 6 HB THR 6 -4.316 2.334 8.272
34 HG1 THR 6 1HG THR 6 -5.025 0.731 9.760
35 1HG2 THR 6 1HG2 THR 6 -6.537 1.314 8.001
36 2HG2 THR 6 2HG2 THR 6 -5.831 0.073 6.963
37 3HG2 THR 6 3HG2 THR 6 -5.822 1.762 6.452
38 H LYS 7 H LYS 7 -2.916 3.487 7.093
39 HA LYS 7 HA LYS 7 -0.403 4.008 6.412
40 1HB LYS 7 2HB LYS 7 -2.017 5.731 7.001
41 2HB LYS 7 1HB LYS 7 -1.818 5.356 8.707
42 1HG LYS 7 2HG LYS 7 -0.510 7.250 8.383
43 2HG LYS 7 1HG LYS 7 0.649 5.921 8.359
44 1HD LYS 7 2HD LYS 7 0.077 6.066 5.722
45 2HD LYS 7 1HD LYS 7 -0.213 7.742 6.196
46 1HE LYS 7 2HE LYS 7 2.321 6.195 6.724
47 2HE LYS 7 1HE LYS 7 2.098 7.401 5.460
48 1HZ LYS 7 1HZ LYS 7 3.232 8.257 7.458
49 2HZ LYS 7 2HZ LYS 7 1.836 7.957 8.373
50 3HZ LYS 7 3HZ LYS 7 1.800 9.094 7.114
51 H ALA 8 H ALA 8 -1.175 3.119 9.815
52 HA ALA 8 HA ALA 8 1.325 3.731 10.900
53 1HB ALA 8 1HB ALA 8 -0.546 1.555 11.812
54 2HB ALA 8 2HB ALA 8 -0.678 3.263 12.238
55 3HB ALA 8 3HB ALA 8 0.718 2.325 12.770
56 H HIS 9 H HIS 9 0.295 0.888 9.154
57 HA HIS 9 HA HIS 9 2.415 -0.829 9.901
58 1HB HIS 9 2HB HIS 9 0.754 -0.790 7.390
59 2HB HIS 9 1HB HIS 9 1.891 -2.061 7.802
60 HD1 HIS 9 1HD HIS 9 -1.462 -0.717 8.650
61 HD2 HIS 9 2HD HIS 9 1.001 -3.854 9.793
62 HE1 HIS 9 1HE HIS 9 -2.985 -2.422 9.694
63 HE2 HIS 9 2HE HIS 9 -1.440 -4.190 10.611
64 H ASN 10 H ASN 10 2.493 2.032 8.227
65 HA ASN 10 HA ASN 10 4.427 1.918 6.307
66 1HB ASN 10 2HB ASN 10 3.436 4.040 6.967
67 2HB ASN 10 1HB ASN 10 4.122 3.894 8.587
68 1HD2 ASN 10 1HD2 ASN 10 4.759 4.677 5.271
69 2HD2 ASN 10 2HD2 ASN 10 6.320 5.373 5.519
70 H GLY 11 H GLY 11 4.705 1.015 9.590
71 1HA GLY 11 2HA GLY 11 7.480 0.200 9.101
72 2HA GLY 11 1HA GLY 11 7.153 1.154 10.546
73 H ALA 12 H ALA 12 5.704 -1.647 8.861
74 HA ALA 12 HA ALA 12 5.364 -2.907 11.520
75 1HB ALA 12 1HB ALA 12 3.569 -2.865 9.120
76 2HB ALA 12 2HB ALA 12 3.213 -2.355 10.772
77 3HB ALA 12 3HB ALA 12 3.395 -4.072 10.395
78 H THR 13 H THR 13 5.795 -5.055 11.770
79 HA THR 13 HA THR 13 6.323 -6.700 9.389
80 HB THR 13 HB THR 13 7.912 -6.823 11.971
81 HG1 THR 13 1HG THR 13 8.864 -5.217 10.882
82 1HG2 THR 13 1HG2 THR 13 8.145 -8.443 9.431
83 2HG2 THR 13 2HG2 THR 13 7.583 -9.034 10.995
84 3HG2 THR 13 3HG2 THR 13 9.257 -8.517 10.799
85 H LEU 14 H LEU 14 4.899 -8.354 9.356
86 HA LEU 14 HA LEU 14 4.127 -9.746 11.749
87 1HB LEU 14 2HB LEU 14 1.803 -9.224 11.773
88 2HB LEU 14 1HB LEU 14 2.687 -7.713 11.826
89 HG LEU 14 HG LEU 14 1.423 -8.846 9.323
90 1HD1 LEU 14 1HD1 LEU 14 0.423 -6.709 11.201
91 2HD1 LEU 14 2HD1 LEU 14 -0.287 -8.305 10.963
92 3HD1 LEU 14 3HD1 LEU 14 -0.295 -7.131 9.647
93 1HD2 LEU 14 1HD2 LEU 14 2.486 -6.088 9.919
94 2HD2 LEU 14 2HD2 LEU 14 1.791 -6.646 8.396
95 3HD2 LEU 14 3HD2 LEU 14 3.322 -7.313 8.967
96 H THR 15 H THR 15 2.503 -11.482 11.259
97 HA THR 15 HA THR 15 2.957 -12.531 8.555
98 HB THR 15 HB THR 15 2.093 -13.940 11.091
99 HG1 THR 15 1HG THR 15 4.306 -13.379 11.050
100 1HG2 THR 15 1HG2 THR 15 1.097 -14.908 9.030
101 2HG2 THR 15 2HG2 THR 15 2.227 -16.002 9.839
102 3HG2 THR 15 3HG2 THR 15 2.729 -15.130 8.390
103 H VAL 16 H VAL 16 1.224 -13.378 7.339
104 HA VAL 16 HA VAL 16 -1.439 -12.501 8.257
105 HB VAL 16 HB VAL 16 -1.975 -11.577 6.180
106 1HG1 VAL 16 1HG1 VAL 16 -0.453 -10.171 7.430
107 2HG1 VAL 16 2HG1 VAL 16 -0.151 -9.994 5.701
108 3HG1 VAL 16 3HG1 VAL 16 0.934 -10.972 6.690
109 1HG2 VAL 16 1HG2 VAL 16 -1.185 -13.367 4.743
110 2HG2 VAL 16 2HG2 VAL 16 0.487 -12.869 5.021
111 3HG2 VAL 16 3HG2 VAL 16 -0.623 -11.801 4.158
112 H ALA 17 H ALA 17 -3.219 -13.694 7.488
113 HA ALA 17 HA ALA 17 -2.573 -16.269 6.220
114 1HB ALA 17 1HB ALA 17 -3.638 -16.535 8.377
115 2HB ALA 17 2HB ALA 17 -4.785 -16.989 7.115
116 3HB ALA 17 3HB ALA 17 -4.923 -15.422 7.914
117 H VAL 18 H VAL 18 -2.961 -16.222 4.100
118 HA VAL 18 HA VAL 18 -4.674 -14.124 3.030
119 HB VAL 18 HB VAL 18 -3.708 -14.604 0.886
120 1HG1 VAL 18 1HG1 VAL 18 -2.324 -13.220 2.254
121 2HG1 VAL 18 2HG1 VAL 18 -1.274 -14.350 1.387
122 3HG1 VAL 18 3HG1 VAL 18 -1.656 -14.622 3.089
123 1HG2 VAL 18 1HG2 VAL 18 -2.144 -16.423 0.508
124 2HG2 VAL 18 2HG2 VAL 18 -3.707 -17.045 1.040
125 3HG2 VAL 18 3HG2 VAL 18 -2.356 -16.968 2.170
126 H GLY 19 H GLY 19 -5.507 -15.182 0.666
127 1HA GLY 19 2HA GLY 19 -6.593 -17.306 -0.095
128 2HA GLY 19 1HA GLY 19 -7.323 -17.360 1.511
129 H GLU 20 H GLU 20 -8.318 -15.029 2.030
130 HA GLU 20 HA GLU 20 -10.336 -14.490 0.059
131 1HB GLU 20 2HB GLU 20 -9.600 -12.831 2.482
132 2HB GLU 20 1HB GLU 20 -11.121 -12.798 1.598
133 1HG GLU 20 2HG GLU 20 -11.622 -15.055 2.350
134 2HG GLU 20 1HG GLU 20 -10.084 -15.116 3.211
135 H LEU 21 H LEU 21 -7.874 -12.498 1.616
136 HA LEU 21 HA LEU 21 -6.927 -11.356 -0.802
137 1HB LEU 21 2HB LEU 21 -9.045 -10.145 -0.643
138 2HB LEU 21 1HB LEU 21 -8.684 -9.697 1.011
139 HG LEU 21 HG LEU 21 -6.731 -8.376 0.141
140 1HD1 LEU 21 1HD1 LEU 21 -6.641 -7.819 -2.194
141 2HD1 LEU 21 2HD1 LEU 21 -8.051 -8.825 -2.528
142 3HD1 LEU 21 3HD1 LEU 21 -6.537 -9.571 -2.012
143 1HD2 LEU 21 1HD2 LEU 21 -8.835 -7.315 0.766
144 2HD2 LEU 21 2HD2 LEU 21 -9.469 -7.601 -0.854
145 3HD2 LEU 21 3HD2 LEU 21 -8.105 -6.507 -0.623
146 H VAL 22 H VAL 22 -5.167 -9.857 -0.404
147 HA VAL 22 HA VAL 22 -4.673 -9.257 2.401
148 HB VAL 22 HB VAL 22 -2.855 -10.845 0.682
149 1HG1 VAL 22 1HG1 VAL 22 -1.509 -8.881 0.573
150 2HG1 VAL 22 2HG1 VAL 22 -0.827 -9.878 1.861
151 3HG1 VAL 22 3HG1 VAL 22 -1.829 -8.484 2.256
152 1HG2 VAL 22 1HG2 VAL 22 -2.068 -11.583 2.884
153 2HG2 VAL 22 2HG2 VAL 22 -3.822 -11.687 2.733
154 3HG2 VAL 22 3HG2 VAL 22 -3.094 -10.368 3.646
155 H GLU 23 H GLU 23 -4.906 -7.095 2.460
156 HA GLU 23 HA GLU 23 -4.062 -5.674 0.031
157 1HB GLU 23 2HB GLU 23 -5.798 -4.182 0.162
158 2HB GLU 23 1HB GLU 23 -6.549 -5.699 0.626
159 1HG GLU 23 2HG GLU 23 -6.628 -5.064 2.907
160 2HG GLU 23 1HG GLU 23 -5.582 -3.673 2.620
161 H ILE 24 H ILE 24 -3.417 -3.557 0.188
162 HA ILE 24 HA ILE 24 -2.238 -2.722 2.743
163 HB ILE 24 HB ILE 24 -0.917 -2.515 0.033
164 1HG1 ILE 24 2HG1 ILE 24 -0.893 -4.833 0.825
165 2HG1 ILE 24 1HG1 ILE 24 0.726 -4.141 0.863
166 1HG2 ILE 24 1HG2 ILE 24 -0.371 -0.668 1.499
167 2HG2 ILE 24 2HG2 ILE 24 1.030 -1.716 1.276
168 3HG2 ILE 24 3HG2 ILE 24 0.097 -1.796 2.771
169 1HD1 ILE 24 1HD1 ILE 24 -1.103 -4.413 3.234
170 2HD1 ILE 24 2HD1 ILE 24 0.556 -3.812 3.247
171 3HD1 ILE 24 3HD1 ILE 24 0.231 -5.495 2.833
172 H GLN 25 H GLN 25 -3.531 -0.952 3.150
173 HA GLN 25 HA GLN 25 -4.019 0.817 0.861
174 1HB GLN 25 2HB GLN 25 -6.109 -0.041 1.559
175 2HB GLN 25 1HB GLN 25 -5.747 0.247 3.262
176 1HG GLN 25 2HG GLN 25 -5.548 2.667 1.747
177 2HG GLN 25 1HG GLN 25 -7.113 1.905 1.485
178 1HE2 GLN 25 1HE2 GLN 25 -4.982 3.309 3.877
179 2HE2 GLN 25 2HE2 GLN 25 -6.192 3.526 5.094
180 H LEU 26 H LEU 26 -3.403 2.824 0.934
181 HA LEU 26 HA LEU 26 -2.354 3.868 3.460
182 1HB LEU 26 2HB LEU 26 -1.572 4.276 0.618
183 2HB LEU 26 1HB LEU 26 -1.355 5.608 1.733
184 HG LEU 26 HG LEU 26 0.712 4.407 1.537
185 1HD1 LEU 26 1HD1 LEU 26 1.109 3.787 3.876
186 2HD1 LEU 26 2HD1 LEU 26 -0.630 3.834 4.168
187 3HD1 LEU 26 3HD1 LEU 26 0.230 5.309 3.721
188 1HD2 LEU 26 1HD2 LEU 26 -0.797 1.953 2.425
189 2HD2 LEU 26 2HD2 LEU 26 0.940 2.062 2.129
190 3HD2 LEU 26 3HD2 LEU 26 -0.198 2.257 0.794
191 HA PRO 27 HA PRO 27 -5.697 6.778 3.279
192 1HB PRO 27 2HB PRO 27 -4.923 8.502 5.129
193 2HB PRO 27 1HB PRO 27 -5.307 6.834 5.582
194 1HG PRO 27 2HG PRO 27 -2.609 8.069 5.061
195 2HG PRO 27 1HG PRO 27 -3.125 7.053 6.429
196 1HD PRO 27 2HD PRO 27 -1.785 6.075 4.278
197 2HD PRO 27 1HD PRO 27 -2.950 5.113 5.207
198 H SER 28 H SER 28 -2.875 7.144 1.863
199 HA SER 28 HA SER 28 -1.955 8.549 0.397
200 1HB SER 28 2HB SER 28 -4.311 8.893 -0.395
201 2HB SER 28 1HB SER 28 -4.425 10.267 0.704
202 HG SER 28 HG SER 28 -2.614 9.967 -1.474
203 H ASN 29 H ASN 29 -3.606 10.565 2.767
204 HA ASN 29 HA ASN 29 -2.947 12.415 3.947
205 1HB ASN 29 2HB ASN 29 -0.091 11.533 3.805
206 2HB ASN 29 1HB ASN 29 -0.938 12.302 5.136
207 1HD2 ASN 29 1HD2 ASN 29 0.111 9.402 3.753
208 2HD2 ASN 29 2HD2 ASN 29 -0.565 8.312 4.920
209 HA PRO 30 HA PRO 30 -1.543 13.715 -0.380
210 1HB PRO 30 2HB PRO 30 -3.546 15.839 0.264
211 2HB PRO 30 1HB PRO 30 -3.271 14.970 -1.254
212 1HG PRO 30 2HG PRO 30 -5.317 14.271 0.238
213 2HG PRO 30 1HG PRO 30 -4.271 13.009 -0.449
214 1HD PRO 30 2HD PRO 30 -4.308 14.100 2.342
215 2HD PRO 30 1HD PRO 30 -4.212 12.413 1.793
216 H THR 31 H THR 31 0.459 14.400 0.023
217 HA THR 31 HA THR 31 0.981 16.668 1.733
218 HB THR 31 HB THR 31 3.271 16.152 1.506
219 HG1 THR 31 1HG THR 31 4.153 15.400 -0.299
220 1HG2 THR 31 1HG2 THR 31 1.979 14.340 2.620
221 2HG2 THR 31 2HG2 THR 31 3.452 13.758 1.847
222 3HG2 THR 31 3HG2 THR 31 1.887 13.492 1.069
223 H THR 32 H THR 32 0.912 15.905 -1.670
224 HA THR 32 HA THR 32 0.443 18.465 -2.620
225 HB THR 32 HB THR 32 2.690 19.051 -1.877
226 HG1 THR 32 1HG THR 32 3.509 19.803 -3.849
227 1HG2 THR 32 1HG2 THR 32 3.704 16.838 -1.835
228 2HG2 THR 32 2HG2 THR 32 4.691 17.959 -2.773
229 3HG2 THR 32 3HG2 THR 32 3.674 16.776 -3.598
230 H GLY 33 H GLY 33 2.253 17.922 -5.052
231 1HA GLY 33 2HA GLY 33 0.441 16.418 -6.594
232 2HA GLY 33 1HA GLY 33 2.081 16.814 -7.062
233 H PHE 34 H PHE 34 2.718 15.325 -4.387
234 HA PHE 34 HA PHE 34 3.439 12.839 -5.548
235 1HB PHE 34 2HB PHE 34 3.466 13.860 -2.706
236 2HB PHE 34 1HB PHE 34 4.117 12.298 -3.186
237 HD1 PHE 34 1HD PHE 34 6.386 12.443 -2.875
238 HD2 PHE 34 2HD PHE 34 4.371 15.611 -4.861
239 HE1 PHE 34 1HE PHE 34 8.544 13.489 -3.400
240 HE2 PHE 34 2HE PHE 34 6.509 16.662 -5.389
241 HZ PHE 34 HZ PHE 34 8.609 15.600 -4.659
242 H ALA 35 H ALA 35 2.718 10.762 -5.013
243 HA ALA 35 HA ALA 35 0.376 10.410 -3.327
244 1HB ALA 35 1HB ALA 35 -0.574 10.937 -5.548
245 2HB ALA 35 2HB ALA 35 -0.920 9.276 -5.066
246 3HB ALA 35 3HB ALA 35 0.348 9.605 -6.249
247 H TRP 36 H TRP 36 -0.093 8.008 -3.045
248 HA TRP 36 HA TRP 36 2.453 6.683 -2.704
249 1HB TRP 36 2HB TRP 36 -0.329 5.691 -2.016
250 2HB TRP 36 1HB TRP 36 1.175 4.845 -1.659
251 HD1 TRP 36 HD TRP 36 -1.043 7.636 -0.378
252 HE1 TRP 36 1HE TRP 36 -0.158 8.391 1.906
253 HE3 TRP 36 3HE TRP 36 3.395 5.125 -0.369
254 HZ2 TRP 36 2HZ TRP 36 2.106 7.959 3.524
255 HZ3 TRP 36 3HZ TRP 36 4.873 5.345 1.580
256 HH2 TRP 36 HH TRP 36 4.245 6.742 3.487
257 H TYR 37 H TYR 37 3.372 5.622 -4.264
258 HA TYR 37 HA TYR 37 1.750 3.646 -5.724
259 1HB TYR 37 2HB TYR 37 4.104 5.268 -6.692
260 2HB TYR 37 1HB TYR 37 3.603 3.775 -7.481
261 HD1 TYR 37 1HD TYR 37 2.881 7.269 -6.925
262 HD2 TYR 37 2HD TYR 37 1.428 3.657 -8.631
263 HE1 TYR 37 1HE TYR 37 1.242 8.556 -8.256
264 HE2 TYR 37 2HE TYR 37 -0.210 4.921 -9.960
265 HH TYR 37 HH TYR 37 -0.042 8.173 -10.481
266 H PHE 38 H PHE 38 3.453 1.816 -6.509
267 HA PHE 38 HA PHE 38 4.914 0.931 -4.236
268 1HB PHE 38 2HB PHE 38 4.384 -0.040 -6.928
269 2HB PHE 38 1HB PHE 38 6.024 -0.360 -6.392
270 HD1 PHE 38 1HD PHE 38 2.623 -1.414 -6.273
271 HD2 PHE 38 2HD PHE 38 6.304 -1.552 -4.133
272 HE1 PHE 38 1HE PHE 38 1.815 -3.364 -5.006
273 HE2 PHE 38 2HE PHE 38 5.500 -3.501 -2.868
274 HZ PHE 38 HZ PHE 38 3.253 -4.418 -3.301
275 H GLU 39 H GLU 39 6.383 1.329 -7.432
276 HA GLU 39 HA GLU 39 8.614 2.753 -6.157
277 1HB GLU 39 2HB GLU 39 8.469 1.376 -8.847
278 2HB GLU 39 1HB GLU 39 9.894 2.166 -8.184
279 1HG GLU 39 2HG GLU 39 8.505 -0.249 -7.048
280 2HG GLU 39 1HG GLU 39 10.039 -0.233 -7.917
281 H GLY 40 H GLY 40 5.837 3.431 -7.668
282 1HA GLY 40 2HA GLY 40 5.239 5.676 -8.242
283 2HA GLY 40 1HA GLY 40 6.897 5.941 -8.773
284 H GLY 41 H GLY 41 3.748 5.151 -9.718
285 1HA GLY 41 2HA GLY 41 2.871 4.872 -11.843
286 2HA GLY 41 1HA GLY 41 4.503 4.973 -12.491
287 H THR 42 H THR 42 4.685 2.760 -10.126
288 HA THR 42 HA THR 42 3.891 0.506 -11.834
289 HB THR 42 HB THR 42 5.873 -0.630 -10.523
290 HG1 THR 42 1HG THR 42 7.524 1.377 -10.856
291 1HG2 THR 42 1HG2 THR 42 7.331 -0.206 -12.468
292 2HG2 THR 42 2HG2 THR 42 6.253 1.092 -12.980
293 3HG2 THR 42 3HG2 THR 42 5.673 -0.573 -12.946
294 H LYS 43 H LYS 43 2.871 -1.118 -10.849
295 HA LYS 43 HA LYS 43 3.382 -1.584 -8.036
296 1HB LYS 43 2HB LYS 43 0.780 -2.181 -8.026
297 2HB LYS 43 1HB LYS 43 1.407 -0.635 -7.497
298 1HG LYS 43 2HG LYS 43 -0.409 -0.132 -8.875
299 2HG LYS 43 1HG LYS 43 1.015 0.167 -9.868
300 1HD LYS 43 2HD LYS 43 0.630 -2.313 -10.627
301 2HD LYS 43 1HD LYS 43 -1.015 -2.014 -10.062
302 1HE LYS 43 2HE LYS 43 0.492 -0.422 -12.134
303 2HE LYS 43 1HE LYS 43 -0.836 -1.540 -12.436
304 1HZ LYS 43 1HZ LYS 43 -2.362 -0.105 -11.443
305 2HZ LYS 43 2HZ LYS 43 -1.373 0.922 -12.362
306 3HZ LYS 43 3HZ LYS 43 -1.162 0.818 -10.688
307 H GLU 44 H GLU 44 3.812 -3.681 -7.697
308 HA GLU 44 HA GLU 44 2.548 -5.651 -9.470
309 1HB GLU 44 2HB GLU 44 4.625 -6.912 -9.654
310 2HB GLU 44 1HB GLU 44 4.829 -5.291 -10.295
311 1HG GLU 44 2HG GLU 44 5.660 -6.041 -7.509
312 2HG GLU 44 1HG GLU 44 6.723 -6.228 -8.902
313 H SER 45 H SER 45 2.281 -7.735 -8.594
314 HA SER 45 HA SER 45 2.498 -7.863 -5.651
315 1HB SER 45 2HB SER 45 0.239 -8.244 -6.729
316 2HB SER 45 1HB SER 45 0.908 -9.681 -7.498
317 HG SER 45 HG SER 45 0.807 -10.720 -5.662
318 HA PRO 46 HA PRO 46 5.812 -10.665 -6.483
319 1HB PRO 46 2HB PRO 46 6.569 -10.658 -3.796
320 2HB PRO 46 1HB PRO 46 7.024 -9.446 -4.995
321 1HG PRO 46 2HG PRO 46 5.383 -9.039 -2.732
322 2HG PRO 46 1HG PRO 46 5.625 -7.912 -4.078
323 1HD PRO 46 2HD PRO 46 3.424 -9.887 -3.628
324 2HD PRO 46 1HD PRO 46 3.338 -8.262 -4.338
325 H ASN 47 H ASN 47 6.616 -12.719 -5.896
326 HA ASN 47 HA ASN 47 6.631 -14.865 -5.170
327 1HB ASN 47 2HB ASN 47 4.395 -14.186 -3.250
328 2HB ASN 47 1HB ASN 47 5.482 -15.562 -3.175
329 1HD2 ASN 47 1HD2 ASN 47 4.987 -13.795 -1.081
330 2HD2 ASN 47 2HD2 ASN 47 6.457 -12.952 -0.715
331 H GLU 48 H GLU 48 4.451 -13.555 -7.033
332 HA GLU 48 HA GLU 48 2.933 -15.962 -7.520
333 1HB GLU 48 2HB GLU 48 1.871 -14.729 -5.543
334 2HB GLU 48 1HB GLU 48 1.380 -13.524 -6.729
335 1HG GLU 48 2HG GLU 48 -0.404 -15.103 -6.317
336 2HG GLU 48 1HG GLU 48 0.182 -15.254 -7.974
337 H SER 49 H SER 49 2.382 -16.150 -9.515
338 HA SER 49 HA SER 49 2.066 -13.743 -11.165
339 1HB SER 49 2HB SER 49 3.079 -15.092 -13.050
340 2HB SER 49 1HB SER 49 4.210 -14.657 -11.767
341 HG SER 49 HG SER 49 2.920 -17.161 -12.168
342 H MET 50 H MET 50 0.138 -15.368 -9.741
343 HA MET 50 HA MET 50 -1.477 -16.204 -11.993
344 1HB MET 50 2HB MET 50 -2.242 -18.250 -11.003
345 2HB MET 50 1HB MET 50 -0.499 -18.280 -11.152
346 1HG MET 50 2HG MET 50 -0.213 -17.940 -8.817
347 2HG MET 50 1HG MET 50 -1.924 -17.583 -8.592
348 1HE MET 50 1HE MET 50 -1.763 -20.877 -6.653
349 2HE MET 50 2HE MET 50 -2.227 -19.172 -6.666
350 3HE MET 50 3HE MET 50 -0.522 -19.623 -6.683
351 H PHE 51 H PHE 51 -1.244 -15.707 -8.559
352 HA PHE 51 HA PHE 51 -3.754 -14.212 -8.599
353 1HB PHE 51 2HB PHE 51 -2.075 -15.443 -6.446
354 2HB PHE 51 1HB PHE 51 -3.058 -14.026 -6.073
355 HD1 PHE 51 1HD PHE 51 -3.508 -17.226 -7.952
356 HD2 PHE 51 2HD PHE 51 -5.065 -14.509 -5.064
357 HE1 PHE 51 1HE PHE 51 -5.461 -18.688 -7.629
358 HE2 PHE 51 2HE PHE 51 -7.018 -15.969 -4.740
359 HZ PHE 51 HZ PHE 51 -7.250 -18.019 -6.015
360 H THR 52 H THR 52 -3.593 -11.963 -7.648
361 HA THR 52 HA THR 52 -1.068 -10.706 -8.088
362 HB THR 52 HB THR 52 -2.887 -9.955 -10.262
363 HG1 THR 52 1HG THR 52 -3.112 -12.181 -10.462
364 1HG2 THR 52 1HG2 THR 52 -0.663 -8.967 -9.972
365 2HG2 THR 52 2HG2 THR 52 -0.774 -9.841 -11.501
366 3HG2 THR 52 3HG2 THR 52 0.058 -10.572 -10.124
367 H VAL 53 H VAL 53 -1.500 -8.227 -8.598
368 HA VAL 53 HA VAL 53 -3.202 -7.462 -6.334
369 HB VAL 53 HB VAL 53 -0.856 -6.940 -6.061
370 1HG1 VAL 53 1HG1 VAL 53 -1.081 -5.366 -8.623
371 2HG1 VAL 53 2HG1 VAL 53 -0.210 -6.884 -8.410
372 3HG1 VAL 53 3HG1 VAL 53 0.336 -5.430 -7.571
373 1HG2 VAL 53 1HG2 VAL 53 -0.949 -4.514 -5.698
374 2HG2 VAL 53 2HG2 VAL 53 -2.415 -5.316 -5.132
375 3HG2 VAL 53 3HG2 VAL 53 -2.426 -4.434 -6.659
376 H GLU 54 H GLU 54 -4.774 -5.988 -6.481
377 HA GLU 54 HA GLU 54 -5.189 -4.525 -9.012
378 1HB GLU 54 2HB GLU 54 -7.512 -4.269 -8.341
379 2HB GLU 54 1HB GLU 54 -7.085 -5.975 -8.271
380 1HG GLU 54 2HG GLU 54 -6.911 -5.915 -5.901
381 2HG GLU 54 1HG GLU 54 -7.052 -4.160 -5.879
382 H ASN 55 H ASN 55 -5.737 -2.285 -8.826
383 HA ASN 55 HA ASN 55 -4.794 -1.085 -6.303
384 1HB ASN 55 2HB ASN 55 -3.476 0.526 -7.498
385 2HB ASN 55 1HB ASN 55 -3.030 -1.072 -8.084
386 1HD2 ASN 55 1HD2 ASN 55 -3.785 -1.738 -10.163
387 2HD2 ASN 55 2HD2 ASN 55 -4.234 -0.550 -11.351
388 H LYS 56 H LYS 56 -5.892 0.676 -5.569
389 HA LYS 56 HA LYS 56 -7.450 2.237 -7.423
390 1HB LYS 56 2HB LYS 56 -9.587 1.987 -6.492
391 2HB LYS 56 1HB LYS 56 -8.966 0.356 -6.631
392 1HG LYS 56 2HG LYS 56 -8.691 1.765 -4.025
393 2HG LYS 56 1HG LYS 56 -10.264 1.135 -4.507
394 1HD LYS 56 2HD LYS 56 -8.630 -0.981 -5.039
395 2HD LYS 56 1HD LYS 56 -7.853 -0.256 -3.626
396 1HE LYS 56 2HE LYS 56 -9.500 -1.952 -3.009
397 2HE LYS 56 1HE LYS 56 -9.871 -0.352 -2.381
398 1HZ LYS 56 1HZ LYS 56 -11.524 -0.059 -4.082
399 2HZ LYS 56 2HZ LYS 56 -11.818 -1.524 -3.282
400 3HZ LYS 56 3HZ LYS 56 -11.097 -1.529 -4.817
401 H TYR 57 H TYR 57 -6.887 4.226 -7.034
402 HA TYR 57 HA TYR 57 -6.168 4.990 -4.292
403 1HB TYR 57 2HB TYR 57 -5.366 6.529 -6.705
404 2HB TYR 57 1HB TYR 57 -4.605 6.499 -5.125
405 HD1 TYR 57 1HD TYR 57 -4.383 5.347 -8.444
406 HD2 TYR 57 2HD TYR 57 -3.576 4.157 -4.436
407 HE1 TYR 57 1HE TYR 57 -2.769 3.682 -9.265
408 HE2 TYR 57 2HE TYR 57 -1.967 2.497 -5.250
409 HH TYR 57 HH TYR 57 -1.417 1.269 -7.203
410 H PHE 58 H PHE 58 -7.882 5.912 -3.367
411 HA PHE 58 HA PHE 58 -9.447 7.832 -4.957
412 1HB PHE 58 2HB PHE 58 -10.275 5.972 -2.731
413 2HB PHE 58 1HB PHE 58 -11.270 7.338 -3.241
414 HD1 PHE 58 1HD PHE 58 -10.129 3.995 -4.045
415 HD2 PHE 58 2HD PHE 58 -12.232 7.394 -5.502
416 HE1 PHE 58 1HE PHE 58 -11.104 2.621 -5.839
417 HE2 PHE 58 2HE PHE 58 -13.210 6.026 -7.298
418 HZ PHE 58 HZ PHE 58 -12.647 3.635 -7.468
419 HA PRO 59 HA PRO 59 -7.644 10.754 -1.977
420 1HB PRO 59 2HB PRO 59 -9.018 12.542 -3.927
421 2HB PRO 59 1HB PRO 59 -7.375 12.634 -3.280
422 1HG PRO 59 2HG PRO 59 -7.735 11.811 -5.759
423 2HG PRO 59 1HG PRO 59 -6.586 10.953 -4.704
424 1HD PRO 59 2HD PRO 59 -9.416 10.206 -5.408
425 2HD PRO 59 1HD PRO 59 -7.954 9.192 -5.418
426 HA PRO 60 HA PRO 60 -10.997 11.735 0.599
427 1HB PRO 60 2HB PRO 60 -10.520 14.642 0.500
428 2HB PRO 60 1HB PRO 60 -10.464 13.532 1.872
429 1HG PRO 60 2HG PRO 60 -8.217 14.520 0.836
430 2HG PRO 60 1HG PRO 60 -8.309 12.854 1.423
431 1HD PRO 60 2HD PRO 60 -8.402 13.880 -1.390
432 2HD PRO 60 1HD PRO 60 -7.552 12.465 -0.732
433 H ASP 61 H ASP 61 -12.497 13.907 1.029
434 HA ASP 61 HA ASP 61 -14.120 14.968 -0.890
435 1HB ASP 61 2HB ASP 61 -14.356 12.501 -1.592
436 2HB ASP 61 1HB ASP 61 -15.178 12.245 -0.058
437 H SER 62 H SER 62 -16.575 13.832 0.584
438 HA SER 62 HA SER 62 -16.014 15.016 3.207
439 1HB SER 62 2HB SER 62 -18.610 14.927 3.353
440 2HB SER 62 1HB SER 62 -17.865 16.148 2.319
441 HG SER 62 HG SER 62 -18.439 15.051 0.551
442 H LYS 63 H LYS 63 -17.997 12.389 1.836
443 HA LYS 63 HA LYS 63 -17.717 10.917 4.332
444 1HB LYS 63 2HB LYS 63 -19.374 9.352 3.292
445 2HB LYS 63 1HB LYS 63 -19.946 10.999 3.495
446 1HG LYS 63 2HG LYS 63 -20.711 10.308 1.384
447 2HG LYS 63 1HG LYS 63 -19.345 11.372 1.065
448 1HD LYS 63 2HD LYS 63 -19.217 9.444 -0.386
449 2HD LYS 63 1HD LYS 63 -17.895 9.384 0.792
450 1HE LYS 63 2HE LYS 63 -18.979 7.190 0.447
451 2HE LYS 63 1HE LYS 63 -19.093 7.758 2.111
452 1HZ LYS 63 1HZ LYS 63 -21.262 8.029 0.097
453 2HZ LYS 63 2HZ LYS 63 -21.358 8.396 1.749
454 3HZ LYS 63 3HZ LYS 63 -21.172 6.786 1.250
455 H LEU 64 H LEU 64 -16.299 10.988 1.232
456 HA LEU 64 HA LEU 64 -15.670 8.274 0.841
457 1HB LEU 64 2HB LEU 64 -15.404 10.340 -0.732
458 2HB LEU 64 1HB LEU 64 -13.834 10.510 0.028
459 HG LEU 64 HG LEU 64 -13.771 9.344 -2.165
460 1HD1 LEU 64 1HD1 LEU 64 -12.343 7.485 -1.474
461 2HD1 LEU 64 2HD1 LEU 64 -12.926 7.658 0.183
462 3HD1 LEU 64 3HD1 LEU 64 -11.992 8.954 -0.563
463 1HD2 LEU 64 1HD2 LEU 64 -15.290 7.181 -0.718
464 2HD2 LEU 64 2HD2 LEU 64 -14.596 7.056 -2.333
465 3HD2 LEU 64 3HD2 LEU 64 -15.909 8.191 -2.024
466 H LEU 65 H LEU 65 -13.759 10.908 2.233
467 HA LEU 65 HA LEU 65 -12.852 9.215 4.325
468 1HB LEU 65 2HB LEU 65 -11.316 8.844 2.232
469 2HB LEU 65 1HB LEU 65 -10.644 10.396 2.680
470 HG LEU 65 HG LEU 65 -9.265 8.561 3.504
471 1HD1 LEU 65 1HD1 LEU 65 -10.667 9.989 5.756
472 2HD1 LEU 65 2HD1 LEU 65 -9.316 10.616 4.810
473 3HD1 LEU 65 3HD1 LEU 65 -9.091 9.204 5.842
474 1HD2 LEU 65 1HD2 LEU 65 -10.063 7.015 5.190
475 2HD2 LEU 65 2HD2 LEU 65 -11.034 6.880 3.724
476 3HD2 LEU 65 3HD2 LEU 65 -11.669 7.739 5.128
477 H GLY 66 H GLY 66 -11.845 12.099 2.607
478 1HA GLY 66 2HA GLY 66 -12.254 14.323 3.186
479 2HA GLY 66 1HA GLY 66 -12.857 13.776 4.741
480 H ALA 67 H ALA 67 -10.992 12.594 6.018
481 HA ALA 67 HA ALA 67 -9.271 14.602 6.892
482 1HB ALA 67 1HB ALA 67 -9.984 12.694 8.258
483 2HB ALA 67 2HB ALA 67 -8.232 12.889 8.265
484 3HB ALA 67 3HB ALA 67 -8.976 11.628 7.280
485 H GLY 68 H GLY 68 -8.429 11.663 5.052
486 1HA GLY 68 2HA GLY 68 -6.068 13.099 4.051
487 2HA GLY 68 1HA GLY 68 -5.898 11.488 4.726
488 H GLY 69 H GLY 69 -7.865 10.039 3.649
489 1HA GLY 69 2HA GLY 69 -8.906 9.998 1.296
490 2HA GLY 69 1HA GLY 69 -7.236 10.211 0.781
491 H THR 70 H THR 70 -7.644 8.108 -0.347
492 HA THR 70 HA THR 70 -6.891 5.882 1.312
493 HB THR 70 HB THR 70 -8.977 4.644 0.126
494 HG1 THR 70 1HG THR 70 -9.566 7.148 -0.223
495 1HG2 THR 70 1HG2 THR 70 -9.044 6.052 2.800
496 2HG2 THR 70 2HG2 THR 70 -8.290 4.491 2.480
497 3HG2 THR 70 3HG2 THR 70 -10.039 4.673 2.326
498 H GLU 71 H GLU 71 -5.123 5.700 -0.019
499 HA GLU 71 HA GLU 71 -5.627 4.829 -2.786
500 1HB GLU 71 2HB GLU 71 -3.008 5.581 -1.457
501 2HB GLU 71 1HB GLU 71 -3.227 5.179 -3.155
502 1HG GLU 71 2HG GLU 71 -4.742 7.142 -3.356
503 2HG GLU 71 1HG GLU 71 -4.311 7.577 -1.702
504 H HIS 72 H HIS 72 -5.850 2.672 -2.957
505 HA HIS 72 HA HIS 72 -4.644 1.024 -0.824
506 1HB HIS 72 2HB HIS 72 -6.912 0.238 -2.612
507 2HB HIS 72 1HB HIS 72 -6.341 -0.607 -1.198
508 HD1 HIS 72 1HD HIS 72 -8.197 -0.551 0.385
509 HD2 HIS 72 2HD HIS 72 -7.619 3.144 -1.418
510 HE1 HIS 72 1HE HIS 72 -10.033 0.906 1.230
511 HE2 HIS 72 2HE HIS 72 -9.809 3.060 -0.039
512 H PHE 73 H PHE 73 -3.528 -0.731 -1.264
513 HA PHE 73 HA PHE 73 -3.205 -1.618 -4.052
514 1HB PHE 73 2HB PHE 73 -1.285 -1.544 -1.724
515 2HB PHE 73 1HB PHE 73 -0.987 -2.550 -3.135
516 HD1 PHE 73 1HD PHE 73 0.143 -1.647 -4.949
517 HD2 PHE 73 2HD PHE 73 -1.729 0.963 -2.157
518 HE1 PHE 73 1HE PHE 73 1.162 0.286 -6.083
519 HE2 PHE 73 2HE PHE 73 -0.701 2.901 -3.276
520 HZ PHE 73 HZ PHE 73 0.742 2.563 -5.244
521 H HIS 74 H HIS 74 -4.524 -3.361 -4.226
522 HA HIS 74 HA HIS 74 -4.806 -5.123 -1.875
523 1HB HIS 74 2HB HIS 74 -6.577 -4.613 -4.265
524 2HB HIS 74 1HB HIS 74 -6.804 -6.008 -3.226
525 HD1 HIS 74 1HD HIS 74 -9.176 -5.078 -2.715
526 HD2 HIS 74 2HD HIS 74 -6.048 -2.673 -1.381
527 HE1 HIS 74 1HE HIS 74 -10.204 -3.437 -1.122
528 HE2 HIS 74 2HE HIS 74 -8.216 -2.356 -0.020
529 H VAL 75 H VAL 75 -3.386 -6.777 -1.999
530 HA VAL 75 HA VAL 75 -2.977 -7.931 -4.659
531 HB VAL 75 HB VAL 75 -0.933 -8.900 -3.935
532 1HG1 VAL 75 1HG1 VAL 75 0.373 -7.005 -3.078
533 2HG1 VAL 75 2HG1 VAL 75 -1.130 -6.156 -2.712
534 3HG1 VAL 75 3HG1 VAL 75 -0.721 -6.544 -4.382
535 1HG2 VAL 75 1HG2 VAL 75 -1.592 -9.786 -1.802
536 2HG2 VAL 75 2HG2 VAL 75 -1.701 -8.159 -1.122
537 3HG2 VAL 75 3HG2 VAL 75 -0.129 -8.815 -1.599
538 H THR 76 H THR 76 -4.103 -9.630 -5.120
539 HA THR 76 HA THR 76 -5.206 -11.253 -2.937
540 HB THR 76 HB THR 76 -5.940 -11.463 -5.870
541 HG1 THR 76 1HG THR 76 -6.447 -9.402 -4.172
542 1HG2 THR 76 1HG2 THR 76 -6.672 -13.287 -4.416
543 2HG2 THR 76 2HG2 THR 76 -8.053 -12.340 -4.968
544 3HG2 THR 76 3HG2 THR 76 -7.438 -12.127 -3.330
545 H VAL 77 H VAL 77 -3.787 -12.796 -2.447
546 HA VAL 77 HA VAL 77 -2.566 -14.432 -4.523
547 HB VAL 77 HB VAL 77 -0.973 -12.625 -4.414
548 1HG1 VAL 77 1HG1 VAL 77 0.085 -11.907 -2.329
549 2HG1 VAL 77 2HG1 VAL 77 -0.947 -13.012 -1.423
550 3HG1 VAL 77 3HG1 VAL 77 -1.659 -11.649 -2.285
551 1HG2 VAL 77 1HG2 VAL 77 0.005 -14.856 -4.524
552 2HG2 VAL 77 2HG2 VAL 77 0.042 -14.938 -2.762
553 3HG2 VAL 77 3HG2 VAL 77 1.044 -13.760 -3.613
554 H LYS 78 H LYS 78 -1.928 -16.439 -3.789
555 HA LYS 78 HA LYS 78 -1.739 -16.830 -0.907
556 1HB LYS 78 2HB LYS 78 -2.777 -19.242 -1.626
557 2HB LYS 78 1HB LYS 78 -3.687 -17.936 -0.891
558 1HG LYS 78 2HG LYS 78 -5.005 -18.639 -2.676
559 2HG LYS 78 1HG LYS 78 -4.213 -17.181 -3.267
560 1HD LYS 78 2HD LYS 78 -4.262 -18.981 -4.943
561 2HD LYS 78 1HD LYS 78 -2.617 -18.509 -4.517
562 1HE LYS 78 2HE LYS 78 -2.794 -20.928 -4.667
563 2HE LYS 78 1HE LYS 78 -2.473 -20.444 -3.003
564 1HZ LYS 78 1HZ LYS 78 -5.153 -21.137 -4.085
565 2HZ LYS 78 2HZ LYS 78 -4.787 -20.773 -2.470
566 3HZ LYS 78 3HZ LYS 78 -4.171 -22.181 -3.181
567 H ALA 79 H ALA 79 0.356 -17.174 -0.737
568 HA ALA 79 HA ALA 79 1.567 -19.477 -1.899
569 1HB ALA 79 1HB ALA 79 2.563 -16.777 -2.810
570 2HB ALA 79 2HB ALA 79 1.710 -17.947 -3.817
571 3HB ALA 79 3HB ALA 79 3.307 -18.334 -3.174
572 H ALA 80 H ALA 80 3.302 -20.119 -0.719
573 HA ALA 80 HA ALA 80 3.642 -18.891 1.825
574 1HB ALA 80 1HB ALA 80 5.220 -20.708 2.259
575 2HB ALA 80 2HB ALA 80 5.164 -21.161 0.556
576 3HB ALA 80 3HB ALA 80 3.718 -21.306 1.554
577 H GLY 81 H GLY 81 4.351 -16.798 1.089
578 1HA GLY 81 2HA GLY 81 7.270 -16.654 1.034
579 2HA GLY 81 1HA GLY 81 6.408 -15.897 -0.303
580 H THR 82 H THR 82 7.986 -14.337 1.307
581 HA THR 82 HA THR 82 6.086 -13.118 3.183
582 HB THR 82 HB THR 82 8.936 -12.204 2.904
583 HG1 THR 82 1HG THR 82 9.647 -13.897 4.112
584 1HG2 THR 82 1HG2 THR 82 7.443 -10.946 4.355
585 2HG2 THR 82 2HG2 THR 82 8.630 -11.812 5.332
586 3HG2 THR 82 3HG2 THR 82 6.978 -12.425 5.197
587 H HIS 83 H HIS 83 5.268 -11.140 2.849
588 HA HIS 83 HA HIS 83 5.753 -9.969 0.197
589 1HB HIS 83 2HB HIS 83 3.396 -10.809 0.987
590 2HB HIS 83 1HB HIS 83 3.399 -9.366 1.986
591 HD1 HIS 83 1HD HIS 83 4.325 -7.175 0.244
592 HD2 HIS 83 2HD HIS 83 1.861 -10.212 -1.172
593 HE1 HIS 83 1HE HIS 83 3.134 -6.190 -1.740
594 HE2 HIS 83 2HE HIS 83 1.573 -8.019 -2.523
595 H ALA 84 H ALA 84 7.287 -8.441 0.446
596 HA ALA 84 HA ALA 84 7.101 -6.632 2.758
597 1HB ALA 84 1HB ALA 84 9.394 -5.969 2.191
598 2HB ALA 84 2HB ALA 84 9.364 -7.049 0.798
599 3HB ALA 84 3HB ALA 84 9.276 -7.713 2.428
600 H VAL 85 H VAL 85 5.970 -4.847 2.374
601 HA VAL 85 HA VAL 85 5.662 -4.043 -0.443
602 HB VAL 85 HB VAL 85 3.862 -3.016 1.687
603 1HG1 VAL 85 1HG1 VAL 85 2.238 -3.067 -0.128
604 2HG1 VAL 85 2HG1 VAL 85 3.449 -3.803 -1.181
605 3HG1 VAL 85 3HG1 VAL 85 3.692 -2.166 -0.569
606 1HG2 VAL 85 1HG2 VAL 85 3.989 -5.409 2.161
607 2HG2 VAL 85 2HG2 VAL 85 3.595 -5.761 0.477
608 3HG2 VAL 85 3HG2 VAL 85 2.410 -4.962 1.511
609 H ASN 86 H ASN 86 7.063 -2.510 -0.904
610 HA ASN 86 HA ASN 86 7.313 -0.216 0.938
611 1HB ASN 86 2HB ASN 86 9.139 -1.222 -1.261
612 2HB ASN 86 1HB ASN 86 9.372 0.305 -0.415
613 1HD2 ASN 86 1HD2 ASN 86 8.885 -3.131 0.246
614 2HD2 ASN 86 2HD2 ASN 86 10.037 -3.227 1.539
615 H LEU 87 H LEU 87 5.824 1.184 0.398
616 HA LEU 87 HA LEU 87 5.275 1.667 -2.444
617 1HB LEU 87 2HB LEU 87 3.622 2.272 0.013
618 2HB LEU 87 1HB LEU 87 3.171 2.706 -1.627
619 HG LEU 87 HG LEU 87 3.602 -0.149 -0.728
620 1HD1 LEU 87 1HD1 LEU 87 1.023 1.380 -1.040
621 2HD1 LEU 87 2HD1 LEU 87 1.734 0.872 0.491
622 3HD1 LEU 87 3HD1 LEU 87 1.180 -0.337 -0.669
623 1HD2 LEU 87 1HD2 LEU 87 3.881 0.235 -3.104
624 2HD2 LEU 87 2HD2 LEU 87 2.312 1.042 -3.170
625 3HD2 LEU 87 3HD2 LEU 87 2.407 -0.676 -2.776
626 H THR 88 H THR 88 5.899 3.523 -3.310
627 HA THR 88 HA THR 88 7.200 5.453 -1.531
628 HB THR 88 HB THR 88 7.575 5.236 -4.516
629 HG1 THR 88 1HG THR 88 8.157 3.231 -3.822
630 1HG2 THR 88 1HG2 THR 88 9.365 6.247 -2.295
631 2HG2 THR 88 2HG2 THR 88 8.442 7.257 -3.407
632 3HG2 THR 88 3HG2 THR 88 9.750 6.243 -4.016
633 H TYR 89 H TYR 89 6.261 7.300 -1.197
634 HA TYR 89 HA TYR 89 4.001 8.175 -2.803
635 1HB TYR 89 2HB TYR 89 3.980 8.131 -0.281
636 2HB TYR 89 1HB TYR 89 5.197 9.399 -0.298
637 HD1 TYR 89 1HD TYR 89 1.683 8.600 -0.893
638 HD2 TYR 89 2HD TYR 89 4.604 11.675 -0.870
639 HE1 TYR 89 1HE TYR 89 -0.105 10.282 -0.962
640 HE2 TYR 89 2HE TYR 89 2.825 13.365 -0.939
641 HH TYR 89 HH TYR 89 0.201 13.202 -1.934
642 H MET 90 H MET 90 4.738 9.091 -4.682
643 HA MET 90 HA MET 90 6.546 11.417 -4.430
644 1HB MET 90 2HB MET 90 6.746 9.575 -6.788
645 2HB MET 90 1HB MET 90 7.880 10.802 -6.256
646 1HG MET 90 2HG MET 90 8.641 9.437 -4.476
647 2HG MET 90 1HG MET 90 7.350 8.262 -4.759
648 1HE MET 90 1HE MET 90 8.375 7.208 -8.494
649 2HE MET 90 2HE MET 90 7.432 8.632 -8.045
650 3HE MET 90 3HE MET 90 7.106 7.076 -7.278
651 H ARG 91 H ARG 91 6.388 12.903 -6.262
652 HA ARG 91 HA ARG 91 3.842 13.137 -7.483
653 1HB ARG 91 2HB ARG 91 6.091 14.760 -7.344
654 2HB ARG 91 1HB ARG 91 6.067 14.252 -9.030
655 1HG ARG 91 2HG ARG 91 3.857 15.110 -9.337
656 2HG ARG 91 1HG ARG 91 3.721 15.489 -7.619
657 1HD ARG 91 2HD ARG 91 5.544 17.104 -7.835
658 2HD ARG 91 1HD ARG 91 5.677 16.721 -9.553
659 HE ARG 91 HE ARG 91 3.033 17.515 -8.854
660 1HH1 ARG 91 1HH1 ARG 91 6.232 18.773 -9.503
661 2HH1 ARG 91 2HH1 ARG 91 5.648 20.310 -10.067
662 1HH2 ARG 91 1HH2 ARG 91 2.258 19.493 -9.607
663 2HH2 ARG 91 2HH2 ARG 91 3.376 20.717 -10.149
664 HA PRO 92 HA PRO 92 4.179 9.362 -9.749
665 1HB PRO 92 2HB PRO 92 2.342 10.223 -11.745
666 2HB PRO 92 1HB PRO 92 2.009 9.222 -10.332
667 1HG PRO 92 2HG PRO 92 1.654 12.149 -10.713
668 2HG PRO 92 1HG PRO 92 0.723 11.019 -9.709
669 1HD PRO 92 2HD PRO 92 2.419 12.752 -8.620
670 2HD PRO 92 1HD PRO 92 2.285 11.097 -7.984
671 H TRP 93 H TRP 93 4.489 12.432 -11.529
672 HA TRP 93 HA TRP 93 5.720 10.947 -13.739
673 1HB TRP 93 2HB TRP 93 5.410 13.035 -15.049
674 2HB TRP 93 1HB TRP 93 3.903 12.369 -14.428
675 HD1 TRP 93 HD TRP 93 6.220 15.376 -14.076
676 HE1 TRP 93 1HE TRP 93 5.008 17.214 -12.741
677 HE3 TRP 93 3HE TRP 93 2.100 12.725 -12.637
678 HZ2 TRP 93 2HZ TRP 93 2.608 17.491 -11.280
679 HZ3 TRP 93 3HZ TRP 93 0.397 13.845 -11.272
680 HH2 TRP 93 HH TRP 93 0.643 16.183 -10.608
681 H THR 94 H THR 94 6.911 12.203 -11.028
682 HA THR 94 HA THR 94 9.506 12.488 -12.126
683 HB THR 94 HB THR 94 8.671 14.684 -12.815
684 HG1 THR 94 1HG THR 94 10.407 15.445 -10.779
685 1HG2 THR 94 1HG2 THR 94 7.006 15.107 -11.104
686 2HG2 THR 94 2HG2 THR 94 8.177 16.425 -11.147
687 3HG2 THR 94 3HG2 THR 94 8.264 15.210 -9.872
688 H GLY 95 H GLY 95 7.632 13.659 -9.309
689 1HA GLY 95 2HA GLY 95 7.920 13.341 -7.050
690 2HA GLY 95 1HA GLY 95 8.660 11.808 -7.502
691 HA PRO 96 HA PRO 96 11.977 15.748 -6.985
692 1HB PRO 96 2HB PRO 96 10.151 16.058 -4.612
693 2HB PRO 96 1HB PRO 96 11.309 17.215 -5.263
694 1HG PRO 96 2HG PRO 96 8.748 17.367 -5.931
695 2HG PRO 96 1HG PRO 96 10.013 17.676 -7.134
696 1HD PRO 96 2HD PRO 96 8.142 15.419 -6.935
697 2HD PRO 96 1HD PRO 96 9.129 15.943 -8.316
698 H SER 97 H SER 97 13.656 14.553 -6.448
699 HA SER 97 HA SER 97 13.483 12.265 -4.753
700 1HB SER 97 2HB SER 97 15.914 13.604 -5.963
701 2HB SER 97 1HB SER 97 15.864 11.984 -5.269
702 HG SER 97 HG SER 97 14.198 11.530 -6.889
703 H HIS 98 H HIS 98 12.665 13.667 -2.959
704 HA HIS 98 HA HIS 98 14.435 13.773 -0.829
705 1HB HIS 98 2HB HIS 98 15.460 15.686 -2.044
706 2HB HIS 98 1HB HIS 98 13.911 16.520 -2.005
707 HD1 HIS 98 1HD HIS 98 16.711 15.407 0.264
708 HD2 HIS 98 2HD HIS 98 13.356 17.861 0.334
709 HE1 HIS 98 1HE HIS 98 16.880 16.729 2.395
710 HE2 HIS 98 2HE HIS 98 14.947 18.344 2.312
711 H ASP 99 H ASP 99 11.564 14.935 -2.430
712 HA ASP 99 HA ASP 99 10.212 15.521 0.073
713 1HB ASP 99 2HB ASP 99 10.006 16.332 -2.676
714 2HB ASP 99 1HB ASP 99 8.488 15.618 -2.170
715 H SER 100 H SER 100 10.883 12.893 -1.791
716 HA SER 100 HA SER 100 8.402 11.576 -1.981
717 1HB SER 100 2HB SER 100 10.030 9.551 -2.298
718 2HB SER 100 1HB SER 100 9.980 10.834 -3.508
719 HG SER 100 HG SER 100 12.002 10.107 -1.798
720 H GLU 101 H GLU 101 7.256 10.705 -0.472
721 HA GLU 101 HA GLU 101 8.404 9.769 2.043
722 1HB GLU 101 2HB GLU 101 6.330 11.060 2.133
723 2HB GLU 101 1HB GLU 101 5.563 9.967 0.993
724 1HG GLU 101 2HG GLU 101 4.716 9.494 3.155
725 2HG GLU 101 1HG GLU 101 5.768 8.161 2.684
726 H ARG 102 H ARG 102 7.749 7.464 2.738
727 HA ARG 102 HA ARG 102 6.864 5.704 0.643
728 1HB ARG 102 2HB ARG 102 9.379 6.035 0.267
729 2HB ARG 102 1HB ARG 102 9.614 5.145 1.763
730 1HG ARG 102 2HG ARG 102 8.528 3.194 0.813
731 2HG ARG 102 1HG ARG 102 8.185 4.085 -0.672
732 1HD ARG 102 2HD ARG 102 10.718 4.451 -0.808
733 2HD ARG 102 1HD ARG 102 10.837 3.183 0.408
734 HE ARG 102 HE ARG 102 9.349 2.567 -2.045
735 1HH1 ARG 102 1HH1 ARG 102 12.285 2.205 -0.141
736 2HH1 ARG 102 2HH1 ARG 102 12.911 0.916 -1.127
737 1HH2 ARG 102 1HH2 ARG 102 10.193 0.879 -3.354
738 2HH2 ARG 102 2HH2 ARG 102 11.722 0.161 -2.933
739 H PHE 103 H PHE 103 5.976 3.946 1.365
740 HA PHE 103 HA PHE 103 5.850 3.537 4.268
741 1HB PHE 103 2HB PHE 103 3.659 3.830 3.658
742 2HB PHE 103 1HB PHE 103 3.940 3.313 2.001
743 HD1 PHE 103 1HD PHE 103 2.954 2.322 5.331
744 HD2 PHE 103 2HD PHE 103 3.938 0.936 1.436
745 HE1 PHE 103 1HE PHE 103 1.949 0.146 5.851
746 HE2 PHE 103 2HE PHE 103 2.936 -1.243 1.950
747 HZ PHE 103 HZ PHE 103 1.941 -1.636 4.160
748 H THR 104 H THR 104 5.849 1.299 5.043
749 HA THR 104 HA THR 104 6.684 -0.741 3.185
750 HB THR 104 HB THR 104 8.564 0.146 5.386
751 HG1 THR 104 1HG THR 104 9.467 -0.007 2.771
752 1HG2 THR 104 1HG2 THR 104 8.544 -2.264 5.170
753 2HG2 THR 104 2HG2 THR 104 10.054 -1.610 4.535
754 3HG2 THR 104 3HG2 THR 104 8.783 -2.130 3.428
755 H VAL 105 H VAL 105 4.984 -2.064 3.886
756 HA VAL 105 HA VAL 105 5.234 -2.896 6.693
757 HB VAL 105 HB VAL 105 2.920 -2.359 5.904
758 1HG1 VAL 105 1HG1 VAL 105 3.288 -4.820 4.201
759 2HG1 VAL 105 2HG1 VAL 105 3.100 -3.167 3.615
760 3HG1 VAL 105 3HG1 VAL 105 1.770 -3.961 4.459
761 1HG2 VAL 105 1HG2 VAL 105 3.376 -5.230 6.702
762 2HG2 VAL 105 2HG2 VAL 105 1.883 -4.313 6.907
763 3HG2 VAL 105 3HG2 VAL 105 3.330 -3.851 7.798
764 H TYR 106 H TYR 106 5.991 -4.819 7.218
765 HA TYR 106 HA TYR 106 6.734 -6.667 5.062
766 1HB TYR 106 2HB TYR 106 7.622 -6.546 7.947
767 2HB TYR 106 1HB TYR 106 8.132 -7.753 6.786
768 HD1 TYR 106 1HD TYR 106 9.274 -6.765 4.606
769 HD2 TYR 106 2HD TYR 106 8.975 -4.730 8.330
770 HE1 TYR 106 1HE TYR 106 11.204 -5.368 3.994
771 HE2 TYR 106 2HE TYR 106 10.897 -3.324 7.725
772 HH TYR 106 HH TYR 106 12.079 -3.023 4.656
773 H LEU 107 H LEU 107 5.057 -7.967 4.709
774 HA LEU 107 HA LEU 107 3.785 -9.210 7.053
775 1HB LEU 107 2HB LEU 107 1.678 -9.128 5.969
776 2HB LEU 107 1HB LEU 107 2.377 -7.534 5.806
777 HG LEU 107 HG LEU 107 3.209 -8.659 3.485
778 1HD1 LEU 107 1HD1 LEU 107 1.302 -9.835 2.494
779 2HD1 LEU 107 2HD1 LEU 107 0.503 -9.848 4.066
780 3HD1 LEU 107 3HD1 LEU 107 2.013 -10.731 3.837
781 1HD2 LEU 107 1HD2 LEU 107 0.588 -7.265 3.979
782 2HD2 LEU 107 2HD2 LEU 107 1.405 -7.407 2.422
783 3HD2 LEU 107 3HD2 LEU 107 2.153 -6.491 3.731
784 H LYS 108 H LYS 108 3.365 -11.443 6.877
785 HA LYS 108 HA LYS 108 4.793 -12.725 4.649
786 1HB LYS 108 2HB LYS 108 5.630 -13.434 6.766
787 2HB LYS 108 1HB LYS 108 4.019 -13.721 7.376
788 1HG LYS 108 2HG LYS 108 3.753 -15.672 6.215
789 2HG LYS 108 1HG LYS 108 4.939 -15.222 4.988
790 1HD LYS 108 2HD LYS 108 5.825 -15.633 7.819
791 2HD LYS 108 1HD LYS 108 5.494 -17.043 6.814
792 1HE LYS 108 2HE LYS 108 7.342 -14.820 5.973
793 2HE LYS 108 1HE LYS 108 7.890 -16.247 6.852
794 1HZ LYS 108 1HZ LYS 108 7.198 -17.648 5.074
795 2HZ LYS 108 2HZ LYS 108 8.127 -16.402 4.393
796 3HZ LYS 108 3HZ LYS 108 6.436 -16.371 4.267
797 H ALA 109 H ALA 109 3.643 -13.542 3.061
798 HA ALA 109 HA ALA 109 0.785 -14.042 3.486
799 1HB ALA 109 1HB ALA 109 1.299 -12.430 1.734
800 2HB ALA 109 2HB ALA 109 0.610 -13.894 1.029
801 3HB ALA 109 3HB ALA 109 2.348 -13.605 0.940
802 H ASN 110 H ASN 110 -0.137 -16.032 2.644
803 HA ASN 110 HA ASN 110 1.449 -18.053 1.506
804 1HB ASN 110 2HB ASN 110 1.684 -19.610 3.411
805 2HB ASN 110 1HB ASN 110 2.602 -18.131 3.641
806 1HD2 ASN 110 1HD2 ASN 110 1.935 -16.638 5.198
807 2HD2 ASN 110 2HD2 ASN 110 0.852 -17.085 6.470
Start of MODEL 7
1 H HIS 3 H HIS 3 -6.228 -9.678 4.361
2 HA HIS 3 HA HIS 3 -4.995 -8.997 6.788
3 1HB HIS 3 2HB HIS 3 -3.113 -10.331 6.128
4 2HB HIS 3 1HB HIS 3 -3.189 -9.703 4.482
5 HD1 HIS 3 1HD HIS 3 -2.731 -8.112 7.918
6 HD2 HIS 3 2HD HIS 3 -1.137 -8.065 4.078
7 HE1 HIS 3 1HE HIS 3 -0.834 -6.475 8.001
8 HE2 HIS 3 2HE HIS 3 0.175 -6.525 5.693
9 H LYS 4 H LYS 4 -4.681 -6.789 6.897
10 HA LYS 4 HA LYS 4 -4.897 -5.253 4.425
11 1HB LYS 4 2HB LYS 4 -6.626 -3.789 5.491
12 2HB LYS 4 1HB LYS 4 -7.178 -5.417 5.111
13 1HG LYS 4 2HG LYS 4 -6.934 -6.069 7.435
14 2HG LYS 4 1HG LYS 4 -6.310 -4.470 7.837
15 1HD LYS 4 2HD LYS 4 -8.416 -3.451 7.271
16 2HD LYS 4 1HD LYS 4 -9.046 -4.994 6.686
17 1HE LYS 4 2HE LYS 4 -8.917 -5.928 8.915
18 2HE LYS 4 1HE LYS 4 -8.186 -4.444 9.523
19 1HZ LYS 4 1HZ LYS 4 -10.885 -4.555 8.295
20 2HZ LYS 4 2HZ LYS 4 -10.185 -3.258 9.144
21 3HZ LYS 4 3HZ LYS 4 -10.609 -4.681 9.964
22 H VAL 5 H VAL 5 -3.524 -3.579 4.409
23 HA VAL 5 HA VAL 5 -2.431 -2.770 7.015
24 HB VAL 5 HB VAL 5 -1.171 -2.882 4.310
25 1HG1 VAL 5 1HG1 VAL 5 -0.515 -0.817 6.387
26 2HG1 VAL 5 2HG1 VAL 5 -0.915 -0.555 4.690
27 3HG1 VAL 5 3HG1 VAL 5 0.611 -1.329 5.131
28 1HG2 VAL 5 1HG2 VAL 5 -0.094 -3.253 7.098
29 2HG2 VAL 5 2HG2 VAL 5 0.692 -3.700 5.585
30 3HG2 VAL 5 3HG2 VAL 5 -0.766 -4.545 6.104
31 H THR 6 H THR 6 -2.668 -0.821 7.778
32 HA THR 6 HA THR 6 -3.584 1.341 6.022
33 HB THR 6 HB THR 6 -4.315 2.372 8.303
34 HG1 THR 6 1HG THR 6 -5.021 -0.041 9.288
35 1HG2 THR 6 1HG2 THR 6 -5.800 0.064 7.038
36 2HG2 THR 6 2HG2 THR 6 -5.861 1.752 6.528
37 3HG2 THR 6 3HG2 THR 6 -6.515 1.281 8.098
38 H LYS 7 H LYS 7 -2.894 3.560 7.047
39 HA LYS 7 HA LYS 7 -0.308 3.955 6.388
40 1HB LYS 7 2HB LYS 7 -1.949 5.731 6.701
41 2HB LYS 7 1HB LYS 7 -1.830 5.546 8.442
42 1HG LYS 7 2HG LYS 7 -0.576 7.481 7.507
43 2HG LYS 7 1HG LYS 7 0.404 6.365 8.463
44 1HD LYS 7 2HD LYS 7 1.383 5.424 6.517
45 2HD LYS 7 1HD LYS 7 0.216 6.215 5.454
46 1HE LYS 7 2HE LYS 7 2.501 7.251 5.487
47 2HE LYS 7 1HE LYS 7 1.181 8.355 5.868
48 1HZ LYS 7 1HZ LYS 7 3.214 8.513 7.310
49 2HZ LYS 7 2HZ LYS 7 2.790 7.009 7.964
50 3HZ LYS 7 3HZ LYS 7 1.744 8.332 8.134
51 H ALA 8 H ALA 8 -1.329 3.170 9.729
52 HA ALA 8 HA ALA 8 1.036 3.733 11.072
53 1HB ALA 8 1HB ALA 8 -0.775 1.389 11.601
54 2HB ALA 8 2HB ALA 8 -1.067 3.041 12.150
55 3HB ALA 8 3HB ALA 8 0.333 2.147 12.746
56 H HIS 9 H HIS 9 0.228 0.963 9.092
57 HA HIS 9 HA HIS 9 2.345 -0.719 9.923
58 1HB HIS 9 2HB HIS 9 0.747 -0.723 7.375
59 2HB HIS 9 1HB HIS 9 1.889 -1.979 7.830
60 HD1 HIS 9 1HD HIS 9 -1.481 -0.621 8.636
61 HD2 HIS 9 2HD HIS 9 0.964 -3.778 9.767
62 HE1 HIS 9 1HE HIS 9 -3.002 -2.304 9.719
63 HE2 HIS 9 2HE HIS 9 -1.459 -4.077 10.630
64 H ASN 10 H ASN 10 2.461 2.139 8.275
65 HA ASN 10 HA ASN 10 4.464 2.038 6.423
66 1HB ASN 10 2HB ASN 10 3.396 4.132 7.113
67 2HB ASN 10 1HB ASN 10 4.109 3.996 8.718
68 1HD2 ASN 10 1HD2 ASN 10 5.831 3.347 5.726
69 2HD2 ASN 10 2HD2 ASN 10 6.893 4.703 5.828
70 H GLY 11 H GLY 11 4.604 1.104 9.724
71 1HA GLY 11 2HA GLY 11 7.404 0.302 9.334
72 2HA GLY 11 1HA GLY 11 7.000 1.211 10.787
73 H ALA 12 H ALA 12 5.542 -1.522 8.993
74 HA ALA 12 HA ALA 12 5.068 -2.813 11.610
75 1HB ALA 12 1HB ALA 12 3.005 -2.302 10.617
76 2HB ALA 12 2HB ALA 12 3.243 -4.032 10.351
77 3HB ALA 12 3HB ALA 12 3.531 -2.883 9.040
78 H THR 13 H THR 13 5.101 -5.102 11.732
79 HA THR 13 HA THR 13 6.169 -6.660 9.528
80 HB THR 13 HB THR 13 7.593 -6.667 12.208
81 HG1 THR 13 1HG THR 13 7.917 -5.079 10.031
82 1HG2 THR 13 1HG2 THR 13 7.598 -8.837 11.086
83 2HG2 THR 13 2HG2 THR 13 9.208 -8.119 11.063
84 3HG2 THR 13 3HG2 THR 13 8.209 -8.084 9.611
85 H LEU 14 H LEU 14 4.700 -8.281 9.427
86 HA LEU 14 HA LEU 14 3.943 -9.765 11.780
87 1HB LEU 14 2HB LEU 14 1.606 -9.266 11.793
88 2HB LEU 14 1HB LEU 14 2.487 -7.759 11.923
89 HG LEU 14 HG LEU 14 1.308 -8.767 9.332
90 1HD1 LEU 14 1HD1 LEU 14 -0.483 -8.413 10.928
91 2HD1 LEU 14 2HD1 LEU 14 -0.481 -7.137 9.712
92 3HD1 LEU 14 3HD1 LEU 14 0.161 -6.820 11.324
93 1HD2 LEU 14 1HD2 LEU 14 3.154 -7.146 9.156
94 2HD2 LEU 14 2HD2 LEU 14 2.238 -6.025 10.162
95 3HD2 LEU 14 3HD2 LEU 14 1.620 -6.495 8.578
96 H THR 15 H THR 15 2.304 -11.488 11.233
97 HA THR 15 HA THR 15 2.817 -12.448 8.513
98 HB THR 15 HB THR 15 1.963 -13.983 10.976
99 HG1 THR 15 1HG THR 15 4.150 -14.921 10.547
100 1HG2 THR 15 1HG2 THR 15 2.246 -15.981 9.635
101 2HG2 THR 15 2HG2 THR 15 2.723 -15.013 8.240
102 3HG2 THR 15 3HG2 THR 15 1.072 -14.913 8.858
103 H VAL 16 H VAL 16 1.127 -13.332 7.271
104 HA VAL 16 HA VAL 16 -1.579 -12.519 8.108
105 HB VAL 16 HB VAL 16 -2.040 -11.605 6.002
106 1HG1 VAL 16 1HG1 VAL 16 -0.586 -10.171 7.290
107 2HG1 VAL 16 2HG1 VAL 16 -0.216 -10.009 5.573
108 3HG1 VAL 16 3HG1 VAL 16 0.836 -10.966 6.617
109 1HG2 VAL 16 1HG2 VAL 16 0.478 -12.840 4.933
110 2HG2 VAL 16 2HG2 VAL 16 -0.670 -11.854 4.025
111 3HG2 VAL 16 3HG2 VAL 16 -1.158 -13.433 4.646
112 H ALA 17 H ALA 17 -3.307 -13.813 7.154
113 HA ALA 17 HA ALA 17 -2.407 -16.430 6.146
114 1HB ALA 17 1HB ALA 17 -4.617 -17.240 6.914
115 2HB ALA 17 2HB ALA 17 -4.935 -15.632 7.573
116 3HB ALA 17 3HB ALA 17 -3.618 -16.606 8.223
117 H VAL 18 H VAL 18 -2.499 -16.371 3.973
118 HA VAL 18 HA VAL 18 -4.336 -14.526 2.693
119 HB VAL 18 HB VAL 18 -3.239 -15.084 0.599
120 1HG1 VAL 18 1HG1 VAL 18 -0.914 -14.367 1.241
121 2HG1 VAL 18 2HG1 VAL 18 -1.441 -14.461 2.928
122 3HG1 VAL 18 3HG1 VAL 18 -2.228 -13.339 1.820
123 1HG2 VAL 18 1HG2 VAL 18 -1.340 -16.616 0.521
124 2HG2 VAL 18 2HG2 VAL 18 -2.817 -17.456 0.999
125 3HG2 VAL 18 3HG2 VAL 18 -1.605 -17.040 2.211
126 H GLY 19 H GLY 19 -5.247 -15.370 0.502
127 1HA GLY 19 2HA GLY 19 -6.226 -17.502 -0.449
128 2HA GLY 19 1HA GLY 19 -6.857 -17.760 1.174
129 H GLU 20 H GLU 20 -7.413 -14.966 1.638
130 HA GLU 20 HA GLU 20 -9.862 -14.710 0.053
131 1HB GLU 20 2HB GLU 20 -8.975 -13.244 2.552
132 2HB GLU 20 1HB GLU 20 -10.532 -13.062 1.760
133 1HG GLU 20 2HG GLU 20 -9.575 -15.692 2.831
134 2HG GLU 20 1HG GLU 20 -10.449 -14.523 3.819
135 H LEU 21 H LEU 21 -7.769 -12.291 1.558
136 HA LEU 21 HA LEU 21 -6.844 -11.167 -0.881
137 1HB LEU 21 2HB LEU 21 -9.092 -10.313 -1.060
138 2HB LEU 21 1HB LEU 21 -9.057 -9.748 0.602
139 HG LEU 21 HG LEU 21 -7.336 -8.094 -0.002
140 1HD1 LEU 21 1HD1 LEU 21 -6.330 -9.334 -1.864
141 2HD1 LEU 21 2HD1 LEU 21 -6.772 -7.688 -2.320
142 3HD1 LEU 21 3HD1 LEU 21 -7.782 -9.046 -2.826
143 1HD2 LEU 21 1HD2 LEU 21 -9.798 -7.979 -1.735
144 2HD2 LEU 21 2HD2 LEU 21 -8.779 -6.612 -1.291
145 3HD2 LEU 21 3HD2 LEU 21 -9.694 -7.467 -0.051
146 H VAL 22 H VAL 22 -4.901 -10.354 -0.409
147 HA VAL 22 HA VAL 22 -4.516 -9.302 2.308
148 HB VAL 22 HB VAL 22 -2.727 -10.905 0.541
149 1HG1 VAL 22 1HG1 VAL 22 -1.474 -8.781 0.645
150 2HG1 VAL 22 2HG1 VAL 22 -0.692 -10.035 1.608
151 3HG1 VAL 22 3HG1 VAL 22 -1.636 -8.775 2.398
152 1HG2 VAL 22 1HG2 VAL 22 -3.035 -10.551 3.509
153 2HG2 VAL 22 2HG2 VAL 22 -2.016 -11.753 2.715
154 3HG2 VAL 22 3HG2 VAL 22 -3.768 -11.812 2.521
155 H GLU 23 H GLU 23 -4.778 -7.185 2.334
156 HA GLU 23 HA GLU 23 -3.911 -5.711 -0.064
157 1HB GLU 23 2HB GLU 23 -5.630 -4.134 0.249
158 2HB GLU 23 1HB GLU 23 -6.371 -5.720 0.391
159 1HG GLU 23 2HG GLU 23 -6.641 -5.517 2.703
160 2HG GLU 23 1HG GLU 23 -5.503 -4.175 2.800
161 H ILE 24 H ILE 24 -3.256 -3.570 0.178
162 HA ILE 24 HA ILE 24 -2.160 -2.796 2.799
163 HB ILE 24 HB ILE 24 -0.746 -2.531 0.142
164 1HG1 ILE 24 2HG1 ILE 24 -0.729 -4.860 0.860
165 2HG1 ILE 24 1HG1 ILE 24 0.880 -4.160 1.021
166 1HG2 ILE 24 1HG2 ILE 24 -0.242 -0.713 1.653
167 2HG2 ILE 24 2HG2 ILE 24 1.161 -1.765 1.470
168 3HG2 ILE 24 3HG2 ILE 24 0.171 -1.862 2.927
169 1HD1 ILE 24 1HD1 ILE 24 -1.095 -4.550 3.253
170 2HD1 ILE 24 2HD1 ILE 24 0.532 -3.885 3.404
171 3HD1 ILE 24 3HD1 ILE 24 0.308 -5.565 2.915
172 H GLN 25 H GLN 25 -3.471 -1.034 3.199
173 HA GLN 25 HA GLN 25 -4.054 0.730 0.924
174 1HB GLN 25 2HB GLN 25 -6.055 -0.076 1.836
175 2HB GLN 25 1HB GLN 25 -5.495 0.199 3.491
176 1HG GLN 25 2HG GLN 25 -5.534 2.619 1.920
177 2HG GLN 25 1HG GLN 25 -7.112 1.848 1.975
178 1HE2 GLN 25 1HE2 GLN 25 -4.566 3.274 3.916
179 2HE2 GLN 25 2HE2 GLN 25 -5.530 3.549 5.323
180 H LEU 26 H LEU 26 -3.548 2.833 0.960
181 HA LEU 26 HA LEU 26 -2.561 3.891 3.482
182 1HB LEU 26 2HB LEU 26 -1.425 4.200 0.753
183 2HB LEU 26 1HB LEU 26 -1.149 5.431 1.979
184 HG LEU 26 HG LEU 26 -0.678 2.673 2.830
185 1HD1 LEU 26 1HD1 LEU 26 1.520 2.561 1.763
186 2HD1 LEU 26 2HD1 LEU 26 1.150 4.037 0.869
187 3HD1 LEU 26 3HD1 LEU 26 0.211 2.569 0.579
188 1HD2 LEU 26 1HD2 LEU 26 -0.284 4.529 4.302
189 2HD2 LEU 26 2HD2 LEU 26 0.835 5.247 3.140
190 3HD2 LEU 26 3HD2 LEU 26 1.237 3.720 3.929
191 HA PRO 27 HA PRO 27 -5.726 6.838 2.893
192 1HB PRO 27 2HB PRO 27 -5.183 8.510 4.853
193 2HB PRO 27 1HB PRO 27 -5.526 6.815 5.225
194 1HG PRO 27 2HG PRO 27 -2.834 8.152 4.949
195 2HG PRO 27 1HG PRO 27 -3.421 7.107 6.256
196 1HD PRO 27 2HD PRO 27 -1.898 6.219 4.191
197 2HD PRO 27 1HD PRO 27 -3.074 5.196 5.039
198 H SER 28 H SER 28 -2.925 7.250 1.549
199 HA SER 28 HA SER 28 -1.864 8.753 0.274
200 1HB SER 28 2HB SER 28 -4.238 9.218 -0.559
201 2HB SER 28 1HB SER 28 -4.233 10.599 0.542
202 HG SER 28 HG SER 28 -2.411 10.119 -1.588
203 H ASN 29 H ASN 29 -3.617 10.610 2.695
204 HA ASN 29 HA ASN 29 -3.027 12.340 4.058
205 1HB ASN 29 2HB ASN 29 -0.146 11.560 3.983
206 2HB ASN 29 1HB ASN 29 -1.096 12.155 5.329
207 1HD2 ASN 29 1HD2 ASN 29 0.130 9.434 3.732
208 2HD2 ASN 29 2HD2 ASN 29 -0.574 8.221 4.756
209 HA PRO 30 HA PRO 30 -1.922 14.331 0.118
210 1HB PRO 30 2HB PRO 30 -3.450 16.572 1.319
211 2HB PRO 30 1HB PRO 30 -3.653 15.777 -0.248
212 1HG PRO 30 2HG PRO 30 -5.393 15.306 1.689
213 2HG PRO 30 1HG PRO 30 -4.803 13.974 0.671
214 1HD PRO 30 2HD PRO 30 -3.944 14.736 3.435
215 2HD PRO 30 1HD PRO 30 -4.341 13.133 2.781
216 H THR 31 H THR 31 0.255 14.632 0.465
217 HA THR 31 HA THR 31 1.161 16.852 2.075
218 HB THR 31 HB THR 31 3.360 16.168 1.572
219 HG1 THR 31 1HG THR 31 3.953 15.330 -0.312
220 1HG2 THR 31 1HG2 THR 31 2.050 14.455 2.839
221 2HG2 THR 31 2HG2 THR 31 3.416 13.787 1.944
222 3HG2 THR 31 3HG2 THR 31 1.773 13.601 1.314
223 H THR 32 H THR 32 0.885 16.008 -1.331
224 HA THR 32 HA THR 32 0.126 18.445 -2.328
225 HB THR 32 HB THR 32 2.254 19.371 -1.596
226 HG1 THR 32 1HG THR 32 2.848 20.312 -3.507
227 1HG2 THR 32 1HG2 THR 32 4.395 18.600 -2.487
228 2HG2 THR 32 2HG2 THR 32 3.572 17.269 -3.301
229 3HG2 THR 32 3HG2 THR 32 3.592 17.346 -1.540
230 H GLY 33 H GLY 33 2.109 18.064 -4.715
231 1HA GLY 33 2HA GLY 33 0.503 16.504 -6.361
232 2HA GLY 33 1HA GLY 33 2.189 16.858 -6.672
233 H PHE 34 H PHE 34 3.045 15.437 -4.229
234 HA PHE 34 HA PHE 34 3.591 12.891 -5.193
235 1HB PHE 34 2HB PHE 34 3.446 13.879 -2.336
236 2HB PHE 34 1HB PHE 34 4.194 12.369 -2.838
237 HD1 PHE 34 1HD PHE 34 4.389 16.033 -3.332
238 HD2 PHE 34 2HD PHE 34 6.449 12.331 -3.437
239 HE1 PHE 34 1HE PHE 34 6.503 17.231 -3.667
240 HE2 PHE 34 2HE PHE 34 8.574 13.516 -3.777
241 HZ PHE 34 HZ PHE 34 8.625 15.925 -3.907
242 H ALA 35 H ALA 35 2.736 10.858 -4.811
243 HA ALA 35 HA ALA 35 0.372 10.499 -3.150
244 1HB ALA 35 1HB ALA 35 0.344 9.810 -6.103
245 2HB ALA 35 2HB ALA 35 -0.549 11.140 -5.355
246 3HB ALA 35 3HB ALA 35 -0.940 9.471 -4.941
247 H TRP 36 H TRP 36 -0.110 8.101 -2.874
248 HA TRP 36 HA TRP 36 2.439 6.765 -2.631
249 1HB TRP 36 2HB TRP 36 -0.303 5.704 -1.902
250 2HB TRP 36 1HB TRP 36 1.237 4.920 -1.569
251 HD1 TRP 36 HD TRP 36 -1.043 7.660 -0.263
252 HE1 TRP 36 1HE TRP 36 -0.174 8.394 2.035
253 HE3 TRP 36 3HE TRP 36 3.437 5.230 -0.290
254 HZ2 TRP 36 2HZ TRP 36 2.092 7.984 3.645
255 HZ3 TRP 36 3HZ TRP 36 4.913 5.444 1.658
256 HH2 TRP 36 HH TRP 36 4.258 6.806 3.590
257 H TYR 37 H TYR 37 3.324 5.661 -4.160
258 HA TYR 37 HA TYR 37 1.663 3.731 -5.647
259 1HB TYR 37 2HB TYR 37 4.096 5.267 -6.598
260 2HB TYR 37 1HB TYR 37 3.473 3.843 -7.421
261 HD1 TYR 37 1HD TYR 37 2.930 7.347 -6.652
262 HD2 TYR 37 2HD TYR 37 1.391 3.938 -8.665
263 HE1 TYR 37 1HE TYR 37 1.376 8.801 -7.918
264 HE2 TYR 37 2HE TYR 37 -0.159 5.365 -9.937
265 HH TYR 37 HH TYR 37 0.073 8.809 -9.937
266 H PHE 38 H PHE 38 3.315 1.865 -6.425
267 HA PHE 38 HA PHE 38 4.915 1.027 -4.233
268 1HB PHE 38 2HB PHE 38 4.279 0.042 -6.899
269 2HB PHE 38 1HB PHE 38 5.946 -0.240 -6.425
270 HD1 PHE 38 1HD PHE 38 2.516 -1.251 -6.022
271 HD2 PHE 38 2HD PHE 38 6.405 -1.513 -4.315
272 HE1 PHE 38 1HE PHE 38 1.807 -3.204 -4.701
273 HE2 PHE 38 2HE PHE 38 5.702 -3.464 -2.997
274 HZ PHE 38 HZ PHE 38 3.342 -4.292 -3.197
275 H GLU 39 H GLU 39 6.108 1.525 -7.530
276 HA GLU 39 HA GLU 39 8.225 3.223 -6.415
277 1HB GLU 39 2HB GLU 39 9.754 2.273 -8.150
278 2HB GLU 39 1HB GLU 39 9.258 1.135 -6.910
279 1HG GLU 39 2HG GLU 39 8.741 -0.257 -8.540
280 2HG GLU 39 1HG GLU 39 7.387 0.806 -8.921
281 H GLY 40 H GLY 40 5.567 3.231 -8.349
282 1HA GLY 40 2HA GLY 40 5.227 5.672 -8.982
283 2HA GLY 40 1HA GLY 40 6.701 5.478 -9.914
284 H GLY 41 H GLY 41 3.300 5.120 -9.874
285 1HA GLY 41 2HA GLY 41 1.786 4.415 -11.458
286 2HA GLY 41 1HA GLY 41 3.068 4.657 -12.636
287 H THR 42 H THR 42 3.548 2.490 -10.018
288 HA THR 42 HA THR 42 3.137 0.147 -11.722
289 HB THR 42 HB THR 42 5.387 -0.605 -10.527
290 HG1 THR 42 1HG THR 42 6.780 1.452 -10.866
291 1HG2 THR 42 1HG2 THR 42 5.249 1.024 -13.065
292 2HG2 THR 42 2HG2 THR 42 5.024 -0.720 -12.911
293 3HG2 THR 42 3HG2 THR 42 6.603 -0.003 -12.592
294 H LYS 43 H LYS 43 2.435 -1.603 -10.613
295 HA LYS 43 HA LYS 43 3.353 -1.851 -7.872
296 1HB LYS 43 2HB LYS 43 1.296 -2.458 -6.946
297 2HB LYS 43 1HB LYS 43 1.004 -0.974 -7.827
298 1HG LYS 43 2HG LYS 43 0.341 -3.737 -8.855
299 2HG LYS 43 1HG LYS 43 -0.800 -2.685 -8.025
300 1HD LYS 43 2HD LYS 43 -1.305 -1.729 -9.970
301 2HD LYS 43 1HD LYS 43 0.364 -1.185 -10.126
302 1HE LYS 43 2HE LYS 43 -0.351 -2.470 -12.078
303 2HE LYS 43 1HE LYS 43 0.962 -3.272 -11.220
304 1HZ LYS 43 1HZ LYS 43 -0.639 -4.767 -10.216
305 2HZ LYS 43 2HZ LYS 43 -0.768 -4.824 -11.901
306 3HZ LYS 43 3HZ LYS 43 -1.919 -3.972 -10.992
307 H GLU 44 H GLU 44 3.931 -3.864 -7.334
308 HA GLU 44 HA GLU 44 3.121 -6.066 -9.078
309 1HB GLU 44 2HB GLU 44 5.459 -6.975 -8.861
310 2HB GLU 44 1HB GLU 44 5.314 -5.527 -9.849
311 1HG GLU 44 2HG GLU 44 5.994 -4.209 -7.814
312 2HG GLU 44 1HG GLU 44 6.377 -5.751 -7.048
313 H SER 45 H SER 45 2.839 -8.032 -8.065
314 HA SER 45 HA SER 45 3.020 -7.971 -5.118
315 1HB SER 45 2HB SER 45 1.559 -10.116 -5.413
316 2HB SER 45 1HB SER 45 0.814 -8.535 -5.621
317 HG SER 45 HG SER 45 1.811 -9.351 -7.976
318 HA PRO 46 HA PRO 46 6.614 -10.412 -5.700
319 1HB PRO 46 2HB PRO 46 6.641 -10.927 -2.845
320 2HB PRO 46 1HB PRO 46 7.655 -9.823 -3.779
321 1HG PRO 46 2HG PRO 46 5.786 -8.963 -2.005
322 2HG PRO 46 1HG PRO 46 6.242 -8.041 -3.449
323 1HD PRO 46 2HD PRO 46 3.874 -9.842 -3.031
324 2HD PRO 46 1HD PRO 46 3.931 -8.230 -3.782
325 H ASN 47 H ASN 47 4.178 -11.877 -6.097
326 HA ASN 47 HA ASN 47 5.148 -14.512 -5.849
327 1HB ASN 47 2HB ASN 47 4.162 -13.763 -3.460
328 2HB ASN 47 1HB ASN 47 2.666 -14.274 -4.234
329 1HD2 ASN 47 1HD2 ASN 47 4.036 -15.454 -1.978
330 2HD2 ASN 47 2HD2 ASN 47 4.389 -17.084 -2.420
331 H GLU 48 H GLU 48 4.063 -12.738 -7.841
332 HA GLU 48 HA GLU 48 1.356 -13.726 -8.281
333 1HB GLU 48 2HB GLU 48 1.199 -11.957 -10.012
334 2HB GLU 48 1HB GLU 48 1.557 -11.339 -8.404
335 1HG GLU 48 2HG GLU 48 3.875 -11.025 -9.007
336 2HG GLU 48 1HG GLU 48 3.581 -11.725 -10.598
337 H SER 49 H SER 49 1.256 -15.583 -9.279
338 HA SER 49 HA SER 49 2.412 -15.788 -11.952
339 1HB SER 49 2HB SER 49 2.670 -17.988 -9.887
340 2HB SER 49 1HB SER 49 3.231 -18.054 -11.558
341 HG SER 49 HG SER 49 4.297 -15.892 -10.552
342 H MET 50 H MET 50 -0.227 -15.560 -10.372
343 HA MET 50 HA MET 50 -1.972 -17.037 -11.963
344 1HB MET 50 2HB MET 50 -2.762 -18.731 -10.332
345 2HB MET 50 1HB MET 50 -1.140 -19.030 -10.936
346 1HG MET 50 2HG MET 50 -0.186 -18.171 -8.879
347 2HG MET 50 1HG MET 50 -1.794 -17.764 -8.280
348 1HE MET 50 1HE MET 50 -1.078 -19.097 -6.045
349 2HE MET 50 2HE MET 50 0.461 -19.566 -6.766
350 3HE MET 50 3HE MET 50 -0.581 -20.790 -6.040
351 H PHE 51 H PHE 51 -1.189 -15.579 -8.958
352 HA PHE 51 HA PHE 51 -3.816 -14.280 -8.855
353 1HB PHE 51 2HB PHE 51 -2.170 -15.575 -6.731
354 2HB PHE 51 1HB PHE 51 -3.045 -14.112 -6.289
355 HD1 PHE 51 1HD PHE 51 -3.680 -17.300 -8.143
356 HD2 PHE 51 2HD PHE 51 -5.138 -14.403 -5.383
357 HE1 PHE 51 1HE PHE 51 -5.718 -18.638 -7.818
358 HE2 PHE 51 2HE PHE 51 -7.176 -15.739 -5.053
359 HZ PHE 51 HZ PHE 51 -7.505 -17.812 -6.317
360 H THR 52 H THR 52 -3.576 -12.004 -7.755
361 HA THR 52 HA THR 52 -1.086 -10.762 -8.571
362 HB THR 52 HB THR 52 -2.175 -11.252 -10.727
363 HG1 THR 52 1HG THR 52 -0.985 -9.472 -10.976
364 1HG2 THR 52 1HG2 THR 52 -4.505 -11.179 -10.029
365 2HG2 THR 52 2HG2 THR 52 -4.228 -10.054 -11.360
366 3HG2 THR 52 3HG2 THR 52 -4.372 -9.449 -9.710
367 H VAL 53 H VAL 53 -1.249 -8.336 -8.575
368 HA VAL 53 HA VAL 53 -2.957 -7.472 -6.336
369 HB VAL 53 HB VAL 53 -0.595 -7.391 -5.780
370 1HG1 VAL 53 1HG1 VAL 53 0.293 -7.228 -8.052
371 2HG1 VAL 53 2HG1 VAL 53 0.983 -5.996 -6.994
372 3HG1 VAL 53 3HG1 VAL 53 -0.273 -5.560 -8.153
373 1HG2 VAL 53 1HG2 VAL 53 -2.023 -5.626 -4.867
374 2HG2 VAL 53 2HG2 VAL 53 -1.670 -4.611 -6.265
375 3HG2 VAL 53 3HG2 VAL 53 -0.384 -5.043 -5.141
376 H GLU 54 H GLU 54 -4.272 -5.784 -6.548
377 HA GLU 54 HA GLU 54 -4.117 -4.150 -9.000
378 1HB GLU 54 2HB GLU 54 -6.567 -3.761 -8.658
379 2HB GLU 54 1HB GLU 54 -6.161 -5.438 -9.004
380 1HG GLU 54 2HG GLU 54 -6.342 -5.980 -6.636
381 2HG GLU 54 1HG GLU 54 -6.715 -4.297 -6.273
382 H ASN 55 H ASN 55 -4.017 -1.944 -8.739
383 HA ASN 55 HA ASN 55 -4.084 -1.017 -5.957
384 1HB ASN 55 2HB ASN 55 -2.865 1.008 -6.742
385 2HB ASN 55 1HB ASN 55 -1.959 -0.487 -6.878
386 1HD2 ASN 55 1HD2 ASN 55 -4.427 0.234 -9.241
387 2HD2 ASN 55 2HD2 ASN 55 -3.337 0.612 -10.538
388 H LYS 56 H LYS 56 -5.260 0.721 -5.333
389 HA LYS 56 HA LYS 56 -7.057 1.988 -7.232
390 1HB LYS 56 2HB LYS 56 -8.752 1.296 -5.114
391 2HB LYS 56 1HB LYS 56 -8.813 0.681 -6.762
392 1HG LYS 56 2HG LYS 56 -8.414 -1.347 -5.961
393 2HG LYS 56 1HG LYS 56 -6.820 -0.793 -5.449
394 1HD LYS 56 2HD LYS 56 -8.061 -1.809 -3.601
395 2HD LYS 56 1HD LYS 56 -7.724 -0.099 -3.306
396 1HE LYS 56 2HE LYS 56 -10.039 -0.867 -2.711
397 2HE LYS 56 1HE LYS 56 -9.939 0.517 -3.787
398 1HZ LYS 56 1HZ LYS 56 -10.507 -2.287 -4.600
399 2HZ LYS 56 2HZ LYS 56 -10.378 -0.976 -5.665
400 3HZ LYS 56 3HZ LYS 56 -11.632 -1.021 -4.527
401 H TYR 57 H TYR 57 -6.559 4.026 -6.791
402 HA TYR 57 HA TYR 57 -6.405 4.796 -3.958
403 1HB TYR 57 2HB TYR 57 -5.123 6.764 -5.489
404 2HB TYR 57 1HB TYR 57 -4.427 5.667 -4.315
405 HD1 TYR 57 1HD TYR 57 -4.948 6.316 -7.882
406 HD2 TYR 57 2HD TYR 57 -3.175 3.723 -5.017
407 HE1 TYR 57 1HE TYR 57 -3.560 5.320 -9.648
408 HE2 TYR 57 2HE TYR 57 -1.784 2.721 -6.777
409 HH TYR 57 HH TYR 57 -1.780 2.449 -9.205
410 H PHE 58 H PHE 58 -7.703 6.276 -3.226
411 HA PHE 58 HA PHE 58 -8.849 8.238 -5.099
412 1HB PHE 58 2HB PHE 58 -10.264 6.886 -2.779
413 2HB PHE 58 1HB PHE 58 -10.937 8.186 -3.763
414 HD1 PHE 58 1HD PHE 58 -10.177 4.632 -3.582
415 HD2 PHE 58 2HD PHE 58 -11.641 7.767 -6.059
416 HE1 PHE 58 1HE PHE 58 -11.128 2.966 -5.116
417 HE2 PHE 58 2HE PHE 58 -12.596 6.102 -7.602
418 HZ PHE 58 HZ PHE 58 -12.340 3.698 -7.126
419 HA PRO 59 HA PRO 59 -6.927 10.716 -1.724
420 1HB PRO 59 2HB PRO 59 -6.889 12.653 -3.982
421 2HB PRO 59 1HB PRO 59 -5.592 12.203 -2.866
422 1HG PRO 59 2HG PRO 59 -5.494 11.344 -5.346
423 2HG PRO 59 1HG PRO 59 -5.119 10.222 -4.029
424 1HD PRO 59 2HD PRO 59 -7.724 10.545 -5.518
425 2HD PRO 59 1HD PRO 59 -6.796 9.055 -5.218
426 HA PRO 60 HA PRO 60 -10.246 13.219 -0.342
427 1HB PRO 60 2HB PRO 60 -8.827 15.711 -1.227
428 2HB PRO 60 1HB PRO 60 -9.664 15.375 0.298
429 1HG PRO 60 2HG PRO 60 -7.062 15.215 0.281
430 2HG PRO 60 1HG PRO 60 -7.986 13.899 1.025
431 1HD PRO 60 2HD PRO 60 -6.678 13.976 -1.679
432 2HD PRO 60 1HD PRO 60 -6.694 12.667 -0.477
433 H ASP 61 H ASP 61 -9.054 14.825 -3.309
434 HA ASP 61 HA ASP 61 -10.122 15.620 -5.162
435 1HB ASP 61 2HB ASP 61 -10.888 13.287 -5.424
436 2HB ASP 61 1HB ASP 61 -12.254 13.613 -4.356
437 H SER 62 H SER 62 -13.127 14.876 -3.697
438 HA SER 62 HA SER 62 -13.557 17.276 -2.278
439 1HB SER 62 2HB SER 62 -15.004 16.936 -4.922
440 2HB SER 62 1HB SER 62 -15.472 18.089 -3.676
441 HG SER 62 HG SER 62 -12.824 18.243 -4.409
442 H LYS 63 H LYS 63 -14.944 14.567 -4.036
443 HA LYS 63 HA LYS 63 -16.760 14.063 -1.784
444 1HB LYS 63 2HB LYS 63 -18.335 14.025 -3.368
445 2HB LYS 63 1HB LYS 63 -17.136 14.090 -4.645
446 1HG LYS 63 2HG LYS 63 -17.895 11.526 -3.277
447 2HG LYS 63 1HG LYS 63 -18.753 12.151 -4.683
448 1HD LYS 63 2HD LYS 63 -15.790 11.534 -4.573
449 2HD LYS 63 1HD LYS 63 -17.029 10.476 -5.274
450 1HE LYS 63 2HE LYS 63 -16.390 13.276 -6.204
451 2HE LYS 63 1HE LYS 63 -15.843 11.794 -6.983
452 1HZ LYS 63 1HZ LYS 63 -17.726 12.552 -8.164
453 2HZ LYS 63 2HZ LYS 63 -18.628 12.791 -6.752
454 3HZ LYS 63 3HZ LYS 63 -18.249 11.217 -7.258
455 H LEU 64 H LEU 64 -14.149 12.757 -3.668
456 HA LEU 64 HA LEU 64 -14.560 10.021 -3.346
457 1HB LEU 64 2HB LEU 64 -12.000 11.580 -3.576
458 2HB LEU 64 1HB LEU 64 -12.057 9.828 -3.582
459 HG LEU 64 HG LEU 64 -13.291 11.666 -5.633
460 1HD1 LEU 64 1HD1 LEU 64 -10.872 11.479 -5.808
461 2HD1 LEU 64 2HD1 LEU 64 -11.663 10.641 -7.142
462 3HD1 LEU 64 3HD1 LEU 64 -10.996 9.718 -5.795
463 1HD2 LEU 64 1HD2 LEU 64 -13.306 8.652 -5.478
464 2HD2 LEU 64 2HD2 LEU 64 -13.868 9.612 -6.844
465 3HD2 LEU 64 3HD2 LEU 64 -14.705 9.712 -5.294
466 H LEU 65 H LEU 65 -12.448 12.115 -1.419
467 HA LEU 65 HA LEU 65 -13.041 10.380 0.860
468 1HB LEU 65 2HB LEU 65 -10.700 10.126 -0.196
469 2HB LEU 65 1HB LEU 65 -10.372 11.706 0.476
470 HG LEU 65 HG LEU 65 -9.451 9.893 1.841
471 1HD1 LEU 65 1HD1 LEU 65 -10.360 10.567 4.017
472 2HD1 LEU 65 2HD1 LEU 65 -11.653 11.433 3.182
473 3HD1 LEU 65 3HD1 LEU 65 -9.972 11.933 2.974
474 1HD2 LEU 65 1HD2 LEU 65 -12.304 9.075 2.312
475 2HD2 LEU 65 2HD2 LEU 65 -10.870 8.402 3.096
476 3HD2 LEU 65 3HD2 LEU 65 -11.113 8.183 1.361
477 H GLY 66 H GLY 66 -11.278 13.353 0.288
478 1HA GLY 66 2HA GLY 66 -12.334 15.514 0.654
479 2HA GLY 66 1HA GLY 66 -13.231 14.772 1.973
480 H ALA 67 H ALA 67 -11.274 13.407 3.285
481 HA ALA 67 HA ALA 67 -9.864 15.622 4.537
482 1HB ALA 67 1HB ALA 67 -11.123 14.142 5.968
483 2HB ALA 67 2HB ALA 67 -9.403 14.016 6.333
484 3HB ALA 67 3HB ALA 67 -10.200 12.757 5.390
485 H GLY 68 H GLY 68 -8.747 12.267 4.273
486 1HA GLY 68 2HA GLY 68 -6.123 13.355 3.530
487 2HA GLY 68 1HA GLY 68 -6.378 11.844 4.388
488 H GLY 69 H GLY 69 -7.947 10.342 2.956
489 1HA GLY 69 2HA GLY 69 -8.274 10.195 0.369
490 2HA GLY 69 1HA GLY 69 -6.519 10.112 0.416
491 H THR 70 H THR 70 -7.438 8.058 -0.735
492 HA THR 70 HA THR 70 -7.076 5.896 1.126
493 HB THR 70 HB THR 70 -9.230 4.892 -0.225
494 HG1 THR 70 1HG THR 70 -9.452 7.460 -0.567
495 1HG2 THR 70 1HG2 THR 70 -10.383 5.092 1.932
496 2HG2 THR 70 2HG2 THR 70 -9.192 6.291 2.450
497 3HG2 THR 70 3HG2 THR 70 -8.692 4.626 2.144
498 H GLU 71 H GLU 71 -5.206 5.739 -0.109
499 HA GLU 71 HA GLU 71 -5.527 4.722 -2.850
500 1HB GLU 71 2HB GLU 71 -2.956 5.515 -1.457
501 2HB GLU 71 1HB GLU 71 -3.211 5.277 -3.181
502 1HG GLU 71 2HG GLU 71 -4.802 7.234 -3.090
503 2HG GLU 71 1HG GLU 71 -4.204 7.533 -1.461
504 H HIS 72 H HIS 72 -5.856 2.512 -2.706
505 HA HIS 72 HA HIS 72 -4.197 1.148 -0.691
506 1HB HIS 72 2HB HIS 72 -6.491 -0.418 -1.630
507 2HB HIS 72 1HB HIS 72 -5.803 -0.234 -0.028
508 HD1 HIS 72 1HD HIS 72 -8.211 -0.268 0.888
509 HD2 HIS 72 2HD HIS 72 -7.327 3.013 -1.484
510 HE1 HIS 72 1HE HIS 72 -10.108 1.316 1.198
511 HE2 HIS 72 2HE HIS 72 -9.703 3.157 -0.459
512 H PHE 73 H PHE 73 -3.380 -0.816 -1.116
513 HA PHE 73 HA PHE 73 -3.134 -1.575 -3.946
514 1HB PHE 73 2HB PHE 73 -1.195 -1.470 -1.656
515 2HB PHE 73 1HB PHE 73 -0.877 -2.516 -3.044
516 HD1 PHE 73 1HD PHE 73 0.071 -1.629 -4.991
517 HD2 PHE 73 2HD PHE 73 -1.581 0.999 -2.078
518 HE1 PHE 73 1HE PHE 73 1.009 0.299 -6.198
519 HE2 PHE 73 2HE PHE 73 -0.644 2.929 -3.280
520 HZ PHE 73 HZ PHE 73 0.587 2.596 -5.368
521 H HIS 74 H HIS 74 -4.381 -3.324 -4.222
522 HA HIS 74 HA HIS 74 -4.752 -5.144 -1.937
523 1HB HIS 74 2HB HIS 74 -6.482 -4.444 -4.300
524 2HB HIS 74 1HB HIS 74 -6.784 -5.878 -3.336
525 HD1 HIS 74 1HD HIS 74 -9.088 -4.854 -2.714
526 HD2 HIS 74 2HD HIS 74 -5.828 -2.655 -1.359
527 HE1 HIS 74 1HE HIS 74 -9.994 -3.311 -0.965
528 HE2 HIS 74 2HE HIS 74 -7.937 -2.310 0.086
529 H VAL 75 H VAL 75 -3.285 -6.809 -2.140
530 HA VAL 75 HA VAL 75 -3.065 -7.982 -4.811
531 HB VAL 75 HB VAL 75 -0.860 -7.917 -4.442
532 1HG1 VAL 75 1HG1 VAL 75 -1.189 -7.815 -1.457
533 2HG1 VAL 75 2HG1 VAL 75 -1.178 -6.400 -2.513
534 3HG1 VAL 75 3HG1 VAL 75 0.255 -7.432 -2.408
535 1HG2 VAL 75 1HG2 VAL 75 -1.416 -10.109 -2.452
536 2HG2 VAL 75 2HG2 VAL 75 0.135 -9.782 -3.225
537 3HG2 VAL 75 3HG2 VAL 75 -1.243 -10.304 -4.197
538 H THR 76 H THR 76 -4.072 -9.709 -5.237
539 HA THR 76 HA THR 76 -5.227 -11.301 -3.057
540 HB THR 76 HB THR 76 -5.949 -11.439 -5.993
541 HG1 THR 76 1HG THR 76 -6.314 -9.356 -4.390
542 1HG2 THR 76 1HG2 THR 76 -8.087 -12.291 -5.124
543 2HG2 THR 76 2HG2 THR 76 -7.466 -12.153 -3.478
544 3HG2 THR 76 3HG2 THR 76 -6.727 -13.289 -4.608
545 H VAL 77 H VAL 77 -3.787 -12.854 -2.569
546 HA VAL 77 HA VAL 77 -2.913 -14.662 -4.683
547 HB VAL 77 HB VAL 77 -1.067 -13.077 -4.568
548 1HG1 VAL 77 1HG1 VAL 77 -1.468 -12.178 -2.342
549 2HG1 VAL 77 2HG1 VAL 77 0.203 -12.714 -2.505
550 3HG1 VAL 77 3HG1 VAL 77 -0.958 -13.703 -1.619
551 1HG2 VAL 77 1HG2 VAL 77 0.774 -14.588 -4.027
552 2HG2 VAL 77 2HG2 VAL 77 -0.499 -15.440 -4.899
553 3HG2 VAL 77 3HG2 VAL 77 -0.335 -15.647 -3.153
554 H LYS 78 H LYS 78 -2.613 -16.772 -3.970
555 HA LYS 78 HA LYS 78 -2.364 -17.143 -1.089
556 1HB LYS 78 2HB LYS 78 -3.832 -18.926 -0.953
557 2HB LYS 78 1HB LYS 78 -4.676 -17.810 -2.005
558 1HG LYS 78 2HG LYS 78 -3.094 -20.177 -2.980
559 2HG LYS 78 1HG LYS 78 -4.831 -20.194 -2.679
560 1HD LYS 78 2HD LYS 78 -5.240 -18.649 -4.421
561 2HD LYS 78 1HD LYS 78 -3.529 -18.243 -4.564
562 1HE LYS 78 2HE LYS 78 -4.364 -19.723 -6.375
563 2HE LYS 78 1HE LYS 78 -3.020 -20.400 -5.460
564 1HZ LYS 78 1HZ LYS 78 -4.461 -21.858 -4.322
565 2HZ LYS 78 2HZ LYS 78 -4.898 -21.953 -5.962
566 3HZ LYS 78 3HZ LYS 78 -5.852 -21.062 -4.883
567 H ALA 79 H ALA 79 -0.321 -17.600 -0.887
568 HA ALA 79 HA ALA 79 0.843 -19.941 -1.994
569 1HB ALA 79 1HB ALA 79 2.636 -18.848 -3.279
570 2HB ALA 79 2HB ALA 79 1.860 -17.287 -3.016
571 3HB ALA 79 3HB ALA 79 1.048 -18.522 -3.976
572 H ALA 80 H ALA 80 3.215 -20.072 -1.287
573 HA ALA 80 HA ALA 80 3.355 -18.878 1.385
574 1HB ALA 80 1HB ALA 80 4.969 -21.137 0.209
575 2HB ALA 80 2HB ALA 80 3.543 -21.316 1.231
576 3HB ALA 80 3HB ALA 80 5.013 -20.590 1.885
577 H GLY 81 H GLY 81 4.236 -16.916 1.245
578 1HA GLY 81 2HA GLY 81 7.049 -16.734 0.657
579 2HA GLY 81 1HA GLY 81 6.043 -15.856 -0.489
580 H THR 82 H THR 82 7.862 -14.482 1.069
581 HA THR 82 HA THR 82 6.149 -13.241 3.106
582 HB THR 82 HB THR 82 9.066 -12.608 2.688
583 HG1 THR 82 1HG THR 82 8.620 -14.943 3.056
584 1HG2 THR 82 1HG2 THR 82 7.803 -11.089 4.119
585 2HG2 THR 82 2HG2 THR 82 8.926 -12.043 5.089
586 3HG2 THR 82 3HG2 THR 82 7.208 -12.451 5.070
587 H HIS 83 H HIS 83 5.647 -11.074 3.021
588 HA HIS 83 HA HIS 83 5.921 -9.895 0.332
589 1HB HIS 83 2HB HIS 83 3.609 -10.740 1.241
590 2HB HIS 83 1HB HIS 83 3.677 -9.297 2.240
591 HD1 HIS 83 1HD HIS 83 4.583 -7.163 0.340
592 HD2 HIS 83 2HD HIS 83 1.875 -10.124 -0.731
593 HE1 HIS 83 1HE HIS 83 3.255 -6.199 -1.566
594 HE2 HIS 83 2HE HIS 83 1.508 -7.942 -2.068
595 H ALA 84 H ALA 84 7.509 -8.392 0.575
596 HA ALA 84 HA ALA 84 7.323 -6.532 2.848
597 1HB ALA 84 1HB ALA 84 9.545 -6.937 0.842
598 2HB ALA 84 2HB ALA 84 9.515 -7.553 2.494
599 3HB ALA 84 3HB ALA 84 9.582 -5.815 2.201
600 H VAL 85 H VAL 85 6.118 -4.793 2.468
601 HA VAL 85 HA VAL 85 5.761 -3.979 -0.343
602 HB VAL 85 HB VAL 85 3.981 -2.994 1.830
603 1HG1 VAL 85 1HG1 VAL 85 2.301 -3.079 0.063
604 2HG1 VAL 85 2HG1 VAL 85 3.504 -3.755 -1.038
605 3HG1 VAL 85 3HG1 VAL 85 3.705 -2.119 -0.407
606 1HG2 VAL 85 1HG2 VAL 85 3.730 -5.726 0.598
607 2HG2 VAL 85 2HG2 VAL 85 2.566 -4.960 1.679
608 3HG2 VAL 85 3HG2 VAL 85 4.172 -5.389 2.273
609 H ASN 86 H ASN 86 7.230 -2.458 -0.772
610 HA ASN 86 HA ASN 86 7.407 -0.129 1.030
611 1HB ASN 86 2HB ASN 86 9.251 -1.064 -1.189
612 2HB ASN 86 1HB ASN 86 9.412 0.484 -0.373
613 1HD2 ASN 86 1HD2 ASN 86 8.545 -2.569 1.159
614 2HD2 ASN 86 2HD2 ASN 86 9.980 -2.698 2.114
615 H LEU 87 H LEU 87 5.878 1.245 0.497
616 HA LEU 87 HA LEU 87 5.284 1.687 -2.345
617 1HB LEU 87 2HB LEU 87 3.625 2.240 0.117
618 2HB LEU 87 1HB LEU 87 3.159 2.670 -1.519
619 HG LEU 87 HG LEU 87 3.683 -0.174 -0.649
620 1HD1 LEU 87 1HD1 LEU 87 1.073 1.319 -0.887
621 2HD1 LEU 87 2HD1 LEU 87 1.793 0.703 0.603
622 3HD1 LEU 87 3HD1 LEU 87 1.239 -0.419 -0.642
623 1HD2 LEU 87 1HD2 LEU 87 2.385 1.026 -3.078
624 2HD2 LEU 87 2HD2 LEU 87 2.473 -0.697 -2.705
625 3HD2 LEU 87 3HD2 LEU 87 3.950 0.217 -3.009
626 H THR 88 H THR 88 5.775 3.587 -3.227
627 HA THR 88 HA THR 88 7.055 5.539 -1.454
628 HB THR 88 HB THR 88 7.438 5.363 -4.438
629 HG1 THR 88 1HG THR 88 8.118 3.384 -3.907
630 1HG2 THR 88 1HG2 THR 88 8.301 7.361 -3.301
631 2HG2 THR 88 2HG2 THR 88 9.626 6.346 -3.875
632 3HG2 THR 88 3HG2 THR 88 9.186 6.339 -2.167
633 H TYR 89 H TYR 89 6.019 7.303 -1.065
634 HA TYR 89 HA TYR 89 3.766 8.216 -2.629
635 1HB TYR 89 2HB TYR 89 3.876 8.223 -0.100
636 2HB TYR 89 1HB TYR 89 5.090 9.488 -0.214
637 HD1 TYR 89 1HD TYR 89 1.547 8.683 -0.852
638 HD2 TYR 89 2HD TYR 89 4.462 11.747 -0.574
639 HE1 TYR 89 1HE TYR 89 -0.228 10.375 -0.887
640 HE2 TYR 89 2HE TYR 89 2.692 13.450 -0.597
641 HH TYR 89 HH TYR 89 -0.362 12.912 0.088
642 H MET 90 H MET 90 4.618 8.901 -4.585
643 HA MET 90 HA MET 90 6.617 11.081 -4.503
644 1HB MET 90 2HB MET 90 6.218 9.121 -6.749
645 2HB MET 90 1HB MET 90 7.472 10.342 -6.618
646 1HG MET 90 2HG MET 90 8.411 9.152 -4.704
647 2HG MET 90 1HG MET 90 7.163 7.919 -4.892
648 1HE MET 90 1HE MET 90 8.030 6.900 -8.702
649 2HE MET 90 2HE MET 90 7.087 8.309 -8.213
650 3HE MET 90 3HE MET 90 6.810 6.748 -7.440
651 H ARG 91 H ARG 91 6.447 12.690 -6.117
652 HA ARG 91 HA ARG 91 3.874 13.279 -7.205
653 1HB ARG 91 2HB ARG 91 6.486 14.550 -7.080
654 2HB ARG 91 1HB ARG 91 5.854 14.601 -8.730
655 1HG ARG 91 2HG ARG 91 3.809 15.671 -7.936
656 2HG ARG 91 1HG ARG 91 4.416 15.602 -6.281
657 1HD ARG 91 2HD ARG 91 5.900 16.994 -8.494
658 2HD ARG 91 1HD ARG 91 4.690 17.810 -7.505
659 HE ARG 91 HE ARG 91 6.322 16.793 -5.648
660 1HH1 ARG 91 1HH1 ARG 91 7.024 18.603 -8.570
661 2HH1 ARG 91 2HH1 ARG 91 8.422 19.383 -7.883
662 1HH2 ARG 91 1HH2 ARG 91 8.153 17.851 -4.756
663 2HH2 ARG 91 2HH2 ARG 91 9.067 18.948 -5.749
664 HA PRO 92 HA PRO 92 4.306 9.800 -9.984
665 1HB PRO 92 2HB PRO 92 2.133 10.508 -11.598
666 2HB PRO 92 1HB PRO 92 2.076 9.491 -10.156
667 1HG PRO 92 2HG PRO 92 1.503 12.408 -10.448
668 2HG PRO 92 1HG PRO 92 0.675 11.194 -9.452
669 1HD PRO 92 2HD PRO 92 2.360 12.935 -8.353
670 2HD PRO 92 1HD PRO 92 2.339 11.238 -7.816
671 H TRP 93 H TRP 93 4.133 13.110 -11.195
672 HA TRP 93 HA TRP 93 5.076 12.238 -13.814
673 1HB TRP 93 2HB TRP 93 4.763 14.639 -14.457
674 2HB TRP 93 1HB TRP 93 3.297 13.839 -13.897
675 HD1 TRP 93 HD TRP 93 5.698 16.646 -13.017
676 HE1 TRP 93 1HE TRP 93 4.707 18.026 -11.082
677 HE3 TRP 93 3HE TRP 93 1.757 13.633 -11.820
678 HZ2 TRP 93 2HZ TRP 93 2.533 17.855 -9.292
679 HZ3 TRP 93 3HZ TRP 93 0.271 14.305 -9.983
680 HH2 TRP 93 HH TRP 93 0.649 16.372 -8.745
681 H THR 94 H THR 94 6.549 12.775 -11.005
682 HA THR 94 HA THR 94 9.096 13.031 -12.201
683 HB THR 94 HB THR 94 8.812 15.356 -12.383
684 HG1 THR 94 1HG THR 94 10.776 15.078 -11.457
685 1HG2 THR 94 1HG2 THR 94 7.708 15.407 -9.573
686 2HG2 THR 94 2HG2 THR 94 6.781 15.623 -11.059
687 3HG2 THR 94 3HG2 THR 94 7.995 16.817 -10.593
688 H GLY 95 H GLY 95 7.973 14.196 -9.034
689 1HA GLY 95 2HA GLY 95 8.127 13.291 -6.929
690 2HA GLY 95 1HA GLY 95 8.373 11.727 -7.702
691 HA PRO 96 HA PRO 96 12.753 14.061 -6.913
692 1HB PRO 96 2HB PRO 96 12.084 15.334 -4.527
693 2HB PRO 96 1HB PRO 96 12.693 16.085 -5.984
694 1HG PRO 96 2HG PRO 96 9.938 15.909 -4.950
695 2HG PRO 96 1HG PRO 96 10.646 17.076 -6.082
696 1HD PRO 96 2HD PRO 96 8.919 15.164 -6.872
697 2HD PRO 96 1HD PRO 96 10.243 15.733 -7.911
698 H SER 97 H SER 97 13.792 12.370 -6.130
699 HA SER 97 HA SER 97 12.541 10.293 -4.789
700 1HB SER 97 2HB SER 97 15.510 10.807 -4.784
701 2HB SER 97 1HB SER 97 14.688 9.250 -4.686
702 HG SER 97 HG SER 97 13.770 9.953 -6.850
703 H HIS 98 H HIS 98 14.537 12.901 -3.460
704 HA HIS 98 HA HIS 98 14.465 11.727 -0.813
705 1HB HIS 98 2HB HIS 98 16.480 12.889 -1.470
706 2HB HIS 98 1HB HIS 98 15.574 14.354 -1.826
707 HD1 HIS 98 1HD HIS 98 16.415 12.162 1.176
708 HD2 HIS 98 2HD HIS 98 15.436 16.101 0.251
709 HE1 HIS 98 1HE HIS 98 16.640 13.449 3.328
710 HE2 HIS 98 2HE HIS 98 16.163 15.850 2.722
711 H ASP 99 H ASP 99 12.474 13.820 -2.638
712 HA ASP 99 HA ASP 99 11.378 15.125 -0.255
713 1HB ASP 99 2HB ASP 99 11.894 16.365 -2.430
714 2HB ASP 99 1HB ASP 99 10.513 15.525 -3.123
715 H SER 100 H SER 100 11.008 12.357 -1.968
716 HA SER 100 HA SER 100 8.126 12.119 -1.705
717 1HB SER 100 2HB SER 100 10.181 10.140 -2.727
718 2HB SER 100 1HB SER 100 8.428 9.960 -2.830
719 HG SER 100 HG SER 100 10.013 11.973 -4.064
720 H GLU 101 H GLU 101 7.108 10.651 -0.360
721 HA GLU 101 HA GLU 101 8.720 9.719 1.917
722 1HB GLU 101 2HB GLU 101 6.719 11.148 2.357
723 2HB GLU 101 1HB GLU 101 5.707 9.914 1.620
724 1HG GLU 101 2HG GLU 101 6.329 8.343 3.370
725 2HG GLU 101 1HG GLU 101 7.380 9.555 4.100
726 H ARG 102 H ARG 102 8.079 7.459 2.763
727 HA ARG 102 HA ARG 102 6.946 5.759 0.699
728 1HB ARG 102 2HB ARG 102 9.551 5.981 0.491
729 2HB ARG 102 1HB ARG 102 9.579 4.918 1.890
730 1HG ARG 102 2HG ARG 102 8.357 3.216 0.646
731 2HG ARG 102 1HG ARG 102 8.270 4.285 -0.753
732 1HD ARG 102 2HD ARG 102 10.857 4.339 -0.552
733 2HD ARG 102 1HD ARG 102 10.643 2.878 0.409
734 HE ARG 102 HE ARG 102 9.353 2.895 -2.215
735 1HH1 ARG 102 1HH1 ARG 102 12.078 1.847 -0.246
736 2HH1 ARG 102 2HH1 ARG 102 12.686 0.762 -1.465
737 1HH2 ARG 102 1HH2 ARG 102 10.197 1.487 -3.806
738 2HH2 ARG 102 2HH2 ARG 102 11.616 0.550 -3.459
739 H PHE 103 H PHE 103 6.023 3.996 1.398
740 HA PHE 103 HA PHE 103 5.739 3.626 4.291
741 1HB PHE 103 2HB PHE 103 3.581 3.899 3.439
742 2HB PHE 103 1HB PHE 103 4.003 3.183 1.889
743 HD1 PHE 103 1HD PHE 103 2.866 2.580 5.280
744 HD2 PHE 103 2HD PHE 103 3.991 0.786 1.593
745 HE1 PHE 103 1HE PHE 103 1.859 0.462 5.999
746 HE2 PHE 103 2HE PHE 103 2.984 -1.330 2.308
747 HZ PHE 103 HZ PHE 103 1.918 -1.490 4.512
748 H THR 104 H THR 104 5.759 1.386 5.097
749 HA THR 104 HA THR 104 6.729 -0.655 3.317
750 HB THR 104 HB THR 104 8.501 0.347 5.562
751 HG1 THR 104 1HG THR 104 8.369 0.942 2.924
752 1HG2 THR 104 1HG2 THR 104 8.851 -1.983 3.677
753 2HG2 THR 104 2HG2 THR 104 8.570 -2.072 5.417
754 3HG2 THR 104 3HG2 THR 104 10.076 -1.390 4.799
755 H VAL 105 H VAL 105 5.011 -1.980 3.980
756 HA VAL 105 HA VAL 105 5.189 -2.806 6.795
757 HB VAL 105 HB VAL 105 2.899 -2.323 5.992
758 1HG1 VAL 105 1HG1 VAL 105 1.821 -3.870 4.421
759 2HG1 VAL 105 2HG1 VAL 105 3.377 -4.652 4.139
760 3HG1 VAL 105 3HG1 VAL 105 3.135 -2.969 3.667
761 1HG2 VAL 105 1HG2 VAL 105 3.287 -3.947 7.795
762 2HG2 VAL 105 2HG2 VAL 105 3.358 -5.241 6.601
763 3HG2 VAL 105 3HG2 VAL 105 1.859 -4.344 6.843
764 H TYR 106 H TYR 106 5.945 -4.710 7.360
765 HA TYR 106 HA TYR 106 6.794 -6.560 5.247
766 1HB TYR 106 2HB TYR 106 7.644 -6.318 8.133
767 2HB TYR 106 1HB TYR 106 8.178 -7.584 7.043
768 HD1 TYR 106 1HD TYR 106 9.562 -6.952 5.036
769 HD2 TYR 106 2HD TYR 106 8.686 -4.207 8.165
770 HE1 TYR 106 1HE TYR 106 11.405 -5.511 4.280
771 HE2 TYR 106 2HE TYR 106 10.525 -2.761 7.419
772 HH TYR 106 HH TYR 106 12.570 -2.889 6.155
773 H LEU 107 H LEU 107 5.251 -8.002 4.866
774 HA LEU 107 HA LEU 107 3.964 -9.269 7.187
775 1HB LEU 107 2HB LEU 107 1.855 -9.267 6.064
776 2HB LEU 107 1HB LEU 107 2.472 -7.631 6.028
777 HG LEU 107 HG LEU 107 3.399 -8.689 3.651
778 1HD1 LEU 107 1HD1 LEU 107 1.451 -9.679 2.574
779 2HD1 LEU 107 2HD1 LEU 107 0.583 -9.652 4.108
780 3HD1 LEU 107 3HD1 LEU 107 2.011 -10.669 3.921
781 1HD2 LEU 107 1HD2 LEU 107 2.518 -6.453 3.984
782 2HD2 LEU 107 2HD2 LEU 107 0.890 -7.106 4.170
783 3HD2 LEU 107 3HD2 LEU 107 1.722 -7.243 2.622
784 H LYS 108 H LYS 108 3.387 -11.505 6.834
785 HA LYS 108 HA LYS 108 4.962 -12.692 4.644
786 1HB LYS 108 2HB LYS 108 5.439 -13.365 7.055
787 2HB LYS 108 1HB LYS 108 3.869 -14.153 7.043
788 1HG LYS 108 2HG LYS 108 4.684 -15.410 4.992
789 2HG LYS 108 1HG LYS 108 6.292 -14.821 5.409
790 1HD LYS 108 2HD LYS 108 4.503 -16.508 7.155
791 2HD LYS 108 1HD LYS 108 5.953 -17.049 6.311
792 1HE LYS 108 2HE LYS 108 5.853 -14.966 8.492
793 2HE LYS 108 1HE LYS 108 6.370 -16.640 8.691
794 1HZ LYS 108 1HZ LYS 108 7.696 -14.547 7.050
795 2HZ LYS 108 2HZ LYS 108 8.151 -16.179 7.052
796 3HZ LYS 108 3HZ LYS 108 8.290 -15.259 8.472
797 H ALA 109 H ALA 109 3.856 -13.469 2.964
798 HA ALA 109 HA ALA 109 0.944 -13.658 3.254
799 1HB ALA 109 1HB ALA 109 0.827 -13.291 0.851
800 2HB ALA 109 2HB ALA 109 2.586 -13.316 0.748
801 3HB ALA 109 3HB ALA 109 1.773 -12.017 1.617
802 H ASN 110 H ASN 110 0.162 -15.611 3.452
803 HA ASN 110 HA ASN 110 0.772 -17.851 1.924
804 1HB ASN 110 2HB ASN 110 2.165 -19.206 3.404
805 2HB ASN 110 1HB ASN 110 3.022 -17.734 2.972
806 1HD2 ASN 110 1HD2 ASN 110 1.640 -16.021 4.811
807 2HD2 ASN 110 2HD2 ASN 110 2.196 -16.434 6.392
Start of MODEL 8
1 H HIS 3 H HIS 3 -6.362 -9.751 4.080
2 HA HIS 3 HA HIS 3 -5.611 -8.959 6.735
3 1HB HIS 3 2HB HIS 3 -3.721 -10.456 6.338
4 2HB HIS 3 1HB HIS 3 -3.519 -9.790 4.715
5 HD1 HIS 3 1HD HIS 3 -3.376 -8.491 8.296
6 HD2 HIS 3 2HD HIS 3 -1.579 -7.973 4.573
7 HE1 HIS 3 1HE HIS 3 -1.651 -6.690 8.625
8 HE2 HIS 3 2HE HIS 3 -0.722 -6.253 6.325
9 H LYS 4 H LYS 4 -4.996 -6.751 6.784
10 HA LYS 4 HA LYS 4 -4.896 -5.362 4.209
11 1HB LYS 4 2HB LYS 4 -6.437 -3.619 5.101
12 2HB LYS 4 1HB LYS 4 -7.197 -5.189 4.863
13 1HG LYS 4 2HG LYS 4 -7.074 -5.646 7.237
14 2HG LYS 4 1HG LYS 4 -6.225 -4.125 7.507
15 1HD LYS 4 2HD LYS 4 -8.999 -4.344 6.349
16 2HD LYS 4 1HD LYS 4 -8.658 -4.045 8.052
17 1HE LYS 4 2HE LYS 4 -7.437 -1.999 7.424
18 2HE LYS 4 1HE LYS 4 -7.843 -2.295 5.734
19 1HZ LYS 4 1HZ LYS 4 -9.330 -0.686 6.822
20 2HZ LYS 4 2HZ LYS 4 -9.839 -1.893 7.898
21 3HZ LYS 4 3HZ LYS 4 -10.161 -2.045 6.239
22 H VAL 5 H VAL 5 -3.467 -3.673 4.167
23 HA VAL 5 HA VAL 5 -2.304 -2.938 6.763
24 HB VAL 5 HB VAL 5 -1.083 -2.998 4.034
25 1HG1 VAL 5 1HG1 VAL 5 -0.367 -0.988 6.150
26 2HG1 VAL 5 2HG1 VAL 5 -0.844 -0.667 4.485
27 3HG1 VAL 5 3HG1 VAL 5 0.700 -1.451 4.825
28 1HG2 VAL 5 1HG2 VAL 5 0.009 -3.432 6.809
29 2HG2 VAL 5 2HG2 VAL 5 0.805 -3.823 5.283
30 3HG2 VAL 5 3HG2 VAL 5 -0.648 -4.703 5.770
31 H THR 6 H THR 6 -2.686 -1.059 7.608
32 HA THR 6 HA THR 6 -3.567 1.167 5.930
33 HB THR 6 HB THR 6 -4.214 2.098 8.272
34 HG1 THR 6 1HG THR 6 -4.672 0.387 9.758
35 1HG2 THR 6 1HG2 THR 6 -6.385 0.859 8.123
36 2HG2 THR 6 2HG2 THR 6 -5.649 -0.173 6.892
37 3HG2 THR 6 3HG2 THR 6 -5.847 1.554 6.593
38 H LYS 7 H LYS 7 -2.859 3.355 6.970
39 HA LYS 7 HA LYS 7 -0.260 3.811 6.360
40 1HB LYS 7 2HB LYS 7 -1.910 5.572 6.726
41 2HB LYS 7 1HB LYS 7 -1.811 5.309 8.463
42 1HG LYS 7 2HG LYS 7 -0.493 7.252 7.604
43 2HG LYS 7 1HG LYS 7 0.433 6.077 8.540
44 1HD LYS 7 2HD LYS 7 1.224 5.052 6.465
45 2HD LYS 7 1HD LYS 7 0.319 6.234 5.525
46 1HE LYS 7 2HE LYS 7 2.669 6.709 7.358
47 2HE LYS 7 1HE LYS 7 2.610 6.940 5.613
48 1HZ LYS 7 1HZ LYS 7 1.062 8.770 5.946
49 2HZ LYS 7 2HZ LYS 7 2.495 9.037 6.799
50 3HZ LYS 7 3HZ LYS 7 1.103 8.535 7.625
51 H ALA 8 H ALA 8 -1.378 2.906 9.643
52 HA ALA 8 HA ALA 8 0.953 3.477 11.053
53 1HB ALA 8 1HB ALA 8 0.191 1.873 12.708
54 2HB ALA 8 2HB ALA 8 -0.920 1.166 11.536
55 3HB ALA 8 3HB ALA 8 -1.166 2.820 12.099
56 H HIS 9 H HIS 9 0.213 0.759 8.997
57 HA HIS 9 HA HIS 9 2.347 -0.919 9.822
58 1HB HIS 9 2HB HIS 9 0.732 -0.868 7.289
59 2HB HIS 9 1HB HIS 9 1.950 -2.086 7.641
60 HD1 HIS 9 1HD HIS 9 -1.528 -1.272 8.139
61 HD2 HIS 9 2HD HIS 9 1.260 -3.709 9.987
62 HE1 HIS 9 1HE HIS 9 -2.867 -3.033 9.322
63 HE2 HIS 9 2HE HIS 9 -1.157 -4.259 10.730
64 H ASN 10 H ASN 10 2.430 1.996 8.261
65 HA ASN 10 HA ASN 10 4.466 1.909 6.415
66 1HB ASN 10 2HB ASN 10 3.366 4.006 7.025
67 2HB ASN 10 1HB ASN 10 4.028 3.902 8.660
68 1HD2 ASN 10 1HD2 ASN 10 4.625 4.771 5.384
69 2HD2 ASN 10 2HD2 ASN 10 6.179 5.490 5.637
70 H GLY 11 H GLY 11 4.520 0.997 9.711
71 1HA GLY 11 2HA GLY 11 7.364 0.283 9.423
72 2HA GLY 11 1HA GLY 11 6.839 1.099 10.890
73 H ALA 12 H ALA 12 5.631 -1.614 8.882
74 HA ALA 12 HA ALA 12 4.992 -3.024 11.394
75 1HB ALA 12 1HB ALA 12 3.976 -3.830 8.704
76 2HB ALA 12 2HB ALA 12 3.240 -2.493 9.595
77 3HB ALA 12 3HB ALA 12 3.267 -4.114 10.297
78 H THR 13 H THR 13 5.353 -5.244 11.638
79 HA THR 13 HA THR 13 6.601 -6.771 9.505
80 HB THR 13 HB THR 13 7.917 -6.670 12.234
81 HG1 THR 13 1HG THR 13 8.207 -5.016 10.144
82 1HG2 THR 13 1HG2 THR 13 8.085 -8.835 11.087
83 2HG2 THR 13 2HG2 THR 13 9.654 -8.032 11.184
84 3HG2 THR 13 3HG2 THR 13 8.751 -8.029 9.668
85 H LEU 14 H LEU 14 4.996 -8.311 9.415
86 HA LEU 14 HA LEU 14 4.547 -10.064 11.631
87 1HB LEU 14 2HB LEU 14 2.218 -9.642 12.025
88 2HB LEU 14 1HB LEU 14 3.134 -8.178 12.314
89 HG LEU 14 HG LEU 14 1.704 -8.646 9.711
90 1HD1 LEU 14 1HD1 LEU 14 0.061 -8.845 11.510
91 2HD1 LEU 14 2HD1 LEU 14 -0.154 -7.345 10.608
92 3HD1 LEU 14 3HD1 LEU 14 0.620 -7.320 12.193
93 1HD2 LEU 14 1HD2 LEU 14 1.850 -6.264 9.516
94 2HD2 LEU 14 2HD2 LEU 14 3.456 -6.905 9.873
95 3HD2 LEU 14 3HD2 LEU 14 2.514 -6.127 11.145
96 H THR 15 H THR 15 2.693 -11.636 11.124
97 HA THR 15 HA THR 15 3.024 -12.444 8.326
98 HB THR 15 HB THR 15 2.072 -14.051 10.709
99 HG1 THR 15 1HG THR 15 4.093 -14.684 10.936
100 1HG2 THR 15 1HG2 THR 15 1.126 -14.763 8.521
101 2HG2 THR 15 2HG2 THR 15 2.169 -15.982 9.268
102 3HG2 THR 15 3HG2 THR 15 2.775 -15.001 7.930
103 H VAL 16 H VAL 16 1.308 -12.982 7.042
104 HA VAL 16 HA VAL 16 -1.381 -12.279 8.027
105 HB VAL 16 HB VAL 16 -1.926 -11.367 5.913
106 1HG1 VAL 16 1HG1 VAL 16 -0.539 -9.902 7.268
107 2HG1 VAL 16 2HG1 VAL 16 -0.196 -9.657 5.554
108 3HG1 VAL 16 3HG1 VAL 16 0.918 -10.591 6.552
109 1HG2 VAL 16 1HG2 VAL 16 0.667 -12.464 4.865
110 2HG2 VAL 16 2HG2 VAL 16 -0.469 -11.461 3.960
111 3HG2 VAL 16 3HG2 VAL 16 -0.947 -13.075 4.492
112 H ALA 17 H ALA 17 -3.124 -13.578 7.296
113 HA ALA 17 HA ALA 17 -2.366 -16.154 6.105
114 1HB ALA 17 1HB ALA 17 -3.580 -16.334 8.190
115 2HB ALA 17 2HB ALA 17 -4.610 -16.887 6.867
116 3HB ALA 17 3HB ALA 17 -4.855 -15.286 7.571
117 H VAL 18 H VAL 18 -2.530 -16.125 3.943
118 HA VAL 18 HA VAL 18 -4.298 -14.192 2.678
119 HB VAL 18 HB VAL 18 -3.247 -14.844 0.573
120 1HG1 VAL 18 1HG1 VAL 18 -1.343 -14.268 2.834
121 2HG1 VAL 18 2HG1 VAL 18 -2.190 -13.097 1.822
122 3HG1 VAL 18 3HG1 VAL 18 -0.936 -14.129 1.121
123 1HG2 VAL 18 1HG2 VAL 18 -2.886 -17.214 1.025
124 2HG2 VAL 18 2HG2 VAL 18 -1.672 -16.806 2.237
125 3HG2 VAL 18 3HG2 VAL 18 -1.382 -16.431 0.536
126 H GLY 19 H GLY 19 -4.925 -15.357 0.309
127 1HA GLY 19 2HA GLY 19 -6.044 -17.382 -0.512
128 2HA GLY 19 1HA GLY 19 -6.721 -17.568 1.104
129 H GLU 20 H GLU 20 -7.633 -15.159 1.738
130 HA GLU 20 HA GLU 20 -9.893 -14.794 -0.013
131 1HB GLU 20 2HB GLU 20 -9.051 -13.376 2.526
132 2HB GLU 20 1HB GLU 20 -10.571 -13.101 1.687
133 1HG GLU 20 2HG GLU 20 -9.784 -15.822 2.656
134 2HG GLU 20 1HG GLU 20 -10.581 -14.654 3.711
135 H LEU 21 H LEU 21 -7.893 -12.326 1.511
136 HA LEU 21 HA LEU 21 -6.959 -11.164 -0.904
137 1HB LEU 21 2HB LEU 21 -9.216 -10.405 -1.175
138 2HB LEU 21 1HB LEU 21 -9.306 -9.900 0.499
139 HG LEU 21 HG LEU 21 -7.673 -8.107 0.033
140 1HD1 LEU 21 1HD1 LEU 21 -6.503 -9.173 -1.830
141 2HD1 LEU 21 2HD1 LEU 21 -7.082 -7.564 -2.260
142 3HD1 LEU 21 3HD1 LEU 21 -7.940 -8.995 -2.834
143 1HD2 LEU 21 1HD2 LEU 21 -10.066 -7.662 -0.082
144 2HD2 LEU 21 2HD2 LEU 21 -10.076 -8.116 -1.786
145 3HD2 LEU 21 3HD2 LEU 21 -9.179 -6.691 -1.257
146 H VAL 22 H VAL 22 -5.046 -10.351 -0.330
147 HA VAL 22 HA VAL 22 -4.836 -9.193 2.369
148 HB VAL 22 HB VAL 22 -2.844 -10.787 0.774
149 1HG1 VAL 22 1HG1 VAL 22 -2.162 -8.846 2.992
150 2HG1 VAL 22 2HG1 VAL 22 -1.643 -8.717 1.312
151 3HG1 VAL 22 3HG1 VAL 22 -1.067 -10.051 2.315
152 1HG2 VAL 22 1HG2 VAL 22 -2.546 -11.812 3.011
153 2HG2 VAL 22 2HG2 VAL 22 -4.197 -11.921 2.395
154 3HG2 VAL 22 3HG2 VAL 22 -3.792 -10.721 3.626
155 H GLU 23 H GLU 23 -5.040 -7.093 2.241
156 HA GLU 23 HA GLU 23 -3.975 -5.790 -0.168
157 1HB GLU 23 2HB GLU 23 -5.577 -4.057 0.055
158 2HB GLU 23 1HB GLU 23 -6.424 -5.588 0.186
159 1HG GLU 23 2HG GLU 23 -6.659 -5.339 2.547
160 2HG GLU 23 1HG GLU 23 -5.616 -3.917 2.548
161 H ILE 24 H ILE 24 -3.235 -3.665 -0.007
162 HA ILE 24 HA ILE 24 -2.007 -2.907 2.561
163 HB ILE 24 HB ILE 24 -0.730 -2.605 -0.166
164 1HG1 ILE 24 2HG1 ILE 24 -0.911 -5.001 0.577
165 2HG1 ILE 24 1HG1 ILE 24 0.744 -4.445 0.328
166 1HG2 ILE 24 1HG2 ILE 24 -0.033 -0.924 1.421
167 2HG2 ILE 24 2HG2 ILE 24 1.290 -2.049 1.118
168 3HG2 ILE 24 3HG2 ILE 24 0.354 -2.170 2.607
169 1HD1 ILE 24 1HD1 ILE 24 -0.654 -4.627 3.004
170 2HD1 ILE 24 2HD1 ILE 24 1.033 -4.195 2.723
171 3HD1 ILE 24 3HD1 ILE 24 0.468 -5.824 2.354
172 H GLN 25 H GLN 25 -3.285 -1.138 3.027
173 HA GLN 25 HA GLN 25 -4.021 0.625 0.790
174 1HB GLN 25 2HB GLN 25 -5.965 -0.273 1.752
175 2HB GLN 25 1HB GLN 25 -5.359 -0.032 3.391
176 1HG GLN 25 2HG GLN 25 -5.590 2.427 1.877
177 2HG GLN 25 1HG GLN 25 -7.120 1.572 2.034
178 1HE2 GLN 25 1HE2 GLN 25 -4.553 3.171 3.782
179 2HE2 GLN 25 2HE2 GLN 25 -5.410 3.332 5.274
180 H LEU 26 H LEU 26 -3.628 2.776 0.898
181 HA LEU 26 HA LEU 26 -2.563 3.748 3.416
182 1HB LEU 26 2HB LEU 26 -1.469 4.106 0.682
183 2HB LEU 26 1HB LEU 26 -1.214 5.358 1.893
184 HG LEU 26 HG LEU 26 -0.654 2.599 2.750
185 1HD1 LEU 26 1HD1 LEU 26 1.561 2.595 1.719
186 2HD1 LEU 26 2HD1 LEU 26 1.134 4.052 0.817
187 3HD1 LEU 26 3HD1 LEU 26 0.268 2.540 0.519
188 1HD2 LEU 26 1HD2 LEU 26 0.784 5.215 3.089
189 2HD2 LEU 26 2HD2 LEU 26 1.187 3.695 3.893
190 3HD2 LEU 26 3HD2 LEU 26 -0.354 4.490 4.227
191 HA PRO 27 HA PRO 27 -5.791 6.658 3.107
192 1HB PRO 27 2HB PRO 27 -4.991 8.461 4.930
193 2HB PRO 27 1HB PRO 27 -5.479 6.826 5.399
194 1HG PRO 27 2HG PRO 27 -2.719 7.955 5.040
195 2HG PRO 27 1HG PRO 27 -3.348 6.886 6.316
196 1HD PRO 27 2HD PRO 27 -1.899 6.006 4.177
197 2HD PRO 27 1HD PRO 27 -3.072 5.006 5.052
198 H SER 28 H SER 28 -2.952 7.083 1.699
199 HA SER 28 HA SER 28 -1.941 8.570 0.365
200 1HB SER 28 2HB SER 28 -4.283 8.957 -0.537
201 2HB SER 28 1HB SER 28 -4.395 10.314 0.584
202 HG SER 28 HG SER 28 -2.605 9.968 -1.590
203 H ASN 29 H ASN 29 -3.777 10.265 2.836
204 HA ASN 29 HA ASN 29 -3.299 12.082 4.142
205 1HB ASN 29 2HB ASN 29 -0.373 11.423 4.061
206 2HB ASN 29 1HB ASN 29 -1.341 11.990 5.406
207 1HD2 ASN 29 1HD2 ASN 29 -0.093 9.272 3.764
208 2HD2 ASN 29 2HD2 ASN 29 -0.717 8.059 4.834
209 HA PRO 30 HA PRO 30 -1.875 13.389 -0.149
210 1HB PRO 30 2HB PRO 30 -4.012 15.435 0.224
211 2HB PRO 30 1HB PRO 30 -3.660 14.407 -1.173
212 1HG PRO 30 2HG PRO 30 -5.709 13.812 0.375
213 2HG PRO 30 1HG PRO 30 -4.628 12.513 -0.174
214 1HD PRO 30 2HD PRO 30 -4.708 13.907 2.474
215 2HD PRO 30 1HD PRO 30 -4.576 12.169 2.125
216 H THR 31 H THR 31 -0.008 14.263 0.052
217 HA THR 31 HA THR 31 0.207 16.997 1.082
218 HB THR 31 HB THR 31 0.978 15.632 2.878
219 HG1 THR 31 1HG THR 31 2.360 17.335 2.598
220 1HG2 THR 31 1HG2 THR 31 2.747 14.176 0.909
221 2HG2 THR 31 2HG2 THR 31 1.274 13.529 1.633
222 3HG2 THR 31 3HG2 THR 31 2.674 13.894 2.649
223 H THR 32 H THR 32 0.577 18.073 -0.753
224 HA THR 32 HA THR 32 1.747 18.930 -2.502
225 HB THR 32 HB THR 32 3.869 16.823 -2.057
226 HG1 THR 32 1HG THR 32 4.407 17.784 -0.230
227 1HG2 THR 32 1HG2 THR 32 4.413 18.122 -3.951
228 2HG2 THR 32 2HG2 THR 32 5.340 18.832 -2.633
229 3HG2 THR 32 3HG2 THR 32 3.860 19.612 -3.190
230 H GLY 33 H GLY 33 2.906 17.899 -4.732
231 1HA GLY 33 2HA GLY 33 0.794 16.645 -6.060
232 2HA GLY 33 1HA GLY 33 2.418 16.807 -6.680
233 H PHE 34 H PHE 34 3.197 15.197 -4.137
234 HA PHE 34 HA PHE 34 3.540 12.749 -5.413
235 1HB PHE 34 2HB PHE 34 3.535 12.948 -2.433
236 2HB PHE 34 1HB PHE 34 4.622 12.056 -3.493
237 HD1 PHE 34 1HD PHE 34 4.811 14.359 -1.168
238 HD2 PHE 34 2HD PHE 34 5.569 14.082 -5.342
239 HE1 PHE 34 1HE PHE 34 6.429 16.199 -0.995
240 HE2 PHE 34 2HE PHE 34 7.189 15.916 -5.177
241 HZ PHE 34 HZ PHE 34 7.627 16.977 -2.998
242 H ALA 35 H ALA 35 2.725 10.693 -4.956
243 HA ALA 35 HA ALA 35 0.357 10.382 -3.288
244 1HB ALA 35 1HB ALA 35 -0.520 10.923 -5.548
245 2HB ALA 35 2HB ALA 35 -0.916 9.276 -5.059
246 3HB ALA 35 3HB ALA 35 0.391 9.563 -6.210
247 H TRP 36 H TRP 36 -0.113 7.979 -2.987
248 HA TRP 36 HA TRP 36 2.436 6.669 -2.648
249 1HB TRP 36 2HB TRP 36 -0.324 5.624 -1.963
250 2HB TRP 36 1HB TRP 36 1.203 4.833 -1.585
251 HD1 TRP 36 HD TRP 36 -1.120 7.543 -0.338
252 HE1 TRP 36 1HE TRP 36 -0.281 8.333 1.953
253 HE3 TRP 36 3HE TRP 36 3.428 5.240 -0.314
254 HZ2 TRP 36 2HZ TRP 36 1.991 7.998 3.584
255 HZ3 TRP 36 3HZ TRP 36 4.894 5.517 1.635
256 HH2 TRP 36 HH TRP 36 4.189 6.881 3.555
257 H TYR 37 H TYR 37 3.368 5.616 -4.194
258 HA TYR 37 HA TYR 37 1.792 3.599 -5.655
259 1HB TYR 37 2HB TYR 37 4.137 5.255 -6.593
260 2HB TYR 37 1HB TYR 37 3.697 3.738 -7.367
261 HD1 TYR 37 1HD TYR 37 2.721 7.200 -6.753
262 HD2 TYR 37 2HD TYR 37 1.733 3.581 -8.760
263 HE1 TYR 37 1HE TYR 37 1.085 8.421 -8.144
264 HE2 TYR 37 2HE TYR 37 0.103 4.778 -10.154
265 HH TYR 37 HH TYR 37 -0.059 8.182 -10.299
266 H PHE 38 H PHE 38 3.558 1.795 -6.406
267 HA PHE 38 HA PHE 38 5.108 1.041 -4.133
268 1HB PHE 38 2HB PHE 38 4.591 -0.042 -6.800
269 2HB PHE 38 1HB PHE 38 6.244 -0.276 -6.245
270 HD1 PHE 38 1HD PHE 38 2.832 -1.351 -5.975
271 HD2 PHE 38 2HD PHE 38 6.630 -1.466 -4.057
272 HE1 PHE 38 1HE PHE 38 2.093 -3.280 -4.640
273 HE2 PHE 38 2HE PHE 38 5.897 -3.398 -2.718
274 HZ PHE 38 HZ PHE 38 3.622 -4.284 -2.979
275 H GLU 39 H GLU 39 6.372 1.475 -7.400
276 HA GLU 39 HA GLU 39 8.566 3.075 -6.262
277 1HB GLU 39 2HB GLU 39 8.557 1.306 -8.715
278 2HB GLU 39 1HB GLU 39 9.923 2.261 -8.156
279 1HG GLU 39 2HG GLU 39 8.617 0.014 -6.642
280 2HG GLU 39 1HG GLU 39 10.131 -0.089 -7.539
281 H GLY 40 H GLY 40 5.800 3.613 -7.666
282 1HA GLY 40 2HA GLY 40 5.189 5.739 -8.527
283 2HA GLY 40 1HA GLY 40 6.823 5.928 -9.143
284 H GLY 41 H GLY 41 3.640 5.118 -9.897
285 1HA GLY 41 2HA GLY 41 2.674 4.632 -11.939
286 2HA GLY 41 1HA GLY 41 4.276 4.672 -12.659
287 H THR 42 H THR 42 4.619 2.641 -10.172
288 HA THR 42 HA THR 42 3.787 0.268 -11.690
289 HB THR 42 HB THR 42 5.883 -0.723 -10.409
290 HG1 THR 42 1HG THR 42 7.403 1.356 -11.047
291 1HG2 THR 42 1HG2 THR 42 7.206 -0.409 -12.468
292 2HG2 THR 42 2HG2 THR 42 6.041 0.796 -13.019
293 3HG2 THR 42 3HG2 THR 42 5.542 -0.882 -12.806
294 H LYS 43 H LYS 43 2.869 -1.333 -10.561
295 HA LYS 43 HA LYS 43 3.618 -1.594 -7.772
296 1HB LYS 43 2HB LYS 43 1.209 -2.385 -7.343
297 2HB LYS 43 1HB LYS 43 1.561 -0.672 -7.326
298 1HG LYS 43 2HG LYS 43 -0.482 -0.931 -8.461
299 2HG LYS 43 1HG LYS 43 0.724 -0.596 -9.700
300 1HD LYS 43 2HD LYS 43 0.844 -2.987 -10.222
301 2HD LYS 43 1HD LYS 43 -0.362 -3.319 -8.978
302 1HE LYS 43 2HE LYS 43 -2.039 -2.127 -10.178
303 2HE LYS 43 1HE LYS 43 -0.855 -1.489 -11.319
304 1HZ LYS 43 1HZ LYS 43 -1.416 -4.389 -11.031
305 2HZ LYS 43 2HZ LYS 43 -0.558 -3.615 -12.270
306 3HZ LYS 43 3HZ LYS 43 -2.235 -3.397 -12.134
307 H GLU 44 H GLU 44 4.178 -3.607 -7.236
308 HA GLU 44 HA GLU 44 3.184 -5.808 -8.901
309 1HB GLU 44 2HB GLU 44 5.414 -6.885 -8.781
310 2HB GLU 44 1HB GLU 44 5.412 -5.394 -9.705
311 1HG GLU 44 2HG GLU 44 6.178 -5.339 -6.824
312 2HG GLU 44 1HG GLU 44 7.328 -5.920 -8.026
313 H SER 45 H SER 45 3.122 -7.848 -7.905
314 HA SER 45 HA SER 45 3.056 -7.741 -4.953
315 1HB SER 45 2HB SER 45 0.937 -8.410 -5.985
316 2HB SER 45 1HB SER 45 1.751 -9.671 -6.911
317 HG SER 45 HG SER 45 1.104 -10.801 -5.226
318 HA PRO 46 HA PRO 46 6.913 -9.953 -4.837
319 1HB PRO 46 2HB PRO 46 5.651 -11.173 -2.421
320 2HB PRO 46 1HB PRO 46 7.241 -10.420 -2.604
321 1HG PRO 46 2HG PRO 46 5.271 -9.107 -1.410
322 2HG PRO 46 1HG PRO 46 6.375 -8.266 -2.515
323 1HD PRO 46 2HD PRO 46 3.559 -9.156 -2.960
324 2HD PRO 46 1HD PRO 46 4.391 -7.704 -3.546
325 H ASN 47 H ASN 47 3.837 -11.603 -4.610
326 HA ASN 47 HA ASN 47 4.980 -13.832 -6.112
327 1HB ASN 47 2HB ASN 47 3.560 -14.039 -3.487
328 2HB ASN 47 1HB ASN 47 3.280 -15.290 -4.693
329 1HD2 ASN 47 1HD2 ASN 47 4.608 -15.385 -2.068
330 2HD2 ASN 47 2HD2 ASN 47 6.191 -16.015 -2.370
331 H GLU 48 H GLU 48 3.959 -12.733 -7.875
332 HA GLU 48 HA GLU 48 1.034 -13.076 -7.885
333 1HB GLU 48 2HB GLU 48 0.929 -11.241 -9.535
334 2HB GLU 48 1HB GLU 48 1.593 -10.724 -7.991
335 1HG GLU 48 2HG GLU 48 3.805 -10.684 -8.872
336 2HG GLU 48 1HG GLU 48 3.276 -11.431 -10.380
337 H SER 49 H SER 49 2.124 -15.297 -8.431
338 HA SER 49 HA SER 49 2.858 -15.618 -11.192
339 1HB SER 49 2HB SER 49 2.613 -18.126 -10.436
340 2HB SER 49 1HB SER 49 3.958 -17.149 -9.843
341 HG SER 49 HG SER 49 2.442 -18.442 -8.320
342 H MET 50 H MET 50 0.180 -16.934 -9.224
343 HA MET 50 HA MET 50 -1.421 -17.110 -11.677
344 1HB MET 50 2HB MET 50 -2.764 -18.800 -10.611
345 2HB MET 50 1HB MET 50 -1.074 -19.244 -10.563
346 1HG MET 50 2HG MET 50 -2.660 -18.101 -8.260
347 2HG MET 50 1HG MET 50 -2.240 -19.800 -8.488
348 1HE MET 50 1HE MET 50 -1.620 -18.331 -5.771
349 2HE MET 50 2HE MET 50 0.026 -18.893 -5.470
350 3HE MET 50 3HE MET 50 -1.182 -20.004 -6.120
351 H PHE 51 H PHE 51 -1.228 -15.890 -8.478
352 HA PHE 51 HA PHE 51 -3.788 -14.518 -8.805
353 1HB PHE 51 2HB PHE 51 -2.281 -15.549 -6.468
354 2HB PHE 51 1HB PHE 51 -3.148 -14.031 -6.222
355 HD1 PHE 51 1HD PHE 51 -3.683 -17.418 -7.694
356 HD2 PHE 51 2HD PHE 51 -5.353 -14.137 -5.559
357 HE1 PHE 51 1HE PHE 51 -5.794 -18.651 -7.460
358 HE2 PHE 51 2HE PHE 51 -7.466 -15.372 -5.319
359 HZ PHE 51 HZ PHE 51 -7.691 -17.627 -6.276
360 H THR 52 H THR 52 -3.662 -12.174 -7.715
361 HA THR 52 HA THR 52 -1.245 -10.883 -8.643
362 HB THR 52 HB THR 52 -2.411 -11.572 -10.721
363 HG1 THR 52 1HG THR 52 -1.187 -9.864 -11.167
364 1HG2 THR 52 1HG2 THR 52 -4.430 -10.343 -11.408
365 2HG2 THR 52 2HG2 THR 52 -4.523 -9.615 -9.804
366 3HG2 THR 52 3HG2 THR 52 -4.720 -11.358 -9.994
367 H VAL 53 H VAL 53 -1.567 -8.459 -8.817
368 HA VAL 53 HA VAL 53 -3.031 -7.652 -6.412
369 HB VAL 53 HB VAL 53 -0.664 -7.325 -6.169
370 1HG1 VAL 53 1HG1 VAL 53 -0.773 -5.718 -8.716
371 2HG1 VAL 53 2HG1 VAL 53 -0.004 -7.290 -8.500
372 3HG1 VAL 53 3HG1 VAL 53 0.633 -5.875 -7.661
373 1HG2 VAL 53 1HG2 VAL 53 -2.020 -4.682 -6.697
374 2HG2 VAL 53 2HG2 VAL 53 -0.542 -4.906 -5.763
375 3HG2 VAL 53 3HG2 VAL 53 -2.061 -5.595 -5.188
376 H GLU 54 H GLU 54 -4.526 -6.161 -6.462
377 HA GLU 54 HA GLU 54 -5.154 -4.775 -8.980
378 1HB GLU 54 2HB GLU 54 -6.952 -6.145 -8.034
379 2HB GLU 54 1HB GLU 54 -6.790 -5.308 -6.502
380 1HG GLU 54 2HG GLU 54 -7.498 -3.226 -7.552
381 2HG GLU 54 1HG GLU 54 -7.713 -4.084 -9.084
382 H ASN 55 H ASN 55 -5.739 -2.562 -8.844
383 HA ASN 55 HA ASN 55 -4.610 -1.177 -6.512
384 1HB ASN 55 2HB ASN 55 -3.785 0.588 -7.999
385 2HB ASN 55 1HB ASN 55 -3.032 -0.966 -8.347
386 1HD2 ASN 55 1HD2 ASN 55 -5.060 1.560 -9.538
387 2HD2 ASN 55 2HD2 ASN 55 -5.245 0.945 -11.139
388 H LYS 56 H LYS 56 -5.588 0.690 -5.856
389 HA LYS 56 HA LYS 56 -7.709 1.941 -7.308
390 1HB LYS 56 2HB LYS 56 -9.190 1.423 -5.097
391 2HB LYS 56 1HB LYS 56 -9.345 0.540 -6.610
392 1HG LYS 56 2HG LYS 56 -9.013 -1.286 -5.374
393 2HG LYS 56 1HG LYS 56 -7.322 -0.776 -5.314
394 1HD LYS 56 2HD LYS 56 -8.250 -1.308 -3.093
395 2HD LYS 56 1HD LYS 56 -7.667 0.353 -3.239
396 1HE LYS 56 2HE LYS 56 -9.878 0.013 -2.040
397 2HE LYS 56 1HE LYS 56 -9.847 1.219 -3.314
398 1HZ LYS 56 1HZ LYS 56 -11.827 -0.281 -3.319
399 2HZ LYS 56 2HZ LYS 56 -10.797 -1.567 -3.723
400 3HZ LYS 56 3HZ LYS 56 -10.975 -0.258 -4.784
401 H TYR 57 H TYR 57 -6.982 3.951 -6.927
402 HA TYR 57 HA TYR 57 -6.377 4.605 -4.132
403 1HB TYR 57 2HB TYR 57 -5.166 6.249 -6.237
404 2HB TYR 57 1HB TYR 57 -4.573 5.811 -4.649
405 HD1 TYR 57 1HD TYR 57 -4.436 5.099 -8.161
406 HD2 TYR 57 2HD TYR 57 -3.619 3.494 -4.303
407 HE1 TYR 57 1HE TYR 57 -2.920 3.451 -9.174
408 HE2 TYR 57 2HE TYR 57 -2.098 1.847 -5.310
409 HH TYR 57 HH TYR 57 -1.004 2.069 -8.509
410 H PHE 58 H PHE 58 -7.507 6.077 -3.232
411 HA PHE 58 HA PHE 58 -8.688 8.255 -4.819
412 1HB PHE 58 2HB PHE 58 -9.965 6.967 -2.386
413 2HB PHE 58 1HB PHE 58 -10.676 8.188 -3.445
414 HD1 PHE 58 1HD PHE 58 -9.928 4.642 -3.036
415 HD2 PHE 58 2HD PHE 58 -11.558 7.591 -5.633
416 HE1 PHE 58 1HE PHE 58 -10.968 2.870 -4.388
417 HE2 PHE 58 2HE PHE 58 -12.602 5.827 -6.990
418 HZ PHE 58 HZ PHE 58 -12.310 3.460 -6.362
419 HA PRO 59 HA PRO 59 -6.413 9.948 -1.281
420 1HB PRO 59 2HB PRO 59 -4.942 11.749 -2.509
421 2HB PRO 59 1HB PRO 59 -4.701 10.028 -2.847
422 1HG PRO 59 2HG PRO 59 -6.104 12.092 -4.455
423 2HG PRO 59 1HG PRO 59 -5.087 10.760 -5.014
424 1HD PRO 59 2HD PRO 59 -7.922 10.806 -4.856
425 2HD PRO 59 1HD PRO 59 -6.900 9.394 -5.190
426 HA PRO 60 HA PRO 60 -9.334 13.793 -1.081
427 1HB PRO 60 2HB PRO 60 -10.696 11.925 0.762
428 2HB PRO 60 1HB PRO 60 -11.359 13.200 -0.270
429 1HG PRO 60 2HG PRO 60 -11.672 10.698 -0.993
430 2HG PRO 60 1HG PRO 60 -11.168 11.904 -2.195
431 1HD PRO 60 2HD PRO 60 -9.472 9.920 -0.703
432 2HD PRO 60 1HD PRO 60 -9.500 10.289 -2.442
433 H ASP 61 H ASP 61 -10.022 14.477 1.256
434 HA ASP 61 HA ASP 61 -7.830 14.169 3.125
435 1HB ASP 61 2HB ASP 61 -6.859 15.538 1.294
436 2HB ASP 61 1HB ASP 61 -8.169 16.690 1.472
437 H SER 62 H SER 62 -8.776 17.317 3.291
438 HA SER 62 HA SER 62 -11.470 16.935 4.291
439 1HB SER 62 2HB SER 62 -9.226 17.966 6.052
440 2HB SER 62 1HB SER 62 -10.939 18.123 6.442
441 HG SER 62 HG SER 62 -9.400 15.748 6.194
442 H LYS 63 H LYS 63 -8.745 19.180 3.858
443 HA LYS 63 HA LYS 63 -10.598 21.425 3.745
444 1HB LYS 63 2HB LYS 63 -8.382 22.734 3.556
445 2HB LYS 63 1HB LYS 63 -8.800 21.981 5.085
446 1HG LYS 63 2HG LYS 63 -6.462 21.660 4.623
447 2HG LYS 63 1HG LYS 63 -7.297 20.109 4.561
448 1HD LYS 63 2HD LYS 63 -7.196 20.053 2.173
449 2HD LYS 63 1HD LYS 63 -6.680 21.745 2.105
450 1HE LYS 63 2HE LYS 63 -4.854 20.046 1.743
451 2HE LYS 63 1HE LYS 63 -4.544 21.232 3.009
452 1HZ LYS 63 1HZ LYS 63 -5.068 19.625 4.676
453 2HZ LYS 63 2HZ LYS 63 -3.959 18.911 3.613
454 3HZ LYS 63 3HZ LYS 63 -5.603 18.504 3.526
455 H LEU 64 H LEU 64 -9.672 19.310 1.504
456 HA LEU 64 HA LEU 64 -10.127 21.134 -0.672
457 1HB LEU 64 2HB LEU 64 -7.644 21.313 -0.091
458 2HB LEU 64 1HB LEU 64 -7.505 19.653 -0.633
459 HG LEU 64 HG LEU 64 -6.813 21.456 -2.285
460 1HD1 LEU 64 1HD1 LEU 64 -7.236 19.163 -2.995
461 2HD1 LEU 64 2HD1 LEU 64 -7.771 20.319 -4.215
462 3HD1 LEU 64 3HD1 LEU 64 -8.951 19.528 -3.169
463 1HD2 LEU 64 1HD2 LEU 64 -8.573 22.549 -3.550
464 2HD2 LEU 64 2HD2 LEU 64 -8.658 23.000 -1.848
465 3HD2 LEU 64 3HD2 LEU 64 -9.794 21.823 -2.508
466 H LEU 65 H LEU 65 -8.352 18.089 -0.426
467 HA LEU 65 HA LEU 65 -9.779 16.778 -2.421
468 1HB LEU 65 2HB LEU 65 -8.088 15.795 -0.167
469 2HB LEU 65 1HB LEU 65 -8.846 14.687 -1.286
470 HG LEU 65 HG LEU 65 -6.586 14.953 -1.944
471 1HD1 LEU 65 1HD1 LEU 65 -8.310 14.880 -3.703
472 2HD1 LEU 65 2HD1 LEU 65 -6.814 15.674 -4.199
473 3HD1 LEU 65 3HD1 LEU 65 -8.234 16.639 -3.801
474 1HD2 LEU 65 1HD2 LEU 65 -5.591 17.112 -2.503
475 2HD2 LEU 65 2HD2 LEU 65 -6.075 17.037 -0.810
476 3HD2 LEU 65 3HD2 LEU 65 -7.059 17.927 -1.971
477 H GLY 66 H GLY 66 -10.042 16.448 1.053
478 1HA GLY 66 2HA GLY 66 -11.987 16.986 2.149
479 2HA GLY 66 1HA GLY 66 -12.858 16.848 0.647
480 H ALA 67 H ALA 67 -12.770 14.368 -0.148
481 HA ALA 67 HA ALA 67 -14.811 13.299 1.419
482 1HB ALA 67 1HB ALA 67 -13.083 11.876 -0.596
483 2HB ALA 67 2HB ALA 67 -14.597 12.729 -0.903
484 3HB ALA 67 3HB ALA 67 -14.597 11.248 0.058
485 H GLY 68 H GLY 68 -12.090 11.159 0.860
486 1HA GLY 68 2HA GLY 68 -11.140 11.086 3.538
487 2HA GLY 68 1HA GLY 68 -12.175 9.701 3.184
488 H GLY 69 H GLY 69 -9.030 10.714 3.187
489 1HA GLY 69 2HA GLY 69 -8.021 9.863 0.696
490 2HA GLY 69 1HA GLY 69 -7.094 9.985 2.173
491 H THR 70 H THR 70 -7.699 7.955 -0.178
492 HA THR 70 HA THR 70 -7.179 5.602 1.370
493 HB THR 70 HB THR 70 -9.326 4.626 -0.003
494 HG1 THR 70 1HG THR 70 -9.829 7.293 0.730
495 1HG2 THR 70 1HG2 THR 70 -10.326 4.398 2.200
496 2HG2 THR 70 2HG2 THR 70 -9.251 5.651 2.825
497 3HG2 THR 70 3HG2 THR 70 -8.582 4.114 2.276
498 H GLU 71 H GLU 71 -5.365 5.683 -0.032
499 HA GLU 71 HA GLU 71 -5.880 4.742 -2.777
500 1HB GLU 71 2HB GLU 71 -3.253 5.625 -1.554
501 2HB GLU 71 1HB GLU 71 -3.571 5.309 -3.253
502 1HG GLU 71 2HG GLU 71 -5.204 7.213 -3.198
503 2HG GLU 71 1HG GLU 71 -4.599 7.585 -1.585
504 H HIS 72 H HIS 72 -6.050 2.509 -2.768
505 HA HIS 72 HA HIS 72 -4.282 1.142 -0.847
506 1HB HIS 72 2HB HIS 72 -6.598 -0.436 -1.738
507 2HB HIS 72 1HB HIS 72 -5.813 -0.328 -0.182
508 HD1 HIS 72 1HD HIS 72 -8.196 -0.501 0.816
509 HD2 HIS 72 2HD HIS 72 -7.416 2.994 -1.278
510 HE1 HIS 72 1HE HIS 72 -10.084 1.044 1.354
511 HE2 HIS 72 2HE HIS 72 -9.761 3.019 -0.172
512 H PHE 73 H PHE 73 -3.318 -0.681 -1.359
513 HA PHE 73 HA PHE 73 -3.305 -1.582 -4.159
514 1HB PHE 73 2HB PHE 73 -1.325 -1.799 -1.880
515 2HB PHE 73 1HB PHE 73 -1.127 -2.680 -3.392
516 HD1 PHE 73 1HD PHE 73 -0.047 -1.662 -5.199
517 HD2 PHE 73 2HD PHE 73 -1.500 0.750 -2.005
518 HE1 PHE 73 1HE PHE 73 1.069 0.297 -6.175
519 HE2 PHE 73 2HE PHE 73 -0.380 2.714 -2.979
520 HZ PHE 73 HZ PHE 73 0.916 2.495 -5.041
521 H HIS 74 H HIS 74 -4.490 -3.416 -4.466
522 HA HIS 74 HA HIS 74 -5.128 -5.001 -2.063
523 1HB HIS 74 2HB HIS 74 -6.634 -4.343 -4.552
524 2HB HIS 74 1HB HIS 74 -6.967 -5.879 -3.759
525 HD1 HIS 74 1HD HIS 74 -9.246 -5.352 -2.880
526 HD2 HIS 74 2HD HIS 74 -6.420 -2.490 -1.795
527 HE1 HIS 74 1HE HIS 74 -10.362 -3.911 -1.154
528 HE2 HIS 74 2HE HIS 74 -8.524 -2.435 -0.280
529 H VAL 75 H VAL 75 -3.896 -6.814 -1.888
530 HA VAL 75 HA VAL 75 -2.994 -8.047 -4.392
531 HB VAL 75 HB VAL 75 -1.879 -8.406 -1.599
532 1HG1 VAL 75 1HG1 VAL 75 -1.614 -10.407 -2.981
533 2HG1 VAL 75 2HG1 VAL 75 -0.061 -9.620 -2.691
534 3HG1 VAL 75 3HG1 VAL 75 -0.868 -9.435 -4.250
535 1HG2 VAL 75 1HG2 VAL 75 -1.412 -6.187 -2.481
536 2HG2 VAL 75 2HG2 VAL 75 -0.776 -6.895 -3.965
537 3HG2 VAL 75 3HG2 VAL 75 0.058 -7.160 -2.434
538 H THR 76 H THR 76 -4.271 -9.615 -5.013
539 HA THR 76 HA THR 76 -5.499 -11.343 -2.989
540 HB THR 76 HB THR 76 -6.095 -11.251 -5.965
541 HG1 THR 76 1HG THR 76 -6.930 -9.360 -5.405
542 1HG2 THR 76 1HG2 THR 76 -7.635 -12.400 -3.634
543 2HG2 THR 76 2HG2 THR 76 -6.758 -13.321 -4.857
544 3HG2 THR 76 3HG2 THR 76 -8.177 -12.379 -5.315
545 H VAL 77 H VAL 77 -4.098 -12.889 -2.502
546 HA VAL 77 HA VAL 77 -3.149 -14.655 -4.607
547 HB VAL 77 HB VAL 77 -1.324 -13.042 -4.428
548 1HG1 VAL 77 1HG1 VAL 77 -1.734 -12.203 -2.193
549 2HG1 VAL 77 2HG1 VAL 77 -0.068 -12.764 -2.333
550 3HG1 VAL 77 3HG1 VAL 77 -1.266 -13.754 -1.500
551 1HG2 VAL 77 1HG2 VAL 77 0.522 -14.550 -3.918
552 2HG2 VAL 77 2HG2 VAL 77 -0.734 -15.383 -4.835
553 3HG2 VAL 77 3HG2 VAL 77 -0.587 -15.648 -3.095
554 H LYS 78 H LYS 78 -2.726 -16.776 -3.867
555 HA LYS 78 HA LYS 78 -2.545 -17.094 -0.982
556 1HB LYS 78 2HB LYS 78 -4.026 -18.852 -0.794
557 2HB LYS 78 1HB LYS 78 -4.854 -17.788 -1.907
558 1HG LYS 78 2HG LYS 78 -3.181 -19.865 -3.152
559 2HG LYS 78 1HG LYS 78 -4.577 -20.446 -2.252
560 1HD LYS 78 2HD LYS 78 -4.610 -18.444 -4.519
561 2HD LYS 78 1HD LYS 78 -5.135 -20.129 -4.591
562 1HE LYS 78 2HE LYS 78 -6.611 -19.271 -2.506
563 2HE LYS 78 1HE LYS 78 -6.489 -17.777 -3.437
564 1HZ LYS 78 1HZ LYS 78 -7.539 -20.388 -4.384
565 2HZ LYS 78 2HZ LYS 78 -7.308 -19.043 -5.380
566 3HZ LYS 78 3HZ LYS 78 -8.431 -18.970 -4.114
567 H ALA 79 H ALA 79 -0.487 -17.553 -0.767
568 HA ALA 79 HA ALA 79 0.595 -19.993 -1.751
569 1HB ALA 79 1HB ALA 79 1.713 -17.420 -2.872
570 2HB ALA 79 2HB ALA 79 0.895 -18.686 -3.788
571 3HB ALA 79 3HB ALA 79 2.459 -19.010 -3.037
572 H ALA 80 H ALA 80 2.746 -20.385 -0.826
573 HA ALA 80 HA ALA 80 3.029 -18.973 1.695
574 1HB ALA 80 1HB ALA 80 4.720 -20.652 2.226
575 2HB ALA 80 2HB ALA 80 4.638 -21.275 0.577
576 3HB ALA 80 3HB ALA 80 3.241 -21.415 1.643
577 H GLY 81 H GLY 81 3.775 -16.989 1.296
578 1HA GLY 81 2HA GLY 81 6.532 -16.754 0.355
579 2HA GLY 81 1HA GLY 81 5.297 -15.825 -0.483
580 H THR 82 H THR 82 7.341 -14.490 0.676
581 HA THR 82 HA THR 82 6.096 -13.363 3.095
582 HB THR 82 HB THR 82 8.892 -12.717 2.184
583 HG1 THR 82 1HG THR 82 8.457 -15.087 2.476
584 1HG2 THR 82 1HG2 THR 82 7.935 -11.321 3.933
585 2HG2 THR 82 2HG2 THR 82 9.196 -12.350 4.617
586 3HG2 THR 82 3HG2 THR 82 7.495 -12.755 4.864
587 H HIS 83 H HIS 83 5.334 -11.279 3.038
588 HA HIS 83 HA HIS 83 5.327 -10.079 0.346
589 1HB HIS 83 2HB HIS 83 3.117 -10.818 1.581
590 2HB HIS 83 1HB HIS 83 3.379 -9.360 2.521
591 HD1 HIS 83 1HD HIS 83 3.475 -7.082 1.117
592 HD2 HIS 83 2HD HIS 83 1.906 -10.381 -0.858
593 HE1 HIS 83 1HE HIS 83 2.256 -6.143 -0.869
594 HE2 HIS 83 2HE HIS 83 1.170 -8.154 -1.958
595 H ALA 84 H ALA 84 6.996 -8.629 0.347
596 HA ALA 84 HA ALA 84 7.163 -6.742 2.594
597 1HB ALA 84 1HB ALA 84 9.249 -7.890 2.006
598 2HB ALA 84 2HB ALA 84 9.372 -6.152 1.724
599 3HB ALA 84 3HB ALA 84 9.137 -7.254 0.364
600 H VAL 85 H VAL 85 6.556 -4.655 2.331
601 HA VAL 85 HA VAL 85 5.852 -3.822 -0.411
602 HB VAL 85 HB VAL 85 4.228 -2.943 1.928
603 1HG1 VAL 85 1HG1 VAL 85 3.557 -3.404 -0.970
604 2HG1 VAL 85 2HG1 VAL 85 3.898 -1.848 -0.214
605 3HG1 VAL 85 3HG1 VAL 85 2.464 -2.760 0.256
606 1HG2 VAL 85 1HG2 VAL 85 4.296 -5.352 2.152
607 2HG2 VAL 85 2HG2 VAL 85 3.811 -5.535 0.464
608 3HG2 VAL 85 3HG2 VAL 85 2.699 -4.814 1.626
609 H ASN 86 H ASN 86 7.421 -2.345 -0.757
610 HA ASN 86 HA ASN 86 7.506 -0.051 1.107
611 1HB ASN 86 2HB ASN 86 9.476 -0.910 -1.038
612 2HB ASN 86 1HB ASN 86 9.577 0.608 -0.158
613 1HD2 ASN 86 1HD2 ASN 86 8.743 -2.596 1.100
614 2HD2 ASN 86 2HD2 ASN 86 10.096 -2.710 2.170
615 H LEU 87 H LEU 87 5.973 1.275 0.519
616 HA LEU 87 HA LEU 87 5.433 1.679 -2.336
617 1HB LEU 87 2HB LEU 87 3.752 2.244 0.112
618 2HB LEU 87 1HB LEU 87 3.290 2.680 -1.523
619 HG LEU 87 HG LEU 87 3.793 -0.168 -0.640
620 1HD1 LEU 87 1HD1 LEU 87 1.183 1.302 -0.965
621 2HD1 LEU 87 2HD1 LEU 87 1.888 0.773 0.565
622 3HD1 LEU 87 3HD1 LEU 87 1.374 -0.420 -0.631
623 1HD2 LEU 87 1HD2 LEU 87 4.087 0.232 -3.011
624 2HD2 LEU 87 2HD2 LEU 87 2.501 1.006 -3.089
625 3HD2 LEU 87 3HD2 LEU 87 2.631 -0.711 -2.704
626 H THR 88 H THR 88 6.018 3.549 -3.241
627 HA THR 88 HA THR 88 7.221 5.526 -1.447
628 HB THR 88 HB THR 88 7.674 5.334 -4.425
629 HG1 THR 88 1HG THR 88 8.314 3.342 -3.742
630 1HG2 THR 88 1HG2 THR 88 9.816 6.386 -3.845
631 2HG2 THR 88 2HG2 THR 88 9.358 6.385 -2.142
632 3HG2 THR 88 3HG2 THR 88 8.458 7.368 -3.296
633 H TYR 89 H TYR 89 6.190 7.292 -1.092
634 HA TYR 89 HA TYR 89 3.924 8.141 -2.682
635 1HB TYR 89 2HB TYR 89 3.951 8.114 -0.161
636 2HB TYR 89 1HB TYR 89 5.161 9.391 -0.210
637 HD1 TYR 89 1HD TYR 89 1.636 8.578 -0.917
638 HD2 TYR 89 2HD TYR 89 4.544 11.650 -0.619
639 HE1 TYR 89 1HE TYR 89 -0.148 10.267 -0.945
640 HE2 TYR 89 2HE TYR 89 2.774 13.350 -0.649
641 HH TYR 89 HH TYR 89 -0.310 12.764 0.021
642 H MET 90 H MET 90 4.762 8.937 -4.605
643 HA MET 90 HA MET 90 6.565 11.281 -4.387
644 1HB MET 90 2HB MET 90 6.603 9.430 -6.747
645 2HB MET 90 1HB MET 90 7.782 10.642 -6.289
646 1HG MET 90 2HG MET 90 8.575 9.282 -4.494
647 2HG MET 90 1HG MET 90 7.302 8.088 -4.794
648 1HE MET 90 1HE MET 90 8.282 7.240 -8.612
649 2HE MET 90 2HE MET 90 7.303 8.599 -8.046
650 3HE MET 90 3HE MET 90 7.043 6.986 -7.385
651 H ARG 91 H ARG 91 6.431 12.708 -6.271
652 HA ARG 91 HA ARG 91 3.805 13.162 -7.249
653 1HB ARG 91 2HB ARG 91 6.182 14.624 -7.221
654 2HB ARG 91 1HB ARG 91 5.980 14.189 -8.917
655 1HG ARG 91 2HG ARG 91 3.697 15.131 -8.861
656 2HG ARG 91 1HG ARG 91 4.000 15.673 -7.212
657 1HD ARG 91 2HD ARG 91 5.679 16.467 -9.579
658 2HD ARG 91 1HD ARG 91 4.317 17.412 -8.985
659 HE ARG 91 HE ARG 91 5.895 17.099 -6.791
660 1HH1 ARG 91 1HH1 ARG 91 6.405 18.328 -10.025
661 2HH1 ARG 91 2HH1 ARG 91 7.620 19.472 -9.547
662 1HH2 ARG 91 1HH2 ARG 91 7.460 18.647 -6.124
663 2HH2 ARG 91 2HH2 ARG 91 8.210 19.665 -7.323
664 HA PRO 92 HA PRO 92 3.888 9.421 -9.639
665 1HB PRO 92 2HB PRO 92 1.796 10.302 -11.350
666 2HB PRO 92 1HB PRO 92 1.650 9.304 -9.901
667 1HG PRO 92 2HG PRO 92 1.308 12.252 -10.214
668 2HG PRO 92 1HG PRO 92 0.442 11.126 -9.149
669 1HD PRO 92 2HD PRO 92 2.280 12.772 -8.179
670 2HD PRO 92 1HD PRO 92 2.193 11.092 -7.601
671 H TRP 93 H TRP 93 3.996 12.567 -11.292
672 HA TRP 93 HA TRP 93 4.888 11.227 -13.720
673 1HB TRP 93 2HB TRP 93 4.764 13.532 -14.731
674 2HB TRP 93 1HB TRP 93 3.239 12.860 -14.170
675 HD1 TRP 93 HD TRP 93 5.669 15.714 -13.540
676 HE1 TRP 93 1HE TRP 93 4.591 17.388 -11.905
677 HE3 TRP 93 3HE TRP 93 1.567 12.989 -12.195
678 HZ2 TRP 93 2HZ TRP 93 2.300 17.521 -10.260
679 HZ3 TRP 93 3HZ TRP 93 -0.018 13.954 -10.587
680 HH2 TRP 93 HH TRP 93 0.338 16.180 -9.639
681 H THR 94 H THR 94 6.443 12.071 -11.038
682 HA THR 94 HA THR 94 8.966 12.139 -12.354
683 HB THR 94 HB THR 94 8.650 14.453 -12.714
684 HG1 THR 94 1HG THR 94 10.610 14.720 -11.990
685 1HG2 THR 94 1HG2 THR 94 6.754 14.845 -11.222
686 2HG2 THR 94 2HG2 THR 94 8.017 16.050 -10.966
687 3HG2 THR 94 3HG2 THR 94 7.819 14.722 -9.821
688 H GLY 95 H GLY 95 7.562 13.219 -9.241
689 1HA GLY 95 2HA GLY 95 8.003 12.582 -7.070
690 2HA GLY 95 1HA GLY 95 8.572 11.053 -7.753
691 HA PRO 96 HA PRO 96 12.252 14.291 -7.365
692 1HB PRO 96 2HB PRO 96 11.296 15.490 -4.840
693 2HB PRO 96 1HB PRO 96 12.051 16.258 -6.230
694 1HG PRO 96 2HG PRO 96 9.453 16.558 -5.681
695 2HG PRO 96 1HG PRO 96 10.074 16.539 -7.340
696 1HD PRO 96 2HD PRO 96 8.625 14.430 -5.821
697 2HD PRO 96 1HD PRO 96 8.569 14.819 -7.552
698 H SER 97 H SER 97 13.793 13.002 -6.629
699 HA SER 97 HA SER 97 13.228 10.664 -5.304
700 1HB SER 97 2HB SER 97 15.220 11.069 -6.730
701 2HB SER 97 1HB SER 97 15.941 11.994 -5.413
702 HG SER 97 HG SER 97 16.691 10.116 -4.820
703 H HIS 98 H HIS 98 14.860 13.508 -3.886
704 HA HIS 98 HA HIS 98 14.772 12.198 -1.274
705 1HB HIS 98 2HB HIS 98 16.845 13.331 -2.125
706 2HB HIS 98 1HB HIS 98 15.992 14.864 -2.025
707 HD1 HIS 98 1HD HIS 98 16.389 16.109 0.067
708 HD2 HIS 98 2HD HIS 98 16.907 12.012 0.590
709 HE1 HIS 98 1HE HIS 98 17.190 15.818 2.436
710 HE2 HIS 98 2HE HIS 98 17.484 13.338 2.737
711 H ASP 99 H ASP 99 12.537 13.754 -2.961
712 HA ASP 99 HA ASP 99 11.708 15.520 -0.741
713 1HB ASP 99 2HB ASP 99 12.284 16.552 -2.995
714 2HB ASP 99 1HB ASP 99 10.861 15.744 -3.633
715 H SER 100 H SER 100 11.188 12.588 -1.963
716 HA SER 100 HA SER 100 8.265 12.625 -1.821
717 1HB SER 100 2HB SER 100 10.176 10.447 -2.698
718 2HB SER 100 1HB SER 100 8.416 10.372 -2.793
719 HG SER 100 HG SER 100 10.117 12.213 -4.139
720 H GLU 101 H GLU 101 7.304 10.600 -0.802
721 HA GLU 101 HA GLU 101 8.622 9.998 1.774
722 1HB GLU 101 2HB GLU 101 6.627 11.323 2.126
723 2HB GLU 101 1HB GLU 101 5.696 10.303 1.045
724 1HG GLU 101 2HG GLU 101 5.079 9.878 3.329
725 2HG GLU 101 1HG GLU 101 5.868 8.461 2.645
726 H ARG 102 H ARG 102 7.773 7.750 2.656
727 HA ARG 102 HA ARG 102 6.907 5.902 0.614
728 1HB ARG 102 2HB ARG 102 9.516 6.231 0.489
729 2HB ARG 102 1HB ARG 102 9.526 5.205 1.915
730 1HG ARG 102 2HG ARG 102 8.356 3.456 0.652
731 2HG ARG 102 1HG ARG 102 8.387 4.487 -0.779
732 1HD ARG 102 2HD ARG 102 10.904 4.558 -0.500
733 2HD ARG 102 1HD ARG 102 10.714 3.256 0.672
734 HE ARG 102 HE ARG 102 9.546 2.787 -1.968
735 1HH1 ARG 102 1HH1 ARG 102 12.224 2.282 0.239
736 2HH1 ARG 102 2HH1 ARG 102 12.953 1.027 -0.712
737 1HH2 ARG 102 1HH2 ARG 102 10.508 1.135 -3.246
738 2HH2 ARG 102 2HH2 ARG 102 11.974 0.371 -2.685
739 H PHE 103 H PHE 103 6.013 4.137 1.377
740 HA PHE 103 HA PHE 103 5.746 3.817 4.287
741 1HB PHE 103 2HB PHE 103 3.569 4.007 3.507
742 2HB PHE 103 1HB PHE 103 3.984 3.387 1.915
743 HD1 PHE 103 1HD PHE 103 2.856 2.592 5.258
744 HD2 PHE 103 2HD PHE 103 4.064 0.993 1.509
745 HE1 PHE 103 1HE PHE 103 1.881 0.421 5.866
746 HE2 PHE 103 2HE PHE 103 3.098 -1.175 2.113
747 HZ PHE 103 HZ PHE 103 2.006 -1.460 4.294
748 H THR 104 H THR 104 5.743 1.535 5.087
749 HA THR 104 HA THR 104 6.780 -0.466 3.306
750 HB THR 104 HB THR 104 8.538 0.561 5.548
751 HG1 THR 104 1HG THR 104 8.384 1.199 2.943
752 1HG2 THR 104 1HG2 THR 104 8.606 -1.876 5.384
753 2HG2 THR 104 2HG2 THR 104 10.125 -1.157 4.840
754 3HG2 THR 104 3HG2 THR 104 8.959 -1.754 3.659
755 H VAL 105 H VAL 105 5.108 -1.837 3.934
756 HA VAL 105 HA VAL 105 5.217 -2.680 6.743
757 HB VAL 105 HB VAL 105 2.954 -2.248 5.808
758 1HG1 VAL 105 1HG1 VAL 105 1.988 -3.773 4.198
759 2HG1 VAL 105 2HG1 VAL 105 3.529 -4.619 4.051
760 3HG1 VAL 105 3HG1 VAL 105 3.385 -2.946 3.507
761 1HG2 VAL 105 1HG2 VAL 105 3.765 -4.918 6.831
762 2HG2 VAL 105 2HG2 VAL 105 2.097 -4.673 6.312
763 3HG2 VAL 105 3HG2 VAL 105 2.775 -3.663 7.586
764 H TYR 106 H TYR 106 6.085 -4.559 7.304
765 HA TYR 106 HA TYR 106 6.966 -6.354 5.166
766 1HB TYR 106 2HB TYR 106 7.951 -6.050 8.003
767 2HB TYR 106 1HB TYR 106 8.416 -7.370 6.936
768 HD1 TYR 106 1HD TYR 106 9.470 -6.726 4.676
769 HD2 TYR 106 2HD TYR 106 9.169 -4.070 7.981
770 HE1 TYR 106 1HE TYR 106 11.256 -5.344 3.715
771 HE2 TYR 106 2HE TYR 106 10.956 -2.681 7.035
772 HH TYR 106 HH TYR 106 12.840 -2.890 5.462
773 H LEU 107 H LEU 107 5.708 -7.954 4.817
774 HA LEU 107 HA LEU 107 4.178 -9.109 7.041
775 1HB LEU 107 2HB LEU 107 3.280 -8.450 4.250
776 2HB LEU 107 1HB LEU 107 2.342 -9.427 5.358
777 HG LEU 107 HG LEU 107 3.146 -6.578 5.891
778 1HD1 LEU 107 1HD1 LEU 107 0.859 -6.007 5.234
779 2HD1 LEU 107 2HD1 LEU 107 0.592 -7.675 4.732
780 3HD1 LEU 107 3HD1 LEU 107 1.776 -6.679 3.886
781 1HD2 LEU 107 1HD2 LEU 107 2.592 -7.918 7.859
782 2HD2 LEU 107 2HD2 LEU 107 1.054 -8.363 7.117
783 3HD2 LEU 107 3HD2 LEU 107 1.370 -6.682 7.549
784 H LYS 108 H LYS 108 3.465 -11.321 6.582
785 HA LYS 108 HA LYS 108 5.111 -12.666 4.539
786 1HB LYS 108 2HB LYS 108 5.625 -13.229 6.964
787 2HB LYS 108 1HB LYS 108 4.018 -13.934 7.054
788 1HG LYS 108 2HG LYS 108 4.629 -15.464 5.216
789 2HG LYS 108 1HG LYS 108 6.270 -14.811 5.260
790 1HD LYS 108 2HD LYS 108 6.341 -15.442 7.698
791 2HD LYS 108 1HD LYS 108 4.833 -16.315 7.439
792 1HE LYS 108 2HE LYS 108 7.421 -16.829 5.979
793 2HE LYS 108 1HE LYS 108 6.811 -17.779 7.331
794 1HZ LYS 108 1HZ LYS 108 6.254 -18.911 5.344
795 2HZ LYS 108 2HZ LYS 108 5.619 -17.517 4.631
796 3HZ LYS 108 3HZ LYS 108 4.814 -18.241 5.937
797 H ALA 109 H ALA 109 3.888 -13.361 2.893
798 HA ALA 109 HA ALA 109 0.990 -13.447 3.316
799 1HB ALA 109 1HB ALA 109 2.509 -13.107 0.736
800 2HB ALA 109 2HB ALA 109 1.788 -11.798 1.671
801 3HB ALA 109 3HB ALA 109 0.759 -13.027 0.935
802 H ASN 110 H ASN 110 0.207 -15.385 3.595
803 HA ASN 110 HA ASN 110 0.735 -17.618 2.001
804 1HB ASN 110 2HB ASN 110 2.208 -18.952 3.397
805 2HB ASN 110 1HB ASN 110 3.016 -17.449 2.980
806 1HD2 ASN 110 1HD2 ASN 110 1.606 -15.833 4.912
807 2HD2 ASN 110 2HD2 ASN 110 2.220 -16.273 6.464
Start of MODEL 9
1 H HIS 3 H HIS 3 -6.436 -10.262 4.650
2 HA HIS 3 HA HIS 3 -5.543 -9.284 7.254
3 1HB HIS 3 2HB HIS 3 -3.726 -10.782 6.827
4 2HB HIS 3 1HB HIS 3 -3.784 -10.446 5.093
5 HD1 HIS 3 1HD HIS 3 -2.942 -8.568 8.294
6 HD2 HIS 3 2HD HIS 3 -1.834 -8.771 4.287
7 HE1 HIS 3 1HE HIS 3 -1.112 -6.870 8.015
8 HE2 HIS 3 2HE HIS 3 -0.587 -6.878 5.549
9 H LYS 4 H LYS 4 -4.886 -7.076 7.181
10 HA LYS 4 HA LYS 4 -4.766 -5.783 4.575
11 1HB LYS 4 2HB LYS 4 -6.411 -4.040 5.252
12 2HB LYS 4 1HB LYS 4 -7.112 -5.635 5.009
13 1HG LYS 4 2HG LYS 4 -7.028 -5.965 7.479
14 2HG LYS 4 1HG LYS 4 -6.526 -4.278 7.628
15 1HD LYS 4 2HD LYS 4 -8.589 -3.578 6.496
16 2HD LYS 4 1HD LYS 4 -9.089 -5.265 6.375
17 1HE LYS 4 2HE LYS 4 -10.203 -4.196 8.241
18 2HE LYS 4 1HE LYS 4 -9.081 -5.425 8.825
19 1HZ LYS 4 1HZ LYS 4 -8.970 -3.366 10.117
20 2HZ LYS 4 2HZ LYS 4 -8.517 -2.508 8.724
21 3HZ LYS 4 3HZ LYS 4 -7.492 -3.706 9.356
22 H VAL 5 H VAL 5 -3.724 -3.767 4.578
23 HA VAL 5 HA VAL 5 -2.466 -3.027 7.132
24 HB VAL 5 HB VAL 5 -1.218 -3.363 4.449
25 1HG1 VAL 5 1HG1 VAL 5 0.614 -1.793 5.075
26 2HG1 VAL 5 2HG1 VAL 5 -0.448 -1.150 6.329
27 3HG1 VAL 5 3HG1 VAL 5 -0.907 -1.012 4.635
28 1HG2 VAL 5 1HG2 VAL 5 -0.839 -4.889 6.357
29 2HG2 VAL 5 2HG2 VAL 5 -0.126 -3.538 7.251
30 3HG2 VAL 5 3HG2 VAL 5 0.639 -4.122 5.771
31 H THR 6 H THR 6 -2.593 -1.033 7.791
32 HA THR 6 HA THR 6 -3.492 1.081 5.972
33 HB THR 6 HB THR 6 -4.191 2.142 8.288
34 HG1 THR 6 1HG THR 6 -4.660 0.643 9.833
35 1HG2 THR 6 1HG2 THR 6 -5.727 -0.004 6.821
36 2HG2 THR 6 2HG2 THR 6 -5.719 1.725 6.462
37 3HG2 THR 6 3HG2 THR 6 -6.441 1.136 7.963
38 H LYS 7 H LYS 7 -2.852 3.330 6.983
39 HA LYS 7 HA LYS 7 -0.313 3.848 6.312
40 1HB LYS 7 2HB LYS 7 -1.966 5.563 6.811
41 2HB LYS 7 1HB LYS 7 -1.762 5.269 8.533
42 1HG LYS 7 2HG LYS 7 -0.528 7.253 7.667
43 2HG LYS 7 1HG LYS 7 0.485 6.061 8.483
44 1HD LYS 7 2HD LYS 7 1.169 5.145 6.335
45 2HD LYS 7 1HD LYS 7 0.135 6.289 5.489
46 1HE LYS 7 2HE LYS 7 2.636 6.820 7.084
47 2HE LYS 7 1HE LYS 7 2.330 7.179 5.386
48 1HZ LYS 7 1HZ LYS 7 0.633 8.807 6.167
49 2HZ LYS 7 2HZ LYS 7 2.219 9.202 6.595
50 3HZ LYS 7 3HZ LYS 7 1.168 8.544 7.754
51 H ALA 8 H ALA 8 -1.191 3.099 9.728
52 HA ALA 8 HA ALA 8 1.282 3.679 10.872
53 1HB ALA 8 1HB ALA 8 -0.631 1.512 11.721
54 2HB ALA 8 2HB ALA 8 -0.757 3.218 12.153
55 3HB ALA 8 3HB ALA 8 0.611 2.262 12.724
56 H HIS 9 H HIS 9 0.252 0.827 9.155
57 HA HIS 9 HA HIS 9 2.385 -0.883 9.876
58 1HB HIS 9 2HB HIS 9 0.640 -0.847 7.429
59 2HB HIS 9 1HB HIS 9 1.806 -2.112 7.774
60 HD1 HIS 9 1HD HIS 9 -1.530 -0.813 8.778
61 HD2 HIS 9 2HD HIS 9 1.025 -3.930 9.771
62 HE1 HIS 9 1HE HIS 9 -2.994 -2.580 9.798
63 HE2 HIS 9 2HE HIS 9 -1.411 -4.419 10.512
64 H ASN 10 H ASN 10 2.453 1.967 8.182
65 HA ASN 10 HA ASN 10 4.290 1.806 6.176
66 1HB ASN 10 2HB ASN 10 3.330 3.934 6.988
67 2HB ASN 10 1HB ASN 10 4.304 3.816 8.455
68 1HD2 ASN 10 1HD2 ASN 10 4.216 4.655 5.141
69 2HD2 ASN 10 2HD2 ASN 10 5.829 5.261 5.011
70 H GLY 11 H GLY 11 4.691 0.978 9.488
71 1HA GLY 11 2HA GLY 11 7.469 0.174 8.937
72 2HA GLY 11 1HA GLY 11 7.147 1.138 10.375
73 H ALA 12 H ALA 12 5.565 -1.654 8.801
74 HA ALA 12 HA ALA 12 5.410 -2.900 11.480
75 1HB ALA 12 1HB ALA 12 3.391 -4.093 10.423
76 2HB ALA 12 2HB ALA 12 3.485 -2.829 9.187
77 3HB ALA 12 3HB ALA 12 3.224 -2.395 10.876
78 H THR 13 H THR 13 5.554 -5.158 11.652
79 HA THR 13 HA THR 13 6.220 -6.740 9.289
80 HB THR 13 HB THR 13 7.941 -6.794 11.787
81 HG1 THR 13 1HG THR 13 8.038 -5.224 9.581
82 1HG2 THR 13 1HG2 THR 13 9.378 -8.286 10.448
83 2HG2 THR 13 2HG2 THR 13 8.187 -8.246 9.147
84 3HG2 THR 13 3HG2 THR 13 7.771 -8.971 10.700
85 H LEU 14 H LEU 14 4.760 -8.372 9.350
86 HA LEU 14 HA LEU 14 4.255 -9.855 11.748
87 1HB LEU 14 2HB LEU 14 1.918 -9.369 12.027
88 2HB LEU 14 1HB LEU 14 2.852 -7.903 12.170
89 HG LEU 14 HG LEU 14 0.889 -7.297 11.051
90 1HD1 LEU 14 1HD1 LEU 14 2.991 -7.659 8.938
91 2HD1 LEU 14 2HD1 LEU 14 2.806 -6.286 10.030
92 3HD1 LEU 14 3HD1 LEU 14 1.575 -6.611 8.810
93 1HD2 LEU 14 1HD2 LEU 14 0.032 -9.464 10.474
94 2HD2 LEU 14 2HD2 LEU 14 1.262 -9.658 9.226
95 3HD2 LEU 14 3HD2 LEU 14 0.017 -8.422 9.052
96 H THR 15 H THR 15 2.477 -11.548 11.368
97 HA THR 15 HA THR 15 2.973 -12.674 8.702
98 HB THR 15 HB THR 15 1.993 -14.019 11.230
99 HG1 THR 15 1HG THR 15 4.114 -13.635 11.550
100 1HG2 THR 15 1HG2 THR 15 2.854 -15.258 8.617
101 2HG2 THR 15 2HG2 THR 15 1.176 -15.042 9.121
102 3HG2 THR 15 3HG2 THR 15 2.250 -16.106 10.044
103 H VAL 16 H VAL 16 1.298 -13.504 7.433
104 HA VAL 16 HA VAL 16 -1.439 -12.893 8.324
105 HB VAL 16 HB VAL 16 -2.025 -11.834 6.329
106 1HG1 VAL 16 1HG1 VAL 16 0.826 -11.033 6.895
107 2HG1 VAL 16 2HG1 VAL 16 -0.617 -10.426 7.709
108 3HG1 VAL 16 3HG1 VAL 16 -0.350 -10.068 6.003
109 1HG2 VAL 16 1HG2 VAL 16 -0.683 -11.802 4.296
110 2HG2 VAL 16 2HG2 VAL 16 -1.076 -13.455 4.773
111 3HG2 VAL 16 3HG2 VAL 16 0.537 -12.809 5.078
112 H ALA 17 H ALA 17 -3.086 -14.115 7.234
113 HA ALA 17 HA ALA 17 -2.126 -16.461 5.726
114 1HB ALA 17 1HB ALA 17 -4.365 -17.442 6.366
115 2HB ALA 17 2HB ALA 17 -4.561 -16.065 7.456
116 3HB ALA 17 3HB ALA 17 -3.242 -17.208 7.707
117 H VAL 18 H VAL 18 -2.984 -16.696 3.646
118 HA VAL 18 HA VAL 18 -4.946 -14.621 2.909
119 HB VAL 18 HB VAL 18 -3.094 -15.710 0.834
120 1HG1 VAL 18 1HG1 VAL 18 -4.939 -14.282 0.155
121 2HG1 VAL 18 2HG1 VAL 18 -3.399 -13.469 -0.120
122 3HG1 VAL 18 3HG1 VAL 18 -4.396 -13.020 1.263
123 1HG2 VAL 18 1HG2 VAL 18 -2.332 -13.352 2.544
124 2HG2 VAL 18 2HG2 VAL 18 -1.351 -14.193 1.330
125 3HG2 VAL 18 3HG2 VAL 18 -1.747 -14.982 2.859
126 H GLY 19 H GLY 19 -5.308 -15.568 0.277
127 1HA GLY 19 2HA GLY 19 -6.168 -17.723 -0.651
128 2HA GLY 19 1HA GLY 19 -6.912 -17.963 0.927
129 H GLU 20 H GLU 20 -8.010 -15.633 1.546
130 HA GLU 20 HA GLU 20 -10.082 -15.239 -0.435
131 1HB GLU 20 2HB GLU 20 -9.649 -13.781 2.184
132 2HB GLU 20 1HB GLU 20 -11.112 -13.759 1.202
133 1HG GLU 20 2HG GLU 20 -11.120 -16.316 1.567
134 2HG GLU 20 1HG GLU 20 -10.010 -15.960 2.891
135 H LEU 21 H LEU 21 -8.176 -12.909 1.420
136 HA LEU 21 HA LEU 21 -7.101 -11.608 -0.868
137 1HB LEU 21 2HB LEU 21 -9.373 -10.737 -1.044
138 2HB LEU 21 1HB LEU 21 -9.351 -10.266 0.641
139 HG LEU 21 HG LEU 21 -7.543 -8.632 0.114
140 1HD1 LEU 21 1HD1 LEU 21 -8.175 -9.326 -2.749
141 2HD1 LEU 21 2HD1 LEU 21 -6.682 -9.729 -1.900
142 3HD1 LEU 21 3HD1 LEU 21 -7.102 -8.040 -2.191
143 1HD2 LEU 21 1HD2 LEU 21 -10.118 -8.335 -1.419
144 2HD2 LEU 21 2HD2 LEU 21 -9.016 -7.022 -1.014
145 3HD2 LEU 21 3HD2 LEU 21 -9.845 -7.903 0.268
146 H VAL 22 H VAL 22 -5.414 -10.286 -0.320
147 HA VAL 22 HA VAL 22 -5.212 -9.588 2.521
148 HB VAL 22 HB VAL 22 -3.222 -10.907 0.787
149 1HG1 VAL 22 1HG1 VAL 22 -2.431 -8.558 2.515
150 2HG1 VAL 22 2HG1 VAL 22 -2.090 -8.799 0.803
151 3HG1 VAL 22 3HG1 VAL 22 -1.305 -9.818 2.010
152 1HG2 VAL 22 1HG2 VAL 22 -4.144 -11.938 2.770
153 2HG2 VAL 22 2HG2 VAL 22 -3.550 -10.612 3.768
154 3HG2 VAL 22 3HG2 VAL 22 -2.411 -11.689 2.962
155 H GLU 23 H GLU 23 -5.227 -7.464 2.873
156 HA GLU 23 HA GLU 23 -5.056 -5.757 0.496
157 1HB GLU 23 2HB GLU 23 -6.391 -5.264 3.154
158 2HB GLU 23 1HB GLU 23 -6.331 -4.113 1.827
159 1HG GLU 23 2HG GLU 23 -7.583 -5.709 0.432
160 2HG GLU 23 1HG GLU 23 -7.702 -6.789 1.823
161 H ILE 24 H ILE 24 -4.006 -3.882 0.482
162 HA ILE 24 HA ILE 24 -2.530 -2.962 2.844
163 HB ILE 24 HB ILE 24 -1.519 -2.880 -0.022
164 1HG1 ILE 24 2HG1 ILE 24 -1.323 -5.136 0.986
165 2HG1 ILE 24 1HG1 ILE 24 0.249 -4.407 0.663
166 1HG2 ILE 24 1HG2 ILE 24 -0.239 -1.893 2.519
167 2HG2 ILE 24 2HG2 ILE 24 -0.879 -0.902 1.207
168 3HG2 ILE 24 3HG2 ILE 24 0.531 -1.928 0.932
169 1HD1 ILE 24 1HD1 ILE 24 0.400 -3.788 3.055
170 2HD1 ILE 24 2HD1 ILE 24 0.293 -5.527 2.791
171 3HD1 ILE 24 3HD1 ILE 24 -1.126 -4.630 3.340
172 H GLN 25 H GLN 25 -2.893 -0.728 3.163
173 HA GLN 25 HA GLN 25 -3.947 0.790 0.904
174 1HB GLN 25 2HB GLN 25 -5.960 0.063 1.863
175 2HB GLN 25 1HB GLN 25 -5.406 0.371 3.509
176 1HG GLN 25 2HG GLN 25 -5.495 2.691 1.710
177 2HG GLN 25 1HG GLN 25 -7.053 1.963 2.071
178 1HE2 GLN 25 1HE2 GLN 25 -4.272 2.229 4.293
179 2HE2 GLN 25 2HE2 GLN 25 -5.084 3.266 5.416
180 H LEU 26 H LEU 26 -3.394 2.869 0.884
181 HA LEU 26 HA LEU 26 -2.253 3.918 3.346
182 1HB LEU 26 2HB LEU 26 -1.475 4.411 0.502
183 2HB LEU 26 1HB LEU 26 -1.229 5.673 1.686
184 HG LEU 26 HG LEU 26 0.815 4.445 1.359
185 1HD1 LEU 26 1HD1 LEU 26 -0.474 3.888 4.015
186 2HD1 LEU 26 2HD1 LEU 26 0.486 5.302 3.563
187 3HD1 LEU 26 3HD1 LEU 26 1.249 3.715 3.680
188 1HD2 LEU 26 1HD2 LEU 26 1.003 2.075 1.959
189 2HD2 LEU 26 2HD2 LEU 26 -0.077 2.333 0.587
190 3HD2 LEU 26 3HD2 LEU 26 -0.744 2.008 2.187
191 HA PRO 27 HA PRO 27 -5.568 6.847 3.146
192 1HB PRO 27 2HB PRO 27 -4.768 8.558 5.002
193 2HB PRO 27 1HB PRO 27 -5.183 6.896 5.452
194 1HG PRO 27 2HG PRO 27 -2.464 8.088 4.963
195 2HG PRO 27 1HG PRO 27 -2.999 7.058 6.308
196 1HD PRO 27 2HD PRO 27 -1.660 6.120 4.129
197 2HD PRO 27 1HD PRO 27 -2.812 5.141 5.057
198 H SER 28 H SER 28 -2.786 7.194 1.679
199 HA SER 28 HA SER 28 -1.866 8.609 0.217
200 1HB SER 28 2HB SER 28 -4.287 9.032 -0.449
201 2HB SER 28 1HB SER 28 -4.191 10.476 0.568
202 HG SER 28 HG SER 28 -2.454 9.889 -1.613
203 H ASN 29 H ASN 29 -3.227 10.268 2.995
204 HA ASN 29 HA ASN 29 -2.645 12.204 4.043
205 1HB ASN 29 2HB ASN 29 -0.167 12.166 4.768
206 2HB ASN 29 1HB ASN 29 -1.251 10.959 5.391
207 1HD2 ASN 29 1HD2 ASN 29 -1.061 8.828 4.637
208 2HD2 ASN 29 2HD2 ASN 29 0.392 8.262 3.886
209 HA PRO 30 HA PRO 30 -1.495 14.145 0.098
210 1HB PRO 30 2HB PRO 30 -3.326 16.238 1.106
211 2HB PRO 30 1HB PRO 30 -3.359 15.353 -0.428
212 1HG PRO 30 2HG PRO 30 -5.156 14.821 1.458
213 2HG PRO 30 1HG PRO 30 -4.421 13.509 0.518
214 1HD PRO 30 2HD PRO 30 -3.718 14.453 3.276
215 2HD PRO 30 1HD PRO 30 -3.990 12.795 2.691
216 H THR 31 H THR 31 0.495 14.934 0.217
217 HA THR 31 HA THR 31 0.892 17.422 1.695
218 HB THR 31 HB THR 31 1.639 15.952 3.342
219 HG1 THR 31 1HG THR 31 3.763 16.466 3.519
220 1HG2 THR 31 1HG2 THR 31 1.594 13.884 1.960
221 2HG2 THR 31 2HG2 THR 31 3.011 13.989 3.008
222 3HG2 THR 31 3HG2 THR 31 3.163 14.345 1.287
223 H THR 32 H THR 32 1.659 18.853 0.320
224 HA THR 32 HA THR 32 3.050 19.893 -1.164
225 HB THR 32 HB THR 32 4.536 17.260 -1.236
226 HG1 THR 32 1HG THR 32 4.493 18.353 0.811
227 1HG2 THR 32 1HG2 THR 32 5.387 19.989 -2.212
228 2HG2 THR 32 2HG2 THR 32 5.000 18.595 -3.223
229 3HG2 THR 32 3HG2 THR 32 6.405 18.549 -2.156
230 H GLY 33 H GLY 33 2.110 16.648 -2.021
231 1HA GLY 33 2HA GLY 33 0.749 16.987 -4.365
232 2HA GLY 33 1HA GLY 33 2.446 16.955 -4.836
233 H PHE 34 H PHE 34 3.011 15.021 -5.473
234 HA PHE 34 HA PHE 34 3.653 12.838 -5.279
235 1HB PHE 34 2HB PHE 34 2.797 13.106 -2.389
236 2HB PHE 34 1HB PHE 34 3.889 11.909 -3.065
237 HD1 PHE 34 1HD PHE 34 4.512 13.605 -0.712
238 HD2 PHE 34 2HD PHE 34 5.201 14.249 -4.859
239 HE1 PHE 34 1HE PHE 34 6.416 15.060 -0.167
240 HE2 PHE 34 2HE PHE 34 7.106 15.702 -4.320
241 HZ PHE 34 HZ PHE 34 7.720 16.110 -1.971
242 H ALA 35 H ALA 35 2.844 10.655 -4.481
243 HA ALA 35 HA ALA 35 0.190 10.232 -3.662
244 1HB ALA 35 1HB ALA 35 -0.359 10.845 -5.986
245 2HB ALA 35 2HB ALA 35 -0.678 9.135 -5.698
246 3HB ALA 35 3HB ALA 35 0.768 9.624 -6.581
247 H TRP 36 H TRP 36 -0.056 7.994 -3.086
248 HA TRP 36 HA TRP 36 2.495 6.699 -2.779
249 1HB TRP 36 2HB TRP 36 -0.253 5.722 -1.991
250 2HB TRP 36 1HB TRP 36 1.262 4.895 -1.635
251 HD1 TRP 36 HD TRP 36 -0.853 7.861 -0.467
252 HE1 TRP 36 1HE TRP 36 0.046 8.614 1.810
253 HE3 TRP 36 3HE TRP 36 3.423 5.072 -0.316
254 HZ2 TRP 36 2HZ TRP 36 2.242 8.081 3.475
255 HZ3 TRP 36 3HZ TRP 36 4.884 5.264 1.652
256 HH2 TRP 36 HH TRP 36 4.305 6.742 3.515
257 H TYR 37 H TYR 37 3.244 6.050 -4.704
258 HA TYR 37 HA TYR 37 1.766 3.858 -6.004
259 1HB TYR 37 2HB TYR 37 4.087 5.576 -6.903
260 2HB TYR 37 1HB TYR 37 3.696 4.059 -7.698
261 HD1 TYR 37 1HD TYR 37 2.584 7.530 -7.108
262 HD2 TYR 37 2HD TYR 37 1.767 3.828 -9.063
263 HE1 TYR 37 1HE TYR 37 0.922 8.652 -8.531
264 HE2 TYR 37 2HE TYR 37 0.102 4.948 -10.491
265 HH TYR 37 HH TYR 37 -1.137 6.834 -10.746
266 H PHE 38 H PHE 38 3.469 2.026 -6.683
267 HA PHE 38 HA PHE 38 4.982 1.239 -4.434
268 1HB PHE 38 2HB PHE 38 4.507 0.249 -7.125
269 2HB PHE 38 1HB PHE 38 6.161 -0.001 -6.594
270 HD1 PHE 38 1HD PHE 38 2.715 -1.008 -6.244
271 HD2 PHE 38 2HD PHE 38 6.593 -1.302 -4.521
272 HE1 PHE 38 1HE PHE 38 1.990 -2.975 -4.951
273 HE2 PHE 38 2HE PHE 38 5.879 -3.261 -3.231
274 HZ PHE 38 HZ PHE 38 3.515 -4.053 -3.414
275 H GLU 39 H GLU 39 6.279 2.027 -7.657
276 HA GLU 39 HA GLU 39 8.126 3.892 -6.359
277 1HB GLU 39 2HB GLU 39 9.987 3.099 -7.743
278 2HB GLU 39 1HB GLU 39 9.380 1.832 -6.690
279 1HG GLU 39 2HG GLU 39 8.091 0.935 -8.612
280 2HG GLU 39 1HG GLU 39 8.885 2.128 -9.639
281 H GLY 40 H GLY 40 5.650 3.761 -8.279
282 1HA GLY 40 2HA GLY 40 5.077 5.875 -9.347
283 2HA GLY 40 1HA GLY 40 6.709 5.922 -9.990
284 H GLY 41 H GLY 41 3.525 5.224 -10.650
285 1HA GLY 41 2HA GLY 41 2.486 4.482 -12.556
286 2HA GLY 41 1HA GLY 41 4.061 4.482 -13.330
287 H THR 42 H THR 42 4.213 2.595 -10.594
288 HA THR 42 HA THR 42 3.430 0.158 -11.998
289 HB THR 42 HB THR 42 5.564 -0.880 -11.010
290 HG1 THR 42 1HG THR 42 7.195 0.456 -10.566
291 1HG2 THR 42 1HG2 THR 42 6.785 -0.426 -13.088
292 2HG2 THR 42 2HG2 THR 42 5.680 0.901 -13.445
293 3HG2 THR 42 3HG2 THR 42 5.080 -0.758 -13.390
294 H LYS 43 H LYS 43 2.748 -1.469 -10.776
295 HA LYS 43 HA LYS 43 3.535 -1.517 -7.980
296 1HB LYS 43 2HB LYS 43 1.289 -2.146 -7.246
297 2HB LYS 43 1HB LYS 43 1.337 -0.515 -7.878
298 1HG LYS 43 2HG LYS 43 0.445 -2.856 -9.538
299 2HG LYS 43 1HG LYS 43 -0.656 -1.962 -8.492
300 1HD LYS 43 2HD LYS 43 -0.639 -0.112 -9.825
301 2HD LYS 43 1HD LYS 43 1.014 -0.394 -10.381
302 1HE LYS 43 2HE LYS 43 0.246 -2.209 -11.803
303 2HE LYS 43 1HE LYS 43 -1.403 -1.999 -11.212
304 1HZ LYS 43 1HZ LYS 43 -0.419 0.462 -12.193
305 2HZ LYS 43 2HZ LYS 43 -1.743 -0.449 -12.736
306 3HZ LYS 43 3HZ LYS 43 -0.197 -0.740 -13.371
307 H GLU 44 H GLU 44 4.329 -3.450 -7.496
308 HA GLU 44 HA GLU 44 3.252 -5.791 -8.913
309 1HB GLU 44 2HB GLU 44 5.496 -6.793 -8.913
310 2HB GLU 44 1HB GLU 44 5.454 -5.297 -9.832
311 1HG GLU 44 2HG GLU 44 6.348 -5.317 -6.977
312 2HG GLU 44 1HG GLU 44 7.450 -5.760 -8.277
313 H SER 45 H SER 45 3.027 -7.655 -7.742
314 HA SER 45 HA SER 45 3.427 -7.386 -4.825
315 1HB SER 45 2HB SER 45 1.055 -7.616 -5.548
316 2HB SER 45 1HB SER 45 1.455 -9.154 -6.310
317 HG SER 45 HG SER 45 1.564 -10.097 -4.412
318 HA PRO 46 HA PRO 46 6.465 -10.624 -5.231
319 1HB PRO 46 2HB PRO 46 5.726 -11.262 -2.435
320 2HB PRO 46 1HB PRO 46 7.301 -10.830 -3.109
321 1HG PRO 46 2HG PRO 46 5.925 -9.104 -1.603
322 2HG PRO 46 1HG PRO 46 6.871 -8.555 -3.000
323 1HD PRO 46 2HD PRO 46 3.917 -8.971 -2.751
324 2HD PRO 46 1HD PRO 46 4.799 -7.666 -3.571
325 H ASN 47 H ASN 47 6.197 -12.553 -6.094
326 HA ASN 47 HA ASN 47 5.497 -14.660 -6.512
327 1HB ASN 47 2HB ASN 47 4.082 -14.344 -3.885
328 2HB ASN 47 1HB ASN 47 3.988 -15.818 -4.837
329 1HD2 ASN 47 1HD2 ASN 47 5.115 -15.319 -2.177
330 2HD2 ASN 47 2HD2 ASN 47 6.762 -15.847 -2.263
331 H GLU 48 H GLU 48 4.064 -12.301 -7.525
332 HA GLU 48 HA GLU 48 1.313 -13.164 -7.695
333 1HB GLU 48 2HB GLU 48 0.960 -11.211 -9.097
334 2HB GLU 48 1HB GLU 48 1.860 -10.778 -7.652
335 1HG GLU 48 2HG GLU 48 3.876 -10.546 -8.859
336 2HG GLU 48 1HG GLU 48 3.179 -11.295 -10.296
337 H SER 49 H SER 49 2.826 -15.208 -8.517
338 HA SER 49 HA SER 49 3.295 -15.187 -11.358
339 1HB SER 49 2HB SER 49 3.304 -17.630 -9.601
340 2HB SER 49 1HB SER 49 4.287 -17.291 -11.026
341 HG SER 49 HG SER 49 5.056 -15.427 -9.580
342 H MET 50 H MET 50 0.693 -15.944 -9.296
343 HA MET 50 HA MET 50 -0.847 -17.020 -11.541
344 1HB MET 50 2HB MET 50 -1.920 -18.657 -9.960
345 2HB MET 50 1HB MET 50 -0.258 -19.000 -10.405
346 1HG MET 50 2HG MET 50 0.517 -18.110 -8.278
347 2HG MET 50 1HG MET 50 -1.142 -17.701 -7.835
348 1HE MET 50 1HE MET 50 -0.105 -20.713 -5.484
349 2HE MET 50 2HE MET 50 -0.616 -19.025 -5.530
350 3HE MET 50 3HE MET 50 0.980 -19.481 -6.127
351 H PHE 51 H PHE 51 -0.725 -15.632 -8.371
352 HA PHE 51 HA PHE 51 -3.417 -14.526 -8.663
353 1HB PHE 51 2HB PHE 51 -1.704 -15.329 -6.359
354 2HB PHE 51 1HB PHE 51 -2.809 -13.981 -6.111
355 HD1 PHE 51 1HD PHE 51 -2.834 -17.409 -7.591
356 HD2 PHE 51 2HD PHE 51 -4.901 -14.482 -5.285
357 HE1 PHE 51 1HE PHE 51 -4.657 -19.012 -7.188
358 HE2 PHE 51 2HE PHE 51 -6.724 -16.084 -4.881
359 HZ PHE 51 HZ PHE 51 -6.658 -18.298 -5.868
360 H THR 52 H THR 52 -3.474 -12.138 -7.595
361 HA THR 52 HA THR 52 -1.142 -10.655 -8.448
362 HB THR 52 HB THR 52 -2.360 -11.340 -10.564
363 HG1 THR 52 1HG THR 52 -1.072 -9.718 -11.020
364 1HG2 THR 52 1HG2 THR 52 -4.654 -10.999 -9.805
365 2HG2 THR 52 2HG2 THR 52 -4.304 -9.985 -11.205
366 3HG2 THR 52 3HG2 THR 52 -4.340 -9.277 -9.591
367 H VAL 53 H VAL 53 -1.562 -8.273 -8.487
368 HA VAL 53 HA VAL 53 -3.169 -7.566 -6.135
369 HB VAL 53 HB VAL 53 -0.844 -7.069 -5.834
370 1HG1 VAL 53 1HG1 VAL 53 0.415 -5.613 -7.359
371 2HG1 VAL 53 2HG1 VAL 53 -0.971 -5.575 -8.448
372 3HG1 VAL 53 3HG1 VAL 53 -0.126 -7.094 -8.150
373 1HG2 VAL 53 1HG2 VAL 53 -2.280 -4.508 -6.528
374 2HG2 VAL 53 2HG2 VAL 53 -0.846 -4.646 -5.511
375 3HG2 VAL 53 3HG2 VAL 53 -2.372 -5.359 -4.986
376 H GLU 54 H GLU 54 -4.675 -5.972 -6.183
377 HA GLU 54 HA GLU 54 -5.110 -4.505 -8.706
378 1HB GLU 54 2HB GLU 54 -7.486 -4.282 -7.948
379 2HB GLU 54 1HB GLU 54 -7.002 -5.933 -8.303
380 1HG GLU 54 2HG GLU 54 -7.466 -6.611 -6.242
381 2HG GLU 54 1HG GLU 54 -6.570 -5.275 -5.522
382 H ASN 55 H ASN 55 -5.341 -2.285 -8.585
383 HA ASN 55 HA ASN 55 -4.549 -1.157 -5.975
384 1HB ASN 55 2HB ASN 55 -3.429 0.629 -7.204
385 2HB ASN 55 1HB ASN 55 -2.824 -0.945 -7.703
386 1HD2 ASN 55 1HD2 ASN 55 -3.263 -1.694 -9.772
387 2HD2 ASN 55 2HD2 ASN 55 -3.872 -0.653 -11.018
388 H LYS 56 H LYS 56 -5.306 0.998 -5.457
389 HA LYS 56 HA LYS 56 -7.372 2.226 -7.041
390 1HB LYS 56 2HB LYS 56 -8.990 2.293 -5.124
391 2HB LYS 56 1HB LYS 56 -8.838 0.722 -5.882
392 1HG LYS 56 2HG LYS 56 -7.309 1.455 -3.421
393 2HG LYS 56 1HG LYS 56 -8.985 0.919 -3.332
394 1HD LYS 56 2HD LYS 56 -6.749 -0.646 -4.608
395 2HD LYS 56 1HD LYS 56 -7.327 -0.873 -2.956
396 1HE LYS 56 2HE LYS 56 -8.376 -2.533 -4.230
397 2HE LYS 56 1HE LYS 56 -9.606 -1.313 -3.938
398 1HZ LYS 56 1HZ LYS 56 -9.616 -0.665 -6.130
399 2HZ LYS 56 2HZ LYS 56 -9.311 -2.328 -6.293
400 3HZ LYS 56 3HZ LYS 56 -8.044 -1.216 -6.434
401 H TYR 57 H TYR 57 -6.905 4.374 -6.930
402 HA TYR 57 HA TYR 57 -5.717 5.323 -4.409
403 1HB TYR 57 2HB TYR 57 -4.934 6.577 -6.976
404 2HB TYR 57 1HB TYR 57 -4.090 6.581 -5.440
405 HD1 TYR 57 1HD TYR 57 -3.585 5.594 -8.623
406 HD2 TYR 57 2HD TYR 57 -3.749 3.867 -4.732
407 HE1 TYR 57 1HE TYR 57 -2.170 3.733 -9.388
408 HE2 TYR 57 2HE TYR 57 -2.326 2.014 -5.485
409 HH TYR 57 HH TYR 57 -1.690 0.895 -7.540
410 H PHE 58 H PHE 58 -7.255 6.529 -3.509
411 HA PHE 58 HA PHE 58 -8.684 8.403 -5.257
412 1HB PHE 58 2HB PHE 58 -9.902 6.301 -4.272
413 2HB PHE 58 1HB PHE 58 -9.957 7.272 -2.797
414 HD1 PHE 58 1HD PHE 58 -11.694 8.762 -2.508
415 HD2 PHE 58 2HD PHE 58 -10.655 7.454 -6.411
416 HE1 PHE 58 1HE PHE 58 -13.635 9.985 -3.415
417 HE2 PHE 58 2HE PHE 58 -12.603 8.668 -7.342
418 HZ PHE 58 HZ PHE 58 -14.089 9.936 -5.836
419 HA PRO 59 HA PRO 59 -6.792 11.295 -2.275
420 1HB PRO 59 2HB PRO 59 -8.102 13.096 -4.264
421 2HB PRO 59 1HB PRO 59 -6.478 13.180 -3.566
422 1HG PRO 59 2HG PRO 59 -6.758 12.326 -6.043
423 2HG PRO 59 1HG PRO 59 -5.670 11.455 -4.936
424 1HD PRO 59 2HD PRO 59 -8.479 10.758 -5.756
425 2HD PRO 59 1HD PRO 59 -7.046 9.709 -5.669
426 HA PRO 60 HA PRO 60 -9.973 12.463 0.467
427 1HB PRO 60 2HB PRO 60 -9.566 15.345 -0.053
428 2HB PRO 60 1HB PRO 60 -9.528 14.449 1.466
429 1HG PRO 60 2HG PRO 60 -7.278 15.284 0.262
430 2HG PRO 60 1HG PRO 60 -7.356 13.789 1.203
431 1HD PRO 60 2HD PRO 60 -7.184 14.176 -1.727
432 2HD PRO 60 1HD PRO 60 -6.652 12.811 -0.727
433 H ASP 61 H ASP 61 -11.631 14.334 0.860
434 HA ASP 61 HA ASP 61 -13.345 15.037 -1.293
435 1HB ASP 61 2HB ASP 61 -13.635 12.505 -1.150
436 2HB ASP 61 1HB ASP 61 -14.234 12.744 0.491
437 H SER 62 H SER 62 -15.723 14.953 0.287
438 HA SER 62 HA SER 62 -14.961 16.601 2.562
439 1HB SER 62 2HB SER 62 -17.413 17.134 2.674
440 2HB SER 62 1HB SER 62 -16.644 17.620 1.164
441 HG SER 62 HG SER 62 -17.658 16.016 0.095
442 H LYS 63 H LYS 63 -16.820 13.714 1.702
443 HA LYS 63 HA LYS 63 -16.850 13.013 4.562
444 1HB LYS 63 2HB LYS 63 -18.911 11.676 4.033
445 2HB LYS 63 1HB LYS 63 -19.091 13.418 3.920
446 1HG LYS 63 2HG LYS 63 -20.247 12.525 2.082
447 2HG LYS 63 1HG LYS 63 -18.741 13.166 1.431
448 1HD LYS 63 2HD LYS 63 -19.188 11.018 0.432
449 2HD LYS 63 1HD LYS 63 -17.777 10.886 1.500
450 1HE LYS 63 2HE LYS 63 -19.202 9.936 3.249
451 2HE LYS 63 1HE LYS 63 -20.611 10.079 2.201
452 1HZ LYS 63 1HZ LYS 63 -19.449 8.574 0.623
453 2HZ LYS 63 2HZ LYS 63 -19.836 7.852 2.107
454 3HZ LYS 63 3HZ LYS 63 -18.242 8.334 1.795
455 H LEU 64 H LEU 64 -16.020 11.935 1.362
456 HA LEU 64 HA LEU 64 -15.955 9.171 1.691
457 1HB LEU 64 2HB LEU 64 -15.411 10.644 -0.383
458 2HB LEU 64 1HB LEU 64 -13.771 10.643 0.237
459 HG LEU 64 HG LEU 64 -14.174 8.978 -1.565
460 1HD1 LEU 64 1HD1 LEU 64 -13.432 7.805 1.108
461 2HD1 LEU 64 2HD1 LEU 64 -12.347 8.621 -0.017
462 3HD1 LEU 64 3HD1 LEU 64 -13.086 7.084 -0.464
463 1HD2 LEU 64 1HD2 LEU 64 -15.460 6.969 -1.092
464 2HD2 LEU 64 2HD2 LEU 64 -16.479 8.405 -0.996
465 3HD2 LEU 64 3HD2 LEU 64 -15.921 7.620 0.480
466 H LEU 65 H LEU 65 -13.251 11.415 2.084
467 HA LEU 65 HA LEU 65 -12.485 9.976 4.484
468 1HB LEU 65 2HB LEU 65 -11.116 9.406 2.296
469 2HB LEU 65 1HB LEU 65 -10.337 10.934 2.639
470 HG LEU 65 HG LEU 65 -8.991 9.122 3.483
471 1HD1 LEU 65 1HD1 LEU 65 -8.950 11.158 4.791
472 2HD1 LEU 65 2HD1 LEU 65 -8.788 9.750 5.841
473 3HD1 LEU 65 3HD1 LEU 65 -10.328 10.603 5.739
474 1HD2 LEU 65 1HD2 LEU 65 -9.789 7.608 5.225
475 2HD2 LEU 65 2HD2 LEU 65 -10.736 7.445 3.748
476 3HD2 LEU 65 3HD2 LEU 65 -11.394 8.328 5.126
477 H GLY 66 H GLY 66 -11.423 12.635 2.466
478 1HA GLY 66 2HA GLY 66 -11.778 14.913 2.784
479 2HA GLY 66 1HA GLY 66 -12.439 14.559 4.367
480 H ALA 67 H ALA 67 -10.631 13.516 5.843
481 HA ALA 67 HA ALA 67 -8.754 15.490 6.461
482 1HB ALA 67 1HB ALA 67 -9.492 13.778 8.044
483 2HB ALA 67 2HB ALA 67 -7.733 13.810 7.915
484 3HB ALA 67 3HB ALA 67 -8.654 12.544 7.100
485 H GLY 68 H GLY 68 -8.278 12.357 4.933
486 1HA GLY 68 2HA GLY 68 -6.069 13.504 3.389
487 2HA GLY 68 1HA GLY 68 -5.866 11.959 4.209
488 H GLY 69 H GLY 69 -5.445 11.198 2.000
489 1HA GLY 69 2HA GLY 69 -7.866 10.921 0.385
490 2HA GLY 69 1HA GLY 69 -6.228 10.547 -0.139
491 H THR 70 H THR 70 -6.746 8.508 -0.825
492 HA THR 70 HA THR 70 -6.619 6.425 1.084
493 HB THR 70 HB THR 70 -8.866 5.479 -0.148
494 HG1 THR 70 1HG THR 70 -9.004 8.015 -0.625
495 1HG2 THR 70 1HG2 THR 70 -8.745 6.976 2.472
496 2HG2 THR 70 2HG2 THR 70 -8.266 5.294 2.223
497 3HG2 THR 70 3HG2 THR 70 -9.953 5.774 2.012
498 H GLU 71 H GLU 71 -4.837 5.958 -0.182
499 HA GLU 71 HA GLU 71 -5.409 4.939 -2.888
500 1HB GLU 71 2HB GLU 71 -2.747 5.910 -1.824
501 2HB GLU 71 1HB GLU 71 -3.134 5.487 -3.488
502 1HG GLU 71 2HG GLU 71 -4.715 7.363 -3.590
503 2HG GLU 71 1HG GLU 71 -4.286 7.793 -1.934
504 H HIS 72 H HIS 72 -5.595 2.790 -2.762
505 HA HIS 72 HA HIS 72 -4.036 1.411 -0.678
506 1HB HIS 72 2HB HIS 72 -6.377 0.025 -1.847
507 2HB HIS 72 1HB HIS 72 -5.724 -0.019 -0.235
508 HD1 HIS 72 1HD HIS 72 -8.190 0.013 0.555
509 HD2 HIS 72 2HD HIS 72 -6.882 3.489 -1.266
510 HE1 HIS 72 1HE HIS 72 -9.948 1.706 1.014
511 HE2 HIS 72 2HE HIS 72 -9.299 3.711 -0.354
512 H PHE 73 H PHE 73 -3.623 -0.837 -1.076
513 HA PHE 73 HA PHE 73 -3.296 -1.630 -3.881
514 1HB PHE 73 2HB PHE 73 -1.230 -1.550 -1.689
515 2HB PHE 73 1HB PHE 73 -1.049 -2.619 -3.079
516 HD1 PHE 73 1HD PHE 73 -0.325 -1.775 -5.176
517 HD2 PHE 73 2HD PHE 73 -1.283 0.907 -2.016
518 HE1 PHE 73 1HE PHE 73 0.675 0.074 -6.452
519 HE2 PHE 73 2HE PHE 73 -0.287 2.762 -3.290
520 HZ PHE 73 HZ PHE 73 0.700 2.350 -5.502
521 H HIS 74 H HIS 74 -4.678 -3.360 -3.938
522 HA HIS 74 HA HIS 74 -4.797 -5.111 -1.560
523 1HB HIS 74 2HB HIS 74 -6.699 -4.778 -3.890
524 2HB HIS 74 1HB HIS 74 -6.873 -6.017 -2.662
525 HD1 HIS 74 1HD HIS 74 -9.263 -4.636 -2.656
526 HD2 HIS 74 2HD HIS 74 -5.972 -2.829 -0.855
527 HE1 HIS 74 1HE HIS 74 -10.208 -2.929 -1.074
528 HE2 HIS 74 2HE HIS 74 -8.210 -2.103 0.219
529 H VAL 75 H VAL 75 -3.563 -6.890 -1.713
530 HA VAL 75 HA VAL 75 -3.109 -7.928 -4.419
531 HB VAL 75 HB VAL 75 -1.106 -8.965 -3.694
532 1HG1 VAL 75 1HG1 VAL 75 -1.203 -6.261 -2.366
533 2HG1 VAL 75 2HG1 VAL 75 -0.924 -6.553 -4.083
534 3HG1 VAL 75 3HG1 VAL 75 0.250 -7.119 -2.891
535 1HG2 VAL 75 1HG2 VAL 75 -1.770 -9.873 -1.588
536 2HG2 VAL 75 2HG2 VAL 75 -1.910 -8.257 -0.884
537 3HG2 VAL 75 3HG2 VAL 75 -0.321 -8.890 -1.341
538 H THR 76 H THR 76 -4.099 -9.698 -4.996
539 HA THR 76 HA THR 76 -5.111 -11.495 -2.902
540 HB THR 76 HB THR 76 -5.730 -11.708 -5.851
541 HG1 THR 76 1HG THR 76 -6.433 -9.682 -4.213
542 1HG2 THR 76 1HG2 THR 76 -7.259 -12.501 -3.369
543 2HG2 THR 76 2HG2 THR 76 -6.370 -13.590 -4.434
544 3HG2 THR 76 3HG2 THR 76 -7.799 -12.745 -5.031
545 H VAL 77 H VAL 77 -3.455 -12.864 -2.423
546 HA VAL 77 HA VAL 77 -2.393 -14.537 -4.511
547 HB VAL 77 HB VAL 77 -0.860 -12.696 -4.764
548 1HG1 VAL 77 1HG1 VAL 77 -1.180 -11.587 -2.626
549 2HG1 VAL 77 2HG1 VAL 77 0.535 -11.878 -2.913
550 3HG1 VAL 77 3HG1 VAL 77 -0.360 -12.909 -1.795
551 1HG2 VAL 77 1HG2 VAL 77 1.270 -13.799 -4.267
552 2HG2 VAL 77 2HG2 VAL 77 0.092 -14.931 -4.928
553 3HG2 VAL 77 3HG2 VAL 77 0.434 -14.926 -3.197
554 H LYS 78 H LYS 78 -2.064 -16.519 -3.735
555 HA LYS 78 HA LYS 78 -1.560 -16.775 -0.872
556 1HB LYS 78 2HB LYS 78 -2.762 -19.102 -1.263
557 2HB LYS 78 1HB LYS 78 -3.649 -17.649 -0.849
558 1HG LYS 78 2HG LYS 78 -4.894 -18.623 -2.559
559 2HG LYS 78 1HG LYS 78 -3.988 -17.344 -3.366
560 1HD LYS 78 2HD LYS 78 -3.966 -19.363 -4.709
561 2HD LYS 78 1HD LYS 78 -2.342 -19.015 -4.118
562 1HE LYS 78 2HE LYS 78 -2.683 -21.349 -3.858
563 2HE LYS 78 1HE LYS 78 -2.789 -20.638 -2.248
564 1HZ LYS 78 1HZ LYS 78 -5.240 -20.657 -2.513
565 2HZ LYS 78 2HZ LYS 78 -4.549 -22.205 -2.508
566 3HZ LYS 78 3HZ LYS 78 -5.046 -21.504 -3.973
567 H ALA 79 H ALA 79 0.523 -17.170 -0.801
568 HA ALA 79 HA ALA 79 1.509 -19.696 -1.651
569 1HB ALA 79 1HB ALA 79 2.699 -17.260 -2.980
570 2HB ALA 79 2HB ALA 79 1.715 -18.483 -3.784
571 3HB ALA 79 3HB ALA 79 3.292 -18.915 -3.123
572 H ALA 80 H ALA 80 3.298 -20.287 -0.485
573 HA ALA 80 HA ALA 80 3.758 -18.887 1.920
574 1HB ALA 80 1HB ALA 80 5.404 -20.590 2.406
575 2HB ALA 80 2HB ALA 80 5.423 -21.094 0.715
576 3HB ALA 80 3HB ALA 80 3.971 -21.328 1.690
577 H GLY 81 H GLY 81 4.409 -16.816 1.386
578 1HA GLY 81 2HA GLY 81 7.279 -16.529 1.001
579 2HA GLY 81 1HA GLY 81 6.268 -15.804 -0.248
580 H THR 82 H THR 82 7.917 -14.205 1.274
581 HA THR 82 HA THR 82 6.062 -13.014 3.206
582 HB THR 82 HB THR 82 8.834 -11.953 2.824
583 HG1 THR 82 1HG THR 82 9.740 -13.677 3.710
584 1HG2 THR 82 1HG2 THR 82 7.011 -12.361 5.205
585 2HG2 THR 82 2HG2 THR 82 7.312 -10.837 4.366
586 3HG2 THR 82 3HG2 THR 82 8.613 -11.619 5.268
587 H HIS 83 H HIS 83 5.244 -11.010 2.934
588 HA HIS 83 HA HIS 83 5.486 -9.975 0.198
589 1HB HIS 83 2HB HIS 83 3.216 -10.727 1.221
590 2HB HIS 83 1HB HIS 83 3.338 -9.280 2.213
591 HD1 HIS 83 1HD HIS 83 3.624 -6.959 0.752
592 HD2 HIS 83 2HD HIS 83 1.963 -10.268 -1.130
593 HE1 HIS 83 1HE HIS 83 2.436 -6.045 -1.269
594 HE2 HIS 83 2HE HIS 83 1.563 -8.092 -2.478
595 H ALA 84 H ALA 84 7.094 -8.523 0.230
596 HA ALA 84 HA ALA 84 7.177 -6.550 2.400
597 1HB ALA 84 1HB ALA 84 9.236 -7.225 0.295
598 2HB ALA 84 2HB ALA 84 9.265 -7.751 1.976
599 3HB ALA 84 3HB ALA 84 9.439 -6.041 1.584
600 H VAL 85 H VAL 85 5.869 -4.917 1.925
601 HA VAL 85 HA VAL 85 5.762 -4.002 -0.858
602 HB VAL 85 HB VAL 85 3.633 -4.693 -0.078
603 1HG1 VAL 85 1HG1 VAL 85 4.036 -4.631 2.282
604 2HG1 VAL 85 2HG1 VAL 85 2.527 -3.818 1.857
605 3HG1 VAL 85 3HG1 VAL 85 3.964 -2.868 2.247
606 1HG2 VAL 85 1HG2 VAL 85 3.604 -2.718 -1.479
607 2HG2 VAL 85 2HG2 VAL 85 3.757 -1.696 -0.051
608 3HG2 VAL 85 3HG2 VAL 85 2.298 -2.658 -0.295
609 H ASN 86 H ASN 86 7.098 -2.429 -1.204
610 HA ASN 86 HA ASN 86 7.328 -0.229 0.741
611 1HB ASN 86 2HB ASN 86 9.140 -1.053 -1.549
612 2HB ASN 86 1HB ASN 86 9.339 0.436 -0.640
613 1HD2 ASN 86 1HD2 ASN 86 8.409 -2.652 0.762
614 2HD2 ASN 86 2HD2 ASN 86 9.860 -2.878 1.669
615 H LEU 87 H LEU 87 5.780 1.200 0.274
616 HA LEU 87 HA LEU 87 5.258 1.821 -2.552
617 1HB LEU 87 2HB LEU 87 3.548 2.315 -0.110
618 2HB LEU 87 1HB LEU 87 3.128 2.782 -1.750
619 HG LEU 87 HG LEU 87 3.599 -0.079 -0.924
620 1HD1 LEU 87 1HD1 LEU 87 1.707 0.788 0.316
621 2HD1 LEU 87 2HD1 LEU 87 1.160 -0.301 -0.959
622 3HD1 LEU 87 3HD1 LEU 87 1.013 1.444 -1.167
623 1HD2 LEU 87 1HD2 LEU 87 3.899 0.430 -3.286
624 2HD2 LEU 87 2HD2 LEU 87 2.282 1.133 -3.334
625 3HD2 LEU 87 3HD2 LEU 87 2.486 -0.587 -2.998
626 H THR 88 H THR 88 5.717 3.784 -3.314
627 HA THR 88 HA THR 88 6.939 5.661 -1.421
628 HB THR 88 HB THR 88 7.344 5.684 -4.420
629 HG1 THR 88 1HG THR 88 7.995 3.642 -3.860
630 1HG2 THR 88 1HG2 THR 88 8.094 7.604 -2.942
631 2HG2 THR 88 2HG2 THR 88 9.377 6.837 -3.871
632 3HG2 THR 88 3HG2 THR 88 9.196 6.477 -2.156
633 H TYR 89 H TYR 89 6.058 7.593 -1.125
634 HA TYR 89 HA TYR 89 3.755 8.427 -2.725
635 1HB TYR 89 2HB TYR 89 3.703 8.356 -0.188
636 2HB TYR 89 1HB TYR 89 4.883 9.657 -0.190
637 HD1 TYR 89 1HD TYR 89 1.566 8.897 -1.718
638 HD2 TYR 89 2HD TYR 89 4.058 11.781 0.146
639 HE1 TYR 89 1HE TYR 89 -0.278 10.515 -1.776
640 HE2 TYR 89 2HE TYR 89 2.218 13.411 0.076
641 HH TYR 89 HH TYR 89 -0.993 12.511 -0.668
642 H MET 90 H MET 90 4.675 9.240 -4.602
643 HA MET 90 HA MET 90 6.362 11.655 -4.273
644 1HB MET 90 2HB MET 90 6.709 10.233 -6.800
645 2HB MET 90 1HB MET 90 7.895 11.030 -5.794
646 1HG MET 90 2HG MET 90 8.512 8.820 -5.846
647 2HG MET 90 1HG MET 90 7.760 9.030 -4.278
648 1HE MET 90 1HE MET 90 7.313 7.746 -7.921
649 2HE MET 90 2HE MET 90 5.858 8.733 -7.739
650 3HE MET 90 3HE MET 90 5.731 6.980 -7.860
651 H ARG 91 H ARG 91 6.235 13.154 -6.007
652 HA ARG 91 HA ARG 91 3.661 13.642 -6.960
653 1HB ARG 91 2HB ARG 91 6.343 14.789 -7.377
654 2HB ARG 91 1HB ARG 91 5.250 14.993 -8.733
655 1HG ARG 91 2HG ARG 91 3.601 16.016 -7.182
656 2HG ARG 91 1HG ARG 91 4.809 15.909 -5.900
657 1HD ARG 91 2HD ARG 91 6.309 17.348 -7.170
658 2HD ARG 91 1HD ARG 91 5.146 17.416 -8.493
659 HE ARG 91 HE ARG 91 3.850 18.300 -6.190
660 1HH1 ARG 91 1HH1 ARG 91 6.394 19.320 -8.372
661 2HH1 ARG 91 2HH1 ARG 91 6.228 21.008 -7.980
662 1HH2 ARG 91 1HH2 ARG 91 3.608 20.515 -5.699
663 2HH2 ARG 91 2HH2 ARG 91 4.626 21.689 -6.475
664 HA PRO 92 HA PRO 92 3.202 10.222 -9.668
665 1HB PRO 92 2HB PRO 92 1.315 11.910 -11.120
666 2HB PRO 92 1HB PRO 92 1.005 10.469 -10.154
667 1HG PRO 92 2HG PRO 92 0.732 13.284 -9.397
668 2HG PRO 92 1HG PRO 92 0.155 11.832 -8.558
669 1HD PRO 92 2HD PRO 92 2.161 13.428 -7.653
670 2HD PRO 92 1HD PRO 92 2.030 11.701 -7.271
671 H TRP 93 H TRP 93 3.665 13.493 -10.987
672 HA TRP 93 HA TRP 93 4.243 12.395 -13.616
673 1HB TRP 93 2HB TRP 93 4.363 14.841 -14.259
674 2HB TRP 93 1HB TRP 93 2.805 14.272 -13.669
675 HD1 TRP 93 HD TRP 93 5.709 16.567 -12.716
676 HE1 TRP 93 1HE TRP 93 4.971 18.076 -10.762
677 HE3 TRP 93 3HE TRP 93 1.229 14.365 -11.662
678 HZ2 TRP 93 2HZ TRP 93 2.756 18.292 -9.002
679 HZ3 TRP 93 3HZ TRP 93 -0.138 15.268 -9.834
680 HH2 TRP 93 HH TRP 93 0.606 17.194 -8.530
681 H THR 94 H THR 94 6.113 12.824 -10.953
682 HA THR 94 HA THR 94 8.508 12.829 -12.540
683 HB THR 94 HB THR 94 8.306 15.200 -12.494
684 HG1 THR 94 1HG THR 94 10.412 14.696 -12.120
685 1HG2 THR 94 1HG2 THR 94 6.699 15.483 -10.703
686 2HG2 THR 94 2HG2 THR 94 8.109 16.502 -10.412
687 3HG2 THR 94 3HG2 THR 94 7.905 15.001 -9.509
688 H GLY 95 H GLY 95 7.625 13.557 -9.152
689 1HA GLY 95 2HA GLY 95 8.016 12.327 -7.236
690 2HA GLY 95 1HA GLY 95 8.611 11.021 -8.255
691 HA PRO 96 HA PRO 96 12.248 13.877 -6.797
692 1HB PRO 96 2HB PRO 96 11.082 14.716 -4.225
693 2HB PRO 96 1HB PRO 96 11.956 15.681 -5.412
694 1HG PRO 96 2HG PRO 96 9.325 15.991 -5.027
695 2HG PRO 96 1HG PRO 96 10.049 16.140 -6.639
696 1HD PRO 96 2HD PRO 96 8.584 13.819 -5.437
697 2HD PRO 96 1HD PRO 96 8.443 14.516 -7.067
698 H SER 97 H SER 97 13.000 11.742 -6.560
699 HA SER 97 HA SER 97 12.385 10.025 -4.419
700 1HB SER 97 2HB SER 97 14.988 10.190 -5.964
701 2HB SER 97 1HB SER 97 14.406 8.808 -5.037
702 HG SER 97 HG SER 97 13.531 9.807 -7.515
703 H HIS 98 H HIS 98 14.491 12.743 -4.783
704 HA HIS 98 HA HIS 98 15.966 12.638 -2.422
705 1HB HIS 98 2HB HIS 98 16.433 14.333 -4.068
706 2HB HIS 98 1HB HIS 98 14.803 14.980 -3.948
707 HD1 HIS 98 1HD HIS 98 14.298 16.598 -2.003
708 HD2 HIS 98 2HD HIS 98 18.190 15.106 -1.998
709 HE1 HIS 98 1HE HIS 98 15.568 18.000 -0.338
710 HE2 HIS 98 2HE HIS 98 17.877 16.985 -0.242
711 H ASP 99 H ASP 99 12.559 13.374 -2.974
712 HA ASP 99 HA ASP 99 12.335 14.212 -0.182
713 1HB ASP 99 2HB ASP 99 10.931 14.947 -2.716
714 2HB ASP 99 1HB ASP 99 10.075 15.078 -1.194
715 H SER 100 H SER 100 9.497 13.497 -1.881
716 HA SER 100 HA SER 100 7.790 12.059 -1.522
717 1HB SER 100 2HB SER 100 8.350 9.690 -1.906
718 2HB SER 100 1HB SER 100 9.160 10.756 -3.052
719 HG SER 100 HG SER 100 10.823 10.529 -1.059
720 H GLU 101 H GLU 101 7.014 10.042 -0.267
721 HA GLU 101 HA GLU 101 8.462 9.537 2.231
722 1HB GLU 101 2HB GLU 101 6.595 11.082 2.830
723 2HB GLU 101 1HB GLU 101 5.454 9.936 2.134
724 1HG GLU 101 2HG GLU 101 6.224 8.243 3.770
725 2HG GLU 101 1HG GLU 101 7.253 9.468 4.503
726 H ARG 102 H ARG 102 8.393 7.308 2.773
727 HA ARG 102 HA ARG 102 6.954 5.710 0.764
728 1HB ARG 102 2HB ARG 102 9.558 5.954 0.620
729 2HB ARG 102 1HB ARG 102 9.566 4.804 1.948
730 1HG ARG 102 2HG ARG 102 8.448 3.158 0.598
731 2HG ARG 102 1HG ARG 102 8.246 4.321 -0.717
732 1HD ARG 102 2HD ARG 102 10.756 4.512 -0.780
733 2HD ARG 102 1HD ARG 102 10.814 3.147 0.332
734 HE ARG 102 HE ARG 102 9.275 2.616 -2.044
735 1HH1 ARG 102 1HH1 ARG 102 12.497 2.674 -0.663
736 2HH1 ARG 102 2HH1 ARG 102 13.140 1.527 -1.801
737 1HH2 ARG 102 1HH2 ARG 102 10.130 1.106 -3.563
738 2HH2 ARG 102 2HH2 ARG 102 11.810 0.651 -3.455
739 H PHE 103 H PHE 103 6.039 3.890 1.327
740 HA PHE 103 HA PHE 103 5.708 3.317 4.187
741 1HB PHE 103 2HB PHE 103 3.575 3.655 3.362
742 2HB PHE 103 1HB PHE 103 3.987 3.088 1.753
743 HD1 PHE 103 1HD PHE 103 2.817 2.170 5.067
744 HD2 PHE 103 2HD PHE 103 3.938 0.710 1.229
745 HE1 PHE 103 1HE PHE 103 1.745 0.019 5.569
746 HE2 PHE 103 2HE PHE 103 2.871 -1.452 1.725
747 HZ PHE 103 HZ PHE 103 1.771 -1.787 3.899
748 H THR 104 H THR 104 5.717 1.083 4.846
749 HA THR 104 HA THR 104 6.574 -0.925 2.995
750 HB THR 104 HB THR 104 8.522 0.096 5.077
751 HG1 THR 104 1HG THR 104 8.240 0.688 2.539
752 1HG2 THR 104 1HG2 THR 104 9.983 -1.758 4.383
753 2HG2 THR 104 2HG2 THR 104 8.677 -2.396 3.382
754 3HG2 THR 104 3HG2 THR 104 8.491 -2.328 5.136
755 H VAL 105 H VAL 105 4.912 -2.285 3.747
756 HA VAL 105 HA VAL 105 5.387 -3.038 6.565
757 HB VAL 105 HB VAL 105 3.018 -2.401 6.099
758 1HG1 VAL 105 1HG1 VAL 105 2.767 -3.260 3.860
759 2HG1 VAL 105 2HG1 VAL 105 1.588 -4.014 4.933
760 3HG1 VAL 105 3HG1 VAL 105 3.029 -4.905 4.437
761 1HG2 VAL 105 1HG2 VAL 105 3.341 -5.290 6.876
762 2HG2 VAL 105 2HG2 VAL 105 2.065 -4.179 7.377
763 3HG2 VAL 105 3HG2 VAL 105 3.721 -3.931 7.929
764 H TYR 106 H TYR 106 6.032 -4.969 7.079
765 HA TYR 106 HA TYR 106 6.536 -6.878 4.909
766 1HB TYR 106 2HB TYR 106 7.716 -6.597 7.671
767 2HB TYR 106 1HB TYR 106 8.027 -7.979 6.631
768 HD1 TYR 106 1HD TYR 106 9.137 -7.513 4.369
769 HD2 TYR 106 2HD TYR 106 9.019 -4.676 7.533
770 HE1 TYR 106 1HE TYR 106 10.997 -6.285 3.333
771 HE2 TYR 106 2HE TYR 106 10.879 -3.444 6.509
772 HH TYR 106 HH TYR 106 12.722 -3.831 4.969
773 H LEU 107 H LEU 107 4.713 -7.995 4.739
774 HA LEU 107 HA LEU 107 3.868 -9.416 7.149
775 1HB LEU 107 2HB LEU 107 1.563 -9.356 6.470
776 2HB LEU 107 1HB LEU 107 2.181 -7.736 6.573
777 HG LEU 107 HG LEU 107 0.679 -7.827 4.747
778 1HD1 LEU 107 1HD1 LEU 107 2.037 -7.174 2.849
779 2HD1 LEU 107 2HD1 LEU 107 3.469 -7.830 3.644
780 3HD1 LEU 107 3HD1 LEU 107 2.618 -6.457 4.353
781 1HD2 LEU 107 1HD2 LEU 107 2.245 -10.154 3.658
782 2HD2 LEU 107 2HD2 LEU 107 0.925 -9.327 2.834
783 3HD2 LEU 107 3HD2 LEU 107 0.618 -10.202 4.333
784 H LYS 108 H LYS 108 3.358 -11.618 6.855
785 HA LYS 108 HA LYS 108 4.751 -12.637 4.479
786 1HB LYS 108 2HB LYS 108 5.601 -13.214 6.770
787 2HB LYS 108 1HB LYS 108 4.117 -14.122 7.030
788 1HG LYS 108 2HG LYS 108 4.711 -15.411 4.930
789 2HG LYS 108 1HG LYS 108 6.306 -14.667 5.056
790 1HD LYS 108 2HD LYS 108 6.626 -15.603 7.261
791 2HD LYS 108 1HD LYS 108 4.999 -16.283 7.238
792 1HE LYS 108 2HE LYS 108 5.619 -17.716 5.359
793 2HE LYS 108 1HE LYS 108 7.239 -17.017 5.355
794 1HZ LYS 108 1HZ LYS 108 6.047 -18.466 7.653
795 2HZ LYS 108 2HZ LYS 108 7.643 -17.906 7.524
796 3HZ LYS 108 3HZ LYS 108 7.103 -19.167 6.527
797 H ALA 109 H ALA 109 3.700 -13.737 2.977
798 HA ALA 109 HA ALA 109 0.831 -14.127 3.418
799 1HB ALA 109 1HB ALA 109 2.369 -13.764 0.852
800 2HB ALA 109 2HB ALA 109 1.389 -12.540 1.662
801 3HB ALA 109 3HB ALA 109 0.624 -13.973 0.976
802 H ASN 110 H ASN 110 -0.182 -15.931 2.333
803 HA ASN 110 HA ASN 110 1.002 -18.117 1.192
804 1HB ASN 110 2HB ASN 110 1.039 -19.744 3.114
805 2HB ASN 110 1HB ASN 110 2.319 -18.540 3.157
806 1HD2 ASN 110 1HD2 ASN 110 2.267 -16.920 4.725
807 2HD2 ASN 110 2HD2 ASN 110 1.265 -17.041 6.131
Start of MODEL 10
1 H HIS 3 H HIS 3 -7.365 -9.884 6.680
2 HA HIS 3 HA HIS 3 -5.559 -8.679 7.339
3 1HB HIS 3 2HB HIS 3 -3.990 -10.353 6.660
4 2HB HIS 3 1HB HIS 3 -4.314 -10.037 4.952
5 HD1 HIS 3 1HD HIS 3 -3.169 -7.813 7.826
6 HD2 HIS 3 2HD HIS 3 -2.156 -8.794 3.903
7 HE1 HIS 3 1HE HIS 3 -1.322 -6.237 7.188
8 HE2 HIS 3 2HE HIS 3 -0.909 -6.685 4.741
9 H LYS 4 H LYS 4 -5.125 -6.552 7.200
10 HA LYS 4 HA LYS 4 -4.875 -5.295 4.599
11 1HB LYS 4 2HB LYS 4 -6.440 -3.429 5.302
12 2HB LYS 4 1HB LYS 4 -7.193 -4.954 4.858
13 1HG LYS 4 2HG LYS 4 -7.456 -5.510 7.227
14 2HG LYS 4 1HG LYS 4 -6.714 -3.969 7.666
15 1HD LYS 4 2HD LYS 4 -8.517 -2.747 6.657
16 2HD LYS 4 1HD LYS 4 -9.202 -4.224 5.979
17 1HE LYS 4 2HE LYS 4 -10.443 -3.491 7.948
18 2HE LYS 4 1HE LYS 4 -9.672 -5.053 8.219
19 1HZ LYS 4 1HZ LYS 4 -7.948 -3.975 9.479
20 2HZ LYS 4 2HZ LYS 4 -9.457 -3.532 10.116
21 3HZ LYS 4 3HZ LYS 4 -8.591 -2.441 9.141
22 H VAL 5 H VAL 5 -3.510 -3.563 4.596
23 HA VAL 5 HA VAL 5 -2.320 -2.864 7.185
24 HB VAL 5 HB VAL 5 -1.141 -2.986 4.437
25 1HG1 VAL 5 1HG1 VAL 5 0.667 -1.427 5.086
26 2HG1 VAL 5 2HG1 VAL 5 -0.327 -0.906 6.448
27 3HG1 VAL 5 3HG1 VAL 5 -0.885 -0.633 4.799
28 1HG2 VAL 5 1HG2 VAL 5 0.774 -3.746 5.676
29 2HG2 VAL 5 2HG2 VAL 5 -0.667 -4.618 6.205
30 3HG2 VAL 5 3HG2 VAL 5 -0.005 -3.314 7.198
31 H THR 6 H THR 6 -2.357 -0.856 7.953
32 HA THR 6 HA THR 6 -3.364 1.298 6.247
33 HB THR 6 HB THR 6 -4.043 2.367 8.490
34 HG1 THR 6 1HG THR 6 -4.685 0.376 9.891
35 1HG2 THR 6 1HG2 THR 6 -6.197 1.150 8.460
36 2HG2 THR 6 2HG2 THR 6 -5.466 -0.055 7.397
37 3HG2 THR 6 3HG2 THR 6 -5.649 1.613 6.847
38 H LYS 7 H LYS 7 -2.637 3.501 7.225
39 HA LYS 7 HA LYS 7 -0.107 3.933 6.473
40 1HB LYS 7 2HB LYS 7 -1.727 5.694 6.911
41 2HB LYS 7 1HB LYS 7 -1.543 5.456 8.642
42 1HG LYS 7 2HG LYS 7 -0.316 7.420 7.668
43 2HG LYS 7 1HG LYS 7 0.660 6.306 8.625
44 1HD LYS 7 2HD LYS 7 1.569 5.304 6.648
45 2HD LYS 7 1HD LYS 7 0.465 6.214 5.609
46 1HE LYS 7 2HE LYS 7 2.762 7.146 5.651
47 2HE LYS 7 1HE LYS 7 1.547 8.288 6.221
48 1HZ LYS 7 1HZ LYS 7 2.239 8.034 8.426
49 2HZ LYS 7 2HZ LYS 7 3.688 8.108 7.544
50 3HZ LYS 7 3HZ LYS 7 3.111 6.617 8.105
51 H ALA 8 H ALA 8 -0.949 3.253 9.907
52 HA ALA 8 HA ALA 8 1.558 3.792 11.014
53 1HB ALA 8 1HB ALA 8 -0.461 3.407 12.344
54 2HB ALA 8 2HB ALA 8 0.881 2.402 12.891
55 3HB ALA 8 3HB ALA 8 -0.410 1.696 11.921
56 H HIS 9 H HIS 9 0.447 0.960 9.306
57 HA HIS 9 HA HIS 9 2.518 -0.826 9.985
58 1HB HIS 9 2HB HIS 9 0.726 -0.615 7.595
59 2HB HIS 9 1HB HIS 9 1.970 -1.848 7.700
60 HD1 HIS 9 1HD HIS 9 -1.373 -0.925 8.984
61 HD2 HIS 9 2HD HIS 9 1.456 -3.886 9.612
62 HE1 HIS 9 1HE HIS 9 -2.649 -2.890 9.882
63 HE2 HIS 9 2HE HIS 9 -0.930 -4.703 10.188
64 H ASN 10 H ASN 10 2.726 2.073 8.370
65 HA ASN 10 HA ASN 10 4.641 1.877 6.427
66 1HB ASN 10 2HB ASN 10 3.749 4.020 7.071
67 2HB ASN 10 1HB ASN 10 4.386 3.857 8.706
68 1HD2 ASN 10 1HD2 ASN 10 6.056 3.245 5.642
69 2HD2 ASN 10 2HD2 ASN 10 7.240 4.482 5.847
70 H GLY 11 H GLY 11 4.878 0.962 9.742
71 1HA GLY 11 2HA GLY 11 7.668 0.130 9.269
72 2HA GLY 11 1HA GLY 11 7.287 1.009 10.742
73 H ALA 12 H ALA 12 5.717 -1.669 8.955
74 HA ALA 12 HA ALA 12 5.276 -2.973 11.560
75 1HB ALA 12 1HB ALA 12 3.495 -2.330 9.625
76 2HB ALA 12 2HB ALA 12 3.252 -3.579 10.850
77 3HB ALA 12 3HB ALA 12 3.840 -4.022 9.242
78 H THR 13 H THR 13 5.331 -5.271 11.724
79 HA THR 13 HA THR 13 6.358 -6.854 9.515
80 HB THR 13 HB THR 13 7.814 -6.813 12.176
81 HG1 THR 13 1HG THR 13 8.152 -5.361 9.953
82 1HG2 THR 13 1HG2 THR 13 9.335 -8.433 11.120
83 2HG2 THR 13 2HG2 THR 13 8.297 -8.471 9.695
84 3HG2 THR 13 3HG2 THR 13 7.695 -9.067 11.242
85 H LEU 14 H LEU 14 4.681 -8.301 9.454
86 HA LEU 14 HA LEU 14 3.931 -9.800 11.812
87 1HB LEU 14 2HB LEU 14 2.766 -7.615 12.033
88 2HB LEU 14 1HB LEU 14 1.978 -7.904 10.498
89 HG LEU 14 HG LEU 14 1.552 -10.009 12.510
90 1HD1 LEU 14 1HD1 LEU 14 0.378 -7.249 12.861
91 2HD1 LEU 14 2HD1 LEU 14 1.542 -8.018 13.941
92 3HD1 LEU 14 3HD1 LEU 14 -0.077 -8.694 13.765
93 1HD2 LEU 14 1HD2 LEU 14 -0.713 -9.833 11.633
94 2HD2 LEU 14 2HD2 LEU 14 0.469 -9.950 10.325
95 3HD2 LEU 14 3HD2 LEU 14 -0.257 -8.391 10.725
96 H THR 15 H THR 15 2.177 -11.432 11.241
97 HA THR 15 HA THR 15 2.628 -12.340 8.483
98 HB THR 15 HB THR 15 1.751 -13.870 10.934
99 HG1 THR 15 1HG THR 15 4.130 -13.151 10.100
100 1HG2 THR 15 1HG2 THR 15 1.836 -15.868 9.568
101 2HG2 THR 15 2HG2 THR 15 2.323 -14.921 8.161
102 3HG2 THR 15 3HG2 THR 15 0.707 -14.715 8.843
103 H VAL 16 H VAL 16 0.953 -12.922 7.133
104 HA VAL 16 HA VAL 16 -1.699 -11.978 8.014
105 HB VAL 16 HB VAL 16 -2.094 -11.028 5.901
106 1HG1 VAL 16 1HG1 VAL 16 0.820 -10.572 6.548
107 2HG1 VAL 16 2HG1 VAL 16 -0.550 -9.721 7.261
108 3HG1 VAL 16 3HG1 VAL 16 -0.185 -9.523 5.547
109 1HG2 VAL 16 1HG2 VAL 16 -0.674 -11.322 3.952
110 2HG2 VAL 16 2HG2 VAL 16 -1.296 -12.873 4.519
111 3HG2 VAL 16 3HG2 VAL 16 0.372 -12.410 4.868
112 H ALA 17 H ALA 17 -3.542 -13.000 7.057
113 HA ALA 17 HA ALA 17 -3.045 -15.698 6.009
114 1HB ALA 17 1HB ALA 17 -4.439 -15.616 7.996
115 2HB ALA 17 2HB ALA 17 -5.407 -16.113 6.607
116 3HB ALA 17 3HB ALA 17 -5.515 -14.460 7.217
117 H VAL 18 H VAL 18 -3.292 -15.964 3.859
118 HA VAL 18 HA VAL 18 -4.844 -13.913 2.415
119 HB VAL 18 HB VAL 18 -3.576 -14.418 0.436
120 1HG1 VAL 18 1HG1 VAL 18 -2.524 -12.776 1.735
121 2HG1 VAL 18 2HG1 VAL 18 -1.241 -13.907 1.280
122 3HG1 VAL 18 3HG1 VAL 18 -1.935 -13.959 2.905
123 1HG2 VAL 18 1HG2 VAL 18 -2.200 -16.542 2.067
124 2HG2 VAL 18 2HG2 VAL 18 -1.723 -16.030 0.448
125 3HG2 VAL 18 3HG2 VAL 18 -3.287 -16.804 0.703
126 H GLY 19 H GLY 19 -5.349 -15.041 0.065
127 1HA GLY 19 2HA GLY 19 -6.155 -17.300 -0.731
128 2HA GLY 19 1HA GLY 19 -7.107 -17.308 0.750
129 H GLU 20 H GLU 20 -8.274 -15.035 0.988
130 HA GLU 20 HA GLU 20 -10.022 -14.780 -1.289
131 1HB GLU 20 2HB GLU 20 -9.947 -13.044 1.182
132 2HB GLU 20 1HB GLU 20 -11.297 -13.285 0.083
133 1HG GLU 20 2HG GLU 20 -11.560 -15.554 0.828
134 2HG GLU 20 1HG GLU 20 -10.123 -15.421 1.840
135 H LEU 21 H LEU 21 -8.276 -12.383 0.624
136 HA LEU 21 HA LEU 21 -6.990 -11.140 -1.601
137 1HB LEU 21 2HB LEU 21 -9.143 -10.209 -2.066
138 2HB LEU 21 1HB LEU 21 -9.447 -9.903 -0.365
139 HG LEU 21 HG LEU 21 -7.674 -8.160 -0.400
140 1HD1 LEU 21 1HD1 LEU 21 -7.692 -8.601 -3.377
141 2HD1 LEU 21 2HD1 LEU 21 -6.385 -9.067 -2.289
142 3HD1 LEU 21 3HD1 LEU 21 -6.795 -7.364 -2.497
143 1HD2 LEU 21 1HD2 LEU 21 -9.880 -7.794 -2.419
144 2HD2 LEU 21 2HD2 LEU 21 -8.978 -6.502 -1.626
145 3HD2 LEU 21 3HD2 LEU 21 -10.021 -7.562 -0.677
146 H VAL 22 H VAL 22 -5.293 -9.886 -0.843
147 HA VAL 22 HA VAL 22 -5.378 -9.227 2.027
148 HB VAL 22 HB VAL 22 -3.234 -10.511 0.466
149 1HG1 VAL 22 1HG1 VAL 22 -2.145 -8.379 0.504
150 2HG1 VAL 22 2HG1 VAL 22 -1.415 -9.369 1.769
151 3HG1 VAL 22 3HG1 VAL 22 -2.585 -8.118 2.188
152 1HG2 VAL 22 1HG2 VAL 22 -2.533 -11.186 2.726
153 2HG2 VAL 22 2HG2 VAL 22 -4.228 -11.540 2.390
154 3HG2 VAL 22 3HG2 VAL 22 -3.799 -10.160 3.402
155 H GLU 23 H GLU 23 -5.333 -7.109 2.533
156 HA GLU 23 HA GLU 23 -4.829 -5.247 0.323
157 1HB GLU 23 2HB GLU 23 -6.414 -4.970 2.856
158 2HB GLU 23 1HB GLU 23 -5.907 -3.565 1.933
159 1HG GLU 23 2HG GLU 23 -7.045 -4.762 -0.052
160 2HG GLU 23 1HG GLU 23 -7.852 -5.701 1.207
161 H ILE 24 H ILE 24 -3.381 -3.704 0.369
162 HA ILE 24 HA ILE 24 -2.082 -2.991 2.922
163 HB ILE 24 HB ILE 24 -0.885 -2.790 0.138
164 1HG1 ILE 24 2HG1 ILE 24 -1.002 -5.123 0.963
165 2HG1 ILE 24 1HG1 ILE 24 0.658 -4.554 0.805
166 1HG2 ILE 24 1HG2 ILE 24 0.334 -2.202 2.833
167 2HG2 ILE 24 2HG2 ILE 24 -0.162 -1.005 1.637
168 3HG2 ILE 24 3HG2 ILE 24 1.163 -2.114 1.278
169 1HD1 ILE 24 1HD1 ILE 24 -0.917 -4.725 3.368
170 2HD1 ILE 24 2HD1 ILE 24 0.748 -4.165 3.212
171 3HD1 ILE 24 3HD1 ILE 24 0.342 -5.841 2.840
172 H GLN 25 H GLN 25 -3.224 -1.150 3.472
173 HA GLN 25 HA GLN 25 -4.062 0.557 1.237
174 1HB GLN 25 2HB GLN 25 -5.960 -0.366 2.293
175 2HB GLN 25 1HB GLN 25 -5.344 -0.007 3.903
176 1HG GLN 25 2HG GLN 25 -5.650 2.319 2.180
177 2HG GLN 25 1HG GLN 25 -7.153 1.460 2.497
178 1HE2 GLN 25 1HE2 GLN 25 -4.558 3.287 3.961
179 2HE2 GLN 25 2HE2 GLN 25 -5.361 3.566 5.465
180 H LEU 26 H LEU 26 -3.606 2.649 1.195
181 HA LEU 26 HA LEU 26 -2.360 3.784 3.572
182 1HB LEU 26 2HB LEU 26 -1.632 4.110 0.706
183 2HB LEU 26 1HB LEU 26 -1.403 5.472 1.782
184 HG LEU 26 HG LEU 26 0.666 4.296 1.575
185 1HD1 LEU 26 1HD1 LEU 26 -0.606 3.760 4.244
186 2HD1 LEU 26 2HD1 LEU 26 0.267 5.214 3.757
187 3HD1 LEU 26 3HD1 LEU 26 1.128 3.680 3.918
188 1HD2 LEU 26 1HD2 LEU 26 -0.150 2.124 0.866
189 2HD2 LEU 26 2HD2 LEU 26 -0.822 1.835 2.472
190 3HD2 LEU 26 3HD2 LEU 26 0.925 1.948 2.254
191 HA PRO 27 HA PRO 27 -5.687 6.708 3.277
192 1HB PRO 27 2HB PRO 27 -5.010 8.389 5.180
193 2HB PRO 27 1HB PRO 27 -5.297 6.692 5.593
194 1HG PRO 27 2HG PRO 27 -2.650 8.074 5.104
195 2HG PRO 27 1HG PRO 27 -3.124 7.012 6.459
196 1HD PRO 27 2HD PRO 27 -1.762 6.134 4.261
197 2HD PRO 27 1HD PRO 27 -2.835 5.102 5.227
198 H SER 28 H SER 28 -2.928 7.074 1.806
199 HA SER 28 HA SER 28 -1.944 8.524 0.423
200 1HB SER 28 2HB SER 28 -4.218 9.010 -0.438
201 2HB SER 28 1HB SER 28 -4.403 10.242 0.816
202 HG SER 28 HG SER 28 -2.649 10.214 -1.408
203 H ASN 29 H ASN 29 -3.396 10.179 3.160
204 HA ASN 29 HA ASN 29 -2.757 12.008 4.385
205 1HB ASN 29 2HB ASN 29 0.133 11.417 4.030
206 2HB ASN 29 1HB ASN 29 -0.764 11.785 5.491
207 1HD2 ASN 29 1HD2 ASN 29 0.391 9.320 3.409
208 2HD2 ASN 29 2HD2 ASN 29 -0.044 7.977 4.412
209 HA PRO 30 HA PRO 30 -1.803 13.454 -0.018
210 1HB PRO 30 2HB PRO 30 -3.812 15.493 0.838
211 2HB PRO 30 1HB PRO 30 -3.638 14.664 -0.718
212 1HG PRO 30 2HG PRO 30 -5.508 13.837 0.923
213 2HG PRO 30 1HG PRO 30 -4.456 12.633 0.146
214 1HD PRO 30 2HD PRO 30 -4.334 13.720 2.936
215 2HD PRO 30 1HD PRO 30 -4.189 12.040 2.373
216 H THR 31 H THR 31 0.011 14.462 -0.296
217 HA THR 31 HA THR 31 0.690 16.731 1.419
218 HB THR 31 HB THR 31 2.966 16.343 0.884
219 HG1 THR 31 1HG THR 31 3.592 15.578 -0.999
220 1HG2 THR 31 1HG2 THR 31 3.322 14.017 1.429
221 2HG2 THR 31 2HG2 THR 31 1.704 13.589 0.859
222 3HG2 THR 31 3HG2 THR 31 1.902 14.583 2.313
223 H THR 32 H THR 32 0.821 15.826 -2.023
224 HA THR 32 HA THR 32 -0.352 18.217 -2.922
225 HB THR 32 HB THR 32 1.641 19.380 -2.407
226 HG1 THR 32 1HG THR 32 2.279 20.114 -4.425
227 1HG2 THR 32 1HG2 THR 32 3.160 17.533 -2.057
228 2HG2 THR 32 2HG2 THR 32 3.879 18.692 -3.175
229 3HG2 THR 32 3HG2 THR 32 3.190 17.189 -3.787
230 H GLY 33 H GLY 33 2.058 17.459 -5.169
231 1HA GLY 33 2HA GLY 33 0.198 16.002 -6.821
232 2HA GLY 33 1HA GLY 33 1.835 16.459 -7.250
233 H PHE 34 H PHE 34 2.554 15.149 -4.583
234 HA PHE 34 HA PHE 34 3.362 12.643 -5.559
235 1HB PHE 34 2HB PHE 34 3.228 13.688 -2.717
236 2HB PHE 34 1HB PHE 34 4.105 12.256 -3.230
237 HD1 PHE 34 1HD PHE 34 3.901 15.880 -4.147
238 HD2 PHE 34 2HD PHE 34 6.368 12.490 -3.480
239 HE1 PHE 34 1HE PHE 34 5.866 17.250 -4.572
240 HE2 PHE 34 2HE PHE 34 8.361 13.863 -3.907
241 HZ PHE 34 HZ PHE 34 8.112 16.251 -4.451
242 H ALA 35 H ALA 35 2.591 10.591 -5.103
243 HA ALA 35 HA ALA 35 0.241 10.255 -3.412
244 1HB ALA 35 1HB ALA 35 0.241 9.376 -6.314
245 2HB ALA 35 2HB ALA 35 -0.648 10.763 -5.684
246 3HB ALA 35 3HB ALA 35 -1.056 9.133 -5.142
247 H TRP 36 H TRP 36 -0.178 7.913 -2.979
248 HA TRP 36 HA TRP 36 2.352 6.563 -2.722
249 1HB TRP 36 2HB TRP 36 -0.405 5.579 -1.931
250 2HB TRP 36 1HB TRP 36 1.116 4.753 -1.604
251 HD1 TRP 36 HD TRP 36 -1.100 7.526 -0.283
252 HE1 TRP 36 1HE TRP 36 -0.172 8.281 1.979
253 HE3 TRP 36 3HE TRP 36 3.397 5.113 -0.405
254 HZ2 TRP 36 2HZ TRP 36 2.137 7.896 3.532
255 HZ3 TRP 36 3HZ TRP 36 4.923 5.355 1.506
256 HH2 TRP 36 HH TRP 36 4.304 6.732 3.441
257 H TYR 37 H TYR 37 3.189 5.595 -4.382
258 HA TYR 37 HA TYR 37 1.575 3.499 -5.681
259 1HB TYR 37 2HB TYR 37 3.681 5.307 -6.850
260 2HB TYR 37 1HB TYR 37 3.373 3.719 -7.543
261 HD1 TYR 37 1HD TYR 37 1.972 7.079 -6.973
262 HD2 TYR 37 2HD TYR 37 1.401 3.271 -8.782
263 HE1 TYR 37 1HE TYR 37 0.119 8.002 -8.303
264 HE2 TYR 37 2HE TYR 37 -0.457 4.185 -10.121
265 HH TYR 37 HH TYR 37 -1.968 5.958 -10.214
266 H PHE 38 H PHE 38 3.209 1.636 -6.416
267 HA PHE 38 HA PHE 38 4.894 0.942 -4.267
268 1HB PHE 38 2HB PHE 38 4.309 -0.127 -6.917
269 2HB PHE 38 1HB PHE 38 5.978 -0.371 -6.412
270 HD1 PHE 38 1HD PHE 38 2.557 -1.416 -6.030
271 HD2 PHE 38 2HD PHE 38 6.420 -1.574 -4.240
272 HE1 PHE 38 1HE PHE 38 1.850 -3.351 -4.684
273 HE2 PHE 38 2HE PHE 38 5.715 -3.508 -2.892
274 HZ PHE 38 HZ PHE 38 3.396 -4.331 -3.037
275 H GLU 39 H GLU 39 5.916 1.727 -7.584
276 HA GLU 39 HA GLU 39 7.958 3.488 -6.431
277 1HB GLU 39 2HB GLU 39 9.527 2.729 -8.238
278 2HB GLU 39 1HB GLU 39 9.192 1.535 -6.991
279 1HG GLU 39 2HG GLU 39 7.765 0.307 -8.428
280 2HG GLU 39 1HG GLU 39 7.757 1.601 -9.628
281 H GLY 40 H GLY 40 5.278 3.734 -7.837
282 1HA GLY 40 2HA GLY 40 4.569 5.776 -8.793
283 2HA GLY 40 1HA GLY 40 6.185 6.012 -9.434
284 H GLY 41 H GLY 41 3.065 4.601 -9.952
285 1HA GLY 41 2HA GLY 41 2.067 4.245 -12.033
286 2HA GLY 41 1HA GLY 41 3.638 4.409 -12.795
287 H THR 42 H THR 42 4.353 2.374 -10.460
288 HA THR 42 HA THR 42 3.499 -0.030 -11.919
289 HB THR 42 HB THR 42 5.868 -0.739 -10.741
290 HG1 THR 42 1HG THR 42 7.259 1.008 -11.800
291 1HG2 THR 42 1HG2 THR 42 6.737 -0.818 -13.059
292 2HG2 THR 42 2HG2 THR 42 5.347 0.128 -13.592
293 3HG2 THR 42 3HG2 THR 42 5.110 -1.484 -12.917
294 H LYS 43 H LYS 43 2.981 -1.776 -10.765
295 HA LYS 43 HA LYS 43 3.673 -1.865 -7.940
296 1HB LYS 43 2HB LYS 43 1.346 -2.751 -7.501
297 2HB LYS 43 1HB LYS 43 1.493 -1.028 -7.765
298 1HG LYS 43 2HG LYS 43 -0.387 -1.591 -8.987
299 2HG LYS 43 1HG LYS 43 0.879 -1.585 -10.212
300 1HD LYS 43 2HD LYS 43 1.078 -4.086 -9.807
301 2HD LYS 43 1HD LYS 43 -0.423 -3.953 -8.889
302 1HE LYS 43 2HE LYS 43 -1.571 -3.098 -10.855
303 2HE LYS 43 1HE LYS 43 -0.066 -3.149 -11.775
304 1HZ LYS 43 1HZ LYS 43 -1.333 -5.087 -12.304
305 2HZ LYS 43 2HZ LYS 43 -1.570 -5.461 -10.670
306 3HZ LYS 43 3HZ LYS 43 -0.024 -5.586 -11.350
307 H GLU 44 H GLU 44 4.192 -3.887 -7.221
308 HA GLU 44 HA GLU 44 3.473 -6.177 -8.876
309 1HB GLU 44 2HB GLU 44 5.805 -7.043 -8.739
310 2HB GLU 44 1HB GLU 44 5.633 -5.600 -9.727
311 1HG GLU 44 2HG GLU 44 6.452 -4.247 -7.833
312 2HG GLU 44 1HG GLU 44 6.704 -5.734 -6.918
313 H SER 45 H SER 45 3.234 -8.086 -7.800
314 HA SER 45 HA SER 45 3.573 -8.030 -4.863
315 1HB SER 45 2HB SER 45 1.877 -9.754 -6.689
316 2HB SER 45 1HB SER 45 2.132 -10.128 -4.982
317 HG SER 45 HG SER 45 0.900 -7.847 -6.112
318 HA PRO 46 HA PRO 46 7.183 -10.538 -5.235
319 1HB PRO 46 2HB PRO 46 6.326 -11.720 -2.656
320 2HB PRO 46 1HB PRO 46 7.828 -10.887 -3.069
321 1HG PRO 46 2HG PRO 46 5.972 -9.695 -1.572
322 2HG PRO 46 1HG PRO 46 6.891 -8.784 -2.784
323 1HD PRO 46 2HD PRO 46 4.090 -9.832 -2.924
324 2HD PRO 46 1HD PRO 46 4.744 -8.284 -3.498
325 H ASN 47 H ASN 47 4.050 -11.985 -4.714
326 HA ASN 47 HA ASN 47 5.130 -14.574 -5.616
327 1HB ASN 47 2HB ASN 47 2.790 -14.074 -3.764
328 2HB ASN 47 1HB ASN 47 3.207 -15.645 -4.433
329 1HD2 ASN 47 1HD2 ASN 47 3.025 -14.970 -1.680
330 2HD2 ASN 47 2HD2 ASN 47 4.591 -15.199 -0.991
331 H GLU 48 H GLU 48 3.993 -12.267 -7.197
332 HA GLU 48 HA GLU 48 1.468 -13.348 -8.076
333 1HB GLU 48 2HB GLU 48 1.123 -11.366 -9.267
334 2HB GLU 48 1HB GLU 48 1.934 -10.882 -7.789
335 1HG GLU 48 2HG GLU 48 3.958 -10.471 -8.905
336 2HG GLU 48 1HG GLU 48 3.399 -11.277 -10.371
337 H SER 49 H SER 49 1.199 -14.658 -9.616
338 HA SER 49 HA SER 49 2.743 -14.722 -12.026
339 1HB SER 49 2HB SER 49 2.814 -17.146 -10.196
340 2HB SER 49 1HB SER 49 3.480 -17.067 -11.824
341 HG SER 49 HG SER 49 4.475 -15.048 -10.376
342 H MET 50 H MET 50 0.640 -16.586 -9.904
343 HA MET 50 HA MET 50 -1.260 -16.961 -12.103
344 1HB MET 50 2HB MET 50 -2.315 -18.664 -10.746
345 2HB MET 50 1HB MET 50 -0.600 -18.978 -10.910
346 1HG MET 50 2HG MET 50 -1.990 -17.834 -8.491
347 2HG MET 50 1HG MET 50 -1.351 -19.466 -8.659
348 1HE MET 50 1HE MET 50 0.985 -17.658 -6.011
349 2HE MET 50 2HE MET 50 -0.151 -18.983 -6.266
350 3HE MET 50 3HE MET 50 -0.725 -17.314 -6.271
351 H PHE 51 H PHE 51 -0.955 -15.829 -8.802
352 HA PHE 51 HA PHE 51 -3.408 -14.248 -9.113
353 1HB PHE 51 2HB PHE 51 -1.971 -15.410 -6.769
354 2HB PHE 51 1HB PHE 51 -2.835 -13.893 -6.523
355 HD1 PHE 51 1HD PHE 51 -3.469 -17.140 -8.284
356 HD2 PHE 51 2HD PHE 51 -4.935 -14.126 -5.650
357 HE1 PHE 51 1HE PHE 51 -5.571 -18.390 -8.016
358 HE2 PHE 51 2HE PHE 51 -7.036 -15.373 -5.391
359 HZ PHE 51 HZ PHE 51 -7.369 -17.491 -6.624
360 H THR 52 H THR 52 -3.134 -11.964 -7.947
361 HA THR 52 HA THR 52 -0.587 -10.760 -8.381
362 HB THR 52 HB THR 52 -1.245 -11.273 -10.736
363 HG1 THR 52 1HG THR 52 0.092 -9.599 -10.811
364 1HG2 THR 52 1HG2 THR 52 -3.433 -9.254 -10.215
365 2HG2 THR 52 2HG2 THR 52 -3.665 -10.974 -10.526
366 3HG2 THR 52 3HG2 THR 52 -3.009 -9.932 -11.789
367 H VAL 53 H VAL 53 -0.845 -8.298 -8.586
368 HA VAL 53 HA VAL 53 -2.745 -7.509 -6.486
369 HB VAL 53 HB VAL 53 -0.512 -7.079 -5.810
370 1HG1 VAL 53 1HG1 VAL 53 -0.084 -5.764 -8.490
371 2HG1 VAL 53 2HG1 VAL 53 0.612 -7.288 -7.940
372 3HG1 VAL 53 3HG1 VAL 53 1.082 -5.774 -7.169
373 1HG2 VAL 53 1HG2 VAL 53 -2.037 -5.243 -5.322
374 2HG2 VAL 53 2HG2 VAL 53 -1.651 -4.491 -6.869
375 3HG2 VAL 53 3HG2 VAL 53 -0.409 -4.636 -5.624
376 H GLU 54 H GLU 54 -4.300 -6.047 -6.877
377 HA GLU 54 HA GLU 54 -4.030 -4.305 -9.238
378 1HB GLU 54 2HB GLU 54 -6.489 -4.170 -9.333
379 2HB GLU 54 1HB GLU 54 -5.927 -5.814 -9.570
380 1HG GLU 54 2HG GLU 54 -6.790 -4.890 -6.861
381 2HG GLU 54 1HG GLU 54 -7.982 -5.359 -8.074
382 H ASN 55 H ASN 55 -4.229 -2.118 -8.858
383 HA ASN 55 HA ASN 55 -4.405 -1.449 -6.011
384 1HB ASN 55 2HB ASN 55 -3.196 0.065 -8.279
385 2HB ASN 55 1HB ASN 55 -3.376 0.722 -6.659
386 1HD2 ASN 55 1HD2 ASN 55 -0.954 0.587 -7.824
387 2HD2 ASN 55 2HD2 ASN 55 0.016 -0.615 -7.038
388 H LYS 56 H LYS 56 -5.486 0.405 -5.318
389 HA LYS 56 HA LYS 56 -7.387 1.640 -7.107
390 1HB LYS 56 2HB LYS 56 -9.041 0.207 -6.617
391 2HB LYS 56 1HB LYS 56 -8.079 -0.578 -5.376
392 1HG LYS 56 2HG LYS 56 -9.107 1.983 -4.504
393 2HG LYS 56 1HG LYS 56 -10.385 0.870 -4.998
394 1HD LYS 56 2HD LYS 56 -9.472 -0.837 -3.505
395 2HD LYS 56 1HD LYS 56 -8.180 0.266 -2.996
396 1HE LYS 56 2HE LYS 56 -9.898 0.315 -1.351
397 2HE LYS 56 1HE LYS 56 -9.953 1.843 -2.223
398 1HZ LYS 56 1HZ LYS 56 -11.757 0.802 -3.611
399 2HZ LYS 56 2HZ LYS 56 -12.175 1.128 -2.001
400 3HZ LYS 56 3HZ LYS 56 -11.806 -0.459 -2.478
401 H TYR 57 H TYR 57 -7.035 3.705 -6.706
402 HA TYR 57 HA TYR 57 -6.386 4.525 -3.952
403 1HB TYR 57 2HB TYR 57 -5.650 6.255 -6.215
404 2HB TYR 57 1HB TYR 57 -4.827 6.015 -4.692
405 HD1 TYR 57 1HD TYR 57 -5.058 4.988 -8.175
406 HD2 TYR 57 2HD TYR 57 -3.348 4.069 -4.390
407 HE1 TYR 57 1HE TYR 57 -3.446 3.485 -9.269
408 HE2 TYR 57 2HE TYR 57 -1.727 2.576 -5.471
409 HH TYR 57 HH TYR 57 -1.370 1.374 -7.435
410 H PHE 58 H PHE 58 -7.676 6.018 -3.015
411 HA PHE 58 HA PHE 58 -9.085 7.886 -4.797
412 1HB PHE 58 2HB PHE 58 -10.229 6.566 -2.320
413 2HB PHE 58 1HB PHE 58 -11.003 7.871 -3.212
414 HD1 PHE 58 1HD PHE 58 -10.295 4.324 -3.101
415 HD2 PHE 58 2HD PHE 58 -11.919 7.471 -5.459
416 HE1 PHE 58 1HE PHE 58 -11.392 2.666 -4.550
417 HE2 PHE 58 2HE PHE 58 -13.017 5.822 -6.912
418 HZ PHE 58 HZ PHE 58 -12.796 3.442 -6.457
419 HA PRO 59 HA PRO 59 -7.069 10.543 -1.658
420 1HB PRO 59 2HB PRO 59 -6.884 12.328 -4.010
421 2HB PRO 59 1HB PRO 59 -5.621 11.842 -2.870
422 1HG PRO 59 2HG PRO 59 -5.586 10.877 -5.329
423 2HG PRO 59 1HG PRO 59 -5.238 9.810 -3.962
424 1HD PRO 59 2HD PRO 59 -7.859 10.163 -5.420
425 2HD PRO 59 1HD PRO 59 -6.973 8.654 -5.080
426 HA PRO 60 HA PRO 60 -10.393 12.968 -0.356
427 1HB PRO 60 2HB PRO 60 -8.832 15.372 -1.217
428 2HB PRO 60 1HB PRO 60 -9.797 15.129 0.249
429 1HG PRO 60 2HG PRO 60 -7.202 14.786 0.401
430 2HG PRO 60 1HG PRO 60 -8.296 13.599 1.145
431 1HD PRO 60 2HD PRO 60 -6.692 13.387 -1.369
432 2HD PRO 60 1HD PRO 60 -7.099 12.136 -0.175
433 H ASP 61 H ASP 61 -12.192 13.416 -1.045
434 HA ASP 61 HA ASP 61 -12.666 14.770 -3.613
435 1HB ASP 61 2HB ASP 61 -12.990 12.379 -4.036
436 2HB ASP 61 1HB ASP 61 -13.997 12.255 -2.592
437 H SER 62 H SER 62 -14.525 13.199 -1.102
438 HA SER 62 HA SER 62 -15.238 15.374 0.403
439 1HB SER 62 2HB SER 62 -16.403 16.109 -1.712
440 2HB SER 62 1HB SER 62 -17.447 14.695 -1.553
441 HG SER 62 HG SER 62 -17.458 17.081 -0.173
442 H LYS 63 H LYS 63 -17.275 12.812 -1.000
443 HA LYS 63 HA LYS 63 -17.865 11.889 1.701
444 1HB LYS 63 2HB LYS 63 -19.766 10.818 0.862
445 2HB LYS 63 1HB LYS 63 -19.663 12.294 -0.079
446 1HG LYS 63 2HG LYS 63 -18.811 9.552 -0.996
447 2HG LYS 63 1HG LYS 63 -20.292 10.389 -1.458
448 1HD LYS 63 2HD LYS 63 -17.476 11.312 -2.033
449 2HD LYS 63 1HD LYS 63 -18.570 10.545 -3.194
450 1HE LYS 63 2HE LYS 63 -19.016 13.191 -1.808
451 2HE LYS 63 1HE LYS 63 -18.562 12.966 -3.497
452 1HZ LYS 63 1HZ LYS 63 -20.685 11.757 -3.806
453 2HZ LYS 63 2HZ LYS 63 -20.899 13.382 -3.369
454 3HZ LYS 63 3HZ LYS 63 -21.120 12.161 -2.215
455 H LEU 64 H LEU 64 -16.302 10.774 -1.245
456 HA LEU 64 HA LEU 64 -15.853 8.102 -0.581
457 1HB LEU 64 2HB LEU 64 -13.921 9.990 -1.952
458 2HB LEU 64 1HB LEU 64 -13.864 8.237 -2.010
459 HG LEU 64 HG LEU 64 -16.061 9.947 -3.180
460 1HD1 LEU 64 1HD1 LEU 64 -13.847 8.402 -4.523
461 2HD1 LEU 64 2HD1 LEU 64 -13.976 10.157 -4.417
462 3HD1 LEU 64 3HD1 LEU 64 -15.165 9.240 -5.341
463 1HD2 LEU 64 1HD2 LEU 64 -16.863 7.768 -2.405
464 2HD2 LEU 64 2HD2 LEU 64 -15.604 6.969 -3.342
465 3HD2 LEU 64 3HD2 LEU 64 -16.874 7.873 -4.165
466 H LEU 65 H LEU 65 -13.513 10.700 -0.305
467 HA LEU 65 HA LEU 65 -13.321 10.360 2.526
468 1HB LEU 65 2HB LEU 65 -11.554 8.864 1.124
469 2HB LEU 65 1HB LEU 65 -10.683 10.382 1.127
470 HG LEU 65 HG LEU 65 -9.762 9.313 2.941
471 1HD1 LEU 65 1HD1 LEU 65 -12.104 10.732 4.193
472 2HD1 LEU 65 2HD1 LEU 65 -10.593 11.479 3.671
473 3HD1 LEU 65 3HD1 LEU 65 -10.588 10.308 4.989
474 1HD2 LEU 65 1HD2 LEU 65 -11.223 7.360 2.860
475 2HD2 LEU 65 2HD2 LEU 65 -12.467 8.256 3.734
476 3HD2 LEU 65 3HD2 LEU 65 -10.923 7.899 4.512
477 H GLY 66 H GLY 66 -13.286 12.405 3.303
478 1HA GLY 66 2HA GLY 66 -12.402 14.520 1.436
479 2HA GLY 66 1HA GLY 66 -13.670 14.730 2.639
480 H ALA 67 H ALA 67 -12.414 13.458 4.784
481 HA ALA 67 HA ALA 67 -10.849 15.489 5.907
482 1HB ALA 67 1HB ALA 67 -12.091 13.789 7.184
483 2HB ALA 67 2HB ALA 67 -10.403 13.901 7.684
484 3HB ALA 67 3HB ALA 67 -10.931 12.572 6.650
485 H GLY 68 H GLY 68 -9.995 12.528 4.260
486 1HA GLY 68 2HA GLY 68 -7.312 13.493 3.751
487 2HA GLY 68 1HA GLY 68 -7.429 12.021 4.712
488 H GLY 69 H GLY 69 -6.390 10.828 3.016
489 1HA GLY 69 2HA GLY 69 -8.135 10.454 0.670
490 2HA GLY 69 1HA GLY 69 -6.393 10.241 0.630
491 H THR 70 H THR 70 -7.512 8.189 -0.356
492 HA THR 70 HA THR 70 -6.989 6.103 1.549
493 HB THR 70 HB THR 70 -9.238 5.018 0.478
494 HG1 THR 70 1HG THR 70 -9.552 7.528 -0.042
495 1HG2 THR 70 1HG2 THR 70 -10.171 5.222 2.686
496 2HG2 THR 70 2HG2 THR 70 -9.129 6.599 3.043
497 3HG2 THR 70 3HG2 THR 70 -8.424 4.994 2.825
498 H GLU 71 H GLU 71 -5.256 5.867 0.114
499 HA GLU 71 HA GLU 71 -5.897 4.751 -2.533
500 1HB GLU 71 2HB GLU 71 -3.197 5.628 -1.465
501 2HB GLU 71 1HB GLU 71 -3.599 5.237 -3.131
502 1HG GLU 71 2HG GLU 71 -5.089 7.188 -3.214
503 2HG GLU 71 1HG GLU 71 -4.635 7.586 -1.558
504 H HIS 72 H HIS 72 -6.176 2.542 -2.312
505 HA HIS 72 HA HIS 72 -4.355 1.232 -0.402
506 1HB HIS 72 2HB HIS 72 -6.677 -0.343 -1.342
507 2HB HIS 72 1HB HIS 72 -5.846 -0.331 0.204
508 HD1 HIS 72 1HD HIS 72 -8.381 -0.601 0.998
509 HD2 HIS 72 2HD HIS 72 -7.265 3.141 -0.431
510 HE1 HIS 72 1HE HIS 72 -10.128 0.991 1.819
511 HE2 HIS 72 2HE HIS 72 -9.588 3.185 0.715
512 H PHE 73 H PHE 73 -3.415 -0.653 -0.903
513 HA PHE 73 HA PHE 73 -3.236 -1.324 -3.753
514 1HB PHE 73 2HB PHE 73 -1.327 -1.519 -1.430
515 2HB PHE 73 1HB PHE 73 -1.041 -2.412 -2.923
516 HD1 PHE 73 1HD PHE 73 0.374 -1.404 -4.425
517 HD2 PHE 73 2HD PHE 73 -2.008 1.049 -1.893
518 HE1 PHE 73 1HE PHE 73 1.401 0.603 -5.410
519 HE2 PHE 73 2HE PHE 73 -0.975 3.060 -2.867
520 HZ PHE 73 HZ PHE 73 0.674 2.857 -4.639
521 H HIS 74 H HIS 74 -4.285 -3.108 -4.292
522 HA HIS 74 HA HIS 74 -5.011 -4.984 -2.150
523 1HB HIS 74 2HB HIS 74 -6.281 -4.299 -4.793
524 2HB HIS 74 1HB HIS 74 -6.706 -5.761 -3.921
525 HD1 HIS 74 1HD HIS 74 -9.101 -4.984 -3.653
526 HD2 HIS 74 2HD HIS 74 -6.332 -2.429 -1.867
527 HE1 HIS 74 1HE HIS 74 -10.440 -3.421 -2.214
528 HE2 HIS 74 2HE HIS 74 -8.710 -2.173 -0.886
529 H VAL 75 H VAL 75 -3.555 -6.660 -2.121
530 HA VAL 75 HA VAL 75 -2.823 -7.726 -4.753
531 HB VAL 75 HB VAL 75 -0.924 -8.812 -3.842
532 1HG1 VAL 75 1HG1 VAL 75 0.407 -7.027 -2.920
533 2HG1 VAL 75 2HG1 VAL 75 -1.051 -6.128 -2.484
534 3HG1 VAL 75 3HG1 VAL 75 -0.656 -6.397 -4.181
535 1HG2 VAL 75 1HG2 VAL 75 -1.976 -8.104 -1.117
536 2HG2 VAL 75 2HG2 VAL 75 -0.367 -8.782 -1.428
537 3HG2 VAL 75 3HG2 VAL 75 -1.820 -9.715 -1.825
538 H THR 76 H THR 76 -3.935 -9.368 -5.420
539 HA THR 76 HA THR 76 -5.329 -11.030 -3.450
540 HB THR 76 HB THR 76 -5.787 -10.829 -6.447
541 HG1 THR 76 1HG THR 76 -6.580 -8.943 -5.632
542 1HG2 THR 76 1HG2 THR 76 -6.438 -13.000 -5.511
543 2HG2 THR 76 2HG2 THR 76 -7.850 -12.065 -6.002
544 3HG2 THR 76 3HG2 THR 76 -7.420 -12.182 -4.295
545 H VAL 77 H VAL 77 -4.038 -12.621 -2.870
546 HA VAL 77 HA VAL 77 -2.936 -14.414 -4.850
547 HB VAL 77 HB VAL 77 -1.123 -12.841 -4.784
548 1HG1 VAL 77 1HG1 VAL 77 -1.260 -13.049 -1.777
549 2HG1 VAL 77 2HG1 VAL 77 -1.697 -11.647 -2.754
550 3HG1 VAL 77 3HG1 VAL 77 -0.018 -12.183 -2.684
551 1HG2 VAL 77 1HG2 VAL 77 -0.454 -15.202 -4.734
552 2HG2 VAL 77 2HG2 VAL 77 -0.426 -15.155 -2.968
553 3HG2 VAL 77 3HG2 VAL 77 0.713 -14.179 -3.897
554 H LYS 78 H LYS 78 -2.718 -16.479 -4.046
555 HA LYS 78 HA LYS 78 -2.421 -16.702 -1.156
556 1HB LYS 78 2HB LYS 78 -3.889 -18.474 -0.902
557 2HB LYS 78 1HB LYS 78 -4.750 -17.389 -1.971
558 1HG LYS 78 2HG LYS 78 -3.274 -19.868 -2.838
559 2HG LYS 78 1HG LYS 78 -5.012 -19.753 -2.572
560 1HD LYS 78 2HD LYS 78 -5.142 -18.048 -4.346
561 2HD LYS 78 1HD LYS 78 -3.407 -18.239 -4.632
562 1HE LYS 78 2HE LYS 78 -5.516 -20.376 -4.935
563 2HE LYS 78 1HE LYS 78 -4.697 -19.529 -6.245
564 1HZ LYS 78 1HZ LYS 78 -3.410 -21.328 -4.253
565 2HZ LYS 78 2HZ LYS 78 -2.598 -20.485 -5.480
566 3HZ LYS 78 3HZ LYS 78 -3.715 -21.688 -5.881
567 H ALA 79 H ALA 79 -0.360 -17.131 -0.981
568 HA ALA 79 HA ALA 79 0.701 -19.592 -1.894
569 1HB ALA 79 1HB ALA 79 2.484 -18.736 -3.324
570 2HB ALA 79 2HB ALA 79 1.836 -17.104 -3.163
571 3HB ALA 79 3HB ALA 79 0.902 -18.346 -3.996
572 H ALA 80 H ALA 80 2.322 -20.230 -0.602
573 HA ALA 80 HA ALA 80 2.927 -18.730 1.705
574 1HB ALA 80 1HB ALA 80 4.434 -20.524 2.289
575 2HB ALA 80 2HB ALA 80 4.386 -21.137 0.636
576 3HB ALA 80 3HB ALA 80 2.936 -21.185 1.638
577 H GLY 81 H GLY 81 3.913 -16.856 1.472
578 1HA GLY 81 2HA GLY 81 6.727 -16.819 0.877
579 2HA GLY 81 1HA GLY 81 5.757 -15.978 -0.332
580 H THR 82 H THR 82 7.565 -14.520 1.145
581 HA THR 82 HA THR 82 5.887 -13.273 3.211
582 HB THR 82 HB THR 82 8.770 -12.532 2.770
583 HG1 THR 82 1HG THR 82 8.991 -14.720 3.030
584 1HG2 THR 82 1HG2 THR 82 6.977 -12.690 5.201
585 2HG2 THR 82 2HG2 THR 82 7.431 -11.216 4.340
586 3HG2 THR 82 3HG2 THR 82 8.658 -12.146 5.202
587 H HIS 83 H HIS 83 5.128 -11.226 2.984
588 HA HIS 83 HA HIS 83 5.518 -10.041 0.318
589 1HB HIS 83 2HB HIS 83 3.144 -10.780 1.228
590 2HB HIS 83 1HB HIS 83 3.256 -9.307 2.174
591 HD1 HIS 83 1HD HIS 83 3.929 -7.102 0.576
592 HD2 HIS 83 2HD HIS 83 1.911 -10.296 -1.155
593 HE1 HIS 83 1HE HIS 83 2.852 -6.162 -1.494
594 HE2 HIS 83 2HE HIS 83 1.520 -8.084 -2.450
595 H ALA 84 H ALA 84 7.180 -8.604 0.559
596 HA ALA 84 HA ALA 84 7.023 -6.689 2.780
597 1HB ALA 84 1HB ALA 84 9.311 -6.044 2.118
598 2HB ALA 84 2HB ALA 84 9.251 -7.233 0.817
599 3HB ALA 84 3HB ALA 84 9.187 -7.764 2.495
600 H VAL 85 H VAL 85 6.276 -4.700 2.431
601 HA VAL 85 HA VAL 85 5.689 -4.027 -0.382
602 HB VAL 85 HB VAL 85 4.125 -2.970 1.933
603 1HG1 VAL 85 1HG1 VAL 85 2.368 -2.746 0.257
604 2HG1 VAL 85 2HG1 VAL 85 3.446 -3.440 -0.957
605 3HG1 VAL 85 3HG1 VAL 85 3.841 -1.892 -0.208
606 1HG2 VAL 85 1HG2 VAL 85 4.112 -5.391 2.190
607 2HG2 VAL 85 2HG2 VAL 85 3.607 -5.573 0.507
608 3HG2 VAL 85 3HG2 VAL 85 2.527 -4.805 1.672
609 H ASN 86 H ASN 86 7.067 -2.509 -1.028
610 HA ASN 86 HA ASN 86 7.519 -0.179 0.731
611 1HB ASN 86 2HB ASN 86 9.095 -0.978 -1.736
612 2HB ASN 86 1HB ASN 86 9.473 0.334 -0.629
613 1HD2 ASN 86 1HD2 ASN 86 8.602 -1.537 1.612
614 2HD2 ASN 86 2HD2 ASN 86 10.012 -2.515 1.880
615 H LEU 87 H LEU 87 5.970 1.223 0.309
616 HA LEU 87 HA LEU 87 5.239 1.692 -2.497
617 1HB LEU 87 2HB LEU 87 3.698 2.294 0.028
618 2HB LEU 87 1HB LEU 87 3.155 2.643 -1.607
619 HG LEU 87 HG LEU 87 3.729 -0.145 -0.589
620 1HD1 LEU 87 1HD1 LEU 87 1.300 -0.414 -0.522
621 2HD1 LEU 87 2HD1 LEU 87 1.100 1.293 -0.915
622 3HD1 LEU 87 3HD1 LEU 87 1.843 0.821 0.613
623 1HD2 LEU 87 1HD2 LEU 87 2.382 0.867 -3.079
624 2HD2 LEU 87 2HD2 LEU 87 2.528 -0.823 -2.596
625 3HD2 LEU 87 3HD2 LEU 87 3.972 0.111 -2.985
626 H THR 88 H THR 88 5.841 3.530 -3.377
627 HA THR 88 HA THR 88 7.130 5.503 -1.639
628 HB THR 88 HB THR 88 7.477 5.314 -4.624
629 HG1 THR 88 1HG THR 88 8.075 3.300 -4.072
630 1HG2 THR 88 1HG2 THR 88 9.291 6.220 -2.374
631 2HG2 THR 88 2HG2 THR 88 8.390 7.280 -3.458
632 3HG2 THR 88 3HG2 THR 88 9.680 6.261 -4.094
633 H TYR 89 H TYR 89 6.139 7.306 -1.305
634 HA TYR 89 HA TYR 89 3.796 8.088 -2.828
635 1HB TYR 89 2HB TYR 89 3.924 8.113 -0.299
636 2HB TYR 89 1HB TYR 89 5.078 9.433 -0.433
637 HD1 TYR 89 1HD TYR 89 1.590 8.451 -1.059
638 HD2 TYR 89 2HD TYR 89 4.345 11.660 -0.787
639 HE1 TYR 89 1HE TYR 89 -0.282 10.036 -1.054
640 HE2 TYR 89 2HE TYR 89 2.483 13.259 -0.786
641 HH TYR 89 HH TYR 89 -0.811 12.237 -0.456
642 H MET 90 H MET 90 4.595 8.847 -4.789
643 HA MET 90 HA MET 90 6.277 11.265 -4.637
644 1HB MET 90 2HB MET 90 6.568 9.561 -7.035
645 2HB MET 90 1HB MET 90 7.743 10.595 -6.245
646 1HG MET 90 2HG MET 90 8.215 8.956 -4.604
647 2HG MET 90 1HG MET 90 6.867 7.948 -5.141
648 1HE MET 90 1HE MET 90 8.094 7.043 -8.798
649 2HE MET 90 2HE MET 90 7.178 8.474 -8.318
650 3HE MET 90 3HE MET 90 6.765 6.895 -7.646
651 H ARG 91 H ARG 91 6.072 12.661 -6.490
652 HA ARG 91 HA ARG 91 3.631 12.892 -7.823
653 1HB ARG 91 2HB ARG 91 6.453 13.758 -8.447
654 2HB ARG 91 1HB ARG 91 5.180 13.986 -9.640
655 1HG ARG 91 2HG ARG 91 3.933 15.335 -7.987
656 2HG ARG 91 1HG ARG 91 5.282 15.140 -6.862
657 1HD ARG 91 2HD ARG 91 6.737 16.088 -8.749
658 2HD ARG 91 1HD ARG 91 5.219 16.600 -9.487
659 HE ARG 91 HE ARG 91 5.027 17.599 -6.989
660 1HH1 ARG 91 1HH1 ARG 91 7.442 17.849 -9.521
661 2HH1 ARG 91 2HH1 ARG 91 8.087 19.355 -8.933
662 1HH2 ARG 91 1HH2 ARG 91 5.874 19.581 -6.217
663 2HH2 ARG 91 2HH2 ARG 91 7.191 20.341 -7.066
664 HA PRO 92 HA PRO 92 3.796 8.913 -9.832
665 1HB PRO 92 2HB PRO 92 1.771 9.557 -11.680
666 2HB PRO 92 1HB PRO 92 1.567 8.757 -10.123
667 1HG PRO 92 2HG PRO 92 1.171 11.608 -10.858
668 2HG PRO 92 1HG PRO 92 0.327 10.626 -9.647
669 1HD PRO 92 2HD PRO 92 2.142 12.481 -8.960
670 2HD PRO 92 1HD PRO 92 1.961 10.968 -8.052
671 H TRP 93 H TRP 93 4.095 11.925 -11.592
672 HA TRP 93 HA TRP 93 5.006 10.501 -13.970
673 1HB TRP 93 2HB TRP 93 4.969 12.737 -15.052
674 2HB TRP 93 1HB TRP 93 3.410 12.268 -14.386
675 HD1 TRP 93 HD TRP 93 6.164 14.859 -14.027
676 HE1 TRP 93 1HE TRP 93 5.386 16.704 -12.406
677 HE3 TRP 93 3HE TRP 93 1.865 12.678 -12.316
678 HZ2 TRP 93 2HZ TRP 93 3.229 17.176 -10.658
679 HZ3 TRP 93 3HZ TRP 93 0.502 13.896 -10.668
680 HH2 TRP 93 HH TRP 93 1.172 16.100 -9.858
681 H THR 94 H THR 94 6.433 11.427 -11.199
682 HA THR 94 HA THR 94 9.037 11.186 -12.216
683 HB THR 94 HB THR 94 8.906 13.390 -13.094
684 HG1 THR 94 1HG THR 94 10.869 13.372 -12.264
685 1HG2 THR 94 1HG2 THR 94 7.955 14.325 -10.387
686 2HG2 THR 94 2HG2 THR 94 6.979 14.224 -11.851
687 3HG2 THR 94 3HG2 THR 94 8.322 15.363 -11.764
688 H GLY 95 H GLY 95 7.647 13.168 -9.572
689 1HA GLY 95 2HA GLY 95 7.720 12.833 -7.269
690 2HA GLY 95 1HA GLY 95 8.423 11.241 -7.589
691 HA PRO 96 HA PRO 96 11.789 15.058 -7.230
692 1HB PRO 96 2HB PRO 96 10.082 15.570 -4.803
693 2HB PRO 96 1HB PRO 96 11.209 16.651 -5.613
694 1HG PRO 96 2HG PRO 96 8.639 16.882 -6.118
695 2HG PRO 96 1HG PRO 96 9.812 16.977 -7.446
696 1HD PRO 96 2HD PRO 96 7.934 14.795 -6.742
697 2HD PRO 96 1HD PRO 96 8.608 15.244 -8.321
698 H SER 97 H SER 97 13.446 13.790 -6.619
699 HA SER 97 HA SER 97 12.922 11.441 -5.073
700 1HB SER 97 2HB SER 97 14.392 11.598 -7.135
701 2HB SER 97 1HB SER 97 15.598 12.372 -6.110
702 HG SER 97 HG SER 97 15.572 9.929 -6.460
703 H HIS 98 H HIS 98 13.342 14.420 -3.975
704 HA HIS 98 HA HIS 98 14.629 13.397 -1.536
705 1HB HIS 98 2HB HIS 98 14.924 16.180 -2.694
706 2HB HIS 98 1HB HIS 98 15.552 15.659 -1.135
707 HD1 HIS 98 1HD HIS 98 16.283 15.619 -4.764
708 HD2 HIS 98 2HD HIS 98 17.767 13.862 -1.294
709 HE1 HIS 98 1HE HIS 98 18.518 14.651 -5.394
710 HE2 HIS 98 2HE HIS 98 19.345 13.487 -3.315
711 H ASP 99 H ASP 99 11.788 14.232 -2.831
712 HA ASP 99 HA ASP 99 10.860 15.516 -0.340
713 1HB ASP 99 2HB ASP 99 10.995 17.042 -2.363
714 2HB ASP 99 1HB ASP 99 9.716 16.071 -3.088
715 H SER 100 H SER 100 10.774 12.783 -2.075
716 HA SER 100 HA SER 100 7.922 12.250 -1.937
717 1HB SER 100 2HB SER 100 10.204 10.451 -2.795
718 2HB SER 100 1HB SER 100 8.484 10.129 -3.019
719 HG SER 100 HG SER 100 10.013 12.227 -4.178
720 H GLU 101 H GLU 101 6.975 10.660 -0.668
721 HA GLU 101 HA GLU 101 8.502 9.859 1.714
722 1HB GLU 101 2HB GLU 101 6.402 11.090 2.113
723 2HB GLU 101 1HB GLU 101 5.512 9.891 1.192
724 1HG GLU 101 2HG GLU 101 5.206 9.584 3.581
725 2HG GLU 101 1HG GLU 101 6.026 8.199 2.861
726 H ARG 102 H ARG 102 7.888 7.557 2.536
727 HA ARG 102 HA ARG 102 6.908 5.771 0.488
728 1HB ARG 102 2HB ARG 102 9.456 6.077 0.142
729 2HB ARG 102 1HB ARG 102 9.640 5.164 1.633
730 1HG ARG 102 2HG ARG 102 8.505 3.265 0.648
731 2HG ARG 102 1HG ARG 102 8.212 4.179 -0.830
732 1HD ARG 102 2HD ARG 102 10.807 4.448 -0.840
733 2HD ARG 102 1HD ARG 102 10.766 3.049 0.232
734 HE ARG 102 HE ARG 102 9.248 2.748 -2.223
735 1HH1 ARG 102 1HH1 ARG 102 12.312 2.203 -0.591
736 2HH1 ARG 102 2HH1 ARG 102 12.918 1.137 -1.830
737 1HH2 ARG 102 1HH2 ARG 102 10.043 1.316 -3.819
738 2HH2 ARG 102 2HH2 ARG 102 11.625 0.623 -3.641
739 H PHE 103 H PHE 103 6.052 4.001 1.245
740 HA PHE 103 HA PHE 103 5.880 3.650 4.153
741 1HB PHE 103 2HB PHE 103 3.710 3.947 3.345
742 2HB PHE 103 1HB PHE 103 4.070 3.172 1.812
743 HD1 PHE 103 1HD PHE 103 3.017 2.703 5.250
744 HD2 PHE 103 2HD PHE 103 3.986 0.770 1.590
745 HE1 PHE 103 1HE PHE 103 1.951 0.645 6.056
746 HE2 PHE 103 2HE PHE 103 2.924 -1.294 2.392
747 HZ PHE 103 HZ PHE 103 1.907 -1.352 4.627
748 H THR 104 H THR 104 5.864 1.381 4.935
749 HA THR 104 HA THR 104 6.831 -0.646 3.162
750 HB THR 104 HB THR 104 8.697 0.459 5.274
751 HG1 THR 104 1HG THR 104 8.441 1.018 2.710
752 1HG2 THR 104 1HG2 THR 104 8.992 -2.011 3.559
753 2HG2 THR 104 2HG2 THR 104 8.733 -1.983 5.303
754 3HG2 THR 104 3HG2 THR 104 10.231 -1.345 4.624
755 H VAL 105 H VAL 105 5.147 -1.926 3.883
756 HA VAL 105 HA VAL 105 5.373 -2.676 6.708
757 HB VAL 105 HB VAL 105 3.110 -2.114 5.834
758 1HG1 VAL 105 1HG1 VAL 105 3.302 -3.019 3.591
759 2HG1 VAL 105 2HG1 VAL 105 1.934 -3.732 4.445
760 3HG1 VAL 105 3HG1 VAL 105 3.425 -4.652 4.249
761 1HG2 VAL 105 1HG2 VAL 105 2.025 -4.163 6.783
762 2HG2 VAL 105 2HG2 VAL 105 3.240 -3.395 7.797
763 3HG2 VAL 105 3HG2 VAL 105 3.638 -4.865 6.908
764 H TYR 106 H TYR 106 6.140 -4.580 7.301
765 HA TYR 106 HA TYR 106 6.914 -6.471 5.198
766 1HB TYR 106 2HB TYR 106 7.840 -6.267 8.064
767 2HB TYR 106 1HB TYR 106 8.336 -7.499 6.922
768 HD1 TYR 106 1HD TYR 106 9.611 -6.765 4.846
769 HD2 TYR 106 2HD TYR 106 8.987 -4.224 8.202
770 HE1 TYR 106 1HE TYR 106 11.445 -5.324 4.087
771 HE2 TYR 106 2HE TYR 106 10.827 -2.774 7.451
772 HH TYR 106 HH TYR 106 12.179 -2.978 4.348
773 H LEU 107 H LEU 107 5.549 -8.047 4.918
774 HA LEU 107 HA LEU 107 4.203 -9.192 7.251
775 1HB LEU 107 2HB LEU 107 2.900 -8.302 4.691
776 2HB LEU 107 1HB LEU 107 2.104 -9.270 5.915
777 HG LEU 107 HG LEU 107 3.266 -6.595 6.585
778 1HD1 LEU 107 1HD1 LEU 107 1.868 -6.290 4.618
779 2HD1 LEU 107 2HD1 LEU 107 1.117 -5.598 6.056
780 3HD1 LEU 107 3HD1 LEU 107 0.549 -7.141 5.421
781 1HD2 LEU 107 1HD2 LEU 107 0.963 -8.202 7.685
782 2HD2 LEU 107 2HD2 LEU 107 1.484 -6.620 8.269
783 3HD2 LEU 107 3HD2 LEU 107 2.552 -8.015 8.430
784 H LYS 108 H LYS 108 3.212 -11.321 6.687
785 HA LYS 108 HA LYS 108 4.746 -12.591 4.517
786 1HB LYS 108 2HB LYS 108 5.324 -13.219 6.925
787 2HB LYS 108 1HB LYS 108 3.756 -14.010 6.975
788 1HG LYS 108 2HG LYS 108 4.394 -15.393 5.074
789 2HG LYS 108 1HG LYS 108 5.988 -14.631 5.061
790 1HD LYS 108 2HD LYS 108 6.295 -15.390 7.420
791 2HD LYS 108 1HD LYS 108 4.797 -16.307 7.263
792 1HE LYS 108 2HE LYS 108 5.750 -17.619 5.471
793 2HE LYS 108 1HE LYS 108 7.226 -16.654 5.517
794 1HZ LYS 108 1HZ LYS 108 6.216 -18.273 7.790
795 2HZ LYS 108 2HZ LYS 108 7.701 -17.462 7.702
796 3HZ LYS 108 3HZ LYS 108 7.405 -18.795 6.701
797 H ALA 109 H ALA 109 3.587 -13.579 2.979
798 HA ALA 109 HA ALA 109 0.672 -13.530 3.324
799 1HB ALA 109 1HB ALA 109 0.561 -13.435 0.889
800 2HB ALA 109 2HB ALA 109 2.319 -13.541 0.799
801 3HB ALA 109 3HB ALA 109 1.558 -12.126 1.528
802 H ASN 110 H ASN 110 -0.457 -15.345 3.289
803 HA ASN 110 HA ASN 110 0.092 -17.716 1.997
804 1HB ASN 110 2HB ASN 110 0.971 -19.182 3.798
805 2HB ASN 110 1HB ASN 110 2.131 -17.976 3.284
806 1HD2 ASN 110 1HD2 ASN 110 1.045 -15.801 4.812
807 2HD2 ASN 110 2HD2 ASN 110 1.419 -16.125 6.463
Start of MODEL 11
1 H HIS 3 H HIS 3 -6.044 -10.377 4.274
2 HA HIS 3 HA HIS 3 -5.498 -9.107 6.874
3 1HB HIS 3 2HB HIS 3 -3.644 -10.591 6.557
4 2HB HIS 3 1HB HIS 3 -3.599 -10.232 4.826
5 HD1 HIS 3 1HD HIS 3 -3.164 -8.178 8.026
6 HD2 HIS 3 2HD HIS 3 -1.536 -8.636 4.216
7 HE1 HIS 3 1HE HIS 3 -1.294 -6.505 7.881
8 HE2 HIS 3 2HE HIS 3 -0.276 -6.850 5.603
9 H LYS 4 H LYS 4 -5.013 -6.937 6.838
10 HA LYS 4 HA LYS 4 -4.770 -5.604 4.258
11 1HB LYS 4 2HB LYS 4 -6.454 -3.892 4.924
12 2HB LYS 4 1HB LYS 4 -7.126 -5.489 4.631
13 1HG LYS 4 2HG LYS 4 -6.420 -4.798 7.427
14 2HG LYS 4 1HG LYS 4 -7.829 -4.013 6.714
15 1HD LYS 4 2HD LYS 4 -8.713 -6.250 6.105
16 2HD LYS 4 1HD LYS 4 -7.343 -6.986 6.938
17 1HE LYS 4 2HE LYS 4 -9.280 -5.107 8.274
18 2HE LYS 4 1HE LYS 4 -9.500 -6.855 8.246
19 1HZ LYS 4 1HZ LYS 4 -7.075 -5.525 9.333
20 2HZ LYS 4 2HZ LYS 4 -7.503 -7.161 9.469
21 3HZ LYS 4 3HZ LYS 4 -8.404 -5.978 10.282
22 H VAL 5 H VAL 5 -3.491 -3.790 4.303
23 HA VAL 5 HA VAL 5 -2.399 -3.097 6.948
24 HB VAL 5 HB VAL 5 -1.137 -3.169 4.251
25 1HG1 VAL 5 1HG1 VAL 5 -0.431 -1.100 6.320
26 2HG1 VAL 5 2HG1 VAL 5 -0.923 -0.815 4.651
27 3HG1 VAL 5 3HG1 VAL 5 0.630 -1.581 4.997
28 1HG2 VAL 5 1HG2 VAL 5 -0.690 -4.826 6.013
29 2HG2 VAL 5 2HG2 VAL 5 -0.080 -3.528 7.049
30 3HG2 VAL 5 3HG2 VAL 5 0.756 -3.926 5.549
31 H THR 6 H THR 6 -2.707 -1.199 7.797
32 HA THR 6 HA THR 6 -3.626 1.020 6.121
33 HB THR 6 HB THR 6 -4.225 1.936 8.537
34 HG1 THR 6 1HG THR 6 -5.119 -0.355 9.417
35 1HG2 THR 6 1HG2 THR 6 -6.487 0.904 8.250
36 2HG2 THR 6 2HG2 THR 6 -5.813 -0.089 6.954
37 3HG2 THR 6 3HG2 THR 6 -5.854 1.667 6.791
38 H LYS 7 H LYS 7 -2.944 3.217 7.138
39 HA LYS 7 HA LYS 7 -0.411 3.708 6.423
40 1HB LYS 7 2HB LYS 7 -2.096 5.426 6.884
41 2HB LYS 7 1HB LYS 7 -1.842 5.209 8.610
42 1HG LYS 7 2HG LYS 7 -0.700 7.193 7.616
43 2HG LYS 7 1HG LYS 7 0.373 6.085 8.471
44 1HD LYS 7 2HD LYS 7 1.221 5.198 6.451
45 2HD LYS 7 1HD LYS 7 -0.058 5.949 5.494
46 1HE LYS 7 2HE LYS 7 2.064 7.129 5.227
47 2HE LYS 7 1HE LYS 7 0.861 8.158 5.998
48 1HZ LYS 7 1HZ LYS 7 3.121 8.264 6.990
49 2HZ LYS 7 2HZ LYS 7 2.932 6.661 7.499
50 3HZ LYS 7 3HZ LYS 7 1.898 7.865 8.095
51 H ALA 8 H ALA 8 -1.219 2.914 9.841
52 HA ALA 8 HA ALA 8 1.244 3.564 10.967
53 1HB ALA 8 1HB ALA 8 -0.536 1.284 11.805
54 2HB ALA 8 2HB ALA 8 -0.763 2.972 12.265
55 3HB ALA 8 3HB ALA 8 0.674 2.097 12.798
56 H HIS 9 H HIS 9 0.314 0.768 9.125
57 HA HIS 9 HA HIS 9 2.497 -0.897 9.805
58 1HB HIS 9 2HB HIS 9 0.793 -0.868 7.327
59 2HB HIS 9 1HB HIS 9 1.969 -2.111 7.713
60 HD1 HIS 9 1HD HIS 9 -1.417 -0.897 8.578
61 HD2 HIS 9 2HD HIS 9 1.168 -3.931 9.719
62 HE1 HIS 9 1HE HIS 9 -2.869 -2.670 9.606
63 HE2 HIS 9 2HE HIS 9 -1.277 -4.430 10.435
64 H ASN 10 H ASN 10 2.492 2.017 8.212
65 HA ASN 10 HA ASN 10 4.396 1.881 6.224
66 1HB ASN 10 2HB ASN 10 3.184 3.960 7.117
67 2HB ASN 10 1HB ASN 10 4.380 3.996 8.408
68 1HD2 ASN 10 1HD2 ASN 10 6.575 3.225 6.585
69 2HD2 ASN 10 2HD2 ASN 10 6.887 4.632 5.619
70 H GLY 11 H GLY 11 4.675 1.005 9.508
71 1HA GLY 11 2HA GLY 11 7.498 0.335 9.068
72 2HA GLY 11 1HA GLY 11 7.107 1.281 10.499
73 H ALA 12 H ALA 12 5.582 -1.528 8.893
74 HA ALA 12 HA ALA 12 5.304 -2.728 11.578
75 1HB ALA 12 1HB ALA 12 3.174 -2.271 10.697
76 2HB ALA 12 2HB ALA 12 3.413 -4.009 10.487
77 3HB ALA 12 3HB ALA 12 3.608 -2.916 9.116
78 H THR 13 H THR 13 5.439 -4.976 11.838
79 HA THR 13 HA THR 13 6.320 -6.642 9.613
80 HB THR 13 HB THR 13 7.904 -6.504 12.195
81 HG1 THR 13 1HG THR 13 8.106 -5.095 9.928
82 1HG2 THR 13 1HG2 THR 13 7.742 -8.779 11.281
83 2HG2 THR 13 2HG2 THR 13 9.379 -8.140 11.130
84 3HG2 THR 13 3HG2 THR 13 8.319 -8.192 9.721
85 H LEU 14 H LEU 14 4.779 -8.162 9.644
86 HA LEU 14 HA LEU 14 4.152 -9.613 12.055
87 1HB LEU 14 2HB LEU 14 1.687 -9.119 11.791
88 2HB LEU 14 1HB LEU 14 2.688 -7.843 12.447
89 HG LEU 14 HG LEU 14 2.741 -6.835 10.125
90 1HD1 LEU 14 1HD1 LEU 14 0.991 -7.467 8.584
91 2HD1 LEU 14 2HD1 LEU 14 0.455 -8.740 9.682
92 3HD1 LEU 14 3HD1 LEU 14 2.042 -8.844 8.920
93 1HD2 LEU 14 1HD2 LEU 14 0.530 -5.814 10.375
94 2HD2 LEU 14 2HD2 LEU 14 1.393 -5.912 11.910
95 3HD2 LEU 14 3HD2 LEU 14 0.100 -7.056 11.552
96 H THR 15 H THR 15 2.432 -11.323 11.614
97 HA THR 15 HA THR 15 3.019 -12.509 8.987
98 HB THR 15 HB THR 15 1.991 -13.745 11.549
99 HG1 THR 15 1HG THR 15 4.470 -13.338 10.520
100 1HG2 THR 15 1HG2 THR 15 0.986 -14.757 9.503
101 2HG2 THR 15 2HG2 THR 15 1.998 -15.877 10.428
102 3HG2 THR 15 3HG2 THR 15 2.619 -15.144 8.950
103 H VAL 16 H VAL 16 1.355 -13.336 7.666
104 HA VAL 16 HA VAL 16 -1.367 -12.506 8.413
105 HB VAL 16 HB VAL 16 -1.802 -11.660 6.224
106 1HG1 VAL 16 1HG1 VAL 16 -0.198 -9.805 6.100
107 2HG1 VAL 16 2HG1 VAL 16 0.875 -10.669 7.201
108 3HG1 VAL 16 3HG1 VAL 16 -0.707 -10.124 7.758
109 1HG2 VAL 16 1HG2 VAL 16 -0.116 -11.616 4.447
110 2HG2 VAL 16 2HG2 VAL 16 -0.538 -13.264 4.909
111 3HG2 VAL 16 3HG2 VAL 16 0.984 -12.555 5.467
112 H ALA 17 H ALA 17 -3.059 -13.648 7.326
113 HA ALA 17 HA ALA 17 -2.258 -16.220 6.137
114 1HB ALA 17 1HB ALA 17 -4.598 -16.915 6.740
115 2HB ALA 17 2HB ALA 17 -4.758 -15.378 7.598
116 3HB ALA 17 3HB ALA 17 -3.562 -16.562 8.124
117 H VAL 18 H VAL 18 -2.649 -16.403 3.980
118 HA VAL 18 HA VAL 18 -4.307 -14.288 2.777
119 HB VAL 18 HB VAL 18 -3.196 -14.727 0.675
120 1HG1 VAL 18 1HG1 VAL 18 -0.839 -14.182 1.369
121 2HG1 VAL 18 2HG1 VAL 18 -1.385 -14.352 3.042
122 3HG1 VAL 18 3HG1 VAL 18 -2.098 -13.122 1.999
123 1HG2 VAL 18 1HG2 VAL 18 -2.867 -17.118 0.847
124 2HG2 VAL 18 2HG2 VAL 18 -1.698 -16.888 2.149
125 3HG2 VAL 18 3HG2 VAL 18 -1.327 -16.319 0.521
126 H GLY 19 H GLY 19 -4.786 -15.456 0.314
127 1HA GLY 19 2HA GLY 19 -5.871 -17.439 -0.589
128 2HA GLY 19 1HA GLY 19 -6.539 -17.735 1.012
129 H GLU 20 H GLU 20 -7.584 -15.449 1.783
130 HA GLU 20 HA GLU 20 -9.792 -14.941 0.030
131 1HB GLU 20 2HB GLU 20 -8.921 -13.337 2.444
132 2HB GLU 20 1HB GLU 20 -10.515 -13.349 1.709
133 1HG GLU 20 2HG GLU 20 -9.231 -15.707 3.058
134 2HG GLU 20 1HG GLU 20 -10.386 -14.612 3.816
135 H LEU 21 H LEU 21 -7.643 -12.610 1.530
136 HA LEU 21 HA LEU 21 -6.703 -11.440 -0.877
137 1HB LEU 21 2HB LEU 21 -8.916 -10.541 -1.055
138 2HB LEU 21 1HB LEU 21 -8.938 -10.105 0.639
139 HG LEU 21 HG LEU 21 -7.197 -8.393 0.190
140 1HD1 LEU 21 1HD1 LEU 21 -6.169 -9.390 -1.769
141 2HD1 LEU 21 2HD1 LEU 21 -6.742 -7.762 -2.132
142 3HD1 LEU 21 3HD1 LEU 21 -7.658 -9.163 -2.686
143 1HD2 LEU 21 1HD2 LEU 21 -9.697 -8.168 -1.481
144 2HD2 LEU 21 2HD2 LEU 21 -8.681 -6.823 -0.957
145 3HD2 LEU 21 3HD2 LEU 21 -9.556 -7.784 0.235
146 H VAL 22 H VAL 22 -4.921 -10.213 -0.431
147 HA VAL 22 HA VAL 22 -4.607 -9.296 2.339
148 HB VAL 22 HB VAL 22 -2.699 -10.862 0.677
149 1HG1 VAL 22 1HG1 VAL 22 -1.441 -8.804 0.666
150 2HG1 VAL 22 2HG1 VAL 22 -0.737 -9.860 1.890
151 3HG1 VAL 22 3HG1 VAL 22 -1.782 -8.523 2.370
152 1HG2 VAL 22 1HG2 VAL 22 -3.159 -10.422 3.617
153 2HG2 VAL 22 2HG2 VAL 22 -1.977 -11.544 2.941
154 3HG2 VAL 22 3HG2 VAL 22 -3.697 -11.790 2.641
155 H GLU 23 H GLU 23 -4.976 -7.177 2.279
156 HA GLU 23 HA GLU 23 -4.047 -5.760 -0.121
157 1HB GLU 23 2HB GLU 23 -5.822 -4.259 -0.016
158 2HB GLU 23 1HB GLU 23 -6.545 -5.814 0.341
159 1HG GLU 23 2HG GLU 23 -6.865 -5.293 2.583
160 2HG GLU 23 1HG GLU 23 -5.713 -3.963 2.533
161 H ILE 24 H ILE 24 -3.488 -3.560 0.111
162 HA ILE 24 HA ILE 24 -2.230 -2.857 2.667
163 HB ILE 24 HB ILE 24 -0.965 -2.638 -0.068
164 1HG1 ILE 24 2HG1 ILE 24 -1.109 -4.978 0.824
165 2HG1 ILE 24 1HG1 ILE 24 0.539 -4.418 0.532
166 1HG2 ILE 24 1HG2 ILE 24 -0.291 -0.847 1.404
167 2HG2 ILE 24 2HG2 ILE 24 1.051 -1.962 1.143
168 3HG2 ILE 24 3HG2 ILE 24 0.144 -2.013 2.655
169 1HD1 ILE 24 1HD1 ILE 24 0.343 -5.658 2.627
170 2HD1 ILE 24 2HD1 ILE 24 -0.858 -4.506 3.214
171 3HD1 ILE 24 3HD1 ILE 24 0.802 -3.982 2.924
172 H GLN 25 H GLN 25 -3.428 -1.034 3.176
173 HA GLN 25 HA GLN 25 -4.047 0.750 0.928
174 1HB GLN 25 2HB GLN 25 -6.050 -0.111 1.882
175 2HB GLN 25 1HB GLN 25 -5.527 0.293 3.517
176 1HG GLN 25 2HG GLN 25 -5.609 2.551 1.680
177 2HG GLN 25 1HG GLN 25 -7.172 1.788 1.931
178 1HE2 GLN 25 1HE2 GLN 25 -4.598 2.046 4.356
179 2HE2 GLN 25 2HE2 GLN 25 -5.487 3.091 5.410
180 H LEU 26 H LEU 26 -3.516 2.799 0.952
181 HA LEU 26 HA LEU 26 -2.364 3.888 3.416
182 1HB LEU 26 2HB LEU 26 -1.608 4.264 0.555
183 2HB LEU 26 1HB LEU 26 -1.377 5.596 1.670
184 HG LEU 26 HG LEU 26 0.684 4.423 1.478
185 1HD1 LEU 26 1HD1 LEU 26 -0.670 3.747 4.074
186 2HD1 LEU 26 2HD1 LEU 26 0.199 5.235 3.686
187 3HD1 LEU 26 3HD1 LEU 26 1.070 3.705 3.794
188 1HD2 LEU 26 1HD2 LEU 26 0.923 2.056 2.022
189 2HD2 LEU 26 2HD2 LEU 26 -0.160 2.296 0.649
190 3HD2 LEU 26 3HD2 LEU 26 -0.822 1.930 2.242
191 HA PRO 27 HA PRO 27 -5.801 6.669 3.204
192 1HB PRO 27 2HB PRO 27 -5.042 8.425 5.066
193 2HB PRO 27 1HB PRO 27 -5.466 6.760 5.503
194 1HG PRO 27 2HG PRO 27 -2.746 7.972 5.068
195 2HG PRO 27 1HG PRO 27 -3.314 6.927 6.391
196 1HD PRO 27 2HD PRO 27 -1.900 6.009 4.271
197 2HD PRO 27 1HD PRO 27 -3.085 5.020 5.142
198 H SER 28 H SER 28 -3.003 7.152 1.761
199 HA SER 28 HA SER 28 -2.004 8.695 0.473
200 1HB SER 28 2HB SER 28 -4.393 9.042 -0.351
201 2HB SER 28 1HB SER 28 -4.449 10.438 0.730
202 HG SER 28 HG SER 28 -2.689 9.993 -1.459
203 H ASN 29 H ASN 29 -3.918 10.488 2.815
204 HA ASN 29 HA ASN 29 -3.467 12.257 4.167
205 1HB ASN 29 2HB ASN 29 -0.534 11.620 4.117
206 2HB ASN 29 1HB ASN 29 -1.486 12.264 5.442
207 1HD2 ASN 29 1HD2 ASN 29 -0.121 9.543 4.019
208 2HD2 ASN 29 2HD2 ASN 29 -0.765 8.347 5.092
209 HA PRO 30 HA PRO 30 -2.248 13.825 -0.061
210 1HB PRO 30 2HB PRO 30 -4.178 15.914 0.873
211 2HB PRO 30 1HB PRO 30 -3.997 15.183 -0.731
212 1HG PRO 30 2HG PRO 30 -5.939 14.317 0.786
213 2HG PRO 30 1HG PRO 30 -4.889 13.122 -0.008
214 1HD PRO 30 2HD PRO 30 -4.828 14.077 2.828
215 2HD PRO 30 1HD PRO 30 -4.735 12.416 2.200
216 H THR 31 H THR 31 -0.349 14.623 -0.126
217 HA THR 31 HA THR 31 0.668 16.453 1.825
218 HB THR 31 HB THR 31 2.783 16.198 0.485
219 HG1 THR 31 1HG THR 31 1.634 14.085 -0.942
220 1HG2 THR 31 1HG2 THR 31 2.114 14.646 2.354
221 2HG2 THR 31 2HG2 THR 31 3.179 13.924 1.145
222 3HG2 THR 31 3HG2 THR 31 1.452 13.562 1.122
223 H THR 32 H THR 32 0.989 16.560 -1.684
224 HA THR 32 HA THR 32 0.014 19.194 -2.047
225 HB THR 32 HB THR 32 1.993 19.868 -0.815
226 HG1 THR 32 1HG THR 32 1.751 20.398 -3.533
227 1HG2 THR 32 1HG2 THR 32 3.568 18.264 -2.840
228 2HG2 THR 32 2HG2 THR 32 3.366 17.875 -1.133
229 3HG2 THR 32 3HG2 THR 32 4.260 19.319 -1.607
230 H GLY 33 H GLY 33 1.375 16.288 -3.080
231 1HA GLY 33 2HA GLY 33 0.475 16.471 -5.708
232 2HA GLY 33 1HA GLY 33 2.177 16.911 -5.712
233 H PHE 34 H PHE 34 2.989 15.212 -3.598
234 HA PHE 34 HA PHE 34 3.527 12.775 -4.731
235 1HB PHE 34 2HB PHE 34 3.055 13.210 -1.777
236 2HB PHE 34 1HB PHE 34 4.071 11.986 -2.520
237 HD1 PHE 34 1HD PHE 34 4.003 15.180 -1.039
238 HD2 PHE 34 2HD PHE 34 6.034 12.865 -3.965
239 HE1 PHE 34 1HE PHE 34 5.935 16.696 -0.891
240 HE2 PHE 34 2HE PHE 34 7.969 14.369 -3.824
241 HZ PHE 34 HZ PHE 34 7.914 16.292 -2.233
242 H ALA 35 H ALA 35 2.519 10.874 -4.949
243 HA ALA 35 HA ALA 35 0.099 10.318 -3.391
244 1HB ALA 35 1HB ALA 35 -0.605 11.026 -5.662
245 2HB ALA 35 2HB ALA 35 -0.991 9.335 -5.350
246 3HB ALA 35 3HB ALA 35 0.397 9.750 -6.356
247 H TRP 36 H TRP 36 -0.236 7.973 -3.091
248 HA TRP 36 HA TRP 36 2.353 6.726 -2.755
249 1HB TRP 36 2HB TRP 36 -0.390 5.688 -2.013
250 2HB TRP 36 1HB TRP 36 1.133 4.881 -1.659
251 HD1 TRP 36 HD TRP 36 -1.113 7.690 -0.409
252 HE1 TRP 36 1HE TRP 36 -0.266 8.429 1.892
253 HE3 TRP 36 3HE TRP 36 3.338 5.176 -0.328
254 HZ2 TRP 36 2HZ TRP 36 1.951 7.989 3.547
255 HZ3 TRP 36 3HZ TRP 36 4.777 5.396 1.652
256 HH2 TRP 36 HH TRP 36 4.095 6.777 3.561
257 H TYR 37 H TYR 37 3.239 5.840 -4.490
258 HA TYR 37 HA TYR 37 1.678 3.771 -5.906
259 1HB TYR 37 2HB TYR 37 4.031 5.441 -6.779
260 2HB TYR 37 1HB TYR 37 3.643 3.922 -7.574
261 HD1 TYR 37 1HD TYR 37 2.859 7.406 -7.251
262 HD2 TYR 37 2HD TYR 37 1.407 3.695 -8.758
263 HE1 TYR 37 1HE TYR 37 1.246 8.616 -8.653
264 HE2 TYR 37 2HE TYR 37 -0.209 4.904 -10.172
265 HH TYR 37 HH TYR 37 -1.380 7.158 -10.109
266 H PHE 38 H PHE 38 3.300 1.853 -6.576
267 HA PHE 38 HA PHE 38 4.744 0.982 -4.294
268 1HB PHE 38 2HB PHE 38 4.055 -0.117 -6.832
269 2HB PHE 38 1HB PHE 38 5.801 -0.241 -6.628
270 HD1 PHE 38 1HD PHE 38 2.572 -1.473 -5.584
271 HD2 PHE 38 2HD PHE 38 6.732 -1.480 -4.693
272 HE1 PHE 38 1HE PHE 38 2.251 -3.426 -4.131
273 HE2 PHE 38 2HE PHE 38 6.417 -3.440 -3.237
274 HZ PHE 38 HZ PHE 38 4.174 -4.415 -2.954
275 H GLU 39 H GLU 39 6.152 1.442 -7.506
276 HA GLU 39 HA GLU 39 8.372 2.900 -6.246
277 1HB GLU 39 2HB GLU 39 8.296 1.416 -8.877
278 2HB GLU 39 1HB GLU 39 9.681 2.304 -8.257
279 1HG GLU 39 2HG GLU 39 9.691 0.778 -6.290
280 2HG GLU 39 1HG GLU 39 8.429 -0.166 -7.085
281 H GLY 40 H GLY 40 5.649 3.247 -8.151
282 1HA GLY 40 2HA GLY 40 5.070 5.624 -8.611
283 2HA GLY 40 1HA GLY 40 6.690 5.782 -9.275
284 H GLY 41 H GLY 41 3.465 5.165 -9.967
285 1HA GLY 41 2HA GLY 41 2.438 4.903 -12.021
286 2HA GLY 41 1HA GLY 41 4.027 4.798 -12.762
287 H THR 42 H THR 42 4.535 2.619 -10.624
288 HA THR 42 HA THR 42 3.153 0.421 -12.009
289 HB THR 42 HB THR 42 6.011 0.248 -11.058
290 HG1 THR 42 1HG THR 42 6.643 1.273 -12.794
291 1HG2 THR 42 1HG2 THR 42 6.119 -1.633 -12.615
292 2HG2 THR 42 2HG2 THR 42 4.446 -1.346 -13.094
293 3HG2 THR 42 3HG2 THR 42 4.817 -1.863 -11.448
294 H LYS 43 H LYS 43 2.523 -1.297 -10.716
295 HA LYS 43 HA LYS 43 3.396 -1.316 -7.937
296 1HB LYS 43 2HB LYS 43 1.372 -0.996 -6.966
297 2HB LYS 43 1HB LYS 43 1.061 -0.095 -8.431
298 1HG LYS 43 2HG LYS 43 0.263 -2.966 -8.025
299 2HG LYS 43 1HG LYS 43 -0.796 -1.585 -7.746
300 1HD LYS 43 2HD LYS 43 0.481 -2.366 -10.368
301 2HD LYS 43 1HD LYS 43 -1.216 -2.570 -9.933
302 1HE LYS 43 2HE LYS 43 -1.526 -0.186 -9.828
303 2HE LYS 43 1HE LYS 43 0.201 0.088 -10.062
304 1HZ LYS 43 1HZ LYS 43 -0.873 0.447 -12.127
305 2HZ LYS 43 2HZ LYS 43 -1.729 -1.015 -12.033
306 3HZ LYS 43 3HZ LYS 43 -0.046 -1.029 -12.256
307 H GLU 44 H GLU 44 3.400 -3.387 -7.002
308 HA GLU 44 HA GLU 44 2.742 -5.583 -8.822
309 1HB GLU 44 2HB GLU 44 4.994 -6.591 -8.313
310 2HB GLU 44 1HB GLU 44 5.007 -5.174 -9.351
311 1HG GLU 44 2HG GLU 44 5.580 -3.797 -7.371
312 2HG GLU 44 1HG GLU 44 5.703 -5.281 -6.429
313 H SER 45 H SER 45 2.931 -7.716 -7.839
314 HA SER 45 HA SER 45 2.631 -7.755 -4.888
315 1HB SER 45 2HB SER 45 0.819 -9.494 -5.296
316 2HB SER 45 1HB SER 45 0.386 -7.841 -5.726
317 HG SER 45 HG SER 45 1.530 -9.414 -7.724
318 HA PRO 46 HA PRO 46 5.681 -11.054 -5.530
319 1HB PRO 46 2HB PRO 46 4.890 -11.799 -2.783
320 2HB PRO 46 1HB PRO 46 6.485 -11.398 -3.424
321 1HG PRO 46 2HG PRO 46 5.137 -9.712 -1.829
322 2HG PRO 46 1HG PRO 46 6.179 -9.133 -3.142
323 1HD PRO 46 2HD PRO 46 3.194 -9.309 -3.020
324 2HD PRO 46 1HD PRO 46 4.230 -8.082 -3.780
325 H ASN 47 H ASN 47 5.631 -13.277 -5.854
326 HA ASN 47 HA ASN 47 4.767 -15.327 -6.313
327 1HB ASN 47 2HB ASN 47 2.751 -14.542 -4.221
328 2HB ASN 47 1HB ASN 47 2.787 -16.125 -4.979
329 1HD2 ASN 47 1HD2 ASN 47 3.110 -15.436 -2.193
330 2HD2 ASN 47 2HD2 ASN 47 4.658 -16.032 -1.720
331 H GLU 48 H GLU 48 4.241 -13.361 -8.081
332 HA GLU 48 HA GLU 48 1.392 -13.232 -8.627
333 1HB GLU 48 2HB GLU 48 1.932 -11.518 -10.221
334 2HB GLU 48 1HB GLU 48 2.830 -11.199 -8.745
335 1HG GLU 48 2HG GLU 48 3.961 -12.471 -11.234
336 2HG GLU 48 1HG GLU 48 4.133 -10.777 -10.785
337 H SER 49 H SER 49 2.762 -15.774 -8.950
338 HA SER 49 HA SER 49 2.979 -16.178 -11.819
339 1HB SER 49 2HB SER 49 3.226 -18.163 -9.548
340 2HB SER 49 1HB SER 49 3.645 -18.463 -11.236
341 HG SER 49 HG SER 49 5.131 -17.340 -9.310
342 H MET 50 H MET 50 0.400 -15.653 -10.175
343 HA MET 50 HA MET 50 -1.393 -17.151 -11.731
344 1HB MET 50 2HB MET 50 -2.362 -18.583 -9.919
345 2HB MET 50 1HB MET 50 -0.776 -19.074 -10.491
346 1HG MET 50 2HG MET 50 0.243 -17.989 -8.533
347 2HG MET 50 1HG MET 50 -1.369 -17.565 -7.956
348 1HE MET 50 1HE MET 50 -0.721 -18.746 -5.615
349 2HE MET 50 2HE MET 50 0.856 -19.161 -6.284
350 3HE MET 50 3HE MET 50 -0.127 -20.402 -5.509
351 H PHE 51 H PHE 51 -0.700 -15.371 -8.846
352 HA PHE 51 HA PHE 51 -3.389 -14.197 -8.886
353 1HB PHE 51 2HB PHE 51 -1.764 -15.311 -6.650
354 2HB PHE 51 1HB PHE 51 -2.755 -13.901 -6.299
355 HD1 PHE 51 1HD PHE 51 -3.045 -17.216 -8.009
356 HD2 PHE 51 2HD PHE 51 -4.900 -14.267 -5.561
357 HE1 PHE 51 1HE PHE 51 -5.001 -18.676 -7.730
358 HE2 PHE 51 2HE PHE 51 -6.858 -15.724 -5.284
359 HZ PHE 51 HZ PHE 51 -6.944 -17.901 -6.440
360 H THR 52 H THR 52 -3.302 -11.906 -7.703
361 HA THR 52 HA THR 52 -0.915 -10.467 -8.373
362 HB THR 52 HB THR 52 -1.805 -11.093 -10.628
363 HG1 THR 52 1HG THR 52 -0.535 -9.286 -10.604
364 1HG2 THR 52 1HG2 THR 52 -3.778 -9.918 -11.475
365 2HG2 THR 52 2HG2 THR 52 -4.061 -9.234 -9.875
366 3HG2 THR 52 3HG2 THR 52 -4.194 -10.974 -10.126
367 H VAL 53 H VAL 53 -1.328 -8.072 -8.480
368 HA VAL 53 HA VAL 53 -3.121 -7.379 -6.264
369 HB VAL 53 HB VAL 53 -0.762 -6.930 -5.872
370 1HG1 VAL 53 1HG1 VAL 53 0.475 -5.297 -7.224
371 2HG1 VAL 53 2HG1 VAL 53 -0.894 -5.193 -8.332
372 3HG1 VAL 53 3HG1 VAL 53 -0.010 -6.710 -8.164
373 1HG2 VAL 53 1HG2 VAL 53 -0.861 -4.536 -5.336
374 2HG2 VAL 53 2HG2 VAL 53 -2.341 -5.378 -4.875
375 3HG2 VAL 53 3HG2 VAL 53 -2.311 -4.381 -6.330
376 H GLU 54 H GLU 54 -4.683 -5.845 -6.482
377 HA GLU 54 HA GLU 54 -4.851 -4.330 -9.016
378 1HB GLU 54 2HB GLU 54 -7.260 -4.062 -8.517
379 2HB GLU 54 1HB GLU 54 -6.809 -5.755 -8.676
380 1HG GLU 54 2HG GLU 54 -6.960 -6.124 -6.365
381 2HG GLU 54 1HG GLU 54 -6.965 -4.399 -6.009
382 H ASN 55 H ASN 55 -5.134 -2.098 -8.896
383 HA ASN 55 HA ASN 55 -4.533 -0.978 -6.240
384 1HB ASN 55 2HB ASN 55 -3.353 0.799 -7.308
385 2HB ASN 55 1HB ASN 55 -2.779 -0.713 -8.002
386 1HD2 ASN 55 1HD2 ASN 55 -4.439 2.247 -8.577
387 2HD2 ASN 55 2HD2 ASN 55 -4.577 2.092 -10.292
388 H LYS 56 H LYS 56 -5.385 1.137 -5.743
389 HA LYS 56 HA LYS 56 -7.200 2.469 -7.487
390 1HB LYS 56 2HB LYS 56 -9.208 2.390 -6.078
391 2HB LYS 56 1HB LYS 56 -8.782 0.790 -6.662
392 1HG LYS 56 2HG LYS 56 -7.899 1.693 -3.958
393 2HG LYS 56 1HG LYS 56 -9.538 1.091 -4.216
394 1HD LYS 56 2HD LYS 56 -7.089 -0.449 -5.044
395 2HD LYS 56 1HD LYS 56 -7.803 -0.599 -3.437
396 1HE LYS 56 2HE LYS 56 -8.672 -2.365 -4.715
397 2HE LYS 56 1HE LYS 56 -9.966 -1.183 -4.579
398 1HZ LYS 56 1HZ LYS 56 -9.592 -2.231 -6.840
399 2HZ LYS 56 2HZ LYS 56 -8.195 -1.282 -6.953
400 3HZ LYS 56 3HZ LYS 56 -9.709 -0.540 -6.806
401 H TYR 57 H TYR 57 -6.558 4.511 -7.179
402 HA TYR 57 HA TYR 57 -5.587 5.180 -4.486
403 1HB TYR 57 2HB TYR 57 -4.779 6.632 -6.946
404 2HB TYR 57 1HB TYR 57 -3.999 6.612 -5.381
405 HD1 TYR 57 1HD TYR 57 -3.284 5.750 -8.536
406 HD2 TYR 57 2HD TYR 57 -3.693 3.848 -4.745
407 HE1 TYR 57 1HE TYR 57 -1.803 3.935 -9.283
408 HE2 TYR 57 2HE TYR 57 -2.210 2.039 -5.487
409 HH TYR 57 HH TYR 57 -1.471 1.017 -7.568
410 H PHE 58 H PHE 58 -6.999 6.305 -3.407
411 HA PHE 58 HA PHE 58 -8.266 8.600 -4.721
412 1HB PHE 58 2HB PHE 58 -9.123 7.035 -2.295
413 2HB PHE 58 1HB PHE 58 -9.883 8.539 -2.814
414 HD1 PHE 58 1HD PHE 58 -9.303 5.013 -3.690
415 HD2 PHE 58 2HD PHE 58 -11.398 8.590 -4.645
416 HE1 PHE 58 1HE PHE 58 -10.785 3.742 -5.188
417 HE2 PHE 58 2HE PHE 58 -12.884 7.327 -6.143
418 HZ PHE 58 HZ PHE 58 -12.555 4.909 -6.452
419 HA PRO 59 HA PRO 59 -5.610 10.706 -1.743
420 1HB PRO 59 2HB PRO 59 -4.829 12.646 -3.543
421 2HB PRO 59 1HB PRO 59 -4.059 11.070 -3.353
422 1HG PRO 59 2HG PRO 59 -5.512 12.022 -5.617
423 2HG PRO 59 1HG PRO 59 -4.834 10.404 -5.363
424 1HD PRO 59 2HD PRO 59 -7.623 11.366 -4.919
425 2HD PRO 59 1HD PRO 59 -7.034 9.768 -5.431
426 HA PRO 60 HA PRO 60 -8.491 14.320 -1.284
427 1HB PRO 60 2HB PRO 60 -10.677 13.228 -0.034
428 2HB PRO 60 1HB PRO 60 -10.581 13.594 -1.757
429 1HG PRO 60 2HG PRO 60 -10.747 11.050 -0.491
430 2HG PRO 60 1HG PRO 60 -10.663 11.394 -2.222
431 1HD PRO 60 2HD PRO 60 -8.530 10.568 -0.359
432 2HD PRO 60 1HD PRO 60 -8.620 10.385 -2.121
433 H ASP 61 H ASP 61 -9.406 15.078 0.915
434 HA ASP 61 HA ASP 61 -7.635 14.097 3.058
435 1HB ASP 61 2HB ASP 61 -6.475 15.924 1.908
436 2HB ASP 61 1HB ASP 61 -7.905 16.942 2.081
437 H SER 62 H SER 62 -9.611 16.991 2.678
438 HA SER 62 HA SER 62 -11.854 16.063 4.014
439 1HB SER 62 2HB SER 62 -11.637 17.406 6.142
440 2HB SER 62 1HB SER 62 -10.585 15.995 6.042
441 HG SER 62 HG SER 62 -8.914 17.483 5.293
442 H LYS 63 H LYS 63 -9.890 18.796 3.082
443 HA LYS 63 HA LYS 63 -12.352 20.290 2.556
444 1HB LYS 63 2HB LYS 63 -11.342 22.380 3.262
445 2HB LYS 63 1HB LYS 63 -11.309 21.224 4.575
446 1HG LYS 63 2HG LYS 63 -8.962 22.004 2.849
447 2HG LYS 63 1HG LYS 63 -9.280 22.571 4.487
448 1HD LYS 63 2HD LYS 63 -9.194 20.122 5.183
449 2HD LYS 63 1HD LYS 63 -8.529 19.806 3.573
450 1HE LYS 63 2HE LYS 63 -6.621 21.136 3.996
451 2HE LYS 63 1HE LYS 63 -7.326 21.811 5.467
452 1HZ LYS 63 1HZ LYS 63 -7.120 19.744 6.568
453 2HZ LYS 63 2HZ LYS 63 -5.623 20.034 5.822
454 3HZ LYS 63 3HZ LYS 63 -6.714 18.923 5.138
455 H LEU 64 H LEU 64 -8.896 20.844 1.921
456 HA LEU 64 HA LEU 64 -9.103 21.826 -0.675
457 1HB LEU 64 2HB LEU 64 -6.958 20.083 0.490
458 2HB LEU 64 1HB LEU 64 -6.761 21.164 -0.881
459 HG LEU 64 HG LEU 64 -7.325 22.049 1.955
460 1HD1 LEU 64 1HD1 LEU 64 -5.020 22.848 1.955
461 2HD1 LEU 64 2HD1 LEU 64 -4.775 22.160 0.349
462 3HD1 LEU 64 3HD1 LEU 64 -5.089 21.101 1.723
463 1HD2 LEU 64 1HD2 LEU 64 -8.229 23.587 0.293
464 2HD2 LEU 64 2HD2 LEU 64 -6.665 23.643 -0.521
465 3HD2 LEU 64 3HD2 LEU 64 -6.835 24.293 1.110
466 H LEU 65 H LEU 65 -7.857 18.655 0.208
467 HA LEU 65 HA LEU 65 -9.069 17.419 -2.079
468 1HB LEU 65 2HB LEU 65 -7.396 16.322 0.178
469 2HB LEU 65 1HB LEU 65 -8.060 15.334 -1.105
470 HG LEU 65 HG LEU 65 -5.799 15.660 -1.641
471 1HD1 LEU 65 1HD1 LEU 65 -7.318 15.913 -3.525
472 2HD1 LEU 65 2HD1 LEU 65 -5.871 16.895 -3.736
473 3HD1 LEU 65 3HD1 LEU 65 -7.385 17.654 -3.250
474 1HD2 LEU 65 1HD2 LEU 65 -4.717 17.849 -1.752
475 2HD2 LEU 65 2HD2 LEU 65 -5.315 17.503 -0.130
476 3HD2 LEU 65 3HD2 LEU 65 -6.197 18.617 -1.176
477 H GLY 66 H GLY 66 -10.732 15.718 -1.715
478 1HA GLY 66 2HA GLY 66 -12.438 17.262 0.054
479 2HA GLY 66 1HA GLY 66 -12.995 16.285 -1.300
480 H ALA 67 H ALA 67 -10.897 15.360 1.332
481 HA ALA 67 HA ALA 67 -10.969 13.746 2.928
482 1HB ALA 67 1HB ALA 67 -13.954 13.973 2.740
483 2HB ALA 67 2HB ALA 67 -12.912 14.927 3.798
484 3HB ALA 67 3HB ALA 67 -13.037 13.176 4.017
485 H GLY 68 H GLY 68 -10.912 11.560 3.088
486 1HA GLY 68 2HA GLY 68 -11.979 9.432 2.399
487 2HA GLY 68 1HA GLY 68 -12.153 10.180 0.809
488 H GLY 69 H GLY 69 -9.219 10.701 2.637
489 1HA GLY 69 2HA GLY 69 -7.592 9.940 0.512
490 2HA GLY 69 1HA GLY 69 -7.064 10.059 2.187
491 H THR 70 H THR 70 -7.492 8.014 -0.407
492 HA THR 70 HA THR 70 -7.019 5.663 1.172
493 HB THR 70 HB THR 70 -9.005 4.511 -0.030
494 HG1 THR 70 1HG THR 70 -9.769 7.240 -0.061
495 1HG2 THR 70 1HG2 THR 70 -10.258 4.707 1.969
496 2HG2 THR 70 2HG2 THR 70 -9.671 6.350 2.260
497 3HG2 THR 70 3HG2 THR 70 -8.572 4.970 2.450
498 H GLU 71 H GLU 71 -5.160 5.633 -0.060
499 HA GLU 71 HA GLU 71 -5.511 4.797 -2.858
500 1HB GLU 71 2HB GLU 71 -2.991 5.610 -1.379
501 2HB GLU 71 1HB GLU 71 -3.081 5.177 -3.080
502 1HG GLU 71 2HG GLU 71 -4.601 7.104 -3.438
503 2HG GLU 71 1HG GLU 71 -4.355 7.562 -1.754
504 H HIS 72 H HIS 72 -5.860 2.663 -2.912
505 HA HIS 72 HA HIS 72 -4.607 1.014 -0.818
506 1HB HIS 72 2HB HIS 72 -6.942 0.365 -2.589
507 2HB HIS 72 1HB HIS 72 -6.276 -0.682 -1.355
508 HD1 HIS 72 1HD HIS 72 -7.805 -0.826 0.509
509 HD2 HIS 72 2HD HIS 72 -7.750 3.003 -1.104
510 HE1 HIS 72 1HE HIS 72 -9.655 0.407 1.630
511 HE2 HIS 72 2HE HIS 72 -9.759 2.642 0.500
512 H PHE 73 H PHE 73 -3.616 -0.838 -1.269
513 HA PHE 73 HA PHE 73 -3.214 -1.635 -4.073
514 1HB PHE 73 2HB PHE 73 -1.341 -1.636 -1.707
515 2HB PHE 73 1HB PHE 73 -1.013 -2.577 -3.163
516 HD1 PHE 73 1HD PHE 73 0.141 -1.584 -4.916
517 HD2 PHE 73 2HD PHE 73 -1.777 0.885 -2.033
518 HE1 PHE 73 1HE PHE 73 1.167 0.403 -5.942
519 HE2 PHE 73 2HE PHE 73 -0.740 2.878 -3.043
520 HZ PHE 73 HZ PHE 73 0.728 2.638 -5.004
521 H HIS 74 H HIS 74 -4.533 -3.381 -4.305
522 HA HIS 74 HA HIS 74 -4.914 -5.142 -1.969
523 1HB HIS 74 2HB HIS 74 -6.553 -4.689 -4.465
524 2HB HIS 74 1HB HIS 74 -6.846 -6.033 -3.378
525 HD1 HIS 74 1HD HIS 74 -9.244 -5.019 -3.109
526 HD2 HIS 74 2HD HIS 74 -6.158 -2.684 -1.554
527 HE1 HIS 74 1HE HIS 74 -10.348 -3.320 -1.625
528 HE2 HIS 74 2HE HIS 74 -8.437 -2.203 -0.441
529 H VAL 75 H VAL 75 -3.389 -6.753 -2.057
530 HA VAL 75 HA VAL 75 -2.949 -7.945 -4.689
531 HB VAL 75 HB VAL 75 -0.782 -7.745 -4.159
532 1HG1 VAL 75 1HG1 VAL 75 0.132 -7.242 -2.004
533 2HG1 VAL 75 2HG1 VAL 75 -1.403 -7.627 -1.220
534 3HG1 VAL 75 3HG1 VAL 75 -1.286 -6.235 -2.299
535 1HG2 VAL 75 1HG2 VAL 75 -1.016 -10.133 -3.958
536 2HG2 VAL 75 2HG2 VAL 75 -1.392 -9.986 -2.238
537 3HG2 VAL 75 3HG2 VAL 75 0.212 -9.555 -2.831
538 H THR 76 H THR 76 -4.031 -9.607 -5.132
539 HA THR 76 HA THR 76 -5.125 -11.286 -3.004
540 HB THR 76 HB THR 76 -5.877 -11.225 -5.942
541 HG1 THR 76 1HG THR 76 -7.294 -9.680 -5.473
542 1HG2 THR 76 1HG2 THR 76 -6.472 -13.305 -4.821
543 2HG2 THR 76 2HG2 THR 76 -7.921 -12.363 -5.172
544 3HG2 THR 76 3HG2 THR 76 -7.271 -12.402 -3.534
545 H VAL 77 H VAL 77 -3.686 -12.791 -2.560
546 HA VAL 77 HA VAL 77 -2.831 -14.614 -4.657
547 HB VAL 77 HB VAL 77 -0.972 -13.040 -4.593
548 1HG1 VAL 77 1HG1 VAL 77 -0.843 -13.576 -1.628
549 2HG1 VAL 77 2HG1 VAL 77 -1.362 -12.073 -2.389
550 3HG1 VAL 77 3HG1 VAL 77 0.309 -12.614 -2.554
551 1HG2 VAL 77 1HG2 VAL 77 0.865 -14.533 -4.018
552 2HG2 VAL 77 2HG2 VAL 77 -0.416 -15.420 -4.846
553 3HG2 VAL 77 3HG2 VAL 77 -0.234 -15.558 -3.093
554 H LYS 78 H LYS 78 -2.534 -16.723 -3.884
555 HA LYS 78 HA LYS 78 -2.161 -16.945 -1.009
556 1HB LYS 78 2HB LYS 78 -3.604 -18.728 -0.703
557 2HB LYS 78 1HB LYS 78 -4.507 -17.663 -1.750
558 1HG LYS 78 2HG LYS 78 -3.012 -20.098 -2.687
559 2HG LYS 78 1HG LYS 78 -4.730 -20.064 -2.293
560 1HD LYS 78 2HD LYS 78 -5.071 -18.373 -4.048
561 2HD LYS 78 1HD LYS 78 -3.354 -18.471 -4.460
562 1HE LYS 78 2HE LYS 78 -4.556 -19.848 -6.005
563 2HE LYS 78 1HE LYS 78 -3.682 -20.910 -4.902
564 1HZ LYS 78 1HZ LYS 78 -5.816 -21.823 -5.096
565 2HZ LYS 78 2HZ LYS 78 -6.586 -20.318 -4.959
566 3HZ LYS 78 3HZ LYS 78 -5.848 -21.014 -3.604
567 H ALA 79 H ALA 79 -0.104 -17.367 -0.864
568 HA ALA 79 HA ALA 79 1.020 -19.761 -1.899
569 1HB ALA 79 1HB ALA 79 2.746 -18.741 -3.324
570 2HB ALA 79 2HB ALA 79 1.971 -17.169 -3.117
571 3HB ALA 79 3HB ALA 79 1.123 -18.467 -3.960
572 H ALA 80 H ALA 80 3.349 -19.953 -1.278
573 HA ALA 80 HA ALA 80 3.598 -18.785 1.382
574 1HB ALA 80 1HB ALA 80 3.802 -21.208 1.159
575 2HB ALA 80 2HB ALA 80 5.302 -20.498 1.757
576 3HB ALA 80 3HB ALA 80 5.175 -20.998 0.069
577 H GLY 81 H GLY 81 4.350 -16.730 1.078
578 1HA GLY 81 2HA GLY 81 7.200 -16.530 0.608
579 2HA GLY 81 1HA GLY 81 6.220 -15.675 -0.578
580 H THR 82 H THR 82 7.965 -14.247 1.009
581 HA THR 82 HA THR 82 6.243 -13.116 3.096
582 HB THR 82 HB THR 82 9.151 -12.424 2.702
583 HG1 THR 82 1HG THR 82 9.582 -14.414 3.289
584 1HG2 THR 82 1HG2 THR 82 7.281 -12.374 5.078
585 2HG2 THR 82 2HG2 THR 82 7.876 -10.972 4.185
586 3HG2 THR 82 3HG2 THR 82 8.995 -11.959 5.129
587 H HIS 83 H HIS 83 5.491 -11.091 2.979
588 HA HIS 83 HA HIS 83 5.856 -9.761 0.383
589 1HB HIS 83 2HB HIS 83 3.540 -10.615 1.305
590 2HB HIS 83 1HB HIS 83 3.632 -9.187 2.320
591 HD1 HIS 83 1HD HIS 83 4.761 -7.184 0.197
592 HD2 HIS 83 2HD HIS 83 1.577 -9.788 -0.415
593 HE1 HIS 83 1HE HIS 83 3.363 -6.131 -1.613
594 HE2 HIS 83 2HE HIS 83 1.379 -7.657 -1.866
595 H ALA 84 H ALA 84 7.489 -8.300 0.690
596 HA ALA 84 HA ALA 84 7.237 -6.455 2.967
597 1HB ALA 84 1HB ALA 84 9.484 -5.690 2.361
598 2HB ALA 84 2HB ALA 84 9.482 -6.771 0.967
599 3HB ALA 84 3HB ALA 84 9.460 -7.438 2.600
600 H VAL 85 H VAL 85 6.021 -4.737 2.578
601 HA VAL 85 HA VAL 85 5.595 -4.012 -0.241
602 HB VAL 85 HB VAL 85 3.844 -3.027 1.956
603 1HG1 VAL 85 1HG1 VAL 85 2.160 -3.120 0.189
604 2HG1 VAL 85 2HG1 VAL 85 3.352 -3.820 -0.907
605 3HG1 VAL 85 3HG1 VAL 85 3.569 -2.178 -0.303
606 1HG2 VAL 85 1HG2 VAL 85 2.452 -5.028 1.812
607 2HG2 VAL 85 2HG2 VAL 85 4.070 -5.418 2.404
608 3HG2 VAL 85 3HG2 VAL 85 3.629 -5.775 0.732
609 H ASN 86 H ASN 86 6.931 -2.443 -0.770
610 HA ASN 86 HA ASN 86 7.165 -0.131 1.030
611 1HB ASN 86 2HB ASN 86 9.304 0.276 -0.400
612 2HB ASN 86 1HB ASN 86 9.339 -0.950 0.864
613 1HD2 ASN 86 1HD2 ASN 86 8.871 -3.170 0.166
614 2HD2 ASN 86 2HD2 ASN 86 9.484 -3.693 -1.373
615 H LEU 87 H LEU 87 5.769 1.285 0.402
616 HA LEU 87 HA LEU 87 5.275 1.699 -2.460
617 1HB LEU 87 2HB LEU 87 3.594 2.332 -0.034
618 2HB LEU 87 1HB LEU 87 3.155 2.757 -1.679
619 HG LEU 87 HG LEU 87 3.597 -0.084 -0.747
620 1HD1 LEU 87 1HD1 LEU 87 1.684 0.900 0.407
621 2HD1 LEU 87 2HD1 LEU 87 1.168 -0.293 -0.784
622 3HD1 LEU 87 3HD1 LEU 87 1.019 1.429 -1.139
623 1HD2 LEU 87 1HD2 LEU 87 2.375 1.059 -3.240
624 2HD2 LEU 87 2HD2 LEU 87 2.473 -0.652 -2.816
625 3HD2 LEU 87 3HD2 LEU 87 3.947 0.269 -3.108
626 H THR 88 H THR 88 5.693 3.620 -3.366
627 HA THR 88 HA THR 88 7.146 5.514 -1.671
628 HB THR 88 HB THR 88 7.237 5.373 -4.686
629 HG1 THR 88 1HG THR 88 7.945 3.382 -4.074
630 1HG2 THR 88 1HG2 THR 88 9.436 6.417 -4.347
631 2HG2 THR 88 2HG2 THR 88 9.170 6.411 -2.603
632 3HG2 THR 88 3HG2 THR 88 8.148 7.397 -3.647
633 H TYR 89 H TYR 89 6.236 7.317 -1.196
634 HA TYR 89 HA TYR 89 3.780 8.189 -2.476
635 1HB TYR 89 2HB TYR 89 4.239 8.012 0.051
636 2HB TYR 89 1HB TYR 89 5.234 9.448 -0.139
637 HD1 TYR 89 1HD TYR 89 2.277 9.214 -2.192
638 HD2 TYR 89 2HD TYR 89 3.790 10.519 1.544
639 HE1 TYR 89 1HE TYR 89 0.289 10.618 -1.892
640 HE2 TYR 89 2HE TYR 89 1.808 11.928 1.857
641 HH TYR 89 HH TYR 89 -0.972 11.654 -0.038
642 H MET 90 H MET 90 4.615 8.955 -4.496
643 HA MET 90 HA MET 90 6.553 11.194 -4.323
644 1HB MET 90 2HB MET 90 6.160 9.205 -6.554
645 2HB MET 90 1HB MET 90 7.220 10.599 -6.629
646 1HG MET 90 2HG MET 90 8.495 9.649 -4.732
647 2HG MET 90 1HG MET 90 7.490 8.202 -4.865
648 1HE MET 90 1HE MET 90 7.117 8.711 -8.188
649 2HE MET 90 2HE MET 90 7.141 7.090 -7.485
650 3HE MET 90 3HE MET 90 8.245 7.495 -8.797
651 H ARG 91 H ARG 91 6.341 12.892 -5.818
652 HA ARG 91 HA ARG 91 3.765 13.479 -6.875
653 1HB ARG 91 2HB ARG 91 6.409 14.740 -6.799
654 2HB ARG 91 1HB ARG 91 5.607 14.968 -8.350
655 1HG ARG 91 2HG ARG 91 3.693 15.956 -7.252
656 2HG ARG 91 1HG ARG 91 4.420 15.668 -5.674
657 1HD ARG 91 2HD ARG 91 5.645 17.385 -7.831
658 2HD ARG 91 1HD ARG 91 4.656 18.010 -6.515
659 HE ARG 91 HE ARG 91 6.494 16.842 -5.080
660 1HH1 ARG 91 1HH1 ARG 91 6.944 18.598 -8.074
661 2HH1 ARG 91 2HH1 ARG 91 8.553 19.129 -7.677
662 1HH2 ARG 91 1HH2 ARG 91 8.617 17.570 -4.522
663 2HH2 ARG 91 2HH2 ARG 91 9.495 18.555 -5.659
664 HA PRO 92 HA PRO 92 4.208 10.188 -9.864
665 1HB PRO 92 2HB PRO 92 2.027 11.053 -11.407
666 2HB PRO 92 1HB PRO 92 1.984 9.888 -10.083
667 1HG PRO 92 2HG PRO 92 1.357 12.807 -10.062
668 2HG PRO 92 1HG PRO 92 0.590 11.483 -9.164
669 1HD PRO 92 2HD PRO 92 2.270 13.171 -7.970
670 2HD PRO 92 1HD PRO 92 2.279 11.437 -7.568
671 H TRP 93 H TRP 93 4.049 13.578 -10.797
672 HA TRP 93 HA TRP 93 4.922 12.940 -13.498
673 1HB TRP 93 2HB TRP 93 4.723 15.412 -13.881
674 2HB TRP 93 1HB TRP 93 3.229 14.610 -13.415
675 HD1 TRP 93 HD TRP 93 5.713 17.243 -12.229
676 HE1 TRP 93 1HE TRP 93 4.732 18.444 -10.166
677 HE3 TRP 93 3HE TRP 93 1.674 14.225 -11.381
678 HZ2 TRP 93 2HZ TRP 93 2.534 18.142 -8.424
679 HZ3 TRP 93 3HZ TRP 93 0.188 14.744 -9.495
680 HH2 TRP 93 HH TRP 93 0.608 16.669 -8.049
681 H THR 94 H THR 94 6.454 13.381 -10.600
682 HA THR 94 HA THR 94 8.981 13.646 -11.881
683 HB THR 94 HB THR 94 8.532 15.991 -11.921
684 HG1 THR 94 1HG THR 94 10.649 15.317 -11.236
685 1HG2 THR 94 1HG2 THR 94 7.935 15.816 -8.966
686 2HG2 THR 94 2HG2 THR 94 6.774 16.156 -10.251
687 3HG2 THR 94 3HG2 THR 94 8.059 17.309 -9.896
688 H GLY 95 H GLY 95 7.640 14.348 -8.636
689 1HA GLY 95 2HA GLY 95 8.115 13.468 -6.564
690 2HA GLY 95 1HA GLY 95 8.276 11.945 -7.434
691 HA PRO 96 HA PRO 96 12.752 14.065 -7.337
692 1HB PRO 96 2HB PRO 96 12.129 15.705 -4.975
693 2HB PRO 96 1HB PRO 96 13.253 16.036 -6.289
694 1HG PRO 96 2HG PRO 96 10.921 17.277 -6.202
695 2HG PRO 96 1HG PRO 96 11.547 16.666 -7.746
696 1HD PRO 96 2HD PRO 96 9.399 15.557 -5.991
697 2HD PRO 96 1HD PRO 96 9.507 15.587 -7.764
698 H SER 97 H SER 97 14.036 12.598 -6.480
699 HA SER 97 HA SER 97 13.292 10.836 -4.455
700 1HB SER 97 2HB SER 97 15.077 10.483 -6.220
701 2HB SER 97 1HB SER 97 16.136 11.506 -5.253
702 HG SER 97 HG SER 97 16.203 9.105 -4.951
703 H HIS 98 H HIS 98 13.626 10.784 -2.295
704 HA HIS 98 HA HIS 98 14.218 11.384 -0.191
705 1HB HIS 98 2HB HIS 98 15.928 13.528 -1.472
706 2HB HIS 98 1HB HIS 98 15.918 13.125 0.240
707 HD1 HIS 98 1HD HIS 98 17.525 12.279 -2.917
708 HD2 HIS 98 2HD HIS 98 16.920 10.420 0.759
709 HE1 HIS 98 1HE HIS 98 19.184 10.394 -2.827
710 HE2 HIS 98 2HE HIS 98 18.940 9.420 -0.521
711 H ASP 99 H ASP 99 12.595 13.353 -2.393
712 HA ASP 99 HA ASP 99 11.689 15.173 -0.264
713 1HB ASP 99 2HB ASP 99 12.289 16.153 -2.484
714 2HB ASP 99 1HB ASP 99 11.002 15.204 -3.218
715 H SER 100 H SER 100 10.827 12.475 -2.183
716 HA SER 100 HA SER 100 8.021 12.485 -1.555
717 1HB SER 100 2HB SER 100 8.254 10.129 -2.584
718 2HB SER 100 1HB SER 100 8.588 11.512 -3.625
719 HG SER 100 HG SER 100 10.402 9.706 -2.423
720 H GLU 101 H GLU 101 7.025 10.625 -0.442
721 HA GLU 101 HA GLU 101 8.597 9.784 1.902
722 1HB GLU 101 2HB GLU 101 6.532 11.039 2.362
723 2HB GLU 101 1HB GLU 101 5.603 9.889 1.416
724 1HG GLU 101 2HG GLU 101 5.270 9.514 3.770
725 2HG GLU 101 1HG GLU 101 6.109 8.145 3.046
726 H ARG 102 H ARG 102 7.902 7.458 2.695
727 HA ARG 102 HA ARG 102 6.825 5.759 0.635
728 1HB ARG 102 2HB ARG 102 9.324 5.946 0.117
729 2HB ARG 102 1HB ARG 102 9.612 5.090 1.626
730 1HG ARG 102 2HG ARG 102 8.533 3.132 0.828
731 2HG ARG 102 1HG ARG 102 7.888 3.981 -0.575
732 1HD ARG 102 2HD ARG 102 10.349 4.386 -1.201
733 2HD ARG 102 1HD ARG 102 10.711 3.123 -0.027
734 HE ARG 102 HE ARG 102 8.727 2.188 -1.803
735 1HH1 ARG 102 1HH1 ARG 102 12.144 2.957 -1.737
736 2HH1 ARG 102 2HH1 ARG 102 12.531 1.930 -3.090
737 1HH2 ARG 102 1HH2 ARG 102 9.230 0.829 -3.561
738 2HH2 ARG 102 2HH2 ARG 102 10.873 0.706 -4.118
739 H PHE 103 H PHE 103 5.945 3.989 1.357
740 HA PHE 103 HA PHE 103 5.840 3.581 4.263
741 1HB PHE 103 2HB PHE 103 3.646 3.862 3.679
742 2HB PHE 103 1HB PHE 103 3.921 3.391 2.009
743 HD1 PHE 103 1HD PHE 103 2.898 2.339 5.296
744 HD2 PHE 103 2HD PHE 103 3.919 1.017 1.391
745 HE1 PHE 103 1HE PHE 103 1.841 0.172 5.753
746 HE2 PHE 103 2HE PHE 103 2.870 -1.152 1.842
747 HZ PHE 103 HZ PHE 103 1.827 -1.575 4.025
748 H THR 104 H THR 104 5.779 1.310 5.024
749 HA THR 104 HA THR 104 6.581 -0.739 3.198
750 HB THR 104 HB THR 104 8.614 0.202 5.229
751 HG1 THR 104 1HG THR 104 8.236 0.897 2.689
752 1HG2 THR 104 1HG2 THR 104 10.021 -1.609 4.358
753 2HG2 THR 104 2HG2 THR 104 8.678 -2.156 3.353
754 3HG2 THR 104 3HG2 THR 104 8.547 -2.221 5.112
755 H VAL 105 H VAL 105 4.975 -2.052 3.989
756 HA VAL 105 HA VAL 105 5.269 -2.819 6.807
757 HB VAL 105 HB VAL 105 2.967 -2.342 6.090
758 1HG1 VAL 105 1HG1 VAL 105 1.820 -3.829 4.538
759 2HG1 VAL 105 2HG1 VAL 105 3.342 -4.660 4.212
760 3HG1 VAL 105 3HG1 VAL 105 3.143 -2.968 3.756
761 1HG2 VAL 105 1HG2 VAL 105 3.417 -4.004 7.860
762 2HG2 VAL 105 2HG2 VAL 105 3.391 -5.276 6.642
763 3HG2 VAL 105 3HG2 VAL 105 1.933 -4.340 6.972
764 H TYR 106 H TYR 106 5.986 -4.746 7.392
765 HA TYR 106 HA TYR 106 6.775 -6.622 5.283
766 1HB TYR 106 2HB TYR 106 7.744 -6.326 8.133
767 2HB TYR 106 1HB TYR 106 8.203 -7.639 7.064
768 HD1 TYR 106 1HD TYR 106 9.554 -7.161 5.029
769 HD2 TYR 106 2HD TYR 106 8.778 -4.196 7.980
770 HE1 TYR 106 1HE TYR 106 11.406 -5.811 4.146
771 HE2 TYR 106 2HE TYR 106 10.625 -2.835 7.103
772 HH TYR 106 HH TYR 106 12.090 -3.440 4.103
773 H LEU 107 H LEU 107 5.241 -8.070 4.968
774 HA LEU 107 HA LEU 107 4.011 -9.315 7.327
775 1HB LEU 107 2HB LEU 107 1.851 -9.297 6.269
776 2HB LEU 107 1HB LEU 107 2.474 -7.664 6.310
777 HG LEU 107 HG LEU 107 3.315 -8.486 3.848
778 1HD1 LEU 107 1HD1 LEU 107 2.083 -10.591 4.028
779 2HD1 LEU 107 2HD1 LEU 107 1.438 -9.563 2.748
780 3HD1 LEU 107 3HD1 LEU 107 0.588 -9.692 4.286
781 1HD2 LEU 107 1HD2 LEU 107 2.268 -6.364 4.391
782 2HD2 LEU 107 2HD2 LEU 107 0.707 -7.164 4.563
783 3HD2 LEU 107 3HD2 LEU 107 1.499 -7.104 2.988
784 H LYS 108 H LYS 108 3.536 -11.526 7.083
785 HA LYS 108 HA LYS 108 5.032 -12.736 4.867
786 1HB LYS 108 2HB LYS 108 5.726 -13.241 7.203
787 2HB LYS 108 1HB LYS 108 4.170 -14.012 7.462
788 1HG LYS 108 2HG LYS 108 4.823 -15.880 6.469
789 2HG LYS 108 1HG LYS 108 5.465 -14.989 5.081
790 1HD LYS 108 2HD LYS 108 7.502 -14.491 6.385
791 2HD LYS 108 1HD LYS 108 6.856 -15.436 7.729
792 1HE LYS 108 2HE LYS 108 8.461 -16.732 6.427
793 2HE LYS 108 1HE LYS 108 6.849 -17.434 6.326
794 1HZ LYS 108 1HZ LYS 108 8.066 -17.326 4.179
795 2HZ LYS 108 2HZ LYS 108 7.990 -15.630 4.261
796 3HZ LYS 108 3HZ LYS 108 6.561 -16.543 4.159
797 H ALA 109 H ALA 109 3.908 -13.631 3.259
798 HA ALA 109 HA ALA 109 1.015 -13.908 3.669
799 1HB ALA 109 1HB ALA 109 2.608 -13.521 1.128
800 2HB ALA 109 2HB ALA 109 1.684 -12.280 1.971
801 3HB ALA 109 3HB ALA 109 0.854 -13.638 1.218
802 H ASN 110 H ASN 110 -0.008 -15.793 3.362
803 HA ASN 110 HA ASN 110 0.774 -17.989 1.865
804 1HB ASN 110 2HB ASN 110 1.798 -19.510 3.441
805 2HB ASN 110 1HB ASN 110 2.762 -18.041 3.389
806 1HD2 ASN 110 1HD2 ASN 110 2.630 -16.582 5.158
807 2HD2 ASN 110 2HD2 ASN 110 2.125 -17.128 6.715
Start of MODEL 12
1 H HIS 3 H HIS 3 -6.494 -9.606 4.423
2 HA HIS 3 HA HIS 3 -5.392 -9.052 6.971
3 1HB HIS 3 2HB HIS 3 -3.523 -10.434 6.447
4 2HB HIS 3 1HB HIS 3 -3.565 -9.942 4.752
5 HD1 HIS 3 1HD HIS 3 -3.042 -8.114 8.055
6 HD2 HIS 3 2HD HIS 3 -1.488 -8.367 4.205
7 HE1 HIS 3 1HE HIS 3 -1.214 -6.402 7.958
8 HE2 HIS 3 2HE HIS 3 -0.414 -6.433 5.566
9 H LYS 4 H LYS 4 -4.762 -6.838 7.087
10 HA LYS 4 HA LYS 4 -4.884 -5.316 4.593
11 1HB LYS 4 2HB LYS 4 -7.150 -5.271 5.405
12 2HB LYS 4 1HB LYS 4 -6.610 -4.796 7.011
13 1HG LYS 4 2HG LYS 4 -5.701 -2.708 6.011
14 2HG LYS 4 1HG LYS 4 -6.476 -3.163 4.490
15 1HD LYS 4 2HD LYS 4 -8.656 -3.210 5.638
16 2HD LYS 4 1HD LYS 4 -7.864 -2.702 7.132
17 1HE LYS 4 2HE LYS 4 -7.135 -0.635 6.011
18 2HE LYS 4 1HE LYS 4 -7.986 -1.145 4.551
19 1HZ LYS 4 1HZ LYS 4 -9.236 -0.616 7.198
20 2HZ LYS 4 2HZ LYS 4 -10.058 -1.129 5.806
21 3HZ LYS 4 3HZ LYS 4 -9.321 0.394 5.838
22 H VAL 5 H VAL 5 -3.420 -3.729 4.514
23 HA VAL 5 HA VAL 5 -2.161 -2.927 7.033
24 HB VAL 5 HB VAL 5 -1.055 -3.265 4.295
25 1HG1 VAL 5 1HG1 VAL 5 -0.758 -0.871 4.532
26 2HG1 VAL 5 2HG1 VAL 5 0.785 -1.712 4.701
27 3HG1 VAL 5 3HG1 VAL 5 -0.052 -1.104 6.130
28 1HG2 VAL 5 1HG2 VAL 5 -0.600 -4.779 6.171
29 2HG2 VAL 5 2HG2 VAL 5 0.121 -3.432 7.060
30 3HG2 VAL 5 3HG2 VAL 5 0.861 -4.000 5.564
31 H THR 6 H THR 6 -1.501 -0.685 7.215
32 HA THR 6 HA THR 6 -3.243 1.277 6.006
33 HB THR 6 HB THR 6 -3.757 1.992 8.508
34 HG1 THR 6 1HG THR 6 -3.490 0.438 9.935
35 1HG2 THR 6 1HG2 THR 6 -5.254 -0.212 7.075
36 2HG2 THR 6 2HG2 THR 6 -5.458 1.521 6.813
37 3HG2 THR 6 3HG2 THR 6 -5.909 0.802 8.360
38 H LYS 7 H LYS 7 -2.697 3.494 7.180
39 HA LYS 7 HA LYS 7 -0.113 4.086 6.468
40 1HB LYS 7 2HB LYS 7 -1.897 5.745 6.793
41 2HB LYS 7 1HB LYS 7 -1.766 5.544 8.533
42 1HG LYS 7 2HG LYS 7 -0.632 7.568 7.593
43 2HG LYS 7 1HG LYS 7 0.386 6.524 8.582
44 1HD LYS 7 2HD LYS 7 1.471 5.629 6.671
45 2HD LYS 7 1HD LYS 7 0.288 6.346 5.573
46 1HE LYS 7 2HE LYS 7 2.501 7.528 5.663
47 2HE LYS 7 1HE LYS 7 1.110 8.546 6.016
48 1HZ LYS 7 1HZ LYS 7 1.609 8.501 8.319
49 2HZ LYS 7 2HZ LYS 7 3.063 8.859 7.513
50 3HZ LYS 7 3HZ LYS 7 2.789 7.298 8.123
51 H ALA 8 H ALA 8 -1.198 3.192 9.769
52 HA ALA 8 HA ALA 8 1.229 3.742 11.087
53 1HB ALA 8 1HB ALA 8 -0.868 3.249 12.262
54 2HB ALA 8 2HB ALA 8 0.456 2.230 12.826
55 3HB ALA 8 3HB ALA 8 -0.761 1.570 11.730
56 H HIS 9 H HIS 9 0.162 0.999 9.231
57 HA HIS 9 HA HIS 9 2.213 -0.814 9.917
58 1HB HIS 9 2HB HIS 9 0.331 -0.603 7.592
59 2HB HIS 9 1HB HIS 9 1.580 -1.838 7.636
60 HD1 HIS 9 1HD HIS 9 -1.858 -1.301 8.559
61 HD2 HIS 9 2HD HIS 9 1.302 -3.503 10.107
62 HE1 HIS 9 1HE HIS 9 -2.903 -3.212 9.773
63 HE2 HIS 9 2HE HIS 9 -0.985 -4.270 11.030
64 H ASN 10 H ASN 10 2.392 2.077 8.287
65 HA ASN 10 HA ASN 10 4.287 1.867 6.312
66 1HB ASN 10 2HB ASN 10 3.382 4.029 6.899
67 2HB ASN 10 1HB ASN 10 4.026 3.906 8.534
68 1HD2 ASN 10 1HD2 ASN 10 4.735 4.652 5.233
69 2HD2 ASN 10 2HD2 ASN 10 6.323 5.282 5.496
70 H GLY 11 H GLY 11 4.591 1.084 9.638
71 1HA GLY 11 2HA GLY 11 7.383 0.291 9.163
72 2HA GLY 11 1HA GLY 11 7.014 1.253 10.591
73 H ALA 12 H ALA 12 5.520 -1.542 8.956
74 HA ALA 12 HA ALA 12 5.257 -2.774 11.630
75 1HB ALA 12 1HB ALA 12 3.114 -2.211 10.872
76 2HB ALA 12 2HB ALA 12 3.274 -3.945 10.571
77 3HB ALA 12 3HB ALA 12 3.451 -2.793 9.244
78 H THR 13 H THR 13 5.223 -5.075 11.752
79 HA THR 13 HA THR 13 6.091 -6.660 9.474
80 HB THR 13 HB THR 13 7.705 -6.700 12.041
81 HG1 THR 13 1HG THR 13 7.866 -5.031 9.938
82 1HG2 THR 13 1HG2 THR 13 8.149 -8.055 9.376
83 2HG2 THR 13 2HG2 THR 13 7.613 -8.846 10.858
84 3HG2 THR 13 3HG2 THR 13 9.227 -8.137 10.771
85 H LEU 14 H LEU 14 4.762 -8.402 9.496
86 HA LEU 14 HA LEU 14 4.115 -9.853 11.866
87 1HB LEU 14 2HB LEU 14 1.718 -9.350 11.910
88 2HB LEU 14 1HB LEU 14 2.706 -7.952 12.280
89 HG LEU 14 HG LEU 14 2.382 -7.376 9.760
90 1HD1 LEU 14 1HD1 LEU 14 -0.002 -9.141 10.260
91 2HD1 LEU 14 2HD1 LEU 14 1.346 -9.518 9.191
92 3HD1 LEU 14 3HD1 LEU 14 0.290 -8.149 8.828
93 1HD2 LEU 14 1HD2 LEU 14 0.153 -7.116 11.771
94 2HD2 LEU 14 2HD2 LEU 14 0.349 -6.139 10.316
95 3HD2 LEU 14 3HD2 LEU 14 1.542 -6.041 11.609
96 H THR 15 H THR 15 2.393 -11.556 11.405
97 HA THR 15 HA THR 15 2.789 -12.530 8.660
98 HB THR 15 HB THR 15 2.009 -14.008 11.178
99 HG1 THR 15 1HG THR 15 4.234 -13.506 11.023
100 1HG2 THR 15 1HG2 THR 15 2.456 -15.124 8.408
101 2HG2 THR 15 2HG2 THR 15 0.876 -14.902 9.161
102 3HG2 THR 15 3HG2 THR 15 2.039 -16.038 9.859
103 H VAL 16 H VAL 16 1.078 -13.267 7.421
104 HA VAL 16 HA VAL 16 -1.615 -12.498 8.347
105 HB VAL 16 HB VAL 16 -2.137 -11.593 6.252
106 1HG1 VAL 16 1HG1 VAL 16 -0.399 -9.931 5.832
107 2HG1 VAL 16 2HG1 VAL 16 0.742 -10.890 6.774
108 3HG1 VAL 16 3HG1 VAL 16 -0.664 -10.167 7.558
109 1HG2 VAL 16 1HG2 VAL 16 -0.751 -11.780 4.257
110 2HG2 VAL 16 2HG2 VAL 16 -1.284 -13.359 4.837
111 3HG2 VAL 16 3HG2 VAL 16 0.370 -12.817 5.143
112 H ALA 17 H ALA 17 -3.362 -13.761 7.335
113 HA ALA 17 HA ALA 17 -2.469 -16.295 6.116
114 1HB ALA 17 1HB ALA 17 -3.659 -16.746 8.144
115 2HB ALA 17 2HB ALA 17 -4.758 -17.112 6.811
116 3HB ALA 17 3HB ALA 17 -4.931 -15.605 7.714
117 H VAL 18 H VAL 18 -2.825 -16.367 3.965
118 HA VAL 18 HA VAL 18 -4.547 -14.293 2.826
119 HB VAL 18 HB VAL 18 -3.509 -14.759 0.694
120 1HG1 VAL 18 1HG1 VAL 18 -1.756 -14.275 3.058
121 2HG1 VAL 18 2HG1 VAL 18 -2.263 -13.171 1.776
122 3HG1 VAL 18 3HG1 VAL 18 -1.045 -14.407 1.444
123 1HG2 VAL 18 1HG2 VAL 18 -3.238 -17.165 0.900
124 2HG2 VAL 18 2HG2 VAL 18 -1.982 -16.933 2.117
125 3HG2 VAL 18 3HG2 VAL 18 -1.715 -16.394 0.458
126 H GLY 19 H GLY 19 -5.509 -15.043 0.600
127 1HA GLY 19 2HA GLY 19 -6.412 -17.249 -0.361
128 2HA GLY 19 1HA GLY 19 -7.197 -17.382 1.210
129 H GLU 20 H GLU 20 -8.197 -15.017 1.756
130 HA GLU 20 HA GLU 20 -10.215 -14.541 -0.240
131 1HB GLU 20 2HB GLU 20 -9.617 -12.927 2.252
132 2HB GLU 20 1HB GLU 20 -11.093 -12.879 1.302
133 1HG GLU 20 2HG GLU 20 -11.511 -15.236 1.922
134 2HG GLU 20 1HG GLU 20 -10.085 -15.179 2.959
135 H LEU 21 H LEU 21 -8.081 -12.232 1.407
136 HA LEU 21 HA LEU 21 -6.969 -11.168 -0.974
137 1HB LEU 21 2HB LEU 21 -9.161 -10.241 -1.322
138 2HB LEU 21 1HB LEU 21 -9.233 -9.670 0.332
139 HG LEU 21 HG LEU 21 -7.448 -8.046 -0.156
140 1HD1 LEU 21 1HD1 LEU 21 -6.344 -9.334 -1.943
141 2HD1 LEU 21 2HD1 LEU 21 -6.696 -7.673 -2.417
142 3HD1 LEU 21 3HD1 LEU 21 -7.711 -8.991 -3.006
143 1HD2 LEU 21 1HD2 LEU 21 -9.781 -7.931 -2.059
144 2HD2 LEU 21 2HD2 LEU 21 -8.783 -6.566 -1.559
145 3HD2 LEU 21 3HD2 LEU 21 -9.789 -7.402 -0.377
146 H VAL 22 H VAL 22 -5.054 -10.258 -0.420
147 HA VAL 22 HA VAL 22 -4.820 -9.325 2.360
148 HB VAL 22 HB VAL 22 -2.876 -10.691 0.570
149 1HG1 VAL 22 1HG1 VAL 22 -1.681 -8.623 0.732
150 2HG1 VAL 22 2HG1 VAL 22 -0.967 -9.734 1.904
151 3HG1 VAL 22 3HG1 VAL 22 -2.070 -8.468 2.443
152 1HG2 VAL 22 1HG2 VAL 22 -2.175 -11.649 2.681
153 2HG2 VAL 22 2HG2 VAL 22 -3.926 -11.752 2.498
154 3HG2 VAL 22 3HG2 VAL 22 -3.221 -10.530 3.555
155 H GLU 23 H GLU 23 -4.903 -7.247 2.668
156 HA GLU 23 HA GLU 23 -4.622 -5.501 0.329
157 1HB GLU 23 2HB GLU 23 -6.009 -4.980 2.959
158 2HB GLU 23 1HB GLU 23 -6.011 -3.922 1.555
159 1HG GLU 23 2HG GLU 23 -7.223 -5.626 0.285
160 2HG GLU 23 1HG GLU 23 -7.228 -6.670 1.708
161 H ILE 24 H ILE 24 -3.376 -3.754 0.319
162 HA ILE 24 HA ILE 24 -2.038 -2.913 2.806
163 HB ILE 24 HB ILE 24 -0.879 -2.741 0.011
164 1HG1 ILE 24 2HG1 ILE 24 -0.923 -5.075 0.848
165 2HG1 ILE 24 1HG1 ILE 24 0.722 -4.459 0.681
166 1HG2 ILE 24 1HG2 ILE 24 0.347 -2.100 2.692
167 2HG2 ILE 24 2HG2 ILE 24 -0.214 -0.924 1.508
168 3HG2 ILE 24 3HG2 ILE 24 1.147 -1.978 1.124
169 1HD1 ILE 24 1HD1 ILE 24 -0.839 -4.649 3.257
170 2HD1 ILE 24 2HD1 ILE 24 0.822 -4.079 3.082
171 3HD1 ILE 24 3HD1 ILE 24 0.426 -5.759 2.724
172 H GLN 25 H GLN 25 -3.223 -1.091 3.297
173 HA GLN 25 HA GLN 25 -3.929 0.631 1.023
174 1HB GLN 25 2HB GLN 25 -5.948 -0.235 1.844
175 2HB GLN 25 1HB GLN 25 -5.458 -0.046 3.526
176 1HG GLN 25 2HG GLN 25 -5.530 2.443 2.035
177 2HG GLN 25 1HG GLN 25 -7.086 1.621 2.098
178 1HE2 GLN 25 1HE2 GLN 25 -4.600 3.179 4.001
179 2HE2 GLN 25 2HE2 GLN 25 -5.535 3.333 5.448
180 H LEU 26 H LEU 26 -3.492 2.732 1.071
181 HA LEU 26 HA LEU 26 -2.347 3.826 3.536
182 1HB LEU 26 2HB LEU 26 -1.578 4.247 0.688
183 2HB LEU 26 1HB LEU 26 -1.399 5.577 1.810
184 HG LEU 26 HG LEU 26 0.698 4.435 1.601
185 1HD1 LEU 26 1HD1 LEU 26 1.092 3.782 3.956
186 2HD1 LEU 26 2HD1 LEU 26 -0.648 3.889 4.235
187 3HD1 LEU 26 3HD1 LEU 26 0.263 5.327 3.770
188 1HD2 LEU 26 1HD2 LEU 26 -0.731 1.937 2.499
189 2HD2 LEU 26 2HD2 LEU 26 0.999 2.101 2.195
190 3HD2 LEU 26 3HD2 LEU 26 -0.149 2.258 0.865
191 HA PRO 27 HA PRO 27 -5.750 6.645 3.311
192 1HB PRO 27 2HB PRO 27 -5.088 8.308 5.235
193 2HB PRO 27 1HB PRO 27 -5.358 6.600 5.625
194 1HG PRO 27 2HG PRO 27 -2.748 8.027 5.135
195 2HG PRO 27 1HG PRO 27 -3.177 6.946 6.478
196 1HD PRO 27 2HD PRO 27 -1.812 6.123 4.276
197 2HD PRO 27 1HD PRO 27 -2.882 5.059 5.207
198 H SER 28 H SER 28 -2.968 7.173 1.873
199 HA SER 28 HA SER 28 -2.115 8.715 0.495
200 1HB SER 28 2HB SER 28 -4.513 9.040 -0.183
201 2HB SER 28 1HB SER 28 -4.607 10.362 0.984
202 HG SER 28 HG SER 28 -2.932 10.170 -1.314
203 H ASN 29 H ASN 29 -3.778 10.607 2.968
204 HA ASN 29 HA ASN 29 -3.113 12.332 4.322
205 1HB ASN 29 2HB ASN 29 -0.267 11.439 4.127
206 2HB ASN 29 1HB ASN 29 -1.093 12.162 5.492
207 1HD2 ASN 29 1HD2 ASN 29 -0.143 9.304 3.950
208 2HD2 ASN 29 2HD2 ASN 29 -0.805 8.182 5.089
209 HA PRO 30 HA PRO 30 -1.983 14.236 0.274
210 1HB PRO 30 2HB PRO 30 -3.425 16.501 1.593
211 2HB PRO 30 1HB PRO 30 -3.564 15.883 -0.062
212 1HG PRO 30 2HG PRO 30 -5.440 15.236 1.642
213 2HG PRO 30 1HG PRO 30 -4.722 13.961 0.635
214 1HD PRO 30 2HD PRO 30 -4.124 14.624 3.495
215 2HD PRO 30 1HD PRO 30 -4.454 13.045 2.755
216 H THR 31 H THR 31 0.141 14.489 0.395
217 HA THR 31 HA THR 31 1.377 16.502 2.052
218 HB THR 31 HB THR 31 3.458 15.812 0.893
219 HG1 THR 31 1HG THR 31 2.122 13.748 -0.443
220 1HG2 THR 31 1HG2 THR 31 2.450 14.466 2.808
221 2HG2 THR 31 2HG2 THR 31 3.608 13.624 1.779
222 3HG2 THR 31 3HG2 THR 31 1.878 13.338 1.570
223 H THR 32 H THR 32 0.961 15.908 -1.393
224 HA THR 32 HA THR 32 0.267 18.476 -2.187
225 HB THR 32 HB THR 32 2.510 19.183 -1.566
226 HG1 THR 32 1HG THR 32 2.798 20.283 -3.368
227 1HG2 THR 32 1HG2 THR 32 4.523 18.225 -2.561
228 2HG2 THR 32 2HG2 THR 32 3.543 17.017 -3.393
229 3HG2 THR 32 3HG2 THR 32 3.635 17.014 -1.632
230 H GLY 33 H GLY 33 2.133 17.973 -4.677
231 1HA GLY 33 2HA GLY 33 0.336 16.488 -6.232
232 2HA GLY 33 1HA GLY 33 2.004 16.823 -6.659
233 H PHE 34 H PHE 34 2.999 15.400 -4.234
234 HA PHE 34 HA PHE 34 3.463 12.877 -5.198
235 1HB PHE 34 2HB PHE 34 3.193 13.401 -2.243
236 2HB PHE 34 1HB PHE 34 4.238 12.244 -3.054
237 HD1 PHE 34 1HD PHE 34 4.937 14.335 -0.935
238 HD2 PHE 34 2HD PHE 34 5.184 14.338 -5.181
239 HE1 PHE 34 1HE PHE 34 6.779 15.956 -0.820
240 HE2 PHE 34 2HE PHE 34 7.026 15.960 -5.072
241 HZ PHE 34 HZ PHE 34 7.827 16.770 -2.892
242 H ALA 35 H ALA 35 2.647 10.851 -4.839
243 HA ALA 35 HA ALA 35 0.305 10.476 -3.157
244 1HB ALA 35 1HB ALA 35 -0.963 9.338 -4.911
245 2HB ALA 35 2HB ALA 35 0.325 9.654 -6.072
246 3HB ALA 35 3HB ALA 35 -0.609 10.997 -5.408
247 H TRP 36 H TRP 36 -0.146 8.051 -2.944
248 HA TRP 36 HA TRP 36 2.421 6.734 -2.619
249 1HB TRP 36 2HB TRP 36 -0.343 5.739 -1.887
250 2HB TRP 36 1HB TRP 36 1.178 4.921 -1.534
251 HD1 TRP 36 HD TRP 36 -1.065 7.715 -0.247
252 HE1 TRP 36 1HE TRP 36 -0.155 8.448 2.035
253 HE3 TRP 36 3HE TRP 36 3.396 5.229 -0.316
254 HZ2 TRP 36 2HZ TRP 36 2.126 8.012 3.620
255 HZ3 TRP 36 3HZ TRP 36 4.908 5.439 1.609
256 HH2 TRP 36 HH TRP 36 4.284 6.821 3.545
257 H TYR 37 H TYR 37 3.297 5.471 -4.042
258 HA TYR 37 HA TYR 37 1.794 3.383 -5.295
259 1HB TYR 37 2HB TYR 37 2.783 4.001 -7.605
260 2HB TYR 37 1HB TYR 37 1.340 4.835 -7.063
261 HD1 TYR 37 1HD TYR 37 1.536 6.812 -8.336
262 HD2 TYR 37 2HD TYR 37 4.806 5.558 -5.937
263 HE1 TYR 37 1HE TYR 37 2.594 8.987 -8.636
264 HE2 TYR 37 2HE TYR 37 5.854 7.738 -6.228
265 HH TYR 37 HH TYR 37 4.203 10.397 -7.330
266 H PHE 38 H PHE 38 3.177 1.665 -6.068
267 HA PHE 38 HA PHE 38 5.211 1.059 -4.345
268 1HB PHE 38 2HB PHE 38 4.376 0.026 -6.958
269 2HB PHE 38 1HB PHE 38 6.049 -0.313 -6.532
270 HD1 PHE 38 1HD PHE 38 2.632 -1.254 -6.085
271 HD2 PHE 38 2HD PHE 38 6.486 -1.451 -4.303
272 HE1 PHE 38 1HE PHE 38 1.880 -3.130 -4.674
273 HE2 PHE 38 2HE PHE 38 5.747 -3.322 -2.893
274 HZ PHE 38 HZ PHE 38 3.410 -4.193 -3.130
275 H GLU 39 H GLU 39 5.974 1.748 -7.759
276 HA GLU 39 HA GLU 39 8.226 3.360 -6.788
277 1HB GLU 39 2HB GLU 39 9.534 2.489 -8.775
278 2HB GLU 39 1HB GLU 39 9.281 1.363 -7.452
279 1HG GLU 39 2HG GLU 39 7.534 0.249 -8.674
280 2HG GLU 39 1HG GLU 39 7.646 1.436 -9.974
281 H GLY 40 H GLY 40 5.446 3.791 -8.002
282 1HA GLY 40 2HA GLY 40 4.866 5.950 -8.828
283 2HA GLY 40 1HA GLY 40 6.393 5.995 -9.700
284 H GLY 41 H GLY 41 3.109 4.909 -9.691
285 1HA GLY 41 2HA GLY 41 1.739 4.587 -11.523
286 2HA GLY 41 1HA GLY 41 3.135 4.766 -12.573
287 H THR 42 H THR 42 4.088 2.618 -10.356
288 HA THR 42 HA THR 42 3.112 0.292 -11.861
289 HB THR 42 HB THR 42 5.551 -0.500 -10.971
290 HG1 THR 42 1HG THR 42 6.938 1.287 -11.784
291 1HG2 THR 42 1HG2 THR 42 4.642 -0.960 -13.180
292 2HG2 THR 42 2HG2 THR 42 6.274 -0.305 -13.328
293 3HG2 THR 42 3HG2 THR 42 4.877 0.722 -13.655
294 H LYS 43 H LYS 43 2.686 -1.514 -10.756
295 HA LYS 43 HA LYS 43 3.596 -1.750 -8.016
296 1HB LYS 43 2HB LYS 43 1.435 -2.345 -7.153
297 2HB LYS 43 1HB LYS 43 1.402 -0.720 -7.777
298 1HG LYS 43 2HG LYS 43 0.447 -2.993 -9.473
299 2HG LYS 43 1HG LYS 43 -0.588 -2.345 -8.204
300 1HD LYS 43 2HD LYS 43 -1.292 -0.962 -9.836
301 2HD LYS 43 1HD LYS 43 0.166 -0.059 -9.435
302 1HE LYS 43 2HE LYS 43 0.000 -0.339 -11.833
303 2HE LYS 43 1HE LYS 43 1.376 -1.247 -11.214
304 1HZ LYS 43 1HZ LYS 43 0.144 -2.522 -12.845
305 2HZ LYS 43 2HZ LYS 43 -1.278 -2.389 -11.930
306 3HZ LYS 43 3HZ LYS 43 0.039 -3.270 -11.325
307 H GLU 44 H GLU 44 4.259 -3.755 -7.572
308 HA GLU 44 HA GLU 44 3.031 -5.963 -9.070
309 1HB GLU 44 2HB GLU 44 5.152 -7.148 -9.132
310 2HB GLU 44 1HB GLU 44 5.308 -5.590 -9.925
311 1HG GLU 44 2HG GLU 44 6.122 -6.013 -7.072
312 2HG GLU 44 1HG GLU 44 7.209 -6.340 -8.420
313 H SER 45 H SER 45 3.157 -8.048 -7.927
314 HA SER 45 HA SER 45 3.246 -7.696 -5.002
315 1HB SER 45 2HB SER 45 0.901 -7.833 -5.820
316 2HB SER 45 1HB SER 45 1.262 -9.401 -6.539
317 HG SER 45 HG SER 45 1.321 -10.308 -4.600
318 HA PRO 46 HA PRO 46 6.117 -11.104 -5.138
319 1HB PRO 46 2HB PRO 46 4.968 -11.757 -2.477
320 2HB PRO 46 1HB PRO 46 6.649 -11.458 -2.932
321 1HG PRO 46 2HG PRO 46 5.257 -9.642 -1.559
322 2HG PRO 46 1HG PRO 46 6.407 -9.155 -2.821
323 1HD PRO 46 2HD PRO 46 3.417 -9.290 -2.928
324 2HD PRO 46 1HD PRO 46 4.511 -8.083 -3.611
325 H ASN 47 H ASN 47 5.840 -13.008 -6.067
326 HA ASN 47 HA ASN 47 5.008 -15.031 -6.670
327 1HB ASN 47 2HB ASN 47 3.169 -14.648 -4.319
328 2HB ASN 47 1HB ASN 47 3.193 -16.100 -5.307
329 1HD2 ASN 47 1HD2 ASN 47 3.822 -15.617 -2.440
330 2HD2 ASN 47 2HD2 ASN 47 5.411 -16.265 -2.222
331 H GLU 48 H GLU 48 4.266 -12.774 -8.029
332 HA GLU 48 HA GLU 48 1.416 -12.789 -8.464
333 1HB GLU 48 2HB GLU 48 1.785 -10.930 -9.914
334 2HB GLU 48 1HB GLU 48 2.833 -10.723 -8.521
335 1HG GLU 48 2HG GLU 48 3.761 -11.825 -11.157
336 2HG GLU 48 1HG GLU 48 3.858 -10.125 -10.708
337 H SER 49 H SER 49 2.757 -15.262 -9.014
338 HA SER 49 HA SER 49 3.162 -15.642 -11.790
339 1HB SER 49 2HB SER 49 2.274 -17.797 -9.878
340 2HB SER 49 1HB SER 49 3.359 -17.935 -11.263
341 HG SER 49 HG SER 49 4.952 -16.896 -10.120
342 H MET 50 H MET 50 0.521 -16.800 -9.714
343 HA MET 50 HA MET 50 -1.240 -16.854 -12.055
344 1HB MET 50 2HB MET 50 -2.568 -18.500 -10.882
345 2HB MET 50 1HB MET 50 -0.892 -19.001 -10.985
346 1HG MET 50 2HG MET 50 -2.249 -17.838 -8.562
347 2HG MET 50 1HG MET 50 -1.850 -19.533 -8.817
348 1HE MET 50 1HE MET 50 -1.029 -17.812 -6.211
349 2HE MET 50 2HE MET 50 0.616 -18.398 -5.962
350 3HE MET 50 3HE MET 50 -0.663 -19.525 -6.411
351 H PHE 51 H PHE 51 -0.880 -15.755 -8.788
352 HA PHE 51 HA PHE 51 -3.388 -14.248 -8.962
353 1HB PHE 51 2HB PHE 51 -1.811 -15.415 -6.715
354 2HB PHE 51 1HB PHE 51 -2.685 -13.920 -6.390
355 HD1 PHE 51 1HD PHE 51 -3.459 -17.021 -8.332
356 HD2 PHE 51 2HD PHE 51 -4.649 -14.327 -5.253
357 HE1 PHE 51 1HE PHE 51 -5.529 -18.301 -8.017
358 HE2 PHE 51 2HE PHE 51 -6.725 -15.613 -4.937
359 HZ PHE 51 HZ PHE 51 -7.166 -17.602 -6.316
360 H THR 52 H THR 52 -3.127 -11.964 -7.776
361 HA THR 52 HA THR 52 -0.641 -10.713 -8.493
362 HB THR 52 HB THR 52 -1.604 -11.228 -10.727
363 HG1 THR 52 1HG THR 52 -1.409 -8.970 -11.472
364 1HG2 THR 52 1HG2 THR 52 -3.751 -9.266 -9.901
365 2HG2 THR 52 2HG2 THR 52 -3.980 -10.989 -10.198
366 3HG2 THR 52 3HG2 THR 52 -3.525 -9.920 -11.524
367 H VAL 53 H VAL 53 -0.925 -8.261 -8.629
368 HA VAL 53 HA VAL 53 -2.510 -7.478 -6.284
369 HB VAL 53 HB VAL 53 -0.194 -6.975 -5.991
370 1HG1 VAL 53 1HG1 VAL 53 1.125 -5.657 -7.568
371 2HG1 VAL 53 2HG1 VAL 53 -0.259 -5.564 -8.658
372 3HG1 VAL 53 3HG1 VAL 53 0.503 -7.121 -8.336
373 1HG2 VAL 53 1HG2 VAL 53 -1.720 -5.209 -5.250
374 2HG2 VAL 53 2HG2 VAL 53 -1.589 -4.432 -6.828
375 3HG2 VAL 53 3HG2 VAL 53 -0.176 -4.540 -5.777
376 H GLU 54 H GLU 54 -4.195 -6.224 -6.507
377 HA GLU 54 HA GLU 54 -4.651 -4.830 -9.057
378 1HB GLU 54 2HB GLU 54 -6.727 -5.650 -7.025
379 2HB GLU 54 1HB GLU 54 -6.994 -5.136 -8.686
380 1HG GLU 54 2HG GLU 54 -5.989 -7.152 -9.527
381 2HG GLU 54 1HG GLU 54 -5.548 -7.653 -7.897
382 H ASN 55 H ASN 55 -4.742 -2.644 -8.957
383 HA ASN 55 HA ASN 55 -4.485 -1.500 -6.270
384 1HB ASN 55 2HB ASN 55 -3.388 0.393 -7.311
385 2HB ASN 55 1HB ASN 55 -2.569 -1.108 -7.737
386 1HD2 ASN 55 1HD2 ASN 55 -2.522 1.454 -9.093
387 2HD2 ASN 55 2HD2 ASN 55 -3.104 1.174 -10.701
388 H LYS 56 H LYS 56 -5.483 0.452 -5.747
389 HA LYS 56 HA LYS 56 -7.373 1.724 -7.450
390 1HB LYS 56 2HB LYS 56 -9.277 1.172 -5.723
391 2HB LYS 56 1HB LYS 56 -8.944 0.071 -7.051
392 1HG LYS 56 2HG LYS 56 -9.022 -1.434 -5.355
393 2HG LYS 56 1HG LYS 56 -7.317 -0.990 -5.255
394 1HD LYS 56 2HD LYS 56 -7.807 -0.680 -3.087
395 2HD LYS 56 1HD LYS 56 -8.370 0.889 -3.660
396 1HE LYS 56 2HE LYS 56 -10.025 -1.563 -3.162
397 2HE LYS 56 1HE LYS 56 -10.009 -0.098 -2.191
398 1HZ LYS 56 1HZ LYS 56 -10.858 1.116 -4.138
399 2HZ LYS 56 2HZ LYS 56 -11.922 -0.091 -3.608
400 3HZ LYS 56 3HZ LYS 56 -10.975 -0.352 -4.985
401 H TYR 57 H TYR 57 -7.100 3.792 -6.885
402 HA TYR 57 HA TYR 57 -6.542 4.334 -4.054
403 1HB TYR 57 2HB TYR 57 -5.493 6.197 -6.072
404 2HB TYR 57 1HB TYR 57 -4.861 5.767 -4.496
405 HD1 TYR 57 1HD TYR 57 -4.514 5.308 -8.013
406 HD2 TYR 57 2HD TYR 57 -3.790 3.447 -4.258
407 HE1 TYR 57 1HE TYR 57 -2.876 3.818 -9.072
408 HE2 TYR 57 2HE TYR 57 -2.143 1.958 -5.308
409 HH TYR 57 HH TYR 57 -1.691 1.045 -7.618
410 H PHE 58 H PHE 58 -7.226 6.372 -3.271
411 HA PHE 58 HA PHE 58 -8.986 7.903 -4.994
412 1HB PHE 58 2HB PHE 58 -10.066 5.968 -3.450
413 2HB PHE 58 1HB PHE 58 -10.070 7.306 -2.299
414 HD1 PHE 58 1HD PHE 58 -11.901 8.584 -2.226
415 HD2 PHE 58 2HD PHE 58 -10.898 6.686 -5.895
416 HE1 PHE 58 1HE PHE 58 -13.950 9.506 -3.257
417 HE2 PHE 58 2HE PHE 58 -12.941 7.593 -6.937
418 HZ PHE 58 HZ PHE 58 -14.435 8.939 -5.735
419 HA PRO 59 HA PRO 59 -6.710 10.949 -2.437
420 1HB PRO 59 2HB PRO 59 -7.524 12.596 -4.764
421 2HB PRO 59 1HB PRO 59 -5.933 12.423 -4.015
422 1HG PRO 59 2HG PRO 59 -6.420 11.327 -6.385
423 2HG PRO 59 1HG PRO 59 -5.455 10.458 -5.168
424 1HD PRO 59 2HD PRO 59 -8.358 10.103 -5.882
425 2HD PRO 59 1HD PRO 59 -7.102 8.867 -5.639
426 HA PRO 60 HA PRO 60 -9.989 12.692 -0.166
427 1HB PRO 60 2HB PRO 60 -8.790 15.253 -1.178
428 2HB PRO 60 1HB PRO 60 -9.481 14.908 0.416
429 1HG PRO 60 2HG PRO 60 -6.894 14.696 0.183
430 2HG PRO 60 1HG PRO 60 -7.802 13.367 0.944
431 1HD PRO 60 2HD PRO 60 -6.589 13.490 -1.784
432 2HD PRO 60 1HD PRO 60 -6.725 12.117 -0.663
433 H ASP 61 H ASP 61 -11.836 12.321 -0.928
434 HA ASP 61 HA ASP 61 -12.867 13.521 -3.347
435 1HB ASP 61 2HB ASP 61 -14.978 12.300 -2.598
436 2HB ASP 61 1HB ASP 61 -13.597 11.288 -3.036
437 H SER 62 H SER 62 -14.470 13.184 -0.245
438 HA SER 62 HA SER 62 -14.792 15.836 0.395
439 1HB SER 62 2HB SER 62 -16.027 16.009 -1.737
440 2HB SER 62 1HB SER 62 -17.136 14.758 -1.176
441 HG SER 62 HG SER 62 -16.730 17.328 -0.016
442 H LYS 63 H LYS 63 -16.234 12.611 0.342
443 HA LYS 63 HA LYS 63 -17.323 13.154 3.020
444 1HB LYS 63 2HB LYS 63 -19.188 11.486 2.276
445 2HB LYS 63 1HB LYS 63 -19.275 13.182 1.830
446 1HG LYS 63 2HG LYS 63 -19.885 11.900 -0.072
447 2HG LYS 63 1HG LYS 63 -18.290 12.584 -0.382
448 1HD LYS 63 2HD LYS 63 -18.381 10.272 -1.121
449 2HD LYS 63 1HD LYS 63 -17.265 10.440 0.245
450 1HE LYS 63 2HE LYS 63 -18.650 8.446 0.489
451 2HE LYS 63 1HE LYS 63 -19.008 9.616 1.756
452 1HZ LYS 63 1HZ LYS 63 -21.046 8.725 0.938
453 2HZ LYS 63 2HZ LYS 63 -20.633 9.060 -0.670
454 3HZ LYS 63 3HZ LYS 63 -20.948 10.332 0.407
455 H LEU 64 H LEU 64 -15.765 10.812 0.935
456 HA LEU 64 HA LEU 64 -16.015 8.540 2.592
457 1HB LEU 64 2HB LEU 64 -15.108 8.769 0.173
458 2HB LEU 64 1HB LEU 64 -13.573 9.156 0.924
459 HG LEU 64 HG LEU 64 -15.102 6.574 1.349
460 1HD1 LEU 64 1HD1 LEU 64 -13.422 5.553 -0.104
461 2HD1 LEU 64 2HD1 LEU 64 -12.732 7.145 -0.423
462 3HD1 LEU 64 3HD1 LEU 64 -14.370 6.771 -0.956
463 1HD2 LEU 64 1HD2 LEU 64 -13.625 7.111 3.210
464 2HD2 LEU 64 2HD2 LEU 64 -12.280 7.338 2.094
465 3HD2 LEU 64 3HD2 LEU 64 -13.002 5.741 2.290
466 H LEU 65 H LEU 65 -13.339 10.883 2.285
467 HA LEU 65 HA LEU 65 -13.531 11.270 5.078
468 1HB LEU 65 2HB LEU 65 -11.249 10.889 5.746
469 2HB LEU 65 1HB LEU 65 -11.982 9.417 5.164
470 HG LEU 65 HG LEU 65 -9.985 11.095 3.592
471 1HD1 LEU 65 1HD1 LEU 65 -8.436 9.303 4.098
472 2HD1 LEU 65 2HD1 LEU 65 -9.660 8.484 5.071
473 3HD1 LEU 65 3HD1 LEU 65 -9.025 10.047 5.585
474 1HD2 LEU 65 1HD2 LEU 65 -11.634 9.792 2.253
475 2HD2 LEU 65 2HD2 LEU 65 -11.076 8.330 3.065
476 3HD2 LEU 65 3HD2 LEU 65 -9.965 9.256 2.053
477 H GLY 66 H GLY 66 -11.495 11.959 2.314
478 1HA GLY 66 2HA GLY 66 -10.981 14.011 1.359
479 2HA GLY 66 1HA GLY 66 -12.054 14.772 2.524
480 H ALA 67 H ALA 67 -10.798 13.745 4.849
481 HA ALA 67 HA ALA 67 -8.895 15.624 5.495
482 1HB ALA 67 1HB ALA 67 -9.191 12.826 6.590
483 2HB ALA 67 2HB ALA 67 -10.066 14.260 7.140
484 3HB ALA 67 3HB ALA 67 -8.322 14.150 7.372
485 H GLY 68 H GLY 68 -8.286 12.216 4.705
486 1HA GLY 68 2HA GLY 68 -5.540 12.981 3.971
487 2HA GLY 68 1HA GLY 68 -5.968 11.436 4.691
488 H GLY 69 H GLY 69 -8.126 10.672 3.226
489 1HA GLY 69 2HA GLY 69 -8.658 10.339 0.846
490 2HA GLY 69 1HA GLY 69 -6.925 10.412 0.549
491 H THR 70 H THR 70 -7.367 8.289 -0.483
492 HA THR 70 HA THR 70 -6.947 6.120 1.334
493 HB THR 70 HB THR 70 -9.131 5.048 0.123
494 HG1 THR 70 1HG THR 70 -9.447 7.538 -0.377
495 1HG2 THR 70 1HG2 THR 70 -9.100 6.556 2.741
496 2HG2 THR 70 2HG2 THR 70 -8.445 4.935 2.495
497 3HG2 THR 70 3HG2 THR 70 -10.178 5.222 2.306
498 H GLU 71 H GLU 71 -5.137 5.875 -0.003
499 HA GLU 71 HA GLU 71 -5.670 4.888 -2.722
500 1HB GLU 71 2HB GLU 71 -3.042 5.736 -1.476
501 2HB GLU 71 1HB GLU 71 -3.300 5.292 -3.161
502 1HG GLU 71 2HG GLU 71 -4.843 7.213 -3.394
503 2HG GLU 71 1HG GLU 71 -4.456 7.675 -1.735
504 H HIS 72 H HIS 72 -5.853 2.713 -2.821
505 HA HIS 72 HA HIS 72 -4.491 1.183 -0.694
506 1HB HIS 72 2HB HIS 72 -6.865 0.222 -2.254
507 2HB HIS 72 1HB HIS 72 -6.180 -0.471 -0.803
508 HD1 HIS 72 1HD HIS 72 -8.357 -0.440 0.457
509 HD2 HIS 72 2HD HIS 72 -7.198 3.307 -0.869
510 HE1 HIS 72 1HE HIS 72 -9.912 1.157 1.542
511 HE2 HIS 72 2HE HIS 72 -9.427 3.364 0.449
512 H PHE 73 H PHE 73 -3.452 -0.651 -1.142
513 HA PHE 73 HA PHE 73 -3.239 -1.520 -3.945
514 1HB PHE 73 2HB PHE 73 -1.256 -1.543 -1.670
515 2HB PHE 73 1HB PHE 73 -1.031 -2.543 -3.099
516 HD1 PHE 73 1HD PHE 73 0.128 -1.678 -4.885
517 HD2 PHE 73 2HD PHE 73 -1.661 0.996 -2.102
518 HE1 PHE 73 1HE PHE 73 1.158 0.230 -6.059
519 HE2 PHE 73 2HE PHE 73 -0.630 2.905 -3.261
520 HZ PHE 73 HZ PHE 73 0.803 2.549 -5.182
521 H HIS 74 H HIS 74 -4.494 -3.265 -4.194
522 HA HIS 74 HA HIS 74 -4.904 -5.052 -1.886
523 1HB HIS 74 2HB HIS 74 -6.519 -4.399 -4.336
524 2HB HIS 74 1HB HIS 74 -6.783 -5.911 -3.490
525 HD1 HIS 74 1HD HIS 74 -9.211 -5.024 -3.111
526 HD2 HIS 74 2HD HIS 74 -6.238 -2.858 -1.141
527 HE1 HIS 74 1HE HIS 74 -10.398 -3.679 -1.358
528 HE2 HIS 74 2HE HIS 74 -8.547 -2.698 0.029
529 H VAL 75 H VAL 75 -3.467 -6.712 -1.947
530 HA VAL 75 HA VAL 75 -2.864 -7.781 -4.605
531 HB VAL 75 HB VAL 75 -0.792 -8.585 -3.876
532 1HG1 VAL 75 1HG1 VAL 75 0.344 -6.685 -2.861
533 2HG1 VAL 75 2HG1 VAL 75 -1.214 -6.000 -2.394
534 3HG1 VAL 75 3HG1 VAL 75 -0.803 -6.171 -4.101
535 1HG2 VAL 75 1HG2 VAL 75 -0.028 -8.679 -1.563
536 2HG2 VAL 75 2HG2 VAL 75 -1.464 -9.682 -1.827
537 3HG2 VAL 75 3HG2 VAL 75 -1.619 -8.117 -1.021
538 H THR 76 H THR 76 -3.847 -9.509 -5.174
539 HA THR 76 HA THR 76 -4.993 -11.250 -3.113
540 HB THR 76 HB THR 76 -5.606 -11.259 -6.087
541 HG1 THR 76 1HG THR 76 -6.656 -9.460 -5.664
542 1HG2 THR 76 1HG2 THR 76 -6.183 -13.318 -4.902
543 2HG2 THR 76 2HG2 THR 76 -7.639 -12.447 -5.392
544 3HG2 THR 76 3HG2 THR 76 -7.096 -12.388 -3.713
545 H VAL 77 H VAL 77 -3.507 -12.707 -2.592
546 HA VAL 77 HA VAL 77 -2.396 -14.392 -4.683
547 HB VAL 77 HB VAL 77 -0.641 -12.766 -4.459
548 1HG1 VAL 77 1HG1 VAL 77 -0.757 -13.247 -1.483
549 2HG1 VAL 77 2HG1 VAL 77 -1.298 -11.791 -2.320
550 3HG1 VAL 77 3HG1 VAL 77 0.412 -12.225 -2.318
551 1HG2 VAL 77 1HG2 VAL 77 0.058 -15.126 -4.591
552 2HG2 VAL 77 2HG2 VAL 77 0.124 -15.188 -2.827
553 3HG2 VAL 77 3HG2 VAL 77 1.221 -14.129 -3.716
554 H LYS 78 H LYS 78 -2.190 -16.488 -4.045
555 HA LYS 78 HA LYS 78 -2.199 -17.010 -1.176
556 1HB LYS 78 2HB LYS 78 -3.363 -19.274 -2.000
557 2HB LYS 78 1HB LYS 78 -4.267 -17.856 -1.495
558 1HG LYS 78 2HG LYS 78 -5.308 -18.566 -3.454
559 2HG LYS 78 1HG LYS 78 -4.309 -17.204 -3.954
560 1HD LYS 78 2HD LYS 78 -4.098 -18.962 -5.579
561 2HD LYS 78 1HD LYS 78 -2.577 -18.820 -4.701
562 1HE LYS 78 2HE LYS 78 -3.152 -20.735 -3.333
563 2HE LYS 78 1HE LYS 78 -4.730 -20.849 -4.111
564 1HZ LYS 78 1HZ LYS 78 -3.243 -22.458 -5.061
565 2HZ LYS 78 2HZ LYS 78 -2.093 -21.267 -5.409
566 3HZ LYS 78 3HZ LYS 78 -3.576 -21.268 -6.222
567 H ALA 79 H ALA 79 -0.191 -17.496 -0.812
568 HA ALA 79 HA ALA 79 1.009 -19.854 -1.848
569 1HB ALA 79 1HB ALA 79 2.221 -17.208 -2.656
570 2HB ALA 79 2HB ALA 79 1.464 -18.370 -3.746
571 3HB ALA 79 3HB ALA 79 2.954 -18.794 -2.903
572 H ALA 80 H ALA 80 3.295 -20.057 -0.876
573 HA ALA 80 HA ALA 80 3.163 -18.848 1.801
574 1HB ALA 80 1HB ALA 80 4.766 -21.217 0.840
575 2HB ALA 80 2HB ALA 80 3.246 -21.287 1.731
576 3HB ALA 80 3HB ALA 80 4.688 -20.622 2.498
577 H GLY 81 H GLY 81 4.021 -16.849 1.368
578 1HA GLY 81 2HA GLY 81 6.921 -16.754 1.068
579 2HA GLY 81 1HA GLY 81 5.989 -15.953 -0.193
580 H THR 82 H THR 82 7.712 -14.452 1.335
581 HA THR 82 HA THR 82 5.934 -13.132 3.264
582 HB THR 82 HB THR 82 8.855 -12.485 2.851
583 HG1 THR 82 1HG THR 82 8.420 -14.784 3.419
584 1HG2 THR 82 1HG2 THR 82 7.555 -10.861 4.119
585 2HG2 THR 82 2HG2 THR 82 8.660 -11.721 5.193
586 3HG2 THR 82 3HG2 THR 82 6.944 -12.142 5.168
587 H HIS 83 H HIS 83 5.221 -11.102 2.966
588 HA HIS 83 HA HIS 83 5.599 -10.006 0.264
589 1HB HIS 83 2HB HIS 83 3.278 -10.767 1.146
590 2HB HIS 83 1HB HIS 83 3.350 -9.350 2.175
591 HD1 HIS 83 1HD HIS 83 4.030 -7.068 0.547
592 HD2 HIS 83 2HD HIS 83 1.823 -10.204 -1.048
593 HE1 HIS 83 1HE HIS 83 2.801 -6.082 -1.414
594 HE2 HIS 83 2HE HIS 83 1.565 -8.041 -2.442
595 H ALA 84 H ALA 84 7.200 -8.497 0.390
596 HA ALA 84 HA ALA 84 7.185 -6.647 2.674
597 1HB ALA 84 1HB ALA 84 9.449 -6.031 1.952
598 2HB ALA 84 2HB ALA 84 9.307 -7.128 0.578
599 3HB ALA 84 3HB ALA 84 9.308 -7.768 2.222
600 H VAL 85 H VAL 85 6.090 -4.834 2.377
601 HA VAL 85 HA VAL 85 5.580 -3.987 -0.397
602 HB VAL 85 HB VAL 85 3.963 -2.923 1.844
603 1HG1 VAL 85 1HG1 VAL 85 2.174 -3.092 0.199
604 2HG1 VAL 85 2HG1 VAL 85 3.279 -3.888 -0.922
605 3HG1 VAL 85 3HG1 VAL 85 3.562 -2.213 -0.445
606 1HG2 VAL 85 1HG2 VAL 85 4.119 -5.241 2.487
607 2HG2 VAL 85 2HG2 VAL 85 3.694 -5.748 0.847
608 3HG2 VAL 85 3HG2 VAL 85 2.506 -4.904 1.842
609 H ASN 86 H ASN 86 7.072 -2.494 -0.884
610 HA ASN 86 HA ASN 86 7.334 -0.171 0.920
611 1HB ASN 86 2HB ASN 86 9.120 -1.138 -1.335
612 2HB ASN 86 1HB ASN 86 9.316 0.415 -0.540
613 1HD2 ASN 86 1HD2 ASN 86 8.425 -2.572 1.090
614 2HD2 ASN 86 2HD2 ASN 86 9.895 -2.723 1.993
615 H LEU 87 H LEU 87 5.759 1.188 0.405
616 HA LEU 87 HA LEU 87 5.177 1.664 -2.437
617 1HB LEU 87 2HB LEU 87 3.559 2.346 0.023
618 2HB LEU 87 1HB LEU 87 3.087 2.698 -1.630
619 HG LEU 87 HG LEU 87 3.488 -0.086 -0.514
620 1HD1 LEU 87 1HD1 LEU 87 1.556 1.005 0.490
621 2HD1 LEU 87 2HD1 LEU 87 1.055 -0.256 -0.637
622 3HD1 LEU 87 3HD1 LEU 87 0.956 1.441 -1.111
623 1HD2 LEU 87 1HD2 LEU 87 2.339 0.859 -3.130
624 2HD2 LEU 87 2HD2 LEU 87 2.488 -0.813 -2.588
625 3HD2 LEU 87 3HD2 LEU 87 3.937 0.142 -2.909
626 H THR 88 H THR 88 5.630 3.633 -3.317
627 HA THR 88 HA THR 88 7.117 5.407 -1.526
628 HB THR 88 HB THR 88 7.289 5.314 -4.543
629 HG1 THR 88 1HG THR 88 8.111 3.386 -4.110
630 1HG2 THR 88 1HG2 THR 88 9.473 6.360 -4.162
631 2HG2 THR 88 2HG2 THR 88 9.193 6.336 -2.421
632 3HG2 THR 88 3HG2 THR 88 8.184 7.340 -3.465
633 H TYR 89 H TYR 89 6.709 7.505 -1.384
634 HA TYR 89 HA TYR 89 4.131 8.405 -2.460
635 1HB TYR 89 2HB TYR 89 4.696 8.206 0.073
636 2HB TYR 89 1HB TYR 89 5.665 9.651 -0.180
637 HD1 TYR 89 1HD TYR 89 3.187 10.185 -2.404
638 HD2 TYR 89 2HD TYR 89 3.710 9.907 1.796
639 HE1 TYR 89 1HE TYR 89 1.189 11.576 -2.066
640 HE2 TYR 89 2HE TYR 89 1.724 11.295 2.144
641 HH TYR 89 HH TYR 89 0.449 13.043 0.824
642 H MET 90 H MET 90 4.801 9.247 -4.467
643 HA MET 90 HA MET 90 6.652 11.557 -4.327
644 1HB MET 90 2HB MET 90 6.725 9.987 -6.840
645 2HB MET 90 1HB MET 90 8.000 10.888 -6.047
646 1HG MET 90 2HG MET 90 8.384 9.082 -4.506
647 2HG MET 90 1HG MET 90 7.023 8.185 -5.175
648 1HE MET 90 1HE MET 90 8.314 7.265 -8.771
649 2HE MET 90 2HE MET 90 7.218 8.555 -8.264
650 3HE MET 90 3HE MET 90 7.067 6.938 -7.564
651 H ARG 91 H ARG 91 6.525 12.839 -6.410
652 HA ARG 91 HA ARG 91 3.787 13.145 -7.296
653 1HB ARG 91 2HB ARG 91 6.322 14.631 -7.493
654 2HB ARG 91 1HB ARG 91 5.401 14.647 -8.986
655 1HG ARG 91 2HG ARG 91 3.546 15.695 -7.921
656 2HG ARG 91 1HG ARG 91 4.263 15.475 -6.323
657 1HD ARG 91 2HD ARG 91 6.114 16.952 -6.965
658 2HD ARG 91 1HD ARG 91 5.388 17.170 -8.553
659 HE ARG 91 HE ARG 91 3.415 18.002 -6.948
660 1HH1 ARG 91 1HH1 ARG 91 6.837 18.750 -6.997
661 2HH1 ARG 91 2HH1 ARG 91 6.618 20.355 -6.377
662 1HH2 ARG 91 1HH2 ARG 91 3.130 20.111 -6.132
663 2HH2 ARG 91 2HH2 ARG 91 4.519 21.128 -5.869
664 HA PRO 92 HA PRO 92 4.161 9.752 -10.075
665 1HB PRO 92 2HB PRO 92 2.019 10.776 -11.681
666 2HB PRO 92 1HB PRO 92 1.970 9.464 -10.508
667 1HG PRO 92 2HG PRO 92 1.087 12.235 -10.233
668 2HG PRO 92 1HG PRO 92 0.697 10.828 -9.233
669 1HD PRO 92 2HD PRO 92 2.306 12.902 -8.435
670 2HD PRO 92 1HD PRO 92 2.396 11.264 -7.765
671 H TRP 93 H TRP 93 3.877 13.045 -11.345
672 HA TRP 93 HA TRP 93 4.826 12.210 -13.940
673 1HB TRP 93 2HB TRP 93 4.658 14.657 -14.494
674 2HB TRP 93 1HB TRP 93 3.152 13.907 -13.973
675 HD1 TRP 93 HD TRP 93 5.642 16.606 -13.011
676 HE1 TRP 93 1HE TRP 93 4.701 17.956 -11.028
677 HE3 TRP 93 3HE TRP 93 1.637 13.652 -11.859
678 HZ2 TRP 93 2HZ TRP 93 2.538 17.783 -9.220
679 HZ3 TRP 93 3HZ TRP 93 0.185 14.309 -9.990
680 HH2 TRP 93 HH TRP 93 0.626 16.334 -8.700
681 H THR 94 H THR 94 6.369 12.671 -11.119
682 HA THR 94 HA THR 94 8.901 12.684 -12.346
683 HB THR 94 HB THR 94 8.703 15.016 -12.693
684 HG1 THR 94 1HG THR 94 10.507 15.661 -11.668
685 1HG2 THR 94 1HG2 THR 94 6.830 15.483 -11.177
686 2HG2 THR 94 2HG2 THR 94 8.143 16.639 -10.958
687 3HG2 THR 94 3HG2 THR 94 7.914 15.335 -9.794
688 H GLY 95 H GLY 95 7.849 14.064 -9.193
689 1HA GLY 95 2HA GLY 95 8.149 13.191 -7.037
690 2HA GLY 95 1HA GLY 95 8.785 11.713 -7.784
691 HA PRO 96 HA PRO 96 12.125 15.222 -7.234
692 1HB PRO 96 2HB PRO 96 11.586 15.927 -4.451
693 2HB PRO 96 1HB PRO 96 11.699 16.972 -5.856
694 1HG PRO 96 2HG PRO 96 9.368 16.528 -4.608
695 2HG PRO 96 1HG PRO 96 9.462 16.775 -6.364
696 1HD PRO 96 2HD PRO 96 9.249 14.208 -4.822
697 2HD PRO 96 1HD PRO 96 8.365 14.724 -6.276
698 H SER 97 H SER 97 12.099 12.407 -6.627
699 HA SER 97 HA SER 97 13.261 10.750 -5.595
700 1HB SER 97 2HB SER 97 14.926 12.005 -7.042
701 2HB SER 97 1HB SER 97 15.514 12.758 -5.560
702 HG SER 97 HG SER 97 16.010 10.660 -4.770
703 H HIS 98 H HIS 98 15.064 13.301 -3.956
704 HA HIS 98 HA HIS 98 15.061 11.916 -1.479
705 1HB HIS 98 2HB HIS 98 15.683 14.843 -1.935
706 2HB HIS 98 1HB HIS 98 16.196 13.855 -0.578
707 HD1 HIS 98 1HD HIS 98 17.993 11.923 -1.193
708 HD2 HIS 98 2HD HIS 98 17.415 14.916 -4.025
709 HE1 HIS 98 1HE HIS 98 20.007 11.840 -2.695
710 HE2 HIS 98 2HE HIS 98 19.725 13.788 -4.268
711 H ASP 99 H ASP 99 12.806 14.043 -2.969
712 HA ASP 99 HA ASP 99 11.833 15.078 -0.415
713 1HB ASP 99 2HB ASP 99 12.226 16.525 -2.473
714 2HB ASP 99 1HB ASP 99 10.808 15.759 -3.186
715 H SER 100 H SER 100 11.440 12.354 -2.034
716 HA SER 100 HA SER 100 8.544 12.135 -1.781
717 1HB SER 100 2HB SER 100 10.496 10.041 -2.751
718 2HB SER 100 1HB SER 100 8.756 10.106 -3.033
719 HG SER 100 HG SER 100 10.750 11.242 -4.442
720 H GLU 101 H GLU 101 7.540 10.725 -0.373
721 HA GLU 101 HA GLU 101 9.205 9.644 1.794
722 1HB GLU 101 2HB GLU 101 7.265 11.152 2.341
723 2HB GLU 101 1HB GLU 101 6.189 9.930 1.682
724 1HG GLU 101 2HG GLU 101 6.389 9.951 4.175
725 2HG GLU 101 1HG GLU 101 6.723 8.399 3.410
726 H ARG 102 H ARG 102 8.042 7.445 2.694
727 HA ARG 102 HA ARG 102 6.968 5.780 0.609
728 1HB ARG 102 2HB ARG 102 9.512 5.924 0.195
729 2HB ARG 102 1HB ARG 102 9.698 5.002 1.677
730 1HG ARG 102 2HG ARG 102 8.542 3.131 0.729
731 2HG ARG 102 1HG ARG 102 8.121 4.060 -0.708
732 1HD ARG 102 2HD ARG 102 10.619 4.343 -1.074
733 2HD ARG 102 1HD ARG 102 10.836 3.111 0.166
734 HE ARG 102 HE ARG 102 9.050 2.196 -1.843
735 1HH1 ARG 102 1HH1 ARG 102 12.457 2.859 -1.326
736 2HH1 ARG 102 2HH1 ARG 102 12.990 1.656 -2.460
737 1HH2 ARG 102 1HH2 ARG 102 9.758 0.612 -3.345
738 2HH2 ARG 102 2HH2 ARG 102 11.462 0.362 -3.584
739 H PHE 103 H PHE 103 6.096 3.953 1.342
740 HA PHE 103 HA PHE 103 5.904 3.622 4.252
741 1HB PHE 103 2HB PHE 103 3.719 3.864 3.602
742 2HB PHE 103 1HB PHE 103 4.055 3.368 1.950
743 HD1 PHE 103 1HD PHE 103 2.957 2.345 5.227
744 HD2 PHE 103 2HD PHE 103 4.109 0.992 1.368
745 HE1 PHE 103 1HE PHE 103 1.958 0.153 5.697
746 HE2 PHE 103 2HE PHE 103 3.115 -1.201 1.832
747 HZ PHE 103 HZ PHE 103 2.040 -1.618 4.000
748 H THR 104 H THR 104 5.863 1.363 5.078
749 HA THR 104 HA THR 104 6.761 -0.700 3.289
750 HB THR 104 HB THR 104 8.626 0.310 5.447
751 HG1 THR 104 1HG THR 104 8.412 0.886 2.842
752 1HG2 THR 104 1HG2 THR 104 10.116 -1.505 4.741
753 2HG2 THR 104 2HG2 THR 104 8.874 -2.093 3.635
754 3HG2 THR 104 3HG2 THR 104 8.591 -2.128 5.376
755 H VAL 105 H VAL 105 5.089 -2.030 3.998
756 HA VAL 105 HA VAL 105 5.397 -2.851 6.807
757 HB VAL 105 HB VAL 105 3.081 -2.255 6.122
758 1HG1 VAL 105 1HG1 VAL 105 1.841 -3.784 4.675
759 2HG1 VAL 105 2HG1 VAL 105 3.325 -4.682 4.353
760 3HG1 VAL 105 3HG1 VAL 105 3.171 -3.011 3.809
761 1HG2 VAL 105 1HG2 VAL 105 3.414 -5.175 6.797
762 2HG2 VAL 105 2HG2 VAL 105 2.024 -4.150 7.165
763 3HG2 VAL 105 3HG2 VAL 105 3.574 -3.855 7.952
764 H TYR 106 H TYR 106 6.112 -4.793 7.304
765 HA TYR 106 HA TYR 106 6.698 -6.665 5.115
766 1HB TYR 106 2HB TYR 106 7.780 -6.547 7.928
767 2HB TYR 106 1HB TYR 106 8.220 -7.760 6.738
768 HD1 TYR 106 1HD TYR 106 9.492 -7.041 4.696
769 HD2 TYR 106 2HD TYR 106 8.857 -4.450 8.010
770 HE1 TYR 106 1HE TYR 106 11.309 -5.591 3.900
771 HE2 TYR 106 2HE TYR 106 10.674 -2.993 7.225
772 HH TYR 106 HH TYR 106 12.670 -3.123 5.821
773 H LEU 107 H LEU 107 4.901 -7.877 4.899
774 HA LEU 107 HA LEU 107 4.065 -9.307 7.314
775 1HB LEU 107 2HB LEU 107 1.754 -9.312 6.634
776 2HB LEU 107 1HB LEU 107 2.331 -7.675 6.771
777 HG LEU 107 HG LEU 107 0.825 -7.787 4.938
778 1HD1 LEU 107 1HD1 LEU 107 3.620 -7.658 3.858
779 2HD1 LEU 107 2HD1 LEU 107 2.719 -6.337 4.597
780 3HD1 LEU 107 3HD1 LEU 107 2.171 -7.030 3.071
781 1HD2 LEU 107 1HD2 LEU 107 2.495 -10.021 3.807
782 2HD2 LEU 107 2HD2 LEU 107 1.152 -9.225 2.985
783 3HD2 LEU 107 3HD2 LEU 107 0.861 -10.153 4.458
784 H LYS 108 H LYS 108 3.328 -11.495 6.950
785 HA LYS 108 HA LYS 108 4.760 -12.575 4.619
786 1HB LYS 108 2HB LYS 108 5.375 -13.278 7.020
787 2HB LYS 108 1HB LYS 108 3.872 -14.186 7.001
788 1HG LYS 108 2HG LYS 108 4.668 -15.333 4.944
789 2HG LYS 108 1HG LYS 108 6.225 -14.532 5.166
790 1HD LYS 108 2HD LYS 108 6.292 -15.559 7.475
791 2HD LYS 108 1HD LYS 108 4.902 -16.532 6.988
792 1HE LYS 108 2HE LYS 108 7.599 -16.492 5.632
793 2HE LYS 108 1HE LYS 108 7.009 -17.753 6.710
794 1HZ LYS 108 1HZ LYS 108 5.330 -18.341 5.141
795 2HZ LYS 108 2HZ LYS 108 6.805 -18.281 4.309
796 3HZ LYS 108 3HZ LYS 108 5.694 -17.015 4.156
797 H ALA 109 H ALA 109 3.629 -13.443 3.029
798 HA ALA 109 HA ALA 109 0.729 -13.572 3.408
799 1HB ALA 109 1HB ALA 109 0.576 -13.271 0.991
800 2HB ALA 109 2HB ALA 109 2.335 -13.304 0.867
801 3HB ALA 109 3HB ALA 109 1.534 -11.983 1.722
802 H ASN 110 H ASN 110 -0.155 -15.445 3.553
803 HA ASN 110 HA ASN 110 0.400 -17.745 2.084
804 1HB ASN 110 2HB ASN 110 1.397 -19.078 4.086
805 2HB ASN 110 1HB ASN 110 2.448 -18.179 3.018
806 1HD2 ASN 110 1HD2 ASN 110 0.507 -16.571 5.463
807 2HD2 ASN 110 2HD2 ASN 110 1.850 -16.108 6.451
Start of MODEL 13
1 H HIS 3 H HIS 3 -6.088 -10.193 4.631
2 HA HIS 3 HA HIS 3 -5.452 -9.026 7.260
3 1HB HIS 3 2HB HIS 3 -3.671 -10.536 6.827
4 2HB HIS 3 1HB HIS 3 -3.728 -10.184 5.097
5 HD1 HIS 3 1HD HIS 3 -2.894 -8.199 8.264
6 HD2 HIS 3 2HD HIS 3 -1.646 -8.714 4.318
7 HE1 HIS 3 1HE HIS 3 -0.953 -6.630 7.957
8 HE2 HIS 3 2HE HIS 3 -0.145 -7.045 5.607
9 H LYS 4 H LYS 4 -4.898 -6.847 7.304
10 HA LYS 4 HA LYS 4 -4.946 -5.434 4.731
11 1HB LYS 4 2HB LYS 4 -6.494 -3.793 5.534
12 2HB LYS 4 1HB LYS 4 -7.193 -5.388 5.805
13 1HG LYS 4 2HG LYS 4 -6.762 -5.289 8.131
14 2HG LYS 4 1HG LYS 4 -5.735 -3.864 7.951
15 1HD LYS 4 2HD LYS 4 -7.714 -2.583 7.194
16 2HD LYS 4 1HD LYS 4 -8.714 -4.007 7.489
17 1HE LYS 4 2HE LYS 4 -8.170 -3.950 9.841
18 2HE LYS 4 1HE LYS 4 -7.042 -2.621 9.582
19 1HZ LYS 4 1HZ LYS 4 -9.982 -2.496 9.137
20 2HZ LYS 4 2HZ LYS 4 -8.888 -1.220 8.912
21 3HZ LYS 4 3HZ LYS 4 -9.155 -1.845 10.463
22 H VAL 5 H VAL 5 -3.825 -3.469 4.685
23 HA VAL 5 HA VAL 5 -2.271 -2.861 7.101
24 HB VAL 5 HB VAL 5 -1.281 -3.221 4.318
25 1HG1 VAL 5 1HG1 VAL 5 0.636 -1.735 4.706
26 2HG1 VAL 5 2HG1 VAL 5 -0.185 -1.087 6.126
27 3HG1 VAL 5 3HG1 VAL 5 -0.885 -0.857 4.525
28 1HG2 VAL 5 1HG2 VAL 5 0.015 -3.439 7.026
29 2HG2 VAL 5 2HG2 VAL 5 0.648 -4.048 5.496
30 3HG2 VAL 5 3HG2 VAL 5 -0.812 -4.756 6.188
31 H THR 6 H THR 6 -1.571 -0.668 7.304
32 HA THR 6 HA THR 6 -3.253 1.370 6.098
33 HB THR 6 HB THR 6 -3.701 2.219 8.493
34 HG1 THR 6 1HG THR 6 -3.463 0.801 10.124
35 1HG2 THR 6 1HG2 THR 6 -5.098 -0.255 7.458
36 2HG2 THR 6 2HG2 THR 6 -5.478 1.419 7.044
37 3HG2 THR 6 3HG2 THR 6 -5.741 0.834 8.689
38 H LYS 7 H LYS 7 -2.520 3.596 7.142
39 HA LYS 7 HA LYS 7 0.094 4.020 6.401
40 1HB LYS 7 2HB LYS 7 -1.570 5.802 6.692
41 2HB LYS 7 1HB LYS 7 -1.448 5.630 8.438
42 1HG LYS 7 2HG LYS 7 -0.164 7.544 7.442
43 2HG LYS 7 1HG LYS 7 0.772 6.449 8.463
44 1HD LYS 7 2HD LYS 7 1.707 5.363 6.535
45 2HD LYS 7 1HD LYS 7 0.655 6.272 5.448
46 1HE LYS 7 2HE LYS 7 2.965 7.149 5.498
47 2HE LYS 7 1HE LYS 7 1.780 8.337 6.038
48 1HZ LYS 7 1HZ LYS 7 2.457 8.120 8.244
49 2HZ LYS 7 2HZ LYS 7 3.916 8.103 7.379
50 3HZ LYS 7 3HZ LYS 7 3.265 6.654 7.972
51 H ALA 8 H ALA 8 -1.044 3.212 9.685
52 HA ALA 8 HA ALA 8 1.359 3.641 11.066
53 1HB ALA 8 1HB ALA 8 -0.808 3.170 12.149
54 2HB ALA 8 2HB ALA 8 0.494 2.142 12.755
55 3HB ALA 8 3HB ALA 8 -0.683 1.492 11.613
56 H HIS 9 H HIS 9 0.229 0.921 9.197
57 HA HIS 9 HA HIS 9 2.231 -0.936 9.890
58 1HB HIS 9 2HB HIS 9 0.364 -0.689 7.554
59 2HB HIS 9 1HB HIS 9 1.571 -1.964 7.621
60 HD1 HIS 9 1HD HIS 9 -1.809 -1.094 8.784
61 HD2 HIS 9 2HD HIS 9 1.163 -3.813 9.828
62 HE1 HIS 9 1HE HIS 9 -2.991 -3.002 9.890
63 HE2 HIS 9 2HE HIS 9 -1.180 -4.573 10.650
64 H ASN 10 H ASN 10 2.526 1.941 8.267
65 HA ASN 10 HA ASN 10 4.398 1.622 6.274
66 1HB ASN 10 2HB ASN 10 3.576 3.816 6.780
67 2HB ASN 10 1HB ASN 10 4.149 3.718 8.443
68 1HD2 ASN 10 1HD2 ASN 10 5.005 4.307 5.149
69 2HD2 ASN 10 2HD2 ASN 10 6.589 4.930 5.449
70 H GLY 11 H GLY 11 4.675 0.845 9.599
71 1HA GLY 11 2HA GLY 11 7.497 0.096 9.159
72 2HA GLY 11 1HA GLY 11 7.049 0.960 10.627
73 H ALA 12 H ALA 12 5.535 -1.712 8.816
74 HA ALA 12 HA ALA 12 5.236 -3.090 11.408
75 1HB ALA 12 1HB ALA 12 3.107 -2.550 10.662
76 2HB ALA 12 2HB ALA 12 3.307 -4.231 10.155
77 3HB ALA 12 3HB ALA 12 3.500 -2.922 8.987
78 H THR 13 H THR 13 5.385 -5.336 11.511
79 HA THR 13 HA THR 13 6.189 -6.864 9.166
80 HB THR 13 HB THR 13 7.826 -6.920 11.718
81 HG1 THR 13 1HG THR 13 7.965 -5.268 9.615
82 1HG2 THR 13 1HG2 THR 13 7.732 -9.086 10.599
83 2HG2 THR 13 2HG2 THR 13 9.335 -8.372 10.421
84 3HG2 THR 13 3HG2 THR 13 8.200 -8.335 9.074
85 H LEU 14 H LEU 14 4.566 -8.350 9.179
86 HA LEU 14 HA LEU 14 3.908 -9.700 11.687
87 1HB LEU 14 2HB LEU 14 1.543 -8.936 10.115
88 2HB LEU 14 1HB LEU 14 1.745 -9.068 11.848
89 HG LEU 14 HG LEU 14 3.107 -6.858 11.592
90 1HD1 LEU 14 1HD1 LEU 14 1.384 -6.799 9.124
91 2HD1 LEU 14 2HD1 LEU 14 3.141 -6.931 9.151
92 3HD1 LEU 14 3HD1 LEU 14 2.358 -5.468 9.752
93 1HD2 LEU 14 1HD2 LEU 14 1.046 -5.572 11.890
94 2HD2 LEU 14 2HD2 LEU 14 1.010 -7.070 12.819
95 3HD2 LEU 14 3HD2 LEU 14 0.104 -6.944 11.310
96 H THR 15 H THR 15 2.364 -11.508 11.353
97 HA THR 15 HA THR 15 2.840 -12.837 8.776
98 HB THR 15 HB THR 15 1.907 -13.909 11.444
99 HG1 THR 15 1HG THR 15 4.284 -13.437 10.652
100 1HG2 THR 15 1HG2 THR 15 0.762 -15.001 9.528
101 2HG2 THR 15 2HG2 THR 15 1.820 -16.098 10.428
102 3HG2 THR 15 3HG2 THR 15 2.346 -15.435 8.879
103 H VAL 16 H VAL 16 1.136 -13.481 7.469
104 HA VAL 16 HA VAL 16 -1.529 -12.573 8.346
105 HB VAL 16 HB VAL 16 -1.971 -11.512 6.307
106 1HG1 VAL 16 1HG1 VAL 16 0.931 -10.978 6.942
107 2HG1 VAL 16 2HG1 VAL 16 -0.459 -10.259 7.756
108 3HG1 VAL 16 3HG1 VAL 16 -0.151 -9.898 6.057
109 1HG2 VAL 16 1HG2 VAL 16 0.539 -12.746 5.164
110 2HG2 VAL 16 2HG2 VAL 16 -0.554 -11.640 4.324
111 3HG2 VAL 16 3HG2 VAL 16 -1.118 -13.239 4.803
112 H ALA 17 H ALA 17 -3.326 -13.518 7.225
113 HA ALA 17 HA ALA 17 -2.749 -16.070 5.868
114 1HB ALA 17 1HB ALA 17 -5.117 -15.184 7.508
115 2HB ALA 17 2HB ALA 17 -3.977 -16.476 7.893
116 3HB ALA 17 3HB ALA 17 -5.096 -16.658 6.539
117 H VAL 18 H VAL 18 -3.147 -15.962 3.713
118 HA VAL 18 HA VAL 18 -4.999 -13.852 2.816
119 HB VAL 18 HB VAL 18 -3.177 -15.309 0.930
120 1HG1 VAL 18 1HG1 VAL 18 -4.887 -13.834 0.005
121 2HG1 VAL 18 2HG1 VAL 18 -3.278 -13.172 -0.283
122 3HG1 VAL 18 3HG1 VAL 18 -4.293 -12.501 0.995
123 1HG2 VAL 18 1HG2 VAL 18 -1.921 -14.396 2.978
124 2HG2 VAL 18 2HG2 VAL 18 -2.307 -12.804 2.333
125 3HG2 VAL 18 3HG2 VAL 18 -1.343 -13.934 1.376
126 H GLY 19 H GLY 19 -5.283 -15.110 0.188
127 1HA GLY 19 2HA GLY 19 -6.339 -17.126 -0.657
128 2HA GLY 19 1HA GLY 19 -6.971 -17.399 0.966
129 H GLU 20 H GLU 20 -8.055 -15.131 1.703
130 HA GLU 20 HA GLU 20 -10.269 -14.674 -0.072
131 1HB GLU 20 2HB GLU 20 -9.488 -13.201 2.460
132 2HB GLU 20 1HB GLU 20 -11.050 -13.124 1.656
133 1HG GLU 20 2HG GLU 20 -9.857 -15.604 2.874
134 2HG GLU 20 1HG GLU 20 -11.049 -14.567 3.657
135 H LEU 21 H LEU 21 -8.211 -12.299 1.528
136 HA LEU 21 HA LEU 21 -7.123 -11.220 -0.866
137 1HB LEU 21 2HB LEU 21 -9.333 -10.269 -1.115
138 2HB LEU 21 1HB LEU 21 -9.333 -9.720 0.547
139 HG LEU 21 HG LEU 21 -7.506 -8.135 -0.008
140 1HD1 LEU 21 1HD1 LEU 21 -8.004 -9.012 -2.845
141 2HD1 LEU 21 2HD1 LEU 21 -6.558 -9.364 -1.901
142 3HD1 LEU 21 3HD1 LEU 21 -6.950 -7.699 -2.325
143 1HD2 LEU 21 1HD2 LEU 21 -9.837 -7.415 -0.029
144 2HD2 LEU 21 2HD2 LEU 21 -9.972 -7.893 -1.723
145 3HD2 LEU 21 3HD2 LEU 21 -8.898 -6.573 -1.262
146 H VAL 22 H VAL 22 -5.353 -9.903 -0.392
147 HA VAL 22 HA VAL 22 -5.144 -9.081 2.432
148 HB VAL 22 HB VAL 22 -3.144 -10.488 0.751
149 1HG1 VAL 22 1HG1 VAL 22 -1.252 -9.470 2.035
150 2HG1 VAL 22 2HG1 VAL 22 -2.366 -8.227 2.611
151 3HG1 VAL 22 3HG1 VAL 22 -2.004 -8.357 0.892
152 1HG2 VAL 22 1HG2 VAL 22 -4.206 -11.506 2.684
153 2HG2 VAL 22 2HG2 VAL 22 -3.595 -10.218 3.719
154 3HG2 VAL 22 3HG2 VAL 22 -2.471 -11.334 2.941
155 H GLU 23 H GLU 23 -5.356 -6.967 2.599
156 HA GLU 23 HA GLU 23 -4.719 -5.402 0.205
157 1HB GLU 23 2HB GLU 23 -6.623 -4.279 0.463
158 2HB GLU 23 1HB GLU 23 -7.077 -5.519 1.618
159 1HG GLU 23 2HG GLU 23 -6.457 -4.168 3.455
160 2HG GLU 23 1HG GLU 23 -5.637 -3.004 2.410
161 H ILE 24 H ILE 24 -3.404 -3.750 0.255
162 HA ILE 24 HA ILE 24 -2.236 -2.922 2.831
163 HB ILE 24 HB ILE 24 -1.013 -2.746 0.066
164 1HG1 ILE 24 2HG1 ILE 24 -1.149 -5.064 0.834
165 2HG1 ILE 24 1HG1 ILE 24 0.526 -4.511 0.821
166 1HG2 ILE 24 1HG2 ILE 24 0.163 -2.151 2.774
167 2HG2 ILE 24 2HG2 ILE 24 -0.286 -0.961 1.553
168 3HG2 ILE 24 3HG2 ILE 24 1.028 -2.096 1.239
169 1HD1 ILE 24 1HD1 ILE 24 0.460 -4.196 3.223
170 2HD1 ILE 24 2HD1 ILE 24 -0.025 -5.839 2.811
171 3HD1 ILE 24 3HD1 ILE 24 -1.246 -4.645 3.261
172 H GLN 25 H GLN 25 -3.406 -1.119 3.340
173 HA GLN 25 HA GLN 25 -4.188 0.614 1.110
174 1HB GLN 25 2HB GLN 25 -6.118 -0.103 2.173
175 2HB GLN 25 1HB GLN 25 -5.396 0.033 3.777
176 1HG GLN 25 2HG GLN 25 -5.537 2.559 2.369
177 2HG GLN 25 1HG GLN 25 -7.115 1.814 2.591
178 1HE2 GLN 25 1HE2 GLN 25 -4.322 3.123 4.239
179 2HE2 GLN 25 2HE2 GLN 25 -5.084 3.317 5.779
180 H LEU 26 H LEU 26 -3.720 2.737 1.093
181 HA LEU 26 HA LEU 26 -2.500 3.769 3.497
182 1HB LEU 26 2HB LEU 26 -1.490 3.951 0.724
183 2HB LEU 26 1HB LEU 26 -1.157 5.263 1.851
184 HG LEU 26 HG LEU 26 -0.663 2.521 2.830
185 1HD1 LEU 26 1HD1 LEU 26 1.139 3.863 0.834
186 2HD1 LEU 26 2HD1 LEU 26 0.229 2.368 0.594
187 3HD1 LEU 26 3HD1 LEU 26 1.531 2.427 1.782
188 1HD2 LEU 26 1HD2 LEU 26 -0.285 4.431 4.251
189 2HD2 LEU 26 2HD2 LEU 26 0.818 5.126 3.063
190 3HD2 LEU 26 3HD2 LEU 26 1.240 3.625 3.888
191 HA PRO 27 HA PRO 27 -5.647 6.738 3.269
192 1HB PRO 27 2HB PRO 27 -4.792 8.435 5.148
193 2HB PRO 27 1HB PRO 27 -5.270 6.779 5.564
194 1HG PRO 27 2HG PRO 27 -2.513 7.903 5.120
195 2HG PRO 27 1HG PRO 27 -3.100 6.845 6.429
196 1HD PRO 27 2HD PRO 27 -1.757 5.925 4.252
197 2HD PRO 27 1HD PRO 27 -2.951 4.960 5.139
198 H SER 28 H SER 28 -2.835 7.132 1.784
199 HA SER 28 HA SER 28 -1.888 8.658 0.424
200 1HB SER 28 2HB SER 28 -4.269 9.142 -0.286
201 2HB SER 28 1HB SER 28 -4.283 10.438 0.920
202 HG SER 28 HG SER 28 -2.726 10.208 -1.439
203 H ASN 29 H ASN 29 -3.518 10.308 3.047
204 HA ASN 29 HA ASN 29 -2.963 12.079 4.358
205 1HB ASN 29 2HB ASN 29 -0.070 11.320 4.230
206 2HB ASN 29 1HB ASN 29 -1.004 11.878 5.604
207 1HD2 ASN 29 1HD2 ASN 29 0.156 9.185 3.879
208 2HD2 ASN 29 2HD2 ASN 29 -0.499 7.961 4.912
209 HA PRO 30 HA PRO 30 -1.767 13.683 0.110
210 1HB PRO 30 2HB PRO 30 -3.510 15.837 1.257
211 2HB PRO 30 1HB PRO 30 -3.412 15.235 -0.408
212 1HG PRO 30 2HG PRO 30 -5.366 14.352 1.069
213 2HG PRO 30 1HG PRO 30 -4.390 13.168 0.171
214 1HD PRO 30 2HD PRO 30 -4.259 13.888 3.069
215 2HD PRO 30 1HD PRO 30 -4.224 12.283 2.304
216 H THR 31 H THR 31 0.037 14.604 -0.301
217 HA THR 31 HA THR 31 0.871 17.040 0.967
218 HB THR 31 HB THR 31 1.587 15.567 2.695
219 HG1 THR 31 1HG THR 31 3.220 17.108 1.505
220 1HG2 THR 31 1HG2 THR 31 3.038 13.897 0.640
221 2HG2 THR 31 2HG2 THR 31 1.492 13.462 1.363
222 3HG2 THR 31 3HG2 THR 31 2.935 13.596 2.375
223 H THR 32 H THR 32 1.031 17.963 -1.022
224 HA THR 32 HA THR 32 2.135 18.676 -2.885
225 HB THR 32 HB THR 32 4.152 16.470 -2.366
226 HG1 THR 32 1HG THR 32 3.612 18.182 -0.640
227 1HG2 THR 32 1HG2 THR 32 5.722 18.111 -3.443
228 2HG2 THR 32 2HG2 THR 32 4.313 19.069 -3.900
229 3HG2 THR 32 3HG2 THR 32 4.514 17.435 -4.534
230 H GLY 33 H GLY 33 2.870 17.687 -5.166
231 1HA GLY 33 2HA GLY 33 0.764 16.212 -6.239
232 2HA GLY 33 1HA GLY 33 2.314 16.446 -7.012
233 H PHE 34 H PHE 34 3.293 15.005 -4.358
234 HA PHE 34 HA PHE 34 3.808 12.501 -5.387
235 1HB PHE 34 2HB PHE 34 3.413 13.061 -2.451
236 2HB PHE 34 1HB PHE 34 4.436 11.837 -3.184
237 HD1 PHE 34 1HD PHE 34 5.080 14.012 -1.097
238 HD2 PHE 34 2HD PHE 34 5.631 13.758 -5.304
239 HE1 PHE 34 1HE PHE 34 6.996 15.541 -0.932
240 HE2 PHE 34 2HE PHE 34 7.549 15.289 -5.147
241 HZ PHE 34 HZ PHE 34 8.235 16.179 -2.959
242 H ALA 35 H ALA 35 2.954 10.426 -4.939
243 HA ALA 35 HA ALA 35 0.451 10.147 -3.507
244 1HB ALA 35 1HB ALA 35 -0.745 9.111 -5.367
245 2HB ALA 35 2HB ALA 35 0.644 9.353 -6.429
246 3HB ALA 35 3HB ALA 35 -0.254 10.746 -5.821
247 H TRP 36 H TRP 36 -0.037 7.846 -3.088
248 HA TRP 36 HA TRP 36 2.412 6.375 -2.727
249 1HB TRP 36 2HB TRP 36 -0.434 5.529 -2.062
250 2HB TRP 36 1HB TRP 36 1.025 4.631 -1.658
251 HD1 TRP 36 HD TRP 36 -1.174 7.425 -0.391
252 HE1 TRP 36 1HE TRP 36 -0.251 8.231 1.866
253 HE3 TRP 36 3HE TRP 36 3.308 5.007 -0.452
254 HZ2 TRP 36 2HZ TRP 36 2.061 7.873 3.432
255 HZ3 TRP 36 3HZ TRP 36 4.828 5.281 1.450
256 HH2 TRP 36 HH TRP 36 4.224 6.695 3.357
257 H TYR 37 H TYR 37 3.289 5.390 -4.422
258 HA TYR 37 HA TYR 37 1.805 3.165 -5.499
259 1HB TYR 37 2HB TYR 37 2.703 3.675 -7.832
260 2HB TYR 37 1HB TYR 37 1.325 4.620 -7.283
261 HD1 TYR 37 1HD TYR 37 1.455 7.000 -7.305
262 HD2 TYR 37 2HD TYR 37 4.989 4.659 -7.596
263 HE1 TYR 37 1HE TYR 37 2.753 9.020 -7.794
264 HE2 TYR 37 2HE TYR 37 6.280 6.667 -8.079
265 HH TYR 37 HH TYR 37 4.965 9.813 -7.752
266 H PHE 38 H PHE 38 3.150 1.462 -6.260
267 HA PHE 38 HA PHE 38 5.053 0.809 -4.448
268 1HB PHE 38 2HB PHE 38 4.231 -0.225 -7.035
269 2HB PHE 38 1HB PHE 38 5.898 -0.592 -6.617
270 HD1 PHE 38 1HD PHE 38 2.462 -1.433 -6.124
271 HD2 PHE 38 2HD PHE 38 6.337 -1.751 -4.392
272 HE1 PHE 38 1HE PHE 38 1.669 -3.279 -4.703
273 HE2 PHE 38 2HE PHE 38 5.552 -3.599 -2.971
274 HZ PHE 38 HZ PHE 38 3.218 -4.369 -3.134
275 H GLU 39 H GLU 39 6.167 1.159 -7.820
276 HA GLU 39 HA GLU 39 8.575 2.397 -6.687
277 1HB GLU 39 2HB GLU 39 9.864 1.322 -8.527
278 2HB GLU 39 1HB GLU 39 9.149 0.185 -7.394
279 1HG GLU 39 2HG GLU 39 7.406 -0.357 -8.959
280 2HG GLU 39 1HG GLU 39 7.972 0.884 -10.076
281 H GLY 40 H GLY 40 6.007 2.847 -8.796
282 1HA GLY 40 2HA GLY 40 6.089 5.380 -9.307
283 2HA GLY 40 1HA GLY 40 7.484 4.924 -10.272
284 H GLY 41 H GLY 41 4.035 4.956 -10.020
285 1HA GLY 41 2HA GLY 41 2.385 4.624 -11.588
286 2HA GLY 41 1HA GLY 41 3.646 4.683 -12.812
287 H THR 42 H THR 42 4.122 2.393 -10.367
288 HA THR 42 HA THR 42 3.018 0.208 -11.960
289 HB THR 42 HB THR 42 5.279 -0.933 -11.075
290 HG1 THR 42 1HG THR 42 6.762 0.979 -12.059
291 1HG2 THR 42 1HG2 THR 42 4.398 -1.121 -13.334
292 2HG2 THR 42 2HG2 THR 42 6.120 -0.744 -13.383
293 3HG2 THR 42 3HG2 THR 42 4.930 0.519 -13.706
294 H LYS 43 H LYS 43 2.332 -1.513 -10.843
295 HA LYS 43 HA LYS 43 3.248 -1.799 -8.099
296 1HB LYS 43 2HB LYS 43 0.841 -2.475 -7.529
297 2HB LYS 43 1HB LYS 43 1.261 -0.775 -7.573
298 1HG LYS 43 2HG LYS 43 -0.811 -0.901 -8.634
299 2HG LYS 43 1HG LYS 43 0.349 -0.793 -9.956
300 1HD LYS 43 2HD LYS 43 0.240 -3.283 -10.149
301 2HD LYS 43 1HD LYS 43 -1.067 -3.263 -8.962
302 1HE LYS 43 2HE LYS 43 -2.406 -1.867 -10.443
303 2HE LYS 43 1HE LYS 43 -1.091 -1.830 -11.617
304 1HZ LYS 43 1HZ LYS 43 -2.583 -4.252 -10.762
305 2HZ LYS 43 2HZ LYS 43 -1.309 -4.224 -11.884
306 3HZ LYS 43 3HZ LYS 43 -2.771 -3.436 -12.236
307 H GLU 44 H GLU 44 3.796 -3.787 -7.597
308 HA GLU 44 HA GLU 44 2.569 -6.033 -8.997
309 1HB GLU 44 2HB GLU 44 4.849 -7.094 -9.198
310 2HB GLU 44 1HB GLU 44 4.555 -5.734 -10.274
311 1HG GLU 44 2HG GLU 44 5.797 -4.275 -8.752
312 2HG GLU 44 1HG GLU 44 6.109 -5.654 -7.698
313 H SER 45 H SER 45 2.957 -8.091 -7.894
314 HA SER 45 HA SER 45 3.206 -7.707 -4.980
315 1HB SER 45 2HB SER 45 1.070 -8.700 -5.933
316 2HB SER 45 1HB SER 45 2.023 -10.086 -6.455
317 HG SER 45 HG SER 45 1.581 -10.802 -4.528
318 HA PRO 46 HA PRO 46 7.125 -9.840 -5.310
319 1HB PRO 46 2HB PRO 46 6.792 -10.442 -2.451
320 2HB PRO 46 1HB PRO 46 8.021 -9.464 -3.259
321 1HG PRO 46 2HG PRO 46 6.112 -8.348 -1.744
322 2HG PRO 46 1HG PRO 46 6.726 -7.555 -3.207
323 1HD PRO 46 2HD PRO 46 4.200 -9.126 -2.829
324 2HD PRO 46 1HD PRO 46 4.447 -7.595 -3.691
325 H ASN 47 H ASN 47 4.845 -11.362 -6.018
326 HA ASN 47 HA ASN 47 5.812 -13.957 -6.013
327 1HB ASN 47 2HB ASN 47 5.012 -13.711 -3.526
328 2HB ASN 47 1HB ASN 47 3.404 -13.858 -4.219
329 1HD2 ASN 47 1HD2 ASN 47 4.703 -15.636 -2.386
330 2HD2 ASN 47 2HD2 ASN 47 4.814 -17.181 -3.159
331 H GLU 48 H GLU 48 4.828 -12.154 -7.824
332 HA GLU 48 HA GLU 48 2.024 -12.557 -8.290
333 1HB GLU 48 2HB GLU 48 2.288 -10.948 -10.047
334 2HB GLU 48 1HB GLU 48 3.226 -10.414 -8.659
335 1HG GLU 48 2HG GLU 48 4.505 -11.904 -10.921
336 2HG GLU 48 1HG GLU 48 4.247 -10.164 -10.995
337 H SER 49 H SER 49 3.207 -15.017 -8.352
338 HA SER 49 HA SER 49 3.947 -15.797 -11.004
339 1HB SER 49 2HB SER 49 3.150 -17.476 -8.616
340 2HB SER 49 1HB SER 49 3.906 -18.085 -10.091
341 HG SER 49 HG SER 49 5.297 -16.002 -9.008
342 H MET 50 H MET 50 1.010 -16.009 -9.064
343 HA MET 50 HA MET 50 -0.483 -16.697 -11.489
344 1HB MET 50 2HB MET 50 -1.814 -18.307 -10.312
345 2HB MET 50 1HB MET 50 -0.119 -18.718 -10.166
346 1HG MET 50 2HG MET 50 -1.866 -17.462 -8.045
347 2HG MET 50 1HG MET 50 -1.243 -19.108 -8.075
348 1HE MET 50 1HE MET 50 -1.040 -16.972 -5.659
349 2HE MET 50 2HE MET 50 0.591 -17.306 -5.077
350 3HE MET 50 3HE MET 50 -0.475 -18.636 -5.525
351 H PHE 51 H PHE 51 -0.172 -14.959 -8.599
352 HA PHE 51 HA PHE 51 -2.856 -13.819 -8.879
353 1HB PHE 51 2HB PHE 51 -1.486 -14.992 -6.529
354 2HB PHE 51 1HB PHE 51 -2.386 -13.510 -6.227
355 HD1 PHE 51 1HD PHE 51 -3.008 -16.520 -8.356
356 HD2 PHE 51 2HD PHE 51 -4.420 -13.984 -5.247
357 HE1 PHE 51 1HE PHE 51 -5.076 -17.840 -8.225
358 HE2 PHE 51 2HE PHE 51 -6.489 -15.302 -5.112
359 HZ PHE 51 HZ PHE 51 -6.864 -17.165 -6.642
360 H THR 52 H THR 52 -2.902 -11.545 -7.665
361 HA THR 52 HA THR 52 -0.505 -10.083 -8.385
362 HB THR 52 HB THR 52 -1.463 -10.689 -10.568
363 HG1 THR 52 1HG THR 52 -1.383 -8.593 -11.417
364 1HG2 THR 52 1HG2 THR 52 -3.585 -9.677 -11.292
365 2HG2 THR 52 2HG2 THR 52 -3.847 -9.074 -9.655
366 3HG2 THR 52 3HG2 THR 52 -3.813 -10.811 -9.961
367 H VAL 53 H VAL 53 -0.996 -7.661 -8.521
368 HA VAL 53 HA VAL 53 -2.542 -6.950 -6.132
369 HB VAL 53 HB VAL 53 -0.498 -5.308 -7.641
370 1HG1 VAL 53 1HG1 VAL 53 -2.049 -3.958 -6.349
371 2HG1 VAL 53 2HG1 VAL 53 -0.441 -3.925 -5.627
372 3HG1 VAL 53 3HG1 VAL 53 -1.709 -4.918 -4.910
373 1HG2 VAL 53 1HG2 VAL 53 1.043 -5.856 -5.814
374 2HG2 VAL 53 2HG2 VAL 53 0.562 -7.278 -6.739
375 3HG2 VAL 53 3HG2 VAL 53 -0.156 -6.971 -5.158
376 H GLU 54 H GLU 54 -4.398 -5.969 -6.362
377 HA GLU 54 HA GLU 54 -5.023 -4.457 -8.805
378 1HB GLU 54 2HB GLU 54 -6.871 -5.502 -6.639
379 2HB GLU 54 1HB GLU 54 -7.361 -4.752 -8.153
380 1HG GLU 54 2HG GLU 54 -6.575 -6.591 -9.424
381 2HG GLU 54 1HG GLU 54 -5.746 -7.282 -8.031
382 H ASN 55 H ASN 55 -4.923 -2.287 -8.627
383 HA ASN 55 HA ASN 55 -4.656 -1.190 -5.910
384 1HB ASN 55 2HB ASN 55 -3.437 0.676 -6.970
385 2HB ASN 55 1HB ASN 55 -2.669 -0.880 -7.268
386 1HD2 ASN 55 1HD2 ASN 55 -2.469 1.632 -8.743
387 2HD2 ASN 55 2HD2 ASN 55 -2.959 1.273 -10.365
388 H LYS 56 H LYS 56 -5.612 0.790 -5.358
389 HA LYS 56 HA LYS 56 -7.456 2.042 -7.167
390 1HB LYS 56 2HB LYS 56 -9.396 1.140 -6.498
391 2HB LYS 56 1HB LYS 56 -8.422 -0.125 -5.777
392 1HG LYS 56 2HG LYS 56 -8.827 2.185 -4.040
393 2HG LYS 56 1HG LYS 56 -10.305 1.336 -4.487
394 1HD LYS 56 2HD LYS 56 -8.913 -0.789 -3.864
395 2HD LYS 56 1HD LYS 56 -7.938 0.356 -2.930
396 1HE LYS 56 2HE LYS 56 -9.599 -0.498 -1.489
397 2HE LYS 56 1HE LYS 56 -10.050 1.160 -1.878
398 1HZ LYS 56 1HZ LYS 56 -11.967 -0.305 -1.971
399 2HZ LYS 56 2HZ LYS 56 -11.202 -1.283 -3.126
400 3HZ LYS 56 3HZ LYS 56 -11.625 0.311 -3.516
401 H TYR 57 H TYR 57 -7.181 4.141 -6.807
402 HA TYR 57 HA TYR 57 -6.352 4.975 -4.110
403 1HB TYR 57 2HB TYR 57 -5.772 6.570 -6.546
404 2HB TYR 57 1HB TYR 57 -4.971 6.628 -4.993
405 HD1 TYR 57 1HD TYR 57 -4.623 5.663 -8.291
406 HD2 TYR 57 2HD TYR 57 -3.769 4.263 -4.363
407 HE1 TYR 57 1HE TYR 57 -2.851 4.227 -9.194
408 HE2 TYR 57 2HE TYR 57 -1.996 2.829 -5.263
409 HH TYR 57 HH TYR 57 -0.729 3.170 -8.330
410 H PHE 58 H PHE 58 -7.508 6.497 -3.069
411 HA PHE 58 HA PHE 58 -9.241 8.252 -4.676
412 1HB PHE 58 2HB PHE 58 -9.901 6.990 -2.004
413 2HB PHE 58 1HB PHE 58 -10.831 8.290 -2.732
414 HD1 PHE 58 1HD PHE 58 -9.872 4.753 -3.037
415 HD2 PHE 58 2HD PHE 58 -12.389 7.866 -4.475
416 HE1 PHE 58 1HE PHE 58 -11.240 3.090 -4.221
417 HE2 PHE 58 2HE PHE 58 -13.764 6.207 -5.666
418 HZ PHE 58 HZ PHE 58 -13.188 3.816 -5.536
419 HA PRO 59 HA PRO 59 -6.763 11.124 -2.166
420 1HB PRO 59 2HB PRO 59 -7.017 12.913 -4.433
421 2HB PRO 59 1HB PRO 59 -5.558 12.164 -3.782
422 1HG PRO 59 2HG PRO 59 -6.595 11.520 -6.213
423 2HG PRO 59 1HG PRO 59 -5.684 10.371 -5.208
424 1HD PRO 59 2HD PRO 59 -8.662 10.667 -5.511
425 2HD PRO 59 1HD PRO 59 -7.674 9.187 -5.511
426 HA PRO 60 HA PRO 60 -10.445 13.396 -1.150
427 1HB PRO 60 2HB PRO 60 -9.606 14.368 1.182
428 2HB PRO 60 1HB PRO 60 -9.871 12.637 0.958
429 1HG PRO 60 2HG PRO 60 -7.324 14.159 1.091
430 2HG PRO 60 1HG PRO 60 -7.677 12.505 1.618
431 1HD PRO 60 2HD PRO 60 -6.448 13.301 -0.802
432 2HD PRO 60 1HD PRO 60 -7.002 11.669 -0.374
433 H ASP 61 H ASP 61 -7.405 14.832 -1.846
434 HA ASP 61 HA ASP 61 -8.431 17.337 -2.589
435 1HB ASP 61 2HB ASP 61 -8.677 17.445 -0.051
436 2HB ASP 61 1HB ASP 61 -6.915 17.448 0.016
437 H SER 62 H SER 62 -5.681 15.715 -1.133
438 HA SER 62 HA SER 62 -3.633 15.230 -1.902
439 1HB SER 62 2HB SER 62 -4.384 16.679 -4.445
440 2HB SER 62 1HB SER 62 -3.031 15.567 -4.228
441 HG SER 62 HG SER 62 -5.060 14.695 -5.170
442 H LYS 63 H LYS 63 -4.487 18.590 -2.828
443 HA LYS 63 HA LYS 63 -1.812 19.441 -2.146
444 1HB LYS 63 2HB LYS 63 -2.973 21.794 -2.483
445 2HB LYS 63 1HB LYS 63 -2.501 20.795 -3.846
446 1HG LYS 63 2HG LYS 63 -4.675 21.713 -4.240
447 2HG LYS 63 1HG LYS 63 -4.817 19.973 -4.006
448 1HD LYS 63 2HD LYS 63 -6.609 21.068 -2.839
449 2HD LYS 63 1HD LYS 63 -5.490 20.383 -1.663
450 1HE LYS 63 2HE LYS 63 -4.477 22.599 -1.362
451 2HE LYS 63 1HE LYS 63 -5.624 23.271 -2.520
452 1HZ LYS 63 1HZ LYS 63 -6.285 23.610 -0.184
453 2HZ LYS 63 2HZ LYS 63 -6.395 21.927 0.012
454 3HZ LYS 63 3HZ LYS 63 -7.431 22.720 -1.062
455 H LEU 64 H LEU 64 -4.211 18.521 -0.237
456 HA LEU 64 HA LEU 64 -3.031 19.736 2.046
457 1HB LEU 64 2HB LEU 64 -4.741 21.461 1.061
458 2HB LEU 64 1HB LEU 64 -5.938 20.399 1.772
459 HG LEU 64 HG LEU 64 -3.717 21.717 3.345
460 1HD1 LEU 64 1HD1 LEU 64 -6.595 22.550 3.017
461 2HD1 LEU 64 2HD1 LEU 64 -5.182 23.406 2.400
462 3HD1 LEU 64 3HD1 LEU 64 -5.437 23.264 4.140
463 1HD2 LEU 64 1HD2 LEU 64 -4.607 19.701 4.388
464 2HD2 LEU 64 2HD2 LEU 64 -6.246 20.332 4.232
465 3HD2 LEU 64 3HD2 LEU 64 -5.086 21.141 5.286
466 H LEU 65 H LEU 65 -6.446 18.901 1.864
467 HA LEU 65 HA LEU 65 -6.308 16.149 2.365
468 1HB LEU 65 2HB LEU 65 -5.357 17.484 4.550
469 2HB LEU 65 1HB LEU 65 -7.064 17.383 4.937
470 HG LEU 65 HG LEU 65 -6.536 14.801 4.203
471 1HD1 LEU 65 1HD1 LEU 65 -4.077 15.862 5.587
472 2HD1 LEU 65 2HD1 LEU 65 -4.163 15.195 3.954
473 3HD1 LEU 65 3HD1 LEU 65 -4.463 14.156 5.351
474 1HD2 LEU 65 1HD2 LEU 65 -7.772 15.500 6.173
475 2HD2 LEU 65 2HD2 LEU 65 -6.282 16.046 6.942
476 3HD2 LEU 65 3HD2 LEU 65 -6.528 14.330 6.615
477 H GLY 66 H GLY 66 -8.369 15.304 2.307
478 1HA GLY 66 2HA GLY 66 -10.567 17.261 2.160
479 2HA GLY 66 1HA GLY 66 -10.564 15.678 1.403
480 H ALA 67 H ALA 67 -9.296 14.750 4.003
481 HA ALA 67 HA ALA 67 -10.962 14.884 6.187
482 1HB ALA 67 1HB ALA 67 -11.723 12.579 4.370
483 2HB ALA 67 2HB ALA 67 -12.747 13.964 4.753
484 3HB ALA 67 3HB ALA 67 -12.294 12.826 6.021
485 H GLY 68 H GLY 68 -9.309 12.649 4.043
486 1HA GLY 68 2HA GLY 68 -7.054 12.415 5.751
487 2HA GLY 68 1HA GLY 68 -8.053 10.966 5.835
488 H GLY 69 H GLY 69 -8.887 10.439 3.467
489 1HA GLY 69 2HA GLY 69 -8.160 10.375 1.117
490 2HA GLY 69 1HA GLY 69 -6.508 10.313 1.726
491 H THR 70 H THR 70 -7.769 8.373 -0.033
492 HA THR 70 HA THR 70 -7.148 6.040 1.556
493 HB THR 70 HB THR 70 -9.367 5.027 0.389
494 HG1 THR 70 1HG THR 70 -9.755 7.764 0.750
495 1HG2 THR 70 1HG2 THR 70 -9.225 6.325 3.107
496 2HG2 THR 70 2HG2 THR 70 -8.590 4.730 2.699
497 3HG2 THR 70 3HG2 THR 70 -10.331 5.037 2.620
498 H GLU 71 H GLU 71 -5.398 6.084 0.083
499 HA GLU 71 HA GLU 71 -6.035 5.054 -2.603
500 1HB GLU 71 2HB GLU 71 -3.374 6.061 -1.558
501 2HB GLU 71 1HB GLU 71 -3.762 5.659 -3.225
502 1HG GLU 71 2HG GLU 71 -5.415 7.509 -3.232
503 2HG GLU 71 1HG GLU 71 -4.869 7.949 -1.615
504 H HIS 72 H HIS 72 -6.167 2.838 -2.501
505 HA HIS 72 HA HIS 72 -4.402 1.537 -0.532
506 1HB HIS 72 2HB HIS 72 -6.775 0.107 -1.659
507 2HB HIS 72 1HB HIS 72 -5.900 -0.164 -0.167
508 HD1 HIS 72 1HD HIS 72 -8.080 -0.302 1.130
509 HD2 HIS 72 2HD HIS 72 -7.416 3.372 -0.687
510 HE1 HIS 72 1HE HIS 72 -9.894 1.211 1.964
511 HE2 HIS 72 2HE HIS 72 -9.651 3.311 0.613
512 H PHE 73 H PHE 73 -3.585 -0.486 -0.991
513 HA PHE 73 HA PHE 73 -3.419 -1.261 -3.825
514 1HB PHE 73 2HB PHE 73 -1.408 -1.206 -1.600
515 2HB PHE 73 1HB PHE 73 -1.211 -2.350 -2.928
516 HD1 PHE 73 1HD PHE 73 -0.186 -1.670 -4.898
517 HD2 PHE 73 2HD PHE 73 -1.677 1.259 -2.198
518 HE1 PHE 73 1HE PHE 73 0.879 0.097 -6.239
519 HE2 PHE 73 2HE PHE 73 -0.609 3.033 -3.528
520 HZ PHE 73 HZ PHE 73 0.670 2.449 -5.550
521 H HIS 74 H HIS 74 -4.708 -3.033 -4.038
522 HA HIS 74 HA HIS 74 -4.958 -4.799 -1.697
523 1HB HIS 74 2HB HIS 74 -6.713 -4.355 -4.114
524 2HB HIS 74 1HB HIS 74 -6.935 -5.722 -3.035
525 HD1 HIS 74 1HD HIS 74 -9.346 -4.499 -2.866
526 HD2 HIS 74 2HD HIS 74 -6.153 -2.612 -0.971
527 HE1 HIS 74 1HE HIS 74 -10.370 -2.939 -1.185
528 HE2 HIS 74 2HE HIS 74 -8.412 -2.122 0.177
529 H VAL 75 H VAL 75 -3.600 -6.490 -1.773
530 HA VAL 75 HA VAL 75 -2.934 -7.501 -4.435
531 HB VAL 75 HB VAL 75 -0.913 -8.407 -3.628
532 1HG1 VAL 75 1HG1 VAL 75 -1.212 -5.805 -2.146
533 2HG1 VAL 75 2HG1 VAL 75 -0.920 -5.957 -3.879
534 3HG1 VAL 75 3HG1 VAL 75 0.288 -6.540 -2.730
535 1HG2 VAL 75 1HG2 VAL 75 -0.261 -8.425 -1.250
536 2HG2 VAL 75 2HG2 VAL 75 -1.645 -9.458 -1.609
537 3HG2 VAL 75 3HG2 VAL 75 -1.894 -7.890 -0.837
538 H THR 76 H THR 76 -3.892 -9.215 -5.071
539 HA THR 76 HA THR 76 -5.069 -11.034 -3.094
540 HB THR 76 HB THR 76 -5.541 -10.988 -6.095
541 HG1 THR 76 1HG THR 76 -6.893 -9.373 -5.825
542 1HG2 THR 76 1HG2 THR 76 -7.158 -12.125 -3.815
543 2HG2 THR 76 2HG2 THR 76 -6.185 -13.051 -4.956
544 3HG2 THR 76 3HG2 THR 76 -7.606 -12.172 -5.520
545 H VAL 77 H VAL 77 -3.501 -12.470 -2.575
546 HA VAL 77 HA VAL 77 -2.449 -14.212 -4.602
547 HB VAL 77 HB VAL 77 -0.810 -12.487 -4.882
548 1HG1 VAL 77 1HG1 VAL 77 0.540 -11.605 -3.036
549 2HG1 VAL 77 2HG1 VAL 77 -0.434 -12.528 -1.889
550 3HG1 VAL 77 3HG1 VAL 77 -1.173 -11.234 -2.835
551 1HG2 VAL 77 1HG2 VAL 77 1.258 -13.626 -4.192
552 2HG2 VAL 77 2HG2 VAL 77 0.083 -14.742 -4.882
553 3HG2 VAL 77 3HG2 VAL 77 0.314 -14.677 -3.134
554 H LYS 78 H LYS 78 -2.611 -16.187 -3.702
555 HA LYS 78 HA LYS 78 -1.926 -16.370 -0.874
556 1HB LYS 78 2HB LYS 78 -3.606 -17.826 -0.395
557 2HB LYS 78 1HB LYS 78 -4.383 -16.853 -1.623
558 1HG LYS 78 2HG LYS 78 -3.054 -19.459 -2.280
559 2HG LYS 78 1HG LYS 78 -4.709 -19.379 -1.684
560 1HD LYS 78 2HD LYS 78 -5.242 -17.868 -3.610
561 2HD LYS 78 1HD LYS 78 -3.613 -18.177 -4.238
562 1HE LYS 78 2HE LYS 78 -4.073 -20.526 -4.423
563 2HE LYS 78 1HE LYS 78 -5.623 -20.340 -3.606
564 1HZ LYS 78 1HZ LYS 78 -5.929 -20.555 -5.972
565 2HZ LYS 78 2HZ LYS 78 -4.909 -19.239 -6.267
566 3HZ LYS 78 3HZ LYS 78 -6.388 -18.998 -5.476
567 H ALA 79 H ALA 79 0.049 -16.993 -0.820
568 HA ALA 79 HA ALA 79 0.775 -19.632 -1.605
569 1HB ALA 79 1HB ALA 79 1.090 -18.542 -3.769
570 2HB ALA 79 2HB ALA 79 2.643 -19.025 -3.084
571 3HB ALA 79 3HB ALA 79 2.137 -17.335 -3.019
572 H ALA 80 H ALA 80 2.584 -20.345 -0.490
573 HA ALA 80 HA ALA 80 3.217 -18.930 1.872
574 1HB ALA 80 1HB ALA 80 3.260 -21.370 1.729
575 2HB ALA 80 2HB ALA 80 4.794 -20.725 2.317
576 3HB ALA 80 3HB ALA 80 4.651 -21.279 0.648
577 H GLY 81 H GLY 81 4.072 -16.967 1.492
578 1HA GLY 81 2HA GLY 81 6.906 -16.866 1.014
579 2HA GLY 81 1HA GLY 81 5.964 -16.113 -0.271
580 H THR 82 H THR 82 7.673 -14.553 1.238
581 HA THR 82 HA THR 82 5.880 -13.252 3.159
582 HB THR 82 HB THR 82 8.752 -12.446 2.804
583 HG1 THR 82 1HG THR 82 9.336 -14.389 3.419
584 1HG2 THR 82 1HG2 THR 82 6.851 -12.560 5.152
585 2HG2 THR 82 2HG2 THR 82 7.312 -11.110 4.255
586 3HG2 THR 82 3HG2 THR 82 8.514 -11.973 5.217
587 H HIS 83 H HIS 83 5.131 -11.249 2.835
588 HA HIS 83 HA HIS 83 5.507 -10.151 0.133
589 1HB HIS 83 2HB HIS 83 3.183 -10.937 1.067
590 2HB HIS 83 1HB HIS 83 3.255 -9.463 2.016
591 HD1 HIS 83 1HD HIS 83 3.690 -7.217 0.460
592 HD2 HIS 83 2HD HIS 83 1.977 -10.556 -1.323
593 HE1 HIS 83 1HE HIS 83 2.569 -6.352 -1.614
594 HE2 HIS 83 2HE HIS 83 1.667 -8.425 -2.764
595 H ALA 84 H ALA 84 7.095 -8.616 0.284
596 HA ALA 84 HA ALA 84 6.963 -6.724 2.522
597 1HB ALA 84 1HB ALA 84 9.205 -6.017 1.804
598 2HB ALA 84 2HB ALA 84 9.124 -7.151 0.455
599 3HB ALA 84 3HB ALA 84 9.139 -7.752 2.111
600 H VAL 85 H VAL 85 5.892 -4.915 2.219
601 HA VAL 85 HA VAL 85 5.327 -4.117 -0.560
602 HB VAL 85 HB VAL 85 3.772 -3.121 1.793
603 1HG1 VAL 85 1HG1 VAL 85 3.373 -2.108 -0.373
604 2HG1 VAL 85 2HG1 VAL 85 1.964 -3.035 0.141
605 3HG1 VAL 85 3HG1 VAL 85 3.057 -3.691 -1.079
606 1HG2 VAL 85 1HG2 VAL 85 3.880 -5.543 2.084
607 2HG2 VAL 85 2HG2 VAL 85 3.314 -5.768 0.426
608 3HG2 VAL 85 3HG2 VAL 85 2.257 -5.023 1.624
609 H ASN 86 H ASN 86 6.848 -2.651 -1.092
610 HA ASN 86 HA ASN 86 7.147 -0.304 0.663
611 1HB ASN 86 2HB ASN 86 8.849 -1.302 -1.636
612 2HB ASN 86 1HB ASN 86 9.046 0.292 -0.924
613 1HD2 ASN 86 1HD2 ASN 86 8.290 -2.643 0.849
614 2HD2 ASN 86 2HD2 ASN 86 9.787 -2.728 1.706
615 H LEU 87 H LEU 87 5.562 1.059 0.221
616 HA LEU 87 HA LEU 87 4.869 1.555 -2.593
617 1HB LEU 87 2HB LEU 87 3.285 2.122 -0.081
618 2HB LEU 87 1HB LEU 87 2.765 2.485 -1.719
619 HG LEU 87 HG LEU 87 3.356 -0.318 -0.758
620 1HD1 LEU 87 1HD1 LEU 87 0.923 -0.606 -0.684
621 2HD1 LEU 87 2HD1 LEU 87 0.712 1.116 -1.010
622 3HD1 LEU 87 3HD1 LEU 87 1.475 0.588 0.493
623 1HD2 LEU 87 1HD2 LEU 87 2.197 -0.951 -2.779
624 2HD2 LEU 87 2HD2 LEU 87 3.564 0.101 -3.157
625 3HD2 LEU 87 3HD2 LEU 87 1.921 0.745 -3.179
626 H THR 88 H THR 88 5.375 3.472 -3.453
627 HA THR 88 HA THR 88 6.752 5.318 -1.641
628 HB THR 88 HB THR 88 7.157 5.142 -4.624
629 HG1 THR 88 1HG THR 88 7.810 3.171 -4.161
630 1HG2 THR 88 1HG2 THR 88 8.096 7.090 -3.416
631 2HG2 THR 88 2HG2 THR 88 9.362 6.041 -4.053
632 3HG2 THR 88 3HG2 THR 88 8.955 5.989 -2.337
633 H TYR 89 H TYR 89 5.862 7.189 -1.262
634 HA TYR 89 HA TYR 89 3.668 8.198 -2.883
635 1HB TYR 89 2HB TYR 89 3.748 8.118 -0.302
636 2HB TYR 89 1HB TYR 89 4.855 9.478 -0.414
637 HD1 TYR 89 1HD TYR 89 1.413 8.374 -1.157
638 HD2 TYR 89 2HD TYR 89 4.023 11.690 -0.736
639 HE1 TYR 89 1HE TYR 89 -0.522 9.882 -1.196
640 HE2 TYR 89 2HE TYR 89 2.091 13.212 -0.786
641 HH TYR 89 HH TYR 89 -1.178 12.040 -0.621
642 H MET 90 H MET 90 4.838 8.794 -4.773
643 HA MET 90 HA MET 90 6.583 11.171 -4.423
644 1HB MET 90 2HB MET 90 6.849 9.406 -6.823
645 2HB MET 90 1HB MET 90 8.004 10.537 -6.148
646 1HG MET 90 2HG MET 90 8.473 9.038 -4.319
647 2HG MET 90 1HG MET 90 7.267 7.898 -4.923
648 1HE MET 90 1HE MET 90 7.493 6.544 -7.186
649 2HE MET 90 2HE MET 90 8.825 6.766 -8.325
650 3HE MET 90 3HE MET 90 7.666 8.074 -8.058
651 H ARG 91 H ARG 91 6.654 12.558 -6.352
652 HA ARG 91 HA ARG 91 4.058 12.873 -7.576
653 1HB ARG 91 2HB ARG 91 6.359 14.493 -7.164
654 2HB ARG 91 1HB ARG 91 6.178 14.304 -8.906
655 1HG ARG 91 2HG ARG 91 3.836 15.098 -8.725
656 2HG ARG 91 1HG ARG 91 4.108 15.371 -7.006
657 1HD ARG 91 2HD ARG 91 5.774 17.014 -7.444
658 2HD ARG 91 1HD ARG 91 5.776 16.633 -9.165
659 HE ARG 91 HE ARG 91 3.197 17.470 -8.300
660 1HH1 ARG 91 1HH1 ARG 91 6.392 18.707 -9.035
661 2HH1 ARG 91 2HH1 ARG 91 5.797 20.236 -9.610
662 1HH2 ARG 91 1HH2 ARG 91 2.420 19.478 -9.038
663 2HH2 ARG 91 2HH2 ARG 91 3.547 20.675 -9.623
664 HA PRO 92 HA PRO 92 4.904 9.420 -10.201
665 1HB PRO 92 2HB PRO 92 3.008 10.165 -12.165
666 2HB PRO 92 1HB PRO 92 2.764 9.076 -10.800
667 1HG PRO 92 2HG PRO 92 2.107 11.968 -11.061
668 2HG PRO 92 1HG PRO 92 1.247 10.695 -10.174
669 1HD PRO 92 2HD PRO 92 2.715 12.517 -8.897
670 2HD PRO 92 1HD PRO 92 2.703 10.822 -8.362
671 H TRP 93 H TRP 93 4.890 12.665 -11.634
672 HA TRP 93 HA TRP 93 6.254 11.622 -13.996
673 1HB TRP 93 2HB TRP 93 5.898 13.946 -14.891
674 2HB TRP 93 1HB TRP 93 4.428 13.049 -14.525
675 HD1 TRP 93 HD TRP 93 6.447 16.081 -13.377
676 HE1 TRP 93 1HE TRP 93 4.993 17.500 -11.799
677 HE3 TRP 93 3HE TRP 93 2.493 12.895 -12.867
678 HZ2 TRP 93 2HZ TRP 93 2.482 17.279 -10.499
679 HZ3 TRP 93 3HZ TRP 93 0.613 13.561 -11.439
680 HH2 TRP 93 HH TRP 93 0.602 15.714 -10.280
681 H THR 94 H THR 94 7.408 12.330 -11.129
682 HA THR 94 HA THR 94 9.984 12.942 -12.128
683 HB THR 94 HB THR 94 9.230 15.202 -12.354
684 HG1 THR 94 1HG THR 94 11.284 14.552 -10.981
685 1HG2 THR 94 1HG2 THR 94 8.368 16.522 -10.468
686 2HG2 THR 94 2HG2 THR 94 8.363 15.073 -9.462
687 3HG2 THR 94 3HG2 THR 94 7.301 15.175 -10.867
688 H GLY 95 H GLY 95 7.985 13.223 -9.192
689 1HA GLY 95 2HA GLY 95 8.387 12.628 -6.995
690 2HA GLY 95 1HA GLY 95 9.175 11.225 -7.722
691 HA PRO 96 HA PRO 96 12.387 15.006 -6.748
692 1HB PRO 96 2HB PRO 96 10.857 15.345 -4.195
693 2HB PRO 96 1HB PRO 96 11.826 16.516 -5.083
694 1HG PRO 96 2HG PRO 96 9.157 16.526 -5.218
695 2HG PRO 96 1HG PRO 96 10.171 16.965 -6.602
696 1HD PRO 96 2HD PRO 96 8.529 14.563 -6.167
697 2HD PRO 96 1HD PRO 96 9.127 15.262 -7.683
698 H SER 97 H SER 97 13.895 13.452 -6.488
699 HA SER 97 HA SER 97 13.636 11.116 -5.036
700 1HB SER 97 2HB SER 97 16.214 12.550 -5.710
701 2HB SER 97 1HB SER 97 16.033 10.831 -5.354
702 HG SER 97 HG SER 97 15.937 10.843 -7.505
703 H HIS 98 H HIS 98 13.650 10.650 -2.984
704 HA HIS 98 HA HIS 98 14.183 10.602 -0.786
705 1HB HIS 98 2HB HIS 98 16.499 11.184 -1.419
706 2HB HIS 98 1HB HIS 98 16.080 12.890 -1.362
707 HD1 HIS 98 1HD HIS 98 16.711 13.999 0.758
708 HD2 HIS 98 2HD HIS 98 16.002 9.931 1.282
709 HE1 HIS 98 1HE HIS 98 17.191 13.530 3.181
710 HE2 HIS 98 2HE HIS 98 16.871 11.043 3.451
711 H ASP 99 H ASP 99 12.610 13.034 -2.387
712 HA ASP 99 HA ASP 99 11.959 14.515 0.078
713 1HB ASP 99 2HB ASP 99 12.429 15.770 -2.065
714 2HB ASP 99 1HB ASP 99 10.971 15.033 -2.743
715 H SER 100 H SER 100 10.819 12.256 -2.207
716 HA SER 100 HA SER 100 8.070 12.254 -1.594
717 1HB SER 100 2HB SER 100 9.766 9.982 -2.632
718 2HB SER 100 1HB SER 100 8.034 10.221 -2.876
719 HG SER 100 HG SER 100 10.188 11.386 -4.163
720 H GLU 101 H GLU 101 6.900 10.614 -0.437
721 HA GLU 101 HA GLU 101 8.348 9.596 1.903
722 1HB GLU 101 2HB GLU 101 6.283 10.914 2.287
723 2HB GLU 101 1HB GLU 101 5.369 9.748 1.342
724 1HG GLU 101 2HG GLU 101 5.052 9.414 3.736
725 2HG GLU 101 1HG GLU 101 5.828 8.020 2.986
726 H ARG 102 H ARG 102 7.864 7.305 2.558
727 HA ARG 102 HA ARG 102 6.770 5.627 0.464
728 1HB ARG 102 2HB ARG 102 9.313 5.913 0.091
729 2HB ARG 102 1HB ARG 102 9.505 4.923 1.532
730 1HG ARG 102 2HG ARG 102 8.262 3.114 0.468
731 2HG ARG 102 1HG ARG 102 8.034 4.109 -0.969
732 1HD ARG 102 2HD ARG 102 10.637 4.259 -0.933
733 2HD ARG 102 1HD ARG 102 10.520 2.811 0.067
734 HE ARG 102 HE ARG 102 9.017 2.720 -2.421
735 1HH1 ARG 102 1HH1 ARG 102 12.029 1.911 -0.796
736 2HH1 ARG 102 2HH1 ARG 102 12.548 0.828 -2.052
737 1HH2 ARG 102 1HH2 ARG 102 9.705 1.295 -4.046
738 2HH2 ARG 102 2HH2 ARG 102 11.235 0.476 -3.900
739 H PHE 103 H PHE 103 5.908 3.817 1.171
740 HA PHE 103 HA PHE 103 5.778 3.427 4.072
741 1HB PHE 103 2HB PHE 103 3.584 3.704 3.412
742 2HB PHE 103 1HB PHE 103 3.895 3.106 1.787
743 HD1 PHE 103 1HD PHE 103 2.994 2.253 5.191
744 HD2 PHE 103 2HD PHE 103 3.838 0.744 1.314
745 HE1 PHE 103 1HE PHE 103 1.969 0.115 5.808
746 HE2 PHE 103 2HE PHE 103 2.810 -1.399 1.921
747 HZ PHE 103 HZ PHE 103 1.975 -1.755 4.171
748 H THR 104 H THR 104 5.791 1.180 4.865
749 HA THR 104 HA THR 104 6.617 -0.873 3.021
750 HB THR 104 HB THR 104 8.539 0.147 5.129
751 HG1 THR 104 1HG THR 104 8.275 0.702 2.540
752 1HG2 THR 104 1HG2 THR 104 8.526 -2.276 5.145
753 2HG2 THR 104 2HG2 THR 104 10.018 -1.681 4.410
754 3HG2 THR 104 3HG2 THR 104 8.722 -2.312 3.392
755 H VAL 105 H VAL 105 4.909 -2.181 3.771
756 HA VAL 105 HA VAL 105 5.245 -3.017 6.568
757 HB VAL 105 HB VAL 105 2.927 -2.450 5.851
758 1HG1 VAL 105 1HG1 VAL 105 1.699 -4.029 4.444
759 2HG1 VAL 105 2HG1 VAL 105 3.195 -4.911 4.132
760 3HG1 VAL 105 3HG1 VAL 105 3.012 -3.254 3.557
761 1HG2 VAL 105 1HG2 VAL 105 3.319 -5.338 6.609
762 2HG2 VAL 105 2HG2 VAL 105 1.892 -4.349 6.922
763 3HG2 VAL 105 3HG2 VAL 105 3.418 -3.977 7.720
764 H TYR 106 H TYR 106 5.996 -4.946 7.077
765 HA TYR 106 HA TYR 106 6.626 -6.811 4.907
766 1HB TYR 106 2HB TYR 106 7.709 -6.581 7.716
767 2HB TYR 106 1HB TYR 106 8.090 -7.898 6.618
768 HD1 TYR 106 1HD TYR 106 9.257 -7.336 4.436
769 HD2 TYR 106 2HD TYR 106 8.925 -4.579 7.654
770 HE1 TYR 106 1HE TYR 106 11.121 -6.034 3.503
771 HE2 TYR 106 2HE TYR 106 10.784 -3.265 6.728
772 HH TYR 106 HH TYR 106 12.025 -3.833 3.560
773 H LEU 107 H LEU 107 4.953 -8.131 4.638
774 HA LEU 107 HA LEU 107 3.787 -9.341 7.055
775 1HB LEU 107 2HB LEU 107 1.635 -9.346 6.005
776 2HB LEU 107 1HB LEU 107 2.277 -7.719 5.929
777 HG LEU 107 HG LEU 107 3.102 -8.786 3.535
778 1HD1 LEU 107 1HD1 LEU 107 1.768 -10.785 3.842
779 2HD1 LEU 107 2HD1 LEU 107 1.109 -9.797 2.538
780 3HD1 LEU 107 3HD1 LEU 107 0.329 -9.804 4.120
781 1HD2 LEU 107 1HD2 LEU 107 0.590 -7.247 4.144
782 2HD2 LEU 107 2HD2 LEU 107 1.367 -7.371 2.565
783 3HD2 LEU 107 3HD2 LEU 107 2.199 -6.567 3.897
784 H LYS 108 H LYS 108 3.295 -11.573 6.895
785 HA LYS 108 HA LYS 108 4.707 -12.868 4.670
786 1HB LYS 108 2HB LYS 108 5.492 -13.458 6.908
787 2HB LYS 108 1HB LYS 108 3.877 -13.978 7.344
788 1HG LYS 108 2HG LYS 108 4.048 -15.931 6.266
789 2HG LYS 108 1HG LYS 108 4.993 -15.234 4.945
790 1HD LYS 108 2HD LYS 108 6.967 -15.187 6.422
791 2HD LYS 108 1HD LYS 108 6.007 -15.899 7.719
792 1HE LYS 108 2HE LYS 108 5.648 -17.898 6.372
793 2HE LYS 108 1HE LYS 108 6.574 -17.183 5.052
794 1HZ LYS 108 1HZ LYS 108 8.525 -17.151 6.459
795 2HZ LYS 108 2HZ LYS 108 7.903 -18.728 6.370
796 3HZ LYS 108 3HZ LYS 108 7.638 -17.788 7.759
797 H ALA 109 H ALA 109 3.560 -13.747 3.104
798 HA ALA 109 HA ALA 109 0.663 -13.928 3.520
799 1HB ALA 109 1HB ALA 109 2.223 -13.627 0.954
800 2HB ALA 109 2HB ALA 109 1.393 -12.331 1.818
801 3HB ALA 109 3HB ALA 109 0.464 -13.647 1.102
802 H ASN 110 H ASN 110 -0.500 -15.628 2.561
803 HA ASN 110 HA ASN 110 0.469 -17.865 1.286
804 1HB ASN 110 2HB ASN 110 0.497 -19.524 3.160
805 2HB ASN 110 1HB ASN 110 1.813 -18.360 3.251
806 1HD2 ASN 110 1HD2 ASN 110 1.689 -16.679 4.814
807 2HD2 ASN 110 2HD2 ASN 110 0.721 -16.873 6.238
Start of MODEL 14
1 H HIS 3 H HIS 3 -6.814 -9.468 4.274
2 HA HIS 3 HA HIS 3 -5.767 -8.794 6.894
3 1HB HIS 3 2HB HIS 3 -4.001 -10.268 6.319
4 2HB HIS 3 1HB HIS 3 -4.116 -9.836 4.608
5 HD1 HIS 3 1HD HIS 3 -3.469 -7.778 7.743
6 HD2 HIS 3 2HD HIS 3 -1.891 -8.478 3.953
7 HE1 HIS 3 1HE HIS 3 -1.650 -6.080 7.450
8 HE2 HIS 3 2HE HIS 3 -0.823 -6.403 5.087
9 H LYS 4 H LYS 4 -5.127 -6.637 7.022
10 HA LYS 4 HA LYS 4 -5.239 -5.025 4.580
11 1HB LYS 4 2HB LYS 4 -7.484 -5.056 5.563
12 2HB LYS 4 1HB LYS 4 -6.828 -4.482 7.090
13 1HG LYS 4 2HG LYS 4 -6.208 -2.386 6.098
14 2HG LYS 4 1HG LYS 4 -6.702 -2.954 4.499
15 1HD LYS 4 2HD LYS 4 -9.012 -3.248 5.400
16 2HD LYS 4 1HD LYS 4 -8.469 -2.484 6.897
17 1HE LYS 4 2HE LYS 4 -7.965 -0.447 5.741
18 2HE LYS 4 1HE LYS 4 -8.284 -1.201 4.180
19 1HZ LYS 4 1HZ LYS 4 -10.285 -0.731 6.325
20 2HZ LYS 4 2HZ LYS 4 -10.596 -1.490 4.838
21 3HZ LYS 4 3HZ LYS 4 -10.145 0.147 4.878
22 H VAL 5 H VAL 5 -3.611 -3.573 4.519
23 HA VAL 5 HA VAL 5 -2.337 -2.844 7.063
24 HB VAL 5 HB VAL 5 -1.188 -3.206 4.335
25 1HG1 VAL 5 1HG1 VAL 5 -0.183 -1.075 6.196
26 2HG1 VAL 5 2HG1 VAL 5 -0.757 -0.859 4.542
27 3HG1 VAL 5 3HG1 VAL 5 0.730 -1.758 4.851
28 1HG2 VAL 5 1HG2 VAL 5 -0.812 -4.752 6.207
29 2HG2 VAL 5 2HG2 VAL 5 -0.044 -3.440 7.110
30 3HG2 VAL 5 3HG2 VAL 5 0.683 -4.026 5.615
31 H THR 6 H THR 6 -1.558 -0.626 7.249
32 HA THR 6 HA THR 6 -3.210 1.416 6.015
33 HB THR 6 HB THR 6 -3.594 2.215 8.513
34 HG1 THR 6 1HG THR 6 -4.182 -0.045 9.542
35 1HG2 THR 6 1HG2 THR 6 -5.804 1.147 8.479
36 2HG2 THR 6 2HG2 THR 6 -5.258 0.053 7.206
37 3HG2 THR 6 3HG2 THR 6 -5.378 1.784 6.889
38 H LYS 7 H LYS 7 -2.507 3.638 7.058
39 HA LYS 7 HA LYS 7 0.103 4.090 6.357
40 1HB LYS 7 2HB LYS 7 -1.591 5.852 6.682
41 2HB LYS 7 1HB LYS 7 -1.401 5.685 8.425
42 1HG LYS 7 2HG LYS 7 -0.124 7.574 7.343
43 2HG LYS 7 1HG LYS 7 0.820 6.481 8.361
44 1HD LYS 7 2HD LYS 7 1.521 5.251 6.350
45 2HD LYS 7 1HD LYS 7 0.632 6.390 5.344
46 1HE LYS 7 2HE LYS 7 3.005 6.979 7.125
47 2HE LYS 7 1HE LYS 7 2.990 6.961 5.366
48 1HZ LYS 7 1HZ LYS 7 1.389 8.837 5.470
49 2HZ LYS 7 2HZ LYS 7 2.918 9.201 6.089
50 3HZ LYS 7 3HZ LYS 7 1.624 8.906 7.148
51 H ALA 8 H ALA 8 -1.032 3.414 9.696
52 HA ALA 8 HA ALA 8 1.408 3.840 11.011
53 1HB ALA 8 1HB ALA 8 -0.723 1.814 11.694
54 2HB ALA 8 2HB ALA 8 -0.708 3.506 12.189
55 3HB ALA 8 3HB ALA 8 0.533 2.402 12.784
56 H HIS 9 H HIS 9 0.222 1.075 9.242
57 HA HIS 9 HA HIS 9 2.175 -0.815 9.973
58 1HB HIS 9 2HB HIS 9 0.338 -0.533 7.623
59 2HB HIS 9 1HB HIS 9 1.548 -1.802 7.655
60 HD1 HIS 9 1HD HIS 9 -1.846 -1.018 8.755
61 HD2 HIS 9 2HD HIS 9 1.159 -3.670 9.873
62 HE1 HIS 9 1HE HIS 9 -3.014 -2.961 9.814
63 HE2 HIS 9 2HE HIS 9 -1.177 -4.462 10.663
64 H ASN 10 H ASN 10 2.541 2.046 8.299
65 HA ASN 10 HA ASN 10 4.423 1.749 6.345
66 1HB ASN 10 2HB ASN 10 3.641 3.940 7.006
67 2HB ASN 10 1HB ASN 10 4.321 3.754 8.619
68 1HD2 ASN 10 1HD2 ASN 10 5.981 2.938 5.617
69 2HD2 ASN 10 2HD2 ASN 10 7.183 4.171 5.741
70 H GLY 11 H GLY 11 4.691 0.888 9.672
71 1HA GLY 11 2HA GLY 11 7.475 0.035 9.196
72 2HA GLY 11 1HA GLY 11 7.083 0.913 10.669
73 H ALA 12 H ALA 12 5.600 -1.774 8.843
74 HA ALA 12 HA ALA 12 5.313 -3.189 11.424
75 1HB ALA 12 1HB ALA 12 3.290 -4.195 10.489
76 2HB ALA 12 2HB ALA 12 3.540 -3.283 8.996
77 3HB ALA 12 3HB ALA 12 3.201 -2.433 10.504
78 H THR 13 H THR 13 5.780 -5.325 11.590
79 HA THR 13 HA THR 13 6.340 -6.892 9.172
80 HB THR 13 HB THR 13 8.125 -6.933 11.619
81 HG1 THR 13 1HG THR 13 8.117 -5.271 9.526
82 1HG2 THR 13 1HG2 THR 13 7.975 -9.094 10.489
83 2HG2 THR 13 2HG2 THR 13 9.564 -8.371 10.237
84 3HG2 THR 13 3HG2 THR 13 8.358 -8.330 8.948
85 H LEU 14 H LEU 14 4.885 -8.534 9.257
86 HA LEU 14 HA LEU 14 4.520 -10.210 11.518
87 1HB LEU 14 2HB LEU 14 2.290 -9.632 12.179
88 2HB LEU 14 1HB LEU 14 3.337 -8.241 12.344
89 HG LEU 14 HG LEU 14 2.345 -7.675 9.943
90 1HD1 LEU 14 1HD1 LEU 14 0.127 -9.208 11.273
91 2HD1 LEU 14 2HD1 LEU 14 1.052 -9.772 9.885
92 3HD1 LEU 14 3HD1 LEU 14 0.044 -8.330 9.744
93 1HD2 LEU 14 1HD2 LEU 14 0.909 -7.205 12.554
94 2HD2 LEU 14 2HD2 LEU 14 0.690 -6.272 11.073
95 3HD2 LEU 14 3HD2 LEU 14 2.241 -6.242 11.915
96 H THR 15 H THR 15 2.459 -11.695 11.132
97 HA THR 15 HA THR 15 2.740 -12.538 8.335
98 HB THR 15 HB THR 15 1.826 -14.023 10.799
99 HG1 THR 15 1HG THR 15 4.211 -13.691 9.592
100 1HG2 THR 15 1HG2 THR 15 0.505 -14.687 8.796
101 2HG2 THR 15 2HG2 THR 15 1.513 -15.988 9.439
102 3HG2 THR 15 3HG2 THR 15 2.017 -15.117 7.991
103 H VAL 16 H VAL 16 1.015 -12.969 7.008
104 HA VAL 16 HA VAL 16 -1.615 -12.004 7.950
105 HB VAL 16 HB VAL 16 -2.047 -11.063 5.825
106 1HG1 VAL 16 1HG1 VAL 16 0.811 -10.473 6.558
107 2HG1 VAL 16 2HG1 VAL 16 -0.624 -9.715 7.246
108 3HG1 VAL 16 3HG1 VAL 16 -0.221 -9.458 5.549
109 1HG2 VAL 16 1HG2 VAL 16 -0.561 -11.234 3.904
110 2HG2 VAL 16 2HG2 VAL 16 -1.160 -12.816 4.408
111 3HG2 VAL 16 3HG2 VAL 16 0.487 -12.324 4.815
112 H ALA 17 H ALA 17 -3.490 -12.960 6.943
113 HA ALA 17 HA ALA 17 -3.036 -15.664 5.879
114 1HB ALA 17 1HB ALA 17 -5.500 -14.348 7.023
115 2HB ALA 17 2HB ALA 17 -4.507 -15.583 7.799
116 3HB ALA 17 3HB ALA 17 -5.453 -15.984 6.364
117 H VAL 18 H VAL 18 -3.663 -16.163 3.799
118 HA VAL 18 HA VAL 18 -4.873 -13.947 2.268
119 HB VAL 18 HB VAL 18 -3.580 -14.584 0.327
120 1HG1 VAL 18 1HG1 VAL 18 -1.963 -14.128 2.823
121 2HG1 VAL 18 2HG1 VAL 18 -2.580 -12.923 1.691
122 3HG1 VAL 18 3HG1 VAL 18 -1.304 -14.032 1.189
123 1HG2 VAL 18 1HG2 VAL 18 -2.287 -16.654 2.093
124 2HG2 VAL 18 2HG2 VAL 18 -1.807 -16.253 0.443
125 3HG2 VAL 18 3HG2 VAL 18 -3.386 -16.975 0.753
126 H GLY 19 H GLY 19 -5.175 -15.239 -0.154
127 1HA GLY 19 2HA GLY 19 -6.297 -17.165 -1.101
128 2HA GLY 19 1HA GLY 19 -7.067 -17.422 0.463
129 H GLU 20 H GLU 20 -8.205 -15.226 1.176
130 HA GLU 20 HA GLU 20 -10.236 -14.714 -0.775
131 1HB GLU 20 2HB GLU 20 -9.729 -13.168 1.772
132 2HB GLU 20 1HB GLU 20 -11.245 -13.317 0.894
133 1HG GLU 20 2HG GLU 20 -9.830 -15.529 2.363
134 2HG GLU 20 1HG GLU 20 -11.246 -14.651 2.932
135 H LEU 21 H LEU 21 -8.277 -12.384 1.034
136 HA LEU 21 HA LEU 21 -7.068 -11.248 -1.273
137 1HB LEU 21 2HB LEU 21 -9.235 -10.278 -1.650
138 2HB LEU 21 1HB LEU 21 -9.355 -9.771 0.023
139 HG LEU 21 HG LEU 21 -7.444 -8.209 -0.374
140 1HD1 LEU 21 1HD1 LEU 21 -6.508 -9.410 -2.333
141 2HD1 LEU 21 2HD1 LEU 21 -6.754 -7.687 -2.610
142 3HD1 LEU 21 3HD1 LEU 21 -7.889 -8.858 -3.285
143 1HD2 LEU 21 1HD2 LEU 21 -9.879 -7.844 -2.110
144 2HD2 LEU 21 2HD2 LEU 21 -8.776 -6.566 -1.606
145 3HD2 LEU 21 3HD2 LEU 21 -9.740 -7.424 -0.404
146 H VAL 22 H VAL 22 -5.307 -10.036 -0.706
147 HA VAL 22 HA VAL 22 -5.175 -9.217 2.124
148 HB VAL 22 HB VAL 22 -3.169 -10.683 0.505
149 1HG1 VAL 22 1HG1 VAL 22 -2.415 -8.293 2.173
150 2HG1 VAL 22 2HG1 VAL 22 -1.860 -8.725 0.559
151 3HG1 VAL 22 3HG1 VAL 22 -1.319 -9.655 1.956
152 1HG2 VAL 22 1HG2 VAL 22 -4.294 -11.616 2.448
153 2HG2 VAL 22 2HG2 VAL 22 -3.630 -10.334 3.460
154 3HG2 VAL 22 3HG2 VAL 22 -2.553 -11.510 2.704
155 H GLU 23 H GLU 23 -5.198 -7.051 2.355
156 HA GLU 23 HA GLU 23 -4.393 -5.530 -0.026
157 1HB GLU 23 2HB GLU 23 -6.086 -3.953 0.345
158 2HB GLU 23 1HB GLU 23 -6.843 -5.523 0.541
159 1HG GLU 23 2HG GLU 23 -6.978 -5.276 2.875
160 2HG GLU 23 1HG GLU 23 -5.875 -3.899 2.869
161 H ILE 24 H ILE 24 -3.341 -3.620 0.173
162 HA ILE 24 HA ILE 24 -2.241 -2.905 2.819
163 HB ILE 24 HB ILE 24 -0.934 -2.667 0.094
164 1HG1 ILE 24 2HG1 ILE 24 -1.032 -5.004 0.897
165 2HG1 ILE 24 1HG1 ILE 24 0.621 -4.397 0.832
166 1HG2 ILE 24 1HG2 ILE 24 1.060 -1.969 1.313
167 2HG2 ILE 24 2HG2 ILE 24 0.158 -2.040 2.827
168 3HG2 ILE 24 3HG2 ILE 24 -0.293 -0.870 1.586
169 1HD1 ILE 24 1HD1 ILE 24 -1.078 -4.620 3.305
170 2HD1 ILE 24 2HD1 ILE 24 0.587 -4.041 3.235
171 3HD1 ILE 24 3HD1 ILE 24 0.220 -5.715 2.829
172 H GLN 25 H GLN 25 -3.448 -1.064 3.329
173 HA GLN 25 HA GLN 25 -4.086 0.706 1.082
174 1HB GLN 25 2HB GLN 25 -6.109 0.070 1.924
175 2HB GLN 25 1HB GLN 25 -5.552 0.044 3.599
176 1HG GLN 25 2HG GLN 25 -5.478 2.673 2.334
177 2HG GLN 25 1HG GLN 25 -7.089 1.979 2.433
178 1HE2 GLN 25 1HE2 GLN 25 -4.364 3.158 4.282
179 2HE2 GLN 25 2HE2 GLN 25 -5.204 3.290 5.787
180 H LEU 26 H LEU 26 -3.623 2.807 1.073
181 HA LEU 26 HA LEU 26 -2.389 3.905 3.473
182 1HB LEU 26 2HB LEU 26 -1.816 4.425 0.585
183 2HB LEU 26 1HB LEU 26 -1.480 5.661 1.776
184 HG LEU 26 HG LEU 26 0.541 4.497 1.315
185 1HD1 LEU 26 1HD1 LEU 26 -0.612 3.722 3.980
186 2HD1 LEU 26 2HD1 LEU 26 0.369 5.140 3.593
187 3HD1 LEU 26 3HD1 LEU 26 1.088 3.526 3.552
188 1HD2 LEU 26 1HD2 LEU 26 -0.907 1.953 2.020
189 2HD2 LEU 26 2HD2 LEU 26 0.807 2.097 1.628
190 3HD2 LEU 26 3HD2 LEU 26 -0.411 2.450 0.401
191 HA PRO 27 HA PRO 27 -5.747 6.847 3.351
192 1HB PRO 27 2HB PRO 27 -4.931 8.557 5.176
193 2HB PRO 27 1HB PRO 27 -5.252 6.878 5.648
194 1HG PRO 27 2HG PRO 27 -2.605 8.178 4.983
195 2HG PRO 27 1HG PRO 27 -3.034 7.174 6.393
196 1HD PRO 27 2HD PRO 27 -1.790 6.183 4.185
197 2HD PRO 27 1HD PRO 27 -2.875 5.212 5.202
198 H SER 28 H SER 28 -2.977 7.189 1.818
199 HA SER 28 HA SER 28 -2.097 8.640 0.352
200 1HB SER 28 2HB SER 28 -4.431 9.135 -0.319
201 2HB SER 28 1HB SER 28 -4.495 10.379 0.932
202 HG SER 28 HG SER 28 -2.801 10.307 -1.358
203 H ASN 29 H ASN 29 -3.417 10.311 3.157
204 HA ASN 29 HA ASN 29 -2.628 11.998 4.480
205 1HB ASN 29 2HB ASN 29 0.193 11.471 3.673
206 2HB ASN 29 1HB ASN 29 -0.450 11.872 5.252
207 1HD2 ASN 29 1HD2 ASN 29 0.497 9.416 3.122
208 2HD2 ASN 29 2HD2 ASN 29 0.143 8.063 4.138
209 HA PRO 30 HA PRO 30 -2.311 14.125 0.321
210 1HB PRO 30 2HB PRO 30 -4.160 15.982 1.742
211 2HB PRO 30 1HB PRO 30 -4.271 15.312 0.108
212 1HG PRO 30 2HG PRO 30 -5.828 14.334 1.994
213 2HG PRO 30 1HG PRO 30 -4.999 13.223 0.881
214 1HD PRO 30 2HD PRO 30 -4.265 13.958 3.694
215 2HD PRO 30 1HD PRO 30 -4.327 12.353 2.928
216 H THR 31 H THR 31 -0.240 14.807 0.500
217 HA THR 31 HA THR 31 0.301 17.117 2.221
218 HB THR 31 HB THR 31 1.792 15.406 2.779
219 HG1 THR 31 1HG THR 31 3.795 16.235 2.191
220 1HG2 THR 31 1HG2 THR 31 1.399 13.862 0.982
221 2HG2 THR 31 2HG2 THR 31 3.136 14.155 1.104
222 3HG2 THR 31 3HG2 THR 31 2.200 14.935 -0.171
223 H THR 32 H THR 32 0.593 15.963 -1.099
224 HA THR 32 HA THR 32 0.359 18.477 -2.273
225 HB THR 32 HB THR 32 2.574 18.941 -1.320
226 HG1 THR 32 1HG THR 32 3.051 19.987 -3.089
227 1HG2 THR 32 1HG2 THR 32 4.556 17.705 -2.055
228 2HG2 THR 32 2HG2 THR 32 3.522 16.574 -2.927
229 3HG2 THR 32 3HG2 THR 32 3.435 16.672 -1.169
230 H GLY 33 H GLY 33 2.251 17.793 -4.496
231 1HA GLY 33 2HA GLY 33 0.525 16.315 -6.116
232 2HA GLY 33 1HA GLY 33 2.217 16.615 -6.462
233 H PHE 34 H PHE 34 3.039 15.187 -3.970
234 HA PHE 34 HA PHE 34 3.547 12.645 -4.726
235 1HB PHE 34 2HB PHE 34 2.760 13.421 -1.914
236 2HB PHE 34 1HB PHE 34 3.714 12.022 -2.381
237 HD1 PHE 34 1HD PHE 34 4.484 14.175 -0.373
238 HD2 PHE 34 2HD PHE 34 5.256 13.713 -4.531
239 HE1 PHE 34 1HE PHE 34 6.539 15.499 -0.137
240 HE2 PHE 34 2HE PHE 34 7.313 15.035 -4.299
241 HZ PHE 34 HZ PHE 34 7.947 15.925 -2.021
242 H ALA 35 H ALA 35 2.534 10.789 -4.954
243 HA ALA 35 HA ALA 35 0.028 10.291 -3.533
244 1HB ALA 35 1HB ALA 35 -0.621 10.967 -5.810
245 2HB ALA 35 2HB ALA 35 -0.962 9.257 -5.540
246 3HB ALA 35 3HB ALA 35 0.449 9.736 -6.483
247 H TRP 36 H TRP 36 -0.286 7.978 -3.136
248 HA TRP 36 HA TRP 36 2.267 6.685 -2.836
249 1HB TRP 36 2HB TRP 36 -0.489 5.665 -2.083
250 2HB TRP 36 1HB TRP 36 1.029 4.824 -1.771
251 HD1 TRP 36 HD TRP 36 -1.056 7.768 -0.483
252 HE1 TRP 36 1HE TRP 36 -0.092 8.472 1.782
253 HE3 TRP 36 3HE TRP 36 3.185 4.928 -0.497
254 HZ2 TRP 36 2HZ TRP 36 2.163 7.887 3.380
255 HZ3 TRP 36 3HZ TRP 36 4.704 5.054 1.431
256 HH2 TRP 36 HH TRP 36 4.204 6.512 3.333
257 H TYR 37 H TYR 37 3.209 5.627 -4.343
258 HA TYR 37 HA TYR 37 1.640 3.673 -5.888
259 1HB TYR 37 2HB TYR 37 3.923 5.431 -6.767
260 2HB TYR 37 1HB TYR 37 3.607 3.897 -7.568
261 HD1 TYR 37 1HD TYR 37 2.466 7.327 -7.083
262 HD2 TYR 37 2HD TYR 37 1.584 3.557 -8.851
263 HE1 TYR 37 1HE TYR 37 0.771 8.402 -8.505
264 HE2 TYR 37 2HE TYR 37 -0.119 4.624 -10.281
265 HH TYR 37 HH TYR 37 -0.483 8.091 -10.446
266 H PHE 38 H PHE 38 3.340 1.859 -6.665
267 HA PHE 38 HA PHE 38 4.885 1.022 -4.424
268 1HB PHE 38 2HB PHE 38 4.405 0.037 -7.157
269 2HB PHE 38 1HB PHE 38 5.971 -0.357 -6.470
270 HD1 PHE 38 1HD PHE 38 2.573 -1.291 -6.702
271 HD2 PHE 38 2HD PHE 38 5.940 -1.436 -4.104
272 HE1 PHE 38 1HE PHE 38 1.535 -3.160 -5.479
273 HE2 PHE 38 2HE PHE 38 4.906 -3.296 -2.868
274 HZ PHE 38 HZ PHE 38 2.702 -4.148 -3.552
275 H GLU 39 H GLU 39 6.243 1.383 -7.667
276 HA GLU 39 HA GLU 39 8.454 2.918 -6.479
277 1HB GLU 39 2HB GLU 39 8.451 1.308 -9.041
278 2HB GLU 39 1HB GLU 39 9.841 2.092 -8.305
279 1HG GLU 39 2HG GLU 39 8.272 -0.142 -7.036
280 2HG GLU 39 1HG GLU 39 9.762 -0.356 -7.948
281 H GLY 40 H GLY 40 5.704 3.559 -7.892
282 1HA GLY 40 2HA GLY 40 5.158 5.758 -8.629
283 2HA GLY 40 1HA GLY 40 6.790 5.923 -9.260
284 H GLY 41 H GLY 41 3.572 5.228 -10.004
285 1HA GLY 41 2HA GLY 41 2.543 4.820 -12.025
286 2HA GLY 41 1HA GLY 41 4.122 4.934 -12.792
287 H THR 42 H THR 42 4.350 2.784 -10.323
288 HA THR 42 HA THR 42 3.735 0.470 -12.021
289 HB THR 42 HB THR 42 5.761 -0.524 -10.673
290 HG1 THR 42 1HG THR 42 7.109 1.813 -11.042
291 1HG2 THR 42 1HG2 THR 42 7.245 0.047 -12.571
292 2HG2 THR 42 2HG2 THR 42 6.061 1.236 -13.114
293 3HG2 THR 42 3HG2 THR 42 5.646 -0.477 -13.092
294 H LYS 43 H LYS 43 2.796 -1.228 -11.025
295 HA LYS 43 HA LYS 43 3.312 -1.528 -8.178
296 1HB LYS 43 2HB LYS 43 1.020 -2.115 -7.655
297 2HB LYS 43 1HB LYS 43 1.134 -0.463 -8.209
298 1HG LYS 43 2HG LYS 43 0.374 -2.666 -10.092
299 2HG LYS 43 1HG LYS 43 -0.817 -1.946 -9.013
300 1HD LYS 43 2HD LYS 43 0.878 -0.329 -10.904
301 2HD LYS 43 1HD LYS 43 -0.702 -0.976 -11.344
302 1HE LYS 43 2HE LYS 43 -1.585 0.221 -9.276
303 2HE LYS 43 1HE LYS 43 -0.040 1.066 -9.240
304 1HZ LYS 43 1HZ LYS 43 -1.860 2.264 -10.422
305 2HZ LYS 43 2HZ LYS 43 -1.833 1.046 -11.598
306 3HZ LYS 43 3HZ LYS 43 -0.472 2.018 -11.363
307 H GLU 44 H GLU 44 3.915 -3.495 -7.691
308 HA GLU 44 HA GLU 44 2.988 -5.764 -9.292
309 1HB GLU 44 2HB GLU 44 5.276 -6.676 -9.376
310 2HB GLU 44 1HB GLU 44 5.165 -5.134 -10.215
311 1HG GLU 44 2HG GLU 44 6.128 -4.007 -8.272
312 2HG GLU 44 1HG GLU 44 6.246 -5.556 -7.435
313 H SER 45 H SER 45 2.447 -7.528 -8.025
314 HA SER 45 HA SER 45 3.386 -7.463 -5.243
315 1HB SER 45 2HB SER 45 1.224 -9.128 -6.487
316 2HB SER 45 1HB SER 45 1.561 -8.931 -4.766
317 HG SER 45 HG SER 45 1.069 -6.670 -6.350
318 HA PRO 46 HA PRO 46 6.302 -10.529 -6.188
319 1HB PRO 46 2HB PRO 46 7.138 -10.716 -3.524
320 2HB PRO 46 1HB PRO 46 7.632 -9.477 -4.679
321 1HG PRO 46 2HG PRO 46 6.090 -9.086 -2.350
322 2HG PRO 46 1HG PRO 46 6.353 -7.911 -3.649
323 1HD PRO 46 2HD PRO 46 4.055 -9.762 -3.204
324 2HD PRO 46 1HD PRO 46 4.045 -8.113 -3.847
325 H ASN 47 H ASN 47 7.228 -12.586 -5.450
326 HA ASN 47 HA ASN 47 7.162 -14.776 -4.821
327 1HB ASN 47 2HB ASN 47 6.225 -14.046 -2.629
328 2HB ASN 47 1HB ASN 47 4.613 -14.174 -3.323
329 1HD2 ASN 47 1HD2 ASN 47 3.864 -15.796 -2.002
330 2HD2 ASN 47 2HD2 ASN 47 4.496 -17.402 -2.047
331 H GLU 48 H GLU 48 4.258 -13.283 -5.999
332 HA GLU 48 HA GLU 48 3.323 -15.858 -7.051
333 1HB GLU 48 2HB GLU 48 2.044 -13.595 -5.724
334 2HB GLU 48 1HB GLU 48 1.219 -14.123 -7.203
335 1HG GLU 48 2HG GLU 48 1.838 -15.775 -4.772
336 2HG GLU 48 1HG GLU 48 0.262 -15.377 -5.469
337 H SER 49 H SER 49 2.599 -16.099 -9.011
338 HA SER 49 HA SER 49 2.715 -13.820 -10.836
339 1HB SER 49 2HB SER 49 4.679 -15.314 -11.195
340 2HB SER 49 1HB SER 49 3.574 -16.651 -11.504
341 HG SER 49 HG SER 49 3.767 -14.234 -12.998
342 H MET 50 H MET 50 0.976 -16.341 -9.424
343 HA MET 50 HA MET 50 -0.864 -16.495 -11.659
344 1HB MET 50 2HB MET 50 -1.840 -18.400 -10.745
345 2HB MET 50 1HB MET 50 -0.119 -18.578 -10.498
346 1HG MET 50 2HG MET 50 -0.329 -18.020 -8.172
347 2HG MET 50 1HG MET 50 -2.023 -17.586 -8.393
348 1HE MET 50 1HE MET 50 -2.845 -19.046 -6.430
349 2HE MET 50 2HE MET 50 -1.169 -19.463 -6.062
350 3HE MET 50 3HE MET 50 -2.389 -20.733 -6.185
351 H PHE 51 H PHE 51 -0.624 -15.419 -8.355
352 HA PHE 51 HA PHE 51 -3.208 -14.023 -8.572
353 1HB PHE 51 2HB PHE 51 -2.841 -16.481 -7.243
354 2HB PHE 51 1HB PHE 51 -2.803 -15.268 -5.982
355 HD1 PHE 51 1HD PHE 51 -4.862 -16.349 -8.868
356 HD2 PHE 51 2HD PHE 51 -4.776 -14.618 -4.984
357 HE1 PHE 51 1HE PHE 51 -7.311 -16.240 -8.874
358 HE2 PHE 51 2HE PHE 51 -7.238 -14.526 -4.975
359 HZ PHE 51 HZ PHE 51 -8.485 -15.659 -6.643
360 H THR 52 H THR 52 -1.906 -12.005 -8.411
361 HA THR 52 HA THR 52 -2.251 -11.031 -5.920
362 HB THR 52 HB THR 52 -0.299 -12.373 -5.281
363 HG1 THR 52 1HG THR 52 -0.694 -10.685 -3.955
364 1HG2 THR 52 1HG2 THR 52 1.235 -10.478 -7.045
365 2HG2 THR 52 2HG2 THR 52 1.070 -12.222 -7.254
366 3HG2 THR 52 3HG2 THR 52 1.964 -11.577 -5.876
367 H VAL 53 H VAL 53 -3.278 -9.451 -7.266
368 HA VAL 53 HA VAL 53 -1.776 -7.104 -7.017
369 HB VAL 53 HB VAL 53 -2.330 -6.346 -9.515
370 1HG1 VAL 53 1HG1 VAL 53 -0.223 -6.015 -8.361
371 2HG1 VAL 53 2HG1 VAL 53 0.037 -6.556 -10.021
372 3HG1 VAL 53 3HG1 VAL 53 0.226 -7.692 -8.686
373 1HG2 VAL 53 1HG2 VAL 53 -3.079 -8.505 -10.312
374 2HG2 VAL 53 2HG2 VAL 53 -1.557 -9.244 -9.815
375 3HG2 VAL 53 3HG2 VAL 53 -1.576 -8.056 -11.118
376 H GLU 54 H GLU 54 -3.055 -5.360 -6.746
377 HA GLU 54 HA GLU 54 -5.382 -4.904 -8.308
378 1HB GLU 54 2HB GLU 54 -6.387 -6.444 -6.664
379 2HB GLU 54 1HB GLU 54 -5.795 -5.426 -5.365
380 1HG GLU 54 2HG GLU 54 -8.156 -5.061 -5.743
381 2HG GLU 54 1HG GLU 54 -7.224 -3.608 -6.098
382 H ASN 55 H ASN 55 -6.180 -2.765 -7.986
383 HA ASN 55 HA ASN 55 -4.740 -1.118 -6.080
384 1HB ASN 55 2HB ASN 55 -4.162 0.593 -7.823
385 2HB ASN 55 1HB ASN 55 -3.191 -0.870 -7.829
386 1HD2 ASN 55 1HD2 ASN 55 -6.437 -0.635 -9.214
387 2HD2 ASN 55 2HD2 ASN 55 -5.928 -0.817 -10.858
388 H LYS 56 H LYS 56 -5.815 0.616 -5.371
389 HA LYS 56 HA LYS 56 -7.870 1.884 -6.880
390 1HB LYS 56 2HB LYS 56 -9.482 1.395 -4.759
391 2HB LYS 56 1HB LYS 56 -9.545 0.505 -6.271
392 1HG LYS 56 2HG LYS 56 -9.435 -1.272 -4.893
393 2HG LYS 56 1HG LYS 56 -7.702 -0.948 -4.966
394 1HD LYS 56 2HD LYS 56 -8.538 -1.317 -2.670
395 2HD LYS 56 1HD LYS 56 -7.792 0.265 -2.885
396 1HE LYS 56 2HE LYS 56 -9.807 0.463 -1.590
397 2HE LYS 56 1HE LYS 56 -10.012 1.264 -3.143
398 1HZ LYS 56 1HZ LYS 56 -11.188 -0.738 -3.934
399 2HZ LYS 56 2HZ LYS 56 -11.977 0.010 -2.634
400 3HZ LYS 56 3HZ LYS 56 -11.080 -1.405 -2.378
401 H TYR 57 H TYR 57 -7.154 3.854 -6.541
402 HA TYR 57 HA TYR 57 -6.729 4.714 -3.763
403 1HB TYR 57 2HB TYR 57 -5.098 6.400 -5.131
404 2HB TYR 57 1HB TYR 57 -4.570 4.938 -4.312
405 HD1 TYR 57 1HD TYR 57 -5.834 6.103 -7.620
406 HD2 TYR 57 2HD TYR 57 -3.346 3.364 -5.515
407 HE1 TYR 57 1HE TYR 57 -4.974 5.243 -9.760
408 HE2 TYR 57 2HE TYR 57 -2.483 2.500 -7.647
409 HH TYR 57 HH TYR 57 -2.877 2.423 -9.895
410 H PHE 58 H PHE 58 -7.865 6.367 -3.122
411 HA PHE 58 HA PHE 58 -9.039 8.196 -5.100
412 1HB PHE 58 2HB PHE 58 -10.464 6.696 -2.898
413 2HB PHE 58 1HB PHE 58 -11.156 8.101 -3.710
414 HD1 PHE 58 1HD PHE 58 -10.158 4.597 -4.117
415 HD2 PHE 58 2HD PHE 58 -11.980 7.972 -5.951
416 HE1 PHE 58 1HE PHE 58 -11.023 3.153 -5.911
417 HE2 PHE 58 2HE PHE 58 -12.850 6.536 -7.746
418 HZ PHE 58 HZ PHE 58 -12.373 4.122 -7.728
419 HA PRO 59 HA PRO 59 -7.332 11.087 -2.052
420 1HB PRO 59 2HB PRO 59 -8.433 12.987 -4.051
421 2HB PRO 59 1HB PRO 59 -6.805 12.887 -3.365
422 1HG PRO 59 2HG PRO 59 -7.249 12.123 -5.872
423 2HG PRO 59 1HG PRO 59 -6.157 11.192 -4.825
424 1HD PRO 59 2HD PRO 59 -9.017 10.628 -5.548
425 2HD PRO 59 1HD PRO 59 -7.629 9.516 -5.514
426 HA PRO 60 HA PRO 60 -10.634 12.437 0.486
427 1HB PRO 60 2HB PRO 60 -9.863 15.259 -0.090
428 2HB PRO 60 1HB PRO 60 -10.167 14.467 1.460
429 1HG PRO 60 2HG PRO 60 -7.683 14.906 0.686
430 2HG PRO 60 1HG PRO 60 -8.132 13.371 1.460
431 1HD PRO 60 2HD PRO 60 -7.579 13.963 -1.420
432 2HD PRO 60 1HD PRO 60 -7.202 12.509 -0.473
433 H ASP 61 H ASP 61 -12.431 13.930 0.746
434 HA ASP 61 HA ASP 61 -13.704 15.119 -1.519
435 1HB ASP 61 2HB ASP 61 -14.198 12.797 -2.089
436 2HB ASP 61 1HB ASP 61 -14.720 12.471 -0.438
437 H SER 62 H SER 62 -15.587 13.433 0.761
438 HA SER 62 HA SER 62 -15.387 15.202 2.963
439 1HB SER 62 2HB SER 62 -17.915 15.309 1.284
440 2HB SER 62 1HB SER 62 -17.784 15.942 2.925
441 HG SER 62 HG SER 62 -15.808 16.870 1.283
442 H LYS 63 H LYS 63 -17.572 12.962 1.267
443 HA LYS 63 HA LYS 63 -18.089 11.573 3.770
444 1HB LYS 63 2HB LYS 63 -19.675 10.207 2.434
445 2HB LYS 63 1HB LYS 63 -20.012 11.928 2.363
446 1HG LYS 63 2HG LYS 63 -20.344 11.122 0.186
447 2HG LYS 63 1HG LYS 63 -18.784 11.938 0.144
448 1HD LYS 63 2HD LYS 63 -17.635 9.792 0.332
449 2HD LYS 63 1HD LYS 63 -19.193 8.962 0.432
450 1HE LYS 63 2HE LYS 63 -18.314 10.627 -1.923
451 2HE LYS 63 1HE LYS 63 -18.126 8.876 -1.822
452 1HZ LYS 63 1HZ LYS 63 -20.615 8.825 -1.447
453 2HZ LYS 63 2HZ LYS 63 -20.092 9.230 -3.008
454 3HZ LYS 63 3HZ LYS 63 -20.637 10.444 -1.960
455 H LEU 64 H LEU 64 -16.178 11.234 0.902
456 HA LEU 64 HA LEU 64 -15.729 8.457 0.979
457 1HB LEU 64 2HB LEU 64 -15.210 9.931 -0.951
458 2HB LEU 64 1HB LEU 64 -13.878 10.617 -0.039
459 HG LEU 64 HG LEU 64 -12.764 8.427 -0.006
460 1HD1 LEU 64 1HD1 LEU 64 -13.612 6.591 -1.368
461 2HD1 LEU 64 2HD1 LEU 64 -15.057 7.528 -1.748
462 3HD1 LEU 64 3HD1 LEU 64 -14.756 7.007 -0.091
463 1HD2 LEU 64 1HD2 LEU 64 -12.275 10.010 -1.792
464 2HD2 LEU 64 2HD2 LEU 64 -13.594 9.343 -2.754
465 3HD2 LEU 64 3HD2 LEU 64 -12.187 8.350 -2.377
466 H LEU 65 H LEU 65 -13.684 11.124 2.065
467 HA LEU 65 HA LEU 65 -13.015 9.660 4.439
468 1HB LEU 65 2HB LEU 65 -11.324 9.226 2.439
469 2HB LEU 65 1HB LEU 65 -10.697 10.786 2.926
470 HG LEU 65 HG LEU 65 -9.370 9.022 3.912
471 1HD1 LEU 65 1HD1 LEU 65 -11.110 10.326 6.000
472 2HD1 LEU 65 2HD1 LEU 65 -9.670 11.024 5.261
473 3HD1 LEU 65 3HD1 LEU 65 -9.533 9.590 6.278
474 1HD2 LEU 65 1HD2 LEU 65 -10.294 7.387 5.438
475 2HD2 LEU 65 2HD2 LEU 65 -11.096 7.271 3.871
476 3HD2 LEU 65 3HD2 LEU 65 -11.910 8.058 5.224
477 H GLY 66 H GLY 66 -12.033 12.428 2.520
478 1HA GLY 66 2HA GLY 66 -12.541 14.674 2.834
479 2HA GLY 66 1HA GLY 66 -13.328 14.252 4.345
480 H ALA 67 H ALA 67 -11.631 13.315 5.982
481 HA ALA 67 HA ALA 67 -9.900 15.327 6.825
482 1HB ALA 67 1HB ALA 67 -9.746 12.359 7.344
483 2HB ALA 67 2HB ALA 67 -10.700 13.523 8.266
484 3HB ALA 67 3HB ALA 67 -8.938 13.609 8.292
485 H GLY 68 H GLY 68 -8.934 12.171 5.594
486 1HA GLY 68 2HA GLY 68 -6.743 13.465 4.110
487 2HA GLY 68 1HA GLY 68 -6.582 11.882 4.875
488 H GLY 69 H GLY 69 -6.033 11.096 2.739
489 1HA GLY 69 2HA GLY 69 -8.374 10.857 0.965
490 2HA GLY 69 1HA GLY 69 -6.700 10.654 0.464
491 H THR 70 H THR 70 -7.414 8.614 -0.428
492 HA THR 70 HA THR 70 -7.048 6.473 1.437
493 HB THR 70 HB THR 70 -9.308 5.537 0.126
494 HG1 THR 70 1HG THR 70 -9.643 7.928 -0.253
495 1HG2 THR 70 1HG2 THR 70 -10.263 5.517 2.373
496 2HG2 THR 70 2HG2 THR 70 -9.063 6.696 2.909
497 3HG2 THR 70 3HG2 THR 70 -8.554 5.075 2.426
498 H GLU 71 H GLU 71 -5.234 6.271 0.078
499 HA GLU 71 HA GLU 71 -5.768 5.210 -2.610
500 1HB GLU 71 2HB GLU 71 -3.146 6.138 -1.400
501 2HB GLU 71 1HB GLU 71 -3.421 5.690 -3.081
502 1HG GLU 71 2HG GLU 71 -4.985 7.570 -3.306
503 2HG GLU 71 1HG GLU 71 -4.637 8.040 -1.644
504 H HIS 72 H HIS 72 -6.072 3.013 -2.448
505 HA HIS 72 HA HIS 72 -4.367 1.640 -0.478
506 1HB HIS 72 2HB HIS 72 -6.716 0.198 -1.597
507 2HB HIS 72 1HB HIS 72 -5.936 0.065 -0.034
508 HD1 HIS 72 1HD HIS 72 -8.291 0.007 1.023
509 HD2 HIS 72 2HD HIS 72 -7.341 3.578 -0.863
510 HE1 HIS 72 1HE HIS 72 -10.018 1.640 1.770
511 HE2 HIS 72 2HE HIS 72 -9.626 3.687 0.361
512 H PHE 73 H PHE 73 -3.310 -0.168 -0.978
513 HA PHE 73 HA PHE 73 -3.162 -0.924 -3.814
514 1HB PHE 73 2HB PHE 73 -1.146 -0.423 -1.715
515 2HB PHE 73 1HB PHE 73 -0.815 -1.788 -2.788
516 HD1 PHE 73 1HD PHE 73 0.148 -1.393 -4.870
517 HD2 PHE 73 2HD PHE 73 -1.760 1.809 -2.821
518 HE1 PHE 73 1HE PHE 73 0.932 0.169 -6.595
519 HE2 PHE 73 2HE PHE 73 -0.968 3.383 -4.539
520 HZ PHE 73 HZ PHE 73 0.377 2.562 -6.429
521 H HIS 74 H HIS 74 -4.136 -2.825 -4.107
522 HA HIS 74 HA HIS 74 -4.297 -4.632 -1.792
523 1HB HIS 74 2HB HIS 74 -6.065 -4.250 -4.203
524 2HB HIS 74 1HB HIS 74 -6.181 -5.677 -3.186
525 HD1 HIS 74 1HD HIS 74 -8.618 -4.991 -2.658
526 HD2 HIS 74 2HD HIS 74 -5.746 -2.281 -1.316
527 HE1 HIS 74 1HE HIS 74 -9.786 -3.532 -0.982
528 HE2 HIS 74 2HE HIS 74 -7.950 -2.147 0.039
529 H VAL 75 H VAL 75 -3.812 -6.830 -2.058
530 HA VAL 75 HA VAL 75 -2.844 -7.595 -4.713
531 HB VAL 75 HB VAL 75 -0.912 -8.699 -3.905
532 1HG1 VAL 75 1HG1 VAL 75 -0.673 -6.272 -4.092
533 2HG1 VAL 75 2HG1 VAL 75 0.392 -6.950 -2.860
534 3HG1 VAL 75 3HG1 VAL 75 -1.085 -6.104 -2.383
535 1HG2 VAL 75 1HG2 VAL 75 -1.781 -9.743 -1.935
536 2HG2 VAL 75 2HG2 VAL 75 -1.929 -8.175 -1.124
537 3HG2 VAL 75 3HG2 VAL 75 -0.328 -8.830 -1.507
538 H THR 76 H THR 76 -3.720 -9.426 -5.405
539 HA THR 76 HA THR 76 -5.502 -10.825 -3.532
540 HB THR 76 HB THR 76 -5.431 -11.177 -6.535
541 HG1 THR 76 1HG THR 76 -6.139 -9.181 -6.746
542 1HG2 THR 76 1HG2 THR 76 -6.810 -12.747 -5.294
543 2HG2 THR 76 2HG2 THR 76 -7.854 -11.646 -6.192
544 3HG2 THR 76 3HG2 THR 76 -7.626 -11.428 -4.455
545 H VAL 77 H VAL 77 -4.369 -12.554 -2.668
546 HA VAL 77 HA VAL 77 -2.806 -14.198 -4.500
547 HB VAL 77 HB VAL 77 -1.193 -12.557 -3.828
548 1HG1 VAL 77 1HG1 VAL 77 -2.350 -11.705 -1.859
549 2HG1 VAL 77 2HG1 VAL 77 -0.661 -12.072 -1.506
550 3HG1 VAL 77 3HG1 VAL 77 -1.933 -13.173 -0.976
551 1HG2 VAL 77 1HG2 VAL 77 -0.792 -15.090 -2.245
552 2HG2 VAL 77 2HG2 VAL 77 0.470 -13.917 -2.619
553 3HG2 VAL 77 3HG2 VAL 77 -0.319 -14.810 -3.920
554 H LYS 78 H LYS 78 -2.633 -16.296 -3.913
555 HA LYS 78 HA LYS 78 -2.803 -16.930 -1.083
556 1HB LYS 78 2HB LYS 78 -4.131 -18.877 -1.364
557 2HB LYS 78 1HB LYS 78 -5.006 -17.524 -2.036
558 1HG LYS 78 2HG LYS 78 -3.413 -19.312 -3.823
559 2HG LYS 78 1HG LYS 78 -5.019 -19.790 -3.273
560 1HD LYS 78 2HD LYS 78 -5.830 -17.554 -4.143
561 2HD LYS 78 1HD LYS 78 -4.252 -17.390 -4.918
562 1HE LYS 78 2HE LYS 78 -5.828 -18.275 -6.508
563 2HE LYS 78 1HE LYS 78 -4.657 -19.527 -6.100
564 1HZ LYS 78 1HZ LYS 78 -6.895 -20.412 -6.157
565 2HZ LYS 78 2HZ LYS 78 -7.406 -19.287 -4.996
566 3HZ LYS 78 3HZ LYS 78 -6.282 -20.488 -4.577
567 H ALA 79 H ALA 79 -0.791 -17.449 -0.703
568 HA ALA 79 HA ALA 79 0.495 -19.639 -1.984
569 1HB ALA 79 1HB ALA 79 2.379 -18.428 -2.958
570 2HB ALA 79 2HB ALA 79 1.645 -16.892 -2.506
571 3HB ALA 79 3HB ALA 79 0.868 -17.919 -3.713
572 H ALA 80 H ALA 80 2.728 -19.947 -1.073
573 HA ALA 80 HA ALA 80 2.778 -18.930 1.687
574 1HB ALA 80 1HB ALA 80 4.188 -21.311 0.488
575 2HB ALA 80 2HB ALA 80 2.712 -21.362 1.451
576 3HB ALA 80 3HB ALA 80 4.227 -20.831 2.184
577 H GLY 81 H GLY 81 3.706 -16.948 1.280
578 1HA GLY 81 2HA GLY 81 6.569 -16.925 0.829
579 2HA GLY 81 1HA GLY 81 5.622 -16.162 -0.446
580 H THR 82 H THR 82 7.404 -14.625 0.931
581 HA THR 82 HA THR 82 5.771 -13.261 2.956
582 HB THR 82 HB THR 82 8.646 -12.616 2.307
583 HG1 THR 82 1HG THR 82 8.037 -14.938 3.042
584 1HG2 THR 82 1HG2 THR 82 8.622 -11.813 4.656
585 2HG2 THR 82 2HG2 THR 82 6.902 -12.208 4.743
586 3HG2 THR 82 3HG2 THR 82 7.467 -10.960 3.633
587 H HIS 83 H HIS 83 4.981 -11.262 2.657
588 HA HIS 83 HA HIS 83 5.290 -10.159 -0.047
589 1HB HIS 83 2HB HIS 83 2.967 -10.869 0.929
590 2HB HIS 83 1HB HIS 83 3.103 -9.404 1.891
591 HD1 HIS 83 1HD HIS 83 3.532 -7.142 0.404
592 HD2 HIS 83 2HD HIS 83 1.851 -10.420 -1.518
593 HE1 HIS 83 1HE HIS 83 2.488 -6.217 -1.684
594 HE2 HIS 83 2HE HIS 83 1.355 -8.199 -2.770
595 H ALA 84 H ALA 84 6.906 -8.702 0.033
596 HA ALA 84 HA ALA 84 6.991 -6.822 2.285
597 1HB ALA 84 1HB ALA 84 9.095 -7.971 1.775
598 2HB ALA 84 2HB ALA 84 9.237 -6.239 1.473
599 3HB ALA 84 3HB ALA 84 9.040 -7.354 0.122
600 H VAL 85 H VAL 85 5.933 -4.996 1.994
601 HA VAL 85 HA VAL 85 5.343 -4.173 -0.772
602 HB VAL 85 HB VAL 85 3.780 -3.031 1.445
603 1HG1 VAL 85 1HG1 VAL 85 3.012 -4.251 -1.190
604 2HG1 VAL 85 2HG1 VAL 85 3.293 -2.537 -0.882
605 3HG1 VAL 85 3HG1 VAL 85 1.938 -3.362 -0.108
606 1HG2 VAL 85 1HG2 VAL 85 3.376 -5.910 0.676
607 2HG2 VAL 85 2HG2 VAL 85 2.405 -4.974 1.814
608 3HG2 VAL 85 3HG2 VAL 85 4.087 -5.365 2.196
609 H ASN 86 H ASN 86 6.850 -2.689 -1.282
610 HA ASN 86 HA ASN 86 7.262 -0.456 0.595
611 1HB ASN 86 2HB ASN 86 8.969 -1.472 -1.693
612 2HB ASN 86 1HB ASN 86 9.258 0.063 -0.885
613 1HD2 ASN 86 1HD2 ASN 86 8.193 -2.871 0.724
614 2HD2 ASN 86 2HD2 ASN 86 9.648 -3.125 1.620
615 H LEU 87 H LEU 87 5.788 1.006 0.167
616 HA LEU 87 HA LEU 87 5.157 1.599 -2.640
617 1HB LEU 87 2HB LEU 87 3.572 2.171 -0.133
618 2HB LEU 87 1HB LEU 87 3.092 2.614 -1.763
619 HG LEU 87 HG LEU 87 3.532 -0.249 -0.922
620 1HD1 LEU 87 1HD1 LEU 87 0.963 1.327 -1.012
621 2HD1 LEU 87 2HD1 LEU 87 1.759 0.718 0.443
622 3HD1 LEU 87 3HD1 LEU 87 1.104 -0.412 -0.743
623 1HD2 LEU 87 1HD2 LEU 87 2.099 1.005 -3.247
624 2HD2 LEU 87 2HD2 LEU 87 2.224 -0.722 -2.907
625 3HD2 LEU 87 3HD2 LEU 87 3.672 0.207 -3.300
626 H THR 88 H THR 88 5.803 3.483 -3.433
627 HA THR 88 HA THR 88 7.092 5.327 -1.567
628 HB THR 88 HB THR 88 7.479 5.265 -4.557
629 HG1 THR 88 1HG THR 88 8.171 3.269 -4.074
630 1HG2 THR 88 1HG2 THR 88 8.333 7.235 -3.384
631 2HG2 THR 88 2HG2 THR 88 9.671 6.234 -3.949
632 3HG2 THR 88 3HG2 THR 88 9.200 6.201 -2.248
633 H TYR 89 H TYR 89 6.197 7.149 -1.138
634 HA TYR 89 HA TYR 89 3.799 8.026 -2.539
635 1HB TYR 89 2HB TYR 89 3.941 7.790 -0.034
636 2HB TYR 89 1HB TYR 89 5.120 9.091 -0.026
637 HD1 TYR 89 1HD TYR 89 2.110 8.999 -2.145
638 HD2 TYR 89 2HD TYR 89 3.936 10.613 1.325
639 HE1 TYR 89 1HE TYR 89 0.296 10.639 -1.959
640 HE2 TYR 89 2HE TYR 89 2.124 12.251 1.528
641 HH TYR 89 HH TYR 89 0.469 13.334 0.073
642 H MET 90 H MET 90 4.614 8.972 -4.445
643 HA MET 90 HA MET 90 6.406 11.297 -4.049
644 1HB MET 90 2HB MET 90 6.585 9.669 -6.549
645 2HB MET 90 1HB MET 90 7.757 10.769 -5.855
646 1HG MET 90 2HG MET 90 8.338 9.186 -4.159
647 2HG MET 90 1HG MET 90 7.081 8.077 -4.722
648 1HE MET 90 1HE MET 90 8.416 7.303 -8.381
649 2HE MET 90 2HE MET 90 7.358 8.634 -7.904
650 3HE MET 90 3HE MET 90 7.101 7.019 -7.240
651 H ARG 91 H ARG 91 6.381 12.794 -5.815
652 HA ARG 91 HA ARG 91 3.865 13.260 -7.048
653 1HB ARG 91 2HB ARG 91 6.478 14.537 -6.869
654 2HB ARG 91 1HB ARG 91 5.839 14.600 -8.509
655 1HG ARG 91 2HG ARG 91 3.829 15.691 -7.733
656 2HG ARG 91 1HG ARG 91 4.347 15.511 -6.059
657 1HD ARG 91 2HD ARG 91 5.982 17.024 -8.073
658 2HD ARG 91 1HD ARG 91 4.680 17.792 -7.171
659 HE ARG 91 HE ARG 91 7.047 16.563 -5.900
660 1HH1 ARG 91 1HH1 ARG 91 4.560 19.014 -6.069
661 2HH1 ARG 91 2HH1 ARG 91 5.168 19.911 -4.711
662 1HH2 ARG 91 1HH2 ARG 91 7.855 17.757 -4.071
663 2HH2 ARG 91 2HH2 ARG 91 7.027 19.204 -3.585
664 HA PRO 92 HA PRO 92 4.447 9.739 -9.715
665 1HB PRO 92 2HB PRO 92 2.383 10.434 -11.473
666 2HB PRO 92 1HB PRO 92 2.238 9.426 -10.031
667 1HG PRO 92 2HG PRO 92 1.650 12.325 -10.389
668 2HG PRO 92 1HG PRO 92 0.803 11.119 -9.403
669 1HD PRO 92 2HD PRO 92 2.427 12.922 -8.286
670 2HD PRO 92 1HD PRO 92 2.370 11.249 -7.688
671 H TRP 93 H TRP 93 4.383 13.024 -10.992
672 HA TRP 93 HA TRP 93 5.444 12.108 -13.547
673 1HB TRP 93 2HB TRP 93 5.230 14.500 -14.222
674 2HB TRP 93 1HB TRP 93 3.717 13.767 -13.704
675 HD1 TRP 93 HD TRP 93 6.193 16.501 -12.772
676 HE1 TRP 93 1HE TRP 93 5.184 17.949 -10.897
677 HE3 TRP 93 3HE TRP 93 2.099 13.653 -11.675
678 HZ2 TRP 93 2HZ TRP 93 2.936 17.887 -9.184
679 HZ3 TRP 93 3HZ TRP 93 0.574 14.406 -9.906
680 HH2 TRP 93 HH TRP 93 0.983 16.487 -8.686
681 H THR 94 H THR 94 6.809 12.622 -10.666
682 HA THR 94 HA THR 94 9.407 12.957 -11.782
683 HB THR 94 HB THR 94 8.995 15.281 -11.848
684 HG1 THR 94 1HG THR 94 10.944 14.442 -10.590
685 1HG2 THR 94 1HG2 THR 94 8.167 16.604 -9.964
686 2HG2 THR 94 2HG2 THR 94 7.973 15.132 -9.013
687 3HG2 THR 94 3HG2 THR 94 6.990 15.384 -10.456
688 H GLY 95 H GLY 95 7.922 13.707 -8.615
689 1HA GLY 95 2HA GLY 95 8.181 12.745 -6.543
690 2HA GLY 95 1HA GLY 95 8.758 11.300 -7.391
691 HA PRO 96 HA PRO 96 12.419 14.333 -6.317
692 1HB PRO 96 2HB PRO 96 11.509 15.199 -3.664
693 2HB PRO 96 1HB PRO 96 12.141 16.157 -4.999
694 1HG PRO 96 2HG PRO 96 9.557 16.257 -4.267
695 2HG PRO 96 1HG PRO 96 10.081 16.469 -5.946
696 1HD PRO 96 2HD PRO 96 8.897 14.073 -4.620
697 2HD PRO 96 1HD PRO 96 8.608 14.724 -6.248
698 H SER 97 H SER 97 14.093 13.251 -5.553
699 HA SER 97 HA SER 97 13.931 10.665 -4.778
700 1HB SER 97 2HB SER 97 15.946 11.864 -5.658
701 2HB SER 97 1HB SER 97 16.218 12.494 -4.036
702 HG SER 97 HG SER 97 17.269 10.385 -4.844
703 H HIS 98 H HIS 98 14.503 13.383 -2.508
704 HA HIS 98 HA HIS 98 13.840 11.476 -0.355
705 1HB HIS 98 2HB HIS 98 16.275 12.185 -0.462
706 2HB HIS 98 1HB HIS 98 15.735 13.803 -0.026
707 HD1 HIS 98 1HD HIS 98 15.174 10.297 1.373
708 HD2 HIS 98 2HD HIS 98 15.933 14.187 2.642
709 HE1 HIS 98 1HE HIS 98 15.314 10.178 3.883
710 HE2 HIS 98 2HE HIS 98 15.563 12.571 4.633
711 H ASP 99 H ASP 99 12.268 13.571 -1.944
712 HA ASP 99 HA ASP 99 11.308 15.106 0.384
713 1HB ASP 99 2HB ASP 99 11.851 16.420 -1.641
714 2HB ASP 99 1HB ASP 99 10.692 15.471 -2.562
715 H SER 100 H SER 100 10.678 12.558 -1.765
716 HA SER 100 HA SER 100 7.856 12.337 -1.288
717 1HB SER 100 2HB SER 100 9.783 10.323 -2.461
718 2HB SER 100 1HB SER 100 8.027 10.329 -2.626
719 HG SER 100 HG SER 100 9.951 11.945 -3.855
720 H GLU 101 H GLU 101 6.831 10.766 -0.026
721 HA GLU 101 HA GLU 101 8.454 9.673 2.160
722 1HB GLU 101 2HB GLU 101 6.359 10.955 2.681
723 2HB GLU 101 1HB GLU 101 5.433 9.721 1.840
724 1HG GLU 101 2HG GLU 101 6.026 8.071 3.465
725 2HG GLU 101 1HG GLU 101 7.163 9.170 4.241
726 H ARG 102 H ARG 102 7.627 7.320 2.833
727 HA ARG 102 HA ARG 102 6.705 5.718 0.630
728 1HB ARG 102 2HB ARG 102 9.173 6.053 0.166
729 2HB ARG 102 1HB ARG 102 9.513 5.211 1.669
730 1HG ARG 102 2HG ARG 102 8.496 3.190 0.813
731 2HG ARG 102 1HG ARG 102 8.027 4.021 -0.669
732 1HD ARG 102 2HD ARG 102 10.553 4.527 -0.899
733 2HD ARG 102 1HD ARG 102 10.756 3.228 0.273
734 HE ARG 102 HE ARG 102 9.295 2.772 -2.264
735 1HH1 ARG 102 1HH1 ARG 102 11.806 1.883 0.026
736 2HH1 ARG 102 2HH1 ARG 102 12.402 0.567 -0.944
737 1HH2 ARG 102 1HH2 ARG 102 10.086 1.053 -3.549
738 2HH2 ARG 102 2HH2 ARG 102 11.429 0.102 -2.970
739 H PHE 103 H PHE 103 5.883 3.860 1.257
740 HA PHE 103 HA PHE 103 5.771 3.341 4.140
741 1HB PHE 103 2HB PHE 103 3.568 3.603 3.510
742 2HB PHE 103 1HB PHE 103 3.863 3.066 1.862
743 HD1 PHE 103 1HD PHE 103 3.054 2.056 5.256
744 HD2 PHE 103 2HD PHE 103 3.837 0.718 1.298
745 HE1 PHE 103 1HE PHE 103 2.179 -0.163 5.832
746 HE2 PHE 103 2HE PHE 103 2.957 -1.498 1.866
747 HZ PHE 103 HZ PHE 103 2.130 -1.941 4.134
748 H THR 104 H THR 104 5.807 1.077 4.824
749 HA THR 104 HA THR 104 6.660 -0.878 2.910
750 HB THR 104 HB THR 104 8.587 0.173 4.991
751 HG1 THR 104 1HG THR 104 8.304 0.699 2.450
752 1HG2 THR 104 1HG2 THR 104 8.747 -2.377 3.389
753 2HG2 THR 104 2HG2 THR 104 8.561 -2.242 5.141
754 3HG2 THR 104 3HG2 THR 104 10.052 -1.700 4.364
755 H VAL 105 H VAL 105 5.029 -2.263 3.595
756 HA VAL 105 HA VAL 105 5.335 -3.165 6.365
757 HB VAL 105 HB VAL 105 3.044 -2.844 4.775
758 1HG1 VAL 105 1HG1 VAL 105 1.991 -5.035 4.783
759 2HG1 VAL 105 2HG1 VAL 105 3.484 -5.766 5.371
760 3HG1 VAL 105 3HG1 VAL 105 3.430 -5.041 3.768
761 1HG2 VAL 105 1HG2 VAL 105 1.896 -3.640 6.782
762 2HG2 VAL 105 2HG2 VAL 105 3.191 -2.501 7.154
763 3HG2 VAL 105 3HG2 VAL 105 3.435 -4.231 7.411
764 H TYR 106 H TYR 106 6.306 -5.001 6.831
765 HA TYR 106 HA TYR 106 6.913 -6.869 4.623
766 1HB TYR 106 2HB TYR 106 8.146 -6.753 7.373
767 2HB TYR 106 1HB TYR 106 8.624 -7.834 6.081
768 HD1 TYR 106 1HD TYR 106 9.529 -6.717 3.936
769 HD2 TYR 106 2HD TYR 106 9.279 -4.747 7.700
770 HE1 TYR 106 1HE TYR 106 11.173 -5.071 3.173
771 HE2 TYR 106 2HE TYR 106 10.933 -3.087 6.947
772 HH TYR 106 HH TYR 106 12.763 -2.941 5.243
773 H LEU 107 H LEU 107 5.129 -8.114 4.579
774 HA LEU 107 HA LEU 107 4.373 -9.436 7.072
775 1HB LEU 107 2HB LEU 107 2.696 -7.685 5.363
776 2HB LEU 107 1HB LEU 107 1.943 -9.158 5.942
777 HG LEU 107 HG LEU 107 2.389 -8.489 8.266
778 1HD1 LEU 107 1HD1 LEU 107 3.443 -5.925 7.097
779 2HD1 LEU 107 2HD1 LEU 107 4.401 -7.153 7.926
780 3HD1 LEU 107 3HD1 LEU 107 3.164 -6.256 8.807
781 1HD2 LEU 107 1HD2 LEU 107 1.013 -6.379 6.638
782 2HD2 LEU 107 2HD2 LEU 107 0.842 -6.615 8.378
783 3HD2 LEU 107 3HD2 LEU 107 0.292 -7.863 7.260
784 H LYS 108 H LYS 108 3.388 -11.518 6.753
785 HA LYS 108 HA LYS 108 4.561 -12.614 4.291
786 1HB LYS 108 2HB LYS 108 5.426 -13.320 6.582
787 2HB LYS 108 1HB LYS 108 3.910 -14.186 6.767
788 1HG LYS 108 2HG LYS 108 4.379 -15.446 4.727
789 2HG LYS 108 1HG LYS 108 5.920 -14.605 4.571
790 1HD LYS 108 2HD LYS 108 6.293 -16.777 5.554
791 2HD LYS 108 1HD LYS 108 6.622 -15.518 6.747
792 1HE LYS 108 2HE LYS 108 4.443 -15.894 7.763
793 2HE LYS 108 1HE LYS 108 4.073 -17.118 6.548
794 1HZ LYS 108 1HZ LYS 108 4.824 -18.114 8.614
795 2HZ LYS 108 2HZ LYS 108 6.283 -17.261 8.527
796 3HZ LYS 108 3HZ LYS 108 5.920 -18.442 7.363
797 H ALA 109 H ALA 109 3.423 -13.816 2.927
798 HA ALA 109 HA ALA 109 0.532 -13.753 3.355
799 1HB ALA 109 1HB ALA 109 0.438 -13.977 0.865
800 2HB ALA 109 2HB ALA 109 2.195 -13.877 0.843
801 3HB ALA 109 3HB ALA 109 1.241 -12.511 1.421
802 H ASN 110 H ASN 110 -0.640 -15.583 3.379
803 HA ASN 110 HA ASN 110 0.073 -18.041 2.270
804 1HB ASN 110 2HB ASN 110 0.785 -19.346 4.209
805 2HB ASN 110 1HB ASN 110 1.911 -18.027 3.917
806 1HD2 ASN 110 1HD2 ASN 110 1.801 -16.183 5.304
807 2HD2 ASN 110 2HD2 ASN 110 1.192 -16.336 6.910
Start of MODEL 15
1 H HIS 3 H HIS 3 -6.429 -9.907 4.445
2 HA HIS 3 HA HIS 3 -5.477 -9.008 7.036
3 1HB HIS 3 2HB HIS 3 -3.631 -10.454 6.508
4 2HB HIS 3 1HB HIS 3 -3.677 -9.958 4.810
5 HD1 HIS 3 1HD HIS 3 -3.183 -8.124 8.119
6 HD2 HIS 3 2HD HIS 3 -1.592 -8.349 4.277
7 HE1 HIS 3 1HE HIS 3 -1.337 -6.417 8.050
8 HE2 HIS 3 2HE HIS 3 -0.499 -6.451 5.674
9 H LYS 4 H LYS 4 -5.193 -6.825 7.089
10 HA LYS 4 HA LYS 4 -4.989 -5.383 4.544
11 1HB LYS 4 2HB LYS 4 -6.658 -3.769 5.192
12 2HB LYS 4 1HB LYS 4 -7.368 -5.376 5.292
13 1HG LYS 4 2HG LYS 4 -7.129 -5.369 7.699
14 2HG LYS 4 1HG LYS 4 -6.312 -3.807 7.639
15 1HD LYS 4 2HD LYS 4 -8.562 -3.383 8.262
16 2HD LYS 4 1HD LYS 4 -8.399 -2.878 6.579
17 1HE LYS 4 2HE LYS 4 -10.478 -4.095 6.918
18 2HE LYS 4 1HE LYS 4 -9.397 -4.990 5.851
19 1HZ LYS 4 1HZ LYS 4 -10.515 -6.366 7.573
20 2HZ LYS 4 2HZ LYS 4 -9.645 -5.524 8.762
21 3HZ LYS 4 3HZ LYS 4 -8.824 -6.459 7.609
22 H VAL 5 H VAL 5 -3.470 -3.769 4.617
23 HA VAL 5 HA VAL 5 -2.430 -3.207 7.316
24 HB VAL 5 HB VAL 5 -0.979 -4.079 5.096
25 1HG1 VAL 5 1HG1 VAL 5 -0.311 -1.200 5.551
26 2HG1 VAL 5 2HG1 VAL 5 -0.958 -1.900 4.067
27 3HG1 VAL 5 3HG1 VAL 5 0.654 -2.357 4.634
28 1HG2 VAL 5 1HG2 VAL 5 0.940 -3.714 6.585
29 2HG2 VAL 5 2HG2 VAL 5 -0.431 -4.498 7.372
30 3HG2 VAL 5 3HG2 VAL 5 -0.111 -2.786 7.652
31 H THR 6 H THR 6 -2.632 -1.233 8.199
32 HA THR 6 HA THR 6 -3.509 0.983 6.449
33 HB THR 6 HB THR 6 -4.623 1.716 8.777
34 HG1 THR 6 1HG THR 6 -5.593 -0.328 9.590
35 1HG2 THR 6 1HG2 THR 6 -5.812 -0.194 6.762
36 2HG2 THR 6 2HG2 THR 6 -5.777 1.566 6.645
37 3HG2 THR 6 3HG2 THR 6 -6.734 0.783 7.905
38 H LYS 7 H LYS 7 -3.117 3.233 7.392
39 HA LYS 7 HA LYS 7 -0.588 3.630 6.703
40 1HB LYS 7 2HB LYS 7 -2.190 5.431 6.973
41 2HB LYS 7 1HB LYS 7 -2.007 5.365 8.719
42 1HG LYS 7 2HG LYS 7 -0.765 7.224 7.647
43 2HG LYS 7 1HG LYS 7 0.260 6.133 8.580
44 1HD LYS 7 2HD LYS 7 1.095 5.093 6.614
45 2HD LYS 7 1HD LYS 7 -0.118 5.876 5.599
46 1HE LYS 7 2HE LYS 7 1.979 6.995 5.267
47 2HE LYS 7 1HE LYS 7 0.927 8.072 6.182
48 1HZ LYS 7 1HZ LYS 7 3.137 8.095 7.099
49 2HZ LYS 7 2HZ LYS 7 3.134 6.416 7.281
50 3HZ LYS 7 3HZ LYS 7 2.086 7.371 8.214
51 H ALA 8 H ALA 8 -1.328 3.324 10.220
52 HA ALA 8 HA ALA 8 1.080 3.850 11.387
53 1HB ALA 8 1HB ALA 8 -0.894 3.097 12.598
54 2HB ALA 8 2HB ALA 8 0.522 2.144 13.051
55 3HB ALA 8 3HB ALA 8 -0.678 1.473 11.943
56 H HIS 9 H HIS 9 0.223 1.068 9.517
57 HA HIS 9 HA HIS 9 2.249 -0.710 10.008
58 1HB HIS 9 2HB HIS 9 1.667 -1.706 7.891
59 2HB HIS 9 1HB HIS 9 0.201 -1.136 8.692
60 HD1 HIS 9 1HD HIS 9 -1.260 -0.185 6.954
61 HD2 HIS 9 2HD HIS 9 2.684 0.769 6.469
62 HE1 HIS 9 1HE HIS 9 -1.248 1.491 5.142
63 HE2 HIS 9 2HE HIS 9 1.181 1.875 4.631
64 H ASN 10 H ASN 10 2.673 2.362 8.717
65 HA ASN 10 HA ASN 10 4.407 1.949 6.542
66 1HB ASN 10 2HB ASN 10 3.239 4.107 7.236
67 2HB ASN 10 1HB ASN 10 4.492 4.315 8.459
68 1HD2 ASN 10 1HD2 ASN 10 6.625 3.345 6.685
69 2HD2 ASN 10 2HD2 ASN 10 6.873 4.602 5.517
70 H GLY 11 H GLY 11 4.728 1.522 9.877
71 1HA GLY 11 2HA GLY 11 7.481 0.565 9.451
72 2HA GLY 11 1HA GLY 11 7.074 1.455 10.918
73 H ALA 12 H ALA 12 5.706 -1.242 9.001
74 HA ALA 12 HA ALA 12 5.032 -2.517 11.545
75 1HB ALA 12 1HB ALA 12 2.999 -1.964 10.579
76 2HB ALA 12 2HB ALA 12 3.210 -3.685 10.247
77 3HB ALA 12 3HB ALA 12 3.522 -2.493 8.984
78 H THR 13 H THR 13 5.205 -4.762 11.769
79 HA THR 13 HA THR 13 6.121 -6.363 9.513
80 HB THR 13 HB THR 13 7.662 -6.385 12.122
81 HG1 THR 13 1HG THR 13 7.852 -4.723 9.994
82 1HG2 THR 13 1HG2 THR 13 9.263 -7.738 10.827
83 2HG2 THR 13 2HG2 THR 13 8.162 -7.705 9.450
84 3HG2 THR 13 3HG2 THR 13 7.686 -8.516 10.943
85 H LEU 14 H LEU 14 4.629 -7.956 9.482
86 HA LEU 14 HA LEU 14 3.900 -9.342 11.921
87 1HB LEU 14 2HB LEU 14 1.518 -8.934 11.740
88 2HB LEU 14 1HB LEU 14 2.382 -7.429 11.961
89 HG LEU 14 HG LEU 14 1.425 -8.377 9.260
90 1HD1 LEU 14 1HD1 LEU 14 -0.496 -8.149 10.743
91 2HD1 LEU 14 2HD1 LEU 14 -0.463 -6.847 9.556
92 3HD1 LEU 14 3HD1 LEU 14 0.047 -6.540 11.215
93 1HD2 LEU 14 1HD2 LEU 14 2.182 -5.632 10.266
94 2HD2 LEU 14 2HD2 LEU 14 1.709 -6.053 8.620
95 3HD2 LEU 14 3HD2 LEU 14 3.217 -6.677 9.294
96 H THR 15 H THR 15 2.325 -11.158 11.461
97 HA THR 15 HA THR 15 2.910 -12.298 8.808
98 HB THR 15 HB THR 15 2.016 -13.626 11.379
99 HG1 THR 15 1HG THR 15 4.338 -12.940 10.860
100 1HG2 THR 15 1HG2 THR 15 2.613 -14.935 8.722
101 2HG2 THR 15 2HG2 THR 15 0.986 -14.641 9.344
102 3HG2 THR 15 3HG2 THR 15 2.083 -15.732 10.205
103 H VAL 16 H VAL 16 1.256 -13.094 7.499
104 HA VAL 16 HA VAL 16 -1.489 -12.434 8.345
105 HB VAL 16 HB VAL 16 -2.010 -11.479 6.257
106 1HG1 VAL 16 1HG1 VAL 16 0.760 -10.601 7.067
107 2HG1 VAL 16 2HG1 VAL 16 -0.771 -9.988 7.694
108 3HG1 VAL 16 3HG1 VAL 16 -0.320 -9.684 6.016
109 1HG2 VAL 16 1HG2 VAL 16 -0.957 -13.042 4.768
110 2HG2 VAL 16 2HG2 VAL 16 0.645 -12.461 5.236
111 3HG2 VAL 16 3HG2 VAL 16 -0.459 -11.400 4.357
112 H ALA 17 H ALA 17 -3.148 -13.689 7.415
113 HA ALA 17 HA ALA 17 -2.285 -16.178 6.105
114 1HB ALA 17 1HB ALA 17 -4.855 -15.424 7.501
115 2HB ALA 17 2HB ALA 17 -3.629 -16.557 8.072
116 3HB ALA 17 3HB ALA 17 -4.598 -16.948 6.651
117 H VAL 18 H VAL 18 -3.008 -16.612 4.028
118 HA VAL 18 HA VAL 18 -4.501 -14.412 2.762
119 HB VAL 18 HB VAL 18 -3.351 -14.876 0.677
120 1HG1 VAL 18 1HG1 VAL 18 -2.306 -13.201 1.934
121 2HG1 VAL 18 2HG1 VAL 18 -0.997 -14.282 1.439
122 3HG1 VAL 18 3HG1 VAL 18 -1.635 -14.356 3.087
123 1HG2 VAL 18 1HG2 VAL 18 -2.966 -17.261 0.944
124 2HG2 VAL 18 2HG2 VAL 18 -1.797 -16.943 2.227
125 3HG2 VAL 18 3HG2 VAL 18 -1.457 -16.422 0.575
126 H GLY 19 H GLY 19 -5.249 -15.315 0.447
127 1HA GLY 19 2HA GLY 19 -6.178 -17.515 -0.437
128 2HA GLY 19 1HA GLY 19 -7.003 -17.587 1.116
129 H GLU 20 H GLU 20 -8.163 -15.386 1.619
130 HA GLU 20 HA GLU 20 -10.046 -14.888 -0.480
131 1HB GLU 20 2HB GLU 20 -9.619 -13.234 2.008
132 2HB GLU 20 1HB GLU 20 -11.071 -13.322 1.026
133 1HG GLU 20 2HG GLU 20 -11.469 -15.586 1.748
134 2HG GLU 20 1HG GLU 20 -9.953 -15.590 2.654
135 H LEU 21 H LEU 21 -8.081 -12.582 1.347
136 HA LEU 21 HA LEU 21 -6.960 -11.329 -0.955
137 1HB LEU 21 2HB LEU 21 -9.179 -10.452 -1.232
138 2HB LEU 21 1HB LEU 21 -9.280 -10.032 0.466
139 HG LEU 21 HG LEU 21 -7.522 -8.323 0.125
140 1HD1 LEU 21 1HD1 LEU 21 -7.819 -9.013 -2.793
141 2HD1 LEU 21 2HD1 LEU 21 -6.415 -9.382 -1.792
142 3HD1 LEU 21 3HD1 LEU 21 -6.848 -7.704 -2.119
143 1HD2 LEU 21 1HD2 LEU 21 -9.926 -8.101 -1.678
144 2HD2 LEU 21 2HD2 LEU 21 -8.921 -6.753 -1.151
145 3HD2 LEU 21 3HD2 LEU 21 -9.852 -7.672 0.031
146 H VAL 22 H VAL 22 -5.151 -10.300 -0.351
147 HA VAL 22 HA VAL 22 -4.986 -9.391 2.440
148 HB VAL 22 HB VAL 22 -3.011 -10.938 0.819
149 1HG1 VAL 22 1HG1 VAL 22 -2.279 -8.653 2.609
150 2HG1 VAL 22 2HG1 VAL 22 -1.598 -9.101 1.049
151 3HG1 VAL 22 3HG1 VAL 22 -1.231 -10.062 2.482
152 1HG2 VAL 22 1HG2 VAL 22 -3.685 -10.738 3.745
153 2HG2 VAL 22 2HG2 VAL 22 -2.524 -11.867 3.041
154 3HG2 VAL 22 3HG2 VAL 22 -4.234 -11.980 2.619
155 H GLU 23 H GLU 23 -5.001 -7.226 2.540
156 HA GLU 23 HA GLU 23 -4.072 -5.868 0.109
157 1HB GLU 23 2HB GLU 23 -5.714 -4.298 0.217
158 2HB GLU 23 1HB GLU 23 -6.554 -5.720 0.812
159 1HG GLU 23 2HG GLU 23 -6.389 -4.944 3.074
160 2HG GLU 23 1HG GLU 23 -5.366 -3.596 2.575
161 H ILE 24 H ILE 24 -3.235 -3.863 0.224
162 HA ILE 24 HA ILE 24 -1.937 -3.068 2.748
163 HB ILE 24 HB ILE 24 -0.848 -2.816 -0.060
164 1HG1 ILE 24 2HG1 ILE 24 -0.798 -5.151 0.719
165 2HG1 ILE 24 1HG1 ILE 24 0.823 -4.490 0.528
166 1HG2 ILE 24 1HG2 ILE 24 -0.195 -0.997 1.447
167 2HG2 ILE 24 2HG2 ILE 24 1.178 -1.988 0.949
168 3HG2 ILE 24 3HG2 ILE 24 0.488 -2.186 2.558
169 1HD1 ILE 24 1HD1 ILE 24 -0.664 -4.822 3.125
170 2HD1 ILE 24 2HD1 ILE 24 0.963 -4.164 2.943
171 3HD1 ILE 24 3HD1 ILE 24 0.640 -5.847 2.530
172 H GLN 25 H GLN 25 -3.208 -1.267 3.268
173 HA GLN 25 HA GLN 25 -3.885 0.445 0.983
174 1HB GLN 25 2HB GLN 25 -5.910 -0.448 1.728
175 2HB GLN 25 1HB GLN 25 -5.495 -0.225 3.428
176 1HG GLN 25 2HG GLN 25 -5.491 2.245 1.932
177 2HG GLN 25 1HG GLN 25 -7.052 1.424 1.867
178 1HE2 GLN 25 1HE2 GLN 25 -4.714 2.963 3.937
179 2HE2 GLN 25 2HE2 GLN 25 -5.738 3.115 5.319
180 H LEU 26 H LEU 26 -3.403 2.480 0.994
181 HA LEU 26 HA LEU 26 -2.362 3.640 3.472
182 1HB LEU 26 2HB LEU 26 -1.597 4.013 0.616
183 2HB LEU 26 1HB LEU 26 -1.433 5.371 1.710
184 HG LEU 26 HG LEU 26 0.675 4.213 1.494
185 1HD1 LEU 26 1HD1 LEU 26 -0.596 3.764 4.181
186 2HD1 LEU 26 2HD1 LEU 26 0.207 5.234 3.626
187 3HD1 LEU 26 3HD1 LEU 26 1.137 3.751 3.855
188 1HD2 LEU 26 1HD2 LEU 26 0.980 1.917 2.233
189 2HD2 LEU 26 2HD2 LEU 26 -0.183 1.993 0.906
190 3HD2 LEU 26 3HD2 LEU 26 -0.747 1.781 2.566
191 HA PRO 27 HA PRO 27 -5.822 6.385 3.207
192 1HB PRO 27 2HB PRO 27 -5.103 8.198 5.001
193 2HB PRO 27 1HB PRO 27 -5.414 6.529 5.503
194 1HG PRO 27 2HG PRO 27 -2.774 7.872 4.944
195 2HG PRO 27 1HG PRO 27 -3.243 6.848 6.326
196 1HD PRO 27 2HD PRO 27 -1.867 5.918 4.167
197 2HD PRO 27 1HD PRO 27 -2.953 4.907 5.142
198 H SER 28 H SER 28 -3.002 6.857 1.769
199 HA SER 28 HA SER 28 -2.037 8.360 0.406
200 1HB SER 28 2HB SER 28 -4.384 8.651 -0.486
201 2HB SER 28 1HB SER 28 -4.566 10.002 0.636
202 HG SER 28 HG SER 28 -2.671 9.777 -1.482
203 H ASN 29 H ASN 29 -3.967 10.204 2.693
204 HA ASN 29 HA ASN 29 -3.541 12.020 3.990
205 1HB ASN 29 2HB ASN 29 -0.594 11.482 3.958
206 2HB ASN 29 1HB ASN 29 -1.581 12.109 5.260
207 1HD2 ASN 29 1HD2 ASN 29 -0.150 9.406 3.847
208 2HD2 ASN 29 2HD2 ASN 29 -0.724 8.218 4.961
209 HA PRO 30 HA PRO 30 -2.282 13.691 -0.194
210 1HB PRO 30 2HB PRO 30 -4.422 15.608 0.631
211 2HB PRO 30 1HB PRO 30 -4.135 14.842 -0.940
212 1HG PRO 30 2HG PRO 30 -6.071 13.915 0.568
213 2HG PRO 30 1HG PRO 30 -4.957 12.768 -0.207
214 1HD PRO 30 2HD PRO 30 -4.971 13.741 2.630
215 2HD PRO 30 1HD PRO 30 -4.794 12.083 2.010
216 H THR 31 H THR 31 -0.379 14.629 0.023
217 HA THR 31 HA THR 31 -0.020 16.767 1.955
218 HB THR 31 HB THR 31 1.972 15.846 2.265
219 HG1 THR 31 1HG THR 31 3.534 16.515 0.971
220 1HG2 THR 31 1HG2 THR 31 1.511 14.155 -0.199
221 2HG2 THR 31 2HG2 THR 31 1.065 13.726 1.455
222 3HG2 THR 31 3HG2 THR 31 2.766 13.888 1.012
223 H THR 32 H THR 32 0.082 16.277 -1.549
224 HA THR 32 HA THR 32 -0.557 18.930 -2.119
225 HB THR 32 HB THR 32 1.666 19.509 -1.311
226 HG1 THR 32 1HG THR 32 1.337 20.926 -2.853
227 1HG2 THR 32 1HG2 THR 32 2.851 17.420 -1.707
228 2HG2 THR 32 2HG2 THR 32 3.698 18.761 -2.480
229 3HG2 THR 32 3HG2 THR 32 2.724 17.657 -3.450
230 H GLY 33 H GLY 33 1.240 16.122 -3.318
231 1HA GLY 33 2HA GLY 33 -0.374 15.976 -5.687
232 2HA GLY 33 1HA GLY 33 1.266 16.499 -6.021
233 H PHE 34 H PHE 34 2.546 14.979 -4.017
234 HA PHE 34 HA PHE 34 3.110 12.541 -4.944
235 1HB PHE 34 2HB PHE 34 2.658 13.028 -1.999
236 2HB PHE 34 1HB PHE 34 3.789 11.899 -2.740
237 HD1 PHE 34 1HD PHE 34 3.515 14.965 -1.160
238 HD2 PHE 34 2HD PHE 34 5.491 13.089 -4.423
239 HE1 PHE 34 1HE PHE 34 5.258 16.694 -1.094
240 HE2 PHE 34 2HE PHE 34 7.237 14.816 -4.365
241 HZ PHE 34 HZ PHE 34 7.121 16.620 -2.700
242 H ALA 35 H ALA 35 2.316 10.555 -4.980
243 HA ALA 35 HA ALA 35 -0.105 9.885 -3.489
244 1HB ALA 35 1HB ALA 35 -1.029 8.748 -5.470
245 2HB ALA 35 2HB ALA 35 0.313 9.357 -6.439
246 3HB ALA 35 3HB ALA 35 -0.853 10.482 -5.741
247 H TRP 36 H TRP 36 -0.241 7.595 -3.047
248 HA TRP 36 HA TRP 36 2.390 6.443 -2.767
249 1HB TRP 36 2HB TRP 36 -0.311 5.318 -1.986
250 2HB TRP 36 1HB TRP 36 1.245 4.580 -1.617
251 HD1 TRP 36 HD TRP 36 -1.089 7.365 -0.464
252 HE1 TRP 36 1HE TRP 36 -0.253 8.231 1.800
253 HE3 TRP 36 3HE TRP 36 3.413 4.970 -0.307
254 HZ2 TRP 36 2HZ TRP 36 1.995 7.913 3.464
255 HZ3 TRP 36 3HZ TRP 36 4.862 5.302 1.647
256 HH2 TRP 36 HH TRP 36 4.164 6.741 3.511
257 H TYR 37 H TYR 37 3.335 5.337 -4.311
258 HA TYR 37 HA TYR 37 1.932 3.098 -5.462
259 1HB TYR 37 2HB TYR 37 2.985 3.707 -7.760
260 2HB TYR 37 1HB TYR 37 1.452 4.423 -7.294
261 HD1 TYR 37 1HD TYR 37 4.893 5.405 -6.209
262 HD2 TYR 37 2HD TYR 37 1.446 6.409 -8.456
263 HE1 TYR 37 1HE TYR 37 5.785 7.649 -6.553
264 HE2 TYR 37 2HE TYR 37 2.333 8.650 -8.825
265 HH TYR 37 HH TYR 37 5.514 9.497 -8.151
266 H PHE 38 H PHE 38 3.330 1.407 -6.151
267 HA PHE 38 HA PHE 38 5.351 0.870 -4.401
268 1HB PHE 38 2HB PHE 38 4.455 -0.282 -6.916
269 2HB PHE 38 1HB PHE 38 6.177 -0.485 -6.631
270 HD1 PHE 38 1HD PHE 38 2.841 -1.526 -5.691
271 HD2 PHE 38 2HD PHE 38 6.955 -1.728 -4.633
272 HE1 PHE 38 1HE PHE 38 2.359 -3.411 -4.183
273 HE2 PHE 38 2HE PHE 38 6.485 -3.612 -3.127
274 HZ PHE 38 HZ PHE 38 4.195 -4.562 -3.031
275 H GLU 39 H GLU 39 6.173 1.257 -7.833
276 HA GLU 39 HA GLU 39 8.743 2.362 -6.957
277 1HB GLU 39 2HB GLU 39 8.012 1.057 -9.585
278 2HB GLU 39 1HB GLU 39 9.612 1.635 -9.140
279 1HG GLU 39 2HG GLU 39 9.551 0.024 -7.221
280 2HG GLU 39 1HG GLU 39 8.079 -0.642 -7.926
281 H GLY 40 H GLY 40 5.831 3.273 -8.309
282 1HA GLY 40 2HA GLY 40 5.623 5.731 -8.560
283 2HA GLY 40 1HA GLY 40 7.139 5.678 -9.448
284 H GLY 41 H GLY 41 3.734 4.989 -9.534
285 1HA GLY 41 2HA GLY 41 2.312 4.910 -11.360
286 2HA GLY 41 1HA GLY 41 3.705 5.109 -12.418
287 H THR 42 H THR 42 4.621 2.781 -10.408
288 HA THR 42 HA THR 42 3.502 0.586 -12.010
289 HB THR 42 HB THR 42 6.120 -0.087 -11.092
290 HG1 THR 42 1HG THR 42 6.260 2.112 -12.878
291 1HG2 THR 42 1HG2 THR 42 6.530 -0.507 -13.451
292 2HG2 THR 42 2HG2 THR 42 5.103 0.433 -13.889
293 3HG2 THR 42 3HG2 THR 42 4.925 -1.082 -13.002
294 H LYS 43 H LYS 43 2.932 -1.200 -10.887
295 HA LYS 43 HA LYS 43 3.832 -1.469 -8.125
296 1HB LYS 43 2HB LYS 43 1.770 -1.337 -7.145
297 2HB LYS 43 1HB LYS 43 1.499 -0.232 -8.464
298 1HG LYS 43 2HG LYS 43 0.705 -3.131 -8.539
299 2HG LYS 43 1HG LYS 43 -0.369 -1.814 -8.067
300 1HD LYS 43 2HD LYS 43 -0.088 -0.784 -10.264
301 2HD LYS 43 1HD LYS 43 1.018 -2.076 -10.738
302 1HE LYS 43 2HE LYS 43 -0.827 -3.702 -10.354
303 2HE LYS 43 1HE LYS 43 -1.909 -2.339 -10.067
304 1HZ LYS 43 1HZ LYS 43 -1.292 -1.539 -12.332
305 2HZ LYS 43 2HZ LYS 43 -2.159 -2.998 -12.315
306 3HZ LYS 43 3HZ LYS 43 -0.484 -3.011 -12.582
307 H GLU 44 H GLU 44 4.071 -3.599 -7.495
308 HA GLU 44 HA GLU 44 2.989 -5.671 -9.265
309 1HB GLU 44 2HB GLU 44 5.111 -6.829 -9.404
310 2HB GLU 44 1HB GLU 44 5.287 -5.194 -10.027
311 1HG GLU 44 2HG GLU 44 6.483 -4.485 -8.139
312 2HG GLU 44 1HG GLU 44 6.004 -5.902 -7.202
313 H SER 45 H SER 45 3.186 -7.855 -8.355
314 HA SER 45 HA SER 45 3.240 -7.839 -5.403
315 1HB SER 45 2HB SER 45 1.880 -10.051 -5.798
316 2HB SER 45 1HB SER 45 1.061 -8.496 -5.913
317 HG SER 45 HG SER 45 2.199 -9.436 -8.267
318 HA PRO 46 HA PRO 46 6.886 -10.167 -5.826
319 1HB PRO 46 2HB PRO 46 6.577 -11.283 -3.166
320 2HB PRO 46 1HB PRO 46 7.633 -9.975 -3.703
321 1HG PRO 46 2HG PRO 46 5.500 -9.579 -2.058
322 2HG PRO 46 1HG PRO 46 6.099 -8.346 -3.185
323 1HD PRO 46 2HD PRO 46 3.781 -10.229 -3.492
324 2HD PRO 46 1HD PRO 46 3.876 -8.496 -3.879
325 H ASN 47 H ASN 47 3.959 -11.757 -5.551
326 HA ASN 47 HA ASN 47 5.115 -14.271 -6.362
327 1HB ASN 47 2HB ASN 47 3.783 -15.549 -4.649
328 2HB ASN 47 1HB ASN 47 5.175 -14.682 -4.020
329 1HD2 ASN 47 1HD2 ASN 47 2.933 -15.646 -2.557
330 2HD2 ASN 47 2HD2 ASN 47 2.153 -14.286 -1.841
331 H GLU 48 H GLU 48 3.988 -13.227 -8.197
332 HA GLU 48 HA GLU 48 1.099 -13.719 -8.142
333 1HB GLU 48 2HB GLU 48 1.019 -12.127 -10.058
334 2HB GLU 48 1HB GLU 48 1.598 -11.430 -8.552
335 1HG GLU 48 2HG GLU 48 3.902 -11.608 -9.360
336 2HG GLU 48 1HG GLU 48 3.305 -12.263 -10.885
337 H SER 49 H SER 49 1.163 -13.410 -11.141
338 HA SER 49 HA SER 49 1.154 -14.706 -12.993
339 1HB SER 49 2HB SER 49 3.220 -16.404 -11.581
340 2HB SER 49 1HB SER 49 2.841 -16.439 -13.303
341 HG SER 49 HG SER 49 4.645 -14.972 -12.184
342 H MET 50 H MET 50 -0.667 -15.058 -10.915
343 HA MET 50 HA MET 50 -2.183 -17.171 -11.815
344 1HB MET 50 2HB MET 50 -2.141 -18.802 -10.031
345 2HB MET 50 1HB MET 50 -0.555 -18.656 -10.759
346 1HG MET 50 2HG MET 50 0.181 -17.281 -8.868
347 2HG MET 50 1HG MET 50 -1.419 -17.437 -8.144
348 1HE MET 50 1HE MET 50 0.648 -19.641 -5.734
349 2HE MET 50 2HE MET 50 -0.520 -18.328 -5.891
350 3HE MET 50 3HE MET 50 1.129 -18.116 -6.480
351 H PHE 51 H PHE 51 -1.170 -15.327 -9.092
352 HA PHE 51 HA PHE 51 -3.876 -14.280 -8.731
353 1HB PHE 51 2HB PHE 51 -1.964 -15.393 -6.713
354 2HB PHE 51 1HB PHE 51 -2.931 -13.999 -6.237
355 HD1 PHE 51 1HD PHE 51 -3.261 -17.408 -7.713
356 HD2 PHE 51 2HD PHE 51 -5.075 -14.314 -5.407
357 HE1 PHE 51 1HE PHE 51 -5.166 -18.887 -7.228
358 HE2 PHE 51 2HE PHE 51 -6.979 -15.796 -4.920
359 HZ PHE 51 HZ PHE 51 -7.022 -18.084 -5.828
360 H THR 52 H THR 52 -3.573 -11.939 -7.593
361 HA THR 52 HA THR 52 -1.184 -10.711 -8.677
362 HB THR 52 HB THR 52 -2.664 -11.183 -10.650
363 HG1 THR 52 1HG THR 52 -2.008 -9.354 -11.582
364 1HG2 THR 52 1HG2 THR 52 -4.834 -10.775 -9.621
365 2HG2 THR 52 2HG2 THR 52 -4.599 -9.708 -11.006
366 3HG2 THR 52 3HG2 THR 52 -4.414 -9.081 -9.370
367 H VAL 53 H VAL 53 -1.243 -8.338 -8.571
368 HA VAL 53 HA VAL 53 -2.657 -7.435 -6.171
369 HB VAL 53 HB VAL 53 -0.252 -7.214 -6.013
370 1HG1 VAL 53 1HG1 VAL 53 -0.409 -5.583 -8.543
371 2HG1 VAL 53 2HG1 VAL 53 0.279 -7.199 -8.389
372 3HG1 VAL 53 3HG1 VAL 53 1.038 -5.835 -7.565
373 1HG2 VAL 53 1HG2 VAL 53 -1.552 -5.426 -4.989
374 2HG2 VAL 53 2HG2 VAL 53 -1.531 -4.524 -6.507
375 3HG2 VAL 53 3HG2 VAL 53 -0.029 -4.799 -5.624
376 H GLU 54 H GLU 54 -4.127 -5.921 -6.276
377 HA GLU 54 HA GLU 54 -4.573 -4.405 -8.755
378 1HB GLU 54 2HB GLU 54 -6.487 -5.699 -7.815
379 2HB GLU 54 1HB GLU 54 -6.331 -4.783 -6.327
380 1HG GLU 54 2HG GLU 54 -6.749 -2.710 -7.717
381 2HG GLU 54 1HG GLU 54 -7.236 -3.810 -9.008
382 H ASN 55 H ASN 55 -4.902 -2.162 -8.578
383 HA ASN 55 HA ASN 55 -4.079 -0.929 -6.055
384 1HB ASN 55 2HB ASN 55 -2.762 0.762 -7.249
385 2HB ASN 55 1HB ASN 55 -2.090 -0.852 -7.438
386 1HD2 ASN 55 1HD2 ASN 55 -1.796 1.577 -9.069
387 2HD2 ASN 55 2HD2 ASN 55 -2.277 1.126 -10.673
388 H LYS 56 H LYS 56 -5.570 0.476 -5.393
389 HA LYS 56 HA LYS 56 -6.909 2.068 -7.430
390 1HB LYS 56 2HB LYS 56 -9.076 1.553 -6.885
391 2HB LYS 56 1HB LYS 56 -8.305 0.001 -6.640
392 1HG LYS 56 2HG LYS 56 -8.585 1.778 -4.289
393 2HG LYS 56 1HG LYS 56 -10.032 1.016 -4.933
394 1HD LYS 56 2HD LYS 56 -8.538 -1.141 -4.846
395 2HD LYS 56 1HD LYS 56 -7.637 -0.204 -3.646
396 1HE LYS 56 2HE LYS 56 -9.264 -1.459 -2.487
397 2HE LYS 56 1HE LYS 56 -9.779 0.224 -2.468
398 1HZ LYS 56 1HZ LYS 56 -11.689 -1.032 -2.962
399 2HZ LYS 56 2HZ LYS 56 -10.880 -2.001 -4.090
400 3HZ LYS 56 3HZ LYS 56 -11.206 -0.378 -4.453
401 H TYR 57 H TYR 57 -6.510 4.066 -7.008
402 HA TYR 57 HA TYR 57 -6.019 4.878 -4.232
403 1HB TYR 57 2HB TYR 57 -5.296 6.577 -6.537
404 2HB TYR 57 1HB TYR 57 -4.533 6.468 -4.970
405 HD1 TYR 57 1HD TYR 57 -4.203 5.645 -8.386
406 HD2 TYR 57 2HD TYR 57 -3.351 4.180 -4.481
407 HE1 TYR 57 1HE TYR 57 -2.487 4.151 -9.320
408 HE2 TYR 57 2HE TYR 57 -1.627 2.695 -5.404
409 HH TYR 57 HH TYR 57 -1.140 1.598 -7.594
410 H PHE 58 H PHE 58 -7.533 6.089 -3.278
411 HA PHE 58 HA PHE 58 -9.145 7.837 -5.006
412 1HB PHE 58 2HB PHE 58 -9.933 6.412 -2.467
413 2HB PHE 58 1HB PHE 58 -10.909 7.667 -3.224
414 HD1 PHE 58 1HD PHE 58 -9.798 4.210 -3.396
415 HD2 PHE 58 2HD PHE 58 -12.010 7.263 -5.373
416 HE1 PHE 58 1HE PHE 58 -10.840 2.516 -4.842
417 HE2 PHE 58 2HE PHE 58 -13.052 5.570 -6.823
418 HZ PHE 58 HZ PHE 58 -12.490 3.210 -6.564
419 HA PRO 59 HA PRO 59 -7.281 10.908 -2.274
420 1HB PRO 59 2HB PRO 59 -7.053 12.634 -4.523
421 2HB PRO 59 1HB PRO 59 -5.758 11.730 -3.739
422 1HG PRO 59 2HG PRO 59 -6.675 11.285 -6.315
423 2HG PRO 59 1HG PRO 59 -5.767 10.116 -5.337
424 1HD PRO 59 2HD PRO 59 -8.727 10.311 -5.790
425 2HD PRO 59 1HD PRO 59 -7.689 8.869 -5.718
426 HA PRO 60 HA PRO 60 -11.222 12.970 -1.766
427 1HB PRO 60 2HB PRO 60 -9.608 14.732 -0.041
428 2HB PRO 60 1HB PRO 60 -11.038 13.772 0.347
429 1HG PRO 60 2HG PRO 60 -8.646 13.039 1.235
430 2HG PRO 60 1HG PRO 60 -9.808 11.825 0.659
431 1HD PRO 60 2HD PRO 60 -7.439 13.000 -0.753
432 2HD PRO 60 1HD PRO 60 -7.967 11.303 -0.667
433 H ASP 61 H ASP 61 -8.374 15.085 -1.744
434 HA ASP 61 HA ASP 61 -9.527 16.775 -3.821
435 1HB ASP 61 2HB ASP 61 -8.807 17.813 -1.070
436 2HB ASP 61 1HB ASP 61 -9.179 18.825 -2.459
437 H SER 62 H SER 62 -6.990 16.415 -1.419
438 HA SER 62 HA SER 62 -4.757 16.265 -1.579
439 1HB SER 62 2HB SER 62 -4.984 15.347 -3.895
440 2HB SER 62 1HB SER 62 -4.962 16.996 -4.514
441 HG SER 62 HG SER 62 -2.867 17.209 -3.540
442 H LYS 63 H LYS 63 -6.506 19.017 -2.806
443 HA LYS 63 HA LYS 63 -4.491 20.889 -2.000
444 1HB LYS 63 2HB LYS 63 -6.281 22.574 -2.091
445 2HB LYS 63 1HB LYS 63 -6.268 21.588 -3.539
446 1HG LYS 63 2HG LYS 63 -8.524 21.824 -3.066
447 2HG LYS 63 1HG LYS 63 -8.143 20.243 -2.388
448 1HD LYS 63 2HD LYS 63 -8.352 20.969 -0.219
449 2HD LYS 63 1HD LYS 63 -7.915 22.632 -0.624
450 1HE LYS 63 2HE LYS 63 -10.247 22.529 0.006
451 2HE LYS 63 1HE LYS 63 -10.109 22.921 -1.706
452 1HZ LYS 63 1HZ LYS 63 -10.650 20.195 -0.664
453 2HZ LYS 63 2HZ LYS 63 -10.710 20.697 -2.282
454 3HZ LYS 63 3HZ LYS 63 -11.853 21.271 -1.168
455 H LEU 64 H LEU 64 -6.675 18.835 -0.524
456 HA LEU 64 HA LEU 64 -5.715 19.377 2.098
457 1HB LEU 64 2HB LEU 64 -7.642 21.083 1.613
458 2HB LEU 64 1HB LEU 64 -8.682 19.675 1.758
459 HG LEU 64 HG LEU 64 -7.849 19.314 4.055
460 1HD1 LEU 64 1HD1 LEU 64 -6.460 21.958 3.660
461 2HD1 LEU 64 2HD1 LEU 64 -5.665 20.390 3.802
462 3HD1 LEU 64 3HD1 LEU 64 -6.566 21.047 5.169
463 1HD2 LEU 64 1HD2 LEU 64 -9.050 21.186 5.062
464 2HD2 LEU 64 2HD2 LEU 64 -9.911 20.552 3.660
465 3HD2 LEU 64 3HD2 LEU 64 -8.994 22.052 3.527
466 H LEU 65 H LEU 65 -7.983 18.148 3.346
467 HA LEU 65 HA LEU 65 -7.765 15.451 2.245
468 1HB LEU 65 2HB LEU 65 -7.348 16.470 4.878
469 2HB LEU 65 1HB LEU 65 -8.753 15.421 4.920
470 HG LEU 65 HG LEU 65 -6.043 14.605 3.860
471 1HD1 LEU 65 1HD1 LEU 65 -5.865 13.285 5.916
472 2HD1 LEU 65 2HD1 LEU 65 -7.362 14.008 6.505
473 3HD1 LEU 65 3HD1 LEU 65 -5.938 15.016 6.249
474 1HD2 LEU 65 1HD2 LEU 65 -6.951 12.355 3.893
475 2HD2 LEU 65 2HD2 LEU 65 -7.935 13.393 2.864
476 3HD2 LEU 65 3HD2 LEU 65 -8.499 12.965 4.478
477 H GLY 66 H GLY 66 -9.640 14.084 2.736
478 1HA GLY 66 2HA GLY 66 -12.201 15.527 2.679
479 2HA GLY 66 1HA GLY 66 -11.816 14.369 1.424
480 H ALA 67 H ALA 67 -10.838 13.991 4.730
481 HA ALA 67 HA ALA 67 -11.108 12.326 6.237
482 1HB ALA 67 1HB ALA 67 -13.475 12.984 6.256
483 2HB ALA 67 2HB ALA 67 -13.266 11.248 6.498
484 3HB ALA 67 3HB ALA 67 -13.786 11.864 4.929
485 H GLY 68 H GLY 68 -12.662 11.092 3.279
486 1HA GLY 68 2HA GLY 68 -11.456 8.498 3.746
487 2HA GLY 68 1HA GLY 68 -12.623 8.903 2.500
488 H GLY 69 H GLY 69 -9.289 9.984 3.317
489 1HA GLY 69 2HA GLY 69 -8.500 9.753 0.540
490 2HA GLY 69 1HA GLY 69 -7.434 10.080 1.909
491 H THR 70 H THR 70 -7.831 7.869 -0.422
492 HA THR 70 HA THR 70 -6.993 5.654 1.233
493 HB THR 70 HB THR 70 -9.012 4.357 -0.003
494 HG1 THR 70 1HG THR 70 -9.729 7.050 0.235
495 1HG2 THR 70 1HG2 THR 70 -9.245 5.797 2.650
496 2HG2 THR 70 2HG2 THR 70 -8.359 4.293 2.396
497 3HG2 THR 70 3HG2 THR 70 -10.111 4.334 2.169
498 H GLU 71 H GLU 71 -5.177 5.561 -0.050
499 HA GLU 71 HA GLU 71 -5.583 4.623 -2.811
500 1HB GLU 71 2HB GLU 71 -3.024 5.496 -1.442
501 2HB GLU 71 1HB GLU 71 -3.195 5.057 -3.135
502 1HG GLU 71 2HG GLU 71 -4.790 6.963 -3.385
503 2HG GLU 71 1HG GLU 71 -4.365 7.450 -1.743
504 H HIS 72 H HIS 72 -5.783 2.440 -2.875
505 HA HIS 72 HA HIS 72 -4.426 0.909 -0.744
506 1HB HIS 72 2HB HIS 72 -6.696 -0.051 -2.452
507 2HB HIS 72 1HB HIS 72 -6.030 -0.830 -1.046
508 HD1 HIS 72 1HD HIS 72 -7.937 -0.918 0.482
509 HD2 HIS 72 2HD HIS 72 -7.445 2.868 -1.152
510 HE1 HIS 72 1HE HIS 72 -9.824 0.452 1.361
511 HE2 HIS 72 2HE HIS 72 -9.615 2.685 0.261
512 H PHE 73 H PHE 73 -3.372 -0.948 -1.192
513 HA PHE 73 HA PHE 73 -3.083 -1.767 -4.000
514 1HB PHE 73 2HB PHE 73 -1.091 -1.734 -1.738
515 2HB PHE 73 1HB PHE 73 -0.856 -2.745 -3.163
516 HD1 PHE 73 1HD PHE 73 0.239 -1.870 -5.001
517 HD2 PHE 73 2HD PHE 73 -1.519 0.776 -2.170
518 HE1 PHE 73 1HE PHE 73 1.222 0.048 -6.189
519 HE2 PHE 73 2HE PHE 73 -0.536 2.698 -3.348
520 HZ PHE 73 HZ PHE 73 0.852 2.329 -5.355
521 H HIS 74 H HIS 74 -4.258 -3.536 -4.262
522 HA HIS 74 HA HIS 74 -4.770 -5.243 -1.915
523 1HB HIS 74 2HB HIS 74 -6.317 -4.668 -4.434
524 2HB HIS 74 1HB HIS 74 -6.648 -6.108 -3.485
525 HD1 HIS 74 1HD HIS 74 -9.056 -5.045 -3.223
526 HD2 HIS 74 2HD HIS 74 -5.969 -2.996 -1.316
527 HE1 HIS 74 1HE HIS 74 -10.165 -3.492 -1.591
528 HE2 HIS 74 2HE HIS 74 -8.262 -2.615 -0.192
529 H VAL 75 H VAL 75 -3.362 -6.946 -1.908
530 HA VAL 75 HA VAL 75 -2.817 -8.119 -4.531
531 HB VAL 75 HB VAL 75 -0.829 -9.107 -3.715
532 1HG1 VAL 75 1HG1 VAL 75 -0.598 -6.733 -4.125
533 2HG1 VAL 75 2HG1 VAL 75 0.456 -7.239 -2.802
534 3HG1 VAL 75 3HG1 VAL 75 -1.046 -6.382 -2.455
535 1HG2 VAL 75 1HG2 VAL 75 -1.598 -9.998 -1.635
536 2HG2 VAL 75 2HG2 VAL 75 -1.730 -8.376 -0.946
537 3HG2 VAL 75 3HG2 VAL 75 -0.141 -9.038 -1.351
538 H THR 76 H THR 76 -4.029 -9.683 -5.046
539 HA THR 76 HA THR 76 -5.298 -11.327 -2.981
540 HB THR 76 HB THR 76 -5.931 -11.250 -5.945
541 HG1 THR 76 1HG THR 76 -7.646 -9.810 -5.327
542 1HG2 THR 76 1HG2 THR 76 -8.087 -12.175 -5.230
543 2HG2 THR 76 2HG2 THR 76 -7.533 -12.172 -3.557
544 3HG2 THR 76 3HG2 THR 76 -6.748 -13.213 -4.742
545 H VAL 77 H VAL 77 -3.952 -12.928 -2.516
546 HA VAL 77 HA VAL 77 -2.960 -14.649 -4.615
547 HB VAL 77 HB VAL 77 -1.195 -13.029 -4.617
548 1HG1 VAL 77 1HG1 VAL 77 0.046 -12.402 -2.593
549 2HG1 VAL 77 2HG1 VAL 77 -1.075 -13.357 -1.620
550 3HG1 VAL 77 3HG1 VAL 77 -1.652 -11.939 -2.495
551 1HG2 VAL 77 1HG2 VAL 77 -0.317 -15.399 -2.961
552 2HG2 VAL 77 2HG2 VAL 77 0.733 -14.353 -3.920
553 3HG2 VAL 77 3HG2 VAL 77 -0.469 -15.364 -4.720
554 H LYS 78 H LYS 78 -2.532 -16.704 -3.907
555 HA LYS 78 HA LYS 78 -2.203 -17.062 -1.035
556 1HB LYS 78 2HB LYS 78 -3.182 -19.477 -1.606
557 2HB LYS 78 1HB LYS 78 -4.191 -18.138 -1.096
558 1HG LYS 78 2HG LYS 78 -5.320 -19.136 -2.888
559 2HG LYS 78 1HG LYS 78 -4.590 -17.679 -3.553
560 1HD LYS 78 2HD LYS 78 -4.370 -19.591 -5.067
561 2HD LYS 78 1HD LYS 78 -2.799 -18.995 -4.538
562 1HE LYS 78 2HE LYS 78 -2.816 -21.415 -4.515
563 2HE LYS 78 1HE LYS 78 -2.701 -20.804 -2.868
564 1HZ LYS 78 1HZ LYS 78 -4.979 -21.312 -2.486
565 2HZ LYS 78 2HZ LYS 78 -4.266 -22.687 -3.179
566 3HZ LYS 78 3HZ LYS 78 -5.246 -21.676 -4.124
567 H ALA 79 H ALA 79 -0.100 -17.329 -0.884
568 HA ALA 79 HA ALA 79 1.143 -19.650 -1.951
569 1HB ALA 79 1HB ALA 79 2.053 -16.986 -3.042
570 2HB ALA 79 2HB ALA 79 1.271 -18.273 -3.961
571 3HB ALA 79 3HB ALA 79 2.877 -18.528 -3.279
572 H ALA 80 H ALA 80 2.978 -20.167 -0.822
573 HA ALA 80 HA ALA 80 3.304 -18.776 1.658
574 1HB ALA 80 1HB ALA 80 4.884 -21.074 0.515
575 2HB ALA 80 2HB ALA 80 3.440 -21.204 1.521
576 3HB ALA 80 3HB ALA 80 4.920 -20.514 2.188
577 H GLY 81 H GLY 81 4.114 -16.788 1.359
578 1HA GLY 81 2HA GLY 81 6.958 -16.598 0.846
579 2HA GLY 81 1HA GLY 81 5.943 -15.753 -0.318
580 H THR 82 H THR 82 7.724 -14.323 1.222
581 HA THR 82 HA THR 82 5.975 -13.096 3.248
582 HB THR 82 HB THR 82 8.880 -12.396 2.832
583 HG1 THR 82 1HG THR 82 8.124 -14.797 3.404
584 1HG2 THR 82 1HG2 THR 82 8.688 -11.820 5.242
585 2HG2 THR 82 2HG2 THR 82 6.974 -12.248 5.176
586 3HG2 THR 82 3HG2 THR 82 7.584 -10.887 4.230
587 H HIS 83 H HIS 83 5.269 -11.020 2.991
588 HA HIS 83 HA HIS 83 5.679 -9.925 0.298
589 1HB HIS 83 2HB HIS 83 3.315 -10.571 1.237
590 2HB HIS 83 1HB HIS 83 3.467 -9.096 2.172
591 HD1 HIS 83 1HD HIS 83 4.209 -6.947 0.484
592 HD2 HIS 83 2HD HIS 83 2.002 -10.099 -1.077
593 HE1 HIS 83 1HE HIS 83 3.106 -6.027 -1.574
594 HE2 HIS 83 2HE HIS 83 1.626 -7.902 -2.395
595 H ALA 84 H ALA 84 7.312 -8.506 0.397
596 HA ALA 84 HA ALA 84 7.397 -6.622 2.640
597 1HB ALA 84 1HB ALA 84 9.487 -7.792 2.155
598 2HB ALA 84 2HB ALA 84 9.653 -6.066 1.837
599 3HB ALA 84 3HB ALA 84 9.448 -7.193 0.497
600 H VAL 85 H VAL 85 6.232 -4.866 2.312
601 HA VAL 85 HA VAL 85 5.755 -4.033 -0.466
602 HB VAL 85 HB VAL 85 4.109 -2.895 1.695
603 1HG1 VAL 85 1HG1 VAL 85 2.325 -3.259 0.059
604 2HG1 VAL 85 2HG1 VAL 85 3.461 -4.118 -0.984
605 3HG1 VAL 85 3HG1 VAL 85 3.696 -2.401 -0.652
606 1HG2 VAL 85 1HG2 VAL 85 4.304 -5.147 2.538
607 2HG2 VAL 85 2HG2 VAL 85 3.892 -5.804 0.951
608 3HG2 VAL 85 3HG2 VAL 85 2.689 -4.896 1.868
609 H ASN 86 H ASN 86 7.083 -2.457 -1.021
610 HA ASN 86 HA ASN 86 7.407 -0.164 0.808
611 1HB ASN 86 2HB ASN 86 9.210 -1.212 -1.388
612 2HB ASN 86 1HB ASN 86 9.383 0.404 -0.722
613 1HD2 ASN 86 1HD2 ASN 86 8.474 -2.362 1.214
614 2HD2 ASN 86 2HD2 ASN 86 9.948 -2.447 2.113
615 H LEU 87 H LEU 87 5.861 1.243 0.269
616 HA LEU 87 HA LEU 87 5.283 1.665 -2.594
617 1HB LEU 87 2HB LEU 87 3.637 2.439 -0.179
618 2HB LEU 87 1HB LEU 87 3.190 2.714 -1.851
619 HG LEU 87 HG LEU 87 3.578 -0.024 -0.636
620 1HD1 LEU 87 1HD1 LEU 87 1.062 1.556 -1.146
621 2HD1 LEU 87 2HD1 LEU 87 1.710 1.071 0.428
622 3HD1 LEU 87 3HD1 LEU 87 1.121 -0.153 -0.704
623 1HD2 LEU 87 1HD2 LEU 87 3.948 0.120 -3.048
624 2HD2 LEU 87 2HD2 LEU 87 2.351 0.849 -3.242
625 3HD2 LEU 87 3HD2 LEU 87 2.500 -0.806 -2.647
626 H THR 88 H THR 88 5.698 3.613 -3.482
627 HA THR 88 HA THR 88 7.154 5.444 -1.726
628 HB THR 88 HB THR 88 7.277 5.314 -4.745
629 HG1 THR 88 1HG THR 88 8.132 3.407 -4.356
630 1HG2 THR 88 1HG2 THR 88 8.197 7.343 -3.706
631 2HG2 THR 88 2HG2 THR 88 9.487 6.345 -4.381
632 3HG2 THR 88 3HG2 THR 88 9.194 6.351 -2.640
633 H TYR 89 H TYR 89 6.329 7.332 -1.272
634 HA TYR 89 HA TYR 89 3.803 8.136 -2.489
635 1HB TYR 89 2HB TYR 89 4.300 7.959 0.049
636 2HB TYR 89 1HB TYR 89 5.211 9.450 -0.158
637 HD1 TYR 89 1HD TYR 89 2.351 9.187 -2.286
638 HD2 TYR 89 2HD TYR 89 3.631 10.311 1.603
639 HE1 TYR 89 1HE TYR 89 0.291 10.490 -1.988
640 HE2 TYR 89 2HE TYR 89 1.575 11.613 1.911
641 HH TYR 89 HH TYR 89 -0.939 11.700 -0.579
642 H MET 90 H MET 90 4.566 8.967 -4.503
643 HA MET 90 HA MET 90 6.166 11.448 -4.242
644 1HB MET 90 2HB MET 90 6.434 9.896 -6.754
645 2HB MET 90 1HB MET 90 7.576 10.961 -5.963
646 1HG MET 90 2HG MET 90 8.146 9.270 -4.365
647 2HG MET 90 1HG MET 90 6.932 8.180 -5.041
648 1HE MET 90 1HE MET 90 7.181 8.730 -8.159
649 2HE MET 90 2HE MET 90 7.095 7.092 -7.494
650 3HE MET 90 3HE MET 90 8.369 7.512 -8.643
651 H ARG 91 H ARG 91 6.057 12.734 -6.294
652 HA ARG 91 HA ARG 91 3.324 12.921 -7.199
653 1HB ARG 91 2HB ARG 91 5.711 14.630 -7.123
654 2HB ARG 91 1HB ARG 91 4.894 14.691 -8.680
655 1HG ARG 91 2HG ARG 91 2.830 15.381 -7.622
656 2HG ARG 91 1HG ARG 91 3.555 15.178 -6.027
657 1HD ARG 91 2HD ARG 91 4.650 17.082 -8.084
658 2HD ARG 91 1HD ARG 91 3.420 17.547 -6.911
659 HE ARG 91 HE ARG 91 5.844 16.378 -5.824
660 1HH1 ARG 91 1HH1 ARG 91 4.101 19.290 -6.649
661 2HH1 ARG 91 2HH1 ARG 91 4.979 20.295 -5.530
662 1HH2 ARG 91 1HH2 ARG 91 7.022 17.704 -4.340
663 2HH2 ARG 91 2HH2 ARG 91 6.636 19.391 -4.226
664 HA PRO 92 HA PRO 92 3.970 9.647 -10.039
665 1HB PRO 92 2HB PRO 92 1.966 10.680 -11.823
666 2HB PRO 92 1HB PRO 92 1.816 9.372 -10.650
667 1HG PRO 92 2HG PRO 92 1.054 12.226 -10.406
668 2HG PRO 92 1HG PRO 92 0.390 10.804 -9.583
669 1HD PRO 92 2HD PRO 92 1.929 12.583 -8.312
670 2HD PRO 92 1HD PRO 92 2.026 10.847 -7.942
671 H TRP 93 H TRP 93 3.890 12.958 -11.319
672 HA TRP 93 HA TRP 93 5.019 12.085 -13.841
673 1HB TRP 93 2HB TRP 93 4.920 14.556 -14.384
674 2HB TRP 93 1HB TRP 93 3.377 13.780 -14.048
675 HD1 TRP 93 HD TRP 93 5.754 16.426 -12.683
676 HE1 TRP 93 1HE TRP 93 4.574 17.716 -10.790
677 HE3 TRP 93 3HE TRP 93 1.586 13.509 -12.203
678 HZ2 TRP 93 2HZ TRP 93 2.179 17.517 -9.300
679 HZ3 TRP 93 3HZ TRP 93 -0.097 14.122 -10.522
680 HH2 TRP 93 HH TRP 93 0.192 16.088 -9.100
681 H THR 94 H THR 94 6.408 12.513 -10.933
682 HA THR 94 HA THR 94 9.004 12.710 -12.036
683 HB THR 94 HB THR 94 8.580 15.060 -12.253
684 HG1 THR 94 1HG THR 94 10.655 14.578 -11.550
685 1HG2 THR 94 1HG2 THR 94 6.758 15.355 -10.684
686 2HG2 THR 94 2HG2 THR 94 8.050 16.501 -10.327
687 3HG2 THR 94 3HG2 THR 94 7.847 15.064 -9.325
688 H GLY 95 H GLY 95 7.334 13.526 -8.971
689 1HA GLY 95 2HA GLY 95 7.634 12.745 -6.824
690 2HA GLY 95 1HA GLY 95 8.377 11.314 -7.553
691 HA PRO 96 HA PRO 96 11.685 15.006 -6.939
692 1HB PRO 96 2HB PRO 96 10.392 15.780 -4.364
693 2HB PRO 96 1HB PRO 96 11.263 16.776 -5.528
694 1HG PRO 96 2HG PRO 96 8.619 16.859 -5.406
695 2HG PRO 96 1HG PRO 96 9.464 16.932 -6.964
696 1HD PRO 96 2HD PRO 96 7.962 14.687 -5.724
697 2HD PRO 96 1HD PRO 96 8.146 15.121 -7.434
698 H SER 97 H SER 97 13.421 13.992 -6.313
699 HA SER 97 HA SER 97 13.418 11.534 -5.119
700 1HB SER 97 2HB SER 97 15.219 12.462 -6.552
701 2HB SER 97 1HB SER 97 15.760 13.443 -5.190
702 HG SER 97 HG SER 97 15.495 10.633 -4.965
703 H HIS 98 H HIS 98 13.983 14.645 -3.481
704 HA HIS 98 HA HIS 98 14.206 13.105 -0.975
705 1HB HIS 98 2HB HIS 98 15.493 14.900 -0.015
706 2HB HIS 98 1HB HIS 98 16.231 14.421 -1.536
707 HD1 HIS 98 1HD HIS 98 16.526 16.201 -3.295
708 HD2 HIS 98 2HD HIS 98 14.164 17.456 -0.104
709 HE1 HIS 98 1HE HIS 98 16.211 18.679 -3.609
710 HE2 HIS 98 2HE HIS 98 14.725 19.411 -1.703
711 H ASP 99 H ASP 99 11.802 14.218 -2.502
712 HA ASP 99 HA ASP 99 10.729 15.834 -0.269
713 1HB ASP 99 2HB ASP 99 11.164 17.064 -2.443
714 2HB ASP 99 1HB ASP 99 9.923 16.059 -3.174
715 H SER 100 H SER 100 10.685 12.939 -1.688
716 HA SER 100 HA SER 100 7.803 12.480 -1.573
717 1HB SER 100 2HB SER 100 8.518 10.225 -2.537
718 2HB SER 100 1HB SER 100 8.804 11.633 -3.564
719 HG SER 100 HG SER 100 10.702 10.566 -3.615
720 H GLU 101 H GLU 101 6.964 10.698 -0.363
721 HA GLU 101 HA GLU 101 8.631 9.855 1.916
722 1HB GLU 101 2HB GLU 101 6.507 11.115 2.420
723 2HB GLU 101 1HB GLU 101 5.605 9.805 1.675
724 1HG GLU 101 2HG GLU 101 6.334 8.269 3.371
725 2HG GLU 101 1HG GLU 101 7.405 9.484 4.066
726 H ARG 102 H ARG 102 7.796 7.511 2.689
727 HA ARG 102 HA ARG 102 6.856 5.836 0.560
728 1HB ARG 102 2HB ARG 102 9.350 6.147 0.096
729 2HB ARG 102 1HB ARG 102 9.652 5.273 1.590
730 1HG ARG 102 2HG ARG 102 8.645 3.289 0.722
731 2HG ARG 102 1HG ARG 102 8.060 4.146 -0.704
732 1HD ARG 102 2HD ARG 102 10.544 4.642 -1.163
733 2HD ARG 102 1HD ARG 102 10.868 3.362 0.006
734 HE ARG 102 HE ARG 102 9.031 2.574 -2.074
735 1HH1 ARG 102 1HH1 ARG 102 12.418 2.931 -1.253
736 2HH1 ARG 102 2HH1 ARG 102 12.950 1.724 -2.390
737 1HH2 ARG 102 1HH2 ARG 102 9.736 1.034 -3.599
738 2HH2 ARG 102 2HH2 ARG 102 11.428 0.682 -3.752
739 H PHE 103 H PHE 103 6.133 3.934 1.215
740 HA PHE 103 HA PHE 103 5.872 3.584 4.115
741 1HB PHE 103 2HB PHE 103 3.685 3.507 3.548
742 2HB PHE 103 1HB PHE 103 4.072 3.410 1.835
743 HD1 PHE 103 1HD PHE 103 2.950 1.625 4.724
744 HD2 PHE 103 2HD PHE 103 4.581 1.207 0.845
745 HE1 PHE 103 1HE PHE 103 2.170 -0.693 4.665
746 HE2 PHE 103 2HE PHE 103 3.812 -1.128 0.773
747 HZ PHE 103 HZ PHE 103 2.680 -2.103 2.776
748 H THR 104 H THR 104 5.707 1.298 4.849
749 HA THR 104 HA THR 104 6.767 -0.775 3.226
750 HB THR 104 HB THR 104 8.561 0.422 5.349
751 HG1 THR 104 1HG THR 104 8.472 0.845 2.796
752 1HG2 THR 104 1HG2 THR 104 10.068 -1.479 4.925
753 2HG2 THR 104 2HG2 THR 104 8.820 -2.218 3.917
754 3HG2 THR 104 3HG2 THR 104 8.533 -1.976 5.643
755 H VAL 105 H VAL 105 5.068 -2.120 3.959
756 HA VAL 105 HA VAL 105 5.393 -2.796 6.806
757 HB VAL 105 HB VAL 105 3.050 -2.262 6.214
758 1HG1 VAL 105 1HG1 VAL 105 1.781 -3.755 4.761
759 2HG1 VAL 105 2HG1 VAL 105 3.253 -4.650 4.383
760 3HG1 VAL 105 3HG1 VAL 105 3.088 -2.970 3.874
761 1HG2 VAL 105 1HG2 VAL 105 3.615 -3.886 7.983
762 2HG2 VAL 105 2HG2 VAL 105 3.463 -5.186 6.803
763 3HG2 VAL 105 3HG2 VAL 105 2.057 -4.207 7.225
764 H TYR 106 H TYR 106 6.138 -4.735 7.345
765 HA TYR 106 HA TYR 106 6.756 -6.619 5.179
766 1HB TYR 106 2HB TYR 106 7.767 -6.494 8.024
767 2HB TYR 106 1HB TYR 106 8.237 -7.708 6.846
768 HD1 TYR 106 1HD TYR 106 9.561 -6.994 4.831
769 HD2 TYR 106 2HD TYR 106 8.836 -4.398 8.122
770 HE1 TYR 106 1HE TYR 106 11.382 -5.528 4.070
771 HE2 TYR 106 2HE TYR 106 10.660 -2.929 7.372
772 HH TYR 106 HH TYR 106 12.056 -3.173 4.297
773 H LEU 107 H LEU 107 4.984 -7.870 4.921
774 HA LEU 107 HA LEU 107 4.050 -9.227 7.330
775 1HB LEU 107 2HB LEU 107 1.752 -9.190 6.601
776 2HB LEU 107 1HB LEU 107 2.368 -7.568 6.740
777 HG LEU 107 HG LEU 107 0.912 -7.630 4.880
778 1HD1 LEU 107 1HD1 LEU 107 2.866 -6.276 4.529
779 2HD1 LEU 107 2HD1 LEU 107 2.328 -6.997 3.011
780 3HD1 LEU 107 3HD1 LEU 107 3.731 -7.657 3.854
781 1HD2 LEU 107 1HD2 LEU 107 1.191 -9.116 2.966
782 2HD2 LEU 107 2HD2 LEU 107 0.837 -9.998 4.452
783 3HD2 LEU 107 3HD2 LEU 107 2.482 -9.962 3.817
784 H LYS 108 H LYS 108 3.364 -11.381 7.051
785 HA LYS 108 HA LYS 108 4.789 -12.572 4.781
786 1HB LYS 108 2HB LYS 108 5.594 -13.210 6.996
787 2HB LYS 108 1HB LYS 108 3.986 -13.756 7.435
788 1HG LYS 108 2HG LYS 108 4.204 -15.709 6.380
789 2HG LYS 108 1HG LYS 108 5.028 -14.975 5.000
790 1HD LYS 108 2HD LYS 108 7.113 -14.940 6.202
791 2HD LYS 108 1HD LYS 108 6.318 -15.476 7.683
792 1HE LYS 108 2HE LYS 108 6.502 -17.076 5.131
793 2HE LYS 108 1HE LYS 108 7.552 -17.279 6.532
794 1HZ LYS 108 1HZ LYS 108 5.919 -18.902 6.773
795 2HZ LYS 108 2HZ LYS 108 4.664 -17.867 6.311
796 3HZ LYS 108 3HZ LYS 108 5.409 -17.665 7.819
797 H ALA 109 H ALA 109 3.651 -13.454 3.208
798 HA ALA 109 HA ALA 109 0.757 -13.689 3.610
799 1HB ALA 109 1HB ALA 109 2.367 -13.353 1.081
800 2HB ALA 109 2HB ALA 109 1.464 -12.089 1.915
801 3HB ALA 109 3HB ALA 109 0.608 -13.440 1.171
802 H ASN 110 H ASN 110 -0.122 -15.623 3.666
803 HA ASN 110 HA ASN 110 0.485 -17.817 2.102
804 1HB ASN 110 2HB ASN 110 1.759 -19.295 3.595
805 2HB ASN 110 1HB ASN 110 2.690 -17.872 3.166
806 1HD2 ASN 110 1HD2 ASN 110 1.584 -16.051 5.026
807 2HD2 ASN 110 2HD2 ASN 110 2.027 -16.562 6.614
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