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 |
|
|
22500 |
2joz   |
15211 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1HT MET 1 13.695 46.716 -6.530
2 2H MET 1 2HT MET 1 13.782 47.277 -8.127
3 3H MET 1 3HT MET 1 15.134 47.392 -7.113
4 HA MET 1 HA MET 1 15.366 45.578 -8.695
5 1HB MET 1 2HB MET 1 14.966 44.690 -5.830
6 2HB MET 1 1HB MET 1 15.863 43.797 -7.052
7 1HG MET 1 2HG MET 1 17.497 45.558 -7.204
8 2HG MET 1 1HG MET 1 16.565 46.560 -6.092
9 1HE MET 1 1HE MET 1 18.693 46.964 -4.605
10 2HE MET 1 2HE MET 1 19.651 45.989 -5.720
11 3HE MET 1 3HE MET 1 19.721 45.670 -3.986
12 H ILE 2 H ILE 2 14.702 43.102 -8.781
13 HA ILE 2 HA ILE 2 11.776 42.923 -8.655
14 HB ILE 2 HB ILE 2 11.597 41.961 -10.860
15 1HG1 ILE 2 2HG1 ILE 2 13.897 40.938 -10.911
16 2HG1 ILE 2 1HG1 ILE 2 13.401 41.710 -12.411
17 1HG2 ILE 2 1HG2 ILE 2 12.099 43.910 -12.245
18 2HG2 ILE 2 2HG2 ILE 2 13.094 44.569 -10.947
19 3HG2 ILE 2 3HG2 ILE 2 11.359 44.356 -10.708
20 1HD1 ILE 2 1HD1 ILE 2 15.721 42.171 -11.923
21 2HD1 ILE 2 2HD1 ILE 2 15.280 42.852 -10.357
22 3HD1 ILE 2 3HD1 ILE 2 14.772 43.655 -11.842
23 H MET 3 H MET 3 10.961 40.727 -8.927
24 HA MET 3 HA MET 3 12.882 38.686 -8.023
25 1HB MET 3 2HB MET 3 10.943 39.020 -6.533
26 2HB MET 3 1HB MET 3 9.853 38.709 -7.879
27 1HG MET 3 2HG MET 3 10.684 36.427 -8.037
28 2HG MET 3 1HG MET 3 11.809 36.735 -6.715
29 1HE MET 3 1HE MET 3 8.060 36.388 -7.773
30 2HE MET 3 2HE MET 3 8.056 37.989 -7.031
31 3HE MET 3 3HE MET 3 7.211 36.654 -6.251
32 H VAL 4 H VAL 4 13.565 37.349 -9.569
33 HA VAL 4 HA VAL 4 12.492 37.528 -12.208
34 HB VAL 4 HB VAL 4 14.530 35.578 -11.120
35 1HG1 VAL 4 1HG1 VAL 4 13.926 36.400 -13.960
36 2HG1 VAL 4 2HG1 VAL 4 13.571 34.831 -13.236
37 3HG1 VAL 4 3HG1 VAL 4 15.245 35.346 -13.454
38 1HG2 VAL 4 1HG2 VAL 4 14.911 38.247 -12.471
39 2HG2 VAL 4 2HG2 VAL 4 16.200 37.124 -12.041
40 3HG2 VAL 4 3HG2 VAL 4 15.232 37.882 -10.776
41 H SER 5 H SER 5 10.652 36.609 -12.765
42 HA SER 5 HA SER 5 9.547 34.372 -11.356
43 1HB SER 5 2HB SER 5 8.228 36.258 -12.408
44 2HB SER 5 1HB SER 5 8.601 35.548 -13.977
45 HG SER 5 HG SER 5 6.814 34.745 -12.042
46 H GLY 6 H GLY 6 8.876 32.375 -12.424
47 1HA GLY 6 2HA GLY 6 9.594 31.417 -14.871
48 2HA GLY 6 1HA GLY 6 11.041 31.205 -13.893
49 H CYS 7 H CYS 7 8.903 29.365 -15.105
50 HA CYS 7 HA CYS 7 8.699 27.680 -12.725
51 1HB CYS 7 2HB CYS 7 6.359 28.334 -14.528
52 2HB CYS 7 1HB CYS 7 6.352 27.090 -13.283
53 HG CYS 7 HG CYS 7 7.333 29.738 -11.757
54 H GLN 8 H GLN 8 7.751 27.738 -16.167
55 HA GLN 8 HA GLN 8 8.159 26.313 -17.895
56 1HB GLN 8 2HB GLN 8 10.407 25.357 -16.111
57 2HB GLN 8 1HB GLN 8 10.189 24.864 -17.784
58 1HG GLN 8 2HG GLN 8 10.689 27.007 -18.593
59 2HG GLN 8 1HG GLN 8 10.492 27.742 -17.001
60 1HE2 GLN 8 1HE2 GLN 8 12.561 25.791 -19.024
61 2HE2 GLN 8 2HE2 GLN 8 13.990 25.963 -18.051
62 H GLN 9 H GLN 9 8.816 23.675 -18.065
63 HA GLN 9 HA GLN 9 7.331 22.219 -16.028
64 1HB GLN 9 2HB GLN 9 6.072 20.942 -17.719
65 2HB GLN 9 1HB GLN 9 5.641 22.645 -17.728
66 1HG GLN 9 2HG GLN 9 6.947 23.021 -19.708
67 2HG GLN 9 1HG GLN 9 7.569 21.371 -19.655
68 1HE2 GLN 9 1HE2 GLN 9 4.252 22.164 -18.916
69 2HE2 GLN 9 2HE2 GLN 9 3.557 21.419 -20.316
70 H GLN 10 H GLN 10 7.915 20.024 -15.896
71 HA GLN 10 HA GLN 10 10.567 19.519 -16.944
72 1HB GLN 10 2HB GLN 10 10.420 17.441 -15.507
73 2HB GLN 10 1HB GLN 10 10.373 18.973 -14.657
74 1HG GLN 10 2HG GLN 10 7.842 17.546 -15.369
75 2HG GLN 10 1HG GLN 10 8.778 17.080 -13.949
76 1HE2 GLN 10 1HE2 GLN 10 8.969 18.526 -12.228
77 2HE2 GLN 10 2HE2 GLN 10 7.898 19.877 -12.049
78 H LYS 11 H LYS 11 10.951 18.432 -18.712
79 HA LYS 11 HA LYS 11 8.882 16.895 -20.020
80 1HB LYS 11 2HB LYS 11 11.746 17.542 -20.726
81 2HB LYS 11 1HB LYS 11 10.781 16.417 -21.676
82 1HG LYS 11 2HG LYS 11 10.126 19.313 -21.162
83 2HG LYS 11 1HG LYS 11 10.761 18.636 -22.665
84 1HD LYS 11 2HD LYS 11 8.762 17.246 -22.883
85 2HD LYS 11 1HD LYS 11 8.128 17.918 -21.381
86 1HE LYS 11 2HE LYS 11 8.085 20.144 -22.401
87 2HE LYS 11 1HE LYS 11 8.721 19.465 -23.900
88 1HZ LYS 11 1HZ LYS 11 6.738 18.090 -24.069
89 2HZ LYS 11 2HZ LYS 11 6.330 19.735 -24.020
90 3HZ LYS 11 3HZ LYS 11 6.120 18.765 -22.644
91 H GLU 12 H GLU 12 11.563 16.415 -17.934
92 HA GLU 12 HA GLU 12 11.655 13.564 -18.218
93 1HB GLU 12 2HB GLU 12 12.868 13.724 -15.965
94 2HB GLU 12 1HB GLU 12 13.637 14.488 -17.343
95 1HG GLU 12 2HG GLU 12 11.904 16.071 -15.492
96 2HG GLU 12 1HG GLU 12 13.585 15.726 -15.088
97 H GLU 13 H GLU 13 10.505 12.052 -17.092
98 HA GLU 13 HA GLU 13 7.989 12.800 -16.155
99 1HB GLU 13 2HB GLU 13 7.778 10.417 -15.595
100 2HB GLU 13 1HB GLU 13 8.353 10.682 -17.222
101 1HG GLU 13 2HG GLU 13 10.633 10.205 -16.480
102 2HG GLU 13 1HG GLU 13 10.032 9.917 -14.848
103 H THR 14 H THR 14 7.119 12.824 -14.176
104 HA THR 14 HA THR 14 8.747 12.196 -11.846
105 HB THR 14 HB THR 14 7.308 14.855 -12.065
106 HG1 THR 14 1HG THR 14 9.712 14.128 -12.991
107 1HG2 THR 14 1HG2 THR 14 8.497 15.368 -9.968
108 2HG2 THR 14 2HG2 THR 14 9.157 13.734 -9.951
109 3HG2 THR 14 3HG2 THR 14 7.418 13.984 -9.784
110 HA PRO 15 HA PRO 15 4.399 10.675 -11.452
111 1HB PRO 15 2HB PRO 15 5.122 8.251 -10.427
112 2HB PRO 15 1HB PRO 15 4.930 8.563 -12.151
113 1HG PRO 15 2HG PRO 15 7.415 8.378 -10.523
114 2HG PRO 15 1HG PRO 15 7.123 7.861 -12.192
115 1HD PRO 15 2HD PRO 15 8.454 10.154 -11.498
116 2HD PRO 15 1HD PRO 15 7.601 9.929 -13.037
117 H PHE 16 H PHE 16 3.488 11.557 -9.719
118 HA PHE 16 HA PHE 16 4.955 12.161 -7.381
119 1HB PHE 16 2HB PHE 16 2.942 13.152 -6.524
120 2HB PHE 16 1HB PHE 16 3.056 13.524 -8.239
121 HD1 PHE 16 2HD PHE 16 1.576 12.355 -9.849
122 HD2 PHE 16 1HD PHE 16 1.138 11.905 -5.641
123 HE1 PHE 16 2HE PHE 16 -0.699 11.473 -10.182
124 HE2 PHE 16 1HE PHE 16 -1.133 11.025 -5.965
125 HZ PHE 16 HZ PHE 16 -2.054 10.804 -8.237
126 H TYR 17 H TYR 17 3.350 9.284 -8.262
127 HA TYR 17 HA TYR 17 2.847 8.535 -5.497
128 1HB TYR 17 2HB TYR 17 1.550 6.771 -6.316
129 2HB TYR 17 1HB TYR 17 1.247 8.068 -7.454
130 HD1 TYR 17 1HD TYR 17 2.184 7.956 -9.744
131 HD2 TYR 17 2HD TYR 17 2.676 4.753 -6.984
132 HE1 TYR 17 1HE TYR 17 2.817 6.460 -11.594
133 HE2 TYR 17 2HE TYR 17 3.319 3.257 -8.821
134 HH TYR 17 HH TYR 17 3.167 3.020 -11.134
135 H TYR 18 H TYR 18 5.295 8.214 -7.835
136 HA TYR 18 HA TYR 18 6.186 5.585 -7.085
137 1HB TYR 18 2HB TYR 18 6.472 6.602 -9.371
138 2HB TYR 18 1HB TYR 18 7.674 7.683 -8.677
139 HD1 TYR 18 1HD TYR 18 6.930 4.186 -9.568
140 HD2 TYR 18 2HD TYR 18 9.897 6.903 -8.172
141 HE1 TYR 18 1HE TYR 18 8.671 2.500 -9.994
142 HE2 TYR 18 2HE TYR 18 11.643 5.223 -8.592
143 HH TYR 18 HH TYR 18 11.103 2.421 -10.426
144 H GLY 19 H GLY 19 7.838 5.036 -5.745
145 1HA GLY 19 2HA GLY 19 10.026 6.022 -4.820
146 2HA GLY 19 1HA GLY 19 8.946 7.209 -4.101
147 H THR 20 H THR 20 9.641 6.611 -2.031
148 HA THR 20 HA THR 20 8.422 4.115 -1.055
149 HB THR 20 HB THR 20 10.911 5.375 0.119
150 HG1 THR 20 1HG THR 20 11.741 3.226 -0.933
151 1HG2 THR 20 1HG2 THR 20 9.639 3.985 1.666
152 2HG2 THR 20 2HG2 THR 20 11.146 3.181 1.225
153 3HG2 THR 20 3HG2 THR 20 9.625 2.665 0.496
154 H TRP 21 H TRP 21 7.000 4.408 0.588
155 HA TRP 21 HA TRP 21 6.835 7.138 1.688
156 1HB TRP 21 2HB TRP 21 4.521 5.282 1.117
157 2HB TRP 21 1HB TRP 21 4.427 6.942 1.684
158 HD1 TRP 21 HD TRP 21 5.233 4.912 -1.467
159 HE1 TRP 21 1HE TRP 21 5.043 6.463 -3.516
160 HE3 TRP 21 3HE TRP 21 4.535 9.357 0.951
161 HZ2 TRP 21 2HZ TRP 21 4.660 9.210 -4.026
162 HZ3 TRP 21 3HZ TRP 21 4.268 11.399 -0.389
163 HH2 TRP 21 HH TRP 21 4.329 11.327 -2.829
164 H ASP 22 H ASP 22 6.318 7.416 3.818
165 HA ASP 22 HA ASP 22 6.857 5.137 5.545
166 1HB ASP 22 2HB ASP 22 8.104 7.150 5.984
167 2HB ASP 22 1HB ASP 22 6.632 8.100 6.098
168 H GLU 23 H GLU 23 5.279 3.953 6.322
169 HA GLU 23 HA GLU 23 2.735 5.145 7.095
170 1HB GLU 23 2HB GLU 23 2.313 3.379 5.686
171 2HB GLU 23 1HB GLU 23 3.773 2.527 6.144
172 1HG GLU 23 2HG GLU 23 2.130 1.210 6.897
173 2HG GLU 23 1HG GLU 23 2.591 2.083 8.336
174 H GLY 24 H GLY 24 5.067 5.719 8.541
175 1HA GLY 24 2HA GLY 24 5.517 3.882 10.688
176 2HA GLY 24 1HA GLY 24 6.228 5.479 10.509
177 H ARG 25 H ARG 25 3.097 3.981 11.148
178 HA ARG 25 HA ARG 25 2.499 6.041 13.102
179 1HB ARG 25 2HB ARG 25 0.928 3.854 11.788
180 2HB ARG 25 1HB ARG 25 0.342 4.599 13.259
181 1HG ARG 25 2HG ARG 25 0.500 6.810 12.125
182 2HG ARG 25 1HG ARG 25 0.887 5.950 10.635
183 1HD ARG 25 2HD ARG 25 -1.240 4.844 10.649
184 2HD ARG 25 1HD ARG 25 -1.614 5.480 12.251
185 HE ARG 25 HE ARG 25 -1.122 7.493 10.233
186 1HH1 ARG 25 1HH1 ARG 25 -3.524 5.502 11.829
187 2HH1 ARG 25 2HH1 ARG 25 -4.850 6.545 11.404
188 1HH2 ARG 25 1HH2 ARG 25 -2.867 8.889 9.717
189 2HH2 ARG 25 2HH2 ARG 25 -4.476 8.455 10.208
190 H ALA 26 H ALA 26 1.007 4.574 14.910
191 HA ALA 26 HA ALA 26 3.125 3.607 16.572
192 1HB ALA 26 1HB ALA 26 1.295 4.958 17.480
193 2HB ALA 26 2HB ALA 26 1.414 3.398 18.295
194 3HB ALA 26 3HB ALA 26 0.156 3.668 17.091
195 HA PRO 27 HA PRO 27 2.900 -0.679 15.658
196 1HB PRO 27 2HB PRO 27 3.824 -1.268 18.363
197 2HB PRO 27 1HB PRO 27 4.675 -1.447 16.829
198 1HG PRO 27 2HG PRO 27 5.347 0.426 18.661
199 2HG PRO 27 1HG PRO 27 5.554 0.670 16.917
200 1HD PRO 27 2HD PRO 27 3.398 1.683 18.732
201 2HD PRO 27 1HD PRO 27 4.240 2.516 17.407
202 H GLY 28 H GLY 28 2.363 -2.820 16.878
203 1HA GLY 28 2HA GLY 28 -0.069 -2.523 18.500
204 2HA GLY 28 1HA GLY 28 -0.162 -3.402 16.978
205 HA PRO 29 HA PRO 29 0.720 -6.701 20.098
206 1HB PRO 29 2HB PRO 29 -0.474 -8.601 18.509
207 2HB PRO 29 1HB PRO 29 -1.328 -7.653 19.732
208 1HG PRO 29 2HG PRO 29 -1.154 -7.218 16.773
209 2HG PRO 29 1HG PRO 29 -2.567 -7.097 17.842
210 1HD PRO 29 2HD PRO 29 -1.273 -4.910 17.009
211 2HD PRO 29 1HD PRO 29 -1.927 -5.016 18.656
212 H THR 30 H THR 30 1.267 -9.198 19.061
213 HA THR 30 HA THR 30 3.919 -9.066 18.295
214 HB THR 30 HB THR 30 3.645 -11.443 17.534
215 HG1 THR 30 1HG THR 30 1.615 -11.684 16.804
216 1HG2 THR 30 1HG2 THR 30 3.060 -12.321 19.751
217 2HG2 THR 30 2HG2 THR 30 2.411 -10.743 20.199
218 3HG2 THR 30 3HG2 THR 30 4.134 -10.926 19.868
219 H ASP 31 H ASP 31 1.061 -9.099 16.288
220 HA ASP 31 HA ASP 31 2.719 -9.115 13.876
221 1HB ASP 31 2HB ASP 31 -0.232 -9.578 14.293
222 2HB ASP 31 1HB ASP 31 0.511 -9.445 12.701
223 H GLY 32 H GLY 32 2.086 -6.895 15.856
224 1HA GLY 32 2HA GLY 32 1.102 -4.889 13.931
225 2HA GLY 32 1HA GLY 32 1.064 -4.711 15.684
226 H VAL 33 H VAL 33 3.154 -4.978 12.919
227 HA VAL 33 HA VAL 33 5.657 -4.620 14.076
228 HB VAL 33 HB VAL 33 4.642 -3.835 11.348
229 1HG1 VAL 33 1HG1 VAL 33 7.413 -4.024 12.459
230 2HG1 VAL 33 2HG1 VAL 33 6.654 -2.666 11.624
231 3HG1 VAL 33 3HG1 VAL 33 7.072 -4.132 10.737
232 1HG2 VAL 33 1HG2 VAL 33 6.021 -6.312 12.368
233 2HG2 VAL 33 2HG2 VAL 33 5.650 -5.976 10.677
234 3HG2 VAL 33 3HG2 VAL 33 4.341 -6.182 11.840
235 H LYS 34 H LYS 34 6.994 -2.872 14.379
236 HA LYS 34 HA LYS 34 5.897 -0.706 15.698
237 1HB LYS 34 2HB LYS 34 8.649 -0.974 14.489
238 2HB LYS 34 1HB LYS 34 8.182 0.227 15.678
239 1HG LYS 34 2HG LYS 34 7.793 -1.484 17.326
240 2HG LYS 34 1HG LYS 34 8.108 -2.743 16.133
241 1HD LYS 34 2HD LYS 34 10.083 -2.534 17.427
242 2HD LYS 34 1HD LYS 34 10.422 -1.769 15.877
243 1HE LYS 34 2HE LYS 34 9.502 -0.195 18.262
244 2HE LYS 34 1HE LYS 34 11.200 -0.574 18.000
245 1HZ LYS 34 1HZ LYS 34 10.635 1.612 17.153
246 2HZ LYS 34 2HZ LYS 34 9.461 0.952 16.132
247 3HZ LYS 34 3HZ LYS 34 11.096 0.590 15.881
248 H SER 35 H SER 35 7.059 -0.939 12.412
249 HA SER 35 HA SER 35 5.651 1.473 11.679
250 1HB SER 35 2HB SER 35 8.648 1.326 11.277
251 2HB SER 35 1HB SER 35 7.588 2.646 10.796
252 HG SER 35 HG SER 35 7.136 2.352 13.330
253 H ALA 36 H ALA 36 5.755 1.816 9.309
254 HA ALA 36 HA ALA 36 6.681 -0.496 7.790
255 1HB ALA 36 1HB ALA 36 4.340 -0.979 8.362
256 2HB ALA 36 2HB ALA 36 4.561 -0.741 6.630
257 3HB ALA 36 3HB ALA 36 3.853 0.541 7.611
258 H THR 37 H THR 37 7.065 -0.074 5.633
259 HA THR 37 HA THR 37 6.623 2.661 4.664
260 HB THR 37 HB THR 37 8.859 2.462 3.464
261 HG1 THR 37 1HG THR 37 9.279 0.266 3.802
262 1HG2 THR 37 1HG2 THR 37 8.574 3.968 5.354
263 2HG2 THR 37 2HG2 THR 37 10.167 3.212 5.412
264 3HG2 THR 37 3HG2 THR 37 8.882 2.645 6.478
265 H VAL 38 H VAL 38 6.042 2.750 2.487
266 HA VAL 38 HA VAL 38 5.763 0.104 1.224
267 HB VAL 38 HB VAL 38 3.584 1.059 1.708
268 1HG1 VAL 38 1HG1 VAL 38 4.161 3.418 1.733
269 2HG1 VAL 38 2HG1 VAL 38 2.810 3.123 0.640
270 3HG1 VAL 38 3HG1 VAL 38 4.431 3.392 -0.007
271 1HG2 VAL 38 1HG2 VAL 38 2.613 0.977 -0.537
272 2HG2 VAL 38 2HG2 VAL 38 3.803 -0.299 -0.288
273 3HG2 VAL 38 3HG2 VAL 38 4.225 1.128 -1.237
274 H THR 39 H THR 39 6.695 -0.271 -0.639
275 HA THR 39 HA THR 39 8.067 1.958 -1.978
276 HB THR 39 HB THR 39 8.682 -1.008 -2.050
277 HG1 THR 39 1HG THR 39 9.748 -0.597 -0.273
278 1HG2 THR 39 1HG2 THR 39 10.227 1.338 -3.157
279 2HG2 THR 39 2HG2 THR 39 9.362 0.127 -4.104
280 3HG2 THR 39 3HG2 THR 39 10.769 -0.339 -3.148
281 H PHE 40 H PHE 40 7.350 2.512 -3.960
282 HA PHE 40 HA PHE 40 5.512 0.670 -5.310
283 1HB PHE 40 2HB PHE 40 5.977 3.636 -5.556
284 2HB PHE 40 1HB PHE 40 5.064 2.740 -6.766
285 HD1 PHE 40 2HD PHE 40 5.118 3.857 -3.261
286 HD2 PHE 40 1HD PHE 40 2.855 1.982 -6.339
287 HE1 PHE 40 2HE PHE 40 3.085 4.073 -1.894
288 HE2 PHE 40 1HE PHE 40 0.818 2.206 -4.978
289 HZ PHE 40 HZ PHE 40 0.932 3.250 -2.750
290 H THR 41 H THR 41 6.290 -0.550 -6.815
291 HA THR 41 HA THR 41 8.737 0.228 -8.217
292 HB THR 41 HB THR 41 7.520 -2.518 -8.371
293 HG1 THR 41 1HG THR 41 9.343 -2.091 -6.318
294 1HG2 THR 41 1HG2 THR 41 9.989 -3.119 -8.256
295 2HG2 THR 41 2HG2 THR 41 10.320 -1.395 -8.434
296 3HG2 THR 41 3HG2 THR 41 9.468 -2.269 -9.706
297 H GLU 42 H GLU 42 8.671 -0.983 -10.510
298 HA GLU 42 HA GLU 42 7.321 0.525 -12.290
299 1HB GLU 42 2HB GLU 42 9.138 -0.887 -12.906
300 2HB GLU 42 1HB GLU 42 8.245 -2.330 -12.460
301 1HG GLU 42 2HG GLU 42 6.689 -1.891 -14.324
302 2HG GLU 42 1HG GLU 42 7.704 -0.522 -14.796
303 H ASP 43 H ASP 43 6.299 -2.881 -11.762
304 HA ASP 43 HA ASP 43 3.525 -1.982 -12.224
305 1HB ASP 43 2HB ASP 43 5.005 -4.236 -13.524
306 2HB ASP 43 1HB ASP 43 3.273 -4.392 -13.250
307 H GLU 44 H GLU 44 5.423 -2.951 -9.960
308 HA GLU 44 HA GLU 44 3.372 -4.559 -8.630
309 1HB GLU 44 2HB GLU 44 5.241 -5.838 -7.515
310 2HB GLU 44 1HB GLU 44 4.993 -6.188 -9.215
311 1HG GLU 44 2HG GLU 44 7.045 -4.185 -8.375
312 2HG GLU 44 1HG GLU 44 7.391 -5.910 -8.287
313 H VAL 45 H VAL 45 3.237 -4.278 -6.381
314 HA VAL 45 HA VAL 45 4.700 -1.926 -5.355
315 HB VAL 45 HB VAL 45 2.067 -3.015 -4.329
316 1HG1 VAL 45 1HG1 VAL 45 1.925 -0.889 -3.132
317 2HG1 VAL 45 2HG1 VAL 45 3.501 -0.420 -3.770
318 3HG1 VAL 45 3HG1 VAL 45 3.366 -1.791 -2.666
319 1HG2 VAL 45 1HG2 VAL 45 1.729 -2.167 -6.565
320 2HG2 VAL 45 2HG2 VAL 45 2.579 -0.676 -6.159
321 3HG2 VAL 45 3HG2 VAL 45 1.034 -1.045 -5.395
322 H VAL 46 H VAL 46 5.921 -2.175 -3.540
323 HA VAL 46 HA VAL 46 5.863 -4.843 -2.292
324 HB VAL 46 HB VAL 46 8.257 -3.014 -2.442
325 1HG1 VAL 46 1HG1 VAL 46 8.015 -5.914 -1.673
326 2HG1 VAL 46 2HG1 VAL 46 8.284 -4.562 -0.574
327 3HG1 VAL 46 3HG1 VAL 46 9.514 -4.987 -1.763
328 1HG2 VAL 46 1HG2 VAL 46 9.150 -4.542 -4.143
329 2HG2 VAL 46 2HG2 VAL 46 7.700 -3.700 -4.688
330 3HG2 VAL 46 3HG2 VAL 46 7.602 -5.385 -4.179
331 H GLU 47 H GLU 47 5.188 -4.809 -0.242
332 HA GLU 47 HA GLU 47 5.351 -2.327 1.260
333 1HB GLU 47 2HB GLU 47 3.801 -4.851 1.608
334 2HB GLU 47 1HB GLU 47 4.097 -3.821 3.001
335 1HG GLU 47 2HG GLU 47 2.154 -2.924 2.334
336 2HG GLU 47 1HG GLU 47 3.230 -1.965 1.329
337 H THR 48 H THR 48 6.467 -2.033 3.059
338 HA THR 48 HA THR 48 8.199 -4.235 3.991
339 HB THR 48 HB THR 48 9.174 -1.419 4.176
340 HG1 THR 48 1HG THR 48 8.634 -2.694 1.826
341 1HG2 THR 48 1HG2 THR 48 10.414 -3.252 5.231
342 2HG2 THR 48 2HG2 THR 48 11.350 -2.488 3.947
343 3HG2 THR 48 3HG2 THR 48 10.571 -4.043 3.660
344 H GLU 49 H GLU 49 8.126 -4.524 6.148
345 HA GLU 49 HA GLU 49 7.133 -2.306 7.801
346 1HB GLU 49 2HB GLU 49 6.566 -5.242 8.291
347 2HB GLU 49 1HB GLU 49 6.041 -3.906 9.299
348 1HG GLU 49 2HG GLU 49 4.794 -3.060 7.248
349 2HG GLU 49 1HG GLU 49 5.084 -4.655 6.561
350 H VAL 50 H VAL 50 8.344 -1.843 9.606
351 HA VAL 50 HA VAL 50 10.921 -3.230 9.725
352 HB VAL 50 HB VAL 50 10.080 -0.789 11.295
353 1HG1 VAL 50 1HG1 VAL 50 12.029 -1.946 12.170
354 2HG1 VAL 50 2HG1 VAL 50 12.494 -0.396 11.469
355 3HG1 VAL 50 3HG1 VAL 50 12.794 -1.892 10.582
356 1HG2 VAL 50 1HG2 VAL 50 11.306 0.516 9.557
357 2HG2 VAL 50 2HG2 VAL 50 9.809 -0.220 8.985
358 3HG2 VAL 50 3HG2 VAL 50 11.359 -0.948 8.575
359 H MET 51 H MET 51 11.023 -4.910 10.993
360 HA MET 51 HA MET 51 9.159 -5.127 13.250
361 1HB MET 51 2HB MET 51 10.818 -7.160 11.748
362 2HB MET 51 1HB MET 51 9.780 -7.548 13.110
363 1HG MET 51 2HG MET 51 7.832 -6.811 11.847
364 2HG MET 51 1HG MET 51 8.870 -6.362 10.496
365 1HE MET 51 1HE MET 51 7.487 -7.774 8.782
366 2HE MET 51 2HE MET 51 6.359 -8.195 10.070
367 3HE MET 51 3HE MET 51 7.025 -9.457 9.034
368 H GLU 52 H GLU 52 9.884 -5.407 15.325
369 HA GLU 52 HA GLU 52 12.460 -4.474 15.986
370 1HB GLU 52 2HB GLU 52 10.480 -4.273 17.461
371 2HB GLU 52 1HB GLU 52 10.521 -6.012 17.721
372 1HG GLU 52 2HG GLU 52 12.811 -5.749 18.651
373 2HG GLU 52 1HG GLU 52 12.601 -4.003 18.532
374 H GLY 53 H GLY 53 14.295 -5.529 15.731
375 1HA GLY 53 2HA GLY 53 15.793 -7.261 16.352
376 2HA GLY 53 1HA GLY 53 14.429 -8.353 16.525
377 H ARG 54 H ARG 54 13.573 -7.045 13.790
378 HA ARG 54 HA ARG 54 15.165 -8.916 12.165
379 1HB ARG 54 2HB ARG 54 12.492 -7.928 11.274
380 2HB ARG 54 1HB ARG 54 13.285 -9.453 10.941
381 1HG ARG 54 2HG ARG 54 12.883 -9.572 13.644
382 2HG ARG 54 1HG ARG 54 11.444 -8.734 13.071
383 1HD ARG 54 2HD ARG 54 10.846 -10.985 12.968
384 2HD ARG 54 1HD ARG 54 11.306 -10.600 11.308
385 HE ARG 54 HE ARG 54 13.568 -11.568 12.003
386 1HH1 ARG 54 1HH1 ARG 54 10.459 -12.686 13.159
387 2HH1 ARG 54 2HH1 ARG 54 11.051 -14.251 13.629
388 1HH2 ARG 54 1HH2 ARG 54 14.347 -13.645 12.575
389 2HH2 ARG 54 2HH2 ARG 54 13.259 -14.786 13.301
390 H GLY 55 H GLY 55 13.697 -5.742 12.338
391 1HA GLY 55 2HA GLY 55 14.498 -3.768 11.327
392 2HA GLY 55 1HA GLY 55 15.538 -4.746 10.294
393 H GLU 56 H GLU 56 14.674 -3.306 8.559
394 HA GLU 56 HA GLU 56 12.023 -3.479 7.703
395 1HB GLU 56 2HB GLU 56 14.558 -3.106 6.109
396 2HB GLU 56 1HB GLU 56 12.940 -2.901 5.461
397 1HG GLU 56 2HG GLU 56 13.544 -0.763 5.933
398 2HG GLU 56 1HG GLU 56 12.655 -1.198 7.377
399 H VAL 57 H VAL 57 10.905 -5.018 6.902
400 HA VAL 57 HA VAL 57 12.256 -7.253 5.539
401 HB VAL 57 HB VAL 57 9.845 -7.343 7.363
402 1HG1 VAL 57 1HG1 VAL 57 9.727 -9.749 6.893
403 2HG1 VAL 57 2HG1 VAL 57 11.017 -9.584 5.703
404 3HG1 VAL 57 3HG1 VAL 57 9.463 -8.796 5.434
405 1HG2 VAL 57 1HG2 VAL 57 12.542 -8.679 7.587
406 2HG2 VAL 57 2HG2 VAL 57 11.190 -8.892 8.701
407 3HG2 VAL 57 3HG2 VAL 57 11.967 -7.317 8.546
408 H GLN 58 H GLN 58 11.679 -7.332 3.452
409 HA GLN 58 HA GLN 58 9.380 -5.824 2.572
410 1HB GLN 58 2HB GLN 58 11.524 -7.299 1.048
411 2HB GLN 58 1HB GLN 58 10.225 -6.389 0.305
412 1HG GLN 58 2HG GLN 58 11.171 -4.475 1.876
413 2HG GLN 58 1HG GLN 58 12.642 -5.433 1.713
414 1HE2 GLN 58 1HE2 GLN 58 11.835 -6.338 -0.989
415 2HE2 GLN 58 2HE2 GLN 58 12.112 -4.981 -2.032
416 H LEU 59 H LEU 59 7.523 -6.627 1.909
417 HA LEU 59 HA LEU 59 7.039 -9.455 2.358
418 1HB LEU 59 2HB LEU 59 5.068 -7.314 1.557
419 2HB LEU 59 1HB LEU 59 4.708 -8.880 2.258
420 HG LEU 59 HG LEU 59 6.094 -6.605 3.648
421 1HD1 LEU 59 1HD1 LEU 59 3.715 -6.219 3.279
422 2HD1 LEU 59 2HD1 LEU 59 4.071 -6.474 4.987
423 3HD1 LEU 59 3HD1 LEU 59 3.346 -7.770 4.033
424 1HD2 LEU 59 1HD2 LEU 59 6.933 -8.738 4.436
425 2HD2 LEU 59 2HD2 LEU 59 5.284 -9.314 4.683
426 3HD2 LEU 59 3HD2 LEU 59 5.912 -7.987 5.662
427 HA PRO 60 HA PRO 60 6.585 -10.926 -1.829
428 1HB PRO 60 2HB PRO 60 3.695 -11.295 -1.231
429 2HB PRO 60 1HB PRO 60 4.861 -12.450 -1.883
430 1HG PRO 60 2HG PRO 60 4.032 -12.569 0.667
431 2HG PRO 60 1HG PRO 60 5.683 -13.000 0.194
432 1HD PRO 60 2HD PRO 60 4.693 -10.595 1.623
433 2HD PRO 60 1HD PRO 60 6.279 -11.387 1.693
434 H PHE 61 H PHE 61 6.551 -9.568 -3.497
435 HA PHE 61 HA PHE 61 5.212 -7.098 -3.422
436 1HB PHE 61 2HB PHE 61 5.925 -7.005 -5.902
437 2HB PHE 61 1HB PHE 61 7.177 -7.068 -4.669
438 HD1 PHE 61 2HD PHE 61 5.414 -9.012 -7.253
439 HD2 PHE 61 1HD PHE 61 8.681 -8.895 -4.531
440 HE1 PHE 61 2HE PHE 61 6.407 -10.971 -8.362
441 HE2 PHE 61 1HE PHE 61 9.679 -10.848 -5.640
442 HZ PHE 61 HZ PHE 61 8.545 -11.891 -7.554
443 H MET 62 H MET 62 3.364 -6.390 -4.213
444 HA MET 62 HA MET 62 1.524 -8.369 -5.369
445 1HB MET 62 2HB MET 62 1.091 -5.769 -3.901
446 2HB MET 62 1HB MET 62 -0.202 -6.586 -4.760
447 1HG MET 62 2HG MET 62 1.413 -7.877 -2.581
448 2HG MET 62 1HG MET 62 -0.099 -7.019 -2.299
449 1HE MET 62 1HE MET 62 -2.685 -9.199 -4.245
450 2HE MET 62 2HE MET 62 -1.822 -7.788 -4.860
451 3HE MET 62 3HE MET 62 -2.440 -7.794 -3.209
452 H ALA 63 H ALA 63 0.832 -8.162 -7.437
453 HA ALA 63 HA ALA 63 1.922 -6.061 -9.069
454 1HB ALA 63 1HB ALA 63 0.802 -7.190 -10.918
455 2HB ALA 63 2HB ALA 63 -0.054 -8.226 -9.775
456 3HB ALA 63 3HB ALA 63 1.699 -8.340 -9.926
457 H TYR 64 H TYR 64 0.745 -4.441 -10.187
458 HA TYR 64 HA TYR 64 -2.077 -4.129 -9.460
459 1HB TYR 64 2HB TYR 64 -1.847 -1.867 -8.759
460 2HB TYR 64 1HB TYR 64 -0.609 -2.765 -7.893
461 HD1 TYR 64 1HD TYR 64 1.786 -2.537 -8.584
462 HD2 TYR 64 2HD TYR 64 -1.276 -0.123 -10.284
463 HE1 TYR 64 1HE TYR 64 3.489 -0.958 -9.401
464 HE2 TYR 64 2HE TYR 64 0.417 1.457 -11.108
465 HH TYR 64 HH TYR 64 3.783 0.740 -11.078
466 H LYS 65 H LYS 65 -3.292 -2.887 -10.937
467 HA LYS 65 HA LYS 65 -1.861 -1.981 -13.348
468 1HB LYS 65 2HB LYS 65 -4.486 -3.438 -13.147
469 2HB LYS 65 1HB LYS 65 -4.077 -2.457 -14.547
470 1HG LYS 65 2HG LYS 65 -2.062 -3.843 -14.871
471 2HG LYS 65 1HG LYS 65 -2.595 -4.858 -13.538
472 1HD LYS 65 2HD LYS 65 -4.656 -5.376 -14.755
473 2HD LYS 65 1HD LYS 65 -4.122 -4.350 -16.088
474 1HE LYS 65 2HE LYS 65 -2.117 -5.820 -16.306
475 2HE LYS 65 1HE LYS 65 -2.844 -6.896 -15.111
476 1HZ LYS 65 1HZ LYS 65 -3.944 -6.196 -17.778
477 2HZ LYS 65 2HZ LYS 65 -4.774 -7.111 -16.619
478 3HZ LYS 65 3HZ LYS 65 -3.332 -7.701 -17.293
479 H VAL 66 H VAL 66 -2.657 -0.178 -14.354
480 HA VAL 66 HA VAL 66 -4.006 1.660 -12.526
481 HB VAL 66 HB VAL 66 -2.532 2.160 -15.112
482 1HG1 VAL 66 1HG1 VAL 66 -2.681 4.541 -14.532
483 2HG1 VAL 66 2HG1 VAL 66 -3.661 4.132 -13.124
484 3HG1 VAL 66 3HG1 VAL 66 -4.282 3.830 -14.746
485 1HG2 VAL 66 1HG2 VAL 66 -1.082 1.444 -13.283
486 2HG2 VAL 66 2HG2 VAL 66 -1.738 2.716 -12.255
487 3HG2 VAL 66 3HG2 VAL 66 -0.800 3.137 -13.689
488 H ILE 67 H ILE 67 -6.124 1.881 -12.708
489 HA ILE 67 HA ILE 67 -7.517 1.164 -15.152
490 HB ILE 67 HB ILE 67 -8.728 2.394 -12.682
491 1HG1 ILE 67 2HG1 ILE 67 -8.305 -0.552 -13.242
492 2HG1 ILE 67 1HG1 ILE 67 -7.398 0.395 -12.067
493 1HG2 ILE 67 1HG2 ILE 67 -10.125 2.348 -14.685
494 2HG2 ILE 67 2HG2 ILE 67 -10.754 1.268 -13.444
495 3HG2 ILE 67 3HG2 ILE 67 -9.879 0.606 -14.824
496 1HD1 ILE 67 1HD1 ILE 67 -9.117 -0.913 -10.981
497 2HD1 ILE 67 2HD1 ILE 67 -10.352 -0.159 -11.990
498 3HD1 ILE 67 3HD1 ILE 67 -9.455 0.811 -10.823
499 H SER 68 H SER 68 -7.220 4.000 -13.064
500 HA SER 68 HA SER 68 -7.518 5.710 -15.432
501 1HB SER 68 2HB SER 68 -8.698 6.529 -12.798
502 2HB SER 68 1HB SER 68 -9.070 7.132 -14.405
503 HG SER 68 HG SER 68 -10.005 4.839 -13.105
504 H GLN 69 H GLN 69 -6.443 7.763 -15.206
505 HA GLN 69 HA GLN 69 -4.639 8.051 -12.955
506 1HB GLN 69 2HB GLN 69 -3.623 6.466 -14.755
507 2HB GLN 69 1HB GLN 69 -3.390 7.938 -15.685
508 1HG GLN 69 2HG GLN 69 -2.094 8.875 -13.794
509 2HG GLN 69 1HG GLN 69 -2.253 7.327 -12.967
510 1HE2 GLN 69 1HE2 GLN 69 -2.013 5.883 -15.564
511 2HE2 GLN 69 2HE2 GLN 69 -0.324 5.930 -15.944
512 H SER 70 H SER 70 -3.599 10.062 -12.872
513 HA SER 70 HA SER 70 -4.478 12.067 -14.840
514 1HB SER 70 2HB SER 70 -5.627 12.364 -12.653
515 2HB SER 70 1HB SER 70 -4.060 12.451 -11.857
516 HG SER 70 HG SER 70 -5.396 14.337 -13.399
517 H THR 71 H THR 71 -2.888 13.834 -15.136
518 HA THR 71 HA THR 71 -0.210 12.882 -15.157
519 HB THR 71 HB THR 71 -1.134 14.581 -16.768
520 HG1 THR 71 1HG THR 71 1.083 14.354 -16.725
521 1HG2 THR 71 1HG2 THR 71 -1.078 16.954 -16.107
522 2HG2 THR 71 2HG2 THR 71 -0.767 16.466 -14.440
523 3HG2 THR 71 3HG2 THR 71 -2.295 16.043 -15.212
524 H ASP 72 H ASP 72 -2.093 14.874 -13.019
525 HA ASP 72 HA ASP 72 -0.497 14.206 -10.779
526 1HB ASP 72 2HB ASP 72 0.975 15.969 -11.698
527 2HB ASP 72 1HB ASP 72 -0.365 17.109 -11.626
528 H GLY 73 H GLY 73 -2.500 13.542 -10.028
529 1HA GLY 73 2HA GLY 73 -3.915 15.509 -8.534
530 2HA GLY 73 1HA GLY 73 -4.860 14.966 -9.914
531 H SER 74 H SER 74 -5.262 12.652 -10.105
532 HA SER 74 HA SER 74 -4.974 11.147 -7.619
533 1HB SER 74 2HB SER 74 -7.206 12.187 -7.551
534 2HB SER 74 1HB SER 74 -7.606 11.448 -9.096
535 HG SER 74 HG SER 74 -6.786 9.902 -6.875
536 H ILE 75 H ILE 75 -5.230 8.889 -7.889
537 HA ILE 75 HA ILE 75 -5.063 7.892 -10.649
538 HB ILE 75 HB ILE 75 -3.189 7.033 -8.429
539 1HG1 ILE 75 2HG1 ILE 75 -2.589 8.620 -10.937
540 2HG1 ILE 75 1HG1 ILE 75 -2.623 9.273 -9.306
541 1HG2 ILE 75 1HG2 ILE 75 -3.303 6.218 -11.329
542 2HG2 ILE 75 2HG2 ILE 75 -3.756 5.220 -9.947
543 3HG2 ILE 75 3HG2 ILE 75 -2.078 5.718 -10.165
544 1HD1 ILE 75 1HD1 ILE 75 -0.353 8.885 -10.062
545 2HD1 ILE 75 2HD1 ILE 75 -0.720 7.179 -10.320
546 3HD1 ILE 75 3HD1 ILE 75 -0.749 7.851 -8.688
547 H GLU 76 H GLU 76 -6.136 6.000 -10.963
548 HA GLU 76 HA GLU 76 -7.238 4.665 -8.576
549 1HB GLU 76 2HB GLU 76 -8.923 5.801 -10.038
550 2HB GLU 76 1HB GLU 76 -8.407 4.751 -11.345
551 1HG GLU 76 2HG GLU 76 -9.123 2.801 -10.098
552 2HG GLU 76 1HG GLU 76 -9.636 3.840 -8.769
553 H ILE 77 H ILE 77 -6.559 2.674 -8.284
554 HA ILE 77 HA ILE 77 -5.474 1.173 -10.564
555 HB ILE 77 HB ILE 77 -3.606 0.365 -9.123
556 1HG1 ILE 77 2HG1 ILE 77 -4.398 2.654 -7.309
557 2HG1 ILE 77 1HG1 ILE 77 -4.673 0.953 -6.946
558 1HG2 ILE 77 1HG2 ILE 77 -2.225 2.383 -9.351
559 2HG2 ILE 77 2HG2 ILE 77 -3.684 3.327 -9.648
560 3HG2 ILE 77 3HG2 ILE 77 -3.203 2.069 -10.785
561 1HD1 ILE 77 1HD1 ILE 77 -2.718 1.777 -5.779
562 2HD1 ILE 77 2HD1 ILE 77 -1.999 2.286 -7.307
563 3HD1 ILE 77 3HD1 ILE 77 -2.251 0.572 -6.981
564 H GLN 78 H GLN 78 -5.492 -1.064 -10.362
565 HA GLN 78 HA GLN 78 -6.977 -2.147 -8.065
566 1HB GLN 78 2HB GLN 78 -8.545 -2.264 -9.825
567 2HB GLN 78 1HB GLN 78 -7.319 -2.707 -11.001
568 1HG GLN 78 2HG GLN 78 -7.215 -4.915 -10.223
569 2HG GLN 78 1HG GLN 78 -8.075 -4.518 -8.738
570 1HE2 GLN 78 1HE2 GLN 78 -10.269 -4.551 -8.716
571 2HE2 GLN 78 2HE2 GLN 78 -11.252 -4.967 -10.074
572 H TYR 79 H TYR 79 -6.166 -3.982 -7.170
573 HA TYR 79 HA TYR 79 -3.421 -4.569 -7.805
574 1HB TYR 79 2HB TYR 79 -5.226 -5.835 -5.731
575 2HB TYR 79 1HB TYR 79 -3.476 -5.987 -5.816
576 HD1 TYR 79 2HD TYR 79 -2.036 -4.134 -5.142
577 HD2 TYR 79 1HD TYR 79 -6.268 -3.822 -4.893
578 HE1 TYR 79 2HE TYR 79 -1.800 -2.170 -3.681
579 HE2 TYR 79 1HE TYR 79 -6.045 -1.856 -3.436
580 HH TYR 79 HH TYR 79 -3.027 -0.276 -2.928
581 H LEU 80 H LEU 80 -2.708 -6.883 -7.839
582 HA LEU 80 HA LEU 80 -4.688 -8.696 -9.044
583 1HB LEU 80 2HB LEU 80 -1.806 -8.367 -9.906
584 2HB LEU 80 1HB LEU 80 -2.903 -9.593 -10.506
585 HG LEU 80 HG LEU 80 -3.284 -6.620 -10.887
586 1HD1 LEU 80 1HD1 LEU 80 -1.334 -7.408 -12.104
587 2HD1 LEU 80 2HD1 LEU 80 -2.656 -7.040 -13.212
588 3HD1 LEU 80 3HD1 LEU 80 -2.284 -8.716 -12.809
589 1HD2 LEU 80 1HD2 LEU 80 -5.003 -7.283 -12.485
590 2HD2 LEU 80 2HD2 LEU 80 -5.375 -7.898 -10.874
591 3HD2 LEU 80 3HD2 LEU 80 -4.721 -8.982 -12.103
592 H GLY 81 H GLY 81 -4.378 -10.892 -8.543
593 1HA GLY 81 2HA GLY 81 -2.964 -12.552 -7.351
594 2HA GLY 81 1HA GLY 81 -2.659 -11.279 -6.173
595 HA PRO 82 HA PRO 82 -6.181 -13.754 -4.505
596 1HB PRO 82 2HB PRO 82 -5.491 -13.394 -1.889
597 2HB PRO 82 1HB PRO 82 -4.849 -14.697 -2.895
598 1HG PRO 82 2HG PRO 82 -3.611 -12.079 -2.159
599 2HG PRO 82 1HG PRO 82 -2.863 -13.683 -2.258
600 1HD PRO 82 2HD PRO 82 -2.584 -11.821 -4.204
601 2HD PRO 82 1HD PRO 82 -2.610 -13.562 -4.546
602 H TYR 83 H TYR 83 -5.133 -10.526 -4.208
603 HA TYR 83 HA TYR 83 -7.744 -9.725 -3.103
604 1HB TYR 83 2HB TYR 83 -5.094 -8.328 -2.634
605 2HB TYR 83 1HB TYR 83 -6.655 -7.835 -1.990
606 HD1 TYR 83 2HD TYR 83 -7.781 -9.289 -0.273
607 HD2 TYR 83 1HD TYR 83 -3.773 -9.949 -1.538
608 HE1 TYR 83 2HE TYR 83 -7.371 -10.641 1.739
609 HE2 TYR 83 1HE TYR 83 -3.356 -11.312 0.464
610 HH TYR 83 HH TYR 83 -4.212 -11.643 2.668
611 H TYR 84 H TYR 84 -7.545 -9.988 -5.792
612 HA TYR 84 HA TYR 84 -6.451 -7.604 -6.954
613 1HB TYR 84 2HB TYR 84 -6.801 -8.623 -9.093
614 2HB TYR 84 1HB TYR 84 -6.093 -9.819 -8.022
615 HD1 TYR 84 2HD TYR 84 -7.582 -11.620 -7.066
616 HD2 TYR 84 1HD TYR 84 -8.874 -9.004 -10.160
617 HE1 TYR 84 2HE TYR 84 -9.387 -13.187 -7.627
618 HE2 TYR 84 1HE TYR 84 -10.686 -10.565 -10.729
619 HH TYR 84 HH TYR 84 -11.130 -13.043 -10.470
620 HA PRO 85 HA PRO 85 -10.896 -7.106 -8.296
621 1HB PRO 85 2HB PRO 85 -12.950 -7.840 -6.716
622 2HB PRO 85 1HB PRO 85 -12.211 -8.913 -7.907
623 1HG PRO 85 2HG PRO 85 -11.830 -8.815 -4.950
624 2HG PRO 85 1HG PRO 85 -11.903 -10.222 -6.027
625 1HD PRO 85 2HD PRO 85 -9.576 -9.117 -5.044
626 2HD PRO 85 1HD PRO 85 -9.680 -10.105 -6.513
627 H LEU 86 H LEU 86 -9.606 -6.369 -5.330
628 HA LEU 86 HA LEU 86 -11.544 -4.224 -4.823
629 1HB LEU 86 2HB LEU 86 -10.971 -5.733 -2.934
630 2HB LEU 86 1HB LEU 86 -9.299 -5.222 -3.066
631 HG LEU 86 HG LEU 86 -9.937 -2.933 -2.469
632 1HD1 LEU 86 1HD1 LEU 86 -12.713 -4.064 -2.137
633 2HD1 LEU 86 2HD1 LEU 86 -12.200 -2.932 -3.390
634 3HD1 LEU 86 3HD1 LEU 86 -12.195 -2.437 -1.696
635 1HD2 LEU 86 1HD2 LEU 86 -10.523 -3.363 -0.133
636 2HD2 LEU 86 2HD2 LEU 86 -9.290 -4.486 -0.706
637 3HD2 LEU 86 3HD2 LEU 86 -10.965 -5.019 -0.546
638 H LYS 87 H LYS 87 -11.054 -2.411 -5.863
639 HA LYS 87 HA LYS 87 -8.302 -1.831 -6.549
640 1HB LYS 87 2HB LYS 87 -9.212 0.016 -7.871
641 2HB LYS 87 1HB LYS 87 -10.006 -1.501 -8.261
642 1HG LYS 87 2HG LYS 87 -11.943 -0.865 -6.967
643 2HG LYS 87 1HG LYS 87 -11.137 0.615 -6.441
644 1HD LYS 87 2HD LYS 87 -11.029 1.380 -8.762
645 2HD LYS 87 1HD LYS 87 -11.831 -0.100 -9.287
646 1HE LYS 87 2HE LYS 87 -13.804 0.497 -7.990
647 2HE LYS 87 1HE LYS 87 -12.998 1.954 -7.416
648 1HZ LYS 87 1HZ LYS 87 -13.653 1.358 -10.251
649 2HZ LYS 87 2HZ LYS 87 -12.920 2.781 -9.679
650 3HZ LYS 87 3HZ LYS 87 -14.520 2.411 -9.244
651 H SER 88 H SER 88 -7.587 0.499 -6.309
652 HA SER 88 HA SER 88 -8.367 1.533 -3.670
653 1HB SER 88 2HB SER 88 -6.325 0.114 -3.485
654 2HB SER 88 1HB SER 88 -5.520 1.171 -4.641
655 HG SER 88 HG SER 88 -6.670 2.254 -2.309
656 H THR 89 H THR 89 -7.558 3.785 -3.326
657 HA THR 89 HA THR 89 -7.440 5.247 -5.882
658 HB THR 89 HB THR 89 -8.642 6.380 -3.372
659 HG1 THR 89 1HG THR 89 -9.626 4.371 -4.870
660 1HG2 THR 89 1HG2 THR 89 -8.985 7.024 -6.303
661 2HG2 THR 89 2HG2 THR 89 -8.056 7.962 -5.134
662 3HG2 THR 89 3HG2 THR 89 -9.808 7.841 -4.974
663 H LEU 90 H LEU 90 -6.050 6.914 -6.018
664 HA LEU 90 HA LEU 90 -4.304 7.494 -3.717
665 1HB LEU 90 2HB LEU 90 -3.465 7.057 -6.589
666 2HB LEU 90 1HB LEU 90 -2.412 7.696 -5.344
667 HG LEU 90 HG LEU 90 -3.655 4.941 -5.313
668 1HD1 LEU 90 1HD1 LEU 90 -1.992 5.148 -7.079
669 2HD1 LEU 90 2HD1 LEU 90 -1.367 4.161 -5.758
670 3HD1 LEU 90 3HD1 LEU 90 -0.837 5.834 -5.936
671 1HD2 LEU 90 1HD2 LEU 90 -2.172 4.526 -3.441
672 2HD2 LEU 90 2HD2 LEU 90 -3.237 5.883 -3.081
673 3HD2 LEU 90 3HD2 LEU 90 -1.557 6.177 -3.532
674 H LYS 91 H LYS 91 -3.831 9.616 -3.419
675 HA LYS 91 HA LYS 91 -4.457 11.534 -5.543
676 1HB LYS 91 2HB LYS 91 -5.573 11.639 -2.733
677 2HB LYS 91 1HB LYS 91 -5.608 12.996 -3.850
678 1HG LYS 91 2HG LYS 91 -7.149 11.975 -5.247
679 2HG LYS 91 1HG LYS 91 -6.789 10.367 -4.624
680 1HD LYS 91 2HD LYS 91 -7.805 11.035 -2.458
681 2HD LYS 91 1HD LYS 91 -8.256 12.579 -3.188
682 1HE LYS 91 2HE LYS 91 -9.696 11.507 -4.753
683 2HE LYS 91 1HE LYS 91 -9.096 9.913 -4.306
684 1HZ LYS 91 1HZ LYS 91 -10.741 11.729 -2.635
685 2HZ LYS 91 2HZ LYS 91 -10.022 10.305 -2.059
686 3HZ LYS 91 3HZ LYS 91 -11.201 10.228 -3.276
687 H ARG 92 H ARG 92 -3.428 13.604 -5.228
688 HA ARG 92 HA ARG 92 -0.912 13.405 -3.857
689 1HB ARG 92 2HB ARG 92 -0.431 15.575 -4.792
690 2HB ARG 92 1HB ARG 92 -1.145 14.563 -6.037
691 1HG ARG 92 2HG ARG 92 -3.287 15.642 -5.693
692 2HG ARG 92 1HG ARG 92 -2.591 16.648 -4.427
693 1HD ARG 92 2HD ARG 92 -0.994 17.543 -6.120
694 2HD ARG 92 1HD ARG 92 -1.887 16.656 -7.357
695 HE ARG 92 HE ARG 92 -3.446 18.455 -5.694
696 1HH1 ARG 92 1HH1 ARG 92 -1.680 18.042 -8.695
697 2HH1 ARG 92 2HH1 ARG 92 -2.545 19.302 -9.515
698 1HH2 ARG 92 1HH2 ARG 92 -4.553 20.144 -6.766
699 2HH2 ARG 92 2HH2 ARG 92 -4.187 20.486 -8.437
700 H GLY 93 H GLY 93 -0.241 14.600 -2.056
701 1HA GLY 93 2HA GLY 93 -2.469 15.745 -0.494
702 2HA GLY 93 1HA GLY 93 -1.176 14.794 0.216
703 H GLU 94 H GLU 94 -1.209 16.794 1.589
704 HA GLU 94 HA GLU 94 -0.131 19.208 0.486
705 1HB GLU 94 2HB GLU 94 -0.548 18.336 3.348
706 2HB GLU 94 1HB GLU 94 -0.126 19.956 2.833
707 1HG GLU 94 2HG GLU 94 -2.657 18.499 2.147
708 2HG GLU 94 1HG GLU 94 -2.488 19.775 3.349
709 H ASN 95 H ASN 95 1.865 20.159 1.099
710 HA ASN 95 HA ASN 95 4.078 20.292 1.585
711 1HB ASN 95 2HB ASN 95 3.704 17.637 2.995
712 2HB ASN 95 1HB ASN 95 5.143 18.646 3.083
713 1HD2 ASN 95 1HD2 ASN 95 1.891 18.199 4.141
714 2HD2 ASN 95 2HD2 ASN 95 1.891 19.435 5.352
715 H GLY 96 H GLY 96 3.253 16.941 0.834
716 1HA GLY 96 2HA GLY 96 4.200 16.671 -1.681
717 2HA GLY 96 1HA GLY 96 5.659 16.537 -0.701
718 H THR 97 H THR 97 2.370 15.474 -0.007
719 HA THR 97 HA THR 97 3.473 12.832 0.615
720 HB THR 97 HB THR 97 1.433 12.611 2.090
721 HG1 THR 97 1HG THR 97 1.221 15.409 2.087
722 1HG2 THR 97 1HG2 THR 97 2.360 14.018 3.886
723 2HG2 THR 97 2HG2 THR 97 3.366 14.851 2.703
724 3HG2 THR 97 3HG2 THR 97 3.623 13.136 3.024
725 H LEU 98 H LEU 98 1.761 11.078 0.548
726 HA LEU 98 HA LEU 98 0.103 11.377 -1.866
727 1HB LEU 98 2HB LEU 98 2.011 9.835 -2.189
728 2HB LEU 98 1HB LEU 98 1.465 8.886 -0.821
729 HG LEU 98 HG LEU 98 -0.638 8.392 -2.073
730 1HD1 LEU 98 1HD1 LEU 98 -0.607 10.313 -3.580
731 2HD1 LEU 98 2HD1 LEU 98 -0.706 8.795 -4.470
732 3HD1 LEU 98 3HD1 LEU 98 0.825 9.665 -4.381
733 1HD2 LEU 98 1HD2 LEU 98 0.385 6.749 -3.561
734 2HD2 LEU 98 2HD2 LEU 98 1.207 6.807 -2.003
735 3HD2 LEU 98 3HD2 LEU 98 1.938 7.574 -3.413
736 H ILE 99 H ILE 99 -2.005 10.949 -1.631
737 HA ILE 99 HA ILE 99 -2.925 10.013 0.988
738 HB ILE 99 HB ILE 99 -4.498 11.246 -1.284
739 1HG1 ILE 99 2HG1 ILE 99 -3.630 12.430 1.361
740 2HG1 ILE 99 1HG1 ILE 99 -2.886 12.783 -0.191
741 1HG2 ILE 99 1HG2 ILE 99 -5.325 10.575 1.539
742 2HG2 ILE 99 2HG2 ILE 99 -5.863 9.754 0.074
743 3HG2 ILE 99 3HG2 ILE 99 -6.311 11.436 0.357
744 1HD1 ILE 99 1HD1 ILE 99 -4.412 14.548 0.511
745 2HD1 ILE 99 2HD1 ILE 99 -5.739 13.388 0.544
746 3HD1 ILE 99 3HD1 ILE 99 -4.951 13.783 -0.984
747 H TRP 100 H TRP 100 -3.159 7.920 1.127
748 HA TRP 100 HA TRP 100 -3.890 6.365 -1.255
749 1HB TRP 100 2HB TRP 100 -1.751 5.873 0.053
750 2HB TRP 100 1HB TRP 100 -2.789 5.327 1.362
751 HD1 TRP 100 HD TRP 100 -4.778 3.992 -1.138
752 HE1 TRP 100 1HE TRP 100 -4.084 1.639 -1.908
753 HE3 TRP 100 3HE TRP 100 -0.011 3.934 0.686
754 HZ2 TRP 100 2HZ TRP 100 -1.802 -0.028 -1.756
755 HZ3 TRP 100 3HZ TRP 100 1.364 1.930 0.340
756 HH2 TRP 100 HH TRP 100 0.486 -0.016 -0.859
757 H GLU 101 H GLU 101 -5.995 5.893 -1.360
758 HA GLU 101 HA GLU 101 -7.408 5.453 1.177
759 1HB GLU 101 2HB GLU 101 -8.303 6.613 -1.423
760 2HB GLU 101 1HB GLU 101 -9.477 5.904 -0.330
761 1HG GLU 101 2HG GLU 101 -8.836 7.423 1.420
762 2HG GLU 101 1HG GLU 101 -7.539 8.070 0.427
763 H GLN 102 H GLN 102 -8.347 3.667 1.561
764 HA GLN 102 HA GLN 102 -8.883 1.671 -0.482
765 1HB GLN 102 2HB GLN 102 -6.395 1.650 0.704
766 2HB GLN 102 1HB GLN 102 -7.302 0.557 1.737
767 1HG GLN 102 2HG GLN 102 -7.355 0.219 -1.231
768 2HG GLN 102 1HG GLN 102 -5.992 -0.363 -0.287
769 1HE2 GLN 102 1HE2 GLN 102 -6.400 -2.470 -0.845
770 2HE2 GLN 102 2HE2 GLN 102 -7.712 -3.371 -0.172
771 H ASN 103 H ASN 103 -10.696 0.607 0.074
772 HA ASN 103 HA ASN 103 -12.330 -0.392 1.314
773 1HB ASN 103 2HB ASN 103 -9.985 -0.713 2.836
774 2HB ASN 103 1HB ASN 103 -11.218 -0.174 3.967
775 1HD2 ASN 103 1HD2 ASN 103 -10.189 -2.668 1.820
776 2HD2 ASN 103 2HD2 ASN 103 -11.309 -3.879 2.352
777 H GLY 104 H GLY 104 -11.725 2.675 1.264
778 1HA GLY 104 2HA GLY 104 -13.228 4.400 1.813
779 2HA GLY 104 1HA GLY 104 -13.906 3.380 3.074
780 H GLN 105 H GLN 105 -10.705 3.027 3.507
781 HA GLN 105 HA GLN 105 -10.617 5.085 5.562
782 1HB GLN 105 2HB GLN 105 -8.658 2.883 4.913
783 2HB GLN 105 1HB GLN 105 -8.642 3.897 6.349
784 1HG GLN 105 2HG GLN 105 -10.960 2.136 5.638
785 2HG GLN 105 1HG GLN 105 -9.596 1.583 6.587
786 1HE2 GLN 105 1HE2 GLN 105 -12.393 3.621 6.519
787 2HE2 GLN 105 2HE2 GLN 105 -12.445 3.960 8.213
788 H ARG 106 H ARG 106 -9.324 6.813 5.510
789 HA ARG 106 HA ARG 106 -7.804 7.308 3.054
790 1HB ARG 106 2HB ARG 106 -9.645 8.874 3.681
791 2HB ARG 106 1HB ARG 106 -8.756 9.278 5.140
792 1HG ARG 106 2HG ARG 106 -7.005 10.290 3.891
793 2HG ARG 106 1HG ARG 106 -7.668 9.687 2.368
794 1HD ARG 106 2HD ARG 106 -9.666 11.052 2.691
795 2HD ARG 106 1HD ARG 106 -9.025 11.637 4.225
796 HE ARG 106 HE ARG 106 -7.159 12.585 2.809
797 1HH1 ARG 106 1HH1 ARG 106 -10.370 12.065 1.539
798 2HH1 ARG 106 2HH1 ARG 106 -10.297 13.395 0.425
799 1HH2 ARG 106 1HH2 ARG 106 -7.043 14.345 1.334
800 2HH2 ARG 106 2HH2 ARG 106 -8.388 14.672 0.284
801 H LYS 107 H LYS 107 -5.667 7.037 3.178
802 HA LYS 107 HA LYS 107 -4.351 7.534 5.771
803 1HB LYS 107 2HB LYS 107 -4.248 5.268 3.970
804 2HB LYS 107 1HB LYS 107 -2.646 5.927 4.263
805 1HG LYS 107 2HG LYS 107 -4.564 5.182 6.448
806 2HG LYS 107 1HG LYS 107 -3.336 4.097 5.804
807 1HD LYS 107 2HD LYS 107 -2.892 6.731 7.203
808 2HD LYS 107 1HD LYS 107 -2.492 5.123 7.811
809 1HE LYS 107 2HE LYS 107 -1.002 4.888 5.781
810 2HE LYS 107 1HE LYS 107 -1.255 6.606 5.517
811 1HZ LYS 107 1HZ LYS 107 -0.391 6.929 7.844
812 2HZ LYS 107 2HZ LYS 107 0.746 6.401 6.709
813 3HZ LYS 107 3HZ LYS 107 0.088 5.297 7.813
814 H THR 108 H THR 108 -2.871 9.074 5.830
815 HA THR 108 HA THR 108 -1.890 10.221 3.330
816 HB THR 108 HB THR 108 -1.494 11.203 6.168
817 HG1 THR 108 1HG THR 108 -3.116 12.629 4.449
818 1HG2 THR 108 1HG2 THR 108 -0.891 13.328 5.076
819 2HG2 THR 108 2HG2 THR 108 -1.027 12.544 3.502
820 3HG2 THR 108 3HG2 THR 108 0.216 12.027 4.641
821 H MET 109 H MET 109 -0.017 9.564 2.529
822 HA MET 109 HA MET 109 1.935 8.270 4.320
823 1HB MET 109 2HB MET 109 1.589 8.084 1.320
824 2HB MET 109 1HB MET 109 2.839 7.271 2.241
825 1HG MET 109 2HG MET 109 -0.111 6.811 2.605
826 2HG MET 109 1HG MET 109 0.945 5.815 1.605
827 1HE MET 109 1HE MET 109 -0.719 4.319 3.635
828 2HE MET 109 2HE MET 109 0.462 3.329 4.500
829 3HE MET 109 3HE MET 109 0.593 3.540 2.753
830 H THR 110 H THR 110 3.955 9.124 4.556
831 HA THR 110 HA THR 110 4.591 11.590 3.105
832 HB THR 110 HB THR 110 6.488 10.555 5.114
833 HG1 THR 110 1HG THR 110 3.947 11.583 5.944
834 1HG2 THR 110 1HG2 THR 110 6.452 12.899 5.839
835 2HG2 THR 110 2HG2 THR 110 5.139 13.225 4.708
836 3HG2 THR 110 3HG2 THR 110 6.730 12.764 4.103
837 H ARG 111 H ARG 111 6.565 11.798 1.902
838 HA ARG 111 HA ARG 111 7.499 9.224 0.884
839 1HB ARG 111 2HB ARG 111 6.747 10.916 -0.748
840 2HB ARG 111 1HB ARG 111 8.015 12.004 -0.196
841 1HG ARG 111 2HG ARG 111 9.676 10.814 -1.219
842 2HG ARG 111 1HG ARG 111 8.795 9.289 -1.119
843 1HD ARG 111 2HD ARG 111 8.931 9.995 -3.418
844 2HD ARG 111 1HD ARG 111 7.260 10.090 -2.872
845 HE ARG 111 HE ARG 111 8.819 12.548 -2.764
846 1HH1 ARG 111 1HH1 ARG 111 6.474 10.595 -4.472
847 2HH1 ARG 111 2HH1 ARG 111 5.881 11.909 -5.431
848 1HH2 ARG 111 1HH2 ARG 111 8.072 14.287 -4.061
849 2HH2 ARG 111 2HH2 ARG 111 6.785 14.009 -5.207
850 H ILE 112 H ILE 112 9.393 8.395 1.314
851 HA ILE 112 HA ILE 112 11.226 9.795 3.067
852 HB ILE 112 HB ILE 112 11.482 7.057 1.830
853 1HG1 ILE 112 2HG1 ILE 112 9.403 7.392 3.216
854 2HG1 ILE 112 1HG1 ILE 112 10.486 6.156 3.821
855 1HG2 ILE 112 1HG2 ILE 112 12.868 8.288 4.207
856 2HG2 ILE 112 2HG2 ILE 112 13.597 7.906 2.648
857 3HG2 ILE 112 3HG2 ILE 112 13.020 6.609 3.694
858 1HD1 ILE 112 1HD1 ILE 112 10.016 8.900 4.898
859 2HD1 ILE 112 2HD1 ILE 112 11.412 7.930 5.365
860 3HD1 ILE 112 3HD1 ILE 112 9.784 7.345 5.696
861 H GLU 113 H GLU 113 13.422 10.177 2.557
862 HA GLU 113 HA GLU 113 13.833 10.735 -0.279
863 1HB GLU 113 2HB GLU 113 15.418 11.607 2.127
864 2HB GLU 113 1HB GLU 113 15.717 12.124 0.478
865 1HG GLU 113 2HG GLU 113 13.569 13.230 0.391
866 2HG GLU 113 1HG GLU 113 13.172 12.635 2.002
867 H SER 114 H SER 114 14.443 8.928 -1.197
868 HA SER 114 HA SER 114 17.114 7.972 -0.704
869 1HB SER 114 2HB SER 114 15.621 6.556 0.775
870 2HB SER 114 1HB SER 114 14.816 5.993 -0.689
871 HG SER 114 HG SER 114 16.363 4.505 -0.360
872 H LYS 115 H LYS 115 17.655 6.302 -2.502
873 HA LYS 115 HA LYS 115 17.924 5.945 -4.735
874 1HB LYS 115 2HB LYS 115 14.928 6.352 -4.732
875 2HB LYS 115 1HB LYS 115 15.845 5.735 -6.098
876 1HG LYS 115 2HG LYS 115 16.552 3.820 -4.759
877 2HG LYS 115 1HG LYS 115 15.624 4.435 -3.390
878 1HD LYS 115 2HD LYS 115 13.566 4.230 -4.654
879 2HD LYS 115 1HD LYS 115 14.468 3.713 -6.080
880 1HE LYS 115 2HE LYS 115 15.221 1.725 -4.874
881 2HE LYS 115 1HE LYS 115 14.316 2.246 -3.452
882 1HZ LYS 115 1HZ LYS 115 12.280 2.008 -4.627
883 2HZ LYS 115 2HZ LYS 115 13.160 0.574 -4.857
884 3HZ LYS 115 3HZ LYS 115 13.078 1.725 -6.095
885 H THR 116 H THR 116 18.226 8.600 -3.713
886 HA THR 116 HA THR 116 17.087 10.511 -5.520
887 HB THR 116 HB THR 116 19.451 10.999 -3.749
888 HG1 THR 116 1HG THR 116 16.791 10.397 -3.035
889 1HG2 THR 116 1HG2 THR 116 17.048 12.692 -4.457
890 2HG2 THR 116 2HG2 THR 116 18.652 12.843 -5.173
891 3HG2 THR 116 3HG2 THR 116 18.416 13.198 -3.463
892 H GLY 117 H GLY 117 18.306 8.655 -7.051
893 1HA GLY 117 2HA GLY 117 19.526 9.035 -9.090
894 2HA GLY 117 1HA GLY 117 20.595 10.111 -8.194
895 H ARG 118 H ARG 118 19.580 7.078 -6.856
896 HA ARG 118 HA ARG 118 22.112 5.828 -7.529
897 1HB ARG 118 2HB ARG 118 21.629 7.063 -5.017
898 2HB ARG 118 1HB ARG 118 21.601 5.325 -4.760
899 1HG ARG 118 2HG ARG 118 23.823 6.834 -6.116
900 2HG ARG 118 1HG ARG 118 23.831 6.295 -4.437
901 1HD ARG 118 2HD ARG 118 23.865 4.024 -5.055
902 2HD ARG 118 1HD ARG 118 23.423 4.389 -6.723
903 HE ARG 118 HE ARG 118 25.759 5.653 -6.533
904 1HH1 ARG 118 1HH1 ARG 118 24.840 2.445 -5.442
905 2HH1 ARG 118 2HH1 ARG 118 26.408 1.763 -5.728
906 1HH2 ARG 118 1HH2 ARG 118 27.825 4.752 -6.889
907 2HH2 ARG 118 2HH2 ARG 118 28.105 3.071 -6.533
908 H GLU 119 H GLU 119 21.858 3.803 -7.987
909 HA GLU 119 HA GLU 119 19.428 2.467 -8.110
910 1HB GLU 119 2HB GLU 119 21.585 1.937 -9.334
911 2HB GLU 119 1HB GLU 119 22.130 1.141 -7.867
912 1HG GLU 119 2HG GLU 119 21.290 -0.508 -9.368
913 2HG GLU 119 1HG GLU 119 20.171 -0.363 -8.010
914 H GLU 120 H GLU 120 18.190 1.628 -6.570
915 HA GLU 120 HA GLU 120 19.489 0.373 -4.251
916 1HB GLU 120 2HB GLU 120 18.465 2.508 -3.558
917 2HB GLU 120 1HB GLU 120 16.915 1.962 -4.181
918 1HG GLU 120 2HG GLU 120 16.853 0.179 -2.541
919 2HG GLU 120 1HG GLU 120 18.446 0.645 -1.945
920 H LYS 121 H LYS 121 19.202 -1.699 -4.461
921 HA LYS 121 HA LYS 121 17.063 -2.783 -6.064
922 1HB LYS 121 2HB LYS 121 19.398 -3.655 -6.150
923 2HB LYS 121 1HB LYS 121 19.201 -4.240 -4.503
924 1HG LYS 121 2HG LYS 121 17.234 -5.579 -5.366
925 2HG LYS 121 1HG LYS 121 17.797 -5.167 -6.986
926 1HD LYS 121 2HD LYS 121 19.979 -6.181 -6.458
927 2HD LYS 121 1HD LYS 121 19.362 -6.637 -4.868
928 1HE LYS 121 2HE LYS 121 18.385 -7.594 -7.552
929 2HE LYS 121 1HE LYS 121 19.219 -8.543 -6.324
930 1HZ LYS 121 1HZ LYS 121 16.812 -8.931 -6.351
931 2HZ LYS 121 2HZ LYS 121 16.537 -7.301 -5.980
932 3HZ LYS 121 3HZ LYS 121 17.334 -8.303 -4.865
933 H ASP 122 H ASP 122 15.443 -4.153 -5.397
934 HA ASP 122 HA ASP 122 14.449 -3.845 -2.736
935 1HB ASP 122 2HB ASP 122 13.498 -5.970 -4.649
936 2HB ASP 122 1HB ASP 122 12.573 -5.074 -3.450
937 H GLU 123 H GLU 123 13.997 -5.660 -1.266
938 HA GLU 123 HA GLU 123 15.984 -7.809 -1.535
939 1HB GLU 123 2HB GLU 123 16.224 -6.339 0.470
940 2HB GLU 123 1HB GLU 123 14.631 -6.865 0.998
941 1HG GLU 123 2HG GLU 123 16.481 -8.049 2.124
942 2HG GLU 123 1HG GLU 123 15.396 -9.126 1.246
943 H LYS 124 H LYS 124 15.355 -9.945 -1.062
944 HA LYS 124 HA LYS 124 12.464 -10.402 -1.371
945 1HB LYS 124 2HB LYS 124 13.744 -11.075 -3.348
946 2HB LYS 124 1HB LYS 124 14.784 -12.077 -2.347
947 1HG LYS 124 2HG LYS 124 12.858 -13.490 -1.778
948 2HG LYS 124 1HG LYS 124 11.839 -12.497 -2.822
949 1HD LYS 124 2HD LYS 124 13.233 -13.095 -4.745
950 2HD LYS 124 1HD LYS 124 14.250 -14.086 -3.700
951 1HE LYS 124 2HE LYS 124 12.329 -15.515 -3.190
952 2HE LYS 124 1HE LYS 124 11.309 -14.518 -4.225
953 1HZ LYS 124 1HZ LYS 124 13.652 -16.125 -5.096
954 2HZ LYS 124 2HZ LYS 124 12.732 -15.120 -6.105
955 3HZ LYS 124 3HZ LYS 124 12.021 -16.484 -5.398
956 H SER 125 H SER 125 11.566 -11.202 0.391
957 HA SER 125 HA SER 125 12.966 -13.307 1.868
958 1HB SER 125 2HB SER 125 11.558 -10.953 3.157
959 2HB SER 125 1HB SER 125 12.273 -12.319 4.013
960 HG SER 125 HG SER 125 14.102 -11.303 2.365
961 H LYS 126 H LYS 126 11.691 -15.031 2.203
962 HA LYS 126 HA LYS 126 8.838 -14.737 1.599
963 1HB LYS 126 2HB LYS 126 10.173 -16.464 0.369
964 2HB LYS 126 1HB LYS 126 10.429 -17.290 1.900
965 1HG LYS 126 2HG LYS 126 8.003 -17.576 2.134
966 2HG LYS 126 1HG LYS 126 7.773 -16.793 0.571
967 1HD LYS 126 2HD LYS 126 9.170 -18.567 -0.462
968 2HD LYS 126 1HD LYS 126 9.237 -19.375 1.105
969 1HE LYS 126 2HE LYS 126 6.759 -18.804 -0.517
970 2HE LYS 126 1HE LYS 126 7.523 -20.374 -0.291
971 1HZ LYS 126 1HZ LYS 126 7.085 -20.086 2.142
972 2HZ LYS 126 2HZ LYS 126 5.701 -20.268 1.179
973 3HZ LYS 126 3HZ LYS 126 6.134 -18.731 1.752
974 H SER 127 H SER 127 7.726 -14.224 3.338
975 HA SER 127 HA SER 127 8.378 -15.523 5.888
976 1HB SER 127 2HB SER 127 8.593 -13.092 5.924
977 2HB SER 127 1HB SER 127 6.957 -12.912 5.297
978 HG SER 127 HG SER 127 6.438 -12.808 7.325
979 H LEU 128 H LEU 128 6.966 -16.959 6.680
980 HA LEU 128 HA LEU 128 4.309 -17.206 5.536
981 1HB LEU 128 2HB LEU 128 5.632 -19.218 6.149
982 2HB LEU 128 1HB LEU 128 5.587 -18.715 7.827
983 HG LEU 128 HG LEU 128 3.123 -18.941 7.811
984 1HD1 LEU 128 1HD1 LEU 128 2.023 -20.069 5.960
985 2HD1 LEU 128 2HD1 LEU 128 3.538 -20.100 5.059
986 3HD1 LEU 128 3HD1 LEU 128 2.758 -18.560 5.421
987 1HD2 LEU 128 1HD2 LEU 128 3.081 -21.396 7.748
988 2HD2 LEU 128 2HD2 LEU 128 4.488 -20.775 8.610
989 3HD2 LEU 128 3HD2 LEU 128 4.662 -21.392 6.966
990 H GLU 129 H GLU 129 2.958 -15.617 6.164
991 HA GLU 129 HA GLU 129 2.830 -14.902 8.994
992 1HB GLU 129 2HB GLU 129 2.969 -12.457 8.235
993 2HB GLU 129 1HB GLU 129 4.468 -13.380 8.291
994 1HG GLU 129 2HG GLU 129 4.369 -13.746 5.899
995 2HG GLU 129 1HG GLU 129 2.823 -12.900 5.813
996 H HIS 130 H HIS 130 1.036 -13.617 9.571
997 HA HIS 130 HA HIS 130 -0.982 -13.071 7.518
998 1HB HIS 130 2HB HIS 130 -1.529 -14.550 10.107
999 2HB HIS 130 1HB HIS 130 -2.781 -13.879 9.068
1000 HD1 HIS 130 1HD HIS 130 -3.172 -15.080 6.758
1001 HD2 HIS 130 2HD HIS 130 -0.446 -16.961 9.276
1002 HE1 HIS 130 1HE HIS 130 -2.833 -17.375 5.794
1003 HE2 HIS 130 2HE HIS 130 -1.071 -18.447 7.250
1004 H HIS 131 H HIS 131 1.023 -11.640 9.163
1005 HA HIS 131 HA HIS 131 -0.016 -10.147 11.240
1006 1HB HIS 131 2HB HIS 131 1.689 -8.454 10.708
1007 2HB HIS 131 1HB HIS 131 2.353 -10.077 10.642
1008 HD1 HIS 131 1HD HIS 131 3.160 -7.240 9.054
1009 HD2 HIS 131 2HD HIS 131 1.605 -10.783 7.532
1010 HE1 HIS 131 1HE HIS 131 3.827 -7.296 6.643
1011 HE2 HIS 131 2HE HIS 131 3.176 -9.599 5.859
1012 H HIS 132 H HIS 132 -1.211 -8.353 11.462
1013 HA HIS 132 HA HIS 132 -2.159 -6.930 9.095
1014 1HB HIS 132 2HB HIS 132 -3.806 -8.640 10.865
1015 2HB HIS 132 1HB HIS 132 -4.479 -7.058 10.501
1016 HD1 HIS 132 1HD HIS 132 -5.873 -6.976 8.486
1017 HD2 HIS 132 2HD HIS 132 -3.136 -10.105 8.336
1018 HE1 HIS 132 1HE HIS 132 -6.366 -8.210 6.349
1019 HE2 HIS 132 2HE HIS 132 -4.874 -10.236 6.418
1020 H HIS 133 H HIS 133 -0.913 -5.120 9.892
1021 HA HIS 133 HA HIS 133 -1.629 -4.025 12.447
1022 1HB HIS 133 2HB HIS 133 -0.228 -2.182 11.989
1023 2HB HIS 133 1HB HIS 133 0.574 -3.548 11.239
1024 HD1 HIS 133 1HD HIS 133 1.245 -3.256 8.832
1025 HD2 HIS 133 2HD HIS 133 -1.540 -0.415 10.064
1026 HE1 HIS 133 1HE HIS 133 1.078 -1.601 6.950
1027 HE2 HIS 133 2HE HIS 133 -0.398 0.242 7.833
1028 H HIS 134 H HIS 134 -3.310 -2.779 12.950
1029 HA HIS 134 HA HIS 134 -4.935 -1.658 10.794
1030 1HB HIS 134 2HB HIS 134 -6.976 -2.765 11.568
1031 2HB HIS 134 1HB HIS 134 -5.777 -3.950 11.060
1032 HD1 HIS 134 1HD HIS 134 -7.497 -2.606 14.139
1033 HD2 HIS 134 2HD HIS 134 -4.908 -5.686 13.048
1034 HE1 HIS 134 1HE HIS 134 -7.398 -4.156 16.121
1035 HE2 HIS 134 2HE HIS 134 -5.759 -5.965 15.479
1036 H HIS 135 H HIS 135 -6.926 -0.565 11.769
1037 HA HIS 135 HA HIS 135 -6.049 1.179 13.887
1038 1HB HIS 135 2HB HIS 135 -7.488 1.793 11.811
1039 2HB HIS 135 1HB HIS 135 -8.831 1.116 12.728
1040 HD1 HIS 135 1HD HIS 135 -9.445 2.376 14.992
1041 HD2 HIS 135 2HD HIS 135 -6.725 4.327 12.520
1042 HE1 HIS 135 1HE HIS 135 -9.374 4.756 15.803
1043 HE2 HIS 135 2HE HIS 135 -7.634 5.889 14.371
Start of MODEL 2
1 1H MET 1 1HT MET 1 14.153 42.662 1.653
2 2H MET 1 2HT MET 1 13.948 44.049 2.599
3 3H MET 1 3HT MET 1 15.156 44.007 1.406
4 HA MET 1 HA MET 1 12.224 43.944 0.964
5 1HB MET 1 2HB MET 1 14.301 46.029 0.263
6 2HB MET 1 1HB MET 1 12.604 46.106 -0.173
7 1HG MET 1 2HG MET 1 11.983 46.231 2.157
8 2HG MET 1 1HG MET 1 13.681 46.115 2.629
9 1HE MET 1 1HE MET 1 11.839 48.461 3.680
10 2HE MET 1 2HE MET 1 12.914 49.847 3.465
11 3HE MET 1 3HE MET 1 13.553 48.311 4.052
12 H ILE 2 H ILE 2 12.271 42.092 -0.317
13 HA ILE 2 HA ILE 2 13.378 42.547 -2.997
14 HB ILE 2 HB ILE 2 14.080 40.202 -3.203
15 1HG1 ILE 2 2HG1 ILE 2 13.606 40.000 -0.224
16 2HG1 ILE 2 1HG1 ILE 2 12.544 39.316 -1.446
17 1HG2 ILE 2 1HG2 ILE 2 15.397 41.641 -0.908
18 2HG2 ILE 2 2HG2 ILE 2 15.759 41.845 -2.622
19 3HG2 ILE 2 3HG2 ILE 2 16.105 40.311 -1.823
20 1HD1 ILE 2 1HD1 ILE 2 14.021 37.632 -0.496
21 2HD1 ILE 2 2HD1 ILE 2 15.421 38.565 -1.025
22 3HD1 ILE 2 3HD1 ILE 2 14.327 37.864 -2.217
23 H MET 3 H MET 3 12.377 41.089 -4.617
24 HA MET 3 HA MET 3 9.779 40.008 -3.768
25 1HB MET 3 2HB MET 3 10.340 41.650 -6.244
26 2HB MET 3 1HB MET 3 8.877 40.703 -6.018
27 1HG MET 3 2HG MET 3 8.334 42.032 -4.037
28 2HG MET 3 1HG MET 3 9.790 42.992 -4.292
29 1HE MET 3 1HE MET 3 6.173 42.932 -7.168
30 2HE MET 3 2HE MET 3 6.287 41.975 -5.691
31 3HE MET 3 3HE MET 3 7.323 41.599 -7.068
32 H VAL 4 H VAL 4 10.143 37.888 -3.870
33 HA VAL 4 HA VAL 4 11.922 36.618 -5.651
34 HB VAL 4 HB VAL 4 11.254 35.558 -3.555
35 1HG1 VAL 4 1HG1 VAL 4 8.956 36.306 -3.421
36 2HG1 VAL 4 2HG1 VAL 4 9.027 34.551 -3.280
37 3HG1 VAL 4 3HG1 VAL 4 8.516 35.293 -4.796
38 1HG2 VAL 4 1HG2 VAL 4 10.415 33.920 -5.950
39 2HG2 VAL 4 2HG2 VAL 4 10.882 33.285 -4.372
40 3HG2 VAL 4 3HG2 VAL 4 12.066 34.135 -5.366
41 H SER 5 H SER 5 11.643 35.724 -7.639
42 HA SER 5 HA SER 5 8.965 35.911 -8.848
43 1HB SER 5 2HB SER 5 11.527 36.738 -10.232
44 2HB SER 5 1HB SER 5 9.880 36.906 -10.844
45 HG SER 5 HG SER 5 10.082 38.073 -8.432
46 H GLY 6 H GLY 6 8.384 34.179 -10.012
47 1HA GLY 6 2HA GLY 6 9.191 32.558 -11.744
48 2HA GLY 6 1HA GLY 6 10.478 32.188 -10.605
49 H CYS 7 H CYS 7 9.849 30.004 -10.612
50 HA CYS 7 HA CYS 7 8.875 28.159 -9.729
51 1HB CYS 7 2HB CYS 7 7.636 30.145 -7.814
52 2HB CYS 7 1HB CYS 7 7.622 28.396 -7.607
53 HG CYS 7 HG CYS 7 10.697 28.919 -8.034
54 H GLN 8 H GLN 8 7.474 29.906 -11.769
55 HA GLN 8 HA GLN 8 4.850 28.614 -11.510
56 1HB GLN 8 2HB GLN 8 3.880 30.598 -12.703
57 2HB GLN 8 1HB GLN 8 4.449 30.927 -11.073
58 1HG GLN 8 2HG GLN 8 6.580 31.780 -12.133
59 2HG GLN 8 1HG GLN 8 5.733 31.692 -13.678
60 1HE2 GLN 8 1HE2 GLN 8 5.847 33.905 -13.994
61 2HE2 GLN 8 2HE2 GLN 8 4.873 35.021 -13.080
62 H GLN 9 H GLN 9 3.826 28.041 -13.476
63 HA GLN 9 HA GLN 9 3.758 27.016 -15.482
64 1HB GLN 9 2HB GLN 9 5.917 29.013 -16.126
65 2HB GLN 9 1HB GLN 9 5.285 27.877 -17.310
66 1HG GLN 9 2HG GLN 9 2.990 28.827 -16.739
67 2HG GLN 9 1HG GLN 9 3.867 30.136 -15.944
68 1HE2 GLN 9 1HE2 GLN 9 3.133 28.591 -18.959
69 2HE2 GLN 9 2HE2 GLN 9 3.679 29.874 -19.988
70 H GLN 10 H GLN 10 5.626 26.147 -13.303
71 HA GLN 10 HA GLN 10 7.632 24.665 -14.811
72 1HB GLN 10 2HB GLN 10 8.240 25.637 -12.616
73 2HB GLN 10 1HB GLN 10 7.007 24.648 -11.846
74 1HG GLN 10 2HG GLN 10 8.213 22.628 -12.655
75 2HG GLN 10 1HG GLN 10 9.500 23.687 -13.232
76 1HE2 GLN 10 1HE2 GLN 10 7.912 22.342 -10.456
77 2HE2 GLN 10 2HE2 GLN 10 9.119 22.787 -9.298
78 H LYS 11 H LYS 11 7.193 22.705 -15.629
79 HA LYS 11 HA LYS 11 5.050 21.119 -14.372
80 1HB LYS 11 2HB LYS 11 5.751 21.394 -17.292
81 2HB LYS 11 1HB LYS 11 4.791 20.059 -16.680
82 1HG LYS 11 2HG LYS 11 3.248 21.602 -17.521
83 2HG LYS 11 1HG LYS 11 3.198 21.811 -15.771
84 1HD LYS 11 2HD LYS 11 4.495 23.802 -15.888
85 2HD LYS 11 1HD LYS 11 4.876 23.524 -17.590
86 1HE LYS 11 2HE LYS 11 2.127 24.078 -16.476
87 2HE LYS 11 1HE LYS 11 3.157 25.258 -17.286
88 1HZ LYS 11 1HZ LYS 11 1.695 24.490 -18.924
89 2HZ LYS 11 2HZ LYS 11 1.843 22.873 -18.446
90 3HZ LYS 11 3HZ LYS 11 3.135 23.643 -19.231
91 H GLU 12 H GLU 12 5.763 19.323 -13.468
92 HA GLU 12 HA GLU 12 8.059 17.953 -14.715
93 1HB GLU 12 2HB GLU 12 7.213 17.865 -11.806
94 2HB GLU 12 1HB GLU 12 8.575 17.004 -12.506
95 1HG GLU 12 2HG GLU 12 9.655 19.132 -13.025
96 2HG GLU 12 1HG GLU 12 8.284 19.993 -12.323
97 H GLU 13 H GLU 13 7.435 16.152 -15.739
98 HA GLU 13 HA GLU 13 4.852 15.026 -15.282
99 1HB GLU 13 2HB GLU 13 7.098 14.473 -17.178
100 2HB GLU 13 1HB GLU 13 5.742 13.385 -17.039
101 1HG GLU 13 2HG GLU 13 4.233 15.306 -17.564
102 2HG GLU 13 1HG GLU 13 5.680 16.263 -17.872
103 H THR 14 H THR 14 7.457 14.786 -13.609
104 HA THR 14 HA THR 14 8.032 12.094 -13.163
105 HB THR 14 HB THR 14 8.052 14.234 -11.028
106 HG1 THR 14 1HG THR 14 10.308 14.488 -11.915
107 1HG2 THR 14 1HG2 THR 14 9.846 11.854 -11.523
108 2HG2 THR 14 2HG2 THR 14 8.574 11.942 -10.304
109 3HG2 THR 14 3HG2 THR 14 9.982 12.999 -10.189
110 HA PRO 15 HA PRO 15 4.048 10.738 -11.648
111 1HB PRO 15 2HB PRO 15 5.714 8.504 -10.606
112 2HB PRO 15 1HB PRO 15 4.251 8.453 -11.598
113 1HG PRO 15 2HG PRO 15 6.639 7.967 -12.669
114 2HG PRO 15 1HG PRO 15 5.412 8.886 -13.559
115 1HD PRO 15 2HD PRO 15 7.848 9.864 -12.132
116 2HD PRO 15 1HD PRO 15 7.127 10.430 -13.653
117 H PHE 16 H PHE 16 3.327 11.846 -9.955
118 HA PHE 16 HA PHE 16 4.818 12.486 -7.663
119 1HB PHE 16 2HB PHE 16 2.780 13.436 -6.778
120 2HB PHE 16 1HB PHE 16 2.858 13.782 -8.501
121 HD1 PHE 16 2HD PHE 16 1.431 12.446 -10.073
122 HD2 PHE 16 1HD PHE 16 0.987 12.234 -5.849
123 HE1 PHE 16 2HE PHE 16 -0.803 11.466 -10.363
124 HE2 PHE 16 1HE PHE 16 -1.249 11.244 -6.130
125 HZ PHE 16 HZ PHE 16 -2.146 10.854 -8.389
126 H TYR 17 H TYR 17 2.880 9.715 -8.396
127 HA TYR 17 HA TYR 17 2.531 8.951 -5.628
128 1HB TYR 17 2HB TYR 17 1.225 7.104 -6.526
129 2HB TYR 17 1HB TYR 17 0.716 8.615 -7.262
130 HD1 TYR 17 1HD TYR 17 1.698 9.164 -9.591
131 HD2 TYR 17 2HD TYR 17 1.794 5.281 -7.854
132 HE1 TYR 17 1HE TYR 17 2.007 8.181 -11.824
133 HE2 TYR 17 2HE TYR 17 2.108 4.286 -10.078
134 HH TYR 17 HH TYR 17 2.937 6.095 -12.805
135 H TYR 18 H TYR 18 4.926 8.555 -7.955
136 HA TYR 18 HA TYR 18 5.592 5.815 -7.251
137 1HB TYR 18 2HB TYR 18 5.747 6.713 -9.602
138 2HB TYR 18 1HB TYR 18 7.103 7.699 -9.073
139 HD1 TYR 18 1HD TYR 18 5.946 4.254 -9.687
140 HD2 TYR 18 2HD TYR 18 9.278 6.737 -8.753
141 HE1 TYR 18 1HE TYR 18 7.467 2.386 -10.175
142 HE2 TYR 18 2HE TYR 18 10.807 4.872 -9.234
143 HH TYR 18 HH TYR 18 9.836 2.080 -10.861
144 H GLY 19 H GLY 19 7.360 5.188 -6.065
145 1HA GLY 19 2HA GLY 19 9.689 6.075 -5.420
146 2HA GLY 19 1HA GLY 19 8.757 7.336 -4.625
147 H THR 20 H THR 20 9.849 6.624 -2.686
148 HA THR 20 HA THR 20 8.589 4.234 -1.504
149 HB THR 20 HB THR 20 11.125 5.483 -0.457
150 HG1 THR 20 1HG THR 20 10.803 3.642 -2.600
151 1HG2 THR 20 1HG2 THR 20 9.995 2.684 -0.322
152 2HG2 THR 20 2HG2 THR 20 9.945 3.880 0.972
153 3HG2 THR 20 3HG2 THR 20 11.494 3.233 0.432
154 H TRP 21 H TRP 21 7.199 4.632 0.114
155 HA TRP 21 HA TRP 21 7.194 7.364 1.224
156 1HB TRP 21 2HB TRP 21 4.809 5.571 0.734
157 2HB TRP 21 1HB TRP 21 4.770 7.221 1.341
158 HD1 TRP 21 HD TRP 21 5.077 5.227 -1.868
159 HE1 TRP 21 1HE TRP 21 4.963 6.836 -3.874
160 HE3 TRP 21 3HE TRP 21 5.355 9.668 0.640
161 HZ2 TRP 21 2HZ TRP 21 4.992 9.614 -4.329
162 HZ3 TRP 21 3HZ TRP 21 5.307 11.762 -0.653
163 HH2 TRP 21 HH TRP 21 5.130 11.734 -3.090
164 H ASP 22 H ASP 22 7.070 7.637 3.339
165 HA ASP 22 HA ASP 22 6.821 5.267 5.073
166 1HB ASP 22 2HB ASP 22 8.997 6.338 5.290
167 2HB ASP 22 1HB ASP 22 8.240 7.906 5.542
168 H GLU 23 H GLU 23 5.537 5.490 6.992
169 HA GLU 23 HA GLU 23 3.113 6.865 6.595
170 1HB GLU 23 2HB GLU 23 4.236 5.702 9.147
171 2HB GLU 23 1HB GLU 23 2.560 6.174 8.894
172 1HG GLU 23 2HG GLU 23 2.355 4.499 7.130
173 2HG GLU 23 1HG GLU 23 4.032 4.020 7.396
174 H GLY 24 H GLY 24 6.081 7.869 8.066
175 1HA GLY 24 2HA GLY 24 6.406 10.274 8.239
176 2HA GLY 24 1HA GLY 24 4.752 10.395 8.822
177 H ARG 25 H ARG 25 4.463 8.727 10.796
178 HA ARG 25 HA ARG 25 6.620 8.539 12.615
179 1HB ARG 25 2HB ARG 25 6.134 11.056 12.519
180 2HB ARG 25 1HB ARG 25 4.607 10.683 13.307
181 1HG ARG 25 2HG ARG 25 5.781 9.785 15.222
182 2HG ARG 25 1HG ARG 25 7.331 10.057 14.422
183 1HD ARG 25 2HD ARG 25 6.836 12.472 14.353
184 2HD ARG 25 1HD ARG 25 5.338 12.167 15.231
185 HE ARG 25 HE ARG 25 7.354 11.056 16.757
186 1HH1 ARG 25 1HH1 ARG 25 6.577 14.258 15.526
187 2HH1 ARG 25 2HH1 ARG 25 7.283 15.076 16.893
188 1HH2 ARG 25 1HH2 ARG 25 8.288 12.158 18.528
189 2HH2 ARG 25 2HH2 ARG 25 8.243 13.896 18.578
190 H ALA 26 H ALA 26 5.737 8.013 14.859
191 HA ALA 26 HA ALA 26 4.378 6.926 16.315
192 1HB ALA 26 1HB ALA 26 1.989 6.773 15.971
193 2HB ALA 26 2HB ALA 26 2.174 7.222 14.276
194 3HB ALA 26 3HB ALA 26 2.553 8.389 15.542
195 HA PRO 27 HA PRO 27 4.907 2.759 15.051
196 1HB PRO 27 2HB PRO 27 3.570 1.457 17.007
197 2HB PRO 27 1HB PRO 27 5.103 2.287 17.293
198 1HG PRO 27 2HG PRO 27 2.315 3.210 17.859
199 2HG PRO 27 1HG PRO 27 3.765 3.348 18.870
200 1HD PRO 27 2HD PRO 27 2.807 5.400 17.365
201 2HD PRO 27 1HD PRO 27 4.530 5.199 17.737
202 H GLY 28 H GLY 28 3.600 0.651 14.839
203 1HA GLY 28 2HA GLY 28 1.109 1.316 13.403
204 2HA GLY 28 1HA GLY 28 2.239 0.072 12.893
205 HA PRO 29 HA PRO 29 -1.282 -2.232 14.834
206 1HB PRO 29 2HB PRO 29 -0.106 -4.577 13.773
207 2HB PRO 29 1HB PRO 29 -1.512 -3.712 13.152
208 1HG PRO 29 2HG PRO 29 1.311 -3.614 12.263
209 2HG PRO 29 1HG PRO 29 -0.174 -3.362 11.330
210 1HD PRO 29 2HD PRO 29 1.434 -1.321 12.018
211 2HD PRO 29 1HD PRO 29 -0.331 -1.134 11.952
212 H THR 30 H THR 30 -1.341 -3.818 16.455
213 HA THR 30 HA THR 30 0.753 -3.523 18.354
214 HB THR 30 HB THR 30 -1.650 -3.755 18.925
215 HG1 THR 30 1HG THR 30 0.253 -5.528 20.074
216 1HG2 THR 30 1HG2 THR 30 -2.643 -5.987 19.046
217 2HG2 THR 30 2HG2 THR 30 -1.206 -6.668 18.286
218 3HG2 THR 30 3HG2 THR 30 -2.239 -5.559 17.385
219 H ASP 31 H ASP 31 0.522 -5.571 15.761
220 HA ASP 31 HA ASP 31 1.565 -7.998 16.666
221 1HB ASP 31 2HB ASP 31 1.934 -6.560 14.037
222 2HB ASP 31 1HB ASP 31 2.577 -8.170 14.338
223 H GLY 32 H GLY 32 3.044 -4.911 16.380
224 1HA GLY 32 2HA GLY 32 5.050 -4.738 17.877
225 2HA GLY 32 1HA GLY 32 5.678 -6.113 16.980
226 H VAL 33 H VAL 33 3.869 -3.707 15.306
227 HA VAL 33 HA VAL 33 6.234 -3.087 13.737
228 HB VAL 33 HB VAL 33 3.413 -2.119 13.296
229 1HG1 VAL 33 1HG1 VAL 33 5.760 -2.370 11.432
230 2HG1 VAL 33 2HG1 VAL 33 5.075 -0.873 12.070
231 3HG1 VAL 33 3HG1 VAL 33 4.133 -1.877 10.967
232 1HG2 VAL 33 1HG2 VAL 33 3.406 -4.557 13.377
233 2HG2 VAL 33 2HG2 VAL 33 4.710 -4.607 12.189
234 3HG2 VAL 33 3HG2 VAL 33 3.125 -3.979 11.735
235 H LYS 34 H LYS 34 7.287 -1.212 13.804
236 HA LYS 34 HA LYS 34 6.351 0.813 15.692
237 1HB LYS 34 2HB LYS 34 9.063 0.266 14.472
238 2HB LYS 34 1HB LYS 34 8.712 1.635 15.512
239 1HG LYS 34 2HG LYS 34 8.048 0.077 17.301
240 2HG LYS 34 1HG LYS 34 8.495 -1.269 16.256
241 1HD LYS 34 2HD LYS 34 10.404 0.910 17.075
242 2HD LYS 34 1HD LYS 34 10.219 -0.608 17.955
243 1HE LYS 34 2HE LYS 34 10.837 -1.842 15.912
244 2HE LYS 34 1HE LYS 34 11.061 -0.307 15.071
245 1HZ LYS 34 1HZ LYS 34 12.576 -1.118 17.495
246 2HZ LYS 34 2HZ LYS 34 12.854 0.247 16.526
247 3HZ LYS 34 3HZ LYS 34 13.146 -1.302 15.909
248 H SER 35 H SER 35 6.652 0.151 12.419
249 HA SER 35 HA SER 35 5.173 2.311 11.554
250 1HB SER 35 2HB SER 35 6.984 3.474 10.153
251 2HB SER 35 1HB SER 35 6.940 3.852 11.869
252 HG SER 35 HG SER 35 8.510 1.692 11.282
253 H ALA 36 H ALA 36 4.938 2.349 9.226
254 HA ALA 36 HA ALA 36 6.001 -0.099 7.962
255 1HB ALA 36 1HB ALA 36 3.928 -0.347 6.731
256 2HB ALA 36 2HB ALA 36 3.278 1.109 7.486
257 3HB ALA 36 3HB ALA 36 3.606 -0.320 8.465
258 H THR 37 H THR 37 6.877 0.101 5.983
259 HA THR 37 HA THR 37 6.767 2.765 4.737
260 HB THR 37 HB THR 37 9.023 2.103 3.742
261 HG1 THR 37 1HG THR 37 10.168 0.530 5.118
262 1HG2 THR 37 1HG2 THR 37 8.864 2.488 6.738
263 2HG2 THR 37 2HG2 THR 37 8.818 3.770 5.527
264 3HG2 THR 37 3HG2 THR 37 10.277 2.800 5.731
265 H VAL 38 H VAL 38 6.094 2.832 2.657
266 HA VAL 38 HA VAL 38 5.641 0.217 1.386
267 HB VAL 38 HB VAL 38 3.566 1.450 2.014
268 1HG1 VAL 38 1HG1 VAL 38 4.421 3.404 -0.116
269 2HG1 VAL 38 2HG1 VAL 38 4.335 3.731 1.614
270 3HG1 VAL 38 3HG1 VAL 38 2.861 3.383 0.708
271 1HG2 VAL 38 1HG2 VAL 38 4.011 0.968 -0.930
272 2HG2 VAL 38 2HG2 VAL 38 2.435 1.109 -0.151
273 3HG2 VAL 38 3HG2 VAL 38 3.512 -0.223 0.274
274 H THR 39 H THR 39 6.392 -0.144 -0.609
275 HA THR 39 HA THR 39 7.806 2.085 -1.922
276 HB THR 39 HB THR 39 8.613 -0.825 -2.047
277 HG1 THR 39 1HG THR 39 8.779 0.686 0.048
278 1HG2 THR 39 1HG2 THR 39 9.413 0.555 -3.901
279 2HG2 THR 39 2HG2 THR 39 10.749 0.090 -2.849
280 3HG2 THR 39 3HG2 THR 39 10.082 1.719 -2.758
281 H PHE 40 H PHE 40 7.128 2.530 -3.933
282 HA PHE 40 HA PHE 40 5.366 0.579 -5.234
283 1HB PHE 40 2HB PHE 40 5.706 3.557 -5.619
284 2HB PHE 40 1HB PHE 40 4.781 2.553 -6.732
285 HD1 PHE 40 1HD PHE 40 2.696 1.507 -6.022
286 HD2 PHE 40 2HD PHE 40 4.855 4.119 -3.447
287 HE1 PHE 40 1HE PHE 40 0.705 1.738 -4.592
288 HE2 PHE 40 2HE PHE 40 2.872 4.345 -2.011
289 HZ PHE 40 HZ PHE 40 0.797 3.157 -2.582
290 H THR 41 H THR 41 6.172 -0.628 -6.745
291 HA THR 41 HA THR 41 8.632 0.173 -8.110
292 HB THR 41 HB THR 41 7.311 -2.509 -8.438
293 HG1 THR 41 1HG THR 41 8.046 -1.439 -6.084
294 1HG2 THR 41 1HG2 THR 41 9.718 -3.237 -8.428
295 2HG2 THR 41 2HG2 THR 41 10.173 -1.535 -8.367
296 3HG2 THR 41 3HG2 THR 41 9.290 -2.164 -9.757
297 H GLU 42 H GLU 42 8.552 -0.782 -10.526
298 HA GLU 42 HA GLU 42 6.874 0.979 -11.888
299 1HB GLU 42 2HB GLU 42 9.102 -0.071 -12.608
300 2HB GLU 42 1HB GLU 42 8.138 -1.434 -13.155
301 1HG GLU 42 2HG GLU 42 6.931 -0.026 -14.684
302 2HG GLU 42 1HG GLU 42 7.759 1.403 -14.070
303 H ASP 43 H ASP 43 6.494 -2.460 -11.166
304 HA ASP 43 HA ASP 43 3.776 -2.279 -12.297
305 1HB ASP 43 2HB ASP 43 5.686 -4.616 -12.466
306 2HB ASP 43 1HB ASP 43 3.983 -4.703 -12.892
307 H GLU 44 H GLU 44 5.586 -2.744 -9.546
308 HA GLU 44 HA GLU 44 3.602 -4.567 -8.361
309 1HB GLU 44 2HB GLU 44 6.510 -4.600 -7.587
310 2HB GLU 44 1HB GLU 44 5.275 -5.805 -7.255
311 1HG GLU 44 2HG GLU 44 6.256 -6.904 -8.936
312 2HG GLU 44 1HG GLU 44 5.273 -5.847 -9.946
313 H VAL 45 H VAL 45 3.166 -4.346 -6.167
314 HA VAL 45 HA VAL 45 4.173 -1.884 -4.896
315 HB VAL 45 HB VAL 45 1.765 -3.569 -4.156
316 1HG1 VAL 45 1HG1 VAL 45 1.211 -1.776 -2.600
317 2HG1 VAL 45 2HG1 VAL 45 2.703 -0.934 -3.022
318 3HG1 VAL 45 3HG1 VAL 45 2.768 -2.498 -2.207
319 1HG2 VAL 45 1HG2 VAL 45 1.930 -0.861 -5.480
320 2HG2 VAL 45 2HG2 VAL 45 0.443 -1.627 -4.921
321 3HG2 VAL 45 3HG2 VAL 45 1.379 -2.364 -6.222
322 H VAL 46 H VAL 46 5.716 -2.147 -3.424
323 HA VAL 46 HA VAL 46 5.985 -4.765 -2.100
324 HB VAL 46 HB VAL 46 8.056 -2.579 -2.368
325 1HG1 VAL 46 1HG1 VAL 46 8.295 -5.404 -1.344
326 2HG1 VAL 46 2HG1 VAL 46 8.370 -3.932 -0.375
327 3HG1 VAL 46 3HG1 VAL 46 9.628 -4.271 -1.560
328 1HG2 VAL 46 1HG2 VAL 46 7.554 -3.587 -4.530
329 2HG2 VAL 46 2HG2 VAL 46 7.830 -5.191 -3.852
330 3HG2 VAL 46 3HG2 VAL 46 9.163 -4.042 -3.973
331 H GLU 47 H GLU 47 5.506 -4.881 0.001
332 HA GLU 47 HA GLU 47 5.267 -2.350 1.477
333 1HB GLU 47 2HB GLU 47 3.140 -3.534 1.134
334 2HB GLU 47 1HB GLU 47 3.798 -4.949 1.943
335 1HG GLU 47 2HG GLU 47 3.929 -3.768 4.019
336 2HG GLU 47 1HG GLU 47 3.483 -2.254 3.239
337 H THR 48 H THR 48 6.525 -2.041 3.145
338 HA THR 48 HA THR 48 7.997 -4.338 4.260
339 HB THR 48 HB THR 48 9.431 -2.012 4.899
340 HG1 THR 48 1HG THR 48 8.303 -0.922 3.220
341 1HG2 THR 48 1HG2 THR 48 9.948 -4.034 2.723
342 2HG2 THR 48 2HG2 THR 48 10.378 -4.213 4.423
343 3HG2 THR 48 3HG2 THR 48 11.144 -2.961 3.445
344 H GLU 49 H GLU 49 7.684 -4.723 6.339
345 HA GLU 49 HA GLU 49 6.398 -2.664 7.989
346 1HB GLU 49 2HB GLU 49 6.988 -5.517 8.761
347 2HB GLU 49 1HB GLU 49 5.890 -4.401 9.549
348 1HG GLU 49 2HG GLU 49 4.345 -4.536 7.747
349 2HG GLU 49 1HG GLU 49 5.481 -5.471 6.773
350 H VAL 50 H VAL 50 7.609 -1.540 9.420
351 HA VAL 50 HA VAL 50 10.253 -2.557 10.117
352 HB VAL 50 HB VAL 50 8.881 -0.046 11.116
353 1HG1 VAL 50 1HG1 VAL 50 10.678 -0.814 12.571
354 2HG1 VAL 50 2HG1 VAL 50 11.149 0.666 11.733
355 3HG1 VAL 50 3HG1 VAL 50 11.776 -0.891 11.193
356 1HG2 VAL 50 1HG2 VAL 50 9.151 0.071 8.697
357 2HG2 VAL 50 2HG2 VAL 50 10.851 -0.362 8.853
358 3HG2 VAL 50 3HG2 VAL 50 10.273 1.175 9.494
359 H MET 51 H MET 51 10.314 -4.047 11.647
360 HA MET 51 HA MET 51 8.314 -3.905 13.805
361 1HB MET 51 2HB MET 51 7.947 -5.731 12.106
362 2HB MET 51 1HB MET 51 9.481 -6.419 12.612
363 1HG MET 51 2HG MET 51 8.660 -6.840 14.813
364 2HG MET 51 1HG MET 51 7.170 -5.958 14.483
365 1HE MET 51 1HE MET 51 6.383 -6.936 11.583
366 2HE MET 51 2HE MET 51 5.240 -6.831 12.922
367 3HE MET 51 3HE MET 51 5.341 -8.308 11.964
368 H GLU 52 H GLU 52 9.006 -4.443 15.874
369 HA GLU 52 HA GLU 52 11.696 -3.857 16.461
370 1HB GLU 52 2HB GLU 52 9.734 -3.563 18.013
371 2HB GLU 52 1HB GLU 52 9.753 -5.303 18.267
372 1HG GLU 52 2HG GLU 52 10.905 -4.072 20.051
373 2HG GLU 52 1HG GLU 52 11.973 -5.189 19.198
374 H GLY 53 H GLY 53 13.448 -5.111 16.762
375 1HA GLY 53 2HA GLY 53 14.597 -7.109 17.244
376 2HA GLY 53 1HA GLY 53 13.122 -8.008 16.928
377 H ARG 54 H ARG 54 12.404 -7.411 14.419
378 HA ARG 54 HA ARG 54 14.634 -8.594 12.981
379 1HB ARG 54 2HB ARG 54 13.000 -9.336 11.337
380 2HB ARG 54 1HB ARG 54 12.607 -9.868 12.956
381 1HG ARG 54 2HG ARG 54 10.983 -7.990 13.088
382 2HG ARG 54 1HG ARG 54 11.261 -7.702 11.368
383 1HD ARG 54 2HD ARG 54 10.794 -10.283 11.188
384 2HD ARG 54 1HD ARG 54 9.972 -10.037 12.724
385 HE ARG 54 HE ARG 54 8.907 -8.125 11.112
386 1HH1 ARG 54 1HH1 ARG 54 9.249 -11.608 10.921
387 2HH1 ARG 54 2HH1 ARG 54 7.888 -11.814 9.861
388 1HH2 ARG 54 1HH2 ARG 54 7.063 -8.414 9.717
389 2HH2 ARG 54 2HH2 ARG 54 6.644 -10.018 9.203
390 H GLY 55 H GLY 55 12.547 -5.796 12.840
391 1HA GLY 55 2HA GLY 55 13.240 -3.734 11.908
392 2HA GLY 55 1HA GLY 55 14.432 -4.597 10.947
393 H GLU 56 H GLU 56 13.790 -3.575 9.020
394 HA GLU 56 HA GLU 56 11.113 -3.686 8.059
395 1HB GLU 56 2HB GLU 56 13.753 -3.049 6.759
396 2HB GLU 56 1HB GLU 56 12.258 -3.103 5.845
397 1HG GLU 56 2HG GLU 56 11.332 -1.367 7.320
398 2HG GLU 56 1HG GLU 56 12.884 -1.275 8.138
399 H VAL 57 H VAL 57 10.147 -5.429 7.512
400 HA VAL 57 HA VAL 57 11.635 -7.530 6.091
401 HB VAL 57 HB VAL 57 9.088 -7.621 7.699
402 1HG1 VAL 57 1HG1 VAL 57 10.292 -9.822 6.012
403 2HG1 VAL 57 2HG1 VAL 57 8.773 -8.987 5.686
404 3HG1 VAL 57 3HG1 VAL 57 8.931 -10.004 7.119
405 1HG2 VAL 57 1HG2 VAL 57 10.330 -9.274 9.017
406 2HG2 VAL 57 2HG2 VAL 57 11.164 -7.721 8.966
407 3HG2 VAL 57 3HG2 VAL 57 11.725 -9.058 7.962
408 H GLN 58 H GLN 58 11.295 -7.687 3.990
409 HA GLN 58 HA GLN 58 9.286 -6.054 2.723
410 1HB GLN 58 2HB GLN 58 11.372 -7.878 1.524
411 2HB GLN 58 1HB GLN 58 10.437 -6.669 0.673
412 1HG GLN 58 2HG GLN 58 11.495 -4.907 1.971
413 2HG GLN 58 1HG GLN 58 12.429 -6.114 2.849
414 1HE2 GLN 58 1HE2 GLN 58 13.301 -3.870 1.175
415 2HE2 GLN 58 2HE2 GLN 58 14.302 -4.568 -0.056
416 H LEU 59 H LEU 59 7.342 -6.799 2.307
417 HA LEU 59 HA LEU 59 6.783 -9.636 2.309
418 1HB LEU 59 2HB LEU 59 5.007 -7.235 1.862
419 2HB LEU 59 1HB LEU 59 4.433 -8.889 1.901
420 HG LEU 59 HG LEU 59 5.758 -7.467 4.206
421 1HD1 LEU 59 1HD1 LEU 59 3.530 -7.459 5.214
422 2HD1 LEU 59 2HD1 LEU 59 2.861 -8.153 3.736
423 3HD1 LEU 59 3HD1 LEU 59 3.561 -6.534 3.713
424 1HD2 LEU 59 1HD2 LEU 59 4.431 -10.167 4.023
425 2HD2 LEU 59 2HD2 LEU 59 4.991 -9.406 5.513
426 3HD2 LEU 59 3HD2 LEU 59 6.151 -9.859 4.265
427 HA PRO 60 HA PRO 60 6.914 -10.655 -1.980
428 1HB PRO 60 2HB PRO 60 4.043 -11.396 -1.676
429 2HB PRO 60 1HB PRO 60 5.378 -12.332 -2.357
430 1HG PRO 60 2HG PRO 60 4.424 -12.848 0.090
431 2HG PRO 60 1HG PRO 60 6.151 -12.991 -0.283
432 1HD PRO 60 2HD PRO 60 4.722 -10.912 1.286
433 2HD PRO 60 1HD PRO 60 6.395 -11.494 1.423
434 H PHE 61 H PHE 61 6.856 -9.208 -3.563
435 HA PHE 61 HA PHE 61 5.199 -6.934 -3.524
436 1HB PHE 61 2HB PHE 61 6.112 -6.524 -5.827
437 2HB PHE 61 1HB PHE 61 7.328 -6.760 -4.580
438 HD1 PHE 61 1HD PHE 61 5.768 -8.198 -7.566
439 HD2 PHE 61 2HD PHE 61 8.777 -8.677 -4.593
440 HE1 PHE 61 1HE PHE 61 6.843 -9.929 -8.940
441 HE2 PHE 61 2HE PHE 61 9.855 -10.416 -5.960
442 HZ PHE 61 HZ PHE 61 8.887 -11.041 -8.137
443 H MET 62 H MET 62 3.389 -6.389 -4.618
444 HA MET 62 HA MET 62 1.978 -8.580 -5.996
445 1HB MET 62 2HB MET 62 0.949 -6.265 -4.363
446 2HB MET 62 1HB MET 62 -0.095 -7.245 -5.379
447 1HG MET 62 2HG MET 62 0.462 -9.219 -4.083
448 2HG MET 62 1HG MET 62 1.573 -8.275 -3.092
449 1HE MET 62 1HE MET 62 -0.841 -5.887 -1.161
450 2HE MET 62 2HE MET 62 -0.003 -5.548 -2.675
451 3HE MET 62 3HE MET 62 0.827 -6.416 -1.386
452 H ALA 63 H ALA 63 1.276 -8.279 -8.036
453 HA ALA 63 HA ALA 63 2.160 -5.921 -9.441
454 1HB ALA 63 1HB ALA 63 2.350 -8.142 -10.463
455 2HB ALA 63 2HB ALA 63 1.358 -7.062 -11.441
456 3HB ALA 63 3HB ALA 63 0.591 -8.297 -10.447
457 H TYR 64 H TYR 64 0.962 -4.256 -10.167
458 HA TYR 64 HA TYR 64 -1.941 -4.381 -9.730
459 1HB TYR 64 2HB TYR 64 -1.972 -2.165 -8.779
460 2HB TYR 64 1HB TYR 64 -0.848 -3.153 -7.858
461 HD1 TYR 64 2HD TYR 64 1.627 -2.838 -8.229
462 HD2 TYR 64 1HD TYR 64 -1.265 -0.171 -9.844
463 HE1 TYR 64 2HE TYR 64 3.373 -1.137 -8.531
464 HE2 TYR 64 1HE TYR 64 0.477 1.535 -10.160
465 HH TYR 64 HH TYR 64 3.831 0.833 -9.803
466 H LYS 65 H LYS 65 -3.187 -2.914 -10.989
467 HA LYS 65 HA LYS 65 -1.759 -1.686 -13.252
468 1HB LYS 65 2HB LYS 65 -4.319 -3.271 -13.322
469 2HB LYS 65 1HB LYS 65 -3.866 -2.151 -14.598
470 1HG LYS 65 2HG LYS 65 -1.791 -3.423 -14.941
471 2HG LYS 65 1HG LYS 65 -2.331 -4.576 -13.725
472 1HD LYS 65 2HD LYS 65 -4.296 -5.097 -15.080
473 2HD LYS 65 1HD LYS 65 -3.784 -3.916 -16.286
474 1HE LYS 65 2HE LYS 65 -1.727 -5.220 -16.649
475 2HE LYS 65 1HE LYS 65 -2.302 -6.419 -15.491
476 1HZ LYS 65 1HZ LYS 65 -2.801 -7.170 -17.681
477 2HZ LYS 65 2HZ LYS 65 -3.545 -5.703 -18.090
478 3HZ LYS 65 3HZ LYS 65 -4.265 -6.727 -16.945
479 H VAL 66 H VAL 66 -2.897 0.056 -14.254
480 HA VAL 66 HA VAL 66 -4.155 1.728 -12.211
481 HB VAL 66 HB VAL 66 -2.883 2.421 -14.859
482 1HG1 VAL 66 1HG1 VAL 66 -4.003 4.244 -12.738
483 2HG1 VAL 66 2HG1 VAL 66 -4.661 3.998 -14.354
484 3HG1 VAL 66 3HG1 VAL 66 -3.082 4.759 -14.150
485 1HG2 VAL 66 1HG2 VAL 66 -1.141 3.459 -13.489
486 2HG2 VAL 66 2HG2 VAL 66 -1.278 1.728 -13.175
487 3HG2 VAL 66 3HG2 VAL 66 -1.955 2.889 -12.032
488 H ILE 67 H ILE 67 -6.269 1.983 -12.225
489 HA ILE 67 HA ILE 67 -7.871 1.254 -14.528
490 HB ILE 67 HB ILE 67 -8.868 2.575 -12.012
491 1HG1 ILE 67 2HG1 ILE 67 -8.466 -0.391 -12.477
492 2HG1 ILE 67 1HG1 ILE 67 -7.532 0.606 -11.364
493 1HG2 ILE 67 1HG2 ILE 67 -10.421 2.464 -13.877
494 2HG2 ILE 67 2HG2 ILE 67 -10.944 1.401 -12.570
495 3HG2 ILE 67 3HG2 ILE 67 -10.166 0.724 -14.002
496 1HD1 ILE 67 1HD1 ILE 67 -10.484 0.045 -11.181
497 2HD1 ILE 67 2HD1 ILE 67 -9.552 1.042 -10.065
498 3HD1 ILE 67 3HD1 ILE 67 -9.224 -0.684 -10.189
499 H SER 68 H SER 68 -7.433 4.117 -12.510
500 HA SER 68 HA SER 68 -8.072 5.807 -14.835
501 1HB SER 68 2HB SER 68 -8.844 6.494 -12.006
502 2HB SER 68 1HB SER 68 -9.368 7.275 -13.488
503 HG SER 68 HG SER 68 -10.385 5.238 -14.043
504 H GLN 69 H GLN 69 -7.109 7.952 -14.699
505 HA GLN 69 HA GLN 69 -4.799 8.191 -12.955
506 1HB GLN 69 2HB GLN 69 -4.005 6.747 -14.787
507 2HB GLN 69 1HB GLN 69 -4.500 7.960 -15.957
508 1HG GLN 69 2HG GLN 69 -2.886 9.535 -14.931
509 2HG GLN 69 1HG GLN 69 -2.338 8.228 -13.883
510 1HE2 GLN 69 1HE2 GLN 69 -1.144 6.535 -14.762
511 2HE2 GLN 69 2HE2 GLN 69 -0.424 6.630 -16.331
512 H SER 70 H SER 70 -4.004 10.251 -12.806
513 HA SER 70 HA SER 70 -4.875 12.279 -14.704
514 1HB SER 70 2HB SER 70 -6.508 12.376 -12.840
515 2HB SER 70 1HB SER 70 -5.181 12.570 -11.702
516 HG SER 70 HG SER 70 -6.459 14.455 -13.034
517 H THR 71 H THR 71 -3.381 13.981 -14.887
518 HA THR 71 HA THR 71 -0.743 13.412 -13.909
519 HB THR 71 HB THR 71 -0.203 15.657 -14.995
520 HG1 THR 71 1HG THR 71 -1.860 16.429 -16.423
521 1HG2 THR 71 1HG2 THR 71 -0.354 14.749 -17.262
522 2HG2 THR 71 2HG2 THR 71 -1.500 13.531 -16.705
523 3HG2 THR 71 3HG2 THR 71 0.165 13.508 -16.121
524 H ASP 72 H ASP 72 -3.417 15.393 -12.983
525 HA ASP 72 HA ASP 72 -2.088 16.066 -10.505
526 1HB ASP 72 2HB ASP 72 -1.426 17.945 -11.911
527 2HB ASP 72 1HB ASP 72 -3.100 18.217 -12.377
528 H GLY 73 H GLY 73 -3.828 14.406 -10.189
529 1HA GLY 73 2HA GLY 73 -5.994 15.768 -8.889
530 2HA GLY 73 1HA GLY 73 -6.518 14.797 -10.260
531 H SER 74 H SER 74 -6.291 12.547 -10.186
532 HA SER 74 HA SER 74 -5.318 11.301 -7.762
533 1HB SER 74 2HB SER 74 -7.606 11.899 -7.145
534 2HB SER 74 1HB SER 74 -8.227 11.096 -8.581
535 HG SER 74 HG SER 74 -6.693 9.731 -6.625
536 H ILE 75 H ILE 75 -5.240 9.001 -7.920
537 HA ILE 75 HA ILE 75 -5.523 7.905 -10.633
538 HB ILE 75 HB ILE 75 -3.137 7.376 -8.841
539 1HG1 ILE 75 2HG1 ILE 75 -3.429 9.167 -11.259
540 2HG1 ILE 75 1HG1 ILE 75 -2.898 9.612 -9.645
541 1HG2 ILE 75 1HG2 ILE 75 -3.701 6.540 -11.686
542 2HG2 ILE 75 2HG2 ILE 75 -3.739 5.496 -10.265
543 3HG2 ILE 75 3HG2 ILE 75 -2.216 6.216 -10.787
544 1HD1 ILE 75 1HD1 ILE 75 -0.861 8.310 -9.958
545 2HD1 ILE 75 2HD1 ILE 75 -1.042 9.549 -11.198
546 3HD1 ILE 75 3HD1 ILE 75 -1.395 7.863 -11.579
547 H GLU 76 H GLU 76 -6.388 5.861 -10.650
548 HA GLU 76 HA GLU 76 -6.808 4.625 -8.010
549 1HB GLU 76 2HB GLU 76 -8.846 5.603 -9.228
550 2HB GLU 76 1HB GLU 76 -8.648 4.277 -10.366
551 1HG GLU 76 2HG GLU 76 -9.053 2.650 -8.693
552 2HG GLU 76 1HG GLU 76 -8.966 3.857 -7.410
553 H ILE 77 H ILE 77 -6.123 2.583 -7.761
554 HA ILE 77 HA ILE 77 -5.212 1.171 -10.182
555 HB ILE 77 HB ILE 77 -3.304 0.283 -8.892
556 1HG1 ILE 77 2HG1 ILE 77 -4.098 2.334 -6.808
557 2HG1 ILE 77 1HG1 ILE 77 -4.271 0.590 -6.635
558 1HG2 ILE 77 1HG2 ILE 77 -3.431 3.294 -9.094
559 2HG2 ILE 77 2HG2 ILE 77 -2.970 2.168 -10.372
560 3HG2 ILE 77 3HG2 ILE 77 -1.952 2.341 -8.943
561 1HD1 ILE 77 1HD1 ILE 77 -2.312 1.409 -5.458
562 2HD1 ILE 77 2HD1 ILE 77 -1.673 2.075 -6.961
563 3HD1 ILE 77 3HD1 ILE 77 -1.854 0.330 -6.775
564 H GLN 78 H GLN 78 -5.035 -1.119 -9.992
565 HA GLN 78 HA GLN 78 -6.683 -2.319 -7.871
566 1HB GLN 78 2HB GLN 78 -8.095 -1.977 -9.845
567 2HB GLN 78 1HB GLN 78 -6.929 -2.827 -10.843
568 1HG GLN 78 2HG GLN 78 -7.370 -4.886 -9.697
569 2HG GLN 78 1HG GLN 78 -8.436 -4.062 -8.553
570 1HE2 GLN 78 1HE2 GLN 78 -10.451 -3.312 -9.270
571 2HE2 GLN 78 2HE2 GLN 78 -11.187 -3.908 -10.720
572 H TYR 79 H TYR 79 -6.093 -4.398 -7.294
573 HA TYR 79 HA TYR 79 -3.460 -5.246 -8.226
574 1HB TYR 79 2HB TYR 79 -5.131 -6.428 -5.998
575 2HB TYR 79 1HB TYR 79 -3.414 -6.682 -6.293
576 HD1 TYR 79 1HD TYR 79 -1.831 -4.718 -5.980
577 HD2 TYR 79 2HD TYR 79 -5.880 -4.641 -4.664
578 HE1 TYR 79 1HE TYR 79 -1.300 -2.851 -4.466
579 HE2 TYR 79 2HE TYR 79 -5.361 -2.769 -3.158
580 HH TYR 79 HH TYR 79 -2.479 -1.000 -3.347
581 H LEU 80 H LEU 80 -3.077 -7.385 -8.949
582 HA LEU 80 HA LEU 80 -5.424 -8.556 -10.252
583 1HB LEU 80 2HB LEU 80 -2.471 -8.907 -10.762
584 2HB LEU 80 1HB LEU 80 -3.733 -9.752 -11.638
585 HG LEU 80 HG LEU 80 -3.442 -6.744 -11.585
586 1HD1 LEU 80 1HD1 LEU 80 -2.612 -8.733 -13.697
587 2HD1 LEU 80 2HD1 LEU 80 -1.532 -7.755 -12.704
588 3HD1 LEU 80 3HD1 LEU 80 -2.597 -6.979 -13.876
589 1HD2 LEU 80 1HD2 LEU 80 -5.142 -8.581 -13.265
590 2HD2 LEU 80 2HD2 LEU 80 -5.010 -6.832 -13.466
591 3HD2 LEU 80 3HD2 LEU 80 -5.710 -7.503 -11.993
592 H GLY 81 H GLY 81 -5.424 -10.998 -10.432
593 1HA GLY 81 2HA GLY 81 -5.141 -13.104 -9.415
594 2HA GLY 81 1HA GLY 81 -4.268 -12.328 -8.095
595 HA PRO 82 HA PRO 82 -8.456 -13.270 -6.360
596 1HB PRO 82 2HB PRO 82 -7.516 -13.558 -3.808
597 2HB PRO 82 1HB PRO 82 -7.613 -14.883 -4.974
598 1HG PRO 82 2HG PRO 82 -5.259 -13.198 -4.212
599 2HG PRO 82 1HG PRO 82 -5.344 -14.949 -4.476
600 1HD PRO 82 2HD PRO 82 -4.362 -13.290 -6.349
601 2HD PRO 82 1HD PRO 82 -5.299 -14.736 -6.780
602 H TYR 83 H TYR 83 -6.111 -10.887 -6.073
603 HA TYR 83 HA TYR 83 -7.594 -9.251 -4.178
604 1HB TYR 83 2HB TYR 83 -5.029 -8.709 -5.693
605 2HB TYR 83 1HB TYR 83 -5.728 -7.650 -4.474
606 HD1 TYR 83 2HD TYR 83 -5.692 -8.296 -2.105
607 HD2 TYR 83 1HD TYR 83 -3.842 -10.704 -5.081
608 HE1 TYR 83 2HE TYR 83 -4.450 -9.496 -0.353
609 HE2 TYR 83 1HE TYR 83 -2.602 -11.917 -3.340
610 HH TYR 83 HH TYR 83 -3.322 -11.582 0.009
611 H TYR 84 H TYR 84 -8.172 -10.041 -7.182
612 HA TYR 84 HA TYR 84 -8.374 -7.660 -8.650
613 1HB TYR 84 2HB TYR 84 -9.699 -8.906 -10.178
614 2HB TYR 84 1HB TYR 84 -8.532 -10.040 -9.517
615 HD1 TYR 84 1HD TYR 84 -9.652 -11.053 -7.100
616 HD2 TYR 84 2HD TYR 84 -11.672 -9.924 -10.667
617 HE1 TYR 84 1HE TYR 84 -11.492 -12.583 -6.541
618 HE2 TYR 84 2HE TYR 84 -13.519 -11.445 -10.112
619 HH TYR 84 HH TYR 84 -13.889 -12.859 -7.060
620 HA PRO 85 HA PRO 85 -11.337 -4.872 -8.740
621 1HB PRO 85 2HB PRO 85 -13.486 -6.632 -7.646
622 2HB PRO 85 1HB PRO 85 -13.648 -5.171 -8.634
623 1HG PRO 85 2HG PRO 85 -13.366 -7.799 -9.626
624 2HG PRO 85 1HG PRO 85 -13.167 -6.305 -10.559
625 1HD PRO 85 2HD PRO 85 -11.129 -8.148 -10.070
626 2HD PRO 85 1HD PRO 85 -10.861 -6.436 -10.480
627 H LEU 86 H LEU 86 -10.435 -6.561 -5.932
628 HA LEU 86 HA LEU 86 -11.222 -4.501 -4.105
629 1HB LEU 86 2HB LEU 86 -10.540 -6.825 -3.437
630 2HB LEU 86 1HB LEU 86 -8.899 -6.430 -3.910
631 HG LEU 86 HG LEU 86 -8.895 -4.628 -2.177
632 1HD1 LEU 86 1HD1 LEU 86 -11.508 -5.904 -1.377
633 2HD1 LEU 86 2HD1 LEU 86 -11.298 -4.275 -2.022
634 3HD1 LEU 86 3HD1 LEU 86 -10.624 -4.695 -0.447
635 1HD2 LEU 86 1HD2 LEU 86 -7.887 -6.791 -1.735
636 2HD2 LEU 86 2HD2 LEU 86 -9.448 -7.436 -1.228
637 3HD2 LEU 86 3HD2 LEU 86 -8.666 -6.170 -0.280
638 H LYS 87 H LYS 87 -10.541 -2.448 -4.480
639 HA LYS 87 HA LYS 87 -7.969 -2.164 -5.870
640 1HB LYS 87 2HB LYS 87 -8.897 -0.188 -6.974
641 2HB LYS 87 1HB LYS 87 -9.837 -1.632 -7.312
642 1HG LYS 87 2HG LYS 87 -11.493 -0.927 -5.645
643 2HG LYS 87 1HG LYS 87 -10.552 0.538 -5.352
644 1HD LYS 87 2HD LYS 87 -10.810 1.122 -7.752
645 2HD LYS 87 1HD LYS 87 -11.868 -0.280 -7.940
646 1HE LYS 87 2HE LYS 87 -13.418 0.659 -6.316
647 2HE LYS 87 1HE LYS 87 -12.346 2.035 -6.068
648 1HZ LYS 87 1HZ LYS 87 -12.631 2.499 -8.505
649 2HZ LYS 87 2HZ LYS 87 -14.009 2.740 -7.553
650 3HZ LYS 87 3HZ LYS 87 -13.883 1.347 -8.509
651 H SER 88 H SER 88 -7.159 0.156 -5.796
652 HA SER 88 HA SER 88 -7.407 1.338 -3.133
653 1HB SER 88 2HB SER 88 -5.512 -0.020 -2.793
654 2HB SER 88 1HB SER 88 -4.902 0.258 -4.414
655 HG SER 88 HG SER 88 -5.125 2.341 -2.516
656 H THR 89 H THR 89 -6.788 3.570 -3.081
657 HA THR 89 HA THR 89 -6.760 4.808 -5.755
658 HB THR 89 HB THR 89 -8.052 6.150 -3.419
659 HG1 THR 89 1HG THR 89 -10.042 5.078 -4.544
660 1HG2 THR 89 1HG2 THR 89 -7.705 7.409 -5.489
661 2HG2 THR 89 2HG2 THR 89 -9.423 7.161 -5.181
662 3HG2 THR 89 3HG2 THR 89 -8.595 6.178 -6.388
663 H LEU 90 H LEU 90 -5.519 6.627 -6.022
664 HA LEU 90 HA LEU 90 -3.804 7.417 -3.756
665 1HB LEU 90 2HB LEU 90 -3.065 7.213 -6.680
666 2HB LEU 90 1HB LEU 90 -2.028 7.871 -5.429
667 HG LEU 90 HG LEU 90 -3.017 5.019 -5.500
668 1HD1 LEU 90 1HD1 LEU 90 -0.713 4.460 -6.129
669 2HD1 LEU 90 2HD1 LEU 90 -0.341 6.179 -6.259
670 3HD1 LEU 90 3HD1 LEU 90 -1.513 5.442 -7.353
671 1HD2 LEU 90 1HD2 LEU 90 -2.537 5.886 -3.253
672 2HD2 LEU 90 2HD2 LEU 90 -0.919 6.343 -3.785
673 3HD2 LEU 90 3HD2 LEU 90 -1.387 4.644 -3.744
674 H LYS 91 H LYS 91 -3.758 9.542 -3.304
675 HA LYS 91 HA LYS 91 -4.674 11.452 -5.349
676 1HB LYS 91 2HB LYS 91 -5.642 11.253 -2.497
677 2HB LYS 91 1HB LYS 91 -5.846 12.700 -3.476
678 1HG LYS 91 2HG LYS 91 -7.271 11.609 -4.985
679 2HG LYS 91 1HG LYS 91 -6.835 10.016 -4.365
680 1HD LYS 91 2HD LYS 91 -7.906 10.571 -2.229
681 2HD LYS 91 1HD LYS 91 -8.359 12.150 -2.875
682 1HE LYS 91 2HE LYS 91 -9.820 11.181 -4.469
683 2HE LYS 91 1HE LYS 91 -9.179 9.564 -4.175
684 1HZ LYS 91 1HZ LYS 91 -11.336 9.897 -3.125
685 2HZ LYS 91 2HZ LYS 91 -10.708 11.180 -2.206
686 3HZ LYS 91 3HZ LYS 91 -10.122 9.600 -1.976
687 H ARG 92 H ARG 92 -3.947 13.643 -4.988
688 HA ARG 92 HA ARG 92 -1.247 13.692 -4.070
689 1HB ARG 92 2HB ARG 92 -1.126 15.887 -4.939
690 2HB ARG 92 1HB ARG 92 -2.162 14.998 -6.042
691 1HG ARG 92 2HG ARG 92 -4.120 15.973 -5.039
692 2HG ARG 92 1HG ARG 92 -3.133 16.813 -3.848
693 1HD ARG 92 2HD ARG 92 -1.977 17.937 -5.807
694 2HD ARG 92 1HD ARG 92 -3.270 17.288 -6.816
695 HE ARG 92 HE ARG 92 -4.055 18.851 -4.485
696 1HH1 ARG 92 1HH1 ARG 92 -3.513 18.805 -7.959
697 2HH1 ARG 92 2HH1 ARG 92 -4.571 20.156 -8.256
698 1HH2 ARG 92 1HH2 ARG 92 -5.393 20.638 -4.873
699 2HH2 ARG 92 2HH2 ARG 92 -5.652 21.196 -6.505
700 H GLY 93 H GLY 93 -0.376 14.707 -2.301
701 1HA GLY 93 2HA GLY 93 -2.290 15.866 -0.388
702 2HA GLY 93 1HA GLY 93 -0.846 14.976 0.092
703 H GLU 94 H GLU 94 -1.706 17.773 0.616
704 HA GLU 94 HA GLU 94 -0.060 19.488 -0.932
705 1HB GLU 94 2HB GLU 94 -1.362 19.910 1.759
706 2HB GLU 94 1HB GLU 94 -0.613 21.167 0.794
707 1HG GLU 94 2HG GLU 94 -3.061 19.569 0.125
708 2HG GLU 94 1HG GLU 94 -2.960 21.295 0.468
709 H ASN 95 H ASN 95 1.701 20.769 -0.094
710 HA ASN 95 HA ASN 95 3.778 21.017 0.774
711 1HB ASN 95 2HB ASN 95 2.751 19.192 2.956
712 2HB ASN 95 1HB ASN 95 4.314 19.998 2.999
713 1HD2 ASN 95 1HD2 ASN 95 0.919 20.322 3.421
714 2HD2 ASN 95 2HD2 ASN 95 0.926 21.960 3.971
715 H GLY 96 H GLY 96 2.826 18.510 -0.836
716 1HA GLY 96 2HA GLY 96 4.171 17.104 -2.124
717 2HA GLY 96 1HA GLY 96 5.513 17.440 -1.041
718 H THR 97 H THR 97 2.267 15.993 -0.678
719 HA THR 97 HA THR 97 3.576 13.612 0.418
720 HB THR 97 HB THR 97 1.508 13.428 1.947
721 HG1 THR 97 1HG THR 97 1.484 16.257 1.554
722 1HG2 THR 97 1HG2 THR 97 3.609 15.540 2.442
723 2HG2 THR 97 2HG2 THR 97 3.727 13.825 2.834
724 3HG2 THR 97 3HG2 THR 97 2.567 14.847 3.683
725 H LEU 98 H LEU 98 1.866 11.756 0.582
726 HA LEU 98 HA LEU 98 0.105 11.870 -1.776
727 1HB LEU 98 2HB LEU 98 2.173 10.624 -2.311
728 2HB LEU 98 1HB LEU 98 1.850 9.537 -0.974
729 HG LEU 98 HG LEU 98 -0.290 8.880 -2.146
730 1HD1 LEU 98 1HD1 LEU 98 -0.471 9.365 -4.529
731 2HD1 LEU 98 2HD1 LEU 98 0.963 10.388 -4.435
732 3HD1 LEU 98 3HD1 LEU 98 -0.503 10.845 -3.571
733 1HD2 LEU 98 1HD2 LEU 98 1.704 7.480 -2.213
734 2HD2 LEU 98 2HD2 LEU 98 2.302 8.379 -3.607
735 3HD2 LEU 98 3HD2 LEU 98 0.835 7.410 -3.747
736 H ILE 99 H ILE 99 -1.902 11.133 -1.448
737 HA ILE 99 HA ILE 99 -2.516 9.934 1.159
738 HB ILE 99 HB ILE 99 -4.399 11.063 -0.930
739 1HG1 ILE 99 2HG1 ILE 99 -3.492 12.215 1.725
740 2HG1 ILE 99 1HG1 ILE 99 -2.976 12.776 0.139
741 1HG2 ILE 99 1HG2 ILE 99 -6.117 10.881 0.806
742 2HG2 ILE 99 2HG2 ILE 99 -4.939 10.142 1.892
743 3HG2 ILE 99 3HG2 ILE 99 -5.426 9.302 0.423
744 1HD1 ILE 99 1HD1 ILE 99 -5.791 12.843 1.182
745 2HD1 ILE 99 2HD1 ILE 99 -5.247 13.441 -0.385
746 3HD1 ILE 99 3HD1 ILE 99 -4.689 14.217 1.098
747 H TRP 100 H TRP 100 -2.580 7.800 1.227
748 HA TRP 100 HA TRP 100 -3.196 6.328 -1.235
749 1HB TRP 100 2HB TRP 100 -1.041 5.752 -0.333
750 2HB TRP 100 1HB TRP 100 -1.717 5.512 1.275
751 HD1 TRP 100 HD TRP 100 -3.002 4.020 -2.073
752 HE1 TRP 100 1HE TRP 100 -3.039 1.473 -1.841
753 HE3 TRP 100 3HE TRP 100 -0.914 3.604 2.580
754 HZ2 TRP 100 2HZ TRP 100 -2.258 -0.477 0.049
755 HZ3 TRP 100 3HZ TRP 100 -0.591 1.354 3.523
756 HH2 TRP 100 HH TRP 100 -1.250 -0.645 2.282
757 H GLU 101 H GLU 101 -5.214 5.695 -1.385
758 HA GLU 101 HA GLU 101 -6.676 4.963 1.050
759 1HB GLU 101 2HB GLU 101 -7.563 5.862 -1.664
760 2HB GLU 101 1HB GLU 101 -8.654 4.941 -0.639
761 1HG GLU 101 2HG GLU 101 -8.499 6.604 1.087
762 2HG GLU 101 1HG GLU 101 -7.317 7.504 0.146
763 H GLN 102 H GLN 102 -7.463 3.004 1.331
764 HA GLN 102 HA GLN 102 -7.419 1.086 -0.864
765 1HB GLN 102 2HB GLN 102 -5.212 1.012 0.510
766 2HB GLN 102 1HB GLN 102 -6.200 0.255 1.753
767 1HG GLN 102 2HG GLN 102 -6.922 -1.351 -0.136
768 2HG GLN 102 1HG GLN 102 -5.498 -0.754 -0.966
769 1HE2 GLN 102 1HE2 GLN 102 -4.454 -2.723 -0.905
770 2HE2 GLN 102 2HE2 GLN 102 -3.820 -3.408 0.556
771 H ASN 103 H ASN 103 -9.304 0.099 -0.877
772 HA ASN 103 HA ASN 103 -11.231 -0.911 -0.212
773 1HB ASN 103 2HB ASN 103 -9.748 -1.059 2.416
774 2HB ASN 103 1HB ASN 103 -11.381 -1.673 2.228
775 1HD2 ASN 103 1HD2 ASN 103 -8.892 -1.847 -0.246
776 2HD2 ASN 103 2HD2 ASN 103 -8.718 -3.564 -0.207
777 H GLY 104 H GLY 104 -10.450 2.094 0.414
778 1HA GLY 104 2HA GLY 104 -12.282 3.693 0.542
779 2HA GLY 104 1HA GLY 104 -13.008 2.663 1.766
780 H GLN 105 H GLN 105 -10.047 2.385 2.766
781 HA GLN 105 HA GLN 105 -10.255 4.655 4.598
782 1HB GLN 105 2HB GLN 105 -8.226 2.418 4.665
783 2HB GLN 105 1HB GLN 105 -8.715 3.470 5.987
784 1HG GLN 105 2HG GLN 105 -10.861 2.421 6.109
785 2HG GLN 105 1HG GLN 105 -10.530 1.478 4.657
786 1HE2 GLN 105 1HE2 GLN 105 -9.093 -0.245 4.762
787 2HE2 GLN 105 2HE2 GLN 105 -8.638 -0.969 6.264
788 H ARG 106 H ARG 106 -8.885 6.387 4.534
789 HA ARG 106 HA ARG 106 -6.726 6.286 2.573
790 1HB ARG 106 2HB ARG 106 -6.732 8.751 2.771
791 2HB ARG 106 1HB ARG 106 -8.225 8.078 2.159
792 1HG ARG 106 2HG ARG 106 -9.271 8.396 4.321
793 2HG ARG 106 1HG ARG 106 -7.754 9.021 4.977
794 1HD ARG 106 2HD ARG 106 -7.805 10.860 3.393
795 2HD ARG 106 1HD ARG 106 -9.281 10.222 2.675
796 HE ARG 106 HE ARG 106 -9.986 10.570 5.252
797 1HH1 ARG 106 1HH1 ARG 106 -8.330 12.648 2.988
798 2HH1 ARG 106 2HH1 ARG 106 -9.045 14.113 3.584
799 1HH2 ARG 106 1HH2 ARG 106 -10.958 12.477 6.049
800 2HH2 ARG 106 2HH2 ARG 106 -10.540 14.018 5.347
801 H LYS 107 H LYS 107 -4.728 6.075 3.192
802 HA LYS 107 HA LYS 107 -3.926 7.003 5.868
803 1HB LYS 107 2HB LYS 107 -3.663 4.551 5.247
804 2HB LYS 107 1HB LYS 107 -2.462 5.067 4.072
805 1HG LYS 107 2HG LYS 107 -1.447 4.290 6.133
806 2HG LYS 107 1HG LYS 107 -1.097 5.992 5.843
807 1HD LYS 107 2HD LYS 107 -2.786 6.651 7.425
808 2HD LYS 107 1HD LYS 107 -3.278 4.969 7.649
809 1HE LYS 107 2HE LYS 107 -0.527 6.024 8.255
810 2HE LYS 107 1HE LYS 107 -1.814 5.888 9.442
811 1HZ LYS 107 1HZ LYS 107 -0.608 3.646 7.914
812 2HZ LYS 107 2HZ LYS 107 -1.890 3.496 9.014
813 3HZ LYS 107 3HZ LYS 107 -0.361 3.983 9.556
814 H THR 108 H THR 108 -2.481 8.664 5.954
815 HA THR 108 HA THR 108 -1.650 9.804 3.408
816 HB THR 108 HB THR 108 -1.352 10.991 6.173
817 HG1 THR 108 1HG THR 108 -3.252 12.268 5.220
818 1HG2 THR 108 1HG2 THR 108 -1.167 13.115 4.951
819 2HG2 THR 108 2HG2 THR 108 -1.283 12.246 3.421
820 3HG2 THR 108 3HG2 THR 108 0.107 11.992 4.476
821 H MET 109 H MET 109 0.288 9.436 2.622
822 HA MET 109 HA MET 109 2.399 8.519 4.449
823 1HB MET 109 2HB MET 109 2.048 8.069 1.481
824 2HB MET 109 1HB MET 109 3.416 7.509 2.426
825 1HG MET 109 2HG MET 109 0.564 6.687 2.900
826 2HG MET 109 1HG MET 109 1.741 5.761 1.975
827 1HE MET 109 1HE MET 109 1.490 3.596 5.197
828 2HE MET 109 2HE MET 109 1.490 3.591 3.433
829 3HE MET 109 3HE MET 109 0.198 4.406 4.312
830 H THR 110 H THR 110 4.476 9.340 4.270
831 HA THR 110 HA THR 110 4.731 11.836 2.715
832 HB THR 110 HB THR 110 6.376 11.208 5.149
833 HG1 THR 110 1HG THR 110 3.913 11.262 5.431
834 1HG2 THR 110 1HG2 THR 110 6.603 13.634 5.270
835 2HG2 THR 110 2HG2 THR 110 5.527 13.816 3.885
836 3HG2 THR 110 3HG2 THR 110 7.101 13.047 3.683
837 H ARG 111 H ARG 111 6.929 12.262 1.909
838 HA ARG 111 HA ARG 111 8.040 9.873 0.763
839 1HB ARG 111 2HB ARG 111 7.852 12.002 -0.507
840 2HB ARG 111 1HB ARG 111 9.039 12.723 0.572
841 1HG ARG 111 2HG ARG 111 10.695 11.077 -0.161
842 2HG ARG 111 1HG ARG 111 9.503 10.375 -1.256
843 1HD ARG 111 2HD ARG 111 10.949 11.848 -2.496
844 2HD ARG 111 1HD ARG 111 9.339 12.559 -2.404
845 HE ARG 111 HE ARG 111 10.288 13.952 -0.530
846 1HH1 ARG 111 1HH1 ARG 111 12.330 12.632 -3.054
847 2HH1 ARG 111 2HH1 ARG 111 13.506 13.915 -2.945
848 1HH2 ARG 111 1HH2 ARG 111 11.835 15.620 -0.370
849 2HH2 ARG 111 2HH2 ARG 111 13.219 15.613 -1.423
850 H ILE 112 H ILE 112 9.804 8.773 1.390
851 HA ILE 112 HA ILE 112 11.033 9.371 3.893
852 HB ILE 112 HB ILE 112 12.016 7.426 1.797
853 1HG1 ILE 112 2HG1 ILE 112 10.008 7.050 4.027
854 2HG1 ILE 112 1HG1 ILE 112 9.700 6.927 2.299
855 1HG2 ILE 112 1HG2 ILE 112 13.029 6.258 3.699
856 2HG2 ILE 112 2HG2 ILE 112 12.446 7.524 4.781
857 3HG2 ILE 112 3HG2 ILE 112 13.645 7.903 3.545
858 1HD1 ILE 112 1HD1 ILE 112 11.105 4.954 2.173
859 2HD1 ILE 112 2HD1 ILE 112 9.820 4.741 3.362
860 3HD1 ILE 112 3HD1 ILE 112 11.466 5.087 3.895
861 H GLU 113 H GLU 113 13.236 9.890 4.248
862 HA GLU 113 HA GLU 113 14.159 12.035 2.679
863 1HB GLU 113 2HB GLU 113 16.183 11.904 4.138
864 2HB GLU 113 1HB GLU 113 14.665 11.970 5.025
865 1HG GLU 113 2HG GLU 113 14.763 9.555 5.373
866 2HG GLU 113 1HG GLU 113 16.281 9.487 4.481
867 H SER 114 H SER 114 16.074 12.230 1.449
868 HA SER 114 HA SER 114 16.735 9.823 -0.041
869 1HB SER 114 2HB SER 114 17.692 12.677 -0.418
870 2HB SER 114 1HB SER 114 17.943 11.341 -1.544
871 HG SER 114 HG SER 114 15.371 12.196 -0.719
872 H LYS 115 H LYS 115 18.175 8.526 0.868
873 HA LYS 115 HA LYS 115 20.273 9.709 2.543
874 1HB LYS 115 2HB LYS 115 19.163 6.906 2.426
875 2HB LYS 115 1HB LYS 115 20.547 7.366 3.406
876 1HG LYS 115 2HG LYS 115 19.114 8.973 4.614
877 2HG LYS 115 1HG LYS 115 17.734 8.402 3.673
878 1HD LYS 115 2HD LYS 115 17.824 7.329 5.872
879 2HD LYS 115 1HD LYS 115 18.041 6.153 4.573
880 1HE LYS 115 2HE LYS 115 20.464 6.222 4.919
881 2HE LYS 115 1HE LYS 115 20.248 7.401 6.213
882 1HZ LYS 115 1HZ LYS 115 19.091 4.662 6.247
883 2HZ LYS 115 2HZ LYS 115 19.099 5.785 7.522
884 3HZ LYS 115 3HZ LYS 115 20.555 5.090 6.991
885 H THR 116 H THR 116 22.383 9.401 2.176
886 HA THR 116 HA THR 116 23.200 7.391 0.195
887 HB THR 116 HB THR 116 24.609 10.016 0.359
888 HG1 THR 116 1HG THR 116 22.151 9.524 -0.778
889 1HG2 THR 116 1HG2 THR 116 24.411 7.918 -1.798
890 2HG2 THR 116 2HG2 THR 116 25.784 8.185 -0.722
891 3HG2 THR 116 3HG2 THR 116 25.340 9.408 -1.912
892 H GLY 117 H GLY 117 23.679 6.171 2.026
893 1HA GLY 117 2HA GLY 117 25.898 7.147 3.705
894 2HA GLY 117 1HA GLY 117 24.772 5.872 4.161
895 H ARG 118 H ARG 118 27.851 6.378 3.320
896 HA ARG 118 HA ARG 118 28.104 4.023 1.609
897 1HB ARG 118 2HB ARG 118 29.272 6.124 0.963
898 2HB ARG 118 1HB ARG 118 30.231 6.007 2.433
899 1HG ARG 118 2HG ARG 118 31.166 3.889 1.659
900 2HG ARG 118 1HG ARG 118 30.193 3.995 0.190
901 1HD ARG 118 2HD ARG 118 32.353 5.918 1.053
902 2HD ARG 118 1HD ARG 118 32.477 4.717 -0.230
903 HE ARG 118 HE ARG 118 30.869 7.174 -0.303
904 1HH1 ARG 118 1HH1 ARG 118 32.139 4.339 -1.933
905 2HH1 ARG 118 2HH1 ARG 118 31.828 4.969 -3.527
906 1HH2 ARG 118 1HH2 ARG 118 30.455 8.002 -2.403
907 2HH2 ARG 118 2HH2 ARG 118 30.915 7.057 -3.790
908 H GLU 119 H GLU 119 27.844 2.330 2.950
909 HA GLU 119 HA GLU 119 30.095 1.697 4.653
910 1HB GLU 119 2HB GLU 119 28.576 2.847 6.217
911 2HB GLU 119 1HB GLU 119 27.280 1.744 5.769
912 1HG GLU 119 2HG GLU 119 28.556 -0.130 6.677
913 2HG GLU 119 1HG GLU 119 29.863 0.971 7.113
914 H GLU 120 H GLU 120 30.639 -0.105 3.614
915 HA GLU 120 HA GLU 120 28.745 -1.791 2.315
916 1HB GLU 120 2HB GLU 120 31.121 -1.393 1.585
917 2HB GLU 120 1HB GLU 120 31.639 -2.389 2.937
918 1HG GLU 120 2HG GLU 120 30.583 -4.316 2.024
919 2HG GLU 120 1HG GLU 120 29.791 -3.358 0.773
920 H LYS 121 H LYS 121 28.410 -4.052 2.771
921 HA LYS 121 HA LYS 121 27.300 -4.497 5.228
922 1HB LYS 121 2HB LYS 121 26.783 -5.835 3.252
923 2HB LYS 121 1HB LYS 121 28.380 -6.570 3.310
924 1HG LYS 121 2HG LYS 121 27.836 -7.597 5.454
925 2HG LYS 121 1HG LYS 121 26.238 -6.851 5.413
926 1HD LYS 121 2HD LYS 121 26.127 -9.176 4.697
927 2HD LYS 121 1HD LYS 121 25.713 -8.089 3.372
928 1HE LYS 121 2HE LYS 121 27.936 -8.336 2.433
929 2HE LYS 121 1HE LYS 121 28.418 -9.357 3.788
930 1HZ LYS 121 1HZ LYS 121 27.818 -10.602 1.751
931 2HZ LYS 121 2HZ LYS 121 26.227 -10.030 1.892
932 3HZ LYS 121 3HZ LYS 121 26.879 -11.030 3.098
933 H ASP 122 H ASP 122 28.101 -4.687 7.167
934 HA ASP 122 HA ASP 122 30.794 -5.780 7.562
935 1HB ASP 122 2HB ASP 122 30.375 -3.564 8.521
936 2HB ASP 122 1HB ASP 122 29.010 -4.198 9.429
937 H GLU 123 H GLU 123 31.099 -7.634 8.696
938 HA GLU 123 HA GLU 123 28.721 -9.263 9.039
939 1HB GLU 123 2HB GLU 123 30.391 -11.119 9.396
940 2HB GLU 123 1HB GLU 123 30.446 -10.338 7.823
941 1HG GLU 123 2HG GLU 123 32.384 -9.045 8.515
942 2HG GLU 123 1HG GLU 123 32.316 -9.781 10.116
943 H LYS 124 H LYS 124 27.701 -9.301 10.896
944 HA LYS 124 HA LYS 124 29.256 -9.529 13.364
945 1HB LYS 124 2HB LYS 124 28.739 -7.154 13.172
946 2HB LYS 124 1HB LYS 124 27.038 -7.521 12.919
947 1HG LYS 124 2HG LYS 124 27.470 -6.743 15.189
948 2HG LYS 124 1HG LYS 124 26.871 -8.403 15.179
949 1HD LYS 124 2HD LYS 124 29.158 -9.227 15.443
950 2HD LYS 124 1HD LYS 124 29.759 -7.569 15.448
951 1HE LYS 124 2HE LYS 124 28.517 -7.094 17.478
952 2HE LYS 124 1HE LYS 124 27.813 -8.711 17.451
953 1HZ LYS 124 1HZ LYS 124 30.703 -8.074 17.774
954 2HZ LYS 124 2HZ LYS 124 30.037 -9.636 17.715
955 3HZ LYS 124 3HZ LYS 124 29.652 -8.601 19.000
956 H SER 125 H SER 125 28.644 -11.518 13.981
957 HA SER 125 HA SER 125 25.797 -12.202 13.950
958 1HB SER 125 2HB SER 125 26.681 -14.481 14.668
959 2HB SER 125 1HB SER 125 27.162 -13.947 13.059
960 HG SER 125 HG SER 125 28.769 -13.515 15.352
961 H LYS 126 H LYS 126 24.785 -11.327 15.663
962 HA LYS 126 HA LYS 126 26.178 -11.097 18.213
963 1HB LYS 126 2HB LYS 126 24.810 -9.223 17.269
964 2HB LYS 126 1HB LYS 126 23.375 -10.218 17.473
965 1HG LYS 126 2HG LYS 126 23.655 -10.224 19.861
966 2HG LYS 126 1HG LYS 126 25.196 -9.375 19.721
967 1HD LYS 126 2HD LYS 126 23.494 -7.797 20.355
968 2HD LYS 126 1HD LYS 126 23.990 -7.462 18.697
969 1HE LYS 126 2HE LYS 126 22.019 -8.643 17.867
970 2HE LYS 126 1HE LYS 126 21.527 -8.998 19.523
971 1HZ LYS 126 1HZ LYS 126 21.735 -6.310 18.270
972 2HZ LYS 126 2HZ LYS 126 21.403 -6.578 19.912
973 3HZ LYS 126 3HZ LYS 126 20.310 -7.108 18.730
974 H SER 127 H SER 127 25.478 -12.052 20.129
975 HA SER 127 HA SER 127 24.520 -14.667 20.012
976 1HB SER 127 2HB SER 127 24.415 -12.820 22.406
977 2HB SER 127 1HB SER 127 24.501 -14.581 22.425
978 HG SER 127 HG SER 127 26.556 -13.955 22.740
979 H LEU 128 H LEU 128 22.516 -15.586 20.273
980 HA LEU 128 HA LEU 128 20.253 -13.818 19.867
981 1HB LEU 128 2HB LEU 128 20.511 -16.820 19.846
982 2HB LEU 128 1HB LEU 128 18.986 -15.985 19.625
983 HG LEU 128 HG LEU 128 21.393 -15.880 17.810
984 1HD1 LEU 128 1HD1 LEU 128 20.024 -17.886 17.604
985 2HD1 LEU 128 2HD1 LEU 128 19.870 -16.860 16.178
986 3HD1 LEU 128 3HD1 LEU 128 18.585 -16.890 17.387
987 1HD2 LEU 128 1HD2 LEU 128 20.072 -14.404 16.384
988 2HD2 LEU 128 2HD2 LEU 128 20.373 -13.665 17.957
989 3HD2 LEU 128 3HD2 LEU 128 18.794 -14.363 17.599
990 H GLU 129 H GLU 129 21.453 -13.655 22.418
991 HA GLU 129 HA GLU 129 19.180 -14.523 24.075
992 1HB GLU 129 2HB GLU 129 20.672 -14.660 25.994
993 2HB GLU 129 1HB GLU 129 21.276 -15.697 24.711
994 1HG GLU 129 2HG GLU 129 22.931 -14.016 24.111
995 2HG GLU 129 1HG GLU 129 22.311 -12.948 25.367
996 H HIS 130 H HIS 130 18.200 -12.917 25.288
997 HA HIS 130 HA HIS 130 18.988 -10.220 24.693
998 1HB HIS 130 2HB HIS 130 17.134 -9.632 26.396
999 2HB HIS 130 1HB HIS 130 16.682 -10.335 24.852
1000 HD1 HIS 130 1HD HIS 130 14.679 -11.668 25.298
1001 HD2 HIS 130 2HD HIS 130 17.573 -12.233 28.238
1002 HE1 HIS 130 1HE HIS 130 13.769 -13.455 26.811
1003 HE2 HIS 130 2HE HIS 130 15.485 -13.725 28.631
1004 H HIS 131 H HIS 131 21.143 -10.839 25.572
1005 HA HIS 131 HA HIS 131 21.494 -10.599 28.426
1006 1HB HIS 131 2HB HIS 131 23.050 -11.971 27.140
1007 2HB HIS 131 1HB HIS 131 23.465 -10.600 26.122
1008 HD1 HIS 131 1HD HIS 131 25.882 -10.307 26.658
1009 HD2 HIS 131 2HD HIS 131 23.519 -10.589 30.075
1010 HE1 HIS 131 1HE HIS 131 27.413 -9.811 28.592
1011 HE2 HIS 131 2HE HIS 131 26.001 -10.145 30.655
1012 H HIS 132 H HIS 132 21.040 -8.676 29.295
1013 HA HIS 132 HA HIS 132 22.232 -6.311 28.053
1014 1HB HIS 132 2HB HIS 132 20.192 -5.004 28.262
1015 2HB HIS 132 1HB HIS 132 19.914 -6.406 27.243
1016 HD1 HIS 132 1HD HIS 132 18.112 -4.546 29.503
1017 HD2 HIS 132 2HD HIS 132 18.881 -8.626 29.248
1018 HE1 HIS 132 1HE HIS 132 16.301 -5.661 30.840
1019 HE2 HIS 132 2HE HIS 132 16.721 -8.130 30.592
1020 H HIS 133 H HIS 133 23.554 -5.543 29.512
1021 HA HIS 133 HA HIS 133 22.468 -5.006 32.182
1022 1HB HIS 133 2HB HIS 133 25.002 -6.445 31.525
1023 2HB HIS 133 1HB HIS 133 24.972 -5.390 32.934
1024 HD1 HIS 133 1HD HIS 133 23.374 -6.070 34.885
1025 HD2 HIS 133 2HD HIS 133 23.684 -8.859 31.812
1026 HE1 HIS 133 1HE HIS 133 22.379 -8.195 35.792
1027 HE2 HIS 133 2HE HIS 133 22.767 -9.913 33.990
1028 H HIS 134 H HIS 134 22.741 -3.021 32.845
1029 HA HIS 134 HA HIS 134 24.923 -1.412 31.710
1030 1HB HIS 134 2HB HIS 134 22.067 -0.498 32.150
1031 2HB HIS 134 1HB HIS 134 23.406 0.571 31.758
1032 HD1 HIS 134 1HD HIS 134 20.761 -1.341 30.237
1033 HD2 HIS 134 2HD HIS 134 24.571 -0.101 29.107
1034 HE1 HIS 134 1HE HIS 134 20.820 -1.513 27.726
1035 HE2 HIS 134 2HE HIS 134 23.070 -0.600 27.054
1036 H HIS 135 H HIS 135 25.323 0.547 33.146
1037 HA HIS 135 HA HIS 135 24.779 -0.180 35.949
1038 1HB HIS 135 2HB HIS 135 27.269 1.029 34.744
1039 2HB HIS 135 1HB HIS 135 26.939 1.060 36.473
1040 HD1 HIS 135 1HD HIS 135 29.125 -0.610 34.552
1041 HD2 HIS 135 2HD HIS 135 26.012 -2.017 36.925
1042 HE1 HIS 135 1HE HIS 135 29.726 -2.990 35.123
1043 HE2 HIS 135 2HE HIS 135 27.841 -3.817 36.591
Start of MODEL 3
1 1H MET 1 1HT MET 1 -21.678 12.175 -8.110
2 2H MET 1 2HT MET 1 -21.370 13.811 -8.409
3 3H MET 1 3HT MET 1 -20.821 13.097 -6.976
4 HA MET 1 HA MET 1 -19.034 13.420 -8.587
5 1HB MET 1 2HB MET 1 -18.966 11.596 -6.918
6 2HB MET 1 1HB MET 1 -19.754 10.524 -8.065
7 1HG MET 1 2HG MET 1 -17.819 10.789 -9.583
8 2HG MET 1 1HG MET 1 -17.026 11.769 -8.350
9 1HE MET 1 1HE MET 1 -14.901 10.201 -8.354
10 2HE MET 1 2HE MET 1 -15.649 9.251 -9.637
11 3HE MET 1 3HE MET 1 -14.986 8.445 -8.217
12 H ILE 2 H ILE 2 -18.281 13.244 -10.667
13 HA ILE 2 HA ILE 2 -20.159 12.534 -12.720
14 HB ILE 2 HB ILE 2 -17.201 13.146 -12.936
15 1HG1 ILE 2 2HG1 ILE 2 -19.619 14.906 -13.394
16 2HG1 ILE 2 1HG1 ILE 2 -18.513 15.013 -12.028
17 1HG2 ILE 2 1HG2 ILE 2 -19.322 12.973 -15.078
18 2HG2 ILE 2 2HG2 ILE 2 -17.955 11.880 -14.852
19 3HG2 ILE 2 3HG2 ILE 2 -17.675 13.558 -15.316
20 1HD1 ILE 2 1HD1 ILE 2 -17.845 15.537 -14.916
21 2HD1 ILE 2 2HD1 ILE 2 -16.698 15.591 -13.577
22 3HD1 ILE 2 3HD1 ILE 2 -18.035 16.739 -13.640
23 H MET 3 H MET 3 -20.591 10.511 -13.257
24 HA MET 3 HA MET 3 -18.699 8.415 -12.538
25 1HB MET 3 2HB MET 3 -21.575 8.285 -13.456
26 2HB MET 3 1HB MET 3 -20.597 6.876 -13.065
27 1HG MET 3 2HG MET 3 -20.323 7.722 -10.774
28 2HG MET 3 1HG MET 3 -21.353 9.095 -11.175
29 1HE MET 3 1HE MET 3 -23.632 7.852 -12.956
30 2HE MET 3 2HE MET 3 -23.944 8.942 -11.605
31 3HE MET 3 3HE MET 3 -24.831 7.422 -11.736
32 H VAL 4 H VAL 4 -17.144 8.476 -14.064
33 HA VAL 4 HA VAL 4 -17.941 8.219 -16.875
34 HB VAL 4 HB VAL 4 -16.355 10.034 -16.334
35 1HG1 VAL 4 1HG1 VAL 4 -14.047 9.509 -15.687
36 2HG1 VAL 4 2HG1 VAL 4 -14.496 7.813 -15.502
37 3HG1 VAL 4 3HG1 VAL 4 -15.212 9.031 -14.449
38 1HG2 VAL 4 1HG2 VAL 4 -14.712 9.570 -18.062
39 2HG2 VAL 4 2HG2 VAL 4 -16.311 9.013 -18.557
40 3HG2 VAL 4 3HG2 VAL 4 -15.107 7.852 -17.997
41 H SER 5 H SER 5 -17.154 6.536 -18.167
42 HA SER 5 HA SER 5 -15.743 4.365 -16.794
43 1HB SER 5 2HB SER 5 -18.162 3.851 -16.710
44 2HB SER 5 1HB SER 5 -18.253 4.013 -18.463
45 HG SER 5 HG SER 5 -17.742 1.991 -18.518
46 H GLY 6 H GLY 6 -14.167 3.476 -18.025
47 1HA GLY 6 2HA GLY 6 -14.036 2.934 -20.674
48 2HA GLY 6 1HA GLY 6 -13.633 4.645 -20.609
49 H CYS 7 H CYS 7 -11.589 3.809 -21.547
50 HA CYS 7 HA CYS 7 -9.569 3.746 -19.580
51 1HB CYS 7 2HB CYS 7 -8.627 1.487 -20.179
52 2HB CYS 7 1HB CYS 7 -10.115 1.439 -19.239
53 HG CYS 7 HG CYS 7 -11.583 0.168 -20.958
54 H GLN 8 H GLN 8 -7.563 4.177 -20.453
55 HA GLN 8 HA GLN 8 -7.448 4.396 -23.386
56 1HB GLN 8 2HB GLN 8 -6.350 6.334 -21.336
57 2HB GLN 8 1HB GLN 8 -5.998 6.405 -23.055
58 1HG GLN 8 2HG GLN 8 -8.345 6.773 -23.543
59 2HG GLN 8 1HG GLN 8 -8.730 6.663 -21.826
60 1HE2 GLN 8 1HE2 GLN 8 -9.592 8.729 -21.807
61 2HE2 GLN 8 2HE2 GLN 8 -8.590 10.139 -21.874
62 H GLN 9 H GLN 9 -5.541 3.826 -24.368
63 HA GLN 9 HA GLN 9 -3.526 2.623 -22.585
64 1HB GLN 9 2HB GLN 9 -4.571 1.711 -25.250
65 2HB GLN 9 1HB GLN 9 -3.000 1.187 -24.659
66 1HG GLN 9 2HG GLN 9 -4.020 0.194 -22.708
67 2HG GLN 9 1HG GLN 9 -5.601 0.800 -23.201
68 1HE2 GLN 9 1HE2 GLN 9 -4.525 -1.964 -22.768
69 2HE2 GLN 9 2HE2 GLN 9 -4.913 -2.805 -24.232
70 H GLN 10 H GLN 10 -2.264 4.460 -22.465
71 HA GLN 10 HA GLN 10 -0.836 5.128 -24.934
72 1HB GLN 10 2HB GLN 10 -1.733 6.947 -22.704
73 2HB GLN 10 1HB GLN 10 -0.507 7.406 -23.872
74 1HG GLN 10 2HG GLN 10 -2.126 7.101 -25.685
75 2HG GLN 10 1HG GLN 10 -3.355 6.670 -24.496
76 1HE2 GLN 10 1HE2 GLN 10 -4.258 8.263 -23.220
77 2HE2 GLN 10 2HE2 GLN 10 -4.062 9.943 -23.557
78 H LYS 11 H LYS 11 1.163 6.668 -23.896
79 HA LYS 11 HA LYS 11 2.819 4.674 -22.632
80 1HB LYS 11 2HB LYS 11 3.484 7.549 -23.288
81 2HB LYS 11 1HB LYS 11 4.627 6.267 -22.912
82 1HG LYS 11 2HG LYS 11 4.045 5.106 -24.950
83 2HG LYS 11 1HG LYS 11 2.820 6.325 -25.317
84 1HD LYS 11 2HD LYS 11 4.631 8.036 -25.322
85 2HD LYS 11 1HD LYS 11 5.800 6.726 -25.146
86 1HE LYS 11 2HE LYS 11 5.595 7.392 -27.472
87 2HE LYS 11 1HE LYS 11 5.025 5.741 -27.234
88 1HZ LYS 11 1HZ LYS 11 3.204 8.087 -27.312
89 2HZ LYS 11 2HZ LYS 11 2.785 6.445 -27.384
90 3HZ LYS 11 3HZ LYS 11 3.599 7.168 -28.682
91 H GLU 12 H GLU 12 3.823 4.851 -20.613
92 HA GLU 12 HA GLU 12 2.314 5.984 -18.532
93 1HB GLU 12 2HB GLU 12 5.236 5.206 -18.424
94 2HB GLU 12 1HB GLU 12 4.139 5.363 -17.061
95 1HG GLU 12 2HG GLU 12 4.132 3.109 -17.308
96 2HG GLU 12 1HG GLU 12 2.783 3.526 -18.362
97 H GLU 13 H GLU 13 2.419 7.880 -17.483
98 HA GLU 13 HA GLU 13 4.166 9.951 -18.547
99 1HB GLU 13 2HB GLU 13 1.517 9.891 -17.573
100 2HB GLU 13 1HB GLU 13 2.443 10.818 -16.400
101 1HG GLU 13 2HG GLU 13 2.285 11.356 -19.357
102 2HG GLU 13 1HG GLU 13 1.454 12.257 -18.087
103 H THR 14 H THR 14 4.598 11.584 -16.422
104 HA THR 14 HA THR 14 6.732 10.242 -15.131
105 HB THR 14 HB THR 14 6.803 12.656 -15.654
106 HG1 THR 14 1HG THR 14 7.045 12.223 -12.840
107 1HG2 THR 14 1HG2 THR 14 5.664 14.271 -14.187
108 2HG2 THR 14 2HG2 THR 14 4.806 12.941 -13.406
109 3HG2 THR 14 3HG2 THR 14 4.522 13.296 -15.110
110 HA PRO 15 HA PRO 15 4.207 8.548 -11.901
111 1HB PRO 15 2HB PRO 15 6.494 7.148 -10.903
112 2HB PRO 15 1HB PRO 15 5.174 6.512 -11.881
113 1HG PRO 15 2HG PRO 15 7.785 6.772 -12.742
114 2HG PRO 15 1HG PRO 15 6.373 6.657 -13.805
115 1HD PRO 15 2HD PRO 15 7.917 9.070 -12.953
116 2HD PRO 15 1HD PRO 15 7.171 8.700 -14.524
117 H PHE 16 H PHE 16 3.861 10.375 -10.605
118 HA PHE 16 HA PHE 16 5.914 11.327 -8.834
119 1HB PHE 16 2HB PHE 16 4.166 12.758 -7.882
120 2HB PHE 16 1HB PHE 16 4.159 12.848 -9.637
121 HD1 PHE 16 1HD PHE 16 2.310 11.922 -10.921
122 HD2 PHE 16 2HD PHE 16 2.334 11.788 -6.664
123 HE1 PHE 16 1HE PHE 16 -0.094 11.409 -10.929
124 HE2 PHE 16 2HE PHE 16 -0.075 11.272 -6.663
125 HZ PHE 16 HZ PHE 16 -1.294 11.073 -8.799
126 H TYR 17 H TYR 17 3.878 8.685 -8.847
127 HA TYR 17 HA TYR 17 3.709 8.438 -5.958
128 1HB TYR 17 2HB TYR 17 2.369 6.395 -6.497
129 2HB TYR 17 1HB TYR 17 1.700 7.880 -7.150
130 HD1 TYR 17 1HD TYR 17 2.104 8.387 -9.621
131 HD2 TYR 17 2HD TYR 17 2.829 4.565 -7.900
132 HE1 TYR 17 1HE TYR 17 2.010 7.371 -11.859
133 HE2 TYR 17 2HE TYR 17 2.746 3.541 -10.133
134 HH TYR 17 HH TYR 17 2.966 5.240 -12.963
135 H TYR 18 H TYR 18 5.954 7.777 -8.267
136 HA TYR 18 HA TYR 18 6.737 5.132 -7.484
137 1HB TYR 18 2HB TYR 18 7.229 5.841 -9.738
138 2HB TYR 18 1HB TYR 18 8.123 7.239 -9.152
139 HD1 TYR 18 2HD TYR 18 8.193 3.539 -9.395
140 HD2 TYR 18 1HD TYR 18 10.411 7.066 -8.569
141 HE1 TYR 18 2HE TYR 18 10.277 2.233 -9.430
142 HE2 TYR 18 1HE TYR 18 12.495 5.765 -8.595
143 HH TYR 18 HH TYR 18 12.714 2.641 -9.820
144 H GLY 19 H GLY 19 8.196 4.521 -5.996
145 1HA GLY 19 2HA GLY 19 10.394 5.179 -4.966
146 2HA GLY 19 1HA GLY 19 9.573 6.664 -4.508
147 H THR 20 H THR 20 10.370 5.925 -2.367
148 HA THR 20 HA THR 20 8.545 3.977 -1.140
149 HB THR 20 HB THR 20 11.156 5.035 -0.038
150 HG1 THR 20 1HG THR 20 10.661 2.439 -1.106
151 1HG2 THR 20 1HG2 THR 20 9.412 2.724 0.834
152 2HG2 THR 20 2HG2 THR 20 9.593 4.259 1.687
153 3HG2 THR 20 3HG2 THR 20 10.968 3.163 1.539
154 H TRP 21 H TRP 21 7.059 4.687 0.246
155 HA TRP 21 HA TRP 21 7.198 7.501 1.106
156 1HB TRP 21 2HB TRP 21 4.759 5.741 0.759
157 2HB TRP 21 1HB TRP 21 4.751 7.442 1.205
158 HD1 TRP 21 HD TRP 21 5.516 5.159 -1.799
159 HE1 TRP 21 1HE TRP 21 5.298 6.545 -3.958
160 HE3 TRP 21 3HE TRP 21 4.757 9.759 0.282
161 HZ2 TRP 21 2HZ TRP 21 4.859 9.239 -4.674
162 HZ3 TRP 21 3HZ TRP 21 4.438 11.688 -1.205
163 HH2 TRP 21 HH TRP 21 4.489 11.435 -3.634
164 H ASP 22 H ASP 22 6.672 8.026 3.240
165 HA ASP 22 HA ASP 22 6.854 5.760 5.119
166 1HB ASP 22 2HB ASP 22 8.743 7.329 5.252
167 2HB ASP 22 1HB ASP 22 7.626 8.662 5.523
168 H GLU 23 H GLU 23 5.377 5.535 6.717
169 HA GLU 23 HA GLU 23 2.783 6.296 6.466
170 1HB GLU 23 2HB GLU 23 4.337 5.696 8.983
171 2HB GLU 23 1HB GLU 23 2.590 5.880 8.958
172 1HG GLU 23 2HG GLU 23 3.961 3.899 7.188
173 2HG GLU 23 1HG GLU 23 3.593 3.526 8.869
174 H GLY 24 H GLY 24 5.066 7.888 8.737
175 1HA GLY 24 2HA GLY 24 4.875 9.870 9.897
176 2HA GLY 24 1HA GLY 24 3.991 10.467 8.497
177 H ARG 25 H ARG 25 2.832 7.681 10.123
178 HA ARG 25 HA ARG 25 0.536 9.201 11.115
179 1HB ARG 25 2HB ARG 25 0.835 6.568 9.718
180 2HB ARG 25 1HB ARG 25 -0.537 6.838 10.773
181 1HG ARG 25 2HG ARG 25 0.145 8.663 8.491
182 2HG ARG 25 1HG ARG 25 -0.919 7.265 8.328
183 1HD ARG 25 2HD ARG 25 -2.322 8.217 10.160
184 2HD ARG 25 1HD ARG 25 -1.318 9.664 10.106
185 HE ARG 25 HE ARG 25 -2.317 10.280 8.118
186 1HH1 ARG 25 1HH1 ARG 25 -3.325 7.038 9.035
187 2HH1 ARG 25 2HH1 ARG 25 -4.638 6.997 7.896
188 1HH2 ARG 25 1HH2 ARG 25 -4.032 10.207 6.608
189 2HH2 ARG 25 2HH2 ARG 25 -5.027 8.781 6.507
190 H ALA 26 H ALA 26 -0.711 7.238 12.515
191 HA ALA 26 HA ALA 26 0.921 7.022 14.878
192 1HB ALA 26 1HB ALA 26 -1.890 6.073 14.338
193 2HB ALA 26 2HB ALA 26 -1.432 7.613 15.067
194 3HB ALA 26 3HB ALA 26 -1.094 6.103 15.912
195 HA PRO 27 HA PRO 27 2.616 2.994 14.300
196 1HB PRO 27 2HB PRO 27 1.840 2.493 17.125
197 2HB PRO 27 1HB PRO 27 3.420 2.354 16.348
198 1HG PRO 27 2HG PRO 27 2.880 4.397 17.958
199 2HG PRO 27 1HG PRO 27 3.832 4.633 16.479
200 1HD PRO 27 2HD PRO 27 0.970 5.302 17.021
201 2HD PRO 27 1HD PRO 27 2.181 6.203 16.086
202 H GLY 28 H GLY 28 2.070 0.826 14.065
203 1HA GLY 28 2HA GLY 28 -0.801 0.350 13.878
204 2HA GLY 28 1HA GLY 28 0.463 -0.620 13.139
205 HA PRO 29 HA PRO 29 -1.302 -3.268 16.531
206 1HB PRO 29 2HB PRO 29 0.038 -5.447 15.357
207 2HB PRO 29 1HB PRO 29 -1.672 -5.060 15.204
208 1HG PRO 29 2HG PRO 29 0.572 -4.512 13.339
209 2HG PRO 29 1HG PRO 29 -1.133 -4.836 12.980
210 1HD PRO 29 2HD PRO 29 -0.089 -2.370 12.783
211 2HD PRO 29 1HD PRO 29 -1.753 -2.633 13.341
212 H THR 30 H THR 30 -0.163 -3.078 18.384
213 HA THR 30 HA THR 30 2.717 -3.032 18.261
214 HB THR 30 HB THR 30 1.713 -1.416 19.643
215 HG1 THR 30 1HG THR 30 3.645 -2.001 20.490
216 1HG2 THR 30 1HG2 THR 30 0.529 -3.638 21.295
217 2HG2 THR 30 2HG2 THR 30 -0.367 -2.551 20.232
218 3HG2 THR 30 3HG2 THR 30 0.440 -1.914 21.665
219 H ASP 31 H ASP 31 2.620 -5.169 17.426
220 HA ASP 31 HA ASP 31 3.141 -7.070 19.616
221 1HB ASP 31 2HB ASP 31 1.114 -7.795 18.442
222 2HB ASP 31 1HB ASP 31 1.983 -7.770 16.910
223 H GLY 32 H GLY 32 3.690 -6.784 16.123
224 1HA GLY 32 2HA GLY 32 6.550 -7.293 16.658
225 2HA GLY 32 1HA GLY 32 5.706 -8.015 15.299
226 H VAL 33 H VAL 33 4.264 -5.953 14.293
227 HA VAL 33 HA VAL 33 6.392 -4.297 13.165
228 HB VAL 33 HB VAL 33 3.506 -4.251 12.329
229 1HG1 VAL 33 1HG1 VAL 33 4.906 -2.475 11.468
230 2HG1 VAL 33 2HG1 VAL 33 4.395 -3.566 10.178
231 3HG1 VAL 33 3HG1 VAL 33 6.033 -3.666 10.819
232 1HG2 VAL 33 1HG2 VAL 33 5.620 -6.176 11.364
233 2HG2 VAL 33 2HG2 VAL 33 4.034 -5.958 10.630
234 3HG2 VAL 33 3HG2 VAL 33 4.164 -6.587 12.272
235 H LYS 34 H LYS 34 6.600 -2.155 13.581
236 HA LYS 34 HA LYS 34 4.575 -0.940 15.322
237 1HB LYS 34 2HB LYS 34 7.493 -0.299 14.914
238 2HB LYS 34 1HB LYS 34 6.410 0.608 15.950
239 1HG LYS 34 2HG LYS 34 6.011 -1.445 17.266
240 2HG LYS 34 1HG LYS 34 7.200 -2.272 16.264
241 1HD LYS 34 2HD LYS 34 7.733 0.155 17.969
242 2HD LYS 34 1HD LYS 34 8.145 -1.506 18.397
243 1HE LYS 34 2HE LYS 34 9.582 -1.625 16.382
244 2HE LYS 34 1HE LYS 34 9.221 0.070 16.058
245 1HZ LYS 34 1HZ LYS 34 10.618 -1.001 18.456
246 2HZ LYS 34 2HZ LYS 34 10.207 0.627 18.225
247 3HZ LYS 34 3HZ LYS 34 11.323 -0.118 17.187
248 H SER 35 H SER 35 5.921 -0.861 12.232
249 HA SER 35 HA SER 35 4.413 1.423 11.399
250 1HB SER 35 2HB SER 35 7.438 1.669 11.343
251 2HB SER 35 1HB SER 35 6.285 2.825 10.679
252 HG SER 35 HG SER 35 5.591 2.446 13.187
253 H ALA 36 H ALA 36 4.821 1.863 9.021
254 HA ALA 36 HA ALA 36 5.953 -0.468 7.655
255 1HB ALA 36 1HB ALA 36 3.557 -0.909 7.884
256 2HB ALA 36 2HB ALA 36 4.005 -0.655 6.196
257 3HB ALA 36 3HB ALA 36 3.196 0.626 7.096
258 H THR 37 H THR 37 6.837 -0.043 5.682
259 HA THR 37 HA THR 37 6.540 2.694 4.642
260 HB THR 37 HB THR 37 8.861 2.207 3.593
261 HG1 THR 37 1HG THR 37 10.081 0.818 5.180
262 1HG2 THR 37 1HG2 THR 37 8.645 2.653 6.571
263 2HG2 THR 37 2HG2 THR 37 8.455 3.896 5.336
264 3HG2 THR 37 3HG2 THR 37 10.013 3.093 5.549
265 H VAL 38 H VAL 38 5.930 2.850 2.529
266 HA VAL 38 HA VAL 38 5.575 0.279 1.143
267 HB VAL 38 HB VAL 38 3.443 1.305 1.766
268 1HG1 VAL 38 1HG1 VAL 38 4.311 3.628 0.053
269 2HG1 VAL 38 2HG1 VAL 38 4.075 3.638 1.801
270 3HG1 VAL 38 3HG1 VAL 38 2.697 3.397 0.727
271 1HG2 VAL 38 1HG2 VAL 38 3.973 1.360 -1.202
272 2HG2 VAL 38 2HG2 VAL 38 2.382 1.266 -0.442
273 3HG2 VAL 38 3HG2 VAL 38 3.537 -0.052 -0.238
274 H THR 39 H THR 39 6.506 -0.007 -0.745
275 HA THR 39 HA THR 39 7.598 2.348 -2.133
276 HB THR 39 HB THR 39 8.721 -0.466 -2.103
277 HG1 THR 39 1HG THR 39 9.142 0.596 -0.143
278 1HG2 THR 39 1HG2 THR 39 9.149 0.677 -4.216
279 2HG2 THR 39 2HG2 THR 39 10.637 0.531 -3.279
280 3HG2 THR 39 3HG2 THR 39 9.784 2.073 -3.346
281 H PHE 40 H PHE 40 6.884 2.676 -4.140
282 HA PHE 40 HA PHE 40 5.250 0.574 -5.370
283 1HB PHE 40 2HB PHE 40 5.441 3.542 -5.935
284 2HB PHE 40 1HB PHE 40 4.473 2.422 -6.886
285 HD1 PHE 40 1HD PHE 40 2.443 1.465 -5.998
286 HD2 PHE 40 2HD PHE 40 4.771 4.184 -3.696
287 HE1 PHE 40 1HE PHE 40 0.553 1.769 -4.450
288 HE2 PHE 40 2HE PHE 40 2.886 4.498 -2.145
289 HZ PHE 40 HZ PHE 40 0.773 3.290 -2.522
290 H THR 41 H THR 41 6.129 -0.610 -6.877
291 HA THR 41 HA THR 41 8.593 0.314 -8.172
292 HB THR 41 HB THR 41 7.577 -2.528 -8.200
293 HG1 THR 41 1HG THR 41 7.983 -1.220 -6.007
294 1HG2 THR 41 1HG2 THR 41 10.310 -1.252 -8.365
295 2HG2 THR 41 2HG2 THR 41 9.484 -2.204 -9.601
296 3HG2 THR 41 3HG2 THR 41 10.061 -2.982 -8.129
297 H GLU 42 H GLU 42 8.787 -0.833 -10.450
298 HA GLU 42 HA GLU 42 7.177 0.470 -12.220
299 1HB GLU 42 2HB GLU 42 9.346 -0.548 -12.733
300 2HB GLU 42 1HB GLU 42 8.619 -2.141 -12.644
301 1HG GLU 42 2HG GLU 42 7.299 -1.727 -14.583
302 2HG GLU 42 1HG GLU 42 7.785 -0.030 -14.611
303 H ASP 43 H ASP 43 6.811 -2.988 -11.302
304 HA ASP 43 HA ASP 43 4.170 -2.897 -12.630
305 1HB ASP 43 2HB ASP 43 5.825 -4.310 -13.793
306 2HB ASP 43 1HB ASP 43 6.038 -5.256 -12.326
307 H GLU 44 H GLU 44 5.871 -3.530 -9.728
308 HA GLU 44 HA GLU 44 3.457 -4.706 -8.535
309 1HB GLU 44 2HB GLU 44 4.919 -6.128 -7.133
310 2HB GLU 44 1HB GLU 44 5.032 -6.504 -8.846
311 1HG GLU 44 2HG GLU 44 7.013 -4.720 -7.460
312 2HG GLU 44 1HG GLU 44 7.190 -6.472 -7.505
313 H VAL 45 H VAL 45 3.177 -4.360 -6.286
314 HA VAL 45 HA VAL 45 4.614 -2.011 -5.243
315 HB VAL 45 HB VAL 45 1.966 -3.168 -4.341
316 1HG1 VAL 45 1HG1 VAL 45 1.738 -1.128 -3.029
317 2HG1 VAL 45 2HG1 VAL 45 3.335 -0.601 -3.559
318 3HG1 VAL 45 3HG1 VAL 45 3.171 -2.035 -2.545
319 1HG2 VAL 45 1HG2 VAL 45 0.968 -1.170 -5.345
320 2HG2 VAL 45 2HG2 VAL 45 1.766 -2.191 -6.545
321 3HG2 VAL 45 3HG2 VAL 45 2.548 -0.713 -5.981
322 H VAL 46 H VAL 46 5.974 -2.300 -3.585
323 HA VAL 46 HA VAL 46 5.755 -4.795 -2.038
324 HB VAL 46 HB VAL 46 8.245 -3.193 -2.642
325 1HG1 VAL 46 1HG1 VAL 46 7.916 -5.660 -0.946
326 2HG1 VAL 46 2HG1 VAL 46 8.348 -4.046 -0.385
327 3HG1 VAL 46 3HG1 VAL 46 9.458 -4.947 -1.423
328 1HG2 VAL 46 1HG2 VAL 46 7.546 -4.556 -4.517
329 2HG2 VAL 46 2HG2 VAL 46 7.440 -5.976 -3.472
330 3HG2 VAL 46 3HG2 VAL 46 9.005 -5.220 -3.783
331 H GLU 47 H GLU 47 5.189 -4.515 0.013
332 HA GLU 47 HA GLU 47 5.730 -1.912 1.268
333 1HB GLU 47 2HB GLU 47 3.358 -2.596 1.278
334 2HB GLU 47 1HB GLU 47 3.792 -4.076 2.121
335 1HG GLU 47 2HG GLU 47 4.550 -2.782 4.037
336 2HG GLU 47 1HG GLU 47 4.168 -1.285 3.192
337 H THR 48 H THR 48 7.052 -1.791 2.974
338 HA THR 48 HA THR 48 8.224 -4.299 3.944
339 HB THR 48 HB THR 48 9.897 -2.361 4.858
340 HG1 THR 48 1HG THR 48 9.091 -0.620 3.805
341 1HG2 THR 48 1HG2 THR 48 10.554 -4.396 3.665
342 2HG2 THR 48 2HG2 THR 48 11.384 -2.980 3.019
343 3HG2 THR 48 3HG2 THR 48 10.018 -3.675 2.147
344 H GLU 49 H GLU 49 7.830 -4.869 5.974
345 HA GLU 49 HA GLU 49 6.377 -2.968 7.668
346 1HB GLU 49 2HB GLU 49 6.818 -5.912 8.164
347 2HB GLU 49 1HB GLU 49 5.644 -4.867 8.944
348 1HG GLU 49 2HG GLU 49 4.496 -4.609 6.762
349 2HG GLU 49 1HG GLU 49 5.619 -5.783 6.078
350 H VAL 50 H VAL 50 7.340 -2.041 9.354
351 HA VAL 50 HA VAL 50 10.080 -2.790 9.955
352 HB VAL 50 HB VAL 50 8.413 -0.580 11.185
353 1HG1 VAL 50 1HG1 VAL 50 11.389 -1.044 11.175
354 2HG1 VAL 50 2HG1 VAL 50 10.309 -1.237 12.557
355 3HG1 VAL 50 3HG1 VAL 50 10.566 0.360 11.853
356 1HG2 VAL 50 1HG2 VAL 50 8.662 -0.287 8.754
357 2HG2 VAL 50 2HG2 VAL 50 10.413 -0.399 8.934
358 3HG2 VAL 50 3HG2 VAL 50 9.537 0.946 9.663
359 H MET 51 H MET 51 10.435 -4.338 11.306
360 HA MET 51 HA MET 51 8.532 -4.813 13.492
361 1HB MET 51 2HB MET 51 10.294 -6.720 11.951
362 2HB MET 51 1HB MET 51 9.351 -7.171 13.366
363 1HG MET 51 2HG MET 51 7.294 -6.591 12.183
364 2HG MET 51 1HG MET 51 8.238 -6.119 10.771
365 1HE MET 51 1HE MET 51 8.057 -10.436 12.390
366 2HE MET 51 2HE MET 51 7.153 -9.098 13.096
367 3HE MET 51 3HE MET 51 8.914 -9.120 13.189
368 H GLU 52 H GLU 52 9.277 -4.803 15.514
369 HA GLU 52 HA GLU 52 11.751 -3.586 16.049
370 1HB GLU 52 2HB GLU 52 9.750 -3.413 17.500
371 2HB GLU 52 1HB GLU 52 9.965 -5.093 17.966
372 1HG GLU 52 2HG GLU 52 11.946 -4.625 19.138
373 2HG GLU 52 1HG GLU 52 12.101 -3.034 18.395
374 H GLY 53 H GLY 53 13.700 -4.436 15.973
375 1HA GLY 53 2HA GLY 53 15.364 -5.931 16.781
376 2HA GLY 53 1HA GLY 53 14.124 -7.164 16.974
377 H ARG 54 H ARG 54 13.078 -6.426 14.249
378 HA ARG 54 HA ARG 54 14.878 -8.197 12.766
379 1HB ARG 54 2HB ARG 54 12.188 -7.190 11.861
380 2HB ARG 54 1HB ARG 54 13.052 -8.621 11.323
381 1HG ARG 54 2HG ARG 54 12.173 -8.404 14.161
382 2HG ARG 54 1HG ARG 54 11.020 -8.834 12.905
383 1HD ARG 54 2HD ARG 54 11.789 -10.891 13.695
384 2HD ARG 54 1HD ARG 54 12.728 -10.627 12.228
385 HE ARG 54 HE ARG 54 13.790 -10.052 14.929
386 1HH1 ARG 54 1HH1 ARG 54 14.119 -11.421 11.714
387 2HH1 ARG 54 2HH1 ARG 54 15.764 -11.935 11.966
388 1HH2 ARG 54 1HH2 ARG 54 15.930 -10.772 15.276
389 2HH2 ARG 54 2HH2 ARG 54 16.774 -11.595 13.999
390 H GLY 55 H GLY 55 12.948 -5.303 12.214
391 1HA GLY 55 2HA GLY 55 14.081 -3.303 11.273
392 2HA GLY 55 1HA GLY 55 14.921 -4.413 10.191
393 H GLU 56 H GLU 56 14.053 -3.273 8.356
394 HA GLU 56 HA GLU 56 11.197 -3.410 7.924
395 1HB GLU 56 2HB GLU 56 13.481 -2.584 6.122
396 2HB GLU 56 1HB GLU 56 11.791 -2.521 5.668
397 1HG GLU 56 2HG GLU 56 11.346 -0.918 7.426
398 2HG GLU 56 1HG GLU 56 13.023 -1.013 7.951
399 H VAL 57 H VAL 57 10.245 -5.158 7.344
400 HA VAL 57 HA VAL 57 11.736 -7.237 5.902
401 HB VAL 57 HB VAL 57 9.198 -7.376 7.533
402 1HG1 VAL 57 1HG1 VAL 57 9.076 -8.951 5.668
403 2HG1 VAL 57 2HG1 VAL 57 9.302 -9.810 7.193
404 3HG1 VAL 57 3HG1 VAL 57 10.665 -9.592 6.095
405 1HG2 VAL 57 1HG2 VAL 57 11.959 -8.485 8.026
406 2HG2 VAL 57 2HG2 VAL 57 10.544 -8.790 9.035
407 3HG2 VAL 57 3HG2 VAL 57 11.190 -7.154 8.892
408 H GLN 58 H GLN 58 11.282 -7.586 3.825
409 HA GLN 58 HA GLN 58 9.289 -5.980 2.528
410 1HB GLN 58 2HB GLN 58 11.084 -8.125 1.387
411 2HB GLN 58 1HB GLN 58 10.205 -6.914 0.481
412 1HG GLN 58 2HG GLN 58 11.550 -5.156 1.522
413 2HG GLN 58 1HG GLN 58 12.443 -6.389 2.408
414 1HE2 GLN 58 1HE2 GLN 58 13.827 -7.763 1.279
415 2HE2 GLN 58 2HE2 GLN 58 14.445 -7.348 -0.282
416 H LEU 59 H LEU 59 7.277 -6.562 2.085
417 HA LEU 59 HA LEU 59 6.387 -9.280 2.497
418 1HB LEU 59 2HB LEU 59 4.953 -6.787 1.578
419 2HB LEU 59 1HB LEU 59 4.167 -8.342 1.782
420 HG LEU 59 HG LEU 59 5.527 -6.786 3.978
421 1HD1 LEU 59 1HD1 LEU 59 3.495 -5.683 3.238
422 2HD1 LEU 59 2HD1 LEU 59 3.255 -6.425 4.820
423 3HD1 LEU 59 3HD1 LEU 59 2.603 -7.198 3.374
424 1HD2 LEU 59 1HD2 LEU 59 4.487 -8.435 5.458
425 2HD2 LEU 59 2HD2 LEU 59 5.630 -9.182 4.341
426 3HD2 LEU 59 3HD2 LEU 59 3.895 -9.318 4.050
427 HA PRO 60 HA PRO 60 6.437 -10.922 -1.655
428 1HB PRO 60 2HB PRO 60 3.480 -11.219 -1.331
429 2HB PRO 60 1HB PRO 60 4.679 -12.414 -1.838
430 1HG PRO 60 2HG PRO 60 3.649 -12.479 0.612
431 2HG PRO 60 1HG PRO 60 5.360 -12.846 0.333
432 1HD PRO 60 2HD PRO 60 4.110 -10.398 1.482
433 2HD PRO 60 1HD PRO 60 5.664 -11.165 1.866
434 H PHE 61 H PHE 61 6.142 -10.140 -3.705
435 HA PHE 61 HA PHE 61 5.340 -7.435 -3.903
436 1HB PHE 61 2HB PHE 61 5.799 -7.702 -6.341
437 2HB PHE 61 1HB PHE 61 7.132 -8.174 -5.301
438 HD1 PHE 61 1HD PHE 61 7.732 -10.546 -5.051
439 HD2 PHE 61 2HD PHE 61 4.682 -9.283 -7.743
440 HE1 PHE 61 1HE PHE 61 7.853 -12.717 -6.209
441 HE2 PHE 61 2HE PHE 61 4.791 -11.451 -8.893
442 HZ PHE 61 HZ PHE 61 6.379 -13.168 -8.131
443 H MET 62 H MET 62 3.503 -6.553 -4.389
444 HA MET 62 HA MET 62 1.276 -8.297 -5.190
445 1HB MET 62 2HB MET 62 1.256 -5.549 -3.917
446 2HB MET 62 1HB MET 62 -0.180 -6.459 -4.366
447 1HG MET 62 2HG MET 62 0.351 -8.176 -2.756
448 2HG MET 62 1HG MET 62 1.875 -7.381 -2.368
449 1HE MET 62 1HE MET 62 2.071 -5.069 -1.143
450 2HE MET 62 2HE MET 62 0.695 -4.104 -0.613
451 3HE MET 62 3HE MET 62 1.023 -4.300 -2.336
452 H ALA 63 H ALA 63 0.636 -8.201 -7.232
453 HA ALA 63 HA ALA 63 1.725 -6.263 -9.033
454 1HB ALA 63 1HB ALA 63 1.342 -8.584 -9.724
455 2HB ALA 63 2HB ALA 63 0.465 -7.452 -10.753
456 3HB ALA 63 3HB ALA 63 -0.396 -8.359 -9.508
457 H TYR 64 H TYR 64 0.786 -4.463 -9.859
458 HA TYR 64 HA TYR 64 -2.021 -3.959 -9.141
459 1HB TYR 64 2HB TYR 64 -1.571 -1.719 -8.519
460 2HB TYR 64 1HB TYR 64 -0.341 -2.680 -7.711
461 HD1 TYR 64 2HD TYR 64 1.999 -2.704 -8.667
462 HD2 TYR 64 1HD TYR 64 -0.993 -0.013 -10.040
463 HE1 TYR 64 2HE TYR 64 3.743 -1.279 -9.657
464 HE2 TYR 64 1HE TYR 64 0.740 1.420 -11.031
465 HH TYR 64 HH TYR 64 3.966 0.398 -11.425
466 H LYS 65 H LYS 65 -3.247 -2.865 -10.629
467 HA LYS 65 HA LYS 65 -1.925 -2.099 -13.153
468 1HB LYS 65 2HB LYS 65 -3.921 -2.739 -14.371
469 2HB LYS 65 1HB LYS 65 -3.359 -4.112 -13.429
470 1HG LYS 65 2HG LYS 65 -5.069 -3.677 -11.752
471 2HG LYS 65 1HG LYS 65 -5.627 -2.279 -12.673
472 1HD LYS 65 2HD LYS 65 -5.624 -5.138 -13.640
473 2HD LYS 65 1HD LYS 65 -7.037 -4.250 -13.072
474 1HE LYS 65 2HE LYS 65 -6.815 -2.672 -14.891
475 2HE LYS 65 1HE LYS 65 -5.327 -3.449 -15.421
476 1HZ LYS 65 1HZ LYS 65 -8.080 -4.539 -15.529
477 2HZ LYS 65 2HZ LYS 65 -6.701 -5.509 -15.740
478 3HZ LYS 65 3HZ LYS 65 -7.018 -4.238 -16.815
479 H VAL 66 H VAL 66 -3.050 -0.376 -14.302
480 HA VAL 66 HA VAL 66 -3.978 1.603 -12.358
481 HB VAL 66 HB VAL 66 -2.734 1.928 -15.090
482 1HG1 VAL 66 1HG1 VAL 66 -4.375 3.703 -14.712
483 2HG1 VAL 66 2HG1 VAL 66 -2.729 4.336 -14.651
484 3HG1 VAL 66 3HG1 VAL 66 -3.627 4.068 -13.157
485 1HG2 VAL 66 1HG2 VAL 66 -1.145 1.286 -13.374
486 2HG2 VAL 66 2HG2 VAL 66 -1.714 2.590 -12.331
487 3HG2 VAL 66 3HG2 VAL 66 -0.891 2.967 -13.844
488 H ILE 67 H ILE 67 -6.043 2.142 -12.333
489 HA ILE 67 HA ILE 67 -7.765 1.470 -14.587
490 HB ILE 67 HB ILE 67 -8.610 2.848 -12.042
491 1HG1 ILE 67 2HG1 ILE 67 -8.401 -0.131 -12.543
492 2HG1 ILE 67 1HG1 ILE 67 -7.445 0.800 -11.399
493 1HG2 ILE 67 1HG2 ILE 67 -10.788 1.899 -12.557
494 2HG2 ILE 67 2HG2 ILE 67 -10.116 1.101 -13.980
495 3HG2 ILE 67 3HG2 ILE 67 -10.191 2.862 -13.908
496 1HD1 ILE 67 1HD1 ILE 67 -9.200 -0.412 -10.261
497 2HD1 ILE 67 2HD1 ILE 67 -10.416 0.361 -11.274
498 3HD1 ILE 67 3HD1 ILE 67 -9.472 1.325 -10.139
499 H SER 68 H SER 68 -6.843 4.264 -12.637
500 HA SER 68 HA SER 68 -7.166 5.993 -14.966
501 1HB SER 68 2HB SER 68 -8.312 6.735 -12.281
502 2HB SER 68 1HB SER 68 -8.483 7.615 -13.784
503 HG SER 68 HG SER 68 -9.370 5.148 -14.189
504 H GLN 69 H GLN 69 -6.039 8.005 -14.707
505 HA GLN 69 HA GLN 69 -4.275 8.300 -12.436
506 1HB GLN 69 2HB GLN 69 -2.981 6.818 -13.895
507 2HB GLN 69 1HB GLN 69 -3.152 7.955 -15.222
508 1HG GLN 69 2HG GLN 69 -1.840 9.597 -14.043
509 2HG GLN 69 1HG GLN 69 -1.756 8.556 -12.624
510 1HE2 GLN 69 1HE2 GLN 69 -1.371 6.140 -14.227
511 2HE2 GLN 69 2HE2 GLN 69 0.257 6.197 -14.794
512 H SER 70 H SER 70 -4.003 10.356 -11.964
513 HA SER 70 HA SER 70 -3.759 12.460 -13.829
514 1HB SER 70 2HB SER 70 -6.191 11.994 -14.095
515 2HB SER 70 1HB SER 70 -6.415 12.310 -12.378
516 HG SER 70 HG SER 70 -5.902 14.073 -14.483
517 H THR 71 H THR 71 -3.547 14.532 -12.750
518 HA THR 71 HA THR 71 -2.614 14.278 -10.026
519 HB THR 71 HB THR 71 -1.283 15.624 -11.499
520 HG1 THR 71 1HG THR 71 -2.677 17.007 -9.461
521 1HG2 THR 71 1HG2 THR 71 -2.121 17.710 -12.502
522 2HG2 THR 71 2HG2 THR 71 -3.740 17.317 -11.921
523 3HG2 THR 71 3HG2 THR 71 -2.959 16.287 -13.121
524 H ASP 72 H ASP 72 -5.254 15.697 -11.799
525 HA ASP 72 HA ASP 72 -6.442 16.707 -9.312
526 1HB ASP 72 2HB ASP 72 -7.063 17.254 -12.213
527 2HB ASP 72 1HB ASP 72 -8.138 17.751 -10.910
528 H GLY 73 H GLY 73 -7.064 14.566 -12.026
529 1HA GLY 73 2HA GLY 73 -9.609 13.683 -10.999
530 2HA GLY 73 1HA GLY 73 -8.734 13.005 -12.367
531 H SER 74 H SER 74 -6.489 13.120 -10.078
532 HA SER 74 HA SER 74 -5.538 11.726 -8.574
533 1HB SER 74 2HB SER 74 -7.666 11.955 -7.346
534 2HB SER 74 1HB SER 74 -8.339 10.610 -8.260
535 HG SER 74 HG SER 74 -6.814 9.255 -7.289
536 H ILE 75 H ILE 75 -5.055 9.376 -8.166
537 HA ILE 75 HA ILE 75 -5.217 7.890 -10.703
538 HB ILE 75 HB ILE 75 -3.291 7.482 -8.406
539 1HG1 ILE 75 2HG1 ILE 75 -2.920 8.884 -11.054
540 2HG1 ILE 75 1HG1 ILE 75 -2.794 9.593 -9.453
541 1HG2 ILE 75 1HG2 ILE 75 -3.365 6.278 -11.169
542 2HG2 ILE 75 2HG2 ILE 75 -3.673 5.440 -9.648
543 3HG2 ILE 75 3HG2 ILE 75 -2.061 6.062 -10.003
544 1HD1 ILE 75 1HD1 ILE 75 -0.607 9.230 -10.432
545 2HD1 ILE 75 2HD1 ILE 75 -0.957 7.510 -10.592
546 3HD1 ILE 75 3HD1 ILE 75 -0.828 8.236 -8.990
547 H GLU 76 H GLU 76 -6.152 5.911 -10.749
548 HA GLU 76 HA GLU 76 -6.909 4.722 -8.169
549 1HB GLU 76 2HB GLU 76 -8.843 5.663 -9.568
550 2HB GLU 76 1HB GLU 76 -8.501 4.356 -10.695
551 1HG GLU 76 2HG GLU 76 -8.964 2.698 -9.043
552 2HG GLU 76 1HG GLU 76 -9.100 3.918 -7.781
553 H ILE 77 H ILE 77 -6.230 2.703 -7.865
554 HA ILE 77 HA ILE 77 -5.111 1.295 -10.190
555 HB ILE 77 HB ILE 77 -3.393 0.322 -8.692
556 1HG1 ILE 77 2HG1 ILE 77 -4.304 2.440 -6.733
557 2HG1 ILE 77 1HG1 ILE 77 -4.599 0.715 -6.553
558 1HG2 ILE 77 1HG2 ILE 77 -2.833 2.189 -10.136
559 2HG2 ILE 77 2HG2 ILE 77 -1.964 2.324 -8.609
560 3HG2 ILE 77 3HG2 ILE 77 -3.381 3.330 -8.910
561 1HD1 ILE 77 1HD1 ILE 77 -2.735 1.473 -5.180
562 2HD1 ILE 77 2HD1 ILE 77 -1.888 2.029 -6.625
563 3HD1 ILE 77 3HD1 ILE 77 -2.208 0.308 -6.395
564 H GLN 78 H GLN 78 -5.010 -1.028 -9.953
565 HA GLN 78 HA GLN 78 -6.960 -2.115 -8.041
566 1HB GLN 78 2HB GLN 78 -8.091 -1.771 -10.188
567 2HB GLN 78 1HB GLN 78 -6.841 -2.691 -11.008
568 1HG GLN 78 2HG GLN 78 -7.548 -4.710 -10.030
569 2HG GLN 78 1HG GLN 78 -8.572 -3.869 -8.861
570 1HE2 GLN 78 1HE2 GLN 78 -10.550 -3.072 -9.496
571 2HE2 GLN 78 2HE2 GLN 78 -11.286 -3.476 -11.005
572 H TYR 79 H TYR 79 -6.402 -4.075 -7.190
573 HA TYR 79 HA TYR 79 -3.681 -4.904 -7.654
574 1HB TYR 79 2HB TYR 79 -5.802 -5.989 -5.788
575 2HB TYR 79 1HB TYR 79 -4.130 -6.537 -5.832
576 HD1 TYR 79 1HD TYR 79 -2.342 -4.600 -5.559
577 HD2 TYR 79 2HD TYR 79 -6.382 -4.380 -4.246
578 HE1 TYR 79 1HE TYR 79 -1.715 -2.856 -3.945
579 HE2 TYR 79 2HE TYR 79 -5.768 -2.633 -2.629
580 HH TYR 79 HH TYR 79 -3.718 -1.865 -1.426
581 H LEU 80 H LEU 80 -3.022 -6.937 -8.320
582 HA LEU 80 HA LEU 80 -5.026 -8.447 -9.852
583 1HB LEU 80 2HB LEU 80 -2.038 -8.247 -10.222
584 2HB LEU 80 1HB LEU 80 -3.085 -9.305 -11.150
585 HG LEU 80 HG LEU 80 -3.242 -6.288 -11.124
586 1HD1 LEU 80 1HD1 LEU 80 -2.382 -6.439 -13.407
587 2HD1 LEU 80 2HD1 LEU 80 -2.210 -8.185 -13.231
588 3HD1 LEU 80 3HD1 LEU 80 -1.231 -7.101 -12.246
589 1HD2 LEU 80 1HD2 LEU 80 -4.799 -6.601 -12.998
590 2HD2 LEU 80 2HD2 LEU 80 -5.410 -7.302 -11.501
591 3HD2 LEU 80 3HD2 LEU 80 -4.731 -8.346 -12.750
592 H GLY 81 H GLY 81 -3.764 -10.843 -10.191
593 1HA GLY 81 2HA GLY 81 -3.285 -12.821 -9.080
594 2HA GLY 81 1HA GLY 81 -2.840 -11.868 -7.668
595 HA PRO 82 HA PRO 82 -6.773 -13.974 -6.420
596 1HB PRO 82 2HB PRO 82 -5.511 -13.428 -3.789
597 2HB PRO 82 1HB PRO 82 -6.265 -14.911 -4.390
598 1HG PRO 82 2HG PRO 82 -3.613 -14.717 -4.156
599 2HG PRO 82 1HG PRO 82 -4.355 -15.580 -5.516
600 1HD PRO 82 2HD PRO 82 -3.132 -12.850 -5.448
601 2HD PRO 82 1HD PRO 82 -3.043 -14.098 -6.709
602 H TYR 83 H TYR 83 -5.188 -10.982 -5.836
603 HA TYR 83 HA TYR 83 -7.427 -9.834 -4.353
604 1HB TYR 83 2HB TYR 83 -4.873 -8.453 -5.193
605 2HB TYR 83 1HB TYR 83 -5.999 -7.956 -3.935
606 HD1 TYR 83 2HD TYR 83 -6.103 -9.246 -1.804
607 HD2 TYR 83 1HD TYR 83 -3.139 -10.010 -4.756
608 HE1 TYR 83 2HE TYR 83 -4.754 -10.447 -0.135
609 HE2 TYR 83 1HE TYR 83 -1.782 -11.206 -3.095
610 HH TYR 83 HH TYR 83 -3.010 -12.089 -0.005
611 H TYR 84 H TYR 84 -7.355 -10.592 -7.325
612 HA TYR 84 HA TYR 84 -7.320 -8.280 -8.892
613 1HB TYR 84 2HB TYR 84 -8.258 -9.602 -10.628
614 2HB TYR 84 1HB TYR 84 -7.223 -10.669 -9.699
615 HD1 TYR 84 2HD TYR 84 -8.575 -12.001 -7.754
616 HD2 TYR 84 1HD TYR 84 -10.266 -10.404 -11.314
617 HE1 TYR 84 2HE TYR 84 -10.430 -13.612 -7.597
618 HE2 TYR 84 1HE TYR 84 -12.119 -12.003 -11.165
619 HH TYR 84 HH TYR 84 -12.647 -14.116 -10.193
620 HA PRO 85 HA PRO 85 -10.252 -5.585 -9.786
621 1HB PRO 85 2HB PRO 85 -12.515 -7.400 -9.070
622 2HB PRO 85 1HB PRO 85 -12.545 -5.956 -10.096
623 1HG PRO 85 2HG PRO 85 -11.962 -8.551 -10.999
624 2HG PRO 85 1HG PRO 85 -11.574 -7.053 -11.862
625 1HD PRO 85 2HD PRO 85 -9.683 -8.875 -10.875
626 2HD PRO 85 1HD PRO 85 -9.340 -7.175 -11.280
627 H LEU 86 H LEU 86 -9.862 -7.021 -6.727
628 HA LEU 86 HA LEU 86 -11.093 -4.954 -5.210
629 1HB LEU 86 2HB LEU 86 -10.246 -7.023 -4.180
630 2HB LEU 86 1HB LEU 86 -8.609 -6.581 -4.618
631 HG LEU 86 HG LEU 86 -8.779 -4.605 -3.126
632 1HD1 LEU 86 1HD1 LEU 86 -10.613 -4.513 -1.501
633 2HD1 LEU 86 2HD1 LEU 86 -11.410 -5.844 -2.338
634 3HD1 LEU 86 3HD1 LEU 86 -11.185 -4.298 -3.156
635 1HD2 LEU 86 1HD2 LEU 86 -9.324 -7.272 -1.832
636 2HD2 LEU 86 2HD2 LEU 86 -8.621 -5.866 -1.033
637 3HD2 LEU 86 3HD2 LEU 86 -7.749 -6.665 -2.344
638 H LYS 87 H LYS 87 -10.589 -2.814 -5.285
639 HA LYS 87 HA LYS 87 -8.073 -2.142 -6.647
640 1HB LYS 87 2HB LYS 87 -9.146 -0.168 -7.510
641 2HB LYS 87 1HB LYS 87 -10.161 -1.563 -7.850
642 1HG LYS 87 2HG LYS 87 -11.666 -0.979 -6.080
643 2HG LYS 87 1HG LYS 87 -10.600 0.323 -5.546
644 1HD LYS 87 2HD LYS 87 -10.902 1.364 -7.812
645 2HD LYS 87 1HD LYS 87 -12.145 0.152 -8.126
646 1HE LYS 87 2HE LYS 87 -13.436 0.948 -6.237
647 2HE LYS 87 1HE LYS 87 -12.170 2.100 -5.833
648 1HZ LYS 87 1HZ LYS 87 -13.846 2.108 -8.283
649 2HZ LYS 87 2HZ LYS 87 -12.554 3.174 -7.999
650 3HZ LYS 87 3HZ LYS 87 -13.922 3.220 -7.000
651 H SER 88 H SER 88 -7.591 0.314 -6.261
652 HA SER 88 HA SER 88 -7.883 1.176 -3.511
653 1HB SER 88 2HB SER 88 -5.932 -0.315 -3.380
654 2HB SER 88 1HB SER 88 -5.177 0.529 -4.728
655 HG SER 88 HG SER 88 -5.929 1.879 -2.363
656 H THR 89 H THR 89 -6.834 3.413 -3.296
657 HA THR 89 HA THR 89 -6.837 4.771 -5.912
658 HB THR 89 HB THR 89 -7.926 6.058 -3.432
659 HG1 THR 89 1HG THR 89 -9.136 4.194 -5.134
660 1HG2 THR 89 1HG2 THR 89 -7.350 7.537 -5.283
661 2HG2 THR 89 2HG2 THR 89 -9.097 7.485 -5.050
662 3HG2 THR 89 3HG2 THR 89 -8.355 6.581 -6.371
663 H LEU 90 H LEU 90 -5.422 6.407 -6.182
664 HA LEU 90 HA LEU 90 -3.596 7.055 -3.964
665 1HB LEU 90 2HB LEU 90 -2.915 6.636 -6.878
666 2HB LEU 90 1HB LEU 90 -1.814 7.342 -5.711
667 HG LEU 90 HG LEU 90 -2.924 4.537 -5.563
668 1HD1 LEU 90 1HD1 LEU 90 -1.399 4.789 -7.442
669 2HD1 LEU 90 2HD1 LEU 90 -0.648 3.847 -6.154
670 3HD1 LEU 90 3HD1 LEU 90 -0.200 5.536 -6.388
671 1HD2 LEU 90 1HD2 LEU 90 -2.409 5.509 -3.378
672 2HD2 LEU 90 2HD2 LEU 90 -0.791 5.924 -3.944
673 3HD2 LEU 90 3HD2 LEU 90 -1.268 4.231 -3.799
674 H LYS 91 H LYS 91 -3.579 9.163 -3.515
675 HA LYS 91 HA LYS 91 -4.480 11.064 -5.564
676 1HB LYS 91 2HB LYS 91 -6.268 10.275 -3.962
677 2HB LYS 91 1HB LYS 91 -5.376 11.072 -2.686
678 1HG LYS 91 2HG LYS 91 -5.754 13.203 -3.657
679 2HG LYS 91 1HG LYS 91 -6.422 12.470 -5.121
680 1HD LYS 91 2HD LYS 91 -7.603 12.271 -2.346
681 2HD LYS 91 1HD LYS 91 -8.211 13.289 -3.656
682 1HE LYS 91 2HE LYS 91 -8.907 11.449 -4.919
683 2HE LYS 91 1HE LYS 91 -7.902 10.326 -4.005
684 1HZ LYS 91 1HZ LYS 91 -10.212 11.758 -2.816
685 2HZ LYS 91 2HZ LYS 91 -9.368 10.424 -2.180
686 3HZ LYS 91 3HZ LYS 91 -10.349 10.233 -3.549
687 H ARG 92 H ARG 92 -3.897 13.321 -5.003
688 HA ARG 92 HA ARG 92 -1.185 13.295 -3.972
689 1HB ARG 92 2HB ARG 92 -0.964 15.489 -4.980
690 2HB ARG 92 1HB ARG 92 -1.599 14.337 -6.140
691 1HG ARG 92 2HG ARG 92 -3.795 15.215 -5.898
692 2HG ARG 92 1HG ARG 92 -3.288 16.260 -4.574
693 1HD ARG 92 2HD ARG 92 -1.879 17.536 -6.060
694 2HD ARG 92 1HD ARG 92 -2.221 16.433 -7.392
695 HE ARG 92 HE ARG 92 -4.661 17.230 -6.911
696 1HH1 ARG 92 1HH1 ARG 92 -1.754 19.210 -6.790
697 2HH1 ARG 92 2HH1 ARG 92 -2.575 20.646 -7.310
698 1HH2 ARG 92 1HH2 ARG 92 -5.717 19.122 -7.602
699 2HH2 ARG 92 2HH2 ARG 92 -4.822 20.607 -7.751
700 H GLY 93 H GLY 93 -0.387 14.750 -2.446
701 1HA GLY 93 2HA GLY 93 -2.408 15.955 -0.692
702 2HA GLY 93 1HA GLY 93 -0.810 15.428 -0.176
703 H GLU 94 H GLU 94 -1.716 17.949 0.364
704 HA GLU 94 HA GLU 94 -0.834 19.774 -1.681
705 1HB GLU 94 2HB GLU 94 -1.997 20.202 1.066
706 2HB GLU 94 1HB GLU 94 -1.603 21.492 -0.052
707 1HG GLU 94 2HG GLU 94 -3.241 20.738 -1.614
708 2HG GLU 94 1HG GLU 94 -3.543 19.285 -0.661
709 H ASN 95 H ASN 95 0.683 18.149 0.834
710 HA ASN 95 HA ASN 95 2.766 20.225 1.004
711 1HB ASN 95 2HB ASN 95 1.695 18.590 3.318
712 2HB ASN 95 1HB ASN 95 3.073 19.683 3.404
713 1HD2 ASN 95 1HD2 ASN 95 -0.369 19.412 3.218
714 2HD2 ASN 95 2HD2 ASN 95 -0.736 21.081 3.510
715 H GLY 96 H GLY 96 3.095 18.302 -0.807
716 1HA GLY 96 2HA GLY 96 4.642 16.740 -1.498
717 2HA GLY 96 1HA GLY 96 5.462 16.961 0.042
718 H THR 97 H THR 97 2.129 16.034 -0.170
719 HA THR 97 HA THR 97 2.828 13.485 1.079
720 HB THR 97 HB THR 97 0.220 13.750 1.672
721 HG1 THR 97 1HG THR 97 0.063 16.087 2.298
722 1HG2 THR 97 1HG2 THR 97 2.490 15.058 3.174
723 2HG2 THR 97 2HG2 THR 97 2.013 13.362 3.282
724 3HG2 THR 97 3HG2 THR 97 0.920 14.623 3.853
725 H LEU 98 H LEU 98 1.510 11.639 0.641
726 HA LEU 98 HA LEU 98 -0.102 11.792 -1.813
727 1HB LEU 98 2HB LEU 98 2.125 10.599 -2.107
728 2HB LEU 98 1HB LEU 98 1.532 9.393 -0.981
729 HG LEU 98 HG LEU 98 -0.394 9.005 -2.581
730 1HD1 LEU 98 1HD1 LEU 98 1.370 10.576 -4.453
731 2HD1 LEU 98 2HD1 LEU 98 -0.176 11.124 -3.808
732 3HD1 LEU 98 3HD1 LEU 98 -0.117 9.722 -4.879
733 1HD2 LEU 98 1HD2 LEU 98 0.962 7.646 -4.122
734 2HD2 LEU 98 2HD2 LEU 98 1.443 7.447 -2.437
735 3HD2 LEU 98 3HD2 LEU 98 2.414 8.448 -3.519
736 H ILE 99 H ILE 99 -2.085 10.880 -1.644
737 HA ILE 99 HA ILE 99 -2.766 9.720 0.965
738 HB ILE 99 HB ILE 99 -4.581 10.968 -1.100
739 1HG1 ILE 99 2HG1 ILE 99 -3.706 12.002 1.605
740 2HG1 ILE 99 1HG1 ILE 99 -3.075 12.568 0.063
741 1HG2 ILE 99 1HG2 ILE 99 -5.178 9.957 1.676
742 2HG2 ILE 99 2HG2 ILE 99 -5.714 9.231 0.161
743 3HG2 ILE 99 3HG2 ILE 99 -6.310 10.822 0.635
744 1HD1 ILE 99 1HD1 ILE 99 -5.278 13.389 -0.550
745 2HD1 ILE 99 2HD1 ILE 99 -4.738 14.092 0.974
746 3HD1 ILE 99 3HD1 ILE 99 -5.933 12.795 0.975
747 H TRP 100 H TRP 100 -2.815 7.608 0.957
748 HA TRP 100 HA TRP 100 -3.545 6.174 -1.503
749 1HB TRP 100 2HB TRP 100 -1.329 5.664 -0.566
750 2HB TRP 100 1HB TRP 100 -2.061 5.252 0.977
751 HD1 TRP 100 HD TRP 100 -3.892 3.896 -2.035
752 HE1 TRP 100 1HE TRP 100 -3.473 1.377 -2.222
753 HE3 TRP 100 3HE TRP 100 -0.164 3.440 1.437
754 HZ2 TRP 100 2HZ TRP 100 -1.773 -0.561 -1.062
755 HZ3 TRP 100 3HZ TRP 100 0.807 1.213 1.834
756 HH2 TRP 100 HH TRP 100 0.018 -0.744 0.610
757 H GLU 101 H GLU 101 -5.630 5.574 -1.551
758 HA GLU 101 HA GLU 101 -6.996 5.032 1.003
759 1HB GLU 101 2HB GLU 101 -7.930 5.843 -1.710
760 2HB GLU 101 1HB GLU 101 -9.040 5.042 -0.626
761 1HG GLU 101 2HG GLU 101 -8.801 6.786 0.998
762 2HG GLU 101 1HG GLU 101 -7.524 7.538 0.051
763 H GLN 102 H GLN 102 -7.666 3.123 1.505
764 HA GLN 102 HA GLN 102 -8.008 1.044 -0.476
765 1HB GLN 102 2HB GLN 102 -5.510 1.186 0.306
766 2HB GLN 102 1HB GLN 102 -6.113 0.403 1.759
767 1HG GLN 102 2HG GLN 102 -6.632 -0.744 -0.962
768 2HG GLN 102 1HG GLN 102 -5.133 -1.056 -0.101
769 1HE2 GLN 102 1HE2 GLN 102 -7.234 -2.881 -0.940
770 2HE2 GLN 102 2HE2 GLN 102 -7.740 -3.703 0.495
771 H ASN 103 H ASN 103 -9.875 0.187 0.056
772 HA ASN 103 HA ASN 103 -11.225 -1.274 1.164
773 1HB ASN 103 2HB ASN 103 -8.863 -1.755 2.348
774 2HB ASN 103 1HB ASN 103 -9.768 -1.157 3.732
775 1HD2 ASN 103 1HD2 ASN 103 -8.714 -3.834 2.673
776 2HD2 ASN 103 2HD2 ASN 103 -10.049 -4.912 2.935
777 H GLY 104 H GLY 104 -10.068 1.225 3.410
778 1HA GLY 104 2HA GLY 104 -12.776 2.190 3.714
779 2HA GLY 104 1HA GLY 104 -12.150 1.384 5.139
780 H GLN 105 H GLN 105 -9.368 2.541 4.382
781 HA GLN 105 HA GLN 105 -9.957 5.172 5.553
782 1HB GLN 105 2HB GLN 105 -7.971 5.010 6.930
783 2HB GLN 105 1HB GLN 105 -9.029 3.641 7.243
784 1HG GLN 105 2HG GLN 105 -7.641 2.166 6.067
785 2HG GLN 105 1HG GLN 105 -6.726 3.479 5.334
786 1HE2 GLN 105 1HE2 GLN 105 -7.254 1.623 8.229
787 2HE2 GLN 105 2HE2 GLN 105 -5.816 2.134 9.057
788 H ARG 106 H ARG 106 -8.562 6.893 5.039
789 HA ARG 106 HA ARG 106 -6.975 6.477 2.636
790 1HB ARG 106 2HB ARG 106 -6.926 8.879 2.457
791 2HB ARG 106 1HB ARG 106 -8.579 8.374 2.721
792 1HG ARG 106 2HG ARG 106 -8.541 9.128 4.964
793 2HG ARG 106 1HG ARG 106 -6.794 9.366 4.924
794 1HD ARG 106 2HD ARG 106 -7.224 11.073 3.087
795 2HD ARG 106 1HD ARG 106 -8.928 10.968 3.532
796 HE ARG 106 HE ARG 106 -7.767 11.456 5.903
797 1HH1 ARG 106 1HH1 ARG 106 -7.505 13.044 2.783
798 2HH1 ARG 106 2HH1 ARG 106 -7.047 14.580 3.466
799 1HH2 ARG 106 1HH2 ARG 106 -7.183 13.470 6.790
800 2HH2 ARG 106 2HH2 ARG 106 -6.844 14.815 5.743
801 H LYS 107 H LYS 107 -4.845 6.216 2.773
802 HA LYS 107 HA LYS 107 -3.458 6.795 5.260
803 1HB LYS 107 2HB LYS 107 -2.780 5.362 2.735
804 2HB LYS 107 1HB LYS 107 -1.462 6.021 3.691
805 1HG LYS 107 2HG LYS 107 -3.523 4.041 4.629
806 2HG LYS 107 1HG LYS 107 -1.837 3.715 4.243
807 1HD LYS 107 2HD LYS 107 -1.185 5.310 6.033
808 2HD LYS 107 1HD LYS 107 -2.890 5.420 6.477
809 1HE LYS 107 2HE LYS 107 -1.841 3.829 7.906
810 2HE LYS 107 1HE LYS 107 -2.905 2.962 6.808
811 1HZ LYS 107 1HZ LYS 107 -0.765 1.854 7.069
812 2HZ LYS 107 2HZ LYS 107 0.044 3.230 6.498
813 3HZ LYS 107 3HZ LYS 107 -0.989 2.362 5.471
814 H THR 108 H THR 108 -2.391 8.594 5.630
815 HA THR 108 HA THR 108 -1.726 10.332 3.346
816 HB THR 108 HB THR 108 -1.894 11.171 6.254
817 HG1 THR 108 1HG THR 108 -3.870 11.938 4.426
818 1HG2 THR 108 1HG2 THR 108 -1.909 12.761 3.686
819 2HG2 THR 108 2HG2 THR 108 -0.543 12.605 4.790
820 3HG2 THR 108 3HG2 THR 108 -2.012 13.425 5.316
821 H MET 109 H MET 109 0.327 10.134 2.784
822 HA MET 109 HA MET 109 2.325 9.671 4.876
823 1HB MET 109 2HB MET 109 3.392 7.957 3.411
824 2HB MET 109 1HB MET 109 1.813 7.482 4.016
825 1HG MET 109 2HG MET 109 0.849 8.229 1.829
826 2HG MET 109 1HG MET 109 2.500 8.432 1.249
827 1HE MET 109 1HE MET 109 1.989 6.805 -0.777
828 2HE MET 109 2HE MET 109 0.336 6.575 -0.205
829 3HE MET 109 3HE MET 109 1.337 5.175 -0.589
830 H THR 110 H THR 110 4.507 10.160 4.209
831 HA THR 110 HA THR 110 4.541 12.209 2.092
832 HB THR 110 HB THR 110 6.499 12.081 4.362
833 HG1 THR 110 1HG THR 110 4.030 12.379 4.833
834 1HG2 THR 110 1HG2 THR 110 7.086 13.496 2.453
835 2HG2 THR 110 2HG2 THR 110 6.770 14.464 3.892
836 3HG2 THR 110 3HG2 THR 110 5.555 14.352 2.622
837 H ARG 111 H ARG 111 6.514 12.392 0.878
838 HA ARG 111 HA ARG 111 7.555 9.811 0.146
839 1HB ARG 111 2HB ARG 111 7.026 11.548 -1.539
840 2HB ARG 111 1HB ARG 111 8.298 12.561 -0.872
841 1HG ARG 111 2HG ARG 111 9.829 10.528 -1.364
842 2HG ARG 111 1HG ARG 111 8.525 10.033 -2.445
843 1HD ARG 111 2HD ARG 111 10.203 11.316 -3.653
844 2HD ARG 111 1HD ARG 111 8.671 12.190 -3.601
845 HE ARG 111 HE ARG 111 9.631 13.585 -1.847
846 1HH1 ARG 111 1HH1 ARG 111 11.854 11.675 -3.771
847 2HH1 ARG 111 2HH1 ARG 111 13.223 12.683 -3.395
848 1HH2 ARG 111 1HH2 ARG 111 11.427 14.898 -1.374
849 2HH2 ARG 111 2HH2 ARG 111 12.988 14.496 -2.033
850 H ILE 112 H ILE 112 9.444 8.933 0.778
851 HA ILE 112 HA ILE 112 11.022 10.304 2.745
852 HB ILE 112 HB ILE 112 11.670 7.697 1.379
853 1HG1 ILE 112 2HG1 ILE 112 10.062 8.223 3.884
854 2HG1 ILE 112 1HG1 ILE 112 9.462 7.538 2.379
855 1HG2 ILE 112 1HG2 ILE 112 12.969 7.240 3.411
856 2HG2 ILE 112 2HG2 ILE 112 12.573 8.852 4.010
857 3HG2 ILE 112 3HG2 ILE 112 13.553 8.667 2.555
858 1HD1 ILE 112 1HD1 ILE 112 10.871 5.581 2.699
859 2HD1 ILE 112 2HD1 ILE 112 9.776 5.825 4.060
860 3HD1 ILE 112 3HD1 ILE 112 11.477 6.270 4.206
861 H GLU 113 H GLU 113 13.125 10.943 2.571
862 HA GLU 113 HA GLU 113 14.372 11.031 -0.062
863 1HB GLU 113 2HB GLU 113 13.111 13.130 0.135
864 2HB GLU 113 1HB GLU 113 13.909 13.478 1.661
865 1HG GLU 113 2HG GLU 113 14.896 14.780 -0.109
866 2HG GLU 113 1HG GLU 113 16.064 13.598 0.483
867 H SER 114 H SER 114 16.374 10.337 0.176
868 HA SER 114 HA SER 114 17.409 9.873 2.801
869 1HB SER 114 2HB SER 114 17.715 8.340 0.797
870 2HB SER 114 1HB SER 114 18.893 9.507 0.195
871 HG SER 114 HG SER 114 20.274 8.946 1.724
872 H LYS 115 H LYS 115 18.161 11.494 3.934
873 HA LYS 115 HA LYS 115 19.507 13.142 4.678
874 1HB LYS 115 2HB LYS 115 21.291 11.709 3.709
875 2HB LYS 115 1HB LYS 115 21.169 12.617 2.209
876 1HG LYS 115 2HG LYS 115 21.828 14.653 3.394
877 2HG LYS 115 1HG LYS 115 21.959 13.734 4.893
878 1HD LYS 115 2HD LYS 115 23.704 12.344 3.898
879 2HD LYS 115 1HD LYS 115 23.562 13.241 2.385
880 1HE LYS 115 2HE LYS 115 24.395 14.374 5.052
881 2HE LYS 115 1HE LYS 115 25.467 14.018 3.697
882 1HZ LYS 115 1HZ LYS 115 24.212 15.641 2.376
883 2HZ LYS 115 2HZ LYS 115 24.944 16.346 3.731
884 3HZ LYS 115 3HZ LYS 115 23.279 16.030 3.737
885 H THR 116 H THR 116 17.818 14.636 4.352
886 HA THR 116 HA THR 116 17.914 16.310 1.971
887 HB THR 116 HB THR 116 16.145 16.678 4.395
888 HG1 THR 116 1HG THR 116 15.958 14.870 2.228
889 1HG2 THR 116 1HG2 THR 116 16.209 18.534 2.778
890 2HG2 THR 116 2HG2 THR 116 14.632 17.745 2.804
891 3HG2 THR 116 3HG2 THR 116 15.757 17.421 1.486
892 H GLY 117 H GLY 117 18.273 18.610 2.106
893 1HA GLY 117 2HA GLY 117 19.880 19.349 4.470
894 2HA GLY 117 1HA GLY 117 20.307 19.827 2.834
895 H ARG 118 H ARG 118 20.085 21.967 2.743
896 HA ARG 118 HA ARG 118 17.628 23.183 3.712
897 1HB ARG 118 2HB ARG 118 19.009 25.107 4.434
898 2HB ARG 118 1HB ARG 118 19.350 23.650 5.347
899 1HG ARG 118 2HG ARG 118 21.371 23.285 4.104
900 2HG ARG 118 1HG ARG 118 20.998 24.633 3.030
901 1HD ARG 118 2HD ARG 118 22.620 25.388 4.607
902 2HD ARG 118 1HD ARG 118 21.079 26.141 5.009
903 HE ARG 118 HE ARG 118 21.264 23.825 6.531
904 1HH1 ARG 118 1HH1 ARG 118 23.026 26.847 6.196
905 2HH1 ARG 118 2HH1 ARG 118 23.534 26.882 7.862
906 1HH2 ARG 118 1HH2 ARG 118 21.929 23.877 8.721
907 2HH2 ARG 118 2HH2 ARG 118 22.921 25.186 9.286
908 H GLU 119 H GLU 119 17.080 25.083 2.617
909 HA GLU 119 HA GLU 119 18.566 25.951 0.296
910 1HB GLU 119 2HB GLU 119 16.732 23.936 -0.109
911 2HB GLU 119 1HB GLU 119 15.767 25.373 -0.416
912 1HG GLU 119 2HG GLU 119 18.407 24.839 -1.750
913 2HG GLU 119 1HG GLU 119 16.857 24.338 -2.421
914 H GLU 120 H GLU 120 17.776 28.011 -0.502
915 HA GLU 120 HA GLU 120 15.620 29.317 0.874
916 1HB GLU 120 2HB GLU 120 17.390 29.381 2.604
917 2HB GLU 120 1HB GLU 120 18.444 30.219 1.474
918 1HG GLU 120 2HG GLU 120 16.892 32.098 1.410
919 2HG GLU 120 1HG GLU 120 15.821 31.256 2.530
920 H LYS 121 H LYS 121 18.644 30.750 -0.233
921 HA LYS 121 HA LYS 121 19.197 32.122 -1.933
922 1HB LYS 121 2HB LYS 121 18.280 30.385 -3.437
923 2HB LYS 121 1HB LYS 121 16.697 31.148 -3.330
924 1HG LYS 121 2HG LYS 121 17.744 33.234 -4.236
925 2HG LYS 121 1HG LYS 121 19.208 32.295 -4.523
926 1HD LYS 121 2HD LYS 121 17.951 30.793 -5.991
927 2HD LYS 121 1HD LYS 121 16.489 31.747 -5.709
928 1HE LYS 121 2HE LYS 121 17.691 33.729 -6.617
929 2HE LYS 121 1HE LYS 121 19.042 32.668 -7.024
930 1HZ LYS 121 1HZ LYS 121 17.612 33.049 -8.921
931 2HZ LYS 121 2HZ LYS 121 16.273 32.441 -8.077
932 3HZ LYS 121 3HZ LYS 121 17.565 31.412 -8.468
933 H ASP 122 H ASP 122 19.063 34.244 -2.041
934 HA ASP 122 HA ASP 122 16.685 35.598 -1.057
935 1HB ASP 122 2HB ASP 122 18.106 37.634 -1.195
936 2HB ASP 122 1HB ASP 122 18.834 36.363 -0.220
937 H GLU 123 H GLU 123 15.879 37.535 -2.252
938 HA GLU 123 HA GLU 123 16.067 37.098 -5.159
939 1HB GLU 123 2HB GLU 123 13.835 36.513 -4.255
940 2HB GLU 123 1HB GLU 123 13.677 38.155 -3.642
941 1HG GLU 123 2HG GLU 123 14.070 38.877 -6.076
942 2HG GLU 123 1HG GLU 123 13.698 37.203 -6.478
943 H LYS 124 H LYS 124 17.520 38.622 -5.737
944 HA LYS 124 HA LYS 124 17.186 41.355 -4.771
945 1HB LYS 124 2HB LYS 124 19.424 39.946 -5.332
946 2HB LYS 124 1HB LYS 124 19.182 40.743 -6.877
947 1HG LYS 124 2HG LYS 124 19.444 42.118 -4.208
948 2HG LYS 124 1HG LYS 124 20.696 42.001 -5.441
949 1HD LYS 124 2HD LYS 124 19.310 43.287 -6.985
950 2HD LYS 124 1HD LYS 124 18.032 43.381 -5.770
951 1HE LYS 124 2HE LYS 124 19.269 45.443 -5.754
952 2HE LYS 124 1HE LYS 124 19.612 44.561 -4.269
953 1HZ LYS 124 1HZ LYS 124 21.362 44.736 -6.664
954 2HZ LYS 124 2HZ LYS 124 21.692 43.777 -5.306
955 3HZ LYS 124 3HZ LYS 124 21.635 45.465 -5.157
956 H SER 125 H SER 125 15.479 42.294 -5.734
957 HA SER 125 HA SER 125 15.513 42.494 -8.649
958 1HB SER 125 2HB SER 125 13.082 42.059 -8.779
959 2HB SER 125 1HB SER 125 13.961 40.659 -8.167
960 HG SER 125 HG SER 125 12.657 40.754 -6.525
961 H LYS 126 H LYS 126 14.136 44.253 -9.446
962 HA LYS 126 HA LYS 126 13.353 46.244 -7.475
963 1HB LYS 126 2HB LYS 126 14.633 48.027 -8.620
964 2HB LYS 126 1HB LYS 126 15.668 46.830 -7.854
965 1HG LYS 126 2HG LYS 126 16.056 45.777 -10.022
966 2HG LYS 126 1HG LYS 126 15.013 46.974 -10.793
967 1HD LYS 126 2HD LYS 126 16.535 48.755 -10.052
968 2HD LYS 126 1HD LYS 126 17.578 47.543 -9.306
969 1HE LYS 126 2HE LYS 126 16.891 47.647 -12.239
970 2HE LYS 126 1HE LYS 126 18.370 48.296 -11.533
971 1HZ LYS 126 1HZ LYS 126 18.973 46.098 -10.798
972 2HZ LYS 126 2HZ LYS 126 18.679 46.075 -12.465
973 3HZ LYS 126 3HZ LYS 126 17.522 45.448 -11.394
974 H SER 127 H SER 127 11.850 47.731 -8.273
975 HA SER 127 HA SER 127 10.854 47.168 -10.984
976 1HB SER 127 2HB SER 127 9.140 47.604 -8.523
977 2HB SER 127 1HB SER 127 8.560 47.284 -10.159
978 HG SER 127 HG SER 127 9.888 45.550 -8.363
979 H LEU 128 H LEU 128 11.185 48.964 -12.122
980 HA LEU 128 HA LEU 128 10.655 51.550 -10.818
981 1HB LEU 128 2HB LEU 128 12.516 50.925 -13.111
982 2HB LEU 128 1HB LEU 128 12.199 52.531 -12.483
983 HG LEU 128 HG LEU 128 13.514 50.274 -10.968
984 1HD1 LEU 128 1HD1 LEU 128 14.949 51.213 -12.696
985 2HD1 LEU 128 2HD1 LEU 128 15.514 51.676 -11.091
986 3HD1 LEU 128 3HD1 LEU 128 14.636 52.838 -12.088
987 1HD2 LEU 128 1HD2 LEU 128 13.011 53.133 -10.153
988 2HD2 LEU 128 2HD2 LEU 128 13.914 51.934 -9.227
989 3HD2 LEU 128 3HD2 LEU 128 12.187 51.716 -9.505
990 H GLU 129 H GLU 129 8.540 51.822 -11.319
991 HA GLU 129 HA GLU 129 7.908 52.097 -14.193
992 1HB GLU 129 2HB GLU 129 6.545 50.478 -12.633
993 2HB GLU 129 1HB GLU 129 5.819 51.958 -12.032
994 1HG GLU 129 2HG GLU 129 5.785 51.039 -14.900
995 2HG GLU 129 1HG GLU 129 4.461 50.872 -13.752
996 H HIS 130 H HIS 130 8.595 54.179 -14.489
997 HA HIS 130 HA HIS 130 7.346 56.222 -12.790
998 1HB HIS 130 2HB HIS 130 9.744 55.747 -12.142
999 2HB HIS 130 1HB HIS 130 10.214 56.342 -13.728
1000 HD1 HIS 130 1HD HIS 130 11.013 58.659 -13.624
1001 HD2 HIS 130 2HD HIS 130 8.042 57.918 -10.808
1002 HE1 HIS 130 1HE HIS 130 10.736 60.810 -12.337
1003 HE2 HIS 130 2HE HIS 130 9.089 60.258 -10.504
1004 H HIS 131 H HIS 131 5.855 56.686 -14.410
1005 HA HIS 131 HA HIS 131 6.961 58.232 -16.659
1006 1HB HIS 131 2HB HIS 131 4.745 56.180 -16.867
1007 2HB HIS 131 1HB HIS 131 5.176 57.313 -18.142
1008 HD1 HIS 131 1HD HIS 131 6.115 54.084 -16.623
1009 HD2 HIS 131 2HD HIS 131 7.711 56.781 -19.367
1010 HE1 HIS 131 1HE HIS 131 7.949 52.841 -17.815
1011 HE2 HIS 131 2HE HIS 131 9.037 54.555 -19.312
1012 H HIS 132 H HIS 132 5.606 59.957 -17.379
1013 HA HIS 132 HA HIS 132 3.090 60.419 -16.058
1014 1HB HIS 132 2HB HIS 132 3.676 62.383 -14.822
1015 2HB HIS 132 1HB HIS 132 4.817 61.129 -14.359
1016 HD1 HIS 132 1HD HIS 132 7.278 61.358 -15.442
1017 HD2 HIS 132 2HD HIS 132 4.783 64.673 -15.784
1018 HE1 HIS 132 1HE HIS 132 8.782 63.285 -16.031
1019 HE2 HIS 132 2HE HIS 132 7.278 65.311 -16.035
1020 H HIS 133 H HIS 133 1.883 62.065 -16.984
1021 HA HIS 133 HA HIS 133 3.060 63.829 -18.941
1022 1HB HIS 133 2HB HIS 133 1.311 63.173 -20.686
1023 2HB HIS 133 1HB HIS 133 2.679 62.090 -20.488
1024 HD1 HIS 133 1HD HIS 133 2.190 59.694 -19.897
1025 HD2 HIS 133 2HD HIS 133 -1.168 62.136 -19.621
1026 HE1 HIS 133 1HE HIS 133 0.244 58.141 -19.544
1027 HE2 HIS 133 2HE HIS 133 -1.728 59.653 -19.144
1028 H HIS 134 H HIS 134 2.332 65.688 -18.157
1029 HA HIS 134 HA HIS 134 -0.144 65.752 -16.664
1030 1HB HIS 134 2HB HIS 134 1.842 66.925 -15.821
1031 2HB HIS 134 1HB HIS 134 1.843 67.959 -17.246
1032 HD1 HIS 134 1HD HIS 134 0.430 70.036 -17.154
1033 HD2 HIS 134 2HD HIS 134 -0.420 67.385 -14.060
1034 HE1 HIS 134 1HE HIS 134 -1.124 71.268 -15.607
1035 HE2 HIS 134 2HE HIS 134 -1.453 69.718 -13.646
1036 H HIS 135 H HIS 135 -1.707 65.423 -18.258
1037 HA HIS 135 HA HIS 135 -2.935 67.772 -19.126
1038 1HB HIS 135 2HB HIS 135 -1.082 67.597 -20.891
1039 2HB HIS 135 1HB HIS 135 -1.935 66.177 -21.490
1040 HD1 HIS 135 1HD HIS 135 -2.021 69.872 -21.455
1041 HD2 HIS 135 2HD HIS 135 -4.487 66.749 -22.656
1042 HE1 HIS 135 1HE HIS 135 -3.771 70.919 -22.927
1043 HE2 HIS 135 2HE HIS 135 -5.396 69.052 -23.410
Start of MODEL 4
1 1H MET 1 1HT MET 1 13.111 34.165 -22.778
2 2H MET 1 2HT MET 1 13.724 35.727 -23.003
3 3H MET 1 3HT MET 1 13.472 34.723 -24.337
4 HA MET 1 HA MET 1 11.376 35.802 -22.550
5 1HB MET 1 2HB MET 1 12.286 36.560 -25.313
6 2HB MET 1 1HB MET 1 10.675 36.952 -24.732
7 1HG MET 1 2HG MET 1 12.157 38.838 -24.465
8 2HG MET 1 1HG MET 1 11.653 38.229 -22.889
9 1HE MET 1 1HE MET 1 14.117 40.234 -23.382
10 2HE MET 1 2HE MET 1 15.304 39.553 -22.266
11 3HE MET 1 3HE MET 1 13.609 39.679 -21.789
12 H ILE 2 H ILE 2 12.304 33.271 -24.600
13 HA ILE 2 HA ILE 2 9.620 32.655 -25.495
14 HB ILE 2 HB ILE 2 12.243 31.173 -25.693
15 1HG1 ILE 2 2HG1 ILE 2 11.669 31.338 -28.165
16 2HG1 ILE 2 1HG1 ILE 2 10.361 32.423 -27.704
17 1HG2 ILE 2 1HG2 ILE 2 11.086 29.411 -26.946
18 2HG2 ILE 2 2HG2 ILE 2 9.537 30.162 -26.558
19 3HG2 ILE 2 3HG2 ILE 2 10.542 29.494 -25.272
20 1HD1 ILE 2 1HD1 ILE 2 12.282 33.676 -28.453
21 2HD1 ILE 2 2HD1 ILE 2 13.305 32.873 -27.263
22 3HD1 ILE 2 3HD1 ILE 2 12.020 33.956 -26.730
23 H MET 3 H MET 3 8.164 31.561 -24.358
24 HA MET 3 HA MET 3 9.055 30.026 -22.019
25 1HB MET 3 2HB MET 3 7.154 30.989 -20.726
26 2HB MET 3 1HB MET 3 8.409 32.150 -21.127
27 1HG MET 3 2HG MET 3 7.016 32.950 -23.006
28 2HG MET 3 1HG MET 3 5.743 31.847 -22.490
29 1HE MET 3 1HE MET 3 4.183 34.055 -22.547
30 2HE MET 3 2HE MET 3 5.553 35.116 -22.876
31 3HE MET 3 3HE MET 3 4.465 35.469 -21.533
32 H VAL 4 H VAL 4 7.968 28.171 -21.629
33 HA VAL 4 HA VAL 4 5.984 27.411 -23.653
34 HB VAL 4 HB VAL 4 7.572 25.627 -21.791
35 1HG1 VAL 4 1HG1 VAL 4 5.882 24.986 -24.204
36 2HG1 VAL 4 2HG1 VAL 4 5.500 24.598 -22.524
37 3HG1 VAL 4 3HG1 VAL 4 6.877 23.832 -23.317
38 1HG2 VAL 4 1HG2 VAL 4 8.026 26.246 -24.705
39 2HG2 VAL 4 2HG2 VAL 4 8.920 25.070 -23.744
40 3HG2 VAL 4 3HG2 VAL 4 9.033 26.789 -23.364
41 H SER 5 H SER 5 3.956 27.653 -23.024
42 HA SER 5 HA SER 5 3.045 26.357 -20.615
43 1HB SER 5 2HB SER 5 1.700 28.486 -20.019
44 2HB SER 5 1HB SER 5 3.400 28.418 -19.562
45 HG SER 5 HG SER 5 3.801 30.029 -20.835
46 H GLY 6 H GLY 6 0.881 25.763 -20.727
47 1HA GLY 6 2HA GLY 6 -1.220 25.507 -21.686
48 2HA GLY 6 1HA GLY 6 -0.795 26.722 -22.887
49 H CYS 7 H CYS 7 1.078 25.928 -24.371
50 HA CYS 7 HA CYS 7 0.222 23.461 -25.589
51 1HB CYS 7 2HB CYS 7 2.586 25.218 -26.291
52 2HB CYS 7 1HB CYS 7 1.865 23.975 -27.308
53 HG CYS 7 HG CYS 7 0.208 25.532 -28.488
54 H GLN 8 H GLN 8 0.725 22.286 -23.545
55 HA GLN 8 HA GLN 8 3.533 21.392 -23.536
56 1HB GLN 8 2HB GLN 8 1.697 21.663 -21.143
57 2HB GLN 8 1HB GLN 8 3.350 21.063 -21.107
58 1HG GLN 8 2HG GLN 8 4.228 23.196 -21.666
59 2HG GLN 8 1HG GLN 8 2.626 23.825 -22.046
60 1HE2 GLN 8 1HE2 GLN 8 4.852 22.975 -19.524
61 2HE2 GLN 8 2HE2 GLN 8 3.975 23.721 -18.226
62 H GLN 9 H GLN 9 2.812 19.803 -25.038
63 HA GLN 9 HA GLN 9 0.845 17.867 -24.122
64 1HB GLN 9 2HB GLN 9 0.851 17.008 -26.358
65 2HB GLN 9 1HB GLN 9 0.779 18.759 -26.448
66 1HG GLN 9 2HG GLN 9 3.399 17.335 -26.687
67 2HG GLN 9 1HG GLN 9 2.310 17.448 -28.064
68 1HE2 GLN 9 1HE2 GLN 9 3.740 18.669 -29.239
69 2HE2 GLN 9 2HE2 GLN 9 4.064 20.329 -28.886
70 H GLN 10 H GLN 10 3.868 18.235 -23.315
71 HA GLN 10 HA GLN 10 4.847 15.573 -23.825
72 1HB GLN 10 2HB GLN 10 6.707 16.249 -22.271
73 2HB GLN 10 1HB GLN 10 6.537 17.234 -23.715
74 1HG GLN 10 2HG GLN 10 5.487 18.991 -22.447
75 2HG GLN 10 1HG GLN 10 5.477 17.988 -20.997
76 1HE2 GLN 10 1HE2 GLN 10 6.702 20.599 -21.495
77 2HE2 GLN 10 2HE2 GLN 10 8.380 20.407 -21.122
78 H LYS 11 H LYS 11 3.668 14.038 -22.896
79 HA LYS 11 HA LYS 11 2.366 14.308 -20.383
80 1HB LYS 11 2HB LYS 11 1.512 12.836 -22.139
81 2HB LYS 11 1HB LYS 11 2.962 11.851 -22.046
82 1HG LYS 11 2HG LYS 11 2.368 11.255 -19.725
83 2HG LYS 11 1HG LYS 11 0.871 12.174 -19.905
84 1HD LYS 11 2HD LYS 11 0.148 10.709 -21.691
85 2HD LYS 11 1HD LYS 11 1.681 9.835 -21.633
86 1HE LYS 11 2HE LYS 11 1.171 9.174 -19.307
87 2HE LYS 11 1HE LYS 11 -0.396 9.971 -19.453
88 1HZ LYS 11 1HZ LYS 11 -0.503 7.563 -19.844
89 2HZ LYS 11 2HZ LYS 11 0.535 7.734 -21.172
90 3HZ LYS 11 3HZ LYS 11 -1.000 8.452 -21.200
91 H GLU 12 H GLU 12 5.492 13.217 -21.366
92 HA GLU 12 HA GLU 12 6.079 11.606 -19.097
93 1HB GLU 12 2HB GLU 12 8.028 12.977 -20.964
94 2HB GLU 12 1HB GLU 12 8.345 11.578 -19.942
95 1HG GLU 12 2HG GLU 12 6.830 10.231 -21.237
96 2HG GLU 12 1HG GLU 12 6.357 11.628 -22.199
97 H GLU 13 H GLU 13 5.945 12.529 -17.139
98 HA GLU 13 HA GLU 13 7.748 14.741 -16.535
99 1HB GLU 13 2HB GLU 13 5.003 15.167 -16.893
100 2HB GLU 13 1HB GLU 13 5.210 15.079 -15.152
101 1HG GLU 13 2HG GLU 13 6.935 16.856 -16.846
102 2HG GLU 13 1HG GLU 13 5.346 17.369 -16.283
103 H THR 14 H THR 14 7.548 15.123 -14.026
104 HA THR 14 HA THR 14 8.524 12.787 -12.816
105 HB THR 14 HB THR 14 7.508 15.239 -11.376
106 HG1 THR 14 1HG THR 14 8.910 15.913 -13.032
107 1HG2 THR 14 1HG2 THR 14 9.315 14.691 -9.791
108 2HG2 THR 14 2HG2 THR 14 9.697 13.253 -10.738
109 3HG2 THR 14 3HG2 THR 14 8.139 13.384 -9.921
110 HA PRO 15 HA PRO 15 4.564 11.050 -11.513
111 1HB PRO 15 2HB PRO 15 6.114 8.790 -10.563
112 2HB PRO 15 1HB PRO 15 4.970 8.860 -11.905
113 1HG PRO 15 2HG PRO 15 7.657 8.522 -12.238
114 2HG PRO 15 1HG PRO 15 6.604 9.277 -13.447
115 1HD PRO 15 2HD PRO 15 8.434 10.567 -11.457
116 2HD PRO 15 1HD PRO 15 8.130 10.998 -13.155
117 H PHE 16 H PHE 16 3.834 11.974 -9.703
118 HA PHE 16 HA PHE 16 5.456 12.652 -7.508
119 1HB PHE 16 2HB PHE 16 3.426 13.420 -6.431
120 2HB PHE 16 1HB PHE 16 3.396 13.874 -8.129
121 HD1 PHE 16 2HD PHE 16 1.943 12.583 -9.709
122 HD2 PHE 16 1HD PHE 16 1.755 12.062 -5.489
123 HE1 PHE 16 2HE PHE 16 -0.265 11.524 -9.941
124 HE2 PHE 16 1HE PHE 16 -0.455 11.006 -5.713
125 HZ PHE 16 HZ PHE 16 -1.470 10.728 -7.939
126 H TYR 17 H TYR 17 3.553 9.809 -8.158
127 HA TYR 17 HA TYR 17 3.408 9.015 -5.391
128 1HB TYR 17 2HB TYR 17 2.084 7.183 -6.162
129 2HB TYR 17 1HB TYR 17 1.579 8.596 -7.074
130 HD1 TYR 17 2HD TYR 17 2.481 8.864 -9.450
131 HD2 TYR 17 1HD TYR 17 2.828 5.244 -7.248
132 HE1 TYR 17 2HE TYR 17 2.872 7.633 -11.542
133 HE2 TYR 17 1HE TYR 17 3.222 4.006 -9.333
134 HH TYR 17 HH TYR 17 2.756 4.258 -11.737
135 H TYR 18 H TYR 18 5.741 8.734 -7.803
136 HA TYR 18 HA TYR 18 6.482 5.996 -7.303
137 1HB TYR 18 2HB TYR 18 6.744 7.325 -9.500
138 2HB TYR 18 1HB TYR 18 8.192 7.998 -8.763
139 HD1 TYR 18 2HD TYR 18 6.596 4.930 -10.011
140 HD2 TYR 18 1HD TYR 18 10.190 6.678 -8.548
141 HE1 TYR 18 2HE TYR 18 7.852 2.952 -10.758
142 HE2 TYR 18 1HE TYR 18 11.455 4.706 -9.293
143 HH TYR 18 HH TYR 18 10.161 2.369 -11.378
144 H GLY 19 H GLY 19 8.100 5.236 -6.074
145 1HA GLY 19 2HA GLY 19 10.374 5.836 -5.122
146 2HA GLY 19 1HA GLY 19 9.533 7.197 -4.394
147 H THR 20 H THR 20 10.420 6.256 -2.386
148 HA THR 20 HA THR 20 8.787 4.008 -1.413
149 HB THR 20 HB THR 20 11.399 5.070 -0.304
150 HG1 THR 20 1HG THR 20 10.972 2.530 -1.511
151 1HG2 THR 20 1HG2 THR 20 9.960 4.095 1.434
152 2HG2 THR 20 2HG2 THR 20 11.369 3.081 1.124
153 3HG2 THR 20 3HG2 THR 20 9.796 2.624 0.472
154 H TRP 21 H TRP 21 7.207 4.482 -0.040
155 HA TRP 21 HA TRP 21 7.273 7.097 1.306
156 1HB TRP 21 2HB TRP 21 4.925 5.312 0.623
157 2HB TRP 21 1HB TRP 21 4.809 6.836 1.498
158 HD1 TRP 21 HD TRP 21 5.593 5.464 -2.003
159 HE1 TRP 21 1HE TRP 21 5.270 7.356 -3.716
160 HE3 TRP 21 3HE TRP 21 4.757 9.326 1.231
161 HZ2 TRP 21 2HZ TRP 21 4.736 10.133 -3.688
162 HZ3 TRP 21 3HZ TRP 21 4.349 11.570 0.309
163 HH2 TRP 21 HH TRP 21 4.338 11.966 -2.097
164 H ASP 22 H ASP 22 6.886 7.266 3.469
165 HA ASP 22 HA ASP 22 7.065 4.772 5.018
166 1HB ASP 22 2HB ASP 22 8.869 6.305 5.500
167 2HB ASP 22 1HB ASP 22 7.742 7.634 5.738
168 H GLU 23 H GLU 23 5.276 4.085 5.932
169 HA GLU 23 HA GLU 23 3.026 5.898 6.313
170 1HB GLU 23 2HB GLU 23 3.213 2.916 6.808
171 2HB GLU 23 1HB GLU 23 1.741 3.879 6.822
172 1HG GLU 23 2HG GLU 23 2.135 4.405 4.426
173 2HG GLU 23 1HG GLU 23 3.506 3.296 4.454
174 H GLY 24 H GLY 24 5.087 6.606 7.912
175 1HA GLY 24 2HA GLY 24 4.850 5.475 10.546
176 2HA GLY 24 1HA GLY 24 5.717 6.943 10.107
177 H ARG 25 H ARG 25 2.351 6.002 9.731
178 HA ARG 25 HA ARG 25 1.364 7.790 11.733
179 1HB ARG 25 2HB ARG 25 1.894 9.346 9.842
180 2HB ARG 25 1HB ARG 25 0.792 8.434 8.826
181 1HG ARG 25 2HG ARG 25 -0.436 10.289 9.519
182 2HG ARG 25 1HG ARG 25 -0.982 8.983 10.576
183 1HD ARG 25 2HD ARG 25 -0.607 11.013 11.861
184 2HD ARG 25 1HD ARG 25 0.556 9.768 12.319
185 HE ARG 25 HE ARG 25 2.058 11.026 10.633
186 1HH1 ARG 25 1HH1 ARG 25 -0.256 12.497 12.811
187 2HH1 ARG 25 2HH1 ARG 25 0.600 14.005 12.899
188 1HH2 ARG 25 1HH2 ARG 25 3.181 13.008 10.758
189 2HH2 ARG 25 2HH2 ARG 25 2.543 14.294 11.738
190 H ALA 26 H ALA 26 -0.752 7.306 12.201
191 HA ALA 26 HA ALA 26 -2.698 6.137 12.284
192 1HB ALA 26 1HB ALA 26 -3.005 6.886 9.955
193 2HB ALA 26 2HB ALA 26 -3.719 5.302 10.256
194 3HB ALA 26 3HB ALA 26 -2.185 5.429 9.394
195 HA PRO 27 HA PRO 27 -1.723 1.954 13.347
196 1HB PRO 27 2HB PRO 27 -4.252 1.013 12.140
197 2HB PRO 27 1HB PRO 27 -3.691 0.901 13.811
198 1HG PRO 27 2HG PRO 27 -5.629 2.600 13.125
199 2HG PRO 27 1HG PRO 27 -4.405 3.043 14.330
200 1HD PRO 27 2HD PRO 27 -4.594 3.825 11.444
201 2HD PRO 27 1HD PRO 27 -4.161 4.817 12.854
202 H GLY 28 H GLY 28 -0.545 0.388 12.490
203 1HA GLY 28 2HA GLY 28 -0.920 -0.288 9.638
204 2HA GLY 28 1HA GLY 28 0.675 -0.098 10.358
205 HA PRO 29 HA PRO 29 -0.093 -4.682 10.278
206 1HB PRO 29 2HB PRO 29 2.662 -4.979 10.860
207 2HB PRO 29 1HB PRO 29 1.866 -5.219 9.304
208 1HG PRO 29 2HG PRO 29 3.371 -2.877 10.321
209 2HG PRO 29 1HG PRO 29 3.171 -3.451 8.657
210 1HD PRO 29 2HD PRO 29 1.898 -1.266 9.569
211 2HD PRO 29 1HD PRO 29 1.143 -2.364 8.394
212 H THR 30 H THR 30 -0.706 -5.755 12.016
213 HA THR 30 HA THR 30 -0.478 -4.385 14.545
214 HB THR 30 HB THR 30 -2.620 -5.301 13.677
215 HG1 THR 30 1HG THR 30 -1.802 -5.162 16.105
216 1HG2 THR 30 1HG2 THR 30 -1.404 -7.968 14.389
217 2HG2 THR 30 2HG2 THR 30 -1.800 -7.410 12.764
218 3HG2 THR 30 3HG2 THR 30 -3.087 -7.691 13.935
219 H ASP 31 H ASP 31 1.285 -6.825 13.086
220 HA ASP 31 HA ASP 31 1.795 -8.645 15.115
221 1HB ASP 31 2HB ASP 31 2.647 -8.944 12.847
222 2HB ASP 31 1HB ASP 31 3.740 -7.580 13.059
223 H GLY 32 H GLY 32 2.985 -5.402 14.730
224 1HA GLY 32 2HA GLY 32 3.552 -4.415 17.010
225 2HA GLY 32 1HA GLY 32 4.726 -5.726 17.089
226 H VAL 33 H VAL 33 3.792 -3.716 14.353
227 HA VAL 33 HA VAL 33 6.624 -3.284 13.809
228 HB VAL 33 HB VAL 33 4.245 -2.667 12.063
229 1HG1 VAL 33 1HG1 VAL 33 6.216 -1.438 11.413
230 2HG1 VAL 33 2HG1 VAL 33 5.893 -2.715 10.241
231 3HG1 VAL 33 3HG1 VAL 33 7.176 -2.917 11.433
232 1HG2 VAL 33 1HG2 VAL 33 4.293 -5.044 12.568
233 2HG2 VAL 33 2HG2 VAL 33 5.995 -5.123 12.115
234 3HG2 VAL 33 3HG2 VAL 33 4.773 -4.769 10.893
235 H LYS 34 H LYS 34 7.559 -1.304 13.794
236 HA LYS 34 HA LYS 34 6.279 0.781 15.248
237 1HB LYS 34 2HB LYS 34 8.927 0.653 13.803
238 2HB LYS 34 1HB LYS 34 8.418 2.000 14.800
239 1HG LYS 34 2HG LYS 34 8.452 -0.731 15.979
240 2HG LYS 34 1HG LYS 34 9.971 0.134 15.759
241 1HD LYS 34 2HD LYS 34 9.191 0.567 17.977
242 2HD LYS 34 1HD LYS 34 8.992 2.041 17.033
243 1HE LYS 34 2HE LYS 34 6.613 1.504 16.732
244 2HE LYS 34 1HE LYS 34 6.829 0.049 17.705
245 1HZ LYS 34 1HZ LYS 34 7.278 2.829 18.653
246 2HZ LYS 34 2HZ LYS 34 7.430 1.421 19.586
247 3HZ LYS 34 3HZ LYS 34 5.909 1.888 18.993
248 H SER 35 H SER 35 7.152 0.231 11.914
249 HA SER 35 HA SER 35 5.285 2.174 10.938
250 1HB SER 35 2HB SER 35 8.206 2.709 10.330
251 2HB SER 35 1HB SER 35 6.819 3.689 9.864
252 HG SER 35 HG SER 35 6.624 3.589 12.418
253 H ALA 36 H ALA 36 5.235 2.140 8.553
254 HA ALA 36 HA ALA 36 6.518 -0.275 7.472
255 1HB ALA 36 1HB ALA 36 4.120 -0.667 7.801
256 2HB ALA 36 2HB ALA 36 4.541 -0.660 6.089
257 3HB ALA 36 3HB ALA 36 3.752 0.744 6.808
258 H THR 37 H THR 37 7.566 -0.026 5.559
259 HA THR 37 HA THR 37 7.247 2.587 4.232
260 HB THR 37 HB THR 37 9.593 2.262 3.389
261 HG1 THR 37 1HG THR 37 9.507 -0.085 3.987
262 1HG2 THR 37 1HG2 THR 37 10.680 2.986 5.437
263 2HG2 THR 37 2HG2 THR 37 9.334 2.371 6.398
264 3HG2 THR 37 3HG2 THR 37 9.088 3.733 5.304
265 H VAL 38 H VAL 38 6.600 2.539 2.199
266 HA VAL 38 HA VAL 38 6.497 -0.096 0.889
267 HB VAL 38 HB VAL 38 4.290 0.534 1.659
268 1HG1 VAL 38 1HG1 VAL 38 3.132 2.518 0.823
269 2HG1 VAL 38 2HG1 VAL 38 4.609 3.039 0.015
270 3HG1 VAL 38 3HG1 VAL 38 4.553 2.945 1.775
271 1HG2 VAL 38 1HG2 VAL 38 4.569 0.801 -1.327
272 2HG2 VAL 38 2HG2 VAL 38 3.072 0.433 -0.470
273 3HG2 VAL 38 3HG2 VAL 38 4.422 -0.699 -0.413
274 H THR 39 H THR 39 7.387 -0.236 -1.038
275 HA THR 39 HA THR 39 8.146 2.244 -2.412
276 HB THR 39 HB THR 39 9.280 -0.542 -2.755
277 HG1 THR 39 1HG THR 39 10.602 -0.011 -1.189
278 1HG2 THR 39 1HG2 THR 39 11.057 0.587 -4.031
279 2HG2 THR 39 2HG2 THR 39 10.197 2.117 -3.864
280 3HG2 THR 39 3HG2 THR 39 9.480 0.800 -4.793
281 H PHE 40 H PHE 40 7.140 2.746 -4.245
282 HA PHE 40 HA PHE 40 5.371 0.722 -5.427
283 1HB PHE 40 2HB PHE 40 5.349 3.738 -5.647
284 2HB PHE 40 1HB PHE 40 4.254 2.674 -6.519
285 HD1 PHE 40 2HD PHE 40 2.706 1.188 -5.158
286 HD2 PHE 40 1HD PHE 40 4.864 4.452 -3.489
287 HE1 PHE 40 2HE PHE 40 1.148 1.242 -3.253
288 HE2 PHE 40 1HE PHE 40 3.310 4.515 -1.587
289 HZ PHE 40 HZ PHE 40 1.448 2.906 -1.466
290 H THR 41 H THR 41 6.128 -0.279 -7.146
291 HA THR 41 HA THR 41 7.649 1.257 -9.121
292 HB THR 41 HB THR 41 7.862 -1.010 -10.278
293 HG1 THR 41 1HG THR 41 7.685 -2.729 -8.506
294 1HG2 THR 41 1HG2 THR 41 9.675 -1.758 -8.768
295 2HG2 THR 41 2HG2 THR 41 9.096 -0.621 -7.548
296 3HG2 THR 41 3HG2 THR 41 9.724 -0.025 -9.085
297 H GLU 42 H GLU 42 6.860 0.256 -11.502
298 HA GLU 42 HA GLU 42 4.409 1.667 -11.772
299 1HB GLU 42 2HB GLU 42 6.291 1.493 -13.489
300 2HB GLU 42 1HB GLU 42 5.617 -0.078 -13.902
301 1HG GLU 42 2HG GLU 42 3.449 1.034 -14.362
302 2HG GLU 42 1HG GLU 42 4.232 2.587 -14.083
303 H ASP 43 H ASP 43 5.255 -1.744 -11.697
304 HA ASP 43 HA ASP 43 2.426 -2.398 -12.221
305 1HB ASP 43 2HB ASP 43 4.870 -4.140 -12.571
306 2HB ASP 43 1HB ASP 43 3.212 -4.623 -12.912
307 H GLU 44 H GLU 44 4.653 -2.299 -9.688
308 HA GLU 44 HA GLU 44 3.242 -4.454 -8.283
309 1HB GLU 44 2HB GLU 44 6.240 -4.127 -8.411
310 2HB GLU 44 1HB GLU 44 5.385 -5.305 -7.423
311 1HG GLU 44 2HG GLU 44 4.995 -6.680 -9.158
312 2HG GLU 44 1HG GLU 44 4.712 -5.355 -10.285
313 H VAL 45 H VAL 45 2.979 -4.210 -6.114
314 HA VAL 45 HA VAL 45 4.121 -1.795 -4.863
315 HB VAL 45 HB VAL 45 1.675 -3.396 -4.070
316 1HG1 VAL 45 1HG1 VAL 45 2.844 -0.910 -2.815
317 2HG1 VAL 45 2HG1 VAL 45 2.826 -2.523 -2.104
318 3HG1 VAL 45 3HG1 VAL 45 1.311 -1.661 -2.370
319 1HG2 VAL 45 1HG2 VAL 45 1.893 -0.584 -5.144
320 2HG2 VAL 45 2HG2 VAL 45 0.408 -1.398 -4.652
321 3HG2 VAL 45 3HG2 VAL 45 1.317 -1.987 -6.044
322 H VAL 46 H VAL 46 5.813 -2.216 -3.566
323 HA VAL 46 HA VAL 46 5.890 -4.829 -2.213
324 HB VAL 46 HB VAL 46 8.177 -2.916 -2.698
325 1HG1 VAL 46 1HG1 VAL 46 9.590 -4.804 -1.977
326 2HG1 VAL 46 2HG1 VAL 46 8.132 -5.716 -1.582
327 3HG1 VAL 46 3HG1 VAL 46 8.513 -4.237 -0.701
328 1HG2 VAL 46 1HG2 VAL 46 7.464 -3.869 -4.793
329 2HG2 VAL 46 2HG2 VAL 46 7.464 -5.489 -4.094
330 3HG2 VAL 46 3HG2 VAL 46 8.982 -4.614 -4.295
331 H GLU 47 H GLU 47 5.493 -4.846 -0.112
332 HA GLU 47 HA GLU 47 5.601 -2.299 1.341
333 1HB GLU 47 2HB GLU 47 3.389 -3.411 1.169
334 2HB GLU 47 1HB GLU 47 4.041 -4.800 2.022
335 1HG GLU 47 2HG GLU 47 4.370 -3.506 4.004
336 2HG GLU 47 1HG GLU 47 3.942 -2.019 3.160
337 H THR 48 H THR 48 6.897 -2.086 3.056
338 HA THR 48 HA THR 48 8.342 -4.487 3.984
339 HB THR 48 HB THR 48 9.624 -1.785 4.040
340 HG1 THR 48 1HG THR 48 8.764 -2.658 1.817
341 1HG2 THR 48 1HG2 THR 48 10.707 -3.633 5.203
342 2HG2 THR 48 2HG2 THR 48 11.673 -3.111 3.821
343 3HG2 THR 48 3HG2 THR 48 10.706 -4.583 3.717
344 H GLU 49 H GLU 49 8.443 -4.745 6.137
345 HA GLU 49 HA GLU 49 7.061 -2.739 7.774
346 1HB GLU 49 2HB GLU 49 7.834 -5.541 8.578
347 2HB GLU 49 1HB GLU 49 6.703 -4.472 9.388
348 1HG GLU 49 2HG GLU 49 5.161 -4.652 7.514
349 2HG GLU 49 1HG GLU 49 6.300 -5.698 6.665
350 H VAL 50 H VAL 50 8.230 -1.460 9.071
351 HA VAL 50 HA VAL 50 11.014 -2.137 9.612
352 HB VAL 50 HB VAL 50 9.453 0.273 10.579
353 1HG1 VAL 50 1HG1 VAL 50 11.693 1.271 10.880
354 2HG1 VAL 50 2HG1 VAL 50 12.419 -0.273 10.429
355 3HG1 VAL 50 3HG1 VAL 50 11.443 -0.151 11.892
356 1HG2 VAL 50 1HG2 VAL 50 11.216 0.005 8.144
357 2HG2 VAL 50 2HG2 VAL 50 10.517 1.507 8.748
358 3HG2 VAL 50 3HG2 VAL 50 9.465 0.227 8.149
359 H MET 51 H MET 51 11.398 -3.481 11.247
360 HA MET 51 HA MET 51 9.419 -3.565 13.420
361 1HB MET 51 2HB MET 51 9.945 -5.553 11.655
362 2HB MET 51 1HB MET 51 11.102 -5.940 12.921
363 1HG MET 51 2HG MET 51 8.155 -5.561 13.369
364 2HG MET 51 1HG MET 51 8.948 -7.118 13.142
365 1HE MET 51 1HE MET 51 7.103 -6.182 15.666
366 2HE MET 51 2HE MET 51 7.985 -7.004 16.958
367 3HE MET 51 3HE MET 51 7.723 -7.810 15.412
368 H GLU 52 H GLU 52 10.130 -3.050 15.340
369 HA GLU 52 HA GLU 52 12.779 -2.238 15.822
370 1HB GLU 52 2HB GLU 52 10.718 -1.398 16.994
371 2HB GLU 52 1HB GLU 52 10.678 -2.912 17.887
372 1HG GLU 52 2HG GLU 52 12.871 -2.413 18.831
373 2HG GLU 52 1HG GLU 52 12.902 -0.889 17.949
374 H GLY 53 H GLY 53 14.480 -3.489 16.066
375 1HA GLY 53 2HA GLY 53 15.623 -5.061 17.541
376 2HA GLY 53 1HA GLY 53 14.155 -6.030 17.535
377 H ARG 54 H ARG 54 13.803 -5.566 14.619
378 HA ARG 54 HA ARG 54 15.842 -7.480 13.696
379 1HB ARG 54 2HB ARG 54 13.427 -7.113 12.052
380 2HB ARG 54 1HB ARG 54 14.270 -8.581 12.500
381 1HG ARG 54 2HG ARG 54 13.213 -8.420 14.744
382 2HG ARG 54 1HG ARG 54 12.249 -7.078 14.130
383 1HD ARG 54 2HD ARG 54 11.448 -8.573 12.310
384 2HD ARG 54 1HD ARG 54 12.297 -9.903 13.085
385 HE ARG 54 HE ARG 54 10.481 -8.633 14.875
386 1HH1 ARG 54 1HH1 ARG 54 10.761 -10.993 12.304
387 2HH1 ARG 54 2HH1 ARG 54 9.248 -11.767 12.672
388 1HH2 ARG 54 1HH2 ARG 54 8.492 -9.670 15.379
389 2HH2 ARG 54 2HH2 ARG 54 7.945 -11.001 14.404
390 H GLY 55 H GLY 55 13.692 -4.945 12.507
391 1HA GLY 55 2HA GLY 55 14.817 -3.035 11.326
392 2HA GLY 55 1HA GLY 55 15.715 -4.278 10.458
393 H GLU 56 H GLU 56 14.702 -3.070 8.570
394 HA GLU 56 HA GLU 56 11.961 -3.433 8.036
395 1HB GLU 56 2HB GLU 56 14.274 -3.020 6.142
396 2HB GLU 56 1HB GLU 56 12.576 -2.896 5.713
397 1HG GLU 56 2HG GLU 56 13.005 -0.721 6.062
398 2HG GLU 56 1HG GLU 56 12.572 -1.165 7.701
399 H VAL 57 H VAL 57 10.879 -5.079 7.449
400 HA VAL 57 HA VAL 57 12.244 -7.415 6.271
401 HB VAL 57 HB VAL 57 9.793 -7.296 8.039
402 1HG1 VAL 57 1HG1 VAL 57 9.533 -8.977 6.255
403 2HG1 VAL 57 2HG1 VAL 57 9.694 -9.724 7.844
404 3HG1 VAL 57 3HG1 VAL 57 11.066 -9.707 6.736
405 1HG2 VAL 57 1HG2 VAL 57 11.125 -8.640 9.582
406 2HG2 VAL 57 2HG2 VAL 57 11.915 -7.102 9.232
407 3HG2 VAL 57 3HG2 VAL 57 12.488 -8.581 8.463
408 H GLN 58 H GLN 58 11.675 -7.806 4.210
409 HA GLN 58 HA GLN 58 9.608 -6.263 2.978
410 1HB GLN 58 2HB GLN 58 11.436 -8.393 1.875
411 2HB GLN 58 1HB GLN 58 10.364 -7.389 0.919
412 1HG GLN 58 2HG GLN 58 11.556 -5.392 1.723
413 2HG GLN 58 1HG GLN 58 12.673 -6.441 2.586
414 1HE2 GLN 58 1HE2 GLN 58 12.683 -8.456 0.486
415 2HE2 GLN 58 2HE2 GLN 58 13.642 -7.806 -0.798
416 H LEU 59 H LEU 59 7.610 -6.820 2.585
417 HA LEU 59 HA LEU 59 6.687 -9.533 3.120
418 1HB LEU 59 2HB LEU 59 5.275 -6.931 2.521
419 2HB LEU 59 1HB LEU 59 4.425 -8.458 2.660
420 HG LEU 59 HG LEU 59 6.057 -7.175 4.848
421 1HD1 LEU 59 1HD1 LEU 59 4.038 -5.913 4.407
422 2HD1 LEU 59 2HD1 LEU 59 3.874 -6.801 5.922
423 3HD1 LEU 59 3HD1 LEU 59 3.074 -7.387 4.462
424 1HD2 LEU 59 1HD2 LEU 59 4.284 -9.614 4.882
425 2HD2 LEU 59 2HD2 LEU 59 5.108 -8.909 6.273
426 3HD2 LEU 59 3HD2 LEU 59 6.046 -9.616 4.958
427 HA PRO 60 HA PRO 60 6.249 -10.954 -1.040
428 1HB PRO 60 2HB PRO 60 3.542 -11.529 -1.236
429 2HB PRO 60 1HB PRO 60 4.766 -12.608 -0.565
430 1HG PRO 60 2HG PRO 60 2.846 -10.810 0.838
431 2HG PRO 60 1HG PRO 60 3.425 -12.421 1.301
432 1HD PRO 60 2HD PRO 60 4.343 -10.186 2.474
433 2HD PRO 60 1HD PRO 60 5.382 -11.595 2.208
434 H PHE 61 H PHE 61 6.213 -9.884 -2.895
435 HA PHE 61 HA PHE 61 5.145 -7.295 -3.122
436 1HB PHE 61 2HB PHE 61 5.865 -7.385 -5.453
437 2HB PHE 61 1HB PHE 61 7.103 -8.064 -4.405
438 HD1 PHE 61 1HD PHE 61 7.373 -10.551 -4.291
439 HD2 PHE 61 2HD PHE 61 4.879 -8.650 -7.171
440 HE1 PHE 61 1HE PHE 61 7.400 -12.594 -5.657
441 HE2 PHE 61 2HE PHE 61 4.900 -10.692 -8.539
442 HZ PHE 61 HZ PHE 61 6.161 -12.666 -7.785
443 H MET 62 H MET 62 3.417 -6.486 -4.279
444 HA MET 62 HA MET 62 1.440 -8.462 -5.193
445 1HB MET 62 2HB MET 62 1.006 -5.890 -3.671
446 2HB MET 62 1HB MET 62 -0.288 -6.751 -4.490
447 1HG MET 62 2HG MET 62 0.085 -8.696 -3.097
448 2HG MET 62 1HG MET 62 1.445 -7.898 -2.315
449 1HE MET 62 1HE MET 62 1.255 -5.929 -0.634
450 2HE MET 62 2HE MET 62 -0.241 -5.078 -0.250
451 3HE MET 62 3HE MET 62 0.463 -4.946 -1.863
452 H ALA 63 H ALA 63 1.081 -8.306 -7.306
453 HA ALA 63 HA ALA 63 1.986 -5.940 -8.739
454 1HB ALA 63 1HB ALA 63 1.670 -7.264 -10.749
455 2HB ALA 63 2HB ALA 63 0.894 -8.538 -9.809
456 3HB ALA 63 3HB ALA 63 2.600 -8.174 -9.556
457 H TYR 64 H TYR 64 0.692 -4.557 -9.886
458 HA TYR 64 HA TYR 64 -2.217 -4.985 -9.770
459 1HB TYR 64 2HB TYR 64 -2.617 -2.786 -8.866
460 2HB TYR 64 1HB TYR 64 -1.495 -3.610 -7.792
461 HD1 TYR 64 2HD TYR 64 0.954 -2.990 -7.893
462 HD2 TYR 64 1HD TYR 64 -2.047 -0.734 -9.894
463 HE1 TYR 64 2HE TYR 64 2.500 -1.087 -8.058
464 HE2 TYR 64 1HE TYR 64 -0.509 1.177 -10.056
465 HH TYR 64 HH TYR 64 2.847 0.905 -9.338
466 H LYS 65 H LYS 65 -3.347 -3.247 -11.078
467 HA LYS 65 HA LYS 65 -1.651 -2.171 -13.223
468 1HB LYS 65 2HB LYS 65 -4.203 -3.714 -13.487
469 2HB LYS 65 1HB LYS 65 -3.792 -2.487 -14.678
470 1HG LYS 65 2HG LYS 65 -1.588 -3.680 -14.947
471 2HG LYS 65 1HG LYS 65 -2.289 -4.988 -14.000
472 1HD LYS 65 2HD LYS 65 -4.046 -5.293 -15.622
473 2HD LYS 65 1HD LYS 65 -3.498 -3.881 -16.527
474 1HE LYS 65 2HE LYS 65 -1.346 -5.036 -16.933
475 2HE LYS 65 1HE LYS 65 -2.003 -6.467 -16.138
476 1HZ LYS 65 1HZ LYS 65 -3.138 -5.179 -18.564
477 2HZ LYS 65 2HZ LYS 65 -3.720 -6.590 -17.819
478 3HZ LYS 65 3HZ LYS 65 -2.191 -6.584 -18.556
479 H VAL 66 H VAL 66 -2.421 -0.329 -14.252
480 HA VAL 66 HA VAL 66 -3.884 1.414 -12.427
481 HB VAL 66 HB VAL 66 -2.235 2.020 -14.882
482 1HG1 VAL 66 1HG1 VAL 66 -2.413 4.375 -14.235
483 2HG1 VAL 66 2HG1 VAL 66 -3.488 3.932 -12.910
484 3HG1 VAL 66 3HG1 VAL 66 -4.002 3.689 -14.577
485 1HG2 VAL 66 1HG2 VAL 66 -0.884 1.250 -13.032
486 2HG2 VAL 66 2HG2 VAL 66 -1.661 2.400 -11.946
487 3HG2 VAL 66 3HG2 VAL 66 -0.638 2.983 -13.261
488 H ILE 67 H ILE 67 -5.937 1.916 -12.778
489 HA ILE 67 HA ILE 67 -7.227 1.183 -15.282
490 HB ILE 67 HB ILE 67 -8.539 2.503 -12.913
491 1HG1 ILE 67 2HG1 ILE 67 -8.121 -0.462 -13.361
492 2HG1 ILE 67 1HG1 ILE 67 -7.322 0.509 -12.126
493 1HG2 ILE 67 1HG2 ILE 67 -10.528 1.312 -13.761
494 2HG2 ILE 67 2HG2 ILE 67 -9.569 0.720 -15.118
495 3HG2 ILE 67 3HG2 ILE 67 -9.862 2.449 -14.930
496 1HD1 ILE 67 1HD1 ILE 67 -9.492 0.963 -11.088
497 2HD1 ILE 67 2HD1 ILE 67 -9.150 -0.763 -11.176
498 3HD1 ILE 67 3HD1 ILE 67 -10.278 -0.032 -12.314
499 H SER 68 H SER 68 -6.779 4.041 -13.239
500 HA SER 68 HA SER 68 -6.736 5.708 -15.633
501 1HB SER 68 2HB SER 68 -8.375 6.476 -13.225
502 2HB SER 68 1HB SER 68 -8.260 7.336 -14.748
503 HG SER 68 HG SER 68 -9.041 4.781 -15.155
504 H GLN 69 H GLN 69 -5.774 7.803 -15.213
505 HA GLN 69 HA GLN 69 -4.228 8.063 -12.762
506 1HB GLN 69 2HB GLN 69 -2.874 6.567 -14.196
507 2HB GLN 69 1HB GLN 69 -2.888 7.783 -15.462
508 1HG GLN 69 2HG GLN 69 -1.682 9.321 -13.979
509 2HG GLN 69 1HG GLN 69 -1.641 8.069 -12.740
510 1HE2 GLN 69 1HE2 GLN 69 -1.281 7.399 -16.151
511 2HE2 GLN 69 2HE2 GLN 69 0.394 6.955 -16.079
512 H SER 70 H SER 70 -3.403 10.143 -12.434
513 HA SER 70 HA SER 70 -3.807 12.108 -14.561
514 1HB SER 70 2HB SER 70 -5.783 12.226 -13.066
515 2HB SER 70 1HB SER 70 -4.712 12.499 -11.699
516 HG SER 70 HG SER 70 -5.746 14.363 -13.000
517 H THR 71 H THR 71 -2.297 13.744 -14.567
518 HA THR 71 HA THR 71 0.083 13.419 -13.033
519 HB THR 71 HB THR 71 -0.649 15.890 -14.566
520 HG1 THR 71 1HG THR 71 0.717 14.227 -16.116
521 1HG2 THR 71 1HG2 THR 71 1.447 15.939 -13.297
522 2HG2 THR 71 2HG2 THR 71 1.757 15.956 -15.033
523 3HG2 THR 71 3HG2 THR 71 1.977 14.468 -14.114
524 H ASP 72 H ASP 72 -2.858 15.211 -12.739
525 HA ASP 72 HA ASP 72 -2.132 16.013 -10.068
526 1HB ASP 72 2HB ASP 72 -1.322 17.916 -11.407
527 2HB ASP 72 1HB ASP 72 -2.928 18.102 -12.105
528 H GLY 73 H GLY 73 -3.765 14.326 -9.888
529 1HA GLY 73 2HA GLY 73 -6.209 15.556 -9.105
530 2HA GLY 73 1HA GLY 73 -6.426 14.559 -10.538
531 H SER 74 H SER 74 -6.303 12.356 -10.387
532 HA SER 74 HA SER 74 -5.548 11.129 -7.877
533 1HB SER 74 2HB SER 74 -8.279 10.746 -9.108
534 2HB SER 74 1HB SER 74 -7.662 9.952 -7.679
535 HG SER 74 HG SER 74 -7.391 12.563 -7.320
536 H ILE 75 H ILE 75 -5.167 8.889 -8.073
537 HA ILE 75 HA ILE 75 -5.139 7.835 -10.830
538 HB ILE 75 HB ILE 75 -3.328 6.906 -8.606
539 1HG1 ILE 75 2HG1 ILE 75 -2.731 8.961 -10.740
540 2HG1 ILE 75 1HG1 ILE 75 -2.826 9.259 -9.010
541 1HG2 ILE 75 1HG2 ILE 75 -3.245 6.561 -11.589
542 2HG2 ILE 75 2HG2 ILE 75 -3.627 5.323 -10.391
543 3HG2 ILE 75 3HG2 ILE 75 -2.001 6.001 -10.471
544 1HD1 ILE 75 1HD1 ILE 75 -0.520 9.153 -9.776
545 2HD1 ILE 75 2HD1 ILE 75 -0.788 7.519 -10.383
546 3HD1 ILE 75 3HD1 ILE 75 -0.878 7.843 -8.652
547 H GLU 76 H GLU 76 -6.094 5.855 -11.137
548 HA GLU 76 HA GLU 76 -7.246 4.567 -8.744
549 1HB GLU 76 2HB GLU 76 -8.826 5.693 -10.483
550 2HB GLU 76 1HB GLU 76 -8.426 4.309 -11.489
551 1HG GLU 76 2HG GLU 76 -9.350 2.782 -9.918
552 2HG GLU 76 1HG GLU 76 -9.552 4.056 -8.718
553 H ILE 77 H ILE 77 -6.515 2.588 -8.375
554 HA ILE 77 HA ILE 77 -5.370 1.045 -10.607
555 HB ILE 77 HB ILE 77 -3.567 0.251 -9.132
556 1HG1 ILE 77 2HG1 ILE 77 -4.519 2.375 -7.194
557 2HG1 ILE 77 1HG1 ILE 77 -4.768 0.647 -6.983
558 1HG2 ILE 77 1HG2 ILE 77 -3.125 2.107 -10.628
559 2HG2 ILE 77 2HG2 ILE 77 -2.220 2.300 -9.128
560 3HG2 ILE 77 3HG2 ILE 77 -3.679 3.252 -9.404
561 1HD1 ILE 77 1HD1 ILE 77 -2.106 2.039 -7.104
562 2HD1 ILE 77 2HD1 ILE 77 -2.353 0.307 -6.887
563 3HD1 ILE 77 3HD1 ILE 77 -2.900 1.436 -5.648
564 H GLN 78 H GLN 78 -5.309 -1.258 -10.250
565 HA GLN 78 HA GLN 78 -7.072 -2.189 -8.086
566 1HB GLN 78 2HB GLN 78 -8.150 -2.031 -10.430
567 2HB GLN 78 1HB GLN 78 -7.150 -3.418 -10.831
568 1HG GLN 78 2HG GLN 78 -8.318 -4.834 -9.475
569 2HG GLN 78 1HG GLN 78 -8.848 -3.547 -8.393
570 1HE2 GLN 78 1HE2 GLN 78 -11.008 -4.217 -8.493
571 2HE2 GLN 78 2HE2 GLN 78 -11.990 -3.970 -9.893
572 H TYR 79 H TYR 79 -6.526 -4.191 -7.193
573 HA TYR 79 HA TYR 79 -3.669 -4.503 -7.277
574 1HB TYR 79 2HB TYR 79 -5.827 -5.119 -5.411
575 2HB TYR 79 1HB TYR 79 -4.543 -6.320 -5.432
576 HD1 TYR 79 1HD TYR 79 -5.216 -2.702 -4.965
577 HD2 TYR 79 2HD TYR 79 -2.492 -5.914 -4.383
578 HE1 TYR 79 1HE TYR 79 -3.841 -1.266 -3.519
579 HE2 TYR 79 2HE TYR 79 -1.115 -4.490 -2.934
580 HH TYR 79 HH TYR 79 -0.695 -2.112 -2.566
581 H LEU 80 H LEU 80 -5.917 -5.956 -9.085
582 HA LEU 80 HA LEU 80 -6.197 -7.948 -10.169
583 1HB LEU 80 2HB LEU 80 -3.198 -7.891 -9.878
584 2HB LEU 80 1HB LEU 80 -4.063 -8.970 -10.955
585 HG LEU 80 HG LEU 80 -4.054 -5.954 -11.141
586 1HD1 LEU 80 1HD1 LEU 80 -2.678 -6.270 -13.113
587 2HD1 LEU 80 2HD1 LEU 80 -2.701 -8.018 -12.875
588 3HD1 LEU 80 3HD1 LEU 80 -1.891 -6.979 -11.703
589 1HD2 LEU 80 1HD2 LEU 80 -6.137 -6.930 -11.944
590 2HD2 LEU 80 2HD2 LEU 80 -5.232 -8.051 -12.961
591 3HD2 LEU 80 3HD2 LEU 80 -5.172 -6.319 -13.289
592 H GLY 81 H GLY 81 -5.038 -10.413 -10.119
593 1HA GLY 81 2HA GLY 81 -4.827 -12.360 -8.911
594 2HA GLY 81 1HA GLY 81 -4.287 -11.367 -7.565
595 HA PRO 82 HA PRO 82 -8.279 -13.194 -6.068
596 1HB PRO 82 2HB PRO 82 -6.896 -12.561 -3.525
597 2HB PRO 82 1HB PRO 82 -7.721 -14.045 -4.013
598 1HG PRO 82 2HG PRO 82 -5.056 -13.929 -3.880
599 2HG PRO 82 1HG PRO 82 -5.874 -14.846 -5.160
600 1HD PRO 82 2HD PRO 82 -4.561 -12.159 -5.295
601 2HD PRO 82 1HD PRO 82 -4.557 -13.479 -6.483
602 H TYR 83 H TYR 83 -6.616 -10.244 -5.861
603 HA TYR 83 HA TYR 83 -8.884 -8.895 -4.556
604 1HB TYR 83 2HB TYR 83 -6.013 -7.979 -4.879
605 2HB TYR 83 1HB TYR 83 -7.293 -7.045 -4.119
606 HD1 TYR 83 2HD TYR 83 -5.018 -9.895 -3.749
607 HD2 TYR 83 1HD TYR 83 -8.072 -7.587 -1.896
608 HE1 TYR 83 2HE TYR 83 -4.448 -10.898 -1.580
609 HE2 TYR 83 1HE TYR 83 -7.508 -8.577 0.283
610 HH TYR 83 HH TYR 83 -4.668 -10.341 0.825
611 H TYR 84 H TYR 84 -8.875 -9.703 -7.354
612 HA TYR 84 HA TYR 84 -8.062 -7.412 -8.869
613 1HB TYR 84 2HB TYR 84 -8.425 -8.638 -10.819
614 2HB TYR 84 1HB TYR 84 -7.814 -9.817 -9.672
615 HD1 TYR 84 1HD TYR 84 -9.384 -11.499 -8.689
616 HD2 TYR 84 2HD TYR 84 -10.580 -8.847 -11.789
617 HE1 TYR 84 1HE TYR 84 -11.284 -12.973 -9.211
618 HE2 TYR 84 2HE TYR 84 -12.482 -10.307 -12.316
619 HH TYR 84 HH TYR 84 -13.588 -12.717 -10.326
620 HA PRO 85 HA PRO 85 -12.445 -6.332 -8.907
621 1HB PRO 85 2HB PRO 85 -14.177 -7.084 -7.013
622 2HB PRO 85 1HB PRO 85 -13.891 -8.053 -8.461
623 1HG PRO 85 2HG PRO 85 -12.920 -8.472 -5.683
624 2HG PRO 85 1HG PRO 85 -13.353 -9.668 -6.915
625 1HD PRO 85 2HD PRO 85 -10.751 -8.803 -6.262
626 2HD PRO 85 1HD PRO 85 -11.218 -9.762 -7.680
627 H LEU 86 H LEU 86 -10.340 -6.433 -6.339
628 HA LEU 86 HA LEU 86 -11.583 -4.203 -4.903
629 1HB LEU 86 2HB LEU 86 -10.787 -5.997 -3.493
630 2HB LEU 86 1HB LEU 86 -9.211 -5.952 -4.254
631 HG LEU 86 HG LEU 86 -8.845 -3.693 -3.304
632 1HD1 LEU 86 1HD1 LEU 86 -10.320 -2.898 -1.525
633 2HD1 LEU 86 2HD1 LEU 86 -11.430 -4.227 -1.856
634 3HD1 LEU 86 3HD1 LEU 86 -11.155 -2.982 -3.076
635 1HD2 LEU 86 1HD2 LEU 86 -9.510 -5.837 -1.294
636 2HD2 LEU 86 2HD2 LEU 86 -8.480 -4.436 -1.007
637 3HD2 LEU 86 3HD2 LEU 86 -7.985 -5.669 -2.169
638 H LYS 87 H LYS 87 -11.104 -2.243 -5.648
639 HA LYS 87 HA LYS 87 -8.402 -1.823 -6.707
640 1HB LYS 87 2HB LYS 87 -9.293 0.067 -7.984
641 2HB LYS 87 1HB LYS 87 -10.071 -1.444 -8.413
642 1HG LYS 87 2HG LYS 87 -12.020 -0.833 -7.089
643 2HG LYS 87 1HG LYS 87 -11.234 0.683 -6.631
644 1HD LYS 87 2HD LYS 87 -11.133 1.355 -8.966
645 2HD LYS 87 1HD LYS 87 -11.869 -0.170 -9.451
646 1HE LYS 87 2HE LYS 87 -13.898 0.426 -8.215
647 2HE LYS 87 1HE LYS 87 -13.150 1.949 -7.730
648 1HZ LYS 87 1HZ LYS 87 -13.823 1.106 -10.500
649 2HZ LYS 87 2HZ LYS 87 -12.960 2.513 -10.113
650 3HZ LYS 87 3HZ LYS 87 -14.570 2.338 -9.602
651 H SER 88 H SER 88 -7.608 0.444 -6.458
652 HA SER 88 HA SER 88 -8.324 1.531 -3.829
653 1HB SER 88 2HB SER 88 -6.475 0.097 -3.335
654 2HB SER 88 1HB SER 88 -5.584 0.636 -4.747
655 HG SER 88 HG SER 88 -6.289 2.411 -2.662
656 H THR 89 H THR 89 -7.568 3.734 -3.507
657 HA THR 89 HA THR 89 -7.301 5.156 -6.072
658 HB THR 89 HB THR 89 -8.326 6.407 -3.548
659 HG1 THR 89 1HG THR 89 -9.509 4.426 -4.907
660 1HG2 THR 89 1HG2 THR 89 -9.453 7.922 -5.098
661 2HG2 THR 89 2HG2 THR 89 -8.834 6.996 -6.465
662 3HG2 THR 89 3HG2 THR 89 -7.719 7.875 -5.422
663 H LEU 90 H LEU 90 -5.773 6.674 -6.272
664 HA LEU 90 HA LEU 90 -3.989 7.181 -3.987
665 1HB LEU 90 2HB LEU 90 -3.234 6.755 -6.877
666 2HB LEU 90 1HB LEU 90 -2.139 7.390 -5.667
667 HG LEU 90 HG LEU 90 -3.419 4.660 -5.544
668 1HD1 LEU 90 1HD1 LEU 90 -1.177 3.822 -6.114
669 2HD1 LEU 90 2HD1 LEU 90 -0.639 5.481 -6.382
670 3HD1 LEU 90 3HD1 LEU 90 -1.884 4.780 -7.417
671 1HD2 LEU 90 1HD2 LEU 90 -1.226 5.933 -3.910
672 2HD2 LEU 90 2HD2 LEU 90 -1.756 4.255 -3.787
673 3HD2 LEU 90 3HD2 LEU 90 -2.859 5.563 -3.357
674 H LYS 91 H LYS 91 -3.820 9.246 -3.489
675 HA LYS 91 HA LYS 91 -4.293 11.277 -5.565
676 1HB LYS 91 2HB LYS 91 -5.584 11.143 -2.836
677 2HB LYS 91 1HB LYS 91 -5.616 12.572 -3.855
678 1HG LYS 91 2HG LYS 91 -7.136 11.685 -5.287
679 2HG LYS 91 1HG LYS 91 -6.568 10.034 -5.051
680 1HD LYS 91 2HD LYS 91 -8.802 10.333 -4.122
681 2HD LYS 91 1HD LYS 91 -7.630 9.978 -2.854
682 1HE LYS 91 2HE LYS 91 -7.533 12.323 -2.250
683 2HE LYS 91 1HE LYS 91 -8.632 12.730 -3.569
684 1HZ LYS 91 1HZ LYS 91 -9.286 10.994 -1.246
685 2HZ LYS 91 2HZ LYS 91 -10.336 11.387 -2.519
686 3HZ LYS 91 3HZ LYS 91 -9.802 12.600 -1.462
687 H ARG 92 H ARG 92 -3.318 13.341 -5.057
688 HA ARG 92 HA ARG 92 -0.935 13.037 -3.453
689 1HB ARG 92 2HB ARG 92 -0.328 15.240 -4.342
690 2HB ARG 92 1HB ARG 92 -0.747 14.121 -5.632
691 1HG ARG 92 2HG ARG 92 -2.793 15.145 -6.000
692 2HG ARG 92 1HG ARG 92 -2.756 16.001 -4.464
693 1HD ARG 92 2HD ARG 92 -0.820 17.305 -5.304
694 2HD ARG 92 1HD ARG 92 -1.023 16.521 -6.871
695 HE ARG 92 HE ARG 92 -2.713 17.979 -7.318
696 1HH1 ARG 92 1HH1 ARG 92 -2.226 17.891 -3.842
697 2HH1 ARG 92 2HH1 ARG 92 -3.531 18.988 -3.492
698 1HH2 ARG 92 1HH2 ARG 92 -4.441 19.430 -6.855
699 2HH2 ARG 92 2HH2 ARG 92 -4.793 19.847 -5.205
700 H GLY 93 H GLY 93 -0.346 14.634 -1.836
701 1HA GLY 93 2HA GLY 93 -2.638 15.699 -0.385
702 2HA GLY 93 1HA GLY 93 -0.978 15.612 0.200
703 H GLU 94 H GLU 94 -1.888 17.917 0.725
704 HA GLU 94 HA GLU 94 -1.597 19.736 -1.508
705 1HB GLU 94 2HB GLU 94 -2.324 20.161 1.386
706 2HB GLU 94 1HB GLU 94 -2.164 21.461 0.225
707 1HG GLU 94 2HG GLU 94 -4.131 19.193 0.092
708 2HG GLU 94 1HG GLU 94 -4.485 20.865 0.522
709 H ASN 95 H ASN 95 0.404 18.308 0.772
710 HA ASN 95 HA ASN 95 2.574 20.085 0.127
711 1HB ASN 95 2HB ASN 95 3.155 20.549 2.522
712 2HB ASN 95 1HB ASN 95 1.700 21.355 1.960
713 1HD2 ASN 95 1HD2 ASN 95 -0.322 20.652 2.731
714 2HD2 ASN 95 2HD2 ASN 95 -0.466 19.702 4.175
715 H GLY 96 H GLY 96 3.542 18.302 -0.778
716 1HA GLY 96 2HA GLY 96 4.981 16.514 -0.820
717 2HA GLY 96 1HA GLY 96 5.498 17.098 0.751
718 H THR 97 H THR 97 2.395 15.687 -0.206
719 HA THR 97 HA THR 97 2.910 13.429 1.575
720 HB THR 97 HB THR 97 0.356 13.892 2.247
721 HG1 THR 97 1HG THR 97 1.417 16.520 2.101
722 1HG2 THR 97 1HG2 THR 97 2.236 13.613 3.808
723 2HG2 THR 97 2HG2 THR 97 1.169 14.928 4.298
724 3HG2 THR 97 3HG2 THR 97 2.713 15.289 3.523
725 H LEU 98 H LEU 98 1.371 11.661 1.287
726 HA LEU 98 HA LEU 98 0.019 11.716 -1.328
727 1HB LEU 98 2HB LEU 98 2.089 10.325 -1.333
728 2HB LEU 98 1HB LEU 98 1.391 9.335 -0.067
729 HG LEU 98 HG LEU 98 -0.491 8.799 -1.669
730 1HD1 LEU 98 1HD1 LEU 98 1.396 10.066 -3.642
731 2HD1 LEU 98 2HD1 LEU 98 -0.211 10.648 -3.206
732 3HD1 LEU 98 3HD1 LEU 98 -0.027 9.112 -4.055
733 1HD2 LEU 98 1HD2 LEU 98 2.287 7.971 -2.493
734 2HD2 LEU 98 2HD2 LEU 98 0.789 7.113 -2.856
735 3HD2 LEU 98 3HD2 LEU 98 1.347 7.247 -1.188
736 H ILE 99 H ILE 99 -2.046 11.064 -1.346
737 HA ILE 99 HA ILE 99 -3.190 10.045 1.156
738 HB ILE 99 HB ILE 99 -4.620 11.147 -1.268
739 1HG1 ILE 99 2HG1 ILE 99 -3.142 12.835 -0.186
740 2HG1 ILE 99 1HG1 ILE 99 -4.846 13.242 -0.066
741 1HG2 ILE 99 1HG2 ILE 99 -5.980 9.664 0.113
742 2HG2 ILE 99 2HG2 ILE 99 -6.550 11.328 0.225
743 3HG2 ILE 99 3HG2 ILE 99 -5.601 10.629 1.539
744 1HD1 ILE 99 1HD1 ILE 99 -3.150 12.034 2.097
745 2HD1 ILE 99 2HD1 ILE 99 -4.867 12.405 2.230
746 3HD1 ILE 99 3HD1 ILE 99 -3.700 13.710 2.010
747 H TRP 100 H TRP 100 -3.271 7.887 1.173
748 HA TRP 100 HA TRP 100 -3.845 6.468 -1.344
749 1HB TRP 100 2HB TRP 100 -1.686 5.942 -0.175
750 2HB TRP 100 1HB TRP 100 -2.618 5.366 1.198
751 HD1 TRP 100 HD TRP 100 -4.446 4.225 -1.751
752 HE1 TRP 100 1HE TRP 100 -3.847 1.803 -2.344
753 HE3 TRP 100 3HE TRP 100 -0.253 3.717 1.119
754 HZ2 TRP 100 2HZ TRP 100 -1.844 -0.088 -1.674
755 HZ3 TRP 100 3HZ TRP 100 0.947 1.573 1.092
756 HH2 TRP 100 HH TRP 100 0.167 -0.291 -0.276
757 H GLU 101 H GLU 101 -5.927 5.938 -1.515
758 HA GLU 101 HA GLU 101 -7.379 5.214 0.935
759 1HB GLU 101 2HB GLU 101 -8.227 6.314 -1.703
760 2HB GLU 101 1HB GLU 101 -9.386 5.450 -0.722
761 1HG GLU 101 2HG GLU 101 -9.206 7.016 1.035
762 2HG GLU 101 1HG GLU 101 -7.789 7.765 0.310
763 H GLN 102 H GLN 102 -8.031 3.249 1.233
764 HA GLN 102 HA GLN 102 -8.312 1.350 -0.937
765 1HB GLN 102 2HB GLN 102 -5.827 1.438 -0.197
766 2HB GLN 102 1HB GLN 102 -6.388 0.628 1.260
767 1HG GLN 102 2HG GLN 102 -7.472 -1.020 -0.466
768 2HG GLN 102 1HG GLN 102 -6.234 -0.377 -1.531
769 1HE2 GLN 102 1HE2 GLN 102 -4.089 -0.796 -1.082
770 2HE2 GLN 102 2HE2 GLN 102 -3.626 -2.032 0.020
771 H ASN 103 H ASN 103 -9.868 -0.112 -0.455
772 HA ASN 103 HA ASN 103 -11.450 -1.284 0.679
773 1HB ASN 103 2HB ASN 103 -9.212 -1.229 2.672
774 2HB ASN 103 1HB ASN 103 -10.776 -1.871 3.154
775 1HD2 ASN 103 1HD2 ASN 103 -7.924 -2.392 1.300
776 2HD2 ASN 103 2HD2 ASN 103 -8.301 -3.999 0.792
777 H GLY 104 H GLY 104 -11.245 1.778 0.942
778 1HA GLY 104 2HA GLY 104 -13.078 3.103 1.698
779 2HA GLY 104 1HA GLY 104 -13.337 1.949 2.997
780 H GLN 105 H GLN 105 -10.191 2.136 3.199
781 HA GLN 105 HA GLN 105 -10.306 4.224 5.232
782 1HB GLN 105 2HB GLN 105 -8.116 2.241 4.603
783 2HB GLN 105 1HB GLN 105 -8.157 3.326 5.985
784 1HG GLN 105 2HG GLN 105 -10.277 2.181 6.680
785 2HG GLN 105 1HG GLN 105 -9.956 0.997 5.417
786 1HE2 GLN 105 1HE2 GLN 105 -8.880 2.294 8.467
787 2HE2 GLN 105 2HE2 GLN 105 -7.808 0.993 8.872
788 H ARG 106 H ARG 106 -9.301 6.094 5.118
789 HA ARG 106 HA ARG 106 -7.662 6.691 2.769
790 1HB ARG 106 2HB ARG 106 -9.545 8.161 3.053
791 2HB ARG 106 1HB ARG 106 -9.149 8.434 4.740
792 1HG ARG 106 2HG ARG 106 -7.088 9.217 2.776
793 2HG ARG 106 1HG ARG 106 -8.576 10.168 2.782
794 1HD ARG 106 2HD ARG 106 -8.286 10.395 5.276
795 2HD ARG 106 1HD ARG 106 -6.686 9.679 5.078
796 HE ARG 106 HE ARG 106 -6.750 11.773 3.311
797 1HH1 ARG 106 1HH1 ARG 106 -7.236 11.406 6.750
798 2HH1 ARG 106 2HH1 ARG 106 -6.667 13.001 7.142
799 1HH2 ARG 106 1HH2 ARG 106 -5.999 13.895 3.824
800 2HH2 ARG 106 2HH2 ARG 106 -5.977 14.410 5.479
801 H LYS 107 H LYS 107 -5.517 6.527 3.055
802 HA LYS 107 HA LYS 107 -4.415 7.075 5.729
803 1HB LYS 107 2HB LYS 107 -4.115 4.793 4.690
804 2HB LYS 107 1HB LYS 107 -3.020 5.577 3.552
805 1HG LYS 107 2HG LYS 107 -1.689 6.401 5.446
806 2HG LYS 107 1HG LYS 107 -2.757 5.536 6.547
807 1HD LYS 107 2HD LYS 107 -1.005 4.349 4.419
808 2HD LYS 107 1HD LYS 107 -0.781 4.263 6.163
809 1HE LYS 107 2HE LYS 107 -2.891 3.059 6.371
810 2HE LYS 107 1HE LYS 107 -3.076 3.108 4.620
811 1HZ LYS 107 1HZ LYS 107 -0.989 1.675 6.170
812 2HZ LYS 107 2HZ LYS 107 -0.884 1.906 4.500
813 3HZ LYS 107 3HZ LYS 107 -2.163 0.992 5.155
814 H THR 108 H THR 108 -2.825 8.597 5.984
815 HA THR 108 HA THR 108 -1.771 9.866 3.544
816 HB THR 108 HB THR 108 -2.031 11.176 6.259
817 HG1 THR 108 1HG THR 108 -3.891 10.717 4.342
818 1HG2 THR 108 1HG2 THR 108 -1.475 12.328 3.521
819 2HG2 THR 108 2HG2 THR 108 -0.286 12.114 4.806
820 3HG2 THR 108 3HG2 THR 108 -1.622 13.244 5.021
821 H MET 109 H MET 109 0.304 9.314 3.214
822 HA MET 109 HA MET 109 1.945 8.728 5.595
823 1HB MET 109 2HB MET 109 3.280 7.212 4.220
824 2HB MET 109 1HB MET 109 1.591 6.734 4.243
825 1HG MET 109 2HG MET 109 2.732 8.376 2.015
826 2HG MET 109 1HG MET 109 2.830 6.617 2.024
827 1HE MET 109 1HE MET 109 -0.925 5.573 2.025
828 2HE MET 109 2HE MET 109 0.120 5.804 3.428
829 3HE MET 109 3HE MET 109 0.746 5.016 1.980
830 H THR 110 H THR 110 4.290 9.008 5.272
831 HA THR 110 HA THR 110 4.830 11.573 3.935
832 HB THR 110 HB THR 110 6.621 10.215 5.937
833 HG1 THR 110 1HG THR 110 4.117 11.141 6.357
834 1HG2 THR 110 1HG2 THR 110 7.533 12.153 4.746
835 2HG2 THR 110 2HG2 THR 110 7.287 12.521 6.453
836 3HG2 THR 110 3HG2 THR 110 6.145 13.119 5.251
837 H ARG 111 H ARG 111 7.099 11.733 2.925
838 HA ARG 111 HA ARG 111 7.620 9.186 1.535
839 1HB ARG 111 2HB ARG 111 6.917 11.201 0.187
840 2HB ARG 111 1HB ARG 111 8.456 11.936 0.619
841 1HG ARG 111 2HG ARG 111 9.615 10.012 -0.423
842 2HG ARG 111 1HG ARG 111 8.045 9.396 -0.943
843 1HD ARG 111 2HD ARG 111 9.041 10.582 -2.774
844 2HD ARG 111 1HD ARG 111 7.685 11.534 -2.166
845 HE ARG 111 HE ARG 111 9.879 12.494 -0.823
846 1HH1 ARG 111 1HH1 ARG 111 8.974 12.121 -4.190
847 2HH1 ARG 111 2HH1 ARG 111 9.926 13.476 -4.730
848 1HH2 ARG 111 1HH2 ARG 111 11.144 14.282 -1.542
849 2HH2 ARG 111 2HH2 ARG 111 11.158 14.689 -3.228
850 H ILE 112 H ILE 112 9.544 8.226 1.629
851 HA ILE 112 HA ILE 112 11.592 9.268 3.377
852 HB ILE 112 HB ILE 112 11.506 6.761 1.692
853 1HG1 ILE 112 2HG1 ILE 112 9.796 7.002 3.541
854 2HG1 ILE 112 1HG1 ILE 112 10.842 5.600 3.667
855 1HG2 ILE 112 1HG2 ILE 112 13.422 7.512 3.893
856 2HG2 ILE 112 2HG2 ILE 112 13.807 7.394 2.175
857 3HG2 ILE 112 3HG2 ILE 112 13.351 5.950 3.079
858 1HD1 ILE 112 1HD1 ILE 112 10.568 6.585 5.834
859 2HD1 ILE 112 2HD1 ILE 112 11.063 8.163 5.226
860 3HD1 ILE 112 3HD1 ILE 112 12.228 6.840 5.303
861 H GLU 113 H GLU 113 13.813 9.533 2.670
862 HA GLU 113 HA GLU 113 13.967 11.017 0.225
863 1HB GLU 113 2HB GLU 113 16.223 10.203 2.038
864 2HB GLU 113 1HB GLU 113 16.249 11.491 0.847
865 1HG GLU 113 2HG GLU 113 14.605 12.737 2.139
866 2HG GLU 113 1HG GLU 113 14.540 11.431 3.323
867 H SER 114 H SER 114 13.467 9.383 -1.279
868 HA SER 114 HA SER 114 15.221 7.149 -1.675
869 1HB SER 114 2HB SER 114 13.119 8.314 -3.522
870 2HB SER 114 1HB SER 114 13.888 6.737 -3.693
871 HG SER 114 HG SER 114 12.915 6.091 -1.772
872 H LYS 115 H LYS 115 17.285 7.927 -1.979
873 HA LYS 115 HA LYS 115 17.695 9.798 -4.202
874 1HB LYS 115 2HB LYS 115 19.901 10.223 -3.297
875 2HB LYS 115 1HB LYS 115 18.712 10.393 -2.012
876 1HG LYS 115 2HG LYS 115 19.285 8.228 -1.135
877 2HG LYS 115 1HG LYS 115 20.395 7.940 -2.476
878 1HD LYS 115 2HD LYS 115 21.674 9.964 -1.735
879 2HD LYS 115 1HD LYS 115 20.642 10.017 -0.304
880 1HE LYS 115 2HE LYS 115 21.392 7.783 0.327
881 2HE LYS 115 1HE LYS 115 22.391 7.701 -1.123
882 1HZ LYS 115 1HZ LYS 115 22.736 9.540 1.178
883 2HZ LYS 115 2HZ LYS 115 23.604 9.671 -0.271
884 3HZ LYS 115 3HZ LYS 115 23.776 8.288 0.695
885 H THR 116 H THR 116 17.337 6.705 -3.921
886 HA THR 116 HA THR 116 19.721 5.673 -5.130
887 HB THR 116 HB THR 116 18.278 3.574 -5.348
888 HG1 THR 116 1HG THR 116 16.230 3.800 -4.893
889 1HG2 THR 116 1HG2 THR 116 18.389 3.100 -2.937
890 2HG2 THR 116 2HG2 THR 116 18.666 4.813 -2.622
891 3HG2 THR 116 3HG2 THR 116 19.862 3.877 -3.520
892 H GLY 117 H GLY 117 17.076 7.308 -6.250
893 1HA GLY 117 2HA GLY 117 16.361 7.869 -8.351
894 2HA GLY 117 1HA GLY 117 17.828 7.116 -8.958
895 H ARG 118 H ARG 118 16.862 6.166 -10.686
896 HA ARG 118 HA ARG 118 15.263 3.797 -10.081
897 1HB ARG 118 2HB ARG 118 13.558 5.374 -10.620
898 2HB ARG 118 1HB ARG 118 14.475 6.007 -11.977
899 1HG ARG 118 2HG ARG 118 13.918 3.178 -12.274
900 2HG ARG 118 1HG ARG 118 12.447 4.134 -12.080
901 1HD ARG 118 2HD ARG 118 14.636 4.603 -14.107
902 2HD ARG 118 1HD ARG 118 13.030 3.949 -14.432
903 HE ARG 118 HE ARG 118 12.171 6.166 -13.662
904 1HH1 ARG 118 1HH1 ARG 118 15.373 5.826 -15.030
905 2HH1 ARG 118 2HH1 ARG 118 15.505 7.516 -15.447
906 1HH2 ARG 118 1HH2 ARG 118 12.325 8.381 -14.253
907 2HH2 ARG 118 2HH2 ARG 118 13.784 8.953 -15.008
908 H GLU 119 H GLU 119 16.387 2.157 -10.896
909 HA GLU 119 HA GLU 119 18.082 2.543 -13.218
910 1HB GLU 119 2HB GLU 119 17.536 -0.074 -11.821
911 2HB GLU 119 1HB GLU 119 18.903 0.338 -12.840
912 1HG GLU 119 2HG GLU 119 19.934 0.535 -10.852
913 2HG GLU 119 1HG GLU 119 19.243 2.157 -10.909
914 H GLU 120 H GLU 120 17.605 1.938 -15.254
915 HA GLU 120 HA GLU 120 14.968 0.961 -15.851
916 1HB GLU 120 2HB GLU 120 17.355 1.449 -17.644
917 2HB GLU 120 1HB GLU 120 15.768 0.962 -18.218
918 1HG GLU 120 2HG GLU 120 15.924 3.285 -18.550
919 2HG GLU 120 1HG GLU 120 14.852 3.048 -17.173
920 H LYS 121 H LYS 121 18.145 -0.257 -16.880
921 HA LYS 121 HA LYS 121 19.032 -2.329 -17.067
922 1HB LYS 121 2HB LYS 121 17.107 -2.996 -14.839
923 2HB LYS 121 1HB LYS 121 18.511 -3.940 -15.309
924 1HG LYS 121 2HG LYS 121 19.982 -2.102 -14.685
925 2HG LYS 121 1HG LYS 121 18.581 -1.126 -14.242
926 1HD LYS 121 2HD LYS 121 19.502 -2.032 -12.235
927 2HD LYS 121 1HD LYS 121 17.991 -2.881 -12.561
928 1HE LYS 121 2HE LYS 121 19.197 -4.773 -13.452
929 2HE LYS 121 1HE LYS 121 20.728 -3.912 -13.290
930 1HZ LYS 121 1HZ LYS 121 20.519 -5.394 -11.460
931 2HZ LYS 121 2HZ LYS 121 18.956 -4.852 -11.097
932 3HZ LYS 121 3HZ LYS 121 20.281 -3.826 -10.856
933 H ASP 122 H ASP 122 16.367 -1.665 -18.441
934 HA ASP 122 HA ASP 122 16.083 -4.280 -19.648
935 1HB ASP 122 2HB ASP 122 14.388 -4.013 -17.682
936 2HB ASP 122 1HB ASP 122 13.554 -2.908 -18.771
937 H GLU 123 H GLU 123 14.333 -3.989 -21.524
938 HA GLU 123 HA GLU 123 15.198 -1.534 -22.887
939 1HB GLU 123 2HB GLU 123 14.523 -4.275 -23.936
940 2HB GLU 123 1HB GLU 123 14.595 -2.872 -24.991
941 1HG GLU 123 2HG GLU 123 16.676 -3.987 -25.154
942 2HG GLU 123 1HG GLU 123 16.944 -2.515 -24.225
943 H LYS 124 H LYS 124 13.590 -1.138 -24.874
944 HA LYS 124 HA LYS 124 10.823 -1.230 -23.906
945 1HB LYS 124 2HB LYS 124 12.292 1.234 -24.872
946 2HB LYS 124 1HB LYS 124 10.549 1.146 -24.685
947 1HG LYS 124 2HG LYS 124 10.871 0.687 -22.277
948 2HG LYS 124 1HG LYS 124 12.607 0.907 -22.503
949 1HD LYS 124 2HD LYS 124 11.575 2.946 -21.645
950 2HD LYS 124 1HD LYS 124 12.224 3.202 -23.267
951 1HE LYS 124 2HE LYS 124 9.991 2.949 -24.213
952 2HE LYS 124 1HE LYS 124 9.331 2.634 -22.609
953 1HZ LYS 124 1HZ LYS 124 9.965 4.859 -21.936
954 2HZ LYS 124 2HZ LYS 124 8.960 4.921 -23.302
955 3HZ LYS 124 3HZ LYS 124 10.633 5.168 -23.465
956 H SER 125 H SER 125 9.654 0.178 -25.916
957 HA SER 125 HA SER 125 8.967 0.177 -28.079
958 1HB SER 125 2HB SER 125 11.822 -0.626 -28.694
959 2HB SER 125 1HB SER 125 10.666 0.073 -29.827
960 HG SER 125 HG SER 125 10.668 1.966 -28.579
961 H LYS 126 H LYS 126 8.525 -2.206 -26.588
962 HA LYS 126 HA LYS 126 9.054 -4.392 -28.406
963 1HB LYS 126 2HB LYS 126 9.082 -4.827 -25.989
964 2HB LYS 126 1HB LYS 126 7.397 -4.330 -25.877
965 1HG LYS 126 2HG LYS 126 6.775 -6.191 -27.365
966 2HG LYS 126 1HG LYS 126 8.464 -6.705 -27.394
967 1HD LYS 126 2HD LYS 126 8.414 -7.120 -25.014
968 2HD LYS 126 1HD LYS 126 6.771 -6.483 -24.904
969 1HE LYS 126 2HE LYS 126 5.995 -8.280 -26.391
970 2HE LYS 126 1HE LYS 126 7.632 -8.926 -26.452
971 1HZ LYS 126 1HZ LYS 126 6.086 -8.630 -23.935
972 2HZ LYS 126 2HZ LYS 126 7.542 -9.472 -24.158
973 3HZ LYS 126 3HZ LYS 126 6.111 -10.052 -24.856
974 H SER 127 H SER 127 7.986 -3.792 -30.280
975 HA SER 127 HA SER 127 5.121 -4.310 -30.193
976 1HB SER 127 2HB SER 127 4.711 -2.403 -31.779
977 2HB SER 127 1HB SER 127 5.188 -1.896 -30.160
978 HG SER 127 HG SER 127 6.254 -0.954 -32.182
979 H LEU 128 H LEU 128 4.498 -5.635 -31.782
980 HA LEU 128 HA LEU 128 6.077 -5.793 -34.237
981 1HB LEU 128 2HB LEU 128 6.927 -7.550 -32.727
982 2HB LEU 128 1HB LEU 128 5.305 -8.198 -32.579
983 HG LEU 128 HG LEU 128 5.313 -8.716 -34.998
984 1HD1 LEU 128 1HD1 LEU 128 7.406 -8.600 -36.246
985 2HD1 LEU 128 2HD1 LEU 128 8.187 -7.820 -34.869
986 3HD1 LEU 128 3HD1 LEU 128 6.884 -6.997 -35.724
987 1HD2 LEU 128 1HD2 LEU 128 6.876 -10.583 -34.867
988 2HD2 LEU 128 2HD2 LEU 128 5.962 -10.406 -33.367
989 3HD2 LEU 128 3HD2 LEU 128 7.636 -9.853 -33.453
990 H GLU 129 H GLU 129 4.882 -6.360 -36.040
991 HA GLU 129 HA GLU 129 1.976 -6.522 -35.583
992 1HB GLU 129 2HB GLU 129 3.437 -5.227 -37.885
993 2HB GLU 129 1HB GLU 129 1.692 -5.333 -37.711
994 1HG GLU 129 2HG GLU 129 1.807 -3.953 -35.709
995 2HG GLU 129 1HG GLU 129 3.560 -3.850 -35.877
996 H HIS 130 H HIS 130 0.776 -7.890 -36.805
997 HA HIS 130 HA HIS 130 2.041 -9.340 -39.009
998 1HB HIS 130 2HB HIS 130 0.622 -10.672 -36.688
999 2HB HIS 130 1HB HIS 130 0.894 -11.463 -38.234
1000 HD1 HIS 130 1HD HIS 130 3.523 -11.687 -38.917
1001 HD2 HIS 130 2HD HIS 130 2.652 -10.960 -34.916
1002 HE1 HIS 130 1HE HIS 130 5.582 -12.358 -37.639
1003 HE2 HIS 130 2HE HIS 130 4.932 -12.151 -35.214
1004 H HIS 131 H HIS 131 0.702 -7.682 -40.073
1005 HA HIS 131 HA HIS 131 -1.973 -8.724 -40.544
1006 1HB HIS 131 2HB HIS 131 -3.094 -6.587 -40.216
1007 2HB HIS 131 1HB HIS 131 -2.315 -7.101 -38.728
1008 HD1 HIS 131 1HD HIS 131 -2.727 -4.229 -40.841
1009 HD2 HIS 131 2HD HIS 131 0.257 -5.662 -38.325
1010 HE1 HIS 131 1HE HIS 131 -1.279 -2.243 -40.307
1011 HE2 HIS 131 2HE HIS 131 0.389 -3.090 -38.616
1012 H HIS 132 H HIS 132 -2.961 -7.920 -42.454
1013 HA HIS 132 HA HIS 132 -1.480 -6.142 -44.178
1014 1HB HIS 132 2HB HIS 132 -1.098 -7.682 -45.991
1015 2HB HIS 132 1HB HIS 132 -0.352 -8.333 -44.541
1016 HD1 HIS 132 1HD HIS 132 -2.370 -9.297 -47.307
1017 HD2 HIS 132 2HD HIS 132 -2.142 -10.424 -43.309
1018 HE1 HIS 132 1HE HIS 132 -3.524 -11.532 -47.163
1019 HE2 HIS 132 2HE HIS 132 -3.191 -12.282 -44.781
1020 H HIS 133 H HIS 133 -4.270 -7.634 -43.133
1021 HA HIS 133 HA HIS 133 -6.467 -7.328 -43.552
1022 1HB HIS 133 2HB HIS 133 -5.774 -4.933 -43.987
1023 2HB HIS 133 1HB HIS 133 -5.696 -5.342 -45.696
1024 HD1 HIS 133 1HD HIS 133 -8.149 -4.981 -42.867
1025 HD2 HIS 133 2HD HIS 133 -8.117 -5.353 -47.009
1026 HE1 HIS 133 1HE HIS 133 -10.511 -4.528 -43.609
1027 HE2 HIS 133 2HE HIS 133 -10.411 -4.550 -46.129
1028 H HIS 134 H HIS 134 -5.321 -6.705 -46.842
1029 HA HIS 134 HA HIS 134 -5.648 -9.346 -47.798
1030 1HB HIS 134 2HB HIS 134 -8.012 -7.548 -47.979
1031 2HB HIS 134 1HB HIS 134 -7.604 -8.461 -49.427
1032 HD1 HIS 134 1HD HIS 134 -9.982 -8.735 -47.032
1033 HD2 HIS 134 2HD HIS 134 -6.967 -11.364 -48.187
1034 HE1 HIS 134 1HE HIS 134 -10.741 -11.017 -46.287
1035 HE2 HIS 134 2HE HIS 134 -8.855 -12.576 -46.886
1036 H HIS 135 H HIS 135 -6.042 -5.950 -48.763
1037 HA HIS 135 HA HIS 135 -3.691 -6.092 -50.394
1038 1HB HIS 135 2HB HIS 135 -4.781 -5.348 -52.487
1039 2HB HIS 135 1HB HIS 135 -5.266 -6.972 -52.021
1040 HD1 HIS 135 1HD HIS 135 -7.716 -7.380 -51.562
1041 HD2 HIS 135 2HD HIS 135 -6.827 -3.377 -52.270
1042 HE1 HIS 135 1HE HIS 135 -9.935 -6.234 -51.862
1043 HE2 HIS 135 2HE HIS 135 -9.365 -3.858 -52.472
Start of MODEL 5
1 1H MET 1 1HT MET 1 24.952 30.114 -8.624
2 2H MET 1 2HT MET 1 25.359 28.581 -9.231
3 3H MET 1 3HT MET 1 25.778 29.006 -7.646
4 HA MET 1 HA MET 1 23.517 29.063 -6.966
5 1HB MET 1 2HB MET 1 22.914 28.358 -9.848
6 2HB MET 1 1HB MET 1 21.732 28.363 -8.546
7 1HG MET 1 2HG MET 1 22.078 30.754 -8.231
8 2HG MET 1 1HG MET 1 23.281 30.753 -9.520
9 1HE MET 1 1HE MET 1 18.778 29.943 -10.139
10 2HE MET 1 2HE MET 1 19.524 30.311 -8.584
11 3HE MET 1 3HE MET 1 19.854 28.771 -9.375
12 H ILE 2 H ILE 2 24.171 27.403 -5.673
13 HA ILE 2 HA ILE 2 24.461 24.748 -6.907
14 HB ILE 2 HB ILE 2 25.399 25.680 -4.186
15 1HG1 ILE 2 2HG1 ILE 2 26.978 25.128 -6.711
16 2HG1 ILE 2 1HG1 ILE 2 26.646 26.722 -6.049
17 1HG2 ILE 2 1HG2 ILE 2 26.615 23.555 -4.128
18 2HG2 ILE 2 2HG2 ILE 2 25.883 23.095 -5.665
19 3HG2 ILE 2 3HG2 ILE 2 24.873 23.308 -4.234
20 1HD1 ILE 2 1HD1 ILE 2 27.917 26.130 -4.032
21 2HD1 ILE 2 2HD1 ILE 2 28.890 26.049 -5.502
22 3HD1 ILE 2 3HD1 ILE 2 28.297 24.565 -4.757
23 H MET 3 H MET 3 22.600 23.722 -6.896
24 HA MET 3 HA MET 3 20.767 22.615 -6.194
25 1HB MET 3 2HB MET 3 21.860 23.143 -3.424
26 2HB MET 3 1HB MET 3 20.531 22.050 -3.794
27 1HG MET 3 2HG MET 3 22.028 20.671 -5.134
28 2HG MET 3 1HG MET 3 23.359 21.773 -4.791
29 1HE MET 3 1HE MET 3 22.617 22.454 -1.675
30 2HE MET 3 2HE MET 3 24.247 22.236 -2.309
31 3HE MET 3 3HE MET 3 23.725 21.324 -0.895
32 H VAL 4 H VAL 4 19.426 24.230 -7.054
33 HA VAL 4 HA VAL 4 18.323 26.147 -5.124
34 HB VAL 4 HB VAL 4 19.033 27.070 -7.295
35 1HG1 VAL 4 1HG1 VAL 4 17.822 26.527 -9.349
36 2HG1 VAL 4 2HG1 VAL 4 16.921 25.281 -8.485
37 3HG1 VAL 4 3HG1 VAL 4 18.664 25.123 -8.694
38 1HG2 VAL 4 1HG2 VAL 4 16.977 28.286 -7.849
39 2HG2 VAL 4 2HG2 VAL 4 17.233 28.183 -6.108
40 3HG2 VAL 4 3HG2 VAL 4 16.043 27.141 -6.889
41 H SER 5 H SER 5 17.623 23.275 -6.912
42 HA SER 5 HA SER 5 15.999 21.712 -6.719
43 1HB SER 5 2HB SER 5 15.117 23.325 -4.316
44 2HB SER 5 1HB SER 5 14.648 21.664 -4.678
45 HG SER 5 HG SER 5 16.445 21.011 -3.823
46 H GLY 6 H GLY 6 13.409 21.588 -6.317
47 1HA GLY 6 2HA GLY 6 12.284 23.424 -8.277
48 2HA GLY 6 1HA GLY 6 11.507 21.987 -7.623
49 H CYS 7 H CYS 7 10.728 24.920 -7.885
50 HA CYS 7 HA CYS 7 10.383 25.691 -5.103
51 1HB CYS 7 2HB CYS 7 9.383 27.754 -6.087
52 2HB CYS 7 1HB CYS 7 11.026 27.440 -6.639
53 HG CYS 7 HG CYS 7 8.129 27.373 -8.378
54 H GLN 8 H GLN 8 8.946 23.434 -6.647
55 HA GLN 8 HA GLN 8 6.940 22.397 -6.633
56 1HB GLN 8 2HB GLN 8 6.366 24.517 -4.579
57 2HB GLN 8 1HB GLN 8 5.106 23.424 -5.127
58 1HG GLN 8 2HG GLN 8 6.076 22.631 -3.063
59 2HG GLN 8 1HG GLN 8 6.429 21.511 -4.375
60 1HE2 GLN 8 1HE2 GLN 8 8.534 21.230 -5.043
61 2HE2 GLN 8 2HE2 GLN 8 9.887 21.862 -4.167
62 H GLN 9 H GLN 9 4.611 22.685 -7.258
63 HA GLN 9 HA GLN 9 2.966 23.485 -8.614
64 1HB GLN 9 2HB GLN 9 4.377 26.138 -8.261
65 2HB GLN 9 1HB GLN 9 2.798 25.929 -9.002
66 1HG GLN 9 2HG GLN 9 1.872 25.147 -6.925
67 2HG GLN 9 1HG GLN 9 3.460 25.186 -6.162
68 1HE2 GLN 9 1HE2 GLN 9 2.771 26.615 -4.572
69 2HE2 GLN 9 2HE2 GLN 9 2.459 28.284 -4.902
70 H GLN 10 H GLN 10 5.848 22.809 -9.555
71 HA GLN 10 HA GLN 10 5.753 24.129 -12.171
72 1HB GLN 10 2HB GLN 10 7.815 24.501 -10.897
73 2HB GLN 10 1HB GLN 10 8.060 22.765 -10.772
74 1HG GLN 10 2HG GLN 10 8.399 22.594 -13.148
75 2HG GLN 10 1HG GLN 10 8.004 24.301 -13.359
76 1HE2 GLN 10 1HE2 GLN 10 10.365 22.027 -12.183
77 2HE2 GLN 10 2HE2 GLN 10 11.683 23.137 -12.105
78 H LYS 11 H LYS 11 5.621 23.006 -14.012
79 HA LYS 11 HA LYS 11 4.793 20.233 -13.871
80 1HB LYS 11 2HB LYS 11 3.892 22.162 -15.388
81 2HB LYS 11 1HB LYS 11 5.277 21.785 -16.400
82 1HG LYS 11 2HG LYS 11 3.452 20.617 -17.311
83 2HG LYS 11 1HG LYS 11 4.422 19.410 -16.466
84 1HD LYS 11 2HD LYS 11 2.902 19.281 -14.677
85 2HD LYS 11 1HD LYS 11 2.107 20.787 -15.137
86 1HE LYS 11 2HE LYS 11 2.038 18.209 -16.698
87 2HE LYS 11 1HE LYS 11 0.734 18.835 -15.689
88 1HZ LYS 11 1HZ LYS 11 0.677 20.813 -17.149
89 2HZ LYS 11 2HZ LYS 11 0.293 19.381 -17.969
90 3HZ LYS 11 3HZ LYS 11 1.825 20.083 -18.161
91 H GLU 12 H GLU 12 6.994 19.612 -13.011
92 HA GLU 12 HA GLU 12 9.181 19.893 -14.892
93 1HB GLU 12 2HB GLU 12 9.486 20.389 -12.475
94 2HB GLU 12 1HB GLU 12 9.247 18.681 -12.133
95 1HG GLU 12 2HG GLU 12 11.226 18.087 -13.311
96 2HG GLU 12 1HG GLU 12 11.410 19.724 -13.939
97 H GLU 13 H GLU 13 8.673 17.035 -12.818
98 HA GLU 13 HA GLU 13 8.349 15.191 -14.946
99 1HB GLU 13 2HB GLU 13 10.657 16.226 -15.349
100 2HB GLU 13 1HB GLU 13 11.175 15.388 -13.899
101 1HG GLU 13 2HG GLU 13 9.885 13.532 -15.646
102 2HG GLU 13 1HG GLU 13 11.116 14.428 -16.532
103 H THR 14 H THR 14 9.196 12.925 -14.143
104 HA THR 14 HA THR 14 9.403 11.253 -12.677
105 HB THR 14 HB THR 14 9.817 13.576 -10.877
106 HG1 THR 14 1HG THR 14 11.335 12.386 -12.567
107 1HG2 THR 14 1HG2 THR 14 10.545 12.020 -9.103
108 2HG2 THR 14 2HG2 THR 14 9.997 10.663 -10.089
109 3HG2 THR 14 3HG2 THR 14 8.831 11.833 -9.467
110 HA PRO 15 HA PRO 15 5.138 10.531 -11.528
111 1HB PRO 15 2HB PRO 15 5.727 8.139 -10.245
112 2HB PRO 15 1HB PRO 15 5.335 8.306 -11.953
113 1HG PRO 15 2HG PRO 15 7.985 8.026 -10.633
114 2HG PRO 15 1HG PRO 15 7.434 7.399 -12.197
115 1HD PRO 15 2HD PRO 15 9.061 9.543 -11.996
116 2HD PRO 15 1HD PRO 15 7.846 9.393 -13.282
117 H PHE 16 H PHE 16 4.202 11.453 -9.828
118 HA PHE 16 HA PHE 16 5.657 12.326 -7.595
119 1HB PHE 16 2HB PHE 16 3.526 13.159 -6.739
120 2HB PHE 16 1HB PHE 16 3.690 13.517 -8.452
121 HD1 PHE 16 2HD PHE 16 2.380 12.199 -10.114
122 HD2 PHE 16 1HD PHE 16 1.758 11.820 -5.917
123 HE1 PHE 16 2HE PHE 16 0.194 11.154 -10.532
124 HE2 PHE 16 1HE PHE 16 -0.427 10.771 -6.334
125 HZ PHE 16 HZ PHE 16 -1.211 10.436 -8.642
126 H TYR 17 H TYR 17 3.888 9.364 -8.109
127 HA TYR 17 HA TYR 17 3.659 8.878 -5.256
128 1HB TYR 17 2HB TYR 17 2.226 7.073 -5.809
129 2HB TYR 17 1HB TYR 17 1.787 8.393 -6.877
130 HD1 TYR 17 2HD TYR 17 2.389 8.280 -9.287
131 HD2 TYR 17 1HD TYR 17 3.092 5.007 -6.656
132 HE1 TYR 17 2HE TYR 17 2.666 6.784 -11.224
133 HE2 TYR 17 1HE TYR 17 3.370 3.507 -8.580
134 HH TYR 17 HH TYR 17 2.811 3.338 -10.879
135 H TYR 18 H TYR 18 5.964 8.317 -7.621
136 HA TYR 18 HA TYR 18 6.655 5.624 -6.965
137 1HB TYR 18 2HB TYR 18 7.199 6.605 -9.152
138 2HB TYR 18 1HB TYR 18 8.302 7.734 -8.372
139 HD1 TYR 18 2HD TYR 18 7.708 4.113 -8.964
140 HD2 TYR 18 1HD TYR 18 10.533 7.131 -7.959
141 HE1 TYR 18 2HE TYR 18 9.523 2.469 -9.162
142 HE2 TYR 18 1HE TYR 18 12.359 5.495 -8.154
143 HH TYR 18 HH TYR 18 11.916 2.404 -9.566
144 H GLY 19 H GLY 19 7.954 4.851 -5.428
145 1HA GLY 19 2HA GLY 19 10.182 5.352 -4.296
146 2HA GLY 19 1HA GLY 19 9.372 6.808 -3.739
147 H THR 20 H THR 20 10.009 5.919 -1.627
148 HA THR 20 HA THR 20 8.098 3.900 -0.675
149 HB THR 20 HB THR 20 10.766 4.688 0.528
150 HG1 THR 20 1HG THR 20 10.155 2.122 -0.473
151 1HG2 THR 20 1HG2 THR 20 10.421 2.817 2.054
152 2HG2 THR 20 2HG2 THR 20 8.848 2.491 1.324
153 3HG2 THR 20 3HG2 THR 20 9.113 3.988 2.219
154 H TRP 21 H TRP 21 6.599 4.533 0.723
155 HA TRP 21 HA TRP 21 6.872 7.193 1.969
156 1HB TRP 21 2HB TRP 21 4.301 5.787 1.196
157 2HB TRP 21 1HB TRP 21 4.464 7.435 1.791
158 HD1 TRP 21 HD TRP 21 5.397 5.336 -1.325
159 HE1 TRP 21 1HE TRP 21 5.451 6.900 -3.370
160 HE3 TRP 21 3HE TRP 21 4.531 9.778 1.044
161 HZ2 TRP 21 2HZ TRP 21 5.154 9.654 -3.901
162 HZ3 TRP 21 3HZ TRP 21 4.423 11.831 -0.306
163 HH2 TRP 21 HH TRP 21 4.728 11.768 -2.729
164 H ASP 22 H ASP 22 6.030 7.404 4.114
165 HA ASP 22 HA ASP 22 6.112 4.898 5.603
166 1HB ASP 22 2HB ASP 22 7.402 6.897 6.390
167 2HB ASP 22 1HB ASP 22 5.875 7.718 6.678
168 H GLU 23 H GLU 23 4.390 3.949 6.483
169 HA GLU 23 HA GLU 23 1.848 4.357 5.492
170 1HB GLU 23 2HB GLU 23 3.064 2.755 7.635
171 2HB GLU 23 1HB GLU 23 1.350 3.077 7.851
172 1HG GLU 23 2HG GLU 23 2.377 2.044 5.245
173 2HG GLU 23 1HG GLU 23 2.100 0.948 6.600
174 H GLY 24 H GLY 24 3.067 5.305 8.708
175 1HA GLY 24 2HA GLY 24 2.148 6.659 10.324
176 2HA GLY 24 1HA GLY 24 1.447 7.564 8.990
177 H ARG 25 H ARG 25 0.826 4.204 9.772
178 HA ARG 25 HA ARG 25 -2.028 4.784 9.929
179 1HB ARG 25 2HB ARG 25 -1.147 3.120 8.272
180 2HB ARG 25 1HB ARG 25 -0.588 2.139 9.613
181 1HG ARG 25 2HG ARG 25 -2.542 1.082 9.335
182 2HG ARG 25 1HG ARG 25 -3.202 2.437 10.256
183 1HD ARG 25 2HD ARG 25 -4.471 1.958 8.182
184 2HD ARG 25 1HD ARG 25 -3.799 3.589 8.225
185 HE ARG 25 HE ARG 25 -1.890 2.139 6.921
186 1HH1 ARG 25 1HH1 ARG 25 -5.351 2.418 6.431
187 2HH1 ARG 25 2HH1 ARG 25 -5.232 2.360 4.704
188 1HH2 ARG 25 1HH2 ARG 25 -1.712 2.088 4.671
189 2HH2 ARG 25 2HH2 ARG 25 -3.151 2.163 3.693
190 H ALA 26 H ALA 26 -3.231 3.991 11.640
191 HA ALA 26 HA ALA 26 -1.704 3.030 13.968
192 1HB ALA 26 1HB ALA 26 -3.286 4.159 15.429
193 2HB ALA 26 2HB ALA 26 -4.191 4.734 14.029
194 3HB ALA 26 3HB ALA 26 -2.548 5.306 14.310
195 HA PRO 27 HA PRO 27 -4.843 -0.235 13.500
196 1HB PRO 27 2HB PRO 27 -3.268 -2.212 12.598
197 2HB PRO 27 1HB PRO 27 -3.902 -0.978 11.504
198 1HG PRO 27 2HG PRO 27 -1.155 -1.386 12.465
199 2HG PRO 27 1HG PRO 27 -1.728 -0.480 11.057
200 1HD PRO 27 2HD PRO 27 -1.008 0.512 13.695
201 2HD PRO 27 1HD PRO 27 -1.391 1.432 12.226
202 H GLY 28 H GLY 28 -4.265 -2.748 14.327
203 1HA GLY 28 2HA GLY 28 -3.012 -2.397 16.929
204 2HA GLY 28 1HA GLY 28 -3.953 -3.789 16.409
205 HA PRO 29 HA PRO 29 0.662 -4.611 15.950
206 1HB PRO 29 2HB PRO 29 0.957 -6.395 17.949
207 2HB PRO 29 1HB PRO 29 1.102 -4.650 18.215
208 1HG PRO 29 2HG PRO 29 -1.240 -6.448 18.750
209 2HG PRO 29 1HG PRO 29 -0.568 -5.155 19.762
210 1HD PRO 29 2HD PRO 29 -2.766 -4.797 18.169
211 2HD PRO 29 1HD PRO 29 -1.628 -3.493 18.565
212 H THR 30 H THR 30 1.112 -6.097 14.459
213 HA THR 30 HA THR 30 -0.597 -8.392 14.048
214 HB THR 30 HB THR 30 1.242 -8.807 12.237
215 HG1 THR 30 1HG THR 30 2.011 -6.485 11.718
216 1HG2 THR 30 1HG2 THR 30 -1.044 -8.084 11.740
217 2HG2 THR 30 2HG2 THR 30 0.118 -7.232 10.724
218 3HG2 THR 30 3HG2 THR 30 -0.602 -6.417 12.114
219 H ASP 31 H ASP 31 1.576 -7.797 16.245
220 HA ASP 31 HA ASP 31 2.866 -8.982 17.664
221 1HB ASP 31 2HB ASP 31 1.165 -10.738 17.559
222 2HB ASP 31 1HB ASP 31 1.921 -11.400 16.114
223 H GLY 32 H GLY 32 4.638 -7.913 16.820
224 1HA GLY 32 2HA GLY 32 6.969 -8.824 16.427
225 2HA GLY 32 1HA GLY 32 6.292 -9.475 14.940
226 H VAL 33 H VAL 33 4.649 -7.254 14.295
227 HA VAL 33 HA VAL 33 6.725 -5.417 13.347
228 HB VAL 33 HB VAL 33 3.850 -5.488 12.458
229 1HG1 VAL 33 1HG1 VAL 33 5.088 -3.492 11.873
230 2HG1 VAL 33 2HG1 VAL 33 4.705 -4.444 10.439
231 3HG1 VAL 33 3HG1 VAL 33 6.336 -4.478 11.111
232 1HG2 VAL 33 1HG2 VAL 33 4.544 -6.903 10.583
233 2HG2 VAL 33 2HG2 VAL 33 4.781 -7.721 12.127
234 3HG2 VAL 33 3HG2 VAL 33 6.161 -7.027 11.276
235 H LYS 34 H LYS 34 6.753 -3.288 13.880
236 HA LYS 34 HA LYS 34 4.895 -2.355 15.909
237 1HB LYS 34 2HB LYS 34 7.276 -0.998 14.646
238 2HB LYS 34 1HB LYS 34 6.373 -0.405 16.019
239 1HG LYS 34 2HG LYS 34 7.095 -2.325 17.340
240 2HG LYS 34 1HG LYS 34 8.013 -2.919 15.953
241 1HD LYS 34 2HD LYS 34 9.319 -0.832 15.951
242 2HD LYS 34 1HD LYS 34 8.429 -0.292 17.373
243 1HE LYS 34 2HE LYS 34 9.283 -2.208 18.632
244 2HE LYS 34 1HE LYS 34 10.180 -2.739 17.208
245 1HZ LYS 34 1HZ LYS 34 11.611 -1.533 18.710
246 2HZ LYS 34 2HZ LYS 34 10.575 -0.185 18.672
247 3HZ LYS 34 3HZ LYS 34 11.417 -0.647 17.274
248 H SER 35 H SER 35 5.776 -1.818 12.610
249 HA SER 35 HA SER 35 3.500 -0.285 11.903
250 1HB SER 35 2HB SER 35 6.124 1.224 12.171
251 2HB SER 35 1HB SER 35 4.673 1.851 11.393
252 HG SER 35 HG SER 35 4.125 0.941 13.883
253 H ALA 36 H ALA 36 3.949 0.676 9.567
254 HA ALA 36 HA ALA 36 5.841 -1.089 8.184
255 1HB ALA 36 1HB ALA 36 2.949 -0.740 7.396
256 2HB ALA 36 2HB ALA 36 3.654 -2.178 8.136
257 3HB ALA 36 3HB ALA 36 4.162 -1.677 6.524
258 H THR 37 H THR 37 6.247 -0.467 5.966
259 HA THR 37 HA THR 37 5.534 2.311 5.314
260 HB THR 37 HB THR 37 7.736 2.461 4.100
261 HG1 THR 37 1HG THR 37 9.218 0.753 5.411
262 1HG2 THR 37 1HG2 THR 37 7.873 2.041 7.086
263 2HG2 THR 37 2HG2 THR 37 7.454 3.539 6.258
264 3HG2 THR 37 3HG2 THR 37 9.083 2.882 6.117
265 H VAL 38 H VAL 38 5.426 2.690 2.958
266 HA VAL 38 HA VAL 38 4.886 0.173 1.528
267 HB VAL 38 HB VAL 38 2.768 1.254 2.038
268 1HG1 VAL 38 1HG1 VAL 38 3.523 3.553 2.273
269 2HG1 VAL 38 2HG1 VAL 38 2.195 3.449 1.117
270 3HG1 VAL 38 3HG1 VAL 38 3.853 3.637 0.544
271 1HG2 VAL 38 1HG2 VAL 38 1.876 1.481 -0.240
272 2HG2 VAL 38 2HG2 VAL 38 2.907 0.062 -0.057
273 3HG2 VAL 38 3HG2 VAL 38 3.524 1.504 -0.865
274 H THR 39 H THR 39 6.009 -0.140 -0.246
275 HA THR 39 HA THR 39 7.354 2.170 -1.478
276 HB THR 39 HB THR 39 8.083 -0.771 -1.635
277 HG1 THR 39 1HG THR 39 8.671 -0.019 0.374
278 1HG2 THR 39 1HG2 THR 39 9.525 1.668 -2.688
279 2HG2 THR 39 2HG2 THR 39 8.704 0.451 -3.663
280 3HG2 THR 39 3HG2 THR 39 10.134 0.011 -2.728
281 H PHE 40 H PHE 40 6.600 2.824 -3.379
282 HA PHE 40 HA PHE 40 4.888 0.992 -4.908
283 1HB PHE 40 2HB PHE 40 5.204 3.998 -5.001
284 2HB PHE 40 1HB PHE 40 4.247 3.088 -6.165
285 HD1 PHE 40 1HD PHE 40 2.268 1.785 -5.349
286 HD2 PHE 40 2HD PHE 40 4.329 4.593 -2.904
287 HE1 PHE 40 1HE PHE 40 0.315 1.917 -3.860
288 HE2 PHE 40 2HE PHE 40 2.379 4.725 -1.405
289 HZ PHE 40 HZ PHE 40 0.369 3.386 -1.883
290 H THR 41 H THR 41 5.772 -0.028 -6.523
291 HA THR 41 HA THR 41 8.174 1.083 -7.794
292 HB THR 41 HB THR 41 7.180 -1.706 -8.300
293 HG1 THR 41 1HG THR 41 7.583 -0.800 -5.878
294 1HG2 THR 41 1HG2 THR 41 9.656 -2.148 -8.296
295 2HG2 THR 41 2HG2 THR 41 9.906 -0.411 -8.118
296 3HG2 THR 41 3HG2 THR 41 9.119 -1.047 -9.560
297 H GLU 42 H GLU 42 8.187 0.233 -10.272
298 HA GLU 42 HA GLU 42 6.380 1.945 -11.502
299 1HB GLU 42 2HB GLU 42 8.167 -0.187 -12.669
300 2HB GLU 42 1HB GLU 42 7.379 1.083 -13.584
301 1HG GLU 42 2HG GLU 42 8.583 2.771 -12.304
302 2HG GLU 42 1HG GLU 42 9.386 1.497 -11.391
303 H ASP 43 H ASP 43 6.318 -1.607 -11.193
304 HA ASP 43 HA ASP 43 3.627 -1.511 -12.408
305 1HB ASP 43 2HB ASP 43 5.772 -3.583 -12.896
306 2HB ASP 43 1HB ASP 43 4.094 -3.768 -13.392
307 H GLU 44 H GLU 44 5.329 -2.174 -9.685
308 HA GLU 44 HA GLU 44 3.263 -4.003 -8.728
309 1HB GLU 44 2HB GLU 44 5.003 -5.343 -7.544
310 2HB GLU 44 1HB GLU 44 5.058 -5.482 -9.293
311 1HG GLU 44 2HG GLU 44 6.826 -3.554 -7.840
312 2HG GLU 44 1HG GLU 44 7.260 -5.253 -7.998
313 H VAL 45 H VAL 45 3.041 -4.090 -6.438
314 HA VAL 45 HA VAL 45 4.122 -1.721 -5.055
315 HB VAL 45 HB VAL 45 1.597 -3.268 -4.410
316 1HG1 VAL 45 1HG1 VAL 45 2.617 -2.324 -2.425
317 2HG1 VAL 45 2HG1 VAL 45 1.142 -1.448 -2.834
318 3HG1 VAL 45 3HG1 VAL 45 2.717 -0.743 -3.202
319 1HG2 VAL 45 1HG2 VAL 45 1.935 -0.537 -5.644
320 2HG2 VAL 45 2HG2 VAL 45 0.404 -1.272 -5.170
321 3HG2 VAL 45 3HG2 VAL 45 1.360 -1.987 -6.466
322 H VAL 46 H VAL 46 5.321 -2.024 -3.256
323 HA VAL 46 HA VAL 46 5.499 -4.768 -2.185
324 HB VAL 46 HB VAL 46 7.757 -2.774 -2.389
325 1HG1 VAL 46 1HG1 VAL 46 7.942 -4.242 -0.443
326 2HG1 VAL 46 2HG1 VAL 46 9.178 -4.622 -1.644
327 3HG1 VAL 46 3HG1 VAL 46 7.756 -5.653 -1.486
328 1HG2 VAL 46 1HG2 VAL 46 7.165 -3.650 -4.587
329 2HG2 VAL 46 2HG2 VAL 46 7.272 -5.298 -3.968
330 3HG2 VAL 46 3HG2 VAL 46 8.720 -4.293 -4.055
331 H GLU 47 H GLU 47 4.935 -4.904 -0.122
332 HA GLU 47 HA GLU 47 4.940 -2.482 1.504
333 1HB GLU 47 2HB GLU 47 3.485 -5.083 1.675
334 2HB GLU 47 1HB GLU 47 3.717 -4.130 3.132
335 1HG GLU 47 2HG GLU 47 2.486 -2.338 2.301
336 2HG GLU 47 1HG GLU 47 2.575 -2.937 0.649
337 H THR 48 H THR 48 6.120 -2.231 3.253
338 HA THR 48 HA THR 48 8.002 -4.383 3.968
339 HB THR 48 HB THR 48 9.197 -2.040 4.804
340 HG1 THR 48 1HG THR 48 8.368 -0.502 3.617
341 1HG2 THR 48 1HG2 THR 48 9.595 -3.512 2.199
342 2HG2 THR 48 2HG2 THR 48 10.323 -3.932 3.749
343 3HG2 THR 48 3HG2 THR 48 10.759 -2.421 2.950
344 H GLU 49 H GLU 49 7.699 -5.136 5.961
345 HA GLU 49 HA GLU 49 6.271 -3.462 7.900
346 1HB GLU 49 2HB GLU 49 6.930 -6.402 8.059
347 2HB GLU 49 1HB GLU 49 5.872 -5.509 9.141
348 1HG GLU 49 2HG GLU 49 4.404 -5.043 7.161
349 2HG GLU 49 1HG GLU 49 5.409 -6.167 6.246
350 H VAL 50 H VAL 50 7.220 -2.707 9.713
351 HA VAL 50 HA VAL 50 10.103 -3.095 9.940
352 HB VAL 50 HB VAL 50 8.321 -1.252 11.543
353 1HG1 VAL 50 1HG1 VAL 50 10.443 -1.722 12.623
354 2HG1 VAL 50 2HG1 VAL 50 10.416 -0.059 12.037
355 3HG1 VAL 50 3HG1 VAL 50 11.312 -1.296 11.153
356 1HG2 VAL 50 1HG2 VAL 50 9.018 0.534 10.056
357 2HG2 VAL 50 2HG2 VAL 50 8.205 -0.739 9.145
358 3HG2 VAL 50 3HG2 VAL 50 9.962 -0.606 9.098
359 H MET 51 H MET 51 10.814 -4.688 11.103
360 HA MET 51 HA MET 51 9.386 -5.458 13.556
361 1HB MET 51 2HB MET 51 11.095 -7.064 11.661
362 2HB MET 51 1HB MET 51 10.511 -7.668 13.202
363 1HG MET 51 2HG MET 51 8.198 -7.364 12.418
364 2HG MET 51 1HG MET 51 8.824 -6.815 10.864
365 1HE MET 51 1HE MET 51 7.506 -8.586 9.462
366 2HE MET 51 2HE MET 51 6.720 -9.105 10.955
367 3HE MET 51 3HE MET 51 7.435 -10.300 9.872
368 H GLU 52 H GLU 52 10.532 -5.516 15.446
369 HA GLU 52 HA GLU 52 12.967 -4.031 15.540
370 1HB GLU 52 2HB GLU 52 11.280 -3.916 17.325
371 2HB GLU 52 1HB GLU 52 11.580 -5.603 17.719
372 1HG GLU 52 2HG GLU 52 13.804 -5.102 18.443
373 2HG GLU 52 1HG GLU 52 13.664 -3.439 17.875
374 H GLY 53 H GLY 53 15.010 -4.701 15.526
375 1HA GLY 53 2HA GLY 53 16.822 -6.128 15.936
376 2HA GLY 53 1HA GLY 53 15.695 -7.427 16.303
377 H ARG 54 H ARG 54 14.199 -6.872 13.806
378 HA ARG 54 HA ARG 54 15.859 -8.492 12.032
379 1HB ARG 54 2HB ARG 54 13.002 -7.612 11.606
380 2HB ARG 54 1HB ARG 54 13.833 -8.967 10.856
381 1HG ARG 54 2HG ARG 54 13.418 -8.876 13.809
382 2HG ARG 54 1HG ARG 54 12.140 -9.402 12.722
383 1HD ARG 54 2HD ARG 54 13.574 -11.150 11.835
384 2HD ARG 54 1HD ARG 54 14.914 -10.578 12.828
385 HE ARG 54 HE ARG 54 13.200 -11.107 14.734
386 1HH1 ARG 54 1HH1 ARG 54 13.734 -12.965 11.802
387 2HH1 ARG 54 2HH1 ARG 54 13.363 -14.493 12.560
388 1HH2 ARG 54 1HH2 ARG 54 12.713 -13.099 15.710
389 2HH2 ARG 54 2HH2 ARG 54 12.793 -14.568 14.779
390 H GLY 55 H GLY 55 13.644 -5.766 11.711
391 1HA GLY 55 2HA GLY 55 14.603 -3.683 10.658
392 2HA GLY 55 1HA GLY 55 15.241 -4.773 9.429
393 H GLU 56 H GLU 56 13.984 -3.551 7.856
394 HA GLU 56 HA GLU 56 11.114 -3.905 7.987
395 1HB GLU 56 2HB GLU 56 12.922 -2.651 5.916
396 2HB GLU 56 1HB GLU 56 11.175 -2.750 5.762
397 1HG GLU 56 2HG GLU 56 10.955 -1.461 7.852
398 2HG GLU 56 1HG GLU 56 12.704 -1.296 7.898
399 H VAL 57 H VAL 57 10.020 -5.445 7.075
400 HA VAL 57 HA VAL 57 11.492 -7.476 5.547
401 HB VAL 57 HB VAL 57 8.931 -7.643 7.140
402 1HG1 VAL 57 1HG1 VAL 57 8.949 -10.045 6.654
403 2HG1 VAL 57 2HG1 VAL 57 10.349 -9.825 5.607
404 3HG1 VAL 57 3HG1 VAL 57 8.803 -9.101 5.172
405 1HG2 VAL 57 1HG2 VAL 57 10.241 -9.180 8.560
406 2HG2 VAL 57 2HG2 VAL 57 10.911 -7.548 8.524
407 3HG2 VAL 57 3HG2 VAL 57 11.667 -8.831 7.581
408 H GLN 58 H GLN 58 11.084 -7.687 3.466
409 HA GLN 58 HA GLN 58 9.026 -6.049 2.254
410 1HB GLN 58 2HB GLN 58 11.207 -7.683 0.952
411 2HB GLN 58 1HB GLN 58 10.279 -6.382 0.233
412 1HG GLN 58 2HG GLN 58 11.308 -4.763 1.641
413 2HG GLN 58 1HG GLN 58 12.115 -6.018 2.575
414 1HE2 GLN 58 1HE2 GLN 58 13.223 -3.756 1.117
415 2HE2 GLN 58 2HE2 GLN 58 14.340 -4.423 -0.022
416 H LEU 59 H LEU 59 7.201 -6.857 1.436
417 HA LEU 59 HA LEU 59 6.801 -9.723 1.322
418 1HB LEU 59 2HB LEU 59 4.981 -7.411 0.649
419 2HB LEU 59 1HB LEU 59 4.505 -9.094 0.551
420 HG LEU 59 HG LEU 59 5.364 -7.685 3.073
421 1HD1 LEU 59 1HD1 LEU 59 3.014 -7.841 3.719
422 2HD1 LEU 59 2HD1 LEU 59 2.624 -8.525 2.140
423 3HD1 LEU 59 3HD1 LEU 59 3.216 -6.867 2.262
424 1HD2 LEU 59 1HD2 LEU 59 4.255 -10.450 2.620
425 2HD2 LEU 59 2HD2 LEU 59 4.549 -9.709 4.192
426 3HD2 LEU 59 3HD2 LEU 59 5.900 -10.053 3.114
427 HA PRO 60 HA PRO 60 7.674 -10.601 -2.907
428 1HB PRO 60 2HB PRO 60 4.864 -11.577 -3.091
429 2HB PRO 60 1HB PRO 60 6.370 -12.390 -3.532
430 1HG PRO 60 2HG PRO 60 5.054 -13.022 -1.291
431 2HG PRO 60 1HG PRO 60 6.825 -13.022 -1.360
432 1HD PRO 60 2HD PRO 60 4.984 -11.080 -0.061
433 2HD PRO 60 1HD PRO 60 6.640 -11.549 0.373
434 H PHE 61 H PHE 61 7.468 -9.622 -4.877
435 HA PHE 61 HA PHE 61 6.169 -7.145 -5.045
436 1HB PHE 61 2HB PHE 61 7.024 -8.852 -7.378
437 2HB PHE 61 1HB PHE 61 6.813 -7.112 -7.372
438 HD1 PHE 61 2HD PHE 61 8.453 -5.658 -6.345
439 HD2 PHE 61 1HD PHE 61 9.001 -9.873 -6.428
440 HE1 PHE 61 2HE PHE 61 10.820 -5.353 -5.766
441 HE2 PHE 61 1HE PHE 61 11.377 -9.575 -5.856
442 HZ PHE 61 HZ PHE 61 12.289 -7.313 -5.525
443 H MET 62 H MET 62 4.107 -6.718 -5.275
444 HA MET 62 HA MET 62 2.377 -8.707 -6.575
445 1HB MET 62 2HB MET 62 1.778 -6.647 -4.458
446 2HB MET 62 1HB MET 62 0.518 -7.511 -5.327
447 1HG MET 62 2HG MET 62 1.458 -9.642 -4.506
448 2HG MET 62 1HG MET 62 2.648 -8.731 -3.584
449 1HE MET 62 1HE MET 62 0.493 -6.911 -0.922
450 2HE MET 62 2HE MET 62 1.006 -6.267 -2.481
451 3HE MET 62 3HE MET 62 2.117 -7.244 -1.521
452 H ALA 63 H ALA 63 1.560 -8.200 -8.469
453 HA ALA 63 HA ALA 63 2.176 -5.679 -9.666
454 1HB ALA 63 1HB ALA 63 0.540 -7.977 -10.724
455 2HB ALA 63 2HB ALA 63 2.278 -7.759 -10.930
456 3HB ALA 63 3HB ALA 63 1.153 -6.619 -11.668
457 H TYR 64 H TYR 64 0.759 -4.128 -10.461
458 HA TYR 64 HA TYR 64 -2.037 -4.339 -9.595
459 1HB TYR 64 2HB TYR 64 -2.074 -2.030 -8.888
460 2HB TYR 64 1HB TYR 64 -0.777 -2.852 -8.033
461 HD1 TYR 64 1HD TYR 64 -1.586 -0.337 -10.586
462 HD2 TYR 64 2HD TYR 64 1.549 -2.254 -8.439
463 HE1 TYR 64 1HE TYR 64 -0.023 1.410 -11.326
464 HE2 TYR 64 2HE TYR 64 3.121 -0.505 -9.168
465 HH TYR 64 HH TYR 64 3.337 1.120 -11.024
466 H LYS 65 H LYS 65 -3.496 -2.955 -10.826
467 HA LYS 65 HA LYS 65 -2.433 -2.315 -13.504
468 1HB LYS 65 2HB LYS 65 -4.555 -2.996 -14.463
469 2HB LYS 65 1HB LYS 65 -3.897 -4.321 -13.512
470 1HG LYS 65 2HG LYS 65 -5.388 -3.484 -11.628
471 2HG LYS 65 1HG LYS 65 -6.194 -2.510 -12.854
472 1HD LYS 65 2HD LYS 65 -5.897 -5.510 -12.916
473 2HD LYS 65 1HD LYS 65 -7.359 -4.636 -12.465
474 1HE LYS 65 2HE LYS 65 -7.406 -3.632 -14.724
475 2HE LYS 65 1HE LYS 65 -6.003 -4.614 -15.158
476 1HZ LYS 65 1HZ LYS 65 -8.052 -5.649 -15.899
477 2HZ LYS 65 2HZ LYS 65 -8.658 -5.651 -14.314
478 3HZ LYS 65 3HZ LYS 65 -7.314 -6.605 -14.705
479 H VAL 66 H VAL 66 -3.205 -0.497 -14.504
480 HA VAL 66 HA VAL 66 -4.147 1.526 -12.610
481 HB VAL 66 HB VAL 66 -2.915 1.798 -15.356
482 1HG1 VAL 66 1HG1 VAL 66 -2.791 4.208 -14.865
483 2HG1 VAL 66 2HG1 VAL 66 -3.710 3.942 -13.384
484 3HG1 VAL 66 3HG1 VAL 66 -4.458 3.639 -14.952
485 1HG2 VAL 66 1HG2 VAL 66 -1.362 1.047 -13.626
486 2HG2 VAL 66 2HG2 VAL 66 -1.817 2.420 -12.616
487 3HG2 VAL 66 3HG2 VAL 66 -0.988 2.689 -14.150
488 H ILE 67 H ILE 67 -6.213 1.959 -12.536
489 HA ILE 67 HA ILE 67 -7.929 1.381 -14.836
490 HB ILE 67 HB ILE 67 -8.842 2.385 -12.148
491 1HG1 ILE 67 2HG1 ILE 67 -8.358 -0.488 -12.976
492 2HG1 ILE 67 1HG1 ILE 67 -7.434 0.405 -11.779
493 1HG2 ILE 67 1HG2 ILE 67 -10.484 2.451 -13.932
494 2HG2 ILE 67 2HG2 ILE 67 -10.911 1.199 -12.764
495 3HG2 ILE 67 3HG2 ILE 67 -10.175 0.754 -14.306
496 1HD1 ILE 67 1HD1 ILE 67 -9.001 -1.091 -10.710
497 2HD1 ILE 67 2HD1 ILE 67 -10.338 -0.340 -11.579
498 3HD1 ILE 67 3HD1 ILE 67 -9.435 0.589 -10.382
499 H SER 68 H SER 68 -7.303 4.022 -12.553
500 HA SER 68 HA SER 68 -8.005 5.926 -14.691
501 1HB SER 68 2HB SER 68 -8.429 6.454 -11.754
502 2HB SER 68 1HB SER 68 -9.026 7.394 -13.115
503 HG SER 68 HG SER 68 -9.989 4.976 -12.054
504 H GLN 69 H GLN 69 -6.894 7.990 -14.521
505 HA GLN 69 HA GLN 69 -4.387 7.975 -13.044
506 1HB GLN 69 2HB GLN 69 -3.867 6.614 -15.014
507 2HB GLN 69 1HB GLN 69 -4.469 7.886 -16.067
508 1HG GLN 69 2HG GLN 69 -2.672 9.367 -15.056
509 2HG GLN 69 1HG GLN 69 -1.994 7.889 -14.371
510 1HE2 GLN 69 1HE2 GLN 69 -1.042 6.376 -15.729
511 2HE2 GLN 69 2HE2 GLN 69 -0.625 6.753 -17.369
512 H SER 70 H SER 70 -3.463 9.968 -12.831
513 HA SER 70 HA SER 70 -4.270 12.134 -14.582
514 1HB SER 70 2HB SER 70 -5.834 12.244 -12.650
515 2HB SER 70 1HB SER 70 -4.455 12.325 -11.562
516 HG SER 70 HG SER 70 -5.584 14.278 -13.140
517 H THR 71 H THR 71 -2.643 13.697 -14.776
518 HA THR 71 HA THR 71 -0.014 12.932 -13.956
519 HB THR 71 HB THR 71 0.638 15.170 -14.917
520 HG1 THR 71 1HG THR 71 -2.059 15.308 -15.819
521 1HG2 THR 71 1HG2 THR 71 0.138 14.541 -17.243
522 2HG2 THR 71 2HG2 THR 71 -1.033 13.356 -16.664
523 3HG2 THR 71 3HG2 THR 71 0.680 13.160 -16.291
524 H ASP 72 H ASP 72 -2.504 14.947 -12.688
525 HA ASP 72 HA ASP 72 -1.135 15.161 -10.188
526 1HB ASP 72 2HB ASP 72 -0.171 17.101 -11.414
527 2HB ASP 72 1HB ASP 72 -1.802 17.735 -11.627
528 H GLY 73 H GLY 73 -3.048 13.865 -9.831
529 1HA GLY 73 2HA GLY 73 -5.091 15.437 -8.616
530 2HA GLY 73 1HA GLY 73 -5.669 14.666 -10.086
531 H SER 74 H SER 74 -5.688 12.359 -10.194
532 HA SER 74 HA SER 74 -5.257 10.928 -7.708
533 1HB SER 74 2HB SER 74 -7.863 10.808 -9.228
534 2HB SER 74 1HB SER 74 -7.462 9.972 -7.744
535 HG SER 74 HG SER 74 -7.042 12.592 -7.415
536 H ILE 75 H ILE 75 -4.899 8.759 -7.989
537 HA ILE 75 HA ILE 75 -5.044 7.671 -10.717
538 HB ILE 75 HB ILE 75 -2.844 7.073 -8.720
539 1HG1 ILE 75 2HG1 ILE 75 -2.833 8.707 -11.265
540 2HG1 ILE 75 1HG1 ILE 75 -2.461 9.262 -9.643
541 1HG2 ILE 75 1HG2 ILE 75 -1.838 5.786 -10.568
542 2HG2 ILE 75 2HG2 ILE 75 -3.272 6.098 -11.546
543 3HG2 ILE 75 3HG2 ILE 75 -3.402 5.137 -10.073
544 1HD1 ILE 75 1HD1 ILE 75 -0.454 7.887 -9.623
545 2HD1 ILE 75 2HD1 ILE 75 -0.455 9.020 -10.974
546 3HD1 ILE 75 3HD1 ILE 75 -0.830 7.321 -11.250
547 H GLU 76 H GLU 76 -6.049 5.739 -10.838
548 HA GLU 76 HA GLU 76 -6.793 4.468 -8.287
549 1HB GLU 76 2HB GLU 76 -8.696 5.480 -9.509
550 2HB GLU 76 1HB GLU 76 -8.308 4.462 -10.886
551 1HG GLU 76 2HG GLU 76 -8.765 2.474 -9.564
552 2HG GLU 76 1HG GLU 76 -9.165 3.492 -8.180
553 H ILE 77 H ILE 77 -6.096 2.492 -8.001
554 HA ILE 77 HA ILE 77 -5.268 0.893 -10.314
555 HB ILE 77 HB ILE 77 -3.241 0.158 -9.096
556 1HG1 ILE 77 2HG1 ILE 77 -3.891 2.418 -7.186
557 2HG1 ILE 77 1HG1 ILE 77 -4.052 0.706 -6.813
558 1HG2 ILE 77 1HG2 ILE 77 -3.399 3.135 -9.567
559 2HG2 ILE 77 2HG2 ILE 77 -3.077 1.902 -10.787
560 3HG2 ILE 77 3HG2 ILE 77 -1.917 2.183 -9.488
561 1HD1 ILE 77 1HD1 ILE 77 -1.660 0.406 -7.071
562 2HD1 ILE 77 2HD1 ILE 77 -2.012 1.662 -5.884
563 3HD1 ILE 77 3HD1 ILE 77 -1.483 2.105 -7.507
564 H GLN 78 H GLN 78 -5.356 -1.328 -10.017
565 HA GLN 78 HA GLN 78 -6.584 -2.250 -7.506
566 1HB GLN 78 2HB GLN 78 -8.326 -2.311 -9.136
567 2HB GLN 78 1HB GLN 78 -7.261 -3.007 -10.347
568 1HG GLN 78 2HG GLN 78 -7.208 -5.101 -9.191
569 2HG GLN 78 1HG GLN 78 -8.087 -4.418 -7.824
570 1HE2 GLN 78 1HE2 GLN 78 -10.275 -4.326 -7.887
571 2HE2 GLN 78 2HE2 GLN 78 -11.231 -4.907 -9.203
572 H TYR 79 H TYR 79 -5.730 -4.075 -6.614
573 HA TYR 79 HA TYR 79 -3.128 -4.866 -7.556
574 1HB TYR 79 2HB TYR 79 -4.785 -5.971 -5.274
575 2HB TYR 79 1HB TYR 79 -3.088 -6.318 -5.571
576 HD1 TYR 79 1HD TYR 79 -1.531 -4.179 -5.666
577 HD2 TYR 79 2HD TYR 79 -5.326 -4.328 -3.756
578 HE1 TYR 79 1HE TYR 79 -0.886 -2.273 -4.252
579 HE2 TYR 79 2HE TYR 79 -4.694 -2.422 -2.339
580 HH TYR 79 HH TYR 79 -2.560 -1.405 -1.485
581 H LEU 80 H LEU 80 -2.515 -7.061 -8.008
582 HA LEU 80 HA LEU 80 -4.748 -8.760 -8.916
583 1HB LEU 80 2HB LEU 80 -1.978 -8.530 -10.118
584 2HB LEU 80 1HB LEU 80 -3.224 -9.645 -10.646
585 HG LEU 80 HG LEU 80 -3.382 -6.631 -10.814
586 1HD1 LEU 80 1HD1 LEU 80 -1.791 -7.574 -12.396
587 2HD1 LEU 80 2HD1 LEU 80 -3.234 -6.994 -13.228
588 3HD1 LEU 80 3HD1 LEU 80 -3.008 -8.722 -12.953
589 1HD2 LEU 80 1HD2 LEU 80 -5.282 -8.755 -11.802
590 2HD2 LEU 80 2HD2 LEU 80 -5.428 -7.021 -12.085
591 3HD2 LEU 80 3HD2 LEU 80 -5.567 -7.662 -10.449
592 H GLY 81 H GLY 81 -4.061 -11.118 -9.053
593 1HA GLY 81 2HA GLY 81 -2.800 -12.900 -8.050
594 2HA GLY 81 1HA GLY 81 -2.293 -11.782 -6.790
595 HA PRO 82 HA PRO 82 -5.690 -14.281 -4.881
596 1HB PRO 82 2HB PRO 82 -4.715 -13.870 -2.340
597 2HB PRO 82 1HB PRO 82 -4.271 -15.235 -3.367
598 1HG PRO 82 2HG PRO 82 -2.802 -12.683 -2.872
599 2HG PRO 82 1HG PRO 82 -2.170 -14.333 -3.009
600 1HD PRO 82 2HD PRO 82 -1.983 -12.577 -5.037
601 2HD PRO 82 1HD PRO 82 -2.255 -14.307 -5.324
602 H TYR 83 H TYR 83 -4.604 -11.067 -4.752
603 HA TYR 83 HA TYR 83 -7.110 -10.224 -3.460
604 1HB TYR 83 2HB TYR 83 -4.533 -8.639 -3.441
605 2HB TYR 83 1HB TYR 83 -5.996 -8.321 -2.511
606 HD1 TYR 83 2HD TYR 83 -6.711 -10.355 -0.927
607 HD2 TYR 83 1HD TYR 83 -2.764 -9.635 -2.340
608 HE1 TYR 83 2HE TYR 83 -5.812 -11.694 0.928
609 HE2 TYR 83 1HE TYR 83 -1.851 -10.980 -0.492
610 HH TYR 83 HH TYR 83 -3.533 -13.107 1.237
611 H TYR 84 H TYR 84 -7.549 -10.637 -5.903
612 HA TYR 84 HA TYR 84 -6.465 -8.690 -7.708
613 1HB TYR 84 2HB TYR 84 -7.632 -9.990 -9.457
614 2HB TYR 84 1HB TYR 84 -6.562 -10.985 -8.477
615 HD1 TYR 84 2HD TYR 84 -7.566 -12.503 -6.733
616 HD2 TYR 84 1HD TYR 84 -9.959 -10.451 -9.596
617 HE1 TYR 84 2HE TYR 84 -9.429 -14.037 -6.267
618 HE2 TYR 84 1HE TYR 84 -11.827 -11.984 -9.137
619 HH TYR 84 HH TYR 84 -11.915 -14.013 -6.447
620 HA PRO 85 HA PRO 85 -10.814 -7.200 -7.812
621 1HB PRO 85 2HB PRO 85 -12.455 -7.746 -5.612
622 2HB PRO 85 1HB PRO 85 -12.535 -8.506 -7.200
623 1HG PRO 85 2HG PRO 85 -11.774 -9.722 -4.765
624 2HG PRO 85 1HG PRO 85 -11.667 -10.426 -6.385
625 1HD PRO 85 2HD PRO 85 -9.552 -9.160 -4.728
626 2HD PRO 85 1HD PRO 85 -9.412 -10.416 -5.978
627 H LEU 86 H LEU 86 -8.740 -7.018 -5.257
628 HA LEU 86 HA LEU 86 -10.089 -4.835 -3.876
629 1HB LEU 86 2HB LEU 86 -8.937 -6.565 -2.561
630 2HB LEU 86 1HB LEU 86 -7.423 -6.151 -3.340
631 HG LEU 86 HG LEU 86 -7.541 -3.894 -2.328
632 1HD1 LEU 86 1HD1 LEU 86 -9.155 -3.433 -0.574
633 2HD1 LEU 86 2HD1 LEU 86 -9.927 -4.995 -0.852
634 3HD1 LEU 86 3HD1 LEU 86 -9.972 -3.753 -2.104
635 1HD2 LEU 86 1HD2 LEU 86 -6.275 -5.663 -1.236
636 2HD2 LEU 86 2HD2 LEU 86 -7.723 -6.185 -0.373
637 3HD2 LEU 86 3HD2 LEU 86 -7.020 -4.600 -0.043
638 H LYS 87 H LYS 87 -9.862 -2.816 -4.603
639 HA LYS 87 HA LYS 87 -7.324 -2.130 -5.917
640 1HB LYS 87 2HB LYS 87 -8.494 -0.412 -7.161
641 2HB LYS 87 1HB LYS 87 -9.255 -1.973 -7.419
642 1HG LYS 87 2HG LYS 87 -11.069 -1.395 -5.965
643 2HG LYS 87 1HG LYS 87 -10.269 0.110 -5.500
644 1HD LYS 87 2HD LYS 87 -10.428 0.923 -7.785
645 2HD LYS 87 1HD LYS 87 -11.152 -0.601 -8.294
646 1HE LYS 87 2HE LYS 87 -13.081 -0.181 -6.878
647 2HE LYS 87 1HE LYS 87 -12.347 1.314 -6.297
648 1HZ LYS 87 1HZ LYS 87 -12.485 2.252 -8.481
649 2HZ LYS 87 2HZ LYS 87 -14.017 1.651 -8.068
650 3HZ LYS 87 3HZ LYS 87 -13.034 0.789 -9.138
651 H SER 88 H SER 88 -6.665 0.135 -5.688
652 HA SER 88 HA SER 88 -7.427 1.286 -3.103
653 1HB SER 88 2HB SER 88 -4.788 0.334 -4.014
654 2HB SER 88 1HB SER 88 -4.792 1.933 -3.282
655 HG SER 88 HG SER 88 -5.816 1.016 -1.463
656 H THR 89 H THR 89 -6.831 3.568 -2.922
657 HA THR 89 HA THR 89 -6.897 4.877 -5.561
658 HB THR 89 HB THR 89 -7.929 6.135 -3.042
659 HG1 THR 89 1HG THR 89 -8.926 3.957 -4.191
660 1HG2 THR 89 1HG2 THR 89 -8.584 6.525 -5.966
661 2HG2 THR 89 2HG2 THR 89 -7.596 7.594 -4.971
662 3HG2 THR 89 3HG2 THR 89 -9.313 7.410 -4.625
663 H LEU 90 H LEU 90 -5.536 6.506 -5.930
664 HA LEU 90 HA LEU 90 -3.679 7.328 -3.796
665 1HB LEU 90 2HB LEU 90 -3.045 6.856 -6.717
666 2HB LEU 90 1HB LEU 90 -1.942 7.579 -5.565
667 HG LEU 90 HG LEU 90 -3.011 4.763 -5.382
668 1HD1 LEU 90 1HD1 LEU 90 -1.527 5.039 -7.293
669 2HD1 LEU 90 2HD1 LEU 90 -0.750 4.092 -6.025
670 3HD1 LEU 90 3HD1 LEU 90 -0.313 5.784 -6.256
671 1HD2 LEU 90 1HD2 LEU 90 -0.858 6.175 -3.811
672 2HD2 LEU 90 2HD2 LEU 90 -1.328 4.482 -3.650
673 3HD2 LEU 90 3HD2 LEU 90 -2.465 5.757 -3.214
674 H LYS 91 H LYS 91 -3.729 9.469 -3.454
675 HA LYS 91 HA LYS 91 -4.611 11.181 -5.666
676 1HB LYS 91 2HB LYS 91 -5.723 11.100 -2.873
677 2HB LYS 91 1HB LYS 91 -5.917 12.506 -3.914
678 1HG LYS 91 2HG LYS 91 -7.419 11.487 -5.247
679 2HG LYS 91 1HG LYS 91 -6.626 9.920 -5.125
680 1HD LYS 91 2HD LYS 91 -8.789 9.775 -4.101
681 2HD LYS 91 1HD LYS 91 -7.558 9.683 -2.844
682 1HE LYS 91 2HE LYS 91 -7.961 11.927 -2.174
683 2HE LYS 91 1HE LYS 91 -8.978 12.227 -3.584
684 1HZ LYS 91 1HZ LYS 91 -10.646 10.808 -2.736
685 2HZ LYS 91 2HZ LYS 91 -10.192 11.817 -1.454
686 3HZ LYS 91 3HZ LYS 91 -9.638 10.213 -1.507
687 H ARG 92 H ARG 92 -4.011 13.380 -5.503
688 HA ARG 92 HA ARG 92 -1.275 13.592 -4.810
689 1HB ARG 92 2HB ARG 92 -1.430 15.845 -5.700
690 2HB ARG 92 1HB ARG 92 -2.272 14.719 -6.756
691 1HG ARG 92 2HG ARG 92 -4.393 15.381 -5.788
692 2HG ARG 92 1HG ARG 92 -3.565 16.494 -4.705
693 1HD ARG 92 2HD ARG 92 -2.732 17.734 -6.667
694 2HD ARG 92 1HD ARG 92 -3.647 16.646 -7.716
695 HE ARG 92 HE ARG 92 -5.319 17.807 -5.733
696 1HH1 ARG 92 1HH1 ARG 92 -3.673 18.591 -8.729
697 2HH1 ARG 92 2HH1 ARG 92 -4.851 19.790 -9.195
698 1HH2 ARG 92 1HH2 ARG 92 -6.855 19.370 -6.349
699 2HH2 ARG 92 2HH2 ARG 92 -6.660 20.229 -7.846
700 H GLY 93 H GLY 93 -0.255 14.930 -3.327
701 1HA GLY 93 2HA GLY 93 -1.981 16.226 -1.327
702 2HA GLY 93 1HA GLY 93 -0.503 15.371 -0.886
703 H GLU 94 H GLU 94 -1.132 18.153 -0.429
704 HA GLU 94 HA GLU 94 0.099 19.817 -2.331
705 1HB GLU 94 2HB GLU 94 -0.460 20.217 0.605
706 2HB GLU 94 1HB GLU 94 0.132 21.479 -0.460
707 1HG GLU 94 2HG GLU 94 -1.877 21.192 -1.865
708 2HG GLU 94 1HG GLU 94 -2.476 20.010 -0.703
709 H ASN 95 H ASN 95 2.092 20.748 -2.406
710 HA ASN 95 HA ASN 95 4.333 20.956 -2.224
711 1HB ASN 95 2HB ASN 95 3.903 19.871 0.568
712 2HB ASN 95 1HB ASN 95 5.426 20.523 -0.026
713 1HD2 ASN 95 1HD2 ASN 95 2.262 21.239 1.112
714 2HD2 ASN 95 2HD2 ASN 95 2.433 22.958 1.159
715 H GLY 96 H GLY 96 2.948 18.345 -2.978
716 1HA GLY 96 2HA GLY 96 3.868 16.561 -4.150
717 2HA GLY 96 1HA GLY 96 5.442 16.970 -3.486
718 H THR 97 H THR 97 2.347 16.084 -1.967
719 HA THR 97 HA THR 97 3.740 13.814 -0.730
720 HB THR 97 HB THR 97 1.832 14.005 1.019
721 HG1 THR 97 1HG THR 97 1.897 16.756 0.385
722 1HG2 THR 97 1HG2 THR 97 3.146 15.608 2.350
723 2HG2 THR 97 2HG2 THR 97 4.042 16.064 0.900
724 3HG2 THR 97 3HG2 THR 97 4.176 14.426 1.541
725 H LEU 98 H LEU 98 1.957 12.095 0.007
726 HA LEU 98 HA LEU 98 0.137 11.747 -2.279
727 1HB LEU 98 2HB LEU 98 2.146 10.374 -2.585
728 2HB LEU 98 1HB LEU 98 1.866 9.608 -1.034
729 HG LEU 98 HG LEU 98 -0.294 8.723 -1.936
730 1HD1 LEU 98 1HD1 LEU 98 0.788 9.800 -4.536
731 2HD1 LEU 98 2HD1 LEU 98 -0.670 10.338 -3.704
732 3HD1 LEU 98 3HD1 LEU 98 -0.592 8.710 -4.375
733 1HD2 LEU 98 1HD2 LEU 98 2.218 7.961 -3.415
734 2HD2 LEU 98 2HD2 LEU 98 0.755 6.983 -3.303
735 3HD2 LEU 98 3HD2 LEU 98 1.693 7.333 -1.852
736 H ILE 99 H ILE 99 -1.857 11.110 -1.829
737 HA ILE 99 HA ILE 99 -2.461 10.236 0.919
738 HB ILE 99 HB ILE 99 -4.312 11.401 -1.174
739 1HG1 ILE 99 2HG1 ILE 99 -3.232 12.583 1.398
740 2HG1 ILE 99 1HG1 ILE 99 -2.740 13.045 -0.229
741 1HG2 ILE 99 1HG2 ILE 99 -4.864 10.696 1.704
742 2HG2 ILE 99 2HG2 ILE 99 -5.413 9.777 0.303
743 3HG2 ILE 99 3HG2 ILE 99 -6.002 11.419 0.567
744 1HD1 ILE 99 1HD1 ILE 99 -4.294 14.647 0.750
745 2HD1 ILE 99 2HD1 ILE 99 -5.500 13.373 0.923
746 3HD1 ILE 99 3HD1 ILE 99 -4.975 13.877 -0.682
747 H TRP 100 H TRP 100 -2.591 8.102 1.060
748 HA TRP 100 HA TRP 100 -3.503 6.581 -1.282
749 1HB TRP 100 2HB TRP 100 -1.258 5.992 -0.545
750 2HB TRP 100 1HB TRP 100 -1.832 5.723 1.093
751 HD1 TRP 100 HD TRP 100 -3.744 4.271 -1.914
752 HE1 TRP 100 1HE TRP 100 -3.566 1.704 -1.827
753 HE3 TRP 100 3HE TRP 100 -0.392 3.807 1.919
754 HZ2 TRP 100 2HZ TRP 100 -2.197 -0.245 -0.343
755 HZ3 TRP 100 3HZ TRP 100 0.300 1.550 2.604
756 HH2 TRP 100 HH TRP 100 -0.584 -0.434 1.497
757 H GLU 101 H GLU 101 -5.527 5.921 -1.204
758 HA GLU 101 HA GLU 101 -6.733 5.349 1.406
759 1HB GLU 101 2HB GLU 101 -7.850 6.112 -1.249
760 2HB GLU 101 1HB GLU 101 -8.859 5.211 -0.135
761 1HG GLU 101 2HG GLU 101 -8.619 6.914 1.543
762 2HG GLU 101 1HG GLU 101 -7.462 7.782 0.548
763 H GLN 102 H GLN 102 -7.382 3.412 1.944
764 HA GLN 102 HA GLN 102 -7.314 1.195 0.070
765 1HB GLN 102 2HB GLN 102 -4.929 1.626 0.796
766 2HB GLN 102 1HB GLN 102 -5.427 1.215 2.432
767 1HG GLN 102 2HG GLN 102 -6.199 -0.820 0.525
768 2HG GLN 102 1HG GLN 102 -4.467 -0.512 0.505
769 1HE2 GLN 102 1HE2 GLN 102 -3.889 -2.433 1.418
770 2HE2 GLN 102 2HE2 GLN 102 -4.223 -2.827 3.072
771 H ASN 103 H ASN 103 -8.930 -0.098 0.567
772 HA ASN 103 HA ASN 103 -10.536 -1.233 1.692
773 1HB ASN 103 2HB ASN 103 -8.404 -1.030 3.770
774 2HB ASN 103 1HB ASN 103 -9.995 -1.594 4.256
775 1HD2 ASN 103 1HD2 ASN 103 -7.087 -2.355 2.630
776 2HD2 ASN 103 2HD2 ASN 103 -7.478 -3.995 2.242
777 H GLY 104 H GLY 104 -10.439 1.771 1.631
778 1HA GLY 104 2HA GLY 104 -12.291 3.155 2.116
779 2HA GLY 104 1HA GLY 104 -12.679 2.116 3.478
780 H GLN 105 H GLN 105 -9.520 2.456 3.914
781 HA GLN 105 HA GLN 105 -9.876 4.722 5.723
782 1HB GLN 105 2HB GLN 105 -7.463 2.924 5.411
783 2HB GLN 105 1HB GLN 105 -7.800 4.019 6.744
784 1HG GLN 105 2HG GLN 105 -9.735 2.649 7.359
785 2HG GLN 105 1HG GLN 105 -9.349 1.538 6.047
786 1HE2 GLN 105 1HE2 GLN 105 -9.492 1.033 8.898
787 2HE2 GLN 105 2HE2 GLN 105 -7.935 0.444 9.378
788 H ARG 106 H ARG 106 -8.957 6.675 5.407
789 HA ARG 106 HA ARG 106 -7.286 7.030 3.024
790 1HB ARG 106 2HB ARG 106 -9.329 8.445 3.245
791 2HB ARG 106 1HB ARG 106 -8.650 9.138 4.711
792 1HG ARG 106 2HG ARG 106 -6.769 10.025 3.438
793 2HG ARG 106 1HG ARG 106 -7.425 9.311 1.966
794 1HD ARG 106 2HD ARG 106 -8.024 11.612 1.968
795 2HD ARG 106 1HD ARG 106 -9.485 10.689 2.324
796 HE ARG 106 HE ARG 106 -7.977 11.715 4.603
797 1HH1 ARG 106 1HH1 ARG 106 -10.664 12.125 2.395
798 2HH1 ARG 106 2HH1 ARG 106 -11.537 13.202 3.448
799 1HH2 ARG 106 1HH2 ARG 106 -9.121 13.120 6.001
800 2HH2 ARG 106 2HH2 ARG 106 -10.677 13.732 5.524
801 H LYS 107 H LYS 107 -5.143 7.400 3.248
802 HA LYS 107 HA LYS 107 -4.248 8.486 5.819
803 1HB LYS 107 2HB LYS 107 -3.081 6.210 4.258
804 2HB LYS 107 1HB LYS 107 -2.098 7.141 5.378
805 1HG LYS 107 2HG LYS 107 -4.678 5.995 6.324
806 2HG LYS 107 1HG LYS 107 -3.283 4.953 6.126
807 1HD LYS 107 2HD LYS 107 -3.356 5.694 8.400
808 2HD LYS 107 1HD LYS 107 -1.986 6.458 7.599
809 1HE LYS 107 2HE LYS 107 -3.286 8.485 7.302
810 2HE LYS 107 1HE LYS 107 -4.669 7.729 8.087
811 1HZ LYS 107 1HZ LYS 107 -2.040 8.306 9.338
812 2HZ LYS 107 2HZ LYS 107 -3.323 7.523 10.110
813 3HZ LYS 107 3HZ LYS 107 -3.488 9.139 9.625
814 H THR 108 H THR 108 -2.766 10.032 5.801
815 HA THR 108 HA THR 108 -1.831 10.980 3.177
816 HB THR 108 HB THR 108 -1.912 12.520 5.785
817 HG1 THR 108 1HG THR 108 -3.708 12.734 3.581
818 1HG2 THR 108 1HG2 THR 108 -1.636 14.483 4.344
819 2HG2 THR 108 2HG2 THR 108 -1.555 13.436 2.925
820 3HG2 THR 108 3HG2 THR 108 -0.288 13.362 4.150
821 H MET 109 H MET 109 0.217 10.464 2.731
822 HA MET 109 HA MET 109 2.012 9.920 5.002
823 1HB MET 109 2HB MET 109 3.078 8.216 3.456
824 2HB MET 109 1HB MET 109 1.486 7.814 4.086
825 1HG MET 109 2HG MET 109 0.519 8.635 1.937
826 2HG MET 109 1HG MET 109 2.165 8.804 1.328
827 1HE MET 109 1HE MET 109 1.027 5.966 3.799
828 2HE MET 109 2HE MET 109 0.420 4.749 2.677
829 3HE MET 109 3HE MET 109 -0.434 6.280 2.861
830 H THR 110 H THR 110 4.181 10.414 4.792
831 HA THR 110 HA THR 110 4.765 12.467 2.793
832 HB THR 110 HB THR 110 6.618 11.790 5.031
833 HG1 THR 110 1HG THR 110 4.555 13.652 5.484
834 1HG2 THR 110 1HG2 THR 110 5.809 14.400 3.745
835 2HG2 THR 110 2HG2 THR 110 7.267 13.481 3.374
836 3HG2 THR 110 3HG2 THR 110 7.059 14.196 4.975
837 H ARG 111 H ARG 111 6.759 12.435 1.651
838 HA ARG 111 HA ARG 111 7.484 9.766 0.801
839 1HB ARG 111 2HB ARG 111 7.074 11.437 -0.902
840 2HB ARG 111 1HB ARG 111 8.281 12.502 -0.199
841 1HG ARG 111 2HG ARG 111 10.039 10.930 -0.786
842 2HG ARG 111 1HG ARG 111 8.836 9.819 -1.447
843 1HD ARG 111 2HD ARG 111 8.260 11.337 -3.179
844 2HD ARG 111 1HD ARG 111 9.178 12.642 -2.432
845 HE ARG 111 HE ARG 111 10.924 10.518 -3.001
846 1HH1 ARG 111 1HH1 ARG 111 8.993 12.896 -4.692
847 2HH1 ARG 111 2HH1 ARG 111 10.088 13.022 -6.036
848 1HH2 ARG 111 1HH2 ARG 111 12.353 10.660 -4.785
849 2HH2 ARG 111 2HH2 ARG 111 11.982 11.742 -6.093
850 H ILE 112 H ILE 112 9.179 8.691 1.550
851 HA ILE 112 HA ILE 112 11.021 9.886 3.390
852 HB ILE 112 HB ILE 112 11.279 7.185 2.062
853 1HG1 ILE 112 2HG1 ILE 112 9.053 7.382 3.058
854 2HG1 ILE 112 1HG1 ILE 112 10.056 6.266 3.967
855 1HG2 ILE 112 1HG2 ILE 112 13.264 7.936 3.257
856 2HG2 ILE 112 2HG2 ILE 112 12.506 6.575 4.085
857 3HG2 ILE 112 3HG2 ILE 112 12.297 8.214 4.707
858 1HD1 ILE 112 1HD1 ILE 112 8.776 7.612 5.479
859 2HD1 ILE 112 2HD1 ILE 112 9.378 9.091 4.731
860 3HD1 ILE 112 3HD1 ILE 112 10.479 8.040 5.619
861 H GLU 113 H GLU 113 13.336 10.026 3.064
862 HA GLU 113 HA GLU 113 14.036 11.072 0.504
863 1HB GLU 113 2HB GLU 113 15.692 10.473 2.942
864 2HB GLU 113 1HB GLU 113 16.346 11.212 1.495
865 1HG GLU 113 2HG GLU 113 15.899 12.897 3.161
866 2HG GLU 113 1HG GLU 113 14.830 13.112 1.780
867 H SER 114 H SER 114 13.792 9.477 -0.945
868 HA SER 114 HA SER 114 14.390 7.796 -2.336
869 1HB SER 114 2HB SER 114 16.865 7.578 -0.603
870 2HB SER 114 1HB SER 114 16.630 6.788 -2.162
871 HG SER 114 HG SER 114 16.159 9.174 -2.796
872 H LYS 115 H LYS 115 14.909 5.361 -2.316
873 HA LYS 115 HA LYS 115 13.419 4.161 -0.120
874 1HB LYS 115 2HB LYS 115 13.520 2.100 -1.593
875 2HB LYS 115 1HB LYS 115 12.628 3.465 -2.251
876 1HG LYS 115 2HG LYS 115 14.717 4.056 -3.539
877 2HG LYS 115 1HG LYS 115 15.368 2.496 -3.031
878 1HD LYS 115 2HD LYS 115 12.785 2.869 -4.548
879 2HD LYS 115 1HD LYS 115 14.330 2.454 -5.289
880 1HE LYS 115 2HE LYS 115 12.973 0.807 -3.160
881 2HE LYS 115 1HE LYS 115 12.807 0.513 -4.889
882 1HZ LYS 115 1HZ LYS 115 15.307 0.353 -3.288
883 2HZ LYS 115 2HZ LYS 115 15.251 0.243 -4.977
884 3HZ LYS 115 3HZ LYS 115 14.479 -0.929 -4.035
885 H THR 116 H THR 116 14.542 3.518 1.583
886 HA THR 116 HA THR 116 17.383 2.970 1.336
887 HB THR 116 HB THR 116 15.678 2.895 3.834
888 HG1 THR 116 1HG THR 116 16.379 4.996 2.288
889 1HG2 THR 116 1HG2 THR 116 18.649 3.286 3.423
890 2HG2 THR 116 2HG2 THR 116 17.873 1.831 4.052
891 3HG2 THR 116 3HG2 THR 116 17.810 3.333 4.976
892 H GLY 117 H GLY 117 18.292 1.011 1.378
893 1HA GLY 117 2HA GLY 117 18.315 -1.242 2.342
894 2HA GLY 117 1HA GLY 117 16.576 -1.290 2.084
895 H ARG 118 H ARG 118 17.023 -3.293 0.950
896 HA ARG 118 HA ARG 118 17.419 -2.824 -1.879
897 1HB ARG 118 2HB ARG 118 19.700 -3.327 -1.093
898 2HB ARG 118 1HB ARG 118 19.119 -4.797 -0.330
899 1HG ARG 118 2HG ARG 118 18.577 -5.750 -2.488
900 2HG ARG 118 1HG ARG 118 19.043 -4.249 -3.290
901 1HD ARG 118 2HD ARG 118 20.817 -5.910 -3.458
902 2HD ARG 118 1HD ARG 118 21.337 -4.530 -2.494
903 HE ARG 118 HE ARG 118 20.277 -6.718 -0.936
904 1HH1 ARG 118 1HH1 ARG 118 23.151 -5.356 -2.433
905 2HH1 ARG 118 2HH1 ARG 118 24.239 -6.217 -1.392
906 1HH2 ARG 118 1HH2 ARG 118 21.710 -7.821 0.436
907 2HH2 ARG 118 2HH2 ARG 118 23.428 -7.622 0.239
908 H GLU 119 H GLU 119 15.867 -3.927 -2.917
909 HA GLU 119 HA GLU 119 14.217 -5.751 -1.447
910 1HB GLU 119 2HB GLU 119 12.915 -5.978 -3.543
911 2HB GLU 119 1HB GLU 119 13.113 -4.315 -3.023
912 1HG GLU 119 2HG GLU 119 14.816 -5.595 -5.144
913 2HG GLU 119 1HG GLU 119 13.315 -4.738 -5.487
914 H GLU 120 H GLU 120 14.705 -7.758 -1.087
915 HA GLU 120 HA GLU 120 15.779 -9.435 -3.189
916 1HB GLU 120 2HB GLU 120 17.781 -8.368 -2.171
917 2HB GLU 120 1HB GLU 120 17.315 -9.033 -0.614
918 1HG GLU 120 2HG GLU 120 17.629 -11.279 -1.440
919 2HG GLU 120 1HG GLU 120 17.998 -10.662 -3.052
920 H LYS 121 H LYS 121 15.757 -9.609 0.360
921 HA LYS 121 HA LYS 121 14.794 -11.011 1.852
922 1HB LYS 121 2HB LYS 121 12.737 -10.112 0.479
923 2HB LYS 121 1HB LYS 121 12.637 -11.776 -0.063
924 1HG LYS 121 2HG LYS 121 12.493 -10.808 2.790
925 2HG LYS 121 1HG LYS 121 11.150 -11.386 1.810
926 1HD LYS 121 2HD LYS 121 12.218 -13.599 1.681
927 2HD LYS 121 1HD LYS 121 13.528 -13.012 2.707
928 1HE LYS 121 2HE LYS 121 11.809 -12.489 4.449
929 2HE LYS 121 1HE LYS 121 10.617 -13.305 3.435
930 1HZ LYS 121 1HZ LYS 121 11.398 -14.862 5.033
931 2HZ LYS 121 2HZ LYS 121 13.018 -14.488 4.712
932 3HZ LYS 121 3HZ LYS 121 12.093 -15.301 3.546
933 H ASP 122 H ASP 122 15.975 -12.723 2.232
934 HA ASP 122 HA ASP 122 16.263 -14.779 0.180
935 1HB ASP 122 2HB ASP 122 18.296 -13.964 1.296
936 2HB ASP 122 1HB ASP 122 17.667 -14.524 2.844
937 H GLU 123 H GLU 123 15.447 -16.727 0.266
938 HA GLU 123 HA GLU 123 14.392 -18.605 0.925
939 1HB GLU 123 2HB GLU 123 15.899 -18.411 2.938
940 2HB GLU 123 1HB GLU 123 14.560 -17.638 3.775
941 1HG GLU 123 2HG GLU 123 13.245 -19.596 3.677
942 2HG GLU 123 1HG GLU 123 14.343 -20.363 2.530
943 H LYS 124 H LYS 124 12.368 -18.975 0.535
944 HA LYS 124 HA LYS 124 10.331 -17.035 0.793
945 1HB LYS 124 2HB LYS 124 10.125 -19.992 0.188
946 2HB LYS 124 1HB LYS 124 8.855 -18.806 -0.065
947 1HG LYS 124 2HG LYS 124 10.102 -17.720 -1.783
948 2HG LYS 124 1HG LYS 124 11.531 -18.696 -1.435
949 1HD LYS 124 2HD LYS 124 10.425 -19.555 -3.407
950 2HD LYS 124 1HD LYS 124 10.268 -20.717 -2.089
951 1HE LYS 124 2HE LYS 124 8.157 -20.572 -3.197
952 2HE LYS 124 1HE LYS 124 8.005 -19.777 -1.630
953 1HZ LYS 124 1HZ LYS 124 8.436 -18.389 -4.223
954 2HZ LYS 124 2HZ LYS 124 8.232 -17.643 -2.717
955 3HZ LYS 124 3HZ LYS 124 6.951 -18.507 -3.410
956 H SER 125 H SER 125 9.179 -16.589 2.488
957 HA SER 125 HA SER 125 8.818 -18.607 4.599
958 1HB SER 125 2HB SER 125 8.618 -15.593 4.827
959 2HB SER 125 1HB SER 125 8.495 -16.748 6.152
960 HG SER 125 HG SER 125 10.579 -16.826 6.248
961 H LYS 126 H LYS 126 6.930 -19.618 3.957
962 HA LYS 126 HA LYS 126 4.600 -17.864 3.546
963 1HB LYS 126 2HB LYS 126 5.229 -19.488 1.719
964 2HB LYS 126 1HB LYS 126 4.812 -20.789 2.825
965 1HG LYS 126 2HG LYS 126 2.521 -19.990 2.933
966 2HG LYS 126 1HG LYS 126 2.935 -18.635 1.876
967 1HD LYS 126 2HD LYS 126 3.528 -20.206 0.096
968 2HD LYS 126 1HD LYS 126 3.112 -21.560 1.152
969 1HE LYS 126 2HE LYS 126 1.218 -19.397 0.237
970 2HE LYS 126 1HE LYS 126 1.316 -21.021 -0.440
971 1HZ LYS 126 1HZ LYS 126 -0.467 -20.985 1.097
972 2HZ LYS 126 2HZ LYS 126 0.477 -20.262 2.305
973 3HZ LYS 126 3HZ LYS 126 0.785 -21.863 1.832
974 H SER 127 H SER 127 4.713 -17.637 5.922
975 HA SER 127 HA SER 127 2.590 -19.057 7.107
976 1HB SER 127 2HB SER 127 4.387 -20.797 7.382
977 2HB SER 127 1HB SER 127 5.300 -19.637 8.344
978 HG SER 127 HG SER 127 3.643 -21.297 9.309
979 H LEU 128 H LEU 128 1.722 -17.168 7.756
980 HA LEU 128 HA LEU 128 3.469 -15.241 9.125
981 1HB LEU 128 2HB LEU 128 0.866 -14.835 7.657
982 2HB LEU 128 1HB LEU 128 1.658 -13.584 8.594
983 HG LEU 128 HG LEU 128 3.674 -13.947 7.040
984 1HD1 LEU 128 1HD1 LEU 128 3.107 -14.767 4.793
985 2HD1 LEU 128 2HD1 LEU 128 1.530 -15.282 5.394
986 3HD1 LEU 128 3HD1 LEU 128 3.001 -16.029 6.017
987 1HD2 LEU 128 1HD2 LEU 128 2.765 -12.419 5.383
988 2HD2 LEU 128 2HD2 LEU 128 2.247 -11.965 7.007
989 3HD2 LEU 128 3HD2 LEU 128 1.126 -12.788 5.920
990 H GLU 129 H GLU 129 3.164 -14.840 11.215
991 HA GLU 129 HA GLU 129 1.059 -16.138 12.667
992 1HB GLU 129 2HB GLU 129 3.081 -14.098 13.624
993 2HB GLU 129 1HB GLU 129 2.039 -15.069 14.655
994 1HG GLU 129 2HG GLU 129 4.272 -16.033 12.893
995 2HG GLU 129 1HG GLU 129 4.217 -16.031 14.656
996 H HIS 130 H HIS 130 -0.718 -15.168 11.563
997 HA HIS 130 HA HIS 130 -1.202 -12.383 11.605
998 1HB HIS 130 2HB HIS 130 -3.570 -13.044 11.011
999 2HB HIS 130 1HB HIS 130 -2.315 -13.618 9.922
1000 HD1 HIS 130 1HD HIS 130 -5.061 -14.774 12.086
1001 HD2 HIS 130 2HD HIS 130 -1.778 -16.439 10.146
1002 HE1 HIS 130 1HE HIS 130 -5.463 -17.260 12.074
1003 HE2 HIS 130 2HE HIS 130 -3.390 -18.254 11.031
1004 H HIS 131 H HIS 131 -1.211 -11.379 13.481
1005 HA HIS 131 HA HIS 131 -3.206 -12.219 15.481
1006 1HB HIS 131 2HB HIS 131 -0.482 -10.985 15.920
1007 2HB HIS 131 1HB HIS 131 -1.715 -11.059 17.171
1008 HD1 HIS 131 1HD HIS 131 0.757 -13.173 15.330
1009 HD2 HIS 131 2HD HIS 131 -2.139 -13.599 18.283
1010 HE1 HIS 131 1HE HIS 131 1.170 -15.429 16.366
1011 HE2 HIS 131 2HE HIS 131 -0.468 -15.573 18.282
1012 H HIS 132 H HIS 132 -4.059 -10.379 16.775
1013 HA HIS 132 HA HIS 132 -3.679 -7.708 15.930
1014 1HB HIS 132 2HB HIS 132 -5.858 -7.279 14.873
1015 2HB HIS 132 1HB HIS 132 -4.911 -8.424 13.935
1016 HD1 HIS 132 1HD HIS 132 -8.174 -7.972 15.530
1017 HD2 HIS 132 2HD HIS 132 -5.861 -11.180 14.218
1018 HE1 HIS 132 1HE HIS 132 -9.749 -9.933 15.367
1019 HE2 HIS 132 2HE HIS 132 -8.332 -11.870 14.589
1020 H HIS 133 H HIS 133 -4.065 -6.567 17.703
1021 HA HIS 133 HA HIS 133 -6.486 -6.923 19.215
1022 1HB HIS 133 2HB HIS 133 -3.963 -8.079 20.159
1023 2HB HIS 133 1HB HIS 133 -4.707 -6.989 21.322
1024 HD1 HIS 133 1HD HIS 133 -4.966 -10.378 19.916
1025 HD2 HIS 133 2HD HIS 133 -7.349 -7.795 22.142
1026 HE1 HIS 133 1HE HIS 133 -6.786 -11.808 20.903
1027 HE2 HIS 133 2HE HIS 133 -8.112 -10.256 22.379
1028 H HIS 134 H HIS 134 -7.047 -4.830 19.050
1029 HA HIS 134 HA HIS 134 -5.135 -2.857 20.112
1030 1HB HIS 134 2HB HIS 134 -5.826 -2.427 17.771
1031 2HB HIS 134 1HB HIS 134 -7.507 -2.367 18.288
1032 HD1 HIS 134 1HD HIS 134 -4.247 -0.474 18.733
1033 HD2 HIS 134 2HD HIS 134 -8.352 0.077 19.178
1034 HE1 HIS 134 1HE HIS 134 -4.559 1.970 19.249
1035 HE2 HIS 134 2HE HIS 134 -7.013 2.218 19.742
1036 H HIS 135 H HIS 135 -5.565 -2.139 22.072
1037 HA HIS 135 HA HIS 135 -7.975 -2.894 23.422
1038 1HB HIS 135 2HB HIS 135 -5.521 -2.559 24.329
1039 2HB HIS 135 1HB HIS 135 -6.045 -0.894 24.546
1040 HD1 HIS 135 1HD HIS 135 -5.549 -3.602 26.549
1041 HD2 HIS 135 2HD HIS 135 -8.910 -1.236 25.914
1042 HE1 HIS 135 1HE HIS 135 -6.987 -3.906 28.587
1043 HE2 HIS 135 2HE HIS 135 -9.124 -2.685 28.052
Start of MODEL 6
1 1H MET 1 1HT MET 1 13.857 48.135 -4.929
2 2H MET 1 2HT MET 1 14.571 47.504 -6.328
3 3H MET 1 3HT MET 1 14.693 46.665 -4.860
4 HA MET 1 HA MET 1 12.280 46.367 -4.839
5 1HB MET 1 2HB MET 1 12.466 47.442 -7.659
6 2HB MET 1 1HB MET 1 11.019 46.831 -6.866
7 1HG MET 1 2HG MET 1 11.042 48.661 -5.311
8 2HG MET 1 1HG MET 1 12.582 49.231 -5.950
9 1HE MET 1 1HE MET 1 11.871 51.618 -6.385
10 2HE MET 1 2HE MET 1 10.326 51.271 -5.609
11 3HE MET 1 3HE MET 1 10.366 52.096 -7.168
12 H ILE 2 H ILE 2 12.842 44.275 -4.643
13 HA ILE 2 HA ILE 2 13.035 42.774 -7.141
14 HB ILE 2 HB ILE 2 14.645 41.176 -5.922
15 1HG1 ILE 2 2HG1 ILE 2 16.272 42.527 -4.434
16 2HG1 ILE 2 1HG1 ILE 2 14.938 43.655 -4.233
17 1HG2 ILE 2 1HG2 ILE 2 16.608 42.400 -6.728
18 2HG2 ILE 2 2HG2 ILE 2 15.623 43.855 -6.889
19 3HG2 ILE 2 3HG2 ILE 2 15.275 42.439 -7.881
20 1HD1 ILE 2 1HD1 ILE 2 15.085 42.088 -2.379
21 2HD1 ILE 2 2HD1 ILE 2 14.894 40.735 -3.494
22 3HD1 ILE 2 3HD1 ILE 2 13.577 41.886 -3.268
23 H MET 3 H MET 3 12.542 40.434 -6.783
24 HA MET 3 HA MET 3 10.543 40.174 -4.665
25 1HB MET 3 2HB MET 3 9.745 38.184 -5.917
26 2HB MET 3 1HB MET 3 9.666 39.666 -6.854
27 1HG MET 3 2HG MET 3 11.652 39.042 -8.077
28 2HG MET 3 1HG MET 3 11.829 37.589 -7.094
29 1HE MET 3 1HE MET 3 10.780 36.215 -10.629
30 2HE MET 3 2HE MET 3 12.021 36.223 -9.374
31 3HE MET 3 3HE MET 3 11.736 37.669 -10.342
32 H VAL 4 H VAL 4 11.049 39.125 -2.905
33 HA VAL 4 HA VAL 4 13.577 37.858 -2.595
34 HB VAL 4 HB VAL 4 12.574 39.113 -0.770
35 1HG1 VAL 4 1HG1 VAL 4 10.234 38.656 -1.227
36 2HG1 VAL 4 2HG1 VAL 4 10.633 38.282 0.450
37 3HG1 VAL 4 3HG1 VAL 4 10.449 36.979 -0.724
38 1HG2 VAL 4 1HG2 VAL 4 14.151 37.358 -0.187
39 2HG2 VAL 4 2HG2 VAL 4 12.838 36.181 -0.107
40 3HG2 VAL 4 3HG2 VAL 4 12.905 37.509 1.052
41 H SER 5 H SER 5 14.093 35.745 -2.396
42 HA SER 5 HA SER 5 12.548 33.830 -3.752
43 1HB SER 5 2HB SER 5 14.899 33.419 -1.888
44 2HB SER 5 1HB SER 5 14.273 32.227 -3.027
45 HG SER 5 HG SER 5 16.104 34.000 -3.513
46 H GLY 6 H GLY 6 10.707 32.992 -3.030
47 1HA GLY 6 2HA GLY 6 10.381 32.477 -0.162
48 2HA GLY 6 1HA GLY 6 9.097 32.462 -1.365
49 H CYS 7 H CYS 7 9.275 30.400 0.419
50 HA CYS 7 HA CYS 7 10.816 28.211 -0.541
51 1HB CYS 7 2HB CYS 7 8.382 28.262 1.256
52 2HB CYS 7 1HB CYS 7 9.400 26.854 0.983
53 HG CYS 7 HG CYS 7 10.677 27.375 3.146
54 H GLN 8 H GLN 8 10.446 27.811 -2.679
55 HA GLN 8 HA GLN 8 8.070 26.315 -3.299
56 1HB GLN 8 2HB GLN 8 7.360 27.667 -5.195
57 2HB GLN 8 1HB GLN 8 7.308 28.629 -3.723
58 1HG GLN 8 2HG GLN 8 9.461 29.641 -4.333
59 2HG GLN 8 1HG GLN 8 9.453 28.715 -5.834
60 1HE2 GLN 8 1HE2 GLN 8 9.510 31.563 -5.464
61 2HE2 GLN 8 2HE2 GLN 8 8.114 32.198 -6.263
62 H GLN 9 H GLN 9 8.262 25.172 -5.313
63 HA GLN 9 HA GLN 9 10.927 25.314 -6.551
64 1HB GLN 9 2HB GLN 9 10.637 23.327 -4.982
65 2HB GLN 9 1HB GLN 9 9.438 22.722 -6.115
66 1HG GLN 9 2HG GLN 9 11.454 21.612 -6.611
67 2HG GLN 9 1HG GLN 9 11.220 22.808 -7.885
68 1HE2 GLN 9 1HE2 GLN 9 12.614 24.585 -7.999
69 2HE2 GLN 9 2HE2 GLN 9 14.108 24.637 -7.122
70 H GLN 10 H GLN 10 8.553 22.948 -7.422
71 HA GLN 10 HA GLN 10 6.886 24.102 -9.231
72 1HB GLN 10 2HB GLN 10 8.910 24.994 -10.377
73 2HB GLN 10 1HB GLN 10 9.481 23.350 -10.607
74 1HG GLN 10 2HG GLN 10 7.638 22.854 -12.064
75 2HG GLN 10 1HG GLN 10 6.917 24.434 -11.751
76 1HE2 GLN 10 1HE2 GLN 10 9.465 22.711 -13.354
77 2HE2 GLN 10 2HE2 GLN 10 9.957 23.989 -14.407
78 H LYS 11 H LYS 11 5.455 22.437 -9.472
79 HA LYS 11 HA LYS 11 6.628 19.781 -9.878
80 1HB LYS 11 2HB LYS 11 5.086 18.705 -8.459
81 2HB LYS 11 1HB LYS 11 5.692 20.079 -7.561
82 1HG LYS 11 2HG LYS 11 3.050 20.076 -8.995
83 2HG LYS 11 1HG LYS 11 3.246 19.579 -7.319
84 1HD LYS 11 2HD LYS 11 4.203 21.851 -6.853
85 2HD LYS 11 1HD LYS 11 3.749 22.306 -8.499
86 1HE LYS 11 2HE LYS 11 1.411 21.729 -7.995
87 2HE LYS 11 1HE LYS 11 1.875 21.331 -6.343
88 1HZ LYS 11 1HZ LYS 11 1.932 23.994 -7.647
89 2HZ LYS 11 2HZ LYS 11 2.666 23.682 -6.153
90 3HZ LYS 11 3HZ LYS 11 0.990 23.508 -6.322
91 H GLU 12 H GLU 12 6.387 19.547 -11.976
92 HA GLU 12 HA GLU 12 3.651 19.329 -12.998
93 1HB GLU 12 2HB GLU 12 5.868 20.744 -14.497
94 2HB GLU 12 1HB GLU 12 4.234 20.467 -15.081
95 1HG GLU 12 2HG GLU 12 3.397 21.887 -13.226
96 2HG GLU 12 1HG GLU 12 5.071 22.237 -12.800
97 H GLU 13 H GLU 13 6.225 17.698 -12.268
98 HA GLU 13 HA GLU 13 6.138 15.922 -14.565
99 1HB GLU 13 2HB GLU 13 7.908 17.610 -15.060
100 2HB GLU 13 1HB GLU 13 8.732 17.138 -13.583
101 1HG GLU 13 2HG GLU 13 9.717 16.147 -15.607
102 2HG GLU 13 1HG GLU 13 9.151 14.939 -14.455
103 H THR 14 H THR 14 7.320 13.891 -14.112
104 HA THR 14 HA THR 14 7.854 12.079 -12.893
105 HB THR 14 HB THR 14 8.392 14.250 -10.936
106 HG1 THR 14 1HG THR 14 10.565 13.499 -11.305
107 1HG2 THR 14 1HG2 THR 14 8.844 11.301 -10.428
108 2HG2 THR 14 2HG2 THR 14 7.692 12.327 -9.574
109 3HG2 THR 14 3HG2 THR 14 9.423 12.616 -9.405
110 HA PRO 15 HA PRO 15 3.842 10.894 -11.334
111 1HB PRO 15 2HB PRO 15 5.361 8.577 -10.259
112 2HB PRO 15 1HB PRO 15 3.932 8.603 -11.299
113 1HG PRO 15 2HG PRO 15 6.335 7.984 -12.291
114 2HG PRO 15 1HG PRO 15 5.174 8.944 -13.225
115 1HD PRO 15 2HD PRO 15 7.613 9.836 -11.746
116 2HD PRO 15 1HD PRO 15 6.957 10.408 -13.294
117 H PHE 16 H PHE 16 2.955 11.687 -9.537
118 HA PHE 16 HA PHE 16 4.616 12.563 -7.403
119 1HB PHE 16 2HB PHE 16 2.571 13.452 -6.399
120 2HB PHE 16 1HB PHE 16 2.647 13.841 -8.112
121 HD1 PHE 16 2HD PHE 16 0.949 11.843 -5.549
122 HD2 PHE 16 1HD PHE 16 1.049 12.930 -9.662
123 HE1 PHE 16 2HE PHE 16 -1.290 10.873 -5.858
124 HE2 PHE 16 1HE PHE 16 -1.193 11.968 -9.976
125 HZ PHE 16 HZ PHE 16 -2.362 10.927 -8.072
126 H TYR 17 H TYR 17 3.050 9.597 -7.946
127 HA TYR 17 HA TYR 17 2.883 8.999 -5.096
128 1HB TYR 17 2HB TYR 17 1.438 7.276 -5.636
129 2HB TYR 17 1HB TYR 17 1.068 8.447 -6.886
130 HD1 TYR 17 2HD TYR 17 2.020 8.092 -9.204
131 HD2 TYR 17 1HD TYR 17 2.238 5.118 -6.170
132 HE1 TYR 17 2HE TYR 17 2.455 6.379 -10.916
133 HE2 TYR 17 1HE TYR 17 2.672 3.400 -7.871
134 HH TYR 17 HH TYR 17 2.447 2.978 -10.164
135 H TYR 18 H TYR 18 5.208 8.870 -7.425
136 HA TYR 18 HA TYR 18 6.044 6.128 -6.981
137 1HB TYR 18 2HB TYR 18 6.122 7.319 -9.234
138 2HB TYR 18 1HB TYR 18 7.509 8.202 -8.606
139 HD1 TYR 18 2HD TYR 18 6.258 4.737 -9.110
140 HD2 TYR 18 1HD TYR 18 9.643 7.296 -8.870
141 HE1 TYR 18 2HE TYR 18 7.705 2.868 -9.776
142 HE2 TYR 18 1HE TYR 18 11.106 5.431 -9.527
143 HH TYR 18 HH TYR 18 9.827 2.409 -10.680
144 H GLY 19 H GLY 19 7.732 5.471 -5.798
145 1HA GLY 19 2HA GLY 19 10.036 6.276 -5.006
146 2HA GLY 19 1HA GLY 19 9.101 7.527 -4.199
147 H THR 20 H THR 20 9.585 6.979 -2.127
148 HA THR 20 HA THR 20 8.471 4.420 -1.194
149 HB THR 20 HB THR 20 10.859 5.786 0.053
150 HG1 THR 20 1HG THR 20 10.768 4.386 -2.229
151 1HG2 THR 20 1HG2 THR 20 11.181 3.613 1.148
152 2HG2 THR 20 2HG2 THR 20 9.736 2.999 0.344
153 3HG2 THR 20 3HG2 THR 20 9.601 4.299 1.528
154 H TRP 21 H TRP 21 6.947 4.668 0.347
155 HA TRP 21 HA TRP 21 6.730 7.344 1.572
156 1HB TRP 21 2HB TRP 21 4.498 5.470 0.768
157 2HB TRP 21 1HB TRP 21 4.293 7.018 1.578
158 HD1 TRP 21 HD TRP 21 4.885 5.496 -1.826
159 HE1 TRP 21 1HE TRP 21 4.845 7.345 -3.615
160 HE3 TRP 21 3HE TRP 21 4.845 9.577 1.243
161 HZ2 TRP 21 2HZ TRP 21 4.804 10.170 -3.703
162 HZ3 TRP 21 3HZ TRP 21 4.803 11.816 0.232
163 HH2 TRP 21 HH TRP 21 4.782 12.109 -2.192
164 H ASP 22 H ASP 22 6.383 7.510 3.675
165 HA ASP 22 HA ASP 22 6.740 5.176 5.345
166 1HB ASP 22 2HB ASP 22 7.965 7.038 6.081
167 2HB ASP 22 1HB ASP 22 6.624 8.143 5.822
168 H GLU 23 H GLU 23 5.153 4.028 6.234
169 HA GLU 23 HA GLU 23 2.447 5.106 6.333
170 1HB GLU 23 2HB GLU 23 3.529 2.369 7.031
171 2HB GLU 23 1HB GLU 23 1.840 2.830 7.180
172 1HG GLU 23 2HG GLU 23 1.821 3.289 4.733
173 2HG GLU 23 1HG GLU 23 3.460 2.640 4.652
174 H GLY 24 H GLY 24 3.267 6.753 7.850
175 1HA GLY 24 2HA GLY 24 3.812 5.845 10.551
176 2HA GLY 24 1HA GLY 24 3.761 7.512 9.999
177 H ARG 25 H ARG 25 1.059 6.604 8.721
178 HA ARG 25 HA ARG 25 -0.484 7.302 11.099
179 1HB ARG 25 2HB ARG 25 -0.604 8.701 8.977
180 2HB ARG 25 1HB ARG 25 -1.444 7.348 8.237
181 1HG ARG 25 2HG ARG 25 -3.091 8.889 8.967
182 2HG ARG 25 1HG ARG 25 -3.133 7.521 10.085
183 1HD ARG 25 2HD ARG 25 -1.706 8.796 11.644
184 2HD ARG 25 1HD ARG 25 -1.768 10.174 10.546
185 HE ARG 25 HE ARG 25 -4.246 9.067 11.687
186 1HH1 ARG 25 1HH1 ARG 25 -2.034 11.742 11.223
187 2HH1 ARG 25 2HH1 ARG 25 -3.038 12.880 12.059
188 1HH2 ARG 25 1HH2 ARG 25 -5.573 10.549 12.756
189 2HH2 ARG 25 2HH2 ARG 25 -5.072 12.213 12.913
190 H ALA 26 H ALA 26 -2.139 6.110 11.744
191 HA ALA 26 HA ALA 26 -3.509 4.335 12.111
192 1HB ALA 26 1HB ALA 26 -4.203 4.538 9.773
193 2HB ALA 26 2HB ALA 26 -4.156 2.854 10.294
194 3HB ALA 26 3HB ALA 26 -2.861 3.499 9.286
195 HA PRO 27 HA PRO 27 -0.672 1.314 13.629
196 1HB PRO 27 2HB PRO 27 -2.929 -0.523 13.999
197 2HB PRO 27 1HB PRO 27 -1.907 0.254 15.213
198 1HG PRO 27 2HG PRO 27 -4.481 0.959 14.847
199 2HG PRO 27 1HG PRO 27 -3.237 2.130 15.321
200 1HD PRO 27 2HD PRO 27 -4.433 1.630 12.616
201 2HD PRO 27 1HD PRO 27 -4.057 3.173 13.413
202 H GLY 28 H GLY 28 0.399 -0.529 13.010
203 1HA GLY 28 2HA GLY 28 -0.315 -1.601 10.394
204 2HA GLY 28 1HA GLY 28 1.205 -1.848 11.242
205 HA PRO 29 HA PRO 29 -1.194 -5.827 11.582
206 1HB PRO 29 2HB PRO 29 1.108 -7.342 11.437
207 2HB PRO 29 1HB PRO 29 0.081 -6.936 10.055
208 1HG PRO 29 2HG PRO 29 2.631 -5.682 10.965
209 2HG PRO 29 1HG PRO 29 2.061 -5.997 9.316
210 1HD PRO 29 2HD PRO 29 1.981 -3.542 10.418
211 2HD PRO 29 1HD PRO 29 0.746 -4.105 9.274
212 H THR 30 H THR 30 -1.245 -7.256 13.309
213 HA THR 30 HA THR 30 -0.215 -6.214 15.781
214 HB THR 30 HB THR 30 -1.406 -8.319 16.679
215 HG1 THR 30 1HG THR 30 -2.954 -9.152 15.125
216 1HG2 THR 30 1HG2 THR 30 -3.607 -7.268 16.457
217 2HG2 THR 30 2HG2 THR 30 -2.999 -6.256 15.148
218 3HG2 THR 30 3HG2 THR 30 -2.369 -6.057 16.783
219 H ASP 31 H ASP 31 1.275 -7.953 13.518
220 HA ASP 31 HA ASP 31 2.373 -10.135 14.968
221 1HB ASP 31 2HB ASP 31 3.236 -8.787 12.412
222 2HB ASP 31 1HB ASP 31 4.012 -10.228 13.061
223 H GLY 32 H GLY 32 2.985 -6.824 15.062
224 1HA GLY 32 2HA GLY 32 4.298 -6.104 16.987
225 2HA GLY 32 1HA GLY 32 5.446 -7.373 16.592
226 H VAL 33 H VAL 33 3.900 -4.865 14.613
227 HA VAL 33 HA VAL 33 6.580 -4.124 13.676
228 HB VAL 33 HB VAL 33 3.956 -3.446 12.351
229 1HG1 VAL 33 1HG1 VAL 33 5.816 -2.030 11.710
230 2HG1 VAL 33 2HG1 VAL 33 5.316 -3.066 10.374
231 3HG1 VAL 33 3HG1 VAL 33 6.769 -3.456 11.294
232 1HG2 VAL 33 1HG2 VAL 33 4.382 -5.303 10.805
233 2HG2 VAL 33 2HG2 VAL 33 4.153 -5.869 12.459
234 3HG2 VAL 33 3HG2 VAL 33 5.776 -5.781 11.775
235 H LYS 34 H LYS 34 7.338 -2.109 14.007
236 HA LYS 34 HA LYS 34 5.911 -0.280 15.686
237 1HB LYS 34 2HB LYS 34 8.596 -0.376 14.404
238 2HB LYS 34 1HB LYS 34 7.988 1.186 14.928
239 1HG LYS 34 2HG LYS 34 8.044 -1.164 16.774
240 2HG LYS 34 1HG LYS 34 9.448 -0.127 16.544
241 1HD LYS 34 2HD LYS 34 8.042 1.824 17.147
242 2HD LYS 34 1HD LYS 34 6.715 0.715 17.488
243 1HE LYS 34 2HE LYS 34 7.978 -0.331 19.250
244 2HE LYS 34 1HE LYS 34 9.402 0.628 18.847
245 1HZ LYS 34 1HZ LYS 34 8.213 1.515 20.772
246 2HZ LYS 34 2HZ LYS 34 6.820 1.733 19.829
247 3HZ LYS 34 3HZ LYS 34 8.222 2.621 19.486
248 H SER 35 H SER 35 6.783 -0.439 12.320
249 HA SER 35 HA SER 35 4.737 1.333 11.453
250 1HB SER 35 2HB SER 35 7.585 2.362 11.194
251 2HB SER 35 1HB SER 35 6.137 3.127 10.547
252 HG SER 35 HG SER 35 5.726 2.751 13.131
253 H ALA 36 H ALA 36 4.900 1.616 9.042
254 HA ALA 36 HA ALA 36 6.528 -0.532 7.859
255 1HB ALA 36 1HB ALA 36 4.676 -1.069 6.348
256 2HB ALA 36 2HB ALA 36 3.662 0.122 7.163
257 3HB ALA 36 3HB ALA 36 4.219 -1.308 8.034
258 H THR 37 H THR 37 7.060 -0.221 5.632
259 HA THR 37 HA THR 37 6.619 2.508 4.622
260 HB THR 37 HB THR 37 9.043 1.306 3.583
261 HG1 THR 37 1HG THR 37 9.873 0.625 5.431
262 1HG2 THR 37 1HG2 THR 37 9.977 3.496 4.208
263 2HG2 THR 37 2HG2 THR 37 8.485 3.870 5.072
264 3HG2 THR 37 3HG2 THR 37 8.462 3.652 3.322
265 H VAL 38 H VAL 38 6.182 2.638 2.441
266 HA VAL 38 HA VAL 38 5.705 0.037 1.158
267 HB VAL 38 HB VAL 38 3.596 1.120 1.724
268 1HG1 VAL 38 1HG1 VAL 38 4.532 3.392 -0.018
269 2HG1 VAL 38 2HG1 VAL 38 4.287 3.443 1.727
270 3HG1 VAL 38 3HG1 VAL 38 2.909 3.211 0.650
271 1HG2 VAL 38 1HG2 VAL 38 2.578 1.130 -0.533
272 2HG2 VAL 38 2HG2 VAL 38 3.622 -0.260 -0.245
273 3HG2 VAL 38 3HG2 VAL 38 4.198 1.086 -1.229
274 H THR 39 H THR 39 6.601 -0.341 -0.737
275 HA THR 39 HA THR 39 7.982 1.888 -2.074
276 HB THR 39 HB THR 39 8.651 -1.059 -2.196
277 HG1 THR 39 1HG THR 39 9.244 -0.409 -0.185
278 1HG2 THR 39 1HG2 THR 39 9.345 0.185 -4.186
279 2HG2 THR 39 2HG2 THR 39 10.742 -0.297 -3.222
280 3HG2 THR 39 3HG2 THR 39 10.163 1.368 -3.164
281 H PHE 40 H PHE 40 7.119 2.487 -3.959
282 HA PHE 40 HA PHE 40 5.334 0.603 -5.326
283 1HB PHE 40 2HB PHE 40 5.573 3.607 -5.475
284 2HB PHE 40 1HB PHE 40 4.563 2.668 -6.566
285 HD1 PHE 40 1HD PHE 40 2.819 1.110 -5.432
286 HD2 PHE 40 2HD PHE 40 4.687 4.418 -3.510
287 HE1 PHE 40 1HE PHE 40 0.972 1.206 -3.815
288 HE2 PHE 40 2HE PHE 40 2.835 4.523 -1.891
289 HZ PHE 40 HZ PHE 40 0.978 2.915 -2.041
290 H THR 41 H THR 41 6.101 -0.435 -7.005
291 HA THR 41 HA THR 41 8.113 0.838 -8.732
292 HB THR 41 HB THR 41 7.116 -1.980 -9.082
293 HG1 THR 41 1HG THR 41 8.161 -1.102 -6.831
294 1HG2 THR 41 1HG2 THR 41 8.614 -1.166 -10.787
295 2HG2 THR 41 2HG2 THR 41 9.478 -2.338 -9.795
296 3HG2 THR 41 3HG2 THR 41 9.762 -0.611 -9.572
297 H GLU 42 H GLU 42 7.616 0.232 -11.182
298 HA GLU 42 HA GLU 42 5.437 1.666 -11.998
299 1HB GLU 42 2HB GLU 42 6.956 -0.499 -13.438
300 2HB GLU 42 1HB GLU 42 5.806 0.567 -14.205
301 1HG GLU 42 2HG GLU 42 7.814 1.572 -14.695
302 2HG GLU 42 1HG GLU 42 7.266 2.472 -13.285
303 H ASP 43 H ASP 43 5.679 -1.885 -11.758
304 HA ASP 43 HA ASP 43 2.735 -1.961 -11.783
305 1HB ASP 43 2HB ASP 43 2.781 -4.018 -13.071
306 2HB ASP 43 1HB ASP 43 3.653 -2.765 -13.946
307 H GLU 44 H GLU 44 5.168 -2.244 -9.800
308 HA GLU 44 HA GLU 44 4.204 -4.709 -8.508
309 1HB GLU 44 2HB GLU 44 7.018 -3.629 -8.670
310 2HB GLU 44 1HB GLU 44 6.538 -4.900 -7.558
311 1HG GLU 44 2HG GLU 44 6.043 -6.384 -9.327
312 2HG GLU 44 1HG GLU 44 6.187 -5.103 -10.529
313 H VAL 45 H VAL 45 3.576 -4.554 -6.453
314 HA VAL 45 HA VAL 45 4.267 -2.111 -4.959
315 HB VAL 45 HB VAL 45 2.062 -4.116 -4.409
316 1HG1 VAL 45 1HG1 VAL 45 2.705 -1.507 -3.036
317 2HG1 VAL 45 2HG1 VAL 45 2.940 -3.119 -2.358
318 3HG1 VAL 45 3HG1 VAL 45 1.312 -2.535 -2.703
319 1HG2 VAL 45 1HG2 VAL 45 1.599 -2.734 -6.378
320 2HG2 VAL 45 2HG2 VAL 45 1.896 -1.279 -5.428
321 3HG2 VAL 45 3HG2 VAL 45 0.529 -2.323 -5.040
322 H VAL 46 H VAL 46 5.871 -2.353 -3.544
323 HA VAL 46 HA VAL 46 6.367 -5.043 -2.453
324 HB VAL 46 HB VAL 46 8.311 -2.740 -2.668
325 1HG1 VAL 46 1HG1 VAL 46 9.998 -4.454 -2.081
326 2HG1 VAL 46 2HG1 VAL 46 8.687 -5.600 -1.798
327 3HG1 VAL 46 3HG1 VAL 46 8.831 -4.158 -0.792
328 1HG2 VAL 46 1HG2 VAL 46 9.404 -4.069 -4.412
329 2HG2 VAL 46 2HG2 VAL 46 7.757 -3.626 -4.864
330 3HG2 VAL 46 3HG2 VAL 46 8.108 -5.263 -4.307
331 H GLU 47 H GLU 47 5.885 -5.331 -0.393
332 HA GLU 47 HA GLU 47 5.497 -2.994 1.302
333 1HB GLU 47 2HB GLU 47 4.646 -5.857 1.505
334 2HB GLU 47 1HB GLU 47 4.572 -4.781 2.890
335 1HG GLU 47 2HG GLU 47 2.923 -3.483 1.975
336 2HG GLU 47 1HG GLU 47 3.340 -3.938 0.328
337 H THR 48 H THR 48 6.725 -2.494 2.880
338 HA THR 48 HA THR 48 8.720 -4.412 3.862
339 HB THR 48 HB THR 48 9.851 -1.919 4.275
340 HG1 THR 48 1HG THR 48 8.241 -1.151 2.689
341 1HG2 THR 48 1HG2 THR 48 11.037 -3.974 3.650
342 2HG2 THR 48 2HG2 THR 48 11.493 -2.635 2.595
343 3HG2 THR 48 3HG2 THR 48 10.366 -3.864 2.022
344 H GLU 49 H GLU 49 8.384 -4.816 5.939
345 HA GLU 49 HA GLU 49 6.975 -2.792 7.546
346 1HB GLU 49 2HB GLU 49 7.216 -5.732 8.163
347 2HB GLU 49 1HB GLU 49 6.120 -4.571 8.895
348 1HG GLU 49 2HG GLU 49 4.967 -4.329 6.739
349 2HG GLU 49 1HG GLU 49 6.038 -5.548 6.049
350 H VAL 50 H VAL 50 8.030 -1.865 9.181
351 HA VAL 50 HA VAL 50 10.750 -2.715 9.732
352 HB VAL 50 HB VAL 50 9.237 -0.365 10.899
353 1HG1 VAL 50 1HG1 VAL 50 12.192 -0.966 10.777
354 2HG1 VAL 50 2HG1 VAL 50 11.177 -1.028 12.218
355 3HG1 VAL 50 3HG1 VAL 50 11.470 0.511 11.409
356 1HG2 VAL 50 1HG2 VAL 50 9.339 -0.122 8.496
357 2HG2 VAL 50 2HG2 VAL 50 11.066 -0.484 8.504
358 3HG2 VAL 50 3HG2 VAL 50 10.470 0.997 9.254
359 H MET 51 H MET 51 11.045 -4.256 11.150
360 HA MET 51 HA MET 51 9.357 -4.298 13.570
361 1HB MET 51 2HB MET 51 9.190 -6.231 11.864
362 2HB MET 51 1HB MET 51 10.790 -6.676 12.436
363 1HG MET 51 2HG MET 51 9.987 -7.016 14.658
364 2HG MET 51 1HG MET 51 8.389 -6.416 14.219
365 1HE MET 51 1HE MET 51 6.712 -7.694 12.609
366 2HE MET 51 2HE MET 51 7.098 -9.216 11.804
367 3HE MET 51 3HE MET 51 7.947 -7.739 11.351
368 H GLU 52 H GLU 52 10.398 -4.090 15.430
369 HA GLU 52 HA GLU 52 13.096 -3.258 15.417
370 1HB GLU 52 2HB GLU 52 11.413 -2.395 16.995
371 2HB GLU 52 1HB GLU 52 11.346 -3.970 17.775
372 1HG GLU 52 2HG GLU 52 13.605 -3.767 18.524
373 2HG GLU 52 1HG GLU 52 13.834 -2.293 17.586
374 H GLY 53 H GLY 53 14.912 -4.345 15.634
375 1HA GLY 53 2HA GLY 53 16.207 -6.032 16.816
376 2HA GLY 53 1HA GLY 53 14.803 -7.088 16.728
377 H ARG 54 H ARG 54 14.264 -6.235 13.946
378 HA ARG 54 HA ARG 54 16.454 -7.657 12.613
379 1HB ARG 54 2HB ARG 54 14.602 -8.598 11.117
380 2HB ARG 54 1HB ARG 54 14.788 -9.276 12.721
381 1HG ARG 54 2HG ARG 54 12.961 -7.707 13.459
382 2HG ARG 54 1HG ARG 54 12.681 -7.380 11.748
383 1HD ARG 54 2HD ARG 54 11.167 -9.115 12.612
384 2HD ARG 54 1HD ARG 54 12.228 -9.735 11.348
385 HE ARG 54 HE ARG 54 13.627 -10.592 13.300
386 1HH1 ARG 54 1HH1 ARG 54 10.140 -10.234 13.475
387 2HH1 ARG 54 2HH1 ARG 54 9.943 -11.519 14.632
388 1HH2 ARG 54 1HH2 ARG 54 13.353 -12.282 14.835
389 2HH2 ARG 54 2HH2 ARG 54 11.754 -12.664 15.396
390 H GLY 55 H GLY 55 13.850 -5.325 12.326
391 1HA GLY 55 2HA GLY 55 14.308 -3.197 11.330
392 2HA GLY 55 1HA GLY 55 15.460 -3.985 10.262
393 H GLU 56 H GLU 56 14.647 -3.381 8.334
394 HA GLU 56 HA GLU 56 11.886 -3.480 7.664
395 1HB GLU 56 2HB GLU 56 14.434 -3.124 6.128
396 2HB GLU 56 1HB GLU 56 12.920 -3.365 5.271
397 1HG GLU 56 2HG GLU 56 13.199 -1.247 7.363
398 2HG GLU 56 1HG GLU 56 13.722 -0.980 5.703
399 H VAL 57 H VAL 57 10.722 -4.956 6.678
400 HA VAL 57 HA VAL 57 12.000 -7.507 5.943
401 HB VAL 57 HB VAL 57 9.412 -7.121 7.455
402 1HG1 VAL 57 1HG1 VAL 57 9.262 -9.587 7.470
403 2HG1 VAL 57 2HG1 VAL 57 10.637 -9.656 6.367
404 3HG1 VAL 57 3HG1 VAL 57 9.125 -8.911 5.846
405 1HG2 VAL 57 1HG2 VAL 57 11.349 -6.945 8.886
406 2HG2 VAL 57 2HG2 VAL 57 12.003 -8.447 8.235
407 3HG2 VAL 57 3HG2 VAL 57 10.522 -8.472 9.192
408 H GLN 58 H GLN 58 11.651 -7.965 3.868
409 HA GLN 58 HA GLN 58 9.681 -6.525 2.353
410 1HB GLN 58 2HB GLN 58 11.598 -8.719 1.561
411 2HB GLN 58 1HB GLN 58 10.623 -7.781 0.452
412 1HG GLN 58 2HG GLN 58 11.791 -5.746 1.183
413 2HG GLN 58 1HG GLN 58 12.812 -6.738 2.218
414 1HE2 GLN 58 1HE2 GLN 58 12.965 -8.931 0.335
415 2HE2 GLN 58 2HE2 GLN 58 14.011 -8.415 -0.948
416 H LEU 59 H LEU 59 7.709 -7.190 1.859
417 HA LEU 59 HA LEU 59 6.974 -9.991 2.291
418 1HB LEU 59 2HB LEU 59 5.328 -7.528 1.691
419 2HB LEU 59 1HB LEU 59 4.652 -9.146 1.763
420 HG LEU 59 HG LEU 59 5.993 -7.699 4.042
421 1HD1 LEU 59 1HD1 LEU 59 3.758 -7.649 5.027
422 2HD1 LEU 59 2HD1 LEU 59 3.098 -8.380 3.563
423 3HD1 LEU 59 3HD1 LEU 59 3.810 -6.766 3.502
424 1HD2 LEU 59 1HD2 LEU 59 5.210 -9.577 5.405
425 2HD2 LEU 59 2HD2 LEU 59 6.365 -10.092 4.175
426 3HD2 LEU 59 3HD2 LEU 59 4.641 -10.386 3.946
427 HA PRO 60 HA PRO 60 6.958 -11.229 -1.978
428 1HB PRO 60 2HB PRO 60 4.080 -11.887 -1.696
429 2HB PRO 60 1HB PRO 60 5.417 -12.913 -2.219
430 1HG PRO 60 2HG PRO 60 4.295 -13.169 0.210
431 2HG PRO 60 1HG PRO 60 6.025 -13.445 -0.061
432 1HD PRO 60 2HD PRO 60 4.651 -11.143 1.231
433 2HD PRO 60 1HD PRO 60 6.255 -11.830 1.546
434 H PHE 61 H PHE 61 6.968 -9.744 -3.552
435 HA PHE 61 HA PHE 61 5.413 -7.409 -3.463
436 1HB PHE 61 2HB PHE 61 6.325 -6.943 -5.737
437 2HB PHE 61 1HB PHE 61 7.547 -7.321 -4.536
438 HD1 PHE 61 1HD PHE 61 8.630 -9.587 -4.571
439 HD2 PHE 61 2HD PHE 61 6.084 -8.217 -7.695
440 HE1 PHE 61 1HE PHE 61 9.556 -11.299 -6.071
441 HE2 PHE 61 2HE PHE 61 7.003 -9.935 -9.198
442 HZ PHE 61 HZ PHE 61 8.742 -11.476 -8.387
443 H MET 62 H MET 62 3.501 -6.917 -4.163
444 HA MET 62 HA MET 62 1.920 -8.901 -5.528
445 1HB MET 62 2HB MET 62 1.199 -7.847 -3.391
446 2HB MET 62 1HB MET 62 1.154 -6.290 -4.209
447 1HG MET 62 2HG MET 62 -0.510 -7.132 -5.727
448 2HG MET 62 1HG MET 62 -0.449 -8.690 -4.921
449 1HE MET 62 1HE MET 62 -1.760 -7.701 -1.315
450 2HE MET 62 2HE MET 62 -0.081 -7.584 -1.844
451 3HE MET 62 3HE MET 62 -1.052 -8.986 -2.295
452 H ALA 63 H ALA 63 0.875 -8.488 -7.475
453 HA ALA 63 HA ALA 63 1.918 -6.248 -9.028
454 1HB ALA 63 1HB ALA 63 2.028 -8.487 -10.019
455 2HB ALA 63 2HB ALA 63 1.007 -7.406 -10.966
456 3HB ALA 63 3HB ALA 63 0.269 -8.613 -9.916
457 H TYR 64 H TYR 64 0.657 -4.643 -9.879
458 HA TYR 64 HA TYR 64 -2.229 -4.729 -9.361
459 1HB TYR 64 2HB TYR 64 -2.288 -2.588 -8.340
460 2HB TYR 64 1HB TYR 64 -0.977 -3.443 -7.535
461 HD1 TYR 64 2HD TYR 64 1.423 -2.950 -8.355
462 HD2 TYR 64 1HD TYR 64 -1.918 -0.505 -9.324
463 HE1 TYR 64 2HE TYR 64 2.942 -1.097 -8.909
464 HE2 TYR 64 1HE TYR 64 -0.407 1.355 -9.882
465 HH TYR 64 HH TYR 64 2.985 0.936 -10.196
466 H LYS 65 H LYS 65 -3.408 -3.059 -10.624
467 HA LYS 65 HA LYS 65 -1.870 -2.213 -12.996
468 1HB LYS 65 2HB LYS 65 -3.667 -2.650 -14.454
469 2HB LYS 65 1HB LYS 65 -3.580 -4.070 -13.426
470 1HG LYS 65 2HG LYS 65 -5.486 -3.419 -12.199
471 2HG LYS 65 1HG LYS 65 -5.460 -1.793 -12.879
472 1HD LYS 65 2HD LYS 65 -5.914 -2.770 -15.114
473 2HD LYS 65 1HD LYS 65 -6.065 -4.355 -14.356
474 1HE LYS 65 2HE LYS 65 -7.949 -3.631 -13.069
475 2HE LYS 65 1HE LYS 65 -7.728 -1.967 -13.601
476 1HZ LYS 65 1HZ LYS 65 -9.532 -3.123 -14.770
477 2HZ LYS 65 2HZ LYS 65 -8.416 -4.230 -15.400
478 3HZ LYS 65 3HZ LYS 65 -8.317 -2.588 -15.827
479 H VAL 66 H VAL 66 -2.500 -0.284 -13.963
480 HA VAL 66 HA VAL 66 -3.750 1.620 -12.107
481 HB VAL 66 HB VAL 66 -1.925 2.079 -14.477
482 1HG1 VAL 66 1HG1 VAL 66 -1.900 4.428 -13.814
483 2HG1 VAL 66 2HG1 VAL 66 -3.070 4.089 -12.540
484 3HG1 VAL 66 3HG1 VAL 66 -3.537 3.916 -14.231
485 1HG2 VAL 66 1HG2 VAL 66 -0.777 1.166 -12.536
486 2HG2 VAL 66 2HG2 VAL 66 -1.467 2.430 -11.520
487 3HG2 VAL 66 3HG2 VAL 66 -0.319 2.851 -12.791
488 H ILE 67 H ILE 67 -5.804 2.031 -12.508
489 HA ILE 67 HA ILE 67 -6.969 1.480 -15.104
490 HB ILE 67 HB ILE 67 -8.371 2.678 -12.727
491 1HG1 ILE 67 2HG1 ILE 67 -7.844 -0.247 -13.314
492 2HG1 ILE 67 1HG1 ILE 67 -7.240 0.669 -11.940
493 1HG2 ILE 67 1HG2 ILE 67 -10.339 1.601 -13.716
494 2HG2 ILE 67 2HG2 ILE 67 -9.337 0.995 -15.034
495 3HG2 ILE 67 3HG2 ILE 67 -9.580 2.730 -14.840
496 1HD1 ILE 67 1HD1 ILE 67 -10.139 0.093 -12.496
497 2HD1 ILE 67 2HD1 ILE 67 -9.484 0.924 -11.086
498 3HD1 ILE 67 3HD1 ILE 67 -9.123 -0.781 -11.352
499 H SER 68 H SER 68 -6.757 4.235 -12.890
500 HA SER 68 HA SER 68 -6.929 6.026 -15.225
501 1HB SER 68 2HB SER 68 -8.030 6.772 -12.531
502 2HB SER 68 1HB SER 68 -8.368 7.509 -14.091
503 HG SER 68 HG SER 68 -9.623 5.787 -14.663
504 H GLN 69 H GLN 69 -5.795 8.027 -14.950
505 HA GLN 69 HA GLN 69 -3.904 8.201 -12.759
506 1HB GLN 69 2HB GLN 69 -2.848 6.647 -14.406
507 2HB GLN 69 1HB GLN 69 -2.933 7.923 -15.612
508 1HG GLN 69 2HG GLN 69 -1.503 9.324 -14.135
509 2HG GLN 69 1HG GLN 69 -1.320 7.928 -13.073
510 1HE2 GLN 69 1HE2 GLN 69 -0.124 6.153 -13.789
511 2HE2 GLN 69 2HE2 GLN 69 0.974 6.275 -15.115
512 H SER 70 H SER 70 -3.076 10.240 -12.471
513 HA SER 70 HA SER 70 -3.590 12.234 -14.552
514 1HB SER 70 2HB SER 70 -5.359 12.392 -12.793
515 2HB SER 70 1HB SER 70 -4.098 12.641 -11.595
516 HG SER 70 HG SER 70 -5.221 14.412 -13.332
517 H THR 71 H THR 71 -2.093 14.001 -14.515
518 HA THR 71 HA THR 71 0.471 13.407 -13.337
519 HB THR 71 HB THR 71 -0.451 15.863 -14.818
520 HG1 THR 71 1HG THR 71 -0.122 13.458 -15.746
521 1HG2 THR 71 1HG2 THR 71 1.934 16.305 -15.171
522 2HG2 THR 71 2HG2 THR 71 2.336 14.900 -14.185
523 3HG2 THR 71 3HG2 THR 71 1.533 16.288 -13.453
524 H ASP 72 H ASP 72 -2.295 15.395 -12.731
525 HA ASP 72 HA ASP 72 -1.392 15.909 -10.038
526 1HB ASP 72 2HB ASP 72 -0.440 17.836 -11.194
527 2HB ASP 72 1HB ASP 72 -1.995 18.188 -11.935
528 H GLY 73 H GLY 73 -3.133 14.437 -9.752
529 1HA GLY 73 2HA GLY 73 -5.508 15.771 -8.973
530 2HA GLY 73 1HA GLY 73 -5.784 14.837 -10.439
531 H SER 74 H SER 74 -5.815 12.605 -10.343
532 HA SER 74 HA SER 74 -5.227 11.296 -7.834
533 1HB SER 74 2HB SER 74 -7.518 10.167 -7.991
534 2HB SER 74 1HB SER 74 -7.482 11.818 -7.386
535 HG SER 74 HG SER 74 -8.838 12.227 -8.929
536 H ILE 75 H ILE 75 -5.091 9.036 -8.002
537 HA ILE 75 HA ILE 75 -5.049 7.938 -10.737
538 HB ILE 75 HB ILE 75 -3.073 7.276 -8.538
539 1HG1 ILE 75 2HG1 ILE 75 -2.728 8.973 -11.017
540 2HG1 ILE 75 1HG1 ILE 75 -2.633 9.518 -9.351
541 1HG2 ILE 75 1HG2 ILE 75 -3.216 6.411 -11.422
542 2HG2 ILE 75 2HG2 ILE 75 -3.462 5.399 -9.997
543 3HG2 ILE 75 3HG2 ILE 75 -1.869 6.078 -10.333
544 1HD1 ILE 75 1HD1 ILE 75 -0.639 8.164 -9.010
545 2HD1 ILE 75 2HD1 ILE 75 -0.430 9.311 -10.335
546 3HD1 ILE 75 3HD1 ILE 75 -0.732 7.608 -10.682
547 H GLU 76 H GLU 76 -6.175 6.056 -10.923
548 HA GLU 76 HA GLU 76 -7.050 4.794 -8.410
549 1HB GLU 76 2HB GLU 76 -8.862 5.750 -9.909
550 2HB GLU 76 1HB GLU 76 -8.404 4.528 -11.086
551 1HG GLU 76 2HG GLU 76 -8.971 2.760 -9.554
552 2HG GLU 76 1HG GLU 76 -9.339 3.934 -8.295
553 H ILE 77 H ILE 77 -6.333 2.859 -8.006
554 HA ILE 77 HA ILE 77 -5.243 1.241 -10.211
555 HB ILE 77 HB ILE 77 -3.513 0.387 -8.672
556 1HG1 ILE 77 2HG1 ILE 77 -4.454 2.567 -6.793
557 2HG1 ILE 77 1HG1 ILE 77 -4.746 0.849 -6.561
558 1HG2 ILE 77 1HG2 ILE 77 -2.093 2.395 -8.651
559 2HG2 ILE 77 2HG2 ILE 77 -3.512 3.386 -8.993
560 3HG2 ILE 77 3HG2 ILE 77 -2.957 2.206 -10.178
561 1HD1 ILE 77 1HD1 ILE 77 -2.323 0.474 -6.415
562 2HD1 ILE 77 2HD1 ILE 77 -2.912 1.584 -5.178
563 3HD1 ILE 77 3HD1 ILE 77 -2.062 2.210 -6.591
564 H GLN 78 H GLN 78 -5.242 -1.066 -9.791
565 HA GLN 78 HA GLN 78 -7.208 -1.881 -7.766
566 1HB GLN 78 2HB GLN 78 -8.187 -1.646 -10.108
567 2HB GLN 78 1HB GLN 78 -7.160 -2.993 -10.573
568 1HG GLN 78 2HG GLN 78 -8.283 -4.463 -9.082
569 2HG GLN 78 1HG GLN 78 -9.189 -3.128 -8.361
570 1HE2 GLN 78 1HE2 GLN 78 -11.212 -3.826 -8.854
571 2HE2 GLN 78 2HE2 GLN 78 -11.811 -3.981 -10.469
572 H TYR 79 H TYR 79 -6.709 -3.719 -6.710
573 HA TYR 79 HA TYR 79 -4.073 -4.788 -7.050
574 1HB TYR 79 2HB TYR 79 -6.343 -5.680 -5.259
575 2HB TYR 79 1HB TYR 79 -4.698 -6.296 -5.181
576 HD1 TYR 79 2HD TYR 79 -2.851 -4.775 -4.458
577 HD2 TYR 79 1HD TYR 79 -6.942 -3.632 -4.220
578 HE1 TYR 79 2HE TYR 79 -2.256 -2.993 -2.872
579 HE2 TYR 79 1HE TYR 79 -6.359 -1.851 -2.631
580 HH TYR 79 HH TYR 79 -3.131 -0.894 -2.044
581 H LEU 80 H LEU 80 -3.489 -6.806 -7.751
582 HA LEU 80 HA LEU 80 -5.577 -8.294 -9.190
583 1HB LEU 80 2HB LEU 80 -2.628 -8.041 -9.793
584 2HB LEU 80 1HB LEU 80 -3.735 -9.094 -10.655
585 HG LEU 80 HG LEU 80 -4.034 -6.091 -10.519
586 1HD1 LEU 80 1HD1 LEU 80 -3.216 -6.097 -12.838
587 2HD1 LEU 80 2HD1 LEU 80 -2.854 -7.818 -12.692
588 3HD1 LEU 80 3HD1 LEU 80 -1.987 -6.649 -11.698
589 1HD2 LEU 80 1HD2 LEU 80 -6.112 -7.301 -10.924
590 2HD2 LEU 80 2HD2 LEU 80 -5.354 -8.167 -12.262
591 3HD2 LEU 80 3HD2 LEU 80 -5.594 -6.423 -12.363
592 H GLY 81 H GLY 81 -4.510 -10.702 -9.592
593 1HA GLY 81 2HA GLY 81 -3.900 -12.668 -8.511
594 2HA GLY 81 1HA GLY 81 -3.333 -11.705 -7.148
595 HA PRO 82 HA PRO 82 -7.192 -13.729 -5.607
596 1HB PRO 82 2HB PRO 82 -5.758 -13.345 -3.055
597 2HB PRO 82 1HB PRO 82 -6.516 -14.800 -3.710
598 1HG PRO 82 2HG PRO 82 -3.853 -14.545 -3.595
599 2HG PRO 82 1HG PRO 82 -4.647 -15.375 -4.946
600 1HD PRO 82 2HD PRO 82 -3.515 -12.605 -4.823
601 2HD PRO 82 1HD PRO 82 -3.425 -13.801 -6.135
602 H TYR 83 H TYR 83 -5.592 -10.755 -5.187
603 HA TYR 83 HA TYR 83 -7.708 -9.645 -3.489
604 1HB TYR 83 2HB TYR 83 -5.020 -8.561 -4.350
605 2HB TYR 83 1HB TYR 83 -6.199 -7.623 -3.438
606 HD1 TYR 83 1HD TYR 83 -3.830 -10.424 -3.304
607 HD2 TYR 83 2HD TYR 83 -6.625 -8.086 -1.110
608 HE1 TYR 83 1HE TYR 83 -2.945 -11.344 -1.203
609 HE2 TYR 83 2HE TYR 83 -5.747 -8.999 0.995
610 HH TYR 83 HH TYR 83 -2.841 -10.707 1.188
611 H TYR 84 H TYR 84 -7.914 -10.390 -6.380
612 HA TYR 84 HA TYR 84 -7.977 -8.122 -8.011
613 1HB TYR 84 2HB TYR 84 -9.278 -9.508 -9.559
614 2HB TYR 84 1HB TYR 84 -7.906 -10.385 -8.905
615 HD1 TYR 84 2HD TYR 84 -8.641 -11.725 -6.597
616 HD2 TYR 84 1HD TYR 84 -11.163 -10.741 -9.879
617 HE1 TYR 84 2HE TYR 84 -10.122 -13.602 -6.020
618 HE2 TYR 84 1HE TYR 84 -12.646 -12.613 -9.312
619 HH TYR 84 HH TYR 84 -12.385 -14.355 -6.364
620 HA PRO 85 HA PRO 85 -11.269 -5.712 -9.039
621 1HB PRO 85 2HB PRO 85 -13.235 -7.392 -7.530
622 2HB PRO 85 1HB PRO 85 -13.553 -6.186 -8.790
623 1HG PRO 85 2HG PRO 85 -13.009 -8.904 -9.254
624 2HG PRO 85 1HG PRO 85 -12.913 -7.610 -10.463
625 1HD PRO 85 2HD PRO 85 -10.741 -9.142 -9.590
626 2HD PRO 85 1HD PRO 85 -10.604 -7.540 -10.358
627 H LEU 86 H LEU 86 -10.165 -6.505 -5.931
628 HA LEU 86 HA LEU 86 -11.381 -4.310 -4.562
629 1HB LEU 86 2HB LEU 86 -10.332 -6.181 -3.362
630 2HB LEU 86 1HB LEU 86 -8.771 -5.743 -4.033
631 HG LEU 86 HG LEU 86 -8.876 -3.592 -2.814
632 1HD1 LEU 86 1HD1 LEU 86 -11.371 -4.758 -1.593
633 2HD1 LEU 86 2HD1 LEU 86 -11.291 -3.362 -2.668
634 3HD1 LEU 86 3HD1 LEU 86 -10.554 -3.288 -1.068
635 1HD2 LEU 86 1HD2 LEU 86 -8.463 -4.527 -0.600
636 2HD2 LEU 86 2HD2 LEU 86 -7.721 -5.517 -1.856
637 3HD2 LEU 86 3HD2 LEU 86 -9.220 -6.043 -1.089
638 H LYS 87 H LYS 87 -11.114 -2.245 -5.191
639 HA LYS 87 HA LYS 87 -8.678 -1.458 -6.582
640 1HB LYS 87 2HB LYS 87 -11.209 0.067 -5.961
641 2HB LYS 87 1HB LYS 87 -9.848 0.723 -6.859
642 1HG LYS 87 2HG LYS 87 -10.174 -1.090 -8.530
643 2HG LYS 87 1HG LYS 87 -11.645 -1.541 -7.662
644 1HD LYS 87 2HD LYS 87 -12.560 0.680 -8.019
645 2HD LYS 87 1HD LYS 87 -11.077 1.176 -8.835
646 1HE LYS 87 2HE LYS 87 -11.487 -0.616 -10.508
647 2HE LYS 87 1HE LYS 87 -13.045 -0.908 -9.736
648 1HZ LYS 87 1HZ LYS 87 -13.752 1.297 -10.283
649 2HZ LYS 87 2HZ LYS 87 -13.152 0.590 -11.703
650 3HZ LYS 87 3HZ LYS 87 -12.212 1.722 -10.856
651 H SER 88 H SER 88 -7.740 0.669 -6.029
652 HA SER 88 HA SER 88 -8.154 1.685 -3.355
653 1HB SER 88 2HB SER 88 -6.403 0.079 -2.912
654 2HB SER 88 1HB SER 88 -5.466 0.638 -4.285
655 HG SER 88 HG SER 88 -6.163 2.339 -2.137
656 H THR 89 H THR 89 -7.246 3.870 -3.151
657 HA THR 89 HA THR 89 -6.993 5.094 -5.820
658 HB THR 89 HB THR 89 -8.210 6.490 -3.460
659 HG1 THR 89 1HG THR 89 -9.206 4.341 -4.532
660 1HG2 THR 89 1HG2 THR 89 -9.300 7.821 -5.228
661 2HG2 THR 89 2HG2 THR 89 -8.470 6.855 -6.449
662 3HG2 THR 89 3HG2 THR 89 -7.542 7.879 -5.353
663 H LEU 90 H LEU 90 -5.554 6.669 -6.103
664 HA LEU 90 HA LEU 90 -3.804 7.417 -3.852
665 1HB LEU 90 2HB LEU 90 -3.025 7.097 -6.758
666 2HB LEU 90 1HB LEU 90 -1.955 7.584 -5.458
667 HG LEU 90 HG LEU 90 -3.281 4.879 -5.691
668 1HD1 LEU 90 1HD1 LEU 90 -1.604 5.210 -7.421
669 2HD1 LEU 90 2HD1 LEU 90 -1.038 4.060 -6.208
670 3HD1 LEU 90 3HD1 LEU 90 -0.431 5.718 -6.206
671 1HD2 LEU 90 1HD2 LEU 90 -1.750 4.255 -3.876
672 2HD2 LEU 90 2HD2 LEU 90 -2.887 5.509 -3.383
673 3HD2 LEU 90 3HD2 LEU 90 -1.216 5.933 -3.761
674 H LYS 91 H LYS 91 -3.757 9.565 -3.477
675 HA LYS 91 HA LYS 91 -4.699 11.348 -5.616
676 1HB LYS 91 2HB LYS 91 -5.709 11.174 -2.782
677 2HB LYS 91 1HB LYS 91 -5.991 12.576 -3.807
678 1HG LYS 91 2HG LYS 91 -7.371 11.404 -5.249
679 2HG LYS 91 1HG LYS 91 -6.734 9.839 -4.751
680 1HD LYS 91 2HD LYS 91 -9.001 10.207 -3.911
681 2HD LYS 91 1HD LYS 91 -7.838 10.059 -2.594
682 1HE LYS 91 2HE LYS 91 -7.808 12.462 -2.307
683 2HE LYS 91 1HE LYS 91 -8.876 12.664 -3.697
684 1HZ LYS 91 1HZ LYS 91 -9.990 12.770 -1.484
685 2HZ LYS 91 2HZ LYS 91 -9.633 11.119 -1.280
686 3HZ LYS 91 3HZ LYS 91 -10.639 11.622 -2.549
687 H ARG 92 H ARG 92 -4.142 13.552 -5.372
688 HA ARG 92 HA ARG 92 -1.508 14.024 -4.502
689 1HB ARG 92 2HB ARG 92 -2.005 16.378 -5.085
690 2HB ARG 92 1HB ARG 92 -2.500 15.260 -6.345
691 1HG ARG 92 2HG ARG 92 -4.797 15.357 -5.383
692 2HG ARG 92 1HG ARG 92 -4.224 16.656 -4.342
693 1HD ARG 92 2HD ARG 92 -4.162 16.669 -7.354
694 2HD ARG 92 1HD ARG 92 -5.352 17.485 -6.352
695 HE ARG 92 HE ARG 92 -2.527 18.217 -6.617
696 1HH1 ARG 92 1HH1 ARG 92 -5.762 18.917 -5.468
697 2HH1 ARG 92 2HH1 ARG 92 -5.440 20.606 -5.192
698 1HH2 ARG 92 1HH2 ARG 92 -2.097 20.438 -6.280
699 2HH2 ARG 92 2HH2 ARG 92 -3.359 21.475 -5.675
700 H GLY 93 H GLY 93 -0.706 15.155 -2.745
701 1HA GLY 93 2HA GLY 93 -2.564 15.301 -0.477
702 2HA GLY 93 1HA GLY 93 -0.821 15.112 -0.360
703 H GLU 94 H GLU 94 -1.175 16.846 1.235
704 HA GLU 94 HA GLU 94 -1.832 19.461 0.220
705 1HB GLU 94 2HB GLU 94 -1.533 20.109 2.621
706 2HB GLU 94 1HB GLU 94 -2.761 18.885 2.342
707 1HG GLU 94 2HG GLU 94 -1.092 17.157 2.973
708 2HG GLU 94 1HG GLU 94 0.028 18.452 3.383
709 H ASN 95 H ASN 95 0.945 17.770 1.501
710 HA ASN 95 HA ASN 95 2.614 20.155 1.099
711 1HB ASN 95 2HB ASN 95 3.243 17.587 2.582
712 2HB ASN 95 1HB ASN 95 4.273 19.009 2.506
713 1HD2 ASN 95 1HD2 ASN 95 2.120 20.910 2.775
714 2HD2 ASN 95 2HD2 ASN 95 1.590 20.816 4.421
715 H GLY 96 H GLY 96 1.617 18.184 -0.961
716 1HA GLY 96 2HA GLY 96 2.516 17.260 -2.892
717 2HA GLY 96 1HA GLY 96 4.128 17.616 -2.278
718 H THR 97 H THR 97 1.651 15.895 -0.544
719 HA THR 97 HA THR 97 3.375 13.534 -0.461
720 HB THR 97 HB THR 97 1.919 12.950 1.565
721 HG1 THR 97 1HG THR 97 0.686 14.549 2.419
722 1HG2 THR 97 1HG2 THR 97 3.230 14.391 3.062
723 2HG2 THR 97 2HG2 THR 97 3.683 15.403 1.690
724 3HG2 THR 97 3HG2 THR 97 4.229 13.728 1.770
725 H LEU 98 H LEU 98 1.887 11.473 0.066
726 HA LEU 98 HA LEU 98 -0.017 11.446 -2.166
727 1HB LEU 98 2HB LEU 98 1.914 9.944 -2.402
728 2HB LEU 98 1HB LEU 98 1.493 9.156 -0.894
729 HG LEU 98 HG LEU 98 -0.637 8.395 -1.924
730 1HD1 LEU 98 1HD1 LEU 98 -0.907 10.130 -3.599
731 2HD1 LEU 98 2HD1 LEU 98 -0.882 8.543 -4.366
732 3HD1 LEU 98 3HD1 LEU 98 0.543 9.578 -4.437
733 1HD2 LEU 98 1HD2 LEU 98 1.285 6.921 -1.877
734 2HD2 LEU 98 2HD2 LEU 98 1.894 7.625 -3.375
735 3HD2 LEU 98 3HD2 LEU 98 0.393 6.698 -3.381
736 H ILE 99 H ILE 99 -2.093 11.199 -1.748
737 HA ILE 99 HA ILE 99 -2.930 10.249 0.892
738 HB ILE 99 HB ILE 99 -4.601 11.344 -1.381
739 1HG1 ILE 99 2HG1 ILE 99 -2.986 12.991 -0.474
740 2HG1 ILE 99 1HG1 ILE 99 -4.658 13.439 -0.168
741 1HG2 ILE 99 1HG2 ILE 99 -5.866 9.917 0.127
742 2HG2 ILE 99 2HG2 ILE 99 -6.351 11.601 0.315
743 3HG2 ILE 99 3HG2 ILE 99 -5.295 10.846 1.511
744 1HD1 ILE 99 1HD1 ILE 99 -4.428 12.603 2.130
745 2HD1 ILE 99 2HD1 ILE 99 -3.285 13.893 1.761
746 3HD1 ILE 99 3HD1 ILE 99 -2.741 12.216 1.801
747 H TRP 100 H TRP 100 -3.097 8.126 1.046
748 HA TRP 100 HA TRP 100 -3.786 6.559 -1.338
749 1HB TRP 100 2HB TRP 100 -1.648 5.989 -0.324
750 2HB TRP 100 1HB TRP 100 -2.407 5.800 1.249
751 HD1 TRP 100 HD TRP 100 -4.122 4.233 -1.772
752 HE1 TRP 100 1HE TRP 100 -3.940 1.685 -1.597
753 HE3 TRP 100 3HE TRP 100 -0.878 3.930 2.167
754 HZ2 TRP 100 2HZ TRP 100 -2.589 -0.220 -0.002
755 HZ3 TRP 100 3HZ TRP 100 -0.184 1.704 2.955
756 HH2 TRP 100 HH TRP 100 -1.022 -0.330 1.892
757 H GLU 101 H GLU 101 -5.876 6.035 -1.443
758 HA GLU 101 HA GLU 101 -7.300 5.595 1.093
759 1HB GLU 101 2HB GLU 101 -8.170 6.562 -1.584
760 2HB GLU 101 1HB GLU 101 -9.340 5.738 -0.575
761 1HG GLU 101 2HG GLU 101 -9.056 7.345 1.178
762 2HG GLU 101 1HG GLU 101 -7.715 8.101 0.328
763 H GLN 102 H GLN 102 -8.171 3.732 1.550
764 HA GLN 102 HA GLN 102 -8.070 1.527 -0.336
765 1HB GLN 102 2HB GLN 102 -5.740 1.821 0.475
766 2HB GLN 102 1HB GLN 102 -6.300 1.589 2.121
767 1HG GLN 102 2HG GLN 102 -7.036 -0.582 0.312
768 2HG GLN 102 1HG GLN 102 -5.300 -0.344 0.489
769 1HE2 GLN 102 1HE2 GLN 102 -6.950 -2.544 1.417
770 2HE2 GLN 102 2HE2 GLN 102 -6.716 -2.638 3.130
771 H ASN 103 H ASN 103 -9.843 0.370 0.025
772 HA ASN 103 HA ASN 103 -11.598 -0.651 1.028
773 1HB ASN 103 2HB ASN 103 -9.494 -0.792 3.118
774 2HB ASN 103 1HB ASN 103 -11.145 -1.134 3.625
775 1HD2 ASN 103 1HD2 ASN 103 -8.806 -2.901 3.422
776 2HD2 ASN 103 2HD2 ASN 103 -9.298 -4.198 2.387
777 H GLY 104 H GLY 104 -11.264 2.328 1.129
778 1HA GLY 104 2HA GLY 104 -13.035 3.826 1.588
779 2HA GLY 104 1HA GLY 104 -13.563 2.764 2.885
780 H GLN 105 H GLN 105 -10.422 2.836 3.447
781 HA GLN 105 HA GLN 105 -10.687 5.014 5.370
782 1HB GLN 105 2HB GLN 105 -8.475 2.974 5.095
783 2HB GLN 105 1HB GLN 105 -8.726 4.070 6.446
784 1HG GLN 105 2HG GLN 105 -10.902 2.935 6.868
785 2HG GLN 105 1HG GLN 105 -10.463 1.760 5.630
786 1HE2 GLN 105 1HE2 GLN 105 -9.770 2.951 8.819
787 2HE2 GLN 105 2HE2 GLN 105 -8.804 1.612 9.327
788 H ARG 106 H ARG 106 -9.362 6.794 5.407
789 HA ARG 106 HA ARG 106 -7.776 7.248 2.994
790 1HB ARG 106 2HB ARG 106 -9.368 9.007 3.647
791 2HB ARG 106 1HB ARG 106 -8.570 9.163 5.204
792 1HG ARG 106 2HG ARG 106 -6.794 9.481 2.894
793 2HG ARG 106 1HG ARG 106 -8.055 10.704 3.029
794 1HD ARG 106 2HD ARG 106 -6.253 9.943 5.317
795 2HD ARG 106 1HD ARG 106 -5.863 11.231 4.178
796 HE ARG 106 HE ARG 106 -8.460 11.611 5.249
797 1HH1 ARG 106 1HH1 ARG 106 -5.085 11.866 6.169
798 2HH1 ARG 106 2HH1 ARG 106 -5.357 13.160 7.296
799 1HH2 ARG 106 1HH2 ARG 106 -8.829 13.300 6.699
800 2HH2 ARG 106 2HH2 ARG 106 -7.510 13.984 7.607
801 H LYS 107 H LYS 107 -5.729 6.742 3.035
802 HA LYS 107 HA LYS 107 -4.300 6.711 5.597
803 1HB LYS 107 2HB LYS 107 -3.841 5.261 3.019
804 2HB LYS 107 1HB LYS 107 -2.677 5.283 4.353
805 1HG LYS 107 2HG LYS 107 -4.492 4.545 5.852
806 2HG LYS 107 1HG LYS 107 -5.515 4.356 4.435
807 1HD LYS 107 2HD LYS 107 -4.297 2.561 3.652
808 2HD LYS 107 1HD LYS 107 -2.880 2.969 4.638
809 1HE LYS 107 2HE LYS 107 -3.944 2.374 6.611
810 2HE LYS 107 1HE LYS 107 -5.527 2.353 5.849
811 1HZ LYS 107 1HZ LYS 107 -4.779 0.106 6.238
812 2HZ LYS 107 2HZ LYS 107 -3.327 0.390 5.404
813 3HZ LYS 107 3HZ LYS 107 -4.805 0.387 4.567
814 H THR 108 H THR 108 -3.061 8.472 5.910
815 HA THR 108 HA THR 108 -2.121 9.995 3.610
816 HB THR 108 HB THR 108 -1.955 10.642 6.564
817 HG1 THR 108 1HG THR 108 -3.601 11.886 4.609
818 1HG2 THR 108 1HG2 THR 108 -1.370 12.903 5.833
819 2HG2 THR 108 2HG2 THR 108 -1.399 12.376 4.150
820 3HG2 THR 108 3HG2 THR 108 -0.183 11.733 5.253
821 H MET 109 H MET 109 -0.167 9.671 2.810
822 HA MET 109 HA MET 109 1.687 8.027 4.372
823 1HB MET 109 2HB MET 109 1.648 8.645 1.411
824 2HB MET 109 1HB MET 109 2.766 7.558 2.215
825 1HG MET 109 2HG MET 109 -0.200 7.119 2.266
826 2HG MET 109 1HG MET 109 0.819 6.524 0.958
827 1HE MET 109 1HE MET 109 -0.463 5.939 4.581
828 2HE MET 109 2HE MET 109 1.090 6.704 4.916
829 3HE MET 109 3HE MET 109 0.841 5.005 5.318
830 H THR 110 H THR 110 3.733 8.690 4.826
831 HA THR 110 HA THR 110 4.206 11.549 4.481
832 HB THR 110 HB THR 110 6.147 9.932 6.004
833 HG1 THR 110 1HG THR 110 4.734 9.090 7.344
834 1HG2 THR 110 1HG2 THR 110 4.628 12.470 6.608
835 2HG2 THR 110 2HG2 THR 110 6.253 12.370 5.933
836 3HG2 THR 110 3HG2 THR 110 5.946 11.804 7.574
837 H ARG 111 H ARG 111 6.004 12.368 3.501
838 HA ARG 111 HA ARG 111 7.279 10.699 1.528
839 1HB ARG 111 2HB ARG 111 6.691 13.000 0.939
840 2HB ARG 111 1HB ARG 111 7.675 13.613 2.260
841 1HG ARG 111 2HG ARG 111 9.645 12.498 1.102
842 2HG ARG 111 1HG ARG 111 8.579 12.326 -0.296
843 1HD ARG 111 2HD ARG 111 9.311 14.910 1.082
844 2HD ARG 111 1HD ARG 111 9.945 14.344 -0.462
845 HE ARG 111 HE ARG 111 7.545 14.468 -1.243
846 1HH1 ARG 111 1HH1 ARG 111 8.772 16.525 1.337
847 2HH1 ARG 111 2HH1 ARG 111 7.629 17.804 1.019
848 1HH2 ARG 111 1HH2 ARG 111 6.055 16.137 -1.634
849 2HH2 ARG 111 2HH2 ARG 111 6.082 17.575 -0.656
850 H ILE 112 H ILE 112 9.207 9.710 1.763
851 HA ILE 112 HA ILE 112 10.596 9.949 4.260
852 HB ILE 112 HB ILE 112 11.451 8.511 1.756
853 1HG1 ILE 112 2HG1 ILE 112 9.243 7.784 2.679
854 2HG1 ILE 112 1HG1 ILE 112 10.468 6.531 2.717
855 1HG2 ILE 112 1HG2 ILE 112 12.878 7.194 3.240
856 2HG2 ILE 112 2HG2 ILE 112 12.379 8.200 4.600
857 3HG2 ILE 112 3HG2 ILE 112 13.305 8.904 3.275
858 1HD1 ILE 112 1HD1 ILE 112 9.610 8.218 5.051
859 2HD1 ILE 112 2HD1 ILE 112 10.840 6.954 5.090
860 3HD1 ILE 112 3HD1 ILE 112 9.158 6.540 4.754
861 H GLU 113 H GLU 113 12.577 10.788 4.601
862 HA GLU 113 HA GLU 113 13.909 12.381 2.588
863 1HB GLU 113 2HB GLU 113 12.074 13.841 3.468
864 2HB GLU 113 1HB GLU 113 12.761 13.683 5.075
865 1HG GLU 113 2HG GLU 113 14.777 14.817 4.360
866 2HG GLU 113 1HG GLU 113 14.177 14.893 2.705
867 H SER 114 H SER 114 16.041 12.323 2.983
868 HA SER 114 HA SER 114 18.003 11.650 3.910
869 1HB SER 114 2HB SER 114 16.608 12.380 6.503
870 2HB SER 114 1HB SER 114 18.345 12.168 6.294
871 HG SER 114 HG SER 114 18.010 14.323 6.113
872 H LYS 115 H LYS 115 18.463 10.312 6.393
873 HA LYS 115 HA LYS 115 17.264 7.712 5.758
874 1HB LYS 115 2HB LYS 115 19.092 6.761 7.084
875 2HB LYS 115 1HB LYS 115 19.706 7.810 5.817
876 1HG LYS 115 2HG LYS 115 19.973 9.611 7.488
877 2HG LYS 115 1HG LYS 115 19.463 8.478 8.741
878 1HD LYS 115 2HD LYS 115 21.806 8.451 8.826
879 2HD LYS 115 1HD LYS 115 21.371 6.990 7.940
880 1HE LYS 115 2HE LYS 115 22.183 9.592 6.649
881 2HE LYS 115 1HE LYS 115 23.286 8.256 6.964
882 1HZ LYS 115 1HZ LYS 115 22.601 8.095 4.726
883 2HZ LYS 115 2HZ LYS 115 20.964 8.288 5.115
884 3HZ LYS 115 3HZ LYS 115 21.776 6.864 5.552
885 H THR 116 H THR 116 15.997 9.941 7.323
886 HA THR 116 HA THR 116 14.620 10.241 9.080
887 HB THR 116 HB THR 116 14.137 7.666 8.421
888 HG1 THR 116 1HG THR 116 12.293 8.147 9.369
889 1HG2 THR 116 1HG2 THR 116 14.911 7.540 11.344
890 2HG2 THR 116 2HG2 THR 116 15.782 6.756 10.028
891 3HG2 THR 116 3HG2 THR 116 14.134 6.258 10.414
892 H GLY 117 H GLY 117 14.474 10.153 11.500
893 1HA GLY 117 2HA GLY 117 15.646 9.630 13.576
894 2HA GLY 117 1HA GLY 117 17.153 9.832 12.694
895 H ARG 118 H ARG 118 18.144 11.746 12.845
896 HA ARG 118 HA ARG 118 16.568 14.080 13.644
897 1HB ARG 118 2HB ARG 118 17.384 13.113 15.720
898 2HB ARG 118 1HB ARG 118 19.024 13.076 15.089
899 1HG ARG 118 2HG ARG 118 18.983 15.546 14.954
900 2HG ARG 118 1HG ARG 118 17.390 15.523 15.713
901 1HD ARG 118 2HD ARG 118 18.300 14.478 17.686
902 2HD ARG 118 1HD ARG 118 19.885 14.350 16.926
903 HE ARG 118 HE ARG 118 18.750 17.025 17.246
904 1HH1 ARG 118 1HH1 ARG 118 21.043 14.592 18.276
905 2HH1 ARG 118 2HH1 ARG 118 21.966 15.684 19.267
906 1HH2 ARG 118 1HH2 ARG 118 19.983 18.484 18.529
907 2HH2 ARG 118 2HH2 ARG 118 21.369 17.895 19.392
908 H GLU 119 H GLU 119 16.910 15.375 11.959
909 HA GLU 119 HA GLU 119 19.686 16.211 11.505
910 1HB GLU 119 2HB GLU 119 17.581 15.757 9.385
911 2HB GLU 119 1HB GLU 119 19.052 16.677 9.105
912 1HG GLU 119 2HG GLU 119 20.345 14.639 9.757
913 2HG GLU 119 1HG GLU 119 18.818 13.759 9.789
914 H GLU 120 H GLU 120 19.945 18.311 11.850
915 HA GLU 120 HA GLU 120 17.759 19.944 12.616
916 1HB GLU 120 2HB GLU 120 20.059 20.184 13.513
917 2HB GLU 120 1HB GLU 120 20.580 20.782 11.944
918 1HG GLU 120 2HG GLU 120 19.345 22.756 12.156
919 2HG GLU 120 1HG GLU 120 18.381 22.109 13.483
920 H LYS 121 H LYS 121 16.434 21.050 11.433
921 HA LYS 121 HA LYS 121 17.176 21.795 8.691
922 1HB LYS 121 2HB LYS 121 15.763 19.707 8.857
923 2HB LYS 121 1HB LYS 121 14.497 20.701 9.556
924 1HG LYS 121 2HG LYS 121 14.334 21.983 7.501
925 2HG LYS 121 1HG LYS 121 15.656 21.043 6.799
926 1HD LYS 121 2HD LYS 121 14.322 18.997 7.050
927 2HD LYS 121 1HD LYS 121 13.000 19.947 7.723
928 1HE LYS 121 2HE LYS 121 12.836 21.184 5.610
929 2HE LYS 121 1HE LYS 121 14.137 20.198 4.940
930 1HZ LYS 121 1HZ LYS 121 11.539 19.150 5.925
931 2HZ LYS 121 2HZ LYS 121 12.777 18.234 5.207
932 3HZ LYS 121 3HZ LYS 121 11.934 19.391 4.298
933 H ASP 122 H ASP 122 16.383 23.790 8.015
934 HA ASP 122 HA ASP 122 14.938 25.334 10.060
935 1HB ASP 122 2HB ASP 122 17.322 25.903 10.120
936 2HB ASP 122 1HB ASP 122 17.284 26.286 8.404
937 H GLU 123 H GLU 123 13.376 26.674 9.375
938 HA GLU 123 HA GLU 123 12.674 26.606 6.537
939 1HB GLU 123 2HB GLU 123 11.138 27.492 8.983
940 2HB GLU 123 1HB GLU 123 10.521 27.619 7.343
941 1HG GLU 123 2HG GLU 123 11.356 25.035 8.627
942 2HG GLU 123 1HG GLU 123 9.705 25.650 8.621
943 H LYS 124 H LYS 124 13.653 28.186 5.392
944 HA LYS 124 HA LYS 124 13.926 30.826 6.629
945 1HB LYS 124 2HB LYS 124 15.951 29.767 5.612
946 2HB LYS 124 1HB LYS 124 15.152 29.844 4.046
947 1HG LYS 124 2HG LYS 124 15.084 32.262 4.161
948 2HG LYS 124 1HG LYS 124 15.793 32.225 5.775
949 1HD LYS 124 2HD LYS 124 17.812 31.155 4.818
950 2HD LYS 124 1HD LYS 124 17.101 31.325 3.210
951 1HE LYS 124 2HE LYS 124 18.650 33.139 3.613
952 2HE LYS 124 1HE LYS 124 17.002 33.767 3.544
953 1HZ LYS 124 1HZ LYS 124 18.839 33.601 5.810
954 2HZ LYS 124 2HZ LYS 124 17.195 33.353 6.137
955 3HZ LYS 124 3HZ LYS 124 17.702 34.802 5.422
956 H SER 125 H SER 125 11.928 31.723 6.419
957 HA SER 125 HA SER 125 11.062 32.253 3.658
958 1HB SER 125 2HB SER 125 9.285 31.898 6.087
959 2HB SER 125 1HB SER 125 8.737 32.296 4.459
960 HG SER 125 HG SER 125 10.201 30.169 4.158
961 H LYS 126 H LYS 126 11.281 34.311 3.163
962 HA LYS 126 HA LYS 126 10.749 36.374 5.186
963 1HB LYS 126 2HB LYS 126 13.215 36.002 4.974
964 2HB LYS 126 1HB LYS 126 13.098 36.396 3.268
965 1HG LYS 126 2HG LYS 126 12.397 38.654 3.811
966 2HG LYS 126 1HG LYS 126 12.440 38.269 5.535
967 1HD LYS 126 2HD LYS 126 14.840 37.780 5.350
968 2HD LYS 126 1HD LYS 126 14.787 38.196 3.639
969 1HE LYS 126 2HE LYS 126 15.672 40.035 4.958
970 2HE LYS 126 1HE LYS 126 14.142 40.478 4.205
971 1HZ LYS 126 1HZ LYS 126 14.218 39.449 6.973
972 2HZ LYS 126 2HZ LYS 126 13.035 40.413 6.225
973 3HZ LYS 126 3HZ LYS 126 14.531 41.082 6.647
974 H SER 127 H SER 127 9.893 38.330 4.280
975 HA SER 127 HA SER 127 9.381 38.311 1.402
976 1HB SER 127 2HB SER 127 7.173 38.464 3.466
977 2HB SER 127 1HB SER 127 6.967 38.674 1.726
978 HG SER 127 HG SER 127 8.298 36.396 2.202
979 H LEU 128 H LEU 128 9.666 40.235 0.563
980 HA LEU 128 HA LEU 128 8.555 42.586 1.688
981 1HB LEU 128 2HB LEU 128 10.666 43.869 1.877
982 2HB LEU 128 1HB LEU 128 10.509 42.607 3.077
983 HG LEU 128 HG LEU 128 11.971 41.235 1.352
984 1HD1 LEU 128 1HD1 LEU 128 12.703 44.092 0.727
985 2HD1 LEU 128 2HD1 LEU 128 12.022 42.913 -0.395
986 3HD1 LEU 128 3HD1 LEU 128 13.641 42.675 0.263
987 1HD2 LEU 128 1HD2 LEU 128 12.569 41.766 3.665
988 2HD2 LEU 128 2HD2 LEU 128 13.111 43.365 3.155
989 3HD2 LEU 128 3HD2 LEU 128 13.950 41.924 2.582
990 H GLU 129 H GLU 129 8.262 44.138 0.138
991 HA GLU 129 HA GLU 129 9.769 44.428 -2.212
992 1HB GLU 129 2HB GLU 129 8.723 42.265 -2.824
993 2HB GLU 129 1HB GLU 129 7.134 42.982 -2.596
994 1HG GLU 129 2HG GLU 129 7.745 44.647 -4.375
995 2HG GLU 129 1HG GLU 129 9.175 43.667 -4.689
996 H HIS 130 H HIS 130 9.472 46.502 -2.727
997 HA HIS 130 HA HIS 130 6.774 47.640 -2.527
998 1HB HIS 130 2HB HIS 130 8.193 48.117 -0.433
999 2HB HIS 130 1HB HIS 130 9.163 49.151 -1.473
1000 HD1 HIS 130 1HD HIS 130 6.249 49.195 0.666
1001 HD2 HIS 130 2HD HIS 130 7.515 51.300 -2.699
1002 HE1 HIS 130 1HE HIS 130 4.857 51.287 0.603
1003 HE2 HIS 130 2HE HIS 130 5.730 52.609 -1.355
1004 H HIS 131 H HIS 131 6.487 47.943 -4.661
1005 HA HIS 131 HA HIS 131 8.591 48.898 -6.382
1006 1HB HIS 131 2HB HIS 131 5.643 48.460 -6.891
1007 2HB HIS 131 1HB HIS 131 6.797 48.946 -8.126
1008 HD1 HIS 131 1HD HIS 131 5.046 46.143 -7.460
1009 HD2 HIS 131 2HD HIS 131 9.149 46.790 -7.691
1010 HE1 HIS 131 1HE HIS 131 6.059 43.902 -7.995
1011 HE2 HIS 131 2HE HIS 131 8.550 44.280 -7.962
1012 H HIS 132 H HIS 132 7.760 50.698 -8.028
1013 HA HIS 132 HA HIS 132 7.213 53.052 -6.346
1014 1HB HIS 132 2HB HIS 132 9.393 52.840 -7.683
1015 2HB HIS 132 1HB HIS 132 8.405 53.056 -9.123
1016 HD1 HIS 132 1HD HIS 132 9.974 54.892 -6.323
1017 HD2 HIS 132 2HD HIS 132 7.257 55.663 -9.377
1018 HE1 HIS 132 1HE HIS 132 9.791 57.395 -6.455
1019 HE2 HIS 132 2HE HIS 132 7.917 57.807 -8.087
1020 H HIS 133 H HIS 133 5.373 54.142 -6.639
1021 HA HIS 133 HA HIS 133 3.545 53.189 -8.706
1022 1HB HIS 133 2HB HIS 133 3.108 54.968 -6.302
1023 2HB HIS 133 1HB HIS 133 1.848 54.552 -7.460
1024 HD1 HIS 133 1HD HIS 133 0.802 52.213 -7.288
1025 HD2 HIS 133 2HD HIS 133 3.936 52.854 -4.625
1026 HE1 HIS 133 1HE HIS 133 0.721 50.291 -5.666
1027 HE2 HIS 133 2HE HIS 133 2.512 50.801 -3.965
1028 H HIS 134 H HIS 134 1.925 55.306 -9.186
1029 HA HIS 134 HA HIS 134 3.553 56.745 -11.057
1030 1HB HIS 134 2HB HIS 134 0.612 56.711 -10.468
1031 2HB HIS 134 1HB HIS 134 1.301 57.916 -11.551
1032 HD1 HIS 134 1HD HIS 134 -0.216 54.697 -11.649
1033 HD2 HIS 134 2HD HIS 134 2.928 56.520 -13.676
1034 HE1 HIS 134 1HE HIS 134 0.111 53.351 -13.748
1035 HE2 HIS 134 2HE HIS 134 1.999 54.487 -14.981
1036 H HIS 135 H HIS 135 4.854 57.681 -9.269
1037 HA HIS 135 HA HIS 135 4.567 60.429 -9.512
1038 1HB HIS 135 2HB HIS 135 3.992 61.263 -7.388
1039 2HB HIS 135 1HB HIS 135 2.803 60.003 -7.684
1040 HD1 HIS 135 1HD HIS 135 5.211 61.174 -5.251
1041 HD2 HIS 135 2HD HIS 135 3.437 57.533 -6.198
1042 HE1 HIS 135 1HE HIS 135 5.547 59.712 -3.230
1043 HE2 HIS 135 2HE HIS 135 4.657 57.450 -3.911
Start of MODEL 7
1 1H MET 1 1HT MET 1 -14.063 24.786 -0.632
2 2H MET 1 2HT MET 1 -12.433 24.670 -1.075
3 3H MET 1 3HT MET 1 -12.859 24.828 0.561
4 HA MET 1 HA MET 1 -12.243 22.562 0.085
5 1HB MET 1 2HB MET 1 -14.062 23.059 1.726
6 2HB MET 1 1HB MET 1 -15.243 22.846 0.440
7 1HG MET 1 2HG MET 1 -14.373 20.515 0.160
8 2HG MET 1 1HG MET 1 -13.417 20.770 1.620
9 1HE MET 1 1HE MET 1 -15.430 18.344 1.338
10 2HE MET 1 2HE MET 1 -16.231 18.390 2.910
11 3HE MET 1 3HE MET 1 -14.494 18.672 2.792
12 H ILE 2 H ILE 2 -12.679 20.600 -1.064
13 HA ILE 2 HA ILE 2 -13.145 19.294 -2.839
14 HB ILE 2 HB ILE 2 -15.375 21.246 -3.460
15 1HG1 ILE 2 2HG1 ILE 2 -15.586 20.297 -1.195
16 2HG1 ILE 2 1HG1 ILE 2 -16.841 19.676 -2.266
17 1HG2 ILE 2 1HG2 ILE 2 -14.949 18.393 -4.347
18 2HG2 ILE 2 2HG2 ILE 2 -14.799 19.828 -5.361
19 3HG2 ILE 2 3HG2 ILE 2 -16.369 19.378 -4.697
20 1HD1 ILE 2 1HD1 ILE 2 -15.604 17.598 -2.522
21 2HD1 ILE 2 2HD1 ILE 2 -15.923 17.939 -0.820
22 3HD1 ILE 2 3HD1 ILE 2 -14.318 18.225 -1.490
23 H MET 3 H MET 3 -11.083 19.972 -3.672
24 HA MET 3 HA MET 3 -11.134 21.829 -5.897
25 1HB MET 3 2HB MET 3 -8.957 20.030 -4.815
26 2HB MET 3 1HB MET 3 -8.748 21.082 -6.207
27 1HG MET 3 2HG MET 3 -9.201 23.030 -4.804
28 2HG MET 3 1HG MET 3 -9.411 21.973 -3.412
29 1HE MET 3 1HE MET 3 -7.431 24.450 -3.430
30 2HE MET 3 2HE MET 3 -6.003 23.757 -2.657
31 3HE MET 3 3HE MET 3 -7.613 23.380 -2.043
32 H VAL 4 H VAL 4 -11.096 21.265 -8.043
33 HA VAL 4 HA VAL 4 -12.404 18.797 -8.632
34 HB VAL 4 HB VAL 4 -11.230 20.791 -10.578
35 1HG1 VAL 4 1HG1 VAL 4 -13.345 18.680 -10.975
36 2HG1 VAL 4 2HG1 VAL 4 -11.689 18.613 -11.576
37 3HG1 VAL 4 3HG1 VAL 4 -12.796 19.845 -12.182
38 1HG2 VAL 4 1HG2 VAL 4 -13.483 21.717 -10.720
39 2HG2 VAL 4 2HG2 VAL 4 -12.834 21.850 -9.086
40 3HG2 VAL 4 3HG2 VAL 4 -14.024 20.604 -9.462
41 H SER 5 H SER 5 -11.150 17.052 -8.225
42 HA SER 5 HA SER 5 -8.457 16.815 -9.173
43 1HB SER 5 2HB SER 5 -10.329 14.615 -8.262
44 2HB SER 5 1HB SER 5 -8.566 14.557 -8.321
45 HG SER 5 HG SER 5 -9.357 16.674 -6.874
46 H GLY 6 H GLY 6 -8.051 16.681 -11.280
47 1HA GLY 6 2HA GLY 6 -10.078 15.547 -13.066
48 2HA GLY 6 1HA GLY 6 -8.668 16.481 -13.555
49 H CYS 7 H CYS 7 -9.267 14.180 -14.894
50 HA CYS 7 HA CYS 7 -7.133 12.388 -13.960
51 1HB CYS 7 2HB CYS 7 -9.352 11.311 -13.874
52 2HB CYS 7 1HB CYS 7 -9.573 11.643 -15.586
53 HG CYS 7 HG CYS 7 -6.765 10.051 -15.354
54 H GLN 8 H GLN 8 -5.638 13.717 -15.076
55 HA GLN 8 HA GLN 8 -5.799 13.915 -17.955
56 1HB GLN 8 2HB GLN 8 -3.472 14.555 -16.128
57 2HB GLN 8 1HB GLN 8 -3.627 15.017 -17.815
58 1HG GLN 8 2HG GLN 8 -5.563 16.414 -17.235
59 2HG GLN 8 1HG GLN 8 -5.341 15.985 -15.539
60 1HE2 GLN 8 1HE2 GLN 8 -5.242 18.606 -16.808
61 2HE2 GLN 8 2HE2 GLN 8 -3.674 19.256 -16.471
62 H GLN 9 H GLN 9 -5.933 11.685 -18.474
63 HA GLN 9 HA GLN 9 -3.645 10.012 -17.782
64 1HB GLN 9 2HB GLN 9 -6.239 9.386 -17.799
65 2HB GLN 9 1HB GLN 9 -5.887 9.012 -19.478
66 1HG GLN 9 2HG GLN 9 -4.506 7.823 -17.079
67 2HG GLN 9 1HG GLN 9 -5.742 7.037 -18.055
68 1HE2 GLN 9 1HE2 GLN 9 -5.214 6.302 -20.111
69 2HE2 GLN 9 2HE2 GLN 9 -3.574 6.113 -20.635
70 H GLN 10 H GLN 10 -2.405 11.612 -19.197
71 HA GLN 10 HA GLN 10 -1.554 10.260 -21.489
72 1HB GLN 10 2HB GLN 10 -3.765 11.236 -22.334
73 2HB GLN 10 1HB GLN 10 -2.988 12.809 -22.229
74 1HG GLN 10 2HG GLN 10 -1.286 12.092 -23.813
75 2HG GLN 10 1HG GLN 10 -2.026 10.494 -23.897
76 1HE2 GLN 10 1HE2 GLN 10 -3.847 13.466 -23.698
77 2HE2 GLN 10 2HE2 GLN 10 -4.488 13.410 -25.301
78 H LYS 11 H LYS 11 0.127 10.858 -19.811
79 HA LYS 11 HA LYS 11 1.766 12.928 -20.936
80 1HB LYS 11 2HB LYS 11 0.402 13.361 -18.343
81 2HB LYS 11 1HB LYS 11 2.126 13.709 -18.364
82 1HG LYS 11 2HG LYS 11 1.689 15.169 -20.371
83 2HG LYS 11 1HG LYS 11 -0.032 14.965 -20.037
84 1HD LYS 11 2HD LYS 11 0.765 17.029 -19.051
85 2HD LYS 11 1HD LYS 11 0.324 15.889 -17.779
86 1HE LYS 11 2HE LYS 11 2.655 15.318 -17.442
87 2HE LYS 11 1HE LYS 11 3.129 16.361 -18.782
88 1HZ LYS 11 1HZ LYS 11 1.808 17.298 -16.287
89 2HZ LYS 11 2HZ LYS 11 2.369 18.275 -17.556
90 3HZ LYS 11 3HZ LYS 11 3.472 17.402 -16.603
91 H GLU 12 H GLU 12 3.921 12.969 -19.960
92 HA GLU 12 HA GLU 12 4.568 10.571 -18.387
93 1HB GLU 12 2HB GLU 12 5.238 10.141 -20.698
94 2HB GLU 12 1HB GLU 12 6.134 11.653 -20.741
95 1HG GLU 12 2HG GLU 12 7.574 10.746 -18.905
96 2HG GLU 12 1HG GLU 12 6.756 9.199 -19.113
97 H GLU 13 H GLU 13 4.752 11.672 -16.488
98 HA GLU 13 HA GLU 13 7.027 13.522 -16.331
99 1HB GLU 13 2HB GLU 13 4.712 14.665 -16.267
100 2HB GLU 13 1HB GLU 13 4.536 13.932 -14.679
101 1HG GLU 13 2HG GLU 13 6.402 15.151 -13.826
102 2HG GLU 13 1HG GLU 13 6.833 15.721 -15.438
103 H THR 14 H THR 14 7.604 13.779 -13.877
104 HA THR 14 HA THR 14 8.559 11.338 -12.997
105 HB THR 14 HB THR 14 8.035 13.716 -11.213
106 HG1 THR 14 1HG THR 14 9.962 13.253 -13.233
107 1HG2 THR 14 1HG2 THR 14 10.174 11.584 -11.163
108 2HG2 THR 14 2HG2 THR 14 8.804 11.696 -10.058
109 3HG2 THR 14 3HG2 THR 14 10.052 12.943 -10.050
110 HA PRO 15 HA PRO 15 4.796 9.609 -11.234
111 1HB PRO 15 2HB PRO 15 6.568 7.399 -10.464
112 2HB PRO 15 1HB PRO 15 5.154 7.383 -11.520
113 1HG PRO 15 2HG PRO 15 7.658 7.087 -12.476
114 2HG PRO 15 1HG PRO 15 6.382 7.901 -13.398
115 1HD PRO 15 2HD PRO 15 8.636 9.088 -11.828
116 2HD PRO 15 1HD PRO 15 7.969 9.586 -13.397
117 H PHE 16 H PHE 16 4.375 10.770 -9.435
118 HA PHE 16 HA PHE 16 6.104 11.268 -7.321
119 1HB PHE 16 2HB PHE 16 4.048 11.907 -6.046
120 2HB PHE 16 1HB PHE 16 4.169 12.654 -7.631
121 HD1 PHE 16 1HD PHE 16 2.677 11.951 -9.447
122 HD2 PHE 16 2HD PHE 16 2.292 10.371 -5.515
123 HE1 PHE 16 1HE PHE 16 0.420 11.144 -9.994
124 HE2 PHE 16 2HE PHE 16 0.038 9.554 -6.062
125 HZ PHE 16 HZ PHE 16 -0.905 9.935 -8.306
126 H TYR 17 H TYR 17 3.974 8.543 -7.844
127 HA TYR 17 HA TYR 17 4.066 7.659 -5.122
128 1HB TYR 17 2HB TYR 17 2.826 5.697 -5.991
129 2HB TYR 17 1HB TYR 17 2.085 7.228 -6.433
130 HD1 TYR 17 2HD TYR 17 2.092 7.986 -8.760
131 HD2 TYR 17 1HD TYR 17 3.817 4.253 -7.667
132 HE1 TYR 17 2HE TYR 17 2.107 7.305 -11.122
133 HE2 TYR 17 1HE TYR 17 3.839 3.566 -10.025
134 HH TYR 17 HH TYR 17 2.746 4.086 -12.100
135 H TYR 18 H TYR 18 6.296 7.495 -7.582
136 HA TYR 18 HA TYR 18 7.086 4.730 -7.303
137 1HB TYR 18 2HB TYR 18 7.245 6.472 -9.326
138 2HB TYR 18 1HB TYR 18 8.853 6.691 -8.654
139 HD1 TYR 18 2HD TYR 18 6.590 4.349 -10.336
140 HD2 TYR 18 1HD TYR 18 10.506 4.906 -8.767
141 HE1 TYR 18 2HE TYR 18 7.347 2.331 -11.521
142 HE2 TYR 18 1HE TYR 18 11.269 2.893 -9.948
143 HH TYR 18 HH TYR 18 10.315 0.826 -10.857
144 H GLY 19 H GLY 19 7.242 6.590 -5.003
145 1HA GLY 19 2HA GLY 19 10.139 6.410 -4.452
146 2HA GLY 19 1HA GLY 19 9.105 7.668 -3.785
147 H THR 20 H THR 20 10.402 6.585 -1.886
148 HA THR 20 HA THR 20 8.908 4.301 -0.821
149 HB THR 20 HB THR 20 11.360 5.613 0.369
150 HG1 THR 20 1HG THR 20 12.520 3.915 -0.697
151 1HG2 THR 20 1HG2 THR 20 10.176 2.856 0.730
152 2HG2 THR 20 2HG2 THR 20 10.062 4.180 1.889
153 3HG2 THR 20 3HG2 THR 20 11.632 3.469 1.513
154 H TRP 21 H TRP 21 7.241 4.716 0.475
155 HA TRP 21 HA TRP 21 7.177 7.305 1.891
156 1HB TRP 21 2HB TRP 21 4.818 5.613 1.035
157 2HB TRP 21 1HB TRP 21 4.752 7.218 1.747
158 HD1 TRP 21 HD TRP 21 5.732 5.451 -1.526
159 HE1 TRP 21 1HE TRP 21 5.599 7.162 -3.438
160 HE3 TRP 21 3HE TRP 21 4.786 9.658 1.217
161 HZ2 TRP 21 2HZ TRP 21 5.151 9.938 -3.746
162 HZ3 TRP 21 3HZ TRP 21 4.515 11.800 0.038
163 HH2 TRP 21 HH TRP 21 4.695 11.935 -2.393
164 H ASP 22 H ASP 22 7.081 7.279 4.051
165 HA ASP 22 HA ASP 22 6.296 4.804 5.427
166 1HB ASP 22 2HB ASP 22 8.318 5.723 6.330
167 2HB ASP 22 1HB ASP 22 7.623 7.338 6.415
168 H GLU 23 H GLU 23 4.359 4.632 6.409
169 HA GLU 23 HA GLU 23 2.335 6.502 5.826
170 1HB GLU 23 2HB GLU 23 2.377 4.255 7.849
171 2HB GLU 23 1HB GLU 23 0.938 5.162 7.407
172 1HG GLU 23 2HG GLU 23 1.346 4.419 5.033
173 2HG GLU 23 1HG GLU 23 2.563 3.319 5.680
174 H GLY 24 H GLY 24 3.870 5.706 8.942
175 1HA GLY 24 2HA GLY 24 4.158 6.967 10.837
176 2HA GLY 24 1HA GLY 24 3.919 8.388 9.832
177 H ARG 25 H ARG 25 1.500 5.888 10.039
178 HA ARG 25 HA ARG 25 -0.019 7.277 12.066
179 1HB ARG 25 2HB ARG 25 -0.419 8.390 9.761
180 2HB ARG 25 1HB ARG 25 -1.346 6.946 9.390
181 1HG ARG 25 2HG ARG 25 -3.062 8.093 10.244
182 2HG ARG 25 1HG ARG 25 -2.370 7.664 11.809
183 1HD ARG 25 2HD ARG 25 -2.023 10.224 10.265
184 2HD ARG 25 1HD ARG 25 -2.764 10.005 11.848
185 HE ARG 25 HE ARG 25 0.060 9.304 11.612
186 1HH1 ARG 25 1HH1 ARG 25 -2.347 11.640 12.610
187 2HH1 ARG 25 2HH1 ARG 25 -1.260 12.521 13.634
188 1HH2 ARG 25 1HH2 ARG 25 1.513 10.478 12.935
189 2HH2 ARG 25 2HH2 ARG 25 0.931 11.851 13.833
190 H ALA 26 H ALA 26 -1.559 6.036 12.972
191 HA ALA 26 HA ALA 26 -2.776 4.211 13.566
192 1HB ALA 26 1HB ALA 26 -3.618 2.714 11.845
193 2HB ALA 26 2HB ALA 26 -2.443 3.349 10.693
194 3HB ALA 26 3HB ALA 26 -3.724 4.392 11.310
195 HA PRO 27 HA PRO 27 0.056 0.902 14.570
196 1HB PRO 27 2HB PRO 27 -2.190 -0.994 14.517
197 2HB PRO 27 1HB PRO 27 -1.178 -0.498 15.875
198 1HG PRO 27 2HG PRO 27 -3.745 0.271 15.679
199 2HG PRO 27 1HG PRO 27 -2.502 1.336 16.363
200 1HD PRO 27 2HD PRO 27 -3.711 1.354 13.623
201 2HD PRO 27 1HD PRO 27 -3.349 2.720 14.701
202 H GLY 28 H GLY 28 1.050 -0.960 13.652
203 1HA GLY 28 2HA GLY 28 0.647 -1.120 10.793
204 2HA GLY 28 1HA GLY 28 1.985 -1.798 11.703
205 HA PRO 29 HA PRO 29 -0.682 -5.296 10.052
206 1HB PRO 29 2HB PRO 29 2.109 -6.326 10.093
207 2HB PRO 29 1HB PRO 29 0.842 -6.546 8.881
208 1HG PRO 29 2HG PRO 29 2.863 -4.846 8.480
209 2HG PRO 29 1HG PRO 29 1.224 -4.483 7.915
210 1HD PRO 29 2HD PRO 29 2.728 -3.339 10.210
211 2HD PRO 29 1HD PRO 29 1.486 -2.600 9.184
212 H THR 30 H THR 30 -0.794 -7.503 10.884
213 HA THR 30 HA THR 30 -1.123 -7.355 13.692
214 HB THR 30 HB THR 30 -1.818 -9.808 13.391
215 HG1 THR 30 1HG THR 30 -1.007 -10.507 11.518
216 1HG2 THR 30 1HG2 THR 30 -3.931 -9.185 12.340
217 2HG2 THR 30 2HG2 THR 30 -3.208 -7.691 11.743
218 3HG2 THR 30 3HG2 THR 30 -3.419 -7.937 13.478
219 H ASP 31 H ASP 31 1.633 -8.222 11.934
220 HA ASP 31 HA ASP 31 2.500 -10.391 13.600
221 1HB ASP 31 2HB ASP 31 3.236 -10.060 11.230
222 2HB ASP 31 1HB ASP 31 4.190 -8.681 11.768
223 H GLY 32 H GLY 32 2.319 -7.093 14.084
224 1HA GLY 32 2HA GLY 32 2.882 -6.163 16.227
225 2HA GLY 32 1HA GLY 32 4.237 -7.282 16.310
226 H VAL 33 H VAL 33 3.464 -5.524 13.435
227 HA VAL 33 HA VAL 33 6.119 -4.474 13.255
228 HB VAL 33 HB VAL 33 3.730 -3.779 11.544
229 1HG1 VAL 33 1HG1 VAL 33 5.387 -3.349 9.818
230 2HG1 VAL 33 2HG1 VAL 33 6.675 -3.746 10.957
231 3HG1 VAL 33 3HG1 VAL 33 5.655 -2.336 11.237
232 1HG2 VAL 33 1HG2 VAL 33 3.921 -6.192 11.621
233 2HG2 VAL 33 2HG2 VAL 33 5.649 -6.094 11.280
234 3HG2 VAL 33 3HG2 VAL 33 4.477 -5.609 10.053
235 H LYS 34 H LYS 34 6.823 -2.437 13.643
236 HA LYS 34 HA LYS 34 5.170 -0.836 15.370
237 1HB LYS 34 2HB LYS 34 7.956 -0.217 14.394
238 2HB LYS 34 1HB LYS 34 7.163 0.395 15.834
239 1HG LYS 34 2HG LYS 34 8.039 -2.443 15.355
240 2HG LYS 34 1HG LYS 34 8.807 -1.272 16.426
241 1HD LYS 34 2HD LYS 34 5.961 -2.212 16.740
242 2HD LYS 34 1HD LYS 34 7.331 -2.951 17.566
243 1HE LYS 34 2HE LYS 34 6.499 -0.062 17.799
244 2HE LYS 34 1HE LYS 34 6.148 -1.324 18.979
245 1HZ LYS 34 1HZ LYS 34 8.619 -1.654 19.128
246 2HZ LYS 34 2HZ LYS 34 8.039 -0.189 19.757
247 3HZ LYS 34 3HZ LYS 34 8.794 -0.215 18.244
248 H SER 35 H SER 35 6.384 -0.702 12.132
249 HA SER 35 HA SER 35 4.612 1.447 11.421
250 1HB SER 35 2HB SER 35 7.592 1.902 11.120
251 2HB SER 35 1HB SER 35 6.310 2.987 10.591
252 HG SER 35 HG SER 35 5.878 2.506 13.139
253 H ALA 36 H ALA 36 4.726 1.860 9.041
254 HA ALA 36 HA ALA 36 5.816 -0.450 7.611
255 1HB ALA 36 1HB ALA 36 3.468 -0.942 8.117
256 2HB ALA 36 2HB ALA 36 3.744 -0.767 6.385
257 3HB ALA 36 3HB ALA 36 2.985 0.543 7.292
258 H THR 37 H THR 37 6.631 -0.033 5.667
259 HA THR 37 HA THR 37 6.233 2.664 4.565
260 HB THR 37 HB THR 37 8.507 2.339 3.495
261 HG1 THR 37 1HG THR 37 8.870 0.164 3.734
262 1HG2 THR 37 1HG2 THR 37 8.383 2.418 6.515
263 2HG2 THR 37 2HG2 THR 37 8.222 3.798 5.427
264 3HG2 THR 37 3HG2 THR 37 9.756 2.935 5.535
265 H VAL 38 H VAL 38 5.714 2.842 2.445
266 HA VAL 38 HA VAL 38 5.326 0.303 1.005
267 HB VAL 38 HB VAL 38 3.188 1.273 1.706
268 1HG1 VAL 38 1HG1 VAL 38 3.785 3.611 1.797
269 2HG1 VAL 38 2HG1 VAL 38 2.383 3.380 0.753
270 3HG1 VAL 38 3HG1 VAL 38 3.974 3.658 0.044
271 1HG2 VAL 38 1HG2 VAL 38 3.203 -0.035 -0.312
272 2HG2 VAL 38 2HG2 VAL 38 3.678 1.369 -1.267
273 3HG2 VAL 38 3HG2 VAL 38 2.085 1.313 -0.510
274 H THR 39 H THR 39 6.128 0.130 -0.989
275 HA THR 39 HA THR 39 7.151 2.564 -2.298
276 HB THR 39 HB THR 39 8.380 -0.195 -2.492
277 HG1 THR 39 1HG THR 39 8.495 1.441 -0.459
278 1HG2 THR 39 1HG2 THR 39 8.803 1.233 -4.424
279 2HG2 THR 39 2HG2 THR 39 10.280 1.034 -3.480
280 3HG2 THR 39 3HG2 THR 39 9.353 2.531 -3.367
281 H PHE 40 H PHE 40 6.340 2.901 -4.304
282 HA PHE 40 HA PHE 40 4.767 0.727 -5.488
283 1HB PHE 40 2HB PHE 40 4.734 3.710 -5.968
284 2HB PHE 40 1HB PHE 40 3.787 2.556 -6.904
285 HD1 PHE 40 2HD PHE 40 1.933 1.335 -5.863
286 HD2 PHE 40 1HD PHE 40 4.100 4.332 -3.751
287 HE1 PHE 40 2HE PHE 40 0.125 1.464 -4.201
288 HE2 PHE 40 1HE PHE 40 2.294 4.467 -2.085
289 HZ PHE 40 HZ PHE 40 0.305 3.030 -2.311
290 H THR 41 H THR 41 5.700 -0.401 -7.004
291 HA THR 41 HA THR 41 7.796 0.810 -8.649
292 HB THR 41 HB THR 41 7.656 -1.956 -9.185
293 HG1 THR 41 1HG THR 41 6.479 -2.178 -7.217
294 1HG2 THR 41 1HG2 THR 41 9.862 -1.982 -8.094
295 2HG2 THR 41 2HG2 THR 41 9.552 -0.372 -7.446
296 3HG2 THR 41 3HG2 THR 41 9.687 -0.610 -9.188
297 H GLU 42 H GLU 42 7.818 -0.600 -10.885
298 HA GLU 42 HA GLU 42 6.077 0.667 -12.550
299 1HB GLU 42 2HB GLU 42 8.092 -0.514 -13.281
300 2HB GLU 42 1HB GLU 42 7.306 -2.055 -12.980
301 1HG GLU 42 2HG GLU 42 5.622 -1.500 -14.698
302 2HG GLU 42 1HG GLU 42 6.496 -0.004 -15.030
303 H ASP 43 H ASP 43 5.698 -2.799 -11.689
304 HA ASP 43 HA ASP 43 2.816 -2.492 -12.264
305 1HB ASP 43 2HB ASP 43 4.062 -3.530 -14.177
306 2HB ASP 43 1HB ASP 43 4.526 -4.846 -13.110
307 H GLU 44 H GLU 44 4.841 -2.917 -9.902
308 HA GLU 44 HA GLU 44 3.082 -4.772 -8.479
309 1HB GLU 44 2HB GLU 44 4.995 -5.865 -7.401
310 2HB GLU 44 1HB GLU 44 5.014 -6.101 -9.140
311 1HG GLU 44 2HG GLU 44 6.602 -3.905 -7.878
312 2HG GLU 44 1HG GLU 44 7.212 -5.556 -7.921
313 H VAL 45 H VAL 45 2.780 -4.348 -6.340
314 HA VAL 45 HA VAL 45 3.945 -1.857 -5.295
315 HB VAL 45 HB VAL 45 1.604 -3.489 -4.268
316 1HG1 VAL 45 1HG1 VAL 45 1.197 -1.584 -2.755
317 2HG1 VAL 45 2HG1 VAL 45 2.704 -0.846 -3.300
318 3HG1 VAL 45 3HG1 VAL 45 2.737 -2.381 -2.433
319 1HG2 VAL 45 1HG2 VAL 45 1.051 -2.351 -6.326
320 2HG2 VAL 45 2HG2 VAL 45 1.672 -0.829 -5.682
321 3HG2 VAL 45 3HG2 VAL 45 0.242 -1.573 -4.968
322 H VAL 46 H VAL 46 5.385 -1.923 -3.654
323 HA VAL 46 HA VAL 46 5.869 -4.551 -2.411
324 HB VAL 46 HB VAL 46 7.810 -2.249 -2.678
325 1HG1 VAL 46 1HG1 VAL 46 8.253 -3.633 -0.724
326 2HG1 VAL 46 2HG1 VAL 46 9.492 -3.891 -1.954
327 3HG1 VAL 46 3HG1 VAL 46 8.213 -5.084 -1.725
328 1HG2 VAL 46 1HG2 VAL 46 8.953 -3.610 -4.357
329 2HG2 VAL 46 2HG2 VAL 46 7.300 -3.249 -4.859
330 3HG2 VAL 46 3HG2 VAL 46 7.700 -4.841 -4.219
331 H GLU 47 H GLU 47 5.281 -4.711 -0.365
332 HA GLU 47 HA GLU 47 5.139 -2.280 1.264
333 1HB GLU 47 2HB GLU 47 3.687 -4.861 1.329
334 2HB GLU 47 1HB GLU 47 4.018 -4.096 2.875
335 1HG GLU 47 2HG GLU 47 2.873 -2.098 2.184
336 2HG GLU 47 1HG GLU 47 2.638 -2.757 0.572
337 H THR 48 H THR 48 6.262 -2.034 3.049
338 HA THR 48 HA THR 48 8.197 -4.152 3.734
339 HB THR 48 HB THR 48 9.108 -1.468 4.381
340 HG1 THR 48 1HG THR 48 7.910 -1.614 2.073
341 1HG2 THR 48 1HG2 THR 48 10.290 -3.702 2.734
342 2HG2 THR 48 2HG2 THR 48 10.523 -3.453 4.465
343 3HG2 THR 48 3HG2 THR 48 11.157 -2.281 3.310
344 H GLU 49 H GLU 49 8.005 -4.807 5.744
345 HA GLU 49 HA GLU 49 6.495 -3.155 7.648
346 1HB GLU 49 2HB GLU 49 7.271 -6.057 7.885
347 2HB GLU 49 1HB GLU 49 6.129 -5.188 8.894
348 1HG GLU 49 2HG GLU 49 4.603 -4.953 7.039
349 2HG GLU 49 1HG GLU 49 5.760 -5.718 5.952
350 H VAL 50 H VAL 50 7.607 -2.079 9.131
351 HA VAL 50 HA VAL 50 10.418 -2.695 9.545
352 HB VAL 50 HB VAL 50 8.787 -0.472 10.787
353 1HG1 VAL 50 1HG1 VAL 50 11.764 -0.815 10.461
354 2HG1 VAL 50 2HG1 VAL 50 10.860 -0.977 11.968
355 3HG1 VAL 50 3HG1 VAL 50 10.954 0.588 11.159
356 1HG2 VAL 50 1HG2 VAL 50 8.715 -0.279 8.364
357 2HG2 VAL 50 2HG2 VAL 50 10.469 -0.440 8.283
358 3HG2 VAL 50 3HG2 VAL 50 9.750 0.978 9.045
359 H MET 51 H MET 51 10.921 -4.176 11.017
360 HA MET 51 HA MET 51 9.248 -4.354 13.442
361 1HB MET 51 2HB MET 51 9.664 -6.344 11.626
362 2HB MET 51 1HB MET 51 10.972 -6.650 12.760
363 1HG MET 51 2HG MET 51 8.039 -6.505 13.413
364 2HG MET 51 1HG MET 51 9.032 -7.958 13.338
365 1HE MET 51 1HE MET 51 8.177 -7.457 17.166
366 2HE MET 51 2HE MET 51 7.990 -8.519 15.770
367 3HE MET 51 3HE MET 51 7.147 -6.969 15.821
368 H GLU 52 H GLU 52 10.209 -3.962 15.314
369 HA GLU 52 HA GLU 52 12.713 -2.787 15.477
370 1HB GLU 52 2HB GLU 52 12.418 -3.156 17.952
371 2HB GLU 52 1HB GLU 52 11.109 -2.311 17.152
372 1HG GLU 52 2HG GLU 52 9.752 -4.288 17.165
373 2HG GLU 52 1HG GLU 52 11.091 -5.249 17.788
374 H GLY 53 H GLY 53 14.734 -3.517 15.761
375 1HA GLY 53 2HA GLY 53 16.377 -5.010 16.593
376 2HA GLY 53 1HA GLY 53 15.163 -6.280 16.641
377 H ARG 54 H ARG 54 14.150 -5.898 14.021
378 HA ARG 54 HA ARG 54 16.273 -7.222 12.516
379 1HB ARG 54 2HB ARG 54 13.463 -6.767 11.562
380 2HB ARG 54 1HB ARG 54 14.575 -8.054 11.125
381 1HG ARG 54 2HG ARG 54 13.428 -7.766 13.877
382 2HG ARG 54 1HG ARG 54 12.637 -8.673 12.596
383 1HD ARG 54 2HD ARG 54 14.677 -10.066 12.386
384 2HD ARG 54 1HD ARG 54 15.374 -9.191 13.750
385 HE ARG 54 HE ARG 54 12.821 -10.311 14.377
386 1HH1 ARG 54 1HH1 ARG 54 16.230 -11.070 14.063
387 2HH1 ARG 54 2HH1 ARG 54 16.157 -12.424 15.151
388 1HH2 ARG 54 1HH2 ARG 54 12.713 -12.087 15.800
389 2HH2 ARG 54 2HH2 ARG 54 14.160 -12.983 16.167
390 H GLY 55 H GLY 55 13.737 -4.874 11.852
391 1HA GLY 55 2HA GLY 55 14.493 -2.672 10.893
392 2HA GLY 55 1HA GLY 55 15.451 -3.651 9.785
393 H GLU 56 H GLU 56 14.232 -2.590 8.065
394 HA GLU 56 HA GLU 56 11.446 -3.124 7.787
395 1HB GLU 56 2HB GLU 56 13.396 -2.428 5.596
396 2HB GLU 56 1HB GLU 56 11.659 -2.184 5.604
397 1HG GLU 56 2HG GLU 56 12.339 -0.088 6.066
398 2HG GLU 56 1HG GLU 56 12.212 -0.710 7.704
399 H VAL 57 H VAL 57 10.467 -4.779 6.999
400 HA VAL 57 HA VAL 57 12.048 -6.956 5.789
401 HB VAL 57 HB VAL 57 9.462 -7.071 7.348
402 1HG1 VAL 57 1HG1 VAL 57 9.458 -8.764 5.600
403 2HG1 VAL 57 2HG1 VAL 57 9.686 -9.529 7.173
404 3HG1 VAL 57 3HG1 VAL 57 11.061 -9.309 6.092
405 1HG2 VAL 57 1HG2 VAL 57 12.231 -8.045 8.036
406 2HG2 VAL 57 2HG2 VAL 57 10.782 -8.324 9.001
407 3HG2 VAL 57 3HG2 VAL 57 11.386 -6.682 8.768
408 H GLN 58 H GLN 58 11.650 -7.356 3.703
409 HA GLN 58 HA GLN 58 9.561 -5.902 2.363
410 1HB GLN 58 2HB GLN 58 11.712 -7.740 1.322
411 2HB GLN 58 1HB GLN 58 10.647 -6.762 0.331
412 1HG GLN 58 2HG GLN 58 11.548 -4.743 1.429
413 2HG GLN 58 1HG GLN 58 12.689 -5.769 2.291
414 1HE2 GLN 58 1HE2 GLN 58 13.129 -3.601 0.378
415 2HE2 GLN 58 2HE2 GLN 58 14.095 -4.278 -0.888
416 H LEU 59 H LEU 59 7.699 -6.676 1.659
417 HA LEU 59 HA LEU 59 7.059 -9.493 2.004
418 1HB LEU 59 2HB LEU 59 5.433 -7.076 1.217
419 2HB LEU 59 1HB LEU 59 4.777 -8.702 1.215
420 HG LEU 59 HG LEU 59 5.877 -7.279 3.639
421 1HD1 LEU 59 1HD1 LEU 59 3.550 -7.160 4.369
422 2HD1 LEU 59 2HD1 LEU 59 3.032 -7.886 2.847
423 3HD1 LEU 59 3HD1 LEU 59 3.784 -6.291 2.851
424 1HD2 LEU 59 1HD2 LEU 59 4.447 -9.920 3.373
425 2HD2 LEU 59 2HD2 LEU 59 4.935 -9.153 4.885
426 3HD2 LEU 59 3HD2 LEU 59 6.158 -9.705 3.739
427 HA PRO 60 HA PRO 60 7.293 -10.866 -2.232
428 1HB PRO 60 2HB PRO 60 4.375 -11.441 -2.117
429 2HB PRO 60 1HB PRO 60 5.716 -12.506 -2.553
430 1HG PRO 60 2HG PRO 60 4.500 -12.742 -0.195
431 2HG PRO 60 1HG PRO 60 6.256 -12.946 -0.342
432 1HD PRO 60 2HD PRO 60 4.699 -10.627 0.717
433 2HD PRO 60 1HD PRO 60 6.246 -11.297 1.271
434 H PHE 61 H PHE 61 6.791 -10.230 -4.358
435 HA PHE 61 HA PHE 61 5.860 -7.535 -4.575
436 1HB PHE 61 2HB PHE 61 6.468 -9.499 -6.773
437 2HB PHE 61 1HB PHE 61 6.286 -7.766 -6.966
438 HD1 PHE 61 1HD PHE 61 7.935 -6.255 -5.754
439 HD2 PHE 61 2HD PHE 61 8.559 -10.428 -6.283
440 HE1 PHE 61 1HE PHE 61 10.339 -5.939 -5.351
441 HE2 PHE 61 2HE PHE 61 10.967 -10.119 -5.883
442 HZ PHE 61 HZ PHE 61 11.861 -7.872 -5.413
443 H MET 62 H MET 62 3.867 -6.970 -4.590
444 HA MET 62 HA MET 62 1.762 -8.819 -5.446
445 1HB MET 62 2HB MET 62 1.651 -6.188 -3.957
446 2HB MET 62 1HB MET 62 0.243 -7.155 -4.374
447 1HG MET 62 2HG MET 62 0.878 -8.891 -2.914
448 2HG MET 62 1HG MET 62 2.498 -8.229 -2.711
449 1HE MET 62 1HE MET 62 -1.334 -7.579 -2.029
450 2HE MET 62 2HE MET 62 -0.778 -6.064 -2.740
451 3HE MET 62 3HE MET 62 -1.259 -6.116 -1.045
452 H ALA 63 H ALA 63 0.962 -8.618 -7.449
453 HA ALA 63 HA ALA 63 1.857 -6.460 -9.119
454 1HB ALA 63 1HB ALA 63 0.666 -7.631 -10.902
455 2HB ALA 63 2HB ALA 63 -0.037 -8.726 -9.711
456 3HB ALA 63 3HB ALA 63 1.705 -8.724 -9.986
457 H TYR 64 H TYR 64 0.728 -4.795 -9.980
458 HA TYR 64 HA TYR 64 -2.144 -4.609 -9.518
459 1HB TYR 64 2HB TYR 64 -2.119 -2.568 -8.357
460 2HB TYR 64 1HB TYR 64 -0.822 -3.476 -7.590
461 HD1 TYR 64 2HD TYR 64 1.584 -3.020 -8.460
462 HD2 TYR 64 1HD TYR 64 -1.715 -0.439 -9.198
463 HE1 TYR 64 2HE TYR 64 3.139 -1.175 -8.931
464 HE2 TYR 64 1HE TYR 64 -0.168 1.413 -9.673
465 HH TYR 64 HH TYR 64 3.249 0.911 -10.015
466 H LYS 65 H LYS 65 -3.182 -3.170 -10.976
467 HA LYS 65 HA LYS 65 -1.429 -1.971 -12.990
468 1HB LYS 65 2HB LYS 65 -3.714 -3.850 -13.517
469 2HB LYS 65 1HB LYS 65 -3.188 -2.678 -14.722
470 1HG LYS 65 2HG LYS 65 -0.904 -3.602 -14.551
471 2HG LYS 65 1HG LYS 65 -1.527 -4.845 -13.480
472 1HD LYS 65 2HD LYS 65 -2.822 -5.817 -15.183
473 2HD LYS 65 1HD LYS 65 -2.647 -4.402 -16.228
474 1HE LYS 65 2HE LYS 65 -1.240 -6.344 -16.914
475 2HE LYS 65 1HE LYS 65 -0.328 -4.873 -16.589
476 1HZ LYS 65 1HZ LYS 65 -0.650 -7.132 -14.688
477 2HZ LYS 65 2HZ LYS 65 0.291 -5.739 -14.432
478 3HZ LYS 65 3HZ LYS 65 0.723 -6.849 -15.636
479 H VAL 66 H VAL 66 -2.311 -0.309 -14.193
480 HA VAL 66 HA VAL 66 -3.804 1.446 -12.457
481 HB VAL 66 HB VAL 66 -2.470 1.918 -15.126
482 1HG1 VAL 66 1HG1 VAL 66 -2.695 4.318 -14.608
483 2HG1 VAL 66 2HG1 VAL 66 -3.669 3.908 -13.197
484 3HG1 VAL 66 3HG1 VAL 66 -4.259 3.529 -14.816
485 1HG2 VAL 66 1HG2 VAL 66 -0.913 1.361 -13.348
486 2HG2 VAL 66 2HG2 VAL 66 -1.615 2.610 -12.318
487 3HG2 VAL 66 3HG2 VAL 66 -0.760 3.062 -13.792
488 H ILE 67 H ILE 67 -5.844 1.961 -12.604
489 HA ILE 67 HA ILE 67 -7.459 1.071 -14.869
490 HB ILE 67 HB ILE 67 -8.372 2.535 -12.389
491 1HG1 ILE 67 2HG1 ILE 67 -8.277 -0.450 -12.868
492 2HG1 ILE 67 1HG1 ILE 67 -7.203 0.446 -11.796
493 1HG2 ILE 67 1HG2 ILE 67 -9.958 2.594 -14.216
494 2HG2 ILE 67 2HG2 ILE 67 -10.555 1.540 -12.935
495 3HG2 ILE 67 3HG2 ILE 67 -9.854 0.843 -14.396
496 1HD1 ILE 67 1HD1 ILE 67 -8.971 -0.677 -10.562
497 2HD1 ILE 67 2HD1 ILE 67 -10.185 0.199 -11.490
498 3HD1 ILE 67 3HD1 ILE 67 -9.099 1.073 -10.410
499 H SER 68 H SER 68 -6.849 3.999 -13.002
500 HA SER 68 HA SER 68 -7.054 5.592 -15.453
501 1HB SER 68 2HB SER 68 -8.333 6.458 -12.859
502 2HB SER 68 1HB SER 68 -8.432 7.262 -14.412
503 HG SER 68 HG SER 68 -9.439 5.166 -15.122
504 H GLN 69 H GLN 69 -6.015 7.720 -15.177
505 HA GLN 69 HA GLN 69 -4.062 7.895 -13.031
506 1HB GLN 69 2HB GLN 69 -3.007 6.414 -14.723
507 2HB GLN 69 1HB GLN 69 -3.217 7.675 -15.930
508 1HG GLN 69 2HG GLN 69 -1.768 9.149 -14.549
509 2HG GLN 69 1HG GLN 69 -1.474 7.777 -13.482
510 1HE2 GLN 69 1HE2 GLN 69 -0.212 6.065 -14.208
511 2HE2 GLN 69 2HE2 GLN 69 0.801 6.198 -15.600
512 H SER 70 H SER 70 -3.056 9.972 -12.918
513 HA SER 70 HA SER 70 -3.757 11.984 -14.849
514 1HB SER 70 2HB SER 70 -5.790 11.875 -13.454
515 2HB SER 70 1HB SER 70 -4.813 12.193 -12.021
516 HG SER 70 HG SER 70 -5.791 14.097 -12.850
517 H THR 71 H THR 71 -2.224 13.499 -14.934
518 HA THR 71 HA THR 71 -0.103 13.557 -13.002
519 HB THR 71 HB THR 71 0.439 15.707 -14.467
520 HG1 THR 71 1HG THR 71 -1.350 15.853 -15.729
521 1HG2 THR 71 1HG2 THR 71 1.629 14.235 -16.049
522 2HG2 THR 71 2HG2 THR 71 0.680 12.865 -15.473
523 3HG2 THR 71 3HG2 THR 71 1.804 13.678 -14.385
524 H ASP 72 H ASP 72 -3.161 14.966 -13.261
525 HA ASP 72 HA ASP 72 -2.741 17.437 -11.953
526 1HB ASP 72 2HB ASP 72 -4.810 17.057 -13.149
527 2HB ASP 72 1HB ASP 72 -5.200 15.682 -12.124
528 H GLY 73 H GLY 73 -3.460 14.181 -10.781
529 1HA GLY 73 2HA GLY 73 -1.927 13.873 -8.726
530 2HA GLY 73 1HA GLY 73 -2.926 15.144 -8.051
531 H SER 74 H SER 74 -4.183 12.513 -10.062
532 HA SER 74 HA SER 74 -4.875 10.980 -7.718
533 1HB SER 74 2HB SER 74 -6.982 11.814 -9.690
534 2HB SER 74 1HB SER 74 -7.202 10.858 -8.251
535 HG SER 74 HG SER 74 -6.031 13.103 -7.512
536 H ILE 75 H ILE 75 -4.905 8.889 -8.083
537 HA ILE 75 HA ILE 75 -4.951 7.846 -10.832
538 HB ILE 75 HB ILE 75 -2.957 6.964 -8.731
539 1HG1 ILE 75 2HG1 ILE 75 -2.589 8.685 -11.190
540 2HG1 ILE 75 1HG1 ILE 75 -2.272 9.126 -9.521
541 1HG2 ILE 75 1HG2 ILE 75 -3.298 6.134 -11.605
542 2HG2 ILE 75 2HG2 ILE 75 -3.611 5.147 -10.179
543 3HG2 ILE 75 3HG2 ILE 75 -1.963 5.650 -10.560
544 1HD1 ILE 75 1HD1 ILE 75 -0.444 7.510 -9.440
545 2HD1 ILE 75 2HD1 ILE 75 -0.210 8.710 -10.712
546 3HD1 ILE 75 3HD1 ILE 75 -0.759 7.085 -11.122
547 H GLU 76 H GLU 76 -6.123 5.963 -11.036
548 HA GLU 76 HA GLU 76 -6.968 4.654 -8.529
549 1HB GLU 76 2HB GLU 76 -8.763 5.741 -10.072
550 2HB GLU 76 1HB GLU 76 -8.464 4.363 -11.124
551 1HG GLU 76 2HG GLU 76 -8.983 2.855 -9.232
552 2HG GLU 76 1HG GLU 76 -9.401 4.265 -8.264
553 H ILE 77 H ILE 77 -6.407 2.566 -8.267
554 HA ILE 77 HA ILE 77 -5.318 1.127 -10.590
555 HB ILE 77 HB ILE 77 -3.519 0.218 -9.129
556 1HG1 ILE 77 2HG1 ILE 77 -4.400 2.393 -7.217
557 2HG1 ILE 77 1HG1 ILE 77 -4.645 0.672 -6.961
558 1HG2 ILE 77 1HG2 ILE 77 -2.106 2.231 -9.165
559 2HG2 ILE 77 2HG2 ILE 77 -3.543 3.211 -9.463
560 3HG2 ILE 77 3HG2 ILE 77 -3.022 2.022 -10.657
561 1HD1 ILE 77 1HD1 ILE 77 -1.983 2.046 -7.172
562 2HD1 ILE 77 2HD1 ILE 77 -2.241 0.328 -6.874
563 3HD1 ILE 77 3HD1 ILE 77 -2.759 1.522 -5.680
564 H GLN 78 H GLN 78 -5.297 -1.185 -10.366
565 HA GLN 78 HA GLN 78 -7.005 -2.210 -8.190
566 1HB GLN 78 2HB GLN 78 -8.218 -2.261 -10.345
567 2HB GLN 78 1HB GLN 78 -6.924 -3.219 -11.047
568 1HG GLN 78 2HG GLN 78 -8.833 -4.599 -10.418
569 2HG GLN 78 1HG GLN 78 -7.390 -5.031 -9.503
570 1HE2 GLN 78 1HE2 GLN 78 -10.603 -3.743 -9.352
571 2HE2 GLN 78 2HE2 GLN 78 -10.690 -3.623 -7.630
572 H TYR 79 H TYR 79 -6.451 -4.232 -7.360
573 HA TYR 79 HA TYR 79 -3.634 -4.920 -7.789
574 1HB TYR 79 2HB TYR 79 -5.538 -5.769 -5.596
575 2HB TYR 79 1HB TYR 79 -3.824 -6.157 -5.673
576 HD1 TYR 79 1HD TYR 79 -2.135 -4.354 -5.355
577 HD2 TYR 79 2HD TYR 79 -6.297 -3.650 -4.815
578 HE1 TYR 79 1HE TYR 79 -1.619 -2.293 -4.114
579 HE2 TYR 79 2HE TYR 79 -5.793 -1.591 -3.573
580 HH TYR 79 HH TYR 79 -3.949 -0.629 -2.282
581 H LEU 80 H LEU 80 -2.993 -7.083 -8.102
582 HA LEU 80 HA LEU 80 -5.085 -8.727 -9.368
583 1HB LEU 80 2HB LEU 80 -2.086 -8.834 -9.755
584 2HB LEU 80 1HB LEU 80 -3.287 -9.733 -10.664
585 HG LEU 80 HG LEU 80 -3.122 -6.717 -10.672
586 1HD1 LEU 80 1HD1 LEU 80 -1.067 -7.644 -11.588
587 2HD1 LEU 80 2HD1 LEU 80 -2.062 -6.936 -12.861
588 3HD1 LEU 80 3HD1 LEU 80 -2.005 -8.686 -12.660
589 1HD2 LEU 80 1HD2 LEU 80 -4.487 -6.938 -12.699
590 2HD2 LEU 80 2HD2 LEU 80 -5.301 -7.594 -11.280
591 3HD2 LEU 80 3HD2 LEU 80 -4.559 -8.682 -12.455
592 H GLY 81 H GLY 81 -4.896 -11.072 -9.105
593 1HA GLY 81 2HA GLY 81 -4.345 -12.972 -7.815
594 2HA GLY 81 1HA GLY 81 -3.524 -11.924 -6.661
595 HA PRO 82 HA PRO 82 -7.569 -13.064 -4.685
596 1HB PRO 82 2HB PRO 82 -5.921 -12.611 -2.269
597 2HB PRO 82 1HB PRO 82 -6.966 -13.975 -2.674
598 1HG PRO 82 2HG PRO 82 -4.316 -14.219 -2.729
599 2HG PRO 82 1HG PRO 82 -5.336 -15.020 -3.941
600 1HD PRO 82 2HD PRO 82 -3.717 -12.508 -4.194
601 2HD PRO 82 1HD PRO 82 -3.916 -13.840 -5.352
602 H TYR 83 H TYR 83 -5.622 -10.350 -4.885
603 HA TYR 83 HA TYR 83 -7.261 -8.723 -3.087
604 1HB TYR 83 2HB TYR 83 -4.747 -7.998 -4.611
605 2HB TYR 83 1HB TYR 83 -5.581 -6.969 -3.453
606 HD1 TYR 83 1HD TYR 83 -5.881 -8.009 -1.059
607 HD2 TYR 83 2HD TYR 83 -2.969 -9.282 -3.882
608 HE1 TYR 83 1HE TYR 83 -4.528 -8.945 0.767
609 HE2 TYR 83 2HE TYR 83 -1.614 -10.230 -2.063
610 HH TYR 83 HH TYR 83 -1.396 -9.674 0.538
611 H TYR 84 H TYR 84 -7.749 -9.818 -5.996
612 HA TYR 84 HA TYR 84 -8.097 -7.538 -7.619
613 1HB TYR 84 2HB TYR 84 -9.454 -9.067 -9.051
614 2HB TYR 84 1HB TYR 84 -7.867 -9.686 -8.651
615 HD1 TYR 84 1HD TYR 84 -10.656 -9.860 -6.237
616 HD2 TYR 84 2HD TYR 84 -8.429 -11.939 -9.207
617 HE1 TYR 84 1HE TYR 84 -11.642 -11.976 -5.489
618 HE2 TYR 84 2HE TYR 84 -9.411 -14.062 -8.466
619 HH TYR 84 HH TYR 84 -12.075 -14.227 -6.351
620 HA PRO 85 HA PRO 85 -11.441 -5.287 -8.235
621 1HB PRO 85 2HB PRO 85 -13.450 -7.139 -7.093
622 2HB PRO 85 1HB PRO 85 -13.685 -5.857 -8.276
623 1HG PRO 85 2HG PRO 85 -13.034 -8.535 -8.863
624 2HG PRO 85 1HG PRO 85 -12.928 -7.164 -9.983
625 1HD PRO 85 2HD PRO 85 -10.755 -8.669 -9.099
626 2HD PRO 85 1HD PRO 85 -10.640 -7.017 -9.748
627 H LEU 86 H LEU 86 -10.580 -6.414 -5.136
628 HA LEU 86 HA LEU 86 -11.839 -4.078 -3.910
629 1HB LEU 86 2HB LEU 86 -11.605 -6.172 -2.594
630 2HB LEU 86 1HB LEU 86 -9.862 -6.045 -2.730
631 HG LEU 86 HG LEU 86 -9.931 -3.923 -1.464
632 1HD1 LEU 86 1HD1 LEU 86 -11.979 -3.268 -0.316
633 2HD1 LEU 86 2HD1 LEU 86 -12.861 -4.551 -1.145
634 3HD1 LEU 86 3HD1 LEU 86 -12.179 -3.211 -2.066
635 1HD2 LEU 86 1HD2 LEU 86 -11.287 -6.228 -0.074
636 2HD2 LEU 86 2HD2 LEU 86 -10.427 -4.900 0.707
637 3HD2 LEU 86 3HD2 LEU 86 -9.549 -6.043 -0.308
638 H LYS 87 H LYS 87 -10.949 -2.193 -4.469
639 HA LYS 87 HA LYS 87 -8.084 -2.217 -5.153
640 1HB LYS 87 2HB LYS 87 -8.627 -0.481 -6.843
641 2HB LYS 87 1HB LYS 87 -9.403 -2.027 -7.154
642 1HG LYS 87 2HG LYS 87 -11.454 -1.078 -6.024
643 2HG LYS 87 1HG LYS 87 -10.648 0.492 -6.101
644 1HD LYS 87 2HD LYS 87 -10.487 0.308 -8.524
645 2HD LYS 87 1HD LYS 87 -11.241 -1.286 -8.464
646 1HE LYS 87 2HE LYS 87 -12.950 0.226 -9.068
647 2HE LYS 87 1HE LYS 87 -13.224 -0.178 -7.376
648 1HZ LYS 87 1HZ LYS 87 -13.496 2.142 -7.605
649 2HZ LYS 87 2HZ LYS 87 -12.048 2.313 -8.469
650 3HZ LYS 87 3HZ LYS 87 -12.009 1.919 -6.818
651 H SER 88 H SER 88 -7.360 0.205 -5.455
652 HA SER 88 HA SER 88 -8.109 1.693 -3.058
653 1HB SER 88 2HB SER 88 -5.461 0.587 -3.843
654 2HB SER 88 1HB SER 88 -5.506 2.157 -3.066
655 HG SER 88 HG SER 88 -6.431 1.270 -1.294
656 H THR 89 H THR 89 -7.210 3.911 -3.089
657 HA THR 89 HA THR 89 -7.005 4.960 -5.837
658 HB THR 89 HB THR 89 -8.250 6.472 -3.560
659 HG1 THR 89 1HG THR 89 -10.246 5.841 -4.972
660 1HG2 THR 89 1HG2 THR 89 -9.239 7.804 -5.376
661 2HG2 THR 89 2HG2 THR 89 -8.399 6.799 -6.557
662 3HG2 THR 89 3HG2 THR 89 -7.476 7.807 -5.445
663 H LEU 90 H LEU 90 -5.548 6.556 -6.177
664 HA LEU 90 HA LEU 90 -3.759 7.269 -3.942
665 1HB LEU 90 2HB LEU 90 -3.068 6.912 -6.865
666 2HB LEU 90 1HB LEU 90 -1.955 7.465 -5.630
667 HG LEU 90 HG LEU 90 -3.253 4.738 -5.700
668 1HD1 LEU 90 1HD1 LEU 90 -1.660 5.001 -7.513
669 2HD1 LEU 90 2HD1 LEU 90 -0.994 3.942 -6.268
670 3HD1 LEU 90 3HD1 LEU 90 -0.448 5.615 -6.389
671 1HD2 LEU 90 1HD2 LEU 90 -2.760 5.488 -3.432
672 2HD2 LEU 90 2HD2 LEU 90 -1.105 5.877 -3.906
673 3HD2 LEU 90 3HD2 LEU 90 -1.657 4.200 -3.917
674 H LYS 91 H LYS 91 -3.695 9.400 -3.503
675 HA LYS 91 HA LYS 91 -4.330 11.274 -5.665
676 1HB LYS 91 2HB LYS 91 -5.695 11.126 -2.988
677 2HB LYS 91 1HB LYS 91 -5.735 12.568 -3.991
678 1HG LYS 91 2HG LYS 91 -7.098 11.612 -5.558
679 2HG LYS 91 1HG LYS 91 -6.544 9.976 -5.203
680 1HD LYS 91 2HD LYS 91 -8.857 10.333 -4.482
681 2HD LYS 91 1HD LYS 91 -7.792 9.985 -3.120
682 1HE LYS 91 2HE LYS 91 -7.679 12.367 -2.599
683 2HE LYS 91 1HE LYS 91 -8.737 12.720 -3.966
684 1HZ LYS 91 1HZ LYS 91 -10.483 11.456 -2.927
685 2HZ LYS 91 2HZ LYS 91 -9.936 12.644 -1.849
686 3HZ LYS 91 3HZ LYS 91 -9.467 11.023 -1.639
687 H ARG 92 H ARG 92 -3.646 13.434 -5.279
688 HA ARG 92 HA ARG 92 -1.035 13.555 -4.247
689 1HB ARG 92 2HB ARG 92 -1.090 15.887 -4.871
690 2HB ARG 92 1HB ARG 92 -1.887 14.940 -6.118
691 1HG ARG 92 2HG ARG 92 -4.060 15.535 -5.099
692 2HG ARG 92 1HG ARG 92 -3.201 16.589 -3.982
693 1HD ARG 92 2HD ARG 92 -2.317 17.862 -5.891
694 2HD ARG 92 1HD ARG 92 -3.230 16.829 -6.991
695 HE ARG 92 HE ARG 92 -4.625 18.408 -4.930
696 1HH1 ARG 92 1HH1 ARG 92 -4.053 17.632 -8.291
697 2HH1 ARG 92 2HH1 ARG 92 -5.385 18.578 -8.872
698 1HH2 ARG 92 1HH2 ARG 92 -6.372 19.691 -5.702
699 2HH2 ARG 92 2HH2 ARG 92 -6.691 19.753 -7.410
700 H GLY 93 H GLY 93 -0.186 14.409 -2.389
701 1HA GLY 93 2HA GLY 93 -2.113 15.466 -0.428
702 2HA GLY 93 1HA GLY 93 -0.663 14.567 0.010
703 H GLU 94 H GLU 94 -1.763 17.461 0.320
704 HA GLU 94 HA GLU 94 0.105 19.132 -0.984
705 1HB GLU 94 2HB GLU 94 -1.692 19.594 1.398
706 2HB GLU 94 1HB GLU 94 -0.787 20.855 0.577
707 1HG GLU 94 2HG GLU 94 -2.001 20.480 -1.464
708 2HG GLU 94 1HG GLU 94 -2.821 19.091 -0.760
709 H ASN 95 H ASN 95 1.690 20.495 0.113
710 HA ASN 95 HA ASN 95 3.579 20.811 1.320
711 1HB ASN 95 2HB ASN 95 2.520 18.669 3.171
712 2HB ASN 95 1HB ASN 95 3.969 19.619 3.465
713 1HD2 ASN 95 1HD2 ASN 95 2.685 22.056 2.326
714 2HD2 ASN 95 2HD2 ASN 95 1.597 22.603 3.556
715 H GLY 96 H GLY 96 2.709 18.018 -0.232
716 1HA GLY 96 2HA GLY 96 4.292 16.886 -1.625
717 2HA GLY 96 1HA GLY 96 5.531 17.207 -0.419
718 H THR 97 H THR 97 2.306 15.702 -0.379
719 HA THR 97 HA THR 97 3.538 13.322 0.790
720 HB THR 97 HB THR 97 1.405 13.110 2.189
721 HG1 THR 97 1HG THR 97 1.281 15.930 1.964
722 1HG2 THR 97 1HG2 THR 97 2.296 14.492 3.992
723 2HG2 THR 97 2HG2 THR 97 3.322 15.349 2.844
724 3HG2 THR 97 3HG2 THR 97 3.596 13.637 3.164
725 H LEU 98 H LEU 98 1.842 11.485 0.864
726 HA LEU 98 HA LEU 98 0.274 11.540 -1.624
727 1HB LEU 98 2HB LEU 98 2.227 10.093 -1.873
728 2HB LEU 98 1HB LEU 98 1.784 9.211 -0.424
729 HG LEU 98 HG LEU 98 -0.284 8.437 -1.574
730 1HD1 LEU 98 1HD1 LEU 98 0.956 9.749 -3.994
731 2HD1 LEU 98 2HD1 LEU 98 -0.510 10.278 -3.168
732 3HD1 LEU 98 3HD1 LEU 98 -0.477 8.722 -3.996
733 1HD2 LEU 98 1HD2 LEU 98 0.842 6.832 -3.044
734 2HD2 LEU 98 2HD2 LEU 98 1.712 7.036 -1.523
735 3HD2 LEU 98 3HD2 LEU 98 2.306 7.812 -2.989
736 H ILE 99 H ILE 99 -1.809 11.028 -1.442
737 HA ILE 99 HA ILE 99 -2.735 9.972 1.140
738 HB ILE 99 HB ILE 99 -4.308 11.412 -1.010
739 1HG1 ILE 99 2HG1 ILE 99 -3.423 12.283 1.756
740 2HG1 ILE 99 1HG1 ILE 99 -2.769 12.877 0.230
741 1HG2 ILE 99 1HG2 ILE 99 -5.710 9.799 0.119
742 2HG2 ILE 99 2HG2 ILE 99 -6.130 11.421 0.670
743 3HG2 ILE 99 3HG2 ILE 99 -5.153 10.367 1.691
744 1HD1 ILE 99 1HD1 ILE 99 -4.304 14.467 1.219
745 2HD1 ILE 99 2HD1 ILE 99 -5.584 13.255 1.225
746 3HD1 ILE 99 3HD1 ILE 99 -4.942 13.850 -0.306
747 H TRP 100 H TRP 100 -2.957 7.882 1.137
748 HA TRP 100 HA TRP 100 -3.774 6.511 -1.328
749 1HB TRP 100 2HB TRP 100 -1.647 5.736 -0.465
750 2HB TRP 100 1HB TRP 100 -2.334 5.505 1.137
751 HD1 TRP 100 HD TRP 100 -4.033 4.222 -2.085
752 HE1 TRP 100 1HE TRP 100 -4.120 1.657 -1.978
753 HE3 TRP 100 3HE TRP 100 -1.305 3.482 2.180
754 HZ2 TRP 100 2HZ TRP 100 -3.166 -0.414 -0.311
755 HZ3 TRP 100 3HZ TRP 100 -0.944 1.178 2.962
756 HH2 TRP 100 HH TRP 100 -1.854 -0.727 1.741
757 H GLU 101 H GLU 101 -5.846 6.065 -1.410
758 HA GLU 101 HA GLU 101 -7.304 5.569 1.090
759 1HB GLU 101 2HB GLU 101 -8.098 6.568 -1.597
760 2HB GLU 101 1HB GLU 101 -9.293 5.701 -0.655
761 1HG GLU 101 2HG GLU 101 -9.093 7.264 1.145
762 2HG GLU 101 1HG GLU 101 -7.753 8.079 0.347
763 H GLN 102 H GLN 102 -8.250 3.706 1.490
764 HA GLN 102 HA GLN 102 -8.190 1.574 -0.487
765 1HB GLN 102 2HB GLN 102 -5.949 1.432 0.394
766 2HB GLN 102 1HB GLN 102 -6.538 1.528 2.046
767 1HG GLN 102 2HG GLN 102 -7.555 -0.725 0.438
768 2HG GLN 102 1HG GLN 102 -5.850 -0.769 0.831
769 1HE2 GLN 102 1HE2 GLN 102 -7.879 -2.559 1.749
770 2HE2 GLN 102 2HE2 GLN 102 -7.893 -2.447 3.473
771 H ASN 103 H ASN 103 -10.278 0.970 -0.336
772 HA ASN 103 HA ASN 103 -12.003 -0.273 0.501
773 1HB ASN 103 2HB ASN 103 -10.064 -1.704 1.100
774 2HB ASN 103 1HB ASN 103 -9.968 -0.901 2.653
775 1HD2 ASN 103 1HD2 ASN 103 -10.081 -2.947 3.531
776 2HD2 ASN 103 2HD2 ASN 103 -11.607 -3.757 3.743
777 H GLY 104 H GLY 104 -11.711 2.519 1.236
778 1HA GLY 104 2HA GLY 104 -13.370 3.777 2.392
779 2HA GLY 104 1HA GLY 104 -13.451 2.505 3.601
780 H GLN 105 H GLN 105 -10.315 2.610 3.424
781 HA GLN 105 HA GLN 105 -10.149 4.495 5.646
782 1HB GLN 105 2HB GLN 105 -8.082 2.547 4.608
783 2HB GLN 105 1HB GLN 105 -7.972 3.476 6.095
784 1HG GLN 105 2HG GLN 105 -10.020 2.290 6.884
785 2HG GLN 105 1HG GLN 105 -9.897 1.263 5.460
786 1HE2 GLN 105 1HE2 GLN 105 -9.595 -0.590 6.703
787 2HE2 GLN 105 2HE2 GLN 105 -8.096 -0.907 7.516
788 H ARG 106 H ARG 106 -9.056 6.359 5.607
789 HA ARG 106 HA ARG 106 -7.687 7.111 3.124
790 1HB ARG 106 2HB ARG 106 -9.497 8.559 4.198
791 2HB ARG 106 1HB ARG 106 -8.345 8.879 5.483
792 1HG ARG 106 2HG ARG 106 -6.791 9.802 3.770
793 2HG ARG 106 1HG ARG 106 -8.081 9.616 2.580
794 1HD ARG 106 2HD ARG 106 -9.510 10.976 4.231
795 2HD ARG 106 1HD ARG 106 -7.973 11.423 4.968
796 HE ARG 106 HE ARG 106 -8.509 11.914 2.108
797 1HH1 ARG 106 1HH1 ARG 106 -7.457 13.036 5.259
798 2HH1 ARG 106 2HH1 ARG 106 -7.170 14.666 4.713
799 1HH2 ARG 106 1HH2 ARG 106 -8.113 14.065 1.396
800 2HH2 ARG 106 2HH2 ARG 106 -7.547 15.242 2.548
801 H LYS 107 H LYS 107 -5.553 6.738 3.111
802 HA LYS 107 HA LYS 107 -4.079 6.950 5.653
803 1HB LYS 107 2HB LYS 107 -3.623 5.310 3.181
804 2HB LYS 107 1HB LYS 107 -2.290 5.681 4.267
805 1HG LYS 107 2HG LYS 107 -4.828 4.244 5.019
806 2HG LYS 107 1HG LYS 107 -3.245 3.509 4.764
807 1HD LYS 107 2HD LYS 107 -2.352 4.895 6.596
808 2HD LYS 107 1HD LYS 107 -3.980 5.507 6.890
809 1HE LYS 107 2HE LYS 107 -3.428 3.713 8.422
810 2HE LYS 107 1HE LYS 107 -4.749 3.240 7.362
811 1HZ LYS 107 1HZ LYS 107 -1.955 2.548 6.690
812 2HZ LYS 107 2HZ LYS 107 -3.395 1.795 6.188
813 3HZ LYS 107 3HZ LYS 107 -2.841 1.588 7.776
814 H THR 108 H THR 108 -2.465 8.367 5.848
815 HA THR 108 HA THR 108 -1.669 9.884 3.452
816 HB THR 108 HB THR 108 -1.727 10.967 6.276
817 HG1 THR 108 1HG THR 108 -3.725 10.683 4.400
818 1HG2 THR 108 1HG2 THR 108 -0.156 12.081 4.769
819 2HG2 THR 108 2HG2 THR 108 -1.514 13.138 5.156
820 3HG2 THR 108 3HG2 THR 108 -1.445 12.327 3.592
821 H MET 109 H MET 109 0.361 9.359 2.921
822 HA MET 109 HA MET 109 2.231 8.773 5.115
823 1HB MET 109 2HB MET 109 3.475 7.353 3.454
824 2HB MET 109 1HB MET 109 1.908 6.734 3.943
825 1HG MET 109 2HG MET 109 2.240 8.332 1.436
826 2HG MET 109 1HG MET 109 2.554 6.600 1.476
827 1HE MET 109 1HE MET 109 0.330 5.728 3.683
828 2HE MET 109 2HE MET 109 0.716 4.809 2.229
829 3HE MET 109 3HE MET 109 -0.960 5.216 2.594
830 H THR 110 H THR 110 4.392 9.408 4.873
831 HA THR 110 HA THR 110 4.738 11.702 3.048
832 HB THR 110 HB THR 110 6.471 11.224 5.439
833 HG1 THR 110 1HG THR 110 3.807 11.645 5.521
834 1HG2 THR 110 1HG2 THR 110 5.512 13.725 4.041
835 2HG2 THR 110 2HG2 THR 110 7.104 12.983 3.873
836 3HG2 THR 110 3HG2 THR 110 6.614 13.678 5.418
837 H ARG 111 H ARG 111 6.821 11.951 2.041
838 HA ARG 111 HA ARG 111 7.916 9.357 1.317
839 1HB ARG 111 2HB ARG 111 7.333 10.955 -0.472
840 2HB ARG 111 1HB ARG 111 8.520 12.086 0.165
841 1HG ARG 111 2HG ARG 111 10.305 10.496 -0.297
842 2HG ARG 111 1HG ARG 111 9.124 9.338 -0.908
843 1HD ARG 111 2HD ARG 111 8.514 10.894 -2.688
844 2HD ARG 111 1HD ARG 111 9.680 12.065 -2.068
845 HE ARG 111 HE ARG 111 11.066 9.698 -2.522
846 1HH1 ARG 111 1HH1 ARG 111 9.332 12.097 -4.401
847 2HH1 ARG 111 2HH1 ARG 111 10.266 11.833 -5.835
848 1HH2 ARG 111 1HH2 ARG 111 12.302 9.350 -4.402
849 2HH2 ARG 111 2HH2 ARG 111 11.951 10.255 -5.850
850 H ILE 112 H ILE 112 9.891 8.651 1.805
851 HA ILE 112 HA ILE 112 11.378 9.996 3.850
852 HB ILE 112 HB ILE 112 12.251 7.617 2.228
853 1HG1 ILE 112 2HG1 ILE 112 10.020 7.222 3.174
854 2HG1 ILE 112 1HG1 ILE 112 11.235 6.227 3.954
855 1HG2 ILE 112 1HG2 ILE 112 12.996 8.518 5.003
856 2HG2 ILE 112 2HG2 ILE 112 14.012 8.639 3.566
857 3HG2 ILE 112 3HG2 ILE 112 13.573 7.054 4.203
858 1HD1 ILE 112 1HD1 ILE 112 9.648 7.112 5.561
859 2HD1 ILE 112 2HD1 ILE 112 10.063 8.756 5.078
860 3HD1 ILE 112 3HD1 ILE 112 11.270 7.737 5.862
861 H GLU 113 H GLU 113 13.504 10.801 3.666
862 HA GLU 113 HA GLU 113 13.885 12.115 1.106
863 1HB GLU 113 2HB GLU 113 13.924 13.387 3.283
864 2HB GLU 113 1HB GLU 113 15.443 12.579 3.651
865 1HG GLU 113 2HG GLU 113 15.697 14.866 2.710
866 2HG GLU 113 1HG GLU 113 16.533 13.607 1.798
867 H SER 114 H SER 114 15.938 12.224 0.065
868 HA SER 114 HA SER 114 17.064 9.596 -0.107
869 1HB SER 114 2HB SER 114 17.796 12.117 -1.610
870 2HB SER 114 1HB SER 114 18.302 10.479 -2.025
871 HG SER 114 HG SER 114 15.562 11.056 -1.741
872 H LYS 115 H LYS 115 17.894 9.690 2.142
873 HA LYS 115 HA LYS 115 20.682 10.648 2.069
874 1HB LYS 115 2HB LYS 115 18.982 9.834 4.439
875 2HB LYS 115 1HB LYS 115 20.690 10.229 4.530
876 1HG LYS 115 2HG LYS 115 20.148 12.499 3.686
877 2HG LYS 115 1HG LYS 115 18.437 12.077 3.787
878 1HD LYS 115 2HD LYS 115 18.685 11.650 6.186
879 2HD LYS 115 1HD LYS 115 20.396 12.066 6.085
880 1HE LYS 115 2HE LYS 115 18.068 13.902 5.531
881 2HE LYS 115 1HE LYS 115 19.101 13.930 6.957
882 1HZ LYS 115 1HZ LYS 115 19.888 15.617 5.548
883 2HZ LYS 115 2HZ LYS 115 19.814 14.632 4.172
884 3HZ LYS 115 3HZ LYS 115 20.996 14.344 5.354
885 H THR 116 H THR 116 20.746 8.773 0.509
886 HA THR 116 HA THR 116 20.342 6.141 1.569
887 HB THR 116 HB THR 116 21.390 5.552 -0.755
888 HG1 THR 116 1HG THR 116 22.182 7.445 -1.498
889 1HG2 THR 116 1HG2 THR 116 18.739 6.986 -0.509
890 2HG2 THR 116 2HG2 THR 116 19.024 5.277 -0.180
891 3HG2 THR 116 3HG2 THR 116 19.205 5.901 -1.819
892 H GLY 117 H GLY 117 21.792 5.570 3.091
893 1HA GLY 117 2HA GLY 117 24.636 5.933 2.697
894 2HA GLY 117 1HA GLY 117 23.862 5.086 4.032
895 H ARG 118 H ARG 118 24.351 4.782 0.527
896 HA ARG 118 HA ARG 118 24.303 1.875 0.809
897 1HB ARG 118 2HB ARG 118 24.241 1.971 -1.735
898 2HB ARG 118 1HB ARG 118 22.818 2.548 -0.884
899 1HG ARG 118 2HG ARG 118 23.523 4.844 -1.227
900 2HG ARG 118 1HG ARG 118 24.994 4.287 -2.025
901 1HD ARG 118 2HD ARG 118 23.301 4.977 -3.647
902 2HD ARG 118 1HD ARG 118 23.674 3.262 -3.788
903 HE ARG 118 HE ARG 118 21.557 3.028 -2.307
904 1HH1 ARG 118 1HH1 ARG 118 22.046 5.401 -4.849
905 2HH1 ARG 118 2HH1 ARG 118 20.353 5.514 -5.226
906 1HH2 ARG 118 1HH2 ARG 118 19.340 3.192 -2.802
907 2HH2 ARG 118 2HH2 ARG 118 18.806 4.286 -4.048
908 H GLU 119 H GLU 119 26.355 1.761 1.768
909 HA GLU 119 HA GLU 119 28.520 1.797 -0.216
910 1HB GLU 119 2HB GLU 119 28.778 2.604 2.698
911 2HB GLU 119 1HB GLU 119 30.123 2.394 1.591
912 1HG GLU 119 2HG GLU 119 29.832 4.687 1.670
913 2HG GLU 119 1HG GLU 119 28.995 4.223 0.190
914 H GLU 120 H GLU 120 30.217 0.194 0.291
915 HA GLU 120 HA GLU 120 29.108 -2.218 1.381
916 1HB GLU 120 2HB GLU 120 31.967 -1.608 0.605
917 2HB GLU 120 1HB GLU 120 31.347 -3.196 1.015
918 1HG GLU 120 2HG GLU 120 31.462 -3.141 -1.320
919 2HG GLU 120 1HG GLU 120 29.757 -2.942 -0.926
920 H LYS 121 H LYS 121 28.727 -2.210 3.484
921 HA LYS 121 HA LYS 121 30.480 -0.859 5.335
922 1HB LYS 121 2HB LYS 121 28.007 -2.526 5.821
923 2HB LYS 121 1HB LYS 121 28.867 -1.614 7.051
924 1HG LYS 121 2HG LYS 121 28.363 0.461 5.805
925 2HG LYS 121 1HG LYS 121 27.404 -0.498 4.673
926 1HD LYS 121 2HD LYS 121 25.946 -1.215 6.489
927 2HD LYS 121 1HD LYS 121 26.923 -0.307 7.647
928 1HE LYS 121 2HE LYS 121 26.372 1.762 6.400
929 2HE LYS 121 1HE LYS 121 25.295 0.815 5.372
930 1HZ LYS 121 1HZ LYS 121 24.077 1.894 7.152
931 2HZ LYS 121 2HZ LYS 121 25.048 1.139 8.315
932 3HZ LYS 121 3HZ LYS 121 24.016 0.210 7.339
933 H ASP 122 H ASP 122 31.939 -1.783 6.660
934 HA ASP 122 HA ASP 122 32.313 -4.671 6.517
935 1HB ASP 122 2HB ASP 122 34.208 -2.883 6.498
936 2HB ASP 122 1HB ASP 122 33.928 -2.794 8.235
937 H GLU 123 H GLU 123 32.535 -5.874 8.612
938 HA GLU 123 HA GLU 123 30.153 -5.461 10.093
939 1HB GLU 123 2HB GLU 123 32.460 -7.345 10.569
940 2HB GLU 123 1HB GLU 123 30.939 -7.390 11.452
941 1HG GLU 123 2HG GLU 123 29.790 -7.687 9.239
942 2HG GLU 123 1HG GLU 123 31.389 -7.914 8.530
943 H LYS 124 H LYS 124 29.772 -4.542 11.990
944 HA LYS 124 HA LYS 124 31.578 -2.606 12.926
945 1HB LYS 124 2HB LYS 124 29.908 -2.253 14.753
946 2HB LYS 124 1HB LYS 124 29.244 -2.171 13.131
947 1HG LYS 124 2HG LYS 124 28.332 -4.415 13.369
948 2HG LYS 124 1HG LYS 124 29.040 -4.537 14.982
949 1HD LYS 124 2HD LYS 124 27.681 -2.617 15.704
950 2HD LYS 124 1HD LYS 124 26.949 -2.545 14.101
951 1HE LYS 124 2HE LYS 124 26.017 -4.770 14.404
952 2HE LYS 124 1HE LYS 124 26.796 -4.903 15.980
953 1HZ LYS 124 1HZ LYS 124 24.667 -2.969 15.222
954 2HZ LYS 124 2HZ LYS 124 25.460 -2.993 16.719
955 3HZ LYS 124 3HZ LYS 124 24.495 -4.306 16.251
956 H SER 125 H SER 125 33.408 -3.177 13.785
957 HA SER 125 HA SER 125 33.595 -5.320 15.723
958 1HB SER 125 2HB SER 125 35.368 -5.030 14.025
959 2HB SER 125 1HB SER 125 35.718 -3.426 14.669
960 HG SER 125 HG SER 125 36.977 -4.375 16.031
961 H LYS 126 H LYS 126 32.775 -4.815 17.648
962 HA LYS 126 HA LYS 126 32.629 -3.952 19.735
963 1HB LYS 126 2HB LYS 126 35.086 -3.797 19.671
964 2HB LYS 126 1HB LYS 126 34.970 -2.211 18.923
965 1HG LYS 126 2HG LYS 126 33.809 -1.384 20.946
966 2HG LYS 126 1HG LYS 126 34.053 -2.963 21.693
967 1HD LYS 126 2HD LYS 126 35.775 -1.476 22.467
968 2HD LYS 126 1HD LYS 126 36.506 -2.664 21.386
969 1HE LYS 126 2HE LYS 126 36.447 -1.037 19.558
970 2HE LYS 126 1HE LYS 126 35.717 0.152 20.636
971 1HZ LYS 126 1HZ LYS 126 38.086 0.522 20.432
972 2HZ LYS 126 2HZ LYS 126 38.411 -1.059 20.947
973 3HZ LYS 126 3HZ LYS 126 37.714 0.053 22.019
974 H SER 127 H SER 127 33.661 -1.057 17.953
975 HA SER 127 HA SER 127 31.063 0.121 17.898
976 1HB SER 127 2HB SER 127 31.632 0.370 20.320
977 2HB SER 127 1HB SER 127 33.070 1.278 19.860
978 HG SER 127 HG SER 127 30.368 1.994 19.303
979 H LEU 128 H LEU 128 31.049 1.714 16.364
980 HA LEU 128 HA LEU 128 33.674 2.348 15.190
981 1HB LEU 128 2HB LEU 128 31.968 0.866 13.925
982 2HB LEU 128 1HB LEU 128 31.085 2.354 13.658
983 HG LEU 128 HG LEU 128 32.517 1.669 11.740
984 1HD1 LEU 128 1HD1 LEU 128 31.897 4.010 12.009
985 2HD1 LEU 128 2HD1 LEU 128 33.514 3.850 11.321
986 3HD1 LEU 128 3HD1 LEU 128 33.316 4.275 13.022
987 1HD2 LEU 128 1HD2 LEU 128 34.791 2.280 13.619
988 2HD2 LEU 128 2HD2 LEU 128 34.933 1.917 11.899
989 3HD2 LEU 128 3HD2 LEU 128 34.349 0.685 13.017
990 H GLU 129 H GLU 129 34.182 4.332 15.845
991 HA GLU 129 HA GLU 129 32.736 6.548 14.789
992 1HB GLU 129 2HB GLU 129 32.248 7.716 16.870
993 2HB GLU 129 1HB GLU 129 31.419 6.165 16.863
994 1HG GLU 129 2HG GLU 129 33.051 5.220 18.345
995 2HG GLU 129 1HG GLU 129 34.036 6.680 18.258
996 H HIS 130 H HIS 130 34.013 8.423 14.762
997 HA HIS 130 HA HIS 130 36.770 8.087 15.666
998 1HB HIS 130 2HB HIS 130 35.405 10.233 14.024
999 2HB HIS 130 1HB HIS 130 37.065 10.381 14.588
1000 HD1 HIS 130 1HD HIS 130 38.694 9.756 12.844
1001 HD2 HIS 130 2HD HIS 130 35.156 7.587 12.504
1002 HE1 HIS 130 1HE HIS 130 38.995 8.271 10.834
1003 HE2 HIS 130 2HE HIS 130 36.919 6.842 10.759
1004 H HIS 131 H HIS 131 37.092 8.465 17.749
1005 HA HIS 131 HA HIS 131 35.276 9.872 19.387
1006 1HB HIS 131 2HB HIS 131 36.889 8.083 20.142
1007 2HB HIS 131 1HB HIS 131 38.168 9.289 20.049
1008 HD1 HIS 131 1HD HIS 131 38.621 10.457 22.200
1009 HD2 HIS 131 2HD HIS 131 34.717 9.025 21.986
1010 HE1 HIS 131 1HE HIS 131 37.577 10.985 24.427
1011 HE2 HIS 131 2HE HIS 131 35.242 10.036 24.307
1012 H HIS 132 H HIS 132 34.909 11.963 19.265
1013 HA HIS 132 HA HIS 132 37.179 13.724 18.629
1014 1HB HIS 132 2HB HIS 132 35.504 15.229 17.525
1015 2HB HIS 132 1HB HIS 132 35.740 13.679 16.726
1016 HD1 HIS 132 1HD HIS 132 33.782 11.891 17.073
1017 HD2 HIS 132 2HD HIS 132 32.925 15.781 18.275
1018 HE1 HIS 132 1HE HIS 132 31.277 12.000 17.289
1019 HE2 HIS 132 2HE HIS 132 30.780 14.412 17.807
1020 H HIS 133 H HIS 133 37.625 15.336 19.916
1021 HA HIS 133 HA HIS 133 35.779 15.951 22.131
1022 1HB HIS 133 2HB HIS 133 38.272 15.195 22.433
1023 2HB HIS 133 1HB HIS 133 38.646 16.851 21.973
1024 HD1 HIS 133 1HD HIS 133 38.620 18.551 23.825
1025 HD2 HIS 133 2HD HIS 133 36.629 15.040 24.854
1026 HE1 HIS 133 1HE HIS 133 38.076 18.765 26.271
1027 HE2 HIS 133 2HE HIS 133 37.074 16.546 26.914
1028 H HIS 134 H HIS 134 34.642 17.826 21.927
1029 HA HIS 134 HA HIS 134 35.259 19.495 19.640
1030 1HB HIS 134 2HB HIS 134 32.921 18.714 20.351
1031 2HB HIS 134 1HB HIS 134 33.008 19.961 21.590
1032 HD1 HIS 134 1HD HIS 134 30.836 20.823 20.166
1033 HD2 HIS 134 2HD HIS 134 34.565 21.225 18.356
1034 HE1 HIS 134 1HE HIS 134 30.523 22.511 18.319
1035 HE2 HIS 134 2HE HIS 134 32.789 22.728 17.228
1036 H HIS 135 H HIS 135 36.216 19.519 22.818
1037 HA HIS 135 HA HIS 135 37.157 22.265 22.535
1038 1HB HIS 135 2HB HIS 135 35.008 22.238 23.911
1039 2HB HIS 135 1HB HIS 135 35.898 21.323 25.120
1040 HD1 HIS 135 1HD HIS 135 35.773 24.723 23.509
1041 HD2 HIS 135 2HD HIS 135 37.531 22.846 26.774
1042 HE1 HIS 135 1HE HIS 135 36.726 26.572 24.917
1043 HE2 HIS 135 2HE HIS 135 37.931 25.408 26.798
Start of MODEL 8
1 1H MET 1 1HT MET 1 30.252 39.451 -6.082
2 2H MET 1 2HT MET 1 28.945 40.025 -6.998
3 3H MET 1 3HT MET 1 29.100 38.367 -6.687
4 HA MET 1 HA MET 1 28.688 38.659 -4.384
5 1HB MET 1 2HB MET 1 28.557 41.610 -5.055
6 2HB MET 1 1HB MET 1 28.106 40.914 -3.505
7 1HG MET 1 2HG MET 1 30.382 40.143 -3.163
8 2HG MET 1 1HG MET 1 30.849 40.780 -4.739
9 1HE MET 1 1HE MET 1 29.606 43.369 -1.126
10 2HE MET 1 2HE MET 1 29.798 41.617 -1.066
11 3HE MET 1 3HE MET 1 28.477 42.327 -1.994
12 H ILE 2 H ILE 2 26.515 39.302 -3.431
13 HA ILE 2 HA ILE 2 24.259 39.263 -3.473
14 HB ILE 2 HB ILE 2 24.494 40.332 -6.293
15 1HG1 ILE 2 2HG1 ILE 2 23.968 41.752 -3.670
16 2HG1 ILE 2 1HG1 ILE 2 25.479 41.808 -4.574
17 1HG2 ILE 2 1HG2 ILE 2 22.107 40.224 -4.440
18 2HG2 ILE 2 2HG2 ILE 2 22.334 39.264 -5.903
19 3HG2 ILE 2 3HG2 ILE 2 22.157 41.014 -6.016
20 1HD1 ILE 2 1HD1 ILE 2 24.304 42.895 -6.431
21 2HD1 ILE 2 2HD1 ILE 2 24.194 43.820 -4.935
22 3HD1 ILE 2 3HD1 ILE 2 22.813 42.873 -5.489
23 H MET 3 H MET 3 23.977 37.115 -3.255
24 HA MET 3 HA MET 3 23.176 35.712 -5.709
25 1HB MET 3 2HB MET 3 24.698 34.497 -3.395
26 2HB MET 3 1HB MET 3 24.034 33.595 -4.748
27 1HG MET 3 2HG MET 3 25.489 34.995 -6.249
28 2HG MET 3 1HG MET 3 26.269 35.597 -4.789
29 1HE MET 3 1HE MET 3 24.844 32.013 -5.483
30 2HE MET 3 2HE MET 3 26.276 31.162 -6.056
31 3HE MET 3 3HE MET 3 25.568 32.449 -7.034
32 H VAL 4 H VAL 4 21.115 35.132 -5.622
33 HA VAL 4 HA VAL 4 19.815 35.033 -2.980
34 HB VAL 4 HB VAL 4 17.688 35.361 -4.160
35 1HG1 VAL 4 1HG1 VAL 4 18.919 37.315 -3.379
36 2HG1 VAL 4 2HG1 VAL 4 18.042 37.679 -4.866
37 3HG1 VAL 4 3HG1 VAL 4 19.783 37.395 -4.914
38 1HG2 VAL 4 1HG2 VAL 4 17.629 35.886 -6.541
39 2HG2 VAL 4 2HG2 VAL 4 18.262 34.262 -6.271
40 3HG2 VAL 4 3HG2 VAL 4 19.362 35.584 -6.660
41 H SER 5 H SER 5 18.597 33.268 -2.356
42 HA SER 5 HA SER 5 19.027 30.855 -3.970
43 1HB SER 5 2HB SER 5 19.752 31.057 -1.493
44 2HB SER 5 1HB SER 5 18.037 30.879 -1.124
45 HG SER 5 HG SER 5 18.052 28.846 -1.871
46 H GLY 6 H GLY 6 16.714 33.129 -3.600
47 1HA GLY 6 2HA GLY 6 14.372 31.448 -3.467
48 2HA GLY 6 1HA GLY 6 14.404 33.168 -3.839
49 H CYS 7 H CYS 7 15.399 30.066 -5.237
50 HA CYS 7 HA CYS 7 15.326 31.168 -7.912
51 1HB CYS 7 2HB CYS 7 15.879 28.331 -7.033
52 2HB CYS 7 1HB CYS 7 16.254 29.043 -8.598
53 HG CYS 7 HG CYS 7 18.105 28.909 -5.911
54 H GLN 8 H GLN 8 14.055 30.375 -9.601
55 HA GLN 8 HA GLN 8 11.530 29.123 -8.763
56 1HB GLN 8 2HB GLN 8 12.204 30.716 -11.245
57 2HB GLN 8 1HB GLN 8 10.632 30.014 -10.892
58 1HG GLN 8 2HG GLN 8 10.431 31.445 -8.924
59 2HG GLN 8 1HG GLN 8 12.012 32.146 -9.277
60 1HE2 GLN 8 1HE2 GLN 8 9.407 33.434 -9.103
61 2HE2 GLN 8 2HE2 GLN 8 9.142 34.192 -10.634
62 H GLN 9 H GLN 9 11.132 28.686 -11.776
63 HA GLN 9 HA GLN 9 11.541 27.174 -13.419
64 1HB GLN 9 2HB GLN 9 14.148 26.746 -11.950
65 2HB GLN 9 1HB GLN 9 13.755 26.023 -13.504
66 1HG GLN 9 2HG GLN 9 13.560 28.242 -14.496
67 2HG GLN 9 1HG GLN 9 13.935 28.973 -12.936
68 1HE2 GLN 9 1HE2 GLN 9 16.035 28.900 -12.160
69 2HE2 GLN 9 2HE2 GLN 9 17.373 28.465 -13.167
70 H GLN 10 H GLN 10 10.076 26.505 -11.067
71 HA GLN 10 HA GLN 10 10.607 23.855 -10.264
72 1HB GLN 10 2HB GLN 10 8.185 23.819 -9.616
73 2HB GLN 10 1HB GLN 10 9.110 25.144 -8.928
74 1HG GLN 10 2HG GLN 10 8.212 26.585 -10.785
75 2HG GLN 10 1HG GLN 10 7.131 25.250 -11.186
76 1HE2 GLN 10 1HE2 GLN 10 5.292 26.396 -10.702
77 2HE2 GLN 10 2HE2 GLN 10 4.845 26.818 -9.082
78 H LYS 11 H LYS 11 10.359 22.010 -11.291
79 HA LYS 11 HA LYS 11 9.774 22.195 -14.109
80 1HB LYS 11 2HB LYS 11 10.688 19.883 -14.174
81 2HB LYS 11 1HB LYS 11 11.782 21.053 -13.452
82 1HG LYS 11 2HG LYS 11 11.031 20.294 -11.209
83 2HG LYS 11 1HG LYS 11 10.079 19.038 -12.000
84 1HD LYS 11 2HD LYS 11 12.125 18.106 -12.971
85 2HD LYS 11 1HD LYS 11 13.075 19.372 -12.189
86 1HE LYS 11 2HE LYS 11 11.402 17.290 -10.785
87 2HE LYS 11 1HE LYS 11 13.160 17.276 -10.922
88 1HZ LYS 11 1HZ LYS 11 12.348 18.139 -8.773
89 2HZ LYS 11 2HZ LYS 11 11.602 19.427 -9.584
90 3HZ LYS 11 3HZ LYS 11 13.288 19.268 -9.622
91 H GLU 12 H GLU 12 8.274 20.812 -11.288
92 HA GLU 12 HA GLU 12 6.566 19.365 -10.952
93 1HB GLU 12 2HB GLU 12 5.676 21.136 -13.147
94 2HB GLU 12 1HB GLU 12 4.738 19.665 -12.922
95 1HG GLU 12 2HG GLU 12 3.794 21.549 -11.702
96 2HG GLU 12 1HG GLU 12 4.303 20.257 -10.618
97 H GLU 13 H GLU 13 8.361 17.872 -11.554
98 HA GLU 13 HA GLU 13 7.572 16.113 -13.768
99 1HB GLU 13 2HB GLU 13 9.486 17.489 -14.480
100 2HB GLU 13 1HB GLU 13 10.379 17.013 -13.048
101 1HG GLU 13 2HG GLU 13 11.187 15.828 -14.981
102 2HG GLU 13 1HG GLU 13 10.429 14.706 -13.857
103 H THR 14 H THR 14 8.813 13.941 -13.454
104 HA THR 14 HA THR 14 9.311 12.095 -12.273
105 HB THR 14 HB THR 14 9.741 14.182 -10.199
106 HG1 THR 14 1HG THR 14 11.949 13.258 -10.482
107 1HG2 THR 14 1HG2 THR 14 10.691 12.500 -8.696
108 2HG2 THR 14 2HG2 THR 14 10.224 11.224 -9.819
109 3HG2 THR 14 3HG2 THR 14 8.985 12.168 -8.995
110 HA PRO 15 HA PRO 15 5.169 10.873 -11.240
111 1HB PRO 15 2HB PRO 15 6.064 8.476 -10.056
112 2HB PRO 15 1HB PRO 15 5.538 8.698 -11.725
113 1HG PRO 15 2HG PRO 15 8.282 8.626 -10.596
114 2HG PRO 15 1HG PRO 15 7.699 8.086 -12.181
115 1HD PRO 15 2HD PRO 15 9.106 10.353 -11.902
116 2HD PRO 15 1HD PRO 15 7.770 10.232 -13.071
117 H PHE 16 H PHE 16 4.097 11.665 -9.567
118 HA PHE 16 HA PHE 16 5.343 12.296 -7.095
119 1HB PHE 16 2HB PHE 16 3.211 13.187 -6.420
120 2HB PHE 16 1HB PHE 16 3.472 13.605 -8.109
121 HD1 PHE 16 1HD PHE 16 2.280 12.253 -9.880
122 HD2 PHE 16 2HD PHE 16 1.326 11.990 -5.745
123 HE1 PHE 16 1HE PHE 16 0.103 11.263 -10.449
124 HE2 PHE 16 2HE PHE 16 -0.853 10.992 -6.302
125 HZ PHE 16 HZ PHE 16 -1.467 10.625 -8.659
126 H TYR 17 H TYR 17 3.958 9.436 -8.235
127 HA TYR 17 HA TYR 17 3.199 8.497 -5.582
128 1HB TYR 17 2HB TYR 17 2.264 6.559 -6.819
129 2HB TYR 17 1HB TYR 17 1.581 8.093 -7.335
130 HD1 TYR 17 1HD TYR 17 2.117 9.006 -9.549
131 HD2 TYR 17 2HD TYR 17 3.644 5.235 -8.300
132 HE1 TYR 17 1HE TYR 17 2.712 8.481 -11.877
133 HE2 TYR 17 2HE TYR 17 4.238 4.700 -10.625
134 HH TYR 17 HH TYR 17 4.295 7.024 -13.090
135 H TYR 18 H TYR 18 5.899 8.487 -7.566
136 HA TYR 18 HA TYR 18 6.693 5.749 -7.017
137 1HB TYR 18 2HB TYR 18 7.118 6.824 -9.231
138 2HB TYR 18 1HB TYR 18 8.237 7.927 -8.439
139 HD1 TYR 18 1HD TYR 18 7.666 4.437 -9.447
140 HD2 TYR 18 2HD TYR 18 10.450 7.200 -7.803
141 HE1 TYR 18 1HE TYR 18 9.473 2.803 -9.768
142 HE2 TYR 18 2HE TYR 18 12.263 5.570 -8.117
143 HH TYR 18 HH TYR 18 12.492 3.076 -8.312
144 H GLY 19 H GLY 19 8.157 5.110 -5.560
145 1HA GLY 19 2HA GLY 19 10.312 5.869 -4.440
146 2HA GLY 19 1HA GLY 19 9.327 7.198 -3.840
147 H THR 20 H THR 20 10.190 6.251 -1.784
148 HA THR 20 HA THR 20 8.566 3.993 -0.857
149 HB THR 20 HB THR 20 10.942 5.276 0.514
150 HG1 THR 20 1HG THR 20 10.812 2.828 -0.952
151 1HG2 THR 20 1HG2 THR 20 10.939 3.265 1.900
152 2HG2 THR 20 2HG2 THR 20 9.537 2.648 1.029
153 3HG2 THR 20 3HG2 THR 20 9.388 4.095 2.026
154 H TRP 21 H TRP 21 6.955 4.325 0.559
155 HA TRP 21 HA TRP 21 6.707 7.017 1.731
156 1HB TRP 21 2HB TRP 21 4.450 5.214 0.836
157 2HB TRP 21 1HB TRP 21 4.298 6.851 1.467
158 HD1 TRP 21 HD TRP 21 5.080 4.928 -1.705
159 HE1 TRP 21 1HE TRP 21 5.267 6.574 -3.677
160 HE3 TRP 21 3HE TRP 21 5.014 9.330 0.900
161 HZ2 TRP 21 2HZ TRP 21 5.383 9.365 -4.068
162 HZ3 TRP 21 3HZ TRP 21 5.172 11.442 -0.352
163 HH2 TRP 21 HH TRP 21 5.353 11.457 -2.782
164 H ASP 22 H ASP 22 6.337 7.171 3.821
165 HA ASP 22 HA ASP 22 6.026 4.745 5.433
166 1HB ASP 22 2HB ASP 22 7.653 5.999 6.485
167 2HB ASP 22 1HB ASP 22 6.999 7.525 5.906
168 H GLU 23 H GLU 23 4.170 4.357 6.663
169 HA GLU 23 HA GLU 23 1.735 5.235 5.722
170 1HB GLU 23 2HB GLU 23 2.469 4.149 8.428
171 2HB GLU 23 1HB GLU 23 0.809 4.513 7.980
172 1HG GLU 23 2HG GLU 23 1.124 2.967 6.020
173 2HG GLU 23 1HG GLU 23 2.650 2.480 6.761
174 H GLY 24 H GLY 24 3.545 6.516 8.489
175 1HA GLY 24 2HA GLY 24 3.611 8.673 9.291
176 2HA GLY 24 1HA GLY 24 2.536 9.147 7.988
177 H ARG 25 H ARG 25 0.270 7.882 8.399
178 HA ARG 25 HA ARG 25 -0.600 8.936 10.990
179 1HB ARG 25 2HB ARG 25 -1.546 10.015 9.000
180 2HB ARG 25 1HB ARG 25 -2.133 8.465 8.426
181 1HG ARG 25 2HG ARG 25 -3.972 9.650 9.342
182 2HG ARG 25 1HG ARG 25 -3.575 8.348 10.460
183 1HD ARG 25 2HD ARG 25 -2.497 9.867 11.958
184 2HD ARG 25 1HD ARG 25 -2.612 11.184 10.790
185 HE ARG 25 HE ARG 25 -4.923 11.350 11.224
186 1HH1 ARG 25 1HH1 ARG 25 -3.291 9.038 13.292
187 2HH1 ARG 25 2HH1 ARG 25 -4.627 8.888 14.400
188 1HH2 ARG 25 1HH2 ARG 25 -6.666 11.180 12.684
189 2HH2 ARG 25 2HH2 ARG 25 -6.558 10.087 14.036
190 H ALA 26 H ALA 26 -1.763 7.743 12.325
191 HA ALA 26 HA ALA 26 -2.644 5.973 13.424
192 1HB ALA 26 1HB ALA 26 -4.199 5.833 11.543
193 2HB ALA 26 2HB ALA 26 -3.822 4.242 12.202
194 3HB ALA 26 3HB ALA 26 -3.077 4.771 10.693
195 HA PRO 27 HA PRO 27 0.805 3.248 13.869
196 1HB PRO 27 2HB PRO 27 -0.612 1.750 15.876
197 2HB PRO 27 1HB PRO 27 0.635 2.978 16.100
198 1HG PRO 27 2HG PRO 27 -1.987 3.301 16.835
199 2HG PRO 27 1HG PRO 27 -0.888 4.639 16.453
200 1HD PRO 27 2HD PRO 27 -2.980 3.354 14.735
201 2HD PRO 27 1HD PRO 27 -2.563 5.075 14.907
202 H GLY 28 H GLY 28 1.323 0.899 13.989
203 1HA GLY 28 2HA GLY 28 -0.304 -0.572 12.082
204 2HA GLY 28 1HA GLY 28 1.291 -1.022 12.663
205 HA PRO 29 HA PRO 29 -1.703 -3.988 14.528
206 1HB PRO 29 2HB PRO 29 0.215 -5.947 14.774
207 2HB PRO 29 1HB PRO 29 -0.831 -5.740 13.367
208 1HG PRO 29 2HG PRO 29 1.987 -4.841 13.787
209 2HG PRO 29 1HG PRO 29 1.234 -5.530 12.336
210 1HD PRO 29 2HD PRO 29 1.689 -2.896 12.553
211 2HD PRO 29 1HD PRO 29 0.237 -3.524 11.746
212 H THR 30 H THR 30 1.507 -3.054 15.523
213 HA THR 30 HA THR 30 2.411 -2.607 17.562
214 HB THR 30 HB THR 30 -0.360 -3.226 18.609
215 HG1 THR 30 1HG THR 30 1.060 -0.796 18.131
216 1HG2 THR 30 1HG2 THR 30 0.357 -2.162 20.701
217 2HG2 THR 30 2HG2 THR 30 1.999 -2.029 20.074
218 3HG2 THR 30 3HG2 THR 30 1.294 -3.619 20.371
219 H ASP 31 H ASP 31 0.815 -5.600 16.908
220 HA ASP 31 HA ASP 31 1.637 -7.285 18.921
221 1HB ASP 31 2HB ASP 31 1.619 -7.855 15.948
222 2HB ASP 31 1HB ASP 31 1.721 -9.084 17.199
223 H GLY 32 H GLY 32 3.399 -6.570 15.953
224 1HA GLY 32 2HA GLY 32 5.924 -6.631 17.424
225 2HA GLY 32 1HA GLY 32 5.749 -7.738 16.066
226 H VAL 33 H VAL 33 4.335 -6.215 14.285
227 HA VAL 33 HA VAL 33 6.285 -4.321 13.354
228 HB VAL 33 HB VAL 33 3.479 -4.614 12.294
229 1HG1 VAL 33 1HG1 VAL 33 4.517 -3.997 10.163
230 2HG1 VAL 33 2HG1 VAL 33 6.054 -3.780 11.000
231 3HG1 VAL 33 3HG1 VAL 33 4.679 -2.749 11.398
232 1HG2 VAL 33 1HG2 VAL 33 4.411 -6.852 12.427
233 2HG2 VAL 33 2HG2 VAL 33 5.865 -6.313 11.586
234 3HG2 VAL 33 3HG2 VAL 33 4.312 -6.322 10.748
235 H LYS 34 H LYS 34 6.272 -2.154 13.604
236 HA LYS 34 HA LYS 34 4.235 -1.014 15.338
237 1HB LYS 34 2HB LYS 34 6.771 0.215 14.258
238 2HB LYS 34 1HB LYS 34 5.745 0.877 15.518
239 1HG LYS 34 2HG LYS 34 6.270 -1.016 16.959
240 2HG LYS 34 1HG LYS 34 7.297 -1.693 15.693
241 1HD LYS 34 2HD LYS 34 8.692 0.346 15.793
242 2HD LYS 34 1HD LYS 34 7.700 0.928 17.132
243 1HE LYS 34 2HE LYS 34 8.311 -1.096 18.411
244 2HE LYS 34 1HE LYS 34 9.366 -1.586 17.085
245 1HZ LYS 34 1HZ LYS 34 10.633 -0.507 18.797
246 2HZ LYS 34 2HZ LYS 34 9.639 0.866 18.737
247 3HZ LYS 34 3HZ LYS 34 10.626 0.478 17.412
248 H SER 35 H SER 35 5.375 -0.929 12.097
249 HA SER 35 HA SER 35 3.165 0.511 11.062
250 1HB SER 35 2HB SER 35 5.813 2.002 11.055
251 2HB SER 35 1HB SER 35 4.337 2.515 10.248
252 HG SER 35 HG SER 35 3.622 2.148 12.708
253 H ALA 36 H ALA 36 3.465 0.862 8.681
254 HA ALA 36 HA ALA 36 5.496 -0.986 7.600
255 1HB ALA 36 1HB ALA 36 3.257 -1.937 7.440
256 2HB ALA 36 2HB ALA 36 3.910 -1.577 5.842
257 3HB ALA 36 3HB ALA 36 2.704 -0.511 6.565
258 H THR 37 H THR 37 6.522 -0.416 5.713
259 HA THR 37 HA THR 37 5.950 2.277 4.668
260 HB THR 37 HB THR 37 8.388 2.168 3.847
261 HG1 THR 37 1HG THR 37 9.691 0.811 5.359
262 1HG2 THR 37 1HG2 THR 37 7.644 3.644 5.660
263 2HG2 THR 37 2HG2 THR 37 9.260 3.011 5.972
264 3HG2 THR 37 3HG2 THR 37 7.870 2.333 6.818
265 H VAL 38 H VAL 38 5.758 2.476 2.434
266 HA VAL 38 HA VAL 38 5.776 -0.096 0.992
267 HB VAL 38 HB VAL 38 3.481 0.581 1.545
268 1HG1 VAL 38 1HG1 VAL 38 2.475 2.553 0.485
269 2HG1 VAL 38 2HG1 VAL 38 4.065 3.026 -0.117
270 3HG1 VAL 38 3HG1 VAL 38 3.755 2.984 1.619
271 1HG2 VAL 38 1HG2 VAL 38 2.537 0.420 -0.715
272 2HG2 VAL 38 2HG2 VAL 38 3.855 -0.724 -0.455
273 3HG2 VAL 38 3HG2 VAL 38 4.135 0.745 -1.392
274 H THR 39 H THR 39 6.655 -0.129 -1.003
275 HA THR 39 HA THR 39 7.503 2.451 -2.153
276 HB THR 39 HB THR 39 8.918 -0.214 -2.415
277 HG1 THR 39 1HG THR 39 9.056 0.862 -0.316
278 1HG2 THR 39 1HG2 THR 39 10.706 1.089 -3.470
279 2HG2 THR 39 2HG2 THR 39 9.732 2.552 -3.327
280 3HG2 THR 39 3HG2 THR 39 9.200 1.236 -4.376
281 H PHE 40 H PHE 40 6.775 2.877 -4.158
282 HA PHE 40 HA PHE 40 5.172 0.789 -5.448
283 1HB PHE 40 2HB PHE 40 5.110 3.797 -5.685
284 2HB PHE 40 1HB PHE 40 4.182 2.729 -6.731
285 HD1 PHE 40 1HD PHE 40 2.395 1.310 -5.764
286 HD2 PHE 40 2HD PHE 40 4.403 4.288 -3.477
287 HE1 PHE 40 1HE PHE 40 0.578 1.256 -4.103
288 HE2 PHE 40 2HE PHE 40 2.594 4.237 -1.815
289 HZ PHE 40 HZ PHE 40 0.677 2.720 -2.123
290 H THR 41 H THR 41 5.832 -0.138 -7.205
291 HA THR 41 HA THR 41 7.929 1.098 -8.853
292 HB THR 41 HB THR 41 6.904 -1.690 -9.287
293 HG1 THR 41 1HG THR 41 7.841 -0.802 -6.939
294 1HG2 THR 41 1HG2 THR 41 8.595 -0.943 -10.824
295 2HG2 THR 41 2HG2 THR 41 9.354 -2.085 -9.718
296 3HG2 THR 41 3HG2 THR 41 9.606 -0.351 -9.510
297 H GLU 42 H GLU 42 7.465 0.281 -11.350
298 HA GLU 42 HA GLU 42 5.468 1.942 -12.256
299 1HB GLU 42 2HB GLU 42 6.793 -0.388 -13.641
300 2HB GLU 42 1HB GLU 42 5.858 0.860 -14.436
301 1HG GLU 42 2HG GLU 42 7.470 2.532 -13.472
302 2HG GLU 42 1HG GLU 42 8.470 1.158 -13.007
303 H ASP 43 H ASP 43 5.348 -1.605 -11.836
304 HA ASP 43 HA ASP 43 2.436 -1.339 -11.665
305 1HB ASP 43 2HB ASP 43 1.996 -3.215 -13.101
306 2HB ASP 43 1HB ASP 43 3.015 -2.086 -13.985
307 H GLU 44 H GLU 44 4.784 -1.834 -9.842
308 HA GLU 44 HA GLU 44 3.797 -4.319 -8.613
309 1HB GLU 44 2HB GLU 44 6.687 -3.434 -8.779
310 2HB GLU 44 1HB GLU 44 6.097 -4.863 -7.941
311 1HG GLU 44 2HG GLU 44 5.510 -5.929 -9.949
312 2HG GLU 44 1HG GLU 44 5.672 -4.438 -10.873
313 H VAL 45 H VAL 45 3.656 -4.326 -6.404
314 HA VAL 45 HA VAL 45 4.415 -1.835 -5.003
315 HB VAL 45 HB VAL 45 2.168 -3.755 -4.352
316 1HG1 VAL 45 1HG1 VAL 45 1.600 -2.175 -2.541
317 2HG1 VAL 45 2HG1 VAL 45 3.077 -1.275 -2.887
318 3HG1 VAL 45 3HG1 VAL 45 3.175 -2.933 -2.295
319 1HG2 VAL 45 1HG2 VAL 45 2.112 -0.863 -5.199
320 2HG2 VAL 45 2HG2 VAL 45 0.707 -1.853 -4.801
321 3HG2 VAL 45 3HG2 VAL 45 1.689 -2.239 -6.214
322 H VAL 46 H VAL 46 6.094 -2.094 -3.651
323 HA VAL 46 HA VAL 46 6.472 -4.728 -2.385
324 HB VAL 46 HB VAL 46 8.455 -2.473 -2.749
325 1HG1 VAL 46 1HG1 VAL 46 10.115 -3.974 -1.759
326 2HG1 VAL 46 2HG1 VAL 46 8.861 -5.176 -1.462
327 3HG1 VAL 46 3HG1 VAL 46 8.818 -3.630 -0.615
328 1HG2 VAL 46 1HG2 VAL 46 9.663 -4.074 -4.169
329 2HG2 VAL 46 2HG2 VAL 46 8.060 -3.708 -4.809
330 3HG2 VAL 46 3HG2 VAL 46 8.348 -5.233 -3.967
331 H GLU 47 H GLU 47 5.972 -4.898 -0.290
332 HA GLU 47 HA GLU 47 5.718 -2.410 1.253
333 1HB GLU 47 2HB GLU 47 3.607 -3.663 0.914
334 2HB GLU 47 1HB GLU 47 4.311 -5.044 1.740
335 1HG GLU 47 2HG GLU 47 4.549 -3.670 3.768
336 2HG GLU 47 1HG GLU 47 3.778 -2.328 2.925
337 H THR 48 H THR 48 7.001 -2.134 2.916
338 HA THR 48 HA THR 48 8.497 -4.441 3.943
339 HB THR 48 HB THR 48 9.870 -2.321 4.894
340 HG1 THR 48 1HG THR 48 8.853 -0.685 3.873
341 1HG2 THR 48 1HG2 THR 48 10.801 -4.227 3.657
342 2HG2 THR 48 2HG2 THR 48 11.474 -2.695 3.105
343 3HG2 THR 48 3HG2 THR 48 10.237 -3.509 2.148
344 H GLU 49 H GLU 49 8.078 -5.066 5.966
345 HA GLU 49 HA GLU 49 6.379 -3.333 7.619
346 1HB GLU 49 2HB GLU 49 7.077 -6.239 8.065
347 2HB GLU 49 1HB GLU 49 5.823 -5.318 8.877
348 1HG GLU 49 2HG GLU 49 4.598 -5.116 6.782
349 2HG GLU 49 1HG GLU 49 5.864 -6.021 5.952
350 H VAL 50 H VAL 50 7.154 -2.373 9.394
351 HA VAL 50 HA VAL 50 9.962 -2.825 10.063
352 HB VAL 50 HB VAL 50 8.088 -0.691 11.110
353 1HG1 VAL 50 1HG1 VAL 50 10.159 0.469 11.755
354 2HG1 VAL 50 2HG1 VAL 50 11.091 -0.929 11.219
355 3HG1 VAL 50 3HG1 VAL 50 9.975 -1.082 12.576
356 1HG2 VAL 50 1HG2 VAL 50 9.129 0.828 9.518
357 2HG2 VAL 50 2HG2 VAL 50 8.368 -0.524 8.675
358 3HG2 VAL 50 3HG2 VAL 50 10.118 -0.489 8.889
359 H MET 51 H MET 51 10.408 -4.250 11.540
360 HA MET 51 HA MET 51 8.496 -4.754 13.716
361 1HB MET 51 2HB MET 51 10.537 -6.532 12.382
362 2HB MET 51 1HB MET 51 9.626 -6.993 13.811
363 1HG MET 51 2HG MET 51 7.551 -6.829 12.576
364 2HG MET 51 1HG MET 51 8.427 -6.281 11.148
365 1HE MET 51 1HE MET 51 7.392 -8.110 9.599
366 2HE MET 51 2HE MET 51 6.399 -8.637 10.957
367 3HE MET 51 3HE MET 51 7.305 -9.821 10.016
368 H GLU 52 H GLU 52 9.517 -5.481 15.779
369 HA GLU 52 HA GLU 52 11.503 -3.547 16.524
370 1HB GLU 52 2HB GLU 52 9.625 -4.149 18.010
371 2HB GLU 52 1HB GLU 52 10.269 -5.780 18.147
372 1HG GLU 52 2HG GLU 52 10.856 -4.524 20.104
373 2HG GLU 52 1HG GLU 52 12.314 -4.851 19.168
374 H GLY 53 H GLY 53 13.625 -3.816 16.474
375 1HA GLY 53 2HA GLY 53 15.671 -4.835 16.878
376 2HA GLY 53 1HA GLY 53 14.820 -6.319 17.277
377 H ARG 54 H ARG 54 13.431 -5.678 14.519
378 HA ARG 54 HA ARG 54 15.334 -7.284 12.979
379 1HB ARG 54 2HB ARG 54 12.515 -6.526 12.220
380 2HB ARG 54 1HB ARG 54 13.485 -7.851 11.593
381 1HG ARG 54 2HG ARG 54 12.689 -7.724 14.469
382 2HG ARG 54 1HG ARG 54 11.621 -8.384 13.237
383 1HD ARG 54 2HD ARG 54 13.392 -9.980 12.597
384 2HD ARG 54 1HD ARG 54 14.410 -9.333 13.883
385 HE ARG 54 HE ARG 54 12.338 -10.045 15.324
386 1HH1 ARG 54 1HH1 ARG 54 13.798 -11.750 12.634
387 2HH1 ARG 54 2HH1 ARG 54 13.363 -13.323 13.225
388 1HH2 ARG 54 1HH2 ARG 54 11.714 -12.102 16.096
389 2HH2 ARG 54 2HH2 ARG 54 12.153 -13.523 15.196
390 H GLY 55 H GLY 55 13.000 -4.747 12.227
391 1HA GLY 55 2HA GLY 55 13.918 -2.608 11.284
392 2HA GLY 55 1HA GLY 55 14.918 -3.645 10.269
393 H GLU 56 H GLU 56 14.078 -3.035 8.293
394 HA GLU 56 HA GLU 56 11.206 -3.357 7.873
395 1HB GLU 56 2HB GLU 56 13.394 -2.344 6.050
396 2HB GLU 56 1HB GLU 56 11.689 -2.396 5.650
397 1HG GLU 56 2HG GLU 56 11.210 -0.848 7.469
398 2HG GLU 56 1HG GLU 56 12.923 -0.797 7.864
399 H VAL 57 H VAL 57 10.427 -5.160 7.210
400 HA VAL 57 HA VAL 57 12.161 -7.129 5.874
401 HB VAL 57 HB VAL 57 9.540 -7.438 7.347
402 1HG1 VAL 57 1HG1 VAL 57 9.842 -9.866 7.048
403 2HG1 VAL 57 2HG1 VAL 57 11.225 -9.551 6.001
404 3HG1 VAL 57 3HG1 VAL 57 9.614 -9.027 5.512
405 1HG2 VAL 57 1HG2 VAL 57 10.889 -8.760 8.936
406 2HG2 VAL 57 2HG2 VAL 57 11.409 -7.080 8.834
407 3HG2 VAL 57 3HG2 VAL 57 12.340 -8.338 8.023
408 H GLN 58 H GLN 58 11.821 -7.578 3.754
409 HA GLN 58 HA GLN 58 9.782 -6.020 2.410
410 1HB GLN 58 2HB GLN 58 11.866 -7.798 1.165
411 2HB GLN 58 1HB GLN 58 10.992 -6.484 0.415
412 1HG GLN 58 2HG GLN 58 12.144 -4.971 2.107
413 2HG GLN 58 1HG GLN 58 13.201 -6.344 2.417
414 1HE2 GLN 58 1HE2 GLN 58 14.520 -7.126 0.708
415 2HE2 GLN 58 2HE2 GLN 58 14.958 -6.094 -0.614
416 H LEU 59 H LEU 59 7.865 -6.853 1.983
417 HA LEU 59 HA LEU 59 7.430 -9.698 1.789
418 1HB LEU 59 2HB LEU 59 5.635 -7.311 1.341
419 2HB LEU 59 1HB LEU 59 5.093 -8.971 1.175
420 HG LEU 59 HG LEU 59 6.173 -7.745 3.710
421 1HD1 LEU 59 1HD1 LEU 59 3.990 -6.828 3.078
422 2HD1 LEU 59 2HD1 LEU 59 3.874 -7.855 4.507
423 3HD1 LEU 59 3HD1 LEU 59 3.348 -8.465 2.939
424 1HD2 LEU 59 1HD2 LEU 59 5.384 -9.798 4.771
425 2HD2 LEU 59 2HD2 LEU 59 6.611 -10.139 3.553
426 3HD2 LEU 59 3HD2 LEU 59 4.909 -10.433 3.197
427 HA PRO 60 HA PRO 60 7.870 -10.257 -2.573
428 1HB PRO 60 2HB PRO 60 5.509 -11.494 -3.291
429 2HB PRO 60 1HB PRO 60 6.884 -12.319 -2.553
430 1HG PRO 60 2HG PRO 60 4.361 -11.338 -1.300
431 2HG PRO 60 1HG PRO 60 5.282 -12.815 -0.964
432 1HD PRO 60 2HD PRO 60 5.382 -10.645 0.639
433 2HD PRO 60 1HD PRO 60 6.775 -11.716 0.412
434 H PHE 61 H PHE 61 7.404 -9.267 -4.520
435 HA PHE 61 HA PHE 61 6.053 -6.804 -4.359
436 1HB PHE 61 2HB PHE 61 6.473 -6.641 -6.813
437 2HB PHE 61 1HB PHE 61 7.908 -7.001 -5.868
438 HD1 PHE 61 1HD PHE 61 8.922 -9.240 -5.962
439 HD2 PHE 61 2HD PHE 61 5.610 -8.187 -8.416
440 HE1 PHE 61 1HE PHE 61 9.384 -11.177 -7.407
441 HE2 PHE 61 2HE PHE 61 6.060 -10.129 -9.860
442 HZ PHE 61 HZ PHE 61 7.953 -11.627 -9.358
443 H MET 62 H MET 62 4.085 -6.202 -4.794
444 HA MET 62 HA MET 62 2.148 -8.243 -5.604
445 1HB MET 62 2HB MET 62 1.643 -5.463 -4.516
446 2HB MET 62 1HB MET 62 0.460 -6.750 -4.705
447 1HG MET 62 2HG MET 62 1.559 -8.067 -3.010
448 2HG MET 62 1HG MET 62 2.842 -6.867 -2.869
449 1HE MET 62 1HE MET 62 1.289 -7.942 -0.322
450 2HE MET 62 2HE MET 62 1.000 -6.435 0.543
451 3HE MET 62 3HE MET 62 2.546 -6.702 -0.257
452 H ALA 63 H ALA 63 1.562 -8.302 -7.679
453 HA ALA 63 HA ALA 63 2.117 -6.090 -9.443
454 1HB ALA 63 1HB ALA 63 0.715 -8.697 -10.022
455 2HB ALA 63 2HB ALA 63 2.449 -8.422 -10.167
456 3HB ALA 63 3HB ALA 63 1.329 -7.550 -11.215
457 H TYR 64 H TYR 64 0.732 -4.533 -10.033
458 HA TYR 64 HA TYR 64 -2.131 -4.985 -9.523
459 1HB TYR 64 2HB TYR 64 -2.408 -2.769 -8.628
460 2HB TYR 64 1HB TYR 64 -1.140 -3.582 -7.722
461 HD1 TYR 64 1HD TYR 64 1.194 -2.832 -7.911
462 HD2 TYR 64 2HD TYR 64 -1.926 -0.848 -10.013
463 HE1 TYR 64 1HE TYR 64 2.677 -0.906 -8.291
464 HE2 TYR 64 2HE TYR 64 -0.451 1.079 -10.394
465 HH TYR 64 HH TYR 64 2.890 0.974 -9.875
466 H LYS 65 H LYS 65 -3.484 -3.218 -10.578
467 HA LYS 65 HA LYS 65 -2.402 -2.568 -13.255
468 1HB LYS 65 2HB LYS 65 -5.244 -3.243 -12.474
469 2HB LYS 65 1HB LYS 65 -4.747 -2.686 -14.060
470 1HG LYS 65 2HG LYS 65 -3.471 -4.703 -14.406
471 2HG LYS 65 1HG LYS 65 -3.865 -5.247 -12.774
472 1HD LYS 65 2HD LYS 65 -6.272 -5.157 -13.374
473 2HD LYS 65 1HD LYS 65 -5.812 -4.736 -15.020
474 1HE LYS 65 2HE LYS 65 -4.662 -6.873 -15.251
475 2HE LYS 65 1HE LYS 65 -5.088 -7.289 -13.590
476 1HZ LYS 65 1HZ LYS 65 -7.458 -7.077 -14.255
477 2HZ LYS 65 2HZ LYS 65 -6.644 -8.327 -15.057
478 3HZ LYS 65 3HZ LYS 65 -6.955 -6.874 -15.863
479 H VAL 66 H VAL 66 -3.313 -0.736 -14.235
480 HA VAL 66 HA VAL 66 -4.113 1.348 -12.324
481 HB VAL 66 HB VAL 66 -2.924 1.573 -15.096
482 1HG1 VAL 66 1HG1 VAL 66 -2.841 3.989 -14.679
483 2HG1 VAL 66 2HG1 VAL 66 -3.700 3.756 -13.157
484 3HG1 VAL 66 3HG1 VAL 66 -4.500 3.395 -14.686
485 1HG2 VAL 66 1HG2 VAL 66 -1.306 0.895 -13.422
486 2HG2 VAL 66 2HG2 VAL 66 -1.795 2.229 -12.377
487 3HG2 VAL 66 3HG2 VAL 66 -1.006 2.560 -13.918
488 H ILE 67 H ILE 67 -6.180 1.907 -12.303
489 HA ILE 67 HA ILE 67 -7.946 1.054 -14.453
490 HB ILE 67 HB ILE 67 -8.718 2.628 -12.002
491 1HG1 ILE 67 2HG1 ILE 67 -8.591 -0.379 -12.319
492 2HG1 ILE 67 1HG1 ILE 67 -7.550 0.597 -11.286
493 1HG2 ILE 67 1HG2 ILE 67 -10.278 0.821 -13.837
494 2HG2 ILE 67 2HG2 ILE 67 -10.389 2.579 -13.754
495 3HG2 ILE 67 3HG2 ILE 67 -10.920 1.595 -12.388
496 1HD1 ILE 67 1HD1 ILE 67 -9.304 -0.505 -10.004
497 2HD1 ILE 67 2HD1 ILE 67 -10.530 0.288 -10.990
498 3HD1 ILE 67 3HD1 ILE 67 -9.480 1.247 -9.948
499 H SER 68 H SER 68 -7.097 4.029 -12.753
500 HA SER 68 HA SER 68 -7.839 5.584 -15.136
501 1HB SER 68 2HB SER 68 -8.569 6.599 -12.415
502 2HB SER 68 1HB SER 68 -9.270 7.005 -13.973
503 HG SER 68 HG SER 68 -10.064 5.133 -12.214
504 H GLN 69 H GLN 69 -6.826 7.654 -15.240
505 HA GLN 69 HA GLN 69 -4.791 8.264 -13.254
506 1HB GLN 69 2HB GLN 69 -3.606 6.785 -14.786
507 2HB GLN 69 1HB GLN 69 -4.086 7.784 -16.145
508 1HG GLN 69 2HG GLN 69 -2.798 9.655 -15.194
509 2HG GLN 69 1HG GLN 69 -2.281 8.598 -13.881
510 1HE2 GLN 69 1HE2 GLN 69 -0.788 6.975 -14.295
511 2HE2 GLN 69 2HE2 GLN 69 0.169 6.951 -15.733
512 H SER 70 H SER 70 -4.839 10.303 -12.864
513 HA SER 70 HA SER 70 -5.789 12.173 -14.922
514 1HB SER 70 2HB SER 70 -7.119 12.109 -12.844
515 2HB SER 70 1HB SER 70 -5.680 12.511 -11.915
516 HG SER 70 HG SER 70 -6.983 14.115 -13.870
517 H THR 71 H THR 71 -3.145 11.240 -12.966
518 HA THR 71 HA THR 71 -0.962 11.834 -12.959
519 HB THR 71 HB THR 71 -1.647 13.923 -15.004
520 HG1 THR 71 1HG THR 71 -1.123 12.350 -16.531
521 1HG2 THR 71 1HG2 THR 71 0.718 13.756 -15.623
522 2HG2 THR 71 2HG2 THR 71 0.976 12.595 -14.321
523 3HG2 THR 71 3HG2 THR 71 0.533 14.262 -13.943
524 H ASP 72 H ASP 72 -3.277 14.472 -12.874
525 HA ASP 72 HA ASP 72 -1.464 16.024 -11.177
526 1HB ASP 72 2HB ASP 72 -2.397 17.282 -12.996
527 2HB ASP 72 1HB ASP 72 -4.027 16.765 -12.580
528 H GLY 73 H GLY 73 -4.913 15.173 -11.209
529 1HA GLY 73 2HA GLY 73 -5.201 15.881 -8.443
530 2HA GLY 73 1HA GLY 73 -6.436 15.172 -9.474
531 H SER 74 H SER 74 -5.659 12.760 -10.138
532 HA SER 74 HA SER 74 -4.630 11.354 -7.831
533 1HB SER 74 2HB SER 74 -6.983 11.816 -7.216
534 2HB SER 74 1HB SER 74 -7.522 10.992 -8.674
535 HG SER 74 HG SER 74 -5.861 9.702 -6.790
536 H ILE 75 H ILE 75 -4.567 9.049 -8.136
537 HA ILE 75 HA ILE 75 -4.957 8.073 -10.882
538 HB ILE 75 HB ILE 75 -2.597 7.328 -9.134
539 1HG1 ILE 75 2HG1 ILE 75 -2.760 9.097 -11.580
540 2HG1 ILE 75 1HG1 ILE 75 -2.240 9.556 -9.967
541 1HG2 ILE 75 1HG2 ILE 75 -1.806 6.099 -11.100
542 2HG2 ILE 75 2HG2 ILE 75 -3.282 6.533 -11.960
543 3HG2 ILE 75 3HG2 ILE 75 -3.364 5.496 -10.537
544 1HD1 ILE 75 1HD1 ILE 75 -0.267 8.181 -10.174
545 2HD1 ILE 75 2HD1 ILE 75 -0.369 9.324 -11.514
546 3HD1 ILE 75 3HD1 ILE 75 -0.796 7.632 -11.765
547 H GLU 76 H GLU 76 -5.915 6.059 -10.955
548 HA GLU 76 HA GLU 76 -6.570 4.877 -8.333
549 1HB GLU 76 2HB GLU 76 -8.483 5.938 -9.568
550 2HB GLU 76 1HB GLU 76 -8.241 4.746 -10.837
551 1HG GLU 76 2HG GLU 76 -8.905 2.972 -9.467
552 2HG GLU 76 1HG GLU 76 -8.745 3.936 -7.998
553 H ILE 77 H ILE 77 -6.145 2.789 -8.013
554 HA ILE 77 HA ILE 77 -5.202 1.187 -10.290
555 HB ILE 77 HB ILE 77 -3.360 0.307 -8.900
556 1HG1 ILE 77 2HG1 ILE 77 -4.098 2.542 -6.993
557 2HG1 ILE 77 1HG1 ILE 77 -4.355 0.828 -6.687
558 1HG2 ILE 77 1HG2 ILE 77 -2.907 2.082 -10.494
559 2HG2 ILE 77 2HG2 ILE 77 -1.909 2.290 -9.055
560 3HG2 ILE 77 3HG2 ILE 77 -3.335 3.300 -9.292
561 1HD1 ILE 77 1HD1 ILE 77 -1.677 2.162 -7.070
562 2HD1 ILE 77 2HD1 ILE 77 -1.948 0.454 -6.720
563 3HD1 ILE 77 3HD1 ILE 77 -2.384 1.678 -5.529
564 H GLN 78 H GLN 78 -5.190 -1.119 -9.898
565 HA GLN 78 HA GLN 78 -6.859 -1.981 -7.636
566 1HB GLN 78 2HB GLN 78 -8.245 -1.873 -9.693
567 2HB GLN 78 1HB GLN 78 -7.127 -2.977 -10.482
568 1HG GLN 78 2HG GLN 78 -7.692 -4.734 -8.971
569 2HG GLN 78 1HG GLN 78 -8.672 -3.640 -7.994
570 1HE2 GLN 78 1HE2 GLN 78 -10.540 -4.812 -8.229
571 2HE2 GLN 78 2HE2 GLN 78 -11.411 -4.925 -9.720
572 H TYR 79 H TYR 79 -6.279 -3.968 -6.745
573 HA TYR 79 HA TYR 79 -3.579 -4.800 -7.420
574 1HB TYR 79 2HB TYR 79 -5.395 -5.697 -5.171
575 2HB TYR 79 1HB TYR 79 -3.696 -6.124 -5.351
576 HD1 TYR 79 2HD TYR 79 -2.119 -3.961 -5.676
577 HD2 TYR 79 1HD TYR 79 -5.876 -4.009 -3.688
578 HE1 TYR 79 2HE TYR 79 -1.470 -1.950 -4.417
579 HE2 TYR 79 1HE TYR 79 -5.242 -1.998 -2.424
580 HH TYR 79 HH TYR 79 -3.060 -0.892 -1.692
581 H LEU 80 H LEU 80 -3.270 -7.308 -7.005
582 HA LEU 80 HA LEU 80 -5.327 -8.801 -8.455
583 1HB LEU 80 2HB LEU 80 -2.381 -8.732 -9.093
584 2HB LEU 80 1HB LEU 80 -3.452 -10.001 -9.660
585 HG LEU 80 HG LEU 80 -3.819 -7.068 -10.291
586 1HD1 LEU 80 1HD1 LEU 80 -1.757 -7.959 -11.282
587 2HD1 LEU 80 2HD1 LEU 80 -2.978 -7.606 -12.505
588 3HD1 LEU 80 3HD1 LEU 80 -2.681 -9.273 -12.008
589 1HD2 LEU 80 1HD2 LEU 80 -5.112 -9.544 -11.430
590 2HD2 LEU 80 2HD2 LEU 80 -5.408 -7.884 -11.944
591 3HD2 LEU 80 3HD2 LEU 80 -5.874 -8.402 -10.325
592 H GLY 81 H GLY 81 -4.307 -11.281 -8.479
593 1HA GLY 81 2HA GLY 81 -3.754 -13.089 -7.124
594 2HA GLY 81 1HA GLY 81 -3.315 -11.962 -5.841
595 HA PRO 82 HA PRO 82 -7.382 -13.724 -4.500
596 1HB PRO 82 2HB PRO 82 -6.762 -13.510 -1.835
597 2HB PRO 82 1HB PRO 82 -6.453 -14.950 -2.809
598 1HG PRO 82 2HG PRO 82 -4.580 -12.773 -1.996
599 2HG PRO 82 1HG PRO 82 -4.292 -14.518 -2.106
600 1HD PRO 82 2HD PRO 82 -3.436 -12.780 -3.992
601 2HD PRO 82 1HD PRO 82 -3.930 -14.440 -4.378
602 H TYR 83 H TYR 83 -5.684 -10.841 -4.284
603 HA TYR 83 HA TYR 83 -7.919 -9.434 -2.970
604 1HB TYR 83 2HB TYR 83 -5.091 -8.403 -3.285
605 2HB TYR 83 1HB TYR 83 -6.360 -7.750 -2.258
606 HD1 TYR 83 2HD TYR 83 -6.957 -8.890 -0.154
607 HD2 TYR 83 1HD TYR 83 -3.748 -10.250 -2.592
608 HE1 TYR 83 2HE TYR 83 -6.106 -10.230 1.726
609 HE2 TYR 83 1HE TYR 83 -2.883 -11.588 -0.723
610 HH TYR 83 HH TYR 83 -3.028 -11.967 1.498
611 H TYR 84 H TYR 84 -8.053 -10.141 -5.723
612 HA TYR 84 HA TYR 84 -6.936 -7.972 -7.251
613 1HB TYR 84 2HB TYR 84 -7.422 -9.230 -9.206
614 2HB TYR 84 1HB TYR 84 -6.771 -10.349 -8.016
615 HD1 TYR 84 2HD TYR 84 -8.474 -11.776 -6.697
616 HD2 TYR 84 1HD TYR 84 -9.449 -9.662 -10.258
617 HE1 TYR 84 2HE TYR 84 -10.426 -13.230 -7.021
618 HE2 TYR 84 1HE TYR 84 -11.404 -11.116 -10.591
619 HH TYR 84 HH TYR 84 -12.063 -13.504 -9.873
620 HA PRO 85 HA PRO 85 -11.425 -7.133 -8.089
621 1HB PRO 85 2HB PRO 85 -13.359 -7.654 -6.325
622 2HB PRO 85 1HB PRO 85 -12.778 -8.878 -7.459
623 1HG PRO 85 2HG PRO 85 -12.139 -8.525 -4.563
624 2HG PRO 85 1HG PRO 85 -12.405 -10.021 -5.478
625 1HD PRO 85 2HD PRO 85 -9.918 -8.964 -4.831
626 2HD PRO 85 1HD PRO 85 -10.225 -10.129 -6.132
627 H LEU 86 H LEU 86 -9.720 -6.452 -5.327
628 HA LEU 86 HA LEU 86 -11.412 -4.176 -4.572
629 1HB LEU 86 2HB LEU 86 -10.665 -5.728 -2.790
630 2HB LEU 86 1HB LEU 86 -9.001 -5.329 -3.171
631 HG LEU 86 HG LEU 86 -9.420 -2.988 -2.509
632 1HD1 LEU 86 1HD1 LEU 86 -11.484 -2.403 -1.352
633 2HD1 LEU 86 2HD1 LEU 86 -12.134 -4.008 -1.682
634 3HD1 LEU 86 3HD1 LEU 86 -11.808 -2.896 -3.012
635 1HD2 LEU 86 1HD2 LEU 86 -9.588 -3.396 -0.103
636 2HD2 LEU 86 2HD2 LEU 86 -8.532 -4.575 -0.882
637 3HD2 LEU 86 3HD2 LEU 86 -10.172 -5.029 -0.418
638 H LYS 87 H LYS 87 -10.789 -2.112 -4.924
639 HA LYS 87 HA LYS 87 -8.186 -1.749 -6.234
640 1HB LYS 87 2HB LYS 87 -9.136 0.125 -7.446
641 2HB LYS 87 1HB LYS 87 -10.109 -1.314 -7.703
642 1HG LYS 87 2HG LYS 87 -11.754 -0.490 -6.092
643 2HG LYS 87 1HG LYS 87 -10.779 0.960 -5.839
644 1HD LYS 87 2HD LYS 87 -11.019 1.511 -8.226
645 2HD LYS 87 1HD LYS 87 -12.025 0.081 -8.444
646 1HE LYS 87 2HE LYS 87 -13.468 1.978 -8.241
647 2HE LYS 87 1HE LYS 87 -13.611 1.018 -6.769
648 1HZ LYS 87 1HZ LYS 87 -11.972 3.480 -7.079
649 2HZ LYS 87 2HZ LYS 87 -12.125 2.561 -5.662
650 3HZ LYS 87 3HZ LYS 87 -13.466 3.380 -6.280
651 H SER 88 H SER 88 -7.386 0.550 -6.073
652 HA SER 88 HA SER 88 -7.868 1.745 -3.448
653 1HB SER 88 2HB SER 88 -6.052 0.187 -3.045
654 2HB SER 88 1HB SER 88 -5.182 0.767 -4.456
655 HG SER 88 HG SER 88 -5.841 2.435 -2.264
656 H THR 89 H THR 89 -6.974 3.955 -3.315
657 HA THR 89 HA THR 89 -6.620 5.135 -5.994
658 HB THR 89 HB THR 89 -7.963 6.633 -3.780
659 HG1 THR 89 1HG THR 89 -9.020 4.566 -5.371
660 1HG2 THR 89 1HG2 THR 89 -7.262 7.858 -5.778
661 2HG2 THR 89 2HG2 THR 89 -9.020 7.808 -5.653
662 3HG2 THR 89 3HG2 THR 89 -8.188 6.748 -6.789
663 H LEU 90 H LEU 90 -5.152 6.750 -6.181
664 HA LEU 90 HA LEU 90 -3.603 7.456 -3.772
665 1HB LEU 90 2HB LEU 90 -2.602 7.101 -6.606
666 2HB LEU 90 1HB LEU 90 -1.633 7.687 -5.269
667 HG LEU 90 HG LEU 90 -2.856 4.933 -5.448
668 1HD1 LEU 90 1HD1 LEU 90 -1.069 5.247 -7.069
669 2HD1 LEU 90 2HD1 LEU 90 -0.548 4.178 -5.765
670 3HD1 LEU 90 3HD1 LEU 90 -0.008 5.857 -5.802
671 1HD2 LEU 90 1HD2 LEU 90 -1.477 4.447 -3.489
672 2HD2 LEU 90 2HD2 LEU 90 -2.641 5.727 -3.150
673 3HD2 LEU 90 3HD2 LEU 90 -0.949 6.131 -3.440
674 H LYS 91 H LYS 91 -3.653 9.548 -3.305
675 HA LYS 91 HA LYS 91 -4.137 11.465 -5.489
676 1HB LYS 91 2HB LYS 91 -5.356 11.364 -2.745
677 2HB LYS 91 1HB LYS 91 -5.200 12.894 -3.599
678 1HG LYS 91 2HG LYS 91 -6.497 11.975 -5.461
679 2HG LYS 91 1HG LYS 91 -6.687 10.467 -4.568
680 1HD LYS 91 2HD LYS 91 -7.569 13.129 -3.476
681 2HD LYS 91 1HD LYS 91 -8.622 12.107 -4.456
682 1HE LYS 91 2HE LYS 91 -7.281 11.217 -1.906
683 2HE LYS 91 1HE LYS 91 -8.927 11.843 -1.996
684 1HZ LYS 91 1HZ LYS 91 -8.989 9.460 -2.020
685 2HZ LYS 91 2HZ LYS 91 -7.892 9.391 -3.310
686 3HZ LYS 91 3HZ LYS 91 -9.444 10.021 -3.560
687 H ARG 92 H ARG 92 -3.307 13.643 -5.051
688 HA ARG 92 HA ARG 92 -0.695 13.512 -3.884
689 1HB ARG 92 2HB ARG 92 -0.450 15.801 -4.674
690 2HB ARG 92 1HB ARG 92 -1.065 14.758 -5.945
691 1HG ARG 92 2HG ARG 92 -3.319 15.586 -5.513
692 2HG ARG 92 1HG ARG 92 -2.676 16.660 -4.273
693 1HD ARG 92 2HD ARG 92 -1.261 17.740 -5.967
694 2HD ARG 92 1HD ARG 92 -1.961 16.696 -7.202
695 HE ARG 92 HE ARG 92 -4.111 17.930 -6.070
696 1HH1 ARG 92 1HH1 ARG 92 -1.141 19.020 -7.543
697 2HH1 ARG 92 2HH1 ARG 92 -1.824 20.494 -8.156
698 1HH2 ARG 92 1HH2 ARG 92 -5.037 19.857 -6.878
699 2HH2 ARG 92 2HH2 ARG 92 -4.050 20.959 -7.795
700 H GLY 93 H GLY 93 0.057 14.645 -2.114
701 1HA GLY 93 2HA GLY 93 -2.028 15.253 -0.161
702 2HA GLY 93 1HA GLY 93 -0.360 14.839 0.202
703 H GLU 94 H GLU 94 -1.286 16.859 1.518
704 HA GLU 94 HA GLU 94 -1.284 19.375 0.196
705 1HB GLU 94 2HB GLU 94 -1.084 18.825 3.151
706 2HB GLU 94 1HB GLU 94 -1.687 20.277 2.375
707 1HG GLU 94 2HG GLU 94 -3.631 19.156 1.596
708 2HG GLU 94 1HG GLU 94 -2.986 17.587 2.080
709 H ASN 95 H ASN 95 1.170 17.415 1.516
710 HA ASN 95 HA ASN 95 3.000 19.724 1.700
711 1HB ASN 95 2HB ASN 95 3.163 17.173 3.323
712 2HB ASN 95 1HB ASN 95 4.167 18.607 3.504
713 1HD2 ASN 95 1HD2 ASN 95 3.255 20.490 4.412
714 2HD2 ASN 95 2HD2 ASN 95 1.812 20.404 5.374
715 H GLY 96 H GLY 96 2.459 18.038 -0.623
716 1HA GLY 96 2HA GLY 96 3.677 17.012 -2.296
717 2HA GLY 96 1HA GLY 96 5.129 17.331 -1.351
718 H THR 97 H THR 97 2.271 15.538 -0.411
719 HA THR 97 HA THR 97 3.934 13.152 -0.025
720 HB THR 97 HB THR 97 2.257 12.575 1.786
721 HG1 THR 97 1HG THR 97 0.806 14.062 2.406
722 1HG2 THR 97 1HG2 THR 97 3.273 14.054 3.455
723 2HG2 THR 97 2HG2 THR 97 3.873 15.099 2.166
724 3HG2 THR 97 3HG2 THR 97 4.480 13.449 2.320
725 H LEU 98 H LEU 98 2.402 11.120 0.151
726 HA LEU 98 HA LEU 98 0.487 11.301 -2.072
727 1HB LEU 98 2HB LEU 98 2.484 9.875 -2.503
728 2HB LEU 98 1HB LEU 98 2.012 8.860 -1.153
729 HG LEU 98 HG LEU 98 -0.093 8.308 -2.346
730 1HD1 LEU 98 1HD1 LEU 98 -0.297 8.855 -4.720
731 2HD1 LEU 98 2HD1 LEU 98 1.169 9.831 -4.623
732 3HD1 LEU 98 3HD1 LEU 98 -0.271 10.311 -3.726
733 1HD2 LEU 98 1HD2 LEU 98 0.962 6.873 -4.054
734 2HD2 LEU 98 2HD2 LEU 98 1.789 6.806 -2.498
735 3HD2 LEU 98 3HD2 LEU 98 2.474 7.749 -3.822
736 H ILE 99 H ILE 99 -1.558 10.788 -1.700
737 HA ILE 99 HA ILE 99 -2.305 9.840 0.966
738 HB ILE 99 HB ILE 99 -4.082 10.901 -1.237
739 1HG1 ILE 99 2HG1 ILE 99 -2.416 12.565 -0.464
740 2HG1 ILE 99 1HG1 ILE 99 -4.063 13.022 -0.066
741 1HG2 ILE 99 1HG2 ILE 99 -5.718 11.210 0.572
742 2HG2 ILE 99 2HG2 ILE 99 -4.594 10.453 1.701
743 3HG2 ILE 99 3HG2 ILE 99 -5.267 9.518 0.366
744 1HD1 ILE 99 1HD1 ILE 99 -3.713 12.284 2.236
745 2HD1 ILE 99 2HD1 ILE 99 -2.544 13.515 1.762
746 3HD1 ILE 99 3HD1 ILE 99 -2.059 11.821 1.830
747 H TRP 100 H TRP 100 -2.513 7.730 1.167
748 HA TRP 100 HA TRP 100 -3.191 6.097 -1.169
749 1HB TRP 100 2HB TRP 100 -1.157 5.577 0.211
750 2HB TRP 100 1HB TRP 100 -2.224 5.214 1.559
751 HD1 TRP 100 HD TRP 100 -3.432 4.011 -1.810
752 HE1 TRP 100 1HE TRP 100 -3.171 1.460 -1.955
753 HE3 TRP 100 3HE TRP 100 -0.655 3.246 2.418
754 HZ2 TRP 100 2HZ TRP 100 -1.941 -0.609 -0.472
755 HZ3 TRP 100 3HZ TRP 100 0.025 0.947 2.983
756 HH2 TRP 100 HH TRP 100 -0.608 -0.940 1.565
757 H GLU 101 H GLU 101 -5.283 5.659 -1.423
758 HA GLU 101 HA GLU 101 -6.979 5.472 0.969
759 1HB GLU 101 2HB GLU 101 -7.404 7.259 -0.775
760 2HB GLU 101 1HB GLU 101 -7.861 5.972 -1.866
761 1HG GLU 101 2HG GLU 101 -9.694 5.362 -0.496
762 2HG GLU 101 1HG GLU 101 -9.161 6.443 0.792
763 H GLN 102 H GLN 102 -8.031 3.652 1.358
764 HA GLN 102 HA GLN 102 -8.409 1.661 -0.725
765 1HB GLN 102 2HB GLN 102 -6.088 1.336 0.279
766 2HB GLN 102 1HB GLN 102 -6.902 0.894 1.773
767 1HG GLN 102 2HG GLN 102 -7.902 -0.572 -0.531
768 2HG GLN 102 1HG GLN 102 -6.180 -0.801 -0.262
769 1HE2 GLN 102 1HE2 GLN 102 -6.448 -2.939 0.320
770 2HE2 GLN 102 2HE2 GLN 102 -7.109 -3.406 1.849
771 H ASN 103 H ASN 103 -10.318 0.711 -0.462
772 HA ASN 103 HA ASN 103 -12.279 -0.010 0.432
773 1HB ASN 103 2HB ASN 103 -10.318 -0.435 2.594
774 2HB ASN 103 1HB ASN 103 -11.999 -0.399 3.107
775 1HD2 ASN 103 1HD2 ASN 103 -9.953 -2.566 2.892
776 2HD2 ASN 103 2HD2 ASN 103 -10.739 -3.814 1.988
777 H GLY 104 H GLY 104 -11.336 2.909 0.616
778 1HA GLY 104 2HA GLY 104 -12.836 4.721 0.935
779 2HA GLY 104 1HA GLY 104 -13.667 3.774 2.159
780 H GLN 105 H GLN 105 -10.653 3.198 3.006
781 HA GLN 105 HA GLN 105 -10.620 5.380 4.936
782 1HB GLN 105 2HB GLN 105 -8.857 2.931 4.769
783 2HB GLN 105 1HB GLN 105 -9.008 4.022 6.140
784 1HG GLN 105 2HG GLN 105 -11.343 3.353 6.412
785 2HG GLN 105 1HG GLN 105 -11.185 2.261 5.042
786 1HE2 GLN 105 1HE2 GLN 105 -10.271 2.843 8.360
787 2HE2 GLN 105 2HE2 GLN 105 -9.755 1.223 8.695
788 H ARG 106 H ARG 106 -9.139 6.965 4.941
789 HA ARG 106 HA ARG 106 -7.224 7.005 2.739
790 1HB ARG 106 2HB ARG 106 -8.520 9.147 4.391
791 2HB ARG 106 1HB ARG 106 -7.089 9.479 3.432
792 1HG ARG 106 2HG ARG 106 -8.298 8.710 1.423
793 2HG ARG 106 1HG ARG 106 -9.742 8.491 2.416
794 1HD ARG 106 2HD ARG 106 -9.814 10.834 2.924
795 2HD ARG 106 1HD ARG 106 -8.265 11.101 2.125
796 HE ARG 106 HE ARG 106 -10.094 9.974 0.296
797 1HH1 ARG 106 1HH1 ARG 106 -9.447 12.971 2.011
798 2HH1 ARG 106 2HH1 ARG 106 -10.166 13.967 0.778
799 1HH2 ARG 106 1HH2 ARG 106 -11.063 11.305 -1.309
800 2HH2 ARG 106 2HH2 ARG 106 -11.084 13.038 -1.082
801 H LYS 107 H LYS 107 -5.163 6.585 3.146
802 HA LYS 107 HA LYS 107 -4.082 7.322 5.780
803 1HB LYS 107 2HB LYS 107 -3.243 5.322 3.720
804 2HB LYS 107 1HB LYS 107 -2.024 6.018 4.778
805 1HG LYS 107 2HG LYS 107 -4.432 4.400 5.564
806 2HG LYS 107 1HG LYS 107 -2.731 3.971 5.720
807 1HD LYS 107 2HD LYS 107 -2.466 5.908 7.273
808 2HD LYS 107 1HD LYS 107 -4.222 6.092 7.232
809 1HE LYS 107 2HE LYS 107 -3.852 4.805 9.130
810 2HE LYS 107 1HE LYS 107 -4.298 3.621 7.908
811 1HZ LYS 107 1HZ LYS 107 -1.537 4.260 8.805
812 2HZ LYS 107 2HZ LYS 107 -1.923 3.143 7.593
813 3HZ LYS 107 3HZ LYS 107 -2.409 2.861 9.191
814 H THR 108 H THR 108 -2.887 9.085 5.908
815 HA THR 108 HA THR 108 -1.842 10.257 3.434
816 HB THR 108 HB THR 108 -3.099 11.849 4.739
817 HG1 THR 108 1HG THR 108 -0.658 12.856 5.484
818 1HG2 THR 108 1HG2 THR 108 -1.247 11.220 7.038
819 2HG2 THR 108 2HG2 THR 108 -2.954 10.787 6.931
820 3HG2 THR 108 3HG2 THR 108 -2.478 12.483 7.021
821 H MET 109 H MET 109 0.176 9.805 2.919
822 HA MET 109 HA MET 109 1.801 8.514 4.985
823 1HB MET 109 2HB MET 109 1.938 8.349 1.970
824 2HB MET 109 1HB MET 109 3.043 7.525 3.063
825 1HG MET 109 2HG MET 109 1.155 6.302 4.028
826 2HG MET 109 1HG MET 109 0.069 7.099 2.892
827 1HE MET 109 1HE MET 109 0.248 6.778 0.228
828 2HE MET 109 2HE MET 109 1.435 5.725 -0.544
829 3HE MET 109 3HE MET 109 1.961 7.186 0.292
830 H THR 110 H THR 110 4.041 8.848 5.096
831 HA THR 110 HA THR 110 4.877 11.559 4.368
832 HB THR 110 HB THR 110 6.630 9.694 5.900
833 HG1 THR 110 1HG THR 110 5.170 9.439 7.406
834 1HG2 THR 110 1HG2 THR 110 5.997 12.633 6.165
835 2HG2 THR 110 2HG2 THR 110 7.409 11.944 5.366
836 3HG2 THR 110 3HG2 THR 110 7.200 11.753 7.108
837 H ARG 111 H ARG 111 6.850 11.875 3.216
838 HA ARG 111 HA ARG 111 7.473 9.639 1.445
839 1HB ARG 111 2HB ARG 111 8.236 11.184 -0.123
840 2HB ARG 111 1HB ARG 111 6.906 12.048 0.635
841 1HG ARG 111 2HG ARG 111 8.990 12.747 2.213
842 2HG ARG 111 1HG ARG 111 9.766 12.599 0.640
843 1HD ARG 111 2HD ARG 111 8.449 14.253 -0.322
844 2HD ARG 111 1HD ARG 111 7.208 14.124 0.924
845 HE ARG 111 HE ARG 111 9.514 14.964 2.202
846 1HH1 ARG 111 1HH1 ARG 111 7.446 16.166 -0.360
847 2HH1 ARG 111 2HH1 ARG 111 7.669 17.830 0.072
848 1HH2 ARG 111 1HH2 ARG 111 9.815 17.133 2.775
849 2HH2 ARG 111 2HH2 ARG 111 9.019 18.388 1.868
850 H ILE 112 H ILE 112 9.422 8.739 1.369
851 HA ILE 112 HA ILE 112 11.374 9.440 3.420
852 HB ILE 112 HB ILE 112 11.357 7.082 1.526
853 1HG1 ILE 112 2HG1 ILE 112 9.325 7.175 2.944
854 2HG1 ILE 112 1HG1 ILE 112 10.353 5.802 3.309
855 1HG2 ILE 112 1HG2 ILE 112 13.537 7.569 2.508
856 2HG2 ILE 112 2HG2 ILE 112 12.878 6.059 3.138
857 3HG2 ILE 112 3HG2 ILE 112 12.824 7.523 4.120
858 1HD1 ILE 112 1HD1 ILE 112 9.500 6.768 5.349
859 2HD1 ILE 112 2HD1 ILE 112 10.143 8.348 4.901
860 3HD1 ILE 112 3HD1 ILE 112 11.244 7.016 5.257
861 H GLU 113 H GLU 113 13.630 9.694 2.797
862 HA GLU 113 HA GLU 113 13.965 11.224 0.409
863 1HB GLU 113 2HB GLU 113 15.925 10.191 2.431
864 2HB GLU 113 1HB GLU 113 16.439 11.073 1.007
865 1HG GLU 113 2HG GLU 113 16.361 12.641 2.755
866 2HG GLU 113 1HG GLU 113 14.947 12.948 1.755
867 H SER 114 H SER 114 13.346 9.892 -1.192
868 HA SER 114 HA SER 114 14.862 7.443 -1.690
869 1HB SER 114 2HB SER 114 12.961 7.316 -3.553
870 2HB SER 114 1HB SER 114 12.647 6.843 -1.883
871 HG SER 114 HG SER 114 11.798 8.935 -1.522
872 H LYS 115 H LYS 115 16.508 9.315 -2.098
873 HA LYS 115 HA LYS 115 16.393 10.536 -4.692
874 1HB LYS 115 2HB LYS 115 17.466 11.647 -2.784
875 2HB LYS 115 1HB LYS 115 18.624 10.334 -2.660
876 1HG LYS 115 2HG LYS 115 19.523 10.931 -4.858
877 2HG LYS 115 1HG LYS 115 18.367 12.264 -4.955
878 1HD LYS 115 2HD LYS 115 19.354 13.329 -3.039
879 2HD LYS 115 1HD LYS 115 20.401 11.941 -2.747
880 1HE LYS 115 2HE LYS 115 21.509 12.360 -4.909
881 2HE LYS 115 1HE LYS 115 20.492 13.783 -5.132
882 1HZ LYS 115 1HZ LYS 115 22.302 13.422 -2.809
883 2HZ LYS 115 2HZ LYS 115 21.485 14.836 -3.270
884 3HZ LYS 115 3HZ LYS 115 22.753 14.238 -4.226
885 H THR 116 H THR 116 16.202 8.758 -6.094
886 HA THR 116 HA THR 116 18.712 7.500 -6.775
887 HB THR 116 HB THR 116 17.748 5.982 -5.042
888 HG1 THR 116 1HG THR 116 17.567 4.152 -6.864
889 1HG2 THR 116 1HG2 THR 116 15.542 5.590 -7.064
890 2HG2 THR 116 2HG2 THR 116 15.376 6.345 -5.480
891 3HG2 THR 116 3HG2 THR 116 15.776 4.631 -5.603
892 H GLY 117 H GLY 117 18.141 5.834 -8.689
893 1HA GLY 117 2HA GLY 117 16.421 7.358 -10.536
894 2HA GLY 117 1HA GLY 117 17.788 6.364 -11.022
895 H ARG 118 H ARG 118 15.273 6.093 -12.194
896 HA ARG 118 HA ARG 118 13.964 3.840 -10.903
897 1HB ARG 118 2HB ARG 118 12.698 5.746 -12.032
898 2HB ARG 118 1HB ARG 118 13.236 5.069 -13.563
899 1HG ARG 118 2HG ARG 118 12.133 2.927 -12.929
900 2HG ARG 118 1HG ARG 118 11.487 3.741 -11.506
901 1HD ARG 118 2HD ARG 118 9.729 4.039 -12.918
902 2HD ARG 118 1HD ARG 118 10.661 5.480 -13.326
903 HE ARG 118 HE ARG 118 11.075 3.053 -14.913
904 1HH1 ARG 118 1HH1 ARG 118 9.802 6.313 -14.703
905 2HH1 ARG 118 2HH1 ARG 118 9.503 6.441 -16.409
906 1HH2 ARG 118 1HH2 ARG 118 10.672 3.212 -17.146
907 2HH2 ARG 118 2HH2 ARG 118 9.997 4.684 -17.792
908 H GLU 119 H GLU 119 15.331 2.118 -11.112
909 HA GLU 119 HA GLU 119 16.418 1.381 -13.668
910 1HB GLU 119 2HB GLU 119 16.268 -0.194 -11.091
911 2HB GLU 119 1HB GLU 119 17.162 -0.682 -12.524
912 1HG GLU 119 2HG GLU 119 18.348 1.611 -12.245
913 2HG GLU 119 1HG GLU 119 17.737 1.519 -10.594
914 H GLU 120 H GLU 120 15.884 -0.616 -14.786
915 HA GLU 120 HA GLU 120 12.979 -1.078 -14.651
916 1HB GLU 120 2HB GLU 120 13.698 0.203 -16.612
917 2HB GLU 120 1HB GLU 120 14.821 -1.077 -17.046
918 1HG GLU 120 2HG GLU 120 12.925 -2.603 -17.367
919 2HG GLU 120 1HG GLU 120 11.821 -1.277 -16.990
920 H LYS 121 H LYS 121 12.446 -3.048 -14.038
921 HA LYS 121 HA LYS 121 14.330 -5.247 -14.250
922 1HB LYS 121 2HB LYS 121 13.143 -4.984 -12.149
923 2HB LYS 121 1HB LYS 121 11.598 -5.044 -12.980
924 1HG LYS 121 2HG LYS 121 12.257 -7.394 -13.708
925 2HG LYS 121 1HG LYS 121 13.550 -7.276 -12.511
926 1HD LYS 121 2HD LYS 121 11.919 -6.872 -10.754
927 2HD LYS 121 1HD LYS 121 10.612 -6.898 -11.936
928 1HE LYS 121 2HE LYS 121 10.604 -9.014 -10.873
929 2HE LYS 121 1HE LYS 121 11.294 -9.261 -12.475
930 1HZ LYS 121 1HZ LYS 121 12.483 -10.412 -10.651
931 2HZ LYS 121 2HZ LYS 121 12.916 -8.904 -10.015
932 3HZ LYS 121 3HZ LYS 121 13.472 -9.367 -11.552
933 H ASP 122 H ASP 122 14.390 -6.150 -16.230
934 HA ASP 122 HA ASP 122 11.819 -6.899 -17.446
935 1HB ASP 122 2HB ASP 122 13.190 -5.736 -19.010
936 2HB ASP 122 1HB ASP 122 14.560 -6.774 -18.648
937 H GLU 123 H GLU 123 11.251 -8.618 -16.544
938 HA GLU 123 HA GLU 123 12.661 -11.088 -16.898
939 1HB GLU 123 2HB GLU 123 12.227 -9.932 -14.145
940 2HB GLU 123 1HB GLU 123 12.427 -11.649 -14.420
941 1HG GLU 123 2HG GLU 123 14.645 -11.185 -15.414
942 2HG GLU 123 1HG GLU 123 14.432 -9.487 -14.989
943 H LYS 124 H LYS 124 11.311 -12.889 -16.614
944 HA LYS 124 HA LYS 124 8.646 -12.375 -15.515
945 1HB LYS 124 2HB LYS 124 8.507 -12.489 -18.012
946 2HB LYS 124 1HB LYS 124 9.136 -14.130 -17.933
947 1HG LYS 124 2HG LYS 124 7.202 -14.904 -16.792
948 2HG LYS 124 1HG LYS 124 6.622 -13.258 -16.532
949 1HD LYS 124 2HD LYS 124 6.949 -14.559 -19.237
950 2HD LYS 124 1HD LYS 124 5.426 -14.460 -18.352
951 1HE LYS 124 2HE LYS 124 7.085 -12.139 -19.337
952 2HE LYS 124 1HE LYS 124 5.564 -12.702 -20.026
953 1HZ LYS 124 1HZ LYS 124 5.955 -11.524 -17.325
954 2HZ LYS 124 2HZ LYS 124 4.488 -12.157 -17.888
955 3HZ LYS 124 3HZ LYS 124 5.169 -10.796 -18.638
956 H SER 125 H SER 125 9.652 -13.156 -13.628
957 HA SER 125 HA SER 125 10.747 -15.820 -13.595
958 1HB SER 125 2HB SER 125 10.729 -15.084 -11.006
959 2HB SER 125 1HB SER 125 11.977 -14.571 -12.144
960 HG SER 125 HG SER 125 11.046 -12.818 -10.933
961 H LYS 126 H LYS 126 9.460 -17.510 -13.523
962 HA LYS 126 HA LYS 126 6.958 -17.321 -11.984
963 1HB LYS 126 2HB LYS 126 6.182 -19.222 -13.459
964 2HB LYS 126 1HB LYS 126 6.410 -17.678 -14.269
965 1HG LYS 126 2HG LYS 126 8.621 -18.465 -15.053
966 2HG LYS 126 1HG LYS 126 8.286 -20.036 -14.325
967 1HD LYS 126 2HD LYS 126 6.325 -20.281 -15.767
968 2HD LYS 126 1HD LYS 126 6.666 -18.708 -16.493
969 1HE LYS 126 2HE LYS 126 8.850 -19.564 -17.255
970 2HE LYS 126 1HE LYS 126 8.440 -21.145 -16.588
971 1HZ LYS 126 1HZ LYS 126 6.508 -21.189 -18.079
972 2HZ LYS 126 2HZ LYS 126 7.972 -21.123 -18.923
973 3HZ LYS 126 3HZ LYS 126 7.020 -19.728 -18.775
974 H SER 127 H SER 127 7.392 -18.130 -10.023
975 HA SER 127 HA SER 127 9.037 -20.515 -9.775
976 1HB SER 127 2HB SER 127 7.722 -18.837 -7.626
977 2HB SER 127 1HB SER 127 8.915 -20.110 -7.368
978 HG SER 127 HG SER 127 9.764 -18.251 -9.170
979 H LEU 128 H LEU 128 7.614 -21.952 -10.828
980 HA LEU 128 HA LEU 128 4.955 -22.365 -9.800
981 1HB LEU 128 2HB LEU 128 6.552 -23.947 -11.816
982 2HB LEU 128 1HB LEU 128 4.854 -24.193 -11.452
983 HG LEU 128 HG LEU 128 6.036 -21.684 -12.652
984 1HD1 LEU 128 1HD1 LEU 128 4.405 -23.892 -13.901
985 2HD1 LEU 128 2HD1 LEU 128 6.113 -23.561 -14.197
986 3HD1 LEU 128 3HD1 LEU 128 4.887 -22.394 -14.694
987 1HD2 LEU 128 1HD2 LEU 128 3.725 -21.002 -12.990
988 2HD2 LEU 128 2HD2 LEU 128 4.046 -21.263 -11.275
989 3HD2 LEU 128 3HD2 LEU 128 3.157 -22.473 -12.200
990 H GLU 129 H GLU 129 5.140 -23.029 -7.697
991 HA GLU 129 HA GLU 129 6.679 -25.455 -7.174
992 1HB GLU 129 2HB GLU 129 5.702 -23.225 -5.492
993 2HB GLU 129 1HB GLU 129 5.723 -24.817 -4.744
994 1HG GLU 129 2HG GLU 129 8.093 -23.569 -6.108
995 2HG GLU 129 1HG GLU 129 7.777 -23.473 -4.375
996 H HIS 130 H HIS 130 5.748 -27.297 -7.306
997 HA HIS 130 HA HIS 130 2.913 -27.561 -6.586
998 1HB HIS 130 2HB HIS 130 2.717 -29.297 -8.398
999 2HB HIS 130 1HB HIS 130 2.945 -27.657 -8.984
1000 HD1 HIS 130 1HD HIS 130 4.304 -31.036 -9.242
1001 HD2 HIS 130 2HD HIS 130 5.659 -27.159 -9.923
1002 HE1 HIS 130 1HE HIS 130 6.363 -31.271 -10.678
1003 HE2 HIS 130 2HE HIS 130 7.235 -28.920 -10.964
1004 H HIS 131 H HIS 131 5.354 -27.985 -5.075
1005 HA HIS 131 HA HIS 131 5.422 -30.876 -4.692
1006 1HB HIS 131 2HB HIS 131 6.937 -28.605 -3.395
1007 2HB HIS 131 1HB HIS 131 7.084 -30.278 -2.875
1008 HD1 HIS 131 1HD HIS 131 8.564 -27.868 -5.112
1009 HD2 HIS 131 2HD HIS 131 8.030 -31.997 -5.103
1010 HE1 HIS 131 1HE HIS 131 10.229 -28.778 -6.762
1011 HE2 HIS 131 2HE HIS 131 9.769 -31.253 -6.869
1012 H HIS 132 H HIS 132 4.723 -31.876 -2.743
1013 HA HIS 132 HA HIS 132 2.520 -30.444 -1.525
1014 1HB HIS 132 2HB HIS 132 2.308 -32.838 -2.187
1015 2HB HIS 132 1HB HIS 132 3.482 -33.249 -0.939
1016 HD1 HIS 132 1HD HIS 132 2.473 -33.925 1.212
1017 HD2 HIS 132 2HD HIS 132 -0.027 -31.399 -0.953
1018 HE1 HIS 132 1HE HIS 132 0.370 -33.711 2.581
1019 HE2 HIS 132 2HE HIS 132 -1.158 -32.234 1.218
1020 H HIS 133 H HIS 133 2.827 -29.157 0.125
1021 HA HIS 133 HA HIS 133 5.167 -29.189 1.731
1022 1HB HIS 133 2HB HIS 133 3.904 -27.128 1.324
1023 2HB HIS 133 1HB HIS 133 2.521 -27.792 2.188
1024 HD1 HIS 133 1HD HIS 133 2.343 -26.973 4.511
1025 HD2 HIS 133 2HD HIS 133 6.289 -27.041 3.191
1026 HE1 HIS 133 1HE HIS 133 3.716 -26.081 6.421
1027 HE2 HIS 133 2HE HIS 133 6.064 -25.924 5.512
1028 H HIS 134 H HIS 134 5.634 -30.623 3.236
1029 HA HIS 134 HA HIS 134 3.532 -31.425 5.120
1030 1HB HIS 134 2HB HIS 134 3.725 -33.293 3.578
1031 2HB HIS 134 1HB HIS 134 5.476 -33.299 3.743
1032 HD1 HIS 134 1HD HIS 134 2.348 -34.456 5.387
1033 HD2 HIS 134 2HD HIS 134 6.441 -34.445 6.152
1034 HE1 HIS 134 1HE HIS 134 2.688 -36.046 7.303
1035 HE2 HIS 134 2HE HIS 134 5.187 -36.156 7.637
1036 H HIS 135 H HIS 135 4.164 -30.816 7.076
1037 HA HIS 135 HA HIS 135 7.014 -31.065 7.756
1038 1HB HIS 135 2HB HIS 135 6.368 -28.672 7.457
1039 2HB HIS 135 1HB HIS 135 5.171 -28.869 8.735
1040 HD1 HIS 135 1HD HIS 135 5.968 -28.260 11.013
1041 HD2 HIS 135 2HD HIS 135 9.111 -29.288 8.480
1042 HE1 HIS 135 1HE HIS 135 8.066 -27.885 12.342
1043 HE2 HIS 135 2HE HIS 135 9.955 -28.585 10.828
Start of MODEL 9
1 1H MET 1 1HT MET 1 9.163 -2.674 -15.979
2 2H MET 1 2HT MET 1 9.596 -2.882 -17.606
3 3H MET 1 3HT MET 1 9.810 -1.379 -16.848
4 HA MET 1 HA MET 1 11.454 -2.261 -15.388
5 1HB MET 1 2HB MET 1 10.574 -4.543 -15.212
6 2HB MET 1 1HB MET 1 11.011 -4.854 -16.886
7 1HG MET 1 2HG MET 1 13.380 -4.470 -16.287
8 2HG MET 1 1HG MET 1 12.889 -4.308 -14.602
9 1HE MET 1 1HE MET 1 14.685 -7.802 -14.695
10 2HE MET 1 2HE MET 1 14.659 -6.194 -13.972
11 3HE MET 1 3HE MET 1 15.108 -6.390 -15.666
12 H ILE 2 H ILE 2 12.537 -0.667 -16.494
13 HA ILE 2 HA ILE 2 14.396 -1.756 -18.482
14 HB ILE 2 HB ILE 2 14.418 0.570 -19.572
15 1HG1 ILE 2 2HG1 ILE 2 11.652 0.665 -18.350
16 2HG1 ILE 2 1HG1 ILE 2 13.003 1.683 -17.872
17 1HG2 ILE 2 1HG2 ILE 2 13.640 -1.433 -20.705
18 2HG2 ILE 2 2HG2 ILE 2 12.650 -0.041 -21.142
19 3HG2 ILE 2 3HG2 ILE 2 12.038 -1.229 -19.992
20 1HD1 ILE 2 1HD1 ILE 2 11.466 2.874 -19.326
21 2HD1 ILE 2 2HD1 ILE 2 11.703 1.659 -20.582
22 3HD1 ILE 2 3HD1 ILE 2 13.046 2.690 -20.087
23 H MET 3 H MET 3 15.977 -1.929 -16.955
24 HA MET 3 HA MET 3 16.467 0.019 -14.955
25 1HB MET 3 2HB MET 3 17.170 -2.507 -15.119
26 2HB MET 3 1HB MET 3 18.604 -1.858 -15.898
27 1HG MET 3 2HG MET 3 17.630 -1.048 -13.170
28 2HG MET 3 1HG MET 3 18.869 -2.260 -13.474
29 1HE MET 3 1HE MET 3 20.610 1.015 -11.973
30 2HE MET 3 2HE MET 3 20.208 -0.668 -11.632
31 3HE MET 3 3HE MET 3 18.934 0.552 -11.689
32 H VAL 4 H VAL 4 17.359 1.949 -15.170
33 HA VAL 4 HA VAL 4 19.250 2.390 -17.384
34 HB VAL 4 HB VAL 4 18.339 4.655 -17.692
35 1HG1 VAL 4 1HG1 VAL 4 17.535 2.882 -19.136
36 2HG1 VAL 4 2HG1 VAL 4 16.240 4.030 -18.796
37 3HG1 VAL 4 3HG1 VAL 4 16.279 2.474 -17.967
38 1HG2 VAL 4 1HG2 VAL 4 16.195 3.786 -15.758
39 2HG2 VAL 4 2HG2 VAL 4 16.183 5.270 -16.708
40 3HG2 VAL 4 3HG2 VAL 4 17.417 5.027 -15.472
41 H SER 5 H SER 5 20.855 3.930 -17.048
42 HA SER 5 HA SER 5 20.986 5.324 -14.499
43 1HB SER 5 2HB SER 5 23.389 4.609 -14.199
44 2HB SER 5 1HB SER 5 22.210 3.328 -13.933
45 HG SER 5 HG SER 5 22.645 2.628 -16.099
46 H GLY 6 H GLY 6 22.464 7.178 -14.609
47 1HA GLY 6 2HA GLY 6 23.625 7.762 -17.185
48 2HA GLY 6 1HA GLY 6 22.149 8.653 -16.865
49 H CYS 7 H CYS 7 23.281 10.579 -16.985
50 HA CYS 7 HA CYS 7 24.890 11.196 -14.605
51 1HB CYS 7 2HB CYS 7 26.322 10.844 -16.633
52 2HB CYS 7 1HB CYS 7 25.480 12.178 -17.407
53 HG CYS 7 HG CYS 7 28.208 12.416 -15.880
54 H GLN 8 H GLN 8 22.072 11.725 -15.999
55 HA GLN 8 HA GLN 8 22.053 14.642 -15.737
56 1HB GLN 8 2HB GLN 8 20.925 13.165 -17.646
57 2HB GLN 8 1HB GLN 8 19.613 13.090 -16.478
58 1HG GLN 8 2HG GLN 8 19.228 14.881 -18.034
59 2HG GLN 8 1HG GLN 8 19.540 15.541 -16.427
60 1HE2 GLN 8 1HE2 GLN 8 21.430 16.702 -16.062
61 2HE2 GLN 8 2HE2 GLN 8 22.438 17.262 -17.353
62 H GLN 9 H GLN 9 19.560 15.196 -14.847
63 HA GLN 9 HA GLN 9 19.507 13.926 -12.193
64 1HB GLN 9 2HB GLN 9 20.437 16.185 -12.059
65 2HB GLN 9 1HB GLN 9 19.024 16.831 -12.880
66 1HG GLN 9 2HG GLN 9 17.640 15.982 -10.979
67 2HG GLN 9 1HG GLN 9 19.143 15.594 -10.144
68 1HE2 GLN 9 1HE2 GLN 9 18.700 17.020 -8.485
69 2HE2 GLN 9 2HE2 GLN 9 18.790 18.737 -8.681
70 H GLN 10 H GLN 10 17.724 12.756 -12.021
71 HA GLN 10 HA GLN 10 15.254 13.443 -13.323
72 1HB GLN 10 2HB GLN 10 15.940 11.098 -12.764
73 2HB GLN 10 1HB GLN 10 15.740 11.488 -11.063
74 1HG GLN 10 2HG GLN 10 13.836 10.255 -12.016
75 2HG GLN 10 1HG GLN 10 13.384 11.829 -11.361
76 1HE2 GLN 10 1HE2 GLN 10 12.624 13.394 -12.713
77 2HE2 GLN 10 2HE2 GLN 10 12.258 13.122 -14.379
78 H LYS 11 H LYS 11 14.611 15.450 -12.671
79 HA LYS 11 HA LYS 11 14.816 16.129 -9.847
80 1HB LYS 11 2HB LYS 11 14.440 18.464 -10.641
81 2HB LYS 11 1HB LYS 11 15.867 17.689 -11.315
82 1HG LYS 11 2HG LYS 11 14.544 17.179 -13.361
83 2HG LYS 11 1HG LYS 11 13.224 18.133 -12.681
84 1HD LYS 11 2HD LYS 11 14.474 19.507 -14.206
85 2HD LYS 11 1HD LYS 11 14.766 20.075 -12.561
86 1HE LYS 11 2HE LYS 11 16.897 18.887 -12.518
87 2HE LYS 11 1HE LYS 11 16.595 18.266 -14.142
88 1HZ LYS 11 1HZ LYS 11 16.624 20.537 -14.977
89 2HZ LYS 11 2HZ LYS 11 18.079 20.170 -14.189
90 3HZ LYS 11 3HZ LYS 11 16.915 21.131 -13.413
91 H GLU 12 H GLU 12 12.373 16.060 -12.412
92 HA GLU 12 HA GLU 12 10.298 15.754 -10.455
93 1HB GLU 12 2HB GLU 12 9.026 17.795 -11.379
94 2HB GLU 12 1HB GLU 12 10.304 18.070 -10.205
95 1HG GLU 12 2HG GLU 12 11.811 18.431 -12.258
96 2HG GLU 12 1HG GLU 12 10.300 18.612 -13.145
97 H GLU 13 H GLU 13 9.423 14.042 -11.330
98 HA GLU 13 HA GLU 13 8.963 13.920 -14.203
99 1HB GLU 13 2HB GLU 13 8.628 11.502 -13.729
100 2HB GLU 13 1HB GLU 13 10.232 12.075 -13.347
101 1HG GLU 13 2HG GLU 13 8.046 11.697 -11.308
102 2HG GLU 13 1HG GLU 13 9.235 10.461 -11.708
103 H THR 14 H THR 14 6.956 12.332 -14.576
104 HA THR 14 HA THR 14 4.678 13.854 -13.716
105 HB THR 14 HB THR 14 4.734 11.383 -15.459
106 HG1 THR 14 1HG THR 14 4.935 14.169 -16.059
107 1HG2 THR 14 1HG2 THR 14 2.653 13.556 -15.138
108 2HG2 THR 14 2HG2 THR 14 2.512 11.899 -14.552
109 3HG2 THR 14 3HG2 THR 14 2.575 12.219 -16.284
110 HA PRO 15 HA PRO 15 3.220 9.701 -11.747
111 1HB PRO 15 2HB PRO 15 5.570 7.948 -11.692
112 2HB PRO 15 1HB PRO 15 3.931 7.603 -12.250
113 1HG PRO 15 2HG PRO 15 5.992 7.837 -13.963
114 2HG PRO 15 1HG PRO 15 4.358 8.384 -14.384
115 1HD PRO 15 2HD PRO 15 6.713 9.997 -13.465
116 2HD PRO 15 1HD PRO 15 5.551 10.343 -14.765
117 H PHE 16 H PHE 16 3.340 11.159 -10.023
118 HA PHE 16 HA PHE 16 5.659 11.419 -8.387
119 1HB PHE 16 2HB PHE 16 4.069 12.685 -6.886
120 2HB PHE 16 1HB PHE 16 4.175 13.286 -8.537
121 HD1 PHE 16 2HD PHE 16 2.065 11.581 -6.086
122 HD2 PHE 16 1HD PHE 16 2.313 13.076 -10.061
123 HE1 PHE 16 2HE PHE 16 -0.373 11.362 -6.316
124 HE2 PHE 16 1HE PHE 16 -0.126 12.863 -10.300
125 HZ PHE 16 HZ PHE 16 -1.472 11.993 -8.430
126 H TYR 17 H TYR 17 3.381 8.956 -8.603
127 HA TYR 17 HA TYR 17 3.194 8.446 -5.776
128 1HB TYR 17 2HB TYR 17 1.644 6.767 -6.294
129 2HB TYR 17 1HB TYR 17 1.342 8.033 -7.469
130 HD1 TYR 17 1HD TYR 17 2.095 7.707 -9.843
131 HD2 TYR 17 2HD TYR 17 2.282 4.590 -6.951
132 HE1 TYR 17 1HE TYR 17 2.258 6.043 -11.650
133 HE2 TYR 17 2HE TYR 17 2.458 2.924 -8.744
134 HH TYR 17 HH TYR 17 2.034 2.623 -11.018
135 H TYR 18 H TYR 18 5.453 7.695 -8.177
136 HA TYR 18 HA TYR 18 6.218 5.111 -7.245
137 1HB TYR 18 2HB TYR 18 7.511 7.150 -9.039
138 2HB TYR 18 1HB TYR 18 8.377 5.712 -8.526
139 HD1 TYR 18 1HD TYR 18 6.247 3.679 -8.603
140 HD2 TYR 18 2HD TYR 18 7.136 6.829 -11.314
141 HE1 TYR 18 1HE TYR 18 5.203 2.399 -10.422
142 HE2 TYR 18 2HE TYR 18 6.086 5.560 -13.141
143 HH TYR 18 HH TYR 18 4.074 2.979 -12.654
144 H GLY 19 H GLY 19 8.055 4.554 -6.044
145 1HA GLY 19 2HA GLY 19 10.097 5.346 -4.907
146 2HA GLY 19 1HA GLY 19 9.162 6.748 -4.407
147 H THR 20 H THR 20 10.017 6.021 -2.286
148 HA THR 20 HA THR 20 8.375 3.874 -1.123
149 HB THR 20 HB THR 20 10.963 5.036 -0.065
150 HG1 THR 20 1HG THR 20 10.479 2.477 -1.256
151 1HG2 THR 20 1HG2 THR 20 9.382 2.620 0.828
152 2HG2 THR 20 2HG2 THR 20 9.474 4.156 1.688
153 3HG2 THR 20 3HG2 THR 20 10.919 3.162 1.501
154 H TRP 21 H TRP 21 6.870 4.411 0.308
155 HA TRP 21 HA TRP 21 6.909 7.143 1.404
156 1HB TRP 21 2HB TRP 21 4.520 5.350 0.914
157 2HB TRP 21 1HB TRP 21 4.469 7.005 1.508
158 HD1 TRP 21 HD TRP 21 5.193 5.001 -1.688
159 HE1 TRP 21 1HE TRP 21 4.971 6.575 -3.713
160 HE3 TRP 21 3HE TRP 21 4.546 9.419 0.793
161 HZ2 TRP 21 2HZ TRP 21 4.580 9.324 -4.193
162 HZ3 TRP 21 3HZ TRP 21 4.258 11.479 -0.524
163 HH2 TRP 21 HH TRP 21 4.274 11.430 -2.966
164 H ASP 22 H ASP 22 7.035 7.372 3.535
165 HA ASP 22 HA ASP 22 7.086 5.006 5.222
166 1HB ASP 22 2HB ASP 22 8.872 6.576 5.544
167 2HB ASP 22 1HB ASP 22 7.744 7.910 5.738
168 H GLU 23 H GLU 23 5.319 4.285 6.181
169 HA GLU 23 HA GLU 23 3.234 6.137 7.038
170 1HB GLU 23 2HB GLU 23 3.410 3.201 6.562
171 2HB GLU 23 1HB GLU 23 2.247 3.779 7.747
172 1HG GLU 23 2HG GLU 23 2.320 5.027 5.047
173 2HG GLU 23 1HG GLU 23 1.564 3.452 5.265
174 H GLY 24 H GLY 24 4.743 7.016 8.635
175 1HA GLY 24 2HA GLY 24 5.063 5.302 11.004
176 2HA GLY 24 1HA GLY 24 5.943 6.796 10.699
177 H ARG 25 H ARG 25 2.485 6.183 10.406
178 HA ARG 25 HA ARG 25 1.997 8.071 12.593
179 1HB ARG 25 2HB ARG 25 1.634 9.268 10.498
180 2HB ARG 25 1HB ARG 25 0.599 7.976 9.908
181 1HG ARG 25 2HG ARG 25 -1.018 8.467 11.686
182 2HG ARG 25 1HG ARG 25 0.017 9.779 12.250
183 1HD ARG 25 2HD ARG 25 -1.151 9.617 9.475
184 2HD ARG 25 1HD ARG 25 -1.889 10.508 10.805
185 HE ARG 25 HE ARG 25 0.856 11.243 10.299
186 1HH1 ARG 25 1HH1 ARG 25 -2.473 11.829 9.370
187 2HH1 ARG 25 2HH1 ARG 25 -2.173 13.446 8.810
188 1HH2 ARG 25 1HH2 ARG 25 1.259 13.358 9.569
189 2HH2 ARG 25 2HH2 ARG 25 -0.039 14.323 8.926
190 H ALA 26 H ALA 26 0.266 7.626 13.863
191 HA ALA 26 HA ALA 26 -1.444 6.515 14.855
192 1HB ALA 26 1HB ALA 26 -2.549 6.577 12.665
193 2HB ALA 26 2HB ALA 26 -2.927 5.104 13.560
194 3HB ALA 26 3HB ALA 26 -1.766 5.056 12.235
195 HA PRO 27 HA PRO 27 0.315 2.853 16.604
196 1HB PRO 27 2HB PRO 27 -2.420 1.750 16.857
197 2HB PRO 27 1HB PRO 27 -1.218 2.078 18.108
198 1HG PRO 27 2HG PRO 27 -3.376 3.629 17.835
199 2HG PRO 27 1HG PRO 27 -1.799 4.309 18.276
200 1HD PRO 27 2HD PRO 27 -3.193 4.323 15.627
201 2HD PRO 27 1HD PRO 27 -2.253 5.610 16.411
202 H GLY 28 H GLY 28 1.141 1.046 15.762
203 1HA GLY 28 2HA GLY 28 -0.045 0.033 13.293
204 2HA GLY 28 1HA GLY 28 1.605 -0.245 13.834
205 HA PRO 29 HA PRO 29 -1.107 -4.041 14.537
206 1HB PRO 29 2HB PRO 29 0.833 -5.758 13.585
207 2HB PRO 29 1HB PRO 29 -0.492 -5.102 12.623
208 1HG PRO 29 2HG PRO 29 2.349 -4.196 12.799
209 2HG PRO 29 1HG PRO 29 1.288 -4.306 11.380
210 1HD PRO 29 2HD PRO 29 1.803 -1.960 12.585
211 2HD PRO 29 1HD PRO 29 0.215 -2.319 11.875
212 H THR 30 H THR 30 -1.081 -4.900 16.490
213 HA THR 30 HA THR 30 1.072 -4.547 18.307
214 HB THR 30 HB THR 30 -1.362 -4.705 18.922
215 HG1 THR 30 1HG THR 30 -0.069 -4.882 20.666
216 1HG2 THR 30 1HG2 THR 30 -1.987 -6.618 17.559
217 2HG2 THR 30 2HG2 THR 30 -2.316 -6.950 19.261
218 3HG2 THR 30 3HG2 THR 30 -0.900 -7.654 18.481
219 H ASP 31 H ASP 31 0.525 -6.766 15.878
220 HA ASP 31 HA ASP 31 1.529 -9.179 16.790
221 1HB ASP 31 2HB ASP 31 0.475 -8.846 14.598
222 2HB ASP 31 1HB ASP 31 1.870 -7.919 14.065
223 H GLY 32 H GLY 32 3.257 -6.268 15.869
224 1HA GLY 32 2HA GLY 32 5.461 -6.567 17.361
225 2HA GLY 32 1HA GLY 32 5.829 -7.617 16.002
226 H VAL 33 H VAL 33 4.338 -5.790 14.164
227 HA VAL 33 HA VAL 33 6.608 -4.103 13.545
228 HB VAL 33 HB VAL 33 3.968 -4.108 12.099
229 1HG1 VAL 33 1HG1 VAL 33 5.339 -3.547 10.159
230 2HG1 VAL 33 2HG1 VAL 33 6.783 -3.595 11.171
231 3HG1 VAL 33 3HG1 VAL 33 5.540 -2.380 11.466
232 1HG2 VAL 33 1HG2 VAL 33 4.627 -6.443 12.332
233 2HG2 VAL 33 2HG2 VAL 33 6.232 -6.064 11.705
234 3HG2 VAL 33 3HG2 VAL 33 4.820 -5.910 10.661
235 H LYS 34 H LYS 34 6.731 -1.924 13.903
236 HA LYS 34 HA LYS 34 4.535 -0.700 15.354
237 1HB LYS 34 2HB LYS 34 7.297 0.337 14.732
238 2HB LYS 34 1HB LYS 34 6.115 1.149 15.737
239 1HG LYS 34 2HG LYS 34 6.162 -0.972 17.175
240 2HG LYS 34 1HG LYS 34 7.648 -1.355 16.302
241 1HD LYS 34 2HD LYS 34 7.102 1.100 17.970
242 2HD LYS 34 1HD LYS 34 8.203 -0.221 18.357
243 1HE LYS 34 2HE LYS 34 9.609 0.364 16.468
244 2HE LYS 34 1HE LYS 34 8.476 1.629 15.991
245 1HZ LYS 34 1HZ LYS 34 10.195 1.542 18.400
246 2HZ LYS 34 2HZ LYS 34 8.911 2.632 18.235
247 3HZ LYS 34 3HZ LYS 34 10.207 2.690 17.151
248 H SER 35 H SER 35 6.075 -0.567 12.271
249 HA SER 35 HA SER 35 4.120 1.242 11.196
250 1HB SER 35 2HB SER 35 7.005 2.172 11.314
251 2HB SER 35 1HB SER 35 5.663 3.020 10.549
252 HG SER 35 HG SER 35 4.866 2.602 12.985
253 H ALA 36 H ALA 36 4.621 1.665 8.819
254 HA ALA 36 HA ALA 36 6.264 -0.503 7.707
255 1HB ALA 36 1HB ALA 36 3.431 0.089 6.855
256 2HB ALA 36 2HB ALA 36 3.951 -1.307 7.797
257 3HB ALA 36 3HB ALA 36 4.508 -1.108 6.135
258 H THR 37 H THR 37 6.958 -0.183 5.565
259 HA THR 37 HA THR 37 6.531 2.523 4.489
260 HB THR 37 HB THR 37 8.846 2.132 3.391
261 HG1 THR 37 1HG THR 37 10.148 0.830 5.018
262 1HG2 THR 37 1HG2 THR 37 8.636 2.635 6.361
263 2HG2 THR 37 2HG2 THR 37 8.447 3.841 5.090
264 3HG2 THR 37 3HG2 THR 37 10.011 3.069 5.345
265 H VAL 38 H VAL 38 5.809 2.599 2.443
266 HA VAL 38 HA VAL 38 5.608 0.016 1.049
267 HB VAL 38 HB VAL 38 3.418 0.837 1.718
268 1HG1 VAL 38 1HG1 VAL 38 4.059 3.298 0.101
269 2HG1 VAL 38 2HG1 VAL 38 3.882 3.216 1.853
270 3HG1 VAL 38 3HG1 VAL 38 2.490 2.918 0.811
271 1HG2 VAL 38 1HG2 VAL 38 2.308 0.832 -0.464
272 2HG2 VAL 38 2HG2 VAL 38 3.568 -0.398 -0.366
273 3HG2 VAL 38 3HG2 VAL 38 3.864 1.099 -1.248
274 H THR 39 H THR 39 6.467 -0.181 -0.892
275 HA THR 39 HA THR 39 7.448 2.263 -2.218
276 HB THR 39 HB THR 39 8.602 -0.532 -2.379
277 HG1 THR 39 1HG THR 39 9.148 0.336 -0.408
278 1HG2 THR 39 1HG2 THR 39 8.967 0.709 -4.441
279 2HG2 THR 39 2HG2 THR 39 10.479 0.585 -3.541
280 3HG2 THR 39 3HG2 THR 39 9.565 2.093 -3.523
281 H PHE 40 H PHE 40 6.633 2.687 -4.160
282 HA PHE 40 HA PHE 40 4.941 0.635 -5.399
283 1HB PHE 40 2HB PHE 40 5.029 3.637 -5.729
284 2HB PHE 40 1HB PHE 40 4.071 2.584 -6.762
285 HD1 PHE 40 2HD PHE 40 2.101 1.443 -5.892
286 HD2 PHE 40 1HD PHE 40 4.385 4.074 -3.451
287 HE1 PHE 40 2HE PHE 40 0.253 1.539 -4.272
288 HE2 PHE 40 1HE PHE 40 2.537 4.177 -1.831
289 HZ PHE 40 HZ PHE 40 0.468 2.906 -2.243
290 H THR 41 H THR 41 5.782 -0.477 -6.955
291 HA THR 41 HA THR 41 7.895 0.677 -8.624
292 HB THR 41 HB THR 41 7.057 -2.192 -8.845
293 HG1 THR 41 1HG THR 41 7.915 -2.738 -6.938
294 1HG2 THR 41 1HG2 THR 41 9.696 -0.726 -8.940
295 2HG2 THR 41 2HG2 THR 41 8.836 -1.464 -10.290
296 3HG2 THR 41 3HG2 THR 41 9.541 -2.479 -9.036
297 H GLU 42 H GLU 42 7.634 -0.429 -11.002
298 HA GLU 42 HA GLU 42 5.684 0.990 -12.291
299 1HB GLU 42 2HB GLU 42 6.940 -1.581 -13.222
300 2HB GLU 42 1HB GLU 42 6.260 -0.318 -14.225
301 1HG GLU 42 2HG GLU 42 8.004 1.189 -13.683
302 2HG GLU 42 1HG GLU 42 8.606 0.121 -12.413
303 H ASP 43 H ASP 43 5.688 -2.566 -11.935
304 HA ASP 43 HA ASP 43 2.755 -2.475 -12.234
305 1HB ASP 43 2HB ASP 43 2.920 -4.650 -13.381
306 2HB ASP 43 1HB ASP 43 3.825 -3.396 -14.223
307 H GLU 44 H GLU 44 4.727 -2.707 -9.848
308 HA GLU 44 HA GLU 44 3.189 -4.775 -8.487
309 1HB GLU 44 2HB GLU 44 5.234 -5.769 -7.507
310 2HB GLU 44 1HB GLU 44 5.140 -5.990 -9.248
311 1HG GLU 44 2HG GLU 44 6.679 -4.106 -9.552
312 2HG GLU 44 1HG GLU 44 6.806 -3.944 -7.806
313 H VAL 45 H VAL 45 3.033 -4.497 -6.274
314 HA VAL 45 HA VAL 45 4.127 -1.974 -5.208
315 HB VAL 45 HB VAL 45 1.727 -3.555 -4.249
316 1HG1 VAL 45 1HG1 VAL 45 2.793 -0.897 -3.294
317 2HG1 VAL 45 2HG1 VAL 45 2.895 -2.424 -2.416
318 3HG1 VAL 45 3HG1 VAL 45 1.322 -1.690 -2.731
319 1HG2 VAL 45 1HG2 VAL 45 0.395 -1.671 -5.044
320 2HG2 VAL 45 2HG2 VAL 45 1.305 -2.402 -6.366
321 3HG2 VAL 45 3HG2 VAL 45 1.852 -0.885 -5.650
322 H VAL 46 H VAL 46 5.755 -2.210 -3.820
323 HA VAL 46 HA VAL 46 6.128 -4.821 -2.538
324 HB VAL 46 HB VAL 46 8.104 -2.547 -2.785
325 1HG1 VAL 46 1HG1 VAL 46 8.524 -3.981 -0.861
326 2HG1 VAL 46 2HG1 VAL 46 9.760 -4.215 -2.096
327 3HG1 VAL 46 3HG1 VAL 46 8.475 -5.406 -1.896
328 1HG2 VAL 46 1HG2 VAL 46 7.609 -3.446 -4.977
329 2HG2 VAL 46 2HG2 VAL 46 7.848 -5.093 -4.388
330 3HG2 VAL 46 3HG2 VAL 46 9.211 -3.976 -4.467
331 H GLU 47 H GLU 47 5.614 -5.045 -0.479
332 HA GLU 47 HA GLU 47 5.371 -2.650 1.179
333 1HB GLU 47 2HB GLU 47 4.111 -5.327 1.243
334 2HB GLU 47 1HB GLU 47 4.420 -4.557 2.790
335 1HG GLU 47 2HG GLU 47 3.109 -2.666 2.189
336 2HG GLU 47 1HG GLU 47 2.924 -3.259 0.542
337 H THR 48 H THR 48 6.536 -2.309 2.895
338 HA THR 48 HA THR 48 8.496 -4.345 3.715
339 HB THR 48 HB THR 48 9.504 -1.697 4.214
340 HG1 THR 48 1HG THR 48 8.274 -1.133 2.347
341 1HG2 THR 48 1HG2 THR 48 11.441 -2.540 2.988
342 2HG2 THR 48 2HG2 THR 48 10.489 -3.906 2.407
343 3HG2 THR 48 3HG2 THR 48 10.847 -3.751 4.126
344 H GLU 49 H GLU 49 8.273 -4.844 5.798
345 HA GLU 49 HA GLU 49 6.789 -2.984 7.518
346 1HB GLU 49 2HB GLU 49 7.510 -5.875 8.040
347 2HB GLU 49 1HB GLU 49 6.447 -4.873 9.015
348 1HG GLU 49 2HG GLU 49 4.940 -4.685 7.033
349 2HG GLU 49 1HG GLU 49 5.956 -5.878 6.226
350 H VAL 50 H VAL 50 7.717 -2.036 9.271
351 HA VAL 50 HA VAL 50 10.594 -2.369 9.555
352 HB VAL 50 HB VAL 50 8.735 -0.479 11.016
353 1HG1 VAL 50 1HG1 VAL 50 11.740 -0.494 10.767
354 2HG1 VAL 50 2HG1 VAL 50 10.817 -0.879 12.218
355 3HG1 VAL 50 3HG1 VAL 50 10.782 0.757 11.558
356 1HG2 VAL 50 1HG2 VAL 50 9.593 1.238 9.472
357 2HG2 VAL 50 2HG2 VAL 50 8.697 -0.025 8.630
358 3HG2 VAL 50 3HG2 VAL 50 10.461 -0.013 8.583
359 H MET 51 H MET 51 11.306 -3.926 10.821
360 HA MET 51 HA MET 51 9.679 -4.719 13.136
361 1HB MET 51 2HB MET 51 11.495 -6.244 11.301
362 2HB MET 51 1HB MET 51 11.151 -6.848 12.915
363 1HG MET 51 2HG MET 51 9.057 -6.186 10.862
364 2HG MET 51 1HG MET 51 9.703 -7.801 11.149
365 1HE MET 51 1HE MET 51 10.057 -8.005 14.208
366 2HE MET 51 2HE MET 51 9.216 -9.245 13.276
367 3HE MET 51 3HE MET 51 8.485 -8.601 14.745
368 H GLU 52 H GLU 52 10.441 -4.378 15.065
369 HA GLU 52 HA GLU 52 12.801 -2.959 15.565
370 1HB GLU 52 2HB GLU 52 10.798 -2.906 16.998
371 2HB GLU 52 1HB GLU 52 11.096 -4.570 17.472
372 1HG GLU 52 2HG GLU 52 13.146 -3.929 18.570
373 2HG GLU 52 1HG GLU 52 12.949 -2.265 18.018
374 H GLY 53 H GLY 53 14.807 -3.695 15.364
375 1HA GLY 53 2HA GLY 53 16.601 -4.991 16.271
376 2HA GLY 53 1HA GLY 53 15.469 -6.305 16.553
377 H ARG 54 H ARG 54 14.323 -5.873 13.832
378 HA ARG 54 HA ARG 54 16.247 -7.587 12.434
379 1HB ARG 54 2HB ARG 54 13.446 -6.911 11.555
380 2HB ARG 54 1HB ARG 54 14.423 -8.298 11.097
381 1HG ARG 54 2HG ARG 54 13.682 -7.941 13.950
382 2HG ARG 54 1HG ARG 54 12.475 -8.513 12.805
383 1HD ARG 54 2HD ARG 54 13.854 -10.394 12.209
384 2HD ARG 54 1HD ARG 54 15.188 -9.770 13.182
385 HE ARG 54 HE ARG 54 14.079 -10.431 15.120
386 1HH1 ARG 54 1HH1 ARG 54 12.189 -11.150 12.251
387 2HH1 ARG 54 2HH1 ARG 54 11.076 -12.194 13.091
388 1HH2 ARG 54 1HH2 ARG 54 12.633 -11.833 16.218
389 2HH2 ARG 54 2HH2 ARG 54 11.310 -12.555 15.340
390 H GLY 55 H GLY 55 14.074 -4.889 11.797
391 1HA GLY 55 2HA GLY 55 15.032 -2.874 10.705
392 2HA GLY 55 1HA GLY 55 15.896 -3.986 9.645
393 H GLU 56 H GLU 56 14.813 -2.830 7.862
394 HA GLU 56 HA GLU 56 12.015 -3.125 7.505
395 1HB GLU 56 2HB GLU 56 14.159 -2.729 5.413
396 2HB GLU 56 1HB GLU 56 12.440 -2.454 5.209
397 1HG GLU 56 2HG GLU 56 13.060 -0.338 5.595
398 2HG GLU 56 1HG GLU 56 12.845 -0.834 7.264
399 H VAL 57 H VAL 57 10.902 -4.784 6.907
400 HA VAL 57 HA VAL 57 12.299 -7.134 5.797
401 HB VAL 57 HB VAL 57 9.810 -6.963 7.496
402 1HG1 VAL 57 1HG1 VAL 57 9.764 -9.418 7.416
403 2HG1 VAL 57 2HG1 VAL 57 11.092 -9.400 6.256
404 3HG1 VAL 57 3HG1 VAL 57 9.528 -8.710 5.818
405 1HG2 VAL 57 1HG2 VAL 57 12.514 -8.184 8.026
406 2HG2 VAL 57 2HG2 VAL 57 11.120 -8.282 9.102
407 3HG2 VAL 57 3HG2 VAL 57 11.864 -6.719 8.760
408 H GLN 58 H GLN 58 11.802 -7.637 3.753
409 HA GLN 58 HA GLN 58 9.736 -6.184 2.387
410 1HB GLN 58 2HB GLN 58 11.617 -8.325 1.402
411 2HB GLN 58 1HB GLN 58 10.617 -7.294 0.400
412 1HG GLN 58 2HG GLN 58 11.846 -5.335 1.198
413 2HG GLN 58 1HG GLN 58 12.862 -6.390 2.175
414 1HE2 GLN 58 1HE2 GLN 58 12.892 -8.486 0.118
415 2HE2 GLN 58 2HE2 GLN 58 13.970 -7.921 -1.110
416 H LEU 59 H LEU 59 7.756 -6.850 2.003
417 HA LEU 59 HA LEU 59 7.013 -9.640 2.457
418 1HB LEU 59 2HB LEU 59 5.405 -7.136 1.939
419 2HB LEU 59 1HB LEU 59 4.687 -8.729 2.064
420 HG LEU 59 HG LEU 59 6.244 -7.369 4.255
421 1HD1 LEU 59 1HD1 LEU 59 3.274 -7.765 3.921
422 2HD1 LEU 59 2HD1 LEU 59 4.135 -6.232 3.799
423 3HD1 LEU 59 3HD1 LEU 59 4.073 -7.088 5.340
424 1HD2 LEU 59 1HD2 LEU 59 5.371 -9.167 5.667
425 2HD2 LEU 59 2HD2 LEU 59 6.374 -9.801 4.362
426 3HD2 LEU 59 3HD2 LEU 59 4.618 -9.909 4.256
427 HA PRO 60 HA PRO 60 6.698 -10.809 -1.806
428 1HB PRO 60 2HB PRO 60 4.046 -11.604 -2.042
429 2HB PRO 60 1HB PRO 60 5.367 -12.619 -1.457
430 1HG PRO 60 2HG PRO 60 3.300 -11.121 0.081
431 2HG PRO 60 1HG PRO 60 4.039 -12.695 0.423
432 1HD PRO 60 2HD PRO 60 4.737 -10.452 1.746
433 2HD PRO 60 1HD PRO 60 5.901 -11.743 1.408
434 H PHE 61 H PHE 61 6.551 -9.555 -3.583
435 HA PHE 61 HA PHE 61 5.206 -7.066 -3.415
436 1HB PHE 61 2HB PHE 61 5.895 -6.845 -5.865
437 2HB PHE 61 1HB PHE 61 7.174 -6.998 -4.673
438 HD1 PHE 61 1HD PHE 61 5.326 -8.761 -7.323
439 HD2 PHE 61 2HD PHE 61 8.685 -8.826 -4.711
440 HE1 PHE 61 1HE PHE 61 6.286 -10.619 -8.612
441 HE2 PHE 61 2HE PHE 61 9.645 -10.697 -5.992
442 HZ PHE 61 HZ PHE 61 8.446 -11.590 -7.946
443 H MET 62 H MET 62 3.246 -6.533 -3.855
444 HA MET 62 HA MET 62 1.372 -8.454 -4.777
445 1HB MET 62 2HB MET 62 0.981 -6.890 -2.902
446 2HB MET 62 1HB MET 62 1.070 -5.542 -4.031
447 1HG MET 62 2HG MET 62 -0.825 -6.475 -5.236
448 2HG MET 62 1HG MET 62 -0.931 -7.750 -4.032
449 1HE MET 62 1HE MET 62 -0.057 -5.954 -1.450
450 2HE MET 62 2HE MET 62 -1.326 -7.176 -1.369
451 3HE MET 62 3HE MET 62 -1.638 -5.540 -0.790
452 H ALA 63 H ALA 63 0.663 -8.665 -6.819
453 HA ALA 63 HA ALA 63 1.557 -6.899 -8.896
454 1HB ALA 63 1HB ALA 63 -0.501 -9.110 -9.012
455 2HB ALA 63 2HB ALA 63 1.228 -9.307 -9.309
456 3HB ALA 63 3HB ALA 63 0.253 -8.313 -10.393
457 H TYR 64 H TYR 64 0.459 -5.243 -9.870
458 HA TYR 64 HA TYR 64 -2.376 -4.913 -9.322
459 1HB TYR 64 2HB TYR 64 -2.268 -2.853 -8.250
460 2HB TYR 64 1HB TYR 64 -0.895 -3.694 -7.541
461 HD1 TYR 64 1HD TYR 64 1.427 -3.209 -8.494
462 HD2 TYR 64 2HD TYR 64 -1.984 -0.821 -9.368
463 HE1 TYR 64 1HE TYR 64 2.901 -1.365 -9.189
464 HE2 TYR 64 2HE TYR 64 -0.523 1.022 -10.070
465 HH TYR 64 HH TYR 64 2.883 0.607 -10.495
466 H LYS 65 H LYS 65 -3.377 -3.347 -10.721
467 HA LYS 65 HA LYS 65 -1.774 -2.599 -13.044
468 1HB LYS 65 2HB LYS 65 -3.304 -4.417 -13.599
469 2HB LYS 65 1HB LYS 65 -4.654 -3.513 -12.917
470 1HG LYS 65 2HG LYS 65 -4.440 -1.830 -14.582
471 2HG LYS 65 1HG LYS 65 -2.976 -2.588 -15.190
472 1HD LYS 65 2HD LYS 65 -4.304 -4.587 -15.790
473 2HD LYS 65 1HD LYS 65 -5.758 -3.739 -15.265
474 1HE LYS 65 2HE LYS 65 -3.908 -2.874 -17.484
475 2HE LYS 65 1HE LYS 65 -5.480 -3.644 -17.693
476 1HZ LYS 65 1HZ LYS 65 -6.447 -1.708 -16.479
477 2HZ LYS 65 2HZ LYS 65 -5.767 -1.330 -17.983
478 3HZ LYS 65 3HZ LYS 65 -4.928 -0.958 -16.562
479 H VAL 66 H VAL 66 -1.910 -0.542 -13.670
480 HA VAL 66 HA VAL 66 -3.305 1.365 -12.033
481 HB VAL 66 HB VAL 66 -1.796 1.675 -14.631
482 1HG1 VAL 66 1HG1 VAL 66 -3.413 3.486 -14.381
483 2HG1 VAL 66 2HG1 VAL 66 -1.769 4.084 -14.164
484 3HG1 VAL 66 3HG1 VAL 66 -2.806 3.822 -12.760
485 1HG2 VAL 66 1HG2 VAL 66 -0.994 2.238 -11.779
486 2HG2 VAL 66 2HG2 VAL 66 -0.031 2.635 -13.204
487 3HG2 VAL 66 3HG2 VAL 66 -0.380 0.951 -12.816
488 H ILE 67 H ILE 67 -5.364 1.939 -12.261
489 HA ILE 67 HA ILE 67 -6.856 1.213 -14.636
490 HB ILE 67 HB ILE 67 -7.840 2.875 -12.320
491 1HG1 ILE 67 2HG1 ILE 67 -7.943 -0.138 -12.607
492 2HG1 ILE 67 1HG1 ILE 67 -6.940 0.756 -11.465
493 1HG2 ILE 67 1HG2 ILE 67 -9.296 1.181 -14.346
494 2HG2 ILE 67 2HG2 ILE 67 -9.252 2.944 -14.285
495 3HG2 ILE 67 3HG2 ILE 67 -10.044 2.037 -13.000
496 1HD1 ILE 67 1HD1 ILE 67 -8.902 -0.138 -10.371
497 2HD1 ILE 67 2HD1 ILE 67 -9.951 0.696 -11.515
498 3HD1 ILE 67 3HD1 ILE 67 -8.959 1.622 -10.386
499 H SER 68 H SER 68 -6.108 4.153 -12.826
500 HA SER 68 HA SER 68 -6.114 5.687 -15.321
501 1HB SER 68 2HB SER 68 -7.543 6.693 -12.872
502 2HB SER 68 1HB SER 68 -7.570 7.368 -14.490
503 HG SER 68 HG SER 68 -9.374 5.855 -13.600
504 H GLN 69 H GLN 69 -5.056 7.696 -15.160
505 HA GLN 69 HA GLN 69 -3.571 8.310 -12.750
506 1HB GLN 69 2HB GLN 69 -2.059 6.770 -13.919
507 2HB GLN 69 1HB GLN 69 -2.145 7.771 -15.360
508 1HG GLN 69 2HG GLN 69 -1.121 9.617 -14.124
509 2HG GLN 69 1HG GLN 69 -1.016 8.593 -12.696
510 1HE2 GLN 69 1HE2 GLN 69 -0.336 6.220 -14.288
511 2HE2 GLN 69 2HE2 GLN 69 1.321 6.426 -14.753
512 H SER 70 H SER 70 -3.564 10.408 -12.481
513 HA SER 70 HA SER 70 -3.431 12.274 -14.649
514 1HB SER 70 2HB SER 70 -5.820 11.591 -14.735
515 2HB SER 70 1HB SER 70 -6.003 12.081 -13.057
516 HG SER 70 HG SER 70 -5.675 13.653 -15.354
517 H THR 71 H THR 71 -3.250 14.458 -13.907
518 HA THR 71 HA THR 71 -2.133 14.664 -11.256
519 HB THR 71 HB THR 71 -2.599 16.898 -13.211
520 HG1 THR 71 1HG THR 71 -0.281 15.250 -13.008
521 1HG2 THR 71 1HG2 THR 71 -0.554 16.513 -11.025
522 2HG2 THR 71 2HG2 THR 71 -1.950 17.588 -10.956
523 3HG2 THR 71 3HG2 THR 71 -0.652 17.902 -12.108
524 H ASP 72 H ASP 72 -5.107 15.395 -12.869
525 HA ASP 72 HA ASP 72 -6.118 16.656 -10.404
526 1HB ASP 72 2HB ASP 72 -6.826 17.226 -13.280
527 2HB ASP 72 1HB ASP 72 -7.835 17.752 -11.935
528 H GLY 73 H GLY 73 -6.712 14.339 -12.958
529 1HA GLY 73 2HA GLY 73 -9.223 13.462 -11.811
530 2HA GLY 73 1HA GLY 73 -8.349 12.694 -13.132
531 H SER 74 H SER 74 -6.146 13.214 -10.829
532 HA SER 74 HA SER 74 -5.007 12.087 -9.325
533 1HB SER 74 2HB SER 74 -6.189 11.002 -7.560
534 2HB SER 74 1HB SER 74 -7.050 12.459 -7.993
535 HG SER 74 HG SER 74 -8.083 10.571 -9.474
536 H ILE 75 H ILE 75 -4.841 9.665 -8.330
537 HA ILE 75 HA ILE 75 -4.540 8.015 -10.750
538 HB ILE 75 HB ILE 75 -3.040 7.640 -8.160
539 1HG1 ILE 75 2HG1 ILE 75 -2.228 9.265 -10.585
540 2HG1 ILE 75 1HG1 ILE 75 -2.490 9.865 -8.951
541 1HG2 ILE 75 1HG2 ILE 75 -3.112 5.705 -9.643
542 2HG2 ILE 75 2HG2 ILE 75 -1.483 6.370 -9.553
543 3HG2 ILE 75 3HG2 ILE 75 -2.483 6.689 -10.969
544 1HD1 ILE 75 1HD1 ILE 75 -0.574 8.596 -8.166
545 2HD1 ILE 75 2HD1 ILE 75 -0.123 9.680 -9.480
546 3HD1 ILE 75 3HD1 ILE 75 -0.319 7.955 -9.790
547 H GLU 76 H GLU 76 -5.566 6.126 -10.872
548 HA GLU 76 HA GLU 76 -6.750 5.021 -8.415
549 1HB GLU 76 2HB GLU 76 -8.347 6.199 -10.108
550 2HB GLU 76 1HB GLU 76 -8.077 4.776 -11.101
551 1HG GLU 76 2HG GLU 76 -8.923 3.354 -9.310
552 2HG GLU 76 1HG GLU 76 -9.195 4.778 -8.306
553 H ILE 77 H ILE 77 -6.274 2.907 -8.100
554 HA ILE 77 HA ILE 77 -5.168 1.413 -10.376
555 HB ILE 77 HB ILE 77 -3.458 0.423 -8.862
556 1HG1 ILE 77 2HG1 ILE 77 -4.295 2.653 -6.994
557 2HG1 ILE 77 1HG1 ILE 77 -4.581 0.936 -6.724
558 1HG2 ILE 77 1HG2 ILE 77 -1.952 2.375 -8.896
559 2HG2 ILE 77 2HG2 ILE 77 -3.336 3.408 -9.255
560 3HG2 ILE 77 3HG2 ILE 77 -2.836 2.170 -10.408
561 1HD1 ILE 77 1HD1 ILE 77 -2.178 0.550 -6.626
562 2HD1 ILE 77 2HD1 ILE 77 -2.690 1.738 -5.427
563 3HD1 ILE 77 3HD1 ILE 77 -1.888 2.266 -6.907
564 H GLN 78 H GLN 78 -5.232 -0.870 -10.172
565 HA GLN 78 HA GLN 78 -7.160 -1.864 -8.179
566 1HB GLN 78 2HB GLN 78 -8.204 -1.779 -10.407
567 2HB GLN 78 1HB GLN 78 -6.877 -2.719 -11.073
568 1HG GLN 78 2HG GLN 78 -8.791 -4.138 -10.723
569 2HG GLN 78 1HG GLN 78 -7.501 -4.596 -9.616
570 1HE2 GLN 78 1HE2 GLN 78 -10.732 -3.465 -9.909
571 2HE2 GLN 78 2HE2 GLN 78 -11.073 -3.357 -8.221
572 H TYR 79 H TYR 79 -6.749 -3.957 -7.377
573 HA TYR 79 HA TYR 79 -3.930 -4.707 -7.668
574 1HB TYR 79 2HB TYR 79 -5.940 -5.363 -5.504
575 2HB TYR 79 1HB TYR 79 -4.307 -6.019 -5.565
576 HD1 TYR 79 1HD TYR 79 -2.526 -3.932 -6.090
577 HD2 TYR 79 2HD TYR 79 -6.181 -3.716 -3.923
578 HE1 TYR 79 1HE TYR 79 -1.683 -1.967 -4.877
579 HE2 TYR 79 2HE TYR 79 -5.348 -1.751 -2.703
580 HH TYR 79 HH TYR 79 -2.531 -0.061 -3.643
581 H LEU 80 H LEU 80 -3.323 -6.871 -7.939
582 HA LEU 80 HA LEU 80 -5.408 -8.550 -9.175
583 1HB LEU 80 2HB LEU 80 -2.437 -8.655 -9.703
584 2HB LEU 80 1HB LEU 80 -3.699 -9.490 -10.587
585 HG LEU 80 HG LEU 80 -3.307 -6.496 -10.547
586 1HD1 LEU 80 1HD1 LEU 80 -1.487 -7.613 -11.704
587 2HD1 LEU 80 2HD1 LEU 80 -2.536 -6.780 -12.853
588 3HD1 LEU 80 3HD1 LEU 80 -2.643 -8.531 -12.668
589 1HD2 LEU 80 1HD2 LEU 80 -5.635 -7.141 -10.900
590 2HD2 LEU 80 2HD2 LEU 80 -5.145 -8.225 -12.202
591 3HD2 LEU 80 3HD2 LEU 80 -4.927 -6.482 -12.377
592 H GLY 81 H GLY 81 -4.947 -10.945 -8.970
593 1HA GLY 81 2HA GLY 81 -4.121 -12.776 -7.744
594 2HA GLY 81 1HA GLY 81 -3.280 -11.652 -6.683
595 HA PRO 82 HA PRO 82 -6.824 -13.248 -4.186
596 1HB PRO 82 2HB PRO 82 -4.983 -12.513 -2.003
597 2HB PRO 82 1HB PRO 82 -5.821 -14.038 -2.300
598 1HG PRO 82 2HG PRO 82 -3.180 -13.799 -2.671
599 2HG PRO 82 1HG PRO 82 -4.181 -14.819 -3.721
600 1HD PRO 82 2HD PRO 82 -3.071 -12.084 -4.232
601 2HD PRO 82 1HD PRO 82 -3.202 -13.472 -5.334
602 H TYR 83 H TYR 83 -5.305 -10.283 -4.616
603 HA TYR 83 HA TYR 83 -7.023 -8.881 -2.683
604 1HB TYR 83 2HB TYR 83 -4.705 -7.711 -4.232
605 2HB TYR 83 1HB TYR 83 -5.498 -7.045 -2.811
606 HD1 TYR 83 1HD TYR 83 -3.118 -9.555 -4.025
607 HD2 TYR 83 2HD TYR 83 -4.938 -7.832 -0.590
608 HE1 TYR 83 1HE TYR 83 -1.422 -10.618 -2.605
609 HE2 TYR 83 2HE TYR 83 -3.246 -8.896 0.846
610 HH TYR 83 HH TYR 83 -1.634 -10.576 0.883
611 H TYR 84 H TYR 84 -7.506 -9.965 -5.535
612 HA TYR 84 HA TYR 84 -7.682 -7.848 -7.358
613 1HB TYR 84 2HB TYR 84 -8.888 -9.406 -8.765
614 2HB TYR 84 1HB TYR 84 -7.564 -10.236 -7.970
615 HD1 TYR 84 1HD TYR 84 -8.645 -11.021 -5.389
616 HD2 TYR 84 2HD TYR 84 -10.553 -10.902 -9.188
617 HE1 TYR 84 1HE TYR 84 -10.188 -12.789 -4.666
618 HE2 TYR 84 2HE TYR 84 -12.102 -12.666 -8.472
619 HH TYR 84 HH TYR 84 -12.059 -14.555 -6.774
620 HA PRO 85 HA PRO 85 -10.717 -5.415 -8.409
621 1HB PRO 85 2HB PRO 85 -13.016 -6.975 -7.358
622 2HB PRO 85 1HB PRO 85 -12.970 -5.820 -8.689
623 1HG PRO 85 2HG PRO 85 -12.496 -8.609 -8.873
624 2HG PRO 85 1HG PRO 85 -12.208 -7.400 -10.136
625 1HD PRO 85 2HD PRO 85 -10.213 -8.895 -8.930
626 2HD PRO 85 1HD PRO 85 -9.945 -7.308 -9.691
627 H LEU 86 H LEU 86 -10.240 -6.318 -5.176
628 HA LEU 86 HA LEU 86 -11.559 -3.970 -4.127
629 1HB LEU 86 2HB LEU 86 -11.053 -5.947 -2.708
630 2HB LEU 86 1HB LEU 86 -9.341 -5.640 -2.926
631 HG LEU 86 HG LEU 86 -9.584 -3.485 -1.762
632 1HD1 LEU 86 1HD1 LEU 86 -12.441 -4.372 -1.375
633 2HD1 LEU 86 2HD1 LEU 86 -11.888 -2.971 -2.294
634 3HD1 LEU 86 3HD1 LEU 86 -11.676 -3.020 -0.543
635 1HD2 LEU 86 1HD2 LEU 86 -8.955 -5.478 -0.513
636 2HD2 LEU 86 2HD2 LEU 86 -10.656 -5.857 -0.242
637 3HD2 LEU 86 3HD2 LEU 86 -9.951 -4.407 0.472
638 H LYS 87 H LYS 87 -10.869 -2.026 -4.867
639 HA LYS 87 HA LYS 87 -8.170 -1.904 -5.963
640 1HB LYS 87 2HB LYS 87 -8.929 -0.086 -7.317
641 2HB LYS 87 1HB LYS 87 -10.125 -1.368 -7.398
642 1HG LYS 87 2HG LYS 87 -11.538 -0.163 -5.815
643 2HG LYS 87 1HG LYS 87 -10.334 1.126 -5.723
644 1HD LYS 87 2HD LYS 87 -10.581 1.418 -8.193
645 2HD LYS 87 1HD LYS 87 -11.923 0.273 -8.137
646 1HE LYS 87 2HE LYS 87 -13.081 1.769 -6.544
647 2HE LYS 87 1HE LYS 87 -11.761 2.927 -6.712
648 1HZ LYS 87 1HZ LYS 87 -13.508 3.588 -8.161
649 2HZ LYS 87 2HZ LYS 87 -13.651 2.034 -8.818
650 3HZ LYS 87 3HZ LYS 87 -12.265 2.967 -9.138
651 H SER 88 H SER 88 -7.493 0.602 -6.099
652 HA SER 88 HA SER 88 -7.612 1.775 -3.427
653 1HB SER 88 2HB SER 88 -5.655 0.283 -3.422
654 2HB SER 88 1HB SER 88 -5.040 1.076 -4.867
655 HG SER 88 HG SER 88 -5.579 2.502 -2.484
656 H THR 89 H THR 89 -6.757 3.994 -3.399
657 HA THR 89 HA THR 89 -6.683 5.301 -6.029
658 HB THR 89 HB THR 89 -8.277 6.459 -3.755
659 HG1 THR 89 1HG THR 89 -8.928 4.403 -5.474
660 1HG2 THR 89 1HG2 THR 89 -7.583 8.015 -5.506
661 2HG2 THR 89 2HG2 THR 89 -9.328 7.763 -5.558
662 3HG2 THR 89 3HG2 THR 89 -8.283 6.964 -6.736
663 H LEU 90 H LEU 90 -5.476 7.185 -6.089
664 HA LEU 90 HA LEU 90 -4.015 7.883 -3.627
665 1HB LEU 90 2HB LEU 90 -2.860 7.661 -6.411
666 2HB LEU 90 1HB LEU 90 -1.999 8.260 -5.008
667 HG LEU 90 HG LEU 90 -3.083 5.452 -5.260
668 1HD1 LEU 90 1HD1 LEU 90 -0.269 6.481 -5.612
669 2HD1 LEU 90 2HD1 LEU 90 -1.308 5.849 -6.888
670 3HD1 LEU 90 3HD1 LEU 90 -0.755 4.786 -5.595
671 1HD2 LEU 90 1HD2 LEU 90 -1.200 6.702 -3.264
672 2HD2 LEU 90 2HD2 LEU 90 -1.678 5.004 -3.318
673 3HD2 LEU 90 3HD2 LEU 90 -2.877 6.248 -2.959
674 H LYS 91 H LYS 91 -4.193 9.963 -3.116
675 HA LYS 91 HA LYS 91 -4.743 11.892 -5.276
676 1HB LYS 91 2HB LYS 91 -5.926 11.792 -2.504
677 2HB LYS 91 1HB LYS 91 -6.007 13.220 -3.527
678 1HG LYS 91 2HG LYS 91 -7.181 11.869 -5.238
679 2HG LYS 91 1HG LYS 91 -7.178 10.515 -4.110
680 1HD LYS 91 2HD LYS 91 -8.516 11.758 -2.539
681 2HD LYS 91 1HD LYS 91 -8.417 13.206 -3.542
682 1HE LYS 91 2HE LYS 91 -10.533 12.291 -3.990
683 2HE LYS 91 1HE LYS 91 -9.531 11.841 -5.366
684 1HZ LYS 91 1HZ LYS 91 -9.163 9.685 -3.968
685 2HZ LYS 91 2HZ LYS 91 -10.575 9.878 -4.890
686 3HZ LYS 91 3HZ LYS 91 -10.610 10.153 -3.218
687 H ARG 92 H ARG 92 -4.263 14.192 -4.549
688 HA ARG 92 HA ARG 92 -1.472 14.205 -3.849
689 1HB ARG 92 2HB ARG 92 -3.392 16.370 -4.689
690 2HB ARG 92 1HB ARG 92 -1.714 16.685 -4.290
691 1HG ARG 92 2HG ARG 92 -1.006 15.205 -6.100
692 2HG ARG 92 1HG ARG 92 -2.695 14.895 -6.495
693 1HD ARG 92 2HD ARG 92 -2.777 16.735 -7.739
694 2HD ARG 92 1HD ARG 92 -2.283 17.714 -6.360
695 HE ARG 92 HE ARG 92 -0.027 16.432 -7.502
696 1HH1 ARG 92 1HH1 ARG 92 -2.277 19.069 -8.063
697 2HH1 ARG 92 2HH1 ARG 92 -1.171 19.963 -9.063
698 1HH2 ARG 92 1HH2 ARG 92 1.427 17.636 -8.809
699 2HH2 ARG 92 2HH2 ARG 92 0.926 19.172 -9.449
700 H GLY 93 H GLY 93 -0.502 15.299 -2.186
701 1HA GLY 93 2HA GLY 93 -2.250 16.227 0.000
702 2HA GLY 93 1HA GLY 93 -0.669 15.488 0.248
703 H GLU 94 H GLU 94 -1.855 18.190 0.876
704 HA GLU 94 HA GLU 94 -1.026 20.172 -0.854
705 1HB GLU 94 2HB GLU 94 -1.370 20.301 2.132
706 2HB GLU 94 1HB GLU 94 -1.321 21.686 1.052
707 1HG GLU 94 2HG GLU 94 -3.349 21.036 -0.009
708 2HG GLU 94 1HG GLU 94 -3.350 19.484 0.827
709 H ASN 95 H ASN 95 0.720 18.753 1.835
710 HA ASN 95 HA ASN 95 2.960 20.590 1.447
711 1HB ASN 95 2HB ASN 95 2.426 18.459 3.526
712 2HB ASN 95 1HB ASN 95 3.900 19.417 3.468
713 1HD2 ASN 95 1HD2 ASN 95 0.484 19.436 4.089
714 2HD2 ASN 95 2HD2 ASN 95 0.430 20.984 4.866
715 H GLY 96 H GLY 96 2.276 18.484 -0.535
716 1HA GLY 96 2HA GLY 96 3.592 17.232 -1.984
717 2HA GLY 96 1HA GLY 96 4.948 17.432 -0.879
718 H THR 97 H THR 97 1.748 16.171 -0.195
719 HA THR 97 HA THR 97 2.992 13.700 0.787
720 HB THR 97 HB THR 97 0.210 14.553 1.530
721 HG1 THR 97 1HG THR 97 2.560 15.899 2.110
722 1HG2 THR 97 1HG2 THR 97 1.030 12.392 2.316
723 2HG2 THR 97 2HG2 THR 97 0.832 13.502 3.671
724 3HG2 THR 97 3HG2 THR 97 2.441 13.167 3.029
725 H LEU 98 H LEU 98 1.399 11.767 0.668
726 HA LEU 98 HA LEU 98 -0.294 11.942 -1.730
727 1HB LEU 98 2HB LEU 98 1.845 10.714 -2.172
728 2HB LEU 98 1HB LEU 98 1.380 9.551 -0.946
729 HG LEU 98 HG LEU 98 -0.619 8.969 -2.308
730 1HD1 LEU 98 1HD1 LEU 98 0.653 10.795 -4.343
731 2HD1 LEU 98 2HD1 LEU 98 -0.894 11.041 -3.535
732 3HD1 LEU 98 3HD1 LEU 98 -0.689 9.695 -4.658
733 1HD2 LEU 98 1HD2 LEU 98 1.438 7.654 -2.466
734 2HD2 LEU 98 2HD2 LEU 98 2.018 8.714 -3.752
735 3HD2 LEU 98 3HD2 LEU 98 0.590 7.711 -4.009
736 H ILE 99 H ILE 99 -2.315 11.231 -1.428
737 HA ILE 99 HA ILE 99 -2.947 10.052 1.178
738 HB ILE 99 HB ILE 99 -4.786 11.241 -0.907
739 1HG1 ILE 99 2HG1 ILE 99 -3.870 12.312 1.772
740 2HG1 ILE 99 1HG1 ILE 99 -3.333 12.898 0.200
741 1HG2 ILE 99 1HG2 ILE 99 -5.888 9.492 0.406
742 2HG2 ILE 99 2HG2 ILE 99 -6.527 11.086 0.807
743 3HG2 ILE 99 3HG2 ILE 99 -5.389 10.294 1.897
744 1HD1 ILE 99 1HD1 ILE 99 -4.977 14.397 1.092
745 2HD1 ILE 99 2HD1 ILE 99 -6.108 13.067 1.348
746 3HD1 ILE 99 3HD1 ILE 99 -5.671 13.547 -0.290
747 H TRP 100 H TRP 100 -3.044 7.953 1.256
748 HA TRP 100 HA TRP 100 -3.538 6.433 -1.189
749 1HB TRP 100 2HB TRP 100 -1.502 5.897 0.071
750 2HB TRP 100 1HB TRP 100 -2.459 5.576 1.513
751 HD1 TRP 100 HD TRP 100 -3.532 4.255 -1.913
752 HE1 TRP 100 1HE TRP 100 -3.398 1.692 -1.891
753 HE3 TRP 100 3HE TRP 100 -1.270 3.616 2.622
754 HZ2 TRP 100 2HZ TRP 100 -2.439 -0.342 -0.182
755 HZ3 TRP 100 3HZ TRP 100 -0.770 1.325 3.377
756 HH2 TRP 100 HH TRP 100 -1.344 -0.613 2.002
757 H GLU 101 H GLU 101 -5.591 5.891 -1.533
758 HA GLU 101 HA GLU 101 -7.284 5.336 0.806
759 1HB GLU 101 2HB GLU 101 -7.961 6.081 -2.031
760 2HB GLU 101 1HB GLU 101 -9.167 5.557 -0.870
761 1HG GLU 101 2HG GLU 101 -8.808 7.418 0.502
762 2HG GLU 101 1HG GLU 101 -7.325 7.842 -0.335
763 H GLN 102 H GLN 102 -7.981 3.420 1.175
764 HA GLN 102 HA GLN 102 -8.153 1.390 -0.879
765 1HB GLN 102 2HB GLN 102 -5.731 1.492 0.062
766 2HB GLN 102 1HB GLN 102 -6.420 0.742 1.492
767 1HG GLN 102 2HG GLN 102 -6.837 -0.464 -1.210
768 2HG GLN 102 1HG GLN 102 -5.342 -0.739 -0.323
769 1HE2 GLN 102 1HE2 GLN 102 -7.452 -2.594 -1.145
770 2HE2 GLN 102 2HE2 GLN 102 -7.995 -3.357 0.308
771 H ASN 103 H ASN 103 -9.808 0.040 -0.447
772 HA ASN 103 HA ASN 103 -11.376 -1.181 0.676
773 1HB ASN 103 2HB ASN 103 -9.138 -1.134 2.409
774 2HB ASN 103 1HB ASN 103 -10.555 -0.850 3.412
775 1HD2 ASN 103 1HD2 ASN 103 -8.637 -3.137 2.942
776 2HD2 ASN 103 2HD2 ASN 103 -9.669 -4.516 2.730
777 H GLY 104 H GLY 104 -11.265 1.934 0.621
778 1HA GLY 104 2HA GLY 104 -12.982 3.456 1.078
779 2HA GLY 104 1HA GLY 104 -13.684 2.299 2.200
780 H GLN 105 H GLN 105 -10.397 2.588 2.750
781 HA GLN 105 HA GLN 105 -10.858 4.525 4.918
782 1HB GLN 105 2HB GLN 105 -8.600 2.532 4.746
783 2HB GLN 105 1HB GLN 105 -9.142 3.430 6.157
784 1HG GLN 105 2HG GLN 105 -11.257 2.170 6.103
785 2HG GLN 105 1HG GLN 105 -10.633 1.231 4.752
786 1HE2 GLN 105 1HE2 GLN 105 -10.442 1.824 8.160
787 2HE2 GLN 105 2HE2 GLN 105 -9.463 0.449 8.545
788 H ARG 106 H ARG 106 -9.449 6.254 5.168
789 HA ARG 106 HA ARG 106 -7.721 6.768 2.873
790 1HB ARG 106 2HB ARG 106 -9.208 8.494 4.780
791 2HB ARG 106 1HB ARG 106 -7.719 9.124 4.091
792 1HG ARG 106 2HG ARG 106 -8.626 8.652 1.834
793 2HG ARG 106 1HG ARG 106 -10.142 8.163 2.589
794 1HD ARG 106 2HD ARG 106 -10.531 10.350 3.417
795 2HD ARG 106 1HD ARG 106 -8.899 10.872 2.996
796 HE ARG 106 HE ARG 106 -10.469 9.974 0.746
797 1HH1 ARG 106 1HH1 ARG 106 -9.616 12.708 2.775
798 2HH1 ARG 106 2HH1 ARG 106 -9.991 13.892 1.559
799 1HH2 ARG 106 1HH2 ARG 106 -11.024 11.539 -0.837
800 2HH2 ARG 106 2HH2 ARG 106 -10.817 13.225 -0.478
801 H LYS 107 H LYS 107 -5.676 6.378 3.062
802 HA LYS 107 HA LYS 107 -4.373 6.463 5.689
803 1HB LYS 107 2HB LYS 107 -3.547 5.235 3.059
804 2HB LYS 107 1HB LYS 107 -2.502 5.301 4.471
805 1HG LYS 107 2HG LYS 107 -5.182 3.947 4.419
806 2HG LYS 107 1HG LYS 107 -3.646 3.141 4.143
807 1HD LYS 107 2HD LYS 107 -4.458 4.596 6.651
808 2HD LYS 107 1HD LYS 107 -4.359 2.842 6.447
809 1HE LYS 107 2HE LYS 107 -1.971 3.052 5.951
810 2HE LYS 107 1HE LYS 107 -2.080 4.792 6.196
811 1HZ LYS 107 1HZ LYS 107 -1.276 3.977 8.193
812 2HZ LYS 107 2HZ LYS 107 -2.302 2.630 8.188
813 3HZ LYS 107 3HZ LYS 107 -2.934 4.173 8.506
814 H THR 108 H THR 108 -2.622 7.747 6.076
815 HA THR 108 HA THR 108 -1.959 9.696 3.965
816 HB THR 108 HB THR 108 -1.897 10.252 6.937
817 HG1 THR 108 1HG THR 108 -4.014 10.051 5.371
818 1HG2 THR 108 1HG2 THR 108 -1.736 12.599 6.218
819 2HG2 THR 108 2HG2 THR 108 -1.714 12.079 4.534
820 3HG2 THR 108 3HG2 THR 108 -0.385 11.643 5.609
821 H MET 109 H MET 109 0.027 9.332 3.245
822 HA MET 109 HA MET 109 2.054 8.429 5.177
823 1HB MET 109 2HB MET 109 3.029 7.017 3.381
824 2HB MET 109 1HB MET 109 1.425 6.502 3.889
825 1HG MET 109 2HG MET 109 0.482 7.682 1.918
826 2HG MET 109 1HG MET 109 2.131 8.023 1.389
827 1HE MET 109 1HE MET 109 -0.019 6.535 -0.456
828 2HE MET 109 2HE MET 109 1.013 5.285 -1.150
829 3HE MET 109 3HE MET 109 1.630 6.925 -0.938
830 H THR 110 H THR 110 4.106 9.227 4.942
831 HA THR 110 HA THR 110 4.254 11.616 3.251
832 HB THR 110 HB THR 110 6.228 10.911 5.389
833 HG1 THR 110 1HG THR 110 3.626 11.252 5.779
834 1HG2 THR 110 1HG2 THR 110 5.210 13.554 4.339
835 2HG2 THR 110 2HG2 THR 110 6.742 12.799 3.897
836 3HG2 THR 110 3HG2 THR 110 6.471 13.338 5.554
837 H ARG 111 H ARG 111 6.231 12.074 2.118
838 HA ARG 111 HA ARG 111 7.265 9.666 0.870
839 1HB ARG 111 2HB ARG 111 7.923 11.016 -0.922
840 2HB ARG 111 1HB ARG 111 6.440 11.784 -0.368
841 1HG ARG 111 2HG ARG 111 8.091 13.195 1.087
842 2HG ARG 111 1HG ARG 111 9.257 12.707 -0.135
843 1HD ARG 111 2HD ARG 111 7.829 13.618 -1.890
844 2HD ARG 111 1HD ARG 111 6.635 14.091 -0.684
845 HE ARG 111 HE ARG 111 9.125 15.250 -0.036
846 1HH1 ARG 111 1HH1 ARG 111 6.517 15.523 -2.347
847 2HH1 ARG 111 2HH1 ARG 111 6.835 17.188 -2.727
848 1HH2 ARG 111 1HH2 ARG 111 9.542 17.446 -0.489
849 2HH2 ARG 111 2HH2 ARG 111 8.553 18.302 -1.641
850 H ILE 112 H ILE 112 9.500 9.362 0.533
851 HA ILE 112 HA ILE 112 11.177 10.390 2.684
852 HB ILE 112 HB ILE 112 11.817 8.265 0.643
853 1HG1 ILE 112 2HG1 ILE 112 9.815 7.749 2.053
854 2HG1 ILE 112 1HG1 ILE 112 11.141 6.634 2.277
855 1HG2 ILE 112 1HG2 ILE 112 13.096 8.927 3.290
856 2HG2 ILE 112 2HG2 ILE 112 13.783 9.243 1.696
857 3HG2 ILE 112 3HG2 ILE 112 13.542 7.582 2.237
858 1HD1 ILE 112 1HD1 ILE 112 11.762 7.807 4.343
859 2HD1 ILE 112 2HD1 ILE 112 10.117 7.168 4.393
860 3HD1 ILE 112 3HD1 ILE 112 10.387 8.887 4.109
861 H GLU 113 H GLU 113 13.202 11.361 2.196
862 HA GLU 113 HA GLU 113 12.897 13.068 -0.135
863 1HB GLU 113 2HB GLU 113 13.355 14.065 2.080
864 2HB GLU 113 1HB GLU 113 14.917 13.254 2.101
865 1HG GLU 113 2HG GLU 113 15.566 14.490 0.086
866 2HG GLU 113 1HG GLU 113 14.019 15.334 0.117
867 H SER 114 H SER 114 13.861 12.688 -1.954
868 HA SER 114 HA SER 114 16.329 11.119 -2.017
869 1HB SER 114 2HB SER 114 14.556 12.018 -4.306
870 2HB SER 114 1HB SER 114 15.913 10.895 -4.413
871 HG SER 114 HG SER 114 13.941 10.276 -2.560
872 H LYS 115 H LYS 115 18.177 12.207 -2.043
873 HA LYS 115 HA LYS 115 18.151 15.015 -2.865
874 1HB LYS 115 2HB LYS 115 20.227 13.459 -1.309
875 2HB LYS 115 1HB LYS 115 20.313 15.178 -1.674
876 1HG LYS 115 2HG LYS 115 18.360 15.604 -0.324
877 2HG LYS 115 1HG LYS 115 18.150 13.875 -0.030
878 1HD LYS 115 2HD LYS 115 19.210 14.927 1.887
879 2HD LYS 115 1HD LYS 115 20.339 13.823 1.101
880 1HE LYS 115 2HE LYS 115 21.558 15.790 1.617
881 2HE LYS 115 1HE LYS 115 21.271 15.810 -0.121
882 1HZ LYS 115 1HZ LYS 115 19.878 17.399 1.960
883 2HZ LYS 115 2HZ LYS 115 19.327 17.294 0.360
884 3HZ LYS 115 3HZ LYS 115 20.848 17.973 0.693
885 H THR 116 H THR 116 18.557 12.247 -4.310
886 HA THR 116 HA THR 116 20.432 13.300 -6.259
887 HB THR 116 HB THR 116 21.417 10.835 -6.282
888 HG1 THR 116 1HG THR 116 20.319 9.940 -4.586
889 1HG2 THR 116 1HG2 THR 116 23.291 11.616 -4.896
890 2HG2 THR 116 2HG2 THR 116 22.301 12.956 -4.318
891 3HG2 THR 116 3HG2 THR 116 22.754 12.864 -6.020
892 H GLY 117 H GLY 117 20.215 12.354 -8.319
893 1HA GLY 117 2HA GLY 117 18.405 10.171 -8.775
894 2HA GLY 117 1HA GLY 117 17.726 11.731 -9.222
895 H ARG 118 H ARG 118 20.714 9.845 -9.652
896 HA ARG 118 HA ARG 118 21.161 11.275 -12.170
897 1HB ARG 118 2HB ARG 118 22.928 10.957 -10.282
898 2HB ARG 118 1HB ARG 118 23.096 9.336 -10.939
899 1HG ARG 118 2HG ARG 118 23.563 10.389 -13.162
900 2HG ARG 118 1HG ARG 118 23.616 11.946 -12.333
901 1HD ARG 118 2HD ARG 118 25.854 11.212 -12.495
902 2HD ARG 118 1HD ARG 118 25.370 10.936 -10.823
903 HE ARG 118 HE ARG 118 25.592 8.843 -12.889
904 1HH1 ARG 118 1HH1 ARG 118 25.555 9.836 -9.530
905 2HH1 ARG 118 2HH1 ARG 118 26.113 8.301 -8.944
906 1HH2 ARG 118 1HH2 ARG 118 26.305 6.813 -12.116
907 2HH2 ARG 118 2HH2 ARG 118 26.537 6.582 -10.407
908 H GLU 119 H GLU 119 19.579 10.178 -13.375
909 HA GLU 119 HA GLU 119 20.431 7.557 -14.338
910 1HB GLU 119 2HB GLU 119 17.697 8.193 -13.225
911 2HB GLU 119 1HB GLU 119 17.973 6.840 -14.314
912 1HG GLU 119 2HG GLU 119 19.388 5.754 -12.764
913 2HG GLU 119 1HG GLU 119 19.503 7.195 -11.757
914 H GLU 120 H GLU 120 20.236 7.354 -16.488
915 HA GLU 120 HA GLU 120 20.013 7.931 -18.659
916 1HB GLU 120 2HB GLU 120 17.555 9.251 -17.545
917 2HB GLU 120 1HB GLU 120 17.996 9.451 -19.234
918 1HG GLU 120 2HG GLU 120 17.578 6.785 -17.904
919 2HG GLU 120 1HG GLU 120 16.341 7.654 -18.814
920 H LYS 121 H LYS 121 19.977 9.877 -20.182
921 HA LYS 121 HA LYS 121 20.327 12.487 -19.212
922 1HB LYS 121 2HB LYS 121 22.490 11.905 -18.415
923 2HB LYS 121 1HB LYS 121 22.875 11.018 -19.888
924 1HG LYS 121 2HG LYS 121 23.119 12.978 -21.143
925 2HG LYS 121 1HG LYS 121 22.293 13.960 -19.936
926 1HD LYS 121 2HD LYS 121 24.162 13.763 -18.432
927 2HD LYS 121 1HD LYS 121 24.964 12.626 -19.518
928 1HE LYS 121 2HE LYS 121 25.839 14.966 -19.636
929 2HE LYS 121 1HE LYS 121 25.282 14.312 -21.174
930 1HZ LYS 121 1HZ LYS 121 23.751 16.172 -19.425
931 2HZ LYS 121 2HZ LYS 121 23.207 15.543 -20.899
932 3HZ LYS 121 3HZ LYS 121 24.544 16.587 -20.864
933 H ASP 122 H ASP 122 19.800 13.808 -20.760
934 HA ASP 122 HA ASP 122 20.350 13.057 -23.555
935 1HB ASP 122 2HB ASP 122 17.870 13.308 -22.652
936 2HB ASP 122 1HB ASP 122 18.204 15.029 -22.797
937 H GLU 123 H GLU 123 19.604 15.791 -24.396
938 HA GLU 123 HA GLU 123 20.344 17.934 -24.517
939 1HB GLU 123 2HB GLU 123 19.979 18.027 -22.091
940 2HB GLU 123 1HB GLU 123 21.595 17.400 -21.819
941 1HG GLU 123 2HG GLU 123 22.520 19.418 -22.906
942 2HG GLU 123 1HG GLU 123 20.880 20.047 -23.056
943 H LYS 124 H LYS 124 21.583 17.407 -26.295
944 HA LYS 124 HA LYS 124 24.441 17.730 -25.814
945 1HB LYS 124 2HB LYS 124 24.630 16.056 -27.915
946 2HB LYS 124 1HB LYS 124 24.755 15.527 -26.248
947 1HG LYS 124 2HG LYS 124 23.335 14.014 -27.421
948 2HG LYS 124 1HG LYS 124 22.342 14.942 -26.299
949 1HD LYS 124 2HD LYS 124 21.607 16.375 -28.137
950 2HD LYS 124 1HD LYS 124 22.624 15.467 -29.257
951 1HE LYS 124 2HE LYS 124 21.328 13.478 -28.911
952 2HE LYS 124 1HE LYS 124 20.389 14.255 -27.636
953 1HZ LYS 124 1HZ LYS 124 19.380 15.689 -29.206
954 2HZ LYS 124 2HZ LYS 124 19.274 14.123 -29.848
955 3HZ LYS 124 3HZ LYS 124 20.434 15.211 -30.445
956 H SER 125 H SER 125 25.071 19.460 -26.870
957 HA SER 125 HA SER 125 24.274 19.883 -29.626
958 1HB SER 125 2HB SER 125 23.644 21.954 -27.500
959 2HB SER 125 1HB SER 125 23.459 22.179 -29.238
960 HG SER 125 HG SER 125 22.197 19.934 -28.466
961 H LYS 126 H LYS 126 26.250 20.052 -30.484
962 HA LYS 126 HA LYS 126 28.081 21.991 -29.238
963 1HB LYS 126 2HB LYS 126 28.790 19.535 -29.166
964 2HB LYS 126 1HB LYS 126 28.988 19.652 -30.911
965 1HG LYS 126 2HG LYS 126 30.622 21.430 -30.622
966 2HG LYS 126 1HG LYS 126 30.405 21.358 -28.874
967 1HD LYS 126 2HD LYS 126 31.257 19.081 -28.846
968 2HD LYS 126 1HD LYS 126 31.419 19.105 -30.604
969 1HE LYS 126 2HE LYS 126 32.881 20.886 -28.657
970 2HE LYS 126 1HE LYS 126 33.567 19.513 -29.525
971 1HZ LYS 126 1HZ LYS 126 32.513 22.010 -30.748
972 2HZ LYS 126 2HZ LYS 126 33.094 20.670 -31.612
973 3HZ LYS 126 3HZ LYS 126 34.146 21.561 -30.622
974 H SER 127 H SER 127 25.959 22.050 -31.444
975 HA SER 127 HA SER 127 27.568 23.012 -33.674
976 1HB SER 127 2HB SER 127 24.555 23.011 -33.381
977 2HB SER 127 1HB SER 127 25.476 23.225 -34.869
978 HG SER 127 HG SER 127 25.062 20.891 -33.336
979 H LEU 128 H LEU 128 28.489 24.930 -33.141
980 HA LEU 128 HA LEU 128 26.667 27.061 -32.231
981 1HB LEU 128 2HB LEU 128 28.298 26.162 -30.496
982 2HB LEU 128 1HB LEU 128 29.577 26.849 -31.478
983 HG LEU 128 HG LEU 128 28.576 29.091 -31.176
984 1HD1 LEU 128 1HD1 LEU 128 26.704 27.653 -29.298
985 2HD1 LEU 128 2HD1 LEU 128 26.259 28.404 -30.832
986 3HD1 LEU 128 3HD1 LEU 128 26.830 29.402 -29.494
987 1HD2 LEU 128 1HD2 LEU 128 29.189 29.340 -28.812
988 2HD2 LEU 128 2HD2 LEU 128 30.354 28.352 -29.693
989 3HD2 LEU 128 3HD2 LEU 128 29.171 27.588 -28.631
990 H GLU 129 H GLU 129 26.366 27.749 -34.356
991 HA GLU 129 HA GLU 129 28.480 28.282 -36.167
992 1HB GLU 129 2HB GLU 129 26.157 27.875 -36.871
993 2HB GLU 129 1HB GLU 129 25.663 29.377 -36.110
994 1HG GLU 129 2HG GLU 129 25.850 29.679 -38.491
995 2HG GLU 129 1HG GLU 129 27.088 30.623 -37.664
996 H HIS 130 H HIS 130 29.751 29.999 -36.416
997 HA HIS 130 HA HIS 130 29.077 32.672 -35.864
998 1HB HIS 130 2HB HIS 130 29.329 31.805 -33.487
999 2HB HIS 130 1HB HIS 130 31.028 31.528 -33.850
1000 HD1 HIS 130 1HD HIS 130 32.197 33.283 -32.511
1001 HD2 HIS 130 2HD HIS 130 28.951 34.800 -34.625
1002 HE1 HIS 130 1HE HIS 130 32.252 35.775 -32.148
1003 HE2 HIS 130 2HE HIS 130 30.254 36.673 -33.395
1004 H HIS 131 H HIS 131 30.263 33.728 -37.332
1005 HA HIS 131 HA HIS 131 32.651 32.352 -38.347
1006 1HB HIS 131 2HB HIS 131 30.866 34.429 -39.632
1007 2HB HIS 131 1HB HIS 131 32.330 33.792 -40.374
1008 HD1 HIS 131 1HD HIS 131 29.135 33.459 -41.187
1009 HD2 HIS 131 2HD HIS 131 31.789 30.608 -39.735
1010 HE1 HIS 131 1HE HIS 131 28.206 31.241 -41.908
1011 HE2 HIS 131 2HE HIS 131 29.688 29.540 -40.789
1012 H HIS 132 H HIS 132 34.545 33.490 -38.862
1013 HA HIS 132 HA HIS 132 34.836 36.161 -37.656
1014 1HB HIS 132 2HB HIS 132 36.737 33.819 -37.409
1015 2HB HIS 132 1HB HIS 132 37.179 35.474 -37.014
1016 HD1 HIS 132 1HD HIS 132 36.688 36.250 -34.696
1017 HD2 HIS 132 2HD HIS 132 34.682 32.735 -35.672
1018 HE1 HIS 132 1HE HIS 132 35.620 35.457 -32.558
1019 HE2 HIS 132 2HE HIS 132 34.539 33.251 -33.142
1020 H HIS 133 H HIS 133 35.788 37.603 -38.968
1021 HA HIS 133 HA HIS 133 37.506 36.632 -41.121
1022 1HB HIS 133 2HB HIS 133 35.034 38.303 -41.543
1023 2HB HIS 133 1HB HIS 133 36.360 38.291 -42.699
1024 HD1 HIS 133 1HD HIS 133 33.327 36.511 -41.769
1025 HD2 HIS 133 2HD HIS 133 36.838 35.636 -43.825
1026 HE1 HIS 133 1HE HIS 133 32.847 34.416 -43.078
1027 HE2 HIS 133 2HE HIS 133 35.041 33.800 -44.155
1028 H HIS 134 H HIS 134 36.031 39.808 -40.513
1029 HA HIS 134 HA HIS 134 36.923 41.874 -40.264
1030 1HB HIS 134 2HB HIS 134 39.192 40.315 -39.032
1031 2HB HIS 134 1HB HIS 134 39.216 42.071 -39.162
1032 HD1 HIS 134 1HD HIS 134 38.495 39.576 -36.799
1033 HD2 HIS 134 2HD HIS 134 36.601 43.105 -37.927
1034 HE1 HIS 134 1HE HIS 134 37.012 40.206 -34.861
1035 HE2 HIS 134 2HE HIS 134 35.998 42.421 -35.501
1036 H HIS 135 H HIS 135 39.652 39.807 -41.256
1037 HA HIS 135 HA HIS 135 39.734 41.189 -43.812
1038 1HB HIS 135 2HB HIS 135 41.268 42.434 -42.249
1039 2HB HIS 135 1HB HIS 135 42.212 40.957 -42.087
1040 HD1 HIS 135 1HD HIS 135 44.179 40.915 -43.557
1041 HD2 HIS 135 2HD HIS 135 41.069 43.133 -45.203
1042 HE1 HIS 135 1HE HIS 135 45.072 41.832 -45.726
1043 HE2 HIS 135 2HE HIS 135 43.144 43.104 -46.749
Start of MODEL 10
1 1H MET 1 1HT MET 1 -12.085 19.765 -16.441
2 2H MET 1 2HT MET 1 -12.775 19.056 -17.813
3 3H MET 1 3HT MET 1 -11.256 18.546 -17.270
4 HA MET 1 HA MET 1 -12.196 17.676 -15.259
5 1HB MET 1 2HB MET 1 -14.635 17.600 -14.955
6 2HB MET 1 1HB MET 1 -14.024 19.245 -14.994
7 1HG MET 1 2HG MET 1 -14.767 19.484 -17.298
8 2HG MET 1 1HG MET 1 -15.366 17.829 -17.280
9 1HE MET 1 1HE MET 1 -17.124 20.368 -18.126
10 2HE MET 1 2HE MET 1 -18.649 19.973 -17.331
11 3HE MET 1 3HE MET 1 -17.721 18.708 -18.135
12 H ILE 2 H ILE 2 -13.386 17.459 -18.586
13 HA ILE 2 HA ILE 2 -13.484 14.537 -18.236
14 HB ILE 2 HB ILE 2 -15.138 14.541 -20.155
15 1HG1 ILE 2 2HG1 ILE 2 -15.361 17.476 -19.426
16 2HG1 ILE 2 1HG1 ILE 2 -14.698 16.853 -20.930
17 1HG2 ILE 2 1HG2 ILE 2 -15.988 15.851 -17.578
18 2HG2 ILE 2 2HG2 ILE 2 -15.782 14.121 -17.847
19 3HG2 ILE 2 3HG2 ILE 2 -17.041 15.002 -18.713
20 1HD1 ILE 2 1HD1 ILE 2 -17.541 16.522 -19.995
21 2HD1 ILE 2 2HD1 ILE 2 -16.869 15.899 -21.501
22 3HD1 ILE 2 3HD1 ILE 2 -16.973 17.640 -21.235
23 H MET 3 H MET 3 -11.716 13.739 -19.048
24 HA MET 3 HA MET 3 -11.242 13.690 -21.816
25 1HB MET 3 2HB MET 3 -9.108 14.849 -21.966
26 2HB MET 3 1HB MET 3 -10.356 15.966 -21.442
27 1HG MET 3 2HG MET 3 -9.560 15.845 -19.164
28 2HG MET 3 1HG MET 3 -8.358 14.637 -19.622
29 1HE MET 3 1HE MET 3 -6.179 17.816 -18.853
30 2HE MET 3 2HE MET 3 -6.470 16.116 -18.476
31 3HE MET 3 3HE MET 3 -7.667 17.334 -18.032
32 H VAL 4 H VAL 4 -8.965 12.623 -22.222
33 HA VAL 4 HA VAL 4 -8.624 10.609 -20.115
34 HB VAL 4 HB VAL 4 -7.320 9.334 -21.888
35 1HG1 VAL 4 1HG1 VAL 4 -9.354 8.479 -22.946
36 2HG1 VAL 4 2HG1 VAL 4 -10.246 9.890 -22.379
37 3HG1 VAL 4 3HG1 VAL 4 -9.589 8.737 -21.216
38 1HG2 VAL 4 1HG2 VAL 4 -6.891 11.154 -23.437
39 2HG2 VAL 4 2HG2 VAL 4 -8.622 11.378 -23.687
40 3HG2 VAL 4 3HG2 VAL 4 -7.836 9.895 -24.231
41 H SER 5 H SER 5 -7.348 11.726 -18.707
42 HA SER 5 HA SER 5 -5.015 13.169 -19.568
43 1HB SER 5 2HB SER 5 -5.791 12.473 -16.740
44 2HB SER 5 1HB SER 5 -4.859 13.861 -17.304
45 HG SER 5 HG SER 5 -7.044 14.404 -16.806
46 H GLY 6 H GLY 6 -4.893 10.335 -20.173
47 1HA GLY 6 2HA GLY 6 -2.424 9.704 -18.756
48 2HA GLY 6 1HA GLY 6 -3.743 8.559 -18.566
49 H CYS 7 H CYS 7 -1.104 9.470 -20.448
50 HA CYS 7 HA CYS 7 -1.665 7.227 -22.227
51 1HB CYS 7 2HB CYS 7 -2.334 9.172 -23.535
52 2HB CYS 7 1HB CYS 7 -0.798 9.960 -23.200
53 HG CYS 7 HG CYS 7 -1.445 8.445 -25.843
54 H GLN 8 H GLN 8 0.087 5.966 -22.536
55 HA GLN 8 HA GLN 8 2.368 6.489 -20.899
56 1HB GLN 8 2HB GLN 8 1.771 4.208 -22.786
57 2HB GLN 8 1HB GLN 8 3.148 4.261 -21.693
58 1HG GLN 8 2HG GLN 8 1.663 4.300 -19.782
59 2HG GLN 8 1HG GLN 8 0.261 4.323 -20.848
60 1HE2 GLN 8 1HE2 GLN 8 3.116 2.415 -21.514
61 2HE2 GLN 8 2HE2 GLN 8 2.375 0.876 -21.230
62 H GLN 9 H GLN 9 1.611 7.435 -23.950
63 HA GLN 9 HA GLN 9 4.328 7.306 -24.989
64 1HB GLN 9 2HB GLN 9 1.699 8.135 -26.170
65 2HB GLN 9 1HB GLN 9 3.203 8.621 -26.935
66 1HG GLN 9 2HG GLN 9 2.410 6.663 -28.028
67 2HG GLN 9 1HG GLN 9 3.833 6.224 -27.090
68 1HE2 GLN 9 1HE2 GLN 9 3.631 4.810 -25.376
69 2HE2 GLN 9 2HE2 GLN 9 2.174 3.925 -25.070
70 H GLN 10 H GLN 10 2.326 9.428 -23.238
71 HA GLN 10 HA GLN 10 3.371 11.903 -24.172
72 1HB GLN 10 2HB GLN 10 1.943 11.182 -21.612
73 2HB GLN 10 1HB GLN 10 2.365 12.826 -22.066
74 1HG GLN 10 2HG GLN 10 0.970 12.625 -24.066
75 2HG GLN 10 1HG GLN 10 0.539 10.982 -23.587
76 1HE2 GLN 10 1HE2 GLN 10 0.180 14.365 -22.873
77 2HE2 GLN 10 2HE2 GLN 10 -1.185 14.198 -21.820
78 H LYS 11 H LYS 11 4.100 9.833 -21.415
79 HA LYS 11 HA LYS 11 5.856 9.666 -20.012
80 1HB LYS 11 2HB LYS 11 7.281 9.761 -22.010
81 2HB LYS 11 1HB LYS 11 7.278 11.515 -21.929
82 1HG LYS 11 2HG LYS 11 8.518 11.500 -19.891
83 2HG LYS 11 1HG LYS 11 8.361 9.748 -19.748
84 1HD LYS 11 2HD LYS 11 9.683 9.458 -21.785
85 2HD LYS 11 1HD LYS 11 9.818 11.209 -21.951
86 1HE LYS 11 2HE LYS 11 11.836 10.195 -20.970
87 2HE LYS 11 1HE LYS 11 11.066 11.354 -19.891
88 1HZ LYS 11 1HZ LYS 11 11.803 9.295 -18.777
89 2HZ LYS 11 2HZ LYS 11 10.696 8.410 -19.710
90 3HZ LYS 11 3HZ LYS 11 10.137 9.576 -18.612
91 H GLU 12 H GLU 12 6.191 13.026 -21.086
92 HA GLU 12 HA GLU 12 5.901 15.016 -20.061
93 1HB GLU 12 2HB GLU 12 4.222 13.377 -18.169
94 2HB GLU 12 1HB GLU 12 4.364 15.125 -18.073
95 1HG GLU 12 2HG GLU 12 3.346 13.623 -20.475
96 2HG GLU 12 1HG GLU 12 2.328 14.354 -19.235
97 H GLU 13 H GLU 13 6.116 12.817 -17.258
98 HA GLU 13 HA GLU 13 8.639 13.959 -16.426
99 1HB GLU 13 2HB GLU 13 6.790 15.588 -15.707
100 2HB GLU 13 1HB GLU 13 6.230 14.324 -14.628
101 1HG GLU 13 2HG GLU 13 7.548 15.871 -13.381
102 2HG GLU 13 1HG GLU 13 8.437 14.357 -13.510
103 H THR 14 H THR 14 9.198 12.931 -14.178
104 HA THR 14 HA THR 14 8.629 10.125 -14.286
105 HB THR 14 HB THR 14 10.834 10.951 -13.552
106 HG1 THR 14 1HG THR 14 9.727 8.925 -12.679
107 1HG2 THR 14 1HG2 THR 14 11.114 11.924 -11.310
108 2HG2 THR 14 2HG2 THR 14 9.362 11.983 -11.121
109 3HG2 THR 14 3HG2 THR 14 10.147 12.964 -12.358
110 HA PRO 15 HA PRO 15 4.834 9.957 -11.994
111 1HB PRO 15 2HB PRO 15 6.103 7.527 -10.818
112 2HB PRO 15 1HB PRO 15 4.499 7.721 -11.536
113 1HG PRO 15 2HG PRO 15 6.439 6.526 -12.901
114 2HG PRO 15 1HG PRO 15 5.324 7.643 -13.711
115 1HD PRO 15 2HD PRO 15 8.158 8.059 -12.876
116 2HD PRO 15 1HD PRO 15 7.299 8.670 -14.304
117 H PHE 16 H PHE 16 4.328 11.087 -10.255
118 HA PHE 16 HA PHE 16 6.227 11.910 -8.352
119 1HB PHE 16 2HB PHE 16 4.318 12.989 -7.208
120 2HB PHE 16 1HB PHE 16 4.342 13.322 -8.935
121 HD1 PHE 16 1HD PHE 16 2.665 12.319 -10.414
122 HD2 PHE 16 2HD PHE 16 2.548 11.731 -6.199
123 HE1 PHE 16 1HE PHE 16 0.336 11.546 -10.588
124 HE2 PHE 16 2HE PHE 16 0.221 10.949 -6.368
125 HZ PHE 16 HZ PHE 16 -0.888 10.853 -8.564
126 H TYR 17 H TYR 17 4.039 9.210 -8.374
127 HA TYR 17 HA TYR 17 4.118 8.856 -5.516
128 1HB TYR 17 2HB TYR 17 2.617 7.046 -5.849
129 2HB TYR 17 1HB TYR 17 2.122 8.307 -6.964
130 HD1 TYR 17 1HD TYR 17 2.714 8.065 -9.412
131 HD2 TYR 17 2HD TYR 17 3.232 4.896 -6.620
132 HE1 TYR 17 1HE TYR 17 2.823 6.454 -11.266
133 HE2 TYR 17 2HE TYR 17 3.342 3.277 -8.468
134 HH TYR 17 HH TYR 17 2.760 3.027 -10.748
135 H TYR 18 H TYR 18 6.271 8.203 -7.948
136 HA TYR 18 HA TYR 18 6.992 5.517 -7.312
137 1HB TYR 18 2HB TYR 18 7.407 6.852 -9.493
138 2HB TYR 18 1HB TYR 18 8.821 7.484 -8.665
139 HD1 TYR 18 2HD TYR 18 7.223 4.440 -9.978
140 HD2 TYR 18 1HD TYR 18 10.791 6.150 -8.411
141 HE1 TYR 18 2HE TYR 18 8.481 2.454 -10.693
142 HE2 TYR 18 1HE TYR 18 12.058 4.161 -9.109
143 HH TYR 18 HH TYR 18 10.790 1.837 -11.252
144 H GLY 19 H GLY 19 8.534 4.766 -5.970
145 1HA GLY 19 2HA GLY 19 10.655 5.334 -4.747
146 2HA GLY 19 1HA GLY 19 9.794 6.764 -4.194
147 H THR 20 H THR 20 10.003 6.220 -2.022
148 HA THR 20 HA THR 20 8.332 3.962 -1.144
149 HB THR 20 HB THR 20 10.854 4.916 0.226
150 HG1 THR 20 1HG THR 20 10.581 2.399 -1.044
151 1HG2 THR 20 1HG2 THR 20 9.169 3.921 1.730
152 2HG2 THR 20 2HG2 THR 20 10.613 2.919 1.600
153 3HG2 THR 20 3HG2 THR 20 9.148 2.469 0.727
154 H TRP 21 H TRP 21 6.815 4.455 0.342
155 HA TRP 21 HA TRP 21 6.925 7.130 1.586
156 1HB TRP 21 2HB TRP 21 4.443 5.621 0.735
157 2HB TRP 21 1HB TRP 21 4.490 7.226 1.457
158 HD1 TRP 21 HD TRP 21 5.497 5.423 -1.811
159 HE1 TRP 21 1HE TRP 21 5.482 7.146 -3.724
160 HE3 TRP 21 3HE TRP 21 4.548 9.643 0.920
161 HZ2 TRP 21 2HZ TRP 21 5.111 9.934 -4.029
162 HZ3 TRP 21 3HZ TRP 21 4.379 11.799 -0.259
163 HH2 TRP 21 HH TRP 21 4.654 11.939 -2.683
164 H ASP 22 H ASP 22 6.094 7.318 3.700
165 HA ASP 22 HA ASP 22 5.980 4.761 5.163
166 1HB ASP 22 2HB ASP 22 7.779 6.066 5.993
167 2HB ASP 22 1HB ASP 22 6.811 7.534 6.018
168 H GLU 23 H GLU 23 4.169 4.148 6.089
169 HA GLU 23 HA GLU 23 1.808 5.811 5.929
170 1HB GLU 23 2HB GLU 23 2.226 3.038 7.064
171 2HB GLU 23 1HB GLU 23 0.666 3.826 6.889
172 1HG GLU 23 2HG GLU 23 0.910 3.843 4.483
173 2HG GLU 23 1HG GLU 23 2.520 3.133 4.621
174 H GLY 24 H GLY 24 4.245 5.192 8.213
175 1HA GLY 24 2HA GLY 24 4.396 6.272 10.324
176 2HA GLY 24 1HA GLY 24 2.641 6.417 10.350
177 H ARG 25 H ARG 25 1.619 4.076 10.062
178 HA ARG 25 HA ARG 25 3.000 1.854 11.136
179 1HB ARG 25 2HB ARG 25 2.633 3.215 13.214
180 2HB ARG 25 1HB ARG 25 0.903 3.066 12.949
181 1HG ARG 25 2HG ARG 25 1.081 0.634 13.157
182 2HG ARG 25 1HG ARG 25 2.819 0.788 13.419
183 1HD ARG 25 2HD ARG 25 0.666 1.967 15.172
184 2HD ARG 25 1HD ARG 25 1.584 0.503 15.518
185 HE ARG 25 HE ARG 25 3.529 2.340 15.207
186 1HH1 ARG 25 1HH1 ARG 25 0.569 2.326 17.089
187 2HH1 ARG 25 2HH1 ARG 25 1.233 3.300 18.367
188 1HH2 ARG 25 1HH2 ARG 25 4.399 3.637 16.876
189 2HH2 ARG 25 2HH2 ARG 25 3.395 4.057 18.238
190 H ALA 26 H ALA 26 1.722 -0.046 11.019
191 HA ALA 26 HA ALA 26 -1.000 0.209 10.012
192 1HB ALA 26 1HB ALA 26 -0.548 -1.160 8.039
193 2HB ALA 26 2HB ALA 26 1.169 -1.199 8.448
194 3HB ALA 26 3HB ALA 26 0.401 0.326 8.006
195 HA PRO 27 HA PRO 27 -1.551 -3.656 12.188
196 1HB PRO 27 2HB PRO 27 -3.434 -4.473 10.075
197 2HB PRO 27 1HB PRO 27 -3.732 -4.194 11.794
198 1HG PRO 27 2HG PRO 27 -4.641 -2.503 9.914
199 2HG PRO 27 1HG PRO 27 -4.091 -1.930 11.500
200 1HD PRO 27 2HD PRO 27 -2.657 -1.888 8.868
201 2HD PRO 27 1HD PRO 27 -2.739 -0.637 10.128
202 H GLY 28 H GLY 28 -0.510 -5.584 12.106
203 1HA GLY 28 2HA GLY 28 -0.006 -6.986 9.661
204 2HA GLY 28 1HA GLY 28 1.414 -6.124 10.238
205 HA PRO 29 HA PRO 29 1.709 -10.342 12.121
206 1HB PRO 29 2HB PRO 29 4.419 -9.906 12.604
207 2HB PRO 29 1HB PRO 29 3.748 -10.767 11.218
208 1HG PRO 29 2HG PRO 29 4.684 -7.947 11.427
209 2HG PRO 29 1HG PRO 29 4.824 -9.080 10.070
210 1HD PRO 29 2HD PRO 29 3.019 -7.100 10.062
211 2HD PRO 29 1HD PRO 29 2.649 -8.691 9.365
212 H THR 30 H THR 30 1.664 -10.817 14.251
213 HA THR 30 HA THR 30 1.377 -8.583 16.046
214 HB THR 30 HB THR 30 0.931 -10.613 17.662
215 HG1 THR 30 1HG THR 30 0.197 -11.836 15.218
216 1HG2 THR 30 1HG2 THR 30 -1.406 -10.610 16.911
217 2HG2 THR 30 2HG2 THR 30 -0.913 -9.833 15.405
218 3HG2 THR 30 3HG2 THR 30 -0.734 -8.979 16.940
219 H ASP 31 H ASP 31 4.080 -9.730 15.048
220 HA ASP 31 HA ASP 31 5.438 -10.363 17.501
221 1HB ASP 31 2HB ASP 31 6.171 -11.216 15.248
222 2HB ASP 31 1HB ASP 31 6.669 -9.571 14.858
223 H GLY 32 H GLY 32 4.816 -7.542 15.554
224 1HA GLY 32 2HA GLY 32 4.728 -5.488 17.026
225 2HA GLY 32 1HA GLY 32 6.373 -5.921 17.466
226 H VAL 33 H VAL 33 4.323 -4.523 15.041
227 HA VAL 33 HA VAL 33 6.683 -3.794 13.435
228 HB VAL 33 HB VAL 33 3.830 -3.170 12.710
229 1HG1 VAL 33 1HG1 VAL 33 6.320 -3.507 11.059
230 2HG1 VAL 33 2HG1 VAL 33 5.504 -1.993 11.447
231 3HG1 VAL 33 3HG1 VAL 33 4.709 -3.184 10.419
232 1HG2 VAL 33 1HG2 VAL 33 5.312 -5.694 11.989
233 2HG2 VAL 33 2HG2 VAL 33 3.730 -5.212 11.381
234 3HG2 VAL 33 3HG2 VAL 33 3.942 -5.586 13.092
235 H LYS 34 H LYS 34 7.412 -1.726 13.446
236 HA LYS 34 HA LYS 34 6.155 0.137 15.272
237 1HB LYS 34 2HB LYS 34 8.740 0.139 13.729
238 2HB LYS 34 1HB LYS 34 8.199 1.531 14.652
239 1HG LYS 34 2HG LYS 34 8.569 -1.206 15.832
240 2HG LYS 34 1HG LYS 34 9.811 0.046 15.834
241 1HD LYS 34 2HD LYS 34 8.372 1.518 17.111
242 2HD LYS 34 1HD LYS 34 7.056 0.347 17.023
243 1HE LYS 34 2HE LYS 34 8.359 -1.244 18.321
244 2HE LYS 34 1HE LYS 34 9.709 -0.108 18.375
245 1HZ LYS 34 1HZ LYS 34 7.031 0.569 19.438
246 2HZ LYS 34 2HZ LYS 34 8.505 1.358 19.730
247 3HZ LYS 34 3HZ LYS 34 8.217 -0.180 20.388
248 H SER 35 H SER 35 6.706 -0.285 11.878
249 HA SER 35 HA SER 35 4.855 1.780 11.147
250 1HB SER 35 2HB SER 35 7.783 2.164 10.460
251 2HB SER 35 1HB SER 35 6.452 3.135 9.839
252 HG SER 35 HG SER 35 5.992 3.676 12.068
253 H ALA 36 H ALA 36 4.684 1.935 8.755
254 HA ALA 36 HA ALA 36 5.588 -0.525 7.433
255 1HB ALA 36 1HB ALA 36 3.434 -0.712 6.295
256 2HB ALA 36 2HB ALA 36 2.836 0.690 7.186
257 3HB ALA 36 3HB ALA 36 3.238 -0.796 8.044
258 H THR 37 H THR 37 6.480 -0.222 5.498
259 HA THR 37 HA THR 37 6.182 2.433 4.274
260 HB THR 37 HB THR 37 8.575 2.058 3.432
261 HG1 THR 37 1HG THR 37 8.245 -0.179 4.873
262 1HG2 THR 37 1HG2 THR 37 9.559 2.999 5.476
263 2HG2 THR 37 2HG2 THR 37 8.112 2.545 6.378
264 3HG2 THR 37 3HG2 THR 37 8.011 3.752 5.096
265 H VAL 38 H VAL 38 5.655 2.442 2.186
266 HA VAL 38 HA VAL 38 5.663 -0.151 0.795
267 HB VAL 38 HB VAL 38 3.400 0.591 1.167
268 1HG1 VAL 38 1HG1 VAL 38 3.786 2.964 1.494
269 2HG1 VAL 38 2HG1 VAL 38 2.547 2.710 0.264
270 3HG1 VAL 38 3HG1 VAL 38 4.188 3.154 -0.211
271 1HG2 VAL 38 1HG2 VAL 38 4.239 1.012 -1.695
272 2HG2 VAL 38 2HG2 VAL 38 2.583 0.746 -1.150
273 3HG2 VAL 38 3HG2 VAL 38 3.795 -0.516 -0.938
274 H THR 39 H THR 39 6.839 -0.343 -0.965
275 HA THR 39 HA THR 39 7.952 2.102 -2.167
276 HB THR 39 HB THR 39 9.028 -0.730 -2.270
277 HG1 THR 39 1HG THR 39 9.530 -0.020 -0.272
278 1HG2 THR 39 1HG2 THR 39 11.028 0.289 -3.262
279 2HG2 THR 39 2HG2 THR 39 10.232 1.863 -3.253
280 3HG2 THR 39 3HG2 THR 39 9.606 0.564 -4.270
281 H PHE 40 H PHE 40 7.445 2.571 -4.231
282 HA PHE 40 HA PHE 40 5.712 0.655 -5.625
283 1HB PHE 40 2HB PHE 40 6.070 3.638 -5.960
284 2HB PHE 40 1HB PHE 40 5.070 2.648 -7.017
285 HD1 PHE 40 1HD PHE 40 3.058 1.526 -6.115
286 HD2 PHE 40 2HD PHE 40 5.303 4.330 -3.830
287 HE1 PHE 40 1HE PHE 40 1.149 1.808 -4.590
288 HE2 PHE 40 2HE PHE 40 3.402 4.604 -2.295
289 HZ PHE 40 HZ PHE 40 1.320 3.343 -2.672
290 H THR 41 H THR 41 6.581 -0.511 -7.127
291 HA THR 41 HA THR 41 8.937 0.450 -8.588
292 HB THR 41 HB THR 41 7.865 -2.372 -8.671
293 HG1 THR 41 1HG THR 41 8.496 -1.211 -6.456
294 1HG2 THR 41 1HG2 THR 41 10.394 -2.800 -8.828
295 2HG2 THR 41 2HG2 THR 41 10.543 -1.068 -9.134
296 3HG2 THR 41 3HG2 THR 41 9.609 -2.084 -10.232
297 H GLU 42 H GLU 42 8.818 -0.716 -10.962
298 HA GLU 42 HA GLU 42 7.273 0.783 -12.566
299 1HB GLU 42 2HB GLU 42 8.022 -2.088 -13.121
300 2HB GLU 42 1HB GLU 42 7.736 -0.824 -14.296
301 1HG GLU 42 2HG GLU 42 9.985 -0.829 -12.307
302 2HG GLU 42 1HG GLU 42 10.120 -1.334 -13.989
303 H ASP 43 H ASP 43 6.476 -2.659 -11.971
304 HA ASP 43 HA ASP 43 3.639 -1.941 -12.318
305 1HB ASP 43 2HB ASP 43 3.254 -3.942 -13.609
306 2HB ASP 43 1HB ASP 43 4.557 -3.029 -14.356
307 H GLU 44 H GLU 44 5.653 -2.764 -10.043
308 HA GLU 44 HA GLU 44 3.777 -4.628 -8.777
309 1HB GLU 44 2HB GLU 44 6.784 -4.887 -8.721
310 2HB GLU 44 1HB GLU 44 5.662 -5.878 -7.796
311 1HG GLU 44 2HG GLU 44 4.711 -6.754 -9.843
312 2HG GLU 44 1HG GLU 44 5.771 -5.717 -10.792
313 H VAL 45 H VAL 45 3.452 -4.373 -6.650
314 HA VAL 45 HA VAL 45 4.595 -1.990 -5.382
315 HB VAL 45 HB VAL 45 2.290 -3.748 -4.509
316 1HG1 VAL 45 1HG1 VAL 45 3.379 -2.694 -2.606
317 2HG1 VAL 45 2HG1 VAL 45 1.802 -1.958 -2.893
318 3HG1 VAL 45 3HG1 VAL 45 3.272 -1.120 -3.394
319 1HG2 VAL 45 1HG2 VAL 45 0.875 -1.854 -5.148
320 2HG2 VAL 45 2HG2 VAL 45 1.753 -2.513 -6.526
321 3HG2 VAL 45 3HG2 VAL 45 2.291 -1.011 -5.773
322 H VAL 46 H VAL 46 6.095 -2.155 -3.834
323 HA VAL 46 HA VAL 46 6.684 -4.825 -2.757
324 HB VAL 46 HB VAL 46 8.424 -2.356 -2.688
325 1HG1 VAL 46 1HG1 VAL 46 8.888 -3.917 -0.879
326 2HG1 VAL 46 2HG1 VAL 46 10.211 -3.900 -2.046
327 3HG1 VAL 46 3HG1 VAL 46 9.054 -5.233 -2.040
328 1HG2 VAL 46 1HG2 VAL 46 8.560 -4.746 -4.524
329 2HG2 VAL 46 2HG2 VAL 46 9.759 -3.453 -4.435
330 3HG2 VAL 46 3HG2 VAL 46 8.118 -3.101 -4.981
331 H GLU 47 H GLU 47 6.058 -5.236 -0.752
332 HA GLU 47 HA GLU 47 5.429 -3.030 1.038
333 1HB GLU 47 2HB GLU 47 4.817 -5.955 1.064
334 2HB GLU 47 1HB GLU 47 4.678 -5.002 2.529
335 1HG GLU 47 2HG GLU 47 2.946 -3.732 1.704
336 2HG GLU 47 1HG GLU 47 3.336 -4.114 0.032
337 H THR 48 H THR 48 6.644 -2.448 2.603
338 HA THR 48 HA THR 48 8.712 -4.282 3.597
339 HB THR 48 HB THR 48 9.693 -1.701 4.037
340 HG1 THR 48 1HG THR 48 8.185 -1.024 2.366
341 1HG2 THR 48 1HG2 THR 48 10.440 -3.732 1.927
342 2HG2 THR 48 2HG2 THR 48 11.039 -3.684 3.584
343 3HG2 THR 48 3HG2 THR 48 11.457 -2.393 2.455
344 H GLU 49 H GLU 49 8.288 -4.747 5.632
345 HA GLU 49 HA GLU 49 6.826 -2.785 7.262
346 1HB GLU 49 2HB GLU 49 7.298 -5.730 7.784
347 2HB GLU 49 1HB GLU 49 6.270 -4.659 8.726
348 1HG GLU 49 2HG GLU 49 4.784 -4.386 6.824
349 2HG GLU 49 1HG GLU 49 5.828 -5.416 5.847
350 H VAL 50 H VAL 50 7.742 -1.904 9.043
351 HA VAL 50 HA VAL 50 10.510 -2.712 9.635
352 HB VAL 50 HB VAL 50 9.024 -0.236 10.563
353 1HG1 VAL 50 1HG1 VAL 50 11.229 0.576 11.226
354 2HG1 VAL 50 2HG1 VAL 50 11.949 -0.947 10.708
355 3HG1 VAL 50 3HG1 VAL 50 10.822 -0.925 12.063
356 1HG2 VAL 50 1HG2 VAL 50 10.421 0.983 8.929
357 2HG2 VAL 50 2HG2 VAL 50 9.331 -0.167 8.152
358 3HG2 VAL 50 3HG2 VAL 50 11.041 -0.559 8.339
359 H MET 51 H MET 51 10.673 -4.151 11.194
360 HA MET 51 HA MET 51 8.600 -4.186 13.277
361 1HB MET 51 2HB MET 51 10.093 -6.433 11.936
362 2HB MET 51 1HB MET 51 9.089 -6.652 13.358
363 1HG MET 51 2HG MET 51 7.138 -5.903 12.127
364 2HG MET 51 1HG MET 51 8.136 -5.605 10.706
365 1HE MET 51 1HE MET 51 7.377 -9.804 12.467
366 2HE MET 51 2HE MET 51 6.647 -8.334 13.111
367 3HE MET 51 3HE MET 51 8.386 -8.588 13.250
368 H GLU 52 H GLU 52 9.207 -4.277 15.362
369 HA GLU 52 HA GLU 52 11.849 -3.476 15.986
370 1HB GLU 52 2HB GLU 52 11.021 -3.611 18.332
371 2HB GLU 52 1HB GLU 52 10.038 -2.612 17.284
372 1HG GLU 52 2HG GLU 52 8.385 -4.360 17.111
373 2HG GLU 52 1HG GLU 52 9.404 -5.451 18.050
374 H GLY 53 H GLY 53 13.537 -4.744 16.107
375 1HA GLY 53 2HA GLY 53 14.776 -6.478 17.163
376 2HA GLY 53 1HA GLY 53 13.275 -7.357 17.431
377 H ARG 54 H ARG 54 12.766 -6.415 14.483
378 HA ARG 54 HA ARG 54 13.986 -8.810 13.290
379 1HB ARG 54 2HB ARG 54 11.710 -7.208 12.154
380 2HB ARG 54 1HB ARG 54 12.169 -8.863 11.788
381 1HG ARG 54 2HG ARG 54 11.367 -8.251 14.564
382 2HG ARG 54 1HG ARG 54 10.114 -8.253 13.327
383 1HD ARG 54 2HD ARG 54 10.195 -10.441 14.263
384 2HD ARG 54 1HD ARG 54 10.912 -10.532 12.655
385 HE ARG 54 HE ARG 54 13.058 -10.749 13.664
386 1HH1 ARG 54 1HH1 ARG 54 10.396 -10.732 15.946
387 2HH1 ARG 54 2HH1 ARG 54 11.273 -11.609 17.168
388 1HH2 ARG 54 1HH2 ARG 54 14.221 -11.875 15.273
389 2HH2 ARG 54 2HH2 ARG 54 13.464 -12.232 16.799
390 H GLY 55 H GLY 55 12.931 -5.552 12.402
391 1HA GLY 55 2HA GLY 55 14.515 -4.006 11.325
392 2HA GLY 55 1HA GLY 55 15.167 -5.401 10.467
393 H GLU 56 H GLU 56 14.649 -3.892 8.581
394 HA GLU 56 HA GLU 56 11.914 -3.729 7.802
395 1HB GLU 56 2HB GLU 56 14.454 -3.455 6.187
396 2HB GLU 56 1HB GLU 56 12.841 -3.068 5.614
397 1HG GLU 56 2HG GLU 56 13.640 -1.022 6.208
398 2HG GLU 56 1HG GLU 56 12.754 -1.483 7.646
399 H VAL 57 H VAL 57 10.723 -5.148 6.864
400 HA VAL 57 HA VAL 57 11.969 -7.601 5.801
401 HB VAL 57 HB VAL 57 9.280 -7.217 7.130
402 1HG1 VAL 57 1HG1 VAL 57 9.068 -8.827 5.316
403 2HG1 VAL 57 2HG1 VAL 57 8.996 -9.654 6.871
404 3HG1 VAL 57 3HG1 VAL 57 10.473 -9.711 5.912
405 1HG2 VAL 57 1HG2 VAL 57 10.166 -8.762 8.819
406 2HG2 VAL 57 2HG2 VAL 57 11.120 -7.283 8.703
407 3HG2 VAL 57 3HG2 VAL 57 11.716 -8.774 7.978
408 H GLN 58 H GLN 58 11.773 -7.813 3.655
409 HA GLN 58 HA GLN 58 9.823 -6.261 2.195
410 1HB GLN 58 2HB GLN 58 11.914 -8.199 1.196
411 2HB GLN 58 1HB GLN 58 10.997 -7.065 0.227
412 1HG GLN 58 2HG GLN 58 12.064 -5.202 1.419
413 2HG GLN 58 1HG GLN 58 13.011 -6.362 2.345
414 1HE2 GLN 58 1HE2 GLN 58 13.328 -8.140 0.026
415 2HE2 GLN 58 2HE2 GLN 58 14.508 -7.379 -0.981
416 H LEU 59 H LEU 59 7.912 -7.027 1.659
417 HA LEU 59 HA LEU 59 7.331 -9.865 2.004
418 1HB LEU 59 2HB LEU 59 5.596 -7.442 1.536
419 2HB LEU 59 1HB LEU 59 4.961 -9.076 1.575
420 HG LEU 59 HG LEU 59 6.368 -7.692 3.852
421 1HD1 LEU 59 1HD1 LEU 59 4.158 -7.729 4.918
422 2HD1 LEU 59 2HD1 LEU 59 3.465 -8.376 3.431
423 3HD1 LEU 59 3HD1 LEU 59 4.167 -6.760 3.445
424 1HD2 LEU 59 1HD2 LEU 59 6.765 -10.094 3.858
425 2HD2 LEU 59 2HD2 LEU 59 5.031 -10.389 3.717
426 3HD2 LEU 59 3HD2 LEU 59 5.682 -9.631 5.169
427 HA PRO 60 HA PRO 60 7.119 -11.050 -2.239
428 1HB PRO 60 2HB PRO 60 4.503 -11.969 -2.486
429 2HB PRO 60 1HB PRO 60 5.874 -12.921 -1.913
430 1HG PRO 60 2HG PRO 60 3.743 -11.541 -0.364
431 2HG PRO 60 1HG PRO 60 4.570 -13.072 -0.025
432 1HD PRO 60 2HD PRO 60 5.148 -10.802 1.303
433 2HD PRO 60 1HD PRO 60 6.384 -12.020 0.951
434 H PHE 61 H PHE 61 6.804 -10.019 -4.099
435 HA PHE 61 HA PHE 61 5.780 -7.426 -4.098
436 1HB PHE 61 2HB PHE 61 6.286 -9.176 -6.505
437 2HB PHE 61 1HB PHE 61 6.229 -7.419 -6.482
438 HD1 PHE 61 1HD PHE 61 8.203 -10.374 -5.638
439 HD2 PHE 61 2HD PHE 61 8.063 -6.123 -5.597
440 HE1 PHE 61 1HE PHE 61 10.622 -10.303 -5.192
441 HE2 PHE 61 2HE PHE 61 10.479 -6.044 -5.148
442 HZ PHE 61 HZ PHE 61 11.765 -8.135 -4.946
443 H MET 62 H MET 62 3.870 -6.576 -4.512
444 HA MET 62 HA MET 62 1.666 -8.366 -5.230
445 1HB MET 62 2HB MET 62 1.743 -5.633 -3.962
446 2HB MET 62 1HB MET 62 0.254 -6.346 -4.559
447 1HG MET 62 2HG MET 62 1.997 -7.719 -2.538
448 2HG MET 62 1HG MET 62 0.746 -6.568 -2.085
449 1HE MET 62 1HE MET 62 1.623 -10.097 -3.330
450 2HE MET 62 2HE MET 62 0.865 -9.527 -4.817
451 3HE MET 62 3HE MET 62 0.078 -10.773 -3.852
452 H ALA 63 H ALA 63 1.010 -8.409 -7.249
453 HA ALA 63 HA ALA 63 1.831 -6.465 -9.179
454 1HB ALA 63 1HB ALA 63 -0.172 -8.707 -9.416
455 2HB ALA 63 2HB ALA 63 1.553 -8.819 -9.769
456 3HB ALA 63 3HB ALA 63 0.516 -7.787 -10.754
457 H TYR 64 H TYR 64 0.733 -4.708 -9.928
458 HA TYR 64 HA TYR 64 -2.079 -4.454 -9.126
459 1HB TYR 64 2HB TYR 64 -1.833 -2.207 -8.441
460 2HB TYR 64 1HB TYR 64 -0.510 -3.077 -7.679
461 HD1 TYR 64 2HD TYR 64 1.818 -2.764 -8.505
462 HD2 TYR 64 1HD TYR 64 -1.430 -0.470 -10.033
463 HE1 TYR 64 2HE TYR 64 3.411 -1.119 -9.412
464 HE2 TYR 64 1HE TYR 64 0.151 1.175 -10.946
465 HH TYR 64 HH TYR 64 3.502 0.605 -11.167
466 H LYS 65 H LYS 65 -3.326 -2.994 -10.419
467 HA LYS 65 HA LYS 65 -2.224 -2.503 -13.112
468 1HB LYS 65 2HB LYS 65 -4.937 -3.493 -12.275
469 2HB LYS 65 1HB LYS 65 -4.690 -2.696 -13.824
470 1HG LYS 65 2HG LYS 65 -3.035 -4.396 -14.416
471 2HG LYS 65 1HG LYS 65 -3.329 -5.200 -12.878
472 1HD LYS 65 2HD LYS 65 -5.503 -5.816 -13.478
473 2HD LYS 65 1HD LYS 65 -5.564 -4.641 -14.792
474 1HE LYS 65 2HE LYS 65 -3.804 -7.087 -14.717
475 2HE LYS 65 1HE LYS 65 -5.317 -6.943 -15.614
476 1HZ LYS 65 1HZ LYS 65 -3.524 -6.538 -17.102
477 2HZ LYS 65 2HZ LYS 65 -2.815 -5.403 -16.058
478 3HZ LYS 65 3HZ LYS 65 -4.289 -5.048 -16.818
479 H VAL 66 H VAL 66 -3.167 -0.736 -14.249
480 HA VAL 66 HA VAL 66 -3.914 1.438 -12.416
481 HB VAL 66 HB VAL 66 -2.728 1.525 -15.191
482 1HG1 VAL 66 1HG1 VAL 66 -4.216 3.418 -14.884
483 2HG1 VAL 66 2HG1 VAL 66 -2.540 3.964 -14.833
484 3HG1 VAL 66 3HG1 VAL 66 -3.460 3.796 -13.337
485 1HG2 VAL 66 1HG2 VAL 66 -1.134 0.836 -13.496
486 2HG2 VAL 66 2HG2 VAL 66 -1.552 2.231 -12.502
487 3HG2 VAL 66 3HG2 VAL 66 -0.757 2.464 -14.058
488 H ILE 67 H ILE 67 -6.011 1.808 -12.331
489 HA ILE 67 HA ILE 67 -7.781 1.021 -14.487
490 HB ILE 67 HB ILE 67 -8.552 2.601 -12.043
491 1HG1 ILE 67 2HG1 ILE 67 -8.352 -0.408 -12.282
492 2HG1 ILE 67 1HG1 ILE 67 -7.306 0.611 -11.306
493 1HG2 ILE 67 1HG2 ILE 67 -10.225 2.441 -13.804
494 2HG2 ILE 67 2HG2 ILE 67 -10.728 1.533 -12.379
495 3HG2 ILE 67 3HG2 ILE 67 -10.091 0.683 -13.787
496 1HD1 ILE 67 1HD1 ILE 67 -9.256 1.297 -9.974
497 2HD1 ILE 67 2HD1 ILE 67 -8.954 -0.437 -9.907
498 3HD1 ILE 67 3HD1 ILE 67 -10.255 0.192 -10.914
499 H SER 68 H SER 68 -6.988 4.005 -12.755
500 HA SER 68 HA SER 68 -7.499 5.555 -15.175
501 1HB SER 68 2HB SER 68 -8.627 6.480 -12.554
502 2HB SER 68 1HB SER 68 -9.037 7.014 -14.170
503 HG SER 68 HG SER 68 -9.680 4.584 -14.319
504 H GLN 69 H GLN 69 -6.458 7.575 -15.148
505 HA GLN 69 HA GLN 69 -4.774 8.273 -12.906
506 1HB GLN 69 2HB GLN 69 -3.415 6.635 -14.180
507 2HB GLN 69 1HB GLN 69 -3.525 7.669 -15.597
508 1HG GLN 69 2HG GLN 69 -2.384 9.454 -14.334
509 2HG GLN 69 1HG GLN 69 -2.224 8.349 -12.971
510 1HE2 GLN 69 1HE2 GLN 69 -1.905 7.351 -16.307
511 2HE2 GLN 69 2HE2 GLN 69 -0.208 7.026 -16.253
512 H SER 70 H SER 70 -4.635 10.347 -12.701
513 HA SER 70 HA SER 70 -5.436 12.100 -14.897
514 1HB SER 70 2HB SER 70 -6.308 12.413 -12.544
515 2HB SER 70 1HB SER 70 -4.673 12.828 -12.064
516 HG SER 70 HG SER 70 -4.756 14.662 -13.288
517 H THR 71 H THR 71 -2.723 10.884 -13.238
518 HA THR 71 HA THR 71 -0.508 10.957 -13.684
519 HB THR 71 HB THR 71 -1.124 12.953 -15.845
520 HG1 THR 71 1HG THR 71 -2.049 11.260 -16.743
521 1HG2 THR 71 1HG2 THR 71 1.003 12.201 -16.811
522 2HG2 THR 71 2HG2 THR 71 1.260 11.154 -15.417
523 3HG2 THR 71 3HG2 THR 71 1.238 12.905 -15.210
524 H ASP 72 H ASP 72 -2.221 13.995 -13.426
525 HA ASP 72 HA ASP 72 0.204 15.283 -12.416
526 1HB ASP 72 2HB ASP 72 -0.770 17.365 -12.941
527 2HB ASP 72 1HB ASP 72 -1.202 16.308 -14.280
528 H GLY 73 H GLY 73 -2.489 13.735 -11.158
529 1HA GLY 73 2HA GLY 73 -1.950 14.907 -8.566
530 2HA GLY 73 1HA GLY 73 -3.536 15.285 -9.205
531 H SER 74 H SER 74 -4.348 12.930 -10.308
532 HA SER 74 HA SER 74 -4.464 11.232 -7.911
533 1HB SER 74 2HB SER 74 -6.831 10.712 -8.878
534 2HB SER 74 1HB SER 74 -6.561 12.196 -7.969
535 HG SER 74 HG SER 74 -7.493 12.964 -9.748
536 H ILE 75 H ILE 75 -4.425 9.082 -8.095
537 HA ILE 75 HA ILE 75 -4.486 7.862 -10.772
538 HB ILE 75 HB ILE 75 -2.491 7.045 -8.645
539 1HG1 ILE 75 2HG1 ILE 75 -2.054 8.720 -11.126
540 2HG1 ILE 75 1HG1 ILE 75 -1.868 9.255 -9.466
541 1HG2 ILE 75 1HG2 ILE 75 -2.837 6.235 -11.530
542 2HG2 ILE 75 2HG2 ILE 75 -3.110 5.235 -10.101
543 3HG2 ILE 75 3HG2 ILE 75 -1.478 5.765 -10.507
544 1HD1 ILE 75 1HD1 ILE 75 0.001 7.739 -9.170
545 2HD1 ILE 75 2HD1 ILE 75 0.276 8.841 -10.520
546 3HD1 ILE 75 3HD1 ILE 75 -0.191 7.168 -10.828
547 H GLU 76 H GLU 76 -5.651 5.957 -10.823
548 HA GLU 76 HA GLU 76 -6.464 4.845 -8.217
549 1HB GLU 76 2HB GLU 76 -8.266 5.967 -9.717
550 2HB GLU 76 1HB GLU 76 -8.101 4.528 -10.713
551 1HG GLU 76 2HG GLU 76 -8.726 3.109 -8.880
552 2HG GLU 76 1HG GLU 76 -8.763 4.486 -7.783
553 H ILE 77 H ILE 77 -5.895 2.805 -7.858
554 HA ILE 77 HA ILE 77 -5.001 1.189 -10.155
555 HB ILE 77 HB ILE 77 -3.171 0.281 -8.726
556 1HG1 ILE 77 2HG1 ILE 77 -3.879 2.601 -6.907
557 2HG1 ILE 77 1HG1 ILE 77 -4.151 0.903 -6.537
558 1HG2 ILE 77 1HG2 ILE 77 -1.676 2.194 -9.011
559 2HG2 ILE 77 2HG2 ILE 77 -3.070 3.256 -9.216
560 3HG2 ILE 77 3HG2 ILE 77 -2.738 1.997 -10.407
561 1HD1 ILE 77 1HD1 ILE 77 -1.478 2.213 -6.960
562 2HD1 ILE 77 2HD1 ILE 77 -1.740 0.508 -6.599
563 3HD1 ILE 77 3HD1 ILE 77 -2.175 1.739 -5.412
564 H GLN 78 H GLN 78 -5.000 -1.095 -9.822
565 HA GLN 78 HA GLN 78 -6.891 -1.984 -7.741
566 1HB GLN 78 2HB GLN 78 -7.986 -1.884 -9.932
567 2HB GLN 78 1HB GLN 78 -6.719 -2.876 -10.627
568 1HG GLN 78 2HG GLN 78 -7.408 -4.767 -9.312
569 2HG GLN 78 1HG GLN 78 -8.592 -3.779 -8.455
570 1HE2 GLN 78 1HE2 GLN 78 -10.511 -3.235 -9.460
571 2HE2 GLN 78 2HE2 GLN 78 -11.036 -3.966 -10.937
572 H TYR 79 H TYR 79 -6.501 -4.074 -6.872
573 HA TYR 79 HA TYR 79 -3.724 -4.911 -7.098
574 1HB TYR 79 2HB TYR 79 -5.921 -6.079 -5.386
575 2HB TYR 79 1HB TYR 79 -4.203 -6.413 -5.250
576 HD1 TYR 79 1HD TYR 79 -3.022 -3.714 -5.320
577 HD2 TYR 79 2HD TYR 79 -6.551 -5.123 -3.410
578 HE1 TYR 79 1HE TYR 79 -2.806 -1.944 -3.618
579 HE2 TYR 79 2HE TYR 79 -6.350 -3.362 -1.713
580 HH TYR 79 HH TYR 79 -4.511 -0.701 -2.001
581 H LEU 80 H LEU 80 -3.070 -7.009 -7.666
582 HA LEU 80 HA LEU 80 -5.109 -8.668 -8.995
583 1HB LEU 80 2HB LEU 80 -2.125 -8.534 -9.469
584 2HB LEU 80 1HB LEU 80 -3.205 -9.678 -10.240
585 HG LEU 80 HG LEU 80 -3.323 -6.677 -10.568
586 1HD1 LEU 80 1HD1 LEU 80 -1.368 -7.605 -11.654
587 2HD1 LEU 80 2HD1 LEU 80 -2.570 -7.149 -12.863
588 3HD1 LEU 80 3HD1 LEU 80 -2.357 -8.845 -12.429
589 1HD2 LEU 80 1HD2 LEU 80 -5.516 -7.707 -10.752
590 2HD2 LEU 80 2HD2 LEU 80 -4.885 -8.880 -11.909
591 3HD2 LEU 80 3HD2 LEU 80 -4.946 -7.170 -12.331
592 H GLY 81 H GLY 81 -4.617 -11.066 -8.825
593 1HA GLY 81 2HA GLY 81 -3.852 -12.901 -7.552
594 2HA GLY 81 1HA GLY 81 -3.195 -11.775 -6.372
595 HA PRO 82 HA PRO 82 -6.995 -13.526 -4.383
596 1HB PRO 82 2HB PRO 82 -5.433 -12.760 -1.990
597 2HB PRO 82 1HB PRO 82 -6.238 -14.285 -2.365
598 1HG PRO 82 2HG PRO 82 -3.581 -14.082 -2.438
599 2HG PRO 82 1HG PRO 82 -4.458 -15.069 -3.623
600 1HD PRO 82 2HD PRO 82 -3.280 -12.333 -3.935
601 2HD PRO 82 1HD PRO 82 -3.273 -13.698 -5.072
602 H TYR 83 H TYR 83 -5.449 -10.523 -4.504
603 HA TYR 83 HA TYR 83 -7.543 -9.180 -2.940
604 1HB TYR 83 2HB TYR 83 -4.961 -8.030 -4.023
605 2HB TYR 83 1HB TYR 83 -6.068 -7.250 -2.901
606 HD1 TYR 83 2HD TYR 83 -3.515 -9.866 -3.282
607 HD2 TYR 83 1HD TYR 83 -6.041 -7.800 -0.548
608 HE1 TYR 83 2HE TYR 83 -2.218 -10.779 -1.407
609 HE2 TYR 83 1HE TYR 83 -4.745 -8.708 1.336
610 HH TYR 83 HH TYR 83 -1.737 -10.364 0.863
611 H TYR 84 H TYR 84 -7.608 -10.317 -5.744
612 HA TYR 84 HA TYR 84 -7.530 -8.362 -7.716
613 1HB TYR 84 2HB TYR 84 -8.713 -9.941 -9.088
614 2HB TYR 84 1HB TYR 84 -7.623 -10.845 -8.044
615 HD1 TYR 84 2HD TYR 84 -8.883 -11.467 -5.665
616 HD2 TYR 84 1HD TYR 84 -10.731 -10.917 -9.457
617 HE1 TYR 84 2HE TYR 84 -10.769 -12.868 -4.948
618 HE2 TYR 84 1HE TYR 84 -12.623 -12.309 -8.746
619 HH TYR 84 HH TYR 84 -12.900 -14.247 -6.952
620 HA PRO 85 HA PRO 85 -10.269 -5.685 -9.066
621 1HB PRO 85 2HB PRO 85 -12.653 -7.243 -8.151
622 2HB PRO 85 1HB PRO 85 -12.567 -6.008 -9.421
623 1HG PRO 85 2HG PRO 85 -12.109 -8.739 -9.815
624 2HG PRO 85 1HG PRO 85 -11.584 -7.443 -10.904
625 1HD PRO 85 2HD PRO 85 -9.868 -9.165 -9.492
626 2HD PRO 85 1HD PRO 85 -9.393 -7.603 -10.203
627 H LEU 86 H LEU 86 -10.105 -6.569 -5.783
628 HA LEU 86 HA LEU 86 -11.305 -4.133 -4.843
629 1HB LEU 86 2HB LEU 86 -10.796 -6.195 -3.421
630 2HB LEU 86 1HB LEU 86 -9.117 -5.696 -3.464
631 HG LEU 86 HG LEU 86 -10.538 -5.065 -1.415
632 1HD1 LEU 86 1HD1 LEU 86 -9.350 -2.983 -1.079
633 2HD1 LEU 86 2HD1 LEU 86 -8.962 -2.917 -2.799
634 3HD1 LEU 86 3HD1 LEU 86 -8.294 -4.204 -1.791
635 1HD2 LEU 86 1HD2 LEU 86 -11.494 -2.971 -3.347
636 2HD2 LEU 86 2HD2 LEU 86 -11.749 -2.941 -1.603
637 3HD2 LEU 86 3HD2 LEU 86 -12.478 -4.217 -2.578
638 H LYS 87 H LYS 87 -10.086 -2.224 -4.192
639 HA LYS 87 HA LYS 87 -7.593 -1.924 -5.672
640 1HB LYS 87 2HB LYS 87 -8.427 -0.130 -7.069
641 2HB LYS 87 1HB LYS 87 -9.360 -1.594 -7.339
642 1HG LYS 87 2HG LYS 87 -11.157 -0.721 -5.936
643 2HG LYS 87 1HG LYS 87 -10.220 0.749 -5.651
644 1HD LYS 87 2HD LYS 87 -10.215 1.173 -8.081
645 2HD LYS 87 1HD LYS 87 -11.234 -0.250 -8.304
646 1HE LYS 87 2HE LYS 87 -12.968 0.787 -6.917
647 2HE LYS 87 1HE LYS 87 -11.949 2.212 -6.715
648 1HZ LYS 87 1HZ LYS 87 -13.609 2.532 -8.443
649 2HZ LYS 87 2HZ LYS 87 -13.002 1.199 -9.298
650 3HZ LYS 87 3HZ LYS 87 -12.041 2.584 -9.099
651 H SER 88 H SER 88 -6.843 0.386 -5.642
652 HA SER 88 HA SER 88 -7.585 1.777 -3.186
653 1HB SER 88 2HB SER 88 -4.940 0.726 -4.022
654 2HB SER 88 1HB SER 88 -4.965 2.332 -3.312
655 HG SER 88 HG SER 88 -6.247 1.313 -1.594
656 H THR 89 H THR 89 -6.967 4.049 -3.229
657 HA THR 89 HA THR 89 -6.638 5.117 -5.949
658 HB THR 89 HB THR 89 -8.410 6.462 -3.932
659 HG1 THR 89 1HG THR 89 -9.027 4.369 -5.746
660 1HG2 THR 89 1HG2 THR 89 -7.621 7.774 -5.843
661 2HG2 THR 89 2HG2 THR 89 -9.361 7.509 -5.929
662 3HG2 THR 89 3HG2 THR 89 -8.274 6.564 -6.947
663 H LEU 90 H LEU 90 -5.444 6.986 -6.087
664 HA LEU 90 HA LEU 90 -4.077 7.809 -3.611
665 1HB LEU 90 2HB LEU 90 -2.892 7.536 -6.376
666 2HB LEU 90 1HB LEU 90 -2.049 8.173 -4.976
667 HG LEU 90 HG LEU 90 -3.092 5.351 -5.234
668 1HD1 LEU 90 1HD1 LEU 90 -0.277 6.408 -5.417
669 2HD1 LEU 90 2HD1 LEU 90 -1.239 5.782 -6.758
670 3HD1 LEU 90 3HD1 LEU 90 -0.755 4.710 -5.444
671 1HD2 LEU 90 1HD2 LEU 90 -1.381 6.658 -3.122
672 2HD2 LEU 90 2HD2 LEU 90 -1.755 4.937 -3.218
673 3HD2 LEU 90 3HD2 LEU 90 -3.044 6.104 -2.926
674 H LYS 91 H LYS 91 -4.338 9.863 -3.137
675 HA LYS 91 HA LYS 91 -4.764 11.777 -5.346
676 1HB LYS 91 2HB LYS 91 -5.570 12.110 -2.451
677 2HB LYS 91 1HB LYS 91 -5.849 13.263 -3.737
678 1HG LYS 91 2HG LYS 91 -7.009 10.505 -3.667
679 2HG LYS 91 1HG LYS 91 -7.837 11.944 -3.085
680 1HD LYS 91 2HD LYS 91 -7.481 12.905 -5.407
681 2HD LYS 91 1HD LYS 91 -7.009 11.277 -5.898
682 1HE LYS 91 2HE LYS 91 -9.652 12.049 -4.659
683 2HE LYS 91 1HE LYS 91 -9.376 11.727 -6.369
684 1HZ LYS 91 1HZ LYS 91 -8.873 9.459 -5.874
685 2HZ LYS 91 2HZ LYS 91 -10.343 9.835 -5.124
686 3HZ LYS 91 3HZ LYS 91 -8.924 9.734 -4.202
687 H ARG 92 H ARG 92 -3.976 14.032 -4.681
688 HA ARG 92 HA ARG 92 -1.203 13.720 -3.866
689 1HB ARG 92 2HB ARG 92 -0.888 15.938 -4.837
690 2HB ARG 92 1HB ARG 92 -1.650 14.845 -5.980
691 1HG ARG 92 2HG ARG 92 -3.836 15.820 -5.350
692 2HG ARG 92 1HG ARG 92 -2.973 17.002 -4.374
693 1HD ARG 92 2HD ARG 92 -1.794 17.786 -6.373
694 2HD ARG 92 1HD ARG 92 -2.667 16.606 -7.349
695 HE ARG 92 HE ARG 92 -3.811 18.989 -6.068
696 1HH1 ARG 92 1HH1 ARG 92 -4.121 16.294 -8.269
697 2HH1 ARG 92 2HH1 ARG 92 -5.611 16.850 -8.964
698 1HH2 ARG 92 1HH2 ARG 92 -5.769 19.739 -6.965
699 2HH2 ARG 92 2HH2 ARG 92 -6.550 18.817 -8.214
700 H GLY 93 H GLY 93 -0.245 14.888 -2.212
701 1HA GLY 93 2HA GLY 93 -2.142 15.987 -0.266
702 2HA GLY 93 1HA GLY 93 -0.560 15.320 0.117
703 H GLU 94 H GLU 94 -1.921 17.959 0.551
704 HA GLU 94 HA GLU 94 -0.865 19.967 -1.058
705 1HB GLU 94 2HB GLU 94 -1.608 20.145 1.855
706 2HB GLU 94 1HB GLU 94 -1.535 21.474 0.711
707 1HG GLU 94 2HG GLU 94 -3.418 20.698 -0.472
708 2HG GLU 94 1HG GLU 94 -3.381 19.140 0.355
709 H ASN 95 H ASN 95 0.444 18.369 1.727
710 HA ASN 95 HA ASN 95 2.624 20.304 1.942
711 1HB ASN 95 2HB ASN 95 1.752 18.039 3.744
712 2HB ASN 95 1HB ASN 95 3.151 19.060 4.058
713 1HD2 ASN 95 1HD2 ASN 95 0.643 18.672 5.569
714 2HD2 ASN 95 2HD2 ASN 95 -0.015 20.255 5.767
715 H GLY 96 H GLY 96 2.402 18.283 -0.238
716 1HA GLY 96 2HA GLY 96 3.956 17.061 -1.444
717 2HA GLY 96 1HA GLY 96 5.119 17.353 -0.155
718 H THR 97 H THR 97 1.941 15.855 0.010
719 HA THR 97 HA THR 97 3.223 13.386 0.941
720 HB THR 97 HB THR 97 1.085 13.068 2.297
721 HG1 THR 97 1HG THR 97 -0.249 14.762 2.540
722 1HG2 THR 97 1HG2 THR 97 1.891 14.427 4.154
723 2HG2 THR 97 2HG2 THR 97 2.872 15.385 3.047
724 3HG2 THR 97 3HG2 THR 97 3.246 13.682 3.305
725 H LEU 98 H LEU 98 1.576 11.505 0.834
726 HA LEU 98 HA LEU 98 0.020 11.723 -1.659
727 1HB LEU 98 2HB LEU 98 2.072 10.276 -1.808
728 2HB LEU 98 1HB LEU 98 1.359 9.233 -0.594
729 HG LEU 98 HG LEU 98 -0.543 8.796 -2.151
730 1HD1 LEU 98 1HD1 LEU 98 -0.294 9.412 -4.506
731 2HD1 LEU 98 2HD1 LEU 98 1.172 10.312 -4.118
732 3HD1 LEU 98 3HD1 LEU 98 -0.382 10.844 -3.477
733 1HD2 LEU 98 1HD2 LEU 98 0.717 7.322 -3.644
734 2HD2 LEU 98 2HD2 LEU 98 1.336 7.244 -1.994
735 3HD2 LEU 98 3HD2 LEU 98 2.206 8.163 -3.223
736 H ILE 99 H ILE 99 -2.091 11.189 -1.499
737 HA ILE 99 HA ILE 99 -3.014 10.289 1.136
738 HB ILE 99 HB ILE 99 -4.605 11.490 -1.129
739 1HG1 ILE 99 2HG1 ILE 99 -3.686 12.702 1.484
740 2HG1 ILE 99 1HG1 ILE 99 -3.036 13.084 -0.107
741 1HG2 ILE 99 1HG2 ILE 99 -5.949 10.003 0.259
742 2HG2 ILE 99 2HG2 ILE 99 -6.413 11.686 0.516
743 3HG2 ILE 99 3HG2 ILE 99 -5.411 10.855 1.706
744 1HD1 ILE 99 1HD1 ILE 99 -5.170 14.010 -0.785
745 2HD1 ILE 99 2HD1 ILE 99 -4.586 14.793 0.685
746 3HD1 ILE 99 3HD1 ILE 99 -5.866 13.583 0.777
747 H TRP 100 H TRP 100 -3.371 8.212 1.337
748 HA TRP 100 HA TRP 100 -3.869 6.597 -1.055
749 1HB TRP 100 2HB TRP 100 -1.927 6.062 0.415
750 2HB TRP 100 1HB TRP 100 -3.049 5.737 1.727
751 HD1 TRP 100 HD TRP 100 -4.423 4.409 -1.452
752 HE1 TRP 100 1HE TRP 100 -4.060 1.862 -1.584
753 HE3 TRP 100 3HE TRP 100 -1.107 3.861 2.395
754 HZ2 TRP 100 2HZ TRP 100 -2.556 -0.112 -0.245
755 HZ3 TRP 100 3HZ TRP 100 -0.252 1.611 2.900
756 HH2 TRP 100 HH TRP 100 -0.962 -0.332 1.608
757 H GLU 101 H GLU 101 -5.945 6.198 -1.446
758 HA GLU 101 HA GLU 101 -7.778 5.783 0.799
759 1HB GLU 101 2HB GLU 101 -8.197 6.146 -2.163
760 2HB GLU 101 1HB GLU 101 -9.494 5.667 -1.086
761 1HG GLU 101 2HG GLU 101 -9.464 7.679 0.055
762 2HG GLU 101 1HG GLU 101 -7.862 8.097 -0.530
763 H GLN 102 H GLN 102 -8.435 3.872 1.357
764 HA GLN 102 HA GLN 102 -8.194 1.566 -0.393
765 1HB GLN 102 2HB GLN 102 -5.931 2.015 0.765
766 2HB GLN 102 1HB GLN 102 -6.727 1.473 2.235
767 1HG GLN 102 2HG GLN 102 -6.734 -0.220 -0.228
768 2HG GLN 102 1HG GLN 102 -5.352 -0.203 0.856
769 1HE2 GLN 102 1HE2 GLN 102 -7.148 -2.363 0.183
770 2HE2 GLN 102 2HE2 GLN 102 -7.843 -2.902 1.669
771 H ASN 103 H ASN 103 -9.929 0.346 -0.081
772 HA ASN 103 HA ASN 103 -11.663 -0.765 0.881
773 1HB ASN 103 2HB ASN 103 -9.813 -0.391 3.148
774 2HB ASN 103 1HB ASN 103 -11.486 -0.696 3.589
775 1HD2 ASN 103 1HD2 ASN 103 -9.062 -2.316 3.905
776 2HD2 ASN 103 2HD2 ASN 103 -9.445 -3.843 3.181
777 H GLY 104 H GLY 104 -11.119 2.473 1.340
778 1HA GLY 104 2HA GLY 104 -13.191 3.850 1.303
779 2HA GLY 104 1HA GLY 104 -13.734 2.862 2.652
780 H GLN 105 H GLN 105 -10.649 3.020 3.347
781 HA GLN 105 HA GLN 105 -10.983 5.318 5.112
782 1HB GLN 105 2HB GLN 105 -8.724 3.313 4.998
783 2HB GLN 105 1HB GLN 105 -9.029 4.479 6.278
784 1HG GLN 105 2HG GLN 105 -11.172 3.312 6.739
785 2HG GLN 105 1HG GLN 105 -10.704 2.087 5.560
786 1HE2 GLN 105 1HE2 GLN 105 -10.078 3.455 8.672
787 2HE2 GLN 105 2HE2 GLN 105 -9.071 2.182 9.272
788 H ARG 106 H ARG 106 -9.834 7.176 4.942
789 HA ARG 106 HA ARG 106 -7.956 7.395 2.717
790 1HB ARG 106 2HB ARG 106 -9.601 9.383 4.247
791 2HB ARG 106 1HB ARG 106 -8.217 9.902 3.298
792 1HG ARG 106 2HG ARG 106 -9.174 8.929 1.310
793 2HG ARG 106 1HG ARG 106 -10.539 8.316 2.237
794 1HD ARG 106 2HD ARG 106 -11.253 10.584 2.712
795 2HD ARG 106 1HD ARG 106 -9.841 11.224 1.866
796 HE ARG 106 HE ARG 106 -10.848 9.851 -0.103
797 1HH1 ARG 106 1HH1 ARG 106 -12.651 11.696 2.276
798 2HH1 ARG 106 2HH1 ARG 106 -13.993 11.990 1.202
799 1HH2 ARG 106 1HH2 ARG 106 -12.590 10.223 -1.487
800 2HH2 ARG 106 2HH2 ARG 106 -13.962 11.144 -0.946
801 H LYS 107 H LYS 107 -5.878 7.266 3.133
802 HA LYS 107 HA LYS 107 -4.987 7.867 5.872
803 1HB LYS 107 2HB LYS 107 -3.793 5.789 4.061
804 2HB LYS 107 1HB LYS 107 -3.450 6.059 5.770
805 1HG LYS 107 2HG LYS 107 -5.983 5.648 6.079
806 2HG LYS 107 1HG LYS 107 -5.862 4.900 4.500
807 1HD LYS 107 2HD LYS 107 -5.634 3.206 6.129
808 2HD LYS 107 1HD LYS 107 -4.050 3.455 5.399
809 1HE LYS 107 2HE LYS 107 -3.357 4.783 7.275
810 2HE LYS 107 1HE LYS 107 -4.968 4.699 7.983
811 1HZ LYS 107 1HZ LYS 107 -3.610 3.124 9.087
812 2HZ LYS 107 2HZ LYS 107 -3.033 2.474 7.637
813 3HZ LYS 107 3HZ LYS 107 -4.656 2.244 8.087
814 H THR 108 H THR 108 -3.109 8.943 6.148
815 HA THR 108 HA THR 108 -2.141 10.356 3.790
816 HB THR 108 HB THR 108 -2.830 11.774 5.632
817 HG1 THR 108 1HG THR 108 -0.416 12.551 6.061
818 1HG2 THR 108 1HG2 THR 108 -0.701 10.379 7.257
819 2HG2 THR 108 2HG2 THR 108 -2.444 10.242 7.493
820 3HG2 THR 108 3HG2 THR 108 -1.634 11.784 7.771
821 H MET 109 H MET 109 -0.326 9.827 2.836
822 HA MET 109 HA MET 109 1.611 8.138 4.266
823 1HB MET 109 2HB MET 109 1.452 8.740 1.302
824 2HB MET 109 1HB MET 109 2.445 7.514 2.079
825 1HG MET 109 2HG MET 109 0.563 6.193 2.613
826 2HG MET 109 1HG MET 109 -0.554 7.492 2.202
827 1HE MET 109 1HE MET 109 1.865 5.030 -0.855
828 2HE MET 109 2HE MET 109 1.855 4.731 0.884
829 3HE MET 109 3HE MET 109 2.635 6.177 0.240
830 H THR 110 H THR 110 3.622 8.891 4.713
831 HA THR 110 HA THR 110 4.177 11.669 3.996
832 HB THR 110 HB THR 110 5.992 11.438 5.730
833 HG1 THR 110 1HG THR 110 4.623 9.006 6.316
834 1HG2 THR 110 1HG2 THR 110 4.445 11.552 7.638
835 2HG2 THR 110 2HG2 THR 110 3.157 10.919 6.613
836 3HG2 THR 110 3HG2 THR 110 3.866 12.497 6.265
837 H ARG 111 H ARG 111 6.091 12.292 2.996
838 HA ARG 111 HA ARG 111 7.174 10.215 1.280
839 1HB ARG 111 2HB ARG 111 6.385 12.470 0.451
840 2HB ARG 111 1HB ARG 111 7.817 13.158 1.203
841 1HG ARG 111 2HG ARG 111 9.223 11.721 -0.204
842 2HG ARG 111 1HG ARG 111 7.772 11.074 -0.973
843 1HD ARG 111 2HD ARG 111 7.200 13.478 -1.570
844 2HD ARG 111 1HD ARG 111 8.849 13.879 -1.087
845 HE ARG 111 HE ARG 111 8.482 11.787 -3.099
846 1HH1 ARG 111 1HH1 ARG 111 9.473 15.051 -2.304
847 2HH1 ARG 111 2HH1 ARG 111 10.193 15.351 -3.855
848 1HH2 ARG 111 1HH2 ARG 111 9.431 12.152 -5.118
849 2HH2 ARG 111 2HH2 ARG 111 10.180 13.685 -5.454
850 H ILE 112 H ILE 112 8.995 9.232 1.650
851 HA ILE 112 HA ILE 112 10.802 10.091 3.715
852 HB ILE 112 HB ILE 112 11.210 7.890 1.693
853 1HG1 ILE 112 2HG1 ILE 112 9.066 7.612 2.886
854 2HG1 ILE 112 1HG1 ILE 112 10.232 6.369 3.313
855 1HG2 ILE 112 1HG2 ILE 112 12.369 8.279 4.447
856 2HG2 ILE 112 2HG2 ILE 112 13.222 8.532 2.926
857 3HG2 ILE 112 3HG2 ILE 112 12.681 6.914 3.373
858 1HD1 ILE 112 1HD1 ILE 112 9.569 8.793 4.959
859 2HD1 ILE 112 2HD1 ILE 112 10.720 7.529 5.393
860 3HD1 ILE 112 3HD1 ILE 112 9.004 7.148 5.255
861 H GLU 113 H GLU 113 13.058 10.596 3.344
862 HA GLU 113 HA GLU 113 13.521 12.306 1.117
863 1HB GLU 113 2HB GLU 113 15.496 11.105 3.054
864 2HB GLU 113 1HB GLU 113 15.845 12.412 1.942
865 1HG GLU 113 2HG GLU 113 15.535 13.431 4.026
866 2HG GLU 113 1HG GLU 113 14.049 13.732 3.132
867 H SER 114 H SER 114 13.339 11.256 -0.767
868 HA SER 114 HA SER 114 14.721 8.712 -1.139
869 1HB SER 114 2HB SER 114 12.248 8.986 -1.670
870 2HB SER 114 1HB SER 114 12.740 10.006 -3.021
871 HG SER 114 HG SER 114 12.877 7.265 -2.718
872 H LYS 115 H LYS 115 16.748 9.024 -1.724
873 HA LYS 115 HA LYS 115 17.238 10.724 -4.070
874 1HB LYS 115 2HB LYS 115 18.994 10.270 -1.657
875 2HB LYS 115 1HB LYS 115 19.607 10.925 -3.170
876 1HG LYS 115 2HG LYS 115 17.422 12.150 -1.499
877 2HG LYS 115 1HG LYS 115 19.108 12.679 -1.541
878 1HD LYS 115 2HD LYS 115 18.883 13.177 -3.933
879 2HD LYS 115 1HD LYS 115 17.196 12.656 -3.877
880 1HE LYS 115 2HE LYS 115 17.363 15.083 -3.778
881 2HE LYS 115 1HE LYS 115 16.694 14.434 -2.285
882 1HZ LYS 115 1HZ LYS 115 19.556 15.136 -2.613
883 2HZ LYS 115 2HZ LYS 115 18.742 14.769 -1.172
884 3HZ LYS 115 3HZ LYS 115 18.397 16.208 -1.996
885 H THR 116 H THR 116 18.449 9.844 -5.695
886 HA THR 116 HA THR 116 18.368 6.996 -5.810
887 HB THR 116 HB THR 116 19.292 7.327 -8.117
888 HG1 THR 116 1HG THR 116 20.431 9.197 -8.036
889 1HG2 THR 116 1HG2 THR 116 16.886 7.273 -7.735
890 2HG2 THR 116 2HG2 THR 116 17.277 8.448 -8.991
891 3HG2 THR 116 3HG2 THR 116 16.891 8.995 -7.359
892 H GLY 117 H GLY 117 19.891 5.611 -5.280
893 1HA GLY 117 2HA GLY 117 22.650 6.569 -4.972
894 2HA GLY 117 1HA GLY 117 22.000 5.077 -4.297
895 H ARG 118 H ARG 118 21.962 3.226 -5.551
896 HA ARG 118 HA ARG 118 22.888 3.491 -8.298
897 1HB ARG 118 2HB ARG 118 24.172 1.526 -8.135
898 2HB ARG 118 1HB ARG 118 24.597 2.465 -6.729
899 1HG ARG 118 2HG ARG 118 22.558 0.271 -6.603
900 2HG ARG 118 1HG ARG 118 24.283 -0.057 -6.455
901 1HD ARG 118 2HD ARG 118 22.788 1.893 -4.714
902 2HD ARG 118 1HD ARG 118 23.049 0.204 -4.290
903 HE ARG 118 HE ARG 118 25.541 0.913 -4.673
904 1HH1 ARG 118 1HH1 ARG 118 22.992 2.777 -3.156
905 2HH1 ARG 118 2HH1 ARG 118 24.064 3.587 -2.049
906 1HH2 ARG 118 1HH2 ARG 118 26.953 1.990 -3.236
907 2HH2 ARG 118 2HH2 ARG 118 26.306 3.101 -2.067
908 H GLU 119 H GLU 119 21.370 2.939 -9.653
909 HA GLU 119 HA GLU 119 19.493 0.807 -8.868
910 1HB GLU 119 2HB GLU 119 17.835 1.881 -10.394
911 2HB GLU 119 1HB GLU 119 18.238 2.831 -8.972
912 1HG GLU 119 2HG GLU 119 19.718 4.227 -10.326
913 2HG GLU 119 1HG GLU 119 19.314 3.264 -11.748
914 H GLU 120 H GLU 120 18.647 -0.481 -10.614
915 HA GLU 120 HA GLU 120 18.927 -1.933 -12.319
916 1HB GLU 120 2HB GLU 120 19.035 0.121 -13.735
917 2HB GLU 120 1HB GLU 120 20.786 0.087 -13.580
918 1HG GLU 120 2HG GLU 120 20.849 -2.089 -14.662
919 2HG GLU 120 1HG GLU 120 19.090 -2.090 -14.786
920 H LYS 121 H LYS 121 19.890 -3.598 -11.500
921 HA LYS 121 HA LYS 121 22.807 -3.567 -11.130
922 1HB LYS 121 2HB LYS 121 21.599 -3.351 -8.977
923 2HB LYS 121 1HB LYS 121 20.736 -4.840 -9.330
924 1HG LYS 121 2HG LYS 121 22.840 -6.080 -9.271
925 2HG LYS 121 1HG LYS 121 23.707 -4.582 -8.914
926 1HD LYS 121 2HD LYS 121 21.540 -5.812 -7.208
927 2HD LYS 121 1HD LYS 121 23.273 -5.890 -6.879
928 1HE LYS 121 2HE LYS 121 23.397 -3.548 -6.513
929 2HE LYS 121 1HE LYS 121 21.777 -3.293 -7.161
930 1HZ LYS 121 1HZ LYS 121 22.415 -4.767 -4.656
931 2HZ LYS 121 2HZ LYS 121 20.860 -4.481 -5.279
932 3HZ LYS 121 3HZ LYS 121 21.808 -3.184 -4.742
933 H ASP 122 H ASP 122 23.887 -5.451 -11.724
934 HA ASP 122 HA ASP 122 22.274 -7.300 -13.312
935 1HB ASP 122 2HB ASP 122 24.241 -6.269 -14.388
936 2HB ASP 122 1HB ASP 122 25.282 -7.022 -13.183
937 H GLU 123 H GLU 123 22.729 -9.618 -13.206
938 HA GLU 123 HA GLU 123 22.935 -10.376 -10.373
939 1HB GLU 123 2HB GLU 123 21.513 -12.294 -10.996
940 2HB GLU 123 1HB GLU 123 20.749 -10.749 -11.353
941 1HG GLU 123 2HG GLU 123 21.263 -10.969 -13.684
942 2HG GLU 123 1HG GLU 123 22.213 -12.422 -13.379
943 H LYS 124 H LYS 124 24.698 -10.572 -13.196
944 HA LYS 124 HA LYS 124 25.369 -13.292 -13.356
945 1HB LYS 124 2HB LYS 124 25.736 -11.568 -15.141
946 2HB LYS 124 1HB LYS 124 27.091 -10.962 -14.201
947 1HG LYS 124 2HG LYS 124 27.866 -12.404 -15.976
948 2HG LYS 124 1HG LYS 124 28.195 -13.136 -14.405
949 1HD LYS 124 2HD LYS 124 26.370 -14.653 -14.642
950 2HD LYS 124 1HD LYS 124 25.775 -13.803 -16.070
951 1HE LYS 124 2HE LYS 124 28.425 -15.227 -15.893
952 2HE LYS 124 1HE LYS 124 26.964 -15.912 -16.604
953 1HZ LYS 124 1HZ LYS 124 28.447 -14.967 -18.278
954 2HZ LYS 124 2HZ LYS 124 28.335 -13.444 -17.544
955 3HZ LYS 124 3HZ LYS 124 26.961 -14.150 -18.247
956 H SER 125 H SER 125 26.143 -14.350 -11.711
957 HA SER 125 HA SER 125 28.632 -13.419 -10.488
958 1HB SER 125 2HB SER 125 27.617 -14.327 -8.262
959 2HB SER 125 1HB SER 125 27.167 -12.713 -8.813
960 HG SER 125 HG SER 125 25.349 -13.922 -9.897
961 H LYS 126 H LYS 126 29.907 -15.094 -9.563
962 HA LYS 126 HA LYS 126 29.069 -17.831 -10.213
963 1HB LYS 126 2HB LYS 126 30.549 -17.053 -12.000
964 2HB LYS 126 1HB LYS 126 31.767 -16.605 -10.813
965 1HG LYS 126 2HG LYS 126 32.048 -18.929 -10.185
966 2HG LYS 126 1HG LYS 126 30.775 -19.403 -11.314
967 1HD LYS 126 2HD LYS 126 32.098 -18.618 -13.187
968 2HD LYS 126 1HD LYS 126 33.345 -18.026 -12.088
969 1HE LYS 126 2HE LYS 126 33.790 -20.292 -11.341
970 2HE LYS 126 1HE LYS 126 32.500 -20.905 -12.374
971 1HZ LYS 126 1HZ LYS 126 33.713 -20.252 -14.306
972 2HZ LYS 126 2HZ LYS 126 34.748 -21.165 -13.322
973 3HZ LYS 126 3HZ LYS 126 34.900 -19.477 -13.375
974 H SER 127 H SER 127 29.241 -19.120 -8.511
975 HA SER 127 HA SER 127 30.581 -18.134 -6.125
976 1HB SER 127 2HB SER 127 29.021 -20.701 -6.456
977 2HB SER 127 1HB SER 127 29.381 -19.848 -4.956
978 HG SER 127 HG SER 127 28.099 -18.080 -5.876
979 H LEU 128 H LEU 128 32.671 -18.584 -5.842
980 HA LEU 128 HA LEU 128 33.811 -21.033 -6.941
981 1HB LEU 128 2HB LEU 128 34.999 -18.564 -5.707
982 2HB LEU 128 1HB LEU 128 35.956 -20.018 -5.910
983 HG LEU 128 HG LEU 128 35.427 -19.909 -8.377
984 1HD1 LEU 128 1HD1 LEU 128 34.450 -17.154 -7.648
985 2HD1 LEU 128 2HD1 LEU 128 33.464 -18.479 -8.268
986 3HD1 LEU 128 3HD1 LEU 128 34.713 -17.760 -9.284
987 1HD2 LEU 128 1HD2 LEU 128 37.091 -18.181 -8.820
988 2HD2 LEU 128 2HD2 LEU 128 37.571 -19.203 -7.465
989 3HD2 LEU 128 3HD2 LEU 128 36.924 -17.590 -7.169
990 H GLU 129 H GLU 129 35.844 -21.425 -5.022
991 HA GLU 129 HA GLU 129 34.378 -22.051 -2.572
992 1HB GLU 129 2HB GLU 129 35.554 -24.297 -2.536
993 2HB GLU 129 1HB GLU 129 34.256 -24.125 -3.706
994 1HG GLU 129 2HG GLU 129 36.003 -25.296 -4.780
995 2HG GLU 129 1HG GLU 129 36.001 -23.665 -5.445
996 H HIS 130 H HIS 130 35.844 -22.646 -0.771
997 HA HIS 130 HA HIS 130 38.646 -22.082 -1.022
998 1HB HIS 130 2HB HIS 130 36.809 -19.998 -0.025
999 2HB HIS 130 1HB HIS 130 38.183 -20.333 1.024
1000 HD1 HIS 130 1HD HIS 130 37.538 -17.760 -0.958
1001 HD2 HIS 130 2HD HIS 130 40.445 -20.714 -1.342
1002 HE1 HIS 130 1HE HIS 130 39.353 -16.753 -2.385
1003 HE2 HIS 130 2HE HIS 130 41.192 -18.475 -2.391
1004 H HIS 131 H HIS 131 39.757 -23.168 0.486
1005 HA HIS 131 HA HIS 131 38.247 -24.510 2.600
1006 1HB HIS 131 2HB HIS 131 41.146 -24.792 1.757
1007 2HB HIS 131 1HB HIS 131 40.365 -25.745 3.013
1008 HD1 HIS 131 1HD HIS 131 38.737 -27.606 2.258
1009 HD2 HIS 131 2HD HIS 131 40.503 -25.525 -0.882
1010 HE1 HIS 131 1HE HIS 131 38.265 -28.961 0.192
1011 HE2 HIS 131 2HE HIS 131 39.150 -27.570 -1.711
1012 H HIS 132 H HIS 132 37.793 -22.805 3.977
1013 HA HIS 132 HA HIS 132 40.110 -21.283 4.990
1014 1HB HIS 132 2HB HIS 132 38.267 -20.216 3.414
1015 2HB HIS 132 1HB HIS 132 37.364 -20.109 4.919
1016 HD1 HIS 132 1HD HIS 132 37.954 -18.231 6.490
1017 HD2 HIS 132 2HD HIS 132 40.691 -18.686 3.389
1018 HE1 HIS 132 1HE HIS 132 39.456 -16.214 6.600
1019 HE2 HIS 132 2HE HIS 132 40.946 -16.403 4.578
1020 H HIS 133 H HIS 133 40.296 -21.040 7.171
1021 HA HIS 133 HA HIS 133 38.022 -21.294 8.918
1022 1HB HIS 133 2HB HIS 133 38.858 -23.200 10.234
1023 2HB HIS 133 1HB HIS 133 38.487 -23.675 8.583
1024 HD1 HIS 133 1HD HIS 133 40.343 -24.695 7.225
1025 HD2 HIS 133 2HD HIS 133 41.676 -23.106 10.827
1026 HE1 HIS 133 1HE HIS 133 42.725 -25.459 7.460
1027 HE2 HIS 133 2HE HIS 133 43.551 -24.398 9.591
1028 H HIS 134 H HIS 134 38.497 -20.691 11.108
1029 HA HIS 134 HA HIS 134 41.222 -19.699 11.572
1030 1HB HIS 134 2HB HIS 134 38.661 -18.169 11.821
1031 2HB HIS 134 1HB HIS 134 40.006 -17.794 12.893
1032 HD1 HIS 134 1HD HIS 134 42.244 -17.019 11.697
1033 HD2 HIS 134 2HD HIS 134 38.826 -17.058 9.334
1034 HE1 HIS 134 1HE HIS 134 42.783 -15.584 9.701
1035 HE2 HIS 134 2HE HIS 134 40.602 -15.409 8.443
1036 H HIS 135 H HIS 135 41.715 -21.353 12.921
1037 HA HIS 135 HA HIS 135 41.226 -20.976 15.631
1038 1HB HIS 135 2HB HIS 135 38.976 -21.958 15.038
1039 2HB HIS 135 1HB HIS 135 39.810 -23.444 14.592
1040 HD1 HIS 135 1HD HIS 135 38.682 -21.454 17.528
1041 HD2 HIS 135 2HD HIS 135 40.870 -24.915 16.787
1042 HE1 HIS 135 1HE HIS 135 38.885 -22.617 19.751
1043 HE2 HIS 135 2HE HIS 135 40.225 -24.710 19.287
Start of MODEL 11
1 1H MET 1 1HT MET 1 30.547 33.826 -3.199
2 2H MET 1 2HT MET 1 29.008 34.451 -2.862
3 3H MET 1 3HT MET 1 30.202 35.458 -3.511
4 HA MET 1 HA MET 1 28.549 34.807 -5.145
5 1HB MET 1 2HB MET 1 31.355 33.772 -5.561
6 2HB MET 1 1HB MET 1 30.174 33.923 -6.853
7 1HG MET 1 2HG MET 1 30.036 36.347 -6.386
8 2HG MET 1 1HG MET 1 31.310 36.153 -5.183
9 1HE MET 1 1HE MET 1 33.164 33.971 -6.567
10 2HE MET 1 2HE MET 1 33.812 35.413 -5.783
11 3HE MET 1 3HE MET 1 34.331 34.989 -7.413
12 H ILE 2 H ILE 2 27.415 33.135 -3.597
13 HA ILE 2 HA ILE 2 27.837 30.425 -4.640
14 HB ILE 2 HB ILE 2 25.927 31.390 -2.497
15 1HG1 ILE 2 2HG1 ILE 2 28.284 31.574 -1.805
16 2HG1 ILE 2 1HG1 ILE 2 27.454 30.303 -0.911
17 1HG2 ILE 2 1HG2 ILE 2 26.659 28.584 -3.331
18 2HG2 ILE 2 2HG2 ILE 2 25.128 29.395 -3.662
19 3HG2 ILE 2 3HG2 ILE 2 25.588 29.027 -1.999
20 1HD1 ILE 2 1HD1 ILE 2 29.691 29.616 -1.542
21 2HD1 ILE 2 2HD1 ILE 2 29.323 29.907 -3.243
22 3HD1 ILE 2 3HD1 ILE 2 28.485 28.626 -2.365
23 H MET 3 H MET 3 26.958 30.209 -6.601
24 HA MET 3 HA MET 3 24.280 31.361 -7.047
25 1HB MET 3 2HB MET 3 26.475 30.839 -9.061
26 2HB MET 3 1HB MET 3 24.884 31.493 -9.429
27 1HG MET 3 2HG MET 3 25.348 33.482 -8.189
28 2HG MET 3 1HG MET 3 26.868 32.812 -7.596
29 1HE MET 3 1HE MET 3 26.079 33.981 -11.990
30 2HE MET 3 2HE MET 3 24.905 34.179 -10.690
31 3HE MET 3 3HE MET 3 25.352 32.563 -11.235
32 H VAL 4 H VAL 4 22.708 29.930 -7.264
33 HA VAL 4 HA VAL 4 23.296 27.142 -7.728
34 HB VAL 4 HB VAL 4 20.852 26.801 -7.605
35 1HG1 VAL 4 1HG1 VAL 4 22.169 26.759 -5.569
36 2HG1 VAL 4 2HG1 VAL 4 20.581 27.458 -5.258
37 3HG1 VAL 4 3HG1 VAL 4 21.994 28.505 -5.397
38 1HG2 VAL 4 1HG2 VAL 4 20.083 28.870 -8.610
39 2HG2 VAL 4 2HG2 VAL 4 20.737 29.797 -7.260
40 3HG2 VAL 4 3HG2 VAL 4 19.392 28.686 -6.998
41 H SER 5 H SER 5 22.838 25.940 -9.544
42 HA SER 5 HA SER 5 21.670 27.310 -11.844
43 1HB SER 5 2HB SER 5 24.346 25.899 -11.937
44 2HB SER 5 1HB SER 5 23.491 26.574 -13.323
45 HG SER 5 HG SER 5 23.629 28.486 -11.525
46 H GLY 6 H GLY 6 19.884 25.983 -11.561
47 1HA GLY 6 2HA GLY 6 20.306 23.243 -12.548
48 2HA GLY 6 1HA GLY 6 19.324 23.506 -11.111
49 H CYS 7 H CYS 7 19.396 23.476 -14.505
50 HA CYS 7 HA CYS 7 16.768 24.751 -14.695
51 1HB CYS 7 2HB CYS 7 18.641 23.855 -16.898
52 2HB CYS 7 1HB CYS 7 17.156 24.777 -17.110
53 HG CYS 7 HG CYS 7 18.083 27.141 -16.451
54 H GLN 8 H GLN 8 15.028 23.675 -15.752
55 HA GLN 8 HA GLN 8 15.247 20.744 -15.620
56 1HB GLN 8 2HB GLN 8 13.667 21.857 -14.016
57 2HB GLN 8 1HB GLN 8 12.737 22.421 -15.395
58 1HG GLN 8 2HG GLN 8 11.682 20.485 -14.458
59 2HG GLN 8 1HG GLN 8 12.335 20.077 -16.043
60 1HE2 GLN 8 1HE2 GLN 8 12.339 17.890 -15.541
61 2HE2 GLN 8 2HE2 GLN 8 13.498 17.192 -14.465
62 H GLN 9 H GLN 9 16.237 21.385 -17.865
63 HA GLN 9 HA GLN 9 14.127 21.597 -19.889
64 1HB GLN 9 2HB GLN 9 15.761 22.249 -21.441
65 2HB GLN 9 1HB GLN 9 16.272 23.023 -19.951
66 1HG GLN 9 2HG GLN 9 17.405 20.385 -20.824
67 2HG GLN 9 1HG GLN 9 18.046 21.910 -21.419
68 1HE2 GLN 9 1HE2 GLN 9 20.039 21.579 -20.497
69 2HE2 GLN 9 2HE2 GLN 9 20.316 21.673 -18.795
70 H GLN 10 H GLN 10 15.212 19.240 -18.136
71 HA GLN 10 HA GLN 10 16.218 17.304 -19.944
72 1HB GLN 10 2HB GLN 10 14.868 16.959 -17.258
73 2HB GLN 10 1HB GLN 10 15.702 15.682 -18.134
74 1HG GLN 10 2HG GLN 10 17.784 17.012 -18.004
75 2HG GLN 10 1HG GLN 10 16.924 18.199 -17.026
76 1HE2 GLN 10 1HE2 GLN 10 18.256 14.998 -17.143
77 2HE2 GLN 10 2HE2 GLN 10 18.206 14.692 -15.435
78 H LYS 11 H LYS 11 15.152 15.320 -20.571
79 HA LYS 11 HA LYS 11 12.408 15.819 -21.453
80 1HB LYS 11 2HB LYS 11 14.351 13.597 -22.125
81 2HB LYS 11 1HB LYS 11 12.758 13.791 -22.840
82 1HG LYS 11 2HG LYS 11 14.912 15.876 -23.040
83 2HG LYS 11 1HG LYS 11 14.697 14.588 -24.226
84 1HD LYS 11 2HD LYS 11 12.608 16.631 -23.464
85 2HD LYS 11 1HD LYS 11 13.609 16.692 -24.916
86 1HE LYS 11 2HE LYS 11 12.658 14.464 -25.558
87 2HE LYS 11 1HE LYS 11 11.550 14.611 -24.196
88 1HZ LYS 11 1HZ LYS 11 10.433 15.335 -26.145
89 2HZ LYS 11 2HZ LYS 11 11.706 16.363 -26.584
90 3HZ LYS 11 3HZ LYS 11 10.762 16.722 -25.219
91 H GLU 12 H GLU 12 13.544 14.887 -18.699
92 HA GLU 12 HA GLU 12 12.405 12.261 -18.368
93 1HB GLU 12 2HB GLU 12 13.788 14.162 -16.480
94 2HB GLU 12 1HB GLU 12 13.130 12.614 -15.965
95 1HG GLU 12 2HG GLU 12 15.254 13.023 -18.057
96 2HG GLU 12 1HG GLU 12 15.513 12.463 -16.403
97 H GLU 13 H GLU 13 10.560 11.716 -17.444
98 HA GLU 13 HA GLU 13 8.887 13.821 -16.268
99 1HB GLU 13 2HB GLU 13 7.837 12.815 -18.199
100 2HB GLU 13 1HB GLU 13 8.134 11.201 -17.575
101 1HG GLU 13 2HG GLU 13 6.565 11.571 -15.777
102 2HG GLU 13 1HG GLU 13 6.332 13.239 -16.296
103 H THR 14 H THR 14 7.792 13.293 -14.308
104 HA THR 14 HA THR 14 8.955 11.031 -12.845
105 HB THR 14 HB THR 14 8.688 13.807 -11.679
106 HG1 THR 14 1HG THR 14 10.617 12.700 -13.264
107 1HG2 THR 14 1HG2 THR 14 10.100 12.885 -9.882
108 2HG2 THR 14 2HG2 THR 14 10.061 11.306 -10.670
109 3HG2 THR 14 3HG2 THR 14 8.576 12.009 -10.027
110 HA PRO 15 HA PRO 15 4.532 10.633 -11.897
111 1HB PRO 15 2HB PRO 15 5.440 8.075 -10.764
112 2HB PRO 15 1HB PRO 15 4.253 8.374 -12.037
113 1HG PRO 15 2HG PRO 15 6.659 7.291 -12.557
114 2HG PRO 15 1HG PRO 15 5.847 8.372 -13.704
115 1HD PRO 15 2HD PRO 15 8.074 8.969 -11.788
116 2HD PRO 15 1HD PRO 15 7.867 9.497 -13.472
117 H PHE 16 H PHE 16 3.676 11.444 -10.080
118 HA PHE 16 HA PHE 16 5.364 12.159 -7.929
119 1HB PHE 16 2HB PHE 16 3.453 13.248 -6.970
120 2HB PHE 16 1HB PHE 16 3.401 13.493 -8.709
121 HD1 PHE 16 1HD PHE 16 1.761 12.224 -10.085
122 HD2 PHE 16 2HD PHE 16 1.736 12.093 -5.828
123 HE1 PHE 16 1HE PHE 16 -0.530 11.329 -10.127
124 HE2 PHE 16 2HE PHE 16 -0.556 11.203 -5.864
125 HZ PHE 16 HZ PHE 16 -1.690 10.813 -8.013
126 H TYR 17 H TYR 17 3.488 9.349 -8.485
127 HA TYR 17 HA TYR 17 3.211 8.725 -5.666
128 1HB TYR 17 2HB TYR 17 1.957 6.791 -6.419
129 2HB TYR 17 1HB TYR 17 1.373 8.222 -7.249
130 HD1 TYR 17 2HD TYR 17 1.824 8.532 -9.645
131 HD2 TYR 17 1HD TYR 17 3.048 4.998 -7.614
132 HE1 TYR 17 2HE TYR 17 2.159 7.410 -11.806
133 HE2 TYR 17 1HE TYR 17 3.380 3.865 -9.770
134 HH TYR 17 HH TYR 17 2.781 3.996 -12.034
135 H TYR 18 H TYR 18 5.570 8.353 -8.015
136 HA TYR 18 HA TYR 18 6.271 5.611 -7.478
137 1HB TYR 18 2HB TYR 18 6.534 6.911 -9.684
138 2HB TYR 18 1HB TYR 18 7.987 7.585 -8.964
139 HD1 TYR 18 1HD TYR 18 6.380 4.532 -10.220
140 HD2 TYR 18 2HD TYR 18 9.980 6.238 -8.728
141 HE1 TYR 18 1HE TYR 18 7.627 2.566 -10.996
142 HE2 TYR 18 2HE TYR 18 11.237 4.271 -9.503
143 HH TYR 18 HH TYR 18 9.916 1.980 -11.638
144 H GLY 19 H GLY 19 7.793 4.859 -6.161
145 1HA GLY 19 2HA GLY 19 10.074 5.406 -5.180
146 2HA GLY 19 1HA GLY 19 9.266 6.826 -4.528
147 H THR 20 H THR 20 9.868 6.107 -2.422
148 HA THR 20 HA THR 20 8.126 3.952 -1.420
149 HB THR 20 HB THR 20 10.838 4.765 -0.339
150 HG1 THR 20 1HG THR 20 10.373 2.171 -1.230
151 1HG2 THR 20 1HG2 THR 20 8.951 2.569 0.537
152 2HG2 THR 20 2HG2 THR 20 9.341 4.030 1.447
153 3HG2 THR 20 3HG2 THR 20 10.588 2.818 1.148
154 H TRP 21 H TRP 21 6.758 4.467 0.179
155 HA TRP 21 HA TRP 21 6.983 7.176 1.322
156 1HB TRP 21 2HB TRP 21 4.468 5.591 0.751
157 2HB TRP 21 1HB TRP 21 4.528 7.209 1.444
158 HD1 TRP 21 HD TRP 21 5.044 5.344 -1.857
159 HE1 TRP 21 1HE TRP 21 4.991 7.046 -3.787
160 HE3 TRP 21 3HE TRP 21 4.917 9.653 0.882
161 HZ2 TRP 21 2HZ TRP 21 4.913 9.853 -4.099
162 HZ3 TRP 21 3HZ TRP 21 4.855 11.807 -0.305
163 HH2 TRP 21 HH TRP 21 4.854 11.902 -2.745
164 H ASP 22 H ASP 22 6.664 7.466 3.485
165 HA ASP 22 HA ASP 22 6.675 5.012 5.117
166 1HB ASP 22 2HB ASP 22 8.666 6.189 5.497
167 2HB ASP 22 1HB ASP 22 7.855 7.749 5.492
168 H GLU 23 H GLU 23 5.117 4.595 6.551
169 HA GLU 23 HA GLU 23 3.051 6.600 7.043
170 1HB GLU 23 2HB GLU 23 3.168 3.697 7.897
171 2HB GLU 23 1HB GLU 23 1.797 4.775 8.108
172 1HG GLU 23 2HG GLU 23 1.599 4.956 5.665
173 2HG GLU 23 1HG GLU 23 2.927 3.808 5.494
174 H GLY 24 H GLY 24 4.739 7.836 8.271
175 1HA GLY 24 2HA GLY 24 5.574 6.712 10.806
176 2HA GLY 24 1HA GLY 24 5.971 8.309 10.190
177 H ARG 25 H ARG 25 2.779 6.843 10.670
178 HA ARG 25 HA ARG 25 2.193 8.290 13.045
179 1HB ARG 25 2HB ARG 25 2.179 10.111 11.290
180 2HB ARG 25 1HB ARG 25 0.819 9.290 10.545
181 1HG ARG 25 2HG ARG 25 -0.527 9.644 12.515
182 2HG ARG 25 1HG ARG 25 0.850 10.351 13.363
183 1HD ARG 25 2HD ARG 25 -0.469 11.461 10.883
184 2HD ARG 25 1HD ARG 25 -0.661 12.081 12.523
185 HE ARG 25 HE ARG 25 2.089 12.011 11.771
186 1HH1 ARG 25 1HH1 ARG 25 -0.871 13.839 11.356
187 2HH1 ARG 25 2HH1 ARG 25 -0.055 15.329 10.966
188 1HH2 ARG 25 1HH2 ARG 25 3.177 13.961 11.270
189 2HH2 ARG 25 2HH2 ARG 25 2.256 15.394 10.929
190 H ALA 26 H ALA 26 0.215 7.703 13.906
191 HA ALA 26 HA ALA 26 -1.653 6.473 14.288
192 1HB ALA 26 1HB ALA 26 -1.625 5.733 11.364
193 2HB ALA 26 2HB ALA 26 -2.428 7.148 12.042
194 3HB ALA 26 3HB ALA 26 -2.965 5.529 12.494
195 HA PRO 27 HA PRO 27 0.161 2.551 15.123
196 1HB PRO 27 2HB PRO 27 -2.343 1.543 16.137
197 2HB PRO 27 1HB PRO 27 -0.947 2.126 17.043
198 1HG PRO 27 2HG PRO 27 -3.369 3.408 16.965
199 2HG PRO 27 1HG PRO 27 -1.826 4.221 17.286
200 1HD PRO 27 2HD PRO 27 -3.400 4.074 14.740
201 2HD PRO 27 1HD PRO 27 -2.519 5.448 15.444
202 H GLY 28 H GLY 28 0.019 0.282 14.686
203 1HA GLY 28 2HA GLY 28 -1.736 -0.399 12.413
204 2HA GLY 28 1HA GLY 28 -0.035 -0.832 12.450
205 HA PRO 29 HA PRO 29 -2.177 -4.797 13.563
206 1HB PRO 29 2HB PRO 29 0.754 -5.310 13.270
207 2HB PRO 29 1HB PRO 29 -0.615 -6.303 12.762
208 1HG PRO 29 2HG PRO 29 0.757 -4.745 11.041
209 2HG PRO 29 1HG PRO 29 -0.972 -5.082 10.858
210 1HD PRO 29 2HD PRO 29 0.364 -2.576 11.585
211 2HD PRO 29 1HD PRO 29 -1.297 -2.846 11.034
212 H THR 30 H THR 30 -2.493 -5.425 15.564
213 HA THR 30 HA THR 30 -1.302 -4.151 17.771
214 HB THR 30 HB THR 30 -3.608 -5.025 17.731
215 HG1 THR 30 1HG THR 30 -2.167 -4.834 19.745
216 1HG2 THR 30 1HG2 THR 30 -2.281 -7.725 17.892
217 2HG2 THR 30 2HG2 THR 30 -3.253 -7.111 16.555
218 3HG2 THR 30 3HG2 THR 30 -4.004 -7.424 18.119
219 H ASP 31 H ASP 31 -0.229 -6.760 15.937
220 HA ASP 31 HA ASP 31 0.939 -8.407 17.902
221 1HB ASP 31 2HB ASP 31 1.580 -8.058 14.975
222 2HB ASP 31 1HB ASP 31 2.311 -9.296 15.994
223 H GLY 32 H GLY 32 2.091 -5.529 16.281
224 1HA GLY 32 2HA GLY 32 3.936 -4.621 17.944
225 2HA GLY 32 1HA GLY 32 4.804 -5.990 17.270
226 H VAL 33 H VAL 33 3.088 -5.237 14.716
227 HA VAL 33 HA VAL 33 5.098 -3.493 13.575
228 HB VAL 33 HB VAL 33 2.487 -4.289 12.289
229 1HG1 VAL 33 1HG1 VAL 33 3.721 -3.997 10.200
230 2HG1 VAL 33 2HG1 VAL 33 5.149 -3.520 11.120
231 3HG1 VAL 33 3HG1 VAL 33 3.695 -2.521 11.166
232 1HG2 VAL 33 1HG2 VAL 33 3.571 -6.330 13.041
233 2HG2 VAL 33 2HG2 VAL 33 5.077 -5.831 12.271
234 3HG2 VAL 33 3HG2 VAL 33 3.661 -6.198 11.285
235 H LYS 34 H LYS 34 4.893 -1.312 13.336
236 HA LYS 34 HA LYS 34 2.553 -0.123 14.592
237 1HB LYS 34 2HB LYS 34 5.223 1.048 13.808
238 2HB LYS 34 1HB LYS 34 3.936 1.942 14.595
239 1HG LYS 34 2HG LYS 34 4.053 0.298 16.476
240 2HG LYS 34 1HG LYS 34 5.483 -0.383 15.700
241 1HD LYS 34 2HD LYS 34 6.619 1.762 15.883
242 2HD LYS 34 1HD LYS 34 5.180 2.473 16.621
243 1HE LYS 34 2HE LYS 34 5.374 0.765 18.436
244 2HE LYS 34 1HE LYS 34 6.921 0.284 17.741
245 1HZ LYS 34 1HZ LYS 34 6.243 2.984 18.773
246 2HZ LYS 34 2HZ LYS 34 7.728 2.543 18.085
247 3HZ LYS 34 3HZ LYS 34 7.227 1.843 19.548
248 H SER 35 H SER 35 4.040 -0.520 11.556
249 HA SER 35 HA SER 35 1.951 0.292 9.962
250 1HB SER 35 2HB SER 35 3.888 2.518 10.579
251 2HB SER 35 1HB SER 35 3.129 2.423 8.992
252 HG SER 35 HG SER 35 1.703 2.451 11.455
253 H ALA 36 H ALA 36 2.988 0.949 7.631
254 HA ALA 36 HA ALA 36 5.395 -0.707 7.302
255 1HB ALA 36 1HB ALA 36 3.428 -2.020 6.669
256 2HB ALA 36 2HB ALA 36 4.462 -1.681 5.281
257 3HB ALA 36 3HB ALA 36 2.968 -0.772 5.513
258 H THR 37 H THR 37 6.466 -0.335 5.206
259 HA THR 37 HA THR 37 5.988 2.377 4.170
260 HB THR 37 HB THR 37 8.424 2.223 3.390
261 HG1 THR 37 1HG THR 37 9.461 0.725 5.218
262 1HG2 THR 37 1HG2 THR 37 7.765 2.362 6.335
263 2HG2 THR 37 2HG2 THR 37 7.840 3.701 5.191
264 3HG2 THR 37 3HG2 THR 37 9.313 2.849 5.644
265 H VAL 38 H VAL 38 5.779 2.579 1.950
266 HA VAL 38 HA VAL 38 5.531 -0.007 0.564
267 HB VAL 38 HB VAL 38 3.362 1.068 0.910
268 1HG1 VAL 38 1HG1 VAL 38 4.035 3.395 0.983
269 2HG1 VAL 38 2HG1 VAL 38 2.792 3.159 -0.246
270 3HG1 VAL 38 3HG1 VAL 38 4.480 3.342 -0.724
271 1HG2 VAL 38 1HG2 VAL 38 2.574 1.008 -1.411
272 2HG2 VAL 38 2HG2 VAL 38 3.686 -0.317 -1.062
273 3HG2 VAL 38 3HG2 VAL 38 4.244 1.085 -1.974
274 H THR 39 H THR 39 6.803 -0.366 -1.070
275 HA THR 39 HA THR 39 8.109 1.910 -2.397
276 HB THR 39 HB THR 39 8.903 -1.016 -2.383
277 HG1 THR 39 1HG THR 39 9.657 -0.421 -0.481
278 1HG2 THR 39 1HG2 THR 39 9.604 0.140 -4.429
279 2HG2 THR 39 2HG2 THR 39 10.990 -0.234 -3.407
280 3HG2 THR 39 3HG2 THR 39 10.353 1.409 -3.459
281 H PHE 40 H PHE 40 7.524 2.392 -4.416
282 HA PHE 40 HA PHE 40 5.706 0.545 -5.781
283 1HB PHE 40 2HB PHE 40 6.212 3.500 -6.103
284 2HB PHE 40 1HB PHE 40 5.253 2.575 -7.251
285 HD1 PHE 40 2HD PHE 40 3.106 1.618 -6.585
286 HD2 PHE 40 1HD PHE 40 5.349 4.102 -3.956
287 HE1 PHE 40 2HE PHE 40 1.104 1.951 -5.198
288 HE2 PHE 40 1HE PHE 40 3.348 4.436 -2.561
289 HZ PHE 40 HZ PHE 40 1.222 3.359 -3.185
290 H THR 41 H THR 41 6.485 -0.687 -7.271
291 HA THR 41 HA THR 41 8.920 0.000 -8.721
292 HB THR 41 HB THR 41 7.272 -2.457 -9.270
293 HG1 THR 41 1HG THR 41 8.342 -1.735 -6.850
294 1HG2 THR 41 1HG2 THR 41 9.579 -3.471 -9.382
295 2HG2 THR 41 2HG2 THR 41 10.232 -1.844 -9.184
296 3HG2 THR 41 3HG2 THR 41 9.258 -2.242 -10.598
297 H GLU 42 H GLU 42 8.591 -0.765 -11.229
298 HA GLU 42 HA GLU 42 7.312 1.254 -12.528
299 1HB GLU 42 2HB GLU 42 8.752 -0.989 -13.269
300 2HB GLU 42 1HB GLU 42 7.202 -1.212 -14.071
301 1HG GLU 42 2HG GLU 42 8.528 -0.077 -15.610
302 2HG GLU 42 1HG GLU 42 7.470 1.156 -14.927
303 H ASP 43 H ASP 43 5.968 -1.995 -11.913
304 HA ASP 43 HA ASP 43 3.300 -0.820 -11.881
305 1HB ASP 43 2HB ASP 43 2.338 -2.388 -13.447
306 2HB ASP 43 1HB ASP 43 3.663 -1.546 -14.238
307 H GLU 44 H GLU 44 5.142 -1.988 -9.950
308 HA GLU 44 HA GLU 44 3.414 -4.101 -8.893
309 1HB GLU 44 2HB GLU 44 6.425 -4.282 -9.130
310 2HB GLU 44 1HB GLU 44 5.431 -5.400 -8.206
311 1HG GLU 44 2HG GLU 44 4.321 -6.145 -10.203
312 2HG GLU 44 1HG GLU 44 5.154 -4.925 -11.162
313 H VAL 45 H VAL 45 3.721 -4.452 -6.574
314 HA VAL 45 HA VAL 45 4.762 -2.034 -5.225
315 HB VAL 45 HB VAL 45 2.409 -3.773 -4.434
316 1HG1 VAL 45 1HG1 VAL 45 2.096 -2.146 -2.593
317 2HG1 VAL 45 2HG1 VAL 45 3.642 -1.412 -3.018
318 3HG1 VAL 45 3HG1 VAL 45 3.585 -3.078 -2.442
319 1HG2 VAL 45 1HG2 VAL 45 1.904 -2.235 -6.248
320 2HG2 VAL 45 2HG2 VAL 45 2.554 -0.892 -5.308
321 3HG2 VAL 45 3HG2 VAL 45 1.100 -1.728 -4.761
322 H VAL 46 H VAL 46 6.345 -2.357 -3.798
323 HA VAL 46 HA VAL 46 6.665 -5.053 -2.641
324 HB VAL 46 HB VAL 46 8.717 -2.848 -2.911
325 1HG1 VAL 46 1HG1 VAL 46 9.034 -5.615 -1.756
326 2HG1 VAL 46 2HG1 VAL 46 9.016 -4.109 -0.838
327 3HG1 VAL 46 3HG1 VAL 46 10.320 -4.429 -1.981
328 1HG2 VAL 46 1HG2 VAL 46 9.886 -4.408 -4.404
329 2HG2 VAL 46 2HG2 VAL 46 8.295 -3.969 -5.026
330 3HG2 VAL 46 3HG2 VAL 46 8.540 -5.539 -4.260
331 H GLU 47 H GLU 47 6.150 -5.248 -0.556
332 HA GLU 47 HA GLU 47 5.759 -2.803 0.998
333 1HB GLU 47 2HB GLU 47 4.501 -5.461 1.012
334 2HB GLU 47 1HB GLU 47 4.749 -4.738 2.592
335 1HG GLU 47 2HG GLU 47 3.484 -2.800 1.957
336 2HG GLU 47 1HG GLU 47 3.342 -3.396 0.306
337 H THR 48 H THR 48 6.849 -2.345 2.719
338 HA THR 48 HA THR 48 8.556 -4.407 3.931
339 HB THR 48 HB THR 48 9.681 -2.028 4.716
340 HG1 THR 48 1HG THR 48 8.830 -0.646 3.314
341 1HG2 THR 48 1HG2 THR 48 10.437 -3.735 2.347
342 2HG2 THR 48 2HG2 THR 48 10.911 -4.008 4.024
343 3HG2 THR 48 3HG2 THR 48 11.503 -2.589 3.159
344 H GLU 49 H GLU 49 7.841 -4.918 5.903
345 HA GLU 49 HA GLU 49 6.023 -3.036 7.224
346 1HB GLU 49 2HB GLU 49 6.496 -5.956 7.850
347 2HB GLU 49 1HB GLU 49 5.207 -4.940 8.484
348 1HG GLU 49 2HG GLU 49 4.356 -4.675 6.168
349 2HG GLU 49 1HG GLU 49 5.576 -5.829 5.632
350 H VAL 50 H VAL 50 6.464 -2.150 9.179
351 HA VAL 50 HA VAL 50 9.222 -2.503 10.101
352 HB VAL 50 HB VAL 50 7.240 -0.359 10.897
353 1HG1 VAL 50 1HG1 VAL 50 10.233 -0.517 11.212
354 2HG1 VAL 50 2HG1 VAL 50 9.036 -0.653 12.501
355 3HG1 VAL 50 3HG1 VAL 50 9.228 0.869 11.630
356 1HG2 VAL 50 1HG2 VAL 50 9.390 -0.248 8.780
357 2HG2 VAL 50 2HG2 VAL 50 8.406 1.113 9.316
358 3HG2 VAL 50 3HG2 VAL 50 7.651 -0.252 8.493
359 H MET 51 H MET 51 9.536 -3.873 11.694
360 HA MET 51 HA MET 51 7.604 -3.890 13.924
361 1HB MET 51 2HB MET 51 7.324 -5.841 12.336
362 2HB MET 51 1HB MET 51 8.926 -6.364 12.828
363 1HG MET 51 2HG MET 51 8.162 -6.530 15.145
364 2HG MET 51 1HG MET 51 6.541 -6.054 14.636
365 1HE MET 51 1HE MET 51 7.126 -8.672 16.324
366 2HE MET 51 2HE MET 51 6.116 -9.856 15.493
367 3HE MET 51 3HE MET 51 5.509 -8.226 15.780
368 H GLU 52 H GLU 52 8.492 -4.105 15.950
369 HA GLU 52 HA GLU 52 11.225 -3.437 16.277
370 1HB GLU 52 2HB GLU 52 9.516 -2.759 17.897
371 2HB GLU 52 1HB GLU 52 9.207 -4.442 18.295
372 1HG GLU 52 2HG GLU 52 10.561 -3.376 19.998
373 2HG GLU 52 1HG GLU 52 11.464 -4.655 19.187
374 H GLY 53 H GLY 53 12.969 -4.669 16.616
375 1HA GLY 53 2HA GLY 53 14.189 -6.581 17.198
376 2HA GLY 53 1HA GLY 53 12.690 -7.495 17.292
377 H ARG 54 H ARG 54 12.149 -6.106 14.539
378 HA ARG 54 HA ARG 54 13.573 -8.144 12.956
379 1HB ARG 54 2HB ARG 54 10.983 -6.790 12.223
380 2HB ARG 54 1HB ARG 54 11.680 -8.240 11.526
381 1HG ARG 54 2HG ARG 54 11.099 -8.389 14.394
382 2HG ARG 54 1HG ARG 54 9.701 -8.214 13.338
383 1HD ARG 54 2HD ARG 54 10.095 -10.549 13.673
384 2HD ARG 54 1HD ARG 54 10.548 -10.152 12.017
385 HE ARG 54 HE ARG 54 12.909 -10.010 13.071
386 1HH1 ARG 54 1HH1 ARG 54 10.396 -12.300 13.905
387 2HH1 ARG 54 2HH1 ARG 54 11.506 -13.519 14.436
388 1HH2 ARG 54 1HH2 ARG 54 14.377 -11.621 13.762
389 2HH2 ARG 54 2HH2 ARG 54 13.761 -13.142 14.348
390 H GLY 55 H GLY 55 12.002 -4.989 12.694
391 1HA GLY 55 2HA GLY 55 13.117 -3.045 11.797
392 2HA GLY 55 1HA GLY 55 14.115 -4.124 10.822
393 H GLU 56 H GLU 56 13.538 -3.205 8.826
394 HA GLU 56 HA GLU 56 10.736 -3.451 8.064
395 1HB GLU 56 2HB GLU 56 13.124 -2.317 6.609
396 2HB GLU 56 1HB GLU 56 11.505 -2.401 5.941
397 1HG GLU 56 2HG GLU 56 10.711 -1.021 7.831
398 2HG GLU 56 1HG GLU 56 12.384 -0.845 8.343
399 H VAL 57 H VAL 57 10.061 -5.253 7.347
400 HA VAL 57 HA VAL 57 11.922 -7.120 6.032
401 HB VAL 57 HB VAL 57 9.234 -7.563 7.331
402 1HG1 VAL 57 1HG1 VAL 57 9.561 -9.946 6.919
403 2HG1 VAL 57 2HG1 VAL 57 11.061 -9.603 6.057
404 3HG1 VAL 57 3HG1 VAL 57 9.518 -9.057 5.398
405 1HG2 VAL 57 1HG2 VAL 57 10.517 -8.897 8.946
406 2HG2 VAL 57 2HG2 VAL 57 11.025 -7.208 8.919
407 3HG2 VAL 57 3HG2 VAL 57 12.007 -8.437 8.121
408 H GLN 58 H GLN 58 11.729 -7.520 3.896
409 HA GLN 58 HA GLN 58 9.695 -6.119 2.416
410 1HB GLN 58 2HB GLN 58 11.941 -7.889 1.443
411 2HB GLN 58 1HB GLN 58 10.930 -6.865 0.449
412 1HG GLN 58 2HG GLN 58 11.817 -4.922 1.846
413 2HG GLN 58 1HG GLN 58 13.033 -6.065 2.414
414 1HE2 GLN 58 1HE2 GLN 58 14.496 -6.944 0.911
415 2HE2 GLN 58 2HE2 GLN 58 14.841 -6.141 -0.576
416 H LEU 59 H LEU 59 7.915 -6.980 1.606
417 HA LEU 59 HA LEU 59 7.500 -9.866 1.776
418 1HB LEU 59 2HB LEU 59 5.624 -7.586 1.128
419 2HB LEU 59 1HB LEU 59 5.151 -9.275 1.143
420 HG LEU 59 HG LEU 59 6.178 -7.737 3.528
421 1HD1 LEU 59 1HD1 LEU 59 3.400 -8.685 2.845
422 2HD1 LEU 59 2HD1 LEU 59 3.954 -7.012 2.823
423 3HD1 LEU 59 3HD1 LEU 59 3.887 -7.898 4.346
424 1HD2 LEU 59 1HD2 LEU 59 5.529 -9.705 4.805
425 2HD2 LEU 59 2HD2 LEU 59 6.744 -10.121 3.597
426 3HD2 LEU 59 3HD2 LEU 59 5.049 -10.526 3.321
427 HA PRO 60 HA PRO 60 8.108 -10.739 -2.471
428 1HB PRO 60 2HB PRO 60 5.860 -12.189 -3.137
429 2HB PRO 60 1HB PRO 60 7.256 -12.849 -2.281
430 1HG PRO 60 2HG PRO 60 4.632 -11.926 -1.209
431 2HG PRO 60 1HG PRO 60 5.632 -13.299 -0.702
432 1HD PRO 60 2HD PRO 60 5.523 -10.976 0.679
433 2HD PRO 60 1HD PRO 60 6.988 -11.973 0.618
434 H PHE 61 H PHE 61 7.984 -9.336 -4.055
435 HA PHE 61 HA PHE 61 6.338 -7.185 -4.252
436 1HB PHE 61 2HB PHE 61 7.008 -7.115 -6.700
437 2HB PHE 61 1HB PHE 61 8.321 -7.187 -5.533
438 HD1 PHE 61 2HD PHE 61 9.623 -9.254 -5.259
439 HD2 PHE 61 1HD PHE 61 6.617 -8.889 -8.251
440 HE1 PHE 61 2HE PHE 61 10.545 -11.214 -6.421
441 HE2 PHE 61 1HE PHE 61 7.539 -10.848 -9.418
442 HZ PHE 61 HZ PHE 61 9.502 -12.011 -8.503
443 H MET 62 H MET 62 4.369 -6.735 -4.871
444 HA MET 62 HA MET 62 2.759 -8.863 -6.124
445 1HB MET 62 2HB MET 62 2.055 -6.652 -4.204
446 2HB MET 62 1HB MET 62 0.827 -7.507 -5.125
447 1HG MET 62 2HG MET 62 2.790 -8.818 -3.258
448 2HG MET 62 1HG MET 62 1.148 -8.359 -2.821
449 1HE MET 62 1HE MET 62 -1.000 -9.492 -3.708
450 2HE MET 62 2HE MET 62 -1.039 -10.704 -4.990
451 3HE MET 62 3HE MET 62 -0.550 -9.049 -5.354
452 H ALA 63 H ALA 63 1.866 -8.489 -8.063
453 HA ALA 63 HA ALA 63 2.470 -5.992 -9.391
454 1HB ALA 63 1HB ALA 63 2.708 -8.132 -10.569
455 2HB ALA 63 2HB ALA 63 1.566 -7.061 -11.379
456 3HB ALA 63 3HB ALA 63 0.972 -8.409 -10.410
457 H TYR 64 H TYR 64 0.959 -4.537 -10.238
458 HA TYR 64 HA TYR 64 -1.855 -4.965 -9.608
459 1HB TYR 64 2HB TYR 64 -2.156 -2.875 -8.488
460 2HB TYR 64 1HB TYR 64 -0.827 -3.702 -7.688
461 HD1 TYR 64 2HD TYR 64 1.544 -2.954 -8.209
462 HD2 TYR 64 1HD TYR 64 -1.876 -0.733 -9.417
463 HE1 TYR 64 2HE TYR 64 2.948 -0.959 -8.505
464 HE2 TYR 64 1HE TYR 64 -0.479 1.271 -9.717
465 HH TYR 64 HH TYR 64 1.728 2.121 -8.799
466 H LYS 65 H LYS 65 -3.234 -3.294 -10.681
467 HA LYS 65 HA LYS 65 -1.923 -2.232 -13.101
468 1HB LYS 65 2HB LYS 65 -3.904 -2.726 -14.394
469 2HB LYS 65 1HB LYS 65 -3.360 -4.202 -13.608
470 1HG LYS 65 2HG LYS 65 -5.075 -3.909 -11.890
471 2HG LYS 65 1HG LYS 65 -5.630 -2.447 -12.702
472 1HD LYS 65 2HD LYS 65 -5.530 -5.122 -14.078
473 2HD LYS 65 1HD LYS 65 -6.937 -4.584 -13.162
474 1HE LYS 65 2HE LYS 65 -7.391 -4.033 -15.414
475 2HE LYS 65 1HE LYS 65 -6.936 -2.520 -14.634
476 1HZ LYS 65 1HZ LYS 65 -5.890 -2.745 -16.798
477 2HZ LYS 65 2HZ LYS 65 -5.166 -4.203 -16.328
478 3HZ LYS 65 3HZ LYS 65 -4.717 -2.756 -15.578
479 H VAL 66 H VAL 66 -2.864 -0.371 -13.990
480 HA VAL 66 HA VAL 66 -4.106 1.345 -11.957
481 HB VAL 66 HB VAL 66 -2.657 2.025 -14.519
482 1HG1 VAL 66 1HG1 VAL 66 -3.782 3.865 -12.408
483 2HG1 VAL 66 2HG1 VAL 66 -4.384 3.678 -14.056
484 3HG1 VAL 66 3HG1 VAL 66 -2.780 4.355 -13.774
485 1HG2 VAL 66 1HG2 VAL 66 -0.943 2.954 -13.026
486 2HG2 VAL 66 2HG2 VAL 66 -1.161 1.219 -12.793
487 3HG2 VAL 66 3HG2 VAL 66 -1.848 2.359 -11.636
488 H ILE 67 H ILE 67 -6.247 1.491 -12.109
489 HA ILE 67 HA ILE 67 -7.676 0.763 -14.484
490 HB ILE 67 HB ILE 67 -8.845 2.228 -12.128
491 1HG1 ILE 67 2HG1 ILE 67 -8.333 -0.749 -12.382
492 2HG1 ILE 67 1HG1 ILE 67 -7.581 0.345 -11.226
493 1HG2 ILE 67 1HG2 ILE 67 -10.274 1.986 -14.080
494 2HG2 ILE 67 2HG2 ILE 67 -10.869 0.988 -12.754
495 3HG2 ILE 67 3HG2 ILE 67 -9.994 0.244 -14.091
496 1HD1 ILE 67 1HD1 ILE 67 -9.699 0.713 -10.135
497 2HD1 ILE 67 2HD1 ILE 67 -9.371 -1.015 -10.233
498 3HD1 ILE 67 3HD1 ILE 67 -10.526 -0.274 -11.339
499 H SER 68 H SER 68 -7.224 3.760 -12.655
500 HA SER 68 HA SER 68 -7.555 5.281 -15.138
501 1HB SER 68 2HB SER 68 -8.775 6.379 -12.651
502 2HB SER 68 1HB SER 68 -9.219 6.661 -14.326
503 HG SER 68 HG SER 68 -9.884 4.489 -12.660
504 H GLN 69 H GLN 69 -6.412 7.217 -15.145
505 HA GLN 69 HA GLN 69 -4.903 7.983 -12.797
506 1HB GLN 69 2HB GLN 69 -3.441 6.287 -13.794
507 2HB GLN 69 1HB GLN 69 -3.491 7.132 -15.335
508 1HG GLN 69 2HG GLN 69 -2.372 9.050 -14.336
509 2HG GLN 69 1HG GLN 69 -2.348 8.235 -12.774
510 1HE2 GLN 69 1HE2 GLN 69 -1.780 6.577 -15.802
511 2HE2 GLN 69 2HE2 GLN 69 -0.099 6.264 -15.522
512 H SER 70 H SER 70 -4.566 10.066 -12.701
513 HA SER 70 HA SER 70 -4.967 11.690 -15.114
514 1HB SER 70 2HB SER 70 -6.413 12.191 -13.119
515 2HB SER 70 1HB SER 70 -4.954 12.548 -12.207
516 HG SER 70 HG SER 70 -5.983 13.911 -14.474
517 H THR 71 H THR 71 -3.336 13.201 -15.686
518 HA THR 71 HA THR 71 -0.675 12.641 -14.973
519 HB THR 71 HB THR 71 -0.220 14.979 -15.913
520 HG1 THR 71 1HG THR 71 -2.146 15.719 -17.174
521 1HG2 THR 71 1HG2 THR 71 -1.774 13.040 -17.628
522 2HG2 THR 71 2HG2 THR 71 -0.056 12.918 -17.247
523 3HG2 THR 71 3HG2 THR 71 -0.654 14.273 -18.205
524 H ASP 72 H ASP 72 -3.079 14.789 -13.668
525 HA ASP 72 HA ASP 72 -1.671 14.882 -11.175
526 1HB ASP 72 2HB ASP 72 -0.607 16.766 -12.320
527 2HB ASP 72 1HB ASP 72 -2.189 17.466 -12.657
528 H GLY 73 H GLY 73 -3.471 13.811 -10.429
529 1HA GLY 73 2HA GLY 73 -5.445 15.547 -9.325
530 2HA GLY 73 1HA GLY 73 -6.124 14.516 -10.579
531 H SER 74 H SER 74 -6.461 12.378 -10.177
532 HA SER 74 HA SER 74 -5.359 11.252 -7.719
533 1HB SER 74 2HB SER 74 -8.224 11.018 -8.656
534 2HB SER 74 1HB SER 74 -7.521 10.134 -7.314
535 HG SER 74 HG SER 74 -7.119 12.839 -7.186
536 H ILE 75 H ILE 75 -5.257 8.928 -7.757
537 HA ILE 75 HA ILE 75 -5.324 7.797 -10.485
538 HB ILE 75 HB ILE 75 -3.386 6.975 -8.314
539 1HG1 ILE 75 2HG1 ILE 75 -2.938 8.836 -10.661
540 2HG1 ILE 75 1HG1 ILE 75 -2.888 9.269 -8.957
541 1HG2 ILE 75 1HG2 ILE 75 -2.222 5.839 -10.141
542 2HG2 ILE 75 2HG2 ILE 75 -3.460 6.382 -11.271
543 3HG2 ILE 75 3HG2 ILE 75 -3.881 5.260 -9.978
544 1HD1 ILE 75 1HD1 ILE 75 -0.658 9.065 -9.891
545 2HD1 ILE 75 2HD1 ILE 75 -0.992 7.394 -10.350
546 3HD1 ILE 75 3HD1 ILE 75 -0.940 7.848 -8.646
547 H GLU 76 H GLU 76 -6.444 5.945 -10.706
548 HA GLU 76 HA GLU 76 -7.386 4.623 -8.245
549 1HB GLU 76 2HB GLU 76 -9.124 5.602 -9.846
550 2HB GLU 76 1HB GLU 76 -8.606 4.368 -10.984
551 1HG GLU 76 2HG GLU 76 -9.260 2.615 -9.455
552 2HG GLU 76 1HG GLU 76 -9.710 3.815 -8.247
553 H ILE 77 H ILE 77 -6.514 2.740 -7.855
554 HA ILE 77 HA ILE 77 -5.315 1.230 -10.073
555 HB ILE 77 HB ILE 77 -3.472 0.554 -8.546
556 1HG1 ILE 77 2HG1 ILE 77 -4.531 2.763 -6.766
557 2HG1 ILE 77 1HG1 ILE 77 -4.654 1.040 -6.420
558 1HG2 ILE 77 1HG2 ILE 77 -2.196 2.614 -8.729
559 2HG2 ILE 77 2HG2 ILE 77 -3.683 3.523 -8.995
560 3HG2 ILE 77 3HG2 ILE 77 -3.151 2.335 -10.184
561 1HD1 ILE 77 1HD1 ILE 77 -2.109 2.635 -6.659
562 2HD1 ILE 77 2HD1 ILE 77 -2.207 0.902 -6.350
563 3HD1 ILE 77 3HD1 ILE 77 -2.843 2.045 -5.168
564 H GLN 78 H GLN 78 -5.019 -1.032 -9.651
565 HA GLN 78 HA GLN 78 -6.728 -2.113 -7.530
566 1HB GLN 78 2HB GLN 78 -7.964 -1.938 -9.718
567 2HB GLN 78 1HB GLN 78 -6.795 -3.053 -10.401
568 1HG GLN 78 2HG GLN 78 -7.550 -4.831 -9.087
569 2HG GLN 78 1HG GLN 78 -8.431 -3.758 -7.995
570 1HE2 GLN 78 1HE2 GLN 78 -10.369 -4.826 -8.297
571 2HE2 GLN 78 2HE2 GLN 78 -11.269 -4.737 -9.765
572 H TYR 79 H TYR 79 -5.769 -3.757 -6.482
573 HA TYR 79 HA TYR 79 -3.112 -4.529 -7.358
574 1HB TYR 79 2HB TYR 79 -4.638 -5.275 -4.854
575 2HB TYR 79 1HB TYR 79 -2.942 -5.628 -5.163
576 HD1 TYR 79 2HD TYR 79 -1.479 -3.503 -5.746
577 HD2 TYR 79 1HD TYR 79 -5.155 -3.396 -3.613
578 HE1 TYR 79 2HE TYR 79 -0.843 -1.336 -4.776
579 HE2 TYR 79 1HE TYR 79 -4.532 -1.225 -2.636
580 HH TYR 79 HH TYR 79 -2.412 0.038 -2.155
581 H LEU 80 H LEU 80 -2.592 -6.430 -8.245
582 HA LEU 80 HA LEU 80 -4.799 -8.160 -8.984
583 1HB LEU 80 2HB LEU 80 -1.896 -8.142 -9.814
584 2HB LEU 80 1HB LEU 80 -3.114 -9.227 -10.465
585 HG LEU 80 HG LEU 80 -3.332 -6.221 -10.658
586 1HD1 LEU 80 1HD1 LEU 80 -2.558 -6.443 -12.956
587 2HD1 LEU 80 2HD1 LEU 80 -2.258 -8.162 -12.701
588 3HD1 LEU 80 3HD1 LEU 80 -1.314 -6.960 -11.818
589 1HD2 LEU 80 1HD2 LEU 80 -4.700 -8.436 -12.186
590 2HD2 LEU 80 2HD2 LEU 80 -4.979 -6.703 -12.366
591 3HD2 LEU 80 3HD2 LEU 80 -5.420 -7.514 -10.864
592 H GLY 81 H GLY 81 -4.435 -10.563 -8.933
593 1HA GLY 81 2HA GLY 81 -3.445 -12.405 -7.689
594 2HA GLY 81 1HA GLY 81 -3.125 -11.268 -6.384
595 HA PRO 82 HA PRO 82 -6.942 -13.545 -5.133
596 1HB PRO 82 2HB PRO 82 -5.970 -12.707 -2.474
597 2HB PRO 82 1HB PRO 82 -6.434 -14.311 -3.048
598 1HG PRO 82 2HG PRO 82 -3.869 -13.668 -2.598
599 2HG PRO 82 1HG PRO 82 -4.346 -14.754 -3.915
600 1HD PRO 82 2HD PRO 82 -3.555 -11.874 -4.026
601 2HD PRO 82 1HD PRO 82 -3.172 -13.194 -5.151
602 H TYR 83 H TYR 83 -5.738 -10.362 -4.650
603 HA TYR 83 HA TYR 83 -8.312 -9.460 -3.537
604 1HB TYR 83 2HB TYR 83 -5.709 -7.930 -3.457
605 2HB TYR 83 1HB TYR 83 -7.159 -7.643 -2.503
606 HD1 TYR 83 1HD TYR 83 -7.791 -9.380 -0.750
607 HD2 TYR 83 2HD TYR 83 -3.995 -9.292 -2.658
608 HE1 TYR 83 1HE TYR 83 -6.846 -10.734 1.075
609 HE2 TYR 83 2HE TYR 83 -3.037 -10.644 -0.847
610 HH TYR 83 HH TYR 83 -4.898 -12.293 1.404
611 H TYR 84 H TYR 84 -7.955 -9.904 -6.378
612 HA TYR 84 HA TYR 84 -7.199 -7.332 -7.451
613 1HB TYR 84 2HB TYR 84 -6.657 -8.338 -9.429
614 2HB TYR 84 1HB TYR 84 -6.348 -9.645 -8.299
615 HD1 TYR 84 1HD TYR 84 -8.299 -11.380 -8.005
616 HD2 TYR 84 2HD TYR 84 -7.957 -8.695 -11.281
617 HE1 TYR 84 1HE TYR 84 -9.707 -12.869 -9.368
618 HE2 TYR 84 2HE TYR 84 -9.373 -10.165 -12.646
619 HH TYR 84 HH TYR 84 -11.148 -12.759 -11.352
620 HA PRO 85 HA PRO 85 -11.557 -7.050 -8.603
621 1HB PRO 85 2HB PRO 85 -13.485 -7.820 -6.910
622 2HB PRO 85 1HB PRO 85 -12.816 -8.906 -8.131
623 1HG PRO 85 2HG PRO 85 -12.340 -8.829 -5.203
624 2HG PRO 85 1HG PRO 85 -12.316 -10.209 -6.311
625 1HD PRO 85 2HD PRO 85 -10.083 -8.776 -5.328
626 2HD PRO 85 1HD PRO 85 -10.080 -10.007 -6.604
627 H LEU 86 H LEU 86 -9.954 -6.416 -5.775
628 HA LEU 86 HA LEU 86 -11.777 -4.249 -4.969
629 1HB LEU 86 2HB LEU 86 -11.166 -6.002 -3.292
630 2HB LEU 86 1HB LEU 86 -9.500 -5.475 -3.413
631 HG LEU 86 HG LEU 86 -10.081 -3.298 -2.494
632 1HD1 LEU 86 1HD1 LEU 86 -12.320 -3.052 -3.402
633 2HD1 LEU 86 2HD1 LEU 86 -12.345 -2.863 -1.649
634 3HD1 LEU 86 3HD1 LEU 86 -12.900 -4.370 -2.381
635 1HD2 LEU 86 1HD2 LEU 86 -11.162 -5.624 -0.909
636 2HD2 LEU 86 2HD2 LEU 86 -10.777 -4.039 -0.240
637 3HD2 LEU 86 3HD2 LEU 86 -9.498 -5.040 -0.930
638 H LYS 87 H LYS 87 -11.087 -2.135 -5.024
639 HA LYS 87 HA LYS 87 -8.439 -1.737 -6.240
640 1HB LYS 87 2HB LYS 87 -9.361 0.211 -7.403
641 2HB LYS 87 1HB LYS 87 -10.229 -1.258 -7.810
642 1HG LYS 87 2HG LYS 87 -11.983 -0.581 -6.158
643 2HG LYS 87 1HG LYS 87 -11.142 0.966 -6.000
644 1HD LYS 87 2HD LYS 87 -11.400 1.345 -8.412
645 2HD LYS 87 1HD LYS 87 -12.249 -0.193 -8.560
646 1HE LYS 87 2HE LYS 87 -13.960 1.380 -8.487
647 2HE LYS 87 1HE LYS 87 -13.882 0.770 -6.836
648 1HZ LYS 87 1HZ LYS 87 -12.658 3.303 -7.802
649 2HZ LYS 87 2HZ LYS 87 -12.606 2.722 -6.206
650 3HZ LYS 87 3HZ LYS 87 -14.084 3.175 -6.895
651 H SER 88 H SER 88 -7.749 0.652 -6.059
652 HA SER 88 HA SER 88 -8.284 1.789 -3.421
653 1HB SER 88 2HB SER 88 -6.384 0.270 -3.070
654 2HB SER 88 1HB SER 88 -5.515 1.022 -4.401
655 HG SER 88 HG SER 88 -6.405 2.504 -2.164
656 H THR 89 H THR 89 -7.151 3.991 -3.250
657 HA THR 89 HA THR 89 -6.886 5.248 -5.894
658 HB THR 89 HB THR 89 -8.399 6.566 -3.659
659 HG1 THR 89 1HG THR 89 -9.246 4.679 -5.553
660 1HG2 THR 89 1HG2 THR 89 -7.558 8.052 -5.388
661 2HG2 THR 89 2HG2 THR 89 -9.314 7.929 -5.498
662 3HG2 THR 89 3HG2 THR 89 -8.294 7.048 -6.636
663 H LEU 90 H LEU 90 -5.509 6.931 -6.009
664 HA LEU 90 HA LEU 90 -3.970 7.626 -3.590
665 1HB LEU 90 2HB LEU 90 -2.941 7.285 -6.415
666 2HB LEU 90 1HB LEU 90 -1.990 7.890 -5.072
667 HG LEU 90 HG LEU 90 -3.180 5.119 -5.243
668 1HD1 LEU 90 1HD1 LEU 90 -0.332 6.046 -5.607
669 2HD1 LEU 90 2HD1 LEU 90 -1.402 5.470 -6.884
670 3HD1 LEU 90 3HD1 LEU 90 -0.890 4.371 -5.604
671 1HD2 LEU 90 1HD2 LEU 90 -1.751 4.655 -3.307
672 2HD2 LEU 90 2HD2 LEU 90 -2.950 5.897 -2.949
673 3HD2 LEU 90 3HD2 LEU 90 -1.273 6.353 -3.255
674 H LYS 91 H LYS 91 -3.699 9.763 -3.214
675 HA LYS 91 HA LYS 91 -4.292 11.649 -5.397
676 1HB LYS 91 2HB LYS 91 -5.296 11.833 -2.552
677 2HB LYS 91 1HB LYS 91 -5.412 13.133 -3.728
678 1HG LYS 91 2HG LYS 91 -6.894 11.876 -5.089
679 2HG LYS 91 1HG LYS 91 -6.620 10.419 -4.135
680 1HD LYS 91 2HD LYS 91 -7.626 11.555 -2.179
681 2HD LYS 91 1HD LYS 91 -7.969 12.952 -3.202
682 1HE LYS 91 2HE LYS 91 -9.010 10.162 -3.679
683 2HE LYS 91 1HE LYS 91 -9.919 11.457 -2.900
684 1HZ LYS 91 1HZ LYS 91 -8.807 11.687 -5.640
685 2HZ LYS 91 2HZ LYS 91 -9.943 12.702 -4.892
686 3HZ LYS 91 3HZ LYS 91 -10.372 11.117 -5.321
687 H ARG 92 H ARG 92 -3.446 13.836 -4.943
688 HA ARG 92 HA ARG 92 -0.748 13.604 -3.944
689 1HB ARG 92 2HB ARG 92 -0.371 15.749 -4.959
690 2HB ARG 92 1HB ARG 92 -1.265 14.747 -6.090
691 1HG ARG 92 2HG ARG 92 -3.331 15.868 -5.420
692 2HG ARG 92 1HG ARG 92 -2.406 16.900 -4.334
693 1HD ARG 92 2HD ARG 92 -1.113 17.709 -6.299
694 2HD ARG 92 1HD ARG 92 -2.188 16.771 -7.339
695 HE ARG 92 HE ARG 92 -3.107 18.973 -5.599
696 1HH1 ARG 92 1HH1 ARG 92 -3.134 17.279 -8.660
697 2HH1 ARG 92 2HH1 ARG 92 -4.480 18.185 -9.288
698 1HH2 ARG 92 1HH2 ARG 92 -4.847 20.182 -6.427
699 2HH2 ARG 92 2HH2 ARG 92 -5.443 19.839 -8.026
700 H GLY 93 H GLY 93 0.128 14.757 -2.238
701 1HA GLY 93 2HA GLY 93 -1.791 15.826 -0.323
702 2HA GLY 93 1HA GLY 93 -0.110 15.411 0.002
703 H GLU 94 H GLU 94 -1.470 17.848 0.654
704 HA GLU 94 HA GLU 94 -0.823 19.869 -1.228
705 1HB GLU 94 2HB GLU 94 -1.421 21.398 0.689
706 2HB GLU 94 1HB GLU 94 -2.672 20.284 0.166
707 1HG GLU 94 2HG GLU 94 -2.117 18.805 2.041
708 2HG GLU 94 1HG GLU 94 -0.885 19.952 2.567
709 H ASN 95 H ASN 95 1.079 18.201 0.983
710 HA ASN 95 HA ASN 95 3.228 20.130 0.567
711 1HB ASN 95 2HB ASN 95 2.420 19.071 3.277
712 2HB ASN 95 1HB ASN 95 4.010 19.753 2.954
713 1HD2 ASN 95 1HD2 ASN 95 0.668 20.410 3.455
714 2HD2 ASN 95 2HD2 ASN 95 0.803 22.131 3.521
715 H GLY 96 H GLY 96 3.722 18.459 -1.008
716 1HA GLY 96 2HA GLY 96 4.941 16.650 -1.741
717 2HA GLY 96 1HA GLY 96 5.969 17.026 -0.369
718 H THR 97 H THR 97 2.695 15.628 -0.626
719 HA THR 97 HA THR 97 3.666 13.278 0.823
720 HB THR 97 HB THR 97 1.251 13.591 2.000
721 HG1 THR 97 1HG THR 97 2.290 16.232 1.912
722 1HG2 THR 97 1HG2 THR 97 3.354 13.157 3.157
723 2HG2 THR 97 2HG2 THR 97 2.473 14.464 3.952
724 3HG2 THR 97 3HG2 THR 97 3.850 14.831 2.911
725 H LEU 98 H LEU 98 1.874 11.545 0.898
726 HA LEU 98 HA LEU 98 0.323 11.636 -1.607
727 1HB LEU 98 2HB LEU 98 2.295 10.136 -1.772
728 2HB LEU 98 1HB LEU 98 1.680 9.214 -0.413
729 HG LEU 98 HG LEU 98 -0.369 8.716 -1.798
730 1HD1 LEU 98 1HD1 LEU 98 -0.207 9.002 -4.216
731 2HD1 LEU 98 2HD1 LEU 98 1.331 9.839 -4.021
732 3HD1 LEU 98 3HD1 LEU 98 -0.146 10.561 -3.390
733 1HD2 LEU 98 1HD2 LEU 98 0.726 6.976 -3.115
734 2HD2 LEU 98 2HD2 LEU 98 1.420 7.084 -1.497
735 3HD2 LEU 98 3HD2 LEU 98 2.285 7.768 -2.874
736 H ILE 99 H ILE 99 -1.759 11.080 -1.463
737 HA ILE 99 HA ILE 99 -2.771 10.226 1.160
738 HB ILE 99 HB ILE 99 -4.216 11.477 -1.181
739 1HG1 ILE 99 2HG1 ILE 99 -3.576 12.597 1.558
740 2HG1 ILE 99 1HG1 ILE 99 -2.720 13.006 0.076
741 1HG2 ILE 99 1HG2 ILE 99 -6.161 11.599 0.296
742 2HG2 ILE 99 2HG2 ILE 99 -5.271 10.714 1.537
743 3HG2 ILE 99 3HG2 ILE 99 -5.665 9.932 0.006
744 1HD1 ILE 99 1HD1 ILE 99 -4.309 14.733 0.660
745 2HD1 ILE 99 2HD1 ILE 99 -5.619 13.553 0.658
746 3HD1 ILE 99 3HD1 ILE 99 -4.785 13.945 -0.845
747 H TRP 100 H TRP 100 -3.239 8.153 1.366
748 HA TRP 100 HA TRP 100 -3.817 6.578 -1.054
749 1HB TRP 100 2HB TRP 100 -1.749 5.981 0.188
750 2HB TRP 100 1HB TRP 100 -2.724 5.657 1.614
751 HD1 TRP 100 HD TRP 100 -4.235 4.392 -1.603
752 HE1 TRP 100 1HE TRP 100 -3.989 1.848 -1.723
753 HE3 TRP 100 3HE TRP 100 -1.055 3.704 2.342
754 HZ2 TRP 100 2HZ TRP 100 -2.623 -0.200 -0.333
755 HZ3 TRP 100 3HZ TRP 100 -0.323 1.415 2.877
756 HH2 TRP 100 HH TRP 100 -1.092 -0.496 1.565
757 H GLU 101 H GLU 101 -5.905 6.141 -1.279
758 HA GLU 101 HA GLU 101 -7.525 5.759 1.152
759 1HB GLU 101 2HB GLU 101 -8.122 6.943 -1.484
760 2HB GLU 101 1HB GLU 101 -9.400 6.001 -0.746
761 1HG GLU 101 2HG GLU 101 -9.233 7.384 1.269
762 2HG GLU 101 1HG GLU 101 -7.994 8.356 0.481
763 H GLN 102 H GLN 102 -8.554 3.958 1.495
764 HA GLN 102 HA GLN 102 -8.954 2.009 -0.605
765 1HB GLN 102 2HB GLN 102 -6.599 1.735 0.504
766 2HB GLN 102 1HB GLN 102 -7.507 1.029 1.832
767 1HG GLN 102 2HG GLN 102 -7.759 0.061 -0.997
768 2HG GLN 102 1HG GLN 102 -6.562 -0.572 0.125
769 1HE2 GLN 102 1HE2 GLN 102 -8.909 -1.778 -1.233
770 2HE2 GLN 102 2HE2 GLN 102 -9.836 -2.495 0.037
771 H ASN 103 H ASN 103 -10.957 1.384 -0.398
772 HA ASN 103 HA ASN 103 -12.882 0.545 0.439
773 1HB ASN 103 2HB ASN 103 -10.934 -0.159 2.533
774 2HB ASN 103 1HB ASN 103 -12.613 -0.130 3.052
775 1HD2 ASN 103 1HD2 ASN 103 -10.660 -2.330 2.648
776 2HD2 ASN 103 2HD2 ASN 103 -11.474 -3.453 1.615
777 H GLY 104 H GLY 104 -11.477 2.189 3.226
778 1HA GLY 104 2HA GLY 104 -13.452 4.287 3.119
779 2HA GLY 104 1HA GLY 104 -13.742 3.134 4.408
780 H GLN 105 H GLN 105 -10.430 3.284 4.006
781 HA GLN 105 HA GLN 105 -10.250 5.373 6.068
782 1HB GLN 105 2HB GLN 105 -8.320 3.092 5.615
783 2HB GLN 105 1HB GLN 105 -8.299 4.247 6.942
784 1HG GLN 105 2HG GLN 105 -10.649 3.337 7.472
785 2HG GLN 105 1HG GLN 105 -10.184 1.987 6.442
786 1HE2 GLN 105 1HE2 GLN 105 -10.761 2.033 9.305
787 2HE2 GLN 105 2HE2 GLN 105 -9.338 1.408 10.077
788 H ARG 106 H ARG 106 -8.926 7.034 5.761
789 HA ARG 106 HA ARG 106 -7.460 7.149 3.224
790 1HB ARG 106 2HB ARG 106 -9.195 8.867 3.670
791 2HB ARG 106 1HB ARG 106 -8.283 9.386 5.079
792 1HG ARG 106 2HG ARG 106 -6.505 10.200 3.738
793 2HG ARG 106 1HG ARG 106 -7.157 9.423 2.292
794 1HD ARG 106 2HD ARG 106 -8.522 11.631 3.835
795 2HD ARG 106 1HD ARG 106 -7.592 11.856 2.352
796 HE ARG 106 HE ARG 106 -9.257 10.479 1.208
797 1HH1 ARG 106 1HH1 ARG 106 -10.135 11.854 4.307
798 2HH1 ARG 106 2HH1 ARG 106 -11.846 11.718 4.035
799 1HH2 ARG 106 1HH2 ARG 106 -11.490 10.301 0.828
800 2HH2 ARG 106 2HH2 ARG 106 -12.628 10.803 2.048
801 H LYS 107 H LYS 107 -5.351 6.708 3.373
802 HA LYS 107 HA LYS 107 -3.955 7.225 5.892
803 1HB LYS 107 2HB LYS 107 -3.308 5.599 3.459
804 2HB LYS 107 1HB LYS 107 -2.016 6.120 4.529
805 1HG LYS 107 2HG LYS 107 -4.380 4.412 5.267
806 2HG LYS 107 1HG LYS 107 -2.702 3.898 5.108
807 1HD LYS 107 2HD LYS 107 -2.121 5.512 6.927
808 2HD LYS 107 1HD LYS 107 -3.852 5.764 7.166
809 1HE LYS 107 2HE LYS 107 -3.341 4.132 8.731
810 2HE LYS 107 1HE LYS 107 -3.968 3.201 7.377
811 1HZ LYS 107 1HZ LYS 107 -1.171 3.482 8.289
812 2HZ LYS 107 2HZ LYS 107 -1.510 3.004 6.698
813 3HZ LYS 107 3HZ LYS 107 -2.058 2.063 8.002
814 H THR 108 H THR 108 -2.482 8.777 6.159
815 HA THR 108 HA THR 108 -1.699 10.364 3.812
816 HB THR 108 HB THR 108 -1.500 11.156 6.729
817 HG1 THR 108 1HG THR 108 -3.653 11.020 5.146
818 1HG2 THR 108 1HG2 THR 108 -1.179 13.412 5.848
819 2HG2 THR 108 2HG2 THR 108 -1.304 12.799 4.199
820 3HG2 THR 108 3HG2 THR 108 0.055 12.321 5.216
821 H MET 109 H MET 109 0.270 9.854 3.069
822 HA MET 109 HA MET 109 2.159 8.623 4.965
823 1HB MET 109 2HB MET 109 2.098 8.290 1.963
824 2HB MET 109 1HB MET 109 3.078 7.388 3.110
825 1HG MET 109 2HG MET 109 0.986 6.481 4.096
826 2HG MET 109 1HG MET 109 0.089 7.278 2.802
827 1HE MET 109 1HE MET 109 3.039 3.782 2.260
828 2HE MET 109 2HE MET 109 2.500 4.418 3.814
829 3HE MET 109 3HE MET 109 3.566 5.381 2.790
830 H THR 110 H THR 110 4.305 9.241 4.950
831 HA THR 110 HA THR 110 4.741 11.929 3.883
832 HB THR 110 HB THR 110 6.719 10.513 5.620
833 HG1 THR 110 1HG THR 110 5.503 10.712 7.374
834 1HG2 THR 110 1HG2 THR 110 5.793 13.379 5.436
835 2HG2 THR 110 2HG2 THR 110 7.279 12.722 4.751
836 3HG2 THR 110 3HG2 THR 110 7.066 12.782 6.501
837 H ARG 111 H ARG 111 6.710 12.446 2.787
838 HA ARG 111 HA ARG 111 7.533 10.291 1.011
839 1HB ARG 111 2HB ARG 111 7.908 11.888 -0.554
840 2HB ARG 111 1HB ARG 111 6.897 12.876 0.486
841 1HG ARG 111 2HG ARG 111 9.179 13.463 1.623
842 2HG ARG 111 1HG ARG 111 9.838 12.949 0.069
843 1HD ARG 111 2HD ARG 111 8.243 14.522 -1.041
844 2HD ARG 111 1HD ARG 111 7.805 15.123 0.555
845 HE ARG 111 HE ARG 111 10.506 15.345 -0.623
846 1HH1 ARG 111 1HH1 ARG 111 8.010 16.500 1.551
847 2HH1 ARG 111 2HH1 ARG 111 8.817 18.013 1.861
848 1HH2 ARG 111 1HH2 ARG 111 11.539 17.327 -0.231
849 2HH2 ARG 111 2HH2 ARG 111 10.796 18.498 0.818
850 H ILE 112 H ILE 112 9.598 9.565 0.836
851 HA ILE 112 HA ILE 112 11.386 10.194 3.044
852 HB ILE 112 HB ILE 112 11.713 8.117 0.887
853 1HG1 ILE 112 2HG1 ILE 112 9.618 7.857 2.210
854 2HG1 ILE 112 1HG1 ILE 112 10.744 6.532 2.424
855 1HG2 ILE 112 1HG2 ILE 112 13.226 7.044 2.516
856 2HG2 ILE 112 2HG2 ILE 112 13.033 8.440 3.577
857 3HG2 ILE 112 3HG2 ILE 112 13.796 8.632 1.998
858 1HD1 ILE 112 1HD1 ILE 112 10.359 8.821 4.329
859 2HD1 ILE 112 2HD1 ILE 112 11.451 7.452 4.556
860 3HD1 ILE 112 3HD1 ILE 112 9.708 7.195 4.519
861 H GLU 113 H GLU 113 13.520 10.828 2.733
862 HA GLU 113 HA GLU 113 13.945 12.372 0.293
863 1HB GLU 113 2HB GLU 113 15.607 12.338 2.806
864 2HB GLU 113 1HB GLU 113 15.712 13.500 1.498
865 1HG GLU 113 2HG GLU 113 13.444 14.279 2.024
866 2HG GLU 113 1HG GLU 113 13.388 13.148 3.377
867 H SER 114 H SER 114 14.566 10.900 -1.182
868 HA SER 114 HA SER 114 17.209 9.751 -0.825
869 1HB SER 114 2HB SER 114 14.789 8.099 -1.585
870 2HB SER 114 1HB SER 114 16.461 7.538 -1.667
871 HG SER 114 HG SER 114 15.956 8.600 0.753
872 H LYS 115 H LYS 115 18.326 10.467 -2.448
873 HA LYS 115 HA LYS 115 17.112 11.159 -4.983
874 1HB LYS 115 2HB LYS 115 19.467 11.878 -5.545
875 2HB LYS 115 1HB LYS 115 18.739 12.698 -4.173
876 1HG LYS 115 2HG LYS 115 19.962 11.073 -2.689
877 2HG LYS 115 1HG LYS 115 20.828 10.538 -4.129
878 1HD LYS 115 2HD LYS 115 21.801 12.676 -4.442
879 2HD LYS 115 1HD LYS 115 20.724 13.413 -3.253
880 1HE LYS 115 2HE LYS 115 21.777 12.036 -1.497
881 2HE LYS 115 1HE LYS 115 22.895 11.393 -2.698
882 1HZ LYS 115 1HZ LYS 115 23.775 13.584 -3.055
883 2HZ LYS 115 2HZ LYS 115 23.850 13.219 -1.398
884 3HZ LYS 115 3HZ LYS 115 22.653 14.264 -1.983
885 H THR 116 H THR 116 17.283 8.365 -4.058
886 HA THR 116 HA THR 116 19.061 7.170 -6.059
887 HB THR 116 HB THR 116 17.651 5.758 -3.788
888 HG1 THR 116 1HG THR 116 19.202 6.408 -2.472
889 1HG2 THR 116 1HG2 THR 116 19.444 4.099 -4.084
890 2HG2 THR 116 2HG2 THR 116 20.091 5.043 -5.426
891 3HG2 THR 116 3HG2 THR 116 18.496 4.299 -5.558
892 H GLY 117 H GLY 117 18.262 5.648 -7.526
893 1HA GLY 117 2HA GLY 117 15.533 4.781 -7.501
894 2HA GLY 117 1HA GLY 117 15.833 6.012 -8.727
895 H ARG 118 H ARG 118 15.040 3.576 -9.633
896 HA ARG 118 HA ARG 118 15.586 1.951 -11.128
897 1HB ARG 118 2HB ARG 118 16.799 3.790 -12.222
898 2HB ARG 118 1HB ARG 118 18.209 3.459 -11.237
899 1HG ARG 118 2HG ARG 118 18.415 1.257 -12.331
900 2HG ARG 118 1HG ARG 118 17.044 1.675 -13.363
901 1HD ARG 118 2HD ARG 118 19.258 2.089 -14.427
902 2HD ARG 118 1HD ARG 118 18.238 3.524 -14.314
903 HE ARG 118 HE ARG 118 20.531 2.943 -12.534
904 1HH1 ARG 118 1HH1 ARG 118 18.398 5.196 -14.155
905 2HH1 ARG 118 2HH1 ARG 118 19.245 6.604 -13.597
906 1HH2 ARG 118 1HH2 ARG 118 21.639 4.803 -11.781
907 2HH2 ARG 118 2HH2 ARG 118 21.083 6.377 -12.254
908 H GLU 119 H GLU 119 16.285 1.879 -8.205
909 HA GLU 119 HA GLU 119 18.502 0.004 -8.102
910 1HB GLU 119 2HB GLU 119 17.071 1.714 -6.176
911 2HB GLU 119 1HB GLU 119 17.570 0.151 -5.547
912 1HG GLU 119 2HG GLU 119 19.520 1.875 -7.008
913 2HG GLU 119 1HG GLU 119 19.148 2.177 -5.311
914 H GLU 120 H GLU 120 17.952 -1.976 -8.765
915 HA GLU 120 HA GLU 120 15.382 -3.119 -8.119
916 1HB GLU 120 2HB GLU 120 17.830 -4.343 -9.408
917 2HB GLU 120 1HB GLU 120 16.277 -5.147 -9.235
918 1HG GLU 120 2HG GLU 120 15.265 -3.316 -10.595
919 2HG GLU 120 1HG GLU 120 16.898 -2.714 -10.885
920 H LYS 121 H LYS 121 14.935 -4.533 -6.525
921 HA LYS 121 HA LYS 121 17.083 -5.719 -4.982
922 1HB LYS 121 2HB LYS 121 15.882 -3.341 -4.160
923 2HB LYS 121 1HB LYS 121 15.156 -4.583 -3.156
924 1HG LYS 121 2HG LYS 121 17.088 -5.021 -2.064
925 2HG LYS 121 1HG LYS 121 18.092 -4.666 -3.473
926 1HD LYS 121 2HD LYS 121 16.660 -2.601 -1.804
927 2HD LYS 121 1HD LYS 121 18.368 -3.020 -1.649
928 1HE LYS 121 2HE LYS 121 17.026 -1.882 -4.103
929 2HE LYS 121 1HE LYS 121 18.084 -1.007 -2.998
930 1HZ LYS 121 1HZ LYS 121 19.874 -2.555 -3.592
931 2HZ LYS 121 2HZ LYS 121 19.311 -1.687 -4.939
932 3HZ LYS 121 3HZ LYS 121 18.854 -3.304 -4.720
933 H ASP 122 H ASP 122 16.417 -7.678 -5.541
934 HA ASP 122 HA ASP 122 13.616 -8.419 -5.166
935 1HB ASP 122 2HB ASP 122 14.673 -9.085 -7.269
936 2HB ASP 122 1HB ASP 122 15.883 -9.996 -6.380
937 H GLU 123 H GLU 123 12.955 -9.368 -3.478
938 HA GLU 123 HA GLU 123 14.562 -11.339 -2.088
939 1HB GLU 123 2HB GLU 123 14.608 -8.847 -1.031
940 2HB GLU 123 1HB GLU 123 13.150 -9.466 -0.273
941 1HG GLU 123 2HG GLU 123 15.888 -10.711 -0.130
942 2HG GLU 123 1HG GLU 123 15.103 -9.780 1.142
943 H LYS 124 H LYS 124 13.043 -12.665 -3.153
944 HA LYS 124 HA LYS 124 10.245 -12.307 -2.696
945 1HB LYS 124 2HB LYS 124 10.115 -14.603 -3.818
946 2HB LYS 124 1HB LYS 124 10.740 -13.265 -4.771
947 1HG LYS 124 2HG LYS 124 13.048 -14.043 -4.194
948 2HG LYS 124 1HG LYS 124 12.314 -15.474 -3.468
949 1HD LYS 124 2HD LYS 124 13.070 -15.886 -5.773
950 2HD LYS 124 1HD LYS 124 11.323 -16.075 -5.602
951 1HE LYS 124 2HE LYS 124 10.971 -13.862 -6.526
952 2HE LYS 124 1HE LYS 124 12.711 -13.604 -6.636
953 1HZ LYS 124 1HZ LYS 124 11.320 -15.810 -8.045
954 2HZ LYS 124 2HZ LYS 124 12.896 -15.235 -8.306
955 3HZ LYS 124 3HZ LYS 124 11.562 -14.281 -8.740
956 H SER 125 H SER 125 10.185 -12.272 -0.424
957 HA SER 125 HA SER 125 10.748 -14.652 1.074
958 1HB SER 125 2HB SER 125 9.563 -13.415 2.908
959 2HB SER 125 1HB SER 125 10.889 -12.502 2.189
960 HG SER 125 HG SER 125 9.389 -11.020 2.018
961 H LYS 126 H LYS 126 8.743 -15.406 2.529
962 HA LYS 126 HA LYS 126 6.389 -15.664 0.808
963 1HB LYS 126 2HB LYS 126 8.082 -17.620 0.603
964 2HB LYS 126 1HB LYS 126 7.497 -18.086 2.196
965 1HG LYS 126 2HG LYS 126 5.468 -18.733 1.414
966 2HG LYS 126 1HG LYS 126 5.470 -17.550 0.103
967 1HD LYS 126 2HD LYS 126 7.197 -18.900 -1.052
968 2HD LYS 126 1HD LYS 126 7.064 -20.110 0.225
969 1HE LYS 126 2HE LYS 126 4.778 -20.550 -0.349
970 2HE LYS 126 1HE LYS 126 4.763 -19.210 -1.497
971 1HZ LYS 126 1HZ LYS 126 6.246 -20.359 -2.924
972 2HZ LYS 126 2HZ LYS 126 5.034 -21.469 -2.500
973 3HZ LYS 126 3HZ LYS 126 6.559 -21.556 -1.765
974 H SER 127 H SER 127 6.798 -14.052 3.052
975 HA SER 127 HA SER 127 5.377 -15.327 5.232
976 1HB SER 127 2HB SER 127 6.285 -12.457 4.890
977 2HB SER 127 1HB SER 127 5.622 -13.157 6.367
978 HG SER 127 HG SER 127 7.833 -14.408 5.167
979 H LEU 128 H LEU 128 3.267 -15.575 5.066
980 HA LEU 128 HA LEU 128 1.684 -13.483 3.741
981 1HB LEU 128 2HB LEU 128 -0.106 -15.336 3.715
982 2HB LEU 128 1HB LEU 128 1.226 -15.451 2.584
983 HG LEU 128 HG LEU 128 2.309 -17.017 4.332
984 1HD1 LEU 128 1HD1 LEU 128 -0.567 -17.178 5.217
985 2HD1 LEU 128 2HD1 LEU 128 0.771 -16.531 6.165
986 3HD1 LEU 128 3HD1 LEU 128 0.743 -18.240 5.734
987 1HD2 LEU 128 1HD2 LEU 128 1.480 -17.730 2.155
988 2HD2 LEU 128 2HD2 LEU 128 -0.147 -17.879 2.817
989 3HD2 LEU 128 3HD2 LEU 128 1.140 -18.937 3.396
990 H GLU 129 H GLU 129 2.724 -13.266 6.366
991 HA GLU 129 HA GLU 129 0.674 -14.018 8.245
992 1HB GLU 129 2HB GLU 129 3.137 -12.316 8.660
993 2HB GLU 129 1HB GLU 129 2.133 -13.016 9.923
994 1HG GLU 129 2HG GLU 129 3.840 -14.500 7.939
995 2HG GLU 129 1HG GLU 129 4.129 -14.321 9.669
996 H HIS 130 H HIS 130 -1.096 -12.889 8.519
997 HA HIS 130 HA HIS 130 -0.974 -10.011 8.779
998 1HB HIS 130 2HB HIS 130 -2.996 -9.754 7.235
999 2HB HIS 130 1HB HIS 130 -1.444 -10.015 6.457
1000 HD1 HIS 130 1HD HIS 130 -2.031 -11.239 4.371
1001 HD2 HIS 130 2HD HIS 130 -3.973 -12.816 7.693
1002 HE1 HIS 130 1HE HIS 130 -3.209 -13.297 3.552
1003 HE2 HIS 130 2HE HIS 130 -4.177 -14.357 5.625
1004 H HIS 131 H HIS 131 -2.531 -9.214 10.157
1005 HA HIS 131 HA HIS 131 -4.543 -11.125 11.130
1006 1HB HIS 131 2HB HIS 131 -2.710 -9.453 12.858
1007 2HB HIS 131 1HB HIS 131 -4.139 -10.281 13.460
1008 HD1 HIS 131 1HD HIS 131 -0.964 -10.738 14.108
1009 HD2 HIS 131 2HD HIS 131 -3.561 -13.201 11.979
1010 HE1 HIS 131 1HE HIS 131 0.020 -13.052 14.243
1011 HE2 HIS 131 2HE HIS 131 -1.664 -14.549 13.114
1012 H HIS 132 H HIS 132 -6.256 -10.042 12.422
1013 HA HIS 132 HA HIS 132 -7.002 -7.548 11.094
1014 1HB HIS 132 2HB HIS 132 -8.538 -9.610 12.658
1015 2HB HIS 132 1HB HIS 132 -9.229 -8.032 12.302
1016 HD1 HIS 132 1HD HIS 132 -10.208 -7.678 10.041
1017 HD2 HIS 132 2HD HIS 132 -8.042 -11.219 10.305
1018 HE1 HIS 132 1HE HIS 132 -10.696 -8.931 7.911
1019 HE2 HIS 132 2HE HIS 132 -9.496 -11.137 8.161
1020 H HIS 133 H HIS 133 -7.314 -5.651 12.085
1021 HA HIS 133 HA HIS 133 -7.251 -5.549 15.026
1022 1HB HIS 133 2HB HIS 133 -5.037 -4.839 14.287
1023 2HB HIS 133 1HB HIS 133 -5.747 -3.710 13.140
1024 HD1 HIS 133 1HD HIS 133 -5.339 -4.219 16.865
1025 HD2 HIS 133 2HD HIS 133 -6.355 -1.230 14.169
1026 HE1 HIS 133 1HE HIS 133 -5.384 -2.095 18.201
1027 HE2 HIS 133 2HE HIS 133 -6.268 -0.361 16.608
1028 H HIS 134 H HIS 134 -9.192 -4.857 15.602
1029 HA HIS 134 HA HIS 134 -10.867 -3.395 13.789
1030 1HB HIS 134 2HB HIS 134 -12.588 -3.566 15.446
1031 2HB HIS 134 1HB HIS 134 -11.735 -5.103 15.419
1032 HD1 HIS 134 1HD HIS 134 -10.489 -5.804 17.548
1033 HD2 HIS 134 2HD HIS 134 -12.246 -2.040 17.791
1034 HE1 HIS 134 1HE HIS 134 -10.397 -5.162 19.982
1035 HE2 HIS 134 2HE HIS 134 -11.547 -2.924 20.120
1036 H HIS 135 H HIS 135 -12.014 -1.388 14.533
1037 HA HIS 135 HA HIS 135 -10.179 0.363 16.020
1038 1HB HIS 135 2HB HIS 135 -10.590 2.188 14.477
1039 2HB HIS 135 1HB HIS 135 -9.987 0.800 13.583
1040 HD1 HIS 135 1HD HIS 135 -12.841 3.106 13.852
1041 HD2 HIS 135 2HD HIS 135 -11.962 -0.475 11.932
1042 HE1 HIS 135 1HE HIS 135 -14.620 2.825 12.093
1043 HE2 HIS 135 2HE HIS 135 -13.955 0.753 10.824
Start of MODEL 12
1 1H MET 1 1HT MET 1 9.568 37.174 8.830
2 2H MET 1 2HT MET 1 9.137 36.672 7.267
3 3H MET 1 3HT MET 1 10.763 36.947 7.644
4 HA MET 1 HA MET 1 10.815 35.121 9.148
5 1HB MET 1 2HB MET 1 8.485 35.304 9.922
6 2HB MET 1 1HB MET 1 7.915 34.735 8.359
7 1HG MET 1 2HG MET 1 9.068 32.597 8.748
8 2HG MET 1 1HG MET 1 9.572 33.176 10.335
9 1HE MET 1 1HE MET 1 5.172 32.474 9.145
10 2HE MET 1 2HE MET 1 6.525 32.169 8.057
11 3HE MET 1 3HE MET 1 6.127 33.822 8.533
12 H ILE 2 H ILE 2 12.141 33.858 8.031
13 HA ILE 2 HA ILE 2 11.665 33.514 5.202
14 HB ILE 2 HB ILE 2 13.889 32.392 5.176
15 1HG1 ILE 2 2HG1 ILE 2 14.063 33.263 8.069
16 2HG1 ILE 2 1HG1 ILE 2 13.815 31.597 7.540
17 1HG2 ILE 2 1HG2 ILE 2 13.786 35.144 6.404
18 2HG2 ILE 2 2HG2 ILE 2 13.665 34.749 4.689
19 3HG2 ILE 2 3HG2 ILE 2 15.167 34.442 5.557
20 1HD1 ILE 2 1HD1 ILE 2 15.969 31.661 6.382
21 2HD1 ILE 2 2HD1 ILE 2 16.143 32.004 8.102
22 3HD1 ILE 2 3HD1 ILE 2 16.214 33.320 6.927
23 H MET 3 H MET 3 10.286 32.025 4.619
24 HA MET 3 HA MET 3 10.988 29.257 5.302
25 1HB MET 3 2HB MET 3 8.217 30.443 5.108
26 2HB MET 3 1HB MET 3 8.511 28.718 4.944
27 1HG MET 3 2HG MET 3 9.502 28.692 7.194
28 2HG MET 3 1HG MET 3 9.142 30.411 7.351
29 1HE MET 3 1HE MET 3 6.558 28.640 9.749
30 2HE MET 3 2HE MET 3 7.850 29.835 9.653
31 3HE MET 3 3HE MET 3 8.210 28.124 9.418
32 H VAL 4 H VAL 4 9.208 31.369 3.113
33 HA VAL 4 HA VAL 4 8.925 31.421 0.874
34 HB VAL 4 HB VAL 4 11.660 30.156 0.683
35 1HG1 VAL 4 1HG1 VAL 4 11.844 31.509 -1.346
36 2HG1 VAL 4 2HG1 VAL 4 10.223 32.145 -1.079
37 3HG1 VAL 4 3HG1 VAL 4 10.450 30.431 -1.432
38 1HG2 VAL 4 1HG2 VAL 4 10.968 33.047 1.205
39 2HG2 VAL 4 2HG2 VAL 4 12.575 32.444 0.802
40 3HG2 VAL 4 3HG2 VAL 4 11.802 31.952 2.309
41 H SER 5 H SER 5 7.453 29.498 1.691
42 HA SER 5 HA SER 5 8.120 26.994 0.425
43 1HB SER 5 2HB SER 5 5.698 26.457 1.175
44 2HB SER 5 1HB SER 5 6.935 26.675 2.412
45 HG SER 5 HG SER 5 4.996 27.815 2.887
46 H GLY 6 H GLY 6 8.401 28.112 -1.664
47 1HA GLY 6 2HA GLY 6 6.186 29.198 -3.066
48 2HA GLY 6 1HA GLY 6 7.701 28.664 -3.780
49 H CYS 7 H CYS 7 4.517 28.213 -3.916
50 HA CYS 7 HA CYS 7 4.125 25.441 -3.878
51 1HB CYS 7 2HB CYS 7 2.711 27.506 -5.583
52 2HB CYS 7 1HB CYS 7 2.117 25.890 -5.216
53 HG CYS 7 HG CYS 7 2.427 26.784 -2.307
54 H GLN 8 H GLN 8 4.694 27.606 -6.642
55 HA GLN 8 HA GLN 8 5.804 27.349 -8.595
56 1HB GLN 8 2HB GLN 8 7.579 26.309 -7.238
57 2HB GLN 8 1HB GLN 8 6.800 24.745 -7.424
58 1HG GLN 8 2HG GLN 8 7.164 24.845 -9.833
59 2HG GLN 8 1HG GLN 8 7.950 26.414 -9.645
60 1HE2 GLN 8 1HE2 GLN 8 10.000 26.520 -8.708
61 2HE2 GLN 8 2HE2 GLN 8 10.998 25.118 -8.533
62 H GLN 9 H GLN 9 5.074 26.829 -10.533
63 HA GLN 9 HA GLN 9 4.055 24.209 -11.125
64 1HB GLN 9 2HB GLN 9 2.050 25.248 -10.124
65 2HB GLN 9 1HB GLN 9 2.156 26.561 -11.292
66 1HG GLN 9 2HG GLN 9 1.819 24.967 -13.113
67 2HG GLN 9 1HG GLN 9 1.707 23.653 -11.942
68 1HE2 GLN 9 1HE2 GLN 9 -0.371 23.105 -12.563
69 2HE2 GLN 9 2HE2 GLN 9 -1.740 24.112 -12.208
70 H GLN 10 H GLN 10 5.562 24.093 -12.716
71 HA GLN 10 HA GLN 10 5.339 26.050 -14.892
72 1HB GLN 10 2HB GLN 10 7.611 25.558 -13.860
73 2HB GLN 10 1HB GLN 10 7.479 23.944 -14.544
74 1HG GLN 10 2HG GLN 10 8.840 25.344 -15.956
75 2HG GLN 10 1HG GLN 10 7.344 24.920 -16.787
76 1HE2 GLN 10 1HE2 GLN 10 5.815 26.506 -17.176
77 2HE2 GLN 10 2HE2 GLN 10 6.167 28.191 -17.029
78 H LYS 11 H LYS 11 6.062 22.594 -14.585
79 HA LYS 11 HA LYS 11 3.674 21.836 -15.987
80 1HB LYS 11 2HB LYS 11 6.364 21.594 -17.288
81 2HB LYS 11 1HB LYS 11 5.147 20.358 -17.582
82 1HG LYS 11 2HG LYS 11 3.606 22.033 -18.419
83 2HG LYS 11 1HG LYS 11 4.776 23.306 -18.072
84 1HD LYS 11 2HD LYS 11 6.325 22.319 -19.686
85 2HD LYS 11 1HD LYS 11 5.159 21.038 -20.024
86 1HE LYS 11 2HE LYS 11 5.095 22.803 -21.727
87 2HE LYS 11 1HE LYS 11 3.567 22.670 -20.858
88 1HZ LYS 11 1HZ LYS 11 4.058 24.615 -19.619
89 2HZ LYS 11 2HZ LYS 11 4.395 24.992 -21.235
90 3HZ LYS 11 3HZ LYS 11 5.662 24.655 -20.160
91 H GLU 12 H GLU 12 2.924 20.339 -14.735
92 HA GLU 12 HA GLU 12 4.562 19.182 -12.701
93 1HB GLU 12 2HB GLU 12 1.655 18.615 -13.289
94 2HB GLU 12 1HB GLU 12 2.496 18.381 -11.765
95 1HG GLU 12 2HG GLU 12 1.455 20.329 -11.290
96 2HG GLU 12 1HG GLU 12 2.917 20.984 -12.021
97 H GLU 13 H GLU 13 5.047 18.143 -15.487
98 HA GLU 13 HA GLU 13 4.128 15.459 -15.536
99 1HB GLU 13 2HB GLU 13 6.597 16.486 -16.848
100 2HB GLU 13 1HB GLU 13 5.573 15.180 -17.363
101 1HG GLU 13 2HG GLU 13 3.803 16.759 -17.921
102 2HG GLU 13 1HG GLU 13 4.849 18.087 -17.415
103 H THR 14 H THR 14 4.654 14.443 -13.687
104 HA THR 14 HA THR 14 7.233 13.303 -13.491
105 HB THR 14 HB THR 14 7.423 15.591 -12.399
106 HG1 THR 14 1HG THR 14 8.262 14.174 -10.337
107 1HG2 THR 14 1HG2 THR 14 5.856 14.227 -10.215
108 2HG2 THR 14 2HG2 THR 14 5.312 15.597 -11.183
109 3HG2 THR 14 3HG2 THR 14 6.673 15.785 -10.079
110 HA PRO 15 HA PRO 15 4.537 10.256 -11.612
111 1HB PRO 15 2HB PRO 15 6.920 8.756 -10.881
112 2HB PRO 15 1HB PRO 15 5.682 8.363 -12.077
113 1HG PRO 15 2HG PRO 15 8.227 9.041 -12.751
114 2HG PRO 15 1HG PRO 15 6.826 9.371 -13.786
115 1HD PRO 15 2HD PRO 15 8.306 11.227 -11.953
116 2HD PRO 15 1HD PRO 15 7.668 11.526 -13.584
117 H PHE 16 H PHE 16 4.022 11.718 -9.866
118 HA PHE 16 HA PHE 16 5.700 12.143 -7.647
119 1HB PHE 16 2HB PHE 16 3.723 13.082 -6.551
120 2HB PHE 16 1HB PHE 16 3.826 13.639 -8.216
121 HD1 PHE 16 1HD PHE 16 2.297 12.669 -9.925
122 HD2 PHE 16 2HD PHE 16 1.874 11.843 -5.772
123 HE1 PHE 16 1HE PHE 16 -0.004 11.899 -10.317
124 HE2 PHE 16 2HE PHE 16 -0.432 11.070 -6.155
125 HZ PHE 16 HZ PHE 16 -1.375 11.091 -8.434
126 H TYR 17 H TYR 17 3.647 9.500 -8.477
127 HA TYR 17 HA TYR 17 3.260 8.610 -5.765
128 1HB TYR 17 2HB TYR 17 2.011 6.794 -6.730
129 2HB TYR 17 1HB TYR 17 1.562 8.268 -7.572
130 HD1 TYR 17 1HD TYR 17 2.512 8.694 -9.867
131 HD2 TYR 17 2HD TYR 17 2.937 4.949 -7.897
132 HE1 TYR 17 1HE TYR 17 3.046 7.627 -12.018
133 HE2 TYR 17 2HE TYR 17 3.475 3.875 -10.042
134 HH TYR 17 HH TYR 17 3.185 4.212 -12.401
135 H TYR 18 H TYR 18 5.681 8.275 -8.128
136 HA TYR 18 HA TYR 18 6.404 5.559 -7.487
137 1HB TYR 18 2HB TYR 18 6.629 6.697 -9.765
138 2HB TYR 18 1HB TYR 18 8.034 7.519 -9.102
139 HD1 TYR 18 2HD TYR 18 6.660 4.311 -10.194
140 HD2 TYR 18 1HD TYR 18 10.098 6.310 -8.693
141 HE1 TYR 18 2HE TYR 18 8.039 2.367 -10.799
142 HE2 TYR 18 1HE TYR 18 11.495 4.378 -9.296
143 HH TYR 18 HH TYR 18 10.427 1.899 -11.327
144 H GLY 19 H GLY 19 8.049 4.877 -6.229
145 1HA GLY 19 2HA GLY 19 10.331 5.589 -5.360
146 2HA GLY 19 1HA GLY 19 9.449 6.947 -4.670
147 H THR 20 H THR 20 10.118 6.338 -2.589
148 HA THR 20 HA THR 20 8.728 3.973 -1.509
149 HB THR 20 HB THR 20 11.178 5.217 -0.264
150 HG1 THR 20 1HG THR 20 11.902 4.524 -2.250
151 1HG2 THR 20 1HG2 THR 20 9.933 2.474 -0.057
152 2HG2 THR 20 2HG2 THR 20 9.832 3.751 1.157
153 3HG2 THR 20 3HG2 THR 20 11.387 3.009 0.783
154 H TRP 21 H TRP 21 7.245 4.368 0.024
155 HA TRP 21 HA TRP 21 7.260 7.023 1.314
156 1HB TRP 21 2HB TRP 21 4.856 5.352 0.535
157 2HB TRP 21 1HB TRP 21 4.802 6.908 1.352
158 HD1 TRP 21 HD TRP 21 5.771 5.402 -2.077
159 HE1 TRP 21 1HE TRP 21 5.500 7.239 -3.861
160 HE3 TRP 21 3HE TRP 21 4.634 9.338 0.980
161 HZ2 TRP 21 2HZ TRP 21 4.890 9.997 -3.951
162 HZ3 TRP 21 3HZ TRP 21 4.221 11.540 -0.035
163 HH2 TRP 21 HH TRP 21 4.348 11.860 -2.452
164 H ASP 22 H ASP 22 7.030 7.061 3.512
165 HA ASP 22 HA ASP 22 6.431 4.512 4.873
166 1HB ASP 22 2HB ASP 22 8.596 5.709 5.465
167 2HB ASP 22 1HB ASP 22 7.613 7.008 6.123
168 H GLU 23 H GLU 23 4.611 4.386 6.124
169 HA GLU 23 HA GLU 23 2.492 6.124 5.680
170 1HB GLU 23 2HB GLU 23 2.931 4.297 8.050
171 2HB GLU 23 1HB GLU 23 1.396 5.037 7.617
172 1HG GLU 23 2HG GLU 23 1.443 3.829 5.473
173 2HG GLU 23 1HG GLU 23 2.944 3.047 5.969
174 H GLY 24 H GLY 24 4.796 6.029 8.371
175 1HA GLY 24 2HA GLY 24 5.268 7.526 10.048
176 2HA GLY 24 1HA GLY 24 4.871 8.752 8.855
177 H ARG 25 H ARG 25 2.453 6.488 9.795
178 HA ARG 25 HA ARG 25 1.239 7.955 11.889
179 1HB ARG 25 2HB ARG 25 0.908 9.492 9.909
180 2HB ARG 25 1HB ARG 25 -0.078 8.240 9.177
181 1HG ARG 25 2HG ARG 25 -1.675 8.406 10.985
182 2HG ARG 25 1HG ARG 25 -0.661 9.596 11.804
183 1HD ARG 25 2HD ARG 25 -1.980 9.926 9.105
184 2HD ARG 25 1HD ARG 25 -2.495 10.679 10.613
185 HE ARG 25 HE ARG 25 0.110 11.468 10.302
186 1HH1 ARG 25 1HH1 ARG 25 -2.821 11.747 8.400
187 2HH1 ARG 25 2HH1 ARG 25 -2.313 13.201 7.594
188 1HH2 ARG 25 1HH2 ARG 25 0.773 13.384 9.250
189 2HH2 ARG 25 2HH2 ARG 25 -0.274 14.136 8.086
190 H ALA 26 H ALA 26 -0.666 6.890 12.611
191 HA ALA 26 HA ALA 26 -1.986 5.103 13.054
192 1HB ALA 26 1HB ALA 26 -2.787 5.338 10.749
193 2HB ALA 26 2HB ALA 26 -2.752 3.651 11.263
194 3HB ALA 26 3HB ALA 26 -1.493 4.274 10.195
195 HA PRO 27 HA PRO 27 0.939 2.020 14.266
196 1HB PRO 27 2HB PRO 27 -1.193 0.318 15.201
197 2HB PRO 27 1HB PRO 27 -0.095 1.324 16.145
198 1HG PRO 27 2HG PRO 27 -2.778 1.811 15.900
199 2HG PRO 27 1HG PRO 27 -1.575 3.066 16.242
200 1HD PRO 27 2HD PRO 27 -2.895 2.358 13.650
201 2HD PRO 27 1HD PRO 27 -2.497 3.958 14.316
202 H GLY 28 H GLY 28 1.724 -0.023 13.710
203 1HA GLY 28 2HA GLY 28 0.454 -1.198 11.338
204 2HA GLY 28 1HA GLY 28 2.153 -1.329 11.760
205 HA PRO 29 HA PRO 29 0.087 -5.474 12.590
206 1HB PRO 29 2HB PRO 29 2.992 -6.000 12.143
207 2HB PRO 29 1HB PRO 29 1.587 -6.932 11.615
208 1HG PRO 29 2HG PRO 29 2.915 -5.338 9.927
209 2HG PRO 29 1HG PRO 29 1.155 -5.529 9.834
210 1HD PRO 29 2HD PRO 29 2.754 -3.223 10.785
211 2HD PRO 29 1HD PRO 29 1.119 -3.268 10.106
212 H THR 30 H THR 30 0.325 -6.836 14.348
213 HA THR 30 HA THR 30 1.143 -5.499 16.733
214 HB THR 30 HB THR 30 -0.859 -7.025 16.469
215 HG1 THR 30 1HG THR 30 -0.768 -7.611 18.611
216 1HG2 THR 30 1HG2 THR 30 0.234 -8.884 15.338
217 2HG2 THR 30 2HG2 THR 30 -0.502 -9.425 16.847
218 3HG2 THR 30 3HG2 THR 30 1.242 -9.173 16.755
219 H ASP 31 H ASP 31 2.847 -7.368 14.554
220 HA ASP 31 HA ASP 31 4.531 -8.900 16.225
221 1HB ASP 31 2HB ASP 31 5.212 -7.718 13.526
222 2HB ASP 31 1HB ASP 31 6.011 -9.080 14.304
223 H GLY 32 H GLY 32 4.294 -5.567 15.811
224 1HA GLY 32 2HA GLY 32 5.566 -4.242 17.446
225 2HA GLY 32 1HA GLY 32 6.975 -5.190 16.990
226 H VAL 33 H VAL 33 4.495 -3.718 14.936
227 HA VAL 33 HA VAL 33 6.650 -2.335 13.487
228 HB VAL 33 HB VAL 33 3.837 -2.820 12.513
229 1HG1 VAL 33 1HG1 VAL 33 4.830 -2.476 10.308
230 2HG1 VAL 33 2HG1 VAL 33 6.392 -2.170 11.068
231 3HG1 VAL 33 3HG1 VAL 33 5.041 -1.072 11.352
232 1HG2 VAL 33 1HG2 VAL 33 4.713 -4.736 11.258
233 2HG2 VAL 33 2HG2 VAL 33 4.861 -4.981 13.000
234 3HG2 VAL 33 3HG2 VAL 33 6.276 -4.531 12.047
235 H LYS 34 H LYS 34 6.679 -0.161 13.407
236 HA LYS 34 HA LYS 34 4.709 1.303 14.945
237 1HB LYS 34 2HB LYS 34 7.240 2.181 13.552
238 2HB LYS 34 1HB LYS 34 6.232 3.223 14.538
239 1HG LYS 34 2HG LYS 34 6.677 1.833 16.488
240 2HG LYS 34 1HG LYS 34 7.676 0.765 15.498
241 1HD LYS 34 2HD LYS 34 9.168 2.663 15.002
242 2HD LYS 34 1HD LYS 34 8.184 3.690 16.046
243 1HE LYS 34 2HE LYS 34 8.728 2.323 17.963
244 2HE LYS 34 1HE LYS 34 9.617 1.194 16.940
245 1HZ LYS 34 1HZ LYS 34 11.160 2.640 18.004
246 2HZ LYS 34 2HZ LYS 34 10.316 4.023 17.497
247 3HZ LYS 34 3HZ LYS 34 11.116 3.052 16.359
248 H SER 35 H SER 35 5.671 0.783 11.683
249 HA SER 35 HA SER 35 3.282 1.645 10.529
250 1HB SER 35 2HB SER 35 4.194 3.621 9.230
251 2HB SER 35 1HB SER 35 3.923 3.928 10.939
252 HG SER 35 HG SER 35 6.187 4.156 9.531
253 H ALA 36 H ALA 36 3.699 1.887 8.031
254 HA ALA 36 HA ALA 36 5.701 -0.173 7.369
255 1HB ALA 36 1HB ALA 36 4.160 -0.997 5.662
256 2HB ALA 36 2HB ALA 36 2.987 0.241 6.111
257 3HB ALA 36 3HB ALA 36 3.407 -1.031 7.258
258 H THR 37 H THR 37 6.533 -0.126 5.252
259 HA THR 37 HA THR 37 6.514 2.543 4.018
260 HB THR 37 HB THR 37 8.800 1.678 3.078
261 HG1 THR 37 1HG THR 37 9.142 0.415 5.524
262 1HG2 THR 37 1HG2 THR 37 8.491 2.585 5.939
263 2HG2 THR 37 2HG2 THR 37 8.584 3.625 4.518
264 3HG2 THR 37 3HG2 THR 37 9.981 2.662 4.996
265 H VAL 38 H VAL 38 5.930 2.632 1.944
266 HA VAL 38 HA VAL 38 5.499 0.053 0.600
267 HB VAL 38 HB VAL 38 3.413 1.277 1.176
268 1HG1 VAL 38 1HG1 VAL 38 4.456 3.340 -0.754
269 2HG1 VAL 38 2HG1 VAL 38 4.149 3.556 0.970
270 3HG1 VAL 38 3HG1 VAL 38 2.806 3.273 -0.137
271 1HG2 VAL 38 1HG2 VAL 38 3.427 -0.298 -0.656
272 2HG2 VAL 38 2HG2 VAL 38 3.967 0.962 -1.769
273 3HG2 VAL 38 3HG2 VAL 38 2.369 1.063 -1.029
274 H THR 39 H THR 39 6.485 -0.298 -1.259
275 HA THR 39 HA THR 39 7.917 1.963 -2.490
276 HB THR 39 HB THR 39 8.674 -0.954 -2.695
277 HG1 THR 39 1HG THR 39 8.920 0.742 -0.602
278 1HG2 THR 39 1HG2 THR 39 10.852 -0.059 -3.376
279 2HG2 THR 39 2HG2 THR 39 10.233 1.586 -3.210
280 3HG2 THR 39 3HG2 THR 39 9.573 0.515 -4.446
281 H PHE 40 H PHE 40 7.449 2.437 -4.556
282 HA PHE 40 HA PHE 40 5.613 0.631 -5.967
283 1HB PHE 40 2HB PHE 40 6.256 3.560 -6.380
284 2HB PHE 40 1HB PHE 40 5.228 2.626 -7.460
285 HD1 PHE 40 1HD PHE 40 5.537 3.941 -4.023
286 HD2 PHE 40 2HD PHE 40 2.969 2.191 -6.930
287 HE1 PHE 40 1HE PHE 40 3.590 4.440 -2.600
288 HE2 PHE 40 2HE PHE 40 1.018 2.691 -5.520
289 HZ PHE 40 HZ PHE 40 1.324 3.815 -3.350
290 H THR 41 H THR 41 6.461 -0.651 -7.385
291 HA THR 41 HA THR 41 9.041 0.005 -8.611
292 HB THR 41 HB THR 41 7.943 -2.726 -8.940
293 HG1 THR 41 1HG THR 41 7.329 -2.398 -6.806
294 1HG2 THR 41 1HG2 THR 41 10.208 -2.137 -9.660
295 2HG2 THR 41 2HG2 THR 41 10.251 -3.340 -8.375
296 3HG2 THR 41 3HG2 THR 41 10.613 -1.651 -8.015
297 H GLU 42 H GLU 42 9.117 -1.395 -10.848
298 HA GLU 42 HA GLU 42 7.911 0.136 -12.759
299 1HB GLU 42 2HB GLU 42 9.809 -1.396 -13.116
300 2HB GLU 42 1HB GLU 42 8.715 -2.767 -13.016
301 1HG GLU 42 2HG GLU 42 7.564 -2.033 -15.005
302 2HG GLU 42 1HG GLU 42 8.577 -0.592 -15.087
303 H ASP 43 H ASP 43 6.736 -3.063 -11.651
304 HA ASP 43 HA ASP 43 4.061 -2.282 -12.580
305 1HB ASP 43 2HB ASP 43 5.608 -4.694 -13.439
306 2HB ASP 43 1HB ASP 43 3.861 -4.814 -13.278
307 H GLU 44 H GLU 44 5.715 -2.947 -9.978
308 HA GLU 44 HA GLU 44 3.532 -4.457 -8.747
309 1HB GLU 44 2HB GLU 44 5.173 -5.818 -7.454
310 2HB GLU 44 1HB GLU 44 5.160 -6.161 -9.176
311 1HG GLU 44 2HG GLU 44 7.149 -4.259 -8.000
312 2HG GLU 44 1HG GLU 44 7.412 -6.000 -7.955
313 H VAL 45 H VAL 45 3.182 -4.078 -6.559
314 HA VAL 45 HA VAL 45 4.684 -1.816 -5.397
315 HB VAL 45 HB VAL 45 1.844 -2.733 -4.890
316 1HG1 VAL 45 1HG1 VAL 45 3.384 -0.524 -3.536
317 2HG1 VAL 45 2HG1 VAL 45 2.871 -2.038 -2.794
318 3HG1 VAL 45 3HG1 VAL 45 1.667 -0.861 -3.321
319 1HG2 VAL 45 1HG2 VAL 45 2.943 -0.166 -6.014
320 2HG2 VAL 45 2HG2 VAL 45 1.242 -0.510 -5.701
321 3HG2 VAL 45 3HG2 VAL 45 2.117 -1.434 -6.922
322 H VAL 46 H VAL 46 5.912 -2.260 -3.676
323 HA VAL 46 HA VAL 46 5.469 -4.821 -2.295
324 HB VAL 46 HB VAL 46 7.986 -3.154 -2.383
325 1HG1 VAL 46 1HG1 VAL 46 7.497 -5.908 -1.263
326 2HG1 VAL 46 2HG1 VAL 46 7.791 -4.440 -0.332
327 3HG1 VAL 46 3HG1 VAL 46 9.061 -5.102 -1.362
328 1HG2 VAL 46 1HG2 VAL 46 7.326 -5.721 -3.824
329 2HG2 VAL 46 2HG2 VAL 46 8.903 -4.930 -3.802
330 3HG2 VAL 46 3HG2 VAL 46 7.527 -4.128 -4.561
331 H GLU 47 H GLU 47 4.681 -4.720 -0.294
332 HA GLU 47 HA GLU 47 4.888 -2.201 1.180
333 1HB GLU 47 2HB GLU 47 2.652 -3.348 0.978
334 2HB GLU 47 1HB GLU 47 3.302 -4.664 1.945
335 1HG GLU 47 2HG GLU 47 3.747 -3.042 3.759
336 2HG GLU 47 1HG GLU 47 2.958 -1.799 2.797
337 H THR 48 H THR 48 6.079 -2.008 2.974
338 HA THR 48 HA THR 48 7.617 -4.373 3.848
339 HB THR 48 HB THR 48 8.768 -1.605 3.914
340 HG1 THR 48 1HG THR 48 7.959 -2.517 1.705
341 1HG2 THR 48 1HG2 THR 48 9.968 -3.359 5.092
342 2HG2 THR 48 2HG2 THR 48 10.888 -2.831 3.684
343 3HG2 THR 48 3HG2 THR 48 9.992 -4.349 3.630
344 H GLU 49 H GLU 49 7.794 -4.637 6.028
345 HA GLU 49 HA GLU 49 6.277 -2.732 7.674
346 1HB GLU 49 2HB GLU 49 7.135 -5.520 8.447
347 2HB GLU 49 1HB GLU 49 5.931 -4.517 9.239
348 1HG GLU 49 2HG GLU 49 4.545 -4.655 7.182
349 2HG GLU 49 1HG GLU 49 5.722 -5.782 6.516
350 H VAL 50 H VAL 50 7.286 -1.507 9.170
351 HA VAL 50 HA VAL 50 10.174 -1.908 9.461
352 HB VAL 50 HB VAL 50 8.526 0.477 10.317
353 1HG1 VAL 50 1HG1 VAL 50 10.622 0.268 11.522
354 2HG1 VAL 50 2HG1 VAL 50 10.678 1.635 10.407
355 3HG1 VAL 50 3HG1 VAL 50 11.500 0.128 10.000
356 1HG2 VAL 50 1HG2 VAL 50 8.393 0.203 7.903
357 2HG2 VAL 50 2HG2 VAL 50 10.149 0.082 7.805
358 3HG2 VAL 50 3HG2 VAL 50 9.398 1.596 8.307
359 H MET 51 H MET 51 10.804 -3.053 11.100
360 HA MET 51 HA MET 51 9.356 -2.854 13.653
361 1HB MET 51 2HB MET 51 10.872 -5.159 12.422
362 2HB MET 51 1HB MET 51 10.203 -5.166 14.044
363 1HG MET 51 2HG MET 51 7.948 -4.955 13.111
364 2HG MET 51 1HG MET 51 8.631 -4.936 11.487
365 1HE MET 51 1HE MET 51 6.361 -6.931 12.083
366 2HE MET 51 2HE MET 51 7.008 -8.444 11.443
367 3HE MET 51 3HE MET 51 7.263 -6.938 10.565
368 H GLU 52 H GLU 52 10.580 -1.533 14.924
369 HA GLU 52 HA GLU 52 13.344 -1.136 14.604
370 1HB GLU 52 2HB GLU 52 11.970 0.526 15.714
371 2HB GLU 52 1HB GLU 52 11.584 -0.608 17.002
372 1HG GLU 52 2HG GLU 52 13.786 -0.555 17.843
373 2HG GLU 52 1HG GLU 52 14.389 0.271 16.408
374 H GLY 53 H GLY 53 14.947 -2.451 15.022
375 1HA GLY 53 2HA GLY 53 16.108 -3.785 16.766
376 2HA GLY 53 1HA GLY 53 14.553 -4.564 17.052
377 H ARG 54 H ARG 54 13.756 -4.713 14.355
378 HA ARG 54 HA ARG 54 15.469 -6.894 13.403
379 1HB ARG 54 2HB ARG 54 12.778 -6.066 12.327
380 2HB ARG 54 1HB ARG 54 13.588 -7.612 12.138
381 1HG ARG 54 2HG ARG 54 12.791 -6.646 14.841
382 2HG ARG 54 1HG ARG 54 11.613 -7.390 13.769
383 1HD ARG 54 2HD ARG 54 13.203 -9.334 13.562
384 2HD ARG 54 1HD ARG 54 14.150 -8.591 14.850
385 HE ARG 54 HE ARG 54 11.491 -8.821 15.716
386 1HH1 ARG 54 1HH1 ARG 54 14.222 -10.863 14.912
387 2HH1 ARG 54 2HH1 ARG 54 13.745 -12.138 15.990
388 1HH2 ARG 54 1HH2 ARG 54 10.857 -10.515 17.128
389 2HH2 ARG 54 2HH2 ARG 54 11.846 -11.944 17.243
390 H GLY 55 H GLY 55 13.514 -4.287 12.050
391 1HA GLY 55 2HA GLY 55 14.847 -2.606 10.649
392 2HA GLY 55 1HA GLY 55 15.386 -4.043 9.778
393 H GLU 56 H GLU 56 14.291 -2.743 7.951
394 HA GLU 56 HA GLU 56 11.438 -3.033 7.853
395 1HB GLU 56 2HB GLU 56 13.488 -2.469 5.708
396 2HB GLU 56 1HB GLU 56 11.754 -2.443 5.457
397 1HG GLU 56 2HG GLU 56 12.194 -0.244 5.750
398 2HG GLU 56 1HG GLU 56 11.779 -0.700 7.387
399 H VAL 57 H VAL 57 10.360 -4.731 7.322
400 HA VAL 57 HA VAL 57 11.769 -7.017 6.111
401 HB VAL 57 HB VAL 57 9.306 -6.927 7.857
402 1HG1 VAL 57 1HG1 VAL 57 9.324 -9.381 7.762
403 2HG1 VAL 57 2HG1 VAL 57 10.646 -9.324 6.595
404 3HG1 VAL 57 3HG1 VAL 57 9.065 -8.672 6.168
405 1HG2 VAL 57 1HG2 VAL 57 10.672 -8.187 9.458
406 2HG2 VAL 57 2HG2 VAL 57 11.382 -6.616 9.087
407 3HG2 VAL 57 3HG2 VAL 57 12.050 -8.078 8.365
408 H GLN 58 H GLN 58 11.239 -7.468 4.062
409 HA GLN 58 HA GLN 58 9.139 -5.994 2.778
410 1HB GLN 58 2HB GLN 58 11.000 -8.107 1.683
411 2HB GLN 58 1HB GLN 58 9.969 -7.054 0.739
412 1HG GLN 58 2HG GLN 58 11.207 -5.107 1.650
413 2HG GLN 58 1HG GLN 58 12.317 -6.240 2.423
414 1HE2 GLN 58 1HE2 GLN 58 13.673 -7.517 1.101
415 2HE2 GLN 58 2HE2 GLN 58 14.024 -7.062 -0.532
416 H LEU 59 H LEU 59 7.142 -6.666 2.331
417 HA LEU 59 HA LEU 59 6.407 -9.439 2.847
418 1HB LEU 59 2HB LEU 59 4.768 -7.000 2.138
419 2HB LEU 59 1HB LEU 59 4.089 -8.593 2.399
420 HG LEU 59 HG LEU 59 5.548 -6.948 4.464
421 1HD1 LEU 59 1HD1 LEU 59 2.627 -7.625 4.149
422 2HD1 LEU 59 2HD1 LEU 59 3.363 -6.033 3.953
423 3HD1 LEU 59 3HD1 LEU 59 3.342 -6.808 5.538
424 1HD2 LEU 59 1HD2 LEU 59 5.896 -9.340 4.784
425 2HD2 LEU 59 2HD2 LEU 59 4.155 -9.609 4.711
426 3HD2 LEU 59 3HD2 LEU 59 4.850 -8.677 6.039
427 HA PRO 60 HA PRO 60 6.110 -10.939 -1.328
428 1HB PRO 60 2HB PRO 60 3.154 -11.097 -0.921
429 2HB PRO 60 1HB PRO 60 4.274 -12.323 -1.527
430 1HG PRO 60 2HG PRO 60 3.334 -12.450 0.961
431 2HG PRO 60 1HG PRO 60 5.013 -12.888 0.594
432 1HD PRO 60 2HD PRO 60 3.941 -10.444 1.916
433 2HD PRO 60 1HD PRO 60 5.477 -11.292 2.174
434 H PHE 61 H PHE 61 6.248 -9.722 -3.081
435 HA PHE 61 HA PHE 61 5.197 -7.143 -3.278
436 1HB PHE 61 2HB PHE 61 5.951 -7.228 -5.652
437 2HB PHE 61 1HB PHE 61 7.187 -7.724 -4.504
438 HD1 PHE 61 2HD PHE 61 7.830 -10.099 -4.323
439 HD2 PHE 61 1HD PHE 61 5.078 -8.741 -7.275
440 HE1 PHE 61 2HE PHE 61 8.146 -12.191 -5.576
441 HE2 PHE 61 1HE PHE 61 5.388 -10.835 -8.531
442 HZ PHE 61 HZ PHE 61 6.925 -12.566 -7.683
443 H MET 62 H MET 62 3.444 -6.285 -4.228
444 HA MET 62 HA MET 62 1.410 -8.175 -5.198
445 1HB MET 62 2HB MET 62 1.159 -5.448 -3.921
446 2HB MET 62 1HB MET 62 -0.189 -6.280 -4.677
447 1HG MET 62 2HG MET 62 0.010 -8.102 -3.082
448 2HG MET 62 1HG MET 62 1.419 -7.331 -2.356
449 1HE MET 62 1HE MET 62 -0.151 -4.097 -0.787
450 2HE MET 62 2HE MET 62 0.604 -4.275 -2.371
451 3HE MET 62 3HE MET 62 1.317 -5.060 -0.963
452 H ALA 63 H ALA 63 1.019 -8.150 -7.309
453 HA ALA 63 HA ALA 63 2.052 -6.090 -9.015
454 1HB ALA 63 1HB ALA 63 0.145 -8.348 -9.655
455 2HB ALA 63 2HB ALA 63 1.903 -8.424 -9.775
456 3HB ALA 63 3HB ALA 63 0.996 -7.340 -10.829
457 H TYR 64 H TYR 64 0.809 -4.577 -10.227
458 HA TYR 64 HA TYR 64 -1.998 -4.294 -9.503
459 1HB TYR 64 2HB TYR 64 -1.808 -2.063 -8.669
460 2HB TYR 64 1HB TYR 64 -0.621 -3.021 -7.793
461 HD1 TYR 64 1HD TYR 64 1.813 -2.981 -8.835
462 HD2 TYR 64 2HD TYR 64 -1.166 -0.035 -9.557
463 HE1 TYR 64 1HE TYR 64 3.563 -1.373 -9.460
464 HE2 TYR 64 2HE TYR 64 0.575 1.579 -10.194
465 HH TYR 64 HH TYR 64 3.844 0.663 -10.712
466 H LYS 65 H LYS 65 -3.170 -3.021 -10.955
467 HA LYS 65 HA LYS 65 -1.637 -1.971 -13.234
468 1HB LYS 65 2HB LYS 65 -3.410 -2.561 -14.763
469 2HB LYS 65 1HB LYS 65 -2.871 -3.994 -13.911
470 1HG LYS 65 2HG LYS 65 -5.158 -4.234 -13.977
471 2HG LYS 65 1HG LYS 65 -4.886 -3.576 -12.367
472 1HD LYS 65 2HD LYS 65 -5.682 -1.462 -12.986
473 2HD LYS 65 1HD LYS 65 -5.518 -1.808 -14.709
474 1HE LYS 65 2HE LYS 65 -7.473 -3.173 -12.859
475 2HE LYS 65 1HE LYS 65 -7.867 -1.810 -13.904
476 1HZ LYS 65 1HZ LYS 65 -6.949 -4.496 -14.784
477 2HZ LYS 65 2HZ LYS 65 -7.201 -3.177 -15.815
478 3HZ LYS 65 3HZ LYS 65 -8.506 -3.847 -14.964
479 H VAL 66 H VAL 66 -2.710 -0.231 -14.373
480 HA VAL 66 HA VAL 66 -3.786 1.615 -12.375
481 HB VAL 66 HB VAL 66 -2.539 2.096 -15.084
482 1HG1 VAL 66 1HG1 VAL 66 -2.616 4.476 -14.530
483 2HG1 VAL 66 2HG1 VAL 66 -3.460 4.104 -13.027
484 3HG1 VAL 66 3HG1 VAL 66 -4.238 3.787 -14.577
485 1HG2 VAL 66 1HG2 VAL 66 -0.694 3.069 -13.809
486 2HG2 VAL 66 2HG2 VAL 66 -0.948 1.376 -13.383
487 3HG2 VAL 66 3HG2 VAL 66 -1.512 2.652 -12.303
488 H ILE 67 H ILE 67 -5.923 1.754 -12.328
489 HA ILE 67 HA ILE 67 -7.583 1.076 -14.581
490 HB ILE 67 HB ILE 67 -8.465 2.518 -12.089
491 1HG1 ILE 67 2HG1 ILE 67 -8.211 -0.482 -12.446
492 2HG1 ILE 67 1HG1 ILE 67 -7.188 0.514 -11.417
493 1HG2 ILE 67 1HG2 ILE 67 -9.881 0.684 -14.005
494 2HG2 ILE 67 2HG2 ILE 67 -10.082 2.430 -13.870
495 3HG2 ILE 67 3HG2 ILE 67 -10.595 1.381 -12.549
496 1HD1 ILE 67 1HD1 ILE 67 -8.890 -0.649 -10.124
497 2HD1 ILE 67 2HD1 ILE 67 -10.151 0.116 -11.087
498 3HD1 ILE 67 3HD1 ILE 67 -9.118 1.098 -10.051
499 H SER 68 H SER 68 -6.969 3.986 -12.673
500 HA SER 68 HA SER 68 -7.405 5.614 -15.077
501 1HB SER 68 2HB SER 68 -8.264 6.661 -12.410
502 2HB SER 68 1HB SER 68 -8.848 7.087 -14.012
503 HG SER 68 HG SER 68 -9.510 4.829 -12.434
504 H GLN 69 H GLN 69 -6.194 7.585 -15.045
505 HA GLN 69 HA GLN 69 -4.211 7.825 -12.918
506 1HB GLN 69 2HB GLN 69 -3.189 6.349 -14.610
507 2HB GLN 69 1HB GLN 69 -3.418 7.595 -15.827
508 1HG GLN 69 2HG GLN 69 -1.925 9.078 -14.599
509 2HG GLN 69 1HG GLN 69 -1.710 7.846 -13.357
510 1HE2 GLN 69 1HE2 GLN 69 -0.495 6.003 -13.838
511 2HE2 GLN 69 2HE2 GLN 69 0.587 5.945 -15.191
512 H SER 70 H SER 70 -3.789 9.819 -12.412
513 HA SER 70 HA SER 70 -3.852 11.936 -14.351
514 1HB SER 70 2HB SER 70 -6.213 11.841 -13.696
515 2HB SER 70 1HB SER 70 -5.762 11.948 -11.996
516 HG SER 70 HG SER 70 -6.407 13.966 -13.186
517 H THR 71 H THR 71 -1.921 12.777 -13.964
518 HA THR 71 HA THR 71 -0.683 12.870 -11.405
519 HB THR 71 HB THR 71 0.709 14.718 -12.723
520 HG1 THR 71 1HG THR 71 0.564 13.767 -15.046
521 1HG2 THR 71 1HG2 THR 71 0.794 11.767 -13.352
522 2HG2 THR 71 2HG2 THR 71 1.590 12.564 -11.996
523 3HG2 THR 71 3HG2 THR 71 2.103 12.915 -13.646
524 H ASP 72 H ASP 72 -3.154 14.606 -12.814
525 HA ASP 72 HA ASP 72 -2.725 17.162 -11.649
526 1HB ASP 72 2HB ASP 72 -4.117 17.106 -13.564
527 2HB ASP 72 1HB ASP 72 -5.117 15.825 -12.887
528 H GLY 73 H GLY 73 -4.919 14.493 -10.825
529 1HA GLY 73 2HA GLY 73 -5.212 15.782 -8.190
530 2HA GLY 73 1HA GLY 73 -6.597 15.161 -9.068
531 H SER 74 H SER 74 -5.526 12.673 -9.936
532 HA SER 74 HA SER 74 -4.826 11.242 -7.556
533 1HB SER 74 2HB SER 74 -7.151 11.866 -7.053
534 2HB SER 74 1HB SER 74 -7.689 11.046 -8.512
535 HG SER 74 HG SER 74 -6.180 9.668 -6.566
536 H ILE 75 H ILE 75 -4.679 9.015 -7.803
537 HA ILE 75 HA ILE 75 -4.862 7.994 -10.559
538 HB ILE 75 HB ILE 75 -2.697 7.268 -8.572
539 1HG1 ILE 75 2HG1 ILE 75 -2.567 9.024 -11.036
540 2HG1 ILE 75 1HG1 ILE 75 -2.353 9.545 -9.372
541 1HG2 ILE 75 1HG2 ILE 75 -3.031 6.516 -11.479
542 2HG2 ILE 75 2HG2 ILE 75 -3.298 5.447 -10.102
543 3HG2 ILE 75 3HG2 ILE 75 -1.680 6.061 -10.441
544 1HD1 ILE 75 1HD1 ILE 75 -0.224 9.373 -10.511
545 2HD1 ILE 75 2HD1 ILE 75 -0.544 7.677 -10.875
546 3HD1 ILE 75 3HD1 ILE 75 -0.331 8.193 -9.203
547 H GLU 76 H GLU 76 -5.755 5.969 -10.756
548 HA GLU 76 HA GLU 76 -6.660 4.688 -8.252
549 1HB GLU 76 2HB GLU 76 -8.442 5.776 -9.676
550 2HB GLU 76 1HB GLU 76 -8.051 4.603 -10.922
551 1HG GLU 76 2HG GLU 76 -8.746 2.788 -9.518
552 2HG GLU 76 1HG GLU 76 -9.019 3.891 -8.167
553 H ILE 77 H ILE 77 -6.006 2.666 -7.946
554 HA ILE 77 HA ILE 77 -4.947 1.157 -10.243
555 HB ILE 77 HB ILE 77 -3.088 0.331 -8.821
556 1HG1 ILE 77 2HG1 ILE 77 -3.939 2.551 -6.950
557 2HG1 ILE 77 1HG1 ILE 77 -4.114 0.830 -6.628
558 1HG2 ILE 77 1HG2 ILE 77 -1.724 2.384 -8.977
559 2HG2 ILE 77 2HG2 ILE 77 -3.196 3.304 -9.292
560 3HG2 ILE 77 3HG2 ILE 77 -2.666 2.068 -10.434
561 1HD1 ILE 77 1HD1 ILE 77 -2.199 1.793 -5.471
562 2HD1 ILE 77 2HD1 ILE 77 -1.508 2.286 -7.017
563 3HD1 ILE 77 3HD1 ILE 77 -1.699 0.573 -6.641
564 H GLN 78 H GLN 78 -4.769 -1.143 -9.895
565 HA GLN 78 HA GLN 78 -6.551 -2.185 -7.790
566 1HB GLN 78 2HB GLN 78 -7.724 -1.949 -9.986
567 2HB GLN 78 1HB GLN 78 -6.568 -3.066 -10.681
568 1HG GLN 78 2HG GLN 78 -7.399 -4.869 -9.427
569 2HG GLN 78 1HG GLN 78 -8.310 -3.804 -8.354
570 1HE2 GLN 78 1HE2 GLN 78 -10.295 -3.029 -8.995
571 2HE2 GLN 78 2HE2 GLN 78 -11.093 -3.517 -10.442
572 H TYR 79 H TYR 79 -5.900 -4.127 -6.900
573 HA TYR 79 HA TYR 79 -3.076 -4.592 -7.233
574 1HB TYR 79 2HB TYR 79 -5.113 -5.551 -5.252
575 2HB TYR 79 1HB TYR 79 -3.462 -6.145 -5.265
576 HD1 TYR 79 2HD TYR 79 -1.622 -4.218 -5.279
577 HD2 TYR 79 1HD TYR 79 -5.622 -3.762 -3.894
578 HE1 TYR 79 2HE TYR 79 -0.934 -2.275 -3.942
579 HE2 TYR 79 1HE TYR 79 -4.941 -1.818 -2.554
580 HH TYR 79 HH TYR 79 -2.872 -0.940 -1.526
581 H LEU 80 H LEU 80 -5.520 -5.841 -8.838
582 HA LEU 80 HA LEU 80 -5.984 -7.742 -10.010
583 1HB LEU 80 2HB LEU 80 -2.985 -7.929 -9.786
584 2HB LEU 80 1HB LEU 80 -3.945 -8.944 -10.846
585 HG LEU 80 HG LEU 80 -3.731 -5.935 -11.023
586 1HD1 LEU 80 1HD1 LEU 80 -2.553 -8.107 -12.750
587 2HD1 LEU 80 2HD1 LEU 80 -1.664 -7.026 -11.678
588 3HD1 LEU 80 3HD1 LEU 80 -2.493 -6.379 -13.094
589 1HD2 LEU 80 1HD2 LEU 80 -5.123 -7.934 -12.803
590 2HD2 LEU 80 2HD2 LEU 80 -4.941 -6.212 -13.142
591 3HD2 LEU 80 3HD2 LEU 80 -5.903 -6.744 -11.762
592 H GLY 81 H GLY 81 -4.799 -10.293 -10.036
593 1HA GLY 81 2HA GLY 81 -4.718 -12.288 -8.902
594 2HA GLY 81 1HA GLY 81 -4.200 -11.358 -7.503
595 HA PRO 82 HA PRO 82 -8.324 -12.998 -6.271
596 1HB PRO 82 2HB PRO 82 -7.631 -13.254 -3.650
597 2HB PRO 82 1HB PRO 82 -7.356 -14.520 -4.850
598 1HG PRO 82 2HG PRO 82 -5.437 -12.490 -3.769
599 2HG PRO 82 1HG PRO 82 -5.187 -14.220 -4.072
600 1HD PRO 82 2HD PRO 82 -4.310 -12.331 -5.785
601 2HD PRO 82 1HD PRO 82 -4.892 -13.913 -6.340
602 H TYR 83 H TYR 83 -6.362 -10.335 -5.687
603 HA TYR 83 HA TYR 83 -8.259 -8.994 -3.913
604 1HB TYR 83 2HB TYR 83 -5.556 -8.056 -4.906
605 2HB TYR 83 1HB TYR 83 -6.548 -7.259 -3.693
606 HD1 TYR 83 2HD TYR 83 -7.103 -8.685 -1.565
607 HD2 TYR 83 1HD TYR 83 -3.903 -9.529 -4.238
608 HE1 TYR 83 2HE TYR 83 -5.973 -9.973 0.202
609 HE2 TYR 83 1HE TYR 83 -2.767 -10.819 -2.480
610 HH TYR 83 HH TYR 83 -2.772 -10.835 0.099
611 H TYR 84 H TYR 84 -8.413 -9.587 -6.975
612 HA TYR 84 HA TYR 84 -8.451 -7.058 -8.230
613 1HB TYR 84 2HB TYR 84 -9.463 -8.160 -10.110
614 2HB TYR 84 1HB TYR 84 -8.218 -9.203 -9.453
615 HD1 TYR 84 1HD TYR 84 -9.789 -10.507 -7.216
616 HD2 TYR 84 2HD TYR 84 -10.813 -9.617 -11.246
617 HE1 TYR 84 1HE TYR 84 -11.379 -12.387 -7.230
618 HE2 TYR 84 2HE TYR 84 -12.401 -11.484 -11.268
619 HH TYR 84 HH TYR 84 -13.386 -13.110 -8.453
620 HA PRO 85 HA PRO 85 -11.609 -4.579 -8.895
621 1HB PRO 85 2HB PRO 85 -13.702 -6.328 -7.708
622 2HB PRO 85 1HB PRO 85 -13.907 -4.948 -8.791
623 1HG PRO 85 2HG PRO 85 -13.546 -7.622 -9.607
624 2HG PRO 85 1HG PRO 85 -13.371 -6.188 -10.634
625 1HD PRO 85 2HD PRO 85 -11.296 -7.948 -9.995
626 2HD PRO 85 1HD PRO 85 -11.065 -6.267 -10.539
627 H LEU 86 H LEU 86 -10.687 -6.080 -5.967
628 HA LEU 86 HA LEU 86 -11.492 -3.828 -4.367
629 1HB LEU 86 2HB LEU 86 -10.963 -6.036 -3.363
630 2HB LEU 86 1HB LEU 86 -9.301 -5.862 -3.894
631 HG LEU 86 HG LEU 86 -9.036 -3.908 -2.426
632 1HD1 LEU 86 1HD1 LEU 86 -11.355 -3.140 -2.438
633 2HD1 LEU 86 2HD1 LEU 86 -10.758 -3.362 -0.794
634 3HD1 LEU 86 3HD1 LEU 86 -11.832 -4.562 -1.511
635 1HD2 LEU 86 1HD2 LEU 86 -8.425 -6.099 -1.592
636 2HD2 LEU 86 2HD2 LEU 86 -10.083 -6.385 -1.065
637 3HD2 LEU 86 3HD2 LEU 86 -9.118 -5.128 -0.293
638 H LYS 87 H LYS 87 -10.758 -1.882 -4.970
639 HA LYS 87 HA LYS 87 -8.136 -1.738 -6.273
640 1HB LYS 87 2HB LYS 87 -8.961 0.370 -7.255
641 2HB LYS 87 1HB LYS 87 -9.984 -1.004 -7.655
642 1HG LYS 87 2HG LYS 87 -11.598 -0.331 -5.982
643 2HG LYS 87 1HG LYS 87 -10.557 1.006 -5.486
644 1HD LYS 87 2HD LYS 87 -10.755 1.961 -7.747
645 2HD LYS 87 1HD LYS 87 -11.846 0.646 -8.191
646 1HE LYS 87 2HE LYS 87 -13.449 1.353 -6.546
647 2HE LYS 87 1HE LYS 87 -12.340 2.577 -5.938
648 1HZ LYS 87 1HZ LYS 87 -13.550 2.529 -8.650
649 2HZ LYS 87 2HZ LYS 87 -12.476 3.712 -8.082
650 3HZ LYS 87 3HZ LYS 87 -14.016 3.547 -7.379
651 H SER 88 H SER 88 -7.080 0.451 -6.070
652 HA SER 88 HA SER 88 -7.358 1.552 -3.367
653 1HB SER 88 2HB SER 88 -5.438 -0.002 -3.385
654 2HB SER 88 1HB SER 88 -4.741 0.872 -4.742
655 HG SER 88 HG SER 88 -5.397 2.290 -2.417
656 H THR 89 H THR 89 -6.786 3.759 -3.204
657 HA THR 89 HA THR 89 -6.635 5.148 -5.796
658 HB THR 89 HB THR 89 -8.114 6.232 -3.417
659 HG1 THR 89 1HG THR 89 -8.852 4.272 -5.245
660 1HG2 THR 89 1HG2 THR 89 -7.502 7.828 -5.180
661 2HG2 THR 89 2HG2 THR 89 -9.248 7.591 -5.118
662 3HG2 THR 89 3HG2 THR 89 -8.297 6.806 -6.379
663 H LEU 90 H LEU 90 -5.407 6.983 -5.863
664 HA LEU 90 HA LEU 90 -3.858 7.663 -3.447
665 1HB LEU 90 2HB LEU 90 -2.801 7.451 -6.273
666 2HB LEU 90 1HB LEU 90 -1.885 8.019 -4.891
667 HG LEU 90 HG LEU 90 -3.003 5.228 -5.168
668 1HD1 LEU 90 1HD1 LEU 90 -0.708 4.546 -5.590
669 2HD1 LEU 90 2HD1 LEU 90 -0.186 6.230 -5.544
670 3HD1 LEU 90 3HD1 LEU 90 -1.262 5.675 -6.826
671 1HD2 LEU 90 1HD2 LEU 90 -1.529 4.735 -3.278
672 2HD2 LEU 90 2HD2 LEU 90 -2.748 5.940 -2.859
673 3HD2 LEU 90 3HD2 LEU 90 -1.086 6.439 -3.182
674 H LYS 91 H LYS 91 -4.111 9.753 -2.938
675 HA LYS 91 HA LYS 91 -4.450 11.679 -5.145
676 1HB LYS 91 2HB LYS 91 -5.882 11.522 -2.516
677 2HB LYS 91 1HB LYS 91 -5.635 13.089 -3.277
678 1HG LYS 91 2HG LYS 91 -6.735 12.178 -5.327
679 2HG LYS 91 1HG LYS 91 -7.118 10.730 -4.404
680 1HD LYS 91 2HD LYS 91 -7.934 13.460 -3.458
681 2HD LYS 91 1HD LYS 91 -8.919 12.541 -4.596
682 1HE LYS 91 2HE LYS 91 -8.078 11.628 -1.846
683 2HE LYS 91 1HE LYS 91 -9.676 12.231 -2.290
684 1HZ LYS 91 1HZ LYS 91 -8.361 9.726 -3.179
685 2HZ LYS 91 2HZ LYS 91 -9.746 10.347 -3.934
686 3HZ LYS 91 3HZ LYS 91 -9.798 9.888 -2.300
687 H ARG 92 H ARG 92 -3.697 13.888 -4.612
688 HA ARG 92 HA ARG 92 -1.059 13.658 -3.503
689 1HB ARG 92 2HB ARG 92 -0.646 15.806 -4.440
690 2HB ARG 92 1HB ARG 92 -1.575 14.891 -5.612
691 1HG ARG 92 2HG ARG 92 -3.610 16.054 -4.818
692 2HG ARG 92 1HG ARG 92 -2.583 17.047 -3.786
693 1HD ARG 92 2HD ARG 92 -1.291 17.550 -5.978
694 2HD ARG 92 1HD ARG 92 -2.755 16.975 -6.775
695 HE ARG 92 HE ARG 92 -3.172 19.011 -4.758
696 1HH1 ARG 92 1HH1 ARG 92 -2.747 18.301 -8.163
697 2HH1 ARG 92 2HH1 ARG 92 -3.266 19.870 -8.690
698 1HH2 ARG 92 1HH2 ARG 92 -3.847 21.098 -5.450
699 2HH2 ARG 92 2HH2 ARG 92 -3.864 21.468 -7.155
700 H GLY 93 H GLY 93 -0.215 14.737 -1.749
701 1HA GLY 93 2HA GLY 93 -2.210 15.600 0.210
702 2HA GLY 93 1HA GLY 93 -0.564 15.092 0.562
703 H GLU 94 H GLU 94 -0.867 17.132 1.889
704 HA GLU 94 HA GLU 94 -0.830 19.595 0.373
705 1HB GLU 94 2HB GLU 94 -1.286 20.681 2.455
706 2HB GLU 94 1HB GLU 94 -2.350 19.303 2.305
707 1HG GLU 94 2HG GLU 94 0.134 19.453 4.002
708 2HG GLU 94 1HG GLU 94 -1.525 19.562 4.575
709 H ASN 95 H ASN 95 1.277 17.662 2.333
710 HA ASN 95 HA ASN 95 3.382 19.713 2.168
711 1HB ASN 95 2HB ASN 95 3.144 17.218 3.863
712 2HB ASN 95 1HB ASN 95 4.622 18.170 3.765
713 1HD2 ASN 95 1HD2 ASN 95 1.393 18.001 4.944
714 2HD2 ASN 95 2HD2 ASN 95 1.461 19.402 5.969
715 H GLY 96 H GLY 96 2.498 18.064 -0.107
716 1HA GLY 96 2HA GLY 96 3.514 16.934 -1.857
717 2HA GLY 96 1HA GLY 96 5.044 17.088 -0.996
718 H THR 97 H THR 97 2.089 15.678 0.184
719 HA THR 97 HA THR 97 3.488 13.157 0.665
720 HB THR 97 HB THR 97 1.531 12.802 2.284
721 HG1 THR 97 1HG THR 97 0.810 15.139 2.917
722 1HG2 THR 97 1HG2 THR 97 2.542 14.231 4.020
723 2HG2 THR 97 2HG2 THR 97 3.447 15.091 2.773
724 3HG2 THR 97 3HG2 THR 97 3.760 13.381 3.073
725 H LEU 98 H LEU 98 1.802 11.254 0.739
726 HA LEU 98 HA LEU 98 0.021 11.521 -1.590
727 1HB LEU 98 2HB LEU 98 2.092 10.175 -2.046
728 2HB LEU 98 1HB LEU 98 1.558 9.036 -0.826
729 HG LEU 98 HG LEU 98 -0.448 8.541 -2.173
730 1HD1 LEU 98 1HD1 LEU 98 -0.593 9.355 -4.474
731 2HD1 LEU 98 2HD1 LEU 98 0.818 10.377 -4.202
732 3HD1 LEU 98 3HD1 LEU 98 -0.678 10.679 -3.315
733 1HD2 LEU 98 1HD2 LEU 98 2.161 8.265 -3.657
734 2HD2 LEU 98 2HD2 LEU 98 0.697 7.338 -3.976
735 3HD2 LEU 98 3HD2 LEU 98 1.532 7.159 -2.434
736 H ILE 99 H ILE 99 -2.007 10.861 -1.311
737 HA ILE 99 HA ILE 99 -2.740 9.777 1.308
738 HB ILE 99 HB ILE 99 -4.528 10.882 -0.877
739 1HG1 ILE 99 2HG1 ILE 99 -3.601 12.164 1.708
740 2HG1 ILE 99 1HG1 ILE 99 -3.009 12.581 0.102
741 1HG2 ILE 99 1HG2 ILE 99 -5.136 10.202 2.002
742 2HG2 ILE 99 2HG2 ILE 99 -5.632 9.261 0.596
743 3HG2 ILE 99 3HG2 ILE 99 -6.264 10.889 0.834
744 1HD1 ILE 99 1HD1 ILE 99 -4.641 14.191 0.876
745 2HD1 ILE 99 2HD1 ILE 99 -5.833 12.909 1.092
746 3HD1 ILE 99 3HD1 ILE 99 -5.254 13.312 -0.525
747 H TRP 100 H TRP 100 -2.795 7.666 1.415
748 HA TRP 100 HA TRP 100 -3.308 6.105 -1.002
749 1HB TRP 100 2HB TRP 100 -1.223 5.671 0.270
750 2HB TRP 100 1HB TRP 100 -2.188 5.257 1.681
751 HD1 TRP 100 HD TRP 100 -3.279 3.963 -1.736
752 HE1 TRP 100 1HE TRP 100 -2.945 1.421 -1.802
753 HE3 TRP 100 3HE TRP 100 -0.731 3.385 2.652
754 HZ2 TRP 100 2HZ TRP 100 -1.745 -0.582 -0.197
755 HZ3 TRP 100 3HZ TRP 100 -0.015 1.122 3.313
756 HH2 TRP 100 HH TRP 100 -0.515 -0.816 1.915
757 H GLU 101 H GLU 101 -5.329 5.517 -1.287
758 HA GLU 101 HA GLU 101 -6.985 4.886 1.072
759 1HB GLU 101 2HB GLU 101 -7.739 5.790 -1.708
760 2HB GLU 101 1HB GLU 101 -8.905 5.278 -0.501
761 1HG GLU 101 2HG GLU 101 -8.635 7.144 0.768
762 2HG GLU 101 1HG GLU 101 -6.971 7.385 0.244
763 H GLN 102 H GLN 102 -7.752 2.922 1.280
764 HA GLN 102 HA GLN 102 -7.861 1.088 -0.963
765 1HB GLN 102 2HB GLN 102 -5.511 0.939 -0.160
766 2HB GLN 102 1HB GLN 102 -6.106 0.480 1.426
767 1HG GLN 102 2HG GLN 102 -6.973 -1.165 -0.884
768 2HG GLN 102 1HG GLN 102 -5.304 -1.297 -0.372
769 1HE2 GLN 102 1HE2 GLN 102 -7.286 -3.335 -0.308
770 2HE2 GLN 102 2HE2 GLN 102 -7.470 -3.807 1.342
771 H ASN 103 H ASN 103 -9.898 0.308 -0.733
772 HA ASN 103 HA ASN 103 -11.437 -1.180 0.095
773 1HB ASN 103 2HB ASN 103 -9.344 -2.413 0.554
774 2HB ASN 103 1HB ASN 103 -9.256 -1.658 2.128
775 1HD2 ASN 103 1HD2 ASN 103 -9.059 -3.715 2.891
776 2HD2 ASN 103 2HD2 ASN 103 -10.454 -4.719 3.171
777 H GLY 104 H GLY 104 -11.157 1.637 1.110
778 1HA GLY 104 2HA GLY 104 -12.958 2.639 2.364
779 2HA GLY 104 1HA GLY 104 -12.872 1.282 3.476
780 H GLN 105 H GLN 105 -9.764 1.662 3.238
781 HA GLN 105 HA GLN 105 -9.720 3.487 5.518
782 1HB GLN 105 2HB GLN 105 -7.505 1.790 4.363
783 2HB GLN 105 1HB GLN 105 -7.438 2.688 5.871
784 1HG GLN 105 2HG GLN 105 -9.361 1.281 6.662
785 2HG GLN 105 1HG GLN 105 -9.122 0.291 5.226
786 1HE2 GLN 105 1HE2 GLN 105 -8.842 -0.394 8.057
787 2HE2 GLN 105 2HE2 GLN 105 -7.224 -0.979 8.239
788 H ARG 106 H ARG 106 -8.945 5.468 5.473
789 HA ARG 106 HA ARG 106 -7.461 6.405 3.119
790 1HB ARG 106 2HB ARG 106 -9.468 7.691 3.716
791 2HB ARG 106 1HB ARG 106 -8.838 7.943 5.337
792 1HG ARG 106 2HG ARG 106 -6.929 9.184 4.327
793 2HG ARG 106 1HG ARG 106 -7.736 9.047 2.761
794 1HD ARG 106 2HD ARG 106 -9.660 10.251 3.619
795 2HD ARG 106 1HD ARG 106 -8.929 10.323 5.222
796 HE ARG 106 HE ARG 106 -8.069 11.825 2.842
797 1HH1 ARG 106 1HH1 ARG 106 -7.814 11.177 6.272
798 2HH1 ARG 106 2HH1 ARG 106 -6.950 12.639 6.624
799 1HH2 ARG 106 1HH2 ARG 106 -6.961 13.776 3.304
800 2HH2 ARG 106 2HH2 ARG 106 -6.504 14.137 4.940
801 H LYS 107 H LYS 107 -5.271 6.335 3.366
802 HA LYS 107 HA LYS 107 -4.234 7.198 5.968
803 1HB LYS 107 2HB LYS 107 -3.588 4.801 4.481
804 2HB LYS 107 1HB LYS 107 -2.191 5.710 5.059
805 1HG LYS 107 2HG LYS 107 -3.099 5.689 7.324
806 2HG LYS 107 1HG LYS 107 -4.507 4.788 6.756
807 1HD LYS 107 2HD LYS 107 -1.641 3.895 6.865
808 2HD LYS 107 1HD LYS 107 -3.048 3.187 7.672
809 1HE LYS 107 2HE LYS 107 -4.005 2.696 5.469
810 2HE LYS 107 1HE LYS 107 -2.531 3.294 4.724
811 1HZ LYS 107 1HZ LYS 107 -1.286 1.577 5.991
812 2HZ LYS 107 2HZ LYS 107 -2.375 0.917 4.870
813 3HZ LYS 107 3HZ LYS 107 -2.765 0.932 6.513
814 H THR 108 H THR 108 -3.228 9.105 5.787
815 HA THR 108 HA THR 108 -1.984 9.824 3.249
816 HB THR 108 HB THR 108 -2.249 11.477 5.774
817 HG1 THR 108 1HG THR 108 -3.822 12.347 3.818
818 1HG2 THR 108 1HG2 THR 108 -1.825 13.378 4.280
819 2HG2 THR 108 2HG2 THR 108 -1.626 12.267 2.924
820 3HG2 THR 108 3HG2 THR 108 -0.475 12.241 4.260
821 H MET 109 H MET 109 0.059 9.305 2.928
822 HA MET 109 HA MET 109 1.753 8.811 5.284
823 1HB MET 109 2HB MET 109 2.987 7.212 3.829
824 2HB MET 109 1HB MET 109 1.316 6.759 4.129
825 1HG MET 109 2HG MET 109 0.722 7.722 1.919
826 2HG MET 109 1HG MET 109 2.442 7.980 1.624
827 1HE MET 109 1HE MET 109 2.212 6.570 -0.644
828 2HE MET 109 2HE MET 109 0.500 6.328 -0.300
829 3HE MET 109 3HE MET 109 1.520 4.949 -0.711
830 H THR 110 H THR 110 4.081 9.105 4.946
831 HA THR 110 HA THR 110 4.516 11.574 3.407
832 HB THR 110 HB THR 110 6.368 10.604 5.545
833 HG1 THR 110 1HG THR 110 3.799 11.056 5.950
834 1HG2 THR 110 1HG2 THR 110 5.543 13.341 4.573
835 2HG2 THR 110 2HG2 THR 110 7.065 12.522 4.225
836 3HG2 THR 110 3HG2 THR 110 6.697 13.034 5.872
837 H ARG 111 H ARG 111 6.554 11.824 2.308
838 HA ARG 111 HA ARG 111 7.375 9.315 1.093
839 1HB ARG 111 2HB ARG 111 8.267 10.585 -0.668
840 2HB ARG 111 1HB ARG 111 6.833 11.486 -0.198
841 1HG ARG 111 2HG ARG 111 8.537 12.745 1.341
842 2HG ARG 111 1HG ARG 111 9.701 12.152 0.165
843 1HD ARG 111 2HD ARG 111 8.524 13.231 -1.635
844 2HD ARG 111 1HD ARG 111 7.224 13.714 -0.545
845 HE ARG 111 HE ARG 111 9.915 14.666 0.068
846 1HH1 ARG 111 1HH1 ARG 111 6.757 15.365 -1.301
847 2HH1 ARG 111 2HH1 ARG 111 6.942 17.084 -1.138
848 1HH2 ARG 111 1HH2 ARG 111 10.140 16.920 0.269
849 2HH2 ARG 111 2HH2 ARG 111 8.844 17.965 -0.229
850 H ILE 112 H ILE 112 9.635 8.863 0.772
851 HA ILE 112 HA ILE 112 11.275 9.601 3.068
852 HB ILE 112 HB ILE 112 11.850 7.605 0.881
853 1HG1 ILE 112 2HG1 ILE 112 9.762 7.121 2.160
854 2HG1 ILE 112 1HG1 ILE 112 11.002 5.902 2.345
855 1HG2 ILE 112 1HG2 ILE 112 13.830 8.350 2.097
856 2HG2 ILE 112 2HG2 ILE 112 13.457 6.661 2.445
857 3HG2 ILE 112 3HG2 ILE 112 13.059 7.913 3.621
858 1HD1 ILE 112 1HD1 ILE 112 9.919 6.336 4.456
859 2HD1 ILE 112 2HD1 ILE 112 10.320 8.048 4.331
860 3HD1 ILE 112 3HD1 ILE 112 11.603 6.854 4.523
861 H GLU 113 H GLU 113 13.406 10.413 2.760
862 HA GLU 113 HA GLU 113 13.559 12.320 0.634
863 1HB GLU 113 2HB GLU 113 15.603 11.576 2.723
864 2HB GLU 113 1HB GLU 113 15.778 12.906 1.593
865 1HG GLU 113 2HG GLU 113 15.067 13.903 3.570
866 2HG GLU 113 1HG GLU 113 13.616 13.815 2.578
867 H SER 114 H SER 114 13.907 11.599 -1.310
868 HA SER 114 HA SER 114 16.297 10.012 -1.851
869 1HB SER 114 2HB SER 114 13.548 9.347 -2.944
870 2HB SER 114 1HB SER 114 15.054 8.556 -3.407
871 HG SER 114 HG SER 114 15.250 7.766 -1.308
872 H LYS 115 H LYS 115 17.419 10.804 -3.491
873 HA LYS 115 HA LYS 115 15.999 12.161 -5.672
874 1HB LYS 115 2HB LYS 115 18.141 13.253 -3.966
875 2HB LYS 115 1HB LYS 115 18.407 13.445 -5.693
876 1HG LYS 115 2HG LYS 115 15.919 14.326 -4.246
877 2HG LYS 115 1HG LYS 115 17.286 15.375 -4.631
878 1HD LYS 115 2HD LYS 115 16.961 14.813 -7.036
879 2HD LYS 115 1HD LYS 115 15.513 13.913 -6.585
880 1HE LYS 115 2HE LYS 115 15.969 16.858 -6.110
881 2HE LYS 115 1HE LYS 115 14.985 16.168 -7.399
882 1HZ LYS 115 1HZ LYS 115 13.555 15.179 -5.708
883 2HZ LYS 115 2HZ LYS 115 13.612 16.870 -5.566
884 3HZ LYS 115 3HZ LYS 115 14.484 15.901 -4.485
885 H THR 116 H THR 116 16.188 9.973 -6.508
886 HA THR 116 HA THR 116 18.612 9.634 -8.051
887 HB THR 116 HB THR 116 17.713 7.367 -6.264
888 HG1 THR 116 1HG THR 116 19.305 9.523 -5.728
889 1HG2 THR 116 1HG2 THR 116 18.827 6.684 -8.331
890 2HG2 THR 116 2HG2 THR 116 19.843 6.352 -6.928
891 3HG2 THR 116 3HG2 THR 116 20.186 7.743 -7.957
892 H GLY 117 H GLY 117 18.083 8.931 -10.007
893 1HA GLY 117 2HA GLY 117 16.397 6.905 -10.750
894 2HA GLY 117 1HA GLY 117 15.346 8.311 -10.624
895 H ARG 118 H ARG 118 18.448 7.313 -12.031
896 HA ARG 118 HA ARG 118 17.872 9.076 -14.328
897 1HB ARG 118 2HB ARG 118 19.888 9.588 -12.832
898 2HB ARG 118 1HB ARG 118 20.605 8.120 -13.482
899 1HG ARG 118 2HG ARG 118 20.513 9.037 -15.725
900 2HG ARG 118 1HG ARG 118 19.726 10.493 -15.113
901 1HD ARG 118 2HD ARG 118 21.719 10.940 -13.721
902 2HD ARG 118 1HD ARG 118 22.503 9.529 -14.434
903 HE ARG 118 HE ARG 118 21.624 11.265 -16.481
904 1HH1 ARG 118 1HH1 ARG 118 24.062 11.028 -13.967
905 2HH1 ARG 118 2HH1 ARG 118 25.219 12.003 -14.823
906 1HH2 ARG 118 1HH2 ARG 118 23.148 12.557 -17.605
907 2HH2 ARG 118 2HH2 ARG 118 24.694 12.908 -16.875
908 H GLU 119 H GLU 119 17.001 6.315 -13.868
909 HA GLU 119 HA GLU 119 18.610 4.620 -15.543
910 1HB GLU 119 2HB GLU 119 17.179 3.870 -13.568
911 2HB GLU 119 1HB GLU 119 15.785 4.104 -14.606
912 1HG GLU 119 2HG GLU 119 18.040 2.313 -15.422
913 2HG GLU 119 1HG GLU 119 16.766 1.747 -14.348
914 H GLU 120 H GLU 120 18.721 5.215 -17.597
915 HA GLU 120 HA GLU 120 16.211 5.693 -19.061
916 1HB GLU 120 2HB GLU 120 18.972 6.693 -19.794
917 2HB GLU 120 1HB GLU 120 17.460 7.087 -20.602
918 1HG GLU 120 2HG GLU 120 16.679 8.235 -18.598
919 2HG GLU 120 1HG GLU 120 18.187 7.838 -17.778
920 H LYS 121 H LYS 121 15.752 4.287 -20.670
921 HA LYS 121 HA LYS 121 17.850 2.360 -21.376
922 1HB LYS 121 2HB LYS 121 16.180 0.574 -21.334
923 2HB LYS 121 1HB LYS 121 16.340 1.345 -19.764
924 1HG LYS 121 2HG LYS 121 14.303 2.600 -20.135
925 2HG LYS 121 1HG LYS 121 14.151 1.917 -21.755
926 1HD LYS 121 2HD LYS 121 13.946 -0.323 -20.791
927 2HD LYS 121 1HD LYS 121 14.101 0.362 -19.171
928 1HE LYS 121 2HE LYS 121 12.063 1.679 -19.552
929 2HE LYS 121 1HE LYS 121 11.903 0.950 -21.150
930 1HZ LYS 121 1HZ LYS 121 10.504 -0.147 -19.505
931 2HZ LYS 121 2HZ LYS 121 11.864 -0.533 -18.577
932 3HZ LYS 121 3HZ LYS 121 11.668 -1.212 -20.118
933 H ASP 122 H ASP 122 17.446 1.133 -23.337
934 HA ASP 122 HA ASP 122 16.367 2.836 -25.433
935 1HB ASP 122 2HB ASP 122 17.849 0.199 -25.549
936 2HB ASP 122 1HB ASP 122 17.318 1.105 -26.960
937 H GLU 123 H GLU 123 14.716 2.200 -26.839
938 HA GLU 123 HA GLU 123 13.191 -0.189 -26.104
939 1HB GLU 123 2HB GLU 123 12.010 2.565 -26.514
940 2HB GLU 123 1HB GLU 123 11.101 1.093 -26.225
941 1HG GLU 123 2HG GLU 123 11.997 0.916 -24.003
942 2HG GLU 123 1HG GLU 123 13.067 2.287 -24.290
943 H LYS 124 H LYS 124 12.127 -1.160 -27.801
944 HA LYS 124 HA LYS 124 12.415 0.150 -30.428
945 1HB LYS 124 2HB LYS 124 12.281 -2.799 -29.774
946 2HB LYS 124 1HB LYS 124 12.197 -2.148 -31.404
947 1HG LYS 124 2HG LYS 124 14.455 -1.095 -30.953
948 2HG LYS 124 1HG LYS 124 14.518 -2.093 -29.500
949 1HD LYS 124 2HD LYS 124 15.677 -3.222 -31.288
950 2HD LYS 124 1HD LYS 124 14.191 -4.100 -30.918
951 1HE LYS 124 2HE LYS 124 13.087 -2.939 -32.809
952 2HE LYS 124 1HE LYS 124 14.625 -2.175 -33.199
953 1HZ LYS 124 1HZ LYS 124 15.546 -4.470 -33.454
954 2HZ LYS 124 2HZ LYS 124 14.384 -4.035 -34.611
955 3HZ LYS 124 3HZ LYS 124 13.960 -5.065 -33.331
956 H SER 125 H SER 125 10.518 1.293 -30.274
957 HA SER 125 HA SER 125 8.050 -0.182 -29.772
958 1HB SER 125 2HB SER 125 8.591 2.098 -28.723
959 2HB SER 125 1HB SER 125 8.319 2.777 -30.327
960 HG SER 125 HG SER 125 6.414 2.878 -29.148
961 H LYS 126 H LYS 126 7.591 -1.336 -31.590
962 HA LYS 126 HA LYS 126 8.001 -0.164 -34.206
963 1HB LYS 126 2HB LYS 126 7.226 -2.341 -35.068
964 2HB LYS 126 1HB LYS 126 8.538 -2.520 -33.913
965 1HG LYS 126 2HG LYS 126 7.006 -3.229 -32.203
966 2HG LYS 126 1HG LYS 126 5.625 -2.897 -33.251
967 1HD LYS 126 2HD LYS 126 6.450 -4.610 -34.825
968 2HD LYS 126 1HD LYS 126 7.771 -4.968 -33.713
969 1HE LYS 126 2HE LYS 126 6.206 -5.671 -32.014
970 2HE LYS 126 1HE LYS 126 4.842 -5.203 -33.033
971 1HZ LYS 126 1HZ LYS 126 5.549 -6.879 -34.646
972 2HZ LYS 126 2HZ LYS 126 5.203 -7.576 -33.139
973 3HZ LYS 126 3HZ LYS 126 6.814 -7.349 -33.620
974 H SER 127 H SER 127 6.511 0.789 -35.413
975 HA SER 127 HA SER 127 3.700 0.301 -34.954
976 1HB SER 127 2HB SER 127 4.316 2.068 -33.284
977 2HB SER 127 1HB SER 127 4.788 3.107 -34.629
978 HG SER 127 HG SER 127 2.750 3.691 -34.502
979 H LEU 128 H LEU 128 3.050 -0.089 -36.934
980 HA LEU 128 HA LEU 128 3.911 1.695 -39.111
981 1HB LEU 128 2HB LEU 128 4.176 -0.768 -39.446
982 2HB LEU 128 1HB LEU 128 2.439 -0.944 -39.285
983 HG LEU 128 HG LEU 128 2.112 0.432 -41.302
984 1HD1 LEU 128 1HD1 LEU 128 4.038 1.010 -42.704
985 2HD1 LEU 128 2HD1 LEU 128 5.128 0.415 -41.450
986 3HD1 LEU 128 3HD1 LEU 128 4.109 1.819 -41.137
987 1HD2 LEU 128 1HD2 LEU 128 2.254 -1.987 -41.514
988 2HD2 LEU 128 2HD2 LEU 128 4.007 -1.887 -41.667
989 3HD2 LEU 128 3HD2 LEU 128 2.973 -1.199 -42.919
990 H GLU 129 H GLU 129 2.598 3.440 -39.049
991 HA GLU 129 HA GLU 129 -0.284 2.989 -38.744
992 1HB GLU 129 2HB GLU 129 -0.386 4.794 -37.046
993 2HB GLU 129 1HB GLU 129 0.539 3.401 -36.500
994 1HG GLU 129 2HG GLU 129 2.612 4.542 -36.931
995 2HG GLU 129 1HG GLU 129 1.755 5.906 -37.644
996 H HIS 130 H HIS 130 -1.520 5.036 -39.021
997 HA HIS 130 HA HIS 130 -2.092 6.987 -39.994
998 1HB HIS 130 2HB HIS 130 -0.081 7.913 -38.900
999 2HB HIS 130 1HB HIS 130 0.877 7.462 -40.306
1000 HD1 HIS 130 1HD HIS 130 0.999 9.122 -42.178
1001 HD2 HIS 130 2HD HIS 130 -2.047 9.977 -39.473
1002 HE1 HIS 130 1HE HIS 130 0.112 11.385 -42.841
1003 HE2 HIS 130 2HE HIS 130 -1.822 11.816 -41.284
1004 H HIS 131 H HIS 131 -3.135 6.132 -41.750
1005 HA HIS 131 HA HIS 131 -1.602 5.842 -44.227
1006 1HB HIS 131 2HB HIS 131 -3.706 5.081 -45.254
1007 2HB HIS 131 1HB HIS 131 -3.324 4.144 -43.818
1008 HD1 HIS 131 1HD HIS 131 -5.815 6.610 -45.160
1009 HD2 HIS 131 2HD HIS 131 -5.147 4.369 -41.724
1010 HE1 HIS 131 1HE HIS 131 -7.948 6.744 -43.841
1011 HE2 HIS 131 2HE HIS 131 -7.576 5.251 -41.842
1012 H HIS 132 H HIS 132 -1.526 7.394 -45.769
1013 HA HIS 132 HA HIS 132 -3.163 9.788 -45.253
1014 1HB HIS 132 2HB HIS 132 -1.369 11.206 -45.832
1015 2HB HIS 132 1HB HIS 132 -0.669 9.988 -44.779
1016 HD1 HIS 132 1HD HIS 132 0.711 8.022 -46.116
1017 HD2 HIS 132 2HD HIS 132 -0.113 11.525 -48.211
1018 HE1 HIS 132 1HE HIS 132 2.310 8.051 -48.058
1019 HE2 HIS 132 2HE HIS 132 1.905 10.254 -49.218
1020 H HIS 133 H HIS 133 -4.365 10.566 -46.839
1021 HA HIS 133 HA HIS 133 -3.822 9.631 -49.588
1022 1HB HIS 133 2HB HIS 133 -5.890 8.622 -48.595
1023 2HB HIS 133 1HB HIS 133 -6.551 10.244 -48.419
1024 HD1 HIS 133 1HD HIS 133 -7.520 11.354 -50.486
1025 HD2 HIS 133 2HD HIS 133 -5.732 7.681 -51.259
1026 HE1 HIS 133 1HE HIS 133 -8.163 10.769 -52.847
1027 HE2 HIS 133 2HE HIS 133 -7.248 8.450 -53.211
1028 H HIS 134 H HIS 134 -2.836 11.337 -50.470
1029 HA HIS 134 HA HIS 134 -3.725 14.044 -49.777
1030 1HB HIS 134 2HB HIS 134 -1.319 13.439 -49.568
1031 2HB HIS 134 1HB HIS 134 -1.270 13.114 -51.293
1032 HD1 HIS 134 1HD HIS 134 -1.477 15.930 -48.824
1033 HD2 HIS 134 2HD HIS 134 -1.048 15.350 -52.922
1034 HE1 HIS 134 1HE HIS 134 -0.803 18.165 -49.763
1035 HE2 HIS 134 2HE HIS 134 -0.723 17.830 -52.259
1036 H HIS 135 H HIS 135 -4.486 15.480 -51.285
1037 HA HIS 135 HA HIS 135 -5.504 14.376 -53.750
1038 1HB HIS 135 2HB HIS 135 -5.602 17.182 -52.617
1039 2HB HIS 135 1HB HIS 135 -6.377 16.702 -54.120
1040 HD1 HIS 135 1HD HIS 135 -7.305 17.422 -50.861
1041 HD2 HIS 135 2HD HIS 135 -8.121 14.206 -53.374
1042 HE1 HIS 135 1HE HIS 135 -9.410 16.374 -49.963
1043 HE2 HIS 135 2HE HIS 135 -9.910 14.454 -51.519
Start of MODEL 13
1 1H MET 1 1HT MET 1 -15.409 32.792 -18.588
2 2H MET 1 2HT MET 1 -14.194 33.944 -18.881
3 3H MET 1 3HT MET 1 -13.788 32.415 -18.267
4 HA MET 1 HA MET 1 -15.023 32.892 -20.911
5 1HB MET 1 2HB MET 1 -12.749 33.806 -20.844
6 2HB MET 1 1HB MET 1 -12.142 32.281 -20.210
7 1HG MET 1 2HG MET 1 -12.792 31.163 -22.289
8 2HG MET 1 1HG MET 1 -13.394 32.696 -22.917
9 1HE MET 1 1HE MET 1 -11.887 32.359 -25.094
10 2HE MET 1 2HE MET 1 -11.278 30.837 -24.446
11 3HE MET 1 3HE MET 1 -10.151 32.057 -25.037
12 H ILE 2 H ILE 2 -12.997 30.611 -19.060
13 HA ILE 2 HA ILE 2 -12.921 28.352 -18.951
14 HB ILE 2 HB ILE 2 -15.789 28.439 -19.917
15 1HG1 ILE 2 2HG1 ILE 2 -15.447 29.628 -17.789
16 2HG1 ILE 2 1HG1 ILE 2 -16.386 28.155 -17.563
17 1HG2 ILE 2 1HG2 ILE 2 -15.969 26.174 -18.996
18 2HG2 ILE 2 2HG2 ILE 2 -14.248 26.195 -18.619
19 3HG2 ILE 2 3HG2 ILE 2 -14.781 26.250 -20.298
20 1HD1 ILE 2 1HD1 ILE 2 -13.452 28.482 -16.974
21 2HD1 ILE 2 2HD1 ILE 2 -14.405 27.017 -16.729
22 3HD1 ILE 2 3HD1 ILE 2 -14.759 28.465 -15.789
23 H MET 3 H MET 3 -11.372 28.189 -20.526
24 HA MET 3 HA MET 3 -12.149 27.879 -23.309
25 1HB MET 3 2HB MET 3 -10.147 29.166 -22.746
26 2HB MET 3 1HB MET 3 -9.451 27.773 -21.932
27 1HG MET 3 2HG MET 3 -8.414 28.049 -24.079
28 2HG MET 3 1HG MET 3 -9.386 26.582 -24.084
29 1HE MET 3 1HE MET 3 -9.166 26.558 -26.764
30 2HE MET 3 2HE MET 3 -8.233 28.052 -26.692
31 3HE MET 3 3HE MET 3 -9.615 27.931 -27.780
32 H VAL 4 H VAL 4 -11.805 25.922 -20.603
33 HA VAL 4 HA VAL 4 -11.624 23.703 -20.200
34 HB VAL 4 HB VAL 4 -12.273 23.284 -23.131
35 1HG1 VAL 4 1HG1 VAL 4 -13.118 21.109 -22.382
36 2HG1 VAL 4 2HG1 VAL 4 -12.580 21.472 -20.741
37 3HG1 VAL 4 3HG1 VAL 4 -11.399 21.300 -22.039
38 1HG2 VAL 4 1HG2 VAL 4 -14.621 23.017 -22.363
39 2HG2 VAL 4 2HG2 VAL 4 -14.000 24.654 -22.147
40 3HG2 VAL 4 3HG2 VAL 4 -14.123 23.571 -20.762
41 H SER 5 H SER 5 -9.402 24.240 -19.872
42 HA SER 5 HA SER 5 -7.552 24.048 -22.059
43 1HB SER 5 2HB SER 5 -6.986 24.413 -19.110
44 2HB SER 5 1HB SER 5 -5.877 24.732 -20.446
45 HG SER 5 HG SER 5 -6.798 26.673 -19.868
46 H GLY 6 H GLY 6 -7.195 22.071 -22.816
47 1HA GLY 6 2HA GLY 6 -6.209 20.053 -20.899
48 2HA GLY 6 1HA GLY 6 -6.903 19.671 -22.474
49 H CYS 7 H CYS 7 -4.237 18.953 -21.451
50 HA CYS 7 HA CYS 7 -2.663 20.361 -23.484
51 1HB CYS 7 2HB CYS 7 -2.102 21.307 -21.291
52 2HB CYS 7 1HB CYS 7 -1.717 19.697 -20.694
53 HG CYS 7 HG CYS 7 0.218 19.659 -23.085
54 H GLN 8 H GLN 8 -1.876 19.008 -24.902
55 HA GLN 8 HA GLN 8 -1.145 16.302 -24.012
56 1HB GLN 8 2HB GLN 8 -1.855 17.334 -26.764
57 2HB GLN 8 1HB GLN 8 -1.198 15.728 -26.463
58 1HG GLN 8 2HG GLN 8 -3.130 15.355 -24.894
59 2HG GLN 8 1HG GLN 8 -3.814 16.853 -25.516
60 1HE2 GLN 8 1HE2 GLN 8 -4.746 14.083 -25.608
61 2HE2 GLN 8 2HE2 GLN 8 -5.031 13.736 -27.279
62 H GLN 9 H GLN 9 0.620 15.718 -26.169
63 HA GLN 9 HA GLN 9 2.891 15.700 -26.398
64 1HB GLN 9 2HB GLN 9 2.474 18.695 -26.239
65 2HB GLN 9 1HB GLN 9 3.991 17.934 -26.695
66 1HG GLN 9 2HG GLN 9 1.396 17.543 -28.160
67 2HG GLN 9 1HG GLN 9 2.619 18.731 -28.605
68 1HE2 GLN 9 1HE2 GLN 9 2.964 17.811 -30.599
69 2HE2 GLN 9 2HE2 GLN 9 3.784 16.303 -30.806
70 H GLN 10 H GLN 10 2.160 15.005 -24.003
71 HA GLN 10 HA GLN 10 2.754 16.503 -21.771
72 1HB GLN 10 2HB GLN 10 1.529 14.368 -21.753
73 2HB GLN 10 1HB GLN 10 3.022 13.514 -22.106
74 1HG GLN 10 2HG GLN 10 3.949 14.338 -19.967
75 2HG GLN 10 1HG GLN 10 2.383 15.068 -19.612
76 1HE2 GLN 10 1HE2 GLN 10 2.770 12.017 -21.265
77 2HE2 GLN 10 2HE2 GLN 10 2.134 11.027 -19.999
78 H LYS 11 H LYS 11 4.588 17.512 -21.375
79 HA LYS 11 HA LYS 11 7.148 16.512 -22.122
80 1HB LYS 11 2HB LYS 11 6.619 18.936 -21.869
81 2HB LYS 11 1HB LYS 11 6.468 18.693 -20.136
82 1HG LYS 11 2HG LYS 11 8.760 18.265 -19.883
83 2HG LYS 11 1HG LYS 11 8.989 18.028 -21.618
84 1HD LYS 11 2HD LYS 11 8.188 20.646 -20.344
85 2HD LYS 11 1HD LYS 11 9.844 20.218 -20.784
86 1HE LYS 11 2HE LYS 11 9.148 19.970 -23.122
87 2HE LYS 11 1HE LYS 11 7.499 20.397 -22.673
88 1HZ LYS 11 1HZ LYS 11 8.681 22.290 -23.601
89 2HZ LYS 11 2HZ LYS 11 9.871 22.172 -22.398
90 3HZ LYS 11 3HZ LYS 11 8.280 22.575 -21.979
91 H GLU 12 H GLU 12 8.536 15.292 -20.971
92 HA GLU 12 HA GLU 12 7.403 13.552 -19.092
93 1HB GLU 12 2HB GLU 12 9.188 12.919 -20.648
94 2HB GLU 12 1HB GLU 12 10.312 13.960 -19.789
95 1HG GLU 12 2HG GLU 12 10.207 12.579 -17.842
96 2HG GLU 12 1HG GLU 12 8.905 11.614 -18.544
97 H GLU 13 H GLU 13 7.244 13.580 -16.975
98 HA GLU 13 HA GLU 13 9.048 15.231 -15.376
99 1HB GLU 13 2HB GLU 13 6.979 16.545 -15.781
100 2HB GLU 13 1HB GLU 13 6.030 15.240 -15.090
101 1HG GLU 13 2HG GLU 13 6.384 17.116 -13.534
102 2HG GLU 13 1HG GLU 13 7.021 15.586 -12.932
103 H THR 14 H THR 14 8.927 14.623 -13.050
104 HA THR 14 HA THR 14 9.140 11.789 -12.812
105 HB THR 14 HB THR 14 9.177 13.851 -10.601
106 HG1 THR 14 1HG THR 14 10.719 14.406 -12.155
107 1HG2 THR 14 1HG2 THR 14 10.626 12.209 -9.470
108 2HG2 THR 14 2HG2 THR 14 10.390 11.089 -10.813
109 3HG2 THR 14 3HG2 THR 14 9.023 11.553 -9.798
110 HA PRO 15 HA PRO 15 4.844 10.949 -11.776
111 1HB PRO 15 2HB PRO 15 6.051 8.448 -10.724
112 2HB PRO 15 1HB PRO 15 4.743 8.661 -11.892
113 1HG PRO 15 2HG PRO 15 7.169 7.875 -12.677
114 2HG PRO 15 1HG PRO 15 6.198 8.983 -13.665
115 1HD PRO 15 2HD PRO 15 8.525 9.572 -11.878
116 2HD PRO 15 1HD PRO 15 8.114 10.266 -13.460
117 H PHE 16 H PHE 16 3.879 11.694 -9.997
118 HA PHE 16 HA PHE 16 5.390 12.382 -7.712
119 1HB PHE 16 2HB PHE 16 3.360 13.353 -6.862
120 2HB PHE 16 1HB PHE 16 3.461 13.683 -8.587
121 HD1 PHE 16 2HD PHE 16 2.017 12.409 -10.169
122 HD2 PHE 16 1HD PHE 16 1.572 12.114 -5.946
123 HE1 PHE 16 2HE PHE 16 -0.229 11.450 -10.473
124 HE2 PHE 16 1HE PHE 16 -0.673 11.156 -6.242
125 HZ PHE 16 HZ PHE 16 -1.574 10.814 -8.508
126 H TYR 17 H TYR 17 3.794 9.456 -8.467
127 HA TYR 17 HA TYR 17 3.375 8.820 -5.650
128 1HB TYR 17 2HB TYR 17 1.989 7.045 -6.365
129 2HB TYR 17 1HB TYR 17 1.590 8.392 -7.412
130 HD1 TYR 17 2HD TYR 17 2.233 8.344 -9.798
131 HD2 TYR 17 1HD TYR 17 3.039 5.052 -7.216
132 HE1 TYR 17 2HE TYR 17 2.645 6.910 -11.755
133 HE2 TYR 17 1HE TYR 17 3.450 3.613 -9.163
134 HH TYR 17 HH TYR 17 3.085 3.451 -11.449
135 H TYR 18 H TYR 18 5.817 8.557 -7.871
136 HA TYR 18 HA TYR 18 6.485 5.782 -7.414
137 1HB TYR 18 2HB TYR 18 6.814 7.009 -9.607
138 2HB TYR 18 1HB TYR 18 8.158 7.846 -8.843
139 HD1 TYR 18 1HD TYR 18 6.932 4.583 -10.033
140 HD2 TYR 18 2HD TYR 18 10.263 6.731 -8.481
141 HE1 TYR 18 1HE TYR 18 8.413 2.716 -10.638
142 HE2 TYR 18 2HE TYR 18 11.752 4.867 -9.083
143 HH TYR 18 HH TYR 18 10.817 2.364 -11.141
144 H GLY 19 H GLY 19 8.107 4.993 -6.171
145 1HA GLY 19 2HA GLY 19 10.332 5.467 -5.166
146 2HA GLY 19 1HA GLY 19 9.620 6.958 -4.568
147 H THR 20 H THR 20 10.027 6.486 -2.421
148 HA THR 20 HA THR 20 8.495 4.233 -1.304
149 HB THR 20 HB THR 20 11.049 5.415 -0.184
150 HG1 THR 20 1HG THR 20 10.738 2.812 -1.288
151 1HG2 THR 20 1HG2 THR 20 9.453 2.988 0.655
152 2HG2 THR 20 2HG2 THR 20 9.585 4.506 1.544
153 3HG2 THR 20 3HG2 THR 20 11.006 3.484 1.333
154 H TRP 21 H TRP 21 7.093 4.686 0.304
155 HA TRP 21 HA TRP 21 7.073 7.441 1.364
156 1HB TRP 21 2HB TRP 21 4.674 5.769 0.576
157 2HB TRP 21 1HB TRP 21 4.618 7.375 1.297
158 HD1 TRP 21 HD TRP 21 5.193 5.598 -2.008
159 HE1 TRP 21 1HE TRP 21 5.315 7.342 -3.896
160 HE3 TRP 21 3HE TRP 21 5.331 9.844 0.834
161 HZ2 TRP 21 2HZ TRP 21 5.457 10.151 -4.142
162 HZ3 TRP 21 3HZ TRP 21 5.462 12.021 -0.303
163 HH2 TRP 21 HH TRP 21 5.525 12.172 -2.740
164 H ASP 22 H ASP 22 6.575 7.675 3.489
165 HA ASP 22 HA ASP 22 6.528 5.251 5.138
166 1HB ASP 22 2HB ASP 22 8.176 6.722 5.924
167 2HB ASP 22 1HB ASP 22 7.186 8.142 5.621
168 H GLU 23 H GLU 23 4.604 4.511 5.867
169 HA GLU 23 HA GLU 23 2.419 6.447 6.033
170 1HB GLU 23 2HB GLU 23 0.919 4.463 6.263
171 2HB GLU 23 1HB GLU 23 1.766 4.569 4.729
172 1HG GLU 23 2HG GLU 23 3.339 2.870 5.473
173 2HG GLU 23 1HG GLU 23 2.512 2.776 7.030
174 H GLY 24 H GLY 24 3.376 7.402 7.845
175 1HA GLY 24 2HA GLY 24 3.695 6.074 10.324
176 2HA GLY 24 1HA GLY 24 3.541 7.809 10.097
177 H ARG 25 H ARG 25 0.874 6.800 8.652
178 HA ARG 25 HA ARG 25 -0.712 6.907 11.105
179 1HB ARG 25 2HB ARG 25 -1.136 8.603 9.331
180 2HB ARG 25 1HB ARG 25 -1.558 7.317 8.223
181 1HG ARG 25 2HG ARG 25 -3.045 7.711 10.796
182 2HG ARG 25 1HG ARG 25 -3.427 8.650 9.355
183 1HD ARG 25 2HD ARG 25 -3.668 6.423 8.150
184 2HD ARG 25 1HD ARG 25 -3.619 5.673 9.745
185 HE ARG 25 HE ARG 25 -5.631 7.744 9.135
186 1HH1 ARG 25 1HH1 ARG 25 -4.834 4.470 10.101
187 2HH1 ARG 25 2HH1 ARG 25 -6.475 4.040 10.477
188 1HH2 ARG 25 1HH2 ARG 25 -7.786 7.173 9.606
189 2HH2 ARG 25 2HH2 ARG 25 -8.157 5.577 10.186
190 H ALA 26 H ALA 26 -2.148 5.331 11.553
191 HA ALA 26 HA ALA 26 -2.902 3.196 11.790
192 1HB ALA 26 1HB ALA 26 -3.862 3.528 9.540
193 2HB ALA 26 2HB ALA 26 -3.387 1.857 9.840
194 3HB ALA 26 3HB ALA 26 -2.373 2.894 8.837
195 HA PRO 27 HA PRO 27 0.861 0.832 12.110
196 1HB PRO 27 2HB PRO 27 -0.076 -1.123 13.702
197 2HB PRO 27 1HB PRO 27 0.168 0.525 14.287
198 1HG PRO 27 2HG PRO 27 -2.339 -0.906 13.699
199 2HG PRO 27 1HG PRO 27 -2.059 0.479 14.763
200 1HD PRO 27 2HD PRO 27 -3.100 0.478 12.086
201 2HD PRO 27 1HD PRO 27 -2.819 1.868 13.152
202 H GLY 28 H GLY 28 1.601 -1.469 11.813
203 1HA GLY 28 2HA GLY 28 0.365 -2.627 9.462
204 2HA GLY 28 1HA GLY 28 1.849 -3.171 10.236
205 HA PRO 29 HA PRO 29 -1.308 -6.457 11.121
206 1HB PRO 29 2HB PRO 29 0.738 -8.287 11.582
207 2HB PRO 29 1HB PRO 29 -0.167 -8.108 10.074
208 1HG PRO 29 2HG PRO 29 2.514 -7.047 10.816
209 2HG PRO 29 1HG PRO 29 1.929 -7.638 9.250
210 1HD PRO 29 2HD PRO 29 2.217 -5.015 9.744
211 2HD PRO 29 1HD PRO 29 0.887 -5.631 8.742
212 H THR 30 H THR 30 -1.564 -7.764 13.014
213 HA THR 30 HA THR 30 -0.934 -6.328 15.392
214 HB THR 30 HB THR 30 -2.212 -9.055 15.161
215 HG1 THR 30 1HG THR 30 -3.706 -6.662 15.275
216 1HG2 THR 30 1HG2 THR 30 -2.568 -6.851 17.195
217 2HG2 THR 30 2HG2 THR 30 -1.626 -8.320 17.441
218 3HG2 THR 30 3HG2 THR 30 -3.371 -8.422 17.205
219 H ASP 31 H ASP 31 0.997 -8.287 13.666
220 HA ASP 31 HA ASP 31 2.012 -10.133 15.533
221 1HB ASP 31 2HB ASP 31 2.409 -10.199 13.049
222 2HB ASP 31 1HB ASP 31 3.546 -8.871 13.257
223 H GLY 32 H GLY 32 2.981 -6.857 14.673
224 1HA GLY 32 2HA GLY 32 3.585 -5.701 16.945
225 2HA GLY 32 1HA GLY 32 4.921 -6.839 16.877
226 H VAL 33 H VAL 33 3.320 -4.536 14.681
227 HA VAL 33 HA VAL 33 5.958 -3.875 13.577
228 HB VAL 33 HB VAL 33 3.309 -2.984 12.465
229 1HG1 VAL 33 1HG1 VAL 33 5.248 -1.799 11.644
230 2HG1 VAL 33 2HG1 VAL 33 4.534 -2.797 10.375
231 3HG1 VAL 33 3HG1 VAL 33 6.006 -3.325 11.191
232 1HG2 VAL 33 1HG2 VAL 33 4.805 -5.516 11.811
233 2HG2 VAL 33 2HG2 VAL 33 3.403 -4.895 10.937
234 3HG2 VAL 33 3HG2 VAL 33 3.242 -5.406 12.618
235 H LYS 34 H LYS 34 6.847 -1.910 13.814
236 HA LYS 34 HA LYS 34 5.604 -0.042 15.615
237 1HB LYS 34 2HB LYS 34 8.255 -0.072 14.179
238 2HB LYS 34 1HB LYS 34 7.745 1.252 15.209
239 1HG LYS 34 2HG LYS 34 7.821 -1.553 16.245
240 2HG LYS 34 1HG LYS 34 9.280 -0.564 16.189
241 1HD LYS 34 2HD LYS 34 8.384 -0.303 18.363
242 2HD LYS 34 1HD LYS 34 8.001 1.181 17.494
243 1HE LYS 34 2HE LYS 34 5.734 0.271 17.050
244 2HE LYS 34 1HE LYS 34 6.138 -1.125 18.046
245 1HZ LYS 34 1HZ LYS 34 4.926 0.467 19.346
246 2HZ LYS 34 2HZ LYS 34 6.020 1.703 18.946
247 3HZ LYS 34 3HZ LYS 34 6.525 0.407 19.913
248 H SER 35 H SER 35 6.411 -0.239 12.238
249 HA SER 35 HA SER 35 4.550 1.751 11.430
250 1HB SER 35 2HB SER 35 7.491 2.486 11.211
251 2HB SER 35 1HB SER 35 6.158 3.385 10.494
252 HG SER 35 HG SER 35 5.619 3.082 13.072
253 H ALA 36 H ALA 36 4.770 2.119 8.998
254 HA ALA 36 HA ALA 36 6.094 -0.174 7.723
255 1HB ALA 36 1HB ALA 36 3.717 -0.697 8.049
256 2HB ALA 36 2HB ALA 36 4.151 -0.593 6.342
257 3HB ALA 36 3HB ALA 36 3.285 0.736 7.117
258 H THR 37 H THR 37 6.762 0.123 5.612
259 HA THR 37 HA THR 37 6.425 2.804 4.462
260 HB THR 37 HB THR 37 8.849 2.499 3.607
261 HG1 THR 37 1HG THR 37 8.694 0.267 4.851
262 1HG2 THR 37 1HG2 THR 37 8.347 3.101 6.524
263 2HG2 THR 37 2HG2 THR 37 8.191 4.241 5.187
264 3HG2 THR 37 3HG2 THR 37 9.773 3.581 5.600
265 H VAL 38 H VAL 38 5.943 2.792 2.336
266 HA VAL 38 HA VAL 38 5.984 0.164 1.002
267 HB VAL 38 HB VAL 38 3.712 1.003 1.449
268 1HG1 VAL 38 1HG1 VAL 38 2.867 2.958 0.223
269 2HG1 VAL 38 2HG1 VAL 38 4.510 3.307 -0.313
270 3HG1 VAL 38 3HG1 VAL 38 4.108 3.381 1.403
271 1HG2 VAL 38 1HG2 VAL 38 4.441 0.993 -1.477
272 2HG2 VAL 38 2HG2 VAL 38 2.823 0.745 -0.821
273 3HG2 VAL 38 3HG2 VAL 38 4.100 -0.426 -0.489
274 H THR 39 H THR 39 6.837 -0.020 -1.000
275 HA THR 39 HA THR 39 7.888 2.432 -2.253
276 HB THR 39 HB THR 39 9.084 -0.349 -2.376
277 HG1 THR 39 1HG THR 39 9.543 0.552 -0.382
278 1HG2 THR 39 1HG2 THR 39 9.464 0.931 -4.429
279 2HG2 THR 39 2HG2 THR 39 10.962 0.750 -3.514
280 3HG2 THR 39 3HG2 THR 39 10.084 2.280 -3.478
281 H PHE 40 H PHE 40 7.195 2.838 -4.262
282 HA PHE 40 HA PHE 40 5.576 0.775 -5.591
283 1HB PHE 40 2HB PHE 40 5.706 3.772 -5.985
284 2HB PHE 40 1HB PHE 40 4.746 2.691 -6.988
285 HD1 PHE 40 1HD PHE 40 2.744 1.640 -6.125
286 HD2 PHE 40 2HD PHE 40 5.045 4.296 -3.721
287 HE1 PHE 40 1HE PHE 40 0.865 1.841 -4.549
288 HE2 PHE 40 2HE PHE 40 3.173 4.492 -2.140
289 HZ PHE 40 HZ PHE 40 1.079 3.264 -2.555
290 H THR 41 H THR 41 6.521 -0.331 -7.130
291 HA THR 41 HA THR 41 8.776 0.863 -8.566
292 HB THR 41 HB THR 41 9.283 -1.451 -9.319
293 HG1 THR 41 1HG THR 41 8.082 -3.137 -8.657
294 1HG2 THR 41 1HG2 THR 41 10.084 -2.274 -7.138
295 2HG2 THR 41 2HG2 THR 41 9.078 -1.069 -6.334
296 3HG2 THR 41 3HG2 THR 41 10.412 -0.555 -7.365
297 H GLU 42 H GLU 42 8.856 -0.358 -10.880
298 HA GLU 42 HA GLU 42 7.212 0.965 -12.584
299 1HB GLU 42 2HB GLU 42 9.201 -0.202 -13.309
300 2HB GLU 42 1HB GLU 42 8.464 -1.756 -12.953
301 1HG GLU 42 2HG GLU 42 6.783 -1.319 -14.704
302 2HG GLU 42 1HG GLU 42 7.623 0.184 -15.091
303 H ASP 43 H ASP 43 6.669 -2.424 -11.552
304 HA ASP 43 HA ASP 43 3.864 -2.116 -12.410
305 1HB ASP 43 2HB ASP 43 5.148 -3.385 -14.077
306 2HB ASP 43 1HB ASP 43 5.653 -4.521 -12.835
307 H GLU 44 H GLU 44 5.828 -2.660 -9.813
308 HA GLU 44 HA GLU 44 3.879 -4.467 -8.541
309 1HB GLU 44 2HB GLU 44 6.749 -4.259 -7.659
310 2HB GLU 44 1HB GLU 44 5.580 -5.511 -7.280
311 1HG GLU 44 2HG GLU 44 6.949 -6.576 -8.771
312 2HG GLU 44 1HG GLU 44 5.663 -5.996 -9.829
313 H VAL 45 H VAL 45 3.450 -4.167 -6.324
314 HA VAL 45 HA VAL 45 4.403 -1.612 -5.175
315 HB VAL 45 HB VAL 45 1.874 -3.137 -4.477
316 1HG1 VAL 45 1HG1 VAL 45 1.345 -1.177 -3.095
317 2HG1 VAL 45 2HG1 VAL 45 2.921 -0.488 -3.485
318 3HG1 VAL 45 3HG1 VAL 45 2.817 -1.984 -2.558
319 1HG2 VAL 45 1HG2 VAL 45 0.675 -1.249 -5.467
320 2HG2 VAL 45 2HG2 VAL 45 1.708 -2.039 -6.659
321 3HG2 VAL 45 3HG2 VAL 45 2.209 -0.513 -5.932
322 H VAL 46 H VAL 46 5.895 -1.931 -3.637
323 HA VAL 46 HA VAL 46 5.963 -4.566 -2.317
324 HB VAL 46 HB VAL 46 8.221 -2.580 -2.555
325 1HG1 VAL 46 1HG1 VAL 46 9.635 -4.482 -1.897
326 2HG1 VAL 46 2HG1 VAL 46 8.190 -5.469 -1.691
327 3HG1 VAL 46 3HG1 VAL 46 8.456 -4.068 -0.654
328 1HG2 VAL 46 1HG2 VAL 46 7.745 -5.065 -4.190
329 2HG2 VAL 46 2HG2 VAL 46 9.160 -4.015 -4.280
330 3HG2 VAL 46 3HG2 VAL 46 7.578 -3.406 -4.766
331 H GLU 47 H GLU 47 5.429 -4.634 -0.238
332 HA GLU 47 HA GLU 47 5.539 -2.157 1.311
333 1HB GLU 47 2HB GLU 47 3.878 -4.613 1.490
334 2HB GLU 47 1HB GLU 47 4.249 -3.768 2.984
335 1HG GLU 47 2HG GLU 47 3.222 -1.774 2.205
336 2HG GLU 47 1HG GLU 47 3.051 -2.434 0.582
337 H THR 48 H THR 48 6.753 -1.931 2.993
338 HA THR 48 HA THR 48 8.297 -4.232 3.986
339 HB THR 48 HB THR 48 9.829 -1.925 4.489
340 HG1 THR 48 1HG THR 48 8.469 -1.082 2.655
341 1HG2 THR 48 1HG2 THR 48 10.712 -4.165 4.090
342 2HG2 THR 48 2HG2 THR 48 11.459 -3.000 2.995
343 3HG2 THR 48 3HG2 THR 48 10.195 -4.080 2.408
344 H GLU 49 H GLU 49 7.805 -4.596 6.035
345 HA GLU 49 HA GLU 49 6.670 -2.384 7.603
346 1HB GLU 49 2HB GLU 49 6.324 -5.333 8.137
347 2HB GLU 49 1HB GLU 49 5.380 -4.000 8.790
348 1HG GLU 49 2HG GLU 49 4.574 -3.518 6.492
349 2HG GLU 49 1HG GLU 49 5.414 -4.963 5.938
350 H VAL 50 H VAL 50 7.675 -1.727 9.399
351 HA VAL 50 HA VAL 50 10.220 -2.994 10.030
352 HB VAL 50 HB VAL 50 9.041 -0.442 11.147
353 1HG1 VAL 50 1HG1 VAL 50 11.863 -1.509 11.211
354 2HG1 VAL 50 2HG1 VAL 50 10.755 -1.434 12.580
355 3HG1 VAL 50 3HG1 VAL 50 11.337 0.055 11.833
356 1HG2 VAL 50 1HG2 VAL 50 10.546 0.719 9.583
357 2HG2 VAL 50 2HG2 VAL 50 9.345 -0.257 8.736
358 3HG2 VAL 50 3HG2 VAL 50 11.003 -0.837 8.886
359 H MET 51 H MET 51 10.262 -4.537 11.475
360 HA MET 51 HA MET 51 8.485 -4.355 13.814
361 1HB MET 51 2HB MET 51 9.201 -6.677 12.059
362 2HB MET 51 1HB MET 51 8.737 -6.943 13.731
363 1HG MET 51 2HG MET 51 6.585 -6.013 13.375
364 2HG MET 51 1HG MET 51 7.047 -5.398 11.789
365 1HE MET 51 1HE MET 51 8.439 -7.629 10.250
366 2HE MET 51 2HE MET 51 7.054 -6.734 9.624
367 3HE MET 51 3HE MET 51 7.081 -8.496 9.534
368 H GLU 52 H GLU 52 9.433 -4.502 15.753
369 HA GLU 52 HA GLU 52 12.229 -4.209 15.939
370 1HB GLU 52 2HB GLU 52 10.531 -3.284 17.541
371 2HB GLU 52 1HB GLU 52 10.328 -4.910 18.177
372 1HG GLU 52 2HG GLU 52 11.813 -3.596 19.579
373 2HG GLU 52 1HG GLU 52 12.665 -4.956 18.849
374 H GLY 53 H GLY 53 13.824 -5.630 16.243
375 1HA GLY 53 2HA GLY 53 14.700 -7.653 17.208
376 2HA GLY 53 1HA GLY 53 13.119 -8.390 16.985
377 H ARG 54 H ARG 54 12.883 -7.261 14.254
378 HA ARG 54 HA ARG 54 14.782 -9.057 12.915
379 1HB ARG 54 2HB ARG 54 12.988 -9.616 11.333
380 2HB ARG 54 1HB ARG 54 12.589 -10.077 12.977
381 1HG ARG 54 2HG ARG 54 11.391 -7.791 13.052
382 2HG ARG 54 1HG ARG 54 11.449 -7.899 11.293
383 1HD ARG 54 2HD ARG 54 9.357 -8.801 12.015
384 2HD ARG 54 1HD ARG 54 10.366 -10.141 11.471
385 HE ARG 54 HE ARG 54 10.892 -10.319 14.006
386 1HH1 ARG 54 1HH1 ARG 54 7.805 -9.444 12.605
387 2HH1 ARG 54 2HH1 ARG 54 6.871 -10.077 13.928
388 1HH2 ARG 54 1HH2 ARG 54 9.678 -11.123 15.763
389 2HH2 ARG 54 2HH2 ARG 54 7.942 -11.013 15.739
390 H GLY 55 H GLY 55 12.915 -6.090 12.741
391 1HA GLY 55 2HA GLY 55 13.846 -4.103 11.794
392 2HA GLY 55 1HA GLY 55 14.825 -5.105 10.728
393 H GLU 56 H GLU 56 14.100 -3.902 8.910
394 HA GLU 56 HA GLU 56 11.361 -3.828 8.171
395 1HB GLU 56 2HB GLU 56 13.756 -3.681 6.333
396 2HB GLU 56 1HB GLU 56 12.146 -3.057 6.035
397 1HG GLU 56 2HG GLU 56 13.094 -1.125 6.629
398 2HG GLU 56 1HG GLU 56 12.715 -1.693 8.248
399 H VAL 57 H VAL 57 10.166 -5.233 7.118
400 HA VAL 57 HA VAL 57 11.457 -7.678 6.104
401 HB VAL 57 HB VAL 57 8.849 -7.415 7.601
402 1HG1 VAL 57 1HG1 VAL 57 8.604 -9.850 7.309
403 2HG1 VAL 57 2HG1 VAL 57 10.018 -9.858 6.255
404 3HG1 VAL 57 3HG1 VAL 57 8.557 -9.000 5.765
405 1HG2 VAL 57 1HG2 VAL 57 9.892 -8.940 9.196
406 2HG2 VAL 57 2HG2 VAL 57 10.838 -7.463 9.009
407 3HG2 VAL 57 3HG2 VAL 57 11.365 -8.954 8.226
408 H GLN 58 H GLN 58 11.119 -8.025 4.010
409 HA GLN 58 HA GLN 58 9.206 -6.416 2.564
410 1HB GLN 58 2HB GLN 58 11.069 -8.554 1.538
411 2HB GLN 58 1HB GLN 58 10.240 -7.344 0.590
412 1HG GLN 58 2HG GLN 58 11.567 -5.593 1.641
413 2HG GLN 58 1HG GLN 58 12.397 -6.811 2.608
414 1HE2 GLN 58 1HE2 GLN 58 12.381 -8.725 0.362
415 2HE2 GLN 58 2HE2 GLN 58 13.612 -8.183 -0.721
416 H LEU 59 H LEU 59 7.187 -7.090 2.329
417 HA LEU 59 HA LEU 59 6.513 -9.903 2.561
418 1HB LEU 59 2HB LEU 59 4.807 -7.467 2.021
419 2HB LEU 59 1HB LEU 59 4.180 -9.095 2.184
420 HG LEU 59 HG LEU 59 5.611 -7.562 4.346
421 1HD1 LEU 59 1HD1 LEU 59 3.408 -7.470 5.411
422 2HD1 LEU 59 2HD1 LEU 59 2.699 -8.222 3.982
423 3HD1 LEU 59 3HD1 LEU 59 3.431 -6.623 3.862
424 1HD2 LEU 59 1HD2 LEU 59 5.971 -9.958 4.541
425 2HD2 LEU 59 2HD2 LEU 59 4.236 -10.243 4.398
426 3HD2 LEU 59 3HD2 LEU 59 4.876 -9.393 5.804
427 HA PRO 60 HA PRO 60 6.271 -10.951 -1.789
428 1HB PRO 60 2HB PRO 60 3.408 -11.578 -1.296
429 2HB PRO 60 1HB PRO 60 4.665 -12.580 -2.025
430 1HG PRO 60 2HG PRO 60 3.777 -13.008 0.474
431 2HG PRO 60 1HG PRO 60 5.460 -13.300 0.008
432 1HD PRO 60 2HD PRO 60 4.307 -11.104 1.642
433 2HD PRO 60 1HD PRO 60 5.930 -11.819 1.686
434 H PHE 61 H PHE 61 6.216 -9.312 -3.173
435 HA PHE 61 HA PHE 61 4.612 -7.018 -2.699
436 1HB PHE 61 2HB PHE 61 5.616 -6.185 -4.853
437 2HB PHE 61 1HB PHE 61 6.771 -6.636 -3.608
438 HD1 PHE 61 2HD PHE 61 5.311 -7.596 -6.842
439 HD2 PHE 61 1HD PHE 61 8.293 -8.440 -3.924
440 HE1 PHE 61 2HE PHE 61 6.455 -9.072 -8.442
441 HE2 PHE 61 1HE PHE 61 9.450 -9.908 -5.524
442 HZ PHE 61 HZ PHE 61 8.527 -10.224 -7.785
443 H MET 62 H MET 62 3.018 -6.108 -3.930
444 HA MET 62 HA MET 62 1.344 -8.072 -5.309
445 1HB MET 62 2HB MET 62 0.788 -5.374 -4.086
446 2HB MET 62 1HB MET 62 -0.381 -6.199 -5.103
447 1HG MET 62 2HG MET 62 0.779 -7.269 -2.540
448 2HG MET 62 1HG MET 62 -0.818 -6.547 -2.724
449 1HE MET 62 1HE MET 62 -0.167 -9.448 -1.458
450 2HE MET 62 2HE MET 62 -1.499 -10.385 -2.138
451 3HE MET 62 3HE MET 62 -1.790 -8.755 -1.535
452 H ALA 63 H ALA 63 0.510 -7.712 -7.368
453 HA ALA 63 HA ALA 63 1.944 -5.729 -8.963
454 1HB ALA 63 1HB ALA 63 1.772 -8.034 -9.805
455 2HB ALA 63 2HB ALA 63 1.003 -6.873 -10.888
456 3HB ALA 63 3HB ALA 63 0.017 -7.882 -9.829
457 H TYR 64 H TYR 64 1.013 -3.901 -9.721
458 HA TYR 64 HA TYR 64 -1.848 -3.555 -9.107
459 1HB TYR 64 2HB TYR 64 -1.495 -1.273 -8.596
460 2HB TYR 64 1HB TYR 64 -0.183 -2.124 -7.794
461 HD1 TYR 64 1HD TYR 64 2.129 -2.019 -8.772
462 HD2 TYR 64 2HD TYR 64 -1.069 0.343 -10.289
463 HE1 TYR 64 1HE TYR 64 3.751 -0.547 -9.891
464 HE2 TYR 64 2HE TYR 64 0.546 1.817 -11.412
465 HH TYR 64 HH TYR 64 3.895 1.009 -11.679
466 H LYS 65 H LYS 65 -3.177 -2.750 -10.653
467 HA LYS 65 HA LYS 65 -1.924 -1.932 -13.198
468 1HB LYS 65 2HB LYS 65 -4.428 -3.531 -12.742
469 2HB LYS 65 1HB LYS 65 -4.132 -2.672 -14.247
470 1HG LYS 65 2HG LYS 65 -2.004 -3.942 -14.471
471 2HG LYS 65 1HG LYS 65 -2.489 -4.883 -13.064
472 1HD LYS 65 2HD LYS 65 -3.084 -6.083 -15.085
473 2HD LYS 65 1HD LYS 65 -4.554 -5.547 -14.265
474 1HE LYS 65 2HE LYS 65 -4.632 -3.592 -15.790
475 2HE LYS 65 1HE LYS 65 -3.228 -4.235 -16.638
476 1HZ LYS 65 1HZ LYS 65 -5.263 -4.782 -17.787
477 2HZ LYS 65 2HZ LYS 65 -5.882 -5.550 -16.409
478 3HZ LYS 65 3HZ LYS 65 -4.534 -6.198 -17.206
479 H VAL 66 H VAL 66 -2.927 -0.344 -14.373
480 HA VAL 66 HA VAL 66 -4.150 1.661 -12.664
481 HB VAL 66 HB VAL 66 -3.091 1.814 -15.486
482 1HG1 VAL 66 1HG1 VAL 66 -3.343 4.244 -15.283
483 2HG1 VAL 66 2HG1 VAL 66 -4.113 4.032 -13.710
484 3HG1 VAL 66 3HG1 VAL 66 -4.903 3.430 -15.167
485 1HG2 VAL 66 1HG2 VAL 66 -1.292 3.121 -14.465
486 2HG2 VAL 66 2HG2 VAL 66 -1.381 1.498 -13.781
487 3HG2 VAL 66 3HG2 VAL 66 -2.016 2.872 -12.877
488 H ILE 67 H ILE 67 -6.234 2.045 -12.589
489 HA ILE 67 HA ILE 67 -7.989 1.014 -14.701
490 HB ILE 67 HB ILE 67 -8.875 2.436 -12.200
491 1HG1 ILE 67 2HG1 ILE 67 -8.352 -0.523 -12.528
492 2HG1 ILE 67 1HG1 ILE 67 -7.430 0.575 -11.512
493 1HG2 ILE 67 1HG2 ILE 67 -10.930 1.153 -12.538
494 2HG2 ILE 67 2HG2 ILE 67 -10.226 0.406 -13.973
495 3HG2 ILE 67 3HG2 ILE 67 -10.542 2.140 -13.949
496 1HD1 ILE 67 1HD1 ILE 67 -10.297 -0.240 -11.157
497 2HD1 ILE 67 2HD1 ILE 67 -9.482 0.990 -10.192
498 3HD1 ILE 67 3HD1 ILE 67 -8.924 -0.680 -10.144
499 H SER 68 H SER 68 -7.491 3.952 -12.806
500 HA SER 68 HA SER 68 -8.160 5.584 -15.160
501 1HB SER 68 2HB SER 68 -8.935 6.462 -12.394
502 2HB SER 68 1HB SER 68 -9.582 6.990 -13.942
503 HG SER 68 HG SER 68 -10.427 4.970 -12.337
504 H GLN 69 H GLN 69 -7.142 7.732 -15.082
505 HA GLN 69 HA GLN 69 -4.988 8.032 -13.151
506 1HB GLN 69 2HB GLN 69 -4.131 6.517 -14.966
507 2HB GLN 69 1HB GLN 69 -4.334 7.850 -16.090
508 1HG GLN 69 2HG GLN 69 -2.742 9.181 -14.813
509 2HG GLN 69 1HG GLN 69 -2.545 7.852 -13.672
510 1HE2 GLN 69 1HE2 GLN 69 -1.409 6.026 -14.296
511 2HE2 GLN 69 2HE2 GLN 69 -0.395 5.993 -15.695
512 H SER 70 H SER 70 -4.057 10.073 -13.111
513 HA SER 70 HA SER 70 -5.026 12.094 -14.988
514 1HB SER 70 2HB SER 70 -6.475 12.248 -12.986
515 2HB SER 70 1HB SER 70 -5.049 12.401 -11.970
516 HG SER 70 HG SER 70 -5.562 14.215 -14.086
517 H THR 71 H THR 71 -3.678 14.120 -14.748
518 HA THR 71 HA THR 71 -0.904 13.398 -14.631
519 HB THR 71 HB THR 71 -0.602 15.888 -15.142
520 HG1 THR 71 1HG THR 71 -2.480 16.861 -14.597
521 1HG2 THR 71 1HG2 THR 71 -0.505 14.134 -16.852
522 2HG2 THR 71 2HG2 THR 71 -1.258 15.601 -17.476
523 3HG2 THR 71 3HG2 THR 71 -2.258 14.217 -17.033
524 H ASP 72 H ASP 72 -3.147 15.259 -12.683
525 HA ASP 72 HA ASP 72 -1.155 15.475 -10.577
526 1HB ASP 72 2HB ASP 72 -1.502 17.916 -10.366
527 2HB ASP 72 1HB ASP 72 -0.739 17.476 -11.887
528 H GLY 73 H GLY 73 -4.096 14.550 -11.285
529 1HA GLY 73 2HA GLY 73 -5.366 15.752 -8.922
530 2HA GLY 73 1HA GLY 73 -6.216 14.952 -10.238
531 H SER 74 H SER 74 -5.934 12.621 -10.441
532 HA SER 74 HA SER 74 -5.237 11.257 -7.982
533 1HB SER 74 2HB SER 74 -7.529 10.099 -8.159
534 2HB SER 74 1HB SER 74 -7.473 11.711 -7.462
535 HG SER 74 HG SER 74 -8.295 10.943 -10.060
536 H ILE 75 H ILE 75 -4.960 9.035 -8.192
537 HA ILE 75 HA ILE 75 -5.139 7.930 -10.923
538 HB ILE 75 HB ILE 75 -3.014 7.173 -8.904
539 1HG1 ILE 75 2HG1 ILE 75 -2.800 9.005 -11.304
540 2HG1 ILE 75 1HG1 ILE 75 -2.594 9.460 -9.617
541 1HG2 ILE 75 1HG2 ILE 75 -3.611 5.426 -10.506
542 2HG2 ILE 75 2HG2 ILE 75 -1.975 6.019 -10.782
543 3HG2 ILE 75 3HG2 ILE 75 -3.289 6.531 -11.843
544 1HD1 ILE 75 1HD1 ILE 75 -0.606 8.060 -9.483
545 2HD1 ILE 75 2HD1 ILE 75 -0.458 9.262 -10.765
546 3HD1 ILE 75 3HD1 ILE 75 -0.821 7.582 -11.168
547 H GLU 76 H GLU 76 -6.078 5.899 -11.044
548 HA GLU 76 HA GLU 76 -6.841 4.702 -8.462
549 1HB GLU 76 2HB GLU 76 -8.737 5.663 -9.778
550 2HB GLU 76 1HB GLU 76 -8.361 4.516 -11.054
551 1HG GLU 76 2HG GLU 76 -8.972 2.677 -9.734
552 2HG GLU 76 1HG GLU 76 -9.006 3.652 -8.264
553 H ILE 77 H ILE 77 -6.222 2.690 -8.112
554 HA ILE 77 HA ILE 77 -5.070 1.177 -10.356
555 HB ILE 77 HB ILE 77 -3.307 0.329 -8.835
556 1HG1 ILE 77 2HG1 ILE 77 -4.253 2.508 -6.958
557 2HG1 ILE 77 1HG1 ILE 77 -4.516 0.787 -6.706
558 1HG2 ILE 77 1HG2 ILE 77 -2.802 2.120 -10.374
559 2HG2 ILE 77 2HG2 ILE 77 -1.928 2.369 -8.862
560 3HG2 ILE 77 3HG2 ILE 77 -3.374 3.315 -9.211
561 1HD1 ILE 77 1HD1 ILE 77 -2.093 0.447 -6.602
562 2HD1 ILE 77 2HD1 ILE 77 -2.665 1.569 -5.366
563 3HD1 ILE 77 3HD1 ILE 77 -1.854 2.182 -6.808
564 H GLN 78 H GLN 78 -4.945 -1.102 -10.039
565 HA GLN 78 HA GLN 78 -6.926 -2.139 -8.123
566 1HB GLN 78 2HB GLN 78 -7.886 -2.056 -10.371
567 2HB GLN 78 1HB GLN 78 -6.514 -2.944 -11.009
568 1HG GLN 78 2HG GLN 78 -7.177 -4.927 -10.009
569 2HG GLN 78 1HG GLN 78 -8.243 -4.106 -8.868
570 1HE2 GLN 78 1HE2 GLN 78 -9.968 -5.355 -9.422
571 2HE2 GLN 78 2HE2 GLN 78 -10.846 -5.157 -10.901
572 H TYR 79 H TYR 79 -6.455 -4.100 -7.178
573 HA TYR 79 HA TYR 79 -3.706 -4.999 -7.315
574 1HB TYR 79 2HB TYR 79 -6.094 -5.867 -5.676
575 2HB TYR 79 1HB TYR 79 -4.554 -6.708 -5.616
576 HD1 TYR 79 1HD TYR 79 -5.981 -3.273 -5.169
577 HD2 TYR 79 2HD TYR 79 -3.021 -6.108 -4.026
578 HE1 TYR 79 1HE TYR 79 -5.231 -1.763 -3.375
579 HE2 TYR 79 2HE TYR 79 -2.254 -4.604 -2.244
580 HH TYR 79 HH TYR 79 -2.346 -2.430 -1.496
581 H LEU 80 H LEU 80 -3.030 -7.020 -8.008
582 HA LEU 80 HA LEU 80 -4.982 -8.579 -9.555
583 1HB LEU 80 2HB LEU 80 -1.958 -8.580 -9.608
584 2HB LEU 80 1HB LEU 80 -2.962 -9.674 -10.542
585 HG LEU 80 HG LEU 80 -2.904 -6.666 -10.828
586 1HD1 LEU 80 1HD1 LEU 80 -0.881 -7.671 -11.683
587 2HD1 LEU 80 2HD1 LEU 80 -1.903 -7.161 -13.028
588 3HD1 LEU 80 3HD1 LEU 80 -1.817 -8.865 -12.582
589 1HD2 LEU 80 1HD2 LEU 80 -5.107 -7.559 -11.301
590 2HD2 LEU 80 2HD2 LEU 80 -4.408 -8.776 -12.369
591 3HD2 LEU 80 3HD2 LEU 80 -4.314 -7.068 -12.798
592 H GLY 81 H GLY 81 -4.532 -11.028 -9.460
593 1HA GLY 81 2HA GLY 81 -4.078 -12.934 -8.151
594 2HA GLY 81 1HA GLY 81 -3.595 -11.883 -6.825
595 HA PRO 82 HA PRO 82 -7.788 -13.421 -5.678
596 1HB PRO 82 2HB PRO 82 -6.748 -13.209 -2.949
597 2HB PRO 82 1HB PRO 82 -7.411 -14.616 -3.783
598 1HG PRO 82 2HG PRO 82 -4.785 -14.401 -3.173
599 2HG PRO 82 1HG PRO 82 -5.364 -15.260 -4.612
600 1HD PRO 82 2HD PRO 82 -4.200 -12.511 -4.383
601 2HD PRO 82 1HD PRO 82 -3.926 -13.754 -5.624
602 H TYR 83 H TYR 83 -5.974 -10.647 -5.230
603 HA TYR 83 HA TYR 83 -8.016 -9.283 -3.638
604 1HB TYR 83 2HB TYR 83 -5.216 -8.485 -4.454
605 2HB TYR 83 1HB TYR 83 -6.325 -7.410 -3.607
606 HD1 TYR 83 2HD TYR 83 -4.633 -10.716 -3.308
607 HD2 TYR 83 1HD TYR 83 -6.458 -7.460 -1.274
608 HE1 TYR 83 2HE TYR 83 -3.914 -11.663 -1.158
609 HE2 TYR 83 1HE TYR 83 -5.731 -8.394 0.880
610 HH TYR 83 HH TYR 83 -3.569 -11.146 1.059
611 H TYR 84 H TYR 84 -7.950 -10.089 -6.626
612 HA TYR 84 HA TYR 84 -8.156 -7.728 -8.137
613 1HB TYR 84 2HB TYR 84 -9.270 -9.157 -9.809
614 2HB TYR 84 1HB TYR 84 -7.800 -9.881 -9.187
615 HD1 TYR 84 2HD TYR 84 -10.044 -10.417 -6.611
616 HD2 TYR 84 1HD TYR 84 -9.296 -11.679 -10.608
617 HE1 TYR 84 2HE TYR 84 -11.258 -12.505 -6.175
618 HE2 TYR 84 1HE TYR 84 -10.506 -13.773 -10.178
619 HH TYR 84 HH TYR 84 -12.459 -14.243 -7.459
620 HA PRO 85 HA PRO 85 -11.713 -5.675 -9.107
621 1HB PRO 85 2HB PRO 85 -13.460 -7.644 -7.700
622 2HB PRO 85 1HB PRO 85 -13.938 -6.396 -8.862
623 1HG PRO 85 2HG PRO 85 -13.153 -8.980 -9.552
624 2HG PRO 85 1HG PRO 85 -13.124 -7.586 -10.646
625 1HD PRO 85 2HD PRO 85 -10.864 -9.039 -9.790
626 2HD PRO 85 1HD PRO 85 -10.828 -7.416 -10.520
627 H LEU 86 H LEU 86 -10.555 -6.575 -6.041
628 HA LEU 86 HA LEU 86 -11.727 -4.249 -4.767
629 1HB LEU 86 2HB LEU 86 -11.131 -6.213 -3.412
630 2HB LEU 86 1HB LEU 86 -9.458 -6.061 -3.912
631 HG LEU 86 HG LEU 86 -9.314 -3.889 -2.751
632 1HD1 LEU 86 1HD1 LEU 86 -11.088 -3.182 -1.240
633 2HD1 LEU 86 2HD1 LEU 86 -12.100 -4.521 -1.780
634 3HD1 LEU 86 3HD1 LEU 86 -11.668 -3.235 -2.906
635 1HD2 LEU 86 1HD2 LEU 86 -8.638 -5.925 -1.604
636 2HD2 LEU 86 2HD2 LEU 86 -10.289 -6.172 -1.037
637 3HD2 LEU 86 3HD2 LEU 86 -9.362 -4.782 -0.471
638 H LYS 87 H LYS 87 -10.936 -2.227 -5.034
639 HA LYS 87 HA LYS 87 -8.281 -2.006 -6.281
640 1HB LYS 87 2HB LYS 87 -9.126 -0.103 -7.586
641 2HB LYS 87 1HB LYS 87 -10.011 -1.580 -7.933
642 1HG LYS 87 2HG LYS 87 -11.807 -0.811 -6.418
643 2HG LYS 87 1HG LYS 87 -10.931 0.708 -6.210
644 1HD LYS 87 2HD LYS 87 -11.084 1.137 -8.601
645 2HD LYS 87 1HD LYS 87 -11.913 -0.399 -8.833
646 1HE LYS 87 2HE LYS 87 -13.550 1.343 -8.831
647 2HE LYS 87 1HE LYS 87 -13.724 0.420 -7.339
648 1HZ LYS 87 1HZ LYS 87 -12.488 2.151 -6.177
649 2HZ LYS 87 2HZ LYS 87 -13.865 2.790 -6.923
650 3HZ LYS 87 3HZ LYS 87 -12.332 3.039 -7.618
651 H SER 88 H SER 88 -7.412 0.260 -6.149
652 HA SER 88 HA SER 88 -7.990 1.449 -3.535
653 1HB SER 88 2HB SER 88 -5.476 0.282 -4.557
654 2HB SER 88 1HB SER 88 -5.326 1.833 -3.745
655 HG SER 88 HG SER 88 -6.189 0.959 -1.916
656 H THR 89 H THR 89 -7.333 3.652 -3.327
657 HA THR 89 HA THR 89 -7.283 5.031 -5.930
658 HB THR 89 HB THR 89 -8.318 6.178 -3.350
659 HG1 THR 89 1HG THR 89 -9.548 4.293 -4.124
660 1HG2 THR 89 1HG2 THR 89 -7.685 7.798 -5.064
661 2HG2 THR 89 2HG2 THR 89 -9.431 7.785 -4.816
662 3HG2 THR 89 3HG2 THR 89 -8.733 6.986 -6.225
663 H LEU 90 H LEU 90 -5.890 6.650 -6.225
664 HA LEU 90 HA LEU 90 -3.967 7.258 -4.082
665 1HB LEU 90 2HB LEU 90 -3.433 6.910 -7.040
666 2HB LEU 90 1HB LEU 90 -2.270 7.568 -5.905
667 HG LEU 90 HG LEU 90 -3.407 4.773 -5.780
668 1HD1 LEU 90 1HD1 LEU 90 -1.203 4.057 -6.558
669 2HD1 LEU 90 2HD1 LEU 90 -0.715 5.742 -6.744
670 3HD1 LEU 90 3HD1 LEU 90 -2.004 5.079 -7.752
671 1HD2 LEU 90 1HD2 LEU 90 -1.174 6.103 -4.249
672 2HD2 LEU 90 2HD2 LEU 90 -1.606 4.396 -4.159
673 3HD2 LEU 90 3HD2 LEU 90 -2.744 5.623 -3.604
674 H LYS 91 H LYS 91 -3.955 9.345 -3.582
675 HA LYS 91 HA LYS 91 -4.494 11.280 -5.724
676 1HB LYS 91 2HB LYS 91 -5.789 11.167 -3.022
677 2HB LYS 91 1HB LYS 91 -5.569 12.707 -3.837
678 1HG LYS 91 2HG LYS 91 -6.811 11.778 -5.780
679 2HG LYS 91 1HG LYS 91 -7.151 10.347 -4.808
680 1HD LYS 91 2HD LYS 91 -7.870 13.148 -3.966
681 2HD LYS 91 1HD LYS 91 -8.973 12.078 -4.831
682 1HE LYS 91 2HE LYS 91 -7.681 11.419 -2.188
683 2HE LYS 91 1HE LYS 91 -9.296 12.106 -2.360
684 1HZ LYS 91 1HZ LYS 91 -9.971 10.164 -3.614
685 2HZ LYS 91 2HZ LYS 91 -9.346 9.687 -2.107
686 3HZ LYS 91 3HZ LYS 91 -8.413 9.512 -3.503
687 H ARG 92 H ARG 92 -3.600 13.342 -5.378
688 HA ARG 92 HA ARG 92 -1.046 13.349 -4.182
689 1HB ARG 92 2HB ARG 92 -0.972 15.690 -4.756
690 2HB ARG 92 1HB ARG 92 -1.700 14.805 -6.085
691 1HG ARG 92 2HG ARG 92 -3.914 15.475 -5.301
692 2HG ARG 92 1HG ARG 92 -3.164 16.395 -4.000
693 1HD ARG 92 2HD ARG 92 -1.908 17.656 -5.807
694 2HD ARG 92 1HD ARG 92 -3.005 16.894 -6.961
695 HE ARG 92 HE ARG 92 -4.223 18.326 -4.734
696 1HH1 ARG 92 1HH1 ARG 92 -3.383 18.268 -8.135
697 2HH1 ARG 92 2HH1 ARG 92 -4.353 19.654 -8.532
698 1HH2 ARG 92 1HH2 ARG 92 -5.524 20.135 -5.249
699 2HH2 ARG 92 2HH2 ARG 92 -5.562 20.726 -6.888
700 H GLY 93 H GLY 93 -0.345 14.360 -2.258
701 1HA GLY 93 2HA GLY 93 -2.238 14.305 -0.132
702 2HA GLY 93 1HA GLY 93 -0.550 14.784 -0.016
703 H GLU 94 H GLU 94 -1.629 16.323 1.486
704 HA GLU 94 HA GLU 94 -3.057 18.496 0.242
705 1HB GLU 94 2HB GLU 94 -2.162 18.072 3.090
706 2HB GLU 94 1HB GLU 94 -3.245 19.336 2.535
707 1HG GLU 94 2HG GLU 94 -4.961 17.830 2.055
708 2HG GLU 94 1HG GLU 94 -3.867 16.448 2.089
709 H ASN 95 H ASN 95 0.012 17.829 1.729
710 HA ASN 95 HA ASN 95 1.221 20.069 0.328
711 1HB ASN 95 2HB ASN 95 1.411 19.752 3.337
712 2HB ASN 95 1HB ASN 95 2.431 20.824 2.387
713 1HD2 ASN 95 1HD2 ASN 95 -0.667 20.340 3.814
714 2HD2 ASN 95 2HD2 ASN 95 -1.315 21.902 3.454
715 H GLY 96 H GLY 96 2.541 18.792 -0.872
716 1HA GLY 96 2HA GLY 96 4.322 17.439 -1.385
717 2HA GLY 96 1HA GLY 96 4.984 17.967 0.152
718 H THR 97 H THR 97 2.175 15.929 -0.608
719 HA THR 97 HA THR 97 3.443 13.671 0.730
720 HB THR 97 HB THR 97 1.046 13.446 1.896
721 HG1 THR 97 1HG THR 97 1.486 16.255 1.947
722 1HG2 THR 97 1HG2 THR 97 2.024 14.452 3.915
723 2HG2 THR 97 2HG2 THR 97 3.300 15.173 2.932
724 3HG2 THR 97 3HG2 THR 97 3.180 13.418 3.074
725 H LEU 98 H LEU 98 1.850 11.723 0.669
726 HA LEU 98 HA LEU 98 0.237 11.792 -1.790
727 1HB LEU 98 2HB LEU 98 2.390 10.629 -2.204
728 2HB LEU 98 1HB LEU 98 2.012 9.513 -0.905
729 HG LEU 98 HG LEU 98 -0.018 8.802 -2.205
730 1HD1 LEU 98 1HD1 LEU 98 -0.106 9.340 -4.587
731 2HD1 LEU 98 2HD1 LEU 98 1.277 10.418 -4.399
732 3HD1 LEU 98 3HD1 LEU 98 -0.247 10.794 -3.597
733 1HD2 LEU 98 1HD2 LEU 98 1.231 7.422 -3.789
734 2HD2 LEU 98 2HD2 LEU 98 2.024 7.476 -2.215
735 3HD2 LEU 98 3HD2 LEU 98 2.655 8.435 -3.553
736 H ILE 99 H ILE 99 -1.738 10.836 -1.631
737 HA ILE 99 HA ILE 99 -2.387 9.588 0.961
738 HB ILE 99 HB ILE 99 -4.225 11.038 -0.955
739 1HG1 ILE 99 2HG1 ILE 99 -3.211 11.817 1.789
740 2HG1 ILE 99 1HG1 ILE 99 -2.681 12.527 0.268
741 1HG2 ILE 99 1HG2 ILE 99 -5.369 9.223 0.213
742 2HG2 ILE 99 2HG2 ILE 99 -5.921 10.793 0.794
743 3HG2 ILE 99 3HG2 ILE 99 -4.792 9.843 1.760
744 1HD1 ILE 99 1HD1 ILE 99 -4.941 13.379 -0.110
745 2HD1 ILE 99 2HD1 ILE 99 -4.250 13.974 1.401
746 3HD1 ILE 99 3HD1 ILE 99 -5.451 12.683 1.428
747 H TRP 100 H TRP 100 -2.429 7.465 0.767
748 HA TRP 100 HA TRP 100 -3.456 6.250 -1.706
749 1HB TRP 100 2HB TRP 100 -1.176 5.571 -1.070
750 2HB TRP 100 1HB TRP 100 -1.762 5.050 0.502
751 HD1 TRP 100 HD TRP 100 -4.159 3.996 -2.139
752 HE1 TRP 100 1HE TRP 100 -3.846 1.498 -2.678
753 HE3 TRP 100 3HE TRP 100 0.299 3.189 0.230
754 HZ2 TRP 100 2HZ TRP 100 -1.965 -0.533 -2.184
755 HZ3 TRP 100 3HZ TRP 100 1.288 0.937 0.148
756 HH2 TRP 100 HH TRP 100 0.174 -0.883 -1.034
757 H GLU 101 H GLU 101 -5.528 5.723 -1.593
758 HA GLU 101 HA GLU 101 -6.694 5.015 1.001
759 1HB GLU 101 2HB GLU 101 -7.853 5.808 -1.653
760 2HB GLU 101 1HB GLU 101 -8.855 5.141 -0.381
761 1HG GLU 101 2HG GLU 101 -8.526 6.956 1.019
762 2HG GLU 101 1HG GLU 101 -7.069 7.461 0.175
763 H GLN 102 H GLN 102 -7.302 3.074 1.487
764 HA GLN 102 HA GLN 102 -7.547 0.954 -0.484
765 1HB GLN 102 2HB GLN 102 -5.096 1.136 -0.005
766 2HB GLN 102 1HB GLN 102 -5.434 0.823 1.688
767 1HG GLN 102 2HG GLN 102 -6.321 -1.147 -0.370
768 2HG GLN 102 1HG GLN 102 -4.632 -1.089 0.104
769 1HE2 GLN 102 1HE2 GLN 102 -6.508 -3.220 0.455
770 2HE2 GLN 102 2HE2 GLN 102 -6.587 -3.532 2.152
771 H ASN 103 H ASN 103 -9.050 -0.479 0.173
772 HA ASN 103 HA ASN 103 -10.342 -1.807 1.513
773 1HB ASN 103 2HB ASN 103 -7.958 -1.808 2.745
774 2HB ASN 103 1HB ASN 103 -8.906 -1.017 3.996
775 1HD2 ASN 103 1HD2 ASN 103 -7.570 -3.626 3.874
776 2HD2 ASN 103 2HD2 ASN 103 -8.806 -4.788 4.275
777 H GLY 104 H GLY 104 -10.437 1.346 1.434
778 1HA GLY 104 2HA GLY 104 -12.434 2.559 1.945
779 2HA GLY 104 1HA GLY 104 -12.636 1.548 3.369
780 H GLN 105 H GLN 105 -9.505 2.083 3.545
781 HA GLN 105 HA GLN 105 -9.853 4.511 5.168
782 1HB GLN 105 2HB GLN 105 -7.663 2.441 5.386
783 2HB GLN 105 1HB GLN 105 -8.017 3.736 6.520
784 1HG GLN 105 2HG GLN 105 -10.242 2.635 6.910
785 2HG GLN 105 1HG GLN 105 -9.639 1.265 5.981
786 1HE2 GLN 105 1HE2 GLN 105 -9.751 -0.120 7.763
787 2HE2 GLN 105 2HE2 GLN 105 -8.636 -0.011 9.085
788 H ARG 106 H ARG 106 -8.434 6.227 4.921
789 HA ARG 106 HA ARG 106 -6.699 6.100 2.588
790 1HB ARG 106 2HB ARG 106 -6.600 8.623 2.965
791 2HB ARG 106 1HB ARG 106 -8.106 7.951 2.378
792 1HG ARG 106 2HG ARG 106 -9.019 8.066 4.652
793 2HG ARG 106 1HG ARG 106 -7.499 8.775 5.212
794 1HD ARG 106 2HD ARG 106 -7.805 10.680 3.772
795 2HD ARG 106 1HD ARG 106 -9.232 9.948 3.044
796 HE ARG 106 HE ARG 106 -9.562 10.244 5.855
797 1HH1 ARG 106 1HH1 ARG 106 -9.569 12.058 2.845
798 2HH1 ARG 106 2HH1 ARG 106 -10.705 13.249 3.428
799 1HH2 ARG 106 1HH2 ARG 106 -11.009 11.835 6.621
800 2HH2 ARG 106 2HH2 ARG 106 -11.482 13.139 5.582
801 H LYS 107 H LYS 107 -4.588 5.965 2.777
802 HA LYS 107 HA LYS 107 -3.343 6.145 5.399
803 1HB LYS 107 2HB LYS 107 -2.749 4.853 2.869
804 2HB LYS 107 1HB LYS 107 -1.349 5.712 3.493
805 1HG LYS 107 2HG LYS 107 -1.345 3.416 4.247
806 2HG LYS 107 1HG LYS 107 -1.566 4.508 5.613
807 1HD LYS 107 2HD LYS 107 -3.964 4.089 5.558
808 2HD LYS 107 1HD LYS 107 -3.746 2.999 4.188
809 1HE LYS 107 2HE LYS 107 -2.521 2.648 6.911
810 2HE LYS 107 1HE LYS 107 -3.956 1.830 6.324
811 1HZ LYS 107 1HZ LYS 107 -2.402 1.053 4.438
812 2HZ LYS 107 2HZ LYS 107 -2.290 0.293 5.937
813 3HZ LYS 107 3HZ LYS 107 -1.145 1.467 5.501
814 H THR 108 H THR 108 -2.354 7.949 6.091
815 HA THR 108 HA THR 108 -1.607 10.020 4.165
816 HB THR 108 HB THR 108 -1.501 10.079 7.195
817 HG1 THR 108 1HG THR 108 -3.409 11.108 5.339
818 1HG2 THR 108 1HG2 THR 108 -1.237 12.318 5.180
819 2HG2 THR 108 2HG2 THR 108 0.076 11.644 6.143
820 3HG2 THR 108 3HG2 THR 108 -1.247 12.500 6.934
821 H MET 109 H MET 109 0.386 9.915 3.326
822 HA MET 109 HA MET 109 2.418 8.449 4.860
823 1HB MET 109 2HB MET 109 1.971 8.582 1.882
824 2HB MET 109 1HB MET 109 3.391 7.854 2.627
825 1HG MET 109 2HG MET 109 1.930 6.292 3.826
826 2HG MET 109 1HG MET 109 0.538 7.000 3.015
827 1HE MET 109 1HE MET 109 1.504 3.881 3.107
828 2HE MET 109 2HE MET 109 1.051 3.398 1.471
829 3HE MET 109 3HE MET 109 -0.025 4.428 2.416
830 H THR 110 H THR 110 4.437 9.159 4.997
831 HA THR 110 HA THR 110 4.903 11.971 4.374
832 HB THR 110 HB THR 110 6.903 10.365 5.871
833 HG1 THR 110 1HG THR 110 5.415 9.620 7.209
834 1HG2 THR 110 1HG2 THR 110 7.208 12.760 5.560
835 2HG2 THR 110 2HG2 THR 110 6.958 12.396 7.267
836 3HG2 THR 110 3HG2 THR 110 5.642 13.074 6.307
837 H ARG 111 H ARG 111 6.821 12.640 3.333
838 HA ARG 111 HA ARG 111 7.748 10.792 1.299
839 1HB ARG 111 2HB ARG 111 7.086 13.095 0.707
840 2HB ARG 111 1HB ARG 111 8.343 13.728 1.753
841 1HG ARG 111 2HG ARG 111 10.058 12.873 0.323
842 2HG ARG 111 1HG ARG 111 8.869 12.011 -0.662
843 1HD ARG 111 2HD ARG 111 7.896 14.098 -1.387
844 2HD ARG 111 1HD ARG 111 8.941 15.007 -0.300
845 HE ARG 111 HE ARG 111 10.797 13.921 -1.763
846 1HH1 ARG 111 1HH1 ARG 111 7.686 15.108 -2.882
847 2HH1 ARG 111 2HH1 ARG 111 8.272 15.525 -4.465
848 1HH2 ARG 111 1HH2 ARG 111 11.570 14.508 -3.808
849 2HH2 ARG 111 2HH2 ARG 111 10.497 15.208 -4.983
850 H ILE 112 H ILE 112 9.613 9.717 1.405
851 HA ILE 112 HA ILE 112 11.118 9.770 3.829
852 HB ILE 112 HB ILE 112 11.681 8.259 1.285
853 1HG1 ILE 112 2HG1 ILE 112 9.438 7.806 2.235
854 2HG1 ILE 112 1HG1 ILE 112 10.494 6.404 2.314
855 1HG2 ILE 112 1HG2 ILE 112 13.627 8.364 2.728
856 2HG2 ILE 112 2HG2 ILE 112 12.959 6.731 2.698
857 3HG2 ILE 112 3HG2 ILE 112 12.665 7.780 4.084
858 1HD1 ILE 112 1HD1 ILE 112 10.926 6.868 4.675
859 2HD1 ILE 112 2HD1 ILE 112 9.206 6.647 4.352
860 3HD1 ILE 112 3HD1 ILE 112 9.859 8.269 4.586
861 H GLU 113 H GLU 113 13.242 10.220 4.139
862 HA GLU 113 HA GLU 113 14.602 11.865 2.112
863 1HB GLU 113 2HB GLU 113 13.622 13.317 3.843
864 2HB GLU 113 1HB GLU 113 14.445 12.392 5.088
865 1HG GLU 113 2HG GLU 113 16.606 13.080 4.108
866 2HG GLU 113 1HG GLU 113 15.722 14.088 2.963
867 H SER 114 H SER 114 16.773 11.503 1.903
868 HA SER 114 HA SER 114 18.744 10.386 1.987
869 1HB SER 114 2HB SER 114 18.029 10.217 4.924
870 2HB SER 114 1HB SER 114 19.599 9.763 4.258
871 HG SER 114 HG SER 114 18.641 12.223 4.865
872 H LYS 115 H LYS 115 16.578 8.916 1.117
873 HA LYS 115 HA LYS 115 16.364 6.394 2.408
874 1HB LYS 115 2HB LYS 115 15.322 5.680 0.214
875 2HB LYS 115 1HB LYS 115 14.547 7.027 1.031
876 1HG LYS 115 2HG LYS 115 15.704 8.585 -0.488
877 2HG LYS 115 1HG LYS 115 16.409 7.205 -1.332
878 1HD LYS 115 2HD LYS 115 14.252 6.441 -2.033
879 2HD LYS 115 1HD LYS 115 13.443 7.627 -1.009
880 1HE LYS 115 2HE LYS 115 13.401 8.339 -3.330
881 2HE LYS 115 1HE LYS 115 14.384 9.436 -2.366
882 1HZ LYS 115 1HZ LYS 115 15.375 8.860 -4.530
883 2HZ LYS 115 2HZ LYS 115 15.484 7.239 -4.039
884 3HZ LYS 115 3HZ LYS 115 16.367 8.436 -3.224
885 H THR 116 H THR 116 17.561 4.613 2.241
886 HA THR 116 HA THR 116 20.149 4.776 1.117
887 HB THR 116 HB THR 116 18.783 2.231 1.987
888 HG1 THR 116 1HG THR 116 18.565 3.265 3.841
889 1HG2 THR 116 1HG2 THR 116 21.043 1.566 2.630
890 2HG2 THR 116 2HG2 THR 116 21.665 3.127 2.096
891 3HG2 THR 116 3HG2 THR 116 20.988 1.998 0.921
892 H GLY 117 H GLY 117 20.894 4.221 -0.831
893 1HA GLY 117 2HA GLY 117 19.180 2.540 -2.557
894 2HA GLY 117 1HA GLY 117 19.973 3.985 -3.172
895 H ARG 118 H ARG 118 20.290 1.232 -4.088
896 HA ARG 118 HA ARG 118 22.903 0.429 -3.148
897 1HB ARG 118 2HB ARG 118 22.618 -1.465 -4.722
898 2HB ARG 118 1HB ARG 118 21.303 -1.332 -3.569
899 1HG ARG 118 2HG ARG 118 19.776 -0.974 -5.165
900 2HG ARG 118 1HG ARG 118 20.845 0.089 -6.085
901 1HD ARG 118 2HD ARG 118 22.106 -2.149 -6.608
902 2HD ARG 118 1HD ARG 118 20.556 -2.879 -6.195
903 HE ARG 118 HE ARG 118 19.768 -1.053 -7.945
904 1HH1 ARG 118 1HH1 ARG 118 22.480 -3.270 -8.094
905 2HH1 ARG 118 2HH1 ARG 118 22.500 -3.322 -9.827
906 1HH2 ARG 118 1HH2 ARG 118 19.800 -1.111 -10.206
907 2HH2 ARG 118 2HH2 ARG 118 20.952 -2.113 -11.032
908 H GLU 119 H GLU 119 24.156 2.212 -3.823
909 HA GLU 119 HA GLU 119 25.690 3.202 -5.192
910 1HB GLU 119 2HB GLU 119 25.728 0.629 -5.925
911 2HB GLU 119 1HB GLU 119 25.115 1.307 -7.423
912 1HG GLU 119 2HG GLU 119 27.086 2.710 -7.621
913 2HG GLU 119 1HG GLU 119 27.692 2.099 -6.083
914 H GLU 120 H GLU 120 25.776 3.820 -7.836
915 HA GLU 120 HA GLU 120 24.907 5.011 -9.553
916 1HB GLU 120 2HB GLU 120 22.201 4.100 -8.575
917 2HB GLU 120 1HB GLU 120 22.551 4.818 -10.139
918 1HG GLU 120 2HG GLU 120 23.927 2.895 -10.724
919 2HG GLU 120 1HG GLU 120 23.602 2.179 -9.144
920 H LYS 121 H LYS 121 25.413 7.034 -9.073
921 HA LYS 121 HA LYS 121 23.368 8.837 -8.250
922 1HB LYS 121 2HB LYS 121 24.548 9.753 -6.274
923 2HB LYS 121 1HB LYS 121 23.984 8.108 -6.025
924 1HG LYS 121 2HG LYS 121 26.243 7.267 -6.427
925 2HG LYS 121 1HG LYS 121 26.809 8.918 -6.693
926 1HD LYS 121 2HD LYS 121 27.327 8.159 -4.431
927 2HD LYS 121 1HD LYS 121 26.181 9.502 -4.402
928 1HE LYS 121 2HE LYS 121 24.339 7.878 -4.140
929 2HE LYS 121 1HE LYS 121 25.524 6.574 -4.093
930 1HZ LYS 121 1HZ LYS 121 26.394 7.362 -2.066
931 2HZ LYS 121 2HZ LYS 121 24.708 7.409 -1.883
932 3HZ LYS 121 3HZ LYS 121 25.570 8.838 -2.183
933 H ASP 122 H ASP 122 24.320 11.132 -8.085
934 HA ASP 122 HA ASP 122 25.981 11.551 -10.370
935 1HB ASP 122 2HB ASP 122 25.720 13.896 -9.966
936 2HB ASP 122 1HB ASP 122 24.170 13.135 -9.636
937 H GLU 123 H GLU 123 28.075 12.344 -10.457
938 HA GLU 123 HA GLU 123 29.789 11.321 -8.438
939 1HB GLU 123 2HB GLU 123 30.409 13.031 -10.845
940 2HB GLU 123 1HB GLU 123 31.613 12.240 -9.837
941 1HG GLU 123 2HG GLU 123 30.627 10.059 -10.434
942 2HG GLU 123 1HG GLU 123 29.511 10.894 -11.514
943 H LYS 124 H LYS 124 29.519 14.624 -9.715
944 HA LYS 124 HA LYS 124 29.651 15.754 -7.086
945 1HB LYS 124 2HB LYS 124 31.749 17.071 -7.587
946 2HB LYS 124 1HB LYS 124 31.981 15.358 -7.273
947 1HG LYS 124 2HG LYS 124 32.031 15.004 -9.756
948 2HG LYS 124 1HG LYS 124 32.053 16.757 -9.935
949 1HD LYS 124 2HD LYS 124 34.302 16.197 -10.041
950 2HD LYS 124 1HD LYS 124 34.098 16.656 -8.353
951 1HE LYS 124 2HE LYS 124 33.982 13.812 -9.349
952 2HE LYS 124 1HE LYS 124 35.447 14.575 -8.739
953 1HZ LYS 124 1HZ LYS 124 34.470 13.332 -6.985
954 2HZ LYS 124 2HZ LYS 124 32.949 14.030 -7.230
955 3HZ LYS 124 3HZ LYS 124 34.222 14.972 -6.629
956 H SER 125 H SER 125 27.819 16.841 -7.530
957 HA SER 125 HA SER 125 27.604 18.462 -9.937
958 1HB SER 125 2HB SER 125 25.666 18.115 -7.634
959 2HB SER 125 1HB SER 125 25.312 18.882 -9.181
960 HG SER 125 HG SER 125 25.851 16.147 -8.636
961 H LYS 126 H LYS 126 29.670 19.478 -8.676
962 HA LYS 126 HA LYS 126 28.740 22.020 -7.623
963 1HB LYS 126 2HB LYS 126 30.093 21.899 -5.596
964 2HB LYS 126 1HB LYS 126 28.910 20.595 -5.612
965 1HG LYS 126 2HG LYS 126 30.642 19.038 -6.364
966 2HG LYS 126 1HG LYS 126 31.826 20.345 -6.334
967 1HD LYS 126 2HD LYS 126 31.385 20.626 -3.910
968 2HD LYS 126 1HD LYS 126 30.312 19.227 -3.976
969 1HE LYS 126 2HE LYS 126 32.178 17.832 -4.729
970 2HE LYS 126 1HE LYS 126 33.250 19.229 -4.664
971 1HZ LYS 126 1HZ LYS 126 31.885 17.908 -2.388
972 2HZ LYS 126 2HZ LYS 126 32.713 19.380 -2.255
973 3HZ LYS 126 3HZ LYS 126 33.552 17.971 -2.688
974 H SER 127 H SER 127 30.479 23.591 -7.437
975 HA SER 127 HA SER 127 33.089 22.876 -8.454
976 1HB SER 127 2HB SER 127 31.694 23.416 -10.498
977 2HB SER 127 1HB SER 127 31.515 25.051 -9.862
978 HG SER 127 HG SER 127 33.263 25.201 -11.142
979 H LEU 128 H LEU 128 34.397 23.761 -7.006
980 HA LEU 128 HA LEU 128 33.448 25.970 -5.384
981 1HB LEU 128 2HB LEU 128 35.910 24.242 -5.241
982 2HB LEU 128 1HB LEU 128 35.650 25.608 -4.177
983 HG LEU 128 HG LEU 128 33.511 24.469 -3.424
984 1HD1 LEU 128 1HD1 LEU 128 33.351 22.058 -3.762
985 2HD1 LEU 128 2HD1 LEU 128 34.743 22.112 -4.843
986 3HD1 LEU 128 3HD1 LEU 128 33.245 22.928 -5.292
987 1HD2 LEU 128 1HD2 LEU 128 35.520 24.491 -2.061
988 2HD2 LEU 128 2HD2 LEU 128 36.128 23.070 -2.910
989 3HD2 LEU 128 3HD2 LEU 128 34.681 22.949 -1.909
990 H GLU 129 H GLU 129 33.544 27.837 -6.464
991 HA GLU 129 HA GLU 129 36.168 28.882 -7.123
992 1HB GLU 129 2HB GLU 129 35.535 27.912 -9.238
993 2HB GLU 129 1HB GLU 129 33.941 28.646 -9.152
994 1HG GLU 129 2HG GLU 129 34.865 30.833 -9.454
995 2HG GLU 129 1HG GLU 129 36.508 30.199 -9.342
996 H HIS 130 H HIS 130 36.335 30.987 -6.606
997 HA HIS 130 HA HIS 130 33.871 32.360 -5.825
998 1HB HIS 130 2HB HIS 130 35.330 33.998 -4.679
999 2HB HIS 130 1HB HIS 130 35.566 32.359 -4.097
1000 HD1 HIS 130 1HD HIS 130 37.927 31.974 -3.577
1001 HD2 HIS 130 2HD HIS 130 37.494 34.488 -6.859
1002 HE1 HIS 130 1HE HIS 130 40.263 32.543 -4.311
1003 HE2 HIS 130 2HE HIS 130 39.965 34.240 -6.145
1004 H HIS 131 H HIS 131 33.251 34.312 -6.639
1005 HA HIS 131 HA HIS 131 34.858 35.585 -8.696
1006 1HB HIS 131 2HB HIS 131 32.825 35.661 -10.245
1007 2HB HIS 131 1HB HIS 131 33.702 34.142 -10.154
1008 HD1 HIS 131 1HD HIS 131 30.346 35.584 -9.747
1009 HD2 HIS 131 2HD HIS 131 32.324 32.105 -8.612
1010 HE1 HIS 131 1HE HIS 131 28.542 33.965 -9.089
1011 HE2 HIS 131 2HE HIS 131 29.749 31.823 -8.548
1012 H HIS 132 H HIS 132 34.893 37.628 -8.207
1013 HA HIS 132 HA HIS 132 32.541 38.812 -6.869
1014 1HB HIS 132 2HB HIS 132 34.050 40.267 -5.610
1015 2HB HIS 132 1HB HIS 132 34.453 38.581 -5.325
1016 HD1 HIS 132 1HD HIS 132 36.050 41.700 -5.929
1017 HD2 HIS 132 2HD HIS 132 36.714 37.786 -7.174
1018 HE1 HIS 132 1HE HIS 132 38.429 41.635 -6.734
1019 HE2 HIS 132 2HE HIS 132 38.715 39.329 -7.713
1020 H HIS 133 H HIS 133 32.054 40.996 -7.344
1021 HA HIS 133 HA HIS 133 33.324 42.025 -9.801
1022 1HB HIS 133 2HB HIS 133 30.365 42.182 -9.202
1023 2HB HIS 133 1HB HIS 133 31.179 42.701 -10.672
1024 HD1 HIS 133 1HD HIS 133 32.071 40.765 -12.261
1025 HD2 HIS 133 2HD HIS 133 29.613 39.545 -9.131
1026 HE1 HIS 133 1HE HIS 133 31.341 38.426 -12.839
1027 HE2 HIS 133 2HE HIS 133 29.693 37.797 -11.033
1028 H HIS 134 H HIS 134 33.548 44.234 -9.927
1029 HA HIS 134 HA HIS 134 33.579 46.423 -9.323
1030 1HB HIS 134 2HB HIS 134 31.127 46.184 -9.163
1031 2HB HIS 134 1HB HIS 134 31.285 45.639 -7.501
1032 HD1 HIS 134 1HD HIS 134 31.496 47.399 -5.701
1033 HD2 HIS 134 2HD HIS 134 31.615 48.978 -9.547
1034 HE1 HIS 134 1HE HIS 134 31.309 49.891 -5.417
1035 HE2 HIS 134 2HE HIS 134 31.649 50.826 -7.733
1036 H HIS 135 H HIS 135 34.391 47.829 -7.660
1037 HA HIS 135 HA HIS 135 36.060 46.700 -5.707
1038 1HB HIS 135 2HB HIS 135 36.492 48.921 -6.503
1039 2HB HIS 135 1HB HIS 135 34.896 49.474 -6.017
1040 HD1 HIS 135 1HD HIS 135 34.731 50.564 -3.798
1041 HD2 HIS 135 2HD HIS 135 38.233 48.348 -4.193
1042 HE1 HIS 135 1HE HIS 135 36.098 51.084 -1.749
1043 HE2 HIS 135 2HE HIS 135 38.287 49.890 -2.103
Start of MODEL 14
1 1H MET 1 1HT MET 1 -20.577 45.569 -6.070
2 2H MET 1 2HT MET 1 -20.133 44.157 -5.236
3 3H MET 1 3HT MET 1 -21.270 44.082 -6.489
4 HA MET 1 HA MET 1 -19.641 44.642 -8.117
5 1HB MET 1 2HB MET 1 -17.302 44.953 -7.521
6 2HB MET 1 1HB MET 1 -18.293 46.137 -6.682
7 1HG MET 1 2HG MET 1 -18.155 44.854 -4.638
8 2HG MET 1 1HG MET 1 -17.241 43.593 -5.466
9 1HE MET 1 1HE MET 1 -15.343 43.704 -3.620
10 2HE MET 1 2HE MET 1 -16.250 44.949 -2.761
11 3HE MET 1 3HE MET 1 -14.542 45.196 -3.123
12 H ILE 2 H ILE 2 -17.923 43.069 -8.897
13 HA ILE 2 HA ILE 2 -18.523 40.438 -7.751
14 HB ILE 2 HB ILE 2 -17.556 39.483 -9.808
15 1HG1 ILE 2 2HG1 ILE 2 -17.439 41.301 -11.744
16 2HG1 ILE 2 1HG1 ILE 2 -16.998 42.357 -10.405
17 1HG2 ILE 2 1HG2 ILE 2 -19.938 39.864 -9.668
18 2HG2 ILE 2 2HG2 ILE 2 -19.380 40.150 -11.315
19 3HG2 ILE 2 3HG2 ILE 2 -19.739 41.513 -10.255
20 1HD1 ILE 2 1HD1 ILE 2 -15.574 39.829 -11.227
21 2HD1 ILE 2 2HD1 ILE 2 -15.131 40.872 -9.874
22 3HD1 ILE 2 3HD1 ILE 2 -15.037 41.484 -11.523
23 H MET 3 H MET 3 -16.823 38.912 -7.404
24 HA MET 3 HA MET 3 -14.183 40.120 -6.936
25 1HB MET 3 2HB MET 3 -15.491 39.980 -4.805
26 2HB MET 3 1HB MET 3 -15.596 38.240 -5.032
27 1HG MET 3 2HG MET 3 -13.159 38.080 -4.895
28 2HG MET 3 1HG MET 3 -13.065 39.825 -4.671
29 1HE MET 3 1HE MET 3 -11.705 37.777 -2.662
30 2HE MET 3 2HE MET 3 -12.143 38.510 -1.117
31 3HE MET 3 3HE MET 3 -11.655 39.529 -2.469
32 H VAL 4 H VAL 4 -12.533 38.918 -7.677
33 HA VAL 4 HA VAL 4 -13.085 36.122 -8.382
34 HB VAL 4 HB VAL 4 -13.398 37.316 -10.433
35 1HG1 VAL 4 1HG1 VAL 4 -12.262 39.386 -9.891
36 2HG1 VAL 4 2HG1 VAL 4 -11.662 38.739 -11.420
37 3HG1 VAL 4 3HG1 VAL 4 -10.702 38.566 -9.952
38 1HG2 VAL 4 1HG2 VAL 4 -11.652 36.335 -11.844
39 2HG2 VAL 4 2HG2 VAL 4 -12.218 35.200 -10.619
40 3HG2 VAL 4 3HG2 VAL 4 -10.676 36.025 -10.406
41 H SER 5 H SER 5 -11.559 34.749 -7.776
42 HA SER 5 HA SER 5 -8.808 35.668 -7.434
43 1HB SER 5 2HB SER 5 -9.874 35.963 -5.225
44 2HB SER 5 1HB SER 5 -10.366 34.270 -5.242
45 HG SER 5 HG SER 5 -8.359 33.656 -4.833
46 H GLY 6 H GLY 6 -7.568 34.279 -8.506
47 1HA GLY 6 2HA GLY 6 -8.047 31.414 -8.217
48 2HA GLY 6 1HA GLY 6 -8.091 32.067 -9.849
49 H CYS 7 H CYS 7 -6.164 30.604 -7.623
50 HA CYS 7 HA CYS 7 -3.709 31.984 -8.005
51 1HB CYS 7 2HB CYS 7 -4.204 30.486 -6.074
52 2HB CYS 7 1HB CYS 7 -4.157 29.108 -7.169
53 HG CYS 7 HG CYS 7 -1.779 29.842 -5.411
54 H GLN 8 H GLN 8 -1.876 31.278 -9.219
55 HA GLN 8 HA GLN 8 -2.605 30.234 -11.812
56 1HB GLN 8 2HB GLN 8 0.052 31.198 -10.740
57 2HB GLN 8 1HB GLN 8 -0.254 30.750 -12.409
58 1HG GLN 8 2HG GLN 8 -1.879 32.559 -12.599
59 2HG GLN 8 1HG GLN 8 -1.573 33.007 -10.921
60 1HE2 GLN 8 1HE2 GLN 8 -1.211 34.544 -13.380
61 2HE2 GLN 8 2HE2 GLN 8 0.451 35.017 -13.410
62 H GLN 9 H GLN 9 -2.887 28.082 -11.858
63 HA GLN 9 HA GLN 9 -1.215 26.297 -10.357
64 1HB GLN 9 2HB GLN 9 -3.569 25.736 -10.842
65 2HB GLN 9 1HB GLN 9 -3.203 25.695 -12.561
66 1HG GLN 9 2HG GLN 9 -3.304 23.451 -11.683
67 2HG GLN 9 1HG GLN 9 -1.655 23.831 -12.181
68 1HE2 GLN 9 1HE2 GLN 9 -0.044 24.014 -10.610
69 2HE2 GLN 9 2HE2 GLN 9 -0.281 23.500 -8.973
70 H GLN 10 H GLN 10 0.881 26.540 -11.008
71 HA GLN 10 HA GLN 10 1.613 26.348 -13.785
72 1HB GLN 10 2HB GLN 10 2.965 27.691 -12.235
73 2HB GLN 10 1HB GLN 10 3.302 26.258 -11.275
74 1HG GLN 10 2HG GLN 10 4.538 25.280 -13.098
75 2HG GLN 10 1HG GLN 10 4.144 26.651 -14.137
76 1HE2 GLN 10 1HE2 GLN 10 5.166 28.626 -13.793
77 2HE2 GLN 10 2HE2 GLN 10 6.588 28.760 -12.808
78 H LYS 11 H LYS 11 2.021 24.539 -14.888
79 HA LYS 11 HA LYS 11 1.657 22.019 -13.505
80 1HB LYS 11 2HB LYS 11 1.804 21.075 -15.871
81 2HB LYS 11 1HB LYS 11 0.428 22.100 -15.494
82 1HG LYS 11 2HG LYS 11 1.584 23.989 -16.590
83 2HG LYS 11 1HG LYS 11 2.893 22.889 -17.035
84 1HD LYS 11 2HD LYS 11 1.361 21.539 -18.334
85 2HD LYS 11 1HD LYS 11 0.001 22.541 -17.822
86 1HE LYS 11 2HE LYS 11 1.017 24.470 -18.956
87 2HE LYS 11 1HE LYS 11 2.353 23.446 -19.487
88 1HZ LYS 11 1HZ LYS 11 -0.507 23.079 -20.207
89 2HZ LYS 11 2HZ LYS 11 0.774 22.091 -20.719
90 3HZ LYS 11 3HZ LYS 11 0.695 23.708 -21.226
91 H GLU 12 H GLU 12 3.270 21.045 -12.604
92 HA GLU 12 HA GLU 12 5.981 21.418 -13.625
93 1HB GLU 12 2HB GLU 12 4.885 21.299 -11.042
94 2HB GLU 12 1HB GLU 12 5.791 19.805 -11.233
95 1HG GLU 12 2HG GLU 12 6.865 22.586 -11.648
96 2HG GLU 12 1HG GLU 12 7.155 21.562 -10.243
97 H GLU 13 H GLU 13 6.945 18.954 -12.410
98 HA GLU 13 HA GLU 13 5.691 16.879 -14.039
99 1HB GLU 13 2HB GLU 13 7.715 18.274 -15.131
100 2HB GLU 13 1HB GLU 13 8.649 17.089 -14.231
101 1HG GLU 13 2HG GLU 13 7.476 15.286 -15.387
102 2HG GLU 13 1HG GLU 13 6.538 16.480 -16.287
103 H THR 14 H THR 14 7.967 15.123 -13.696
104 HA THR 14 HA THR 14 8.879 13.626 -12.301
105 HB THR 14 HB THR 14 8.340 15.841 -10.390
106 HG1 THR 14 1HG THR 14 10.074 16.392 -11.524
107 1HG2 THR 14 1HG2 THR 14 9.798 13.271 -9.756
108 2HG2 THR 14 2HG2 THR 14 8.229 13.738 -9.105
109 3HG2 THR 14 3HG2 THR 14 9.668 14.671 -8.692
110 HA PRO 15 HA PRO 15 5.166 11.353 -11.266
111 1HB PRO 15 2HB PRO 15 7.112 9.294 -10.449
112 2HB PRO 15 1HB PRO 15 5.819 9.201 -11.649
113 1HG PRO 15 2HG PRO 15 8.394 9.302 -12.377
114 2HG PRO 15 1HG PRO 15 7.128 10.099 -13.327
115 1HD PRO 15 2HD PRO 15 9.088 11.291 -11.404
116 2HD PRO 15 1HD PRO 15 8.515 11.918 -12.964
117 H PHE 16 H PHE 16 4.312 12.203 -9.465
118 HA PHE 16 HA PHE 16 5.739 12.583 -7.054
119 1HB PHE 16 2HB PHE 16 3.647 13.400 -6.141
120 2HB PHE 16 1HB PHE 16 3.853 14.012 -7.776
121 HD1 PHE 16 2HD PHE 16 2.534 12.959 -9.645
122 HD2 PHE 16 1HD PHE 16 1.777 12.103 -5.544
123 HE1 PHE 16 2HE PHE 16 0.314 12.078 -10.241
124 HE2 PHE 16 1HE PHE 16 -0.442 11.222 -6.135
125 HZ PHE 16 HZ PHE 16 -1.177 11.202 -8.480
126 H TYR 17 H TYR 17 4.221 9.813 -8.278
127 HA TYR 17 HA TYR 17 3.612 8.781 -5.617
128 1HB TYR 17 2HB TYR 17 2.315 7.070 -6.785
129 2HB TYR 17 1HB TYR 17 1.799 8.684 -7.235
130 HD1 TYR 17 1HD TYR 17 2.700 9.617 -9.474
131 HD2 TYR 17 2HD TYR 17 2.859 5.495 -8.418
132 HE1 TYR 17 1HE TYR 17 2.930 9.024 -11.850
133 HE2 TYR 17 2HE TYR 17 3.099 4.893 -10.790
134 HH TYR 17 HH TYR 17 3.879 7.073 -13.186
135 H TYR 18 H TYR 18 6.285 8.847 -7.377
136 HA TYR 18 HA TYR 18 6.862 5.978 -7.173
137 1HB TYR 18 2HB TYR 18 7.357 7.049 -9.331
138 2HB TYR 18 1HB TYR 18 8.465 8.155 -8.528
139 HD1 TYR 18 1HD TYR 18 7.870 4.492 -8.945
140 HD2 TYR 18 2HD TYR 18 10.721 7.617 -8.498
141 HE1 TYR 18 1HE TYR 18 9.687 2.870 -9.261
142 HE2 TYR 18 2HE TYR 18 12.550 6.000 -8.811
143 HH TYR 18 HH TYR 18 11.982 2.770 -9.892
144 H GLY 19 H GLY 19 8.038 5.197 -5.607
145 1HA GLY 19 2HA GLY 19 10.320 5.690 -4.488
146 2HA GLY 19 1HA GLY 19 9.436 7.053 -3.817
147 H THR 20 H THR 20 10.230 5.895 -1.832
148 HA THR 20 HA THR 20 8.422 3.719 -1.030
149 HB THR 20 HB THR 20 10.858 4.807 0.403
150 HG1 THR 20 1HG THR 20 10.576 2.419 -1.142
151 1HG2 THR 20 1HG2 THR 20 9.279 3.698 1.904
152 2HG2 THR 20 2HG2 THR 20 10.724 2.710 1.690
153 3HG2 THR 20 3HG2 THR 20 9.238 2.293 0.839
154 H TRP 21 H TRP 21 6.836 4.057 0.439
155 HA TRP 21 HA TRP 21 6.654 6.759 1.612
156 1HB TRP 21 2HB TRP 21 4.387 4.912 0.836
157 2HB TRP 21 1HB TRP 21 4.235 6.560 1.438
158 HD1 TRP 21 HD TRP 21 5.138 4.585 -1.701
159 HE1 TRP 21 1HE TRP 21 5.161 6.188 -3.715
160 HE3 TRP 21 3HE TRP 21 4.597 9.012 0.794
161 HZ2 TRP 21 2HZ TRP 21 4.974 8.968 -4.176
162 HZ3 TRP 21 3HZ TRP 21 4.525 11.098 -0.509
163 HH2 TRP 21 HH TRP 21 4.710 11.073 -2.940
164 H ASP 22 H ASP 22 6.270 6.948 3.763
165 HA ASP 22 HA ASP 22 6.247 4.469 5.324
166 1HB ASP 22 2HB ASP 22 8.019 5.811 6.044
167 2HB ASP 22 1HB ASP 22 7.070 7.290 5.944
168 H GLU 23 H GLU 23 4.509 3.772 6.303
169 HA GLU 23 HA GLU 23 2.308 5.622 6.879
170 1HB GLU 23 2HB GLU 23 2.393 2.599 6.965
171 2HB GLU 23 1HB GLU 23 0.980 3.579 7.318
172 1HG GLU 23 2HG GLU 23 0.963 4.395 5.028
173 2HG GLU 23 1HG GLU 23 2.396 3.432 4.672
174 H GLY 24 H GLY 24 3.622 6.555 8.586
175 1HA GLY 24 2HA GLY 24 4.460 5.036 10.834
176 2HA GLY 24 1HA GLY 24 4.312 6.783 10.765
177 H ARG 25 H ARG 25 1.378 5.616 9.883
178 HA ARG 25 HA ARG 25 0.394 5.669 12.644
179 1HB ARG 25 2HB ARG 25 -0.247 7.595 11.111
180 2HB ARG 25 1HB ARG 25 -1.188 6.434 10.190
181 1HG ARG 25 2HG ARG 25 -2.608 7.650 11.725
182 2HG ARG 25 1HG ARG 25 -2.518 5.951 12.195
183 1HD ARG 25 2HD ARG 25 -2.347 7.471 14.131
184 2HD ARG 25 1HD ARG 25 -0.906 6.473 13.925
185 HE ARG 25 HE ARG 25 -1.001 9.251 12.938
186 1HH1 ARG 25 1HH1 ARG 25 0.478 6.759 14.904
187 2HH1 ARG 25 2HH1 ARG 25 1.913 7.684 15.233
188 1HH2 ARG 25 1HH2 ARG 25 0.863 10.486 13.387
189 2HH2 ARG 25 2HH2 ARG 25 2.121 9.822 14.390
190 H ALA 26 H ALA 26 -1.133 4.196 13.197
191 HA ALA 26 HA ALA 26 -2.249 2.215 13.265
192 1HB ALA 26 1HB ALA 26 -3.000 1.127 11.215
193 2HB ALA 26 2HB ALA 26 -1.976 2.200 10.262
194 3HB ALA 26 3HB ALA 26 -3.332 2.859 11.173
195 HA PRO 27 HA PRO 27 1.121 -0.651 13.279
196 1HB PRO 27 2HB PRO 27 -0.107 -2.783 14.322
197 2HB PRO 27 1HB PRO 27 0.147 -1.312 15.270
198 1HG PRO 27 2HG PRO 27 -2.333 -2.303 13.936
199 2HG PRO 27 1HG PRO 27 -2.146 -1.475 15.492
200 1HD PRO 27 2HD PRO 27 -2.916 -0.271 13.102
201 2HD PRO 27 1HD PRO 27 -2.290 0.576 14.529
202 H GLY 28 H GLY 28 1.659 -2.905 12.577
203 1HA GLY 28 2HA GLY 28 0.433 -3.417 9.948
204 2HA GLY 28 1HA GLY 28 2.049 -3.903 10.430
205 HA PRO 29 HA PRO 29 -0.331 -7.916 10.379
206 1HB PRO 29 2HB PRO 29 2.592 -8.446 10.793
207 2HB PRO 29 1HB PRO 29 1.405 -9.373 9.867
208 1HG PRO 29 2HG PRO 29 3.106 -7.683 8.672
209 2HG PRO 29 1HG PRO 29 1.449 -7.913 8.090
210 1HD PRO 29 2HD PRO 29 2.648 -5.580 9.430
211 2HD PRO 29 1HD PRO 29 1.179 -5.685 8.446
212 H THR 30 H THR 30 -0.801 -9.286 12.028
213 HA THR 30 HA THR 30 -0.781 -8.108 14.586
214 HB THR 30 HB THR 30 -2.571 -9.568 13.562
215 HG1 THR 30 1HG THR 30 -1.736 -10.287 16.201
216 1HG2 THR 30 1HG2 THR 30 -0.796 -11.790 14.569
217 2HG2 THR 30 2HG2 THR 30 -1.143 -11.432 12.877
218 3HG2 THR 30 3HG2 THR 30 -2.438 -11.972 13.945
219 H ASP 31 H ASP 31 1.600 -9.934 13.117
220 HA ASP 31 HA ASP 31 2.595 -11.447 15.270
221 1HB ASP 31 2HB ASP 31 3.421 -11.756 12.978
222 2HB ASP 31 1HB ASP 31 4.140 -10.149 13.013
223 H GLY 32 H GLY 32 2.970 -8.085 14.373
224 1HA GLY 32 2HA GLY 32 3.146 -6.737 16.556
225 2HA GLY 32 1HA GLY 32 4.634 -7.645 16.759
226 H VAL 33 H VAL 33 3.124 -5.948 14.013
227 HA VAL 33 HA VAL 33 5.713 -4.651 13.513
228 HB VAL 33 HB VAL 33 3.297 -4.646 11.704
229 1HG1 VAL 33 1HG1 VAL 33 4.885 -4.081 9.963
230 2HG1 VAL 33 2HG1 VAL 33 6.202 -4.116 11.135
231 3HG1 VAL 33 3HG1 VAL 33 4.933 -2.897 11.268
232 1HG2 VAL 33 1HG2 VAL 33 3.963 -6.953 12.067
233 2HG2 VAL 33 2HG2 VAL 33 5.637 -6.549 11.687
234 3HG2 VAL 33 3HG2 VAL 33 4.399 -6.441 10.436
235 H LYS 34 H LYS 34 5.954 -2.469 13.702
236 HA LYS 34 HA LYS 34 3.909 -1.063 15.138
237 1HB LYS 34 2HB LYS 34 6.672 -0.346 14.223
238 2HB LYS 34 1HB LYS 34 5.598 0.860 14.909
239 1HG LYS 34 2HG LYS 34 5.410 -0.593 16.935
240 2HG LYS 34 1HG LYS 34 6.689 -1.597 16.244
241 1HD LYS 34 2HD LYS 34 8.190 0.312 16.189
242 2HD LYS 34 1HD LYS 34 6.911 1.357 16.809
243 1HE LYS 34 2HE LYS 34 6.832 -0.053 18.850
244 2HE LYS 34 1HE LYS 34 8.219 -0.952 18.236
245 1HZ LYS 34 1HZ LYS 34 8.133 1.937 18.927
246 2HZ LYS 34 2HZ LYS 34 9.451 1.179 18.172
247 3HZ LYS 34 3HZ LYS 34 8.993 0.718 19.741
248 H SER 35 H SER 35 5.238 -1.001 11.923
249 HA SER 35 HA SER 35 3.152 0.697 10.923
250 1HB SER 35 2HB SER 35 5.984 1.783 10.976
251 2HB SER 35 1HB SER 35 4.598 2.551 10.205
252 HG SER 35 HG SER 35 3.855 2.113 12.667
253 H ALA 36 H ALA 36 3.548 1.185 8.554
254 HA ALA 36 HA ALA 36 5.102 -1.008 7.357
255 1HB ALA 36 1HB ALA 36 2.713 -1.510 7.251
256 2HB ALA 36 2HB ALA 36 3.372 -1.215 5.641
257 3HB ALA 36 3HB ALA 36 2.422 0.033 6.446
258 H THR 37 H THR 37 6.020 -0.613 5.335
259 HA THR 37 HA THR 37 5.913 2.149 4.351
260 HB THR 37 HB THR 37 8.367 1.835 3.686
261 HG1 THR 37 1HG THR 37 7.913 -0.495 4.977
262 1HG2 THR 37 1HG2 THR 37 7.661 2.086 6.613
263 2HG2 THR 37 2HG2 THR 37 7.696 3.398 5.434
264 3HG2 THR 37 3HG2 THR 37 9.191 2.579 5.887
265 H VAL 38 H VAL 38 5.517 2.270 2.237
266 HA VAL 38 HA VAL 38 5.522 -0.284 0.766
267 HB VAL 38 HB VAL 38 3.244 0.440 1.272
268 1HG1 VAL 38 1HG1 VAL 38 2.316 2.496 0.336
269 2HG1 VAL 38 2HG1 VAL 38 3.910 2.941 -0.275
270 3HG1 VAL 38 3HG1 VAL 38 3.632 2.835 1.463
271 1HG2 VAL 38 1HG2 VAL 38 2.334 0.440 -1.006
272 2HG2 VAL 38 2HG2 VAL 38 3.599 -0.767 -0.792
273 3HG2 VAL 38 3HG2 VAL 38 3.949 0.736 -1.644
274 H THR 39 H THR 39 6.431 -0.374 -1.199
275 HA THR 39 HA THR 39 7.283 2.161 -2.438
276 HB THR 39 HB THR 39 8.724 -0.498 -2.596
277 HG1 THR 39 1HG THR 39 8.938 0.519 -0.537
278 1HG2 THR 39 1HG2 THR 39 9.482 2.245 -3.606
279 2HG2 THR 39 2HG2 THR 39 9.017 0.869 -4.601
280 3HG2 THR 39 3HG2 THR 39 10.509 0.811 -3.665
281 H PHE 40 H PHE 40 6.456 2.506 -4.412
282 HA PHE 40 HA PHE 40 5.006 0.281 -5.661
283 1HB PHE 40 2HB PHE 40 4.813 3.270 -6.104
284 2HB PHE 40 1HB PHE 40 3.886 2.074 -6.997
285 HD1 PHE 40 2HD PHE 40 2.249 0.625 -5.737
286 HD2 PHE 40 1HD PHE 40 4.101 4.050 -4.017
287 HE1 PHE 40 2HE PHE 40 0.499 0.696 -4.010
288 HE2 PHE 40 1HE PHE 40 2.349 4.132 -2.287
289 HZ PHE 40 HZ PHE 40 0.544 2.452 -2.283
290 H THR 41 H THR 41 6.039 -0.760 -7.194
291 HA THR 41 HA THR 41 7.852 0.721 -8.962
292 HB THR 41 HB THR 41 7.624 -2.266 -9.016
293 HG1 THR 41 1HG THR 41 8.055 -0.997 -6.779
294 1HG2 THR 41 1HG2 THR 41 10.055 -2.073 -9.453
295 2HG2 THR 41 2HG2 THR 41 9.917 -0.319 -9.334
296 3HG2 THR 41 3HG2 THR 41 9.090 -1.184 -10.630
297 H GLU 42 H GLU 42 7.743 -0.208 -11.306
298 HA GLU 42 HA GLU 42 5.245 0.502 -12.341
299 1HB GLU 42 2HB GLU 42 7.463 0.647 -13.500
300 2HB GLU 42 1HB GLU 42 7.391 -1.092 -13.737
301 1HG GLU 42 2HG GLU 42 5.414 -0.859 -15.101
302 2HG GLU 42 1HG GLU 42 5.386 0.881 -14.803
303 H ASP 43 H ASP 43 6.701 -2.710 -11.899
304 HA ASP 43 HA ASP 43 4.279 -3.939 -13.014
305 1HB ASP 43 2HB ASP 43 6.946 -5.201 -12.338
306 2HB ASP 43 1HB ASP 43 5.592 -6.020 -13.102
307 H GLU 44 H GLU 44 5.419 -3.099 -9.993
308 HA GLU 44 HA GLU 44 3.948 -5.190 -8.647
309 1HB GLU 44 2HB GLU 44 5.922 -6.058 -7.444
310 2HB GLU 44 1HB GLU 44 6.002 -6.351 -9.176
311 1HG GLU 44 2HG GLU 44 7.318 -4.037 -9.096
312 2HG GLU 44 1HG GLU 44 7.669 -4.609 -7.466
313 H VAL 45 H VAL 45 3.463 -4.760 -6.549
314 HA VAL 45 HA VAL 45 4.486 -2.265 -5.373
315 HB VAL 45 HB VAL 45 2.166 -4.023 -4.514
316 1HG1 VAL 45 1HG1 VAL 45 3.231 -2.953 -2.600
317 2HG1 VAL 45 2HG1 VAL 45 1.633 -2.276 -2.907
318 3HG1 VAL 45 3HG1 VAL 45 3.074 -1.381 -3.385
319 1HG2 VAL 45 1HG2 VAL 45 0.762 -2.134 -5.204
320 2HG2 VAL 45 2HG2 VAL 45 1.687 -2.795 -6.551
321 3HG2 VAL 45 3HG2 VAL 45 2.198 -1.290 -5.787
322 H VAL 46 H VAL 46 6.130 -2.456 -3.985
323 HA VAL 46 HA VAL 46 6.641 -5.084 -2.779
324 HB VAL 46 HB VAL 46 8.495 -2.712 -3.022
325 1HG1 VAL 46 1HG1 VAL 46 9.029 -5.529 -2.083
326 2HG1 VAL 46 2HG1 VAL 46 9.012 -4.079 -1.080
327 3HG1 VAL 46 3HG1 VAL 46 10.248 -4.277 -2.322
328 1HG2 VAL 46 1HG2 VAL 46 8.017 -3.693 -5.188
329 2HG2 VAL 46 2HG2 VAL 46 8.415 -5.297 -4.570
330 3HG2 VAL 46 3HG2 VAL 46 9.670 -4.064 -4.696
331 H GLU 47 H GLU 47 6.229 -5.388 -0.699
332 HA GLU 47 HA GLU 47 5.662 -3.066 0.975
333 1HB GLU 47 2HB GLU 47 4.851 -5.911 1.044
334 2HB GLU 47 1HB GLU 47 5.028 -5.094 2.588
335 1HG GLU 47 2HG GLU 47 3.442 -3.412 1.932
336 2HG GLU 47 1HG GLU 47 3.328 -4.115 0.323
337 H THR 48 H THR 48 6.798 -2.491 2.613
338 HA THR 48 HA THR 48 8.813 -4.335 3.727
339 HB THR 48 HB THR 48 9.247 -1.367 3.779
340 HG1 THR 48 1HG THR 48 9.140 -2.758 1.549
341 1HG2 THR 48 1HG2 THR 48 10.592 -2.812 5.241
342 2HG2 THR 48 2HG2 THR 48 11.585 -2.027 4.014
343 3HG2 THR 48 3HG2 THR 48 11.137 -3.722 3.829
344 H GLU 49 H GLU 49 8.672 -4.539 5.896
345 HA GLU 49 HA GLU 49 6.726 -2.787 7.246
346 1HB GLU 49 2HB GLU 49 7.163 -5.713 7.846
347 2HB GLU 49 1HB GLU 49 5.883 -4.674 8.465
348 1HG GLU 49 2HG GLU 49 5.088 -4.405 6.101
349 2HG GLU 49 1HG GLU 49 6.254 -5.641 5.641
350 H VAL 50 H VAL 50 7.249 -1.991 9.212
351 HA VAL 50 HA VAL 50 10.028 -2.404 10.034
352 HB VAL 50 HB VAL 50 8.080 -0.273 10.939
353 1HG1 VAL 50 1HG1 VAL 50 11.075 -0.443 11.265
354 2HG1 VAL 50 2HG1 VAL 50 9.886 -0.728 12.535
355 3HG1 VAL 50 3HG1 VAL 50 10.033 0.872 11.811
356 1HG2 VAL 50 1HG2 VAL 50 9.332 1.234 9.460
357 2HG2 VAL 50 2HG2 VAL 50 8.521 -0.053 8.570
358 3HG2 VAL 50 3HG2 VAL 50 10.259 -0.143 8.858
359 H MET 51 H MET 51 10.369 -3.858 11.538
360 HA MET 51 HA MET 51 8.400 -4.145 13.714
361 1HB MET 51 2HB MET 51 8.780 -6.078 12.009
362 2HB MET 51 1HB MET 51 10.296 -6.309 12.863
363 1HG MET 51 2HG MET 51 7.617 -6.349 14.215
364 2HG MET 51 1HG MET 51 8.413 -7.788 13.585
365 1HE MET 51 1HE MET 51 8.358 -9.021 15.896
366 2HE MET 51 2HE MET 51 7.463 -7.658 16.568
367 3HE MET 51 3HE MET 51 8.879 -8.284 17.409
368 H GLU 52 H GLU 52 9.159 -3.798 15.710
369 HA GLU 52 HA GLU 52 11.803 -2.703 15.972
370 1HB GLU 52 2HB GLU 52 9.533 -2.041 17.134
371 2HB GLU 52 1HB GLU 52 10.025 -3.241 18.319
372 1HG GLU 52 2HG GLU 52 11.762 -0.929 17.501
373 2HG GLU 52 1HG GLU 52 10.618 -0.858 18.838
374 H GLY 53 H GLY 53 13.481 -4.011 16.054
375 1HA GLY 53 2HA GLY 53 14.708 -5.475 17.662
376 2HA GLY 53 1HA GLY 53 13.275 -6.499 17.642
377 H ARG 54 H ARG 54 12.905 -5.903 14.761
378 HA ARG 54 HA ARG 54 14.867 -7.811 13.692
379 1HB ARG 54 2HB ARG 54 12.356 -6.867 12.325
380 2HB ARG 54 1HB ARG 54 13.274 -8.333 12.030
381 1HG ARG 54 2HG ARG 54 11.970 -7.925 14.670
382 2HG ARG 54 1HG ARG 54 11.012 -8.417 13.280
383 1HD ARG 54 2HD ARG 54 12.623 -10.314 12.957
384 2HD ARG 54 1HD ARG 54 13.360 -9.858 14.495
385 HE ARG 54 HE ARG 54 10.485 -10.436 14.436
386 1HH1 ARG 54 1HH1 ARG 54 13.728 -11.438 15.338
387 2HH1 ARG 54 2HH1 ARG 54 13.173 -12.596 16.509
388 1HH2 ARG 54 1HH2 ARG 54 9.766 -11.983 15.950
389 2HH2 ARG 54 2HH2 ARG 54 10.927 -12.921 16.844
390 H GLY 55 H GLY 55 13.009 -4.984 12.718
391 1HA GLY 55 2HA GLY 55 14.209 -3.037 11.756
392 2HA GLY 55 1HA GLY 55 15.179 -4.211 10.867
393 H GLU 56 H GLU 56 14.265 -2.788 9.041
394 HA GLU 56 HA GLU 56 11.598 -3.260 8.243
395 1HB GLU 56 2HB GLU 56 14.040 -2.365 6.722
396 2HB GLU 56 1HB GLU 56 12.443 -2.484 6.004
397 1HG GLU 56 2HG GLU 56 12.672 -0.263 6.567
398 2HG GLU 56 1HG GLU 56 11.668 -0.921 7.844
399 H VAL 57 H VAL 57 10.708 -4.881 7.326
400 HA VAL 57 HA VAL 57 12.388 -7.001 6.147
401 HB VAL 57 HB VAL 57 9.766 -7.238 7.639
402 1HG1 VAL 57 1HG1 VAL 57 11.392 -9.391 6.274
403 2HG1 VAL 57 2HG1 VAL 57 9.793 -8.825 5.791
404 3HG1 VAL 57 3HG1 VAL 57 10.000 -9.671 7.323
405 1HG2 VAL 57 1HG2 VAL 57 11.714 -6.926 9.078
406 2HG2 VAL 57 2HG2 VAL 57 12.520 -8.285 8.296
407 3HG2 VAL 57 3HG2 VAL 57 11.058 -8.555 9.245
408 H GLN 58 H GLN 58 12.069 -7.267 4.009
409 HA GLN 58 HA GLN 58 9.765 -6.021 2.774
410 1HB GLN 58 2HB GLN 58 12.240 -7.254 1.567
411 2HB GLN 58 1HB GLN 58 10.998 -6.382 0.690
412 1HG GLN 58 2HG GLN 58 11.487 -4.399 2.114
413 2HG GLN 58 1HG GLN 58 12.853 -5.289 2.772
414 1HE2 GLN 58 1HE2 GLN 58 12.746 -2.797 1.237
415 2HE2 GLN 58 2HE2 GLN 58 13.766 -3.048 -0.133
416 H LEU 59 H LEU 59 8.084 -7.096 2.053
417 HA LEU 59 HA LEU 59 8.125 -10.022 2.121
418 1HB LEU 59 2HB LEU 59 5.866 -8.026 1.927
419 2HB LEU 59 1HB LEU 59 5.638 -9.762 1.837
420 HG LEU 59 HG LEU 59 6.718 -8.242 4.207
421 1HD1 LEU 59 1HD1 LEU 59 4.632 -8.965 5.287
422 2HD1 LEU 59 2HD1 LEU 59 4.084 -9.632 3.747
423 3HD1 LEU 59 3HD1 LEU 59 4.345 -7.895 3.917
424 1HD2 LEU 59 1HD2 LEU 59 6.606 -10.385 5.378
425 2HD2 LEU 59 2HD2 LEU 59 7.742 -10.441 4.030
426 3HD2 LEU 59 3HD2 LEU 59 6.148 -11.183 3.872
427 HA PRO 60 HA PRO 60 7.971 -10.781 -2.267
428 1HB PRO 60 2HB PRO 60 5.273 -11.972 -1.795
429 2HB PRO 60 1HB PRO 60 6.664 -12.646 -2.653
430 1HG PRO 60 2HG PRO 60 6.037 -13.482 -0.200
431 2HG PRO 60 1HG PRO 60 7.729 -13.284 -0.695
432 1HD PRO 60 2HD PRO 60 6.061 -11.573 1.087
433 2HD PRO 60 1HD PRO 60 7.802 -11.908 1.143
434 H PHE 61 H PHE 61 7.308 -9.641 -4.005
435 HA PHE 61 HA PHE 61 5.676 -7.358 -3.533
436 1HB PHE 61 2HB PHE 61 6.154 -6.838 -5.928
437 2HB PHE 61 1HB PHE 61 7.594 -7.125 -4.956
438 HD1 PHE 61 1HD PHE 61 5.436 -8.460 -7.609
439 HD2 PHE 61 2HD PHE 61 9.014 -9.017 -5.367
440 HE1 PHE 61 1HE PHE 61 6.188 -10.146 -9.236
441 HE2 PHE 61 2HE PHE 61 9.768 -10.704 -6.987
442 HZ PHE 61 HZ PHE 61 8.358 -11.268 -8.923
443 H MET 62 H MET 62 3.799 -6.727 -4.618
444 HA MET 62 HA MET 62 2.153 -8.970 -5.597
445 1HB MET 62 2HB MET 62 1.435 -6.424 -4.160
446 2HB MET 62 1HB MET 62 0.236 -7.369 -5.027
447 1HG MET 62 2HG MET 62 0.728 -9.297 -3.600
448 2HG MET 62 1HG MET 62 1.923 -8.339 -2.730
449 1HE MET 62 1HE MET 62 -1.421 -6.835 -4.078
450 2HE MET 62 2HE MET 62 -2.547 -7.199 -2.771
451 3HE MET 62 3HE MET 62 -1.882 -8.503 -3.753
452 H ALA 63 H ALA 63 1.126 -8.791 -7.543
453 HA ALA 63 HA ALA 63 1.992 -6.646 -9.285
454 1HB ALA 63 1HB ALA 63 1.967 -8.934 -10.134
455 2HB ALA 63 2HB ALA 63 0.880 -7.906 -11.065
456 3HB ALA 63 3HB ALA 63 0.225 -9.027 -9.868
457 H TYR 64 H TYR 64 0.649 -5.092 -10.245
458 HA TYR 64 HA TYR 64 -2.177 -5.095 -9.549
459 1HB TYR 64 2HB TYR 64 -2.176 -2.950 -8.505
460 2HB TYR 64 1HB TYR 64 -0.937 -3.905 -7.705
461 HD1 TYR 64 2HD TYR 64 1.509 -3.592 -8.724
462 HD2 TYR 64 1HD TYR 64 -1.667 -0.788 -9.124
463 HE1 TYR 64 2HE TYR 64 3.143 -1.808 -9.150
464 HE2 TYR 64 1HE TYR 64 -0.035 1.005 -9.550
465 HH TYR 64 HH TYR 64 3.350 0.330 -10.032
466 H LYS 65 H LYS 65 -3.333 -3.262 -10.618
467 HA LYS 65 HA LYS 65 -2.009 -2.435 -13.116
468 1HB LYS 65 2HB LYS 65 -4.122 -2.773 -14.313
469 2HB LYS 65 1HB LYS 65 -3.559 -4.280 -13.601
470 1HG LYS 65 2HG LYS 65 -5.131 -4.056 -11.792
471 2HG LYS 65 1HG LYS 65 -5.656 -2.492 -12.398
472 1HD LYS 65 2HD LYS 65 -5.899 -5.067 -13.951
473 2HD LYS 65 1HD LYS 65 -7.190 -4.393 -12.952
474 1HE LYS 65 2HE LYS 65 -7.049 -2.311 -14.323
475 2HE LYS 65 1HE LYS 65 -5.910 -3.146 -15.378
476 1HZ LYS 65 1HZ LYS 65 -7.589 -4.709 -15.983
477 2HZ LYS 65 2HZ LYS 65 -8.239 -3.157 -16.172
478 3HZ LYS 65 3HZ LYS 65 -8.670 -4.093 -14.831
479 H VAL 66 H VAL 66 -2.928 -0.574 -14.080
480 HA VAL 66 HA VAL 66 -4.013 1.307 -12.102
481 HB VAL 66 HB VAL 66 -2.566 1.793 -14.709
482 1HG1 VAL 66 1HG1 VAL 66 -2.586 4.165 -14.096
483 2HG1 VAL 66 2HG1 VAL 66 -3.568 3.790 -12.680
484 3HG1 VAL 66 3HG1 VAL 66 -4.223 3.545 -14.298
485 1HG2 VAL 66 1HG2 VAL 66 -0.763 2.651 -13.317
486 2HG2 VAL 66 2HG2 VAL 66 -1.128 0.974 -12.910
487 3HG2 VAL 66 3HG2 VAL 66 -1.695 2.274 -11.865
488 H ILE 67 H ILE 67 -6.032 1.975 -12.289
489 HA ILE 67 HA ILE 67 -7.631 1.150 -14.571
490 HB ILE 67 HB ILE 67 -8.563 2.810 -12.232
491 1HG1 ILE 67 2HG1 ILE 67 -8.362 -0.204 -12.429
492 2HG1 ILE 67 1HG1 ILE 67 -7.500 0.836 -11.304
493 1HG2 ILE 67 1HG2 ILE 67 -10.009 0.924 -14.091
494 2HG2 ILE 67 2HG2 ILE 67 -10.067 2.687 -14.146
495 3HG2 ILE 67 3HG2 ILE 67 -10.741 1.826 -12.763
496 1HD1 ILE 67 1HD1 ILE 67 -9.575 1.431 -10.219
497 2HD1 ILE 67 2HD1 ILE 67 -9.370 -0.321 -10.248
498 3HD1 ILE 67 3HD1 ILE 67 -10.478 0.455 -11.375
499 H SER 68 H SER 68 -6.805 4.129 -12.870
500 HA SER 68 HA SER 68 -6.869 5.607 -15.380
501 1HB SER 68 2HB SER 68 -8.411 6.483 -12.939
502 2HB SER 68 1HB SER 68 -8.199 7.427 -14.397
503 HG SER 68 HG SER 68 -10.100 6.485 -14.743
504 H GLN 69 H GLN 69 -5.896 7.783 -15.077
505 HA GLN 69 HA GLN 69 -4.220 8.077 -12.744
506 1HB GLN 69 2HB GLN 69 -2.897 6.566 -14.153
507 2HB GLN 69 1HB GLN 69 -2.980 7.718 -15.477
508 1HG GLN 69 2HG GLN 69 -1.653 9.294 -14.287
509 2HG GLN 69 1HG GLN 69 -1.739 8.332 -12.812
510 1HE2 GLN 69 1HE2 GLN 69 -0.502 6.466 -12.639
511 2HE2 GLN 69 2HE2 GLN 69 0.834 6.151 -13.691
512 H SER 70 H SER 70 -3.890 10.110 -12.269
513 HA SER 70 HA SER 70 -3.870 12.166 -14.306
514 1HB SER 70 2HB SER 70 -6.239 12.039 -13.803
515 2HB SER 70 1HB SER 70 -5.918 12.089 -12.073
516 HG SER 70 HG SER 70 -5.863 14.146 -13.972
517 H THR 71 H THR 71 -2.240 13.469 -13.831
518 HA THR 71 HA THR 71 -0.921 13.272 -11.292
519 HB THR 71 HB THR 71 0.482 15.189 -12.412
520 HG1 THR 71 1HG THR 71 -0.242 15.716 -14.320
521 1HG2 THR 71 1HG2 THR 71 1.264 12.886 -12.047
522 2HG2 THR 71 2HG2 THR 71 1.797 13.513 -13.607
523 3HG2 THR 71 3HG2 THR 71 0.447 12.382 -13.528
524 H ASP 72 H ASP 72 -3.395 15.240 -12.556
525 HA ASP 72 HA ASP 72 -2.782 17.375 -10.641
526 1HB ASP 72 2HB ASP 72 -4.271 18.805 -11.889
527 2HB ASP 72 1HB ASP 72 -3.125 18.062 -12.996
528 H GLY 73 H GLY 73 -4.954 14.800 -11.212
529 1HA GLY 73 2HA GLY 73 -6.767 15.897 -9.160
530 2HA GLY 73 1HA GLY 73 -7.263 14.785 -10.425
531 H SER 74 H SER 74 -5.836 12.689 -10.385
532 HA SER 74 HA SER 74 -5.086 11.582 -7.933
533 1HB SER 74 2HB SER 74 -7.382 12.022 -7.233
534 2HB SER 74 1HB SER 74 -8.000 11.155 -8.632
535 HG SER 74 HG SER 74 -6.283 9.878 -6.794
536 H ILE 75 H ILE 75 -4.805 9.308 -8.014
537 HA ILE 75 HA ILE 75 -4.945 8.161 -10.728
538 HB ILE 75 HB ILE 75 -2.958 7.432 -8.565
539 1HG1 ILE 75 2HG1 ILE 75 -2.591 9.187 -11.008
540 2HG1 ILE 75 1HG1 ILE 75 -2.520 9.707 -9.331
541 1HG2 ILE 75 1HG2 ILE 75 -3.080 6.686 -11.491
542 2HG2 ILE 75 2HG2 ILE 75 -3.451 5.627 -10.130
543 3HG2 ILE 75 3HG2 ILE 75 -1.808 6.226 -10.360
544 1HD1 ILE 75 1HD1 ILE 75 -0.612 7.808 -10.661
545 2HD1 ILE 75 2HD1 ILE 75 -0.547 8.332 -8.978
546 3HD1 ILE 75 3HD1 ILE 75 -0.307 9.502 -10.278
547 H GLU 76 H GLU 76 -6.041 6.255 -10.917
548 HA GLU 76 HA GLU 76 -6.973 5.028 -8.405
549 1HB GLU 76 2HB GLU 76 -8.714 6.017 -10.008
550 2HB GLU 76 1HB GLU 76 -8.282 4.703 -11.092
551 1HG GLU 76 2HG GLU 76 -9.028 3.055 -9.567
552 2HG GLU 76 1HG GLU 76 -9.201 4.239 -8.276
553 H ILE 77 H ILE 77 -6.287 3.052 -7.974
554 HA ILE 77 HA ILE 77 -5.103 1.464 -10.160
555 HB ILE 77 HB ILE 77 -3.395 0.632 -8.569
556 1HG1 ILE 77 2HG1 ILE 77 -4.370 2.855 -6.755
557 2HG1 ILE 77 1HG1 ILE 77 -4.668 1.140 -6.486
558 1HG2 ILE 77 1HG2 ILE 77 -2.861 2.432 -10.119
559 2HG2 ILE 77 2HG2 ILE 77 -1.983 2.624 -8.601
560 3HG2 ILE 77 3HG2 ILE 77 -3.397 3.624 -8.934
561 1HD1 ILE 77 1HD1 ILE 77 -1.968 2.475 -6.554
562 2HD1 ILE 77 2HD1 ILE 77 -2.272 0.761 -6.263
563 3HD1 ILE 77 3HD1 ILE 77 -2.844 1.964 -5.108
564 H GLN 78 H GLN 78 -5.009 -0.823 -9.766
565 HA GLN 78 HA GLN 78 -6.875 -1.828 -7.739
566 1HB GLN 78 2HB GLN 78 -8.163 -1.556 -9.806
567 2HB GLN 78 1HB GLN 78 -6.963 -2.484 -10.692
568 1HG GLN 78 2HG GLN 78 -7.515 -4.467 -9.412
569 2HG GLN 78 1HG GLN 78 -8.683 -3.545 -8.461
570 1HE2 GLN 78 1HE2 GLN 78 -10.625 -2.936 -9.388
571 2HE2 GLN 78 2HE2 GLN 78 -11.202 -3.606 -10.872
572 H TYR 79 H TYR 79 -6.315 -3.848 -6.947
573 HA TYR 79 HA TYR 79 -3.617 -4.674 -7.635
574 1HB TYR 79 2HB TYR 79 -5.478 -5.519 -5.408
575 2HB TYR 79 1HB TYR 79 -3.846 -6.150 -5.627
576 HD1 TYR 79 2HD TYR 79 -1.895 -4.703 -5.265
577 HD2 TYR 79 1HD TYR 79 -5.845 -3.299 -4.543
578 HE1 TYR 79 2HE TYR 79 -0.982 -2.800 -4.005
579 HE2 TYR 79 1HE TYR 79 -4.942 -1.389 -3.284
580 HH TYR 79 HH TYR 79 -1.637 -0.553 -3.340
581 H LEU 80 H LEU 80 -3.057 -6.860 -8.060
582 HA LEU 80 HA LEU 80 -5.213 -8.333 -9.406
583 1HB LEU 80 2HB LEU 80 -2.242 -8.303 -9.951
584 2HB LEU 80 1HB LEU 80 -3.386 -9.355 -10.762
585 HG LEU 80 HG LEU 80 -3.468 -6.341 -10.875
586 1HD1 LEU 80 1HD1 LEU 80 -2.471 -8.340 -12.901
587 2HD1 LEU 80 2HD1 LEU 80 -1.474 -7.215 -11.977
588 3HD1 LEU 80 3HD1 LEU 80 -2.631 -6.602 -13.157
589 1HD2 LEU 80 1HD2 LEU 80 -4.962 -8.448 -12.431
590 2HD2 LEU 80 2HD2 LEU 80 -5.053 -6.707 -12.702
591 3HD2 LEU 80 3HD2 LEU 80 -5.645 -7.399 -11.191
592 H GLY 81 H GLY 81 -4.196 -10.802 -9.662
593 1HA GLY 81 2HA GLY 81 -3.738 -12.753 -8.482
594 2HA GLY 81 1HA GLY 81 -3.219 -11.764 -7.119
595 HA PRO 82 HA PRO 82 -7.274 -13.585 -5.776
596 1HB PRO 82 2HB PRO 82 -5.983 -13.109 -3.155
597 2HB PRO 82 1HB PRO 82 -6.792 -14.556 -3.761
598 1HG PRO 82 2HG PRO 82 -4.137 -14.471 -3.506
599 2HG PRO 82 1HG PRO 82 -4.905 -15.311 -4.867
600 1HD PRO 82 2HD PRO 82 -3.592 -12.615 -4.796
601 2HD PRO 82 1HD PRO 82 -3.508 -13.877 -6.045
602 H TYR 83 H TYR 83 -5.492 -10.709 -5.211
603 HA TYR 83 HA TYR 83 -7.634 -9.388 -3.734
604 1HB TYR 83 2HB TYR 83 -4.919 -8.373 -4.614
605 2HB TYR 83 1HB TYR 83 -6.056 -7.492 -3.602
606 HD1 TYR 83 1HD TYR 83 -3.712 -10.333 -3.724
607 HD2 TYR 83 2HD TYR 83 -6.297 -8.005 -1.268
608 HE1 TYR 83 1HE TYR 83 -2.676 -11.311 -1.716
609 HE2 TYR 83 2HE TYR 83 -5.274 -8.982 0.741
610 HH TYR 83 HH TYR 83 -2.372 -10.612 0.713
611 H TYR 84 H TYR 84 -7.716 -10.217 -6.668
612 HA TYR 84 HA TYR 84 -7.643 -7.934 -8.297
613 1HB TYR 84 2HB TYR 84 -8.858 -9.274 -9.927
614 2HB TYR 84 1HB TYR 84 -7.606 -10.243 -9.166
615 HD1 TYR 84 1HD TYR 84 -8.347 -11.836 -7.277
616 HD2 TYR 84 2HD TYR 84 -11.053 -10.024 -10.012
617 HE1 TYR 84 1HE TYR 84 -9.999 -13.590 -6.798
618 HE2 TYR 84 2HE TYR 84 -12.715 -11.768 -9.530
619 HH TYR 84 HH TYR 84 -12.776 -14.057 -8.698
620 HA PRO 85 HA PRO 85 -10.600 -5.226 -9.203
621 1HB PRO 85 2HB PRO 85 -12.832 -7.001 -8.299
622 2HB PRO 85 1HB PRO 85 -12.914 -5.600 -9.383
623 1HG PRO 85 2HG PRO 85 -12.395 -8.221 -10.206
624 2HG PRO 85 1HG PRO 85 -12.024 -6.763 -11.147
625 1HD PRO 85 2HD PRO 85 -10.120 -8.576 -10.157
626 2HD PRO 85 1HD PRO 85 -9.771 -6.905 -10.663
627 H LEU 86 H LEU 86 -10.076 -6.541 -6.112
628 HA LEU 86 HA LEU 86 -11.246 -4.397 -4.638
629 1HB LEU 86 2HB LEU 86 -10.439 -6.468 -3.566
630 2HB LEU 86 1HB LEU 86 -8.795 -6.071 -4.030
631 HG LEU 86 HG LEU 86 -8.908 -4.055 -2.578
632 1HD1 LEU 86 1HD1 LEU 86 -11.568 -5.209 -1.750
633 2HD1 LEU 86 2HD1 LEU 86 -11.312 -3.697 -2.620
634 3HD1 LEU 86 3HD1 LEU 86 -10.741 -3.868 -0.959
635 1HD2 LEU 86 1HD2 LEU 86 -9.547 -6.650 -1.182
636 2HD2 LEU 86 2HD2 LEU 86 -8.736 -5.257 -0.470
637 3HD2 LEU 86 3HD2 LEU 86 -7.955 -6.160 -1.767
638 H LYS 87 H LYS 87 -10.800 -2.335 -5.221
639 HA LYS 87 HA LYS 87 -8.134 -1.789 -6.305
640 1HB LYS 87 2HB LYS 87 -9.087 0.095 -7.464
641 2HB LYS 87 1HB LYS 87 -10.056 -1.332 -7.791
642 1HG LYS 87 2HG LYS 87 -11.783 -0.595 -6.332
643 2HG LYS 87 1HG LYS 87 -10.782 0.724 -5.720
644 1HD LYS 87 2HD LYS 87 -10.756 1.718 -7.983
645 2HD LYS 87 1HD LYS 87 -11.817 0.424 -8.542
646 1HE LYS 87 2HE LYS 87 -13.544 1.152 -6.983
647 2HE LYS 87 1HE LYS 87 -12.476 2.412 -6.372
648 1HZ LYS 87 1HZ LYS 87 -12.555 3.540 -8.445
649 2HZ LYS 87 2HZ LYS 87 -14.159 3.161 -8.034
650 3HZ LYS 87 3HZ LYS 87 -13.348 2.247 -9.204
651 H SER 88 H SER 88 -7.540 0.612 -6.077
652 HA SER 88 HA SER 88 -8.138 1.695 -3.439
653 1HB SER 88 2HB SER 88 -6.225 0.291 -2.977
654 2HB SER 88 1HB SER 88 -5.369 0.907 -4.383
655 HG SER 88 HG SER 88 -6.146 2.471 -2.143
656 H THR 89 H THR 89 -7.245 3.942 -3.249
657 HA THR 89 HA THR 89 -7.022 5.197 -5.908
658 HB THR 89 HB THR 89 -8.320 6.606 -3.609
659 HG1 THR 89 1HG THR 89 -9.408 4.594 -5.257
660 1HG2 THR 89 1HG2 THR 89 -8.627 6.816 -6.601
661 2HG2 THR 89 2HG2 THR 89 -7.706 7.915 -5.575
662 3HG2 THR 89 3HG2 THR 89 -9.460 7.816 -5.414
663 H LEU 90 H LEU 90 -5.591 6.862 -6.097
664 HA LEU 90 HA LEU 90 -4.035 7.602 -3.708
665 1HB LEU 90 2HB LEU 90 -3.045 7.213 -6.537
666 2HB LEU 90 1HB LEU 90 -2.091 7.914 -5.245
667 HG LEU 90 HG LEU 90 -3.185 5.100 -5.217
668 1HD1 LEU 90 1HD1 LEU 90 -0.899 4.403 -5.686
669 2HD1 LEU 90 2HD1 LEU 90 -0.405 6.090 -5.825
670 3HD1 LEU 90 3HD1 LEU 90 -1.533 5.404 -6.993
671 1HD2 LEU 90 1HD2 LEU 90 -2.823 6.037 -2.997
672 2HD2 LEU 90 2HD2 LEU 90 -1.187 6.513 -3.452
673 3HD2 LEU 90 3HD2 LEU 90 -1.614 4.804 -3.359
674 H LYS 91 H LYS 91 -4.234 9.721 -3.264
675 HA LYS 91 HA LYS 91 -4.781 11.511 -5.542
676 1HB LYS 91 2HB LYS 91 -5.814 11.665 -2.718
677 2HB LYS 91 1HB LYS 91 -5.824 13.049 -3.801
678 1HG LYS 91 2HG LYS 91 -7.116 11.605 -5.417
679 2HG LYS 91 1HG LYS 91 -7.305 10.469 -4.086
680 1HD LYS 91 2HD LYS 91 -8.372 12.230 -2.746
681 2HD LYS 91 1HD LYS 91 -8.193 13.351 -4.095
682 1HE LYS 91 2HE LYS 91 -10.409 12.576 -4.210
683 2HE LYS 91 1HE LYS 91 -9.533 11.697 -5.464
684 1HZ LYS 91 1HZ LYS 91 -10.462 10.712 -2.840
685 2HZ LYS 91 2HZ LYS 91 -9.260 9.893 -3.703
686 3HZ LYS 91 3HZ LYS 91 -10.807 10.087 -4.378
687 H ARG 92 H ARG 92 -4.025 13.678 -5.332
688 HA ARG 92 HA ARG 92 -1.352 13.852 -4.381
689 1HB ARG 92 2HB ARG 92 -1.579 16.262 -5.057
690 2HB ARG 92 1HB ARG 92 -1.952 15.110 -6.327
691 1HG ARG 92 2HG ARG 92 -4.337 15.385 -5.790
692 2HG ARG 92 1HG ARG 92 -3.890 16.636 -4.636
693 1HD ARG 92 2HD ARG 92 -2.960 16.818 -7.467
694 2HD ARG 92 1HD ARG 92 -4.602 17.278 -7.050
695 HE ARG 92 HE ARG 92 -2.419 18.511 -5.545
696 1HH1 ARG 92 1HH1 ARG 92 -4.890 18.771 -8.007
697 2HH1 ARG 92 2HH1 ARG 92 -4.919 20.512 -7.990
698 1HH2 ARG 92 1HH2 ARG 92 -2.416 20.816 -5.552
699 2HH2 ARG 92 2HH2 ARG 92 -3.511 21.669 -6.600
700 H GLY 93 H GLY 93 -0.552 14.958 -2.642
701 1HA GLY 93 2HA GLY 93 -2.341 15.064 -0.400
702 2HA GLY 93 1HA GLY 93 -0.595 15.265 -0.361
703 H GLU 94 H GLU 94 -2.840 16.757 0.795
704 HA GLU 94 HA GLU 94 -3.318 19.194 -0.389
705 1HB GLU 94 2HB GLU 94 -3.088 18.552 2.553
706 2HB GLU 94 1HB GLU 94 -3.894 19.957 1.872
707 1HG GLU 94 2HG GLU 94 -5.580 18.635 0.881
708 2HG GLU 94 1HG GLU 94 -4.691 17.148 1.203
709 H ASN 95 H ASN 95 -0.723 18.276 1.795
710 HA ASN 95 HA ASN 95 0.792 20.601 0.831
711 1HB ASN 95 2HB ASN 95 0.708 19.570 3.671
712 2HB ASN 95 1HB ASN 95 1.902 20.718 3.082
713 1HD2 ASN 95 1HD2 ASN 95 -0.108 22.062 1.353
714 2HD2 ASN 95 2HD2 ASN 95 -1.079 23.000 2.434
715 H GLY 96 H GLY 96 1.641 19.080 -0.719
716 1HA GLY 96 2HA GLY 96 3.356 17.782 -1.524
717 2HA GLY 96 1HA GLY 96 4.241 18.319 -0.107
718 H THR 97 H THR 97 1.521 16.096 -0.713
719 HA THR 97 HA THR 97 3.023 13.960 0.581
720 HB THR 97 HB THR 97 0.567 13.571 1.703
721 HG1 THR 97 1HG THR 97 1.043 16.324 2.142
722 1HG2 THR 97 1HG2 THR 97 2.892 15.103 2.879
723 2HG2 THR 97 2HG2 THR 97 2.700 13.351 2.862
724 3HG2 THR 97 3HG2 THR 97 1.594 14.351 3.806
725 H LEU 98 H LEU 98 1.660 11.856 0.492
726 HA LEU 98 HA LEU 98 -0.028 11.833 -1.924
727 1HB LEU 98 2HB LEU 98 2.056 10.549 -2.216
728 2HB LEU 98 1HB LEU 98 1.648 9.576 -0.814
729 HG LEU 98 HG LEU 98 -0.401 8.796 -2.045
730 1HD1 LEU 98 1HD1 LEU 98 -0.609 10.636 -3.618
731 2HD1 LEU 98 2HD1 LEU 98 -0.445 9.106 -4.482
732 3HD1 LEU 98 3HD1 LEU 98 0.930 10.201 -4.358
733 1HD2 LEU 98 1HD2 LEU 98 2.266 8.247 -3.342
734 2HD2 LEU 98 2HD2 LEU 98 0.819 7.253 -3.508
735 3HD2 LEU 98 3HD2 LEU 98 1.600 7.419 -1.934
736 H ILE 99 H ILE 99 -2.038 11.020 -1.735
737 HA ILE 99 HA ILE 99 -2.842 10.113 0.935
738 HB ILE 99 HB ILE 99 -4.519 11.238 -1.314
739 1HG1 ILE 99 2HG1 ILE 99 -3.807 12.415 1.375
740 2HG1 ILE 99 1HG1 ILE 99 -3.047 12.859 -0.149
741 1HG2 ILE 99 1HG2 ILE 99 -5.328 10.409 1.469
742 2HG2 ILE 99 2HG2 ILE 99 -5.785 9.611 -0.036
743 3HG2 ILE 99 3HG2 ILE 99 -6.357 11.243 0.308
744 1HD1 ILE 99 1HD1 ILE 99 -5.260 13.619 -0.964
745 2HD1 ILE 99 2HD1 ILE 99 -4.671 14.511 0.437
746 3HD1 ILE 99 3HD1 ILE 99 -5.921 13.283 0.637
747 H TRP 100 H TRP 100 -2.899 7.983 1.099
748 HA TRP 100 HA TRP 100 -3.624 6.363 -1.234
749 1HB TRP 100 2HB TRP 100 -1.538 5.813 0.031
750 2HB TRP 100 1HB TRP 100 -2.525 5.460 1.443
751 HD1 TRP 100 HD TRP 100 -3.712 4.297 -1.982
752 HE1 TRP 100 1HE TRP 100 -3.563 1.741 -2.104
753 HE3 TRP 100 3HE TRP 100 -1.222 3.426 2.397
754 HZ2 TRP 100 2HZ TRP 100 -2.525 -0.377 -0.552
755 HZ3 TRP 100 3HZ TRP 100 -0.688 1.102 3.001
756 HH2 TRP 100 HH TRP 100 -1.324 -0.759 1.554
757 H GLU 101 H GLU 101 -5.698 5.905 -1.439
758 HA GLU 101 HA GLU 101 -7.369 5.752 0.978
759 1HB GLU 101 2HB GLU 101 -8.037 6.142 -1.925
760 2HB GLU 101 1HB GLU 101 -9.255 5.856 -0.697
761 1HG GLU 101 2HG GLU 101 -8.807 7.882 0.380
762 2HG GLU 101 1HG GLU 101 -7.286 8.086 -0.482
763 H GLN 102 H GLN 102 -8.213 3.981 1.606
764 HA GLN 102 HA GLN 102 -8.720 1.776 -0.205
765 1HB GLN 102 2HB GLN 102 -6.338 1.797 1.269
766 2HB GLN 102 1HB GLN 102 -7.410 0.727 2.160
767 1HG GLN 102 2HG GLN 102 -6.981 0.445 -0.793
768 2HG GLN 102 1HG GLN 102 -5.906 -0.296 0.382
769 1HE2 GLN 102 1HE2 GLN 102 -6.406 -2.353 -0.290
770 2HE2 GLN 102 2HE2 GLN 102 -7.921 -3.106 0.052
771 H ASN 103 H ASN 103 -10.691 1.092 0.261
772 HA ASN 103 HA ASN 103 -12.522 0.400 1.413
773 1HB ASN 103 2HB ASN 103 -10.234 -0.313 3.004
774 2HB ASN 103 1HB ASN 103 -11.594 0.058 4.050
775 1HD2 ASN 103 1HD2 ASN 103 -10.381 -1.996 1.541
776 2HD2 ASN 103 2HD2 ASN 103 -11.565 -3.250 1.709
777 H GLY 104 H GLY 104 -11.537 3.315 1.547
778 1HA GLY 104 2HA GLY 104 -13.133 5.030 2.085
779 2HA GLY 104 1HA GLY 104 -13.588 4.102 3.503
780 H GLN 105 H GLN 105 -10.534 3.701 3.920
781 HA GLN 105 HA GLN 105 -10.384 6.053 5.644
782 1HB GLN 105 2HB GLN 105 -8.568 4.818 6.808
783 2HB GLN 105 1HB GLN 105 -10.094 3.942 6.777
784 1HG GLN 105 2HG GLN 105 -9.279 2.563 4.951
785 2HG GLN 105 1HG GLN 105 -7.761 3.458 4.945
786 1HE2 GLN 105 1HE2 GLN 105 -9.739 1.169 6.669
787 2HE2 GLN 105 2HE2 GLN 105 -8.489 0.581 7.709
788 H ARG 106 H ARG 106 -8.652 7.437 5.715
789 HA ARG 106 HA ARG 106 -7.106 7.600 3.246
790 1HB ARG 106 2HB ARG 106 -8.131 9.674 3.765
791 2HB ARG 106 1HB ARG 106 -7.680 9.568 5.462
792 1HG ARG 106 2HG ARG 106 -5.283 9.751 4.733
793 2HG ARG 106 1HG ARG 106 -5.879 10.110 3.117
794 1HD ARG 106 2HD ARG 106 -6.776 11.696 5.497
795 2HD ARG 106 1HD ARG 106 -5.269 12.069 4.665
796 HE ARG 106 HE ARG 106 -7.653 11.921 3.008
797 1HH1 ARG 106 1HH1 ARG 106 -5.383 13.922 4.759
798 2HH1 ARG 106 2HH1 ARG 106 -5.804 15.382 3.906
799 1HH2 ARG 106 1HH2 ARG 106 -8.211 13.825 1.873
800 2HH2 ARG 106 2HH2 ARG 106 -7.425 15.321 2.287
801 H LYS 107 H LYS 107 -5.170 6.652 3.227
802 HA LYS 107 HA LYS 107 -3.540 6.725 5.648
803 1HB LYS 107 2HB LYS 107 -3.396 5.212 3.100
804 2HB LYS 107 1HB LYS 107 -1.883 5.571 3.929
805 1HG LYS 107 2HG LYS 107 -4.246 4.099 5.072
806 2HG LYS 107 1HG LYS 107 -2.689 3.425 4.609
807 1HD LYS 107 2HD LYS 107 -1.581 4.761 6.319
808 2HD LYS 107 1HD LYS 107 -3.136 5.456 6.780
809 1HE LYS 107 2HE LYS 107 -2.479 2.543 6.857
810 2HE LYS 107 1HE LYS 107 -2.400 3.612 8.247
811 1HZ LYS 107 1HZ LYS 107 -4.810 4.111 7.770
812 2HZ LYS 107 2HZ LYS 107 -4.486 2.557 8.359
813 3HZ LYS 107 3HZ LYS 107 -4.791 2.790 6.713
814 H THR 108 H THR 108 -2.279 8.364 5.993
815 HA THR 108 HA THR 108 -1.552 10.119 3.759
816 HB THR 108 HB THR 108 -1.429 10.665 6.734
817 HG1 THR 108 1HG THR 108 -3.472 11.133 6.486
818 1HG2 THR 108 1HG2 THR 108 -1.049 12.526 4.382
819 2HG2 THR 108 2HG2 THR 108 0.228 11.960 5.458
820 3HG2 THR 108 3HG2 THR 108 -1.055 12.998 6.081
821 H MET 109 H MET 109 0.399 9.864 2.930
822 HA MET 109 HA MET 109 2.514 8.802 4.673
823 1HB MET 109 2HB MET 109 3.293 7.484 2.664
824 2HB MET 109 1HB MET 109 1.800 6.930 3.411
825 1HG MET 109 2HG MET 109 0.532 8.144 1.661
826 2HG MET 109 1HG MET 109 2.063 8.559 0.894
827 1HE MET 109 1HE MET 109 1.477 5.166 2.718
828 2HE MET 109 2HE MET 109 0.772 4.167 1.445
829 3HE MET 109 3HE MET 109 -0.147 5.513 2.118
830 H THR 110 H THR 110 4.443 9.698 4.516
831 HA THR 110 HA THR 110 4.926 11.737 2.480
832 HB THR 110 HB THR 110 7.011 12.085 4.030
833 HG1 THR 110 1HG THR 110 6.704 11.387 6.139
834 1HG2 THR 110 1HG2 THR 110 5.242 13.731 3.789
835 2HG2 THR 110 2HG2 THR 110 5.693 13.583 5.488
836 3HG2 THR 110 3HG2 THR 110 4.217 12.821 4.898
837 H ARG 111 H ARG 111 6.811 11.635 1.175
838 HA ARG 111 HA ARG 111 7.605 8.912 0.615
839 1HB ARG 111 2HB ARG 111 7.181 10.790 -1.121
840 2HB ARG 111 1HB ARG 111 8.814 11.314 -0.726
841 1HG ARG 111 2HG ARG 111 9.548 8.944 -1.234
842 2HG ARG 111 1HG ARG 111 7.942 8.698 -1.919
843 1HD ARG 111 2HD ARG 111 9.157 9.297 -3.781
844 2HD ARG 111 1HD ARG 111 8.503 10.853 -3.270
845 HE ARG 111 HE ARG 111 10.753 11.105 -2.093
846 1HH1 ARG 111 1HH1 ARG 111 10.279 9.318 -5.054
847 2HH1 ARG 111 2HH1 ARG 111 11.911 9.545 -5.618
848 1HH2 ARG 111 1HH2 ARG 111 12.928 11.419 -2.805
849 2HH2 ARG 111 2HH2 ARG 111 13.416 10.738 -4.333
850 H ILE 112 H ILE 112 9.357 7.938 1.284
851 HA ILE 112 HA ILE 112 11.145 9.239 3.100
852 HB ILE 112 HB ILE 112 11.506 6.535 1.821
853 1HG1 ILE 112 2HG1 ILE 112 9.292 6.698 2.869
854 2HG1 ILE 112 1HG1 ILE 112 10.348 5.613 3.760
855 1HG2 ILE 112 1HG2 ILE 112 12.532 7.646 4.425
856 2HG2 ILE 112 2HG2 ILE 112 13.485 7.406 2.961
857 3HG2 ILE 112 3HG2 ILE 112 12.811 6.016 3.816
858 1HD1 ILE 112 1HD1 ILE 112 9.032 7.027 5.243
859 2HD1 ILE 112 2HD1 ILE 112 9.747 8.461 4.506
860 3HD1 ILE 112 3HD1 ILE 112 10.759 7.335 5.413
861 H GLU 113 H GLU 113 13.307 9.669 2.793
862 HA GLU 113 HA GLU 113 14.151 9.876 -0.015
863 1HB GLU 113 2HB GLU 113 13.437 12.034 1.074
864 2HB GLU 113 1HB GLU 113 14.817 11.872 2.147
865 1HG GLU 113 2HG GLU 113 15.251 13.384 0.278
866 2HG GLU 113 1HG GLU 113 16.320 11.984 0.264
867 H SER 114 H SER 114 15.803 8.618 -0.362
868 HA SER 114 HA SER 114 17.300 7.610 1.918
869 1HB SER 114 2HB SER 114 17.193 6.642 -0.944
870 2HB SER 114 1HB SER 114 18.043 5.836 0.375
871 HG SER 114 HG SER 114 15.506 5.578 -0.305
872 H LYS 115 H LYS 115 18.709 9.273 2.357
873 HA LYS 115 HA LYS 115 20.854 9.684 0.387
874 1HB LYS 115 2HB LYS 115 19.917 11.226 2.776
875 2HB LYS 115 1HB LYS 115 21.607 11.339 2.313
876 1HG LYS 115 2HG LYS 115 20.314 13.167 1.380
877 2HG LYS 115 1HG LYS 115 20.963 12.137 0.105
878 1HD LYS 115 2HD LYS 115 18.775 11.005 -0.044
879 2HD LYS 115 1HD LYS 115 18.144 12.117 1.170
880 1HE LYS 115 2HE LYS 115 19.284 12.932 -1.500
881 2HE LYS 115 1HE LYS 115 17.565 12.774 -1.140
882 1HZ LYS 115 1HZ LYS 115 18.164 15.052 -0.952
883 2HZ LYS 115 2HZ LYS 115 19.472 14.701 0.067
884 3HZ LYS 115 3HZ LYS 115 17.884 14.477 0.619
885 H THR 116 H THR 116 20.222 7.321 2.104
886 HA THR 116 HA THR 116 22.885 6.936 3.237
887 HB THR 116 HB THR 116 21.523 7.562 5.150
888 HG1 THR 116 1HG THR 116 21.603 4.757 5.393
889 1HG2 THR 116 1HG2 THR 116 19.543 6.260 5.803
890 2HG2 THR 116 2HG2 THR 116 19.654 5.349 4.298
891 3HG2 THR 116 3HG2 THR 116 19.314 7.079 4.259
892 H GLY 117 H GLY 117 23.525 4.731 3.305
893 1HA GLY 117 2HA GLY 117 21.779 2.929 1.735
894 2HA GLY 117 1HA GLY 117 23.536 2.916 1.630
895 H ARG 118 H ARG 118 24.644 2.617 3.779
896 HA ARG 118 HA ARG 118 25.184 1.293 5.511
897 1HB ARG 118 2HB ARG 118 23.478 2.690 6.601
898 2HB ARG 118 1HB ARG 118 22.242 1.526 6.149
899 1HG ARG 118 2HG ARG 118 23.233 -0.146 7.577
900 2HG ARG 118 1HG ARG 118 24.580 0.932 7.954
901 1HD ARG 118 2HD ARG 118 22.883 0.865 9.742
902 2HD ARG 118 1HD ARG 118 23.081 2.476 9.052
903 HE ARG 118 HE ARG 118 20.958 0.888 7.887
904 1HH1 ARG 118 1HH1 ARG 118 21.814 3.248 10.344
905 2HH1 ARG 118 2HH1 ARG 118 20.193 3.855 10.488
906 1HH2 ARG 118 1HH2 ARG 118 18.835 1.685 8.096
907 2HH2 ARG 118 2HH2 ARG 118 18.503 2.960 9.233
908 H GLU 119 H GLU 119 25.746 -0.428 4.148
909 HA GLU 119 HA GLU 119 23.814 -2.586 3.875
910 1HB GLU 119 2HB GLU 119 25.629 -3.716 2.571
911 2HB GLU 119 1HB GLU 119 25.090 -2.189 1.895
912 1HG GLU 119 2HG GLU 119 27.530 -2.401 3.627
913 2HG GLU 119 1HG GLU 119 27.579 -2.659 1.885
914 H GLU 120 H GLU 120 23.830 -4.411 5.023
915 HA GLU 120 HA GLU 120 25.670 -4.527 7.294
916 1HB GLU 120 2HB GLU 120 23.149 -6.116 6.769
917 2HB GLU 120 1HB GLU 120 24.078 -6.105 8.262
918 1HG GLU 120 2HG GLU 120 22.624 -3.744 7.084
919 2HG GLU 120 1HG GLU 120 22.055 -4.743 8.419
920 H LYS 121 H LYS 121 26.666 -6.524 7.907
921 HA LYS 121 HA LYS 121 27.324 -8.246 5.648
922 1HB LYS 121 2HB LYS 121 28.426 -8.289 8.466
923 2HB LYS 121 1HB LYS 121 29.071 -9.155 7.082
924 1HG LYS 121 2HG LYS 121 28.989 -6.160 7.379
925 2HG LYS 121 1HG LYS 121 30.399 -7.182 7.651
926 1HD LYS 121 2HD LYS 121 30.319 -7.904 5.307
927 2HD LYS 121 1HD LYS 121 28.916 -6.866 5.040
928 1HE LYS 121 2HE LYS 121 30.263 -4.907 5.638
929 2HE LYS 121 1HE LYS 121 31.661 -5.949 5.888
930 1HZ LYS 121 1HZ LYS 121 31.720 -4.889 3.722
931 2HZ LYS 121 2HZ LYS 121 30.221 -5.571 3.317
932 3HZ LYS 121 3HZ LYS 121 31.569 -6.571 3.553
933 H ASP 122 H ASP 122 27.695 -10.680 6.595
934 HA ASP 122 HA ASP 122 25.035 -11.500 7.470
935 1HB ASP 122 2HB ASP 122 26.306 -12.600 5.526
936 2HB ASP 122 1HB ASP 122 27.332 -13.331 6.755
937 H GLU 123 H GLU 123 24.743 -12.893 9.284
938 HA GLU 123 HA GLU 123 26.401 -12.063 11.494
939 1HB GLU 123 2HB GLU 123 23.842 -12.226 11.460
940 2HB GLU 123 1HB GLU 123 24.059 -13.963 11.600
941 1HG GLU 123 2HG GLU 123 25.287 -12.081 13.579
942 2HG GLU 123 1HG GLU 123 23.609 -12.598 13.720
943 H LYS 124 H LYS 124 28.305 -13.092 11.637
944 HA LYS 124 HA LYS 124 28.298 -16.032 11.526
945 1HB LYS 124 2HB LYS 124 30.595 -14.203 10.804
946 2HB LYS 124 1HB LYS 124 30.591 -15.957 10.711
947 1HG LYS 124 2HG LYS 124 28.978 -14.055 9.025
948 2HG LYS 124 1HG LYS 124 30.342 -15.048 8.512
949 1HD LYS 124 2HD LYS 124 29.021 -17.065 9.048
950 2HD LYS 124 1HD LYS 124 27.649 -16.030 9.447
951 1HE LYS 124 2HE LYS 124 27.949 -15.064 7.088
952 2HE LYS 124 1HE LYS 124 28.947 -16.486 6.781
953 1HZ LYS 124 1HZ LYS 124 26.102 -16.484 7.639
954 2HZ LYS 124 2HZ LYS 124 27.048 -17.877 7.422
955 3HZ LYS 124 3HZ LYS 124 26.682 -16.885 6.096
956 H SER 125 H SER 125 28.796 -16.972 13.371
957 HA SER 125 HA SER 125 30.667 -15.632 15.191
958 1HB SER 125 2HB SER 125 28.355 -15.441 16.079
959 2HB SER 125 1HB SER 125 28.213 -17.197 16.035
960 HG SER 125 HG SER 125 30.350 -15.994 17.421
961 H LYS 126 H LYS 126 31.995 -17.058 16.431
962 HA LYS 126 HA LYS 126 32.075 -19.808 15.378
963 1HB LYS 126 2HB LYS 126 33.849 -18.397 14.384
964 2HB LYS 126 1HB LYS 126 34.458 -18.056 15.997
965 1HG LYS 126 2HG LYS 126 34.943 -20.435 16.317
966 2HG LYS 126 1HG LYS 126 34.341 -20.768 14.692
967 1HD LYS 126 2HD LYS 126 36.693 -19.008 15.380
968 2HD LYS 126 1HD LYS 126 36.783 -20.645 14.731
969 1HE LYS 126 2HE LYS 126 35.559 -19.869 12.726
970 2HE LYS 126 1HE LYS 126 35.597 -18.230 13.370
971 1HZ LYS 126 1HZ LYS 126 38.052 -18.395 13.378
972 2HZ LYS 126 2HZ LYS 126 37.375 -18.477 11.825
973 3HZ LYS 126 3HZ LYS 126 37.929 -19.892 12.586
974 H SER 127 H SER 127 31.413 -21.024 17.028
975 HA SER 127 HA SER 127 32.636 -20.551 19.657
976 1HB SER 127 2HB SER 127 30.128 -20.363 19.554
977 2HB SER 127 1HB SER 127 30.074 -22.062 19.089
978 HG SER 127 HG SER 127 29.822 -21.536 21.410
979 H LEU 128 H LEU 128 34.382 -21.820 19.741
980 HA LEU 128 HA LEU 128 34.166 -24.577 18.747
981 1HB LEU 128 2HB LEU 128 36.628 -22.931 19.348
982 2HB LEU 128 1HB LEU 128 36.634 -24.579 18.752
983 HG LEU 128 HG LEU 128 35.570 -22.177 17.259
984 1HD1 LEU 128 1HD1 LEU 128 37.992 -22.161 17.436
985 2HD1 LEU 128 2HD1 LEU 128 37.489 -22.534 15.787
986 3HD1 LEU 128 3HD1 LEU 128 38.061 -23.821 16.847
987 1HD2 LEU 128 1HD2 LEU 128 35.857 -25.052 16.396
988 2HD2 LEU 128 2HD2 LEU 128 35.365 -23.706 15.366
989 3HD2 LEU 128 3HD2 LEU 128 34.341 -24.209 16.711
990 H GLU 129 H GLU 129 33.386 -25.739 20.414
991 HA GLU 129 HA GLU 129 34.247 -25.258 23.128
992 1HB GLU 129 2HB GLU 129 32.668 -26.972 23.756
993 2HB GLU 129 1HB GLU 129 31.906 -25.925 22.570
994 1HG GLU 129 2HG GLU 129 32.068 -27.528 20.876
995 2HG GLU 129 1HG GLU 129 33.240 -28.487 21.775
996 H HIS 130 H HIS 130 35.263 -26.828 24.468
997 HA HIS 130 HA HIS 130 36.798 -28.879 23.035
998 1HB HIS 130 2HB HIS 130 38.061 -27.348 24.542
999 2HB HIS 130 1HB HIS 130 37.085 -27.905 25.896
1000 HD1 HIS 130 1HD HIS 130 37.760 -30.102 27.002
1001 HD2 HIS 130 2HD HIS 130 39.874 -29.297 23.509
1002 HE1 HIS 130 1HE HIS 130 39.594 -31.826 26.900
1003 HE2 HIS 130 2HE HIS 130 40.712 -31.445 24.671
1004 H HIS 131 H HIS 131 35.897 -30.845 22.996
1005 HA HIS 131 HA HIS 131 33.552 -31.399 24.480
1006 1HB HIS 131 2HB HIS 131 35.254 -33.000 22.614
1007 2HB HIS 131 1HB HIS 131 34.001 -33.798 23.558
1008 HD1 HIS 131 1HD HIS 131 34.507 -31.468 20.696
1009 HD2 HIS 131 2HD HIS 131 31.356 -33.113 22.855
1010 HE1 HIS 131 1HE HIS 131 32.442 -31.014 19.335
1011 HE2 HIS 131 2HE HIS 131 30.532 -31.807 20.778
1012 H HIS 132 H HIS 132 33.318 -32.105 26.433
1013 HA HIS 132 HA HIS 132 35.406 -33.828 27.577
1014 1HB HIS 132 2HB HIS 132 34.845 -32.882 29.834
1015 2HB HIS 132 1HB HIS 132 35.642 -31.750 28.753
1016 HD1 HIS 132 1HD HIS 132 32.759 -32.085 30.941
1017 HD2 HIS 132 2HD HIS 132 33.737 -29.829 27.579
1018 HE1 HIS 132 1HE HIS 132 31.160 -30.146 30.930
1019 HE2 HIS 132 2HE HIS 132 31.646 -28.905 28.793
1020 H HIS 133 H HIS 133 34.668 -35.770 27.889
1021 HA HIS 133 HA HIS 133 31.839 -36.189 28.563
1022 1HB HIS 133 2HB HIS 133 32.154 -36.469 26.115
1023 2HB HIS 133 1HB HIS 133 33.391 -37.681 26.424
1024 HD1 HIS 133 1HD HIS 133 32.614 -40.042 26.889
1025 HD2 HIS 133 2HD HIS 133 29.509 -37.288 26.694
1026 HE1 HIS 133 1HE HIS 133 30.504 -41.409 26.814
1027 HE2 HIS 133 2HE HIS 133 28.667 -39.718 26.440
1028 H HIS 134 H HIS 134 31.590 -37.665 30.179
1029 HA HIS 134 HA HIS 134 34.029 -38.731 31.337
1030 1HB HIS 134 2HB HIS 134 31.167 -38.717 32.288
1031 2HB HIS 134 1HB HIS 134 32.471 -39.497 33.176
1032 HD1 HIS 134 1HD HIS 134 31.060 -37.352 34.653
1033 HD2 HIS 134 2HD HIS 134 34.270 -36.546 32.129
1034 HE1 HIS 134 1HE HIS 134 31.988 -35.138 35.414
1035 HE2 HIS 134 2HE HIS 134 34.003 -34.728 33.945
1036 H HIS 135 H HIS 135 34.629 -40.808 31.459
1037 HA HIS 135 HA HIS 135 32.960 -42.767 30.045
1038 1HB HIS 135 2HB HIS 135 35.255 -42.396 29.143
1039 2HB HIS 135 1HB HIS 135 35.920 -42.891 30.695
1040 HD1 HIS 135 1HD HIS 135 36.172 -45.373 31.120
1041 HD2 HIS 135 2HD HIS 135 34.021 -44.521 27.662
1042 HE1 HIS 135 1HE HIS 135 35.924 -47.565 29.915
1043 HE2 HIS 135 2HE HIS 135 34.454 -47.058 27.933
Start of MODEL 15
1 1H MET 1 1HT MET 1 -24.662 16.502 -2.955
2 2H MET 1 2HT MET 1 -25.327 18.016 -3.319
3 3H MET 1 3HT MET 1 -24.020 17.898 -2.242
4 HA MET 1 HA MET 1 -23.871 17.054 -5.065
5 1HB MET 1 2HB MET 1 -22.625 19.196 -5.443
6 2HB MET 1 1HB MET 1 -24.340 19.407 -5.123
7 1HG MET 1 2HG MET 1 -23.826 20.020 -2.809
8 2HG MET 1 1HG MET 1 -22.107 19.819 -3.145
9 1HE MET 1 1HE MET 1 -24.922 21.404 -5.455
10 2HE MET 1 2HE MET 1 -24.777 23.102 -5.003
11 3HE MET 1 3HE MET 1 -25.333 21.922 -3.818
12 H ILE 2 H ILE 2 -22.472 15.399 -4.851
13 HA ILE 2 HA ILE 2 -19.950 15.963 -3.431
14 HB ILE 2 HB ILE 2 -21.424 13.318 -3.404
15 1HG1 ILE 2 2HG1 ILE 2 -21.142 13.775 -0.836
16 2HG1 ILE 2 1HG1 ILE 2 -21.007 15.455 -1.339
17 1HG2 ILE 2 1HG2 ILE 2 -18.764 14.045 -2.192
18 2HG2 ILE 2 2HG2 ILE 2 -19.019 13.007 -3.593
19 3HG2 ILE 2 3HG2 ILE 2 -19.602 12.504 -2.007
20 1HD1 ILE 2 1HD1 ILE 2 -23.276 14.933 -0.681
21 2HD1 ILE 2 2HD1 ILE 2 -23.342 13.631 -1.868
22 3HD1 ILE 2 3HD1 ILE 2 -23.207 15.307 -2.404
23 H MET 3 H MET 3 -18.351 15.975 -4.821
24 HA MET 3 HA MET 3 -18.477 14.254 -7.189
25 1HB MET 3 2HB MET 3 -16.656 16.558 -6.463
26 2HB MET 3 1HB MET 3 -16.423 15.555 -7.885
27 1HG MET 3 2HG MET 3 -17.516 17.550 -8.563
28 2HG MET 3 1HG MET 3 -18.680 16.232 -8.664
29 1HE MET 3 1HE MET 3 -20.673 17.926 -8.845
30 2HE MET 3 2HE MET 3 -19.556 19.290 -8.763
31 3HE MET 3 3HE MET 3 -20.966 19.240 -7.706
32 H VAL 4 H VAL 4 -17.318 12.412 -7.257
33 HA VAL 4 HA VAL 4 -15.802 11.703 -4.892
34 HB VAL 4 HB VAL 4 -16.402 9.998 -7.317
35 1HG1 VAL 4 1HG1 VAL 4 -15.511 9.264 -4.527
36 2HG1 VAL 4 2HG1 VAL 4 -14.529 9.173 -5.990
37 3HG1 VAL 4 3HG1 VAL 4 -15.934 8.124 -5.803
38 1HG2 VAL 4 1HG2 VAL 4 -17.887 10.218 -4.696
39 2HG2 VAL 4 2HG2 VAL 4 -18.215 9.041 -5.966
40 3HG2 VAL 4 3HG2 VAL 4 -18.472 10.759 -6.271
41 H SER 5 H SER 5 -15.123 11.123 -8.345
42 HA SER 5 HA SER 5 -12.356 11.956 -7.853
43 1HB SER 5 2HB SER 5 -11.602 9.914 -9.149
44 2HB SER 5 1HB SER 5 -12.231 9.596 -7.533
45 HG SER 5 HG SER 5 -13.874 9.477 -9.832
46 H GLY 6 H GLY 6 -12.044 13.560 -9.236
47 1HA GLY 6 2HA GLY 6 -13.405 13.652 -11.790
48 2HA GLY 6 1HA GLY 6 -12.301 14.860 -11.146
49 H CYS 7 H CYS 7 -12.417 11.624 -12.561
50 HA CYS 7 HA CYS 7 -9.613 11.600 -13.145
51 1HB CYS 7 2HB CYS 7 -11.817 9.814 -14.192
52 2HB CYS 7 1HB CYS 7 -10.088 9.494 -14.295
53 HG CYS 7 HG CYS 7 -11.339 7.859 -12.326
54 H GLN 8 H GLN 8 -8.935 13.120 -14.518
55 HA GLN 8 HA GLN 8 -10.325 13.406 -17.093
56 1HB GLN 8 2HB GLN 8 -10.141 15.501 -15.862
57 2HB GLN 8 1HB GLN 8 -8.406 15.275 -15.684
58 1HG GLN 8 2HG GLN 8 -8.854 16.893 -17.410
59 2HG GLN 8 1HG GLN 8 -8.145 15.442 -18.115
60 1HE2 GLN 8 1HE2 GLN 8 -8.951 15.820 -20.142
61 2HE2 GLN 8 2HE2 GLN 8 -10.630 15.690 -20.533
62 H GLN 9 H GLN 9 -9.284 12.932 -18.950
63 HA GLN 9 HA GLN 9 -6.635 11.717 -18.672
64 1HB GLN 9 2HB GLN 9 -7.159 10.659 -20.881
65 2HB GLN 9 1HB GLN 9 -8.243 10.198 -19.575
66 1HG GLN 9 2HG GLN 9 -9.986 11.546 -20.416
67 2HG GLN 9 1HG GLN 9 -8.906 12.369 -21.542
68 1HE2 GLN 9 1HE2 GLN 9 -10.692 9.469 -20.881
69 2HE2 GLN 9 2HE2 GLN 9 -10.565 8.785 -22.469
70 H GLN 10 H GLN 10 -4.991 13.013 -19.174
71 HA GLN 10 HA GLN 10 -5.224 14.582 -21.642
72 1HB GLN 10 2HB GLN 10 -3.524 15.049 -19.196
73 2HB GLN 10 1HB GLN 10 -3.231 15.859 -20.722
74 1HG GLN 10 2HG GLN 10 -5.719 16.054 -19.041
75 2HG GLN 10 1HG GLN 10 -4.472 17.286 -19.222
76 1HE2 GLN 10 1HE2 GLN 10 -7.277 17.539 -19.750
77 2HE2 GLN 10 2HE2 GLN 10 -7.446 17.922 -21.432
78 H LYS 11 H LYS 11 -2.472 13.353 -19.747
79 HA LYS 11 HA LYS 11 -1.699 11.383 -21.635
80 1HB LYS 11 2HB LYS 11 -1.179 13.544 -22.864
81 2HB LYS 11 1HB LYS 11 0.006 13.883 -21.613
82 1HG LYS 11 2HG LYS 11 1.366 12.069 -22.270
83 2HG LYS 11 1HG LYS 11 0.091 11.389 -23.285
84 1HD LYS 11 2HD LYS 11 1.488 14.024 -23.759
85 2HD LYS 11 1HD LYS 11 1.822 12.517 -24.616
86 1HE LYS 11 2HE LYS 11 -0.419 12.480 -25.514
87 2HE LYS 11 1HE LYS 11 -0.861 13.897 -24.565
88 1HZ LYS 11 1HZ LYS 11 -0.419 14.528 -26.818
89 2HZ LYS 11 2HZ LYS 11 1.112 13.797 -26.783
90 3HZ LYS 11 3HZ LYS 11 0.802 15.167 -25.830
91 H GLU 12 H GLU 12 0.490 10.467 -21.029
92 HA GLU 12 HA GLU 12 0.647 10.064 -18.260
93 1HB GLU 12 2HB GLU 12 1.502 8.461 -19.933
94 2HB GLU 12 1HB GLU 12 2.797 9.580 -20.333
95 1HG GLU 12 2HG GLU 12 3.433 9.422 -17.855
96 2HG GLU 12 1HG GLU 12 2.381 8.009 -17.819
97 H GLU 13 H GLU 13 1.215 11.516 -16.804
98 HA GLU 13 HA GLU 13 3.498 13.282 -17.322
99 1HB GLU 13 2HB GLU 13 1.389 14.388 -16.639
100 2HB GLU 13 1HB GLU 13 1.347 13.409 -15.182
101 1HG GLU 13 2HG GLU 13 2.113 15.718 -14.796
102 2HG GLU 13 1HG GLU 13 3.299 14.504 -14.323
103 H THR 14 H THR 14 4.889 13.586 -15.299
104 HA THR 14 HA THR 14 6.091 11.170 -14.665
105 HB THR 14 HB THR 14 7.290 13.278 -14.480
106 HG1 THR 14 1HG THR 14 7.137 12.040 -11.919
107 1HG2 THR 14 1HG2 THR 14 5.552 13.831 -12.075
108 2HG2 THR 14 2HG2 THR 14 5.510 14.701 -13.608
109 3HG2 THR 14 3HG2 THR 14 6.942 14.791 -12.582
110 HA PRO 15 HA PRO 15 3.201 9.483 -11.713
111 1HB PRO 15 2HB PRO 15 5.430 7.596 -11.243
112 2HB PRO 15 1HB PRO 15 3.760 7.270 -11.713
113 1HG PRO 15 2HG PRO 15 5.741 7.005 -13.474
114 2HG PRO 15 1HG PRO 15 4.170 7.676 -13.959
115 1HD PRO 15 2HD PRO 15 6.737 9.108 -13.353
116 2HD PRO 15 1HD PRO 15 5.574 9.390 -14.668
117 H PHE 16 H PHE 16 3.098 10.845 -10.041
118 HA PHE 16 HA PHE 16 5.308 11.655 -8.461
119 1HB PHE 16 2HB PHE 16 3.547 12.719 -7.030
120 2HB PHE 16 1HB PHE 16 3.444 13.147 -8.734
121 HD1 PHE 16 2HD PHE 16 1.611 12.357 -10.108
122 HD2 PHE 16 1HD PHE 16 1.851 11.349 -5.981
123 HE1 PHE 16 2HE PHE 16 -0.736 11.618 -10.157
124 HE2 PHE 16 1HE PHE 16 -0.492 10.602 -6.020
125 HZ PHE 16 HZ PHE 16 -1.790 10.728 -8.111
126 H TYR 17 H TYR 17 3.553 8.788 -8.392
127 HA TYR 17 HA TYR 17 3.583 8.510 -5.511
128 1HB TYR 17 2HB TYR 17 2.308 6.502 -5.855
129 2HB TYR 17 1HB TYR 17 1.631 7.766 -6.864
130 HD1 TYR 17 2HD TYR 17 1.918 7.681 -9.316
131 HD2 TYR 17 1HD TYR 17 3.299 4.547 -6.795
132 HE1 TYR 17 2HE TYR 17 2.111 6.199 -11.269
133 HE2 TYR 17 1HE TYR 17 3.485 3.055 -8.736
134 HH TYR 17 HH TYR 17 2.647 2.816 -10.958
135 H TYR 18 H TYR 18 5.804 7.975 -7.950
136 HA TYR 18 HA TYR 18 6.860 5.480 -7.085
137 1HB TYR 18 2HB TYR 18 7.836 7.652 -8.895
138 2HB TYR 18 1HB TYR 18 8.939 6.391 -8.374
139 HD1 TYR 18 2HD TYR 18 6.704 4.205 -8.323
140 HD2 TYR 18 1HD TYR 18 7.956 7.052 -11.230
141 HE1 TYR 18 2HE TYR 18 5.874 2.737 -10.110
142 HE2 TYR 18 1HE TYR 18 7.128 5.588 -13.025
143 HH TYR 18 HH TYR 18 5.094 2.945 -12.442
144 H GLY 19 H GLY 19 8.479 5.020 -5.703
145 1HA GLY 19 2HA GLY 19 10.515 5.956 -4.559
146 2HA GLY 19 1HA GLY 19 9.449 7.256 -4.043
147 H THR 20 H THR 20 10.201 6.590 -1.890
148 HA THR 20 HA THR 20 8.683 4.269 -0.898
149 HB THR 20 HB THR 20 11.180 5.506 0.283
150 HG1 THR 20 1HG THR 20 10.821 2.956 -0.958
151 1HG2 THR 20 1HG2 THR 20 11.159 3.576 1.802
152 2HG2 THR 20 2HG2 THR 20 9.621 3.054 1.113
153 3HG2 THR 20 3HG2 THR 20 9.719 4.573 2.003
154 H TRP 21 H TRP 21 7.031 4.713 0.380
155 HA TRP 21 HA TRP 21 6.913 7.362 1.673
156 1HB TRP 21 2HB TRP 21 4.580 5.654 0.781
157 2HB TRP 21 1HB TRP 21 4.512 7.304 1.393
158 HD1 TRP 21 HD TRP 21 5.384 5.303 -1.741
159 HE1 TRP 21 1HE TRP 21 5.521 6.908 -3.749
160 HE3 TRP 21 3HE TRP 21 4.987 9.743 0.756
161 HZ2 TRP 21 2HZ TRP 21 5.472 9.699 -4.207
162 HZ3 TRP 21 3HZ TRP 21 5.040 11.834 -0.540
163 HH2 TRP 21 HH TRP 21 5.277 11.810 -2.969
164 H ASP 22 H ASP 22 6.568 7.422 3.821
165 HA ASP 22 HA ASP 22 6.103 4.845 5.174
166 1HB ASP 22 2HB ASP 22 8.228 5.725 5.822
167 2HB ASP 22 1HB ASP 22 7.550 7.323 6.108
168 H GLU 23 H GLU 23 4.353 4.582 6.349
169 HA GLU 23 HA GLU 23 2.376 6.619 6.615
170 1HB GLU 23 2HB GLU 23 2.690 3.766 7.298
171 2HB GLU 23 1HB GLU 23 1.628 4.669 8.370
172 1HG GLU 23 2HG GLU 23 1.295 4.830 5.405
173 2HG GLU 23 1HG GLU 23 0.640 3.476 6.324
174 H GLY 24 H GLY 24 4.449 4.876 8.954
175 1HA GLY 24 2HA GLY 24 4.786 5.230 11.208
176 2HA GLY 24 1HA GLY 24 4.817 6.939 10.781
177 H ARG 25 H ARG 25 2.126 4.730 10.373
178 HA ARG 25 HA ARG 25 0.494 6.007 12.367
179 1HB ARG 25 2HB ARG 25 0.789 7.537 10.253
180 2HB ARG 25 1HB ARG 25 -0.292 6.390 9.484
181 1HG ARG 25 2HG ARG 25 -2.027 6.896 11.102
182 2HG ARG 25 1HG ARG 25 -0.932 7.995 11.947
183 1HD ARG 25 2HD ARG 25 -2.026 8.277 9.157
184 2HD ARG 25 1HD ARG 25 -2.331 9.327 10.541
185 HE ARG 25 HE ARG 25 0.438 9.100 9.672
186 1HH1 ARG 25 1HH1 ARG 25 -2.537 10.946 9.546
187 2HH1 ARG 25 2HH1 ARG 25 -1.759 12.416 9.044
188 1HH2 ARG 25 1HH2 ARG 25 1.477 11.017 8.997
189 2HH2 ARG 25 2HH2 ARG 25 0.530 12.456 8.720
190 H ALA 26 H ALA 26 -1.772 5.141 12.151
191 HA ALA 26 HA ALA 26 -3.315 3.495 11.879
192 1HB ALA 26 1HB ALA 26 -3.280 2.138 9.876
193 2HB ALA 26 2HB ALA 26 -1.617 2.622 9.552
194 3HB ALA 26 3HB ALA 26 -2.912 3.819 9.484
195 HA PRO 27 HA PRO 27 -1.633 -0.234 13.723
196 1HB PRO 27 2HB PRO 27 -3.784 -1.885 12.727
197 2HB PRO 27 1HB PRO 27 -3.536 -1.275 14.363
198 1HG PRO 27 2HG PRO 27 -5.574 -0.468 12.716
199 2HG PRO 27 1HG PRO 27 -4.916 0.515 14.037
200 1HD PRO 27 2HD PRO 27 -4.378 0.673 11.098
201 2HD PRO 27 1HD PRO 27 -4.558 1.986 12.283
202 H GLY 28 H GLY 28 -0.156 -1.695 13.044
203 1HA GLY 28 2HA GLY 28 -0.200 -2.430 10.193
204 2HA GLY 28 1HA GLY 28 1.243 -2.341 11.190
205 HA PRO 29 HA PRO 29 0.111 -6.880 10.747
206 1HB PRO 29 2HB PRO 29 3.061 -6.813 11.144
207 2HB PRO 29 1HB PRO 29 2.094 -7.804 10.048
208 1HG PRO 29 2HG PRO 29 3.516 -5.685 9.187
209 2HG PRO 29 1HG PRO 29 1.980 -6.164 8.448
210 1HD PRO 29 2HD PRO 29 2.581 -3.847 10.198
211 2HD PRO 29 1HD PRO 29 1.301 -4.054 8.988
212 H THR 30 H THR 30 -0.475 -7.899 12.534
213 HA THR 30 HA THR 30 0.198 -6.763 15.101
214 HB THR 30 HB THR 30 -2.100 -7.505 14.442
215 HG1 THR 30 1HG THR 30 -0.795 -8.033 16.806
216 1HG2 THR 30 1HG2 THR 30 -2.657 -9.885 14.646
217 2HG2 THR 30 2HG2 THR 30 -0.944 -10.261 14.831
218 3HG2 THR 30 3HG2 THR 30 -1.538 -9.578 13.317
219 H ASP 31 H ASP 31 1.664 -8.938 13.164
220 HA ASP 31 HA ASP 31 2.494 -11.013 14.863
221 1HB ASP 31 2HB ASP 31 4.086 -9.730 12.631
222 2HB ASP 31 1HB ASP 31 4.336 -11.337 13.304
223 H GLY 32 H GLY 32 3.622 -7.740 14.453
224 1HA GLY 32 2HA GLY 32 4.573 -7.072 16.808
225 2HA GLY 32 1HA GLY 32 5.852 -8.165 16.302
226 H VAL 33 H VAL 33 4.018 -5.930 14.291
227 HA VAL 33 HA VAL 33 6.562 -4.657 13.542
228 HB VAL 33 HB VAL 33 3.953 -4.726 12.016
229 1HG1 VAL 33 1HG1 VAL 33 5.256 -3.881 10.137
230 2HG1 VAL 33 2HG1 VAL 33 6.677 -3.766 11.174
231 3HG1 VAL 33 3HG1 VAL 33 5.268 -2.752 11.491
232 1HG2 VAL 33 1HG2 VAL 33 4.965 -6.936 12.154
233 2HG2 VAL 33 2HG2 VAL 33 6.498 -6.279 11.582
234 3HG2 VAL 33 3HG2 VAL 33 5.092 -6.293 10.516
235 H LYS 34 H LYS 34 6.795 -2.455 13.642
236 HA LYS 34 HA LYS 34 4.950 -1.117 15.422
237 1HB LYS 34 2HB LYS 34 7.540 -0.137 14.219
238 2HB LYS 34 1HB LYS 34 6.665 0.603 15.546
239 1HG LYS 34 2HG LYS 34 7.057 -1.448 16.886
240 2HG LYS 34 1HG LYS 34 8.036 -2.069 15.558
241 1HD LYS 34 2HD LYS 34 9.501 -1.099 17.190
242 2HD LYS 34 1HD LYS 34 9.489 -0.063 15.760
243 1HE LYS 34 2HE LYS 34 9.373 1.316 17.732
244 2HE LYS 34 1HE LYS 34 7.831 1.394 16.883
245 1HZ LYS 34 1HZ LYS 34 8.392 -0.319 19.247
246 2HZ LYS 34 2HZ LYS 34 6.894 -0.150 18.464
247 3HZ LYS 34 3HZ LYS 34 7.575 1.168 19.291
248 H SER 35 H SER 35 5.839 -1.099 12.094
249 HA SER 35 HA SER 35 3.640 0.373 11.216
250 1HB SER 35 2HB SER 35 4.968 2.403 10.347
251 2HB SER 35 1HB SER 35 4.547 2.390 12.056
252 HG SER 35 HG SER 35 6.898 2.780 11.138
253 H ALA 36 H ALA 36 3.919 1.005 8.853
254 HA ALA 36 HA ALA 36 5.746 -0.918 7.580
255 1HB ALA 36 1HB ALA 36 2.919 -0.307 6.730
256 2HB ALA 36 2HB ALA 36 3.454 -1.772 7.555
257 3HB ALA 36 3HB ALA 36 4.033 -1.414 5.928
258 H THR 37 H THR 37 6.709 -0.322 5.707
259 HA THR 37 HA THR 37 6.250 2.439 4.773
260 HB THR 37 HB THR 37 8.651 2.318 3.950
261 HG1 THR 37 1HG THR 37 9.947 0.713 5.152
262 1HG2 THR 37 1HG2 THR 37 8.216 2.113 6.933
263 2HG2 THR 37 2HG2 THR 37 8.077 3.577 5.960
264 3HG2 THR 37 3HG2 THR 37 9.644 2.790 6.150
265 H VAL 38 H VAL 38 5.841 2.683 2.602
266 HA VAL 38 HA VAL 38 5.748 0.166 1.071
267 HB VAL 38 HB VAL 38 3.520 1.090 1.585
268 1HG1 VAL 38 1HG1 VAL 38 4.405 3.450 -0.065
269 2HG1 VAL 38 2HG1 VAL 38 4.065 3.450 1.666
270 3HG1 VAL 38 3HG1 VAL 38 2.765 3.155 0.512
271 1HG2 VAL 38 1HG2 VAL 38 4.246 1.204 -1.339
272 2HG2 VAL 38 2HG2 VAL 38 2.617 1.009 -0.688
273 3HG2 VAL 38 3HG2 VAL 38 3.830 -0.245 -0.423
274 H THR 39 H THR 39 6.698 0.053 -0.856
275 HA THR 39 HA THR 39 7.696 2.546 -2.072
276 HB THR 39 HB THR 39 9.042 -0.170 -2.143
277 HG1 THR 39 1HG THR 39 9.125 1.150 -0.123
278 1HG2 THR 39 1HG2 THR 39 10.893 1.023 -3.216
279 2HG2 THR 39 2HG2 THR 39 9.941 2.509 -3.207
280 3HG2 THR 39 3HG2 THR 39 9.420 1.132 -4.178
281 H PHE 40 H PHE 40 7.104 2.866 -4.152
282 HA PHE 40 HA PHE 40 5.455 0.764 -5.348
283 1HB PHE 40 2HB PHE 40 5.594 3.735 -5.843
284 2HB PHE 40 1HB PHE 40 4.649 2.634 -6.838
285 HD1 PHE 40 1HD PHE 40 2.692 1.491 -5.907
286 HD2 PHE 40 2HD PHE 40 4.866 4.373 -3.655
287 HE1 PHE 40 1HE PHE 40 0.806 1.682 -4.340
288 HE2 PHE 40 2HE PHE 40 2.982 4.573 -2.085
289 HZ PHE 40 HZ PHE 40 0.949 3.227 -2.426
290 H THR 41 H THR 41 6.214 -0.385 -6.929
291 HA THR 41 HA THR 41 8.681 0.451 -8.266
292 HB THR 41 HB THR 41 7.407 -2.237 -8.672
293 HG1 THR 41 1HG THR 41 7.920 -1.230 -6.265
294 1HG2 THR 41 1HG2 THR 41 9.454 -1.879 -9.871
295 2HG2 THR 41 2HG2 THR 41 9.826 -2.939 -8.516
296 3HG2 THR 41 3HG2 THR 41 10.246 -1.229 -8.440
297 H GLU 42 H GLU 42 8.637 -0.596 -10.670
298 HA GLU 42 HA GLU 42 7.249 1.160 -12.230
299 1HB GLU 42 2HB GLU 42 8.152 -1.589 -13.075
300 2HB GLU 42 1HB GLU 42 7.999 -0.161 -14.078
301 1HG GLU 42 2HG GLU 42 9.790 0.924 -12.791
302 2HG GLU 42 1HG GLU 42 9.973 -0.551 -11.848
303 H ASP 43 H ASP 43 6.313 -2.139 -11.299
304 HA ASP 43 HA ASP 43 3.552 -1.412 -11.842
305 1HB ASP 43 2HB ASP 43 3.064 -3.266 -13.287
306 2HB ASP 43 1HB ASP 43 4.407 -2.367 -13.978
307 H GLU 44 H GLU 44 5.392 -2.242 -9.577
308 HA GLU 44 HA GLU 44 3.646 -4.335 -8.474
309 1HB GLU 44 2HB GLU 44 6.653 -4.165 -8.239
310 2HB GLU 44 1HB GLU 44 5.646 -5.241 -7.282
311 1HG GLU 44 2HG GLU 44 4.972 -6.458 -9.215
312 2HG GLU 44 1HG GLU 44 5.740 -5.285 -10.283
313 H VAL 45 H VAL 45 3.182 -4.179 -6.295
314 HA VAL 45 HA VAL 45 4.040 -1.700 -4.957
315 HB VAL 45 HB VAL 45 1.825 -3.623 -4.198
316 1HG1 VAL 45 1HG1 VAL 45 2.553 -0.932 -3.046
317 2HG1 VAL 45 2HG1 VAL 45 2.750 -2.496 -2.254
318 3HG1 VAL 45 3HG1 VAL 45 1.135 -1.889 -2.612
319 1HG2 VAL 45 1HG2 VAL 45 0.295 -1.872 -4.923
320 2HG2 VAL 45 2HG2 VAL 45 1.327 -2.400 -6.252
321 3HG2 VAL 45 3HG2 VAL 45 1.659 -0.876 -5.428
322 H VAL 46 H VAL 46 5.666 -1.863 -3.580
323 HA VAL 46 HA VAL 46 6.219 -4.467 -2.320
324 HB VAL 46 HB VAL 46 8.084 -2.124 -2.729
325 1HG1 VAL 46 1HG1 VAL 46 8.613 -4.876 -1.617
326 2HG1 VAL 46 2HG1 VAL 46 8.638 -3.359 -0.719
327 3HG1 VAL 46 3HG1 VAL 46 9.844 -3.659 -1.969
328 1HG2 VAL 46 1HG2 VAL 46 7.541 -3.250 -4.824
329 2HG2 VAL 46 2HG2 VAL 46 7.989 -4.801 -4.116
330 3HG2 VAL 46 3HG2 VAL 46 9.216 -3.557 -4.360
331 H GLU 47 H GLU 47 5.811 -4.639 -0.209
332 HA GLU 47 HA GLU 47 5.770 -2.168 1.380
333 1HB GLU 47 2HB GLU 47 3.785 -4.160 1.114
334 2HB GLU 47 1HB GLU 47 4.423 -4.283 2.742
335 1HG GLU 47 2HG GLU 47 4.023 -1.844 3.011
336 2HG GLU 47 1HG GLU 47 3.229 -1.849 1.437
337 H THR 48 H THR 48 6.932 -2.061 3.150
338 HA THR 48 HA THR 48 8.478 -4.436 3.944
339 HB THR 48 HB THR 48 9.822 -2.209 4.953
340 HG1 THR 48 1HG THR 48 8.863 -0.741 3.618
341 1HG2 THR 48 1HG2 THR 48 10.845 -4.248 4.087
342 2HG2 THR 48 2HG2 THR 48 11.557 -2.819 3.340
343 3HG2 THR 48 3HG2 THR 48 10.388 -3.793 2.448
344 H GLU 49 H GLU 49 8.465 -5.004 6.052
345 HA GLU 49 HA GLU 49 6.702 -3.480 7.828
346 1HB GLU 49 2HB GLU 49 7.999 -6.158 8.328
347 2HB GLU 49 1HB GLU 49 6.698 -5.431 9.248
348 1HG GLU 49 2HG GLU 49 5.165 -5.726 7.436
349 2HG GLU 49 1HG GLU 49 6.461 -6.282 6.377
350 H VAL 50 H VAL 50 7.581 -2.171 9.302
351 HA VAL 50 HA VAL 50 10.414 -2.435 9.936
352 HB VAL 50 HB VAL 50 8.418 -0.402 10.967
353 1HG1 VAL 50 1HG1 VAL 50 10.362 -0.684 12.419
354 2HG1 VAL 50 2HG1 VAL 50 10.397 0.885 11.617
355 3HG1 VAL 50 3HG1 VAL 50 11.437 -0.418 11.045
356 1HG2 VAL 50 1HG2 VAL 50 9.427 1.153 9.360
357 2HG2 VAL 50 2HG2 VAL 50 8.653 -0.209 8.551
358 3HG2 VAL 50 3HG2 VAL 50 10.408 -0.159 8.711
359 H MET 51 H MET 51 10.928 -3.852 11.433
360 HA MET 51 HA MET 51 8.944 -4.413 13.533
361 1HB MET 51 2HB MET 51 9.520 -6.250 11.869
362 2HB MET 51 1HB MET 51 11.112 -6.290 12.613
363 1HG MET 51 2HG MET 51 10.127 -6.870 14.752
364 2HG MET 51 1HG MET 51 8.513 -6.772 14.049
365 1HE MET 51 1HE MET 51 8.994 -8.069 11.169
366 2HE MET 51 2HE MET 51 7.603 -8.472 12.177
367 3HE MET 51 3HE MET 51 8.591 -9.757 11.483
368 H GLU 52 H GLU 52 9.518 -4.366 15.581
369 HA GLU 52 HA GLU 52 11.652 -2.698 16.322
370 1HB GLU 52 2HB GLU 52 9.431 -3.004 17.477
371 2HB GLU 52 1HB GLU 52 10.043 -4.522 18.110
372 1HG GLU 52 2HG GLU 52 11.652 -3.435 19.438
373 2HG GLU 52 1HG GLU 52 11.424 -1.903 18.593
374 H GLY 53 H GLY 53 13.730 -3.252 16.305
375 1HA GLY 53 2HA GLY 53 15.534 -4.382 17.370
376 2HA GLY 53 1HA GLY 53 14.494 -5.779 17.598
377 H ARG 54 H ARG 54 13.647 -5.292 14.644
378 HA ARG 54 HA ARG 54 15.822 -6.941 13.565
379 1HB ARG 54 2HB ARG 54 13.246 -6.489 12.125
380 2HB ARG 54 1HB ARG 54 14.293 -7.895 12.126
381 1HG ARG 54 2HG ARG 54 12.748 -7.093 14.552
382 2HG ARG 54 1HG ARG 54 12.037 -8.066 13.276
383 1HD ARG 54 2HD ARG 54 13.908 -9.694 13.581
384 2HD ARG 54 1HD ARG 54 14.413 -8.752 14.988
385 HE ARG 54 HE ARG 54 11.704 -9.893 14.812
386 1HH1 ARG 54 1HH1 ARG 54 14.775 -9.605 16.438
387 2HH1 ARG 54 2HH1 ARG 54 14.222 -10.344 17.908
388 1HH2 ARG 54 1HH2 ARG 54 10.946 -10.868 16.723
389 2HH2 ARG 54 2HH2 ARG 54 12.032 -11.060 18.076
390 H GLY 55 H GLY 55 13.496 -4.708 12.106
391 1HA GLY 55 2HA GLY 55 14.715 -2.657 11.051
392 2HA GLY 55 1HA GLY 55 15.529 -3.934 10.149
393 H GLU 56 H GLU 56 14.577 -2.996 8.204
394 HA GLU 56 HA GLU 56 11.709 -3.390 7.916
395 1HB GLU 56 2HB GLU 56 13.801 -2.268 6.047
396 2HB GLU 56 1HB GLU 56 12.099 -2.424 5.649
397 1HG GLU 56 2HG GLU 56 11.530 -0.949 7.505
398 2HG GLU 56 1HG GLU 56 13.236 -0.786 7.890
399 H VAL 57 H VAL 57 10.900 -5.180 7.263
400 HA VAL 57 HA VAL 57 12.520 -7.040 5.647
401 HB VAL 57 HB VAL 57 10.231 -7.571 7.549
402 1HG1 VAL 57 1HG1 VAL 57 10.079 -9.081 5.633
403 2HG1 VAL 57 2HG1 VAL 57 10.595 -9.963 7.072
404 3HG1 VAL 57 3HG1 VAL 57 11.773 -9.529 5.833
405 1HG2 VAL 57 1HG2 VAL 57 12.329 -7.145 8.675
406 2HG2 VAL 57 2HG2 VAL 57 13.146 -8.332 7.660
407 3HG2 VAL 57 3HG2 VAL 57 11.912 -8.853 8.808
408 H GLN 58 H GLN 58 11.812 -7.497 3.624
409 HA GLN 58 HA GLN 58 9.537 -6.053 2.629
410 1HB GLN 58 2HB GLN 58 11.432 -7.951 1.239
411 2HB GLN 58 1HB GLN 58 10.259 -6.913 0.452
412 1HG GLN 58 2HG GLN 58 11.436 -4.953 1.451
413 2HG GLN 58 1HG GLN 58 12.686 -6.068 2.000
414 1HE2 GLN 58 1HE2 GLN 58 12.895 -3.832 0.176
415 2HE2 GLN 58 2HE2 GLN 58 13.493 -4.482 -1.316
416 H LEU 59 H LEU 59 7.577 -6.787 2.228
417 HA LEU 59 HA LEU 59 6.909 -9.569 2.749
418 1HB LEU 59 2HB LEU 59 5.282 -7.104 2.156
419 2HB LEU 59 1HB LEU 59 4.558 -8.697 2.248
420 HG LEU 59 HG LEU 59 6.053 -7.364 4.504
421 1HD1 LEU 59 1HD1 LEU 59 3.092 -7.705 4.049
422 2HD1 LEU 59 2HD1 LEU 59 3.984 -6.185 4.008
423 3HD1 LEU 59 3HD1 LEU 59 3.840 -7.082 5.519
424 1HD2 LEU 59 1HD2 LEU 59 5.125 -9.167 5.854
425 2HD2 LEU 59 2HD2 LEU 59 6.131 -9.807 4.553
426 3HD2 LEU 59 3HD2 LEU 59 4.373 -9.866 4.422
427 HA PRO 60 HA PRO 60 6.437 -11.085 -1.435
428 1HB PRO 60 2HB PRO 60 3.543 -11.431 -0.796
429 2HB PRO 60 1HB PRO 60 4.684 -12.586 -1.492
430 1HG PRO 60 2HG PRO 60 3.947 -12.784 1.052
431 2HG PRO 60 1HG PRO 60 5.622 -13.099 0.561
432 1HD PRO 60 2HD PRO 60 4.464 -10.725 1.949
433 2HD PRO 60 1HD PRO 60 6.062 -11.477 2.138
434 H PHE 61 H PHE 61 6.335 -9.864 -3.183
435 HA PHE 61 HA PHE 61 5.178 -7.283 -3.107
436 1HB PHE 61 2HB PHE 61 6.188 -8.677 -5.584
437 2HB PHE 61 1HB PHE 61 6.189 -6.951 -5.227
438 HD1 PHE 61 2HD PHE 61 7.557 -6.301 -3.046
439 HD2 PHE 61 1HD PHE 61 8.161 -9.827 -5.356
440 HE1 PHE 61 2HE PHE 61 9.837 -6.501 -2.141
441 HE2 PHE 61 1HE PHE 61 10.441 -10.031 -4.457
442 HZ PHE 61 HZ PHE 61 11.283 -8.369 -2.847
443 H MET 62 H MET 62 3.441 -6.436 -4.157
444 HA MET 62 HA MET 62 1.533 -8.388 -5.271
445 1HB MET 62 2HB MET 62 1.078 -5.765 -3.852
446 2HB MET 62 1HB MET 62 -0.190 -6.599 -4.736
447 1HG MET 62 2HG MET 62 0.058 -8.534 -3.265
448 2HG MET 62 1HG MET 62 1.329 -7.692 -2.377
449 1HE MET 62 1HE MET 62 -0.657 -4.690 -0.808
450 2HE MET 62 2HE MET 62 0.179 -4.695 -2.357
451 3HE MET 62 3HE MET 62 0.920 -5.474 -0.959
452 H ALA 63 H ALA 63 1.129 -8.254 -7.395
453 HA ALA 63 HA ALA 63 2.112 -6.011 -8.926
454 1HB ALA 63 1HB ALA 63 1.363 -7.286 -10.875
455 2HB ALA 63 2HB ALA 63 0.575 -8.452 -9.812
456 3HB ALA 63 3HB ALA 63 2.332 -8.290 -9.796
457 H TYR 64 H TYR 64 0.888 -4.464 -9.949
458 HA TYR 64 HA TYR 64 -2.016 -4.542 -9.511
459 1HB TYR 64 2HB TYR 64 -2.082 -2.251 -8.792
460 2HB TYR 64 1HB TYR 64 -0.906 -3.088 -7.788
461 HD1 TYR 64 2HD TYR 64 1.499 -2.628 -8.050
462 HD2 TYR 64 1HD TYR 64 -1.414 -0.502 -10.303
463 HE1 TYR 64 2HE TYR 64 3.181 -0.930 -8.617
464 HE2 TYR 64 1HE TYR 64 0.264 1.199 -10.882
465 HH TYR 64 HH TYR 64 3.630 0.763 -10.209
466 H LYS 65 H LYS 65 -3.123 -2.808 -10.811
467 HA LYS 65 HA LYS 65 -1.688 -1.968 -13.212
468 1HB LYS 65 2HB LYS 65 -3.458 -2.782 -14.695
469 2HB LYS 65 1HB LYS 65 -2.720 -4.115 -13.820
470 1HG LYS 65 2HG LYS 65 -4.692 -3.742 -12.159
471 2HG LYS 65 1HG LYS 65 -5.444 -2.945 -13.540
472 1HD LYS 65 2HD LYS 65 -4.326 -5.746 -13.569
473 2HD LYS 65 1HD LYS 65 -6.029 -5.347 -13.353
474 1HE LYS 65 2HE LYS 65 -4.426 -4.504 -15.756
475 2HE LYS 65 1HE LYS 65 -5.341 -6.007 -15.686
476 1HZ LYS 65 1HZ LYS 65 -7.345 -4.672 -15.241
477 2HZ LYS 65 2HZ LYS 65 -6.648 -4.325 -16.748
478 3HZ LYS 65 3HZ LYS 65 -6.433 -3.253 -15.456
479 H VAL 66 H VAL 66 -2.463 -0.120 -14.099
480 HA VAL 66 HA VAL 66 -4.055 1.527 -12.334
481 HB VAL 66 HB VAL 66 -2.630 2.136 -14.924
482 1HG1 VAL 66 1HG1 VAL 66 -4.508 3.658 -14.654
483 2HG1 VAL 66 2HG1 VAL 66 -2.988 4.510 -14.377
484 3HG1 VAL 66 3HG1 VAL 66 -3.995 4.032 -13.010
485 1HG2 VAL 66 1HG2 VAL 66 -1.931 2.794 -12.062
486 2HG2 VAL 66 2HG2 VAL 66 -1.036 3.327 -13.486
487 3HG2 VAL 66 3HG2 VAL 66 -1.125 1.610 -13.092
488 H ILE 67 H ILE 67 -6.158 1.855 -12.534
489 HA ILE 67 HA ILE 67 -7.589 0.871 -14.864
490 HB ILE 67 HB ILE 67 -8.819 2.383 -12.576
491 1HG1 ILE 67 2HG1 ILE 67 -8.268 -0.591 -12.643
492 2HG1 ILE 67 1HG1 ILE 67 -7.466 0.570 -11.591
493 1HG2 ILE 67 1HG2 ILE 67 -10.790 1.039 -13.132
494 2HG2 ILE 67 2HG2 ILE 67 -9.883 0.259 -14.429
495 3HG2 ILE 67 3HG2 ILE 67 -10.227 1.986 -14.509
496 1HD1 ILE 67 1HD1 ILE 67 -9.681 1.101 -10.599
497 2HD1 ILE 67 2HD1 ILE 67 -9.155 -0.558 -10.337
498 3HD1 ILE 67 3HD1 ILE 67 -10.371 -0.204 -11.562
499 H SER 68 H SER 68 -7.241 3.898 -13.082
500 HA SER 68 HA SER 68 -7.831 5.420 -15.508
501 1HB SER 68 2HB SER 68 -9.157 6.081 -12.877
502 2HB SER 68 1HB SER 68 -9.529 6.727 -14.472
503 HG SER 68 HG SER 68 -10.416 4.435 -13.254
504 H GLN 69 H GLN 69 -7.296 7.733 -15.208
505 HA GLN 69 HA GLN 69 -5.482 8.332 -13.013
506 1HB GLN 69 2HB GLN 69 -4.048 7.413 -14.809
507 2HB GLN 69 1HB GLN 69 -4.682 8.617 -15.920
508 1HG GLN 69 2HG GLN 69 -3.755 10.385 -14.452
509 2HG GLN 69 1HG GLN 69 -3.023 9.125 -13.463
510 1HE2 GLN 69 1HE2 GLN 69 -3.278 8.948 -16.955
511 2HE2 GLN 69 2HE2 GLN 69 -1.584 9.102 -17.263
512 H SER 70 H SER 70 -5.268 10.519 -12.605
513 HA SER 70 HA SER 70 -6.925 12.318 -14.241
514 1HB SER 70 2HB SER 70 -8.017 11.866 -12.074
515 2HB SER 70 1HB SER 70 -6.560 12.378 -11.232
516 HG SER 70 HG SER 70 -8.571 13.888 -12.052
517 H THR 71 H THR 71 -5.715 13.834 -15.171
518 HA THR 71 HA THR 71 -3.020 14.330 -14.427
519 HB THR 71 HB THR 71 -3.541 16.429 -15.990
520 HG1 THR 71 1HG THR 71 -5.732 16.160 -16.228
521 1HG2 THR 71 1HG2 THR 71 -1.975 14.606 -16.479
522 2HG2 THR 71 2HG2 THR 71 -2.933 15.020 -17.900
523 3HG2 THR 71 3HG2 THR 71 -3.323 13.576 -16.966
524 H ASP 72 H ASP 72 -5.910 15.375 -13.098
525 HA ASP 72 HA ASP 72 -5.119 17.879 -12.055
526 1HB ASP 72 2HB ASP 72 -7.449 17.199 -11.919
527 2HB ASP 72 1HB ASP 72 -7.013 15.801 -10.944
528 H GLY 73 H GLY 73 -4.914 14.583 -10.791
529 1HA GLY 73 2HA GLY 73 -2.432 14.389 -9.942
530 2HA GLY 73 1HA GLY 73 -3.044 15.507 -8.733
531 H SER 74 H SER 74 -4.606 12.700 -10.226
532 HA SER 74 HA SER 74 -4.278 11.181 -7.778
533 1HB SER 74 2HB SER 74 -6.971 11.761 -9.017
534 2HB SER 74 1HB SER 74 -6.670 10.651 -7.699
535 HG SER 74 HG SER 74 -5.593 13.044 -7.144
536 H ILE 75 H ILE 75 -4.632 8.936 -8.068
537 HA ILE 75 HA ILE 75 -4.828 8.022 -10.853
538 HB ILE 75 HB ILE 75 -2.718 6.978 -8.954
539 1HG1 ILE 75 2HG1 ILE 75 -2.528 9.044 -11.151
540 2HG1 ILE 75 1HG1 ILE 75 -2.032 9.198 -9.477
541 1HG2 ILE 75 1HG2 ILE 75 -3.483 5.370 -10.622
542 2HG2 ILE 75 2HG2 ILE 75 -1.826 5.874 -10.950
543 3HG2 ILE 75 3HG2 ILE 75 -3.153 6.530 -11.909
544 1HD1 ILE 75 1HD1 ILE 75 -0.721 7.474 -11.551
545 2HD1 ILE 75 2HD1 ILE 75 -0.233 7.595 -9.859
546 3HD1 ILE 75 3HD1 ILE 75 -0.115 9.003 -10.918
547 H GLU 76 H GLU 76 -5.907 6.113 -11.102
548 HA GLU 76 HA GLU 76 -6.882 4.833 -8.633
549 1HB GLU 76 2HB GLU 76 -8.608 5.879 -10.085
550 2HB GLU 76 1HB GLU 76 -8.112 4.808 -11.383
551 1HG GLU 76 2HG GLU 76 -8.834 2.883 -10.165
552 2HG GLU 76 1HG GLU 76 -9.192 3.869 -8.747
553 H ILE 77 H ILE 77 -6.351 2.783 -8.270
554 HA ILE 77 HA ILE 77 -5.103 1.257 -10.455
555 HB ILE 77 HB ILE 77 -3.416 0.383 -8.882
556 1HG1 ILE 77 2HG1 ILE 77 -4.423 2.519 -6.991
557 2HG1 ILE 77 1HG1 ILE 77 -4.719 0.795 -6.808
558 1HG2 ILE 77 1HG2 ILE 77 -2.015 2.400 -8.787
559 2HG2 ILE 77 2HG2 ILE 77 -3.427 3.381 -9.182
560 3HG2 ILE 77 3HG2 ILE 77 -2.817 2.205 -10.347
561 1HD1 ILE 77 1HD1 ILE 77 -2.022 2.126 -6.765
562 2HD1 ILE 77 2HD1 ILE 77 -2.327 0.399 -6.583
563 3HD1 ILE 77 3HD1 ILE 77 -2.912 1.531 -5.364
564 H GLN 78 H GLN 78 -5.043 -1.021 -10.152
565 HA GLN 78 HA GLN 78 -6.970 -2.090 -8.201
566 1HB GLN 78 2HB GLN 78 -8.021 -1.858 -10.435
567 2HB GLN 78 1HB GLN 78 -6.758 -2.865 -11.117
568 1HG GLN 78 2HG GLN 78 -7.523 -4.768 -9.926
569 2HG GLN 78 1HG GLN 78 -8.639 -3.793 -8.966
570 1HE2 GLN 78 1HE2 GLN 78 -10.551 -3.099 -9.868
571 2HE2 GLN 78 2HE2 GLN 78 -11.156 -3.699 -11.372
572 H TYR 79 H TYR 79 -6.469 -4.160 -7.428
573 HA TYR 79 HA TYR 79 -3.689 -4.925 -7.853
574 1HB TYR 79 2HB TYR 79 -5.687 -5.893 -5.792
575 2HB TYR 79 1HB TYR 79 -3.986 -6.340 -5.856
576 HD1 TYR 79 1HD TYR 79 -2.260 -4.449 -5.628
577 HD2 TYR 79 2HD TYR 79 -6.366 -4.000 -4.605
578 HE1 TYR 79 1HE TYR 79 -1.694 -2.501 -4.239
579 HE2 TYR 79 2HE TYR 79 -5.811 -2.050 -3.213
580 HH TYR 79 HH TYR 79 -3.812 -1.174 -1.996
581 H LEU 80 H LEU 80 -3.097 -7.149 -8.148
582 HA LEU 80 HA LEU 80 -5.112 -8.668 -9.668
583 1HB LEU 80 2HB LEU 80 -2.111 -8.543 -9.931
584 2HB LEU 80 1HB LEU 80 -3.096 -9.747 -10.740
585 HG LEU 80 HG LEU 80 -3.470 -6.780 -11.132
586 1HD1 LEU 80 1HD1 LEU 80 -2.275 -7.071 -13.253
587 2HD1 LEU 80 2HD1 LEU 80 -1.903 -8.736 -12.810
588 3HD1 LEU 80 3HD1 LEU 80 -1.233 -7.405 -11.868
589 1HD2 LEU 80 1HD2 LEU 80 -5.411 -8.167 -11.652
590 2HD2 LEU 80 2HD2 LEU 80 -4.416 -9.185 -12.691
591 3HD2 LEU 80 3HD2 LEU 80 -4.704 -7.500 -13.123
592 H GLY 81 H GLY 81 -4.143 -11.145 -9.764
593 1HA GLY 81 2HA GLY 81 -3.731 -13.066 -8.532
594 2HA GLY 81 1HA GLY 81 -3.175 -12.045 -7.209
595 HA PRO 82 HA PRO 82 -7.186 -13.771 -5.687
596 1HB PRO 82 2HB PRO 82 -6.372 -13.646 -3.068
597 2HB PRO 82 1HB PRO 82 -6.159 -15.061 -4.104
598 1HG PRO 82 2HG PRO 82 -4.198 -12.924 -3.379
599 2HG PRO 82 1HG PRO 82 -3.945 -14.671 -3.539
600 1HD PRO 82 2HD PRO 82 -3.191 -12.934 -5.453
601 2HD PRO 82 1HD PRO 82 -3.779 -14.565 -5.837
602 H TYR 83 H TYR 83 -5.464 -10.893 -5.524
603 HA TYR 83 HA TYR 83 -7.496 -9.518 -3.908
604 1HB TYR 83 2HB TYR 83 -4.895 -8.390 -4.960
605 2HB TYR 83 1HB TYR 83 -5.918 -7.716 -3.698
606 HD1 TYR 83 1HD TYR 83 -6.055 -8.902 -1.474
607 HD2 TYR 83 2HD TYR 83 -3.231 -9.994 -4.466
608 HE1 TYR 83 1HE TYR 83 -4.731 -10.102 0.220
609 HE2 TYR 83 2HE TYR 83 -1.904 -11.201 -2.786
610 HH TYR 83 HH TYR 83 -1.548 -11.258 -0.405
611 H TYR 84 H TYR 84 -7.664 -10.525 -6.737
612 HA TYR 84 HA TYR 84 -7.520 -8.462 -8.604
613 1HB TYR 84 2HB TYR 84 -8.818 -9.912 -10.043
614 2HB TYR 84 1HB TYR 84 -7.654 -10.872 -9.147
615 HD1 TYR 84 1HD TYR 84 -8.570 -12.076 -7.008
616 HD2 TYR 84 2HD TYR 84 -11.032 -10.565 -10.135
617 HE1 TYR 84 1HE TYR 84 -10.367 -13.614 -6.334
618 HE2 TYR 84 2HE TYR 84 -12.837 -12.089 -9.459
619 HH TYR 84 HH TYR 84 -13.009 -14.310 -8.274
620 HA PRO 85 HA PRO 85 -10.283 -5.660 -9.775
621 1HB PRO 85 2HB PRO 85 -12.655 -7.245 -8.888
622 2HB PRO 85 1HB PRO 85 -12.573 -5.972 -10.117
623 1HG PRO 85 2HG PRO 85 -12.122 -8.708 -10.588
624 2HG PRO 85 1HG PRO 85 -11.663 -7.382 -11.671
625 1HD PRO 85 2HD PRO 85 -9.863 -9.108 -10.407
626 2HD PRO 85 1HD PRO 85 -9.444 -7.495 -11.037
627 H LEU 86 H LEU 86 -10.001 -6.676 -6.556
628 HA LEU 86 HA LEU 86 -11.356 -4.497 -5.338
629 1HB LEU 86 2HB LEU 86 -10.577 -6.390 -4.018
630 2HB LEU 86 1HB LEU 86 -8.916 -6.049 -4.459
631 HG LEU 86 HG LEU 86 -9.046 -3.916 -3.210
632 1HD1 LEU 86 1HD1 LEU 86 -10.929 -3.541 -1.689
633 2HD1 LEU 86 2HD1 LEU 86 -11.764 -4.926 -2.395
634 3HD1 LEU 86 3HD1 LEU 86 -11.425 -3.503 -3.381
635 1HD2 LEU 86 1HD2 LEU 86 -8.159 -5.921 -2.144
636 2HD2 LEU 86 2HD2 LEU 86 -9.780 -6.369 -1.613
637 3HD2 LEU 86 3HD2 LEU 86 -9.014 -4.912 -0.980
638 H LYS 87 H LYS 87 -10.969 -2.419 -5.861
639 HA LYS 87 HA LYS 87 -8.283 -1.751 -6.815
640 1HB LYS 87 2HB LYS 87 -9.249 0.148 -7.939
641 2HB LYS 87 1HB LYS 87 -10.140 -1.303 -8.365
642 1HG LYS 87 2HG LYS 87 -11.961 -0.685 -6.949
643 2HG LYS 87 1HG LYS 87 -11.041 0.665 -6.278
644 1HD LYS 87 2HD LYS 87 -10.949 1.660 -8.555
645 2HD LYS 87 1HD LYS 87 -11.997 0.359 -9.124
646 1HE LYS 87 2HE LYS 87 -13.772 1.083 -7.680
647 2HE LYS 87 1HE LYS 87 -12.720 2.270 -6.912
648 1HZ LYS 87 1HZ LYS 87 -13.567 2.309 -9.762
649 2HZ LYS 87 2HZ LYS 87 -12.566 3.451 -9.017
650 3HZ LYS 87 3HZ LYS 87 -14.186 3.302 -8.531
651 H SER 88 H SER 88 -7.566 0.514 -6.403
652 HA SER 88 HA SER 88 -8.352 1.534 -3.778
653 1HB SER 88 2HB SER 88 -6.492 0.047 -3.295
654 2HB SER 88 1HB SER 88 -5.537 0.754 -4.588
655 HG SER 88 HG SER 88 -6.483 2.383 -2.499
656 H THR 89 H THR 89 -7.603 3.761 -3.437
657 HA THR 89 HA THR 89 -7.268 5.156 -6.009
658 HB THR 89 HB THR 89 -8.319 6.516 -3.568
659 HG1 THR 89 1HG THR 89 -10.082 5.224 -5.388
660 1HG2 THR 89 1HG2 THR 89 -8.822 6.828 -6.525
661 2HG2 THR 89 2HG2 THR 89 -7.833 7.878 -5.508
662 3HG2 THR 89 3HG2 THR 89 -9.578 7.802 -5.262
663 H LEU 90 H LEU 90 -5.738 6.705 -6.200
664 HA LEU 90 HA LEU 90 -3.986 7.217 -3.886
665 1HB LEU 90 2HB LEU 90 -3.206 6.957 -6.796
666 2HB LEU 90 1HB LEU 90 -2.126 7.485 -5.521
667 HG LEU 90 HG LEU 90 -3.408 4.756 -5.695
668 1HD1 LEU 90 1HD1 LEU 90 -1.140 3.982 -6.202
669 2HD1 LEU 90 2HD1 LEU 90 -0.584 5.656 -6.241
670 3HD1 LEU 90 3HD1 LEU 90 -1.751 5.085 -7.434
671 1HD2 LEU 90 1HD2 LEU 90 -1.312 5.824 -3.806
672 2HD2 LEU 90 2HD2 LEU 90 -1.934 4.174 -3.850
673 3HD2 LEU 90 3HD2 LEU 90 -2.997 5.506 -3.395
674 H LYS 91 H LYS 91 -3.815 9.300 -3.339
675 HA LYS 91 HA LYS 91 -4.482 11.330 -5.369
676 1HB LYS 91 2HB LYS 91 -5.230 11.308 -2.444
677 2HB LYS 91 1HB LYS 91 -5.382 12.720 -3.481
678 1HG LYS 91 2HG LYS 91 -7.026 11.669 -4.814
679 2HG LYS 91 1HG LYS 91 -6.723 10.105 -4.060
680 1HD LYS 91 2HD LYS 91 -7.522 11.010 -1.913
681 2HD LYS 91 1HD LYS 91 -7.866 12.547 -2.706
682 1HE LYS 91 2HE LYS 91 -9.500 11.478 -4.140
683 2HE LYS 91 1HE LYS 91 -9.105 9.904 -3.452
684 1HZ LYS 91 1HZ LYS 91 -10.376 12.194 -2.046
685 2HZ LYS 91 2HZ LYS 91 -9.847 10.776 -1.273
686 3HZ LYS 91 3HZ LYS 91 -11.087 10.701 -2.429
687 H ARG 92 H ARG 92 -3.428 13.350 -5.114
688 HA ARG 92 HA ARG 92 -0.747 13.104 -4.120
689 1HB ARG 92 2HB ARG 92 -0.351 15.234 -5.117
690 2HB ARG 92 1HB ARG 92 -1.342 14.313 -6.232
691 1HG ARG 92 2HG ARG 92 -3.327 15.514 -5.384
692 2HG ARG 92 1HG ARG 92 -2.261 16.496 -4.382
693 1HD ARG 92 2HD ARG 92 -1.080 17.233 -6.421
694 2HD ARG 92 1HD ARG 92 -2.226 16.311 -7.391
695 HE ARG 92 HE ARG 92 -2.648 18.877 -6.162
696 1HH1 ARG 92 1HH1 ARG 92 -4.281 15.982 -7.254
697 2HH1 ARG 92 2HH1 ARG 92 -5.724 16.820 -7.755
698 1HH2 ARG 92 1HH2 ARG 92 -4.569 19.985 -6.793
699 2HH2 ARG 92 2HH2 ARG 92 -5.885 19.068 -7.475
700 H GLY 93 H GLY 93 0.163 14.176 -2.366
701 1HA GLY 93 2HA GLY 93 -1.759 15.371 -0.511
702 2HA GLY 93 1HA GLY 93 -0.162 14.757 -0.087
703 H GLU 94 H GLU 94 -0.609 17.090 0.900
704 HA GLU 94 HA GLU 94 -0.076 19.259 -0.877
705 1HB GLU 94 2HB GLU 94 0.072 20.559 1.275
706 2HB GLU 94 1HB GLU 94 -1.456 19.754 0.976
707 1HG GLU 94 2HG GLU 94 -0.754 17.937 2.485
708 2HG GLU 94 1HG GLU 94 0.732 18.826 2.823
709 H ASN 95 H ASN 95 1.777 20.184 -1.359
710 HA ASN 95 HA ASN 95 3.950 20.795 -1.411
711 1HB ASN 95 2HB ASN 95 4.246 19.488 1.305
712 2HB ASN 95 1HB ASN 95 5.391 20.586 0.544
713 1HD2 ASN 95 1HD2 ASN 95 2.596 20.302 2.454
714 2HD2 ASN 95 2HD2 ASN 95 2.249 21.989 2.632
715 H GLY 96 H GLY 96 4.014 17.626 0.250
716 1HA GLY 96 2HA GLY 96 5.032 16.297 -2.074
717 2HA GLY 96 1HA GLY 96 6.301 16.632 -0.905
718 H THR 97 H THR 97 2.956 15.424 -0.837
719 HA THR 97 HA THR 97 3.903 13.086 0.644
720 HB THR 97 HB THR 97 1.675 13.259 1.955
721 HG1 THR 97 1HG THR 97 2.026 16.038 1.574
722 1HG2 THR 97 1HG2 THR 97 3.939 15.174 2.533
723 2HG2 THR 97 2HG2 THR 97 3.867 13.477 3.005
724 3HG2 THR 97 3HG2 THR 97 2.728 14.631 3.696
725 H LEU 98 H LEU 98 2.076 11.382 0.754
726 HA LEU 98 HA LEU 98 0.492 11.466 -1.729
727 1HB LEU 98 2HB LEU 98 2.524 10.069 -2.022
728 2HB LEU 98 1HB LEU 98 1.993 9.057 -0.693
729 HG LEU 98 HG LEU 98 -0.046 8.482 -2.021
730 1HD1 LEU 98 1HD1 LEU 98 -0.055 8.959 -4.411
731 2HD1 LEU 98 2HD1 LEU 98 1.419 9.912 -4.234
732 3HD1 LEU 98 3HD1 LEU 98 -0.076 10.450 -3.468
733 1HD2 LEU 98 1HD2 LEU 98 1.927 7.018 -1.952
734 2HD2 LEU 98 2HD2 LEU 98 2.583 7.854 -3.361
735 3HD2 LEU 98 3HD2 LEU 98 1.089 6.929 -3.501
736 H ILE 99 H ILE 99 -1.569 10.802 -1.551
737 HA ILE 99 HA ILE 99 -2.445 9.774 1.062
738 HB ILE 99 HB ILE 99 -4.040 11.131 -1.117
739 1HG1 ILE 99 2HG1 ILE 99 -3.240 12.116 1.630
740 2HG1 ILE 99 1HG1 ILE 99 -2.506 12.632 0.114
741 1HG2 ILE 99 1HG2 ILE 99 -5.885 11.128 0.501
742 2HG2 ILE 99 2HG2 ILE 99 -4.896 10.186 1.616
743 3HG2 ILE 99 3HG2 ILE 99 -5.387 9.492 0.070
744 1HD1 ILE 99 1HD1 ILE 99 -4.666 13.548 -0.593
745 2HD1 ILE 99 2HD1 ILE 99 -4.074 14.283 0.898
746 3HD1 ILE 99 3HD1 ILE 99 -5.357 13.075 0.959
747 H TRP 100 H TRP 100 -3.164 7.752 1.200
748 HA TRP 100 HA TRP 100 -3.713 6.293 -1.304
749 1HB TRP 100 2HB TRP 100 -1.627 5.586 -0.238
750 2HB TRP 100 1HB TRP 100 -2.473 5.298 1.274
751 HD1 TRP 100 HD TRP 100 -4.067 4.061 -1.966
752 HE1 TRP 100 1HE TRP 100 -3.980 1.501 -2.010
753 HE3 TRP 100 3HE TRP 100 -1.096 3.290 2.126
754 HZ2 TRP 100 2HZ TRP 100 -2.802 -0.585 -0.506
755 HZ3 TRP 100 3HZ TRP 100 -0.534 0.979 2.750
756 HH2 TRP 100 HH TRP 100 -1.367 -0.917 1.460
757 H GLU 101 H GLU 101 -5.812 5.807 -1.487
758 HA GLU 101 HA GLU 101 -7.331 5.358 0.997
759 1HB GLU 101 2HB GLU 101 -8.067 6.605 -1.592
760 2HB GLU 101 1HB GLU 101 -9.311 5.738 -0.715
761 1HG GLU 101 2HG GLU 101 -8.947 7.138 1.228
762 2HG GLU 101 1HG GLU 101 -7.658 7.989 0.384
763 H GLN 102 H GLN 102 -8.383 3.565 1.304
764 HA GLN 102 HA GLN 102 -8.858 1.688 -0.853
765 1HB GLN 102 2HB GLN 102 -6.518 1.242 -0.020
766 2HB GLN 102 1HB GLN 102 -7.216 0.826 1.537
767 1HG GLN 102 2HG GLN 102 -8.364 -0.603 -0.756
768 2HG GLN 102 1HG GLN 102 -6.670 -0.942 -0.436
769 1HE2 GLN 102 1HE2 GLN 102 -7.077 -3.049 0.197
770 2HE2 GLN 102 2HE2 GLN 102 -7.821 -3.432 1.713
771 H ASN 103 H ASN 103 -10.834 1.004 -0.613
772 HA ASN 103 HA ASN 103 -12.759 0.183 0.256
773 1HB ASN 103 2HB ASN 103 -10.791 -1.047 1.734
774 2HB ASN 103 1HB ASN 103 -11.808 -0.333 2.979
775 1HD2 ASN 103 1HD2 ASN 103 -11.565 -2.696 0.489
776 2HD2 ASN 103 2HD2 ASN 103 -13.043 -3.533 0.836
777 H GLY 104 H GLY 104 -11.547 3.002 1.038
778 1HA GLY 104 2HA GLY 104 -13.137 4.750 1.634
779 2HA GLY 104 1HA GLY 104 -13.801 3.648 2.830
780 H GLN 105 H GLN 105 -10.671 3.058 3.173
781 HA GLN 105 HA GLN 105 -10.429 4.962 5.369
782 1HB GLN 105 2HB GLN 105 -8.609 2.665 4.609
783 2HB GLN 105 1HB GLN 105 -8.578 3.573 6.116
784 1HG GLN 105 2HG GLN 105 -10.841 2.739 6.620
785 2HG GLN 105 1HG GLN 105 -10.782 1.769 5.151
786 1HE2 GLN 105 1HE2 GLN 105 -11.029 0.984 7.960
787 2HE2 GLN 105 2HE2 GLN 105 -9.732 -0.126 8.253
788 H ARG 106 H ARG 106 -8.980 6.597 5.429
789 HA ARG 106 HA ARG 106 -7.447 7.049 2.974
790 1HB ARG 106 2HB ARG 106 -9.096 8.764 3.611
791 2HB ARG 106 1HB ARG 106 -8.236 9.014 5.124
792 1HG ARG 106 2HG ARG 106 -6.399 9.988 4.046
793 2HG ARG 106 1HG ARG 106 -6.896 9.377 2.464
794 1HD ARG 106 2HD ARG 106 -8.365 11.445 4.099
795 2HD ARG 106 1HD ARG 106 -7.349 11.774 2.695
796 HE ARG 106 HE ARG 106 -8.990 10.333 1.433
797 1HH1 ARG 106 1HH1 ARG 106 -9.899 12.207 4.246
798 2HH1 ARG 106 2HH1 ARG 106 -11.583 12.274 3.822
799 1HH2 ARG 106 1HH2 ARG 106 -11.165 10.405 0.865
800 2HH2 ARG 106 2HH2 ARG 106 -12.319 11.218 1.886
801 H LYS 107 H LYS 107 -5.407 6.531 3.034
802 HA LYS 107 HA LYS 107 -3.915 6.686 5.546
803 1HB LYS 107 2HB LYS 107 -3.339 5.379 2.893
804 2HB LYS 107 1HB LYS 107 -2.120 5.536 4.148
805 1HG LYS 107 2HG LYS 107 -4.758 4.156 4.584
806 2HG LYS 107 1HG LYS 107 -3.308 3.333 4.033
807 1HD LYS 107 2HD LYS 107 -3.165 2.976 6.281
808 2HD LYS 107 1HD LYS 107 -2.218 4.455 6.113
809 1HE LYS 107 2HE LYS 107 -4.755 5.416 6.453
810 2HE LYS 107 1HE LYS 107 -4.747 3.978 7.468
811 1HZ LYS 107 1HZ LYS 107 -2.370 5.145 8.058
812 2HZ LYS 107 2HZ LYS 107 -3.792 5.299 8.980
813 3HZ LYS 107 3HZ LYS 107 -3.391 6.487 7.842
814 H THR 108 H THR 108 -2.181 7.970 5.824
815 HA THR 108 HA THR 108 -1.598 9.886 3.667
816 HB THR 108 HB THR 108 -1.645 10.526 6.626
817 HG1 THR 108 1HG THR 108 -3.615 10.396 4.798
818 1HG2 THR 108 1HG2 THR 108 -1.289 12.300 4.203
819 2HG2 THR 108 2HG2 THR 108 -0.033 11.876 5.367
820 3HG2 THR 108 3HG2 THR 108 -1.412 12.854 5.870
821 H MET 109 H MET 109 0.397 9.546 2.962
822 HA MET 109 HA MET 109 2.360 8.471 4.874
823 1HB MET 109 2HB MET 109 2.117 7.941 1.911
824 2HB MET 109 1HB MET 109 3.385 7.311 2.954
825 1HG MET 109 2HG MET 109 1.792 6.028 4.207
826 2HG MET 109 1HG MET 109 0.456 6.750 3.316
827 1HE MET 109 1HE MET 109 1.048 5.291 -0.281
828 2HE MET 109 2HE MET 109 1.737 6.790 0.339
829 3HE MET 109 3HE MET 109 0.062 6.370 0.704
830 H THR 110 H THR 110 4.381 9.295 4.917
831 HA THR 110 HA THR 110 4.802 11.790 3.427
832 HB THR 110 HB THR 110 6.662 10.803 5.547
833 HG1 THR 110 1HG THR 110 4.029 11.212 5.909
834 1HG2 THR 110 1HG2 THR 110 6.894 13.195 6.014
835 2HG2 THR 110 2HG2 THR 110 5.666 13.554 4.798
836 3HG2 THR 110 3HG2 THR 110 7.209 12.851 4.313
837 H ARG 111 H ARG 111 6.827 12.129 2.339
838 HA ARG 111 HA ARG 111 7.746 9.702 1.050
839 1HB ARG 111 2HB ARG 111 7.277 11.799 -0.241
840 2HB ARG 111 1HB ARG 111 8.663 12.537 0.554
841 1HG ARG 111 2HG ARG 111 10.090 10.734 -0.399
842 2HG ARG 111 1HG ARG 111 8.685 10.165 -1.302
843 1HD ARG 111 2HD ARG 111 10.057 11.560 -2.719
844 2HD ARG 111 1HD ARG 111 8.528 12.373 -2.385
845 HE ARG 111 HE ARG 111 9.654 13.919 -1.021
846 1HH1 ARG 111 1HH1 ARG 111 11.822 11.563 -2.446
847 2HH1 ARG 111 2HH1 ARG 111 13.255 12.503 -2.158
848 1HH2 ARG 111 1HH2 ARG 111 11.535 15.174 -0.642
849 2HH2 ARG 111 2HH2 ARG 111 13.086 14.562 -1.130
850 H ILE 112 H ILE 112 9.521 8.626 1.578
851 HA ILE 112 HA ILE 112 11.268 9.699 3.620
852 HB ILE 112 HB ILE 112 11.479 7.090 2.138
853 1HG1 ILE 112 2HG1 ILE 112 9.336 7.357 3.362
854 2HG1 ILE 112 1HG1 ILE 112 10.350 6.085 4.017
855 1HG2 ILE 112 1HG2 ILE 112 13.571 7.768 3.197
856 2HG2 ILE 112 2HG2 ILE 112 12.872 6.370 4.013
857 3HG2 ILE 112 3HG2 ILE 112 12.728 7.973 4.732
858 1HD1 ILE 112 1HD1 ILE 112 10.049 8.850 5.148
859 2HD1 ILE 112 2HD1 ILE 112 11.081 7.579 5.803
860 3HD1 ILE 112 3HD1 ILE 112 9.329 7.374 5.792
861 H GLU 113 H GLU 113 13.351 10.177 3.394
862 HA GLU 113 HA GLU 113 14.598 10.033 0.753
863 1HB GLU 113 2HB GLU 113 13.909 12.359 1.088
864 2HB GLU 113 1HB GLU 113 14.726 12.386 2.641
865 1HG GLU 113 2HG GLU 113 16.864 12.190 1.599
866 2HG GLU 113 1HG GLU 113 16.125 11.931 0.019
867 H SER 114 H SER 114 16.218 8.721 0.959
868 HA SER 114 HA SER 114 17.440 8.427 3.616
869 1HB SER 114 2HB SER 114 17.877 6.036 2.866
870 2HB SER 114 1HB SER 114 16.191 6.459 3.165
871 HG SER 114 HG SER 114 16.526 7.018 0.665
872 H LYS 115 H LYS 115 19.457 8.997 3.761
873 HA LYS 115 HA LYS 115 21.158 9.015 1.379
874 1HB LYS 115 2HB LYS 115 21.630 10.048 4.189
875 2HB LYS 115 1HB LYS 115 22.781 10.182 2.865
876 1HG LYS 115 2HG LYS 115 21.040 11.463 1.599
877 2HG LYS 115 1HG LYS 115 20.075 11.478 3.076
878 1HD LYS 115 2HD LYS 115 21.344 13.548 2.833
879 2HD LYS 115 1HD LYS 115 21.885 12.638 4.245
880 1HE LYS 115 2HE LYS 115 23.751 13.584 2.923
881 2HE LYS 115 1HE LYS 115 23.810 11.827 3.050
882 1HZ LYS 115 1HZ LYS 115 24.297 12.616 0.802
883 2HZ LYS 115 2HZ LYS 115 22.761 13.330 0.707
884 3HZ LYS 115 3HZ LYS 115 22.907 11.646 0.830
885 H THR 116 H THR 116 20.246 6.594 2.349
886 HA THR 116 HA THR 116 22.721 5.187 2.683
887 HB THR 116 HB THR 116 22.115 5.692 5.041
888 HG1 THR 116 1HG THR 116 22.569 3.676 5.715
889 1HG2 THR 116 1HG2 THR 116 19.624 4.091 4.461
890 2HG2 THR 116 2HG2 THR 116 19.684 5.824 4.786
891 3HG2 THR 116 3HG2 THR 116 20.132 4.674 6.047
892 H GLY 117 H GLY 117 22.313 2.815 2.406
893 1HA GLY 117 2HA GLY 117 20.252 1.313 1.905
894 2HA GLY 117 1HA GLY 117 20.022 2.469 0.598
895 H ARG 118 H ARG 118 21.927 -0.142 1.820
896 HA ARG 118 HA ARG 118 23.335 -0.277 -0.760
897 1HB ARG 118 2HB ARG 118 24.672 0.199 1.430
898 2HB ARG 118 1HB ARG 118 24.405 -1.504 1.768
899 1HG ARG 118 2HG ARG 118 25.683 -0.514 -0.764
900 2HG ARG 118 1HG ARG 118 26.596 -0.920 0.687
901 1HD ARG 118 2HD ARG 118 25.783 -3.203 0.592
902 2HD ARG 118 1HD ARG 118 24.776 -2.810 -0.801
903 HE ARG 118 HE ARG 118 27.081 -2.194 -1.831
904 1HH1 ARG 118 1HH1 ARG 118 26.393 -4.881 0.300
905 2HH1 ARG 118 2HH1 ARG 118 27.672 -5.879 -0.330
906 1HH2 ARG 118 1HH2 ARG 118 28.749 -3.487 -2.670
907 2HH2 ARG 118 2HH2 ARG 118 29.010 -5.081 -2.030
908 H GLU 119 H GLU 119 22.330 -1.760 -1.908
909 HA GLU 119 HA GLU 119 20.822 -3.896 -0.887
910 1HB GLU 119 2HB GLU 119 22.073 -3.506 -3.607
911 2HB GLU 119 1HB GLU 119 21.025 -4.858 -3.213
912 1HG GLU 119 2HG GLU 119 19.705 -3.256 -4.331
913 2HG GLU 119 1HG GLU 119 19.249 -3.201 -2.630
914 H GLU 120 H GLU 120 21.867 -5.169 0.549
915 HA GLU 120 HA GLU 120 24.215 -6.626 -0.426
916 1HB GLU 120 2HB GLU 120 23.044 -6.545 2.355
917 2HB GLU 120 1HB GLU 120 24.533 -7.352 1.887
918 1HG GLU 120 2HG GLU 120 25.470 -5.167 1.233
919 2HG GLU 120 1HG GLU 120 24.001 -4.392 1.818
920 H LYS 121 H LYS 121 23.411 -8.118 -1.736
921 HA LYS 121 HA LYS 121 20.942 -9.491 -1.084
922 1HB LYS 121 2HB LYS 121 21.590 -8.550 -3.378
923 2HB LYS 121 1HB LYS 121 22.679 -9.923 -3.506
924 1HG LYS 121 2HG LYS 121 20.800 -11.454 -3.320
925 2HG LYS 121 1HG LYS 121 19.694 -10.089 -3.137
926 1HD LYS 121 2HD LYS 121 20.460 -9.271 -5.370
927 2HD LYS 121 1HD LYS 121 21.375 -10.769 -5.548
928 1HE LYS 121 2HE LYS 121 19.272 -10.972 -6.702
929 2HE LYS 121 1HE LYS 121 19.269 -12.036 -5.297
930 1HZ LYS 121 1HZ LYS 121 17.948 -10.426 -4.102
931 2HZ LYS 121 2HZ LYS 121 17.178 -10.821 -5.557
932 3HZ LYS 121 3HZ LYS 121 18.005 -9.346 -5.408
933 H ASP 122 H ASP 122 20.783 -11.536 -0.411
934 HA ASP 122 HA ASP 122 23.274 -13.094 -0.187
935 1HB ASP 122 2HB ASP 122 22.253 -12.432 1.987
936 2HB ASP 122 1HB ASP 122 20.794 -13.307 1.540
937 H GLU 123 H GLU 123 23.251 -15.238 -0.829
938 HA GLU 123 HA GLU 123 21.214 -15.808 -2.812
939 1HB GLU 123 2HB GLU 123 23.702 -16.106 -3.184
940 2HB GLU 123 1HB GLU 123 23.611 -17.497 -2.113
941 1HG GLU 123 2HG GLU 123 22.136 -18.634 -3.611
942 2HG GLU 123 1HG GLU 123 21.996 -17.200 -4.630
943 H LYS 124 H LYS 124 19.381 -16.604 -2.042
944 HA LYS 124 HA LYS 124 19.493 -18.810 -0.097
945 1HB LYS 124 2HB LYS 124 18.751 -16.609 0.863
946 2HB LYS 124 1HB LYS 124 17.388 -16.645 -0.243
947 1HG LYS 124 2HG LYS 124 16.595 -18.709 0.825
948 2HG LYS 124 1HG LYS 124 17.955 -18.629 1.951
949 1HD LYS 124 2HD LYS 124 17.140 -16.389 2.673
950 2HD LYS 124 1HD LYS 124 15.720 -16.623 1.650
951 1HE LYS 124 2HE LYS 124 15.213 -17.187 3.958
952 2HE LYS 124 1HE LYS 124 15.132 -18.621 2.937
953 1HZ LYS 124 1HZ LYS 124 16.331 -18.787 5.171
954 2HZ LYS 124 2HZ LYS 124 17.599 -17.958 4.417
955 3HZ LYS 124 3HZ LYS 124 17.088 -19.458 3.813
956 H SER 125 H SER 125 18.553 -20.609 -0.827
957 HA SER 125 HA SER 125 16.816 -20.414 -3.182
958 1HB SER 125 2HB SER 125 18.816 -21.837 -3.419
959 2HB SER 125 1HB SER 125 18.280 -22.819 -2.057
960 HG SER 125 HG SER 125 16.917 -23.817 -3.317
961 H LYS 126 H LYS 126 14.763 -21.206 -3.198
962 HA LYS 126 HA LYS 126 13.700 -22.192 -0.642
963 1HB LYS 126 2HB LYS 126 12.226 -21.220 -3.105
964 2HB LYS 126 1HB LYS 126 11.478 -21.710 -1.593
965 1HG LYS 126 2HG LYS 126 12.637 -19.851 -0.457
966 2HG LYS 126 1HG LYS 126 13.286 -19.338 -2.018
967 1HD LYS 126 2HD LYS 126 10.990 -19.055 -2.858
968 2HD LYS 126 1HD LYS 126 10.365 -19.533 -1.279
969 1HE LYS 126 2HE LYS 126 10.315 -17.144 -1.427
970 2HE LYS 126 1HE LYS 126 11.568 -17.607 -0.278
971 1HZ LYS 126 1HZ LYS 126 13.246 -17.169 -1.896
972 2HZ LYS 126 2HZ LYS 126 12.216 -15.821 -1.848
973 3HZ LYS 126 3HZ LYS 126 12.094 -16.928 -3.119
974 H SER 127 H SER 127 14.460 -24.316 -0.791
975 HA SER 127 HA SER 127 13.916 -25.807 -3.228
976 1HB SER 127 2HB SER 127 15.453 -26.600 -0.746
977 2HB SER 127 1HB SER 127 15.354 -27.537 -2.236
978 HG SER 127 HG SER 127 17.219 -26.375 -2.366
979 H LEU 128 H LEU 128 11.580 -25.708 -2.805
980 HA LEU 128 HA LEU 128 10.780 -28.138 -1.389
981 1HB LEU 128 2HB LEU 128 9.475 -25.433 -1.061
982 2HB LEU 128 1HB LEU 128 8.692 -26.936 -0.615
983 HG LEU 128 HG LEU 128 11.272 -25.923 0.589
984 1HD1 LEU 128 1HD1 LEU 128 8.472 -25.906 1.720
985 2HD1 LEU 128 2HD1 LEU 128 9.372 -24.492 1.170
986 3HD1 LEU 128 3HD1 LEU 128 9.941 -25.410 2.563
987 1HD2 LEU 128 1HD2 LEU 128 9.473 -28.211 1.388
988 2HD2 LEU 128 2HD2 LEU 128 10.931 -27.685 2.231
989 3HD2 LEU 128 3HD2 LEU 128 11.049 -28.361 0.607
990 H GLU 129 H GLU 129 9.339 -29.337 -2.540
991 HA GLU 129 HA GLU 129 8.550 -28.256 -5.129
992 1HB GLU 129 2HB GLU 129 8.757 -31.027 -4.020
993 2HB GLU 129 1HB GLU 129 7.764 -30.721 -5.438
994 1HG GLU 129 2HG GLU 129 10.123 -29.449 -6.044
995 2HG GLU 129 1HG GLU 129 10.647 -30.892 -5.174
996 H HIS 130 H HIS 130 6.543 -27.844 -5.735
997 HA HIS 130 HA HIS 130 4.393 -28.138 -3.784
998 1HB HIS 130 2HB HIS 130 4.579 -25.986 -4.916
999 2HB HIS 130 1HB HIS 130 4.513 -26.771 -6.489
1000 HD1 HIS 130 1HD HIS 130 2.227 -27.148 -7.493
1001 HD2 HIS 130 2HD HIS 130 2.075 -26.081 -3.466
1002 HE1 HIS 130 1HE HIS 130 -0.205 -26.747 -6.977
1003 HE2 HIS 130 2HE HIS 130 -0.259 -25.980 -4.579
1004 H HIS 131 H HIS 131 3.121 -29.883 -3.819
1005 HA HIS 131 HA HIS 131 2.908 -31.361 -6.345
1006 1HB HIS 131 2HB HIS 131 2.334 -33.350 -5.039
1007 2HB HIS 131 1HB HIS 131 3.893 -32.704 -4.553
1008 HD1 HIS 131 1HD HIS 131 0.610 -33.678 -3.253
1009 HD2 HIS 131 2HD HIS 131 3.844 -31.395 -1.972
1010 HE1 HIS 131 1HE HIS 131 0.306 -33.403 -0.776
1011 HE2 HIS 131 2HE HIS 131 2.377 -32.201 0.003
1012 H HIS 132 H HIS 132 0.998 -31.722 -7.259
1013 HA HIS 132 HA HIS 132 -1.224 -30.094 -6.538
1014 1HB HIS 132 2HB HIS 132 -0.627 -30.764 -8.865
1015 2HB HIS 132 1HB HIS 132 -1.089 -32.416 -8.478
1016 HD1 HIS 132 1HD HIS 132 -2.415 -29.226 -9.664
1017 HD2 HIS 132 2HD HIS 132 -3.941 -32.718 -7.998
1018 HE1 HIS 132 1HE HIS 132 -4.880 -29.199 -10.164
1019 HE2 HIS 132 2HE HIS 132 -5.721 -31.446 -9.380
1020 H HIS 133 H HIS 133 -2.309 -30.542 -4.696
1021 HA HIS 133 HA HIS 133 -2.964 -33.369 -4.170
1022 1HB HIS 133 2HB HIS 133 -1.392 -32.472 -2.519
1023 2HB HIS 133 1HB HIS 133 -2.499 -31.150 -2.166
1024 HD1 HIS 133 1HD HIS 133 -4.154 -31.538 -0.348
1025 HD2 HIS 133 2HD HIS 133 -2.491 -35.086 -1.748
1026 HE1 HIS 133 1HE HIS 133 -5.016 -33.342 1.178
1027 HE2 HIS 133 2HE HIS 133 -4.225 -35.492 0.129
1028 H HIS 134 H HIS 134 -4.934 -33.455 -5.105
1029 HA HIS 134 HA HIS 134 -7.147 -33.068 -3.549
1030 1HB HIS 134 2HB HIS 134 -6.460 -30.592 -4.807
1031 2HB HIS 134 1HB HIS 134 -7.941 -31.196 -5.546
1032 HD1 HIS 134 1HD HIS 134 -6.947 -29.065 -2.945
1033 HD2 HIS 134 2HD HIS 134 -9.786 -32.092 -3.233
1034 HE1 HIS 134 1HE HIS 134 -8.584 -28.643 -1.087
1035 HE2 HIS 134 2HE HIS 134 -10.145 -30.615 -1.138
1036 H HIS 135 H HIS 135 -7.114 -32.071 -6.923
1037 HA HIS 135 HA HIS 135 -7.994 -34.759 -7.712
1038 1HB HIS 135 2HB HIS 135 -9.989 -33.345 -7.537
1039 2HB HIS 135 1HB HIS 135 -9.240 -32.134 -8.568
1040 HD1 HIS 135 1HD HIS 135 -9.559 -32.383 -11.040
1041 HD2 HIS 135 2HD HIS 135 -10.649 -35.809 -8.943
1042 HE1 HIS 135 1HE HIS 135 -10.639 -33.904 -12.729
1043 HE2 HIS 135 2HE HIS 135 -11.487 -35.860 -11.396
Start of MODEL 16
1 1H MET 1 1HT MET 1 26.987 31.855 -23.572
2 2H MET 1 2HT MET 1 28.565 32.349 -23.219
3 3H MET 1 3HT MET 1 27.334 32.585 -22.080
4 HA MET 1 HA MET 1 28.367 29.978 -23.035
5 1HB MET 1 2HB MET 1 29.265 29.699 -20.783
6 2HB MET 1 1HB MET 1 29.943 31.126 -21.550
7 1HG MET 1 2HG MET 1 28.513 32.558 -20.251
8 2HG MET 1 1HG MET 1 27.675 31.163 -19.574
9 1HE MET 1 1HE MET 1 28.707 29.492 -17.846
10 2HE MET 1 2HE MET 1 30.380 29.542 -17.292
11 3HE MET 1 3HE MET 1 30.018 29.120 -18.966
12 H ILE 2 H ILE 2 25.573 31.457 -22.361
13 HA ILE 2 HA ILE 2 24.525 29.156 -20.849
14 HB ILE 2 HB ILE 2 23.320 31.924 -21.123
15 1HG1 ILE 2 2HG1 ILE 2 23.509 31.730 -18.530
16 2HG1 ILE 2 1HG1 ILE 2 24.705 30.491 -18.875
17 1HG2 ILE 2 1HG2 ILE 2 22.253 29.507 -19.676
18 2HG2 ILE 2 2HG2 ILE 2 21.589 30.222 -21.144
19 3HG2 ILE 2 3HG2 ILE 2 21.556 31.126 -19.630
20 1HD1 ILE 2 1HD1 ILE 2 26.030 32.106 -20.124
21 2HD1 ILE 2 2HD1 ILE 2 25.750 32.634 -18.464
22 3HD1 ILE 2 3HD1 ILE 2 24.826 33.349 -19.784
23 H MET 3 H MET 3 23.788 27.700 -22.226
24 HA MET 3 HA MET 3 22.269 28.615 -24.573
25 1HB MET 3 2HB MET 3 23.481 25.908 -23.967
26 2HB MET 3 1HB MET 3 22.557 26.299 -25.411
27 1HG MET 3 2HG MET 3 24.242 27.957 -26.039
28 2HG MET 3 1HG MET 3 25.172 27.546 -24.598
29 1HE MET 3 1HE MET 3 23.840 26.312 -28.063
30 2HE MET 3 2HE MET 3 23.180 25.089 -26.976
31 3HE MET 3 3HE MET 3 24.447 24.658 -28.124
32 H VAL 4 H VAL 4 20.208 28.865 -23.991
33 HA VAL 4 HA VAL 4 18.872 26.569 -22.756
34 HB VAL 4 HB VAL 4 19.318 28.143 -20.937
35 1HG1 VAL 4 1HG1 VAL 4 19.436 30.213 -22.206
36 2HG1 VAL 4 2HG1 VAL 4 18.274 30.346 -20.886
37 3HG1 VAL 4 3HG1 VAL 4 17.705 30.118 -22.539
38 1HG2 VAL 4 1HG2 VAL 4 16.404 28.080 -21.716
39 2HG2 VAL 4 2HG2 VAL 4 17.033 28.370 -20.095
40 3HG2 VAL 4 3HG2 VAL 4 17.274 26.803 -20.866
41 H SER 5 H SER 5 16.940 26.096 -23.637
42 HA SER 5 HA SER 5 15.507 28.127 -25.167
43 1HB SER 5 2HB SER 5 16.228 25.411 -26.307
44 2HB SER 5 1HB SER 5 15.241 26.640 -27.094
45 HG SER 5 HG SER 5 17.386 27.914 -26.512
46 H GLY 6 H GLY 6 13.522 28.137 -24.322
47 1HA GLY 6 2HA GLY 6 12.395 25.920 -22.927
48 2HA GLY 6 1HA GLY 6 11.555 27.399 -23.383
49 H CYS 7 H CYS 7 11.917 24.099 -24.001
50 HA CYS 7 HA CYS 7 10.306 24.361 -26.449
51 1HB CYS 7 2HB CYS 7 12.468 22.302 -25.965
52 2HB CYS 7 1HB CYS 7 11.454 22.427 -27.399
53 HG CYS 7 HG CYS 7 12.800 25.335 -27.138
54 H GLN 8 H GLN 8 8.683 22.848 -26.746
55 HA GLN 8 HA GLN 8 7.789 21.491 -24.339
56 1HB GLN 8 2HB GLN 8 6.545 21.587 -27.100
57 2HB GLN 8 1HB GLN 8 5.783 20.940 -25.655
58 1HG GLN 8 2HG GLN 8 5.797 23.156 -24.642
59 2HG GLN 8 1HG GLN 8 6.596 23.809 -26.070
60 1HE2 GLN 8 1HE2 GLN 8 4.029 24.496 -24.866
61 2HE2 GLN 8 2HE2 GLN 8 2.843 24.285 -26.108
62 H GLN 9 H GLN 9 9.515 19.952 -24.189
63 HA GLN 9 HA GLN 9 9.767 18.003 -26.326
64 1HB GLN 9 2HB GLN 9 11.210 18.246 -23.684
65 2HB GLN 9 1HB GLN 9 11.565 17.035 -24.909
66 1HG GLN 9 2HG GLN 9 12.109 18.858 -26.488
67 2HG GLN 9 1HG GLN 9 11.848 20.017 -25.187
68 1HE2 GLN 9 1HE2 GLN 9 13.954 20.754 -25.290
69 2HE2 GLN 9 2HE2 GLN 9 15.291 19.827 -24.706
70 H GLN 10 H GLN 10 8.570 18.155 -23.008
71 HA GLN 10 HA GLN 10 7.183 15.636 -23.474
72 1HB GLN 10 2HB GLN 10 9.212 14.956 -22.342
73 2HB GLN 10 1HB GLN 10 8.974 16.177 -21.102
74 1HG GLN 10 2HG GLN 10 8.427 13.951 -20.289
75 2HG GLN 10 1HG GLN 10 7.015 15.002 -20.284
76 1HE2 GLN 10 1HE2 GLN 10 7.243 12.080 -20.299
77 2HE2 GLN 10 2HE2 GLN 10 6.321 11.551 -21.669
78 H LYS 11 H LYS 11 5.163 15.661 -22.764
79 HA LYS 11 HA LYS 11 4.179 18.042 -21.396
80 1HB LYS 11 2HB LYS 11 2.634 15.657 -22.439
81 2HB LYS 11 1HB LYS 11 1.970 17.214 -21.967
82 1HG LYS 11 2HG LYS 11 2.989 18.292 -23.844
83 2HG LYS 11 1HG LYS 11 3.883 16.829 -24.260
84 1HD LYS 11 2HD LYS 11 0.877 17.116 -24.273
85 2HD LYS 11 1HD LYS 11 1.917 17.152 -25.701
86 1HE LYS 11 2HE LYS 11 2.623 14.871 -25.283
87 2HE LYS 11 1HE LYS 11 1.693 14.827 -23.786
88 1HZ LYS 11 1HZ LYS 11 0.577 15.104 -26.530
89 2HZ LYS 11 2HZ LYS 11 -0.329 15.116 -25.096
90 3HZ LYS 11 3HZ LYS 11 0.510 13.715 -25.553
91 H GLU 12 H GLU 12 4.684 14.647 -20.871
92 HA GLU 12 HA GLU 12 2.981 14.422 -18.585
93 1HB GLU 12 2HB GLU 12 5.145 12.553 -19.566
94 2HB GLU 12 1HB GLU 12 3.871 12.162 -18.416
95 1HG GLU 12 2HG GLU 12 2.187 12.434 -20.118
96 2HG GLU 12 1HG GLU 12 3.401 12.987 -21.273
97 H GLU 13 H GLU 13 3.444 14.861 -16.541
98 HA GLU 13 HA GLU 13 6.049 15.846 -15.827
99 1HB GLU 13 2HB GLU 13 3.396 15.650 -14.406
100 2HB GLU 13 1HB GLU 13 4.843 16.274 -13.647
101 1HG GLU 13 2HG GLU 13 4.983 18.071 -15.226
102 2HG GLU 13 1HG GLU 13 3.651 17.396 -16.162
103 H THR 14 H THR 14 6.317 15.170 -13.223
104 HA THR 14 HA THR 14 7.279 12.460 -13.464
105 HB THR 14 HB THR 14 8.720 14.173 -12.463
106 HG1 THR 14 1HG THR 14 8.249 12.600 -10.219
107 1HG2 THR 14 1HG2 THR 14 6.661 14.289 -10.257
108 2HG2 THR 14 2HG2 THR 14 7.030 15.572 -11.409
109 3HG2 THR 14 3HG2 THR 14 8.241 15.073 -10.230
110 HA PRO 15 HA PRO 15 3.866 10.455 -11.445
111 1HB PRO 15 2HB PRO 15 5.913 8.573 -10.418
112 2HB PRO 15 1HB PRO 15 4.483 8.250 -11.405
113 1HG PRO 15 2HG PRO 15 6.936 8.154 -12.465
114 2HG PRO 15 1HG PRO 15 5.563 8.798 -13.385
115 1HD PRO 15 2HD PRO 15 7.756 10.266 -11.971
116 2HD PRO 15 1HD PRO 15 6.999 10.607 -13.542
117 H PHE 16 H PHE 16 3.092 11.514 -9.724
118 HA PHE 16 HA PHE 16 4.699 12.476 -7.603
119 1HB PHE 16 2HB PHE 16 2.568 13.227 -6.621
120 2HB PHE 16 1HB PHE 16 2.679 13.636 -8.330
121 HD1 PHE 16 1HD PHE 16 1.291 12.474 -9.978
122 HD2 PHE 16 2HD PHE 16 0.951 11.650 -5.819
123 HE1 PHE 16 1HE PHE 16 -0.850 11.331 -10.380
124 HE2 PHE 16 2HE PHE 16 -1.190 10.515 -6.217
125 HZ PHE 16 HZ PHE 16 -2.088 10.345 -8.494
126 H TYR 17 H TYR 17 3.185 9.442 -8.082
127 HA TYR 17 HA TYR 17 2.979 8.897 -5.229
128 1HB TYR 17 2HB TYR 17 1.652 7.049 -5.802
129 2HB TYR 17 1HB TYR 17 1.192 8.274 -6.971
130 HD1 TYR 17 1HD TYR 17 2.232 8.139 -9.308
131 HD2 TYR 17 2HD TYR 17 2.442 4.950 -6.499
132 HE1 TYR 17 1HE TYR 17 2.737 6.570 -11.133
133 HE2 TYR 17 2HE TYR 17 2.951 3.374 -8.319
134 HH TYR 17 HH TYR 17 2.722 3.144 -10.671
135 H TYR 18 H TYR 18 5.309 8.642 -7.600
136 HA TYR 18 HA TYR 18 6.208 5.974 -6.983
137 1HB TYR 18 2HB TYR 18 6.366 7.030 -9.272
138 2HB TYR 18 1HB TYR 18 7.657 8.041 -8.638
139 HD1 TYR 18 2HD TYR 18 6.662 4.533 -9.252
140 HD2 TYR 18 1HD TYR 18 9.870 7.217 -8.510
141 HE1 TYR 18 2HE TYR 18 8.265 2.737 -9.733
142 HE2 TYR 18 1HE TYR 18 11.487 5.427 -8.992
143 HH TYR 18 HH TYR 18 11.671 3.089 -9.140
144 H GLY 19 H GLY 19 7.700 5.403 -5.580
145 1HA GLY 19 2HA GLY 19 10.004 6.197 -4.741
146 2HA GLY 19 1HA GLY 19 9.069 7.528 -4.075
147 H THR 20 H THR 20 10.030 6.740 -2.043
148 HA THR 20 HA THR 20 8.660 4.373 -0.977
149 HB THR 20 HB THR 20 10.988 5.852 0.262
150 HG1 THR 20 1HG THR 20 10.879 3.844 -1.707
151 1HG2 THR 20 1HG2 THR 20 11.291 3.773 1.523
152 2HG2 THR 20 2HG2 THR 20 9.881 3.074 0.728
153 3HG2 THR 20 3HG2 THR 20 9.691 4.456 1.806
154 H TRP 21 H TRP 21 7.153 4.595 0.569
155 HA TRP 21 HA TRP 21 6.808 7.266 1.772
156 1HB TRP 21 2HB TRP 21 4.638 5.273 1.073
157 2HB TRP 21 1HB TRP 21 4.393 6.860 1.791
158 HD1 TRP 21 HD TRP 21 5.249 5.170 -1.524
159 HE1 TRP 21 1HE TRP 21 4.959 6.873 -3.435
160 HE3 TRP 21 3HE TRP 21 4.416 9.373 1.268
161 HZ2 TRP 21 2HZ TRP 21 4.439 9.636 -3.713
162 HZ3 TRP 21 3HZ TRP 21 4.025 11.504 0.102
163 HH2 TRP 21 HH TRP 21 4.037 11.634 -2.339
164 H ASP 22 H ASP 22 6.342 7.371 3.938
165 HA ASP 22 HA ASP 22 6.688 4.891 5.462
166 1HB ASP 22 2HB ASP 22 8.058 6.920 6.025
167 2HB ASP 22 1HB ASP 22 6.575 7.749 6.469
168 H GLU 23 H GLU 23 5.094 4.093 6.809
169 HA GLU 23 HA GLU 23 2.440 4.378 6.219
170 1HB GLU 23 2HB GLU 23 3.328 3.860 9.046
171 2HB GLU 23 1HB GLU 23 1.934 3.203 8.205
172 1HG GLU 23 2HG GLU 23 4.817 2.518 7.711
173 2HG GLU 23 1HG GLU 23 3.615 1.506 8.502
174 H GLY 24 H GLY 24 4.186 6.001 8.852
175 1HA GLY 24 2HA GLY 24 3.923 8.120 9.706
176 2HA GLY 24 1HA GLY 24 2.701 8.420 8.484
177 H ARG 25 H ARG 25 0.747 6.638 9.054
178 HA ARG 25 HA ARG 25 -0.032 7.279 11.801
179 1HB ARG 25 2HB ARG 25 -0.775 8.978 9.964
180 2HB ARG 25 1HB ARG 25 -1.909 7.722 9.498
181 1HG ARG 25 2HG ARG 25 -2.931 7.785 11.686
182 2HG ARG 25 1HG ARG 25 -1.744 8.976 12.229
183 1HD ARG 25 2HD ARG 25 -2.550 10.461 10.366
184 2HD ARG 25 1HD ARG 25 -3.863 9.311 10.118
185 HE ARG 25 HE ARG 25 -4.286 9.813 12.632
186 1HH1 ARG 25 1HH1 ARG 25 -3.166 12.100 10.232
187 2HH1 ARG 25 2HH1 ARG 25 -3.961 13.461 10.975
188 1HH2 ARG 25 1HH2 ARG 25 -5.298 11.582 13.624
189 2HH2 ARG 25 2HH2 ARG 25 -5.154 13.170 12.928
190 H ALA 26 H ALA 26 -2.013 6.106 12.415
191 HA ALA 26 HA ALA 26 -3.361 4.291 12.613
192 1HB ALA 26 1HB ALA 26 -2.582 3.663 9.764
193 2HB ALA 26 2HB ALA 26 -3.966 4.633 10.265
194 3HB ALA 26 3HB ALA 26 -3.898 2.918 10.669
195 HA PRO 27 HA PRO 27 -0.674 0.987 13.853
196 1HB PRO 27 2HB PRO 27 -2.755 -1.013 13.360
197 2HB PRO 27 1HB PRO 27 -2.068 -0.472 14.893
198 1HG PRO 27 2HG PRO 27 -4.594 0.125 14.155
199 2HG PRO 27 1HG PRO 27 -3.604 1.221 15.136
200 1HD PRO 27 2HD PRO 27 -4.197 1.322 12.201
201 2HD PRO 27 1HD PRO 27 -4.149 2.645 13.386
202 H GLY 28 H GLY 28 0.002 -1.318 13.195
203 1HA GLY 28 2HA GLY 28 0.020 -1.528 10.255
204 2HA GLY 28 1HA GLY 28 1.518 -1.602 11.173
205 HA PRO 29 HA PRO 29 0.423 -5.981 10.182
206 1HB PRO 29 2HB PRO 29 2.993 -6.690 11.120
207 2HB PRO 29 1HB PRO 29 2.481 -6.514 9.440
208 1HG PRO 29 2HG PRO 29 3.912 -4.596 11.199
209 2HG PRO 29 1HG PRO 29 4.032 -4.823 9.445
210 1HD PRO 29 2HD PRO 29 2.748 -2.726 10.488
211 2HD PRO 29 1HD PRO 29 2.146 -3.535 9.027
212 H THR 30 H THR 30 0.053 -7.778 11.460
213 HA THR 30 HA THR 30 -0.621 -7.066 14.171
214 HB THR 30 HB THR 30 -1.646 -9.395 14.160
215 HG1 THR 30 1HG THR 30 -0.559 -10.417 12.517
216 1HG2 THR 30 1HG2 THR 30 -2.976 -7.391 13.761
217 2HG2 THR 30 2HG2 THR 30 -3.519 -8.699 12.710
218 3HG2 THR 30 3HG2 THR 30 -2.514 -7.403 12.059
219 H ASP 31 H ASP 31 2.101 -8.286 12.800
220 HA ASP 31 HA ASP 31 2.795 -10.233 14.796
221 1HB ASP 31 2HB ASP 31 4.246 -8.952 12.508
222 2HB ASP 31 1HB ASP 31 5.145 -9.864 13.716
223 H GLY 32 H GLY 32 2.484 -6.989 14.993
224 1HA GLY 32 2HA GLY 32 3.120 -5.572 16.717
225 2HA GLY 32 1HA GLY 32 4.143 -6.857 17.345
226 H VAL 33 H VAL 33 4.250 -5.607 14.079
227 HA VAL 33 HA VAL 33 7.066 -5.092 14.292
228 HB VAL 33 HB VAL 33 5.208 -4.356 12.028
229 1HG1 VAL 33 1HG1 VAL 33 7.222 -4.494 10.662
230 2HG1 VAL 33 2HG1 VAL 33 8.176 -4.812 12.113
231 3HG1 VAL 33 3HG1 VAL 33 7.358 -3.262 11.916
232 1HG2 VAL 33 1HG2 VAL 33 5.874 -6.479 10.999
233 2HG2 VAL 33 2HG2 VAL 33 5.008 -6.733 12.515
234 3HG2 VAL 33 3HG2 VAL 33 6.762 -6.901 12.464
235 H LYS 34 H LYS 34 8.065 -3.169 14.553
236 HA LYS 34 HA LYS 34 6.376 -1.097 15.640
237 1HB LYS 34 2HB LYS 34 9.314 -1.695 15.828
238 2HB LYS 34 1HB LYS 34 8.598 -0.231 16.490
239 1HG LYS 34 2HG LYS 34 7.184 -1.514 17.945
240 2HG LYS 34 1HG LYS 34 7.716 -3.016 17.204
241 1HD LYS 34 2HD LYS 34 9.666 -1.167 18.541
242 2HD LYS 34 1HD LYS 34 8.735 -2.346 19.466
243 1HE LYS 34 2HE LYS 34 9.601 -4.122 17.960
244 2HE LYS 34 1HE LYS 34 10.631 -2.915 17.190
245 1HZ LYS 34 1HZ LYS 34 11.790 -2.576 19.247
246 2HZ LYS 34 2HZ LYS 34 11.761 -4.243 18.926
247 3HZ LYS 34 3HZ LYS 34 10.713 -3.589 20.083
248 H SER 35 H SER 35 8.106 -1.601 12.751
249 HA SER 35 HA SER 35 7.348 1.084 11.941
250 1HB SER 35 2HB SER 35 10.154 0.083 11.453
251 2HB SER 35 1HB SER 35 9.487 1.631 10.955
252 HG SER 35 HG SER 35 9.121 1.360 13.586
253 H ALA 36 H ALA 36 7.340 1.344 9.618
254 HA ALA 36 HA ALA 36 7.709 -0.942 7.925
255 1HB ALA 36 1HB ALA 36 5.534 -1.478 8.970
256 2HB ALA 36 2HB ALA 36 5.397 -1.211 7.231
257 3HB ALA 36 3HB ALA 36 4.887 0.045 8.361
258 H THR 37 H THR 37 7.766 -0.382 5.777
259 HA THR 37 HA THR 37 7.015 2.359 5.046
260 HB THR 37 HB THR 37 9.090 2.310 3.510
261 HG1 THR 37 1HG THR 37 9.549 0.061 4.044
262 1HG2 THR 37 1HG2 THR 37 10.524 3.257 5.261
263 2HG2 THR 37 2HG2 THR 37 9.452 2.596 6.496
264 3HG2 THR 37 3HG2 THR 37 8.867 3.843 5.395
265 H VAL 38 H VAL 38 6.088 2.535 3.043
266 HA VAL 38 HA VAL 38 5.816 0.020 1.541
267 HB VAL 38 HB VAL 38 3.689 0.824 2.424
268 1HG1 VAL 38 1HG1 VAL 38 4.173 3.202 2.583
269 2HG1 VAL 38 2HG1 VAL 38 2.696 2.928 1.659
270 3HG1 VAL 38 3HG1 VAL 38 4.195 3.329 0.823
271 1HG2 VAL 38 1HG2 VAL 38 2.410 0.890 0.322
272 2HG2 VAL 38 2HG2 VAL 38 3.654 -0.359 0.305
273 3HG2 VAL 38 3HG2 VAL 38 3.912 1.152 -0.566
274 H THR 39 H THR 39 6.390 -0.059 -0.552
275 HA THR 39 HA THR 39 7.430 2.440 -1.732
276 HB THR 39 HB THR 39 8.549 -0.335 -2.169
277 HG1 THR 39 1HG THR 39 8.730 0.985 0.019
278 1HG2 THR 39 1HG2 THR 39 8.993 1.272 -3.978
279 2HG2 THR 39 2HG2 THR 39 10.470 0.874 -3.102
280 3HG2 THR 39 3HG2 THR 39 9.658 2.409 -2.804
281 H PHE 40 H PHE 40 6.513 2.998 -3.592
282 HA PHE 40 HA PHE 40 4.935 0.982 -5.034
283 1HB PHE 40 2HB PHE 40 4.856 4.006 -5.066
284 2HB PHE 40 1HB PHE 40 3.948 3.005 -6.192
285 HD1 PHE 40 1HD PHE 40 4.258 4.084 -2.705
286 HD2 PHE 40 2HD PHE 40 2.018 1.781 -5.490
287 HE1 PHE 40 1HE PHE 40 2.414 3.919 -1.081
288 HE2 PHE 40 2HE PHE 40 0.173 1.610 -3.876
289 HZ PHE 40 HZ PHE 40 0.367 2.681 -1.667
290 H THR 41 H THR 41 5.853 0.099 -6.723
291 HA THR 41 HA THR 41 7.909 1.584 -8.192
292 HB THR 41 HB THR 41 7.378 -1.273 -8.827
293 HG1 THR 41 1HG THR 41 7.289 -1.372 -6.582
294 1HG2 THR 41 1HG2 THR 41 9.858 -1.329 -8.867
295 2HG2 THR 41 2HG2 THR 41 9.880 0.365 -8.375
296 3HG2 THR 41 3HG2 THR 41 9.196 -0.093 -9.933
297 H GLU 42 H GLU 42 7.825 0.701 -10.663
298 HA GLU 42 HA GLU 42 5.804 2.098 -11.880
299 1HB GLU 42 2HB GLU 42 7.383 -0.185 -13.054
300 2HB GLU 42 1HB GLU 42 6.610 1.121 -13.925
301 1HG GLU 42 2HG GLU 42 8.118 2.732 -12.951
302 2HG GLU 42 1HG GLU 42 8.876 1.465 -11.986
303 H ASP 43 H ASP 43 6.004 -1.388 -11.261
304 HA ASP 43 HA ASP 43 3.207 -1.634 -12.172
305 1HB ASP 43 2HB ASP 43 4.650 -2.524 -13.892
306 2HB ASP 43 1HB ASP 43 5.536 -3.481 -12.715
307 H GLU 44 H GLU 44 5.460 -2.198 -9.697
308 HA GLU 44 HA GLU 44 3.678 -4.173 -8.436
309 1HB GLU 44 2HB GLU 44 5.651 -5.281 -7.499
310 2HB GLU 44 1HB GLU 44 5.707 -5.265 -9.257
311 1HG GLU 44 2HG GLU 44 7.104 -3.093 -8.904
312 2HG GLU 44 1HG GLU 44 7.363 -3.757 -7.293
313 H VAL 45 H VAL 45 3.208 -3.907 -6.306
314 HA VAL 45 HA VAL 45 4.396 -1.597 -4.921
315 HB VAL 45 HB VAL 45 1.973 -3.235 -4.134
316 1HG1 VAL 45 1HG1 VAL 45 3.041 -2.183 -2.220
317 2HG1 VAL 45 2HG1 VAL 45 1.513 -1.382 -2.586
318 3HG1 VAL 45 3HG1 VAL 45 3.035 -0.627 -3.053
319 1HG2 VAL 45 1HG2 VAL 45 1.544 -2.017 -6.191
320 2HG2 VAL 45 2HG2 VAL 45 2.117 -0.525 -5.444
321 3HG2 VAL 45 3HG2 VAL 45 0.648 -1.302 -4.852
322 H VAL 46 H VAL 46 5.855 -1.937 -3.358
323 HA VAL 46 HA VAL 46 6.100 -4.672 -2.293
324 HB VAL 46 HB VAL 46 8.290 -2.621 -2.639
325 1HG1 VAL 46 1HG1 VAL 46 8.640 -4.022 -0.670
326 2HG1 VAL 46 2HG1 VAL 46 9.805 -4.416 -1.934
327 3HG1 VAL 46 3HG1 VAL 46 8.421 -5.470 -1.653
328 1HG2 VAL 46 1HG2 VAL 46 7.775 -5.194 -4.128
329 2HG2 VAL 46 2HG2 VAL 46 9.216 -4.193 -4.291
330 3HG2 VAL 46 3HG2 VAL 46 7.645 -3.561 -4.784
331 H GLU 47 H GLU 47 5.625 -4.850 -0.202
332 HA GLU 47 HA GLU 47 5.773 -2.487 1.496
333 1HB GLU 47 2HB GLU 47 4.437 -5.142 1.771
334 2HB GLU 47 1HB GLU 47 4.818 -4.216 3.211
335 1HG GLU 47 2HG GLU 47 2.851 -3.259 2.909
336 2HG GLU 47 1HG GLU 47 3.641 -2.340 1.634
337 H THR 48 H THR 48 7.137 -2.258 3.141
338 HA THR 48 HA THR 48 9.018 -4.468 3.675
339 HB THR 48 HB THR 48 9.969 -1.705 4.108
340 HG1 THR 48 1HG THR 48 9.051 -2.533 1.691
341 1HG2 THR 48 1HG2 THR 48 11.374 -3.600 4.661
342 2HG2 THR 48 2HG2 THR 48 12.085 -2.694 3.326
343 3HG2 THR 48 3HG2 THR 48 11.239 -4.207 3.008
344 H GLU 49 H GLU 49 8.866 -5.095 5.684
345 HA GLU 49 HA GLU 49 7.700 -3.258 7.663
346 1HB GLU 49 2HB GLU 49 7.916 -6.257 7.897
347 2HB GLU 49 1HB GLU 49 6.914 -5.172 8.850
348 1HG GLU 49 2HG GLU 49 5.579 -4.665 6.866
349 2HG GLU 49 1HG GLU 49 6.569 -5.773 5.920
350 H VAL 50 H VAL 50 8.952 -2.582 9.295
351 HA VAL 50 HA VAL 50 11.679 -3.663 9.380
352 HB VAL 50 HB VAL 50 10.632 -1.110 10.616
353 1HG1 VAL 50 1HG1 VAL 50 13.452 -2.098 10.156
354 2HG1 VAL 50 2HG1 VAL 50 12.627 -1.967 11.710
355 3HG1 VAL 50 3HG1 VAL 50 13.013 -0.513 10.790
356 1HG2 VAL 50 1HG2 VAL 50 10.435 -0.980 8.204
357 2HG2 VAL 50 2HG2 VAL 50 12.103 -1.524 8.007
358 3HG2 VAL 50 3HG2 VAL 50 11.763 0.039 8.755
359 H MET 51 H MET 51 11.943 -5.204 10.849
360 HA MET 51 HA MET 51 10.428 -5.031 13.357
361 1HB MET 51 2HB MET 51 10.911 -7.188 11.732
362 2HB MET 51 1HB MET 51 12.156 -7.362 12.959
363 1HG MET 51 2HG MET 51 9.197 -7.148 13.451
364 2HG MET 51 1HG MET 51 10.167 -8.617 13.550
365 1HE MET 51 1HE MET 51 11.898 -9.130 15.451
366 2HE MET 51 2HE MET 51 12.383 -7.973 16.691
367 3HE MET 51 3HE MET 51 12.813 -7.693 15.003
368 H GLU 52 H GLU 52 11.422 -3.953 14.842
369 HA GLU 52 HA GLU 52 14.165 -3.267 14.762
370 1HB GLU 52 2HB GLU 52 12.470 -1.819 15.787
371 2HB GLU 52 1HB GLU 52 12.189 -3.021 17.036
372 1HG GLU 52 2HG GLU 52 14.526 -2.743 17.775
373 2HG GLU 52 1HG GLU 52 14.715 -1.456 16.581
374 H GLY 53 H GLY 53 15.694 -4.700 15.038
375 1HA GLY 53 2HA GLY 53 16.680 -5.968 17.082
376 2HA GLY 53 1HA GLY 53 15.247 -6.965 16.850
377 H ARG 54 H ARG 54 15.304 -6.640 13.935
378 HA ARG 54 HA ARG 54 17.728 -8.159 13.307
379 1HB ARG 54 2HB ARG 54 16.393 -9.425 11.650
380 2HB ARG 54 1HB ARG 54 15.918 -9.725 13.313
381 1HG ARG 54 2HG ARG 54 14.017 -8.279 13.058
382 2HG ARG 54 1HG ARG 54 14.510 -7.864 11.417
383 1HD ARG 54 2HD ARG 54 12.785 -9.513 11.272
384 2HD ARG 54 1HD ARG 54 14.310 -10.272 10.818
385 HE ARG 54 HE ARG 54 13.663 -10.598 13.602
386 1HH1 ARG 54 1HH1 ARG 54 13.260 -11.912 10.370
387 2HH1 ARG 54 2HH1 ARG 54 12.802 -13.495 10.935
388 1HH2 ARG 54 1HH2 ARG 54 13.035 -12.680 14.346
389 2HH2 ARG 54 2HH2 ARG 54 12.656 -13.919 13.186
390 H GLY 55 H GLY 55 15.105 -6.209 11.881
391 1HA GLY 55 2HA GLY 55 16.215 -4.256 10.570
392 2HA GLY 55 1HA GLY 55 16.855 -5.583 9.615
393 H GLU 56 H GLU 56 15.758 -4.704 7.787
394 HA GLU 56 HA GLU 56 12.902 -4.457 7.770
395 1HB GLU 56 2HB GLU 56 14.909 -4.434 5.510
396 2HB GLU 56 1HB GLU 56 13.225 -3.976 5.380
397 1HG GLU 56 2HG GLU 56 14.483 -1.997 5.458
398 2HG GLU 56 1HG GLU 56 13.680 -2.141 7.013
399 H VAL 57 H VAL 57 11.434 -5.720 6.797
400 HA VAL 57 HA VAL 57 12.333 -8.247 5.581
401 HB VAL 57 HB VAL 57 9.951 -7.764 7.377
402 1HG1 VAL 57 1HG1 VAL 57 9.407 -10.140 7.054
403 2HG1 VAL 57 2HG1 VAL 57 10.697 -10.268 5.858
404 3HG1 VAL 57 3HG1 VAL 57 9.303 -9.234 5.544
405 1HG2 VAL 57 1HG2 VAL 57 12.387 -9.510 7.704
406 2HG2 VAL 57 2HG2 VAL 57 10.989 -9.522 8.778
407 3HG2 VAL 57 3HG2 VAL 57 11.977 -8.068 8.634
408 H GLN 58 H GLN 58 11.737 -8.359 3.499
409 HA GLN 58 HA GLN 58 9.669 -6.561 2.521
410 1HB GLN 58 2HB GLN 58 11.634 -8.304 1.033
411 2HB GLN 58 1HB GLN 58 10.537 -7.150 0.309
412 1HG GLN 58 2HG GLN 58 11.685 -5.396 1.736
413 2HG GLN 58 1HG GLN 58 12.921 -6.614 2.031
414 1HE2 GLN 58 1HE2 GLN 58 14.198 -7.323 0.285
415 2HE2 GLN 58 2HE2 GLN 58 14.355 -6.381 -1.151
416 H LEU 59 H LEU 59 7.723 -7.233 1.873
417 HA LEU 59 HA LEU 59 7.132 -10.090 1.961
418 1HB LEU 59 2HB LEU 59 5.344 -7.669 1.725
419 2HB LEU 59 1HB LEU 59 4.758 -9.322 1.710
420 HG LEU 59 HG LEU 59 6.211 -8.009 4.002
421 1HD1 LEU 59 1HD1 LEU 59 3.302 -8.708 3.672
422 2HD1 LEU 59 2HD1 LEU 59 3.982 -7.082 3.671
423 3HD1 LEU 59 3HD1 LEU 59 4.053 -8.066 5.135
424 1HD2 LEU 59 1HD2 LEU 59 4.915 -10.716 3.754
425 2HD2 LEU 59 2HD2 LEU 59 5.530 -10.016 5.252
426 3HD2 LEU 59 3HD2 LEU 59 6.638 -10.389 3.930
427 HA PRO 60 HA PRO 60 6.865 -10.876 -2.410
428 1HB PRO 60 2HB PRO 60 4.030 -11.630 -1.904
429 2HB PRO 60 1HB PRO 60 5.302 -12.535 -2.728
430 1HG PRO 60 2HG PRO 60 4.525 -13.168 -0.246
431 2HG PRO 60 1HG PRO 60 6.215 -13.315 -0.760
432 1HD PRO 60 2HD PRO 60 4.947 -11.291 1.015
433 2HD PRO 60 1HD PRO 60 6.607 -11.916 1.008
434 H PHE 61 H PHE 61 6.705 -9.247 -3.816
435 HA PHE 61 HA PHE 61 5.182 -6.946 -3.366
436 1HB PHE 61 2HB PHE 61 5.880 -6.262 -5.628
437 2HB PHE 61 1HB PHE 61 7.222 -6.884 -4.680
438 HD1 PHE 61 2HD PHE 61 8.242 -9.031 -5.226
439 HD2 PHE 61 1HD PHE 61 5.093 -7.405 -7.583
440 HE1 PHE 61 2HE PHE 61 8.786 -10.608 -7.034
441 HE2 PHE 61 1HE PHE 61 5.630 -8.981 -9.394
442 HZ PHE 61 HZ PHE 61 7.477 -10.585 -9.121
443 H MET 62 H MET 62 3.354 -6.123 -4.287
444 HA MET 62 HA MET 62 1.576 -8.107 -5.517
445 1HB MET 62 2HB MET 62 1.032 -5.558 -4.004
446 2HB MET 62 1HB MET 62 -0.214 -6.378 -4.931
447 1HG MET 62 2HG MET 62 0.176 -8.406 -3.564
448 2HG MET 62 1HG MET 62 1.308 -7.480 -2.579
449 1HE MET 62 1HE MET 62 -1.024 -4.780 -0.973
450 2HE MET 62 2HE MET 62 -0.128 -4.619 -2.483
451 3HE MET 62 3HE MET 62 0.619 -5.410 -1.095
452 H ALA 63 H ALA 63 1.086 -7.959 -7.588
453 HA ALA 63 HA ALA 63 1.921 -5.650 -9.122
454 1HB ALA 63 1HB ALA 63 2.272 -7.876 -10.046
455 2HB ALA 63 2HB ALA 63 1.171 -6.949 -11.065
456 3HB ALA 63 3HB ALA 63 0.538 -8.192 -9.988
457 H TYR 64 H TYR 64 0.608 -4.106 -9.980
458 HA TYR 64 HA TYR 64 -2.278 -4.404 -9.489
459 1HB TYR 64 2HB TYR 64 -2.440 -2.065 -8.858
460 2HB TYR 64 1HB TYR 64 -1.279 -2.874 -7.815
461 HD1 TYR 64 2HD TYR 64 -1.709 -0.397 -10.485
462 HD2 TYR 64 1HD TYR 64 1.076 -2.294 -7.894
463 HE1 TYR 64 2HE TYR 64 -0.054 1.344 -11.004
464 HE2 TYR 64 1HE TYR 64 2.735 -0.553 -8.397
465 HH TYR 64 HH TYR 64 3.246 1.092 -10.062
466 H LYS 65 H LYS 65 -3.628 -3.060 -10.860
467 HA LYS 65 HA LYS 65 -2.328 -2.316 -13.399
468 1HB LYS 65 2HB LYS 65 -4.977 -3.679 -12.939
469 2HB LYS 65 1HB LYS 65 -4.581 -2.873 -14.453
470 1HG LYS 65 2HG LYS 65 -2.700 -4.335 -14.785
471 2HG LYS 65 1HG LYS 65 -2.984 -5.091 -13.224
472 1HD LYS 65 2HD LYS 65 -5.105 -5.970 -13.994
473 2HD LYS 65 1HD LYS 65 -4.925 -5.118 -15.532
474 1HE LYS 65 2HE LYS 65 -2.923 -6.439 -16.022
475 2HE LYS 65 1HE LYS 65 -3.110 -7.291 -14.492
476 1HZ LYS 65 1HZ LYS 65 -3.962 -8.542 -16.400
477 2HZ LYS 65 2HZ LYS 65 -5.106 -7.321 -16.695
478 3HZ LYS 65 3HZ LYS 65 -5.171 -8.222 -15.254
479 H VAL 66 H VAL 66 -3.032 -0.510 -14.415
480 HA VAL 66 HA VAL 66 -4.179 1.458 -12.605
481 HB VAL 66 HB VAL 66 -2.897 1.766 -15.319
482 1HG1 VAL 66 1HG1 VAL 66 -2.812 4.163 -14.785
483 2HG1 VAL 66 2HG1 VAL 66 -3.746 3.859 -13.320
484 3HG1 VAL 66 3HG1 VAL 66 -4.468 3.572 -14.905
485 1HG2 VAL 66 1HG2 VAL 66 -1.838 2.310 -12.550
486 2HG2 VAL 66 2HG2 VAL 66 -1.010 2.701 -14.057
487 3HG2 VAL 66 3HG2 VAL 66 -1.324 1.017 -13.636
488 H ILE 67 H ILE 67 -6.276 1.743 -12.595
489 HA ILE 67 HA ILE 67 -7.948 1.040 -14.845
490 HB ILE 67 HB ILE 67 -8.840 2.540 -12.395
491 1HG1 ILE 67 2HG1 ILE 67 -8.488 -0.454 -12.668
492 2HG1 ILE 67 1HG1 ILE 67 -7.559 0.602 -11.613
493 1HG2 ILE 67 1HG2 ILE 67 -10.961 1.387 -12.824
494 2HG2 ILE 67 2HG2 ILE 67 -10.235 0.596 -14.224
495 3HG2 ILE 67 3HG2 ILE 67 -10.445 2.348 -14.211
496 1HD1 ILE 67 1HD1 ILE 67 -10.513 0.052 -11.403
497 2HD1 ILE 67 2HD1 ILE 67 -9.582 1.112 -10.345
498 3HD1 ILE 67 3HD1 ILE 67 -9.250 -0.618 -10.372
499 H SER 68 H SER 68 -7.347 3.955 -12.949
500 HA SER 68 HA SER 68 -7.813 5.562 -15.367
501 1HB SER 68 2HB SER 68 -8.407 6.606 -12.619
502 2HB SER 68 1HB SER 68 -9.014 7.174 -14.166
503 HG SER 68 HG SER 68 -9.941 5.108 -12.550
504 H GLN 69 H GLN 69 -6.527 7.527 -15.444
505 HA GLN 69 HA GLN 69 -4.204 7.544 -13.702
506 1HB GLN 69 2HB GLN 69 -3.698 5.815 -15.396
507 2HB GLN 69 1HB GLN 69 -3.919 7.009 -16.665
508 1HG GLN 69 2HG GLN 69 -2.033 8.294 -15.763
509 2HG GLN 69 1HG GLN 69 -1.806 7.067 -14.517
510 1HE2 GLN 69 1HE2 GLN 69 -0.972 5.056 -15.090
511 2HE2 GLN 69 2HE2 GLN 69 -0.181 4.785 -16.603
512 H SER 70 H SER 70 -3.325 9.448 -13.490
513 HA SER 70 HA SER 70 -3.619 11.473 -15.571
514 1HB SER 70 2HB SER 70 -5.437 11.949 -14.025
515 2HB SER 70 1HB SER 70 -4.338 11.861 -12.654
516 HG SER 70 HG SER 70 -4.191 13.767 -14.765
517 H THR 71 H THR 71 -1.957 13.079 -15.472
518 HA THR 71 HA THR 71 0.480 11.932 -14.410
519 HB THR 71 HB THR 71 0.980 14.421 -15.687
520 HG1 THR 71 1HG THR 71 -0.876 14.457 -16.816
521 1HG2 THR 71 1HG2 THR 71 2.116 13.009 -17.327
522 2HG2 THR 71 2HG2 THR 71 1.279 11.588 -16.702
523 3HG2 THR 71 3HG2 THR 71 2.445 12.442 -15.691
524 H ASP 72 H ASP 72 -1.787 14.151 -13.292
525 HA ASP 72 HA ASP 72 0.110 15.179 -11.352
526 1HB ASP 72 2HB ASP 72 -0.594 17.501 -11.691
527 2HB ASP 72 1HB ASP 72 0.161 16.842 -13.134
528 H GLY 73 H GLY 73 -3.179 14.548 -12.290
529 1HA GLY 73 2HA GLY 73 -4.313 15.755 -9.938
530 2HA GLY 73 1HA GLY 73 -5.162 14.773 -11.123
531 H SER 74 H SER 74 -4.718 12.422 -11.019
532 HA SER 74 HA SER 74 -3.880 11.315 -8.522
533 1HB SER 74 2HB SER 74 -6.240 10.281 -8.257
534 2HB SER 74 1HB SER 74 -5.976 11.926 -7.690
535 HG SER 74 HG SER 74 -6.791 12.582 -9.799
536 H ILE 75 H ILE 75 -4.168 8.930 -8.503
537 HA ILE 75 HA ILE 75 -4.558 7.774 -11.177
538 HB ILE 75 HB ILE 75 -2.374 6.870 -9.293
539 1HG1 ILE 75 2HG1 ILE 75 -2.232 8.721 -11.678
540 2HG1 ILE 75 1HG1 ILE 75 -1.735 9.058 -10.029
541 1HG2 ILE 75 1HG2 ILE 75 -2.931 6.215 -12.180
542 2HG2 ILE 75 2HG2 ILE 75 -3.223 5.156 -10.801
543 3HG2 ILE 75 3HG2 ILE 75 -1.574 5.615 -11.229
544 1HD1 ILE 75 1HD1 ILE 75 0.085 7.451 -10.243
545 2HD1 ILE 75 2HD1 ILE 75 0.179 8.711 -11.473
546 3HD1 ILE 75 3HD1 ILE 75 -0.414 7.106 -11.900
547 H GLU 76 H GLU 76 -5.724 5.901 -11.185
548 HA GLU 76 HA GLU 76 -6.521 4.841 -8.552
549 1HB GLU 76 2HB GLU 76 -8.352 5.920 -9.846
550 2HB GLU 76 1HB GLU 76 -8.064 4.772 -11.143
551 1HG GLU 76 2HG GLU 76 -8.663 2.933 -9.673
552 2HG GLU 76 1HG GLU 76 -8.944 4.075 -8.359
553 H ILE 77 H ILE 77 -6.223 2.706 -8.188
554 HA ILE 77 HA ILE 77 -5.180 1.090 -10.415
555 HB ILE 77 HB ILE 77 -3.446 0.160 -8.926
556 1HG1 ILE 77 2HG1 ILE 77 -4.262 2.367 -7.018
557 2HG1 ILE 77 1HG1 ILE 77 -4.583 0.650 -6.781
558 1HG2 ILE 77 1HG2 ILE 77 -3.314 3.159 -9.219
559 2HG2 ILE 77 2HG2 ILE 77 -2.893 1.975 -10.456
560 3HG2 ILE 77 3HG2 ILE 77 -1.941 2.080 -8.975
561 1HD1 ILE 77 1HD1 ILE 77 -1.872 1.964 -6.904
562 2HD1 ILE 77 2HD1 ILE 77 -2.165 0.234 -6.721
563 3HD1 ILE 77 3HD1 ILE 77 -2.687 1.353 -5.464
564 H GLN 78 H GLN 78 -5.243 -1.176 -10.087
565 HA GLN 78 HA GLN 78 -7.211 -2.063 -8.076
566 1HB GLN 78 2HB GLN 78 -8.038 -1.922 -10.478
567 2HB GLN 78 1HB GLN 78 -6.894 -3.199 -10.855
568 1HG GLN 78 2HG GLN 78 -8.020 -4.727 -9.400
569 2HG GLN 78 1HG GLN 78 -9.092 -3.449 -8.817
570 1HE2 GLN 78 1HE2 GLN 78 -10.979 -4.406 -9.483
571 2HE2 GLN 78 2HE2 GLN 78 -11.400 -4.617 -11.150
572 H TYR 79 H TYR 79 -6.595 -3.787 -6.878
573 HA TYR 79 HA TYR 79 -3.918 -4.801 -7.299
574 1HB TYR 79 2HB TYR 79 -5.916 -5.283 -5.084
575 2HB TYR 79 1HB TYR 79 -4.298 -5.975 -5.125
576 HD1 TYR 79 2HD TYR 79 -2.488 -3.941 -5.779
577 HD2 TYR 79 1HD TYR 79 -6.106 -3.567 -3.575
578 HE1 TYR 79 2HE TYR 79 -1.597 -1.937 -4.669
579 HE2 TYR 79 1HE TYR 79 -5.227 -1.559 -2.461
580 HH TYR 79 HH TYR 79 -2.902 -0.625 -1.917
581 H LEU 80 H LEU 80 -3.389 -6.993 -7.415
582 HA LEU 80 HA LEU 80 -5.553 -8.737 -8.380
583 1HB LEU 80 2HB LEU 80 -2.634 -8.737 -9.171
584 2HB LEU 80 1HB LEU 80 -3.841 -9.875 -9.741
585 HG LEU 80 HG LEU 80 -3.931 -6.899 -10.259
586 1HD1 LEU 80 1HD1 LEU 80 -3.069 -9.173 -12.047
587 2HD1 LEU 80 2HD1 LEU 80 -2.029 -7.908 -11.390
588 3HD1 LEU 80 3HD1 LEU 80 -3.289 -7.500 -12.555
589 1HD2 LEU 80 1HD2 LEU 80 -5.645 -7.518 -11.909
590 2HD2 LEU 80 2HD2 LEU 80 -6.127 -7.937 -10.264
591 3HD2 LEU 80 3HD2 LEU 80 -5.553 -9.192 -11.364
592 H GLY 81 H GLY 81 -4.493 -11.185 -8.261
593 1HA GLY 81 2HA GLY 81 -3.698 -12.849 -6.834
594 2HA GLY 81 1HA GLY 81 -3.059 -11.590 -5.781
595 HA PRO 82 HA PRO 82 -6.622 -13.435 -3.475
596 1HB PRO 82 2HB PRO 82 -5.037 -12.341 -1.226
597 2HB PRO 82 1HB PRO 82 -5.738 -13.950 -1.432
598 1HG PRO 82 2HG PRO 82 -3.104 -13.552 -1.645
599 2HG PRO 82 1HG PRO 82 -3.948 -14.712 -2.690
600 1HD PRO 82 2HD PRO 82 -2.993 -11.942 -3.314
601 2HD PRO 82 1HD PRO 82 -2.944 -13.405 -4.320
602 H TYR 83 H TYR 83 -5.299 -10.325 -3.865
603 HA TYR 83 HA TYR 83 -7.540 -9.069 -2.424
604 1HB TYR 83 2HB TYR 83 -4.919 -7.834 -3.319
605 2HB TYR 83 1HB TYR 83 -6.165 -7.043 -2.358
606 HD1 TYR 83 1HD TYR 83 -6.533 -7.716 -0.010
607 HD2 TYR 83 2HD TYR 83 -3.377 -9.380 -2.331
608 HE1 TYR 83 1HE TYR 83 -5.477 -8.562 2.041
609 HE2 TYR 83 2HE TYR 83 -2.315 -10.231 -0.286
610 HH TYR 83 HH TYR 83 -3.935 -10.336 2.698
611 H TYR 84 H TYR 84 -7.527 -10.316 -5.074
612 HA TYR 84 HA TYR 84 -7.449 -8.548 -7.203
613 1HB TYR 84 2HB TYR 84 -8.816 -10.200 -8.383
614 2HB TYR 84 1HB TYR 84 -7.559 -10.988 -7.441
615 HD1 TYR 84 2HD TYR 84 -8.218 -12.071 -5.234
616 HD2 TYR 84 1HD TYR 84 -11.072 -10.750 -8.097
617 HE1 TYR 84 2HE TYR 84 -9.911 -13.530 -4.212
618 HE2 TYR 84 1HE TYR 84 -12.767 -12.216 -7.091
619 HH TYR 84 HH TYR 84 -12.350 -13.714 -4.062
620 HA PRO 85 HA PRO 85 -10.085 -5.857 -8.690
621 1HB PRO 85 2HB PRO 85 -12.497 -7.427 -7.849
622 2HB PRO 85 1HB PRO 85 -12.358 -6.237 -9.156
623 1HG PRO 85 2HG PRO 85 -11.840 -8.967 -9.424
624 2HG PRO 85 1HG PRO 85 -11.273 -7.704 -10.532
625 1HD PRO 85 2HD PRO 85 -9.618 -9.351 -8.963
626 2HD PRO 85 1HD PRO 85 -9.123 -7.811 -9.703
627 H LEU 86 H LEU 86 -10.063 -6.606 -5.378
628 HA LEU 86 HA LEU 86 -11.550 -4.310 -4.532
629 1HB LEU 86 2HB LEU 86 -10.932 -6.234 -3.041
630 2HB LEU 86 1HB LEU 86 -9.264 -5.696 -3.111
631 HG LEU 86 HG LEU 86 -9.911 -3.575 -2.029
632 1HD1 LEU 86 1HD1 LEU 86 -12.638 -4.854 -1.829
633 2HD1 LEU 86 2HD1 LEU 86 -12.219 -3.450 -2.810
634 3HD1 LEU 86 3HD1 LEU 86 -12.146 -3.350 -1.051
635 1HD2 LEU 86 1HD2 LEU 86 -10.808 -6.032 -0.523
636 2HD2 LEU 86 2HD2 LEU 86 -10.323 -4.493 0.189
637 3HD2 LEU 86 3HD2 LEU 86 -9.142 -5.473 -0.681
638 H LYS 87 H LYS 87 -10.983 -2.348 -5.291
639 HA LYS 87 HA LYS 87 -8.202 -1.992 -6.115
640 1HB LYS 87 2HB LYS 87 -9.036 -0.239 -7.597
641 2HB LYS 87 1HB LYS 87 -9.879 -1.758 -7.858
642 1HG LYS 87 2HG LYS 87 -11.704 -0.838 -6.359
643 2HG LYS 87 1HG LYS 87 -10.896 0.724 -6.516
644 1HD LYS 87 2HD LYS 87 -11.081 0.542 -8.967
645 2HD LYS 87 1HD LYS 87 -11.947 -0.980 -8.771
646 1HE LYS 87 2HE LYS 87 -13.614 0.629 -9.105
647 2HE LYS 87 1HE LYS 87 -13.611 0.336 -7.367
648 1HZ LYS 87 1HZ LYS 87 -12.330 2.626 -8.765
649 2HZ LYS 87 2HZ LYS 87 -12.244 2.341 -7.098
650 3HZ LYS 87 3HZ LYS 87 -13.736 2.682 -7.823
651 H SER 88 H SER 88 -7.577 0.421 -6.208
652 HA SER 88 HA SER 88 -8.178 1.734 -3.673
653 1HB SER 88 2HB SER 88 -6.322 0.261 -3.123
654 2HB SER 88 1HB SER 88 -5.416 0.821 -4.525
655 HG SER 88 HG SER 88 -6.271 2.580 -2.483
656 H THR 89 H THR 89 -7.308 3.929 -3.600
657 HA THR 89 HA THR 89 -6.823 5.037 -6.291
658 HB THR 89 HB THR 89 -8.193 6.643 -4.178
659 HG1 THR 89 1HG THR 89 -9.248 4.464 -4.631
660 1HG2 THR 89 1HG2 THR 89 -9.211 7.724 -6.134
661 2HG2 THR 89 2HG2 THR 89 -8.387 6.581 -7.193
662 3HG2 THR 89 3HG2 THR 89 -7.451 7.736 -6.244
663 H LEU 90 H LEU 90 -5.282 6.587 -6.449
664 HA LEU 90 HA LEU 90 -3.832 7.312 -3.986
665 1HB LEU 90 2HB LEU 90 -2.708 6.825 -6.750
666 2HB LEU 90 1HB LEU 90 -1.788 7.455 -5.399
667 HG LEU 90 HG LEU 90 -3.072 4.727 -5.498
668 1HD1 LEU 90 1HD1 LEU 90 -1.223 4.887 -7.055
669 2HD1 LEU 90 2HD1 LEU 90 -0.767 3.904 -5.664
670 3HD1 LEU 90 3HD1 LEU 90 -0.194 5.566 -5.793
671 1HD2 LEU 90 1HD2 LEU 90 -1.218 5.976 -3.470
672 2HD2 LEU 90 2HD2 LEU 90 -1.776 4.304 -3.466
673 3HD2 LEU 90 3HD2 LEU 90 -2.931 5.615 -3.231
674 H LYS 91 H LYS 91 -3.849 9.393 -3.571
675 HA LYS 91 HA LYS 91 -3.976 11.334 -5.772
676 1HB LYS 91 2HB LYS 91 -5.757 11.295 -3.331
677 2HB LYS 91 1HB LYS 91 -5.605 12.669 -4.411
678 1HG LYS 91 2HG LYS 91 -6.802 11.691 -6.066
679 2HG LYS 91 1HG LYS 91 -6.309 10.061 -5.614
680 1HD LYS 91 2HD LYS 91 -8.696 10.468 -5.194
681 2HD LYS 91 1HD LYS 91 -7.811 10.104 -3.714
682 1HE LYS 91 2HE LYS 91 -7.726 12.471 -3.163
683 2HE LYS 91 1HE LYS 91 -8.558 12.863 -4.668
684 1HZ LYS 91 1HZ LYS 91 -9.726 11.092 -2.599
685 2HZ LYS 91 2HZ LYS 91 -10.510 11.807 -3.927
686 3HZ LYS 91 3HZ LYS 91 -9.993 12.771 -2.635
687 H ARG 92 H ARG 92 -3.034 13.349 -5.251
688 HA ARG 92 HA ARG 92 -1.152 13.161 -3.054
689 1HB ARG 92 2HB ARG 92 -0.103 15.136 -4.037
690 2HB ARG 92 1HB ARG 92 -0.276 13.849 -5.217
691 1HG ARG 92 2HG ARG 92 -2.228 14.947 -6.137
692 2HG ARG 92 1HG ARG 92 -2.088 16.226 -4.936
693 1HD ARG 92 2HD ARG 92 0.055 16.891 -5.840
694 2HD ARG 92 1HD ARG 92 0.011 15.551 -6.988
695 HE ARG 92 HE ARG 92 -1.741 16.652 -8.161
696 1HH1 ARG 92 1HH1 ARG 92 -0.317 18.558 -5.583
697 2HH1 ARG 92 2HH1 ARG 92 -0.869 20.078 -6.231
698 1HH2 ARG 92 1HH2 ARG 92 -2.500 18.640 -9.000
699 2HH2 ARG 92 2HH2 ARG 92 -2.118 20.123 -8.168
700 H GLY 93 H GLY 93 -0.998 14.675 -1.400
701 1HA GLY 93 2HA GLY 93 -3.455 16.269 -1.016
702 2HA GLY 93 1HA GLY 93 -2.484 15.603 0.292
703 H GLU 94 H GLU 94 -2.546 17.873 1.065
704 HA GLU 94 HA GLU 94 -1.106 19.904 -0.230
705 1HB GLU 94 2HB GLU 94 -1.508 19.412 2.727
706 2HB GLU 94 1HB GLU 94 -0.932 20.908 2.019
707 1HG GLU 94 2HG GLU 94 -3.100 21.471 2.243
708 2HG GLU 94 1HG GLU 94 -3.205 20.699 0.665
709 H ASN 95 H ASN 95 1.023 20.402 -0.284
710 HA ASN 95 HA ASN 95 3.267 20.165 -0.183
711 1HB ASN 95 2HB ASN 95 2.681 18.571 2.330
712 2HB ASN 95 1HB ASN 95 4.276 19.112 1.828
713 1HD2 ASN 95 1HD2 ASN 95 3.327 21.681 0.853
714 2HD2 ASN 95 2HD2 ASN 95 2.957 22.628 2.259
715 H GLY 96 H GLY 96 4.745 17.851 0.691
716 1HA GLY 96 2HA GLY 96 4.227 16.184 -1.638
717 2HA GLY 96 1HA GLY 96 5.675 16.166 -0.642
718 H THR 97 H THR 97 2.195 15.639 -0.088
719 HA THR 97 HA THR 97 2.910 13.083 1.173
720 HB THR 97 HB THR 97 0.869 13.332 2.595
721 HG1 THR 97 1HG THR 97 0.938 16.067 1.778
722 1HG2 THR 97 1HG2 THR 97 1.867 14.933 4.169
723 2HG2 THR 97 2HG2 THR 97 2.967 15.480 2.903
724 3HG2 THR 97 3HG2 THR 97 3.070 13.827 3.508
725 H LEU 98 H LEU 98 1.486 11.336 0.858
726 HA LEU 98 HA LEU 98 -0.267 11.687 -1.482
727 1HB LEU 98 2HB LEU 98 1.787 10.205 -1.722
728 2HB LEU 98 1HB LEU 98 1.023 9.109 -0.588
729 HG LEU 98 HG LEU 98 -0.889 8.881 -2.183
730 1HD1 LEU 98 1HD1 LEU 98 0.934 10.423 -4.027
731 2HD1 LEU 98 2HD1 LEU 98 -0.620 10.969 -3.400
732 3HD1 LEU 98 3HD1 LEU 98 -0.551 9.599 -4.509
733 1HD2 LEU 98 1HD2 LEU 98 0.941 7.242 -2.072
734 2HD2 LEU 98 2HD2 LEU 98 1.818 8.153 -3.302
735 3HD2 LEU 98 3HD2 LEU 98 0.279 7.387 -3.698
736 H ILE 99 H ILE 99 -2.337 11.167 -1.287
737 HA ILE 99 HA ILE 99 -3.281 10.123 1.276
738 HB ILE 99 HB ILE 99 -4.844 11.367 -0.995
739 1HG1 ILE 99 2HG1 ILE 99 -4.029 12.558 1.670
740 2HG1 ILE 99 1HG1 ILE 99 -3.313 12.964 0.113
741 1HG2 ILE 99 1HG2 ILE 99 -6.698 11.480 0.596
742 2HG2 ILE 99 2HG2 ILE 99 -5.712 10.655 1.805
743 3HG2 ILE 99 3HG2 ILE 99 -6.181 9.814 0.328
744 1HD1 ILE 99 1HD1 ILE 99 -5.462 13.839 -0.641
745 2HD1 ILE 99 2HD1 ILE 99 -4.900 14.652 0.820
746 3HD1 ILE 99 3HD1 ILE 99 -6.171 13.433 0.922
747 H TRP 100 H TRP 100 -3.568 8.043 1.382
748 HA TRP 100 HA TRP 100 -3.980 6.493 -1.064
749 1HB TRP 100 2HB TRP 100 -2.124 5.925 0.530
750 2HB TRP 100 1HB TRP 100 -3.341 5.545 1.743
751 HD1 TRP 100 HD TRP 100 -4.209 4.395 -1.736
752 HE1 TRP 100 1HE TRP 100 -3.922 1.849 -1.896
753 HE3 TRP 100 3HE TRP 100 -1.807 3.576 2.705
754 HZ2 TRP 100 2HZ TRP 100 -2.814 -0.237 -0.342
755 HZ3 TRP 100 3HZ TRP 100 -1.167 1.275 3.291
756 HH2 TRP 100 HH TRP 100 -1.662 -0.592 1.797
757 H GLU 101 H GLU 101 -6.018 6.088 -1.588
758 HA GLU 101 HA GLU 101 -7.978 5.718 0.575
759 1HB GLU 101 2HB GLU 101 -8.234 6.668 -2.242
760 2HB GLU 101 1HB GLU 101 -9.606 5.889 -1.479
761 1HG GLU 101 2HG GLU 101 -9.530 7.513 0.330
762 2HG GLU 101 1HG GLU 101 -8.156 8.299 -0.433
763 H GLN 102 H GLN 102 -8.951 3.914 0.849
764 HA GLN 102 HA GLN 102 -8.963 1.828 -1.172
765 1HB GLN 102 2HB GLN 102 -6.836 1.800 0.509
766 2HB GLN 102 1HB GLN 102 -7.996 0.901 1.477
767 1HG GLN 102 2HG GLN 102 -7.264 0.203 -1.358
768 2HG GLN 102 1HG GLN 102 -6.502 -0.500 0.063
769 1HE2 GLN 102 1HE2 GLN 102 -8.047 -1.726 -2.102
770 2HE2 GLN 102 2HE2 GLN 102 -9.336 -2.577 -1.329
771 H ASN 103 H ASN 103 -10.799 0.686 -1.035
772 HA ASN 103 HA ASN 103 -12.737 -0.218 -0.269
773 1HB ASN 103 2HB ASN 103 -11.129 -0.153 2.048
774 2HB ASN 103 1HB ASN 103 -12.700 0.465 2.526
775 1HD2 ASN 103 1HD2 ASN 103 -10.904 -2.243 1.394
776 2HD2 ASN 103 2HD2 ASN 103 -12.135 -3.435 1.639
777 H GLY 104 H GLY 104 -11.893 2.852 1.192
778 1HA GLY 104 2HA GLY 104 -13.836 4.415 0.093
779 2HA GLY 104 1HA GLY 104 -14.614 3.710 1.503
780 H GLN 105 H GLN 105 -11.758 3.707 2.738
781 HA GLN 105 HA GLN 105 -12.045 6.424 3.802
782 1HB GLN 105 2HB GLN 105 -10.811 5.580 5.770
783 2HB GLN 105 1HB GLN 105 -12.309 4.707 5.478
784 1HG GLN 105 2HG GLN 105 -11.066 2.875 4.473
785 2HG GLN 105 1HG GLN 105 -9.559 3.758 4.709
786 1HE2 GLN 105 1HE2 GLN 105 -12.137 3.823 7.030
787 2HE2 GLN 105 2HE2 GLN 105 -11.344 2.887 8.247
788 H ARG 106 H ARG 106 -10.349 7.823 3.913
789 HA ARG 106 HA ARG 106 -8.033 7.145 2.277
790 1HB ARG 106 2HB ARG 106 -7.726 9.611 2.175
791 2HB ARG 106 1HB ARG 106 -9.227 9.046 1.471
792 1HG ARG 106 2HG ARG 106 -10.348 9.660 3.626
793 2HG ARG 106 1HG ARG 106 -8.833 10.426 4.111
794 1HD ARG 106 2HD ARG 106 -10.374 12.057 3.158
795 2HD ARG 106 1HD ARG 106 -8.939 11.878 2.148
796 HE ARG 106 HE ARG 106 -10.923 10.121 1.223
797 1HH1 ARG 106 1HH1 ARG 106 -10.252 13.557 1.396
798 2HH1 ARG 106 2HH1 ARG 106 -11.216 13.933 0.000
799 1HH2 ARG 106 1HH2 ARG 106 -12.158 10.628 -0.638
800 2HH2 ARG 106 2HH2 ARG 106 -12.285 12.279 -1.152
801 H LYS 107 H LYS 107 -6.007 7.174 3.044
802 HA LYS 107 HA LYS 107 -5.549 8.333 5.711
803 1HB LYS 107 2HB LYS 107 -4.742 5.674 4.639
804 2HB LYS 107 1HB LYS 107 -3.614 6.514 5.699
805 1HG LYS 107 2HG LYS 107 -6.486 5.942 6.386
806 2HG LYS 107 1HG LYS 107 -5.113 4.955 6.887
807 1HD LYS 107 2HD LYS 107 -4.271 6.586 8.287
808 2HD LYS 107 1HD LYS 107 -5.140 7.883 7.460
809 1HE LYS 107 2HE LYS 107 -6.538 5.702 8.970
810 2HE LYS 107 1HE LYS 107 -6.007 7.192 9.740
811 1HZ LYS 107 1HZ LYS 107 -7.913 6.966 7.477
812 2HZ LYS 107 2HZ LYS 107 -7.357 8.427 8.123
813 3HZ LYS 107 3HZ LYS 107 -8.299 7.384 9.072
814 H THR 108 H THR 108 -3.883 9.715 5.856
815 HA THR 108 HA THR 108 -2.388 10.249 3.405
816 HB THR 108 HB THR 108 -3.445 12.199 4.380
817 HG1 THR 108 1HG THR 108 -1.594 13.524 4.510
818 1HG2 THR 108 1HG2 THR 108 -1.823 11.633 6.863
819 2HG2 THR 108 2HG2 THR 108 -3.571 11.464 6.708
820 3HG2 THR 108 3HG2 THR 108 -2.826 13.058 6.588
821 H MET 109 H MET 109 -0.330 9.762 3.169
822 HA MET 109 HA MET 109 1.199 8.981 5.554
823 1HB MET 109 2HB MET 109 2.365 7.301 4.121
824 2HB MET 109 1HB MET 109 0.666 6.951 4.396
825 1HG MET 109 2HG MET 109 0.155 7.889 2.169
826 2HG MET 109 1HG MET 109 1.881 8.122 1.904
827 1HE MET 109 1HE MET 109 0.944 5.095 -0.432
828 2HE MET 109 2HE MET 109 1.611 6.726 -0.363
829 3HE MET 109 3HE MET 109 -0.099 6.458 -0.023
830 H THR 110 H THR 110 3.455 9.387 5.485
831 HA THR 110 HA THR 110 4.025 11.784 3.914
832 HB THR 110 HB THR 110 5.881 10.827 6.036
833 HG1 THR 110 1HG THR 110 4.314 12.083 7.492
834 1HG2 THR 110 1HG2 THR 110 4.754 13.533 5.304
835 2HG2 THR 110 2HG2 THR 110 6.320 12.897 4.802
836 3HG2 THR 110 3HG2 THR 110 6.009 13.232 6.506
837 H ARG 111 H ARG 111 6.006 12.040 2.814
838 HA ARG 111 HA ARG 111 6.882 9.582 1.561
839 1HB ARG 111 2HB ARG 111 7.589 10.883 -0.190
840 2HB ARG 111 1HB ARG 111 6.420 11.999 0.507
841 1HG ARG 111 2HG ARG 111 8.409 12.880 1.871
842 2HG ARG 111 1HG ARG 111 9.399 12.037 0.690
843 1HD ARG 111 2HD ARG 111 8.417 13.321 -1.112
844 2HD ARG 111 1HD ARG 111 7.330 14.123 0.024
845 HE ARG 111 HE ARG 111 10.147 14.412 0.625
846 1HH1 ARG 111 1HH1 ARG 111 7.379 15.769 -1.031
847 2HH1 ARG 111 2HH1 ARG 111 8.026 17.380 -1.094
848 1HH2 ARG 111 1HH2 ARG 111 11.021 16.505 0.550
849 2HH2 ARG 111 2HH2 ARG 111 10.108 17.800 -0.159
850 H ILE 112 H ILE 112 9.042 8.915 1.452
851 HA ILE 112 HA ILE 112 10.853 9.960 3.494
852 HB ILE 112 HB ILE 112 11.214 7.610 1.640
853 1HG1 ILE 112 2HG1 ILE 112 9.255 7.451 3.221
854 2HG1 ILE 112 1HG1 ILE 112 10.465 6.203 3.414
855 1HG2 ILE 112 1HG2 ILE 112 13.306 8.536 2.524
856 2HG2 ILE 112 2HG2 ILE 112 12.979 6.926 3.169
857 3HG2 ILE 112 3HG2 ILE 112 12.682 8.352 4.164
858 1HD1 ILE 112 1HD1 ILE 112 11.413 7.497 5.308
859 2HD1 ILE 112 2HD1 ILE 112 9.767 6.926 5.571
860 3HD1 ILE 112 3HD1 ILE 112 10.056 8.614 5.149
861 H GLU 113 H GLU 113 12.956 10.685 2.863
862 HA GLU 113 HA GLU 113 12.900 11.997 0.268
863 1HB GLU 113 2HB GLU 113 15.013 12.218 2.403
864 2HB GLU 113 1HB GLU 113 14.809 13.273 1.018
865 1HG GLU 113 2HG GLU 113 13.016 13.043 3.421
866 2HG GLU 113 1HG GLU 113 14.008 14.417 2.942
867 H SER 114 H SER 114 13.135 10.158 -0.988
868 HA SER 114 HA SER 114 15.468 8.482 -0.730
869 1HB SER 114 2HB SER 114 13.358 8.539 -2.908
870 2HB SER 114 1HB SER 114 14.531 7.254 -2.621
871 HG SER 114 HG SER 114 13.160 6.456 -1.262
872 H LYS 115 H LYS 115 17.319 8.628 -1.853
873 HA LYS 115 HA LYS 115 17.786 11.007 -3.391
874 1HB LYS 115 2HB LYS 115 19.473 9.950 -1.843
875 2HB LYS 115 1HB LYS 115 19.654 8.666 -3.031
876 1HG LYS 115 2HG LYS 115 20.480 10.213 -4.666
877 2HG LYS 115 1HG LYS 115 20.144 11.580 -3.602
878 1HD LYS 115 2HD LYS 115 21.757 10.628 -1.968
879 2HD LYS 115 1HD LYS 115 22.155 9.380 -3.150
880 1HE LYS 115 2HE LYS 115 22.908 11.084 -4.719
881 2HE LYS 115 1HE LYS 115 22.462 12.352 -3.577
882 1HZ LYS 115 1HZ LYS 115 24.107 11.491 -2.028
883 2HZ LYS 115 2HZ LYS 115 24.835 11.889 -3.511
884 3HZ LYS 115 3HZ LYS 115 24.532 10.266 -3.124
885 H THR 116 H THR 116 16.471 10.848 -5.157
886 HA THR 116 HA THR 116 17.476 9.208 -7.328
887 HB THR 116 HB THR 116 14.561 9.073 -6.508
888 HG1 THR 116 1HG THR 116 16.728 7.606 -5.742
889 1HG2 THR 116 1HG2 THR 116 14.349 7.383 -8.248
890 2HG2 THR 116 2HG2 THR 116 16.055 7.563 -8.658
891 3HG2 THR 116 3HG2 THR 116 14.935 8.896 -8.938
892 H GLY 117 H GLY 117 17.253 10.268 -9.272
893 1HA GLY 117 2HA GLY 117 15.449 11.935 -10.278
894 2HA GLY 117 1HA GLY 117 16.216 12.988 -9.099
895 H ARG 118 H ARG 118 18.877 12.033 -9.403
896 HA ARG 118 HA ARG 118 19.502 13.192 -11.992
897 1HB ARG 118 2HB ARG 118 21.818 13.313 -11.132
898 2HB ARG 118 1HB ARG 118 20.674 14.166 -10.119
899 1HG ARG 118 2HG ARG 118 21.697 13.124 -8.431
900 2HG ARG 118 1HG ARG 118 20.768 11.707 -8.925
901 1HD ARG 118 2HD ARG 118 22.664 11.105 -10.451
902 2HD ARG 118 1HD ARG 118 23.587 12.417 -9.728
903 HE ARG 118 HE ARG 118 23.740 11.197 -7.727
904 1HH1 ARG 118 1HH1 ARG 118 21.909 9.450 -10.160
905 2HH1 ARG 118 2HH1 ARG 118 22.154 7.894 -9.410
906 1HH2 ARG 118 1HH2 ARG 118 24.098 9.157 -6.774
907 2HH2 ARG 118 2HH2 ARG 118 23.435 7.728 -7.507
908 H GLU 119 H GLU 119 19.124 11.594 -13.461
909 HA GLU 119 HA GLU 119 20.926 9.299 -13.360
910 1HB GLU 119 2HB GLU 119 17.925 9.067 -13.524
911 2HB GLU 119 1HB GLU 119 19.021 7.761 -13.947
912 1HG GLU 119 2HG GLU 119 19.909 7.822 -11.640
913 2HG GLU 119 1HG GLU 119 18.699 9.045 -11.246
914 H GLU 120 H GLU 120 21.941 9.324 -15.230
915 HA GLU 120 HA GLU 120 22.215 8.733 -17.402
916 1HB GLU 120 2HB GLU 120 20.020 7.509 -16.873
917 2HB GLU 120 1HB GLU 120 19.235 8.803 -17.760
918 1HG GLU 120 2HG GLU 120 20.127 8.136 -19.781
919 2HG GLU 120 1HG GLU 120 21.458 7.259 -19.019
920 H LYS 121 H LYS 121 22.456 9.710 -19.398
921 HA LYS 121 HA LYS 121 21.008 12.218 -19.847
922 1HB LYS 121 2HB LYS 121 22.991 13.309 -20.703
923 2HB LYS 121 1HB LYS 121 23.310 12.749 -19.067
924 1HG LYS 121 2HG LYS 121 24.746 11.074 -19.783
925 2HG LYS 121 1HG LYS 121 24.084 11.071 -21.419
926 1HD LYS 121 2HD LYS 121 25.058 13.319 -21.782
927 2HD LYS 121 1HD LYS 121 25.784 13.239 -20.175
928 1HE LYS 121 2HE LYS 121 27.150 11.378 -20.817
929 2HE LYS 121 1HE LYS 121 26.306 11.223 -22.356
930 1HZ LYS 121 1HZ LYS 121 27.906 13.600 -21.566
931 2HZ LYS 121 2HZ LYS 121 27.234 13.282 -23.096
932 3HZ LYS 121 3HZ LYS 121 28.505 12.320 -22.508
933 H ASP 122 H ASP 122 20.292 12.514 -21.903
934 HA ASP 122 HA ASP 122 21.256 10.630 -23.952
935 1HB ASP 122 2HB ASP 122 18.890 10.215 -23.281
936 2HB ASP 122 1HB ASP 122 18.483 11.838 -23.828
937 H GLU 123 H GLU 123 21.861 11.494 -25.877
938 HA GLU 123 HA GLU 123 22.020 14.431 -25.864
939 1HB GLU 123 2HB GLU 123 24.017 12.478 -27.017
940 2HB GLU 123 1HB GLU 123 24.191 14.227 -26.943
941 1HG GLU 123 2HG GLU 123 24.227 14.150 -24.519
942 2HG GLU 123 1HG GLU 123 23.978 12.407 -24.553
943 H LYS 124 H LYS 124 20.525 15.123 -27.208
944 HA LYS 124 HA LYS 124 20.410 13.966 -29.913
945 1HB LYS 124 2HB LYS 124 18.331 13.635 -28.671
946 2HB LYS 124 1HB LYS 124 18.247 15.351 -28.309
947 1HG LYS 124 2HG LYS 124 18.044 15.797 -30.740
948 2HG LYS 124 1HG LYS 124 17.976 14.054 -31.011
949 1HD LYS 124 2HD LYS 124 15.975 13.912 -29.615
950 2HD LYS 124 1HD LYS 124 16.052 15.651 -29.321
951 1HE LYS 124 2HE LYS 124 15.779 16.044 -31.738
952 2HE LYS 124 1HE LYS 124 15.648 14.302 -31.988
953 1HZ LYS 124 1HZ LYS 124 13.682 14.292 -30.573
954 2HZ LYS 124 2HZ LYS 124 13.473 15.328 -31.897
955 3HZ LYS 124 3HZ LYS 124 13.801 15.971 -30.364
956 H SER 125 H SER 125 21.473 15.258 -31.301
957 HA SER 125 HA SER 125 20.917 18.119 -31.250
958 1HB SER 125 2HB SER 125 23.420 18.565 -31.488
959 2HB SER 125 1HB SER 125 22.853 18.097 -29.883
960 HG SER 125 HG SER 125 23.410 15.849 -31.056
961 H LYS 126 H LYS 126 20.732 18.963 -33.218
962 HA LYS 126 HA LYS 126 22.198 17.814 -35.459
963 1HB LYS 126 2HB LYS 126 19.212 17.930 -35.263
964 2HB LYS 126 1HB LYS 126 19.977 18.178 -36.826
965 1HG LYS 126 2HG LYS 126 21.087 16.002 -36.609
966 2HG LYS 126 1HG LYS 126 20.266 15.754 -35.067
967 1HD LYS 126 2HD LYS 126 18.121 15.748 -36.131
968 2HD LYS 126 1HD LYS 126 18.828 16.242 -37.671
969 1HE LYS 126 2HE LYS 126 18.296 13.855 -37.649
970 2HE LYS 126 1HE LYS 126 20.027 14.133 -37.818
971 1HZ LYS 126 1HZ LYS 126 18.658 13.446 -35.272
972 2HZ LYS 126 2HZ LYS 126 20.331 13.619 -35.499
973 3HZ LYS 126 3HZ LYS 126 19.502 12.348 -36.251
974 H SER 127 H SER 127 23.002 19.334 -36.753
975 HA SER 127 HA SER 127 21.707 21.940 -36.933
976 1HB SER 127 2HB SER 127 24.073 22.976 -36.646
977 2HB SER 127 1HB SER 127 23.193 22.484 -35.199
978 HG SER 127 HG SER 127 24.462 20.349 -35.882
979 H LEU 128 H LEU 128 21.330 22.004 -39.056
980 HA LEU 128 HA LEU 128 23.454 22.139 -40.940
981 1HB LEU 128 2HB LEU 128 23.379 19.700 -40.644
982 2HB LEU 128 1HB LEU 128 21.674 19.701 -41.048
983 HG LEU 128 HG LEU 128 22.248 20.507 -43.330
984 1HD1 LEU 128 1HD1 LEU 128 24.357 21.609 -42.802
985 2HD1 LEU 128 2HD1 LEU 128 24.572 20.402 -44.070
986 3HD1 LEU 128 3HD1 LEU 128 25.086 20.049 -42.421
987 1HD2 LEU 128 1HD2 LEU 128 23.145 18.383 -44.121
988 2HD2 LEU 128 2HD2 LEU 128 21.917 18.132 -42.880
989 3HD2 LEU 128 3HD2 LEU 128 23.625 17.964 -42.476
990 H GLU 129 H GLU 129 22.788 23.567 -42.397
991 HA GLU 129 HA GLU 129 19.919 23.626 -43.055
992 1HB GLU 129 2HB GLU 129 20.321 26.058 -43.658
993 2HB GLU 129 1HB GLU 129 20.368 25.658 -41.949
994 1HG GLU 129 2HG GLU 129 22.203 26.956 -42.030
995 2HG GLU 129 1HG GLU 129 22.965 25.435 -42.487
996 H HIS 130 H HIS 130 19.778 24.998 -45.335
997 HA HIS 130 HA HIS 130 21.675 23.836 -47.206
998 1HB HIS 130 2HB HIS 130 19.736 22.845 -48.543
999 2HB HIS 130 1HB HIS 130 20.220 21.983 -47.089
1000 HD1 HIS 130 1HD HIS 130 18.352 21.305 -45.625
1001 HD2 HIS 130 2HD HIS 130 17.367 24.610 -47.959
1002 HE1 HIS 130 1HE HIS 130 15.941 21.815 -45.106
1003 HE2 HIS 130 2HE HIS 130 15.422 23.919 -46.397
1004 H HIS 131 H HIS 131 21.461 24.634 -49.368
1005 HA HIS 131 HA HIS 131 19.877 27.113 -49.597
1006 1HB HIS 131 2HB HIS 131 22.775 26.733 -50.392
1007 2HB HIS 131 1HB HIS 131 21.800 28.124 -50.845
1008 HD1 HIS 131 1HD HIS 131 21.970 30.072 -49.314
1009 HD2 HIS 131 2HD HIS 131 23.055 26.517 -47.456
1010 HE1 HIS 131 1HE HIS 131 22.787 30.722 -47.027
1011 HE2 HIS 131 2HE HIS 131 23.168 28.527 -45.846
1012 H HIS 132 H HIS 132 18.914 27.435 -51.542
1013 HA HIS 132 HA HIS 132 19.976 26.067 -53.872
1014 1HB HIS 132 2HB HIS 132 17.752 25.249 -54.608
1015 2HB HIS 132 1HB HIS 132 18.354 24.439 -53.172
1016 HD1 HIS 132 1HD HIS 132 16.972 24.606 -51.059
1017 HD2 HIS 132 2HD HIS 132 15.474 26.909 -54.179
1018 HE1 HIS 132 1HE HIS 132 14.685 25.349 -50.317
1019 HE2 HIS 132 2HE HIS 132 13.722 26.562 -52.308
1020 H HIS 133 H HIS 133 20.386 27.630 -55.188
1021 HA HIS 133 HA HIS 133 18.773 30.042 -55.257
1022 1HB HIS 133 2HB HIS 133 21.228 30.175 -55.419
1023 2HB HIS 133 1HB HIS 133 21.189 29.208 -56.887
1024 HD1 HIS 133 1HD HIS 133 21.575 30.616 -58.848
1025 HD2 HIS 133 2HD HIS 133 19.411 32.630 -55.924
1026 HE1 HIS 133 1HE HIS 133 21.128 32.906 -59.793
1027 HE2 HIS 133 2HE HIS 133 20.090 34.182 -57.880
1028 H HIS 134 H HIS 134 17.107 30.351 -56.600
1029 HA HIS 134 HA HIS 134 16.263 28.237 -58.321
1030 1HB HIS 134 2HB HIS 134 14.690 29.763 -57.105
1031 2HB HIS 134 1HB HIS 134 15.169 31.058 -58.197
1032 HD1 HIS 134 1HD HIS 134 14.264 30.959 -60.634
1033 HD2 HIS 134 2HD HIS 134 13.011 27.813 -58.216
1034 HE1 HIS 134 1HE HIS 134 12.401 29.832 -61.892
1035 HE2 HIS 134 2HE HIS 134 11.535 28.058 -60.331
1036 H HIS 135 H HIS 135 16.912 27.851 -60.281
1037 HA HIS 135 HA HIS 135 18.428 29.824 -61.770
1038 1HB HIS 135 2HB HIS 135 17.692 26.960 -62.438
1039 2HB HIS 135 1HB HIS 135 18.776 27.972 -63.386
1040 HD1 HIS 135 1HD HIS 135 18.550 26.229 -60.050
1041 HD2 HIS 135 2HD HIS 135 21.372 28.104 -62.460
1042 HE1 HIS 135 1HE HIS 135 20.779 25.721 -59.003
1043 HE2 HIS 135 2HE HIS 135 22.475 26.895 -60.455
Start of MODEL 17
1 1H MET 1 1HT MET 1 12.716 32.709 -12.714
2 2H MET 1 2HT MET 1 13.376 31.423 -13.603
3 3H MET 1 3HT MET 1 13.558 31.470 -11.918
4 HA MET 1 HA MET 1 10.988 31.190 -13.353
5 1HB MET 1 2HB MET 1 12.393 29.191 -13.565
6 2HB MET 1 1HB MET 1 12.637 29.162 -11.823
7 1HG MET 1 2HG MET 1 10.213 28.817 -11.529
8 2HG MET 1 1HG MET 1 10.037 28.747 -13.282
9 1HE MET 1 1HE MET 1 8.856 26.349 -13.133
10 2HE MET 1 2HE MET 1 8.973 26.449 -11.376
11 3HE MET 1 3HE MET 1 9.529 25.001 -12.213
12 H ILE 2 H ILE 2 9.627 32.387 -12.173
13 HA ILE 2 HA ILE 2 9.824 32.604 -9.308
14 HB ILE 2 HB ILE 2 8.876 34.418 -10.721
15 1HG1 ILE 2 2HG1 ILE 2 6.889 34.899 -9.295
16 2HG1 ILE 2 1HG1 ILE 2 6.985 33.256 -8.661
17 1HG2 ILE 2 1HG2 ILE 2 7.704 33.097 -12.369
18 2HG2 ILE 2 2HG2 ILE 2 6.587 34.213 -11.580
19 3HG2 ILE 2 3HG2 ILE 2 6.589 32.506 -11.136
20 1HD1 ILE 2 1HD1 ILE 2 9.170 33.737 -7.724
21 2HD1 ILE 2 2HD1 ILE 2 7.974 34.897 -7.147
22 3HD1 ILE 2 3HD1 ILE 2 9.123 35.362 -8.404
23 H MET 3 H MET 3 8.394 31.676 -7.774
24 HA MET 3 HA MET 3 7.462 29.054 -8.473
25 1HB MET 3 2HB MET 3 7.333 30.616 -5.896
26 2HB MET 3 1HB MET 3 6.686 28.992 -6.068
27 1HG MET 3 2HG MET 3 8.952 28.217 -6.723
28 2HG MET 3 1HG MET 3 9.555 29.836 -6.371
29 1HE MET 3 1HE MET 3 7.838 26.623 -4.865
30 2HE MET 3 2HE MET 3 6.721 27.922 -4.449
31 3HE MET 3 3HE MET 3 7.633 27.105 -3.181
32 H VAL 4 H VAL 4 5.801 29.311 -9.922
33 HA VAL 4 HA VAL 4 3.337 30.458 -8.798
34 HB VAL 4 HB VAL 4 3.906 31.645 -10.809
35 1HG1 VAL 4 1HG1 VAL 4 5.411 30.043 -11.834
36 2HG1 VAL 4 2HG1 VAL 4 4.170 30.540 -12.984
37 3HG1 VAL 4 3HG1 VAL 4 4.064 28.967 -12.190
38 1HG2 VAL 4 1HG2 VAL 4 1.705 29.664 -11.373
39 2HG2 VAL 4 2HG2 VAL 4 1.941 31.209 -12.194
40 3HG2 VAL 4 3HG2 VAL 4 1.550 31.172 -10.475
41 H SER 5 H SER 5 2.086 28.933 -7.982
42 HA SER 5 HA SER 5 2.355 26.193 -8.818
43 1HB SER 5 2HB SER 5 0.456 27.443 -6.818
44 2HB SER 5 1HB SER 5 0.770 25.718 -7.008
45 HG SER 5 HG SER 5 2.971 26.148 -6.439
46 H GLY 6 H GLY 6 1.483 25.660 -10.694
47 1HA GLY 6 2HA GLY 6 -1.390 25.943 -11.015
48 2HA GLY 6 1HA GLY 6 -0.404 26.731 -12.241
49 H CYS 7 H CYS 7 -2.137 24.787 -13.022
50 HA CYS 7 HA CYS 7 -0.799 22.232 -13.108
51 1HB CYS 7 2HB CYS 7 -3.211 23.160 -14.687
52 2HB CYS 7 1HB CYS 7 -2.700 21.496 -14.419
53 HG CYS 7 HG CYS 7 -3.491 21.275 -11.870
54 H GLN 8 H GLN 8 1.183 22.714 -14.128
55 HA GLN 8 HA GLN 8 0.923 23.016 -17.042
56 1HB GLN 8 2HB GLN 8 3.051 24.307 -15.324
57 2HB GLN 8 1HB GLN 8 3.029 24.309 -17.081
58 1HG GLN 8 2HG GLN 8 0.840 25.514 -16.971
59 2HG GLN 8 1HG GLN 8 1.076 25.650 -15.229
60 1HE2 GLN 8 1HE2 GLN 8 0.873 27.748 -17.239
61 2HE2 GLN 8 2HE2 GLN 8 2.339 28.660 -17.143
62 H GLN 9 H GLN 9 1.615 21.254 -17.982
63 HA GLN 9 HA GLN 9 4.104 20.049 -17.121
64 1HB GLN 9 2HB GLN 9 2.784 17.743 -17.497
65 2HB GLN 9 1HB GLN 9 2.974 18.495 -15.923
66 1HG GLN 9 2HG GLN 9 0.749 18.028 -15.884
67 2HG GLN 9 1HG GLN 9 0.709 19.657 -16.546
68 1HE2 GLN 9 1HE2 GLN 9 0.075 19.953 -18.675
69 2HE2 GLN 9 2HE2 GLN 9 -0.658 18.702 -19.608
70 H GLN 10 H GLN 10 5.327 19.530 -18.777
71 HA GLN 10 HA GLN 10 4.254 19.804 -21.455
72 1HB GLN 10 2HB GLN 10 6.430 20.813 -20.869
73 2HB GLN 10 1HB GLN 10 7.075 19.211 -20.532
74 1HG GLN 10 2HG GLN 10 6.599 18.609 -22.908
75 2HG GLN 10 1HG GLN 10 6.184 20.300 -23.191
76 1HE2 GLN 10 1HE2 GLN 10 8.720 19.238 -21.034
77 2HE2 GLN 10 2HE2 GLN 10 10.037 19.840 -21.980
78 H LYS 11 H LYS 11 3.254 18.123 -22.302
79 HA LYS 11 HA LYS 11 2.896 16.077 -23.198
80 1HB LYS 11 2HB LYS 11 5.242 16.096 -23.878
81 2HB LYS 11 1HB LYS 11 5.721 15.493 -22.299
82 1HG LYS 11 2HG LYS 11 4.417 13.425 -22.755
83 2HG LYS 11 1HG LYS 11 4.114 14.032 -24.385
84 1HD LYS 11 2HD LYS 11 6.520 14.098 -24.807
85 2HD LYS 11 1HD LYS 11 6.826 13.503 -23.174
86 1HE LYS 11 2HE LYS 11 5.620 11.440 -23.699
87 2HE LYS 11 1HE LYS 11 5.308 12.035 -25.329
88 1HZ LYS 11 1HZ LYS 11 7.749 12.150 -25.638
89 2HZ LYS 11 2HZ LYS 11 7.168 10.574 -25.404
90 3HZ LYS 11 3HZ LYS 11 7.951 11.388 -24.135
91 H GLU 12 H GLU 12 4.993 15.102 -20.523
92 HA GLU 12 HA GLU 12 2.940 14.272 -18.773
93 1HB GLU 12 2HB GLU 12 2.596 12.601 -20.595
94 2HB GLU 12 1HB GLU 12 4.252 12.059 -20.372
95 1HG GLU 12 2HG GLU 12 3.724 11.354 -18.101
96 2HG GLU 12 1HG GLU 12 2.069 11.926 -18.306
97 H GLU 13 H GLU 13 3.840 13.639 -16.801
98 HA GLU 13 HA GLU 13 6.752 13.873 -16.663
99 1HB GLU 13 2HB GLU 13 4.517 14.784 -15.004
100 2HB GLU 13 1HB GLU 13 5.819 14.046 -14.085
101 1HG GLU 13 2HG GLU 13 6.141 16.313 -16.042
102 2HG GLU 13 1HG GLU 13 6.047 16.484 -14.289
103 H THR 14 H THR 14 7.297 12.811 -14.277
104 HA THR 14 HA THR 14 6.966 9.966 -14.725
105 HB THR 14 HB THR 14 9.172 11.118 -14.097
106 HG1 THR 14 1HG THR 14 9.472 9.041 -13.828
107 1HG2 THR 14 1HG2 THR 14 9.593 11.441 -11.708
108 2HG2 THR 14 2HG2 THR 14 7.901 11.084 -11.360
109 3HG2 THR 14 3HG2 THR 14 8.328 12.524 -12.287
110 HA PRO 15 HA PRO 15 3.677 9.282 -11.818
111 1HB PRO 15 2HB PRO 15 5.328 7.087 -10.674
112 2HB PRO 15 1HB PRO 15 3.681 7.042 -11.313
113 1HG PRO 15 2HG PRO 15 5.704 6.025 -12.711
114 2HG PRO 15 1HG PRO 15 4.394 6.913 -13.515
115 1HD PRO 15 2HD PRO 15 7.171 7.811 -12.863
116 2HD PRO 15 1HD PRO 15 6.183 8.145 -14.301
117 H PHE 16 H PHE 16 3.398 10.667 -10.177
118 HA PHE 16 HA PHE 16 5.461 11.574 -8.499
119 1HB PHE 16 2HB PHE 16 3.653 12.678 -7.202
120 2HB PHE 16 1HB PHE 16 3.545 12.974 -8.932
121 HD1 PHE 16 1HD PHE 16 1.747 12.003 -10.250
122 HD2 PHE 16 2HD PHE 16 1.978 11.384 -6.045
123 HE1 PHE 16 1HE PHE 16 -0.594 11.243 -10.235
124 HE2 PHE 16 2HE PHE 16 -0.360 10.618 -6.025
125 HZ PHE 16 HZ PHE 16 -1.652 10.543 -8.121
126 H TYR 17 H TYR 17 3.256 8.907 -8.187
127 HA TYR 17 HA TYR 17 3.761 8.587 -5.366
128 1HB TYR 17 2HB TYR 17 2.255 6.700 -5.495
129 2HB TYR 17 1HB TYR 17 1.544 8.075 -6.320
130 HD1 TYR 17 2HD TYR 17 1.939 8.127 -8.932
131 HD2 TYR 17 1HD TYR 17 2.247 4.632 -6.525
132 HE1 TYR 17 2HE TYR 17 1.580 6.730 -10.922
133 HE2 TYR 17 1HE TYR 17 1.885 3.225 -8.510
134 HH TYR 17 HH TYR 17 2.214 4.255 -11.580
135 H TYR 18 H TYR 18 5.552 7.955 -8.018
136 HA TYR 18 HA TYR 18 6.451 5.292 -7.437
137 1HB TYR 18 2HB TYR 18 6.499 6.335 -9.702
138 2HB TYR 18 1HB TYR 18 7.762 7.417 -9.147
139 HD1 TYR 18 2HD TYR 18 6.933 3.961 -10.058
140 HD2 TYR 18 1HD TYR 18 10.035 6.640 -8.909
141 HE1 TYR 18 2HE TYR 18 8.610 2.309 -10.754
142 HE2 TYR 18 1HE TYR 18 11.721 4.995 -9.616
143 HH TYR 18 HH TYR 18 11.907 2.570 -9.962
144 H GLY 19 H GLY 19 7.905 4.703 -6.005
145 1HA GLY 19 2HA GLY 19 10.243 5.320 -5.192
146 2HA GLY 19 1HA GLY 19 9.473 6.814 -4.671
147 H THR 20 H THR 20 10.190 6.307 -2.530
148 HA THR 20 HA THR 20 8.717 4.101 -1.239
149 HB THR 20 HB THR 20 11.120 5.543 -0.116
150 HG1 THR 20 1HG THR 20 11.061 3.893 -2.216
151 1HG2 THR 20 1HG2 THR 20 9.792 4.306 1.512
152 2HG2 THR 20 2HG2 THR 20 11.338 3.500 1.241
153 3HG2 THR 20 3HG2 THR 20 9.870 2.865 0.499
154 H TRP 21 H TRP 21 7.244 4.562 0.312
155 HA TRP 21 HA TRP 21 7.130 7.328 1.335
156 1HB TRP 21 2HB TRP 21 4.780 5.507 0.764
157 2HB TRP 21 1HB TRP 21 4.696 7.160 1.362
158 HD1 TRP 21 HD TRP 21 5.514 5.175 -1.823
159 HE1 TRP 21 1HE TRP 21 5.293 6.745 -3.848
160 HE3 TRP 21 3HE TRP 21 4.739 9.576 0.659
161 HZ2 TRP 21 2HZ TRP 21 4.858 9.499 -4.321
162 HZ3 TRP 21 3HZ TRP 21 4.425 11.628 -0.657
163 HH2 TRP 21 HH TRP 21 4.482 11.588 -3.093
164 H ASP 22 H ASP 22 6.873 7.581 3.504
165 HA ASP 22 HA ASP 22 6.852 5.133 5.129
166 1HB ASP 22 2HB ASP 22 8.787 6.479 5.544
167 2HB ASP 22 1HB ASP 22 7.811 7.931 5.729
168 H GLU 23 H GLU 23 5.165 4.616 6.333
169 HA GLU 23 HA GLU 23 3.040 6.578 6.756
170 1HB GLU 23 2HB GLU 23 3.036 3.650 7.513
171 2HB GLU 23 1HB GLU 23 1.654 4.729 7.433
172 1HG GLU 23 2HG GLU 23 1.937 4.889 5.001
173 2HG GLU 23 1HG GLU 23 3.293 3.766 5.101
174 H GLY 24 H GLY 24 4.464 7.753 8.230
175 1HA GLY 24 2HA GLY 24 5.232 6.523 10.714
176 2HA GLY 24 1HA GLY 24 5.414 8.214 10.292
177 H ARG 25 H ARG 25 2.405 6.319 10.360
178 HA ARG 25 HA ARG 25 1.601 7.287 12.905
179 1HB ARG 25 2HB ARG 25 1.303 9.282 11.239
180 2HB ARG 25 1HB ARG 25 -0.090 8.370 10.669
181 1HG ARG 25 2HG ARG 25 -1.112 8.457 12.835
182 2HG ARG 25 1HG ARG 25 0.334 9.178 13.540
183 1HD ARG 25 2HD ARG 25 -1.013 11.020 13.253
184 2HD ARG 25 1HD ARG 25 -0.057 11.041 11.774
185 HE ARG 25 HE ARG 25 -2.625 9.682 11.650
186 1HH1 ARG 25 1HH1 ARG 25 -0.718 12.532 10.950
187 2HH1 ARG 25 2HH1 ARG 25 -1.918 13.253 9.925
188 1HH2 ARG 25 1HH2 ARG 25 -4.223 10.621 10.309
189 2HH2 ARG 25 2HH2 ARG 25 -3.907 12.149 9.546
190 H ALA 26 H ALA 26 -0.596 6.567 13.431
191 HA ALA 26 HA ALA 26 -2.274 5.048 13.531
192 1HB ALA 26 1HB ALA 26 -2.776 5.619 11.192
193 2HB ALA 26 2HB ALA 26 -3.086 3.920 11.546
194 3HB ALA 26 3HB ALA 26 -1.635 4.382 10.657
195 HA PRO 27 HA PRO 27 -0.083 1.509 14.913
196 1HB PRO 27 2HB PRO 27 -2.603 -0.001 14.847
197 2HB PRO 27 1HB PRO 27 -1.615 0.466 16.233
198 1HG PRO 27 2HG PRO 27 -4.003 1.603 15.749
199 2HG PRO 27 1HG PRO 27 -2.655 2.516 16.451
200 1HD PRO 27 2HD PRO 27 -3.655 2.481 13.627
201 2HD PRO 27 1HD PRO 27 -3.126 3.858 14.618
202 H GLY 28 H GLY 28 0.952 -0.223 14.068
203 1HA GLY 28 2HA GLY 28 0.363 -0.964 11.335
204 2HA GLY 28 1HA GLY 28 1.734 -1.488 12.296
205 HA PRO 29 HA PRO 29 -1.117 -5.158 11.623
206 1HB PRO 29 2HB PRO 29 1.532 -6.430 11.743
207 2HB PRO 29 1HB PRO 29 0.223 -6.656 10.582
208 1HG PRO 29 2HG PRO 29 2.507 -5.278 10.018
209 2HG PRO 29 1HG PRO 29 0.957 -4.993 9.217
210 1HD PRO 29 2HD PRO 29 2.380 -3.331 11.185
211 2HD PRO 29 1HD PRO 29 1.121 -2.886 10.022
212 H THR 30 H THR 30 -1.265 -7.071 12.930
213 HA THR 30 HA THR 30 -1.119 -6.425 15.691
214 HB THR 30 HB THR 30 -1.903 -8.981 14.283
215 HG1 THR 30 1HG THR 30 -3.515 -6.922 15.436
216 1HG2 THR 30 1HG2 THR 30 -3.002 -9.612 16.350
217 2HG2 THR 30 2HG2 THR 30 -2.432 -8.135 17.126
218 3HG2 THR 30 3HG2 THR 30 -1.276 -9.370 16.626
219 H ASP 31 H ASP 31 0.963 -8.194 13.554
220 HA ASP 31 HA ASP 31 2.071 -9.948 15.506
221 1HB ASP 31 2HB ASP 31 2.826 -9.219 12.705
222 2HB ASP 31 1HB ASP 31 3.922 -10.177 13.696
223 H GLY 32 H GLY 32 2.302 -6.810 15.719
224 1HA GLY 32 2HA GLY 32 3.676 -5.760 17.318
225 2HA GLY 32 1HA GLY 32 4.871 -7.028 17.090
226 H VAL 33 H VAL 33 3.445 -5.388 14.385
227 HA VAL 33 HA VAL 33 6.049 -4.306 13.666
228 HB VAL 33 HB VAL 33 3.457 -4.092 12.137
229 1HG1 VAL 33 1HG1 VAL 33 5.172 -2.527 11.416
230 2HG1 VAL 33 2HG1 VAL 33 4.899 -3.766 10.189
231 3HG1 VAL 33 3HG1 VAL 33 6.319 -3.853 11.234
232 1HG2 VAL 33 1HG2 VAL 33 4.194 -6.045 10.855
233 2HG2 VAL 33 2HG2 VAL 33 3.970 -6.445 12.559
234 3HG2 VAL 33 3HG2 VAL 33 5.595 -6.209 11.914
235 H LYS 34 H LYS 34 6.559 -2.167 13.737
236 HA LYS 34 HA LYS 34 4.997 -0.447 15.362
237 1HB LYS 34 2HB LYS 34 7.386 0.127 13.603
238 2HB LYS 34 1HB LYS 34 6.712 1.248 14.771
239 1HG LYS 34 2HG LYS 34 7.288 -1.293 15.997
240 2HG LYS 34 1HG LYS 34 8.713 -0.628 15.198
241 1HD LYS 34 2HD LYS 34 8.591 0.101 17.525
242 2HD LYS 34 1HD LYS 34 8.426 1.469 16.426
243 1HE LYS 34 2HE LYS 34 6.012 1.447 16.736
244 2HE LYS 34 1HE LYS 34 6.148 0.037 17.786
245 1HZ LYS 34 1HZ LYS 34 5.926 2.102 19.042
246 2HZ LYS 34 2HZ LYS 34 7.353 2.695 18.335
247 3HZ LYS 34 3HZ LYS 34 7.412 1.341 19.351
248 H SER 35 H SER 35 5.682 -0.655 11.964
249 HA SER 35 HA SER 35 3.273 0.441 11.078
250 1HB SER 35 2HB SER 35 4.287 2.581 10.079
251 2HB SER 35 1HB SER 35 3.924 2.606 11.803
252 HG SER 35 HG SER 35 6.210 3.159 10.684
253 H ALA 36 H ALA 36 3.582 1.126 8.644
254 HA ALA 36 HA ALA 36 5.546 -0.743 7.492
255 1HB ALA 36 1HB ALA 36 2.750 -0.187 6.507
256 2HB ALA 36 2HB ALA 36 3.274 -1.642 7.356
257 3HB ALA 36 3HB ALA 36 3.920 -1.273 5.758
258 H THR 37 H THR 37 6.426 -0.217 5.491
259 HA THR 37 HA THR 37 5.923 2.527 4.553
260 HB THR 37 HB THR 37 8.249 2.381 3.551
261 HG1 THR 37 1HG THR 37 8.598 0.149 3.711
262 1HG2 THR 37 1HG2 THR 37 8.043 2.265 6.565
263 2HG2 THR 37 2HG2 THR 37 7.815 3.699 5.564
264 3HG2 THR 37 3HG2 THR 37 9.397 2.928 5.649
265 H VAL 38 H VAL 38 5.633 2.803 2.332
266 HA VAL 38 HA VAL 38 5.185 0.261 0.919
267 HB VAL 38 HB VAL 38 3.096 1.446 1.353
268 1HG1 VAL 38 1HG1 VAL 38 4.270 3.687 -0.273
269 2HG1 VAL 38 2HG1 VAL 38 3.931 3.723 1.459
270 3HG1 VAL 38 3HG1 VAL 38 2.606 3.589 0.302
271 1HG2 VAL 38 1HG2 VAL 38 3.905 1.453 -1.549
272 2HG2 VAL 38 2HG2 VAL 38 2.244 1.524 -0.961
273 3HG2 VAL 38 3HG2 VAL 38 3.232 0.095 -0.648
274 H THR 39 H THR 39 6.203 -0.106 -0.915
275 HA THR 39 HA THR 39 7.641 2.131 -2.178
276 HB THR 39 HB THR 39 8.402 -0.798 -2.255
277 HG1 THR 39 1HG THR 39 8.731 0.991 -0.315
278 1HG2 THR 39 1HG2 THR 39 9.166 0.497 -4.201
279 2HG2 THR 39 2HG2 THR 39 10.518 0.020 -3.176
280 3HG2 THR 39 3HG2 THR 39 9.913 1.674 -3.115
281 H PHE 40 H PHE 40 6.848 2.681 -4.096
282 HA PHE 40 HA PHE 40 5.281 0.689 -5.576
283 1HB PHE 40 2HB PHE 40 5.426 3.699 -5.833
284 2HB PHE 40 1HB PHE 40 4.531 2.667 -6.941
285 HD1 PHE 40 1HD PHE 40 2.593 1.342 -6.068
286 HD2 PHE 40 2HD PHE 40 4.514 4.359 -3.766
287 HE1 PHE 40 1HE PHE 40 0.626 1.463 -4.598
288 HE2 PHE 40 2HE PHE 40 2.550 4.485 -2.288
289 HZ PHE 40 HZ PHE 40 0.604 3.035 -2.704
290 H THR 41 H THR 41 6.319 -0.362 -7.106
291 HA THR 41 HA THR 41 8.573 0.944 -8.442
292 HB THR 41 HB THR 41 9.239 -1.273 -9.249
293 HG1 THR 41 1HG THR 41 6.888 -2.093 -7.888
294 1HG2 THR 41 1HG2 THR 41 8.752 -1.211 -6.272
295 2HG2 THR 41 2HG2 THR 41 10.130 -0.500 -7.112
296 3HG2 THR 41 3HG2 THR 41 9.908 -2.250 -7.104
297 H GLU 42 H GLU 42 8.682 -0.248 -10.825
298 HA GLU 42 HA GLU 42 6.989 1.348 -12.315
299 1HB GLU 42 2HB GLU 42 9.176 0.335 -12.992
300 2HB GLU 42 1HB GLU 42 8.325 -1.175 -13.278
301 1HG GLU 42 2HG GLU 42 7.145 -0.304 -15.090
302 2HG GLU 42 1HG GLU 42 7.486 1.362 -14.621
303 H ASP 43 H ASP 43 6.647 -2.141 -11.601
304 HA ASP 43 HA ASP 43 3.905 -1.945 -12.683
305 1HB ASP 43 2HB ASP 43 5.476 -3.182 -14.179
306 2HB ASP 43 1HB ASP 43 5.704 -4.362 -12.890
307 H GLU 44 H GLU 44 5.786 -2.690 -9.977
308 HA GLU 44 HA GLU 44 3.647 -4.394 -8.876
309 1HB GLU 44 2HB GLU 44 6.616 -4.718 -8.413
310 2HB GLU 44 1HB GLU 44 5.341 -5.738 -7.757
311 1HG GLU 44 2HG GLU 44 4.811 -6.624 -9.866
312 2HG GLU 44 1HG GLU 44 5.731 -5.380 -10.706
313 H VAL 45 H VAL 45 3.325 -4.297 -6.605
314 HA VAL 45 HA VAL 45 4.435 -1.886 -5.323
315 HB VAL 45 HB VAL 45 1.898 -3.392 -4.645
316 1HG1 VAL 45 1HG1 VAL 45 2.920 -2.433 -2.663
317 2HG1 VAL 45 2HG1 VAL 45 1.453 -1.551 -3.090
318 3HG1 VAL 45 3HG1 VAL 45 3.035 -0.865 -3.461
319 1HG2 VAL 45 1HG2 VAL 45 0.738 -1.394 -5.431
320 2HG2 VAL 45 2HG2 VAL 45 1.705 -2.127 -6.711
321 3HG2 VAL 45 3HG2 VAL 45 2.284 -0.678 -5.889
322 H VAL 46 H VAL 46 5.703 -2.151 -3.568
323 HA VAL 46 HA VAL 46 5.791 -4.837 -2.355
324 HB VAL 46 HB VAL 46 8.065 -2.854 -2.550
325 1HG1 VAL 46 1HG1 VAL 46 9.450 -4.670 -1.675
326 2HG1 VAL 46 2HG1 VAL 46 8.021 -5.693 -1.526
327 3HG1 VAL 46 3HG1 VAL 46 8.169 -4.239 -0.540
328 1HG2 VAL 46 1HG2 VAL 46 9.083 -4.453 -4.104
329 2HG2 VAL 46 2HG2 VAL 46 7.567 -3.808 -4.730
330 3HG2 VAL 46 3HG2 VAL 46 7.618 -5.435 -4.049
331 H GLU 47 H GLU 47 5.111 -4.888 -0.311
332 HA GLU 47 HA GLU 47 5.073 -2.415 1.241
333 1HB GLU 47 2HB GLU 47 3.618 -4.998 1.404
334 2HB GLU 47 1HB GLU 47 3.911 -4.143 2.910
335 1HG GLU 47 2HG GLU 47 2.742 -2.227 2.138
336 2HG GLU 47 1HG GLU 47 2.634 -2.884 0.510
337 H THR 48 H THR 48 6.201 -2.093 3.007
338 HA THR 48 HA THR 48 8.094 -4.207 3.825
339 HB THR 48 HB THR 48 9.101 -1.610 4.506
340 HG1 THR 48 1HG THR 48 7.858 -1.727 2.088
341 1HG2 THR 48 1HG2 THR 48 10.439 -3.645 4.290
342 2HG2 THR 48 2HG2 THR 48 11.046 -2.374 3.233
343 3HG2 THR 48 3HG2 THR 48 10.095 -3.698 2.560
344 H GLU 49 H GLU 49 7.756 -4.836 5.830
345 HA GLU 49 HA GLU 49 6.302 -3.059 7.660
346 1HB GLU 49 2HB GLU 49 6.913 -5.989 8.045
347 2HB GLU 49 1HB GLU 49 5.749 -5.016 8.929
348 1HG GLU 49 2HG GLU 49 4.423 -4.770 6.882
349 2HG GLU 49 1HG GLU 49 5.570 -5.803 6.031
350 H VAL 50 H VAL 50 7.322 -2.136 9.325
351 HA VAL 50 HA VAL 50 10.078 -2.989 9.883
352 HB VAL 50 HB VAL 50 8.668 -0.483 10.831
353 1HG1 VAL 50 1HG1 VAL 50 10.508 -1.168 12.262
354 2HG1 VAL 50 2HG1 VAL 50 10.909 0.308 11.383
355 3HG1 VAL 50 3HG1 VAL 50 11.584 -1.240 10.866
356 1HG2 VAL 50 1HG2 VAL 50 8.891 -0.506 8.390
357 2HG2 VAL 50 2HG2 VAL 50 10.622 -0.804 8.553
358 3HG2 VAL 50 3HG2 VAL 50 9.931 0.714 9.124
359 H MET 51 H MET 51 10.309 -4.387 11.481
360 HA MET 51 HA MET 51 8.368 -4.284 13.701
361 1HB MET 51 2HB MET 51 8.325 -6.294 12.138
362 2HB MET 51 1HB MET 51 9.883 -6.729 12.819
363 1HG MET 51 2HG MET 51 8.972 -7.145 14.940
364 2HG MET 51 1HG MET 51 7.487 -6.277 14.563
365 1HE MET 51 1HE MET 51 8.549 -10.381 12.730
366 2HE MET 51 2HE MET 51 9.577 -9.563 13.907
367 3HE MET 51 3HE MET 51 9.362 -8.879 12.295
368 H GLU 52 H GLU 52 9.107 -4.319 15.759
369 HA GLU 52 HA GLU 52 11.579 -3.255 16.370
370 1HB GLU 52 2HB GLU 52 9.526 -4.747 17.979
371 2HB GLU 52 1HB GLU 52 10.996 -4.136 18.713
372 1HG GLU 52 2HG GLU 52 9.041 -2.418 17.212
373 2HG GLU 52 1HG GLU 52 9.006 -2.655 18.960
374 H GLY 53 H GLY 53 13.553 -4.073 16.505
375 1HA GLY 53 2HA GLY 53 15.160 -5.618 17.269
376 2HA GLY 53 1HA GLY 53 13.918 -6.861 17.305
377 H ARG 54 H ARG 54 13.007 -6.119 14.577
378 HA ARG 54 HA ARG 54 14.979 -7.708 13.125
379 1HB ARG 54 2HB ARG 54 12.228 -6.724 12.344
380 2HB ARG 54 1HB ARG 54 13.237 -7.778 11.368
381 1HG ARG 54 2HG ARG 54 12.575 -8.625 14.122
382 2HG ARG 54 1HG ARG 54 11.324 -8.698 12.882
383 1HD ARG 54 2HD ARG 54 14.001 -10.078 12.907
384 2HD ARG 54 1HD ARG 54 12.402 -10.824 12.891
385 HE ARG 54 HE ARG 54 13.547 -9.315 10.611
386 1HH1 ARG 54 1HH1 ARG 54 11.572 -11.941 11.879
387 2HH1 ARG 54 2HH1 ARG 54 11.223 -12.583 10.299
388 1HH2 ARG 54 1HH2 ARG 54 13.077 -10.175 8.558
389 2HH2 ARG 54 2HH2 ARG 54 12.069 -11.586 8.425
390 H GLY 55 H GLY 55 12.899 -5.061 12.141
391 1HA GLY 55 2HA GLY 55 14.064 -2.961 11.308
392 2HA GLY 55 1HA GLY 55 15.059 -4.088 10.385
393 H GLU 56 H GLU 56 14.360 -3.349 8.343
394 HA GLU 56 HA GLU 56 11.567 -3.352 7.698
395 1HB GLU 56 2HB GLU 56 13.876 -3.330 5.763
396 2HB GLU 56 1HB GLU 56 12.237 -2.780 5.486
397 1HG GLU 56 2HG GLU 56 13.292 -0.808 5.763
398 2HG GLU 56 1HG GLU 56 12.785 -1.114 7.415
399 H VAL 57 H VAL 57 10.400 -4.886 6.977
400 HA VAL 57 HA VAL 57 11.665 -7.344 5.942
401 HB VAL 57 HB VAL 57 9.029 -7.002 7.383
402 1HG1 VAL 57 1HG1 VAL 57 8.835 -9.455 7.244
403 2HG1 VAL 57 2HG1 VAL 57 10.293 -9.503 6.251
404 3HG1 VAL 57 3HG1 VAL 57 8.840 -8.704 5.648
405 1HG2 VAL 57 1HG2 VAL 57 10.047 -8.420 9.119
406 2HG2 VAL 57 2HG2 VAL 57 10.934 -6.912 8.888
407 3HG2 VAL 57 3HG2 VAL 57 11.562 -8.417 8.216
408 H GLN 58 H GLN 58 11.333 -7.612 3.805
409 HA GLN 58 HA GLN 58 9.326 -5.978 2.497
410 1HB GLN 58 2HB GLN 58 11.489 -7.742 1.344
411 2HB GLN 58 1HB GLN 58 10.482 -6.624 0.447
412 1HG GLN 58 2HG GLN 58 11.419 -4.776 1.838
413 2HG GLN 58 1HG GLN 58 12.542 -5.948 2.521
414 1HE2 GLN 58 1HE2 GLN 58 13.032 -3.531 0.935
415 2HE2 GLN 58 2HE2 GLN 58 13.955 -4.047 -0.430
416 H LEU 59 H LEU 59 7.453 -6.732 1.813
417 HA LEU 59 HA LEU 59 6.898 -9.577 2.008
418 1HB LEU 59 2HB LEU 59 5.129 -7.206 1.395
419 2HB LEU 59 1HB LEU 59 4.556 -8.860 1.478
420 HG LEU 59 HG LEU 59 5.785 -7.326 3.766
421 1HD1 LEU 59 1HD1 LEU 59 2.930 -8.128 3.230
422 2HD1 LEU 59 2HD1 LEU 59 3.579 -6.488 3.192
423 3HD1 LEU 59 3HD1 LEU 59 3.529 -7.382 4.711
424 1HD2 LEU 59 1HD2 LEU 59 6.251 -9.714 3.892
425 2HD2 LEU 59 2HD2 LEU 59 4.536 -10.067 3.674
426 3HD2 LEU 59 3HD2 LEU 59 5.089 -9.228 5.126
427 HA PRO 60 HA PRO 60 7.038 -10.762 -2.272
428 1HB PRO 60 2HB PRO 60 4.138 -11.405 -1.982
429 2HB PRO 60 1HB PRO 60 5.452 -12.399 -2.620
430 1HG PRO 60 2HG PRO 60 4.455 -12.823 -0.177
431 2HG PRO 60 1HG PRO 60 6.183 -13.017 -0.518
432 1HD PRO 60 2HD PRO 60 4.778 -10.851 0.956
433 2HD PRO 60 1HD PRO 60 6.421 -11.484 1.163
434 H PHE 61 H PHE 61 6.899 -9.580 -4.054
435 HA PHE 61 HA PHE 61 5.616 -7.101 -4.122
436 1HB PHE 61 2HB PHE 61 6.151 -7.196 -6.611
437 2HB PHE 61 1HB PHE 61 7.508 -7.348 -5.504
438 HD1 PHE 61 2HD PHE 61 5.408 -9.089 -7.951
439 HD2 PHE 61 1HD PHE 61 8.734 -9.419 -5.310
440 HE1 PHE 61 2HE PHE 61 6.079 -11.176 -9.062
441 HE2 PHE 61 1HE PHE 61 9.408 -11.507 -6.421
442 HZ PHE 61 HZ PHE 61 8.082 -12.391 -8.296
443 H MET 62 H MET 62 3.659 -6.474 -4.603
444 HA MET 62 HA MET 62 1.794 -8.424 -5.763
445 1HB MET 62 2HB MET 62 1.336 -5.917 -4.147
446 2HB MET 62 1HB MET 62 0.040 -6.779 -4.957
447 1HG MET 62 2HG MET 62 0.597 -8.790 -3.631
448 2HG MET 62 1HG MET 62 1.813 -7.846 -2.772
449 1HE MET 62 1HE MET 62 -2.021 -8.252 -3.536
450 2HE MET 62 2HE MET 62 -1.713 -6.577 -3.994
451 3HE MET 62 3HE MET 62 -2.714 -6.936 -2.587
452 H ALA 63 H ALA 63 1.285 -8.204 -7.831
453 HA ALA 63 HA ALA 63 2.130 -5.927 -9.340
454 1HB ALA 63 1HB ALA 63 2.142 -8.197 -10.289
455 2HB ALA 63 2HB ALA 63 1.174 -7.082 -11.256
456 3HB ALA 63 3HB ALA 63 0.382 -8.238 -10.184
457 H TYR 64 H TYR 64 1.032 -4.148 -9.817
458 HA TYR 64 HA TYR 64 -1.841 -4.103 -9.174
459 1HB TYR 64 2HB TYR 64 -1.654 -1.797 -8.557
460 2HB TYR 64 1HB TYR 64 -0.370 -2.658 -7.719
461 HD1 TYR 64 1HD TYR 64 1.985 -2.440 -8.537
462 HD2 TYR 64 2HD TYR 64 -1.169 -0.055 -10.100
463 HE1 TYR 64 1HE TYR 64 3.635 -0.861 -9.442
464 HE2 TYR 64 2HE TYR 64 0.474 1.531 -11.013
465 HH TYR 64 HH TYR 64 3.802 0.824 -11.204
466 H LYS 65 H LYS 65 -3.197 -2.833 -10.517
467 HA LYS 65 HA LYS 65 -2.020 -2.109 -13.116
468 1HB LYS 65 2HB LYS 65 -4.687 -3.441 -12.639
469 2HB LYS 65 1HB LYS 65 -4.158 -2.794 -14.189
470 1HG LYS 65 2HG LYS 65 -2.267 -4.337 -14.176
471 2HG LYS 65 1HG LYS 65 -2.822 -4.982 -12.641
472 1HD LYS 65 2HD LYS 65 -3.572 -6.491 -14.309
473 2HD LYS 65 1HD LYS 65 -4.990 -5.565 -13.809
474 1HE LYS 65 2HE LYS 65 -4.830 -5.840 -16.266
475 2HE LYS 65 1HE LYS 65 -4.808 -4.151 -15.757
476 1HZ LYS 65 1HZ LYS 65 -2.560 -3.952 -16.225
477 2HZ LYS 65 2HZ LYS 65 -3.113 -4.925 -17.505
478 3HZ LYS 65 3HZ LYS 65 -2.287 -5.621 -16.199
479 H VAL 66 H VAL 66 -2.912 -0.406 -14.164
480 HA VAL 66 HA VAL 66 -4.103 1.550 -12.337
481 HB VAL 66 HB VAL 66 -2.674 1.953 -14.973
482 1HG1 VAL 66 1HG1 VAL 66 -2.704 4.334 -14.406
483 2HG1 VAL 66 2HG1 VAL 66 -3.668 3.978 -12.971
484 3HG1 VAL 66 3HG1 VAL 66 -4.339 3.695 -14.577
485 1HG2 VAL 66 1HG2 VAL 66 -0.904 2.931 -13.586
486 2HG2 VAL 66 2HG2 VAL 66 -1.171 1.225 -13.227
487 3HG2 VAL 66 3HG2 VAL 66 -1.797 2.463 -12.139
488 H ILE 67 H ILE 67 -6.195 1.807 -12.450
489 HA ILE 67 HA ILE 67 -7.722 1.050 -14.777
490 HB ILE 67 HB ILE 67 -8.764 2.474 -12.334
491 1HG1 ILE 67 2HG1 ILE 67 -8.369 -0.500 -12.739
492 2HG1 ILE 67 1HG1 ILE 67 -7.497 0.510 -11.593
493 1HG2 ILE 67 1HG2 ILE 67 -10.269 2.344 -14.252
494 2HG2 ILE 67 2HG2 ILE 67 -10.858 1.345 -12.923
495 3HG2 ILE 67 3HG2 ILE 67 -10.059 0.593 -14.303
496 1HD1 ILE 67 1HD1 ILE 67 -9.573 0.936 -10.395
497 2HD1 ILE 67 2HD1 ILE 67 -9.231 -0.791 -10.500
498 3HD1 ILE 67 3HD1 ILE 67 -10.449 -0.067 -11.551
499 H SER 68 H SER 68 -7.236 3.991 -12.878
500 HA SER 68 HA SER 68 -7.536 5.569 -15.339
501 1HB SER 68 2HB SER 68 -8.652 6.473 -12.690
502 2HB SER 68 1HB SER 68 -8.903 7.202 -14.266
503 HG SER 68 HG SER 68 -10.262 5.176 -13.080
504 H GLN 69 H GLN 69 -6.471 7.659 -15.199
505 HA GLN 69 HA GLN 69 -4.399 7.889 -13.180
506 1HB GLN 69 2HB GLN 69 -3.497 6.256 -14.817
507 2HB GLN 69 1HB GLN 69 -3.696 7.454 -16.089
508 1HG GLN 69 2HG GLN 69 -2.101 8.925 -14.937
509 2HG GLN 69 1HG GLN 69 -1.883 7.691 -13.697
510 1HE2 GLN 69 1HE2 GLN 69 -2.077 5.525 -15.666
511 2HE2 GLN 69 2HE2 GLN 69 -0.563 5.505 -16.495
512 H SER 70 H SER 70 -3.539 9.920 -13.032
513 HA SER 70 HA SER 70 -4.310 11.896 -15.063
514 1HB SER 70 2HB SER 70 -5.780 12.028 -13.028
515 2HB SER 70 1HB SER 70 -4.342 12.340 -12.068
516 HG SER 70 HG SER 70 -5.748 14.165 -13.011
517 H THR 71 H THR 71 -2.743 13.470 -15.466
518 HA THR 71 HA THR 71 -0.076 12.911 -14.641
519 HB THR 71 HB THR 71 0.322 15.252 -15.715
520 HG1 THR 71 1HG THR 71 -1.343 16.028 -16.930
521 1HG2 THR 71 1HG2 THR 71 0.918 13.155 -16.801
522 2HG2 THR 71 2HG2 THR 71 0.208 14.270 -17.969
523 3HG2 THR 71 3HG2 THR 71 -0.750 12.936 -17.326
524 H ASP 72 H ASP 72 -2.648 14.895 -13.477
525 HA ASP 72 HA ASP 72 -1.346 15.168 -10.965
526 1HB ASP 72 2HB ASP 72 -0.313 17.084 -12.214
527 2HB ASP 72 1HB ASP 72 -1.927 17.768 -12.400
528 H GLY 73 H GLY 73 -3.188 14.071 -10.301
529 1HA GLY 73 2HA GLY 73 -5.287 15.718 -9.382
530 2HA GLY 73 1HA GLY 73 -5.828 14.810 -10.786
531 H SER 74 H SER 74 -5.838 12.503 -10.686
532 HA SER 74 HA SER 74 -5.477 11.293 -8.069
533 1HB SER 74 2HB SER 74 -7.792 12.071 -8.012
534 2HB SER 74 1HB SER 74 -8.129 11.249 -9.528
535 HG SER 74 HG SER 74 -8.734 9.718 -8.192
536 H ILE 75 H ILE 75 -5.474 9.021 -8.128
537 HA ILE 75 HA ILE 75 -5.321 7.789 -10.797
538 HB ILE 75 HB ILE 75 -3.380 7.154 -8.564
539 1HG1 ILE 75 2HG1 ILE 75 -3.041 8.924 -10.991
540 2HG1 ILE 75 1HG1 ILE 75 -2.771 9.341 -9.306
541 1HG2 ILE 75 1HG2 ILE 75 -2.190 5.906 -10.308
542 2HG2 ILE 75 2HG2 ILE 75 -3.464 6.311 -11.459
543 3HG2 ILE 75 3HG2 ILE 75 -3.826 5.299 -10.060
544 1HD1 ILE 75 1HD1 ILE 75 -1.119 7.439 -10.947
545 2HD1 ILE 75 2HD1 ILE 75 -0.852 7.832 -9.249
546 3HD1 ILE 75 3HD1 ILE 75 -0.677 9.081 -10.483
547 H GLU 76 H GLU 76 -6.308 5.830 -10.917
548 HA GLU 76 HA GLU 76 -7.201 4.635 -8.375
549 1HB GLU 76 2HB GLU 76 -8.980 5.623 -9.971
550 2HB GLU 76 1HB GLU 76 -8.606 4.248 -10.998
551 1HG GLU 76 2HG GLU 76 -9.234 2.713 -9.242
552 2HG GLU 76 1HG GLU 76 -9.552 4.060 -8.153
553 H ILE 77 H ILE 77 -6.316 2.740 -7.981
554 HA ILE 77 HA ILE 77 -5.289 1.165 -10.248
555 HB ILE 77 HB ILE 77 -3.431 0.397 -8.811
556 1HG1 ILE 77 2HG1 ILE 77 -4.332 2.576 -6.915
557 2HG1 ILE 77 1HG1 ILE 77 -4.555 0.854 -6.635
558 1HG2 ILE 77 1HG2 ILE 77 -3.058 2.203 -10.387
559 2HG2 ILE 77 2HG2 ILE 77 -2.096 2.451 -8.929
560 3HG2 ILE 77 3HG2 ILE 77 -3.571 3.385 -9.182
561 1HD1 ILE 77 1HD1 ILE 77 -2.659 1.693 -5.391
562 2HD1 ILE 77 2HD1 ILE 77 -1.921 2.283 -6.879
563 3HD1 ILE 77 3HD1 ILE 77 -2.129 0.550 -6.626
564 H GLN 78 H GLN 78 -5.117 -1.107 -9.862
565 HA GLN 78 HA GLN 78 -6.860 -2.111 -7.723
566 1HB GLN 78 2HB GLN 78 -8.114 -2.041 -9.841
567 2HB GLN 78 1HB GLN 78 -6.863 -2.999 -10.614
568 1HG GLN 78 2HG GLN 78 -7.388 -4.900 -9.301
569 2HG GLN 78 1HG GLN 78 -8.463 -3.957 -8.266
570 1HE2 GLN 78 1HE2 GLN 78 -10.470 -3.326 -9.044
571 2HE2 GLN 78 2HE2 GLN 78 -11.204 -4.078 -10.422
572 H TYR 79 H TYR 79 -6.266 -4.100 -6.862
573 HA TYR 79 HA TYR 79 -3.525 -4.900 -7.470
574 1HB TYR 79 2HB TYR 79 -5.326 -5.689 -5.168
575 2HB TYR 79 1HB TYR 79 -3.633 -6.137 -5.345
576 HD1 TYR 79 1HD TYR 79 -1.897 -4.269 -5.373
577 HD2 TYR 79 2HD TYR 79 -5.928 -3.659 -4.154
578 HE1 TYR 79 1HE TYR 79 -1.229 -2.205 -4.212
579 HE2 TYR 79 2HE TYR 79 -5.270 -1.597 -2.990
580 HH TYR 79 HH TYR 79 -2.219 -0.135 -3.442
581 H LEU 80 H LEU 80 -2.960 -7.111 -7.715
582 HA LEU 80 HA LEU 80 -5.123 -8.707 -8.899
583 1HB LEU 80 2HB LEU 80 -2.144 -8.780 -9.386
584 2HB LEU 80 1HB LEU 80 -3.292 -9.901 -10.092
585 HG LEU 80 HG LEU 80 -3.326 -6.916 -10.549
586 1HD1 LEU 80 1HD1 LEU 80 -2.482 -7.456 -12.785
587 2HD1 LEU 80 2HD1 LEU 80 -2.323 -9.147 -12.312
588 3HD1 LEU 80 3HD1 LEU 80 -1.337 -7.914 -11.525
589 1HD2 LEU 80 1HD2 LEU 80 -5.515 -7.975 -10.757
590 2HD2 LEU 80 2HD2 LEU 80 -4.841 -9.162 -11.875
591 3HD2 LEU 80 3HD2 LEU 80 -4.906 -7.459 -12.329
592 H GLY 81 H GLY 81 -4.214 -11.193 -8.888
593 1HA GLY 81 2HA GLY 81 -3.664 -13.021 -7.550
594 2HA GLY 81 1HA GLY 81 -3.233 -11.909 -6.256
595 HA PRO 82 HA PRO 82 -7.213 -13.847 -4.937
596 1HB PRO 82 2HB PRO 82 -6.052 -13.249 -2.292
597 2HB PRO 82 1HB PRO 82 -6.726 -14.761 -2.905
598 1HG PRO 82 2HG PRO 82 -4.091 -14.451 -2.536
599 2HG PRO 82 1HG PRO 82 -4.735 -15.404 -3.886
600 1HD PRO 82 2HD PRO 82 -3.634 -12.620 -3.884
601 2HD PRO 82 1HD PRO 82 -3.416 -13.918 -5.077
602 H TYR 83 H TYR 83 -5.604 -10.864 -4.440
603 HA TYR 83 HA TYR 83 -7.940 -9.661 -3.146
604 1HB TYR 83 2HB TYR 83 -5.161 -8.537 -3.589
605 2HB TYR 83 1HB TYR 83 -6.457 -7.752 -2.685
606 HD1 TYR 83 2HD TYR 83 -7.446 -9.151 -0.700
607 HD2 TYR 83 1HD TYR 83 -3.623 -9.852 -2.439
608 HE1 TYR 83 2HE TYR 83 -6.752 -10.351 1.328
609 HE2 TYR 83 1HE TYR 83 -2.918 -11.058 -0.414
610 HH TYR 83 HH TYR 83 -5.087 -12.139 1.899
611 H TYR 84 H TYR 84 -7.855 -10.499 -5.921
612 HA TYR 84 HA TYR 84 -7.690 -8.350 -7.699
613 1HB TYR 84 2HB TYR 84 -9.038 -9.735 -9.184
614 2HB TYR 84 1HB TYR 84 -7.833 -10.721 -8.372
615 HD1 TYR 84 2HD TYR 84 -8.509 -12.394 -6.717
616 HD2 TYR 84 1HD TYR 84 -11.393 -10.037 -8.767
617 HE1 TYR 84 2HE TYR 84 -10.273 -13.970 -6.040
618 HE2 TYR 84 1HE TYR 84 -13.159 -11.606 -8.106
619 HH TYR 84 HH TYR 84 -12.653 -14.096 -5.786
620 HA PRO 85 HA PRO 85 -10.579 -5.547 -8.732
621 1HB PRO 85 2HB PRO 85 -12.835 -7.198 -7.668
622 2HB PRO 85 1HB PRO 85 -12.903 -5.872 -8.845
623 1HG PRO 85 2HG PRO 85 -12.457 -8.564 -9.491
624 2HG PRO 85 1HG PRO 85 -12.075 -7.184 -10.537
625 1HD PRO 85 2HD PRO 85 -10.189 -8.967 -9.464
626 2HD PRO 85 1HD PRO 85 -9.814 -7.337 -10.079
627 H LEU 86 H LEU 86 -10.061 -6.652 -5.556
628 HA LEU 86 HA LEU 86 -11.165 -4.386 -4.228
629 1HB LEU 86 2HB LEU 86 -10.380 -6.393 -3.020
630 2HB LEU 86 1HB LEU 86 -8.735 -6.057 -3.526
631 HG LEU 86 HG LEU 86 -8.805 -3.942 -2.229
632 1HD1 LEU 86 1HD1 LEU 86 -10.608 -3.605 -0.614
633 2HD1 LEU 86 2HD1 LEU 86 -11.465 -4.994 -1.284
634 3HD1 LEU 86 3HD1 LEU 86 -11.203 -3.556 -2.272
635 1HD2 LEU 86 1HD2 LEU 86 -7.829 -5.919 -1.240
636 2HD2 LEU 86 2HD2 LEU 86 -9.418 -6.468 -0.705
637 3HD2 LEU 86 3HD2 LEU 86 -8.708 -5.010 -0.011
638 H LYS 87 H LYS 87 -10.692 -2.388 -4.952
639 HA LYS 87 HA LYS 87 -8.009 -1.957 -6.047
640 1HB LYS 87 2HB LYS 87 -8.974 -0.113 -7.341
641 2HB LYS 87 1HB LYS 87 -9.761 -1.647 -7.680
642 1HG LYS 87 2HG LYS 87 -11.635 -0.994 -6.242
643 2HG LYS 87 1HG LYS 87 -10.848 0.559 -5.935
644 1HD LYS 87 2HD LYS 87 -10.873 0.989 -8.383
645 2HD LYS 87 1HD LYS 87 -11.778 -0.508 -8.603
646 1HE LYS 87 2HE LYS 87 -13.593 0.388 -7.228
647 2HE LYS 87 1HE LYS 87 -12.680 1.880 -6.995
648 1HZ LYS 87 1HZ LYS 87 -13.725 0.837 -9.576
649 2HZ LYS 87 2HZ LYS 87 -12.750 2.218 -9.418
650 3HZ LYS 87 3HZ LYS 87 -14.301 2.188 -8.727
651 H SER 88 H SER 88 -7.433 0.485 -6.030
652 HA SER 88 HA SER 88 -7.874 1.606 -3.364
653 1HB SER 88 2HB SER 88 -5.947 0.286 -2.976
654 2HB SER 88 1HB SER 88 -5.243 0.704 -4.528
655 HG SER 88 HG SER 88 -5.661 2.540 -2.402
656 H THR 89 H THR 89 -7.084 3.838 -3.192
657 HA THR 89 HA THR 89 -7.107 5.201 -5.802
658 HB THR 89 HB THR 89 -8.157 6.407 -3.262
659 HG1 THR 89 1HG THR 89 -9.282 4.436 -4.787
660 1HG2 THR 89 1HG2 THR 89 -8.656 7.009 -6.176
661 2HG2 THR 89 2HG2 THR 89 -7.644 7.951 -5.080
662 3HG2 THR 89 3HG2 THR 89 -9.388 7.858 -4.817
663 H LEU 90 H LEU 90 -5.752 6.922 -6.069
664 HA LEU 90 HA LEU 90 -3.856 7.531 -3.904
665 1HB LEU 90 2HB LEU 90 -3.209 6.937 -6.791
666 2HB LEU 90 1HB LEU 90 -2.073 7.666 -5.674
667 HG LEU 90 HG LEU 90 -3.302 4.930 -5.323
668 1HD1 LEU 90 1HD1 LEU 90 -0.546 5.715 -6.264
669 2HD1 LEU 90 2HD1 LEU 90 -1.818 5.016 -7.266
670 3HD1 LEU 90 3HD1 LEU 90 -1.110 4.072 -5.956
671 1HD2 LEU 90 1HD2 LEU 90 -1.070 6.334 -3.859
672 2HD2 LEU 90 2HD2 LEU 90 -1.581 4.666 -3.600
673 3HD2 LEU 90 3HD2 LEU 90 -2.679 5.994 -3.222
674 H LYS 91 H LYS 91 -3.585 9.625 -3.563
675 HA LYS 91 HA LYS 91 -3.795 11.517 -5.780
676 1HB LYS 91 2HB LYS 91 -5.449 11.620 -3.269
677 2HB LYS 91 1HB LYS 91 -5.039 13.088 -4.141
678 1HG LYS 91 2HG LYS 91 -6.151 12.203 -6.134
679 2HG LYS 91 1HG LYS 91 -6.566 10.743 -5.239
680 1HD LYS 91 2HD LYS 91 -7.415 13.528 -4.455
681 2HD LYS 91 1HD LYS 91 -8.420 12.395 -5.360
682 1HE LYS 91 2HE LYS 91 -7.267 11.836 -2.633
683 2HE LYS 91 1HE LYS 91 -8.893 12.460 -2.912
684 1HZ LYS 91 1HZ LYS 91 -8.750 10.002 -2.602
685 2HZ LYS 91 2HZ LYS 91 -7.904 9.915 -4.068
686 3HZ LYS 91 3HZ LYS 91 -9.497 10.487 -4.051
687 H ARG 92 H ARG 92 -2.876 13.656 -5.167
688 HA ARG 92 HA ARG 92 -0.801 13.342 -3.149
689 1HB ARG 92 2HB ARG 92 0.232 15.313 -4.106
690 2HB ARG 92 1HB ARG 92 -0.052 14.104 -5.344
691 1HG ARG 92 2HG ARG 92 -1.857 15.313 -6.229
692 2HG ARG 92 1HG ARG 92 -1.917 16.399 -4.846
693 1HD ARG 92 2HD ARG 92 0.243 17.330 -5.446
694 2HD ARG 92 1HD ARG 92 0.379 16.200 -6.792
695 HE ARG 92 HE ARG 92 -1.001 17.534 -8.036
696 1HH1 ARG 92 1HH1 ARG 92 -1.181 18.543 -4.675
697 2HH1 ARG 92 2HH1 ARG 92 -2.103 19.975 -5.022
698 1HH2 ARG 92 1HH2 ARG 92 -2.183 19.404 -8.501
699 2HH2 ARG 92 2HH2 ARG 92 -2.660 20.475 -7.213
700 H GLY 93 H GLY 93 -0.421 15.018 -1.595
701 1HA GLY 93 2HA GLY 93 -2.950 16.239 -0.745
702 2HA GLY 93 1HA GLY 93 -1.531 15.995 0.266
703 H GLU 94 H GLU 94 -1.668 18.161 0.955
704 HA GLU 94 HA GLU 94 -1.427 20.337 -0.898
705 1HB GLU 94 2HB GLU 94 -2.478 20.550 1.344
706 2HB GLU 94 1HB GLU 94 -0.904 20.276 2.079
707 1HG GLU 94 2HG GLU 94 -0.068 22.314 0.966
708 2HG GLU 94 1HG GLU 94 -1.691 22.600 0.336
709 H ASN 95 H ASN 95 0.700 18.685 1.315
710 HA ASN 95 HA ASN 95 3.045 20.079 0.256
711 1HB ASN 95 2HB ASN 95 2.786 18.164 2.592
712 2HB ASN 95 1HB ASN 95 4.239 19.054 2.152
713 1HD2 ASN 95 1HD2 ASN 95 1.059 19.251 3.539
714 2HD2 ASN 95 2HD2 ASN 95 1.246 20.832 4.227
715 H GLY 96 H GLY 96 4.947 18.066 0.785
716 1HA GLY 96 2HA GLY 96 4.637 16.336 -1.497
717 2HA GLY 96 1HA GLY 96 5.982 16.349 -0.364
718 H THR 97 H THR 97 2.510 15.779 -0.027
719 HA THR 97 HA THR 97 3.119 13.259 1.351
720 HB THR 97 HB THR 97 0.901 13.631 2.510
721 HG1 THR 97 1HG THR 97 0.254 15.296 0.926
722 1HG2 THR 97 1HG2 THR 97 3.034 14.070 3.641
723 2HG2 THR 97 2HG2 THR 97 1.795 15.220 4.139
724 3HG2 THR 97 3HG2 THR 97 3.041 15.711 2.993
725 H LEU 98 H LEU 98 1.981 11.462 0.800
726 HA LEU 98 HA LEU 98 0.272 11.673 -1.579
727 1HB LEU 98 2HB LEU 98 2.261 10.170 -1.693
728 2HB LEU 98 1HB LEU 98 1.578 9.224 -0.384
729 HG LEU 98 HG LEU 98 -0.424 8.808 -1.887
730 1HD1 LEU 98 1HD1 LEU 98 1.462 9.882 -3.981
731 2HD1 LEU 98 2HD1 LEU 98 -0.046 10.633 -3.459
732 3HD1 LEU 98 3HD1 LEU 98 -0.076 9.077 -4.289
733 1HD2 LEU 98 1HD2 LEU 98 2.264 7.770 -2.780
734 2HD2 LEU 98 2HD2 LEU 98 0.700 7.029 -3.121
735 3HD2 LEU 98 3HD2 LEU 98 1.287 7.122 -1.460
736 H ILE 99 H ILE 99 -1.828 11.146 -1.478
737 HA ILE 99 HA ILE 99 -2.892 10.210 1.083
738 HB ILE 99 HB ILE 99 -4.380 11.154 -1.377
739 1HG1 ILE 99 2HG1 ILE 99 -2.932 12.906 -0.393
740 2HG1 ILE 99 1HG1 ILE 99 -4.640 13.286 -0.269
741 1HG2 ILE 99 1HG2 ILE 99 -6.284 11.397 0.143
742 2HG2 ILE 99 2HG2 ILE 99 -5.315 10.730 1.458
743 3HG2 ILE 99 3HG2 ILE 99 -5.715 9.730 0.062
744 1HD1 ILE 99 1HD1 ILE 99 -3.450 13.875 1.765
745 2HD1 ILE 99 2HD1 ILE 99 -2.919 12.202 1.942
746 3HD1 ILE 99 3HD1 ILE 99 -4.632 12.600 2.072
747 H TRP 100 H TRP 100 -2.902 8.049 1.238
748 HA TRP 100 HA TRP 100 -3.487 6.486 -1.185
749 1HB TRP 100 2HB TRP 100 -1.301 6.012 -0.132
750 2HB TRP 100 1HB TRP 100 -2.124 5.588 1.365
751 HD1 TRP 100 HD TRP 100 -3.672 4.366 -1.878
752 HE1 TRP 100 1HE TRP 100 -3.382 1.820 -2.055
753 HE3 TRP 100 3HE TRP 100 -0.483 3.640 2.057
754 HZ2 TRP 100 2HZ TRP 100 -1.974 -0.225 -0.719
755 HZ3 TRP 100 3HZ TRP 100 0.291 1.352 2.535
756 HH2 TRP 100 HH TRP 100 -0.441 -0.539 1.174
757 H GLU 101 H GLU 101 -5.532 5.948 -1.302
758 HA GLU 101 HA GLU 101 -6.941 5.187 1.170
759 1HB GLU 101 2HB GLU 101 -7.904 6.172 -1.504
760 2HB GLU 101 1HB GLU 101 -8.990 5.444 -0.339
761 1HG GLU 101 2HG GLU 101 -8.706 7.165 1.197
762 2HG GLU 101 1HG GLU 101 -7.229 7.721 0.423
763 H GLN 102 H GLN 102 -7.625 3.196 1.409
764 HA GLN 102 HA GLN 102 -7.615 1.319 -0.813
765 1HB GLN 102 2HB GLN 102 -5.295 1.240 -0.237
766 2HB GLN 102 1HB GLN 102 -5.653 1.156 1.478
767 1HG GLN 102 2HG GLN 102 -6.761 -1.040 -0.124
768 2HG GLN 102 1HG GLN 102 -5.011 -0.969 -0.076
769 1HE2 GLN 102 1HE2 GLN 102 -6.611 -3.017 1.029
770 2HE2 GLN 102 2HE2 GLN 102 -6.305 -3.039 2.728
771 H ASN 103 H ASN 103 -9.511 0.327 -0.582
772 HA ASN 103 HA ASN 103 -10.857 -1.340 0.224
773 1HB ASN 103 2HB ASN 103 -8.682 -2.272 0.934
774 2HB ASN 103 1HB ASN 103 -8.830 -1.428 2.457
775 1HD2 ASN 103 1HD2 ASN 103 -8.484 -3.441 3.359
776 2HD2 ASN 103 2HD2 ASN 103 -9.806 -4.547 3.594
777 H GLY 104 H GLY 104 -10.358 1.554 1.778
778 1HA GLY 104 2HA GLY 104 -12.642 2.357 2.621
779 2HA GLY 104 1HA GLY 104 -12.447 1.052 3.780
780 H GLN 105 H GLN 105 -9.392 1.844 3.573
781 HA GLN 105 HA GLN 105 -9.677 3.945 5.617
782 1HB GLN 105 2HB GLN 105 -7.460 3.215 6.455
783 2HB GLN 105 1HB GLN 105 -8.696 1.973 6.564
784 1HG GLN 105 2HG GLN 105 -7.793 0.819 4.678
785 2HG GLN 105 1HG GLN 105 -6.664 2.134 4.354
786 1HE2 GLN 105 1HE2 GLN 105 -7.417 -0.543 6.464
787 2HE2 GLN 105 2HE2 GLN 105 -5.863 -0.642 7.216
788 H ARG 106 H ARG 106 -8.707 5.844 5.403
789 HA ARG 106 HA ARG 106 -7.064 6.318 3.022
790 1HB ARG 106 2HB ARG 106 -9.030 7.765 3.291
791 2HB ARG 106 1HB ARG 106 -8.454 8.268 4.874
792 1HG ARG 106 2HG ARG 106 -6.475 9.271 3.812
793 2HG ARG 106 1HG ARG 106 -7.110 8.802 2.233
794 1HD ARG 106 2HD ARG 106 -7.609 11.132 2.698
795 2HD ARG 106 1HD ARG 106 -9.092 10.182 2.625
796 HE ARG 106 HE ARG 106 -8.873 10.165 5.176
797 1HH1 ARG 106 1HH1 ARG 106 -7.834 12.806 3.126
798 2HH1 ARG 106 2HH1 ARG 106 -8.033 14.021 4.354
799 1HH2 ARG 106 1HH2 ARG 106 -9.154 11.735 6.792
800 2HH2 ARG 106 2HH2 ARG 106 -8.803 13.408 6.452
801 H LYS 107 H LYS 107 -4.918 6.599 3.240
802 HA LYS 107 HA LYS 107 -3.908 7.286 5.914
803 1HB LYS 107 2HB LYS 107 -3.214 5.164 4.163
804 2HB LYS 107 1HB LYS 107 -1.811 6.194 4.434
805 1HG LYS 107 2HG LYS 107 -2.030 5.951 6.816
806 2HG LYS 107 1HG LYS 107 -3.535 5.052 6.620
807 1HD LYS 107 2HD LYS 107 -0.791 4.196 5.722
808 2HD LYS 107 1HD LYS 107 -1.737 3.515 7.054
809 1HE LYS 107 2HE LYS 107 -3.471 2.864 5.482
810 2HE LYS 107 1HE LYS 107 -2.524 3.523 4.156
811 1HZ LYS 107 1HZ LYS 107 -1.666 1.282 5.915
812 2HZ LYS 107 2HZ LYS 107 -0.770 1.932 4.629
813 3HZ LYS 107 3HZ LYS 107 -2.231 1.124 4.324
814 H THR 108 H THR 108 -2.959 9.232 6.059
815 HA THR 108 HA THR 108 -1.945 10.526 3.646
816 HB THR 108 HB THR 108 -2.060 11.648 6.453
817 HG1 THR 108 1HG THR 108 -3.951 12.780 5.177
818 1HG2 THR 108 1HG2 THR 108 -1.814 12.973 3.748
819 2HG2 THR 108 2HG2 THR 108 -0.545 12.837 4.966
820 3HG2 THR 108 3HG2 THR 108 -1.973 13.818 5.288
821 H MET 109 H MET 109 0.110 10.139 3.122
822 HA MET 109 HA MET 109 2.037 9.678 5.305
823 1HB MET 109 2HB MET 109 3.177 8.038 3.864
824 2HB MET 109 1HB MET 109 1.524 7.558 4.232
825 1HG MET 109 2HG MET 109 0.844 8.473 2.015
826 2HG MET 109 1HG MET 109 2.549 8.732 1.655
827 1HE MET 109 1HE MET 109 0.675 4.581 2.387
828 2HE MET 109 2HE MET 109 -0.219 6.101 2.477
829 3HE MET 109 3HE MET 109 1.007 5.725 3.687
830 H THR 110 H THR 110 4.200 10.323 4.901
831 HA THR 110 HA THR 110 4.354 12.520 2.966
832 HB THR 110 HB THR 110 6.386 11.974 5.100
833 HG1 THR 110 1HG THR 110 3.766 12.631 5.463
834 1HG2 THR 110 1HG2 THR 110 6.658 14.419 5.021
835 2HG2 THR 110 2HG2 THR 110 5.413 14.509 3.774
836 3HG2 THR 110 3HG2 THR 110 6.934 13.677 3.445
837 H ARG 111 H ARG 111 6.331 12.774 1.731
838 HA ARG 111 HA ARG 111 7.267 10.199 0.771
839 1HB ARG 111 2HB ARG 111 6.569 11.918 -0.865
840 2HB ARG 111 1HB ARG 111 7.840 12.978 -0.276
841 1HG ARG 111 2HG ARG 111 9.544 11.490 -1.066
842 2HG ARG 111 1HG ARG 111 8.341 10.274 -1.495
843 1HD ARG 111 2HD ARG 111 7.424 11.740 -3.197
844 2HD ARG 111 1HD ARG 111 8.540 13.023 -2.722
845 HE ARG 111 HE ARG 111 10.341 11.726 -3.607
846 1HH1 ARG 111 1HH1 ARG 111 7.153 10.457 -4.328
847 2HH1 ARG 111 2HH1 ARG 111 7.704 9.476 -5.649
848 1HH2 ARG 111 1HH2 ARG 111 11.059 10.430 -5.363
849 2HH2 ARG 111 2HH2 ARG 111 9.913 9.461 -6.234
850 H ILE 112 H ILE 112 9.323 9.466 0.883
851 HA ILE 112 HA ILE 112 11.074 10.562 2.850
852 HB ILE 112 HB ILE 112 11.708 8.473 0.771
853 1HG1 ILE 112 2HG1 ILE 112 9.678 7.903 2.061
854 2HG1 ILE 112 1HG1 ILE 112 11.007 6.817 2.414
855 1HG2 ILE 112 1HG2 ILE 112 13.677 9.357 1.887
856 2HG2 ILE 112 2HG2 ILE 112 13.370 7.700 2.407
857 3HG2 ILE 112 3HG2 ILE 112 12.942 9.049 3.459
858 1HD1 ILE 112 1HD1 ILE 112 10.093 9.108 4.126
859 2HD1 ILE 112 2HD1 ILE 112 11.449 8.039 4.484
860 3HD1 ILE 112 3HD1 ILE 112 9.809 7.395 4.425
861 H GLU 113 H GLU 113 13.112 11.482 2.490
862 HA GLU 113 HA GLU 113 13.076 13.328 0.299
863 1HB GLU 113 2HB GLU 113 15.347 14.035 1.335
864 2HB GLU 113 1HB GLU 113 13.862 14.360 2.215
865 1HG GLU 113 2HG GLU 113 15.504 11.905 2.750
866 2HG GLU 113 1HG GLU 113 15.870 13.451 3.511
867 H SER 114 H SER 114 13.598 12.692 -1.641
868 HA SER 114 HA SER 114 15.695 10.690 -2.017
869 1HB SER 114 2HB SER 114 13.774 11.783 -4.082
870 2HB SER 114 1HB SER 114 14.720 10.297 -4.172
871 HG SER 114 HG SER 114 13.428 9.830 -2.090
872 H LYS 115 H LYS 115 15.996 13.723 -1.521
873 HA LYS 115 HA LYS 115 17.814 14.210 -3.769
874 1HB LYS 115 2HB LYS 115 17.008 16.488 -4.054
875 2HB LYS 115 1HB LYS 115 15.691 15.349 -4.288
876 1HG LYS 115 2HG LYS 115 15.030 15.801 -1.895
877 2HG LYS 115 1HG LYS 115 16.200 17.121 -1.915
878 1HD LYS 115 2HD LYS 115 13.795 16.824 -3.715
879 2HD LYS 115 1HD LYS 115 13.973 17.965 -2.382
880 1HE LYS 115 2HE LYS 115 15.874 19.007 -3.583
881 2HE LYS 115 1HE LYS 115 15.591 17.900 -4.927
882 1HZ LYS 115 1HZ LYS 115 14.513 19.901 -5.480
883 2HZ LYS 115 2HZ LYS 115 13.815 20.058 -3.944
884 3HZ LYS 115 3HZ LYS 115 13.274 18.845 -4.998
885 H THR 116 H THR 116 17.958 13.572 -0.804
886 HA THR 116 HA THR 116 19.434 15.927 0.124
887 HB THR 116 HB THR 116 19.354 14.528 2.340
888 HG1 THR 116 1HG THR 116 18.349 12.680 1.955
889 1HG2 THR 116 1HG2 THR 116 17.190 15.547 2.897
890 2HG2 THR 116 2HG2 THR 116 16.901 15.859 1.185
891 3HG2 THR 116 3HG2 THR 116 18.225 16.672 2.020
892 H GLY 117 H GLY 117 21.475 15.721 -0.703
893 1HA GLY 117 2HA GLY 117 23.623 14.853 0.208
894 2HA GLY 117 1HA GLY 117 22.916 13.252 0.058
895 H ARG 118 H ARG 118 24.671 12.609 -1.254
896 HA ARG 118 HA ARG 118 24.286 13.095 -4.049
897 1HB ARG 118 2HB ARG 118 25.794 14.973 -3.326
898 2HB ARG 118 1HB ARG 118 26.960 13.771 -2.791
899 1HG ARG 118 2HG ARG 118 27.054 12.924 -5.137
900 2HG ARG 118 1HG ARG 118 26.030 14.284 -5.608
901 1HD ARG 118 2HD ARG 118 27.722 15.830 -4.710
902 2HD ARG 118 1HD ARG 118 28.753 14.452 -4.323
903 HE ARG 118 HE ARG 118 27.911 14.940 -7.098
904 1HH1 ARG 118 1HH1 ARG 118 30.425 14.485 -4.707
905 2HH1 ARG 118 2HH1 ARG 118 31.723 14.673 -5.858
906 1HH2 ARG 118 1HH2 ARG 118 29.588 15.131 -8.611
907 2HH2 ARG 118 2HH2 ARG 118 31.247 15.012 -8.089
908 H GLU 119 H GLU 119 25.400 11.522 -5.296
909 HA GLU 119 HA GLU 119 25.761 9.054 -3.896
910 1HB GLU 119 2HB GLU 119 26.286 8.136 -6.200
911 2HB GLU 119 1HB GLU 119 24.687 8.821 -5.978
912 1HG GLU 119 2HG GLU 119 26.918 10.443 -7.150
913 2HG GLU 119 1HG GLU 119 25.967 9.338 -8.139
914 H GLU 120 H GLU 120 27.577 10.300 -2.679
915 HA GLU 120 HA GLU 120 30.184 10.280 -3.790
916 1HB GLU 120 2HB GLU 120 29.272 9.981 -0.918
917 2HB GLU 120 1HB GLU 120 30.939 10.226 -1.415
918 1HG GLU 120 2HG GLU 120 28.700 12.156 -1.968
919 2HG GLU 120 1HG GLU 120 29.815 12.277 -0.607
920 H LYS 121 H LYS 121 31.856 8.690 -3.494
921 HA LYS 121 HA LYS 121 30.706 6.012 -3.580
922 1HB LYS 121 2HB LYS 121 33.366 7.071 -4.503
923 2HB LYS 121 1HB LYS 121 32.939 5.368 -4.538
924 1HG LYS 121 2HG LYS 121 31.002 5.950 -5.990
925 2HG LYS 121 1HG LYS 121 31.615 7.605 -6.051
926 1HD LYS 121 2HD LYS 121 33.671 6.842 -7.068
927 2HD LYS 121 1HD LYS 121 33.154 5.160 -6.916
928 1HE LYS 121 2HE LYS 121 31.278 5.604 -8.419
929 2HE LYS 121 1HE LYS 121 31.791 7.285 -8.566
930 1HZ LYS 121 1HZ LYS 121 32.526 5.945 -10.440
931 2HZ LYS 121 2HZ LYS 121 33.389 4.922 -9.396
932 3HZ LYS 121 3HZ LYS 121 33.847 6.548 -9.566
933 H ASP 122 H ASP 122 30.547 5.181 -1.635
934 HA ASP 122 HA ASP 122 32.784 5.268 0.231
935 1HB ASP 122 2HB ASP 122 30.609 5.506 1.235
936 2HB ASP 122 1HB ASP 122 30.008 4.076 0.407
937 H GLU 123 H GLU 123 34.043 3.506 0.741
938 HA GLU 123 HA GLU 123 34.399 1.549 -1.283
939 1HB GLU 123 2HB GLU 123 36.173 2.480 0.284
940 2HB GLU 123 1HB GLU 123 35.501 1.442 1.530
941 1HG GLU 123 2HG GLU 123 36.382 0.272 -1.074
942 2HG GLU 123 1HG GLU 123 37.566 0.673 0.167
943 H LYS 124 H LYS 124 32.809 0.149 -1.629
944 HA LYS 124 HA LYS 124 31.789 -1.393 0.659
945 1HB LYS 124 2HB LYS 124 30.253 -0.537 -1.803
946 2HB LYS 124 1HB LYS 124 29.630 -1.573 -0.526
947 1HG LYS 124 2HG LYS 124 29.804 0.238 1.069
948 2HG LYS 124 1HG LYS 124 30.526 1.277 -0.160
949 1HD LYS 124 2HD LYS 124 28.467 1.099 -1.495
950 2HD LYS 124 1HD LYS 124 27.747 0.109 -0.223
951 1HE LYS 124 2HE LYS 124 27.997 1.961 1.356
952 2HE LYS 124 1HE LYS 124 28.710 2.952 0.083
953 1HZ LYS 124 1HZ LYS 124 26.347 3.421 0.446
954 2HZ LYS 124 2HZ LYS 124 25.960 1.824 0.017
955 3HZ LYS 124 3HZ LYS 124 26.647 2.865 -1.130
956 H SER 125 H SER 125 33.407 -2.949 0.249
957 HA SER 125 HA SER 125 33.243 -4.450 -2.230
958 1HB SER 125 2HB SER 125 34.854 -4.978 0.285
959 2HB SER 125 1HB SER 125 35.023 -5.841 -1.246
960 HG SER 125 HG SER 125 35.576 -3.102 -0.699
961 H LYS 126 H LYS 126 31.535 -5.708 -2.471
962 HA LYS 126 HA LYS 126 30.180 -6.756 -0.127
963 1HB LYS 126 2HB LYS 126 28.386 -7.369 -1.683
964 2HB LYS 126 1HB LYS 126 28.826 -5.674 -1.835
965 1HG LYS 126 2HG LYS 126 30.148 -6.218 -3.841
966 2HG LYS 126 1HG LYS 126 29.644 -7.903 -3.693
967 1HD LYS 126 2HD LYS 126 27.814 -5.538 -4.105
968 2HD LYS 126 1HD LYS 126 28.286 -6.705 -5.342
969 1HE LYS 126 2HE LYS 126 27.200 -8.492 -4.105
970 2HE LYS 126 1HE LYS 126 26.786 -7.373 -2.807
971 1HZ LYS 126 1HZ LYS 126 24.884 -7.679 -4.184
972 2HZ LYS 126 2HZ LYS 126 25.763 -7.333 -5.595
973 3HZ LYS 126 3HZ LYS 126 25.466 -6.108 -4.458
974 H SER 127 H SER 127 29.602 -8.945 0.118
975 HA SER 127 HA SER 127 31.121 -10.872 -1.484
976 1HB SER 127 2HB SER 127 32.408 -10.441 0.586
977 2HB SER 127 1HB SER 127 30.993 -10.859 1.549
978 HG SER 127 HG SER 127 32.685 -12.515 0.035
979 H LEU 128 H LEU 128 29.291 -11.561 -2.527
980 HA LEU 128 HA LEU 128 26.988 -12.351 -0.913
981 1HB LEU 128 2HB LEU 128 26.608 -10.968 -2.905
982 2HB LEU 128 1HB LEU 128 27.341 -12.205 -3.907
983 HG LEU 128 HG LEU 128 25.515 -13.759 -3.285
984 1HD1 LEU 128 1HD1 LEU 128 23.521 -12.886 -2.192
985 2HD1 LEU 128 2HD1 LEU 128 24.331 -11.340 -1.937
986 3HD1 LEU 128 3HD1 LEU 128 24.926 -12.792 -1.131
987 1HD2 LEU 128 1HD2 LEU 128 25.375 -12.469 -5.342
988 2HD2 LEU 128 2HD2 LEU 128 24.624 -11.134 -4.469
989 3HD2 LEU 128 3HD2 LEU 128 23.777 -12.673 -4.625
990 H GLU 129 H GLU 129 27.270 -14.300 -0.037
991 HA GLU 129 HA GLU 129 28.411 -16.490 -1.533
992 1HB GLU 129 2HB GLU 129 28.576 -16.107 1.017
993 2HB GLU 129 1HB GLU 129 26.922 -16.694 1.086
994 1HG GLU 129 2HG GLU 129 29.124 -18.295 -0.170
995 2HG GLU 129 1HG GLU 129 28.800 -18.346 1.559
996 H HIS 130 H HIS 130 27.095 -16.815 -3.284
997 HA HIS 130 HA HIS 130 24.250 -16.770 -3.146
998 1HB HIS 130 2HB HIS 130 25.942 -16.460 -5.178
999 2HB HIS 130 1HB HIS 130 25.668 -18.188 -5.364
1000 HD1 HIS 130 1HD HIS 130 24.570 -15.272 -6.834
1001 HD2 HIS 130 2HD HIS 130 22.527 -18.493 -5.165
1002 HE1 HIS 130 1HE HIS 130 22.260 -15.203 -7.829
1003 HE2 HIS 130 2HE HIS 130 21.013 -17.119 -6.762
1004 H HIS 131 H HIS 131 23.359 -18.234 -1.796
1005 HA HIS 131 HA HIS 131 24.473 -20.909 -1.627
1006 1HB HIS 131 2HB HIS 131 23.570 -19.311 0.290
1007 2HB HIS 131 1HB HIS 131 22.044 -20.091 -0.108
1008 HD1 HIS 131 1HD HIS 131 25.391 -20.728 1.413
1009 HD2 HIS 131 2HD HIS 131 21.857 -22.791 0.635
1010 HE1 HIS 131 1HE HIS 131 25.542 -22.869 2.735
1011 HE2 HIS 131 2HE HIS 131 23.330 -24.026 2.370
1012 H HIS 132 H HIS 132 21.429 -19.330 -2.468
1013 HA HIS 132 HA HIS 132 19.767 -19.891 -3.899
1014 1HB HIS 132 2HB HIS 132 21.481 -20.513 -5.500
1015 2HB HIS 132 1HB HIS 132 21.656 -22.096 -4.753
1016 HD1 HIS 132 1HD HIS 132 20.356 -23.918 -5.839
1017 HD2 HIS 132 2HD HIS 132 18.748 -20.167 -6.643
1018 HE1 HIS 132 1HE HIS 132 18.471 -24.317 -7.454
1019 HE2 HIS 132 2HE HIS 132 17.413 -22.059 -7.795
1020 H HIS 133 H HIS 133 18.111 -20.412 -2.624
1021 HA HIS 133 HA HIS 133 17.802 -22.916 -1.293
1022 1HB HIS 133 2HB HIS 133 16.602 -20.911 -0.569
1023 2HB HIS 133 1HB HIS 133 15.764 -20.828 -2.112
1024 HD1 HIS 133 1HD HIS 133 16.083 -23.332 0.753
1025 HD2 HIS 133 2HD HIS 133 13.296 -21.900 -1.983
1026 HE1 HIS 133 1HE HIS 133 13.916 -24.468 1.331
1027 HE2 HIS 133 2HE HIS 133 12.206 -23.368 -0.157
1028 H HIS 134 H HIS 134 16.899 -24.803 -2.005
1029 HA HIS 134 HA HIS 134 16.149 -24.864 -4.864
1030 1HB HIS 134 2HB HIS 134 18.301 -26.004 -4.294
1031 2HB HIS 134 1HB HIS 134 17.404 -27.078 -3.226
1032 HD1 HIS 134 1HD HIS 134 15.904 -28.896 -4.353
1033 HD2 HIS 134 2HD HIS 134 18.099 -26.569 -7.009
1034 HE1 HIS 134 1HE HIS 134 15.802 -30.102 -6.553
1035 HE2 HIS 134 2HE HIS 134 17.112 -28.663 -8.157
1036 H HIS 135 H HIS 135 14.079 -25.324 -5.199
1037 HA HIS 135 HA HIS 135 12.851 -27.426 -3.575
1038 1HB HIS 135 2HB HIS 135 12.076 -25.274 -2.638
1039 2HB HIS 135 1HB HIS 135 11.487 -24.798 -4.228
1040 HD1 HIS 135 1HD HIS 135 10.847 -27.395 -1.551
1041 HD2 HIS 135 2HD HIS 135 8.942 -25.638 -4.804
1042 HE1 HIS 135 1HE HIS 135 8.490 -28.270 -1.512
1043 HE2 HIS 135 2HE HIS 135 7.430 -27.371 -3.616
Start of MODEL 18
1 1H MET 1 1HT MET 1 27.871 18.569 -7.154
2 2H MET 1 2HT MET 1 26.602 19.096 -8.147
3 3H MET 1 3HT MET 1 26.443 17.657 -7.268
4 HA MET 1 HA MET 1 26.651 18.978 -5.190
5 1HB MET 1 2HB MET 1 26.281 21.237 -7.169
6 2HB MET 1 1HB MET 1 26.087 21.404 -5.431
7 1HG MET 1 2HG MET 1 28.428 20.842 -5.102
8 2HG MET 1 1HG MET 1 28.631 20.620 -6.839
9 1HE MET 1 1HE MET 1 30.600 23.939 -6.040
10 2HE MET 1 2HE MET 1 30.718 22.306 -6.693
11 3HE MET 1 3HE MET 1 30.431 22.549 -4.970
12 H ILE 2 H ILE 2 24.759 18.732 -4.157
13 HA ILE 2 HA ILE 2 22.420 18.196 -5.745
14 HB ILE 2 HB ILE 2 22.835 16.734 -3.895
15 1HG1 ILE 2 2HG1 ILE 2 20.678 16.922 -2.645
16 2HG1 ILE 2 1HG1 ILE 2 20.437 18.501 -3.387
17 1HG2 ILE 2 1HG2 ILE 2 22.752 17.479 -1.557
18 2HG2 ILE 2 2HG2 ILE 2 22.657 19.149 -2.112
19 3HG2 ILE 2 3HG2 ILE 2 24.099 18.193 -2.446
20 1HD1 ILE 2 1HD1 ILE 2 20.406 17.464 -5.595
21 2HD1 ILE 2 2HD1 ILE 2 19.169 16.782 -4.538
22 3HD1 ILE 2 3HD1 ILE 2 20.652 15.882 -4.855
23 H MET 3 H MET 3 21.859 20.129 -6.664
24 HA MET 3 HA MET 3 20.223 21.841 -5.016
25 1HB MET 3 2HB MET 3 22.436 22.890 -4.773
26 2HB MET 3 1HB MET 3 22.593 22.972 -6.520
27 1HG MET 3 2HG MET 3 20.660 24.482 -6.607
28 2HG MET 3 1HG MET 3 20.558 24.437 -4.848
29 1HE MET 3 1HE MET 3 23.704 24.340 -4.147
30 2HE MET 3 2HE MET 3 22.549 25.326 -3.249
31 3HE MET 3 3HE MET 3 24.031 26.052 -3.869
32 H VAL 4 H VAL 4 18.508 22.483 -6.131
33 HA VAL 4 HA VAL 4 17.096 23.045 -7.805
34 HB VAL 4 HB VAL 4 19.586 23.239 -9.501
35 1HG1 VAL 4 1HG1 VAL 4 17.629 22.870 -10.897
36 2HG1 VAL 4 2HG1 VAL 4 18.214 24.526 -11.065
37 3HG1 VAL 4 3HG1 VAL 4 16.785 24.190 -10.086
38 1HG2 VAL 4 1HG2 VAL 4 17.949 25.353 -8.096
39 2HG2 VAL 4 2HG2 VAL 4 19.292 25.671 -9.196
40 3HG2 VAL 4 3HG2 VAL 4 19.581 24.832 -7.671
41 H SER 5 H SER 5 15.781 21.437 -8.271
42 HA SER 5 HA SER 5 16.707 19.111 -9.752
43 1HB SER 5 2HB SER 5 13.935 19.849 -8.774
44 2HB SER 5 1HB SER 5 14.409 18.289 -9.445
45 HG SER 5 HG SER 5 15.612 19.439 -7.143
46 H GLY 6 H GLY 6 14.721 21.980 -10.204
47 1HA GLY 6 2HA GLY 6 15.282 22.128 -12.977
48 2HA GLY 6 1HA GLY 6 13.668 21.472 -12.734
49 H CYS 7 H CYS 7 15.413 24.277 -13.147
50 HA CYS 7 HA CYS 7 14.124 26.062 -11.378
51 1HB CYS 7 2HB CYS 7 15.432 26.594 -14.050
52 2HB CYS 7 1HB CYS 7 14.966 27.836 -12.892
53 HG CYS 7 HG CYS 7 16.738 26.991 -10.907
54 H GLN 8 H GLN 8 13.282 24.913 -14.585
55 HA GLN 8 HA GLN 8 10.814 26.498 -14.424
56 1HB GLN 8 2HB GLN 8 10.626 26.023 -16.907
57 2HB GLN 8 1HB GLN 8 11.908 27.123 -16.423
58 1HG GLN 8 2HG GLN 8 13.575 25.535 -16.815
59 2HG GLN 8 1HG GLN 8 12.420 24.204 -16.846
60 1HE2 GLN 8 1HE2 GLN 8 13.756 26.890 -18.625
61 2HE2 GLN 8 2HE2 GLN 8 13.138 26.413 -20.174
62 H GLN 9 H GLN 9 9.258 25.344 -13.585
63 HA GLN 9 HA GLN 9 9.076 22.478 -14.080
64 1HB GLN 9 2HB GLN 9 7.208 22.544 -12.439
65 2HB GLN 9 1HB GLN 9 8.721 23.148 -11.788
66 1HG GLN 9 2HG GLN 9 6.613 24.992 -12.862
67 2HG GLN 9 1HG GLN 9 6.581 24.400 -11.202
68 1HE2 GLN 9 1HE2 GLN 9 8.216 25.055 -9.772
69 2HE2 GLN 9 2HE2 GLN 9 9.204 26.441 -10.087
70 H GLN 10 H GLN 10 8.702 24.249 -16.257
71 HA GLN 10 HA GLN 10 5.958 24.616 -16.876
72 1HB GLN 10 2HB GLN 10 7.895 25.853 -17.888
73 2HB GLN 10 1HB GLN 10 8.277 24.399 -18.800
74 1HG GLN 10 2HG GLN 10 6.177 24.520 -19.959
75 2HG GLN 10 1HG GLN 10 5.667 25.887 -18.968
76 1HE2 GLN 10 1HE2 GLN 10 7.665 24.827 -21.589
77 2HE2 GLN 10 2HE2 GLN 10 8.115 26.401 -22.152
78 H LYS 11 H LYS 11 8.262 22.036 -17.396
79 HA LYS 11 HA LYS 11 6.158 20.400 -18.627
80 1HB LYS 11 2HB LYS 11 9.136 19.900 -18.385
81 2HB LYS 11 1HB LYS 11 7.988 18.810 -19.152
82 1HG LYS 11 2HG LYS 11 7.467 20.554 -20.803
83 2HG LYS 11 1HG LYS 11 8.669 21.603 -20.051
84 1HD LYS 11 2HD LYS 11 9.816 20.675 -21.848
85 2HD LYS 11 1HD LYS 11 10.314 19.667 -20.490
86 1HE LYS 11 2HE LYS 11 8.068 18.949 -22.367
87 2HE LYS 11 1HE LYS 11 9.735 18.443 -22.613
88 1HZ LYS 11 1HZ LYS 11 7.947 17.703 -20.357
89 2HZ LYS 11 2HZ LYS 11 9.610 17.381 -20.380
90 3HZ LYS 11 3HZ LYS 11 8.600 16.681 -21.546
91 H GLU 12 H GLU 12 5.075 19.072 -17.324
92 HA GLU 12 HA GLU 12 6.332 18.325 -14.764
93 1HB GLU 12 2HB GLU 12 4.391 20.042 -14.754
94 2HB GLU 12 1HB GLU 12 3.364 18.662 -15.116
95 1HG GLU 12 2HG GLU 12 3.275 18.967 -12.787
96 2HG GLU 12 1HG GLU 12 4.300 17.558 -13.066
97 H GLU 13 H GLU 13 7.029 16.310 -15.595
98 HA GLU 13 HA GLU 13 4.934 14.455 -16.419
99 1HB GLU 13 2HB GLU 13 7.923 14.413 -16.732
100 2HB GLU 13 1HB GLU 13 6.881 13.091 -17.158
101 1HG GLU 13 2HG GLU 13 7.228 14.121 -19.195
102 2HG GLU 13 1HG GLU 13 5.690 14.810 -18.679
103 H THR 14 H THR 14 6.382 15.376 -13.788
104 HA THR 14 HA THR 14 7.665 13.166 -12.674
105 HB THR 14 HB THR 14 8.000 15.406 -11.794
106 HG1 THR 14 1HG THR 14 8.197 14.776 -9.719
107 1HG2 THR 14 1HG2 THR 14 6.329 16.477 -10.346
108 2HG2 THR 14 2HG2 THR 14 5.177 15.201 -10.744
109 3HG2 THR 14 3HG2 THR 14 5.746 16.297 -12.002
110 HA PRO 15 HA PRO 15 4.121 10.695 -11.428
111 1HB PRO 15 2HB PRO 15 6.039 8.700 -10.620
112 2HB PRO 15 1HB PRO 15 4.934 8.656 -11.993
113 1HG PRO 15 2HG PRO 15 7.664 8.836 -12.218
114 2HG PRO 15 1HG PRO 15 6.528 9.405 -13.452
115 1HD PRO 15 2HD PRO 15 8.006 10.961 -11.367
116 2HD PRO 15 1HD PRO 15 7.657 11.389 -13.057
117 H PHE 16 H PHE 16 3.490 11.797 -9.605
118 HA PHE 16 HA PHE 16 5.125 12.334 -7.393
119 1HB PHE 16 2HB PHE 16 3.046 13.030 -6.263
120 2HB PHE 16 1HB PHE 16 3.180 13.691 -7.887
121 HD1 PHE 16 2HD PHE 16 1.756 12.803 -9.702
122 HD2 PHE 16 1HD PHE 16 1.286 11.544 -5.663
123 HE1 PHE 16 2HE PHE 16 -0.468 11.900 -10.245
124 HE2 PHE 16 1HE PHE 16 -0.940 10.644 -6.201
125 HZ PHE 16 HZ PHE 16 -1.816 10.816 -8.491
126 H TYR 17 H TYR 17 3.277 9.514 -8.165
127 HA TYR 17 HA TYR 17 3.034 8.631 -5.435
128 1HB TYR 17 2HB TYR 17 1.913 6.694 -6.362
129 2HB TYR 17 1HB TYR 17 1.278 8.153 -7.106
130 HD1 TYR 17 1HD TYR 17 2.088 8.753 -9.449
131 HD2 TYR 17 2HD TYR 17 2.809 4.956 -7.660
132 HE1 TYR 17 1HE TYR 17 2.516 7.792 -11.672
133 HE2 TYR 17 2HE TYR 17 3.247 3.989 -9.877
134 HH TYR 17 HH TYR 17 2.810 4.398 -12.186
135 H TYR 18 H TYR 18 5.410 8.417 -7.853
136 HA TYR 18 HA TYR 18 6.355 5.784 -7.251
137 1HB TYR 18 2HB TYR 18 6.666 6.845 -9.469
138 2HB TYR 18 1HB TYR 18 7.746 8.023 -8.733
139 HD1 TYR 18 2HD TYR 18 7.339 4.435 -9.542
140 HD2 TYR 18 1HD TYR 18 10.029 7.497 -8.314
141 HE1 TYR 18 2HE TYR 18 9.234 2.911 -9.911
142 HE2 TYR 18 1HE TYR 18 11.929 5.979 -8.684
143 HH TYR 18 HH TYR 18 11.702 3.123 -10.422
144 H GLY 19 H GLY 19 7.918 5.158 -5.869
145 1HA GLY 19 2HA GLY 19 10.105 5.943 -4.849
146 2HA GLY 19 1HA GLY 19 9.142 7.265 -4.207
147 H THR 20 H THR 20 9.862 6.573 -2.119
148 HA THR 20 HA THR 20 8.360 4.237 -1.114
149 HB THR 20 HB THR 20 10.867 5.428 0.094
150 HG1 THR 20 1HG THR 20 10.800 4.131 -2.091
151 1HG2 THR 20 1HG2 THR 20 9.399 2.838 0.635
152 2HG2 THR 20 2HG2 THR 20 9.412 4.253 1.686
153 3HG2 THR 20 3HG2 THR 20 10.901 3.350 1.408
154 H TRP 21 H TRP 21 6.840 4.640 0.373
155 HA TRP 21 HA TRP 21 6.830 7.293 1.652
156 1HB TRP 21 2HB TRP 21 4.486 5.496 0.984
157 2HB TRP 21 1HB TRP 21 4.376 7.061 1.787
158 HD1 TRP 21 HD TRP 21 5.004 5.493 -1.646
159 HE1 TRP 21 1HE TRP 21 4.842 7.328 -3.442
160 HE3 TRP 21 3HE TRP 21 4.650 9.578 1.406
161 HZ2 TRP 21 2HZ TRP 21 4.595 10.135 -3.548
162 HZ3 TRP 21 3HZ TRP 21 4.450 11.804 0.374
163 HH2 TRP 21 HH TRP 21 4.425 12.076 -2.053
164 H ASP 22 H ASP 22 6.455 7.441 3.829
165 HA ASP 22 HA ASP 22 6.882 4.922 5.296
166 1HB ASP 22 2HB ASP 22 8.717 6.526 5.411
167 2HB ASP 22 1HB ASP 22 7.625 7.764 6.016
168 H GLU 23 H GLU 23 5.533 4.302 6.879
169 HA GLU 23 HA GLU 23 3.185 5.959 7.403
170 1HB GLU 23 2HB GLU 23 3.770 3.049 7.922
171 2HB GLU 23 1HB GLU 23 2.344 3.857 8.559
172 1HG GLU 23 2HG GLU 23 1.823 4.502 6.168
173 2HG GLU 23 1HG GLU 23 3.061 3.339 5.695
174 H GLY 24 H GLY 24 5.626 6.801 8.608
175 1HA GLY 24 2HA GLY 24 5.533 6.139 11.390
176 2HA GLY 24 1HA GLY 24 6.343 7.531 10.679
177 H ARG 25 H ARG 25 3.646 8.070 9.346
178 HA ARG 25 HA ARG 25 2.575 9.710 11.475
179 1HB ARG 25 2HB ARG 25 3.011 10.764 9.314
180 2HB ARG 25 1HB ARG 25 2.007 9.573 8.506
181 1HG ARG 25 2HG ARG 25 0.043 10.432 9.661
182 2HG ARG 25 1HG ARG 25 1.049 11.626 10.488
183 1HD ARG 25 2HD ARG 25 0.650 11.394 7.507
184 2HD ARG 25 1HD ARG 25 -0.088 12.601 8.558
185 HE ARG 25 HE ARG 25 2.728 12.677 8.815
186 1HH1 ARG 25 1HH1 ARG 25 0.192 13.504 6.531
187 2HH1 ARG 25 2HH1 ARG 25 1.062 14.849 5.868
188 1HH2 ARG 25 1HH2 ARG 25 3.878 14.400 7.925
189 2HH2 ARG 25 2HH2 ARG 25 3.188 15.338 6.632
190 H ALA 26 H ALA 26 0.540 9.520 12.202
191 HA ALA 26 HA ALA 26 -1.441 8.594 12.804
192 1HB ALA 26 1HB ALA 26 -2.022 8.712 10.426
193 2HB ALA 26 2HB ALA 26 -2.728 7.294 11.204
194 3HB ALA 26 3HB ALA 26 -1.305 7.118 10.178
195 HA PRO 27 HA PRO 27 -0.446 4.825 14.909
196 1HB PRO 27 2HB PRO 27 -3.281 4.019 14.665
197 2HB PRO 27 1HB PRO 27 -2.309 4.294 16.113
198 1HG PRO 27 2HG PRO 27 -4.210 6.022 15.381
199 2HG PRO 27 1HG PRO 27 -2.684 6.578 16.095
200 1HD PRO 27 2HD PRO 27 -3.537 6.558 13.223
201 2HD PRO 27 1HD PRO 27 -2.669 7.815 14.130
202 H GLY 28 H GLY 28 0.285 2.870 14.284
203 1HA GLY 28 2HA GLY 28 -0.600 1.897 11.649
204 2HA GLY 28 1HA GLY 28 0.970 1.587 12.374
205 HA PRO 29 HA PRO 29 -1.462 -2.302 12.941
206 1HB PRO 29 2HB PRO 29 0.824 -3.841 12.901
207 2HB PRO 29 1HB PRO 29 -0.147 -3.448 11.481
208 1HG PRO 29 2HG PRO 29 2.379 -2.194 12.458
209 2HG PRO 29 1HG PRO 29 1.875 -2.561 10.798
210 1HD PRO 29 2HD PRO 29 1.757 -0.069 11.809
211 2HD PRO 29 1HD PRO 29 0.559 -0.672 10.645
212 H THR 30 H THR 30 -1.083 -4.072 14.568
213 HA THR 30 HA THR 30 0.196 -3.018 17.011
214 HB THR 30 HB THR 30 -2.267 -2.680 17.026
215 HG1 THR 30 1HG THR 30 -1.130 -4.485 18.919
216 1HG2 THR 30 1HG2 THR 30 -2.932 -4.642 15.740
217 2HG2 THR 30 2HG2 THR 30 -3.736 -4.620 17.308
218 3HG2 THR 30 3HG2 THR 30 -2.365 -5.696 17.037
219 H ASP 31 H ASP 31 -0.041 -5.503 14.842
220 HA ASP 31 HA ASP 31 0.118 -7.871 16.274
221 1HB ASP 31 2HB ASP 31 -0.085 -8.016 13.928
222 2HB ASP 31 1HB ASP 31 1.319 -6.991 13.656
223 H GLY 32 H GLY 32 2.603 -5.563 15.519
224 1HA GLY 32 2HA GLY 32 4.358 -5.937 17.561
225 2HA GLY 32 1HA GLY 32 4.806 -7.183 16.389
226 H VAL 33 H VAL 33 4.177 -5.922 14.060
227 HA VAL 33 HA VAL 33 6.071 -3.866 13.600
228 HB VAL 33 HB VAL 33 3.511 -4.288 12.060
229 1HG1 VAL 33 1HG1 VAL 33 4.790 -2.312 11.465
230 2HG1 VAL 33 2HG1 VAL 33 4.771 -3.489 10.154
231 3HG1 VAL 33 3HG1 VAL 33 6.208 -3.316 11.161
232 1HG2 VAL 33 1HG2 VAL 33 6.087 -5.816 11.704
233 2HG2 VAL 33 2HG2 VAL 33 4.668 -5.923 10.662
234 3HG2 VAL 33 3HG2 VAL 33 4.575 -6.470 12.336
235 H LYS 34 H LYS 34 5.838 -1.681 13.954
236 HA LYS 34 HA LYS 34 3.218 -0.785 14.898
237 1HB LYS 34 2HB LYS 34 5.994 0.236 15.480
238 2HB LYS 34 1HB LYS 34 4.528 1.060 15.967
239 1HG LYS 34 2HG LYS 34 3.874 -1.041 17.180
240 2HG LYS 34 1HG LYS 34 5.503 -1.632 16.855
241 1HD LYS 34 2HD LYS 34 6.443 0.265 18.069
242 2HD LYS 34 1HD LYS 34 4.818 0.886 18.371
243 1HE LYS 34 2HE LYS 34 4.278 -1.165 19.601
244 2HE LYS 34 1HE LYS 34 5.919 -1.750 19.324
245 1HZ LYS 34 1HZ LYS 34 5.125 0.637 20.894
246 2HZ LYS 34 2HZ LYS 34 6.728 0.225 20.526
247 3HZ LYS 34 3HZ LYS 34 5.789 -0.805 21.492
248 H SER 35 H SER 35 5.404 -0.578 12.364
249 HA SER 35 HA SER 35 3.914 1.510 11.071
250 1HB SER 35 2HB SER 35 6.853 1.994 11.587
251 2HB SER 35 1HB SER 35 5.745 3.055 10.728
252 HG SER 35 HG SER 35 4.562 2.828 12.948
253 H ALA 36 H ALA 36 4.616 1.798 8.824
254 HA ALA 36 HA ALA 36 6.186 -0.458 7.819
255 1HB ALA 36 1HB ALA 36 4.481 -0.924 6.112
256 2HB ALA 36 2HB ALA 36 3.426 0.280 6.851
257 3HB ALA 36 3HB ALA 36 3.862 -1.177 7.743
258 H THR 37 H THR 37 6.733 -0.219 5.538
259 HA THR 37 HA THR 37 6.673 2.552 4.564
260 HB THR 37 HB THR 37 8.961 2.083 3.558
261 HG1 THR 37 1HG THR 37 8.766 -0.248 4.087
262 1HG2 THR 37 1HG2 THR 37 10.177 2.628 5.630
263 2HG2 THR 37 2HG2 THR 37 8.743 2.219 6.570
264 3HG2 THR 37 3HG2 THR 37 8.709 3.587 5.457
265 H VAL 38 H VAL 38 6.040 2.717 2.473
266 HA VAL 38 HA VAL 38 5.647 0.156 1.066
267 HB VAL 38 HB VAL 38 3.516 1.180 1.629
268 1HG1 VAL 38 1HG1 VAL 38 2.824 3.325 0.696
269 2HG1 VAL 38 2HG1 VAL 38 4.440 3.559 0.032
270 3HG1 VAL 38 3HG1 VAL 38 4.203 3.509 1.779
271 1HG2 VAL 38 1HG2 VAL 38 3.653 -0.077 -0.446
272 2HG2 VAL 38 2HG2 VAL 38 4.131 1.382 -1.315
273 3HG2 VAL 38 3HG2 VAL 38 2.520 1.265 -0.605
274 H THR 39 H THR 39 6.578 -0.145 -0.827
275 HA THR 39 HA THR 39 7.852 2.166 -2.132
276 HB THR 39 HB THR 39 8.718 -0.733 -2.295
277 HG1 THR 39 1HG THR 39 8.953 0.625 -0.205
278 1HG2 THR 39 1HG2 THR 39 10.753 0.165 -3.284
279 2HG2 THR 39 2HG2 THR 39 10.129 1.806 -3.131
280 3HG2 THR 39 3HG2 THR 39 9.351 0.667 -4.231
281 H PHE 40 H PHE 40 7.097 2.667 -4.096
282 HA PHE 40 HA PHE 40 5.408 0.692 -5.463
283 1HB PHE 40 2HB PHE 40 5.671 3.686 -5.835
284 2HB PHE 40 1HB PHE 40 4.666 2.653 -6.843
285 HD1 PHE 40 2HD PHE 40 2.649 1.625 -5.949
286 HD2 PHE 40 1HD PHE 40 5.006 4.286 -3.613
287 HE1 PHE 40 2HE PHE 40 0.778 1.889 -4.369
288 HE2 PHE 40 1HE PHE 40 3.144 4.556 -2.029
289 HZ PHE 40 HZ PHE 40 1.023 3.356 -2.404
290 H THR 41 H THR 41 6.323 -0.446 -6.991
291 HA THR 41 HA THR 41 8.642 0.645 -8.399
292 HB THR 41 HB THR 41 8.852 -1.798 -9.208
293 HG1 THR 41 1HG THR 41 7.759 -3.314 -8.094
294 1HG2 THR 41 1HG2 THR 41 10.084 -2.425 -7.192
295 2HG2 THR 41 2HG2 THR 41 9.280 -1.138 -6.294
296 3HG2 THR 41 3HG2 THR 41 10.381 -0.739 -7.613
297 H GLU 42 H GLU 42 8.677 -0.669 -10.716
298 HA GLU 42 HA GLU 42 7.210 0.980 -12.342
299 1HB GLU 42 2HB GLU 42 9.221 -0.338 -12.972
300 2HB GLU 42 1HB GLU 42 8.222 -1.779 -13.043
301 1HG GLU 42 2HG GLU 42 7.526 0.591 -14.714
302 2HG GLU 42 1HG GLU 42 8.830 -0.484 -15.211
303 H ASP 43 H ASP 43 6.393 -2.433 -11.563
304 HA ASP 43 HA ASP 43 3.636 -1.819 -12.402
305 1HB ASP 43 2HB ASP 43 4.948 -2.958 -14.234
306 2HB ASP 43 1HB ASP 43 5.101 -4.347 -13.171
307 H GLU 44 H GLU 44 5.406 -2.567 -9.871
308 HA GLU 44 HA GLU 44 3.394 -4.411 -8.784
309 1HB GLU 44 2HB GLU 44 6.110 -4.692 -7.669
310 2HB GLU 44 1HB GLU 44 4.893 -5.914 -7.990
311 1HG GLU 44 2HG GLU 44 6.518 -6.514 -9.462
312 2HG GLU 44 1HG GLU 44 5.532 -5.470 -10.484
313 H VAL 45 H VAL 45 3.270 -4.405 -6.437
314 HA VAL 45 HA VAL 45 4.232 -1.898 -5.213
315 HB VAL 45 HB VAL 45 1.831 -3.567 -4.419
316 1HG1 VAL 45 1HG1 VAL 45 1.349 -1.728 -2.854
317 2HG1 VAL 45 2HG1 VAL 45 2.882 -0.976 -3.289
318 3HG1 VAL 45 3HG1 VAL 45 2.868 -2.541 -2.479
319 1HG2 VAL 45 1HG2 VAL 45 1.970 -0.833 -5.680
320 2HG2 VAL 45 2HG2 VAL 45 0.502 -1.643 -5.133
321 3HG2 VAL 45 3HG2 VAL 45 1.435 -2.315 -6.473
322 H VAL 46 H VAL 46 5.798 -2.180 -3.749
323 HA VAL 46 HA VAL 46 6.015 -4.822 -2.461
324 HB VAL 46 HB VAL 46 8.167 -2.721 -2.761
325 1HG1 VAL 46 1HG1 VAL 46 8.456 -4.099 -0.765
326 2HG1 VAL 46 2HG1 VAL 46 9.691 -4.472 -1.969
327 3HG1 VAL 46 3HG1 VAL 46 8.321 -5.559 -1.744
328 1HG2 VAL 46 1HG2 VAL 46 7.758 -5.309 -4.253
329 2HG2 VAL 46 2HG2 VAL 46 9.184 -4.277 -4.378
330 3HG2 VAL 46 3HG2 VAL 46 7.611 -3.684 -4.917
331 H GLU 47 H GLU 47 5.456 -4.909 -0.406
332 HA GLU 47 HA GLU 47 5.402 -2.423 1.139
333 1HB GLU 47 2HB GLU 47 3.772 -4.912 1.215
334 2HB GLU 47 1HB GLU 47 3.991 -4.006 2.701
335 1HG GLU 47 2HG GLU 47 2.894 -2.136 1.886
336 2HG GLU 47 1HG GLU 47 3.087 -2.635 0.211
337 H THR 48 H THR 48 6.490 -2.199 2.942
338 HA THR 48 HA THR 48 8.049 -4.495 3.935
339 HB THR 48 HB THR 48 9.157 -1.740 4.220
340 HG1 THR 48 1HG THR 48 8.683 -2.960 1.828
341 1HG2 THR 48 1HG2 THR 48 10.261 -3.602 5.331
342 2HG2 THR 48 2HG2 THR 48 11.288 -2.955 4.050
343 3HG2 THR 48 3HG2 THR 48 10.398 -4.458 3.797
344 H GLU 49 H GLU 49 7.878 -4.844 6.038
345 HA GLU 49 HA GLU 49 6.416 -2.855 7.642
346 1HB GLU 49 2HB GLU 49 6.644 -5.838 8.063
347 2HB GLU 49 1HB GLU 49 5.683 -4.730 9.029
348 1HG GLU 49 2HG GLU 49 4.304 -4.226 7.069
349 2HG GLU 49 1HG GLU 49 5.256 -5.364 6.117
350 H VAL 50 H VAL 50 7.304 -2.111 9.523
351 HA VAL 50 HA VAL 50 10.042 -2.974 10.087
352 HB VAL 50 HB VAL 50 8.497 -0.662 11.288
353 1HG1 VAL 50 1HG1 VAL 50 10.309 -1.445 12.718
354 2HG1 VAL 50 2HG1 VAL 50 10.701 0.129 12.024
355 3HG1 VAL 50 3HG1 VAL 50 11.439 -1.333 11.369
356 1HG2 VAL 50 1HG2 VAL 50 9.849 0.760 9.801
357 2HG2 VAL 50 2HG2 VAL 50 8.795 -0.331 8.902
358 3HG2 VAL 50 3HG2 VAL 50 10.516 -0.689 9.045
359 H MET 51 H MET 51 10.255 -4.600 11.475
360 HA MET 51 HA MET 51 8.329 -4.785 13.704
361 1HB MET 51 2HB MET 51 8.615 -6.635 11.780
362 2HB MET 51 1HB MET 51 9.888 -7.159 12.868
363 1HG MET 51 2HG MET 51 7.013 -6.792 13.663
364 2HG MET 51 1HG MET 51 7.748 -8.327 13.212
365 1HE MET 51 1HE MET 51 6.976 -9.458 15.445
366 2HE MET 51 2HE MET 51 6.185 -7.961 15.933
367 3HE MET 51 3HE MET 51 7.270 -8.789 17.051
368 H GLU 52 H GLU 52 9.213 -4.342 15.582
369 HA GLU 52 HA GLU 52 12.002 -3.810 15.803
370 1HB GLU 52 2HB GLU 52 10.286 -2.498 17.008
371 2HB GLU 52 1HB GLU 52 9.916 -3.910 17.990
372 1HG GLU 52 2HG GLU 52 12.154 -3.884 18.920
373 2HG GLU 52 1HG GLU 52 12.585 -2.523 17.886
374 H GLY 53 H GLY 53 13.504 -5.286 16.044
375 1HA GLY 53 2HA GLY 53 14.466 -6.946 17.604
376 2HA GLY 53 1HA GLY 53 12.877 -7.706 17.635
377 H ARG 54 H ARG 54 12.647 -7.025 14.717
378 HA ARG 54 HA ARG 54 14.231 -9.273 13.664
379 1HB ARG 54 2HB ARG 54 11.704 -8.043 12.551
380 2HB ARG 54 1HB ARG 54 12.471 -9.540 12.039
381 1HG ARG 54 2HG ARG 54 11.640 -9.310 14.868
382 2HG ARG 54 1HG ARG 54 10.394 -9.503 13.641
383 1HD ARG 54 2HD ARG 54 10.982 -11.639 13.202
384 2HD ARG 54 1HD ARG 54 12.704 -11.296 13.362
385 HE ARG 54 HE ARG 54 11.630 -11.168 15.910
386 1HH1 ARG 54 1HH1 ARG 54 11.939 -13.586 13.384
387 2HH1 ARG 54 2HH1 ARG 54 12.081 -14.909 14.510
388 1HH2 ARG 54 1HH2 ARG 54 11.818 -12.877 17.368
389 2HH2 ARG 54 2HH2 ARG 54 12.025 -14.501 16.780
390 H GLY 55 H GLY 55 12.663 -6.309 12.585
391 1HA GLY 55 2HA GLY 55 14.265 -4.560 11.671
392 2HA GLY 55 1HA GLY 55 14.850 -5.875 10.652
393 H GLU 56 H GLU 56 14.192 -4.435 8.857
394 HA GLU 56 HA GLU 56 11.392 -4.127 8.376
395 1HB GLU 56 2HB GLU 56 13.806 -3.827 6.582
396 2HB GLU 56 1HB GLU 56 12.163 -3.457 6.095
397 1HG GLU 56 2HG GLU 56 13.155 -1.435 6.658
398 2HG GLU 56 1HG GLU 56 12.074 -1.816 7.983
399 H VAL 57 H VAL 57 10.062 -5.417 7.412
400 HA VAL 57 HA VAL 57 11.092 -7.947 6.296
401 HB VAL 57 HB VAL 57 8.437 -7.338 7.614
402 1HG1 VAL 57 1HG1 VAL 57 9.449 -9.929 6.432
403 2HG1 VAL 57 2HG1 VAL 57 8.123 -8.944 5.811
404 3HG1 VAL 57 3HG1 VAL 57 7.968 -9.747 7.373
405 1HG2 VAL 57 1HG2 VAL 57 10.285 -7.529 9.189
406 2HG2 VAL 57 2HG2 VAL 57 10.719 -9.095 8.503
407 3HG2 VAL 57 3HG2 VAL 57 9.181 -8.897 9.344
408 H GLN 58 H GLN 58 10.866 -8.109 4.133
409 HA GLN 58 HA GLN 58 9.047 -6.353 2.731
410 1HB GLN 58 2HB GLN 58 11.042 -8.366 1.685
411 2HB GLN 58 1HB GLN 58 10.192 -7.160 0.742
412 1HG GLN 58 2HG GLN 58 11.320 -5.388 1.983
413 2HG GLN 58 1HG GLN 58 12.177 -6.604 2.916
414 1HE2 GLN 58 1HE2 GLN 58 12.506 -8.373 0.608
415 2HE2 GLN 58 2HE2 GLN 58 13.752 -7.654 -0.361
416 H LEU 59 H LEU 59 7.115 -6.981 2.006
417 HA LEU 59 HA LEU 59 6.358 -9.786 2.092
418 1HB LEU 59 2HB LEU 59 4.830 -7.298 1.321
419 2HB LEU 59 1HB LEU 59 4.143 -8.912 1.329
420 HG LEU 59 HG LEU 59 5.245 -7.495 3.754
421 1HD1 LEU 59 1HD1 LEU 59 2.397 -7.961 2.894
422 2HD1 LEU 59 2HD1 LEU 59 3.231 -6.408 2.962
423 3HD1 LEU 59 3HD1 LEU 59 2.906 -7.300 4.449
424 1HD2 LEU 59 1HD2 LEU 59 3.738 -10.089 3.480
425 2HD2 LEU 59 2HD2 LEU 59 4.173 -9.309 5.001
426 3HD2 LEU 59 3HD2 LEU 59 5.435 -9.905 3.922
427 HA PRO 60 HA PRO 60 7.054 -10.728 -2.138
428 1HB PRO 60 2HB PRO 60 4.696 -11.941 -2.891
429 2HB PRO 60 1HB PRO 60 5.983 -12.740 -1.985
430 1HG PRO 60 2HG PRO 60 3.423 -11.566 -1.007
431 2HG PRO 60 1HG PRO 60 4.271 -13.025 -0.466
432 1HD PRO 60 2HD PRO 60 4.327 -10.691 0.903
433 2HD PRO 60 1HD PRO 60 5.677 -11.838 0.917
434 H PHE 61 H PHE 61 6.981 -9.548 -3.970
435 HA PHE 61 HA PHE 61 5.552 -7.158 -4.040
436 1HB PHE 61 2HB PHE 61 6.307 -6.955 -6.392
437 2HB PHE 61 1HB PHE 61 7.600 -7.366 -5.280
438 HD1 PHE 61 1HD PHE 61 8.510 -9.677 -5.259
439 HD2 PHE 61 2HD PHE 61 5.704 -8.376 -8.180
440 HE1 PHE 61 1HE PHE 61 9.123 -11.581 -6.690
441 HE2 PHE 61 2HE PHE 61 6.308 -10.279 -9.616
442 HZ PHE 61 HZ PHE 61 8.022 -11.887 -8.871
443 H MET 62 H MET 62 3.618 -6.607 -4.636
444 HA MET 62 HA MET 62 1.920 -8.661 -5.866
445 1HB MET 62 2HB MET 62 1.311 -6.301 -4.104
446 2HB MET 62 1HB MET 62 0.052 -7.124 -5.012
447 1HG MET 62 2HG MET 62 0.579 -9.214 -3.861
448 2HG MET 62 1HG MET 62 1.861 -8.396 -2.968
449 1HE MET 62 1HE MET 62 -0.132 -5.895 -0.740
450 2HE MET 62 2HE MET 62 0.596 -5.587 -2.316
451 3HE MET 62 3HE MET 62 1.454 -6.562 -1.122
452 H ALA 63 H ALA 63 1.079 -8.378 -7.824
453 HA ALA 63 HA ALA 63 1.949 -6.145 -9.389
454 1HB ALA 63 1HB ALA 63 1.787 -8.370 -10.356
455 2HB ALA 63 2HB ALA 63 0.747 -7.235 -11.218
456 3HB ALA 63 3HB ALA 63 0.048 -8.379 -10.072
457 H TYR 64 H TYR 64 0.881 -4.333 -9.870
458 HA TYR 64 HA TYR 64 -1.987 -4.206 -9.224
459 1HB TYR 64 2HB TYR 64 -1.778 -2.014 -8.359
460 2HB TYR 64 1HB TYR 64 -0.447 -2.905 -7.634
461 HD1 TYR 64 2HD TYR 64 1.884 -2.535 -8.496
462 HD2 TYR 64 1HD TYR 64 -1.394 -0.137 -9.772
463 HE1 TYR 64 2HE TYR 64 3.454 -0.833 -9.323
464 HE2 TYR 64 1HE TYR 64 0.171 1.573 -10.595
465 HH TYR 64 HH TYR 64 3.561 0.981 -10.850
466 H LYS 65 H LYS 65 -3.271 -3.076 -10.674
467 HA LYS 65 HA LYS 65 -1.888 -2.110 -13.086
468 1HB LYS 65 2HB LYS 65 -4.543 -3.534 -12.906
469 2HB LYS 65 1HB LYS 65 -3.930 -2.753 -14.359
470 1HG LYS 65 2HG LYS 65 -2.643 -5.031 -12.899
471 2HG LYS 65 1HG LYS 65 -3.518 -5.130 -14.423
472 1HD LYS 65 2HD LYS 65 -1.862 -3.767 -15.515
473 2HD LYS 65 1HD LYS 65 -1.046 -3.465 -13.982
474 1HE LYS 65 2HE LYS 65 -0.545 -5.874 -13.811
475 2HE LYS 65 1HE LYS 65 -1.295 -6.121 -15.387
476 1HZ LYS 65 1HZ LYS 65 0.364 -4.570 -16.318
477 2HZ LYS 65 2HZ LYS 65 1.063 -5.966 -15.655
478 3HZ LYS 65 3HZ LYS 65 1.134 -4.503 -14.805
479 H VAL 66 H VAL 66 -2.936 -0.507 -14.254
480 HA VAL 66 HA VAL 66 -4.052 1.478 -12.418
481 HB VAL 66 HB VAL 66 -2.816 1.808 -15.156
482 1HG1 VAL 66 1HG1 VAL 66 -4.485 3.544 -14.706
483 2HG1 VAL 66 2HG1 VAL 66 -2.852 4.212 -14.696
484 3HG1 VAL 66 3HG1 VAL 66 -3.692 3.912 -13.173
485 1HG2 VAL 66 1HG2 VAL 66 -1.187 1.156 -13.478
486 2HG2 VAL 66 2HG2 VAL 66 -1.739 2.446 -12.411
487 3HG2 VAL 66 3HG2 VAL 66 -0.948 2.842 -13.937
488 H ILE 67 H ILE 67 -6.167 1.693 -12.413
489 HA ILE 67 HA ILE 67 -7.792 0.927 -14.678
490 HB ILE 67 HB ILE 67 -8.743 2.375 -12.215
491 1HG1 ILE 67 2HG1 ILE 67 -8.403 -0.609 -12.597
492 2HG1 ILE 67 1HG1 ILE 67 -7.509 0.406 -11.469
493 1HG2 ILE 67 1HG2 ILE 67 -10.301 2.262 -14.096
494 2HG2 ILE 67 2HG2 ILE 67 -10.873 1.303 -12.732
495 3HG2 ILE 67 3HG2 ILE 67 -10.143 0.504 -14.124
496 1HD1 ILE 67 1HD1 ILE 67 -9.541 0.842 -10.224
497 2HD1 ILE 67 2HD1 ILE 67 -9.268 -0.893 -10.373
498 3HD1 ILE 67 3HD1 ILE 67 -10.477 -0.103 -11.384
499 H SER 68 H SER 68 -7.199 3.858 -12.796
500 HA SER 68 HA SER 68 -7.597 5.464 -15.220
501 1HB SER 68 2HB SER 68 -8.647 6.392 -12.564
502 2HB SER 68 1HB SER 68 -9.064 6.973 -14.168
503 HG SER 68 HG SER 68 -10.075 4.815 -12.752
504 H GLN 69 H GLN 69 -6.521 7.480 -15.151
505 HA GLN 69 HA GLN 69 -4.727 8.028 -12.942
506 1HB GLN 69 2HB GLN 69 -3.449 6.479 -14.425
507 2HB GLN 69 1HB GLN 69 -3.661 7.617 -15.749
508 1HG GLN 69 2HG GLN 69 -2.444 9.315 -14.420
509 2HG GLN 69 1HG GLN 69 -2.140 8.083 -13.196
510 1HE2 GLN 69 1HE2 GLN 69 -1.423 9.166 -16.420
511 2HE2 GLN 69 2HE2 GLN 69 -0.015 8.180 -16.645
512 H SER 70 H SER 70 -3.960 10.194 -12.969
513 HA SER 70 HA SER 70 -4.944 11.914 -15.110
514 1HB SER 70 2HB SER 70 -6.728 11.907 -13.398
515 2HB SER 70 1HB SER 70 -5.555 12.410 -12.183
516 HG SER 70 HG SER 70 -6.981 13.992 -13.621
517 H THR 71 H THR 71 -3.618 13.570 -15.552
518 HA THR 71 HA THR 71 -1.097 13.868 -14.288
519 HB THR 71 HB THR 71 -1.103 16.072 -15.632
520 HG1 THR 71 1HG THR 71 -3.156 16.505 -16.136
521 1HG2 THR 71 1HG2 THR 71 -1.501 13.443 -17.067
522 2HG2 THR 71 2HG2 THR 71 0.019 14.034 -16.394
523 3HG2 THR 71 3HG2 THR 71 -0.737 14.878 -17.746
524 H ASP 72 H ASP 72 -4.211 15.007 -13.572
525 HA ASP 72 HA ASP 72 -3.649 17.457 -12.301
526 1HB ASP 72 2HB ASP 72 -5.907 16.910 -12.950
527 2HB ASP 72 1HB ASP 72 -5.910 15.496 -11.902
528 H GLY 73 H GLY 73 -3.936 14.164 -11.053
529 1HA GLY 73 2HA GLY 73 -2.078 13.864 -9.275
530 2HA GLY 73 1HA GLY 73 -2.964 15.136 -8.448
531 H SER 74 H SER 74 -4.607 12.682 -10.298
532 HA SER 74 HA SER 74 -5.187 11.186 -7.860
533 1HB SER 74 2HB SER 74 -7.549 10.928 -8.989
534 2HB SER 74 1HB SER 74 -7.180 12.307 -7.965
535 HG SER 74 HG SER 74 -7.569 13.520 -9.629
536 H ILE 75 H ILE 75 -5.082 9.073 -8.075
537 HA ILE 75 HA ILE 75 -5.071 7.904 -10.772
538 HB ILE 75 HB ILE 75 -2.992 7.241 -8.675
539 1HG1 ILE 75 2HG1 ILE 75 -2.754 8.827 -11.245
540 2HG1 ILE 75 1HG1 ILE 75 -2.542 9.445 -9.611
541 1HG2 ILE 75 1HG2 ILE 75 -3.553 5.333 -10.051
542 2HG2 ILE 75 2HG2 ILE 75 -1.954 5.933 -10.494
543 3HG2 ILE 75 3HG2 ILE 75 -3.345 6.292 -11.516
544 1HD1 ILE 75 1HD1 ILE 75 -0.564 8.057 -9.335
545 2HD1 ILE 75 2HD1 ILE 75 -0.414 9.117 -10.736
546 3HD1 ILE 75 3HD1 ILE 75 -0.787 7.408 -10.960
547 H GLU 76 H GLU 76 -6.040 5.953 -10.916
548 HA GLU 76 HA GLU 76 -6.907 4.698 -8.396
549 1HB GLU 76 2HB GLU 76 -8.746 5.702 -9.779
550 2HB GLU 76 1HB GLU 76 -8.310 4.574 -11.055
551 1HG GLU 76 2HG GLU 76 -8.891 2.700 -9.689
552 2HG GLU 76 1HG GLU 76 -9.176 3.754 -8.304
553 H ILE 77 H ILE 77 -6.173 2.744 -8.067
554 HA ILE 77 HA ILE 77 -5.209 1.145 -10.335
555 HB ILE 77 HB ILE 77 -3.251 0.424 -8.961
556 1HG1 ILE 77 2HG1 ILE 77 -4.023 2.778 -7.223
557 2HG1 ILE 77 1HG1 ILE 77 -4.149 1.087 -6.758
558 1HG2 ILE 77 1HG2 ILE 77 -1.899 2.412 -9.404
559 2HG2 ILE 77 2HG2 ILE 77 -3.368 3.370 -9.600
560 3HG2 ILE 77 3HG2 ILE 77 -3.002 2.071 -10.737
561 1HD1 ILE 77 1HD1 ILE 77 -2.186 2.083 -5.777
562 2HD1 ILE 77 2HD1 ILE 77 -1.610 2.577 -7.368
563 3HD1 ILE 77 3HD1 ILE 77 -1.715 0.865 -6.962
564 H GLN 78 H GLN 78 -4.999 -1.152 -9.816
565 HA GLN 78 HA GLN 78 -6.517 -1.989 -7.455
566 1HB GLN 78 2HB GLN 78 -8.079 -1.776 -9.372
567 2HB GLN 78 1HB GLN 78 -7.106 -2.928 -10.270
568 1HG GLN 78 2HG GLN 78 -7.796 -4.712 -8.997
569 2HG GLN 78 1HG GLN 78 -8.235 -3.693 -7.618
570 1HE2 GLN 78 1HE2 GLN 78 -10.322 -4.512 -7.463
571 2HE2 GLN 78 2HE2 GLN 78 -11.552 -4.168 -8.630
572 H TYR 79 H TYR 79 -5.887 -3.938 -6.616
573 HA TYR 79 HA TYR 79 -3.352 -4.979 -7.411
574 1HB TYR 79 2HB TYR 79 -5.411 -6.020 -5.455
575 2HB TYR 79 1HB TYR 79 -3.818 -6.727 -5.675
576 HD1 TYR 79 2HD TYR 79 -5.641 -3.755 -4.474
577 HD2 TYR 79 1HD TYR 79 -1.886 -5.746 -4.671
578 HE1 TYR 79 2HE TYR 79 -4.748 -2.231 -2.762
579 HE2 TYR 79 1HE TYR 79 -0.985 -4.232 -2.956
580 HH TYR 79 HH TYR 79 -1.382 -2.123 -1.966
581 H LEU 80 H LEU 80 -3.164 -7.462 -7.643
582 HA LEU 80 HA LEU 80 -5.348 -8.473 -9.322
583 1HB LEU 80 2HB LEU 80 -2.391 -8.596 -9.842
584 2HB LEU 80 1HB LEU 80 -3.532 -9.664 -10.641
585 HG LEU 80 HG LEU 80 -3.727 -6.652 -10.780
586 1HD1 LEU 80 1HD1 LEU 80 -1.609 -7.372 -11.769
587 2HD1 LEU 80 2HD1 LEU 80 -2.742 -6.867 -13.023
588 3HD1 LEU 80 3HD1 LEU 80 -2.457 -8.583 -12.732
589 1HD2 LEU 80 1HD2 LEU 80 -4.969 -8.856 -12.429
590 2HD2 LEU 80 2HD2 LEU 80 -5.180 -7.124 -12.686
591 3HD2 LEU 80 3HD2 LEU 80 -5.795 -7.879 -11.217
592 H GLY 81 H GLY 81 -4.871 -10.985 -9.719
593 1HA GLY 81 2HA GLY 81 -4.771 -13.059 -8.668
594 2HA GLY 81 1HA GLY 81 -4.053 -12.277 -7.261
595 HA PRO 82 HA PRO 82 -8.379 -13.312 -5.973
596 1HB PRO 82 2HB PRO 82 -7.060 -13.392 -3.337
597 2HB PRO 82 1HB PRO 82 -8.097 -14.592 -4.113
598 1HG PRO 82 2HG PRO 82 -5.463 -14.987 -3.823
599 2HG PRO 82 1HG PRO 82 -6.347 -15.571 -5.245
600 1HD PRO 82 2HD PRO 82 -4.586 -13.167 -4.962
601 2HD PRO 82 1HD PRO 82 -4.712 -14.319 -6.310
602 H TYR 83 H TYR 83 -6.121 -10.868 -5.423
603 HA TYR 83 HA TYR 83 -7.889 -9.345 -3.640
604 1HB TYR 83 2HB TYR 83 -5.092 -8.571 -4.450
605 2HB TYR 83 1HB TYR 83 -6.002 -8.049 -3.037
606 HD1 TYR 83 2HD TYR 83 -6.711 -10.073 -1.433
607 HD2 TYR 83 1HD TYR 83 -3.423 -10.112 -4.131
608 HE1 TYR 83 2HE TYR 83 -5.649 -11.848 -0.107
609 HE2 TYR 83 1HE TYR 83 -2.355 -11.893 -2.814
610 HH TYR 83 HH TYR 83 -2.525 -12.634 -0.256
611 H TYR 84 H TYR 84 -8.238 -9.746 -6.625
612 HA TYR 84 HA TYR 84 -7.556 -7.111 -7.619
613 1HB TYR 84 2HB TYR 84 -7.369 -7.959 -9.708
614 2HB TYR 84 1HB TYR 84 -7.027 -9.414 -8.790
615 HD1 TYR 84 2HD TYR 84 -9.175 -10.928 -8.311
616 HD2 TYR 84 1HD TYR 84 -8.852 -8.046 -11.423
617 HE1 TYR 84 2HE TYR 84 -10.927 -12.104 -9.576
618 HE2 TYR 84 1HE TYR 84 -10.598 -9.211 -12.697
619 HH TYR 84 HH TYR 84 -11.596 -11.422 -12.863
620 HA PRO 85 HA PRO 85 -11.996 -6.518 -7.733
621 1HB PRO 85 2HB PRO 85 -13.537 -7.358 -5.715
622 2HB PRO 85 1HB PRO 85 -13.263 -8.327 -7.164
623 1HG PRO 85 2HG PRO 85 -12.151 -8.656 -4.440
624 2HG PRO 85 1HG PRO 85 -12.463 -9.876 -5.683
625 1HD PRO 85 2HD PRO 85 -9.979 -8.651 -5.051
626 2HD PRO 85 1HD PRO 85 -10.323 -9.756 -6.394
627 H LEU 86 H LEU 86 -9.792 -6.417 -5.252
628 HA LEU 86 HA LEU 86 -11.070 -4.146 -3.905
629 1HB LEU 86 2HB LEU 86 -10.232 -5.857 -2.411
630 2HB LEU 86 1HB LEU 86 -8.662 -5.827 -3.189
631 HG LEU 86 HG LEU 86 -8.333 -3.506 -2.358
632 1HD1 LEU 86 1HD1 LEU 86 -10.681 -2.876 -2.153
633 2HD1 LEU 86 2HD1 LEU 86 -9.805 -2.628 -0.642
634 3HD1 LEU 86 3HD1 LEU 86 -10.874 -4.020 -0.825
635 1HD2 LEU 86 1HD2 LEU 86 -7.980 -4.138 -0.006
636 2HD2 LEU 86 2HD2 LEU 86 -7.401 -5.364 -1.132
637 3HD2 LEU 86 3HD2 LEU 86 -8.923 -5.605 -0.277
638 H LYS 87 H LYS 87 -10.620 -2.228 -4.796
639 HA LYS 87 HA LYS 87 -8.055 -1.923 -6.169
640 1HB LYS 87 2HB LYS 87 -9.014 0.010 -7.281
641 2HB LYS 87 1HB LYS 87 -10.059 -1.384 -7.487
642 1HG LYS 87 2HG LYS 87 -11.566 -0.526 -5.773
643 2HG LYS 87 1HG LYS 87 -10.500 0.862 -5.527
644 1HD LYS 87 2HD LYS 87 -10.836 1.508 -7.877
645 2HD LYS 87 1HD LYS 87 -11.939 0.149 -8.082
646 1HE LYS 87 2HE LYS 87 -13.433 1.094 -6.405
647 2HE LYS 87 1HE LYS 87 -12.322 2.444 -6.166
648 1HZ LYS 87 1HZ LYS 87 -14.132 3.060 -7.636
649 2HZ LYS 87 2HZ LYS 87 -13.753 1.795 -8.693
650 3HZ LYS 87 3HZ LYS 87 -12.664 3.085 -8.483
651 H SER 88 H SER 88 -7.172 0.361 -6.071
652 HA SER 88 HA SER 88 -7.287 1.422 -3.336
653 1HB SER 88 2HB SER 88 -5.292 0.093 -3.381
654 2HB SER 88 1HB SER 88 -4.837 0.706 -4.965
655 HG SER 88 HG SER 88 -5.052 2.301 -2.629
656 H THR 89 H THR 89 -6.515 3.664 -3.217
657 HA THR 89 HA THR 89 -6.821 5.063 -5.786
658 HB THR 89 HB THR 89 -7.932 6.128 -3.211
659 HG1 THR 89 1HG THR 89 -8.944 4.178 -4.911
660 1HG2 THR 89 1HG2 THR 89 -8.543 6.739 -6.107
661 2HG2 THR 89 2HG2 THR 89 -7.574 7.737 -5.025
662 3HG2 THR 89 3HG2 THR 89 -9.292 7.511 -4.707
663 H LEU 90 H LEU 90 -5.592 6.822 -6.078
664 HA LEU 90 HA LEU 90 -3.730 7.611 -3.934
665 1HB LEU 90 2HB LEU 90 -3.227 7.495 -6.914
666 2HB LEU 90 1HB LEU 90 -2.109 8.163 -5.741
667 HG LEU 90 HG LEU 90 -2.999 5.276 -5.800
668 1HD1 LEU 90 1HD1 LEU 90 -0.779 4.796 -6.680
669 2HD1 LEU 90 2HD1 LEU 90 -0.413 6.519 -6.732
670 3HD1 LEU 90 3HD1 LEU 90 -1.670 5.854 -7.775
671 1HD2 LEU 90 1HD2 LEU 90 -1.163 4.935 -4.228
672 2HD2 LEU 90 2HD2 LEU 90 -2.344 6.074 -3.580
673 3HD2 LEU 90 3HD2 LEU 90 -0.819 6.665 -4.241
674 H LYS 91 H LYS 91 -3.940 9.675 -3.350
675 HA LYS 91 HA LYS 91 -5.106 11.563 -5.283
676 1HB LYS 91 2HB LYS 91 -5.890 11.161 -2.399
677 2HB LYS 91 1HB LYS 91 -6.342 12.576 -3.337
678 1HG LYS 91 2HG LYS 91 -7.683 11.289 -4.799
679 2HG LYS 91 1HG LYS 91 -7.032 9.777 -4.164
680 1HD LYS 91 2HD LYS 91 -8.070 10.207 -2.012
681 2HD LYS 91 1HD LYS 91 -8.664 11.764 -2.591
682 1HE LYS 91 2HE LYS 91 -10.071 10.666 -4.217
683 2HE LYS 91 1HE LYS 91 -9.409 9.094 -3.771
684 1HZ LYS 91 1HZ LYS 91 -10.908 10.866 -1.921
685 2HZ LYS 91 2HZ LYS 91 -10.379 9.282 -1.607
686 3HZ LYS 91 3HZ LYS 91 -11.592 9.559 -2.761
687 H ARG 92 H ARG 92 -4.591 13.733 -4.949
688 HA ARG 92 HA ARG 92 -2.067 14.223 -3.647
689 1HB ARG 92 2HB ARG 92 -2.131 16.351 -4.712
690 2HB ARG 92 1HB ARG 92 -2.756 15.199 -5.883
691 1HG ARG 92 2HG ARG 92 -5.033 15.846 -5.285
692 2HG ARG 92 1HG ARG 92 -4.396 17.025 -4.142
693 1HD ARG 92 2HD ARG 92 -3.081 17.826 -6.311
694 2HD ARG 92 1HD ARG 92 -4.481 17.098 -7.104
695 HE ARG 92 HE ARG 92 -4.718 19.174 -5.015
696 1HH1 ARG 92 1HH1 ARG 92 -5.717 17.811 -8.098
697 2HH1 ARG 92 2HH1 ARG 92 -6.904 19.042 -8.384
698 1HH2 ARG 92 1HH2 ARG 92 -6.267 20.767 -5.400
699 2HH2 ARG 92 2HH2 ARG 92 -7.216 20.737 -6.859
700 H GLY 93 H GLY 93 -1.775 15.698 -1.901
701 1HA GLY 93 2HA GLY 93 -4.145 16.154 -0.265
702 2HA GLY 93 1HA GLY 93 -2.479 16.494 0.192
703 H GLU 94 H GLU 94 -3.267 18.574 0.957
704 HA GLU 94 HA GLU 94 -4.064 20.506 -1.055
705 1HB GLU 94 2HB GLU 94 -4.827 20.549 1.380
706 2HB GLU 94 1HB GLU 94 -3.198 21.072 1.783
707 1HG GLU 94 2HG GLU 94 -3.522 22.997 0.226
708 2HG GLU 94 1HG GLU 94 -5.210 22.512 0.080
709 H ASN 95 H ASN 95 -1.297 19.373 0.617
710 HA ASN 95 HA ASN 95 0.441 21.239 -0.857
711 1HB ASN 95 2HB ASN 95 0.872 19.656 1.679
712 2HB ASN 95 1HB ASN 95 2.212 20.369 0.785
713 1HD2 ASN 95 1HD2 ASN 95 -0.547 20.977 2.792
714 2HD2 ASN 95 2HD2 ASN 95 -0.198 22.647 3.109
715 H GLY 96 H GLY 96 2.775 19.701 -0.759
716 1HA GLY 96 2HA GLY 96 2.232 17.837 -2.885
717 2HA GLY 96 1HA GLY 96 3.814 18.271 -2.256
718 H THR 97 H THR 97 0.909 16.781 -0.838
719 HA THR 97 HA THR 97 2.614 14.550 0.020
720 HB THR 97 HB THR 97 0.907 14.203 1.854
721 HG1 THR 97 1HG THR 97 -0.820 15.405 1.661
722 1HG2 THR 97 1HG2 THR 97 3.079 15.214 2.309
723 2HG2 THR 97 2HG2 THR 97 1.822 15.962 3.294
724 3HG2 THR 97 3HG2 THR 97 2.443 16.800 1.872
725 H LEU 98 H LEU 98 1.617 12.439 0.075
726 HA LEU 98 HA LEU 98 -0.442 12.199 -2.007
727 1HB LEU 98 2HB LEU 98 1.649 11.117 -2.598
728 2HB LEU 98 1HB LEU 98 1.656 10.235 -1.082
729 HG LEU 98 HG LEU 98 -0.405 9.041 -1.822
730 1HD1 LEU 98 1HD1 LEU 98 -1.038 9.123 -4.170
731 2HD1 LEU 98 2HD1 LEU 98 0.158 10.385 -4.461
732 3HD1 LEU 98 3HD1 LEU 98 -1.224 10.704 -3.410
733 1HD2 LEU 98 1HD2 LEU 98 1.804 8.033 -2.083
734 2HD2 LEU 98 2HD2 LEU 98 1.972 8.799 -3.664
735 3HD2 LEU 98 3HD2 LEU 98 0.732 7.572 -3.404
736 H ILE 99 H ILE 99 -2.370 11.502 -1.467
737 HA ILE 99 HA ILE 99 -2.756 10.151 1.106
738 HB ILE 99 HB ILE 99 -4.806 11.267 -0.821
739 1HG1 ILE 99 2HG1 ILE 99 -3.844 12.313 1.849
740 2HG1 ILE 99 1HG1 ILE 99 -3.453 13.008 0.282
741 1HG2 ILE 99 1HG2 ILE 99 -5.135 10.103 1.942
742 2HG2 ILE 99 2HG2 ILE 99 -5.710 9.404 0.428
743 3HG2 ILE 99 3HG2 ILE 99 -6.400 10.914 1.023
744 1HD1 ILE 99 1HD1 ILE 99 -5.797 13.559 -0.068
745 2HD1 ILE 99 2HD1 ILE 99 -5.186 14.272 1.424
746 3HD1 ILE 99 3HD1 ILE 99 -6.206 12.835 1.488
747 H TRP 100 H TRP 100 -2.558 8.031 0.989
748 HA TRP 100 HA TRP 100 -3.347 6.636 -1.473
749 1HB TRP 100 2HB TRP 100 -1.039 6.237 -0.749
750 2HB TRP 100 1HB TRP 100 -1.602 5.723 0.835
751 HD1 TRP 100 HD TRP 100 -3.296 4.452 -2.382
752 HE1 TRP 100 1HE TRP 100 -2.879 1.937 -2.581
753 HE3 TRP 100 3HE TRP 100 -0.016 3.858 1.497
754 HZ2 TRP 100 2HZ TRP 100 -1.373 -0.048 -1.281
755 HZ3 TRP 100 3HZ TRP 100 0.862 1.605 1.948
756 HH2 TRP 100 HH TRP 100 0.197 -0.307 0.587
757 H GLU 101 H GLU 101 -5.318 5.817 -1.445
758 HA GLU 101 HA GLU 101 -6.435 4.923 1.112
759 1HB GLU 101 2HB GLU 101 -7.620 5.677 -1.508
760 2HB GLU 101 1HB GLU 101 -8.499 4.556 -0.496
761 1HG GLU 101 2HG GLU 101 -8.449 6.185 1.331
762 2HG GLU 101 1HG GLU 101 -7.608 7.314 0.276
763 H GLN 102 H GLN 102 -6.679 2.929 1.572
764 HA GLN 102 HA GLN 102 -6.769 0.847 -0.429
765 1HB GLN 102 2HB GLN 102 -4.302 1.350 0.021
766 2HB GLN 102 1HB GLN 102 -4.568 0.691 1.627
767 1HG GLN 102 2HG GLN 102 -5.546 -1.084 -0.440
768 2HG GLN 102 1HG GLN 102 -3.842 -0.711 -0.645
769 1HE2 GLN 102 1HE2 GLN 102 -3.133 -2.730 -0.132
770 2HE2 GLN 102 2HE2 GLN 102 -3.212 -3.376 1.473
771 H ASN 103 H ASN 103 -8.112 -0.708 0.240
772 HA ASN 103 HA ASN 103 -9.202 -2.215 1.560
773 1HB ASN 103 2HB ASN 103 -6.738 -2.113 2.661
774 2HB ASN 103 1HB ASN 103 -7.694 -1.556 4.027
775 1HD2 ASN 103 1HD2 ASN 103 -6.916 -4.177 1.952
776 2HD2 ASN 103 2HD2 ASN 103 -7.746 -5.414 2.834
777 H GLY 104 H GLY 104 -9.579 0.916 1.751
778 1HA GLY 104 2HA GLY 104 -11.603 1.902 2.539
779 2HA GLY 104 1HA GLY 104 -11.627 0.731 3.851
780 H GLN 105 H GLN 105 -8.507 1.737 3.576
781 HA GLN 105 HA GLN 105 -8.836 3.635 5.777
782 1HB GLN 105 2HB GLN 105 -6.262 2.512 4.660
783 2HB GLN 105 1HB GLN 105 -6.481 3.357 6.184
784 1HG GLN 105 2HG GLN 105 -7.901 1.479 6.957
785 2HG GLN 105 1HG GLN 105 -7.500 0.622 5.470
786 1HE2 GLN 105 1HE2 GLN 105 -6.436 -1.045 6.495
787 2HE2 GLN 105 2HE2 GLN 105 -4.906 -0.841 7.274
788 H ARG 106 H ARG 106 -8.426 5.763 5.579
789 HA ARG 106 HA ARG 106 -7.333 6.761 3.037
790 1HB ARG 106 2HB ARG 106 -9.459 7.720 4.082
791 2HB ARG 106 1HB ARG 106 -8.439 8.351 5.363
792 1HG ARG 106 2HG ARG 106 -7.182 9.633 3.635
793 2HG ARG 106 1HG ARG 106 -8.381 9.102 2.452
794 1HD ARG 106 2HD ARG 106 -10.144 10.078 3.956
795 2HD ARG 106 1HD ARG 106 -8.841 10.780 4.910
796 HE ARG 106 HE ARG 106 -9.009 11.414 2.047
797 1HH1 ARG 106 1HH1 ARG 106 -9.194 12.437 5.400
798 2HH1 ARG 106 2HH1 ARG 106 -9.352 14.126 5.003
799 1HH2 ARG 106 1HH2 ARG 106 -9.229 13.627 1.526
800 2HH2 ARG 106 2HH2 ARG 106 -9.363 14.807 2.800
801 H LYS 107 H LYS 107 -5.151 7.043 3.012
802 HA LYS 107 HA LYS 107 -3.858 7.500 5.617
803 1HB LYS 107 2HB LYS 107 -2.826 5.875 3.294
804 2HB LYS 107 1HB LYS 107 -1.926 6.221 4.763
805 1HG LYS 107 2HG LYS 107 -4.499 4.686 4.660
806 2HG LYS 107 1HG LYS 107 -2.904 3.986 4.747
807 1HD LYS 107 2HD LYS 107 -3.750 5.967 6.772
808 2HD LYS 107 1HD LYS 107 -4.366 4.316 6.869
809 1HE LYS 107 2HE LYS 107 -1.468 5.086 6.717
810 2HE LYS 107 1HE LYS 107 -2.349 4.660 8.166
811 1HZ LYS 107 1HZ LYS 107 -1.941 2.856 5.850
812 2HZ LYS 107 2HZ LYS 107 -2.732 2.455 7.289
813 3HZ LYS 107 3HZ LYS 107 -1.066 2.791 7.302
814 H THR 108 H THR 108 -2.402 9.014 5.791
815 HA THR 108 HA THR 108 -1.447 10.369 3.357
816 HB THR 108 HB THR 108 -2.892 11.915 4.498
817 HG1 THR 108 1HG THR 108 -1.310 13.187 3.866
818 1HG2 THR 108 1HG2 THR 108 -2.543 12.609 6.823
819 2HG2 THR 108 2HG2 THR 108 -1.280 11.390 6.997
820 3HG2 THR 108 3HG2 THR 108 -2.948 10.896 6.705
821 H MET 109 H MET 109 0.728 10.345 3.099
822 HA MET 109 HA MET 109 2.290 9.353 5.392
823 1HB MET 109 2HB MET 109 2.496 8.430 2.522
824 2HB MET 109 1HB MET 109 3.543 7.910 3.834
825 1HG MET 109 2HG MET 109 1.620 6.943 4.981
826 2HG MET 109 1HG MET 109 0.579 7.451 3.654
827 1HE MET 109 1HE MET 109 -0.334 5.015 3.387
828 2HE MET 109 2HE MET 109 0.686 4.479 4.721
829 3HE MET 109 3HE MET 109 0.685 3.589 3.199
830 H THR 110 H THR 110 4.568 9.701 5.275
831 HA THR 110 HA THR 110 5.278 12.188 3.931
832 HB THR 110 HB THR 110 7.459 11.397 5.438
833 HG1 THR 110 1HG THR 110 6.769 10.277 7.127
834 1HG2 THR 110 1HG2 THR 110 5.116 13.094 6.307
835 2HG2 THR 110 2HG2 THR 110 6.477 13.644 5.331
836 3HG2 THR 110 3HG2 THR 110 6.740 13.136 7.000
837 H ARG 111 H ARG 111 6.945 12.326 2.464
838 HA ARG 111 HA ARG 111 7.507 9.891 1.024
839 1HB ARG 111 2HB ARG 111 6.968 11.853 -0.266
840 2HB ARG 111 1HB ARG 111 8.233 12.778 0.528
841 1HG ARG 111 2HG ARG 111 9.916 11.290 -0.512
842 2HG ARG 111 1HG ARG 111 8.611 10.486 -1.387
843 1HD ARG 111 2HD ARG 111 8.076 12.460 -2.580
844 2HD ARG 111 1HD ARG 111 9.093 13.449 -1.537
845 HE ARG 111 HE ARG 111 10.039 11.574 -3.596
846 1HH1 ARG 111 1HH1 ARG 111 10.648 14.165 -1.321
847 2HH1 ARG 111 2HH1 ARG 111 12.188 14.588 -2.009
848 1HH2 ARG 111 1HH2 ARG 111 12.051 12.131 -4.529
849 2HH2 ARG 111 2HH2 ARG 111 12.980 13.439 -3.846
850 H ILE 112 H ILE 112 9.220 8.662 1.326
851 HA ILE 112 HA ILE 112 11.481 9.513 2.888
852 HB ILE 112 HB ILE 112 11.061 7.024 1.238
853 1HG1 ILE 112 2HG1 ILE 112 9.498 7.411 3.174
854 2HG1 ILE 112 1HG1 ILE 112 10.442 5.934 3.277
855 1HG2 ILE 112 1HG2 ILE 112 13.425 7.440 1.552
856 2HG2 ILE 112 2HG2 ILE 112 12.914 6.066 2.533
857 3HG2 ILE 112 3HG2 ILE 112 13.177 7.639 3.286
858 1HD1 ILE 112 1HD1 ILE 112 10.386 6.958 5.428
859 2HD1 ILE 112 2HD1 ILE 112 10.910 8.504 4.766
860 3HD1 ILE 112 3HD1 ILE 112 12.017 7.131 4.788
861 H GLU 113 H GLU 113 13.592 9.746 2.096
862 HA GLU 113 HA GLU 113 13.601 10.833 -0.625
863 1HB GLU 113 2HB GLU 113 14.142 12.347 1.282
864 2HB GLU 113 1HB GLU 113 15.555 11.359 1.620
865 1HG GLU 113 2HG GLU 113 16.563 11.960 -0.448
866 2HG GLU 113 1HG GLU 113 15.082 12.743 -1.003
867 H SER 114 H SER 114 14.714 9.884 -2.160
868 HA SER 114 HA SER 114 16.516 7.695 -1.418
869 1HB SER 114 2HB SER 114 15.131 8.175 -4.065
870 2HB SER 114 1HB SER 114 16.002 6.721 -3.573
871 HG SER 114 HG SER 114 14.405 6.610 -1.809
872 H LYS 115 H LYS 115 18.524 8.531 -1.296
873 HA LYS 115 HA LYS 115 19.359 10.534 -3.246
874 1HB LYS 115 2HB LYS 115 19.801 10.580 -0.670
875 2HB LYS 115 1HB LYS 115 21.106 9.467 -1.048
876 1HG LYS 115 2HG LYS 115 20.806 12.192 -2.297
877 2HG LYS 115 1HG LYS 115 21.791 11.854 -0.876
878 1HD LYS 115 2HD LYS 115 23.179 10.340 -2.166
879 2HD LYS 115 1HD LYS 115 22.154 10.572 -3.584
880 1HE LYS 115 2HE LYS 115 22.741 12.964 -3.582
881 2HE LYS 115 1HE LYS 115 23.804 12.684 -2.202
882 1HZ LYS 115 1HZ LYS 115 25.098 11.155 -3.569
883 2HZ LYS 115 2HZ LYS 115 25.056 12.708 -4.249
884 3HZ LYS 115 3HZ LYS 115 24.094 11.472 -4.900
885 H THR 116 H THR 116 20.200 9.876 -5.082
886 HA THR 116 HA THR 116 21.532 7.252 -5.198
887 HB THR 116 HB THR 116 20.638 8.885 -7.576
888 HG1 THR 116 1HG THR 116 18.987 8.112 -5.797
889 1HG2 THR 116 1HG2 THR 116 22.154 7.019 -8.036
890 2HG2 THR 116 2HG2 THR 116 20.543 6.680 -8.666
891 3HG2 THR 116 3HG2 THR 116 21.081 5.919 -7.169
892 H GLY 117 H GLY 117 23.524 7.065 -6.421
893 1HA GLY 117 2HA GLY 117 24.870 9.356 -7.455
894 2HA GLY 117 1HA GLY 117 25.491 8.916 -5.870
895 H ARG 118 H ARG 118 26.297 8.688 -8.924
896 HA ARG 118 HA ARG 118 27.855 6.271 -8.475
897 1HB ARG 118 2HB ARG 118 25.514 5.988 -9.875
898 2HB ARG 118 1HB ARG 118 26.652 6.336 -11.167
899 1HG ARG 118 2HG ARG 118 26.817 4.091 -9.175
900 2HG ARG 118 1HG ARG 118 26.431 3.961 -10.889
901 1HD ARG 118 2HD ARG 118 28.683 4.794 -11.435
902 2HD ARG 118 1HD ARG 118 29.060 4.859 -9.713
903 HE ARG 118 HE ARG 118 28.841 2.479 -11.380
904 1HH1 ARG 118 1HH1 ARG 118 29.196 3.840 -8.174
905 2HH1 ARG 118 2HH1 ARG 118 29.645 2.334 -7.437
906 1HH2 ARG 118 1HH2 ARG 118 29.486 0.495 -10.436
907 2HH2 ARG 118 2HH2 ARG 118 29.788 0.418 -8.721
908 H GLU 119 H GLU 119 29.574 7.794 -8.412
909 HA GLU 119 HA GLU 119 30.136 9.089 -11.001
910 1HB GLU 119 2HB GLU 119 29.517 10.533 -8.927
911 2HB GLU 119 1HB GLU 119 31.135 10.150 -8.370
912 1HG GLU 119 2HG GLU 119 30.620 11.396 -11.048
913 2HG GLU 119 1HG GLU 119 30.805 12.351 -9.580
914 H GLU 120 H GLU 120 31.324 7.327 -11.708
915 HA GLU 120 HA GLU 120 33.225 6.213 -12.201
916 1HB GLU 120 2HB GLU 120 34.287 8.422 -12.059
917 2HB GLU 120 1HB GLU 120 34.539 8.196 -10.335
918 1HG GLU 120 2HG GLU 120 36.584 7.804 -11.577
919 2HG GLU 120 1HG GLU 120 36.036 6.329 -10.784
920 H LYS 121 H LYS 121 34.503 4.506 -11.508
921 HA LYS 121 HA LYS 121 35.093 4.006 -8.773
922 1HB LYS 121 2HB LYS 121 32.735 3.289 -8.713
923 2HB LYS 121 1HB LYS 121 33.045 2.177 -10.043
924 1HG LYS 121 2HG LYS 121 34.708 1.015 -8.616
925 2HG LYS 121 1HG LYS 121 34.240 2.068 -7.283
926 1HD LYS 121 2HD LYS 121 31.977 1.190 -7.346
927 2HD LYS 121 1HD LYS 121 32.386 0.191 -8.747
928 1HE LYS 121 2HE LYS 121 34.046 -1.005 -7.407
929 2HE LYS 121 1HE LYS 121 33.646 -0.006 -6.012
930 1HZ LYS 121 1HZ LYS 121 31.774 -1.846 -7.400
931 2HZ LYS 121 2HZ LYS 121 31.419 -0.916 -6.025
932 3HZ LYS 121 3HZ LYS 121 32.560 -2.168 -5.932
933 H ASP 122 H ASP 122 36.761 2.621 -8.601
934 HA ASP 122 HA ASP 122 38.150 1.788 -10.933
935 1HB ASP 122 2HB ASP 122 39.677 0.668 -9.315
936 2HB ASP 122 1HB ASP 122 39.370 2.357 -8.921
937 H GLU 123 H GLU 123 38.939 -0.537 -11.153
938 HA GLU 123 HA GLU 123 36.590 -2.186 -11.440
939 1HB GLU 123 2HB GLU 123 39.481 -2.702 -12.142
940 2HB GLU 123 1HB GLU 123 38.148 -3.774 -12.548
941 1HG GLU 123 2HG GLU 123 37.203 -2.187 -14.025
942 2HG GLU 123 1HG GLU 123 38.281 -0.915 -13.450
943 H LYS 124 H LYS 124 39.798 -3.082 -10.220
944 HA LYS 124 HA LYS 124 38.440 -4.846 -8.302
945 1HB LYS 124 2HB LYS 124 41.059 -5.207 -9.747
946 2HB LYS 124 1HB LYS 124 40.582 -6.191 -8.373
947 1HG LYS 124 2HG LYS 124 38.539 -6.846 -9.668
948 2HG LYS 124 1HG LYS 124 39.252 -6.030 -11.063
949 1HD LYS 124 2HD LYS 124 41.197 -7.499 -10.947
950 2HD LYS 124 1HD LYS 124 40.532 -8.288 -9.517
951 1HE LYS 124 2HE LYS 124 38.596 -9.019 -10.865
952 2HE LYS 124 1HE LYS 124 39.344 -8.293 -12.288
953 1HZ LYS 124 1HZ LYS 124 39.832 -10.617 -12.270
954 2HZ LYS 124 2HZ LYS 124 40.402 -10.556 -10.679
955 3HZ LYS 124 3HZ LYS 124 41.266 -9.786 -11.921
956 H SER 125 H SER 125 38.491 -3.974 -6.369
957 HA SER 125 HA SER 125 41.136 -3.545 -5.207
958 1HB SER 125 2HB SER 125 38.757 -1.721 -4.750
959 2HB SER 125 1HB SER 125 40.273 -1.654 -3.851
960 HG SER 125 HG SER 125 39.692 -0.860 -6.462
961 H LYS 126 H LYS 126 41.224 -5.318 -3.970
962 HA LYS 126 HA LYS 126 38.825 -6.369 -2.733
963 1HB LYS 126 2HB LYS 126 41.208 -7.483 -3.643
964 2HB LYS 126 1HB LYS 126 41.318 -7.620 -1.894
965 1HG LYS 126 2HG LYS 126 39.012 -8.613 -3.560
966 2HG LYS 126 1HG LYS 126 40.336 -9.609 -2.960
967 1HD LYS 126 2HD LYS 126 39.694 -9.209 -0.687
968 2HD LYS 126 1HD LYS 126 38.503 -8.007 -1.183
969 1HE LYS 126 2HE LYS 126 37.381 -10.066 -0.634
970 2HE LYS 126 1HE LYS 126 37.259 -9.782 -2.369
971 1HZ LYS 126 1HZ LYS 126 37.785 -12.042 -2.088
972 2HZ LYS 126 2HZ LYS 126 39.006 -11.719 -0.960
973 3HZ LYS 126 3HZ LYS 126 39.230 -11.309 -2.591
974 H SER 127 H SER 127 41.466 -4.357 -1.849
975 HA SER 127 HA SER 127 41.248 -4.773 0.971
976 1HB SER 127 2HB SER 127 43.338 -3.972 -0.122
977 2HB SER 127 1HB SER 127 42.522 -2.461 -0.518
978 HG SER 127 HG SER 127 42.918 -3.475 2.119
979 H LEU 128 H LEU 128 38.872 -4.577 0.936
980 HA LEU 128 HA LEU 128 37.962 -1.783 1.104
981 1HB LEU 128 2HB LEU 128 36.396 -4.367 1.004
982 2HB LEU 128 1HB LEU 128 35.681 -2.775 1.159
983 HG LEU 128 HG LEU 128 37.257 -3.784 -1.212
984 1HD1 LEU 128 1HD1 LEU 128 35.102 -3.644 -2.376
985 2HD1 LEU 128 2HD1 LEU 128 34.319 -3.198 -0.860
986 3HD1 LEU 128 3HD1 LEU 128 35.051 -4.793 -1.038
987 1HD2 LEU 128 1HD2 LEU 128 35.861 -1.144 -0.771
988 2HD2 LEU 128 2HD2 LEU 128 36.585 -1.686 -2.285
989 3HD2 LEU 128 3HD2 LEU 128 37.602 -1.395 -0.874
990 H GLU 129 H GLU 129 39.672 -2.772 3.036
991 HA GLU 129 HA GLU 129 38.222 -3.683 5.327
992 1HB GLU 129 2HB GLU 129 40.483 -3.224 6.453
993 2HB GLU 129 1HB GLU 129 40.427 -4.463 5.208
994 1HG GLU 129 2HG GLU 129 41.165 -2.577 3.611
995 2HG GLU 129 1HG GLU 129 41.613 -1.722 5.087
996 H HIS 130 H HIS 130 36.776 -2.320 6.116
997 HA HIS 130 HA HIS 130 37.562 0.480 6.580
998 1HB HIS 130 2HB HIS 130 35.693 0.020 4.920
999 2HB HIS 130 1HB HIS 130 34.749 -0.584 6.275
1000 HD1 HIS 130 1HD HIS 130 33.345 1.092 7.435
1001 HD2 HIS 130 2HD HIS 130 36.445 2.851 5.297
1002 HE1 HIS 130 1HE HIS 130 32.950 3.568 7.586
1003 HE2 HIS 130 2HE HIS 130 34.691 4.583 6.066
1004 H HIS 131 H HIS 131 37.326 1.296 8.618
1005 HA HIS 131 HA HIS 131 36.800 -0.649 10.708
1006 1HB HIS 131 2HB HIS 131 38.076 2.061 10.660
1007 2HB HIS 131 1HB HIS 131 37.525 1.366 12.180
1008 HD1 HIS 131 1HD HIS 131 40.452 1.562 10.151
1009 HD2 HIS 131 2HD HIS 131 38.708 -1.384 12.510
1010 HE1 HIS 131 1HE HIS 131 42.290 -0.083 10.658
1011 HE2 HIS 131 2HE HIS 131 41.139 -1.973 11.868
1012 H HIS 132 H HIS 132 35.851 0.517 12.769
1013 HA HIS 132 HA HIS 132 33.484 2.083 12.135
1014 1HB HIS 132 2HB HIS 132 32.090 0.481 13.538
1015 2HB HIS 132 1HB HIS 132 32.541 -0.098 11.940
1016 HD1 HIS 132 1HD HIS 132 33.770 -2.265 11.811
1017 HD2 HIS 132 2HD HIS 132 33.622 -0.743 15.679
1018 HE1 HIS 132 1HE HIS 132 34.711 -4.069 13.287
1019 HE2 HIS 132 2HE HIS 132 34.848 -3.023 15.575
1020 H HIS 133 H HIS 133 32.537 3.053 14.071
1021 HA HIS 133 HA HIS 133 34.173 2.963 16.470
1022 1HB HIS 133 2HB HIS 133 35.272 4.569 14.812
1023 2HB HIS 133 1HB HIS 133 33.860 5.597 15.029
1024 HD1 HIS 133 1HD HIS 133 34.022 7.270 16.864
1025 HD2 HIS 133 2HD HIS 133 36.660 4.088 17.386
1026 HE1 HIS 133 1HE HIS 133 35.420 7.860 18.874
1027 HE2 HIS 133 2HE HIS 133 37.131 6.013 19.049
1028 H HIS 134 H HIS 134 32.849 3.061 18.145
1029 HA HIS 134 HA HIS 134 30.687 4.954 18.292
1030 1HB HIS 134 2HB HIS 134 29.681 3.074 16.975
1031 2HB HIS 134 1HB HIS 134 29.998 2.004 18.335
1032 HD1 HIS 134 1HD HIS 134 28.463 2.237 20.418
1033 HD2 HIS 134 2HD HIS 134 27.531 4.824 17.291
1034 HE1 HIS 134 1HE HIS 134 26.182 3.164 20.951
1035 HE2 HIS 134 2HE HIS 134 25.646 4.748 19.063
1036 H HIS 135 H HIS 135 30.896 5.698 20.293
1037 HA HIS 135 HA HIS 135 30.917 3.810 22.509
1038 1HB HIS 135 2HB HIS 135 33.310 4.262 22.105
1039 2HB HIS 135 1HB HIS 135 33.005 5.988 22.253
1040 HD1 HIS 135 1HD HIS 135 32.210 6.806 24.695
1041 HD2 HIS 135 2HD HIS 135 33.785 2.965 24.482
1042 HE1 HIS 135 1HE HIS 135 32.810 6.188 27.060
1043 HE2 HIS 135 2HE HIS 135 33.796 3.876 26.907
Start of MODEL 19
1 1H MET 1 1HT MET 1 -3.568 -19.399 -9.028
2 2H MET 1 2HT MET 1 -4.308 -17.967 -9.554
3 3H MET 1 3HT MET 1 -4.511 -18.486 -7.952
4 HA MET 1 HA MET 1 -2.963 -16.682 -8.018
5 1HB MET 1 2HB MET 1 -1.651 -19.355 -7.497
6 2HB MET 1 1HB MET 1 -0.985 -17.807 -6.994
7 1HG MET 1 2HG MET 1 -3.622 -18.957 -6.104
8 2HG MET 1 1HG MET 1 -2.127 -18.956 -5.170
9 1HE MET 1 1HE MET 1 -3.549 -17.876 -3.175
10 2HE MET 1 2HE MET 1 -4.995 -17.790 -4.183
11 3HE MET 1 3HE MET 1 -4.434 -16.356 -3.321
12 H ILE 2 H ILE 2 -1.343 -19.447 -9.597
13 HA ILE 2 HA ILE 2 0.315 -17.588 -11.101
14 HB ILE 2 HB ILE 2 0.318 -20.609 -11.190
15 1HG1 ILE 2 2HG1 ILE 2 0.828 -19.810 -8.931
16 2HG1 ILE 2 1HG1 ILE 2 2.268 -20.474 -9.692
17 1HG2 ILE 2 1HG2 ILE 2 2.557 -20.330 -12.158
18 2HG2 ILE 2 2HG2 ILE 2 2.348 -18.580 -12.117
19 3HG2 ILE 2 3HG2 ILE 2 1.315 -19.567 -13.150
20 1HD1 ILE 2 1HD1 ILE 2 3.037 -18.210 -10.194
21 2HD1 ILE 2 2HD1 ILE 2 2.797 -18.467 -8.466
22 3HD1 ILE 2 3HD1 ILE 2 1.605 -17.556 -9.397
23 H MET 3 H MET 3 -1.267 -16.651 -12.414
24 HA MET 3 HA MET 3 -2.800 -18.340 -14.210
25 1HB MET 3 2HB MET 3 -3.813 -16.208 -14.965
26 2HB MET 3 1HB MET 3 -3.923 -16.426 -13.221
27 1HG MET 3 2HG MET 3 -1.906 -14.972 -13.002
28 2HG MET 3 1HG MET 3 -2.025 -14.643 -14.728
29 1HE MET 3 1HE MET 3 -5.226 -14.619 -15.068
30 2HE MET 3 2HE MET 3 -4.158 -13.451 -15.849
31 3HE MET 3 3HE MET 3 -5.549 -12.891 -14.920
32 H VAL 4 H VAL 4 0.224 -16.899 -14.174
33 HA VAL 4 HA VAL 4 1.830 -16.435 -15.703
34 HB VAL 4 HB VAL 4 0.343 -18.326 -17.538
35 1HG1 VAL 4 1HG1 VAL 4 2.575 -18.786 -18.453
36 2HG1 VAL 4 2HG1 VAL 4 3.271 -17.595 -17.351
37 3HG1 VAL 4 3HG1 VAL 4 2.151 -17.083 -18.613
38 1HG2 VAL 4 1HG2 VAL 4 0.648 -19.367 -15.349
39 2HG2 VAL 4 2HG2 VAL 4 2.370 -18.985 -15.398
40 3HG2 VAL 4 3HG2 VAL 4 1.683 -20.121 -16.559
41 H SER 5 H SER 5 0.319 -14.411 -15.579
42 HA SER 5 HA SER 5 0.229 -13.375 -18.281
43 1HB SER 5 2HB SER 5 -2.232 -13.269 -16.510
44 2HB SER 5 1HB SER 5 -2.053 -12.485 -18.079
45 HG SER 5 HG SER 5 -1.436 -14.995 -18.472
46 H GLY 6 H GLY 6 1.732 -11.856 -17.867
47 1HA GLY 6 2HA GLY 6 1.039 -9.677 -16.105
48 2HA GLY 6 1HA GLY 6 2.431 -10.615 -15.577
49 H CYS 7 H CYS 7 3.328 -8.339 -15.887
50 HA CYS 7 HA CYS 7 4.766 -8.293 -18.380
51 1HB CYS 7 2HB CYS 7 4.009 -5.914 -18.863
52 2HB CYS 7 1HB CYS 7 2.848 -7.189 -19.211
53 HG CYS 7 HG CYS 7 2.732 -5.431 -16.267
54 H GLN 8 H GLN 8 6.183 -6.289 -18.467
55 HA GLN 8 HA GLN 8 6.488 -4.764 -16.040
56 1HB GLN 8 2HB GLN 8 8.565 -6.716 -16.937
57 2HB GLN 8 1HB GLN 8 9.110 -5.152 -16.345
58 1HG GLN 8 2HG GLN 8 7.731 -5.577 -14.288
59 2HG GLN 8 1HG GLN 8 7.514 -7.224 -14.875
60 1HE2 GLN 8 1HE2 GLN 8 8.827 -6.178 -12.475
61 2HE2 GLN 8 2HE2 GLN 8 10.448 -6.797 -12.517
62 H GLN 9 H GLN 9 5.669 -3.192 -17.435
63 HA GLN 9 HA GLN 9 7.378 -2.470 -19.720
64 1HB GLN 9 2HB GLN 9 5.128 -2.972 -20.392
65 2HB GLN 9 1HB GLN 9 4.461 -1.937 -19.139
66 1HG GLN 9 2HG GLN 9 5.313 0.027 -20.262
67 2HG GLN 9 1HG GLN 9 6.091 -0.981 -21.481
68 1HE2 GLN 9 1HE2 GLN 9 4.931 0.048 -23.111
69 2HE2 GLN 9 2HE2 GLN 9 3.257 -0.312 -23.406
70 H GLN 10 H GLN 10 8.841 -1.038 -19.032
71 HA GLN 10 HA GLN 10 8.361 1.014 -17.149
72 1HB GLN 10 2HB GLN 10 10.450 0.801 -19.330
73 2HB GLN 10 1HB GLN 10 10.431 2.062 -18.107
74 1HG GLN 10 2HG GLN 10 11.893 0.633 -17.141
75 2HG GLN 10 1HG GLN 10 10.396 -0.007 -16.472
76 1HE2 GLN 10 1HE2 GLN 10 12.918 -1.341 -16.845
77 2HE2 GLN 10 2HE2 GLN 10 12.614 -2.702 -17.873
78 H LYS 11 H LYS 11 6.881 2.534 -17.423
79 HA LYS 11 HA LYS 11 5.891 3.280 -19.988
80 1HB LYS 11 2HB LYS 11 5.473 4.709 -17.355
81 2HB LYS 11 1HB LYS 11 4.504 4.894 -18.808
82 1HG LYS 11 2HG LYS 11 4.003 2.395 -18.565
83 2HG LYS 11 1HG LYS 11 4.636 2.571 -16.929
84 1HD LYS 11 2HD LYS 11 2.332 4.106 -18.125
85 2HD LYS 11 1HD LYS 11 2.210 2.794 -16.956
86 1HE LYS 11 2HE LYS 11 3.650 5.395 -16.450
87 2HE LYS 11 1HE LYS 11 1.980 5.085 -15.981
88 1HZ LYS 11 1HZ LYS 11 3.226 4.648 -14.083
89 2HZ LYS 11 2HZ LYS 11 4.450 3.838 -14.928
90 3HZ LYS 11 3HZ LYS 11 2.937 3.102 -14.722
91 H GLU 12 H GLU 12 8.414 4.420 -17.936
92 HA GLU 12 HA GLU 12 9.882 6.146 -18.034
93 1HB GLU 12 2HB GLU 12 9.076 6.154 -20.950
94 2HB GLU 12 1HB GLU 12 10.435 7.056 -20.286
95 1HG GLU 12 2HG GLU 12 11.435 4.939 -19.530
96 2HG GLU 12 1HG GLU 12 10.104 4.066 -20.281
97 H GLU 13 H GLU 13 7.356 6.600 -17.166
98 HA GLU 13 HA GLU 13 6.411 9.156 -18.171
99 1HB GLU 13 2HB GLU 13 4.756 7.443 -17.733
100 2HB GLU 13 1HB GLU 13 5.405 7.157 -16.130
101 1HG GLU 13 2HG GLU 13 4.681 9.482 -15.534
102 2HG GLU 13 1HG GLU 13 3.846 9.539 -17.090
103 H THR 14 H THR 14 6.148 10.931 -16.671
104 HA THR 14 HA THR 14 8.265 11.203 -14.742
105 HB THR 14 HB THR 14 5.926 13.083 -15.166
106 HG1 THR 14 1HG THR 14 8.331 12.709 -16.613
107 1HG2 THR 14 1HG2 THR 14 7.234 13.484 -13.135
108 2HG2 THR 14 2HG2 THR 14 7.487 14.773 -14.309
109 3HG2 THR 14 3HG2 THR 14 8.717 13.528 -14.089
110 HA PRO 15 HA PRO 15 5.364 9.298 -11.924
111 1HB PRO 15 2HB PRO 15 7.147 7.766 -10.658
112 2HB PRO 15 1HB PRO 15 6.686 7.456 -12.335
113 1HG PRO 15 2HG PRO 15 9.209 8.529 -11.250
114 2HG PRO 15 1HG PRO 15 8.901 7.732 -12.800
115 1HD PRO 15 2HD PRO 15 9.073 10.563 -12.232
116 2HD PRO 15 1HD PRO 15 8.879 9.759 -13.804
117 H PHE 16 H PHE 16 4.547 10.070 -10.084
118 HA PHE 16 HA PHE 16 6.376 11.264 -8.122
119 1HB PHE 16 2HB PHE 16 4.390 12.314 -7.128
120 2HB PHE 16 1HB PHE 16 4.546 12.733 -8.826
121 HD1 PHE 16 2HD PHE 16 2.580 10.911 -6.342
122 HD2 PHE 16 1HD PHE 16 2.941 11.943 -10.455
123 HE1 PHE 16 2HE PHE 16 0.257 10.195 -6.720
124 HE2 PHE 16 1HE PHE 16 0.617 11.237 -10.840
125 HZ PHE 16 HZ PHE 16 -0.735 10.356 -8.974
126 H TYR 17 H TYR 17 4.636 8.467 -8.790
127 HA TYR 17 HA TYR 17 4.326 7.768 -5.969
128 1HB TYR 17 2HB TYR 17 2.836 5.949 -6.871
129 2HB TYR 17 1HB TYR 17 2.256 7.587 -7.115
130 HD1 TYR 17 2HD TYR 17 2.608 8.635 -9.428
131 HD2 TYR 17 1HD TYR 17 3.074 4.473 -8.674
132 HE1 TYR 17 2HE TYR 17 2.350 8.178 -11.829
133 HE2 TYR 17 1HE TYR 17 2.824 4.007 -11.075
134 HH TYR 17 HH TYR 17 2.712 6.587 -13.456
135 H TYR 18 H TYR 18 6.611 7.344 -8.265
136 HA TYR 18 HA TYR 18 7.026 4.494 -8.068
137 1HB TYR 18 2HB TYR 18 8.387 6.760 -9.445
138 2HB TYR 18 1HB TYR 18 9.289 5.281 -9.171
139 HD1 TYR 18 1HD TYR 18 5.679 5.188 -9.838
140 HD2 TYR 18 2HD TYR 18 9.564 4.869 -11.535
141 HE1 TYR 18 1HE TYR 18 4.703 4.254 -11.891
142 HE2 TYR 18 2HE TYR 18 8.596 3.937 -13.592
143 HH TYR 18 HH TYR 18 6.600 2.800 -14.346
144 H GLY 19 H GLY 19 7.160 6.037 -5.547
145 1HA GLY 19 2HA GLY 19 9.996 5.590 -4.871
146 2HA GLY 19 1HA GLY 19 9.078 6.943 -4.231
147 H THR 20 H THR 20 9.891 6.018 -2.194
148 HA THR 20 HA THR 20 8.208 3.806 -1.235
149 HB THR 20 HB THR 20 10.715 4.900 0.054
150 HG1 THR 20 1HG THR 20 10.431 3.341 -2.118
151 1HG2 THR 20 1HG2 THR 20 9.179 3.710 1.564
152 2HG2 THR 20 2HG2 THR 20 10.681 2.815 1.321
153 3HG2 THR 20 3HG2 THR 20 9.211 2.317 0.484
154 H TRP 21 H TRP 21 6.655 4.281 0.192
155 HA TRP 21 HA TRP 21 6.642 7.016 1.265
156 1HB TRP 21 2HB TRP 21 4.321 5.225 0.544
157 2HB TRP 21 1HB TRP 21 4.179 6.835 1.248
158 HD1 TRP 21 HD TRP 21 4.728 5.065 -2.038
159 HE1 TRP 21 1HE TRP 21 4.884 6.800 -3.930
160 HE3 TRP 21 3HE TRP 21 4.991 9.317 0.786
161 HZ2 TRP 21 2HZ TRP 21 5.098 9.605 -4.190
162 HZ3 TRP 21 3HZ TRP 21 5.170 11.488 -0.361
163 HH2 TRP 21 HH TRP 21 5.221 11.626 -2.800
164 H ASP 22 H ASP 22 6.376 7.372 3.328
165 HA ASP 22 HA ASP 22 6.576 5.149 5.180
166 1HB ASP 22 2HB ASP 22 8.083 6.882 5.658
167 2HB ASP 22 1HB ASP 22 6.884 8.131 5.357
168 H GLU 23 H GLU 23 4.837 4.274 6.117
169 HA GLU 23 HA GLU 23 2.445 5.898 6.532
170 1HB GLU 23 2HB GLU 23 2.965 2.950 6.969
171 2HB GLU 23 1HB GLU 23 1.467 3.752 7.413
172 1HG GLU 23 2HG GLU 23 1.223 4.409 5.000
173 2HG GLU 23 1HG GLU 23 2.588 3.343 4.657
174 H GLY 24 H GLY 24 3.701 7.242 8.029
175 1HA GLY 24 2HA GLY 24 4.413 6.146 10.594
176 2HA GLY 24 1HA GLY 24 4.374 7.849 10.157
177 H ARG 25 H ARG 25 1.946 5.268 10.258
178 HA ARG 25 HA ARG 25 0.385 6.680 12.250
179 1HB ARG 25 2HB ARG 25 -0.264 7.803 10.172
180 2HB ARG 25 1HB ARG 25 -0.601 6.257 9.418
181 1HG ARG 25 2HG ARG 25 -2.697 7.019 9.954
182 2HG ARG 25 1HG ARG 25 -2.318 5.979 11.324
183 1HD ARG 25 2HD ARG 25 -1.772 7.865 12.690
184 2HD ARG 25 1HD ARG 25 -1.887 8.959 11.309
185 HE ARG 25 HE ARG 25 -4.221 7.458 12.322
186 1HH1 ARG 25 1HH1 ARG 25 -2.692 10.480 11.380
187 2HH1 ARG 25 2HH1 ARG 25 -4.183 11.379 11.402
188 1HH2 ARG 25 1HH2 ARG 25 -6.173 8.633 12.321
189 2HH2 ARG 25 2HH2 ARG 25 -6.170 10.323 11.908
190 H ALA 26 H ALA 26 -0.970 5.316 13.315
191 HA ALA 26 HA ALA 26 -1.928 3.395 14.077
192 1HB ALA 26 1HB ALA 26 -2.769 1.761 12.464
193 2HB ALA 26 2HB ALA 26 -1.820 2.524 11.187
194 3HB ALA 26 3HB ALA 26 -3.136 3.410 11.957
195 HA PRO 27 HA PRO 27 1.366 0.397 14.588
196 1HB PRO 27 2HB PRO 27 -0.365 -1.569 15.714
197 2HB PRO 27 1HB PRO 27 0.645 -0.407 16.570
198 1HG PRO 27 2HG PRO 27 -2.129 -0.410 16.564
199 2HG PRO 27 1HG PRO 27 -1.107 0.977 16.983
200 1HD PRO 27 2HD PRO 27 -2.514 0.360 14.417
201 2HD PRO 27 1HD PRO 27 -2.271 1.925 15.225
202 H GLY 28 H GLY 28 1.725 -2.091 14.270
203 1HA GLY 28 2HA GLY 28 0.365 -2.897 11.775
204 2HA GLY 28 1HA GLY 28 2.084 -3.131 12.044
205 HA PRO 29 HA PRO 29 0.039 -7.300 12.749
206 1HB PRO 29 2HB PRO 29 2.961 -7.718 12.270
207 2HB PRO 29 1HB PRO 29 1.586 -8.699 11.752
208 1HG PRO 29 2HG PRO 29 2.807 -7.016 10.074
209 2HG PRO 29 1HG PRO 29 1.056 -7.283 10.014
210 1HD PRO 29 2HD PRO 29 2.569 -4.916 10.947
211 2HD PRO 29 1HD PRO 29 0.900 -5.033 10.358
212 H THR 30 H THR 30 0.508 -8.883 14.330
213 HA THR 30 HA THR 30 0.815 -7.642 16.841
214 HB THR 30 HB THR 30 0.521 -10.072 17.645
215 HG1 THR 30 1HG THR 30 0.641 -11.524 16.108
216 1HG2 THR 30 1HG2 THR 30 -1.864 -10.054 17.047
217 2HG2 THR 30 2HG2 THR 30 -1.549 -8.786 15.863
218 3HG2 THR 30 3HG2 THR 30 -1.311 -8.467 17.583
219 H ASP 31 H ASP 31 3.138 -9.247 14.861
220 HA ASP 31 HA ASP 31 4.726 -10.447 16.842
221 1HB ASP 31 2HB ASP 31 5.009 -10.968 14.466
222 2HB ASP 31 1HB ASP 31 5.599 -9.334 14.172
223 H GLY 32 H GLY 32 5.182 -7.334 15.216
224 1HA GLY 32 2HA GLY 32 5.760 -5.799 17.413
225 2HA GLY 32 1HA GLY 32 7.292 -6.543 16.979
226 H VAL 33 H VAL 33 4.614 -5.213 15.051
227 HA VAL 33 HA VAL 33 6.592 -3.676 13.519
228 HB VAL 33 HB VAL 33 3.674 -3.928 12.847
229 1HG1 VAL 33 1HG1 VAL 33 4.459 -3.535 10.558
230 2HG1 VAL 33 2HG1 VAL 33 6.108 -3.390 11.166
231 3HG1 VAL 33 3HG1 VAL 33 4.884 -2.215 11.649
232 1HG2 VAL 33 1HG2 VAL 33 4.627 -6.198 13.116
233 2HG2 VAL 33 2HG2 VAL 33 5.845 -5.790 11.906
234 3HG2 VAL 33 3HG2 VAL 33 4.142 -5.839 11.459
235 H LYS 34 H LYS 34 6.656 -1.500 13.652
236 HA LYS 34 HA LYS 34 4.637 -0.205 15.343
237 1HB LYS 34 2HB LYS 34 7.511 0.517 14.784
238 2HB LYS 34 1HB LYS 34 6.406 1.498 15.719
239 1HG LYS 34 2HG LYS 34 6.134 -0.453 17.270
240 2HG LYS 34 1HG LYS 34 7.454 -1.232 16.396
241 1HD LYS 34 2HD LYS 34 8.326 -0.138 18.371
242 2HD LYS 34 1HD LYS 34 8.894 0.710 16.929
243 1HE LYS 34 2HE LYS 34 7.005 2.312 17.229
244 2HE LYS 34 1HE LYS 34 6.654 1.531 18.769
245 1HZ LYS 34 1HZ LYS 34 9.211 2.855 18.048
246 2HZ LYS 34 2HZ LYS 34 8.856 2.136 19.543
247 3HZ LYS 34 3HZ LYS 34 8.007 3.515 19.042
248 H SER 35 H SER 35 5.860 -0.419 12.207
249 HA SER 35 HA SER 35 4.401 1.902 11.290
250 1HB SER 35 2HB SER 35 7.403 1.794 10.866
251 2HB SER 35 1HB SER 35 6.306 3.043 10.288
252 HG SER 35 HG SER 35 7.511 3.568 12.219
253 H ALA 36 H ALA 36 4.560 2.092 8.875
254 HA ALA 36 HA ALA 36 5.498 -0.371 7.586
255 1HB ALA 36 1HB ALA 36 3.497 -0.457 6.194
256 2HB ALA 36 2HB ALA 36 2.835 0.939 7.042
257 3HB ALA 36 3HB ALA 36 3.077 -0.582 7.902
258 H THR 37 H THR 37 6.213 -0.117 5.462
259 HA THR 37 HA THR 37 6.078 2.575 4.303
260 HB THR 37 HB THR 37 8.432 1.981 3.334
261 HG1 THR 37 1HG THR 37 9.646 0.596 4.594
262 1HG2 THR 37 1HG2 THR 37 9.540 3.071 5.229
263 2HG2 THR 37 2HG2 THR 37 8.115 2.790 6.229
264 3HG2 THR 37 3HG2 THR 37 8.015 3.869 4.839
265 H VAL 38 H VAL 38 5.495 2.573 2.182
266 HA VAL 38 HA VAL 38 5.312 -0.069 0.897
267 HB VAL 38 HB VAL 38 3.115 0.885 1.336
268 1HG1 VAL 38 1HG1 VAL 38 2.350 2.927 0.245
269 2HG1 VAL 38 2HG1 VAL 38 3.970 3.197 -0.401
270 3HG1 VAL 38 3HG1 VAL 38 3.694 3.248 1.341
271 1HG2 VAL 38 1HG2 VAL 38 3.840 0.874 -1.588
272 2HG2 VAL 38 2HG2 VAL 38 2.201 0.770 -0.942
273 3HG2 VAL 38 3HG2 VAL 38 3.364 -0.514 -0.611
274 H THR 39 H THR 39 6.319 -0.402 -0.965
275 HA THR 39 HA THR 39 7.537 1.929 -2.302
276 HB THR 39 HB THR 39 8.484 -0.942 -2.422
277 HG1 THR 39 1HG THR 39 8.684 0.424 -0.339
278 1HG2 THR 39 1HG2 THR 39 10.515 0.032 -3.380
279 2HG2 THR 39 2HG2 THR 39 9.781 1.633 -3.298
280 3HG2 THR 39 3HG2 THR 39 9.097 0.405 -4.361
281 H PHE 40 H PHE 40 6.764 2.384 -4.284
282 HA PHE 40 HA PHE 40 5.256 0.276 -5.660
283 1HB PHE 40 2HB PHE 40 5.331 3.262 -6.130
284 2HB PHE 40 1HB PHE 40 4.408 2.122 -7.105
285 HD1 PHE 40 2HD PHE 40 2.496 0.924 -6.108
286 HD2 PHE 40 1HD PHE 40 4.563 3.996 -4.018
287 HE1 PHE 40 2HE PHE 40 0.600 1.134 -4.552
288 HE2 PHE 40 1HE PHE 40 2.673 4.215 -2.456
289 HZ PHE 40 HZ PHE 40 0.683 2.781 -2.724
290 H THR 41 H THR 41 6.210 -0.804 -7.194
291 HA THR 41 HA THR 41 8.677 0.260 -8.379
292 HB THR 41 HB THR 41 7.878 -2.568 -8.845
293 HG1 THR 41 1HG THR 41 7.942 -1.465 -6.361
294 1HG2 THR 41 1HG2 THR 41 10.274 -2.935 -8.410
295 2HG2 THR 41 2HG2 THR 41 10.455 -1.234 -7.982
296 3HG2 THR 41 3HG2 THR 41 10.034 -1.688 -9.631
297 H GLU 42 H GLU 42 8.891 -0.932 -10.741
298 HA GLU 42 HA GLU 42 7.374 0.586 -12.451
299 1HB GLU 42 2HB GLU 42 9.511 -0.763 -12.897
300 2HB GLU 42 1HB GLU 42 8.440 -2.113 -13.240
301 1HG GLU 42 2HG GLU 42 9.085 -1.035 -15.292
302 2HG GLU 42 1HG GLU 42 7.364 -0.775 -15.002
303 H ASP 43 H ASP 43 6.915 -2.925 -11.893
304 HA ASP 43 HA ASP 43 4.102 -2.560 -12.706
305 1HB ASP 43 2HB ASP 43 5.468 -3.841 -14.349
306 2HB ASP 43 1HB ASP 43 5.840 -5.011 -13.092
307 H GLU 44 H GLU 44 6.071 -3.176 -10.135
308 HA GLU 44 HA GLU 44 4.181 -5.050 -8.872
309 1HB GLU 44 2HB GLU 44 7.047 -4.655 -8.018
310 2HB GLU 44 1HB GLU 44 5.947 -5.944 -7.556
311 1HG GLU 44 2HG GLU 44 7.299 -7.020 -9.046
312 2HG GLU 44 1HG GLU 44 5.984 -6.507 -10.099
313 H VAL 45 H VAL 45 3.659 -4.747 -6.684
314 HA VAL 45 HA VAL 45 4.518 -2.175 -5.499
315 HB VAL 45 HB VAL 45 1.962 -3.703 -4.953
316 1HG1 VAL 45 1HG1 VAL 45 1.345 -1.797 -3.543
317 2HG1 VAL 45 2HG1 VAL 45 2.933 -1.081 -3.823
318 3HG1 VAL 45 3HG1 VAL 45 2.794 -2.608 -2.953
319 1HG2 VAL 45 1HG2 VAL 45 2.385 -1.053 -6.318
320 2HG2 VAL 45 2HG2 VAL 45 0.827 -1.799 -5.959
321 3HG2 VAL 45 3HG2 VAL 45 1.930 -2.565 -7.102
322 H VAL 46 H VAL 46 5.888 -2.450 -3.859
323 HA VAL 46 HA VAL 46 6.015 -5.099 -2.586
324 HB VAL 46 HB VAL 46 8.143 -2.958 -2.668
325 1HG1 VAL 46 1HG1 VAL 46 9.634 -4.682 -1.806
326 2HG1 VAL 46 2HG1 VAL 46 8.295 -5.830 -1.758
327 3HG1 VAL 46 3HG1 VAL 46 8.282 -4.419 -0.701
328 1HG2 VAL 46 1HG2 VAL 46 9.303 -4.441 -4.241
329 2HG2 VAL 46 2HG2 VAL 46 7.764 -3.872 -4.887
330 3HG2 VAL 46 3HG2 VAL 46 7.902 -5.512 -4.252
331 H GLU 47 H GLU 47 5.363 -5.276 -0.552
332 HA GLU 47 HA GLU 47 5.014 -2.852 1.029
333 1HB GLU 47 2HB GLU 47 3.883 -5.592 1.162
334 2HB GLU 47 1HB GLU 47 4.035 -4.694 2.664
335 1HG GLU 47 2HG GLU 47 2.671 -2.925 1.823
336 2HG GLU 47 1HG GLU 47 2.645 -3.653 0.225
337 H THR 48 H THR 48 6.150 -2.357 2.676
338 HA THR 48 HA THR 48 8.010 -4.316 3.833
339 HB THR 48 HB THR 48 9.134 -1.770 4.246
340 HG1 THR 48 1HG THR 48 7.873 -1.025 2.470
341 1HG2 THR 48 1HG2 THR 48 10.972 -2.647 2.892
342 2HG2 THR 48 2HG2 THR 48 9.924 -3.932 2.291
343 3HG2 THR 48 3HG2 THR 48 10.354 -3.871 3.999
344 H GLU 49 H GLU 49 7.473 -4.652 5.896
345 HA GLU 49 HA GLU 49 6.142 -2.449 7.306
346 1HB GLU 49 2HB GLU 49 6.197 -5.382 8.018
347 2HB GLU 49 1HB GLU 49 5.319 -4.129 8.887
348 1HG GLU 49 2HG GLU 49 4.086 -3.664 6.744
349 2HG GLU 49 1HG GLU 49 4.813 -5.134 6.101
350 H VAL 50 H VAL 50 7.034 -1.530 9.059
351 HA VAL 50 HA VAL 50 9.851 -2.135 9.450
352 HB VAL 50 HB VAL 50 8.205 0.111 10.637
353 1HG1 VAL 50 1HG1 VAL 50 11.191 -0.271 10.450
354 2HG1 VAL 50 2HG1 VAL 50 10.218 -0.357 11.919
355 3HG1 VAL 50 3HG1 VAL 50 10.380 1.173 11.053
356 1HG2 VAL 50 1HG2 VAL 50 9.981 0.092 8.199
357 2HG2 VAL 50 2HG2 VAL 50 9.235 1.523 8.906
358 3HG2 VAL 50 3HG2 VAL 50 8.224 0.256 8.211
359 H MET 51 H MET 51 10.386 -3.557 10.855
360 HA MET 51 HA MET 51 8.804 -3.874 13.312
361 1HB MET 51 2HB MET 51 10.525 -5.819 11.774
362 2HB MET 51 1HB MET 51 9.793 -6.168 13.328
363 1HG MET 51 2HG MET 51 7.583 -5.940 12.367
364 2HG MET 51 1HG MET 51 8.287 -5.497 10.813
365 1HE MET 51 1HE MET 51 6.920 -7.329 9.543
366 2HE MET 51 2HE MET 51 6.134 -7.820 11.043
367 3HE MET 51 3HE MET 51 6.876 -9.033 9.999
368 H GLU 52 H GLU 52 9.810 -3.150 15.095
369 HA GLU 52 HA GLU 52 12.394 -2.130 15.073
370 1HB GLU 52 2HB GLU 52 12.153 -1.951 17.482
371 2HB GLU 52 1HB GLU 52 10.683 -1.442 16.678
372 1HG GLU 52 2HG GLU 52 9.465 -2.993 17.696
373 2HG GLU 52 1HG GLU 52 10.656 -4.257 17.380
374 H GLY 53 H GLY 53 14.339 -3.014 15.346
375 1HA GLY 53 2HA GLY 53 15.895 -4.561 16.218
376 2HA GLY 53 1HA GLY 53 14.570 -5.663 16.565
377 H ARG 54 H ARG 54 13.550 -5.075 13.746
378 HA ARG 54 HA ARG 54 15.338 -6.961 12.366
379 1HB ARG 54 2HB ARG 54 12.697 -6.279 11.218
380 2HB ARG 54 1HB ARG 54 13.532 -7.818 11.271
381 1HG ARG 54 2HG ARG 54 12.429 -6.682 13.782
382 2HG ARG 54 1HG ARG 54 11.350 -7.421 12.612
383 1HD ARG 54 2HD ARG 54 12.922 -9.430 12.689
384 2HD ARG 54 1HD ARG 54 13.597 -8.681 14.141
385 HE ARG 54 HE ARG 54 10.901 -8.681 14.572
386 1HH1 ARG 54 1HH1 ARG 54 13.285 -11.153 13.895
387 2HH1 ARG 54 2HH1 ARG 54 12.362 -12.424 14.640
388 1HH2 ARG 54 1HH2 ARG 54 9.650 -10.355 15.481
389 2HH2 ARG 54 2HH2 ARG 54 10.302 -11.969 15.552
390 H GLY 55 H GLY 55 13.342 -4.088 11.895
391 1HA GLY 55 2HA GLY 55 14.178 -2.174 10.636
392 2HA GLY 55 1HA GLY 55 15.036 -3.314 9.601
393 H GLU 56 H GLU 56 13.952 -2.418 7.746
394 HA GLU 56 HA GLU 56 11.111 -2.821 7.519
395 1HB GLU 56 2HB GLU 56 13.242 -2.062 5.520
396 2HB GLU 56 1HB GLU 56 11.544 -2.236 5.107
397 1HG GLU 56 2HG GLU 56 10.973 -0.470 6.682
398 2HG GLU 56 1HG GLU 56 12.671 -0.300 7.107
399 H VAL 57 H VAL 57 10.181 -4.644 7.070
400 HA VAL 57 HA VAL 57 11.805 -6.848 5.998
401 HB VAL 57 HB VAL 57 9.217 -6.842 7.557
402 1HG1 VAL 57 1HG1 VAL 57 9.356 -9.282 7.558
403 2HG1 VAL 57 2HG1 VAL 57 10.795 -9.210 6.539
404 3HG1 VAL 57 3HG1 VAL 57 9.241 -8.665 5.908
405 1HG2 VAL 57 1HG2 VAL 57 11.991 -7.776 8.291
406 2HG2 VAL 57 2HG2 VAL 57 10.552 -7.960 9.296
407 3HG2 VAL 57 3HG2 VAL 57 11.165 -6.351 8.916
408 H GLN 58 H GLN 58 11.457 -7.449 3.958
409 HA GLN 58 HA GLN 58 9.353 -6.201 2.452
410 1HB GLN 58 2HB GLN 58 11.510 -8.126 1.595
411 2HB GLN 58 1HB GLN 58 10.479 -7.197 0.530
412 1HG GLN 58 2HG GLN 58 11.439 -5.121 1.407
413 2HG GLN 58 1HG GLN 58 12.489 -6.070 2.455
414 1HE2 GLN 58 1HE2 GLN 58 13.098 -4.164 0.281
415 2HE2 GLN 58 2HE2 GLN 58 14.126 -5.040 -0.804
416 H LEU 59 H LEU 59 7.451 -7.046 2.208
417 HA LEU 59 HA LEU 59 7.034 -9.916 2.583
418 1HB LEU 59 2HB LEU 59 5.051 -7.646 2.320
419 2HB LEU 59 1HB LEU 59 4.637 -9.321 2.633
420 HG LEU 59 HG LEU 59 6.232 -7.533 4.466
421 1HD1 LEU 59 1HD1 LEU 59 3.421 -8.586 4.680
422 2HD1 LEU 59 2HD1 LEU 59 3.887 -6.913 4.375
423 3HD1 LEU 59 3HD1 LEU 59 4.272 -7.671 5.922
424 1HD2 LEU 59 1HD2 LEU 59 6.025 -9.374 6.074
425 2HD2 LEU 59 2HD2 LEU 59 6.940 -9.852 4.646
426 3HD2 LEU 59 3HD2 LEU 59 5.262 -10.365 4.831
427 HA PRO 60 HA PRO 60 6.331 -11.196 -1.592
428 1HB PRO 60 2HB PRO 60 3.429 -11.401 -0.933
429 2HB PRO 60 1HB PRO 60 4.482 -12.570 -1.735
430 1HG PRO 60 2HG PRO 60 3.784 -12.855 0.834
431 2HG PRO 60 1HG PRO 60 5.391 -13.318 0.251
432 1HD PRO 60 2HD PRO 60 4.587 -11.015 1.929
433 2HD PRO 60 1HD PRO 60 6.151 -11.846 1.815
434 H PHE 61 H PHE 61 6.400 -9.817 -3.203
435 HA PHE 61 HA PHE 61 5.045 -7.315 -3.158
436 1HB PHE 61 2HB PHE 61 6.100 -6.958 -5.376
437 2HB PHE 61 1HB PHE 61 7.252 -7.446 -4.141
438 HD1 PHE 61 2HD PHE 61 8.212 -9.717 -4.172
439 HD2 PHE 61 1HD PHE 61 5.672 -8.307 -7.285
440 HE1 PHE 61 2HE PHE 61 9.001 -11.534 -5.632
441 HE2 PHE 61 1HE PHE 61 6.450 -10.124 -8.750
442 HZ PHE 61 HZ PHE 61 8.120 -11.741 -7.923
443 H MET 62 H MET 62 3.385 -6.571 -4.387
444 HA MET 62 HA MET 62 1.675 -8.645 -5.570
445 1HB MET 62 2HB MET 62 1.091 -5.958 -4.361
446 2HB MET 62 1HB MET 62 -0.087 -6.811 -5.339
447 1HG MET 62 2HG MET 62 1.170 -7.902 -2.835
448 2HG MET 62 1HG MET 62 -0.395 -7.098 -2.907
449 1HE MET 62 1HE MET 62 1.580 -9.998 -4.822
450 2HE MET 62 2HE MET 62 0.610 -11.369 -4.284
451 3HE MET 62 3HE MET 62 1.490 -10.398 -3.106
452 H ALA 63 H ALA 63 0.694 -8.324 -7.571
453 HA ALA 63 HA ALA 63 2.007 -6.390 -9.317
454 1HB ALA 63 1HB ALA 63 1.804 -8.713 -10.093
455 2HB ALA 63 2HB ALA 63 0.943 -7.597 -11.153
456 3HB ALA 63 3HB ALA 63 0.049 -8.588 -9.997
457 H TYR 64 H TYR 64 0.896 -4.718 -10.370
458 HA TYR 64 HA TYR 64 -1.889 -4.323 -9.503
459 1HB TYR 64 2HB TYR 64 -1.523 -2.061 -8.899
460 2HB TYR 64 1HB TYR 64 -0.221 -2.966 -8.138
461 HD1 TYR 64 1HD TYR 64 2.085 -2.821 -9.066
462 HD2 TYR 64 2HD TYR 64 -1.080 -0.403 -10.555
463 HE1 TYR 64 1HE TYR 64 3.730 -1.325 -10.119
464 HE2 TYR 64 2HE TYR 64 0.554 1.096 -11.610
465 HH TYR 64 HH TYR 64 3.915 0.292 -11.833
466 H LYS 65 H LYS 65 -3.094 -2.794 -10.794
467 HA LYS 65 HA LYS 65 -1.946 -2.164 -13.423
468 1HB LYS 65 2HB LYS 65 -4.052 -2.758 -14.524
469 2HB LYS 65 1HB LYS 65 -3.347 -4.153 -13.718
470 1HG LYS 65 2HG LYS 65 -4.904 -3.911 -11.881
471 2HG LYS 65 1HG LYS 65 -5.586 -2.465 -12.620
472 1HD LYS 65 2HD LYS 65 -5.590 -5.200 -13.898
473 2HD LYS 65 1HD LYS 65 -6.945 -4.515 -12.996
474 1HE LYS 65 2HE LYS 65 -7.079 -2.669 -14.577
475 2HE LYS 65 1HE LYS 65 -5.701 -3.313 -15.466
476 1HZ LYS 65 1HZ LYS 65 -8.269 -4.746 -15.087
477 2HZ LYS 65 2HZ LYS 65 -6.967 -5.238 -16.057
478 3HZ LYS 65 3HZ LYS 65 -7.861 -3.857 -16.471
479 H VAL 66 H VAL 66 -3.153 -0.454 -14.518
480 HA VAL 66 HA VAL 66 -4.004 1.524 -12.513
481 HB VAL 66 HB VAL 66 -2.839 1.888 -15.275
482 1HG1 VAL 66 1HG1 VAL 66 -2.810 4.293 -14.773
483 2HG1 VAL 66 2HG1 VAL 66 -3.685 3.982 -13.272
484 3HG1 VAL 66 3HG1 VAL 66 -4.453 3.651 -14.824
485 1HG2 VAL 66 1HG2 VAL 66 -1.218 1.182 -13.598
486 2HG2 VAL 66 2HG2 VAL 66 -1.706 2.516 -12.551
487 3HG2 VAL 66 3HG2 VAL 66 -0.927 2.846 -14.100
488 H ILE 67 H ILE 67 -6.099 1.946 -12.428
489 HA ILE 67 HA ILE 67 -7.853 1.206 -14.626
490 HB ILE 67 HB ILE 67 -8.687 2.606 -12.095
491 1HG1 ILE 67 2HG1 ILE 67 -8.375 -0.374 -12.520
492 2HG1 ILE 67 1HG1 ILE 67 -7.398 0.630 -11.450
493 1HG2 ILE 67 1HG2 ILE 67 -10.139 0.773 -13.993
494 2HG2 ILE 67 2HG2 ILE 67 -10.349 2.519 -13.854
495 3HG2 ILE 67 3HG2 ILE 67 -10.824 1.465 -12.521
496 1HD1 ILE 67 1HD1 ILE 67 -10.357 0.146 -11.171
497 2HD1 ILE 67 2HD1 ILE 67 -9.350 1.102 -10.085
498 3HD1 ILE 67 3HD1 ILE 67 -9.094 -0.633 -10.224
499 H SER 68 H SER 68 -7.041 4.114 -12.767
500 HA SER 68 HA SER 68 -7.632 5.738 -15.133
501 1HB SER 68 2HB SER 68 -8.556 6.551 -12.377
502 2HB SER 68 1HB SER 68 -8.933 7.322 -13.910
503 HG SER 68 HG SER 68 -10.015 5.010 -12.758
504 H GLN 69 H GLN 69 -6.700 7.875 -14.997
505 HA GLN 69 HA GLN 69 -4.657 8.308 -12.983
506 1HB GLN 69 2HB GLN 69 -3.455 7.033 -14.697
507 2HB GLN 69 1HB GLN 69 -3.989 8.166 -15.932
508 1HG GLN 69 2HG GLN 69 -2.761 9.963 -14.761
509 2HG GLN 69 1HG GLN 69 -2.165 8.768 -13.614
510 1HE2 GLN 69 1HE2 GLN 69 -0.572 7.327 -14.258
511 2HE2 GLN 69 2HE2 GLN 69 0.352 7.559 -15.706
512 H SER 70 H SER 70 -4.432 10.405 -12.526
513 HA SER 70 HA SER 70 -5.388 12.415 -14.433
514 1HB SER 70 2HB SER 70 -7.206 11.986 -12.816
515 2HB SER 70 1HB SER 70 -6.107 12.329 -11.488
516 HG SER 70 HG SER 70 -6.465 14.238 -13.523
517 H THR 71 H THR 71 -3.703 13.685 -14.829
518 HA THR 71 HA THR 71 -1.467 14.002 -13.144
519 HB THR 71 HB THR 71 -2.396 15.917 -15.274
520 HG1 THR 71 1HG THR 71 -0.713 14.503 -16.464
521 1HG2 THR 71 1HG2 THR 71 -0.572 16.763 -13.883
522 2HG2 THR 71 2HG2 THR 71 -0.013 16.423 -15.521
523 3HG2 THR 71 3HG2 THR 71 0.361 15.301 -14.212
524 H ASP 72 H ASP 72 -4.582 15.446 -13.205
525 HA ASP 72 HA ASP 72 -4.168 17.843 -11.869
526 1HB ASP 72 2HB ASP 72 -6.330 17.276 -12.804
527 2HB ASP 72 1HB ASP 72 -6.489 15.920 -11.698
528 H GLY 73 H GLY 73 -4.629 14.580 -10.508
529 1HA GLY 73 2HA GLY 73 -2.724 14.615 -8.645
530 2HA GLY 73 1HA GLY 73 -3.925 15.632 -7.877
531 H SER 74 H SER 74 -4.748 12.777 -9.815
532 HA SER 74 HA SER 74 -4.769 11.112 -7.475
533 1HB SER 74 2HB SER 74 -7.182 10.439 -8.009
534 2HB SER 74 1HB SER 74 -6.917 11.915 -7.101
535 HG SER 74 HG SER 74 -7.143 13.047 -9.125
536 H ILE 75 H ILE 75 -4.547 9.015 -7.904
537 HA ILE 75 HA ILE 75 -4.966 8.089 -10.669
538 HB ILE 75 HB ILE 75 -2.643 7.307 -8.894
539 1HG1 ILE 75 2HG1 ILE 75 -2.820 8.933 -11.434
540 2HG1 ILE 75 1HG1 ILE 75 -2.216 9.452 -9.870
541 1HG2 ILE 75 1HG2 ILE 75 -3.426 5.391 -10.146
542 2HG2 ILE 75 2HG2 ILE 75 -1.890 5.952 -10.807
543 3HG2 ILE 75 3HG2 ILE 75 -3.400 6.321 -11.642
544 1HD1 ILE 75 1HD1 ILE 75 -0.917 7.404 -11.642
545 2HD1 ILE 75 2HD1 ILE 75 -0.311 7.967 -10.084
546 3HD1 ILE 75 3HD1 ILE 75 -0.409 9.081 -11.449
547 H GLU 76 H GLU 76 -5.975 6.153 -10.871
548 HA GLU 76 HA GLU 76 -6.826 4.826 -8.378
549 1HB GLU 76 2HB GLU 76 -8.627 5.852 -9.786
550 2HB GLU 76 1HB GLU 76 -8.143 4.778 -11.086
551 1HG GLU 76 2HG GLU 76 -8.702 2.844 -9.659
552 2HG GLU 76 1HG GLU 76 -9.301 3.965 -8.438
553 H ILE 77 H ILE 77 -6.089 2.840 -8.061
554 HA ILE 77 HA ILE 77 -5.111 1.308 -10.370
555 HB ILE 77 HB ILE 77 -3.220 0.469 -9.002
556 1HG1 ILE 77 2HG1 ILE 77 -3.969 2.714 -7.118
557 2HG1 ILE 77 1HG1 ILE 77 -4.180 0.999 -6.780
558 1HG2 ILE 77 1HG2 ILE 77 -1.818 2.465 -9.242
559 2HG2 ILE 77 2HG2 ILE 77 -3.267 3.450 -9.440
560 3HG2 ILE 77 3HG2 ILE 77 -2.863 2.223 -10.640
561 1HD1 ILE 77 1HD1 ILE 77 -2.205 1.910 -5.680
562 2HD1 ILE 77 2HD1 ILE 77 -1.546 2.383 -7.246
563 3HD1 ILE 77 3HD1 ILE 77 -1.773 0.676 -6.864
564 H GLN 78 H GLN 78 -4.945 -0.979 -10.004
565 HA GLN 78 HA GLN 78 -6.591 -1.976 -7.786
566 1HB GLN 78 2HB GLN 78 -7.870 -1.821 -9.964
567 2HB GLN 78 1HB GLN 78 -6.759 -3.010 -10.619
568 1HG GLN 78 2HG GLN 78 -7.508 -4.679 -9.141
569 2HG GLN 78 1HG GLN 78 -8.390 -3.511 -8.152
570 1HE2 GLN 78 1HE2 GLN 78 -10.381 -4.369 -8.343
571 2HE2 GLN 78 2HE2 GLN 78 -11.266 -4.481 -9.825
572 H TYR 79 H TYR 79 -6.013 -4.048 -7.062
573 HA TYR 79 HA TYR 79 -3.332 -4.868 -7.909
574 1HB TYR 79 2HB TYR 79 -4.923 -5.583 -5.437
575 2HB TYR 79 1HB TYR 79 -3.307 -6.176 -5.799
576 HD1 TYR 79 1HD TYR 79 -1.417 -4.481 -5.982
577 HD2 TYR 79 2HD TYR 79 -5.234 -3.513 -4.361
578 HE1 TYR 79 1HE TYR 79 -0.444 -2.510 -4.878
579 HE2 TYR 79 2HE TYR 79 -4.269 -1.542 -3.251
580 HH TYR 79 HH TYR 79 -1.211 -0.318 -4.009
581 H LEU 80 H LEU 80 -2.852 -7.095 -8.155
582 HA LEU 80 HA LEU 80 -5.154 -8.704 -9.069
583 1HB LEU 80 2HB LEU 80 -2.235 -8.832 -9.887
584 2HB LEU 80 1HB LEU 80 -3.502 -9.883 -10.488
585 HG LEU 80 HG LEU 80 -3.662 -6.900 -10.863
586 1HD1 LEU 80 1HD1 LEU 80 -1.519 -7.621 -11.794
587 2HD1 LEU 80 2HD1 LEU 80 -2.660 -7.219 -13.077
588 3HD1 LEU 80 3HD1 LEU 80 -2.330 -8.908 -12.688
589 1HD2 LEU 80 1HD2 LEU 80 -5.072 -7.547 -12.747
590 2HD2 LEU 80 2HD2 LEU 80 -5.685 -8.214 -11.233
591 3HD2 LEU 80 3HD2 LEU 80 -4.814 -9.247 -12.366
592 H GLY 81 H GLY 81 -4.313 -11.198 -9.006
593 1HA GLY 81 2HA GLY 81 -3.688 -12.962 -7.639
594 2HA GLY 81 1HA GLY 81 -2.763 -11.818 -6.669
595 HA PRO 82 HA PRO 82 -6.240 -13.143 -3.918
596 1HB PRO 82 2HB PRO 82 -4.295 -12.091 -1.944
597 2HB PRO 82 1HB PRO 82 -5.180 -13.619 -1.948
598 1HG PRO 82 2HG PRO 82 -2.567 -13.534 -2.487
599 2HG PRO 82 1HG PRO 82 -3.646 -14.656 -3.339
600 1HD PRO 82 2HD PRO 82 -2.469 -12.071 -4.274
601 2HD PRO 82 1HD PRO 82 -2.728 -13.583 -5.168
602 H TYR 83 H TYR 83 -4.646 -10.186 -4.591
603 HA TYR 83 HA TYR 83 -6.560 -8.668 -2.966
604 1HB TYR 83 2HB TYR 83 -3.908 -7.950 -4.182
605 2HB TYR 83 1HB TYR 83 -5.036 -6.710 -3.647
606 HD1 TYR 83 2HD TYR 83 -5.637 -6.542 -1.246
607 HD2 TYR 83 1HD TYR 83 -2.606 -9.201 -2.610
608 HE1 TYR 83 2HE TYR 83 -4.762 -6.711 1.046
609 HE2 TYR 83 1HE TYR 83 -1.723 -9.379 -0.321
610 HH TYR 83 HH TYR 83 -1.741 -7.992 1.780
611 H TYR 84 H TYR 84 -6.931 -10.014 -5.685
612 HA TYR 84 HA TYR 84 -7.425 -7.959 -7.571
613 1HB TYR 84 2HB TYR 84 -7.180 -10.581 -7.800
614 2HB TYR 84 1HB TYR 84 -8.916 -10.557 -7.581
615 HD1 TYR 84 1HD TYR 84 -7.590 -7.666 -9.260
616 HD2 TYR 84 2HD TYR 84 -8.957 -11.650 -9.866
617 HE1 TYR 84 1HE TYR 84 -7.934 -7.181 -11.647
618 HE2 TYR 84 2HE TYR 84 -9.299 -11.175 -12.252
619 HH TYR 84 HH TYR 84 -9.736 -9.191 -13.677
620 HA PRO 85 HA PRO 85 -10.989 -6.121 -8.335
621 1HB PRO 85 2HB PRO 85 -12.760 -7.418 -6.323
622 2HB PRO 85 1HB PRO 85 -13.192 -6.553 -7.800
623 1HG PRO 85 2HG PRO 85 -12.736 -9.329 -7.574
624 2HG PRO 85 1HG PRO 85 -12.874 -8.403 -9.076
625 1HD PRO 85 2HD PRO 85 -10.579 -9.727 -8.228
626 2HD PRO 85 1HD PRO 85 -10.604 -8.396 -9.406
627 H LEU 86 H LEU 86 -9.488 -6.529 -5.309
628 HA LEU 86 HA LEU 86 -10.680 -4.294 -4.007
629 1HB LEU 86 2HB LEU 86 -9.492 -6.050 -2.775
630 2HB LEU 86 1HB LEU 86 -7.994 -5.596 -3.565
631 HG LEU 86 HG LEU 86 -8.092 -3.385 -2.469
632 1HD1 LEU 86 1HD1 LEU 86 -10.505 -4.519 -1.062
633 2HD1 LEU 86 2HD1 LEU 86 -10.507 -3.199 -2.232
634 3HD1 LEU 86 3HD1 LEU 86 -9.704 -2.996 -0.674
635 1HD2 LEU 86 1HD2 LEU 86 -7.565 -4.152 -0.213
636 2HD2 LEU 86 2HD2 LEU 86 -6.850 -5.217 -1.427
637 3HD2 LEU 86 3HD2 LEU 86 -8.305 -5.713 -0.562
638 H LYS 87 H LYS 87 -10.527 -2.275 -4.667
639 HA LYS 87 HA LYS 87 -8.355 -1.392 -6.353
640 1HB LYS 87 2HB LYS 87 -10.739 0.052 -5.209
641 2HB LYS 87 1HB LYS 87 -9.543 0.811 -6.245
642 1HG LYS 87 2HG LYS 87 -10.138 -0.831 -8.016
643 2HG LYS 87 1HG LYS 87 -11.447 -1.399 -6.967
644 1HD LYS 87 2HD LYS 87 -12.358 0.872 -6.889
645 2HD LYS 87 1HD LYS 87 -11.067 1.426 -7.955
646 1HE LYS 87 2HE LYS 87 -11.883 -0.157 -9.675
647 2HE LYS 87 1HE LYS 87 -13.229 -0.565 -8.607
648 1HZ LYS 87 1HZ LYS 87 -13.864 1.116 -10.241
649 2HZ LYS 87 2HZ LYS 87 -12.636 2.149 -9.681
650 3HZ LYS 87 3HZ LYS 87 -13.936 1.746 -8.668
651 H SER 88 H SER 88 -7.231 0.606 -5.915
652 HA SER 88 HA SER 88 -7.242 1.640 -3.214
653 1HB SER 88 2HB SER 88 -5.465 0.007 -3.026
654 2HB SER 88 1HB SER 88 -4.738 0.550 -4.529
655 HG SER 88 HG SER 88 -5.066 2.235 -2.274
656 H THR 89 H THR 89 -6.582 3.830 -3.166
657 HA THR 89 HA THR 89 -6.262 5.014 -5.845
658 HB THR 89 HB THR 89 -7.586 6.589 -3.704
659 HG1 THR 89 1HG THR 89 -9.375 5.416 -3.685
660 1HG2 THR 89 1HG2 THR 89 -8.865 7.451 -5.618
661 2HG2 THR 89 2HG2 THR 89 -8.038 6.308 -6.676
662 3HG2 THR 89 3HG2 THR 89 -7.127 7.591 -5.878
663 H LEU 90 H LEU 90 -4.828 6.647 -6.063
664 HA LEU 90 HA LEU 90 -3.334 7.471 -3.660
665 1HB LEU 90 2HB LEU 90 -2.376 7.266 -6.521
666 2HB LEU 90 1HB LEU 90 -1.431 7.919 -5.198
667 HG LEU 90 HG LEU 90 -2.393 5.062 -5.413
668 1HD1 LEU 90 1HD1 LEU 90 -0.036 4.529 -5.770
669 2HD1 LEU 90 2HD1 LEU 90 0.360 6.246 -5.758
670 3HD1 LEU 90 3HD1 LEU 90 -0.654 5.582 -7.040
671 1HD2 LEU 90 1HD2 LEU 90 -0.929 4.677 -3.481
672 2HD2 LEU 90 2HD2 LEU 90 -2.236 5.798 -3.103
673 3HD2 LEU 90 3HD2 LEU 90 -0.608 6.410 -3.387
674 H LYS 91 H LYS 91 -3.512 9.557 -3.143
675 HA LYS 91 HA LYS 91 -4.368 11.434 -5.240
676 1HB LYS 91 2HB LYS 91 -5.546 11.064 -2.497
677 2HB LYS 91 1HB LYS 91 -5.765 12.548 -3.416
678 1HG LYS 91 2HG LYS 91 -6.809 11.263 -5.224
679 2HG LYS 91 1HG LYS 91 -6.600 9.787 -4.285
680 1HD LYS 91 2HD LYS 91 -8.204 12.176 -3.385
681 2HD LYS 91 1HD LYS 91 -8.890 10.743 -4.151
682 1HE LYS 91 2HE LYS 91 -7.951 9.373 -2.305
683 2HE LYS 91 1HE LYS 91 -7.414 10.860 -1.522
684 1HZ LYS 91 1HZ LYS 91 -9.706 11.584 -1.369
685 2HZ LYS 91 2HZ LYS 91 -9.535 10.060 -0.640
686 3HZ LYS 91 3HZ LYS 91 -10.235 10.195 -2.179
687 H ARG 92 H ARG 92 -4.130 13.724 -4.566
688 HA ARG 92 HA ARG 92 -1.425 14.144 -3.728
689 1HB ARG 92 2HB ARG 92 -1.886 16.486 -4.263
690 2HB ARG 92 1HB ARG 92 -2.424 15.423 -5.557
691 1HG ARG 92 2HG ARG 92 -4.707 15.535 -4.623
692 2HG ARG 92 1HG ARG 92 -4.128 16.723 -3.460
693 1HD ARG 92 2HD ARG 92 -3.504 18.219 -5.279
694 2HD ARG 92 1HD ARG 92 -4.035 17.021 -6.462
695 HE ARG 92 HE ARG 92 -5.983 18.019 -4.507
696 1HH1 ARG 92 1HH1 ARG 92 -4.819 17.935 -7.813
697 2HH1 ARG 92 2HH1 ARG 92 -6.289 18.575 -8.472
698 1HH2 ARG 92 1HH2 ARG 92 -7.914 18.887 -5.394
699 2HH2 ARG 92 2HH2 ARG 92 -8.025 19.128 -7.118
700 H GLY 93 H GLY 93 -0.687 15.255 -1.924
701 1HA GLY 93 2HA GLY 93 -2.612 15.539 0.261
702 2HA GLY 93 1HA GLY 93 -0.867 15.409 0.436
703 H GLU 94 H GLU 94 -1.954 17.336 1.827
704 HA GLU 94 HA GLU 94 -2.008 19.806 0.274
705 1HB GLU 94 2HB GLU 94 -2.602 19.265 3.186
706 2HB GLU 94 1HB GLU 94 -2.847 20.788 2.357
707 1HG GLU 94 2HG GLU 94 -4.518 19.792 0.928
708 2HG GLU 94 1HG GLU 94 -4.227 18.217 1.663
709 H ASN 95 H ASN 95 0.299 17.990 1.720
710 HA ASN 95 HA ASN 95 1.909 20.349 2.434
711 1HB ASN 95 2HB ASN 95 1.913 17.705 3.908
712 2HB ASN 95 1HB ASN 95 2.893 19.116 4.297
713 1HD2 ASN 95 1HD2 ASN 95 1.874 20.953 5.167
714 2HD2 ASN 95 2HD2 ASN 95 0.336 20.839 5.955
715 H GLY 96 H GLY 96 1.777 18.798 -0.036
716 1HA GLY 96 2HA GLY 96 3.225 17.868 -1.572
717 2HA GLY 96 1HA GLY 96 4.536 18.242 -0.457
718 H THR 97 H THR 97 1.701 16.142 -0.243
719 HA THR 97 HA THR 97 3.456 13.877 0.354
720 HB THR 97 HB THR 97 1.602 13.196 2.014
721 HG1 THR 97 1HG THR 97 0.604 15.179 2.930
722 1HG2 THR 97 1HG2 THR 97 2.613 14.524 3.832
723 2HG2 THR 97 2HG2 THR 97 3.397 15.548 2.629
724 3HG2 THR 97 3HG2 THR 97 3.830 13.843 2.752
725 H LEU 98 H LEU 98 2.051 11.782 0.391
726 HA LEU 98 HA LEU 98 0.122 11.925 -1.828
727 1HB LEU 98 2HB LEU 98 2.285 10.776 -2.385
728 2HB LEU 98 1HB LEU 98 1.909 9.585 -1.157
729 HG LEU 98 HG LEU 98 -0.191 9.049 -2.450
730 1HD1 LEU 98 1HD1 LEU 98 -0.306 11.143 -3.720
731 2HD1 LEU 98 2HD1 LEU 98 -0.305 9.727 -4.771
732 3HD1 LEU 98 3HD1 LEU 98 1.163 10.686 -4.587
733 1HD2 LEU 98 1HD2 LEU 98 0.969 7.692 -4.114
734 2HD2 LEU 98 2HD2 LEU 98 1.797 7.636 -2.558
735 3HD2 LEU 98 3HD2 LEU 98 2.439 8.632 -3.863
736 H ILE 99 H ILE 99 -1.822 11.064 -1.484
737 HA ILE 99 HA ILE 99 -2.372 9.924 1.155
738 HB ILE 99 HB ILE 99 -4.293 10.839 -0.993
739 1HG1 ILE 99 2HG1 ILE 99 -2.879 12.665 -0.104
740 2HG1 ILE 99 1HG1 ILE 99 -4.580 12.864 0.296
741 1HG2 ILE 99 1HG2 ILE 99 -5.295 9.217 0.499
742 2HG2 ILE 99 2HG2 ILE 99 -5.961 10.821 0.809
743 3HG2 ILE 99 3HG2 ILE 99 -4.755 10.143 1.902
744 1HD1 ILE 99 1HD1 ILE 99 -2.436 11.830 2.141
745 2HD1 ILE 99 2HD1 ILE 99 -4.139 12.040 2.550
746 3HD1 ILE 99 3HD1 ILE 99 -3.145 13.446 2.171
747 H TRP 100 H TRP 100 -2.414 7.785 1.315
748 HA TRP 100 HA TRP 100 -2.961 6.159 -1.059
749 1HB TRP 100 2HB TRP 100 -0.928 5.684 0.326
750 2HB TRP 100 1HB TRP 100 -1.985 5.271 1.671
751 HD1 TRP 100 HD TRP 100 -3.179 4.060 -1.698
752 HE1 TRP 100 1HE TRP 100 -2.835 1.526 -1.881
753 HE3 TRP 100 3HE TRP 100 -0.305 3.330 2.471
754 HZ2 TRP 100 2HZ TRP 100 -1.520 -0.520 -0.458
755 HZ3 TRP 100 3HZ TRP 100 0.454 1.045 2.983
756 HH2 TRP 100 HH TRP 100 -0.143 -0.837 1.549
757 H GLU 101 H GLU 101 -5.032 5.686 -1.348
758 HA GLU 101 HA GLU 101 -6.719 5.272 1.010
759 1HB GLU 101 2HB GLU 101 -7.419 6.973 -0.653
760 2HB GLU 101 1HB GLU 101 -7.509 5.713 -1.874
761 1HG GLU 101 2HG GLU 101 -9.208 4.580 -0.468
762 2HG GLU 101 1HG GLU 101 -9.165 5.977 0.604
763 H GLN 102 H GLN 102 -7.551 3.349 1.418
764 HA GLN 102 HA GLN 102 -7.639 1.282 -0.625
765 1HB GLN 102 2HB GLN 102 -5.344 1.211 0.466
766 2HB GLN 102 1HB GLN 102 -6.156 0.782 1.964
767 1HG GLN 102 2HG GLN 102 -6.879 -0.892 -0.327
768 2HG GLN 102 1HG GLN 102 -5.185 -0.979 0.132
769 1HE2 GLN 102 1HE2 GLN 102 -5.268 -3.061 0.901
770 2HE2 GLN 102 2HE2 GLN 102 -6.138 -3.505 2.329
771 H ASN 103 H ASN 103 -9.445 0.107 -0.371
772 HA ASN 103 HA ASN 103 -11.387 -0.701 0.504
773 1HB ASN 103 2HB ASN 103 -9.486 -0.786 2.753
774 2HB ASN 103 1HB ASN 103 -11.176 -0.773 3.234
775 1HD2 ASN 103 1HD2 ASN 103 -8.968 -2.839 3.203
776 2HD2 ASN 103 2HD2 ASN 103 -9.706 -4.220 2.469
777 H GLY 104 H GLY 104 -10.810 2.239 0.285
778 1HA GLY 104 2HA GLY 104 -12.258 4.049 0.474
779 2HA GLY 104 1HA GLY 104 -13.223 3.130 1.620
780 H GLN 105 H GLN 105 -10.278 2.709 2.823
781 HA GLN 105 HA GLN 105 -10.666 4.867 4.739
782 1HB GLN 105 2HB GLN 105 -8.851 2.449 4.856
783 2HB GLN 105 1HB GLN 105 -9.101 3.606 6.161
784 1HG GLN 105 2HG GLN 105 -11.558 2.997 6.024
785 2HG GLN 105 1HG GLN 105 -11.056 1.643 5.013
786 1HE2 GLN 105 1HE2 GLN 105 -10.950 3.053 8.172
787 2HE2 GLN 105 2HE2 GLN 105 -10.400 1.647 9.020
788 H ARG 106 H ARG 106 -9.009 6.264 5.389
789 HA ARG 106 HA ARG 106 -7.288 6.920 3.102
790 1HB ARG 106 2HB ARG 106 -9.061 8.521 3.952
791 2HB ARG 106 1HB ARG 106 -8.066 8.725 5.388
792 1HG ARG 106 2HG ARG 106 -6.222 9.516 3.970
793 2HG ARG 106 1HG ARG 106 -7.273 9.368 2.558
794 1HD ARG 106 2HD ARG 106 -7.368 11.637 3.182
795 2HD ARG 106 1HD ARG 106 -8.870 10.921 3.763
796 HE ARG 106 HE ARG 106 -6.543 11.464 5.506
797 1HH1 ARG 106 1HH1 ARG 106 -10.005 11.320 4.970
798 2HH1 ARG 106 2HH1 ARG 106 -10.399 12.032 6.509
799 1HH2 ARG 106 1HH2 ARG 106 -7.046 12.418 7.503
800 2HH2 ARG 106 2HH2 ARG 106 -8.706 12.674 7.952
801 H LYS 107 H LYS 107 -5.231 6.341 3.286
802 HA LYS 107 HA LYS 107 -3.888 6.631 5.888
803 1HB LYS 107 2HB LYS 107 -3.287 5.044 3.431
804 2HB LYS 107 1HB LYS 107 -1.955 5.554 4.456
805 1HG LYS 107 2HG LYS 107 -4.262 3.776 5.190
806 2HG LYS 107 1HG LYS 107 -2.547 3.376 5.138
807 1HD LYS 107 2HD LYS 107 -2.477 5.391 6.893
808 2HD LYS 107 1HD LYS 107 -4.118 4.813 7.189
809 1HE LYS 107 2HE LYS 107 -1.535 3.326 7.455
810 2HE LYS 107 1HE LYS 107 -2.754 3.644 8.678
811 1HZ LYS 107 1HZ LYS 107 -3.111 1.858 6.335
812 2HZ LYS 107 2HZ LYS 107 -4.264 2.149 7.550
813 3HZ LYS 107 3HZ LYS 107 -2.814 1.347 7.923
814 H THR 108 H THR 108 -2.478 8.238 6.226
815 HA THR 108 HA THR 108 -1.723 9.927 3.957
816 HB THR 108 HB THR 108 -2.727 11.181 5.773
817 HG1 THR 108 1HG THR 108 0.059 11.688 5.982
818 1HG2 THR 108 1HG2 THR 108 -2.275 9.660 7.626
819 2HG2 THR 108 2HG2 THR 108 -1.714 11.290 8.006
820 3HG2 THR 108 3HG2 THR 108 -0.557 10.044 7.537
821 H MET 109 H MET 109 0.324 9.905 3.199
822 HA MET 109 HA MET 109 2.251 8.294 4.736
823 1HB MET 109 2HB MET 109 1.949 8.482 1.735
824 2HB MET 109 1HB MET 109 3.212 7.589 2.572
825 1HG MET 109 2HG MET 109 1.515 6.152 3.595
826 2HG MET 109 1HG MET 109 0.255 7.037 2.739
827 1HE MET 109 1HE MET 109 1.823 7.565 -0.044
828 2HE MET 109 2HE MET 109 0.119 7.117 0.035
829 3HE MET 109 3HE MET 109 1.220 6.218 -1.009
830 H THR 110 H THR 110 4.329 8.923 4.873
831 HA THR 110 HA THR 110 4.989 11.644 4.010
832 HB THR 110 HB THR 110 6.836 9.922 5.615
833 HG1 THR 110 1HG THR 110 5.298 9.655 7.058
834 1HG2 THR 110 1HG2 THR 110 7.568 12.152 4.967
835 2HG2 THR 110 2HG2 THR 110 7.336 12.071 6.714
836 3HG2 THR 110 3HG2 THR 110 6.126 12.856 5.698
837 H ARG 111 H ARG 111 7.148 11.980 2.949
838 HA ARG 111 HA ARG 111 7.661 9.748 1.125
839 1HB ARG 111 2HB ARG 111 7.282 12.079 0.239
840 2HB ARG 111 1HB ARG 111 8.814 12.536 0.969
841 1HG ARG 111 2HG ARG 111 9.866 10.689 -0.394
842 2HG ARG 111 1HG ARG 111 8.336 10.579 -1.263
843 1HD ARG 111 2HD ARG 111 9.726 11.979 -2.552
844 2HD ARG 111 1HD ARG 111 8.580 13.046 -1.741
845 HE ARG 111 HE ARG 111 10.551 13.246 -0.041
846 1HH1 ARG 111 1HH1 ARG 111 10.736 13.102 -3.532
847 2HH1 ARG 111 2HH1 ARG 111 12.267 13.927 -3.619
848 1HH2 ARG 111 1HH2 ARG 111 12.526 14.379 -0.143
849 2HH2 ARG 111 2HH2 ARG 111 13.262 14.695 -1.681
850 H ILE 112 H ILE 112 9.285 8.428 1.473
851 HA ILE 112 HA ILE 112 11.286 8.915 3.458
852 HB ILE 112 HB ILE 112 11.214 6.794 1.312
853 1HG1 ILE 112 2HG1 ILE 112 9.255 6.844 2.883
854 2HG1 ILE 112 1HG1 ILE 112 10.183 5.355 2.933
855 1HG2 ILE 112 1HG2 ILE 112 13.445 7.092 2.228
856 2HG2 ILE 112 2HG2 ILE 112 12.756 5.550 2.734
857 3HG2 ILE 112 3HG2 ILE 112 12.808 6.905 3.862
858 1HD1 ILE 112 1HD1 ILE 112 10.298 7.611 4.923
859 2HD1 ILE 112 2HD1 ILE 112 11.329 6.182 4.960
860 3HD1 ILE 112 3HD1 ILE 112 9.588 6.014 5.169
861 H GLU 113 H GLU 113 13.512 9.204 3.101
862 HA GLU 113 HA GLU 113 13.934 10.997 0.843
863 1HB GLU 113 2HB GLU 113 15.635 10.589 3.289
864 2HB GLU 113 1HB GLU 113 15.817 11.870 2.103
865 1HG GLU 113 2HG GLU 113 13.578 12.704 2.705
866 2HG GLU 113 1HG GLU 113 13.480 11.469 3.959
867 H SER 114 H SER 114 14.201 9.428 -0.713
868 HA SER 114 HA SER 114 15.453 8.333 -2.247
869 1HB SER 114 2HB SER 114 17.121 10.096 -1.837
870 2HB SER 114 1HB SER 114 17.805 9.139 -0.524
871 HG SER 114 HG SER 114 18.631 7.730 -1.937
872 H LYS 115 H LYS 115 14.889 6.253 -2.147
873 HA LYS 115 HA LYS 115 15.826 4.523 -0.040
874 1HB LYS 115 2HB LYS 115 13.613 4.224 -1.203
875 2HB LYS 115 1HB LYS 115 14.498 3.747 -2.645
876 1HG LYS 115 2HG LYS 115 15.459 1.854 -1.431
877 2HG LYS 115 1HG LYS 115 14.556 2.323 0.012
878 1HD LYS 115 2HD LYS 115 12.461 2.094 -1.329
879 2HD LYS 115 1HD LYS 115 13.439 1.430 -2.640
880 1HE LYS 115 2HE LYS 115 14.157 -0.397 -1.217
881 2HE LYS 115 1HE LYS 115 13.273 0.287 0.146
882 1HZ LYS 115 1HZ LYS 115 12.109 -0.783 -2.368
883 2HZ LYS 115 2HZ LYS 115 11.216 0.002 -1.157
884 3HZ LYS 115 3HZ LYS 115 11.992 -1.465 -0.818
885 H THR 116 H THR 116 18.089 5.125 -0.449
886 HA THR 116 HA THR 116 19.323 4.151 -2.878
887 HB THR 116 HB THR 116 20.978 4.979 -0.570
888 HG1 THR 116 1HG THR 116 20.123 6.922 -0.434
889 1HG2 THR 116 1HG2 THR 116 20.994 5.725 -3.493
890 2HG2 THR 116 2HG2 THR 116 21.948 4.434 -2.766
891 3HG2 THR 116 3HG2 THR 116 22.249 6.113 -2.316
892 H GLY 117 H GLY 117 19.080 1.961 -2.823
893 1HA GLY 117 2HA GLY 117 21.030 0.389 -1.621
894 2HA GLY 117 1HA GLY 117 19.611 0.314 -0.584
895 H ARG 118 H ARG 118 20.114 0.344 -4.099
896 HA ARG 118 HA ARG 118 18.233 -1.881 -4.324
897 1HB ARG 118 2HB ARG 118 17.790 0.105 -5.721
898 2HB ARG 118 1HB ARG 118 19.369 -0.075 -6.473
899 1HG ARG 118 2HG ARG 118 18.644 -2.306 -7.306
900 2HG ARG 118 1HG ARG 118 17.034 -1.966 -6.672
901 1HD ARG 118 2HD ARG 118 16.935 0.044 -8.104
902 2HD ARG 118 1HD ARG 118 18.506 -0.384 -8.777
903 HE ARG 118 HE ARG 118 16.349 -2.342 -8.989
904 1HH1 ARG 118 1HH1 ARG 118 18.391 0.036 -10.552
905 2HH1 ARG 118 2HH1 ARG 118 17.970 -0.468 -12.154
906 1HH2 ARG 118 1HH2 ARG 118 15.792 -3.017 -11.100
907 2HH2 ARG 118 2HH2 ARG 118 16.508 -2.215 -12.472
908 H GLU 119 H GLU 119 19.372 -3.665 -3.891
909 HA GLU 119 HA GLU 119 21.173 -4.581 -5.915
910 1HB GLU 119 2HB GLU 119 22.755 -3.320 -4.545
911 2HB GLU 119 1HB GLU 119 22.227 -4.188 -3.108
912 1HG GLU 119 2HG GLU 119 23.204 -6.191 -3.825
913 2HG GLU 119 1HG GLU 119 23.388 -5.604 -5.478
914 H GLU 120 H GLU 120 19.437 -6.037 -6.089
915 HA GLU 120 HA GLU 120 19.772 -8.315 -4.272
916 1HB GLU 120 2HB GLU 120 17.230 -7.011 -5.136
917 2HB GLU 120 1HB GLU 120 17.249 -8.754 -4.938
918 1HG GLU 120 2HG GLU 120 18.127 -6.850 -2.787
919 2HG GLU 120 1HG GLU 120 16.470 -7.432 -2.952
920 H LYS 121 H LYS 121 20.373 -10.058 -5.352
921 HA LYS 121 HA LYS 121 20.637 -9.926 -8.194
922 1HB LYS 121 2HB LYS 121 21.642 -12.129 -8.055
923 2HB LYS 121 1HB LYS 121 22.290 -11.105 -6.781
924 1HG LYS 121 2HG LYS 121 21.064 -12.223 -5.113
925 2HG LYS 121 1HG LYS 121 20.018 -13.007 -6.300
926 1HD LYS 121 2HD LYS 121 21.990 -14.251 -7.141
927 2HD LYS 121 1HD LYS 121 22.954 -13.534 -5.848
928 1HE LYS 121 2HE LYS 121 21.601 -14.604 -4.173
929 2HE LYS 121 1HE LYS 121 20.473 -15.186 -5.397
930 1HZ LYS 121 1HZ LYS 121 22.210 -16.570 -6.311
931 2HZ LYS 121 2HZ LYS 121 22.001 -16.912 -4.662
932 3HZ LYS 121 3HZ LYS 121 23.328 -15.980 -5.173
933 H ASP 122 H ASP 122 19.342 -10.716 -9.742
934 HA ASP 122 HA ASP 122 16.886 -12.036 -8.999
935 1HB ASP 122 2HB ASP 122 16.799 -10.457 -10.842
936 2HB ASP 122 1HB ASP 122 18.036 -11.359 -11.708
937 H GLU 123 H GLU 123 16.506 -14.139 -9.062
938 HA GLU 123 HA GLU 123 18.133 -15.991 -10.509
939 1HB GLU 123 2HB GLU 123 19.513 -15.346 -8.461
940 2HB GLU 123 1HB GLU 123 18.289 -16.163 -7.502
941 1HG GLU 123 2HG GLU 123 18.775 -18.257 -8.532
942 2HG GLU 123 1HG GLU 123 19.844 -17.489 -9.707
943 H LYS 124 H LYS 124 16.475 -17.084 -11.286
944 HA LYS 124 HA LYS 124 14.607 -18.310 -9.408
945 1HB LYS 124 2HB LYS 124 12.786 -17.861 -11.162
946 2HB LYS 124 1HB LYS 124 13.274 -16.527 -10.130
947 1HG LYS 124 2HG LYS 124 14.604 -15.577 -11.902
948 2HG LYS 124 1HG LYS 124 14.287 -16.976 -12.932
949 1HD LYS 124 2HD LYS 124 11.957 -16.430 -13.064
950 2HD LYS 124 1HD LYS 124 12.135 -15.156 -11.857
951 1HE LYS 124 2HE LYS 124 13.575 -15.140 -14.502
952 2HE LYS 124 1HE LYS 124 11.994 -14.398 -14.266
953 1HZ LYS 124 1HZ LYS 124 13.627 -12.714 -14.018
954 2HZ LYS 124 2HZ LYS 124 14.550 -13.645 -12.946
955 3HZ LYS 124 3HZ LYS 124 13.039 -13.052 -12.462
956 H SER 125 H SER 125 14.267 -20.380 -9.789
957 HA SER 125 HA SER 125 15.305 -21.502 -12.296
958 1HB SER 125 2HB SER 125 16.287 -22.319 -10.129
959 2HB SER 125 1HB SER 125 14.700 -22.963 -9.709
960 HG SER 125 HG SER 125 15.836 -24.622 -10.633
961 H LYS 126 H LYS 126 14.032 -23.760 -12.660
962 HA LYS 126 HA LYS 126 11.164 -23.322 -12.379
963 1HB LYS 126 2HB LYS 126 11.793 -22.174 -14.471
964 2HB LYS 126 1HB LYS 126 12.515 -23.661 -15.069
965 1HG LYS 126 2HG LYS 126 10.325 -24.741 -15.024
966 2HG LYS 126 1HG LYS 126 9.603 -23.245 -14.430
967 1HD LYS 126 2HD LYS 126 9.264 -23.463 -16.826
968 2HD LYS 126 1HD LYS 126 10.326 -22.098 -16.473
969 1HE LYS 126 2HE LYS 126 12.272 -23.454 -17.023
970 2HE LYS 126 1HE LYS 126 11.230 -24.844 -17.332
971 1HZ LYS 126 1HZ LYS 126 10.166 -23.557 -19.118
972 2HZ LYS 126 2HZ LYS 126 11.826 -23.792 -19.398
973 3HZ LYS 126 3HZ LYS 126 11.263 -22.290 -18.851
974 H SER 127 H SER 127 10.319 -25.163 -11.716
975 HA SER 127 HA SER 127 11.716 -27.663 -12.227
976 1HB SER 127 2HB SER 127 9.968 -28.634 -10.709
977 2HB SER 127 1HB SER 127 10.925 -27.354 -9.964
978 HG SER 127 HG SER 127 9.061 -25.962 -10.781
979 H LEU 128 H LEU 128 10.993 -29.264 -13.553
980 HA LEU 128 HA LEU 128 8.348 -29.100 -14.721
981 1HB LEU 128 2HB LEU 128 9.061 -29.044 -17.016
982 2HB LEU 128 1HB LEU 128 9.689 -27.638 -16.186
983 HG LEU 128 HG LEU 128 11.359 -30.097 -16.724
984 1HD1 LEU 128 1HD1 LEU 128 10.564 -29.193 -18.846
985 2HD1 LEU 128 2HD1 LEU 128 12.288 -28.885 -18.628
986 3HD1 LEU 128 3HD1 LEU 128 11.121 -27.586 -18.377
987 1HD2 LEU 128 1HD2 LEU 128 13.227 -28.552 -16.394
988 2HD2 LEU 128 2HD2 LEU 128 12.196 -28.621 -14.964
989 3HD2 LEU 128 3HD2 LEU 128 12.093 -27.243 -16.062
990 H GLU 129 H GLU 129 7.544 -31.053 -14.965
991 HA GLU 129 HA GLU 129 9.322 -33.313 -15.485
992 1HB GLU 129 2HB GLU 129 7.365 -33.219 -13.176
993 2HB GLU 129 1HB GLU 129 8.158 -34.679 -13.746
994 1HG GLU 129 2HG GLU 129 10.339 -33.668 -13.208
995 2HG GLU 129 1HG GLU 129 9.496 -32.260 -12.562
996 H HIS 130 H HIS 130 8.454 -33.580 -17.509
997 HA HIS 130 HA HIS 130 5.581 -34.232 -17.565
998 1HB HIS 130 2HB HIS 130 5.743 -33.682 -20.069
999 2HB HIS 130 1HB HIS 130 5.730 -32.342 -18.936
1000 HD1 HIS 130 1HD HIS 130 7.520 -30.651 -19.226
1001 HD2 HIS 130 2HD HIS 130 8.454 -34.269 -21.071
1002 HE1 HIS 130 1HE HIS 130 9.676 -30.251 -20.470
1003 HE2 HIS 130 2HE HIS 130 10.280 -32.486 -21.476
1004 H HIS 131 H HIS 131 5.845 -36.371 -17.077
1005 HA HIS 131 HA HIS 131 6.881 -37.977 -19.306
1006 1HB HIS 131 2HB HIS 131 8.568 -38.022 -17.495
1007 2HB HIS 131 1HB HIS 131 7.340 -38.607 -16.377
1008 HD1 HIS 131 1HD HIS 131 6.871 -41.090 -16.355
1009 HD2 HIS 131 2HD HIS 131 9.326 -39.926 -19.512
1010 HE1 HIS 131 1HE HIS 131 7.714 -43.226 -17.391
1011 HE2 HIS 131 2HE HIS 131 9.255 -42.503 -19.252
1012 H HIS 132 H HIS 132 5.476 -39.442 -19.988
1013 HA HIS 132 HA HIS 132 3.354 -40.315 -18.146
1014 1HB HIS 132 2HB HIS 132 1.696 -40.220 -19.932
1015 2HB HIS 132 1HB HIS 132 2.413 -38.632 -19.701
1016 HD1 HIS 132 1HD HIS 132 1.722 -41.150 -22.235
1017 HD2 HIS 132 2HD HIS 132 4.341 -37.955 -21.784
1018 HE1 HIS 132 1HE HIS 132 2.579 -40.641 -24.549
1019 HE2 HIS 132 2HE HIS 132 4.025 -38.591 -24.266
1020 H HIS 133 H HIS 133 2.568 -42.451 -18.523
1021 HA HIS 133 HA HIS 133 4.664 -44.066 -19.805
1022 1HB HIS 133 2HB HIS 133 4.179 -45.829 -18.268
1023 2HB HIS 133 1HB HIS 133 4.281 -44.345 -17.336
1024 HD1 HIS 133 1HD HIS 133 2.132 -47.203 -18.005
1025 HD2 HIS 133 2HD HIS 133 1.652 -43.350 -16.510
1026 HE1 HIS 133 1HE HIS 133 -0.093 -47.201 -16.834
1027 HE2 HIS 133 2HE HIS 133 -0.429 -44.828 -16.065
1028 H HIS 134 H HIS 134 4.265 -45.523 -21.315
1029 HA HIS 134 HA HIS 134 3.259 -46.741 -22.916
1030 1HB HIS 134 2HB HIS 134 2.073 -47.577 -20.742
1031 2HB HIS 134 1HB HIS 134 0.676 -46.726 -21.388
1032 HD1 HIS 134 1HD HIS 134 -0.832 -48.307 -22.514
1033 HD2 HIS 134 2HD HIS 134 3.164 -49.340 -23.052
1034 HE1 HIS 134 1HE HIS 134 -0.849 -50.394 -23.929
1035 HE2 HIS 134 2HE HIS 134 1.567 -51.107 -24.067
1036 H HIS 135 H HIS 135 0.139 -45.389 -22.080
1037 HA HIS 135 HA HIS 135 0.354 -43.090 -23.728
1038 1HB HIS 135 2HB HIS 135 -1.195 -43.636 -25.490
1039 2HB HIS 135 1HB HIS 135 0.098 -44.821 -25.509
1040 HD1 HIS 135 1HD HIS 135 -0.550 -47.247 -25.291
1041 HD2 HIS 135 2HD HIS 135 -3.723 -44.647 -24.591
1042 HE1 HIS 135 1HE HIS 135 -2.614 -48.691 -25.203
1043 HE2 HIS 135 2HE HIS 135 -4.533 -47.077 -24.958
Start of MODEL 20
1 1H MET 1 1HT MET 1 21.295 37.361 -12.349
2 2H MET 1 2HT MET 1 20.506 37.206 -13.840
3 3H MET 1 3HT MET 1 22.161 36.858 -13.715
4 HA MET 1 HA MET 1 20.800 34.856 -13.843
5 1HB MET 1 2HB MET 1 22.969 34.820 -12.661
6 2HB MET 1 1HB MET 1 22.162 35.277 -11.167
7 1HG MET 1 2HG MET 1 22.639 32.902 -11.205
8 2HG MET 1 1HG MET 1 20.900 33.191 -11.197
9 1HE MET 1 1HE MET 1 20.511 30.666 -11.912
10 2HE MET 1 2HE MET 1 22.251 30.378 -11.959
11 3HE MET 1 3HE MET 1 21.244 29.922 -13.333
12 H ILE 2 H ILE 2 18.622 34.745 -13.776
13 HA ILE 2 HA ILE 2 17.239 35.380 -11.281
14 HB ILE 2 HB ILE 2 15.156 35.138 -12.476
15 1HG1 ILE 2 2HG1 ILE 2 15.899 33.265 -13.985
16 2HG1 ILE 2 1HG1 ILE 2 14.943 34.512 -14.776
17 1HG2 ILE 2 1HG2 ILE 2 17.147 36.781 -14.018
18 2HG2 ILE 2 2HG2 ILE 2 16.217 37.286 -12.607
19 3HG2 ILE 2 3HG2 ILE 2 15.395 36.944 -14.129
20 1HD1 ILE 2 1HD1 ILE 2 17.943 34.227 -14.923
21 2HD1 ILE 2 2HD1 ILE 2 16.973 35.453 -15.740
22 3HD1 ILE 2 3HD1 ILE 2 16.787 33.754 -16.169
23 H MET 3 H MET 3 15.344 33.785 -10.807
24 HA MET 3 HA MET 3 16.607 31.184 -10.477
25 1HB MET 3 2HB MET 3 15.558 32.270 -8.526
26 2HB MET 3 1HB MET 3 14.004 32.230 -9.347
27 1HG MET 3 2HG MET 3 14.012 29.812 -9.321
28 2HG MET 3 1HG MET 3 15.621 29.804 -8.604
29 1HE MET 3 1HE MET 3 13.334 28.489 -5.708
30 2HE MET 3 2HE MET 3 14.794 28.191 -6.651
31 3HE MET 3 3HE MET 3 13.215 28.161 -7.437
32 H VAL 4 H VAL 4 16.391 29.816 -12.095
33 HA VAL 4 HA VAL 4 13.722 29.493 -13.300
34 HB VAL 4 HB VAL 4 14.849 28.536 -15.287
35 1HG1 VAL 4 1HG1 VAL 4 15.698 30.643 -16.197
36 2HG1 VAL 4 2HG1 VAL 4 15.778 31.314 -14.569
37 3HG1 VAL 4 3HG1 VAL 4 14.218 30.893 -15.272
38 1HG2 VAL 4 1HG2 VAL 4 17.260 28.834 -15.581
39 2HG2 VAL 4 2HG2 VAL 4 16.906 27.780 -14.213
40 3HG2 VAL 4 3HG2 VAL 4 17.384 29.454 -13.937
41 H SER 5 H SER 5 13.430 27.196 -14.182
42 HA SER 5 HA SER 5 14.360 25.333 -12.115
43 1HB SER 5 2HB SER 5 12.372 23.938 -12.897
44 2HB SER 5 1HB SER 5 11.985 25.446 -12.067
45 HG SER 5 HG SER 5 11.184 24.678 -14.453
46 H GLY 6 H GLY 6 15.747 23.792 -12.651
47 1HA GLY 6 2HA GLY 6 16.513 23.443 -15.426
48 2HA GLY 6 1HA GLY 6 17.241 22.657 -14.029
49 H CYS 7 H CYS 7 14.355 21.969 -13.227
50 HA CYS 7 HA CYS 7 14.301 19.415 -14.546
51 1HB CYS 7 2HB CYS 7 12.144 19.213 -13.102
52 2HB CYS 7 1HB CYS 7 13.717 19.219 -12.310
53 HG CYS 7 HG CYS 7 13.246 21.204 -10.762
54 H GLN 8 H GLN 8 14.028 20.357 -16.675
55 HA GLN 8 HA GLN 8 11.180 20.553 -17.350
56 1HB GLN 8 2HB GLN 8 11.964 22.847 -17.397
57 2HB GLN 8 1HB GLN 8 13.369 22.391 -18.351
58 1HG GLN 8 2HG GLN 8 11.697 21.611 -20.117
59 2HG GLN 8 1HG GLN 8 10.495 22.513 -19.197
60 1HE2 GLN 8 1HE2 GLN 8 10.560 24.744 -19.185
61 2HE2 GLN 8 2HE2 GLN 8 11.558 25.647 -20.279
62 H GLN 9 H GLN 9 10.667 19.195 -18.948
63 HA GLN 9 HA GLN 9 10.824 17.672 -20.627
64 1HB GLN 9 2HB GLN 9 11.762 19.884 -21.678
65 2HB GLN 9 1HB GLN 9 13.303 19.040 -21.624
66 1HG GLN 9 2HG GLN 9 12.320 18.780 -23.799
67 2HG GLN 9 1HG GLN 9 12.318 17.223 -22.970
68 1HE2 GLN 9 1HE2 GLN 9 10.376 16.307 -22.343
69 2HE2 GLN 9 2HE2 GLN 9 8.840 16.896 -22.904
70 H GLN 10 H GLN 10 11.975 16.999 -18.214
71 HA GLN 10 HA GLN 10 14.638 16.049 -18.428
72 1HB GLN 10 2HB GLN 10 13.959 14.752 -16.319
73 2HB GLN 10 1HB GLN 10 13.929 16.508 -16.254
74 1HG GLN 10 2HG GLN 10 11.500 16.461 -16.638
75 2HG GLN 10 1HG GLN 10 11.552 14.701 -16.630
76 1HE2 GLN 10 1HE2 GLN 10 13.569 16.582 -14.509
77 2HE2 GLN 10 2HE2 GLN 10 12.737 16.187 -13.047
78 H LYS 11 H LYS 11 15.388 13.901 -18.509
79 HA LYS 11 HA LYS 11 13.829 12.250 -20.305
80 1HB LYS 11 2HB LYS 11 16.604 11.851 -19.170
81 2HB LYS 11 1HB LYS 11 15.868 10.869 -20.433
82 1HG LYS 11 2HG LYS 11 15.736 12.846 -21.879
83 2HG LYS 11 1HG LYS 11 16.508 13.809 -20.619
84 1HD LYS 11 2HD LYS 11 17.733 11.403 -21.970
85 2HD LYS 11 1HD LYS 11 18.088 13.084 -22.370
86 1HE LYS 11 2HE LYS 11 18.516 11.839 -19.658
87 2HE LYS 11 1HE LYS 11 19.772 12.019 -20.879
88 1HZ LYS 11 1HZ LYS 11 18.237 14.298 -19.758
89 2HZ LYS 11 2HZ LYS 11 19.622 14.372 -20.731
90 3HZ LYS 11 3HZ LYS 11 19.730 13.784 -19.147
91 H GLU 12 H GLU 12 14.013 12.564 -17.033
92 HA GLU 12 HA GLU 12 12.922 9.859 -16.648
93 1HB GLU 12 2HB GLU 12 15.145 10.059 -15.573
94 2HB GLU 12 1HB GLU 12 14.571 11.455 -14.673
95 1HG GLU 12 2HG GLU 12 14.510 9.615 -13.201
96 2HG GLU 12 1HG GLU 12 12.840 9.967 -13.641
97 H GLU 13 H GLU 13 10.818 10.012 -16.143
98 HA GLU 13 HA GLU 13 9.576 12.455 -15.528
99 1HB GLU 13 2HB GLU 13 8.605 9.603 -15.402
100 2HB GLU 13 1HB GLU 13 7.586 10.998 -15.166
101 1HG GLU 13 2HG GLU 13 9.139 10.480 -17.677
102 2HG GLU 13 1HG GLU 13 7.459 10.004 -17.435
103 H THR 14 H THR 14 8.700 13.145 -13.653
104 HA THR 14 HA THR 14 9.625 11.824 -11.197
105 HB THR 14 HB THR 14 8.695 14.689 -11.512
106 HG1 THR 14 1HG THR 14 10.693 14.303 -12.604
107 1HG2 THR 14 1HG2 THR 14 8.420 13.786 -9.242
108 2HG2 THR 14 2HG2 THR 14 9.698 15.002 -9.297
109 3HG2 THR 14 3HG2 THR 14 10.113 13.289 -9.239
110 HA PRO 15 HA PRO 15 5.132 11.081 -10.984
111 1HB PRO 15 2HB PRO 15 5.727 8.544 -9.786
112 2HB PRO 15 1HB PRO 15 5.098 8.856 -11.403
113 1HG PRO 15 2HG PRO 15 7.590 7.814 -10.885
114 2HG PRO 15 1HG PRO 15 7.165 8.688 -12.367
115 1HD PRO 15 2HD PRO 15 8.578 9.687 -9.916
116 2HD PRO 15 1HD PRO 15 8.928 10.014 -11.630
117 H PHE 16 H PHE 16 4.046 11.887 -9.321
118 HA PHE 16 HA PHE 16 5.346 12.481 -6.876
119 1HB PHE 16 2HB PHE 16 3.308 13.584 -6.238
120 2HB PHE 16 1HB PHE 16 3.585 13.903 -7.946
121 HD1 PHE 16 1HD PHE 16 2.249 12.633 -9.651
122 HD2 PHE 16 2HD PHE 16 1.353 12.512 -5.493
123 HE1 PHE 16 1HE PHE 16 -0.002 11.781 -10.163
124 HE2 PHE 16 2HE PHE 16 -0.898 11.668 -5.997
125 HZ PHE 16 HZ PHE 16 -1.577 11.290 -8.332
126 H TYR 17 H TYR 17 3.851 9.642 -7.866
127 HA TYR 17 HA TYR 17 3.126 8.912 -5.121
128 1HB TYR 17 2HB TYR 17 1.574 7.356 -6.050
129 2HB TYR 17 1HB TYR 17 1.320 8.886 -6.865
130 HD1 TYR 17 1HD TYR 17 2.594 9.156 -9.158
131 HD2 TYR 17 2HD TYR 17 1.769 5.418 -7.298
132 HE1 TYR 17 1HE TYR 17 2.839 8.027 -11.327
133 HE2 TYR 17 2HE TYR 17 2.020 4.279 -9.461
134 HH TYR 17 HH TYR 17 3.418 5.717 -12.144
135 H TYR 18 H TYR 18 5.656 8.595 -7.130
136 HA TYR 18 HA TYR 18 5.921 5.682 -6.940
137 1HB TYR 18 2HB TYR 18 6.119 6.802 -9.139
138 2HB TYR 18 1HB TYR 18 7.534 7.659 -8.555
139 HD1 TYR 18 2HD TYR 18 6.195 4.382 -9.557
140 HD2 TYR 18 1HD TYR 18 9.668 6.568 -8.432
141 HE1 TYR 18 2HE TYR 18 7.609 2.538 -10.361
142 HE2 TYR 18 1HE TYR 18 11.092 4.738 -9.245
143 HH TYR 18 HH TYR 18 10.946 2.332 -9.696
144 H GLY 19 H GLY 19 7.246 4.771 -5.572
145 1HA GLY 19 2HA GLY 19 9.713 4.925 -4.871
146 2HA GLY 19 1HA GLY 19 9.209 6.453 -4.166
147 H THR 20 H THR 20 10.000 5.509 -2.167
148 HA THR 20 HA THR 20 8.215 3.513 -0.968
149 HB THR 20 HB THR 20 10.808 4.631 0.121
150 HG1 THR 20 1HG THR 20 10.378 2.098 -1.126
151 1HG2 THR 20 1HG2 THR 20 9.371 3.701 1.850
152 2HG2 THR 20 2HG2 THR 20 10.747 2.635 1.567
153 3HG2 THR 20 3HG2 THR 20 9.164 2.224 0.908
154 H TRP 21 H TRP 21 6.662 4.146 0.380
155 HA TRP 21 HA TRP 21 6.726 6.922 1.327
156 1HB TRP 21 2HB TRP 21 4.414 5.029 0.896
157 2HB TRP 21 1HB TRP 21 4.256 6.623 1.629
158 HD1 TRP 21 HD TRP 21 4.648 4.899 -1.714
159 HE1 TRP 21 1HE TRP 21 4.480 6.651 -3.594
160 HE3 TRP 21 3HE TRP 21 4.788 9.144 1.125
161 HZ2 TRP 21 2HZ TRP 21 4.428 9.459 -3.831
162 HZ3 TRP 21 3HZ TRP 21 4.678 11.325 -0.008
163 HH2 TRP 21 HH TRP 21 4.502 11.474 -2.436
164 H ASP 22 H ASP 22 6.534 7.465 3.374
165 HA ASP 22 HA ASP 22 7.018 5.521 5.428
166 1HB ASP 22 2HB ASP 22 8.170 7.562 5.681
167 2HB ASP 22 1HB ASP 22 6.722 8.512 5.381
168 H GLU 23 H GLU 23 5.575 4.462 6.491
169 HA GLU 23 HA GLU 23 2.827 5.339 6.651
170 1HB GLU 23 2HB GLU 23 4.301 2.838 7.416
171 2HB GLU 23 1HB GLU 23 2.703 3.159 8.077
172 1HG GLU 23 2HG GLU 23 3.164 3.275 5.130
173 2HG GLU 23 1HG GLU 23 2.946 1.726 5.943
174 H GLY 24 H GLY 24 3.291 7.228 7.838
175 1HA GLY 24 2HA GLY 24 4.284 7.590 10.341
176 2HA GLY 24 1HA GLY 24 2.768 8.322 9.827
177 H ARG 25 H ARG 25 1.184 6.060 9.585
178 HA ARG 25 HA ARG 25 1.578 4.415 11.968
179 1HB ARG 25 2HB ARG 25 -0.201 6.036 12.516
180 2HB ARG 25 1HB ARG 25 -1.089 5.556 11.080
181 1HG ARG 25 2HG ARG 25 -1.292 3.281 12.023
182 2HG ARG 25 1HG ARG 25 -0.489 3.851 13.488
183 1HD ARG 25 2HD ARG 25 -3.095 4.872 12.367
184 2HD ARG 25 1HD ARG 25 -2.904 3.834 13.779
185 HE ARG 25 HE ARG 25 -1.469 5.884 14.578
186 1HH1 ARG 25 1HH1 ARG 25 -4.529 5.934 12.856
187 2HH1 ARG 25 2HH1 ARG 25 -5.029 7.456 13.537
188 1HH2 ARG 25 1HH2 ARG 25 -2.136 7.879 15.469
189 2HH2 ARG 25 2HH2 ARG 25 -3.655 8.569 14.992
190 H ALA 26 H ALA 26 0.989 2.239 11.564
191 HA ALA 26 HA ALA 26 0.388 1.730 8.723
192 1HB ALA 26 1HB ALA 26 2.136 0.029 8.654
193 2HB ALA 26 2HB ALA 26 2.580 0.419 10.315
194 3HB ALA 26 3HB ALA 26 2.799 1.617 9.041
195 HA PRO 27 HA PRO 27 -1.851 -1.787 10.382
196 1HB PRO 27 2HB PRO 27 -3.125 -2.306 8.008
197 2HB PRO 27 1HB PRO 27 -3.670 -1.102 9.178
198 1HG PRO 27 2HG PRO 27 -2.609 -0.674 6.535
199 2HG PRO 27 1HG PRO 27 -3.216 0.530 7.680
200 1HD PRO 27 2HD PRO 27 -0.433 -0.268 7.097
201 2HD PRO 27 1HD PRO 27 -1.054 1.232 7.820
202 H GLY 28 H GLY 28 -1.442 -3.990 10.282
203 1HA GLY 28 2HA GLY 28 -0.631 -5.382 8.026
204 2HA GLY 28 1HA GLY 28 0.817 -4.849 8.850
205 HA PRO 29 HA PRO 29 0.059 -9.166 10.297
206 1HB PRO 29 2HB PRO 29 2.886 -8.565 10.973
207 2HB PRO 29 1HB PRO 29 2.187 -9.998 10.215
208 1HG PRO 29 2HG PRO 29 3.547 -8.128 8.822
209 2HG PRO 29 1HG PRO 29 2.227 -9.079 8.124
210 1HD PRO 29 2HD PRO 29 2.276 -6.223 8.881
211 2HD PRO 29 1HD PRO 29 1.225 -7.080 7.745
212 H THR 30 H THR 30 0.330 -10.113 12.370
213 HA THR 30 HA THR 30 -0.012 -8.202 14.541
214 HB THR 30 HB THR 30 -0.447 -10.475 15.775
215 HG1 THR 30 1HG THR 30 0.307 -11.544 13.667
216 1HG2 THR 30 1HG2 THR 30 -2.809 -10.404 15.023
217 2HG2 THR 30 2HG2 THR 30 -2.330 -9.334 13.703
218 3HG2 THR 30 3HG2 THR 30 -2.168 -8.799 15.374
219 H ASP 31 H ASP 31 2.612 -9.219 13.199
220 HA ASP 31 HA ASP 31 4.124 -10.611 15.109
221 1HB ASP 31 2HB ASP 31 4.976 -8.703 12.921
222 2HB ASP 31 1HB ASP 31 6.109 -9.637 13.892
223 H GLY 32 H GLY 32 3.251 -7.275 14.852
224 1HA GLY 32 2HA GLY 32 3.402 -5.831 16.786
225 2HA GLY 32 1HA GLY 32 4.877 -6.676 17.239
226 H VAL 33 H VAL 33 3.604 -4.962 14.412
227 HA VAL 33 HA VAL 33 6.278 -3.929 13.848
228 HB VAL 33 HB VAL 33 3.830 -3.464 12.164
229 1HG1 VAL 33 1HG1 VAL 33 6.755 -3.658 11.513
230 2HG1 VAL 33 2HG1 VAL 33 5.783 -2.188 11.577
231 3HG1 VAL 33 3HG1 VAL 33 5.462 -3.405 10.341
232 1HG2 VAL 33 1HG2 VAL 33 4.355 -5.493 10.905
233 2HG2 VAL 33 2HG2 VAL 33 3.932 -5.863 12.577
234 3HG2 VAL 33 3HG2 VAL 33 5.618 -5.887 12.067
235 H LYS 34 H LYS 34 6.814 -1.808 14.140
236 HA LYS 34 HA LYS 34 4.788 -0.124 15.369
237 1HB LYS 34 2HB LYS 34 7.786 0.091 15.231
238 2HB LYS 34 1HB LYS 34 6.762 1.335 15.920
239 1HG LYS 34 2HG LYS 34 5.875 -0.404 17.501
240 2HG LYS 34 1HG LYS 34 7.140 -1.475 16.900
241 1HD LYS 34 2HD LYS 34 7.623 1.229 18.150
242 2HD LYS 34 1HD LYS 34 7.758 -0.309 19.000
243 1HE LYS 34 2HE LYS 34 9.535 -1.008 17.495
244 2HE LYS 34 1HE LYS 34 9.382 0.496 16.586
245 1HZ LYS 34 1HZ LYS 34 10.057 0.407 19.475
246 2HZ LYS 34 2HZ LYS 34 10.169 1.733 18.426
247 3HZ LYS 34 3HZ LYS 34 11.232 0.425 18.254
248 H SER 35 H SER 35 6.549 -0.442 12.435
249 HA SER 35 HA SER 35 5.127 1.775 11.279
250 1HB SER 35 2HB SER 35 8.157 1.874 11.306
251 2HB SER 35 1HB SER 35 7.078 3.034 10.540
252 HG SER 35 HG SER 35 6.288 2.955 13.012
253 H ALA 36 H ALA 36 5.571 1.866 8.906
254 HA ALA 36 HA ALA 36 6.948 -0.442 7.817
255 1HB ALA 36 1HB ALA 36 4.025 0.022 7.222
256 2HB ALA 36 2HB ALA 36 4.670 -1.274 8.229
257 3HB ALA 36 3HB ALA 36 5.059 -1.219 6.510
258 H THR 37 H THR 37 7.015 -0.333 5.432
259 HA THR 37 HA THR 37 6.620 2.377 4.398
260 HB THR 37 HB THR 37 8.786 1.912 3.040
261 HG1 THR 37 1HG THR 37 10.069 0.676 4.977
262 1HG2 THR 37 1HG2 THR 37 8.899 2.574 5.986
263 2HG2 THR 37 2HG2 THR 37 8.578 3.708 4.673
264 3HG2 THR 37 3HG2 THR 37 10.160 2.939 4.809
265 H VAL 38 H VAL 38 5.684 2.428 2.436
266 HA VAL 38 HA VAL 38 5.350 -0.164 1.086
267 HB VAL 38 HB VAL 38 3.214 0.696 1.855
268 1HG1 VAL 38 1HG1 VAL 38 2.295 2.819 1.003
269 2HG1 VAL 38 2HG1 VAL 38 3.850 3.169 0.246
270 3HG1 VAL 38 3HG1 VAL 38 3.730 3.060 2.002
271 1HG2 VAL 38 1HG2 VAL 38 1.999 0.737 -0.278
272 2HG2 VAL 38 2HG2 VAL 38 3.237 -0.518 -0.247
273 3HG2 VAL 38 3HG2 VAL 38 3.525 0.980 -1.131
274 H THR 39 H THR 39 6.336 -0.399 -0.755
275 HA THR 39 HA THR 39 7.333 2.006 -2.124
276 HB THR 39 HB THR 39 8.416 -0.821 -2.262
277 HG1 THR 39 1HG THR 39 9.033 -0.096 -0.297
278 1HG2 THR 39 1HG2 THR 39 9.526 1.783 -3.328
279 2HG2 THR 39 2HG2 THR 39 8.849 0.472 -4.297
280 3HG2 THR 39 3HG2 THR 39 10.336 0.218 -3.384
281 H PHE 40 H PHE 40 6.492 2.454 -4.054
282 HA PHE 40 HA PHE 40 5.001 0.346 -5.450
283 1HB PHE 40 2HB PHE 40 5.022 3.350 -5.845
284 2HB PHE 40 1HB PHE 40 4.089 2.224 -6.822
285 HD1 PHE 40 1HD PHE 40 2.283 0.878 -5.723
286 HD2 PHE 40 2HD PHE 40 4.220 4.133 -3.782
287 HE1 PHE 40 1HE PHE 40 0.417 1.033 -4.126
288 HE2 PHE 40 2HE PHE 40 2.358 4.294 -2.186
289 HZ PHE 40 HZ PHE 40 0.454 2.741 -2.353
290 H THR 41 H THR 41 5.974 -0.679 -7.008
291 HA THR 41 HA THR 41 8.391 0.485 -8.191
292 HB THR 41 HB THR 41 7.555 -2.375 -8.592
293 HG1 THR 41 1HG THR 41 7.804 -1.307 -6.207
294 1HG2 THR 41 1HG2 THR 41 10.201 -0.934 -8.344
295 2HG2 THR 41 2HG2 THR 41 9.526 -1.684 -9.791
296 3HG2 THR 41 3HG2 THR 41 10.047 -2.686 -8.439
297 H GLU 42 H GLU 42 8.684 -0.357 -10.564
298 HA GLU 42 HA GLU 42 6.965 1.015 -12.188
299 1HB GLU 42 2HB GLU 42 9.256 0.162 -12.746
300 2HB GLU 42 1HB GLU 42 8.543 -1.417 -13.022
301 1HG GLU 42 2HG GLU 42 7.232 -0.571 -14.846
302 2HG GLU 42 1HG GLU 42 7.771 1.075 -14.518
303 H ASP 43 H ASP 43 6.778 -2.437 -11.327
304 HA ASP 43 HA ASP 43 4.053 -2.411 -12.427
305 1HB ASP 43 2HB ASP 43 5.692 -3.475 -14.041
306 2HB ASP 43 1HB ASP 43 5.920 -4.746 -12.846
307 H GLU 44 H GLU 44 5.839 -2.866 -9.719
308 HA GLU 44 HA GLU 44 3.977 -4.899 -8.675
309 1HB GLU 44 2HB GLU 44 6.863 -4.603 -7.836
310 2HB GLU 44 1HB GLU 44 5.721 -5.805 -7.258
311 1HG GLU 44 2HG GLU 44 7.000 -6.992 -8.756
312 2HG GLU 44 1HG GLU 44 5.594 -6.547 -9.721
313 H VAL 45 H VAL 45 3.286 -4.684 -6.557
314 HA VAL 45 HA VAL 45 4.023 -2.178 -5.176
315 HB VAL 45 HB VAL 45 1.676 -4.029 -4.649
316 1HG1 VAL 45 1HG1 VAL 45 2.376 -1.366 -3.410
317 2HG1 VAL 45 2HG1 VAL 45 2.454 -2.940 -2.614
318 3HG1 VAL 45 3HG1 VAL 45 0.896 -2.283 -3.119
319 1HG2 VAL 45 1HG2 VAL 45 0.291 -2.193 -5.513
320 2HG2 VAL 45 2HG2 VAL 45 1.416 -2.784 -6.732
321 3HG2 VAL 45 3HG2 VAL 45 1.750 -1.274 -5.887
322 H VAL 46 H VAL 46 5.465 -2.385 -3.566
323 HA VAL 46 HA VAL 46 5.757 -5.046 -2.329
324 HB VAL 46 HB VAL 46 7.928 -2.982 -2.694
325 1HG1 VAL 46 1HG1 VAL 46 8.271 -4.384 -0.744
326 2HG1 VAL 46 2HG1 VAL 46 9.436 -4.784 -2.005
327 3HG1 VAL 46 3HG1 VAL 46 8.047 -5.832 -1.725
328 1HG2 VAL 46 1HG2 VAL 46 7.275 -3.891 -4.847
329 2HG2 VAL 46 2HG2 VAL 46 7.429 -5.533 -4.223
330 3HG2 VAL 46 3HG2 VAL 46 8.857 -4.507 -4.375
331 H GLU 47 H GLU 47 5.273 -5.131 -0.249
332 HA GLU 47 HA GLU 47 5.300 -2.666 1.322
333 1HB GLU 47 2HB GLU 47 3.936 -5.292 1.599
334 2HB GLU 47 1HB GLU 47 4.305 -4.396 3.065
335 1HG GLU 47 2HG GLU 47 3.028 -2.530 2.332
336 2HG GLU 47 1HG GLU 47 2.812 -3.241 0.740
337 H THR 48 H THR 48 6.550 -2.351 3.021
338 HA THR 48 HA THR 48 8.484 -4.469 3.724
339 HB THR 48 HB THR 48 9.279 -1.615 4.103
340 HG1 THR 48 1HG THR 48 8.364 -2.114 1.833
341 1HG2 THR 48 1HG2 THR 48 11.485 -2.517 3.568
342 2HG2 THR 48 2HG2 THR 48 10.766 -4.078 3.175
343 3HG2 THR 48 3HG2 THR 48 10.715 -3.479 4.832
344 H GLU 49 H GLU 49 8.720 -4.858 5.869
345 HA GLU 49 HA GLU 49 6.983 -3.355 7.694
346 1HB GLU 49 2HB GLU 49 8.595 -5.832 8.311
347 2HB GLU 49 1HB GLU 49 7.271 -5.169 9.246
348 1HG GLU 49 2HG GLU 49 5.677 -5.868 7.643
349 2HG GLU 49 1HG GLU 49 6.937 -6.287 6.480
350 H VAL 50 H VAL 50 7.868 -1.906 9.102
351 HA VAL 50 HA VAL 50 10.766 -2.099 9.556
352 HB VAL 50 HB VAL 50 8.859 0.092 10.431
353 1HG1 VAL 50 1HG1 VAL 50 11.874 0.003 10.410
354 2HG1 VAL 50 2HG1 VAL 50 10.841 -0.079 11.834
355 3HG1 VAL 50 3HG1 VAL 50 10.885 1.390 10.864
356 1HG2 VAL 50 1HG2 VAL 50 9.002 0.023 8.008
357 2HG2 VAL 50 2HG2 VAL 50 10.764 0.042 8.093
358 3HG2 VAL 50 3HG2 VAL 50 9.839 1.442 8.634
359 H MET 51 H MET 51 11.226 -3.443 11.161
360 HA MET 51 HA MET 51 9.378 -3.562 13.435
361 1HB MET 51 2HB MET 51 8.994 -5.354 11.632
362 2HB MET 51 1HB MET 51 10.523 -6.033 12.158
363 1HG MET 51 2HG MET 51 8.266 -5.551 14.066
364 2HG MET 51 1HG MET 51 8.387 -7.026 13.114
365 1HE MET 51 1HE MET 51 8.359 -8.512 15.249
366 2HE MET 51 2HE MET 51 8.192 -7.072 16.258
367 3HE MET 51 3HE MET 51 9.423 -8.277 16.637
368 H GLU 52 H GLU 52 10.296 -3.776 15.338
369 HA GLU 52 HA GLU 52 13.136 -3.366 15.482
370 1HB GLU 52 2HB GLU 52 11.415 -2.120 16.827
371 2HB GLU 52 1HB GLU 52 11.139 -3.599 17.732
372 1HG GLU 52 2HG GLU 52 13.267 -3.531 18.703
373 2HG GLU 52 1HG GLU 52 13.847 -2.330 17.545
374 H GLY 53 H GLY 53 14.045 -5.303 14.864
375 1HA GLY 53 2HA GLY 53 14.844 -7.206 16.540
376 2HA GLY 53 1HA GLY 53 13.213 -7.760 16.185
377 H ARG 54 H ARG 54 12.851 -7.340 13.595
378 HA ARG 54 HA ARG 54 14.823 -9.088 12.359
379 1HB ARG 54 2HB ARG 54 13.180 -9.376 10.568
380 2HB ARG 54 1HB ARG 54 12.499 -9.745 12.142
381 1HG ARG 54 2HG ARG 54 11.469 -7.525 12.191
382 2HG ARG 54 1HG ARG 54 12.085 -7.222 10.568
383 1HD ARG 54 2HD ARG 54 9.768 -7.926 10.447
384 2HD ARG 54 1HD ARG 54 10.809 -9.163 9.744
385 HE ARG 54 HE ARG 54 10.536 -9.973 12.317
386 1HH1 ARG 54 1HH1 ARG 54 8.219 -9.102 9.806
387 2HH1 ARG 54 2HH1 ARG 54 6.990 -10.163 10.422
388 1HH2 ARG 54 1HH2 ARG 54 8.917 -11.361 13.100
389 2HH2 ARG 54 2HH2 ARG 54 7.374 -11.443 12.302
390 H GLY 55 H GLY 55 13.563 -5.862 12.173
391 1HA GLY 55 2HA GLY 55 14.699 -4.032 11.186
392 2HA GLY 55 1HA GLY 55 15.593 -5.167 10.176
393 H GLU 56 H GLU 56 14.735 -3.293 8.628
394 HA GLU 56 HA GLU 56 12.085 -3.560 7.732
395 1HB GLU 56 2HB GLU 56 14.577 -2.574 6.362
396 2HB GLU 56 1HB GLU 56 12.977 -2.500 5.643
397 1HG GLU 56 2HG GLU 56 13.254 -0.419 6.536
398 2HG GLU 56 1HG GLU 56 12.296 -1.234 7.753
399 H VAL 57 H VAL 57 11.189 -5.144 6.852
400 HA VAL 57 HA VAL 57 12.770 -7.010 5.203
401 HB VAL 57 HB VAL 57 10.581 -7.663 7.176
402 1HG1 VAL 57 1HG1 VAL 57 10.368 -9.052 5.168
403 2HG1 VAL 57 2HG1 VAL 57 10.928 -10.004 6.544
404 3HG1 VAL 57 3HG1 VAL 57 12.069 -9.500 5.298
405 1HG2 VAL 57 1HG2 VAL 57 13.495 -8.450 7.095
406 2HG2 VAL 57 2HG2 VAL 57 12.315 -8.990 8.289
407 3HG2 VAL 57 3HG2 VAL 57 12.767 -7.287 8.202
408 H GLN 58 H GLN 58 12.023 -7.331 3.216
409 HA GLN 58 HA GLN 58 9.659 -5.998 2.331
410 1HB GLN 58 2HB GLN 58 11.580 -7.826 0.885
411 2HB GLN 58 1HB GLN 58 10.326 -6.866 0.126
412 1HG GLN 58 2HG GLN 58 11.418 -4.818 0.918
413 2HG GLN 58 1HG GLN 58 12.692 -5.794 1.642
414 1HE2 GLN 58 1HE2 GLN 58 12.803 -3.744 -0.464
415 2HE2 GLN 58 2HE2 GLN 58 13.563 -4.509 -1.815
416 H LEU 59 H LEU 59 7.705 -6.823 2.019
417 HA LEU 59 HA LEU 59 7.232 -9.650 2.528
418 1HB LEU 59 2HB LEU 59 5.349 -7.336 2.033
419 2HB LEU 59 1HB LEU 59 4.826 -8.980 2.348
420 HG LEU 59 HG LEU 59 6.389 -7.250 4.267
421 1HD1 LEU 59 1HD1 LEU 59 3.490 -8.079 4.274
422 2HD1 LEU 59 2HD1 LEU 59 4.104 -6.455 3.960
423 3HD1 LEU 59 3HD1 LEU 59 4.310 -7.185 5.553
424 1HD2 LEU 59 1HD2 LEU 59 5.159 -9.984 4.610
425 2HD2 LEU 59 2HD2 LEU 59 5.917 -9.029 5.883
426 3HD2 LEU 59 3HD2 LEU 59 6.885 -9.623 4.535
427 HA PRO 60 HA PRO 60 6.674 -11.177 -1.609
428 1HB PRO 60 2HB PRO 60 3.781 -11.502 -0.967
429 2HB PRO 60 1HB PRO 60 4.916 -12.664 -1.660
430 1HG PRO 60 2HG PRO 60 4.161 -12.797 0.909
431 2HG PRO 60 1HG PRO 60 5.799 -13.233 0.393
432 1HD PRO 60 2HD PRO 60 4.858 -10.852 1.877
433 2HD PRO 60 1HD PRO 60 6.453 -11.627 1.873
434 H PHE 61 H PHE 61 6.637 -9.872 -3.331
435 HA PHE 61 HA PHE 61 5.189 -7.424 -3.300
436 1HB PHE 61 2HB PHE 61 6.127 -7.035 -5.537
437 2HB PHE 61 1HB PHE 61 7.364 -7.543 -4.396
438 HD1 PHE 61 1HD PHE 61 5.450 -8.462 -7.373
439 HD2 PHE 61 2HD PHE 61 8.474 -9.672 -4.635
440 HE1 PHE 61 1HE PHE 61 6.154 -10.226 -8.932
441 HE2 PHE 61 2HE PHE 61 9.181 -11.441 -6.192
442 HZ PHE 61 HZ PHE 61 8.021 -11.720 -8.341
443 H MET 62 H MET 62 3.444 -6.770 -4.432
444 HA MET 62 HA MET 62 1.812 -8.933 -5.588
445 1HB MET 62 2HB MET 62 1.084 -6.373 -4.188
446 2HB MET 62 1HB MET 62 -0.083 -7.240 -5.173
447 1HG MET 62 2HG MET 62 0.208 -9.221 -3.745
448 2HG MET 62 1HG MET 62 1.357 -8.324 -2.754
449 1HE MET 62 1HE MET 62 0.737 -6.311 -1.207
450 2HE MET 62 2HE MET 62 -0.878 -5.612 -1.077
451 3HE MET 62 3HE MET 62 0.050 -5.421 -2.567
452 H ALA 63 H ALA 63 0.751 -8.619 -7.537
453 HA ALA 63 HA ALA 63 1.899 -6.621 -9.294
454 1HB ALA 63 1HB ALA 63 0.643 -7.782 -11.057
455 2HB ALA 63 2HB ALA 63 -0.127 -8.795 -9.836
456 3HB ALA 63 3HB ALA 63 1.611 -8.910 -10.108
457 H TYR 64 H TYR 64 0.683 -5.023 -10.378
458 HA TYR 64 HA TYR 64 -2.074 -4.620 -9.529
459 1HB TYR 64 2HB TYR 64 -1.779 -2.454 -8.646
460 2HB TYR 64 1HB TYR 64 -0.490 -3.406 -7.921
461 HD1 TYR 64 1HD TYR 64 1.860 -3.105 -8.716
462 HD2 TYR 64 2HD TYR 64 -1.302 -0.604 -10.073
463 HE1 TYR 64 1HE TYR 64 3.506 -1.456 -9.507
464 HE2 TYR 64 2HE TYR 64 0.336 1.041 -10.876
465 HH TYR 64 HH TYR 64 3.756 0.364 -10.933
466 H LYS 65 H LYS 65 -3.240 -3.159 -10.853
467 HA LYS 65 HA LYS 65 -1.853 -2.315 -13.302
468 1HB LYS 65 2HB LYS 65 -4.539 -3.666 -13.095
469 2HB LYS 65 1HB LYS 65 -4.037 -2.753 -14.512
470 1HG LYS 65 2HG LYS 65 -2.093 -4.244 -14.747
471 2HG LYS 65 1HG LYS 65 -2.686 -5.181 -13.382
472 1HD LYS 65 2HD LYS 65 -3.315 -6.248 -15.467
473 2HD LYS 65 1HD LYS 65 -4.751 -5.656 -14.630
474 1HE LYS 65 2HE LYS 65 -4.887 -3.753 -16.079
475 2HE LYS 65 1HE LYS 65 -3.340 -4.146 -16.823
476 1HZ LYS 65 1HZ LYS 65 -5.775 -5.841 -16.978
477 2HZ LYS 65 2HZ LYS 65 -4.298 -6.126 -17.762
478 3HZ LYS 65 3HZ LYS 65 -5.246 -4.787 -18.200
479 H VAL 66 H VAL 66 -2.834 -0.568 -14.392
480 HA VAL 66 HA VAL 66 -3.863 1.362 -12.449
481 HB VAL 66 HB VAL 66 -2.620 1.757 -15.170
482 1HG1 VAL 66 1HG1 VAL 66 -2.604 4.155 -14.612
483 2HG1 VAL 66 2HG1 VAL 66 -3.546 3.808 -13.162
484 3HG1 VAL 66 3HG1 VAL 66 -4.240 3.514 -14.756
485 1HG2 VAL 66 1HG2 VAL 66 -1.587 2.320 -12.395
486 2HG2 VAL 66 2HG2 VAL 66 -0.761 2.734 -13.897
487 3HG2 VAL 66 3HG2 VAL 66 -1.036 1.042 -13.479
488 H ILE 67 H ILE 67 -5.907 1.949 -12.454
489 HA ILE 67 HA ILE 67 -7.655 1.206 -14.666
490 HB ILE 67 HB ILE 67 -8.443 2.715 -12.177
491 1HG1 ILE 67 2HG1 ILE 67 -8.336 -0.282 -12.588
492 2HG1 ILE 67 1HG1 ILE 67 -7.305 0.650 -11.508
493 1HG2 ILE 67 1HG2 ILE 67 -10.653 1.746 -12.650
494 2HG2 ILE 67 2HG2 ILE 67 -9.988 0.972 -14.088
495 3HG2 ILE 67 3HG2 ILE 67 -10.062 2.731 -13.992
496 1HD1 ILE 67 1HD1 ILE 67 -9.225 1.256 -10.168
497 2HD1 ILE 67 2HD1 ILE 67 -9.104 -0.497 -10.316
498 3HD1 ILE 67 3HD1 ILE 67 -10.290 0.390 -11.273
499 H SER 68 H SER 68 -6.744 4.095 -12.856
500 HA SER 68 HA SER 68 -6.907 5.681 -15.299
501 1HB SER 68 2HB SER 68 -8.232 6.577 -12.740
502 2HB SER 68 1HB SER 68 -8.236 7.416 -14.276
503 HG SER 68 HG SER 68 -9.172 5.049 -14.813
504 H GLN 69 H GLN 69 -5.778 7.737 -15.054
505 HA GLN 69 HA GLN 69 -3.994 7.937 -12.788
506 1HB GLN 69 2HB GLN 69 -2.887 6.293 -14.257
507 2HB GLN 69 1HB GLN 69 -2.852 7.488 -15.546
508 1HG GLN 69 2HG GLN 69 -1.385 8.890 -14.274
509 2HG GLN 69 1HG GLN 69 -1.539 7.843 -12.864
510 1HE2 GLN 69 1HE2 GLN 69 -0.520 5.824 -12.875
511 2HE2 GLN 69 2HE2 GLN 69 0.757 5.447 -13.980
512 H SER 70 H SER 70 -3.585 9.942 -12.343
513 HA SER 70 HA SER 70 -3.681 11.978 -14.439
514 1HB SER 70 2HB SER 70 -5.883 12.004 -13.410
515 2HB SER 70 1HB SER 70 -5.166 12.058 -11.804
516 HG SER 70 HG SER 70 -4.696 14.074 -13.746
517 H THR 71 H THR 71 -2.371 13.796 -14.005
518 HA THR 71 HA THR 71 -0.131 13.168 -12.313
519 HB THR 71 HB THR 71 0.688 15.441 -13.199
520 HG1 THR 71 1HG THR 71 -1.344 16.236 -13.872
521 1HG2 THR 71 1HG2 THR 71 1.291 14.468 -15.371
522 2HG2 THR 71 2HG2 THR 71 0.091 13.197 -15.134
523 3HG2 THR 71 3HG2 THR 71 1.489 13.304 -14.064
524 H ASP 72 H ASP 72 -2.981 15.092 -12.063
525 HA ASP 72 HA ASP 72 -2.017 16.143 -9.531
526 1HB ASP 72 2HB ASP 72 -2.835 18.427 -10.102
527 2HB ASP 72 1HB ASP 72 -1.445 17.916 -11.050
528 H GLY 73 H GLY 73 -4.558 14.871 -11.350
529 1HA GLY 73 2HA GLY 73 -6.624 15.867 -9.573
530 2HA GLY 73 1HA GLY 73 -6.832 14.694 -10.871
531 H SER 74 H SER 74 -6.242 12.536 -10.498
532 HA SER 74 HA SER 74 -5.342 11.605 -7.979
533 1HB SER 74 2HB SER 74 -7.485 10.196 -7.712
534 2HB SER 74 1HB SER 74 -7.519 11.869 -7.175
535 HG SER 74 HG SER 74 -8.207 11.836 -9.737
536 H ILE 75 H ILE 75 -4.909 9.347 -7.998
537 HA ILE 75 HA ILE 75 -4.987 8.138 -10.691
538 HB ILE 75 HB ILE 75 -3.026 7.509 -8.474
539 1HG1 ILE 75 2HG1 ILE 75 -2.707 9.207 -10.957
540 2HG1 ILE 75 1HG1 ILE 75 -2.593 9.748 -9.287
541 1HG2 ILE 75 1HG2 ILE 75 -3.425 5.627 -9.953
542 2HG2 ILE 75 2HG2 ILE 75 -1.815 6.287 -10.236
543 3HG2 ILE 75 3HG2 ILE 75 -3.125 6.642 -11.363
544 1HD1 ILE 75 1HD1 ILE 75 -0.582 8.456 -8.973
545 2HD1 ILE 75 2HD1 ILE 75 -0.405 9.526 -10.363
546 3HD1 ILE 75 3HD1 ILE 75 -0.714 7.806 -10.606
547 H GLU 76 H GLU 76 -5.872 6.115 -10.906
548 HA GLU 76 HA GLU 76 -6.782 4.818 -8.420
549 1HB GLU 76 2HB GLU 76 -8.609 5.821 -9.913
550 2HB GLU 76 1HB GLU 76 -8.183 4.565 -11.068
551 1HG GLU 76 2HG GLU 76 -8.799 2.836 -9.564
552 2HG GLU 76 1HG GLU 76 -8.990 3.977 -8.234
553 H ILE 77 H ILE 77 -6.027 2.860 -8.101
554 HA ILE 77 HA ILE 77 -5.031 1.313 -10.398
555 HB ILE 77 HB ILE 77 -3.203 0.446 -8.943
556 1HG1 ILE 77 2HG1 ILE 77 -3.980 2.746 -7.133
557 2HG1 ILE 77 1HG1 ILE 77 -4.216 1.044 -6.768
558 1HG2 ILE 77 1HG2 ILE 77 -3.179 3.412 -9.475
559 2HG2 ILE 77 2HG2 ILE 77 -2.751 2.136 -10.615
560 3HG2 ILE 77 3HG2 ILE 77 -1.755 2.412 -9.186
561 1HD1 ILE 77 1HD1 ILE 77 -1.571 2.420 -7.149
562 2HD1 ILE 77 2HD1 ILE 77 -1.795 0.701 -6.823
563 3HD1 ILE 77 3HD1 ILE 77 -2.274 1.899 -5.618
564 H GLN 78 H GLN 78 -4.953 -0.999 -10.030
565 HA GLN 78 HA GLN 78 -6.711 -1.899 -7.852
566 1HB GLN 78 2HB GLN 78 -7.982 -1.808 -9.977
567 2HB GLN 78 1HB GLN 78 -6.806 -2.884 -10.711
568 1HG GLN 78 2HG GLN 78 -7.438 -4.681 -9.314
569 2HG GLN 78 1HG GLN 78 -8.410 -3.630 -8.288
570 1HE2 GLN 78 1HE2 GLN 78 -10.237 -4.858 -8.566
571 2HE2 GLN 78 2HE2 GLN 78 -11.133 -4.894 -10.042
572 H TYR 79 H TYR 79 -6.221 -3.891 -6.966
573 HA TYR 79 HA TYR 79 -3.500 -4.786 -7.384
574 1HB TYR 79 2HB TYR 79 -5.640 -5.771 -5.481
575 2HB TYR 79 1HB TYR 79 -3.964 -6.304 -5.484
576 HD1 TYR 79 1HD TYR 79 -2.175 -4.782 -4.752
577 HD2 TYR 79 2HD TYR 79 -6.271 -3.653 -4.529
578 HE1 TYR 79 1HE TYR 79 -1.582 -2.955 -3.218
579 HE2 TYR 79 2HE TYR 79 -5.687 -1.822 -2.998
580 HH TYR 79 HH TYR 79 -2.469 -0.827 -2.462
581 H LEU 80 H LEU 80 -3.081 -7.182 -7.493
582 HA LEU 80 HA LEU 80 -5.137 -8.575 -9.066
583 1HB LEU 80 2HB LEU 80 -2.166 -8.510 -9.613
584 2HB LEU 80 1HB LEU 80 -3.291 -9.600 -10.397
585 HG LEU 80 HG LEU 80 -3.375 -6.586 -10.610
586 1HD1 LEU 80 1HD1 LEU 80 -1.420 -7.514 -11.721
587 2HD1 LEU 80 2HD1 LEU 80 -2.600 -6.954 -12.905
588 3HD1 LEU 80 3HD1 LEU 80 -2.438 -8.678 -12.569
589 1HD2 LEU 80 1HD2 LEU 80 -5.576 -7.629 -10.835
590 2HD2 LEU 80 2HD2 LEU 80 -4.935 -8.722 -12.063
591 3HD2 LEU 80 3HD2 LEU 80 -5.013 -6.989 -12.377
592 H GLY 81 H GLY 81 -4.681 -10.977 -9.167
593 1HA GLY 81 2HA GLY 81 -3.798 -12.918 -8.042
594 2HA GLY 81 1HA GLY 81 -3.517 -11.912 -6.624
595 HA PRO 82 HA PRO 82 -7.526 -14.046 -5.795
596 1HB PRO 82 2HB PRO 82 -7.086 -14.222 -3.099
597 2HB PRO 82 1HB PRO 82 -6.584 -15.460 -4.254
598 1HG PRO 82 2HG PRO 82 -4.976 -13.287 -2.982
599 2HG PRO 82 1HG PRO 82 -4.528 -14.973 -3.304
600 1HD PRO 82 2HD PRO 82 -3.701 -12.919 -4.864
601 2HD PRO 82 1HD PRO 82 -4.009 -14.544 -5.510
602 H TYR 83 H TYR 83 -5.863 -11.270 -4.593
603 HA TYR 83 HA TYR 83 -8.340 -10.133 -3.482
604 1HB TYR 83 2HB TYR 83 -5.499 -9.132 -3.149
605 2HB TYR 83 1HB TYR 83 -6.923 -8.569 -2.284
606 HD1 TYR 83 2HD TYR 83 -8.093 -10.237 -0.720
607 HD2 TYR 83 1HD TYR 83 -4.189 -10.867 -2.293
608 HE1 TYR 83 2HE TYR 83 -7.639 -11.863 1.068
609 HE2 TYR 83 1HE TYR 83 -3.727 -12.493 -0.509
610 HH TYR 83 HH TYR 83 -4.500 -13.011 1.740
611 H TYR 84 H TYR 84 -8.207 -10.233 -6.247
612 HA TYR 84 HA TYR 84 -6.885 -7.932 -7.298
613 1HB TYR 84 2HB TYR 84 -7.654 -8.680 -9.468
614 2HB TYR 84 1HB TYR 84 -6.994 -10.044 -8.575
615 HD1 TYR 84 1HD TYR 84 -8.527 -11.768 -7.646
616 HD2 TYR 84 2HD TYR 84 -9.949 -8.629 -10.139
617 HE1 TYR 84 1HE TYR 84 -10.599 -13.027 -8.039
618 HE2 TYR 84 2HE TYR 84 -12.027 -9.882 -10.534
619 HH TYR 84 HH TYR 84 -12.932 -12.071 -10.407
620 HA PRO 85 HA PRO 85 -11.341 -6.656 -8.112
621 1HB PRO 85 2HB PRO 85 -13.284 -7.097 -6.323
622 2HB PRO 85 1HB PRO 85 -12.863 -8.285 -7.561
623 1HG PRO 85 2HG PRO 85 -12.036 -8.187 -4.682
624 2HG PRO 85 1HG PRO 85 -12.588 -9.575 -5.641
625 1HD PRO 85 2HD PRO 85 -9.954 -9.060 -5.155
626 2HD PRO 85 1HD PRO 85 -10.527 -9.880 -6.621
627 H LEU 86 H LEU 86 -9.554 -6.272 -5.340
628 HA LEU 86 HA LEU 86 -10.999 -3.959 -4.325
629 1HB LEU 86 2HB LEU 86 -9.956 -5.494 -2.732
630 2HB LEU 86 1HB LEU 86 -8.392 -5.224 -3.475
631 HG LEU 86 HG LEU 86 -8.521 -2.834 -2.774
632 1HD1 LEU 86 1HD1 LEU 86 -10.944 -2.631 -2.609
633 2HD1 LEU 86 2HD1 LEU 86 -10.168 -2.192 -1.087
634 3HD1 LEU 86 3HD1 LEU 86 -10.957 -3.761 -1.255
635 1HD2 LEU 86 1HD2 LEU 86 -8.035 -3.259 -0.422
636 2HD2 LEU 86 2HD2 LEU 86 -7.291 -4.478 -1.454
637 3HD2 LEU 86 3HD2 LEU 86 -8.757 -4.863 -0.553
638 H LYS 87 H LYS 87 -10.618 -1.939 -5.029
639 HA LYS 87 HA LYS 87 -8.085 -1.467 -6.439
640 1HB LYS 87 2HB LYS 87 -9.171 0.283 -7.707
641 2HB LYS 87 1HB LYS 87 -10.043 -1.227 -7.892
642 1HG LYS 87 2HG LYS 87 -11.670 -0.390 -6.178
643 2HG LYS 87 1HG LYS 87 -10.844 1.171 -6.263
644 1HD LYS 87 2HD LYS 87 -11.283 1.261 -8.677
645 2HD LYS 87 1HD LYS 87 -12.132 -0.278 -8.573
646 1HE LYS 87 2HE LYS 87 -13.825 1.345 -8.569
647 2HE LYS 87 1HE LYS 87 -13.655 0.872 -6.880
648 1HZ LYS 87 1HZ LYS 87 -12.418 3.281 -8.113
649 2HZ LYS 87 2HZ LYS 87 -12.345 2.848 -6.477
650 3HZ LYS 87 3HZ LYS 87 -13.827 3.285 -7.173
651 H SER 88 H SER 88 -7.482 0.948 -6.400
652 HA SER 88 HA SER 88 -7.788 1.983 -3.672
653 1HB SER 88 2HB SER 88 -5.813 0.520 -3.658
654 2HB SER 88 1HB SER 88 -5.136 1.402 -5.024
655 HG SER 88 HG SER 88 -5.828 2.734 -2.636
656 H THR 89 H THR 89 -7.165 4.200 -3.439
657 HA THR 89 HA THR 89 -7.086 5.661 -5.998
658 HB THR 89 HB THR 89 -8.247 6.833 -3.498
659 HG1 THR 89 1HG THR 89 -9.206 4.671 -4.632
660 1HG2 THR 89 1HG2 THR 89 -7.811 8.326 -5.385
661 2HG2 THR 89 2HG2 THR 89 -9.544 8.165 -5.100
662 3HG2 THR 89 3HG2 THR 89 -8.784 7.297 -6.435
663 H LEU 90 H LEU 90 -5.709 7.364 -6.144
664 HA LEU 90 HA LEU 90 -3.995 7.959 -3.825
665 1HB LEU 90 2HB LEU 90 -3.151 7.719 -6.717
666 2HB LEU 90 1HB LEU 90 -2.120 8.290 -5.420
667 HG LEU 90 HG LEU 90 -3.309 5.517 -5.563
668 1HD1 LEU 90 1HD1 LEU 90 -1.046 4.794 -6.124
669 2HD1 LEU 90 2HD1 LEU 90 -0.520 6.476 -6.178
670 3HD1 LEU 90 3HD1 LEU 90 -1.696 5.881 -7.350
671 1HD2 LEU 90 1HD2 LEU 90 -2.862 6.295 -3.286
672 2HD2 LEU 90 2HD2 LEU 90 -1.209 6.703 -3.750
673 3HD2 LEU 90 3HD2 LEU 90 -1.739 5.021 -3.761
674 H LYS 91 H LYS 91 -4.056 10.031 -3.276
675 HA LYS 91 HA LYS 91 -4.599 12.045 -5.365
676 1HB LYS 91 2HB LYS 91 -5.708 12.021 -2.549
677 2HB LYS 91 1HB LYS 91 -5.887 13.340 -3.694
678 1HG LYS 91 2HG LYS 91 -7.340 12.120 -5.049
679 2HG LYS 91 1HG LYS 91 -6.876 10.590 -4.301
680 1HD LYS 91 2HD LYS 91 -7.902 11.318 -2.194
681 2HD LYS 91 1HD LYS 91 -8.376 12.835 -2.958
682 1HE LYS 91 2HE LYS 91 -9.819 11.651 -4.491
683 2HE LYS 91 1HE LYS 91 -9.274 10.097 -3.857
684 1HZ LYS 91 1HZ LYS 91 -10.698 12.168 -2.269
685 2HZ LYS 91 2HZ LYS 91 -10.266 10.607 -1.747
686 3HZ LYS 91 3HZ LYS 91 -11.437 10.808 -2.961
687 H ARG 92 H ARG 92 -3.790 14.190 -4.797
688 HA ARG 92 HA ARG 92 -1.410 14.117 -3.165
689 1HB ARG 92 2HB ARG 92 -2.647 16.096 -5.022
690 2HB ARG 92 1HB ARG 92 -1.511 16.672 -3.810
691 1HG ARG 92 2HG ARG 92 0.034 14.840 -4.703
692 2HG ARG 92 1HG ARG 92 -1.041 14.822 -6.098
693 1HD ARG 92 2HD ARG 92 -0.543 17.008 -6.683
694 2HD ARG 92 1HD ARG 92 0.016 17.415 -5.065
695 HE ARG 92 HE ARG 92 1.531 16.006 -7.146
696 1HH1 ARG 92 1HH1 ARG 92 1.385 17.363 -3.918
697 2HH1 ARG 92 2HH1 ARG 92 3.101 17.477 -3.742
698 1HH2 ARG 92 1HH2 ARG 92 3.807 16.193 -6.939
699 2HH2 ARG 92 2HH2 ARG 92 4.484 16.810 -5.465
700 H GLY 93 H GLY 93 -1.108 15.134 -1.244
701 1HA GLY 93 2HA GLY 93 -3.510 16.269 0.030
702 2HA GLY 93 1HA GLY 93 -2.076 15.687 0.873
703 H GLU 94 H GLU 94 -1.736 17.597 1.996
704 HA GLU 94 HA GLU 94 -1.217 20.019 0.469
705 1HB GLU 94 2HB GLU 94 -2.389 19.977 2.744
706 2HB GLU 94 1HB GLU 94 -0.813 19.615 3.435
707 1HG GLU 94 2HG GLU 94 -1.284 21.971 3.623
708 2HG GLU 94 1HG GLU 94 0.061 21.707 2.512
709 H ASN 95 H ASN 95 0.768 20.575 -0.207
710 HA ASN 95 HA ASN 95 2.981 20.504 -0.632
711 1HB ASN 95 2HB ASN 95 3.171 19.386 2.177
712 2HB ASN 95 1HB ASN 95 4.539 19.925 1.207
713 1HD2 ASN 95 1HD2 ASN 95 2.013 20.851 3.295
714 2HD2 ASN 95 2HD2 ASN 95 2.308 22.561 3.253
715 H GLY 96 H GLY 96 4.809 18.408 0.404
716 1HA GLY 96 2HA GLY 96 4.272 16.512 -1.696
717 2HA GLY 96 1HA GLY 96 5.682 16.544 -0.652
718 H THR 97 H THR 97 2.197 16.176 -0.033
719 HA THR 97 HA THR 97 2.819 13.630 1.302
720 HB THR 97 HB THR 97 0.687 13.976 2.584
721 HG1 THR 97 1HG THR 97 0.830 16.712 1.926
722 1HG2 THR 97 1HG2 THR 97 1.621 15.588 4.162
723 2HG2 THR 97 2HG2 THR 97 2.773 16.132 2.942
724 3HG2 THR 97 3HG2 THR 97 2.874 14.491 3.580
725 H LEU 98 H LEU 98 1.554 11.845 0.864
726 HA LEU 98 HA LEU 98 -0.183 12.127 -1.499
727 1HB LEU 98 2HB LEU 98 1.835 10.702 -1.784
728 2HB LEU 98 1HB LEU 98 1.258 9.663 -0.495
729 HG LEU 98 HG LEU 98 -0.796 9.237 -1.920
730 1HD1 LEU 98 1HD1 LEU 98 -0.603 9.645 -4.309
731 2HD1 LEU 98 2HD1 LEU 98 0.935 10.470 -4.059
732 3HD1 LEU 98 3HD1 LEU 98 -0.553 11.164 -3.414
733 1HD2 LEU 98 1HD2 LEU 98 1.901 8.374 -2.947
734 2HD2 LEU 98 2HD2 LEU 98 0.367 7.600 -3.338
735 3HD2 LEU 98 3HD2 LEU 98 0.960 7.590 -1.677
736 H ILE 99 H ILE 99 -2.268 11.563 -1.352
737 HA ILE 99 HA ILE 99 -3.202 10.411 1.180
738 HB ILE 99 HB ILE 99 -4.768 11.695 -1.068
739 1HG1 ILE 99 2HG1 ILE 99 -4.133 12.693 1.720
740 2HG1 ILE 99 1HG1 ILE 99 -3.403 13.286 0.231
741 1HG2 ILE 99 1HG2 ILE 99 -5.707 10.689 1.617
742 2HG2 ILE 99 2HG2 ILE 99 -6.077 9.972 0.049
743 3HG2 ILE 99 3HG2 ILE 99 -6.693 11.574 0.452
744 1HD1 ILE 99 1HD1 ILE 99 -5.147 14.776 1.071
745 2HD1 ILE 99 2HD1 ILE 99 -6.323 13.466 0.931
746 3HD1 ILE 99 3HD1 ILE 99 -5.548 14.115 -0.514
747 H TRP 100 H TRP 100 -3.309 8.298 1.199
748 HA TRP 100 HA TRP 100 -3.802 6.864 -1.316
749 1HB TRP 100 2HB TRP 100 -1.661 6.338 -0.284
750 2HB TRP 100 1HB TRP 100 -2.451 5.984 1.246
751 HD1 TRP 100 HD TRP 100 -3.747 4.624 -2.114
752 HE1 TRP 100 1HE TRP 100 -3.552 2.067 -2.077
753 HE3 TRP 100 3HE TRP 100 -1.213 4.073 2.297
754 HZ2 TRP 100 2HZ TRP 100 -2.447 0.069 -0.405
755 HZ3 TRP 100 3HZ TRP 100 -0.619 1.799 3.037
756 HH2 TRP 100 HH TRP 100 -1.225 -0.157 1.712
757 H GLU 101 H GLU 101 -5.825 6.178 -1.531
758 HA GLU 101 HA GLU 101 -7.300 5.468 0.909
759 1HB GLU 101 2HB GLU 101 -8.159 6.496 -1.753
760 2HB GLU 101 1HB GLU 101 -9.286 5.560 -0.797
761 1HG GLU 101 2HG GLU 101 -9.141 7.131 1.011
762 2HG GLU 101 1HG GLU 101 -7.869 8.017 0.180
763 H GLN 102 H GLN 102 -7.980 3.529 1.224
764 HA GLN 102 HA GLN 102 -8.006 1.517 -0.863
765 1HB GLN 102 2HB GLN 102 -5.612 1.769 0.098
766 2HB GLN 102 1HB GLN 102 -6.264 1.024 1.547
767 1HG GLN 102 2HG GLN 102 -6.904 -0.458 -0.871
768 2HG GLN 102 1HG GLN 102 -5.173 -0.285 -0.604
769 1HE2 GLN 102 1HE2 GLN 102 -4.792 -2.388 -0.106
770 2HE2 GLN 102 2HE2 GLN 102 -5.364 -3.141 1.345
771 H ASN 103 H ASN 103 -9.542 0.016 -0.432
772 HA ASN 103 HA ASN 103 -11.131 -1.210 0.649
773 1HB ASN 103 2HB ASN 103 -8.965 -1.211 2.380
774 2HB ASN 103 1HB ASN 103 -10.301 -0.692 3.399
775 1HD2 ASN 103 1HD2 ASN 103 -8.907 -3.268 1.600
776 2HD2 ASN 103 2HD2 ASN 103 -10.002 -4.507 2.111
777 H GLY 104 H GLY 104 -11.004 1.959 0.693
778 1HA GLY 104 2HA GLY 104 -12.854 3.384 0.948
779 2HA GLY 104 1HA GLY 104 -13.582 2.208 2.031
780 H GLN 105 H GLN 105 -10.315 2.798 2.763
781 HA GLN 105 HA GLN 105 -11.085 4.851 4.729
782 1HB GLN 105 2HB GLN 105 -9.532 3.941 6.326
783 2HB GLN 105 1HB GLN 105 -10.597 2.650 5.791
784 1HG GLN 105 2HG GLN 105 -8.839 1.868 4.261
785 2HG GLN 105 1HG GLN 105 -7.770 3.127 4.876
786 1HE2 GLN 105 1HE2 GLN 105 -10.026 1.369 6.863
787 2HE2 GLN 105 2HE2 GLN 105 -8.855 0.469 7.756
788 H ARG 106 H ARG 106 -9.540 6.462 5.195
789 HA ARG 106 HA ARG 106 -7.799 6.986 2.904
790 1HB ARG 106 2HB ARG 106 -9.427 8.719 3.538
791 2HB ARG 106 1HB ARG 106 -8.698 8.819 5.134
792 1HG ARG 106 2HG ARG 106 -6.530 9.396 3.904
793 2HG ARG 106 1HG ARG 106 -7.563 9.680 2.504
794 1HD ARG 106 2HD ARG 106 -7.766 11.038 5.186
795 2HD ARG 106 1HD ARG 106 -7.142 11.753 3.700
796 HE ARG 106 HE ARG 106 -9.625 11.037 2.968
797 1HH1 ARG 106 1HH1 ARG 106 -8.434 12.756 5.794
798 2HH1 ARG 106 2HH1 ARG 106 -9.875 13.710 5.962
799 1HH2 ARG 106 1HH2 ARG 106 -11.507 12.293 3.210
800 2HH2 ARG 106 2HH2 ARG 106 -11.625 13.454 4.499
801 H LYS 107 H LYS 107 -5.679 6.712 3.038
802 HA LYS 107 HA LYS 107 -4.401 6.879 5.681
803 1HB LYS 107 2HB LYS 107 -3.735 5.310 3.219
804 2HB LYS 107 1HB LYS 107 -2.457 5.746 4.344
805 1HG LYS 107 2HG LYS 107 -4.900 4.446 5.421
806 2HG LYS 107 1HG LYS 107 -3.743 3.475 4.533
807 1HD LYS 107 2HD LYS 107 -3.219 3.350 6.872
808 2HD LYS 107 1HD LYS 107 -1.955 4.262 6.047
809 1HE LYS 107 2HE LYS 107 -3.073 6.347 6.738
810 2HE LYS 107 1HE LYS 107 -4.235 5.391 7.650
811 1HZ LYS 107 1HZ LYS 107 -2.408 4.527 8.986
812 2HZ LYS 107 2HZ LYS 107 -2.482 6.219 9.068
813 3HZ LYS 107 3HZ LYS 107 -1.305 5.472 8.105
814 H THR 108 H THR 108 -2.742 8.258 6.008
815 HA THR 108 HA THR 108 -2.180 10.156 3.822
816 HB THR 108 HB THR 108 -1.659 10.547 6.778
817 HG1 THR 108 1HG THR 108 -3.979 10.442 5.630
818 1HG2 THR 108 1HG2 THR 108 -1.733 12.500 4.467
819 2HG2 THR 108 2HG2 THR 108 -0.279 11.941 5.296
820 3HG2 THR 108 3HG2 THR 108 -1.467 12.918 6.157
821 H MET 109 H MET 109 -0.317 9.830 2.808
822 HA MET 109 HA MET 109 1.753 8.269 4.187
823 1HB MET 109 2HB MET 109 1.599 8.871 1.234
824 2HB MET 109 1HB MET 109 2.563 7.637 2.031
825 1HG MET 109 2HG MET 109 -0.421 7.687 1.700
826 2HG MET 109 1HG MET 109 0.725 6.586 0.941
827 1HE MET 109 1HE MET 109 2.683 6.009 3.382
828 2HE MET 109 2HE MET 109 2.106 4.726 2.318
829 3HE MET 109 3HE MET 109 1.978 4.545 4.066
830 H THR 110 H THR 110 3.663 9.117 4.681
831 HA THR 110 HA THR 110 4.324 11.797 3.677
832 HB THR 110 HB THR 110 6.224 10.920 5.600
833 HG1 THR 110 1HG THR 110 5.032 9.568 6.755
834 1HG2 THR 110 1HG2 THR 110 5.509 13.229 5.225
835 2HG2 THR 110 2HG2 THR 110 5.309 12.778 6.918
836 3HG2 THR 110 3HG2 THR 110 3.908 12.844 5.849
837 H ARG 111 H ARG 111 6.291 12.134 2.549
838 HA ARG 111 HA ARG 111 7.320 9.727 1.316
839 1HB ARG 111 2HB ARG 111 6.944 11.919 0.069
840 2HB ARG 111 1HB ARG 111 8.386 12.514 0.884
841 1HG ARG 111 2HG ARG 111 9.588 10.492 -0.066
842 2HG ARG 111 1HG ARG 111 8.168 10.255 -1.083
843 1HD ARG 111 2HD ARG 111 9.641 11.484 -2.419
844 2HD ARG 111 1HD ARG 111 8.501 12.681 -1.807
845 HE ARG 111 HE ARG 111 10.272 13.219 -0.107
846 1HH1 ARG 111 1HH1 ARG 111 11.102 11.768 -3.193
847 2HH1 ARG 111 2HH1 ARG 111 12.704 12.435 -3.229
848 1HH2 ARG 111 1HH2 ARG 111 12.410 14.109 -0.161
849 2HH2 ARG 111 2HH2 ARG 111 13.426 13.778 -1.533
850 H ILE 112 H ILE 112 9.106 8.668 1.886
851 HA ILE 112 HA ILE 112 10.697 9.388 4.096
852 HB ILE 112 HB ILE 112 11.369 7.551 1.805
853 1HG1 ILE 112 2HG1 ILE 112 9.292 7.033 3.152
854 2HG1 ILE 112 1HG1 ILE 112 10.506 5.768 3.142
855 1HG2 ILE 112 1HG2 ILE 112 13.000 6.528 3.303
856 2HG2 ILE 112 2HG2 ILE 112 12.634 7.740 4.529
857 3HG2 ILE 112 3HG2 ILE 112 13.375 8.226 3.004
858 1HD1 ILE 112 1HD1 ILE 112 10.092 7.756 5.355
859 2HD1 ILE 112 2HD1 ILE 112 11.249 6.425 5.350
860 3HD1 ILE 112 3HD1 ILE 112 9.517 6.090 5.348
861 H GLU 113 H GLU 113 12.798 10.243 4.138
862 HA GLU 113 HA GLU 113 13.294 11.980 1.818
863 1HB GLU 113 2HB GLU 113 12.386 13.156 3.809
864 2HB GLU 113 1HB GLU 113 13.820 12.679 4.705
865 1HG GLU 113 2HG GLU 113 13.876 15.001 3.817
866 2HG GLU 113 1HG GLU 113 15.223 13.989 3.298
867 H SER 114 H SER 114 14.978 11.354 0.811
868 HA SER 114 HA SER 114 17.553 11.243 1.949
869 1HB SER 114 2HB SER 114 16.581 9.019 2.730
870 2HB SER 114 1HB SER 114 16.531 8.544 1.034
871 HG SER 114 HG SER 114 18.765 8.732 0.936
872 H LYS 115 H LYS 115 18.417 12.371 0.320
873 HA LYS 115 HA LYS 115 17.805 11.675 -2.441
874 1HB LYS 115 2HB LYS 115 19.654 13.793 -1.320
875 2HB LYS 115 1HB LYS 115 19.228 13.599 -3.015
876 1HG LYS 115 2HG LYS 115 16.878 14.061 -2.465
877 2HG LYS 115 1HG LYS 115 17.341 14.305 -0.777
878 1HD LYS 115 2HD LYS 115 17.168 16.449 -1.845
879 2HD LYS 115 1HD LYS 115 18.870 16.114 -1.525
880 1HE LYS 115 2HE LYS 115 19.059 15.295 -3.882
881 2HE LYS 115 1HE LYS 115 17.420 15.886 -4.157
882 1HZ LYS 115 1HZ LYS 115 19.781 17.500 -3.373
883 2HZ LYS 115 2HZ LYS 115 18.200 18.108 -3.473
884 3HZ LYS 115 3HZ LYS 115 18.980 17.534 -4.870
885 H THR 116 H THR 116 19.102 10.505 -3.727
886 HA THR 116 HA THR 116 20.669 8.958 -4.284
887 HB THR 116 HB THR 116 22.414 10.083 -2.085
888 HG1 THR 116 1HG THR 116 21.588 11.237 -4.355
889 1HG2 THR 116 1HG2 THR 116 23.133 7.904 -2.930
890 2HG2 THR 116 2HG2 THR 116 24.250 9.170 -3.438
891 3HG2 THR 116 3HG2 THR 116 23.078 8.514 -4.582
892 H GLY 117 H GLY 117 20.626 6.853 -3.789
893 1HA GLY 117 2HA GLY 117 19.454 6.100 -1.252
894 2HA GLY 117 1HA GLY 117 19.759 5.037 -2.615
895 H ARG 118 H ARG 118 21.573 3.818 -2.649
896 HA ARG 118 HA ARG 118 23.395 4.083 -0.399
897 1HB ARG 118 2HB ARG 118 23.461 1.572 -0.425
898 2HB ARG 118 1HB ARG 118 21.954 2.264 0.145
899 1HG ARG 118 2HG ARG 118 20.985 1.883 -2.099
900 2HG ARG 118 1HG ARG 118 22.488 1.094 -2.577
901 1HD ARG 118 2HD ARG 118 20.714 -0.496 -1.913
902 2HD ARG 118 1HD ARG 118 22.171 -0.627 -0.930
903 HE ARG 118 HE ARG 118 20.993 0.134 0.905
904 1HH1 ARG 118 1HH1 ARG 118 19.042 0.545 -1.989
905 2HH1 ARG 118 2HH1 ARG 118 17.566 0.770 -1.105
906 1HH2 ARG 118 1HH2 ARG 118 19.046 0.425 2.059
907 2HH2 ARG 118 2HH2 ARG 118 17.563 0.706 1.190
908 H GLU 119 H GLU 119 25.449 3.251 -0.773
909 HA GLU 119 HA GLU 119 26.171 2.930 -3.608
910 1HB GLU 119 2HB GLU 119 28.331 4.026 -3.087
911 2HB GLU 119 1HB GLU 119 26.946 5.088 -2.893
912 1HG GLU 119 2HG GLU 119 27.037 4.765 -0.472
913 2HG GLU 119 1HG GLU 119 28.434 3.706 -0.673
914 H GLU 120 H GLU 120 25.540 0.969 -1.489
915 HA GLU 120 HA GLU 120 27.949 -0.444 -0.902
916 1HB GLU 120 2HB GLU 120 25.163 -1.598 -1.111
917 2HB GLU 120 1HB GLU 120 26.521 -2.260 -0.215
918 1HG GLU 120 2HG GLU 120 26.447 -0.361 1.311
919 2HG GLU 120 1HG GLU 120 25.090 0.315 0.413
920 H LYS 121 H LYS 121 29.046 -0.515 -2.872
921 HA LYS 121 HA LYS 121 27.766 -2.032 -5.029
922 1HB LYS 121 2HB LYS 121 28.181 0.315 -5.578
923 2HB LYS 121 1HB LYS 121 29.885 0.104 -5.208
924 1HG LYS 121 2HG LYS 121 30.050 -1.522 -7.059
925 2HG LYS 121 1HG LYS 121 28.358 -1.203 -7.450
926 1HD LYS 121 2HD LYS 121 30.572 0.847 -7.440
927 2HD LYS 121 1HD LYS 121 29.894 0.081 -8.877
928 1HE LYS 121 2HE LYS 121 27.752 1.080 -8.474
929 2HE LYS 121 1HE LYS 121 28.284 1.699 -6.913
930 1HZ LYS 121 1HZ LYS 121 29.825 3.162 -8.017
931 2HZ LYS 121 2HZ LYS 121 28.269 3.408 -8.648
932 3HZ LYS 121 3HZ LYS 121 29.410 2.526 -9.533
933 H ASP 122 H ASP 122 28.482 -4.051 -4.856
934 HA ASP 122 HA ASP 122 31.135 -4.613 -5.680
935 1HB ASP 122 2HB ASP 122 31.611 -4.207 -3.298
936 2HB ASP 122 1HB ASP 122 30.439 -5.445 -2.857
937 H GLU 123 H GLU 123 31.187 -6.520 -6.700
938 HA GLU 123 HA GLU 123 29.209 -8.565 -6.136
939 1HB GLU 123 2HB GLU 123 28.003 -7.063 -7.644
940 2HB GLU 123 1HB GLU 123 29.318 -7.155 -8.809
941 1HG GLU 123 2HG GLU 123 28.886 -9.640 -8.907
942 2HG GLU 123 1HG GLU 123 27.412 -9.327 -7.992
943 H LYS 124 H LYS 124 30.108 -10.503 -6.369
944 HA LYS 124 HA LYS 124 32.055 -10.881 -8.547
945 1HB LYS 124 2HB LYS 124 32.186 -12.152 -5.799
946 2HB LYS 124 1HB LYS 124 33.192 -12.617 -7.160
947 1HG LYS 124 2HG LYS 124 34.642 -11.251 -6.093
948 2HG LYS 124 1HG LYS 124 33.826 -10.042 -7.084
949 1HD LYS 124 2HD LYS 124 32.459 -9.355 -5.257
950 2HD LYS 124 1HD LYS 124 32.975 -10.726 -4.273
951 1HE LYS 124 2HE LYS 124 34.155 -8.827 -3.481
952 2HE LYS 124 1HE LYS 124 35.304 -9.807 -4.387
953 1HZ LYS 124 1HZ LYS 124 34.840 -8.296 -6.317
954 2HZ LYS 124 2HZ LYS 124 35.657 -7.587 -5.014
955 3HZ LYS 124 3HZ LYS 124 34.005 -7.283 -5.234
956 H SER 125 H SER 125 30.480 -11.718 -9.913
957 HA SER 125 HA SER 125 28.570 -13.642 -9.050
958 1HB SER 125 2HB SER 125 29.467 -13.007 -11.871
959 2HB SER 125 1HB SER 125 27.970 -13.813 -11.403
960 HG SER 125 HG SER 125 27.455 -11.839 -10.231
961 H LYS 126 H LYS 126 29.530 -15.402 -8.138
962 HA LYS 126 HA LYS 126 31.644 -16.838 -9.454
963 1HB LYS 126 2HB LYS 126 29.918 -17.490 -7.062
964 2HB LYS 126 1HB LYS 126 31.186 -18.552 -7.657
965 1HG LYS 126 2HG LYS 126 31.603 -15.724 -6.710
966 2HG LYS 126 1HG LYS 126 31.907 -17.177 -5.751
967 1HD LYS 126 2HD LYS 126 33.556 -17.912 -7.418
968 2HD LYS 126 1HD LYS 126 33.260 -16.444 -8.352
969 1HE LYS 126 2HE LYS 126 34.055 -15.088 -6.493
970 2HE LYS 126 1HE LYS 126 34.305 -16.537 -5.521
971 1HZ LYS 126 1HZ LYS 126 35.710 -15.898 -8.062
972 2HZ LYS 126 2HZ LYS 126 35.959 -17.281 -7.116
973 3HZ LYS 126 3HZ LYS 126 36.372 -15.753 -6.508
974 H SER 127 H SER 127 31.281 -18.013 -11.226
975 HA SER 127 HA SER 127 28.729 -19.476 -11.381
976 1HB SER 127 2HB SER 127 28.892 -19.218 -13.864
977 2HB SER 127 1HB SER 127 28.695 -17.687 -13.008
978 HG SER 127 HG SER 127 31.129 -17.662 -13.106
979 H LEU 128 H LEU 128 28.914 -21.619 -11.488
980 HA LEU 128 HA LEU 128 31.468 -22.752 -12.419
981 1HB LEU 128 2HB LEU 128 30.845 -23.260 -10.062
982 2HB LEU 128 1HB LEU 128 29.381 -24.026 -10.646
983 HG LEU 128 HG LEU 128 30.743 -25.702 -11.844
984 1HD1 LEU 128 1HD1 LEU 128 33.138 -25.862 -11.405
985 2HD1 LEU 128 2HD1 LEU 128 33.075 -24.360 -10.483
986 3HD1 LEU 128 3HD1 LEU 128 32.737 -24.344 -12.212
987 1HD2 LEU 128 1HD2 LEU 128 31.536 -26.903 -9.860
988 2HD2 LEU 128 2HD2 LEU 128 29.935 -26.207 -9.616
989 3HD2 LEU 128 3HD2 LEU 128 31.351 -25.432 -8.903
990 H GLU 129 H GLU 129 31.292 -23.342 -14.476
991 HA GLU 129 HA GLU 129 28.671 -24.179 -15.488
992 1HB GLU 129 2HB GLU 129 30.014 -22.352 -16.619
993 2HB GLU 129 1HB GLU 129 31.175 -23.594 -17.073
994 1HG GLU 129 2HG GLU 129 29.567 -23.018 -18.860
995 2HG GLU 129 1HG GLU 129 29.546 -24.722 -18.408
996 H HIS 130 H HIS 130 28.268 -26.280 -15.573
997 HA HIS 130 HA HIS 130 30.548 -28.126 -15.881
998 1HB HIS 130 2HB HIS 130 29.488 -28.015 -13.568
999 2HB HIS 130 1HB HIS 130 28.043 -28.712 -14.293
1000 HD1 HIS 130 1HD HIS 130 31.572 -29.548 -13.324
1001 HD2 HIS 130 2HD HIS 130 28.200 -31.453 -14.858
1002 HE1 HIS 130 1HE HIS 130 32.035 -32.012 -13.132
1003 HE2 HIS 130 2HE HIS 130 29.901 -33.139 -13.863
1004 H HIS 131 H HIS 131 30.405 -29.578 -17.462
1005 HA HIS 131 HA HIS 131 27.776 -30.107 -18.686
1006 1HB HIS 131 2HB HIS 131 30.347 -29.606 -20.210
1007 2HB HIS 131 1HB HIS 131 28.821 -30.104 -20.923
1008 HD1 HIS 131 1HD HIS 131 26.898 -28.299 -20.963
1009 HD2 HIS 131 2HD HIS 131 30.639 -26.916 -19.779
1010 HE1 HIS 131 1HE HIS 131 26.796 -25.796 -21.168
1011 HE2 HIS 131 2HE HIS 131 29.122 -25.000 -20.614
1012 H HIS 132 H HIS 132 27.474 -32.185 -18.113
1013 HA HIS 132 HA HIS 132 29.352 -34.118 -19.209
1014 1HB HIS 132 2HB HIS 132 30.047 -33.726 -16.816
1015 2HB HIS 132 1HB HIS 132 28.471 -34.337 -16.323
1016 HD1 HIS 132 1HD HIS 132 28.331 -36.789 -15.928
1017 HD2 HIS 132 2HD HIS 132 31.575 -35.767 -18.332
1018 HE1 HIS 132 1HE HIS 132 29.623 -38.925 -16.281
1019 HE2 HIS 132 2HE HIS 132 31.507 -38.309 -17.840
1020 H HIS 133 H HIS 133 27.939 -34.955 -20.621
1021 HA HIS 133 HA HIS 133 25.602 -36.315 -19.540
1022 1HB HIS 133 2HB HIS 133 24.876 -34.003 -20.244
1023 2HB HIS 133 1HB HIS 133 25.315 -34.438 -21.891
1024 HD1 HIS 133 1HD HIS 133 23.054 -35.792 -19.139
1025 HD2 HIS 133 2HD HIS 133 23.250 -35.514 -23.286
1026 HE1 HIS 133 1HE HIS 133 20.880 -36.732 -19.986
1027 HE2 HIS 133 2HE HIS 133 21.080 -36.690 -22.495
1028 H HIS 134 H HIS 134 26.387 -38.271 -20.054
1029 HA HIS 134 HA HIS 134 27.327 -38.782 -22.781
1030 1HB HIS 134 2HB HIS 134 28.708 -39.606 -20.923
1031 2HB HIS 134 1HB HIS 134 27.345 -40.530 -20.305
1032 HD1 HIS 134 1HD HIS 134 27.082 -42.854 -21.150
1033 HD2 HIS 134 2HD HIS 134 29.691 -40.609 -23.487
1034 HE1 HIS 134 1HE HIS 134 28.106 -44.477 -22.773
1035 HE2 HIS 134 2HE HIS 134 29.832 -43.139 -24.033
1036 H HIS 135 H HIS 135 25.861 -39.400 -24.231
1037 HA HIS 135 HA HIS 135 23.438 -40.738 -23.328
1038 1HB HIS 135 2HB HIS 135 22.711 -40.487 -25.746
1039 2HB HIS 135 1HB HIS 135 22.926 -38.995 -24.848
1040 HD1 HIS 135 1HD HIS 135 25.293 -41.106 -26.990
1041 HD2 HIS 135 2HD HIS 135 24.039 -37.176 -26.473
1042 HE1 HIS 135 1HE HIS 135 26.542 -39.762 -28.711
1043 HE2 HIS 135 2HE HIS 135 25.603 -37.432 -28.516
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