NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
7609 |
1krw   |
5303 | cing | recoord | 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 11.782 -16.452 3.617
2 2H MET 1 2HT MET 1 11.800 -16.494 3.339
3 3H MET 1 3HT MET 1 11.877 -16.387 3.391
4 HA MET 1 HA MET 1 11.627 -15.939 3.415
5 1HB MET 1 2HB MET 1 12.325 -16.891 3.326
6 2HB MET 1 1HB MET 1 12.258 -16.667 3.606
7 1HG MET 1 2HG MET 1 11.962 -16.827 3.849
8 2HG MET 1 1HG MET 1 12.026 -16.697 3.619
9 1HE MET 1 1HE MET 1 12.682 -17.365 4.107
10 2HE MET 1 2HE MET 1 12.535 -17.368 3.972
11 3HE MET 1 3HE MET 1 12.741 -17.608 3.878
12 H GLN 2 H GLN 2 11.373 -14.928 2.769
13 HA GLN 2 HA GLN 2 10.576 -14.822 1.581
14 1HB GLN 2 2HB GLN 2 9.999 -14.087 3.097
15 2HB GLN 2 1HB GLN 2 10.185 -13.150 2.053
16 1HG GLN 2 2HG GLN 2 9.050 -14.082 1.925
17 2HG GLN 2 1HG GLN 2 9.231 -14.811 2.077
18 1HE2 GLN 2 1HE2 GLN 2 8.170 -14.687 2.778
19 2HE2 GLN 2 2HE2 GLN 2 7.918 -15.043 3.420
20 H ARG 3 H ARG 3 11.524 -13.622 0.366
21 HA ARG 3 HA ARG 3 13.361 -12.467 0.180
22 1HB ARG 3 2HB ARG 3 12.777 -12.554 -1.459
23 2HB ARG 3 1HB ARG 3 12.098 -12.824 -1.431
24 1HG ARG 3 2HG ARG 3 11.203 -12.006 -2.480
25 2HG ARG 3 1HG ARG 3 12.168 -11.165 -2.359
26 1HD ARG 3 2HD ARG 3 12.877 -12.891 -3.363
27 2HD ARG 3 1HD ARG 3 12.216 -13.115 -3.659
28 HE ARG 3 HE ARG 3 12.592 -12.114 -4.187
29 1HH1 ARG 3 1HH1 ARG 3 12.581 -13.241 -4.482
30 2HH1 ARG 3 2HH1 ARG 3 12.761 -13.198 -5.534
31 1HH2 ARG 3 1HH2 ARG 3 12.829 -12.060 -5.570
32 2HH2 ARG 3 2HH2 ARG 3 12.903 -12.530 -6.151
33 H GLY 4 H GLY 4 10.557 -11.245 0.687
34 1HA GLY 4 2HA GLY 4 9.747 -9.325 1.669
35 2HA GLY 4 1HA GLY 4 11.393 -8.787 1.651
36 H ILE 5 H ILE 5 8.453 -9.017 -0.183
37 HA ILE 5 HA ILE 5 9.563 -7.138 -2.148
38 HB ILE 5 HB ILE 5 7.104 -8.818 -2.542
39 1HG1 ILE 5 2HG1 ILE 5 8.886 -10.113 -3.472
40 2HG1 ILE 5 1HG1 ILE 5 9.497 -9.788 -3.199
41 1HG2 ILE 5 1HG2 ILE 5 7.854 -7.443 -4.395
42 2HG2 ILE 5 2HG2 ILE 5 7.835 -7.609 -4.483
43 3HG2 ILE 5 3HG2 ILE 5 8.004 -7.528 -4.470
44 1HD1 ILE 5 1HD1 ILE 5 9.275 -10.696 -2.661
45 2HD1 ILE 5 2HD1 ILE 5 9.051 -10.564 -2.596
46 3HD1 ILE 5 3HD1 ILE 5 9.347 -10.617 -2.365
47 H VAL 6 H VAL 6 8.972 -5.114 -1.761
48 HA VAL 6 HA VAL 6 6.307 -4.614 -0.626
49 HB VAL 6 HB VAL 6 8.113 -3.701 0.738
50 1HG1 VAL 6 1HG1 VAL 6 9.456 -2.475 -0.896
51 2HG1 VAL 6 2HG1 VAL 6 9.333 -2.472 -0.943
52 3HG1 VAL 6 3HG1 VAL 6 9.404 -2.559 -0.961
53 1HG2 VAL 6 1HG2 VAL 6 6.513 -1.921 0.285
54 2HG2 VAL 6 2HG2 VAL 6 6.678 -1.744 0.116
55 3HG2 VAL 6 3HG2 VAL 6 6.753 -1.787 0.398
56 H TRP 7 H TRP 7 4.813 -3.725 -1.890
57 HA TRP 7 HA TRP 7 5.713 -2.391 -4.352
58 1HB TRP 7 2HB TRP 7 3.362 -4.172 -3.807
59 2HB TRP 7 1HB TRP 7 3.314 -3.019 -5.136
60 HD1 TRP 7 HD1 TRP 7 6.749 -4.311 -4.677
61 HE1 TRP 7 1HE TRP 7 7.302 -6.066 -6.459
62 HE3 TRP 7 3HE TRP 7 2.043 -5.130 -6.489
63 HZ2 TRP 7 2HZ TRP 7 5.927 -7.613 -8.370
64 HZ3 TRP 7 3HZ TRP 7 1.752 -6.771 -8.295
65 HH2 TRP 7 HH2 TRP 7 3.656 -7.987 -9.214
66 H VAL 8 H VAL 8 5.047 -0.374 -4.743
67 HA VAL 8 HA VAL 8 3.138 0.828 -2.849
68 HB VAL 8 HB VAL 8 5.110 2.605 -4.118
69 1HG1 VAL 8 1HG1 VAL 8 4.252 3.154 -1.952
70 2HG1 VAL 8 2HG1 VAL 8 4.221 3.102 -1.929
71 3HG1 VAL 8 3HG1 VAL 8 4.197 3.145 -1.959
72 1HG2 VAL 8 1HG2 VAL 8 6.482 1.248 -2.619
73 2HG2 VAL 8 2HG2 VAL 8 6.511 1.198 -2.790
74 3HG2 VAL 8 3HG2 VAL 8 6.380 1.106 -2.702
75 H VAL 9 H VAL 9 1.648 2.290 -3.637
76 HA VAL 9 HA VAL 9 1.637 2.676 -6.549
77 HB VAL 9 HB VAL 9 -0.987 2.773 -5.614
78 1HG1 VAL 9 1HG1 VAL 9 -0.537 1.318 -7.378
79 2HG1 VAL 9 2HG1 VAL 9 -0.435 1.548 -7.263
80 3HG1 VAL 9 3HG1 VAL 9 -0.570 1.491 -7.327
81 1HG2 VAL 9 1HG2 VAL 9 -0.555 0.650 -4.760
82 2HG2 VAL 9 2HG2 VAL 9 -0.807 0.936 -4.486
83 3HG2 VAL 9 3HG2 VAL 9 -0.235 1.004 -4.558
84 H ASP 10 H ASP 10 2.102 4.725 -6.896
85 HA ASP 10 HA ASP 10 0.471 6.821 -5.860
86 1HB ASP 10 2HB ASP 10 2.361 6.480 -4.244
87 2HB ASP 10 1HB ASP 10 3.079 7.144 -4.954
88 H ASP 11 H ASP 11 1.859 8.569 -6.838
89 HA ASP 11 HA ASP 11 1.722 9.037 -9.360
90 1HB ASP 11 2HB ASP 11 2.752 10.661 -7.404
91 2HB ASP 11 1HB ASP 11 3.500 10.787 -8.512
92 H ASP 12 H ASP 12 4.130 7.320 -7.970
93 HA ASP 12 HA ASP 12 5.813 6.112 -8.746
94 1HB ASP 12 2HB ASP 12 4.775 6.457 -10.945
95 2HB ASP 12 1HB ASP 12 5.620 7.089 -11.203
96 H SER 13 H SER 13 7.637 7.289 -10.761
97 HA SER 13 HA SER 13 9.692 8.052 -10.439
98 1HB SER 13 2HB SER 13 8.579 9.808 -11.566
99 2HB SER 13 1HB SER 13 8.478 10.108 -10.999
100 HG SER 13 HG SER 13 9.074 9.980 -11.470
101 H SER 14 H SER 14 8.151 10.754 -8.957
102 HA SER 14 HA SER 14 10.141 11.238 -7.129
103 1HB SER 14 2HB SER 14 7.974 12.535 -7.647
104 2HB SER 14 1HB SER 14 7.563 12.140 -6.418
105 HG SER 14 HG SER 14 9.097 13.330 -6.460
106 H ILE 15 H ILE 15 6.983 9.766 -6.468
107 HA ILE 15 HA ILE 15 7.599 9.087 -3.819
108 HB ILE 15 HB ILE 15 5.578 7.689 -5.545
109 1HG1 ILE 15 2HG1 ILE 15 5.289 10.134 -5.673
110 2HG1 ILE 15 1HG1 ILE 15 3.968 9.358 -4.830
111 1HG2 ILE 15 1HG2 ILE 15 5.296 7.466 -3.118
112 2HG2 ILE 15 2HG2 ILE 15 5.531 7.381 -3.086
113 3HG2 ILE 15 3HG2 ILE 15 5.368 7.243 -3.218
114 1HD1 ILE 15 1HD1 ILE 15 5.329 10.719 -3.326
115 2HD1 ILE 15 2HD1 ILE 15 5.230 10.720 -3.299
116 3HD1 ILE 15 3HD1 ILE 15 5.265 10.786 -3.368
117 H ARG 16 H ARG 16 8.295 7.580 -6.824
118 HA ARG 16 HA ARG 16 8.761 4.965 -5.823
119 1HB ARG 16 2HB ARG 16 8.406 5.355 -8.176
120 2HB ARG 16 1HB ARG 16 9.681 6.185 -8.305
121 1HG ARG 16 2HG ARG 16 10.582 4.212 -7.654
122 2HG ARG 16 1HG ARG 16 9.404 3.704 -8.160
123 1HD ARG 16 2HD ARG 16 10.454 4.621 -9.700
124 2HD ARG 16 1HD ARG 16 11.022 4.333 -9.595
125 HE ARG 16 HE ARG 16 10.541 3.827 -10.110
126 1HH1 ARG 16 1HH1 ARG 16 11.375 3.865 -10.919
127 2HH1 ARG 16 2HH1 ARG 16 11.784 3.309 -12.090
128 1HH2 ARG 16 1HH2 ARG 16 11.081 3.098 -11.649
129 2HH2 ARG 16 2HH2 ARG 16 11.617 2.874 -12.505
130 H TRP 17 H TRP 17 10.911 7.609 -6.722
131 HA TRP 17 HA TRP 17 13.300 6.339 -6.081
132 1HB TRP 17 2HB TRP 17 13.127 8.429 -7.395
133 2HB TRP 17 1HB TRP 17 12.745 9.287 -5.920
134 HD1 TRP 17 HD1 TRP 17 15.630 7.371 -7.522
135 HE1 TRP 17 1HE TRP 17 17.818 8.176 -6.472
136 HE3 TRP 17 3HE TRP 17 13.734 10.414 -3.982
137 HZ2 TRP 17 2HZ TRP 17 18.632 9.874 -4.414
138 HZ3 TRP 17 3HZ TRP 17 15.286 11.592 -2.510
139 HH2 TRP 17 HH2 TRP 17 17.684 11.326 -2.724
140 H VAL 18 H VAL 18 11.216 8.366 -4.068
141 HA VAL 18 HA VAL 18 12.928 8.437 -1.855
142 HB VAL 18 HB VAL 18 9.960 8.608 -1.582
143 1HG1 VAL 18 1HG1 VAL 18 11.405 9.634 0.140
144 2HG1 VAL 18 2HG1 VAL 18 11.298 9.608 0.153
145 3HG1 VAL 18 3HG1 VAL 18 11.316 9.694 0.084
146 1HG2 VAL 18 1HG2 VAL 18 10.943 10.587 -2.749
147 2HG2 VAL 18 2HG2 VAL 18 10.708 10.638 -2.665
148 3HG2 VAL 18 3HG2 VAL 18 10.742 10.474 -2.859
149 H LEU 19 H LEU 19 10.174 6.362 -2.508
150 HA LEU 19 HA LEU 19 10.548 4.908 -0.088
151 1HB LEU 19 2HB LEU 19 8.458 5.205 -1.847
152 2HB LEU 19 1HB LEU 19 8.795 3.622 -1.899
153 HG LEU 19 HG LEU 19 7.884 4.023 -0.159
154 1HD1 LEU 19 1HD1 LEU 19 8.042 3.962 0.442
155 2HD1 LEU 19 2HD1 LEU 19 8.380 4.070 0.654
156 3HD1 LEU 19 3HD1 LEU 19 8.125 3.929 0.657
157 1HD2 LEU 19 1HD2 LEU 19 7.558 4.458 0.677
158 2HD2 LEU 19 2HD2 LEU 19 7.388 4.521 0.498
159 3HD2 LEU 19 3HD2 LEU 19 7.508 4.835 0.526
160 H GLU 20 H GLU 20 11.479 4.427 -3.386
161 HA GLU 20 HA GLU 20 11.955 1.664 -3.191
162 1HB GLU 20 2HB GLU 20 13.144 1.994 -5.264
163 2HB GLU 20 1HB GLU 20 11.867 2.754 -5.330
164 1HG GLU 20 2HG GLU 20 12.994 4.613 -4.941
165 2HG GLU 20 1HG GLU 20 14.118 3.680 -4.979
166 H ARG 21 H ARG 21 14.286 4.296 -3.228
167 HA ARG 21 HA ARG 21 16.494 2.736 -2.604
168 1HB ARG 21 2HB ARG 21 15.961 5.656 -2.112
169 2HB ARG 21 1HB ARG 21 17.505 4.901 -1.833
170 1HG ARG 21 2HG ARG 21 16.503 4.387 -4.431
171 2HG ARG 21 1HG ARG 21 16.691 5.979 -4.156
172 1HD ARG 21 2HD ARG 21 18.707 5.203 -3.833
173 2HD ARG 21 1HD ARG 21 18.676 4.485 -4.025
174 HE ARG 21 HE ARG 21 18.393 5.267 -5.160
175 1HH1 ARG 21 1HH1 ARG 21 19.832 4.458 -4.107
176 2HH1 ARG 21 2HH1 ARG 21 20.670 4.416 -4.777
177 1HH2 ARG 21 1HH2 ARG 21 19.495 5.210 -6.036
178 2HH2 ARG 21 2HH2 ARG 21 20.479 4.842 -5.870
179 H ALA 22 H ALA 22 14.488 4.679 -0.406
180 HA ALA 22 HA ALA 22 15.844 4.056 1.911
181 1HB ALA 22 1HB ALA 22 13.714 5.215 1.991
182 2HB ALA 22 2HB ALA 22 13.766 5.116 2.353
183 3HB ALA 22 3HB ALA 22 13.515 4.930 2.136
184 H LEU 23 H LEU 23 13.118 2.413 0.462
185 HA LEU 23 HA LEU 23 12.980 0.441 2.500
186 1HB LEU 23 2HB LEU 23 11.227 1.161 0.678
187 2HB LEU 23 1HB LEU 23 11.881 -0.095 -0.143
188 HG LEU 23 HG LEU 23 10.652 -0.766 1.394
189 1HD1 LEU 23 1HD1 LEU 23 10.772 -1.079 1.776
190 2HD1 LEU 23 2HD1 LEU 23 10.596 -1.066 1.676
191 3HD1 LEU 23 3HD1 LEU 23 10.734 -1.293 1.886
192 1HD2 LEU 23 1HD2 LEU 23 10.364 -0.782 2.079
193 2HD2 LEU 23 2HD2 LEU 23 10.124 -1.265 2.266
194 3HD2 LEU 23 3HD2 LEU 23 10.037 -1.025 2.074
195 H ALA 24 H ALA 24 14.778 0.825 -0.402
196 HA ALA 24 HA ALA 24 15.505 -1.884 -0.770
197 1HB ALA 24 1HB ALA 24 16.666 -0.102 -2.068
198 2HB ALA 24 2HB ALA 24 16.594 -0.249 -2.182
199 3HB ALA 24 3HB ALA 24 16.768 -0.273 -2.086
200 H GLY 25 H GLY 25 16.696 0.782 1.156
201 1HA GLY 25 2HA GLY 25 19.136 -0.381 1.963
202 2HA GLY 25 1HA GLY 25 18.247 0.853 2.838
203 H ALA 26 H ALA 26 15.851 -0.906 2.896
204 HA ALA 26 HA ALA 26 16.454 -2.232 5.343
205 1HB ALA 26 1HB ALA 26 14.061 -2.297 4.817
206 2HB ALA 26 2HB ALA 26 14.099 -1.977 4.433
207 3HB ALA 26 3HB ALA 26 14.168 -1.820 4.901
208 H GLY 27 H GLY 27 16.538 -3.098 2.067
209 1HA GLY 27 2HA GLY 27 17.522 -5.115 1.350
210 2HA GLY 27 1HA GLY 27 17.013 -5.869 2.841
211 H LEU 28 H LEU 28 14.719 -4.011 0.930
212 HA LEU 28 HA LEU 28 13.594 -6.543 0.032
213 1HB LEU 28 2HB LEU 28 11.698 -4.373 0.575
214 2HB LEU 28 1HB LEU 28 11.522 -6.090 0.791
215 HG LEU 28 HG LEU 28 13.275 -5.621 2.735
216 1HD1 LEU 28 1HD1 LEU 28 12.735 -3.361 3.022
217 2HD1 LEU 28 2HD1 LEU 28 12.471 -3.303 2.867
218 3HD1 LEU 28 3HD1 LEU 28 12.745 -3.264 2.724
219 1HD2 LEU 28 1HD2 LEU 28 10.943 -5.782 3.380
220 2HD2 LEU 28 2HD2 LEU 28 10.962 -5.809 3.411
221 3HD2 LEU 28 3HD2 LEU 28 10.941 -5.831 3.382
222 H THR 29 H THR 29 11.893 -6.235 -1.694
223 HA THR 29 HA THR 29 13.022 -4.526 -3.753
224 HB THR 29 HB THR 29 10.985 -6.729 -3.855
225 HG1 THR 29 1HG THR 29 13.279 -7.091 -4.360
226 1HG2 THR 29 1HG2 THR 29 11.164 -5.791 -6.016
227 2HG2 THR 29 2HG2 THR 29 11.390 -5.672 -6.046
228 3HG2 THR 29 3HG2 THR 29 11.181 -5.534 -5.976
229 H CYS 30 H CYS 30 12.217 -2.577 -3.999
230 HA CYS 30 HA CYS 30 9.416 -2.073 -3.337
231 1HB CYS 30 2HB CYS 30 10.959 -0.463 -2.501
232 2HB CYS 30 1HB CYS 30 11.230 -0.175 -3.007
233 HG CYS 30 HG CYS 30 10.467 0.296 -2.591
234 H THR 31 H THR 31 8.137 -1.965 -5.033
235 HA THR 31 HA THR 31 9.103 -0.565 -7.429
236 HB THR 31 HB THR 31 8.711 -3.130 -7.626
237 HG1 THR 31 1HG THR 31 8.080 -1.801 -9.471
238 1HG2 THR 31 1HG2 THR 31 6.365 -3.201 -7.332
239 2HG2 THR 31 2HG2 THR 31 6.286 -3.137 -7.700
240 3HG2 THR 31 3HG2 THR 31 6.224 -2.865 -7.440
241 H THR 32 H THR 32 7.583 0.836 -8.398
242 HA THR 32 HA THR 32 5.218 1.353 -6.765
243 HB THR 32 HB THR 32 5.459 3.716 -7.244
244 HG1 THR 32 1HG THR 32 6.955 3.700 -8.894
245 1HG2 THR 32 1HG2 THR 32 7.424 3.228 -5.905
246 2HG2 THR 32 2HG2 THR 32 7.383 3.124 -5.870
247 3HG2 THR 32 3HG2 THR 32 7.339 3.223 -5.824
248 H PHE 33 H PHE 33 3.459 2.485 -7.842
249 HA PHE 33 HA PHE 33 3.249 1.872 -10.688
250 1HB PHE 33 2HB PHE 33 1.153 1.258 -8.636
251 2HB PHE 33 1HB PHE 33 1.016 0.995 -10.351
252 HD1 PHE 33 1HD PHE 33 1.813 -0.853 -10.279
253 HD2 PHE 33 2HD PHE 33 2.879 -0.171 -8.390
254 HE1 PHE 33 1HE PHE 33 2.771 -3.088 -10.001
255 HE2 PHE 33 2HE PHE 33 3.847 -2.402 -8.109
256 HZ PHE 33 HZ PHE 33 3.780 -3.881 -8.922
257 H GLU 34 H GLU 34 1.110 2.837 -11.574
258 HA GLU 34 HA GLU 34 1.313 5.604 -11.400
259 1HB GLU 34 2HB GLU 34 -0.594 5.656 -12.877
260 2HB GLU 34 1HB GLU 34 0.464 4.397 -13.347
261 1HG GLU 34 2HG GLU 34 -1.351 3.323 -12.565
262 2HG GLU 34 1HG GLU 34 -1.605 3.718 -12.273
263 H ASN 35 H ASN 35 -1.175 3.625 -10.012
264 HA ASN 35 HA ASN 35 -1.645 5.454 -7.956
265 1HB ASN 35 2HB ASN 35 -3.429 5.740 -9.721
266 2HB ASN 35 1HB ASN 35 -3.795 5.538 -9.238
267 1HD2 ASN 35 1HD2 ASN 35 -3.711 6.695 -9.146
268 2HD2 ASN 35 2HD2 ASN 35 -4.039 7.294 -9.147
269 H GLY 36 H GLY 36 -3.290 2.985 -8.949
270 1HA GLY 36 2HA GLY 36 -3.054 1.267 -6.919
271 2HA GLY 36 1HA GLY 36 -4.653 1.931 -7.060
272 H ASN 37 H ASN 37 -4.992 1.835 -9.784
273 HA ASN 37 HA ASN 37 -5.859 -0.771 -10.144
274 1HB ASN 37 2HB ASN 37 -5.921 1.597 -11.688
275 2HB ASN 37 1HB ASN 37 -5.678 0.326 -12.636
276 1HD2 ASN 37 1HD2 ASN 37 -7.733 -0.324 -10.389
277 2HD2 ASN 37 2HD2 ASN 37 -9.010 -0.349 -10.875
278 H GLU 38 H GLU 38 -2.884 0.792 -11.054
279 HA GLU 38 HA GLU 38 -1.924 -1.047 -12.892
280 1HB GLU 38 2HB GLU 38 -0.934 1.174 -11.748
281 2HB GLU 38 1HB GLU 38 0.059 0.042 -11.115
282 1HG GLU 38 2HG GLU 38 0.195 -0.075 -13.393
283 2HG GLU 38 1HG GLU 38 0.200 0.626 -13.455
284 H VAL 39 H VAL 39 -1.263 -0.986 -9.342
285 HA VAL 39 HA VAL 39 0.223 -3.329 -9.255
286 HB VAL 39 HB VAL 39 -1.702 -2.526 -7.107
287 1HG1 VAL 39 1HG1 VAL 39 0.106 -4.093 -6.540
288 2HG1 VAL 39 2HG1 VAL 39 -0.098 -4.154 -6.533
289 3HG1 VAL 39 3HG1 VAL 39 -0.020 -4.033 -6.374
290 1HG2 VAL 39 1HG2 VAL 39 0.272 -1.145 -7.207
291 2HG2 VAL 39 2HG2 VAL 39 0.326 -1.160 -7.083
292 3HG2 VAL 39 3HG2 VAL 39 0.163 -1.177 -7.113
293 H LEU 40 H LEU 40 -3.253 -2.912 -9.289
294 HA LEU 40 HA LEU 40 -4.041 -5.497 -8.658
295 1HB LEU 40 2HB LEU 40 -5.430 -3.819 -10.709
296 2HB LEU 40 1HB LEU 40 -6.130 -4.980 -9.618
297 HG LEU 40 HG LEU 40 -5.010 -2.302 -8.863
298 1HD1 LEU 40 1HD1 LEU 40 -7.389 -2.294 -8.919
299 2HD1 LEU 40 2HD1 LEU 40 -7.497 -2.591 -9.021
300 3HD1 LEU 40 3HD1 LEU 40 -7.369 -2.379 -9.238
301 1HD2 LEU 40 1HD2 LEU 40 -5.571 -3.667 -6.970
302 2HD2 LEU 40 2HD2 LEU 40 -5.545 -3.744 -6.997
303 3HD2 LEU 40 3HD2 LEU 40 -5.622 -3.728 -6.965
304 H ALA 41 H ALA 41 -3.207 -4.091 -11.783
305 HA ALA 41 HA ALA 41 -3.711 -6.422 -13.286
306 1HB ALA 41 1HB ALA 41 -2.509 -4.523 -14.398
307 2HB ALA 41 2HB ALA 41 -2.837 -4.400 -14.364
308 3HB ALA 41 3HB ALA 41 -2.772 -4.687 -14.560
309 H ALA 42 H ALA 42 -0.763 -4.998 -12.049
310 HA ALA 42 HA ALA 42 0.985 -6.984 -12.997
311 1HB ALA 42 1HB ALA 42 1.977 -5.351 -11.543
312 2HB ALA 42 2HB ALA 42 1.903 -5.361 -11.377
313 3HB ALA 42 3HB ALA 42 1.846 -5.237 -11.496
314 H LEU 43 H LEU 43 -0.964 -6.714 -10.130
315 HA LEU 43 HA LEU 43 0.264 -8.709 -8.600
316 1HB LEU 43 2HB LEU 43 -2.383 -7.384 -8.592
317 2HB LEU 43 1HB LEU 43 -2.180 -8.836 -7.650
318 HG LEU 43 HG LEU 43 -0.350 -6.520 -7.339
319 1HD1 LEU 43 1HD1 LEU 43 -2.464 -6.246 -6.127
320 2HD1 LEU 43 2HD1 LEU 43 -2.323 -6.105 -6.163
321 3HD1 LEU 43 3HD1 LEU 43 -2.321 -6.209 -5.987
322 1HD2 LEU 43 1HD2 LEU 43 -0.400 -8.367 -5.718
323 2HD2 LEU 43 2HD2 LEU 43 -0.156 -8.161 -5.631
324 3HD2 LEU 43 3HD2 LEU 43 -0.126 -8.370 -5.881
325 H ALA 44 H ALA 44 -1.888 -8.868 -11.272
326 HA ALA 44 HA ALA 44 -3.080 -11.344 -10.887
327 1HB ALA 44 1HB ALA 44 -2.952 -10.458 -13.243
328 2HB ALA 44 2HB ALA 44 -3.186 -10.243 -13.071
329 3HB ALA 44 3HB ALA 44 -3.265 -10.593 -13.122
330 H SER 45 H SER 45 0.196 -10.611 -11.529
331 HA SER 45 HA SER 45 0.719 -13.425 -12.056
332 1HB SER 45 2HB SER 45 1.484 -11.552 -13.712
333 2HB SER 45 1HB SER 45 2.577 -11.701 -13.120
334 HG SER 45 HG SER 45 2.301 -12.999 -14.094
335 H LYS 46 H LYS 46 1.014 -11.132 -9.740
336 HA LYS 46 HA LYS 46 2.973 -12.638 -8.330
337 1HB LYS 46 2HB LYS 46 4.062 -10.767 -9.928
338 2HB LYS 46 1HB LYS 46 3.818 -9.839 -8.479
339 1HG LYS 46 2HG LYS 46 4.959 -12.089 -7.700
340 2HG LYS 46 1HG LYS 46 5.740 -11.755 -8.938
341 1HD LYS 46 2HD LYS 46 5.982 -9.845 -7.930
342 2HD LYS 46 1HD LYS 46 5.665 -10.442 -6.859
343 1HE LYS 46 2HE LYS 46 7.463 -11.090 -6.974
344 2HE LYS 46 1HE LYS 46 7.544 -11.199 -7.637
345 1HZ LYS 46 1HZ LYS 46 7.896 -10.055 -7.144
346 2HZ LYS 46 2HZ LYS 46 8.149 -10.319 -7.525
347 3HZ LYS 46 3HZ LYS 46 8.253 -10.461 -7.043
348 H THR 47 H THR 47 3.303 -11.848 -6.125
349 HA THR 47 HA THR 47 1.321 -9.958 -5.211
350 HB THR 47 HB THR 47 1.674 -12.714 -4.086
351 HG1 THR 47 1HG THR 47 -0.186 -12.323 -5.380
352 1HG2 THR 47 1HG2 THR 47 0.300 -11.329 -2.672
353 2HG2 THR 47 2HG2 THR 47 0.326 -11.246 -2.663
354 3HG2 THR 47 3HG2 THR 47 0.372 -11.311 -2.629
355 HA PRO 48 HA PRO 48 5.047 -8.825 -2.972
356 1HB PRO 48 2HB PRO 48 4.192 -6.432 -2.096
357 2HB PRO 48 1HB PRO 48 4.706 -6.693 -3.764
358 1HG PRO 48 2HG PRO 48 1.956 -6.566 -2.636
359 2HG PRO 48 1HG PRO 48 2.577 -5.885 -4.140
360 1HD PRO 48 2HD PRO 48 1.166 -8.201 -4.010
361 2HD PRO 48 1HD PRO 48 2.339 -7.846 -5.274
362 H ASP 49 H ASP 49 5.581 -8.471 -0.729
363 HA ASP 49 HA ASP 49 3.826 -9.876 1.030
364 1HB ASP 49 2HB ASP 49 6.410 -8.516 1.545
365 2HB ASP 49 1HB ASP 49 5.622 -9.382 2.683
366 H VAL 50 H VAL 50 4.469 -6.541 0.349
367 HA VAL 50 HA VAL 50 2.368 -5.771 2.213
368 HB VAL 50 HB VAL 50 4.422 -5.504 3.486
369 1HG1 VAL 50 1HG1 VAL 50 5.761 -4.306 1.785
370 2HG1 VAL 50 2HG1 VAL 50 5.856 -4.410 1.905
371 3HG1 VAL 50 3HG1 VAL 50 5.812 -4.236 1.948
372 1HG2 VAL 50 1HG2 VAL 50 3.373 -3.217 3.342
373 2HG2 VAL 50 2HG2 VAL 50 3.527 -3.279 3.610
374 3HG2 VAL 50 3HG2 VAL 50 3.248 -3.413 3.555
375 H LEU 51 H LEU 51 1.304 -4.192 1.215
376 HA LEU 51 HA LEU 51 2.165 -2.829 -1.142
377 1HB LEU 51 2HB LEU 51 0.368 -4.589 -1.428
378 2HB LEU 51 1HB LEU 51 -0.700 -3.514 -0.582
379 HG LEU 51 HG LEU 51 -0.369 -1.832 -2.331
380 1HD1 LEU 51 1HD1 LEU 51 1.321 -2.860 -3.690
381 2HD1 LEU 51 2HD1 LEU 51 1.169 -2.963 -3.814
382 3HD1 LEU 51 3HD1 LEU 51 1.269 -3.074 -3.651
383 1HD2 LEU 51 1HD2 LEU 51 -1.681 -3.717 -3.265
384 2HD2 LEU 51 2HD2 LEU 51 -1.683 -3.550 -3.372
385 3HD2 LEU 51 3HD2 LEU 51 -1.803 -3.568 -3.210
386 H LEU 52 H LEU 52 1.967 -0.682 -1.248
387 HA LEU 52 HA LEU 52 0.551 0.725 0.908
388 1HB LEU 52 2HB LEU 52 3.230 0.786 0.405
389 2HB LEU 52 1HB LEU 52 2.686 2.162 -0.459
390 HG LEU 52 HG LEU 52 2.112 1.734 2.418
391 1HD1 LEU 52 1HD1 LEU 52 4.150 2.947 2.175
392 2HD1 LEU 52 2HD1 LEU 52 4.255 2.898 1.799
393 3HD1 LEU 52 3HD1 LEU 52 4.313 2.606 2.058
394 1HD2 LEU 52 1HD2 LEU 52 1.548 3.879 1.481
395 2HD2 LEU 52 2HD2 LEU 52 1.312 3.796 1.580
396 3HD2 LEU 52 3HD2 LEU 52 1.365 3.786 1.318
397 H SER 53 H SER 53 -1.112 1.917 0.194
398 HA SER 53 HA SER 53 -1.078 2.809 -2.599
399 1HB SER 53 2HB SER 53 -3.091 1.543 -1.176
400 2HB SER 53 1HB SER 53 -3.648 2.739 -1.833
401 HG SER 53 HG SER 53 -3.064 1.464 -3.161
402 H ASP 54 H ASP 54 -1.448 4.859 -3.092
403 HA ASP 54 HA ASP 54 -1.374 6.772 -0.979
404 1HB ASP 54 2HB ASP 54 -0.568 7.422 -3.104
405 2HB ASP 54 1HB ASP 54 -1.097 7.390 -3.548
406 H ILE 55 H ILE 55 -3.647 6.826 -1.942
407 HA ILE 55 HA ILE 55 -5.956 6.769 -2.532
408 HB ILE 55 HB ILE 55 -5.957 6.226 -0.221
409 1HG1 ILE 55 2HG1 ILE 55 -7.566 8.466 -0.486
410 2HG1 ILE 55 1HG1 ILE 55 -7.923 7.391 -0.990
411 1HG2 ILE 55 1HG2 ILE 55 -5.071 8.286 0.743
412 2HG2 ILE 55 2HG2 ILE 55 -4.930 8.138 0.739
413 3HG2 ILE 55 3HG2 ILE 55 -5.067 8.151 0.900
414 1HD1 ILE 55 1HD1 ILE 55 -8.228 7.539 0.942
415 2HD1 ILE 55 2HD1 ILE 55 -8.361 7.312 0.694
416 3HD1 ILE 55 3HD1 ILE 55 -8.371 7.471 0.517
417 H ARG 56 H ARG 56 -6.032 8.375 -3.869
418 HA ARG 56 HA ARG 56 -6.567 10.931 -3.399
419 1HB ARG 56 2HB ARG 56 -4.825 11.180 -4.308
420 2HB ARG 56 1HB ARG 56 -4.913 10.982 -4.374
421 1HG ARG 56 2HG ARG 56 -4.461 11.219 -4.501
422 2HG ARG 56 1HG ARG 56 -4.576 11.517 -4.740
423 1HD ARG 56 2HD ARG 56 -3.864 12.339 -4.579
424 2HD ARG 56 1HD ARG 56 -3.534 12.176 -4.603
425 HE ARG 56 HE ARG 56 -3.040 12.844 -5.180
426 1HH1 ARG 56 1HH1 ARG 56 -3.527 12.932 -4.682
427 2HH1 ARG 56 2HH1 ARG 56 -2.949 13.716 -4.992
428 1HH2 ARG 56 1HH2 ARG 56 -2.284 13.874 -5.587
429 2HH2 ARG 56 2HH2 ARG 56 -2.246 14.250 -5.505
430 H MET 57 H MET 57 -8.054 9.495 -4.282
431 HA MET 57 HA MET 57 -9.206 9.886 -5.697
432 1HB MET 57 2HB MET 57 -8.263 11.125 -5.611
433 2HB MET 57 1HB MET 57 -8.434 10.772 -6.644
434 1HG MET 57 2HG MET 57 -9.237 10.807 -6.927
435 2HG MET 57 1HG MET 57 -9.410 11.065 -6.344
436 1HE MET 57 1HE MET 57 -10.067 12.760 -7.015
437 2HE MET 57 2HE MET 57 -10.043 12.776 -7.392
438 3HE MET 57 3HE MET 57 -9.882 13.038 -7.182
439 HA PRO 58 HA PRO 58 -8.441 7.648 -8.987
440 1HB PRO 58 2HB PRO 58 -8.649 5.250 -8.022
441 2HB PRO 58 1HB PRO 58 -7.251 5.965 -8.075
442 1HG PRO 58 2HG PRO 58 -8.824 5.565 -5.946
443 2HG PRO 58 1HG PRO 58 -7.236 5.416 -5.937
444 1HD PRO 58 2HD PRO 58 -8.426 7.373 -5.223
445 2HD PRO 58 1HD PRO 58 -7.086 7.469 -5.909
446 H GLY 59 H GLY 59 -10.452 5.518 -7.773
447 1HA GLY 59 2HA GLY 59 -12.459 6.440 -9.141
448 2HA GLY 59 1HA GLY 59 -12.306 4.846 -8.552
449 H MET 60 H MET 60 -12.170 5.181 -6.126
450 HA MET 60 HA MET 60 -14.281 6.503 -5.070
451 1HB MET 60 2HB MET 60 -14.306 3.913 -5.199
452 2HB MET 60 1HB MET 60 -13.329 4.006 -3.854
453 1HG MET 60 2HG MET 60 -15.194 4.189 -2.813
454 2HG MET 60 1HG MET 60 -15.349 5.422 -3.325
455 1HE MET 60 1HE MET 60 -17.329 3.852 -3.309
456 2HE MET 60 2HE MET 60 -17.431 3.945 -3.423
457 3HE MET 60 3HE MET 60 -17.395 4.062 -3.574
458 H ASP 61 H ASP 61 -12.428 8.049 -5.001
459 HA ASP 61 HA ASP 61 -11.147 9.316 -3.780
460 1HB ASP 61 2HB ASP 61 -12.654 8.073 -1.936
461 2HB ASP 61 1HB ASP 61 -11.350 8.319 -1.325
462 H GLY 62 H GLY 62 -10.613 6.151 -2.967
463 1HA GLY 62 2HA GLY 62 -8.136 5.688 -3.723
464 2HA GLY 62 1HA GLY 62 -8.030 6.275 -2.087
465 H LEU 63 H LEU 63 -10.538 5.046 -1.313
466 HA LEU 63 HA LEU 63 -9.524 2.574 -0.482
467 1HB LEU 63 2HB LEU 63 -12.387 3.356 -0.408
468 2HB LEU 63 1HB LEU 63 -11.595 2.251 0.589
469 HG LEU 63 HG LEU 63 -10.284 4.359 1.197
470 1HD1 LEU 63 1HD1 LEU 63 -11.937 5.766 0.596
471 2HD1 LEU 63 2HD1 LEU 63 -12.086 5.727 0.612
472 3HD1 LEU 63 3HD1 LEU 63 -11.959 5.765 0.471
473 1HD2 LEU 63 1HD2 LEU 63 -11.948 3.828 2.772
474 2HD2 LEU 63 2HD2 LEU 63 -11.989 3.743 2.779
475 3HD2 LEU 63 3HD2 LEU 63 -12.002 3.806 2.699
476 H ALA 64 H ALA 64 -11.125 3.605 -3.302
477 HA ALA 64 HA ALA 64 -12.514 1.354 -4.114
478 1HB ALA 64 1HB ALA 64 -11.657 2.743 -6.063
479 2HB ALA 64 2HB ALA 64 -11.733 3.214 -5.663
480 3HB ALA 64 3HB ALA 64 -12.214 2.853 -5.813
481 H LEU 65 H LEU 65 -9.098 2.057 -4.241
482 HA LEU 65 HA LEU 65 -8.244 -0.047 -5.838
483 1HB LEU 65 2HB LEU 65 -6.706 1.226 -4.260
484 2HB LEU 65 1HB LEU 65 -6.464 0.809 -4.471
485 HG LEU 65 HG LEU 65 -6.546 1.479 -4.871
486 1HD1 LEU 65 1HD1 LEU 65 -5.874 1.641 -4.761
487 2HD1 LEU 65 2HD1 LEU 65 -5.566 1.498 -4.741
488 3HD1 LEU 65 3HD1 LEU 65 -5.689 1.483 -4.852
489 1HD2 LEU 65 1HD2 LEU 65 -5.363 2.134 -5.318
490 2HD2 LEU 65 2HD2 LEU 65 -5.512 1.875 -5.088
491 3HD2 LEU 65 3HD2 LEU 65 -5.690 1.857 -4.891
492 H LEU 66 H LEU 66 -8.729 0.112 -2.363
493 HA LEU 66 HA LEU 66 -7.770 -2.383 -1.662
494 1HB LEU 66 2HB LEU 66 -10.000 -0.800 -0.461
495 2HB LEU 66 1HB LEU 66 -9.324 -2.188 0.265
496 HG LEU 66 HG LEU 66 -7.796 -0.167 0.085
497 1HD1 LEU 66 1HD1 LEU 66 -8.257 0.060 0.890
498 2HD1 LEU 66 2HD1 LEU 66 -8.266 0.056 1.135
499 3HD1 LEU 66 3HD1 LEU 66 -8.189 0.296 1.040
500 1HD2 LEU 66 1HD2 LEU 66 -7.355 -0.750 1.053
501 2HD2 LEU 66 2HD2 LEU 66 -7.013 -0.455 0.950
502 3HD2 LEU 66 3HD2 LEU 66 -7.211 -0.787 0.740
503 H LYS 67 H LYS 67 -11.000 -1.417 -2.682
504 HA LYS 67 HA LYS 67 -12.326 -3.817 -2.382
505 1HB LYS 67 2HB LYS 67 -12.878 -1.566 -3.842
506 2HB LYS 67 1HB LYS 67 -13.329 -2.598 -4.541
507 1HG LYS 67 2HG LYS 67 -14.278 -2.781 -2.984
508 2HG LYS 67 1HG LYS 67 -14.047 -2.081 -2.795
509 1HD LYS 67 2HD LYS 67 -14.982 -1.539 -3.440
510 2HD LYS 67 1HD LYS 67 -15.376 -2.146 -3.744
511 1HE LYS 67 2HE LYS 67 -16.192 -1.940 -2.832
512 2HE LYS 67 1HE LYS 67 -15.958 -1.491 -3.010
513 1HZ LYS 67 1HZ LYS 67 -16.954 -1.965 -2.973
514 2HZ LYS 67 2HZ LYS 67 -17.070 -1.902 -3.277
515 3HZ LYS 67 3HZ LYS 67 -16.841 -1.759 -3.024
516 H GLN 68 H GLN 68 -10.509 -2.660 -5.200
517 HA GLN 68 HA GLN 68 -10.913 -4.969 -6.766
518 1HB GLN 68 2HB GLN 68 -8.639 -3.017 -6.920
519 2HB GLN 68 1HB GLN 68 -9.136 -4.109 -8.170
520 1HG GLN 68 2HG GLN 68 -10.731 -2.014 -7.384
521 2HG GLN 68 1HG GLN 68 -10.049 -1.930 -8.382
522 1HE2 GLN 68 1HE2 GLN 68 -11.208 -2.240 -8.843
523 2HE2 GLN 68 2HE2 GLN 68 -12.176 -2.664 -9.391
524 H ILE 69 H ILE 69 -8.503 -4.072 -4.408
525 HA ILE 69 HA ILE 69 -6.608 -6.043 -4.939
526 HB ILE 69 HB ILE 69 -7.264 -4.661 -2.363
527 1HG1 ILE 69 2HG1 ILE 69 -5.124 -4.068 -4.229
528 2HG1 ILE 69 1HG1 ILE 69 -6.365 -3.296 -4.186
529 1HG2 ILE 69 1HG2 ILE 69 -5.351 -6.135 -2.142
530 2HG2 ILE 69 2HG2 ILE 69 -5.346 -6.105 -2.189
531 3HG2 ILE 69 3HG2 ILE 69 -5.351 -6.159 -2.181
532 1HD1 ILE 69 1HD1 ILE 69 -5.130 -2.901 -2.624
533 2HD1 ILE 69 2HD1 ILE 69 -5.184 -2.783 -2.582
534 3HD1 ILE 69 3HD1 ILE 69 -5.129 -2.752 -2.695
535 H LYS 70 H LYS 70 -9.401 -6.089 -2.860
536 HA LYS 70 HA LYS 70 -8.893 -8.648 -1.785
537 1HB LYS 70 2HB LYS 70 -11.090 -8.507 -0.824
538 2HB LYS 70 1HB LYS 70 -10.288 -6.960 -0.666
539 1HG LYS 70 2HG LYS 70 -11.789 -6.040 -2.064
540 2HG LYS 70 1HG LYS 70 -12.001 -7.264 -2.915
541 1HD LYS 70 2HD LYS 70 -13.140 -7.773 -1.363
542 2HD LYS 70 1HD LYS 70 -13.078 -6.952 -0.891
543 1HE LYS 70 2HE LYS 70 -14.435 -6.561 -1.681
544 2HE LYS 70 1HE LYS 70 -14.000 -6.845 -1.989
545 1HZ LYS 70 1HZ LYS 70 -15.390 -7.089 -1.655
546 2HZ LYS 70 2HZ LYS 70 -15.171 -6.848 -1.903
547 3HZ LYS 70 3HZ LYS 70 -15.114 -6.867 -1.587
548 H GLN 71 H GLN 71 -10.489 -7.516 -4.619
549 HA GLN 71 HA GLN 71 -11.929 -9.879 -5.137
550 1HB GLN 71 2HB GLN 71 -11.836 -7.635 -6.414
551 2HB GLN 71 1HB GLN 71 -11.649 -8.337 -7.262
552 1HG GLN 71 2HG GLN 71 -13.186 -9.152 -7.210
553 2HG GLN 71 1HG GLN 71 -13.414 -8.384 -6.190
554 1HE2 GLN 71 1HE2 GLN 71 -11.860 -6.323 -6.297
555 2HE2 GLN 71 2HE2 GLN 71 -12.493 -5.406 -7.487
556 H ARG 72 H ARG 72 -8.841 -8.700 -6.114
557 HA ARG 72 HA ARG 72 -8.390 -11.060 -7.706
558 1HB ARG 72 2HB ARG 72 -6.998 -8.500 -7.482
559 2HB ARG 72 1HB ARG 72 -6.225 -9.813 -8.202
560 1HG ARG 72 2HG ARG 72 -8.068 -9.649 -9.616
561 2HG ARG 72 1HG ARG 72 -8.406 -8.663 -9.211
562 1HD ARG 72 2HD ARG 72 -7.221 -7.995 -9.898
563 2HD ARG 72 1HD ARG 72 -6.688 -8.772 -10.057
564 HE ARG 72 HE ARG 72 -7.886 -8.375 -11.067
565 1HH1 ARG 72 1HH1 ARG 72 -7.543 -9.077 -11.338
566 2HH1 ARG 72 2HH1 ARG 72 -8.023 -9.231 -12.672
567 1HH2 ARG 72 1HH2 ARG 72 -8.516 -8.579 -12.819
568 2HH2 ARG 72 2HH2 ARG 72 -8.575 -8.950 -13.512
569 H HIS 73 H HIS 73 -7.011 -9.496 -4.975
570 HA HIS 73 HA HIS 73 -5.350 -11.736 -4.469
571 1HB HIS 73 2HB HIS 73 -4.735 -9.660 -3.002
572 2HB HIS 73 1HB HIS 73 -3.893 -10.286 -3.766
573 HD1 HIS 73 1HD HIS 73 -3.876 -9.676 -4.432
574 HD2 HIS 73 2HD HIS 73 -5.127 -7.723 -4.981
575 HE1 HIS 73 1HE HIS 73 -3.841 -7.922 -5.636
576 HE2 HIS 73 2HE HIS 73 -4.631 -6.765 -5.935
577 HA PRO 74 HA PRO 74 -7.643 -12.569 -1.169
578 1HB PRO 74 2HB PRO 74 -6.212 -13.872 0.014
579 2HB PRO 74 1HB PRO 74 -7.025 -14.246 -1.165
580 1HG PRO 74 2HG PRO 74 -4.836 -14.034 -1.320
581 2HG PRO 74 1HG PRO 74 -5.721 -14.534 -2.347
582 1HD PRO 74 2HD PRO 74 -4.583 -12.568 -2.571
583 2HD PRO 74 1HD PRO 74 -5.456 -13.019 -3.655
584 H MET 75 H MET 75 -5.337 -11.714 0.088
585 HA MET 75 HA MET 75 -6.180 -10.495 1.956
586 1HB MET 75 2HB MET 75 -4.749 -12.554 2.430
587 2HB MET 75 1HB MET 75 -4.986 -11.694 3.366
588 1HG MET 75 2HG MET 75 -6.844 -12.295 3.202
589 2HG MET 75 1HG MET 75 -6.720 -13.012 2.454
590 1HE MET 75 1HE MET 75 -7.061 -14.621 3.888
591 2HE MET 75 2HE MET 75 -7.169 -14.817 3.902
592 3HE MET 75 3HE MET 75 -7.180 -14.916 3.941
593 H LEU 76 H LEU 76 -4.472 -9.714 -0.168
594 HA LEU 76 HA LEU 76 -1.870 -9.333 0.699
595 1HB LEU 76 2HB LEU 76 -2.933 -9.076 -1.624
596 2HB LEU 76 1HB LEU 76 -3.163 -7.470 -1.166
597 HG LEU 76 HG LEU 76 -1.023 -8.071 -1.489
598 1HD1 LEU 76 1HD1 LEU 76 -0.437 -7.767 -2.042
599 2HD1 LEU 76 2HD1 LEU 76 -0.698 -7.657 -1.783
600 3HD1 LEU 76 3HD1 LEU 76 -0.713 -7.799 -1.905
601 1HD2 LEU 76 1HD2 LEU 76 -0.507 -7.543 -1.531
602 2HD2 LEU 76 2HD2 LEU 76 -0.528 -7.722 -1.664
603 3HD2 LEU 76 3HD2 LEU 76 -0.429 -7.655 -1.432
604 HA PRO 77 HA PRO 77 -2.710 -6.163 3.745
605 1HB PRO 77 2HB PRO 77 0.046 -5.780 3.968
606 2HB PRO 77 1HB PRO 77 -0.905 -6.567 5.013
607 1HG PRO 77 2HG PRO 77 0.757 -7.563 3.441
608 2HG PRO 77 1HG PRO 77 -0.185 -8.274 4.338
609 1HD PRO 77 2HD PRO 77 -0.094 -8.304 1.686
610 2HD PRO 77 1HD PRO 77 -1.073 -9.227 2.695
611 H VAL 78 H VAL 78 -3.244 -4.165 3.238
612 HA VAL 78 HA VAL 78 -1.597 -2.652 1.360
613 HB VAL 78 HB VAL 78 -4.509 -2.131 1.785
614 1HG1 VAL 78 1HG1 VAL 78 -3.299 -0.932 0.023
615 2HG1 VAL 78 2HG1 VAL 78 -3.479 -0.910 0.011
616 3HG1 VAL 78 3HG1 VAL 78 -3.395 -1.029 -0.099
617 1HG2 VAL 78 1HG2 VAL 78 -4.360 -3.814 0.062
618 2HG2 VAL 78 2HG2 VAL 78 -4.234 -4.044 0.383
619 3HG2 VAL 78 3HG2 VAL 78 -3.968 -3.948 0.078
620 H ILE 79 H ILE 79 -1.187 -0.506 1.801
621 HA ILE 79 HA ILE 79 -2.061 0.481 4.425
622 HB ILE 79 HB ILE 79 0.633 1.059 3.228
623 1HG1 ILE 79 2HG1 ILE 79 0.745 -0.588 5.575
624 2HG1 ILE 79 1HG1 ILE 79 -0.219 -1.369 4.356
625 1HG2 ILE 79 1HG2 ILE 79 0.055 2.119 5.314
626 2HG2 ILE 79 2HG2 ILE 79 0.367 2.000 5.401
627 3HG2 ILE 79 3HG2 ILE 79 0.085 1.874 5.554
628 1HD1 ILE 79 1HD1 ILE 79 2.070 -1.292 3.674
629 2HD1 ILE 79 2HD1 ILE 79 2.093 -1.150 3.765
630 3HD1 ILE 79 3HD1 ILE 79 2.074 -1.148 3.597
631 H ILE 80 H ILE 80 -3.362 2.151 4.100
632 HA ILE 80 HA ILE 80 -2.961 3.845 1.756
633 HB ILE 80 HB ILE 80 -5.292 3.967 3.639
634 1HG1 ILE 80 2HG1 ILE 80 -5.229 1.776 2.692
635 2HG1 ILE 80 1HG1 ILE 80 -6.279 2.427 2.005
636 1HG2 ILE 80 1HG2 ILE 80 -5.337 5.259 1.569
637 2HG2 ILE 80 2HG2 ILE 80 -5.574 5.213 1.618
638 3HG2 ILE 80 3HG2 ILE 80 -5.462 5.100 1.429
639 1HD1 ILE 80 1HD1 ILE 80 -4.771 2.190 0.846
640 2HD1 ILE 80 2HD1 ILE 80 -4.914 1.827 0.651
641 3HD1 ILE 80 3HD1 ILE 80 -4.820 1.770 0.820
642 H MET 81 H MET 81 -2.611 6.016 1.852
643 HA MET 81 HA MET 81 -1.335 7.007 4.197
644 1HB MET 81 2HB MET 81 -0.854 8.739 2.690
645 2HB MET 81 1HB MET 81 -0.924 7.746 1.933
646 1HG MET 81 2HG MET 81 -2.132 8.413 1.209
647 2HG MET 81 1HG MET 81 -2.508 8.881 2.051
648 1HE MET 81 1HE MET 81 -1.792 11.292 0.973
649 2HE MET 81 2HE MET 81 -1.757 11.395 0.743
650 3HE MET 81 3HE MET 81 -1.596 11.201 0.721
651 H THR 82 H THR 82 -4.411 7.740 2.738
652 HA THR 82 HA THR 82 -5.231 9.043 5.158
653 HB THR 82 HB THR 82 -5.988 10.082 2.477
654 HG1 THR 82 1HG THR 82 -4.150 11.178 3.130
655 1HG2 THR 82 1HG2 THR 82 -6.723 11.265 4.456
656 2HG2 THR 82 2HG2 THR 82 -6.810 11.387 4.204
657 3HG2 THR 82 3HG2 THR 82 -6.583 11.501 4.355
658 H ALA 83 H ALA 83 -7.521 9.059 5.533
659 HA ALA 83 HA ALA 83 -8.955 6.990 4.093
660 1HB ALA 83 1HB ALA 83 -9.176 6.775 6.439
661 2HB ALA 83 2HB ALA 83 -9.296 6.750 6.384
662 3HB ALA 83 3HB ALA 83 -9.273 6.854 6.463
663 H HIS 84 H HIS 84 -9.296 9.803 3.952
664 HA HIS 84 HA HIS 84 -11.075 11.224 4.558
665 1HB HIS 84 2HB HIS 84 -11.118 11.268 2.541
666 2HB HIS 84 1HB HIS 84 -10.776 11.817 2.906
667 HD1 HIS 84 1HD HIS 84 -9.833 11.977 2.528
668 HD2 HIS 84 2HD HIS 84 -9.348 11.109 1.106
669 HE1 HIS 84 1HE HIS 84 -8.386 12.109 1.135
670 HE2 HIS 84 2HE HIS 84 -8.104 11.563 0.281
671 H SER 85 H SER 85 -13.037 10.840 3.269
672 HA SER 85 HA SER 85 -14.842 10.308 3.860
673 1HB SER 85 2HB SER 85 -14.696 11.028 2.148
674 2HB SER 85 1HB SER 85 -15.081 10.544 2.148
675 HG SER 85 HG SER 85 -15.448 11.101 2.308
676 H ASP 86 H ASP 86 -14.924 8.208 2.933
677 HA ASP 86 HA ASP 86 -16.523 6.862 2.928
678 1HB ASP 86 2HB ASP 86 -15.217 7.051 0.998
679 2HB ASP 86 1HB ASP 86 -15.197 5.881 1.191
680 H LEU 87 H LEU 87 -14.847 6.773 5.044
681 HA LEU 87 HA LEU 87 -12.897 4.899 5.122
682 1HB LEU 87 2HB LEU 87 -14.359 6.352 6.974
683 2HB LEU 87 1HB LEU 87 -14.452 4.769 7.470
684 HG LEU 87 HG LEU 87 -12.351 6.159 7.552
685 1HD1 LEU 87 1HD1 LEU 87 -12.548 5.431 8.683
686 2HD1 LEU 87 2HD1 LEU 87 -12.440 5.384 8.721
687 3HD1 LEU 87 3HD1 LEU 87 -12.465 5.221 8.763
688 1HD2 LEU 87 1HD2 LEU 87 -11.551 5.074 6.859
689 2HD2 LEU 87 2HD2 LEU 87 -11.741 4.652 7.274
690 3HD2 LEU 87 3HD2 LEU 87 -11.066 5.100 7.568
691 H ASP 88 H ASP 88 -16.231 4.369 4.765
692 HA ASP 88 HA ASP 88 -16.659 1.929 5.819
693 1HB ASP 88 2HB ASP 88 -17.842 3.100 3.660
694 2HB ASP 88 1HB ASP 88 -18.099 1.945 3.683
695 H ALA 89 H ALA 89 -15.287 2.544 2.613
696 HA ALA 89 HA ALA 89 -14.925 -0.170 1.974
697 1HB ALA 89 1HB ALA 89 -14.167 1.400 0.348
698 2HB ALA 89 2HB ALA 89 -13.888 1.365 0.386
699 3HB ALA 89 3HB ALA 89 -14.022 1.584 0.523
700 H ALA 90 H ALA 90 -13.164 2.000 3.937
701 HA ALA 90 HA ALA 90 -10.642 0.739 3.754
702 1HB ALA 90 1HB ALA 90 -10.755 2.423 5.474
703 2HB ALA 90 2HB ALA 90 -11.039 2.509 5.514
704 3HB ALA 90 3HB ALA 90 -10.897 2.573 5.256
705 H VAL 91 H VAL 91 -13.354 0.446 5.935
706 HA VAL 91 HA VAL 91 -12.140 -1.301 7.712
707 HB VAL 91 HB VAL 91 -15.036 -1.359 7.134
708 1HG1 VAL 91 1HG1 VAL 91 -14.208 -2.101 9.330
709 2HG1 VAL 91 2HG1 VAL 91 -14.143 -2.349 9.138
710 3HG1 VAL 91 3HG1 VAL 91 -14.443 -2.302 9.235
711 1HG2 VAL 91 1HG2 VAL 91 -14.433 0.633 8.510
712 2HG2 VAL 91 2HG2 VAL 91 -14.591 0.683 8.178
713 3HG2 VAL 91 3HG2 VAL 91 -14.226 0.728 8.218
714 H SER 92 H SER 92 -14.100 -1.940 4.914
715 HA SER 92 HA SER 92 -14.092 -4.733 5.136
716 1HB SER 92 2HB SER 92 -14.416 -3.754 2.741
717 2HB SER 92 1HB SER 92 -15.041 -4.268 3.152
718 HG SER 92 HG SER 92 -15.434 -3.162 3.170
719 H ALA 93 H ALA 93 -11.745 -2.510 4.112
720 HA ALA 93 HA ALA 93 -10.175 -4.200 2.585
721 1HB ALA 93 1HB ALA 93 -9.406 -1.984 3.084
722 2HB ALA 93 2HB ALA 93 -9.092 -2.148 3.124
723 3HB ALA 93 3HB ALA 93 -9.263 -2.020 3.411
724 H TYR 94 H TYR 94 -10.058 -3.334 5.915
725 HA TYR 94 HA TYR 94 -7.841 -4.820 6.617
726 1HB TYR 94 2HB TYR 94 -10.061 -4.444 8.398
727 2HB TYR 94 1HB TYR 94 -8.519 -4.484 8.789
728 HD1 TYR 94 1HD TYR 94 -9.507 -2.596 8.206
729 HD2 TYR 94 2HD TYR 94 -8.730 -2.559 8.166
730 HE1 TYR 94 1HE TYR 94 -9.428 -0.263 8.318
731 HE2 TYR 94 2HE TYR 94 -8.651 -0.226 8.277
732 HH TYR 94 HH TYR 94 -9.140 1.477 8.513
733 H GLN 95 H GLN 95 -11.025 -5.735 6.055
734 HA GLN 95 HA GLN 95 -10.881 -8.296 7.252
735 1HB GLN 95 2HB GLN 95 -13.024 -8.148 6.787
736 2HB GLN 95 1HB GLN 95 -12.816 -6.905 6.229
737 1HG GLN 95 2HG GLN 95 -12.894 -8.273 5.081
738 2HG GLN 95 1HG GLN 95 -13.332 -8.342 5.211
739 1HE2 GLN 95 1HE2 GLN 95 -13.416 -7.009 3.192
740 2HE2 GLN 95 2HE2 GLN 95 -14.139 -7.404 2.578
741 H GLN 96 H GLN 96 -10.454 -7.065 4.092
742 HA GLN 96 HA GLN 96 -10.044 -9.670 3.039
743 1HB GLN 96 2HB GLN 96 -9.753 -8.477 1.115
744 2HB GLN 96 1HB GLN 96 -10.961 -7.964 1.732
745 1HG GLN 96 2HG GLN 96 -9.879 -6.247 1.875
746 2HG GLN 96 1HG GLN 96 -9.244 -6.621 1.864
747 1HE2 GLN 96 1HE2 GLN 96 -9.225 -5.273 0.854
748 2HE2 GLN 96 2HE2 GLN 96 -9.280 -5.352 0.285
749 H GLY 97 H GLY 97 -8.170 -7.447 4.601
750 1HA GLY 97 2HA GLY 97 -6.095 -8.474 5.074
751 2HA GLY 97 1HA GLY 97 -5.924 -8.547 3.460
752 H ALA 98 H ALA 98 -6.718 -5.954 4.588
753 HA ALA 98 HA ALA 98 -4.740 -4.343 3.763
754 1HB ALA 98 1HB ALA 98 -6.774 -3.174 4.291
755 2HB ALA 98 2HB ALA 98 -6.661 -3.034 4.308
756 3HB ALA 98 3HB ALA 98 -6.739 -3.101 4.459
757 H PHE 99 H PHE 99 -3.325 -3.124 4.996
758 HA PHE 99 HA PHE 99 -2.750 -4.214 7.543
759 1HB PHE 99 2HB PHE 99 -1.047 -3.467 5.869
760 2HB PHE 99 1HB PHE 99 -1.425 -1.826 6.309
761 HD1 PHE 99 1HD PHE 99 -0.817 -4.941 8.096
762 HD2 PHE 99 2HD PHE 99 0.117 -0.909 7.697
763 HE1 PHE 99 1HE PHE 99 0.734 -5.075 9.943
764 HE2 PHE 99 2HE PHE 99 1.673 -1.036 9.543
765 HZ PHE 99 HZ PHE 99 1.983 -3.119 10.668
766 H ASP 100 H ASP 100 -3.562 -0.932 6.424
767 HA ASP 100 HA ASP 100 -5.375 -0.310 8.394
768 1HB ASP 100 2HB ASP 100 -3.231 -0.043 9.701
769 2HB ASP 100 1HB ASP 100 -3.235 0.636 9.562
770 H TYR 101 H TYR 101 -4.916 2.314 8.977
771 HA TYR 101 HA TYR 101 -4.486 3.625 6.393
772 1HB TYR 101 2HB TYR 101 -6.926 3.567 8.047
773 2HB TYR 101 1HB TYR 101 -6.455 5.153 7.460
774 HD1 TYR 101 1HD TYR 101 -7.264 1.718 6.357
775 HD2 TYR 101 2HD TYR 101 -6.878 5.787 5.250
776 HE1 TYR 101 1HE TYR 101 -8.302 1.231 4.185
777 HE2 TYR 101 2HE TYR 101 -7.914 5.310 3.078
778 HH TYR 101 HH TYR 101 -8.728 3.054 1.895
779 H LEU 102 H LEU 102 -3.864 5.838 6.532
780 HA LEU 102 HA LEU 102 -2.597 6.475 9.090
781 1HB LEU 102 2HB LEU 102 -1.738 6.695 6.454
782 2HB LEU 102 1HB LEU 102 -1.785 8.157 7.044
783 HG LEU 102 HG LEU 102 -0.313 7.634 8.570
784 1HD1 LEU 102 1HD1 LEU 102 -0.391 5.498 8.521
785 2HD1 LEU 102 2HD1 LEU 102 -0.012 5.509 8.624
786 3HD1 LEU 102 3HD1 LEU 102 -0.101 5.432 8.247
787 1HD2 LEU 102 1HD2 LEU 102 0.773 7.257 6.518
788 2HD2 LEU 102 2HD2 LEU 102 0.853 7.348 6.724
789 3HD2 LEU 102 3HD2 LEU 102 0.754 7.468 6.550
790 HA PRO 103 HA PRO 103 -5.723 9.581 9.581
791 1HB PRO 103 2HB PRO 103 -4.479 10.679 11.748
792 2HB PRO 103 1HB PRO 103 -5.618 9.468 11.794
793 1HG PRO 103 2HG PRO 103 -2.971 9.287 12.216
794 2HG PRO 103 1HG PRO 103 -4.100 8.220 12.537
795 1HD PRO 103 2HD PRO 103 -2.215 8.023 10.692
796 2HD PRO 103 1HD PRO 103 -3.525 6.965 10.929
797 H LYS 104 H LYS 104 -3.119 11.184 10.697
798 HA LYS 104 HA LYS 104 -3.343 13.183 8.685
799 1HB LYS 104 2HB LYS 104 -2.963 13.503 11.417
800 2HB LYS 104 1HB LYS 104 -2.003 14.266 10.695
801 1HG LYS 104 2HG LYS 104 -3.476 15.268 10.123
802 2HG LYS 104 1HG LYS 104 -4.182 14.634 10.272
803 1HD LYS 104 2HD LYS 104 -4.187 15.214 11.671
804 2HD LYS 104 1HD LYS 104 -3.599 15.366 11.598
805 1HE LYS 104 1HE LYS 104 -4.520 16.328 11.545
806 2HE LYS 104 2HE LYS 104 -4.703 16.500 11.693
807 1HZ LYS 104 1HZ LYS 104 -4.845 16.481 11.741
808 2HZ LYS 104 2HZ LYS 104 -4.873 16.927 11.797
809 3HZ LYS 104 3HZ LYS 104 -4.794 16.689 11.791
810 HA PRO 105 HA PRO 105 1.481 12.809 9.232
811 1HB PRO 105 2HB PRO 105 2.014 10.337 10.369
812 2HB PRO 105 1HB PRO 105 2.322 11.814 11.021
813 1HG PRO 105 2HG PRO 105 0.400 10.127 11.637
814 2HG PRO 105 1HG PRO 105 0.830 11.386 12.393
815 1HD PRO 105 2HD PRO 105 -1.442 11.037 11.274
816 2HD PRO 105 1HD PRO 105 -0.830 12.492 11.827
817 H PHE 106 H PHE 106 2.951 11.673 7.872
818 HA PHE 106 HA PHE 106 2.253 9.270 6.626
819 1HB PHE 106 2HB PHE 106 0.825 10.697 5.412
820 2HB PHE 106 1HB PHE 106 1.819 11.530 5.044
821 HD1 PHE 106 1HD PHE 106 1.552 10.459 3.967
822 HD2 PHE 106 2HD PHE 106 1.776 9.744 3.983
823 HE1 PHE 106 1HE PHE 106 1.572 9.530 2.122
824 HE2 PHE 106 2HE PHE 106 1.797 8.815 2.137
825 HZ PHE 106 HZ PHE 106 1.695 8.705 1.203
826 H ASP 107 H ASP 107 3.681 11.517 4.468
827 HA ASP 107 HA ASP 107 5.750 11.458 3.508
828 1HB ASP 107 2HB ASP 107 7.496 12.244 4.997
829 2HB ASP 107 1HB ASP 107 6.003 13.067 5.349
830 H ILE 108 H ILE 108 8.157 10.530 3.933
831 HA ILE 108 HA ILE 108 7.858 7.737 3.697
832 HB ILE 108 HB ILE 108 9.928 9.593 3.217
833 1HG1 ILE 108 2HG1 ILE 108 10.712 7.914 1.757
834 2HG1 ILE 108 1HG1 ILE 108 9.675 6.734 2.515
835 1HG2 ILE 108 1HG2 ILE 108 11.276 8.247 4.509
836 2HG2 ILE 108 2HG2 ILE 108 11.268 7.987 4.469
837 3HG2 ILE 108 3HG2 ILE 108 11.093 8.076 4.657
838 1HD1 ILE 108 1HD1 ILE 108 8.410 8.027 1.031
839 2HD1 ILE 108 2HD1 ILE 108 8.537 8.249 1.020
840 3HD1 ILE 108 3HD1 ILE 108 8.385 8.231 1.248
841 H ASP 109 H ASP 109 9.095 9.758 6.252
842 HA ASP 109 HA ASP 109 10.132 7.885 7.959
843 1HB ASP 109 2HB ASP 109 9.358 10.425 8.413
844 2HB ASP 109 1HB ASP 109 8.922 9.804 9.375
845 H GLU 110 H GLU 110 6.752 9.052 8.089
846 HA GLU 110 HA GLU 110 6.025 6.982 9.893
847 1HB GLU 110 2HB GLU 110 4.315 8.929 8.475
848 2HB GLU 110 1HB GLU 110 3.773 7.915 9.588
849 1HG GLU 110 2HG GLU 110 5.800 9.612 10.238
850 2HG GLU 110 1HG GLU 110 4.330 10.190 10.084
851 H ALA 111 H ALA 111 5.829 7.439 6.452
852 HA ALA 111 HA ALA 111 3.995 5.350 5.939
853 1HB ALA 111 1HB ALA 111 5.393 6.398 4.026
854 2HB ALA 111 2HB ALA 111 4.896 6.610 4.114
855 3HB ALA 111 3HB ALA 111 4.947 6.114 3.887
856 H VAL 112 H VAL 112 7.524 5.485 5.462
857 HA VAL 112 HA VAL 112 7.862 2.757 4.972
858 HB VAL 112 HB VAL 112 9.864 4.613 6.241
859 1HG1 VAL 112 1HG1 VAL 112 10.656 2.378 5.384
860 2HG1 VAL 112 2HG1 VAL 112 10.702 2.452 5.638
861 3HG1 VAL 112 3HG1 VAL 112 10.853 2.552 5.440
862 1HG2 VAL 112 1HG2 VAL 112 9.728 4.921 3.869
863 2HG2 VAL 112 2HG2 VAL 112 9.581 4.844 3.798
864 3HG2 VAL 112 3HG2 VAL 112 9.742 4.766 3.779
865 H ALA 113 H ALA 113 7.599 4.566 7.903
866 HA ALA 113 HA ALA 113 8.572 2.655 9.720
867 1HB ALA 113 1HB ALA 113 7.073 4.531 10.557
868 2HB ALA 113 2HB ALA 113 7.480 4.719 10.474
869 3HB ALA 113 3HB ALA 113 7.433 4.418 10.811
870 H LEU 114 H LEU 114 5.349 3.374 8.516
871 HA LEU 114 HA LEU 114 4.078 1.286 9.955
872 1HB LEU 114 2HB LEU 114 2.934 3.349 9.313
873 2HB LEU 114 1HB LEU 114 3.104 2.925 7.636
874 HG LEU 114 HG LEU 114 1.703 0.883 8.154
875 1HD1 LEU 114 1HD1 LEU 114 1.111 1.560 10.460
876 2HD1 LEU 114 2HD1 LEU 114 1.221 1.392 10.442
877 3HD1 LEU 114 3HD1 LEU 114 1.042 1.403 10.342
878 1HD2 LEU 114 1HD2 LEU 114 0.363 2.802 7.692
879 2HD2 LEU 114 2HD2 LEU 114 0.426 2.953 7.885
880 3HD2 LEU 114 3HD2 LEU 114 0.243 2.784 7.909
881 H VAL 115 H VAL 115 5.705 1.464 6.919
882 HA VAL 115 HA VAL 115 4.373 -0.824 5.819
883 HB VAL 115 HB VAL 115 5.434 1.029 4.434
884 1HG1 VAL 115 1HG1 VAL 115 7.746 0.459 4.840
885 2HG1 VAL 115 2HG1 VAL 115 7.771 0.440 4.675
886 3HG1 VAL 115 3HG1 VAL 115 7.772 0.307 4.778
887 1HG2 VAL 115 1HG2 VAL 115 5.362 -0.993 3.217
888 2HG2 VAL 115 2HG2 VAL 115 5.497 -1.280 3.442
889 3HG2 VAL 115 3HG2 VAL 115 5.739 -1.080 3.210
890 H GLU 116 H GLU 116 7.513 -0.220 7.310
891 HA GLU 116 HA GLU 116 8.529 -2.826 6.971
892 1HB GLU 116 2HB GLU 116 9.199 -0.664 8.955
893 2HB GLU 116 1HB GLU 116 10.086 -2.171 8.835
894 1HG GLU 116 2HG GLU 116 10.546 -1.572 6.498
895 2HG GLU 116 1HG GLU 116 9.867 -0.084 6.749
896 H ARG 117 H ARG 117 6.799 -1.292 9.645
897 HA ARG 117 HA ARG 117 6.920 -3.458 11.411
898 1HB ARG 117 2HB ARG 117 4.998 -1.792 11.794
899 2HB ARG 117 1HB ARG 117 5.520 -1.839 12.293
900 1HG ARG 117 2HG ARG 117 6.080 -0.861 11.614
901 2HG ARG 117 1HG ARG 117 5.317 -0.978 11.461
902 1HD ARG 117 2HD ARG 117 4.910 -0.343 12.813
903 2HD ARG 117 1HD ARG 117 4.901 -0.644 13.022
904 HE ARG 117 HE ARG 117 5.201 -0.225 13.596
905 1HH1 ARG 117 1HH1 ARG 117 4.599 0.117 13.919
906 2HH1 ARG 117 2HH1 ARG 117 4.435 0.666 14.965
907 1HH2 ARG 117 1HH2 ARG 117 4.985 0.498 14.971
908 2HH2 ARG 117 2HH2 ARG 117 4.654 0.883 15.562
909 H ALA 118 H ALA 118 5.006 -2.900 8.617
910 HA ALA 118 HA ALA 118 2.920 -4.720 9.204
911 1HB ALA 118 1HB ALA 118 2.845 -3.436 7.196
912 2HB ALA 118 2HB ALA 118 2.726 -3.994 6.939
913 3HB ALA 118 3HB ALA 118 3.269 -3.707 6.827
914 H ILE 119 H ILE 119 5.894 -4.952 7.313
915 HA ILE 119 HA ILE 119 5.503 -7.636 6.532
916 HB ILE 119 HB ILE 119 8.121 -6.201 6.742
917 1HG1 ILE 119 2HG1 ILE 119 6.720 -6.306 4.159
918 2HG1 ILE 119 1HG1 ILE 119 6.035 -5.218 5.353
919 1HG2 ILE 119 1HG2 ILE 119 8.022 -8.278 5.411
920 2HG2 ILE 119 2HG2 ILE 119 8.155 -8.256 5.506
921 3HG2 ILE 119 3HG2 ILE 119 8.149 -8.190 5.355
922 1HD1 ILE 119 1HD1 ILE 119 8.218 -4.438 4.645
923 2HD1 ILE 119 2HD1 ILE 119 8.189 -4.471 4.611
924 3HD1 ILE 119 3HD1 ILE 119 8.230 -4.484 4.630
925 H SER 120 H SER 120 6.944 -6.092 9.252
926 HA SER 120 HA SER 120 8.336 -8.333 10.254
927 1HB SER 120 2HB SER 120 8.532 -5.998 11.055
928 2HB SER 120 1HB SER 120 7.613 -6.152 11.860
929 HG SER 120 HG SER 120 8.927 -6.861 12.501
930 H HIS 121 H HIS 121 5.231 -6.885 11.051
931 HA HIS 121 HA HIS 121 4.554 -8.695 13.062
932 1HB HIS 121 2HB HIS 121 3.040 -6.783 11.387
933 2HB HIS 121 1HB HIS 121 2.169 -7.942 12.354
934 HD1 HIS 121 1HD HIS 121 4.705 -5.557 13.100
935 HD2 HIS 121 2HD HIS 121 1.843 -6.899 14.589
936 HE1 HIS 121 1HE HIS 121 4.574 -4.310 15.198
937 HE2 HIS 121 2HE HIS 121 2.839 -5.140 16.085
938 H TYR 122 H TYR 122 4.427 -8.894 9.661
939 HA TYR 122 HA TYR 122 2.583 -11.002 9.538
940 1HB TYR 122 2HB TYR 122 3.743 -9.422 7.662
941 2HB TYR 122 1HB TYR 122 4.254 -10.835 7.368
942 HD1 TYR 122 1HD TYR 122 2.527 -10.589 6.985
943 HD2 TYR 122 2HD TYR 122 2.123 -10.644 7.052
944 HE1 TYR 122 1HE TYR 122 0.699 -10.960 5.844
945 HE2 TYR 122 2HE TYR 122 0.293 -11.016 5.910
946 HH TYR 122 HH TYR 122 -0.823 -11.096 4.982
947 H GLN 123 H GLN 123 6.047 -10.843 9.150
948 HA GLN 123 HA GLN 123 6.847 -13.161 9.099
949 1HB GLN 123 2HB GLN 123 7.709 -12.401 9.789
950 2HB GLN 123 1HB GLN 123 7.617 -12.695 9.933
951 1HG GLN 123 1HG GLN 123 8.140 -13.216 9.799
952 2HG GLN 123 2HG GLN 123 8.193 -12.945 9.690
953 1HE2 GLN 123 1HE2 GLN 123 9.012 -12.715 9.848
954 2HE2 GLN 123 2HE2 GLN 123 9.298 -12.665 9.754
Start of MODEL 2
1 1H MET 1 1HT MET 1 12.614 -17.095 1.166
2 2H MET 1 2HT MET 1 13.714 -17.751 2.308
3 3H MET 1 3HT MET 1 13.282 -16.092 2.383
4 HA MET 1 HA MET 1 11.502 -18.394 2.819
5 1HB MET 1 2HB MET 1 11.452 -17.395 5.149
6 2HB MET 1 1HB MET 1 12.955 -18.174 4.681
7 1HG MET 1 2HG MET 1 13.948 -16.000 4.213
8 2HG MET 1 1HG MET 1 12.435 -15.209 4.648
9 1HE MET 1 1HE MET 1 15.196 -14.272 6.822
10 2HE MET 1 2HE MET 1 15.484 -15.217 5.361
11 3HE MET 1 3HE MET 1 15.937 -15.868 6.935
12 H GLN 2 H GLN 2 11.884 -14.861 2.902
13 HA GLN 2 HA GLN 2 8.991 -14.624 2.427
14 1HB GLN 2 2HB GLN 2 10.782 -12.995 4.208
15 2HB GLN 2 1HB GLN 2 9.283 -12.327 3.576
16 1HG GLN 2 2HG GLN 2 8.031 -13.467 5.021
17 2HG GLN 2 1HG GLN 2 8.947 -14.955 4.784
18 1HE2 GLN 2 1HE2 GLN 2 9.628 -11.723 6.101
19 2HE2 GLN 2 2HE2 GLN 2 10.330 -12.288 7.574
20 H ARG 3 H ARG 3 12.185 -13.416 1.799
21 HA ARG 3 HA ARG 3 13.087 -12.396 -0.012
22 1HB ARG 3 2HB ARG 3 11.523 -13.676 -1.402
23 2HB ARG 3 1HB ARG 3 10.299 -12.437 -1.168
24 1HG ARG 3 2HG ARG 3 11.100 -11.246 -2.852
25 2HG ARG 3 1HG ARG 3 12.714 -11.240 -2.137
26 1HD ARG 3 2HD ARG 3 11.708 -13.658 -3.583
27 2HD ARG 3 1HD ARG 3 12.355 -12.290 -4.486
28 HE ARG 3 HE ARG 3 13.845 -14.241 -3.090
29 1HH1 ARG 3 1HH1 ARG 3 13.811 -10.815 -3.776
30 2HH1 ARG 3 2HH1 ARG 3 15.524 -10.638 -3.589
31 1HH2 ARG 3 1HH2 ARG 3 16.093 -14.008 -2.858
32 2HH2 ARG 3 2HH2 ARG 3 16.820 -12.451 -3.075
33 H GLY 4 H GLY 4 10.423 -11.084 1.706
34 1HA GLY 4 2HA GLY 4 9.810 -8.937 2.222
35 2HA GLY 4 1HA GLY 4 11.524 -8.584 2.062
36 H ILE 5 H ILE 5 8.499 -8.844 0.245
37 HA ILE 5 HA ILE 5 9.637 -7.019 -1.770
38 HB ILE 5 HB ILE 5 7.169 -8.717 -2.104
39 1HG1 ILE 5 2HG1 ILE 5 8.983 -9.916 -3.699
40 2HG1 ILE 5 1HG1 ILE 5 10.042 -9.386 -2.396
41 1HG2 ILE 5 1HG2 ILE 5 6.916 -7.379 -3.872
42 2HG2 ILE 5 2HG2 ILE 5 8.284 -8.243 -4.575
43 3HG2 ILE 5 3HG2 ILE 5 8.547 -6.724 -3.714
44 1HD1 ILE 5 1HD1 ILE 5 7.532 -10.776 -1.658
45 2HD1 ILE 5 2HD1 ILE 5 9.117 -10.807 -0.884
46 3HD1 ILE 5 3HD1 ILE 5 8.836 -11.732 -2.362
47 H VAL 6 H VAL 6 9.074 -4.984 -1.413
48 HA VAL 6 HA VAL 6 6.404 -4.432 -0.307
49 HB VAL 6 HB VAL 6 8.202 -3.541 1.069
50 1HG1 VAL 6 1HG1 VAL 6 9.956 -2.284 0.340
51 2HG1 VAL 6 2HG1 VAL 6 9.052 -1.599 -1.009
52 3HG1 VAL 6 3HG1 VAL 6 9.678 -3.242 -1.111
53 1HG2 VAL 6 1HG2 VAL 6 7.358 -0.980 0.009
54 2HG2 VAL 6 2HG2 VAL 6 6.965 -1.752 1.544
55 3HG2 VAL 6 3HG2 VAL 6 6.021 -2.126 0.104
56 H TRP 7 H TRP 7 4.925 -3.603 -1.622
57 HA TRP 7 HA TRP 7 5.851 -2.296 -4.094
58 1HB TRP 7 2HB TRP 7 3.507 -4.081 -3.537
59 2HB TRP 7 1HB TRP 7 3.456 -2.949 -4.885
60 HD1 TRP 7 HD1 TRP 7 6.897 -4.218 -4.409
61 HE1 TRP 7 1HE TRP 7 7.442 -6.030 -6.146
62 HE3 TRP 7 3HE TRP 7 2.176 -5.086 -6.186
63 HZ2 TRP 7 2HZ TRP 7 6.059 -7.624 -8.018
64 HZ3 TRP 7 3HZ TRP 7 1.879 -6.775 -7.949
65 HH2 TRP 7 HH2 TRP 7 3.780 -8.016 -8.845
66 H VAL 8 H VAL 8 5.244 -0.275 -4.494
67 HA VAL 8 HA VAL 8 3.294 0.960 -2.660
68 HB VAL 8 HB VAL 8 5.133 2.724 -4.165
69 1HG1 VAL 8 1HG1 VAL 8 3.352 3.046 -2.139
70 2HG1 VAL 8 2HG1 VAL 8 4.657 4.169 -2.525
71 3HG1 VAL 8 3HG1 VAL 8 4.878 2.962 -1.258
72 1HG2 VAL 8 1HG2 VAL 8 6.736 2.246 -2.047
73 2HG2 VAL 8 2HG2 VAL 8 6.961 1.516 -3.637
74 3HG2 VAL 8 3HG2 VAL 8 6.134 0.619 -2.360
75 H VAL 9 H VAL 9 1.757 2.394 -3.500
76 HA VAL 9 HA VAL 9 1.600 2.543 -6.432
77 HB VAL 9 HB VAL 9 -1.036 2.490 -5.179
78 1HG1 VAL 9 1HG1 VAL 9 -0.461 2.354 -7.620
79 2HG1 VAL 9 2HG1 VAL 9 -1.557 1.101 -7.055
80 3HG1 VAL 9 3HG1 VAL 9 0.131 0.729 -7.322
81 1HG2 VAL 9 1HG2 VAL 9 0.120 0.896 -3.676
82 2HG2 VAL 9 2HG2 VAL 9 0.571 -0.064 -5.083
83 3HG2 VAL 9 3HG2 VAL 9 -1.127 0.134 -4.655
84 H ASP 10 H ASP 10 1.988 4.616 -6.814
85 HA ASP 10 HA ASP 10 0.159 6.618 -5.860
86 1HB ASP 10 2HB ASP 10 2.268 6.165 -4.195
87 2HB ASP 10 1HB ASP 10 2.926 7.420 -5.242
88 H ASP 11 H ASP 11 1.963 8.809 -6.372
89 HA ASP 11 HA ASP 11 1.639 9.025 -9.175
90 1HB ASP 11 2HB ASP 11 3.208 10.777 -7.278
91 2HB ASP 11 1HB ASP 11 2.778 11.197 -8.934
92 H ASP 12 H ASP 12 3.720 7.029 -7.860
93 HA ASP 12 HA ASP 12 5.790 6.205 -8.300
94 1HB ASP 12 2HB ASP 12 6.238 5.857 -10.664
95 2HB ASP 12 1HB ASP 12 4.520 5.650 -10.349
96 H SER 13 H SER 13 7.579 7.124 -10.479
97 HA SER 13 HA SER 13 9.535 8.283 -10.443
98 1HB SER 13 2HB SER 13 7.700 9.519 -11.732
99 2HB SER 13 1HB SER 13 7.764 10.694 -10.421
100 HG SER 13 HG SER 13 10.044 9.849 -11.876
101 H SER 14 H SER 14 7.956 10.923 -8.785
102 HA SER 14 HA SER 14 10.041 11.388 -7.016
103 1HB SER 14 2HB SER 14 7.940 12.837 -7.628
104 2HB SER 14 1HB SER 14 7.227 12.051 -6.219
105 HG SER 14 HG SER 14 9.776 13.207 -6.017
106 H ILE 15 H ILE 15 6.886 9.919 -6.209
107 HA ILE 15 HA ILE 15 7.666 9.090 -3.637
108 HB ILE 15 HB ILE 15 5.547 7.762 -5.323
109 1HG1 ILE 15 2HG1 ILE 15 5.238 10.219 -5.306
110 2HG1 ILE 15 1HG1 ILE 15 3.961 9.380 -4.432
111 1HG2 ILE 15 1HG2 ILE 15 6.431 7.512 -2.578
112 2HG2 ILE 15 2HG2 ILE 15 5.335 6.491 -3.511
113 3HG2 ILE 15 3HG2 ILE 15 4.717 7.920 -2.682
114 1HD1 ILE 15 1HD1 ILE 15 4.810 11.458 -3.347
115 2HD1 ILE 15 2HD1 ILE 15 6.343 10.626 -3.089
116 3HD1 ILE 15 3HD1 ILE 15 4.869 10.016 -2.336
117 H ARG 16 H ARG 16 8.188 7.747 -6.766
118 HA ARG 16 HA ARG 16 8.678 5.070 -5.945
119 1HB ARG 16 2HB ARG 16 8.069 5.571 -8.241
120 2HB ARG 16 1HB ARG 16 9.518 6.548 -8.443
121 1HG ARG 16 2HG ARG 16 10.222 3.911 -7.550
122 2HG ARG 16 1HG ARG 16 9.198 3.818 -8.981
123 1HD ARG 16 2HD ARG 16 11.229 5.879 -9.217
124 2HD ARG 16 1HD ARG 16 11.924 4.286 -8.928
125 HE ARG 16 HE ARG 16 9.945 4.647 -11.065
126 1HH1 ARG 16 1HH1 ARG 16 13.214 3.883 -10.079
127 2HH1 ARG 16 2HH1 ARG 16 13.653 3.227 -11.619
128 1HH2 ARG 16 1HH2 ARG 16 10.534 3.797 -13.091
129 2HH2 ARG 16 2HH2 ARG 16 12.136 3.181 -13.329
130 H TRP 17 H TRP 17 10.918 7.677 -6.920
131 HA TRP 17 HA TRP 17 13.254 6.253 -6.330
132 1HB TRP 17 2HB TRP 17 13.196 8.328 -7.682
133 2HB TRP 17 1HB TRP 17 12.878 9.249 -6.215
134 HD1 TRP 17 HD1 TRP 17 15.669 7.291 -7.971
135 HE1 TRP 17 1HE TRP 17 17.919 7.944 -6.904
136 HE3 TRP 17 3HE TRP 17 13.929 10.130 -4.094
137 HZ2 TRP 17 2HZ TRP 17 18.833 9.458 -4.702
138 HZ3 TRP 17 3HZ TRP 17 15.557 11.141 -2.547
139 HH2 TRP 17 HH2 TRP 17 17.958 10.811 -2.849
140 H VAL 18 H VAL 18 11.314 8.410 -4.300
141 HA VAL 18 HA VAL 18 13.081 8.470 -2.121
142 HB VAL 18 HB VAL 18 10.101 8.726 -1.852
143 1HG1 VAL 18 1HG1 VAL 18 11.912 8.762 0.079
144 2HG1 VAL 18 2HG1 VAL 18 10.500 9.819 0.105
145 3HG1 VAL 18 3HG1 VAL 18 12.061 10.443 -0.433
146 1HG2 VAL 18 1HG2 VAL 18 11.439 11.250 -2.223
147 2HG2 VAL 18 2HG2 VAL 18 10.039 10.589 -3.063
148 3HG2 VAL 18 3HG2 VAL 18 11.666 10.213 -3.631
149 H LEU 19 H LEU 19 10.318 6.395 -2.776
150 HA LEU 19 HA LEU 19 10.677 4.960 -0.321
151 1HB LEU 19 2HB LEU 19 8.748 4.744 -2.590
152 2HB LEU 19 1HB LEU 19 8.846 3.473 -1.387
153 HG LEU 19 HG LEU 19 8.166 6.364 -0.853
154 1HD1 LEU 19 1HD1 LEU 19 6.299 4.163 -0.245
155 2HD1 LEU 19 2HD1 LEU 19 6.542 4.536 -1.952
156 3HD1 LEU 19 3HD1 LEU 19 5.982 5.790 -0.847
157 1HD2 LEU 19 1HD2 LEU 19 9.354 5.497 1.036
158 2HD2 LEU 19 2HD2 LEU 19 8.429 3.998 0.996
159 3HD2 LEU 19 3HD2 LEU 19 7.638 5.511 1.433
160 H GLU 20 H GLU 20 11.673 4.518 -3.608
161 HA GLU 20 HA GLU 20 12.053 1.724 -3.470
162 1HB GLU 20 2HB GLU 20 13.200 1.864 -5.522
163 2HB GLU 20 1HB GLU 20 11.918 3.052 -5.580
164 1HG GLU 20 2HG GLU 20 13.554 4.812 -5.103
165 2HG GLU 20 1HG GLU 20 14.831 3.597 -5.089
166 H ARG 21 H ARG 21 14.450 4.319 -3.338
167 HA ARG 21 HA ARG 21 16.598 2.640 -2.651
168 1HB ARG 21 2HB ARG 21 16.221 5.613 -2.324
169 2HB ARG 21 1HB ARG 21 17.732 4.787 -1.969
170 1HG ARG 21 2HG ARG 21 16.710 4.128 -4.605
171 2HG ARG 21 1HG ARG 21 16.979 5.860 -4.393
172 1HD ARG 21 2HD ARG 21 19.246 5.593 -4.019
173 2HD ARG 21 1HD ARG 21 19.074 3.911 -3.522
174 HE ARG 21 HE ARG 21 19.257 4.928 -6.241
175 1HH1 ARG 21 1HH1 ARG 21 18.622 2.196 -4.159
176 2HH1 ARG 21 2HH1 ARG 21 18.904 1.026 -5.401
177 1HH2 ARG 21 1HH2 ARG 21 19.634 3.384 -7.876
178 2HH2 ARG 21 2HH2 ARG 21 19.479 1.699 -7.511
179 H ALA 22 H ALA 22 14.560 4.728 -0.592
180 HA ALA 22 HA ALA 22 15.869 4.276 1.803
181 1HB ALA 22 1HB ALA 22 14.324 5.749 2.411
182 2HB ALA 22 2HB ALA 22 13.168 4.420 2.480
183 3HB ALA 22 3HB ALA 22 13.339 5.359 1.001
184 H LEU 23 H LEU 23 12.984 2.565 0.695
185 HA LEU 23 HA LEU 23 13.116 0.600 2.704
186 1HB LEU 23 2HB LEU 23 11.486 1.114 0.371
187 2HB LEU 23 1HB LEU 23 11.828 -0.598 0.533
188 HG LEU 23 HG LEU 23 10.534 1.164 2.617
189 1HD1 LEU 23 1HD1 LEU 23 9.419 -0.040 0.383
190 2HD1 LEU 23 2HD1 LEU 23 8.560 0.548 1.806
191 3HD1 LEU 23 3HD1 LEU 23 9.047 -1.144 1.707
192 1HD2 LEU 23 1HD2 LEU 23 12.090 -0.864 3.288
193 2HD2 LEU 23 2HD2 LEU 23 10.660 -1.801 2.847
194 3HD2 LEU 23 3HD2 LEU 23 10.554 -0.569 4.106
195 H ALA 24 H ALA 24 14.666 0.936 -0.376
196 HA ALA 24 HA ALA 24 15.498 -1.741 -0.725
197 1HB ALA 24 1HB ALA 24 17.340 -0.673 -2.120
198 2HB ALA 24 2HB ALA 24 16.616 0.880 -1.706
199 3HB ALA 24 3HB ALA 24 15.684 -0.315 -2.608
200 H GLY 25 H GLY 25 16.751 1.001 1.087
201 1HA GLY 25 2HA GLY 25 19.247 -0.162 1.793
202 2HA GLY 25 1HA GLY 25 18.434 1.145 2.649
203 H ALA 26 H ALA 26 15.997 -0.590 2.929
204 HA ALA 26 HA ALA 26 16.707 -1.754 5.440
205 1HB ALA 26 1HB ALA 26 14.608 -0.963 5.687
206 2HB ALA 26 2HB ALA 26 14.162 -2.559 5.088
207 3HB ALA 26 3HB ALA 26 14.204 -1.184 3.982
208 H GLY 27 H GLY 27 16.636 -2.871 2.222
209 1HA GLY 27 2HA GLY 27 17.599 -4.971 1.649
210 2HA GLY 27 1HA GLY 27 17.046 -5.610 3.186
211 H LEU 28 H LEU 28 14.839 -3.777 1.156
212 HA LEU 28 HA LEU 28 13.570 -6.308 0.417
213 1HB LEU 28 2HB LEU 28 11.812 -3.968 0.771
214 2HB LEU 28 1HB LEU 28 11.514 -5.659 1.125
215 HG LEU 28 HG LEU 28 13.283 -5.168 3.054
216 1HD1 LEU 28 1HD1 LEU 28 13.855 -3.010 2.974
217 2HD1 LEU 28 2HD1 LEU 28 12.340 -2.788 3.850
218 3HD1 LEU 28 3HD1 LEU 28 12.395 -2.544 2.102
219 1HD2 LEU 28 1HD2 LEU 28 10.677 -4.100 3.809
220 2HD2 LEU 28 2HD2 LEU 28 11.532 -5.523 4.400
221 3HD2 LEU 28 3HD2 LEU 28 10.583 -5.616 2.915
222 H THR 29 H THR 29 11.854 -5.969 -1.334
223 HA THR 29 HA THR 29 13.103 -4.416 -3.486
224 HB THR 29 HB THR 29 11.125 -6.702 -3.509
225 HG1 THR 29 1HG THR 29 13.457 -7.054 -3.213
226 1HG2 THR 29 1HG2 THR 29 10.404 -5.972 -5.477
227 2HG2 THR 29 2HG2 THR 29 11.999 -6.407 -6.090
228 3HG2 THR 29 3HG2 THR 29 11.670 -4.750 -5.585
229 H CYS 30 H CYS 30 12.316 -2.400 -3.571
230 HA CYS 30 HA CYS 30 9.454 -1.961 -3.110
231 1HB CYS 30 2HB CYS 30 11.007 -0.662 -1.735
232 2HB CYS 30 1HB CYS 30 11.731 0.010 -3.191
233 HG CYS 30 HG CYS 30 10.071 1.787 -3.008
234 H THR 31 H THR 31 8.215 -1.923 -4.840
235 HA THR 31 HA THR 31 9.213 -0.571 -7.261
236 HB THR 31 HB THR 31 8.809 -3.144 -7.379
237 HG1 THR 31 1HG THR 31 8.330 -2.901 -9.475
238 1HG2 THR 31 1HG2 THR 31 6.403 -2.667 -6.335
239 2HG2 THR 31 2HG2 THR 31 6.728 -4.003 -7.438
240 3HG2 THR 31 3HG2 THR 31 6.011 -2.515 -8.044
241 H THR 32 H THR 32 7.666 0.755 -8.350
242 HA THR 32 HA THR 32 5.317 1.378 -6.706
243 HB THR 32 HB THR 32 5.562 3.698 -7.275
244 HG1 THR 32 1HG THR 32 7.447 2.699 -9.081
245 1HG2 THR 32 1HG2 THR 32 7.088 4.057 -5.716
246 2HG2 THR 32 2HG2 THR 32 8.367 3.343 -6.697
247 3HG2 THR 32 3HG2 THR 32 7.351 2.312 -5.686
248 H PHE 33 H PHE 33 3.594 2.547 -7.863
249 HA PHE 33 HA PHE 33 3.302 1.696 -10.650
250 1HB PHE 33 2HB PHE 33 1.257 1.288 -8.478
251 2HB PHE 33 1HB PHE 33 1.018 0.940 -10.179
252 HD1 PHE 33 1HD PHE 33 1.249 -1.255 -10.829
253 HD2 PHE 33 2HD PHE 33 3.451 0.127 -7.475
254 HE1 PHE 33 1HE PHE 33 2.127 -3.509 -10.481
255 HE2 PHE 33 2HE PHE 33 4.348 -2.129 -7.121
256 HZ PHE 33 HZ PHE 33 3.668 -3.968 -8.632
257 H GLU 34 H GLU 34 1.162 2.658 -11.555
258 HA GLU 34 HA GLU 34 1.452 5.433 -11.613
259 1HB GLU 34 2HB GLU 34 -0.657 5.406 -12.930
260 2HB GLU 34 1HB GLU 34 0.533 4.231 -13.483
261 1HG GLU 34 2HG GLU 34 -1.261 2.870 -13.497
262 2HG GLU 34 1HG GLU 34 -0.832 2.682 -11.800
263 H ASN 35 H ASN 35 -1.013 3.473 -9.883
264 HA ASN 35 HA ASN 35 -1.339 5.544 -7.969
265 1HB ASN 35 2HB ASN 35 -3.275 5.360 -10.198
266 2HB ASN 35 1HB ASN 35 -3.934 5.626 -8.586
267 1HD2 ASN 35 1HD2 ASN 35 -2.626 7.332 -7.326
268 2HD2 ASN 35 2HD2 ASN 35 -2.303 8.794 -8.191
269 H GLY 36 H GLY 36 -3.413 3.033 -9.337
270 1HA GLY 36 2HA GLY 36 -3.185 1.473 -6.903
271 2HA GLY 36 1HA GLY 36 -4.758 2.190 -7.176
272 H ASN 37 H ASN 37 -5.146 1.879 -9.851
273 HA ASN 37 HA ASN 37 -5.978 -0.785 -10.014
274 1HB ASN 37 2HB ASN 37 -6.370 1.539 -11.509
275 2HB ASN 37 1HB ASN 37 -5.673 0.381 -12.637
276 1HD2 ASN 37 1HD2 ASN 37 -8.036 0.332 -9.981
277 2HD2 ASN 37 2HD2 ASN 37 -9.234 -0.571 -10.839
278 H GLU 38 H GLU 38 -2.979 0.685 -10.821
279 HA GLU 38 HA GLU 38 -2.009 -1.130 -12.712
280 1HB GLU 38 2HB GLU 38 -1.052 1.089 -11.304
281 2HB GLU 38 1HB GLU 38 0.061 -0.210 -10.937
282 1HG GLU 38 2HG GLU 38 -0.651 0.023 -13.768
283 2HG GLU 38 1HG GLU 38 0.221 1.403 -13.105
284 H VAL 39 H VAL 39 -1.319 -1.095 -9.166
285 HA VAL 39 HA VAL 39 0.070 -3.499 -9.086
286 HB VAL 39 HB VAL 39 -1.849 -2.764 -6.887
287 1HG1 VAL 39 1HG1 VAL 39 -0.008 -4.796 -7.178
288 2HG1 VAL 39 2HG1 VAL 39 -0.717 -4.240 -5.663
289 3HG1 VAL 39 3HG1 VAL 39 0.841 -3.609 -6.193
290 1HG2 VAL 39 1HG2 VAL 39 0.764 -1.677 -6.458
291 2HG2 VAL 39 2HG2 VAL 39 -0.801 -0.871 -6.444
292 3HG2 VAL 39 3HG2 VAL 39 0.089 -1.039 -7.955
293 H LEU 40 H LEU 40 -3.399 -2.957 -9.157
294 HA LEU 40 HA LEU 40 -4.298 -5.482 -8.443
295 1HB LEU 40 2HB LEU 40 -5.569 -3.805 -10.591
296 2HB LEU 40 1HB LEU 40 -6.355 -4.932 -9.499
297 HG LEU 40 HG LEU 40 -5.191 -2.238 -8.786
298 1HD1 LEU 40 1HD1 LEU 40 -7.873 -3.252 -9.409
299 2HD1 LEU 40 2HD1 LEU 40 -7.231 -1.615 -9.487
300 3HD1 LEU 40 3HD1 LEU 40 -7.767 -2.272 -7.951
301 1HD2 LEU 40 1HD2 LEU 40 -6.556 -3.057 -6.589
302 2HD2 LEU 40 2HD2 LEU 40 -4.805 -3.192 -6.786
303 3HD2 LEU 40 3HD2 LEU 40 -5.842 -4.577 -7.131
304 H ALA 41 H ALA 41 -3.277 -4.262 -11.593
305 HA ALA 41 HA ALA 41 -3.848 -6.710 -12.962
306 1HB ALA 41 1HB ALA 41 -2.098 -4.457 -13.907
307 2HB ALA 41 2HB ALA 41 -3.858 -4.458 -14.044
308 3HB ALA 41 3HB ALA 41 -2.906 -5.677 -14.894
309 H ALA 42 H ALA 42 -0.923 -5.090 -11.887
310 HA ALA 42 HA ALA 42 0.909 -7.022 -12.794
311 1HB ALA 42 1HB ALA 42 1.154 -4.557 -11.701
312 2HB ALA 42 2HB ALA 42 2.490 -5.685 -11.912
313 3HB ALA 42 3HB ALA 42 1.675 -5.567 -10.352
314 H LEU 43 H LEU 43 -0.905 -6.694 -9.809
315 HA LEU 43 HA LEU 43 0.414 -8.627 -8.290
316 1HB LEU 43 2HB LEU 43 -2.305 -7.415 -8.243
317 2HB LEU 43 1HB LEU 43 -2.016 -8.846 -7.270
318 HG LEU 43 HG LEU 43 -0.245 -6.434 -7.078
319 1HD1 LEU 43 1HD1 LEU 43 -2.905 -6.927 -5.829
320 2HD1 LEU 43 2HD1 LEU 43 -2.223 -5.428 -6.452
321 3HD1 LEU 43 3HD1 LEU 43 -1.661 -6.082 -4.916
322 1HD2 LEU 43 1HD2 LEU 43 -0.531 -9.018 -5.728
323 2HD2 LEU 43 2HD2 LEU 43 -0.321 -7.635 -4.654
324 3HD2 LEU 43 3HD2 LEU 43 0.880 -7.973 -5.901
325 H ALA 44 H ALA 44 -1.660 -8.952 -10.985
326 HA ALA 44 HA ALA 44 -2.763 -11.486 -10.537
327 1HB ALA 44 1HB ALA 44 -3.333 -11.495 -12.818
328 2HB ALA 44 2HB ALA 44 -1.980 -10.446 -13.242
329 3HB ALA 44 3HB ALA 44 -3.352 -9.796 -12.346
330 H SER 45 H SER 45 0.470 -10.575 -11.162
331 HA SER 45 HA SER 45 1.148 -13.344 -11.796
332 1HB SER 45 2HB SER 45 1.999 -10.827 -13.032
333 2HB SER 45 1HB SER 45 3.327 -11.924 -12.658
334 HG SER 45 HG SER 45 2.695 -13.181 -14.217
335 H LYS 46 H LYS 46 1.363 -11.011 -9.420
336 HA LYS 46 HA LYS 46 3.223 -12.565 -7.907
337 1HB LYS 46 2HB LYS 46 4.421 -10.727 -9.518
338 2HB LYS 46 1HB LYS 46 4.177 -9.781 -8.056
339 1HG LYS 46 2HG LYS 46 5.197 -12.256 -7.219
340 2HG LYS 46 1HG LYS 46 6.151 -11.772 -8.623
341 1HD LYS 46 2HD LYS 46 6.005 -9.430 -7.258
342 2HD LYS 46 1HD LYS 46 6.011 -10.595 -5.932
343 1HE LYS 46 2HE LYS 46 8.003 -10.711 -8.179
344 2HE LYS 46 1HE LYS 46 8.269 -9.726 -6.740
345 1HZ LYS 46 1HZ LYS 46 8.698 -11.522 -5.492
346 2HZ LYS 46 2HZ LYS 46 9.008 -12.285 -6.969
347 3HZ LYS 46 3HZ LYS 46 7.501 -12.470 -6.225
348 H THR 47 H THR 47 3.503 -11.730 -5.695
349 HA THR 47 HA THR 47 1.531 -9.750 -4.909
350 HB THR 47 HB THR 47 1.755 -12.495 -3.676
351 HG1 THR 47 1HG THR 47 -0.575 -12.396 -4.312
352 1HG2 THR 47 1HG2 THR 47 1.260 -10.507 -2.103
353 2HG2 THR 47 2HG2 THR 47 0.215 -11.926 -2.053
354 3HG2 THR 47 3HG2 THR 47 -0.307 -10.479 -2.910
355 HA PRO 48 HA PRO 48 5.194 -8.594 -2.550
356 1HB PRO 48 2HB PRO 48 4.272 -6.198 -1.717
357 2HB PRO 48 1HB PRO 48 4.850 -6.456 -3.366
358 1HG PRO 48 2HG PRO 48 2.042 -6.390 -2.333
359 2HG PRO 48 1HG PRO 48 2.706 -5.666 -3.807
360 1HD PRO 48 2HD PRO 48 1.335 -8.012 -3.789
361 2HD PRO 48 1HD PRO 48 2.598 -7.638 -4.975
362 H ASP 49 H ASP 49 5.663 -8.311 -0.309
363 HA ASP 49 HA ASP 49 3.804 -9.649 1.418
364 1HB ASP 49 2HB ASP 49 6.485 -8.369 1.993
365 2HB ASP 49 1HB ASP 49 5.564 -9.328 3.148
366 H VAL 50 H VAL 50 4.561 -6.347 0.696
367 HA VAL 50 HA VAL 50 2.522 -5.480 2.584
368 HB VAL 50 HB VAL 50 4.564 -5.381 3.903
369 1HG1 VAL 50 1HG1 VAL 50 5.783 -3.283 2.216
370 2HG1 VAL 50 2HG1 VAL 50 5.880 -4.944 1.625
371 3HG1 VAL 50 3HG1 VAL 50 6.542 -4.528 3.208
372 1HG2 VAL 50 1HG2 VAL 50 4.539 -2.982 4.490
373 2HG2 VAL 50 2HG2 VAL 50 2.922 -3.670 4.335
374 3HG2 VAL 50 3HG2 VAL 50 3.578 -2.665 3.045
375 H LEU 51 H LEU 51 1.226 -4.692 0.955
376 HA LEU 51 HA LEU 51 2.341 -2.959 -1.092
377 1HB LEU 51 2HB LEU 51 0.565 -4.642 -1.598
378 2HB LEU 51 1HB LEU 51 -0.544 -3.700 -0.621
379 HG LEU 51 HG LEU 51 -0.150 -1.764 -2.175
380 1HD1 LEU 51 1HD1 LEU 51 2.005 -3.009 -3.044
381 2HD1 LEU 51 2HD1 LEU 51 1.074 -1.936 -4.086
382 3HD1 LEU 51 3HD1 LEU 51 0.861 -3.682 -4.205
383 1HD2 LEU 51 1HD2 LEU 51 -1.829 -2.426 -3.598
384 2HD2 LEU 51 2HD2 LEU 51 -2.024 -3.575 -2.274
385 3HD2 LEU 51 3HD2 LEU 51 -1.201 -4.067 -3.754
386 H LEU 52 H LEU 52 2.078 -0.810 -1.264
387 HA LEU 52 HA LEU 52 0.622 0.589 0.893
388 1HB LEU 52 2HB LEU 52 3.367 0.619 0.339
389 2HB LEU 52 1HB LEU 52 2.767 2.120 -0.334
390 HG LEU 52 HG LEU 52 2.267 1.284 2.517
391 1HD1 LEU 52 1HD1 LEU 52 4.564 1.485 2.535
392 2HD1 LEU 52 2HD1 LEU 52 4.061 3.139 2.880
393 3HD1 LEU 52 3HD1 LEU 52 4.574 2.695 1.252
394 1HD2 LEU 52 1HD2 LEU 52 1.984 3.813 2.702
395 2HD2 LEU 52 2HD2 LEU 52 0.699 2.918 1.892
396 3HD2 LEU 52 3HD2 LEU 52 1.886 3.811 0.942
397 H SER 53 H SER 53 -1.138 1.560 -0.011
398 HA SER 53 HA SER 53 -0.828 2.667 -2.728
399 1HB SER 53 2HB SER 53 -2.696 0.794 -1.807
400 2HB SER 53 1HB SER 53 -3.597 2.303 -1.957
401 HG SER 53 HG SER 53 -3.542 1.076 -3.912
402 H ASP 54 H ASP 54 -1.949 4.598 -3.256
403 HA ASP 54 HA ASP 54 -1.967 6.526 -1.100
404 1HB ASP 54 2HB ASP 54 -2.317 8.179 -2.888
405 2HB ASP 54 1HB ASP 54 -0.962 7.119 -3.253
406 H ILE 55 H ILE 55 -3.894 8.323 -1.804
407 HA ILE 55 HA ILE 55 -6.413 7.024 -2.181
408 HB ILE 55 HB ILE 55 -6.054 6.518 0.165
409 1HG1 ILE 55 2HG1 ILE 55 -8.070 8.507 0.707
410 2HG1 ILE 55 1HG1 ILE 55 -8.308 7.828 -0.898
411 1HG2 ILE 55 1HG2 ILE 55 -6.273 8.794 1.612
412 2HG2 ILE 55 2HG2 ILE 55 -5.257 9.321 0.270
413 3HG2 ILE 55 3HG2 ILE 55 -4.764 7.952 1.262
414 1HD1 ILE 55 1HD1 ILE 55 -8.051 5.547 0.297
415 2HD1 ILE 55 2HD1 ILE 55 -9.567 6.433 0.441
416 3HD1 ILE 55 3HD1 ILE 55 -8.396 6.470 1.757
417 H ARG 56 H ARG 56 -5.830 8.676 -3.910
418 HA ARG 56 HA ARG 56 -7.603 10.830 -3.710
419 1HB ARG 56 2HB ARG 56 -5.962 12.715 -3.814
420 2HB ARG 56 1HB ARG 56 -6.038 11.906 -2.257
421 1HG ARG 56 2HG ARG 56 -4.005 10.642 -2.840
422 2HG ARG 56 1HG ARG 56 -3.916 11.536 -4.360
423 1HD ARG 56 2HD ARG 56 -3.558 13.593 -3.226
424 2HD ARG 56 1HD ARG 56 -3.959 12.879 -1.664
425 HE ARG 56 HE ARG 56 -1.809 11.444 -2.530
426 1HH1 ARG 56 1HH1 ARG 56 -2.431 14.844 -2.020
427 2HH1 ARG 56 2HH1 ARG 56 -0.786 15.211 -1.623
428 1HH2 ARG 56 1HH2 ARG 56 0.349 11.927 -2.005
429 2HH2 ARG 56 2HH2 ARG 56 0.793 13.557 -1.620
430 H MET 57 H MET 57 -7.785 9.265 -5.662
431 HA MET 57 HA MET 57 -6.984 10.756 -7.960
432 1HB MET 57 2HB MET 57 -5.036 9.087 -7.229
433 2HB MET 57 1HB MET 57 -6.002 7.959 -8.165
434 1HG MET 57 2HG MET 57 -4.608 8.745 -9.777
435 2HG MET 57 1HG MET 57 -5.966 9.858 -9.950
436 1HE MET 57 1HE MET 57 -4.463 12.354 -10.870
437 2HE MET 57 2HE MET 57 -4.879 13.137 -9.344
438 3HE MET 57 3HE MET 57 -5.958 11.928 -10.040
439 HA PRO 58 HA PRO 58 -9.720 7.093 -9.528
440 1HB PRO 58 2HB PRO 58 -10.485 5.217 -7.707
441 2HB PRO 58 1HB PRO 58 -9.038 5.059 -8.713
442 1HG PRO 58 2HG PRO 58 -9.277 6.018 -5.879
443 2HG PRO 58 1HG PRO 58 -8.112 4.874 -6.575
444 1HD PRO 58 2HD PRO 58 -7.443 7.428 -6.134
445 2HD PRO 58 1HD PRO 58 -6.863 6.558 -7.567
446 H GLY 59 H GLY 59 -12.045 6.146 -8.816
447 1HA GLY 59 2HA GLY 59 -13.662 8.357 -8.251
448 2HA GLY 59 1HA GLY 59 -14.187 6.681 -8.189
449 H MET 60 H MET 60 -13.364 5.486 -6.164
450 HA MET 60 HA MET 60 -14.321 6.951 -3.884
451 1HB MET 60 2HB MET 60 -14.078 4.233 -4.614
452 2HB MET 60 1HB MET 60 -13.097 4.440 -3.173
453 1HG MET 60 2HG MET 60 -14.870 4.709 -1.850
454 2HG MET 60 1HG MET 60 -15.728 5.700 -3.027
455 1HE MET 60 1HE MET 60 -16.608 1.572 -1.798
456 2HE MET 60 2HE MET 60 -15.537 2.783 -1.094
457 3HE MET 60 3HE MET 60 -14.920 1.657 -2.304
458 H ASP 61 H ASP 61 -12.318 8.416 -4.594
459 HA ASP 61 HA ASP 61 -10.254 9.254 -4.201
460 1HB ASP 61 2HB ASP 61 -9.737 9.256 -1.650
461 2HB ASP 61 1HB ASP 61 -11.126 10.138 -2.267
462 H GLY 62 H GLY 62 -10.052 6.655 -1.755
463 1HA GLY 62 2HA GLY 62 -7.761 5.580 -3.269
464 2HA GLY 62 1HA GLY 62 -7.593 5.952 -1.566
465 H LEU 63 H LEU 63 -10.305 5.000 -0.946
466 HA LEU 63 HA LEU 63 -9.600 2.316 -0.443
467 1HB LEU 63 2HB LEU 63 -12.437 3.196 -0.258
468 2HB LEU 63 1HB LEU 63 -11.521 2.149 0.809
469 HG LEU 63 HG LEU 63 -10.209 4.453 1.236
470 1HD1 LEU 63 1HD1 LEU 63 -13.044 5.330 0.781
471 2HD1 LEU 63 2HD1 LEU 63 -11.713 5.673 -0.316
472 3HD1 LEU 63 3HD1 LEU 63 -11.692 6.319 1.322
473 1HD2 LEU 63 1HD2 LEU 63 -11.272 4.526 3.315
474 2HD2 LEU 63 2HD2 LEU 63 -11.391 2.839 2.811
475 3HD2 LEU 63 3HD2 LEU 63 -12.788 3.902 2.660
476 H ALA 64 H ALA 64 -10.851 3.821 -3.193
477 HA ALA 64 HA ALA 64 -12.594 1.923 -4.254
478 1HB ALA 64 1HB ALA 64 -12.478 3.903 -5.459
479 2HB ALA 64 2HB ALA 64 -11.602 2.779 -6.497
480 3HB ALA 64 3HB ALA 64 -10.716 3.910 -5.476
481 H LEU 65 H LEU 65 -9.089 2.248 -4.807
482 HA LEU 65 HA LEU 65 -8.698 -0.079 -6.273
483 1HB LEU 65 2HB LEU 65 -6.333 0.033 -5.394
484 2HB LEU 65 1HB LEU 65 -6.922 1.485 -6.181
485 HG LEU 65 HG LEU 65 -7.532 2.197 -3.731
486 1HD1 LEU 65 1HD1 LEU 65 -6.661 1.061 -2.040
487 2HD1 LEU 65 2HD1 LEU 65 -5.100 0.896 -2.834
488 3HD1 LEU 65 3HD1 LEU 65 -6.395 -0.241 -3.190
489 1HD2 LEU 65 1HD2 LEU 65 -5.143 2.488 -5.366
490 2HD2 LEU 65 2HD2 LEU 65 -4.846 2.750 -3.649
491 3HD2 LEU 65 3HD2 LEU 65 -6.071 3.701 -4.487
492 H LEU 66 H LEU 66 -8.684 0.419 -2.760
493 HA LEU 66 HA LEU 66 -7.787 -2.011 -1.862
494 1HB LEU 66 2HB LEU 66 -9.872 -0.141 -0.792
495 2HB LEU 66 1HB LEU 66 -9.533 -1.648 0.031
496 HG LEU 66 HG LEU 66 -7.396 0.384 -0.566
497 1HD1 LEU 66 1HD1 LEU 66 -8.253 1.711 0.984
498 2HD1 LEU 66 2HD1 LEU 66 -7.978 0.432 2.167
499 3HD1 LEU 66 3HD1 LEU 66 -9.533 0.553 1.344
500 1HD2 LEU 66 1HD2 LEU 66 -7.535 -2.216 0.797
501 2HD2 LEU 66 2HD2 LEU 66 -6.638 -0.961 1.650
502 3HD2 LEU 66 3HD2 LEU 66 -6.178 -1.415 0.010
503 H LYS 67 H LYS 67 -11.183 -1.212 -2.647
504 HA LYS 67 HA LYS 67 -12.283 -3.711 -2.137
505 1HB LYS 67 2HB LYS 67 -13.430 -1.478 -2.811
506 2HB LYS 67 1HB LYS 67 -13.222 -2.062 -4.459
507 1HG LYS 67 2HG LYS 67 -14.656 -3.870 -4.131
508 2HG LYS 67 1HG LYS 67 -14.540 -3.761 -2.373
509 1HD LYS 67 2HD LYS 67 -15.951 -1.898 -2.280
510 2HD LYS 67 1HD LYS 67 -15.735 -1.537 -3.994
511 1HE LYS 67 2HE LYS 67 -17.939 -2.468 -3.619
512 2HE LYS 67 1HE LYS 67 -16.963 -3.593 -4.563
513 1HZ LYS 67 1HZ LYS 67 -16.857 -5.077 -2.854
514 2HZ LYS 67 2HZ LYS 67 -18.366 -4.392 -2.515
515 3HZ LYS 67 3HZ LYS 67 -16.999 -3.898 -1.648
516 H GLN 68 H GLN 68 -10.773 -2.497 -5.105
517 HA GLN 68 HA GLN 68 -11.287 -4.788 -6.669
518 1HB GLN 68 2HB GLN 68 -8.900 -2.984 -6.984
519 2HB GLN 68 1HB GLN 68 -9.699 -3.930 -8.227
520 1HG GLN 68 2HG GLN 68 -11.185 -1.768 -6.806
521 2HG GLN 68 1HG GLN 68 -10.062 -1.373 -8.106
522 1HE2 GLN 68 1HE2 GLN 68 -12.996 -1.117 -7.916
523 2HE2 GLN 68 2HE2 GLN 68 -13.621 -1.976 -9.279
524 H ILE 69 H ILE 69 -8.861 -4.036 -4.286
525 HA ILE 69 HA ILE 69 -6.940 -5.953 -4.987
526 HB ILE 69 HB ILE 69 -7.546 -4.709 -2.309
527 1HG1 ILE 69 2HG1 ILE 69 -5.256 -4.166 -4.195
528 2HG1 ILE 69 1HG1 ILE 69 -6.758 -3.246 -4.215
529 1HG2 ILE 69 1HG2 ILE 69 -5.022 -6.177 -3.026
530 2HG2 ILE 69 2HG2 ILE 69 -6.349 -6.917 -2.133
531 3HG2 ILE 69 3HG2 ILE 69 -5.497 -5.534 -1.458
532 1HD1 ILE 69 1HD1 ILE 69 -6.082 -3.104 -1.596
533 2HD1 ILE 69 2HD1 ILE 69 -5.675 -1.893 -2.808
534 3HD1 ILE 69 3HD1 ILE 69 -4.497 -3.128 -2.368
535 H LYS 70 H LYS 70 -9.743 -6.157 -2.894
536 HA LYS 70 HA LYS 70 -9.178 -8.795 -1.993
537 1HB LYS 70 2HB LYS 70 -11.362 -8.715 -0.945
538 2HB LYS 70 1HB LYS 70 -10.504 -7.205 -0.676
539 1HG LYS 70 2HG LYS 70 -11.783 -6.276 -2.630
540 2HG LYS 70 1HG LYS 70 -12.784 -7.723 -2.551
541 1HD LYS 70 2HD LYS 70 -12.329 -6.087 -0.093
542 2HD LYS 70 1HD LYS 70 -13.511 -5.559 -1.291
543 1HE LYS 70 2HE LYS 70 -13.935 -8.318 -0.862
544 2HE LYS 70 1HE LYS 70 -13.766 -7.566 0.724
545 1HZ LYS 70 1HZ LYS 70 -16.067 -7.588 -0.092
546 2HZ LYS 70 2HZ LYS 70 -15.610 -6.620 -1.401
547 3HZ LYS 70 3HZ LYS 70 -15.497 -6.017 0.175
548 H GLN 71 H GLN 71 -10.817 -7.467 -4.719
549 HA GLN 71 HA GLN 71 -12.501 -9.604 -5.367
550 1HB GLN 71 2HB GLN 71 -11.641 -7.161 -6.582
551 2HB GLN 71 1HB GLN 71 -11.657 -8.446 -7.780
552 1HG GLN 71 2HG GLN 71 -13.906 -8.659 -7.732
553 2HG GLN 71 1HG GLN 71 -14.019 -8.247 -6.022
554 1HE2 GLN 71 1HE2 GLN 71 -12.938 -5.839 -5.810
555 2HE2 GLN 71 2HE2 GLN 71 -13.774 -4.677 -6.777
556 H ARG 72 H ARG 72 -9.253 -8.895 -6.546
557 HA ARG 72 HA ARG 72 -9.129 -11.524 -7.801
558 1HB ARG 72 2HB ARG 72 -7.443 -9.056 -8.016
559 2HB ARG 72 1HB ARG 72 -6.872 -10.598 -8.635
560 1HG ARG 72 2HG ARG 72 -8.414 -10.648 -10.328
561 2HG ARG 72 1HG ARG 72 -9.561 -9.624 -9.461
562 1HD ARG 72 2HD ARG 72 -8.500 -7.682 -10.075
563 2HD ARG 72 1HD ARG 72 -6.932 -8.470 -10.262
564 HE ARG 72 HE ARG 72 -8.984 -8.180 -12.260
565 1HH1 ARG 72 1HH1 ARG 72 -6.178 -10.005 -11.267
566 2HH1 ARG 72 2HH1 ARG 72 -5.834 -10.576 -12.864
567 1HH2 ARG 72 1HH2 ARG 72 -8.532 -8.938 -14.356
568 2HH2 ARG 72 2HH2 ARG 72 -7.169 -9.974 -14.615
569 H HIS 73 H HIS 73 -7.319 -9.618 -5.474
570 HA HIS 73 HA HIS 73 -5.621 -11.887 -4.827
571 1HB HIS 73 2HB HIS 73 -5.413 -9.345 -3.290
572 2HB HIS 73 1HB HIS 73 -4.137 -10.377 -3.939
573 HD1 HIS 73 1HD HIS 73 -4.227 -10.312 -6.786
574 HD2 HIS 73 2HD HIS 73 -5.542 -7.021 -4.631
575 HE1 HIS 73 1HE HIS 73 -4.204 -8.393 -8.412
576 HE2 HIS 73 2HE HIS 73 -5.153 -6.450 -7.120
577 HA PRO 74 HA PRO 74 -8.236 -13.329 -1.539
578 1HB PRO 74 2HB PRO 74 -5.683 -14.331 -0.387
579 2HB PRO 74 1HB PRO 74 -7.179 -15.199 -0.747
580 1HG PRO 74 2HG PRO 74 -5.030 -15.483 -2.295
581 2HG PRO 74 1HG PRO 74 -6.661 -15.434 -2.990
582 1HD PRO 74 2HD PRO 74 -4.561 -13.307 -2.931
583 2HD PRO 74 1HD PRO 74 -5.710 -13.724 -4.216
584 H MET 75 H MET 75 -5.072 -12.632 -0.052
585 HA MET 75 HA MET 75 -6.375 -10.593 1.598
586 1HB MET 75 2HB MET 75 -4.656 -12.862 2.592
587 2HB MET 75 1HB MET 75 -5.091 -11.468 3.570
588 1HG MET 75 2HG MET 75 -6.802 -12.733 4.241
589 2HG MET 75 1HG MET 75 -7.532 -12.284 2.700
590 1HE MET 75 1HE MET 75 -8.127 -14.577 4.625
591 2HE MET 75 2HE MET 75 -7.918 -16.186 3.936
592 3HE MET 75 3HE MET 75 -9.021 -15.039 3.177
593 H LEU 76 H LEU 76 -4.894 -9.913 -0.556
594 HA LEU 76 HA LEU 76 -2.145 -9.547 -0.074
595 1HB LEU 76 2HB LEU 76 -3.271 -9.390 -2.296
596 2HB LEU 76 1HB LEU 76 -3.973 -7.865 -1.788
597 HG LEU 76 HG LEU 76 -1.867 -7.860 -3.288
598 1HD1 LEU 76 1HD1 LEU 76 -1.620 -5.707 -2.689
599 2HD1 LEU 76 2HD1 LEU 76 -1.455 -6.089 -0.974
600 3HD1 LEU 76 3HD1 LEU 76 -3.055 -6.052 -1.720
601 1HD2 LEU 76 1HD2 LEU 76 0.162 -8.310 -2.401
602 2HD2 LEU 76 2HD2 LEU 76 -0.781 -9.387 -1.377
603 3HD2 LEU 76 3HD2 LEU 76 -0.307 -7.797 -0.782
604 HA PRO 77 HA PRO 77 -2.706 -6.505 3.242
605 1HB PRO 77 2HB PRO 77 0.245 -6.345 2.922
606 2HB PRO 77 1HB PRO 77 -0.717 -6.612 4.379
607 1HG PRO 77 2HG PRO 77 0.622 -8.621 3.264
608 2HG PRO 77 1HG PRO 77 -0.999 -8.877 3.936
609 1HD PRO 77 2HD PRO 77 -0.162 -8.569 1.077
610 2HD PRO 77 1HD PRO 77 -1.351 -9.679 1.789
611 H VAL 78 H VAL 78 -3.120 -4.404 3.016
612 HA VAL 78 HA VAL 78 -1.617 -2.845 1.024
613 HB VAL 78 HB VAL 78 -4.540 -2.336 1.499
614 1HG1 VAL 78 1HG1 VAL 78 -4.350 -1.383 -0.799
615 2HG1 VAL 78 2HG1 VAL 78 -2.616 -1.686 -0.726
616 3HG1 VAL 78 3HG1 VAL 78 -3.363 -0.566 0.411
617 1HG2 VAL 78 1HG2 VAL 78 -5.247 -3.839 -0.087
618 2HG2 VAL 78 2HG2 VAL 78 -3.948 -4.751 0.671
619 3HG2 VAL 78 3HG2 VAL 78 -3.667 -3.936 -0.862
620 H ILE 79 H ILE 79 -1.451 -0.614 1.430
621 HA ILE 79 HA ILE 79 -2.275 0.274 4.104
622 HB ILE 79 HB ILE 79 0.434 0.919 2.957
623 1HG1 ILE 79 2HG1 ILE 79 0.244 -0.879 5.299
624 2HG1 ILE 79 1HG1 ILE 79 -0.228 -1.586 3.759
625 1HG2 ILE 79 1HG2 ILE 79 -0.990 2.184 4.897
626 2HG2 ILE 79 2HG2 ILE 79 0.769 2.188 4.775
627 3HG2 ILE 79 3HG2 ILE 79 -0.037 1.041 5.846
628 1HD1 ILE 79 1HD1 ILE 79 2.192 -1.823 4.508
629 2HD1 ILE 79 2HD1 ILE 79 2.361 -0.125 4.069
630 3HD1 ILE 79 3HD1 ILE 79 1.893 -1.310 2.849
631 H ILE 80 H ILE 80 -3.536 1.974 3.855
632 HA ILE 80 HA ILE 80 -3.233 3.672 1.499
633 HB ILE 80 HB ILE 80 -5.376 3.856 3.612
634 1HG1 ILE 80 2HG1 ILE 80 -5.392 1.602 2.659
635 2HG1 ILE 80 1HG1 ILE 80 -6.778 2.518 2.075
636 1HG2 ILE 80 1HG2 ILE 80 -5.382 4.754 0.736
637 2HG2 ILE 80 2HG2 ILE 80 -5.019 5.801 2.104
638 3HG2 ILE 80 3HG2 ILE 80 -6.614 5.069 1.956
639 1HD1 ILE 80 1HD1 ILE 80 -5.646 2.917 -0.032
640 2HD1 ILE 80 2HD1 ILE 80 -5.756 1.190 0.312
641 3HD1 ILE 80 3HD1 ILE 80 -4.231 2.042 0.550
642 H MET 81 H MET 81 -2.749 5.853 1.582
643 HA MET 81 HA MET 81 -1.178 6.677 3.805
644 1HB MET 81 2HB MET 81 -0.912 8.798 2.570
645 2HB MET 81 1HB MET 81 -0.557 7.383 1.591
646 1HG MET 81 2HG MET 81 -2.717 7.558 0.511
647 2HG MET 81 1HG MET 81 -3.133 8.932 1.537
648 1HE MET 81 1HE MET 81 -1.425 11.780 0.621
649 2HE MET 81 2HE MET 81 -2.827 10.946 1.289
650 3HE MET 81 3HE MET 81 -2.854 11.520 -0.378
651 H THR 82 H THR 82 -4.465 7.469 2.777
652 HA THR 82 HA THR 82 -4.920 8.692 5.379
653 HB THR 82 HB THR 82 -5.774 10.168 2.906
654 HG1 THR 82 1HG THR 82 -3.967 11.540 3.352
655 1HG2 THR 82 1HG2 THR 82 -5.232 11.848 5.110
656 2HG2 THR 82 2HG2 THR 82 -6.264 10.533 5.669
657 3HG2 THR 82 3HG2 THR 82 -6.772 11.538 4.312
658 H ALA 83 H ALA 83 -7.054 8.764 6.062
659 HA ALA 83 HA ALA 83 -8.869 7.071 4.487
660 1HB ALA 83 1HB ALA 83 -9.616 7.486 7.272
661 2HB ALA 83 2HB ALA 83 -8.039 6.723 7.078
662 3HB ALA 83 3HB ALA 83 -9.470 5.992 6.343
663 H HIS 84 H HIS 84 -9.573 8.848 3.235
664 HA HIS 84 HA HIS 84 -10.691 11.207 4.330
665 1HB HIS 84 2HB HIS 84 -11.191 9.921 1.638
666 2HB HIS 84 1HB HIS 84 -11.593 11.579 2.068
667 HD1 HIS 84 1HD HIS 84 -8.822 12.044 3.612
668 HD2 HIS 84 2HD HIS 84 -9.318 10.680 -0.281
669 HE1 HIS 84 1HE HIS 84 -6.678 12.606 2.425
670 HE2 HIS 84 2HE HIS 84 -7.012 11.799 0.060
671 H SER 85 H SER 85 -13.172 11.398 2.916
672 HA SER 85 HA SER 85 -14.883 10.198 4.883
673 1HB SER 85 2HB SER 85 -15.016 12.531 3.587
674 2HB SER 85 1HB SER 85 -16.031 11.577 2.506
675 HG SER 85 HG SER 85 -17.552 11.770 3.926
676 H ASP 86 H ASP 86 -14.474 7.966 4.335
677 HA ASP 86 HA ASP 86 -16.563 6.733 3.007
678 1HB ASP 86 2HB ASP 86 -15.436 7.679 0.961
679 2HB ASP 86 1HB ASP 86 -14.056 6.654 1.319
680 H LEU 87 H LEU 87 -14.701 6.588 5.319
681 HA LEU 87 HA LEU 87 -12.924 4.537 5.371
682 1HB LEU 87 2HB LEU 87 -14.822 5.640 7.363
683 2HB LEU 87 1HB LEU 87 -14.026 4.130 7.760
684 HG LEU 87 HG LEU 87 -12.581 6.676 7.025
685 1HD1 LEU 87 1HD1 LEU 87 -12.512 7.277 9.190
686 2HD1 LEU 87 2HD1 LEU 87 -12.412 5.612 9.759
687 3HD1 LEU 87 3HD1 LEU 87 -13.974 6.300 9.311
688 1HD2 LEU 87 1HD2 LEU 87 -11.706 3.934 7.857
689 2HD2 LEU 87 2HD2 LEU 87 -10.698 5.343 8.179
690 3HD2 LEU 87 3HD2 LEU 87 -11.130 4.930 6.521
691 H ASP 88 H ASP 88 -16.331 4.220 4.933
692 HA ASP 88 HA ASP 88 -16.914 1.730 5.891
693 1HB ASP 88 2HB ASP 88 -17.836 3.165 3.422
694 2HB ASP 88 1HB ASP 88 -18.414 1.541 3.782
695 H ALA 89 H ALA 89 -15.383 2.467 2.763
696 HA ALA 89 HA ALA 89 -15.120 -0.278 2.049
697 1HB ALA 89 1HB ALA 89 -14.352 0.465 0.050
698 2HB ALA 89 2HB ALA 89 -13.367 1.729 0.779
699 3HB ALA 89 3HB ALA 89 -15.102 1.961 0.606
700 H ALA 90 H ALA 90 -13.274 1.908 3.961
701 HA ALA 90 HA ALA 90 -10.719 0.730 3.693
702 1HB ALA 90 1HB ALA 90 -11.873 2.246 6.031
703 2HB ALA 90 2HB ALA 90 -10.994 2.942 4.675
704 3HB ALA 90 3HB ALA 90 -10.167 1.865 5.797
705 H VAL 91 H VAL 91 -13.424 0.105 5.902
706 HA VAL 91 HA VAL 91 -12.027 -1.727 7.524
707 HB VAL 91 HB VAL 91 -14.999 -1.837 7.083
708 1HG1 VAL 91 1HG1 VAL 91 -14.543 -2.284 9.705
709 2HG1 VAL 91 2HG1 VAL 91 -13.041 -2.907 9.016
710 3HG1 VAL 91 3HG1 VAL 91 -14.594 -3.564 8.489
711 1HG2 VAL 91 1HG2 VAL 91 -13.470 -0.009 8.942
712 2HG2 VAL 91 2HG2 VAL 91 -15.221 -0.197 8.889
713 3HG2 VAL 91 3HG2 VAL 91 -14.368 0.498 7.513
714 H SER 92 H SER 92 -13.960 -2.146 4.598
715 HA SER 92 HA SER 92 -13.943 -4.968 4.595
716 1HB SER 92 2HB SER 92 -14.029 -3.129 2.192
717 2HB SER 92 1HB SER 92 -14.559 -4.810 2.252
718 HG SER 92 HG SER 92 -16.148 -2.937 2.539
719 H ALA 93 H ALA 93 -11.506 -2.667 4.083
720 HA ALA 93 HA ALA 93 -9.840 -4.188 2.357
721 1HB ALA 93 1HB ALA 93 -9.873 -1.660 2.686
722 2HB ALA 93 2HB ALA 93 -8.297 -2.441 2.564
723 3HB ALA 93 3HB ALA 93 -8.928 -1.972 4.142
724 H TYR 94 H TYR 94 -9.646 -3.328 5.770
725 HA TYR 94 HA TYR 94 -7.419 -4.864 6.424
726 1HB TYR 94 2HB TYR 94 -9.626 -4.536 8.420
727 2HB TYR 94 1HB TYR 94 -7.886 -4.437 8.664
728 HD1 TYR 94 1HD TYR 94 -10.744 -2.569 8.763
729 HD2 TYR 94 2HD TYR 94 -6.840 -2.443 7.071
730 HE1 TYR 94 1HE TYR 94 -10.873 -0.114 8.653
731 HE2 TYR 94 2HE TYR 94 -6.960 0.005 6.958
732 HH TYR 94 HH TYR 94 -9.066 1.830 8.617
733 H GLN 95 H GLN 95 -10.771 -5.734 6.200
734 HA GLN 95 HA GLN 95 -10.430 -8.330 7.383
735 1HB GLN 95 2HB GLN 95 -12.736 -8.722 6.803
736 2HB GLN 95 1HB GLN 95 -12.575 -7.094 7.450
737 1HG GLN 95 2HG GLN 95 -13.946 -6.730 5.660
738 2HG GLN 95 1HG GLN 95 -12.363 -6.419 4.956
739 1HE2 GLN 95 1HE2 GLN 95 -13.901 -6.842 3.046
740 2HE2 GLN 95 2HE2 GLN 95 -13.923 -8.469 2.462
741 H GLN 96 H GLN 96 -10.473 -7.043 4.109
742 HA GLN 96 HA GLN 96 -10.481 -9.629 2.890
743 1HB GLN 96 2HB GLN 96 -10.149 -8.467 0.789
744 2HB GLN 96 1HB GLN 96 -11.408 -7.669 1.724
745 1HG GLN 96 2HG GLN 96 -10.305 -5.800 1.217
746 2HG GLN 96 1HG GLN 96 -9.207 -6.291 2.497
747 1HE2 GLN 96 1HE2 GLN 96 -8.005 -4.724 0.926
748 2HE2 GLN 96 2HE2 GLN 96 -7.018 -5.514 -0.252
749 H GLY 97 H GLY 97 -8.086 -7.613 4.279
750 1HA GLY 97 2HA GLY 97 -6.014 -9.235 4.461
751 2HA GLY 97 1HA GLY 97 -5.928 -8.860 2.748
752 H ALA 98 H ALA 98 -6.917 -6.086 3.250
753 HA ALA 98 HA ALA 98 -4.631 -4.650 3.170
754 1HB ALA 98 1HB ALA 98 -5.883 -2.746 3.507
755 2HB ALA 98 2HB ALA 98 -6.907 -3.508 4.723
756 3HB ALA 98 3HB ALA 98 -7.114 -3.909 3.018
757 H PHE 99 H PHE 99 -3.379 -3.399 4.686
758 HA PHE 99 HA PHE 99 -3.018 -4.790 7.182
759 1HB PHE 99 2HB PHE 99 -1.036 -4.181 5.876
760 2HB PHE 99 1HB PHE 99 -1.463 -2.477 6.009
761 HD1 PHE 99 1HD PHE 99 -0.944 -5.412 8.259
762 HD2 PHE 99 2HD PHE 99 -0.333 -1.253 7.591
763 HE1 PHE 99 1HE PHE 99 0.317 -5.263 10.365
764 HE2 PHE 99 2HE PHE 99 0.935 -1.099 9.695
765 HZ PHE 99 HZ PHE 99 1.260 -3.105 11.086
766 H ASP 100 H ASP 100 -3.557 -1.390 6.224
767 HA ASP 100 HA ASP 100 -5.506 -0.766 8.076
768 1HB ASP 100 2HB ASP 100 -3.354 -1.362 9.581
769 2HB ASP 100 1HB ASP 100 -3.009 0.332 9.270
770 H TYR 101 H TYR 101 -5.206 1.732 8.807
771 HA TYR 101 HA TYR 101 -4.460 3.165 6.347
772 1HB TYR 101 2HB TYR 101 -6.784 3.361 8.158
773 2HB TYR 101 1HB TYR 101 -6.107 4.903 7.635
774 HD1 TYR 101 1HD TYR 101 -7.288 1.636 6.303
775 HD2 TYR 101 2HD TYR 101 -6.717 5.788 5.576
776 HE1 TYR 101 1HE TYR 101 -8.477 1.417 4.162
777 HE2 TYR 101 2HE TYR 101 -7.906 5.585 3.433
778 HH TYR 101 HH TYR 101 -9.473 2.583 2.468
779 H LEU 102 H LEU 102 -3.498 5.242 6.568
780 HA LEU 102 HA LEU 102 -1.989 5.510 9.070
781 1HB LEU 102 2HB LEU 102 -0.641 5.202 7.085
782 2HB LEU 102 1HB LEU 102 -1.442 6.545 6.293
783 HG LEU 102 HG LEU 102 -0.480 7.878 8.383
784 1HD1 LEU 102 1HD1 LEU 102 1.526 7.071 9.245
785 2HD1 LEU 102 2HD1 LEU 102 1.698 5.862 7.974
786 3HD1 LEU 102 3HD1 LEU 102 0.484 5.647 9.235
787 1HD2 LEU 102 1HD2 LEU 102 1.491 7.195 6.255
788 2HD2 LEU 102 2HD2 LEU 102 1.039 8.762 6.920
789 3HD2 LEU 102 3HD2 LEU 102 -0.042 7.940 5.802
790 HA PRO 103 HA PRO 103 -4.271 9.163 10.123
791 1HB PRO 103 2HB PRO 103 -2.436 10.360 11.751
792 2HB PRO 103 1HB PRO 103 -3.426 8.982 12.244
793 1HG PRO 103 2HG PRO 103 -0.598 9.034 11.265
794 2HG PRO 103 1HG PRO 103 -1.299 8.116 12.609
795 1HD PRO 103 2HD PRO 103 -0.802 6.987 10.216
796 2HD PRO 103 1HD PRO 103 -2.194 6.506 11.208
797 H LYS 104 H LYS 104 -3.335 11.647 10.670
798 HA LYS 104 HA LYS 104 -3.214 12.948 8.279
799 1HB LYS 104 2HB LYS 104 -2.109 13.763 10.966
800 2HB LYS 104 1HB LYS 104 -2.147 14.854 9.587
801 1HG LYS 104 2HG LYS 104 -4.511 14.847 9.531
802 2HG LYS 104 1HG LYS 104 -4.602 13.487 10.650
803 1HD LYS 104 2HD LYS 104 -3.848 14.822 12.468
804 2HD LYS 104 1HD LYS 104 -3.402 16.148 11.392
805 1HE LYS 104 2HE LYS 104 -5.756 16.480 10.824
806 2HE LYS 104 1HE LYS 104 -6.206 15.146 11.882
807 1HZ LYS 104 1HZ LYS 104 -6.091 16.450 13.668
808 2HZ LYS 104 2HZ LYS 104 -6.074 17.759 12.599
809 3HZ LYS 104 3HZ LYS 104 -4.618 17.142 13.201
810 HA PRO 105 HA PRO 105 1.706 13.310 8.616
811 1HB PRO 105 2HB PRO 105 2.670 11.006 9.905
812 2HB PRO 105 1HB PRO 105 2.695 12.651 10.543
813 1HG PRO 105 2HG PRO 105 0.788 10.435 11.079
814 2HG PRO 105 1HG PRO 105 1.355 11.721 12.159
815 1HD PRO 105 2HD PRO 105 -1.099 11.771 11.084
816 2HD PRO 105 1HD PRO 105 -0.164 13.261 11.325
817 H PHE 106 H PHE 106 3.291 12.058 7.346
818 HA PHE 106 HA PHE 106 2.559 9.516 6.288
819 1HB PHE 106 2HB PHE 106 0.999 10.905 5.001
820 2HB PHE 106 1HB PHE 106 2.340 11.893 4.427
821 HD1 PHE 106 1HD PHE 106 0.989 8.441 4.388
822 HD2 PHE 106 2HD PHE 106 3.517 11.279 2.482
823 HE1 PHE 106 1HE PHE 106 1.292 6.894 2.506
824 HE2 PHE 106 2HE PHE 106 3.824 9.737 0.592
825 HZ PHE 106 HZ PHE 106 2.709 7.541 0.602
826 H ASP 107 H ASP 107 4.157 11.722 4.118
827 HA ASP 107 HA ASP 107 6.245 11.533 3.191
828 1HB ASP 107 2HB ASP 107 7.909 12.461 4.585
829 2HB ASP 107 1HB ASP 107 6.390 13.111 5.187
830 H ILE 108 H ILE 108 8.630 10.534 3.771
831 HA ILE 108 HA ILE 108 8.250 7.740 3.543
832 HB ILE 108 HB ILE 108 10.424 9.557 3.201
833 1HG1 ILE 108 2HG1 ILE 108 11.195 7.877 1.653
834 2HG1 ILE 108 1HG1 ILE 108 10.188 6.653 2.416
835 1HG2 ILE 108 1HG2 ILE 108 12.254 8.004 3.868
836 2HG2 ILE 108 2HG2 ILE 108 11.056 7.063 4.756
837 3HG2 ILE 108 3HG2 ILE 108 11.390 8.729 5.225
838 1HD1 ILE 108 1HD1 ILE 108 9.408 7.686 0.204
839 2HD1 ILE 108 2HD1 ILE 108 8.973 9.090 1.178
840 3HD1 ILE 108 3HD1 ILE 108 8.235 7.522 1.513
841 H ASP 109 H ASP 109 9.417 9.780 6.126
842 HA ASP 109 HA ASP 109 10.282 7.926 7.949
843 1HB ASP 109 2HB ASP 109 10.242 10.484 8.136
844 2HB ASP 109 1HB ASP 109 8.622 10.289 8.798
845 H GLU 110 H GLU 110 6.938 9.234 7.884
846 HA GLU 110 HA GLU 110 6.041 7.223 9.692
847 1HB GLU 110 2HB GLU 110 4.464 9.235 8.089
848 2HB GLU 110 1HB GLU 110 3.792 8.192 9.332
849 1HG GLU 110 2HG GLU 110 6.105 9.895 10.052
850 2HG GLU 110 1HG GLU 110 4.539 10.672 9.827
851 H ALA 111 H ALA 111 6.137 7.536 6.244
852 HA ALA 111 HA ALA 111 4.175 5.551 5.692
853 1HB ALA 111 1HB ALA 111 6.387 6.703 4.005
854 2HB ALA 111 2HB ALA 111 4.670 7.106 3.959
855 3HB ALA 111 3HB ALA 111 5.218 5.523 3.410
856 H VAL 112 H VAL 112 7.731 5.492 5.405
857 HA VAL 112 HA VAL 112 7.968 2.723 5.050
858 HB VAL 112 HB VAL 112 9.977 4.565 6.349
859 1HG1 VAL 112 1HG1 VAL 112 11.070 2.420 4.773
860 2HG1 VAL 112 2HG1 VAL 112 9.997 1.787 6.023
861 3HG1 VAL 112 3HG1 VAL 112 11.353 2.825 6.466
862 1HG2 VAL 112 1HG2 VAL 112 10.860 4.224 3.815
863 2HG2 VAL 112 2HG2 VAL 112 9.888 5.596 4.347
864 3HG2 VAL 112 3HG2 VAL 112 9.116 4.225 3.555
865 H ALA 113 H ALA 113 7.613 4.686 7.880
866 HA ALA 113 HA ALA 113 8.419 2.830 9.837
867 1HB ALA 113 1HB ALA 113 6.358 5.018 10.048
868 2HB ALA 113 2HB ALA 113 8.093 5.216 10.300
869 3HB ALA 113 3HB ALA 113 7.153 4.209 11.399
870 H LEU 114 H LEU 114 5.289 3.599 8.418
871 HA LEU 114 HA LEU 114 3.864 1.625 9.881
872 1HB LEU 114 2HB LEU 114 2.799 3.671 9.078
873 2HB LEU 114 1HB LEU 114 3.097 3.181 7.420
874 HG LEU 114 HG LEU 114 1.618 1.202 7.800
875 1HD1 LEU 114 1HD1 LEU 114 0.005 1.675 9.819
876 2HD1 LEU 114 2HD1 LEU 114 1.432 2.472 10.484
877 3HD1 LEU 114 3HD1 LEU 114 1.501 0.767 10.042
878 1HD2 LEU 114 1HD2 LEU 114 0.052 3.660 8.441
879 2HD2 LEU 114 2HD2 LEU 114 -0.297 2.372 7.288
880 3HD2 LEU 114 3HD2 LEU 114 0.945 3.569 6.923
881 H VAL 115 H VAL 115 5.661 1.616 6.933
882 HA VAL 115 HA VAL 115 4.351 -0.707 5.872
883 HB VAL 115 HB VAL 115 5.546 1.109 4.500
884 1HG1 VAL 115 1HG1 VAL 115 7.942 -0.652 4.942
885 2HG1 VAL 115 2HG1 VAL 115 7.693 0.865 5.795
886 3HG1 VAL 115 3HG1 VAL 115 7.849 0.862 4.044
887 1HG2 VAL 115 1HG2 VAL 115 4.562 -0.915 3.555
888 2HG2 VAL 115 2HG2 VAL 115 6.048 -1.801 3.896
889 3HG2 VAL 115 3HG2 VAL 115 6.057 -0.482 2.726
890 H GLU 116 H GLU 116 7.405 -0.068 7.549
891 HA GLU 116 HA GLU 116 8.438 -2.682 7.362
892 1HB GLU 116 2HB GLU 116 8.941 -0.466 9.347
893 2HB GLU 116 1HB GLU 116 9.829 -1.984 9.355
894 1HG GLU 116 2HG GLU 116 10.529 -1.515 7.018
895 2HG GLU 116 1HG GLU 116 9.761 0.066 7.157
896 H ARG 117 H ARG 117 6.446 -1.112 9.839
897 HA ARG 117 HA ARG 117 6.427 -3.284 11.631
898 1HB ARG 117 2HB ARG 117 4.531 -2.190 12.688
899 2HB ARG 117 1HB ARG 117 5.766 -1.006 12.279
900 1HG ARG 117 2HG ARG 117 4.460 0.041 10.766
901 2HG ARG 117 1HG ARG 117 3.652 -1.445 10.267
902 1HD ARG 117 2HD ARG 117 1.902 -0.637 11.414
903 2HD ARG 117 1HD ARG 117 2.788 -1.180 12.839
904 HE ARG 117 HE ARG 117 3.702 1.362 12.296
905 1HH1 ARG 117 1HH1 ARG 117 0.641 -0.120 13.084
906 2HH1 ARG 117 2HH1 ARG 117 0.015 1.295 13.859
907 1HH2 ARG 117 1HH2 ARG 117 2.876 3.220 13.320
908 2HH2 ARG 117 2HH2 ARG 117 1.281 3.188 13.992
909 H ALA 118 H ALA 118 4.747 -2.683 8.694
910 HA ALA 118 HA ALA 118 2.560 -4.440 9.118
911 1HB ALA 118 1HB ALA 118 3.431 -2.658 7.082
912 2HB ALA 118 2HB ALA 118 1.849 -3.410 7.284
913 3HB ALA 118 3HB ALA 118 3.098 -4.225 6.345
914 H ILE 119 H ILE 119 5.692 -4.764 7.486
915 HA ILE 119 HA ILE 119 5.325 -7.393 6.566
916 HB ILE 119 HB ILE 119 7.928 -6.072 7.327
917 1HG1 ILE 119 2HG1 ILE 119 7.053 -6.172 4.502
918 2HG1 ILE 119 1HG1 ILE 119 6.174 -5.055 5.544
919 1HG2 ILE 119 1HG2 ILE 119 8.272 -8.405 7.003
920 2HG2 ILE 119 2HG2 ILE 119 8.836 -7.583 5.547
921 3HG2 ILE 119 3HG2 ILE 119 7.278 -8.409 5.545
922 1HD1 ILE 119 1HD1 ILE 119 8.074 -4.016 4.378
923 2HD1 ILE 119 2HD1 ILE 119 9.162 -5.113 5.230
924 3HD1 ILE 119 3HD1 ILE 119 8.209 -3.937 6.134
925 H SER 120 H SER 120 6.309 -6.083 9.617
926 HA SER 120 HA SER 120 7.322 -8.489 10.739
927 1HB SER 120 2HB SER 120 6.471 -5.837 11.870
928 2HB SER 120 1HB SER 120 6.884 -7.178 12.939
929 HG SER 120 HG SER 120 8.708 -5.903 12.523
930 H HIS 121 H HIS 121 4.278 -6.715 11.259
931 HA HIS 121 HA HIS 121 3.063 -8.614 12.907
932 1HB HIS 121 2HB HIS 121 1.992 -6.449 11.122
933 2HB HIS 121 1HB HIS 121 0.895 -7.523 11.987
934 HD1 HIS 121 1HD HIS 121 4.098 -6.084 13.398
935 HD2 HIS 121 2HD HIS 121 -0.018 -5.750 13.872
936 HE1 HIS 121 1HE HIS 121 3.770 -4.640 15.430
937 HE2 HIS 121 2HE HIS 121 1.274 -4.378 15.644
938 H TYR 122 H TYR 122 3.462 -8.498 9.481
939 HA TYR 122 HA TYR 122 1.449 -10.417 8.853
940 1HB TYR 122 2HB TYR 122 2.662 -8.601 7.347
941 2HB TYR 122 1HB TYR 122 3.756 -9.942 7.024
942 HD1 TYR 122 1HD TYR 122 3.302 -10.586 4.831
943 HD2 TYR 122 2HD TYR 122 0.062 -9.953 7.515
944 HE1 TYR 122 1HE TYR 122 1.739 -11.453 3.142
945 HE2 TYR 122 2HE TYR 122 -1.508 -10.820 5.834
946 HH TYR 122 HH TYR 122 -0.610 -11.343 2.575
947 H GLN 123 H GLN 123 5.014 -10.559 8.759
948 HA GLN 123 HA GLN 123 6.472 -12.296 8.964
949 1HB GLN 123 2HB GLN 123 4.929 -12.376 11.151
950 2HB GLN 123 1HB GLN 123 4.507 -13.943 10.473
951 1HG GLN 123 2HG GLN 123 6.704 -14.732 10.640
952 2HG GLN 123 1HG GLN 123 7.359 -13.110 10.863
953 1HE2 GLN 123 1HE2 GLN 123 8.290 -13.223 12.800
954 2HE2 GLN 123 2HE2 GLN 123 7.495 -13.683 14.263
955 H GLU 124 H GLU 124 6.573 -14.854 8.751
956 HA GLU 124 HA GLU 124 4.605 -15.884 6.881
957 1HB GLU 124 2HB GLU 124 6.612 -14.565 5.738
958 2HB GLU 124 1HB GLU 124 7.434 -16.100 5.976
959 1HG GLU 124 2HG GLU 124 4.742 -16.154 4.738
960 2HG GLU 124 1HG GLU 124 6.083 -15.540 3.773
Start of MODEL 3
1 1H MET 1 1HT MET 1 12.058 -19.025 3.647
2 2H MET 1 2HT MET 1 13.387 -17.944 3.750
3 3H MET 1 3HT MET 1 13.474 -19.320 2.728
4 HA MET 1 HA MET 1 13.063 -17.652 1.272
5 1HB MET 1 2HB MET 1 11.328 -19.634 1.496
6 2HB MET 1 1HB MET 1 10.223 -18.334 1.922
7 1HG MET 1 2HG MET 1 9.871 -18.068 -0.246
8 2HG MET 1 1HG MET 1 11.499 -17.402 -0.344
9 1HE MET 1 1HE MET 1 9.062 -20.006 -1.073
10 2HE MET 1 2HE MET 1 9.954 -21.288 -0.255
11 3HE MET 1 3HE MET 1 9.884 -21.248 -2.017
12 H GLN 2 H GLN 2 13.576 -15.613 2.052
13 HA GLN 2 HA GLN 2 11.947 -14.137 3.832
14 1HB GLN 2 2HB GLN 2 14.456 -13.826 3.066
15 2HB GLN 2 1HB GLN 2 13.725 -12.754 1.881
16 1HG GLN 2 2HG GLN 2 14.094 -11.240 3.510
17 2HG GLN 2 1HG GLN 2 12.520 -11.819 4.059
18 1HE2 GLN 2 1HE2 GLN 2 14.841 -10.657 5.501
19 2HE2 GLN 2 2HE2 GLN 2 15.210 -11.795 6.749
20 H ARG 3 H ARG 3 12.606 -13.446 0.442
21 HA ARG 3 HA ARG 3 11.374 -12.479 -1.204
22 1HB ARG 3 2HB ARG 3 10.015 -14.593 -0.649
23 2HB ARG 3 1HB ARG 3 8.905 -13.504 0.172
24 1HG ARG 3 2HG ARG 3 7.941 -12.959 -1.743
25 2HG ARG 3 1HG ARG 3 9.492 -12.482 -2.437
26 1HD ARG 3 2HD ARG 3 8.633 -15.357 -2.261
27 2HD ARG 3 1HD ARG 3 8.190 -14.329 -3.621
28 HE ARG 3 HE ARG 3 11.002 -14.772 -2.871
29 1HH1 ARG 3 1HH1 ARG 3 8.453 -14.792 -5.267
30 2HH1 ARG 3 2HH1 ARG 3 9.531 -15.106 -6.583
31 1HH2 ARG 3 1HH2 ARG 3 12.409 -15.185 -4.605
32 2HH2 ARG 3 2HH2 ARG 3 11.773 -15.328 -6.210
33 H GLY 4 H GLY 4 12.114 -10.567 0.335
34 1HA GLY 4 2HA GLY 4 9.901 -9.129 1.536
35 2HA GLY 4 1HA GLY 4 11.569 -8.579 1.426
36 H ILE 5 H ILE 5 8.517 -8.856 -0.285
37 HA ILE 5 HA ILE 5 9.526 -6.957 -2.300
38 HB ILE 5 HB ILE 5 7.004 -8.555 -2.620
39 1HG1 ILE 5 2HG1 ILE 5 8.487 -10.338 -2.297
40 2HG1 ILE 5 1HG1 ILE 5 8.504 -10.117 -4.041
41 1HG2 ILE 5 1HG2 ILE 5 8.332 -6.604 -4.141
42 2HG2 ILE 5 2HG2 ILE 5 6.924 -7.562 -4.600
43 3HG2 ILE 5 3HG2 ILE 5 8.543 -8.132 -4.997
44 1HD1 ILE 5 1HD1 ILE 5 10.565 -8.523 -3.283
45 2HD1 ILE 5 2HD1 ILE 5 10.719 -10.205 -3.789
46 3HD1 ILE 5 3HD1 ILE 5 10.644 -9.805 -2.073
47 H VAL 6 H VAL 6 8.943 -4.928 -1.864
48 HA VAL 6 HA VAL 6 6.307 -4.451 -0.645
49 HB VAL 6 HB VAL 6 8.100 -3.550 0.721
50 1HG1 VAL 6 1HG1 VAL 6 9.466 -3.157 -1.581
51 2HG1 VAL 6 2HG1 VAL 6 9.889 -2.423 -0.043
52 3HG1 VAL 6 3HG1 VAL 6 8.948 -1.513 -1.223
53 1HG2 VAL 6 1HG2 VAL 6 7.175 -1.004 -0.395
54 2HG2 VAL 6 2HG2 VAL 6 6.951 -1.686 1.215
55 3HG2 VAL 6 3HG2 VAL 6 5.884 -2.171 -0.102
56 H TRP 7 H TRP 7 4.780 -3.560 -1.862
57 HA TRP 7 HA TRP 7 5.623 -2.175 -4.319
58 1HB TRP 7 2HB TRP 7 3.360 -4.060 -3.777
59 2HB TRP 7 1HB TRP 7 3.189 -2.845 -5.041
60 HD1 TRP 7 HD1 TRP 7 6.694 -4.083 -4.713
61 HE1 TRP 7 1HE TRP 7 7.262 -5.672 -6.647
62 HE3 TRP 7 3HE TRP 7 1.990 -4.804 -6.562
63 HZ2 TRP 7 2HZ TRP 7 5.891 -7.065 -8.682
64 HZ3 TRP 7 3HZ TRP 7 1.698 -6.284 -8.505
65 HH2 TRP 7 HH2 TRP 7 3.612 -7.392 -9.541
66 H VAL 8 H VAL 8 4.879 -0.181 -4.723
67 HA VAL 8 HA VAL 8 2.956 0.979 -2.815
68 HB VAL 8 HB VAL 8 5.014 2.734 -4.054
69 1HG1 VAL 8 1HG1 VAL 8 4.019 4.146 -2.669
70 2HG1 VAL 8 2HG1 VAL 8 4.745 3.260 -1.330
71 3HG1 VAL 8 3HG1 VAL 8 3.128 2.843 -1.887
72 1HG2 VAL 8 1HG2 VAL 8 5.743 0.449 -2.461
73 2HG2 VAL 8 2HG2 VAL 8 6.157 1.942 -1.623
74 3HG2 VAL 8 3HG2 VAL 8 6.774 1.644 -3.248
75 H VAL 9 H VAL 9 1.491 2.519 -3.636
76 HA VAL 9 HA VAL 9 1.560 2.862 -6.562
77 HB VAL 9 HB VAL 9 -0.957 2.693 -4.891
78 1HG1 VAL 9 1HG1 VAL 9 -1.143 2.371 -7.782
79 2HG1 VAL 9 2HG1 VAL 9 -0.551 3.959 -7.291
80 3HG1 VAL 9 3HG1 VAL 9 -2.100 3.371 -6.688
81 1HG2 VAL 9 1HG2 VAL 9 -0.731 0.650 -6.918
82 2HG2 VAL 9 2HG2 VAL 9 -0.977 0.482 -5.171
83 3HG2 VAL 9 3HG2 VAL 9 0.659 0.586 -5.821
84 H ASP 10 H ASP 10 2.100 4.889 -6.995
85 HA ASP 10 HA ASP 10 0.657 7.100 -5.844
86 1HB ASP 10 2HB ASP 10 2.761 8.205 -4.985
87 2HB ASP 10 1HB ASP 10 2.220 6.817 -4.052
88 H ASP 11 H ASP 11 2.628 9.077 -6.470
89 HA ASP 11 HA ASP 11 2.206 9.267 -9.280
90 1HB ASP 11 2HB ASP 11 2.389 11.117 -7.364
91 2HB ASP 11 1HB ASP 11 4.060 11.145 -7.918
92 H ASP 12 H ASP 12 4.142 7.185 -8.109
93 HA ASP 12 HA ASP 12 6.184 6.291 -8.537
94 1HB ASP 12 2HB ASP 12 6.681 6.063 -10.896
95 2HB ASP 12 1HB ASP 12 4.940 5.973 -10.663
96 H SER 13 H SER 13 8.132 7.165 -10.508
97 HA SER 13 HA SER 13 10.152 8.188 -10.283
98 1HB SER 13 2HB SER 13 9.987 10.435 -11.094
99 2HB SER 13 1HB SER 13 8.709 9.457 -11.827
100 HG SER 13 HG SER 13 7.304 10.323 -10.173
101 H SER 14 H SER 14 8.689 10.993 -8.876
102 HA SER 14 HA SER 14 10.603 11.380 -6.936
103 1HB SER 14 2HB SER 14 8.496 12.824 -7.801
104 2HB SER 14 1HB SER 14 7.882 12.306 -6.230
105 HG SER 14 HG SER 14 10.033 13.972 -6.847
106 H ILE 15 H ILE 15 7.288 10.220 -6.261
107 HA ILE 15 HA ILE 15 7.850 9.502 -3.600
108 HB ILE 15 HB ILE 15 5.690 8.266 -5.296
109 1HG1 ILE 15 2HG1 ILE 15 5.672 10.748 -5.494
110 2HG1 ILE 15 1HG1 ILE 15 4.247 10.113 -4.680
111 1HG2 ILE 15 1HG2 ILE 15 5.709 8.893 -2.354
112 2HG2 ILE 15 2HG2 ILE 15 6.178 7.329 -3.021
113 3HG2 ILE 15 3HG2 ILE 15 4.533 7.927 -3.243
114 1HD1 ILE 15 1HD1 ILE 15 5.279 12.184 -3.689
115 2HD1 ILE 15 2HD1 ILE 15 6.628 11.164 -3.188
116 3HD1 ILE 15 3HD1 ILE 15 5.006 10.843 -2.576
117 H ARG 16 H ARG 16 8.402 7.900 -6.595
118 HA ARG 16 HA ARG 16 8.620 5.251 -5.528
119 1HB ARG 16 2HB ARG 16 8.100 5.756 -7.923
120 2HB ARG 16 1HB ARG 16 9.747 6.339 -8.113
121 1HG ARG 16 2HG ARG 16 10.359 3.967 -7.180
122 2HG ARG 16 1HG ARG 16 8.751 3.561 -7.766
123 1HD ARG 16 2HD ARG 16 9.810 4.970 -9.864
124 2HD ARG 16 1HD ARG 16 11.206 4.089 -9.242
125 HE ARG 16 HE ARG 16 9.082 3.000 -10.733
126 1HH1 ARG 16 1HH1 ARG 16 11.117 2.281 -7.988
127 2HH1 ARG 16 2HH1 ARG 16 10.938 0.565 -8.147
128 1HH2 ARG 16 1HH2 ARG 16 8.848 0.742 -10.940
129 2HH2 ARG 16 2HH2 ARG 16 9.656 -0.308 -9.825
130 H TRP 17 H TRP 17 10.963 7.680 -6.643
131 HA TRP 17 HA TRP 17 13.274 6.246 -6.078
132 1HB TRP 17 2HB TRP 17 13.097 8.375 -7.419
133 2HB TRP 17 1HB TRP 17 13.045 9.243 -5.887
134 HD1 TRP 17 HD1 TRP 17 15.411 7.025 -7.963
135 HE1 TRP 17 1HE TRP 17 17.828 7.504 -7.218
136 HE3 TRP 17 3HE TRP 17 14.445 10.156 -4.041
137 HZ2 TRP 17 2HZ TRP 17 19.150 9.009 -5.230
138 HZ3 TRP 17 3HZ TRP 17 16.342 11.072 -2.768
139 HH2 TRP 17 HH2 TRP 17 18.645 10.509 -3.351
140 H VAL 18 H VAL 18 11.342 8.315 -3.968
141 HA VAL 18 HA VAL 18 13.212 8.379 -1.852
142 HB VAL 18 HB VAL 18 10.242 8.692 -1.524
143 1HG1 VAL 18 1HG1 VAL 18 10.698 9.760 0.449
144 2HG1 VAL 18 2HG1 VAL 18 12.306 10.265 -0.069
145 3HG1 VAL 18 3HG1 VAL 18 12.019 8.592 0.407
146 1HG2 VAL 18 1HG2 VAL 18 11.476 11.219 -1.780
147 2HG2 VAL 18 2HG2 VAL 18 10.268 10.483 -2.833
148 3HG2 VAL 18 3HG2 VAL 18 11.986 10.248 -3.164
149 H LEU 19 H LEU 19 10.411 6.348 -2.468
150 HA LEU 19 HA LEU 19 10.811 4.882 -0.039
151 1HB LEU 19 2HB LEU 19 8.630 5.358 -1.670
152 2HB LEU 19 1HB LEU 19 8.976 3.658 -1.926
153 HG LEU 19 HG LEU 19 8.804 3.244 0.481
154 1HD1 LEU 19 1HD1 LEU 19 8.257 6.200 0.608
155 2HD1 LEU 19 2HD1 LEU 19 9.550 5.305 1.405
156 3HD1 LEU 19 3HD1 LEU 19 7.878 5.079 1.915
157 1HD2 LEU 19 1HD2 LEU 19 6.736 3.798 -1.283
158 2HD2 LEU 19 2HD2 LEU 19 6.299 4.664 0.190
159 3HD2 LEU 19 3HD2 LEU 19 6.615 2.929 0.246
160 H GLU 20 H GLU 20 11.659 4.480 -3.377
161 HA GLU 20 HA GLU 20 12.066 1.693 -3.262
162 1HB GLU 20 2HB GLU 20 13.104 1.835 -5.376
163 2HB GLU 20 1HB GLU 20 11.803 3.006 -5.370
164 1HG GLU 20 2HG GLU 20 13.490 4.768 -4.917
165 2HG GLU 20 1HG GLU 20 14.744 3.546 -5.115
166 H ARG 21 H ARG 21 14.494 4.274 -3.322
167 HA ARG 21 HA ARG 21 16.679 2.639 -2.741
168 1HB ARG 21 2HB ARG 21 16.219 5.582 -2.282
169 2HB ARG 21 1HB ARG 21 17.766 4.797 -1.985
170 1HG ARG 21 2HG ARG 21 16.666 4.205 -4.617
171 2HG ARG 21 1HG ARG 21 16.961 5.925 -4.350
172 1HD ARG 21 2HD ARG 21 19.265 5.391 -3.649
173 2HD ARG 21 1HD ARG 21 18.956 3.692 -3.995
174 HE ARG 21 HE ARG 21 18.971 5.833 -6.023
175 1HH1 ARG 21 1HH1 ARG 21 19.477 2.490 -5.108
176 2HH1 ARG 21 2HH1 ARG 21 20.063 2.032 -6.670
177 1HH2 ARG 21 1HH2 ARG 21 19.738 5.213 -8.066
178 2HH2 ARG 21 2HH2 ARG 21 20.208 3.568 -8.345
179 H ALA 22 H ALA 22 14.788 4.683 -0.506
180 HA ALA 22 HA ALA 22 16.160 4.033 1.817
181 1HB ALA 22 1HB ALA 22 14.730 5.781 2.172
182 2HB ALA 22 2HB ALA 22 13.781 4.473 2.874
183 3HB ALA 22 3HB ALA 22 13.428 5.041 1.243
184 H LEU 23 H LEU 23 13.242 2.540 0.537
185 HA LEU 23 HA LEU 23 13.142 0.521 2.517
186 1HB LEU 23 2HB LEU 23 11.297 1.396 0.897
187 2HB LEU 23 1HB LEU 23 11.932 0.185 -0.199
188 HG LEU 23 HG LEU 23 11.094 -1.560 1.020
189 1HD1 LEU 23 1HD1 LEU 23 10.434 -1.289 3.474
190 2HD1 LEU 23 2HD1 LEU 23 11.381 0.199 3.430
191 3HD1 LEU 23 3HD1 LEU 23 12.155 -1.349 3.093
192 1HD2 LEU 23 1HD2 LEU 23 9.068 0.136 2.252
193 2HD2 LEU 23 2HD2 LEU 23 8.911 -1.132 1.043
194 3HD2 LEU 23 3HD2 LEU 23 9.363 0.495 0.551
195 H ALA 24 H ALA 24 14.876 0.885 -0.436
196 HA ALA 24 HA ALA 24 15.453 -1.856 -0.885
197 1HB ALA 24 1HB ALA 24 15.725 -0.115 -2.628
198 2HB ALA 24 2HB ALA 24 17.178 -1.086 -2.397
199 3HB ALA 24 3HB ALA 24 17.086 0.541 -1.721
200 H GLY 25 H GLY 25 16.868 0.732 1.020
201 1HA GLY 25 2HA GLY 25 19.276 -0.569 1.726
202 2HA GLY 25 1HA GLY 25 18.490 0.708 2.647
203 H ALA 26 H ALA 26 15.995 -0.934 2.806
204 HA ALA 26 HA ALA 26 16.643 -2.292 5.235
205 1HB ALA 26 1HB ALA 26 14.139 -1.681 3.750
206 2HB ALA 26 2HB ALA 26 14.581 -1.313 5.416
207 3HB ALA 26 3HB ALA 26 14.113 -2.954 4.972
208 H GLY 27 H GLY 27 16.544 -3.181 1.946
209 1HA GLY 27 2HA GLY 27 17.428 -5.268 1.238
210 2HA GLY 27 1HA GLY 27 16.871 -5.981 2.739
211 H LEU 28 H LEU 28 14.704 -3.981 0.808
212 HA LEU 28 HA LEU 28 13.390 -6.443 -0.077
213 1HB LEU 28 2HB LEU 28 11.637 -4.137 0.420
214 2HB LEU 28 1HB LEU 28 11.361 -5.842 0.713
215 HG LEU 28 HG LEU 28 13.136 -5.390 2.651
216 1HD1 LEU 28 1HD1 LEU 28 12.197 -3.096 3.564
217 2HD1 LEU 28 2HD1 LEU 28 12.169 -2.759 1.833
218 3HD1 LEU 28 3HD1 LEU 28 13.675 -3.233 2.615
219 1HD2 LEU 28 1HD2 LEU 28 10.579 -4.403 3.528
220 2HD2 LEU 28 2HD2 LEU 28 11.394 -5.916 3.923
221 3HD2 LEU 28 3HD2 LEU 28 10.401 -5.802 2.469
222 H THR 29 H THR 29 11.669 -5.966 -1.796
223 HA THR 29 HA THR 29 12.914 -4.239 -3.819
224 HB THR 29 HB THR 29 10.957 -6.534 -4.036
225 HG1 THR 29 1HG THR 29 13.328 -6.839 -3.768
226 1HG2 THR 29 1HG2 THR 29 11.493 -4.426 -5.961
227 2HG2 THR 29 2HG2 THR 29 10.237 -5.663 -5.951
228 3HG2 THR 29 3HG2 THR 29 11.840 -6.039 -6.584
229 H CYS 30 H CYS 30 12.125 -2.239 -3.679
230 HA CYS 30 HA CYS 30 9.269 -1.825 -3.172
231 1HB CYS 30 2HB CYS 30 10.820 -0.615 -1.742
232 2HB CYS 30 1HB CYS 30 11.582 0.102 -3.153
233 HG CYS 30 HG CYS 30 8.606 0.763 -2.649
234 H THR 31 H THR 31 8.034 -1.732 -4.934
235 HA THR 31 HA THR 31 9.012 -0.150 -7.213
236 HB THR 31 HB THR 31 8.813 -2.724 -7.583
237 HG1 THR 31 1HG THR 31 7.380 -0.989 -9.311
238 1HG2 THR 31 1HG2 THR 31 6.318 -2.490 -6.614
239 2HG2 THR 31 2HG2 THR 31 6.828 -3.735 -7.753
240 3HG2 THR 31 3HG2 THR 31 6.013 -2.290 -8.338
241 H THR 32 H THR 32 7.418 1.186 -8.200
242 HA THR 32 HA THR 32 5.015 1.477 -6.548
243 HB THR 32 HB THR 32 5.090 3.875 -7.038
244 HG1 THR 32 1HG THR 32 6.613 4.707 -8.297
245 1HG2 THR 32 1HG2 THR 32 6.701 2.520 -5.280
246 2HG2 THR 32 2HG2 THR 32 6.451 4.270 -5.323
247 3HG2 THR 32 3HG2 THR 32 7.837 3.555 -6.144
248 H PHE 33 H PHE 33 3.176 2.616 -7.644
249 HA PHE 33 HA PHE 33 2.995 1.910 -10.490
250 1HB PHE 33 2HB PHE 33 0.971 1.227 -8.352
251 2HB PHE 33 1HB PHE 33 0.769 0.956 -10.072
252 HD1 PHE 33 1HD PHE 33 1.190 -1.171 -10.862
253 HD2 PHE 33 2HD PHE 33 3.239 0.179 -7.391
254 HE1 PHE 33 1HE PHE 33 2.275 -3.364 -10.649
255 HE2 PHE 33 2HE PHE 33 4.338 -2.003 -7.176
256 HZ PHE 33 HZ PHE 33 3.850 -3.790 -8.809
257 H GLU 34 H GLU 34 0.893 2.810 -11.482
258 HA GLU 34 HA GLU 34 0.867 5.618 -11.100
259 1HB GLU 34 2HB GLU 34 -0.875 5.649 -12.820
260 2HB GLU 34 1HB GLU 34 0.473 4.619 -13.282
261 1HG GLU 34 2HG GLU 34 -1.166 3.200 -13.854
262 2HG GLU 34 1HG GLU 34 -1.113 2.792 -12.147
263 H ASN 35 H ASN 35 -1.700 3.194 -10.522
264 HA ASN 35 HA ASN 35 -2.621 4.689 -8.261
265 1HB ASN 35 2HB ASN 35 -4.412 4.372 -10.676
266 2HB ASN 35 1HB ASN 35 -4.946 4.923 -9.094
267 1HD2 ASN 35 1HD2 ASN 35 -4.523 6.986 -8.451
268 2HD2 ASN 35 2HD2 ASN 35 -3.842 8.186 -9.490
269 H GLY 36 H GLY 36 -4.884 3.588 -7.587
270 1HA GLY 36 2HA GLY 36 -4.266 1.097 -6.624
271 2HA GLY 36 1HA GLY 36 -5.905 1.692 -6.808
272 H ASN 37 H ASN 37 -5.179 1.780 -9.883
273 HA ASN 37 HA ASN 37 -6.217 -0.863 -10.334
274 1HB ASN 37 2HB ASN 37 -6.254 1.649 -11.742
275 2HB ASN 37 1HB ASN 37 -5.787 0.336 -12.818
276 1HD2 ASN 37 1HD2 ASN 37 -7.907 0.094 -10.017
277 2HD2 ASN 37 2HD2 ASN 37 -9.329 -0.325 -10.903
278 H GLU 38 H GLU 38 -3.255 0.897 -10.964
279 HA GLU 38 HA GLU 38 -2.038 -0.795 -12.775
280 1HB GLU 38 2HB GLU 38 -1.296 1.456 -11.775
281 2HB GLU 38 1HB GLU 38 -0.490 0.476 -10.573
282 1HG GLU 38 2HG GLU 38 1.234 0.590 -12.001
283 2HG GLU 38 1HG GLU 38 0.386 -0.724 -12.814
284 H VAL 39 H VAL 39 -1.373 -0.882 -9.205
285 HA VAL 39 HA VAL 39 0.195 -3.144 -9.254
286 HB VAL 39 HB VAL 39 -1.735 -2.244 -7.121
287 1HG1 VAL 39 1HG1 VAL 39 -0.665 -3.807 -5.607
288 2HG1 VAL 39 2HG1 VAL 39 0.357 -4.405 -6.908
289 3HG1 VAL 39 3HG1 VAL 39 -1.379 -4.674 -6.958
290 1HG2 VAL 39 1HG2 VAL 39 0.240 -1.440 -6.010
291 2HG2 VAL 39 2HG2 VAL 39 0.225 -0.811 -7.659
292 3HG2 VAL 39 3HG2 VAL 39 1.277 -2.161 -7.238
293 H LEU 40 H LEU 40 -3.282 -2.948 -9.509
294 HA LEU 40 HA LEU 40 -3.922 -5.634 -9.012
295 1HB LEU 40 2HB LEU 40 -5.294 -3.838 -11.005
296 2HB LEU 40 1HB LEU 40 -5.990 -5.208 -10.159
297 HG LEU 40 HG LEU 40 -5.203 -2.556 -8.963
298 1HD1 LEU 40 1HD1 LEU 40 -7.833 -3.921 -9.450
299 2HD1 LEU 40 2HD1 LEU 40 -7.294 -2.355 -10.049
300 3HD1 LEU 40 3HD1 LEU 40 -7.645 -2.571 -8.333
301 1HD2 LEU 40 1HD2 LEU 40 -5.864 -5.168 -7.700
302 2HD2 LEU 40 2HD2 LEU 40 -6.421 -3.679 -6.936
303 3HD2 LEU 40 3HD2 LEU 40 -4.696 -3.941 -7.207
304 H ALA 41 H ALA 41 -2.912 -3.972 -11.951
305 HA ALA 41 HA ALA 41 -3.230 -6.122 -13.732
306 1HB ALA 41 1HB ALA 41 -1.233 -3.889 -13.947
307 2HB ALA 41 2HB ALA 41 -2.930 -3.757 -14.411
308 3HB ALA 41 3HB ALA 41 -1.866 -4.877 -15.262
309 H ALA 42 H ALA 42 -0.412 -4.990 -11.953
310 HA ALA 42 HA ALA 42 1.295 -7.079 -12.873
311 1HB ALA 42 1HB ALA 42 2.948 -6.183 -11.470
312 2HB ALA 42 2HB ALA 42 1.760 -5.484 -10.369
313 3HB ALA 42 3HB ALA 42 1.995 -4.786 -11.971
314 H LEU 43 H LEU 43 -0.899 -6.613 -10.243
315 HA LEU 43 HA LEU 43 -0.049 -8.625 -8.508
316 1HB LEU 43 2HB LEU 43 -2.474 -7.018 -8.908
317 2HB LEU 43 1HB LEU 43 -2.742 -8.572 -8.154
318 HG LEU 43 HG LEU 43 -0.776 -6.544 -7.128
319 1HD1 LEU 43 1HD1 LEU 43 -2.366 -5.676 -5.727
320 2HD1 LEU 43 2HD1 LEU 43 -3.316 -7.158 -5.709
321 3HD1 LEU 43 3HD1 LEU 43 -3.396 -6.078 -7.102
322 1HD2 LEU 43 1HD2 LEU 43 -1.496 -8.202 -5.077
323 2HD2 LEU 43 2HD2 LEU 43 -0.048 -8.386 -6.069
324 3HD2 LEU 43 3HD2 LEU 43 -1.507 -9.297 -6.460
325 H ALA 44 H ALA 44 -2.018 -8.700 -11.363
326 HA ALA 44 HA ALA 44 -3.220 -11.189 -11.110
327 1HB ALA 44 1HB ALA 44 -4.089 -10.108 -12.899
328 2HB ALA 44 2HB ALA 44 -2.903 -11.090 -13.760
329 3HB ALA 44 3HB ALA 44 -2.539 -9.410 -13.369
330 H SER 45 H SER 45 0.087 -10.438 -11.615
331 HA SER 45 HA SER 45 0.624 -13.256 -12.141
332 1HB SER 45 2HB SER 45 1.739 -10.830 -13.448
333 2HB SER 45 1HB SER 45 2.815 -12.208 -13.209
334 HG SER 45 HG SER 45 1.892 -12.663 -15.106
335 H LYS 46 H LYS 46 0.833 -10.993 -9.806
336 HA LYS 46 HA LYS 46 2.833 -12.457 -8.389
337 1HB LYS 46 2HB LYS 46 3.949 -10.610 -9.947
338 2HB LYS 46 1HB LYS 46 3.525 -9.570 -8.594
339 1HG LYS 46 2HG LYS 46 4.709 -11.785 -7.412
340 2HG LYS 46 1HG LYS 46 5.676 -11.484 -8.857
341 1HD LYS 46 2HD LYS 46 5.307 -8.960 -7.847
342 2HD LYS 46 1HD LYS 46 5.453 -9.936 -6.386
343 1HE LYS 46 2HE LYS 46 7.653 -10.036 -6.657
344 2HE LYS 46 1HE LYS 46 7.439 -10.787 -8.238
345 1HZ LYS 46 1HZ LYS 46 7.478 -7.867 -7.699
346 2HZ LYS 46 2HZ LYS 46 7.265 -8.581 -9.217
347 3HZ LYS 46 3HZ LYS 46 8.735 -8.760 -8.398
348 H THR 47 H THR 47 3.188 -11.515 -6.168
349 HA THR 47 HA THR 47 0.966 -9.869 -5.269
350 HB THR 47 HB THR 47 1.748 -12.508 -4.030
351 HG1 THR 47 1HG THR 47 0.464 -12.824 -5.823
352 1HG2 THR 47 1HG2 THR 47 0.151 -12.218 -2.377
353 2HG2 THR 47 2HG2 THR 47 -0.609 -10.863 -3.211
354 3HG2 THR 47 3HG2 THR 47 0.968 -10.656 -2.447
355 HA PRO 48 HA PRO 48 4.570 -8.095 -3.214
356 1HB PRO 48 2HB PRO 48 3.332 -5.906 -2.230
357 2HB PRO 48 1HB PRO 48 3.795 -6.045 -3.930
358 1HG PRO 48 2HG PRO 48 1.122 -6.517 -2.656
359 2HG PRO 48 1HG PRO 48 1.509 -5.616 -4.136
360 1HD PRO 48 2HD PRO 48 0.586 -8.152 -4.198
361 2HD PRO 48 1HD PRO 48 1.740 -7.535 -5.398
362 H ASP 49 H ASP 49 5.290 -8.038 -1.096
363 HA ASP 49 HA ASP 49 3.759 -9.533 0.799
364 1HB ASP 49 2HB ASP 49 6.420 -8.116 0.997
365 2HB ASP 49 1HB ASP 49 5.713 -9.032 2.324
366 H VAL 50 H VAL 50 4.411 -6.154 0.230
367 HA VAL 50 HA VAL 50 2.434 -5.449 2.259
368 HB VAL 50 HB VAL 50 4.542 -5.300 3.472
369 1HG1 VAL 50 1HG1 VAL 50 5.578 -3.113 1.778
370 2HG1 VAL 50 2HG1 VAL 50 5.719 -4.751 1.143
371 3HG1 VAL 50 3HG1 VAL 50 6.443 -4.343 2.698
372 1HG2 VAL 50 1HG2 VAL 50 4.473 -2.890 4.086
373 2HG2 VAL 50 2HG2 VAL 50 2.888 -3.665 4.063
374 3HG2 VAL 50 3HG2 VAL 50 3.379 -2.620 2.730
375 H LEU 51 H LEU 51 0.996 -4.573 0.824
376 HA LEU 51 HA LEU 51 1.919 -2.830 -1.299
377 1HB LEU 51 2HB LEU 51 -0.011 -4.518 -1.454
378 2HB LEU 51 1HB LEU 51 -0.954 -3.328 -0.577
379 HG LEU 51 HG LEU 51 -0.671 -1.714 -2.354
380 1HD1 LEU 51 1HD1 LEU 51 0.383 -2.990 -4.515
381 2HD1 LEU 51 2HD1 LEU 51 1.403 -3.588 -3.213
382 3HD1 LEU 51 3HD1 LEU 51 1.250 -1.853 -3.489
383 1HD2 LEU 51 1HD2 LEU 51 -2.298 -2.589 -3.647
384 2HD2 LEU 51 2HD2 LEU 51 -2.277 -3.879 -2.447
385 3HD2 LEU 51 3HD2 LEU 51 -1.402 -4.073 -3.964
386 H LEU 52 H LEU 52 2.070 -0.717 -1.196
387 HA LEU 52 HA LEU 52 0.648 0.740 0.941
388 1HB LEU 52 2HB LEU 52 3.301 0.468 0.868
389 2HB LEU 52 1HB LEU 52 3.166 1.803 -0.252
390 HG LEU 52 HG LEU 52 2.282 1.788 2.634
391 1HD1 LEU 52 1HD1 LEU 52 4.647 2.833 1.163
392 2HD1 LEU 52 2HD1 LEU 52 4.539 2.106 2.767
393 3HD1 LEU 52 3HD1 LEU 52 4.014 3.770 2.517
394 1HD2 LEU 52 1HD2 LEU 52 1.487 3.480 0.415
395 2HD2 LEU 52 2HD2 LEU 52 2.252 4.396 1.710
396 3HD2 LEU 52 3HD2 LEU 52 0.847 3.391 2.055
397 H SER 53 H SER 53 -0.846 2.117 0.126
398 HA SER 53 HA SER 53 -0.351 3.189 -2.573
399 1HB SER 53 2HB SER 53 -2.271 1.555 -2.327
400 2HB SER 53 1HB SER 53 -3.080 2.786 -1.361
401 HG SER 53 HG SER 53 -3.560 3.808 -3.127
402 H ASP 54 H ASP 54 -0.296 5.314 -2.815
403 HA ASP 54 HA ASP 54 -0.578 7.004 -0.494
404 1HB ASP 54 2HB ASP 54 1.275 7.234 -2.170
405 2HB ASP 54 1HB ASP 54 0.080 7.805 -3.331
406 H ILE 55 H ILE 55 -2.941 5.749 -2.112
407 HA ILE 55 HA ILE 55 -4.927 6.403 -3.074
408 HB ILE 55 HB ILE 55 -5.614 6.294 -0.834
409 1HG1 ILE 55 2HG1 ILE 55 -6.446 8.999 -1.895
410 2HG1 ILE 55 1HG1 ILE 55 -7.206 7.458 -2.251
411 1HG2 ILE 55 1HG2 ILE 55 -5.152 7.770 0.891
412 2HG2 ILE 55 2HG2 ILE 55 -4.675 9.065 -0.210
413 3HG2 ILE 55 3HG2 ILE 55 -3.629 7.661 0.008
414 1HD1 ILE 55 1HD1 ILE 55 -7.579 9.237 -0.003
415 2HD1 ILE 55 2HD1 ILE 55 -7.272 7.573 0.495
416 3HD1 ILE 55 3HD1 ILE 55 -8.606 7.934 -0.600
417 H ARG 56 H ARG 56 -4.533 7.498 -4.959
418 HA ARG 56 HA ARG 56 -4.225 10.412 -4.778
419 1HB ARG 56 2HB ARG 56 -2.588 8.953 -6.117
420 2HB ARG 56 1HB ARG 56 -3.891 8.786 -7.287
421 1HG ARG 56 2HG ARG 56 -2.337 10.554 -7.917
422 2HG ARG 56 1HG ARG 56 -3.950 11.193 -7.600
423 1HD ARG 56 2HD ARG 56 -3.291 12.300 -5.715
424 2HD ARG 56 1HD ARG 56 -2.029 11.126 -5.339
425 HE ARG 56 HE ARG 56 -1.570 12.779 -7.677
426 1HH1 ARG 56 1HH1 ARG 56 -1.004 12.327 -4.261
427 2HH1 ARG 56 2HH1 ARG 56 0.398 13.344 -4.234
428 1HH2 ARG 56 1HH2 ARG 56 0.270 14.121 -7.638
429 2HH2 ARG 56 2HH2 ARG 56 1.118 14.363 -6.147
430 H MET 57 H MET 57 -6.734 9.155 -4.316
431 HA MET 57 HA MET 57 -8.928 9.296 -4.880
432 1HB MET 57 2HB MET 57 -7.867 11.770 -5.060
433 2HB MET 57 1HB MET 57 -8.523 11.592 -6.681
434 1HG MET 57 2HG MET 57 -10.611 11.874 -5.976
435 2HG MET 57 1HG MET 57 -10.400 10.738 -4.650
436 1HE MET 57 1HE MET 57 -9.162 14.000 -5.959
437 2HE MET 57 2HE MET 57 -8.008 14.155 -4.634
438 3HE MET 57 3HE MET 57 -9.440 15.183 -4.681
439 HA PRO 58 HA PRO 58 -8.039 7.647 -9.297
440 1HB PRO 58 2HB PRO 58 -8.532 5.008 -8.673
441 2HB PRO 58 1HB PRO 58 -6.921 5.724 -8.762
442 1HG PRO 58 2HG PRO 58 -8.623 5.172 -6.365
443 2HG PRO 58 1HG PRO 58 -6.872 4.979 -6.572
444 1HD PRO 58 2HD PRO 58 -7.934 7.069 -5.258
445 2HD PRO 58 1HD PRO 58 -6.455 7.224 -6.220
446 H GLY 59 H GLY 59 -10.160 5.616 -7.305
447 1HA GLY 59 2HA GLY 59 -12.470 6.602 -8.866
448 2HA GLY 59 1HA GLY 59 -12.307 4.934 -8.318
449 H MET 60 H MET 60 -12.333 4.534 -6.025
450 HA MET 60 HA MET 60 -14.207 6.260 -4.626
451 1HB MET 60 2HB MET 60 -13.907 3.539 -4.678
452 2HB MET 60 1HB MET 60 -13.066 3.941 -3.188
453 1HG MET 60 2HG MET 60 -15.498 5.381 -3.202
454 2HG MET 60 1HG MET 60 -15.861 3.725 -3.674
455 1HE MET 60 1HE MET 60 -17.304 3.370 -2.086
456 2HE MET 60 2HE MET 60 -17.229 4.104 -0.485
457 3HE MET 60 3HE MET 60 -16.805 2.405 -0.696
458 H ASP 61 H ASP 61 -12.146 7.749 -4.954
459 HA ASP 61 HA ASP 61 -10.511 9.000 -4.076
460 1HB ASP 61 2HB ASP 61 -10.559 9.489 -1.708
461 2HB ASP 61 1HB ASP 61 -12.190 9.450 -2.358
462 H GLY 62 H GLY 62 -10.556 6.152 -1.930
463 1HA GLY 62 2HA GLY 62 -7.896 5.424 -2.833
464 2HA GLY 62 1HA GLY 62 -7.999 5.941 -1.156
465 H LEU 63 H LEU 63 -10.585 4.846 -0.664
466 HA LEU 63 HA LEU 63 -9.866 2.288 0.184
467 1HB LEU 63 2HB LEU 63 -12.736 2.986 -0.221
468 2HB LEU 63 1HB LEU 63 -11.984 2.102 1.093
469 HG LEU 63 HG LEU 63 -10.881 4.500 1.544
470 1HD1 LEU 63 1HD1 LEU 63 -12.089 6.304 0.878
471 2HD1 LEU 63 2HD1 LEU 63 -13.591 5.395 0.754
472 3HD1 LEU 63 3HD1 LEU 63 -12.372 5.254 -0.508
473 1HD2 LEU 63 1HD2 LEU 63 -11.940 3.892 3.407
474 2HD2 LEU 63 2HD2 LEU 63 -13.230 3.086 2.511
475 3HD2 LEU 63 3HD2 LEU 63 -13.295 4.824 2.782
476 H ALA 64 H ALA 64 -11.074 3.399 -2.837
477 HA ALA 64 HA ALA 64 -12.400 1.168 -3.827
478 1HB ALA 64 1HB ALA 64 -10.835 2.244 -5.925
479 2HB ALA 64 2HB ALA 64 -11.300 3.573 -4.863
480 3HB ALA 64 3HB ALA 64 -12.537 2.533 -5.569
481 H LEU 65 H LEU 65 -8.947 1.894 -3.764
482 HA LEU 65 HA LEU 65 -7.978 -0.184 -5.292
483 1HB LEU 65 2HB LEU 65 -6.523 1.557 -4.584
484 2HB LEU 65 1HB LEU 65 -6.825 1.216 -2.892
485 HG LEU 65 HG LEU 65 -5.483 -0.718 -2.926
486 1HD1 LEU 65 1HD1 LEU 65 -4.899 -0.572 -5.841
487 2HD1 LEU 65 2HD1 LEU 65 -6.394 -1.339 -5.313
488 3HD1 LEU 65 3HD1 LEU 65 -4.842 -1.951 -4.746
489 1HD2 LEU 65 1HD2 LEU 65 -4.441 1.761 -3.983
490 2HD2 LEU 65 2HD2 LEU 65 -3.474 0.372 -4.479
491 3HD2 LEU 65 3HD2 LEU 65 -3.773 0.673 -2.768
492 H LEU 66 H LEU 66 -8.781 -0.207 -1.825
493 HA LEU 66 HA LEU 66 -7.869 -2.798 -1.262
494 1HB LEU 66 2HB LEU 66 -10.285 -1.520 0.003
495 2HB LEU 66 1HB LEU 66 -9.225 -2.728 0.701
496 HG LEU 66 HG LEU 66 -8.010 -0.117 -0.036
497 1HD1 LEU 66 1HD1 LEU 66 -8.804 0.329 2.536
498 2HD1 LEU 66 2HD1 LEU 66 -10.236 -0.419 1.836
499 3HD1 LEU 66 3HD1 LEU 66 -9.553 1.029 1.108
500 1HD2 LEU 66 1HD2 LEU 66 -7.115 -0.746 2.411
501 2HD2 LEU 66 2HD2 LEU 66 -6.402 -1.380 0.928
502 3HD2 LEU 66 3HD2 LEU 66 -7.556 -2.355 1.838
503 H LYS 67 H LYS 67 -11.018 -1.639 -2.375
504 HA LYS 67 HA LYS 67 -12.484 -3.968 -2.243
505 1HB LYS 67 2HB LYS 67 -13.090 -1.524 -3.015
506 2HB LYS 67 1HB LYS 67 -12.815 -2.190 -4.618
507 1HG LYS 67 2HG LYS 67 -14.749 -3.295 -4.609
508 2HG LYS 67 1HG LYS 67 -14.506 -3.884 -2.964
509 1HD LYS 67 2HD LYS 67 -15.305 -1.795 -2.053
510 2HD LYS 67 1HD LYS 67 -15.424 -1.099 -3.669
511 1HE LYS 67 2HE LYS 67 -17.352 -2.186 -4.142
512 2HE LYS 67 1HE LYS 67 -16.887 -3.622 -3.231
513 1HZ LYS 67 1HZ LYS 67 -17.255 -2.150 -1.191
514 2HZ LYS 67 2HZ LYS 67 -18.622 -2.719 -2.010
515 3HZ LYS 67 3HZ LYS 67 -18.104 -1.124 -2.234
516 H GLN 68 H GLN 68 -10.661 -2.794 -5.082
517 HA GLN 68 HA GLN 68 -11.138 -5.023 -6.708
518 1HB GLN 68 2HB GLN 68 -8.811 -3.101 -6.728
519 2HB GLN 68 1HB GLN 68 -9.178 -4.242 -8.014
520 1HG GLN 68 2HG GLN 68 -10.936 -1.981 -7.096
521 2HG GLN 68 1HG GLN 68 -9.952 -2.012 -8.560
522 1HE2 GLN 68 1HE2 GLN 68 -12.693 -1.549 -8.602
523 2HE2 GLN 68 2HE2 GLN 68 -13.474 -2.875 -9.386
524 H ILE 69 H ILE 69 -8.422 -4.324 -4.535
525 HA ILE 69 HA ILE 69 -6.819 -6.490 -5.181
526 HB ILE 69 HB ILE 69 -7.133 -5.285 -2.441
527 1HG1 ILE 69 2HG1 ILE 69 -4.966 -4.535 -4.363
528 2HG1 ILE 69 1HG1 ILE 69 -6.546 -3.767 -4.500
529 1HG2 ILE 69 1HG2 ILE 69 -5.652 -7.491 -3.264
530 2HG2 ILE 69 2HG2 ILE 69 -5.489 -6.594 -1.758
531 3HG2 ILE 69 3HG2 ILE 69 -4.486 -6.175 -3.143
532 1HD1 ILE 69 1HD1 ILE 69 -4.419 -3.330 -2.577
533 2HD1 ILE 69 2HD1 ILE 69 -5.985 -3.605 -1.811
534 3HD1 ILE 69 3HD1 ILE 69 -5.800 -2.320 -2.993
535 H LYS 70 H LYS 70 -9.155 -6.233 -2.570
536 HA LYS 70 HA LYS 70 -8.929 -8.826 -1.593
537 1HB LYS 70 2HB LYS 70 -11.036 -8.462 -0.481
538 2HB LYS 70 1HB LYS 70 -10.091 -6.982 -0.433
539 1HG LYS 70 2HG LYS 70 -11.459 -5.911 -1.976
540 2HG LYS 70 1HG LYS 70 -12.159 -7.427 -2.547
541 1HD LYS 70 2HD LYS 70 -13.459 -7.680 -0.602
542 2HD LYS 70 1HD LYS 70 -12.529 -6.463 0.275
543 1HE LYS 70 2HE LYS 70 -13.727 -4.765 -0.572
544 2HE LYS 70 1HE LYS 70 -13.779 -5.481 -2.183
545 1HZ LYS 70 1HZ LYS 70 -15.899 -5.921 -1.761
546 2HZ LYS 70 2HZ LYS 70 -15.749 -5.529 -0.121
547 3HZ LYS 70 3HZ LYS 70 -15.381 -7.091 -0.654
548 H GLN 71 H GLN 71 -10.502 -7.670 -4.425
549 HA GLN 71 HA GLN 71 -12.338 -9.766 -4.789
550 1HB GLN 71 2HB GLN 71 -11.481 -7.455 -6.226
551 2HB GLN 71 1HB GLN 71 -11.541 -8.824 -7.325
552 1HG GLN 71 2HG GLN 71 -13.784 -8.962 -7.249
553 2HG GLN 71 1HG GLN 71 -13.860 -8.522 -5.542
554 1HE2 GLN 71 1HE2 GLN 71 -12.716 -6.117 -5.415
555 2HE2 GLN 71 2HE2 GLN 71 -13.574 -4.964 -6.373
556 H ARG 72 H ARG 72 -9.147 -9.244 -6.187
557 HA ARG 72 HA ARG 72 -9.126 -12.020 -7.114
558 1HB ARG 72 2HB ARG 72 -7.474 -9.613 -7.843
559 2HB ARG 72 1HB ARG 72 -7.014 -11.237 -8.336
560 1HG ARG 72 2HG ARG 72 -9.228 -11.464 -9.443
561 2HG ARG 72 1HG ARG 72 -9.542 -9.771 -9.057
562 1HD ARG 72 2HD ARG 72 -7.772 -9.030 -10.438
563 2HD ARG 72 1HD ARG 72 -7.119 -10.656 -10.602
564 HE ARG 72 HE ARG 72 -9.489 -9.584 -11.948
565 1HH1 ARG 72 1HH1 ARG 72 -7.242 -12.225 -11.486
566 2HH1 ARG 72 2HH1 ARG 72 -7.749 -13.062 -12.912
567 1HH2 ARG 72 1HH2 ARG 72 -10.153 -10.696 -13.815
568 2HH2 ARG 72 2HH2 ARG 72 -9.397 -12.200 -14.231
569 H HIS 73 H HIS 73 -8.012 -10.279 -4.463
570 HA HIS 73 HA HIS 73 -5.910 -12.294 -4.019
571 1HB HIS 73 2HB HIS 73 -5.811 -9.440 -3.034
572 2HB HIS 73 1HB HIS 73 -4.528 -10.649 -2.936
573 HD1 HIS 73 1HD HIS 73 -3.727 -11.556 -5.397
574 HD2 HIS 73 2HD HIS 73 -5.656 -7.885 -5.229
575 HE1 HIS 73 1HE HIS 73 -3.234 -10.441 -7.593
576 HE2 HIS 73 2HE HIS 73 -4.548 -8.290 -7.529
577 HA PRO 74 HA PRO 74 -8.147 -13.403 -0.395
578 1HB PRO 74 2HB PRO 74 -6.147 -14.678 0.951
579 2HB PRO 74 1HB PRO 74 -7.015 -15.385 -0.415
580 1HG PRO 74 2HG PRO 74 -4.330 -14.079 -0.345
581 2HG PRO 74 1HG PRO 74 -4.860 -15.510 -1.243
582 1HD PRO 74 2HD PRO 74 -4.591 -13.062 -2.384
583 2HD PRO 74 1HD PRO 74 -5.769 -14.266 -2.942
584 H MET 75 H MET 75 -4.809 -12.516 0.569
585 HA MET 75 HA MET 75 -5.965 -10.547 2.396
586 1HB MET 75 2HB MET 75 -4.180 -12.836 3.111
587 2HB MET 75 1HB MET 75 -4.130 -11.352 4.054
588 1HG MET 75 2HG MET 75 -6.750 -11.711 4.079
589 2HG MET 75 1HG MET 75 -6.271 -13.389 3.826
590 1HE MET 75 1HE MET 75 -6.593 -10.706 7.029
591 2HE MET 75 2HE MET 75 -7.395 -12.207 7.494
592 3HE MET 75 3HE MET 75 -7.714 -11.490 5.916
593 H LEU 76 H LEU 76 -4.898 -9.752 0.073
594 HA LEU 76 HA LEU 76 -2.123 -9.200 0.167
595 1HB LEU 76 2HB LEU 76 -3.870 -9.102 -1.808
596 2HB LEU 76 1HB LEU 76 -4.043 -7.444 -1.275
597 HG LEU 76 HG LEU 76 -2.432 -7.954 -3.209
598 1HD1 LEU 76 1HD1 LEU 76 -1.540 -5.936 -2.813
599 2HD1 LEU 76 2HD1 LEU 76 -0.993 -6.374 -1.193
600 3HD1 LEU 76 3HD1 LEU 76 -2.680 -5.923 -1.466
601 1HD2 LEU 76 1HD2 LEU 76 -1.328 -9.734 -1.543
602 2HD2 LEU 76 2HD2 LEU 76 -0.337 -8.325 -1.161
603 3HD2 LEU 76 3HD2 LEU 76 -0.427 -8.918 -2.818
604 HA PRO 77 HA PRO 77 -2.626 -6.114 3.463
605 1HB PRO 77 2HB PRO 77 0.050 -5.434 3.486
606 2HB PRO 77 1HB PRO 77 -0.659 -6.756 4.417
607 1HG PRO 77 2HG PRO 77 0.784 -6.840 1.800
608 2HG PRO 77 1HG PRO 77 0.892 -7.953 3.178
609 1HD PRO 77 2HD PRO 77 -0.517 -8.575 0.988
610 2HD PRO 77 1HD PRO 77 -1.076 -9.042 2.608
611 H VAL 78 H VAL 78 -3.162 -4.036 3.231
612 HA VAL 78 HA VAL 78 -1.897 -2.469 1.085
613 HB VAL 78 HB VAL 78 -4.779 -2.061 1.830
614 1HG1 VAL 78 1HG1 VAL 78 -3.052 -0.562 0.355
615 2HG1 VAL 78 2HG1 VAL 78 -4.808 -0.536 0.191
616 3HG1 VAL 78 3HG1 VAL 78 -3.838 -1.530 -0.892
617 1HG2 VAL 78 1HG2 VAL 78 -3.862 -3.739 -0.500
618 2HG2 VAL 78 2HG2 VAL 78 -5.513 -3.464 0.058
619 3HG2 VAL 78 3HG2 VAL 78 -4.402 -4.422 1.034
620 H ILE 79 H ILE 79 -1.288 -0.442 1.628
621 HA ILE 79 HA ILE 79 -2.143 0.581 4.252
622 HB ILE 79 HB ILE 79 0.632 0.923 3.127
623 1HG1 ILE 79 2HG1 ILE 79 0.577 -0.680 5.497
624 2HG1 ILE 79 1HG1 ILE 79 -0.508 -1.395 4.308
625 1HG2 ILE 79 1HG2 ILE 79 -0.683 2.384 5.024
626 2HG2 ILE 79 2HG2 ILE 79 1.068 2.237 4.883
627 3HG2 ILE 79 3HG2 ILE 79 0.184 1.197 5.999
628 1HD1 ILE 79 1HD1 ILE 79 2.431 -1.061 4.243
629 2HD1 ILE 79 2HD1 ILE 79 1.553 -0.984 2.715
630 3HD1 ILE 79 3HD1 ILE 79 1.428 -2.419 3.734
631 H ILE 80 H ILE 80 -3.343 2.308 3.866
632 HA ILE 80 HA ILE 80 -2.706 4.034 1.592
633 HB ILE 80 HB ILE 80 -5.149 4.222 3.330
634 1HG1 ILE 80 2HG1 ILE 80 -5.063 1.942 2.497
635 2HG1 ILE 80 1HG1 ILE 80 -6.297 2.834 1.621
636 1HG2 ILE 80 1HG2 ILE 80 -4.747 6.137 1.924
637 2HG2 ILE 80 2HG2 ILE 80 -6.123 5.232 1.298
638 3HG2 ILE 80 3HG2 ILE 80 -4.549 5.102 0.512
639 1HD1 ILE 80 1HD1 ILE 80 -4.843 3.078 -0.276
640 2HD1 ILE 80 2HD1 ILE 80 -4.956 1.378 0.175
641 3HD1 ILE 80 3HD1 ILE 80 -3.520 2.309 0.601
642 H MET 81 H MET 81 -2.437 6.271 1.795
643 HA MET 81 HA MET 81 -1.277 7.116 4.303
644 1HB MET 81 2HB MET 81 -0.633 9.132 3.113
645 2HB MET 81 1HB MET 81 -0.237 7.715 2.153
646 1HG MET 81 2HG MET 81 -1.624 8.291 0.494
647 2HG MET 81 1HG MET 81 -2.871 8.866 1.593
648 1HE MET 81 1HE MET 81 -2.467 11.895 -0.656
649 2HE MET 81 2HE MET 81 -3.518 11.551 0.716
650 3HE MET 81 3HE MET 81 -3.192 10.298 -0.480
651 H THR 82 H THR 82 -4.193 7.769 2.468
652 HA THR 82 HA THR 82 -5.257 9.269 4.757
653 HB THR 82 HB THR 82 -5.757 10.006 1.868
654 HG1 THR 82 1HG THR 82 -3.816 10.862 3.680
655 1HG2 THR 82 1HG2 THR 82 -7.203 10.689 4.123
656 2HG2 THR 82 2HG2 THR 82 -7.238 11.495 2.555
657 3HG2 THR 82 3HG2 THR 82 -6.164 12.082 3.826
658 H ALA 83 H ALA 83 -7.509 9.024 5.112
659 HA ALA 83 HA ALA 83 -8.631 6.667 3.784
660 1HB ALA 83 1HB ALA 83 -9.406 8.007 6.366
661 2HB ALA 83 2HB ALA 83 -8.530 6.487 6.176
662 3HB ALA 83 3HB ALA 83 -10.218 6.599 5.675
663 H HIS 84 H HIS 84 -9.146 10.081 4.152
664 HA HIS 84 HA HIS 84 -10.791 11.489 3.431
665 1HB HIS 84 2HB HIS 84 -10.358 9.497 1.248
666 2HB HIS 84 1HB HIS 84 -11.609 10.717 1.046
667 HD1 HIS 84 1HD HIS 84 -9.709 12.858 2.678
668 HD2 HIS 84 2HD HIS 84 -8.857 10.751 -0.801
669 HE1 HIS 84 1HE HIS 84 -7.906 14.171 1.522
670 HE2 HIS 84 2HE HIS 84 -7.343 12.833 -0.535
671 H SER 85 H SER 85 -13.114 10.910 1.819
672 HA SER 85 HA SER 85 -14.862 10.003 3.916
673 1HB SER 85 2HB SER 85 -16.671 10.658 2.428
674 2HB SER 85 1HB SER 85 -15.436 11.916 2.441
675 HG SER 85 HG SER 85 -15.732 11.651 0.338
676 H ASP 86 H ASP 86 -16.798 8.577 3.134
677 HA ASP 86 HA ASP 86 -17.557 6.508 2.576
678 1HB ASP 86 2HB ASP 86 -15.587 7.061 0.393
679 2HB ASP 86 1HB ASP 86 -16.268 5.444 0.530
680 H LEU 87 H LEU 87 -15.498 6.818 4.575
681 HA LEU 87 HA LEU 87 -13.417 5.049 4.523
682 1HB LEU 87 2HB LEU 87 -14.897 6.452 6.530
683 2HB LEU 87 1HB LEU 87 -14.473 4.854 7.115
684 HG LEU 87 HG LEU 87 -12.508 6.854 5.995
685 1HD1 LEU 87 1HD1 LEU 87 -12.478 6.043 8.840
686 2HD1 LEU 87 2HD1 LEU 87 -13.735 7.173 8.334
687 3HD1 LEU 87 3HD1 LEU 87 -12.035 7.576 8.090
688 1HD2 LEU 87 1HD2 LEU 87 -11.410 4.888 5.650
689 2HD2 LEU 87 2HD2 LEU 87 -12.300 4.042 6.916
690 3HD2 LEU 87 3HD2 LEU 87 -10.992 5.144 7.345
691 H ASP 88 H ASP 88 -16.758 4.245 4.588
692 HA ASP 88 HA ASP 88 -16.870 1.818 5.849
693 1HB ASP 88 2HB ASP 88 -18.700 3.152 4.548
694 2HB ASP 88 1HB ASP 88 -18.225 2.134 3.191
695 H ALA 89 H ALA 89 -15.682 2.442 2.563
696 HA ALA 89 HA ALA 89 -15.330 -0.262 1.854
697 1HB ALA 89 1HB ALA 89 -15.362 1.138 0.019
698 2HB ALA 89 2HB ALA 89 -13.642 0.785 0.176
699 3HB ALA 89 3HB ALA 89 -14.288 2.317 0.770
700 H ALA 90 H ALA 90 -13.442 1.868 3.796
701 HA ALA 90 HA ALA 90 -10.984 0.404 3.549
702 1HB ALA 90 1HB ALA 90 -10.234 1.811 5.458
703 2HB ALA 90 2HB ALA 90 -11.846 2.524 5.511
704 3HB ALA 90 3HB ALA 90 -10.833 2.734 4.082
705 H VAL 91 H VAL 91 -13.818 0.243 5.553
706 HA VAL 91 HA VAL 91 -12.667 -1.252 7.671
707 HB VAL 91 HB VAL 91 -15.554 -1.442 6.856
708 1HG1 VAL 91 1HG1 VAL 91 -15.278 -1.307 9.622
709 2HG1 VAL 91 2HG1 VAL 91 -13.934 -2.321 9.089
710 3HG1 VAL 91 3HG1 VAL 91 -15.593 -2.753 8.660
711 1HG2 VAL 91 1HG2 VAL 91 -15.958 0.499 8.337
712 2HG2 VAL 91 2HG2 VAL 91 -15.016 0.921 6.908
713 3HG2 VAL 91 3HG2 VAL 91 -14.213 0.731 8.467
714 H SER 92 H SER 92 -14.217 -2.099 4.636
715 HA SER 92 HA SER 92 -14.245 -4.902 5.079
716 1HB SER 92 2HB SER 92 -14.244 -3.410 2.442
717 2HB SER 92 1HB SER 92 -14.707 -5.095 2.685
718 HG SER 92 HG SER 92 -16.056 -3.307 4.286
719 H ALA 93 H ALA 93 -11.830 -2.634 4.232
720 HA ALA 93 HA ALA 93 -10.067 -4.324 2.825
721 1HB ALA 93 1HB ALA 93 -9.580 -2.112 2.498
722 2HB ALA 93 2HB ALA 93 -8.374 -2.536 3.700
723 3HB ALA 93 3HB ALA 93 -9.835 -1.694 4.185
724 H TYR 94 H TYR 94 -10.382 -3.468 6.217
725 HA TYR 94 HA TYR 94 -8.126 -4.900 7.132
726 1HB TYR 94 2HB TYR 94 -10.642 -4.549 8.756
727 2HB TYR 94 1HB TYR 94 -8.979 -4.627 9.323
728 HD1 TYR 94 1HD TYR 94 -7.472 -2.684 8.050
729 HD2 TYR 94 2HD TYR 94 -11.620 -2.482 9.000
730 HE1 TYR 94 1HE TYR 94 -7.354 -0.228 8.041
731 HE2 TYR 94 2HE TYR 94 -11.502 -0.025 8.993
732 HH TYR 94 HH TYR 94 -8.786 1.687 7.797
733 H GLN 95 H GLN 95 -11.281 -5.796 6.140
734 HA GLN 95 HA GLN 95 -11.302 -8.411 7.317
735 1HB GLN 95 2HB GLN 95 -13.444 -7.597 6.988
736 2HB GLN 95 1HB GLN 95 -13.050 -6.875 5.440
737 1HG GLN 95 2HG GLN 95 -12.759 -9.618 5.037
738 2HG GLN 95 1HG GLN 95 -14.194 -9.452 6.045
739 1HE2 GLN 95 1HE2 GLN 95 -12.877 -7.340 3.527
740 2HE2 GLN 95 2HE2 GLN 95 -14.279 -7.377 2.516
741 H GLN 96 H GLN 96 -10.583 -7.048 4.125
742 HA GLN 96 HA GLN 96 -10.128 -9.609 2.957
743 1HB GLN 96 2HB GLN 96 -9.418 -8.443 0.981
744 2HB GLN 96 1HB GLN 96 -10.860 -7.664 1.614
745 1HG GLN 96 2HG GLN 96 -9.618 -5.833 1.143
746 2HG GLN 96 1HG GLN 96 -9.079 -6.121 2.791
747 1HE2 GLN 96 1HE2 GLN 96 -8.214 -5.993 -0.504
748 2HE2 GLN 96 2HE2 GLN 96 -6.533 -6.336 -0.313
749 H GLY 97 H GLY 97 -8.258 -7.535 4.918
750 1HA GLY 97 2HA GLY 97 -6.251 -8.655 5.835
751 2HA GLY 97 1HA GLY 97 -5.845 -9.076 4.180
752 H ALA 98 H ALA 98 -7.124 -5.913 4.637
753 HA ALA 98 HA ALA 98 -4.796 -4.672 3.650
754 1HB ALA 98 1HB ALA 98 -6.825 -3.554 3.263
755 2HB ALA 98 2HB ALA 98 -5.949 -2.545 4.415
756 3HB ALA 98 3HB ALA 98 -7.258 -3.583 4.972
757 H PHE 99 H PHE 99 -3.609 -2.890 4.830
758 HA PHE 99 HA PHE 99 -2.733 -3.947 7.363
759 1HB PHE 99 2HB PHE 99 -1.191 -3.089 5.494
760 2HB PHE 99 1HB PHE 99 -1.606 -1.478 6.087
761 HD1 PHE 99 1HD PHE 99 -0.461 -4.780 7.358
762 HD2 PHE 99 2HD PHE 99 -0.295 -0.546 7.734
763 HE1 PHE 99 1HE PHE 99 1.202 -5.013 9.150
764 HE2 PHE 99 2HE PHE 99 1.382 -0.768 9.524
765 HZ PHE 99 HZ PHE 99 2.125 -3.009 10.235
766 H ASP 100 H ASP 100 -3.807 -0.739 6.203
767 HA ASP 100 HA ASP 100 -5.561 -0.116 8.210
768 1HB ASP 100 2HB ASP 100 -4.132 1.345 9.716
769 2HB ASP 100 1HB ASP 100 -3.893 -0.385 9.904
770 H TYR 101 H TYR 101 -5.012 2.552 8.796
771 HA TYR 101 HA TYR 101 -4.533 3.839 6.208
772 1HB TYR 101 2HB TYR 101 -7.078 3.772 7.715
773 2HB TYR 101 1HB TYR 101 -6.591 5.355 7.116
774 HD1 TYR 101 1HD TYR 101 -7.391 1.893 6.106
775 HD2 TYR 101 2HD TYR 101 -6.768 5.897 4.812
776 HE1 TYR 101 1HE TYR 101 -8.269 1.314 3.888
777 HE2 TYR 101 2HE TYR 101 -7.643 5.326 2.585
778 HH TYR 101 HH TYR 101 -8.431 3.700 1.267
779 H LEU 102 H LEU 102 -3.976 6.080 6.354
780 HA LEU 102 HA LEU 102 -2.880 6.780 8.984
781 1HB LEU 102 2HB LEU 102 -1.888 6.988 6.301
782 2HB LEU 102 1HB LEU 102 -1.943 8.583 7.028
783 HG LEU 102 HG LEU 102 -0.492 7.921 8.803
784 1HD1 LEU 102 1HD1 LEU 102 -1.434 5.292 8.169
785 2HD1 LEU 102 2HD1 LEU 102 -0.551 5.854 9.588
786 3HD1 LEU 102 3HD1 LEU 102 0.327 5.332 8.153
787 1HD2 LEU 102 1HD2 LEU 102 0.769 8.527 6.935
788 2HD2 LEU 102 2HD2 LEU 102 0.378 7.042 6.073
789 3HD2 LEU 102 3HD2 LEU 102 1.473 6.997 7.455
790 HA PRO 103 HA PRO 103 -6.129 9.837 9.191
791 1HB PRO 103 2HB PRO 103 -5.334 10.977 11.543
792 2HB PRO 103 1HB PRO 103 -6.266 9.483 11.440
793 1HG PRO 103 2HG PRO 103 -3.362 9.877 11.953
794 2HG PRO 103 1HG PRO 103 -4.464 8.653 12.602
795 1HD PRO 103 2HD PRO 103 -2.659 8.198 10.583
796 2HD PRO 103 1HD PRO 103 -4.139 7.253 10.831
797 H LYS 104 H LYS 104 -3.160 11.181 10.618
798 HA LYS 104 HA LYS 104 -3.321 13.359 8.652
799 1HB LYS 104 2HB LYS 104 -2.394 13.556 11.520
800 2HB LYS 104 1HB LYS 104 -2.428 14.875 10.360
801 1HG LYS 104 2HG LYS 104 -4.793 14.870 10.288
802 2HG LYS 104 1HG LYS 104 -4.882 13.343 11.168
803 1HD LYS 104 2HD LYS 104 -5.058 14.509 13.053
804 2HD LYS 104 1HD LYS 104 -3.404 15.072 12.804
805 1HE LYS 104 2HE LYS 104 -5.447 16.494 11.243
806 2HE LYS 104 1HE LYS 104 -5.583 16.689 12.990
807 1HZ LYS 104 1HZ LYS 104 -2.948 17.038 12.587
808 2HZ LYS 104 2HZ LYS 104 -4.076 18.295 12.685
809 3HZ LYS 104 3HZ LYS 104 -3.588 17.713 11.173
810 HA PRO 105 HA PRO 105 1.457 12.828 9.644
811 1HB PRO 105 2HB PRO 105 1.993 10.299 10.677
812 2HB PRO 105 1HB PRO 105 1.996 11.805 11.597
813 1HG PRO 105 2HG PRO 105 -0.155 9.749 11.332
814 2HG PRO 105 1HG PRO 105 0.354 10.663 12.764
815 1HD PRO 105 2HD PRO 105 -1.854 11.337 11.447
816 2HD PRO 105 1HD PRO 105 -0.773 12.588 12.089
817 H PHE 106 H PHE 106 2.996 11.674 8.346
818 HA PHE 106 HA PHE 106 2.366 9.321 6.928
819 1HB PHE 106 2HB PHE 106 0.764 10.740 5.755
820 2HB PHE 106 1HB PHE 106 2.028 11.908 5.387
821 HD1 PHE 106 1HD PHE 106 2.789 11.874 3.225
822 HD2 PHE 106 2HD PHE 106 1.496 8.229 4.998
823 HE1 PHE 106 1HE PHE 106 3.277 10.682 1.129
824 HE2 PHE 106 2HE PHE 106 1.992 7.030 2.912
825 HZ PHE 106 HZ PHE 106 2.882 8.256 0.972
826 H ASP 107 H ASP 107 3.891 11.790 5.003
827 HA ASP 107 HA ASP 107 6.013 11.840 4.153
828 1HB ASP 107 2HB ASP 107 7.610 12.645 5.695
829 2HB ASP 107 1HB ASP 107 6.057 13.151 6.350
830 H ILE 108 H ILE 108 8.393 10.830 4.526
831 HA ILE 108 HA ILE 108 8.055 8.063 4.041
832 HB ILE 108 HB ILE 108 10.184 9.948 3.776
833 1HG1 ILE 108 2HG1 ILE 108 10.899 8.447 2.032
834 2HG1 ILE 108 1HG1 ILE 108 9.951 7.134 2.716
835 1HG2 ILE 108 1HG2 ILE 108 12.051 8.308 4.169
836 2HG2 ILE 108 2HG2 ILE 108 10.900 7.346 5.093
837 3HG2 ILE 108 3HG2 ILE 108 11.310 8.978 5.622
838 1HD1 ILE 108 1HD1 ILE 108 9.046 8.372 0.661
839 2HD1 ILE 108 2HD1 ILE 108 8.633 9.654 1.801
840 3HD1 ILE 108 3HD1 ILE 108 7.946 8.040 2.000
841 H ASP 109 H ASP 109 9.322 9.861 6.755
842 HA ASP 109 HA ASP 109 10.295 7.840 8.331
843 1HB ASP 109 2HB ASP 109 10.006 10.470 8.713
844 2HB ASP 109 1HB ASP 109 8.676 9.908 9.723
845 H GLU 110 H GLU 110 6.931 9.090 8.552
846 HA GLU 110 HA GLU 110 6.158 6.919 10.213
847 1HB GLU 110 2HB GLU 110 4.410 8.920 8.782
848 2HB GLU 110 1HB GLU 110 3.878 7.812 10.033
849 1HG GLU 110 2HG GLU 110 6.073 9.785 10.535
850 2HG GLU 110 1HG GLU 110 4.374 10.233 10.683
851 H ALA 111 H ALA 111 6.058 7.505 6.784
852 HA ALA 111 HA ALA 111 4.195 5.455 6.160
853 1HB ALA 111 1HB ALA 111 6.018 7.183 4.633
854 2HB ALA 111 2HB ALA 111 4.342 6.742 4.318
855 3HB ALA 111 3HB ALA 111 5.644 5.633 3.889
856 H VAL 112 H VAL 112 7.732 5.556 5.663
857 HA VAL 112 HA VAL 112 8.042 2.840 5.112
858 HB VAL 112 HB VAL 112 10.073 4.621 6.451
859 1HG1 VAL 112 1HG1 VAL 112 10.134 1.890 5.839
860 2HG1 VAL 112 2HG1 VAL 112 11.493 2.917 6.302
861 3HG1 VAL 112 3HG1 VAL 112 11.110 2.682 4.597
862 1HG2 VAL 112 1HG2 VAL 112 9.018 4.541 3.706
863 2HG2 VAL 112 2HG2 VAL 112 10.776 4.559 3.834
864 3HG2 VAL 112 3HG2 VAL 112 9.826 5.845 4.575
865 H ALA 113 H ALA 113 7.806 4.552 8.110
866 HA ALA 113 HA ALA 113 8.758 2.560 9.862
867 1HB ALA 113 1HB ALA 113 6.638 4.634 10.393
868 2HB ALA 113 2HB ALA 113 8.374 4.939 10.472
869 3HB ALA 113 3HB ALA 113 7.629 3.805 11.597
870 H LEU 114 H LEU 114 5.579 3.377 8.631
871 HA LEU 114 HA LEU 114 4.242 1.275 10.004
872 1HB LEU 114 2HB LEU 114 3.141 3.378 9.534
873 2HB LEU 114 1HB LEU 114 3.357 3.130 7.814
874 HG LEU 114 HG LEU 114 1.905 0.981 8.235
875 1HD1 LEU 114 1HD1 LEU 114 0.129 1.656 9.975
876 2HD1 LEU 114 2HD1 LEU 114 1.392 2.689 10.647
877 3HD1 LEU 114 3HD1 LEU 114 1.637 0.945 10.555
878 1HD2 LEU 114 1HD2 LEU 114 -0.085 2.317 7.749
879 2HD2 LEU 114 2HD2 LEU 114 1.306 2.863 6.810
880 3HD2 LEU 114 3HD2 LEU 114 0.786 3.770 8.223
881 H VAL 115 H VAL 115 5.849 1.557 6.960
882 HA VAL 115 HA VAL 115 4.450 -0.665 5.780
883 HB VAL 115 HB VAL 115 5.508 1.212 4.429
884 1HG1 VAL 115 1HG1 VAL 115 8.011 -0.429 4.619
885 2HG1 VAL 115 2HG1 VAL 115 7.732 0.963 5.660
886 3HG1 VAL 115 3HG1 VAL 115 7.791 1.172 3.914
887 1HG2 VAL 115 1HG2 VAL 115 4.606 -0.854 3.460
888 2HG2 VAL 115 2HG2 VAL 115 6.174 -1.631 3.680
889 3HG2 VAL 115 3HG2 VAL 115 6.012 -0.271 2.569
890 H GLU 116 H GLU 116 7.578 -0.147 7.303
891 HA GLU 116 HA GLU 116 8.701 -2.655 6.810
892 1HB GLU 116 2HB GLU 116 9.105 -0.651 9.021
893 2HB GLU 116 1HB GLU 116 10.034 -2.141 8.934
894 1HG GLU 116 2HG GLU 116 11.134 -1.494 7.002
895 2HG GLU 116 1HG GLU 116 9.910 -0.295 6.590
896 H ARG 117 H ARG 117 6.780 -1.533 9.592
897 HA ARG 117 HA ARG 117 6.898 -3.899 11.064
898 1HB ARG 117 2HB ARG 117 4.901 -3.078 12.238
899 2HB ARG 117 1HB ARG 117 6.120 -1.825 12.048
900 1HG ARG 117 2HG ARG 117 4.806 -1.057 10.020
901 2HG ARG 117 1HG ARG 117 3.523 -2.125 10.583
902 1HD ARG 117 2HD ARG 117 4.608 -0.401 12.670
903 2HD ARG 117 1HD ARG 117 3.875 0.486 11.343
904 HE ARG 117 HE ARG 117 1.887 -1.051 11.772
905 1HH1 ARG 117 1HH1 ARG 117 4.081 0.021 14.275
906 2HH1 ARG 117 2HH1 ARG 117 2.886 -0.059 15.523
907 1HH2 ARG 117 1HH2 ARG 117 0.318 -1.139 13.420
908 2HH2 ARG 117 2HH2 ARG 117 0.757 -0.717 15.041
909 H ALA 118 H ALA 118 5.086 -3.126 8.246
910 HA ALA 118 HA ALA 118 3.052 -5.085 8.542
911 1HB ALA 118 1HB ALA 118 2.764 -3.161 7.072
912 2HB ALA 118 2HB ALA 118 2.586 -4.668 6.173
913 3HB ALA 118 3HB ALA 118 4.079 -3.737 6.048
914 H ILE 119 H ILE 119 6.208 -5.025 7.002
915 HA ILE 119 HA ILE 119 5.986 -7.634 5.866
916 HB ILE 119 HB ILE 119 8.485 -6.025 6.349
917 1HG1 ILE 119 2HG1 ILE 119 7.250 -6.001 3.672
918 2HG1 ILE 119 1HG1 ILE 119 6.369 -5.114 4.916
919 1HG2 ILE 119 1HG2 ILE 119 7.848 -8.269 4.452
920 2HG2 ILE 119 2HG2 ILE 119 9.038 -8.257 5.756
921 3HG2 ILE 119 3HG2 ILE 119 9.280 -7.245 4.328
922 1HD1 ILE 119 1HD1 ILE 119 7.975 -3.542 5.120
923 2HD1 ILE 119 2HD1 ILE 119 8.289 -4.021 3.449
924 3HD1 ILE 119 3HD1 ILE 119 9.276 -4.679 4.758
925 H SER 120 H SER 120 7.176 -6.246 8.804
926 HA SER 120 HA SER 120 8.707 -8.437 9.716
927 1HB SER 120 2HB SER 120 8.738 -6.013 10.565
928 2HB SER 120 1HB SER 120 7.313 -6.452 11.508
929 HG SER 120 HG SER 120 9.797 -7.820 11.617
930 H HIS 121 H HIS 121 5.340 -7.470 10.160
931 HA HIS 121 HA HIS 121 4.714 -9.593 11.962
932 1HB HIS 121 2HB HIS 121 3.174 -7.496 10.510
933 2HB HIS 121 1HB HIS 121 2.292 -8.890 11.123
934 HD1 HIS 121 1HD HIS 121 4.621 -6.180 12.411
935 HD2 HIS 121 2HD HIS 121 1.602 -8.706 13.744
936 HE1 HIS 121 1HE HIS 121 4.159 -5.481 14.782
937 HE2 HIS 121 2HE HIS 121 2.346 -7.040 15.577
938 H TYR 122 H TYR 122 4.894 -9.293 8.540
939 HA TYR 122 HA TYR 122 3.146 -11.419 7.858
940 1HB TYR 122 2HB TYR 122 4.072 -9.528 6.352
941 2HB TYR 122 1HB TYR 122 5.481 -10.566 6.167
942 HD1 TYR 122 1HD TYR 122 5.483 -11.637 4.128
943 HD2 TYR 122 2HD TYR 122 1.783 -11.156 6.174
944 HE1 TYR 122 1HE TYR 122 4.340 -12.874 2.338
945 HE2 TYR 122 2HE TYR 122 0.629 -12.394 4.390
946 HH TYR 122 HH TYR 122 2.033 -14.325 2.285
947 H GLN 123 H GLN 123 6.702 -11.233 7.771
948 HA GLN 123 HA GLN 123 8.288 -12.876 7.716
949 1HB GLN 123 2HB GLN 123 8.352 -14.219 9.738
950 2HB GLN 123 1HB GLN 123 7.850 -12.579 10.112
951 1HG GLN 123 2HG GLN 123 5.497 -13.374 10.157
952 2HG GLN 123 1HG GLN 123 6.096 -15.018 9.949
953 1HE2 GLN 123 1HE2 GLN 123 5.123 -15.547 11.956
954 2HE2 GLN 123 2HE2 GLN 123 5.878 -15.115 13.449
955 H GLU 124 H GLU 124 8.364 -15.534 8.339
956 HA GLU 124 HA GLU 124 8.058 -17.588 7.418
957 1HB GLU 124 2HB GLU 124 5.795 -17.240 8.468
958 2HB GLU 124 1HB GLU 124 5.221 -16.694 6.898
959 1HG GLU 124 2HG GLU 124 5.498 -18.814 5.937
960 2HG GLU 124 1HG GLU 124 6.504 -19.378 7.270
Start of MODEL 4
1 1H MET 1 1HT MET 1 14.942 -19.126 4.372
2 2H MET 1 2HT MET 1 14.625 -18.653 2.754
3 3H MET 1 3HT MET 1 13.325 -18.932 3.840
4 HA MET 1 HA MET 1 14.202 -17.116 5.220
5 1HB MET 1 2HB MET 1 16.251 -17.322 3.199
6 2HB MET 1 1HB MET 1 15.576 -15.699 3.205
7 1HG MET 1 2HG MET 1 15.960 -16.361 5.893
8 2HG MET 1 1HG MET 1 17.399 -16.931 5.049
9 1HE MET 1 1HE MET 1 19.098 -15.421 3.805
10 2HE MET 1 2HE MET 1 18.825 -13.718 3.434
11 3HE MET 1 3HE MET 1 17.816 -14.957 2.690
12 H GLN 2 H GLN 2 13.364 -14.936 4.849
13 HA GLN 2 HA GLN 2 11.083 -15.006 3.077
14 1HB GLN 2 2HB GLN 2 11.806 -13.618 5.478
15 2HB GLN 2 1HB GLN 2 11.341 -12.442 4.256
16 1HG GLN 2 2HG GLN 2 9.372 -14.301 4.002
17 2HG GLN 2 1HG GLN 2 9.715 -14.373 5.730
18 1HE2 GLN 2 1HE2 GLN 2 8.116 -13.295 6.663
19 2HE2 GLN 2 2HE2 GLN 2 7.612 -11.691 6.258
20 H ARG 3 H ARG 3 10.641 -13.542 1.418
21 HA ARG 3 HA ARG 3 12.994 -12.558 0.068
22 1HB ARG 3 2HB ARG 3 11.281 -13.884 -1.150
23 2HB ARG 3 1HB ARG 3 10.131 -12.582 -0.878
24 1HG ARG 3 2HG ARG 3 10.838 -11.545 -2.694
25 2HG ARG 3 1HG ARG 3 12.476 -11.474 -2.042
26 1HD ARG 3 2HD ARG 3 12.982 -12.740 -3.833
27 2HD ARG 3 1HD ARG 3 12.372 -14.054 -2.834
28 HE ARG 3 HE ARG 3 10.787 -12.655 -4.890
29 1HH1 ARG 3 1HH1 ARG 3 11.554 -15.546 -3.071
30 2HH1 ARG 3 2HH1 ARG 3 10.411 -16.525 -3.926
31 1HH2 ARG 3 1HH2 ARG 3 9.292 -13.949 -5.999
32 2HH2 ARG 3 2HH2 ARG 3 9.130 -15.624 -5.584
33 H GLY 4 H GLY 4 10.259 -11.356 1.794
34 1HA GLY 4 2HA GLY 4 9.586 -9.235 2.360
35 2HA GLY 4 1HA GLY 4 11.290 -8.825 2.252
36 H ILE 5 H ILE 5 8.282 -9.045 0.445
37 HA ILE 5 HA ILE 5 9.432 -7.301 -1.626
38 HB ILE 5 HB ILE 5 6.863 -8.867 -1.803
39 1HG1 ILE 5 2HG1 ILE 5 8.487 -10.213 -3.450
40 2HG1 ILE 5 1HG1 ILE 5 9.686 -9.669 -2.279
41 1HG2 ILE 5 1HG2 ILE 5 7.935 -6.830 -3.398
42 2HG2 ILE 5 2HG2 ILE 5 6.561 -7.873 -3.761
43 3HG2 ILE 5 3HG2 ILE 5 8.178 -8.329 -4.295
44 1HD1 ILE 5 1HD1 ILE 5 8.508 -11.956 -1.968
45 2HD1 ILE 5 2HD1 ILE 5 7.184 -10.981 -1.331
46 3HD1 ILE 5 3HD1 ILE 5 8.775 -10.910 -0.573
47 H VAL 6 H VAL 6 9.005 -5.202 -1.292
48 HA VAL 6 HA VAL 6 6.405 -4.487 -0.109
49 HB VAL 6 HB VAL 6 8.270 -3.600 1.162
50 1HG1 VAL 6 1HG1 VAL 6 9.506 -3.332 -1.315
51 2HG1 VAL 6 2HG1 VAL 6 10.146 -2.823 0.244
52 3HG1 VAL 6 3HG1 VAL 6 9.253 -1.682 -0.764
53 1HG2 VAL 6 1HG2 VAL 6 6.180 -2.260 0.850
54 2HG2 VAL 6 2HG2 VAL 6 7.013 -1.361 -0.418
55 3HG2 VAL 6 3HG2 VAL 6 7.607 -1.301 1.243
56 H TRP 7 H TRP 7 4.914 -3.643 -1.371
57 HA TRP 7 HA TRP 7 5.764 -2.416 -3.906
58 1HB TRP 7 2HB TRP 7 3.416 -4.149 -3.218
59 2HB TRP 7 1HB TRP 7 3.313 -3.025 -4.573
60 HD1 TRP 7 HD1 TRP 7 6.762 -4.340 -4.218
61 HE1 TRP 7 1HE TRP 7 7.225 -6.151 -5.977
62 HE3 TRP 7 3HE TRP 7 1.976 -5.135 -5.839
63 HZ2 TRP 7 2HZ TRP 7 5.762 -7.713 -7.808
64 HZ3 TRP 7 3HZ TRP 7 1.599 -6.810 -7.602
65 HH2 TRP 7 HH2 TRP 7 3.456 -8.071 -8.563
66 H VAL 8 H VAL 8 5.059 -0.421 -4.409
67 HA VAL 8 HA VAL 8 3.203 0.898 -2.533
68 HB VAL 8 HB VAL 8 5.122 2.736 -3.701
69 1HG1 VAL 8 1HG1 VAL 8 5.343 3.480 -1.396
70 2HG1 VAL 8 2HG1 VAL 8 4.453 2.061 -0.843
71 3HG1 VAL 8 3HG1 VAL 8 3.650 3.276 -1.843
72 1HG2 VAL 8 1HG2 VAL 8 6.189 0.337 -2.278
73 2HG2 VAL 8 2HG2 VAL 8 6.956 1.906 -2.042
74 3HG2 VAL 8 3HG2 VAL 8 6.844 1.217 -3.666
75 H VAL 9 H VAL 9 1.762 2.336 -3.413
76 HA VAL 9 HA VAL 9 1.894 2.672 -6.335
77 HB VAL 9 HB VAL 9 -0.767 2.951 -5.105
78 1HG1 VAL 9 1HG1 VAL 9 -0.300 1.091 -7.341
79 2HG1 VAL 9 2HG1 VAL 9 0.186 2.764 -7.624
80 3HG1 VAL 9 3HG1 VAL 9 -1.459 2.389 -7.153
81 1HG2 VAL 9 1HG2 VAL 9 -0.949 0.334 -5.322
82 2HG2 VAL 9 2HG2 VAL 9 -0.443 1.090 -3.811
83 3HG2 VAL 9 3HG2 VAL 9 0.764 0.406 -4.903
84 H ASP 10 H ASP 10 2.643 4.680 -6.608
85 HA ASP 10 HA ASP 10 1.058 6.916 -5.956
86 1HB ASP 10 2HB ASP 10 2.337 6.217 -3.742
87 2HB ASP 10 1HB ASP 10 3.650 7.102 -4.506
88 H ASP 11 H ASP 11 1.272 8.057 -7.667
89 HA ASP 11 HA ASP 11 2.072 9.005 -9.554
90 1HB ASP 11 2HB ASP 11 3.346 10.103 -7.404
91 2HB ASP 11 1HB ASP 11 4.706 9.648 -8.420
92 H ASP 12 H ASP 12 5.316 8.075 -8.534
93 HA ASP 12 HA ASP 12 5.726 5.702 -9.804
94 1HB ASP 12 2HB ASP 12 4.851 7.106 -11.813
95 2HB ASP 12 1HB ASP 12 6.447 7.833 -11.806
96 H SER 13 H SER 13 8.071 7.343 -11.398
97 HA SER 13 HA SER 13 10.206 6.617 -9.953
98 1HB SER 13 2HB SER 13 9.878 9.151 -11.546
99 2HB SER 13 1HB SER 13 11.435 8.521 -11.005
100 HG SER 13 HG SER 13 10.549 6.498 -12.153
101 H SER 14 H SER 14 8.414 9.599 -9.484
102 HA SER 14 HA SER 14 10.028 10.848 -7.611
103 1HB SER 14 2HB SER 14 7.093 10.904 -8.172
104 2HB SER 14 1HB SER 14 7.676 11.673 -6.698
105 HG SER 14 HG SER 14 7.597 13.083 -8.546
106 H ILE 15 H ILE 15 7.158 8.878 -6.845
107 HA ILE 15 HA ILE 15 7.898 8.631 -4.111
108 HB ILE 15 HB ILE 15 5.827 7.066 -5.661
109 1HG1 ILE 15 2HG1 ILE 15 5.586 9.573 -5.665
110 2HG1 ILE 15 1HG1 ILE 15 4.241 8.714 -4.930
111 1HG2 ILE 15 1HG2 ILE 15 4.944 7.167 -3.100
112 2HG2 ILE 15 2HG2 ILE 15 6.686 7.074 -2.844
113 3HG2 ILE 15 3HG2 ILE 15 5.866 5.823 -3.776
114 1HD1 ILE 15 1HD1 ILE 15 6.286 9.449 -3.004
115 2HD1 ILE 15 2HD1 ILE 15 4.544 9.727 -2.974
116 3HD1 ILE 15 3HD1 ILE 15 5.600 10.835 -3.851
117 H ARG 16 H ARG 16 8.709 6.967 -6.976
118 HA ARG 16 HA ARG 16 9.374 4.441 -5.837
119 1HB ARG 16 2HB ARG 16 8.895 4.845 -8.272
120 2HB ARG 16 1HB ARG 16 10.437 5.679 -8.377
121 1HG ARG 16 2HG ARG 16 10.452 2.920 -7.305
122 2HG ARG 16 1HG ARG 16 10.151 3.129 -9.025
123 1HD ARG 16 2HD ARG 16 12.414 4.637 -7.845
124 2HD ARG 16 1HD ARG 16 12.604 2.891 -8.005
125 HE ARG 16 HE ARG 16 11.645 3.960 -10.429
126 1HH1 ARG 16 1HH1 ARG 16 14.544 3.866 -8.483
127 2HH1 ARG 16 2HH1 ARG 16 15.608 4.062 -9.835
128 1HH2 ARG 16 1HH2 ARG 16 13.047 4.217 -12.208
129 2HH2 ARG 16 2HH2 ARG 16 14.759 4.261 -11.949
130 H TRP 17 H TRP 17 11.003 7.476 -6.284
131 HA TRP 17 HA TRP 17 13.622 6.502 -5.801
132 1HB TRP 17 2HB TRP 17 13.153 8.614 -7.002
133 2HB TRP 17 1HB TRP 17 12.557 9.314 -5.499
134 HD1 TRP 17 HD1 TRP 17 15.858 7.762 -6.833
135 HE1 TRP 17 1HE TRP 17 17.817 9.015 -5.731
136 HE3 TRP 17 3HE TRP 17 13.211 10.880 -3.769
137 HZ2 TRP 17 2HZ TRP 17 18.191 11.055 -3.816
138 HZ3 TRP 17 3HZ TRP 17 14.442 12.450 -2.332
139 HH2 TRP 17 HH2 TRP 17 16.881 12.537 -2.357
140 H VAL 18 H VAL 18 11.452 8.473 -3.784
141 HA VAL 18 HA VAL 18 13.041 8.437 -1.499
142 HB VAL 18 HB VAL 18 10.110 8.591 -1.090
143 1HG1 VAL 18 1HG1 VAL 18 12.560 9.588 0.114
144 2HG1 VAL 18 2HG1 VAL 18 10.957 9.380 0.814
145 3HG1 VAL 18 3HG1 VAL 18 11.338 10.845 -0.087
146 1HG2 VAL 18 1HG2 VAL 18 10.578 11.121 -1.900
147 2HG2 VAL 18 2HG2 VAL 18 9.870 9.882 -2.934
148 3HG2 VAL 18 3HG2 VAL 18 11.592 10.238 -3.040
149 H LEU 19 H LEU 19 10.046 6.588 -1.878
150 HA LEU 19 HA LEU 19 10.443 5.111 0.481
151 1HB LEU 19 2HB LEU 19 8.333 5.549 -1.173
152 2HB LEU 19 1HB LEU 19 8.698 3.871 -1.515
153 HG LEU 19 HG LEU 19 6.968 4.134 0.215
154 1HD1 LEU 19 1HD1 LEU 19 8.614 2.917 2.051
155 2HD1 LEU 19 2HD1 LEU 19 9.439 2.633 0.520
156 3HD1 LEU 19 3HD1 LEU 19 7.765 2.121 0.726
157 1HD2 LEU 19 1HD2 LEU 19 9.145 5.303 1.935
158 2HD2 LEU 19 2HD2 LEU 19 7.453 5.047 2.367
159 3HD2 LEU 19 3HD2 LEU 19 7.883 6.249 1.152
160 H GLU 20 H GLU 20 10.827 4.081 -2.873
161 HA GLU 20 HA GLU 20 11.527 1.426 -2.276
162 1HB GLU 20 2HB GLU 20 12.459 2.821 -4.726
163 2HB GLU 20 1HB GLU 20 11.894 1.171 -4.556
164 1HG GLU 20 2HG GLU 20 10.268 3.659 -4.423
165 2HG GLU 20 1HG GLU 20 10.310 2.512 -5.756
166 H ARG 21 H ARG 21 13.576 4.003 -3.576
167 HA ARG 21 HA ARG 21 15.986 2.676 -3.488
168 1HB ARG 21 2HB ARG 21 15.485 5.590 -2.919
169 2HB ARG 21 1HB ARG 21 17.079 4.912 -3.195
170 1HG ARG 21 2HG ARG 21 15.178 4.222 -5.291
171 2HG ARG 21 1HG ARG 21 15.418 5.960 -5.114
172 1HD ARG 21 2HD ARG 21 17.898 5.511 -5.182
173 2HD ARG 21 1HD ARG 21 17.506 3.851 -5.630
174 HE ARG 21 HE ARG 21 16.334 5.909 -7.301
175 1HH1 ARG 21 1HH1 ARG 21 19.000 3.699 -6.835
176 2HH1 ARG 21 2HH1 ARG 21 19.453 3.700 -8.506
177 1HH2 ARG 21 1HH2 ARG 21 16.936 5.910 -9.497
178 2HH2 ARG 21 2HH2 ARG 21 18.285 4.956 -10.016
179 H ALA 22 H ALA 22 14.503 4.463 -0.807
180 HA ALA 22 HA ALA 22 16.653 3.921 0.980
181 1HB ALA 22 1HB ALA 22 15.320 4.935 2.680
182 2HB ALA 22 2HB ALA 22 13.848 4.708 1.733
183 3HB ALA 22 3HB ALA 22 15.075 5.858 1.197
184 H LEU 23 H LEU 23 13.747 2.296 0.071
185 HA LEU 23 HA LEU 23 13.806 0.469 2.297
186 1HB LEU 23 2HB LEU 23 11.737 1.241 1.006
187 2HB LEU 23 1HB LEU 23 12.237 0.119 -0.243
188 HG LEU 23 HG LEU 23 11.780 -1.745 1.072
189 1HD1 LEU 23 1HD1 LEU 23 12.061 0.122 3.393
190 2HD1 LEU 23 2HD1 LEU 23 12.880 -1.409 3.088
191 3HD1 LEU 23 3HD1 LEU 23 11.183 -1.399 3.566
192 1HD2 LEU 23 1HD2 LEU 23 9.717 0.194 2.070
193 2HD2 LEU 23 2HD2 LEU 23 9.525 -1.521 1.706
194 3HD2 LEU 23 3HD2 LEU 23 9.779 -0.363 0.398
195 H ALA 24 H ALA 24 15.167 0.678 -0.848
196 HA ALA 24 HA ALA 24 15.656 -2.089 -1.256
197 1HB ALA 24 1HB ALA 24 15.915 0.173 -2.803
198 2HB ALA 24 2HB ALA 24 16.501 -1.434 -3.234
199 3HB ALA 24 3HB ALA 24 17.593 -0.271 -2.481
200 H GLY 25 H GLY 25 17.310 0.569 0.346
201 1HA GLY 25 2HA GLY 25 19.795 -0.698 0.782
202 2HA GLY 25 1HA GLY 25 19.107 0.575 1.784
203 H ALA 26 H ALA 26 16.676 -1.064 2.268
204 HA ALA 26 HA ALA 26 17.615 -2.430 4.598
205 1HB ALA 26 1HB ALA 26 14.960 -1.767 3.441
206 2HB ALA 26 2HB ALA 26 15.604 -1.442 5.051
207 3HB ALA 26 3HB ALA 26 15.056 -3.065 4.633
208 H GLY 27 H GLY 27 17.075 -3.306 1.347
209 1HA GLY 27 2HA GLY 27 17.780 -5.380 0.476
210 2HA GLY 27 1HA GLY 27 17.545 -6.097 2.057
211 H LEU 28 H LEU 28 14.963 -4.170 0.573
212 HA LEU 28 HA LEU 28 13.569 -6.710 0.123
213 1HB LEU 28 2HB LEU 28 11.984 -4.261 0.619
214 2HB LEU 28 1HB LEU 28 11.623 -5.927 1.018
215 HG LEU 28 HG LEU 28 13.669 -5.528 2.693
216 1HD1 LEU 28 1HD1 LEU 28 14.305 -3.408 2.516
217 2HD1 LEU 28 2HD1 LEU 28 12.956 -3.152 3.624
218 3HD1 LEU 28 3HD1 LEU 28 12.745 -2.887 1.892
219 1HD2 LEU 28 1HD2 LEU 28 11.080 -6.058 2.971
220 2HD2 LEU 28 2HD2 LEU 28 11.093 -4.418 3.622
221 3HD2 LEU 28 3HD2 LEU 28 12.119 -5.659 4.343
222 H THR 29 H THR 29 11.695 -6.555 -1.434
223 HA THR 29 HA THR 29 12.663 -5.305 -3.872
224 HB THR 29 HB THR 29 10.213 -7.019 -3.387
225 HG1 THR 29 1HG THR 29 12.686 -7.759 -4.548
226 1HG2 THR 29 1HG2 THR 29 9.741 -6.007 -5.407
227 2HG2 THR 29 2HG2 THR 29 10.558 -7.492 -5.887
228 3HG2 THR 29 3HG2 THR 29 11.435 -5.961 -5.898
229 H CYS 30 H CYS 30 12.285 -3.196 -3.983
230 HA CYS 30 HA CYS 30 9.658 -2.139 -3.179
231 1HB CYS 30 2HB CYS 30 10.923 0.081 -3.351
232 2HB CYS 30 1HB CYS 30 11.323 -0.986 -2.012
233 HG CYS 30 HG CYS 30 13.637 -0.717 -2.762
234 H THR 31 H THR 31 8.275 -2.044 -4.829
235 HA THR 31 HA THR 31 9.230 -0.835 -7.337
236 HB THR 31 HB THR 31 8.655 -3.367 -7.440
237 HG1 THR 31 1HG THR 31 8.849 -2.023 -9.282
238 1HG2 THR 31 1HG2 THR 31 6.600 -4.103 -7.110
239 2HG2 THR 31 2HG2 THR 31 5.904 -2.814 -8.087
240 3HG2 THR 31 3HG2 THR 31 6.232 -2.544 -6.373
241 H THR 32 H THR 32 7.651 0.522 -8.421
242 HA THR 32 HA THR 32 5.485 1.347 -6.617
243 HB THR 32 HB THR 32 5.843 3.651 -7.289
244 HG1 THR 32 1HG THR 32 6.930 4.033 -9.027
245 1HG2 THR 32 1HG2 THR 32 7.503 4.019 -5.839
246 2HG2 THR 32 2HG2 THR 32 8.601 2.903 -6.650
247 3HG2 THR 32 3HG2 THR 32 7.369 2.279 -5.544
248 H PHE 33 H PHE 33 3.747 2.584 -7.640
249 HA PHE 33 HA PHE 33 3.227 1.764 -10.403
250 1HB PHE 33 2HB PHE 33 1.378 1.382 -8.063
251 2HB PHE 33 1HB PHE 33 0.970 1.048 -9.735
252 HD1 PHE 33 1HD PHE 33 3.383 0.155 -7.074
253 HD2 PHE 33 2HD PHE 33 1.405 -1.077 -10.620
254 HE1 PHE 33 1HE PHE 33 4.336 -2.092 -6.813
255 HE2 PHE 33 2HE PHE 33 2.356 -3.324 -10.377
256 HZ PHE 33 HZ PHE 33 3.820 -3.844 -8.477
257 H GLU 34 H GLU 34 1.083 2.806 -11.187
258 HA GLU 34 HA GLU 34 1.463 5.580 -11.208
259 1HB GLU 34 2HB GLU 34 -0.483 5.699 -12.604
260 2HB GLU 34 1HB GLU 34 0.420 4.252 -13.033
261 1HG GLU 34 2HG GLU 34 -1.264 3.201 -11.241
262 2HG GLU 34 1HG GLU 34 -2.256 4.533 -11.823
263 H ASN 35 H ASN 35 -1.192 3.733 -9.618
264 HA ASN 35 HA ASN 35 -1.332 5.610 -7.503
265 1HB ASN 35 2HB ASN 35 -3.074 6.033 -9.830
266 2HB ASN 35 1HB ASN 35 -3.895 6.066 -8.273
267 1HD2 ASN 35 1HD2 ASN 35 -3.501 8.234 -10.108
268 2HD2 ASN 35 2HD2 ASN 35 -2.598 9.445 -9.270
269 H GLY 36 H GLY 36 -2.658 2.872 -9.172
270 1HA GLY 36 2HA GLY 36 -3.102 1.408 -6.850
271 2HA GLY 36 1HA GLY 36 -4.624 2.182 -7.249
272 H ASN 37 H ASN 37 -5.101 1.950 -9.755
273 HA ASN 37 HA ASN 37 -5.758 -0.679 -10.203
274 1HB ASN 37 2HB ASN 37 -6.178 1.717 -11.524
275 2HB ASN 37 1HB ASN 37 -5.332 0.724 -12.706
276 1HD2 ASN 37 1HD2 ASN 37 -7.866 0.265 -10.248
277 2HD2 ASN 37 2HD2 ASN 37 -8.938 -0.627 -11.271
278 H GLU 38 H GLU 38 -2.763 0.933 -10.864
279 HA GLU 38 HA GLU 38 -1.665 -0.826 -12.737
280 1HB GLU 38 2HB GLU 38 -0.768 1.426 -11.850
281 2HB GLU 38 1HB GLU 38 -0.042 0.468 -10.577
282 1HG GLU 38 2HG GLU 38 1.703 0.213 -11.915
283 2HG GLU 38 1HG GLU 38 0.692 -0.855 -12.887
284 H VAL 39 H VAL 39 -1.158 -0.834 -9.153
285 HA VAL 39 HA VAL 39 0.289 -3.190 -8.996
286 HB VAL 39 HB VAL 39 -1.851 -2.551 -6.980
287 1HG1 VAL 39 1HG1 VAL 39 -0.049 -4.586 -7.106
288 2HG1 VAL 39 2HG1 VAL 39 -0.785 -3.974 -5.625
289 3HG1 VAL 39 3HG1 VAL 39 0.810 -3.407 -6.118
290 1HG2 VAL 39 1HG2 VAL 39 0.778 -1.194 -7.424
291 2HG2 VAL 39 2HG2 VAL 39 0.000 -1.233 -5.847
292 3HG2 VAL 39 3HG2 VAL 39 -0.815 -0.474 -7.215
293 H LEU 40 H LEU 40 -3.197 -2.782 -9.256
294 HA LEU 40 HA LEU 40 -4.051 -5.349 -8.676
295 1HB LEU 40 2HB LEU 40 -5.246 -3.705 -10.891
296 2HB LEU 40 1HB LEU 40 -6.053 -4.846 -9.833
297 HG LEU 40 HG LEU 40 -5.002 -2.121 -9.072
298 1HD1 LEU 40 1HD1 LEU 40 -7.555 -3.128 -9.996
299 2HD1 LEU 40 2HD1 LEU 40 -7.003 -1.471 -9.785
300 3HD1 LEU 40 3HD1 LEU 40 -7.674 -2.345 -8.426
301 1HD2 LEU 40 1HD2 LEU 40 -6.661 -3.371 -7.090
302 2HD2 LEU 40 2HD2 LEU 40 -5.032 -2.709 -6.931
303 3HD2 LEU 40 3HD2 LEU 40 -5.257 -4.384 -7.434
304 H ALA 41 H ALA 41 -2.908 -4.055 -11.769
305 HA ALA 41 HA ALA 41 -3.367 -6.425 -13.246
306 1HB ALA 41 1HB ALA 41 -2.185 -5.385 -15.020
307 2HB ALA 41 2HB ALA 41 -1.370 -4.285 -13.908
308 3HB ALA 41 3HB ALA 41 -3.103 -4.123 -14.201
309 H ALA 42 H ALA 42 -0.455 -5.052 -11.825
310 HA ALA 42 HA ALA 42 1.257 -7.163 -12.597
311 1HB ALA 42 1HB ALA 42 2.855 -5.811 -11.845
312 2HB ALA 42 2HB ALA 42 2.174 -5.792 -10.216
313 3HB ALA 42 3HB ALA 42 1.582 -4.662 -11.435
314 H LEU 43 H LEU 43 -0.708 -6.592 -9.738
315 HA LEU 43 HA LEU 43 0.385 -8.561 -8.075
316 1HB LEU 43 2HB LEU 43 -2.261 -7.193 -8.235
317 2HB LEU 43 1HB LEU 43 -2.106 -8.606 -7.207
318 HG LEU 43 HG LEU 43 -0.290 -6.228 -6.956
319 1HD1 LEU 43 1HD1 LEU 43 -2.805 -6.817 -5.405
320 2HD1 LEU 43 2HD1 LEU 43 -2.622 -5.526 -6.591
321 3HD1 LEU 43 3HD1 LEU 43 -1.683 -5.500 -5.099
322 1HD2 LEU 43 1HD2 LEU 43 0.754 -7.899 -5.825
323 2HD2 LEU 43 2HD2 LEU 43 -0.748 -8.770 -5.509
324 3HD2 LEU 43 3HD2 LEU 43 -0.338 -7.339 -4.559
325 H ALA 44 H ALA 44 -1.708 -8.777 -10.801
326 HA ALA 44 HA ALA 44 -2.948 -11.228 -10.377
327 1HB ALA 44 1HB ALA 44 -2.023 -10.535 -13.118
328 2HB ALA 44 2HB ALA 44 -3.146 -9.445 -12.307
329 3HB ALA 44 3HB ALA 44 -3.591 -11.130 -12.571
330 H SER 45 H SER 45 0.351 -10.532 -11.009
331 HA SER 45 HA SER 45 0.879 -13.376 -11.408
332 1HB SER 45 2HB SER 45 1.922 -11.004 -12.831
333 2HB SER 45 1HB SER 45 3.090 -12.276 -12.479
334 HG SER 45 HG SER 45 1.871 -13.709 -13.641
335 H LYS 46 H LYS 46 1.072 -11.098 -9.111
336 HA LYS 46 HA LYS 46 3.090 -12.507 -7.675
337 1HB LYS 46 2HB LYS 46 4.019 -10.463 -9.307
338 2HB LYS 46 1HB LYS 46 3.923 -9.725 -7.717
339 1HG LYS 46 2HG LYS 46 5.114 -12.254 -7.370
340 2HG LYS 46 1HG LYS 46 5.896 -11.492 -8.756
341 1HD LYS 46 2HD LYS 46 5.721 -9.430 -6.953
342 2HD LYS 46 1HD LYS 46 6.038 -10.820 -5.916
343 1HE LYS 46 2HE LYS 46 8.189 -10.368 -6.406
344 2HE LYS 46 1HE LYS 46 7.831 -11.270 -7.877
345 1HZ LYS 46 1HZ LYS 46 7.751 -8.316 -7.565
346 2HZ LYS 46 2HZ LYS 46 7.321 -9.151 -8.973
347 3HZ LYS 46 3HZ LYS 46 8.916 -9.203 -8.412
348 H THR 47 H THR 47 3.347 -11.716 -5.460
349 HA THR 47 HA THR 47 1.281 -9.858 -4.601
350 HB THR 47 HB THR 47 1.722 -12.582 -3.381
351 HG1 THR 47 1HG THR 47 -0.406 -11.506 -4.907
352 1HG2 THR 47 1HG2 THR 47 -0.452 -10.649 -2.669
353 2HG2 THR 47 2HG2 THR 47 1.070 -10.737 -1.779
354 3HG2 THR 47 3HG2 THR 47 0.004 -12.141 -1.851
355 HA PRO 48 HA PRO 48 4.956 -8.556 -2.310
356 1HB PRO 48 2HB PRO 48 3.981 -6.164 -1.539
357 2HB PRO 48 1HB PRO 48 4.543 -6.451 -3.190
358 1HG PRO 48 2HG PRO 48 1.744 -6.467 -2.117
359 2HG PRO 48 1HG PRO 48 2.365 -5.715 -3.599
360 1HD PRO 48 2HD PRO 48 1.091 -8.104 -3.595
361 2HD PRO 48 1HD PRO 48 2.368 -7.704 -4.756
362 H ASP 49 H ASP 49 5.416 -8.239 -0.071
363 HA ASP 49 HA ASP 49 3.536 -9.537 1.674
364 1HB ASP 49 2HB ASP 49 6.302 -8.409 2.066
365 2HB ASP 49 1HB ASP 49 5.350 -9.013 3.419
366 H VAL 50 H VAL 50 4.354 -6.260 0.897
367 HA VAL 50 HA VAL 50 2.327 -5.325 2.775
368 HB VAL 50 HB VAL 50 4.374 -5.225 4.085
369 1HG1 VAL 50 1HG1 VAL 50 5.601 -4.702 1.680
370 2HG1 VAL 50 2HG1 VAL 50 6.362 -4.630 3.268
371 3HG1 VAL 50 3HG1 VAL 50 5.718 -3.162 2.537
372 1HG2 VAL 50 1HG2 VAL 50 3.004 -3.493 4.746
373 2HG2 VAL 50 2HG2 VAL 50 3.122 -2.662 3.196
374 3HG2 VAL 50 3HG2 VAL 50 4.480 -2.627 4.320
375 H LEU 51 H LEU 51 1.046 -4.574 1.076
376 HA LEU 51 HA LEU 51 2.236 -2.852 -0.933
377 1HB LEU 51 2HB LEU 51 0.473 -4.536 -1.504
378 2HB LEU 51 1HB LEU 51 -0.673 -3.564 -0.597
379 HG LEU 51 HG LEU 51 -0.184 -1.658 -2.156
380 1HD1 LEU 51 1HD1 LEU 51 2.031 -2.774 -2.864
381 2HD1 LEU 51 2HD1 LEU 51 1.084 -1.914 -4.075
382 3HD1 LEU 51 3HD1 LEU 51 1.030 -3.675 -4.000
383 1HD2 LEU 51 1HD2 LEU 51 -1.155 -4.044 -3.690
384 2HD2 LEU 51 2HD2 LEU 51 -1.708 -2.372 -3.772
385 3HD2 LEU 51 3HD2 LEU 51 -2.092 -3.359 -2.362
386 H LEU 52 H LEU 52 1.768 -0.713 -1.272
387 HA LEU 52 HA LEU 52 0.312 0.715 0.854
388 1HB LEU 52 2HB LEU 52 3.050 0.707 0.582
389 2HB LEU 52 1HB LEU 52 2.602 2.120 -0.347
390 HG LEU 52 HG LEU 52 1.795 1.692 2.525
391 1HD1 LEU 52 1HD1 LEU 52 4.226 1.793 2.334
392 2HD1 LEU 52 2HD1 LEU 52 3.580 3.241 3.105
393 3HD1 LEU 52 3HD1 LEU 52 4.094 3.295 1.418
394 1HD2 LEU 52 1HD2 LEU 52 0.880 3.490 0.593
395 2HD2 LEU 52 2HD2 LEU 52 1.992 4.413 1.607
396 3HD2 LEU 52 3HD2 LEU 52 0.623 3.573 2.335
397 H SER 53 H SER 53 -1.403 1.681 -0.157
398 HA SER 53 HA SER 53 -0.939 2.707 -2.878
399 1HB SER 53 2HB SER 53 -2.552 0.920 -2.946
400 2HB SER 53 1HB SER 53 -3.493 1.659 -1.653
401 HG SER 53 HG SER 53 -2.989 3.010 -4.080
402 H ASP 54 H ASP 54 -1.662 4.707 -3.469
403 HA ASP 54 HA ASP 54 -1.953 6.592 -1.303
404 1HB ASP 54 2HB ASP 54 -0.587 6.901 -3.485
405 2HB ASP 54 1HB ASP 54 -2.139 7.309 -4.213
406 H ILE 55 H ILE 55 -3.568 8.389 -1.564
407 HA ILE 55 HA ILE 55 -6.108 7.536 -2.707
408 HB ILE 55 HB ILE 55 -6.387 6.718 -0.518
409 1HG1 ILE 55 2HG1 ILE 55 -7.594 9.436 -0.158
410 2HG1 ILE 55 1HG1 ILE 55 -8.149 8.391 -1.458
411 1HG2 ILE 55 1HG2 ILE 55 -4.527 7.667 0.608
412 2HG2 ILE 55 2HG2 ILE 55 -5.984 8.108 1.501
413 3HG2 ILE 55 3HG2 ILE 55 -5.194 9.295 0.457
414 1HD1 ILE 55 1HD1 ILE 55 -8.191 7.766 1.481
415 2HD1 ILE 55 2HD1 ILE 55 -8.670 6.650 0.204
416 3HD1 ILE 55 3HD1 ILE 55 -9.578 8.142 0.458
417 H ARG 56 H ARG 56 -5.807 9.204 -4.227
418 HA ARG 56 HA ARG 56 -6.083 11.919 -3.122
419 1HB ARG 56 2HB ARG 56 -5.090 12.695 -5.325
420 2HB ARG 56 1HB ARG 56 -3.984 11.885 -4.227
421 1HG ARG 56 2HG ARG 56 -4.412 9.777 -5.554
422 2HG ARG 56 1HG ARG 56 -5.225 10.803 -6.738
423 1HD ARG 56 2HD ARG 56 -2.348 10.975 -5.850
424 2HD ARG 56 1HD ARG 56 -2.942 10.459 -7.425
425 HE ARG 56 HE ARG 56 -3.478 12.696 -7.934
426 1HH1 ARG 56 1HH1 ARG 56 -1.935 12.384 -4.810
427 2HH1 ARG 56 2HH1 ARG 56 -1.509 14.060 -4.722
428 1HH2 ARG 56 1HH2 ARG 56 -2.915 14.895 -7.809
429 2HH2 ARG 56 2HH2 ARG 56 -2.065 15.483 -6.418
430 H MET 57 H MET 57 -8.235 10.146 -3.565
431 HA MET 57 HA MET 57 -10.328 10.147 -4.409
432 1HB MET 57 2HB MET 57 -10.037 12.634 -3.985
433 2HB MET 57 1HB MET 57 -9.706 12.793 -5.705
434 1HG MET 57 2HG MET 57 -12.016 11.399 -5.777
435 2HG MET 57 1HG MET 57 -12.243 12.328 -4.297
436 1HE MET 57 1HE MET 57 -14.528 13.917 -6.464
437 2HE MET 57 2HE MET 57 -13.907 15.036 -5.250
438 3HE MET 57 3HE MET 57 -14.081 13.325 -4.863
439 HA PRO 58 HA PRO 58 -8.463 9.173 -8.706
440 1HB PRO 58 2HB PRO 58 -8.398 6.443 -8.385
441 2HB PRO 58 1HB PRO 58 -7.008 7.500 -8.127
442 1HG PRO 58 2HG PRO 58 -8.856 6.273 -6.123
443 2HG PRO 58 1HG PRO 58 -7.107 6.543 -6.029
444 1HD PRO 58 2HD PRO 58 -8.913 8.126 -4.781
445 2HD PRO 58 1HD PRO 58 -7.351 8.725 -5.358
446 H GLY 59 H GLY 59 -10.293 6.517 -7.246
447 1HA GLY 59 2HA GLY 59 -12.524 7.107 -9.089
448 2HA GLY 59 1HA GLY 59 -12.098 5.489 -8.531
449 H MET 60 H MET 60 -12.485 4.928 -6.348
450 HA MET 60 HA MET 60 -14.746 6.339 -5.174
451 1HB MET 60 2HB MET 60 -14.660 3.802 -5.359
452 2HB MET 60 1HB MET 60 -13.409 3.840 -4.123
453 1HG MET 60 2HG MET 60 -15.028 3.707 -2.626
454 2HG MET 60 1HG MET 60 -15.438 5.368 -3.048
455 1HE MET 60 1HE MET 60 -17.239 6.125 -4.490
456 2HE MET 60 2HE MET 60 -18.103 5.643 -3.030
457 3HE MET 60 3HE MET 60 -18.759 5.239 -4.617
458 H ASP 61 H ASP 61 -12.905 8.051 -5.029
459 HA ASP 61 HA ASP 61 -11.712 9.455 -3.758
460 1HB ASP 61 2HB ASP 61 -13.438 8.087 -1.891
461 2HB ASP 61 1HB ASP 61 -11.940 8.623 -1.130
462 H GLY 62 H GLY 62 -11.245 6.088 -2.748
463 1HA GLY 62 2HA GLY 62 -8.547 5.969 -3.306
464 2HA GLY 62 1HA GLY 62 -8.668 6.500 -1.639
465 H LEU 63 H LEU 63 -11.171 4.992 -1.227
466 HA LEU 63 HA LEU 63 -9.968 2.544 -0.427
467 1HB LEU 63 2HB LEU 63 -12.930 2.943 -0.457
468 2HB LEU 63 1HB LEU 63 -11.953 2.032 0.676
469 HG LEU 63 HG LEU 63 -11.003 4.499 1.164
470 1HD1 LEU 63 1HD1 LEU 63 -12.220 6.036 0.111
471 2HD1 LEU 63 2HD1 LEU 63 -13.472 5.672 1.301
472 3HD1 LEU 63 3HD1 LEU 63 -13.501 4.885 -0.277
473 1HD2 LEU 63 1HD2 LEU 63 -12.199 2.679 2.607
474 2HD2 LEU 63 2HD2 LEU 63 -13.568 3.776 2.479
475 3HD2 LEU 63 3HD2 LEU 63 -12.053 4.338 3.187
476 H ALA 64 H ALA 64 -11.474 3.626 -3.302
477 HA ALA 64 HA ALA 64 -12.682 1.315 -4.294
478 1HB ALA 64 1HB ALA 64 -11.408 2.389 -6.498
479 2HB ALA 64 2HB ALA 64 -11.584 3.762 -5.405
480 3HB ALA 64 3HB ALA 64 -13.003 2.837 -5.899
481 H LEU 65 H LEU 65 -9.319 2.105 -3.888
482 HA LEU 65 HA LEU 65 -8.234 0.150 -5.608
483 1HB LEU 65 2HB LEU 65 -7.084 1.593 -3.230
484 2HB LEU 65 1HB LEU 65 -6.159 0.454 -4.187
485 HG LEU 65 HG LEU 65 -5.501 2.414 -5.158
486 1HD1 LEU 65 1HD1 LEU 65 -6.755 0.923 -6.816
487 2HD1 LEU 65 2HD1 LEU 65 -6.419 2.588 -7.296
488 3HD1 LEU 65 3HD1 LEU 65 -8.032 2.139 -6.742
489 1HD2 LEU 65 1HD2 LEU 65 -7.255 4.280 -5.596
490 2HD2 LEU 65 2HD2 LEU 65 -6.593 4.062 -3.976
491 3HD2 LEU 65 3HD2 LEU 65 -8.191 3.433 -4.368
492 H LEU 66 H LEU 66 -9.575 -0.030 -2.426
493 HA LEU 66 HA LEU 66 -8.289 -2.524 -1.767
494 1HB LEU 66 2HB LEU 66 -10.809 -1.557 -0.456
495 2HB LEU 66 1HB LEU 66 -9.488 -2.481 0.235
496 HG LEU 66 HG LEU 66 -9.060 0.356 -0.643
497 1HD1 LEU 66 1HD1 LEU 66 -9.462 0.161 2.178
498 2HD1 LEU 66 2HD1 LEU 66 -10.899 -0.411 1.330
499 3HD1 LEU 66 3HD1 LEU 66 -10.266 1.201 1.004
500 1HD2 LEU 66 1HD2 LEU 66 -7.666 -1.639 1.070
501 2HD2 LEU 66 2HD2 LEU 66 -7.486 0.078 1.432
502 3HD2 LEU 66 3HD2 LEU 66 -7.013 -0.546 -0.148
503 H LYS 67 H LYS 67 -11.485 -1.472 -2.841
504 HA LYS 67 HA LYS 67 -12.878 -3.824 -2.927
505 1HB LYS 67 2HB LYS 67 -12.900 -1.762 -5.137
506 2HB LYS 67 1HB LYS 67 -14.194 -2.878 -4.722
507 1HG LYS 67 2HG LYS 67 -13.818 -1.588 -2.361
508 2HG LYS 67 1HG LYS 67 -13.462 -0.312 -3.524
509 1HD LYS 67 2HD LYS 67 -15.651 -0.005 -3.771
510 2HD LYS 67 1HD LYS 67 -15.754 -1.614 -4.487
511 1HE LYS 67 2HE LYS 67 -15.927 -2.508 -2.127
512 2HE LYS 67 1HE LYS 67 -16.139 -0.837 -1.605
513 1HZ LYS 67 1HZ LYS 67 -17.999 -2.607 -2.919
514 2HZ LYS 67 2HZ LYS 67 -17.943 -1.056 -3.592
515 3HZ LYS 67 3HZ LYS 67 -18.294 -1.252 -1.949
516 H GLN 68 H GLN 68 -10.738 -2.578 -5.516
517 HA GLN 68 HA GLN 68 -10.942 -4.843 -7.185
518 1HB GLN 68 2HB GLN 68 -8.666 -2.871 -6.937
519 2HB GLN 68 1HB GLN 68 -8.899 -3.991 -8.268
520 1HG GLN 68 2HG GLN 68 -10.082 -2.459 -9.323
521 2HG GLN 68 1HG GLN 68 -11.277 -2.502 -8.022
522 1HE2 GLN 68 1HE2 GLN 68 -11.712 -0.306 -8.254
523 2HE2 GLN 68 2HE2 GLN 68 -10.608 0.910 -7.717
524 H ILE 69 H ILE 69 -8.513 -3.860 -4.801
525 HA ILE 69 HA ILE 69 -6.736 -5.950 -5.059
526 HB ILE 69 HB ILE 69 -7.462 -4.299 -2.652
527 1HG1 ILE 69 2HG1 ILE 69 -6.316 -3.385 -4.815
528 2HG1 ILE 69 1HG1 ILE 69 -5.710 -2.902 -3.238
529 1HG2 ILE 69 1HG2 ILE 69 -5.638 -5.125 -1.426
530 2HG2 ILE 69 2HG2 ILE 69 -4.985 -5.993 -2.813
531 3HG2 ILE 69 3HG2 ILE 69 -6.463 -6.556 -2.041
532 1HD1 ILE 69 1HD1 ILE 69 -4.456 -5.289 -4.410
533 2HD1 ILE 69 2HD1 ILE 69 -3.737 -3.930 -3.546
534 3HD1 ILE 69 3HD1 ILE 69 -4.164 -3.766 -5.251
535 H LYS 70 H LYS 70 -9.677 -5.798 -3.170
536 HA LYS 70 HA LYS 70 -9.265 -8.324 -1.916
537 1HB LYS 70 2HB LYS 70 -11.443 -8.012 -0.940
538 2HB LYS 70 1HB LYS 70 -10.554 -6.498 -0.867
539 1HG LYS 70 2HG LYS 70 -12.195 -5.459 -1.918
540 2HG LYS 70 1HG LYS 70 -12.028 -6.554 -3.288
541 1HD LYS 70 2HD LYS 70 -13.459 -8.190 -2.033
542 2HD LYS 70 1HD LYS 70 -13.765 -6.911 -0.858
543 1HE LYS 70 2HE LYS 70 -14.850 -5.561 -2.473
544 2HE LYS 70 1HE LYS 70 -14.283 -6.573 -3.801
545 1HZ LYS 70 1HZ LYS 70 -16.660 -6.799 -2.335
546 2HZ LYS 70 2HZ LYS 70 -15.739 -8.187 -2.043
547 3HZ LYS 70 3HZ LYS 70 -16.131 -7.752 -3.629
548 H GLN 71 H GLN 71 -10.905 -7.219 -4.766
549 HA GLN 71 HA GLN 71 -12.434 -9.580 -5.135
550 1HB GLN 71 2HB GLN 71 -13.430 -7.759 -6.130
551 2HB GLN 71 1HB GLN 71 -11.907 -7.109 -6.708
552 1HG GLN 71 2HG GLN 71 -12.508 -9.633 -7.976
553 2HG GLN 71 1HG GLN 71 -13.827 -8.485 -8.171
554 1HE2 GLN 71 1HE2 GLN 71 -10.482 -7.524 -7.825
555 2HE2 GLN 71 2HE2 GLN 71 -10.284 -6.942 -9.439
556 H ARG 72 H ARG 72 -9.398 -8.406 -6.447
557 HA ARG 72 HA ARG 72 -9.094 -10.766 -8.097
558 1HB ARG 72 2HB ARG 72 -7.668 -8.185 -7.821
559 2HB ARG 72 1HB ARG 72 -6.725 -9.557 -8.388
560 1HG ARG 72 2HG ARG 72 -9.131 -9.576 -9.852
561 2HG ARG 72 1HG ARG 72 -8.559 -7.907 -9.828
562 1HD ARG 72 2HD ARG 72 -6.660 -8.396 -11.000
563 2HD ARG 72 1HD ARG 72 -6.573 -10.043 -10.382
564 HE ARG 72 HE ARG 72 -8.001 -10.744 -12.074
565 1HH1 ARG 72 1HH1 ARG 72 -7.612 -7.272 -12.168
566 2HH1 ARG 72 2HH1 ARG 72 -8.279 -7.119 -13.757
567 1HH2 ARG 72 1HH2 ARG 72 -8.878 -10.536 -14.163
568 2HH2 ARG 72 2HH2 ARG 72 -8.998 -8.968 -14.890
569 H HIS 73 H HIS 73 -7.452 -9.338 -5.337
570 HA HIS 73 HA HIS 73 -5.935 -11.825 -4.970
571 1HB HIS 73 2HB HIS 73 -5.302 -9.471 -3.275
572 2HB HIS 73 1HB HIS 73 -4.218 -10.581 -4.112
573 HD1 HIS 73 1HD HIS 73 -4.379 -10.217 -6.902
574 HD2 HIS 73 2HD HIS 73 -5.313 -7.026 -4.416
575 HE1 HIS 73 1HE HIS 73 -4.248 -8.171 -8.359
576 HE2 HIS 73 2HE HIS 73 -4.745 -6.243 -6.816
577 HA PRO 74 HA PRO 74 -8.408 -13.238 -1.611
578 1HB PRO 74 2HB PRO 74 -5.820 -13.901 -0.289
579 2HB PRO 74 1HB PRO 74 -7.226 -14.925 -0.595
580 1HG PRO 74 2HG PRO 74 -5.034 -15.164 -2.079
581 2HG PRO 74 1HG PRO 74 -6.645 -15.292 -2.811
582 1HD PRO 74 2HD PRO 74 -4.700 -13.026 -2.887
583 2HD PRO 74 1HD PRO 74 -5.805 -13.610 -4.150
584 H MET 75 H MET 75 -5.423 -12.148 0.004
585 HA MET 75 HA MET 75 -6.948 -10.053 1.364
586 1HB MET 75 2HB MET 75 -5.204 -12.015 2.856
587 2HB MET 75 1HB MET 75 -6.190 -10.735 3.548
588 1HG MET 75 2HG MET 75 -8.125 -12.062 2.332
589 2HG MET 75 1HG MET 75 -6.983 -13.394 2.500
590 1HE MET 75 1HE MET 75 -8.659 -14.856 4.909
591 2HE MET 75 2HE MET 75 -9.219 -14.130 3.403
592 3HE MET 75 3HE MET 75 -9.939 -13.640 4.936
593 H LEU 76 H LEU 76 -5.202 -9.565 -0.646
594 HA LEU 76 HA LEU 76 -2.519 -9.223 0.023
595 1HB LEU 76 2HB LEU 76 -3.576 -9.054 -2.262
596 2HB LEU 76 1HB LEU 76 -4.097 -7.438 -1.817
597 HG LEU 76 HG LEU 76 -1.986 -7.638 -3.221
598 1HD1 LEU 76 1HD1 LEU 76 -1.379 -6.136 -0.745
599 2HD1 LEU 76 2HD1 LEU 76 -2.883 -5.763 -1.589
600 3HD1 LEU 76 3HD1 LEU 76 -1.338 -5.615 -2.431
601 1HD2 LEU 76 1HD2 LEU 76 -0.110 -8.556 -2.395
602 2HD2 LEU 76 2HD2 LEU 76 -1.219 -9.435 -1.348
603 3HD2 LEU 76 3HD2 LEU 76 -0.416 -7.975 -0.760
604 HA PRO 77 HA PRO 77 -3.093 -6.040 3.181
605 1HB PRO 77 2HB PRO 77 -0.139 -6.178 3.228
606 2HB PRO 77 1HB PRO 77 -1.299 -6.382 4.545
607 1HG PRO 77 2HG PRO 77 0.014 -8.477 3.542
608 2HG PRO 77 1HG PRO 77 -1.686 -8.610 4.039
609 1HD PRO 77 2HD PRO 77 -0.535 -8.322 1.286
610 2HD PRO 77 1HD PRO 77 -1.852 -9.371 1.853
611 H VAL 78 H VAL 78 -3.523 -4.083 2.503
612 HA VAL 78 HA VAL 78 -1.577 -2.586 0.887
613 HB VAL 78 HB VAL 78 -4.517 -1.957 0.988
614 1HG1 VAL 78 1HG1 VAL 78 -4.002 -0.333 -0.429
615 2HG1 VAL 78 2HG1 VAL 78 -3.205 -1.468 -1.516
616 3HG1 VAL 78 3HG1 VAL 78 -2.298 -0.727 -0.202
617 1HG2 VAL 78 1HG2 VAL 78 -4.572 -4.189 0.244
618 2HG2 VAL 78 2HG2 VAL 78 -3.135 -3.975 -0.757
619 3HG2 VAL 78 3HG2 VAL 78 -4.654 -3.206 -1.220
620 H ILE 79 H ILE 79 -1.341 -0.340 1.375
621 HA ILE 79 HA ILE 79 -2.471 0.528 3.947
622 HB ILE 79 HB ILE 79 0.371 1.086 3.126
623 1HG1 ILE 79 2HG1 ILE 79 -0.043 -0.584 5.492
624 2HG1 ILE 79 1HG1 ILE 79 -0.555 -1.358 3.996
625 1HG2 ILE 79 1HG2 ILE 79 0.589 2.306 5.022
626 2HG2 ILE 79 2HG2 ILE 79 -0.581 1.332 5.915
627 3HG2 ILE 79 3HG2 ILE 79 -1.138 2.543 4.761
628 1HD1 ILE 79 1HD1 ILE 79 1.661 -0.990 3.047
629 2HD1 ILE 79 2HD1 ILE 79 1.740 -1.910 4.550
630 3HD1 ILE 79 3HD1 ILE 79 2.168 -0.200 4.542
631 H ILE 80 H ILE 80 -3.678 2.267 3.543
632 HA ILE 80 HA ILE 80 -2.966 3.982 1.298
633 HB ILE 80 HB ILE 80 -5.443 4.271 2.967
634 1HG1 ILE 80 2HG1 ILE 80 -5.406 1.962 2.214
635 2HG1 ILE 80 1HG1 ILE 80 -6.577 2.863 1.255
636 1HG2 ILE 80 1HG2 ILE 80 -4.346 5.502 0.578
637 2HG2 ILE 80 2HG2 ILE 80 -5.669 6.030 1.615
638 3HG2 ILE 80 3HG2 ILE 80 -5.974 4.874 0.320
639 1HD1 ILE 80 1HD1 ILE 80 -3.956 1.716 0.460
640 2HD1 ILE 80 2HD1 ILE 80 -4.565 3.139 -0.386
641 3HD1 ILE 80 3HD1 ILE 80 -5.515 1.654 -0.362
642 H MET 81 H MET 81 -2.536 6.125 1.430
643 HA MET 81 HA MET 81 -1.281 7.043 3.803
644 1HB MET 81 2HB MET 81 -0.818 9.056 2.621
645 2HB MET 81 1HB MET 81 -0.689 7.733 1.473
646 1HG MET 81 2HG MET 81 -2.465 8.429 0.253
647 2HG MET 81 1HG MET 81 -3.307 9.099 1.651
648 1HE MET 81 1HE MET 81 -3.902 11.155 -0.276
649 2HE MET 81 2HE MET 81 -2.858 10.268 -1.386
650 3HE MET 81 3HE MET 81 -2.589 11.989 -1.107
651 H THR 82 H THR 82 -4.541 7.449 2.595
652 HA THR 82 HA THR 82 -5.272 8.768 5.090
653 HB THR 82 HB THR 82 -6.195 9.958 2.478
654 HG1 THR 82 1HG THR 82 -4.634 11.604 2.923
655 1HG2 THR 82 1HG2 THR 82 -6.528 10.639 5.331
656 2HG2 THR 82 2HG2 THR 82 -7.617 10.884 3.965
657 3HG2 THR 82 3HG2 THR 82 -6.255 11.975 4.214
658 H ALA 83 H ALA 83 -7.735 8.985 5.276
659 HA ALA 83 HA ALA 83 -9.012 6.705 3.905
660 1HB ALA 83 1HB ALA 83 -8.622 6.074 6.183
661 2HB ALA 83 2HB ALA 83 -10.346 6.353 5.966
662 3HB ALA 83 3HB ALA 83 -9.352 7.567 6.771
663 H HIS 84 H HIS 84 -9.483 8.777 2.479
664 HA HIS 84 HA HIS 84 -11.586 10.495 3.378
665 1HB HIS 84 2HB HIS 84 -10.493 9.903 0.624
666 2HB HIS 84 1HB HIS 84 -11.746 11.100 0.937
667 HD1 HIS 84 1HD HIS 84 -9.873 11.666 3.743
668 HD2 HIS 84 2HD HIS 84 -9.063 12.286 -0.285
669 HE1 HIS 84 1HE HIS 84 -8.069 13.418 3.681
670 HE2 HIS 84 2HE HIS 84 -7.553 13.734 1.235
671 H SER 85 H SER 85 -13.714 10.611 2.288
672 HA SER 85 HA SER 85 -15.731 9.743 1.712
673 1HB SER 85 2HB SER 85 -14.364 8.962 -0.270
674 2HB SER 85 1HB SER 85 -14.247 7.397 0.530
675 HG SER 85 HG SER 85 -16.451 8.654 -0.632
676 H ASP 86 H ASP 86 -16.762 7.226 1.573
677 HA ASP 86 HA ASP 86 -17.352 6.612 4.213
678 1HB ASP 86 2HB ASP 86 -18.344 4.527 3.309
679 2HB ASP 86 1HB ASP 86 -18.806 5.953 2.388
680 H LEU 87 H LEU 87 -15.537 6.331 5.476
681 HA LEU 87 HA LEU 87 -13.286 4.845 5.023
682 1HB LEU 87 2HB LEU 87 -14.548 6.040 7.259
683 2HB LEU 87 1HB LEU 87 -14.076 4.421 7.739
684 HG LEU 87 HG LEU 87 -12.170 6.388 6.480
685 1HD1 LEU 87 1HD1 LEU 87 -12.520 7.506 8.426
686 2HD1 LEU 87 2HD1 LEU 87 -11.338 6.328 8.997
687 3HD1 LEU 87 3HD1 LEU 87 -13.059 6.066 9.289
688 1HD2 LEU 87 1HD2 LEU 87 -11.042 4.449 6.254
689 2HD2 LEU 87 2HD2 LEU 87 -11.998 3.625 7.485
690 3HD2 LEU 87 3HD2 LEU 87 -10.685 4.700 7.963
691 H ASP 88 H ASP 88 -16.471 3.642 5.469
692 HA ASP 88 HA ASP 88 -16.190 1.190 6.619
693 1HB ASP 88 2HB ASP 88 -17.888 1.950 4.238
694 2HB ASP 88 1HB ASP 88 -18.058 0.434 5.119
695 H ALA 89 H ALA 89 -15.547 1.934 3.173
696 HA ALA 89 HA ALA 89 -14.920 -0.722 2.471
697 1HB ALA 89 1HB ALA 89 -13.786 0.262 0.494
698 2HB ALA 89 2HB ALA 89 -14.040 1.863 1.196
699 3HB ALA 89 3HB ALA 89 -15.426 0.870 0.740
700 H ALA 90 H ALA 90 -13.132 1.744 4.085
701 HA ALA 90 HA ALA 90 -10.536 0.676 3.610
702 1HB ALA 90 1HB ALA 90 -10.833 3.017 4.183
703 2HB ALA 90 2HB ALA 90 -9.785 2.215 5.356
704 3HB ALA 90 3HB ALA 90 -11.464 2.563 5.766
705 H VAL 91 H VAL 91 -12.745 0.501 6.418
706 HA VAL 91 HA VAL 91 -11.020 -1.081 7.976
707 HB VAL 91 HB VAL 91 -14.004 -1.259 8.220
708 1HG1 VAL 91 1HG1 VAL 91 -12.778 -1.033 10.709
709 2HG1 VAL 91 2HG1 VAL 91 -11.696 -2.065 9.771
710 3HG1 VAL 91 3HG1 VAL 91 -13.394 -2.509 9.964
711 1HG2 VAL 91 1HG2 VAL 91 -12.192 1.018 8.974
712 2HG2 VAL 91 2HG2 VAL 91 -13.709 0.718 9.823
713 3HG2 VAL 91 3HG2 VAL 91 -13.720 1.070 8.096
714 H SER 92 H SER 92 -13.833 -2.049 6.006
715 HA SER 92 HA SER 92 -13.556 -4.812 6.389
716 1HB SER 92 2HB SER 92 -14.912 -5.090 4.388
717 2HB SER 92 1HB SER 92 -15.539 -3.731 5.324
718 HG SER 92 HG SER 92 -15.402 -2.838 3.390
719 H ALA 93 H ALA 93 -11.741 -2.562 4.514
720 HA ALA 93 HA ALA 93 -10.603 -4.197 2.578
721 1HB ALA 93 1HB ALA 93 -9.133 -2.490 2.173
722 2HB ALA 93 2HB ALA 93 -8.938 -2.121 3.889
723 3HB ALA 93 3HB ALA 93 -10.399 -1.622 3.040
724 H TYR 94 H TYR 94 -9.386 -3.350 5.769
725 HA TYR 94 HA TYR 94 -7.080 -4.853 5.827
726 1HB TYR 94 2HB TYR 94 -8.854 -4.625 8.247
727 2HB TYR 94 1HB TYR 94 -7.095 -4.645 8.180
728 HD1 TYR 94 1HD TYR 94 -6.405 -2.625 6.265
729 HD2 TYR 94 2HD TYR 94 -9.549 -2.603 9.129
730 HE1 TYR 94 1HE TYR 94 -6.376 -0.171 6.267
731 HE2 TYR 94 2HE TYR 94 -9.524 -0.144 9.143
732 HH TYR 94 HH TYR 94 -7.907 1.686 8.618
733 H GLN 95 H GLN 95 -10.358 -5.840 6.273
734 HA GLN 95 HA GLN 95 -9.774 -8.484 7.205
735 1HB GLN 95 2HB GLN 95 -11.856 -7.735 7.904
736 2HB GLN 95 1HB GLN 95 -12.214 -6.973 6.365
737 1HG GLN 95 2HG GLN 95 -12.109 -9.648 5.720
738 2HG GLN 95 1HG GLN 95 -12.838 -9.642 7.324
739 1HE2 GLN 95 1HE2 GLN 95 -13.055 -7.360 4.624
740 2HE2 GLN 95 2HE2 GLN 95 -14.774 -7.430 4.476
741 H GLN 96 H GLN 96 -10.567 -7.009 4.113
742 HA GLN 96 HA GLN 96 -10.414 -9.570 2.771
743 1HB GLN 96 2HB GLN 96 -11.140 -8.295 0.772
744 2HB GLN 96 1HB GLN 96 -12.256 -8.177 2.122
745 1HG GLN 96 2HG GLN 96 -10.831 -6.010 2.631
746 2HG GLN 96 1HG GLN 96 -10.530 -6.103 0.901
747 1HE2 GLN 96 1HE2 GLN 96 -11.694 -4.256 0.436
748 2HE2 GLN 96 2HE2 GLN 96 -13.417 -4.183 0.550
749 H GLY 97 H GLY 97 -8.139 -7.542 3.806
750 1HA GLY 97 2HA GLY 97 -5.876 -8.181 2.973
751 2HA GLY 97 1HA GLY 97 -6.502 -7.861 1.366
752 H ALA 98 H ALA 98 -5.690 -6.362 4.459
753 HA ALA 98 HA ALA 98 -4.502 -4.136 3.201
754 1HB ALA 98 1HB ALA 98 -6.161 -2.500 4.442
755 2HB ALA 98 2HB ALA 98 -7.278 -3.819 4.129
756 3HB ALA 98 3HB ALA 98 -6.443 -3.048 2.789
757 H PHE 99 H PHE 99 -3.065 -3.169 4.525
758 HA PHE 99 HA PHE 99 -2.654 -4.329 7.096
759 1HB PHE 99 2HB PHE 99 -0.816 -3.626 5.539
760 2HB PHE 99 1HB PHE 99 -1.233 -1.957 5.902
761 HD1 PHE 99 1HD PHE 99 -0.525 -5.102 7.786
762 HD2 PHE 99 2HD PHE 99 0.075 -0.901 7.458
763 HE1 PHE 99 1HE PHE 99 0.953 -5.162 9.752
764 HE2 PHE 99 2HE PHE 99 1.554 -0.954 9.423
765 HZ PHE 99 HZ PHE 99 1.995 -3.087 10.572
766 H ASP 100 H ASP 100 -3.328 -0.981 6.017
767 HA ASP 100 HA ASP 100 -5.165 -0.412 8.034
768 1HB ASP 100 2HB ASP 100 -2.645 -0.619 9.140
769 2HB ASP 100 1HB ASP 100 -2.842 1.118 8.919
770 H TYR 101 H TYR 101 -4.923 2.169 8.597
771 HA TYR 101 HA TYR 101 -4.491 3.553 6.034
772 1HB TYR 101 2HB TYR 101 -6.949 3.338 7.656
773 2HB TYR 101 1HB TYR 101 -6.553 4.965 7.125
774 HD1 TYR 101 1HD TYR 101 -6.980 1.503 5.810
775 HD2 TYR 101 2HD TYR 101 -7.215 5.671 5.013
776 HE1 TYR 101 1HE TYR 101 -8.011 1.021 3.633
777 HE2 TYR 101 2HE TYR 101 -8.243 5.208 2.830
778 HH TYR 101 HH TYR 101 -9.696 3.094 1.903
779 H LEU 102 H LEU 102 -3.999 5.812 6.225
780 HA LEU 102 HA LEU 102 -2.810 6.484 8.825
781 1HB LEU 102 2HB LEU 102 -2.025 6.880 6.054
782 2HB LEU 102 1HB LEU 102 -1.965 8.375 6.966
783 HG LEU 102 HG LEU 102 -0.396 7.444 8.528
784 1HD1 LEU 102 1HD1 LEU 102 -1.011 5.240 8.885
785 2HD1 LEU 102 2HD1 LEU 102 0.500 5.097 7.983
786 3HD1 LEU 102 3HD1 LEU 102 -1.044 4.867 7.161
787 1HD2 LEU 102 1HD2 LEU 102 1.469 6.864 6.994
788 2HD2 LEU 102 2HD2 LEU 102 0.590 8.323 6.540
789 3HD2 LEU 102 3HD2 LEU 102 0.305 6.818 5.669
790 HA PRO 103 HA PRO 103 -6.200 9.424 9.092
791 1HB PRO 103 2HB PRO 103 -5.586 10.365 11.582
792 2HB PRO 103 1HB PRO 103 -6.485 8.877 11.289
793 1HG PRO 103 2HG PRO 103 -3.659 9.250 12.096
794 2HG PRO 103 1HG PRO 103 -4.772 7.927 12.467
795 1HD PRO 103 2HD PRO 103 -2.746 7.843 10.570
796 2HD PRO 103 1HD PRO 103 -4.139 6.746 10.638
797 H LYS 104 H LYS 104 -3.401 10.670 10.875
798 HA LYS 104 HA LYS 104 -3.502 13.068 9.191
799 1HB LYS 104 2HB LYS 104 -3.965 13.482 11.556
800 2HB LYS 104 1HB LYS 104 -2.427 12.758 11.998
801 1HG LYS 104 2HG LYS 104 -1.810 14.730 10.118
802 2HG LYS 104 1HG LYS 104 -3.016 15.447 11.187
803 1HD LYS 104 2HD LYS 104 -1.628 14.690 13.125
804 2HD LYS 104 1HD LYS 104 -0.386 14.200 11.971
805 1HE LYS 104 2HE LYS 104 -1.506 16.989 12.113
806 2HE LYS 104 1HE LYS 104 -0.076 16.477 13.008
807 1HZ LYS 104 1HZ LYS 104 0.157 15.733 10.288
808 2HZ LYS 104 2HZ LYS 104 1.153 16.751 11.201
809 3HZ LYS 104 3HZ LYS 104 -0.192 17.386 10.396
810 HA PRO 105 HA PRO 105 1.280 12.218 9.791
811 1HB PRO 105 2HB PRO 105 1.817 9.578 10.441
812 2HB PRO 105 1HB PRO 105 1.866 10.934 11.570
813 1HG PRO 105 2HG PRO 105 -0.306 8.941 11.089
814 2HG PRO 105 1HG PRO 105 0.262 9.637 12.619
815 1HD PRO 105 2HD PRO 105 -1.989 10.483 11.470
816 2HD PRO 105 1HD PRO 105 -0.904 11.617 12.293
817 H PHE 106 H PHE 106 2.628 11.458 8.170
818 HA PHE 106 HA PHE 106 1.957 9.244 6.513
819 1HB PHE 106 2HB PHE 106 0.309 10.904 5.689
820 2HB PHE 106 1HB PHE 106 1.626 12.001 5.298
821 HD1 PHE 106 1HD PHE 106 1.588 12.198 2.995
822 HD2 PHE 106 2HD PHE 106 1.352 8.328 4.741
823 HE1 PHE 106 1HE PHE 106 1.793 11.179 0.765
824 HE2 PHE 106 2HE PHE 106 1.562 7.303 2.523
825 HZ PHE 106 HZ PHE 106 1.783 8.728 0.527
826 H ASP 107 H ASP 107 3.388 11.548 4.510
827 HA ASP 107 HA ASP 107 5.496 11.566 3.619
828 1HB ASP 107 2HB ASP 107 7.159 12.505 5.135
829 2HB ASP 107 1HB ASP 107 5.591 13.262 5.405
830 H ILE 108 H ILE 108 7.947 10.777 4.160
831 HA ILE 108 HA ILE 108 7.804 7.960 4.008
832 HB ILE 108 HB ILE 108 9.798 9.936 3.539
833 1HG1 ILE 108 2HG1 ILE 108 10.705 8.114 2.109
834 2HG1 ILE 108 1HG1 ILE 108 9.542 7.016 2.841
835 1HG2 ILE 108 1HG2 ILE 108 10.944 9.274 5.521
836 2HG2 ILE 108 2HG2 ILE 108 11.779 8.534 4.154
837 3HG2 ILE 108 3HG2 ILE 108 10.698 7.568 5.156
838 1HD1 ILE 108 1HD1 ILE 108 8.966 8.046 0.576
839 2HD1 ILE 108 2HD1 ILE 108 8.645 9.523 1.486
840 3HD1 ILE 108 3HD1 ILE 108 7.733 8.056 1.839
841 H ASP 109 H ASP 109 8.797 10.121 6.565
842 HA ASP 109 HA ASP 109 9.938 8.372 8.344
843 1HB ASP 109 2HB ASP 109 9.684 10.853 8.657
844 2HB ASP 109 1HB ASP 109 8.025 10.559 9.171
845 H GLU 110 H GLU 110 6.457 9.228 8.345
846 HA GLU 110 HA GLU 110 5.868 7.071 10.119
847 1HB GLU 110 2HB GLU 110 4.085 8.985 8.633
848 2HB GLU 110 1HB GLU 110 3.478 7.746 9.720
849 1HG GLU 110 2HG GLU 110 5.437 9.867 10.550
850 2HG GLU 110 1HG GLU 110 3.690 10.035 10.706
851 H ALA 111 H ALA 111 5.718 7.584 6.678
852 HA ALA 111 HA ALA 111 4.078 5.372 6.036
853 1HB ALA 111 1HB ALA 111 5.163 5.551 3.766
854 2HB ALA 111 2HB ALA 111 6.142 6.861 4.428
855 3HB ALA 111 3HB ALA 111 4.388 7.021 4.355
856 H VAL 112 H VAL 112 7.607 5.730 5.674
857 HA VAL 112 HA VAL 112 8.163 3.019 5.251
858 HB VAL 112 HB VAL 112 9.980 5.031 6.574
859 1HG1 VAL 112 1HG1 VAL 112 11.597 3.497 6.500
860 2HG1 VAL 112 2HG1 VAL 112 11.188 3.034 4.848
861 3HG1 VAL 112 3HG1 VAL 112 10.322 2.313 6.206
862 1HG2 VAL 112 1HG2 VAL 112 10.817 4.928 4.015
863 2HG2 VAL 112 2HG2 VAL 112 9.679 6.129 4.626
864 3HG2 VAL 112 3HG2 VAL 112 9.082 4.700 3.789
865 H ALA 113 H ALA 113 7.676 4.832 8.163
866 HA ALA 113 HA ALA 113 8.757 3.017 10.020
867 1HB ALA 113 1HB ALA 113 6.502 4.989 10.318
868 2HB ALA 113 2HB ALA 113 8.210 5.293 10.643
869 3HB ALA 113 3HB ALA 113 7.308 4.166 11.654
870 H LEU 114 H LEU 114 5.522 3.467 8.730
871 HA LEU 114 HA LEU 114 4.373 1.305 10.167
872 1HB LEU 114 2HB LEU 114 3.035 3.203 9.581
873 2HB LEU 114 1HB LEU 114 3.395 2.985 7.881
874 HG LEU 114 HG LEU 114 2.234 0.626 8.339
875 1HD1 LEU 114 1HD1 LEU 114 1.295 2.439 10.511
876 2HD1 LEU 114 2HD1 LEU 114 1.661 0.714 10.563
877 3HD1 LEU 114 3HD1 LEU 114 0.179 1.281 9.789
878 1HD2 LEU 114 1HD2 LEU 114 1.101 3.290 7.628
879 2HD2 LEU 114 2HD2 LEU 114 0.043 1.883 7.733
880 3HD2 LEU 114 3HD2 LEU 114 1.403 1.884 6.609
881 H VAL 115 H VAL 115 6.030 1.578 7.144
882 HA VAL 115 HA VAL 115 4.825 -0.784 6.038
883 HB VAL 115 HB VAL 115 5.784 1.122 4.654
884 1HG1 VAL 115 1HG1 VAL 115 8.089 1.166 4.144
885 2HG1 VAL 115 2HG1 VAL 115 8.387 -0.342 5.010
886 3HG1 VAL 115 3HG1 VAL 115 7.978 1.122 5.900
887 1HG2 VAL 115 1HG2 VAL 115 6.310 -1.784 4.144
888 2HG2 VAL 115 2HG2 VAL 115 6.725 -0.560 2.944
889 3HG2 VAL 115 3HG2 VAL 115 5.052 -0.744 3.472
890 H GLU 116 H GLU 116 7.975 -0.008 7.461
891 HA GLU 116 HA GLU 116 9.075 -2.586 7.170
892 1HB GLU 116 2HB GLU 116 9.702 -0.309 9.040
893 2HB GLU 116 1HB GLU 116 10.624 -1.806 9.031
894 1HG GLU 116 2HG GLU 116 10.965 -1.374 6.540
895 2HG GLU 116 1HG GLU 116 10.393 0.260 6.876
896 H ARG 117 H ARG 117 7.423 -1.029 9.914
897 HA ARG 117 HA ARG 117 7.604 -3.201 11.677
898 1HB ARG 117 2HB ARG 117 5.836 -2.137 12.946
899 2HB ARG 117 1HB ARG 117 6.951 -0.911 12.360
900 1HG ARG 117 2HG ARG 117 5.422 0.005 10.953
901 2HG ARG 117 1HG ARG 117 4.569 -1.514 10.697
902 1HD ARG 117 2HD ARG 117 3.142 -0.073 11.955
903 2HD ARG 117 1HD ARG 117 3.720 -1.341 13.032
904 HE ARG 117 HE ARG 117 4.916 1.354 12.983
905 1HH1 ARG 117 1HH1 ARG 117 3.597 -1.366 14.747
906 2HH1 ARG 117 2HH1 ARG 117 3.944 -0.680 16.297
907 1HH2 ARG 117 1HH2 ARG 117 5.364 2.245 15.022
908 2HH2 ARG 117 2HH2 ARG 117 4.944 1.367 16.454
909 H ALA 118 H ALA 118 5.524 -2.558 9.000
910 HA ALA 118 HA ALA 118 3.450 -4.375 9.605
911 1HB ALA 118 1HB ALA 118 3.201 -2.579 7.962
912 2HB ALA 118 2HB ALA 118 2.827 -4.154 7.258
913 3HB ALA 118 3HB ALA 118 4.373 -3.376 6.913
914 H ILE 119 H ILE 119 6.382 -4.659 7.619
915 HA ILE 119 HA ILE 119 5.930 -7.361 6.888
916 HB ILE 119 HB ILE 119 8.598 -5.970 6.980
917 1HG1 ILE 119 2HG1 ILE 119 7.069 -6.025 4.448
918 2HG1 ILE 119 1HG1 ILE 119 6.474 -4.916 5.680
919 1HG2 ILE 119 1HG2 ILE 119 7.509 -8.291 5.407
920 2HG2 ILE 119 2HG2 ILE 119 8.857 -8.283 6.546
921 3HG2 ILE 119 3HG2 ILE 119 9.010 -7.461 4.991
922 1HD1 ILE 119 1HD1 ILE 119 9.332 -4.974 4.775
923 2HD1 ILE 119 2HD1 ILE 119 8.514 -3.739 5.733
924 3HD1 ILE 119 3HD1 ILE 119 8.099 -3.957 4.032
925 H SER 120 H SER 120 7.473 -5.775 9.547
926 HA SER 120 HA SER 120 8.963 -7.954 10.543
927 1HB SER 120 2HB SER 120 9.273 -5.523 11.151
928 2HB SER 120 1HB SER 120 7.833 -5.664 12.159
929 HG SER 120 HG SER 120 8.893 -7.202 13.402
930 H HIS 121 H HIS 121 5.715 -6.739 11.281
931 HA HIS 121 HA HIS 121 5.178 -8.610 13.337
932 1HB HIS 121 2HB HIS 121 3.538 -6.725 11.706
933 2HB HIS 121 1HB HIS 121 2.713 -7.970 12.638
934 HD1 HIS 121 1HD HIS 121 5.488 -5.464 13.386
935 HD2 HIS 121 2HD HIS 121 1.997 -6.992 15.045
936 HE1 HIS 121 1HE HIS 121 5.211 -4.274 15.583
937 HE2 HIS 121 2HE HIS 121 3.060 -5.169 16.542
938 H TYR 122 H TYR 122 5.013 -8.769 9.896
939 HA TYR 122 HA TYR 122 3.314 -11.081 9.845
940 1HB TYR 122 2HB TYR 122 4.706 -9.425 7.789
941 2HB TYR 122 1HB TYR 122 4.194 -11.052 7.353
942 HD1 TYR 122 1HD TYR 122 3.264 -7.925 6.776
943 HD2 TYR 122 2HD TYR 122 1.641 -11.373 8.667
944 HE1 TYR 122 1HE TYR 122 0.994 -7.087 6.342
945 HE2 TYR 122 2HE TYR 122 -0.636 -10.545 8.239
946 HH TYR 122 HH TYR 122 -1.276 -7.364 7.241
947 H GLN 123 H GLN 123 6.754 -10.390 9.372
948 HA GLN 123 HA GLN 123 7.425 -13.111 8.844
949 1HB GLN 123 2HB GLN 123 9.744 -12.361 8.925
950 2HB GLN 123 1HB GLN 123 8.771 -11.270 7.949
951 1HG GLN 123 2HG GLN 123 8.576 -9.908 10.156
952 2HG GLN 123 1HG GLN 123 10.008 -10.826 10.624
953 1HE2 GLN 123 1HE2 GLN 123 10.963 -8.655 10.672
954 2HE2 GLN 123 2HE2 GLN 123 11.601 -8.000 9.206
955 H GLU 124 H GLU 124 9.524 -13.821 10.299
956 HA GLU 124 HA GLU 124 10.182 -14.769 12.257
957 1HB GLU 124 2HB GLU 124 8.728 -12.359 13.331
958 2HB GLU 124 1HB GLU 124 9.501 -13.529 14.391
959 1HG GLU 124 2HG GLU 124 11.650 -13.072 13.400
960 2HG GLU 124 1HG GLU 124 10.909 -11.986 12.224
Start of MODEL 5
1 1H MET 1 1HT MET 1 6.156 -11.966 -2.571
2 2H MET 1 2HT MET 1 5.899 -13.358 -3.537
3 3H MET 1 3HT MET 1 7.446 -13.045 -2.877
4 HA MET 1 HA MET 1 5.262 -13.200 -1.007
5 1HB MET 1 2HB MET 1 6.184 -15.508 -2.700
6 2HB MET 1 1HB MET 1 5.533 -15.764 -1.087
7 1HG MET 1 2HG MET 1 3.689 -14.091 -2.293
8 2HG MET 1 1HG MET 1 4.166 -15.202 -3.576
9 1HE MET 1 1HE MET 1 0.982 -15.599 -0.848
10 2HE MET 1 2HE MET 1 0.833 -15.868 -2.583
11 3HE MET 1 3HE MET 1 1.630 -14.414 -1.982
12 H GLN 2 H GLN 2 8.558 -13.774 -2.038
13 HA GLN 2 HA GLN 2 9.374 -13.793 0.776
14 1HB GLN 2 2HB GLN 2 9.477 -16.059 -0.868
15 2HB GLN 2 1HB GLN 2 11.126 -15.454 -0.826
16 1HG GLN 2 2HG GLN 2 11.424 -16.337 1.174
17 2HG GLN 2 1HG GLN 2 10.084 -15.388 1.816
18 1HE2 GLN 2 1HE2 GLN 2 8.681 -16.596 2.835
19 2HE2 GLN 2 2HE2 GLN 2 8.186 -18.192 2.396
20 H ARG 3 H ARG 3 11.999 -13.817 0.653
21 HA ARG 3 HA ARG 3 13.870 -12.630 0.257
22 1HB ARG 3 2HB ARG 3 14.542 -12.328 -1.901
23 2HB ARG 3 1HB ARG 3 13.213 -13.448 -2.150
24 1HG ARG 3 2HG ARG 3 11.784 -11.366 -2.558
25 2HG ARG 3 1HG ARG 3 13.314 -10.505 -2.699
26 1HD ARG 3 2HD ARG 3 13.769 -12.649 -4.297
27 2HD ARG 3 1HD ARG 3 12.038 -12.421 -4.526
28 HE ARG 3 HE ARG 3 14.015 -10.277 -4.970
29 1HH1 ARG 3 1HH1 ARG 3 11.148 -12.037 -5.939
30 2HH1 ARG 3 2HH1 ARG 3 10.856 -11.035 -7.317
31 1HH2 ARG 3 1HH2 ARG 3 13.614 -8.965 -6.786
32 2HH2 ARG 3 2HH2 ARG 3 12.246 -9.296 -7.795
33 H GLY 4 H GLY 4 10.832 -11.093 0.129
34 1HA GLY 4 2HA GLY 4 10.437 -9.061 1.292
35 2HA GLY 4 1HA GLY 4 12.097 -8.587 0.964
36 H ILE 5 H ILE 5 8.843 -8.695 -0.256
37 HA ILE 5 HA ILE 5 9.710 -6.968 -2.476
38 HB ILE 5 HB ILE 5 7.316 -8.770 -2.649
39 1HG1 ILE 5 2HG1 ILE 5 9.054 -10.349 -2.339
40 2HG1 ILE 5 1HG1 ILE 5 8.839 -10.245 -4.082
41 1HG2 ILE 5 1HG2 ILE 5 7.074 -7.941 -4.707
42 2HG2 ILE 5 2HG2 ILE 5 8.788 -8.138 -5.073
43 3HG2 ILE 5 3HG2 ILE 5 8.228 -6.697 -4.226
44 1HD1 ILE 5 1HD1 ILE 5 11.158 -9.698 -2.458
45 2HD1 ILE 5 2HD1 ILE 5 10.771 -8.347 -3.526
46 3HD1 ILE 5 3HD1 ILE 5 11.030 -9.958 -4.197
47 H VAL 6 H VAL 6 9.039 -4.978 -2.094
48 HA VAL 6 HA VAL 6 6.418 -4.563 -0.813
49 HB VAL 6 HB VAL 6 8.350 -3.578 0.411
50 1HG1 VAL 6 1HG1 VAL 6 8.955 -1.333 -1.134
51 2HG1 VAL 6 2HG1 VAL 6 9.043 -2.706 -2.226
52 3HG1 VAL 6 3HG1 VAL 6 9.997 -2.698 -0.766
53 1HG2 VAL 6 1HG2 VAL 6 6.705 -1.369 -0.794
54 2HG2 VAL 6 2HG2 VAL 6 7.332 -1.500 0.848
55 3HG2 VAL 6 3HG2 VAL 6 6.019 -2.546 0.318
56 H TRP 7 H TRP 7 4.828 -3.639 -1.996
57 HA TRP 7 HA TRP 7 5.615 -2.310 -4.504
58 1HB TRP 7 2HB TRP 7 3.348 -4.182 -3.917
59 2HB TRP 7 1HB TRP 7 3.188 -2.991 -5.206
60 HD1 TRP 7 HD1 TRP 7 6.695 -4.175 -4.948
61 HE1 TRP 7 1HE TRP 7 7.228 -5.840 -6.824
62 HE3 TRP 7 3HE TRP 7 1.945 -5.076 -6.581
63 HZ2 TRP 7 2HZ TRP 7 5.813 -7.357 -8.745
64 HZ3 TRP 7 3HZ TRP 7 1.617 -6.646 -8.444
65 HH2 TRP 7 HH2 TRP 7 3.511 -7.764 -9.503
66 H VAL 8 H VAL 8 5.088 -0.252 -4.695
67 HA VAL 8 HA VAL 8 3.128 0.862 -2.798
68 HB VAL 8 HB VAL 8 5.122 2.672 -4.034
69 1HG1 VAL 8 1HG1 VAL 8 4.560 3.995 -2.329
70 2HG1 VAL 8 2HG1 VAL 8 4.750 2.703 -1.145
71 3HG1 VAL 8 3HG1 VAL 8 3.242 2.859 -2.047
72 1HG2 VAL 8 1HG2 VAL 8 6.908 1.442 -3.463
73 2HG2 VAL 8 2HG2 VAL 8 5.940 0.318 -2.509
74 3HG2 VAL 8 3HG2 VAL 8 6.491 1.831 -1.794
75 H VAL 9 H VAL 9 1.660 2.411 -3.507
76 HA VAL 9 HA VAL 9 1.579 2.852 -6.417
77 HB VAL 9 HB VAL 9 -1.082 3.003 -5.317
78 1HG1 VAL 9 1HG1 VAL 9 0.349 1.464 -7.436
79 2HG1 VAL 9 2HG1 VAL 9 -0.887 2.696 -7.617
80 3HG1 VAL 9 3HG1 VAL 9 -1.324 1.078 -7.064
81 1HG2 VAL 9 1HG2 VAL 9 0.464 0.491 -4.731
82 2HG2 VAL 9 2HG2 VAL 9 -1.282 0.477 -4.965
83 3HG2 VAL 9 3HG2 VAL 9 -0.578 1.413 -3.651
84 H ASP 10 H ASP 10 2.016 4.909 -6.781
85 HA ASP 10 HA ASP 10 0.458 7.006 -5.574
86 1HB ASP 10 2HB ASP 10 2.638 6.313 -4.114
87 2HB ASP 10 1HB ASP 10 3.348 7.513 -5.189
88 H ASP 11 H ASP 11 2.272 9.120 -6.167
89 HA ASP 11 HA ASP 11 1.756 9.468 -8.917
90 1HB ASP 11 2HB ASP 11 2.090 11.232 -7.030
91 2HB ASP 11 1HB ASP 11 3.794 11.103 -7.454
92 H ASP 12 H ASP 12 4.066 7.524 -7.584
93 HA ASP 12 HA ASP 12 5.874 6.451 -8.455
94 1HB ASP 12 2HB ASP 12 4.366 7.203 -10.691
95 2HB ASP 12 1HB ASP 12 6.012 7.702 -11.071
96 H SER 13 H SER 13 7.793 7.439 -10.348
97 HA SER 13 HA SER 13 9.864 8.383 -10.049
98 1HB SER 13 2HB SER 13 8.221 9.835 -11.429
99 2HB SER 13 1HB SER 13 8.368 10.966 -10.087
100 HG SER 13 HG SER 13 10.747 10.622 -10.448
101 H SER 14 H SER 14 8.239 11.023 -8.407
102 HA SER 14 HA SER 14 10.205 11.410 -6.496
103 1HB SER 14 2HB SER 14 8.552 13.120 -6.947
104 2HB SER 14 1HB SER 14 7.258 12.080 -6.352
105 HG SER 14 HG SER 14 8.942 13.694 -4.974
106 H ILE 15 H ILE 15 6.992 9.989 -5.835
107 HA ILE 15 HA ILE 15 7.666 9.040 -3.286
108 HB ILE 15 HB ILE 15 5.580 7.802 -5.074
109 1HG1 ILE 15 2HG1 ILE 15 5.268 10.230 -5.096
110 2HG1 ILE 15 1HG1 ILE 15 4.002 9.458 -4.154
111 1HG2 ILE 15 1HG2 ILE 15 6.093 6.636 -2.969
112 2HG2 ILE 15 2HG2 ILE 15 4.451 7.281 -2.996
113 3HG2 ILE 15 3HG2 ILE 15 5.709 8.108 -2.078
114 1HD1 ILE 15 1HD1 ILE 15 6.379 10.378 -2.669
115 2HD1 ILE 15 2HD1 ILE 15 4.674 10.403 -2.222
116 3HD1 ILE 15 3HD1 ILE 15 5.313 11.618 -3.330
117 H ARG 16 H ARG 16 8.163 7.721 -6.445
118 HA ARG 16 HA ARG 16 8.663 5.034 -5.620
119 1HB ARG 16 2HB ARG 16 7.994 5.594 -7.924
120 2HB ARG 16 1HB ARG 16 9.505 6.466 -8.147
121 1HG ARG 16 2HG ARG 16 10.167 3.874 -7.245
122 2HG ARG 16 1HG ARG 16 8.965 3.695 -8.520
123 1HD ARG 16 2HD ARG 16 11.223 5.582 -8.955
124 2HD ARG 16 1HD ARG 16 11.540 3.853 -9.064
125 HE ARG 16 HE ARG 16 9.265 4.592 -10.599
126 1HH1 ARG 16 1HH1 ARG 16 12.755 4.629 -10.600
127 2HH1 ARG 16 2HH1 ARG 16 12.880 4.598 -12.327
128 1HH2 ARG 16 1HH2 ARG 16 9.427 4.550 -12.870
129 2HH2 ARG 16 2HH2 ARG 16 10.991 4.553 -13.617
130 H TRP 17 H TRP 17 10.730 7.809 -6.372
131 HA TRP 17 HA TRP 17 13.168 6.431 -6.058
132 1HB TRP 17 2HB TRP 17 12.944 8.573 -7.283
133 2HB TRP 17 1HB TRP 17 12.669 9.391 -5.747
134 HD1 TRP 17 HD1 TRP 17 15.435 7.337 -7.510
135 HE1 TRP 17 1HE TRP 17 17.711 8.135 -6.614
136 HE3 TRP 17 3HE TRP 17 13.801 10.647 -3.975
137 HZ2 TRP 17 2HZ TRP 17 18.686 9.931 -4.664
138 HZ3 TRP 17 3HZ TRP 17 15.470 11.863 -2.637
139 HH2 TRP 17 HH2 TRP 17 17.860 11.511 -2.977
140 H VAL 18 H VAL 18 11.220 8.346 -3.807
141 HA VAL 18 HA VAL 18 13.120 8.298 -1.719
142 HB VAL 18 HB VAL 18 10.167 8.588 -1.281
143 1HG1 VAL 18 1HG1 VAL 18 12.360 10.103 0.080
144 2HG1 VAL 18 2HG1 VAL 18 11.936 8.472 0.597
145 3HG1 VAL 18 3HG1 VAL 18 10.727 9.754 0.646
146 1HG2 VAL 18 1HG2 VAL 18 11.835 10.218 -2.959
147 2HG2 VAL 18 2HG2 VAL 18 11.290 11.145 -1.563
148 3HG2 VAL 18 3HG2 VAL 18 10.111 10.365 -2.615
149 H LEU 19 H LEU 19 10.395 6.230 -2.486
150 HA LEU 19 HA LEU 19 10.731 4.694 -0.087
151 1HB LEU 19 2HB LEU 19 8.814 4.660 -2.352
152 2HB LEU 19 1HB LEU 19 8.983 3.205 -1.388
153 HG LEU 19 HG LEU 19 8.276 5.918 -0.272
154 1HD1 LEU 19 1HD1 LEU 19 6.100 4.337 0.106
155 2HD1 LEU 19 2HD1 LEU 19 6.650 3.805 -1.482
156 3HD1 LEU 19 3HD1 LEU 19 6.282 5.507 -1.201
157 1HD2 LEU 19 1HD2 LEU 19 8.159 3.193 1.009
158 2HD2 LEU 19 2HD2 LEU 19 7.782 4.741 1.766
159 3HD2 LEU 19 3HD2 LEU 19 9.438 4.376 1.281
160 H GLU 20 H GLU 20 11.741 4.417 -3.398
161 HA GLU 20 HA GLU 20 12.240 1.639 -3.358
162 1HB GLU 20 2HB GLU 20 13.493 1.940 -5.377
163 2HB GLU 20 1HB GLU 20 12.053 2.934 -5.448
164 1HG GLU 20 2HG GLU 20 13.456 4.887 -4.827
165 2HG GLU 20 1HG GLU 20 14.872 3.842 -4.934
166 H ARG 21 H ARG 21 14.508 4.342 -3.125
167 HA ARG 21 HA ARG 21 16.769 2.808 -2.533
168 1HB ARG 21 2HB ARG 21 16.095 5.687 -1.957
169 2HB ARG 21 1HB ARG 21 17.667 4.990 -1.590
170 1HG ARG 21 2HG ARG 21 16.747 4.503 -4.327
171 2HG ARG 21 1HG ARG 21 17.001 6.204 -3.930
172 1HD ARG 21 2HD ARG 21 19.228 5.967 -3.829
173 2HD ARG 21 1HD ARG 21 19.121 4.431 -2.974
174 HE ARG 21 HE ARG 21 18.925 3.321 -5.074
175 1HH1 ARG 21 1HH1 ARG 21 19.659 6.733 -5.349
176 2HH1 ARG 21 2HH1 ARG 21 20.281 6.589 -6.956
177 1HH2 ARG 21 1HH2 ARG 21 19.737 3.147 -7.188
178 2HH2 ARG 21 2HH2 ARG 21 20.324 4.561 -8.000
179 H ALA 22 H ALA 22 14.655 4.607 -0.282
180 HA ALA 22 HA ALA 22 15.963 3.871 2.061
181 1HB ALA 22 1HB ALA 22 13.215 4.054 2.674
182 2HB ALA 22 2HB ALA 22 13.539 5.207 1.379
183 3HB ALA 22 3HB ALA 22 14.460 5.286 2.882
184 H LEU 23 H LEU 23 13.340 2.271 0.366
185 HA LEU 23 HA LEU 23 13.065 0.183 2.280
186 1HB LEU 23 2HB LEU 23 11.345 0.951 0.567
187 2HB LEU 23 1HB LEU 23 12.255 0.027 -0.613
188 HG LEU 23 HG LEU 23 10.199 -1.075 0.433
189 1HD1 LEU 23 1HD1 LEU 23 12.024 -2.221 -0.848
190 2HD1 LEU 23 2HD1 LEU 23 11.136 -3.229 0.298
191 3HD1 LEU 23 3HD1 LEU 23 12.745 -2.636 0.706
192 1HD2 LEU 23 1HD2 LEU 23 10.752 -0.402 2.761
193 2HD2 LEU 23 2HD2 LEU 23 12.094 -1.548 2.722
194 3HD2 LEU 23 3HD2 LEU 23 10.433 -2.126 2.560
195 H ALA 24 H ALA 24 15.007 0.679 -0.550
196 HA ALA 24 HA ALA 24 15.866 -1.986 -0.915
197 1HB ALA 24 1HB ALA 24 17.974 -0.311 -1.706
198 2HB ALA 24 2HB ALA 24 16.498 0.596 -2.023
199 3HB ALA 24 3HB ALA 24 16.718 -1.003 -2.730
200 H GLY 25 H GLY 25 16.869 0.659 1.158
201 1HA GLY 25 2HA GLY 25 19.312 -0.443 2.057
202 2HA GLY 25 1HA GLY 25 18.334 0.734 2.928
203 H ALA 26 H ALA 26 15.995 -1.117 2.821
204 HA ALA 26 HA ALA 26 16.540 -2.501 5.261
205 1HB ALA 26 1HB ALA 26 14.394 -1.599 5.184
206 2HB ALA 26 2HB ALA 26 14.131 -3.317 4.893
207 3HB ALA 26 3HB ALA 26 14.104 -2.181 3.543
208 H GLY 27 H GLY 27 16.802 -3.254 1.956
209 1HA GLY 27 2HA GLY 27 17.887 -5.215 1.207
210 2HA GLY 27 1HA GLY 27 17.332 -6.044 2.650
211 H LEU 28 H LEU 28 15.071 -4.163 0.716
212 HA LEU 28 HA LEU 28 14.117 -6.656 -0.466
213 1HB LEU 28 2HB LEU 28 11.984 -4.820 0.335
214 2HB LEU 28 1HB LEU 28 12.049 -6.564 0.402
215 HG LEU 28 HG LEU 28 13.748 -6.026 2.388
216 1HD1 LEU 28 1HD1 LEU 28 12.812 -4.139 3.704
217 2HD1 LEU 28 2HD1 LEU 28 11.882 -3.671 2.283
218 3HD1 LEU 28 3HD1 LEU 28 13.644 -3.644 2.230
219 1HD2 LEU 28 1HD2 LEU 28 12.181 -7.153 3.484
220 2HD2 LEU 28 2HD2 LEU 28 11.093 -6.908 2.116
221 3HD2 LEU 28 3HD2 LEU 28 11.101 -5.759 3.455
222 H THR 29 H THR 29 12.314 -6.206 -2.116
223 HA THR 29 HA THR 29 13.334 -4.137 -3.909
224 HB THR 29 HB THR 29 11.564 -6.542 -4.306
225 HG1 THR 29 1HG THR 29 13.272 -7.100 -5.724
226 1HG2 THR 29 1HG2 THR 29 10.534 -5.265 -5.885
227 2HG2 THR 29 2HG2 THR 29 11.911 -5.858 -6.813
228 3HG2 THR 29 3HG2 THR 29 11.942 -4.231 -6.134
229 H CYS 30 H CYS 30 12.296 -2.302 -4.324
230 HA CYS 30 HA CYS 30 9.473 -2.069 -3.518
231 1HB CYS 30 2HB CYS 30 10.896 -0.853 -1.958
232 2HB CYS 30 1HB CYS 30 11.641 0.014 -3.293
233 HG CYS 30 HG CYS 30 8.704 0.464 -2.374
234 H THR 31 H THR 31 8.233 -1.901 -5.178
235 HA THR 31 HA THR 31 9.131 -0.301 -7.480
236 HB THR 31 HB THR 31 8.742 -2.865 -7.795
237 HG1 THR 31 1HG THR 31 7.304 -1.066 -9.453
238 1HG2 THR 31 1HG2 THR 31 6.337 -2.451 -6.662
239 2HG2 THR 31 2HG2 THR 31 6.685 -3.745 -7.811
240 3HG2 THR 31 3HG2 THR 31 5.933 -2.254 -8.368
241 H THR 32 H THR 32 7.487 1.029 -8.462
242 HA THR 32 HA THR 32 5.170 1.442 -6.719
243 HB THR 32 HB THR 32 5.340 3.828 -7.030
244 HG1 THR 32 1HG THR 32 6.428 4.591 -8.631
245 1HG2 THR 32 1HG2 THR 32 8.160 3.332 -6.426
246 2HG2 THR 32 2HG2 THR 32 7.016 2.387 -5.468
247 3HG2 THR 32 3HG2 THR 32 6.914 4.151 -5.479
248 H PHE 33 H PHE 33 3.387 2.637 -7.745
249 HA PHE 33 HA PHE 33 3.165 2.081 -10.610
250 1HB PHE 33 2HB PHE 33 1.077 1.400 -8.558
251 2HB PHE 33 1HB PHE 33 0.920 1.197 -10.285
252 HD1 PHE 33 1HD PHE 33 1.214 -0.941 -11.082
253 HD2 PHE 33 2HD PHE 33 3.315 0.245 -7.584
254 HE1 PHE 33 1HE PHE 33 2.163 -3.190 -10.898
255 HE2 PHE 33 2HE PHE 33 4.275 -2.006 -7.390
256 HZ PHE 33 HZ PHE 33 3.687 -3.743 -9.056
257 H GLU 34 H GLU 34 0.993 3.049 -11.444
258 HA GLU 34 HA GLU 34 1.253 5.812 -11.307
259 1HB GLU 34 2HB GLU 34 -0.578 5.929 -12.802
260 2HB GLU 34 1HB GLU 34 0.295 4.452 -13.178
261 1HG GLU 34 2HG GLU 34 -1.576 3.601 -11.364
262 2HG GLU 34 1HG GLU 34 -2.447 4.830 -12.277
263 H ASN 35 H ASN 35 -1.201 3.793 -9.600
264 HA ASN 35 HA ASN 35 -1.538 5.809 -7.643
265 1HB ASN 35 2HB ASN 35 -3.293 5.895 -9.981
266 2HB ASN 35 1HB ASN 35 -4.155 5.885 -8.449
267 1HD2 ASN 35 1HD2 ASN 35 -3.585 7.527 -6.882
268 2HD2 ASN 35 2HD2 ASN 35 -3.031 9.066 -7.435
269 H GLY 36 H GLY 36 -2.954 3.011 -9.200
270 1HA GLY 36 2HA GLY 36 -3.092 1.525 -6.810
271 2HA GLY 36 1HA GLY 36 -4.669 2.220 -7.137
272 H ASN 37 H ASN 37 -5.252 1.947 -9.608
273 HA ASN 37 HA ASN 37 -5.878 -0.690 -10.027
274 1HB ASN 37 2HB ASN 37 -5.679 1.650 -11.889
275 2HB ASN 37 1HB ASN 37 -6.117 0.057 -12.499
276 1HD2 ASN 37 1HD2 ASN 37 -7.726 -0.980 -10.663
277 2HD2 ASN 37 2HD2 ASN 37 -9.129 -0.001 -10.417
278 H GLU 38 H GLU 38 -2.960 1.012 -10.988
279 HA GLU 38 HA GLU 38 -1.990 -0.842 -12.831
280 1HB GLU 38 2HB GLU 38 -1.048 1.501 -11.768
281 2HB GLU 38 1HB GLU 38 0.079 0.318 -11.135
282 1HG GLU 38 2HG GLU 38 -0.358 -0.225 -13.894
283 2HG GLU 38 1HG GLU 38 0.031 1.481 -13.699
284 H VAL 39 H VAL 39 -1.408 -0.743 -9.260
285 HA VAL 39 HA VAL 39 0.175 -3.090 -9.253
286 HB VAL 39 HB VAL 39 -1.609 -2.320 -6.952
287 1HG1 VAL 39 1HG1 VAL 39 1.128 -3.154 -6.430
288 2HG1 VAL 39 2HG1 VAL 39 0.203 -4.368 -7.309
289 3HG1 VAL 39 3HG1 VAL 39 -0.384 -3.761 -5.761
290 1HG2 VAL 39 1HG2 VAL 39 1.154 -1.243 -7.264
291 2HG2 VAL 39 2HG2 VAL 39 -0.153 -0.673 -6.237
292 3HG2 VAL 39 3HG2 VAL 39 -0.210 -0.387 -7.973
293 H LEU 40 H LEU 40 -3.296 -2.568 -9.008
294 HA LEU 40 HA LEU 40 -4.107 -5.132 -8.298
295 1HB LEU 40 2HB LEU 40 -5.645 -3.424 -10.231
296 2HB LEU 40 1HB LEU 40 -6.272 -4.525 -9.018
297 HG LEU 40 HG LEU 40 -4.989 -1.839 -8.511
298 1HD1 LEU 40 1HD1 LEU 40 -7.504 -1.978 -7.335
299 2HD1 LEU 40 2HD1 LEU 40 -7.708 -2.695 -8.934
300 3HD1 LEU 40 3HD1 LEU 40 -7.055 -1.067 -8.774
301 1HD2 LEU 40 1HD2 LEU 40 -5.332 -4.137 -6.781
302 2HD2 LEU 40 2HD2 LEU 40 -6.157 -2.713 -6.163
303 3HD2 LEU 40 3HD2 LEU 40 -4.430 -2.649 -6.509
304 H ALA 41 H ALA 41 -3.426 -3.752 -11.466
305 HA ALA 41 HA ALA 41 -4.140 -6.090 -12.931
306 1HB ALA 41 1HB ALA 41 -3.371 -4.957 -14.852
307 2HB ALA 41 2HB ALA 41 -2.334 -3.900 -13.894
308 3HB ALA 41 3HB ALA 41 -4.087 -3.723 -13.815
309 H ALA 42 H ALA 42 -1.069 -4.654 -11.985
310 HA ALA 42 HA ALA 42 0.594 -6.610 -13.141
311 1HB ALA 42 1HB ALA 42 2.383 -5.605 -12.012
312 2HB ALA 42 2HB ALA 42 1.359 -5.041 -10.691
313 3HB ALA 42 3HB ALA 42 1.243 -4.289 -12.284
314 H LEU 43 H LEU 43 -1.142 -6.505 -10.133
315 HA LEU 43 HA LEU 43 0.316 -8.518 -8.790
316 1HB LEU 43 2HB LEU 43 -2.319 -7.202 -8.421
317 2HB LEU 43 1HB LEU 43 -2.006 -8.690 -7.547
318 HG LEU 43 HG LEU 43 -0.048 -6.431 -7.406
319 1HD1 LEU 43 1HD1 LEU 43 -1.746 -6.376 -5.147
320 2HD1 LEU 43 2HD1 LEU 43 -2.755 -6.306 -6.587
321 3HD1 LEU 43 3HD1 LEU 43 -1.486 -5.121 -6.352
322 1HD2 LEU 43 1HD2 LEU 43 -0.127 -7.574 -4.981
323 2HD2 LEU 43 2HD2 LEU 43 0.912 -8.147 -6.285
324 3HD2 LEU 43 3HD2 LEU 43 -0.626 -8.947 -5.969
325 H ALA 44 H ALA 44 -2.144 -8.634 -11.197
326 HA ALA 44 HA ALA 44 -3.301 -11.106 -10.710
327 1HB ALA 44 1HB ALA 44 -3.186 -11.011 -13.453
328 2HB ALA 44 2HB ALA 44 -3.055 -9.314 -12.996
329 3HB ALA 44 3HB ALA 44 -4.431 -10.270 -12.447
330 H SER 45 H SER 45 -0.075 -10.399 -11.611
331 HA SER 45 HA SER 45 0.390 -13.222 -12.188
332 1HB SER 45 2HB SER 45 1.228 -10.822 -13.656
333 2HB SER 45 1HB SER 45 2.520 -11.990 -13.376
334 HG SER 45 HG SER 45 0.932 -13.580 -14.208
335 H LYS 46 H LYS 46 0.863 -10.931 -9.897
336 HA LYS 46 HA LYS 46 2.934 -12.437 -8.632
337 1HB LYS 46 2HB LYS 46 3.814 -10.403 -10.291
338 2HB LYS 46 1HB LYS 46 3.815 -9.659 -8.697
339 1HG LYS 46 2HG LYS 46 4.978 -12.163 -8.321
340 2HG LYS 46 1HG LYS 46 5.653 -11.558 -9.835
341 1HD LYS 46 2HD LYS 46 5.943 -9.343 -8.461
342 2HD LYS 46 1HD LYS 46 5.857 -10.434 -7.077
343 1HE LYS 46 2HE LYS 46 7.698 -11.021 -9.363
344 2HE LYS 46 1HE LYS 46 8.168 -9.868 -8.114
345 1HZ LYS 46 1HZ LYS 46 8.072 -12.729 -8.010
346 2HZ LYS 46 2HZ LYS 46 7.263 -12.014 -6.709
347 3HZ LYS 46 3HZ LYS 46 8.886 -11.639 -7.003
348 H THR 47 H THR 47 3.316 -11.785 -6.433
349 HA THR 47 HA THR 47 1.473 -9.813 -5.365
350 HB THR 47 HB THR 47 1.677 -12.656 -4.374
351 HG1 THR 47 1HG THR 47 0.259 -12.033 -6.226
352 1HG2 THR 47 1HG2 THR 47 -0.077 -10.497 -3.242
353 2HG2 THR 47 2HG2 THR 47 1.467 -10.970 -2.529
354 3HG2 THR 47 3HG2 THR 47 0.151 -12.140 -2.644
355 HA PRO 48 HA PRO 48 5.338 -9.009 -3.196
356 1HB PRO 48 2HB PRO 48 4.673 -6.579 -2.248
357 2HB PRO 48 1HB PRO 48 5.111 -6.829 -3.942
358 1HG PRO 48 2HG PRO 48 2.405 -6.538 -2.707
359 2HG PRO 48 1HG PRO 48 3.021 -5.870 -4.226
360 1HD PRO 48 2HD PRO 48 1.447 -8.106 -4.062
361 2HD PRO 48 1HD PRO 48 2.579 -7.780 -5.390
362 H ASP 49 H ASP 49 5.886 -8.548 -0.900
363 HA ASP 49 HA ASP 49 4.178 -10.044 0.833
364 1HB ASP 49 2HB ASP 49 6.654 -8.420 1.457
365 2HB ASP 49 1HB ASP 49 5.870 -9.541 2.566
366 H VAL 50 H VAL 50 4.523 -6.698 0.059
367 HA VAL 50 HA VAL 50 2.388 -6.050 1.940
368 HB VAL 50 HB VAL 50 4.417 -5.550 3.182
369 1HG1 VAL 50 1HG1 VAL 50 5.184 -3.572 1.078
370 2HG1 VAL 50 2HG1 VAL 50 5.752 -5.239 1.029
371 3HG1 VAL 50 3HG1 VAL 50 6.154 -4.207 2.402
372 1HG2 VAL 50 1HG2 VAL 50 3.385 -2.896 2.248
373 2HG2 VAL 50 2HG2 VAL 50 3.890 -3.386 3.865
374 3HG2 VAL 50 3HG2 VAL 50 2.379 -3.995 3.194
375 H LEU 51 H LEU 51 1.571 -3.716 1.473
376 HA LEU 51 HA LEU 51 2.169 -2.750 -1.191
377 1HB LEU 51 2HB LEU 51 0.425 -4.624 -1.336
378 2HB LEU 51 1HB LEU 51 -0.678 -3.504 -0.565
379 HG LEU 51 HG LEU 51 -0.533 -1.984 -2.446
380 1HD1 LEU 51 1HD1 LEU 51 1.154 -1.949 -3.891
381 2HD1 LEU 51 2HD1 LEU 51 0.924 -3.651 -4.295
382 3HD1 LEU 51 3HD1 LEU 51 1.929 -3.202 -2.921
383 1HD2 LEU 51 1HD2 LEU 51 -2.020 -4.094 -2.478
384 2HD2 LEU 51 2HD2 LEU 51 -0.885 -4.705 -3.678
385 3HD2 LEU 51 3HD2 LEU 51 -1.781 -3.220 -3.989
386 H LEU 52 H LEU 52 2.266 -0.621 -1.076
387 HA LEU 52 HA LEU 52 0.701 0.790 0.976
388 1HB LEU 52 2HB LEU 52 3.416 0.944 0.175
389 2HB LEU 52 1HB LEU 52 2.663 2.450 -0.302
390 HG LEU 52 HG LEU 52 2.363 1.396 2.488
391 1HD1 LEU 52 1HD1 LEU 52 4.323 3.400 2.478
392 2HD1 LEU 52 2HD1 LEU 52 4.797 2.237 1.242
393 3HD1 LEU 52 3HD1 LEU 52 4.515 1.699 2.895
394 1HD2 LEU 52 1HD2 LEU 52 2.085 4.070 1.150
395 2HD2 LEU 52 2HD2 LEU 52 2.225 3.902 2.899
396 3HD2 LEU 52 3HD2 LEU 52 0.871 3.161 2.047
397 H SER 53 H SER 53 -1.006 1.946 0.300
398 HA SER 53 HA SER 53 -1.073 2.769 -2.524
399 1HB SER 53 2HB SER 53 -3.275 1.929 -0.655
400 2HB SER 53 1HB SER 53 -3.599 2.782 -2.162
401 HG SER 53 HG SER 53 -2.467 1.073 -3.238
402 H ASP 54 H ASP 54 -1.510 4.817 -3.085
403 HA ASP 54 HA ASP 54 -1.231 6.846 -1.071
404 1HB ASP 54 2HB ASP 54 -1.169 8.409 -2.913
405 2HB ASP 54 1HB ASP 54 -0.186 7.007 -3.326
406 H ILE 55 H ILE 55 -3.868 5.204 -2.398
407 HA ILE 55 HA ILE 55 -6.110 5.519 -2.430
408 HB ILE 55 HB ILE 55 -5.778 5.373 -0.040
409 1HG1 ILE 55 2HG1 ILE 55 -7.843 7.401 -0.885
410 2HG1 ILE 55 1HG1 ILE 55 -8.047 5.659 -0.742
411 1HG2 ILE 55 1HG2 ILE 55 -5.764 7.510 1.314
412 2HG2 ILE 55 2HG2 ILE 55 -5.328 8.335 -0.177
413 3HG2 ILE 55 3HG2 ILE 55 -4.268 7.093 0.483
414 1HD1 ILE 55 1HD1 ILE 55 -7.526 5.970 1.725
415 2HD1 ILE 55 2HD1 ILE 55 -9.088 6.533 1.150
416 3HD1 ILE 55 3HD1 ILE 55 -7.792 7.687 1.444
417 H ARG 56 H ARG 56 -6.091 6.698 -4.384
418 HA ARG 56 HA ARG 56 -7.619 9.005 -4.398
419 1HB ARG 56 2HB ARG 56 -6.007 10.726 -5.113
420 2HB ARG 56 1HB ARG 56 -5.686 10.174 -3.475
421 1HG ARG 56 2HG ARG 56 -4.120 8.510 -5.001
422 2HG ARG 56 1HG ARG 56 -4.016 10.051 -5.852
423 1HD ARG 56 2HD ARG 56 -3.387 9.532 -2.954
424 2HD ARG 56 1HD ARG 56 -2.241 9.914 -4.231
425 HE ARG 56 HE ARG 56 -3.206 12.135 -4.320
426 1HH1 ARG 56 1HH1 ARG 56 -4.029 10.221 -1.506
427 2HH1 ARG 56 2HH1 ARG 56 -4.391 11.602 -0.529
428 1HH2 ARG 56 1HH2 ARG 56 -3.685 13.936 -3.027
429 2HH2 ARG 56 2HH2 ARG 56 -4.199 13.705 -1.389
430 H MET 57 H MET 57 -8.240 9.590 -6.476
431 HA MET 57 HA MET 57 -8.152 9.713 -8.783
432 1HB MET 57 2HB MET 57 -5.731 8.991 -8.580
433 2HB MET 57 1HB MET 57 -6.310 7.356 -8.872
434 1HG MET 57 2HG MET 57 -7.363 8.204 -10.976
435 2HG MET 57 1HG MET 57 -6.524 9.728 -10.702
436 1HE MET 57 1HE MET 57 -4.600 9.090 -13.411
437 2HE MET 57 2HE MET 57 -6.326 8.892 -13.116
438 3HE MET 57 3HE MET 57 -5.360 7.516 -13.647
439 HA PRO 58 HA PRO 58 -9.797 5.222 -9.708
440 1HB PRO 58 2HB PRO 58 -10.419 3.765 -7.457
441 2HB PRO 58 1HB PRO 58 -8.961 3.534 -8.425
442 1HG PRO 58 2HG PRO 58 -9.331 5.110 -5.904
443 2HG PRO 58 1HG PRO 58 -8.009 4.008 -6.353
444 1HD PRO 58 2HD PRO 58 -7.699 6.637 -6.528
445 2HD PRO 58 1HD PRO 58 -7.028 5.580 -7.783
446 H GLY 59 H GLY 59 -12.051 4.268 -9.227
447 1HA GLY 59 2HA GLY 59 -13.994 6.161 -9.283
448 2HA GLY 59 1HA GLY 59 -14.280 4.542 -8.667
449 H MET 60 H MET 60 -13.731 4.196 -6.361
450 HA MET 60 HA MET 60 -14.999 6.151 -4.734
451 1HB MET 60 2HB MET 60 -14.579 3.476 -4.512
452 2HB MET 60 1HB MET 60 -13.351 4.082 -3.412
453 1HG MET 60 2HG MET 60 -16.023 5.270 -3.107
454 2HG MET 60 1HG MET 60 -15.893 3.557 -2.708
455 1HE MET 60 1HE MET 60 -16.449 3.544 -0.522
456 2HE MET 60 2HE MET 60 -16.627 5.206 0.038
457 3HE MET 60 3HE MET 60 -15.504 4.117 0.850
458 H ASP 61 H ASP 61 -13.161 7.668 -5.784
459 HA ASP 61 HA ASP 61 -11.444 9.095 -5.434
460 1HB ASP 61 2HB ASP 61 -12.592 8.538 -2.812
461 2HB ASP 61 1HB ASP 61 -10.897 9.005 -2.713
462 H GLY 62 H GLY 62 -10.647 6.923 -2.759
463 1HA GLY 62 2HA GLY 62 -8.306 5.997 -4.278
464 2HA GLY 62 1HA GLY 62 -8.096 6.690 -2.683
465 H LEU 63 H LEU 63 -10.497 5.479 -1.545
466 HA LEU 63 HA LEU 63 -9.332 3.072 -0.700
467 1HB LEU 63 2HB LEU 63 -12.194 3.970 -0.434
468 2HB LEU 63 1HB LEU 63 -11.506 2.578 0.381
469 HG LEU 63 HG LEU 63 -9.780 4.455 1.210
470 1HD1 LEU 63 1HD1 LEU 63 -12.347 5.897 0.632
471 2HD1 LEU 63 2HD1 LEU 63 -10.713 6.329 0.139
472 3HD1 LEU 63 3HD1 LEU 63 -11.184 6.455 1.833
473 1HD2 LEU 63 1HD2 LEU 63 -12.462 4.042 2.507
474 2HD2 LEU 63 2HD2 LEU 63 -10.937 4.445 3.291
475 3HD2 LEU 63 3HD2 LEU 63 -11.157 2.860 2.549
476 H ALA 64 H ALA 64 -11.091 3.813 -3.501
477 HA ALA 64 HA ALA 64 -12.506 1.506 -4.053
478 1HB ALA 64 1HB ALA 64 -12.028 2.059 -6.465
479 2HB ALA 64 2HB ALA 64 -11.019 3.374 -5.863
480 3HB ALA 64 3HB ALA 64 -12.737 3.345 -5.496
481 H LEU 65 H LEU 65 -9.100 2.208 -4.776
482 HA LEU 65 HA LEU 65 -8.415 -0.106 -6.101
483 1HB LEU 65 2HB LEU 65 -6.120 0.301 -5.374
484 2HB LEU 65 1HB LEU 65 -6.902 1.783 -5.885
485 HG LEU 65 HG LEU 65 -7.389 1.948 -3.259
486 1HD1 LEU 65 1HD1 LEU 65 -6.141 -0.267 -3.006
487 2HD1 LEU 65 2HD1 LEU 65 -5.720 1.047 -1.911
488 3HD1 LEU 65 3HD1 LEU 65 -4.683 0.677 -3.287
489 1HD2 LEU 65 1HD2 LEU 65 -4.739 2.887 -3.561
490 2HD2 LEU 65 2HD2 LEU 65 -6.237 3.807 -3.664
491 3HD2 LEU 65 3HD2 LEU 65 -5.545 3.083 -5.113
492 H LEU 66 H LEU 66 -8.664 0.430 -2.617
493 HA LEU 66 HA LEU 66 -7.541 -1.970 -1.745
494 1HB LEU 66 2HB LEU 66 -9.671 -0.218 -0.550
495 2HB LEU 66 1HB LEU 66 -9.093 -1.660 0.260
496 HG LEU 66 HG LEU 66 -6.737 -0.478 -0.179
497 1HD1 LEU 66 1HD1 LEU 66 -6.776 1.722 -0.554
498 2HD1 LEU 66 2HD1 LEU 66 -8.105 1.980 0.571
499 3HD1 LEU 66 3HD1 LEU 66 -8.437 1.471 -1.082
500 1HD2 LEU 66 1HD2 LEU 66 -7.228 -1.120 1.991
501 2HD2 LEU 66 2HD2 LEU 66 -8.707 -0.161 2.049
502 3HD2 LEU 66 3HD2 LEU 66 -7.138 0.635 2.123
503 H LYS 67 H LYS 67 -10.915 -1.203 -2.538
504 HA LYS 67 HA LYS 67 -12.095 -3.620 -1.950
505 1HB LYS 67 2HB LYS 67 -12.656 -1.728 -4.234
506 2HB LYS 67 1HB LYS 67 -13.681 -3.101 -3.846
507 1HG LYS 67 2HG LYS 67 -14.744 -1.936 -2.298
508 2HG LYS 67 1HG LYS 67 -13.226 -1.567 -1.477
509 1HD LYS 67 2HD LYS 67 -13.175 0.520 -2.294
510 2HD LYS 67 1HD LYS 67 -13.615 -0.018 -3.917
511 1HE LYS 67 2HE LYS 67 -15.637 0.125 -1.706
512 2HE LYS 67 1HE LYS 67 -15.235 1.538 -2.682
513 1HZ LYS 67 1HZ LYS 67 -17.130 -0.232 -3.322
514 2HZ LYS 67 2HZ LYS 67 -15.822 -0.869 -4.181
515 3HZ LYS 67 3HZ LYS 67 -16.316 0.725 -4.455
516 H GLN 68 H GLN 68 -10.361 -2.685 -4.904
517 HA GLN 68 HA GLN 68 -10.755 -5.126 -6.272
518 1HB GLN 68 2HB GLN 68 -8.452 -3.200 -6.584
519 2HB GLN 68 1HB GLN 68 -8.980 -4.392 -7.760
520 1HG GLN 68 2HG GLN 68 -10.632 -2.051 -6.838
521 2HG GLN 68 1HG GLN 68 -9.658 -2.079 -8.308
522 1HE2 GLN 68 1HE2 GLN 68 -10.393 -3.144 -10.084
523 2HE2 GLN 68 2HE2 GLN 68 -11.964 -3.857 -10.192
524 H ILE 69 H ILE 69 -8.564 -4.109 -3.791
525 HA ILE 69 HA ILE 69 -6.531 -6.012 -4.132
526 HB ILE 69 HB ILE 69 -7.446 -4.521 -1.681
527 1HG1 ILE 69 2HG1 ILE 69 -4.980 -4.179 -3.373
528 2HG1 ILE 69 1HG1 ILE 69 -6.439 -3.229 -3.585
529 1HG2 ILE 69 1HG2 ILE 69 -5.351 -6.593 -1.985
530 2HG2 ILE 69 2HG2 ILE 69 -6.393 -6.236 -0.613
531 3HG2 ILE 69 3HG2 ILE 69 -5.001 -5.208 -0.959
532 1HD1 ILE 69 1HD1 ILE 69 -4.282 -2.977 -1.662
533 2HD1 ILE 69 2HD1 ILE 69 -5.879 -2.946 -0.918
534 3HD1 ILE 69 3HD1 ILE 69 -5.477 -1.796 -2.187
535 H LYS 70 H LYS 70 -9.540 -6.113 -2.339
536 HA LYS 70 HA LYS 70 -9.004 -8.639 -1.141
537 1HB LYS 70 2HB LYS 70 -11.210 -8.558 -0.266
538 2HB LYS 70 1HB LYS 70 -10.588 -6.917 -0.218
539 1HG LYS 70 2HG LYS 70 -11.807 -6.578 -2.424
540 2HG LYS 70 1HG LYS 70 -12.641 -8.083 -2.055
541 1HD LYS 70 2HD LYS 70 -13.739 -7.181 -0.236
542 2HD LYS 70 1HD LYS 70 -12.520 -5.930 0.009
543 1HE LYS 70 2HE LYS 70 -14.342 -4.753 -0.834
544 2HE LYS 70 1HE LYS 70 -13.320 -4.999 -2.248
545 1HZ LYS 70 1HZ LYS 70 -15.942 -5.601 -2.111
546 2HZ LYS 70 2HZ LYS 70 -15.233 -7.106 -1.810
547 3HZ LYS 70 3HZ LYS 70 -14.855 -6.264 -3.227
548 H GLN 71 H GLN 71 -10.377 -7.579 -4.119
549 HA GLN 71 HA GLN 71 -11.546 -10.133 -4.710
550 1HB GLN 71 2HB GLN 71 -11.324 -7.563 -6.246
551 2HB GLN 71 1HB GLN 71 -11.967 -9.029 -6.976
552 1HG GLN 71 2HG GLN 71 -13.863 -9.010 -5.675
553 2HG GLN 71 1HG GLN 71 -13.108 -8.053 -4.402
554 1HE2 GLN 71 1HE2 GLN 71 -12.583 -5.804 -4.965
555 2HE2 GLN 71 2HE2 GLN 71 -13.670 -4.940 -5.994
556 H ARG 72 H ARG 72 -8.667 -8.359 -5.561
557 HA ARG 72 HA ARG 72 -7.858 -10.542 -7.345
558 1HB ARG 72 2HB ARG 72 -7.238 -7.643 -7.256
559 2HB ARG 72 1HB ARG 72 -5.969 -8.719 -7.832
560 1HG ARG 72 2HG ARG 72 -7.175 -7.934 -9.719
561 2HG ARG 72 1HG ARG 72 -7.592 -9.632 -9.486
562 1HD ARG 72 2HD ARG 72 -9.543 -8.513 -8.040
563 2HD ARG 72 1HD ARG 72 -9.255 -7.200 -9.182
564 HE ARG 72 HE ARG 72 -9.602 -9.844 -10.329
565 1HH1 ARG 72 1HH1 ARG 72 -11.095 -6.802 -9.483
566 2HH1 ARG 72 2HH1 ARG 72 -12.404 -6.996 -10.599
567 1HH2 ARG 72 1HH2 ARG 72 -11.326 -10.104 -11.783
568 2HH2 ARG 72 2HH2 ARG 72 -12.540 -8.873 -11.900
569 H HIS 73 H HIS 73 -6.829 -8.750 -4.523
570 HA HIS 73 HA HIS 73 -4.424 -10.412 -4.338
571 1HB HIS 73 2HB HIS 73 -5.011 -8.257 -2.354
572 2HB HIS 73 1HB HIS 73 -3.461 -8.813 -2.971
573 HD1 HIS 73 1HD HIS 73 -3.860 -5.843 -2.934
574 HD2 HIS 73 2HD HIS 73 -4.987 -8.192 -6.148
575 HE1 HIS 73 1HE HIS 73 -3.994 -4.284 -4.906
576 HE2 HIS 73 2HE HIS 73 -4.693 -5.743 -6.828
577 HA PRO 74 HA PRO 74 -6.436 -12.722 -1.105
578 1HB PRO 74 2HB PRO 74 -4.573 -14.592 -0.775
579 2HB PRO 74 1HB PRO 74 -5.487 -14.480 -2.286
580 1HG PRO 74 2HG PRO 74 -2.685 -13.687 -1.709
581 2HG PRO 74 1HG PRO 74 -3.399 -14.278 -3.218
582 1HD PRO 74 2HD PRO 74 -2.878 -11.576 -2.497
583 2HD PRO 74 1HD PRO 74 -3.739 -12.157 -3.934
584 H MET 75 H MET 75 -6.484 -11.397 0.687
585 HA MET 75 HA MET 75 -5.917 -10.530 2.706
586 1HB MET 75 2HB MET 75 -4.455 -13.132 2.609
587 2HB MET 75 1HB MET 75 -4.414 -12.120 4.046
588 1HG MET 75 2HG MET 75 -7.085 -12.245 3.498
589 2HG MET 75 1HG MET 75 -6.526 -13.841 2.997
590 1HE MET 75 1HE MET 75 -8.122 -12.872 6.712
591 2HE MET 75 2HE MET 75 -8.450 -14.372 5.843
592 3HE MET 75 3HE MET 75 -8.536 -12.825 4.999
593 H LEU 76 H LEU 76 -4.237 -9.796 0.355
594 HA LEU 76 HA LEU 76 -1.549 -9.541 1.216
595 1HB LEU 76 2HB LEU 76 -2.127 -9.474 -1.139
596 2HB LEU 76 1HB LEU 76 -3.101 -8.037 -0.887
597 HG LEU 76 HG LEU 76 -0.863 -6.981 -0.056
598 1HD1 LEU 76 1HD1 LEU 76 0.051 -9.404 -1.574
599 2HD1 LEU 76 2HD1 LEU 76 0.565 -8.841 0.016
600 3HD1 LEU 76 3HD1 LEU 76 1.043 -7.954 -1.429
601 1HD2 LEU 76 1HD2 LEU 76 -0.852 -7.459 -2.987
602 2HD2 LEU 76 2HD2 LEU 76 -0.697 -5.954 -2.083
603 3HD2 LEU 76 3HD2 LEU 76 -2.278 -6.707 -2.274
604 HA PRO 77 HA PRO 77 -2.407 -6.330 4.276
605 1HB PRO 77 2HB PRO 77 0.562 -6.147 4.122
606 2HB PRO 77 1HB PRO 77 -0.485 -6.280 5.541
607 1HG PRO 77 2HG PRO 77 0.905 -8.382 4.707
608 2HG PRO 77 1HG PRO 77 -0.761 -8.575 5.284
609 1HD PRO 77 2HD PRO 77 0.284 -8.553 2.480
610 2HD PRO 77 1HD PRO 77 -0.989 -9.560 3.200
611 H VAL 78 H VAL 78 -2.989 -4.341 3.746
612 HA VAL 78 HA VAL 78 -1.399 -2.876 1.749
613 HB VAL 78 HB VAL 78 -4.300 -2.310 2.297
614 1HG1 VAL 78 1HG1 VAL 78 -2.237 -1.373 0.439
615 2HG1 VAL 78 2HG1 VAL 78 -3.690 -0.569 1.025
616 3HG1 VAL 78 3HG1 VAL 78 -3.797 -1.715 -0.306
617 1HG2 VAL 78 1HG2 VAL 78 -4.991 -3.736 0.541
618 2HG2 VAL 78 2HG2 VAL 78 -3.958 -4.708 1.585
619 3HG2 VAL 78 3HG2 VAL 78 -3.329 -4.076 0.062
620 H ILE 79 H ILE 79 -1.060 -0.665 2.079
621 HA ILE 79 HA ILE 79 -1.777 0.352 4.748
622 HB ILE 79 HB ILE 79 0.844 0.923 3.379
623 1HG1 ILE 79 2HG1 ILE 79 1.107 -0.644 5.778
624 2HG1 ILE 79 1HG1 ILE 79 0.058 -1.482 4.641
625 1HG2 ILE 79 1HG2 ILE 79 -0.499 2.142 5.526
626 2HG2 ILE 79 2HG2 ILE 79 1.153 2.431 4.974
627 3HG2 ILE 79 3HG2 ILE 79 0.839 1.224 6.220
628 1HD1 ILE 79 1HD1 ILE 79 1.741 -1.588 3.012
629 2HD1 ILE 79 2HD1 ILE 79 2.526 -2.005 4.534
630 3HD1 ILE 79 3HD1 ILE 79 2.736 -0.396 3.846
631 H ILE 80 H ILE 80 -3.099 2.026 4.487
632 HA ILE 80 HA ILE 80 -2.863 3.647 2.064
633 HB ILE 80 HB ILE 80 -5.106 3.808 4.068
634 1HG1 ILE 80 2HG1 ILE 80 -4.910 1.475 3.368
635 2HG1 ILE 80 1HG1 ILE 80 -6.322 2.219 2.630
636 1HG2 ILE 80 1HG2 ILE 80 -6.021 5.240 2.657
637 2HG2 ILE 80 2HG2 ILE 80 -5.737 4.179 1.283
638 3HG2 ILE 80 3HG2 ILE 80 -4.478 5.293 1.814
639 1HD1 ILE 80 1HD1 ILE 80 -3.790 1.316 1.379
640 2HD1 ILE 80 2HD1 ILE 80 -4.671 2.658 0.651
641 3HD1 ILE 80 3HD1 ILE 80 -5.458 1.091 0.850
642 H MET 81 H MET 81 -2.609 5.840 2.072
643 HA MET 81 HA MET 81 -1.307 6.937 4.413
644 1HB MET 81 2HB MET 81 -0.773 8.828 2.924
645 2HB MET 81 1HB MET 81 -0.287 7.280 2.243
646 1HG MET 81 2HG MET 81 -2.155 7.275 0.752
647 2HG MET 81 1HG MET 81 -2.838 8.701 1.529
648 1HE MET 81 1HE MET 81 -2.403 11.190 0.270
649 2HE MET 81 2HE MET 81 -0.697 11.596 0.457
650 3HE MET 81 3HE MET 81 -1.577 10.850 1.791
651 H THR 82 H THR 82 -4.210 7.577 2.505
652 HA THR 82 HA THR 82 -5.097 9.450 4.605
653 HB THR 82 HB THR 82 -6.026 9.589 1.742
654 HG1 THR 82 1HG THR 82 -4.002 11.300 2.626
655 1HG2 THR 82 1HG2 THR 82 -6.782 10.999 3.993
656 2HG2 THR 82 2HG2 THR 82 -7.077 11.455 2.318
657 3HG2 THR 82 3HG2 THR 82 -5.667 12.080 3.164
658 H ALA 83 H ALA 83 -7.564 9.611 4.695
659 HA ALA 83 HA ALA 83 -8.870 7.111 3.891
660 1HB ALA 83 1HB ALA 83 -9.592 6.526 5.993
661 2HB ALA 83 2HB ALA 83 -9.382 8.155 6.637
662 3HB ALA 83 3HB ALA 83 -7.973 7.140 6.327
663 H HIS 84 H HIS 84 -9.102 10.466 4.786
664 HA HIS 84 HA HIS 84 -10.834 11.964 4.856
665 1HB HIS 84 2HB HIS 84 -12.070 11.888 2.523
666 2HB HIS 84 1HB HIS 84 -10.388 12.372 2.647
667 HD1 HIS 84 1HD HIS 84 -8.634 10.809 1.643
668 HD2 HIS 84 2HD HIS 84 -12.524 9.423 1.271
669 HE1 HIS 84 1HE HIS 84 -8.508 8.907 0.021
670 HE2 HIS 84 2HE HIS 84 -10.900 8.197 -0.328
671 H SER 85 H SER 85 -13.382 11.899 3.560
672 HA SER 85 HA SER 85 -14.841 10.439 5.567
673 1HB SER 85 2HB SER 85 -15.474 12.736 4.902
674 2HB SER 85 1HB SER 85 -15.880 12.140 3.293
675 HG SER 85 HG SER 85 -17.421 12.191 5.432
676 H ASP 86 H ASP 86 -13.540 8.626 3.871
677 HA ASP 86 HA ASP 86 -15.872 7.326 2.650
678 1HB ASP 86 2HB ASP 86 -13.138 7.661 1.427
679 2HB ASP 86 1HB ASP 86 -14.249 6.402 0.908
680 H LEU 87 H LEU 87 -14.096 7.132 5.172
681 HA LEU 87 HA LEU 87 -12.560 4.898 5.304
682 1HB LEU 87 2HB LEU 87 -14.048 6.500 7.152
683 2HB LEU 87 1HB LEU 87 -14.175 4.815 7.621
684 HG LEU 87 HG LEU 87 -11.571 6.265 7.145
685 1HD1 LEU 87 1HD1 LEU 87 -12.963 5.578 9.729
686 2HD1 LEU 87 2HD1 LEU 87 -12.728 7.194 9.066
687 3HD1 LEU 87 3HD1 LEU 87 -11.336 6.242 9.581
688 1HD2 LEU 87 1HD2 LEU 87 -10.853 4.144 6.953
689 2HD2 LEU 87 2HD2 LEU 87 -12.305 3.474 7.699
690 3HD2 LEU 87 3HD2 LEU 87 -11.012 4.126 8.708
691 H ASP 88 H ASP 88 -15.946 4.965 4.689
692 HA ASP 88 HA ASP 88 -16.870 2.557 5.602
693 1HB ASP 88 2HB ASP 88 -17.441 3.890 2.950
694 2HB ASP 88 1HB ASP 88 -18.373 2.542 3.598
695 H ALA 89 H ALA 89 -15.170 3.110 2.515
696 HA ALA 89 HA ALA 89 -15.108 0.357 1.818
697 1HB ALA 89 1HB ALA 89 -13.277 1.194 0.197
698 2HB ALA 89 2HB ALA 89 -13.740 2.800 0.764
699 3HB ALA 89 3HB ALA 89 -14.932 1.763 -0.019
700 H ALA 90 H ALA 90 -13.202 2.333 3.875
701 HA ALA 90 HA ALA 90 -10.748 0.950 3.772
702 1HB ALA 90 1HB ALA 90 -11.089 3.192 4.811
703 2HB ALA 90 2HB ALA 90 -10.200 2.059 5.829
704 3HB ALA 90 3HB ALA 90 -11.898 2.390 6.155
705 H VAL 91 H VAL 91 -13.735 0.380 5.516
706 HA VAL 91 HA VAL 91 -12.699 -1.500 7.340
707 HB VAL 91 HB VAL 91 -15.541 -1.592 6.394
708 1HG1 VAL 91 1HG1 VAL 91 -15.383 -3.245 7.931
709 2HG1 VAL 91 2HG1 VAL 91 -15.564 -1.908 9.069
710 3HG1 VAL 91 3HG1 VAL 91 -13.955 -2.539 8.697
711 1HG2 VAL 91 1HG2 VAL 91 -16.085 0.133 8.041
712 2HG2 VAL 91 2HG2 VAL 91 -14.996 0.769 6.810
713 3HG2 VAL 91 3HG2 VAL 91 -14.371 0.339 8.403
714 H SER 92 H SER 92 -14.179 -1.889 4.137
715 HA SER 92 HA SER 92 -14.221 -4.698 4.139
716 1HB SER 92 2HB SER 92 -13.784 -2.934 1.718
717 2HB SER 92 1HB SER 92 -14.439 -4.571 1.739
718 HG SER 92 HG SER 92 -16.029 -2.852 1.594
719 H ALA 93 H ALA 93 -11.641 -2.469 3.964
720 HA ALA 93 HA ALA 93 -9.768 -4.128 2.623
721 1HB ALA 93 1HB ALA 93 -9.082 -1.844 4.412
722 2HB ALA 93 2HB ALA 93 -9.755 -1.600 2.798
723 3HB ALA 93 3HB ALA 93 -8.214 -2.433 2.995
724 H TYR 94 H TYR 94 -10.113 -3.127 5.996
725 HA TYR 94 HA TYR 94 -8.046 -4.676 7.043
726 1HB TYR 94 2HB TYR 94 -10.557 -4.251 8.627
727 2HB TYR 94 1HB TYR 94 -8.886 -4.228 9.176
728 HD1 TYR 94 1HD TYR 94 -11.631 -2.224 8.705
729 HD2 TYR 94 2HD TYR 94 -7.464 -2.312 7.836
730 HE1 TYR 94 1HE TYR 94 -11.615 0.233 8.542
731 HE2 TYR 94 2HE TYR 94 -7.437 0.133 7.670
732 HH TYR 94 HH TYR 94 -10.360 2.067 8.265
733 H GLN 95 H GLN 95 -11.316 -5.507 6.239
734 HA GLN 95 HA GLN 95 -11.247 -8.067 7.530
735 1HB GLN 95 2HB GLN 95 -13.410 -8.450 6.519
736 2HB GLN 95 1HB GLN 95 -13.344 -6.818 7.173
737 1HG GLN 95 2HG GLN 95 -14.341 -6.429 5.160
738 2HG GLN 95 1HG GLN 95 -12.648 -6.189 4.752
739 1HE2 GLN 95 1HE2 GLN 95 -13.848 -6.592 2.600
740 2HE2 GLN 95 2HE2 GLN 95 -13.819 -8.227 2.037
741 H GLN 96 H GLN 96 -10.510 -6.859 4.320
742 HA GLN 96 HA GLN 96 -10.332 -9.510 3.223
743 1HB GLN 96 2HB GLN 96 -9.582 -8.429 1.158
744 2HB GLN 96 1HB GLN 96 -11.070 -7.714 1.758
745 1HG GLN 96 2HG GLN 96 -9.935 -5.834 1.215
746 2HG GLN 96 1HG GLN 96 -9.398 -6.028 2.876
747 1HE2 GLN 96 1HE2 GLN 96 -7.771 -4.530 1.639
748 2HE2 GLN 96 2HE2 GLN 96 -6.350 -5.337 1.077
749 H GLY 97 H GLY 97 -8.261 -7.383 4.931
750 1HA GLY 97 2HA GLY 97 -6.278 -8.762 5.741
751 2HA GLY 97 1HA GLY 97 -5.911 -8.928 4.035
752 H ALA 98 H ALA 98 -7.128 -5.832 4.552
753 HA ALA 98 HA ALA 98 -4.716 -4.577 3.922
754 1HB ALA 98 1HB ALA 98 -6.595 -2.932 5.461
755 2HB ALA 98 2HB ALA 98 -7.281 -3.748 4.058
756 3HB ALA 98 3HB ALA 98 -5.901 -2.675 3.861
757 H PHE 99 H PHE 99 -3.430 -3.081 5.224
758 HA PHE 99 HA PHE 99 -2.806 -4.246 7.781
759 1HB PHE 99 2HB PHE 99 -1.057 -3.559 6.102
760 2HB PHE 99 1HB PHE 99 -1.463 -1.886 6.466
761 HD1 PHE 99 1HD PHE 99 -1.095 -4.829 8.711
762 HD2 PHE 99 2HD PHE 99 0.362 -0.995 7.571
763 HE1 PHE 99 1HE PHE 99 0.476 -4.868 10.604
764 HE2 PHE 99 2HE PHE 99 1.940 -1.027 9.458
765 HZ PHE 99 HZ PHE 99 1.998 -2.965 10.982
766 H ASP 100 H ASP 100 -3.577 -0.959 6.617
767 HA ASP 100 HA ASP 100 -5.361 -0.322 8.649
768 1HB ASP 100 2HB ASP 100 -2.915 -0.524 9.804
769 2HB ASP 100 1HB ASP 100 -2.903 1.175 9.343
770 H TYR 101 H TYR 101 -4.808 2.376 9.100
771 HA TYR 101 HA TYR 101 -4.534 3.565 6.435
772 1HB TYR 101 2HB TYR 101 -6.959 3.530 8.140
773 2HB TYR 101 1HB TYR 101 -6.547 5.086 7.426
774 HD1 TYR 101 1HD TYR 101 -7.434 1.583 6.658
775 HD2 TYR 101 2HD TYR 101 -6.870 5.510 5.133
776 HE1 TYR 101 1HE TYR 101 -8.504 0.911 4.547
777 HE2 TYR 101 2HE TYR 101 -7.927 4.845 3.028
778 HH TYR 101 HH TYR 101 -9.341 1.639 2.590
779 H LEU 102 H LEU 102 -3.981 5.807 6.463
780 HA LEU 102 HA LEU 102 -2.768 6.628 9.001
781 1HB LEU 102 2HB LEU 102 -1.967 6.792 6.223
782 2HB LEU 102 1HB LEU 102 -1.878 8.354 7.011
783 HG LEU 102 HG LEU 102 -0.406 7.439 8.722
784 1HD1 LEU 102 1HD1 LEU 102 -0.099 4.894 7.243
785 2HD1 LEU 102 2HD1 LEU 102 -1.500 5.062 8.300
786 3HD1 LEU 102 3HD1 LEU 102 0.128 5.242 8.956
787 1HD2 LEU 102 1HD2 LEU 102 0.836 6.425 6.241
788 2HD2 LEU 102 2HD2 LEU 102 1.460 7.549 7.448
789 3HD2 LEU 102 3HD2 LEU 102 0.293 8.103 6.242
790 HA PRO 103 HA PRO 103 -6.061 9.639 9.250
791 1HB PRO 103 2HB PRO 103 -5.053 10.990 11.414
792 2HB PRO 103 1HB PRO 103 -5.991 9.498 11.524
793 1HG PRO 103 2HG PRO 103 -3.043 9.902 11.703
794 2HG PRO 103 1HG PRO 103 -4.079 8.773 12.589
795 1HD PRO 103 2HD PRO 103 -2.513 8.035 10.488
796 2HD PRO 103 1HD PRO 103 -4.027 7.214 10.911
797 H LYS 104 H LYS 104 -3.110 11.243 10.385
798 HA LYS 104 HA LYS 104 -3.446 13.197 8.217
799 1HB LYS 104 2HB LYS 104 -3.065 13.528 11.092
800 2HB LYS 104 1HB LYS 104 -1.936 14.481 10.138
801 1HG LYS 104 2HG LYS 104 -3.558 15.821 9.293
802 2HG LYS 104 1HG LYS 104 -4.783 14.552 9.331
803 1HD LYS 104 2HD LYS 104 -5.490 16.014 10.992
804 2HD LYS 104 1HD LYS 104 -4.610 14.782 11.899
805 1HE LYS 104 2HE LYS 104 -3.111 17.155 10.921
806 2HE LYS 104 1HE LYS 104 -4.197 17.366 12.294
807 1HZ LYS 104 1HZ LYS 104 -2.504 15.052 12.513
808 2HZ LYS 104 2HZ LYS 104 -2.813 16.276 13.640
809 3HZ LYS 104 3HZ LYS 104 -1.640 16.506 12.443
810 HA PRO 105 HA PRO 105 1.393 12.868 8.852
811 1HB PRO 105 2HB PRO 105 2.138 10.538 10.164
812 2HB PRO 105 1HB PRO 105 2.106 12.150 10.885
813 1HG PRO 105 2HG PRO 105 0.078 9.962 11.039
814 2HG PRO 105 1HG PRO 105 0.620 11.083 12.302
815 1HD PRO 105 2HD PRO 105 -1.712 11.439 11.052
816 2HD PRO 105 1HD PRO 105 -0.697 12.823 11.496
817 H PHE 106 H PHE 106 2.919 11.534 7.671
818 HA PHE 106 HA PHE 106 2.233 9.020 6.590
819 1HB PHE 106 2HB PHE 106 0.595 10.185 5.269
820 2HB PHE 106 1HB PHE 106 1.766 11.413 4.798
821 HD1 PHE 106 1HD PHE 106 1.523 7.682 4.694
822 HD2 PHE 106 2HD PHE 106 2.502 11.273 2.634
823 HE1 PHE 106 1HE PHE 106 2.089 6.373 2.690
824 HE2 PHE 106 2HE PHE 106 3.070 9.972 0.625
825 HZ PHE 106 HZ PHE 106 2.865 7.518 0.651
826 H ASP 107 H ASP 107 3.683 11.271 4.360
827 HA ASP 107 HA ASP 107 5.761 11.179 3.407
828 1HB ASP 107 2HB ASP 107 7.372 12.232 4.725
829 2HB ASP 107 1HB ASP 107 5.864 12.718 5.488
830 H ILE 108 H ILE 108 8.201 10.253 3.997
831 HA ILE 108 HA ILE 108 7.882 7.458 3.709
832 HB ILE 108 HB ILE 108 10.003 9.314 3.361
833 1HG1 ILE 108 2HG1 ILE 108 10.856 7.513 1.903
834 2HG1 ILE 108 1HG1 ILE 108 9.666 6.418 2.596
835 1HG2 ILE 108 1HG2 ILE 108 11.048 8.568 5.359
836 2HG2 ILE 108 2HG2 ILE 108 11.877 7.776 4.019
837 3HG2 ILE 108 3HG2 ILE 108 10.700 6.882 4.979
838 1HD1 ILE 108 1HD1 ILE 108 7.892 7.476 1.560
839 2HD1 ILE 108 2HD1 ILE 108 9.163 7.525 0.336
840 3HD1 ILE 108 3HD1 ILE 108 8.805 8.962 1.294
841 H ASP 109 H ASP 109 8.901 9.460 6.371
842 HA ASP 109 HA ASP 109 9.858 7.561 8.122
843 1HB ASP 109 2HB ASP 109 8.296 10.082 8.687
844 2HB ASP 109 1HB ASP 109 9.016 9.099 9.957
845 H GLU 110 H GLU 110 6.467 8.735 8.078
846 HA GLU 110 HA GLU 110 5.618 6.641 9.803
847 1HB GLU 110 2HB GLU 110 4.104 8.707 8.228
848 2HB GLU 110 1HB GLU 110 3.295 7.482 9.186
849 1HG GLU 110 2HG GLU 110 5.367 8.922 10.643
850 2HG GLU 110 1HG GLU 110 4.060 9.951 10.056
851 H ALA 111 H ALA 111 5.699 7.111 6.355
852 HA ALA 111 HA ALA 111 3.924 4.993 5.702
853 1HB ALA 111 1HB ALA 111 4.447 6.826 4.144
854 2HB ALA 111 2HB ALA 111 4.723 5.238 3.431
855 3HB ALA 111 3HB ALA 111 6.090 6.203 3.987
856 H VAL 112 H VAL 112 7.478 5.202 5.346
857 HA VAL 112 HA VAL 112 7.889 2.484 4.855
858 HB VAL 112 HB VAL 112 9.790 4.354 6.268
859 1HG1 VAL 112 1HG1 VAL 112 11.001 2.367 4.574
860 2HG1 VAL 112 2HG1 VAL 112 9.955 1.603 5.774
861 3HG1 VAL 112 3HG1 VAL 112 11.254 2.680 6.292
862 1HG2 VAL 112 1HG2 VAL 112 10.681 4.199 3.710
863 2HG2 VAL 112 2HG2 VAL 112 9.657 5.493 4.329
864 3HG2 VAL 112 3HG2 VAL 112 8.935 4.139 3.462
865 H ALA 113 H ALA 113 7.413 4.240 7.799
866 HA ALA 113 HA ALA 113 8.320 2.278 9.613
867 1HB ALA 113 1HB ALA 113 6.156 4.327 10.067
868 2HB ALA 113 2HB ALA 113 7.883 4.659 10.192
869 3HB ALA 113 3HB ALA 113 7.126 3.515 11.296
870 H LEU 114 H LEU 114 5.122 3.083 8.351
871 HA LEU 114 HA LEU 114 3.795 0.944 9.648
872 1HB LEU 114 2HB LEU 114 2.867 3.178 8.725
873 2HB LEU 114 1HB LEU 114 2.757 2.321 7.200
874 HG LEU 114 HG LEU 114 1.277 0.646 8.273
875 1HD1 LEU 114 1HD1 LEU 114 1.935 2.264 10.661
876 2HD1 LEU 114 2HD1 LEU 114 1.619 0.536 10.513
877 3HD1 LEU 114 3HD1 LEU 114 0.277 1.680 10.515
878 1HD2 LEU 114 1HD2 LEU 114 -0.119 3.126 8.964
879 2HD2 LEU 114 2HD2 LEU 114 -0.530 1.880 7.785
880 3HD2 LEU 114 3HD2 LEU 114 0.635 3.135 7.370
881 H VAL 115 H VAL 115 5.620 1.142 6.717
882 HA VAL 115 HA VAL 115 4.326 -1.124 5.511
883 HB VAL 115 HB VAL 115 5.500 0.724 4.207
884 1HG1 VAL 115 1HG1 VAL 115 7.835 0.547 3.794
885 2HG1 VAL 115 2HG1 VAL 115 7.951 -0.940 4.734
886 3HG1 VAL 115 3HG1 VAL 115 7.615 0.588 5.537
887 1HG2 VAL 115 1HG2 VAL 115 4.962 -0.790 2.660
888 2HG2 VAL 115 2HG2 VAL 115 5.361 -2.135 3.727
889 3HG2 VAL 115 3HG2 VAL 115 6.628 -1.354 2.781
890 H GLU 116 H GLU 116 7.447 -0.566 7.097
891 HA GLU 116 HA GLU 116 8.358 -3.234 6.865
892 1HB GLU 116 2HB GLU 116 9.103 -0.975 8.720
893 2HB GLU 116 1HB GLU 116 9.906 -2.540 8.768
894 1HG GLU 116 2HG GLU 116 10.505 -2.234 6.375
895 2HG GLU 116 1HG GLU 116 9.829 -0.608 6.464
896 H ARG 117 H ARG 117 6.690 -1.486 9.468
897 HA ARG 117 HA ARG 117 6.674 -3.574 11.337
898 1HB ARG 117 2HB ARG 117 4.755 -1.277 10.936
899 2HB ARG 117 1HB ARG 117 4.691 -2.368 12.314
900 1HG ARG 117 2HG ARG 117 7.313 -1.567 12.308
901 2HG ARG 117 1HG ARG 117 6.456 -0.114 11.796
902 1HD ARG 117 2HD ARG 117 5.901 0.273 13.905
903 2HD ARG 117 1HD ARG 117 4.972 -1.222 13.917
904 HE ARG 117 HE ARG 117 7.043 -2.344 14.650
905 1HH1 ARG 117 1HH1 ARG 117 6.754 1.112 15.131
906 2HH1 ARG 117 2HH1 ARG 117 7.892 1.143 16.432
907 1HH2 ARG 117 1HH2 ARG 117 8.535 -2.287 16.360
908 2HH2 ARG 117 2HH2 ARG 117 8.901 -0.780 17.130
909 H ALA 118 H ALA 118 4.830 -3.051 8.476
910 HA ALA 118 HA ALA 118 2.632 -4.735 9.109
911 1HB ALA 118 1HB ALA 118 2.157 -3.238 7.406
912 2HB ALA 118 2HB ALA 118 2.402 -4.747 6.531
913 3HB ALA 118 3HB ALA 118 3.684 -3.538 6.581
914 H ILE 119 H ILE 119 5.584 -5.197 7.188
915 HA ILE 119 HA ILE 119 5.068 -7.913 6.581
916 HB ILE 119 HB ILE 119 7.778 -6.603 6.689
917 1HG1 ILE 119 2HG1 ILE 119 6.331 -6.737 4.113
918 2HG1 ILE 119 1HG1 ILE 119 5.725 -5.556 5.271
919 1HG2 ILE 119 1HG2 ILE 119 8.231 -8.200 4.815
920 2HG2 ILE 119 2HG2 ILE 119 6.671 -8.949 5.161
921 3HG2 ILE 119 3HG2 ILE 119 7.944 -8.959 6.381
922 1HD1 ILE 119 1HD1 ILE 119 8.612 -5.736 4.478
923 2HD1 ILE 119 2HD1 ILE 119 7.797 -4.432 5.344
924 3HD1 ILE 119 3HD1 ILE 119 7.437 -4.721 3.643
925 H SER 120 H SER 120 6.600 -6.266 9.216
926 HA SER 120 HA SER 120 7.847 -8.566 10.347
927 1HB SER 120 2HB SER 120 8.276 -5.943 10.668
928 2HB SER 120 1HB SER 120 7.228 -6.218 12.059
929 HG SER 120 HG SER 120 8.833 -7.162 13.017
930 H HIS 121 H HIS 121 5.037 -6.593 11.326
931 HA HIS 121 HA HIS 121 4.240 -8.207 13.460
932 1HB HIS 121 2HB HIS 121 2.875 -6.173 11.760
933 2HB HIS 121 1HB HIS 121 1.890 -7.175 12.817
934 HD1 HIS 121 1HD HIS 121 4.275 -4.340 12.836
935 HD2 HIS 121 2HD HIS 121 2.332 -6.766 15.594
936 HE1 HIS 121 1HE HIS 121 4.547 -3.187 15.056
937 HE2 HIS 121 2HE HIS 121 3.291 -4.630 16.694
938 H TYR 122 H TYR 122 3.767 -8.566 10.054
939 HA TYR 122 HA TYR 122 1.629 -10.432 10.190
940 1HB TYR 122 2HB TYR 122 2.423 -9.001 8.179
941 2HB TYR 122 1HB TYR 122 3.581 -10.300 7.908
942 HD1 TYR 122 1HD TYR 122 -0.080 -9.907 8.582
943 HD2 TYR 122 2HD TYR 122 2.962 -11.937 6.408
944 HE1 TYR 122 1HE TYR 122 -1.802 -11.175 7.365
945 HE2 TYR 122 2HE TYR 122 1.250 -13.209 5.187
946 HH TYR 122 HH TYR 122 -1.163 -13.921 5.605
947 H GLN 123 H GLN 123 5.064 -10.890 9.338
948 HA GLN 123 HA GLN 123 6.441 -12.695 9.497
949 1HB GLN 123 2HB GLN 123 5.663 -12.188 11.966
950 2HB GLN 123 1HB GLN 123 4.855 -13.741 11.805
951 1HG GLN 123 2HG GLN 123 6.805 -14.911 11.757
952 2HG GLN 123 1HG GLN 123 7.712 -13.585 11.029
953 1HE2 GLN 123 1HE2 GLN 123 8.224 -11.757 12.415
954 2HE2 GLN 123 2HE2 GLN 123 8.505 -12.032 14.097
955 H GLU 124 H GLU 124 6.417 -15.222 9.783
956 HA GLU 124 HA GLU 124 3.987 -16.338 8.573
957 1HB GLU 124 2HB GLU 124 5.650 -15.835 6.787
958 2HB GLU 124 1HB GLU 124 6.784 -16.918 7.583
959 1HG GLU 124 2HG GLU 124 5.812 -18.742 6.747
960 2HG GLU 124 1HG GLU 124 4.187 -18.133 7.056
Start of MODEL 6
1 1H MET 1 1HT MET 1 11.747 -17.526 0.301
2 2H MET 1 2HT MET 1 12.464 -18.773 1.237
3 3H MET 1 3HT MET 1 12.210 -17.220 1.924
4 HA MET 1 HA MET 1 10.229 -19.256 1.186
5 1HB MET 1 2HB MET 1 11.388 -18.086 3.646
6 2HB MET 1 1HB MET 1 9.651 -18.359 3.678
7 1HG MET 1 2HG MET 1 9.862 -20.627 3.582
8 2HG MET 1 1HG MET 1 11.399 -20.559 2.723
9 1HE MET 1 1HE MET 1 11.319 -22.728 5.018
10 2HE MET 1 2HE MET 1 12.906 -22.336 5.679
11 3HE MET 1 3HE MET 1 12.630 -22.247 3.939
12 H GLN 2 H GLN 2 10.723 -15.866 2.079
13 HA GLN 2 HA GLN 2 8.000 -15.298 1.123
14 1HB GLN 2 2HB GLN 2 8.985 -14.774 3.626
15 2HB GLN 2 1HB GLN 2 9.260 -13.245 2.803
16 1HG GLN 2 2HG GLN 2 7.170 -12.859 3.573
17 2HG GLN 2 1HG GLN 2 6.754 -13.629 2.042
18 1HE2 GLN 2 1HE2 GLN 2 6.408 -15.996 2.138
19 2HE2 GLN 2 2HE2 GLN 2 5.626 -16.644 3.535
20 H ARG 3 H ARG 3 11.353 -14.401 1.055
21 HA ARG 3 HA ARG 3 12.598 -13.245 -0.448
22 1HB ARG 3 2HB ARG 3 11.319 -14.335 -2.191
23 2HB ARG 3 1HB ARG 3 10.028 -13.156 -2.030
24 1HG ARG 3 2HG ARG 3 11.269 -11.468 -3.029
25 2HG ARG 3 1HG ARG 3 12.801 -12.298 -2.746
26 1HD ARG 3 2HD ARG 3 12.198 -14.000 -4.371
27 2HD ARG 3 1HD ARG 3 10.632 -13.235 -4.619
28 HE ARG 3 HE ARG 3 11.933 -11.278 -5.471
29 1HH1 ARG 3 1HH1 ARG 3 13.308 -14.493 -5.576
30 2HH1 ARG 3 2HH1 ARG 3 14.327 -14.142 -6.927
31 1HH2 ARG 3 1HH2 ARG 3 13.273 -10.829 -7.251
32 2HH2 ARG 3 2HH2 ARG 3 14.307 -12.068 -7.878
33 H GLY 4 H GLY 4 9.950 -11.928 1.158
34 1HA GLY 4 2HA GLY 4 9.362 -9.801 1.763
35 2HA GLY 4 1HA GLY 4 11.081 -9.474 1.644
36 H ILE 5 H ILE 5 8.129 -9.683 -0.333
37 HA ILE 5 HA ILE 5 9.314 -7.717 -2.169
38 HB ILE 5 HB ILE 5 6.783 -9.268 -2.657
39 1HG1 ILE 5 2HG1 ILE 5 8.417 -10.585 -4.233
40 2HG1 ILE 5 1HG1 ILE 5 9.639 -10.049 -3.083
41 1HG2 ILE 5 1HG2 ILE 5 8.225 -7.212 -4.056
42 2HG2 ILE 5 2HG2 ILE 5 6.650 -7.919 -4.416
43 3HG2 ILE 5 3HG2 ILE 5 8.118 -8.669 -5.042
44 1HD1 ILE 5 1HD1 ILE 5 8.045 -12.298 -2.883
45 2HD1 ILE 5 2HD1 ILE 5 7.335 -11.155 -1.742
46 3HD1 ILE 5 3HD1 ILE 5 9.039 -11.587 -1.613
47 H VAL 6 H VAL 6 8.801 -5.686 -1.711
48 HA VAL 6 HA VAL 6 6.144 -5.132 -0.585
49 HB VAL 6 HB VAL 6 7.937 -4.249 0.815
50 1HG1 VAL 6 1HG1 VAL 6 9.436 -2.492 -0.074
51 2HG1 VAL 6 2HG1 VAL 6 8.834 -2.835 -1.684
52 3HG1 VAL 6 3HG1 VAL 6 9.713 -4.073 -0.791
53 1HG2 VAL 6 1HG2 VAL 6 6.827 -2.343 1.238
54 2HG2 VAL 6 2HG2 VAL 6 5.763 -2.871 -0.068
55 3HG2 VAL 6 3HG2 VAL 6 7.066 -1.727 -0.396
56 H TRP 7 H TRP 7 4.669 -4.181 -1.835
57 HA TRP 7 HA TRP 7 5.621 -2.826 -4.270
58 1HB TRP 7 2HB TRP 7 3.241 -4.590 -3.811
59 2HB TRP 7 1HB TRP 7 3.224 -3.392 -5.105
60 HD1 TRP 7 HD1 TRP 7 6.661 -4.650 -4.740
61 HE1 TRP 7 1HE TRP 7 7.199 -6.398 -6.540
62 HE3 TRP 7 3HE TRP 7 1.915 -5.584 -6.400
63 HZ2 TRP 7 2HZ TRP 7 5.795 -7.976 -8.415
64 HZ3 TRP 7 3HZ TRP 7 1.601 -7.227 -8.203
65 HH2 TRP 7 HH2 TRP 7 3.501 -8.398 -9.187
66 H VAL 8 H VAL 8 5.051 -0.790 -4.589
67 HA VAL 8 HA VAL 8 3.142 0.414 -2.693
68 HB VAL 8 HB VAL 8 5.551 1.706 -3.976
69 1HG1 VAL 8 1HG1 VAL 8 4.520 3.006 -1.622
70 2HG1 VAL 8 2HG1 VAL 8 3.284 2.889 -2.871
71 3HG1 VAL 8 3HG1 VAL 8 4.828 3.663 -3.228
72 1HG2 VAL 8 1HG2 VAL 8 6.508 1.643 -1.688
73 2HG2 VAL 8 2HG2 VAL 8 6.286 0.045 -2.401
74 3HG2 VAL 8 3HG2 VAL 8 5.147 0.638 -1.187
75 H VAL 9 H VAL 9 1.692 1.971 -3.463
76 HA VAL 9 HA VAL 9 1.636 2.360 -6.382
77 HB VAL 9 HB VAL 9 -1.025 2.481 -5.254
78 1HG1 VAL 9 1HG1 VAL 9 0.391 1.348 -7.543
79 2HG1 VAL 9 2HG1 VAL 9 -1.177 2.125 -7.462
80 3HG1 VAL 9 3HG1 VAL 9 -1.021 0.420 -7.054
81 1HG2 VAL 9 1HG2 VAL 9 -1.333 0.120 -4.728
82 2HG2 VAL 9 2HG2 VAL 9 -0.155 0.848 -3.634
83 3HG2 VAL 9 3HG2 VAL 9 0.389 -0.170 -4.966
84 H ASP 10 H ASP 10 1.846 4.440 -6.869
85 HA ASP 10 HA ASP 10 0.302 6.490 -5.589
86 1HB ASP 10 2HB ASP 10 2.627 5.917 -4.271
87 2HB ASP 10 1HB ASP 10 3.158 7.181 -5.375
88 H ASP 11 H ASP 11 1.978 8.670 -6.328
89 HA ASP 11 HA ASP 11 1.308 8.891 -9.064
90 1HB ASP 11 2HB ASP 11 1.906 10.669 -7.064
91 2HB ASP 11 1HB ASP 11 3.321 10.790 -8.105
92 H ASP 12 H ASP 12 3.770 7.128 -7.780
93 HA ASP 12 HA ASP 12 5.626 6.150 -8.658
94 1HB ASP 12 2HB ASP 12 3.966 6.370 -10.764
95 2HB ASP 12 1HB ASP 12 5.282 7.387 -11.336
96 H SER 13 H SER 13 7.370 7.157 -10.715
97 HA SER 13 HA SER 13 9.362 8.274 -10.618
98 1HB SER 13 2HB SER 13 7.513 9.533 -11.924
99 2HB SER 13 1HB SER 13 7.676 10.736 -10.649
100 HG SER 13 HG SER 13 9.168 10.521 -12.761
101 H SER 14 H SER 14 7.764 10.941 -9.019
102 HA SER 14 HA SER 14 9.840 11.381 -7.215
103 1HB SER 14 2HB SER 14 7.849 12.914 -7.946
104 2HB SER 14 1HB SER 14 7.035 12.206 -6.550
105 HG SER 14 HG SER 14 8.742 14.196 -6.552
106 H ILE 15 H ILE 15 6.632 9.951 -6.559
107 HA ILE 15 HA ILE 15 7.211 9.279 -3.886
108 HB ILE 15 HB ILE 15 5.220 7.850 -5.637
109 1HG1 ILE 15 2HG1 ILE 15 4.867 10.259 -5.862
110 2HG1 ILE 15 1HG1 ILE 15 3.575 9.538 -4.911
111 1HG2 ILE 15 1HG2 ILE 15 5.924 7.693 -2.870
112 2HG2 ILE 15 2HG2 ILE 15 4.746 6.744 -3.777
113 3HG2 ILE 15 3HG2 ILE 15 4.262 8.264 -3.024
114 1HD1 ILE 15 1HD1 ILE 15 5.924 10.722 -3.518
115 2HD1 ILE 15 2HD1 ILE 15 4.255 10.552 -2.973
116 3HD1 ILE 15 3HD1 ILE 15 4.673 11.775 -4.173
117 H ARG 16 H ARG 16 7.950 7.743 -6.881
118 HA ARG 16 HA ARG 16 8.413 5.138 -5.799
119 1HB ARG 16 2HB ARG 16 7.840 5.387 -8.142
120 2HB ARG 16 1HB ARG 16 9.260 6.386 -8.415
121 1HG ARG 16 2HG ARG 16 10.637 4.381 -7.704
122 2HG ARG 16 1HG ARG 16 9.148 3.442 -7.823
123 1HD ARG 16 2HD ARG 16 9.448 3.244 -10.014
124 2HD ARG 16 1HD ARG 16 9.398 4.999 -10.184
125 HE ARG 16 HE ARG 16 11.945 3.952 -9.327
126 1HH1 ARG 16 1HH1 ARG 16 9.953 4.798 -12.060
127 2HH1 ARG 16 2HH1 ARG 16 11.294 5.017 -13.133
128 1HH2 ARG 16 1HH2 ARG 16 13.718 4.231 -10.734
129 2HH2 ARG 16 2HH2 ARG 16 13.439 4.695 -12.379
130 H TRP 17 H TRP 17 10.591 7.714 -6.962
131 HA TRP 17 HA TRP 17 12.988 6.465 -6.314
132 1HB TRP 17 2HB TRP 17 12.847 8.493 -7.701
133 2HB TRP 17 1HB TRP 17 12.414 9.428 -6.272
134 HD1 TRP 17 HD1 TRP 17 15.387 7.523 -7.795
135 HE1 TRP 17 1HE TRP 17 17.549 8.385 -6.697
136 HE3 TRP 17 3HE TRP 17 13.334 10.587 -4.257
137 HZ2 TRP 17 2HZ TRP 17 18.287 10.131 -4.605
138 HZ3 TRP 17 3HZ TRP 17 14.835 11.817 -2.745
139 HH2 TRP 17 HH2 TRP 17 17.262 11.592 -2.917
140 H VAL 18 H VAL 18 10.897 8.499 -4.325
141 HA VAL 18 HA VAL 18 12.643 8.713 -2.131
142 HB VAL 18 HB VAL 18 9.639 8.801 -1.986
143 1HG1 VAL 18 1HG1 VAL 18 9.916 10.115 -0.048
144 2HG1 VAL 18 2HG1 VAL 18 11.638 10.341 -0.353
145 3HG1 VAL 18 3HG1 VAL 18 11.028 8.759 0.125
146 1HG2 VAL 18 1HG2 VAL 18 11.152 10.355 -3.670
147 2HG2 VAL 18 2HG2 VAL 18 11.018 11.360 -2.227
148 3HG2 VAL 18 3HG2 VAL 18 9.564 10.774 -3.033
149 H LEU 19 H LEU 19 9.944 6.538 -2.729
150 HA LEU 19 HA LEU 19 10.371 5.130 -0.284
151 1HB LEU 19 2HB LEU 19 8.240 5.433 -2.021
152 2HB LEU 19 1HB LEU 19 8.686 3.746 -2.184
153 HG LEU 19 HG LEU 19 8.381 3.376 0.189
154 1HD1 LEU 19 1HD1 LEU 19 7.994 6.351 0.273
155 2HD1 LEU 19 2HD1 LEU 19 9.093 5.353 1.223
156 3HD1 LEU 19 3HD1 LEU 19 7.357 5.297 1.533
157 1HD2 LEU 19 1HD2 LEU 19 6.097 3.321 0.167
158 2HD2 LEU 19 2HD2 LEU 19 6.408 3.609 -1.546
159 3HD2 LEU 19 3HD2 LEU 19 5.955 4.952 -0.496
160 H GLU 20 H GLU 20 11.333 4.637 -3.597
161 HA GLU 20 HA GLU 20 11.852 1.900 -3.404
162 1HB GLU 20 2HB GLU 20 13.314 2.192 -5.357
163 2HB GLU 20 1HB GLU 20 11.735 2.934 -5.547
164 1HG GLU 20 2HG GLU 20 12.867 4.675 -6.302
165 2HG GLU 20 1HG GLU 20 13.194 5.010 -4.605
166 H ARG 21 H ARG 21 14.253 4.552 -3.226
167 HA ARG 21 HA ARG 21 16.388 2.923 -2.445
168 1HB ARG 21 2HB ARG 21 15.847 5.851 -1.971
169 2HB ARG 21 1HB ARG 21 17.350 5.075 -1.490
170 1HG ARG 21 2HG ARG 21 16.688 4.489 -4.237
171 2HG ARG 21 1HG ARG 21 16.776 6.225 -3.944
172 1HD ARG 21 2HD ARG 21 18.904 4.214 -3.218
173 2HD ARG 21 1HD ARG 21 18.937 5.266 -4.633
174 HE ARG 21 HE ARG 21 18.629 6.791 -2.265
175 1HH1 ARG 21 1HH1 ARG 21 21.013 4.991 -4.069
176 2HH1 ARG 21 2HH1 ARG 21 22.348 5.916 -3.472
177 1HH2 ARG 21 1HH2 ARG 21 20.393 8.013 -1.476
178 2HH2 ARG 21 2HH2 ARG 21 21.998 7.629 -2.003
179 H ALA 22 H ALA 22 14.128 4.790 -0.412
180 HA ALA 22 HA ALA 22 15.313 4.122 2.036
181 1HB ALA 22 1HB ALA 22 13.337 5.811 1.293
182 2HB ALA 22 2HB ALA 22 13.700 5.384 2.965
183 3HB ALA 22 3HB ALA 22 12.410 4.547 2.098
184 H LEU 23 H LEU 23 12.934 2.420 0.128
185 HA LEU 23 HA LEU 23 12.444 0.528 2.248
186 1HB LEU 23 2HB LEU 23 11.024 1.270 -0.001
187 2HB LEU 23 1HB LEU 23 11.580 -0.350 -0.379
188 HG LEU 23 HG LEU 23 10.129 0.359 2.166
189 1HD1 LEU 23 1HD1 LEU 23 9.107 -0.406 -0.523
190 2HD1 LEU 23 2HD1 LEU 23 8.458 0.745 0.645
191 3HD1 LEU 23 3HD1 LEU 23 8.281 -0.987 0.921
192 1HD2 LEU 23 1HD2 LEU 23 11.196 -2.133 0.952
193 2HD2 LEU 23 2HD2 LEU 23 9.681 -2.234 1.851
194 3HD2 LEU 23 3HD2 LEU 23 11.144 -1.632 2.644
195 H ALA 24 H ALA 24 14.549 0.834 -0.465
196 HA ALA 24 HA ALA 24 15.274 -1.915 -0.638
197 1HB ALA 24 1HB ALA 24 17.282 0.127 -1.393
198 2HB ALA 24 2HB ALA 24 15.740 0.201 -2.247
199 3HB ALA 24 3HB ALA 24 16.703 -1.277 -2.289
200 H GLY 25 H GLY 25 16.271 0.880 1.227
201 1HA GLY 25 2HA GLY 25 18.617 -0.238 2.370
202 2HA GLY 25 1HA GLY 25 17.661 1.081 3.046
203 H ALA 26 H ALA 26 15.229 -0.675 2.909
204 HA ALA 26 HA ALA 26 15.474 -1.792 5.528
205 1HB ALA 26 1HB ALA 26 13.086 -2.516 5.110
206 2HB ALA 26 2HB ALA 26 13.201 -1.701 3.549
207 3HB ALA 26 3HB ALA 26 13.390 -0.781 5.043
208 H GLY 27 H GLY 27 16.040 -2.904 2.363
209 1HA GLY 27 2HA GLY 27 17.106 -4.944 1.895
210 2HA GLY 27 1HA GLY 27 16.477 -5.595 3.396
211 H LEU 28 H LEU 28 14.313 -3.999 1.100
212 HA LEU 28 HA LEU 28 13.433 -6.646 0.233
213 1HB LEU 28 2HB LEU 28 11.293 -4.682 0.737
214 2HB LEU 28 1HB LEU 28 11.291 -6.427 0.926
215 HG LEU 28 HG LEU 28 12.967 -5.781 2.901
216 1HD1 LEU 28 1HD1 LEU 28 11.392 -3.740 3.844
217 2HD1 LEU 28 2HD1 LEU 28 11.735 -3.320 2.171
218 3HD1 LEU 28 3HD1 LEU 28 13.059 -3.634 3.279
219 1HD2 LEU 28 1HD2 LEU 28 10.484 -5.472 4.095
220 2HD2 LEU 28 2HD2 LEU 28 11.361 -6.980 3.848
221 3HD2 LEU 28 3HD2 LEU 28 10.179 -6.443 2.653
222 H THR 29 H THR 29 11.823 -6.571 -1.561
223 HA THR 29 HA THR 29 12.842 -4.794 -3.618
224 HB THR 29 HB THR 29 10.876 -7.090 -3.732
225 HG1 THR 29 1HG THR 29 12.987 -7.765 -3.403
226 1HG2 THR 29 1HG2 THR 29 10.206 -6.166 -5.660
227 2HG2 THR 29 2HG2 THR 29 11.728 -6.813 -6.274
228 3HG2 THR 29 3HG2 THR 29 11.623 -5.124 -5.780
229 H CYS 30 H CYS 30 11.954 -2.903 -4.008
230 HA CYS 30 HA CYS 30 9.108 -2.519 -3.376
231 1HB CYS 30 2HB CYS 30 9.853 -0.041 -3.215
232 2HB CYS 30 1HB CYS 30 10.204 -1.135 -1.884
233 HG CYS 30 HG CYS 30 12.660 -1.260 -3.302
234 H THR 31 H THR 31 7.854 -2.320 -5.055
235 HA THR 31 HA THR 31 8.859 -0.871 -7.409
236 HB THR 31 HB THR 31 8.562 -3.440 -7.686
237 HG1 THR 31 1HG THR 31 7.145 -1.724 -9.448
238 1HG2 THR 31 1HG2 THR 31 6.064 -3.029 -6.696
239 2HG2 THR 31 2HG2 THR 31 6.560 -4.401 -7.685
240 3HG2 THR 31 3HG2 THR 31 5.782 -3.012 -8.436
241 H THR 32 H THR 32 7.551 0.750 -8.093
242 HA THR 32 HA THR 32 5.032 1.071 -6.647
243 HB THR 32 HB THR 32 5.240 3.489 -7.123
244 HG1 THR 32 1HG THR 32 7.366 2.595 -8.620
245 1HG2 THR 32 1HG2 THR 32 6.089 3.384 -5.068
246 2HG2 THR 32 2HG2 THR 32 7.655 3.559 -5.862
247 3HG2 THR 32 3HG2 THR 32 7.057 1.956 -5.444
248 H PHE 33 H PHE 33 3.323 2.284 -7.769
249 HA PHE 33 HA PHE 33 3.254 1.723 -10.640
250 1HB PHE 33 2HB PHE 33 1.060 0.999 -8.713
251 2HB PHE 33 1HB PHE 33 1.035 0.777 -10.446
252 HD1 PHE 33 1HD PHE 33 1.472 -1.345 -11.221
253 HD2 PHE 33 2HD PHE 33 3.233 -0.102 -7.560
254 HE1 PHE 33 1HE PHE 33 2.467 -3.566 -10.951
255 HE2 PHE 33 2HE PHE 33 4.247 -2.316 -7.288
256 HZ PHE 33 HZ PHE 33 3.845 -4.072 -8.990
257 H GLU 34 H GLU 34 1.112 2.651 -11.596
258 HA GLU 34 HA GLU 34 1.311 5.427 -11.419
259 1HB GLU 34 2HB GLU 34 -0.652 5.471 -12.915
260 2HB GLU 34 1HB GLU 34 0.589 4.341 -13.440
261 1HG GLU 34 2HG GLU 34 -1.340 3.133 -13.757
262 2HG GLU 34 1HG GLU 34 -0.814 2.585 -12.171
263 H ASN 35 H ASN 35 -1.069 3.301 -9.802
264 HA ASN 35 HA ASN 35 -1.695 5.364 -7.971
265 1HB ASN 35 2HB ASN 35 -3.016 5.677 -10.351
266 2HB ASN 35 1HB ASN 35 -4.198 4.818 -9.368
267 1HD2 ASN 35 1HD2 ASN 35 -4.293 5.736 -7.039
268 2HD2 ASN 35 2HD2 ASN 35 -4.417 7.458 -6.941
269 H GLY 36 H GLY 36 -3.308 2.626 -9.498
270 1HA GLY 36 2HA GLY 36 -3.175 1.045 -7.130
271 2HA GLY 36 1HA GLY 36 -4.777 1.744 -7.333
272 H ASN 37 H ASN 37 -5.029 1.620 -10.113
273 HA ASN 37 HA ASN 37 -5.866 -1.038 -10.462
274 1HB ASN 37 2HB ASN 37 -6.473 1.259 -11.714
275 2HB ASN 37 1HB ASN 37 -5.358 0.569 -12.891
276 1HD2 ASN 37 1HD2 ASN 37 -7.983 -0.613 -10.795
277 2HD2 ASN 37 2HD2 ASN 37 -8.788 -1.511 -12.033
278 H GLU 38 H GLU 38 -2.870 0.550 -11.076
279 HA GLU 38 HA GLU 38 -1.802 -1.200 -12.985
280 1HB GLU 38 2HB GLU 38 -0.926 1.020 -11.525
281 2HB GLU 38 1HB GLU 38 0.195 -0.267 -11.153
282 1HG GLU 38 2HG GLU 38 -0.533 0.469 -13.963
283 2HG GLU 38 1HG GLU 38 0.804 1.213 -13.088
284 H VAL 39 H VAL 39 -1.237 -1.190 -9.404
285 HA VAL 39 HA VAL 39 0.240 -3.555 -9.374
286 HB VAL 39 HB VAL 39 -1.652 -2.733 -7.173
287 1HG1 VAL 39 1HG1 VAL 39 -0.361 -4.042 -5.758
288 2HG1 VAL 39 2HG1 VAL 39 1.011 -4.061 -6.860
289 3HG1 VAL 39 3HG1 VAL 39 -0.427 -5.005 -7.227
290 1HG2 VAL 39 1HG2 VAL 39 1.221 -1.899 -7.440
291 2HG2 VAL 39 2HG2 VAL 39 0.022 -1.320 -6.292
292 3HG2 VAL 39 3HG2 VAL 39 -0.112 -0.891 -7.995
293 H LEU 40 H LEU 40 -3.231 -3.102 -9.532
294 HA LEU 40 HA LEU 40 -4.075 -5.674 -8.818
295 1HB LEU 40 2HB LEU 40 -5.434 -4.113 -10.987
296 2HB LEU 40 1HB LEU 40 -6.148 -5.156 -9.771
297 HG LEU 40 HG LEU 40 -4.928 -2.454 -9.247
298 1HD1 LEU 40 1HD1 LEU 40 -7.006 -1.540 -9.288
299 2HD1 LEU 40 2HD1 LEU 40 -7.790 -3.048 -8.865
300 3HD1 LEU 40 3HD1 LEU 40 -7.219 -2.796 -10.505
301 1HD2 LEU 40 1HD2 LEU 40 -5.706 -2.684 -7.004
302 2HD2 LEU 40 2HD2 LEU 40 -4.750 -4.117 -7.386
303 3HD2 LEU 40 3HD2 LEU 40 -6.512 -4.206 -7.383
304 H ALA 41 H ALA 41 -3.196 -4.351 -11.990
305 HA ALA 41 HA ALA 41 -3.659 -6.749 -13.423
306 1HB ALA 41 1HB ALA 41 -1.841 -4.483 -14.199
307 2HB ALA 41 2HB ALA 41 -3.587 -4.488 -14.449
308 3HB ALA 41 3HB ALA 41 -2.575 -5.673 -15.274
309 H ALA 42 H ALA 42 -0.734 -5.230 -12.200
310 HA ALA 42 HA ALA 42 1.081 -7.205 -13.051
311 1HB ALA 42 1HB ALA 42 2.329 -5.443 -12.432
312 2HB ALA 42 2HB ALA 42 2.282 -6.170 -10.825
313 3HB ALA 42 3HB ALA 42 1.143 -4.894 -11.250
314 H LEU 43 H LEU 43 -0.935 -6.907 -10.210
315 HA LEU 43 HA LEU 43 0.266 -8.893 -8.635
316 1HB LEU 43 2HB LEU 43 -2.410 -7.583 -8.701
317 2HB LEU 43 1HB LEU 43 -2.205 -9.024 -7.731
318 HG LEU 43 HG LEU 43 -0.444 -6.620 -7.426
319 1HD1 LEU 43 1HD1 LEU 43 -2.401 -7.101 -5.325
320 2HD1 LEU 43 2HD1 LEU 43 -3.142 -6.655 -6.863
321 3HD1 LEU 43 3HD1 LEU 43 -1.947 -5.594 -6.120
322 1HD2 LEU 43 1HD2 LEU 43 -0.405 -7.843 -5.081
323 2HD2 LEU 43 2HD2 LEU 43 0.682 -8.294 -6.393
324 3HD2 LEU 43 3HD2 LEU 43 -0.778 -9.236 -6.097
325 H ALA 44 H ALA 44 -1.912 -9.083 -11.314
326 HA ALA 44 HA ALA 44 -2.983 -11.633 -10.895
327 1HB ALA 44 1HB ALA 44 -2.489 -10.004 -13.357
328 2HB ALA 44 2HB ALA 44 -4.017 -10.400 -12.573
329 3HB ALA 44 3HB ALA 44 -3.135 -11.639 -13.466
330 H SER 45 H SER 45 0.211 -10.689 -11.685
331 HA SER 45 HA SER 45 0.868 -13.430 -12.448
332 1HB SER 45 2HB SER 45 1.843 -10.817 -13.426
333 2HB SER 45 1HB SER 45 3.060 -12.079 -13.244
334 HG SER 45 HG SER 45 1.082 -11.826 -15.101
335 H LYS 46 H LYS 46 1.063 -11.312 -9.892
336 HA LYS 46 HA LYS 46 2.882 -12.988 -8.485
337 1HB LYS 46 2HB LYS 46 4.198 -11.159 -9.963
338 2HB LYS 46 1HB LYS 46 3.907 -10.214 -8.510
339 1HG LYS 46 2HG LYS 46 4.821 -12.563 -7.472
340 2HG LYS 46 1HG LYS 46 5.743 -12.436 -8.972
341 1HD LYS 46 2HD LYS 46 5.900 -9.891 -7.986
342 2HD LYS 46 1HD LYS 46 5.919 -10.857 -6.511
343 1HE LYS 46 2HE LYS 46 7.910 -11.859 -7.030
344 2HE LYS 46 1HE LYS 46 7.656 -11.707 -8.767
345 1HZ LYS 46 1HZ LYS 46 8.685 -9.716 -6.863
346 2HZ LYS 46 2HZ LYS 46 7.910 -9.192 -8.271
347 3HZ LYS 46 3HZ LYS 46 9.291 -10.162 -8.378
348 H THR 47 H THR 47 3.193 -12.267 -6.228
349 HA THR 47 HA THR 47 1.251 -10.293 -5.348
350 HB THR 47 HB THR 47 1.418 -13.128 -4.331
351 HG1 THR 47 1HG THR 47 -0.786 -13.130 -4.943
352 1HG2 THR 47 1HG2 THR 47 -0.015 -12.681 -2.590
353 2HG2 THR 47 2HG2 THR 47 -0.547 -11.148 -3.280
354 3HG2 THR 47 3HG2 THR 47 1.055 -11.282 -2.554
355 HA PRO 48 HA PRO 48 4.971 -9.397 -2.958
356 1HB PRO 48 2HB PRO 48 4.206 -6.954 -2.103
357 2HB PRO 48 1HB PRO 48 4.796 -7.229 -3.746
358 1HG PRO 48 2HG PRO 48 1.978 -6.987 -2.764
359 2HG PRO 48 1HG PRO 48 2.722 -6.283 -4.210
360 1HD PRO 48 2HD PRO 48 1.199 -8.524 -4.275
361 2HD PRO 48 1HD PRO 48 2.517 -8.223 -5.416
362 H ASP 49 H ASP 49 5.372 -8.931 -0.664
363 HA ASP 49 HA ASP 49 3.500 -10.324 1.012
364 1HB ASP 49 2HB ASP 49 6.064 -8.890 1.732
365 2HB ASP 49 1HB ASP 49 5.164 -9.975 2.788
366 H VAL 50 H VAL 50 4.142 -7.024 0.233
367 HA VAL 50 HA VAL 50 2.047 -6.181 2.089
368 HB VAL 50 HB VAL 50 4.170 -5.853 3.286
369 1HG1 VAL 50 1HG1 VAL 50 5.988 -4.790 2.452
370 2HG1 VAL 50 2HG1 VAL 50 5.039 -3.754 1.392
371 3HG1 VAL 50 3HG1 VAL 50 5.322 -5.439 0.959
372 1HG2 VAL 50 1HG2 VAL 50 2.664 -3.400 2.444
373 2HG2 VAL 50 2HG2 VAL 50 3.998 -3.309 3.583
374 3HG2 VAL 50 3HG2 VAL 50 2.581 -4.288 3.964
375 H LEU 51 H LEU 51 1.309 -3.888 1.555
376 HA LEU 51 HA LEU 51 2.023 -2.951 -1.094
377 1HB LEU 51 2HB LEU 51 0.180 -4.782 -1.172
378 2HB LEU 51 1HB LEU 51 -0.873 -3.507 -0.596
379 HG LEU 51 HG LEU 51 -0.445 -2.187 -2.576
380 1HD1 LEU 51 1HD1 LEU 51 0.951 -4.022 -4.239
381 2HD1 LEU 51 2HD1 LEU 51 1.891 -3.785 -2.766
382 3HD1 LEU 51 3HD1 LEU 51 1.425 -2.392 -3.745
383 1HD2 LEU 51 1HD2 LEU 51 -1.525 -4.893 -2.677
384 2HD2 LEU 51 2HD2 LEU 51 -1.012 -4.293 -4.251
385 3HD2 LEU 51 3HD2 LEU 51 -2.184 -3.383 -3.303
386 H LEU 52 H LEU 52 2.380 -0.887 -0.752
387 HA LEU 52 HA LEU 52 0.706 0.625 1.122
388 1HB LEU 52 2HB LEU 52 3.364 0.616 0.944
389 2HB LEU 52 1HB LEU 52 3.050 1.827 -0.282
390 HG LEU 52 HG LEU 52 2.213 1.983 2.614
391 1HD1 LEU 52 1HD1 LEU 52 4.253 3.567 1.060
392 2HD1 LEU 52 2HD1 LEU 52 4.617 2.305 2.236
393 3HD1 LEU 52 3HD1 LEU 52 3.824 3.792 2.756
394 1HD2 LEU 52 1HD2 LEU 52 1.885 4.471 1.613
395 2HD2 LEU 52 2HD2 LEU 52 0.590 3.284 1.760
396 3HD2 LEU 52 3HD2 LEU 52 1.420 3.497 0.220
397 H SER 53 H SER 53 -0.951 1.784 0.313
398 HA SER 53 HA SER 53 -0.706 2.766 -2.453
399 1HB SER 53 2HB SER 53 -2.568 0.904 -1.439
400 2HB SER 53 1HB SER 53 -3.459 2.393 -1.747
401 HG SER 53 HG SER 53 -2.153 2.277 -3.847
402 H ASP 54 H ASP 54 -1.308 4.802 -2.900
403 HA ASP 54 HA ASP 54 -1.778 6.584 -0.673
404 1HB ASP 54 2HB ASP 54 -0.333 6.904 -2.900
405 2HB ASP 54 1HB ASP 54 -1.853 7.577 -3.475
406 H ILE 55 H ILE 55 -3.371 8.487 -1.264
407 HA ILE 55 HA ILE 55 -5.764 7.639 -2.622
408 HB ILE 55 HB ILE 55 -6.124 6.596 -0.465
409 1HG1 ILE 55 2HG1 ILE 55 -7.918 8.003 -1.806
410 2HG1 ILE 55 1HG1 ILE 55 -8.323 7.223 -0.285
411 1HG2 ILE 55 1HG2 ILE 55 -5.113 9.124 0.546
412 2HG2 ILE 55 2HG2 ILE 55 -5.122 7.526 1.282
413 3HG2 ILE 55 3HG2 ILE 55 -6.551 8.553 1.386
414 1HD1 ILE 55 1HD1 ILE 55 -7.325 10.000 -0.146
415 2HD1 ILE 55 2HD1 ILE 55 -8.576 9.192 0.794
416 3HD1 ILE 55 3HD1 ILE 55 -8.925 9.750 -0.842
417 H ARG 56 H ARG 56 -5.956 9.368 -3.877
418 HA ARG 56 HA ARG 56 -6.173 11.993 -2.583
419 1HB ARG 56 2HB ARG 56 -5.041 12.975 -4.613
420 2HB ARG 56 1HB ARG 56 -4.001 12.042 -3.547
421 1HG ARG 56 2HG ARG 56 -3.498 10.581 -5.147
422 2HG ARG 56 1HG ARG 56 -5.185 10.415 -5.639
423 1HD ARG 56 2HD ARG 56 -3.962 11.289 -7.492
424 2HD ARG 56 1HD ARG 56 -4.966 12.584 -6.851
425 HE ARG 56 HE ARG 56 -2.051 12.354 -6.589
426 1HH1 ARG 56 1HH1 ARG 56 -4.975 14.230 -6.156
427 2HH1 ARG 56 2HH1 ARG 56 -4.125 15.713 -5.894
428 1HH2 ARG 56 1HH2 ARG 56 -0.944 14.314 -6.232
429 2HH2 ARG 56 2HH2 ARG 56 -1.846 15.762 -5.934
430 H MET 57 H MET 57 -8.255 10.234 -3.313
431 HA MET 57 HA MET 57 -10.306 10.308 -4.250
432 1HB MET 57 2HB MET 57 -9.589 12.951 -3.950
433 2HB MET 57 1HB MET 57 -10.083 12.863 -5.634
434 1HG MET 57 2HG MET 57 -12.250 12.249 -5.107
435 2HG MET 57 1HG MET 57 -11.801 11.677 -3.500
436 1HE MET 57 1HE MET 57 -13.416 13.379 -1.671
437 2HE MET 57 2HE MET 57 -14.057 12.724 -3.179
438 3HE MET 57 3HE MET 57 -14.322 14.421 -2.769
439 HA PRO 58 HA PRO 58 -8.355 9.725 -8.584
440 1HB PRO 58 2HB PRO 58 -7.813 7.067 -8.493
441 2HB PRO 58 1HB PRO 58 -6.632 8.292 -8.015
442 1HG PRO 58 2HG PRO 58 -8.453 6.648 -6.290
443 2HG PRO 58 1HG PRO 58 -6.730 7.008 -6.068
444 1HD PRO 58 2HD PRO 58 -8.662 8.337 -4.736
445 2HD PRO 58 1HD PRO 58 -7.155 9.121 -5.240
446 H GLY 59 H GLY 59 -9.544 6.530 -7.737
447 1HA GLY 59 2HA GLY 59 -11.855 6.930 -9.469
448 2HA GLY 59 1HA GLY 59 -11.307 5.400 -8.787
449 H MET 60 H MET 60 -11.943 4.806 -6.720
450 HA MET 60 HA MET 60 -14.343 6.137 -5.757
451 1HB MET 60 2HB MET 60 -14.289 3.641 -5.917
452 2HB MET 60 1HB MET 60 -13.037 3.629 -4.684
453 1HG MET 60 2HG MET 60 -14.956 3.184 -3.484
454 2HG MET 60 1HG MET 60 -14.707 4.911 -3.236
455 1HE MET 60 1HE MET 60 -17.835 3.039 -6.037
456 2HE MET 60 2HE MET 60 -16.437 2.227 -5.333
457 3HE MET 60 3HE MET 60 -16.218 3.370 -6.659
458 H ASP 61 H ASP 61 -12.776 7.961 -5.342
459 HA ASP 61 HA ASP 61 -11.903 9.412 -3.830
460 1HB ASP 61 2HB ASP 61 -13.373 7.528 -2.230
461 2HB ASP 61 1HB ASP 61 -11.930 8.068 -1.374
462 H GLY 62 H GLY 62 -10.794 6.178 -4.032
463 1HA GLY 62 2HA GLY 62 -8.285 6.177 -4.435
464 2HA GLY 62 1HA GLY 62 -8.213 6.878 -2.829
465 H LEU 63 H LEU 63 -10.450 5.324 -1.837
466 HA LEU 63 HA LEU 63 -9.005 3.054 -0.978
467 1HB LEU 63 2HB LEU 63 -11.915 3.762 -0.686
468 2HB LEU 63 1HB LEU 63 -11.178 2.353 0.048
469 HG LEU 63 HG LEU 63 -9.533 4.215 1.018
470 1HD1 LEU 63 1HD1 LEU 63 -10.257 6.308 0.954
471 2HD1 LEU 63 2HD1 LEU 63 -11.863 5.836 1.505
472 3HD1 LEU 63 3HD1 LEU 63 -11.471 5.783 -0.213
473 1HD2 LEU 63 1HD2 LEU 63 -12.202 3.302 2.047
474 2HD2 LEU 63 2HD2 LEU 63 -11.084 4.255 3.024
475 3HD2 LEU 63 3HD2 LEU 63 -10.605 2.666 2.427
476 H ALA 64 H ALA 64 -10.791 3.707 -3.768
477 HA ALA 64 HA ALA 64 -12.057 1.330 -4.394
478 1HB ALA 64 1HB ALA 64 -10.700 2.426 -6.699
479 2HB ALA 64 2HB ALA 64 -11.423 3.693 -5.703
480 3HB ALA 64 3HB ALA 64 -12.424 2.377 -6.322
481 H LEU 65 H LEU 65 -8.620 2.121 -4.625
482 HA LEU 65 HA LEU 65 -7.813 -0.077 -6.154
483 1HB LEU 65 2HB LEU 65 -5.578 0.284 -5.181
484 2HB LEU 65 1HB LEU 65 -6.314 1.753 -5.790
485 HG LEU 65 HG LEU 65 -7.064 1.959 -3.228
486 1HD1 LEU 65 1HD1 LEU 65 -5.927 -0.204 -2.686
487 2HD1 LEU 65 2HD1 LEU 65 -5.388 1.171 -1.726
488 3HD1 LEU 65 3HD1 LEU 65 -4.395 0.578 -3.055
489 1HD2 LEU 65 1HD2 LEU 65 -5.067 3.084 -4.916
490 2HD2 LEU 65 2HD2 LEU 65 -4.385 2.898 -3.302
491 3HD2 LEU 65 3HD2 LEU 65 -5.872 3.814 -3.530
492 H LEU 66 H LEU 66 -8.266 0.235 -2.647
493 HA LEU 66 HA LEU 66 -7.182 -2.249 -1.906
494 1HB LEU 66 2HB LEU 66 -9.454 -0.736 -0.611
495 2HB LEU 66 1HB LEU 66 -8.564 -2.055 0.124
496 HG LEU 66 HG LEU 66 -6.519 -0.389 -0.428
497 1HD1 LEU 66 1HD1 LEU 66 -7.626 1.452 -1.295
498 2HD1 LEU 66 2HD1 LEU 66 -7.436 1.877 0.403
499 3HD1 LEU 66 3HD1 LEU 66 -8.987 1.281 -0.186
500 1HD2 LEU 66 1HD2 LEU 66 -8.301 -0.725 1.933
501 2HD2 LEU 66 2HD2 LEU 66 -7.037 0.502 1.984
502 3HD2 LEU 66 3HD2 LEU 66 -6.614 -1.189 1.720
503 H LYS 67 H LYS 67 -10.437 -1.301 -2.865
504 HA LYS 67 HA LYS 67 -11.790 -3.666 -2.398
505 1HB LYS 67 2HB LYS 67 -12.455 -1.255 -3.449
506 2HB LYS 67 1HB LYS 67 -12.524 -2.271 -4.883
507 1HG LYS 67 2HG LYS 67 -14.484 -3.107 -4.262
508 2HG LYS 67 1HG LYS 67 -13.831 -3.584 -2.692
509 1HD LYS 67 2HD LYS 67 -15.432 -2.114 -1.997
510 2HD LYS 67 1HD LYS 67 -14.086 -0.992 -2.210
511 1HE LYS 67 2HE LYS 67 -16.090 -0.082 -3.218
512 2HE LYS 67 1HE LYS 67 -14.905 -0.465 -4.466
513 1HZ LYS 67 1HZ LYS 67 -17.544 -1.436 -4.165
514 2HZ LYS 67 2HZ LYS 67 -16.459 -2.734 -4.142
515 3HZ LYS 67 3HZ LYS 67 -16.468 -1.663 -5.451
516 H GLN 68 H GLN 68 -9.965 -2.695 -5.264
517 HA GLN 68 HA GLN 68 -10.554 -5.066 -6.707
518 1HB GLN 68 2HB GLN 68 -8.370 -3.026 -7.068
519 2HB GLN 68 1HB GLN 68 -8.718 -4.327 -8.201
520 1HG GLN 68 2HG GLN 68 -10.626 -2.127 -7.436
521 2HG GLN 68 1HG GLN 68 -9.661 -2.181 -8.913
522 1HE2 GLN 68 1HE2 GLN 68 -12.159 -3.891 -7.102
523 2HE2 GLN 68 2HE2 GLN 68 -12.931 -4.592 -8.480
524 H ILE 69 H ILE 69 -7.762 -4.018 -4.767
525 HA ILE 69 HA ILE 69 -6.111 -6.220 -5.296
526 HB ILE 69 HB ILE 69 -6.201 -4.628 -2.734
527 1HG1 ILE 69 2HG1 ILE 69 -4.262 -4.093 -4.951
528 2HG1 ILE 69 1HG1 ILE 69 -5.890 -3.433 -5.068
529 1HG2 ILE 69 1HG2 ILE 69 -3.696 -5.246 -2.803
530 2HG2 ILE 69 2HG2 ILE 69 -4.196 -6.510 -3.927
531 3HG2 ILE 69 3HG2 ILE 69 -4.856 -6.474 -2.291
532 1HD1 ILE 69 1HD1 ILE 69 -4.005 -2.971 -2.768
533 2HD1 ILE 69 2HD1 ILE 69 -5.589 -2.233 -2.999
534 3HD1 ILE 69 3HD1 ILE 69 -4.270 -1.854 -4.105
535 H LYS 70 H LYS 70 -8.675 -5.751 -2.988
536 HA LYS 70 HA LYS 70 -8.198 -8.125 -1.502
537 1HB LYS 70 2HB LYS 70 -10.298 -7.667 -0.405
538 2HB LYS 70 1HB LYS 70 -9.426 -6.153 -0.606
539 1HG LYS 70 2HG LYS 70 -11.062 -5.269 -1.800
540 2HG LYS 70 1HG LYS 70 -11.148 -6.680 -2.852
541 1HD LYS 70 2HD LYS 70 -12.906 -7.540 -1.761
542 2HD LYS 70 1HD LYS 70 -12.242 -7.126 -0.181
543 1HE LYS 70 2HE LYS 70 -13.823 -5.560 -0.069
544 2HE LYS 70 1HE LYS 70 -12.892 -4.674 -1.272
545 1HZ LYS 70 1HZ LYS 70 -14.948 -6.683 -1.993
546 2HZ LYS 70 2HZ LYS 70 -14.218 -5.537 -3.003
547 3HZ LYS 70 3HZ LYS 70 -15.300 -5.038 -1.804
548 H GLN 71 H GLN 71 -10.003 -7.343 -4.350
549 HA GLN 71 HA GLN 71 -11.542 -9.738 -4.380
550 1HB GLN 71 2HB GLN 71 -12.659 -8.115 -5.536
551 2HB GLN 71 1HB GLN 71 -11.185 -7.373 -6.125
552 1HG GLN 71 2HG GLN 71 -11.382 -9.885 -7.393
553 2HG GLN 71 1HG GLN 71 -12.981 -9.151 -7.453
554 1HE2 GLN 71 1HE2 GLN 71 -9.894 -7.449 -7.439
555 2HE2 GLN 71 2HE2 GLN 71 -10.063 -6.765 -9.016
556 H ARG 72 H ARG 72 -8.552 -8.657 -5.805
557 HA ARG 72 HA ARG 72 -8.234 -11.133 -7.289
558 1HB ARG 72 2HB ARG 72 -6.648 -8.589 -7.110
559 2HB ARG 72 1HB ARG 72 -5.967 -10.027 -7.860
560 1HG ARG 72 2HG ARG 72 -8.647 -9.104 -8.753
561 2HG ARG 72 1HG ARG 72 -7.223 -8.201 -9.271
562 1HD ARG 72 2HD ARG 72 -6.783 -9.727 -10.816
563 2HD ARG 72 1HD ARG 72 -6.706 -10.986 -9.586
564 HE ARG 72 HE ARG 72 -9.115 -10.202 -11.087
565 1HH1 ARG 72 1HH1 ARG 72 -7.372 -12.533 -9.142
566 2HH1 ARG 72 2HH1 ARG 72 -8.547 -13.780 -9.376
567 1HH2 ARG 72 1HH2 ARG 72 -10.646 -11.848 -11.385
568 2HH2 ARG 72 2HH2 ARG 72 -10.399 -13.394 -10.645
569 H HIS 73 H HIS 73 -7.203 -9.690 -4.333
570 HA HIS 73 HA HIS 73 -5.954 -12.171 -3.527
571 1HB HIS 73 2HB HIS 73 -4.332 -9.636 -3.302
572 2HB HIS 73 1HB HIS 73 -3.806 -11.292 -3.004
573 HD1 HIS 73 1HD HIS 73 -3.234 -12.742 -5.055
574 HD2 HIS 73 2HD HIS 73 -4.365 -8.854 -5.984
575 HE1 HIS 73 1HE HIS 73 -2.706 -12.459 -7.494
576 HE2 HIS 73 2HE HIS 73 -3.620 -10.186 -8.078
577 HA PRO 74 HA PRO 74 -8.265 -10.049 -0.166
578 1HB PRO 74 2HB PRO 74 -9.512 -12.265 0.755
579 2HB PRO 74 1HB PRO 74 -10.123 -11.322 -0.610
580 1HG PRO 74 2HG PRO 74 -8.553 -13.868 -0.616
581 2HG PRO 74 1HG PRO 74 -9.941 -13.405 -1.617
582 1HD PRO 74 2HD PRO 74 -7.363 -13.290 -2.492
583 2HD PRO 74 1HD PRO 74 -8.642 -12.212 -3.084
584 H MET 75 H MET 75 -5.490 -10.898 -0.068
585 HA MET 75 HA MET 75 -5.376 -11.687 2.736
586 1HB MET 75 2HB MET 75 -3.673 -12.977 0.604
587 2HB MET 75 1HB MET 75 -3.596 -13.301 2.330
588 1HG MET 75 2HG MET 75 -6.235 -13.675 1.090
589 2HG MET 75 1HG MET 75 -4.976 -14.792 0.565
590 1HE MET 75 1HE MET 75 -4.087 -16.652 1.781
591 2HE MET 75 2HE MET 75 -5.784 -17.120 1.657
592 3HE MET 75 3HE MET 75 -4.909 -17.369 3.168
593 H LEU 76 H LEU 76 -3.849 -10.246 -0.037
594 HA LEU 76 HA LEU 76 -1.412 -9.467 1.078
595 1HB LEU 76 2HB LEU 76 -2.736 -9.180 -1.353
596 2HB LEU 76 1HB LEU 76 -2.480 -7.535 -0.805
597 HG LEU 76 HG LEU 76 -0.240 -9.536 -0.915
598 1HD1 LEU 76 1HD1 LEU 76 -1.656 -8.796 -3.125
599 2HD1 LEU 76 2HD1 LEU 76 0.041 -9.275 -3.117
600 3HD1 LEU 76 3HD1 LEU 76 -0.395 -7.567 -3.071
601 1HD2 LEU 76 1HD2 LEU 76 0.055 -6.605 -1.286
602 2HD2 LEU 76 2HD2 LEU 76 1.151 -7.765 -0.538
603 3HD2 LEU 76 3HD2 LEU 76 -0.276 -7.209 0.338
604 HA PRO 77 HA PRO 77 -2.908 -6.323 3.908
605 1HB PRO 77 2HB PRO 77 -0.495 -5.462 4.782
606 2HB PRO 77 1HB PRO 77 -1.222 -6.976 5.330
607 1HG PRO 77 2HG PRO 77 0.879 -6.526 3.256
608 2HG PRO 77 1HG PRO 77 0.798 -7.776 4.506
609 1HD PRO 77 2HD PRO 77 0.118 -8.233 1.915
610 2HD PRO 77 1HD PRO 77 -0.633 -9.089 3.275
611 H VAL 78 H VAL 78 -3.587 -4.378 3.341
612 HA VAL 78 HA VAL 78 -2.016 -2.806 1.422
613 HB VAL 78 HB VAL 78 -4.907 -2.346 2.131
614 1HG1 VAL 78 1HG1 VAL 78 -4.259 -0.473 1.014
615 2HG1 VAL 78 2HG1 VAL 78 -4.706 -1.489 -0.357
616 3HG1 VAL 78 3HG1 VAL 78 -3.009 -1.311 0.096
617 1HG2 VAL 78 1HG2 VAL 78 -5.592 -3.694 0.292
618 2HG2 VAL 78 2HG2 VAL 78 -4.500 -4.677 1.265
619 3HG2 VAL 78 3HG2 VAL 78 -3.925 -3.941 -0.231
620 H ILE 79 H ILE 79 -1.425 -0.732 1.848
621 HA ILE 79 HA ILE 79 -2.179 0.386 4.465
622 HB ILE 79 HB ILE 79 0.550 0.718 3.221
623 1HG1 ILE 79 2HG1 ILE 79 0.472 -0.827 5.682
624 2HG1 ILE 79 1HG1 ILE 79 -0.464 -1.607 4.412
625 1HG2 ILE 79 1HG2 ILE 79 -0.821 2.037 5.327
626 2HG2 ILE 79 2HG2 ILE 79 0.836 2.278 4.771
627 3HG2 ILE 79 3HG2 ILE 79 0.493 1.096 6.033
628 1HD1 ILE 79 1HD1 ILE 79 1.742 -2.462 4.331
629 2HD1 ILE 79 2HD1 ILE 79 2.438 -0.843 4.339
630 3HD1 ILE 79 3HD1 ILE 79 1.534 -1.407 2.933
631 H ILE 80 H ILE 80 -3.419 2.077 4.041
632 HA ILE 80 HA ILE 80 -2.818 3.746 1.709
633 HB ILE 80 HB ILE 80 -5.312 3.807 3.382
634 1HG1 ILE 80 2HG1 ILE 80 -4.864 1.561 2.358
635 2HG1 ILE 80 1HG1 ILE 80 -6.341 2.331 1.795
636 1HG2 ILE 80 1HG2 ILE 80 -5.520 5.707 2.188
637 2HG2 ILE 80 2HG2 ILE 80 -6.033 4.604 0.911
638 3HG2 ILE 80 3HG2 ILE 80 -4.369 5.186 0.958
639 1HD1 ILE 80 1HD1 ILE 80 -3.877 2.762 0.210
640 2HD1 ILE 80 2HD1 ILE 80 -5.553 2.606 -0.317
641 3HD1 ILE 80 3HD1 ILE 80 -4.638 1.173 0.146
642 H MET 81 H MET 81 -2.666 6.003 1.845
643 HA MET 81 HA MET 81 -1.496 6.966 4.270
644 1HB MET 81 2HB MET 81 -1.690 9.243 3.050
645 2HB MET 81 1HB MET 81 -0.593 8.025 2.428
646 1HG MET 81 2HG MET 81 -1.592 8.052 0.464
647 2HG MET 81 1HG MET 81 -3.164 7.733 1.193
648 1HE MET 81 1HE MET 81 -1.319 11.840 0.313
649 2HE MET 81 2HE MET 81 -0.468 10.310 0.523
650 3HE MET 81 3HE MET 81 -1.051 11.194 1.933
651 H THR 82 H THR 82 -4.269 8.449 2.570
652 HA THR 82 HA THR 82 -5.380 9.105 5.204
653 HB THR 82 HB THR 82 -6.241 10.310 2.580
654 HG1 THR 82 1HG THR 82 -4.599 11.640 2.619
655 1HG2 THR 82 1HG2 THR 82 -7.693 11.320 3.925
656 2HG2 THR 82 2HG2 THR 82 -6.312 12.264 4.482
657 3HG2 THR 82 3HG2 THR 82 -6.824 10.837 5.381
658 H ALA 83 H ALA 83 -7.762 9.112 5.384
659 HA ALA 83 HA ALA 83 -8.903 6.809 3.950
660 1HB ALA 83 1HB ALA 83 -9.834 6.069 5.870
661 2HB ALA 83 2HB ALA 83 -10.145 7.698 6.473
662 3HB ALA 83 3HB ALA 83 -8.529 7.007 6.596
663 H HIS 84 H HIS 84 -9.301 10.169 4.646
664 HA HIS 84 HA HIS 84 -10.966 11.676 4.229
665 1HB HIS 84 2HB HIS 84 -10.733 9.939 1.814
666 2HB HIS 84 1HB HIS 84 -11.964 11.194 1.839
667 HD1 HIS 84 1HD HIS 84 -9.807 13.031 3.606
668 HD2 HIS 84 2HD HIS 84 -9.448 11.465 -0.221
669 HE1 HIS 84 1HE HIS 84 -8.090 14.459 2.456
670 HE2 HIS 84 2HE HIS 84 -7.799 13.416 0.182
671 H SER 85 H SER 85 -13.384 11.456 2.804
672 HA SER 85 HA SER 85 -15.029 10.249 4.836
673 1HB SER 85 2HB SER 85 -15.648 12.421 3.906
674 2HB SER 85 1HB SER 85 -15.775 11.713 2.296
675 HG SER 85 HG SER 85 -17.282 10.524 4.310
676 H ASP 86 H ASP 86 -13.453 8.433 3.118
677 HA ASP 86 HA ASP 86 -15.696 6.834 2.095
678 1HB ASP 86 2HB ASP 86 -13.251 7.703 0.704
679 2HB ASP 86 1HB ASP 86 -13.595 5.982 0.561
680 H LEU 87 H LEU 87 -14.165 6.869 4.663
681 HA LEU 87 HA LEU 87 -12.339 4.832 4.933
682 1HB LEU 87 2HB LEU 87 -14.060 6.339 6.667
683 2HB LEU 87 1HB LEU 87 -14.028 4.667 7.188
684 HG LEU 87 HG LEU 87 -11.598 6.411 6.801
685 1HD1 LEU 87 1HD1 LEU 87 -11.630 6.916 8.998
686 2HD1 LEU 87 2HD1 LEU 87 -12.334 5.364 9.455
687 3HD1 LEU 87 3HD1 LEU 87 -13.363 6.647 8.814
688 1HD2 LEU 87 1HD2 LEU 87 -11.352 3.923 6.406
689 2HD2 LEU 87 2HD2 LEU 87 -11.751 3.711 8.111
690 3HD2 LEU 87 3HD2 LEU 87 -10.312 4.621 7.649
691 H ASP 88 H ASP 88 -15.712 4.576 4.259
692 HA ASP 88 HA ASP 88 -16.429 2.122 5.219
693 1HB ASP 88 2HB ASP 88 -17.891 1.953 3.174
694 2HB ASP 88 1HB ASP 88 -18.040 3.451 4.085
695 H ALA 89 H ALA 89 -14.956 2.674 2.009
696 HA ALA 89 HA ALA 89 -14.683 -0.021 1.338
697 1HB ALA 89 1HB ALA 89 -13.787 2.515 0.267
698 2HB ALA 89 2HB ALA 89 -14.238 1.028 -0.570
699 3HB ALA 89 3HB ALA 89 -12.596 1.238 0.033
700 H ALA 90 H ALA 90 -12.838 1.920 3.505
701 HA ALA 90 HA ALA 90 -10.432 0.382 3.427
702 1HB ALA 90 1HB ALA 90 -11.461 2.115 5.677
703 2HB ALA 90 2HB ALA 90 -10.497 2.691 4.320
704 3HB ALA 90 3HB ALA 90 -9.809 1.543 5.465
705 H VAL 91 H VAL 91 -13.425 0.253 5.247
706 HA VAL 91 HA VAL 91 -12.665 -1.559 7.225
707 HB VAL 91 HB VAL 91 -15.413 -1.453 6.014
708 1HG1 VAL 91 1HG1 VAL 91 -15.597 -3.114 7.536
709 2HG1 VAL 91 2HG1 VAL 91 -15.732 -1.769 8.672
710 3HG1 VAL 91 3HG1 VAL 91 -14.179 -2.584 8.443
711 1HG2 VAL 91 1HG2 VAL 91 -14.107 0.406 7.994
712 2HG2 VAL 91 2HG2 VAL 91 -15.854 0.264 7.813
713 3HG2 VAL 91 3HG2 VAL 91 -14.871 0.820 6.459
714 H SER 92 H SER 92 -14.016 -2.145 3.999
715 HA SER 92 HA SER 92 -14.241 -4.934 4.223
716 1HB SER 92 2HB SER 92 -13.692 -3.292 1.739
717 2HB SER 92 1HB SER 92 -14.281 -4.953 1.767
718 HG SER 92 HG SER 92 -16.104 -3.816 1.616
719 H ALA 93 H ALA 93 -11.544 -2.853 3.409
720 HA ALA 93 HA ALA 93 -9.783 -4.765 2.396
721 1HB ALA 93 1HB ALA 93 -9.073 -2.325 4.001
722 2HB ALA 93 2HB ALA 93 -9.433 -2.326 2.274
723 3HB ALA 93 3HB ALA 93 -8.024 -3.195 2.882
724 H TYR 94 H TYR 94 -10.393 -3.732 5.700
725 HA TYR 94 HA TYR 94 -8.350 -5.122 6.977
726 1HB TYR 94 2HB TYR 94 -11.131 -4.755 8.099
727 2HB TYR 94 1HB TYR 94 -9.633 -4.946 9.004
728 HD1 TYR 94 1HD TYR 94 -11.886 -2.664 8.859
729 HD2 TYR 94 2HD TYR 94 -7.891 -3.065 7.435
730 HE1 TYR 94 1HE TYR 94 -11.615 -0.223 8.930
731 HE2 TYR 94 2HE TYR 94 -7.618 -0.621 7.502
732 HH TYR 94 HH TYR 94 -9.372 1.432 7.368
733 H GLN 95 H GLN 95 -11.228 -6.256 5.492
734 HA GLN 95 HA GLN 95 -11.294 -8.802 6.810
735 1HB GLN 95 2HB GLN 95 -13.279 -9.078 5.767
736 2HB GLN 95 1HB GLN 95 -13.117 -7.381 5.346
737 1HG GLN 95 2HG GLN 95 -11.790 -8.524 3.289
738 2HG GLN 95 1HG GLN 95 -12.974 -9.777 3.652
739 1HE2 GLN 95 1HE2 GLN 95 -12.485 -7.554 1.553
740 2HE2 GLN 95 2HE2 GLN 95 -14.067 -6.893 1.326
741 H GLN 96 H GLN 96 -10.057 -7.540 3.758
742 HA GLN 96 HA GLN 96 -9.155 -10.094 2.849
743 1HB GLN 96 2HB GLN 96 -8.217 -8.939 0.974
744 2HB GLN 96 1HB GLN 96 -9.804 -8.257 1.304
745 1HG GLN 96 2HG GLN 96 -8.515 -6.393 0.881
746 2HG GLN 96 1HG GLN 96 -8.499 -6.481 2.632
747 1HE2 GLN 96 1HE2 GLN 96 -6.603 -5.437 2.947
748 2HE2 GLN 96 2HE2 GLN 96 -5.069 -6.074 2.470
749 H GLY 97 H GLY 97 -7.937 -7.728 4.978
750 1HA GLY 97 2HA GLY 97 -6.062 -8.620 6.352
751 2HA GLY 97 1HA GLY 97 -5.262 -8.968 4.831
752 H ALA 98 H ALA 98 -7.037 -6.005 4.952
753 HA ALA 98 HA ALA 98 -4.935 -4.381 4.259
754 1HB ALA 98 1HB ALA 98 -7.622 -3.985 5.069
755 2HB ALA 98 2HB ALA 98 -6.586 -2.915 4.134
756 3HB ALA 98 3HB ALA 98 -6.617 -2.805 5.895
757 H PHE 99 H PHE 99 -3.399 -3.183 5.315
758 HA PHE 99 HA PHE 99 -2.632 -4.128 7.891
759 1HB PHE 99 2HB PHE 99 -1.057 -3.418 6.016
760 2HB PHE 99 1HB PHE 99 -1.437 -1.758 6.470
761 HD1 PHE 99 1HD PHE 99 -0.311 -4.960 8.005
762 HD2 PHE 99 2HD PHE 99 -0.119 -0.711 8.037
763 HE1 PHE 99 1HE PHE 99 1.386 -5.055 9.781
764 HE2 PHE 99 2HE PHE 99 1.590 -0.797 9.807
765 HZ PHE 99 HZ PHE 99 2.341 -2.970 10.684
766 H ASP 100 H ASP 100 -3.583 -0.925 6.636
767 HA ASP 100 HA ASP 100 -5.307 -0.189 8.629
768 1HB ASP 100 2HB ASP 100 -3.716 1.331 10.012
769 2HB ASP 100 1HB ASP 100 -3.781 -0.386 10.387
770 H TYR 101 H TYR 101 -4.901 2.415 9.142
771 HA TYR 101 HA TYR 101 -4.340 3.690 6.554
772 1HB TYR 101 2HB TYR 101 -6.853 3.696 8.121
773 2HB TYR 101 1HB TYR 101 -6.345 5.256 7.485
774 HD1 TYR 101 1HD TYR 101 -7.027 1.742 6.444
775 HD2 TYR 101 2HD TYR 101 -6.804 5.825 5.266
776 HE1 TYR 101 1HE TYR 101 -7.963 1.156 4.254
777 HE2 TYR 101 2HE TYR 101 -7.751 5.246 3.072
778 HH TYR 101 HH TYR 101 -7.970 3.317 1.622
779 H LEU 102 H LEU 102 -3.737 5.928 6.685
780 HA LEU 102 HA LEU 102 -2.504 6.601 9.264
781 1HB LEU 102 2HB LEU 102 -1.591 6.680 6.606
782 2HB LEU 102 1HB LEU 102 -1.798 8.350 7.086
783 HG LEU 102 HG LEU 102 -0.242 8.114 8.891
784 1HD1 LEU 102 1HD1 LEU 102 -0.668 5.987 9.776
785 2HD1 LEU 102 2HD1 LEU 102 0.974 5.907 9.134
786 3HD1 LEU 102 3HD1 LEU 102 -0.362 5.193 8.230
787 1HD2 LEU 102 1HD2 LEU 102 0.530 7.197 6.183
788 2HD2 LEU 102 2HD2 LEU 102 1.722 7.011 7.470
789 3HD2 LEU 102 3HD2 LEU 102 1.062 8.601 7.104
790 HA PRO 103 HA PRO 103 -5.706 9.714 9.612
791 1HB PRO 103 2HB PRO 103 -4.868 10.801 11.965
792 2HB PRO 103 1HB PRO 103 -5.797 9.304 11.853
793 1HG PRO 103 2HG PRO 103 -2.895 9.700 12.339
794 2HG PRO 103 1HG PRO 103 -3.980 8.447 12.956
795 1HD PRO 103 2HD PRO 103 -2.183 8.106 10.885
796 2HD PRO 103 1HD PRO 103 -3.611 7.094 11.164
797 H LYS 104 H LYS 104 -2.876 11.174 11.170
798 HA LYS 104 HA LYS 104 -3.048 13.357 9.213
799 1HB LYS 104 2HB LYS 104 -3.157 13.454 11.966
800 2HB LYS 104 1HB LYS 104 -1.491 13.903 11.624
801 1HG LYS 104 2HG LYS 104 -3.679 15.202 10.085
802 2HG LYS 104 1HG LYS 104 -3.374 15.713 11.746
803 1HD LYS 104 2HD LYS 104 -1.107 16.290 11.219
804 2HD LYS 104 1HD LYS 104 -1.251 15.585 9.609
805 1HE LYS 104 2HE LYS 104 -2.764 17.985 10.634
806 2HE LYS 104 1HE LYS 104 -1.387 18.024 9.536
807 1HZ LYS 104 1HZ LYS 104 -2.632 17.023 7.839
808 2HZ LYS 104 2HZ LYS 104 -3.665 18.188 8.499
809 3HZ LYS 104 3HZ LYS 104 -3.874 16.557 8.887
810 HA PRO 105 HA PRO 105 1.770 12.642 9.941
811 1HB PRO 105 2HB PRO 105 1.621 9.779 10.740
812 2HB PRO 105 1HB PRO 105 2.723 11.046 11.290
813 1HG PRO 105 2HG PRO 105 0.742 10.215 12.854
814 2HG PRO 105 1HG PRO 105 1.175 11.933 12.775
815 1HD PRO 105 2HD PRO 105 -1.116 10.491 11.507
816 2HD PRO 105 1HD PRO 105 -1.075 12.104 12.248
817 H PHE 106 H PHE 106 3.153 11.794 8.358
818 HA PHE 106 HA PHE 106 2.350 9.614 6.677
819 1HB PHE 106 2HB PHE 106 2.186 12.450 5.642
820 2HB PHE 106 1HB PHE 106 2.321 11.052 4.581
821 HD1 PHE 106 1HD PHE 106 0.094 13.253 6.089
822 HD2 PHE 106 2HD PHE 106 0.566 9.136 5.095
823 HE1 PHE 106 1HE PHE 106 -2.347 12.959 6.170
824 HE2 PHE 106 2HE PHE 106 -1.856 8.855 5.186
825 HZ PHE 106 HZ PHE 106 -3.330 10.748 5.714
826 H ASP 107 H ASP 107 4.006 11.758 4.716
827 HA ASP 107 HA ASP 107 6.118 11.681 3.878
828 1HB ASP 107 2HB ASP 107 7.853 12.337 5.432
829 2HB ASP 107 1HB ASP 107 6.369 13.197 5.828
830 H ILE 108 H ILE 108 8.385 10.583 4.169
831 HA ILE 108 HA ILE 108 7.939 7.811 3.922
832 HB ILE 108 HB ILE 108 10.145 9.619 3.511
833 1HG1 ILE 108 2HG1 ILE 108 10.657 8.035 1.714
834 2HG1 ILE 108 1HG1 ILE 108 9.498 6.899 2.389
835 1HG2 ILE 108 1HG2 ILE 108 11.850 7.669 3.675
836 2HG2 ILE 108 2HG2 ILE 108 10.732 7.027 4.874
837 3HG2 ILE 108 3HG2 ILE 108 11.468 8.611 5.115
838 1HD1 ILE 108 1HD1 ILE 108 8.735 8.289 0.413
839 2HD1 ILE 108 2HD1 ILE 108 8.693 9.652 1.531
840 3HD1 ILE 108 3HD1 ILE 108 7.673 8.242 1.821
841 H ASP 109 H ASP 109 9.443 9.726 6.435
842 HA ASP 109 HA ASP 109 10.428 7.754 8.064
843 1HB ASP 109 2HB ASP 109 9.308 10.469 8.628
844 2HB ASP 109 1HB ASP 109 9.705 9.413 9.980
845 H GLU 110 H GLU 110 7.103 9.092 8.269
846 HA GLU 110 HA GLU 110 6.354 7.040 10.116
847 1HB GLU 110 2HB GLU 110 4.578 9.049 8.757
848 2HB GLU 110 1HB GLU 110 4.185 8.095 10.176
849 1HG GLU 110 2HG GLU 110 6.600 9.699 10.482
850 2HG GLU 110 1HG GLU 110 5.148 10.650 10.182
851 H ALA 111 H ALA 111 5.893 7.675 6.703
852 HA ALA 111 HA ALA 111 3.916 5.675 6.303
853 1HB ALA 111 1HB ALA 111 5.776 7.016 4.351
854 2HB ALA 111 2HB ALA 111 4.090 7.429 4.683
855 3HB ALA 111 3HB ALA 111 4.488 5.903 3.890
856 H VAL 112 H VAL 112 7.386 5.751 5.477
857 HA VAL 112 HA VAL 112 7.588 3.053 4.758
858 HB VAL 112 HB VAL 112 9.755 4.772 5.951
859 1HG1 VAL 112 1HG1 VAL 112 9.771 2.069 5.321
860 2HG1 VAL 112 2HG1 VAL 112 11.181 3.101 5.560
861 3HG1 VAL 112 3HG1 VAL 112 10.541 2.843 3.937
862 1HG2 VAL 112 1HG2 VAL 112 8.443 4.765 3.319
863 2HG2 VAL 112 2HG2 VAL 112 10.207 4.785 3.282
864 3HG2 VAL 112 3HG2 VAL 112 9.328 6.047 4.145
865 H ALA 113 H ALA 113 7.646 4.647 7.833
866 HA ALA 113 HA ALA 113 8.742 2.597 9.417
867 1HB ALA 113 1HB ALA 113 6.593 4.512 10.279
868 2HB ALA 113 2HB ALA 113 8.280 4.984 10.095
869 3HB ALA 113 3HB ALA 113 7.835 3.758 11.277
870 H LEU 114 H LEU 114 5.443 3.411 8.524
871 HA LEU 114 HA LEU 114 4.217 1.264 9.902
872 1HB LEU 114 2HB LEU 114 3.063 3.352 9.432
873 2HB LEU 114 1HB LEU 114 3.203 3.059 7.712
874 HG LEU 114 HG LEU 114 1.815 0.914 8.208
875 1HD1 LEU 114 1HD1 LEU 114 2.022 1.219 10.696
876 2HD1 LEU 114 2HD1 LEU 114 0.374 1.014 10.099
877 3HD1 LEU 114 3HD1 LEU 114 0.958 2.618 10.540
878 1HD2 LEU 114 1HD2 LEU 114 1.205 3.173 7.062
879 2HD2 LEU 114 2HD2 LEU 114 0.290 3.457 8.542
880 3HD2 LEU 114 3HD2 LEU 114 -0.074 2.058 7.538
881 H VAL 115 H VAL 115 5.601 1.626 6.742
882 HA VAL 115 HA VAL 115 4.257 -0.676 5.664
883 HB VAL 115 HB VAL 115 5.086 1.271 4.256
884 1HG1 VAL 115 1HG1 VAL 115 7.414 1.159 5.294
885 2HG1 VAL 115 2HG1 VAL 115 7.319 1.380 3.552
886 3HG1 VAL 115 3HG1 VAL 115 7.699 -0.207 4.222
887 1HG2 VAL 115 1HG2 VAL 115 5.959 -1.457 3.328
888 2HG2 VAL 115 2HG2 VAL 115 5.391 -0.112 2.340
889 3HG2 VAL 115 3HG2 VAL 115 4.272 -0.947 3.417
890 H GLU 116 H GLU 116 7.503 0.002 6.894
891 HA GLU 116 HA GLU 116 8.586 -2.544 6.320
892 1HB GLU 116 2HB GLU 116 9.363 -0.459 8.360
893 2HB GLU 116 1HB GLU 116 10.305 -1.909 8.041
894 1HG GLU 116 2HG GLU 116 10.636 -1.208 5.737
895 2HG GLU 116 1HG GLU 116 9.651 0.226 6.023
896 H ARG 117 H ARG 117 7.099 -1.189 9.244
897 HA ARG 117 HA ARG 117 7.448 -3.406 10.910
898 1HB ARG 117 2HB ARG 117 5.674 -2.462 12.278
899 2HB ARG 117 1HB ARG 117 6.730 -1.180 11.699
900 1HG ARG 117 2HG ARG 117 5.135 -0.293 10.327
901 2HG ARG 117 1HG ARG 117 4.292 -1.828 10.124
902 1HD ARG 117 2HD ARG 117 2.892 -0.456 11.454
903 2HD ARG 117 1HD ARG 117 3.612 -1.645 12.540
904 HE ARG 117 HE ARG 117 5.171 0.715 12.480
905 1HH1 ARG 117 1HH1 ARG 117 2.173 -0.553 13.735
906 2HH1 ARG 117 2HH1 ARG 117 2.141 0.521 15.092
907 1HH2 ARG 117 1HH2 ARG 117 5.129 2.133 14.266
908 2HH2 ARG 117 2HH2 ARG 117 3.818 2.046 15.394
909 H ALA 118 H ALA 118 5.241 -2.822 8.326
910 HA ALA 118 HA ALA 118 3.286 -4.750 9.008
911 1HB ALA 118 1HB ALA 118 2.384 -3.372 7.455
912 2HB ALA 118 2HB ALA 118 3.014 -4.582 6.339
913 3HB ALA 118 3HB ALA 118 3.926 -3.104 6.643
914 H ILE 119 H ILE 119 6.183 -4.837 6.993
915 HA ILE 119 HA ILE 119 5.793 -7.537 6.169
916 HB ILE 119 HB ILE 119 8.342 -5.935 6.101
917 1HG1 ILE 119 2HG1 ILE 119 6.684 -6.170 3.668
918 2HG1 ILE 119 1HG1 ILE 119 6.037 -5.128 4.930
919 1HG2 ILE 119 1HG2 ILE 119 7.404 -8.349 4.568
920 2HG2 ILE 119 2HG2 ILE 119 8.776 -8.238 5.672
921 3HG2 ILE 119 3HG2 ILE 119 8.814 -7.388 4.125
922 1HD1 ILE 119 1HD1 ILE 119 8.767 -4.891 3.704
923 2HD1 ILE 119 2HD1 ILE 119 8.070 -3.820 4.918
924 3HD1 ILE 119 3HD1 ILE 119 7.372 -3.895 3.302
925 H SER 120 H SER 120 7.424 -5.917 8.759
926 HA SER 120 HA SER 120 9.040 -8.091 9.600
927 1HB SER 120 2HB SER 120 9.419 -5.658 10.172
928 2HB SER 120 1HB SER 120 8.078 -5.791 11.310
929 HG SER 120 HG SER 120 9.344 -6.794 12.652
930 H HIS 121 H HIS 121 5.985 -6.743 10.829
931 HA HIS 121 HA HIS 121 5.591 -8.646 12.851
932 1HB HIS 121 2HB HIS 121 3.772 -6.766 11.387
933 2HB HIS 121 1HB HIS 121 3.098 -7.950 12.500
934 HD1 HIS 121 1HD HIS 121 4.114 -4.582 12.461
935 HD2 HIS 121 2HD HIS 121 4.638 -7.707 15.149
936 HE1 HIS 121 1HE HIS 121 4.658 -3.492 14.661
937 HE2 HIS 121 2HE HIS 121 4.929 -5.401 16.284
938 H TYR 122 H TYR 122 5.150 -8.827 9.447
939 HA TYR 122 HA TYR 122 3.237 -10.911 9.376
940 1HB TYR 122 2HB TYR 122 4.630 -9.333 7.495
941 2HB TYR 122 1HB TYR 122 4.966 -11.013 7.093
942 HD1 TYR 122 1HD TYR 122 1.966 -9.107 8.268
943 HD2 TYR 122 2HD TYR 122 3.604 -11.823 5.430
944 HE1 TYR 122 1HE TYR 122 -0.227 -9.273 7.169
945 HE2 TYR 122 2HE TYR 122 1.416 -11.995 4.324
946 HH TYR 122 HH TYR 122 -1.241 -9.918 5.156
947 H GLN 123 H GLN 123 6.758 -10.977 8.819
948 HA GLN 123 HA GLN 123 6.857 -13.826 8.931
949 1HB GLN 123 2HB GLN 123 8.471 -11.966 7.828
950 2HB GLN 123 1HB GLN 123 9.354 -12.289 9.314
951 1HG GLN 123 2HG GLN 123 10.161 -14.175 8.492
952 2HG GLN 123 1HG GLN 123 8.541 -14.757 8.110
953 1HE2 GLN 123 1HE2 GLN 123 11.389 -14.414 6.771
954 2HE2 GLN 123 2HE2 GLN 123 10.965 -13.992 5.150
955 H GLU 124 H GLU 124 9.048 -14.462 10.409
956 HA GLU 124 HA GLU 124 8.686 -13.442 13.108
957 1HB GLU 124 2HB GLU 124 8.391 -15.741 14.035
958 2HB GLU 124 1HB GLU 124 7.024 -15.183 13.080
959 1HG GLU 124 2HG GLU 124 7.150 -17.073 11.942
960 2HG GLU 124 1HG GLU 124 8.670 -16.492 11.262
Start of MODEL 7
1 1H MET 1 1HT MET 1 15.681 -13.134 5.706
2 2H MET 1 2HT MET 1 17.107 -12.304 5.236
3 3H MET 1 3HT MET 1 17.172 -13.493 6.470
4 HA MET 1 HA MET 1 17.693 -13.846 3.844
5 1HB MET 1 2HB MET 1 18.364 -15.135 5.930
6 2HB MET 1 1HB MET 1 16.826 -15.977 5.801
7 1HG MET 1 2HG MET 1 17.700 -17.401 4.363
8 2HG MET 1 1HG MET 1 18.106 -16.078 3.270
9 1HE MET 1 1HE MET 1 19.300 -17.306 6.800
10 2HE MET 1 2HE MET 1 20.894 -17.954 6.416
11 3HE MET 1 3HE MET 1 19.448 -18.733 5.776
12 H GLN 2 H GLN 2 15.060 -12.755 3.849
13 HA GLN 2 HA GLN 2 13.610 -14.943 2.517
14 1HB GLN 2 2HB GLN 2 12.756 -13.232 4.713
15 2HB GLN 2 1HB GLN 2 11.647 -13.163 3.350
16 1HG GLN 2 2HG GLN 2 10.807 -14.875 4.661
17 2HG GLN 2 1HG GLN 2 11.720 -15.723 3.415
18 1HE2 GLN 2 1HE2 GLN 2 11.048 -15.741 6.579
19 2HE2 GLN 2 2HE2 GLN 2 12.489 -16.464 7.203
20 H ARG 3 H ARG 3 11.756 -13.946 1.124
21 HA ARG 3 HA ARG 3 12.971 -12.446 -0.913
22 1HB ARG 3 2HB ARG 3 10.904 -14.056 -0.948
23 2HB ARG 3 1HB ARG 3 10.002 -12.575 -0.658
24 1HG ARG 3 2HG ARG 3 9.980 -12.319 -2.865
25 2HG ARG 3 1HG ARG 3 11.687 -11.893 -2.728
26 1HD ARG 3 2HD ARG 3 11.797 -14.614 -2.728
27 2HD ARG 3 1HD ARG 3 10.422 -14.318 -3.791
28 HE ARG 3 HE ARG 3 13.194 -13.716 -4.314
29 1HH1 ARG 3 1HH1 ARG 3 9.879 -13.045 -5.182
30 2HH1 ARG 3 2HH1 ARG 3 10.282 -12.464 -6.763
31 1HH2 ARG 3 1HH2 ARG 3 13.722 -12.948 -6.388
32 2HH2 ARG 3 2HH2 ARG 3 12.463 -12.412 -7.449
33 H GLY 4 H GLY 4 10.277 -11.521 1.175
34 1HA GLY 4 2HA GLY 4 9.539 -9.461 1.887
35 2HA GLY 4 1HA GLY 4 11.236 -9.008 1.901
36 H ILE 5 H ILE 5 8.305 -9.095 -0.015
37 HA ILE 5 HA ILE 5 9.526 -7.235 -1.944
38 HB ILE 5 HB ILE 5 6.912 -8.670 -2.309
39 1HG1 ILE 5 2HG1 ILE 5 8.465 -10.082 -3.930
40 2HG1 ILE 5 1HG1 ILE 5 9.692 -9.651 -2.741
41 1HG2 ILE 5 1HG2 ILE 5 6.948 -7.958 -4.487
42 2HG2 ILE 5 2HG2 ILE 5 8.700 -7.781 -4.516
43 3HG2 ILE 5 3HG2 ILE 5 7.709 -6.594 -3.672
44 1HD1 ILE 5 1HD1 ILE 5 7.971 -11.787 -2.604
45 2HD1 ILE 5 2HD1 ILE 5 7.244 -10.607 -1.514
46 3HD1 ILE 5 3HD1 ILE 5 8.912 -11.120 -1.270
47 H VAL 6 H VAL 6 9.083 -5.162 -1.559
48 HA VAL 6 HA VAL 6 6.489 -4.507 -0.335
49 HB VAL 6 HB VAL 6 8.362 -3.701 0.980
50 1HG1 VAL 6 1HG1 VAL 6 9.698 -3.403 -1.343
51 2HG1 VAL 6 2HG1 VAL 6 10.177 -2.643 0.166
52 3HG1 VAL 6 3HG1 VAL 6 9.247 -1.731 -1.024
53 1HG2 VAL 6 1HG2 VAL 6 7.441 -1.159 -0.204
54 2HG2 VAL 6 2HG2 VAL 6 7.370 -1.728 1.463
55 3HG2 VAL 6 3HG2 VAL 6 6.177 -2.288 0.289
56 H TRP 7 H TRP 7 5.012 -3.854 -1.699
57 HA TRP 7 HA TRP 7 5.843 -2.382 -4.102
58 1HB TRP 7 2HB TRP 7 3.480 -4.159 -3.531
59 2HB TRP 7 1HB TRP 7 3.468 -3.027 -4.881
60 HD1 TRP 7 HD1 TRP 7 6.889 -4.279 -4.449
61 HE1 TRP 7 1HE TRP 7 7.428 -6.095 -6.181
62 HE3 TRP 7 3HE TRP 7 2.142 -5.277 -6.072
63 HZ2 TRP 7 2HZ TRP 7 6.025 -7.762 -7.973
64 HZ3 TRP 7 3HZ TRP 7 1.830 -7.008 -7.795
65 HH2 TRP 7 HH2 TRP 7 3.736 -8.225 -8.722
66 H VAL 8 H VAL 8 4.770 -0.473 -4.668
67 HA VAL 8 HA VAL 8 2.970 0.660 -2.636
68 HB VAL 8 HB VAL 8 4.771 2.657 -3.761
69 1HG1 VAL 8 1HG1 VAL 8 3.900 1.881 -0.991
70 2HG1 VAL 8 2HG1 VAL 8 3.331 3.236 -1.966
71 3HG1 VAL 8 3HG1 VAL 8 4.976 3.236 -1.326
72 1HG2 VAL 8 1HG2 VAL 8 6.624 1.910 -2.087
73 2HG2 VAL 8 2HG2 VAL 8 6.571 1.216 -3.709
74 3HG2 VAL 8 3HG2 VAL 8 5.942 0.304 -2.334
75 H VAL 9 H VAL 9 1.477 2.181 -3.404
76 HA VAL 9 HA VAL 9 1.473 2.530 -6.330
77 HB VAL 9 HB VAL 9 -1.177 2.781 -5.167
78 1HG1 VAL 9 1HG1 VAL 9 0.175 1.519 -7.454
79 2HG1 VAL 9 2HG1 VAL 9 -1.273 2.489 -7.406
80 3HG1 VAL 9 3HG1 VAL 9 -1.349 0.782 -6.982
81 1HG2 VAL 9 1HG2 VAL 9 -1.461 0.294 -4.803
82 2HG2 VAL 9 2HG2 VAL 9 -0.563 1.150 -3.549
83 3HG2 VAL 9 3HG2 VAL 9 0.298 0.185 -4.747
84 H ASP 10 H ASP 10 2.147 4.550 -6.645
85 HA ASP 10 HA ASP 10 0.545 6.770 -6.004
86 1HB ASP 10 2HB ASP 10 2.112 6.059 -3.850
87 2HB ASP 10 1HB ASP 10 3.078 7.292 -4.646
88 H ASP 11 H ASP 11 0.753 7.956 -7.700
89 HA ASP 11 HA ASP 11 1.517 8.752 -9.683
90 1HB ASP 11 2HB ASP 11 2.818 9.970 -7.515
91 2HB ASP 11 1HB ASP 11 4.056 9.743 -8.744
92 H ASP 12 H ASP 12 4.788 8.143 -8.531
93 HA ASP 12 HA ASP 12 5.512 5.768 -9.511
94 1HB ASP 12 2HB ASP 12 4.514 6.225 -11.669
95 2HB ASP 12 1HB ASP 12 5.432 7.716 -11.818
96 H SER 13 H SER 13 7.182 8.195 -11.333
97 HA SER 13 HA SER 13 9.678 7.815 -10.529
98 1HB SER 13 2HB SER 13 10.053 10.303 -10.959
99 2HB SER 13 1HB SER 13 9.312 9.361 -12.254
100 HG SER 13 HG SER 13 7.490 10.413 -11.991
101 H SER 14 H SER 14 8.153 10.681 -9.211
102 HA SER 14 HA SER 14 9.924 11.092 -7.152
103 1HB SER 14 2HB SER 14 8.327 12.786 -7.877
104 2HB SER 14 1HB SER 14 6.995 11.844 -7.211
105 HG SER 14 HG SER 14 8.845 12.224 -5.308
106 H ILE 15 H ILE 15 7.001 9.077 -7.065
107 HA ILE 15 HA ILE 15 7.283 8.616 -4.254
108 HB ILE 15 HB ILE 15 5.551 7.133 -6.229
109 1HG1 ILE 15 2HG1 ILE 15 5.185 9.620 -6.034
110 2HG1 ILE 15 1HG1 ILE 15 3.790 8.636 -5.614
111 1HG2 ILE 15 1HG2 ILE 15 4.552 7.180 -3.544
112 2HG2 ILE 15 2HG2 ILE 15 6.199 6.556 -3.539
113 3HG2 ILE 15 3HG2 ILE 15 4.971 5.793 -4.549
114 1HD1 ILE 15 1HD1 ILE 15 4.021 9.094 -3.335
115 2HD1 ILE 15 2HD1 ILE 15 4.341 10.634 -4.134
116 3HD1 ILE 15 3HD1 ILE 15 5.680 9.659 -3.527
117 H ARG 16 H ARG 16 8.524 7.202 -7.124
118 HA ARG 16 HA ARG 16 9.138 4.657 -5.973
119 1HB ARG 16 2HB ARG 16 8.828 5.102 -8.451
120 2HB ARG 16 1HB ARG 16 10.411 5.866 -8.425
121 1HG ARG 16 2HG ARG 16 10.918 3.459 -7.230
122 2HG ARG 16 1HG ARG 16 9.695 3.036 -8.426
123 1HD ARG 16 2HD ARG 16 11.934 4.790 -9.277
124 2HD ARG 16 1HD ARG 16 12.285 3.083 -9.008
125 HE ARG 16 HE ARG 16 10.601 4.227 -11.087
126 1HH1 ARG 16 1HH1 ARG 16 11.761 1.318 -9.514
127 2HH1 ARG 16 2HH1 ARG 16 11.321 0.293 -10.839
128 1HH2 ARG 16 1HH2 ARG 16 10.033 2.878 -12.804
129 2HH2 ARG 16 2HH2 ARG 16 10.341 1.177 -12.705
130 H TRP 17 H TRP 17 10.737 7.741 -6.307
131 HA TRP 17 HA TRP 17 13.325 6.796 -5.664
132 1HB TRP 17 2HB TRP 17 12.919 8.921 -6.868
133 2HB TRP 17 1HB TRP 17 12.253 9.602 -5.386
134 HD1 TRP 17 HD1 TRP 17 15.603 8.372 -6.849
135 HE1 TRP 17 1HE TRP 17 17.515 9.449 -5.501
136 HE3 TRP 17 3HE TRP 17 12.843 10.670 -3.210
137 HZ2 TRP 17 2HZ TRP 17 17.813 11.058 -3.200
138 HZ3 TRP 17 3HZ TRP 17 14.015 11.955 -1.472
139 HH2 TRP 17 HH2 TRP 17 16.449 12.143 -1.468
140 H VAL 18 H VAL 18 11.099 8.788 -3.741
141 HA VAL 18 HA VAL 18 12.545 8.809 -1.408
142 HB VAL 18 HB VAL 18 9.612 8.719 -1.062
143 1HG1 VAL 18 1HG1 VAL 18 11.720 9.504 0.480
144 2HG1 VAL 18 2HG1 VAL 18 10.047 10.012 0.713
145 3HG1 VAL 18 3HG1 VAL 18 11.163 11.041 -0.182
146 1HG2 VAL 18 1HG2 VAL 18 10.956 10.455 -3.020
147 2HG2 VAL 18 2HG2 VAL 18 9.916 11.292 -1.871
148 3HG2 VAL 18 3HG2 VAL 18 9.258 10.002 -2.875
149 H LEU 19 H LEU 19 9.726 6.708 -1.852
150 HA LEU 19 HA LEU 19 10.313 5.289 0.533
151 1HB LEU 19 2HB LEU 19 8.067 5.683 -0.984
152 2HB LEU 19 1HB LEU 19 8.416 3.986 -1.249
153 HG LEU 19 HG LEU 19 6.852 4.215 0.572
154 1HD1 LEU 19 1HD1 LEU 19 8.779 3.489 2.441
155 2HD1 LEU 19 2HD1 LEU 19 9.461 3.024 0.885
156 3HD1 LEU 19 3HD1 LEU 19 7.880 2.417 1.370
157 1HD2 LEU 19 1HD2 LEU 19 7.554 5.367 2.671
158 2HD2 LEU 19 2HD2 LEU 19 7.277 6.444 1.303
159 3HD2 LEU 19 3HD2 LEU 19 8.923 6.032 1.782
160 H GLU 20 H GLU 20 10.510 4.335 -2.856
161 HA GLU 20 HA GLU 20 11.237 1.666 -2.363
162 1HB GLU 20 2HB GLU 20 12.086 3.091 -4.812
163 2HB GLU 20 1HB GLU 20 11.466 1.461 -4.651
164 1HG GLU 20 2HG GLU 20 9.958 4.020 -4.457
165 2HG GLU 20 1HG GLU 20 9.873 2.842 -5.763
166 H ARG 21 H ARG 21 13.234 4.285 -3.681
167 HA ARG 21 HA ARG 21 15.639 2.954 -3.726
168 1HB ARG 21 2HB ARG 21 15.179 5.854 -3.043
169 2HB ARG 21 1HB ARG 21 16.748 5.175 -3.436
170 1HG ARG 21 2HG ARG 21 14.772 4.539 -5.457
171 2HG ARG 21 1HG ARG 21 14.927 6.278 -5.203
172 1HD ARG 21 2HD ARG 21 17.035 6.352 -6.013
173 2HD ARG 21 1HD ARG 21 17.453 4.768 -5.365
174 HE ARG 21 HE ARG 21 15.773 5.077 -7.768
175 1HH1 ARG 21 1HH1 ARG 21 18.535 3.661 -6.148
176 2HH1 ARG 21 2HH1 ARG 21 18.911 2.603 -7.463
177 1HH2 ARG 21 1HH2 ARG 21 16.291 3.686 -9.495
178 2HH2 ARG 21 2HH2 ARG 21 17.650 2.620 -9.356
179 H ALA 22 H ALA 22 14.252 4.668 -0.950
180 HA ALA 22 HA ALA 22 16.465 4.082 0.744
181 1HB ALA 22 1HB ALA 22 14.162 4.613 2.311
182 2HB ALA 22 2HB ALA 22 14.112 5.668 0.899
183 3HB ALA 22 3HB ALA 22 15.520 5.684 1.961
184 H LEU 23 H LEU 23 13.559 2.440 -0.131
185 HA LEU 23 HA LEU 23 13.697 0.582 2.073
186 1HB LEU 23 2HB LEU 23 11.575 1.356 0.880
187 2HB LEU 23 1HB LEU 23 12.034 0.269 -0.414
188 HG LEU 23 HG LEU 23 11.665 -1.633 0.898
189 1HD1 LEU 23 1HD1 LEU 23 11.020 -1.174 3.427
190 2HD1 LEU 23 2HD1 LEU 23 12.078 0.217 3.183
191 3HD1 LEU 23 3HD1 LEU 23 12.692 -1.409 2.925
192 1HD2 LEU 23 1HD2 LEU 23 9.624 -0.286 0.259
193 2HD2 LEU 23 2HD2 LEU 23 9.574 0.251 1.940
194 3HD2 LEU 23 3HD2 LEU 23 9.412 -1.462 1.557
195 H ALA 24 H ALA 24 14.907 0.856 -1.135
196 HA ALA 24 HA ALA 24 15.435 -1.891 -1.609
197 1HB ALA 24 1HB ALA 24 17.281 -0.698 -3.144
198 2HB ALA 24 2HB ALA 24 16.222 0.682 -2.855
199 3HB ALA 24 3HB ALA 24 15.578 -0.784 -3.596
200 H GLY 25 H GLY 25 17.135 0.767 -0.048
201 1HA GLY 25 2HA GLY 25 19.635 -0.527 0.274
202 2HA GLY 25 1HA GLY 25 19.022 0.789 1.271
203 H ALA 26 H ALA 26 16.578 -0.834 1.870
204 HA ALA 26 HA ALA 26 17.585 -2.106 4.220
205 1HB ALA 26 1HB ALA 26 14.893 -1.539 3.089
206 2HB ALA 26 2HB ALA 26 15.563 -1.127 4.668
207 3HB ALA 26 3HB ALA 26 15.041 -2.779 4.336
208 H GLY 27 H GLY 27 17.004 -3.106 1.008
209 1HA GLY 27 2HA GLY 27 17.765 -5.206 0.223
210 2HA GLY 27 1HA GLY 27 17.504 -5.873 1.823
211 H LEU 28 H LEU 28 14.958 -3.998 0.239
212 HA LEU 28 HA LEU 28 13.559 -6.536 -0.212
213 1HB LEU 28 2HB LEU 28 11.974 -4.090 0.307
214 2HB LEU 28 1HB LEU 28 11.620 -5.761 0.702
215 HG LEU 28 HG LEU 28 13.670 -5.375 2.366
216 1HD1 LEU 28 1HD1 LEU 28 12.794 -2.718 1.560
217 2HD1 LEU 28 2HD1 LEU 28 14.326 -3.260 2.236
218 3HD1 LEU 28 3HD1 LEU 28 12.946 -2.982 3.297
219 1HD2 LEU 28 1HD2 LEU 28 11.269 -4.219 3.511
220 2HD2 LEU 28 2HD2 LEU 28 12.093 -5.729 3.902
221 3HD2 LEU 28 3HD2 LEU 28 10.938 -5.673 2.570
222 H THR 29 H THR 29 11.684 -6.345 -1.766
223 HA THR 29 HA THR 29 12.644 -5.021 -4.171
224 HB THR 29 HB THR 29 10.254 -6.825 -3.719
225 HG1 THR 29 1HG THR 29 12.906 -7.334 -4.133
226 1HG2 THR 29 1HG2 THR 29 11.441 -6.540 -6.402
227 2HG2 THR 29 2HG2 THR 29 10.439 -5.209 -5.823
228 3HG2 THR 29 3HG2 THR 29 9.773 -6.839 -5.916
229 H CYS 30 H CYS 30 12.210 -2.916 -4.200
230 HA CYS 30 HA CYS 30 9.554 -1.971 -3.361
231 1HB CYS 30 2HB CYS 30 10.713 0.289 -3.464
232 2HB CYS 30 1HB CYS 30 11.212 -0.804 -2.182
233 HG CYS 30 HG CYS 30 13.026 -0.965 -4.616
234 H THR 31 H THR 31 8.159 -1.848 -4.967
235 HA THR 31 HA THR 31 9.023 -0.560 -7.468
236 HB THR 31 HB THR 31 8.542 -3.118 -7.592
237 HG1 THR 31 1HG THR 31 7.305 -2.708 -9.601
238 1HG2 THR 31 1HG2 THR 31 6.494 -3.188 -6.345
239 2HG2 THR 31 2HG2 THR 31 6.186 -3.654 -8.016
240 3HG2 THR 31 3HG2 THR 31 5.748 -2.046 -7.448
241 H THR 32 H THR 32 7.345 0.725 -8.497
242 HA THR 32 HA THR 32 5.137 1.385 -6.677
243 HB THR 32 HB THR 32 5.395 3.736 -7.236
244 HG1 THR 32 1HG THR 32 7.740 3.008 -8.642
245 1HG2 THR 32 1HG2 THR 32 8.183 3.015 -6.600
246 2HG2 THR 32 2HG2 THR 32 6.930 2.427 -5.504
247 3HG2 THR 32 3HG2 THR 32 7.097 4.160 -5.812
248 H PHE 33 H PHE 33 3.336 2.545 -7.715
249 HA PHE 33 HA PHE 33 2.992 1.847 -10.537
250 1HB PHE 33 2HB PHE 33 1.003 1.255 -8.365
251 2HB PHE 33 1HB PHE 33 0.779 0.933 -10.069
252 HD1 PHE 33 1HD PHE 33 3.071 0.169 -7.266
253 HD2 PHE 33 2HD PHE 33 1.301 -1.219 -10.864
254 HE1 PHE 33 1HE PHE 33 4.077 -2.035 -6.899
255 HE2 PHE 33 2HE PHE 33 2.306 -3.429 -10.511
256 HZ PHE 33 HZ PHE 33 3.690 -3.851 -8.528
257 H GLU 34 H GLU 34 0.809 2.793 -11.345
258 HA GLU 34 HA GLU 34 1.019 5.575 -11.214
259 1HB GLU 34 2HB GLU 34 -0.918 5.642 -12.641
260 2HB GLU 34 1HB GLU 34 0.123 4.316 -13.132
261 1HG GLU 34 2HG GLU 34 -1.644 3.170 -11.323
262 2HG GLU 34 1HG GLU 34 -2.631 4.283 -12.264
263 H ASN 35 H ASN 35 -1.399 3.466 -9.579
264 HA ASN 35 HA ASN 35 -1.761 5.396 -7.545
265 1HB ASN 35 2HB ASN 35 -4.137 5.970 -8.018
266 2HB ASN 35 1HB ASN 35 -3.001 6.643 -9.183
267 1HD2 ASN 35 1HD2 ASN 35 -5.142 3.873 -8.645
268 2HD2 ASN 35 2HD2 ASN 35 -5.564 3.658 -10.305
269 H GLY 36 H GLY 36 -3.035 2.619 -9.217
270 1HA GLY 36 2HA GLY 36 -3.161 1.015 -6.933
271 2HA GLY 36 1HA GLY 36 -4.754 1.705 -7.183
272 H ASN 37 H ASN 37 -5.188 1.678 -9.763
273 HA ASN 37 HA ASN 37 -5.931 -0.898 -10.367
274 1HB ASN 37 2HB ASN 37 -5.407 1.462 -12.166
275 2HB ASN 37 1HB ASN 37 -6.116 -0.045 -12.744
276 1HD2 ASN 37 1HD2 ASN 37 -7.821 -0.792 -10.870
277 2HD2 ASN 37 2HD2 ASN 37 -9.041 0.400 -10.599
278 H GLU 38 H GLU 38 -2.859 0.677 -10.972
279 HA GLU 38 HA GLU 38 -1.869 -1.197 -12.829
280 1HB GLU 38 2HB GLU 38 -0.940 1.163 -11.748
281 2HB GLU 38 1HB GLU 38 0.158 -0.032 -11.091
282 1HG GLU 38 2HG GLU 38 -0.442 -0.080 -14.003
283 2HG GLU 38 1HG GLU 38 0.663 1.137 -13.368
284 H VAL 39 H VAL 39 -1.373 -0.976 -9.245
285 HA VAL 39 HA VAL 39 0.225 -3.254 -9.027
286 HB VAL 39 HB VAL 39 -1.834 -2.462 -6.969
287 1HG1 VAL 39 1HG1 VAL 39 0.077 -3.334 -5.470
288 2HG1 VAL 39 2HG1 VAL 39 0.671 -4.108 -6.940
289 3HG1 VAL 39 3HG1 VAL 39 -0.931 -4.504 -6.318
290 1HG2 VAL 39 1HG2 VAL 39 0.943 -1.502 -6.707
291 2HG2 VAL 39 2HG2 VAL 39 -0.577 -0.729 -6.273
292 3HG2 VAL 39 3HG2 VAL 39 -0.032 -0.715 -7.947
293 H LEU 40 H LEU 40 -3.267 -3.019 -9.322
294 HA LEU 40 HA LEU 40 -3.943 -5.615 -8.538
295 1HB LEU 40 2HB LEU 40 -5.370 -4.179 -10.749
296 2HB LEU 40 1HB LEU 40 -6.031 -5.275 -9.550
297 HG LEU 40 HG LEU 40 -4.998 -2.502 -8.970
298 1HD1 LEU 40 1HD1 LEU 40 -7.098 -2.681 -10.352
299 2HD1 LEU 40 2HD1 LEU 40 -7.240 -1.797 -8.831
300 3HD1 LEU 40 3HD1 LEU 40 -7.837 -3.449 -8.951
301 1HD2 LEU 40 1HD2 LEU 40 -6.045 -4.722 -7.286
302 2HD2 LEU 40 2HD2 LEU 40 -6.430 -3.059 -6.842
303 3HD2 LEU 40 3HD2 LEU 40 -4.747 -3.573 -6.958
304 H ALA 41 H ALA 41 -3.165 -4.360 -11.777
305 HA ALA 41 HA ALA 41 -3.512 -6.809 -13.118
306 1HB ALA 41 1HB ALA 41 -1.635 -4.630 -13.970
307 2HB ALA 41 2HB ALA 41 -3.386 -4.516 -14.156
308 3HB ALA 41 3HB ALA 41 -2.492 -5.787 -14.991
309 H ALA 42 H ALA 42 -0.646 -5.240 -11.836
310 HA ALA 42 HA ALA 42 1.205 -7.215 -12.606
311 1HB ALA 42 1HB ALA 42 2.782 -6.009 -11.470
312 2HB ALA 42 2HB ALA 42 1.697 -5.629 -10.132
313 3HB ALA 42 3HB ALA 42 1.539 -4.776 -11.668
314 H LEU 43 H LEU 43 -0.718 -6.796 -9.674
315 HA LEU 43 HA LEU 43 0.453 -8.801 -8.122
316 1HB LEU 43 2HB LEU 43 -2.246 -7.516 -8.162
317 2HB LEU 43 1HB LEU 43 -1.977 -8.924 -7.149
318 HG LEU 43 HG LEU 43 -0.370 -6.385 -6.961
319 1HD1 LEU 43 1HD1 LEU 43 -2.682 -5.981 -6.311
320 2HD1 LEU 43 2HD1 LEU 43 -1.644 -6.014 -4.885
321 3HD1 LEU 43 3HD1 LEU 43 -2.651 -7.406 -5.274
322 1HD2 LEU 43 1HD2 LEU 43 1.019 -7.855 -5.967
323 2HD2 LEU 43 2HD2 LEU 43 -0.255 -9.059 -5.753
324 3HD2 LEU 43 3HD2 LEU 43 -0.114 -7.712 -4.620
325 H ALA 44 H ALA 44 -1.728 -8.999 -10.783
326 HA ALA 44 HA ALA 44 -2.967 -11.430 -10.394
327 1HB ALA 44 1HB ALA 44 -3.203 -11.547 -12.820
328 2HB ALA 44 2HB ALA 44 -1.988 -10.283 -12.998
329 3HB ALA 44 3HB ALA 44 -3.528 -9.921 -12.217
330 H SER 45 H SER 45 0.364 -10.852 -11.042
331 HA SER 45 HA SER 45 0.760 -13.732 -11.344
332 1HB SER 45 2HB SER 45 1.824 -11.504 -12.966
333 2HB SER 45 1HB SER 45 2.963 -12.793 -12.578
334 HG SER 45 HG SER 45 1.904 -13.317 -14.477
335 H LYS 46 H LYS 46 1.149 -11.346 -9.197
336 HA LYS 46 HA LYS 46 3.207 -12.757 -7.804
337 1HB LYS 46 2HB LYS 46 4.048 -10.729 -9.514
338 2HB LYS 46 1HB LYS 46 4.038 -9.979 -7.925
339 1HG LYS 46 2HG LYS 46 5.240 -12.526 -7.657
340 2HG LYS 46 1HG LYS 46 5.963 -11.728 -9.055
341 1HD LYS 46 2HD LYS 46 6.316 -9.711 -7.630
342 2HD LYS 46 1HD LYS 46 5.764 -10.657 -6.245
343 1HE LYS 46 2HE LYS 46 7.842 -11.392 -5.971
344 2HE LYS 46 1HE LYS 46 7.714 -12.220 -7.522
345 1HZ LYS 46 1HZ LYS 46 8.373 -9.367 -7.532
346 2HZ LYS 46 2HZ LYS 46 8.860 -10.589 -8.594
347 3HZ LYS 46 3HZ LYS 46 9.581 -10.458 -7.070
348 H THR 47 H THR 47 3.472 -12.005 -5.605
349 HA THR 47 HA THR 47 1.506 -10.050 -4.727
350 HB THR 47 HB THR 47 1.822 -12.802 -3.531
351 HG1 THR 47 1HG THR 47 -0.095 -11.621 -5.193
352 1HG2 THR 47 1HG2 THR 47 -0.272 -10.837 -2.709
353 2HG2 THR 47 2HG2 THR 47 1.313 -10.850 -1.931
354 3HG2 THR 47 3HG2 THR 47 0.289 -12.286 -1.879
355 HA PRO 48 HA PRO 48 5.255 -9.044 -2.430
356 1HB PRO 48 2HB PRO 48 4.574 -6.535 -1.748
357 2HB PRO 48 1HB PRO 48 5.097 -6.938 -3.388
358 1HG PRO 48 2HG PRO 48 2.329 -6.540 -2.326
359 2HG PRO 48 1HG PRO 48 3.031 -5.981 -3.854
360 1HD PRO 48 2HD PRO 48 1.444 -8.194 -3.631
361 2HD PRO 48 1HD PRO 48 2.665 -7.982 -4.896
362 H ASP 49 H ASP 49 5.695 -8.465 -0.166
363 HA ASP 49 HA ASP 49 3.791 -9.697 1.582
364 1HB ASP 49 2HB ASP 49 6.411 -8.302 2.170
365 2HB ASP 49 1HB ASP 49 5.449 -9.161 3.371
366 H VAL 50 H VAL 50 4.476 -6.427 0.631
367 HA VAL 50 HA VAL 50 2.338 -5.519 2.401
368 HB VAL 50 HB VAL 50 4.331 -5.097 3.710
369 1HG1 VAL 50 1HG1 VAL 50 6.267 -4.182 2.947
370 2HG1 VAL 50 2HG1 VAL 50 5.457 -3.210 1.723
371 3HG1 VAL 50 3HG1 VAL 50 5.706 -4.935 1.455
372 1HG2 VAL 50 1HG2 VAL 50 2.446 -3.387 3.528
373 2HG2 VAL 50 2HG2 VAL 50 3.565 -2.435 2.554
374 3HG2 VAL 50 3HG2 VAL 50 3.972 -2.841 4.222
375 H LEU 51 H LEU 51 1.484 -3.385 1.772
376 HA LEU 51 HA LEU 51 2.340 -2.340 -0.788
377 1HB LEU 51 2HB LEU 51 0.746 -4.245 -1.263
378 2HB LEU 51 1HB LEU 51 -0.507 -3.274 -0.514
379 HG LEU 51 HG LEU 51 0.159 -1.467 -2.243
380 1HD1 LEU 51 1HD1 LEU 51 1.278 -2.124 -4.175
381 2HD1 LEU 51 2HD1 LEU 51 1.107 -3.842 -3.804
382 3HD1 LEU 51 3HD1 LEU 51 2.219 -2.839 -2.868
383 1HD2 LEU 51 1HD2 LEU 51 -1.472 -2.239 -3.749
384 2HD2 LEU 51 2HD2 LEU 51 -1.937 -2.906 -2.184
385 3HD2 LEU 51 3HD2 LEU 51 -1.137 -3.929 -3.377
386 H LEU 52 H LEU 52 2.410 -0.242 -0.519
387 HA LEU 52 HA LEU 52 0.446 1.063 1.231
388 1HB LEU 52 2HB LEU 52 3.163 1.316 1.173
389 2HB LEU 52 1HB LEU 52 2.679 2.651 0.147
390 HG LEU 52 HG LEU 52 1.631 2.242 2.942
391 1HD1 LEU 52 1HD1 LEU 52 3.190 4.314 3.279
392 2HD1 LEU 52 2HD1 LEU 52 4.065 3.617 1.916
393 3HD1 LEU 52 3HD1 LEU 52 3.835 2.677 3.392
394 1HD2 LEU 52 1HD2 LEU 52 0.181 3.814 2.329
395 2HD2 LEU 52 2HD2 LEU 52 0.981 4.027 0.770
396 3HD2 LEU 52 3HD2 LEU 52 1.543 4.923 2.183
397 H SER 53 H SER 53 -1.246 1.970 0.237
398 HA SER 53 HA SER 53 -0.898 2.906 -2.536
399 1HB SER 53 2HB SER 53 -3.371 1.866 -1.142
400 2HB SER 53 1HB SER 53 -3.357 2.557 -2.761
401 HG SER 53 HG SER 53 -3.086 0.478 -3.194
402 H ASP 54 H ASP 54 -1.944 4.821 -3.206
403 HA ASP 54 HA ASP 54 -2.096 6.842 -1.140
404 1HB ASP 54 2HB ASP 54 -1.121 7.035 -3.573
405 2HB ASP 54 1HB ASP 54 -2.797 7.356 -4.008
406 H ILE 55 H ILE 55 -3.996 8.536 -1.507
407 HA ILE 55 HA ILE 55 -6.499 7.283 -2.217
408 HB ILE 55 HB ILE 55 -6.260 6.544 0.074
409 1HG1 ILE 55 2HG1 ILE 55 -8.319 8.641 0.417
410 2HG1 ILE 55 1HG1 ILE 55 -8.479 7.592 -0.985
411 1HG2 ILE 55 1HG2 ILE 55 -6.452 8.335 1.890
412 2HG2 ILE 55 2HG2 ILE 55 -5.826 9.437 0.667
413 3HG2 ILE 55 3HG2 ILE 55 -4.883 8.039 1.157
414 1HD1 ILE 55 1HD1 ILE 55 -8.890 7.017 1.846
415 2HD1 ILE 55 2HD1 ILE 55 -7.977 5.787 0.972
416 3HD1 ILE 55 3HD1 ILE 55 -9.582 6.256 0.415
417 H ARG 56 H ARG 56 -5.956 9.049 -3.762
418 HA ARG 56 HA ARG 56 -7.747 11.147 -3.516
419 1HB ARG 56 2HB ARG 56 -6.150 13.083 -3.348
420 2HB ARG 56 1HB ARG 56 -6.367 12.177 -1.859
421 1HG ARG 56 2HG ARG 56 -4.244 10.906 -2.575
422 2HG ARG 56 1HG ARG 56 -4.000 12.251 -3.690
423 1HD ARG 56 2HD ARG 56 -4.660 13.254 -1.081
424 2HD ARG 56 1HD ARG 56 -3.317 12.118 -0.962
425 HE ARG 56 HE ARG 56 -2.979 14.028 -3.072
426 1HH1 ARG 56 1HH1 ARG 56 -2.600 13.503 0.359
427 2HH1 ARG 56 2HH1 ARG 56 -1.343 14.682 0.528
428 1HH2 ARG 56 1HH2 ARG 56 -1.312 15.577 -2.849
429 2HH2 ARG 56 2HH2 ARG 56 -0.609 15.854 -1.289
430 H MET 57 H MET 57 -7.337 9.446 -5.509
431 HA MET 57 HA MET 57 -6.667 11.177 -7.698
432 1HB MET 57 2HB MET 57 -4.459 10.157 -6.894
433 2HB MET 57 1HB MET 57 -5.053 8.640 -7.535
434 1HG MET 57 2HG MET 57 -5.248 9.649 -9.753
435 2HG MET 57 1HG MET 57 -4.630 11.167 -9.103
436 1HE MET 57 1HE MET 57 -1.483 11.400 -8.953
437 2HE MET 57 2HE MET 57 -2.860 11.812 -9.975
438 3HE MET 57 3HE MET 57 -1.505 10.901 -10.644
439 HA PRO 58 HA PRO 58 -8.345 7.006 -9.543
440 1HB PRO 58 2HB PRO 58 -9.068 5.097 -7.711
441 2HB PRO 58 1HB PRO 58 -7.501 5.137 -8.528
442 1HG PRO 58 2HG PRO 58 -8.239 6.154 -5.806
443 2HG PRO 58 1HG PRO 58 -6.825 5.198 -6.296
444 1HD PRO 58 2HD PRO 58 -6.616 7.827 -5.930
445 2HD PRO 58 1HD PRO 58 -5.768 7.024 -7.266
446 H GLY 59 H GLY 59 -10.552 5.589 -8.884
447 1HA GLY 59 2HA GLY 59 -12.605 7.472 -8.944
448 2HA GLY 59 1HA GLY 59 -12.817 5.765 -8.591
449 H MET 60 H MET 60 -12.572 5.070 -6.357
450 HA MET 60 HA MET 60 -13.842 6.919 -4.570
451 1HB MET 60 2HB MET 60 -13.375 4.064 -4.694
452 2HB MET 60 1HB MET 60 -13.058 4.684 -3.081
453 1HG MET 60 2HG MET 60 -15.239 4.442 -2.753
454 2HG MET 60 1HG MET 60 -15.408 5.913 -3.712
455 1HE MET 60 1HE MET 60 -16.104 1.664 -4.398
456 2HE MET 60 2HE MET 60 -17.623 2.483 -4.028
457 3HE MET 60 3HE MET 60 -16.230 2.686 -2.967
458 H ASP 61 H ASP 61 -11.665 8.234 -5.087
459 HA ASP 61 HA ASP 61 -9.835 9.269 -4.249
460 1HB ASP 61 2HB ASP 61 -11.484 8.522 -1.976
461 2HB ASP 61 1HB ASP 61 -9.786 8.642 -1.539
462 H GLY 62 H GLY 62 -9.961 6.362 -2.188
463 1HA GLY 62 2HA GLY 62 -7.520 5.356 -3.414
464 2HA GLY 62 1HA GLY 62 -7.393 5.834 -1.730
465 H LEU 63 H LEU 63 -10.065 4.957 -1.018
466 HA LEU 63 HA LEU 63 -9.458 2.303 -0.324
467 1HB LEU 63 2HB LEU 63 -12.302 3.182 -0.391
468 2HB LEU 63 1HB LEU 63 -11.455 2.234 0.815
469 HG LEU 63 HG LEU 63 -10.192 4.567 1.172
470 1HD1 LEU 63 1HD1 LEU 63 -11.629 6.447 0.966
471 2HD1 LEU 63 2HD1 LEU 63 -12.975 5.441 0.435
472 3HD1 LEU 63 3HD1 LEU 63 -11.572 5.657 -0.608
473 1HD2 LEU 63 1HD2 LEU 63 -12.318 4.980 2.791
474 2HD2 LEU 63 2HD2 LEU 63 -11.018 3.839 3.116
475 3HD2 LEU 63 3HD2 LEU 63 -12.523 3.272 2.396
476 H ALA 64 H ALA 64 -10.770 3.683 -3.173
477 HA ALA 64 HA ALA 64 -12.363 1.653 -4.211
478 1HB ALA 64 1HB ALA 64 -10.607 2.835 -6.213
479 2HB ALA 64 2HB ALA 64 -11.316 4.041 -5.141
480 3HB ALA 64 3HB ALA 64 -12.361 2.944 -6.044
481 H LEU 65 H LEU 65 -8.895 2.000 -4.056
482 HA LEU 65 HA LEU 65 -8.110 -0.089 -5.742
483 1HB LEU 65 2HB LEU 65 -6.605 0.663 -3.256
484 2HB LEU 65 1HB LEU 65 -5.969 0.154 -4.811
485 HG LEU 65 HG LEU 65 -7.259 2.810 -4.198
486 1HD1 LEU 65 1HD1 LEU 65 -5.147 2.983 -3.323
487 2HD1 LEU 65 2HD1 LEU 65 -4.902 3.539 -4.976
488 3HD1 LEU 65 3HD1 LEU 65 -4.444 1.898 -4.522
489 1HD2 LEU 65 1HD2 LEU 65 -6.144 3.127 -6.617
490 2HD2 LEU 65 2HD2 LEU 65 -7.835 2.691 -6.366
491 3HD2 LEU 65 3HD2 LEU 65 -6.645 1.439 -6.725
492 H LEU 66 H LEU 66 -8.379 -0.071 -2.187
493 HA LEU 66 HA LEU 66 -7.826 -2.691 -1.631
494 1HB LEU 66 2HB LEU 66 -9.949 -0.955 -0.365
495 2HB LEU 66 1HB LEU 66 -9.328 -2.441 0.330
496 HG LEU 66 HG LEU 66 -7.391 -0.280 -0.350
497 1HD1 LEU 66 1HD1 LEU 66 -9.398 0.699 0.891
498 2HD1 LEU 66 2HD1 LEU 66 -7.798 0.965 1.583
499 3HD1 LEU 66 3HD1 LEU 66 -8.859 -0.268 2.264
500 1HD2 LEU 66 1HD2 LEU 66 -7.068 -1.561 2.190
501 2HD2 LEU 66 2HD2 LEU 66 -6.024 -1.595 0.775
502 3HD2 LEU 66 3HD2 LEU 66 -7.320 -2.776 0.936
503 H LYS 67 H LYS 67 -10.916 -1.331 -2.688
504 HA LYS 67 HA LYS 67 -12.546 -3.568 -2.535
505 1HB LYS 67 2HB LYS 67 -12.941 -1.069 -3.399
506 2HB LYS 67 1HB LYS 67 -12.767 -1.854 -4.962
507 1HG LYS 67 2HG LYS 67 -14.994 -2.096 -4.747
508 2HG LYS 67 1HG LYS 67 -14.518 -3.531 -3.835
509 1HD LYS 67 2HD LYS 67 -14.715 -0.959 -2.365
510 2HD LYS 67 1HD LYS 67 -16.220 -1.734 -2.864
511 1HE LYS 67 2HE LYS 67 -16.028 -3.337 -1.317
512 2HE LYS 67 1HE LYS 67 -14.318 -3.590 -1.668
513 1HZ LYS 67 1HZ LYS 67 -14.830 -2.764 0.615
514 2HZ LYS 67 2HZ LYS 67 -15.322 -1.303 -0.073
515 3HZ LYS 67 3HZ LYS 67 -13.721 -1.819 -0.243
516 H GLN 68 H GLN 68 -10.642 -2.487 -5.338
517 HA GLN 68 HA GLN 68 -11.111 -4.820 -6.876
518 1HB GLN 68 2HB GLN 68 -8.760 -2.960 -7.185
519 2HB GLN 68 1HB GLN 68 -9.529 -3.942 -8.421
520 1HG GLN 68 2HG GLN 68 -10.910 -1.667 -7.031
521 2HG GLN 68 1HG GLN 68 -9.993 -1.484 -8.525
522 1HE2 GLN 68 1HE2 GLN 68 -12.655 -0.826 -8.370
523 2HE2 GLN 68 2HE2 GLN 68 -13.577 -1.930 -9.326
524 H ILE 69 H ILE 69 -8.616 -3.850 -4.614
525 HA ILE 69 HA ILE 69 -6.759 -5.873 -5.207
526 HB ILE 69 HB ILE 69 -7.185 -4.250 -2.704
527 1HG1 ILE 69 2HG1 ILE 69 -5.018 -4.075 -4.799
528 2HG1 ILE 69 1HG1 ILE 69 -6.489 -3.110 -4.841
529 1HG2 ILE 69 1HG2 ILE 69 -4.584 -5.590 -3.187
530 2HG2 ILE 69 2HG2 ILE 69 -5.900 -6.583 -2.572
531 3HG2 ILE 69 3HG2 ILE 69 -5.374 -5.164 -1.671
532 1HD1 ILE 69 1HD1 ILE 69 -4.062 -2.739 -3.310
533 2HD1 ILE 69 2HD1 ILE 69 -5.510 -2.676 -2.305
534 3HD1 ILE 69 3HD1 ILE 69 -5.351 -1.596 -3.689
535 H LYS 70 H LYS 70 -9.492 -5.766 -3.036
536 HA LYS 70 HA LYS 70 -8.897 -8.259 -1.787
537 1HB LYS 70 2HB LYS 70 -11.012 -7.985 -0.647
538 2HB LYS 70 1HB LYS 70 -10.124 -6.466 -0.641
539 1HG LYS 70 2HG LYS 70 -11.537 -5.498 -2.231
540 2HG LYS 70 1HG LYS 70 -12.216 -7.058 -2.702
541 1HD LYS 70 2HD LYS 70 -12.779 -6.920 -0.012
542 2HD LYS 70 1HD LYS 70 -12.982 -5.250 -0.545
543 1HE LYS 70 2HE LYS 70 -14.549 -5.939 -2.246
544 2HE LYS 70 1HE LYS 70 -14.270 -7.637 -1.863
545 1HZ LYS 70 1HZ LYS 70 -16.313 -6.378 -0.886
546 2HZ LYS 70 2HZ LYS 70 -15.195 -5.838 0.263
547 3HZ LYS 70 3HZ LYS 70 -15.468 -7.497 0.063
548 H GLN 71 H GLN 71 -10.715 -7.280 -4.560
549 HA GLN 71 HA GLN 71 -12.381 -9.540 -4.753
550 1HB GLN 71 2HB GLN 71 -11.656 -7.276 -6.489
551 2HB GLN 71 1HB GLN 71 -12.206 -8.725 -7.325
552 1HG GLN 71 2HG GLN 71 -14.312 -8.638 -6.360
553 2HG GLN 71 1HG GLN 71 -13.773 -7.598 -5.042
554 1HE2 GLN 71 1HE2 GLN 71 -12.776 -5.467 -5.940
555 2HE2 GLN 71 2HE2 GLN 71 -13.754 -4.648 -7.104
556 H ARG 72 H ARG 72 -9.327 -8.797 -6.353
557 HA ARG 72 HA ARG 72 -9.251 -11.465 -7.495
558 1HB ARG 72 2HB ARG 72 -7.602 -8.997 -7.877
559 2HB ARG 72 1HB ARG 72 -7.036 -10.552 -8.472
560 1HG ARG 72 2HG ARG 72 -9.739 -10.190 -9.294
561 2HG ARG 72 1HG ARG 72 -8.820 -8.741 -9.702
562 1HD ARG 72 2HD ARG 72 -7.483 -11.295 -10.301
563 2HD ARG 72 1HD ARG 72 -8.937 -10.966 -11.242
564 HE ARG 72 HE ARG 72 -7.363 -8.668 -11.286
565 1HH1 ARG 72 1HH1 ARG 72 -7.216 -11.963 -12.428
566 2HH1 ARG 72 2HH1 ARG 72 -6.210 -11.579 -13.784
567 1HH2 ARG 72 1HH2 ARG 72 -6.046 -8.163 -13.076
568 2HH2 ARG 72 2HH2 ARG 72 -5.551 -9.424 -14.156
569 H HIS 73 H HIS 73 -7.360 -9.541 -5.245
570 HA HIS 73 HA HIS 73 -5.594 -11.792 -4.723
571 1HB HIS 73 2HB HIS 73 -5.431 -9.213 -3.208
572 2HB HIS 73 1HB HIS 73 -4.132 -10.289 -3.727
573 HD1 HIS 73 1HD HIS 73 -4.281 -10.442 -6.624
574 HD2 HIS 73 2HD HIS 73 -5.263 -6.932 -4.642
575 HE1 HIS 73 1HE HIS 73 -4.104 -8.628 -8.351
576 HE2 HIS 73 2HE HIS 73 -4.875 -6.542 -7.166
577 HA PRO 74 HA PRO 74 -7.705 -13.193 -1.144
578 1HB PRO 74 2HB PRO 74 -5.644 -14.349 0.216
579 2HB PRO 74 1HB PRO 74 -6.419 -15.070 -1.196
580 1HG PRO 74 2HG PRO 74 -3.813 -13.663 -0.973
581 2HG PRO 74 1HG PRO 74 -4.290 -14.990 -2.040
582 1HD PRO 74 2HD PRO 74 -4.079 -12.338 -2.796
583 2HD PRO 74 1HD PRO 74 -5.018 -13.572 -3.657
584 H MET 75 H MET 75 -4.546 -12.470 0.311
585 HA MET 75 HA MET 75 -5.883 -10.488 2.013
586 1HB MET 75 2HB MET 75 -3.997 -12.687 2.811
587 2HB MET 75 1HB MET 75 -4.279 -11.283 3.834
588 1HG MET 75 2HG MET 75 -6.245 -12.048 4.541
589 2HG MET 75 1HG MET 75 -6.738 -12.544 2.923
590 1HE MET 75 1HE MET 75 -6.783 -15.145 6.020
591 2HE MET 75 2HE MET 75 -7.787 -15.259 4.575
592 3HE MET 75 3HE MET 75 -7.569 -13.703 5.379
593 H LEU 76 H LEU 76 -4.559 -9.698 -0.251
594 HA LEU 76 HA LEU 76 -1.842 -9.102 0.080
595 1HB LEU 76 2HB LEU 76 -3.449 -8.850 -1.990
596 2HB LEU 76 1HB LEU 76 -3.665 -7.222 -1.371
597 HG LEU 76 HG LEU 76 -1.919 -7.613 -3.209
598 1HD1 LEU 76 1HD1 LEU 76 -0.705 -6.198 -0.906
599 2HD1 LEU 76 2HD1 LEU 76 -2.300 -5.679 -1.454
600 3HD1 LEU 76 3HD1 LEU 76 -0.936 -5.672 -2.575
601 1HD2 LEU 76 1HD2 LEU 76 -0.942 -9.474 -1.455
602 2HD2 LEU 76 2HD2 LEU 76 0.120 -8.093 -1.173
603 3HD2 LEU 76 3HD2 LEU 76 -0.048 -8.764 -2.794
604 HA PRO 77 HA PRO 77 -2.409 -6.249 3.552
605 1HB PRO 77 2HB PRO 77 0.523 -5.960 3.140
606 2HB PRO 77 1HB PRO 77 -0.372 -6.347 4.615
607 1HG PRO 77 2HG PRO 77 0.997 -8.240 3.356
608 2HG PRO 77 1HG PRO 77 -0.599 -8.595 4.040
609 1HD PRO 77 2HD PRO 77 0.159 -8.044 1.191
610 2HD PRO 77 1HD PRO 77 -0.935 -9.282 1.844
611 H VAL 78 H VAL 78 -3.259 -4.308 3.010
612 HA VAL 78 HA VAL 78 -1.709 -2.584 1.188
613 HB VAL 78 HB VAL 78 -4.649 -2.259 1.711
614 1HG1 VAL 78 1HG1 VAL 78 -4.114 -1.389 -0.827
615 2HG1 VAL 78 2HG1 VAL 78 -2.638 -0.958 0.036
616 3HG1 VAL 78 3HG1 VAL 78 -4.197 -0.365 0.607
617 1HG2 VAL 78 1HG2 VAL 78 -5.254 -3.792 0.170
618 2HG2 VAL 78 2HG2 VAL 78 -3.707 -4.525 0.586
619 3HG2 VAL 78 3HG2 VAL 78 -3.837 -3.496 -0.837
620 H ILE 79 H ILE 79 -1.613 -0.353 1.633
621 HA ILE 79 HA ILE 79 -2.472 0.510 4.299
622 HB ILE 79 HB ILE 79 0.272 1.122 3.226
623 1HG1 ILE 79 2HG1 ILE 79 0.357 -0.460 5.611
624 2HG1 ILE 79 1HG1 ILE 79 -0.600 -1.306 4.398
625 1HG2 ILE 79 1HG2 ILE 79 0.640 2.339 5.109
626 2HG2 ILE 79 2HG2 ILE 79 -0.483 1.388 6.081
627 3HG2 ILE 79 3HG2 ILE 79 -1.097 2.584 4.939
628 1HD1 ILE 79 1HD1 ILE 79 1.558 -0.428 2.962
629 2HD1 ILE 79 2HD1 ILE 79 1.342 -2.043 3.629
630 3HD1 ILE 79 3HD1 ILE 79 2.262 -0.836 4.527
631 H ILE 80 H ILE 80 -3.762 2.177 3.915
632 HA ILE 80 HA ILE 80 -3.254 3.899 1.616
633 HB ILE 80 HB ILE 80 -5.618 4.046 3.472
634 1HG1 ILE 80 2HG1 ILE 80 -5.374 1.747 2.593
635 2HG1 ILE 80 1HG1 ILE 80 -6.784 2.556 1.918
636 1HG2 ILE 80 1HG2 ILE 80 -6.094 4.619 0.696
637 2HG2 ILE 80 2HG2 ILE 80 -4.766 5.606 1.305
638 3HG2 ILE 80 3HG2 ILE 80 -6.334 5.647 2.105
639 1HD1 ILE 80 1HD1 ILE 80 -4.973 3.170 0.042
640 2HD1 ILE 80 2HD1 ILE 80 -5.973 1.718 -0.004
641 3HD1 ILE 80 3HD1 ILE 80 -4.320 1.632 0.604
642 H MET 81 H MET 81 -2.837 6.080 1.754
643 HA MET 81 HA MET 81 -1.511 6.951 4.108
644 1HB MET 81 2HB MET 81 -1.188 9.077 2.889
645 2HB MET 81 1HB MET 81 -0.695 7.663 1.970
646 1HG MET 81 2HG MET 81 -1.922 8.384 0.293
647 2HG MET 81 1HG MET 81 -3.357 8.121 1.276
648 1HE MET 81 1HE MET 81 -0.395 10.233 0.807
649 2HE MET 81 2HE MET 81 -0.779 11.683 1.733
650 3HE MET 81 3HE MET 81 -1.095 11.635 -0.001
651 H THR 82 H THR 82 -4.756 7.408 2.926
652 HA THR 82 HA THR 82 -5.409 8.774 5.409
653 HB THR 82 HB THR 82 -6.361 9.970 2.812
654 HG1 THR 82 1HG THR 82 -4.768 11.532 3.088
655 1HG2 THR 82 1HG2 THR 82 -7.770 10.813 4.393
656 2HG2 THR 82 2HG2 THR 82 -6.461 11.995 4.461
657 3HG2 THR 82 3HG2 THR 82 -6.564 10.721 5.677
658 H ALA 83 H ALA 83 -7.814 8.962 5.707
659 HA ALA 83 HA ALA 83 -9.224 6.837 4.229
660 1HB ALA 83 1HB ALA 83 -9.924 7.193 7.074
661 2HB ALA 83 2HB ALA 83 -8.363 6.446 6.732
662 3HB ALA 83 3HB ALA 83 -9.844 5.727 6.096
663 H HIS 84 H HIS 84 -9.372 9.631 3.711
664 HA HIS 84 HA HIS 84 -11.848 10.572 4.894
665 1HB HIS 84 2HB HIS 84 -11.467 12.532 3.320
666 2HB HIS 84 1HB HIS 84 -10.225 12.271 4.538
667 HD1 HIS 84 1HD HIS 84 -8.556 13.574 2.993
668 HD2 HIS 84 2HD HIS 84 -10.004 10.018 1.403
669 HE1 HIS 84 1HE HIS 84 -7.040 13.034 1.062
670 HE2 HIS 84 2HE HIS 84 -7.866 10.821 0.190
671 H SER 85 H SER 85 -13.182 11.817 2.934
672 HA SER 85 HA SER 85 -14.663 11.578 1.235
673 1HB SER 85 2HB SER 85 -12.837 11.061 -0.243
674 2HB SER 85 1HB SER 85 -12.753 9.405 0.356
675 HG SER 85 HG SER 85 -14.372 10.483 -1.545
676 H ASP 86 H ASP 86 -13.802 8.139 1.482
677 HA ASP 86 HA ASP 86 -16.342 7.624 2.839
678 1HB ASP 86 2HB ASP 86 -15.868 7.129 0.055
679 2HB ASP 86 1HB ASP 86 -16.076 5.590 0.883
680 H LEU 87 H LEU 87 -14.901 7.199 4.608
681 HA LEU 87 HA LEU 87 -12.849 5.328 4.659
682 1HB LEU 87 2HB LEU 87 -14.064 6.978 6.482
683 2HB LEU 87 1HB LEU 87 -14.500 5.390 7.081
684 HG LEU 87 HG LEU 87 -11.695 6.389 6.604
685 1HD1 LEU 87 1HD1 LEU 87 -13.120 5.760 9.181
686 2HD1 LEU 87 2HD1 LEU 87 -12.834 7.384 8.555
687 3HD1 LEU 87 3HD1 LEU 87 -11.471 6.358 9.004
688 1HD2 LEU 87 1HD2 LEU 87 -11.407 4.156 6.272
689 2HD2 LEU 87 2HD2 LEU 87 -12.810 3.715 7.243
690 3HD2 LEU 87 3HD2 LEU 87 -11.309 4.203 8.031
691 H ASP 88 H ASP 88 -16.244 4.829 4.458
692 HA ASP 88 HA ASP 88 -16.688 2.406 5.642
693 1HB ASP 88 2HB ASP 88 -18.285 3.924 4.281
694 2HB ASP 88 1HB ASP 88 -17.774 2.968 2.895
695 H ALA 89 H ALA 89 -15.456 2.895 2.325
696 HA ALA 89 HA ALA 89 -15.201 0.210 1.623
697 1HB ALA 89 1HB ALA 89 -15.017 1.778 -0.108
698 2HB ALA 89 2HB ALA 89 -13.408 1.066 0.033
699 3HB ALA 89 3HB ALA 89 -13.733 2.659 0.719
700 H ALA 90 H ALA 90 -13.336 2.067 3.819
701 HA ALA 90 HA ALA 90 -10.937 0.524 3.655
702 1HB ALA 90 1HB ALA 90 -11.036 2.851 4.536
703 2HB ALA 90 2HB ALA 90 -10.223 1.717 5.614
704 3HB ALA 90 3HB ALA 90 -11.875 2.230 5.955
705 H VAL 91 H VAL 91 -13.976 0.194 5.324
706 HA VAL 91 HA VAL 91 -13.109 -1.506 7.394
707 HB VAL 91 HB VAL 91 -15.853 -1.625 6.172
708 1HG1 VAL 91 1HG1 VAL 91 -16.005 -3.230 7.732
709 2HG1 VAL 91 2HG1 VAL 91 -16.056 -1.903 8.891
710 3HG1 VAL 91 3HG1 VAL 91 -14.525 -2.712 8.543
711 1HG2 VAL 91 1HG2 VAL 91 -15.101 0.180 8.452
712 2HG2 VAL 91 2HG2 VAL 91 -16.546 0.212 7.442
713 3HG2 VAL 91 3HG2 VAL 91 -14.999 0.733 6.782
714 H SER 92 H SER 92 -14.545 -2.283 4.229
715 HA SER 92 HA SER 92 -14.383 -5.071 4.559
716 1HB SER 92 2HB SER 92 -14.180 -3.676 1.899
717 2HB SER 92 1HB SER 92 -14.885 -5.253 2.253
718 HG SER 92 HG SER 92 -16.443 -4.025 3.567
719 H ALA 93 H ALA 93 -12.011 -2.676 3.819
720 HA ALA 93 HA ALA 93 -10.111 -4.282 2.518
721 1HB ALA 93 1HB ALA 93 -10.051 -1.790 2.666
722 2HB ALA 93 2HB ALA 93 -8.517 -2.578 3.027
723 3HB ALA 93 3HB ALA 93 -9.522 -1.964 4.340
724 H TYR 94 H TYR 94 -10.828 -3.699 5.886
725 HA TYR 94 HA TYR 94 -8.617 -5.140 6.949
726 1HB TYR 94 2HB TYR 94 -11.264 -4.814 8.353
727 2HB TYR 94 1HB TYR 94 -9.659 -4.934 9.064
728 HD1 TYR 94 1HD TYR 94 -12.206 -2.751 8.758
729 HD2 TYR 94 2HD TYR 94 -8.054 -2.961 7.820
730 HE1 TYR 94 1HE TYR 94 -12.056 -0.298 8.858
731 HE2 TYR 94 2HE TYR 94 -7.903 -0.509 7.914
732 HH TYR 94 HH TYR 94 -10.063 1.484 7.578
733 H GLN 95 H GLN 95 -11.635 -5.984 5.585
734 HA GLN 95 HA GLN 95 -11.815 -8.616 6.720
735 1HB GLN 95 2HB GLN 95 -13.919 -7.909 6.142
736 2HB GLN 95 1HB GLN 95 -13.353 -6.991 4.762
737 1HG GLN 95 2HG GLN 95 -12.930 -9.694 4.116
738 2HG GLN 95 1HG GLN 95 -14.524 -9.601 4.859
739 1HE2 GLN 95 1HE2 GLN 95 -12.746 -7.312 2.824
740 2HE2 GLN 95 2HE2 GLN 95 -13.948 -7.210 1.586
741 H GLN 96 H GLN 96 -10.619 -7.188 3.713
742 HA GLN 96 HA GLN 96 -10.031 -9.751 2.571
743 1HB GLN 96 2HB GLN 96 -9.196 -8.577 0.679
744 2HB GLN 96 1HB GLN 96 -10.628 -7.715 1.222
745 1HG GLN 96 2HG GLN 96 -9.351 -5.896 1.048
746 2HG GLN 96 1HG GLN 96 -8.678 -6.419 2.587
747 1HE2 GLN 96 1HE2 GLN 96 -7.130 -4.845 1.151
748 2HE2 GLN 96 2HE2 GLN 96 -5.838 -5.718 0.408
749 H GLY 97 H GLY 97 -8.427 -7.582 4.697
750 1HA GLY 97 2HA GLY 97 -6.528 -8.610 5.885
751 2HA GLY 97 1HA GLY 97 -5.933 -9.125 4.317
752 H ALA 98 H ALA 98 -7.286 -5.943 4.913
753 HA ALA 98 HA ALA 98 -5.028 -4.620 3.838
754 1HB ALA 98 1HB ALA 98 -7.182 -3.373 5.529
755 2HB ALA 98 2HB ALA 98 -7.402 -3.796 3.833
756 3HB ALA 98 3HB ALA 98 -6.192 -2.599 4.292
757 H PHE 99 H PHE 99 -3.514 -3.226 4.908
758 HA PHE 99 HA PHE 99 -2.652 -4.250 7.430
759 1HB PHE 99 2HB PHE 99 -1.164 -3.423 5.513
760 2HB PHE 99 1HB PHE 99 -1.533 -1.800 6.091
761 HD1 PHE 99 1HD PHE 99 -0.519 -5.071 7.577
762 HD2 PHE 99 2HD PHE 99 0.065 -0.861 7.428
763 HE1 PHE 99 1HE PHE 99 1.282 -5.265 9.243
764 HE2 PHE 99 2HE PHE 99 1.870 -1.046 9.088
765 HZ PHE 99 HZ PHE 99 2.479 -3.249 9.998
766 H ASP 100 H ASP 100 -3.690 -1.013 6.334
767 HA ASP 100 HA ASP 100 -5.357 -0.401 8.439
768 1HB ASP 100 2HB ASP 100 -2.876 -0.627 9.547
769 2HB ASP 100 1HB ASP 100 -2.896 1.083 9.146
770 H TYR 101 H TYR 101 -4.945 2.215 8.980
771 HA TYR 101 HA TYR 101 -4.659 3.553 6.382
772 1HB TYR 101 2HB TYR 101 -7.049 3.366 8.105
773 2HB TYR 101 1HB TYR 101 -6.669 4.988 7.538
774 HD1 TYR 101 1HD TYR 101 -7.379 1.527 6.402
775 HD2 TYR 101 2HD TYR 101 -7.161 5.642 5.338
776 HE1 TYR 101 1HE TYR 101 -8.442 1.021 4.245
777 HE2 TYR 101 2HE TYR 101 -8.232 5.148 3.180
778 HH TYR 101 HH TYR 101 -9.880 2.432 2.519
779 H LEU 102 H LEU 102 -4.085 5.800 6.538
780 HA LEU 102 HA LEU 102 -2.839 6.445 9.117
781 1HB LEU 102 2HB LEU 102 -1.992 6.703 6.376
782 2HB LEU 102 1HB LEU 102 -1.936 8.261 7.179
783 HG LEU 102 HG LEU 102 -0.452 7.397 8.878
784 1HD1 LEU 102 1HD1 LEU 102 -0.148 4.788 7.533
785 2HD1 LEU 102 2HD1 LEU 102 -1.565 5.010 8.558
786 3HD1 LEU 102 3HD1 LEU 102 0.053 5.220 9.227
787 1HD2 LEU 102 1HD2 LEU 102 1.449 6.641 7.375
788 2HD2 LEU 102 2HD2 LEU 102 0.708 8.199 7.015
789 3HD2 LEU 102 3HD2 LEU 102 0.303 6.788 6.042
790 HA PRO 103 HA PRO 103 -5.999 9.603 9.332
791 1HB PRO 103 2HB PRO 103 -5.543 10.302 11.923
792 2HB PRO 103 1HB PRO 103 -6.478 8.884 11.444
793 1HG PRO 103 2HG PRO 103 -3.764 9.053 12.574
794 2HG PRO 103 1HG PRO 103 -4.916 7.712 12.606
795 1HD PRO 103 2HD PRO 103 -2.656 8.001 10.916
796 2HD PRO 103 1HD PRO 103 -3.902 6.744 10.838
797 H LYS 104 H LYS 104 -3.387 10.626 11.500
798 HA LYS 104 HA LYS 104 -3.263 13.147 10.024
799 1HB LYS 104 2HB LYS 104 -3.126 12.443 12.808
800 2HB LYS 104 1HB LYS 104 -1.681 13.332 12.348
801 1HG LYS 104 2HG LYS 104 -2.923 15.203 11.656
802 2HG LYS 104 1HG LYS 104 -4.438 14.299 11.669
803 1HD LYS 104 2HD LYS 104 -4.693 15.329 13.668
804 2HD LYS 104 1HD LYS 104 -3.701 13.980 14.230
805 1HE LYS 104 2HE LYS 104 -2.797 16.012 15.126
806 2HE LYS 104 1HE LYS 104 -1.689 15.399 13.897
807 1HZ LYS 104 1HZ LYS 104 -3.151 17.862 13.965
808 2HZ LYS 104 2HZ LYS 104 -3.354 17.034 12.504
809 3HZ LYS 104 3HZ LYS 104 -1.800 17.434 13.040
810 HA PRO 105 HA PRO 105 1.459 12.090 10.492
811 1HB PRO 105 2HB PRO 105 1.958 9.432 11.067
812 2HB PRO 105 1HB PRO 105 2.014 10.747 12.244
813 1HG PRO 105 2HG PRO 105 -0.171 8.789 11.686
814 2HG PRO 105 1HG PRO 105 0.392 9.433 13.241
815 1HD PRO 105 2HD PRO 105 -1.849 10.325 12.079
816 2HD PRO 105 1HD PRO 105 -0.785 11.415 12.987
817 H PHE 106 H PHE 106 2.717 11.421 8.793
818 HA PHE 106 HA PHE 106 1.963 9.257 7.075
819 1HB PHE 106 2HB PHE 106 0.364 10.992 6.319
820 2HB PHE 106 1HB PHE 106 1.702 12.085 5.990
821 HD1 PHE 106 1HD PHE 106 2.277 12.287 3.770
822 HD2 PHE 106 2HD PHE 106 0.766 8.571 5.170
823 HE1 PHE 106 1HE PHE 106 2.454 11.360 1.498
824 HE2 PHE 106 2HE PHE 106 0.946 7.635 2.912
825 HZ PHE 106 HZ PHE 106 1.788 9.028 1.066
826 H ASP 107 H ASP 107 3.456 11.778 5.297
827 HA ASP 107 HA ASP 107 5.539 11.789 4.338
828 1HB ASP 107 2HB ASP 107 7.255 12.525 5.908
829 2HB ASP 107 1HB ASP 107 5.717 13.304 6.265
830 H ILE 108 H ILE 108 7.961 10.913 4.710
831 HA ILE 108 HA ILE 108 7.772 8.129 4.307
832 HB ILE 108 HB ILE 108 9.780 10.128 3.974
833 1HG1 ILE 108 2HG1 ILE 108 10.547 8.668 2.237
834 2HG1 ILE 108 1HG1 ILE 108 9.767 7.283 2.985
835 1HG2 ILE 108 1HG2 ILE 108 10.679 7.601 5.329
836 2HG2 ILE 108 2HG2 ILE 108 10.972 9.263 5.841
837 3HG2 ILE 108 3HG2 ILE 108 11.757 8.635 4.392
838 1HD1 ILE 108 1HD1 ILE 108 7.599 8.123 2.421
839 2HD1 ILE 108 2HD1 ILE 108 8.604 8.150 0.973
840 3HD1 ILE 108 3HD1 ILE 108 8.285 9.644 1.853
841 H ASP 109 H ASP 109 8.937 10.026 7.010
842 HA ASP 109 HA ASP 109 10.059 8.060 8.567
843 1HB ASP 109 2HB ASP 109 8.548 10.542 9.312
844 2HB ASP 109 1HB ASP 109 9.105 9.436 10.561
845 H GLU 110 H GLU 110 6.630 9.073 8.798
846 HA GLU 110 HA GLU 110 5.956 6.851 10.433
847 1HB GLU 110 2HB GLU 110 4.363 9.006 9.099
848 2HB GLU 110 1HB GLU 110 3.548 7.633 9.822
849 1HG GLU 110 2HG GLU 110 5.522 9.224 11.401
850 2HG GLU 110 1HG GLU 110 3.868 9.799 11.186
851 H ALA 111 H ALA 111 5.744 7.560 7.021
852 HA ALA 111 HA ALA 111 4.081 5.407 6.281
853 1HB ALA 111 1HB ALA 111 6.165 6.821 4.622
854 2HB ALA 111 2HB ALA 111 4.481 7.312 4.807
855 3HB ALA 111 3HB ALA 111 4.873 5.790 4.006
856 H VAL 112 H VAL 112 7.631 5.729 6.044
857 HA VAL 112 HA VAL 112 8.079 3.056 5.291
858 HB VAL 112 HB VAL 112 9.993 4.900 6.720
859 1HG1 VAL 112 1HG1 VAL 112 11.514 3.284 6.572
860 2HG1 VAL 112 2HG1 VAL 112 11.169 3.040 4.859
861 3HG1 VAL 112 3HG1 VAL 112 10.220 2.187 6.082
862 1HG2 VAL 112 1HG2 VAL 112 9.625 6.127 4.843
863 2HG2 VAL 112 2HG2 VAL 112 9.079 4.740 3.907
864 3HG2 VAL 112 3HG2 VAL 112 10.802 5.000 4.178
865 H ALA 113 H ALA 113 7.729 4.630 8.350
866 HA ALA 113 HA ALA 113 8.754 2.644 10.057
867 1HB ALA 113 1HB ALA 113 6.485 4.547 10.603
868 2HB ALA 113 2HB ALA 113 8.189 4.983 10.705
869 3HB ALA 113 3HB ALA 113 7.526 3.769 11.796
870 H LEU 114 H LEU 114 5.531 3.290 8.820
871 HA LEU 114 HA LEU 114 4.327 1.060 10.114
872 1HB LEU 114 2HB LEU 114 3.070 3.068 9.734
873 2HB LEU 114 1HB LEU 114 3.369 2.978 8.011
874 HG LEU 114 HG LEU 114 2.044 0.748 8.129
875 1HD1 LEU 114 1HD1 LEU 114 1.385 2.049 10.754
876 2HD1 LEU 114 2HD1 LEU 114 1.778 0.362 10.425
877 3HD1 LEU 114 3HD1 LEU 114 0.218 1.020 9.922
878 1HD2 LEU 114 1HD2 LEU 114 1.114 2.454 6.892
879 2HD2 LEU 114 2HD2 LEU 114 1.039 3.547 8.267
880 3HD2 LEU 114 3HD2 LEU 114 -0.108 2.212 8.140
881 H VAL 115 H VAL 115 5.931 1.535 7.082
882 HA VAL 115 HA VAL 115 4.649 -0.717 5.833
883 HB VAL 115 HB VAL 115 5.580 1.234 4.523
884 1HG1 VAL 115 1HG1 VAL 115 7.797 1.202 5.736
885 2HG1 VAL 115 2HG1 VAL 115 7.874 1.347 3.985
886 3HG1 VAL 115 3HG1 VAL 115 8.212 -0.201 4.759
887 1HG2 VAL 115 1HG2 VAL 115 5.441 -1.537 3.926
888 2HG2 VAL 115 2HG2 VAL 115 6.832 -0.866 3.079
889 3HG2 VAL 115 3HG2 VAL 115 5.232 -0.166 2.837
890 H GLU 116 H GLU 116 7.861 -0.103 7.216
891 HA GLU 116 HA GLU 116 8.894 -2.680 6.730
892 1HB GLU 116 2HB GLU 116 9.598 -0.534 8.723
893 2HB GLU 116 1HB GLU 116 10.456 -2.067 8.670
894 1HG GLU 116 2HG GLU 116 11.026 -1.623 6.308
895 2HG GLU 116 1HG GLU 116 10.251 -0.045 6.453
896 H ARG 117 H ARG 117 7.189 -1.302 9.520
897 HA ARG 117 HA ARG 117 7.407 -3.533 11.203
898 1HB ARG 117 2HB ARG 117 5.357 -1.335 11.023
899 2HB ARG 117 1HB ARG 117 5.284 -2.586 12.257
900 1HG ARG 117 2HG ARG 117 7.538 -1.909 13.016
901 2HG ARG 117 1HG ARG 117 7.505 -0.597 11.837
902 1HD ARG 117 2HD ARG 117 5.283 0.055 12.978
903 2HD ARG 117 1HD ARG 117 5.842 -0.966 14.301
904 HE ARG 117 HE ARG 117 7.950 0.597 13.992
905 1HH1 ARG 117 1HH1 ARG 117 4.559 1.443 14.040
906 2HH1 ARG 117 2HH1 ARG 117 4.840 3.030 14.673
907 1HH2 ARG 117 1HH2 ARG 117 8.313 2.673 14.832
908 2HH2 ARG 117 2HH2 ARG 117 6.970 3.727 15.126
909 H ALA 118 H ALA 118 5.444 -2.921 8.443
910 HA ALA 118 HA ALA 118 3.402 -4.818 8.944
911 1HB ALA 118 1HB ALA 118 2.740 -4.481 6.679
912 2HB ALA 118 2HB ALA 118 4.331 -3.856 6.247
913 3HB ALA 118 3HB ALA 118 3.273 -2.922 7.305
914 H ILE 119 H ILE 119 6.434 -4.936 7.107
915 HA ILE 119 HA ILE 119 6.104 -7.652 6.322
916 HB ILE 119 HB ILE 119 8.674 -6.086 6.428
917 1HG1 ILE 119 2HG1 ILE 119 7.186 -6.295 3.877
918 2HG1 ILE 119 1HG1 ILE 119 6.500 -5.211 5.086
919 1HG2 ILE 119 1HG2 ILE 119 9.182 -7.578 4.435
920 2HG2 ILE 119 2HG2 ILE 119 7.787 -8.537 4.937
921 3HG2 ILE 119 3HG2 ILE 119 9.163 -8.347 6.023
922 1HD1 ILE 119 1HD1 ILE 119 9.380 -5.074 4.277
923 2HD1 ILE 119 2HD1 ILE 119 8.409 -3.865 5.118
924 3HD1 ILE 119 3HD1 ILE 119 8.111 -4.206 3.412
925 H SER 120 H SER 120 7.582 -5.986 8.982
926 HA SER 120 HA SER 120 9.046 -8.219 9.976
927 1HB SER 120 2HB SER 120 9.834 -6.005 10.507
928 2HB SER 120 1HB SER 120 8.288 -5.582 11.241
929 HG SER 120 HG SER 120 8.724 -6.895 12.937
930 H HIS 121 H HIS 121 6.037 -6.603 10.965
931 HA HIS 121 HA HIS 121 5.447 -8.236 13.147
932 1HB HIS 121 2HB HIS 121 3.806 -6.522 11.327
933 2HB HIS 121 1HB HIS 121 2.991 -7.571 12.483
934 HD1 HIS 121 1HD HIS 121 6.163 -6.277 13.750
935 HD2 HIS 121 2HD HIS 121 2.197 -5.041 13.680
936 HE1 HIS 121 1HE HIS 121 5.994 -4.465 15.484
937 HE2 HIS 121 2HE HIS 121 3.569 -3.780 15.475
938 H TYR 122 H TYR 122 5.066 -8.772 9.753
939 HA TYR 122 HA TYR 122 3.345 -11.053 10.077
940 1HB TYR 122 2HB TYR 122 4.376 -9.462 7.836
941 2HB TYR 122 1HB TYR 122 4.216 -11.181 7.492
942 HD1 TYR 122 1HD TYR 122 2.586 -8.168 7.227
943 HD2 TYR 122 2HD TYR 122 1.867 -12.165 8.490
944 HE1 TYR 122 1HE TYR 122 0.179 -7.850 6.840
945 HE2 TYR 122 2HE TYR 122 -0.543 -11.860 8.105
946 HH TYR 122 HH TYR 122 -1.966 -8.855 7.674
947 H GLN 123 H GLN 123 6.675 -10.496 8.964
948 HA GLN 123 HA GLN 123 8.484 -11.865 8.831
949 1HB GLN 123 2HB GLN 123 7.566 -12.103 11.355
950 2HB GLN 123 1HB GLN 123 7.432 -13.777 10.834
951 1HG GLN 123 2HG GLN 123 9.975 -12.538 10.132
952 2HG GLN 123 1HG GLN 123 9.670 -12.599 11.867
953 1HE2 GLN 123 1HE2 GLN 123 11.155 -14.176 9.497
954 2HE2 GLN 123 2HE2 GLN 123 11.044 -15.803 10.067
955 H GLU 124 H GLU 124 9.152 -14.261 8.503
956 HA GLU 124 HA GLU 124 7.014 -15.819 7.250
957 1HB GLU 124 2HB GLU 124 9.445 -14.722 5.883
958 2HB GLU 124 1HB GLU 124 8.735 -16.233 5.333
959 1HG GLU 124 2HG GLU 124 6.858 -13.993 5.684
960 2HG GLU 124 1HG GLU 124 8.048 -13.806 4.397
Start of MODEL 8
1 1H MET 1 1HT MET 1 13.344 -17.153 5.633
2 2H MET 1 2HT MET 1 12.184 -16.615 6.775
3 3H MET 1 3HT MET 1 13.847 -16.668 7.197
4 HA MET 1 HA MET 1 12.823 -14.454 6.627
5 1HB MET 1 2HB MET 1 15.349 -15.599 5.449
6 2HB MET 1 1HB MET 1 14.970 -13.885 5.358
7 1HG MET 1 2HG MET 1 15.997 -13.681 7.312
8 2HG MET 1 1HG MET 1 14.599 -14.488 8.023
9 1HE MET 1 1HE MET 1 16.506 -16.819 10.041
10 2HE MET 1 2HE MET 1 15.367 -15.481 9.882
11 3HE MET 1 3HE MET 1 17.098 -15.160 9.971
12 H GLN 2 H GLN 2 11.184 -13.940 5.304
13 HA GLN 2 HA GLN 2 10.749 -15.005 2.741
14 1HB GLN 2 2HB GLN 2 9.435 -13.210 4.504
15 2HB GLN 2 1HB GLN 2 9.565 -12.405 2.947
16 1HG GLN 2 2HG GLN 2 8.563 -15.215 3.114
17 2HG GLN 2 1HG GLN 2 7.493 -13.860 3.467
18 1HE2 GLN 2 1HE2 GLN 2 7.038 -15.630 1.388
19 2HE2 GLN 2 2HE2 GLN 2 7.213 -14.792 -0.113
20 H ARG 3 H ARG 3 10.794 -13.863 0.682
21 HA ARG 3 HA ARG 3 13.306 -12.821 0.073
22 1HB ARG 3 2HB ARG 3 11.908 -13.871 -1.612
23 2HB ARG 3 1HB ARG 3 10.710 -12.599 -1.453
24 1HG ARG 3 2HG ARG 3 11.762 -11.851 -3.308
25 2HG ARG 3 1HG ARG 3 12.792 -11.083 -2.103
26 1HD ARG 3 2HD ARG 3 13.748 -13.728 -2.548
27 2HD ARG 3 1HD ARG 3 13.509 -12.955 -4.111
28 HE ARG 3 HE ARG 3 15.256 -11.953 -1.962
29 1HH1 ARG 3 1HH1 ARG 3 14.321 -12.036 -5.334
30 2HH1 ARG 3 2HH1 ARG 3 15.689 -11.119 -5.859
31 1HH2 ARG 3 1HH2 ARG 3 17.055 -10.749 -2.667
32 2HH2 ARG 3 2HH2 ARG 3 17.238 -10.390 -4.352
33 H GLY 4 H GLY 4 10.488 -11.261 1.287
34 1HA GLY 4 2HA GLY 4 10.149 -9.105 2.007
35 2HA GLY 4 1HA GLY 4 11.873 -8.847 1.811
36 H ILE 5 H ILE 5 8.856 -9.062 -0.036
37 HA ILE 5 HA ILE 5 9.980 -7.136 -1.963
38 HB ILE 5 HB ILE 5 7.607 -8.939 -2.409
39 1HG1 ILE 5 2HG1 ILE 5 9.585 -9.920 -4.018
40 2HG1 ILE 5 1HG1 ILE 5 10.497 -9.473 -2.579
41 1HG2 ILE 5 1HG2 ILE 5 7.308 -7.706 -4.222
42 2HG2 ILE 5 2HG2 ILE 5 8.889 -8.224 -4.808
43 3HG2 ILE 5 3HG2 ILE 5 8.744 -6.750 -3.854
44 1HD1 ILE 5 1HD1 ILE 5 9.552 -11.083 -1.314
45 2HD1 ILE 5 2HD1 ILE 5 9.349 -11.852 -2.889
46 3HD1 ILE 5 3HD1 ILE 5 8.001 -10.986 -2.148
47 H VAL 6 H VAL 6 9.304 -5.122 -1.582
48 HA VAL 6 HA VAL 6 6.576 -4.735 -0.546
49 HB VAL 6 HB VAL 6 8.233 -3.763 0.920
50 1HG1 VAL 6 1HG1 VAL 6 10.125 -2.851 0.217
51 2HG1 VAL 6 2HG1 VAL 6 9.257 -1.664 -0.755
52 3HG1 VAL 6 3HG1 VAL 6 9.646 -3.240 -1.432
53 1HG2 VAL 6 1HG2 VAL 6 6.060 -2.466 -0.036
54 2HG2 VAL 6 2HG2 VAL 6 7.327 -1.275 -0.344
55 3HG2 VAL 6 3HG2 VAL 6 7.067 -1.886 1.292
56 H TRP 7 H TRP 7 5.082 -3.734 -1.760
57 HA TRP 7 HA TRP 7 5.993 -2.460 -4.251
58 1HB TRP 7 2HB TRP 7 3.566 -4.136 -3.660
59 2HB TRP 7 1HB TRP 7 3.591 -3.033 -5.035
60 HD1 TRP 7 HD1 TRP 7 6.964 -4.472 -4.521
61 HE1 TRP 7 1HE TRP 7 7.423 -6.336 -6.219
62 HE3 TRP 7 3HE TRP 7 2.211 -5.151 -6.275
63 HZ2 TRP 7 2HZ TRP 7 5.966 -7.918 -8.041
64 HZ3 TRP 7 3HZ TRP 7 1.831 -6.870 -7.992
65 HH2 TRP 7 HH2 TRP 7 3.671 -8.223 -8.855
66 H VAL 8 H VAL 8 5.206 -0.458 -4.796
67 HA VAL 8 HA VAL 8 3.470 0.851 -2.798
68 HB VAL 8 HB VAL 8 5.388 2.516 -4.346
69 1HG1 VAL 8 1HG1 VAL 8 4.118 2.563 -1.638
70 2HG1 VAL 8 2HG1 VAL 8 4.036 3.759 -2.929
71 3HG1 VAL 8 3HG1 VAL 8 5.521 3.568 -1.997
72 1HG2 VAL 8 1HG2 VAL 8 6.922 2.018 -2.191
73 2HG2 VAL 8 2HG2 VAL 8 7.121 1.203 -3.742
74 3HG2 VAL 8 3HG2 VAL 8 6.221 0.420 -2.443
75 H VAL 9 H VAL 9 1.760 2.009 -3.541
76 HA VAL 9 HA VAL 9 1.576 2.380 -6.459
77 HB VAL 9 HB VAL 9 -1.042 2.370 -5.275
78 1HG1 VAL 9 1HG1 VAL 9 0.386 0.636 -7.280
79 2HG1 VAL 9 2HG1 VAL 9 -0.709 1.977 -7.602
80 3HG1 VAL 9 3HG1 VAL 9 -1.330 0.473 -6.916
81 1HG2 VAL 9 1HG2 VAL 9 -1.004 -0.150 -4.765
82 2HG2 VAL 9 2HG2 VAL 9 -0.403 0.951 -3.530
83 3HG2 VAL 9 3HG2 VAL 9 0.733 0.061 -4.541
84 H ASP 10 H ASP 10 1.883 4.455 -6.885
85 HA ASP 10 HA ASP 10 0.139 6.451 -5.785
86 1HB ASP 10 2HB ASP 10 2.272 6.017 -4.206
87 2HB ASP 10 1HB ASP 10 2.985 7.167 -5.332
88 H ASP 11 H ASP 11 1.822 8.681 -6.420
89 HA ASP 11 HA ASP 11 1.290 8.909 -9.177
90 1HB ASP 11 2HB ASP 11 2.624 10.587 -7.116
91 2HB ASP 11 1HB ASP 11 2.964 10.964 -8.802
92 H ASP 12 H ASP 12 3.736 7.167 -7.764
93 HA ASP 12 HA ASP 12 5.604 6.178 -8.597
94 1HB ASP 12 2HB ASP 12 3.977 6.391 -10.747
95 2HB ASP 12 1HB ASP 12 5.337 7.361 -11.303
96 H SER 13 H SER 13 7.296 7.254 -10.746
97 HA SER 13 HA SER 13 9.305 8.353 -10.653
98 1HB SER 13 2HB SER 13 7.449 9.656 -11.889
99 2HB SER 13 1HB SER 13 7.598 10.807 -10.564
100 HG SER 13 HG SER 13 9.329 10.266 -12.642
101 H SER 14 H SER 14 7.728 10.948 -8.915
102 HA SER 14 HA SER 14 9.841 11.407 -7.180
103 1HB SER 14 2HB SER 14 6.945 12.168 -7.159
104 2HB SER 14 1HB SER 14 7.929 12.507 -5.738
105 HG SER 14 HG SER 14 9.424 13.516 -7.332
106 H ILE 15 H ILE 15 6.757 9.776 -6.422
107 HA ILE 15 HA ILE 15 7.542 8.977 -3.836
108 HB ILE 15 HB ILE 15 5.464 7.608 -5.538
109 1HG1 ILE 15 2HG1 ILE 15 5.074 10.043 -5.501
110 2HG1 ILE 15 1HG1 ILE 15 3.839 9.176 -4.597
111 1HG2 ILE 15 1HG2 ILE 15 4.958 7.904 -2.693
112 2HG2 ILE 15 2HG2 ILE 15 6.434 6.998 -3.026
113 3HG2 ILE 15 3HG2 ILE 15 4.897 6.465 -3.708
114 1HD1 ILE 15 1HD1 ILE 15 4.717 9.874 -2.534
115 2HD1 ILE 15 2HD1 ILE 15 4.728 11.302 -3.568
116 3HD1 ILE 15 3HD1 ILE 15 6.224 10.419 -3.269
117 H ARG 16 H ARG 16 8.096 7.637 -6.968
118 HA ARG 16 HA ARG 16 8.669 4.976 -6.165
119 1HB ARG 16 2HB ARG 16 8.103 5.489 -8.470
120 2HB ARG 16 1HB ARG 16 9.530 6.504 -8.621
121 1HG ARG 16 2HG ARG 16 10.778 4.287 -7.950
122 2HG ARG 16 1HG ARG 16 9.307 3.538 -8.566
123 1HD ARG 16 2HD ARG 16 10.536 3.622 -10.488
124 2HD ARG 16 1HD ARG 16 9.722 5.185 -10.582
125 HE ARG 16 HE ARG 16 12.043 5.693 -9.232
126 1HH1 ARG 16 1HH1 ARG 16 11.256 4.286 -12.328
127 2HH1 ARG 16 2HH1 ARG 16 12.720 4.826 -13.083
128 1HH2 ARG 16 1HH2 ARG 16 13.961 6.398 -10.219
129 2HH2 ARG 16 2HH2 ARG 16 14.257 6.026 -11.883
130 H TRP 17 H TRP 17 10.847 7.652 -7.090
131 HA TRP 17 HA TRP 17 13.225 6.330 -6.509
132 1HB TRP 17 2HB TRP 17 13.117 8.441 -7.778
133 2HB TRP 17 1HB TRP 17 12.706 9.296 -6.293
134 HD1 TRP 17 HD1 TRP 17 15.643 7.283 -7.806
135 HE1 TRP 17 1HE TRP 17 17.824 8.105 -6.711
136 HE3 TRP 17 3HE TRP 17 13.660 10.518 -4.383
137 HZ2 TRP 17 2HZ TRP 17 18.599 9.895 -4.670
138 HZ3 TRP 17 3HZ TRP 17 15.187 11.747 -2.898
139 HH2 TRP 17 HH2 TRP 17 17.606 11.441 -3.037
140 H VAL 18 H VAL 18 11.143 8.253 -4.404
141 HA VAL 18 HA VAL 18 12.894 8.348 -2.215
142 HB VAL 18 HB VAL 18 9.898 8.403 -1.993
143 1HG1 VAL 18 1HG1 VAL 18 11.355 10.265 -0.353
144 2HG1 VAL 18 2HG1 VAL 18 11.954 8.624 -0.103
145 3HG1 VAL 18 3HG1 VAL 18 10.246 8.984 0.120
146 1HG2 VAL 18 1HG2 VAL 18 9.759 10.443 -2.905
147 2HG2 VAL 18 2HG2 VAL 18 11.286 10.032 -3.686
148 3HG2 VAL 18 3HG2 VAL 18 11.282 10.972 -2.195
149 H LEU 19 H LEU 19 10.192 6.176 -2.854
150 HA LEU 19 HA LEU 19 10.748 4.654 -0.494
151 1HB LEU 19 2HB LEU 19 8.541 4.994 -2.223
152 2HB LEU 19 1HB LEU 19 8.941 3.286 -2.223
153 HG LEU 19 HG LEU 19 7.237 3.891 -0.529
154 1HD1 LEU 19 1HD1 LEU 19 9.883 2.790 0.372
155 2HD1 LEU 19 2HD1 LEU 19 8.423 1.910 -0.083
156 3HD1 LEU 19 3HD1 LEU 19 8.468 2.828 1.423
157 1HD2 LEU 19 1HD2 LEU 19 8.964 5.013 1.442
158 2HD2 LEU 19 2HD2 LEU 19 7.483 5.681 0.759
159 3HD2 LEU 19 3HD2 LEU 19 9.034 6.010 -0.010
160 H GLU 20 H GLU 20 11.589 4.401 -3.844
161 HA GLU 20 HA GLU 20 12.080 1.624 -3.855
162 1HB GLU 20 2HB GLU 20 13.122 1.892 -5.944
163 2HB GLU 20 1HB GLU 20 11.808 3.047 -5.897
164 1HG GLU 20 2HG GLU 20 13.452 4.816 -5.376
165 2HG GLU 20 1HG GLU 20 14.734 3.620 -5.545
166 H ARG 21 H ARG 21 14.436 4.279 -3.742
167 HA ARG 21 HA ARG 21 16.614 2.583 -3.146
168 1HB ARG 21 2HB ARG 21 16.267 5.560 -2.821
169 2HB ARG 21 1HB ARG 21 17.786 4.724 -2.531
170 1HG ARG 21 2HG ARG 21 16.544 4.160 -5.129
171 2HG ARG 21 1HG ARG 21 17.058 5.830 -4.890
172 1HD ARG 21 2HD ARG 21 19.295 5.190 -4.509
173 2HD ARG 21 1HD ARG 21 18.858 3.497 -4.305
174 HE ARG 21 HE ARG 21 18.358 3.447 -6.699
175 1HH1 ARG 21 1HH1 ARG 21 20.353 6.075 -5.527
176 2HH1 ARG 21 2HH1 ARG 21 21.077 6.367 -7.071
177 1HH2 ARG 21 1HH2 ARG 21 19.313 3.844 -8.718
178 2HH2 ARG 21 2HH2 ARG 21 20.490 5.106 -8.878
179 H ALA 22 H ALA 22 14.711 4.763 -1.058
180 HA ALA 22 HA ALA 22 16.059 4.341 1.310
181 1HB ALA 22 1HB ALA 22 13.082 4.592 1.292
182 2HB ALA 22 2HB ALA 22 14.106 5.935 0.783
183 3HB ALA 22 3HB ALA 22 14.250 5.286 2.415
184 H LEU 23 H LEU 23 13.166 2.617 0.257
185 HA LEU 23 HA LEU 23 13.275 0.742 2.359
186 1HB LEU 23 2HB LEU 23 11.307 1.358 0.783
187 2HB LEU 23 1HB LEU 23 11.985 0.143 -0.278
188 HG LEU 23 HG LEU 23 11.362 -1.604 1.079
189 1HD1 LEU 23 1HD1 LEU 23 11.447 0.307 3.403
190 2HD1 LEU 23 2HD1 LEU 23 12.536 -1.045 3.076
191 3HD1 LEU 23 3HD1 LEU 23 10.856 -1.353 3.517
192 1HD2 LEU 23 1HD2 LEU 23 9.389 -0.117 0.376
193 2HD2 LEU 23 2HD2 LEU 23 9.304 0.320 2.081
194 3HD2 LEU 23 3HD2 LEU 23 9.109 -1.366 1.593
195 H ALA 24 H ALA 24 14.954 0.990 -0.629
196 HA ALA 24 HA ALA 24 15.660 -1.749 -0.914
197 1HB ALA 24 1HB ALA 24 17.095 -1.090 -2.622
198 2HB ALA 24 2HB ALA 24 17.383 0.494 -1.904
199 3HB ALA 24 3HB ALA 24 15.838 0.138 -2.672
200 H GLY 25 H GLY 25 17.007 1.050 0.738
201 1HA GLY 25 2HA GLY 25 19.480 -0.088 1.485
202 2HA GLY 25 1HA GLY 25 18.664 1.228 2.319
203 H ALA 26 H ALA 26 16.255 -0.530 2.668
204 HA ALA 26 HA ALA 26 17.005 -1.618 5.200
205 1HB ALA 26 1HB ALA 26 14.499 -2.444 4.988
206 2HB ALA 26 2HB ALA 26 14.473 -1.237 3.702
207 3HB ALA 26 3HB ALA 26 14.896 -0.762 5.347
208 H GLY 27 H GLY 27 16.925 -2.805 2.007
209 1HA GLY 27 2HA GLY 27 17.918 -4.901 1.476
210 2HA GLY 27 1HA GLY 27 17.390 -5.511 3.032
211 H LEU 28 H LEU 28 15.145 -3.772 0.953
212 HA LEU 28 HA LEU 28 13.961 -6.344 0.226
213 1HB LEU 28 2HB LEU 28 12.052 -4.153 0.654
214 2HB LEU 28 1HB LEU 28 11.917 -5.856 1.040
215 HG LEU 28 HG LEU 28 13.685 -5.160 2.916
216 1HD1 LEU 28 1HD1 LEU 28 12.503 -2.887 3.698
217 2HD1 LEU 28 2HD1 LEU 28 12.563 -2.660 1.949
218 3HD1 LEU 28 3HD1 LEU 28 14.046 -2.980 2.847
219 1HD2 LEU 28 1HD2 LEU 28 11.026 -5.862 2.824
220 2HD2 LEU 28 2HD2 LEU 28 11.027 -4.358 3.746
221 3HD2 LEU 28 3HD2 LEU 28 12.011 -5.720 4.281
222 H THR 29 H THR 29 12.171 -6.029 -1.466
223 HA THR 29 HA THR 29 13.296 -4.352 -3.591
224 HB THR 29 HB THR 29 11.470 -6.760 -3.644
225 HG1 THR 29 1HG THR 29 14.106 -6.244 -4.529
226 1HG2 THR 29 1HG2 THR 29 11.427 -6.684 -6.031
227 2HG2 THR 29 2HG2 THR 29 12.431 -5.235 -6.051
228 3HG2 THR 29 3HG2 THR 29 10.790 -5.159 -5.414
229 H CYS 30 H CYS 30 12.419 -2.382 -3.572
230 HA CYS 30 HA CYS 30 9.546 -2.104 -3.073
231 1HB CYS 30 2HB CYS 30 11.314 -0.788 -1.768
232 2HB CYS 30 1HB CYS 30 11.520 0.152 -3.237
233 HG CYS 30 HG CYS 30 9.664 1.018 -1.346
234 H THR 31 H THR 31 8.283 -2.029 -4.774
235 HA THR 31 HA THR 31 9.253 -0.717 -7.232
236 HB THR 31 HB THR 31 8.653 -3.265 -7.256
237 HG1 THR 31 1HG THR 31 7.363 -1.538 -9.104
238 1HG2 THR 31 1HG2 THR 31 6.447 -3.915 -7.449
239 2HG2 THR 31 2HG2 THR 31 5.885 -2.263 -7.695
240 3HG2 THR 31 3HG2 THR 31 6.410 -2.781 -6.097
241 H THR 32 H THR 32 7.583 0.528 -8.424
242 HA THR 32 HA THR 32 5.348 1.345 -6.720
243 HB THR 32 HB THR 32 5.715 3.661 -7.202
244 HG1 THR 32 1HG THR 32 6.724 4.168 -8.953
245 1HG2 THR 32 1HG2 THR 32 7.499 2.123 -5.722
246 2HG2 THR 32 2HG2 THR 32 7.238 3.864 -5.616
247 3HG2 THR 32 3HG2 THR 32 8.501 3.222 -6.669
248 H PHE 33 H PHE 33 3.632 2.548 -7.891
249 HA PHE 33 HA PHE 33 3.465 1.833 -10.720
250 1HB PHE 33 2HB PHE 33 1.284 1.239 -8.725
251 2HB PHE 33 1HB PHE 33 1.215 0.961 -10.459
252 HD1 PHE 33 1HD PHE 33 1.981 -1.015 -11.388
253 HD2 PHE 33 2HD PHE 33 3.084 -0.005 -7.415
254 HE1 PHE 33 1HE PHE 33 2.978 -3.244 -11.109
255 HE2 PHE 33 2HE PHE 33 4.099 -2.221 -7.123
256 HZ PHE 33 HZ PHE 33 4.038 -3.856 -8.974
257 H GLU 34 H GLU 34 1.323 2.736 -11.675
258 HA GLU 34 HA GLU 34 1.553 5.492 -11.802
259 1HB GLU 34 2HB GLU 34 -0.053 5.378 -13.440
260 2HB GLU 34 1HB GLU 34 0.451 3.697 -13.380
261 1HG GLU 34 2HG GLU 34 -1.553 3.591 -11.602
262 2HG GLU 34 1HG GLU 34 -2.114 4.941 -12.579
263 H ASN 35 H ASN 35 -0.813 3.617 -9.916
264 HA ASN 35 HA ASN 35 -1.290 5.771 -8.149
265 1HB ASN 35 2HB ASN 35 -3.223 5.262 -10.358
266 2HB ASN 35 1HB ASN 35 -3.855 5.698 -8.775
267 1HD2 ASN 35 1HD2 ASN 35 -3.780 7.101 -11.405
268 2HD2 ASN 35 2HD2 ASN 35 -3.096 8.649 -11.061
269 H GLY 36 H GLY 36 -3.288 3.150 -9.422
270 1HA GLY 36 2HA GLY 36 -2.896 1.579 -7.030
271 2HA GLY 36 1HA GLY 36 -4.486 2.300 -7.146
272 H ASN 37 H ASN 37 -4.721 1.993 -10.037
273 HA ASN 37 HA ASN 37 -5.870 -0.551 -10.076
274 1HB ASN 37 2HB ASN 37 -5.336 1.535 -12.116
275 2HB ASN 37 1HB ASN 37 -5.717 -0.085 -12.693
276 1HD2 ASN 37 1HD2 ASN 37 -7.576 -1.041 -11.129
277 2HD2 ASN 37 2HD2 ASN 37 -8.978 -0.036 -11.060
278 H GLU 38 H GLU 38 -2.663 0.512 -11.124
279 HA GLU 38 HA GLU 38 -1.850 -1.606 -12.664
280 1HB GLU 38 2HB GLU 38 -0.087 -0.481 -10.562
281 2HB GLU 38 1HB GLU 38 0.321 -0.929 -12.213
282 1HG GLU 38 2HG GLU 38 0.331 1.358 -12.299
283 2HG GLU 38 1HG GLU 38 -1.308 0.961 -12.816
284 H VAL 39 H VAL 39 -1.177 -1.366 -9.129
285 HA VAL 39 HA VAL 39 -0.072 -3.837 -8.726
286 HB VAL 39 HB VAL 39 -2.003 -2.460 -6.848
287 1HG1 VAL 39 1HG1 VAL 39 -0.514 -4.950 -6.643
288 2HG1 VAL 39 2HG1 VAL 39 -1.807 -4.327 -5.621
289 3HG1 VAL 39 3HG1 VAL 39 -0.138 -3.829 -5.339
290 1HG2 VAL 39 1HG2 VAL 39 1.005 -2.376 -6.859
291 2HG2 VAL 39 2HG2 VAL 39 -0.098 -1.432 -5.862
292 3HG2 VAL 39 3HG2 VAL 39 -0.009 -1.140 -7.598
293 H LEU 40 H LEU 40 -3.413 -3.069 -9.256
294 HA LEU 40 HA LEU 40 -4.539 -5.519 -8.439
295 1HB LEU 40 2HB LEU 40 -5.649 -3.794 -10.631
296 2HB LEU 40 1HB LEU 40 -6.523 -4.771 -9.462
297 HG LEU 40 HG LEU 40 -5.093 -2.163 -8.954
298 1HD1 LEU 40 1HD1 LEU 40 -7.657 -2.091 -7.918
299 2HD1 LEU 40 2HD1 LEU 40 -7.838 -2.917 -9.467
300 3HD1 LEU 40 3HD1 LEU 40 -7.098 -1.319 -9.394
301 1HD2 LEU 40 1HD2 LEU 40 -4.688 -2.884 -6.890
302 2HD2 LEU 40 2HD2 LEU 40 -5.620 -4.360 -7.144
303 3HD2 LEU 40 3HD2 LEU 40 -6.433 -2.878 -6.636
304 H ALA 41 H ALA 41 -3.341 -4.348 -11.554
305 HA ALA 41 HA ALA 41 -3.866 -6.871 -12.860
306 1HB ALA 41 1HB ALA 41 -2.227 -4.600 -13.942
307 2HB ALA 41 2HB ALA 41 -3.991 -4.612 -13.989
308 3HB ALA 41 3HB ALA 41 -3.076 -5.856 -14.843
309 H ALA 42 H ALA 42 -1.055 -5.015 -11.884
310 HA ALA 42 HA ALA 42 0.980 -6.693 -12.727
311 1HB ALA 42 1HB ALA 42 1.679 -4.607 -11.991
312 2HB ALA 42 2HB ALA 42 2.243 -5.678 -10.710
313 3HB ALA 42 3HB ALA 42 0.778 -4.724 -10.481
314 H LEU 43 H LEU 43 -0.956 -6.844 -9.776
315 HA LEU 43 HA LEU 43 0.573 -8.844 -8.499
316 1HB LEU 43 2HB LEU 43 -2.233 -7.866 -8.162
317 2HB LEU 43 1HB LEU 43 -1.644 -9.242 -7.247
318 HG LEU 43 HG LEU 43 -0.283 -6.570 -7.204
319 1HD1 LEU 43 1HD1 LEU 43 -2.498 -6.194 -6.368
320 2HD1 LEU 43 2HD1 LEU 43 -1.404 -6.299 -4.988
321 3HD1 LEU 43 3HD1 LEU 43 -2.435 -7.670 -5.403
322 1HD2 LEU 43 1HD2 LEU 43 -0.088 -9.126 -5.675
323 2HD2 LEU 43 2HD2 LEU 43 0.469 -7.600 -4.984
324 3HD2 LEU 43 3HD2 LEU 43 1.192 -8.210 -6.470
325 H ALA 44 H ALA 44 -1.754 -8.959 -11.020
326 HA ALA 44 HA ALA 44 -2.827 -11.495 -10.758
327 1HB ALA 44 1HB ALA 44 -3.619 -11.229 -12.868
328 2HB ALA 44 2HB ALA 44 -2.087 -10.616 -13.489
329 3HB ALA 44 3HB ALA 44 -3.143 -9.561 -12.551
330 H SER 45 H SER 45 0.427 -10.640 -11.407
331 HA SER 45 HA SER 45 1.009 -13.397 -12.172
332 1HB SER 45 2HB SER 45 2.215 -10.819 -13.103
333 2HB SER 45 1HB SER 45 3.165 -12.305 -13.151
334 HG SER 45 HG SER 45 0.579 -12.104 -14.284
335 H LYS 46 H LYS 46 1.322 -11.191 -9.689
336 HA LYS 46 HA LYS 46 3.109 -12.879 -8.259
337 1HB LYS 46 2HB LYS 46 4.477 -11.219 -9.837
338 2HB LYS 46 1HB LYS 46 4.218 -10.137 -8.477
339 1HG LYS 46 2HG LYS 46 5.077 -12.607 -7.418
340 2HG LYS 46 1HG LYS 46 6.141 -12.212 -8.772
341 1HD LYS 46 2HD LYS 46 7.099 -10.516 -7.662
342 2HD LYS 46 1HD LYS 46 5.552 -9.927 -7.051
343 1HE LYS 46 2HE LYS 46 5.618 -11.851 -5.408
344 2HE LYS 46 1HE LYS 46 7.289 -12.106 -5.912
345 1HZ LYS 46 1HZ LYS 46 6.198 -9.610 -4.724
346 2HZ LYS 46 2HZ LYS 46 7.799 -9.846 -5.215
347 3HZ LYS 46 3HZ LYS 46 7.170 -10.744 -3.928
348 H THR 47 H THR 47 3.542 -12.079 -6.055
349 HA THR 47 HA THR 47 1.722 -10.008 -5.147
350 HB THR 47 HB THR 47 1.820 -12.801 -4.010
351 HG1 THR 47 1HG THR 47 -0.612 -12.220 -4.520
352 1HG2 THR 47 1HG2 THR 47 -0.028 -10.651 -3.048
353 2HG2 THR 47 2HG2 THR 47 1.559 -10.896 -2.310
354 3HG2 THR 47 3HG2 THR 47 0.368 -12.199 -2.302
355 HA PRO 48 HA PRO 48 5.487 -9.214 -2.831
356 1HB PRO 48 2HB PRO 48 4.890 -6.744 -2.003
357 2HB PRO 48 1HB PRO 48 5.296 -7.067 -3.693
358 1HG PRO 48 2HG PRO 48 2.618 -6.662 -2.433
359 2HG PRO 48 1HG PRO 48 3.228 -6.067 -3.986
360 1HD PRO 48 2HD PRO 48 1.614 -8.285 -3.682
361 2HD PRO 48 1HD PRO 48 2.679 -7.999 -5.071
362 H ASP 49 H ASP 49 5.988 -8.693 -0.545
363 HA ASP 49 HA ASP 49 4.180 -10.063 1.194
364 1HB ASP 49 2HB ASP 49 6.725 -8.545 1.816
365 2HB ASP 49 1HB ASP 49 5.849 -9.560 2.960
366 H VAL 50 H VAL 50 4.764 -6.740 0.386
367 HA VAL 50 HA VAL 50 2.586 -5.954 2.169
368 HB VAL 50 HB VAL 50 4.632 -5.522 3.452
369 1HG1 VAL 50 1HG1 VAL 50 5.919 -5.136 1.194
370 2HG1 VAL 50 2HG1 VAL 50 6.449 -4.357 2.686
371 3HG1 VAL 50 3HG1 VAL 50 5.504 -3.451 1.506
372 1HG2 VAL 50 1HG2 VAL 50 3.417 -2.958 2.430
373 2HG2 VAL 50 2HG2 VAL 50 4.215 -3.202 3.983
374 3HG2 VAL 50 3HG2 VAL 50 2.684 -4.012 3.641
375 H LEU 51 H LEU 51 1.758 -3.731 1.599
376 HA LEU 51 HA LEU 51 2.573 -2.705 -0.984
377 1HB LEU 51 2HB LEU 51 0.981 -4.543 -1.508
378 2HB LEU 51 1HB LEU 51 -0.251 -3.690 -0.597
379 HG LEU 51 HG LEU 51 0.114 -1.745 -2.222
380 1HD1 LEU 51 1HD1 LEU 51 2.216 -2.442 -3.181
381 2HD1 LEU 51 2HD1 LEU 51 0.978 -2.404 -4.437
382 3HD1 LEU 51 3HD1 LEU 51 1.493 -3.947 -3.751
383 1HD2 LEU 51 1HD2 LEU 51 -1.778 -3.486 -2.200
384 2HD2 LEU 51 2HD2 LEU 51 -0.935 -4.206 -3.570
385 3HD2 LEU 51 3HD2 LEU 51 -1.524 -2.548 -3.672
386 H LEU 52 H LEU 52 2.458 -0.587 -1.002
387 HA LEU 52 HA LEU 52 0.818 0.793 1.014
388 1HB LEU 52 2HB LEU 52 3.486 1.055 0.331
389 2HB LEU 52 1HB LEU 52 2.730 2.390 -0.510
390 HG LEU 52 HG LEU 52 2.335 1.921 2.435
391 1HD1 LEU 52 1HD1 LEU 52 4.029 4.059 2.209
392 2HD1 LEU 52 2HD1 LEU 52 4.653 2.951 0.990
393 3HD1 LEU 52 3HD1 LEU 52 4.507 2.423 2.665
394 1HD2 LEU 52 1HD2 LEU 52 1.933 4.291 0.614
395 2HD2 LEU 52 2HD2 LEU 52 1.780 4.337 2.371
396 3HD2 LEU 52 3HD2 LEU 52 0.677 3.348 1.416
397 H SER 53 H SER 53 -1.072 1.553 0.240
398 HA SER 53 HA SER 53 -1.158 2.425 -2.572
399 1HB SER 53 2HB SER 53 -2.773 0.794 -2.510
400 2HB SER 53 1HB SER 53 -3.151 1.075 -0.813
401 HG SER 53 HG SER 53 -3.876 2.737 -3.000
402 H ASP 54 H ASP 54 -1.875 4.421 -3.118
403 HA ASP 54 HA ASP 54 -1.977 6.391 -1.006
404 1HB ASP 54 2HB ASP 54 -2.063 8.029 -2.849
405 2HB ASP 54 1HB ASP 54 -0.736 6.891 -3.053
406 H ILE 55 H ILE 55 -3.712 8.278 -1.783
407 HA ILE 55 HA ILE 55 -6.290 7.228 -2.442
408 HB ILE 55 HB ILE 55 -6.151 6.480 -0.136
409 1HG1 ILE 55 2HG1 ILE 55 -7.982 8.869 -0.282
410 2HG1 ILE 55 1HG1 ILE 55 -8.335 7.315 -1.018
411 1HG2 ILE 55 1HG2 ILE 55 -5.490 9.340 0.441
412 2HG2 ILE 55 2HG2 ILE 55 -4.588 7.886 0.868
413 3HG2 ILE 55 3HG2 ILE 55 -6.112 8.246 1.677
414 1HD1 ILE 55 1HD1 ILE 55 -9.517 7.371 1.005
415 2HD1 ILE 55 2HD1 ILE 55 -8.129 8.001 1.891
416 3HD1 ILE 55 3HD1 ILE 55 -8.119 6.337 1.305
417 H ARG 56 H ARG 56 -8.018 8.992 -2.118
418 HA ARG 56 HA ARG 56 -8.816 10.992 -2.746
419 1HB ARG 56 2HB ARG 56 -7.965 12.950 -1.717
420 2HB ARG 56 1HB ARG 56 -7.759 11.643 -0.567
421 1HG ARG 56 2HG ARG 56 -5.460 11.656 -0.764
422 2HG ARG 56 1HG ARG 56 -5.493 12.442 -2.345
423 1HD ARG 56 2HD ARG 56 -6.175 14.522 -1.354
424 2HD ARG 56 1HD ARG 56 -6.368 13.760 0.220
425 HE ARG 56 HE ARG 56 -3.961 13.507 0.306
426 1HH1 ARG 56 1HH1 ARG 56 -5.191 15.678 -2.147
427 2HH1 ARG 56 2HH1 ARG 56 -3.710 16.560 -2.275
428 1HH2 ARG 56 1HH2 ARG 56 -2.021 14.677 0.129
429 2HH2 ARG 56 2HH2 ARG 56 -1.915 15.996 -0.990
430 H MET 57 H MET 57 -7.564 9.592 -4.654
431 HA MET 57 HA MET 57 -6.780 11.677 -6.498
432 1HB MET 57 2HB MET 57 -4.870 9.726 -5.410
433 2HB MET 57 1HB MET 57 -4.899 9.793 -7.165
434 1HG MET 57 2HG MET 57 -4.451 12.173 -7.107
435 2HG MET 57 1HG MET 57 -4.491 12.154 -5.346
436 1HE MET 57 1HE MET 57 -1.290 12.091 -4.346
437 2HE MET 57 2HE MET 57 -1.879 10.463 -4.011
438 3HE MET 57 3HE MET 57 -2.990 11.831 -3.958
439 HA PRO 58 HA PRO 58 -7.555 7.600 -9.059
440 1HB PRO 58 2HB PRO 58 -8.234 5.395 -7.558
441 2HB PRO 58 1HB PRO 58 -6.603 5.734 -8.145
442 1HG PRO 58 2HG PRO 58 -7.806 6.302 -5.461
443 2HG PRO 58 1HG PRO 58 -6.217 5.612 -5.850
444 1HD PRO 58 2HD PRO 58 -6.429 8.176 -5.176
445 2HD PRO 58 1HD PRO 58 -5.336 7.679 -6.482
446 H GLY 59 H GLY 59 -9.572 5.772 -8.863
447 1HA GLY 59 2HA GLY 59 -11.883 7.254 -9.164
448 2HA GLY 59 1HA GLY 59 -11.852 5.529 -8.834
449 H MET 60 H MET 60 -12.032 4.802 -6.654
450 HA MET 60 HA MET 60 -13.705 6.503 -5.059
451 1HB MET 60 2HB MET 60 -13.363 3.747 -5.313
452 2HB MET 60 1HB MET 60 -12.786 4.103 -3.691
453 1HG MET 60 2HG MET 60 -14.848 4.408 -2.931
454 2HG MET 60 1HG MET 60 -15.259 5.478 -4.270
455 1HE MET 60 1HE MET 60 -15.546 4.678 -6.578
456 2HE MET 60 2HE MET 60 -17.259 4.463 -6.217
457 3HE MET 60 3HE MET 60 -16.367 3.191 -7.051
458 H ASP 61 H ASP 61 -11.744 8.034 -5.111
459 HA ASP 61 HA ASP 61 -10.220 9.239 -3.965
460 1HB ASP 61 2HB ASP 61 -11.740 7.781 -1.909
461 2HB ASP 61 1HB ASP 61 -10.177 8.404 -1.379
462 H GLY 62 H GLY 62 -10.026 6.042 -2.453
463 1HA GLY 62 2HA GLY 62 -7.486 5.446 -3.641
464 2HA GLY 62 1HA GLY 62 -7.351 5.895 -1.945
465 H LEU 63 H LEU 63 -9.937 4.787 -1.223
466 HA LEU 63 HA LEU 63 -9.117 2.175 -0.591
467 1HB LEU 63 2HB LEU 63 -11.997 2.998 -0.556
468 2HB LEU 63 1HB LEU 63 -11.162 1.886 0.509
469 HG LEU 63 HG LEU 63 -9.841 4.134 1.132
470 1HD1 LEU 63 1HD1 LEU 63 -10.932 6.066 0.781
471 2HD1 LEU 63 2HD1 LEU 63 -12.517 5.320 0.959
472 3HD1 LEU 63 3HD1 LEU 63 -11.650 5.184 -0.566
473 1HD2 LEU 63 1HD2 LEU 63 -10.742 2.948 2.893
474 2HD2 LEU 63 2HD2 LEU 63 -12.364 2.945 2.203
475 3HD2 LEU 63 3HD2 LEU 63 -11.714 4.419 2.923
476 H ALA 64 H ALA 64 -10.403 3.461 -3.453
477 HA ALA 64 HA ALA 64 -12.025 1.430 -4.425
478 1HB ALA 64 1HB ALA 64 -10.310 2.398 -6.518
479 2HB ALA 64 2HB ALA 64 -10.784 3.727 -5.459
480 3HB ALA 64 3HB ALA 64 -12.020 2.732 -6.231
481 H LEU 65 H LEU 65 -8.555 1.577 -4.063
482 HA LEU 65 HA LEU 65 -7.842 -0.612 -5.688
483 1HB LEU 65 2HB LEU 65 -6.573 0.644 -3.269
484 2HB LEU 65 1HB LEU 65 -5.863 -0.750 -4.060
485 HG LEU 65 HG LEU 65 -5.933 0.704 -6.202
486 1HD1 LEU 65 1HD1 LEU 65 -7.338 2.485 -5.287
487 2HD1 LEU 65 2HD1 LEU 65 -5.765 3.105 -5.787
488 3HD1 LEU 65 3HD1 LEU 65 -6.105 2.839 -4.078
489 1HD2 LEU 65 1HD2 LEU 65 -3.844 1.998 -5.023
490 2HD2 LEU 65 2HD2 LEU 65 -3.785 0.353 -5.658
491 3HD2 LEU 65 3HD2 LEU 65 -4.074 0.626 -3.941
492 H LEU 66 H LEU 66 -8.414 -0.391 -2.186
493 HA LEU 66 HA LEU 66 -8.064 -2.983 -1.413
494 1HB LEU 66 2HB LEU 66 -10.009 -0.883 -0.521
495 2HB LEU 66 1HB LEU 66 -10.045 -2.478 0.204
496 HG LEU 66 HG LEU 66 -8.750 -1.096 1.639
497 1HD1 LEU 66 1HD1 LEU 66 -7.859 -3.363 1.208
498 2HD1 LEU 66 2HD1 LEU 66 -6.610 -2.200 1.658
499 3HD1 LEU 66 3HD1 LEU 66 -6.804 -2.677 -0.028
500 1HD2 LEU 66 1HD2 LEU 66 -6.795 -0.401 -0.501
501 2HD2 LEU 66 2HD2 LEU 66 -7.172 0.446 1.001
502 3HD2 LEU 66 3HD2 LEU 66 -8.289 0.524 -0.362
503 H LYS 67 H LYS 67 -10.990 -1.586 -2.819
504 HA LYS 67 HA LYS 67 -12.613 -3.856 -2.696
505 1HB LYS 67 2HB LYS 67 -12.583 -1.462 -4.514
506 2HB LYS 67 1HB LYS 67 -13.761 -2.750 -4.728
507 1HG LYS 67 2HG LYS 67 -14.498 -2.408 -2.392
508 2HG LYS 67 1HG LYS 67 -13.386 -1.042 -2.279
509 1HD LYS 67 2HD LYS 67 -14.639 -0.208 -4.411
510 2HD LYS 67 1HD LYS 67 -15.902 -1.318 -3.874
511 1HE LYS 67 2HE LYS 67 -15.274 0.000 -1.563
512 2HE LYS 67 1HE LYS 67 -15.066 1.264 -2.774
513 1HZ LYS 67 1HZ LYS 67 -17.468 -0.319 -3.069
514 2HZ LYS 67 2HZ LYS 67 -17.256 1.356 -3.170
515 3HZ LYS 67 3HZ LYS 67 -17.412 0.613 -1.658
516 H GLN 68 H GLN 68 -10.658 -2.678 -5.452
517 HA GLN 68 HA GLN 68 -11.159 -4.925 -7.084
518 1HB GLN 68 2HB GLN 68 -8.751 -3.103 -7.130
519 2HB GLN 68 1HB GLN 68 -9.281 -4.149 -8.437
520 1HG GLN 68 2HG GLN 68 -10.762 -1.765 -7.352
521 2HG GLN 68 1HG GLN 68 -9.876 -1.843 -8.876
522 1HE2 GLN 68 1HE2 GLN 68 -10.602 -3.908 -10.178
523 2HE2 GLN 68 2HE2 GLN 68 -12.313 -4.044 -10.387
524 H ILE 69 H ILE 69 -8.919 -4.311 -4.506
525 HA ILE 69 HA ILE 69 -7.031 -6.316 -5.050
526 HB ILE 69 HB ILE 69 -7.806 -4.903 -2.515
527 1HG1 ILE 69 2HG1 ILE 69 -5.145 -4.844 -3.909
528 2HG1 ILE 69 1HG1 ILE 69 -6.479 -3.845 -4.482
529 1HG2 ILE 69 1HG2 ILE 69 -6.223 -7.345 -2.785
530 2HG2 ILE 69 2HG2 ILE 69 -6.939 -6.610 -1.352
531 3HG2 ILE 69 3HG2 ILE 69 -5.379 -6.044 -1.947
532 1HD1 ILE 69 1HD1 ILE 69 -6.133 -2.351 -2.882
533 2HD1 ILE 69 2HD1 ILE 69 -4.637 -3.212 -2.513
534 3HD1 ILE 69 3HD1 ILE 69 -6.117 -3.593 -1.631
535 H LYS 70 H LYS 70 -10.056 -6.380 -3.309
536 HA LYS 70 HA LYS 70 -9.677 -9.006 -2.274
537 1HB LYS 70 2HB LYS 70 -11.896 -8.836 -1.414
538 2HB LYS 70 1HB LYS 70 -11.123 -7.270 -1.218
539 1HG LYS 70 2HG LYS 70 -12.347 -6.342 -3.011
540 2HG LYS 70 1HG LYS 70 -12.958 -7.921 -3.504
541 1HD LYS 70 2HD LYS 70 -14.367 -8.069 -1.626
542 2HD LYS 70 1HD LYS 70 -13.518 -6.774 -0.782
543 1HE LYS 70 2HE LYS 70 -14.867 -5.243 -1.658
544 2HE LYS 70 1HE LYS 70 -14.535 -5.817 -3.293
545 1HZ LYS 70 1HZ LYS 70 -16.642 -6.752 -1.431
546 2HZ LYS 70 2HZ LYS 70 -16.214 -7.604 -2.830
547 3HZ LYS 70 3HZ LYS 70 -16.839 -6.039 -2.953
548 H GLN 71 H GLN 71 -11.027 -7.672 -5.160
549 HA GLN 71 HA GLN 71 -12.526 -9.933 -5.935
550 1HB GLN 71 2HB GLN 71 -11.660 -7.408 -7.202
551 2HB GLN 71 1HB GLN 71 -12.016 -8.736 -8.302
552 1HG GLN 71 2HG GLN 71 -14.239 -8.781 -7.757
553 2HG GLN 71 1HG GLN 71 -13.974 -8.092 -6.157
554 1HE2 GLN 71 1HE2 GLN 71 -12.889 -5.796 -6.377
555 2HE2 GLN 71 2HE2 GLN 71 -13.726 -4.726 -7.443
556 H ARG 72 H ARG 72 -9.180 -9.064 -6.316
557 HA ARG 72 HA ARG 72 -8.771 -11.522 -7.874
558 1HB ARG 72 2HB ARG 72 -7.634 -8.832 -8.133
559 2HB ARG 72 1HB ARG 72 -6.459 -10.134 -8.261
560 1HG ARG 72 2HG ARG 72 -8.845 -10.661 -9.823
561 2HG ARG 72 1HG ARG 72 -8.057 -9.151 -10.285
562 1HD ARG 72 2HD ARG 72 -6.333 -10.221 -11.221
563 2HD ARG 72 1HD ARG 72 -6.168 -11.321 -9.857
564 HE ARG 72 HE ARG 72 -7.689 -12.802 -10.896
565 1HH1 ARG 72 1HH1 ARG 72 -6.945 -10.018 -12.872
566 2HH1 ARG 72 2HH1 ARG 72 -7.487 -10.761 -14.337
567 1HH2 ARG 72 1HH2 ARG 72 -8.399 -13.777 -12.829
568 2HH2 ARG 72 2HH2 ARG 72 -8.314 -12.889 -14.314
569 H HIS 73 H HIS 73 -6.994 -9.466 -5.598
570 HA HIS 73 HA HIS 73 -5.294 -11.671 -4.849
571 1HB HIS 73 2HB HIS 73 -5.313 -9.200 -3.205
572 2HB HIS 73 1HB HIS 73 -3.952 -10.131 -3.833
573 HD1 HIS 73 1HD HIS 73 -4.266 -10.010 -6.773
574 HD2 HIS 73 2HD HIS 73 -5.176 -6.775 -4.352
575 HE1 HIS 73 1HE HIS 73 -4.154 -8.000 -8.274
576 HE2 HIS 73 2HE HIS 73 -4.469 -6.041 -6.722
577 HA PRO 74 HA PRO 74 -7.575 -13.181 -1.435
578 1HB PRO 74 2HB PRO 74 -5.572 -14.200 0.101
579 2HB PRO 74 1HB PRO 74 -6.155 -14.963 -1.381
580 1HG PRO 74 2HG PRO 74 -3.693 -13.369 -0.912
581 2HG PRO 74 1HG PRO 74 -3.963 -14.727 -2.013
582 1HD PRO 74 2HD PRO 74 -3.886 -12.062 -2.757
583 2HD PRO 74 1HD PRO 74 -4.637 -13.363 -3.700
584 H MET 75 H MET 75 -4.636 -12.311 0.348
585 HA MET 75 HA MET 75 -6.143 -10.207 1.728
586 1HB MET 75 2HB MET 75 -4.525 -12.324 3.149
587 2HB MET 75 1HB MET 75 -5.421 -11.011 3.899
588 1HG MET 75 2HG MET 75 -7.406 -12.061 3.696
589 2HG MET 75 1HG MET 75 -6.978 -12.805 2.157
590 1HE MET 75 1HE MET 75 -8.639 -14.247 3.556
591 2HE MET 75 2HE MET 75 -8.283 -14.596 5.248
592 3HE MET 75 3HE MET 75 -7.993 -15.823 4.014
593 H LEU 76 H LEU 76 -4.331 -9.562 -0.158
594 HA LEU 76 HA LEU 76 -1.671 -9.276 0.733
595 1HB LEU 76 2HB LEU 76 -2.988 -8.835 -1.611
596 2HB LEU 76 1HB LEU 76 -2.685 -7.194 -1.074
597 HG LEU 76 HG LEU 76 -0.559 -9.305 -1.422
598 1HD1 LEU 76 1HD1 LEU 76 -0.543 -6.972 -3.174
599 2HD1 LEU 76 2HD1 LEU 76 -1.937 -8.028 -3.406
600 3HD1 LEU 76 3HD1 LEU 76 -0.306 -8.679 -3.550
601 1HD2 LEU 76 1HD2 LEU 76 -0.598 -6.709 -0.147
602 2HD2 LEU 76 2HD2 LEU 76 0.554 -6.755 -1.481
603 3HD2 LEU 76 3HD2 LEU 76 0.673 -7.931 -0.173
604 HA PRO 77 HA PRO 77 -2.458 -6.202 3.937
605 1HB PRO 77 2HB PRO 77 0.490 -5.905 3.702
606 2HB PRO 77 1HB PRO 77 -0.503 -6.187 5.137
607 1HG PRO 77 2HG PRO 77 0.966 -8.147 4.081
608 2HG PRO 77 1HG PRO 77 -0.643 -8.466 4.758
609 1HD PRO 77 2HD PRO 77 0.211 -8.260 1.902
610 2HD PRO 77 1HD PRO 77 -0.989 -9.336 2.648
611 H VAL 78 H VAL 78 -3.258 -4.300 3.292
612 HA VAL 78 HA VAL 78 -1.695 -2.682 1.390
613 HB VAL 78 HB VAL 78 -4.607 -2.249 2.001
614 1HG1 VAL 78 1HG1 VAL 78 -4.645 -1.043 -0.044
615 2HG1 VAL 78 2HG1 VAL 78 -3.034 -1.609 -0.483
616 3HG1 VAL 78 3HG1 VAL 78 -3.238 -0.483 0.860
617 1HG2 VAL 78 1HG2 VAL 78 -3.495 -3.971 -0.212
618 2HG2 VAL 78 2HG2 VAL 78 -5.192 -3.601 0.087
619 3HG2 VAL 78 3HG2 VAL 78 -4.290 -4.577 1.242
620 H ILE 79 H ILE 79 -1.291 -0.544 1.794
621 HA ILE 79 HA ILE 79 -2.059 0.492 4.439
622 HB ILE 79 HB ILE 79 0.629 1.017 3.175
623 1HG1 ILE 79 2HG1 ILE 79 0.804 -0.614 5.533
624 2HG1 ILE 79 1HG1 ILE 79 -0.249 -1.405 4.368
625 1HG2 ILE 79 1HG2 ILE 79 0.557 1.251 6.017
626 2HG2 ILE 79 2HG2 ILE 79 -0.779 2.173 5.332
627 3HG2 ILE 79 3HG2 ILE 79 0.873 2.497 4.810
628 1HD1 ILE 79 1HD1 ILE 79 1.450 -1.927 3.023
629 2HD1 ILE 79 2HD1 ILE 79 2.458 -1.602 4.433
630 3HD1 ILE 79 3HD1 ILE 79 2.216 -0.349 3.215
631 H ILE 80 H ILE 80 -3.383 2.161 4.062
632 HA ILE 80 HA ILE 80 -2.965 3.789 1.675
633 HB ILE 80 HB ILE 80 -5.292 3.913 3.583
634 1HG1 ILE 80 2HG1 ILE 80 -5.139 1.671 2.636
635 2HG1 ILE 80 1HG1 ILE 80 -6.481 2.536 1.900
636 1HG2 ILE 80 1HG2 ILE 80 -6.192 5.456 2.231
637 2HG2 ILE 80 2HG2 ILE 80 -5.646 4.641 0.770
638 3HG2 ILE 80 3HG2 ILE 80 -4.545 5.696 1.656
639 1HD1 ILE 80 1HD1 ILE 80 -5.143 2.974 -0.075
640 2HD1 ILE 80 2HD1 ILE 80 -5.232 1.244 0.263
641 3HD1 ILE 80 3HD1 ILE 80 -3.771 2.148 0.664
642 H MET 81 H MET 81 -2.573 5.951 1.686
643 HA MET 81 HA MET 81 -1.195 6.991 3.948
644 1HB MET 81 2HB MET 81 -0.812 8.961 2.584
645 2HB MET 81 1HB MET 81 -0.532 7.500 1.647
646 1HG MET 81 2HG MET 81 -2.637 7.751 0.523
647 2HG MET 81 1HG MET 81 -3.068 9.115 1.551
648 1HE MET 81 1HE MET 81 -1.782 12.084 0.023
649 2HE MET 81 2HE MET 81 -0.786 11.484 1.347
650 3HE MET 81 3HE MET 81 -2.533 11.252 1.384
651 H THR 82 H THR 82 -4.458 7.478 2.719
652 HA THR 82 HA THR 82 -5.058 8.996 5.131
653 HB THR 82 HB THR 82 -5.904 10.063 2.446
654 HG1 THR 82 1HG THR 82 -3.730 10.891 4.068
655 1HG2 THR 82 1HG2 THR 82 -7.328 10.931 4.080
656 2HG2 THR 82 2HG2 THR 82 -6.114 12.182 3.814
657 3HG2 THR 82 3HG2 THR 82 -6.014 11.140 5.236
658 H ALA 83 H ALA 83 -7.502 9.421 5.303
659 HA ALA 83 HA ALA 83 -9.071 7.364 3.926
660 1HB ALA 83 1HB ALA 83 -9.603 7.570 6.815
661 2HB ALA 83 2HB ALA 83 -8.087 6.794 6.354
662 3HB ALA 83 3HB ALA 83 -9.619 6.164 5.749
663 H HIS 84 H HIS 84 -8.912 10.410 5.547
664 HA HIS 84 HA HIS 84 -10.479 11.965 6.142
665 1HB HIS 84 2HB HIS 84 -11.872 12.531 3.947
666 2HB HIS 84 1HB HIS 84 -10.168 12.924 4.117
667 HD1 HIS 84 1HD HIS 84 -8.495 11.606 2.686
668 HD2 HIS 84 2HD HIS 84 -12.457 10.534 2.061
669 HE1 HIS 84 1HE HIS 84 -8.491 10.217 0.600
670 HE2 HIS 84 2HE HIS 84 -10.866 9.417 0.359
671 H SER 85 H SER 85 -12.912 10.937 3.875
672 HA SER 85 HA SER 85 -14.558 10.054 6.151
673 1HB SER 85 2HB SER 85 -16.450 10.957 4.503
674 2HB SER 85 1HB SER 85 -15.619 12.013 5.646
675 HG SER 85 HG SER 85 -15.088 11.684 2.881
676 H ASP 86 H ASP 86 -13.307 9.122 3.134
677 HA ASP 86 HA ASP 86 -15.494 7.362 2.453
678 1HB ASP 86 2HB ASP 86 -12.806 7.931 1.252
679 2HB ASP 86 1HB ASP 86 -13.697 6.493 0.769
680 H LEU 87 H LEU 87 -13.849 7.130 5.023
681 HA LEU 87 HA LEU 87 -12.282 4.881 5.117
682 1HB LEU 87 2HB LEU 87 -13.815 6.471 6.998
683 2HB LEU 87 1HB LEU 87 -13.747 4.784 7.475
684 HG LEU 87 HG LEU 87 -11.311 6.438 6.831
685 1HD1 LEU 87 1HD1 LEU 87 -12.173 7.469 8.738
686 2HD1 LEU 87 2HD1 LEU 87 -11.010 6.302 9.366
687 3HD1 LEU 87 3HD1 LEU 87 -12.736 5.942 9.420
688 1HD2 LEU 87 1HD2 LEU 87 -10.792 4.156 6.561
689 2HD2 LEU 87 2HD2 LEU 87 -11.741 3.692 7.974
690 3HD2 LEU 87 3HD2 LEU 87 -10.228 4.575 8.178
691 H ASP 88 H ASP 88 -15.656 5.045 4.519
692 HA ASP 88 HA ASP 88 -16.703 2.739 5.516
693 1HB ASP 88 2HB ASP 88 -17.209 4.336 3.071
694 2HB ASP 88 1HB ASP 88 -17.914 2.725 3.119
695 H ALA 89 H ALA 89 -15.044 2.963 2.339
696 HA ALA 89 HA ALA 89 -15.165 0.184 1.860
697 1HB ALA 89 1HB ALA 89 -14.837 1.605 -0.015
698 2HB ALA 89 2HB ALA 89 -13.369 0.639 0.156
699 3HB ALA 89 3HB ALA 89 -13.392 2.320 0.695
700 H ALA 90 H ALA 90 -13.145 2.101 3.849
701 HA ALA 90 HA ALA 90 -10.845 0.448 3.918
702 1HB ALA 90 1HB ALA 90 -10.088 1.798 5.654
703 2HB ALA 90 2HB ALA 90 -11.720 2.140 6.229
704 3HB ALA 90 3HB ALA 90 -11.137 2.878 4.738
705 H VAL 91 H VAL 91 -13.806 0.575 5.853
706 HA VAL 91 HA VAL 91 -13.067 -1.210 7.848
707 HB VAL 91 HB VAL 91 -15.863 -1.129 6.767
708 1HG1 VAL 91 1HG1 VAL 91 -16.090 -2.544 8.487
709 2HG1 VAL 91 2HG1 VAL 91 -15.919 -1.120 9.515
710 3HG1 VAL 91 3HG1 VAL 91 -14.509 -2.122 9.155
711 1HG2 VAL 91 1HG2 VAL 91 -15.329 1.170 6.937
712 2HG2 VAL 91 2HG2 VAL 91 -14.425 0.926 8.431
713 3HG2 VAL 91 3HG2 VAL 91 -16.182 0.767 8.427
714 H SER 92 H SER 92 -14.599 -1.856 4.722
715 HA SER 92 HA SER 92 -14.844 -4.637 5.060
716 1HB SER 92 2HB SER 92 -14.710 -2.852 2.635
717 2HB SER 92 1HB SER 92 -14.792 -4.605 2.466
718 HG SER 92 HG SER 92 -16.829 -3.167 2.610
719 H ALA 93 H ALA 93 -12.293 -2.628 3.660
720 HA ALA 93 HA ALA 93 -10.579 -4.507 2.659
721 1HB ALA 93 1HB ALA 93 -9.755 -2.070 4.214
722 2HB ALA 93 2HB ALA 93 -10.246 -2.070 2.518
723 3HB ALA 93 3HB ALA 93 -8.789 -2.931 3.015
724 H TYR 94 H TYR 94 -10.932 -3.496 5.997
725 HA TYR 94 HA TYR 94 -8.816 -4.916 7.126
726 1HB TYR 94 2HB TYR 94 -11.520 -4.480 8.409
727 2HB TYR 94 1HB TYR 94 -9.994 -4.770 9.236
728 HD1 TYR 94 1HD TYR 94 -8.186 -2.936 7.807
729 HD2 TYR 94 2HD TYR 94 -12.196 -2.374 9.113
730 HE1 TYR 94 1HE TYR 94 -7.789 -0.512 7.951
731 HE2 TYR 94 2HE TYR 94 -11.811 0.050 9.258
732 HH TYR 94 HH TYR 94 -10.308 1.741 8.314
733 H GLN 95 H GLN 95 -11.848 -5.978 5.895
734 HA GLN 95 HA GLN 95 -11.913 -8.499 7.228
735 1HB GLN 95 2HB GLN 95 -13.963 -8.651 6.342
736 2HB GLN 95 1HB GLN 95 -13.704 -7.045 5.688
737 1HG GLN 95 2HG GLN 95 -12.558 -8.875 3.857
738 2HG GLN 95 1HG GLN 95 -14.131 -9.508 4.318
739 1HE2 GLN 95 1HE2 GLN 95 -12.412 -6.927 2.758
740 2HE2 GLN 95 2HE2 GLN 95 -13.785 -6.206 1.997
741 H GLN 96 H GLN 96 -10.870 -7.435 4.031
742 HA GLN 96 HA GLN 96 -10.062 -10.023 3.185
743 1HB GLN 96 2HB GLN 96 -9.677 -7.244 2.132
744 2HB GLN 96 1HB GLN 96 -8.900 -8.629 1.361
745 1HG GLN 96 2HG GLN 96 -11.847 -8.267 1.805
746 2HG GLN 96 1HG GLN 96 -10.997 -8.061 0.284
747 1HE2 GLN 96 1HE2 GLN 96 -13.175 -9.863 0.983
748 2HE2 GLN 96 2HE2 GLN 96 -12.603 -11.460 0.659
749 H GLY 97 H GLY 97 -8.576 -7.632 5.147
750 1HA GLY 97 2HA GLY 97 -6.625 -8.515 6.398
751 2HA GLY 97 1HA GLY 97 -5.997 -9.049 4.846
752 H ALA 98 H ALA 98 -7.549 -5.930 5.359
753 HA ALA 98 HA ALA 98 -5.409 -4.513 4.184
754 1HB ALA 98 1HB ALA 98 -7.416 -3.232 6.008
755 2HB ALA 98 2HB ALA 98 -7.874 -3.823 4.412
756 3HB ALA 98 3HB ALA 98 -6.646 -2.571 4.565
757 H PHE 99 H PHE 99 -3.802 -3.203 5.123
758 HA PHE 99 HA PHE 99 -2.910 -4.129 7.673
759 1HB PHE 99 2HB PHE 99 -1.425 -3.484 5.689
760 2HB PHE 99 1HB PHE 99 -1.710 -1.813 6.174
761 HD1 PHE 99 1HD PHE 99 -0.955 -4.992 7.973
762 HD2 PHE 99 2HD PHE 99 0.061 -0.915 7.316
763 HE1 PHE 99 1HE PHE 99 0.830 -5.173 9.654
764 HE2 PHE 99 2HE PHE 99 1.852 -1.091 8.991
765 HZ PHE 99 HZ PHE 99 2.238 -3.218 10.165
766 H ASP 100 H ASP 100 -3.841 -0.909 6.425
767 HA ASP 100 HA ASP 100 -5.407 -0.159 8.569
768 1HB ASP 100 2HB ASP 100 -2.787 -0.325 9.463
769 2HB ASP 100 1HB ASP 100 -2.993 1.392 9.137
770 H TYR 101 H TYR 101 -4.866 2.491 8.952
771 HA TYR 101 HA TYR 101 -4.607 3.720 6.312
772 1HB TYR 101 2HB TYR 101 -7.090 3.562 7.920
773 2HB TYR 101 1HB TYR 101 -6.707 5.150 7.263
774 HD1 TYR 101 1HD TYR 101 -7.316 1.613 6.333
775 HD2 TYR 101 2HD TYR 101 -7.067 5.645 5.002
776 HE1 TYR 101 1HE TYR 101 -8.269 0.951 4.161
777 HE2 TYR 101 2HE TYR 101 -8.012 5.004 2.826
778 HH TYR 101 HH TYR 101 -9.232 1.754 2.242
779 H LEU 102 H LEU 102 -4.066 5.956 6.399
780 HA LEU 102 HA LEU 102 -3.007 6.771 9.010
781 1HB LEU 102 2HB LEU 102 -2.050 6.947 6.279
782 2HB LEU 102 1HB LEU 102 -2.014 8.511 7.074
783 HG LEU 102 HG LEU 102 -0.616 7.623 8.849
784 1HD1 LEU 102 1HD1 LEU 102 -1.663 5.292 8.649
785 2HD1 LEU 102 2HD1 LEU 102 0.059 5.396 9.021
786 3HD1 LEU 102 3HD1 LEU 102 -0.467 5.017 7.383
787 1HD2 LEU 102 1HD2 LEU 102 0.753 6.541 6.467
788 2HD2 LEU 102 2HD2 LEU 102 1.306 7.711 7.665
789 3HD2 LEU 102 3HD2 LEU 102 0.202 8.215 6.382
790 HA PRO 103 HA PRO 103 -6.325 9.792 8.985
791 1HB PRO 103 2HB PRO 103 -5.640 10.999 11.344
792 2HB PRO 103 1HB PRO 103 -6.577 9.506 11.234
793 1HG PRO 103 2HG PRO 103 -3.697 9.897 11.876
794 2HG PRO 103 1HG PRO 103 -4.839 8.700 12.506
795 1HD PRO 103 2HD PRO 103 -2.944 8.165 10.598
796 2HD PRO 103 1HD PRO 103 -4.453 7.252 10.786
797 H LYS 104 H LYS 104 -3.555 11.288 10.624
798 HA LYS 104 HA LYS 104 -3.647 13.441 8.633
799 1HB LYS 104 2HB LYS 104 -3.824 13.619 11.351
800 2HB LYS 104 1HB LYS 104 -2.114 13.934 11.088
801 1HG LYS 104 2HG LYS 104 -2.711 15.701 9.482
802 2HG LYS 104 1HG LYS 104 -4.415 15.418 9.841
803 1HD LYS 104 2HD LYS 104 -3.066 15.753 12.310
804 2HD LYS 104 1HD LYS 104 -2.535 17.048 11.235
805 1HE LYS 104 2HE LYS 104 -5.416 16.328 11.746
806 2HE LYS 104 1HE LYS 104 -4.549 17.615 12.582
807 1HZ LYS 104 1HZ LYS 104 -4.490 17.667 9.670
808 2HZ LYS 104 2HZ LYS 104 -4.595 18.946 10.772
809 3HZ LYS 104 3HZ LYS 104 -5.971 18.034 10.401
810 HA PRO 105 HA PRO 105 1.133 12.781 9.286
811 1HB PRO 105 2HB PRO 105 1.800 10.344 10.404
812 2HB PRO 105 1HB PRO 105 1.751 11.877 11.280
813 1HG PRO 105 2HG PRO 105 -0.298 9.706 11.141
814 2HG PRO 105 1HG PRO 105 0.211 10.681 12.531
815 1HD PRO 105 2HD PRO 105 -2.071 11.190 11.231
816 2HD PRO 105 1HD PRO 105 -1.074 12.501 11.886
817 H PHE 106 H PHE 106 2.560 11.675 7.897
818 HA PHE 106 HA PHE 106 1.907 9.225 6.635
819 1HB PHE 106 2HB PHE 106 0.233 10.560 5.480
820 2HB PHE 106 1HB PHE 106 1.446 11.755 5.034
821 HD1 PHE 106 1HD PHE 106 1.713 11.718 2.756
822 HD2 PHE 106 2HD PHE 106 1.416 8.028 4.858
823 HE1 PHE 106 1HE PHE 106 2.163 10.496 0.668
824 HE2 PHE 106 2HE PHE 106 1.865 6.800 2.772
825 HZ PHE 106 HZ PHE 106 2.240 8.033 0.673
826 H ASP 107 H ASP 107 3.296 11.548 4.484
827 HA ASP 107 HA ASP 107 5.389 11.565 3.559
828 1HB ASP 107 2HB ASP 107 7.111 12.358 5.106
829 2HB ASP 107 1HB ASP 107 5.578 13.172 5.403
830 H ILE 108 H ILE 108 7.829 10.698 4.067
831 HA ILE 108 HA ILE 108 7.611 7.895 3.778
832 HB ILE 108 HB ILE 108 9.643 9.845 3.387
833 1HG1 ILE 108 2HG1 ILE 108 10.485 8.156 1.839
834 2HG1 ILE 108 1HG1 ILE 108 9.466 6.941 2.598
835 1HG2 ILE 108 1HG2 ILE 108 10.743 9.078 5.369
836 2HG2 ILE 108 2HG2 ILE 108 11.601 8.421 3.973
837 3HG2 ILE 108 3HG2 ILE 108 10.507 7.397 4.900
838 1HD1 ILE 108 1HD1 ILE 108 8.405 9.396 1.223
839 2HD1 ILE 108 2HD1 ILE 108 7.482 8.013 1.817
840 3HD1 ILE 108 3HD1 ILE 108 8.581 7.820 0.450
841 H ASP 109 H ASP 109 8.638 9.936 6.402
842 HA ASP 109 HA ASP 109 9.726 8.111 8.137
843 1HB ASP 109 2HB ASP 109 9.232 10.713 8.341
844 2HB ASP 109 1HB ASP 109 7.877 10.129 9.304
845 H GLU 110 H GLU 110 6.273 9.079 8.163
846 HA GLU 110 HA GLU 110 5.596 6.926 9.905
847 1HB GLU 110 2HB GLU 110 3.887 8.894 8.393
848 2HB GLU 110 1HB GLU 110 3.227 7.661 9.452
849 1HG GLU 110 2HG GLU 110 5.311 9.228 10.728
850 2HG GLU 110 1HG GLU 110 3.954 10.209 10.173
851 H ALA 111 H ALA 111 5.530 7.453 6.466
852 HA ALA 111 HA ALA 111 3.821 5.300 5.803
853 1HB ALA 111 1HB ALA 111 4.130 6.888 4.110
854 2HB ALA 111 2HB ALA 111 4.998 5.458 3.543
855 3HB ALA 111 3HB ALA 111 5.889 6.812 4.239
856 H VAL 112 H VAL 112 7.364 5.552 5.494
857 HA VAL 112 HA VAL 112 7.820 2.834 5.027
858 HB VAL 112 HB VAL 112 9.701 4.766 6.375
859 1HG1 VAL 112 1HG1 VAL 112 9.945 2.030 5.931
860 2HG1 VAL 112 2HG1 VAL 112 11.242 3.158 6.324
861 3HG1 VAL 112 3HG1 VAL 112 10.884 2.779 4.641
862 1HG2 VAL 112 1HG2 VAL 112 9.472 5.896 4.439
863 2HG2 VAL 112 2HG2 VAL 112 8.767 4.517 3.597
864 3HG2 VAL 112 3HG2 VAL 112 10.517 4.631 3.791
865 H ALA 113 H ALA 113 7.360 4.622 7.953
866 HA ALA 113 HA ALA 113 8.342 2.730 9.800
867 1HB ALA 113 1HB ALA 113 6.249 4.877 10.034
868 2HB ALA 113 2HB ALA 113 7.942 4.969 10.529
869 3HB ALA 113 3HB ALA 113 6.822 3.924 11.404
870 H LEU 114 H LEU 114 5.163 3.360 8.449
871 HA LEU 114 HA LEU 114 3.888 1.210 9.818
872 1HB LEU 114 2HB LEU 114 2.753 3.318 9.128
873 2HB LEU 114 1HB LEU 114 2.901 2.803 7.458
874 HG LEU 114 HG LEU 114 1.478 0.845 7.947
875 1HD1 LEU 114 1HD1 LEU 114 0.200 1.561 10.312
876 2HD1 LEU 114 2HD1 LEU 114 1.920 1.710 10.670
877 3HD1 LEU 114 3HD1 LEU 114 1.277 0.188 10.064
878 1HD2 LEU 114 1HD2 LEU 114 0.095 3.347 8.864
879 2HD2 LEU 114 2HD2 LEU 114 -0.561 2.010 7.919
880 3HD2 LEU 114 3HD2 LEU 114 0.610 3.114 7.193
881 H VAL 115 H VAL 115 5.648 1.488 6.864
882 HA VAL 115 HA VAL 115 4.396 -0.787 5.638
883 HB VAL 115 HB VAL 115 5.500 1.122 4.357
884 1HG1 VAL 115 1HG1 VAL 115 8.007 -0.497 4.694
885 2HG1 VAL 115 2HG1 VAL 115 7.653 0.903 5.698
886 3HG1 VAL 115 3HG1 VAL 115 7.813 1.094 3.957
887 1HG2 VAL 115 1HG2 VAL 115 4.774 -0.558 2.982
888 2HG2 VAL 115 2HG2 VAL 115 5.749 -1.789 3.788
889 3HG2 VAL 115 3HG2 VAL 115 6.510 -0.640 2.687
890 H GLU 116 H GLU 116 7.463 -0.183 7.276
891 HA GLU 116 HA GLU 116 8.598 -2.715 6.927
892 1HB GLU 116 2HB GLU 116 8.954 -0.676 9.124
893 2HB GLU 116 1HB GLU 116 9.943 -2.121 8.972
894 1HG GLU 116 2HG GLU 116 10.728 -1.376 6.795
895 2HG GLU 116 1HG GLU 116 9.706 0.056 6.904
896 H ARG 117 H ARG 117 6.543 -1.448 9.528
897 HA ARG 117 HA ARG 117 6.597 -3.740 11.145
898 1HB ARG 117 2HB ARG 117 4.509 -1.579 10.862
899 2HB ARG 117 1HB ARG 117 4.466 -2.821 12.107
900 1HG ARG 117 2HG ARG 117 6.898 -1.118 11.803
901 2HG ARG 117 1HG ARG 117 5.473 -0.483 12.630
902 1HD ARG 117 2HD ARG 117 6.878 -3.056 13.336
903 2HD ARG 117 1HD ARG 117 7.116 -1.518 14.167
904 HE ARG 117 HE ARG 117 4.458 -1.865 14.348
905 1HH1 ARG 117 1HH1 ARG 117 7.147 -3.974 15.062
906 2HH1 ARG 117 2HH1 ARG 117 6.305 -4.833 16.307
907 1HH2 ARG 117 1HH2 ARG 117 3.350 -2.991 15.990
908 2HH2 ARG 117 2HH2 ARG 117 4.150 -4.273 16.835
909 H ALA 118 H ALA 118 4.908 -3.057 8.226
910 HA ALA 118 HA ALA 118 2.845 -4.992 8.552
911 1HB ALA 118 1HB ALA 118 2.159 -4.448 6.388
912 2HB ALA 118 2HB ALA 118 3.778 -3.943 5.906
913 3HB ALA 118 3HB ALA 118 2.839 -2.948 7.017
914 H ILE 119 H ILE 119 5.971 -4.960 6.885
915 HA ILE 119 HA ILE 119 5.724 -7.504 5.701
916 HB ILE 119 HB ILE 119 8.263 -6.096 6.515
917 1HG1 ILE 119 2HG1 ILE 119 7.300 -5.989 3.720
918 2HG1 ILE 119 1HG1 ILE 119 6.389 -5.036 4.887
919 1HG2 ILE 119 1HG2 ILE 119 8.715 -8.378 5.956
920 2HG2 ILE 119 2HG2 ILE 119 9.228 -7.371 4.601
921 3HG2 ILE 119 3HG2 ILE 119 7.716 -8.274 4.506
922 1HD1 ILE 119 1HD1 ILE 119 8.167 -3.757 3.785
923 2HD1 ILE 119 2HD1 ILE 119 9.356 -4.866 4.471
924 3HD1 ILE 119 3HD1 ILE 119 8.378 -3.856 5.532
925 H SER 120 H SER 120 6.717 -6.429 8.836
926 HA SER 120 HA SER 120 7.955 -8.823 9.702
927 1HB SER 120 2HB SER 120 6.956 -6.341 11.018
928 2HB SER 120 1HB SER 120 7.267 -7.748 12.033
929 HG SER 120 HG SER 120 9.385 -7.761 10.839
930 H HIS 121 H HIS 121 4.703 -7.480 10.231
931 HA HIS 121 HA HIS 121 3.727 -9.625 11.759
932 1HB HIS 121 2HB HIS 121 2.450 -7.421 10.188
933 2HB HIS 121 1HB HIS 121 1.445 -8.728 10.809
934 HD1 HIS 121 1HD HIS 121 3.839 -6.071 12.061
935 HD2 HIS 121 2HD HIS 121 0.734 -8.471 13.427
936 HE1 HIS 121 1HE HIS 121 3.359 -5.282 14.401
937 HE2 HIS 121 2HE HIS 121 1.468 -6.741 15.205
938 H TYR 122 H TYR 122 4.211 -9.266 8.369
939 HA TYR 122 HA TYR 122 2.362 -11.203 7.465
940 1HB TYR 122 2HB TYR 122 3.614 -9.412 6.101
941 2HB TYR 122 1HB TYR 122 4.948 -10.559 6.068
942 HD1 TYR 122 1HD TYR 122 1.293 -11.238 5.810
943 HD2 TYR 122 2HD TYR 122 5.061 -11.222 3.832
944 HE1 TYR 122 1HE TYR 122 0.277 -12.367 3.875
945 HE2 TYR 122 2HE TYR 122 4.054 -12.348 1.893
946 HH TYR 122 HH TYR 122 1.163 -12.401 1.089
947 H GLN 123 H GLN 123 5.904 -11.406 7.797
948 HA GLN 123 HA GLN 123 7.308 -13.200 7.947
949 1HB GLN 123 2HB GLN 123 6.911 -14.619 9.846
950 2HB GLN 123 1HB GLN 123 6.387 -12.989 10.248
951 1HG GLN 123 2HG GLN 123 4.108 -13.572 10.058
952 2HG GLN 123 1HG GLN 123 4.493 -15.111 9.289
953 1HE2 GLN 123 1HE2 GLN 123 4.639 -13.305 12.292
954 2HE2 GLN 123 2HE2 GLN 123 4.714 -14.681 13.336
955 H GLU 124 H GLU 124 7.047 -15.871 8.316
956 HA GLU 124 HA GLU 124 6.686 -17.822 7.208
957 1HB GLU 124 2HB GLU 124 4.123 -16.506 7.353
958 2HB GLU 124 1HB GLU 124 4.239 -17.448 5.872
959 1HG GLU 124 2HG GLU 124 4.885 -19.414 7.216
960 2HG GLU 124 1HG GLU 124 4.650 -18.454 8.676
Start of MODEL 9
1 1H MET 1 1HT MET 1 17.671 -16.079 3.570
2 2H MET 1 2HT MET 1 16.947 -17.080 4.761
3 3H MET 1 3HT MET 1 16.255 -15.557 4.380
4 HA MET 1 HA MET 1 16.463 -16.932 2.014
5 1HB MET 1 2HB MET 1 15.193 -18.973 2.511
6 2HB MET 1 1HB MET 1 16.741 -18.968 3.345
7 1HG MET 1 2HG MET 1 15.273 -17.924 5.284
8 2HG MET 1 1HG MET 1 13.990 -18.782 4.433
9 1HE MET 1 1HE MET 1 14.159 -21.066 3.650
10 2HE MET 1 2HE MET 1 13.566 -21.568 5.233
11 3HE MET 1 3HE MET 1 14.942 -22.397 4.503
12 H GLN 2 H GLN 2 15.443 -14.538 2.851
13 HA GLN 2 HA GLN 2 12.540 -14.942 2.555
14 1HB GLN 2 2HB GLN 2 14.057 -13.246 4.431
15 2HB GLN 2 1HB GLN 2 12.704 -12.452 3.639
16 1HG GLN 2 2HG GLN 2 11.163 -13.666 4.741
17 2HG GLN 2 1HG GLN 2 12.157 -15.122 4.750
18 1HE2 GLN 2 1HE2 GLN 2 10.611 -13.645 6.859
19 2HE2 GLN 2 2HE2 GLN 2 11.739 -13.425 8.148
20 H ARG 3 H ARG 3 11.495 -13.722 1.049
21 HA ARG 3 HA ARG 3 13.083 -12.587 -1.023
22 1HB ARG 3 2HB ARG 3 10.708 -13.817 -1.029
23 2HB ARG 3 1HB ARG 3 10.163 -12.147 -1.015
24 1HG ARG 3 2HG ARG 3 10.274 -12.479 -3.254
25 2HG ARG 3 1HG ARG 3 11.926 -11.930 -2.968
26 1HD ARG 3 2HD ARG 3 11.538 -14.811 -2.612
27 2HD ARG 3 1HD ARG 3 11.230 -14.243 -4.252
28 HE ARG 3 HE ARG 3 13.774 -14.310 -2.873
29 1HH1 ARG 3 1HH1 ARG 3 11.961 -13.038 -5.574
30 2HH1 ARG 3 2HH1 ARG 3 13.372 -12.678 -6.510
31 1HH2 ARG 3 1HH2 ARG 3 15.627 -13.829 -4.099
32 2HH2 ARG 3 2HH2 ARG 3 15.453 -13.126 -5.673
33 H GLY 4 H GLY 4 10.429 -11.230 0.853
34 1HA GLY 4 2HA GLY 4 10.116 -9.121 1.721
35 2HA GLY 4 1HA GLY 4 11.824 -8.818 1.445
36 H ILE 5 H ILE 5 8.683 -8.952 -0.183
37 HA ILE 5 HA ILE 5 9.711 -7.027 -2.166
38 HB ILE 5 HB ILE 5 7.184 -8.626 -2.485
39 1HG1 ILE 5 2HG1 ILE 5 8.955 -9.839 -4.164
40 2HG1 ILE 5 1HG1 ILE 5 9.985 -9.497 -2.775
41 1HG2 ILE 5 1HG2 ILE 5 8.560 -8.004 -4.909
42 2HG2 ILE 5 2HG2 ILE 5 8.398 -6.540 -3.940
43 3HG2 ILE 5 3HG2 ILE 5 6.968 -7.477 -4.366
44 1HD1 ILE 5 1HD1 ILE 5 8.870 -10.940 -1.427
45 2HD1 ILE 5 2HD1 ILE 5 8.599 -11.730 -2.978
46 3HD1 ILE 5 3HD1 ILE 5 7.337 -10.726 -2.267
47 H VAL 6 H VAL 6 9.139 -5.000 -1.749
48 HA VAL 6 HA VAL 6 6.546 -4.502 -0.446
49 HB VAL 6 HB VAL 6 8.470 -3.630 0.805
50 1HG1 VAL 6 1HG1 VAL 6 10.147 -2.431 -0.082
51 2HG1 VAL 6 2HG1 VAL 6 9.078 -1.510 -1.135
52 3HG1 VAL 6 3HG1 VAL 6 9.600 -3.125 -1.600
53 1HG2 VAL 6 1HG2 VAL 6 7.044 -2.068 1.475
54 2HG2 VAL 6 2HG2 VAL 6 6.207 -2.123 -0.076
55 3HG2 VAL 6 3HG2 VAL 6 7.576 -1.033 0.151
56 H TRP 7 H TRP 7 4.979 -3.717 -1.694
57 HA TRP 7 HA TRP 7 5.757 -2.333 -4.174
58 1HB TRP 7 2HB TRP 7 3.466 -4.151 -3.523
59 2HB TRP 7 1HB TRP 7 3.321 -2.987 -4.838
60 HD1 TRP 7 HD1 TRP 7 6.791 -4.313 -4.482
61 HE1 TRP 7 1HE TRP 7 7.295 -6.007 -6.348
62 HE3 TRP 7 3HE TRP 7 2.049 -4.973 -6.279
63 HZ2 TRP 7 2HZ TRP 7 5.863 -7.448 -8.308
64 HZ3 TRP 7 3HZ TRP 7 1.701 -6.530 -8.153
65 HH2 TRP 7 HH2 TRP 7 3.574 -7.740 -9.145
66 H VAL 8 H VAL 8 5.083 -0.319 -4.539
67 HA VAL 8 HA VAL 8 3.187 0.861 -2.612
68 HB VAL 8 HB VAL 8 5.015 2.801 -3.772
69 1HG1 VAL 8 1HG1 VAL 8 5.203 3.528 -1.483
70 2HG1 VAL 8 2HG1 VAL 8 4.452 2.047 -0.917
71 3HG1 VAL 8 3HG1 VAL 8 3.525 3.196 -1.872
72 1HG2 VAL 8 1HG2 VAL 8 6.856 1.943 -2.060
73 2HG2 VAL 8 2HG2 VAL 8 6.846 1.450 -3.750
74 3HG2 VAL 8 3HG2 VAL 8 6.188 0.380 -2.518
75 H VAL 9 H VAL 9 1.819 2.499 -3.351
76 HA VAL 9 HA VAL 9 1.799 2.938 -6.258
77 HB VAL 9 HB VAL 9 -0.872 3.105 -5.093
78 1HG1 VAL 9 1HG1 VAL 9 -1.045 3.036 -7.321
79 2HG1 VAL 9 2HG1 VAL 9 -0.963 1.290 -7.132
80 3HG1 VAL 9 3HG1 VAL 9 0.481 2.214 -7.515
81 1HG2 VAL 9 1HG2 VAL 9 -1.085 0.522 -5.175
82 2HG2 VAL 9 2HG2 VAL 9 -0.481 1.284 -3.712
83 3HG2 VAL 9 3HG2 VAL 9 0.643 0.535 -4.839
84 H ASP 10 H ASP 10 2.461 5.003 -6.410
85 HA ASP 10 HA ASP 10 0.812 7.104 -5.392
86 1HB ASP 10 2HB ASP 10 2.248 6.416 -3.401
87 2HB ASP 10 1HB ASP 10 3.615 7.050 -4.304
88 H ASP 11 H ASP 11 1.043 7.065 -7.841
89 HA ASP 11 HA ASP 11 1.680 8.120 -9.747
90 1HB ASP 11 2HB ASP 11 1.491 10.097 -8.202
91 2HB ASP 11 1HB ASP 11 3.232 9.993 -7.959
92 H ASP 12 H ASP 12 3.730 6.303 -8.051
93 HA ASP 12 HA ASP 12 5.864 5.538 -8.286
94 1HB ASP 12 2HB ASP 12 6.360 4.777 -10.522
95 2HB ASP 12 1HB ASP 12 4.629 4.620 -10.251
96 H SER 13 H SER 13 7.575 6.212 -10.675
97 HA SER 13 HA SER 13 9.492 7.438 -10.822
98 1HB SER 13 2HB SER 13 7.560 8.389 -12.234
99 2HB SER 13 1HB SER 13 7.634 9.758 -11.130
100 HG SER 13 HG SER 13 10.033 9.610 -11.687
101 H SER 14 H SER 14 7.858 10.261 -9.579
102 HA SER 14 HA SER 14 9.937 11.051 -7.925
103 1HB SER 14 2HB SER 14 8.080 12.532 -8.657
104 2HB SER 14 1HB SER 14 6.998 11.691 -7.545
105 HG SER 14 HG SER 14 8.751 13.674 -7.042
106 H ILE 15 H ILE 15 6.808 9.791 -6.738
107 HA ILE 15 HA ILE 15 7.723 9.355 -4.130
108 HB ILE 15 HB ILE 15 5.479 7.801 -5.430
109 1HG1 ILE 15 2HG1 ILE 15 5.264 10.269 -5.809
110 2HG1 ILE 15 1HG1 ILE 15 3.987 9.600 -4.805
111 1HG2 ILE 15 1HG2 ILE 15 6.611 7.743 -2.860
112 2HG2 ILE 15 2HG2 ILE 15 5.106 6.997 -3.385
113 3HG2 ILE 15 3HG2 ILE 15 5.090 8.617 -2.695
114 1HD1 ILE 15 1HD1 ILE 15 5.500 10.360 -2.839
115 2HD1 ILE 15 2HD1 ILE 15 4.504 11.536 -3.698
116 3HD1 ILE 15 3HD1 ILE 15 6.227 11.408 -4.056
117 H ARG 16 H ARG 16 8.221 7.538 -6.996
118 HA ARG 16 HA ARG 16 8.656 4.993 -5.808
119 1HB ARG 16 2HB ARG 16 8.179 5.276 -8.215
120 2HB ARG 16 1HB ARG 16 9.721 6.087 -8.419
121 1HG ARG 16 2HG ARG 16 10.648 3.841 -7.382
122 2HG ARG 16 1HG ARG 16 9.134 3.205 -8.018
123 1HD ARG 16 2HD ARG 16 11.183 4.735 -9.615
124 2HD ARG 16 1HD ARG 16 10.999 2.982 -9.611
125 HE ARG 16 HE ARG 16 9.451 4.853 -11.086
126 1HH1 ARG 16 1HH1 ARG 16 9.254 1.790 -9.422
127 2HH1 ARG 16 2HH1 ARG 16 7.897 1.235 -10.343
128 1HH2 ARG 16 1HH2 ARG 16 7.667 4.120 -12.302
129 2HH2 ARG 16 2HH2 ARG 16 6.998 2.556 -11.977
130 H TRP 17 H TRP 17 10.968 7.379 -7.103
131 HA TRP 17 HA TRP 17 13.302 6.171 -6.303
132 1HB TRP 17 2HB TRP 17 13.189 8.176 -7.742
133 2HB TRP 17 1HB TRP 17 12.787 9.146 -6.325
134 HD1 TRP 17 HD1 TRP 17 15.681 6.894 -7.584
135 HE1 TRP 17 1HE TRP 17 17.879 7.795 -6.597
136 HE3 TRP 17 3HE TRP 17 13.784 10.647 -4.672
137 HZ2 TRP 17 2HZ TRP 17 18.707 9.821 -4.820
138 HZ3 TRP 17 3HZ TRP 17 15.355 12.019 -3.353
139 HH2 TRP 17 HH2 TRP 17 17.763 11.611 -3.429
140 H VAL 18 H VAL 18 11.193 8.255 -4.383
141 HA VAL 18 HA VAL 18 12.908 8.555 -2.191
142 HB VAL 18 HB VAL 18 9.911 8.516 -1.973
143 1HG1 VAL 18 1HG1 VAL 18 10.318 9.105 0.124
144 2HG1 VAL 18 2HG1 VAL 18 11.101 10.570 -0.457
145 3HG1 VAL 18 3HG1 VAL 18 12.053 9.114 -0.174
146 1HG2 VAL 18 1HG2 VAL 18 9.822 10.792 -2.632
147 2HG2 VAL 18 2HG2 VAL 18 10.721 9.938 -3.884
148 3HG2 VAL 18 3HG2 VAL 18 11.580 10.915 -2.695
149 H LEU 19 H LEU 19 10.242 6.283 -2.620
150 HA LEU 19 HA LEU 19 10.906 4.942 -0.179
151 1HB LEU 19 2HB LEU 19 8.572 5.302 -1.440
152 2HB LEU 19 1HB LEU 19 8.973 3.696 -2.018
153 HG LEU 19 HG LEU 19 9.176 2.916 0.311
154 1HD1 LEU 19 1HD1 LEU 19 8.329 5.737 0.945
155 2HD1 LEU 19 2HD1 LEU 19 9.813 4.923 1.438
156 3HD1 LEU 19 3HD1 LEU 19 8.263 4.401 2.090
157 1HD2 LEU 19 1HD2 LEU 19 7.070 2.325 -0.064
158 2HD2 LEU 19 2HD2 LEU 19 6.780 3.775 -1.023
159 3HD2 LEU 19 3HD2 LEU 19 6.570 3.822 0.725
160 H GLU 20 H GLU 20 11.600 4.427 -3.528
161 HA GLU 20 HA GLU 20 12.059 1.651 -3.357
162 1HB GLU 20 2HB GLU 20 13.113 1.780 -5.482
163 2HB GLU 20 1HB GLU 20 11.752 2.882 -5.498
164 1HG GLU 20 2HG GLU 20 13.326 4.745 -5.110
165 2HG GLU 20 1HG GLU 20 14.656 3.597 -5.228
166 H ARG 21 H ARG 21 14.427 4.278 -3.494
167 HA ARG 21 HA ARG 21 16.675 2.724 -2.956
168 1HB ARG 21 2HB ARG 21 16.145 5.643 -2.410
169 2HB ARG 21 1HB ARG 21 17.728 4.888 -2.262
170 1HG ARG 21 2HG ARG 21 16.463 4.346 -4.822
171 2HG ARG 21 1HG ARG 21 16.689 6.071 -4.521
172 1HD ARG 21 2HD ARG 21 18.926 4.168 -3.992
173 2HD ARG 21 1HD ARG 21 18.583 4.663 -5.648
174 HE ARG 21 HE ARG 21 18.848 7.006 -4.782
175 1HH1 ARG 21 1HH1 ARG 21 20.479 4.313 -3.254
176 2HH1 ARG 21 2HH1 ARG 21 21.750 5.295 -2.612
177 1HH2 ARG 21 1HH2 ARG 21 20.523 8.284 -3.939
178 2HH2 ARG 21 2HH2 ARG 21 21.776 7.545 -2.999
179 H ALA 22 H ALA 22 14.776 4.700 -0.671
180 HA ALA 22 HA ALA 22 16.221 4.083 1.611
181 1HB ALA 22 1HB ALA 22 14.795 5.604 2.381
182 2HB ALA 22 2HB ALA 22 13.561 4.345 2.444
183 3HB ALA 22 3HB ALA 22 13.723 5.347 1.003
184 H LEU 23 H LEU 23 13.395 2.432 0.315
185 HA LEU 23 HA LEU 23 13.422 0.455 2.369
186 1HB LEU 23 2HB LEU 23 11.464 1.227 0.814
187 2HB LEU 23 1HB LEU 23 12.099 0.014 -0.277
188 HG LEU 23 HG LEU 23 11.395 -1.734 1.020
189 1HD1 LEU 23 1HD1 LEU 23 12.528 -1.475 3.033
190 2HD1 LEU 23 2HD1 LEU 23 10.835 -1.392 3.511
191 3HD1 LEU 23 3HD1 LEU 23 11.783 0.084 3.366
192 1HD2 LEU 23 1HD2 LEU 23 9.483 0.374 1.983
193 2HD2 LEU 23 2HD2 LEU 23 9.161 -1.343 1.746
194 3HD2 LEU 23 3HD2 LEU 23 9.464 -0.302 0.355
195 H ALA 24 H ALA 24 15.023 0.868 -0.648
196 HA ALA 24 HA ALA 24 15.697 -1.857 -1.088
197 1HB ALA 24 1HB ALA 24 17.346 0.475 -2.030
198 2HB ALA 24 2HB ALA 24 15.814 0.048 -2.792
199 3HB ALA 24 3HB ALA 24 17.145 -1.106 -2.783
200 H GLY 25 H GLY 25 17.047 0.811 0.753
201 1HA GLY 25 2HA GLY 25 19.559 -0.340 1.348
202 2HA GLY 25 1HA GLY 25 18.729 0.875 2.318
203 H ALA 26 H ALA 26 16.352 -0.881 2.596
204 HA ALA 26 HA ALA 26 17.196 -2.251 4.956
205 1HB ALA 26 1HB ALA 26 14.700 -3.028 4.837
206 2HB ALA 26 2HB ALA 26 14.585 -1.769 3.609
207 3HB ALA 26 3HB ALA 26 15.099 -1.359 5.243
208 H GLY 27 H GLY 27 16.943 -3.088 1.659
209 1HA GLY 27 2HA GLY 27 17.870 -5.117 0.846
210 2HA GLY 27 1HA GLY 27 17.469 -5.881 2.369
211 H LEU 28 H LEU 28 15.051 -3.981 0.644
212 HA LEU 28 HA LEU 28 13.789 -6.501 -0.149
213 1HB LEU 28 2HB LEU 28 12.006 -4.222 0.414
214 2HB LEU 28 1HB LEU 28 11.767 -5.931 0.705
215 HG LEU 28 HG LEU 28 13.629 -5.454 2.561
216 1HD1 LEU 28 1HD1 LEU 28 12.689 -3.199 3.547
217 2HD1 LEU 28 2HD1 LEU 28 12.524 -2.852 1.826
218 3HD1 LEU 28 3HD1 LEU 28 14.097 -3.278 2.491
219 1HD2 LEU 28 1HD2 LEU 28 11.098 -4.566 3.597
220 2HD2 LEU 28 2HD2 LEU 28 11.964 -6.074 3.894
221 3HD2 LEU 28 3HD2 LEU 28 10.888 -5.934 2.502
222 H THR 29 H THR 29 12.003 -6.149 -1.809
223 HA THR 29 HA THR 29 13.090 -4.448 -3.933
224 HB THR 29 HB THR 29 11.098 -6.725 -3.985
225 HG1 THR 29 1HG THR 29 13.026 -7.323 -5.525
226 1HG2 THR 29 1HG2 THR 29 11.805 -6.363 -6.583
227 2HG2 THR 29 2HG2 THR 29 11.669 -4.698 -6.019
228 3HG2 THR 29 3HG2 THR 29 10.300 -5.798 -5.858
229 H CYS 30 H CYS 30 12.305 -2.445 -3.829
230 HA CYS 30 HA CYS 30 9.474 -2.055 -3.197
231 1HB CYS 30 2HB CYS 30 11.162 -0.857 -1.833
232 2HB CYS 30 1HB CYS 30 11.689 -0.016 -3.284
233 HG CYS 30 HG CYS 30 9.507 0.907 -1.552
234 H THR 31 H THR 31 8.197 -1.989 -4.918
235 HA THR 31 HA THR 31 9.110 -0.468 -7.275
236 HB THR 31 HB THR 31 8.671 -3.035 -7.515
237 HG1 THR 31 1HG THR 31 7.511 -1.048 -9.167
238 1HG2 THR 31 1HG2 THR 31 6.619 -3.876 -7.401
239 2HG2 THR 31 2HG2 THR 31 5.893 -2.466 -8.155
240 3HG2 THR 31 3HG2 THR 31 6.235 -2.459 -6.426
241 H THR 32 H THR 32 7.423 0.833 -8.333
242 HA THR 32 HA THR 32 5.155 1.346 -6.544
243 HB THR 32 HB THR 32 5.335 3.711 -6.877
244 HG1 THR 32 1HG THR 32 7.369 3.006 -8.698
245 1HG2 THR 32 1HG2 THR 32 8.178 3.327 -6.450
246 2HG2 THR 32 2HG2 THR 32 7.180 2.270 -5.459
247 3HG2 THR 32 3HG2 THR 32 6.955 4.018 -5.388
248 H PHE 33 H PHE 33 3.388 2.576 -7.568
249 HA PHE 33 HA PHE 33 3.071 1.984 -10.412
250 1HB PHE 33 2HB PHE 33 1.095 1.250 -8.260
251 2HB PHE 33 1HB PHE 33 0.825 1.077 -9.976
252 HD1 PHE 33 1HD PHE 33 1.357 -0.975 -10.993
253 HD2 PHE 33 2HD PHE 33 3.165 0.079 -7.293
254 HE1 PHE 33 1HE PHE 33 2.386 -3.203 -10.861
255 HE2 PHE 33 2HE PHE 33 4.200 -2.139 -7.155
256 HZ PHE 33 HZ PHE 33 3.804 -3.792 -8.942
257 H GLU 34 H GLU 34 0.845 2.991 -11.164
258 HA GLU 34 HA GLU 34 1.154 5.745 -10.998
259 1HB GLU 34 2HB GLU 34 -1.037 5.860 -12.168
260 2HB GLU 34 1HB GLU 34 0.111 4.746 -12.900
261 1HG GLU 34 2HG GLU 34 -1.652 3.366 -12.934
262 2HG GLU 34 1HG GLU 34 -1.182 3.066 -11.266
263 H ASN 35 H ASN 35 -1.422 3.789 -9.391
264 HA ASN 35 HA ASN 35 -1.526 5.668 -7.252
265 1HB ASN 35 2HB ASN 35 -3.368 5.990 -9.500
266 2HB ASN 35 1HB ASN 35 -4.159 5.939 -7.928
267 1HD2 ASN 35 1HD2 ASN 35 -3.875 8.150 -9.795
268 2HD2 ASN 35 2HD2 ASN 35 -3.077 9.412 -8.925
269 H GLY 36 H GLY 36 -2.871 2.902 -8.852
270 1HA GLY 36 2HA GLY 36 -3.062 1.370 -6.539
271 2HA GLY 36 1HA GLY 36 -4.641 2.093 -6.799
272 H ASN 37 H ASN 37 -5.165 1.973 -9.349
273 HA ASN 37 HA ASN 37 -5.836 -0.664 -9.850
274 1HB ASN 37 2HB ASN 37 -6.502 1.701 -10.979
275 2HB ASN 37 1HB ASN 37 -5.470 1.030 -12.238
276 1HD2 ASN 37 1HD2 ASN 37 -7.926 -0.236 -10.000
277 2HD2 ASN 37 2HD2 ASN 37 -8.835 -1.074 -11.206
278 H GLU 38 H GLU 38 -2.915 1.078 -10.658
279 HA GLU 38 HA GLU 38 -1.934 -0.655 -12.628
280 1HB GLU 38 2HB GLU 38 -0.916 1.533 -11.074
281 2HB GLU 38 1HB GLU 38 0.279 0.260 -11.161
282 1HG GLU 38 2HG GLU 38 -1.019 0.922 -13.705
283 2HG GLU 38 1HG GLU 38 -0.008 2.189 -13.011
284 H VAL 39 H VAL 39 -1.188 -0.656 -9.081
285 HA VAL 39 HA VAL 39 0.382 -2.948 -9.062
286 HB VAL 39 HB VAL 39 -1.668 -2.514 -6.902
287 1HG1 VAL 39 1HG1 VAL 39 1.123 -3.230 -6.307
288 2HG1 VAL 39 2HG1 VAL 39 0.192 -4.437 -7.194
289 3HG1 VAL 39 3HG1 VAL 39 -0.379 -3.852 -5.634
290 1HG2 VAL 39 1HG2 VAL 39 -0.649 -0.341 -7.326
291 2HG2 VAL 39 2HG2 VAL 39 0.949 -1.052 -7.170
292 3HG2 VAL 39 3HG2 VAL 39 -0.128 -1.004 -5.784
293 H LEU 40 H LEU 40 -3.125 -2.672 -8.883
294 HA LEU 40 HA LEU 40 -3.835 -5.306 -8.490
295 1HB LEU 40 2HB LEU 40 -5.293 -3.424 -10.334
296 2HB LEU 40 1HB LEU 40 -5.966 -4.747 -9.413
297 HG LEU 40 HG LEU 40 -4.905 -2.157 -8.303
298 1HD1 LEU 40 1HD1 LEU 40 -7.312 -2.054 -7.466
299 2HD1 LEU 40 2HD1 LEU 40 -7.645 -3.306 -8.661
300 3HD1 LEU 40 3HD1 LEU 40 -7.031 -1.742 -9.176
301 1HD2 LEU 40 1HD2 LEU 40 -6.156 -3.364 -6.234
302 2HD2 LEU 40 2HD2 LEU 40 -4.416 -3.430 -6.511
303 3HD2 LEU 40 3HD2 LEU 40 -5.447 -4.757 -7.047
304 H ALA 41 H ALA 41 -3.078 -3.674 -11.542
305 HA ALA 41 HA ALA 41 -3.688 -5.827 -13.243
306 1HB ALA 41 1HB ALA 41 -2.508 -4.631 -14.949
307 2HB ALA 41 2HB ALA 41 -1.656 -3.667 -13.742
308 3HB ALA 41 3HB ALA 41 -3.394 -3.467 -13.964
309 H ALA 42 H ALA 42 -0.607 -4.752 -11.922
310 HA ALA 42 HA ALA 42 0.901 -6.891 -13.016
311 1HB ALA 42 1HB ALA 42 2.735 -5.938 -12.008
312 2HB ALA 42 2HB ALA 42 1.821 -5.404 -10.597
313 3HB ALA 42 3HB ALA 42 1.659 -4.547 -12.129
314 H LEU 43 H LEU 43 -0.892 -6.398 -10.089
315 HA LEU 43 HA LEU 43 0.227 -8.438 -8.527
316 1HB LEU 43 2HB LEU 43 -2.226 -6.799 -8.474
317 2HB LEU 43 1HB LEU 43 -2.287 -8.305 -7.576
318 HG LEU 43 HG LEU 43 -0.024 -6.382 -7.185
319 1HD1 LEU 43 1HD1 LEU 43 -2.108 -5.131 -6.847
320 2HD1 LEU 43 2HD1 LEU 43 -1.234 -5.389 -5.334
321 3HD1 LEU 43 3HD1 LEU 43 -2.634 -6.369 -5.720
322 1HD2 LEU 43 1HD2 LEU 43 -0.915 -7.777 -4.866
323 2HD2 LEU 43 2HD2 LEU 43 0.621 -7.907 -5.716
324 3HD2 LEU 43 3HD2 LEU 43 -0.730 -8.928 -6.188
325 H ALA 44 H ALA 44 -2.034 -8.531 -11.129
326 HA ALA 44 HA ALA 44 -3.348 -10.934 -10.583
327 1HB ALA 44 1HB ALA 44 -3.416 -11.041 -13.200
328 2HB ALA 44 2HB ALA 44 -2.757 -9.414 -13.076
329 3HB ALA 44 3HB ALA 44 -4.306 -9.794 -12.330
330 H SER 45 H SER 45 -0.082 -10.364 -11.420
331 HA SER 45 HA SER 45 0.302 -13.220 -11.880
332 1HB SER 45 2HB SER 45 0.700 -12.051 -13.960
333 2HB SER 45 1HB SER 45 1.793 -10.926 -13.153
334 HG SER 45 HG SER 45 2.170 -13.705 -13.566
335 H LYS 46 H LYS 46 0.769 -10.929 -9.620
336 HA LYS 46 HA LYS 46 2.813 -12.436 -8.315
337 1HB LYS 46 2HB LYS 46 3.804 -10.545 -10.005
338 2HB LYS 46 1HB LYS 46 3.681 -9.630 -8.507
339 1HG LYS 46 2HG LYS 46 4.841 -12.020 -7.733
340 2HG LYS 46 1HG LYS 46 5.587 -11.662 -9.290
341 1HD LYS 46 2HD LYS 46 6.315 -9.513 -8.525
342 2HD LYS 46 1HD LYS 46 5.384 -9.673 -7.035
343 1HE LYS 46 2HE LYS 46 7.453 -10.245 -6.260
344 2HE LYS 46 1HE LYS 46 6.867 -11.834 -6.748
345 1HZ LYS 46 1HZ LYS 46 8.452 -11.996 -8.277
346 2HZ LYS 46 2HZ LYS 46 9.181 -10.642 -7.572
347 3HZ LYS 46 3HZ LYS 46 8.146 -10.451 -8.897
348 H THR 47 H THR 47 3.258 -11.672 -6.135
349 HA THR 47 HA THR 47 1.337 -9.757 -5.085
350 HB THR 47 HB THR 47 1.744 -12.546 -4.007
351 HG1 THR 47 1HG THR 47 -0.144 -12.983 -4.851
352 1HG2 THR 47 1HG2 THR 47 1.454 -10.936 -2.175
353 2HG2 THR 47 2HG2 THR 47 0.091 -12.046 -2.327
354 3HG2 THR 47 3HG2 THR 47 -0.050 -10.389 -2.917
355 HA PRO 48 HA PRO 48 5.204 -8.643 -3.028
356 1HB PRO 48 2HB PRO 48 4.359 -6.299 -2.005
357 2HB PRO 48 1HB PRO 48 4.743 -6.476 -3.722
358 1HG PRO 48 2HG PRO 48 2.070 -6.538 -2.367
359 2HG PRO 48 1HG PRO 48 2.550 -5.689 -3.847
360 1HD PRO 48 2HD PRO 48 1.238 -8.054 -3.887
361 2HD PRO 48 1HD PRO 48 2.402 -7.582 -5.138
362 H ASP 49 H ASP 49 5.801 -8.173 -0.754
363 HA ASP 49 HA ASP 49 4.241 -9.786 1.033
364 1HB ASP 49 2HB ASP 49 6.886 -8.451 1.103
365 2HB ASP 49 1HB ASP 49 6.091 -8.667 2.661
366 H VAL 50 H VAL 50 4.654 -6.372 0.423
367 HA VAL 50 HA VAL 50 2.493 -5.798 2.299
368 HB VAL 50 HB VAL 50 4.527 -5.510 3.620
369 1HG1 VAL 50 1HG1 VAL 50 5.692 -4.721 1.294
370 2HG1 VAL 50 2HG1 VAL 50 6.387 -4.490 2.898
371 3HG1 VAL 50 3HG1 VAL 50 5.495 -3.179 2.129
372 1HG2 VAL 50 1HG2 VAL 50 2.768 -3.243 2.937
373 2HG2 VAL 50 2HG2 VAL 50 4.219 -2.857 3.856
374 3HG2 VAL 50 3HG2 VAL 50 3.062 -4.024 4.487
375 H LEU 51 H LEU 51 1.041 -4.864 0.940
376 HA LEU 51 HA LEU 51 1.955 -3.115 -1.195
377 1HB LEU 51 2HB LEU 51 0.104 -4.808 -1.480
378 2HB LEU 51 1HB LEU 51 -0.895 -3.789 -0.466
379 HG LEU 51 HG LEU 51 -0.849 -2.010 -2.088
380 1HD1 LEU 51 1HD1 LEU 51 0.303 -2.662 -4.355
381 2HD1 LEU 51 2HD1 LEU 51 1.316 -3.646 -3.304
382 3HD1 LEU 51 3HD1 LEU 51 1.215 -1.902 -3.056
383 1HD2 LEU 51 1HD2 LEU 51 -2.611 -3.330 -2.720
384 2HD2 LEU 51 2HD2 LEU 51 -1.604 -4.742 -3.020
385 3HD2 LEU 51 3HD2 LEU 51 -1.640 -3.424 -4.184
386 H LEU 52 H LEU 52 1.738 -0.955 -1.295
387 HA LEU 52 HA LEU 52 0.507 0.426 1.009
388 1HB LEU 52 2HB LEU 52 3.132 0.375 0.677
389 2HB LEU 52 1HB LEU 52 2.785 1.622 -0.500
390 HG LEU 52 HG LEU 52 2.119 1.742 2.439
391 1HD1 LEU 52 1HD1 LEU 52 4.048 2.814 2.778
392 2HD1 LEU 52 2HD1 LEU 52 3.871 3.775 1.311
393 3HD1 LEU 52 3HD1 LEU 52 4.550 2.150 1.223
394 1HD2 LEU 52 1HD2 LEU 52 1.816 4.251 1.573
395 2HD2 LEU 52 2HD2 LEU 52 0.493 3.094 1.645
396 3HD2 LEU 52 3HD2 LEU 52 1.321 3.385 0.120
397 H SER 53 H SER 53 -1.112 1.774 0.420
398 HA SER 53 HA SER 53 -1.231 2.639 -2.393
399 1HB SER 53 2HB SER 53 -3.456 2.263 -0.393
400 2HB SER 53 1HB SER 53 -3.675 2.861 -2.031
401 HG SER 53 HG SER 53 -3.117 0.897 -2.831
402 H ASP 54 H ASP 54 -1.402 4.738 -2.924
403 HA ASP 54 HA ASP 54 -0.902 6.685 -0.854
404 1HB ASP 54 2HB ASP 54 0.312 6.791 -2.985
405 2HB ASP 54 1HB ASP 54 -1.205 7.071 -3.834
406 H ILE 55 H ILE 55 -3.698 5.458 -2.345
407 HA ILE 55 HA ILE 55 -5.853 6.219 -2.560
408 HB ILE 55 HB ILE 55 -5.817 5.690 -0.218
409 1HG1 ILE 55 2HG1 ILE 55 -7.127 8.378 -0.193
410 2HG1 ILE 55 1HG1 ILE 55 -7.728 7.132 -1.269
411 1HG2 ILE 55 1HG2 ILE 55 -5.319 7.412 1.487
412 2HG2 ILE 55 2HG2 ILE 55 -4.710 8.456 0.203
413 3HG2 ILE 55 3HG2 ILE 55 -3.916 6.918 0.543
414 1HD1 ILE 55 1HD1 ILE 55 -8.087 7.444 1.569
415 2HD1 ILE 55 2HD1 ILE 55 -7.490 5.841 1.149
416 3HD1 ILE 55 3HD1 ILE 55 -8.973 6.446 0.421
417 H ARG 56 H ARG 56 -5.002 7.742 -4.302
418 HA ARG 56 HA ARG 56 -5.344 10.542 -3.465
419 1HB ARG 56 2HB ARG 56 -3.150 9.698 -4.576
420 2HB ARG 56 1HB ARG 56 -4.083 9.750 -6.067
421 1HG ARG 56 2HG ARG 56 -4.348 12.062 -5.965
422 2HG ARG 56 1HG ARG 56 -3.940 12.125 -4.250
423 1HD ARG 56 2HD ARG 56 -1.663 11.086 -5.232
424 2HD ARG 56 1HD ARG 56 -2.189 12.040 -6.618
425 HE ARG 56 HE ARG 56 -2.075 13.317 -3.987
426 1HH1 ARG 56 1HH1 ARG 56 -0.770 12.984 -7.214
427 2HH1 ARG 56 2HH1 ARG 56 0.134 14.456 -7.128
428 1HH2 ARG 56 1HH2 ARG 56 -0.883 15.246 -3.879
429 2HH2 ARG 56 2HH2 ARG 56 0.075 15.738 -5.237
430 H MET 57 H MET 57 -7.663 9.115 -3.845
431 HA MET 57 HA MET 57 -9.666 9.204 -4.906
432 1HB MET 57 2HB MET 57 -8.503 11.756 -5.132
433 2HB MET 57 1HB MET 57 -9.247 11.416 -6.689
434 1HG MET 57 2HG MET 57 -10.681 11.135 -4.062
435 2HG MET 57 1HG MET 57 -10.699 12.600 -5.039
436 1HE MET 57 1HE MET 57 -12.836 12.972 -6.702
437 2HE MET 57 2HE MET 57 -12.793 11.834 -8.050
438 3HE MET 57 3HE MET 57 -11.307 12.610 -7.502
439 HA PRO 58 HA PRO 58 -7.658 7.573 -8.939
440 1HB PRO 58 2HB PRO 58 -7.845 4.910 -8.340
441 2HB PRO 58 1HB PRO 58 -6.399 5.881 -8.046
442 1HG PRO 58 2HG PRO 58 -8.558 5.076 -6.133
443 2HG PRO 58 1HG PRO 58 -6.802 5.115 -5.890
444 1HD PRO 58 2HD PRO 58 -8.432 7.047 -4.961
445 2HD PRO 58 1HD PRO 58 -6.783 7.391 -5.515
446 H GLY 59 H GLY 59 -9.818 5.216 -7.386
447 1HA GLY 59 2HA GLY 59 -11.795 5.756 -9.507
448 2HA GLY 59 1HA GLY 59 -11.543 4.184 -8.765
449 H MET 60 H MET 60 -11.276 5.432 -6.095
450 HA MET 60 HA MET 60 -13.821 6.649 -5.537
451 1HB MET 60 2HB MET 60 -14.155 4.076 -5.670
452 2HB MET 60 1HB MET 60 -13.298 4.043 -4.135
453 1HG MET 60 2HG MET 60 -15.591 4.051 -3.618
454 2HG MET 60 1HG MET 60 -15.002 5.675 -3.271
455 1HE MET 60 1HE MET 60 -16.240 7.293 -3.440
456 2HE MET 60 2HE MET 60 -17.750 7.486 -4.335
457 3HE MET 60 3HE MET 60 -16.226 8.014 -5.051
458 H ASP 61 H ASP 61 -11.952 8.098 -5.048
459 HA ASP 61 HA ASP 61 -10.853 9.335 -3.501
460 1HB ASP 61 2HB ASP 61 -12.799 7.988 -2.007
461 2HB ASP 61 1HB ASP 61 -11.299 7.802 -1.105
462 H GLY 62 H GLY 62 -10.426 5.906 -3.548
463 1HA GLY 62 2HA GLY 62 -7.919 5.467 -3.957
464 2HA GLY 62 1HA GLY 62 -7.768 6.118 -2.340
465 H LEU 63 H LEU 63 -10.414 4.930 -1.620
466 HA LEU 63 HA LEU 63 -9.400 2.418 -0.732
467 1HB LEU 63 2HB LEU 63 -12.241 3.385 -0.561
468 2HB LEU 63 1HB LEU 63 -11.484 2.136 0.410
469 HG LEU 63 HG LEU 63 -9.882 4.186 1.038
470 1HD1 LEU 63 1HD1 LEU 63 -12.405 5.378 0.036
471 2HD1 LEU 63 2HD1 LEU 63 -10.753 5.973 -0.067
472 3HD1 LEU 63 3HD1 LEU 63 -11.636 6.086 1.454
473 1HD2 LEU 63 1HD2 LEU 63 -10.976 4.266 3.101
474 2HD2 LEU 63 2HD2 LEU 63 -11.323 2.656 2.477
475 3HD2 LEU 63 3HD2 LEU 63 -12.545 3.915 2.384
476 H ALA 64 H ALA 64 -10.948 3.546 -3.522
477 HA ALA 64 HA ALA 64 -12.535 1.412 -4.324
478 1HB ALA 64 1HB ALA 64 -11.878 3.707 -5.460
479 2HB ALA 64 2HB ALA 64 -12.493 2.355 -6.402
480 3HB ALA 64 3HB ALA 64 -10.762 2.675 -6.344
481 H LEU 65 H LEU 65 -9.033 1.892 -4.650
482 HA LEU 65 HA LEU 65 -8.458 -0.444 -6.071
483 1HB LEU 65 2HB LEU 65 -6.157 -0.207 -5.227
484 2HB LEU 65 1HB LEU 65 -6.801 1.293 -5.858
485 HG LEU 65 HG LEU 65 -7.385 1.668 -3.283
486 1HD1 LEU 65 1HD1 LEU 65 -6.574 -0.301 -2.330
487 2HD1 LEU 65 2HD1 LEU 65 -5.323 0.897 -2.007
488 3HD1 LEU 65 3HD1 LEU 65 -5.106 -0.274 -3.308
489 1HD2 LEU 65 1HD2 LEU 65 -4.595 2.284 -3.631
490 2HD2 LEU 65 2HD2 LEU 65 -5.982 3.369 -3.588
491 3HD2 LEU 65 3HD2 LEU 65 -5.496 2.620 -5.106
492 H LEU 66 H LEU 66 -8.899 0.133 -2.628
493 HA LEU 66 HA LEU 66 -7.933 -2.275 -1.617
494 1HB LEU 66 2HB LEU 66 -9.970 -0.303 -0.719
495 2HB LEU 66 1HB LEU 66 -9.896 -1.847 0.104
496 HG LEU 66 HG LEU 66 -7.563 0.043 -0.195
497 1HD1 LEU 66 1HD1 LEU 66 -8.351 -0.245 2.495
498 2HD1 LEU 66 2HD1 LEU 66 -9.797 0.153 1.569
499 3HD1 LEU 66 3HD1 LEU 66 -8.383 1.201 1.491
500 1HD2 LEU 66 1HD2 LEU 66 -6.826 -1.493 1.795
501 2HD2 LEU 66 2HD2 LEU 66 -6.574 -1.993 0.125
502 3HD2 LEU 66 3HD2 LEU 66 -7.933 -2.639 1.041
503 H LYS 67 H LYS 67 -11.187 -1.462 -2.743
504 HA LYS 67 HA LYS 67 -12.450 -3.878 -2.259
505 1HB LYS 67 2HB LYS 67 -13.296 -1.591 -3.289
506 2HB LYS 67 1HB LYS 67 -13.054 -2.448 -4.806
507 1HG LYS 67 2HG LYS 67 -15.275 -2.867 -4.320
508 2HG LYS 67 1HG LYS 67 -14.465 -4.313 -3.712
509 1HD LYS 67 2HD LYS 67 -14.544 -3.479 -1.458
510 2HD LYS 67 1HD LYS 67 -15.178 -1.926 -2.010
511 1HE LYS 67 2HE LYS 67 -17.053 -3.503 -3.043
512 2HE LYS 67 1HE LYS 67 -16.541 -4.549 -1.720
513 1HZ LYS 67 1HZ LYS 67 -17.767 -3.332 -0.356
514 2HZ LYS 67 2HZ LYS 67 -18.211 -2.294 -1.616
515 3HZ LYS 67 3HZ LYS 67 -16.826 -1.967 -0.699
516 H GLN 68 H GLN 68 -10.540 -2.903 -5.092
517 HA GLN 68 HA GLN 68 -10.937 -5.288 -6.556
518 1HB GLN 68 2HB GLN 68 -8.540 -3.471 -6.759
519 2HB GLN 68 1HB GLN 68 -9.185 -4.532 -8.002
520 1HG GLN 68 2HG GLN 68 -10.622 -2.139 -6.885
521 2HG GLN 68 1HG GLN 68 -9.675 -2.142 -8.372
522 1HE2 GLN 68 1HE2 GLN 68 -10.675 -2.649 -10.199
523 2HE2 GLN 68 2HE2 GLN 68 -12.244 -3.363 -10.323
524 H ILE 69 H ILE 69 -8.775 -4.381 -4.009
525 HA ILE 69 HA ILE 69 -6.778 -6.323 -4.358
526 HB ILE 69 HB ILE 69 -7.713 -4.901 -1.872
527 1HG1 ILE 69 2HG1 ILE 69 -5.335 -4.354 -3.644
528 2HG1 ILE 69 1HG1 ILE 69 -6.857 -3.508 -3.757
529 1HG2 ILE 69 1HG2 ILE 69 -6.299 -6.070 -0.643
530 2HG2 ILE 69 2HG2 ILE 69 -4.975 -5.702 -1.740
531 3HG2 ILE 69 3HG2 ILE 69 -5.991 -7.113 -2.025
532 1HD1 ILE 69 1HD1 ILE 69 -6.091 -2.069 -2.286
533 2HD1 ILE 69 2HD1 ILE 69 -4.643 -3.032 -2.033
534 3HD1 ILE 69 3HD1 ILE 69 -6.092 -3.351 -1.086
535 H LYS 70 H LYS 70 -9.830 -6.381 -2.643
536 HA LYS 70 HA LYS 70 -9.386 -8.930 -1.449
537 1HB LYS 70 2HB LYS 70 -11.639 -8.793 -0.652
538 2HB LYS 70 1HB LYS 70 -10.910 -7.203 -0.500
539 1HG LYS 70 2HG LYS 70 -12.177 -6.313 -2.221
540 2HG LYS 70 1HG LYS 70 -12.564 -7.899 -2.891
541 1HD LYS 70 2HD LYS 70 -13.496 -7.717 -0.179
542 2HD LYS 70 1HD LYS 70 -14.098 -6.348 -1.114
543 1HE LYS 70 2HE LYS 70 -15.194 -7.734 -2.652
544 2HE LYS 70 1HE LYS 70 -14.282 -9.157 -2.151
545 1HZ LYS 70 1HZ LYS 70 -15.613 -9.495 -0.365
546 2HZ LYS 70 2HZ LYS 70 -16.743 -8.724 -1.355
547 3HZ LYS 70 3HZ LYS 70 -15.951 -7.854 -0.140
548 H GLN 71 H GLN 71 -10.733 -7.790 -4.417
549 HA GLN 71 HA GLN 71 -11.888 -10.337 -5.085
550 1HB GLN 71 2HB GLN 71 -13.215 -8.649 -5.927
551 2HB GLN 71 1HB GLN 71 -11.847 -7.622 -6.311
552 1HG GLN 71 2HG GLN 71 -11.777 -9.981 -7.946
553 2HG GLN 71 1HG GLN 71 -13.362 -9.221 -8.045
554 1HE2 GLN 71 1HE2 GLN 71 -10.344 -7.521 -7.456
555 2HE2 GLN 71 2HE2 GLN 71 -10.336 -6.644 -8.945
556 H ARG 72 H ARG 72 -9.019 -8.516 -5.747
557 HA ARG 72 HA ARG 72 -8.138 -10.343 -7.822
558 1HB ARG 72 2HB ARG 72 -7.081 -7.784 -6.704
559 2HB ARG 72 1HB ARG 72 -6.038 -8.825 -7.661
560 1HG ARG 72 2HG ARG 72 -8.012 -8.733 -9.372
561 2HG ARG 72 1HG ARG 72 -8.427 -7.259 -8.491
562 1HD ARG 72 2HD ARG 72 -6.450 -6.210 -9.063
563 2HD ARG 72 1HD ARG 72 -5.629 -7.721 -9.424
564 HE ARG 72 HE ARG 72 -6.635 -7.752 -11.528
565 1HH1 ARG 72 1HH1 ARG 72 -7.775 -5.018 -9.671
566 2HH1 ARG 72 2HH1 ARG 72 -8.297 -4.138 -11.066
567 1HH2 ARG 72 1HH2 ARG 72 -7.332 -6.595 -13.352
568 2HH2 ARG 72 2HH2 ARG 72 -8.053 -5.034 -13.153
569 H HIS 73 H HIS 73 -6.519 -9.061 -4.962
570 HA HIS 73 HA HIS 73 -4.950 -11.497 -4.782
571 1HB HIS 73 2HB HIS 73 -4.395 -9.770 -2.571
572 2HB HIS 73 1HB HIS 73 -3.358 -10.203 -3.917
573 HD1 HIS 73 1HD HIS 73 -3.912 -7.355 -2.337
574 HD2 HIS 73 2HD HIS 73 -4.789 -8.370 -6.248
575 HE1 HIS 73 1HE HIS 73 -3.952 -5.192 -3.599
576 HE2 HIS 73 2HE HIS 73 -4.404 -5.848 -5.983
577 HA PRO 74 HA PRO 74 -7.390 -13.620 -1.814
578 1HB PRO 74 2HB PRO 74 -4.837 -14.272 -0.443
579 2HB PRO 74 1HB PRO 74 -6.100 -15.347 -1.048
580 1HG PRO 74 2HG PRO 74 -3.779 -15.095 -2.340
581 2HG PRO 74 1HG PRO 74 -5.307 -15.278 -3.221
582 1HD PRO 74 2HD PRO 74 -3.659 -12.828 -2.771
583 2HD PRO 74 1HD PRO 74 -4.594 -13.316 -4.199
584 H MET 75 H MET 75 -4.565 -12.452 0.032
585 HA MET 75 HA MET 75 -6.296 -10.724 1.616
586 1HB MET 75 2HB MET 75 -4.945 -13.186 2.632
587 2HB MET 75 1HB MET 75 -5.055 -11.788 3.690
588 1HG MET 75 2HG MET 75 -7.227 -12.104 4.079
589 2HG MET 75 1HG MET 75 -7.575 -12.461 2.388
590 1HE MET 75 1HE MET 75 -8.814 -14.414 5.243
591 2HE MET 75 2HE MET 75 -7.452 -13.407 5.737
592 3HE MET 75 3HE MET 75 -7.345 -15.162 5.873
593 H LEU 76 H LEU 76 -4.293 -10.056 -0.218
594 HA LEU 76 HA LEU 76 -1.772 -9.610 0.940
595 1HB LEU 76 2HB LEU 76 -2.298 -9.508 -1.493
596 2HB LEU 76 1HB LEU 76 -3.121 -7.989 -1.205
597 HG LEU 76 HG LEU 76 -0.910 -7.111 -0.309
598 1HD1 LEU 76 1HD1 LEU 76 0.763 -8.544 -0.078
599 2HD1 LEU 76 2HD1 LEU 76 0.807 -8.727 -1.830
600 3HD1 LEU 76 3HD1 LEU 76 -0.169 -9.824 -0.852
601 1HD2 LEU 76 1HD2 LEU 76 -1.965 -7.237 -2.880
602 2HD2 LEU 76 2HD2 LEU 76 -0.268 -7.636 -3.070
603 3HD2 LEU 76 3HD2 LEU 76 -0.732 -6.132 -2.295
604 HA PRO 77 HA PRO 77 -2.863 -6.299 3.730
605 1HB PRO 77 2HB PRO 77 -0.359 -5.599 4.476
606 2HB PRO 77 1HB PRO 77 -1.152 -7.065 5.066
607 1HG PRO 77 2HG PRO 77 0.861 -6.754 2.872
608 2HG PRO 77 1HG PRO 77 0.773 -7.987 4.143
609 1HD PRO 77 2HD PRO 77 -0.080 -8.427 1.607
610 2HD PRO 77 1HD PRO 77 -0.816 -9.214 3.016
611 H VAL 78 H VAL 78 -3.277 -4.203 3.404
612 HA VAL 78 HA VAL 78 -1.633 -2.740 1.446
613 HB VAL 78 HB VAL 78 -4.559 -2.195 1.866
614 1HG1 VAL 78 1HG1 VAL 78 -2.417 -1.187 0.118
615 2HG1 VAL 78 2HG1 VAL 78 -3.858 -0.380 0.734
616 3HG1 VAL 78 3HG1 VAL 78 -3.977 -1.454 -0.659
617 1HG2 VAL 78 1HG2 VAL 78 -5.211 -3.737 0.331
618 2HG2 VAL 78 2HG2 VAL 78 -3.790 -4.583 0.931
619 3HG2 VAL 78 3HG2 VAL 78 -3.695 -3.654 -0.563
620 H ILE 79 H ILE 79 -1.285 -0.533 1.836
621 HA ILE 79 HA ILE 79 -2.098 0.414 4.503
622 HB ILE 79 HB ILE 79 0.566 1.021 3.231
623 1HG1 ILE 79 2HG1 ILE 79 0.757 -0.543 5.633
624 2HG1 ILE 79 1HG1 ILE 79 -0.261 -1.383 4.468
625 1HG2 ILE 79 1HG2 ILE 79 -0.877 2.120 5.445
626 2HG2 ILE 79 2HG2 ILE 79 0.684 2.604 4.782
627 3HG2 ILE 79 3HG2 ILE 79 0.602 1.352 6.020
628 1HD1 ILE 79 1HD1 ILE 79 1.915 -2.138 4.106
629 2HD1 ILE 79 2HD1 ILE 79 2.588 -0.513 4.158
630 3HD1 ILE 79 3HD1 ILE 79 1.593 -1.014 2.790
631 H ILE 80 H ILE 80 -3.400 2.078 4.275
632 HA ILE 80 HA ILE 80 -3.127 3.815 1.935
633 HB ILE 80 HB ILE 80 -5.339 3.931 3.968
634 1HG1 ILE 80 2HG1 ILE 80 -5.099 1.612 3.059
635 2HG1 ILE 80 1HG1 ILE 80 -6.615 2.383 2.620
636 1HG2 ILE 80 1HG2 ILE 80 -6.108 5.550 2.663
637 2HG2 ILE 80 2HG2 ILE 80 -6.109 4.466 1.277
638 3HG2 ILE 80 3HG2 ILE 80 -4.671 5.408 1.659
639 1HD1 ILE 80 1HD1 ILE 80 -4.989 3.040 0.524
640 2HD1 ILE 80 2HD1 ILE 80 -6.157 1.717 0.554
641 3HD1 ILE 80 3HD1 ILE 80 -4.465 1.411 0.942
642 H MET 81 H MET 81 -2.659 5.970 2.064
643 HA MET 81 HA MET 81 -1.318 6.868 4.431
644 1HB MET 81 2HB MET 81 -0.726 8.817 3.173
645 2HB MET 81 1HB MET 81 -0.590 7.424 2.111
646 1HG MET 81 2HG MET 81 -2.020 8.290 0.672
647 2HG MET 81 1HG MET 81 -3.220 8.560 1.931
648 1HE MET 81 1HE MET 81 -3.698 10.570 -0.058
649 2HE MET 81 2HE MET 81 -2.138 10.310 -0.839
650 3HE MET 81 3HE MET 81 -2.584 11.921 -0.276
651 H THR 82 H THR 82 -4.488 7.453 3.045
652 HA THR 82 HA THR 82 -5.233 8.903 5.467
653 HB THR 82 HB THR 82 -5.810 10.054 2.736
654 HG1 THR 82 1HG THR 82 -4.198 11.529 3.168
655 1HG2 THR 82 1HG2 THR 82 -5.913 12.075 4.598
656 2HG2 THR 82 2HG2 THR 82 -6.710 10.725 5.402
657 3HG2 THR 82 3HG2 THR 82 -7.290 11.282 3.835
658 H ALA 83 H ALA 83 -7.547 9.094 5.771
659 HA ALA 83 HA ALA 83 -9.067 7.098 4.218
660 1HB ALA 83 1HB ALA 83 -8.570 7.274 7.028
661 2HB ALA 83 2HB ALA 83 -9.424 6.023 6.124
662 3HB ALA 83 3HB ALA 83 -10.301 7.432 6.725
663 H HIS 84 H HIS 84 -8.764 10.318 4.689
664 HA HIS 84 HA HIS 84 -10.210 12.111 4.930
665 1HB HIS 84 2HB HIS 84 -11.639 11.996 2.624
666 2HB HIS 84 1HB HIS 84 -9.966 12.516 2.748
667 HD1 HIS 84 1HD HIS 84 -11.415 9.007 2.631
668 HD2 HIS 84 2HD HIS 84 -8.775 11.463 0.572
669 HE1 HIS 84 1HE HIS 84 -10.444 7.579 0.818
670 HE2 HIS 84 2HE HIS 84 -8.956 9.119 -0.508
671 H SER 85 H SER 85 -12.696 10.405 3.101
672 HA SER 85 HA SER 85 -14.353 10.345 5.523
673 1HB SER 85 2HB SER 85 -15.290 11.515 2.901
674 2HB SER 85 1HB SER 85 -16.204 11.430 4.406
675 HG SER 85 HG SER 85 -15.279 13.482 4.138
676 H ASP 86 H ASP 86 -13.614 8.973 2.419
677 HA ASP 86 HA ASP 86 -15.950 7.302 2.310
678 1HB ASP 86 2HB ASP 86 -13.731 7.942 0.585
679 2HB ASP 86 1HB ASP 86 -13.959 6.197 0.653
680 H LEU 87 H LEU 87 -14.269 7.106 4.742
681 HA LEU 87 HA LEU 87 -12.648 4.932 4.953
682 1HB LEU 87 2HB LEU 87 -14.093 6.588 6.715
683 2HB LEU 87 1HB LEU 87 -14.442 4.939 7.194
684 HG LEU 87 HG LEU 87 -11.649 6.031 6.865
685 1HD1 LEU 87 1HD1 LEU 87 -11.553 6.265 9.244
686 2HD1 LEU 87 2HD1 LEU 87 -13.179 5.606 9.426
687 3HD1 LEU 87 3HD1 LEU 87 -12.944 7.177 8.658
688 1HD2 LEU 87 1HD2 LEU 87 -11.040 3.904 7.042
689 2HD2 LEU 87 2HD2 LEU 87 -12.719 3.402 7.231
690 3HD2 LEU 87 3HD2 LEU 87 -11.772 3.856 8.646
691 H ASP 88 H ASP 88 -16.027 4.875 4.277
692 HA ASP 88 HA ASP 88 -16.888 2.470 5.259
693 1HB ASP 88 2HB ASP 88 -17.917 4.297 3.523
694 2HB ASP 88 1HB ASP 88 -17.648 2.927 2.447
695 H ALA 89 H ALA 89 -15.259 2.950 2.123
696 HA ALA 89 HA ALA 89 -15.112 0.219 1.466
697 1HB ALA 89 1HB ALA 89 -13.635 2.640 0.517
698 2HB ALA 89 2HB ALA 89 -14.850 1.683 -0.327
699 3HB ALA 89 3HB ALA 89 -13.228 1.030 -0.079
700 H ALA 90 H ALA 90 -13.287 2.131 3.652
701 HA ALA 90 HA ALA 90 -10.875 0.630 3.613
702 1HB ALA 90 1HB ALA 90 -10.311 1.765 5.659
703 2HB ALA 90 2HB ALA 90 -11.985 2.246 5.904
704 3HB ALA 90 3HB ALA 90 -11.065 2.920 4.563
705 H VAL 91 H VAL 91 -13.932 0.321 5.318
706 HA VAL 91 HA VAL 91 -13.069 -1.564 7.216
707 HB VAL 91 HB VAL 91 -15.866 -1.580 6.151
708 1HG1 VAL 91 1HG1 VAL 91 -14.395 -2.517 8.521
709 2HG1 VAL 91 2HG1 VAL 91 -15.886 -3.130 7.787
710 3HG1 VAL 91 3HG1 VAL 91 -15.946 -1.736 8.865
711 1HG2 VAL 91 1HG2 VAL 91 -16.154 0.180 8.091
712 2HG2 VAL 91 2HG2 VAL 91 -15.722 0.698 6.463
713 3HG2 VAL 91 3HG2 VAL 91 -14.477 0.557 7.703
714 H SER 92 H SER 92 -14.537 -1.982 4.005
715 HA SER 92 HA SER 92 -14.560 -4.799 4.059
716 1HB SER 92 2HB SER 92 -14.960 -4.720 1.714
717 2HB SER 92 1HB SER 92 -15.745 -3.287 2.379
718 HG SER 92 HG SER 92 -14.578 -2.631 0.615
719 H ALA 93 H ALA 93 -12.034 -2.547 3.862
720 HA ALA 93 HA ALA 93 -10.154 -4.135 2.443
721 1HB ALA 93 1HB ALA 93 -10.163 -1.615 2.651
722 2HB ALA 93 2HB ALA 93 -8.612 -2.416 2.870
723 3HB ALA 93 3HB ALA 93 -9.519 -1.860 4.273
724 H TYR 94 H TYR 94 -10.526 -3.256 5.841
725 HA TYR 94 HA TYR 94 -8.392 -4.750 6.843
726 1HB TYR 94 2HB TYR 94 -10.919 -4.428 8.426
727 2HB TYR 94 1HB TYR 94 -9.253 -4.396 8.991
728 HD1 TYR 94 1HD TYR 94 -12.035 -2.419 8.524
729 HD2 TYR 94 2HD TYR 94 -7.842 -2.415 7.743
730 HE1 TYR 94 1HE TYR 94 -12.049 0.036 8.439
731 HE2 TYR 94 2HE TYR 94 -7.854 0.041 7.656
732 HH TYR 94 HH TYR 94 -9.086 1.892 7.793
733 H GLN 95 H GLN 95 -11.623 -5.675 6.003
734 HA GLN 95 HA GLN 95 -11.468 -8.267 7.229
735 1HB GLN 95 2HB GLN 95 -13.614 -8.695 6.211
736 2HB GLN 95 1HB GLN 95 -13.606 -7.079 6.904
737 1HG GLN 95 2HG GLN 95 -14.625 -6.701 4.900
738 2HG GLN 95 1HG GLN 95 -12.946 -6.351 4.514
739 1HE2 GLN 95 1HE2 GLN 95 -14.177 -6.759 2.360
740 2HE2 GLN 95 2HE2 GLN 95 -14.025 -8.365 1.734
741 H GLN 96 H GLN 96 -10.796 -6.958 4.042
742 HA GLN 96 HA GLN 96 -10.527 -9.572 2.880
743 1HB GLN 96 2HB GLN 96 -9.831 -8.401 0.839
744 2HB GLN 96 1HB GLN 96 -11.349 -7.781 1.471
745 1HG GLN 96 2HG GLN 96 -10.421 -5.784 1.147
746 2HG GLN 96 1HG GLN 96 -9.577 -6.117 2.651
747 1HE2 GLN 96 1HE2 GLN 96 -7.747 -4.991 2.219
748 2HE2 GLN 96 2HE2 GLN 96 -6.632 -5.415 0.972
749 H GLY 97 H GLY 97 -8.523 -7.484 4.681
750 1HA GLY 97 2HA GLY 97 -6.475 -8.786 5.399
751 2HA GLY 97 1HA GLY 97 -6.130 -8.898 3.684
752 H ALA 98 H ALA 98 -7.467 -5.881 4.394
753 HA ALA 98 HA ALA 98 -5.182 -4.457 3.682
754 1HB ALA 98 1HB ALA 98 -7.340 -3.309 5.425
755 2HB ALA 98 2HB ALA 98 -7.600 -3.675 3.721
756 3HB ALA 98 3HB ALA 98 -6.374 -2.503 4.190
757 H PHE 99 H PHE 99 -3.775 -3.102 4.918
758 HA PHE 99 HA PHE 99 -2.976 -4.331 7.383
759 1HB PHE 99 2HB PHE 99 -1.385 -3.515 5.593
760 2HB PHE 99 1HB PHE 99 -1.772 -1.878 6.115
761 HD1 PHE 99 1HD PHE 99 -0.841 -5.113 7.735
762 HD2 PHE 99 2HD PHE 99 -0.234 -0.911 7.490
763 HE1 PHE 99 1HE PHE 99 0.874 -5.261 9.489
764 HE2 PHE 99 2HE PHE 99 1.484 -1.052 9.242
765 HZ PHE 99 HZ PHE 99 2.041 -3.228 10.244
766 H ASP 100 H ASP 100 -3.893 -1.021 6.413
767 HA ASP 100 HA ASP 100 -5.585 -0.457 8.518
768 1HB ASP 100 2HB ASP 100 -4.255 0.716 10.152
769 2HB ASP 100 1HB ASP 100 -3.526 -0.867 9.922
770 H TYR 101 H TYR 101 -4.897 2.204 9.142
771 HA TYR 101 HA TYR 101 -4.636 3.568 6.566
772 1HB TYR 101 2HB TYR 101 -7.075 3.443 8.235
773 2HB TYR 101 1HB TYR 101 -6.625 5.050 7.677
774 HD1 TYR 101 1HD TYR 101 -7.532 1.645 6.567
775 HD2 TYR 101 2HD TYR 101 -6.946 5.708 5.436
776 HE1 TYR 101 1HE TYR 101 -8.614 1.198 4.403
777 HE2 TYR 101 2HE TYR 101 -8.018 5.272 3.265
778 HH TYR 101 HH TYR 101 -9.588 2.214 2.594
779 H LEU 102 H LEU 102 -4.085 5.816 6.762
780 HA LEU 102 HA LEU 102 -2.797 6.420 9.326
781 1HB LEU 102 2HB LEU 102 -2.062 6.760 6.574
782 2HB LEU 102 1HB LEU 102 -2.072 8.321 7.370
783 HG LEU 102 HG LEU 102 -0.498 7.515 9.041
784 1HD1 LEU 102 1HD1 LEU 102 -0.038 4.988 7.567
785 2HD1 LEU 102 2HD1 LEU 102 -1.422 5.065 8.659
786 3HD1 LEU 102 3HD1 LEU 102 0.205 5.367 9.271
787 1HD2 LEU 102 1HD2 LEU 102 0.019 7.762 6.243
788 2HD2 LEU 102 2HD2 LEU 102 1.146 6.605 6.954
789 3HD2 LEU 102 3HD2 LEU 102 1.021 8.236 7.614
790 HA PRO 103 HA PRO 103 -6.180 9.259 10.134
791 1HB PRO 103 2HB PRO 103 -4.218 10.375 12.067
792 2HB PRO 103 1HB PRO 103 -5.880 9.839 12.331
793 1HG PRO 103 2HG PRO 103 -3.818 8.365 13.155
794 2HG PRO 103 1HG PRO 103 -5.279 7.610 12.492
795 1HD PRO 103 2HD PRO 103 -2.607 8.021 11.217
796 2HD PRO 103 1HD PRO 103 -3.731 6.653 11.071
797 H LYS 104 H LYS 104 -3.070 10.917 10.693
798 HA LYS 104 HA LYS 104 -3.811 12.806 8.570
799 1HB LYS 104 2HB LYS 104 -2.948 13.418 11.376
800 2HB LYS 104 1HB LYS 104 -2.662 14.571 10.080
801 1HG LYS 104 2HG LYS 104 -5.395 13.456 10.385
802 2HG LYS 104 1HG LYS 104 -4.838 14.640 11.568
803 1HD LYS 104 2HD LYS 104 -4.101 15.649 9.052
804 2HD LYS 104 1HD LYS 104 -5.750 15.045 8.871
805 1HE LYS 104 2HE LYS 104 -6.571 16.463 10.547
806 2HE LYS 104 1HE LYS 104 -4.960 16.784 11.185
807 1HZ LYS 104 1HZ LYS 104 -4.646 17.749 8.765
808 2HZ LYS 104 2HZ LYS 104 -5.287 18.684 10.020
809 3HZ LYS 104 3HZ LYS 104 -6.320 17.965 8.888
810 HA PRO 105 HA PRO 105 1.067 12.983 9.039
811 1HB PRO 105 2HB PRO 105 1.435 10.430 10.527
812 2HB PRO 105 1HB PRO 105 2.353 11.936 10.634
813 1HG PRO 105 2HG PRO 105 0.628 11.267 12.543
814 2HG PRO 105 1HG PRO 105 0.784 12.950 12.007
815 1HD PRO 105 2HD PRO 105 -1.343 10.946 11.388
816 2HD PRO 105 1HD PRO 105 -1.483 12.690 11.676
817 H PHE 106 H PHE 106 2.587 11.797 7.718
818 HA PHE 106 HA PHE 106 1.995 9.227 6.678
819 1HB PHE 106 2HB PHE 106 0.231 10.396 5.481
820 2HB PHE 106 1HB PHE 106 1.379 11.590 4.888
821 HD1 PHE 106 1HD PHE 106 1.550 11.359 2.604
822 HD2 PHE 106 2HD PHE 106 1.511 7.865 5.032
823 HE1 PHE 106 1HE PHE 106 1.965 9.974 0.613
824 HE2 PHE 106 2HE PHE 106 1.927 6.474 3.045
825 HZ PHE 106 HZ PHE 106 2.154 7.529 0.833
826 H ASP 107 H ASP 107 3.229 11.396 4.285
827 HA ASP 107 HA ASP 107 5.282 11.404 3.277
828 1HB ASP 107 2HB ASP 107 7.085 12.282 4.708
829 2HB ASP 107 1HB ASP 107 5.575 13.151 4.955
830 H ILE 108 H ILE 108 7.778 10.631 3.814
831 HA ILE 108 HA ILE 108 7.614 7.811 3.658
832 HB ILE 108 HB ILE 108 9.627 9.787 3.196
833 1HG1 ILE 108 2HG1 ILE 108 10.468 8.084 1.664
834 2HG1 ILE 108 1HG1 ILE 108 9.460 6.873 2.445
835 1HG2 ILE 108 1HG2 ILE 108 10.469 7.427 4.842
836 2HG2 ILE 108 2HG2 ILE 108 10.843 9.129 5.093
837 3HG2 ILE 108 3HG2 ILE 108 11.576 8.254 3.752
838 1HD1 ILE 108 1HD1 ILE 108 8.657 7.910 0.236
839 2HD1 ILE 108 2HD1 ILE 108 8.237 9.309 1.224
840 3HD1 ILE 108 3HD1 ILE 108 7.504 7.739 1.563
841 H ASP 109 H ASP 109 8.670 9.984 6.176
842 HA ASP 109 HA ASP 109 9.761 8.240 7.986
843 1HB ASP 109 2HB ASP 109 9.521 10.756 8.206
844 2HB ASP 109 1HB ASP 109 7.897 10.458 8.814
845 H GLU 110 H GLU 110 6.305 9.197 7.998
846 HA GLU 110 HA GLU 110 5.651 7.122 9.828
847 1HB GLU 110 2HB GLU 110 3.934 9.036 8.261
848 2HB GLU 110 1HB GLU 110 3.262 7.814 9.323
849 1HG GLU 110 2HG GLU 110 5.331 9.523 10.519
850 2HG GLU 110 1HG GLU 110 3.830 10.335 10.071
851 H ALA 111 H ALA 111 5.511 7.508 6.370
852 HA ALA 111 HA ALA 111 3.836 5.290 5.843
853 1HB ALA 111 1HB ALA 111 5.867 6.680 4.106
854 2HB ALA 111 2HB ALA 111 4.125 6.957 4.153
855 3HB ALA 111 3HB ALA 111 4.760 5.432 3.533
856 H VAL 112 H VAL 112 7.380 5.616 5.475
857 HA VAL 112 HA VAL 112 7.875 2.896 5.046
858 HB VAL 112 HB VAL 112 9.762 4.839 6.367
859 1HG1 VAL 112 1HG1 VAL 112 10.005 2.108 5.878
860 2HG1 VAL 112 2HG1 VAL 112 11.309 3.234 6.255
861 3HG1 VAL 112 3HG1 VAL 112 10.910 2.877 4.573
862 1HG2 VAL 112 1HG2 VAL 112 10.449 4.628 3.693
863 2HG2 VAL 112 2HG2 VAL 112 9.639 5.990 4.461
864 3HG2 VAL 112 3HG2 VAL 112 8.691 4.736 3.680
865 H ALA 113 H ALA 113 7.431 4.734 7.941
866 HA ALA 113 HA ALA 113 8.443 2.914 9.831
867 1HB ALA 113 1HB ALA 113 6.111 4.767 10.247
868 2HB ALA 113 2HB ALA 113 7.783 5.322 10.211
869 3HB ALA 113 3HB ALA 113 7.260 4.187 11.451
870 H LEU 114 H LEU 114 5.249 3.402 8.459
871 HA LEU 114 HA LEU 114 4.047 1.257 9.901
872 1HB LEU 114 2HB LEU 114 2.849 3.312 9.227
873 2HB LEU 114 1HB LEU 114 3.012 2.827 7.551
874 HG LEU 114 HG LEU 114 1.665 0.784 8.082
875 1HD1 LEU 114 1HD1 LEU 114 1.819 0.433 10.359
876 2HD1 LEU 114 2HD1 LEU 114 0.223 1.161 10.204
877 3HD1 LEU 114 3HD1 LEU 114 1.589 2.136 10.743
878 1HD2 LEU 114 1HD2 LEU 114 0.850 3.177 7.302
879 2HD2 LEU 114 2HD2 LEU 114 0.017 3.129 8.853
880 3HD2 LEU 114 3HD2 LEU 114 -0.289 1.879 7.650
881 H VAL 115 H VAL 115 5.729 1.537 6.902
882 HA VAL 115 HA VAL 115 4.502 -0.783 5.740
883 HB VAL 115 HB VAL 115 5.499 1.091 4.369
884 1HG1 VAL 115 1HG1 VAL 115 7.668 1.072 5.700
885 2HG1 VAL 115 2HG1 VAL 115 7.806 1.194 3.951
886 3HG1 VAL 115 3HG1 VAL 115 8.105 -0.346 4.756
887 1HG2 VAL 115 1HG2 VAL 115 4.995 -0.542 2.923
888 2HG2 VAL 115 2HG2 VAL 115 5.688 -1.796 3.950
889 3HG2 VAL 115 3HG2 VAL 115 6.732 -0.844 2.899
890 H GLU 116 H GLU 116 7.614 -0.096 7.277
891 HA GLU 116 HA GLU 116 8.681 -2.694 6.956
892 1HB GLU 116 2HB GLU 116 9.307 -0.542 8.985
893 2HB GLU 116 1HB GLU 116 10.257 -2.005 8.765
894 1HG GLU 116 2HG GLU 116 10.897 -1.354 6.572
895 2HG GLU 116 1HG GLU 116 9.755 -0.011 6.575
896 H ARG 117 H ARG 117 6.935 -1.143 9.623
897 HA ARG 117 HA ARG 117 7.056 -3.280 11.428
898 1HB ARG 117 2HB ARG 117 5.078 -1.038 11.071
899 2HB ARG 117 1HB ARG 117 4.921 -2.223 12.361
900 1HG ARG 117 2HG ARG 117 6.933 -1.532 13.375
901 2HG ARG 117 1HG ARG 117 7.410 -0.594 11.960
902 1HD ARG 117 2HD ARG 117 6.654 1.013 13.474
903 2HD ARG 117 1HD ARG 117 5.290 0.769 12.386
904 HE ARG 117 HE ARG 117 5.410 -0.655 14.951
905 1HH1 ARG 117 1HH1 ARG 117 3.810 1.618 12.826
906 2HH1 ARG 117 2HH1 ARG 117 2.369 1.675 13.781
907 1HH2 ARG 117 1HH2 ARG 117 3.516 -0.568 16.201
908 2HH2 ARG 117 2HH2 ARG 117 2.201 0.441 15.694
909 H ALA 118 H ALA 118 5.163 -2.787 8.597
910 HA ALA 118 HA ALA 118 3.099 -4.643 9.195
911 1HB ALA 118 1HB ALA 118 2.428 -4.392 6.902
912 2HB ALA 118 2HB ALA 118 3.990 -3.692 6.479
913 3HB ALA 118 3HB ALA 118 2.884 -2.808 7.531
914 H ILE 119 H ILE 119 6.042 -4.823 7.200
915 HA ILE 119 HA ILE 119 5.692 -7.515 6.447
916 HB ILE 119 HB ILE 119 8.331 -6.088 6.711
917 1HG1 ILE 119 2HG1 ILE 119 6.960 -6.158 4.087
918 2HG1 ILE 119 1HG1 ILE 119 6.271 -5.067 5.285
919 1HG2 ILE 119 1HG2 ILE 119 8.790 -7.567 4.661
920 2HG2 ILE 119 2HG2 ILE 119 7.378 -8.483 5.188
921 3HG2 ILE 119 3HG2 ILE 119 8.774 -8.324 6.255
922 1HD1 ILE 119 1HD1 ILE 119 8.265 -3.840 5.458
923 2HD1 ILE 119 2HD1 ILE 119 8.002 -4.092 3.732
924 3HD1 ILE 119 3HD1 ILE 119 9.186 -5.071 4.597
925 H SER 120 H SER 120 7.078 -5.978 9.224
926 HA SER 120 HA SER 120 8.444 -8.251 10.245
927 1HB SER 120 2HB SER 120 8.701 -5.686 10.803
928 2HB SER 120 1HB SER 120 7.495 -6.050 12.036
929 HG SER 120 HG SER 120 10.146 -6.810 11.867
930 H HIS 121 H HIS 121 5.478 -6.595 11.335
931 HA HIS 121 HA HIS 121 4.718 -8.542 13.197
932 1HB HIS 121 2HB HIS 121 3.272 -6.352 11.758
933 2HB HIS 121 1HB HIS 121 2.355 -7.507 12.720
934 HD1 HIS 121 1HD HIS 121 5.355 -5.205 13.203
935 HD2 HIS 121 2HD HIS 121 2.127 -6.764 15.309
936 HE1 HIS 121 1HE HIS 121 5.454 -4.132 15.474
937 HE2 HIS 121 2HE HIS 121 3.485 -5.078 16.728
938 H TYR 122 H TYR 122 4.366 -8.399 9.764
939 HA TYR 122 HA TYR 122 2.308 -10.354 9.546
940 1HB TYR 122 2HB TYR 122 2.881 -8.619 7.801
941 2HB TYR 122 1HB TYR 122 4.305 -9.581 7.416
942 HD1 TYR 122 1HD TYR 122 0.610 -10.005 7.798
943 HD2 TYR 122 2HD TYR 122 4.136 -11.093 5.683
944 HE1 TYR 122 1HE TYR 122 -0.741 -11.364 6.257
945 HE2 TYR 122 2HE TYR 122 2.795 -12.455 4.134
946 HH TYR 122 HH TYR 122 0.682 -12.911 3.429
947 H GLN 123 H GLN 123 5.789 -10.462 8.778
948 HA GLN 123 HA GLN 123 7.282 -12.181 8.700
949 1HB GLN 123 2HB GLN 123 6.369 -12.219 11.154
950 2HB GLN 123 1HB GLN 123 5.599 -13.717 10.646
951 1HG GLN 123 2HG GLN 123 7.636 -14.789 10.296
952 2HG GLN 123 1HG GLN 123 8.531 -13.270 10.238
953 1HE2 GLN 123 1HE2 GLN 123 8.613 -12.028 12.265
954 2HE2 GLN 123 2HE2 GLN 123 8.708 -12.897 13.756
955 H GLU 124 H GLU 124 7.513 -14.608 8.322
956 HA GLU 124 HA GLU 124 5.216 -15.902 7.128
957 1HB GLU 124 2HB GLU 124 6.160 -14.387 5.348
958 2HB GLU 124 1HB GLU 124 7.636 -15.345 5.409
959 1HG GLU 124 2HG GLU 124 6.766 -16.950 4.146
960 2HG GLU 124 1HG GLU 124 5.271 -16.990 5.081
Start of MODEL 10
1 1H MET 1 1HT MET 1 9.953 -15.582 6.173
2 2H MET 1 2HT MET 1 11.386 -16.245 5.499
3 3H MET 1 3HT MET 1 10.354 -17.223 6.462
4 HA MET 1 HA MET 1 10.163 -17.658 4.100
5 1HB MET 1 2HB MET 1 7.684 -17.541 4.102
6 2HB MET 1 1HB MET 1 8.337 -18.162 5.611
7 1HG MET 1 2HG MET 1 7.774 -15.255 5.421
8 2HG MET 1 1HG MET 1 6.412 -16.364 5.553
9 1HE MET 1 1HE MET 1 5.477 -17.107 7.377
10 2HE MET 1 2HE MET 1 5.587 -15.590 8.270
11 3HE MET 1 3HE MET 1 6.048 -17.104 9.046
12 H GLN 2 H GLN 2 10.040 -16.894 2.069
13 HA GLN 2 HA GLN 2 9.960 -15.440 0.321
14 1HB GLN 2 2HB GLN 2 7.835 -14.575 2.112
15 2HB GLN 2 1HB GLN 2 8.485 -13.243 1.168
16 1HG GLN 2 2HG GLN 2 6.663 -14.132 -0.042
17 2HG GLN 2 1HG GLN 2 8.132 -14.631 -0.880
18 1HE2 GLN 2 1HE2 GLN 2 5.282 -15.716 -0.525
19 2HE2 GLN 2 2HE2 GLN 2 5.534 -17.390 -0.181
20 H ARG 3 H ARG 3 11.114 -13.706 -0.462
21 HA ARG 3 HA ARG 3 13.137 -12.660 1.233
22 1HB ARG 3 2HB ARG 3 13.903 -11.452 -0.747
23 2HB ARG 3 1HB ARG 3 13.544 -13.128 -1.138
24 1HG ARG 3 2HG ARG 3 11.317 -12.365 -1.985
25 2HG ARG 3 1HG ARG 3 11.876 -10.706 -1.768
26 1HD ARG 3 2HD ARG 3 13.428 -10.865 -3.464
27 2HD ARG 3 1HD ARG 3 13.550 -12.618 -3.329
28 HE ARG 3 HE ARG 3 10.983 -12.123 -4.174
29 1HH1 ARG 3 1HH1 ARG 3 14.190 -11.434 -5.366
30 2HH1 ARG 3 2HH1 ARG 3 13.713 -11.464 -7.029
31 1HH2 ARG 3 1HH2 ARG 3 10.355 -12.164 -6.361
32 2HH2 ARG 3 2HH2 ARG 3 11.536 -11.879 -7.595
33 H GLY 4 H GLY 4 9.956 -11.687 0.604
34 1HA GLY 4 2HA GLY 4 8.851 -9.936 1.698
35 2HA GLY 4 1HA GLY 4 10.409 -9.203 2.052
36 H ILE 5 H ILE 5 7.889 -9.583 -0.338
37 HA ILE 5 HA ILE 5 9.197 -7.613 -2.066
38 HB ILE 5 HB ILE 5 6.661 -9.142 -2.630
39 1HG1 ILE 5 2HG1 ILE 5 8.523 -10.291 -4.230
40 2HG1 ILE 5 1HG1 ILE 5 9.508 -9.925 -2.817
41 1HG2 ILE 5 1HG2 ILE 5 6.533 -7.780 -4.380
42 2HG2 ILE 5 2HG2 ILE 5 8.024 -8.500 -4.988
43 3HG2 ILE 5 3HG2 ILE 5 8.090 -7.048 -3.990
44 1HD1 ILE 5 1HD1 ILE 5 7.498 -11.976 -3.206
45 2HD1 ILE 5 2HD1 ILE 5 7.244 -11.043 -1.731
46 3HD1 ILE 5 3HD1 ILE 5 8.784 -11.859 -2.006
47 H VAL 6 H VAL 6 8.751 -5.550 -1.658
48 HA VAL 6 HA VAL 6 6.083 -4.876 -0.630
49 HB VAL 6 HB VAL 6 7.843 -4.097 0.838
50 1HG1 VAL 6 1HG1 VAL 6 9.074 -2.081 -0.774
51 2HG1 VAL 6 2HG1 VAL 6 9.262 -3.653 -1.543
52 3HG1 VAL 6 3HG1 VAL 6 9.819 -3.412 0.109
53 1HG2 VAL 6 1HG2 VAL 6 6.776 -2.182 1.250
54 2HG2 VAL 6 2HG2 VAL 6 5.826 -2.532 -0.195
55 3HG2 VAL 6 3HG2 VAL 6 7.244 -1.487 -0.304
56 H TRP 7 H TRP 7 4.681 -3.931 -1.935
57 HA TRP 7 HA TRP 7 5.706 -2.572 -4.340
58 1HB TRP 7 2HB TRP 7 3.277 -4.281 -3.897
59 2HB TRP 7 1HB TRP 7 3.310 -3.104 -5.206
60 HD1 TRP 7 HD1 TRP 7 6.682 -4.544 -4.674
61 HE1 TRP 7 1HE TRP 7 7.210 -6.291 -6.480
62 HE3 TRP 7 3HE TRP 7 1.989 -5.120 -6.625
63 HZ2 TRP 7 2HZ TRP 7 5.812 -7.747 -8.459
64 HZ3 TRP 7 3HZ TRP 7 1.672 -6.716 -8.470
65 HH2 TRP 7 HH2 TRP 7 3.544 -8.001 -9.367
66 H VAL 8 H VAL 8 5.266 -0.474 -4.560
67 HA VAL 8 HA VAL 8 3.282 0.714 -2.734
68 HB VAL 8 HB VAL 8 5.263 2.506 -4.001
69 1HG1 VAL 8 1HG1 VAL 8 5.137 3.661 -1.959
70 2HG1 VAL 8 2HG1 VAL 8 4.501 2.254 -1.110
71 3HG1 VAL 8 3HG1 VAL 8 3.497 3.101 -2.287
72 1HG2 VAL 8 1HG2 VAL 8 7.125 1.486 -3.359
73 2HG2 VAL 8 2HG2 VAL 8 6.192 0.133 -2.720
74 3HG2 VAL 8 3HG2 VAL 8 6.560 1.511 -1.688
75 H VAL 9 H VAL 9 1.782 2.183 -3.508
76 HA VAL 9 HA VAL 9 1.771 2.567 -6.425
77 HB VAL 9 HB VAL 9 -0.910 2.753 -5.528
78 1HG1 VAL 9 1HG1 VAL 9 0.603 0.763 -7.199
79 2HG1 VAL 9 2HG1 VAL 9 -0.324 2.153 -7.760
80 3HG1 VAL 9 3HG1 VAL 9 -1.151 0.759 -7.063
81 1HG2 VAL 9 1HG2 VAL 9 0.461 0.231 -4.589
82 2HG2 VAL 9 2HG2 VAL 9 -1.285 0.444 -4.712
83 3HG2 VAL 9 3HG2 VAL 9 -0.356 1.424 -3.581
84 H ASP 10 H ASP 10 2.199 4.590 -6.842
85 HA ASP 10 HA ASP 10 0.619 6.718 -5.734
86 1HB ASP 10 2HB ASP 10 2.738 6.066 -4.201
87 2HB ASP 10 1HB ASP 10 3.512 7.190 -5.313
88 H ASP 11 H ASP 11 2.452 8.813 -6.359
89 HA ASP 11 HA ASP 11 1.969 9.068 -9.124
90 1HB ASP 11 2HB ASP 11 3.238 10.693 -7.019
91 2HB ASP 11 1HB ASP 11 3.809 11.010 -8.654
92 H ASP 12 H ASP 12 4.273 7.186 -7.680
93 HA ASP 12 HA ASP 12 6.087 6.076 -8.489
94 1HB ASP 12 2HB ASP 12 4.550 6.472 -10.695
95 2HB ASP 12 1HB ASP 12 6.024 7.308 -11.175
96 H SER 13 H SER 13 7.969 7.004 -10.486
97 HA SER 13 HA SER 13 10.030 7.983 -10.276
98 1HB SER 13 2HB SER 13 8.407 9.365 -11.685
99 2HB SER 13 1HB SER 13 8.427 10.512 -10.351
100 HG SER 13 HG SER 13 10.608 10.811 -10.652
101 H SER 14 H SER 14 8.524 10.710 -8.686
102 HA SER 14 HA SER 14 10.520 11.049 -6.793
103 1HB SER 14 2HB SER 14 9.021 12.864 -7.242
104 2HB SER 14 1HB SER 14 7.622 11.909 -6.755
105 HG SER 14 HG SER 14 9.701 12.912 -5.114
106 H ILE 15 H ILE 15 7.246 9.752 -6.142
107 HA ILE 15 HA ILE 15 7.844 8.880 -3.541
108 HB ILE 15 HB ILE 15 5.781 7.642 -5.358
109 1HG1 ILE 15 2HG1 ILE 15 5.505 10.074 -5.383
110 2HG1 ILE 15 1HG1 ILE 15 4.206 9.317 -4.469
111 1HG2 ILE 15 1HG2 ILE 15 6.372 7.551 -2.466
112 2HG2 ILE 15 2HG2 ILE 15 5.664 6.330 -3.522
113 3HG2 ILE 15 3HG2 ILE 15 4.671 7.659 -2.922
114 1HD1 ILE 15 1HD1 ILE 15 4.985 10.117 -2.452
115 2HD1 ILE 15 2HD1 ILE 15 5.341 11.447 -3.554
116 3HD1 ILE 15 3HD1 ILE 15 6.626 10.346 -3.058
117 H ARG 16 H ARG 16 8.537 7.544 -6.626
118 HA ARG 16 HA ARG 16 8.879 4.841 -5.773
119 1HB ARG 16 2HB ARG 16 8.343 5.421 -8.101
120 2HB ARG 16 1HB ARG 16 9.898 6.224 -8.255
121 1HG ARG 16 2HG ARG 16 10.859 3.911 -7.561
122 2HG ARG 16 1HG ARG 16 9.283 3.309 -8.072
123 1HD ARG 16 2HD ARG 16 9.592 4.186 -10.279
124 2HD ARG 16 1HD ARG 16 11.066 5.024 -9.793
125 HE ARG 16 HE ARG 16 11.461 2.326 -9.282
126 1HH1 ARG 16 1HH1 ARG 16 10.897 4.374 -12.050
127 2HH1 ARG 16 2HH1 ARG 16 11.765 3.350 -13.142
128 1HH2 ARG 16 1HH2 ARG 16 12.610 0.978 -10.718
129 2HH2 ARG 16 2HH2 ARG 16 12.739 1.422 -12.386
130 H TRP 17 H TRP 17 11.206 7.377 -6.728
131 HA TRP 17 HA TRP 17 13.509 5.931 -6.120
132 1HB TRP 17 2HB TRP 17 13.508 8.028 -7.417
133 2HB TRP 17 1HB TRP 17 13.131 8.923 -5.946
134 HD1 TRP 17 HD1 TRP 17 16.006 7.230 -7.763
135 HE1 TRP 17 1HE TRP 17 18.207 7.788 -6.552
136 HE3 TRP 17 3HE TRP 17 14.086 9.480 -3.599
137 HZ2 TRP 17 2HZ TRP 17 19.022 9.022 -4.147
138 HZ3 TRP 17 3HZ TRP 17 15.644 10.321 -1.887
139 HH2 TRP 17 HH2 TRP 17 18.061 10.096 -2.158
140 H VAL 18 H VAL 18 11.494 7.960 -4.055
141 HA VAL 18 HA VAL 18 13.245 7.950 -1.847
142 HB VAL 18 HB VAL 18 10.279 8.287 -1.593
143 1HG1 VAL 18 1HG1 VAL 18 12.471 9.776 -0.181
144 2HG1 VAL 18 2HG1 VAL 18 11.868 8.222 0.397
145 3HG1 VAL 18 3HG1 VAL 18 10.778 9.604 0.283
146 1HG2 VAL 18 1HG2 VAL 18 11.905 9.758 -3.357
147 2HG2 VAL 18 2HG2 VAL 18 11.625 10.793 -1.957
148 3HG2 VAL 18 3HG2 VAL 18 10.258 10.123 -2.845
149 H LEU 19 H LEU 19 10.428 5.970 -2.599
150 HA LEU 19 HA LEU 19 10.725 4.468 -0.173
151 1HB LEU 19 2HB LEU 19 8.611 4.968 -1.899
152 2HB LEU 19 1HB LEU 19 8.949 3.261 -2.116
153 HG LEU 19 HG LEU 19 7.228 3.626 -0.419
154 1HD1 LEU 19 1HD1 LEU 19 7.953 1.831 0.676
155 2HD1 LEU 19 2HD1 LEU 19 9.287 2.729 1.403
156 3HD1 LEU 19 3HD1 LEU 19 9.477 2.007 -0.194
157 1HD2 LEU 19 1HD2 LEU 19 9.308 4.911 1.318
158 2HD2 LEU 19 2HD2 LEU 19 7.560 4.853 1.542
159 3HD2 LEU 19 3HD2 LEU 19 8.254 5.868 0.277
160 H GLU 20 H GLU 20 11.703 4.103 -3.470
161 HA GLU 20 HA GLU 20 12.064 1.305 -3.409
162 1HB GLU 20 2HB GLU 20 13.177 1.495 -5.476
163 2HB GLU 20 1HB GLU 20 11.935 2.729 -5.482
164 1HG GLU 20 2HG GLU 20 13.647 4.406 -4.932
165 2HG GLU 20 1HG GLU 20 14.872 3.142 -5.010
166 H ARG 21 H ARG 21 14.532 3.861 -3.281
167 HA ARG 21 HA ARG 21 16.666 2.168 -2.666
168 1HB ARG 21 2HB ARG 21 16.279 5.112 -2.136
169 2HB ARG 21 1HB ARG 21 17.794 4.267 -1.842
170 1HG ARG 21 2HG ARG 21 16.703 3.836 -4.519
171 2HG ARG 21 1HG ARG 21 17.104 5.516 -4.165
172 1HD ARG 21 2HD ARG 21 19.346 5.060 -3.875
173 2HD ARG 21 1HD ARG 21 19.060 3.368 -3.481
174 HE ARG 21 HE ARG 21 19.046 4.543 -6.177
175 1HH1 ARG 21 1HH1 ARG 21 19.105 1.718 -4.112
176 2HH1 ARG 21 2HH1 ARG 21 19.477 0.635 -5.407
177 1HH2 ARG 21 1HH2 ARG 21 19.529 3.110 -7.868
178 2HH2 ARG 21 2HH2 ARG 21 19.717 1.420 -7.536
179 H ALA 22 H ALA 22 14.768 4.222 -0.443
180 HA ALA 22 HA ALA 22 16.055 3.527 1.897
181 1HB ALA 22 1HB ALA 22 14.607 5.034 2.646
182 2HB ALA 22 2HB ALA 22 13.342 3.806 2.572
183 3HB ALA 22 3HB ALA 22 13.629 4.859 1.189
184 H LEU 23 H LEU 23 13.228 1.971 0.480
185 HA LEU 23 HA LEU 23 13.132 -0.048 2.471
186 1HB LEU 23 2HB LEU 23 11.291 0.777 0.783
187 2HB LEU 23 1HB LEU 23 11.962 -0.476 -0.240
188 HG LEU 23 HG LEU 23 11.085 -2.167 1.004
189 1HD1 LEU 23 1HD1 LEU 23 12.333 -1.723 3.033
190 2HD1 LEU 23 2HD1 LEU 23 10.653 -2.082 3.424
191 3HD1 LEU 23 3HD1 LEU 23 11.228 -0.412 3.455
192 1HD2 LEU 23 1HD2 LEU 23 9.181 -0.206 2.169
193 2HD2 LEU 23 2HD2 LEU 23 8.874 -1.745 1.366
194 3HD2 LEU 23 3HD2 LEU 23 9.314 -0.326 0.414
195 H ALA 24 H ALA 24 14.835 0.335 -0.510
196 HA ALA 24 HA ALA 24 15.515 -2.391 -0.906
197 1HB ALA 24 1HB ALA 24 15.816 -0.212 -2.453
198 2HB ALA 24 2HB ALA 24 16.753 -1.685 -2.677
199 3HB ALA 24 3HB ALA 24 17.443 -0.325 -1.791
200 H GLY 25 H GLY 25 16.830 0.274 0.957
201 1HA GLY 25 2HA GLY 25 19.300 -0.912 1.652
202 2HA GLY 25 1HA GLY 25 18.466 0.340 2.569
203 H ALA 26 H ALA 26 16.051 -1.384 2.759
204 HA ALA 26 HA ALA 26 16.748 -2.706 5.193
205 1HB ALA 26 1HB ALA 26 14.218 -3.444 4.878
206 2HB ALA 26 2HB ALA 26 14.243 -2.107 3.726
207 3HB ALA 26 3HB ALA 26 14.663 -1.824 5.415
208 H GLY 27 H GLY 27 16.670 -3.613 1.912
209 1HA GLY 27 2HA GLY 27 17.577 -5.668 1.172
210 2HA GLY 27 1HA GLY 27 17.115 -6.394 2.697
211 H LEU 28 H LEU 28 14.781 -4.499 0.856
212 HA LEU 28 HA LEU 28 13.544 -7.027 0.051
213 1HB LEU 28 2HB LEU 28 11.692 -4.802 0.540
214 2HB LEU 28 1HB LEU 28 11.521 -6.506 0.893
215 HG LEU 28 HG LEU 28 13.317 -5.883 2.768
216 1HD1 LEU 28 1HD1 LEU 28 12.199 -3.354 1.861
217 2HD1 LEU 28 2HD1 LEU 28 13.707 -3.706 2.700
218 3HD1 LEU 28 3HD1 LEU 28 12.196 -3.611 3.605
219 1HD2 LEU 28 1HD2 LEU 28 10.556 -5.096 3.446
220 2HD2 LEU 28 2HD2 LEU 28 11.634 -6.248 4.237
221 3HD2 LEU 28 3HD2 LEU 28 10.780 -6.706 2.761
222 H THR 29 H THR 29 11.761 -6.658 -1.612
223 HA THR 29 HA THR 29 12.911 -5.042 -3.761
224 HB THR 29 HB THR 29 10.800 -7.207 -3.745
225 HG1 THR 29 1HG THR 29 12.661 -8.240 -3.711
226 1HG2 THR 29 1HG2 THR 29 10.095 -6.571 -5.734
227 2HG2 THR 29 2HG2 THR 29 11.733 -6.757 -6.360
228 3HG2 THR 29 3HG2 THR 29 11.206 -5.201 -5.721
229 H CYS 30 H CYS 30 12.231 -2.992 -3.701
230 HA CYS 30 HA CYS 30 9.408 -2.457 -3.108
231 1HB CYS 30 2HB CYS 30 11.112 -1.363 -1.689
232 2HB CYS 30 1HB CYS 30 11.736 -0.542 -3.113
233 HG CYS 30 HG CYS 30 9.247 0.241 -1.547
234 H THR 31 H THR 31 8.190 -2.312 -4.873
235 HA THR 31 HA THR 31 9.252 -0.795 -7.167
236 HB THR 31 HB THR 31 8.745 -3.332 -7.485
237 HG1 THR 31 1HG THR 31 7.566 -2.668 -9.552
238 1HG2 THR 31 1HG2 THR 31 6.641 -4.098 -7.570
239 2HG2 THR 31 2HG2 THR 31 5.988 -2.562 -8.131
240 3HG2 THR 31 3HG2 THR 31 6.345 -2.794 -6.420
241 H THR 32 H THR 32 7.704 0.575 -8.264
242 HA THR 32 HA THR 32 5.345 1.158 -6.631
243 HB THR 32 HB THR 32 5.678 3.500 -6.863
244 HG1 THR 32 1HG THR 32 6.583 4.075 -8.669
245 1HG2 THR 32 1HG2 THR 32 8.233 3.604 -6.150
246 2HG2 THR 32 2HG2 THR 32 7.958 1.887 -5.915
247 3HG2 THR 32 3HG2 THR 32 6.962 3.066 -5.060
248 H PHE 33 H PHE 33 3.614 2.213 -7.668
249 HA PHE 33 HA PHE 33 3.494 1.769 -10.565
250 1HB PHE 33 2HB PHE 33 1.285 1.220 -8.601
251 2HB PHE 33 1HB PHE 33 1.227 0.970 -10.328
252 HD1 PHE 33 1HD PHE 33 3.495 -0.005 -7.520
253 HD2 PHE 33 2HD PHE 33 1.359 -1.220 -10.987
254 HE1 PHE 33 1HE PHE 33 4.314 -2.296 -7.216
255 HE2 PHE 33 2HE PHE 33 2.165 -3.512 -10.690
256 HZ PHE 33 HZ PHE 33 3.640 -4.066 -8.806
257 H GLU 34 H GLU 34 1.403 2.853 -11.456
258 HA GLU 34 HA GLU 34 1.754 5.605 -11.238
259 1HB GLU 34 2HB GLU 34 -0.297 5.776 -12.615
260 2HB GLU 34 1HB GLU 34 0.867 4.612 -13.235
261 1HG GLU 34 2HG GLU 34 -1.096 3.457 -13.460
262 2HG GLU 34 1HG GLU 34 -0.534 2.897 -11.888
263 H ASN 35 H ASN 35 -0.643 3.561 -9.518
264 HA ASN 35 HA ASN 35 -1.003 5.540 -7.565
265 1HB ASN 35 2HB ASN 35 -2.326 6.249 -9.848
266 2HB ASN 35 1HB ASN 35 -3.596 5.467 -8.910
267 1HD2 ASN 35 1HD2 ASN 35 -1.570 8.204 -9.238
268 2HD2 ASN 35 2HD2 ASN 35 -2.196 9.111 -7.909
269 H GLY 36 H GLY 36 -2.525 2.812 -9.166
270 1HA GLY 36 2HA GLY 36 -2.744 1.268 -6.853
271 2HA GLY 36 1HA GLY 36 -4.250 2.147 -7.014
272 H ASN 37 H ASN 37 -4.658 2.139 -9.710
273 HA ASN 37 HA ASN 37 -5.794 -0.367 -10.142
274 1HB ASN 37 2HB ASN 37 -5.988 2.079 -11.338
275 2HB ASN 37 1HB ASN 37 -5.161 1.142 -12.579
276 1HD2 ASN 37 1HD2 ASN 37 -7.731 0.481 -10.221
277 2HD2 ASN 37 2HD2 ASN 37 -8.848 -0.172 -11.365
278 H GLU 38 H GLU 38 -2.650 0.880 -10.907
279 HA GLU 38 HA GLU 38 -1.885 -0.983 -12.860
280 1HB GLU 38 2HB GLU 38 -0.770 1.220 -11.979
281 2HB GLU 38 1HB GLU 38 0.090 0.116 -10.928
282 1HG GLU 38 2HG GLU 38 1.548 -0.193 -12.563
283 2HG GLU 38 1HG GLU 38 0.279 -1.011 -13.469
284 H VAL 39 H VAL 39 -1.201 -1.014 -9.309
285 HA VAL 39 HA VAL 39 0.191 -3.404 -9.219
286 HB VAL 39 HB VAL 39 -1.856 -2.638 -7.136
287 1HG1 VAL 39 1HG1 VAL 39 -1.021 -4.305 -5.924
288 2HG1 VAL 39 2HG1 VAL 39 0.627 -3.731 -6.173
289 3HG1 VAL 39 3HG1 VAL 39 -0.114 -4.815 -7.346
290 1HG2 VAL 39 1HG2 VAL 39 -0.604 -0.939 -6.422
291 2HG2 VAL 39 2HG2 VAL 39 0.176 -1.003 -8.003
292 3HG2 VAL 39 3HG2 VAL 39 0.897 -1.837 -6.627
293 H LEU 40 H LEU 40 -3.277 -2.893 -9.423
294 HA LEU 40 HA LEU 40 -4.184 -5.475 -8.926
295 1HB LEU 40 2HB LEU 40 -5.401 -3.742 -11.052
296 2HB LEU 40 1HB LEU 40 -6.201 -4.852 -9.958
297 HG LEU 40 HG LEU 40 -4.978 -2.201 -9.184
298 1HD1 LEU 40 1HD1 LEU 40 -6.929 -1.729 -10.389
299 2HD1 LEU 40 2HD1 LEU 40 -7.421 -1.695 -8.696
300 3HD1 LEU 40 3HD1 LEU 40 -7.789 -3.100 -9.696
301 1HD2 LEU 40 1HD2 LEU 40 -5.816 -4.510 -7.627
302 2HD2 LEU 40 2HD2 LEU 40 -6.672 -3.035 -7.172
303 3HD2 LEU 40 3HD2 LEU 40 -4.909 -3.079 -7.133
304 H ALA 41 H ALA 41 -3.201 -3.984 -11.999
305 HA ALA 41 HA ALA 41 -3.645 -6.256 -13.597
306 1HB ALA 41 1HB ALA 41 -3.283 -3.827 -14.324
307 2HB ALA 41 2HB ALA 41 -2.598 -5.103 -15.332
308 3HB ALA 41 3HB ALA 41 -1.562 -4.203 -14.225
309 H ALA 42 H ALA 42 -0.688 -5.002 -12.143
310 HA ALA 42 HA ALA 42 1.015 -7.053 -13.036
311 1HB ALA 42 1HB ALA 42 2.622 -6.245 -11.466
312 2HB ALA 42 2HB ALA 42 1.371 -5.466 -10.495
313 3HB ALA 42 3HB ALA 42 1.755 -4.848 -12.101
314 H LEU 43 H LEU 43 -1.074 -6.766 -10.240
315 HA LEU 43 HA LEU 43 -0.102 -8.890 -8.723
316 1HB LEU 43 2HB LEU 43 -2.769 -7.559 -8.941
317 2HB LEU 43 1HB LEU 43 -2.588 -8.994 -7.947
318 HG LEU 43 HG LEU 43 -0.845 -6.577 -7.576
319 1HD1 LEU 43 1HD1 LEU 43 -3.615 -6.665 -7.146
320 2HD1 LEU 43 2HD1 LEU 43 -2.472 -5.464 -6.549
321 3HD1 LEU 43 3HD1 LEU 43 -2.872 -6.866 -5.559
322 1HD2 LEU 43 1HD2 LEU 43 -1.439 -9.085 -6.067
323 2HD2 LEU 43 2HD2 LEU 43 -0.832 -7.651 -5.239
324 3HD2 LEU 43 3HD2 LEU 43 0.122 -8.399 -6.519
325 H ALA 44 H ALA 44 -1.932 -8.884 -11.623
326 HA ALA 44 HA ALA 44 -3.239 -11.340 -11.465
327 1HB ALA 44 1HB ALA 44 -2.139 -10.529 -14.090
328 2HB ALA 44 2HB ALA 44 -3.217 -9.395 -13.278
329 3HB ALA 44 3HB ALA 44 -3.772 -11.026 -13.647
330 H SER 45 H SER 45 0.113 -10.691 -11.718
331 HA SER 45 HA SER 45 0.597 -13.513 -12.280
332 1HB SER 45 2HB SER 45 1.256 -12.419 -14.272
333 2HB SER 45 1HB SER 45 2.051 -11.120 -13.381
334 HG SER 45 HG SER 45 3.554 -12.630 -14.212
335 H LYS 46 H LYS 46 0.786 -11.289 -9.908
336 HA LYS 46 HA LYS 46 2.631 -12.833 -8.398
337 1HB LYS 46 2HB LYS 46 3.925 -11.077 -9.989
338 2HB LYS 46 1HB LYS 46 3.633 -10.059 -8.586
339 1HG LYS 46 2HG LYS 46 4.584 -12.504 -7.593
340 2HG LYS 46 1HG LYS 46 5.606 -12.094 -8.971
341 1HD LYS 46 2HD LYS 46 5.560 -9.708 -7.819
342 2HD LYS 46 1HD LYS 46 5.234 -10.677 -6.382
343 1HE LYS 46 2HE LYS 46 7.487 -10.758 -6.269
344 2HE LYS 46 1HE LYS 46 7.278 -12.075 -7.424
345 1HZ LYS 46 1HZ LYS 46 7.515 -9.350 -8.468
346 2HZ LYS 46 2HZ LYS 46 8.034 -10.811 -9.142
347 3HZ LYS 46 3HZ LYS 46 8.917 -10.100 -7.887
348 H THR 47 H THR 47 2.912 -11.986 -6.189
349 HA THR 47 HA THR 47 0.965 -9.965 -5.436
350 HB THR 47 HB THR 47 1.124 -12.733 -4.240
351 HG1 THR 47 1HG THR 47 -1.037 -11.395 -5.492
352 1HG2 THR 47 1HG2 THR 47 0.697 -10.856 -2.570
353 2HG2 THR 47 2HG2 THR 47 -0.475 -12.171 -2.640
354 3HG2 THR 47 3HG2 THR 47 -0.836 -10.626 -3.409
355 HA PRO 48 HA PRO 48 4.691 -8.943 -3.099
356 1HB PRO 48 2HB PRO 48 3.862 -6.476 -2.306
357 2HB PRO 48 1HB PRO 48 4.546 -6.798 -3.903
358 1HG PRO 48 2HG PRO 48 1.699 -6.459 -3.094
359 2HG PRO 48 1HG PRO 48 2.519 -5.916 -4.561
360 1HD PRO 48 2HD PRO 48 0.916 -8.127 -4.444
361 2HD PRO 48 1HD PRO 48 2.229 -7.925 -5.612
362 H ASP 49 H ASP 49 5.152 -8.588 -0.845
363 HA ASP 49 HA ASP 49 3.280 -9.892 0.871
364 1HB ASP 49 2HB ASP 49 6.000 -8.685 1.265
365 2HB ASP 49 1HB ASP 49 5.049 -9.216 2.647
366 H VAL 50 H VAL 50 3.987 -6.587 0.126
367 HA VAL 50 HA VAL 50 1.883 -5.734 1.967
368 HB VAL 50 HB VAL 50 3.910 -5.431 3.278
369 1HG1 VAL 50 1HG1 VAL 50 5.857 -4.640 2.499
370 2HG1 VAL 50 2HG1 VAL 50 5.081 -3.385 1.535
371 3HG1 VAL 50 3HG1 VAL 50 5.175 -5.037 0.924
372 1HG2 VAL 50 1HG2 VAL 50 3.660 -3.152 3.886
373 2HG2 VAL 50 2HG2 VAL 50 2.076 -3.700 3.335
374 3HG2 VAL 50 3HG2 VAL 50 3.085 -2.714 2.277
375 H LEU 51 H LEU 51 1.275 -3.382 1.534
376 HA LEU 51 HA LEU 51 2.043 -2.364 -1.062
377 1HB LEU 51 2HB LEU 51 0.058 -4.088 -1.201
378 2HB LEU 51 1HB LEU 51 -0.887 -2.714 -0.658
379 HG LEU 51 HG LEU 51 -0.040 -1.421 -2.612
380 1HD1 LEU 51 1HD1 LEU 51 1.588 -2.172 -3.919
381 2HD1 LEU 51 2HD1 LEU 51 0.747 -3.698 -4.189
382 3HD1 LEU 51 3HD1 LEU 51 1.803 -3.509 -2.790
383 1HD2 LEU 51 1HD2 LEU 51 -1.215 -3.291 -4.249
384 2HD2 LEU 51 2HD2 LEU 51 -2.060 -2.071 -3.297
385 3HD2 LEU 51 3HD2 LEU 51 -1.851 -3.700 -2.656
386 H LEU 52 H LEU 52 1.856 -0.202 -1.221
387 HA LEU 52 HA LEU 52 0.504 1.228 0.978
388 1HB LEU 52 2HB LEU 52 3.171 1.158 0.595
389 2HB LEU 52 1HB LEU 52 2.760 2.509 -0.441
390 HG LEU 52 HG LEU 52 2.142 2.328 2.504
391 1HD1 LEU 52 1HD1 LEU 52 3.948 4.407 1.511
392 2HD1 LEU 52 2HD1 LEU 52 4.578 2.767 1.358
393 3HD1 LEU 52 3HD1 LEU 52 4.076 3.374 2.936
394 1HD2 LEU 52 1HD2 LEU 52 1.240 4.469 2.375
395 2HD2 LEU 52 2HD2 LEU 52 0.593 3.670 0.944
396 3HD2 LEU 52 3HD2 LEU 52 1.955 4.781 0.793
397 H SER 53 H SER 53 -1.171 2.413 0.268
398 HA SER 53 HA SER 53 -1.072 3.441 -2.494
399 1HB SER 53 2HB SER 53 -3.124 1.984 -1.048
400 2HB SER 53 1HB SER 53 -3.744 3.511 -1.673
401 HG SER 53 HG SER 53 -2.248 2.314 -3.553
402 H ASP 54 H ASP 54 -1.458 5.564 -2.886
403 HA ASP 54 HA ASP 54 -1.346 7.355 -0.623
404 1HB ASP 54 2HB ASP 54 -0.989 9.107 -2.227
405 2HB ASP 54 1HB ASP 54 -0.024 7.718 -2.711
406 H ILE 55 H ILE 55 -3.868 5.859 -2.158
407 HA ILE 55 HA ILE 55 -6.094 6.226 -2.378
408 HB ILE 55 HB ILE 55 -5.793 6.240 0.091
409 1HG1 ILE 55 2HG1 ILE 55 -8.048 8.075 -0.524
410 2HG1 ILE 55 1HG1 ILE 55 -8.000 6.497 -1.286
411 1HG2 ILE 55 1HG2 ILE 55 -5.715 9.198 -0.325
412 2HG2 ILE 55 2HG2 ILE 55 -4.625 8.181 0.618
413 3HG2 ILE 55 3HG2 ILE 55 -6.263 8.491 1.194
414 1HD1 ILE 55 1HD1 ILE 55 -8.563 7.228 1.493
415 2HD1 ILE 55 2HD1 ILE 55 -7.577 5.784 1.257
416 3HD1 ILE 55 3HD1 ILE 55 -9.170 5.894 0.516
417 H ARG 56 H ARG 56 -7.882 7.938 -2.557
418 HA ARG 56 HA ARG 56 -8.741 9.781 -3.554
419 1HB ARG 56 2HB ARG 56 -7.044 10.867 -1.864
420 2HB ARG 56 1HB ARG 56 -6.141 11.246 -3.325
421 1HG ARG 56 2HG ARG 56 -8.399 12.214 -4.159
422 2HG ARG 56 1HG ARG 56 -8.815 12.234 -2.444
423 1HD ARG 56 2HD ARG 56 -7.234 13.818 -1.938
424 2HD ARG 56 1HD ARG 56 -6.203 13.382 -3.303
425 HE ARG 56 HE ARG 56 -7.357 14.871 -4.607
426 1HH1 ARG 56 1HH1 ARG 56 -9.156 14.301 -1.671
427 2HH1 ARG 56 2HH1 ARG 56 -10.323 15.537 -1.997
428 1HH2 ARG 56 1HH2 ARG 56 -8.893 16.495 -5.040
429 2HH2 ARG 56 2HH2 ARG 56 -10.175 16.782 -3.910
430 H MET 57 H MET 57 -8.704 8.420 -5.465
431 HA MET 57 HA MET 57 -7.429 9.746 -7.647
432 1HB MET 57 2HB MET 57 -5.585 8.311 -6.772
433 2HB MET 57 1HB MET 57 -6.557 6.900 -7.137
434 1HG MET 57 2HG MET 57 -5.154 7.055 -8.959
435 2HG MET 57 1HG MET 57 -6.631 7.826 -9.532
436 1HE MET 57 1HE MET 57 -6.860 10.693 -9.432
437 2HE MET 57 2HE MET 57 -6.572 9.707 -10.865
438 3HE MET 57 3HE MET 57 -5.640 11.182 -10.608
439 HA PRO 58 HA PRO 58 -10.179 6.211 -9.486
440 1HB PRO 58 2HB PRO 58 -11.245 4.374 -7.848
441 2HB PRO 58 1HB PRO 58 -9.594 4.216 -8.463
442 1HG PRO 58 2HG PRO 58 -10.511 5.356 -5.832
443 2HG PRO 58 1HG PRO 58 -9.297 4.096 -6.119
444 1HD PRO 58 2HD PRO 58 -8.543 6.622 -5.735
445 2HD PRO 58 1HD PRO 58 -7.738 5.617 -6.954
446 H GLY 59 H GLY 59 -12.598 5.199 -8.862
447 1HA GLY 59 2HA GLY 59 -14.271 7.458 -8.696
448 2HA GLY 59 1HA GLY 59 -14.799 5.785 -8.592
449 H MET 60 H MET 60 -14.170 4.732 -6.387
450 HA MET 60 HA MET 60 -15.492 6.228 -4.349
451 1HB MET 60 2HB MET 60 -15.369 3.652 -4.673
452 2HB MET 60 1HB MET 60 -13.839 3.772 -3.815
453 1HG MET 60 2HG MET 60 -14.822 4.237 -1.831
454 2HG MET 60 1HG MET 60 -16.180 5.080 -2.574
455 1HE MET 60 1HE MET 60 -17.023 3.153 -0.135
456 2HE MET 60 2HE MET 60 -18.449 2.559 -0.987
457 3HE MET 60 3HE MET 60 -17.934 4.235 -1.189
458 H ASP 61 H ASP 61 -13.750 7.982 -4.867
459 HA ASP 61 HA ASP 61 -12.065 9.304 -4.138
460 1HB ASP 61 2HB ASP 61 -13.081 7.920 -1.792
461 2HB ASP 61 1HB ASP 61 -11.380 8.340 -1.615
462 H GLY 62 H GLY 62 -11.071 6.453 -2.323
463 1HA GLY 62 2HA GLY 62 -8.937 5.930 -4.244
464 2HA GLY 62 1HA GLY 62 -8.463 6.337 -2.615
465 H LEU 63 H LEU 63 -10.823 4.933 -1.489
466 HA LEU 63 HA LEU 63 -9.630 2.444 -1.039
467 1HB LEU 63 2HB LEU 63 -12.547 3.136 -0.683
468 2HB LEU 63 1HB LEU 63 -11.679 1.826 0.099
469 HG LEU 63 HG LEU 63 -10.175 3.870 0.927
470 1HD1 LEU 63 1HD1 LEU 63 -11.127 5.753 0.149
471 2HD1 LEU 63 2HD1 LEU 63 -12.075 5.577 1.625
472 3HD1 LEU 63 3HD1 LEU 63 -12.740 5.048 0.079
473 1HD2 LEU 63 1HD2 LEU 63 -12.753 2.928 2.156
474 2HD2 LEU 63 2HD2 LEU 63 -11.542 3.892 3.000
475 3HD2 LEU 63 3HD2 LEU 63 -11.138 2.275 2.425
476 H ALA 64 H ALA 64 -11.513 3.608 -3.659
477 HA ALA 64 HA ALA 64 -12.758 1.279 -4.558
478 1HB ALA 64 1HB ALA 64 -11.475 3.146 -6.495
479 2HB ALA 64 2HB ALA 64 -12.808 3.713 -5.492
480 3HB ALA 64 3HB ALA 64 -13.043 2.347 -6.584
481 H LEU 65 H LEU 65 -9.432 2.393 -4.829
482 HA LEU 65 HA LEU 65 -8.493 0.450 -6.635
483 1HB LEU 65 2HB LEU 65 -7.044 1.868 -4.389
484 2HB LEU 65 1HB LEU 65 -6.256 0.906 -5.627
485 HG LEU 65 HG LEU 65 -7.946 3.281 -6.335
486 1HD1 LEU 65 1HD1 LEU 65 -6.402 4.292 -4.920
487 2HD1 LEU 65 2HD1 LEU 65 -5.685 4.462 -6.522
488 3HD1 LEU 65 3HD1 LEU 65 -5.098 3.217 -5.420
489 1HD2 LEU 65 1HD2 LEU 65 -5.690 2.823 -8.015
490 2HD2 LEU 65 2HD2 LEU 65 -7.404 2.743 -8.413
491 3HD2 LEU 65 3HD2 LEU 65 -6.573 1.309 -7.812
492 H LEU 66 H LEU 66 -8.577 0.550 -3.091
493 HA LEU 66 HA LEU 66 -7.421 -1.887 -2.492
494 1HB LEU 66 2HB LEU 66 -9.564 -0.265 -1.169
495 2HB LEU 66 1HB LEU 66 -9.170 -1.850 -0.539
496 HG LEU 66 HG LEU 66 -6.890 -1.165 -0.100
497 1HD1 LEU 66 1HD1 LEU 66 -6.926 0.473 -2.096
498 2HD1 LEU 66 2HD1 LEU 66 -5.968 0.873 -0.679
499 3HD1 LEU 66 3HD1 LEU 66 -7.540 1.635 -0.922
500 1HD2 LEU 66 1HD2 LEU 66 -8.089 -0.709 1.788
501 2HD2 LEU 66 2HD2 LEU 66 -9.162 0.424 0.968
502 3HD2 LEU 66 3HD2 LEU 66 -7.525 0.916 1.400
503 H LYS 67 H LYS 67 -10.841 -1.176 -3.080
504 HA LYS 67 HA LYS 67 -11.990 -3.616 -2.796
505 1HB LYS 67 2HB LYS 67 -12.554 -1.629 -4.996
506 2HB LYS 67 1HB LYS 67 -13.635 -2.924 -4.497
507 1HG LYS 67 2HG LYS 67 -14.027 -1.918 -2.395
508 2HG LYS 67 1HG LYS 67 -12.706 -0.771 -2.619
509 1HD LYS 67 2HD LYS 67 -14.204 0.670 -3.420
510 2HD LYS 67 1HD LYS 67 -14.378 -0.391 -4.821
511 1HE LYS 67 2HE LYS 67 -15.937 -0.752 -2.273
512 2HE LYS 67 1HE LYS 67 -16.515 0.220 -3.627
513 1HZ LYS 67 1HZ LYS 67 -16.214 -2.681 -3.416
514 2HZ LYS 67 2HZ LYS 67 -15.958 -1.975 -4.931
515 3HZ LYS 67 3HZ LYS 67 -17.442 -1.773 -4.145
516 H GLN 68 H GLN 68 -10.399 -2.418 -5.729
517 HA GLN 68 HA GLN 68 -10.737 -4.798 -7.216
518 1HB GLN 68 2HB GLN 68 -8.606 -2.711 -7.625
519 2HB GLN 68 1HB GLN 68 -9.252 -3.825 -8.821
520 1HG GLN 68 2HG GLN 68 -10.887 -1.694 -7.473
521 2HG GLN 68 1HG GLN 68 -10.055 -1.471 -9.013
522 1HE2 GLN 68 1HE2 GLN 68 -12.899 -2.381 -7.554
523 2HE2 GLN 68 2HE2 GLN 68 -13.648 -3.177 -8.893
524 H ILE 69 H ILE 69 -8.383 -3.770 -4.880
525 HA ILE 69 HA ILE 69 -6.271 -5.483 -5.587
526 HB ILE 69 HB ILE 69 -6.980 -4.383 -2.867
527 1HG1 ILE 69 2HG1 ILE 69 -5.065 -3.372 -4.980
528 2HG1 ILE 69 1HG1 ILE 69 -6.605 -2.643 -4.548
529 1HG2 ILE 69 1HG2 ILE 69 -5.306 -5.566 -2.016
530 2HG2 ILE 69 2HG2 ILE 69 -4.191 -4.768 -3.130
531 3HG2 ILE 69 3HG2 ILE 69 -4.975 -6.274 -3.601
532 1HD1 ILE 69 1HD1 ILE 69 -5.488 -1.374 -3.120
533 2HD1 ILE 69 2HD1 ILE 69 -4.016 -2.322 -3.337
534 3HD1 ILE 69 3HD1 ILE 69 -5.221 -2.823 -2.150
535 H LYS 70 H LYS 70 -8.762 -5.863 -3.111
536 HA LYS 70 HA LYS 70 -8.035 -8.457 -2.339
537 1HB LYS 70 2HB LYS 70 -10.209 -8.580 -1.243
538 2HB LYS 70 1HB LYS 70 -9.404 -7.050 -0.932
539 1HG LYS 70 2HG LYS 70 -11.045 -6.755 -3.232
540 2HG LYS 70 1HG LYS 70 -11.996 -7.490 -1.940
541 1HD LYS 70 2HD LYS 70 -10.714 -5.590 -0.540
542 2HD LYS 70 1HD LYS 70 -10.784 -4.801 -2.113
543 1HE LYS 70 2HE LYS 70 -13.185 -5.039 -2.173
544 2HE LYS 70 1HE LYS 70 -13.167 -5.974 -0.681
545 1HZ LYS 70 1HZ LYS 70 -13.529 -4.019 0.301
546 2HZ LYS 70 2HZ LYS 70 -13.069 -3.126 -1.059
547 3HZ LYS 70 3HZ LYS 70 -11.892 -3.692 0.016
548 H GLN 71 H GLN 71 -9.975 -7.351 -4.981
549 HA GLN 71 HA GLN 71 -11.317 -9.778 -5.485
550 1HB GLN 71 2HB GLN 71 -10.818 -7.274 -6.955
551 2HB GLN 71 1HB GLN 71 -11.131 -8.685 -7.956
552 1HG GLN 71 2HG GLN 71 -13.276 -8.952 -7.152
553 2HG GLN 71 1HG GLN 71 -12.941 -8.054 -5.672
554 1HE2 GLN 71 1HE2 GLN 71 -12.270 -5.708 -6.125
555 2HE2 GLN 71 2HE2 GLN 71 -13.257 -4.857 -7.259
556 H ARG 72 H ARG 72 -8.067 -8.791 -6.035
557 HA ARG 72 HA ARG 72 -7.615 -11.225 -7.635
558 1HB ARG 72 2HB ARG 72 -6.965 -8.537 -8.231
559 2HB ARG 72 1HB ARG 72 -5.450 -9.380 -7.939
560 1HG ARG 72 2HG ARG 72 -5.672 -10.708 -9.766
561 2HG ARG 72 1HG ARG 72 -7.434 -10.717 -9.685
562 1HD ARG 72 2HD ARG 72 -7.091 -8.149 -10.268
563 2HD ARG 72 1HD ARG 72 -5.592 -8.766 -10.962
564 HE ARG 72 HE ARG 72 -8.177 -9.007 -12.069
565 1HH1 ARG 72 1HH1 ARG 72 -5.220 -10.816 -11.650
566 2HH1 ARG 72 2HH1 ARG 72 -5.484 -11.808 -13.043
567 1HH2 ARG 72 1HH2 ARG 72 -8.521 -10.308 -13.907
568 2HH2 ARG 72 2HH2 ARG 72 -7.352 -11.518 -14.327
569 H HIS 73 H HIS 73 -6.888 -9.738 -4.660
570 HA HIS 73 HA HIS 73 -4.454 -11.375 -4.373
571 1HB HIS 73 2HB HIS 73 -3.614 -9.855 -2.841
572 2HB HIS 73 1HB HIS 73 -4.495 -8.799 -3.939
573 HD1 HIS 73 1HD HIS 73 -5.225 -10.624 -0.682
574 HD2 HIS 73 2HD HIS 73 -6.127 -7.106 -2.619
575 HE1 HIS 73 1HE HIS 73 -6.621 -9.313 0.939
576 HE2 HIS 73 2HE HIS 73 -7.143 -7.164 -0.256
577 HA PRO 74 HA PRO 74 -6.451 -13.767 -1.208
578 1HB PRO 74 2HB PRO 74 -4.293 -14.755 0.076
579 2HB PRO 74 1HB PRO 74 -4.722 -15.245 -1.564
580 1HG PRO 74 2HG PRO 74 -2.521 -13.525 -0.634
581 2HG PRO 74 1HG PRO 74 -2.661 -14.462 -2.127
582 1HD PRO 74 2HD PRO 74 -3.102 -11.655 -1.761
583 2HD PRO 74 1HD PRO 74 -3.284 -12.602 -3.249
584 H MET 75 H MET 75 -3.600 -12.154 0.249
585 HA MET 75 HA MET 75 -5.281 -10.766 2.152
586 1HB MET 75 2HB MET 75 -3.355 -12.931 2.950
587 2HB MET 75 1HB MET 75 -3.757 -11.623 4.049
588 1HG MET 75 2HG MET 75 -5.961 -13.175 2.793
589 2HG MET 75 1HG MET 75 -5.051 -13.888 4.122
590 1HE MET 75 1HE MET 75 -8.241 -12.671 3.554
591 2HE MET 75 2HE MET 75 -8.684 -12.261 5.211
592 3HE MET 75 3HE MET 75 -7.917 -13.811 4.859
593 H LEU 76 H LEU 76 -3.903 -9.532 0.211
594 HA LEU 76 HA LEU 76 -1.240 -8.842 0.928
595 1HB LEU 76 2HB LEU 76 -2.795 -8.676 -1.331
596 2HB LEU 76 1HB LEU 76 -2.629 -7.000 -0.846
597 HG LEU 76 HG LEU 76 -0.276 -8.842 -1.188
598 1HD1 LEU 76 1HD1 LEU 76 -0.516 -8.708 -3.379
599 2HD1 LEU 76 2HD1 LEU 76 -0.417 -6.950 -3.275
600 3HD1 LEU 76 3HD1 LEU 76 -1.985 -7.753 -3.190
601 1HD2 LEU 76 1HD2 LEU 76 0.548 -6.291 -1.658
602 2HD2 LEU 76 2HD2 LEU 76 0.686 -7.125 -0.112
603 3HD2 LEU 76 3HD2 LEU 76 -0.673 -6.042 -0.413
604 HA PRO 77 HA PRO 77 -2.374 -5.681 3.907
605 1HB PRO 77 2HB PRO 77 0.450 -4.887 3.692
606 2HB PRO 77 1HB PRO 77 -0.456 -5.431 5.106
607 1HG PRO 77 2HG PRO 77 1.406 -6.972 3.947
608 2HG PRO 77 1HG PRO 77 -0.058 -7.657 4.672
609 1HD PRO 77 2HD PRO 77 0.570 -7.165 1.786
610 2HD PRO 77 1HD PRO 77 -0.245 -8.549 2.540
611 H VAL 78 H VAL 78 -3.004 -3.637 3.653
612 HA VAL 78 HA VAL 78 -1.920 -2.073 1.407
613 HB VAL 78 HB VAL 78 -4.782 -1.793 2.276
614 1HG1 VAL 78 1HG1 VAL 78 -4.252 0.005 0.957
615 2HG1 VAL 78 2HG1 VAL 78 -4.838 -1.131 -0.257
616 3HG1 VAL 78 3HG1 VAL 78 -3.104 -0.907 -0.021
617 1HG2 VAL 78 1HG2 VAL 78 -3.912 -3.541 -0.016
618 2HG2 VAL 78 2HG2 VAL 78 -5.533 -3.343 0.650
619 3HG2 VAL 78 3HG2 VAL 78 -4.291 -4.178 1.584
620 H ILE 79 H ILE 79 -0.995 -0.284 2.092
621 HA ILE 79 HA ILE 79 -1.874 0.880 4.647
622 HB ILE 79 HB ILE 79 0.756 1.402 3.284
623 1HG1 ILE 79 2HG1 ILE 79 1.060 -0.280 5.572
624 2HG1 ILE 79 1HG1 ILE 79 -0.120 -1.028 4.503
625 1HG2 ILE 79 1HG2 ILE 79 1.194 2.743 5.003
626 2HG2 ILE 79 2HG2 ILE 79 0.653 1.537 6.172
627 3HG2 ILE 79 3HG2 ILE 79 -0.519 2.624 5.419
628 1HD1 ILE 79 1HD1 ILE 79 2.204 -0.043 3.077
629 2HD1 ILE 79 2HD1 ILE 79 1.440 -1.632 3.049
630 3HD1 ILE 79 3HD1 ILE 79 2.604 -1.236 4.312
631 H ILE 80 H ILE 80 -3.213 2.515 4.329
632 HA ILE 80 HA ILE 80 -2.852 4.226 1.987
633 HB ILE 80 HB ILE 80 -5.219 4.137 3.862
634 1HG1 ILE 80 2HG1 ILE 80 -4.908 1.972 2.776
635 2HG1 ILE 80 1HG1 ILE 80 -6.279 2.807 2.054
636 1HG2 ILE 80 1HG2 ILE 80 -4.592 6.116 2.185
637 2HG2 ILE 80 2HG2 ILE 80 -6.244 5.611 2.476
638 3HG2 ILE 80 3HG2 ILE 80 -5.385 5.032 1.054
639 1HD1 ILE 80 1HD1 ILE 80 -4.135 3.599 0.512
640 2HD1 ILE 80 2HD1 ILE 80 -5.347 2.391 0.094
641 3HD1 ILE 80 3HD1 ILE 80 -3.829 1.895 0.839
642 H MET 81 H MET 81 -2.791 6.464 2.097
643 HA MET 81 HA MET 81 -1.484 7.501 4.442
644 1HB MET 81 2HB MET 81 -1.069 9.473 3.106
645 2HB MET 81 1HB MET 81 -0.724 8.036 2.157
646 1HG MET 81 2HG MET 81 -2.594 8.308 0.818
647 2HG MET 81 1HG MET 81 -3.382 9.387 1.963
648 1HE MET 81 1HE MET 81 -1.767 11.258 2.898
649 2HE MET 81 2HE MET 81 -2.084 12.592 1.788
650 3HE MET 81 3HE MET 81 -0.443 11.974 1.977
651 H THR 82 H THR 82 -4.646 7.936 2.901
652 HA THR 82 HA THR 82 -5.574 9.275 5.325
653 HB THR 82 HB THR 82 -6.135 10.478 2.611
654 HG1 THR 82 1HG THR 82 -3.983 10.815 2.965
655 1HG2 THR 82 1HG2 THR 82 -7.373 12.019 3.620
656 2HG2 THR 82 2HG2 THR 82 -6.217 12.214 4.938
657 3HG2 THR 82 3HG2 THR 82 -7.412 10.921 4.997
658 H ALA 83 H ALA 83 -7.861 9.193 5.626
659 HA ALA 83 HA ALA 83 -9.203 7.237 3.880
660 1HB ALA 83 1HB ALA 83 -10.033 6.120 5.648
661 2HB ALA 83 2HB ALA 83 -10.214 7.578 6.625
662 3HB ALA 83 3HB ALA 83 -8.633 6.820 6.463
663 H HIS 84 H HIS 84 -9.139 10.391 4.243
664 HA HIS 84 HA HIS 84 -10.667 12.114 4.511
665 1HB HIS 84 2HB HIS 84 -12.303 11.709 2.358
666 2HB HIS 84 1HB HIS 84 -10.692 12.406 2.303
667 HD1 HIS 84 1HD HIS 84 -11.812 8.773 2.485
668 HD2 HIS 84 2HD HIS 84 -9.514 11.320 0.148
669 HE1 HIS 84 1HE HIS 84 -10.806 7.327 0.702
670 HE2 HIS 84 2HE HIS 84 -9.639 8.937 -0.836
671 H SER 85 H SER 85 -13.160 10.079 3.051
672 HA SER 85 HA SER 85 -14.562 9.890 5.596
673 1HB SER 85 2HB SER 85 -15.567 11.525 3.269
674 2HB SER 85 1HB SER 85 -16.622 10.947 4.559
675 HG SER 85 HG SER 85 -15.967 12.947 5.179
676 H ASP 86 H ASP 86 -13.538 7.845 3.940
677 HA ASP 86 HA ASP 86 -16.051 6.480 3.300
678 1HB ASP 86 2HB ASP 86 -14.247 7.366 1.336
679 2HB ASP 86 1HB ASP 86 -13.977 5.635 1.481
680 H LEU 87 H LEU 87 -14.434 6.327 5.604
681 HA LEU 87 HA LEU 87 -12.550 4.337 5.736
682 1HB LEU 87 2HB LEU 87 -14.449 5.550 7.624
683 2HB LEU 87 1HB LEU 87 -13.860 3.964 8.087
684 HG LEU 87 HG LEU 87 -12.171 6.400 7.516
685 1HD1 LEU 87 1HD1 LEU 87 -13.452 6.300 9.685
686 2HD1 LEU 87 2HD1 LEU 87 -11.700 6.448 9.831
687 3HD1 LEU 87 3HD1 LEU 87 -12.479 4.887 10.095
688 1HD2 LEU 87 1HD2 LEU 87 -10.836 4.645 6.795
689 2HD2 LEU 87 2HD2 LEU 87 -11.471 3.530 8.006
690 3HD2 LEU 87 3HD2 LEU 87 -10.372 4.822 8.487
691 H ASP 88 H ASP 88 -15.901 3.977 5.081
692 HA ASP 88 HA ASP 88 -16.569 1.505 6.035
693 1HB ASP 88 2HB ASP 88 -17.212 2.702 3.336
694 2HB ASP 88 1HB ASP 88 -17.999 1.266 3.987
695 H ALA 89 H ALA 89 -15.098 2.050 2.811
696 HA ALA 89 HA ALA 89 -14.609 -0.717 2.404
697 1HB ALA 89 1HB ALA 89 -13.219 0.047 0.481
698 2HB ALA 89 2HB ALA 89 -13.506 1.709 0.995
699 3HB ALA 89 3HB ALA 89 -14.858 0.700 0.487
700 H ALA 90 H ALA 90 -12.983 1.745 4.122
701 HA ALA 90 HA ALA 90 -10.330 0.754 3.984
702 1HB ALA 90 1HB ALA 90 -11.199 3.073 4.745
703 2HB ALA 90 2HB ALA 90 -9.779 2.382 5.533
704 3HB ALA 90 3HB ALA 90 -11.353 2.306 6.324
705 H VAL 91 H VAL 91 -12.925 0.338 6.411
706 HA VAL 91 HA VAL 91 -11.339 -1.242 8.128
707 HB VAL 91 HB VAL 91 -14.324 -1.480 8.033
708 1HG1 VAL 91 1HG1 VAL 91 -13.488 -1.392 10.641
709 2HG1 VAL 91 2HG1 VAL 91 -12.140 -2.210 9.844
710 3HG1 VAL 91 3HG1 VAL 91 -13.776 -2.866 9.713
711 1HG2 VAL 91 1HG2 VAL 91 -14.590 0.670 8.560
712 2HG2 VAL 91 2HG2 VAL 91 -12.856 0.935 8.372
713 3HG2 VAL 91 3HG2 VAL 91 -13.513 0.472 9.941
714 H SER 92 H SER 92 -13.861 -2.198 5.793
715 HA SER 92 HA SER 92 -13.520 -4.966 6.140
716 1HB SER 92 2HB SER 92 -14.381 -3.549 3.608
717 2HB SER 92 1HB SER 92 -14.662 -5.246 4.010
718 HG SER 92 HG SER 92 -15.676 -3.002 5.431
719 H ALA 93 H ALA 93 -11.709 -2.587 4.403
720 HA ALA 93 HA ALA 93 -10.325 -4.233 2.617
721 1HB ALA 93 1HB ALA 93 -10.115 -1.962 2.203
722 2HB ALA 93 2HB ALA 93 -8.540 -2.401 2.852
723 3HB ALA 93 3HB ALA 93 -9.723 -1.605 3.883
724 H TYR 94 H TYR 94 -9.701 -3.337 5.951
725 HA TYR 94 HA TYR 94 -7.212 -4.682 6.177
726 1HB TYR 94 2HB TYR 94 -9.041 -4.314 8.528
727 2HB TYR 94 1HB TYR 94 -7.287 -4.248 8.480
728 HD1 TYR 94 1HD TYR 94 -6.651 -2.271 6.500
729 HD2 TYR 94 2HD TYR 94 -9.880 -2.315 9.280
730 HE1 TYR 94 1HE TYR 94 -6.741 0.184 6.433
731 HE2 TYR 94 2HE TYR 94 -9.970 0.138 9.215
732 HH TYR 94 HH TYR 94 -9.249 1.958 7.396
733 H GLN 95 H GLN 95 -10.505 -5.625 6.368
734 HA GLN 95 HA GLN 95 -10.263 -8.003 7.831
735 1HB GLN 95 2HB GLN 95 -12.460 -7.403 7.597
736 2HB GLN 95 1HB GLN 95 -12.258 -6.873 5.941
737 1HG GLN 95 2HG GLN 95 -12.062 -9.777 6.528
738 2HG GLN 95 1HG GLN 95 -13.650 -9.013 6.548
739 1HE2 GLN 95 1HE2 GLN 95 -13.556 -7.234 4.529
740 2HE2 GLN 95 2HE2 GLN 95 -13.283 -8.036 3.023
741 H GLN 96 H GLN 96 -9.878 -7.381 4.362
742 HA GLN 96 HA GLN 96 -9.161 -10.171 3.998
743 1HB GLN 96 2HB GLN 96 -9.395 -9.807 1.630
744 2HB GLN 96 1HB GLN 96 -10.823 -9.215 2.467
745 1HG GLN 96 2HG GLN 96 -8.928 -7.089 2.212
746 2HG GLN 96 1HG GLN 96 -9.187 -7.849 0.642
747 1HE2 GLN 96 1HE2 GLN 96 -11.478 -8.286 0.121
748 2HE2 GLN 96 2HE2 GLN 96 -12.633 -7.060 0.500
749 H GLY 97 H GLY 97 -7.632 -7.064 4.213
750 1HA GLY 97 2HA GLY 97 -5.065 -8.257 4.077
751 2HA GLY 97 1HA GLY 97 -5.429 -7.485 2.547
752 H ALA 98 H ALA 98 -6.475 -5.110 3.065
753 HA ALA 98 HA ALA 98 -4.583 -3.349 3.495
754 1HB ALA 98 1HB ALA 98 -7.356 -3.107 4.581
755 2HB ALA 98 2HB ALA 98 -6.730 -2.526 3.043
756 3HB ALA 98 3HB ALA 98 -6.211 -1.773 4.550
757 H PHE 99 H PHE 99 -3.346 -2.401 5.050
758 HA PHE 99 HA PHE 99 -3.114 -3.846 7.522
759 1HB PHE 99 2HB PHE 99 -1.125 -3.179 6.188
760 2HB PHE 99 1HB PHE 99 -1.494 -1.495 6.540
761 HD1 PHE 99 1HD PHE 99 -1.384 -4.606 8.597
762 HD2 PHE 99 2HD PHE 99 -0.004 -0.618 8.040
763 HE1 PHE 99 1HE PHE 99 -0.090 -4.769 10.682
764 HE2 PHE 99 2HE PHE 99 1.298 -0.779 10.121
765 HZ PHE 99 HZ PHE 99 1.255 -2.853 11.446
766 H ASP 100 H ASP 100 -3.563 -0.427 6.617
767 HA ASP 100 HA ASP 100 -5.512 0.086 8.563
768 1HB ASP 100 2HB ASP 100 -4.331 1.250 10.284
769 2HB ASP 100 1HB ASP 100 -3.520 -0.299 10.076
770 H TYR 101 H TYR 101 -4.993 2.758 9.178
771 HA TYR 101 HA TYR 101 -4.514 4.048 6.590
772 1HB TYR 101 2HB TYR 101 -7.071 3.976 8.083
773 2HB TYR 101 1HB TYR 101 -6.586 5.559 7.484
774 HD1 TYR 101 1HD TYR 101 -6.957 2.038 6.287
775 HD2 TYR 101 2HD TYR 101 -7.182 6.179 5.379
776 HE1 TYR 101 1HE TYR 101 -7.843 1.493 4.064
777 HE2 TYR 101 2HE TYR 101 -8.068 5.651 3.157
778 HH TYR 101 HH TYR 101 -8.804 4.048 1.806
779 H LEU 102 H LEU 102 -3.990 6.265 6.711
780 HA LEU 102 HA LEU 102 -2.891 7.039 9.315
781 1HB LEU 102 2HB LEU 102 -2.017 7.320 6.554
782 2HB LEU 102 1HB LEU 102 -1.933 8.833 7.437
783 HG LEU 102 HG LEU 102 -0.478 7.837 9.101
784 1HD1 LEU 102 1HD1 LEU 102 -1.569 5.541 8.837
785 2HD1 LEU 102 2HD1 LEU 102 0.169 5.603 9.131
786 3HD1 LEU 102 3HD1 LEU 102 -0.439 5.314 7.502
787 1HD2 LEU 102 1HD2 LEU 102 0.778 8.724 7.375
788 2HD2 LEU 102 2HD2 LEU 102 0.250 7.500 6.224
789 3HD2 LEU 102 3HD2 LEU 102 1.396 7.078 7.495
790 HA PRO 103 HA PRO 103 -6.287 9.976 9.524
791 1HB PRO 103 2HB PRO 103 -4.801 11.038 11.835
792 2HB PRO 103 1HB PRO 103 -6.433 10.372 11.761
793 1HG PRO 103 2HG PRO 103 -4.410 9.042 12.927
794 2HG PRO 103 1HG PRO 103 -5.707 8.204 12.056
795 1HD PRO 103 2HD PRO 103 -2.915 8.818 11.173
796 2HD PRO 103 1HD PRO 103 -3.889 7.356 10.909
797 H LYS 104 H LYS 104 -3.257 11.394 10.722
798 HA LYS 104 HA LYS 104 -3.568 13.533 8.729
799 1HB LYS 104 2HB LYS 104 -2.469 13.793 11.531
800 2HB LYS 104 1HB LYS 104 -2.578 15.089 10.348
801 1HG LYS 104 2HG LYS 104 -5.151 14.060 10.484
802 2HG LYS 104 1HG LYS 104 -4.581 14.059 12.153
803 1HD LYS 104 2HD LYS 104 -4.490 16.324 12.262
804 2HD LYS 104 1HD LYS 104 -4.015 16.490 10.571
805 1HE LYS 104 2HE LYS 104 -6.146 17.349 10.512
806 2HE LYS 104 1HE LYS 104 -6.455 15.659 10.118
807 1HZ LYS 104 1HZ LYS 104 -6.693 16.836 12.833
808 2HZ LYS 104 2HZ LYS 104 -7.070 15.248 12.394
809 3HZ LYS 104 3HZ LYS 104 -7.990 16.532 11.793
810 HA PRO 105 HA PRO 105 1.264 13.051 9.426
811 1HB PRO 105 2HB PRO 105 1.899 10.539 10.444
812 2HB PRO 105 1HB PRO 105 1.941 12.054 11.352
813 1HG PRO 105 2HG PRO 105 -0.187 9.962 11.249
814 2HG PRO 105 1HG PRO 105 0.392 10.908 12.631
815 1HD PRO 105 2HD PRO 105 -1.907 11.508 11.431
816 2HD PRO 105 1HD PRO 105 -0.831 12.788 12.014
817 H PHE 106 H PHE 106 2.763 11.816 8.093
818 HA PHE 106 HA PHE 106 2.027 9.473 6.720
819 1HB PHE 106 2HB PHE 106 0.383 10.923 5.622
820 2HB PHE 106 1HB PHE 106 1.664 12.030 5.134
821 HD1 PHE 106 1HD PHE 106 1.113 8.343 4.959
822 HD2 PHE 106 2HD PHE 106 2.159 11.908 2.895
823 HE1 PHE 106 1HE PHE 106 1.420 7.045 2.896
824 HE2 PHE 106 2HE PHE 106 2.469 10.618 0.822
825 HZ PHE 106 HZ PHE 106 2.099 8.182 0.821
826 H ASP 107 H ASP 107 3.465 11.782 4.598
827 HA ASP 107 HA ASP 107 5.545 11.747 3.652
828 1HB ASP 107 2HB ASP 107 7.328 12.412 5.232
829 2HB ASP 107 1HB ASP 107 5.852 13.344 5.455
830 H ILE 108 H ILE 108 7.943 10.774 4.049
831 HA ILE 108 HA ILE 108 7.605 7.989 3.746
832 HB ILE 108 HB ILE 108 9.691 9.854 3.290
833 1HG1 ILE 108 2HG1 ILE 108 10.430 8.141 1.713
834 2HG1 ILE 108 1HG1 ILE 108 9.397 6.956 2.499
835 1HG2 ILE 108 1HG2 ILE 108 11.618 8.358 3.805
836 2HG2 ILE 108 2HG2 ILE 108 10.520 7.377 4.774
837 3HG2 ILE 108 3HG2 ILE 108 10.838 9.051 5.226
838 1HD1 ILE 108 1HD1 ILE 108 7.449 7.944 1.689
839 2HD1 ILE 108 2HD1 ILE 108 8.571 8.013 0.330
840 3HD1 ILE 108 3HD1 ILE 108 8.268 9.457 1.298
841 H ASP 109 H ASP 109 8.923 9.901 6.377
842 HA ASP 109 HA ASP 109 9.939 7.911 7.976
843 1HB ASP 109 2HB ASP 109 8.480 10.415 8.825
844 2HB ASP 109 1HB ASP 109 9.358 9.374 9.935
845 H GLU 110 H GLU 110 6.584 9.168 8.244
846 HA GLU 110 HA GLU 110 5.827 7.023 9.953
847 1HB GLU 110 2HB GLU 110 4.116 9.046 8.513
848 2HB GLU 110 1HB GLU 110 3.524 7.909 9.708
849 1HG GLU 110 2HG GLU 110 5.764 9.721 10.441
850 2HG GLU 110 1HG GLU 110 4.124 10.367 10.361
851 H ALA 111 H ALA 111 5.657 7.619 6.533
852 HA ALA 111 HA ALA 111 3.798 5.579 5.903
853 1HB ALA 111 1HB ALA 111 5.915 6.938 4.251
854 2HB ALA 111 2HB ALA 111 4.177 7.250 4.266
855 3HB ALA 111 3HB ALA 111 4.797 5.739 3.598
856 H VAL 112 H VAL 112 7.337 5.640 5.450
857 HA VAL 112 HA VAL 112 7.613 2.912 4.898
858 HB VAL 112 HB VAL 112 9.662 4.693 6.215
859 1HG1 VAL 112 1HG1 VAL 112 9.699 1.952 5.721
860 2HG1 VAL 112 2HG1 VAL 112 11.080 2.981 6.110
861 3HG1 VAL 112 3HG1 VAL 112 10.664 2.662 4.425
862 1HG2 VAL 112 1HG2 VAL 112 8.656 4.527 3.449
863 2HG2 VAL 112 2HG2 VAL 112 10.411 4.559 3.623
864 3HG2 VAL 112 3HG2 VAL 112 9.433 5.863 4.295
865 H ALA 113 H ALA 113 7.392 4.663 7.874
866 HA ALA 113 HA ALA 113 8.308 2.665 9.640
867 1HB ALA 113 1HB ALA 113 8.062 4.950 10.374
868 2HB ALA 113 2HB ALA 113 7.009 3.919 11.342
869 3HB ALA 113 3HB ALA 113 6.331 4.899 10.038
870 H LEU 114 H LEU 114 5.129 3.544 8.421
871 HA LEU 114 HA LEU 114 3.744 1.491 9.812
872 1HB LEU 114 2HB LEU 114 2.771 3.682 9.063
873 2HB LEU 114 1HB LEU 114 2.800 3.060 7.423
874 HG LEU 114 HG LEU 114 1.309 1.188 8.191
875 1HD1 LEU 114 1HD1 LEU 114 0.010 1.879 10.329
876 2HD1 LEU 114 2HD1 LEU 114 1.484 2.770 10.715
877 3HD1 LEU 114 3HD1 LEU 114 1.543 1.026 10.471
878 1HD2 LEU 114 1HD2 LEU 114 -0.442 2.398 7.516
879 2HD2 LEU 114 2HD2 LEU 114 0.689 3.745 7.403
880 3HD2 LEU 114 3HD2 LEU 114 -0.288 3.528 8.857
881 H VAL 115 H VAL 115 5.391 1.657 6.773
882 HA VAL 115 HA VAL 115 3.994 -0.588 5.645
883 HB VAL 115 HB VAL 115 5.117 1.274 4.298
884 1HG1 VAL 115 1HG1 VAL 115 7.310 1.029 5.495
885 2HG1 VAL 115 2HG1 VAL 115 7.409 1.072 3.740
886 3HG1 VAL 115 3HG1 VAL 115 7.553 -0.464 4.596
887 1HG2 VAL 115 1HG2 VAL 115 4.384 -1.255 3.650
888 2HG2 VAL 115 2HG2 VAL 115 6.067 -1.245 3.125
889 3HG2 VAL 115 3HG2 VAL 115 4.937 -0.049 2.490
890 H GLU 116 H GLU 116 7.168 -0.089 7.133
891 HA GLU 116 HA GLU 116 8.091 -2.728 6.744
892 1HB GLU 116 2HB GLU 116 8.881 -0.576 8.700
893 2HB GLU 116 1HB GLU 116 9.685 -2.138 8.636
894 1HG GLU 116 2HG GLU 116 10.265 -1.718 6.282
895 2HG GLU 116 1HG GLU 116 9.517 -0.126 6.403
896 H ARG 117 H ARG 117 6.413 -1.183 9.473
897 HA ARG 117 HA ARG 117 6.523 -3.416 11.176
898 1HB ARG 117 2HB ARG 117 4.813 -2.336 12.496
899 2HB ARG 117 1HB ARG 117 5.981 -1.139 11.960
900 1HG ARG 117 2HG ARG 117 4.367 -0.580 10.102
901 2HG ARG 117 1HG ARG 117 3.189 -1.587 10.948
902 1HD ARG 117 2HD ARG 117 4.591 0.849 12.044
903 2HD ARG 117 1HD ARG 117 2.904 0.747 11.562
904 HE ARG 117 HE ARG 117 4.104 -0.343 13.977
905 1HH1 ARG 117 1HH1 ARG 117 1.273 -0.099 11.945
906 2HH1 ARG 117 2HH1 ARG 117 0.184 -0.596 13.192
907 1HH2 ARG 117 1HH2 ARG 117 2.668 -1.001 15.612
908 2HH2 ARG 117 2HH2 ARG 117 0.973 -1.108 15.271
909 H ALA 118 H ALA 118 4.565 -2.715 8.437
910 HA ALA 118 HA ALA 118 2.413 -4.472 9.038
911 1HB ALA 118 1HB ALA 118 1.769 -4.190 6.713
912 2HB ALA 118 2HB ALA 118 3.331 -3.456 6.351
913 3HB ALA 118 3HB ALA 118 2.198 -2.633 7.424
914 H ILE 119 H ILE 119 5.346 -4.762 7.052
915 HA ILE 119 HA ILE 119 4.862 -7.426 6.231
916 HB ILE 119 HB ILE 119 7.551 -6.089 6.441
917 1HG1 ILE 119 2HG1 ILE 119 6.110 -6.062 3.860
918 2HG1 ILE 119 1HG1 ILE 119 5.480 -4.982 5.100
919 1HG2 ILE 119 1HG2 ILE 119 7.998 -7.536 4.422
920 2HG2 ILE 119 2HG2 ILE 119 6.489 -8.371 4.797
921 3HG2 ILE 119 3HG2 ILE 119 7.817 -8.385 5.959
922 1HD1 ILE 119 1HD1 ILE 119 7.089 -3.850 3.681
923 2HD1 ILE 119 2HD1 ILE 119 8.311 -5.051 4.097
924 3HD1 ILE 119 3HD1 ILE 119 7.677 -3.969 5.337
925 H SER 120 H SER 120 6.415 -5.979 8.974
926 HA SER 120 HA SER 120 7.800 -8.241 9.921
927 1HB SER 120 2HB SER 120 8.294 -5.955 10.692
928 2HB SER 120 1HB SER 120 6.718 -5.884 11.481
929 HG SER 120 HG SER 120 8.120 -6.493 13.046
930 H HIS 121 H HIS 121 4.556 -6.987 10.558
931 HA HIS 121 HA HIS 121 3.861 -8.809 12.577
932 1HB HIS 121 2HB HIS 121 2.303 -7.101 10.674
933 2HB HIS 121 1HB HIS 121 1.460 -8.278 11.679
934 HD1 HIS 121 1HD HIS 121 4.352 -6.035 12.681
935 HD2 HIS 121 2HD HIS 121 0.346 -6.677 13.583
936 HE1 HIS 121 1HE HIS 121 3.855 -4.536 14.638
937 HE2 HIS 121 2HE HIS 121 1.437 -4.973 15.196
938 H TYR 122 H TYR 122 3.928 -9.075 9.126
939 HA TYR 122 HA TYR 122 2.403 -11.503 9.048
940 1HB TYR 122 2HB TYR 122 3.322 -9.582 7.149
941 2HB TYR 122 1HB TYR 122 3.867 -11.178 6.646
942 HD1 TYR 122 1HD TYR 122 1.479 -8.981 5.894
943 HD2 TYR 122 2HD TYR 122 1.753 -12.960 7.373
944 HE1 TYR 122 1HE TYR 122 -0.765 -9.460 5.008
945 HE2 TYR 122 2HE TYR 122 -0.489 -13.449 6.491
946 HH TYR 122 HH TYR 122 -2.576 -12.070 5.914
947 H GLN 123 H GLN 123 5.792 -10.608 8.492
948 HA GLN 123 HA GLN 123 6.651 -13.324 8.306
949 1HB GLN 123 2HB GLN 123 7.746 -10.768 7.752
950 2HB GLN 123 1HB GLN 123 8.831 -11.574 8.874
951 1HG GLN 123 2HG GLN 123 9.719 -12.541 7.085
952 2HG GLN 123 1HG GLN 123 8.270 -13.547 7.056
953 1HE2 GLN 123 1HE2 GLN 123 10.200 -11.860 5.135
954 2HE2 GLN 123 2HE2 GLN 123 9.081 -11.324 3.933
955 H GLU 124 H GLU 124 8.554 -14.033 9.750
956 HA GLU 124 HA GLU 124 8.283 -13.123 12.509
957 1HB GLU 124 2HB GLU 124 7.545 -15.843 11.507
958 2HB GLU 124 1HB GLU 124 8.252 -15.685 13.111
959 1HG GLU 124 2HG GLU 124 5.938 -13.967 12.358
960 2HG GLU 124 1HG GLU 124 5.666 -15.653 12.787
Start of MODEL 11
1 1H MET 1 1HT MET 1 11.525 -17.368 4.895
2 2H MET 1 2HT MET 1 10.385 -16.335 4.134
3 3H MET 1 3HT MET 1 12.066 -16.014 3.994
4 HA MET 1 HA MET 1 12.239 -18.259 2.932
5 1HB MET 1 2HB MET 1 9.302 -17.843 3.204
6 2HB MET 1 1HB MET 1 9.881 -18.587 1.720
7 1HG MET 1 2HG MET 1 10.404 -20.516 2.733
8 2HG MET 1 1HG MET 1 10.996 -19.714 4.187
9 1HE MET 1 1HE MET 1 9.832 -21.820 5.590
10 2HE MET 1 2HE MET 1 8.506 -21.105 6.508
11 3HE MET 1 3HE MET 1 10.010 -20.209 6.285
12 H GLN 2 H GLN 2 10.304 -15.364 2.352
13 HA GLN 2 HA GLN 2 11.318 -15.225 -0.392
14 1HB GLN 2 2HB GLN 2 8.981 -14.058 1.042
15 2HB GLN 2 1HB GLN 2 9.648 -13.155 -0.312
16 1HG GLN 2 2HG GLN 2 8.627 -14.475 -1.764
17 2HG GLN 2 1HG GLN 2 9.339 -15.913 -1.033
18 1HE2 GLN 2 1HE2 GLN 2 6.524 -14.027 -1.420
19 2HE2 GLN 2 2HE2 GLN 2 5.472 -14.975 -0.432
20 H ARG 3 H ARG 3 12.404 -13.415 -1.173
21 HA ARG 3 HA ARG 3 14.235 -12.209 0.575
22 1HB ARG 3 2HB ARG 3 14.741 -10.696 -1.366
23 2HB ARG 3 1HB ARG 3 14.831 -12.414 -1.724
24 1HG ARG 3 2HG ARG 3 12.386 -12.121 -2.537
25 2HG ARG 3 1HG ARG 3 12.797 -10.407 -2.593
26 1HD ARG 3 2HD ARG 3 14.130 -10.654 -4.386
27 2HD ARG 3 1HD ARG 3 14.775 -12.193 -3.824
28 HE ARG 3 HE ARG 3 12.232 -11.836 -5.269
29 1HH1 ARG 3 1HH1 ARG 3 14.892 -13.874 -4.251
30 2HH1 ARG 3 2HH1 ARG 3 14.403 -15.205 -5.242
31 1HH2 ARG 3 1HH2 ARG 3 11.605 -13.588 -6.567
32 2HH2 ARG 3 2HH2 ARG 3 12.542 -15.045 -6.551
33 H GLY 4 H GLY 4 10.974 -11.458 -0.004
34 1HA GLY 4 2HA GLY 4 9.737 -9.871 1.199
35 2HA GLY 4 1HA GLY 4 11.235 -9.044 1.605
36 H ILE 5 H ILE 5 8.661 -9.359 -0.684
37 HA ILE 5 HA ILE 5 9.838 -7.238 -2.340
38 HB ILE 5 HB ILE 5 7.440 -8.931 -3.018
39 1HG1 ILE 5 2HG1 ILE 5 9.335 -9.898 -4.648
40 2HG1 ILE 5 1HG1 ILE 5 10.353 -9.467 -3.278
41 1HG2 ILE 5 1HG2 ILE 5 8.476 -8.180 -5.369
42 2HG2 ILE 5 2HG2 ILE 5 8.972 -6.807 -4.380
43 3HG2 ILE 5 3HG2 ILE 5 7.266 -7.236 -4.501
44 1HD1 ILE 5 1HD1 ILE 5 8.754 -11.767 -3.631
45 2HD1 ILE 5 2HD1 ILE 5 8.071 -10.840 -2.293
46 3HD1 ILE 5 3HD1 ILE 5 9.764 -11.333 -2.253
47 H VAL 6 H VAL 6 9.189 -5.258 -1.922
48 HA VAL 6 HA VAL 6 6.489 -4.848 -0.832
49 HB VAL 6 HB VAL 6 8.215 -3.939 0.626
50 1HG1 VAL 6 1HG1 VAL 6 9.037 -1.968 -1.457
51 2HG1 VAL 6 2HG1 VAL 6 9.772 -3.567 -1.439
52 3HG1 VAL 6 3HG1 VAL 6 9.905 -2.529 -0.032
53 1HG2 VAL 6 1HG2 VAL 6 7.276 -1.398 -0.447
54 2HG2 VAL 6 2HG2 VAL 6 6.945 -2.162 1.108
55 3HG2 VAL 6 3HG2 VAL 6 5.999 -2.608 -0.312
56 H TRP 7 H TRP 7 5.021 -3.761 -1.961
57 HA TRP 7 HA TRP 7 5.908 -2.399 -4.414
58 1HB TRP 7 2HB TRP 7 3.482 -4.108 -3.884
59 2HB TRP 7 1HB TRP 7 3.525 -2.964 -5.225
60 HD1 TRP 7 HD1 TRP 7 6.897 -4.374 -4.758
61 HE1 TRP 7 1HE TRP 7 7.387 -6.197 -6.488
62 HE3 TRP 7 3HE TRP 7 2.151 -5.112 -6.498
63 HZ2 TRP 7 2HZ TRP 7 5.953 -7.765 -8.335
64 HZ3 TRP 7 3HZ TRP 7 1.798 -6.803 -8.253
65 HH2 TRP 7 HH2 TRP 7 3.662 -8.101 -9.151
66 H VAL 8 H VAL 8 5.053 -0.393 -4.872
67 HA VAL 8 HA VAL 8 3.221 0.754 -2.873
68 HB VAL 8 HB VAL 8 5.238 2.622 -3.927
69 1HG1 VAL 8 1HG1 VAL 8 4.821 2.270 -1.037
70 2HG1 VAL 8 2HG1 VAL 8 3.394 2.708 -1.974
71 3HG1 VAL 8 3HG1 VAL 8 4.824 3.735 -2.016
72 1HG2 VAL 8 1HG2 VAL 8 6.040 0.198 -2.407
73 2HG2 VAL 8 2HG2 VAL 8 6.788 1.734 -1.975
74 3HG2 VAL 8 3HG2 VAL 8 6.924 1.121 -3.623
75 H VAL 9 H VAL 9 1.829 2.337 -3.608
76 HA VAL 9 HA VAL 9 1.978 3.014 -6.465
77 HB VAL 9 HB VAL 9 -0.580 2.968 -6.439
78 1HG1 VAL 9 1HG1 VAL 9 -0.617 0.508 -6.921
79 2HG1 VAL 9 2HG1 VAL 9 1.061 0.454 -6.370
80 3HG1 VAL 9 3HG1 VAL 9 0.620 1.427 -7.767
81 1HG2 VAL 9 1HG2 VAL 9 -1.440 2.574 -4.413
82 2HG2 VAL 9 2HG2 VAL 9 0.020 1.769 -3.843
83 3HG2 VAL 9 3HG2 VAL 9 -1.146 0.884 -4.819
84 H ASP 10 H ASP 10 2.455 5.132 -6.406
85 HA ASP 10 HA ASP 10 0.545 6.984 -5.368
86 1HB ASP 10 2HB ASP 10 1.781 6.312 -3.293
87 2HB ASP 10 1HB ASP 10 3.241 6.990 -4.004
88 H ASP 11 H ASP 11 0.966 7.151 -7.787
89 HA ASP 11 HA ASP 11 1.500 8.587 -9.466
90 1HB ASP 11 2HB ASP 11 1.629 10.246 -7.471
91 2HB ASP 11 1HB ASP 11 3.371 10.116 -7.692
92 H ASP 12 H ASP 12 3.777 6.696 -7.847
93 HA ASP 12 HA ASP 12 5.757 5.764 -8.480
94 1HB ASP 12 2HB ASP 12 4.198 5.665 -10.664
95 2HB ASP 12 1HB ASP 12 5.481 6.692 -11.293
96 H SER 13 H SER 13 7.492 6.676 -10.651
97 HA SER 13 HA SER 13 9.444 7.860 -10.623
98 1HB SER 13 2HB SER 13 7.584 8.953 -12.040
99 2HB SER 13 1HB SER 13 7.662 10.246 -10.847
100 HG SER 13 HG SER 13 9.550 9.442 -12.735
101 H SER 14 H SER 14 7.753 10.586 -9.227
102 HA SER 14 HA SER 14 9.803 11.271 -7.496
103 1HB SER 14 2HB SER 14 6.934 12.004 -7.740
104 2HB SER 14 1HB SER 14 7.726 12.391 -6.213
105 HG SER 14 HG SER 14 8.957 13.060 -8.654
106 H ILE 15 H ILE 15 6.662 9.926 -6.432
107 HA ILE 15 HA ILE 15 7.533 9.321 -3.841
108 HB ILE 15 HB ILE 15 5.325 7.903 -5.345
109 1HG1 ILE 15 2HG1 ILE 15 5.017 10.335 -5.435
110 2HG1 ILE 15 1HG1 ILE 15 3.830 9.595 -4.366
111 1HG2 ILE 15 1HG2 ILE 15 6.274 7.898 -2.558
112 2HG2 ILE 15 2HG2 ILE 15 5.370 6.678 -3.455
113 3HG2 ILE 15 3HG2 ILE 15 4.531 8.065 -2.761
114 1HD1 ILE 15 1HD1 ILE 15 4.506 11.487 -3.222
115 2HD1 ILE 15 2HD1 ILE 15 6.201 11.271 -3.666
116 3HD1 ILE 15 3HD1 ILE 15 5.455 10.199 -2.479
117 H ARG 16 H ARG 16 8.088 7.711 -6.815
118 HA ARG 16 HA ARG 16 8.525 5.090 -5.805
119 1HB ARG 16 2HB ARG 16 8.068 5.464 -8.165
120 2HB ARG 16 1HB ARG 16 9.531 6.424 -8.319
121 1HG ARG 16 2HG ARG 16 10.673 4.221 -7.444
122 2HG ARG 16 1HG ARG 16 9.216 3.479 -8.100
123 1HD ARG 16 2HD ARG 16 9.689 4.759 -10.229
124 2HD ARG 16 1HD ARG 16 11.267 5.137 -9.542
125 HE ARG 16 HE ARG 16 10.748 2.342 -9.470
126 1HH1 ARG 16 1HH1 ARG 16 11.695 4.933 -11.611
127 2HH1 ARG 16 2HH1 ARG 16 12.564 3.892 -12.688
128 1HH2 ARG 16 1HH2 ARG 16 11.889 0.973 -10.887
129 2HH2 ARG 16 2HH2 ARG 16 12.673 1.646 -12.279
130 H TRP 17 H TRP 17 10.834 7.583 -6.906
131 HA TRP 17 HA TRP 17 13.161 6.293 -6.164
132 1HB TRP 17 2HB TRP 17 13.084 8.363 -7.518
133 2HB TRP 17 1HB TRP 17 12.674 9.275 -6.068
134 HD1 TRP 17 HD1 TRP 17 15.566 7.047 -7.375
135 HE1 TRP 17 1HE TRP 17 17.762 7.903 -6.341
136 HE3 TRP 17 3HE TRP 17 13.670 10.711 -4.349
137 HZ2 TRP 17 2HZ TRP 17 18.583 9.865 -4.491
138 HZ3 TRP 17 3HZ TRP 17 15.234 12.029 -2.975
139 HH2 TRP 17 HH2 TRP 17 17.639 11.613 -3.047
140 H VAL 18 H VAL 18 11.046 8.327 -4.197
141 HA VAL 18 HA VAL 18 12.711 8.546 -1.968
142 HB VAL 18 HB VAL 18 9.712 8.472 -1.836
143 1HG1 VAL 18 1HG1 VAL 18 11.574 10.172 -0.212
144 2HG1 VAL 18 2HG1 VAL 18 11.202 8.514 0.252
145 3HG1 VAL 18 3HG1 VAL 18 9.908 9.706 0.133
146 1HG2 VAL 18 1HG2 VAL 18 9.959 10.047 -3.485
147 2HG2 VAL 18 2HG2 VAL 18 11.551 10.553 -2.924
148 3HG2 VAL 18 3HG2 VAL 18 10.104 11.057 -2.049
149 H LEU 19 H LEU 19 10.016 6.303 -2.439
150 HA LEU 19 HA LEU 19 10.700 4.875 -0.053
151 1HB LEU 19 2HB LEU 19 8.355 5.289 -1.240
152 2HB LEU 19 1HB LEU 19 8.741 3.734 -1.955
153 HG LEU 19 HG LEU 19 8.902 2.714 0.243
154 1HD1 LEU 19 1HD1 LEU 19 8.978 5.498 1.102
155 2HD1 LEU 19 2HD1 LEU 19 9.564 4.043 1.907
156 3HD1 LEU 19 3HD1 LEU 19 7.867 4.504 2.044
157 1HD2 LEU 19 1HD2 LEU 19 6.723 2.351 0.063
158 2HD2 LEU 19 2HD2 LEU 19 6.536 3.826 -0.884
159 3HD2 LEU 19 3HD2 LEU 19 6.401 3.884 0.872
160 H GLU 20 H GLU 20 11.442 4.492 -3.399
161 HA GLU 20 HA GLU 20 11.856 1.702 -3.344
162 1HB GLU 20 2HB GLU 20 12.842 1.891 -5.467
163 2HB GLU 20 1HB GLU 20 11.588 3.110 -5.411
164 1HG GLU 20 2HG GLU 20 13.278 4.821 -5.013
165 2HG GLU 20 1HG GLU 20 14.533 3.586 -5.071
166 H ARG 21 H ARG 21 14.222 4.327 -3.286
167 HA ARG 21 HA ARG 21 16.444 2.691 -2.763
168 1HB ARG 21 2HB ARG 21 15.986 5.625 -2.231
169 2HB ARG 21 1HB ARG 21 17.543 4.829 -2.046
170 1HG ARG 21 2HG ARG 21 16.256 4.382 -4.638
171 2HG ARG 21 1HG ARG 21 16.685 6.062 -4.307
172 1HD ARG 21 2HD ARG 21 18.841 5.644 -4.657
173 2HD ARG 21 1HD ARG 21 18.816 4.298 -3.520
174 HE ARG 21 HE ARG 21 17.737 3.780 -6.168
175 1HH1 ARG 21 1HH1 ARG 21 20.472 3.539 -4.005
176 2HH1 ARG 21 2HH1 ARG 21 21.229 2.274 -4.911
177 1HH2 ARG 21 1HH2 ARG 21 18.740 2.117 -7.354
178 2HH2 ARG 21 2HH2 ARG 21 20.250 1.468 -6.808
179 H ALA 22 H ALA 22 14.485 4.659 -0.524
180 HA ALA 22 HA ALA 22 15.899 4.050 1.794
181 1HB ALA 22 1HB ALA 22 14.310 5.219 2.889
182 2HB ALA 22 2HB ALA 22 12.990 4.349 2.107
183 3HB ALA 22 3HB ALA 22 13.812 5.655 1.253
184 H LEU 23 H LEU 23 13.094 2.432 0.424
185 HA LEU 23 HA LEU 23 12.996 0.456 2.465
186 1HB LEU 23 2HB LEU 23 11.144 1.234 0.801
187 2HB LEU 23 1HB LEU 23 11.847 0.035 -0.266
188 HG LEU 23 HG LEU 23 11.100 -1.733 0.986
189 1HD1 LEU 23 1HD1 LEU 23 10.320 -1.402 3.413
190 2HD1 LEU 23 2HD1 LEU 23 11.228 0.107 3.343
191 3HD1 LEU 23 3HD1 LEU 23 12.050 -1.429 3.085
192 1HD2 LEU 23 1HD2 LEU 23 9.239 -0.116 0.195
193 2HD2 LEU 23 2HD2 LEU 23 8.996 0.167 1.918
194 3HD2 LEU 23 3HD2 LEU 23 8.830 -1.461 1.261
195 H ALA 24 H ALA 24 14.766 0.830 -0.463
196 HA ALA 24 HA ALA 24 15.449 -1.897 -0.857
197 1HB ALA 24 1HB ALA 24 16.953 0.584 -1.710
198 2HB ALA 24 2HB ALA 24 15.689 -0.218 -2.641
199 3HB ALA 24 3HB ALA 24 17.211 -1.050 -2.325
200 H GLY 25 H GLY 25 16.699 0.749 1.080
201 1HA GLY 25 2HA GLY 25 19.150 -0.465 1.834
202 2HA GLY 25 1HA GLY 25 18.316 0.810 2.715
203 H ALA 26 H ALA 26 15.863 -0.915 2.826
204 HA ALA 26 HA ALA 26 16.467 -2.194 5.306
205 1HB ALA 26 1HB ALA 26 13.964 -2.985 4.871
206 2HB ALA 26 2HB ALA 26 14.023 -1.647 3.725
207 3HB ALA 26 3HB ALA 26 14.354 -1.360 5.434
208 H GLY 27 H GLY 27 16.540 -3.141 2.032
209 1HA GLY 27 2HA GLY 27 17.507 -5.198 1.360
210 2HA GLY 27 1HA GLY 27 16.967 -5.915 2.867
211 H LEU 28 H LEU 28 14.736 -4.023 0.895
212 HA LEU 28 HA LEU 28 13.511 -6.549 0.060
213 1HB LEU 28 2HB LEU 28 11.704 -4.252 0.438
214 2HB LEU 28 1HB LEU 28 11.436 -5.955 0.741
215 HG LEU 28 HG LEU 28 13.145 -5.453 2.728
216 1HD1 LEU 28 1HD1 LEU 28 12.132 -2.855 1.864
217 2HD1 LEU 28 2HD1 LEU 28 13.636 -3.285 2.670
218 3HD1 LEU 28 3HD1 LEU 28 12.139 -3.175 3.597
219 1HD2 LEU 28 1HD2 LEU 28 10.538 -4.547 3.541
220 2HD2 LEU 28 2HD2 LEU 28 11.374 -6.051 3.926
221 3HD2 LEU 28 3HD2 LEU 28 10.418 -5.927 2.450
222 H THR 29 H THR 29 11.884 -6.243 -1.746
223 HA THR 29 HA THR 29 13.138 -4.592 -3.815
224 HB THR 29 HB THR 29 11.074 -6.801 -3.993
225 HG1 THR 29 1HG THR 29 13.810 -6.695 -4.728
226 1HG2 THR 29 1HG2 THR 29 11.878 -6.678 -6.484
227 2HG2 THR 29 2HG2 THR 29 12.158 -4.985 -6.078
228 3HG2 THR 29 3HG2 THR 29 10.546 -5.679 -5.903
229 H CYS 30 H CYS 30 12.367 -2.566 -3.790
230 HA CYS 30 HA CYS 30 9.519 -2.142 -3.293
231 1HB CYS 30 2HB CYS 30 11.316 -0.905 -2.006
232 2HB CYS 30 1HB CYS 30 11.650 -0.033 -3.496
233 HG CYS 30 HG CYS 30 9.772 0.983 -1.650
234 H THR 31 H THR 31 8.241 -2.080 -5.024
235 HA THR 31 HA THR 31 9.209 -0.641 -7.409
236 HB THR 31 HB THR 31 8.805 -3.218 -7.612
237 HG1 THR 31 1HG THR 31 8.815 -2.626 -9.617
238 1HG2 THR 31 1HG2 THR 31 6.750 -4.073 -7.624
239 2HG2 THR 31 2HG2 THR 31 6.032 -2.624 -8.313
240 3HG2 THR 31 3HG2 THR 31 6.366 -2.700 -6.584
241 H THR 32 H THR 32 7.717 0.819 -8.369
242 HA THR 32 HA THR 32 5.304 1.284 -6.763
243 HB THR 32 HB THR 32 5.559 3.665 -7.094
244 HG1 THR 32 1HG THR 32 7.078 2.981 -9.116
245 1HG2 THR 32 1HG2 THR 32 6.966 3.895 -5.401
246 2HG2 THR 32 2HG2 THR 32 8.314 3.234 -6.326
247 3HG2 THR 32 3HG2 THR 32 7.204 2.149 -5.492
248 H PHE 33 H PHE 33 3.544 2.347 -7.774
249 HA PHE 33 HA PHE 33 3.434 2.131 -10.686
250 1HB PHE 33 2HB PHE 33 1.172 1.158 -8.975
251 2HB PHE 33 1HB PHE 33 1.396 0.967 -10.691
252 HD1 PHE 33 1HD PHE 33 3.317 0.142 -7.595
253 HD2 PHE 33 2HD PHE 33 1.868 -1.146 -11.380
254 HE1 PHE 33 1HE PHE 33 4.335 -2.062 -7.226
255 HE2 PHE 33 2HE PHE 33 2.874 -3.355 -11.015
256 HZ PHE 33 HZ PHE 33 4.095 -3.829 -8.939
257 H GLU 34 H GLU 34 1.224 3.036 -11.458
258 HA GLU 34 HA GLU 34 1.157 5.767 -10.809
259 1HB GLU 34 2HB GLU 34 -0.518 5.959 -12.434
260 2HB GLU 34 1HB GLU 34 0.424 4.577 -12.966
261 1HG GLU 34 2HG GLU 34 -1.754 3.744 -11.254
262 2HG GLU 34 1HG GLU 34 -2.335 4.709 -12.605
263 H ASN 35 H ASN 35 -0.738 3.056 -9.651
264 HA ASN 35 HA ASN 35 -1.562 4.343 -7.311
265 1HB ASN 35 2HB ASN 35 -2.992 5.387 -9.343
266 2HB ASN 35 1HB ASN 35 -4.002 3.996 -8.961
267 1HD2 ASN 35 1HD2 ASN 35 -3.131 7.148 -8.106
268 2HD2 ASN 35 2HD2 ASN 35 -4.031 7.260 -6.636
269 H GLY 36 H GLY 36 -3.620 3.080 -6.390
270 1HA GLY 36 2HA GLY 36 -2.847 0.468 -5.957
271 2HA GLY 36 1HA GLY 36 -4.480 1.063 -5.715
272 H ASN 37 H ASN 37 -4.486 1.728 -8.712
273 HA ASN 37 HA ASN 37 -5.802 -0.625 -9.541
274 1HB ASN 37 2HB ASN 37 -5.685 2.021 -10.379
275 2HB ASN 37 1HB ASN 37 -5.031 1.106 -11.733
276 1HD2 ASN 37 1HD2 ASN 37 -7.540 0.315 -9.366
277 2HD2 ASN 37 2HD2 ASN 37 -8.793 0.053 -10.523
278 H GLU 38 H GLU 38 -2.702 0.830 -10.613
279 HA GLU 38 HA GLU 38 -2.023 -1.043 -12.521
280 1HB GLU 38 2HB GLU 38 -0.754 1.094 -11.365
281 2HB GLU 38 1HB GLU 38 0.225 -0.258 -10.824
282 1HG GLU 38 2HG GLU 38 0.517 -0.975 -13.150
283 2HG GLU 38 1HG GLU 38 -0.433 0.409 -13.683
284 H VAL 39 H VAL 39 -1.187 -1.170 -9.027
285 HA VAL 39 HA VAL 39 0.192 -3.561 -9.045
286 HB VAL 39 HB VAL 39 -1.664 -2.572 -6.875
287 1HG1 VAL 39 1HG1 VAL 39 0.262 -4.832 -7.024
288 2HG1 VAL 39 2HG1 VAL 39 -1.277 -4.710 -6.172
289 3HG1 VAL 39 3HG1 VAL 39 0.156 -3.926 -5.517
290 1HG2 VAL 39 1HG2 VAL 39 0.052 -1.293 -6.063
291 2HG2 VAL 39 2HG2 VAL 39 0.383 -1.192 -7.793
292 3HG2 VAL 39 3HG2 VAL 39 1.297 -2.313 -6.785
293 H LEU 40 H LEU 40 -3.276 -3.042 -9.213
294 HA LEU 40 HA LEU 40 -4.156 -5.635 -8.614
295 1HB LEU 40 2HB LEU 40 -5.431 -3.901 -10.717
296 2HB LEU 40 1HB LEU 40 -6.203 -5.077 -9.672
297 HG LEU 40 HG LEU 40 -5.101 -2.396 -8.849
298 1HD1 LEU 40 1HD1 LEU 40 -7.509 -2.023 -8.231
299 2HD1 LEU 40 2HD1 LEU 40 -7.882 -3.490 -9.134
300 3HD1 LEU 40 3HD1 LEU 40 -7.169 -2.106 -9.958
301 1HD2 LEU 40 1HD2 LEU 40 -4.776 -3.417 -6.871
302 2HD2 LEU 40 2HD2 LEU 40 -5.790 -4.794 -7.303
303 3HD2 LEU 40 3HD2 LEU 40 -6.531 -3.300 -6.728
304 H ALA 41 H ALA 41 -3.235 -4.164 -11.705
305 HA ALA 41 HA ALA 41 -3.635 -6.527 -13.236
306 1HB ALA 41 1HB ALA 41 -3.587 -4.127 -14.086
307 2HB ALA 41 2HB ALA 41 -2.762 -5.341 -15.065
308 3HB ALA 41 3HB ALA 41 -1.829 -4.267 -14.024
309 H ALA 42 H ALA 42 -0.758 -4.931 -11.986
310 HA ALA 42 HA ALA 42 1.135 -6.775 -12.922
311 1HB ALA 42 1HB ALA 42 2.367 -5.063 -12.189
312 2HB ALA 42 2HB ALA 42 2.241 -5.787 -10.586
313 3HB ALA 42 3HB ALA 42 1.111 -4.526 -11.079
314 H LEU 43 H LEU 43 -0.910 -6.790 -10.078
315 HA LEU 43 HA LEU 43 0.463 -8.825 -8.680
316 1HB LEU 43 2HB LEU 43 -2.273 -7.652 -8.484
317 2HB LEU 43 1HB LEU 43 -1.888 -9.124 -7.605
318 HG LEU 43 HG LEU 43 -0.387 -6.539 -7.299
319 1HD1 LEU 43 1HD1 LEU 43 -1.530 -6.481 -5.092
320 2HD1 LEU 43 2HD1 LEU 43 -2.544 -7.820 -5.632
321 3HD1 LEU 43 3HD1 LEU 43 -2.625 -6.264 -6.457
322 1HD2 LEU 43 1HD2 LEU 43 -0.205 -9.273 -6.144
323 2HD2 LEU 43 2HD2 LEU 43 0.262 -7.877 -5.169
324 3HD2 LEU 43 3HD2 LEU 43 1.085 -8.204 -6.695
325 H ALA 44 H ALA 44 -1.799 -8.901 -11.280
326 HA ALA 44 HA ALA 44 -2.953 -11.396 -10.980
327 1HB ALA 44 1HB ALA 44 -2.993 -11.385 -13.550
328 2HB ALA 44 2HB ALA 44 -2.242 -9.795 -13.408
329 3HB ALA 44 3HB ALA 44 -3.827 -10.090 -12.692
330 H SER 45 H SER 45 0.325 -10.650 -11.676
331 HA SER 45 HA SER 45 0.835 -13.476 -12.206
332 1HB SER 45 2HB SER 45 1.267 -12.328 -14.257
333 2HB SER 45 1HB SER 45 2.184 -11.072 -13.425
334 HG SER 45 HG SER 45 3.382 -12.845 -14.537
335 H LYS 46 H LYS 46 1.136 -11.272 -9.863
336 HA LYS 46 HA LYS 46 3.177 -12.715 -8.521
337 1HB LYS 46 2HB LYS 46 4.134 -10.726 -10.198
338 2HB LYS 46 1HB LYS 46 4.115 -9.961 -8.614
339 1HG LYS 46 2HG LYS 46 5.214 -12.511 -8.227
340 2HG LYS 46 1HG LYS 46 5.959 -11.869 -9.691
341 1HD LYS 46 2HD LYS 46 6.123 -9.694 -8.151
342 2HD LYS 46 1HD LYS 46 6.139 -10.924 -6.887
343 1HE LYS 46 2HE LYS 46 8.360 -10.904 -7.286
344 2HE LYS 46 1HE LYS 46 7.915 -11.996 -8.596
345 1HZ LYS 46 1HZ LYS 46 8.923 -9.297 -8.712
346 2HZ LYS 46 2HZ LYS 46 7.602 -9.574 -9.732
347 3HZ LYS 46 3HZ LYS 46 8.991 -10.529 -9.869
348 H THR 47 H THR 47 3.482 -12.017 -6.322
349 HA THR 47 HA THR 47 1.621 -10.000 -5.374
350 HB THR 47 HB THR 47 1.766 -12.822 -4.317
351 HG1 THR 47 1HG THR 47 -0.299 -11.346 -5.574
352 1HG2 THR 47 1HG2 THR 47 0.069 -12.231 -2.721
353 2HG2 THR 47 2HG2 THR 47 0.066 -10.563 -3.291
354 3HG2 THR 47 3HG2 THR 47 1.491 -11.215 -2.477
355 HA PRO 48 HA PRO 48 5.411 -9.213 -3.079
356 1HB PRO 48 2HB PRO 48 4.768 -6.765 -2.166
357 2HB PRO 48 1HB PRO 48 5.239 -7.037 -3.848
358 1HG PRO 48 2HG PRO 48 2.519 -6.664 -2.674
359 2HG PRO 48 1HG PRO 48 3.179 -6.045 -4.198
360 1HD PRO 48 2HD PRO 48 1.549 -8.250 -3.983
361 2HD PRO 48 1HD PRO 48 2.667 -7.958 -5.327
362 H ASP 49 H ASP 49 5.941 -8.834 -0.802
363 HA ASP 49 HA ASP 49 4.114 -10.204 0.917
364 1HB ASP 49 2HB ASP 49 6.729 -8.798 1.498
365 2HB ASP 49 1HB ASP 49 5.833 -9.751 2.677
366 H VAL 50 H VAL 50 4.670 -6.901 0.113
367 HA VAL 50 HA VAL 50 2.591 -6.107 1.993
368 HB VAL 50 HB VAL 50 4.585 -5.703 3.287
369 1HG1 VAL 50 1HG1 VAL 50 5.722 -3.729 1.421
370 2HG1 VAL 50 2HG1 VAL 50 5.885 -5.420 0.957
371 3HG1 VAL 50 3HG1 VAL 50 6.524 -4.864 2.500
372 1HG2 VAL 50 1HG2 VAL 50 3.694 -3.047 2.175
373 2HG2 VAL 50 2HG2 VAL 50 4.309 -3.392 3.791
374 3HG2 VAL 50 3HG2 VAL 50 2.734 -4.010 3.299
375 H LEU 51 H LEU 51 1.762 -3.894 1.514
376 HA LEU 51 HA LEU 51 2.491 -2.780 -1.063
377 1HB LEU 51 2HB LEU 51 0.890 -4.629 -1.544
378 2HB LEU 51 1HB LEU 51 -0.311 -3.793 -0.583
379 HG LEU 51 HG LEU 51 -0.103 -1.855 -2.188
380 1HD1 LEU 51 1HD1 LEU 51 0.800 -2.448 -4.436
381 2HD1 LEU 51 2HD1 LEU 51 1.499 -3.904 -3.717
382 3HD1 LEU 51 3HD1 LEU 51 2.024 -2.305 -3.176
383 1HD2 LEU 51 1HD2 LEU 51 -1.001 -4.476 -3.379
384 2HD2 LEU 51 2HD2 LEU 51 -1.555 -2.863 -3.829
385 3HD2 LEU 51 3HD2 LEU 51 -1.938 -3.515 -2.236
386 H LEU 52 H LEU 52 2.259 -0.643 -1.094
387 HA LEU 52 HA LEU 52 0.616 0.642 1.001
388 1HB LEU 52 2HB LEU 52 3.298 0.892 0.668
389 2HB LEU 52 1HB LEU 52 2.736 2.191 -0.360
390 HG LEU 52 HG LEU 52 1.861 1.950 2.502
391 1HD1 LEU 52 1HD1 LEU 52 3.676 3.928 2.583
392 2HD1 LEU 52 2HD1 LEU 52 4.434 2.861 1.399
393 3HD1 LEU 52 3HD1 LEU 52 4.034 2.253 3.006
394 1HD2 LEU 52 1HD2 LEU 52 1.869 4.168 0.472
395 2HD2 LEU 52 2HD2 LEU 52 1.561 4.420 2.191
396 3HD2 LEU 52 3HD2 LEU 52 0.479 3.406 1.241
397 H SER 53 H SER 53 -1.194 1.588 0.178
398 HA SER 53 HA SER 53 -1.048 2.556 -2.594
399 1HB SER 53 2HB SER 53 -3.210 1.114 -1.136
400 2HB SER 53 1HB SER 53 -3.648 2.225 -2.433
401 HG SER 53 HG SER 53 -2.785 0.914 -3.866
402 H ASP 54 H ASP 54 -1.944 4.467 -3.198
403 HA ASP 54 HA ASP 54 -2.199 6.433 -1.097
404 1HB ASP 54 2HB ASP 54 -1.100 6.607 -3.524
405 2HB ASP 54 1HB ASP 54 -2.724 7.153 -3.934
406 H ILE 55 H ILE 55 -3.962 8.215 -1.673
407 HA ILE 55 HA ILE 55 -6.500 7.118 -2.490
408 HB ILE 55 HB ILE 55 -6.483 6.356 -0.219
409 1HG1 ILE 55 2HG1 ILE 55 -8.180 8.859 -0.369
410 2HG1 ILE 55 1HG1 ILE 55 -8.631 7.280 -0.993
411 1HG2 ILE 55 1HG2 ILE 55 -4.821 7.600 0.812
412 2HG2 ILE 55 2HG2 ILE 55 -6.305 8.051 1.654
413 3HG2 ILE 55 3HG2 ILE 55 -5.610 9.136 0.447
414 1HD1 ILE 55 1HD1 ILE 55 -8.080 6.642 1.553
415 2HD1 ILE 55 2HD1 ILE 55 -9.679 7.096 0.968
416 3HD1 ILE 55 3HD1 ILE 55 -8.653 8.298 1.752
417 H ARG 56 H ARG 56 -5.688 8.897 -4.009
418 HA ARG 56 HA ARG 56 -6.423 11.562 -2.998
419 1HB ARG 56 2HB ARG 56 -4.266 10.639 -4.659
420 2HB ARG 56 1HB ARG 56 -5.229 11.805 -5.551
421 1HG ARG 56 2HG ARG 56 -4.710 12.694 -2.846
422 2HG ARG 56 1HG ARG 56 -3.222 12.355 -3.728
423 1HD ARG 56 2HD ARG 56 -5.373 13.945 -5.048
424 2HD ARG 56 1HD ARG 56 -4.341 14.720 -3.851
425 HE ARG 56 HE ARG 56 -2.478 14.375 -5.265
426 1HH1 ARG 56 1HH1 ARG 56 -5.488 13.363 -6.732
427 2HH1 ARG 56 2HH1 ARG 56 -4.839 13.348 -8.337
428 1HH2 ARG 56 1HH2 ARG 56 -1.636 14.358 -7.378
429 2HH2 ARG 56 2HH2 ARG 56 -2.657 13.908 -8.704
430 H MET 57 H MET 57 -8.454 9.747 -3.690
431 HA MET 57 HA MET 57 -10.424 9.689 -4.783
432 1HB MET 57 2HB MET 57 -9.717 12.387 -4.725
433 2HB MET 57 1HB MET 57 -10.256 12.091 -6.374
434 1HG MET 57 2HG MET 57 -12.266 10.921 -5.261
435 2HG MET 57 1HG MET 57 -11.769 11.793 -3.814
436 1HE MET 57 1HE MET 57 -14.480 11.841 -5.049
437 2HE MET 57 2HE MET 57 -14.991 13.465 -5.511
438 3HE MET 57 3HE MET 57 -14.380 13.161 -3.884
439 HA PRO 58 HA PRO 58 -8.178 8.623 -8.831
440 1HB PRO 58 2HB PRO 58 -7.956 5.939 -8.418
441 2HB PRO 58 1HB PRO 58 -6.685 7.092 -7.997
442 1HG PRO 58 2HG PRO 58 -8.731 5.800 -6.240
443 2HG PRO 58 1HG PRO 58 -7.018 6.119 -5.921
444 1HD PRO 58 2HD PRO 58 -9.020 7.664 -4.944
445 2HD PRO 58 1HD PRO 58 -7.411 8.302 -5.322
446 H GLY 59 H GLY 59 -9.946 5.827 -7.530
447 1HA GLY 59 2HA GLY 59 -11.943 6.194 -9.665
448 2HA GLY 59 1HA GLY 59 -11.520 4.655 -8.928
449 H MET 60 H MET 60 -11.520 5.884 -6.238
450 HA MET 60 HA MET 60 -14.190 6.806 -5.740
451 1HB MET 60 2HB MET 60 -14.619 4.389 -5.970
452 2HB MET 60 1HB MET 60 -13.399 4.060 -4.750
453 1HG MET 60 2HG MET 60 -15.081 4.051 -3.307
454 2HG MET 60 1HG MET 60 -15.026 5.807 -3.446
455 1HE MET 60 1HE MET 60 -17.460 5.589 -2.425
456 2HE MET 60 2HE MET 60 -17.689 3.854 -2.637
457 3HE MET 60 3HE MET 60 -18.861 4.987 -3.311
458 H ASP 61 H ASP 61 -12.445 8.375 -5.079
459 HA ASP 61 HA ASP 61 -11.552 9.599 -3.376
460 1HB ASP 61 2HB ASP 61 -13.426 7.985 -2.095
461 2HB ASP 61 1HB ASP 61 -11.950 7.788 -1.154
462 H GLY 62 H GLY 62 -10.845 6.212 -3.613
463 1HA GLY 62 2HA GLY 62 -8.309 5.997 -4.032
464 2HA GLY 62 1HA GLY 62 -8.219 6.560 -2.370
465 H LEU 63 H LEU 63 -10.730 5.189 -1.695
466 HA LEU 63 HA LEU 63 -9.609 2.690 -0.940
467 1HB LEU 63 2HB LEU 63 -12.525 3.331 -0.728
468 2HB LEU 63 1HB LEU 63 -11.544 2.318 0.314
469 HG LEU 63 HG LEU 63 -10.323 4.663 0.746
470 1HD1 LEU 63 1HD1 LEU 63 -13.052 5.726 0.796
471 2HD1 LEU 63 2HD1 LEU 63 -12.364 5.534 -0.816
472 3HD1 LEU 63 3HD1 LEU 63 -11.530 6.514 0.389
473 1HD2 LEU 63 1HD2 LEU 63 -12.790 3.580 2.078
474 2HD2 LEU 63 2HD2 LEU 63 -11.798 4.874 2.751
475 3HD2 LEU 63 3HD2 LEU 63 -11.107 3.272 2.495
476 H ALA 64 H ALA 64 -11.180 3.830 -3.714
477 HA ALA 64 HA ALA 64 -12.707 1.679 -4.588
478 1HB ALA 64 1HB ALA 64 -12.873 2.956 -6.409
479 2HB ALA 64 2HB ALA 64 -11.162 2.728 -6.772
480 3HB ALA 64 3HB ALA 64 -11.670 4.036 -5.706
481 H LEU 65 H LEU 65 -9.245 2.286 -5.141
482 HA LEU 65 HA LEU 65 -8.666 -0.054 -6.534
483 1HB LEU 65 2HB LEU 65 -6.369 0.385 -6.089
484 2HB LEU 65 1HB LEU 65 -7.171 1.926 -6.315
485 HG LEU 65 HG LEU 65 -7.327 1.782 -3.649
486 1HD1 LEU 65 1HD1 LEU 65 -5.956 0.332 -2.662
487 2HD1 LEU 65 2HD1 LEU 65 -4.616 0.791 -3.704
488 3HD1 LEU 65 3HD1 LEU 65 -5.761 -0.435 -4.234
489 1HD2 LEU 65 1HD2 LEU 65 -6.054 3.599 -3.822
490 2HD2 LEU 65 2HD2 LEU 65 -5.844 3.208 -5.529
491 3HD2 LEU 65 3HD2 LEU 65 -4.661 2.651 -4.346
492 H LEU 66 H LEU 66 -8.955 0.514 -3.083
493 HA LEU 66 HA LEU 66 -7.708 -1.807 -2.138
494 1HB LEU 66 2HB LEU 66 -9.912 -0.096 -1.024
495 2HB LEU 66 1HB LEU 66 -9.371 -1.534 -0.186
496 HG LEU 66 HG LEU 66 -8.276 0.350 0.790
497 1HD1 LEU 66 1HD1 LEU 66 -6.957 -1.839 -0.155
498 2HD1 LEU 66 2HD1 LEU 66 -6.276 -0.635 0.938
499 3HD1 LEU 66 3HD1 LEU 66 -5.980 -0.519 -0.797
500 1HD2 LEU 66 1HD2 LEU 66 -7.688 2.177 -0.336
501 2HD2 LEU 66 2HD2 LEU 66 -8.376 1.441 -1.775
502 3HD2 LEU 66 3HD2 LEU 66 -6.663 1.250 -1.422
503 H LYS 67 H LYS 67 -11.133 -1.218 -2.903
504 HA LYS 67 HA LYS 67 -12.148 -3.723 -2.281
505 1HB LYS 67 2HB LYS 67 -13.008 -1.910 -4.538
506 2HB LYS 67 1HB LYS 67 -13.979 -3.190 -3.816
507 1HG LYS 67 2HG LYS 67 -13.237 -1.640 -1.655
508 2HG LYS 67 1HG LYS 67 -13.543 -0.461 -2.931
509 1HD LYS 67 2HD LYS 67 -15.763 -0.933 -3.017
510 2HD LYS 67 1HD LYS 67 -15.524 -2.638 -2.625
511 1HE LYS 67 2HE LYS 67 -14.757 -1.519 -0.305
512 2HE LYS 67 1HE LYS 67 -15.924 -0.313 -0.846
513 1HZ LYS 67 1HZ LYS 67 -16.757 -3.096 -1.027
514 2HZ LYS 67 2HZ LYS 67 -17.643 -1.725 -0.580
515 3HZ LYS 67 3HZ LYS 67 -16.605 -2.461 0.535
516 H GLN 68 H GLN 68 -10.625 -2.596 -5.259
517 HA GLN 68 HA GLN 68 -11.095 -4.925 -6.782
518 1HB GLN 68 2HB GLN 68 -8.745 -3.072 -7.122
519 2HB GLN 68 1HB GLN 68 -9.536 -4.051 -8.348
520 1HG GLN 68 2HG GLN 68 -10.890 -1.781 -6.920
521 2HG GLN 68 1HG GLN 68 -10.020 -1.602 -8.442
522 1HE2 GLN 68 1HE2 GLN 68 -10.730 -3.079 -10.204
523 2HE2 GLN 68 2HE2 GLN 68 -12.425 -3.378 -10.361
524 H ILE 69 H ILE 69 -8.705 -4.094 -4.402
525 HA ILE 69 HA ILE 69 -6.740 -5.987 -5.057
526 HB ILE 69 HB ILE 69 -7.400 -4.705 -2.416
527 1HG1 ILE 69 2HG1 ILE 69 -5.122 -4.113 -4.300
528 2HG1 ILE 69 1HG1 ILE 69 -6.666 -3.279 -4.379
529 1HG2 ILE 69 1HG2 ILE 69 -4.671 -5.537 -2.590
530 2HG2 ILE 69 2HG2 ILE 69 -5.724 -6.926 -2.853
531 3HG2 ILE 69 3HG2 ILE 69 -5.889 -5.960 -1.390
532 1HD1 ILE 69 1HD1 ILE 69 -5.841 -1.829 -2.930
533 2HD1 ILE 69 2HD1 ILE 69 -4.429 -2.840 -2.631
534 3HD1 ILE 69 3HD1 ILE 69 -5.913 -3.106 -1.718
535 H LYS 70 H LYS 70 -9.262 -6.118 -2.601
536 HA LYS 70 HA LYS 70 -8.747 -8.753 -1.764
537 1HB LYS 70 2HB LYS 70 -10.934 -8.640 -0.668
538 2HB LYS 70 1HB LYS 70 -10.003 -7.172 -0.402
539 1HG LYS 70 2HG LYS 70 -11.751 -6.009 -1.119
540 2HG LYS 70 1HG LYS 70 -11.483 -6.698 -2.717
541 1HD LYS 70 2HD LYS 70 -13.245 -8.079 -2.553
542 2HD LYS 70 1HD LYS 70 -12.914 -8.456 -0.862
543 1HE LYS 70 2HE LYS 70 -15.037 -7.305 -1.052
544 2HE LYS 70 1HE LYS 70 -13.870 -6.285 -0.212
545 1HZ LYS 70 1HZ LYS 70 -14.873 -6.020 -2.980
546 2HZ LYS 70 2HZ LYS 70 -13.455 -5.250 -2.474
547 3HZ LYS 70 3HZ LYS 70 -14.928 -4.883 -1.729
548 H GLN 71 H GLN 71 -10.519 -7.504 -4.445
549 HA GLN 71 HA GLN 71 -12.227 -9.670 -4.913
550 1HB GLN 71 2HB GLN 71 -11.430 -7.266 -6.299
551 2HB GLN 71 1HB GLN 71 -11.662 -8.605 -7.415
552 1HG GLN 71 2HG GLN 71 -13.901 -8.804 -6.931
553 2HG GLN 71 1HG GLN 71 -13.731 -8.056 -5.343
554 1HE2 GLN 71 1HE2 GLN 71 -12.679 -5.720 -5.676
555 2HE2 GLN 71 2HE2 GLN 71 -13.572 -4.723 -6.766
556 H ARG 72 H ARG 72 -9.090 -8.949 -6.364
557 HA ARG 72 HA ARG 72 -9.033 -11.626 -7.520
558 1HB ARG 72 2HB ARG 72 -7.317 -9.193 -7.957
559 2HB ARG 72 1HB ARG 72 -6.920 -10.766 -8.638
560 1HG ARG 72 2HG ARG 72 -8.064 -9.916 -10.392
561 2HG ARG 72 1HG ARG 72 -9.423 -10.598 -9.500
562 1HD ARG 72 2HD ARG 72 -10.276 -8.525 -9.788
563 2HD ARG 72 1HD ARG 72 -9.310 -8.174 -8.354
564 HE ARG 72 HE ARG 72 -8.108 -6.739 -9.644
565 1HH1 ARG 72 1HH1 ARG 72 -9.437 -9.199 -11.737
566 2HH1 ARG 72 2HH1 ARG 72 -8.760 -8.516 -13.177
567 1HH2 ARG 72 1HH2 ARG 72 -7.219 -5.840 -11.539
568 2HH2 ARG 72 2HH2 ARG 72 -7.503 -6.609 -13.064
569 H HIS 73 H HIS 73 -7.535 -9.800 -4.994
570 HA HIS 73 HA HIS 73 -5.657 -12.015 -4.520
571 1HB HIS 73 2HB HIS 73 -5.355 -9.396 -3.121
572 2HB HIS 73 1HB HIS 73 -4.118 -10.536 -3.646
573 HD1 HIS 73 1HD HIS 73 -4.105 -10.698 -6.479
574 HD2 HIS 73 2HD HIS 73 -5.341 -7.180 -4.658
575 HE1 HIS 73 1HE HIS 73 -3.900 -8.922 -8.244
576 HE2 HIS 73 2HE HIS 73 -4.629 -6.791 -7.111
577 HA PRO 74 HA PRO 74 -7.959 -13.373 -1.014
578 1HB PRO 74 2HB PRO 74 -5.302 -13.865 0.231
579 2HB PRO 74 1HB PRO 74 -6.658 -14.966 -0.006
580 1HG PRO 74 2HG PRO 74 -4.474 -15.117 -1.529
581 2HG PRO 74 1HG PRO 74 -6.089 -15.407 -2.199
582 1HD PRO 74 2HD PRO 74 -4.324 -13.017 -2.466
583 2HD PRO 74 1HD PRO 74 -5.433 -13.739 -3.648
584 H MET 75 H MET 75 -4.983 -12.187 0.525
585 HA MET 75 HA MET 75 -6.455 -9.950 1.694
586 1HB MET 75 2HB MET 75 -4.964 -11.967 3.390
587 2HB MET 75 1HB MET 75 -5.812 -10.546 3.966
588 1HG MET 75 2HG MET 75 -7.791 -11.577 3.963
589 2HG MET 75 1HG MET 75 -7.494 -12.349 2.411
590 1HE MET 75 1HE MET 75 -4.638 -14.410 3.467
591 2HE MET 75 2HE MET 75 -5.707 -14.008 2.124
592 3HE MET 75 3HE MET 75 -5.900 -15.539 2.977
593 H LEU 76 H LEU 76 -4.658 -9.488 -0.171
594 HA LEU 76 HA LEU 76 -1.953 -9.374 0.572
595 1HB LEU 76 2HB LEU 76 -3.217 -9.000 -1.730
596 2HB LEU 76 1HB LEU 76 -3.076 -7.317 -1.258
597 HG LEU 76 HG LEU 76 -0.742 -9.209 -1.513
598 1HD1 LEU 76 1HD1 LEU 76 -0.718 -8.814 -3.694
599 2HD1 LEU 76 2HD1 LEU 76 -0.760 -7.074 -3.412
600 3HD1 LEU 76 3HD1 LEU 76 -2.267 -7.984 -3.535
601 1HD2 LEU 76 1HD2 LEU 76 -0.141 -7.522 0.001
602 2HD2 LEU 76 2HD2 LEU 76 -1.008 -6.282 -0.906
603 3HD2 LEU 76 3HD2 LEU 76 0.483 -6.971 -1.553
604 HA PRO 77 HA PRO 77 -2.276 -6.132 3.689
605 1HB PRO 77 2HB PRO 77 0.674 -6.180 3.328
606 2HB PRO 77 1HB PRO 77 -0.281 -6.288 4.811
607 1HG PRO 77 2HG PRO 77 0.898 -8.449 3.812
608 2HG PRO 77 1HG PRO 77 -0.728 -8.547 4.516
609 1HD PRO 77 2HD PRO 77 0.094 -8.495 1.637
610 2HD PRO 77 1HD PRO 77 -1.175 -9.451 2.430
611 H VAL 78 H VAL 78 -2.860 -4.197 3.053
612 HA VAL 78 HA VAL 78 -1.166 -2.649 1.232
613 HB VAL 78 HB VAL 78 -4.124 -2.189 1.413
614 1HG1 VAL 78 1HG1 VAL 78 -2.644 -0.490 0.389
615 2HG1 VAL 78 2HG1 VAL 78 -3.847 -1.138 -0.725
616 3HG1 VAL 78 3HG1 VAL 78 -2.172 -1.680 -0.823
617 1HG2 VAL 78 1HG2 VAL 78 -2.718 -4.221 -0.299
618 2HG2 VAL 78 2HG2 VAL 78 -4.291 -3.548 -0.719
619 3HG2 VAL 78 3HG2 VAL 78 -4.095 -4.458 0.776
620 H ILE 79 H ILE 79 -0.939 -0.447 1.721
621 HA ILE 79 HA ILE 79 -2.124 0.435 4.269
622 HB ILE 79 HB ILE 79 0.669 1.155 3.388
623 1HG1 ILE 79 2HG1 ILE 79 0.851 -0.459 5.663
624 2HG1 ILE 79 1HG1 ILE 79 -0.329 -1.278 4.645
625 1HG2 ILE 79 1HG2 ILE 79 -0.097 1.282 6.216
626 2HG2 ILE 79 2HG2 ILE 79 -0.965 2.401 5.164
627 3HG2 ILE 79 3HG2 ILE 79 0.798 2.436 5.228
628 1HD1 ILE 79 1HD1 ILE 79 2.340 -1.618 4.477
629 2HD1 ILE 79 2HD1 ILE 79 2.088 -0.377 3.252
630 3HD1 ILE 79 3HD1 ILE 79 1.213 -1.904 3.153
631 H ILE 80 H ILE 80 -3.413 2.114 3.883
632 HA ILE 80 HA ILE 80 -2.913 3.739 1.518
633 HB ILE 80 HB ILE 80 -5.318 3.863 3.317
634 1HG1 ILE 80 2HG1 ILE 80 -4.935 1.577 2.411
635 2HG1 ILE 80 1HG1 ILE 80 -6.394 2.323 1.780
636 1HG2 ILE 80 1HG2 ILE 80 -5.577 4.465 0.464
637 2HG2 ILE 80 2HG2 ILE 80 -4.525 5.575 1.336
638 3HG2 ILE 80 3HG2 ILE 80 -6.188 5.338 1.866
639 1HD1 ILE 80 1HD1 ILE 80 -5.519 2.565 -0.332
640 2HD1 ILE 80 2HD1 ILE 80 -4.812 1.038 0.193
641 3HD1 ILE 80 3HD1 ILE 80 -3.853 2.516 0.242
642 H MET 81 H MET 81 -2.607 5.919 1.497
643 HA MET 81 HA MET 81 -1.231 7.041 3.682
644 1HB MET 81 2HB MET 81 -1.033 9.026 2.327
645 2HB MET 81 1HB MET 81 -0.810 7.611 1.310
646 1HG MET 81 2HG MET 81 -2.764 7.950 0.171
647 2HG MET 81 1HG MET 81 -3.518 8.816 1.506
648 1HE MET 81 1HE MET 81 -3.633 12.121 0.250
649 2HE MET 81 2HE MET 81 -4.397 10.666 0.891
650 3HE MET 81 3HE MET 81 -4.216 10.872 -0.850
651 H THR 82 H THR 82 -4.589 7.328 2.663
652 HA THR 82 HA THR 82 -5.186 8.654 5.177
653 HB THR 82 HB THR 82 -6.258 9.877 2.644
654 HG1 THR 82 1HG THR 82 -3.967 10.105 2.717
655 1HG2 THR 82 1HG2 THR 82 -6.349 10.552 5.520
656 2HG2 THR 82 2HG2 THR 82 -7.569 10.762 4.267
657 3HG2 THR 82 3HG2 THR 82 -6.206 11.876 4.368
658 H ALA 83 H ALA 83 -7.659 8.926 5.436
659 HA ALA 83 HA ALA 83 -9.157 6.894 3.959
660 1HB ALA 83 1HB ALA 83 -8.025 6.181 6.304
661 2HB ALA 83 2HB ALA 83 -9.516 5.482 5.672
662 3HB ALA 83 3HB ALA 83 -9.583 6.781 6.861
663 H HIS 84 H HIS 84 -9.712 9.432 3.468
664 HA HIS 84 HA HIS 84 -11.849 10.268 5.287
665 1HB HIS 84 2HB HIS 84 -11.784 12.407 4.020
666 2HB HIS 84 1HB HIS 84 -10.249 11.991 4.773
667 HD1 HIS 84 1HD HIS 84 -11.871 11.512 1.365
668 HD2 HIS 84 2HD HIS 84 -8.178 12.303 3.087
669 HE1 HIS 84 1HE HIS 84 -10.293 11.824 -0.562
670 HE2 HIS 84 2HE HIS 84 -8.055 12.304 0.503
671 H SER 85 H SER 85 -13.687 11.476 4.039
672 HA SER 85 HA SER 85 -15.534 11.370 2.738
673 1HB SER 85 2HB SER 85 -13.641 11.230 0.928
674 2HB SER 85 1HB SER 85 -14.206 9.571 0.754
675 HG SER 85 HG SER 85 -16.297 10.417 0.356
676 H ASP 86 H ASP 86 -14.265 8.155 1.868
677 HA ASP 86 HA ASP 86 -16.584 6.998 3.271
678 1HB ASP 86 2HB ASP 86 -16.163 6.949 0.560
679 2HB ASP 86 1HB ASP 86 -15.485 5.404 1.062
680 H LEU 87 H LEU 87 -14.932 6.981 5.052
681 HA LEU 87 HA LEU 87 -12.651 5.408 5.057
682 1HB LEU 87 2HB LEU 87 -13.244 6.956 6.852
683 2HB LEU 87 1HB LEU 87 -14.602 5.946 7.296
684 HG LEU 87 HG LEU 87 -12.531 5.850 8.771
685 1HD1 LEU 87 1HD1 LEU 87 -14.467 4.158 8.561
686 2HD1 LEU 87 2HD1 LEU 87 -12.998 3.691 9.418
687 3HD1 LEU 87 3HD1 LEU 87 -13.267 3.142 7.769
688 1HD2 LEU 87 1HD2 LEU 87 -11.402 4.852 6.259
689 2HD2 LEU 87 2HD2 LEU 87 -11.070 3.840 7.659
690 3HD2 LEU 87 3HD2 LEU 87 -10.615 5.537 7.675
691 H ASP 88 H ASP 88 -15.954 4.458 5.001
692 HA ASP 88 HA ASP 88 -15.953 1.989 6.213
693 1HB ASP 88 2HB ASP 88 -17.809 3.356 4.891
694 2HB ASP 88 1HB ASP 88 -17.377 2.225 3.613
695 H ALA 89 H ALA 89 -15.291 2.584 2.746
696 HA ALA 89 HA ALA 89 -14.633 -0.062 2.127
697 1HB ALA 89 1HB ALA 89 -13.552 0.832 0.119
698 2HB ALA 89 2HB ALA 89 -13.652 2.458 0.793
699 3HB ALA 89 3HB ALA 89 -15.126 1.575 0.398
700 H ALA 90 H ALA 90 -12.860 2.317 3.850
701 HA ALA 90 HA ALA 90 -10.245 1.339 3.342
702 1HB ALA 90 1HB ALA 90 -9.715 2.553 5.536
703 2HB ALA 90 2HB ALA 90 -11.395 3.072 5.505
704 3HB ALA 90 3HB ALA 90 -10.315 3.524 4.193
705 H VAL 91 H VAL 91 -12.247 1.067 6.289
706 HA VAL 91 HA VAL 91 -10.675 -0.797 7.591
707 HB VAL 91 HB VAL 91 -13.677 -0.815 7.786
708 1HG1 VAL 91 1HG1 VAL 91 -11.429 -1.896 9.327
709 2HG1 VAL 91 2HG1 VAL 91 -13.115 -2.417 9.257
710 3HG1 VAL 91 3HG1 VAL 91 -12.650 -1.069 10.295
711 1HG2 VAL 91 1HG2 VAL 91 -13.091 0.869 9.721
712 2HG2 VAL 91 2HG2 VAL 91 -13.349 1.434 8.072
713 3HG2 VAL 91 3HG2 VAL 91 -11.709 1.233 8.688
714 H SER 92 H SER 92 -13.342 -1.355 5.313
715 HA SER 92 HA SER 92 -13.353 -4.155 5.470
716 1HB SER 92 2HB SER 92 -13.930 -2.700 2.908
717 2HB SER 92 1HB SER 92 -14.690 -4.158 3.553
718 HG SER 92 HG SER 92 -15.634 -2.847 5.173
719 H ALA 93 H ALA 93 -11.230 -1.913 3.967
720 HA ALA 93 HA ALA 93 -10.001 -3.715 2.144
721 1HB ALA 93 1HB ALA 93 -8.838 -1.160 3.178
722 2HB ALA 93 2HB ALA 93 -10.077 -1.210 1.925
723 3HB ALA 93 3HB ALA 93 -8.505 -1.960 1.643
724 H TYR 94 H TYR 94 -9.061 -2.305 5.228
725 HA TYR 94 HA TYR 94 -6.637 -3.781 5.418
726 1HB TYR 94 2HB TYR 94 -6.195 -2.221 6.912
727 2HB TYR 94 1HB TYR 94 -7.806 -1.570 6.644
728 HD1 TYR 94 1HD TYR 94 -5.947 -4.049 8.613
729 HD2 TYR 94 2HD TYR 94 -9.352 -1.565 8.334
730 HE1 TYR 94 1HE TYR 94 -6.493 -4.570 10.968
731 HE2 TYR 94 2HE TYR 94 -9.935 -2.056 10.684
732 HH TYR 94 HH TYR 94 -8.162 -4.461 12.543
733 H GLN 95 H GLN 95 -9.897 -4.309 6.417
734 HA GLN 95 HA GLN 95 -9.238 -6.464 8.205
735 1HB GLN 95 2HB GLN 95 -11.616 -6.817 8.399
736 2HB GLN 95 1HB GLN 95 -11.276 -5.093 8.471
737 1HG GLN 95 2HG GLN 95 -13.099 -5.149 7.102
738 2HG GLN 95 1HG GLN 95 -11.771 -5.138 5.944
739 1HE2 GLN 95 1HE2 GLN 95 -13.813 -5.930 4.733
740 2HE2 GLN 95 2HE2 GLN 95 -13.969 -7.649 4.616
741 H GLN 96 H GLN 96 -10.266 -6.159 4.844
742 HA GLN 96 HA GLN 96 -10.588 -8.958 4.445
743 1HB GLN 96 2HB GLN 96 -10.809 -8.438 2.088
744 2HB GLN 96 1HB GLN 96 -11.750 -7.297 3.042
745 1HG GLN 96 2HG GLN 96 -9.672 -5.791 2.862
746 2HG GLN 96 1HG GLN 96 -9.207 -6.855 1.537
747 1HE2 GLN 96 1HE2 GLN 96 -9.357 -4.925 0.234
748 2HE2 GLN 96 2HE2 GLN 96 -10.895 -4.417 -0.366
749 H GLY 97 H GLY 97 -7.859 -6.898 4.611
750 1HA GLY 97 2HA GLY 97 -5.972 -8.869 4.551
751 2HA GLY 97 1HA GLY 97 -6.178 -8.440 2.863
752 H ALA 98 H ALA 98 -6.645 -5.582 3.430
753 HA ALA 98 HA ALA 98 -4.004 -4.739 3.244
754 1HB ALA 98 1HB ALA 98 -6.551 -3.278 3.687
755 2HB ALA 98 2HB ALA 98 -5.430 -3.196 2.341
756 3HB ALA 98 3HB ALA 98 -5.030 -2.420 3.871
757 H PHE 99 H PHE 99 -2.717 -3.406 4.688
758 HA PHE 99 HA PHE 99 -2.542 -4.555 7.263
759 1HB PHE 99 2HB PHE 99 -0.612 -3.659 5.932
760 2HB PHE 99 1HB PHE 99 -1.181 -2.035 6.312
761 HD1 PHE 99 1HD PHE 99 -0.708 -5.179 8.266
762 HD2 PHE 99 2HD PHE 99 0.107 -1.017 7.909
763 HE1 PHE 99 1HE PHE 99 0.522 -5.242 10.392
764 HE2 PHE 99 2HE PHE 99 1.345 -1.075 10.037
765 HZ PHE 99 HZ PHE 99 1.552 -3.190 11.281
766 H ASP 100 H ASP 100 -3.326 -1.224 6.249
767 HA ASP 100 HA ASP 100 -5.401 -0.848 8.078
768 1HB ASP 100 2HB ASP 100 -4.389 0.438 9.850
769 2HB ASP 100 1HB ASP 100 -3.537 -1.096 9.738
770 H TYR 101 H TYR 101 -4.974 1.888 8.751
771 HA TYR 101 HA TYR 101 -4.593 3.204 6.152
772 1HB TYR 101 2HB TYR 101 -7.073 3.034 7.742
773 2HB TYR 101 1HB TYR 101 -6.661 4.650 7.183
774 HD1 TYR 101 1HD TYR 101 -7.181 1.168 5.985
775 HD2 TYR 101 2HD TYR 101 -7.156 5.301 5.002
776 HE1 TYR 101 1HE TYR 101 -8.165 0.649 3.793
777 HE2 TYR 101 2HE TYR 101 -8.150 4.804 2.818
778 HH TYR 101 HH TYR 101 -8.089 2.227 1.316
779 H LEU 102 H LEU 102 -4.101 5.456 6.276
780 HA LEU 102 HA LEU 102 -2.912 6.213 8.853
781 1HB LEU 102 2HB LEU 102 -1.943 6.291 6.217
782 2HB LEU 102 1HB LEU 102 -2.225 7.961 6.663
783 HG LEU 102 HG LEU 102 -0.693 7.849 8.465
784 1HD1 LEU 102 1HD1 LEU 102 -0.968 4.906 8.113
785 2HD1 LEU 102 2HD1 LEU 102 -1.014 5.876 9.586
786 3HD1 LEU 102 3HD1 LEU 102 0.525 5.560 8.783
787 1HD2 LEU 102 1HD2 LEU 102 0.161 6.737 5.862
788 2HD2 LEU 102 2HD2 LEU 102 1.313 6.639 7.192
789 3HD2 LEU 102 3HD2 LEU 102 0.670 8.202 6.696
790 HA PRO 103 HA PRO 103 -6.286 9.165 9.071
791 1HB PRO 103 2HB PRO 103 -5.598 10.236 11.487
792 2HB PRO 103 1HB PRO 103 -6.496 8.728 11.301
793 1HG PRO 103 2HG PRO 103 -3.634 9.159 11.962
794 2HG PRO 103 1HG PRO 103 -4.730 7.872 12.482
795 1HD PRO 103 2HD PRO 103 -2.804 7.616 10.517
796 2HD PRO 103 1HD PRO 103 -4.224 6.569 10.686
797 H LYS 104 H LYS 104 -3.524 10.612 10.765
798 HA LYS 104 HA LYS 104 -3.653 12.851 8.866
799 1HB LYS 104 2HB LYS 104 -3.748 12.823 11.666
800 2HB LYS 104 1HB LYS 104 -2.154 13.441 11.263
801 1HG LYS 104 2HG LYS 104 -2.996 15.300 10.189
802 2HG LYS 104 1HG LYS 104 -4.567 14.550 9.899
803 1HD LYS 104 2HD LYS 104 -4.456 14.551 12.621
804 2HD LYS 104 1HD LYS 104 -3.579 16.032 12.233
805 1HE LYS 104 2HE LYS 104 -5.489 17.082 11.808
806 2HE LYS 104 1HE LYS 104 -5.903 15.881 10.584
807 1HZ LYS 104 1HZ LYS 104 -6.331 14.840 13.188
808 2HZ LYS 104 2HZ LYS 104 -7.433 15.029 11.920
809 3HZ LYS 104 3HZ LYS 104 -7.164 16.301 13.001
810 HA PRO 105 HA PRO 105 1.153 12.162 9.779
811 1HB PRO 105 2HB PRO 105 0.934 9.277 10.499
812 2HB PRO 105 1HB PRO 105 2.057 10.504 11.092
813 1HG PRO 105 2HG PRO 105 0.027 9.694 12.599
814 2HG PRO 105 1HG PRO 105 0.510 11.401 12.566
815 1HD PRO 105 2HD PRO 105 -1.817 10.060 11.267
816 2HD PRO 105 1HD PRO 105 -1.705 11.678 11.990
817 H PHE 106 H PHE 106 2.590 11.368 8.217
818 HA PHE 106 HA PHE 106 1.933 9.213 6.484
819 1HB PHE 106 2HB PHE 106 0.351 10.942 5.660
820 2HB PHE 106 1HB PHE 106 1.720 11.982 5.285
821 HD1 PHE 106 1HD PHE 106 2.173 12.090 3.049
822 HD2 PHE 106 2HD PHE 106 0.858 8.395 4.696
823 HE1 PHE 106 1HE PHE 106 2.370 11.040 0.836
824 HE2 PHE 106 2HE PHE 106 1.054 7.335 2.483
825 HZ PHE 106 HZ PHE 106 1.811 8.658 0.550
826 H ASP 107 H ASP 107 3.466 11.552 4.599
827 HA ASP 107 HA ASP 107 5.585 11.560 3.749
828 1HB ASP 107 2HB ASP 107 7.263 12.309 5.354
829 2HB ASP 107 1HB ASP 107 5.729 13.126 5.642
830 H ILE 108 H ILE 108 7.974 10.643 4.226
831 HA ILE 108 HA ILE 108 7.734 7.845 3.930
832 HB ILE 108 HB ILE 108 9.791 9.787 3.569
833 1HG1 ILE 108 2HG1 ILE 108 10.590 8.199 1.942
834 2HG1 ILE 108 1HG1 ILE 108 9.674 6.903 2.698
835 1HG2 ILE 108 1HG2 ILE 108 10.970 9.026 5.455
836 2HG2 ILE 108 2HG2 ILE 108 11.711 8.202 4.084
837 3HG2 ILE 108 3HG2 ILE 108 10.577 7.343 5.119
838 1HD1 ILE 108 1HD1 ILE 108 7.633 7.750 1.941
839 2HD1 ILE 108 2HD1 ILE 108 8.729 7.923 0.568
840 3HD1 ILE 108 3HD1 ILE 108 8.328 9.326 1.559
841 H ASP 109 H ASP 109 8.906 9.834 6.564
842 HA ASP 109 HA ASP 109 9.935 7.922 8.239
843 1HB ASP 109 2HB ASP 109 8.701 10.572 8.657
844 2HB ASP 109 1HB ASP 109 8.767 9.531 10.074
845 H GLU 110 H GLU 110 6.527 9.043 8.362
846 HA GLU 110 HA GLU 110 5.813 6.897 10.095
847 1HB GLU 110 2HB GLU 110 4.073 8.865 8.616
848 2HB GLU 110 1HB GLU 110 3.489 7.716 9.807
849 1HG GLU 110 2HG GLU 110 5.517 9.871 10.342
850 2HG GLU 110 1HG GLU 110 3.799 9.977 10.715
851 H ALA 111 H ALA 111 5.684 7.462 6.665
852 HA ALA 111 HA ALA 111 3.915 5.350 6.013
853 1HB ALA 111 1HB ALA 111 4.904 5.546 3.726
854 2HB ALA 111 2HB ALA 111 6.038 6.730 4.377
855 3HB ALA 111 3HB ALA 111 4.307 7.066 4.391
856 H VAL 112 H VAL 112 7.474 5.548 5.765
857 HA VAL 112 HA VAL 112 7.853 2.827 5.194
858 HB VAL 112 HB VAL 112 9.805 4.668 6.573
859 1HG1 VAL 112 1HG1 VAL 112 11.307 3.020 6.465
860 2HG1 VAL 112 2HG1 VAL 112 10.867 2.624 4.804
861 3HG1 VAL 112 3HG1 VAL 112 9.949 1.939 6.146
862 1HG2 VAL 112 1HG2 VAL 112 9.671 5.824 4.651
863 2HG2 VAL 112 2HG2 VAL 112 8.844 4.517 3.810
864 3HG2 VAL 112 3HG2 VAL 112 10.600 4.490 3.969
865 H ALA 113 H ALA 113 7.539 4.583 8.165
866 HA ALA 113 HA ALA 113 8.454 2.642 9.977
867 1HB ALA 113 1HB ALA 113 7.057 3.883 11.621
868 2HB ALA 113 2HB ALA 113 6.394 4.817 10.278
869 3HB ALA 113 3HB ALA 113 8.113 4.923 10.663
870 H LEU 114 H LEU 114 5.250 3.365 8.714
871 HA LEU 114 HA LEU 114 3.960 1.267 10.130
872 1HB LEU 114 2HB LEU 114 2.834 3.345 9.495
873 2HB LEU 114 1HB LEU 114 3.027 2.931 7.802
874 HG LEU 114 HG LEU 114 1.599 0.897 8.237
875 1HD1 LEU 114 1HD1 LEU 114 0.142 0.987 10.220
876 2HD1 LEU 114 2HD1 LEU 114 1.097 2.333 10.842
877 3HD1 LEU 114 3HD1 LEU 114 1.837 0.746 10.644
878 1HD2 LEU 114 1HD2 LEU 114 0.297 3.545 8.802
879 2HD2 LEU 114 2HD2 LEU 114 -0.446 2.133 8.062
880 3HD2 LEU 114 3HD2 LEU 114 0.814 3.017 7.205
881 H VAL 115 H VAL 115 5.631 1.443 7.105
882 HA VAL 115 HA VAL 115 4.270 -0.820 5.972
883 HB VAL 115 HB VAL 115 5.335 0.990 4.579
884 1HG1 VAL 115 1HG1 VAL 115 7.456 1.273 5.548
885 2HG1 VAL 115 2HG1 VAL 115 7.747 0.542 3.982
886 3HG1 VAL 115 3HG1 VAL 115 7.837 -0.436 5.440
887 1HG2 VAL 115 1HG2 VAL 115 5.064 -0.461 2.925
888 2HG2 VAL 115 2HG2 VAL 115 5.013 -1.754 4.122
889 3HG2 VAL 115 3HG2 VAL 115 6.545 -1.310 3.370
890 H GLU 116 H GLU 116 7.375 -0.303 7.571
891 HA GLU 116 HA GLU 116 8.357 -2.927 7.176
892 1HB GLU 116 2HB GLU 116 9.031 -0.758 9.156
893 2HB GLU 116 1HB GLU 116 9.836 -2.322 9.179
894 1HG GLU 116 2HG GLU 116 10.573 -1.963 6.866
895 2HG GLU 116 1HG GLU 116 9.801 -0.377 6.882
896 H ARG 117 H ARG 117 6.545 -1.410 9.807
897 HA ARG 117 HA ARG 117 6.567 -3.592 11.569
898 1HB ARG 117 2HB ARG 117 4.528 -1.389 11.222
899 2HB ARG 117 1HB ARG 117 4.553 -2.514 12.575
900 1HG ARG 117 2HG ARG 117 6.673 -1.678 13.314
901 2HG ARG 117 1HG ARG 117 6.826 -0.671 11.872
902 1HD ARG 117 2HD ARG 117 5.657 0.968 12.811
903 2HD ARG 117 1HD ARG 117 4.346 -0.130 13.239
904 HE ARG 117 HE ARG 117 5.996 -0.717 15.174
905 1HH1 ARG 117 1HH1 ARG 117 5.346 2.453 13.850
906 2HH1 ARG 117 2HH1 ARG 117 5.719 3.278 15.324
907 1HH2 ARG 117 1HH2 ARG 117 6.485 0.374 17.110
908 2HH2 ARG 117 2HH2 ARG 117 6.366 2.101 17.174
909 H ALA 118 H ALA 118 4.828 -3.001 8.667
910 HA ALA 118 HA ALA 118 2.678 -4.801 9.117
911 1HB ALA 118 1HB ALA 118 3.391 -2.930 7.149
912 2HB ALA 118 2HB ALA 118 1.893 -3.853 7.267
913 3HB ALA 118 3HB ALA 118 3.246 -4.484 6.327
914 H ILE 119 H ILE 119 5.722 -5.034 7.300
915 HA ILE 119 HA ILE 119 5.344 -7.726 6.507
916 HB ILE 119 HB ILE 119 7.981 -6.291 6.766
917 1HG1 ILE 119 2HG1 ILE 119 6.616 -6.363 4.143
918 2HG1 ILE 119 1HG1 ILE 119 5.907 -5.286 5.342
919 1HG2 ILE 119 1HG2 ILE 119 8.276 -8.619 6.346
920 2HG2 ILE 119 2HG2 ILE 119 8.582 -7.756 4.838
921 3HG2 ILE 119 3HG2 ILE 119 7.052 -8.602 5.075
922 1HD1 ILE 119 1HD1 ILE 119 7.628 -4.274 3.809
923 2HD1 ILE 119 2HD1 ILE 119 8.824 -5.252 4.656
924 3HD1 ILE 119 3HD1 ILE 119 7.893 -4.038 5.535
925 H SER 120 H SER 120 6.748 -6.189 9.282
926 HA SER 120 HA SER 120 8.121 -8.463 10.286
927 1HB SER 120 2HB SER 120 8.738 -6.171 10.935
928 2HB SER 120 1HB SER 120 7.182 -5.983 11.745
929 HG SER 120 HG SER 120 7.907 -7.093 13.381
930 H HIS 121 H HIS 121 5.048 -6.907 11.185
931 HA HIS 121 HA HIS 121 4.326 -8.725 13.185
932 1HB HIS 121 2HB HIS 121 2.878 -6.733 11.518
933 2HB HIS 121 1HB HIS 121 1.912 -7.932 12.372
934 HD1 HIS 121 1HD HIS 121 5.040 -6.325 13.750
935 HD2 HIS 121 2HD HIS 121 0.928 -6.293 14.345
936 HE1 HIS 121 1HE HIS 121 4.677 -5.000 15.854
937 HE2 HIS 121 2HE HIS 121 2.176 -4.914 16.143
938 H TYR 122 H TYR 122 4.249 -9.001 9.757
939 HA TYR 122 HA TYR 122 2.259 -10.989 9.518
940 1HB TYR 122 2HB TYR 122 3.223 -9.567 7.652
941 2HB TYR 122 1HB TYR 122 4.623 -10.636 7.677
942 HD1 TYR 122 1HD TYR 122 4.592 -11.988 5.806
943 HD2 TYR 122 2HD TYR 122 0.942 -11.273 7.874
944 HE1 TYR 122 1HE TYR 122 3.432 -13.537 4.288
945 HE2 TYR 122 2HE TYR 122 -0.225 -12.821 6.361
946 HH TYR 122 HH TYR 122 1.220 -15.030 4.520
947 H GLN 123 H GLN 123 5.785 -11.168 9.840
948 HA GLN 123 HA GLN 123 5.850 -14.018 9.734
949 1HB GLN 123 2HB GLN 123 7.722 -12.129 9.337
950 2HB GLN 123 1HB GLN 123 8.090 -12.549 11.004
951 1HG GLN 123 2HG GLN 123 7.767 -14.980 9.649
952 2HG GLN 123 1HG GLN 123 8.730 -13.950 8.591
953 1HE2 GLN 123 1HE2 GLN 123 10.564 -12.814 9.687
954 2HE2 GLN 123 2HE2 GLN 123 11.467 -13.715 10.854
955 H GLU 124 H GLU 124 6.964 -15.241 11.580
956 HA GLU 124 HA GLU 124 5.410 -14.763 13.990
957 1HB GLU 124 2HB GLU 124 6.175 -16.988 14.674
958 2HB GLU 124 1HB GLU 124 5.482 -17.026 13.059
959 1HG GLU 124 2HG GLU 124 7.662 -17.119 12.063
960 2HG GLU 124 1HG GLU 124 8.431 -16.894 13.632
Start of MODEL 12
1 1H MET 1 1HT MET 1 6.752 -13.067 -0.582
2 2H MET 1 2HT MET 1 6.501 -14.217 -1.829
3 3H MET 1 3HT MET 1 8.092 -13.859 -1.299
4 HA MET 1 HA MET 1 6.129 -14.852 0.610
5 1HB MET 1 2HB MET 1 7.694 -16.497 -1.392
6 2HB MET 1 1HB MET 1 6.899 -17.163 0.026
7 1HG MET 1 2HG MET 1 4.766 -16.730 -0.819
8 2HG MET 1 1HG MET 1 5.375 -15.602 -2.028
9 1HE MET 1 1HE MET 1 6.201 -16.036 -4.136
10 2HE MET 1 2HE MET 1 4.581 -16.655 -4.453
11 3HE MET 1 3HE MET 1 5.990 -17.533 -5.044
12 H GLN 2 H GLN 2 7.490 -13.554 2.008
13 HA GLN 2 HA GLN 2 9.040 -13.511 3.694
14 1HB GLN 2 2HB GLN 2 9.013 -16.033 3.518
15 2HB GLN 2 1HB GLN 2 10.387 -15.891 2.430
16 1HG GLN 2 2HG GLN 2 11.648 -16.042 4.246
17 2HG GLN 2 1HG GLN 2 11.165 -14.376 4.571
18 1HE2 GLN 2 1HE2 GLN 2 11.785 -16.826 6.268
19 2HE2 GLN 2 2HE2 GLN 2 10.464 -16.899 7.380
20 H ARG 3 H ARG 3 9.847 -13.630 0.374
21 HA ARG 3 HA ARG 3 12.552 -12.890 0.459
22 1HB ARG 3 2HB ARG 3 11.561 -13.777 -1.545
23 2HB ARG 3 1HB ARG 3 10.389 -12.476 -1.602
24 1HG ARG 3 2HG ARG 3 11.834 -11.746 -3.176
25 2HG ARG 3 1HG ARG 3 12.578 -11.000 -1.762
26 1HD ARG 3 2HD ARG 3 13.890 -13.248 -1.615
27 2HD ARG 3 1HD ARG 3 13.432 -13.411 -3.307
28 HE ARG 3 HE ARG 3 14.744 -11.522 -3.821
29 1HH1 ARG 3 1HH1 ARG 3 14.946 -12.383 -0.435
30 2HH1 ARG 3 2HH1 ARG 3 16.425 -11.524 -0.185
31 1HH2 ARG 3 1HH2 ARG 3 16.679 -10.401 -3.485
32 2HH2 ARG 3 2HH2 ARG 3 17.410 -10.396 -1.914
33 H GLY 4 H GLY 4 9.811 -11.196 1.440
34 1HA GLY 4 2HA GLY 4 9.558 -9.046 2.208
35 2HA GLY 4 1HA GLY 4 11.293 -8.851 2.023
36 H ILE 5 H ILE 5 8.418 -9.168 -0.071
37 HA ILE 5 HA ILE 5 9.614 -7.177 -1.868
38 HB ILE 5 HB ILE 5 7.185 -8.892 -2.411
39 1HG1 ILE 5 2HG1 ILE 5 9.117 -9.908 -4.020
40 2HG1 ILE 5 1HG1 ILE 5 10.079 -9.479 -2.609
41 1HG2 ILE 5 1HG2 ILE 5 8.107 -6.643 -3.711
42 2HG2 ILE 5 2HG2 ILE 5 7.032 -7.867 -4.386
43 3HG2 ILE 5 3HG2 ILE 5 8.769 -7.968 -4.668
44 1HD1 ILE 5 1HD1 ILE 5 8.974 -10.984 -1.247
45 2HD1 ILE 5 2HD1 ILE 5 9.079 -11.840 -2.786
46 3HD1 ILE 5 3HD1 ILE 5 7.567 -11.067 -2.309
47 H VAL 6 H VAL 6 9.003 -5.138 -1.561
48 HA VAL 6 HA VAL 6 6.316 -4.602 -0.482
49 HB VAL 6 HB VAL 6 8.078 -3.627 0.884
50 1HG1 VAL 6 1HG1 VAL 6 9.820 -2.364 0.125
51 2HG1 VAL 6 2HG1 VAL 6 8.938 -1.783 -1.283
52 3HG1 VAL 6 3HG1 VAL 6 9.592 -3.418 -1.261
53 1HG2 VAL 6 1HG2 VAL 6 6.979 -1.685 1.238
54 2HG2 VAL 6 2HG2 VAL 6 5.874 -2.321 0.018
55 3HG2 VAL 6 3HG2 VAL 6 7.131 -1.172 -0.442
56 H TRP 7 H TRP 7 4.828 -3.731 -1.755
57 HA TRP 7 HA TRP 7 5.719 -2.489 -4.272
58 1HB TRP 7 2HB TRP 7 3.429 -4.328 -3.676
59 2HB TRP 7 1HB TRP 7 3.290 -3.172 -4.998
60 HD1 TRP 7 HD1 TRP 7 6.771 -4.455 -4.569
61 HE1 TRP 7 1HE TRP 7 7.326 -6.144 -6.421
62 HE3 TRP 7 3HE TRP 7 2.067 -5.184 -6.454
63 HZ2 TRP 7 2HZ TRP 7 5.968 -7.592 -8.409
64 HZ3 TRP 7 3HZ TRP 7 1.790 -6.750 -8.334
65 HH2 TRP 7 HH2 TRP 7 3.705 -7.932 -9.284
66 H VAL 8 H VAL 8 5.222 -0.442 -4.567
67 HA VAL 8 HA VAL 8 3.226 0.796 -2.785
68 HB VAL 8 HB VAL 8 5.110 2.556 -4.222
69 1HG1 VAL 8 1HG1 VAL 8 4.443 2.467 -1.296
70 2HG1 VAL 8 2HG1 VAL 8 3.397 3.228 -2.495
71 3HG1 VAL 8 3HG1 VAL 8 5.035 3.830 -2.243
72 1HG2 VAL 8 1HG2 VAL 8 6.683 1.954 -2.089
73 2HG2 VAL 8 2HG2 VAL 8 6.935 1.355 -3.730
74 3HG2 VAL 8 3HG2 VAL 8 6.087 0.358 -2.544
75 H VAL 9 H VAL 9 1.757 2.312 -3.642
76 HA VAL 9 HA VAL 9 1.690 2.509 -6.571
77 HB VAL 9 HB VAL 9 -0.970 2.508 -5.331
78 1HG1 VAL 9 1HG1 VAL 9 -1.495 2.117 -7.433
79 2HG1 VAL 9 2HG1 VAL 9 -0.599 0.616 -7.465
80 3HG1 VAL 9 3HG1 VAL 9 0.198 2.141 -7.855
81 1HG2 VAL 9 1HG2 VAL 9 -0.008 0.746 -3.971
82 2HG2 VAL 9 2HG2 VAL 9 0.621 -0.055 -5.408
83 3HG2 VAL 9 3HG2 VAL 9 -1.120 0.060 -5.149
84 H ASP 10 H ASP 10 1.951 4.564 -7.063
85 HA ASP 10 HA ASP 10 0.249 6.605 -5.968
86 1HB ASP 10 2HB ASP 10 2.345 6.196 -4.392
87 2HB ASP 10 1HB ASP 10 3.153 7.195 -5.597
88 H ASP 11 H ASP 11 1.987 8.778 -6.686
89 HA ASP 11 HA ASP 11 1.408 8.970 -9.436
90 1HB ASP 11 2HB ASP 11 1.592 10.865 -7.744
91 2HB ASP 11 1HB ASP 11 3.339 10.731 -7.929
92 H ASP 12 H ASP 12 3.777 7.147 -8.067
93 HA ASP 12 HA ASP 12 5.631 6.120 -8.884
94 1HB ASP 12 2HB ASP 12 4.054 6.765 -11.156
95 2HB ASP 12 1HB ASP 12 5.727 7.108 -11.578
96 H SER 13 H SER 13 7.460 7.056 -10.886
97 HA SER 13 HA SER 13 9.480 8.118 -10.727
98 1HB SER 13 2HB SER 13 7.714 9.412 -12.121
99 2HB SER 13 1HB SER 13 7.874 10.629 -10.859
100 HG SER 13 HG SER 13 9.384 10.474 -12.890
101 H SER 14 H SER 14 7.886 10.847 -9.235
102 HA SER 14 HA SER 14 9.880 11.340 -7.387
103 1HB SER 14 2HB SER 14 7.104 12.248 -7.779
104 2HB SER 14 1HB SER 14 7.711 12.402 -6.130
105 HG SER 14 HG SER 14 8.500 14.195 -6.938
106 H ILE 15 H ILE 15 6.711 9.841 -6.716
107 HA ILE 15 HA ILE 15 7.356 9.128 -4.067
108 HB ILE 15 HB ILE 15 5.327 7.734 -5.803
109 1HG1 ILE 15 2HG1 ILE 15 5.038 10.187 -5.925
110 2HG1 ILE 15 1HG1 ILE 15 3.708 9.407 -5.080
111 1HG2 ILE 15 1HG2 ILE 15 4.214 7.207 -3.758
112 2HG2 ILE 15 2HG2 ILE 15 5.315 8.228 -2.832
113 3HG2 ILE 15 3HG2 ILE 15 5.907 6.746 -3.581
114 1HD1 ILE 15 1HD1 ILE 15 5.055 9.989 -2.947
115 2HD1 ILE 15 2HD1 ILE 15 4.134 11.250 -3.768
116 3HD1 ILE 15 3HD1 ILE 15 5.879 11.141 -3.999
117 H ARG 16 H ARG 16 8.038 7.680 -7.116
118 HA ARG 16 HA ARG 16 8.504 5.032 -6.189
119 1HB ARG 16 2HB ARG 16 8.046 5.551 -8.557
120 2HB ARG 16 1HB ARG 16 9.578 6.407 -8.655
121 1HG ARG 16 2HG ARG 16 10.454 4.035 -7.768
122 2HG ARG 16 1HG ARG 16 9.021 3.512 -8.647
123 1HD ARG 16 2HD ARG 16 11.101 5.331 -9.836
124 2HD ARG 16 1HD ARG 16 11.171 3.577 -9.975
125 HE ARG 16 HE ARG 16 9.241 5.363 -11.249
126 1HH1 ARG 16 1HH1 ARG 16 10.361 2.094 -10.698
127 2HH1 ARG 16 2HH1 ARG 16 9.451 1.435 -12.015
128 1HH2 ARG 16 1HH2 ARG 16 8.043 4.486 -12.968
129 2HH2 ARG 16 2HH2 ARG 16 8.135 2.789 -13.301
130 H TRP 17 H TRP 17 10.777 7.581 -7.201
131 HA TRP 17 HA TRP 17 13.112 6.300 -6.478
132 1HB TRP 17 2HB TRP 17 13.025 8.378 -7.800
133 2HB TRP 17 1HB TRP 17 12.597 9.271 -6.344
134 HD1 TRP 17 HD1 TRP 17 15.523 7.140 -7.715
135 HE1 TRP 17 1HE TRP 17 17.701 7.985 -6.640
136 HE3 TRP 17 3HE TRP 17 13.562 10.627 -4.525
137 HZ2 TRP 17 2HZ TRP 17 18.489 9.876 -4.699
138 HZ3 TRP 17 3HZ TRP 17 15.100 11.909 -3.093
139 HH2 TRP 17 HH2 TRP 17 17.513 11.539 -3.180
140 H VAL 18 H VAL 18 10.945 8.200 -4.448
141 HA VAL 18 HA VAL 18 12.676 8.357 -2.235
142 HB VAL 18 HB VAL 18 9.680 8.433 -2.048
143 1HG1 VAL 18 1HG1 VAL 18 10.100 8.918 0.073
144 2HG1 VAL 18 2HG1 VAL 18 10.925 10.380 -0.445
145 3HG1 VAL 18 3HG1 VAL 18 11.835 8.886 -0.215
146 1HG2 VAL 18 1HG2 VAL 18 11.156 10.965 -2.381
147 2HG2 VAL 18 2HG2 VAL 18 9.560 10.494 -2.961
148 3HG2 VAL 18 3HG2 VAL 18 11.001 9.967 -3.825
149 H LEU 19 H LEU 19 10.030 6.124 -2.923
150 HA LEU 19 HA LEU 19 10.542 4.659 -0.511
151 1HB LEU 19 2HB LEU 19 8.332 5.000 -2.137
152 2HB LEU 19 1HB LEU 19 8.780 3.326 -2.381
153 HG LEU 19 HG LEU 19 7.131 3.498 -0.610
154 1HD1 LEU 19 1HD1 LEU 19 9.402 2.046 -0.474
155 2HD1 LEU 19 2HD1 LEU 19 8.099 1.947 0.708
156 3HD1 LEU 19 3HD1 LEU 19 9.512 2.952 1.031
157 1HD2 LEU 19 1HD2 LEU 19 7.122 5.127 0.901
158 2HD2 LEU 19 2HD2 LEU 19 8.464 5.844 0.013
159 3HD2 LEU 19 3HD2 LEU 19 8.784 4.782 1.382
160 H GLU 20 H GLU 20 11.396 4.326 -3.859
161 HA GLU 20 HA GLU 20 11.980 1.567 -3.793
162 1HB GLU 20 2HB GLU 20 13.091 1.847 -5.880
163 2HB GLU 20 1HB GLU 20 11.666 2.866 -5.886
164 1HG GLU 20 2HG GLU 20 13.129 4.797 -5.357
165 2HG GLU 20 1HG GLU 20 14.519 3.728 -5.528
166 H ARG 21 H ARG 21 14.243 4.307 -3.752
167 HA ARG 21 HA ARG 21 16.489 2.724 -3.120
168 1HB ARG 21 2HB ARG 21 16.039 5.692 -2.793
169 2HB ARG 21 1HB ARG 21 17.597 4.896 -2.617
170 1HG ARG 21 2HG ARG 21 16.322 4.209 -5.121
171 2HG ARG 21 1HG ARG 21 16.523 5.953 -4.940
172 1HD ARG 21 2HD ARG 21 18.780 4.075 -4.354
173 2HD ARG 21 1HD ARG 21 18.425 4.567 -6.007
174 HE ARG 21 HE ARG 21 18.795 6.875 -5.281
175 1HH1 ARG 21 1HH1 ARG 21 20.058 4.321 -3.249
176 2HH1 ARG 21 2HH1 ARG 21 21.271 5.329 -2.538
177 1HH2 ARG 21 1HH2 ARG 21 20.386 8.188 -4.340
178 2HH2 ARG 21 2HH2 ARG 21 21.458 7.520 -3.153
179 H ALA 22 H ALA 22 14.442 4.805 -1.075
180 HA ALA 22 HA ALA 22 15.838 4.450 1.305
181 1HB ALA 22 1HB ALA 22 13.873 6.037 0.734
182 2HB ALA 22 2HB ALA 22 14.051 5.444 2.385
183 3HB ALA 22 3HB ALA 22 12.865 4.709 1.308
184 H LEU 23 H LEU 23 12.991 2.686 0.185
185 HA LEU 23 HA LEU 23 13.072 0.823 2.316
186 1HB LEU 23 2HB LEU 23 11.122 1.433 0.700
187 2HB LEU 23 1HB LEU 23 11.819 0.201 -0.333
188 HG LEU 23 HG LEU 23 11.176 -1.522 1.044
189 1HD1 LEU 23 1HD1 LEU 23 10.493 -1.063 3.488
190 2HD1 LEU 23 2HD1 LEU 23 11.387 0.445 3.291
191 3HD1 LEU 23 3HD1 LEU 23 12.207 -1.098 3.082
192 1HD2 LEU 23 1HD2 LEU 23 9.211 -0.154 0.241
193 2HD2 LEU 23 2HD2 LEU 23 9.110 0.486 1.883
194 3HD2 LEU 23 3HD2 LEU 23 8.907 -1.244 1.595
195 H ALA 24 H ALA 24 14.751 1.094 -0.670
196 HA ALA 24 HA ALA 24 15.492 -1.634 -0.949
197 1HB ALA 24 1HB ALA 24 15.865 -0.574 -2.935
198 2HB ALA 24 2HB ALA 24 17.479 -0.405 -2.243
199 3HB ALA 24 3HB ALA 24 16.340 0.938 -2.163
200 H GLY 25 H GLY 25 16.780 1.173 0.727
201 1HA GLY 25 2HA GLY 25 19.270 0.066 1.483
202 2HA GLY 25 1HA GLY 25 18.428 1.367 2.317
203 H ALA 26 H ALA 26 16.026 -0.396 2.640
204 HA ALA 26 HA ALA 26 16.784 -1.515 5.155
205 1HB ALA 26 1HB ALA 26 14.327 -2.328 5.070
206 2HB ALA 26 2HB ALA 26 14.210 -1.279 3.657
207 3HB ALA 26 3HB ALA 26 14.660 -0.603 5.223
208 H GLY 27 H GLY 27 16.698 -2.669 1.946
209 1HA GLY 27 2HA GLY 27 17.709 -4.746 1.387
210 2HA GLY 27 1HA GLY 27 17.231 -5.367 2.954
211 H LEU 28 H LEU 28 14.892 -3.684 0.920
212 HA LEU 28 HA LEU 28 13.739 -6.290 0.251
213 1HB LEU 28 2HB LEU 28 11.811 -4.109 0.639
214 2HB LEU 28 1HB LEU 28 11.692 -5.801 1.065
215 HG LEU 28 HG LEU 28 13.468 -5.042 2.913
216 1HD1 LEU 28 1HD1 LEU 28 12.177 -2.598 1.946
217 2HD1 LEU 28 2HD1 LEU 28 13.777 -2.845 2.638
218 3HD1 LEU 28 3HD1 LEU 28 12.361 -2.788 3.689
219 1HD2 LEU 28 1HD2 LEU 28 10.799 -5.761 2.852
220 2HD2 LEU 28 2HD2 LEU 28 10.816 -4.252 3.767
221 3HD2 LEU 28 3HD2 LEU 28 11.810 -5.611 4.289
222 H THR 29 H THR 29 11.956 -6.067 -1.452
223 HA THR 29 HA THR 29 13.047 -4.471 -3.654
224 HB THR 29 HB THR 29 11.055 -6.748 -3.600
225 HG1 THR 29 1HG THR 29 13.695 -6.711 -3.658
226 1HG2 THR 29 1HG2 THR 29 10.313 -6.011 -5.560
227 2HG2 THR 29 2HG2 THR 29 11.875 -6.525 -6.199
228 3HG2 THR 29 3HG2 THR 29 11.626 -4.845 -5.726
229 H CYS 30 H CYS 30 12.233 -2.457 -3.675
230 HA CYS 30 HA CYS 30 9.361 -2.115 -3.185
231 1HB CYS 30 2HB CYS 30 10.751 -0.810 -1.700
232 2HB CYS 30 1HB CYS 30 11.613 -0.115 -3.067
233 HG CYS 30 HG CYS 30 9.012 0.829 -3.617
234 H THR 31 H THR 31 8.157 -2.034 -4.915
235 HA THR 31 HA THR 31 9.171 -0.627 -7.300
236 HB THR 31 HB THR 31 8.655 -3.180 -7.448
237 HG1 THR 31 1HG THR 31 8.923 -2.161 -9.353
238 1HG2 THR 31 1HG2 THR 31 6.410 -2.869 -6.299
239 2HG2 THR 31 2HG2 THR 31 6.445 -3.860 -7.759
240 3HG2 THR 31 3HG2 THR 31 5.867 -2.197 -7.832
241 H THR 32 H THR 32 7.508 0.609 -8.474
242 HA THR 32 HA THR 32 5.240 1.323 -6.766
243 HB THR 32 HB THR 32 5.530 3.642 -7.266
244 HG1 THR 32 1HG THR 32 6.470 4.133 -9.062
245 1HG2 THR 32 1HG2 THR 32 7.341 2.179 -5.764
246 2HG2 THR 32 2HG2 THR 32 7.088 3.926 -5.722
247 3HG2 THR 32 3HG2 THR 32 8.341 3.242 -6.760
248 H PHE 33 H PHE 33 3.442 2.297 -7.837
249 HA PHE 33 HA PHE 33 3.228 1.541 -10.663
250 1HB PHE 33 2HB PHE 33 1.203 1.070 -8.495
251 2HB PHE 33 1HB PHE 33 0.942 0.748 -10.195
252 HD1 PHE 33 1HD PHE 33 1.437 -1.414 -11.010
253 HD2 PHE 33 2HD PHE 33 3.232 -0.047 -7.416
254 HE1 PHE 33 1HE PHE 33 2.401 -3.638 -10.643
255 HE2 PHE 33 2HE PHE 33 4.206 -2.260 -7.043
256 HZ PHE 33 HZ PHE 33 3.777 -4.082 -8.663
257 H GLU 34 H GLU 34 1.079 2.463 -11.596
258 HA GLU 34 HA GLU 34 1.378 5.238 -11.657
259 1HB GLU 34 2HB GLU 34 -0.499 5.268 -13.154
260 2HB GLU 34 1HB GLU 34 0.487 3.855 -13.503
261 1HG GLU 34 2HG GLU 34 -1.354 2.910 -11.688
262 2HG GLU 34 1HG GLU 34 -2.285 4.039 -12.667
263 H ASN 35 H ASN 35 -1.026 3.300 -9.835
264 HA ASN 35 HA ASN 35 -1.422 5.379 -7.984
265 1HB ASN 35 2HB ASN 35 -3.789 5.955 -8.528
266 2HB ASN 35 1HB ASN 35 -2.613 6.550 -9.698
267 1HD2 ASN 35 1HD2 ASN 35 -3.097 6.233 -11.734
268 2HD2 ASN 35 2HD2 ASN 35 -4.149 5.012 -12.357
269 H GLY 36 H GLY 36 -2.925 2.595 -9.503
270 1HA GLY 36 2HA GLY 36 -3.052 1.123 -7.102
271 2HA GLY 36 1HA GLY 36 -4.620 1.859 -7.388
272 H ASN 37 H ASN 37 -4.867 1.671 -10.108
273 HA ASN 37 HA ASN 37 -5.726 -0.968 -10.413
274 1HB ASN 37 2HB ASN 37 -5.956 1.433 -11.860
275 2HB ASN 37 1HB ASN 37 -5.304 0.241 -12.979
276 1HD2 ASN 37 1HD2 ASN 37 -7.570 -0.063 -10.276
277 2HD2 ASN 37 2HD2 ASN 37 -8.861 -0.742 -11.202
278 H GLU 38 H GLU 38 -2.678 0.548 -11.181
279 HA GLU 38 HA GLU 38 -1.694 -1.335 -12.997
280 1HB GLU 38 2HB GLU 38 -0.727 0.968 -11.924
281 2HB GLU 38 1HB GLU 38 0.272 -0.227 -11.128
282 1HG GLU 38 2HG GLU 38 0.715 -1.181 -13.439
283 2HG GLU 38 1HG GLU 38 0.013 0.311 -14.058
284 H VAL 39 H VAL 39 -1.259 -1.237 -9.412
285 HA VAL 39 HA VAL 39 0.301 -3.517 -9.184
286 HB VAL 39 HB VAL 39 -1.888 -2.814 -7.238
287 1HG1 VAL 39 1HG1 VAL 39 0.754 -3.800 -6.375
288 2HG1 VAL 39 2HG1 VAL 39 -0.277 -4.958 -7.212
289 3HG1 VAL 39 3HG1 VAL 39 -0.855 -4.165 -5.749
290 1HG2 VAL 39 1HG2 VAL 39 -0.815 -0.980 -6.623
291 2HG2 VAL 39 2HG2 VAL 39 0.136 -1.122 -8.097
292 3HG2 VAL 39 3HG2 VAL 39 0.741 -1.802 -6.586
293 H LEU 40 H LEU 40 -3.214 -3.294 -9.436
294 HA LEU 40 HA LEU 40 -3.885 -5.938 -8.905
295 1HB LEU 40 2HB LEU 40 -5.281 -4.465 -11.100
296 2HB LEU 40 1HB LEU 40 -5.952 -5.530 -9.881
297 HG LEU 40 HG LEU 40 -4.910 -2.754 -9.323
298 1HD1 LEU 40 1HD1 LEU 40 -7.412 -2.348 -9.003
299 2HD1 LEU 40 2HD1 LEU 40 -7.635 -3.798 -9.974
300 3HD1 LEU 40 3HD1 LEU 40 -6.789 -2.409 -10.649
301 1HD2 LEU 40 1HD2 LEU 40 -5.625 -4.952 -7.623
302 2HD2 LEU 40 2HD2 LEU 40 -6.761 -3.621 -7.392
303 3HD2 LEU 40 3HD2 LEU 40 -5.029 -3.351 -7.186
304 H ALA 41 H ALA 41 -2.989 -4.457 -12.008
305 HA ALA 41 HA ALA 41 -3.273 -6.786 -13.561
306 1HB ALA 41 1HB ALA 41 -3.136 -4.408 -14.392
307 2HB ALA 41 2HB ALA 41 -2.214 -5.600 -15.306
308 3HB ALA 41 3HB ALA 41 -1.391 -4.531 -14.170
309 H ALA 42 H ALA 42 -0.427 -5.308 -12.109
310 HA ALA 42 HA ALA 42 1.402 -7.289 -12.964
311 1HB ALA 42 1HB ALA 42 1.500 -4.870 -11.474
312 2HB ALA 42 2HB ALA 42 2.831 -5.760 -12.209
313 3HB ALA 42 3HB ALA 42 2.341 -6.116 -10.552
314 H LEU 43 H LEU 43 -0.698 -6.919 -10.228
315 HA LEU 43 HA LEU 43 0.356 -8.863 -8.528
316 1HB LEU 43 2HB LEU 43 -2.220 -7.454 -8.849
317 2HB LEU 43 1HB LEU 43 -2.274 -8.957 -7.963
318 HG LEU 43 HG LEU 43 -0.421 -6.707 -7.257
319 1HD1 LEU 43 1HD1 LEU 43 -3.144 -6.578 -7.069
320 2HD1 LEU 43 2HD1 LEU 43 -2.017 -5.712 -6.028
321 3HD1 LEU 43 3HD1 LEU 43 -2.702 -7.248 -5.500
322 1HD2 LEU 43 1HD2 LEU 43 -0.958 -9.414 -6.250
323 2HD2 LEU 43 2HD2 LEU 43 -0.850 -8.158 -5.013
324 3HD2 LEU 43 3HD2 LEU 43 0.497 -8.425 -6.121
325 H ALA 44 H ALA 44 -1.501 -9.134 -11.417
326 HA ALA 44 HA ALA 44 -2.661 -11.654 -11.043
327 1HB ALA 44 1HB ALA 44 -1.723 -10.821 -13.746
328 2HB ALA 44 2HB ALA 44 -2.966 -9.870 -12.932
329 3HB ALA 44 3HB ALA 44 -3.240 -11.580 -13.263
330 H SER 45 H SER 45 0.621 -10.810 -11.475
331 HA SER 45 HA SER 45 1.270 -13.611 -11.970
332 1HB SER 45 2HB SER 45 2.367 -11.148 -13.236
333 2HB SER 45 1HB SER 45 3.451 -12.518 -12.990
334 HG SER 45 HG SER 45 1.082 -12.393 -14.522
335 H LYS 46 H LYS 46 1.390 -11.239 -9.695
336 HA LYS 46 HA LYS 46 3.327 -12.671 -8.164
337 1HB LYS 46 2HB LYS 46 4.424 -10.767 -9.762
338 2HB LYS 46 1HB LYS 46 4.102 -9.832 -8.308
339 1HG LYS 46 2HG LYS 46 5.255 -12.138 -7.336
340 2HG LYS 46 1HG LYS 46 6.145 -11.829 -8.829
341 1HD LYS 46 2HD LYS 46 6.015 -9.338 -7.747
342 2HD LYS 46 1HD LYS 46 6.120 -10.339 -6.299
343 1HE LYS 46 2HE LYS 46 8.282 -10.740 -6.646
344 2HE LYS 46 1HE LYS 46 7.982 -11.238 -8.312
345 1HZ LYS 46 1HZ LYS 46 7.721 -8.560 -8.450
346 2HZ LYS 46 2HZ LYS 46 9.135 -9.409 -8.820
347 3HZ LYS 46 3HZ LYS 46 8.942 -8.720 -7.288
348 H THR 47 H THR 47 3.548 -11.786 -5.954
349 HA THR 47 HA THR 47 1.372 -10.024 -5.173
350 HB THR 47 HB THR 47 1.945 -12.683 -3.867
351 HG1 THR 47 1HG THR 47 0.817 -12.823 -5.874
352 1HG2 THR 47 1HG2 THR 47 -0.244 -10.708 -3.289
353 2HG2 THR 47 2HG2 THR 47 1.147 -11.036 -2.255
354 3HG2 THR 47 3HG2 THR 47 -0.049 -12.296 -2.553
355 HA PRO 48 HA PRO 48 4.916 -8.516 -2.848
356 1HB PRO 48 2HB PRO 48 3.812 -6.210 -1.996
357 2HB PRO 48 1HB PRO 48 4.376 -6.425 -3.656
358 1HG PRO 48 2HG PRO 48 1.593 -6.579 -2.566
359 2HG PRO 48 1HG PRO 48 2.169 -5.815 -4.059
360 1HD PRO 48 2HD PRO 48 0.988 -8.274 -3.985
361 2HD PRO 48 1HD PRO 48 2.172 -7.795 -5.216
362 H ASP 49 H ASP 49 5.462 -8.445 -0.670
363 HA ASP 49 HA ASP 49 3.677 -9.800 1.103
364 1HB ASP 49 2HB ASP 49 6.330 -8.471 1.699
365 2HB ASP 49 1HB ASP 49 5.476 -9.589 2.759
366 H VAL 50 H VAL 50 4.435 -6.488 0.439
367 HA VAL 50 HA VAL 50 2.421 -5.650 2.369
368 HB VAL 50 HB VAL 50 4.477 -5.470 3.648
369 1HG1 VAL 50 1HG1 VAL 50 6.440 -4.710 2.867
370 2HG1 VAL 50 2HG1 VAL 50 5.689 -3.388 1.971
371 3HG1 VAL 50 3HG1 VAL 50 5.717 -5.013 1.286
372 1HG2 VAL 50 1HG2 VAL 50 2.910 -3.132 2.860
373 2HG2 VAL 50 2HG2 VAL 50 4.461 -2.749 3.591
374 3HG2 VAL 50 3HG2 VAL 50 3.301 -3.745 4.463
375 H LEU 51 H LEU 51 1.039 -4.822 0.871
376 HA LEU 51 HA LEU 51 2.015 -3.172 -1.312
377 1HB LEU 51 2HB LEU 51 0.159 -4.870 -1.539
378 2HB LEU 51 1HB LEU 51 -0.848 -3.795 -0.589
379 HG LEU 51 HG LEU 51 -0.723 -2.083 -2.309
380 1HD1 LEU 51 1HD1 LEU 51 1.505 -3.704 -3.221
381 2HD1 LEU 51 2HD1 LEU 51 1.117 -2.016 -3.560
382 3HD1 LEU 51 3HD1 LEU 51 0.389 -3.298 -4.520
383 1HD2 LEU 51 1HD2 LEU 51 -2.138 -3.075 -3.871
384 2HD2 LEU 51 2HD2 LEU 51 -2.332 -4.099 -2.448
385 3HD2 LEU 51 3HD2 LEU 51 -1.310 -4.631 -3.783
386 H LEU 52 H LEU 52 1.900 -0.995 -1.447
387 HA LEU 52 HA LEU 52 0.569 0.457 0.752
388 1HB LEU 52 2HB LEU 52 3.224 0.393 0.451
389 2HB LEU 52 1HB LEU 52 2.865 1.687 -0.674
390 HG LEU 52 HG LEU 52 2.128 1.661 2.252
391 1HD1 LEU 52 1HD1 LEU 52 4.355 2.092 2.370
392 2HD1 LEU 52 2HD1 LEU 52 3.779 3.724 2.027
393 3HD1 LEU 52 3HD1 LEU 52 4.435 2.728 0.728
394 1HD2 LEU 52 1HD2 LEU 52 0.492 2.907 1.024
395 2HD2 LEU 52 2HD2 LEU 52 1.745 3.737 0.100
396 3HD2 LEU 52 3HD2 LEU 52 1.568 4.051 1.826
397 H SER 53 H SER 53 -1.044 1.748 0.073
398 HA SER 53 HA SER 53 -0.921 2.749 -2.697
399 1HB SER 53 2HB SER 53 -3.117 1.399 -1.221
400 2HB SER 53 1HB SER 53 -3.557 2.689 -2.337
401 HG SER 53 HG SER 53 -1.916 0.476 -3.010
402 H ASP 54 H ASP 54 -0.988 4.847 -2.943
403 HA ASP 54 HA ASP 54 -1.458 6.569 -0.682
404 1HB ASP 54 2HB ASP 54 -0.465 6.964 -3.478
405 2HB ASP 54 1HB ASP 54 -0.978 8.354 -2.525
406 H ILE 55 H ILE 55 -3.509 6.961 -0.138
407 HA ILE 55 HA ILE 55 -5.682 6.966 -1.974
408 HB ILE 55 HB ILE 55 -6.012 6.409 0.381
409 1HG1 ILE 55 2HG1 ILE 55 -7.552 8.935 0.135
410 2HG1 ILE 55 1HG1 ILE 55 -7.753 7.724 -1.120
411 1HG2 ILE 55 1HG2 ILE 55 -5.894 8.021 2.130
412 2HG2 ILE 55 2HG2 ILE 55 -5.523 9.310 0.992
413 3HG2 ILE 55 3HG2 ILE 55 -4.361 8.023 1.277
414 1HD1 ILE 55 1HD1 ILE 55 -8.439 6.088 0.506
415 2HD1 ILE 55 2HD1 ILE 55 -9.423 7.542 0.671
416 3HD1 ILE 55 3HD1 ILE 55 -8.121 7.226 1.816
417 H ARG 56 H ARG 56 -6.106 8.502 -3.407
418 HA ARG 56 HA ARG 56 -6.131 11.272 -2.634
419 1HB ARG 56 2HB ARG 56 -3.743 10.374 -3.590
420 2HB ARG 56 1HB ARG 56 -4.514 10.940 -5.064
421 1HG ARG 56 2HG ARG 56 -4.355 12.633 -2.595
422 2HG ARG 56 1HG ARG 56 -3.068 12.597 -3.801
423 1HD ARG 56 2HD ARG 56 -5.784 12.995 -4.866
424 2HD ARG 56 1HD ARG 56 -5.178 14.300 -3.851
425 HE ARG 56 HE ARG 56 -3.576 14.789 -5.446
426 1HH1 ARG 56 1HH1 ARG 56 -5.349 11.917 -6.369
427 2HH1 ARG 56 2HH1 ARG 56 -4.664 11.860 -7.957
428 1HH2 ARG 56 1HH2 ARG 56 -2.696 14.715 -7.537
429 2HH2 ARG 56 2HH2 ARG 56 -3.158 13.445 -8.619
430 H MET 57 H MET 57 -8.325 10.091 -3.241
431 HA MET 57 HA MET 57 -10.117 9.897 -4.616
432 1HB MET 57 2HB MET 57 -10.685 11.909 -5.808
433 2HB MET 57 1HB MET 57 -9.933 12.321 -4.276
434 1HG MET 57 2HG MET 57 -7.900 12.927 -5.343
435 2HG MET 57 1HG MET 57 -8.446 12.272 -6.885
436 1HE MET 57 1HE MET 57 -11.294 14.572 -4.938
437 2HE MET 57 2HE MET 57 -10.157 15.905 -4.738
438 3HE MET 57 3HE MET 57 -9.783 14.317 -4.067
439 HA PRO 58 HA PRO 58 -7.626 8.499 -8.440
440 1HB PRO 58 2HB PRO 58 -7.524 5.837 -7.897
441 2HB PRO 58 1HB PRO 58 -6.254 6.965 -7.411
442 1HG PRO 58 2HG PRO 58 -8.492 5.818 -5.792
443 2HG PRO 58 1HG PRO 58 -6.801 6.085 -5.338
444 1HD PRO 58 2HD PRO 58 -8.816 7.748 -4.605
445 2HD PRO 58 1HD PRO 58 -7.154 8.296 -4.856
446 H GLY 59 H GLY 59 -9.517 5.764 -7.216
447 1HA GLY 59 2HA GLY 59 -11.403 6.169 -9.438
448 2HA GLY 59 1HA GLY 59 -11.044 4.622 -8.684
449 H MET 60 H MET 60 -11.149 5.924 -5.997
450 HA MET 60 HA MET 60 -13.822 6.874 -5.640
451 1HB MET 60 2HB MET 60 -14.108 4.362 -5.911
452 2HB MET 60 1HB MET 60 -13.209 4.187 -4.410
453 1HG MET 60 2HG MET 60 -14.989 4.644 -3.181
454 2HG MET 60 1HG MET 60 -15.348 6.094 -4.116
455 1HE MET 60 1HE MET 60 -17.830 2.528 -3.800
456 2HE MET 60 2HE MET 60 -17.866 4.060 -2.928
457 3HE MET 60 3HE MET 60 -16.436 3.033 -2.846
458 H ASP 61 H ASP 61 -12.212 8.447 -4.859
459 HA ASP 61 HA ASP 61 -11.387 9.666 -3.136
460 1HB ASP 61 2HB ASP 61 -13.243 7.907 -1.915
461 2HB ASP 61 1HB ASP 61 -11.829 7.986 -0.872
462 H GLY 62 H GLY 62 -10.550 6.310 -3.419
463 1HA GLY 62 2HA GLY 62 -8.003 6.177 -3.658
464 2HA GLY 62 1HA GLY 62 -8.018 6.760 -2.016
465 H LEU 63 H LEU 63 -10.496 5.220 -1.482
466 HA LEU 63 HA LEU 63 -9.193 2.804 -0.685
467 1HB LEU 63 2HB LEU 63 -12.100 3.545 -0.442
468 2HB LEU 63 1HB LEU 63 -11.273 2.260 0.418
469 HG LEU 63 HG LEU 63 -9.782 4.246 1.305
470 1HD1 LEU 63 1HD1 LEU 63 -11.417 6.188 1.728
471 2HD1 LEU 63 2HD1 LEU 63 -12.268 5.573 0.312
472 3HD1 LEU 63 3HD1 LEU 63 -10.591 6.096 0.176
473 1HD2 LEU 63 1HD2 LEU 63 -12.566 3.644 2.280
474 2HD2 LEU 63 2HD2 LEU 63 -11.304 4.433 3.229
475 3HD2 LEU 63 3HD2 LEU 63 -11.101 2.762 2.695
476 H ALA 64 H ALA 64 -10.862 3.875 -3.426
477 HA ALA 64 HA ALA 64 -12.289 1.660 -4.292
478 1HB ALA 64 1HB ALA 64 -12.556 2.912 -6.117
479 2HB ALA 64 2HB ALA 64 -10.825 2.895 -6.462
480 3HB ALA 64 3HB ALA 64 -11.492 4.096 -5.358
481 H LEU 65 H LEU 65 -8.829 2.365 -4.663
482 HA LEU 65 HA LEU 65 -8.134 0.183 -6.252
483 1HB LEU 65 2HB LEU 65 -5.851 0.494 -5.337
484 2HB LEU 65 1HB LEU 65 -6.588 1.972 -5.930
485 HG LEU 65 HG LEU 65 -7.291 2.134 -3.342
486 1HD1 LEU 65 1HD1 LEU 65 -5.175 1.536 -2.070
487 2HD1 LEU 65 2HD1 LEU 65 -4.774 0.507 -3.445
488 3HD1 LEU 65 3HD1 LEU 65 -6.243 0.209 -2.518
489 1HD2 LEU 65 1HD2 LEU 65 -6.300 4.022 -4.103
490 2HD2 LEU 65 2HD2 LEU 65 -5.027 3.145 -4.950
491 3HD2 LEU 65 3HD2 LEU 65 -4.928 3.379 -3.206
492 H LEU 66 H LEU 66 -8.678 0.411 -2.812
493 HA LEU 66 HA LEU 66 -7.487 -2.019 -2.043
494 1HB LEU 66 2HB LEU 66 -9.638 -0.301 -0.863
495 2HB LEU 66 1HB LEU 66 -9.247 -1.850 -0.146
496 HG LEU 66 HG LEU 66 -6.817 -0.970 -0.087
497 1HD1 LEU 66 1HD1 LEU 66 -7.817 1.742 0.262
498 2HD1 LEU 66 2HD1 LEU 66 -7.909 1.174 -1.400
499 3HD1 LEU 66 3HD1 LEU 66 -6.367 1.165 -0.550
500 1HD2 LEU 66 1HD2 LEU 66 -8.740 0.419 1.747
501 2HD2 LEU 66 2HD2 LEU 66 -7.130 -0.207 2.095
502 3HD2 LEU 66 3HD2 LEU 66 -8.459 -1.319 1.819
503 H LYS 67 H LYS 67 -10.782 -1.213 -3.030
504 HA LYS 67 HA LYS 67 -11.979 -3.697 -2.651
505 1HB LYS 67 2HB LYS 67 -13.023 -1.440 -3.321
506 2HB LYS 67 1HB LYS 67 -12.645 -1.902 -4.973
507 1HG LYS 67 2HG LYS 67 -14.137 -3.693 -4.942
508 2HG LYS 67 1HG LYS 67 -14.228 -3.702 -3.180
509 1HD LYS 67 2HD LYS 67 -15.192 -1.301 -3.493
510 2HD LYS 67 1HD LYS 67 -15.525 -1.850 -5.137
511 1HE LYS 67 2HE LYS 67 -17.006 -3.494 -4.421
512 2HE LYS 67 1HE LYS 67 -16.358 -3.498 -2.781
513 1HZ LYS 67 1HZ LYS 67 -18.609 -2.385 -3.207
514 2HZ LYS 67 2HZ LYS 67 -17.711 -1.107 -3.856
515 3HZ LYS 67 3HZ LYS 67 -17.485 -1.565 -2.244
516 H GLN 68 H GLN 68 -10.248 -2.433 -5.476
517 HA GLN 68 HA GLN 68 -10.647 -4.684 -7.122
518 1HB GLN 68 2HB GLN 68 -8.477 -2.580 -7.168
519 2HB GLN 68 1HB GLN 68 -8.784 -3.740 -8.453
520 1HG GLN 68 2HG GLN 68 -10.276 -2.385 -9.343
521 2HG GLN 68 1HG GLN 68 -11.225 -2.451 -7.858
522 1HE2 GLN 68 1HE2 GLN 68 -8.083 -0.982 -8.634
523 2HE2 GLN 68 2HE2 GLN 68 -8.518 0.611 -8.137
524 H ILE 69 H ILE 69 -8.063 -3.827 -4.864
525 HA ILE 69 HA ILE 69 -6.305 -5.926 -5.533
526 HB ILE 69 HB ILE 69 -6.569 -4.512 -2.880
527 1HG1 ILE 69 2HG1 ILE 69 -4.459 -3.816 -4.857
528 2HG1 ILE 69 1HG1 ILE 69 -6.093 -3.252 -5.194
529 1HG2 ILE 69 1HG2 ILE 69 -4.101 -5.107 -2.758
530 2HG2 ILE 69 2HG2 ILE 69 -4.421 -6.237 -4.074
531 3HG2 ILE 69 3HG2 ILE 69 -5.252 -6.421 -2.530
532 1HD1 ILE 69 1HD1 ILE 69 -5.838 -2.530 -2.608
533 2HD1 ILE 69 2HD1 ILE 69 -5.448 -1.486 -3.974
534 3HD1 ILE 69 3HD1 ILE 69 -4.170 -2.385 -3.155
535 H LYS 70 H LYS 70 -9.043 -5.771 -3.377
536 HA LYS 70 HA LYS 70 -8.477 -8.255 -2.101
537 1HB LYS 70 2HB LYS 70 -10.598 -8.011 -1.004
538 2HB LYS 70 1HB LYS 70 -9.777 -6.459 -1.029
539 1HG LYS 70 2HG LYS 70 -11.229 -5.566 -2.597
540 2HG LYS 70 1HG LYS 70 -11.797 -7.155 -3.117
541 1HD LYS 70 2HD LYS 70 -12.536 -7.244 -0.546
542 2HD LYS 70 1HD LYS 70 -12.605 -5.500 -0.799
543 1HE LYS 70 2HE LYS 70 -14.225 -5.694 -2.482
544 2HE LYS 70 1HE LYS 70 -13.915 -7.417 -2.699
545 1HZ LYS 70 1HZ LYS 70 -15.764 -7.580 -1.444
546 2HZ LYS 70 2HZ LYS 70 -15.563 -6.061 -0.725
547 3HZ LYS 70 3HZ LYS 70 -14.677 -7.387 -0.161
548 H GLN 71 H GLN 71 -10.217 -7.250 -4.906
549 HA GLN 71 HA GLN 71 -11.781 -9.556 -5.273
550 1HB GLN 71 2HB GLN 71 -11.150 -7.159 -6.762
551 2HB GLN 71 1HB GLN 71 -11.202 -8.566 -7.817
552 1HG GLN 71 2HG GLN 71 -13.423 -8.827 -7.590
553 2HG GLN 71 1HG GLN 71 -13.419 -8.327 -5.900
554 1HE2 GLN 71 1HE2 GLN 71 -12.435 -5.866 -5.904
555 2HE2 GLN 71 2HE2 GLN 71 -13.402 -4.797 -6.857
556 H ARG 72 H ARG 72 -8.604 -8.631 -6.412
557 HA ARG 72 HA ARG 72 -8.197 -11.200 -7.698
558 1HB ARG 72 2HB ARG 72 -6.380 -8.804 -7.408
559 2HB ARG 72 1HB ARG 72 -5.967 -10.262 -8.300
560 1HG ARG 72 2HG ARG 72 -8.092 -9.806 -9.654
561 2HG ARG 72 1HG ARG 72 -8.029 -8.190 -8.948
562 1HD ARG 72 2HD ARG 72 -5.672 -8.024 -9.796
563 2HD ARG 72 1HD ARG 72 -5.951 -9.526 -10.673
564 HE ARG 72 HE ARG 72 -7.148 -6.918 -11.235
565 1HH1 ARG 72 1HH1 ARG 72 -6.852 -10.305 -12.067
566 2HH1 ARG 72 2HH1 ARG 72 -7.561 -10.102 -13.633
567 1HH2 ARG 72 1HH2 ARG 72 -8.077 -6.667 -13.293
568 2HH2 ARG 72 2HH2 ARG 72 -8.255 -8.043 -14.328
569 H HIS 73 H HIS 73 -7.510 -9.657 -4.711
570 HA HIS 73 HA HIS 73 -6.169 -12.075 -3.771
571 1HB HIS 73 2HB HIS 73 -5.095 -9.288 -3.346
572 2HB HIS 73 1HB HIS 73 -4.435 -10.760 -2.634
573 HD1 HIS 73 1HD HIS 73 -3.137 -12.352 -4.218
574 HD2 HIS 73 2HD HIS 73 -4.426 -8.809 -5.970
575 HE1 HIS 73 1HE HIS 73 -1.937 -12.227 -6.420
576 HE2 HIS 73 2HE HIS 73 -2.948 -10.230 -7.564
577 HA PRO 74 HA PRO 74 -9.443 -10.806 -0.822
578 1HB PRO 74 2HB PRO 74 -9.234 -13.652 -0.076
579 2HB PRO 74 1HB PRO 74 -10.653 -12.716 -0.552
580 1HG PRO 74 2HG PRO 74 -9.583 -14.549 -2.182
581 2HG PRO 74 1HG PRO 74 -10.273 -13.040 -2.810
582 1HD PRO 74 2HD PRO 74 -7.400 -13.767 -2.364
583 2HD PRO 74 1HD PRO 74 -8.145 -12.914 -3.734
584 H MET 75 H MET 75 -6.239 -11.492 -0.481
585 HA MET 75 HA MET 75 -6.355 -11.059 2.403
586 1HB MET 75 2HB MET 75 -4.672 -13.214 1.129
587 2HB MET 75 1HB MET 75 -4.650 -12.762 2.827
588 1HG MET 75 2HG MET 75 -6.328 -14.125 3.266
589 2HG MET 75 1HG MET 75 -7.331 -13.356 2.040
590 1HE MET 75 1HE MET 75 -8.631 -15.087 1.139
591 2HE MET 75 2HE MET 75 -8.129 -16.364 2.247
592 3HE MET 75 3HE MET 75 -8.107 -16.647 0.506
593 H LEU 76 H LEU 76 -5.413 -9.713 -0.281
594 HA LEU 76 HA LEU 76 -2.620 -9.338 0.122
595 1HB LEU 76 2HB LEU 76 -4.086 -9.036 -2.024
596 2HB LEU 76 1HB LEU 76 -4.241 -7.400 -1.440
597 HG LEU 76 HG LEU 76 -2.417 -7.893 -3.161
598 1HD1 LEU 76 1HD1 LEU 76 -2.750 -5.954 -1.401
599 2HD1 LEU 76 2HD1 LEU 76 -1.328 -6.045 -2.443
600 3HD1 LEU 76 3HD1 LEU 76 -1.234 -6.604 -0.774
601 1HD2 LEU 76 1HD2 LEU 76 -0.683 -8.625 -0.873
602 2HD2 LEU 76 2HD2 LEU 76 -0.521 -9.004 -2.584
603 3HD2 LEU 76 3HD2 LEU 76 -1.672 -9.896 -1.589
604 HA PRO 77 HA PRO 77 -3.211 -6.287 3.363
605 1HB PRO 77 2HB PRO 77 -0.549 -5.938 3.815
606 2HB PRO 77 1HB PRO 77 -1.480 -7.269 4.496
607 1HG PRO 77 2HG PRO 77 0.334 -7.217 2.126
608 2HG PRO 77 1HG PRO 77 0.149 -8.465 3.372
609 1HD PRO 77 2HD PRO 77 -0.959 -8.671 0.917
610 2HD PRO 77 1HD PRO 77 -1.702 -9.373 2.365
611 H VAL 78 H VAL 78 -3.796 -4.284 2.716
612 HA VAL 78 HA VAL 78 -1.961 -2.799 0.940
613 HB VAL 78 HB VAL 78 -4.866 -2.110 1.282
614 1HG1 VAL 78 1HG1 VAL 78 -2.695 -1.421 -0.659
615 2HG1 VAL 78 2HG1 VAL 78 -3.760 -0.352 0.254
616 3HG1 VAL 78 3HG1 VAL 78 -4.392 -1.271 -1.114
617 1HG2 VAL 78 1HG2 VAL 78 -3.647 -4.251 -0.406
618 2HG2 VAL 78 2HG2 VAL 78 -5.011 -3.331 -1.037
619 3HG2 VAL 78 3HG2 VAL 78 -5.183 -4.239 0.462
620 H ILE 79 H ILE 79 -1.235 -0.818 1.540
621 HA ILE 79 HA ILE 79 -2.161 0.193 4.147
622 HB ILE 79 HB ILE 79 0.448 0.968 2.873
623 1HG1 ILE 79 2HG1 ILE 79 0.563 -0.947 5.090
624 2HG1 ILE 79 1HG1 ILE 79 -0.100 -1.620 3.605
625 1HG2 ILE 79 1HG2 ILE 79 0.903 2.041 4.819
626 2HG2 ILE 79 2HG2 ILE 79 0.029 0.860 5.796
627 3HG2 ILE 79 3HG2 ILE 79 -0.858 2.103 4.915
628 1HD1 ILE 79 1HD1 ILE 79 2.526 -1.508 4.213
629 2HD1 ILE 79 2HD1 ILE 79 2.339 -0.036 3.262
630 3HD1 ILE 79 3HD1 ILE 79 1.883 -1.593 2.574
631 H ILE 80 H ILE 80 -3.405 1.881 4.031
632 HA ILE 80 HA ILE 80 -3.265 3.657 1.714
633 HB ILE 80 HB ILE 80 -5.379 3.691 3.861
634 1HG1 ILE 80 2HG1 ILE 80 -6.720 2.372 2.120
635 2HG1 ILE 80 1HG1 ILE 80 -5.178 2.007 1.364
636 1HG2 ILE 80 1HG2 ILE 80 -6.243 4.385 1.220
637 2HG2 ILE 80 2HG2 ILE 80 -4.815 5.329 1.643
638 3HG2 ILE 80 3HG2 ILE 80 -6.233 5.365 2.682
639 1HD1 ILE 80 1HD1 ILE 80 -4.963 1.398 4.109
640 2HD1 ILE 80 2HD1 ILE 80 -4.927 0.302 2.734
641 3HD1 ILE 80 3HD1 ILE 80 -6.457 0.693 3.514
642 H MET 81 H MET 81 -2.624 5.740 1.866
643 HA MET 81 HA MET 81 -1.241 6.531 4.224
644 1HB MET 81 2HB MET 81 -0.713 8.591 2.989
645 2HB MET 81 1HB MET 81 -0.383 7.141 2.058
646 1HG MET 81 2HG MET 81 -1.637 7.882 0.414
647 2HG MET 81 1HG MET 81 -3.021 7.966 1.489
648 1HE MET 81 1HE MET 81 -0.928 9.346 -0.782
649 2HE MET 81 2HE MET 81 -0.340 10.932 -0.283
650 3HE MET 81 3HE MET 81 -1.918 10.780 -1.058
651 H THR 82 H THR 82 -4.473 7.175 3.081
652 HA THR 82 HA THR 82 -4.953 8.713 5.512
653 HB THR 82 HB THR 82 -5.917 9.829 2.887
654 HG1 THR 82 1HG THR 82 -3.520 10.376 4.280
655 1HG2 THR 82 1HG2 THR 82 -7.078 10.620 4.889
656 2HG2 THR 82 2HG2 THR 82 -6.160 11.898 4.092
657 3HG2 THR 82 3HG2 THR 82 -5.535 11.147 5.561
658 H ALA 83 H ALA 83 -7.225 9.029 6.011
659 HA ALA 83 HA ALA 83 -9.069 7.276 4.561
660 1HB ALA 83 1HB ALA 83 -9.445 7.136 7.453
661 2HB ALA 83 2HB ALA 83 -7.918 6.446 6.906
662 3HB ALA 83 3HB ALA 83 -9.442 5.851 6.243
663 H HIS 84 H HIS 84 -9.547 9.574 3.888
664 HA HIS 84 HA HIS 84 -10.769 11.360 5.716
665 1HB HIS 84 2HB HIS 84 -11.627 12.440 3.536
666 2HB HIS 84 1HB HIS 84 -9.894 12.373 3.800
667 HD1 HIS 84 1HD HIS 84 -9.666 12.615 1.186
668 HD2 HIS 84 2HD HIS 84 -11.410 9.077 2.496
669 HE1 HIS 84 1HE HIS 84 -9.589 11.059 -0.785
670 HE2 HIS 84 2HE HIS 84 -10.634 8.922 0.034
671 H SER 85 H SER 85 -13.106 11.819 3.717
672 HA SER 85 HA SER 85 -14.994 10.288 5.243
673 1HB SER 85 2HB SER 85 -16.575 11.498 3.473
674 2HB SER 85 1HB SER 85 -15.890 12.358 4.852
675 HG SER 85 HG SER 85 -15.665 13.309 2.639
676 H ASP 86 H ASP 86 -14.306 8.175 4.551
677 HA ASP 86 HA ASP 86 -16.003 7.013 2.671
678 1HB ASP 86 2HB ASP 86 -14.094 8.315 1.286
679 2HB ASP 86 1HB ASP 86 -13.276 6.779 1.531
680 H LEU 87 H LEU 87 -14.812 6.651 5.334
681 HA LEU 87 HA LEU 87 -12.978 4.588 5.507
682 1HB LEU 87 2HB LEU 87 -14.753 5.950 7.260
683 2HB LEU 87 1HB LEU 87 -14.935 4.232 7.552
684 HG LEU 87 HG LEU 87 -13.287 5.231 9.055
685 1HD1 LEU 87 1HD1 LEU 87 -11.392 3.698 7.509
686 2HD1 LEU 87 2HD1 LEU 87 -12.973 2.919 7.538
687 3HD1 LEU 87 3HD1 LEU 87 -12.159 3.318 9.051
688 1HD2 LEU 87 1HD2 LEU 87 -12.086 6.925 8.233
689 2HD2 LEU 87 2HD2 LEU 87 -12.320 6.398 6.565
690 3HD2 LEU 87 3HD2 LEU 87 -11.039 5.685 7.543
691 H ASP 88 H ASP 88 -16.246 4.465 4.451
692 HA ASP 88 HA ASP 88 -17.131 1.963 5.087
693 1HB ASP 88 2HB ASP 88 -17.400 3.415 2.448
694 2HB ASP 88 1HB ASP 88 -18.329 1.982 2.883
695 H ALA 89 H ALA 89 -15.166 2.733 2.206
696 HA ALA 89 HA ALA 89 -14.837 0.015 1.482
697 1HB ALA 89 1HB ALA 89 -14.673 1.854 -0.132
698 2HB ALA 89 2HB ALA 89 -13.238 0.827 -0.150
699 3HB ALA 89 3HB ALA 89 -13.197 2.393 0.660
700 H ALA 90 H ALA 90 -13.237 2.069 3.735
701 HA ALA 90 HA ALA 90 -10.779 0.594 3.827
702 1HB ALA 90 1HB ALA 90 -10.294 1.882 5.861
703 2HB ALA 90 2HB ALA 90 -11.936 2.529 5.836
704 3HB ALA 90 3HB ALA 90 -10.814 2.926 4.541
705 H VAL 91 H VAL 91 -13.777 0.652 5.719
706 HA VAL 91 HA VAL 91 -12.951 -1.171 7.683
707 HB VAL 91 HB VAL 91 -15.789 -0.856 6.733
708 1HG1 VAL 91 1HG1 VAL 91 -14.443 -2.221 8.955
709 2HG1 VAL 91 2HG1 VAL 91 -16.043 -2.496 8.252
710 3HG1 VAL 91 3HG1 VAL 91 -15.811 -1.214 9.441
711 1HG2 VAL 91 1HG2 VAL 91 -14.423 1.282 7.396
712 2HG2 VAL 91 2HG2 VAL 91 -14.656 0.677 9.033
713 3HG2 VAL 91 3HG2 VAL 91 -16.053 1.041 8.020
714 H SER 92 H SER 92 -14.860 -1.726 4.727
715 HA SER 92 HA SER 92 -15.071 -4.503 4.977
716 1HB SER 92 2HB SER 92 -15.145 -4.343 2.350
717 2HB SER 92 1HB SER 92 -16.442 -3.629 3.310
718 HG SER 92 HG SER 92 -15.721 -1.654 2.854
719 H ALA 93 H ALA 93 -12.512 -2.458 3.796
720 HA ALA 93 HA ALA 93 -10.938 -4.320 2.492
721 1HB ALA 93 1HB ALA 93 -9.965 -2.371 2.080
722 2HB ALA 93 2HB ALA 93 -9.124 -2.602 3.610
723 3HB ALA 93 3HB ALA 93 -10.605 -1.653 3.557
724 H TYR 94 H TYR 94 -11.116 -3.516 5.894
725 HA TYR 94 HA TYR 94 -8.908 -5.016 6.760
726 1HB TYR 94 2HB TYR 94 -11.452 -4.545 8.325
727 2HB TYR 94 1HB TYR 94 -9.852 -4.878 8.976
728 HD1 TYR 94 1HD TYR 94 -12.098 -2.391 8.854
729 HD2 TYR 94 2HD TYR 94 -8.071 -3.096 7.658
730 HE1 TYR 94 1HE TYR 94 -11.636 0.026 8.972
731 HE2 TYR 94 2HE TYR 94 -7.604 -0.685 7.772
732 HH TYR 94 HH TYR 94 -8.523 1.316 8.935
733 H GLN 95 H GLN 95 -11.996 -5.949 5.634
734 HA GLN 95 HA GLN 95 -12.095 -8.509 6.904
735 1HB GLN 95 2HB GLN 95 -14.169 -8.647 6.029
736 2HB GLN 95 1HB GLN 95 -13.939 -6.951 5.647
737 1HG GLN 95 2HG GLN 95 -12.883 -8.108 3.441
738 2HG GLN 95 1HG GLN 95 -14.115 -9.286 3.877
739 1HE2 GLN 95 1HE2 GLN 95 -13.725 -7.136 1.738
740 2HE2 GLN 95 2HE2 GLN 95 -15.245 -6.311 1.718
741 H GLN 96 H GLN 96 -11.119 -7.332 3.705
742 HA GLN 96 HA GLN 96 -10.396 -9.967 2.827
743 1HB GLN 96 2HB GLN 96 -9.691 -8.947 0.770
744 2HB GLN 96 1HB GLN 96 -11.240 -8.260 1.249
745 1HG GLN 96 2HG GLN 96 -9.159 -6.658 2.343
746 2HG GLN 96 1HG GLN 96 -8.829 -6.923 0.632
747 1HE2 GLN 96 1HE2 GLN 96 -9.237 -4.714 0.230
748 2HE2 GLN 96 2HE2 GLN 96 -10.851 -4.099 0.170
749 H GLY 97 H GLY 97 -8.872 -7.629 4.742
750 1HA GLY 97 2HA GLY 97 -6.814 -8.462 5.803
751 2HA GLY 97 1HA GLY 97 -6.281 -8.943 4.204
752 H ALA 98 H ALA 98 -7.768 -5.846 5.100
753 HA ALA 98 HA ALA 98 -5.827 -4.343 3.718
754 1HB ALA 98 1HB ALA 98 -7.229 -3.018 5.944
755 2HB ALA 98 2HB ALA 98 -8.244 -3.766 4.721
756 3HB ALA 98 3HB ALA 98 -7.073 -2.539 4.255
757 H PHE 99 H PHE 99 -4.072 -3.123 4.457
758 HA PHE 99 HA PHE 99 -2.648 -4.227 6.658
759 1HB PHE 99 2HB PHE 99 -1.911 -2.898 4.422
760 2HB PHE 99 1HB PHE 99 -1.794 -1.600 5.602
761 HD1 PHE 99 1HD PHE 99 -0.557 -4.837 4.573
762 HD2 PHE 99 2HD PHE 99 -0.045 -1.625 7.274
763 HE1 PHE 99 1HE PHE 99 1.649 -5.731 5.173
764 HE2 PHE 99 2HE PHE 99 2.170 -2.491 7.893
765 HZ PHE 99 HZ PHE 99 3.024 -4.555 6.836
766 H ASP 100 H ASP 100 -3.998 -1.008 6.011
767 HA ASP 100 HA ASP 100 -5.291 -0.528 8.361
768 1HB ASP 100 2HB ASP 100 -3.723 0.723 9.775
769 2HB ASP 100 1HB ASP 100 -3.160 -0.925 9.553
770 H TYR 101 H TYR 101 -4.724 2.084 9.000
771 HA TYR 101 HA TYR 101 -4.645 3.566 6.487
772 1HB TYR 101 2HB TYR 101 -7.016 3.190 8.209
773 2HB TYR 101 1HB TYR 101 -6.701 4.852 7.714
774 HD1 TYR 101 1HD TYR 101 -7.443 1.445 6.499
775 HD2 TYR 101 2HD TYR 101 -7.045 5.556 5.466
776 HE1 TYR 101 1HE TYR 101 -8.483 1.003 4.313
777 HE2 TYR 101 2HE TYR 101 -8.095 5.117 3.288
778 HH TYR 101 HH TYR 101 -8.323 2.324 1.893
779 H LEU 102 H LEU 102 -3.972 5.719 6.717
780 HA LEU 102 HA LEU 102 -2.850 6.331 9.353
781 1HB LEU 102 2HB LEU 102 -2.042 6.856 6.579
782 2HB LEU 102 1HB LEU 102 -1.810 8.208 7.672
783 HG LEU 102 HG LEU 102 -0.464 6.765 9.150
784 1HD1 LEU 102 1HD1 LEU 102 -0.944 4.577 8.948
785 2HD1 LEU 102 2HD1 LEU 102 0.315 4.627 7.714
786 3HD1 LEU 102 3HD1 LEU 102 -1.381 4.721 7.245
787 1HD2 LEU 102 1HD2 LEU 102 1.309 7.456 8.018
788 2HD2 LEU 102 2HD2 LEU 102 0.238 7.848 6.672
789 3HD2 LEU 102 3HD2 LEU 102 1.023 6.269 6.745
790 HA PRO 103 HA PRO 103 -6.219 9.233 9.868
791 1HB PRO 103 2HB PRO 103 -4.465 10.298 12.006
792 2HB PRO 103 1HB PRO 103 -6.136 9.736 12.094
793 1HG PRO 103 2HG PRO 103 -4.125 8.276 13.088
794 2HG PRO 103 1HG PRO 103 -5.523 7.518 12.301
795 1HD PRO 103 2HD PRO 103 -2.762 7.962 11.251
796 2HD PRO 103 1HD PRO 103 -3.856 6.584 11.010
797 H LYS 104 H LYS 104 -3.104 10.731 10.702
798 HA LYS 104 HA LYS 104 -3.643 12.781 8.665
799 1HB LYS 104 2HB LYS 104 -2.544 13.188 11.448
800 2HB LYS 104 1HB LYS 104 -2.542 14.426 10.199
801 1HG LYS 104 2HG LYS 104 -5.142 13.686 10.172
802 2HG LYS 104 1HG LYS 104 -4.737 13.417 11.868
803 1HD LYS 104 2HD LYS 104 -5.331 15.614 11.984
804 2HD LYS 104 1HD LYS 104 -3.624 15.813 11.582
805 1HE LYS 104 2HE LYS 104 -4.837 17.260 10.145
806 2HE LYS 104 1HE LYS 104 -4.314 15.892 9.163
807 1HZ LYS 104 1HZ LYS 104 -6.742 16.733 9.007
808 2HZ LYS 104 2HZ LYS 104 -6.970 15.841 10.427
809 3HZ LYS 104 3HZ LYS 104 -6.439 15.067 9.021
810 HA PRO 105 HA PRO 105 1.211 12.538 9.123
811 1HB PRO 105 2HB PRO 105 2.055 10.226 10.393
812 2HB PRO 105 1HB PRO 105 2.006 11.829 11.133
813 1HG PRO 105 2HG PRO 105 0.035 9.591 11.324
814 2HG PRO 105 1HG PRO 105 0.599 10.702 12.587
815 1HD PRO 105 2HD PRO 105 -1.779 11.034 11.431
816 2HD PRO 105 1HD PRO 105 -0.770 12.430 11.851
817 H PHE 106 H PHE 106 2.648 11.337 7.796
818 HA PHE 106 HA PHE 106 2.073 8.776 6.778
819 1HB PHE 106 2HB PHE 106 0.227 9.860 5.626
820 2HB PHE 106 1HB PHE 106 1.308 11.094 4.986
821 HD1 PHE 106 1HD PHE 106 1.541 10.857 2.713
822 HD2 PHE 106 2HD PHE 106 1.475 7.370 5.148
823 HE1 PHE 106 1HE PHE 106 1.953 9.466 0.726
824 HE2 PHE 106 2HE PHE 106 1.888 5.972 3.169
825 HZ PHE 106 HZ PHE 106 2.130 7.019 0.952
826 H ASP 107 H ASP 107 3.128 11.000 4.344
827 HA ASP 107 HA ASP 107 5.132 11.063 3.241
828 1HB ASP 107 2HB ASP 107 6.928 12.074 4.551
829 2HB ASP 107 1HB ASP 107 5.384 12.820 4.951
830 H ILE 108 H ILE 108 7.667 10.353 3.611
831 HA ILE 108 HA ILE 108 7.555 7.530 3.531
832 HB ILE 108 HB ILE 108 9.475 9.517 2.848
833 1HG1 ILE 108 2HG1 ILE 108 10.279 7.698 1.382
834 2HG1 ILE 108 1HG1 ILE 108 9.254 6.569 2.258
835 1HG2 ILE 108 1HG2 ILE 108 10.506 7.268 4.540
836 2HG2 ILE 108 2HG2 ILE 108 10.866 8.988 4.664
837 3HG2 ILE 108 3HG2 ILE 108 11.503 8.046 3.316
838 1HD1 ILE 108 1HD1 ILE 108 7.942 8.959 1.127
839 2HD1 ILE 108 2HD1 ILE 108 7.361 7.299 1.277
840 3HD1 ILE 108 3HD1 ILE 108 8.500 7.728 -0.006
841 H ASP 109 H ASP 109 8.757 9.769 5.930
842 HA ASP 109 HA ASP 109 10.010 8.070 7.673
843 1HB ASP 109 2HB ASP 109 8.242 10.423 8.353
844 2HB ASP 109 1HB ASP 109 9.353 9.649 9.477
845 H GLU 110 H GLU 110 6.533 8.948 7.880
846 HA GLU 110 HA GLU 110 6.075 6.897 9.805
847 1HB GLU 110 2HB GLU 110 4.089 8.606 8.309
848 2HB GLU 110 1HB GLU 110 3.704 7.552 9.661
849 1HG GLU 110 2HG GLU 110 5.658 9.828 9.828
850 2HG GLU 110 1HG GLU 110 3.948 9.967 10.233
851 H ALA 111 H ALA 111 5.690 7.167 6.354
852 HA ALA 111 HA ALA 111 4.046 4.885 6.018
853 1HB ALA 111 1HB ALA 111 4.018 6.194 4.135
854 2HB ALA 111 2HB ALA 111 5.174 4.954 3.648
855 3HB ALA 111 3HB ALA 111 5.750 6.521 4.204
856 H VAL 112 H VAL 112 7.531 5.295 5.312
857 HA VAL 112 HA VAL 112 8.096 2.569 5.036
858 HB VAL 112 HB VAL 112 9.997 4.664 6.075
859 1HG1 VAL 112 1HG1 VAL 112 10.291 1.885 5.698
860 2HG1 VAL 112 2HG1 VAL 112 11.550 3.068 6.063
861 3HG1 VAL 112 3HG1 VAL 112 11.176 2.668 4.386
862 1HG2 VAL 112 1HG2 VAL 112 8.810 4.239 3.435
863 2HG2 VAL 112 2HG2 VAL 112 10.571 4.326 3.420
864 3HG2 VAL 112 3HG2 VAL 112 9.629 5.653 4.095
865 H ALA 113 H ALA 113 7.780 4.553 7.857
866 HA ALA 113 HA ALA 113 9.026 2.866 9.741
867 1HB ALA 113 1HB ALA 113 6.778 4.842 10.081
868 2HB ALA 113 2HB ALA 113 8.502 5.162 10.284
869 3HB ALA 113 3HB ALA 113 7.667 4.092 11.406
870 H LEU 114 H LEU 114 5.681 3.204 8.689
871 HA LEU 114 HA LEU 114 4.670 1.126 10.328
872 1HB LEU 114 2HB LEU 114 3.168 2.834 9.702
873 2HB LEU 114 1HB LEU 114 3.587 2.686 8.007
874 HG LEU 114 HG LEU 114 2.530 0.266 8.325
875 1HD1 LEU 114 1HD1 LEU 114 1.660 1.796 10.684
876 2HD1 LEU 114 2HD1 LEU 114 1.768 0.054 10.434
877 3HD1 LEU 114 3HD1 LEU 114 0.391 0.953 9.796
878 1HD2 LEU 114 1HD2 LEU 114 0.849 2.747 8.055
879 2HD2 LEU 114 2HD2 LEU 114 0.480 1.137 7.442
880 3HD2 LEU 114 3HD2 LEU 114 1.827 2.051 6.763
881 H VAL 115 H VAL 115 6.203 1.180 7.230
882 HA VAL 115 HA VAL 115 5.084 -1.326 6.395
883 HB VAL 115 HB VAL 115 5.857 0.400 4.751
884 1HG1 VAL 115 1HG1 VAL 115 8.144 0.649 4.210
885 2HG1 VAL 115 2HG1 VAL 115 8.615 -0.679 5.271
886 3HG1 VAL 115 3HG1 VAL 115 8.029 0.830 5.953
887 1HG2 VAL 115 1HG2 VAL 115 5.717 -1.309 3.349
888 2HG2 VAL 115 2HG2 VAL 115 6.029 -2.426 4.680
889 3HG2 VAL 115 3HG2 VAL 115 7.372 -1.778 3.735
890 H GLU 116 H GLU 116 8.298 -0.309 7.538
891 HA GLU 116 HA GLU 116 9.427 -2.891 7.470
892 1HB GLU 116 2HB GLU 116 10.200 -0.519 9.174
893 2HB GLU 116 1HB GLU 116 11.197 -1.939 8.881
894 1HG GLU 116 2HG GLU 116 10.733 -1.220 6.354
895 2HG GLU 116 1HG GLU 116 10.599 0.358 7.128
896 H ARG 117 H ARG 117 8.207 -0.984 10.222
897 HA ARG 117 HA ARG 117 8.539 -2.938 12.175
898 1HB ARG 117 2HB ARG 117 6.566 -0.672 11.954
899 2HB ARG 117 1HB ARG 117 6.689 -1.689 13.382
900 1HG ARG 117 2HG ARG 117 8.797 -0.891 13.930
901 2HG ARG 117 1HG ARG 117 9.100 -0.291 12.298
902 1HD ARG 117 2HD ARG 117 8.650 1.671 13.403
903 2HD ARG 117 1HD ARG 117 7.047 1.249 12.808
904 HE ARG 117 HE ARG 117 6.461 0.536 15.005
905 1HH1 ARG 117 1HH1 ARG 117 9.562 2.149 14.825
906 2HH1 ARG 117 2HH1 ARG 117 9.599 2.518 16.515
907 1HH2 ARG 117 1HH2 ARG 117 6.525 1.023 17.224
908 2HH2 ARG 117 2HH2 ARG 117 7.883 1.879 17.873
909 H ALA 118 H ALA 118 6.133 -2.613 9.725
910 HA ALA 118 HA ALA 118 4.189 -4.312 10.913
911 1HB ALA 118 1HB ALA 118 3.517 -2.693 9.272
912 2HB ALA 118 2HB ALA 118 3.150 -4.312 8.688
913 3HB ALA 118 3HB ALA 118 4.550 -3.443 8.050
914 H ILE 119 H ILE 119 6.612 -4.798 8.346
915 HA ILE 119 HA ILE 119 6.011 -7.506 7.887
916 HB ILE 119 HB ILE 119 8.705 -6.205 7.531
917 1HG1 ILE 119 2HG1 ILE 119 6.844 -6.405 5.236
918 2HG1 ILE 119 1HG1 ILE 119 6.442 -5.196 6.452
919 1HG2 ILE 119 1HG2 ILE 119 7.399 -8.566 6.190
920 2HG2 ILE 119 2HG2 ILE 119 8.784 -8.595 7.281
921 3HG2 ILE 119 3HG2 ILE 119 8.929 -7.844 5.690
922 1HD1 ILE 119 1HD1 ILE 119 8.486 -4.068 6.139
923 2HD1 ILE 119 2HD1 ILE 119 7.845 -4.403 4.529
924 3HD1 ILE 119 3HD1 ILE 119 9.151 -5.394 5.183
925 H SER 120 H SER 120 7.974 -5.880 10.230
926 HA SER 120 HA SER 120 9.389 -8.171 11.137
927 1HB SER 120 2HB SER 120 10.289 -5.918 11.469
928 2HB SER 120 1HB SER 120 8.914 -5.511 12.497
929 HG SER 120 HG SER 120 9.622 -7.194 13.917
930 H HIS 121 H HIS 121 6.615 -6.343 12.405
931 HA HIS 121 HA HIS 121 6.196 -8.098 14.605
932 1HB HIS 121 2HB HIS 121 4.630 -5.868 13.356
933 2HB HIS 121 1HB HIS 121 3.867 -6.904 14.561
934 HD1 HIS 121 1HD HIS 121 7.092 -4.891 14.286
935 HD2 HIS 121 2HD HIS 121 4.189 -5.947 17.065
936 HE1 HIS 121 1HE HIS 121 7.734 -3.709 16.410
937 HE2 HIS 121 2HE HIS 121 6.016 -4.438 18.103
938 H TYR 122 H TYR 122 5.259 -8.160 11.294
939 HA TYR 122 HA TYR 122 2.977 -9.818 11.543
940 1HB TYR 122 2HB TYR 122 3.543 -8.447 9.524
941 2HB TYR 122 1HB TYR 122 4.824 -9.600 9.161
942 HD1 TYR 122 1HD TYR 122 4.214 -10.813 7.291
943 HD2 TYR 122 2HD TYR 122 1.287 -10.055 10.283
944 HE1 TYR 122 1HE TYR 122 2.608 -12.209 6.063
945 HE2 TYR 122 2HE TYR 122 -0.329 -11.451 9.064
946 HH TYR 122 HH TYR 122 -0.438 -13.143 7.425
947 H GLN 123 H GLN 123 6.387 -10.507 10.843
948 HA GLN 123 HA GLN 123 5.981 -13.328 10.725
949 1HB GLN 123 2HB GLN 123 8.428 -13.465 10.600
950 2HB GLN 123 1HB GLN 123 7.788 -12.285 9.468
951 1HG GLN 123 2HG GLN 123 8.348 -10.505 11.125
952 2HG GLN 123 1HG GLN 123 9.157 -11.743 12.089
953 1HE2 GLN 123 1HE2 GLN 123 10.604 -9.629 11.273
954 2HE2 GLN 123 2HE2 GLN 123 11.708 -10.084 10.026
955 H GLU 124 H GLU 124 7.872 -14.534 12.165
956 HA GLU 124 HA GLU 124 6.908 -14.179 14.894
957 1HB GLU 124 2HB GLU 124 8.488 -16.369 13.545
958 2HB GLU 124 1HB GLU 124 8.158 -16.351 15.273
959 1HG GLU 124 2HG GLU 124 5.734 -16.313 14.757
960 2HG GLU 124 1HG GLU 124 6.136 -16.476 13.048
Start of MODEL 13
1 1H MET 1 1HT MET 1 4.917 -17.046 3.643
2 2H MET 1 2HT MET 1 6.159 -18.223 3.765
3 3H MET 1 3HT MET 1 6.054 -17.224 2.373
4 HA MET 1 HA MET 1 6.225 -15.804 4.853
5 1HB MET 1 2HB MET 1 8.095 -17.960 4.182
6 2HB MET 1 1HB MET 1 8.886 -16.408 4.429
7 1HG MET 1 2HG MET 1 8.191 -16.261 6.635
8 2HG MET 1 1HG MET 1 6.899 -17.439 6.408
9 1HE MET 1 1HE MET 1 11.341 -18.024 6.840
10 2HE MET 1 2HE MET 1 10.503 -16.922 5.749
11 3HE MET 1 3HE MET 1 10.858 -18.572 5.235
12 H GLN 2 H GLN 2 7.828 -16.600 1.767
13 HA GLN 2 HA GLN 2 8.508 -15.297 0.031
14 1HB GLN 2 2HB GLN 2 6.239 -13.915 1.130
15 2HB GLN 2 1HB GLN 2 7.431 -12.740 0.591
16 1HG GLN 2 2HG GLN 2 5.884 -13.190 -1.187
17 2HG GLN 2 1HG GLN 2 7.471 -13.824 -1.616
18 1HE2 GLN 2 1HE2 GLN 2 4.535 -14.903 0.066
19 2HE2 GLN 2 2HE2 GLN 2 4.476 -16.460 -0.678
20 H ARG 3 H ARG 3 10.144 -13.813 -0.484
21 HA ARG 3 HA ARG 3 12.029 -13.344 1.540
22 1HB ARG 3 2HB ARG 3 13.166 -11.905 -0.223
23 2HB ARG 3 1HB ARG 3 12.910 -13.595 -0.618
24 1HG ARG 3 2HG ARG 3 10.645 -12.446 -1.620
25 2HG ARG 3 1HG ARG 3 11.845 -11.181 -1.876
26 1HD ARG 3 2HD ARG 3 12.927 -12.349 -3.455
27 2HD ARG 3 1HD ARG 3 12.756 -13.872 -2.587
28 HE ARG 3 HE ARG 3 10.748 -12.682 -4.380
29 1HH1 ARG 3 1HH1 ARG 3 12.009 -15.445 -2.644
30 2HH1 ARG 3 2HH1 ARG 3 10.951 -16.569 -3.425
31 1HH2 ARG 3 1HH2 ARG 3 9.351 -14.157 -5.389
32 2HH2 ARG 3 2HH2 ARG 3 9.439 -15.838 -4.983
33 H GLY 4 H GLY 4 10.517 -10.857 -0.442
34 1HA GLY 4 2HA GLY 4 9.381 -9.280 1.494
35 2HA GLY 4 1HA GLY 4 11.071 -8.794 1.447
36 H ILE 5 H ILE 5 8.061 -8.890 -0.306
37 HA ILE 5 HA ILE 5 9.233 -7.052 -2.293
38 HB ILE 5 HB ILE 5 6.785 -8.752 -2.734
39 1HG1 ILE 5 2HG1 ILE 5 8.738 -10.212 -2.368
40 2HG1 ILE 5 1HG1 ILE 5 8.213 -10.258 -4.049
41 1HG2 ILE 5 1HG2 ILE 5 6.562 -7.465 -4.531
42 2HG2 ILE 5 2HG2 ILE 5 8.088 -8.111 -5.135
43 3HG2 ILE 5 3HG2 ILE 5 8.075 -6.630 -4.177
44 1HD1 ILE 5 1HD1 ILE 5 10.370 -9.959 -4.513
45 2HD1 ILE 5 2HD1 ILE 5 10.736 -9.373 -2.891
46 3HD1 ILE 5 3HD1 ILE 5 10.072 -8.272 -4.097
47 H VAL 6 H VAL 6 8.650 -5.030 -1.893
48 HA VAL 6 HA VAL 6 5.967 -4.514 -0.800
49 HB VAL 6 HB VAL 6 7.897 -3.584 0.491
50 1HG1 VAL 6 1HG1 VAL 6 9.499 -3.050 -1.135
51 2HG1 VAL 6 2HG1 VAL 6 8.926 -1.492 -0.549
52 3HG1 VAL 6 3HG1 VAL 6 8.349 -2.115 -2.079
53 1HG2 VAL 6 1HG2 VAL 6 5.514 -2.481 0.125
54 2HG2 VAL 6 2HG2 VAL 6 6.492 -1.201 -0.586
55 3HG2 VAL 6 3HG2 VAL 6 6.766 -1.698 1.084
56 H TRP 7 H TRP 7 4.479 -3.571 -2.048
57 HA TRP 7 HA TRP 7 5.402 -2.357 -4.563
58 1HB TRP 7 2HB TRP 7 3.068 -4.128 -3.965
59 2HB TRP 7 1HB TRP 7 2.975 -2.991 -5.307
60 HD1 TRP 7 HD1 TRP 7 6.429 -4.308 -4.836
61 HE1 TRP 7 1HE TRP 7 6.983 -6.032 -6.648
62 HE3 TRP 7 3HE TRP 7 1.730 -5.043 -6.709
63 HZ2 TRP 7 2HZ TRP 7 5.613 -7.529 -8.609
64 HZ3 TRP 7 3HZ TRP 7 1.440 -6.643 -8.557
65 HH2 TRP 7 HH2 TRP 7 3.341 -7.860 -9.484
66 H VAL 8 H VAL 8 4.877 -0.321 -4.933
67 HA VAL 8 HA VAL 8 2.919 0.941 -3.131
68 HB VAL 8 HB VAL 8 5.062 2.594 -4.332
69 1HG1 VAL 8 1HG1 VAL 8 4.851 3.276 -1.727
70 2HG1 VAL 8 2HG1 VAL 8 3.243 2.636 -2.039
71 3HG1 VAL 8 3HG1 VAL 8 3.868 3.958 -3.020
72 1HG2 VAL 8 1HG2 VAL 8 6.163 1.757 -1.908
73 2HG2 VAL 8 2HG2 VAL 8 6.760 1.386 -3.524
74 3HG2 VAL 8 3HG2 VAL 8 5.667 0.270 -2.710
75 H VAL 9 H VAL 9 1.639 2.613 -3.925
76 HA VAL 9 HA VAL 9 1.660 2.944 -6.847
77 HB VAL 9 HB VAL 9 -0.993 3.329 -5.731
78 1HG1 VAL 9 1HG1 VAL 9 0.304 1.879 -7.981
79 2HG1 VAL 9 2HG1 VAL 9 -0.929 3.128 -8.021
80 3HG1 VAL 9 3HG1 VAL 9 -1.358 1.476 -7.577
81 1HG2 VAL 9 1HG2 VAL 9 0.310 0.635 -5.352
82 2HG2 VAL 9 2HG2 VAL 9 -1.437 0.864 -5.420
83 3HG2 VAL 9 3HG2 VAL 9 -0.496 1.626 -4.138
84 H ASP 10 H ASP 10 2.212 4.949 -7.309
85 HA ASP 10 HA ASP 10 0.811 7.202 -6.239
86 1HB ASP 10 2HB ASP 10 2.895 6.403 -4.665
87 2HB ASP 10 1HB ASP 10 3.689 7.558 -5.729
88 H ASP 11 H ASP 11 2.809 9.140 -6.801
89 HA ASP 11 HA ASP 11 2.460 9.417 -9.584
90 1HB ASP 11 2HB ASP 11 2.874 11.188 -7.663
91 2HB ASP 11 1HB ASP 11 4.551 10.999 -8.165
92 H ASP 12 H ASP 12 4.542 7.329 -8.126
93 HA ASP 12 HA ASP 12 6.332 6.144 -8.879
94 1HB ASP 12 2HB ASP 12 4.921 6.504 -11.085
95 2HB ASP 12 1HB ASP 12 6.275 7.538 -11.527
96 H SER 13 H SER 13 8.371 6.964 -10.733
97 HA SER 13 HA SER 13 10.482 7.773 -10.364
98 1HB SER 13 2HB SER 13 9.081 9.222 -11.940
99 2HB SER 13 1HB SER 13 9.095 10.412 -10.642
100 HG SER 13 HG SER 13 11.290 9.344 -12.070
101 H SER 14 H SER 14 9.054 10.650 -8.975
102 HA SER 14 HA SER 14 10.939 10.952 -6.978
103 1HB SER 14 2HB SER 14 9.140 12.606 -7.846
104 2HB SER 14 1HB SER 14 8.117 11.910 -6.591
105 HG SER 14 HG SER 14 10.315 13.570 -6.372
106 H ILE 15 H ILE 15 7.612 9.706 -6.566
107 HA ILE 15 HA ILE 15 7.987 8.968 -3.867
108 HB ILE 15 HB ILE 15 5.971 7.743 -5.743
109 1HG1 ILE 15 2HG1 ILE 15 5.866 10.198 -5.911
110 2HG1 ILE 15 1HG1 ILE 15 4.443 9.545 -5.105
111 1HG2 ILE 15 1HG2 ILE 15 4.688 7.291 -3.809
112 2HG2 ILE 15 2HG2 ILE 15 5.727 8.293 -2.797
113 3HG2 ILE 15 3HG2 ILE 15 6.332 6.770 -3.446
114 1HD1 ILE 15 1HD1 ILE 15 6.149 11.571 -4.209
115 2HD1 ILE 15 2HD1 ILE 15 6.442 10.183 -3.161
116 3HD1 ILE 15 3HD1 ILE 15 4.808 10.822 -3.343
117 H ARG 16 H ARG 16 8.749 7.424 -6.854
118 HA ARG 16 HA ARG 16 8.976 4.764 -5.786
119 1HB ARG 16 2HB ARG 16 8.510 5.286 -8.201
120 2HB ARG 16 1HB ARG 16 10.171 5.844 -8.338
121 1HG ARG 16 2HG ARG 16 10.161 3.246 -7.157
122 2HG ARG 16 1HG ARG 16 9.186 3.221 -8.627
123 1HD ARG 16 2HD ARG 16 11.849 4.560 -8.669
124 2HD ARG 16 1HD ARG 16 11.768 2.799 -8.727
125 HE ARG 16 HE ARG 16 10.017 4.003 -10.623
126 1HH1 ARG 16 1HH1 ARG 16 13.355 3.161 -10.050
127 2HH1 ARG 16 2HH1 ARG 16 13.745 3.053 -11.733
128 1HH2 ARG 16 1HH2 ARG 16 10.525 3.861 -12.829
129 2HH2 ARG 16 2HH2 ARG 16 12.137 3.449 -13.312
130 H TRP 17 H TRP 17 11.235 7.355 -6.659
131 HA TRP 17 HA TRP 17 13.581 5.927 -6.084
132 1HB TRP 17 2HB TRP 17 13.526 8.003 -7.429
133 2HB TRP 17 1HB TRP 17 13.179 8.919 -5.963
134 HD1 TRP 17 HD1 TRP 17 15.990 6.887 -7.617
135 HE1 TRP 17 1HE TRP 17 18.226 7.559 -6.531
136 HE3 TRP 17 3HE TRP 17 14.210 9.932 -3.918
137 HZ2 TRP 17 2HZ TRP 17 19.114 9.168 -4.388
138 HZ3 TRP 17 3HZ TRP 17 15.817 11.001 -2.393
139 HH2 TRP 17 HH2 TRP 17 18.218 10.626 -2.624
140 H VAL 18 H VAL 18 11.551 7.991 -4.073
141 HA VAL 18 HA VAL 18 13.288 8.030 -1.849
142 HB VAL 18 HB VAL 18 10.312 8.363 -1.664
143 1HG1 VAL 18 1HG1 VAL 18 12.629 9.497 -0.102
144 2HG1 VAL 18 2HG1 VAL 18 11.477 8.285 0.448
145 3HG1 VAL 18 3HG1 VAL 18 10.938 9.935 0.141
146 1HG2 VAL 18 1HG2 VAL 18 12.037 9.836 -3.335
147 2HG2 VAL 18 2HG2 VAL 18 11.678 10.860 -1.943
148 3HG2 VAL 18 3HG2 VAL 18 10.362 10.197 -2.911
149 H LEU 19 H LEU 19 10.518 6.001 -2.625
150 HA LEU 19 HA LEU 19 10.780 4.573 -0.153
151 1HB LEU 19 2HB LEU 19 8.692 5.001 -1.951
152 2HB LEU 19 1HB LEU 19 9.020 3.280 -2.032
153 HG LEU 19 HG LEU 19 8.712 3.087 0.388
154 1HD1 LEU 19 1HD1 LEU 19 8.051 6.027 0.297
155 2HD1 LEU 19 2HD1 LEU 19 9.495 5.317 1.018
156 3HD1 LEU 19 3HD1 LEU 19 7.908 4.972 1.703
157 1HD2 LEU 19 1HD2 LEU 19 6.619 2.651 -0.209
158 2HD2 LEU 19 2HD2 LEU 19 6.672 3.853 -1.497
159 3HD2 LEU 19 3HD2 LEU 19 6.229 4.335 0.141
160 H GLU 20 H GLU 20 11.955 4.160 -3.363
161 HA GLU 20 HA GLU 20 12.272 1.354 -3.254
162 1HB GLU 20 2HB GLU 20 13.687 1.544 -5.178
163 2HB GLU 20 1HB GLU 20 12.318 2.619 -5.370
164 1HG GLU 20 2HG GLU 20 13.742 4.506 -4.735
165 2HG GLU 20 1HG GLU 20 15.114 3.408 -4.606
166 H ARG 21 H ARG 21 14.642 3.946 -2.857
167 HA ARG 21 HA ARG 21 16.735 2.270 -2.018
168 1HB ARG 21 2HB ARG 21 16.271 5.214 -1.544
169 2HB ARG 21 1HB ARG 21 17.761 4.378 -1.124
170 1HG ARG 21 2HG ARG 21 17.024 3.831 -3.851
171 2HG ARG 21 1HG ARG 21 17.115 5.569 -3.560
172 1HD ARG 21 2HD ARG 21 19.359 5.450 -2.894
173 2HD ARG 21 1HD ARG 21 19.283 3.706 -2.650
174 HE ARG 21 HE ARG 21 18.838 4.573 -5.368
175 1HH1 ARG 21 1HH1 ARG 21 21.186 3.539 -3.003
176 2HH1 ARG 21 2HH1 ARG 21 22.343 3.037 -4.188
177 1HH2 ARG 21 1HH2 ARG 21 20.356 3.915 -6.929
178 2HH2 ARG 21 2HH2 ARG 21 21.873 3.251 -6.420
179 H ALA 22 H ALA 22 14.498 4.269 -0.099
180 HA ALA 22 HA ALA 22 15.492 3.672 2.415
181 1HB ALA 22 1HB ALA 22 13.477 5.212 1.543
182 2HB ALA 22 2HB ALA 22 13.671 4.747 3.233
183 3HB ALA 22 3HB ALA 22 12.556 3.859 2.195
184 H LEU 23 H LEU 23 12.822 2.081 0.768
185 HA LEU 23 HA LEU 23 12.541 0.019 2.672
186 1HB LEU 23 2HB LEU 23 10.852 0.800 0.929
187 2HB LEU 23 1HB LEU 23 11.750 -0.168 -0.222
188 HG LEU 23 HG LEU 23 9.633 -1.145 0.914
189 1HD1 LEU 23 1HD1 LEU 23 11.364 -2.281 -0.553
190 2HD1 LEU 23 2HD1 LEU 23 10.426 -3.312 0.524
191 3HD1 LEU 23 3HD1 LEU 23 12.081 -2.876 0.942
192 1HD2 LEU 23 1HD2 LEU 23 10.291 -0.645 3.210
193 2HD2 LEU 23 2HD2 LEU 23 11.693 -1.699 3.041
194 3HD2 LEU 23 3HD2 LEU 23 10.067 -2.376 2.962
195 H ALA 24 H ALA 24 14.586 0.447 -0.084
196 HA ALA 24 HA ALA 24 15.327 -2.266 -0.417
197 1HB ALA 24 1HB ALA 24 15.744 -0.712 -2.208
198 2HB ALA 24 2HB ALA 24 17.288 -1.347 -1.640
199 3HB ALA 24 3HB ALA 24 16.775 0.273 -1.168
200 H GLY 25 H GLY 25 16.392 0.382 1.624
201 1HA GLY 25 2HA GLY 25 18.785 -0.757 2.585
202 2HA GLY 25 1HA GLY 25 17.801 0.427 3.437
203 H ALA 26 H ALA 26 15.445 -1.397 3.305
204 HA ALA 26 HA ALA 26 15.936 -2.779 5.758
205 1HB ALA 26 1HB ALA 26 13.524 -3.615 5.256
206 2HB ALA 26 2HB ALA 26 13.559 -2.381 3.997
207 3HB ALA 26 3HB ALA 26 13.794 -1.928 5.684
208 H GLY 27 H GLY 27 16.244 -3.551 2.459
209 1HA GLY 27 2HA GLY 27 17.338 -5.526 1.746
210 2HA GLY 27 1HA GLY 27 16.729 -6.347 3.173
211 H LEU 28 H LEU 28 14.540 -4.423 1.202
212 HA LEU 28 HA LEU 28 13.564 -6.905 0.010
213 1HB LEU 28 2HB LEU 28 11.483 -4.957 0.726
214 2HB LEU 28 1HB LEU 28 11.449 -6.705 0.773
215 HG LEU 28 HG LEU 28 13.129 -6.276 2.804
216 1HD1 LEU 28 1HD1 LEU 28 13.169 -3.914 2.692
217 2HD1 LEU 28 2HD1 LEU 28 12.211 -4.352 4.107
218 3HD1 LEU 28 3HD1 LEU 28 11.407 -3.826 2.628
219 1HD2 LEU 28 1HD2 LEU 28 10.418 -7.000 2.478
220 2HD2 LEU 28 2HD2 LEU 28 10.505 -5.908 3.860
221 3HD2 LEU 28 3HD2 LEU 28 11.493 -7.369 3.827
222 H THR 29 H THR 29 11.829 -6.411 -1.721
223 HA THR 29 HA THR 29 13.029 -4.437 -3.511
224 HB THR 29 HB THR 29 11.091 -6.703 -3.962
225 HG1 THR 29 1HG THR 29 13.819 -6.301 -4.373
226 1HG2 THR 29 1HG2 THR 29 11.691 -4.436 -5.695
227 2HG2 THR 29 2HG2 THR 29 10.368 -5.603 -5.753
228 3HG2 THR 29 3HG2 THR 29 11.938 -6.014 -6.444
229 H CYS 30 H CYS 30 12.070 -2.579 -4.089
230 HA CYS 30 HA CYS 30 9.234 -2.202 -3.382
231 1HB CYS 30 2HB CYS 30 10.743 -0.994 -1.832
232 2HB CYS 30 1HB CYS 30 11.404 -0.119 -3.205
233 HG CYS 30 HG CYS 30 8.765 0.472 -1.812
234 H THR 31 H THR 31 8.041 -1.982 -5.066
235 HA THR 31 HA THR 31 9.077 -0.537 -7.420
236 HB THR 31 HB THR 31 8.490 -3.076 -7.620
237 HG1 THR 31 1HG THR 31 8.586 -1.311 -9.348
238 1HG2 THR 31 1HG2 THR 31 6.349 -2.959 -6.453
239 2HG2 THR 31 2HG2 THR 31 6.178 -3.569 -8.097
240 3HG2 THR 31 3HG2 THR 31 5.730 -1.908 -7.716
241 H THR 32 H THR 32 7.430 0.784 -8.538
242 HA THR 32 HA THR 32 5.124 1.418 -6.856
243 HB THR 32 HB THR 32 5.478 3.802 -7.184
244 HG1 THR 32 1HG THR 32 6.675 4.349 -8.802
245 1HG2 THR 32 1HG2 THR 32 7.371 4.145 -5.796
246 2HG2 THR 32 2HG2 THR 32 8.058 2.581 -6.244
247 3HG2 THR 32 3HG2 THR 32 6.595 2.656 -5.268
248 H PHE 33 H PHE 33 3.324 2.314 -7.889
249 HA PHE 33 HA PHE 33 3.280 2.073 -10.821
250 1HB PHE 33 2HB PHE 33 1.020 1.297 -8.981
251 2HB PHE 33 1HB PHE 33 1.045 1.157 -10.723
252 HD1 PHE 33 1HD PHE 33 1.411 -0.974 -11.564
253 HD2 PHE 33 2HD PHE 33 3.086 0.098 -7.815
254 HE1 PHE 33 1HE PHE 33 2.313 -3.245 -11.331
255 HE2 PHE 33 2HE PHE 33 4.009 -2.160 -7.572
256 HZ PHE 33 HZ PHE 33 3.607 -3.854 -9.335
257 H GLU 34 H GLU 34 1.139 3.133 -11.661
258 HA GLU 34 HA GLU 34 1.347 5.865 -11.157
259 1HB GLU 34 2HB GLU 34 -0.803 5.953 -12.523
260 2HB GLU 34 1HB GLU 34 0.581 5.161 -13.266
261 1HG GLU 34 2HG GLU 34 -0.556 3.287 -13.529
262 2HG GLU 34 1HG GLU 34 -0.943 3.233 -11.813
263 H ASN 35 H ASN 35 -1.968 5.075 -11.129
264 HA ASN 35 HA ASN 35 -2.367 6.437 -8.665
265 1HB ASN 35 2HB ASN 35 -3.942 5.737 -10.976
266 2HB ASN 35 1HB ASN 35 -4.817 5.398 -9.487
267 1HD2 ASN 35 1HD2 ASN 35 -2.507 7.951 -10.328
268 2HD2 ASN 35 2HD2 ASN 35 -3.575 9.264 -9.984
269 H GLY 36 H GLY 36 -3.767 3.406 -9.780
270 1HA GLY 36 2HA GLY 36 -2.929 1.963 -7.456
271 2HA GLY 36 1HA GLY 36 -4.603 2.443 -7.359
272 H ASN 37 H ASN 37 -5.191 2.125 -10.174
273 HA ASN 37 HA ASN 37 -5.898 -0.593 -10.151
274 1HB ASN 37 2HB ASN 37 -5.931 1.515 -12.284
275 2HB ASN 37 1HB ASN 37 -6.325 -0.157 -12.673
276 1HD2 ASN 37 1HD2 ASN 37 -7.779 -1.067 -10.677
277 2HD2 ASN 37 2HD2 ASN 37 -9.206 -0.126 -10.428
278 H GLU 38 H GLU 38 -3.098 1.084 -11.369
279 HA GLU 38 HA GLU 38 -2.085 -0.791 -13.141
280 1HB GLU 38 2HB GLU 38 -1.165 1.540 -11.991
281 2HB GLU 38 1HB GLU 38 -0.038 0.334 -11.408
282 1HG GLU 38 2HG GLU 38 -0.383 -0.176 -14.145
283 2HG GLU 38 1HG GLU 38 -0.191 1.565 -13.980
284 H VAL 39 H VAL 39 -1.339 -0.565 -9.605
285 HA VAL 39 HA VAL 39 0.197 -2.876 -9.441
286 HB VAL 39 HB VAL 39 -1.766 -2.252 -7.252
287 1HG1 VAL 39 1HG1 VAL 39 -0.518 -4.030 -6.566
288 2HG1 VAL 39 2HG1 VAL 39 0.515 -2.719 -6.006
289 3HG1 VAL 39 3HG1 VAL 39 0.888 -3.553 -7.513
290 1HG2 VAL 39 1HG2 VAL 39 0.542 -0.800 -6.679
291 2HG2 VAL 39 2HG2 VAL 39 -1.046 -0.160 -7.092
292 3HG2 VAL 39 3HG2 VAL 39 0.159 -0.405 -8.354
293 H LEU 40 H LEU 40 -3.318 -2.549 -9.153
294 HA LEU 40 HA LEU 40 -3.957 -5.192 -8.581
295 1HB LEU 40 2HB LEU 40 -5.620 -3.430 -10.367
296 2HB LEU 40 1HB LEU 40 -6.171 -4.701 -9.292
297 HG LEU 40 HG LEU 40 -5.001 -2.054 -8.421
298 1HD1 LEU 40 1HD1 LEU 40 -7.749 -3.001 -8.909
299 2HD1 LEU 40 2HD1 LEU 40 -7.083 -1.369 -8.950
300 3HD1 LEU 40 3HD1 LEU 40 -7.486 -2.113 -7.408
301 1HD2 LEU 40 1HD2 LEU 40 -5.597 -4.563 -7.014
302 2HD2 LEU 40 2HD2 LEU 40 -6.193 -3.096 -6.239
303 3HD2 LEU 40 3HD2 LEU 40 -4.474 -3.267 -6.600
304 H ALA 41 H ALA 41 -3.469 -3.630 -11.715
305 HA ALA 41 HA ALA 41 -4.178 -5.826 -13.317
306 1HB ALA 41 1HB ALA 41 -2.157 -3.744 -14.076
307 2HB ALA 41 2HB ALA 41 -3.889 -3.417 -14.033
308 3HB ALA 41 3HB ALA 41 -3.248 -4.640 -15.130
309 H ALA 42 H ALA 42 -1.031 -4.706 -12.212
310 HA ALA 42 HA ALA 42 0.431 -6.849 -13.361
311 1HB ALA 42 1HB ALA 42 1.166 -4.448 -12.441
312 2HB ALA 42 2HB ALA 42 2.293 -5.793 -12.608
313 3HB ALA 42 3HB ALA 42 1.589 -5.423 -11.032
314 H LEU 43 H LEU 43 -1.261 -6.402 -10.381
315 HA LEU 43 HA LEU 43 0.009 -8.363 -8.825
316 1HB LEU 43 2HB LEU 43 -2.614 -6.973 -8.758
317 2HB LEU 43 1HB LEU 43 -2.408 -8.397 -7.755
318 HG LEU 43 HG LEU 43 -0.375 -6.211 -7.618
319 1HD1 LEU 43 1HD1 LEU 43 -2.217 -4.865 -7.281
320 2HD1 LEU 43 2HD1 LEU 43 -1.857 -5.408 -5.644
321 3HD1 LEU 43 3HD1 LEU 43 -3.150 -6.163 -6.567
322 1HD2 LEU 43 1HD2 LEU 43 -1.352 -8.453 -5.913
323 2HD2 LEU 43 2HD2 LEU 43 -0.599 -7.047 -5.158
324 3HD2 LEU 43 3HD2 LEU 43 0.298 -8.000 -6.342
325 H ALA 44 H ALA 44 -2.177 -8.606 -11.453
326 HA ALA 44 HA ALA 44 -3.430 -11.040 -10.893
327 1HB ALA 44 1HB ALA 44 -3.178 -11.093 -13.608
328 2HB ALA 44 2HB ALA 44 -2.980 -9.377 -13.260
329 3HB ALA 44 3HB ALA 44 -4.433 -10.221 -12.727
330 H SER 45 H SER 45 -0.152 -10.376 -11.593
331 HA SER 45 HA SER 45 0.338 -13.211 -12.081
332 1HB SER 45 2HB SER 45 1.441 -10.799 -13.395
333 2HB SER 45 1HB SER 45 2.569 -12.123 -13.100
334 HG SER 45 HG SER 45 1.471 -12.251 -15.140
335 H LYS 46 H LYS 46 0.603 -10.940 -9.743
336 HA LYS 46 HA LYS 46 2.484 -12.471 -8.260
337 1HB LYS 46 2HB LYS 46 3.706 -10.668 -9.891
338 2HB LYS 46 1HB LYS 46 3.492 -9.710 -8.432
339 1HG LYS 46 2HG LYS 46 4.453 -12.110 -7.482
340 2HG LYS 46 1HG LYS 46 5.342 -11.874 -8.987
341 1HD LYS 46 2HD LYS 46 5.484 -9.389 -7.913
342 2HD LYS 46 1HD LYS 46 5.472 -10.381 -6.454
343 1HE LYS 46 2HE LYS 46 7.387 -11.607 -7.186
344 2HE LYS 46 1HE LYS 46 7.318 -10.864 -8.783
345 1HZ LYS 46 1HZ LYS 46 7.621 -8.684 -7.470
346 2HZ LYS 46 2HZ LYS 46 8.967 -9.673 -7.731
347 3HZ LYS 46 3HZ LYS 46 8.190 -9.686 -6.231
348 H THR 47 H THR 47 2.790 -11.650 -6.063
349 HA THR 47 HA THR 47 0.874 -9.620 -5.264
350 HB THR 47 HB THR 47 1.045 -12.388 -4.071
351 HG1 THR 47 1HG THR 47 -0.389 -11.530 -6.044
352 1HG2 THR 47 1HG2 THR 47 -0.495 -11.810 -2.428
353 2HG2 THR 47 2HG2 THR 47 -0.893 -10.279 -3.207
354 3HG2 THR 47 3HG2 THR 47 0.668 -10.485 -2.412
355 HA PRO 48 HA PRO 48 4.653 -8.525 -3.030
356 1HB PRO 48 2HB PRO 48 3.725 -6.142 -2.107
357 2HB PRO 48 1HB PRO 48 4.329 -6.363 -3.752
358 1HG PRO 48 2HG PRO 48 1.498 -6.358 -2.764
359 2HG PRO 48 1HG PRO 48 2.184 -5.552 -4.187
360 1HD PRO 48 2HD PRO 48 0.850 -7.862 -4.391
361 2HD PRO 48 1HD PRO 48 2.238 -7.497 -5.426
362 H ASP 49 H ASP 49 5.220 -8.377 -0.820
363 HA ASP 49 HA ASP 49 3.414 -9.704 0.957
364 1HB ASP 49 2HB ASP 49 6.125 -8.452 1.437
365 2HB ASP 49 1HB ASP 49 5.246 -9.404 2.628
366 H VAL 50 H VAL 50 4.263 -6.390 0.342
367 HA VAL 50 HA VAL 50 2.306 -5.533 2.336
368 HB VAL 50 HB VAL 50 4.435 -5.464 3.516
369 1HG1 VAL 50 1HG1 VAL 50 5.445 -4.715 1.004
370 2HG1 VAL 50 2HG1 VAL 50 6.344 -4.968 2.499
371 3HG1 VAL 50 3HG1 VAL 50 5.753 -3.359 2.091
372 1HG2 VAL 50 1HG2 VAL 50 3.274 -2.802 2.741
373 2HG2 VAL 50 2HG2 VAL 50 4.520 -2.972 3.977
374 3HG2 VAL 50 3HG2 VAL 50 2.958 -3.759 4.190
375 H LEU 51 H LEU 51 0.900 -4.634 0.876
376 HA LEU 51 HA LEU 51 1.915 -2.974 -1.270
377 1HB LEU 51 2HB LEU 51 -0.005 -4.586 -1.540
378 2HB LEU 51 1HB LEU 51 -0.962 -3.506 -0.547
379 HG LEU 51 HG LEU 51 -0.778 -1.743 -2.205
380 1HD1 LEU 51 1HD1 LEU 51 1.525 -2.974 -3.009
381 2HD1 LEU 51 2HD1 LEU 51 0.689 -1.702 -3.898
382 3HD1 LEU 51 3HD1 LEU 51 0.409 -3.399 -4.302
383 1HD2 LEU 51 1HD2 LEU 51 -1.540 -3.732 -4.128
384 2HD2 LEU 51 2HD2 LEU 51 -2.552 -2.604 -3.226
385 3HD2 LEU 51 3HD2 LEU 51 -2.151 -4.176 -2.535
386 H LEU 52 H LEU 52 1.808 -0.805 -1.427
387 HA LEU 52 HA LEU 52 0.577 0.687 0.802
388 1HB LEU 52 2HB LEU 52 3.196 0.464 0.655
389 2HB LEU 52 1HB LEU 52 3.034 1.681 -0.589
390 HG LEU 52 HG LEU 52 2.190 1.969 2.294
391 1HD1 LEU 52 1HD1 LEU 52 3.978 3.859 2.027
392 2HD1 LEU 52 2HD1 LEU 52 4.573 2.824 0.730
393 3HD1 LEU 52 3HD1 LEU 52 4.466 2.201 2.376
394 1HD2 LEU 52 1HD2 LEU 52 1.409 3.439 -0.066
395 2HD2 LEU 52 2HD2 LEU 52 2.264 4.471 1.073
396 3HD2 LEU 52 3HD2 LEU 52 0.829 3.586 1.591
397 H SER 53 H SER 53 -0.846 2.220 0.145
398 HA SER 53 HA SER 53 -0.622 3.192 -2.625
399 1HB SER 53 2HB SER 53 -2.804 1.741 -1.428
400 2HB SER 53 1HB SER 53 -3.346 3.344 -1.931
401 HG SER 53 HG SER 53 -2.667 2.910 -4.000
402 H ASP 54 H ASP 54 -0.603 5.298 -2.884
403 HA ASP 54 HA ASP 54 -0.695 7.024 -0.596
404 1HB ASP 54 2HB ASP 54 0.629 7.065 -3.010
405 2HB ASP 54 1HB ASP 54 -0.580 8.330 -3.213
406 H ILE 55 H ILE 55 -3.159 5.785 -2.399
407 HA ILE 55 HA ILE 55 -5.234 6.512 -3.089
408 HB ILE 55 HB ILE 55 -5.661 6.001 -0.781
409 1HG1 ILE 55 2HG1 ILE 55 -6.972 8.669 -1.236
410 2HG1 ILE 55 1HG1 ILE 55 -7.377 7.260 -2.202
411 1HG2 ILE 55 1HG2 ILE 55 -3.872 7.506 0.139
412 2HG2 ILE 55 2HG2 ILE 55 -5.388 7.490 1.035
413 3HG2 ILE 55 3HG2 ILE 55 -5.011 8.840 -0.034
414 1HD1 ILE 55 1HD1 ILE 55 -7.852 6.100 0.024
415 2HD1 ILE 55 2HD1 ILE 55 -9.001 7.316 -0.534
416 3HD1 ILE 55 3HD1 ILE 55 -7.827 7.721 0.716
417 H ARG 56 H ARG 56 -4.978 7.937 -4.770
418 HA ARG 56 HA ARG 56 -4.949 10.795 -4.052
419 1HB ARG 56 2HB ARG 56 -3.659 9.318 -6.317
420 2HB ARG 56 1HB ARG 56 -4.060 11.022 -6.488
421 1HG ARG 56 2HG ARG 56 -2.759 10.890 -4.051
422 2HG ARG 56 1HG ARG 56 -1.869 9.761 -5.074
423 1HD ARG 56 2HD ARG 56 -1.733 11.556 -6.803
424 2HD ARG 56 1HD ARG 56 -2.450 12.662 -5.634
425 HE ARG 56 HE ARG 56 0.036 11.266 -4.956
426 1HH1 ARG 56 1HH1 ARG 56 -1.634 14.252 -5.688
427 2HH1 ARG 56 2HH1 ARG 56 -0.343 15.251 -5.117
428 1HH2 ARG 56 1HH2 ARG 56 1.728 12.589 -4.211
429 2HH2 ARG 56 2HH2 ARG 56 1.561 14.312 -4.279
430 H MET 57 H MET 57 -7.344 9.354 -4.136
431 HA MET 57 HA MET 57 -9.440 9.463 -4.961
432 1HB MET 57 2HB MET 57 -8.241 12.019 -5.489
433 2HB MET 57 1HB MET 57 -9.416 11.635 -6.739
434 1HG MET 57 2HG MET 57 -10.754 10.941 -4.465
435 2HG MET 57 1HG MET 57 -9.814 12.330 -3.933
436 1HE MET 57 1HE MET 57 -10.035 14.605 -4.628
437 2HE MET 57 2HE MET 57 -11.161 15.280 -5.806
438 3HE MET 57 3HE MET 57 -9.733 14.401 -6.353
439 HA PRO 58 HA PRO 58 -7.870 7.798 -9.175
440 1HB PRO 58 2HB PRO 58 -8.221 5.142 -8.557
441 2HB PRO 58 1HB PRO 58 -6.676 5.991 -8.437
442 1HG PRO 58 2HG PRO 58 -8.655 5.341 -6.293
443 2HG PRO 58 1HG PRO 58 -6.884 5.270 -6.245
444 1HD PRO 58 2HD PRO 58 -8.269 7.297 -5.139
445 2HD PRO 58 1HD PRO 58 -6.682 7.546 -5.890
446 H GLY 59 H GLY 59 -10.026 5.504 -7.550
447 1HA GLY 59 2HA GLY 59 -12.166 6.284 -9.429
448 2HA GLY 59 1HA GLY 59 -12.003 4.691 -8.691
449 H MET 60 H MET 60 -12.411 4.495 -6.416
450 HA MET 60 HA MET 60 -14.488 6.315 -5.487
451 1HB MET 60 2HB MET 60 -14.945 3.924 -5.214
452 2HB MET 60 1HB MET 60 -13.457 3.718 -4.306
453 1HG MET 60 2HG MET 60 -14.932 3.802 -2.579
454 2HG MET 60 1HG MET 60 -14.562 5.522 -2.733
455 1HE MET 60 1HE MET 60 -16.841 2.791 -2.697
456 2HE MET 60 2HE MET 60 -17.522 2.930 -4.317
457 3HE MET 60 3HE MET 60 -18.456 3.466 -2.920
458 H ASP 61 H ASP 61 -12.471 7.796 -5.588
459 HA ASP 61 HA ASP 61 -11.111 9.224 -4.480
460 1HB ASP 61 2HB ASP 61 -12.869 8.147 -2.442
461 2HB ASP 61 1HB ASP 61 -11.307 8.637 -1.791
462 H GLY 62 H GLY 62 -10.884 5.880 -4.058
463 1HA GLY 62 2HA GLY 62 -8.442 5.178 -4.386
464 2HA GLY 62 1HA GLY 62 -8.216 6.021 -2.860
465 H LEU 63 H LEU 63 -10.846 5.258 -1.870
466 HA LEU 63 HA LEU 63 -10.220 2.925 -0.468
467 1HB LEU 63 2HB LEU 63 -12.303 4.799 -0.517
468 2HB LEU 63 1HB LEU 63 -13.077 3.267 -0.865
469 HG LEU 63 HG LEU 63 -12.416 2.342 1.212
470 1HD1 LEU 63 1HD1 LEU 63 -10.203 2.957 1.511
471 2HD1 LEU 63 2HD1 LEU 63 -11.065 3.759 2.823
472 3HD1 LEU 63 3HD1 LEU 63 -10.562 4.680 1.403
473 1HD2 LEU 63 1HD2 LEU 63 -12.950 4.901 2.435
474 2HD2 LEU 63 2HD2 LEU 63 -13.947 3.449 2.364
475 3HD2 LEU 63 3HD2 LEU 63 -13.998 4.615 1.044
476 H ALA 64 H ALA 64 -11.682 3.489 -3.569
477 HA ALA 64 HA ALA 64 -12.914 1.053 -4.091
478 1HB ALA 64 1HB ALA 64 -12.156 3.334 -5.560
479 2HB ALA 64 2HB ALA 64 -13.256 2.047 -6.054
480 3HB ALA 64 3HB ALA 64 -11.539 1.938 -6.443
481 H LEU 65 H LEU 65 -9.516 1.963 -4.270
482 HA LEU 65 HA LEU 65 -8.436 -0.221 -5.565
483 1HB LEU 65 2HB LEU 65 -7.475 1.959 -4.091
484 2HB LEU 65 1HB LEU 65 -6.801 0.549 -3.299
485 HG LEU 65 HG LEU 65 -5.781 -0.173 -5.393
486 1HD1 LEU 65 1HD1 LEU 65 -6.403 2.355 -6.781
487 2HD1 LEU 65 2HD1 LEU 65 -7.711 1.181 -6.669
488 3HD1 LEU 65 3HD1 LEU 65 -6.185 0.728 -7.423
489 1HD2 LEU 65 1HD2 LEU 65 -5.171 2.740 -4.920
490 2HD2 LEU 65 2HD2 LEU 65 -4.084 1.498 -5.543
491 3HD2 LEU 65 3HD2 LEU 65 -4.626 1.435 -3.866
492 H LEU 66 H LEU 66 -9.068 0.146 -2.084
493 HA LEU 66 HA LEU 66 -8.158 -2.310 -1.200
494 1HB LEU 66 2HB LEU 66 -10.475 -0.652 -0.244
495 2HB LEU 66 1HB LEU 66 -9.843 -2.037 0.628
496 HG LEU 66 HG LEU 66 -8.327 0.496 -0.003
497 1HD1 LEU 66 1HD1 LEU 66 -8.821 1.236 2.054
498 2HD1 LEU 66 2HD1 LEU 66 -8.787 -0.372 2.764
499 3HD1 LEU 66 3HD1 LEU 66 -10.215 0.179 1.887
500 1HD2 LEU 66 1HD2 LEU 66 -6.712 -1.197 0.009
501 2HD2 LEU 66 2HD2 LEU 66 -7.518 -2.080 1.306
502 3HD2 LEU 66 3HD2 LEU 66 -6.693 -0.561 1.654
503 H LYS 67 H LYS 67 -11.320 -1.469 -2.532
504 HA LYS 67 HA LYS 67 -12.580 -3.931 -2.115
505 1HB LYS 67 2HB LYS 67 -12.959 -1.771 -4.174
506 2HB LYS 67 1HB LYS 67 -13.949 -3.225 -4.181
507 1HG LYS 67 2HG LYS 67 -14.593 -2.705 -1.827
508 2HG LYS 67 1HG LYS 67 -13.745 -1.167 -1.998
509 1HD LYS 67 2HD LYS 67 -15.288 -0.328 -3.489
510 2HD LYS 67 1HD LYS 67 -15.808 -1.931 -4.017
511 1HE LYS 67 2HE LYS 67 -16.300 -1.011 -1.211
512 2HE LYS 67 1HE LYS 67 -17.377 -0.517 -2.516
513 1HZ LYS 67 1HZ LYS 67 -16.883 -3.219 -1.450
514 2HZ LYS 67 2HZ LYS 67 -17.463 -3.020 -3.027
515 3HZ LYS 67 3HZ LYS 67 -18.356 -2.432 -1.717
516 H GLN 68 H GLN 68 -10.688 -2.769 -4.888
517 HA GLN 68 HA GLN 68 -10.938 -5.108 -6.448
518 1HB GLN 68 2HB GLN 68 -8.613 -3.187 -6.500
519 2HB GLN 68 1HB GLN 68 -9.166 -4.221 -7.807
520 1HG GLN 68 2HG GLN 68 -10.842 -2.004 -6.664
521 2HG GLN 68 1HG GLN 68 -9.719 -1.771 -8.009
522 1HE2 GLN 68 1HE2 GLN 68 -10.015 -3.781 -9.627
523 2HE2 GLN 68 2HE2 GLN 68 -11.645 -3.962 -10.174
524 H ILE 69 H ILE 69 -8.774 -4.169 -3.882
525 HA ILE 69 HA ILE 69 -6.726 -6.027 -4.245
526 HB ILE 69 HB ILE 69 -7.765 -4.789 -1.699
527 1HG1 ILE 69 2HG1 ILE 69 -5.357 -4.009 -3.347
528 2HG1 ILE 69 1HG1 ILE 69 -6.929 -3.274 -3.547
529 1HG2 ILE 69 1HG2 ILE 69 -6.318 -5.997 -0.533
530 2HG2 ILE 69 2HG2 ILE 69 -4.994 -5.436 -1.554
531 3HG2 ILE 69 3HG2 ILE 69 -5.895 -6.886 -1.994
532 1HD1 ILE 69 1HD1 ILE 69 -6.266 -3.171 -0.800
533 2HD1 ILE 69 2HD1 ILE 69 -6.452 -1.842 -1.946
534 3HD1 ILE 69 3HD1 ILE 69 -4.880 -2.604 -1.731
535 H LYS 70 H LYS 70 -9.693 -6.283 -2.370
536 HA LYS 70 HA LYS 70 -9.177 -8.880 -1.374
537 1HB LYS 70 2HB LYS 70 -11.469 -8.881 -0.623
538 2HB LYS 70 1HB LYS 70 -10.765 -7.299 -0.328
539 1HG LYS 70 2HG LYS 70 -12.247 -6.276 -1.632
540 2HG LYS 70 1HG LYS 70 -12.078 -7.474 -2.914
541 1HD LYS 70 2HD LYS 70 -13.628 -8.945 -1.833
542 2HD LYS 70 1HD LYS 70 -13.675 -7.919 -0.399
543 1HE LYS 70 2HE LYS 70 -14.439 -6.811 -3.068
544 2HE LYS 70 1HE LYS 70 -15.593 -7.775 -2.149
545 1HZ LYS 70 1HZ LYS 70 -15.635 -6.225 -0.432
546 2HZ LYS 70 2HZ LYS 70 -15.616 -5.264 -1.824
547 3HZ LYS 70 3HZ LYS 70 -14.200 -5.476 -0.927
548 H GLN 71 H GLN 71 -10.606 -7.683 -4.289
549 HA GLN 71 HA GLN 71 -11.727 -10.213 -5.047
550 1HB GLN 71 2HB GLN 71 -11.535 -7.529 -6.368
551 2HB GLN 71 1HB GLN 71 -12.100 -8.936 -7.257
552 1HG GLN 71 2HG GLN 71 -14.039 -9.098 -6.038
553 2HG GLN 71 1HG GLN 71 -13.362 -8.256 -4.646
554 1HE2 GLN 71 1HE2 GLN 71 -12.482 -5.956 -5.515
555 2HE2 GLN 71 2HE2 GLN 71 -13.723 -5.018 -6.265
556 H ARG 72 H ARG 72 -8.883 -8.347 -5.740
557 HA ARG 72 HA ARG 72 -8.023 -10.150 -7.841
558 1HB ARG 72 2HB ARG 72 -6.686 -7.731 -6.655
559 2HB ARG 72 1HB ARG 72 -6.092 -8.635 -8.042
560 1HG ARG 72 2HG ARG 72 -8.773 -7.944 -8.587
561 2HG ARG 72 1HG ARG 72 -7.979 -6.502 -7.951
562 1HD ARG 72 2HD ARG 72 -7.606 -6.416 -10.263
563 2HD ARG 72 1HD ARG 72 -6.096 -7.022 -9.587
564 HE ARG 72 HE ARG 72 -6.479 -9.061 -10.595
565 1HH1 ARG 72 1HH1 ARG 72 -9.309 -7.041 -10.899
566 2HH1 ARG 72 2HH1 ARG 72 -10.078 -8.080 -12.051
567 1HH2 ARG 72 1HH2 ARG 72 -7.490 -10.432 -12.099
568 2HH2 ARG 72 2HH2 ARG 72 -9.044 -10.006 -12.735
569 H HIS 73 H HIS 73 -6.415 -8.866 -4.978
570 HA HIS 73 HA HIS 73 -4.806 -11.295 -4.859
571 1HB HIS 73 2HB HIS 73 -3.944 -9.605 -2.811
572 2HB HIS 73 1HB HIS 73 -3.158 -9.884 -4.355
573 HD1 HIS 73 1HD HIS 73 -3.838 -7.198 -2.380
574 HD2 HIS 73 2HD HIS 73 -4.812 -7.975 -6.320
575 HE1 HIS 73 1HE HIS 73 -4.129 -4.959 -3.440
576 HE2 HIS 73 2HE HIS 73 -4.610 -5.449 -5.849
577 HA PRO 74 HA PRO 74 -6.829 -12.667 -1.183
578 1HB PRO 74 2HB PRO 74 -5.113 -14.561 -0.424
579 2HB PRO 74 1HB PRO 74 -5.972 -14.668 -1.965
580 1HG PRO 74 2HG PRO 74 -3.130 -14.044 -1.434
581 2HG PRO 74 1HG PRO 74 -3.878 -14.741 -2.880
582 1HD PRO 74 2HD PRO 74 -3.129 -12.007 -2.411
583 2HD PRO 74 1HD PRO 74 -3.875 -12.704 -3.862
584 H MET 75 H MET 75 -6.876 -11.069 0.371
585 HA MET 75 HA MET 75 -6.421 -10.004 2.320
586 1HB MET 75 2HB MET 75 -5.027 -12.622 2.570
587 2HB MET 75 1HB MET 75 -4.879 -11.434 3.858
588 1HG MET 75 2HG MET 75 -7.545 -11.446 3.524
589 2HG MET 75 1HG MET 75 -7.163 -13.101 3.050
590 1HE MET 75 1HE MET 75 -8.718 -13.887 4.921
591 2HE MET 75 2HE MET 75 -9.018 -12.342 5.713
592 3HE MET 75 3HE MET 75 -8.421 -13.711 6.650
593 H LEU 76 H LEU 76 -4.521 -9.583 -0.011
594 HA LEU 76 HA LEU 76 -1.896 -9.275 0.922
595 1HB LEU 76 2HB LEU 76 -2.975 -8.993 -1.466
596 2HB LEU 76 1HB LEU 76 -3.027 -7.309 -0.992
597 HG LEU 76 HG LEU 76 -0.531 -8.990 -1.090
598 1HD1 LEU 76 1HD1 LEU 76 -0.158 -8.278 -3.184
599 2HD1 LEU 76 2HD1 LEU 76 -0.900 -6.704 -2.902
600 3HD1 LEU 76 3HD1 LEU 76 -1.911 -8.113 -3.232
601 1HD2 LEU 76 1HD2 LEU 76 -0.025 -7.372 0.457
602 2HD2 LEU 76 2HD2 LEU 76 -1.133 -6.197 -0.248
603 3HD2 LEU 76 3HD2 LEU 76 0.406 -6.542 -1.038
604 HA PRO 77 HA PRO 77 -2.746 -5.987 3.912
605 1HB PRO 77 2HB PRO 77 0.218 -6.042 4.080
606 2HB PRO 77 1HB PRO 77 -0.986 -6.151 5.370
607 1HG PRO 77 2HG PRO 77 0.360 -8.312 4.614
608 2HG PRO 77 1HG PRO 77 -1.370 -8.414 5.000
609 1HD PRO 77 2HD PRO 77 -0.032 -8.318 2.316
610 2HD PRO 77 1HD PRO 77 -1.382 -9.336 2.864
611 H VAL 78 H VAL 78 -3.222 -4.102 3.074
612 HA VAL 78 HA VAL 78 -1.284 -2.688 1.391
613 HB VAL 78 HB VAL 78 -4.262 -2.227 1.451
614 1HG1 VAL 78 1HG1 VAL 78 -2.732 -0.388 0.656
615 2HG1 VAL 78 2HG1 VAL 78 -3.954 -0.921 -0.498
616 3HG1 VAL 78 3HG1 VAL 78 -2.280 -1.452 -0.676
617 1HG2 VAL 78 1HG2 VAL 78 -2.937 -4.463 0.410
618 2HG2 VAL 78 2HG2 VAL 78 -3.320 -3.446 -0.976
619 3HG2 VAL 78 3HG2 VAL 78 -4.602 -3.969 0.116
620 H ILE 79 H ILE 79 -0.873 -0.511 1.801
621 HA ILE 79 HA ILE 79 -1.968 0.523 4.335
622 HB ILE 79 HB ILE 79 0.741 1.213 3.212
623 1HG1 ILE 79 2HG1 ILE 79 0.946 -0.319 5.599
624 2HG1 ILE 79 1HG1 ILE 79 -0.094 -1.205 4.490
625 1HG2 ILE 79 1HG2 ILE 79 -0.803 2.459 5.140
626 2HG2 ILE 79 2HG2 ILE 79 0.933 2.654 4.901
627 3HG2 ILE 79 3HG2 ILE 79 0.331 1.477 6.069
628 1HD1 ILE 79 1HD1 ILE 79 2.644 -0.163 3.805
629 2HD1 ILE 79 2HD1 ILE 79 1.622 -1.199 2.807
630 3HD1 ILE 79 3HD1 ILE 79 2.284 -1.809 4.323
631 H ILE 80 H ILE 80 -3.381 2.062 3.909
632 HA ILE 80 HA ILE 80 -2.932 3.836 1.613
633 HB ILE 80 HB ILE 80 -5.440 3.622 3.260
634 1HG1 ILE 80 2HG1 ILE 80 -4.926 1.413 2.329
635 2HG1 ILE 80 1HG1 ILE 80 -6.307 2.121 1.502
636 1HG2 ILE 80 1HG2 ILE 80 -4.872 4.694 0.497
637 2HG2 ILE 80 2HG2 ILE 80 -5.251 5.638 1.939
638 3HG2 ILE 80 3HG2 ILE 80 -6.470 4.582 1.231
639 1HD1 ILE 80 1HD1 ILE 80 -5.062 2.564 -0.429
640 2HD1 ILE 80 2HD1 ILE 80 -4.583 0.942 0.075
641 3HD1 ILE 80 3HD1 ILE 80 -3.528 2.316 0.404
642 H MET 81 H MET 81 -2.993 6.068 1.809
643 HA MET 81 HA MET 81 -1.987 7.130 4.248
644 1HB MET 81 2HB MET 81 -1.318 8.087 2.137
645 2HB MET 81 1HB MET 81 -2.982 8.491 1.739
646 1HG MET 81 2HG MET 81 -2.870 9.905 3.918
647 2HG MET 81 1HG MET 81 -1.128 9.780 3.684
648 1HE MET 81 1HE MET 81 -1.610 12.617 3.753
649 2HE MET 81 2HE MET 81 -3.347 12.326 3.654
650 3HE MET 81 3HE MET 81 -2.564 13.398 2.492
651 H THR 82 H THR 82 -4.795 8.484 2.529
652 HA THR 82 HA THR 82 -6.109 8.839 5.137
653 HB THR 82 HB THR 82 -6.858 10.261 2.589
654 HG1 THR 82 1HG THR 82 -5.501 11.958 3.360
655 1HG2 THR 82 1HG2 THR 82 -7.704 10.427 5.351
656 2HG2 THR 82 2HG2 THR 82 -8.437 11.102 3.896
657 3HG2 THR 82 3HG2 THR 82 -7.148 11.977 4.722
658 H ALA 83 H ALA 83 -8.459 8.623 5.219
659 HA ALA 83 HA ALA 83 -9.326 6.279 3.747
660 1HB ALA 83 1HB ALA 83 -9.702 6.304 6.129
661 2HB ALA 83 2HB ALA 83 -11.250 6.301 5.285
662 3HB ALA 83 3HB ALA 83 -10.637 7.794 5.996
663 H HIS 84 H HIS 84 -9.730 9.660 3.542
664 HA HIS 84 HA HIS 84 -11.103 11.030 2.360
665 1HB HIS 84 2HB HIS 84 -10.644 8.648 0.628
666 2HB HIS 84 1HB HIS 84 -11.713 9.927 0.061
667 HD1 HIS 84 1HD HIS 84 -9.775 12.144 1.534
668 HD2 HIS 84 2HD HIS 84 -8.782 9.340 -1.361
669 HE1 HIS 84 1HE HIS 84 -7.702 13.030 0.422
670 HE2 HIS 84 2HE HIS 84 -7.094 11.297 -1.302
671 H SER 85 H SER 85 -12.732 8.211 1.029
672 HA SER 85 HA SER 85 -15.274 9.267 1.885
673 1HB SER 85 2HB SER 85 -14.396 7.004 0.119
674 2HB SER 85 1HB SER 85 -16.063 7.075 0.683
675 HG SER 85 HG SER 85 -15.806 8.143 -1.316
676 H ASP 86 H ASP 86 -16.826 7.091 2.346
677 HA ASP 86 HA ASP 86 -16.796 6.632 5.001
678 1HB ASP 86 2HB ASP 86 -17.635 4.730 2.814
679 2HB ASP 86 1HB ASP 86 -17.987 4.461 4.518
680 H LEU 87 H LEU 87 -15.151 6.062 6.242
681 HA LEU 87 HA LEU 87 -12.900 4.621 5.622
682 1HB LEU 87 2HB LEU 87 -14.178 5.582 7.989
683 2HB LEU 87 1HB LEU 87 -13.596 3.956 8.294
684 HG LEU 87 HG LEU 87 -11.932 6.293 7.356
685 1HD1 LEU 87 1HD1 LEU 87 -11.227 4.951 9.845
686 2HD1 LEU 87 2HD1 LEU 87 -12.812 5.724 9.892
687 3HD1 LEU 87 3HD1 LEU 87 -11.381 6.671 9.485
688 1HD2 LEU 87 1HD2 LEU 87 -10.811 4.545 6.393
689 2HD2 LEU 87 2HD2 LEU 87 -11.367 3.380 7.596
690 3HD2 LEU 87 3HD2 LEU 87 -10.095 4.532 8.005
691 H ASP 88 H ASP 88 -16.093 3.435 6.046
692 HA ASP 88 HA ASP 88 -15.812 0.895 6.981
693 1HB ASP 88 2HB ASP 88 -17.932 2.092 6.239
694 2HB ASP 88 1HB ASP 88 -17.574 1.502 4.618
695 H ALA 89 H ALA 89 -15.190 1.905 3.589
696 HA ALA 89 HA ALA 89 -14.605 -0.781 2.818
697 1HB ALA 89 1HB ALA 89 -13.780 0.220 0.692
698 2HB ALA 89 2HB ALA 89 -14.095 1.817 1.366
699 3HB ALA 89 3HB ALA 89 -15.425 0.696 1.110
700 H ALA 90 H ALA 90 -12.893 1.751 4.348
701 HA ALA 90 HA ALA 90 -10.254 0.828 3.681
702 1HB ALA 90 1HB ALA 90 -9.729 2.335 5.783
703 2HB ALA 90 2HB ALA 90 -11.354 2.941 5.444
704 3HB ALA 90 3HB ALA 90 -10.100 3.035 4.209
705 H VAL 91 H VAL 91 -12.109 0.917 6.711
706 HA VAL 91 HA VAL 91 -10.390 -0.679 8.197
707 HB VAL 91 HB VAL 91 -13.372 -0.569 8.588
708 1HG1 VAL 91 1HG1 VAL 91 -12.113 -0.540 11.042
709 2HG1 VAL 91 2HG1 VAL 91 -11.126 -1.655 10.092
710 3HG1 VAL 91 3HG1 VAL 91 -12.860 -1.941 10.274
711 1HG2 VAL 91 1HG2 VAL 91 -12.060 1.276 10.277
712 2HG2 VAL 91 2HG2 VAL 91 -13.208 1.612 8.982
713 3HG2 VAL 91 3HG2 VAL 91 -11.480 1.571 8.637
714 H SER 92 H SER 92 -13.434 -1.658 6.636
715 HA SER 92 HA SER 92 -13.306 -4.367 7.190
716 1HB SER 92 2HB SER 92 -14.883 -4.698 5.425
717 2HB SER 92 1HB SER 92 -15.229 -3.112 6.115
718 HG SER 92 HG SER 92 -13.862 -2.275 4.368
719 H ALA 93 H ALA 93 -11.511 -2.501 4.875
720 HA ALA 93 HA ALA 93 -10.685 -4.500 3.125
721 1HB ALA 93 1HB ALA 93 -8.732 -2.404 3.861
722 2HB ALA 93 2HB ALA 93 -10.271 -1.886 3.178
723 3HB ALA 93 3HB ALA 93 -9.227 -2.978 2.269
724 H TYR 94 H TYR 94 -9.245 -3.389 6.138
725 HA TYR 94 HA TYR 94 -6.930 -4.856 6.185
726 1HB TYR 94 2HB TYR 94 -8.641 -4.577 8.651
727 2HB TYR 94 1HB TYR 94 -6.887 -4.642 8.550
728 HD1 TYR 94 1HD TYR 94 -6.426 -2.642 6.385
729 HD2 TYR 94 2HD TYR 94 -9.025 -2.546 9.748
730 HE1 TYR 94 1HE TYR 94 -6.324 -0.188 6.381
731 HE2 TYR 94 2HE TYR 94 -8.928 -0.092 9.758
732 HH TYR 94 HH TYR 94 -8.417 1.733 8.357
733 H GLN 95 H GLN 95 -10.166 -5.949 6.570
734 HA GLN 95 HA GLN 95 -9.498 -8.514 7.660
735 1HB GLN 95 2HB GLN 95 -11.731 -8.772 7.931
736 2HB GLN 95 1HB GLN 95 -11.781 -7.050 7.591
737 1HG GLN 95 2HG GLN 95 -11.939 -8.057 5.083
738 2HG GLN 95 1HG GLN 95 -12.743 -9.326 5.999
739 1HE2 GLN 95 1HE2 GLN 95 -13.802 -7.481 4.041
740 2HE2 GLN 95 2HE2 GLN 95 -15.069 -6.607 4.827
741 H GLN 96 H GLN 96 -10.234 -7.229 4.477
742 HA GLN 96 HA GLN 96 -9.837 -9.842 3.280
743 1HB GLN 96 2HB GLN 96 -10.716 -8.748 1.216
744 2HB GLN 96 1HB GLN 96 -11.835 -8.761 2.573
745 1HG GLN 96 2HG GLN 96 -10.842 -6.398 3.045
746 2HG GLN 96 1HG GLN 96 -10.369 -6.473 1.351
747 1HE2 GLN 96 1HE2 GLN 96 -11.782 -4.714 0.967
748 2HE2 GLN 96 2HE2 GLN 96 -13.485 -4.962 0.825
749 H GLY 97 H GLY 97 -7.789 -7.476 4.125
750 1HA GLY 97 2HA GLY 97 -5.490 -7.972 3.194
751 2HA GLY 97 1HA GLY 97 -6.229 -7.705 1.624
752 H ALA 98 H ALA 98 -5.425 -6.140 4.686
753 HA ALA 98 HA ALA 98 -4.422 -3.833 3.435
754 1HB ALA 98 1HB ALA 98 -6.453 -2.933 2.975
755 2HB ALA 98 2HB ALA 98 -6.205 -2.302 4.600
756 3HB ALA 98 3HB ALA 98 -7.229 -3.710 4.347
757 H PHE 99 H PHE 99 -2.923 -3.032 4.760
758 HA PHE 99 HA PHE 99 -2.576 -4.099 7.353
759 1HB PHE 99 2HB PHE 99 -0.760 -3.356 5.779
760 2HB PHE 99 1HB PHE 99 -1.180 -1.697 6.188
761 HD1 PHE 99 1HD PHE 99 -0.798 -4.781 8.254
762 HD2 PHE 99 2HD PHE 99 0.476 -0.797 7.477
763 HE1 PHE 99 1HE PHE 99 0.705 -4.887 10.201
764 HE2 PHE 99 2HE PHE 99 1.977 -0.893 9.423
765 HZ PHE 99 HZ PHE 99 2.094 -2.940 10.785
766 H ASP 100 H ASP 100 -3.282 -0.744 6.301
767 HA ASP 100 HA ASP 100 -5.122 -0.213 8.338
768 1HB ASP 100 2HB ASP 100 -2.481 -0.281 9.319
769 2HB ASP 100 1HB ASP 100 -2.933 1.420 9.248
770 H TYR 101 H TYR 101 -4.838 2.401 8.897
771 HA TYR 101 HA TYR 101 -4.422 3.773 6.336
772 1HB TYR 101 2HB TYR 101 -6.955 3.469 7.818
773 2HB TYR 101 1HB TYR 101 -6.586 5.118 7.324
774 HD1 TYR 101 1HD TYR 101 -6.809 1.651 5.968
775 HD2 TYR 101 2HD TYR 101 -7.102 5.814 5.160
776 HE1 TYR 101 1HE TYR 101 -7.590 1.150 3.690
777 HE2 TYR 101 2HE TYR 101 -7.897 5.322 2.889
778 HH TYR 101 HH TYR 101 -8.068 3.704 1.307
779 H LEU 102 H LEU 102 -4.022 6.055 6.528
780 HA LEU 102 HA LEU 102 -2.878 6.743 9.140
781 1HB LEU 102 2HB LEU 102 -2.236 7.441 6.335
782 2HB LEU 102 1HB LEU 102 -1.971 8.695 7.530
783 HG LEU 102 HG LEU 102 -0.412 7.311 8.731
784 1HD1 LEU 102 1HD1 LEU 102 0.095 5.097 7.221
785 2HD1 LEU 102 2HD1 LEU 102 -1.666 5.190 7.176
786 3HD1 LEU 102 3HD1 LEU 102 -0.826 5.124 8.725
787 1HD2 LEU 102 1HD2 LEU 102 1.350 7.282 7.190
788 2HD2 LEU 102 2HD2 LEU 102 0.260 8.542 6.608
789 3HD2 LEU 102 3HD2 LEU 102 0.270 6.956 5.834
790 HA PRO 103 HA PRO 103 -6.313 9.554 9.658
791 1HB PRO 103 2HB PRO 103 -5.441 10.699 11.971
792 2HB PRO 103 1HB PRO 103 -6.221 9.117 11.903
793 1HG PRO 103 2HG PRO 103 -3.321 9.794 12.122
794 2HG PRO 103 1HG PRO 103 -4.235 8.498 12.910
795 1HD PRO 103 2HD PRO 103 -2.644 8.100 10.736
796 2HD PRO 103 1HD PRO 103 -4.069 7.107 11.097
797 H LYS 104 H LYS 104 -3.126 10.888 10.562
798 HA LYS 104 HA LYS 104 -3.653 13.123 8.748
799 1HB LYS 104 2HB LYS 104 -4.116 13.637 11.234
800 2HB LYS 104 1HB LYS 104 -2.370 13.622 11.417
801 1HG LYS 104 2HG LYS 104 -2.115 15.433 9.890
802 2HG LYS 104 1HG LYS 104 -3.822 15.363 9.444
803 1HD LYS 104 2HD LYS 104 -3.143 15.767 12.310
804 2HD LYS 104 1HD LYS 104 -2.901 17.118 11.202
805 1HE LYS 104 2HE LYS 104 -5.085 17.366 12.054
806 2HE LYS 104 1HE LYS 104 -5.272 16.733 10.418
807 1HZ LYS 104 1HZ LYS 104 -5.212 14.918 12.744
808 2HZ LYS 104 2HZ LYS 104 -5.870 14.653 11.209
809 3HZ LYS 104 3HZ LYS 104 -6.645 15.696 12.292
810 HA PRO 105 HA PRO 105 1.181 12.818 9.451
811 1HB PRO 105 2HB PRO 105 1.318 10.071 10.584
812 2HB PRO 105 1HB PRO 105 2.293 11.496 10.966
813 1HG PRO 105 2HG PRO 105 0.424 10.656 12.658
814 2HG PRO 105 1HG PRO 105 0.668 12.391 12.367
815 1HD PRO 105 2HD PRO 105 -1.452 10.569 11.293
816 2HD PRO 105 1HD PRO 105 -1.597 12.234 11.887
817 H PHE 106 H PHE 106 2.667 11.742 8.024
818 HA PHE 106 HA PHE 106 1.951 9.365 6.632
819 1HB PHE 106 2HB PHE 106 0.347 10.885 5.545
820 2HB PHE 106 1HB PHE 106 1.655 11.976 5.109
821 HD1 PHE 106 1HD PHE 106 0.758 8.377 4.742
822 HD2 PHE 106 2HD PHE 106 2.468 11.830 2.948
823 HE1 PHE 106 1HE PHE 106 1.096 7.115 2.667
824 HE2 PHE 106 2HE PHE 106 2.807 10.576 0.861
825 HZ PHE 106 HZ PHE 106 2.121 8.214 0.718
826 H ASP 107 H ASP 107 3.440 11.749 4.619
827 HA ASP 107 HA ASP 107 5.527 11.736 3.681
828 1HB ASP 107 2HB ASP 107 7.277 12.421 5.239
829 2HB ASP 107 1HB ASP 107 5.774 13.268 5.590
830 H ILE 108 H ILE 108 7.912 10.785 4.032
831 HA ILE 108 HA ILE 108 7.613 7.985 3.753
832 HB ILE 108 HB ILE 108 9.675 9.860 3.235
833 1HG1 ILE 108 2HG1 ILE 108 10.455 8.062 1.757
834 2HG1 ILE 108 1HG1 ILE 108 9.387 6.931 2.575
835 1HG2 ILE 108 1HG2 ILE 108 10.888 9.190 5.159
836 2HG2 ILE 108 2HG2 ILE 108 11.616 8.343 3.794
837 3HG2 ILE 108 3HG2 ILE 108 10.520 7.491 4.877
838 1HD1 ILE 108 1HD1 ILE 108 7.567 7.656 1.486
839 2HD1 ILE 108 2HD1 ILE 108 8.757 8.206 0.303
840 3HD1 ILE 108 3HD1 ILE 108 8.099 9.338 1.485
841 H ASP 109 H ASP 109 8.833 10.002 6.325
842 HA ASP 109 HA ASP 109 9.944 8.148 8.010
843 1HB ASP 109 2HB ASP 109 9.786 10.661 8.343
844 2HB ASP 109 1HB ASP 109 8.183 10.379 9.013
845 H GLU 110 H GLU 110 6.516 9.191 8.180
846 HA GLU 110 HA GLU 110 5.875 7.056 9.950
847 1HB GLU 110 2HB GLU 110 4.104 9.010 8.490
848 2HB GLU 110 1HB GLU 110 3.517 7.832 9.649
849 1HG GLU 110 2HG GLU 110 5.624 9.833 10.369
850 2HG GLU 110 1HG GLU 110 3.905 10.217 10.452
851 H ALA 111 H ALA 111 5.638 7.579 6.515
852 HA ALA 111 HA ALA 111 3.880 5.440 5.942
853 1HB ALA 111 1HB ALA 111 5.981 6.606 4.120
854 2HB ALA 111 2HB ALA 111 4.376 7.292 4.374
855 3HB ALA 111 3HB ALA 111 4.546 5.696 3.646
856 H VAL 112 H VAL 112 7.422 5.655 5.491
857 HA VAL 112 HA VAL 112 7.811 2.929 4.973
858 HB VAL 112 HB VAL 112 9.789 4.808 6.261
859 1HG1 VAL 112 1HG1 VAL 112 11.293 3.165 6.136
860 2HG1 VAL 112 2HG1 VAL 112 10.846 2.791 4.472
861 3HG1 VAL 112 3HG1 VAL 112 9.950 2.069 5.810
862 1HG2 VAL 112 1HG2 VAL 112 10.522 4.676 3.661
863 2HG2 VAL 112 2HG2 VAL 112 9.504 5.949 4.332
864 3HG2 VAL 112 3HG2 VAL 112 8.767 4.576 3.507
865 H ALA 113 H ALA 113 7.495 4.708 7.919
866 HA ALA 113 HA ALA 113 8.500 2.801 9.733
867 1HB ALA 113 1HB ALA 113 7.291 4.041 11.420
868 2HB ALA 113 2HB ALA 113 6.304 4.813 10.177
869 3HB ALA 113 3HB ALA 113 8.028 5.168 10.285
870 H LEU 114 H LEU 114 5.279 3.456 8.481
871 HA LEU 114 HA LEU 114 4.043 1.317 9.892
872 1HB LEU 114 2HB LEU 114 2.890 3.408 9.305
873 2HB LEU 114 1HB LEU 114 3.029 2.993 7.609
874 HG LEU 114 HG LEU 114 1.617 0.953 8.098
875 1HD1 LEU 114 1HD1 LEU 114 1.890 0.747 10.463
876 2HD1 LEU 114 2HD1 LEU 114 0.201 1.142 10.144
877 3HD1 LEU 114 3HD1 LEU 114 1.303 2.389 10.725
878 1HD2 LEU 114 1HD2 LEU 114 0.866 3.263 7.206
879 2HD2 LEU 114 2HD2 LEU 114 0.144 3.460 8.803
880 3HD2 LEU 114 3HD2 LEU 114 -0.359 2.125 7.769
881 H VAL 115 H VAL 115 5.663 1.606 6.851
882 HA VAL 115 HA VAL 115 4.378 -0.708 5.724
883 HB VAL 115 HB VAL 115 5.356 1.160 4.311
884 1HG1 VAL 115 1HG1 VAL 115 7.630 1.276 3.849
885 2HG1 VAL 115 2HG1 VAL 115 7.952 -0.317 4.534
886 3HG1 VAL 115 3HG1 VAL 115 7.587 1.040 5.592
887 1HG2 VAL 115 1HG2 VAL 115 6.189 -0.483 2.575
888 2HG2 VAL 115 2HG2 VAL 115 4.583 -0.794 3.232
889 3HG2 VAL 115 3HG2 VAL 115 5.963 -1.736 3.793
890 H GLU 116 H GLU 116 7.471 -0.031 7.289
891 HA GLU 116 HA GLU 116 8.580 -2.606 6.885
892 1HB GLU 116 2HB GLU 116 9.189 -0.477 8.936
893 2HB GLU 116 1HB GLU 116 10.112 -1.965 8.777
894 1HG GLU 116 2HG GLU 116 10.508 -1.293 6.367
895 2HG GLU 116 1HG GLU 116 9.871 0.289 6.814
896 H ARG 117 H ARG 117 6.894 -1.153 9.669
897 HA ARG 117 HA ARG 117 7.041 -3.390 11.336
898 1HB ARG 117 2HB ARG 117 5.216 -2.391 12.614
899 2HB ARG 117 1HB ARG 117 6.405 -1.181 12.168
900 1HG ARG 117 2HG ARG 117 4.962 -0.344 10.425
901 2HG ARG 117 1HG ARG 117 3.787 -1.621 10.750
902 1HD ARG 117 2HD ARG 117 2.813 -0.094 12.080
903 2HD ARG 117 1HD ARG 117 4.085 -0.519 13.221
904 HE ARG 117 HE ARG 117 3.998 1.865 11.517
905 1HH1 ARG 117 1HH1 ARG 117 5.481 0.099 14.142
906 2HH1 ARG 117 2HH1 ARG 117 6.519 1.408 14.588
907 1HH2 ARG 117 1HH2 ARG 117 5.366 3.573 12.107
908 2HH2 ARG 117 2HH2 ARG 117 6.454 3.377 13.441
909 H ALA 118 H ALA 118 5.098 -2.791 8.569
910 HA ALA 118 HA ALA 118 3.023 -4.650 9.141
911 1HB ALA 118 1HB ALA 118 3.147 -2.683 7.399
912 2HB ALA 118 2HB ALA 118 2.156 -4.110 7.090
913 3HB ALA 118 3HB ALA 118 3.745 -3.958 6.339
914 H ILE 119 H ILE 119 6.017 -4.793 7.243
915 HA ILE 119 HA ILE 119 5.639 -7.466 6.369
916 HB ILE 119 HB ILE 119 8.248 -5.973 6.542
917 1HG1 ILE 119 2HG1 ILE 119 6.769 -6.053 3.986
918 2HG1 ILE 119 1HG1 ILE 119 6.081 -5.015 5.231
919 1HG2 ILE 119 1HG2 ILE 119 7.312 -8.351 4.971
920 2HG2 ILE 119 2HG2 ILE 119 8.705 -8.215 6.043
921 3HG2 ILE 119 3HG2 ILE 119 8.710 -7.393 4.481
922 1HD1 ILE 119 1HD1 ILE 119 8.930 -4.885 4.291
923 2HD1 ILE 119 2HD1 ILE 119 8.119 -3.774 5.394
924 3HD1 ILE 119 3HD1 ILE 119 7.630 -3.850 3.702
925 H SER 120 H SER 120 7.157 -5.983 9.112
926 HA SER 120 HA SER 120 8.593 -8.271 9.987
927 1HB SER 120 2HB SER 120 8.914 -5.753 10.609
928 2HB SER 120 1HB SER 120 7.712 -6.093 11.852
929 HG SER 120 HG SER 120 10.223 -6.499 12.089
930 H HIS 121 H HIS 121 5.520 -6.791 10.953
931 HA HIS 121 HA HIS 121 4.891 -8.679 12.953
932 1HB HIS 121 2HB HIS 121 3.213 -6.765 11.344
933 2HB HIS 121 1HB HIS 121 2.516 -7.811 12.579
934 HD1 HIS 121 1HD HIS 121 5.575 -7.093 14.041
935 HD2 HIS 121 2HD HIS 121 2.201 -4.779 13.319
936 HE1 HIS 121 1HE HIS 121 5.724 -5.167 15.652
937 HE2 HIS 121 2HE HIS 121 3.718 -3.732 15.134
938 H TYR 122 H TYR 122 4.637 -8.748 9.520
939 HA TYR 122 HA TYR 122 2.644 -10.761 9.315
940 1HB TYR 122 2HB TYR 122 3.329 -9.148 7.488
941 2HB TYR 122 1HB TYR 122 4.775 -10.127 7.272
942 HD1 TYR 122 1HD TYR 122 4.582 -11.238 5.251
943 HD2 TYR 122 2HD TYR 122 1.206 -11.077 7.835
944 HE1 TYR 122 1HE TYR 122 3.352 -12.724 3.727
945 HE2 TYR 122 2HE TYR 122 -0.034 -12.563 6.318
946 HH TYR 122 HH TYR 122 0.071 -13.143 3.818
947 H GLN 123 H GLN 123 6.191 -10.827 9.058
948 HA GLN 123 HA GLN 123 6.299 -13.667 8.823
949 1HB GLN 123 2HB GLN 123 8.015 -11.780 8.099
950 2HB GLN 123 1HB GLN 123 8.674 -12.097 9.698
951 1HG GLN 123 2HG GLN 123 9.476 -14.120 9.120
952 2HG GLN 123 1HG GLN 123 8.135 -14.463 8.028
953 1HE2 GLN 123 1HE2 GLN 123 8.141 -13.335 5.955
954 2HE2 GLN 123 2HE2 GLN 123 9.656 -12.988 5.202
955 H GLU 124 H GLU 124 7.950 -14.807 10.400
956 HA GLU 124 HA GLU 124 7.336 -14.065 13.173
957 1HB GLU 124 2HB GLU 124 7.109 -16.868 12.063
958 2HB GLU 124 1HB GLU 124 6.853 -16.394 13.736
959 1HG GLU 124 2HG GLU 124 5.216 -15.048 11.667
960 2HG GLU 124 1HG GLU 124 4.858 -16.736 12.029
Start of MODEL 14
1 1H MET 1 1HT MET 1 12.478 -16.820 7.631
2 2H MET 1 2HT MET 1 11.440 -16.102 6.466
3 3H MET 1 3HT MET 1 12.655 -15.165 7.235
4 HA MET 1 HA MET 1 14.311 -15.999 6.022
5 1HB MET 1 2HB MET 1 13.168 -18.393 6.703
6 2HB MET 1 1HB MET 1 12.946 -18.385 4.960
7 1HG MET 1 2HG MET 1 15.488 -17.691 4.989
8 2HG MET 1 1HG MET 1 15.443 -18.497 6.556
9 1HE MET 1 1HE MET 1 15.270 -19.479 2.458
10 2HE MET 1 2HE MET 1 13.863 -18.724 3.208
11 3HE MET 1 3HE MET 1 13.829 -20.439 2.799
12 H GLN 2 H GLN 2 11.955 -14.412 5.309
13 HA GLN 2 HA GLN 2 11.664 -15.050 2.462
14 1HB GLN 2 2HB GLN 2 9.922 -13.864 4.469
15 2HB GLN 2 1HB GLN 2 10.003 -12.898 3.001
16 1HG GLN 2 2HG GLN 2 8.225 -14.319 2.608
17 2HG GLN 2 1HG GLN 2 9.563 -15.101 1.766
18 1HE2 GLN 2 1HE2 GLN 2 7.643 -15.141 4.709
19 2HE2 GLN 2 2HE2 GLN 2 7.899 -16.810 5.075
20 H ARG 3 H ARG 3 12.172 -13.629 0.870
21 HA ARG 3 HA ARG 3 14.323 -11.887 1.267
22 1HB ARG 3 2HB ARG 3 13.780 -11.083 -1.070
23 2HB ARG 3 1HB ARG 3 14.040 -12.814 -0.904
24 1HG ARG 3 2HG ARG 3 11.552 -13.082 -0.781
25 2HG ARG 3 1HG ARG 3 11.415 -11.375 -1.186
26 1HD ARG 3 2HD ARG 3 12.253 -11.684 -3.328
27 2HD ARG 3 1HD ARG 3 13.024 -13.214 -2.909
28 HE ARG 3 HE ARG 3 10.453 -13.832 -2.590
29 1HH1 ARG 3 1HH1 ARG 3 12.064 -12.159 -5.201
30 2HH1 ARG 3 2HH1 ARG 3 10.933 -12.689 -6.399
31 1HH2 ARG 3 1HH2 ARG 3 8.972 -14.525 -4.164
32 2HH2 ARG 3 2HH2 ARG 3 9.178 -14.031 -5.812
33 H GLY 4 H GLY 4 10.924 -11.212 0.671
34 1HA GLY 4 2HA GLY 4 9.731 -9.483 1.817
35 2HA GLY 4 1HA GLY 4 11.252 -8.622 2.017
36 H ILE 5 H ILE 5 8.414 -8.764 0.264
37 HA ILE 5 HA ILE 5 9.589 -7.114 -1.878
38 HB ILE 5 HB ILE 5 7.111 -8.771 -2.251
39 1HG1 ILE 5 2HG1 ILE 5 8.792 -10.397 -1.717
40 2HG1 ILE 5 1HG1 ILE 5 8.588 -10.408 -3.465
41 1HG2 ILE 5 1HG2 ILE 5 8.846 -8.253 -4.533
42 2HG2 ILE 5 2HG2 ILE 5 8.252 -6.782 -3.764
43 3HG2 ILE 5 3HG2 ILE 5 7.112 -7.995 -4.345
44 1HD1 ILE 5 1HD1 ILE 5 10.593 -8.622 -3.205
45 2HD1 ILE 5 2HD1 ILE 5 10.822 -10.350 -3.469
46 3HD1 ILE 5 3HD1 ILE 5 10.914 -9.688 -1.839
47 H VAL 6 H VAL 6 8.990 -5.067 -1.597
48 HA VAL 6 HA VAL 6 6.308 -4.503 -0.513
49 HB VAL 6 HB VAL 6 8.288 -3.526 0.700
50 1HG1 VAL 6 1HG1 VAL 6 9.869 -2.431 -0.394
51 2HG1 VAL 6 2HG1 VAL 6 8.701 -1.300 -1.055
52 3HG1 VAL 6 3HG1 VAL 6 9.058 -2.803 -1.893
53 1HG2 VAL 6 1HG2 VAL 6 6.377 -1.533 -0.525
54 2HG2 VAL 6 2HG2 VAL 6 7.292 -1.315 0.967
55 3HG2 VAL 6 3HG2 VAL 6 6.039 -2.549 0.872
56 H TRP 7 H TRP 7 4.803 -3.694 -1.834
57 HA TRP 7 HA TRP 7 5.717 -2.405 -4.318
58 1HB TRP 7 2HB TRP 7 3.436 -4.305 -3.838
59 2HB TRP 7 1HB TRP 7 3.361 -3.148 -5.169
60 HD1 TRP 7 HD1 TRP 7 6.846 -4.250 -4.594
61 HE1 TRP 7 1HE TRP 7 7.574 -5.956 -6.357
62 HE3 TRP 7 3HE TRP 7 2.267 -5.333 -6.599
63 HZ2 TRP 7 2HZ TRP 7 6.380 -7.560 -8.332
64 HZ3 TRP 7 3HZ TRP 7 2.154 -6.977 -8.429
65 HH2 TRP 7 HH2 TRP 7 4.175 -8.076 -9.277
66 H VAL 8 H VAL 8 5.234 -0.350 -4.487
67 HA VAL 8 HA VAL 8 3.133 0.737 -2.732
68 HB VAL 8 HB VAL 8 5.064 2.700 -3.676
69 1HG1 VAL 8 1HG1 VAL 8 3.549 3.168 -1.878
70 2HG1 VAL 8 2HG1 VAL 8 5.193 3.167 -1.241
71 3HG1 VAL 8 3HG1 VAL 8 4.149 1.785 -0.965
72 1HG2 VAL 8 1HG2 VAL 8 6.091 0.203 -2.402
73 2HG2 VAL 8 2HG2 VAL 8 6.800 1.746 -1.936
74 3HG2 VAL 8 3HG2 VAL 8 6.837 1.234 -3.621
75 H VAL 9 H VAL 9 1.612 2.078 -3.543
76 HA VAL 9 HA VAL 9 1.817 2.782 -6.399
77 HB VAL 9 HB VAL 9 -0.935 2.719 -5.483
78 1HG1 VAL 9 1HG1 VAL 9 -0.978 1.031 -7.472
79 2HG1 VAL 9 2HG1 VAL 9 0.691 1.546 -7.693
80 3HG1 VAL 9 3HG1 VAL 9 -0.609 2.729 -7.774
81 1HG2 VAL 9 1HG2 VAL 9 -1.186 0.296 -5.240
82 2HG2 VAL 9 2HG2 VAL 9 -0.160 0.958 -3.975
83 3HG2 VAL 9 3HG2 VAL 9 0.566 0.101 -5.329
84 H ASP 10 H ASP 10 2.343 4.902 -6.381
85 HA ASP 10 HA ASP 10 0.462 6.819 -5.425
86 1HB ASP 10 2HB ASP 10 1.918 6.028 -3.371
87 2HB ASP 10 1HB ASP 10 3.099 7.131 -4.065
88 H ASP 11 H ASP 11 0.858 7.070 -7.791
89 HA ASP 11 HA ASP 11 1.571 8.334 -9.531
90 1HB ASP 11 2HB ASP 11 1.743 9.979 -7.322
91 2HB ASP 11 1HB ASP 11 3.335 10.135 -8.057
92 H ASP 12 H ASP 12 3.604 6.368 -7.890
93 HA ASP 12 HA ASP 12 5.749 5.624 -8.158
94 1HB ASP 12 2HB ASP 12 6.270 5.018 -10.435
95 2HB ASP 12 1HB ASP 12 4.537 4.837 -10.192
96 H SER 13 H SER 13 7.514 6.438 -10.437
97 HA SER 13 HA SER 13 9.431 7.682 -10.450
98 1HB SER 13 2HB SER 13 7.533 8.671 -11.908
99 2HB SER 13 1HB SER 13 7.594 10.013 -10.771
100 HG SER 13 HG SER 13 10.021 9.800 -11.274
101 H SER 14 H SER 14 7.682 10.427 -9.189
102 HA SER 14 HA SER 14 9.679 11.228 -7.440
103 1HB SER 14 2HB SER 14 7.536 12.470 -8.280
104 2HB SER 14 1HB SER 14 6.786 11.795 -6.834
105 HG SER 14 HG SER 14 7.670 13.400 -5.829
106 H ILE 15 H ILE 15 6.547 9.847 -6.422
107 HA ILE 15 HA ILE 15 7.374 9.298 -3.798
108 HB ILE 15 HB ILE 15 5.211 7.832 -5.317
109 1HG1 ILE 15 2HG1 ILE 15 4.900 10.273 -5.480
110 2HG1 ILE 15 1HG1 ILE 15 3.666 9.533 -4.466
111 1HG2 ILE 15 1HG2 ILE 15 4.396 8.127 -2.720
112 2HG2 ILE 15 2HG2 ILE 15 6.130 7.855 -2.545
113 3HG2 ILE 15 3HG2 ILE 15 5.135 6.679 -3.403
114 1HD1 ILE 15 1HD1 ILE 15 6.129 10.819 -3.332
115 2HD1 ILE 15 2HD1 ILE 15 4.641 10.376 -2.497
116 3HD1 ILE 15 3HD1 ILE 15 4.639 11.707 -3.653
117 H ARG 16 H ARG 16 7.990 7.664 -6.745
118 HA ARG 16 HA ARG 16 8.421 5.048 -5.730
119 1HB ARG 16 2HB ARG 16 8.016 5.461 -8.107
120 2HB ARG 16 1HB ARG 16 9.501 6.383 -8.217
121 1HG ARG 16 2HG ARG 16 10.701 4.261 -7.492
122 2HG ARG 16 1HG ARG 16 9.185 3.428 -7.821
123 1HD ARG 16 2HD ARG 16 9.528 3.478 -10.020
124 2HD ARG 16 1HD ARG 16 9.926 5.194 -9.989
125 HE ARG 16 HE ARG 16 12.193 4.248 -9.106
126 1HH1 ARG 16 1HH1 ARG 16 10.187 2.906 -11.639
127 2HH1 ARG 16 2HH1 ARG 16 11.521 2.199 -12.485
128 1HH2 ARG 16 1HH2 ARG 16 13.941 3.324 -10.231
129 2HH2 ARG 16 2HH2 ARG 16 13.646 2.436 -11.690
130 H TRP 17 H TRP 17 10.735 7.540 -6.782
131 HA TRP 17 HA TRP 17 13.026 6.221 -5.919
132 1HB TRP 17 2HB TRP 17 12.973 8.174 -7.463
133 2HB TRP 17 1HB TRP 17 12.661 9.211 -6.073
134 HD1 TRP 17 HD1 TRP 17 15.397 6.759 -7.324
135 HE1 TRP 17 1HE TRP 17 17.663 7.582 -6.428
136 HE3 TRP 17 3HE TRP 17 13.762 10.683 -4.484
137 HZ2 TRP 17 2HZ TRP 17 18.634 9.622 -4.738
138 HZ3 TRP 17 3HZ TRP 17 15.431 12.016 -3.250
139 HH2 TRP 17 HH2 TRP 17 17.815 11.495 -3.378
140 H VAL 18 H VAL 18 10.968 8.527 -4.171
141 HA VAL 18 HA VAL 18 12.670 8.754 -1.941
142 HB VAL 18 HB VAL 18 9.705 9.087 -1.707
143 1HG1 VAL 18 1HG1 VAL 18 11.831 9.524 0.014
144 2HG1 VAL 18 2HG1 VAL 18 10.193 10.150 0.191
145 3HG1 VAL 18 3HG1 VAL 18 11.431 11.132 -0.590
146 1HG2 VAL 18 1HG2 VAL 18 11.492 10.514 -3.517
147 2HG2 VAL 18 2HG2 VAL 18 10.635 11.580 -2.402
148 3HG2 VAL 18 3HG2 VAL 18 9.731 10.488 -3.450
149 H LEU 19 H LEU 19 9.938 6.634 -2.561
150 HA LEU 19 HA LEU 19 10.121 5.441 0.041
151 1HB LEU 19 2HB LEU 19 8.346 5.049 -2.323
152 2HB LEU 19 1HB LEU 19 8.389 3.831 -1.062
153 HG LEU 19 HG LEU 19 7.726 6.736 -0.598
154 1HD1 LEU 19 1HD1 LEU 19 6.142 4.625 -1.678
155 2HD1 LEU 19 2HD1 LEU 19 5.696 6.295 -1.352
156 3HD1 LEU 19 3HD1 LEU 19 5.516 5.076 -0.093
157 1HD2 LEU 19 1HD2 LEU 19 8.715 5.488 1.320
158 2HD2 LEU 19 2HD2 LEU 19 7.368 4.355 1.213
159 3HD2 LEU 19 3HD2 LEU 19 7.067 6.048 1.600
160 H GLU 20 H GLU 20 11.291 4.705 -3.123
161 HA GLU 20 HA GLU 20 11.684 1.939 -2.718
162 1HB GLU 20 2HB GLU 20 12.953 1.945 -4.728
163 2HB GLU 20 1HB GLU 20 11.618 3.058 -4.942
164 1HG GLU 20 2HG GLU 20 13.126 4.932 -4.570
165 2HG GLU 20 1HG GLU 20 14.468 3.812 -4.355
166 H ARG 21 H ARG 21 14.068 4.565 -2.722
167 HA ARG 21 HA ARG 21 16.282 3.143 -1.949
168 1HB ARG 21 2HB ARG 21 15.483 5.983 -1.359
169 2HB ARG 21 1HB ARG 21 17.060 5.341 -0.916
170 1HG ARG 21 2HG ARG 21 16.272 4.877 -3.707
171 2HG ARG 21 1HG ARG 21 16.497 6.569 -3.261
172 1HD ARG 21 2HD ARG 21 18.717 6.347 -3.161
173 2HD ARG 21 1HD ARG 21 18.601 4.866 -2.213
174 HE ARG 21 HE ARG 21 17.931 4.274 -4.863
175 1HH1 ARG 21 1HH1 ARG 21 20.700 5.246 -2.979
176 2HH1 ARG 21 2HH1 ARG 21 21.842 4.481 -4.032
177 1HH2 ARG 21 1HH2 ARG 21 19.433 3.267 -6.252
178 2HH2 ARG 21 2HH2 ARG 21 21.124 3.359 -5.890
179 H ALA 22 H ALA 22 14.051 4.833 0.278
180 HA ALA 22 HA ALA 22 15.298 4.117 2.635
181 1HB ALA 22 1HB ALA 22 12.606 5.013 1.892
182 2HB ALA 22 2HB ALA 22 13.697 5.611 3.141
183 3HB ALA 22 3HB ALA 22 12.724 4.169 3.436
184 H LEU 23 H LEU 23 12.709 2.370 0.989
185 HA LEU 23 HA LEU 23 12.707 0.217 2.852
186 1HB LEU 23 2HB LEU 23 10.813 0.873 1.300
187 2HB LEU 23 1HB LEU 23 11.720 0.105 0.011
188 HG LEU 23 HG LEU 23 9.877 -1.261 1.080
189 1HD1 LEU 23 1HD1 LEU 23 12.537 -2.612 1.273
190 2HD1 LEU 23 2HD1 LEU 23 11.894 -2.077 -0.274
191 3HD1 LEU 23 3HD1 LEU 23 11.004 -3.256 0.692
192 1HD2 LEU 23 1HD2 LEU 23 11.897 -1.575 3.294
193 2HD2 LEU 23 2HD2 LEU 23 10.325 -2.369 3.160
194 3HD2 LEU 23 3HD2 LEU 23 10.414 -0.625 3.416
195 H ALA 24 H ALA 24 14.454 0.931 -0.060
196 HA ALA 24 HA ALA 24 15.449 -1.682 -0.521
197 1HB ALA 24 1HB ALA 24 15.488 0.056 -2.256
198 2HB ALA 24 2HB ALA 24 17.100 -0.603 -1.965
199 3HB ALA 24 3HB ALA 24 16.658 0.974 -1.309
200 H GLY 25 H GLY 25 16.360 1.006 1.526
201 1HA GLY 25 2HA GLY 25 18.942 0.115 2.253
202 2HA GLY 25 1HA GLY 25 17.910 1.172 3.213
203 H ALA 26 H ALA 26 15.729 -0.842 3.206
204 HA ALA 26 HA ALA 26 16.549 -2.266 5.547
205 1HB ALA 26 1HB ALA 26 14.325 -1.533 5.615
206 2HB ALA 26 2HB ALA 26 14.202 -3.268 5.322
207 3HB ALA 26 3HB ALA 26 13.983 -2.129 3.990
208 H GLY 27 H GLY 27 16.641 -2.872 2.196
209 1HA GLY 27 2HA GLY 27 17.822 -4.691 1.282
210 2HA GLY 27 1HA GLY 27 17.505 -5.603 2.743
211 H LEU 28 H LEU 28 14.856 -3.971 1.065
212 HA LEU 28 HA LEU 28 14.084 -6.603 0.049
213 1HB LEU 28 2HB LEU 28 11.895 -4.795 0.831
214 2HB LEU 28 1HB LEU 28 11.996 -6.540 0.907
215 HG LEU 28 HG LEU 28 13.770 -5.944 2.817
216 1HD1 LEU 28 1HD1 LEU 28 12.790 -4.083 4.167
217 2HD1 LEU 28 2HD1 LEU 28 11.867 -3.633 2.738
218 3HD1 LEU 28 3HD1 LEU 28 13.629 -3.584 2.698
219 1HD2 LEU 28 1HD2 LEU 28 12.276 -7.191 3.874
220 2HD2 LEU 28 2HD2 LEU 28 11.049 -6.783 2.674
221 3HD2 LEU 28 3HD2 LEU 28 11.263 -5.764 4.099
222 H THR 29 H THR 29 12.345 -6.528 -1.616
223 HA THR 29 HA THR 29 13.184 -4.786 -3.729
224 HB THR 29 HB THR 29 10.896 -6.761 -3.598
225 HG1 THR 29 1HG THR 29 13.125 -7.550 -3.384
226 1HG2 THR 29 1HG2 THR 29 11.700 -6.630 -6.210
227 2HG2 THR 29 2HG2 THR 29 11.724 -4.940 -5.705
228 3HG2 THR 29 3HG2 THR 29 10.247 -5.891 -5.536
229 H CYS 30 H CYS 30 12.383 -2.864 -4.257
230 HA CYS 30 HA CYS 30 9.711 -2.120 -3.272
231 1HB CYS 30 2HB CYS 30 10.694 0.237 -3.130
232 2HB CYS 30 1HB CYS 30 11.187 -0.917 -1.897
233 HG CYS 30 HG CYS 30 13.364 0.143 -2.598
234 H THR 31 H THR 31 8.407 -1.992 -4.970
235 HA THR 31 HA THR 31 9.360 -0.518 -7.333
236 HB THR 31 HB THR 31 9.024 -3.082 -7.630
237 HG1 THR 31 1HG THR 31 9.227 -1.766 -9.418
238 1HG2 THR 31 1HG2 THR 31 6.297 -2.781 -8.437
239 2HG2 THR 31 2HG2 THR 31 6.449 -2.494 -6.704
240 3HG2 THR 31 3HG2 THR 31 7.035 -3.998 -7.407
241 H THR 32 H THR 32 7.758 0.827 -8.356
242 HA THR 32 HA THR 32 5.340 1.197 -6.738
243 HB THR 32 HB THR 32 5.525 3.604 -7.000
244 HG1 THR 32 1HG THR 32 7.486 2.893 -8.788
245 1HG2 THR 32 1HG2 THR 32 7.043 2.102 -5.335
246 2HG2 THR 32 2HG2 THR 32 6.898 3.859 -5.271
247 3HG2 THR 32 3HG2 THR 32 8.255 3.109 -6.118
248 H PHE 33 H PHE 33 3.598 2.346 -7.775
249 HA PHE 33 HA PHE 33 3.543 2.115 -10.693
250 1HB PHE 33 2HB PHE 33 1.264 1.179 -8.958
251 2HB PHE 33 1HB PHE 33 1.419 1.036 -10.691
252 HD1 PHE 33 1HD PHE 33 1.827 -1.069 -11.462
253 HD2 PHE 33 2HD PHE 33 3.425 0.082 -7.689
254 HE1 PHE 33 1HE PHE 33 2.807 -3.307 -11.196
255 HE2 PHE 33 2HE PHE 33 4.422 -2.144 -7.424
256 HZ PHE 33 HZ PHE 33 4.104 -3.852 -9.180
257 H GLU 34 H GLU 34 1.389 3.123 -11.524
258 HA GLU 34 HA GLU 34 1.456 5.830 -10.911
259 1HB GLU 34 2HB GLU 34 -0.695 5.882 -12.274
260 2HB GLU 34 1HB GLU 34 0.723 5.179 -13.042
261 1HG GLU 34 2HG GLU 34 -0.359 3.301 -13.421
262 2HG GLU 34 1HG GLU 34 -0.708 3.114 -11.706
263 H ASN 35 H ASN 35 -1.840 4.754 -10.814
264 HA ASN 35 HA ASN 35 -2.149 6.009 -8.252
265 1HB ASN 35 2HB ASN 35 -3.657 6.343 -10.327
266 2HB ASN 35 1HB ASN 35 -4.388 4.818 -9.842
267 1HD2 ASN 35 1HD2 ASN 35 -4.213 5.157 -7.049
268 2HD2 ASN 35 2HD2 ASN 35 -5.293 6.409 -6.593
269 H GLY 36 H GLY 36 -3.660 3.129 -9.585
270 1HA GLY 36 2HA GLY 36 -2.768 1.471 -7.410
271 2HA GLY 36 1HA GLY 36 -4.455 1.924 -7.289
272 H ASN 37 H ASN 37 -4.950 1.890 -10.152
273 HA ASN 37 HA ASN 37 -5.743 -0.773 -10.446
274 1HB ASN 37 2HB ASN 37 -5.367 1.406 -12.507
275 2HB ASN 37 1HB ASN 37 -6.087 -0.160 -12.873
276 1HD2 ASN 37 1HD2 ASN 37 -7.673 -0.675 -10.790
277 2HD2 ASN 37 2HD2 ASN 37 -8.899 0.527 -10.622
278 H GLU 38 H GLU 38 -2.824 0.895 -11.341
279 HA GLU 38 HA GLU 38 -1.701 -0.881 -13.146
280 1HB GLU 38 2HB GLU 38 -0.891 1.373 -11.718
281 2HB GLU 38 1HB GLU 38 0.250 0.120 -11.269
282 1HG GLU 38 2HG GLU 38 0.158 -0.206 -13.956
283 2HG GLU 38 1HG GLU 38 -0.092 1.529 -13.809
284 H VAL 39 H VAL 39 -0.994 -0.802 -9.594
285 HA VAL 39 HA VAL 39 0.481 -3.139 -9.506
286 HB VAL 39 HB VAL 39 -1.475 -2.521 -7.303
287 1HG1 VAL 39 1HG1 VAL 39 1.131 -3.174 -6.400
288 2HG1 VAL 39 2HG1 VAL 39 0.688 -4.333 -7.653
289 3HG1 VAL 39 3HG1 VAL 39 -0.353 -4.114 -6.248
290 1HG2 VAL 39 1HG2 VAL 39 0.416 -0.694 -8.353
291 2HG2 VAL 39 2HG2 VAL 39 1.041 -1.281 -6.811
292 3HG2 VAL 39 3HG2 VAL 39 -0.560 -0.559 -6.894
293 H LEU 40 H LEU 40 -3.002 -2.774 -9.705
294 HA LEU 40 HA LEU 40 -3.763 -5.372 -8.998
295 1HB LEU 40 2HB LEU 40 -5.102 -3.743 -11.143
296 2HB LEU 40 1HB LEU 40 -5.824 -4.966 -10.118
297 HG LEU 40 HG LEU 40 -4.912 -2.217 -9.284
298 1HD1 LEU 40 1HD1 LEU 40 -7.058 -2.421 -10.511
299 2HD1 LEU 40 2HD1 LEU 40 -7.235 -1.818 -8.863
300 3HD1 LEU 40 3HD1 LEU 40 -7.633 -3.492 -9.240
301 1HD2 LEU 40 1HD2 LEU 40 -6.155 -3.092 -7.114
302 2HD2 LEU 40 2HD2 LEU 40 -4.426 -3.342 -7.359
303 3HD2 LEU 40 3HD2 LEU 40 -5.562 -4.646 -7.703
304 H ALA 41 H ALA 41 -2.824 -4.030 -12.140
305 HA ALA 41 HA ALA 41 -3.255 -6.337 -13.661
306 1HB ALA 41 1HB ALA 41 -1.956 -5.319 -15.363
307 2HB ALA 41 2HB ALA 41 -1.103 -4.310 -14.194
308 3HB ALA 41 3HB ALA 41 -2.809 -4.017 -14.533
309 H ALA 42 H ALA 42 -0.351 -5.144 -12.086
310 HA ALA 42 HA ALA 42 1.280 -7.360 -12.753
311 1HB ALA 42 1HB ALA 42 1.506 -5.002 -10.976
312 2HB ALA 42 2HB ALA 42 2.630 -5.621 -12.187
313 3HB ALA 42 3HB ALA 42 2.540 -6.380 -10.599
314 H LEU 43 H LEU 43 -0.916 -6.626 -10.157
315 HA LEU 43 HA LEU 43 -0.151 -8.623 -8.325
316 1HB LEU 43 2HB LEU 43 -2.570 -6.951 -8.787
317 2HB LEU 43 1HB LEU 43 -2.753 -8.369 -7.779
318 HG LEU 43 HG LEU 43 -0.673 -6.274 -7.231
319 1HD1 LEU 43 1HD1 LEU 43 -3.156 -6.397 -5.629
320 2HD1 LEU 43 2HD1 LEU 43 -3.269 -5.653 -7.221
321 3HD1 LEU 43 3HD1 LEU 43 -2.134 -5.018 -6.033
322 1HD2 LEU 43 1HD2 LEU 43 -1.559 -7.549 -4.910
323 2HD2 LEU 43 2HD2 LEU 43 -0.022 -7.775 -5.739
324 3HD2 LEU 43 3HD2 LEU 43 -1.384 -8.823 -6.115
325 H ALA 44 H ALA 44 -1.969 -8.700 -11.254
326 HA ALA 44 HA ALA 44 -3.471 -11.019 -10.875
327 1HB ALA 44 1HB ALA 44 -3.308 -9.237 -12.858
328 2HB ALA 44 2HB ALA 44 -4.031 -10.833 -13.060
329 3HB ALA 44 3HB ALA 44 -2.368 -10.547 -13.574
330 H SER 45 H SER 45 -0.097 -10.599 -11.413
331 HA SER 45 HA SER 45 0.208 -13.500 -11.520
332 1HB SER 45 2HB SER 45 1.114 -11.540 -13.437
333 2HB SER 45 1HB SER 45 2.474 -12.448 -12.777
334 HG SER 45 HG SER 45 1.339 -14.369 -13.337
335 H LYS 46 H LYS 46 0.596 -11.076 -9.482
336 HA LYS 46 HA LYS 46 2.906 -12.324 -8.251
337 1HB LYS 46 2HB LYS 46 3.562 -10.234 -9.640
338 2HB LYS 46 1HB LYS 46 2.795 -9.339 -8.334
339 1HG LYS 46 2HG LYS 46 4.985 -9.357 -7.652
340 2HG LYS 46 1HG LYS 46 4.354 -10.762 -6.814
341 1HD LYS 46 2HD LYS 46 5.244 -12.226 -8.461
342 2HD LYS 46 1HD LYS 46 5.714 -10.860 -9.482
343 1HE LYS 46 2HE LYS 46 7.154 -10.127 -7.488
344 2HE LYS 46 1HE LYS 46 6.904 -11.760 -6.873
345 1HZ LYS 46 1HZ LYS 46 8.971 -11.368 -8.244
346 2HZ LYS 46 2HZ LYS 46 7.955 -11.248 -9.591
347 3HZ LYS 46 3HZ LYS 46 8.012 -12.686 -8.701
348 H THR 47 H THR 47 3.240 -11.631 -6.045
349 HA THR 47 HA THR 47 0.924 -10.434 -4.768
350 HB THR 47 HB THR 47 2.140 -13.071 -3.925
351 HG1 THR 47 1HG THR 47 0.257 -12.628 -5.649
352 1HG2 THR 47 1HG2 THR 47 0.632 -13.170 -2.126
353 2HG2 THR 47 2HG2 THR 47 -0.230 -11.731 -2.670
354 3HG2 THR 47 3HG2 THR 47 1.406 -11.589 -2.029
355 HA PRO 48 HA PRO 48 4.569 -8.571 -2.860
356 1HB PRO 48 2HB PRO 48 3.394 -6.296 -2.047
357 2HB PRO 48 1HB PRO 48 3.793 -6.577 -3.744
358 1HG PRO 48 2HG PRO 48 1.164 -6.803 -2.354
359 2HG PRO 48 1HG PRO 48 1.531 -6.154 -3.960
360 1HD PRO 48 2HD PRO 48 0.545 -8.680 -3.488
361 2HD PRO 48 1HD PRO 48 1.443 -8.206 -4.936
362 H ASP 49 H ASP 49 5.278 -8.395 -0.730
363 HA ASP 49 HA ASP 49 3.716 -9.776 1.229
364 1HB ASP 49 2HB ASP 49 6.369 -8.337 1.445
365 2HB ASP 49 1HB ASP 49 5.651 -9.294 2.739
366 H VAL 50 H VAL 50 4.422 -6.438 0.513
367 HA VAL 50 HA VAL 50 2.410 -5.601 2.443
368 HB VAL 50 HB VAL 50 4.439 -5.508 3.764
369 1HG1 VAL 50 1HG1 VAL 50 5.854 -3.451 2.329
370 2HG1 VAL 50 2HG1 VAL 50 5.662 -4.901 1.338
371 3HG1 VAL 50 3HG1 VAL 50 6.432 -5.004 2.923
372 1HG2 VAL 50 1HG2 VAL 50 3.580 -2.763 2.861
373 2HG2 VAL 50 2HG2 VAL 50 4.467 -3.124 4.343
374 3HG2 VAL 50 3HG2 VAL 50 2.828 -3.734 4.125
375 H LEU 51 H LEU 51 1.143 -4.897 0.747
376 HA LEU 51 HA LEU 51 2.223 -3.108 -1.256
377 1HB LEU 51 2HB LEU 51 0.568 -4.913 -1.757
378 2HB LEU 51 1HB LEU 51 -0.625 -4.008 -0.848
379 HG LEU 51 HG LEU 51 -0.340 -2.127 -2.485
380 1HD1 LEU 51 1HD1 LEU 51 0.900 -4.034 -4.393
381 2HD1 LEU 51 2HD1 LEU 51 1.947 -3.229 -3.225
382 3HD1 LEU 51 3HD1 LEU 51 0.974 -2.271 -4.340
383 1HD2 LEU 51 1HD2 LEU 51 -2.030 -2.964 -3.711
384 2HD2 LEU 51 2HD2 LEU 51 -1.920 -4.325 -2.595
385 3HD2 LEU 51 3HD2 LEU 51 -1.124 -4.406 -4.166
386 H LEU 52 H LEU 52 1.785 -0.957 -1.497
387 HA LEU 52 HA LEU 52 0.298 0.384 0.680
388 1HB LEU 52 2HB LEU 52 3.010 0.625 -0.046
389 2HB LEU 52 1HB LEU 52 2.232 2.085 -0.617
390 HG LEU 52 HG LEU 52 1.727 1.244 2.186
391 1HD1 LEU 52 1HD1 LEU 52 4.135 0.953 1.922
392 2HD1 LEU 52 2HD1 LEU 52 3.756 2.330 2.954
393 3HD1 LEU 52 3HD1 LEU 52 4.261 2.592 1.285
394 1HD2 LEU 52 1HD2 LEU 52 1.576 3.605 2.557
395 2HD2 LEU 52 2HD2 LEU 52 0.630 3.214 1.121
396 3HD2 LEU 52 3HD2 LEU 52 2.225 3.944 0.953
397 H SER 53 H SER 53 -1.552 1.248 -0.150
398 HA SER 53 HA SER 53 -1.483 2.175 -2.943
399 1HB SER 53 2HB SER 53 -3.281 0.483 -1.677
400 2HB SER 53 1HB SER 53 -4.140 2.020 -1.768
401 HG SER 53 HG SER 53 -4.510 0.899 -3.658
402 H ASP 54 H ASP 54 -2.191 4.184 -3.531
403 HA ASP 54 HA ASP 54 -2.119 6.200 -1.464
404 1HB ASP 54 2HB ASP 54 -2.292 7.787 -3.399
405 2HB ASP 54 1HB ASP 54 -0.917 6.689 -3.478
406 H ILE 55 H ILE 55 -3.755 8.149 -2.083
407 HA ILE 55 HA ILE 55 -6.425 7.272 -2.692
408 HB ILE 55 HB ILE 55 -6.273 6.534 -0.380
409 1HG1 ILE 55 2HG1 ILE 55 -7.897 9.001 -0.056
410 2HG1 ILE 55 1HG1 ILE 55 -8.313 7.946 -1.394
411 1HG2 ILE 55 1HG2 ILE 55 -4.577 7.825 0.541
412 2HG2 ILE 55 2HG2 ILE 55 -6.032 8.332 1.389
413 3HG2 ILE 55 3HG2 ILE 55 -5.366 9.340 0.107
414 1HD1 ILE 55 1HD1 ILE 55 -8.727 7.588 1.467
415 2HD1 ILE 55 2HD1 ILE 55 -8.106 6.161 0.636
416 3HD1 ILE 55 3HD1 ILE 55 -9.605 6.915 0.094
417 H ARG 56 H ARG 56 -7.971 9.072 -2.645
418 HA ARG 56 HA ARG 56 -8.653 11.220 -2.937
419 1HB ARG 56 2HB ARG 56 -7.150 11.835 -1.046
420 2HB ARG 56 1HB ARG 56 -5.842 12.066 -2.199
421 1HG ARG 56 2HG ARG 56 -8.118 13.561 -3.056
422 2HG ARG 56 1HG ARG 56 -7.784 13.926 -1.363
423 1HD ARG 56 2HD ARG 56 -5.348 13.831 -2.915
424 2HD ARG 56 1HD ARG 56 -6.495 14.976 -3.604
425 HE ARG 56 HE ARG 56 -5.060 15.236 -1.136
426 1HH1 ARG 56 1HH1 ARG 56 -7.940 16.194 -2.862
427 2HH1 ARG 56 2HH1 ARG 56 -8.170 17.633 -1.927
428 1HH2 ARG 56 1HH2 ARG 56 -5.364 17.129 0.093
429 2HH2 ARG 56 2HH2 ARG 56 -6.710 18.165 -0.250
430 H MET 57 H MET 57 -8.173 9.771 -5.075
431 HA MET 57 HA MET 57 -7.439 11.707 -7.047
432 1HB MET 57 2HB MET 57 -5.505 9.640 -6.246
433 2HB MET 57 1HB MET 57 -5.804 9.709 -7.976
434 1HG MET 57 2HG MET 57 -5.481 12.356 -7.269
435 2HG MET 57 1HG MET 57 -4.302 11.509 -6.271
436 1HE MET 57 1HE MET 57 -4.745 13.492 -8.794
437 2HE MET 57 2HE MET 57 -4.582 12.699 -10.361
438 3HE MET 57 3HE MET 57 -3.165 13.394 -9.574
439 HA PRO 58 HA PRO 58 -8.876 7.680 -9.342
440 1HB PRO 58 2HB PRO 58 -9.293 5.463 -7.798
441 2HB PRO 58 1HB PRO 58 -7.761 5.818 -8.605
442 1HG PRO 58 2HG PRO 58 -8.573 6.319 -5.767
443 2HG PRO 58 1HG PRO 58 -7.051 5.657 -6.393
444 1HD PRO 58 2HD PRO 58 -7.239 8.223 -5.634
445 2HD PRO 58 1HD PRO 58 -6.257 7.746 -7.023
446 H GLY 59 H GLY 59 -10.850 5.881 -8.795
447 1HA GLY 59 2HA GLY 59 -13.155 7.400 -8.660
448 2HA GLY 59 1HA GLY 59 -13.091 5.672 -8.357
449 H MET 60 H MET 60 -12.959 4.915 -6.214
450 HA MET 60 HA MET 60 -14.276 6.582 -4.306
451 1HB MET 60 2HB MET 60 -14.238 3.936 -4.635
452 2HB MET 60 1HB MET 60 -12.949 4.055 -3.448
453 1HG MET 60 2HG MET 60 -14.572 3.934 -1.934
454 2HG MET 60 1HG MET 60 -14.885 5.621 -2.336
455 1HE MET 60 1HE MET 60 -16.952 1.830 -3.226
456 2HE MET 60 2HE MET 60 -15.256 2.175 -3.558
457 3HE MET 60 3HE MET 60 -16.461 2.370 -4.830
458 H ASP 61 H ASP 61 -12.261 8.114 -4.770
459 HA ASP 61 HA ASP 61 -10.527 9.273 -3.881
460 1HB ASP 61 2HB ASP 61 -12.029 8.258 -1.687
461 2HB ASP 61 1HB ASP 61 -10.324 8.144 -1.268
462 H GLY 62 H GLY 62 -10.160 6.268 -2.056
463 1HA GLY 62 2HA GLY 62 -7.792 5.541 -3.591
464 2HA GLY 62 1HA GLY 62 -7.524 5.960 -1.909
465 H LEU 63 H LEU 63 -10.088 4.833 -1.079
466 HA LEU 63 HA LEU 63 -9.214 2.230 -0.482
467 1HB LEU 63 2HB LEU 63 -12.090 2.971 -0.300
468 2HB LEU 63 1HB LEU 63 -11.117 2.012 0.796
469 HG LEU 63 HG LEU 63 -9.921 4.378 1.160
470 1HD1 LEU 63 1HD1 LEU 63 -12.741 5.272 0.876
471 2HD1 LEU 63 2HD1 LEU 63 -11.676 5.322 -0.522
472 3HD1 LEU 63 3HD1 LEU 63 -11.264 6.226 0.935
473 1HD2 LEU 63 1HD2 LEU 63 -10.995 2.832 2.794
474 2HD2 LEU 63 2HD2 LEU 63 -12.519 3.661 2.486
475 3HD2 LEU 63 3HD2 LEU 63 -11.156 4.545 3.180
476 H ALA 64 H ALA 64 -10.977 3.550 -3.140
477 HA ALA 64 HA ALA 64 -12.481 1.365 -3.984
478 1HB ALA 64 1HB ALA 64 -11.276 2.672 -6.245
479 2HB ALA 64 2HB ALA 64 -11.751 3.864 -5.037
480 3HB ALA 64 3HB ALA 64 -12.943 2.735 -5.678
481 H LEU 65 H LEU 65 -9.069 1.979 -4.115
482 HA LEU 65 HA LEU 65 -8.352 0.001 -6.005
483 1HB LEU 65 2HB LEU 65 -6.813 1.321 -3.770
484 2HB LEU 65 1HB LEU 65 -6.089 0.167 -4.873
485 HG LEU 65 HG LEU 65 -5.469 2.230 -5.750
486 1HD1 LEU 65 1HD1 LEU 65 -8.003 1.486 -7.200
487 2HD1 LEU 65 2HD1 LEU 65 -6.403 0.798 -7.477
488 3HD1 LEU 65 3HD1 LEU 65 -6.708 2.496 -7.841
489 1HD2 LEU 65 1HD2 LEU 65 -7.647 3.830 -6.199
490 2HD2 LEU 65 2HD2 LEU 65 -6.489 4.013 -4.883
491 3HD2 LEU 65 3HD2 LEU 65 -7.990 3.138 -4.621
492 H LEU 66 H LEU 66 -8.556 0.013 -2.470
493 HA LEU 66 HA LEU 66 -7.579 -2.512 -1.917
494 1HB LEU 66 2HB LEU 66 -9.970 -1.337 -0.515
495 2HB LEU 66 1HB LEU 66 -8.766 -2.430 0.140
496 HG LEU 66 HG LEU 66 -8.025 0.337 -0.759
497 1HD1 LEU 66 1HD1 LEU 66 -9.940 0.053 1.063
498 2HD1 LEU 66 2HD1 LEU 66 -8.703 1.301 1.164
499 3HD1 LEU 66 3HD1 LEU 66 -8.535 -0.177 2.105
500 1HD2 LEU 66 1HD2 LEU 66 -6.614 -1.890 0.279
501 2HD2 LEU 66 2HD2 LEU 66 -6.615 -0.631 1.514
502 3HD2 LEU 66 3HD2 LEU 66 -6.001 -0.281 -0.101
503 H LYS 67 H LYS 67 -10.863 -1.561 -2.849
504 HA LYS 67 HA LYS 67 -12.135 -4.019 -2.608
505 1HB LYS 67 2HB LYS 67 -12.953 -1.582 -3.373
506 2HB LYS 67 1HB LYS 67 -12.841 -2.341 -4.955
507 1HG LYS 67 2HG LYS 67 -14.320 -4.157 -4.122
508 2HG LYS 67 1HG LYS 67 -14.511 -3.251 -2.619
509 1HD LYS 67 2HD LYS 67 -15.084 -1.942 -5.247
510 2HD LYS 67 1HD LYS 67 -16.283 -3.002 -4.507
511 1HE LYS 67 2HE LYS 67 -15.263 -1.203 -2.533
512 2HE LYS 67 1HE LYS 67 -15.772 -0.283 -3.949
513 1HZ LYS 67 1HZ LYS 67 -17.485 -0.811 -2.130
514 2HZ LYS 67 2HZ LYS 67 -17.527 -2.361 -2.809
515 3HZ LYS 67 3HZ LYS 67 -17.940 -1.016 -3.747
516 H GLN 68 H GLN 68 -10.323 -2.679 -5.346
517 HA GLN 68 HA GLN 68 -10.759 -4.914 -7.038
518 1HB GLN 68 2HB GLN 68 -8.463 -2.975 -7.258
519 2HB GLN 68 1HB GLN 68 -9.211 -3.918 -8.539
520 1HG GLN 68 2HG GLN 68 -10.674 -1.774 -7.026
521 2HG GLN 68 1HG GLN 68 -9.755 -1.462 -8.500
522 1HE2 GLN 68 1HE2 GLN 68 -12.630 -1.214 -7.926
523 2HE2 GLN 68 2HE2 GLN 68 -13.427 -2.184 -9.113
524 H ILE 69 H ILE 69 -8.061 -3.959 -4.928
525 HA ILE 69 HA ILE 69 -6.300 -6.032 -5.611
526 HB ILE 69 HB ILE 69 -6.548 -4.694 -2.915
527 1HG1 ILE 69 2HG1 ILE 69 -4.696 -3.922 -5.169
528 2HG1 ILE 69 1HG1 ILE 69 -6.259 -3.154 -4.918
529 1HG2 ILE 69 1HG2 ILE 69 -5.135 -6.478 -2.542
530 2HG2 ILE 69 2HG2 ILE 69 -3.998 -5.206 -2.992
531 3HG2 ILE 69 3HG2 ILE 69 -4.468 -6.428 -4.174
532 1HD1 ILE 69 1HD1 ILE 69 -5.584 -2.289 -2.813
533 2HD1 ILE 69 2HD1 ILE 69 -4.305 -1.924 -3.972
534 3HD1 ILE 69 3HD1 ILE 69 -4.106 -3.250 -2.826
535 H LYS 70 H LYS 70 -8.934 -5.908 -3.324
536 HA LYS 70 HA LYS 70 -8.340 -8.396 -2.097
537 1HB LYS 70 2HB LYS 70 -10.468 -8.176 -0.979
538 2HB LYS 70 1HB LYS 70 -9.627 -6.637 -0.974
539 1HG LYS 70 2HG LYS 70 -11.054 -5.712 -2.567
540 2HG LYS 70 1HG LYS 70 -11.701 -7.288 -3.028
541 1HD LYS 70 2HD LYS 70 -12.564 -7.439 -0.629
542 2HD LYS 70 1HD LYS 70 -12.201 -5.716 -0.514
543 1HE LYS 70 2HE LYS 70 -14.495 -5.906 -1.102
544 2HE LYS 70 1HE LYS 70 -13.634 -5.383 -2.550
545 1HZ LYS 70 1HZ LYS 70 -13.627 -7.710 -3.294
546 2HZ LYS 70 2HZ LYS 70 -15.194 -7.100 -3.111
547 3HZ LYS 70 3HZ LYS 70 -14.550 -8.141 -1.943
548 H GLN 71 H GLN 71 -10.101 -7.445 -4.912
549 HA GLN 71 HA GLN 71 -11.689 -9.751 -5.207
550 1HB GLN 71 2HB GLN 71 -10.981 -7.427 -6.808
551 2HB GLN 71 1HB GLN 71 -11.165 -8.881 -7.781
552 1HG GLN 71 2HG GLN 71 -13.395 -9.117 -7.244
553 2HG GLN 71 1HG GLN 71 -13.248 -8.159 -5.770
554 1HE2 GLN 71 1HE2 GLN 71 -12.345 -5.854 -6.339
555 2HE2 GLN 71 2HE2 GLN 71 -13.233 -5.037 -7.576
556 H ARG 72 H ARG 72 -8.453 -8.938 -6.224
557 HA ARG 72 HA ARG 72 -8.111 -11.548 -7.477
558 1HB ARG 72 2HB ARG 72 -6.811 -8.936 -7.703
559 2HB ARG 72 1HB ARG 72 -5.677 -10.281 -7.680
560 1HG ARG 72 2HG ARG 72 -7.145 -11.326 -9.483
561 2HG ARG 72 1HG ARG 72 -7.886 -9.732 -9.630
562 1HD ARG 72 2HD ARG 72 -5.585 -8.799 -9.980
563 2HD ARG 72 1HD ARG 72 -4.999 -10.459 -10.059
564 HE ARG 72 HE ARG 72 -6.300 -9.017 -12.126
565 1HH1 ARG 72 1HH1 ARG 72 -5.985 -12.221 -10.771
566 2HH1 ARG 72 2HH1 ARG 72 -6.400 -13.020 -12.249
567 1HH2 ARG 72 1HH2 ARG 72 -6.843 -10.071 -14.067
568 2HH2 ARG 72 2HH2 ARG 72 -6.886 -11.801 -14.119
569 H HIS 73 H HIS 73 -7.291 -9.850 -4.596
570 HA HIS 73 HA HIS 73 -5.908 -12.237 -3.610
571 1HB HIS 73 2HB HIS 73 -4.874 -9.423 -3.244
572 2HB HIS 73 1HB HIS 73 -4.135 -10.896 -2.617
573 HD1 HIS 73 1HD HIS 73 -3.017 -12.484 -4.391
574 HD2 HIS 73 2HD HIS 73 -4.286 -8.807 -5.861
575 HE1 HIS 73 1HE HIS 73 -1.914 -12.247 -6.634
576 HE2 HIS 73 2HE HIS 73 -2.840 -10.107 -7.575
577 HA PRO 74 HA PRO 74 -8.942 -10.976 -0.456
578 1HB PRO 74 2HB PRO 74 -9.361 -13.417 0.576
579 2HB PRO 74 1HB PRO 74 -10.069 -12.921 -0.966
580 1HG PRO 74 2HG PRO 74 -7.628 -14.580 -0.452
581 2HG PRO 74 1HG PRO 74 -8.935 -14.853 -1.618
582 1HD PRO 74 2HD PRO 74 -6.538 -13.737 -2.292
583 2HD PRO 74 1HD PRO 74 -8.054 -13.370 -3.138
584 H MET 75 H MET 75 -5.758 -11.543 -0.193
585 HA MET 75 HA MET 75 -5.811 -11.169 2.685
586 1HB MET 75 2HB MET 75 -4.409 -13.464 1.344
587 2HB MET 75 1HB MET 75 -3.977 -12.901 2.953
588 1HG MET 75 2HG MET 75 -6.047 -13.525 3.852
589 2HG MET 75 1HG MET 75 -6.786 -13.686 2.263
590 1HE MET 75 1HE MET 75 -5.216 -15.231 5.157
591 2HE MET 75 2HE MET 75 -5.225 -16.949 4.760
592 3HE MET 75 3HE MET 75 -6.738 -16.044 4.793
593 H LEU 76 H LEU 76 -4.895 -9.868 -0.027
594 HA LEU 76 HA LEU 76 -2.097 -9.433 0.337
595 1HB LEU 76 2HB LEU 76 -3.800 -9.144 -1.754
596 2HB LEU 76 1HB LEU 76 -3.628 -7.480 -1.246
597 HG LEU 76 HG LEU 76 -2.083 -8.391 -3.091
598 1HD1 LEU 76 1HD1 LEU 76 -0.805 -6.597 -2.695
599 2HD1 LEU 76 2HD1 LEU 76 -0.406 -7.107 -1.053
600 3HD1 LEU 76 3HD1 LEU 76 -1.948 -6.311 -1.383
601 1HD2 LEU 76 1HD2 LEU 76 -0.143 -9.129 -1.018
602 2HD2 LEU 76 2HD2 LEU 76 -0.437 -9.831 -2.608
603 3HD2 LEU 76 3HD2 LEU 76 -1.456 -10.285 -1.247
604 HA PRO 77 HA PRO 77 -2.785 -6.344 3.580
605 1HB PRO 77 2HB PRO 77 0.160 -6.148 3.365
606 2HB PRO 77 1HB PRO 77 -0.842 -6.466 4.785
607 1HG PRO 77 2HG PRO 77 0.601 -8.412 3.679
608 2HG PRO 77 1HG PRO 77 -1.026 -8.733 4.307
609 1HD PRO 77 2HD PRO 77 -0.140 -8.325 1.472
610 2HD PRO 77 1HD PRO 77 -1.271 -9.522 2.137
611 H VAL 78 H VAL 78 -3.274 -4.265 3.181
612 HA VAL 78 HA VAL 78 -1.658 -2.817 1.197
613 HB VAL 78 HB VAL 78 -4.586 -2.266 1.604
614 1HG1 VAL 78 1HG1 VAL 78 -3.262 -0.496 0.582
615 2HG1 VAL 78 2HG1 VAL 78 -4.369 -1.202 -0.595
616 3HG1 VAL 78 3HG1 VAL 78 -2.660 -1.629 -0.627
617 1HG2 VAL 78 1HG2 VAL 78 -5.124 -3.638 -0.275
618 2HG2 VAL 78 2HG2 VAL 78 -4.211 -4.631 0.861
619 3HG2 VAL 78 3HG2 VAL 78 -3.423 -3.987 -0.579
620 H ILE 79 H ILE 79 -1.438 -0.556 1.497
621 HA ILE 79 HA ILE 79 -2.214 0.467 4.139
622 HB ILE 79 HB ILE 79 0.503 0.961 2.949
623 1HG1 ILE 79 2HG1 ILE 79 0.616 -0.560 5.366
624 2HG1 ILE 79 1HG1 ILE 79 -0.413 -1.398 4.214
625 1HG2 ILE 79 1HG2 ILE 79 -0.892 2.341 4.877
626 2HG2 ILE 79 2HG2 ILE 79 0.852 2.392 4.619
627 3HG2 ILE 79 3HG2 ILE 79 0.168 1.284 5.805
628 1HD1 ILE 79 1HD1 ILE 79 1.479 -1.087 2.555
629 2HD1 ILE 79 2HD1 ILE 79 1.725 -2.239 3.863
630 3HD1 ILE 79 3HD1 ILE 79 2.466 -0.642 3.944
631 H ILE 80 H ILE 80 -3.500 2.119 3.742
632 HA ILE 80 HA ILE 80 -3.107 3.725 1.347
633 HB ILE 80 HB ILE 80 -5.355 3.974 3.322
634 1HG1 ILE 80 2HG1 ILE 80 -5.171 1.643 2.486
635 2HG1 ILE 80 1HG1 ILE 80 -6.627 2.442 1.918
636 1HG2 ILE 80 1HG2 ILE 80 -5.524 4.537 0.398
637 2HG2 ILE 80 2HG2 ILE 80 -4.752 5.710 1.462
638 3HG2 ILE 80 3HG2 ILE 80 -6.430 5.245 1.730
639 1HD1 ILE 80 1HD1 ILE 80 -4.432 1.317 0.423
640 2HD1 ILE 80 2HD1 ILE 80 -4.798 2.973 -0.062
641 3HD1 ILE 80 3HD1 ILE 80 -6.061 1.741 -0.100
642 H MET 81 H MET 81 -2.559 5.849 1.328
643 HA MET 81 HA MET 81 -1.184 6.866 3.596
644 1HB MET 81 2HB MET 81 -1.046 8.988 2.201
645 2HB MET 81 1HB MET 81 -0.339 7.532 1.518
646 1HG MET 81 2HG MET 81 -1.539 7.795 -0.299
647 2HG MET 81 1HG MET 81 -3.010 7.635 0.650
648 1HE MET 81 1HE MET 81 -0.197 10.408 0.606
649 2HE MET 81 2HE MET 81 -0.953 11.621 -0.428
650 3HE MET 81 3HE MET 81 -0.501 10.054 -1.095
651 H THR 82 H THR 82 -4.448 7.388 2.401
652 HA THR 82 HA THR 82 -5.069 8.812 4.864
653 HB THR 82 HB THR 82 -5.671 9.985 2.138
654 HG1 THR 82 1HG THR 82 -3.724 10.710 2.531
655 1HG2 THR 82 1HG2 THR 82 -6.837 11.723 3.101
656 2HG2 THR 82 2HG2 THR 82 -6.218 11.379 4.717
657 3HG2 THR 82 3HG2 THR 82 -7.426 10.321 3.991
658 H ALA 83 H ALA 83 -7.346 8.838 5.377
659 HA ALA 83 HA ALA 83 -8.790 6.674 4.009
660 1HB ALA 83 1HB ALA 83 -9.579 5.969 5.997
661 2HB ALA 83 2HB ALA 83 -9.779 7.608 6.621
662 3HB ALA 83 3HB ALA 83 -8.186 6.851 6.623
663 H HIS 84 H HIS 84 -9.079 10.014 5.050
664 HA HIS 84 HA HIS 84 -10.722 11.572 4.780
665 1HB HIS 84 2HB HIS 84 -10.462 10.137 2.181
666 2HB HIS 84 1HB HIS 84 -11.713 11.365 2.338
667 HD1 HIS 84 1HD HIS 84 -9.677 13.066 4.311
668 HD2 HIS 84 2HD HIS 84 -9.090 11.848 0.386
669 HE1 HIS 84 1HE HIS 84 -7.933 14.613 3.384
670 HE2 HIS 84 2HE HIS 84 -7.609 13.876 0.996
671 H SER 85 H SER 85 -13.125 11.620 3.411
672 HA SER 85 HA SER 85 -14.790 10.158 5.242
673 1HB SER 85 2HB SER 85 -15.125 12.374 3.333
674 2HB SER 85 1HB SER 85 -16.534 11.326 3.493
675 HG SER 85 HG SER 85 -16.673 11.815 5.616
676 H ASP 86 H ASP 86 -14.228 8.004 4.543
677 HA ASP 86 HA ASP 86 -16.187 6.820 2.953
678 1HB ASP 86 2HB ASP 86 -13.993 7.861 1.431
679 2HB ASP 86 1HB ASP 86 -13.972 6.106 1.342
680 H LEU 87 H LEU 87 -14.659 6.540 5.447
681 HA LEU 87 HA LEU 87 -12.854 4.485 5.553
682 1HB LEU 87 2HB LEU 87 -14.615 5.823 7.383
683 2HB LEU 87 1HB LEU 87 -14.572 4.112 7.759
684 HG LEU 87 HG LEU 87 -12.925 5.528 9.015
685 1HD1 LEU 87 1HD1 LEU 87 -11.555 3.478 7.314
686 2HD1 LEU 87 2HD1 LEU 87 -12.707 3.047 8.575
687 3HD1 LEU 87 3HD1 LEU 87 -11.225 3.910 8.988
688 1HD2 LEU 87 1HD2 LEU 87 -12.335 7.034 7.165
689 2HD2 LEU 87 2HD2 LEU 87 -11.544 5.691 6.340
690 3HD2 LEU 87 3HD2 LEU 87 -10.916 6.270 7.881
691 H ASP 88 H ASP 88 -16.174 4.254 4.701
692 HA ASP 88 HA ASP 88 -16.948 1.756 5.478
693 1HB ASP 88 2HB ASP 88 -17.484 3.341 2.995
694 2HB ASP 88 1HB ASP 88 -18.123 1.707 3.140
695 H ALA 89 H ALA 89 -15.190 2.454 2.429
696 HA ALA 89 HA ALA 89 -14.838 -0.295 1.818
697 1HB ALA 89 1HB ALA 89 -14.845 1.503 0.118
698 2HB ALA 89 2HB ALA 89 -13.438 0.441 0.007
699 3HB ALA 89 3HB ALA 89 -13.288 2.039 0.737
700 H ALA 90 H ALA 90 -13.161 1.919 3.833
701 HA ALA 90 HA ALA 90 -10.602 0.677 3.801
702 1HB ALA 90 1HB ALA 90 -11.737 2.249 6.098
703 2HB ALA 90 2HB ALA 90 -11.135 3.017 4.636
704 3HB ALA 90 3HB ALA 90 -10.046 2.061 5.633
705 H VAL 91 H VAL 91 -13.471 0.354 5.857
706 HA VAL 91 HA VAL 91 -12.331 -1.387 7.731
707 HB VAL 91 HB VAL 91 -15.224 -1.547 6.966
708 1HG1 VAL 91 1HG1 VAL 91 -13.516 -2.418 9.170
709 2HG1 VAL 91 2HG1 VAL 91 -15.105 -3.004 8.665
710 3HG1 VAL 91 3HG1 VAL 91 -14.978 -1.580 9.699
711 1HG2 VAL 91 1HG2 VAL 91 -13.761 0.665 8.353
712 2HG2 VAL 91 2HG2 VAL 91 -15.419 0.279 8.815
713 3HG2 VAL 91 3HG2 VAL 91 -15.054 0.757 7.156
714 H SER 92 H SER 92 -14.131 -2.065 4.744
715 HA SER 92 HA SER 92 -14.011 -4.875 5.007
716 1HB SER 92 2HB SER 92 -14.243 -3.247 2.465
717 2HB SER 92 1HB SER 92 -14.618 -4.966 2.642
718 HG SER 92 HG SER 92 -16.241 -4.329 4.168
719 H ALA 93 H ALA 93 -11.713 -2.497 4.083
720 HA ALA 93 HA ALA 93 -10.018 -4.103 2.511
721 1HB ALA 93 1HB ALA 93 -9.713 -1.765 2.369
722 2HB ALA 93 2HB ALA 93 -8.270 -2.406 3.151
723 3HB ALA 93 3HB ALA 93 -9.515 -1.623 4.113
724 H TYR 94 H TYR 94 -10.277 -3.458 5.931
725 HA TYR 94 HA TYR 94 -7.958 -4.923 6.703
726 1HB TYR 94 2HB TYR 94 -10.350 -4.478 8.482
727 2HB TYR 94 1HB TYR 94 -8.655 -4.606 8.939
728 HD1 TYR 94 1HD TYR 94 -7.223 -2.710 7.428
729 HD2 TYR 94 2HD TYR 94 -11.201 -2.396 8.917
730 HE1 TYR 94 1HE TYR 94 -7.032 -0.257 7.403
731 HE2 TYR 94 2HE TYR 94 -11.017 0.059 8.890
732 HH TYR 94 HH TYR 94 -9.502 1.795 8.792
733 H GLN 95 H GLN 95 -11.166 -5.729 5.832
734 HA GLN 95 HA GLN 95 -11.346 -8.246 7.142
735 1HB GLN 95 2HB GLN 95 -13.429 -7.467 6.536
736 2HB GLN 95 1HB GLN 95 -12.864 -6.829 5.006
737 1HG GLN 95 2HG GLN 95 -12.939 -9.778 5.409
738 2HG GLN 95 1HG GLN 95 -14.436 -8.904 5.089
739 1HE2 GLN 95 1HE2 GLN 95 -13.748 -7.034 3.291
740 2HE2 GLN 95 2HE2 GLN 95 -13.135 -7.760 1.847
741 H GLN 96 H GLN 96 -10.352 -7.242 3.877
742 HA GLN 96 HA GLN 96 -9.777 -9.922 3.074
743 1HB GLN 96 2HB GLN 96 -8.918 -8.997 1.035
744 2HB GLN 96 1HB GLN 96 -10.403 -8.151 1.447
745 1HG GLN 96 2HG GLN 96 -8.260 -6.716 2.602
746 2HG GLN 96 1HG GLN 96 -7.815 -7.091 0.940
747 1HE2 GLN 96 1HE2 GLN 96 -7.982 -4.938 0.313
748 2HE2 GLN 96 2HE2 GLN 96 -9.511 -4.159 0.119
749 H GLY 97 H GLY 97 -8.119 -7.550 4.898
750 1HA GLY 97 2HA GLY 97 -6.207 -8.593 6.129
751 2HA GLY 97 1HA GLY 97 -5.607 -9.074 4.554
752 H ALA 98 H ALA 98 -7.035 -5.941 4.697
753 HA ALA 98 HA ALA 98 -4.758 -4.613 3.825
754 1HB ALA 98 1HB ALA 98 -5.946 -2.531 4.616
755 2HB ALA 98 2HB ALA 98 -7.206 -3.598 5.231
756 3HB ALA 98 3HB ALA 98 -6.844 -3.563 3.504
757 H PHE 99 H PHE 99 -3.277 -3.182 4.897
758 HA PHE 99 HA PHE 99 -2.502 -4.143 7.474
759 1HB PHE 99 2HB PHE 99 -0.887 -3.438 5.665
760 2HB PHE 99 1HB PHE 99 -1.325 -1.770 6.028
761 HD1 PHE 99 1HD PHE 99 -0.589 -4.751 8.150
762 HD2 PHE 99 2HD PHE 99 0.369 -0.724 7.171
763 HE1 PHE 99 1HE PHE 99 1.074 -4.708 9.961
764 HE2 PHE 99 2HE PHE 99 2.038 -0.684 8.973
765 HZ PHE 99 HZ PHE 99 2.389 -2.671 10.374
766 H ASP 100 H ASP 100 -3.511 -0.928 6.262
767 HA ASP 100 HA ASP 100 -5.244 -0.278 8.287
768 1HB ASP 100 2HB ASP 100 -2.592 -0.342 9.310
769 2HB ASP 100 1HB ASP 100 -3.082 1.348 9.241
770 H TYR 101 H TYR 101 -4.755 2.373 8.834
771 HA TYR 101 HA TYR 101 -4.446 3.632 6.197
772 1HB TYR 101 2HB TYR 101 -6.826 3.549 7.928
773 2HB TYR 101 1HB TYR 101 -6.405 5.154 7.338
774 HD1 TYR 101 1HD TYR 101 -7.228 1.702 6.266
775 HD2 TYR 101 2HD TYR 101 -6.831 5.780 5.109
776 HE1 TYR 101 1HE TYR 101 -8.304 1.196 4.109
777 HE2 TYR 101 2HE TYR 101 -7.906 5.283 2.957
778 HH TYR 101 HH TYR 101 -8.278 3.368 1.496
779 H LEU 102 H LEU 102 -3.874 5.868 6.242
780 HA LEU 102 HA LEU 102 -2.505 6.623 8.727
781 1HB LEU 102 2HB LEU 102 -1.803 6.737 5.958
782 2HB LEU 102 1HB LEU 102 -1.808 8.366 6.603
783 HG LEU 102 HG LEU 102 -0.194 7.765 8.293
784 1HD1 LEU 102 1HD1 LEU 102 -0.878 5.529 8.813
785 2HD1 LEU 102 2HD1 LEU 102 0.811 5.506 8.305
786 3HD1 LEU 102 3HD1 LEU 102 -0.452 4.978 7.194
787 1HD2 LEU 102 1HD2 LEU 102 1.086 8.383 6.549
788 2HD2 LEU 102 2HD2 LEU 102 0.329 7.242 5.441
789 3HD2 LEU 102 3HD2 LEU 102 1.564 6.688 6.574
790 HA PRO 103 HA PRO 103 -5.755 9.694 9.099
791 1HB PRO 103 2HB PRO 103 -4.949 10.696 11.502
792 2HB PRO 103 1HB PRO 103 -5.890 9.214 11.327
793 1HG PRO 103 2HG PRO 103 -2.999 9.565 11.895
794 2HG PRO 103 1HG PRO 103 -4.106 8.291 12.427
795 1HD PRO 103 2HD PRO 103 -2.252 8.050 10.380
796 2HD PRO 103 1HD PRO 103 -3.670 7.011 10.603
797 H LYS 104 H LYS 104 -2.824 10.965 10.659
798 HA LYS 104 HA LYS 104 -2.964 13.256 8.823
799 1HB LYS 104 2HB LYS 104 -2.910 13.161 11.643
800 2HB LYS 104 1HB LYS 104 -1.356 13.806 11.135
801 1HG LYS 104 2HG LYS 104 -2.291 15.670 10.161
802 2HG LYS 104 1HG LYS 104 -3.863 14.895 9.945
803 1HD LYS 104 2HD LYS 104 -4.518 15.315 12.094
804 2HD LYS 104 1HD LYS 104 -2.866 15.275 12.718
805 1HE LYS 104 2HE LYS 104 -2.424 17.450 11.717
806 2HE LYS 104 1HE LYS 104 -4.050 17.484 11.038
807 1HZ LYS 104 1HZ LYS 104 -4.860 17.312 13.395
808 2HZ LYS 104 2HZ LYS 104 -4.111 18.773 12.989
809 3HZ LYS 104 3HZ LYS 104 -3.272 17.616 13.892
810 HA PRO 105 HA PRO 105 1.827 12.409 9.495
811 1HB PRO 105 2HB PRO 105 1.628 9.560 10.333
812 2HB PRO 105 1HB PRO 105 2.766 10.812 10.845
813 1HG PRO 105 2HG PRO 105 0.788 10.044 12.449
814 2HG PRO 105 1HG PRO 105 1.273 11.747 12.347
815 1HD PRO 105 2HD PRO 105 -1.094 10.371 11.154
816 2HD PRO 105 1HD PRO 105 -0.965 11.999 11.850
817 H PHE 106 H PHE 106 3.157 11.552 7.897
818 HA PHE 106 HA PHE 106 2.380 9.346 6.266
819 1HB PHE 106 2HB PHE 106 0.799 11.048 5.423
820 2HB PHE 106 1HB PHE 106 2.149 12.109 5.035
821 HD1 PHE 106 1HD PHE 106 1.253 8.531 4.403
822 HD2 PHE 106 2HD PHE 106 2.632 12.221 2.800
823 HE1 PHE 106 1HE PHE 106 1.426 7.498 2.184
824 HE2 PHE 106 2HE PHE 106 2.800 11.194 0.572
825 HZ PHE 106 HZ PHE 106 2.196 8.827 0.261
826 H ASP 107 H ASP 107 3.912 11.704 4.332
827 HA ASP 107 HA ASP 107 6.004 11.663 3.408
828 1HB ASP 107 2HB ASP 107 7.760 12.320 4.990
829 2HB ASP 107 1HB ASP 107 6.271 13.211 5.284
830 H ILE 108 H ILE 108 8.378 10.690 3.761
831 HA ILE 108 HA ILE 108 8.080 7.895 3.459
832 HB ILE 108 HB ILE 108 10.175 9.822 3.072
833 1HG1 ILE 108 2HG1 ILE 108 10.806 8.364 1.290
834 2HG1 ILE 108 1HG1 ILE 108 9.977 7.002 2.033
835 1HG2 ILE 108 1HG2 ILE 108 10.926 7.299 4.492
836 2HG2 ILE 108 2HG2 ILE 108 11.470 8.946 4.795
837 3HG2 ILE 108 3HG2 ILE 108 12.036 8.076 3.369
838 1HD1 ILE 108 1HD1 ILE 108 8.867 8.151 0.042
839 2HD1 ILE 108 2HD1 ILE 108 8.488 9.451 1.171
840 3HD1 ILE 108 3HD1 ILE 108 7.875 7.825 1.462
841 H ASP 109 H ASP 109 9.366 9.875 6.026
842 HA ASP 109 HA ASP 109 10.449 7.993 7.695
843 1HB ASP 109 2HB ASP 109 9.185 10.635 8.104
844 2HB ASP 109 1HB ASP 109 9.330 9.623 9.536
845 H GLU 110 H GLU 110 7.054 9.127 7.898
846 HA GLU 110 HA GLU 110 6.375 7.013 9.686
847 1HB GLU 110 2HB GLU 110 4.777 9.145 8.320
848 2HB GLU 110 1HB GLU 110 3.990 7.870 9.232
849 1HG GLU 110 2HG GLU 110 6.148 9.530 10.467
850 2HG GLU 110 1HG GLU 110 4.488 10.120 10.369
851 H ALA 111 H ALA 111 6.085 7.563 6.260
852 HA ALA 111 HA ALA 111 4.261 5.489 5.683
853 1HB ALA 111 1HB ALA 111 5.251 5.631 3.364
854 2HB ALA 111 2HB ALA 111 6.351 6.853 4.002
855 3HB ALA 111 3HB ALA 111 4.613 7.141 4.017
856 H VAL 112 H VAL 112 7.799 5.598 5.264
857 HA VAL 112 HA VAL 112 8.125 2.870 4.731
858 HB VAL 112 HB VAL 112 10.135 4.721 6.004
859 1HG1 VAL 112 1HG1 VAL 112 10.267 1.982 5.557
860 2HG1 VAL 112 2HG1 VAL 112 11.620 3.069 5.882
861 3HG1 VAL 112 3HG1 VAL 112 11.169 2.697 4.219
862 1HG2 VAL 112 1HG2 VAL 112 9.921 5.863 4.086
863 2HG2 VAL 112 2HG2 VAL 112 9.059 4.553 3.285
864 3HG2 VAL 112 3HG2 VAL 112 10.820 4.529 3.371
865 H ALA 113 H ALA 113 7.898 4.662 7.684
866 HA ALA 113 HA ALA 113 8.878 2.737 9.484
867 1HB ALA 113 1HB ALA 113 7.550 3.985 11.166
868 2HB ALA 113 2HB ALA 113 6.807 4.895 9.851
869 3HB ALA 113 3HB ALA 113 8.540 5.034 10.155
870 H LEU 114 H LEU 114 5.647 3.451 8.293
871 HA LEU 114 HA LEU 114 4.389 1.338 9.724
872 1HB LEU 114 2HB LEU 114 3.208 3.389 9.144
873 2HB LEU 114 1HB LEU 114 3.416 3.046 7.439
874 HG LEU 114 HG LEU 114 2.065 0.910 7.885
875 1HD1 LEU 114 1HD1 LEU 114 1.941 0.670 10.182
876 2HD1 LEU 114 2HD1 LEU 114 0.396 1.437 9.814
877 3HD1 LEU 114 3HD1 LEU 114 1.729 2.399 10.453
878 1HD2 LEU 114 1HD2 LEU 114 1.313 3.014 6.717
879 2HD2 LEU 114 2HD2 LEU 114 0.598 3.498 8.253
880 3HD2 LEU 114 3HD2 LEU 114 0.035 2.040 7.445
881 H VAL 115 H VAL 115 6.023 1.552 6.695
882 HA VAL 115 HA VAL 115 4.675 -0.703 5.544
883 HB VAL 115 HB VAL 115 5.800 1.169 4.207
884 1HG1 VAL 115 1HG1 VAL 115 8.257 -0.404 3.995
885 2HG1 VAL 115 2HG1 VAL 115 8.067 0.434 5.530
886 3HG1 VAL 115 3HG1 VAL 115 8.023 1.340 4.025
887 1HG2 VAL 115 1HG2 VAL 115 5.158 -1.443 3.618
888 2HG2 VAL 115 2HG2 VAL 115 6.790 -1.269 2.974
889 3HG2 VAL 115 3HG2 VAL 115 5.516 -0.172 2.452
890 H GLU 116 H GLU 116 7.696 -0.178 7.255
891 HA GLU 116 HA GLU 116 8.738 -2.783 6.848
892 1HB GLU 116 2HB GLU 116 9.326 -0.712 8.963
893 2HB GLU 116 1HB GLU 116 10.238 -2.202 8.763
894 1HG GLU 116 2HG GLU 116 11.075 -1.533 6.670
895 2HG GLU 116 1HG GLU 116 9.909 -0.218 6.537
896 H ARG 117 H ARG 117 6.735 -1.315 9.335
897 HA ARG 117 HA ARG 117 6.779 -3.455 11.152
898 1HB ARG 117 2HB ARG 117 4.782 -1.251 10.668
899 2HB ARG 117 1HB ARG 117 4.593 -2.428 11.961
900 1HG ARG 117 2HG ARG 117 7.148 -0.912 11.744
901 2HG ARG 117 1HG ARG 117 5.721 -0.118 12.412
902 1HD ARG 117 2HD ARG 117 6.116 -2.774 13.508
903 2HD ARG 117 1HD ARG 117 7.508 -1.730 13.783
904 HE ARG 117 HE ARG 117 5.625 -0.113 14.605
905 1HH1 ARG 117 1HH1 ARG 117 5.865 -3.558 15.158
906 2HH1 ARG 117 2HH1 ARG 117 4.996 -3.499 16.653
907 1HH2 ARG 117 1HH2 ARG 117 4.489 -0.046 16.578
908 2HH2 ARG 117 2HH2 ARG 117 4.216 -1.512 17.459
909 H ALA 118 H ALA 118 5.015 -2.937 8.224
910 HA ALA 118 HA ALA 118 2.958 -4.828 8.674
911 1HB ALA 118 1HB ALA 118 3.718 -4.421 5.883
912 2HB ALA 118 2HB ALA 118 3.430 -2.928 6.774
913 3HB ALA 118 3HB ALA 118 2.171 -4.159 6.687
914 H ILE 119 H ILE 119 6.090 -5.001 7.023
915 HA ILE 119 HA ILE 119 5.846 -7.650 6.114
916 HB ILE 119 HB ILE 119 8.388 -6.208 6.863
917 1HG1 ILE 119 2HG1 ILE 119 7.481 -6.334 4.047
918 2HG1 ILE 119 1HG1 ILE 119 6.579 -5.256 5.109
919 1HG2 ILE 119 1HG2 ILE 119 7.837 -8.547 5.046
920 2HG2 ILE 119 2HG2 ILE 119 8.799 -8.541 6.524
921 3HG2 ILE 119 3HG2 ILE 119 9.368 -7.675 5.097
922 1HD1 ILE 119 1HD1 ILE 119 9.564 -5.177 4.928
923 2HD1 ILE 119 2HD1 ILE 119 8.462 -3.962 5.570
924 3HD1 ILE 119 3HD1 ILE 119 8.525 -4.264 3.835
925 H SER 120 H SER 120 6.793 -6.275 9.148
926 HA SER 120 HA SER 120 7.868 -8.674 10.255
927 1HB SER 120 2HB SER 120 8.451 -6.322 10.988
928 2HB SER 120 1HB SER 120 6.876 -6.261 11.776
929 HG SER 120 HG SER 120 8.831 -6.986 13.028
930 H HIS 121 H HIS 121 4.819 -6.892 10.701
931 HA HIS 121 HA HIS 121 3.656 -8.732 12.489
932 1HB HIS 121 2HB HIS 121 2.639 -6.507 10.788
933 2HB HIS 121 1HB HIS 121 1.469 -7.638 11.462
934 HD1 HIS 121 1HD HIS 121 3.900 -4.970 12.442
935 HD2 HIS 121 2HD HIS 121 1.075 -7.443 14.220
936 HE1 HIS 121 1HE HIS 121 3.587 -4.067 14.767
937 HE2 HIS 121 2HE HIS 121 1.937 -5.633 15.852
938 H TYR 122 H TYR 122 3.894 -8.657 9.036
939 HA TYR 122 HA TYR 122 1.821 -10.486 8.453
940 1HB TYR 122 2HB TYR 122 3.183 -8.878 6.888
941 2HB TYR 122 1HB TYR 122 4.254 -10.265 6.721
942 HD1 TYR 122 1HD TYR 122 3.916 -10.991 4.535
943 HD2 TYR 122 2HD TYR 122 0.536 -10.193 6.993
944 HE1 TYR 122 1HE TYR 122 2.442 -11.922 2.802
945 HE2 TYR 122 2HE TYR 122 -0.947 -11.121 5.267
946 HH TYR 122 HH TYR 122 0.267 -12.071 2.107
947 H GLN 123 H GLN 123 5.358 -10.978 8.534
948 HA GLN 123 HA GLN 123 5.065 -13.820 8.429
949 1HB GLN 123 2HB GLN 123 7.220 -11.910 8.204
950 2HB GLN 123 1HB GLN 123 7.676 -13.258 9.235
951 1HG GLN 123 2HG GLN 123 8.327 -13.995 7.158
952 2HG GLN 123 1HG GLN 123 6.730 -14.724 7.324
953 1HE2 GLN 123 1HE2 GLN 123 4.934 -13.128 6.547
954 2HE2 GLN 123 2HE2 GLN 123 5.218 -12.433 4.994
955 H GLU 124 H GLU 124 6.363 -15.164 10.067
956 HA GLU 124 HA GLU 124 6.546 -15.998 12.172
957 1HB GLU 124 2HB GLU 124 7.367 -13.311 12.344
958 2HB GLU 124 1HB GLU 124 6.316 -13.578 13.728
959 1HG GLU 124 2HG GLU 124 7.712 -15.142 14.663
960 2HG GLU 124 1HG GLU 124 8.456 -15.559 13.120
Start of MODEL 15
1 1H MET 1 1HT MET 1 13.518 -17.786 2.171
2 2H MET 1 2HT MET 1 12.449 -16.894 1.168
3 3H MET 1 3HT MET 1 12.356 -18.607 1.219
4 HA MET 1 HA MET 1 11.164 -18.643 3.040
5 1HB MET 1 2HB MET 1 13.180 -16.631 3.862
6 2HB MET 1 1HB MET 1 11.647 -16.576 4.722
7 1HG MET 1 2HG MET 1 12.532 -19.285 4.545
8 2HG MET 1 1HG MET 1 13.838 -18.281 5.169
9 1HE MET 1 1HE MET 1 10.512 -20.089 7.321
10 2HE MET 1 2HE MET 1 12.196 -20.614 7.318
11 3HE MET 1 3HE MET 1 11.318 -20.455 5.796
12 H GLN 2 H GLN 2 11.699 -15.141 2.729
13 HA GLN 2 HA GLN 2 8.869 -14.854 1.976
14 1HB GLN 2 2HB GLN 2 9.418 -14.100 4.317
15 2HB GLN 2 1HB GLN 2 10.450 -12.867 3.605
16 1HG GLN 2 2HG GLN 2 8.706 -11.604 2.912
17 2HG GLN 2 1HG GLN 2 7.660 -12.998 2.641
18 1HE2 GLN 2 1HE2 GLN 2 8.692 -10.589 4.854
19 2HE2 GLN 2 2HE2 GLN 2 7.601 -10.979 6.135
20 H ARG 3 H ARG 3 12.148 -13.845 1.506
21 HA ARG 3 HA ARG 3 13.193 -12.865 -0.256
22 1HB ARG 3 2HB ARG 3 11.661 -14.038 -1.742
23 2HB ARG 3 1HB ARG 3 10.445 -12.795 -1.502
24 1HG ARG 3 2HG ARG 3 11.243 -11.883 -3.366
25 2HG ARG 3 1HG ARG 3 12.592 -11.339 -2.373
26 1HD ARG 3 2HD ARG 3 14.031 -12.759 -3.341
27 2HD ARG 3 1HD ARG 3 12.869 -14.084 -3.330
28 HE ARG 3 HE ARG 3 12.705 -11.938 -5.337
29 1HH1 ARG 3 1HH1 ARG 3 13.005 -15.328 -4.535
30 2HH1 ARG 3 2HH1 ARG 3 12.760 -15.857 -6.163
31 1HH2 ARG 3 1HH2 ARG 3 12.408 -12.642 -7.479
32 2HH2 ARG 3 2HH2 ARG 3 12.431 -14.337 -7.833
33 H GLY 4 H GLY 4 10.511 -11.404 1.313
34 1HA GLY 4 2HA GLY 4 10.033 -9.241 1.862
35 2HA GLY 4 1HA GLY 4 11.758 -8.951 1.682
36 H ILE 5 H ILE 5 8.698 -9.097 -0.054
37 HA ILE 5 HA ILE 5 9.834 -7.277 -2.079
38 HB ILE 5 HB ILE 5 7.415 -9.028 -2.481
39 1HG1 ILE 5 2HG1 ILE 5 9.335 -10.150 -4.048
40 2HG1 ILE 5 1HG1 ILE 5 10.281 -9.690 -2.636
41 1HG2 ILE 5 1HG2 ILE 5 7.218 -8.027 -4.452
42 2HG2 ILE 5 2HG2 ILE 5 8.911 -8.334 -4.838
43 3HG2 ILE 5 3HG2 ILE 5 8.461 -6.887 -3.937
44 1HD1 ILE 5 1HD1 ILE 5 7.722 -11.126 -2.205
45 2HD1 ILE 5 2HD1 ILE 5 9.220 -11.171 -1.275
46 3HD1 ILE 5 3HD1 ILE 5 9.109 -12.031 -2.811
47 H VAL 6 H VAL 6 9.186 -5.252 -1.682
48 HA VAL 6 HA VAL 6 6.460 -4.844 -0.651
49 HB VAL 6 HB VAL 6 8.127 -3.894 0.832
50 1HG1 VAL 6 1HG1 VAL 6 9.174 -1.767 -0.730
51 2HG1 VAL 6 2HG1 VAL 6 9.461 -3.273 -1.588
52 3HG1 VAL 6 3HG1 VAL 6 10.039 -3.080 0.064
53 1HG2 VAL 6 1HG2 VAL 6 5.940 -2.613 -0.103
54 2HG2 VAL 6 2HG2 VAL 6 7.188 -1.412 -0.443
55 3HG2 VAL 6 3HG2 VAL 6 6.956 -2.003 1.204
56 H TRP 7 H TRP 7 5.000 -3.860 -1.880
57 HA TRP 7 HA TRP 7 5.937 -2.521 -4.327
58 1HB TRP 7 2HB TRP 7 3.585 -4.322 -3.832
59 2HB TRP 7 1HB TRP 7 3.555 -3.163 -5.161
60 HD1 TRP 7 HD1 TRP 7 7.001 -4.367 -4.691
61 HE1 TRP 7 1HE TRP 7 7.610 -6.135 -6.442
62 HE3 TRP 7 3HE TRP 7 2.315 -5.375 -6.462
63 HZ2 TRP 7 2HZ TRP 7 6.278 -7.766 -8.321
64 HZ3 TRP 7 3HZ TRP 7 2.073 -7.057 -8.243
65 HH2 TRP 7 HH2 TRP 7 4.016 -8.227 -9.149
66 H VAL 8 H VAL 8 5.137 -0.524 -4.819
67 HA VAL 8 HA VAL 8 3.298 0.672 -2.844
68 HB VAL 8 HB VAL 8 5.150 2.481 -4.276
69 1HG1 VAL 8 1HG1 VAL 8 4.837 3.830 -2.477
70 2HG1 VAL 8 2HG1 VAL 8 4.764 2.486 -1.338
71 3HG1 VAL 8 3HG1 VAL 8 3.369 2.861 -2.350
72 1HG2 VAL 8 1HG2 VAL 8 7.041 1.440 -3.727
73 2HG2 VAL 8 2HG2 VAL 8 6.176 0.218 -2.797
74 3HG2 VAL 8 3HG2 VAL 8 6.638 1.737 -2.038
75 H VAL 9 H VAL 9 1.774 2.169 -3.586
76 HA VAL 9 HA VAL 9 1.598 2.455 -6.505
77 HB VAL 9 HB VAL 9 -1.017 2.415 -5.198
78 1HG1 VAL 9 1HG1 VAL 9 -0.751 0.460 -7.245
79 2HG1 VAL 9 2HG1 VAL 9 0.169 1.882 -7.724
80 3HG1 VAL 9 3HG1 VAL 9 -1.519 2.031 -7.315
81 1HG2 VAL 9 1HG2 VAL 9 -1.061 -0.095 -5.049
82 2HG2 VAL 9 2HG2 VAL 9 -0.137 0.715 -3.786
83 3HG2 VAL 9 3HG2 VAL 9 0.702 -0.058 -5.133
84 H ASP 10 H ASP 10 1.937 4.523 -6.906
85 HA ASP 10 HA ASP 10 0.202 6.543 -5.842
86 1HB ASP 10 2HB ASP 10 2.279 6.072 -4.214
87 2HB ASP 10 1HB ASP 10 3.054 7.196 -5.327
88 H ASP 11 H ASP 11 1.928 8.751 -6.458
89 HA ASP 11 HA ASP 11 1.469 8.951 -9.232
90 1HB ASP 11 2HB ASP 11 1.867 10.753 -7.265
91 2HB ASP 11 1HB ASP 11 3.456 10.783 -8.025
92 H ASP 12 H ASP 12 3.860 7.224 -7.723
93 HA ASP 12 HA ASP 12 5.753 6.212 -8.476
94 1HB ASP 12 2HB ASP 12 4.207 6.288 -10.648
95 2HB ASP 12 1HB ASP 12 5.472 7.374 -11.212
96 H SER 13 H SER 13 7.361 7.468 -10.764
97 HA SER 13 HA SER 13 9.356 8.582 -10.677
98 1HB SER 13 2HB SER 13 8.958 10.858 -11.222
99 2HB SER 13 1HB SER 13 7.570 9.926 -11.790
100 HG SER 13 HG SER 13 6.548 10.557 -9.757
101 H SER 14 H SER 14 8.153 11.192 -8.773
102 HA SER 14 HA SER 14 10.308 11.235 -7.029
103 1HB SER 14 2HB SER 14 7.618 12.495 -7.084
104 2HB SER 14 1HB SER 14 8.474 12.512 -5.540
105 HG SER 14 HG SER 14 9.621 13.375 -7.984
106 H ILE 15 H ILE 15 7.047 9.907 -6.435
107 HA ILE 15 HA ILE 15 7.574 9.034 -3.816
108 HB ILE 15 HB ILE 15 5.619 7.746 -5.713
109 1HG1 ILE 15 2HG1 ILE 15 5.325 10.204 -5.695
110 2HG1 ILE 15 1HG1 ILE 15 3.968 9.374 -4.945
111 1HG2 ILE 15 1HG2 ILE 15 4.415 7.125 -3.730
112 2HG2 ILE 15 2HG2 ILE 15 5.527 8.043 -2.716
113 3HG2 ILE 15 3HG2 ILE 15 6.092 6.602 -3.559
114 1HD1 ILE 15 1HD1 ILE 15 4.889 9.891 -2.737
115 2HD1 ILE 15 2HD1 ILE 15 4.570 11.344 -3.686
116 3HD1 ILE 15 3HD1 ILE 15 6.222 10.751 -3.507
117 H ARG 16 H ARG 16 8.393 7.722 -6.893
118 HA ARG 16 HA ARG 16 8.828 5.032 -6.028
119 1HB ARG 16 2HB ARG 16 8.383 5.660 -8.396
120 2HB ARG 16 1HB ARG 16 9.953 6.448 -8.450
121 1HG ARG 16 2HG ARG 16 11.107 4.423 -8.266
122 2HG ARG 16 1HG ARG 16 9.676 3.556 -7.720
123 1HD ARG 16 2HD ARG 16 8.811 3.377 -9.838
124 2HD ARG 16 1HD ARG 16 9.642 4.821 -10.415
125 HE ARG 16 HE ARG 16 11.384 2.623 -9.735
126 1HH1 ARG 16 1HH1 ARG 16 9.514 4.135 -12.264
127 2HH1 ARG 16 2HH1 ARG 16 10.439 3.424 -13.542
128 1HH2 ARG 16 1HH2 ARG 16 12.606 1.697 -11.415
129 2HH2 ARG 16 2HH2 ARG 16 12.196 2.043 -13.062
130 H TRP 17 H TRP 17 11.037 7.676 -6.921
131 HA TRP 17 HA TRP 17 13.423 6.421 -6.289
132 1HB TRP 17 2HB TRP 17 13.055 8.635 -7.492
133 2HB TRP 17 1HB TRP 17 12.973 9.365 -5.893
134 HD1 TRP 17 HD1 TRP 17 15.449 7.386 -8.101
135 HE1 TRP 17 1HE TRP 17 17.838 8.018 -7.380
136 HE3 TRP 17 3HE TRP 17 14.321 10.352 -4.099
137 HZ2 TRP 17 2HZ TRP 17 19.081 9.569 -5.375
138 HZ3 TRP 17 3HZ TRP 17 16.171 11.370 -2.826
139 HH2 TRP 17 HH2 TRP 17 18.499 10.985 -3.453
140 H VAL 18 H VAL 18 11.329 8.350 -4.169
141 HA VAL 18 HA VAL 18 13.094 8.356 -1.980
142 HB VAL 18 HB VAL 18 10.111 8.507 -1.702
143 1HG1 VAL 18 1HG1 VAL 18 12.047 10.190 -0.194
144 2HG1 VAL 18 2HG1 VAL 18 11.891 8.488 0.239
145 3HG1 VAL 18 3HG1 VAL 18 10.481 9.547 0.302
146 1HG2 VAL 18 1HG2 VAL 18 11.709 10.165 -3.351
147 2HG2 VAL 18 2HG2 VAL 18 11.257 11.105 -1.930
148 3HG2 VAL 18 3HG2 VAL 18 10.009 10.355 -2.925
149 H LEU 19 H LEU 19 10.380 6.252 -2.760
150 HA LEU 19 HA LEU 19 10.804 4.691 -0.397
151 1HB LEU 19 2HB LEU 19 8.675 5.053 -2.245
152 2HB LEU 19 1HB LEU 19 9.039 3.340 -2.150
153 HG LEU 19 HG LEU 19 8.768 3.420 0.296
154 1HD1 LEU 19 1HD1 LEU 19 7.806 6.244 -0.095
155 2HD1 LEU 19 2HD1 LEU 19 9.416 5.828 0.492
156 3HD1 LEU 19 3HD1 LEU 19 7.992 5.364 1.423
157 1HD2 LEU 19 1HD2 LEU 19 6.222 4.364 0.021
158 2HD2 LEU 19 2HD2 LEU 19 6.752 2.736 -0.398
159 3HD2 LEU 19 3HD2 LEU 19 6.650 3.978 -1.646
160 H GLU 20 H GLU 20 11.799 4.462 -3.712
161 HA GLU 20 HA GLU 20 12.247 1.674 -3.737
162 1HB GLU 20 2HB GLU 20 13.491 1.983 -5.739
163 2HB GLU 20 1HB GLU 20 12.137 3.094 -5.782
164 1HG GLU 20 2HG GLU 20 13.646 4.913 -5.135
165 2HG GLU 20 1HG GLU 20 14.994 3.778 -5.153
166 H ARG 21 H ARG 21 14.601 4.309 -3.404
167 HA ARG 21 HA ARG 21 16.764 2.638 -2.732
168 1HB ARG 21 2HB ARG 21 16.298 5.582 -2.291
169 2HB ARG 21 1HB ARG 21 17.821 4.784 -1.929
170 1HG ARG 21 2HG ARG 21 16.916 4.178 -4.608
171 2HG ARG 21 1HG ARG 21 17.058 5.916 -4.341
172 1HD ARG 21 2HD ARG 21 19.304 5.836 -4.134
173 2HD ARG 21 1HD ARG 21 19.283 4.274 -3.321
174 HE ARG 21 HE ARG 21 18.800 3.358 -5.637
175 1HH1 ARG 21 1HH1 ARG 21 20.697 6.254 -5.113
176 2HH1 ARG 21 2HH1 ARG 21 21.589 6.075 -6.583
177 1HH2 ARG 21 1HH2 ARG 21 19.978 3.139 -7.568
178 2HH2 ARG 21 2HH2 ARG 21 21.183 4.315 -7.974
179 H ALA 22 H ALA 22 14.717 4.691 -0.654
180 HA ALA 22 HA ALA 22 15.947 4.100 1.757
181 1HB ALA 22 1HB ALA 22 13.019 4.675 1.364
182 2HB ALA 22 2HB ALA 22 14.286 5.899 1.423
183 3HB ALA 22 3HB ALA 22 13.952 4.908 2.843
184 H LEU 23 H LEU 23 13.275 2.421 0.201
185 HA LEU 23 HA LEU 23 13.064 0.515 2.322
186 1HB LEU 23 2HB LEU 23 11.435 1.253 0.227
187 2HB LEU 23 1HB LEU 23 11.962 -0.360 -0.223
188 HG LEU 23 HG LEU 23 10.807 0.268 2.480
189 1HD1 LEU 23 1HD1 LEU 23 8.856 -1.096 1.133
190 2HD1 LEU 23 2HD1 LEU 23 9.447 0.038 -0.083
191 3HD1 LEU 23 3HD1 LEU 23 8.860 0.635 1.469
192 1HD2 LEU 23 1HD2 LEU 23 11.491 -2.219 0.964
193 2HD2 LEU 23 2HD2 LEU 23 10.268 -2.243 2.234
194 3HD2 LEU 23 3HD2 LEU 23 11.923 -1.755 2.611
195 H ALA 24 H ALA 24 14.943 0.800 -0.548
196 HA ALA 24 HA ALA 24 15.628 -1.947 -0.807
197 1HB ALA 24 1HB ALA 24 15.926 -0.228 -2.618
198 2HB ALA 24 2HB ALA 24 17.344 -1.231 -2.318
199 3HB ALA 24 3HB ALA 24 17.282 0.418 -1.695
200 H GLY 25 H GLY 25 16.806 0.803 1.027
201 1HA GLY 25 2HA GLY 25 19.220 -0.366 1.946
202 2HA GLY 25 1HA GLY 25 18.346 0.948 2.728
203 H ALA 26 H ALA 26 15.895 -0.812 2.768
204 HA ALA 26 HA ALA 26 16.364 -1.962 5.343
205 1HB ALA 26 1HB ALA 26 14.258 -0.889 4.988
206 2HB ALA 26 2HB ALA 26 13.954 -2.614 5.186
207 3HB ALA 26 3HB ALA 26 13.919 -1.893 3.575
208 H GLY 27 H GLY 27 16.616 -3.034 2.129
209 1HA GLY 27 2HA GLY 27 17.636 -5.089 1.578
210 2HA GLY 27 1HA GLY 27 17.043 -5.763 3.085
211 H LEU 28 H LEU 28 14.836 -4.002 0.990
212 HA LEU 28 HA LEU 28 13.821 -6.554 0.019
213 1HB LEU 28 2HB LEU 28 11.794 -4.524 0.716
214 2HB LEU 28 1HB LEU 28 11.697 -6.272 0.768
215 HG LEU 28 HG LEU 28 13.467 -5.868 2.733
216 1HD1 LEU 28 1HD1 LEU 28 13.228 -3.948 3.912
217 2HD1 LEU 28 2HD1 LEU 28 11.630 -3.610 3.249
218 3HD1 LEU 28 3HD1 LEU 28 13.066 -3.349 2.261
219 1HD2 LEU 28 1HD2 LEU 28 11.841 -6.678 4.079
220 2HD2 LEU 28 2HD2 LEU 28 11.002 -6.890 2.542
221 3HD2 LEU 28 3HD2 LEU 28 10.657 -5.483 3.549
222 H THR 29 H THR 29 12.195 -6.344 -1.724
223 HA THR 29 HA THR 29 13.219 -4.504 -3.727
224 HB THR 29 HB THR 29 11.297 -6.831 -3.843
225 HG1 THR 29 1HG THR 29 13.061 -7.879 -4.177
226 1HG2 THR 29 1HG2 THR 29 10.464 -5.822 -5.671
227 2HG2 THR 29 2HG2 THR 29 11.922 -6.480 -6.412
228 3HG2 THR 29 3HG2 THR 29 11.880 -4.794 -5.890
229 H CYS 30 H CYS 30 12.394 -2.523 -3.741
230 HA CYS 30 HA CYS 30 9.526 -2.173 -3.219
231 1HB CYS 30 2HB CYS 30 10.935 -0.920 -1.716
232 2HB CYS 30 1HB CYS 30 11.806 -0.205 -3.066
233 HG CYS 30 HG CYS 30 8.800 0.460 -2.845
234 H THR 31 H THR 31 8.334 -2.088 -4.965
235 HA THR 31 HA THR 31 9.329 -0.544 -7.265
236 HB THR 31 HB THR 31 8.939 -3.116 -7.562
237 HG1 THR 31 1HG THR 31 7.573 -1.350 -9.314
238 1HG2 THR 31 1HG2 THR 31 6.918 -3.977 -7.419
239 2HG2 THR 31 2HG2 THR 31 6.229 -2.697 -8.409
240 3HG2 THR 31 3HG2 THR 31 6.383 -2.477 -6.665
241 H THR 32 H THR 32 7.657 0.707 -8.380
242 HA THR 32 HA THR 32 5.347 1.250 -6.657
243 HB THR 32 HB THR 32 5.544 3.609 -7.111
244 HG1 THR 32 1HG THR 32 6.981 4.427 -8.492
245 1HG2 THR 32 1HG2 THR 32 8.352 3.206 -6.503
246 2HG2 THR 32 2HG2 THR 32 7.281 2.191 -5.540
247 3HG2 THR 32 3HG2 THR 32 7.075 3.945 -5.539
248 H PHE 33 H PHE 33 3.561 2.395 -7.756
249 HA PHE 33 HA PHE 33 3.326 1.591 -10.571
250 1HB PHE 33 2HB PHE 33 1.260 1.216 -8.412
251 2HB PHE 33 1HB PHE 33 1.013 0.879 -10.115
252 HD1 PHE 33 1HD PHE 33 1.151 -1.315 -10.718
253 HD2 PHE 33 2HD PHE 33 3.492 0.029 -7.454
254 HE1 PHE 33 1HE PHE 33 2.017 -3.580 -10.419
255 HE2 PHE 33 2HE PHE 33 4.389 -2.238 -7.146
256 HZ PHE 33 HZ PHE 33 3.634 -4.064 -8.639
257 H GLU 34 H GLU 34 1.267 2.588 -11.560
258 HA GLU 34 HA GLU 34 1.592 5.365 -11.577
259 1HB GLU 34 2HB GLU 34 -0.418 5.371 -13.034
260 2HB GLU 34 1HB GLU 34 0.803 4.201 -13.516
261 1HG GLU 34 2HG GLU 34 -1.063 2.921 -13.711
262 2HG GLU 34 1HG GLU 34 -0.622 2.578 -12.041
263 H ASN 35 H ASN 35 -1.040 3.425 -10.082
264 HA ASN 35 HA ASN 35 -1.491 5.548 -8.229
265 1HB ASN 35 2HB ASN 35 -2.718 6.283 -10.293
266 2HB ASN 35 1HB ASN 35 -3.777 4.893 -10.059
267 1HD2 ASN 35 1HD2 ASN 35 -4.909 4.758 -7.994
268 2HD2 ASN 35 2HD2 ASN 35 -5.403 6.219 -7.218
269 H GLY 36 H GLY 36 -3.260 2.800 -9.585
270 1HA GLY 36 2HA GLY 36 -3.116 1.379 -7.084
271 2HA GLY 36 1HA GLY 36 -4.706 2.053 -7.388
272 H ASN 37 H ASN 37 -4.899 1.656 -10.141
273 HA ASN 37 HA ASN 37 -5.704 -1.043 -10.195
274 1HB ASN 37 2HB ASN 37 -5.598 1.149 -12.223
275 2HB ASN 37 1HB ASN 37 -5.951 -0.498 -12.740
276 1HD2 ASN 37 1HD2 ASN 37 -7.620 -1.585 -11.193
277 2HD2 ASN 37 2HD2 ASN 37 -9.028 -0.642 -10.863
278 H GLU 38 H GLU 38 -2.753 0.526 -11.134
279 HA GLU 38 HA GLU 38 -1.796 -1.363 -12.957
280 1HB GLU 38 2HB GLU 38 -0.824 0.919 -12.306
281 2HB GLU 38 1HB GLU 38 -0.001 0.055 -11.024
282 1HG GLU 38 2HG GLU 38 1.315 -1.155 -12.518
283 2HG GLU 38 1HG GLU 38 0.229 -0.838 -13.869
284 H VAL 39 H VAL 39 -1.282 -1.252 -9.379
285 HA VAL 39 HA VAL 39 0.242 -3.622 -9.312
286 HB VAL 39 HB VAL 39 -1.578 -2.768 -7.075
287 1HG1 VAL 39 1HG1 VAL 39 -0.322 -4.961 -7.039
288 2HG1 VAL 39 2HG1 VAL 39 -0.062 -3.891 -5.667
289 3HG1 VAL 39 3HG1 VAL 39 1.151 -4.006 -6.939
290 1HG2 VAL 39 1HG2 VAL 39 0.102 -1.018 -8.214
291 2HG2 VAL 39 2HG2 VAL 39 1.216 -1.824 -7.112
292 3HG2 VAL 39 3HG2 VAL 39 -0.239 -1.059 -6.491
293 H LEU 40 H LEU 40 -3.222 -3.105 -9.283
294 HA LEU 40 HA LEU 40 -4.071 -5.641 -8.512
295 1HB LEU 40 2HB LEU 40 -5.418 -3.940 -10.594
296 2HB LEU 40 1HB LEU 40 -6.169 -5.109 -9.521
297 HG LEU 40 HG LEU 40 -4.941 -2.482 -8.689
298 1HD1 LEU 40 1HD1 LEU 40 -6.919 -1.736 -9.448
299 2HD1 LEU 40 2HD1 LEU 40 -7.516 -2.381 -7.932
300 3HD1 LEU 40 3HD1 LEU 40 -7.660 -3.332 -9.409
301 1HD2 LEU 40 1HD2 LEU 40 -4.637 -3.633 -6.768
302 2HD2 LEU 40 2HD2 LEU 40 -5.846 -4.850 -7.179
303 3HD2 LEU 40 3HD2 LEU 40 -6.354 -3.278 -6.561
304 H ALA 41 H ALA 41 -3.143 -4.406 -11.669
305 HA ALA 41 HA ALA 41 -3.721 -6.850 -13.049
306 1HB ALA 41 1HB ALA 41 -2.004 -4.591 -14.030
307 2HB ALA 41 2HB ALA 41 -3.767 -4.557 -14.082
308 3HB ALA 41 3HB ALA 41 -2.882 -5.781 -14.993
309 H ALA 42 H ALA 42 -0.799 -5.185 -12.027
310 HA ALA 42 HA ALA 42 1.065 -7.046 -12.998
311 1HB ALA 42 1HB ALA 42 2.633 -5.718 -12.064
312 2HB ALA 42 2HB ALA 42 1.798 -5.632 -10.512
313 3HB ALA 42 3HB ALA 42 1.276 -4.612 -11.855
314 H LEU 43 H LEU 43 -0.710 -6.862 -9.976
315 HA LEU 43 HA LEU 43 0.703 -8.839 -8.573
316 1HB LEU 43 2HB LEU 43 -2.009 -7.629 -8.343
317 2HB LEU 43 1HB LEU 43 -1.653 -9.080 -7.422
318 HG LEU 43 HG LEU 43 0.025 -6.594 -7.270
319 1HD1 LEU 43 1HD1 LEU 43 -2.220 -7.477 -5.459
320 2HD1 LEU 43 2HD1 LEU 43 -2.251 -6.082 -6.537
321 3HD1 LEU 43 3HD1 LEU 43 -1.138 -6.117 -5.168
322 1HD2 LEU 43 1HD2 LEU 43 0.352 -7.901 -4.956
323 2HD2 LEU 43 2HD2 LEU 43 1.363 -8.170 -6.374
324 3HD2 LEU 43 3HD2 LEU 43 0.022 -9.264 -6.026
325 H ALA 44 H ALA 44 -1.589 -9.028 -11.115
326 HA ALA 44 HA ALA 44 -2.735 -11.523 -10.728
327 1HB ALA 44 1HB ALA 44 -2.004 -10.760 -13.494
328 2HB ALA 44 2HB ALA 44 -3.021 -9.645 -12.585
329 3HB ALA 44 3HB ALA 44 -3.547 -11.308 -12.839
330 H SER 45 H SER 45 0.523 -10.752 -11.490
331 HA SER 45 HA SER 45 1.056 -13.574 -12.021
332 1HB SER 45 2HB SER 45 1.756 -11.263 -13.600
333 2HB SER 45 1HB SER 45 3.203 -12.137 -13.101
334 HG SER 45 HG SER 45 2.053 -14.065 -13.886
335 H LYS 46 H LYS 46 1.387 -11.303 -9.716
336 HA LYS 46 HA LYS 46 3.476 -12.736 -8.401
337 1HB LYS 46 2HB LYS 46 4.311 -10.636 -10.018
338 2HB LYS 46 1HB LYS 46 4.272 -9.946 -8.403
339 1HG LYS 46 2HG LYS 46 5.500 -12.499 -8.242
340 2HG LYS 46 1HG LYS 46 6.248 -11.597 -9.564
341 1HD LYS 46 2HD LYS 46 7.246 -10.156 -8.164
342 2HD LYS 46 1HD LYS 46 5.800 -9.993 -7.164
343 1HE LYS 46 2HE LYS 46 6.426 -12.386 -6.350
344 2HE LYS 46 1HE LYS 46 8.025 -11.980 -6.971
345 1HZ LYS 46 1HZ LYS 46 6.507 -10.493 -4.897
346 2HZ LYS 46 2HZ LYS 46 7.987 -9.992 -5.545
347 3HZ LYS 46 3HZ LYS 46 7.897 -11.428 -4.655
348 H THR 47 H THR 47 3.742 -12.086 -6.173
349 HA THR 47 HA THR 47 1.767 -10.199 -5.178
350 HB THR 47 HB THR 47 2.072 -13.039 -4.201
351 HG1 THR 47 1HG THR 47 -0.057 -13.234 -4.894
352 1HG2 THR 47 1HG2 THR 47 0.032 -11.113 -3.172
353 2HG2 THR 47 2HG2 THR 47 1.616 -11.265 -2.405
354 3HG2 THR 47 3HG2 THR 47 0.541 -12.662 -2.501
355 HA PRO 48 HA PRO 48 5.511 -9.330 -2.802
356 1HB PRO 48 2HB PRO 48 4.849 -6.848 -2.005
357 2HB PRO 48 1HB PRO 48 5.386 -7.181 -3.656
358 1HG PRO 48 2HG PRO 48 2.629 -6.734 -2.610
359 2HG PRO 48 1HG PRO 48 3.353 -6.202 -4.136
360 1HD PRO 48 2HD PRO 48 1.691 -8.387 -3.852
361 2HD PRO 48 1HD PRO 48 2.827 -8.145 -5.189
362 H ASP 49 H ASP 49 5.955 -8.917 -0.519
363 HA ASP 49 HA ASP 49 4.051 -10.218 1.165
364 1HB ASP 49 2HB ASP 49 6.601 -8.780 1.941
365 2HB ASP 49 1HB ASP 49 5.703 -9.920 2.940
366 H VAL 50 H VAL 50 4.724 -6.923 0.367
367 HA VAL 50 HA VAL 50 2.613 -6.053 2.192
368 HB VAL 50 HB VAL 50 4.681 -5.679 3.435
369 1HG1 VAL 50 1HG1 VAL 50 5.877 -5.327 1.060
370 2HG1 VAL 50 2HG1 VAL 50 6.567 -4.791 2.588
371 3HG1 VAL 50 3HG1 VAL 50 5.700 -3.651 1.567
372 1HG2 VAL 50 1HG2 VAL 50 2.709 -3.895 3.158
373 2HG2 VAL 50 2HG2 VAL 50 4.057 -2.916 2.583
374 3HG2 VAL 50 3HG2 VAL 50 4.106 -3.625 4.196
375 H LEU 51 H LEU 51 1.819 -3.840 1.617
376 HA LEU 51 HA LEU 51 2.600 -2.844 -0.987
377 1HB LEU 51 2HB LEU 51 0.965 -4.689 -1.390
378 2HB LEU 51 1HB LEU 51 -0.234 -3.759 -0.519
379 HG LEU 51 HG LEU 51 0.093 -1.934 -2.241
380 1HD1 LEU 51 1HD1 LEU 51 1.383 -2.228 -4.091
381 2HD1 LEU 51 2HD1 LEU 51 1.212 -3.987 -4.070
382 3HD1 LEU 51 3HD1 LEU 51 2.318 -3.192 -2.949
383 1HD2 LEU 51 1HD2 LEU 51 -1.094 -4.617 -2.746
384 2HD2 LEU 51 2HD2 LEU 51 -1.052 -3.451 -4.069
385 3HD2 LEU 51 3HD2 LEU 51 -1.881 -3.048 -2.565
386 H LEU 52 H LEU 52 2.350 -0.721 -1.165
387 HA LEU 52 HA LEU 52 0.827 0.693 0.925
388 1HB LEU 52 2HB LEU 52 3.488 0.898 0.285
389 2HB LEU 52 1HB LEU 52 2.792 2.215 -0.634
390 HG LEU 52 HG LEU 52 2.549 1.832 2.346
391 1HD1 LEU 52 1HD1 LEU 52 4.208 3.380 2.624
392 2HD1 LEU 52 2HD1 LEU 52 3.922 4.133 1.055
393 3HD1 LEU 52 3HD1 LEU 52 4.769 2.589 1.149
394 1HD2 LEU 52 1HD2 LEU 52 1.113 3.508 0.432
395 2HD2 LEU 52 2HD2 LEU 52 1.842 4.414 1.759
396 3HD2 LEU 52 3HD2 LEU 52 0.720 3.099 2.103
397 H SER 53 H SER 53 -1.045 1.511 0.182
398 HA SER 53 HA SER 53 -1.197 2.316 -2.647
399 1HB SER 53 2HB SER 53 -3.133 1.062 -0.771
400 2HB SER 53 1HB SER 53 -3.777 2.167 -1.980
401 HG SER 53 HG SER 53 -2.482 0.841 -3.511
402 H ASP 54 H ASP 54 -1.863 4.321 -3.228
403 HA ASP 54 HA ASP 54 -1.917 6.364 -1.176
404 1HB ASP 54 2HB ASP 54 -2.110 7.924 -3.125
405 2HB ASP 54 1HB ASP 54 -0.699 6.872 -3.187
406 H ILE 55 H ILE 55 -3.617 8.227 -1.758
407 HA ILE 55 HA ILE 55 -6.229 7.196 -2.440
408 HB ILE 55 HB ILE 55 -6.180 6.544 -0.154
409 1HG1 ILE 55 2HG1 ILE 55 -7.681 8.991 0.401
410 2HG1 ILE 55 1HG1 ILE 55 -8.068 8.283 -1.161
411 1HG2 ILE 55 1HG2 ILE 55 -5.170 9.310 0.417
412 2HG2 ILE 55 2HG2 ILE 55 -4.364 7.770 0.711
413 3HG2 ILE 55 3HG2 ILE 55 -5.781 8.221 1.660
414 1HD1 ILE 55 1HD1 ILE 55 -9.332 6.750 -0.188
415 2HD1 ILE 55 2HD1 ILE 55 -9.015 7.517 1.369
416 3HD1 ILE 55 3HD1 ILE 55 -7.971 6.215 0.799
417 H ARG 56 H ARG 56 -6.431 8.734 -4.036
418 HA ARG 56 HA ARG 56 -6.766 11.488 -3.099
419 1HB ARG 56 2HB ARG 56 -4.488 11.207 -4.110
420 2HB ARG 56 1HB ARG 56 -5.270 10.810 -5.633
421 1HG ARG 56 2HG ARG 56 -5.519 12.954 -6.131
422 2HG ARG 56 1HG ARG 56 -6.333 13.266 -4.598
423 1HD ARG 56 2HD ARG 56 -4.426 14.667 -4.634
424 2HD ARG 56 1HD ARG 56 -4.045 13.342 -3.536
425 HE ARG 56 HE ARG 56 -3.063 12.498 -5.918
426 1HH1 ARG 56 1HH1 ARG 56 -2.635 15.399 -4.028
427 2HH1 ARG 56 2HH1 ARG 56 -1.027 15.687 -4.602
428 1HH2 ARG 56 1HH2 ARG 56 -0.943 12.866 -6.666
429 2HH2 ARG 56 2HH2 ARG 56 -0.065 14.248 -6.101
430 H MET 57 H MET 57 -8.797 9.631 -3.619
431 HA MET 57 HA MET 57 -10.829 9.540 -4.618
432 1HB MET 57 2HB MET 57 -10.438 12.114 -4.528
433 2HB MET 57 1HB MET 57 -10.221 11.961 -6.268
434 1HG MET 57 2HG MET 57 -12.423 12.191 -6.423
435 2HG MET 57 1HG MET 57 -12.528 10.543 -5.807
436 1HE MET 57 1HE MET 57 -14.901 13.665 -4.113
437 2HE MET 57 2HE MET 57 -14.858 12.710 -5.597
438 3HE MET 57 3HE MET 57 -13.740 14.056 -5.381
439 HA PRO 58 HA PRO 58 -8.694 8.103 -8.618
440 1HB PRO 58 2HB PRO 58 -8.453 5.461 -7.983
441 2HB PRO 58 1HB PRO 58 -7.173 6.648 -7.721
442 1HG PRO 58 2HG PRO 58 -9.109 5.487 -5.769
443 2HG PRO 58 1HG PRO 58 -7.399 5.897 -5.550
444 1HD PRO 58 2HD PRO 58 -9.460 7.444 -4.661
445 2HD PRO 58 1HD PRO 58 -7.866 8.087 -5.085
446 H GLY 59 H GLY 59 -10.422 5.465 -6.990
447 1HA GLY 59 2HA GLY 59 -12.521 5.676 -9.052
448 2HA GLY 59 1HA GLY 59 -12.008 4.166 -8.310
449 H MET 60 H MET 60 -11.853 5.546 -5.658
450 HA MET 60 HA MET 60 -14.526 6.360 -5.025
451 1HB MET 60 2HB MET 60 -14.220 3.658 -5.091
452 2HB MET 60 1HB MET 60 -13.789 3.992 -3.420
453 1HG MET 60 2HG MET 60 -16.023 3.665 -3.194
454 2HG MET 60 1HG MET 60 -16.004 5.405 -3.480
455 1HE MET 60 1HE MET 60 -18.175 5.519 -3.835
456 2HE MET 60 2HE MET 60 -19.181 4.415 -4.771
457 3HE MET 60 3HE MET 60 -18.563 5.889 -5.514
458 H ASP 61 H ASP 61 -12.842 8.037 -4.586
459 HA ASP 61 HA ASP 61 -11.888 9.422 -3.067
460 1HB ASP 61 2HB ASP 61 -13.578 7.786 -1.515
461 2HB ASP 61 1HB ASP 61 -12.053 7.907 -0.641
462 H GLY 62 H GLY 62 -11.017 6.054 -3.041
463 1HA GLY 62 2HA GLY 62 -8.476 5.988 -3.572
464 2HA GLY 62 1HA GLY 62 -8.371 6.643 -1.949
465 H LEU 63 H LEU 63 -10.733 5.156 -1.088
466 HA LEU 63 HA LEU 63 -9.410 2.806 -0.217
467 1HB LEU 63 2HB LEU 63 -12.370 3.241 -0.025
468 2HB LEU 63 1HB LEU 63 -11.327 2.352 1.067
469 HG LEU 63 HG LEU 63 -10.262 4.790 1.372
470 1HD1 LEU 63 1HD1 LEU 63 -12.609 6.130 1.614
471 2HD1 LEU 63 2HD1 LEU 63 -12.875 5.225 0.125
472 3HD1 LEU 63 3HD1 LEU 63 -11.485 6.301 0.268
473 1HD2 LEU 63 1HD2 LEU 63 -11.270 4.843 3.452
474 2HD2 LEU 63 2HD2 LEU 63 -11.357 3.136 3.019
475 3HD2 LEU 63 3HD2 LEU 63 -12.779 4.159 2.852
476 H ALA 64 H ALA 64 -11.266 3.636 -2.969
477 HA ALA 64 HA ALA 64 -12.505 1.254 -3.677
478 1HB ALA 64 1HB ALA 64 -12.934 2.333 -5.589
479 2HB ALA 64 2HB ALA 64 -11.222 2.548 -5.946
480 3HB ALA 64 3HB ALA 64 -12.051 3.692 -4.894
481 H LEU 65 H LEU 65 -9.133 2.171 -3.817
482 HA LEU 65 HA LEU 65 -8.130 0.193 -5.512
483 1HB LEU 65 2HB LEU 65 -7.049 2.251 -4.133
484 2HB LEU 65 1HB LEU 65 -6.503 0.908 -3.148
485 HG LEU 65 HG LEU 65 -6.005 1.117 -6.115
486 1HD1 LEU 65 1HD1 LEU 65 -4.690 2.837 -5.393
487 2HD1 LEU 65 2HD1 LEU 65 -3.591 1.487 -5.110
488 3HD1 LEU 65 3HD1 LEU 65 -4.514 2.169 -3.771
489 1HD2 LEU 65 1HD2 LEU 65 -4.092 -0.498 -5.076
490 2HD2 LEU 65 2HD2 LEU 65 -5.599 -1.071 -5.790
491 3HD2 LEU 65 3HD2 LEU 65 -5.465 -0.893 -4.041
492 H LEU 66 H LEU 66 -8.632 0.183 -2.009
493 HA LEU 66 HA LEU 66 -7.602 -2.342 -1.436
494 1HB LEU 66 2HB LEU 66 -9.872 -0.877 -0.089
495 2HB LEU 66 1HB LEU 66 -9.007 -2.244 0.589
496 HG LEU 66 HG LEU 66 -7.406 0.134 -0.206
497 1HD1 LEU 66 1HD1 LEU 66 -7.836 1.121 2.053
498 2HD1 LEU 66 2HD1 LEU 66 -9.216 0.035 2.195
499 3HD1 LEU 66 3HD1 LEU 66 -9.180 1.249 0.921
500 1HD2 LEU 66 1HD2 LEU 66 -6.935 -1.044 2.390
501 2HD2 LEU 66 2HD2 LEU 66 -5.850 -0.889 1.007
502 3HD2 LEU 66 3HD2 LEU 66 -6.944 -2.266 1.118
503 H LYS 67 H LYS 67 -10.890 -1.379 -2.348
504 HA LYS 67 HA LYS 67 -12.196 -3.798 -2.056
505 1HB LYS 67 2HB LYS 67 -13.192 -1.553 -2.700
506 2HB LYS 67 1HB LYS 67 -12.701 -1.908 -4.351
507 1HG LYS 67 2HG LYS 67 -14.035 -4.162 -3.804
508 2HG LYS 67 1HG LYS 67 -14.890 -3.050 -2.733
509 1HD LYS 67 2HD LYS 67 -14.440 -2.617 -5.686
510 2HD LYS 67 1HD LYS 67 -15.932 -3.222 -4.965
511 1HE LYS 67 2HE LYS 67 -16.105 -1.132 -3.661
512 2HE LYS 67 1HE LYS 67 -14.664 -0.529 -4.481
513 1HZ LYS 67 1HZ LYS 67 -16.141 -1.190 -6.569
514 2HZ LYS 67 2HZ LYS 67 -16.212 0.340 -5.850
515 3HZ LYS 67 3HZ LYS 67 -17.382 -0.825 -5.478
516 H GLN 68 H GLN 68 -10.591 -2.589 -5.010
517 HA GLN 68 HA GLN 68 -11.020 -4.855 -6.597
518 1HB GLN 68 2HB GLN 68 -8.667 -2.971 -6.705
519 2HB GLN 68 1HB GLN 68 -9.215 -4.021 -8.003
520 1HG GLN 68 2HG GLN 68 -10.760 -1.721 -6.832
521 2HG GLN 68 1HG GLN 68 -9.880 -1.707 -8.363
522 1HE2 GLN 68 1HE2 GLN 68 -12.841 -2.111 -6.963
523 2HE2 GLN 68 2HE2 GLN 68 -13.643 -2.958 -8.238
524 H ILE 69 H ILE 69 -8.520 -4.128 -4.257
525 HA ILE 69 HA ILE 69 -6.706 -6.137 -4.934
526 HB ILE 69 HB ILE 69 -7.236 -4.748 -2.318
527 1HG1 ILE 69 2HG1 ILE 69 -4.909 -4.446 -4.216
528 2HG1 ILE 69 1HG1 ILE 69 -6.378 -3.488 -4.360
529 1HG2 ILE 69 1HG2 ILE 69 -5.656 -7.100 -2.756
530 2HG2 ILE 69 2HG2 ILE 69 -5.931 -6.204 -1.264
531 3HG2 ILE 69 3HG2 ILE 69 -4.605 -5.748 -2.330
532 1HD1 ILE 69 1HD1 ILE 69 -4.791 -3.577 -1.831
533 2HD1 ILE 69 2HD1 ILE 69 -5.984 -2.387 -2.337
534 3HD1 ILE 69 3HD1 ILE 69 -4.412 -2.456 -3.132
535 H LYS 70 H LYS 70 -9.602 -6.253 -2.989
536 HA LYS 70 HA LYS 70 -9.067 -8.861 -1.952
537 1HB LYS 70 2HB LYS 70 -11.221 -8.751 -0.922
538 2HB LYS 70 1HB LYS 70 -10.472 -7.169 -0.774
539 1HG LYS 70 2HG LYS 70 -12.077 -6.166 -1.938
540 2HG LYS 70 1HG LYS 70 -12.125 -7.438 -3.157
541 1HD LYS 70 2HD LYS 70 -13.201 -8.659 -0.931
542 2HD LYS 70 1HD LYS 70 -13.822 -7.010 -0.826
543 1HE LYS 70 2HE LYS 70 -15.405 -8.225 -2.092
544 2HE LYS 70 1HE LYS 70 -14.500 -7.246 -3.248
545 1HZ LYS 70 1HZ LYS 70 -14.550 -9.302 -4.253
546 2HZ LYS 70 2HZ LYS 70 -14.393 -10.154 -2.800
547 3HZ LYS 70 3HZ LYS 70 -13.055 -9.356 -3.461
548 H GLN 71 H GLN 71 -10.695 -7.563 -4.708
549 HA GLN 71 HA GLN 71 -12.263 -9.789 -5.388
550 1HB GLN 71 2HB GLN 71 -11.348 -7.331 -6.746
551 2HB GLN 71 1HB GLN 71 -11.868 -8.648 -7.788
552 1HG GLN 71 2HG GLN 71 -14.037 -8.469 -7.168
553 2HG GLN 71 1HG GLN 71 -13.643 -7.944 -5.531
554 1HE2 GLN 71 1HE2 GLN 71 -12.656 -5.725 -5.402
555 2HE2 GLN 71 2HE2 GLN 71 -13.335 -4.506 -6.421
556 H ARG 72 H ARG 72 -9.085 -8.796 -6.516
557 HA ARG 72 HA ARG 72 -8.783 -11.291 -7.977
558 1HB ARG 72 2HB ARG 72 -7.200 -8.747 -7.877
559 2HB ARG 72 1HB ARG 72 -6.546 -10.197 -8.627
560 1HG ARG 72 2HG ARG 72 -8.626 -10.235 -10.064
561 2HG ARG 72 1HG ARG 72 -8.966 -8.618 -9.446
562 1HD ARG 72 2HD ARG 72 -7.679 -7.830 -11.081
563 2HD ARG 72 1HD ARG 72 -6.300 -8.520 -10.227
564 HE ARG 72 HE ARG 72 -6.164 -10.144 -11.837
565 1HH1 ARG 72 1HH1 ARG 72 -9.272 -8.577 -12.069
566 2HH1 ARG 72 2HH1 ARG 72 -9.714 -9.388 -13.533
567 1HH2 ARG 72 1HH2 ARG 72 -6.750 -11.219 -13.771
568 2HH2 ARG 72 2HH2 ARG 72 -8.285 -10.883 -14.498
569 H HIS 73 H HIS 73 -6.888 -9.465 -5.626
570 HA HIS 73 HA HIS 73 -5.265 -11.780 -5.027
571 1HB HIS 73 2HB HIS 73 -5.097 -9.328 -3.351
572 2HB HIS 73 1HB HIS 73 -3.809 -10.335 -4.013
573 HD1 HIS 73 1HD HIS 73 -4.144 -10.178 -6.935
574 HD2 HIS 73 2HD HIS 73 -4.861 -6.900 -4.499
575 HE1 HIS 73 1HE HIS 73 -3.952 -8.172 -8.438
576 HE2 HIS 73 2HE HIS 73 -4.325 -6.193 -6.921
577 HA PRO 74 HA PRO 74 -7.496 -13.303 -1.568
578 1HB PRO 74 2HB PRO 74 -5.463 -14.243 -0.004
579 2HB PRO 74 1HB PRO 74 -6.058 -15.066 -1.449
580 1HG PRO 74 2HG PRO 74 -3.624 -13.392 -1.086
581 2HG PRO 74 1HG PRO 74 -3.864 -14.828 -2.091
582 1HD PRO 74 2HD PRO 74 -3.838 -12.264 -3.056
583 2HD PRO 74 1HD PRO 74 -4.680 -13.612 -3.843
584 H MET 75 H MET 75 -4.533 -12.246 0.089
585 HA MET 75 HA MET 75 -6.073 -10.196 1.477
586 1HB MET 75 2HB MET 75 -4.501 -12.377 2.839
587 2HB MET 75 1HB MET 75 -5.088 -10.934 3.653
588 1HG MET 75 2HG MET 75 -7.240 -11.635 3.656
589 2HG MET 75 1HG MET 75 -7.069 -12.532 2.149
590 1HE MET 75 1HE MET 75 -4.252 -14.410 3.281
591 2HE MET 75 2HE MET 75 -5.437 -14.506 1.977
592 3HE MET 75 3HE MET 75 -5.353 -15.785 3.190
593 H LEU 76 H LEU 76 -4.445 -9.453 -0.398
594 HA LEU 76 HA LEU 76 -1.731 -9.121 0.245
595 1HB LEU 76 2HB LEU 76 -3.083 -8.741 -1.970
596 2HB LEU 76 1HB LEU 76 -3.225 -7.098 -1.368
597 HG LEU 76 HG LEU 76 -1.391 -7.084 -2.827
598 1HD1 LEU 76 1HD1 LEU 76 0.382 -6.378 -1.483
599 2HD1 LEU 76 2HD1 LEU 76 -0.035 -7.493 -0.185
600 3HD1 LEU 76 3HD1 LEU 76 -1.056 -6.090 -0.504
601 1HD2 LEU 76 1HD2 LEU 76 0.181 -9.197 -1.549
602 2HD2 LEU 76 2HD2 LEU 76 -0.066 -8.832 -3.258
603 3HD2 LEU 76 3HD2 LEU 76 -1.282 -9.749 -2.367
604 HA PRO 77 HA PRO 77 -2.398 -6.174 3.638
605 1HB PRO 77 2HB PRO 77 0.304 -5.629 3.922
606 2HB PRO 77 1HB PRO 77 -0.551 -6.940 4.739
607 1HG PRO 77 2HG PRO 77 1.111 -7.020 2.257
608 2HG PRO 77 1HG PRO 77 1.035 -8.185 3.592
609 1HD PRO 77 2HD PRO 77 -0.197 -8.661 1.272
610 2HD PRO 77 1HD PRO 77 -0.941 -9.128 2.816
611 H VAL 78 H VAL 78 -3.030 -4.151 3.197
612 HA VAL 78 HA VAL 78 -1.475 -2.582 1.245
613 HB VAL 78 HB VAL 78 -4.391 -2.116 1.809
614 1HG1 VAL 78 1HG1 VAL 78 -3.810 -0.298 0.618
615 2HG1 VAL 78 2HG1 VAL 78 -3.931 -1.394 -0.759
616 3HG1 VAL 78 3HG1 VAL 78 -2.358 -1.059 -0.034
617 1HG2 VAL 78 1HG2 VAL 78 -5.059 -3.593 0.153
618 2HG2 VAL 78 2HG2 VAL 78 -3.778 -4.486 0.964
619 3HG2 VAL 78 3HG2 VAL 78 -3.449 -3.676 -0.563
620 H ILE 79 H ILE 79 -1.283 -0.347 1.576
621 HA ILE 79 HA ILE 79 -1.957 0.611 4.271
622 HB ILE 79 HB ILE 79 0.660 1.251 2.908
623 1HG1 ILE 79 2HG1 ILE 79 0.710 -0.500 5.285
624 2HG1 ILE 79 1HG1 ILE 79 0.045 -1.245 3.838
625 1HG2 ILE 79 1HG2 ILE 79 -0.582 2.594 4.880
626 2HG2 ILE 79 2HG2 ILE 79 1.172 2.502 4.713
627 3HG2 ILE 79 3HG2 ILE 79 0.334 1.426 5.831
628 1HD1 ILE 79 1HD1 ILE 79 2.045 -1.005 2.658
629 2HD1 ILE 79 2HD1 ILE 79 2.527 -1.529 4.271
630 3HD1 ILE 79 3HD1 ILE 79 2.685 0.165 3.811
631 H ILE 80 H ILE 80 -3.316 2.263 4.017
632 HA ILE 80 HA ILE 80 -3.146 3.901 1.605
633 HB ILE 80 HB ILE 80 -5.313 4.039 3.697
634 1HG1 ILE 80 2HG1 ILE 80 -6.576 2.628 1.930
635 2HG1 ILE 80 1HG1 ILE 80 -4.977 2.195 1.340
636 1HG2 ILE 80 1HG2 ILE 80 -5.485 5.923 2.352
637 2HG2 ILE 80 2HG2 ILE 80 -6.592 4.785 1.589
638 3HG2 ILE 80 3HG2 ILE 80 -4.993 5.055 0.899
639 1HD1 ILE 80 1HD1 ILE 80 -5.549 1.866 4.231
640 2HD1 ILE 80 2HD1 ILE 80 -4.494 0.932 3.171
641 3HD1 ILE 80 3HD1 ILE 80 -6.242 0.711 3.095
642 H MET 81 H MET 81 -2.500 5.965 1.583
643 HA MET 81 HA MET 81 -1.109 7.011 3.824
644 1HB MET 81 2HB MET 81 -0.501 8.827 2.427
645 2HB MET 81 1HB MET 81 -0.522 7.390 1.420
646 1HG MET 81 2HG MET 81 -2.280 8.117 0.181
647 2HG MET 81 1HG MET 81 -2.986 9.033 1.509
648 1HE MET 81 1HE MET 81 0.404 9.178 -0.821
649 2HE MET 81 2HE MET 81 -0.282 10.487 -1.784
650 3HE MET 81 3HE MET 81 -1.152 8.962 -1.621
651 H THR 82 H THR 82 -4.391 7.482 2.748
652 HA THR 82 HA THR 82 -4.815 9.230 5.042
653 HB THR 82 HB THR 82 -5.803 10.054 2.312
654 HG1 THR 82 1HG THR 82 -3.669 11.200 3.774
655 1HG2 THR 82 1HG2 THR 82 -5.688 11.551 4.916
656 2HG2 THR 82 2HG2 THR 82 -7.141 10.943 4.125
657 3HG2 THR 82 3HG2 THR 82 -6.191 12.217 3.362
658 H ALA 83 H ALA 83 -7.092 9.556 5.569
659 HA ALA 83 HA ALA 83 -8.932 7.613 4.382
660 1HB ALA 83 1HB ALA 83 -7.582 7.009 6.690
661 2HB ALA 83 2HB ALA 83 -9.113 6.295 6.183
662 3HB ALA 83 3HB ALA 83 -9.103 7.661 7.298
663 H HIS 84 H HIS 84 -9.338 10.119 3.748
664 HA HIS 84 HA HIS 84 -10.825 11.569 5.718
665 1HB HIS 84 2HB HIS 84 -11.483 12.988 3.636
666 2HB HIS 84 1HB HIS 84 -9.835 13.036 4.240
667 HD1 HIS 84 1HD HIS 84 -9.324 13.903 1.761
668 HD2 HIS 84 2HD HIS 84 -10.487 9.929 2.094
669 HE1 HIS 84 1HE HIS 84 -8.683 12.829 -0.419
670 HE2 HIS 84 2HE HIS 84 -9.505 10.456 -0.238
671 H SER 85 H SER 85 -12.303 11.258 2.541
672 HA SER 85 HA SER 85 -14.767 10.444 3.840
673 1HB SER 85 2HB SER 85 -14.590 12.303 2.095
674 2HB SER 85 1HB SER 85 -14.405 11.015 0.904
675 HG SER 85 HG SER 85 -16.598 11.720 1.205
676 H ASP 86 H ASP 86 -16.194 8.922 2.482
677 HA ASP 86 HA ASP 86 -16.635 6.793 1.829
678 1HB ASP 86 2HB ASP 86 -14.062 7.304 0.348
679 2HB ASP 86 1HB ASP 86 -14.961 5.803 0.168
680 H LEU 87 H LEU 87 -14.777 7.365 4.222
681 HA LEU 87 HA LEU 87 -12.878 5.433 4.602
682 1HB LEU 87 2HB LEU 87 -14.446 7.176 6.263
683 2HB LEU 87 1HB LEU 87 -14.258 5.622 7.051
684 HG LEU 87 HG LEU 87 -12.006 7.385 6.079
685 1HD1 LEU 87 1HD1 LEU 87 -13.468 7.876 8.243
686 2HD1 LEU 87 2HD1 LEU 87 -11.720 8.121 8.212
687 3HD1 LEU 87 3HD1 LEU 87 -12.393 6.654 8.925
688 1HD2 LEU 87 1HD2 LEU 87 -12.131 4.596 7.054
689 2HD2 LEU 87 2HD2 LEU 87 -10.824 5.605 7.672
690 3HD2 LEU 87 3HD2 LEU 87 -11.002 5.356 5.934
691 H ASP 88 H ASP 88 -16.298 4.977 4.430
692 HA ASP 88 HA ASP 88 -16.764 2.698 5.876
693 1HB ASP 88 2HB ASP 88 -17.819 3.388 3.127
694 2HB ASP 88 1HB ASP 88 -18.489 2.133 4.166
695 H ALA 89 H ALA 89 -15.395 2.893 2.605
696 HA ALA 89 HA ALA 89 -15.158 0.110 2.223
697 1HB ALA 89 1HB ALA 89 -13.790 2.446 0.926
698 2HB ALA 89 2HB ALA 89 -15.115 1.470 0.294
699 3HB ALA 89 3HB ALA 89 -13.498 0.777 0.438
700 H ALA 90 H ALA 90 -13.310 2.339 4.065
701 HA ALA 90 HA ALA 90 -10.791 1.082 4.020
702 1HB ALA 90 1HB ALA 90 -11.849 2.500 6.442
703 2HB ALA 90 2HB ALA 90 -11.431 3.385 4.979
704 3HB ALA 90 3HB ALA 90 -10.201 2.445 5.819
705 H VAL 91 H VAL 91 -13.585 0.687 6.167
706 HA VAL 91 HA VAL 91 -12.428 -1.123 7.944
707 HB VAL 91 HB VAL 91 -15.335 -1.216 7.183
708 1HG1 VAL 91 1HG1 VAL 91 -15.016 -1.408 9.935
709 2HG1 VAL 91 2HG1 VAL 91 -13.671 -2.340 9.275
710 3HG1 VAL 91 3HG1 VAL 91 -15.328 -2.735 8.815
711 1HG2 VAL 91 1HG2 VAL 91 -13.826 1.007 8.295
712 2HG2 VAL 91 2HG2 VAL 91 -15.121 0.477 9.369
713 3HG2 VAL 91 3HG2 VAL 91 -15.489 0.951 7.711
714 H SER 92 H SER 92 -14.259 -1.739 4.953
715 HA SER 92 HA SER 92 -14.175 -4.550 5.142
716 1HB SER 92 2HB SER 92 -14.729 -4.585 2.768
717 2HB SER 92 1HB SER 92 -15.692 -3.358 3.591
718 HG SER 92 HG SER 92 -14.113 -3.032 1.510
719 H ALA 93 H ALA 93 -11.778 -2.227 4.372
720 HA ALA 93 HA ALA 93 -10.094 -3.785 2.745
721 1HB ALA 93 1HB ALA 93 -8.554 -2.087 2.924
722 2HB ALA 93 2HB ALA 93 -8.975 -1.745 4.602
723 3HB ALA 93 3HB ALA 93 -10.051 -1.235 3.301
724 H TYR 94 H TYR 94 -10.249 -3.284 6.220
725 HA TYR 94 HA TYR 94 -8.020 -4.864 6.919
726 1HB TYR 94 2HB TYR 94 -10.473 -4.639 8.653
727 2HB TYR 94 1HB TYR 94 -8.790 -4.771 9.149
728 HD1 TYR 94 1HD TYR 94 -11.393 -2.616 9.240
729 HD2 TYR 94 2HD TYR 94 -7.361 -2.715 7.890
730 HE1 TYR 94 1HE TYR 94 -11.267 -0.169 9.454
731 HE2 TYR 94 2HE TYR 94 -7.230 -0.269 8.096
732 HH TYR 94 HH TYR 94 -9.951 1.693 8.518
733 H GLN 95 H GLN 95 -11.224 -5.609 5.938
734 HA GLN 95 HA GLN 95 -11.283 -8.299 6.926
735 1HB GLN 95 2HB GLN 95 -13.420 -7.428 6.675
736 2HB GLN 95 1HB GLN 95 -13.032 -6.626 5.163
737 1HG GLN 95 2HG GLN 95 -13.105 -9.611 5.308
738 2HG GLN 95 1HG GLN 95 -14.599 -8.685 5.167
739 1HE2 GLN 95 1HE2 GLN 95 -14.009 -6.701 3.462
740 2HE2 GLN 95 2HE2 GLN 95 -13.527 -7.329 1.927
741 H GLN 96 H GLN 96 -10.518 -6.724 3.863
742 HA GLN 96 HA GLN 96 -10.147 -9.203 2.480
743 1HB GLN 96 2HB GLN 96 -9.436 -7.873 0.605
744 2HB GLN 96 1HB GLN 96 -10.867 -7.140 1.317
745 1HG GLN 96 2HG GLN 96 -9.784 -5.225 1.488
746 2HG GLN 96 1HG GLN 96 -8.624 -5.988 2.570
747 1HE2 GLN 96 1HE2 GLN 96 -8.069 -3.896 0.751
748 2HE2 GLN 96 2HE2 GLN 96 -6.922 -4.490 -0.394
749 H GLY 97 H GLY 97 -8.208 -7.255 4.534
750 1HA GLY 97 2HA GLY 97 -6.192 -8.546 5.294
751 2HA GLY 97 1HA GLY 97 -5.798 -8.683 3.590
752 H ALA 98 H ALA 98 -7.090 -5.648 4.023
753 HA ALA 98 HA ALA 98 -4.754 -4.273 3.460
754 1HB ALA 98 1HB ALA 98 -7.225 -3.271 4.860
755 2HB ALA 98 2HB ALA 98 -6.908 -3.252 3.126
756 3HB ALA 98 3HB ALA 98 -5.952 -2.241 4.209
757 H PHE 99 H PHE 99 -3.354 -2.941 4.760
758 HA PHE 99 HA PHE 99 -2.781 -4.128 7.305
759 1HB PHE 99 2HB PHE 99 -1.021 -3.358 5.658
760 2HB PHE 99 1HB PHE 99 -1.430 -1.707 6.118
761 HD1 PHE 99 1HD PHE 99 -1.019 -4.830 8.109
762 HD2 PHE 99 2HD PHE 99 0.292 -0.845 7.389
763 HE1 PHE 99 1HE PHE 99 0.503 -4.986 10.035
764 HE2 PHE 99 2HE PHE 99 1.819 -1.001 9.314
765 HZ PHE 99 HZ PHE 99 1.924 -3.070 10.640
766 H ASP 100 H ASP 100 -3.572 -0.808 6.247
767 HA ASP 100 HA ASP 100 -5.404 -0.259 8.234
768 1HB ASP 100 2HB ASP 100 -2.867 -0.443 9.385
769 2HB ASP 100 1HB ASP 100 -3.159 1.287 9.242
770 H TYR 101 H TYR 101 -4.968 2.363 8.876
771 HA TYR 101 HA TYR 101 -4.619 3.713 6.289
772 1HB TYR 101 2HB TYR 101 -7.045 3.504 7.940
773 2HB TYR 101 1HB TYR 101 -6.647 5.144 7.446
774 HD1 TYR 101 1HD TYR 101 -7.418 1.742 6.193
775 HD2 TYR 101 2HD TYR 101 -6.992 5.868 5.221
776 HE1 TYR 101 1HE TYR 101 -8.474 1.343 3.995
777 HE2 TYR 101 2HE TYR 101 -8.033 5.476 3.035
778 HH TYR 101 HH TYR 101 -8.376 3.574 1.467
779 H LEU 102 H LEU 102 -4.114 5.954 6.425
780 HA LEU 102 HA LEU 102 -2.827 6.665 8.963
781 1HB LEU 102 2HB LEU 102 -2.124 6.969 6.175
782 2HB LEU 102 1HB LEU 102 -2.052 8.506 7.014
783 HG LEU 102 HG LEU 102 -0.470 7.623 8.612
784 1HD1 LEU 102 1HD1 LEU 102 -1.573 5.187 8.093
785 2HD1 LEU 102 2HD1 LEU 102 -0.074 5.461 8.979
786 3HD1 LEU 102 3HD1 LEU 102 -0.024 5.078 7.259
787 1HD2 LEU 102 1HD2 LEU 102 0.094 7.257 5.707
788 2HD2 LEU 102 2HD2 LEU 102 1.323 6.833 6.900
789 3HD2 LEU 102 3HD2 LEU 102 0.694 8.477 6.825
790 HA PRO 103 HA PRO 103 -6.165 9.650 9.398
791 1HB PRO 103 2HB PRO 103 -4.786 10.532 11.813
792 2HB PRO 103 1HB PRO 103 -6.354 9.742 11.654
793 1HG PRO 103 2HG PRO 103 -4.180 8.524 12.732
794 2HG PRO 103 1HG PRO 103 -5.468 7.645 11.889
795 1HD PRO 103 2HD PRO 103 -2.755 8.438 10.912
796 2HD PRO 103 1HD PRO 103 -3.670 6.943 10.622
797 H LYS 104 H LYS 104 -3.138 10.892 10.802
798 HA LYS 104 HA LYS 104 -3.355 13.182 8.969
799 1HB LYS 104 2HB LYS 104 -3.247 13.144 11.824
800 2HB LYS 104 1HB LYS 104 -1.802 13.941 11.214
801 1HG LYS 104 2HG LYS 104 -3.025 15.608 10.137
802 2HG LYS 104 1HG LYS 104 -4.523 14.677 10.199
803 1HD LYS 104 2HD LYS 104 -3.111 15.702 12.655
804 2HD LYS 104 1HD LYS 104 -4.366 16.610 11.811
805 1HE LYS 104 2HE LYS 104 -6.028 15.253 12.537
806 2HE LYS 104 1HE LYS 104 -5.013 13.812 12.505
807 1HZ LYS 104 1HZ LYS 104 -5.494 15.689 14.661
808 2HZ LYS 104 2HZ LYS 104 -3.886 15.192 14.491
809 3HZ LYS 104 3HZ LYS 104 -5.106 14.043 14.723
810 HA PRO 105 HA PRO 105 1.451 12.541 9.655
811 1HB PRO 105 2HB PRO 105 2.039 9.955 10.487
812 2HB PRO 105 1HB PRO 105 2.081 11.392 11.513
813 1HG PRO 105 2HG PRO 105 -0.077 9.349 11.200
814 2HG PRO 105 1HG PRO 105 0.502 10.152 12.671
815 1HD PRO 105 2HD PRO 105 -1.769 10.907 11.510
816 2HD PRO 105 1HD PRO 105 -0.670 12.114 12.205
817 H PHE 106 H PHE 106 2.870 11.548 8.152
818 HA PHE 106 HA PHE 106 2.128 9.278 6.617
819 1HB PHE 106 2HB PHE 106 0.535 10.874 5.649
820 2HB PHE 106 1HB PHE 106 1.851 11.978 5.272
821 HD1 PHE 106 1HD PHE 106 2.034 12.106 2.984
822 HD2 PHE 106 2HD PHE 106 1.499 8.293 4.792
823 HE1 PHE 106 1HE PHE 106 2.312 11.028 0.791
824 HE2 PHE 106 2HE PHE 106 1.777 7.209 2.607
825 HZ PHE 106 HZ PHE 106 2.185 8.578 0.599
826 H ASP 107 H ASP 107 3.650 11.611 4.621
827 HA ASP 107 HA ASP 107 5.756 11.585 3.726
828 1HB ASP 107 2HB ASP 107 7.495 12.245 5.332
829 2HB ASP 107 1HB ASP 107 5.999 13.134 5.607
830 H ILE 108 H ILE 108 8.125 10.597 4.118
831 HA ILE 108 HA ILE 108 7.801 7.807 3.801
832 HB ILE 108 HB ILE 108 9.903 9.694 3.404
833 1HG1 ILE 108 2HG1 ILE 108 10.617 8.071 1.747
834 2HG1 ILE 108 1HG1 ILE 108 9.616 6.832 2.498
835 1HG2 ILE 108 1HG2 ILE 108 11.807 8.140 3.864
836 2HG2 ILE 108 2HG2 ILE 108 10.691 7.161 4.811
837 3HG2 ILE 108 3HG2 ILE 108 11.043 8.815 5.304
838 1HD1 ILE 108 1HD1 ILE 108 8.723 7.949 0.397
839 2HD1 ILE 108 2HD1 ILE 108 8.444 9.364 1.412
840 3HD1 ILE 108 3HD1 ILE 108 7.635 7.840 1.784
841 H ASP 109 H ASP 109 9.075 9.749 6.414
842 HA ASP 109 HA ASP 109 10.109 7.816 8.063
843 1HB ASP 109 2HB ASP 109 8.564 10.296 8.837
844 2HB ASP 109 1HB ASP 109 9.479 9.313 9.974
845 H GLU 110 H GLU 110 6.719 8.997 8.255
846 HA GLU 110 HA GLU 110 5.996 6.857 9.989
847 1HB GLU 110 2HB GLU 110 4.173 8.744 8.510
848 2HB GLU 110 1HB GLU 110 3.745 7.747 9.890
849 1HG GLU 110 2HG GLU 110 5.840 9.897 9.990
850 2HG GLU 110 1HG GLU 110 4.141 10.172 10.372
851 H ALA 111 H ALA 111 5.795 7.447 6.560
852 HA ALA 111 HA ALA 111 3.951 5.401 5.933
853 1HB ALA 111 1HB ALA 111 4.795 5.584 3.637
854 2HB ALA 111 2HB ALA 111 6.133 6.579 4.210
855 3HB ALA 111 3HB ALA 111 4.476 7.169 4.340
856 H VAL 112 H VAL 112 7.492 5.462 5.525
857 HA VAL 112 HA VAL 112 7.791 2.725 5.008
858 HB VAL 112 HB VAL 112 9.805 4.544 6.323
859 1HG1 VAL 112 1HG1 VAL 112 11.283 2.880 6.191
860 2HG1 VAL 112 2HG1 VAL 112 10.801 2.475 4.544
861 3HG1 VAL 112 3HG1 VAL 112 9.906 1.814 5.913
862 1HG2 VAL 112 1HG2 VAL 112 10.578 4.416 3.742
863 2HG2 VAL 112 2HG2 VAL 112 9.558 5.696 4.393
864 3HG2 VAL 112 3HG2 VAL 112 8.827 4.336 3.547
865 H ALA 113 H ALA 113 7.520 4.509 7.965
866 HA ALA 113 HA ALA 113 8.455 2.564 9.777
867 1HB ALA 113 1HB ALA 113 6.400 4.739 10.115
868 2HB ALA 113 2HB ALA 113 8.126 4.855 10.470
869 3HB ALA 113 3HB ALA 113 7.094 3.804 11.439
870 H LEU 114 H LEU 114 5.270 3.322 8.502
871 HA LEU 114 HA LEU 114 3.927 1.243 9.904
872 1HB LEU 114 2HB LEU 114 2.804 3.313 9.291
873 2HB LEU 114 1HB LEU 114 3.064 2.968 7.594
874 HG LEU 114 HG LEU 114 1.588 0.966 7.829
875 1HD1 LEU 114 1HD1 LEU 114 0.433 2.031 10.327
876 2HD1 LEU 114 2HD1 LEU 114 1.966 1.171 10.485
877 3HD1 LEU 114 3HD1 LEU 114 0.572 0.371 9.758
878 1HD2 LEU 114 1HD2 LEU 114 -0.473 2.253 7.846
879 2HD2 LEU 114 2HD2 LEU 114 0.789 3.115 6.965
880 3HD2 LEU 114 3HD2 LEU 114 0.369 3.600 8.605
881 H VAL 115 H VAL 115 5.601 1.438 6.884
882 HA VAL 115 HA VAL 115 4.273 -0.844 5.743
883 HB VAL 115 HB VAL 115 5.359 1.036 4.395
884 1HG1 VAL 115 1HG1 VAL 115 7.556 0.780 5.662
885 2HG1 VAL 115 2HG1 VAL 115 7.646 0.981 3.917
886 3HG1 VAL 115 3HG1 VAL 115 7.852 -0.617 4.632
887 1HG2 VAL 115 1HG2 VAL 115 5.245 -1.839 3.882
888 2HG2 VAL 115 2HG2 VAL 115 6.371 -0.976 2.832
889 3HG2 VAL 115 3HG2 VAL 115 4.678 -0.487 2.902
890 H GLU 116 H GLU 116 7.357 -0.248 7.350
891 HA GLU 116 HA GLU 116 8.429 -2.830 6.967
892 1HB GLU 116 2HB GLU 116 8.984 -0.767 9.102
893 2HB GLU 116 1HB GLU 116 9.934 -2.228 8.866
894 1HG GLU 116 2HG GLU 116 10.652 -1.506 6.715
895 2HG GLU 116 1HG GLU 116 9.530 -0.148 6.737
896 H ARG 117 H ARG 117 6.557 -1.415 9.629
897 HA ARG 117 HA ARG 117 6.656 -3.650 11.323
898 1HB ARG 117 2HB ARG 117 4.777 -2.644 12.494
899 2HB ARG 117 1HB ARG 117 5.957 -1.411 12.067
900 1HG ARG 117 2HG ARG 117 4.583 -0.423 10.538
901 2HG ARG 117 1HG ARG 117 3.695 -1.910 10.207
902 1HD ARG 117 2HD ARG 117 2.207 -0.510 11.394
903 2HD ARG 117 1HD ARG 117 2.760 -1.726 12.544
904 HE ARG 117 HE ARG 117 4.396 0.581 12.670
905 1HH1 ARG 117 1HH1 ARG 117 1.242 -0.594 13.585
906 2HH1 ARG 117 2HH1 ARG 117 1.102 0.469 14.945
907 1HH2 ARG 117 1HH2 ARG 117 4.215 1.986 14.450
908 2HH2 ARG 117 2HH2 ARG 117 2.790 1.938 15.435
909 H ALA 118 H ALA 118 4.791 -2.988 8.501
910 HA ALA 118 HA ALA 118 2.711 -4.861 8.973
911 1HB ALA 118 1HB ALA 118 2.885 -2.858 7.277
912 2HB ALA 118 2HB ALA 118 1.893 -4.273 6.918
913 3HB ALA 118 3HB ALA 118 3.499 -4.117 6.205
914 H ILE 119 H ILE 119 5.754 -4.980 7.149
915 HA ILE 119 HA ILE 119 5.396 -7.624 6.200
916 HB ILE 119 HB ILE 119 8.026 -6.215 6.634
917 1HG1 ILE 119 2HG1 ILE 119 6.755 -6.162 3.963
918 2HG1 ILE 119 1HG1 ILE 119 6.014 -5.133 5.187
919 1HG2 ILE 119 1HG2 ILE 119 8.642 -7.587 4.597
920 2HG2 ILE 119 2HG2 ILE 119 7.149 -8.488 4.869
921 3HG2 ILE 119 3HG2 ILE 119 8.412 -8.480 6.101
922 1HD1 ILE 119 1HD1 ILE 119 8.038 -3.948 5.522
923 2HD1 ILE 119 2HD1 ILE 119 7.759 -4.029 3.785
924 3HD1 ILE 119 3HD1 ILE 119 8.946 -5.094 4.539
925 H SER 120 H SER 120 6.677 -6.234 9.098
926 HA SER 120 HA SER 120 8.026 -8.535 10.060
927 1HB SER 120 2HB SER 120 8.698 -6.423 10.935
928 2HB SER 120 1HB SER 120 7.049 -6.021 11.411
929 HG SER 120 HG SER 120 7.553 -6.871 13.254
930 H HIS 121 H HIS 121 4.827 -7.138 10.700
931 HA HIS 121 HA HIS 121 4.061 -9.068 12.621
932 1HB HIS 121 2HB HIS 121 2.605 -7.029 10.984
933 2HB HIS 121 1HB HIS 121 1.685 -8.238 11.874
934 HD1 HIS 121 1HD HIS 121 3.800 -5.206 12.342
935 HD2 HIS 121 2HD HIS 121 1.757 -7.972 14.674
936 HE1 HIS 121 1HE HIS 121 3.732 -4.215 14.653
937 HE2 HIS 121 2HE HIS 121 2.572 -5.949 16.066
938 H TYR 122 H TYR 122 4.124 -9.074 9.178
939 HA TYR 122 HA TYR 122 2.188 -11.085 8.714
940 1HB TYR 122 2HB TYR 122 3.566 -9.416 7.098
941 2HB TYR 122 1HB TYR 122 4.481 -10.899 6.852
942 HD1 TYR 122 1HD TYR 122 3.901 -11.738 4.768
943 HD2 TYR 122 2HD TYR 122 0.826 -10.317 7.344
944 HE1 TYR 122 1HE TYR 122 2.205 -12.510 3.160
945 HE2 TYR 122 2HE TYR 122 -0.876 -11.086 5.745
946 HH TYR 122 HH TYR 122 -0.805 -11.511 3.045
947 H GLN 123 H GLN 123 5.732 -11.191 8.945
948 HA GLN 123 HA GLN 123 5.850 -14.033 8.749
949 1HB GLN 123 2HB GLN 123 7.661 -12.241 8.180
950 2HB GLN 123 1HB GLN 123 8.060 -12.362 9.887
951 1HG GLN 123 2HG GLN 123 7.855 -14.988 8.783
952 2HG GLN 123 1HG GLN 123 8.917 -14.008 7.775
953 1HE2 GLN 123 1HE2 GLN 123 9.893 -16.161 9.153
954 2HE2 GLN 123 2HE2 GLN 123 10.932 -15.620 10.421
955 H GLU 124 H GLU 124 7.127 -15.253 10.531
956 HA GLU 124 HA GLU 124 7.177 -16.116 12.633
957 1HB GLU 124 2HB GLU 124 7.583 -13.372 12.954
958 2HB GLU 124 1HB GLU 124 6.344 -13.774 14.135
959 1HG GLU 124 2HG GLU 124 7.791 -14.833 15.451
960 2HG GLU 124 1HG GLU 124 8.529 -15.690 14.098
Start of MODEL 16
1 1H MET 1 1HT MET 1 6.664 -15.859 3.530
2 2H MET 1 2HT MET 1 7.609 -17.112 4.226
3 3H MET 1 3HT MET 1 7.691 -16.808 2.538
4 HA MET 1 HA MET 1 8.347 -14.696 4.439
5 1HB MET 1 2HB MET 1 9.541 -17.120 4.673
6 2HB MET 1 1HB MET 1 10.557 -16.391 3.437
7 1HG MET 1 2HG MET 1 11.699 -15.611 5.193
8 2HG MET 1 1HG MET 1 10.445 -14.372 5.215
9 1HE MET 1 1HE MET 1 9.931 -14.307 8.711
10 2HE MET 1 2HE MET 1 10.697 -13.631 7.275
11 3HE MET 1 3HE MET 1 11.628 -14.649 8.373
12 H GLN 2 H GLN 2 9.399 -16.438 1.503
13 HA GLN 2 HA GLN 2 10.024 -15.705 -0.554
14 1HB GLN 2 2HB GLN 2 8.105 -13.583 0.319
15 2HB GLN 2 1HB GLN 2 9.040 -13.332 -1.148
16 1HG GLN 2 2HG GLN 2 8.161 -15.464 -2.029
17 2HG GLN 2 1HG GLN 2 7.164 -15.618 -0.583
18 1HE2 GLN 2 1HE2 GLN 2 6.494 -15.330 -3.463
19 2HE2 GLN 2 2HE2 GLN 2 5.407 -13.991 -3.541
20 H ARG 3 H ARG 3 11.102 -13.685 -1.693
21 HA ARG 3 HA ARG 3 13.419 -13.094 -0.135
22 1HB ARG 3 2HB ARG 3 14.179 -11.878 -2.167
23 2HB ARG 3 1HB ARG 3 13.699 -13.539 -2.484
24 1HG ARG 3 2HG ARG 3 11.932 -12.934 -3.756
25 2HG ARG 3 1HG ARG 3 11.614 -11.475 -2.814
26 1HD ARG 3 2HD ARG 3 14.062 -11.675 -4.522
27 2HD ARG 3 1HD ARG 3 12.508 -11.266 -5.241
28 HE ARG 3 HE ARG 3 12.486 -9.258 -3.997
29 1HH1 ARG 3 1HH1 ARG 3 15.440 -11.076 -3.554
30 2HH1 ARG 3 2HH1 ARG 3 16.328 -9.714 -2.964
31 1HH2 ARG 3 1HH2 ARG 3 13.662 -7.474 -3.225
32 2HH2 ARG 3 2HH2 ARG 3 15.323 -7.674 -2.776
33 H GLY 4 H GLY 4 10.460 -11.727 -0.005
34 1HA GLY 4 2HA GLY 4 9.852 -9.813 1.175
35 2HA GLY 4 1HA GLY 4 11.526 -9.276 1.116
36 H ILE 5 H ILE 5 8.501 -9.444 -0.642
37 HA ILE 5 HA ILE 5 9.552 -7.479 -2.562
38 HB ILE 5 HB ILE 5 7.078 -9.167 -2.896
39 1HG1 ILE 5 2HG1 ILE 5 8.849 -10.171 -4.693
40 2HG1 ILE 5 1HG1 ILE 5 9.931 -9.780 -3.360
41 1HG2 ILE 5 1HG2 ILE 5 8.388 -7.057 -4.440
42 2HG2 ILE 5 2HG2 ILE 5 6.725 -7.640 -4.497
43 3HG2 ILE 5 3HG2 ILE 5 7.989 -8.497 -5.378
44 1HD1 ILE 5 1HD1 ILE 5 9.149 -11.437 -2.072
45 2HD1 ILE 5 2HD1 ILE 5 8.614 -12.112 -3.612
46 3HD1 ILE 5 3HD1 ILE 5 7.483 -11.210 -2.604
47 H VAL 6 H VAL 6 9.031 -5.474 -2.060
48 HA VAL 6 HA VAL 6 6.428 -4.959 -0.790
49 HB VAL 6 HB VAL 6 8.252 -4.164 0.593
50 1HG1 VAL 6 1HG1 VAL 6 9.139 -2.557 -1.802
51 2HG1 VAL 6 2HG1 VAL 6 9.957 -3.977 -1.155
52 3HG1 VAL 6 3HG1 VAL 6 9.853 -2.508 -0.193
53 1HG2 VAL 6 1HG2 VAL 6 6.098 -2.689 -0.222
54 2HG2 VAL 6 2HG2 VAL 6 7.437 -1.562 -0.462
55 3HG2 VAL 6 3HG2 VAL 6 7.163 -2.281 1.127
56 H TRP 7 H TRP 7 4.907 -4.076 -2.026
57 HA TRP 7 HA TRP 7 5.774 -2.559 -4.392
58 1HB TRP 7 2HB TRP 7 3.448 -4.390 -3.930
59 2HB TRP 7 1HB TRP 7 3.369 -3.153 -5.185
60 HD1 TRP 7 HD1 TRP 7 6.835 -4.377 -4.844
61 HE1 TRP 7 1HE TRP 7 7.417 -6.009 -6.736
62 HE3 TRP 7 3HE TRP 7 2.125 -5.236 -6.632
63 HZ2 TRP 7 2HZ TRP 7 6.050 -7.499 -8.709
64 HZ3 TRP 7 3HZ TRP 7 1.849 -6.780 -8.525
65 HH2 TRP 7 HH2 TRP 7 3.772 -7.888 -9.540
66 H VAL 8 H VAL 8 4.913 -0.594 -4.848
67 HA VAL 8 HA VAL 8 3.108 0.574 -2.823
68 HB VAL 8 HB VAL 8 5.139 2.296 -4.167
69 1HG1 VAL 8 1HG1 VAL 8 4.215 3.759 -2.790
70 2HG1 VAL 8 2HG1 VAL 8 4.910 2.867 -1.437
71 3HG1 VAL 8 3HG1 VAL 8 3.281 2.495 -1.998
72 1HG2 VAL 8 1HG2 VAL 8 6.402 1.637 -1.819
73 2HG2 VAL 8 2HG2 VAL 8 6.849 1.065 -3.427
74 3HG2 VAL 8 3HG2 VAL 8 5.812 0.077 -2.396
75 H VAL 9 H VAL 9 1.561 2.017 -3.543
76 HA VAL 9 HA VAL 9 1.465 2.480 -6.456
77 HB VAL 9 HB VAL 9 -1.169 2.670 -5.277
78 1HG1 VAL 9 1HG1 VAL 9 -0.999 2.425 -7.606
79 2HG1 VAL 9 2HG1 VAL 9 -1.572 0.851 -7.052
80 3HG1 VAL 9 3HG1 VAL 9 0.119 1.072 -7.467
81 1HG2 VAL 9 1HG2 VAL 9 -1.388 0.128 -4.973
82 2HG2 VAL 9 2HG2 VAL 9 -0.674 1.057 -3.657
83 3HG2 VAL 9 3HG2 VAL 9 0.362 0.140 -4.752
84 H ASP 10 H ASP 10 1.938 4.566 -6.801
85 HA ASP 10 HA ASP 10 0.417 6.640 -5.517
86 1HB ASP 10 2HB ASP 10 2.475 7.821 -4.629
87 2HB ASP 10 1HB ASP 10 2.013 6.364 -3.758
88 H ASP 11 H ASP 11 2.185 8.790 -6.050
89 HA ASP 11 HA ASP 11 1.633 9.199 -8.781
90 1HB ASP 11 2HB ASP 11 3.467 10.727 -6.924
91 2HB ASP 11 1HB ASP 11 2.955 11.282 -8.514
92 H ASP 12 H ASP 12 4.000 7.288 -7.461
93 HA ASP 12 HA ASP 12 5.827 6.257 -8.333
94 1HB ASP 12 2HB ASP 12 4.166 6.690 -10.483
95 2HB ASP 12 1HB ASP 12 5.672 7.425 -11.023
96 H SER 13 H SER 13 7.567 7.248 -10.442
97 HA SER 13 HA SER 13 9.608 8.285 -10.325
98 1HB SER 13 2HB SER 13 9.351 10.533 -11.103
99 2HB SER 13 1HB SER 13 8.021 9.559 -11.737
100 HG SER 13 HG SER 13 6.708 10.418 -10.067
101 H SER 14 H SER 14 8.251 11.071 -8.787
102 HA SER 14 HA SER 14 10.275 11.394 -6.943
103 1HB SER 14 2HB SER 14 8.771 13.217 -7.490
104 2HB SER 14 1HB SER 14 7.410 12.355 -6.773
105 HG SER 14 HG SER 14 9.576 12.708 -5.099
106 H ILE 15 H ILE 15 6.997 10.151 -6.225
107 HA ILE 15 HA ILE 15 7.603 9.430 -3.569
108 HB ILE 15 HB ILE 15 5.483 8.080 -5.219
109 1HG1 ILE 15 2HG1 ILE 15 5.331 10.534 -5.559
110 2HG1 ILE 15 1HG1 ILE 15 3.959 9.895 -4.664
111 1HG2 ILE 15 1HG2 ILE 15 5.805 8.695 -2.292
112 2HG2 ILE 15 2HG2 ILE 15 5.734 7.113 -3.065
113 3HG2 ILE 15 3HG2 ILE 15 4.294 8.130 -3.005
114 1HD1 ILE 15 1HD1 ILE 15 6.280 10.965 -3.152
115 2HD1 ILE 15 2HD1 ILE 15 4.569 10.924 -2.724
116 3HD1 ILE 15 3HD1 ILE 15 5.154 12.089 -3.912
117 H ARG 16 H ARG 16 8.113 7.849 -6.592
118 HA ARG 16 HA ARG 16 8.439 5.202 -5.570
119 1HB ARG 16 2HB ARG 16 7.852 5.599 -7.904
120 2HB ARG 16 1HB ARG 16 9.372 6.443 -8.163
121 1HG ARG 16 2HG ARG 16 10.541 4.309 -7.531
122 2HG ARG 16 1HG ARG 16 8.968 3.521 -7.593
123 1HD ARG 16 2HD ARG 16 8.933 3.503 -9.831
124 2HD ARG 16 1HD ARG 16 9.578 5.141 -9.949
125 HE ARG 16 HE ARG 16 11.597 3.344 -9.118
126 1HH1 ARG 16 1HH1 ARG 16 9.762 4.268 -11.938
127 2HH1 ARG 16 2HH1 ARG 16 11.000 3.792 -13.052
128 1HH2 ARG 16 1HH2 ARG 16 13.226 2.726 -10.580
129 2HH2 ARG 16 2HH2 ARG 16 12.966 2.920 -12.281
130 H TRP 17 H TRP 17 10.742 7.725 -6.608
131 HA TRP 17 HA TRP 17 13.063 6.248 -6.051
132 1HB TRP 17 2HB TRP 17 13.022 8.281 -7.468
133 2HB TRP 17 1HB TRP 17 12.762 9.256 -6.023
134 HD1 TRP 17 HD1 TRP 17 15.458 7.229 -7.819
135 HE1 TRP 17 1HE TRP 17 17.749 7.832 -6.812
136 HE3 TRP 17 3HE TRP 17 13.885 10.109 -3.907
137 HZ2 TRP 17 2HZ TRP 17 18.754 9.329 -4.640
138 HZ3 TRP 17 3HZ TRP 17 15.571 11.091 -2.411
139 HH2 TRP 17 HH2 TRP 17 17.956 10.709 -2.770
140 H VAL 18 H VAL 18 11.185 8.457 -4.021
141 HA VAL 18 HA VAL 18 13.027 8.549 -1.893
142 HB VAL 18 HB VAL 18 10.074 8.861 -1.475
143 1HG1 VAL 18 1HG1 VAL 18 11.037 10.761 -0.007
144 2HG1 VAL 18 2HG1 VAL 18 12.562 9.894 -0.177
145 3HG1 VAL 18 3HG1 VAL 18 11.170 9.095 0.550
146 1HG2 VAL 18 1HG2 VAL 18 11.331 11.369 -2.080
147 2HG2 VAL 18 2HG2 VAL 18 9.916 10.623 -2.818
148 3HG2 VAL 18 3HG2 VAL 18 11.525 10.259 -3.436
149 H LEU 19 H LEU 19 10.234 6.499 -2.471
150 HA LEU 19 HA LEU 19 10.595 5.111 0.011
151 1HB LEU 19 2HB LEU 19 8.418 5.560 -1.576
152 2HB LEU 19 1HB LEU 19 8.795 3.890 -1.952
153 HG LEU 19 HG LEU 19 7.121 4.069 -0.174
154 1HD1 LEU 19 1HD1 LEU 19 8.304 2.669 1.531
155 2HD1 LEU 19 2HD1 LEU 19 9.794 2.953 0.633
156 3HD1 LEU 19 3HD1 LEU 19 8.452 2.101 -0.133
157 1HD2 LEU 19 1HD2 LEU 19 9.253 5.710 1.124
158 2HD2 LEU 19 2HD2 LEU 19 8.092 4.818 2.105
159 3HD2 LEU 19 3HD2 LEU 19 7.528 6.039 0.965
160 H GLU 20 H GLU 20 11.416 4.544 -3.324
161 HA GLU 20 HA GLU 20 11.826 1.771 -3.111
162 1HB GLU 20 2HB GLU 20 12.905 1.848 -5.203
163 2HB GLU 20 1HB GLU 20 11.654 3.071 -5.252
164 1HG GLU 20 2HG GLU 20 13.357 4.792 -4.840
165 2HG GLU 20 1HG GLU 20 14.596 3.537 -4.860
166 H ARG 21 H ARG 21 14.291 4.323 -3.155
167 HA ARG 21 HA ARG 21 16.481 2.741 -2.601
168 1HB ARG 21 2HB ARG 21 15.918 5.625 -1.956
169 2HB ARG 21 1HB ARG 21 17.471 4.876 -1.610
170 1HG ARG 21 2HG ARG 21 16.580 4.382 -4.329
171 2HG ARG 21 1HG ARG 21 16.737 6.102 -3.964
172 1HD ARG 21 2HD ARG 21 18.892 4.124 -3.287
173 2HD ARG 21 1HD ARG 21 18.797 4.890 -4.870
174 HE ARG 21 HE ARG 21 19.010 7.044 -3.695
175 1HH1 ARG 21 1HH1 ARG 21 20.082 4.145 -2.050
176 2HH1 ARG 21 2HH1 ARG 21 21.172 4.998 -1.014
177 1HH2 ARG 21 1HH2 ARG 21 20.438 8.150 -2.321
178 2HH2 ARG 21 2HH2 ARG 21 21.371 7.263 -1.161
179 H ALA 22 H ALA 22 14.522 4.536 -0.211
180 HA ALA 22 HA ALA 22 15.952 3.630 2.018
181 1HB ALA 22 1HB ALA 22 13.297 4.893 1.616
182 2HB ALA 22 2HB ALA 22 14.684 5.448 2.555
183 3HB ALA 22 3HB ALA 22 13.649 4.167 3.185
184 H LEU 23 H LEU 23 13.408 2.109 0.206
185 HA LEU 23 HA LEU 23 13.017 0.097 2.257
186 1HB LEU 23 2HB LEU 23 11.477 1.005 0.081
187 2HB LEU 23 1HB LEU 23 11.862 -0.675 -0.249
188 HG LEU 23 HG LEU 23 10.681 0.253 2.363
189 1HD1 LEU 23 1HD1 LEU 23 8.614 0.230 1.537
190 2HD1 LEU 23 2HD1 LEU 23 8.927 -1.204 0.571
191 3HD1 LEU 23 3HD1 LEU 23 9.376 0.381 -0.046
192 1HD2 LEU 23 1HD2 LEU 23 9.959 -2.280 2.179
193 2HD2 LEU 23 2HD2 LEU 23 11.551 -1.822 2.802
194 3HD2 LEU 23 3HD2 LEU 23 11.377 -2.363 1.129
195 H ALA 24 H ALA 24 14.775 0.538 -0.684
196 HA ALA 24 HA ALA 24 15.438 -2.180 -1.138
197 1HB ALA 24 1HB ALA 24 17.314 -1.254 -2.490
198 2HB ALA 24 2HB ALA 24 16.886 0.359 -1.916
199 3HB ALA 24 3HB ALA 24 15.748 -0.555 -2.906
200 H GLY 25 H GLY 25 16.638 0.383 0.924
201 1HA GLY 25 2HA GLY 25 19.060 -0.894 1.706
202 2HA GLY 25 1HA GLY 25 18.219 0.373 2.598
203 H ALA 26 H ALA 26 15.724 -1.282 2.537
204 HA ALA 26 HA ALA 26 16.184 -2.690 4.981
205 1HB ALA 26 1HB ALA 26 13.711 -3.300 4.663
206 2HB ALA 26 2HB ALA 26 13.748 -2.185 3.296
207 3HB ALA 26 3HB ALA 26 14.118 -1.605 4.920
208 H GLY 27 H GLY 27 16.372 -3.472 1.679
209 1HA GLY 27 2HA GLY 27 17.271 -5.495 0.891
210 2HA GLY 27 1HA GLY 27 16.754 -6.277 2.373
211 H LEU 28 H LEU 28 14.478 -4.336 0.510
212 HA LEU 28 HA LEU 28 13.291 -6.836 -0.439
213 1HB LEU 28 2HB LEU 28 11.515 -4.585 0.321
214 2HB LEU 28 1HB LEU 28 11.194 -6.309 0.315
215 HG LEU 28 HG LEU 28 13.061 -6.214 2.223
216 1HD1 LEU 28 1HD1 LEU 28 12.110 -3.501 1.944
217 2HD1 LEU 28 2HD1 LEU 28 13.576 -4.121 2.672
218 3HD1 LEU 28 3HD1 LEU 28 12.069 -4.126 3.586
219 1HD2 LEU 28 1HD2 LEU 28 10.431 -6.821 2.087
220 2HD2 LEU 28 2HD2 LEU 28 10.413 -5.484 3.238
221 3HD2 LEU 28 3HD2 LEU 28 11.397 -6.911 3.560
222 H THR 29 H THR 29 11.739 -6.633 -2.193
223 HA THR 29 HA THR 29 12.788 -4.966 -4.287
224 HB THR 29 HB THR 29 10.406 -6.836 -4.247
225 HG1 THR 29 1HG THR 29 12.035 -8.019 -5.631
226 1HG2 THR 29 1HG2 THR 29 11.564 -6.466 -6.835
227 2HG2 THR 29 2HG2 THR 29 11.034 -4.915 -6.185
228 3HG2 THR 29 3HG2 THR 29 9.892 -6.253 -6.318
229 H CYS 30 H CYS 30 12.236 -2.918 -4.568
230 HA CYS 30 HA CYS 30 9.590 -2.052 -3.625
231 1HB CYS 30 2HB CYS 30 10.722 0.267 -3.691
232 2HB CYS 30 1HB CYS 30 11.141 -0.837 -2.387
233 HG CYS 30 HG CYS 30 13.159 -1.148 -4.559
234 H THR 31 H THR 31 8.178 -1.924 -5.239
235 HA THR 31 HA THR 31 8.999 -0.445 -7.642
236 HB THR 31 HB THR 31 8.784 -3.010 -7.983
237 HG1 THR 31 1HG THR 31 8.660 -1.259 -9.626
238 1HG2 THR 31 1HG2 THR 31 6.896 -3.903 -7.289
239 2HG2 THR 31 2HG2 THR 31 6.214 -3.261 -8.772
240 3HG2 THR 31 3HG2 THR 31 6.030 -2.381 -7.258
241 H THR 32 H THR 32 7.515 1.076 -8.347
242 HA THR 32 HA THR 32 5.087 1.293 -6.722
243 HB THR 32 HB THR 32 5.201 3.718 -7.063
244 HG1 THR 32 1HG THR 32 6.441 3.561 -9.049
245 1HG2 THR 32 1HG2 THR 32 6.694 2.284 -5.311
246 2HG2 THR 32 2HG2 THR 32 6.554 4.043 -5.326
247 3HG2 THR 32 3HG2 THR 32 7.920 3.259 -6.115
248 H PHE 33 H PHE 33 3.266 2.390 -7.659
249 HA PHE 33 HA PHE 33 3.060 2.181 -10.576
250 1HB PHE 33 2HB PHE 33 0.955 1.152 -8.688
251 2HB PHE 33 1HB PHE 33 0.962 1.046 -10.432
252 HD1 PHE 33 1HD PHE 33 3.175 0.095 -7.591
253 HD2 PHE 33 2HD PHE 33 1.483 -1.006 -11.324
254 HE1 PHE 33 1HE PHE 33 4.299 -2.079 -7.451
255 HE2 PHE 33 2HE PHE 33 2.588 -3.189 -11.193
256 HZ PHE 33 HZ PHE 33 3.993 -3.745 -9.258
257 H GLU 34 H GLU 34 0.820 3.106 -11.275
258 HA GLU 34 HA GLU 34 0.774 5.817 -10.604
259 1HB GLU 34 2HB GLU 34 -1.413 5.758 -11.933
260 2HB GLU 34 1HB GLU 34 0.037 5.181 -12.744
261 1HG GLU 34 2HG GLU 34 -0.848 3.192 -13.093
262 2HG GLU 34 1HG GLU 34 -1.284 3.021 -11.397
263 H ASN 35 H ASN 35 -2.450 4.615 -10.541
264 HA ASN 35 HA ASN 35 -2.842 5.726 -7.927
265 1HB ASN 35 2HB ASN 35 -4.698 4.747 -10.073
266 2HB ASN 35 1HB ASN 35 -5.288 5.104 -8.455
267 1HD2 ASN 35 1HD2 ASN 35 -5.215 7.230 -7.696
268 2HD2 ASN 35 2HD2 ASN 35 -5.113 8.569 -8.782
269 H GLY 36 H GLY 36 -4.162 2.822 -9.389
270 1HA GLY 36 2HA GLY 36 -3.163 1.138 -7.272
271 2HA GLY 36 1HA GLY 36 -4.893 1.413 -7.204
272 H ASN 37 H ASN 37 -5.427 1.451 -9.984
273 HA ASN 37 HA ASN 37 -5.886 -1.218 -10.495
274 1HB ASN 37 2HB ASN 37 -5.853 1.210 -12.222
275 2HB ASN 37 1HB ASN 37 -5.990 -0.373 -12.987
276 1HD2 ASN 37 1HD2 ASN 37 -7.595 -1.823 -11.509
277 2HD2 ASN 37 2HD2 ASN 37 -9.129 -1.075 -11.240
278 H GLU 38 H GLU 38 -3.053 0.670 -11.144
279 HA GLU 38 HA GLU 38 -1.795 -0.962 -13.027
280 1HB GLU 38 2HB GLU 38 -1.133 1.299 -11.488
281 2HB GLU 38 1HB GLU 38 0.116 0.110 -11.187
282 1HG GLU 38 2HG GLU 38 -0.616 0.462 -14.005
283 2HG GLU 38 1HG GLU 38 0.145 1.853 -13.238
284 H VAL 39 H VAL 39 -1.261 -0.964 -9.441
285 HA VAL 39 HA VAL 39 0.433 -3.174 -9.417
286 HB VAL 39 HB VAL 39 -1.581 -2.722 -7.227
287 1HG1 VAL 39 1HG1 VAL 39 1.191 -3.323 -6.554
288 2HG1 VAL 39 2HG1 VAL 39 0.424 -4.574 -7.530
289 3HG1 VAL 39 3HG1 VAL 39 -0.300 -4.082 -6.002
290 1HG2 VAL 39 1HG2 VAL 39 0.073 -0.731 -8.197
291 2HG2 VAL 39 2HG2 VAL 39 0.964 -1.396 -6.831
292 3HG2 VAL 39 3HG2 VAL 39 -0.676 -0.795 -6.604
293 H LEU 40 H LEU 40 -3.110 -3.108 -9.255
294 HA LEU 40 HA LEU 40 -3.571 -5.795 -8.758
295 1HB LEU 40 2HB LEU 40 -5.289 -4.325 -10.721
296 2HB LEU 40 1HB LEU 40 -5.758 -5.496 -9.506
297 HG LEU 40 HG LEU 40 -4.794 -2.718 -8.823
298 1HD1 LEU 40 1HD1 LEU 40 -7.351 -2.547 -8.299
299 2HD1 LEU 40 2HD1 LEU 40 -7.474 -3.731 -9.595
300 3HD1 LEU 40 3HD1 LEU 40 -6.726 -2.167 -9.894
301 1HD2 LEU 40 1HD2 LEU 40 -6.489 -3.623 -6.858
302 2HD2 LEU 40 2HD2 LEU 40 -4.722 -3.627 -6.781
303 3HD2 LEU 40 3HD2 LEU 40 -5.586 -5.074 -7.302
304 H ALA 41 H ALA 41 -3.176 -4.177 -11.896
305 HA ALA 41 HA ALA 41 -3.494 -6.399 -13.533
306 1HB ALA 41 1HB ALA 41 -2.483 -5.141 -15.263
307 2HB ALA 41 2HB ALA 41 -1.596 -4.144 -14.109
308 3HB ALA 41 3HB ALA 41 -3.348 -3.990 -14.248
309 H ALA 42 H ALA 42 -0.547 -5.044 -12.178
310 HA ALA 42 HA ALA 42 1.196 -7.025 -13.202
311 1HB ALA 42 1HB ALA 42 1.456 -4.621 -11.743
312 2HB ALA 42 2HB ALA 42 2.732 -5.586 -12.482
313 3HB ALA 42 3HB ALA 42 2.266 -5.878 -10.807
314 H LEU 43 H LEU 43 -0.809 -6.807 -10.380
315 HA LEU 43 HA LEU 43 0.460 -8.814 -8.847
316 1HB LEU 43 2HB LEU 43 -2.175 -7.431 -8.773
317 2HB LEU 43 1HB LEU 43 -1.951 -8.873 -7.799
318 HG LEU 43 HG LEU 43 0.077 -6.700 -7.596
319 1HD1 LEU 43 1HD1 LEU 43 -1.589 -6.039 -5.586
320 2HD1 LEU 43 2HD1 LEU 43 -2.755 -6.475 -6.834
321 3HD1 LEU 43 3HD1 LEU 43 -1.558 -5.223 -7.147
322 1HD2 LEU 43 1HD2 LEU 43 0.609 -8.625 -6.375
323 2HD2 LEU 43 2HD2 LEU 43 -1.053 -8.842 -5.821
324 3HD2 LEU 43 3HD2 LEU 43 -0.075 -7.517 -5.184
325 H ALA 44 H ALA 44 -1.808 -8.888 -11.440
326 HA ALA 44 HA ALA 44 -3.065 -11.326 -11.050
327 1HB ALA 44 1HB ALA 44 -3.608 -9.669 -12.827
328 2HB ALA 44 2HB ALA 44 -3.532 -11.335 -13.399
329 3HB ALA 44 3HB ALA 44 -2.193 -10.230 -13.718
330 H SER 45 H SER 45 0.230 -10.698 -11.792
331 HA SER 45 HA SER 45 0.662 -13.548 -12.249
332 1HB SER 45 2HB SER 45 1.077 -12.468 -14.343
333 2HB SER 45 1HB SER 45 2.052 -11.219 -13.568
334 HG SER 45 HG SER 45 3.654 -12.677 -13.217
335 H LYS 46 H LYS 46 1.144 -11.141 -10.064
336 HA LYS 46 HA LYS 46 3.244 -12.616 -8.769
337 1HB LYS 46 2HB LYS 46 3.991 -10.455 -10.348
338 2HB LYS 46 1HB LYS 46 3.948 -9.793 -8.719
339 1HG LYS 46 2HG LYS 46 5.270 -12.294 -8.588
340 2HG LYS 46 1HG LYS 46 5.950 -11.394 -9.945
341 1HD LYS 46 2HD LYS 46 5.818 -9.454 -8.056
342 2HD LYS 46 1HD LYS 46 6.116 -10.874 -7.053
343 1HE LYS 46 2HE LYS 46 7.785 -10.731 -9.454
344 2HE LYS 46 1HE LYS 46 8.036 -9.400 -8.327
345 1HZ LYS 46 1HZ LYS 46 9.513 -11.049 -7.645
346 2HZ LYS 46 2HZ LYS 46 8.388 -12.296 -7.851
347 3HZ LYS 46 3HZ LYS 46 8.218 -11.207 -6.568
348 H THR 47 H THR 47 3.528 -11.995 -6.536
349 HA THR 47 HA THR 47 1.478 -10.226 -5.478
350 HB THR 47 HB THR 47 1.932 -13.083 -4.622
351 HG1 THR 47 1HG THR 47 -0.444 -13.020 -5.023
352 1HG2 THR 47 1HG2 THR 47 0.215 -12.764 -2.939
353 2HG2 THR 47 2HG2 THR 47 0.133 -11.047 -3.328
354 3HG2 THR 47 3HG2 THR 47 1.603 -11.721 -2.625
355 HA PRO 48 HA PRO 48 5.230 -9.173 -3.210
356 1HB PRO 48 2HB PRO 48 4.407 -6.760 -2.324
357 2HB PRO 48 1HB PRO 48 4.978 -7.018 -3.975
358 1HG PRO 48 2HG PRO 48 2.199 -6.728 -2.953
359 2HG PRO 48 1HG PRO 48 2.897 -6.180 -4.485
360 1HD PRO 48 2HD PRO 48 1.337 -8.446 -4.161
361 2HD PRO 48 1HD PRO 48 2.433 -8.147 -5.519
362 H ASP 49 H ASP 49 5.730 -8.774 -0.924
363 HA ASP 49 HA ASP 49 3.950 -10.217 0.782
364 1HB ASP 49 2HB ASP 49 6.486 -8.703 1.425
365 2HB ASP 49 1HB ASP 49 5.617 -9.732 2.560
366 H VAL 50 H VAL 50 4.431 -6.866 0.050
367 HA VAL 50 HA VAL 50 2.282 -6.186 1.915
368 HB VAL 50 HB VAL 50 4.343 -5.764 3.147
369 1HG1 VAL 50 1HG1 VAL 50 6.083 -4.408 2.388
370 2HG1 VAL 50 2HG1 VAL 50 5.107 -3.722 1.093
371 3HG1 VAL 50 3HG1 VAL 50 5.657 -5.395 0.992
372 1HG2 VAL 50 1HG2 VAL 50 2.343 -4.231 3.324
373 2HG2 VAL 50 2HG2 VAL 50 3.227 -3.106 2.292
374 3HG2 VAL 50 3HG2 VAL 50 3.883 -3.564 3.865
375 H LEU 51 H LEU 51 1.503 -3.867 1.503
376 HA LEU 51 HA LEU 51 2.115 -2.808 -1.129
377 1HB LEU 51 2HB LEU 51 0.278 -4.680 -1.202
378 2HB LEU 51 1HB LEU 51 -0.765 -3.409 -0.598
379 HG LEU 51 HG LEU 51 -0.317 -2.051 -2.570
380 1HD1 LEU 51 1HD1 LEU 51 1.769 -4.089 -3.007
381 2HD1 LEU 51 2HD1 LEU 51 1.749 -2.374 -3.419
382 3HD1 LEU 51 3HD1 LEU 51 0.907 -3.539 -4.442
383 1HD2 LEU 51 1HD2 LEU 51 -2.099 -3.157 -3.327
384 2HD2 LEU 51 2HD2 LEU 51 -1.541 -4.678 -2.630
385 3HD2 LEU 51 3HD2 LEU 51 -0.977 -4.179 -4.222
386 H LEU 52 H LEU 52 1.958 -0.664 -1.173
387 HA LEU 52 HA LEU 52 0.518 0.703 1.012
388 1HB LEU 52 2HB LEU 52 3.198 0.872 0.294
389 2HB LEU 52 1HB LEU 52 2.490 2.293 -0.440
390 HG LEU 52 HG LEU 52 2.106 1.665 2.474
391 1HD1 LEU 52 1HD1 LEU 52 4.399 1.809 2.455
392 2HD1 LEU 52 2HD1 LEU 52 3.950 3.503 2.658
393 3HD1 LEU 52 3HD1 LEU 52 4.427 2.900 1.070
394 1HD2 LEU 52 1HD2 LEU 52 2.175 4.393 2.081
395 2HD2 LEU 52 2HD2 LEU 52 0.723 3.412 2.261
396 3HD2 LEU 52 3HD2 LEU 52 1.328 3.801 0.652
397 H SER 53 H SER 53 -1.144 2.020 0.428
398 HA SER 53 HA SER 53 -1.456 2.608 -2.439
399 1HB SER 53 2HB SER 53 -3.441 2.296 -0.200
400 2HB SER 53 1HB SER 53 -3.878 3.117 -1.699
401 HG SER 53 HG SER 53 -3.125 0.430 -1.302
402 H ASP 54 H ASP 54 -1.529 4.654 -3.187
403 HA ASP 54 HA ASP 54 -0.691 6.776 -1.479
404 1HB ASP 54 2HB ASP 54 -0.863 8.187 -3.492
405 2HB ASP 54 1HB ASP 54 0.042 6.706 -3.784
406 H ILE 55 H ILE 55 -3.745 5.728 -2.728
407 HA ILE 55 HA ILE 55 -5.876 6.505 -2.526
408 HB ILE 55 HB ILE 55 -5.309 5.784 -0.240
409 1HG1 ILE 55 2HG1 ILE 55 -7.586 6.750 -0.907
410 2HG1 ILE 55 1HG1 ILE 55 -7.240 6.572 0.797
411 1HG2 ILE 55 1HG2 ILE 55 -3.647 7.126 0.586
412 2HG2 ILE 55 2HG2 ILE 55 -5.068 7.704 1.452
413 3HG2 ILE 55 3HG2 ILE 55 -4.448 8.615 0.086
414 1HD1 ILE 55 1HD1 ILE 55 -7.550 8.726 1.154
415 2HD1 ILE 55 2HD1 ILE 55 -8.149 8.842 -0.500
416 3HD1 ILE 55 3HD1 ILE 55 -6.453 9.171 -0.151
417 H ARG 56 H ARG 56 -6.163 8.084 -4.063
418 HA ARG 56 HA ARG 56 -6.319 10.802 -3.104
419 1HB ARG 56 2HB ARG 56 -3.924 10.458 -3.858
420 2HB ARG 56 1HB ARG 56 -4.552 10.277 -5.489
421 1HG ARG 56 2HG ARG 56 -3.781 12.524 -5.190
422 2HG ARG 56 1HG ARG 56 -5.540 12.539 -5.318
423 1HD ARG 56 2HD ARG 56 -5.709 12.679 -2.879
424 2HD ARG 56 1HD ARG 56 -3.952 12.664 -2.755
425 HE ARG 56 HE ARG 56 -3.893 14.859 -3.503
426 1HH1 ARG 56 1HH1 ARG 56 -7.159 13.621 -3.622
427 2HH1 ARG 56 2HH1 ARG 56 -7.873 15.187 -3.809
428 1HH2 ARG 56 1HH2 ARG 56 -4.835 16.909 -3.756
429 2HH2 ARG 56 2HH2 ARG 56 -6.555 17.051 -3.888
430 H MET 57 H MET 57 -8.485 9.535 -3.754
431 HA MET 57 HA MET 57 -10.371 9.584 -5.006
432 1HB MET 57 2HB MET 57 -9.494 12.071 -5.071
433 2HB MET 57 1HB MET 57 -9.295 11.714 -6.781
434 1HG MET 57 2HG MET 57 -11.414 12.425 -6.917
435 2HG MET 57 1HG MET 57 -11.788 10.785 -6.395
436 1HE MET 57 1HE MET 57 -13.929 13.930 -4.626
437 2HE MET 57 2HE MET 57 -13.974 12.909 -6.062
438 3HE MET 57 3HE MET 57 -12.816 14.234 -5.958
439 HA PRO 58 HA PRO 58 -8.164 7.562 -8.711
440 1HB PRO 58 2HB PRO 58 -8.316 4.966 -7.891
441 2HB PRO 58 1HB PRO 58 -6.913 5.998 -7.592
442 1HG PRO 58 2HG PRO 58 -9.124 5.222 -5.746
443 2HG PRO 58 1HG PRO 58 -7.400 5.446 -5.410
444 1HD PRO 58 2HD PRO 58 -9.333 7.286 -4.815
445 2HD PRO 58 1HD PRO 58 -7.636 7.693 -5.099
446 H GLY 59 H GLY 59 -10.348 5.330 -7.029
447 1HA GLY 59 2HA GLY 59 -12.316 5.736 -9.190
448 2HA GLY 59 1HA GLY 59 -11.985 4.167 -8.472
449 H MET 60 H MET 60 -11.750 5.610 -5.797
450 HA MET 60 HA MET 60 -14.386 6.586 -5.244
451 1HB MET 60 2HB MET 60 -14.382 3.935 -5.294
452 2HB MET 60 1HB MET 60 -13.698 4.134 -3.687
453 1HG MET 60 2HG MET 60 -15.658 4.703 -2.803
454 2HG MET 60 1HG MET 60 -16.044 5.795 -4.131
455 1HE MET 60 1HE MET 60 -18.055 5.679 -4.595
456 2HE MET 60 2HE MET 60 -19.144 4.336 -4.246
457 3HE MET 60 3HE MET 60 -18.561 4.595 -5.891
458 H ASP 61 H ASP 61 -12.603 8.184 -4.793
459 HA ASP 61 HA ASP 61 -11.661 9.558 -3.248
460 1HB ASP 61 2HB ASP 61 -13.356 7.879 -1.706
461 2HB ASP 61 1HB ASP 61 -11.851 8.083 -0.818
462 H GLY 62 H GLY 62 -10.865 6.164 -3.156
463 1HA GLY 62 2HA GLY 62 -8.330 5.997 -3.662
464 2HA GLY 62 1HA GLY 62 -8.213 6.749 -2.091
465 H LEU 63 H LEU 63 -10.687 5.308 -1.278
466 HA LEU 63 HA LEU 63 -9.401 2.994 -0.226
467 1HB LEU 63 2HB LEU 63 -12.331 3.670 -0.147
468 2HB LEU 63 1HB LEU 63 -11.461 2.591 0.930
469 HG LEU 63 HG LEU 63 -10.101 4.834 1.428
470 1HD1 LEU 63 1HD1 LEU 63 -12.541 5.693 0.060
471 2HD1 LEU 63 2HD1 LEU 63 -11.036 6.562 0.360
472 3HD1 LEU 63 3HD1 LEU 63 -12.267 6.470 1.618
473 1HD2 LEU 63 1HD2 LEU 63 -11.583 5.153 3.368
474 2HD2 LEU 63 2HD2 LEU 63 -11.181 3.462 3.090
475 3HD2 LEU 63 3HD2 LEU 63 -12.760 4.075 2.620
476 H ALA 64 H ALA 64 -11.330 3.762 -2.986
477 HA ALA 64 HA ALA 64 -12.508 1.323 -3.624
478 1HB ALA 64 1HB ALA 64 -11.459 2.538 -6.001
479 2HB ALA 64 2HB ALA 64 -12.061 3.786 -4.912
480 3HB ALA 64 3HB ALA 64 -13.124 2.476 -5.426
481 H LEU 65 H LEU 65 -9.192 2.359 -3.820
482 HA LEU 65 HA LEU 65 -8.150 0.441 -5.562
483 1HB LEU 65 2HB LEU 65 -6.672 1.425 -3.144
484 2HB LEU 65 1HB LEU 65 -6.021 0.982 -4.709
485 HG LEU 65 HG LEU 65 -7.806 3.376 -4.327
486 1HD1 LEU 65 1HD1 LEU 65 -5.140 4.190 -4.722
487 2HD1 LEU 65 2HD1 LEU 65 -5.132 3.028 -3.396
488 3HD1 LEU 65 3HD1 LEU 65 -6.163 4.455 -3.310
489 1HD2 LEU 65 1HD2 LEU 65 -6.759 2.056 -6.588
490 2HD2 LEU 65 2HD2 LEU 65 -5.883 3.576 -6.426
491 3HD2 LEU 65 3HD2 LEU 65 -7.643 3.578 -6.527
492 H LEU 66 H LEU 66 -8.777 0.361 -2.113
493 HA LEU 66 HA LEU 66 -7.599 -2.136 -1.561
494 1HB LEU 66 2HB LEU 66 -9.929 -0.811 -0.174
495 2HB LEU 66 1HB LEU 66 -8.911 -2.076 0.495
496 HG LEU 66 HG LEU 66 -7.828 0.611 -0.329
497 1HD1 LEU 66 1HD1 LEU 66 -7.992 1.344 1.926
498 2HD1 LEU 66 2HD1 LEU 66 -8.623 -0.213 2.452
499 3HD1 LEU 66 3HD1 LEU 66 -9.596 0.827 1.414
500 1HD2 LEU 66 1HD2 LEU 66 -6.482 -1.656 0.151
501 2HD2 LEU 66 2HD2 LEU 66 -6.607 -1.033 1.795
502 3HD2 LEU 66 3HD2 LEU 66 -5.853 -0.055 0.537
503 H LYS 67 H LYS 67 -10.872 -1.195 -2.514
504 HA LYS 67 HA LYS 67 -12.189 -3.625 -2.264
505 1HB LYS 67 2HB LYS 67 -12.527 -1.513 -4.399
506 2HB LYS 67 1HB LYS 67 -13.657 -2.828 -4.113
507 1HG LYS 67 2HG LYS 67 -13.724 -1.882 -1.690
508 2HG LYS 67 1HG LYS 67 -13.100 -0.417 -2.453
509 1HD LYS 67 2HD LYS 67 -15.003 -0.158 -3.787
510 2HD LYS 67 1HD LYS 67 -15.503 -1.835 -3.556
511 1HE LYS 67 2HE LYS 67 -15.337 -0.435 -1.034
512 2HE LYS 67 1HE LYS 67 -16.404 0.404 -2.159
513 1HZ LYS 67 1HZ LYS 67 -16.602 -2.479 -1.479
514 2HZ LYS 67 2HZ LYS 67 -17.668 -1.599 -2.455
515 3HZ LYS 67 3HZ LYS 67 -17.561 -1.262 -0.801
516 H GLN 68 H GLN 68 -10.186 -2.415 -4.916
517 HA GLN 68 HA GLN 68 -10.565 -4.661 -6.597
518 1HB GLN 68 2HB GLN 68 -8.398 -2.559 -6.553
519 2HB GLN 68 1HB GLN 68 -8.625 -3.742 -7.833
520 1HG GLN 68 2HG GLN 68 -10.063 -2.423 -8.837
521 2HG GLN 68 1HG GLN 68 -11.087 -2.434 -7.393
522 1HE2 GLN 68 1HE2 GLN 68 -7.845 -1.086 -7.707
523 2HE2 GLN 68 2HE2 GLN 68 -8.303 0.554 -7.435
524 H ILE 69 H ILE 69 -8.002 -3.682 -4.353
525 HA ILE 69 HA ILE 69 -6.190 -5.727 -4.830
526 HB ILE 69 HB ILE 69 -6.763 -4.301 -2.234
527 1HG1 ILE 69 2HG1 ILE 69 -4.427 -3.722 -4.010
528 2HG1 ILE 69 1HG1 ILE 69 -6.007 -3.087 -4.466
529 1HG2 ILE 69 1HG2 ILE 69 -4.219 -4.927 -1.945
530 2HG2 ILE 69 2HG2 ILE 69 -4.662 -6.260 -3.010
531 3HG2 ILE 69 3HG2 ILE 69 -5.497 -6.047 -1.471
532 1HD1 ILE 69 1HD1 ILE 69 -5.256 -2.630 -1.667
533 2HD1 ILE 69 2HD1 ILE 69 -5.978 -1.539 -2.848
534 3HD1 ILE 69 3HD1 ILE 69 -4.237 -1.822 -2.858
535 H LYS 70 H LYS 70 -9.028 -5.666 -2.801
536 HA LYS 70 HA LYS 70 -8.546 -8.205 -1.610
537 1HB LYS 70 2HB LYS 70 -10.732 -7.983 -0.631
538 2HB LYS 70 1HB LYS 70 -9.922 -6.426 -0.550
539 1HG LYS 70 2HG LYS 70 -11.695 -5.518 -1.513
540 2HG LYS 70 1HG LYS 70 -11.300 -6.423 -2.972
541 1HD LYS 70 2HD LYS 70 -13.411 -7.196 -2.662
542 2HD LYS 70 1HD LYS 70 -12.553 -8.356 -1.646
543 1HE LYS 70 2HE LYS 70 -13.951 -7.729 -0.021
544 2HE LYS 70 1HE LYS 70 -12.997 -6.249 0.059
545 1HZ LYS 70 1HZ LYS 70 -15.583 -6.707 -1.282
546 2HZ LYS 70 2HZ LYS 70 -14.577 -5.441 -1.774
547 3HZ LYS 70 3HZ LYS 70 -15.158 -5.490 -0.186
548 H GLN 71 H GLN 71 -10.112 -7.084 -4.486
549 HA GLN 71 HA GLN 71 -11.617 -9.438 -4.979
550 1HB GLN 71 2HB GLN 71 -12.501 -7.643 -6.119
551 2HB GLN 71 1HB GLN 71 -10.926 -6.986 -6.524
552 1HG GLN 71 2HG GLN 71 -11.369 -9.528 -7.828
553 2HG GLN 71 1HG GLN 71 -12.653 -8.381 -8.191
554 1HE2 GLN 71 1HE2 GLN 71 -9.359 -7.451 -7.462
555 2HE2 GLN 71 2HE2 GLN 71 -8.975 -6.867 -9.043
556 H ARG 72 H ARG 72 -8.388 -8.392 -5.699
557 HA ARG 72 HA ARG 72 -7.894 -10.691 -7.408
558 1HB ARG 72 2HB ARG 72 -6.213 -8.314 -6.652
559 2HB ARG 72 1HB ARG 72 -5.562 -9.675 -7.562
560 1HG ARG 72 2HG ARG 72 -7.903 -8.960 -8.895
561 2HG ARG 72 1HG ARG 72 -7.129 -7.434 -8.464
562 1HD ARG 72 2HD ARG 72 -5.344 -7.799 -9.815
563 2HD ARG 72 1HD ARG 72 -5.380 -9.544 -9.579
564 HE ARG 72 HE ARG 72 -7.045 -8.020 -11.461
565 1HH1 ARG 72 1HH1 ARG 72 -5.791 -11.086 -10.332
566 2HH1 ARG 72 2HH1 ARG 72 -6.383 -11.964 -11.699
567 1HH2 ARG 72 1HH2 ARG 72 -7.823 -9.185 -13.245
568 2HH2 ARG 72 2HH2 ARG 72 -7.533 -10.888 -13.350
569 H HIS 73 H HIS 73 -6.188 -9.290 -4.650
570 HA HIS 73 HA HIS 73 -5.663 -12.006 -3.671
571 1HB HIS 73 2HB HIS 73 -3.504 -11.016 -2.714
572 2HB HIS 73 1HB HIS 73 -3.550 -11.317 -4.448
573 HD1 HIS 73 1HD HIS 73 -1.947 -9.104 -2.544
574 HD2 HIS 73 2HD HIS 73 -4.815 -8.504 -5.476
575 HE1 HIS 73 1HE HIS 73 -1.644 -6.729 -3.304
576 HE2 HIS 73 2HE HIS 73 -3.512 -6.341 -4.942
577 HA PRO 74 HA PRO 74 -7.829 -9.535 -0.391
578 1HB PRO 74 2HB PRO 74 -9.496 -11.539 0.382
579 2HB PRO 74 1HB PRO 74 -9.872 -10.432 -0.940
580 1HG PRO 74 2HG PRO 74 -8.782 -13.217 -1.053
581 2HG PRO 74 1HG PRO 74 -10.028 -12.460 -2.063
582 1HD PRO 74 2HD PRO 74 -7.463 -12.765 -2.886
583 2HD PRO 74 1HD PRO 74 -8.481 -11.407 -3.404
584 H MET 75 H MET 75 -5.356 -10.213 0.156
585 HA MET 75 HA MET 75 -5.534 -11.383 2.776
586 1HB MET 75 2HB MET 75 -3.876 -12.712 0.638
587 2HB MET 75 1HB MET 75 -3.729 -13.053 2.357
588 1HG MET 75 2HG MET 75 -6.260 -13.565 2.220
589 2HG MET 75 1HG MET 75 -5.964 -13.701 0.487
590 1HE MET 75 1HE MET 75 -6.825 -16.360 0.606
591 2HE MET 75 2HE MET 75 -7.171 -15.950 2.286
592 3HE MET 75 3HE MET 75 -6.261 -17.411 1.905
593 H LEU 76 H LEU 76 -3.572 -9.994 0.240
594 HA LEU 76 HA LEU 76 -1.258 -9.457 1.725
595 1HB LEU 76 2HB LEU 76 -2.177 -8.995 -0.861
596 2HB LEU 76 1HB LEU 76 -1.826 -7.399 -0.229
597 HG LEU 76 HG LEU 76 0.452 -8.393 0.454
598 1HD1 LEU 76 1HD1 LEU 76 0.742 -10.179 -1.647
599 2HD1 LEU 76 2HD1 LEU 76 -0.767 -10.646 -0.869
600 3HD1 LEU 76 3HD1 LEU 76 0.722 -10.560 0.073
601 1HD2 LEU 76 1HD2 LEU 76 -0.374 -6.937 -1.662
602 2HD2 LEU 76 2HD2 LEU 76 0.339 -8.326 -2.479
603 3HD2 LEU 76 3HD2 LEU 76 1.306 -7.372 -1.356
604 HA PRO 77 HA PRO 77 -2.546 -6.045 4.248
605 1HB PRO 77 2HB PRO 77 -0.160 -5.191 5.111
606 2HB PRO 77 1HB PRO 77 -0.816 -6.754 5.599
607 1HG PRO 77 2HG PRO 77 1.282 -6.132 3.579
608 2HG PRO 77 1HG PRO 77 1.185 -7.487 4.715
609 1HD PRO 77 2HD PRO 77 0.489 -7.586 2.029
610 2HD PRO 77 1HD PRO 77 -0.030 -8.747 3.264
611 H VAL 78 H VAL 78 -3.363 -4.270 3.345
612 HA VAL 78 HA VAL 78 -1.712 -2.640 1.566
613 HB VAL 78 HB VAL 78 -4.625 -2.154 2.124
614 1HG1 VAL 78 1HG1 VAL 78 -2.691 -1.427 -0.045
615 2HG1 VAL 78 2HG1 VAL 78 -3.730 -0.378 0.920
616 3HG1 VAL 78 3HG1 VAL 78 -4.432 -1.404 -0.332
617 1HG2 VAL 78 1HG2 VAL 78 -3.473 -4.090 0.113
618 2HG2 VAL 78 2HG2 VAL 78 -5.154 -3.552 0.155
619 3HG2 VAL 78 3HG2 VAL 78 -4.493 -4.488 1.495
620 H ILE 79 H ILE 79 -1.168 -0.557 2.021
621 HA ILE 79 HA ILE 79 -2.004 0.505 4.641
622 HB ILE 79 HB ILE 79 0.675 0.989 3.341
623 1HG1 ILE 79 2HG1 ILE 79 0.923 -0.499 5.754
624 2HG1 ILE 79 1HG1 ILE 79 -0.247 -1.332 4.738
625 1HG2 ILE 79 1HG2 ILE 79 0.422 1.350 6.210
626 2HG2 ILE 79 2HG2 ILE 79 -0.628 2.423 5.286
627 3HG2 ILE 79 3HG2 ILE 79 1.112 2.421 4.993
628 1HD1 ILE 79 1HD1 ILE 79 2.639 -0.782 4.239
629 2HD1 ILE 79 2HD1 ILE 79 1.540 -1.041 2.886
630 3HD1 ILE 79 3HD1 ILE 79 1.743 -2.296 4.107
631 H ILE 80 H ILE 80 -3.316 2.174 4.312
632 HA ILE 80 HA ILE 80 -2.946 3.840 1.936
633 HB ILE 80 HB ILE 80 -5.275 3.978 3.847
634 1HG1 ILE 80 2HG1 ILE 80 -6.401 2.584 1.970
635 2HG1 ILE 80 1HG1 ILE 80 -4.760 2.129 1.523
636 1HG2 ILE 80 1HG2 ILE 80 -5.879 5.660 2.543
637 2HG2 ILE 80 2HG2 ILE 80 -5.990 4.539 1.187
638 3HG2 ILE 80 3HG2 ILE 80 -4.484 5.404 1.500
639 1HD1 ILE 80 1HD1 ILE 80 -5.387 1.818 4.362
640 2HD1 ILE 80 2HD1 ILE 80 -4.549 0.733 3.254
641 3HD1 ILE 80 3HD1 ILE 80 -6.312 0.783 3.276
642 H MET 81 H MET 81 -2.361 5.909 1.991
643 HA MET 81 HA MET 81 -1.321 6.977 4.473
644 1HB MET 81 2HB MET 81 -0.305 8.675 3.065
645 2HB MET 81 1HB MET 81 0.005 7.064 2.429
646 1HG MET 81 2HG MET 81 -1.235 7.406 0.567
647 2HG MET 81 1HG MET 81 -2.363 8.485 1.384
648 1HE MET 81 1HE MET 81 -1.516 10.536 2.501
649 2HE MET 81 2HE MET 81 -0.972 11.816 1.418
650 3HE MET 81 3HE MET 81 0.192 10.963 2.432
651 H THR 82 H THR 82 -4.272 7.268 2.859
652 HA THR 82 HA THR 82 -4.989 9.578 4.481
653 HB THR 82 HB THR 82 -5.482 9.595 1.505
654 HG1 THR 82 1HG THR 82 -3.798 10.974 1.343
655 1HG2 THR 82 1HG2 THR 82 -7.075 11.021 2.270
656 2HG2 THR 82 2HG2 THR 82 -5.706 12.124 2.150
657 3HG2 THR 82 3HG2 THR 82 -6.159 11.449 3.715
658 H ALA 83 H ALA 83 -7.065 9.539 5.180
659 HA ALA 83 HA ALA 83 -8.826 7.504 3.982
660 1HB ALA 83 1HB ALA 83 -9.327 8.108 6.802
661 2HB ALA 83 2HB ALA 83 -7.771 7.340 6.486
662 3HB ALA 83 3HB ALA 83 -9.261 6.558 5.961
663 H HIS 84 H HIS 84 -9.708 9.194 2.668
664 HA HIS 84 HA HIS 84 -10.913 11.518 3.760
665 1HB HIS 84 2HB HIS 84 -11.197 10.085 1.124
666 2HB HIS 84 1HB HIS 84 -12.166 11.504 1.504
667 HD1 HIS 84 1HD HIS 84 -9.136 12.201 3.105
668 HD2 HIS 84 2HD HIS 84 -10.314 12.165 -0.879
669 HE1 HIS 84 1HE HIS 84 -7.456 13.621 1.896
670 HE2 HIS 84 2HE HIS 84 -8.133 13.511 -0.529
671 H SER 85 H SER 85 -13.495 11.588 2.710
672 HA SER 85 HA SER 85 -14.890 10.105 4.739
673 1HB SER 85 2HB SER 85 -15.326 12.527 3.622
674 2HB SER 85 1HB SER 85 -16.463 11.550 2.692
675 HG SER 85 HG SER 85 -16.327 11.441 5.511
676 H ASP 86 H ASP 86 -14.446 7.961 3.980
677 HA ASP 86 HA ASP 86 -16.592 6.783 2.633
678 1HB ASP 86 2HB ASP 86 -15.510 7.819 0.640
679 2HB ASP 86 1HB ASP 86 -14.074 6.852 0.960
680 H LEU 87 H LEU 87 -14.801 6.513 4.948
681 HA LEU 87 HA LEU 87 -12.989 4.497 4.945
682 1HB LEU 87 2HB LEU 87 -14.513 5.860 6.856
683 2HB LEU 87 1HB LEU 87 -14.773 4.160 7.188
684 HG LEU 87 HG LEU 87 -12.919 5.142 8.496
685 1HD1 LEU 87 1HD1 LEU 87 -11.363 3.302 6.904
686 2HD1 LEU 87 2HD1 LEU 87 -13.004 2.710 7.155
687 3HD1 LEU 87 3HD1 LEU 87 -11.993 3.125 8.541
688 1HD2 LEU 87 1HD2 LEU 87 -11.609 6.613 7.452
689 2HD2 LEU 87 2HD2 LEU 87 -12.104 6.047 5.858
690 3HD2 LEU 87 3HD2 LEU 87 -10.806 5.223 6.722
691 H ASP 88 H ASP 88 -16.365 4.157 4.344
692 HA ASP 88 HA ASP 88 -16.968 1.603 5.096
693 1HB ASP 88 2HB ASP 88 -17.789 3.230 2.713
694 2HB ASP 88 1HB ASP 88 -18.369 1.576 2.903
695 H ALA 89 H ALA 89 -15.234 2.562 2.141
696 HA ALA 89 HA ALA 89 -15.021 -0.107 1.178
697 1HB ALA 89 1HB ALA 89 -13.838 0.759 -0.625
698 2HB ALA 89 2HB ALA 89 -13.223 2.110 0.316
699 3HB ALA 89 3HB ALA 89 -14.914 2.076 -0.165
700 H ALA 90 H ALA 90 -13.219 1.776 3.422
701 HA ALA 90 HA ALA 90 -10.732 0.412 3.197
702 1HB ALA 90 1HB ALA 90 -10.795 2.567 4.280
703 2HB ALA 90 2HB ALA 90 -10.250 1.361 5.438
704 3HB ALA 90 3HB ALA 90 -11.906 1.964 5.504
705 H VAL 91 H VAL 91 -13.634 -0.045 5.147
706 HA VAL 91 HA VAL 91 -12.709 -1.969 6.899
707 HB VAL 91 HB VAL 91 -15.465 -2.239 5.776
708 1HG1 VAL 91 1HG1 VAL 91 -13.989 -2.947 8.228
709 2HG1 VAL 91 2HG1 VAL 91 -15.336 -3.768 7.432
710 3HG1 VAL 91 3HG1 VAL 91 -15.643 -2.375 8.468
711 1HG2 VAL 91 1HG2 VAL 91 -14.418 -0.003 7.498
712 2HG2 VAL 91 2HG2 VAL 91 -16.112 -0.488 7.519
713 3HG2 VAL 91 3HG2 VAL 91 -15.384 0.105 6.026
714 H SER 92 H SER 92 -13.857 -2.374 3.582
715 HA SER 92 HA SER 92 -13.838 -5.194 3.579
716 1HB SER 92 2HB SER 92 -13.881 -5.042 1.170
717 2HB SER 92 1HB SER 92 -14.915 -3.772 1.821
718 HG SER 92 HG SER 92 -12.375 -3.558 0.624
719 H ALA 93 H ALA 93 -11.361 -2.861 3.599
720 HA ALA 93 HA ALA 93 -9.313 -4.434 2.409
721 1HB ALA 93 1HB ALA 93 -8.643 -2.228 4.254
722 2HB ALA 93 2HB ALA 93 -9.560 -1.828 2.800
723 3HB ALA 93 3HB ALA 93 -7.987 -2.612 2.661
724 H TYR 94 H TYR 94 -9.950 -3.393 5.717
725 HA TYR 94 HA TYR 94 -7.938 -4.854 6.963
726 1HB TYR 94 2HB TYR 94 -10.566 -4.462 8.346
727 2HB TYR 94 1HB TYR 94 -8.940 -4.357 9.005
728 HD1 TYR 94 1HD TYR 94 -7.513 -2.417 7.629
729 HD2 TYR 94 2HD TYR 94 -11.706 -2.480 8.362
730 HE1 TYR 94 1HE TYR 94 -7.585 0.028 7.395
731 HE2 TYR 94 2HE TYR 94 -11.787 -0.032 8.123
732 HH TYR 94 HH TYR 94 -9.838 1.919 8.468
733 H GLN 95 H GLN 95 -11.118 -5.808 5.942
734 HA GLN 95 HA GLN 95 -11.077 -8.327 7.309
735 1HB GLN 95 2HB GLN 95 -13.117 -8.831 6.105
736 2HB GLN 95 1HB GLN 95 -13.177 -7.191 6.734
737 1HG GLN 95 2HG GLN 95 -14.015 -6.889 4.639
738 2HG GLN 95 1HG GLN 95 -12.310 -6.549 4.383
739 1HE2 GLN 95 1HE2 GLN 95 -13.320 -7.043 2.138
740 2HE2 GLN 95 2HE2 GLN 95 -13.131 -8.674 1.599
741 H GLN 96 H GLN 96 -10.016 -7.180 4.190
742 HA GLN 96 HA GLN 96 -9.623 -9.864 3.203
743 1HB GLN 96 2HB GLN 96 -8.919 -8.900 1.136
744 2HB GLN 96 1HB GLN 96 -10.342 -8.015 1.675
745 1HG GLN 96 2HG GLN 96 -9.125 -6.201 1.211
746 2HG GLN 96 1HG GLN 96 -8.347 -6.531 2.752
747 1HE2 GLN 96 1HE2 GLN 96 -6.235 -6.929 2.793
748 2HE2 GLN 96 2HE2 GLN 96 -5.239 -7.164 1.399
749 H GLY 97 H GLY 97 -7.946 -7.762 5.202
750 1HA GLY 97 2HA GLY 97 -5.932 -8.836 6.181
751 2HA GLY 97 1HA GLY 97 -5.400 -9.101 4.530
752 H ALA 98 H ALA 98 -6.877 -6.086 4.757
753 HA ALA 98 HA ALA 98 -4.586 -4.651 4.143
754 1HB ALA 98 1HB ALA 98 -6.875 -3.848 3.748
755 2HB ALA 98 2HB ALA 98 -5.865 -2.646 4.546
756 3HB ALA 98 3HB ALA 98 -7.053 -3.558 5.477
757 H PHE 99 H PHE 99 -3.421 -3.007 5.385
758 HA PHE 99 HA PHE 99 -2.795 -3.989 8.023
759 1HB PHE 99 2HB PHE 99 -1.065 -3.251 6.285
760 2HB PHE 99 1HB PHE 99 -1.523 -1.601 6.701
761 HD1 PHE 99 1HD PHE 99 -1.123 -4.580 8.890
762 HD2 PHE 99 2HD PHE 99 0.319 -0.722 7.813
763 HE1 PHE 99 1HE PHE 99 0.434 -4.637 10.792
764 HE2 PHE 99 2HE PHE 99 1.886 -0.774 9.712
765 HZ PHE 99 HZ PHE 99 1.943 -2.733 11.206
766 H ASP 100 H ASP 100 -3.709 -0.810 6.644
767 HA ASP 100 HA ASP 100 -5.628 -0.127 8.482
768 1HB ASP 100 2HB ASP 100 -3.079 -0.159 9.747
769 2HB ASP 100 1HB ASP 100 -3.579 1.523 9.622
770 H TYR 101 H TYR 101 -5.083 2.558 9.045
771 HA TYR 101 HA TYR 101 -4.658 3.741 6.390
772 1HB TYR 101 2HB TYR 101 -7.119 3.666 7.978
773 2HB TYR 101 1HB TYR 101 -6.668 5.288 7.459
774 HD1 TYR 101 1HD TYR 101 -7.445 1.866 6.246
775 HD2 TYR 101 2HD TYR 101 -6.939 5.975 5.236
776 HE1 TYR 101 1HE TYR 101 -8.400 1.441 4.010
777 HE2 TYR 101 2HE TYR 101 -7.880 5.558 3.008
778 HH TYR 101 HH TYR 101 -8.087 3.475 1.456
779 H LEU 102 H LEU 102 -4.082 5.956 6.382
780 HA LEU 102 HA LEU 102 -2.785 6.805 8.870
781 1HB LEU 102 2HB LEU 102 -1.996 6.773 6.141
782 2HB LEU 102 1HB LEU 102 -2.060 8.447 6.654
783 HG LEU 102 HG LEU 102 -0.496 7.994 8.455
784 1HD1 LEU 102 1HD1 LEU 102 0.268 5.928 9.066
785 2HD1 LEU 102 2HD1 LEU 102 -0.011 5.233 7.472
786 3HD1 LEU 102 3HD1 LEU 102 -1.369 5.511 8.561
787 1HD2 LEU 102 1HD2 LEU 102 0.188 7.230 5.664
788 2HD2 LEU 102 2HD2 LEU 102 1.409 7.045 6.922
789 3HD2 LEU 102 3HD2 LEU 102 0.698 8.627 6.607
790 HA PRO 103 HA PRO 103 -6.068 9.841 9.226
791 1HB PRO 103 2HB PRO 103 -4.980 11.159 11.375
792 2HB PRO 103 1HB PRO 103 -5.947 9.688 11.500
793 1HG PRO 103 2HG PRO 103 -2.985 10.025 11.587
794 2HG PRO 103 1HG PRO 103 -4.021 8.929 12.515
795 1HD PRO 103 2HD PRO 103 -2.550 8.113 10.388
796 2HD PRO 103 1HD PRO 103 -4.100 7.371 10.828
797 H LYS 104 H LYS 104 -2.975 11.297 10.212
798 HA LYS 104 HA LYS 104 -3.326 13.279 8.069
799 1HB LYS 104 2HB LYS 104 -2.780 13.661 10.968
800 2HB LYS 104 1HB LYS 104 -1.997 14.758 9.837
801 1HG LYS 104 2HG LYS 104 -3.858 15.964 9.910
802 2HG LYS 104 1HG LYS 104 -4.610 14.683 8.957
803 1HD LYS 104 2HD LYS 104 -5.396 13.592 10.957
804 2HD LYS 104 1HD LYS 104 -4.527 14.749 11.971
805 1HE LYS 104 2HE LYS 104 -6.553 15.705 9.992
806 2HE LYS 104 1HE LYS 104 -7.076 15.058 11.546
807 1HZ LYS 104 1HZ LYS 104 -6.192 17.624 11.002
808 2HZ LYS 104 2HZ LYS 104 -4.971 16.906 11.925
809 3HZ LYS 104 3HZ LYS 104 -6.555 16.963 12.516
810 HA PRO 105 HA PRO 105 1.507 13.044 8.977
811 1HB PRO 105 2HB PRO 105 2.085 10.570 10.179
812 2HB PRO 105 1HB PRO 105 2.186 12.157 10.946
813 1HG PRO 105 2HG PRO 105 -0.003 10.135 11.054
814 2HG PRO 105 1HG PRO 105 0.582 11.230 12.321
815 1HD PRO 105 2HD PRO 105 -1.696 11.725 11.040
816 2HD PRO 105 1HD PRO 105 -0.593 13.049 11.458
817 H PHE 106 H PHE 106 3.079 11.755 7.790
818 HA PHE 106 HA PHE 106 2.442 9.326 6.535
819 1HB PHE 106 2HB PHE 106 0.834 10.587 5.236
820 2HB PHE 106 1HB PHE 106 2.049 11.791 4.821
821 HD1 PHE 106 1HD PHE 106 1.561 8.086 4.569
822 HD2 PHE 106 2HD PHE 106 2.976 11.653 2.723
823 HE1 PHE 106 1HE PHE 106 2.152 6.806 2.557
824 HE2 PHE 106 2HE PHE 106 3.558 10.377 0.702
825 HZ PHE 106 HZ PHE 106 3.150 7.950 0.618
826 H ASP 107 H ASP 107 3.962 11.646 4.434
827 HA ASP 107 HA ASP 107 6.100 11.624 3.599
828 1HB ASP 107 2HB ASP 107 7.743 12.403 5.196
829 2HB ASP 107 1HB ASP 107 6.196 13.161 5.557
830 H ILE 108 H ILE 108 8.469 10.618 4.070
831 HA ILE 108 HA ILE 108 8.099 7.826 3.805
832 HB ILE 108 HB ILE 108 10.247 9.629 3.363
833 1HG1 ILE 108 2HG1 ILE 108 11.026 7.799 1.914
834 2HG1 ILE 108 1HG1 ILE 108 9.889 6.707 2.696
835 1HG2 ILE 108 1HG2 ILE 108 12.129 8.179 4.040
836 2HG2 ILE 108 2HG2 ILE 108 10.988 7.173 4.934
837 3HG2 ILE 108 3HG2 ILE 108 11.251 8.849 5.416
838 1HD1 ILE 108 1HD1 ILE 108 8.033 7.811 1.772
839 2HD1 ILE 108 2HD1 ILE 108 9.197 7.626 0.459
840 3HD1 ILE 108 3HD1 ILE 108 9.010 9.187 1.258
841 H ASP 109 H ASP 109 9.341 9.789 6.426
842 HA ASP 109 HA ASP 109 10.287 7.858 8.132
843 1HB ASP 109 2HB ASP 109 10.336 10.351 8.499
844 2HB ASP 109 1HB ASP 109 8.674 10.233 9.068
845 H GLU 110 H GLU 110 6.942 9.131 8.234
846 HA GLU 110 HA GLU 110 6.112 7.073 10.008
847 1HB GLU 110 2HB GLU 110 4.414 8.989 8.414
848 2HB GLU 110 1HB GLU 110 3.865 7.996 9.754
849 1HG GLU 110 2HG GLU 110 6.157 9.654 10.425
850 2HG GLU 110 1HG GLU 110 4.747 10.583 9.915
851 H ALA 111 H ALA 111 6.081 7.492 6.558
852 HA ALA 111 HA ALA 111 4.196 5.450 5.984
853 1HB ALA 111 1HB ALA 111 5.318 5.503 3.692
854 2HB ALA 111 2HB ALA 111 6.316 6.805 4.345
855 3HB ALA 111 3HB ALA 111 4.562 6.995 4.259
856 H VAL 112 H VAL 112 7.747 5.466 5.540
857 HA VAL 112 HA VAL 112 8.022 2.723 5.123
858 HB VAL 112 HB VAL 112 10.031 4.508 6.497
859 1HG1 VAL 112 1HG1 VAL 112 10.049 1.760 6.081
860 2HG1 VAL 112 2HG1 VAL 112 11.432 2.781 6.485
861 3HG1 VAL 112 3HG1 VAL 112 11.073 2.412 4.798
862 1HG2 VAL 112 1HG2 VAL 112 9.806 5.635 4.527
863 2HG2 VAL 112 2HG2 VAL 112 9.235 4.216 3.652
864 3HG2 VAL 112 3HG2 VAL 112 10.953 4.399 4.010
865 H ALA 113 H ALA 113 7.684 4.570 8.027
866 HA ALA 113 HA ALA 113 8.516 2.641 9.900
867 1HB ALA 113 1HB ALA 113 6.494 4.853 10.201
868 2HB ALA 113 2HB ALA 113 8.234 5.005 10.455
869 3HB ALA 113 3HB ALA 113 7.274 3.982 11.524
870 H LEU 114 H LEU 114 5.348 3.478 8.585
871 HA LEU 114 HA LEU 114 3.996 1.429 10.027
872 1HB LEU 114 2HB LEU 114 2.929 3.554 9.377
873 2HB LEU 114 1HB LEU 114 3.052 3.083 7.694
874 HG LEU 114 HG LEU 114 1.618 1.053 8.336
875 1HD1 LEU 114 1HD1 LEU 114 0.060 1.691 10.278
876 2HD1 LEU 114 2HD1 LEU 114 1.374 2.747 10.796
877 3HD1 LEU 114 3HD1 LEU 114 1.641 1.009 10.667
878 1HD2 LEU 114 1HD2 LEU 114 -0.287 2.188 7.724
879 2HD2 LEU 114 2HD2 LEU 114 0.974 3.286 7.161
880 3HD2 LEU 114 3HD2 LEU 114 0.128 3.611 8.676
881 H VAL 115 H VAL 115 5.676 1.540 7.009
882 HA VAL 115 HA VAL 115 4.242 -0.693 5.900
883 HB VAL 115 HB VAL 115 5.384 1.091 4.497
884 1HG1 VAL 115 1HG1 VAL 115 7.673 0.944 4.004
885 2HG1 VAL 115 2HG1 VAL 115 7.839 -0.607 4.828
886 3HG1 VAL 115 3HG1 VAL 115 7.577 0.864 5.759
887 1HG2 VAL 115 1HG2 VAL 115 6.409 -1.112 3.113
888 2HG2 VAL 115 2HG2 VAL 115 4.803 -0.400 2.957
889 3HG2 VAL 115 3HG2 VAL 115 5.069 -1.737 4.075
890 H GLU 116 H GLU 116 7.470 -0.246 7.304
891 HA GLU 116 HA GLU 116 8.288 -2.935 7.041
892 1HB GLU 116 2HB GLU 116 9.164 -0.745 8.929
893 2HB GLU 116 1HB GLU 116 9.957 -2.312 8.828
894 1HG GLU 116 2HG GLU 116 10.658 -1.916 6.604
895 2HG GLU 116 1HG GLU 116 9.620 -0.498 6.459
896 H ARG 117 H ARG 117 6.671 -1.187 9.662
897 HA ARG 117 HA ARG 117 6.719 -3.267 11.543
898 1HB ARG 117 2HB ARG 117 4.762 -0.993 11.198
899 2HB ARG 117 1HB ARG 117 4.794 -2.061 12.596
900 1HG ARG 117 2HG ARG 117 7.084 -0.320 11.715
901 2HG ARG 117 1HG ARG 117 5.935 0.087 12.988
902 1HD ARG 117 2HD ARG 117 7.567 -2.436 13.045
903 2HD ARG 117 1HD ARG 117 8.172 -0.914 13.694
904 HE ARG 117 HE ARG 117 5.608 -1.543 14.748
905 1HH1 ARG 117 1HH1 ARG 117 8.997 -2.329 15.021
906 2HH1 ARG 117 2HH1 ARG 117 8.875 -2.836 16.672
907 1HH2 ARG 117 1HH2 ARG 117 5.441 -2.212 16.917
908 2HH2 ARG 117 2HH2 ARG 117 6.851 -2.774 17.750
909 H ALA 118 H ALA 118 4.821 -2.788 8.719
910 HA ALA 118 HA ALA 118 2.648 -4.479 9.422
911 1HB ALA 118 1HB ALA 118 3.518 -2.996 7.063
912 2HB ALA 118 2HB ALA 118 1.895 -3.292 7.680
913 3HB ALA 118 3HB ALA 118 2.694 -4.510 6.691
914 H ILE 119 H ILE 119 5.550 -4.934 7.418
915 HA ILE 119 HA ILE 119 5.038 -7.676 6.899
916 HB ILE 119 HB ILE 119 7.722 -6.315 6.776
917 1HG1 ILE 119 2HG1 ILE 119 6.096 -6.502 4.314
918 2HG1 ILE 119 1HG1 ILE 119 5.552 -5.316 5.497
919 1HG2 ILE 119 1HG2 ILE 119 6.537 -8.719 5.413
920 2HG2 ILE 119 2HG2 ILE 119 7.945 -8.648 6.475
921 3HG2 ILE 119 3HG2 ILE 119 8.016 -7.931 4.862
922 1HD1 ILE 119 1HD1 ILE 119 7.047 -4.296 3.902
923 2HD1 ILE 119 2HD1 ILE 119 8.293 -5.487 4.279
924 3HD1 ILE 119 3HD1 ILE 119 7.785 -4.322 5.502
925 H SER 120 H SER 120 6.728 -5.909 9.354
926 HA SER 120 HA SER 120 8.165 -8.091 10.454
927 1HB SER 120 2HB SER 120 8.410 -5.455 10.752
928 2HB SER 120 1HB SER 120 7.405 -5.774 12.166
929 HG SER 120 HG SER 120 9.031 -7.468 12.642
930 H HIS 121 H HIS 121 5.157 -6.450 11.402
931 HA HIS 121 HA HIS 121 4.591 -7.955 13.670
932 1HB HIS 121 2HB HIS 121 2.887 -6.424 11.741
933 2HB HIS 121 1HB HIS 121 2.135 -7.358 13.030
934 HD1 HIS 121 1HD HIS 121 5.360 -5.705 13.815
935 HD2 HIS 121 2HD HIS 121 1.299 -4.909 14.202
936 HE1 HIS 121 1HE HIS 121 5.205 -3.762 15.404
937 HE2 HIS 121 2HE HIS 121 2.734 -3.360 15.696
938 H TYR 122 H TYR 122 4.248 -8.745 10.327
939 HA TYR 122 HA TYR 122 2.484 -10.957 10.772
940 1HB TYR 122 2HB TYR 122 3.932 -9.870 8.384
941 2HB TYR 122 1HB TYR 122 3.168 -11.457 8.317
942 HD1 TYR 122 1HD TYR 122 0.700 -11.206 9.698
943 HD2 TYR 122 2HD TYR 122 2.639 -8.320 7.248
944 HE1 TYR 122 1HE TYR 122 -1.470 -10.141 9.246
945 HE2 TYR 122 2HE TYR 122 0.479 -7.250 6.790
946 HH TYR 122 HH TYR 122 -1.797 -7.535 6.920
947 H GLN 123 H GLN 123 5.871 -10.677 9.687
948 HA GLN 123 HA GLN 123 7.637 -12.100 9.867
949 1HB GLN 123 2HB GLN 123 6.734 -11.909 12.328
950 2HB GLN 123 1HB GLN 123 6.262 -13.582 12.071
951 1HG GLN 123 2HG GLN 123 8.327 -14.287 12.427
952 2HG GLN 123 1HG GLN 123 8.973 -13.177 11.220
953 1HE2 GLN 123 1HE2 GLN 123 8.573 -13.838 14.544
954 2HE2 GLN 123 2HE2 GLN 123 9.378 -12.439 15.158
955 H GLU 124 H GLU 124 8.209 -14.551 9.949
956 HA GLU 124 HA GLU 124 8.062 -16.582 8.937
957 1HB GLU 124 2HB GLU 124 5.082 -16.235 9.318
958 2HB GLU 124 1HB GLU 124 5.925 -17.749 9.021
959 1HG GLU 124 2HG GLU 124 7.082 -17.531 11.155
960 2HG GLU 124 1HG GLU 124 6.250 -16.005 11.453
Start of MODEL 17
1 1H MET 1 1HT MET 1 10.028 -18.716 0.253
2 2H MET 1 2HT MET 1 10.441 -18.796 1.917
3 3H MET 1 3HT MET 1 11.438 -19.557 0.747
4 HA MET 1 HA MET 1 11.989 -17.237 1.779
5 1HB MET 1 2HB MET 1 13.320 -16.843 -0.275
6 2HB MET 1 1HB MET 1 13.410 -18.509 0.280
7 1HG MET 1 2HG MET 1 11.915 -19.236 -1.427
8 2HG MET 1 1HG MET 1 11.555 -17.573 -1.891
9 1HE MET 1 1HE MET 1 12.086 -19.742 -3.708
10 2HE MET 1 2HE MET 1 13.639 -19.799 -4.541
11 3HE MET 1 3HE MET 1 12.550 -18.437 -4.798
12 H GLN 2 H GLN 2 11.642 -15.071 1.521
13 HA GLN 2 HA GLN 2 9.537 -14.290 -0.378
14 1HB GLN 2 2HB GLN 2 9.864 -13.723 2.501
15 2HB GLN 2 1HB GLN 2 9.350 -12.365 1.511
16 1HG GLN 2 2HG GLN 2 7.367 -13.401 0.891
17 2HG GLN 2 1HG GLN 2 7.960 -15.005 1.318
18 1HE2 GLN 2 1HE2 GLN 2 8.091 -15.574 3.529
19 2HE2 GLN 2 2HE2 GLN 2 7.122 -14.772 4.711
20 H ARG 3 H ARG 3 12.517 -13.418 1.185
21 HA ARG 3 HA ARG 3 14.216 -12.057 0.625
22 1HB ARG 3 2HB ARG 3 14.739 -11.756 -1.567
23 2HB ARG 3 1HB ARG 3 13.533 -13.020 -1.722
24 1HG ARG 3 2HG ARG 3 11.872 -11.076 -2.095
25 2HG ARG 3 1HG ARG 3 13.321 -10.115 -2.394
26 1HD ARG 3 2HD ARG 3 13.080 -12.737 -3.770
27 2HD ARG 3 1HD ARG 3 12.066 -11.417 -4.340
28 HE ARG 3 HE ARG 3 14.777 -10.603 -4.056
29 1HH1 ARG 3 1HH1 ARG 3 12.602 -12.359 -6.142
30 2HH1 ARG 3 2HH1 ARG 3 13.541 -12.078 -7.570
31 1HH2 ARG 3 1HH2 ARG 3 16.018 -10.231 -5.928
32 2HH2 ARG 3 2HH2 ARG 3 15.484 -10.867 -7.449
33 H GLY 4 H GLY 4 11.000 -10.820 0.234
34 1HA GLY 4 2HA GLY 4 10.358 -8.860 1.457
35 2HA GLY 4 1HA GLY 4 11.981 -8.231 1.216
36 H ILE 5 H ILE 5 8.831 -8.678 -0.191
37 HA ILE 5 HA ILE 5 9.628 -6.893 -2.400
38 HB ILE 5 HB ILE 5 7.284 -8.779 -2.511
39 1HG1 ILE 5 2HG1 ILE 5 9.098 -10.277 -2.219
40 2HG1 ILE 5 1HG1 ILE 5 8.844 -10.203 -3.960
41 1HG2 ILE 5 1HG2 ILE 5 8.015 -6.681 -4.113
42 2HG2 ILE 5 2HG2 ILE 5 6.972 -8.022 -4.589
43 3HG2 ILE 5 3HG2 ILE 5 8.694 -8.069 -4.963
44 1HD1 ILE 5 1HD1 ILE 5 11.052 -9.913 -4.033
45 2HD1 ILE 5 2HD1 ILE 5 11.140 -9.398 -2.347
46 3HD1 ILE 5 3HD1 ILE 5 10.684 -8.244 -3.602
47 H VAL 6 H VAL 6 8.909 -4.909 -2.032
48 HA VAL 6 HA VAL 6 6.237 -4.573 -0.829
49 HB VAL 6 HB VAL 6 7.896 -3.635 0.646
50 1HG1 VAL 6 1HG1 VAL 6 9.400 -3.183 -1.579
51 2HG1 VAL 6 2HG1 VAL 6 9.743 -2.529 0.020
52 3HG1 VAL 6 3HG1 VAL 6 8.875 -1.554 -1.166
53 1HG2 VAL 6 1HG2 VAL 6 5.731 -2.281 -0.241
54 2HG2 VAL 6 2HG2 VAL 6 7.006 -1.107 -0.568
55 3HG2 VAL 6 3HG2 VAL 6 6.776 -1.725 1.068
56 H TRP 7 H TRP 7 4.750 -3.939 -2.244
57 HA TRP 7 HA TRP 7 5.653 -2.400 -4.580
58 1HB TRP 7 2HB TRP 7 3.427 -4.369 -4.199
59 2HB TRP 7 1HB TRP 7 3.300 -3.143 -5.464
60 HD1 TRP 7 HD1 TRP 7 6.832 -4.134 -5.001
61 HE1 TRP 7 1HE TRP 7 7.585 -5.733 -6.864
62 HE3 TRP 7 3HE TRP 7 2.252 -5.313 -6.965
63 HZ2 TRP 7 2HZ TRP 7 6.404 -7.304 -8.879
64 HZ3 TRP 7 3HZ TRP 7 2.159 -6.882 -8.859
65 HH2 TRP 7 HH2 TRP 7 4.198 -7.868 -9.795
66 H VAL 8 H VAL 8 4.905 -0.422 -4.969
67 HA VAL 8 HA VAL 8 2.881 0.646 -3.109
68 HB VAL 8 HB VAL 8 4.905 2.441 -4.351
69 1HG1 VAL 8 1HG1 VAL 8 4.641 3.531 -2.075
70 2HG1 VAL 8 2HG1 VAL 8 3.311 2.408 -1.823
71 3HG1 VAL 8 3HG1 VAL 8 3.245 3.563 -3.151
72 1HG2 VAL 8 1HG2 VAL 8 6.680 1.582 -3.338
73 2HG2 VAL 8 2HG2 VAL 8 5.698 0.225 -2.785
74 3HG2 VAL 8 3HG2 VAL 8 5.859 1.660 -1.778
75 H VAL 9 H VAL 9 1.443 2.187 -3.859
76 HA VAL 9 HA VAL 9 1.422 2.635 -6.763
77 HB VAL 9 HB VAL 9 -1.259 2.717 -5.676
78 1HG1 VAL 9 1HG1 VAL 9 -1.656 1.176 -7.593
79 2HG1 VAL 9 2HG1 VAL 9 0.081 1.115 -7.847
80 3HG1 VAL 9 3HG1 VAL 9 -0.776 2.638 -8.041
81 1HG2 VAL 9 1HG2 VAL 9 -1.380 0.137 -5.546
82 2HG2 VAL 9 2HG2 VAL 9 -0.800 1.029 -4.140
83 3HG2 VAL 9 3HG2 VAL 9 0.351 0.232 -5.216
84 H ASP 10 H ASP 10 1.812 4.695 -7.089
85 HA ASP 10 HA ASP 10 0.211 6.747 -5.873
86 1HB ASP 10 2HB ASP 10 2.284 6.095 -4.324
87 2HB ASP 10 1HB ASP 10 3.129 7.170 -5.433
88 H ASP 11 H ASP 11 1.923 8.923 -6.440
89 HA ASP 11 HA ASP 11 1.470 9.216 -9.203
90 1HB ASP 11 2HB ASP 11 3.175 10.862 -7.325
91 2HB ASP 11 1HB ASP 11 2.712 11.351 -8.953
92 H ASP 12 H ASP 12 3.837 7.417 -7.743
93 HA ASP 12 HA ASP 12 5.704 6.391 -8.542
94 1HB ASP 12 2HB ASP 12 4.207 6.733 -10.762
95 2HB ASP 12 1HB ASP 12 5.605 7.709 -11.200
96 H SER 13 H SER 13 7.537 7.530 -10.543
97 HA SER 13 HA SER 13 9.552 8.582 -10.279
98 1HB SER 13 2HB SER 13 9.299 10.876 -10.904
99 2HB SER 13 1HB SER 13 8.007 9.934 -11.659
100 HG SER 13 HG SER 13 6.600 10.669 -10.043
101 H SER 14 H SER 14 8.128 11.262 -8.619
102 HA SER 14 HA SER 14 10.081 11.463 -6.682
103 1HB SER 14 2HB SER 14 7.975 13.006 -7.400
104 2HB SER 14 1HB SER 14 7.396 12.390 -5.854
105 HG SER 14 HG SER 14 9.901 13.102 -5.476
106 H ILE 15 H ILE 15 6.820 10.037 -6.268
107 HA ILE 15 HA ILE 15 7.242 9.249 -3.601
108 HB ILE 15 HB ILE 15 5.372 7.869 -5.514
109 1HG1 ILE 15 2HG1 ILE 15 5.060 10.330 -5.629
110 2HG1 ILE 15 1HG1 ILE 15 3.677 9.511 -4.914
111 1HG2 ILE 15 1HG2 ILE 15 4.204 7.150 -3.642
112 2HG2 ILE 15 2HG2 ILE 15 4.913 8.383 -2.603
113 3HG2 ILE 15 3HG2 ILE 15 5.886 7.012 -3.135
114 1HD1 ILE 15 1HD1 ILE 15 5.393 11.549 -3.807
115 2HD1 ILE 15 2HD1 ILE 15 5.276 10.142 -2.748
116 3HD1 ILE 15 3HD1 ILE 15 3.813 10.981 -3.264
117 H ARG 16 H ARG 16 8.024 7.766 -6.634
118 HA ARG 16 HA ARG 16 8.550 5.142 -5.626
119 1HB ARG 16 2HB ARG 16 8.034 5.743 -8.024
120 2HB ARG 16 1HB ARG 16 9.661 6.398 -8.135
121 1HG ARG 16 2HG ARG 16 10.572 4.182 -7.589
122 2HG ARG 16 1HG ARG 16 8.933 3.535 -7.545
123 1HD ARG 16 2HD ARG 16 9.688 3.010 -9.691
124 2HD ARG 16 1HD ARG 16 8.710 4.460 -9.923
125 HE ARG 16 HE ARG 16 11.341 5.267 -9.496
126 1HH1 ARG 16 1HH1 ARG 16 9.497 3.512 -11.884
127 2HH1 ARG 16 2HH1 ARG 16 10.537 3.961 -13.194
128 1HH2 ARG 16 1HH2 ARG 16 12.703 5.860 -11.199
129 2HH2 ARG 16 2HH2 ARG 16 12.364 5.305 -12.806
130 H TRP 17 H TRP 17 10.535 7.984 -6.339
131 HA TRP 17 HA TRP 17 13.043 6.803 -5.865
132 1HB TRP 17 2HB TRP 17 12.735 8.927 -7.081
133 2HB TRP 17 1HB TRP 17 12.240 9.705 -5.581
134 HD1 TRP 17 HD1 TRP 17 15.282 8.745 -7.572
135 HE1 TRP 17 1HE TRP 17 17.404 9.535 -6.351
136 HE3 TRP 17 3HE TRP 17 13.210 10.056 -3.079
137 HZ2 TRP 17 2HZ TRP 17 18.111 10.569 -3.824
138 HZ3 TRP 17 3HZ TRP 17 14.681 10.933 -1.315
139 HH2 TRP 17 HH2 TRP 17 17.081 11.185 -1.681
140 H VAL 18 H VAL 18 11.077 8.889 -3.749
141 HA VAL 18 HA VAL 18 12.801 8.792 -1.563
142 HB VAL 18 HB VAL 18 9.858 8.982 -1.095
143 1HG1 VAL 18 1HG1 VAL 18 10.995 9.267 0.884
144 2HG1 VAL 18 2HG1 VAL 18 10.835 10.933 0.334
145 3HG1 VAL 18 3HG1 VAL 18 12.360 10.074 0.111
146 1HG2 VAL 18 1HG2 VAL 18 10.698 11.583 -1.634
147 2HG2 VAL 18 2HG2 VAL 18 9.604 10.602 -2.606
148 3HG2 VAL 18 3HG2 VAL 18 11.329 10.624 -2.973
149 H LEU 19 H LEU 19 10.077 6.724 -2.351
150 HA LEU 19 HA LEU 19 10.363 5.207 0.050
151 1HB LEU 19 2HB LEU 19 8.212 5.713 -1.291
152 2HB LEU 19 1HB LEU 19 8.694 4.340 -2.268
153 HG LEU 19 HG LEU 19 8.566 2.871 -0.342
154 1HD1 LEU 19 1HD1 LEU 19 7.995 3.588 1.832
155 2HD1 LEU 19 2HD1 LEU 19 7.595 5.212 1.271
156 3HD1 LEU 19 3HD1 LEU 19 9.272 4.674 1.290
157 1HD2 LEU 19 1HD2 LEU 19 6.088 4.567 -0.339
158 2HD2 LEU 19 2HD2 LEU 19 6.225 2.827 -0.088
159 3HD2 LEU 19 3HD2 LEU 19 6.518 3.512 -1.688
160 H GLU 20 H GLU 20 11.494 4.811 -3.228
161 HA GLU 20 HA GLU 20 11.880 2.032 -3.044
162 1HB GLU 20 2HB GLU 20 13.259 2.202 -5.023
163 2HB GLU 20 1HB GLU 20 11.805 3.165 -5.195
164 1HG GLU 20 2HG GLU 20 13.193 5.161 -4.588
165 2HG GLU 20 1HG GLU 20 14.607 4.114 -4.714
166 H ARG 21 H ARG 21 14.413 4.569 -2.921
167 HA ARG 21 HA ARG 21 16.435 2.915 -2.158
168 1HB ARG 21 2HB ARG 21 16.061 5.807 -1.468
169 2HB ARG 21 1HB ARG 21 17.569 4.916 -1.249
170 1HG ARG 21 2HG ARG 21 17.988 5.725 -3.317
171 2HG ARG 21 1HG ARG 21 17.046 4.300 -3.782
172 1HD ARG 21 2HD ARG 21 15.041 5.653 -3.694
173 2HD ARG 21 1HD ARG 21 16.026 7.091 -3.464
174 HE ARG 21 HE ARG 21 15.456 5.820 -5.912
175 1HH1 ARG 21 1HH1 ARG 21 18.098 7.361 -4.232
176 2HH1 ARG 21 2HH1 ARG 21 18.910 7.822 -5.690
177 1HH2 ARG 21 1HH2 ARG 21 16.488 6.446 -7.811
178 2HH2 ARG 21 2HH2 ARG 21 17.984 7.316 -7.730
179 H ALA 22 H ALA 22 14.290 4.781 -0.037
180 HA ALA 22 HA ALA 22 15.394 4.127 2.401
181 1HB ALA 22 1HB ALA 22 12.955 5.290 1.480
182 2HB ALA 22 2HB ALA 22 13.766 5.492 3.034
183 3HB ALA 22 3HB ALA 22 12.614 4.178 2.807
184 H LEU 23 H LEU 23 12.631 2.482 0.926
185 HA LEU 23 HA LEU 23 12.670 0.365 2.788
186 1HB LEU 23 2HB LEU 23 11.144 1.079 0.449
187 2HB LEU 23 1HB LEU 23 11.523 -0.633 0.431
188 HG LEU 23 HG LEU 23 10.104 0.850 2.645
189 1HD1 LEU 23 1HD1 LEU 23 9.104 -0.077 0.248
190 2HD1 LEU 23 2HD1 LEU 23 8.174 0.257 1.711
191 3HD1 LEU 23 3HD1 LEU 23 8.743 -1.381 1.382
192 1HD2 LEU 23 1HD2 LEU 23 11.682 -1.208 3.143
193 2HD2 LEU 23 2HD2 LEU 23 10.295 -2.117 2.538
194 3HD2 LEU 23 3HD2 LEU 23 10.108 -1.042 3.925
195 H ALA 24 H ALA 24 14.412 1.006 -0.127
196 HA ALA 24 HA ALA 24 15.279 -1.629 -0.672
197 1HB ALA 24 1HB ALA 24 15.509 0.140 -2.339
198 2HB ALA 24 2HB ALA 24 17.081 -0.567 -1.971
199 3HB ALA 24 3HB ALA 24 16.640 1.000 -1.294
200 H GLY 25 H GLY 25 16.359 0.925 1.484
201 1HA GLY 25 2HA GLY 25 18.828 -0.266 2.220
202 2HA GLY 25 1HA GLY 25 17.940 0.930 3.157
203 H ALA 26 H ALA 26 15.531 -0.860 3.112
204 HA ALA 26 HA ALA 26 16.126 -2.276 5.517
205 1HB ALA 26 1HB ALA 26 14.002 -1.566 5.725
206 2HB ALA 26 2HB ALA 26 13.630 -3.092 4.925
207 3HB ALA 26 3HB ALA 26 13.703 -1.601 3.986
208 H GLY 27 H GLY 27 16.283 -3.033 2.202
209 1HA GLY 27 2HA GLY 27 17.336 -5.036 1.472
210 2HA GLY 27 1HA GLY 27 16.728 -5.842 2.904
211 H LEU 28 H LEU 28 14.574 -3.880 0.933
212 HA LEU 28 HA LEU 28 13.436 -6.362 -0.119
213 1HB LEU 28 2HB LEU 28 11.573 -4.135 0.360
214 2HB LEU 28 1HB LEU 28 11.335 -5.860 0.552
215 HG LEU 28 HG LEU 28 12.964 -5.486 2.613
216 1HD1 LEU 28 1HD1 LEU 28 13.484 -3.317 2.751
217 2HD1 LEU 28 2HD1 LEU 28 11.923 -3.213 3.564
218 3HD1 LEU 28 3HD1 LEU 28 12.056 -2.805 1.851
219 1HD2 LEU 28 1HD2 LEU 28 11.131 -5.788 3.931
220 2HD2 LEU 28 2HD2 LEU 28 10.418 -6.162 2.362
221 3HD2 LEU 28 3HD2 LEU 28 10.184 -4.569 3.079
222 H THR 29 H THR 29 11.766 -5.878 -1.880
223 HA THR 29 HA THR 29 13.037 -4.081 -3.813
224 HB THR 29 HB THR 29 11.148 -6.417 -4.125
225 HG1 THR 29 1HG THR 29 13.858 -5.936 -4.684
226 1HG2 THR 29 1HG2 THR 29 12.056 -5.800 -6.646
227 2HG2 THR 29 2HG2 THR 29 11.602 -4.235 -5.970
228 3HG2 THR 29 3HG2 THR 29 10.424 -5.547 -6.026
229 H CYS 30 H CYS 30 12.206 -2.087 -3.682
230 HA CYS 30 HA CYS 30 9.331 -1.762 -3.255
231 1HB CYS 30 2HB CYS 30 11.039 -0.550 -1.823
232 2HB CYS 30 1HB CYS 30 11.402 0.414 -3.249
233 HG CYS 30 HG CYS 30 8.586 0.827 -2.986
234 H THR 31 H THR 31 8.146 -1.665 -5.019
235 HA THR 31 HA THR 31 9.138 -0.060 -7.281
236 HB THR 31 HB THR 31 8.853 -2.624 -7.649
237 HG1 THR 31 1HG THR 31 8.882 -0.813 -9.278
238 1HG2 THR 31 1HG2 THR 31 5.996 -1.878 -8.086
239 2HG2 THR 31 2HG2 THR 31 6.544 -2.593 -6.572
240 3HG2 THR 31 3HG2 THR 31 6.739 -3.479 -8.090
241 H THR 32 H THR 32 7.438 1.105 -8.452
242 HA THR 32 HA THR 32 5.026 1.499 -6.850
243 HB THR 32 HB THR 32 5.172 3.901 -7.184
244 HG1 THR 32 1HG THR 32 6.296 4.342 -8.936
245 1HG2 THR 32 1HG2 THR 32 6.733 4.346 -5.568
246 2HG2 THR 32 2HG2 THR 32 7.878 3.164 -6.206
247 3HG2 THR 32 3HG2 THR 32 6.460 2.620 -5.320
248 H PHE 33 H PHE 33 3.263 2.571 -7.983
249 HA PHE 33 HA PHE 33 3.283 2.043 -10.869
250 1HB PHE 33 2HB PHE 33 1.079 1.338 -8.947
251 2HB PHE 33 1HB PHE 33 0.998 1.169 -10.688
252 HD1 PHE 33 1HD PHE 33 1.371 -0.946 -11.531
253 HD2 PHE 33 2HD PHE 33 3.236 0.171 -7.888
254 HE1 PHE 33 1HE PHE 33 2.350 -3.191 -11.355
255 HE2 PHE 33 2HE PHE 33 4.231 -2.061 -7.699
256 HZ PHE 33 HZ PHE 33 3.779 -3.760 -9.440
257 H GLU 34 H GLU 34 1.185 2.979 -11.883
258 HA GLU 34 HA GLU 34 1.348 5.754 -11.764
259 1HB GLU 34 2HB GLU 34 -0.697 5.721 -13.182
260 2HB GLU 34 1HB GLU 34 0.564 4.628 -13.739
261 1HG GLU 34 2HG GLU 34 -1.130 3.163 -13.889
262 2HG GLU 34 1HG GLU 34 -0.842 2.961 -12.165
263 H ASN 35 H ASN 35 -1.347 3.713 -10.502
264 HA ASN 35 HA ASN 35 -1.875 5.768 -8.551
265 1HB ASN 35 2HB ASN 35 -3.248 5.901 -10.894
266 2HB ASN 35 1HB ASN 35 -4.334 4.935 -9.905
267 1HD2 ASN 35 1HD2 ASN 35 -2.520 7.949 -9.977
268 2HD2 ASN 35 2HD2 ASN 35 -3.611 8.835 -8.974
269 H GLY 36 H GLY 36 -3.782 3.092 -9.818
270 1HA GLY 36 2HA GLY 36 -3.362 1.597 -7.356
271 2HA GLY 36 1HA GLY 36 -4.990 2.176 -7.638
272 H ASN 37 H ASN 37 -5.173 1.765 -10.413
273 HA ASN 37 HA ASN 37 -5.854 -0.979 -10.438
274 1HB ASN 37 2HB ASN 37 -6.165 1.297 -12.215
275 2HB ASN 37 1HB ASN 37 -5.838 -0.193 -13.093
276 1HD2 ASN 37 1HD2 ASN 37 -7.549 0.188 -10.032
277 2HD2 ASN 37 2HD2 ASN 37 -9.065 -0.416 -10.597
278 H GLU 38 H GLU 38 -3.065 0.792 -11.511
279 HA GLU 38 HA GLU 38 -1.908 -0.970 -13.287
280 1HB GLU 38 2HB GLU 38 -1.161 1.344 -12.349
281 2HB GLU 38 1HB GLU 38 -0.233 0.374 -11.227
282 1HG GLU 38 2HG GLU 38 1.355 0.514 -12.795
283 2HG GLU 38 1HG GLU 38 0.448 -0.784 -13.570
284 H VAL 39 H VAL 39 -1.194 -0.898 -9.735
285 HA VAL 39 HA VAL 39 0.353 -3.229 -9.766
286 HB VAL 39 HB VAL 39 -1.366 -2.899 -7.372
287 1HG1 VAL 39 1HG1 VAL 39 0.462 -4.522 -7.460
288 2HG1 VAL 39 2HG1 VAL 39 0.761 -3.286 -6.235
289 3HG1 VAL 39 3HG1 VAL 39 1.603 -3.218 -7.785
290 1HG2 VAL 39 1HG2 VAL 39 -1.096 -0.686 -7.286
291 2HG2 VAL 39 2HG2 VAL 39 0.150 -0.691 -8.535
292 3HG2 VAL 39 3HG2 VAL 39 0.576 -1.052 -6.862
293 H LEU 40 H LEU 40 -3.147 -2.843 -9.420
294 HA LEU 40 HA LEU 40 -3.857 -5.463 -8.840
295 1HB LEU 40 2HB LEU 40 -5.455 -3.828 -10.780
296 2HB LEU 40 1HB LEU 40 -6.028 -4.928 -9.538
297 HG LEU 40 HG LEU 40 -4.946 -2.140 -9.168
298 1HD1 LEU 40 1HD1 LEU 40 -7.302 -2.377 -7.796
299 2HD1 LEU 40 2HD1 LEU 40 -7.594 -3.350 -9.240
300 3HD1 LEU 40 3HD1 LEU 40 -7.113 -1.661 -9.394
301 1HD2 LEU 40 1HD2 LEU 40 -4.641 -2.432 -6.954
302 2HD2 LEU 40 2HD2 LEU 40 -4.351 -4.107 -7.430
303 3HD2 LEU 40 3HD2 LEU 40 -5.939 -3.620 -6.826
304 H ALA 41 H ALA 41 -3.159 -3.930 -11.927
305 HA ALA 41 HA ALA 41 -3.775 -6.120 -13.588
306 1HB ALA 41 1HB ALA 41 -1.710 -4.022 -14.184
307 2HB ALA 41 2HB ALA 41 -3.443 -3.711 -14.283
308 3HB ALA 41 3HB ALA 41 -2.704 -4.926 -15.326
309 H ALA 42 H ALA 42 -0.742 -4.993 -12.212
310 HA ALA 42 HA ALA 42 0.832 -7.111 -13.265
311 1HB ALA 42 1HB ALA 42 1.702 -5.614 -10.834
312 2HB ALA 42 2HB ALA 42 1.529 -4.742 -12.357
313 3HB ALA 42 3HB ALA 42 2.630 -6.112 -12.248
314 H LEU 43 H LEU 43 -1.103 -6.700 -10.427
315 HA LEU 43 HA LEU 43 0.053 -8.752 -8.858
316 1HB LEU 43 2HB LEU 43 -2.454 -7.156 -8.797
317 2HB LEU 43 1HB LEU 43 -2.374 -8.612 -7.819
318 HG LEU 43 HG LEU 43 -0.063 -6.799 -7.571
319 1HD1 LEU 43 1HD1 LEU 43 -2.789 -5.845 -7.204
320 2HD1 LEU 43 2HD1 LEU 43 -1.278 -4.952 -7.288
321 3HD1 LEU 43 3HD1 LEU 43 -1.784 -5.675 -5.766
322 1HD2 LEU 43 1HD2 LEU 43 -1.796 -8.416 -5.724
323 2HD2 LEU 43 2HD2 LEU 43 -0.513 -7.350 -5.151
324 3HD2 LEU 43 3HD2 LEU 43 -0.124 -8.716 -6.199
325 H ALA 44 H ALA 44 -2.140 -8.768 -11.506
326 HA ALA 44 HA ALA 44 -3.603 -11.083 -11.062
327 1HB ALA 44 1HB ALA 44 -3.107 -9.347 -13.241
328 2HB ALA 44 2HB ALA 44 -4.400 -10.534 -13.059
329 3HB ALA 44 3HB ALA 44 -2.875 -11.001 -13.813
330 H SER 45 H SER 45 -0.256 -10.700 -11.701
331 HA SER 45 HA SER 45 0.047 -13.593 -11.810
332 1HB SER 45 2HB SER 45 0.936 -11.610 -13.752
333 2HB SER 45 1HB SER 45 2.248 -12.644 -13.188
334 HG SER 45 HG SER 45 0.984 -13.424 -15.041
335 H LYS 46 H LYS 46 0.605 -10.955 -9.966
336 HA LYS 46 HA LYS 46 2.933 -12.209 -8.757
337 1HB LYS 46 2HB LYS 46 3.498 -10.135 -10.198
338 2HB LYS 46 1HB LYS 46 2.764 -9.229 -8.883
339 1HG LYS 46 2HG LYS 46 4.966 -9.192 -8.263
340 2HG LYS 46 1HG LYS 46 4.403 -10.613 -7.400
341 1HD LYS 46 2HD LYS 46 5.275 -12.058 -9.068
342 2HD LYS 46 1HD LYS 46 5.663 -10.687 -10.117
343 1HE LYS 46 2HE LYS 46 7.680 -10.581 -9.187
344 2HE LYS 46 1HE LYS 46 6.926 -10.217 -7.635
345 1HZ LYS 46 1HZ LYS 46 7.536 -12.923 -8.696
346 2HZ LYS 46 2HZ LYS 46 6.743 -12.612 -7.236
347 3HZ LYS 46 3HZ LYS 46 8.351 -12.132 -7.440
348 H THR 47 H THR 47 3.349 -11.508 -6.578
349 HA THR 47 HA THR 47 1.091 -10.335 -5.185
350 HB THR 47 HB THR 47 2.369 -12.931 -4.323
351 HG1 THR 47 1HG THR 47 -0.106 -12.333 -5.540
352 1HG2 THR 47 1HG2 THR 47 1.600 -11.543 -2.432
353 2HG2 THR 47 2HG2 THR 47 0.689 -13.043 -2.610
354 3HG2 THR 47 3HG2 THR 47 -0.012 -11.517 -3.146
355 HA PRO 48 HA PRO 48 4.776 -8.471 -3.388
356 1HB PRO 48 2HB PRO 48 3.595 -6.238 -2.473
357 2HB PRO 48 1HB PRO 48 3.962 -6.459 -4.187
358 1HG PRO 48 2HG PRO 48 1.359 -6.710 -2.757
359 2HG PRO 48 1HG PRO 48 1.698 -6.080 -4.378
360 1HD PRO 48 2HD PRO 48 0.736 -8.626 -3.815
361 2HD PRO 48 1HD PRO 48 1.525 -8.139 -5.324
362 H ASP 49 H ASP 49 5.511 -8.172 -1.258
363 HA ASP 49 HA ASP 49 4.108 -9.718 0.690
364 1HB ASP 49 2HB ASP 49 6.623 -8.051 0.898
365 2HB ASP 49 1HB ASP 49 6.009 -9.083 2.184
366 H VAL 50 H VAL 50 4.483 -6.293 0.037
367 HA VAL 50 HA VAL 50 2.420 -5.729 2.007
368 HB VAL 50 HB VAL 50 4.490 -5.538 3.285
369 1HG1 VAL 50 1HG1 VAL 50 5.663 -4.768 1.012
370 2HG1 VAL 50 2HG1 VAL 50 6.340 -4.433 2.611
371 3HG1 VAL 50 3HG1 VAL 50 5.423 -3.185 1.763
372 1HG2 VAL 50 1HG2 VAL 50 4.129 -3.349 4.197
373 2HG2 VAL 50 2HG2 VAL 50 2.573 -4.030 3.720
374 3HG2 VAL 50 3HG2 VAL 50 3.349 -2.809 2.706
375 H LEU 51 H LEU 51 0.986 -4.852 0.600
376 HA LEU 51 HA LEU 51 1.876 -3.024 -1.457
377 1HB LEU 51 2HB LEU 51 0.070 -4.864 -1.643
378 2HB LEU 51 1HB LEU 51 -0.992 -3.689 -0.897
379 HG LEU 51 HG LEU 51 -0.727 -2.179 -2.761
380 1HD1 LEU 51 1HD1 LEU 51 0.834 -4.006 -4.438
381 2HD1 LEU 51 2HD1 LEU 51 1.731 -3.292 -3.104
382 3HD1 LEU 51 3HD1 LEU 51 0.926 -2.248 -4.277
383 1HD2 LEU 51 1HD2 LEU 51 -1.603 -4.960 -3.164
384 2HD2 LEU 51 2HD2 LEU 51 -1.267 -4.071 -4.649
385 3HD2 LEU 51 3HD2 LEU 51 -2.442 -3.445 -3.495
386 H LEU 52 H LEU 52 1.732 -0.888 -1.488
387 HA LEU 52 HA LEU 52 0.343 0.465 0.740
388 1HB LEU 52 2HB LEU 52 3.024 0.605 -0.077
389 2HB LEU 52 1HB LEU 52 2.293 2.089 -0.648
390 HG LEU 52 HG LEU 52 2.139 1.185 2.224
391 1HD1 LEU 52 1HD1 LEU 52 3.900 3.000 2.526
392 2HD1 LEU 52 2HD1 LEU 52 4.179 2.867 0.787
393 3HD1 LEU 52 3HD1 LEU 52 4.446 1.471 1.833
394 1HD2 LEU 52 1HD2 LEU 52 0.540 2.793 2.109
395 2HD2 LEU 52 2HD2 LEU 52 1.244 3.548 0.679
396 3HD2 LEU 52 3HD2 LEU 52 1.942 3.851 2.270
397 H SER 53 H SER 53 -1.312 1.799 0.179
398 HA SER 53 HA SER 53 -1.573 2.525 -2.662
399 1HB SER 53 2HB SER 53 -3.444 1.490 -0.725
400 2HB SER 53 1HB SER 53 -4.027 3.016 -1.386
401 HG SER 53 HG SER 53 -3.201 0.740 -2.869
402 H ASP 54 H ASP 54 -1.747 4.619 -3.284
403 HA ASP 54 HA ASP 54 -0.972 6.644 -1.403
404 1HB ASP 54 2HB ASP 54 -0.884 8.121 -3.336
405 2HB ASP 54 1HB ASP 54 -0.092 6.590 -3.691
406 H ILE 55 H ILE 55 -3.993 5.606 -2.690
407 HA ILE 55 HA ILE 55 -6.109 6.482 -2.651
408 HB ILE 55 HB ILE 55 -5.982 5.840 -0.366
409 1HG1 ILE 55 2HG1 ILE 55 -6.960 8.484 0.346
410 2HG1 ILE 55 1HG1 ILE 55 -7.599 7.949 -1.204
411 1HG2 ILE 55 1HG2 ILE 55 -3.908 6.755 0.334
412 2HG2 ILE 55 2HG2 ILE 55 -5.166 7.405 1.390
413 3HG2 ILE 55 3HG2 ILE 55 -4.491 8.406 0.107
414 1HD1 ILE 55 1HD1 ILE 55 -7.679 6.204 1.232
415 2HD1 ILE 55 2HD1 ILE 55 -8.623 6.068 -0.252
416 3HD1 ILE 55 3HD1 ILE 55 -8.940 7.385 0.877
417 H ARG 56 H ARG 56 -5.938 8.013 -4.352
418 HA ARG 56 HA ARG 56 -6.236 10.749 -3.423
419 1HB ARG 56 2HB ARG 56 -4.656 11.684 -5.028
420 2HB ARG 56 1HB ARG 56 -3.846 10.605 -3.902
421 1HG ARG 56 2HG ARG 56 -3.773 8.862 -5.584
422 2HG ARG 56 1HG ARG 56 -4.654 9.891 -6.714
423 1HD ARG 56 2HD ARG 56 -2.562 11.492 -5.954
424 2HD ARG 56 1HD ARG 56 -1.825 9.895 -5.979
425 HE ARG 56 HE ARG 56 -2.154 9.791 -8.278
426 1HH1 ARG 56 1HH1 ARG 56 -3.575 12.695 -6.957
427 2HH1 ARG 56 2HH1 ARG 56 -3.768 13.451 -8.501
428 1HH2 ARG 56 1HH2 ARG 56 -2.430 10.789 -10.316
429 2HH2 ARG 56 2HH2 ARG 56 -3.130 12.371 -10.401
430 H MET 57 H MET 57 -8.355 9.482 -4.174
431 HA MET 57 HA MET 57 -10.153 9.530 -5.548
432 1HB MET 57 2HB MET 57 -9.453 11.978 -5.585
433 2HB MET 57 1HB MET 57 -8.751 11.644 -7.165
434 1HG MET 57 2HG MET 57 -11.028 10.786 -7.847
435 2HG MET 57 1HG MET 57 -11.633 11.485 -6.346
436 1HE MET 57 1HE MET 57 -12.635 11.909 -9.138
437 2HE MET 57 2HE MET 57 -11.284 12.404 -10.158
438 3HE MET 57 3HE MET 57 -12.529 13.573 -9.715
439 HA PRO 58 HA PRO 58 -7.826 7.289 -8.985
440 1HB PRO 58 2HB PRO 58 -7.954 4.747 -8.030
441 2HB PRO 58 1HB PRO 58 -6.598 5.827 -7.712
442 1HG PRO 58 2HG PRO 58 -8.815 5.007 -5.931
443 2HG PRO 58 1HG PRO 58 -7.151 5.450 -5.529
444 1HD PRO 58 2HD PRO 58 -9.400 7.078 -5.250
445 2HD PRO 58 1HD PRO 58 -7.713 7.616 -5.215
446 H GLY 59 H GLY 59 -10.004 5.066 -7.287
447 1HA GLY 59 2HA GLY 59 -11.905 5.302 -9.534
448 2HA GLY 59 1HA GLY 59 -11.556 3.784 -8.715
449 H MET 60 H MET 60 -11.448 5.385 -6.126
450 HA MET 60 HA MET 60 -14.105 6.344 -5.703
451 1HB MET 60 2HB MET 60 -14.301 3.784 -5.665
452 2HB MET 60 1HB MET 60 -13.386 3.856 -4.164
453 1HG MET 60 2HG MET 60 -15.104 4.734 -2.985
454 2HG MET 60 1HG MET 60 -15.763 5.602 -4.373
455 1HE MET 60 1HE MET 60 -17.380 4.491 -2.321
456 2HE MET 60 2HE MET 60 -17.112 2.773 -2.016
457 3HE MET 60 3HE MET 60 -18.538 3.299 -2.913
458 H ASP 61 H ASP 61 -12.353 7.975 -5.254
459 HA ASP 61 HA ASP 61 -11.437 9.407 -3.747
460 1HB ASP 61 2HB ASP 61 -13.260 7.835 -2.208
461 2HB ASP 61 1HB ASP 61 -11.825 8.151 -1.241
462 H GLY 62 H GLY 62 -10.661 6.047 -3.616
463 1HA GLY 62 2HA GLY 62 -8.106 5.845 -3.808
464 2HA GLY 62 1HA GLY 62 -8.142 6.615 -2.234
465 H LEU 63 H LEU 63 -10.626 5.269 -1.495
466 HA LEU 63 HA LEU 63 -9.457 2.949 -0.376
467 1HB LEU 63 2HB LEU 63 -12.367 3.723 -0.410
468 2HB LEU 63 1HB LEU 63 -11.616 2.547 0.654
469 HG LEU 63 HG LEU 63 -10.133 4.682 1.291
470 1HD1 LEU 63 1HD1 LEU 63 -10.949 6.652 0.701
471 2HD1 LEU 63 2HD1 LEU 63 -12.552 6.228 1.309
472 3HD1 LEU 63 3HD1 LEU 63 -12.096 5.809 -0.344
473 1HD2 LEU 63 1HD2 LEU 63 -12.211 3.207 2.457
474 2HD2 LEU 63 2HD2 LEU 63 -12.586 4.905 2.752
475 3HD2 LEU 63 3HD2 LEU 63 -11.035 4.244 3.264
476 H ALA 64 H ALA 64 -11.178 3.629 -3.267
477 HA ALA 64 HA ALA 64 -12.400 1.211 -3.870
478 1HB ALA 64 1HB ALA 64 -11.701 3.586 -5.253
479 2HB ALA 64 2HB ALA 64 -12.882 2.359 -5.709
480 3HB ALA 64 3HB ALA 64 -11.208 2.215 -6.249
481 H LEU 65 H LEU 65 -9.015 2.109 -4.008
482 HA LEU 65 HA LEU 65 -8.015 0.026 -5.561
483 1HB LEU 65 2HB LEU 65 -6.942 1.892 -3.552
484 2HB LEU 65 1HB LEU 65 -6.021 0.411 -3.743
485 HG LEU 65 HG LEU 65 -5.711 0.864 -6.108
486 1HD1 LEU 65 1HD1 LEU 65 -6.700 3.594 -6.101
487 2HD1 LEU 65 2HD1 LEU 65 -7.984 2.408 -5.881
488 3HD1 LEU 65 3HD1 LEU 65 -6.928 2.312 -7.290
489 1HD2 LEU 65 1HD2 LEU 65 -4.569 3.208 -5.792
490 2HD2 LEU 65 2HD2 LEU 65 -3.935 1.774 -4.982
491 3HD2 LEU 65 3HD2 LEU 65 -4.944 2.917 -4.093
492 H LEU 66 H LEU 66 -8.484 0.201 -2.060
493 HA LEU 66 HA LEU 66 -7.504 -2.297 -1.363
494 1HB LEU 66 2HB LEU 66 -9.777 -0.766 -0.121
495 2HB LEU 66 1HB LEU 66 -8.906 -2.081 0.649
496 HG LEU 66 HG LEU 66 -6.837 -0.447 0.080
497 1HD1 LEU 66 1HD1 LEU 66 -9.279 1.214 0.092
498 2HD1 LEU 66 2HD1 LEU 66 -7.765 1.425 -0.792
499 3HD1 LEU 66 3HD1 LEU 66 -7.854 1.839 0.920
500 1HD2 LEU 66 1HD2 LEU 66 -7.889 0.549 2.506
501 2HD2 LEU 66 2HD2 LEU 66 -6.657 -0.694 2.279
502 3HD2 LEU 66 3HD2 LEU 66 -8.354 -1.144 2.387
503 H LYS 67 H LYS 67 -10.699 -1.350 -2.482
504 HA LYS 67 HA LYS 67 -12.094 -3.712 -2.071
505 1HB LYS 67 2HB LYS 67 -12.550 -1.291 -3.392
506 2HB LYS 67 1HB LYS 67 -12.771 -2.524 -4.628
507 1HG LYS 67 2HG LYS 67 -14.148 -3.589 -2.532
508 2HG LYS 67 1HG LYS 67 -14.420 -1.862 -2.301
509 1HD LYS 67 2HD LYS 67 -14.729 -2.462 -5.071
510 2HD LYS 67 1HD LYS 67 -15.678 -3.621 -4.137
511 1HE LYS 67 2HE LYS 67 -16.877 -1.877 -3.044
512 2HE LYS 67 1HE LYS 67 -15.796 -0.645 -3.694
513 1HZ LYS 67 1HZ LYS 67 -17.809 -0.630 -4.943
514 2HZ LYS 67 2HZ LYS 67 -17.737 -2.299 -5.214
515 3HZ LYS 67 3HZ LYS 67 -16.599 -1.274 -5.936
516 H GLN 68 H GLN 68 -10.151 -2.767 -4.902
517 HA GLN 68 HA GLN 68 -10.562 -5.224 -6.274
518 1HB GLN 68 2HB GLN 68 -8.380 -3.171 -6.634
519 2HB GLN 68 1HB GLN 68 -8.739 -4.477 -7.752
520 1HG GLN 68 2HG GLN 68 -10.660 -2.280 -7.034
521 2HG GLN 68 1HG GLN 68 -9.604 -2.268 -8.448
522 1HE2 GLN 68 1HE2 GLN 68 -10.675 -2.742 -10.212
523 2HE2 GLN 68 2HE2 GLN 68 -11.942 -3.908 -10.365
524 H ILE 69 H ILE 69 -8.254 -4.071 -3.938
525 HA ILE 69 HA ILE 69 -6.227 -5.954 -4.332
526 HB ILE 69 HB ILE 69 -7.017 -4.418 -1.863
527 1HG1 ILE 69 2HG1 ILE 69 -4.536 -3.980 -3.481
528 2HG1 ILE 69 1HG1 ILE 69 -6.067 -3.337 -4.069
529 1HG2 ILE 69 1HG2 ILE 69 -5.213 -6.637 -2.083
530 2HG2 ILE 69 2HG2 ILE 69 -5.647 -5.691 -0.660
531 3HG2 ILE 69 3HG2 ILE 69 -4.311 -5.173 -1.690
532 1HD1 ILE 69 1HD1 ILE 69 -5.970 -1.639 -2.640
533 2HD1 ILE 69 2HD1 ILE 69 -4.306 -2.128 -2.318
534 3HD1 ILE 69 3HD1 ILE 69 -5.610 -2.702 -1.281
535 H LYS 70 H LYS 70 -9.088 -6.048 -2.327
536 HA LYS 70 HA LYS 70 -8.447 -8.531 -1.102
537 1HB LYS 70 2HB LYS 70 -10.688 -8.434 -0.174
538 2HB LYS 70 1HB LYS 70 -9.915 -6.859 -0.046
539 1HG LYS 70 2HG LYS 70 -11.107 -6.214 -2.145
540 2HG LYS 70 1HG LYS 70 -12.022 -7.711 -2.008
541 1HD LYS 70 2HD LYS 70 -12.412 -6.769 0.451
542 2HD LYS 70 1HD LYS 70 -12.150 -5.236 -0.383
543 1HE LYS 70 2HE LYS 70 -13.869 -6.021 -2.069
544 2HE LYS 70 1HE LYS 70 -14.247 -7.321 -0.941
545 1HZ LYS 70 1HZ LYS 70 -15.529 -5.939 0.192
546 2HZ LYS 70 2HZ LYS 70 -15.220 -4.714 -0.932
547 3HZ LYS 70 3HZ LYS 70 -14.241 -4.869 0.440
548 H GLN 71 H GLN 71 -10.145 -7.571 -3.967
549 HA GLN 71 HA GLN 71 -11.314 -10.162 -4.367
550 1HB GLN 71 2HB GLN 71 -11.390 -7.577 -5.861
551 2HB GLN 71 1HB GLN 71 -11.946 -9.058 -6.632
552 1HG GLN 71 2HG GLN 71 -13.722 -9.308 -5.168
553 2HG GLN 71 1HG GLN 71 -12.994 -8.261 -3.953
554 1HE2 GLN 71 1HE2 GLN 71 -12.547 -5.968 -4.907
555 2HE2 GLN 71 2HE2 GLN 71 -13.895 -5.252 -5.713
556 H ARG 72 H ARG 72 -8.673 -8.317 -5.736
557 HA ARG 72 HA ARG 72 -8.085 -10.473 -7.608
558 1HB ARG 72 2HB ARG 72 -7.241 -7.629 -7.346
559 2HB ARG 72 1HB ARG 72 -6.173 -8.738 -8.192
560 1HG ARG 72 2HG ARG 72 -8.357 -9.362 -9.499
561 2HG ARG 72 1HG ARG 72 -8.889 -7.774 -8.939
562 1HD ARG 72 2HD ARG 72 -6.651 -6.921 -9.852
563 2HD ARG 72 1HD ARG 72 -6.560 -8.460 -10.703
564 HE ARG 72 HE ARG 72 -8.576 -6.365 -11.139
565 1HH1 ARG 72 1HH1 ARG 72 -7.003 -9.314 -12.165
566 2HH1 ARG 72 2HH1 ARG 72 -7.724 -9.295 -13.735
567 1HH2 ARG 72 1HH2 ARG 72 -9.531 -6.355 -13.206
568 2HH2 ARG 72 2HH2 ARG 72 -9.156 -7.620 -14.329
569 H HIS 73 H HIS 73 -6.869 -9.117 -4.659
570 HA HIS 73 HA HIS 73 -4.497 -10.841 -4.851
571 1HB HIS 73 2HB HIS 73 -4.755 -8.817 -2.674
572 2HB HIS 73 1HB HIS 73 -3.317 -9.386 -3.510
573 HD1 HIS 73 1HD HIS 73 -3.551 -6.433 -3.167
574 HD2 HIS 73 2HD HIS 73 -5.171 -8.390 -6.432
575 HE1 HIS 73 1HE HIS 73 -3.758 -4.695 -4.966
576 HE2 HIS 73 2HE HIS 73 -4.986 -5.857 -6.824
577 HA PRO 74 HA PRO 74 -6.327 -13.616 -1.910
578 1HB PRO 74 2HB PRO 74 -3.561 -14.353 -1.189
579 2HB PRO 74 1HB PRO 74 -4.853 -15.353 -1.855
580 1HG PRO 74 2HG PRO 74 -2.738 -14.619 -3.330
581 2HG PRO 74 1HG PRO 74 -4.358 -14.780 -4.033
582 1HD PRO 74 2HD PRO 74 -2.870 -12.307 -3.242
583 2HD PRO 74 1HD PRO 74 -3.904 -12.601 -4.656
584 H MET 75 H MET 75 -6.932 -11.702 -0.585
585 HA MET 75 HA MET 75 -6.963 -10.483 1.331
586 1HB MET 75 2HB MET 75 -6.957 -11.762 3.254
587 2HB MET 75 1HB MET 75 -7.170 -12.987 2.020
588 1HG MET 75 2HG MET 75 -4.446 -12.881 2.291
589 2HG MET 75 1HG MET 75 -5.013 -12.593 3.930
590 1HE MET 75 1HE MET 75 -4.236 -15.219 1.264
591 2HE MET 75 2HE MET 75 -4.233 -16.571 2.395
592 3HE MET 75 3HE MET 75 -3.275 -15.133 2.740
593 H LEU 76 H LEU 76 -4.906 -9.781 -0.279
594 HA LEU 76 HA LEU 76 -2.370 -9.711 0.959
595 1HB LEU 76 2HB LEU 76 -3.075 -9.311 -1.504
596 2HB LEU 76 1HB LEU 76 -3.335 -7.654 -0.996
597 HG LEU 76 HG LEU 76 -0.876 -7.846 -0.107
598 1HD1 LEU 76 1HD1 LEU 76 -0.376 -9.592 -2.408
599 2HD1 LEU 76 2HD1 LEU 76 -1.119 -10.387 -1.020
600 3HD1 LEU 76 3HD1 LEU 76 0.412 -9.533 -0.830
601 1HD2 LEU 76 1HD2 LEU 76 -0.703 -6.319 -1.701
602 2HD2 LEU 76 2HD2 LEU 76 -2.071 -7.008 -2.569
603 3HD2 LEU 76 3HD2 LEU 76 -0.444 -7.608 -2.873
604 HA PRO 77 HA PRO 77 -3.034 -6.508 3.989
605 1HB PRO 77 2HB PRO 77 -0.442 -5.780 4.383
606 2HB PRO 77 1HB PRO 77 -1.134 -7.265 5.045
607 1HG PRO 77 2HG PRO 77 0.518 -6.885 2.573
608 2HG PRO 77 1HG PRO 77 0.651 -8.138 3.823
609 1HD PRO 77 2HD PRO 77 -0.565 -8.611 1.475
610 2HD PRO 77 1HD PRO 77 -1.136 -9.345 2.985
611 H VAL 78 H VAL 78 -3.740 -4.508 3.574
612 HA VAL 78 HA VAL 78 -2.365 -2.930 1.503
613 HB VAL 78 HB VAL 78 -5.141 -2.354 2.491
614 1HG1 VAL 78 1HG1 VAL 78 -3.512 -1.604 0.086
615 2HG1 VAL 78 2HG1 VAL 78 -4.243 -0.549 1.297
616 3HG1 VAL 78 3HG1 VAL 78 -5.262 -1.401 0.138
617 1HG2 VAL 78 1HG2 VAL 78 -6.020 -3.613 0.581
618 2HG2 VAL 78 2HG2 VAL 78 -5.152 -4.664 1.703
619 3HG2 VAL 78 3HG2 VAL 78 -4.388 -4.161 0.197
620 H ILE 79 H ILE 79 -1.806 -0.837 1.870
621 HA ILE 79 HA ILE 79 -2.275 0.258 4.552
622 HB ILE 79 HB ILE 79 0.375 0.422 3.117
623 1HG1 ILE 79 2HG1 ILE 79 0.533 -0.974 5.603
624 2HG1 ILE 79 1HG1 ILE 79 -0.728 -1.725 4.633
625 1HG2 ILE 79 1HG2 ILE 79 1.080 1.798 4.751
626 2HG2 ILE 79 2HG2 ILE 79 0.171 0.943 5.997
627 3HG2 ILE 79 3HG2 ILE 79 -0.642 2.121 4.966
628 1HD1 ILE 79 1HD1 ILE 79 2.068 -1.210 3.663
629 2HD1 ILE 79 2HD1 ILE 79 0.809 -2.143 2.853
630 3HD1 ILE 79 3HD1 ILE 79 1.508 -2.729 4.361
631 H ILE 80 H ILE 80 -3.408 2.045 4.257
632 HA ILE 80 HA ILE 80 -2.980 3.626 1.827
633 HB ILE 80 HB ILE 80 -5.221 3.956 3.812
634 1HG1 ILE 80 2HG1 ILE 80 -5.113 1.622 2.897
635 2HG1 ILE 80 1HG1 ILE 80 -6.570 2.494 2.439
636 1HG2 ILE 80 1HG2 ILE 80 -5.636 4.536 0.978
637 2HG2 ILE 80 2HG2 ILE 80 -4.418 5.545 1.759
638 3HG2 ILE 80 3HG2 ILE 80 -6.053 5.477 2.406
639 1HD1 ILE 80 1HD1 ILE 80 -6.073 2.431 0.263
640 2HD1 ILE 80 2HD1 ILE 80 -5.013 1.103 0.733
641 3HD1 ILE 80 3HD1 ILE 80 -4.359 2.728 0.543
642 H MET 81 H MET 81 -2.437 5.786 1.864
643 HA MET 81 HA MET 81 -1.072 6.690 4.240
644 1HB MET 81 2HB MET 81 -0.335 8.567 2.825
645 2HB MET 81 1HB MET 81 -0.013 7.000 2.095
646 1HG MET 81 2HG MET 81 -1.701 7.256 0.508
647 2HG MET 81 1HG MET 81 -2.468 8.565 1.399
648 1HE MET 81 1HE MET 81 -1.148 10.861 1.883
649 2HE MET 81 2HE MET 81 0.188 11.451 0.891
650 3HE MET 81 3HE MET 81 0.470 10.192 2.092
651 H THR 82 H THR 82 -4.165 7.271 2.812
652 HA THR 82 HA THR 82 -4.768 9.150 4.950
653 HB THR 82 HB THR 82 -5.554 9.899 2.150
654 HG1 THR 82 1HG THR 82 -3.458 10.158 1.914
655 1HG2 THR 82 1HG2 THR 82 -5.493 11.301 4.787
656 2HG2 THR 82 2HG2 THR 82 -6.812 11.167 3.620
657 3HG2 THR 82 3HG2 THR 82 -5.427 12.208 3.275
658 H ALA 83 H ALA 83 -7.084 9.497 5.257
659 HA ALA 83 HA ALA 83 -8.791 7.518 3.922
660 1HB ALA 83 1HB ALA 83 -7.768 7.004 6.380
661 2HB ALA 83 2HB ALA 83 -9.288 6.348 5.770
662 3HB ALA 83 3HB ALA 83 -9.294 7.781 6.800
663 H HIS 84 H HIS 84 -9.283 9.804 2.944
664 HA HIS 84 HA HIS 84 -11.117 11.315 4.663
665 1HB HIS 84 2HB HIS 84 -11.025 13.019 2.846
666 2HB HIS 84 1HB HIS 84 -9.450 12.659 3.554
667 HD1 HIS 84 1HD HIS 84 -11.346 12.542 0.386
668 HD2 HIS 84 2HD HIS 84 -7.708 11.162 1.846
669 HE1 HIS 84 1HE HIS 84 -10.026 11.851 -1.633
670 HE2 HIS 84 2HE HIS 84 -7.786 11.138 -0.740
671 H SER 85 H SER 85 -13.225 10.969 4.538
672 HA SER 85 HA SER 85 -15.275 10.307 3.821
673 1HB SER 85 2HB SER 85 -14.155 11.962 1.778
674 2HB SER 85 1HB SER 85 -15.109 10.695 1.007
675 HG SER 85 HG SER 85 -15.993 12.875 2.181
676 H ASP 86 H ASP 86 -16.503 8.813 2.367
677 HA ASP 86 HA ASP 86 -16.860 6.672 1.679
678 1HB ASP 86 2HB ASP 86 -15.267 7.857 -0.166
679 2HB ASP 86 1HB ASP 86 -14.269 6.473 0.271
680 H LEU 87 H LEU 87 -15.303 7.119 4.155
681 HA LEU 87 HA LEU 87 -13.204 5.348 4.501
682 1HB LEU 87 2HB LEU 87 -14.626 7.056 6.099
683 2HB LEU 87 1HB LEU 87 -15.054 5.494 6.769
684 HG LEU 87 HG LEU 87 -13.183 6.363 7.991
685 1HD1 LEU 87 1HD1 LEU 87 -11.837 4.380 6.231
686 2HD1 LEU 87 2HD1 LEU 87 -13.277 3.891 7.128
687 3HD1 LEU 87 3HD1 LEU 87 -11.862 4.498 7.992
688 1HD2 LEU 87 1HD2 LEU 87 -11.235 7.216 7.076
689 2HD2 LEU 87 2HD2 LEU 87 -12.471 7.810 5.966
690 3HD2 LEU 87 3HD2 LEU 87 -11.490 6.411 5.527
691 H ASP 88 H ASP 88 -16.560 4.707 4.120
692 HA ASP 88 HA ASP 88 -16.955 2.310 5.401
693 1HB ASP 88 2HB ASP 88 -18.067 3.523 2.912
694 2HB ASP 88 1HB ASP 88 -18.452 1.842 3.269
695 H ALA 89 H ALA 89 -15.272 2.868 2.350
696 HA ALA 89 HA ALA 89 -15.089 0.137 1.625
697 1HB ALA 89 1HB ALA 89 -13.660 2.612 0.738
698 2HB ALA 89 2HB ALA 89 -14.818 1.620 -0.147
699 3HB ALA 89 3HB ALA 89 -13.184 1.019 0.145
700 H ALA 90 H ALA 90 -13.327 2.118 3.819
701 HA ALA 90 HA ALA 90 -10.917 0.592 3.880
702 1HB ALA 90 1HB ALA 90 -12.033 2.430 5.994
703 2HB ALA 90 2HB ALA 90 -11.028 2.933 4.636
704 3HB ALA 90 3HB ALA 90 -10.365 1.862 5.872
705 H VAL 91 H VAL 91 -13.999 0.395 5.518
706 HA VAL 91 HA VAL 91 -13.179 -1.289 7.624
707 HB VAL 91 HB VAL 91 -15.946 -1.296 6.460
708 1HG1 VAL 91 1HG1 VAL 91 -16.215 -1.379 9.141
709 2HG1 VAL 91 2HG1 VAL 91 -14.656 -2.189 8.956
710 3HG1 VAL 91 3HG1 VAL 91 -16.082 -2.815 8.125
711 1HG2 VAL 91 1HG2 VAL 91 -15.872 0.523 8.588
712 2HG2 VAL 91 2HG2 VAL 91 -16.124 0.885 6.882
713 3HG2 VAL 91 3HG2 VAL 91 -14.499 0.938 7.563
714 H SER 92 H SER 92 -14.616 -2.010 4.451
715 HA SER 92 HA SER 92 -14.795 -4.789 4.751
716 1HB SER 92 2HB SER 92 -14.083 -3.519 2.115
717 2HB SER 92 1HB SER 92 -15.134 -4.899 2.426
718 HG SER 92 HG SER 92 -16.749 -3.587 2.687
719 H ALA 93 H ALA 93 -12.152 -2.710 3.784
720 HA ALA 93 HA ALA 93 -10.332 -4.594 2.875
721 1HB ALA 93 1HB ALA 93 -9.953 -2.259 2.549
722 2HB ALA 93 2HB ALA 93 -8.613 -2.914 3.486
723 3HB ALA 93 3HB ALA 93 -9.877 -1.984 4.289
724 H TYR 94 H TYR 94 -10.982 -3.483 6.140
725 HA TYR 94 HA TYR 94 -8.886 -4.809 7.440
726 1HB TYR 94 2HB TYR 94 -11.645 -4.349 8.584
727 2HB TYR 94 1HB TYR 94 -10.143 -4.546 9.479
728 HD1 TYR 94 1HD TYR 94 -12.359 -2.226 9.257
729 HD2 TYR 94 2HD TYR 94 -8.371 -2.752 7.868
730 HE1 TYR 94 1HE TYR 94 -12.046 0.215 9.244
731 HE2 TYR 94 2HE TYR 94 -8.048 -0.315 7.848
732 HH TYR 94 HH TYR 94 -8.960 1.674 8.246
733 H GLN 95 H GLN 95 -11.774 -5.971 6.011
734 HA GLN 95 HA GLN 95 -11.927 -8.421 7.478
735 1HB GLN 95 2HB GLN 95 -13.901 -8.690 6.436
736 2HB GLN 95 1HB GLN 95 -13.665 -7.048 5.864
737 1HG GLN 95 2HG GLN 95 -12.344 -8.498 3.962
738 2HG GLN 95 1HG GLN 95 -13.662 -9.577 4.397
739 1HE2 GLN 95 1HE2 GLN 95 -12.894 -7.668 2.091
740 2HE2 GLN 95 2HE2 GLN 95 -14.382 -6.862 1.743
741 H GLN 96 H GLN 96 -10.540 -7.423 4.393
742 HA GLN 96 HA GLN 96 -9.702 -10.078 3.711
743 1HB GLN 96 2HB GLN 96 -8.615 -9.062 1.794
744 2HB GLN 96 1HB GLN 96 -10.244 -8.420 1.974
745 1HG GLN 96 2HG GLN 96 -9.522 -6.332 2.399
746 2HG GLN 96 1HG GLN 96 -8.116 -6.886 3.306
747 1HE2 GLN 96 1HE2 GLN 96 -8.604 -4.932 1.019
748 2HE2 GLN 96 2HE2 GLN 96 -7.398 -5.350 -0.143
749 H GLY 97 H GLY 97 -8.508 -7.730 5.817
750 1HA GLY 97 2HA GLY 97 -6.652 -8.361 7.238
751 2HA GLY 97 1HA GLY 97 -5.900 -9.099 5.834
752 H ALA 98 H ALA 98 -7.416 -5.925 5.777
753 HA ALA 98 HA ALA 98 -5.187 -4.693 4.602
754 1HB ALA 98 1HB ALA 98 -7.714 -3.708 5.818
755 2HB ALA 98 2HB ALA 98 -7.095 -3.515 4.179
756 3HB ALA 98 3HB ALA 98 -6.426 -2.549 5.491
757 H PHE 99 H PHE 99 -3.586 -3.317 5.435
758 HA PHE 99 HA PHE 99 -2.705 -3.982 8.047
759 1HB PHE 99 2HB PHE 99 -1.303 -3.295 5.964
760 2HB PHE 99 1HB PHE 99 -1.594 -1.651 6.528
761 HD1 PHE 99 1HD PHE 99 -0.412 -4.951 7.775
762 HD2 PHE 99 2HD PHE 99 -0.129 -0.713 8.042
763 HE1 PHE 99 1HE PHE 99 1.439 -5.181 9.378
764 HE2 PHE 99 2HE PHE 99 1.728 -0.935 9.644
765 HZ PHE 99 HZ PHE 99 2.515 -3.172 10.313
766 H ASP 100 H ASP 100 -3.801 -0.876 6.644
767 HA ASP 100 HA ASP 100 -5.443 -0.040 8.664
768 1HB ASP 100 2HB ASP 100 -3.989 1.456 10.043
769 2HB ASP 100 1HB ASP 100 -3.623 -0.247 10.264
770 H TYR 101 H TYR 101 -4.885 2.605 9.038
771 HA TYR 101 HA TYR 101 -4.538 3.730 6.352
772 1HB TYR 101 2HB TYR 101 -6.932 3.839 8.093
773 2HB TYR 101 1HB TYR 101 -6.452 5.373 7.374
774 HD1 TYR 101 1HD TYR 101 -7.507 1.904 6.607
775 HD2 TYR 101 2HD TYR 101 -6.808 5.827 5.097
776 HE1 TYR 101 1HE TYR 101 -8.657 1.307 4.511
777 HE2 TYR 101 2HE TYR 101 -7.946 5.237 3.003
778 HH TYR 101 HH TYR 101 -8.687 3.442 1.744
779 H LEU 102 H LEU 102 -3.865 5.930 6.339
780 HA LEU 102 HA LEU 102 -2.552 6.733 8.839
781 1HB LEU 102 2HB LEU 102 -1.733 6.698 6.091
782 2HB LEU 102 1HB LEU 102 -1.674 8.342 6.694
783 HG LEU 102 HG LEU 102 -0.145 7.724 8.443
784 1HD1 LEU 102 1HD1 LEU 102 0.763 5.282 8.250
785 2HD1 LEU 102 2HD1 LEU 102 -0.846 4.957 7.605
786 3HD1 LEU 102 3HD1 LEU 102 -0.664 5.636 9.224
787 1HD2 LEU 102 1HD2 LEU 102 1.669 6.608 6.936
788 2HD2 LEU 102 2HD2 LEU 102 1.090 8.236 6.581
789 3HD2 LEU 102 3HD2 LEU 102 0.477 6.862 5.660
790 HA PRO 103 HA PRO 103 -5.733 9.900 8.989
791 1HB PRO 103 2HB PRO 103 -4.220 10.956 11.268
792 2HB PRO 103 1HB PRO 103 -5.861 10.310 11.216
793 1HG PRO 103 2HG PRO 103 -3.820 8.998 12.405
794 2HG PRO 103 1HG PRO 103 -5.169 8.157 11.620
795 1HD PRO 103 2HD PRO 103 -2.391 8.637 10.621
796 2HD PRO 103 1HD PRO 103 -3.423 7.201 10.451
797 H LYS 104 H LYS 104 -2.625 11.166 10.162
798 HA LYS 104 HA LYS 104 -2.780 13.242 8.085
799 1HB LYS 104 2HB LYS 104 -2.353 13.462 11.004
800 2HB LYS 104 1HB LYS 104 -1.357 14.502 9.992
801 1HG LYS 104 2HG LYS 104 -3.068 15.847 9.496
802 2HG LYS 104 1HG LYS 104 -4.159 14.493 9.205
803 1HD LYS 104 2HD LYS 104 -4.636 14.287 11.540
804 2HD LYS 104 1HD LYS 104 -3.376 15.448 11.956
805 1HE LYS 104 2HE LYS 104 -4.684 17.221 11.492
806 2HE LYS 104 1HE LYS 104 -5.398 16.450 10.077
807 1HZ LYS 104 1HZ LYS 104 -6.708 15.068 11.709
808 2HZ LYS 104 2HZ LYS 104 -7.125 16.705 11.628
809 3HZ LYS 104 3HZ LYS 104 -6.188 16.136 12.915
810 HA PRO 105 HA PRO 105 2.011 12.622 9.041
811 1HB PRO 105 2HB PRO 105 2.397 10.067 10.140
812 2HB PRO 105 1HB PRO 105 2.588 11.605 10.983
813 1HG PRO 105 2HG PRO 105 0.266 9.736 10.952
814 2HG PRO 105 1HG PRO 105 0.899 10.724 12.284
815 1HD PRO 105 2HD PRO 105 -1.314 11.446 10.994
816 2HD PRO 105 1HD PRO 105 -0.124 12.664 11.493
817 H PHE 106 H PHE 106 3.469 11.378 7.734
818 HA PHE 106 HA PHE 106 2.691 9.017 6.396
819 1HB PHE 106 2HB PHE 106 1.149 10.517 5.223
820 2HB PHE 106 1HB PHE 106 2.481 11.577 4.784
821 HD1 PHE 106 1HD PHE 106 3.134 11.433 2.600
822 HD2 PHE 106 2HD PHE 106 1.713 7.922 4.539
823 HE1 PHE 106 1HE PHE 106 3.467 10.156 0.525
824 HE2 PHE 106 2HE PHE 106 2.048 6.639 2.471
825 HZ PHE 106 HZ PHE 106 2.924 7.755 0.460
826 H ASP 107 H ASP 107 4.301 11.253 4.306
827 HA ASP 107 HA ASP 107 6.416 11.143 3.440
828 1HB ASP 107 2HB ASP 107 8.133 11.835 5.013
829 2HB ASP 107 1HB ASP 107 6.639 12.703 5.350
830 H ILE 108 H ILE 108 8.713 10.083 3.778
831 HA ILE 108 HA ILE 108 8.295 7.292 3.620
832 HB ILE 108 HB ILE 108 10.447 9.088 3.071
833 1HG1 ILE 108 2HG1 ILE 108 11.040 7.381 1.468
834 2HG1 ILE 108 1HG1 ILE 108 10.055 6.199 2.317
835 1HG2 ILE 108 1HG2 ILE 108 11.178 6.598 4.586
836 2HG2 ILE 108 2HG2 ILE 108 11.632 8.259 4.964
837 3HG2 ILE 108 3HG2 ILE 108 12.304 7.459 3.539
838 1HD1 ILE 108 1HD1 ILE 108 8.919 8.683 1.070
839 2HD1 ILE 108 2HD1 ILE 108 8.051 7.267 1.665
840 3HD1 ILE 108 3HD1 ILE 108 9.059 7.143 0.222
841 H ASP 109 H ASP 109 9.645 9.355 6.079
842 HA ASP 109 HA ASP 109 10.703 7.520 7.828
843 1HB ASP 109 2HB ASP 109 9.779 10.254 7.981
844 2HB ASP 109 1HB ASP 109 9.439 9.393 9.478
845 H GLU 110 H GLU 110 7.343 8.762 8.004
846 HA GLU 110 HA GLU 110 6.616 6.754 9.891
847 1HB GLU 110 2HB GLU 110 4.821 8.636 8.364
848 2HB GLU 110 1HB GLU 110 4.370 7.689 9.771
849 1HG GLU 110 2HG GLU 110 6.518 9.791 9.782
850 2HG GLU 110 1HG GLU 110 4.837 10.091 10.223
851 H ALA 111 H ALA 111 6.324 7.128 6.432
852 HA ALA 111 HA ALA 111 4.406 5.078 6.046
853 1HB ALA 111 1HB ALA 111 6.480 5.896 4.023
854 2HB ALA 111 2HB ALA 111 5.037 6.857 4.366
855 3HB ALA 111 3HB ALA 111 4.876 5.218 3.732
856 H VAL 112 H VAL 112 7.924 5.088 5.488
857 HA VAL 112 HA VAL 112 8.165 2.326 5.069
858 HB VAL 112 HB VAL 112 10.266 4.201 6.163
859 1HG1 VAL 112 1HG1 VAL 112 11.200 2.062 4.466
860 2HG1 VAL 112 2HG1 VAL 112 10.313 1.430 5.854
861 3HG1 VAL 112 3HG1 VAL 112 11.697 2.496 6.103
862 1HG2 VAL 112 1HG2 VAL 112 9.986 5.228 4.176
863 2HG2 VAL 112 2HG2 VAL 112 9.105 3.868 3.485
864 3HG2 VAL 112 3HG2 VAL 112 10.867 3.843 3.535
865 H ALA 113 H ALA 113 8.094 4.263 7.946
866 HA ALA 113 HA ALA 113 9.061 2.379 9.799
867 1HB ALA 113 1HB ALA 113 7.016 4.554 10.197
868 2HB ALA 113 2HB ALA 113 8.765 4.752 10.331
869 3HB ALA 113 3HB ALA 113 7.904 3.726 11.477
870 H LEU 114 H LEU 114 5.845 3.142 8.616
871 HA LEU 114 HA LEU 114 4.523 1.168 10.168
872 1HB LEU 114 2HB LEU 114 3.377 3.180 9.506
873 2HB LEU 114 1HB LEU 114 3.647 2.821 7.813
874 HG LEU 114 HG LEU 114 2.249 0.641 8.440
875 1HD1 LEU 114 1HD1 LEU 114 1.619 0.797 10.605
876 2HD1 LEU 114 2HD1 LEU 114 0.330 1.785 9.916
877 3HD1 LEU 114 3HD1 LEU 114 1.749 2.557 10.631
878 1HD2 LEU 114 1HD2 LEU 114 0.251 1.824 7.644
879 2HD2 LEU 114 2HD2 LEU 114 1.682 2.214 6.685
880 3HD2 LEU 114 3HD2 LEU 114 1.081 3.362 7.883
881 H VAL 115 H VAL 115 6.107 1.162 7.099
882 HA VAL 115 HA VAL 115 4.754 -1.183 6.132
883 HB VAL 115 HB VAL 115 5.839 0.631 4.656
884 1HG1 VAL 115 1HG1 VAL 115 8.088 0.352 5.831
885 2HG1 VAL 115 2HG1 VAL 115 8.101 0.435 4.073
886 3HG1 VAL 115 3HG1 VAL 115 8.268 -1.124 4.885
887 1HG2 VAL 115 1HG2 VAL 115 6.342 -1.047 2.897
888 2HG2 VAL 115 2HG2 VAL 115 4.813 -1.338 3.731
889 3HG2 VAL 115 3HG2 VAL 115 6.233 -2.312 4.123
890 H GLU 116 H GLU 116 7.908 -0.493 7.566
891 HA GLU 116 HA GLU 116 9.021 -3.042 7.287
892 1HB GLU 116 2HB GLU 116 9.506 -0.900 9.360
893 2HB GLU 116 1HB GLU 116 10.480 -2.359 9.222
894 1HG GLU 116 2HG GLU 116 10.868 -1.641 6.795
895 2HG GLU 116 1HG GLU 116 10.249 -0.072 7.302
896 H ARG 117 H ARG 117 7.292 -1.646 10.093
897 HA ARG 117 HA ARG 117 7.409 -3.914 11.707
898 1HB ARG 117 2HB ARG 117 5.577 -2.963 12.977
899 2HB ARG 117 1HB ARG 117 6.710 -1.698 12.525
900 1HG ARG 117 2HG ARG 117 5.248 -0.871 10.848
901 2HG ARG 117 1HG ARG 117 4.181 -2.267 11.004
902 1HD ARG 117 2HD ARG 117 3.046 -1.289 12.645
903 2HD ARG 117 1HD ARG 117 4.521 -0.986 13.554
904 HE ARG 117 HE ARG 117 3.272 0.836 11.621
905 1HH1 ARG 117 1HH1 ARG 117 5.639 0.254 14.127
906 2HH1 ARG 117 2HH1 ARG 117 6.036 1.928 14.306
907 1HH2 ARG 117 1HH2 ARG 117 3.805 3.035 11.857
908 2HH2 ARG 117 2HH2 ARG 117 5.004 3.504 13.015
909 H ALA 118 H ALA 118 5.489 -3.272 8.929
910 HA ALA 118 HA ALA 118 3.415 -5.145 9.425
911 1HB ALA 118 1HB ALA 118 3.359 -3.231 7.765
912 2HB ALA 118 2HB ALA 118 2.733 -4.778 7.192
913 3HB ALA 118 3HB ALA 118 4.344 -4.246 6.711
914 H ILE 119 H ILE 119 6.444 -5.271 7.586
915 HA ILE 119 HA ILE 119 6.091 -7.989 6.798
916 HB ILE 119 HB ILE 119 8.633 -6.381 6.762
917 1HG1 ILE 119 2HG1 ILE 119 7.020 -6.624 4.297
918 2HG1 ILE 119 1HG1 ILE 119 6.365 -5.563 5.542
919 1HG2 ILE 119 1HG2 ILE 119 9.079 -8.680 6.356
920 2HG2 ILE 119 2HG2 ILE 119 9.141 -7.843 4.805
921 3HG2 ILE 119 3HG2 ILE 119 7.726 -8.806 5.231
922 1HD1 ILE 119 1HD1 ILE 119 8.062 -4.067 5.357
923 2HD1 ILE 119 2HD1 ILE 119 7.998 -4.671 3.698
924 3HD1 ILE 119 3HD1 ILE 119 9.223 -5.283 4.815
925 H SER 120 H SER 120 7.759 -6.308 9.343
926 HA SER 120 HA SER 120 9.379 -8.431 10.244
927 1HB SER 120 2HB SER 120 8.411 -5.862 11.443
928 2HB SER 120 1HB SER 120 9.218 -7.048 12.472
929 HG SER 120 HG SER 120 10.232 -5.526 10.361
930 H HIS 121 H HIS 121 6.188 -7.282 11.290
931 HA HIS 121 HA HIS 121 5.868 -9.273 13.291
932 1HB HIS 121 2HB HIS 121 4.126 -7.224 12.013
933 2HB HIS 121 1HB HIS 121 3.342 -8.541 12.880
934 HD1 HIS 121 1HD HIS 121 6.211 -6.140 13.619
935 HD2 HIS 121 2HD HIS 121 2.900 -7.860 15.448
936 HE1 HIS 121 1HE HIS 121 6.167 -5.197 15.951
937 HE2 HIS 121 2HE HIS 121 4.112 -6.196 17.014
938 H TYR 122 H TYR 122 5.192 -9.117 9.898
939 HA TYR 122 HA TYR 122 3.504 -11.428 9.853
940 1HB TYR 122 2HB TYR 122 3.372 -9.553 8.188
941 2HB TYR 122 1HB TYR 122 4.905 -10.110 7.526
942 HD1 TYR 122 1HD TYR 122 1.772 -11.855 8.598
943 HD2 TYR 122 2HD TYR 122 4.586 -11.139 5.488
944 HE1 TYR 122 1HE TYR 122 0.564 -13.430 7.149
945 HE2 TYR 122 2HE TYR 122 3.386 -12.712 4.030
946 HH TYR 122 HH TYR 122 0.281 -13.953 4.827
947 H GLN 123 H GLN 123 6.878 -10.713 9.108
948 HA GLN 123 HA GLN 123 7.485 -13.363 8.241
949 1HB GLN 123 2HB GLN 123 8.691 -11.072 7.748
950 2HB GLN 123 1HB GLN 123 9.588 -11.471 9.206
951 1HG GLN 123 2HG GLN 123 10.823 -12.996 8.159
952 2HG GLN 123 1HG GLN 123 9.425 -13.695 7.344
953 1HE2 GLN 123 1HE2 GLN 123 11.623 -10.926 7.248
954 2HE2 GLN 123 2HE2 GLN 123 11.597 -10.741 5.530
955 H GLU 124 H GLU 124 9.608 -14.318 9.414
956 HA GLU 124 HA GLU 124 9.101 -14.354 12.311
957 1HB GLU 124 2HB GLU 124 8.044 -16.328 11.218
958 2HB GLU 124 1HB GLU 124 9.626 -16.795 10.608
959 1HG GLU 124 2HG GLU 124 9.800 -18.028 12.446
960 2HG GLU 124 1HG GLU 124 10.089 -16.506 13.291
Start of MODEL 18
1 1H MET 1 1HT MET 1 10.988 -19.105 3.367
2 2H MET 1 2HT MET 1 9.643 -18.629 2.413
3 3H MET 1 3HT MET 1 9.448 -18.918 4.093
4 HA MET 1 HA MET 1 9.558 -16.719 4.163
5 1HB MET 1 2HB MET 1 12.226 -17.970 4.375
6 2HB MET 1 1HB MET 1 12.233 -16.218 4.216
7 1HG MET 1 2HG MET 1 10.464 -17.532 6.229
8 2HG MET 1 1HG MET 1 12.180 -17.304 6.563
9 1HE MET 1 1HE MET 1 13.263 -14.600 6.043
10 2HE MET 1 2HE MET 1 13.108 -15.405 7.604
11 3HE MET 1 3HE MET 1 12.603 -13.725 7.423
12 H GLN 2 H GLN 2 9.281 -14.995 2.908
13 HA GLN 2 HA GLN 2 10.267 -15.056 0.181
14 1HB GLN 2 2HB GLN 2 8.360 -13.257 1.669
15 2HB GLN 2 1HB GLN 2 8.916 -12.879 0.046
16 1HG GLN 2 2HG GLN 2 6.963 -13.956 -0.418
17 2HG GLN 2 1HG GLN 2 8.095 -15.305 -0.477
18 1HE2 GLN 2 1HE2 GLN 2 6.837 -16.953 0.154
19 2HE2 GLN 2 2HE2 GLN 2 6.015 -17.041 1.670
20 H ARG 3 H ARG 3 11.400 -13.256 -0.775
21 HA ARG 3 HA ARG 3 13.555 -12.350 0.830
22 1HB ARG 3 2HB ARG 3 14.152 -11.021 -1.232
23 2HB ARG 3 1HB ARG 3 14.015 -12.758 -1.458
24 1HG ARG 3 2HG ARG 3 12.278 -12.570 -2.866
25 2HG ARG 3 1HG ARG 3 11.544 -11.253 -1.947
26 1HD ARG 3 2HD ARG 3 12.516 -9.674 -3.204
27 2HD ARG 3 1HD ARG 3 14.053 -10.535 -3.269
28 HE ARG 3 HE ARG 3 12.079 -10.481 -5.279
29 1HH1 ARG 3 1HH1 ARG 3 14.281 -12.690 -3.714
30 2HH1 ARG 3 2HH1 ARG 3 14.430 -13.720 -5.098
31 1HH2 ARG 3 1HH2 ARG 3 12.273 -11.832 -7.101
32 2HH2 ARG 3 2HH2 ARG 3 13.291 -13.233 -7.022
33 H GLY 4 H GLY 4 10.437 -11.249 0.698
34 1HA GLY 4 2HA GLY 4 9.567 -9.409 1.825
35 2HA GLY 4 1HA GLY 4 11.190 -8.743 1.941
36 H ILE 5 H ILE 5 8.387 -9.131 -0.131
37 HA ILE 5 HA ILE 5 9.507 -7.178 -2.007
38 HB ILE 5 HB ILE 5 6.950 -8.738 -2.342
39 1HG1 ILE 5 2HG1 ILE 5 8.600 -9.976 -4.034
40 2HG1 ILE 5 1HG1 ILE 5 9.790 -9.494 -2.830
41 1HG2 ILE 5 1HG2 ILE 5 7.756 -6.559 -3.686
42 2HG2 ILE 5 2HG2 ILE 5 6.806 -7.853 -4.418
43 3HG2 ILE 5 3HG2 ILE 5 8.556 -7.810 -4.638
44 1HD1 ILE 5 1HD1 ILE 5 7.334 -10.795 -1.832
45 2HD1 ILE 5 2HD1 ILE 5 9.003 -10.936 -1.281
46 3HD1 ILE 5 3HD1 ILE 5 8.476 -11.799 -2.726
47 H VAL 6 H VAL 6 9.066 -5.143 -1.588
48 HA VAL 6 HA VAL 6 6.502 -4.464 -0.318
49 HB VAL 6 HB VAL 6 8.418 -3.644 0.929
50 1HG1 VAL 6 1HG1 VAL 6 9.242 -2.101 -1.521
51 2HG1 VAL 6 2HG1 VAL 6 9.976 -3.625 -1.030
52 3HG1 VAL 6 3HG1 VAL 6 10.096 -2.217 0.015
53 1HG2 VAL 6 1HG2 VAL 6 7.566 -1.581 1.335
54 2HG2 VAL 6 2HG2 VAL 6 6.277 -2.191 0.297
55 3HG2 VAL 6 3HG2 VAL 6 7.527 -1.139 -0.373
56 H TRP 7 H TRP 7 4.962 -3.655 -1.615
57 HA TRP 7 HA TRP 7 5.826 -2.325 -4.096
58 1HB TRP 7 2HB TRP 7 3.442 -4.048 -3.497
59 2HB TRP 7 1HB TRP 7 3.377 -2.864 -4.807
60 HD1 TRP 7 HD1 TRP 7 6.773 -4.352 -4.395
61 HE1 TRP 7 1HE TRP 7 7.229 -6.053 -6.265
62 HE3 TRP 7 3HE TRP 7 2.029 -4.775 -6.284
63 HZ2 TRP 7 2HZ TRP 7 5.775 -7.397 -8.271
64 HZ3 TRP 7 3HZ TRP 7 1.657 -6.298 -8.178
65 HH2 TRP 7 HH2 TRP 7 3.492 -7.583 -9.149
66 H VAL 8 H VAL 8 5.048 -0.341 -4.612
67 HA VAL 8 HA VAL 8 3.270 0.929 -2.635
68 HB VAL 8 HB VAL 8 5.187 2.703 -3.998
69 1HG1 VAL 8 1HG1 VAL 8 5.318 3.568 -1.647
70 2HG1 VAL 8 2HG1 VAL 8 4.117 2.375 -1.223
71 3HG1 VAL 8 3HG1 VAL 8 3.731 3.631 -2.394
72 1HG2 VAL 8 1HG2 VAL 8 6.756 1.943 -1.906
73 2HG2 VAL 8 2HG2 VAL 8 6.994 1.434 -3.578
74 3HG2 VAL 8 3HG2 VAL 8 6.128 0.388 -2.453
75 H VAL 9 H VAL 9 1.868 2.537 -3.389
76 HA VAL 9 HA VAL 9 1.703 2.801 -6.312
77 HB VAL 9 HB VAL 9 -0.922 3.080 -5.179
78 1HG1 VAL 9 1HG1 VAL 9 -1.384 1.229 -6.823
79 2HG1 VAL 9 2HG1 VAL 9 0.341 1.180 -7.136
80 3HG1 VAL 9 3HG1 VAL 9 -0.572 2.640 -7.495
81 1HG2 VAL 9 1HG2 VAL 9 -0.663 1.592 -3.453
82 2HG2 VAL 9 2HG2 VAL 9 0.615 0.693 -4.268
83 3HG2 VAL 9 3HG2 VAL 9 -1.064 0.478 -4.753
84 H ASP 10 H ASP 10 2.080 4.826 -6.837
85 HA ASP 10 HA ASP 10 0.642 7.032 -5.760
86 1HB ASP 10 2HB ASP 10 2.573 6.310 -4.070
87 2HB ASP 10 1HB ASP 10 3.525 7.303 -5.158
88 H ASP 11 H ASP 11 2.847 8.916 -6.246
89 HA ASP 11 HA ASP 11 2.398 9.405 -8.979
90 1HB ASP 11 2HB ASP 11 4.560 10.569 -7.222
91 2HB ASP 11 1HB ASP 11 3.958 11.253 -8.728
92 H ASP 12 H ASP 12 4.409 7.108 -7.675
93 HA ASP 12 HA ASP 12 5.972 5.743 -8.601
94 1HB ASP 12 2HB ASP 12 4.468 6.447 -10.714
95 2HB ASP 12 1HB ASP 12 6.007 7.123 -11.227
96 H SER 13 H SER 13 6.771 8.583 -10.584
97 HA SER 13 HA SER 13 9.450 8.473 -10.505
98 1HB SER 13 2HB SER 13 7.559 10.422 -11.211
99 2HB SER 13 1HB SER 13 8.746 11.241 -10.198
100 HG SER 13 HG SER 13 9.539 9.543 -12.308
101 H SER 14 H SER 14 8.018 10.937 -8.455
102 HA SER 14 HA SER 14 10.199 11.320 -6.817
103 1HB SER 14 2HB SER 14 7.929 12.622 -7.015
104 2HB SER 14 1HB SER 14 7.446 11.594 -5.666
105 HG SER 14 HG SER 14 8.346 13.458 -4.839
106 H ILE 15 H ILE 15 7.686 8.899 -6.568
107 HA ILE 15 HA ILE 15 8.403 8.079 -3.930
108 HB ILE 15 HB ILE 15 6.793 6.515 -5.928
109 1HG1 ILE 15 2HG1 ILE 15 5.914 8.799 -5.736
110 2HG1 ILE 15 1HG1 ILE 15 4.831 7.634 -5.001
111 1HG2 ILE 15 1HG2 ILE 15 7.459 5.250 -3.967
112 2HG2 ILE 15 2HG2 ILE 15 5.729 5.585 -3.913
113 3HG2 ILE 15 3HG2 ILE 15 6.838 6.521 -2.913
114 1HD1 ILE 15 1HD1 ILE 15 6.117 9.917 -3.841
115 2HD1 ILE 15 2HD1 ILE 15 6.490 8.452 -2.935
116 3HD1 ILE 15 3HD1 ILE 15 4.811 8.916 -3.205
117 H ARG 16 H ARG 16 9.336 7.197 -7.140
118 HA ARG 16 HA ARG 16 10.391 4.660 -6.681
119 1HB ARG 16 2HB ARG 16 10.090 5.751 -8.923
120 2HB ARG 16 1HB ARG 16 11.522 6.715 -8.581
121 1HG ARG 16 2HG ARG 16 12.835 4.641 -8.369
122 2HG ARG 16 1HG ARG 16 11.397 3.715 -8.798
123 1HD ARG 16 2HD ARG 16 11.481 5.483 -10.845
124 2HD ARG 16 1HD ARG 16 13.201 5.316 -10.489
125 HE ARG 16 HE ARG 16 12.171 2.753 -10.587
126 1HH1 ARG 16 1HH1 ARG 16 12.508 5.455 -12.770
127 2HH1 ARG 16 2HH1 ARG 16 12.618 4.460 -14.183
128 1HH2 ARG 16 1HH2 ARG 16 12.317 1.443 -12.445
129 2HH2 ARG 16 2HH2 ARG 16 12.509 2.183 -13.998
130 H TRP 17 H TRP 17 11.851 7.859 -6.388
131 HA TRP 17 HA TRP 17 14.405 6.882 -5.623
132 1HB TRP 17 2HB TRP 17 14.037 9.107 -6.644
133 2HB TRP 17 1HB TRP 17 13.225 9.626 -5.169
134 HD1 TRP 17 HD1 TRP 17 16.714 8.272 -6.201
135 HE1 TRP 17 1HE TRP 17 18.478 9.419 -4.721
136 HE3 TRP 17 3HE TRP 17 13.609 11.012 -3.201
137 HZ2 TRP 17 2HZ TRP 17 18.547 11.242 -2.569
138 HZ3 TRP 17 3HZ TRP 17 14.604 12.427 -1.454
139 HH2 TRP 17 HH2 TRP 17 17.023 12.539 -1.147
140 H VAL 18 H VAL 18 12.015 8.689 -3.686
141 HA VAL 18 HA VAL 18 13.303 8.362 -1.254
142 HB VAL 18 HB VAL 18 10.360 8.499 -1.087
143 1HG1 VAL 18 1HG1 VAL 18 11.802 10.662 0.117
144 2HG1 VAL 18 2HG1 VAL 18 12.586 9.131 0.509
145 3HG1 VAL 18 3HG1 VAL 18 10.880 9.370 0.883
146 1HG2 VAL 18 1HG2 VAL 18 10.936 11.114 -1.624
147 2HG2 VAL 18 2HG2 VAL 18 10.164 9.995 -2.744
148 3HG2 VAL 18 3HG2 VAL 18 11.903 10.279 -2.837
149 H LEU 19 H LEU 19 10.380 6.618 -2.201
150 HA LEU 19 HA LEU 19 10.491 4.949 0.054
151 1HB LEU 19 2HB LEU 19 8.803 5.099 -2.358
152 2HB LEU 19 1HB LEU 19 8.779 3.601 -1.443
153 HG LEU 19 HG LEU 19 8.191 6.330 -0.300
154 1HD1 LEU 19 1HD1 LEU 19 6.560 4.600 -1.825
155 2HD1 LEU 19 2HD1 LEU 19 6.127 6.113 -1.032
156 3HD1 LEU 19 3HD1 LEU 19 5.976 4.587 -0.159
157 1HD2 LEU 19 1HD2 LEU 19 7.179 4.496 1.434
158 2HD2 LEU 19 2HD2 LEU 19 8.742 5.290 1.606
159 3HD2 LEU 19 3HD2 LEU 19 8.647 3.690 0.880
160 H GLU 20 H GLU 20 11.181 4.132 -3.332
161 HA GLU 20 HA GLU 20 11.793 1.447 -2.755
162 1HB GLU 20 2HB GLU 20 13.008 2.893 -5.038
163 2HB GLU 20 1HB GLU 20 12.415 1.239 -4.981
164 1HG GLU 20 2HG GLU 20 10.123 2.382 -4.656
165 2HG GLU 20 1HG GLU 20 10.966 3.792 -5.294
166 H ARG 21 H ARG 21 13.967 4.059 -3.740
167 HA ARG 21 HA ARG 21 16.337 2.692 -3.343
168 1HB ARG 21 2HB ARG 21 15.774 5.617 -2.923
169 2HB ARG 21 1HB ARG 21 17.389 4.940 -2.862
170 1HG ARG 21 2HG ARG 21 15.908 4.196 -5.265
171 2HG ARG 21 1HG ARG 21 16.174 5.932 -5.097
172 1HD ARG 21 2HD ARG 21 18.323 5.723 -5.635
173 2HD ARG 21 1HD ARG 21 18.563 4.468 -4.426
174 HE ARG 21 HE ARG 21 17.681 4.001 -7.201
175 1HH1 ARG 21 1HH1 ARG 21 19.191 2.870 -4.253
176 2HH1 ARG 21 2HH1 ARG 21 19.705 1.375 -4.952
177 1HH2 ARG 21 1HH2 ARG 21 18.366 2.034 -8.108
178 2HH2 ARG 21 2HH2 ARG 21 19.240 0.899 -7.134
179 H ALA 22 H ALA 22 14.510 4.512 -0.924
180 HA ALA 22 HA ALA 22 16.367 4.035 1.158
181 1HB ALA 22 1HB ALA 22 14.520 5.839 0.993
182 2HB ALA 22 2HB ALA 22 14.916 5.152 2.567
183 3HB ALA 22 3HB ALA 22 13.486 4.595 1.699
184 H LEU 23 H LEU 23 13.497 2.342 0.068
185 HA LEU 23 HA LEU 23 13.524 0.513 2.276
186 1HB LEU 23 2HB LEU 23 11.825 0.973 -0.023
187 2HB LEU 23 1HB LEU 23 12.141 -0.733 0.191
188 HG LEU 23 HG LEU 23 10.946 1.119 2.257
189 1HD1 LEU 23 1HD1 LEU 23 9.372 -1.169 1.492
190 2HD1 LEU 23 2HD1 LEU 23 9.753 -0.173 0.090
191 3HD1 LEU 23 3HD1 LEU 23 8.946 0.543 1.485
192 1HD2 LEU 23 1HD2 LEU 23 10.996 -0.564 3.793
193 2HD2 LEU 23 2HD2 LEU 23 12.478 -0.943 2.914
194 3HD2 LEU 23 3HD2 LEU 23 10.992 -1.834 2.570
195 H ALA 24 H ALA 24 15.024 0.720 -0.829
196 HA ALA 24 HA ALA 24 15.710 -1.998 -1.159
197 1HB ALA 24 1HB ALA 24 17.605 0.060 -2.136
198 2HB ALA 24 2HB ALA 24 15.951 0.159 -2.736
199 3HB ALA 24 3HB ALA 24 16.890 -1.313 -2.979
200 H GLY 25 H GLY 25 17.124 0.694 0.606
201 1HA GLY 25 2HA GLY 25 19.580 -0.555 1.271
202 2HA GLY 25 1HA GLY 25 18.819 0.761 2.161
203 H ALA 26 H ALA 26 16.343 -0.877 2.473
204 HA ALA 26 HA ALA 26 17.065 -2.134 4.934
205 1HB ALA 26 1HB ALA 26 14.486 -2.833 4.621
206 2HB ALA 26 2HB ALA 26 14.556 -1.436 3.547
207 3HB ALA 26 3HB ALA 26 15.003 -1.267 5.245
208 H GLY 27 H GLY 27 16.879 -3.151 1.688
209 1HA GLY 27 2HA GLY 27 17.714 -5.252 0.997
210 2HA GLY 27 1HA GLY 27 17.273 -5.916 2.560
211 H LEU 28 H LEU 28 14.956 -4.011 0.714
212 HA LEU 28 HA LEU 28 13.582 -6.512 0.059
213 1HB LEU 28 2HB LEU 28 11.909 -4.125 0.483
214 2HB LEU 28 1HB LEU 28 11.593 -5.800 0.878
215 HG LEU 28 HG LEU 28 13.464 -5.322 2.710
216 1HD1 LEU 28 1HD1 LEU 28 12.593 -2.903 3.497
217 2HD1 LEU 28 2HD1 LEU 28 12.594 -2.700 1.742
218 3HD1 LEU 28 3HD1 LEU 28 14.073 -3.178 2.577
219 1HD2 LEU 28 1HD2 LEU 28 10.701 -5.621 2.667
220 2HD2 LEU 28 2HD2 LEU 28 10.980 -4.181 3.648
221 3HD2 LEU 28 3HD2 LEU 28 11.752 -5.708 4.081
222 H THR 29 H THR 29 11.826 -6.186 -1.605
223 HA THR 29 HA THR 29 12.955 -4.653 -3.828
224 HB THR 29 HB THR 29 10.858 -6.832 -3.752
225 HG1 THR 29 1HG THR 29 12.796 -7.778 -3.563
226 1HG2 THR 29 1HG2 THR 29 11.358 -4.910 -5.805
227 2HG2 THR 29 2HG2 THR 29 10.189 -6.233 -5.767
228 3HG2 THR 29 3HG2 THR 29 11.825 -6.518 -6.361
229 H CYS 30 H CYS 30 12.179 -2.667 -4.097
230 HA CYS 30 HA CYS 30 9.369 -2.164 -3.400
231 1HB CYS 30 2HB CYS 30 11.352 -0.930 -2.245
232 2HB CYS 30 1HB CYS 30 11.354 0.027 -3.724
233 HG CYS 30 HG CYS 30 9.649 1.354 -2.553
234 H THR 31 H THR 31 8.047 -1.958 -5.026
235 HA THR 31 HA THR 31 9.007 -0.640 -7.472
236 HB THR 31 HB THR 31 8.553 -3.174 -7.659
237 HG1 THR 31 1HG THR 31 7.322 -2.731 -9.691
238 1HG2 THR 31 1HG2 THR 31 5.767 -2.736 -8.271
239 2HG2 THR 31 2HG2 THR 31 6.113 -2.551 -6.551
240 3HG2 THR 31 3HG2 THR 31 6.550 -4.036 -7.390
241 H THR 32 H THR 32 7.668 0.914 -8.312
242 HA THR 32 HA THR 32 5.318 1.535 -6.678
243 HB THR 32 HB THR 32 5.677 3.896 -7.330
244 HG1 THR 32 1HG THR 32 8.129 2.956 -8.398
245 1HG2 THR 32 1HG2 THR 32 7.349 2.329 -5.598
246 2HG2 THR 32 2HG2 THR 32 6.752 3.979 -5.398
247 3HG2 THR 32 3HG2 THR 32 8.252 3.686 -6.275
248 H PHE 33 H PHE 33 3.574 2.691 -7.752
249 HA PHE 33 HA PHE 33 3.290 1.939 -10.571
250 1HB PHE 33 2HB PHE 33 1.235 1.548 -8.412
251 2HB PHE 33 1HB PHE 33 1.001 1.215 -10.113
252 HD1 PHE 33 1HD PHE 33 3.415 0.340 -7.399
253 HD2 PHE 33 2HD PHE 33 1.220 -0.987 -10.785
254 HE1 PHE 33 1HE PHE 33 4.300 -1.919 -7.079
255 HE2 PHE 33 2HE PHE 33 2.092 -3.250 -10.463
256 HZ PHE 33 HZ PHE 33 3.626 -3.735 -8.619
257 H GLU 34 H GLU 34 1.175 2.945 -11.475
258 HA GLU 34 HA GLU 34 1.553 5.711 -11.532
259 1HB GLU 34 2HB GLU 34 -0.496 5.767 -12.903
260 2HB GLU 34 1HB GLU 34 0.624 4.512 -13.411
261 1HG GLU 34 2HG GLU 34 -1.379 3.402 -13.490
262 2HG GLU 34 1HG GLU 34 -0.807 2.984 -11.880
263 H ASN 35 H ASN 35 -0.923 3.841 -9.732
264 HA ASN 35 HA ASN 35 -1.290 6.070 -7.995
265 1HB ASN 35 2HB ASN 35 -2.675 6.497 -10.164
266 2HB ASN 35 1HB ASN 35 -3.793 5.342 -9.445
267 1HD2 ASN 35 1HD2 ASN 35 -2.120 8.385 -8.901
268 2HD2 ASN 35 2HD2 ASN 35 -3.291 9.047 -7.820
269 H GLY 36 H GLY 36 -3.123 3.273 -9.114
270 1HA GLY 36 2HA GLY 36 -2.849 1.915 -6.611
271 2HA GLY 36 1HA GLY 36 -4.431 2.643 -6.785
272 H ASN 37 H ASN 37 -4.896 2.268 -9.481
273 HA ASN 37 HA ASN 37 -5.832 -0.384 -9.492
274 1HB ASN 37 2HB ASN 37 -6.369 1.894 -10.944
275 2HB ASN 37 1HB ASN 37 -5.623 0.837 -12.137
276 1HD2 ASN 37 1HD2 ASN 37 -7.741 0.195 -9.367
277 2HD2 ASN 37 2HD2 ASN 37 -8.966 -0.623 -10.270
278 H GLU 38 H GLU 38 -2.944 1.106 -10.705
279 HA GLU 38 HA GLU 38 -2.078 -0.762 -12.550
280 1HB GLU 38 2HB GLU 38 -1.028 1.478 -11.288
281 2HB GLU 38 1HB GLU 38 0.085 0.191 -10.886
282 1HG GLU 38 2HG GLU 38 -0.714 0.298 -13.704
283 2HG GLU 38 1HG GLU 38 0.220 1.679 -13.131
284 H VAL 39 H VAL 39 -1.350 -0.722 -9.017
285 HA VAL 39 HA VAL 39 0.201 -2.994 -8.882
286 HB VAL 39 HB VAL 39 -1.928 -2.428 -6.831
287 1HG1 VAL 39 1HG1 VAL 39 -0.719 -3.698 -5.406
288 2HG1 VAL 39 2HG1 VAL 39 0.822 -3.251 -6.136
289 3HG1 VAL 39 3HG1 VAL 39 -0.204 -4.457 -6.909
290 1HG2 VAL 39 1HG2 VAL 39 0.071 -0.638 -7.723
291 2HG2 VAL 39 2HG2 VAL 39 0.544 -1.219 -6.125
292 3HG2 VAL 39 3HG2 VAL 39 -1.034 -0.475 -6.362
293 H LEU 40 H LEU 40 -3.297 -2.779 -9.066
294 HA LEU 40 HA LEU 40 -3.891 -5.483 -8.592
295 1HB LEU 40 2HB LEU 40 -5.463 -3.724 -10.453
296 2HB LEU 40 1HB LEU 40 -6.051 -5.017 -9.424
297 HG LEU 40 HG LEU 40 -4.997 -2.363 -8.437
298 1HD1 LEU 40 1HD1 LEU 40 -7.753 -2.917 -7.859
299 2HD1 LEU 40 2HD1 LEU 40 -7.466 -2.939 -9.598
300 3HD1 LEU 40 3HD1 LEU 40 -7.033 -1.519 -8.647
301 1HD2 LEU 40 1HD2 LEU 40 -5.514 -4.882 -7.125
302 2HD2 LEU 40 2HD2 LEU 40 -6.527 -3.598 -6.471
303 3HD2 LEU 40 3HD2 LEU 40 -4.774 -3.414 -6.493
304 H ALA 41 H ALA 41 -3.165 -3.721 -11.563
305 HA ALA 41 HA ALA 41 -3.633 -5.825 -13.365
306 1HB ALA 41 1HB ALA 41 -3.424 -3.431 -13.988
307 2HB ALA 41 2HB ALA 41 -2.456 -4.514 -14.988
308 3HB ALA 41 3HB ALA 41 -1.686 -3.561 -13.716
309 H ALA 42 H ALA 42 -0.650 -4.695 -11.874
310 HA ALA 42 HA ALA 42 0.967 -6.740 -13.015
311 1HB ALA 42 1HB ALA 42 1.541 -4.368 -11.882
312 2HB ALA 42 2HB ALA 42 2.724 -5.657 -12.094
313 3HB ALA 42 3HB ALA 42 1.923 -5.443 -10.535
314 H LEU 43 H LEU 43 -0.862 -6.375 -10.076
315 HA LEU 43 HA LEU 43 0.246 -8.430 -8.554
316 1HB LEU 43 2HB LEU 43 -2.323 -6.964 -8.596
317 2HB LEU 43 1HB LEU 43 -2.302 -8.490 -7.733
318 HG LEU 43 HG LEU 43 -0.223 -6.414 -7.175
319 1HD1 LEU 43 1HD1 LEU 43 -2.882 -6.580 -5.776
320 2HD1 LEU 43 2HD1 LEU 43 -2.482 -5.365 -6.989
321 3HD1 LEU 43 3HD1 LEU 43 -1.581 -5.432 -5.476
322 1HD2 LEU 43 1HD2 LEU 43 0.327 -8.414 -6.161
323 2HD2 LEU 43 2HD2 LEU 43 -1.353 -8.821 -5.811
324 3HD2 LEU 43 3HD2 LEU 43 -0.538 -7.563 -4.887
325 H ALA 44 H ALA 44 -1.817 -8.533 -11.302
326 HA ALA 44 HA ALA 44 -3.083 -10.992 -10.966
327 1HB ALA 44 1HB ALA 44 -3.793 -10.737 -13.099
328 2HB ALA 44 2HB ALA 44 -2.191 -10.305 -13.696
329 3HB ALA 44 3HB ALA 44 -3.174 -9.103 -12.860
330 H SER 45 H SER 45 0.227 -10.303 -11.532
331 HA SER 45 HA SER 45 0.724 -13.125 -12.092
332 1HB SER 45 2HB SER 45 1.366 -11.957 -14.051
333 2HB SER 45 1HB SER 45 2.156 -10.686 -13.119
334 HG SER 45 HG SER 45 3.233 -12.890 -14.092
335 H LYS 46 H LYS 46 0.936 -10.909 -9.694
336 HA LYS 46 HA LYS 46 2.795 -12.475 -8.210
337 1HB LYS 46 2HB LYS 46 4.093 -10.751 -9.768
338 2HB LYS 46 1HB LYS 46 3.713 -9.658 -8.444
339 1HG LYS 46 2HG LYS 46 4.693 -11.908 -7.174
340 2HG LYS 46 1HG LYS 46 5.708 -11.748 -8.610
341 1HD LYS 46 2HD LYS 46 5.867 -9.261 -7.938
342 2HD LYS 46 1HD LYS 46 5.301 -9.809 -6.359
343 1HE LYS 46 2HE LYS 46 7.198 -11.134 -6.013
344 2HE LYS 46 1HE LYS 46 7.637 -11.107 -7.721
345 1HZ LYS 46 1HZ LYS 46 7.572 -8.565 -6.262
346 2HZ LYS 46 2HZ LYS 46 8.563 -9.045 -7.546
347 3HZ LYS 46 3HZ LYS 46 8.871 -9.613 -5.982
348 H THR 47 H THR 47 3.138 -11.585 -6.002
349 HA THR 47 HA THR 47 1.115 -9.680 -5.174
350 HB THR 47 HB THR 47 1.485 -12.393 -3.909
351 HG1 THR 47 1HG THR 47 0.194 -12.127 -5.927
352 1HG2 THR 47 1HG2 THR 47 0.958 -10.660 -2.242
353 2HG2 THR 47 2HG2 THR 47 -0.339 -11.837 -2.442
354 3HG2 THR 47 3HG2 THR 47 -0.479 -10.238 -3.170
355 HA PRO 48 HA PRO 48 4.805 -8.444 -2.937
356 1HB PRO 48 2HB PRO 48 3.840 -6.075 -2.019
357 2HB PRO 48 1HB PRO 48 4.469 -6.300 -3.651
358 1HG PRO 48 2HG PRO 48 1.664 -6.098 -2.716
359 2HG PRO 48 1HG PRO 48 2.380 -5.583 -4.250
360 1HD PRO 48 2HD PRO 48 0.884 -7.894 -3.864
361 2HD PRO 48 1HD PRO 48 1.971 -7.591 -5.229
362 H ASP 49 H ASP 49 5.386 -8.192 -0.735
363 HA ASP 49 HA ASP 49 3.664 -9.607 1.050
364 1HB ASP 49 2HB ASP 49 6.362 -8.305 1.359
365 2HB ASP 49 1HB ASP 49 5.512 -9.002 2.735
366 H VAL 50 H VAL 50 4.431 -6.221 0.497
367 HA VAL 50 HA VAL 50 2.276 -5.499 2.324
368 HB VAL 50 HB VAL 50 4.330 -5.508 3.685
369 1HG1 VAL 50 1HG1 VAL 50 5.384 -3.149 2.227
370 2HG1 VAL 50 2HG1 VAL 50 5.645 -4.747 1.520
371 3HG1 VAL 50 3HG1 VAL 50 6.238 -4.389 3.145
372 1HG2 VAL 50 1HG2 VAL 50 2.489 -3.945 4.173
373 2HG2 VAL 50 2HG2 VAL 50 3.285 -2.731 3.171
374 3HG2 VAL 50 3HG2 VAL 50 4.064 -3.306 4.642
375 H LEU 51 H LEU 51 0.997 -4.424 0.879
376 HA LEU 51 HA LEU 51 2.200 -2.703 -1.125
377 1HB LEU 51 2HB LEU 51 0.225 -4.222 -1.566
378 2HB LEU 51 1HB LEU 51 -0.739 -3.109 -0.613
379 HG LEU 51 HG LEU 51 -0.129 -1.292 -2.209
380 1HD1 LEU 51 1HD1 LEU 51 1.949 -2.308 -3.041
381 2HD1 LEU 51 2HD1 LEU 51 0.848 -1.867 -4.344
382 3HD1 LEU 51 3HD1 LEU 51 1.000 -3.553 -3.853
383 1HD2 LEU 51 1HD2 LEU 51 -1.389 -3.592 -3.668
384 2HD2 LEU 51 2HD2 LEU 51 -1.751 -1.870 -3.798
385 3HD2 LEU 51 3HD2 LEU 51 -2.208 -2.762 -2.345
386 H LEU 52 H LEU 52 1.599 -0.491 -1.423
387 HA LEU 52 HA LEU 52 0.571 0.896 0.958
388 1HB LEU 52 2HB LEU 52 3.204 0.799 0.589
389 2HB LEU 52 1HB LEU 52 2.844 2.090 -0.535
390 HG LEU 52 HG LEU 52 2.079 2.166 2.373
391 1HD1 LEU 52 1HD1 LEU 52 4.649 2.275 1.375
392 2HD1 LEU 52 2HD1 LEU 52 4.102 2.897 2.932
393 3HD1 LEU 52 3HD1 LEU 52 4.186 3.969 1.535
394 1HD2 LEU 52 1HD2 LEU 52 0.720 3.595 0.963
395 2HD2 LEU 52 2HD2 LEU 52 2.167 4.288 0.235
396 3HD2 LEU 52 3HD2 LEU 52 1.814 4.570 1.940
397 H SER 53 H SER 53 -1.088 2.147 0.331
398 HA SER 53 HA SER 53 -1.087 3.172 -2.432
399 1HB SER 53 2HB SER 53 -3.121 1.865 -0.828
400 2HB SER 53 1HB SER 53 -3.689 3.415 -1.452
401 HG SER 53 HG SER 53 -3.878 2.491 -3.314
402 H ASP 54 H ASP 54 -1.036 5.308 -2.755
403 HA ASP 54 HA ASP 54 -0.968 7.051 -0.456
404 1HB ASP 54 2HB ASP 54 0.390 7.099 -2.788
405 2HB ASP 54 1HB ASP 54 -0.887 8.258 -3.148
406 H ILE 55 H ILE 55 -3.461 5.857 -2.257
407 HA ILE 55 HA ILE 55 -5.577 6.566 -2.796
408 HB ILE 55 HB ILE 55 -5.827 6.155 -0.449
409 1HG1 ILE 55 2HG1 ILE 55 -7.167 8.801 -0.579
410 2HG1 ILE 55 1HG1 ILE 55 -7.551 7.636 -1.841
411 1HG2 ILE 55 1HG2 ILE 55 -5.519 7.916 1.244
412 2HG2 ILE 55 2HG2 ILE 55 -4.816 8.952 0.003
413 3HG2 ILE 55 3HG2 ILE 55 -4.017 7.446 0.451
414 1HD1 ILE 55 1HD1 ILE 55 -8.753 7.798 0.616
415 2HD1 ILE 55 2HD1 ILE 55 -7.602 6.479 0.826
416 3HD1 ILE 55 3HD1 ILE 55 -8.800 6.405 -0.465
417 H ARG 56 H ARG 56 -5.280 7.944 -4.576
418 HA ARG 56 HA ARG 56 -5.249 10.820 -3.932
419 1HB ARG 56 2HB ARG 56 -3.348 9.604 -5.366
420 2HB ARG 56 1HB ARG 56 -4.495 9.933 -6.658
421 1HG ARG 56 2HG ARG 56 -4.412 12.319 -5.329
422 2HG ARG 56 1HG ARG 56 -2.749 11.745 -5.193
423 1HD ARG 56 2HD ARG 56 -2.574 11.524 -7.579
424 2HD ARG 56 1HD ARG 56 -4.288 11.884 -7.781
425 HE ARG 56 HE ARG 56 -3.759 14.096 -7.718
426 1HH1 ARG 56 1HH1 ARG 56 -1.185 12.321 -6.167
427 2HH1 ARG 56 2HH1 ARG 56 -0.226 13.731 -5.862
428 1HH2 ARG 56 1HH2 ARG 56 -2.500 15.951 -7.317
429 2HH2 ARG 56 2HH2 ARG 56 -0.973 15.791 -6.517
430 H MET 57 H MET 57 -7.642 9.379 -3.935
431 HA MET 57 HA MET 57 -9.753 9.436 -4.741
432 1HB MET 57 2HB MET 57 -8.958 11.951 -4.677
433 2HB MET 57 1HB MET 57 -9.155 11.817 -6.420
434 1HG MET 57 2HG MET 57 -11.473 10.725 -5.567
435 2HG MET 57 1HG MET 57 -11.167 11.894 -4.284
436 1HE MET 57 1HE MET 57 -13.906 12.894 -5.865
437 2HE MET 57 2HE MET 57 -13.334 11.357 -6.515
438 3HE MET 57 3HE MET 57 -13.609 12.725 -7.594
439 HA PRO 58 HA PRO 58 -8.269 7.979 -9.063
440 1HB PRO 58 2HB PRO 58 -8.404 5.286 -8.549
441 2HB PRO 58 1HB PRO 58 -6.917 6.233 -8.446
442 1HG PRO 58 2HG PRO 58 -8.759 5.356 -6.258
443 2HG PRO 58 1HG PRO 58 -6.986 5.397 -6.282
444 1HD PRO 58 2HD PRO 58 -8.448 7.281 -5.034
445 2HD PRO 58 1HD PRO 58 -6.910 7.660 -5.827
446 H GLY 59 H GLY 59 -10.162 5.467 -7.445
447 1HA GLY 59 2HA GLY 59 -12.445 6.136 -9.182
448 2HA GLY 59 1HA GLY 59 -12.154 4.566 -8.437
449 H MET 60 H MET 60 -12.551 4.307 -6.194
450 HA MET 60 HA MET 60 -14.601 6.110 -5.180
451 1HB MET 60 2HB MET 60 -14.845 3.575 -5.023
452 2HB MET 60 1HB MET 60 -13.580 3.626 -3.801
453 1HG MET 60 2HG MET 60 -15.122 3.989 -2.278
454 2HG MET 60 1HG MET 60 -15.437 5.554 -3.024
455 1HE MET 60 1HE MET 60 -17.539 4.012 -5.971
456 2HE MET 60 2HE MET 60 -16.350 5.229 -5.503
457 3HE MET 60 3HE MET 60 -18.061 5.483 -5.153
458 H ASP 61 H ASP 61 -12.649 7.609 -5.249
459 HA ASP 61 HA ASP 61 -11.333 9.053 -4.131
460 1HB ASP 61 2HB ASP 61 -12.991 7.858 -2.081
461 2HB ASP 61 1HB ASP 61 -11.430 8.382 -1.448
462 H GLY 62 H GLY 62 -10.962 5.666 -3.443
463 1HA GLY 62 2HA GLY 62 -8.409 5.266 -4.031
464 2HA GLY 62 1HA GLY 62 -8.263 5.997 -2.438
465 H LEU 63 H LEU 63 -10.699 4.874 -1.396
466 HA LEU 63 HA LEU 63 -9.693 2.423 -0.443
467 1HB LEU 63 2HB LEU 63 -12.613 3.096 -0.343
468 2HB LEU 63 1HB LEU 63 -11.662 2.177 0.804
469 HG LEU 63 HG LEU 63 -10.461 4.558 1.081
470 1HD1 LEU 63 1HD1 LEU 63 -13.278 5.463 0.799
471 2HD1 LEU 63 2HD1 LEU 63 -12.268 5.388 -0.642
472 3HD1 LEU 63 3HD1 LEU 63 -11.779 6.389 0.725
473 1HD2 LEU 63 1HD2 LEU 63 -11.393 4.560 3.147
474 2HD2 LEU 63 2HD2 LEU 63 -11.880 2.942 2.646
475 3HD2 LEU 63 3HD2 LEU 63 -13.026 4.277 2.537
476 H ALA 64 H ALA 64 -11.489 3.280 -3.264
477 HA ALA 64 HA ALA 64 -12.904 0.948 -3.821
478 1HB ALA 64 1HB ALA 64 -11.370 2.609 -5.820
479 2HB ALA 64 2HB ALA 64 -12.980 2.978 -5.224
480 3HB ALA 64 3HB ALA 64 -12.711 1.523 -6.171
481 H LEU 65 H LEU 65 -9.487 1.670 -4.246
482 HA LEU 65 HA LEU 65 -8.707 -0.533 -5.735
483 1HB LEU 65 2HB LEU 65 -7.448 1.580 -4.428
484 2HB LEU 65 1HB LEU 65 -6.761 0.143 -3.693
485 HG LEU 65 HG LEU 65 -5.463 1.016 -5.631
486 1HD1 LEU 65 1HD1 LEU 65 -6.633 -1.747 -5.688
487 2HD1 LEU 65 2HD1 LEU 65 -5.059 -1.228 -5.086
488 3HD1 LEU 65 3HD1 LEU 65 -5.381 -1.243 -6.820
489 1HD2 LEU 65 1HD2 LEU 65 -6.340 0.678 -7.877
490 2HD2 LEU 65 2HD2 LEU 65 -7.370 1.782 -6.973
491 3HD2 LEU 65 3HD2 LEU 65 -7.866 0.109 -7.217
492 H LEU 66 H LEU 66 -9.024 -0.200 -2.229
493 HA LEU 66 HA LEU 66 -8.042 -2.678 -1.455
494 1HB LEU 66 2HB LEU 66 -10.407 -1.336 -0.166
495 2HB LEU 66 1HB LEU 66 -9.219 -2.380 0.591
496 HG LEU 66 HG LEU 66 -8.333 0.212 -0.611
497 1HD1 LEU 66 1HD1 LEU 66 -9.725 -0.135 2.025
498 2HD1 LEU 66 2HD1 LEU 66 -10.135 0.965 0.716
499 3HD1 LEU 66 3HD1 LEU 66 -8.669 1.224 1.661
500 1HD2 LEU 66 1HD2 LEU 66 -7.323 -0.924 1.936
501 2HD2 LEU 66 2HD2 LEU 66 -6.464 -0.071 0.653
502 3HD2 LEU 66 3HD2 LEU 66 -6.915 -1.762 0.438
503 H LYS 67 H LYS 67 -11.289 -1.763 -2.520
504 HA LYS 67 HA LYS 67 -12.584 -4.192 -2.054
505 1HB LYS 67 2HB LYS 67 -13.460 -1.852 -2.927
506 2HB LYS 67 1HB LYS 67 -13.261 -2.621 -4.499
507 1HG LYS 67 2HG LYS 67 -14.689 -4.491 -3.687
508 2HG LYS 67 1HG LYS 67 -14.990 -3.557 -2.223
509 1HD LYS 67 2HD LYS 67 -16.053 -1.812 -3.481
510 2HD LYS 67 1HD LYS 67 -15.588 -2.568 -5.007
511 1HE LYS 67 2HE LYS 67 -16.915 -4.610 -3.905
512 2HE LYS 67 1HE LYS 67 -17.750 -3.275 -3.110
513 1HZ LYS 67 1HZ LYS 67 -17.354 -3.263 -6.033
514 2HZ LYS 67 2HZ LYS 67 -18.526 -2.462 -5.115
515 3HZ LYS 67 3HZ LYS 67 -18.633 -4.133 -5.345
516 H GLN 68 H GLN 68 -10.761 -3.076 -4.872
517 HA GLN 68 HA GLN 68 -11.218 -5.386 -6.453
518 1HB GLN 68 2HB GLN 68 -8.864 -3.523 -6.668
519 2HB GLN 68 1HB GLN 68 -9.579 -4.493 -7.946
520 1HG GLN 68 2HG GLN 68 -11.071 -2.282 -6.566
521 2HG GLN 68 1HG GLN 68 -10.059 -2.010 -7.985
522 1HE2 GLN 68 1HE2 GLN 68 -10.787 -2.594 -9.965
523 2HE2 GLN 68 2HE2 GLN 68 -12.364 -3.229 -10.266
524 H ILE 69 H ILE 69 -8.943 -4.555 -3.982
525 HA ILE 69 HA ILE 69 -6.933 -6.424 -4.545
526 HB ILE 69 HB ILE 69 -7.731 -5.107 -1.958
527 1HG1 ILE 69 2HG1 ILE 69 -5.410 -4.551 -3.807
528 2HG1 ILE 69 1HG1 ILE 69 -6.941 -3.691 -3.871
529 1HG2 ILE 69 1HG2 ILE 69 -6.028 -6.057 -0.825
530 2HG2 ILE 69 2HG2 ILE 69 -4.988 -6.140 -2.245
531 3HG2 ILE 69 3HG2 ILE 69 -6.240 -7.353 -1.999
532 1HD1 ILE 69 1HD1 ILE 69 -6.124 -3.555 -1.211
533 2HD1 ILE 69 2HD1 ILE 69 -6.110 -2.263 -2.412
534 3HD1 ILE 69 3HD1 ILE 69 -4.678 -3.265 -2.177
535 H LYS 70 H LYS 70 -9.880 -6.682 -2.687
536 HA LYS 70 HA LYS 70 -9.280 -9.269 -1.645
537 1HB LYS 70 2HB LYS 70 -11.522 -9.222 -0.740
538 2HB LYS 70 1HB LYS 70 -10.741 -7.670 -0.479
539 1HG LYS 70 2HG LYS 70 -12.517 -6.710 -1.374
540 2HG LYS 70 1HG LYS 70 -12.025 -7.402 -2.917
541 1HD LYS 70 2HD LYS 70 -13.464 -9.229 -2.696
542 2HD LYS 70 1HD LYS 70 -13.672 -8.967 -0.962
543 1HE LYS 70 2HE LYS 70 -15.215 -7.318 -1.259
544 2HE LYS 70 1HE LYS 70 -14.507 -6.783 -2.782
545 1HZ LYS 70 1HZ LYS 70 -15.418 -8.824 -3.809
546 2HZ LYS 70 2HZ LYS 70 -16.614 -7.780 -3.223
547 3HZ LYS 70 3HZ LYS 70 -16.211 -9.175 -2.355
548 H GLN 71 H GLN 71 -10.968 -8.007 -4.401
549 HA GLN 71 HA GLN 71 -12.415 -10.303 -5.098
550 1HB GLN 71 2HB GLN 71 -11.610 -7.805 -6.457
551 2HB GLN 71 1HB GLN 71 -12.073 -9.146 -7.495
552 1HG GLN 71 2HG GLN 71 -14.247 -9.161 -6.735
553 2HG GLN 71 1HG GLN 71 -13.831 -8.371 -5.215
554 1HE2 GLN 71 1HE2 GLN 71 -12.909 -6.101 -5.539
555 2HE2 GLN 71 2HE2 GLN 71 -13.759 -5.095 -6.656
556 H ARG 72 H ARG 72 -9.227 -9.216 -6.095
557 HA ARG 72 HA ARG 72 -8.834 -11.693 -7.578
558 1HB ARG 72 2HB ARG 72 -7.531 -9.030 -7.573
559 2HB ARG 72 1HB ARG 72 -6.540 -10.414 -8.016
560 1HG ARG 72 2HG ARG 72 -7.624 -10.746 -9.965
561 2HG ARG 72 1HG ARG 72 -9.176 -10.217 -9.318
562 1HD ARG 72 2HD ARG 72 -8.674 -7.958 -9.640
563 2HD ARG 72 1HD ARG 72 -6.941 -8.269 -9.764
564 HE ARG 72 HE ARG 72 -7.234 -8.547 -12.000
565 1HH1 ARG 72 1HH1 ARG 72 -10.291 -9.159 -10.429
566 2HH1 ARG 72 2HH1 ARG 72 -11.130 -9.477 -11.910
567 1HH2 ARG 72 1HH2 ARG 72 -8.338 -8.974 -13.948
568 2HH2 ARG 72 2HH2 ARG 72 -10.023 -9.373 -13.906
569 H HIS 73 H HIS 73 -7.180 -9.831 -5.094
570 HA HIS 73 HA HIS 73 -5.553 -12.160 -4.416
571 1HB HIS 73 2HB HIS 73 -5.155 -9.700 -2.850
572 2HB HIS 73 1HB HIS 73 -3.977 -10.713 -3.678
573 HD1 HIS 73 1HD HIS 73 -4.291 -10.412 -6.493
574 HD2 HIS 73 2HD HIS 73 -5.273 -7.257 -3.984
575 HE1 HIS 73 1HE HIS 73 -4.308 -8.369 -7.957
576 HE2 HIS 73 2HE HIS 73 -4.789 -6.460 -6.392
577 HA PRO 74 HA PRO 74 -7.826 -13.287 -0.843
578 1HB PRO 74 2HB PRO 74 -5.824 -13.898 0.934
579 2HB PRO 74 1HB PRO 74 -6.352 -14.957 -0.375
580 1HG PRO 74 2HG PRO 74 -3.975 -13.166 -0.226
581 2HG PRO 74 1HG PRO 74 -4.141 -14.758 -0.986
582 1HD PRO 74 2HD PRO 74 -4.143 -12.417 -2.382
583 2HD PRO 74 1HD PRO 74 -4.987 -13.880 -2.925
584 H MET 75 H MET 75 -4.978 -11.825 0.700
585 HA MET 75 HA MET 75 -6.611 -9.629 1.715
586 1HB MET 75 2HB MET 75 -5.195 -11.648 3.461
587 2HB MET 75 1HB MET 75 -5.704 -10.070 4.041
588 1HG MET 75 2HG MET 75 -7.890 -10.639 4.094
589 2HG MET 75 1HG MET 75 -7.758 -11.722 2.712
590 1HE MET 75 1HE MET 75 -8.589 -14.195 3.348
591 2HE MET 75 2HE MET 75 -9.544 -12.982 4.199
592 3HE MET 75 3HE MET 75 -8.981 -14.417 5.054
593 H LEU 76 H LEU 76 -4.818 -9.139 -0.130
594 HA LEU 76 HA LEU 76 -2.142 -8.843 0.648
595 1HB LEU 76 2HB LEU 76 -2.812 -8.733 -1.678
596 2HB LEU 76 1HB LEU 76 -3.749 -7.284 -1.368
597 HG LEU 76 HG LEU 76 -1.531 -6.212 -0.655
598 1HD1 LEU 76 1HD1 LEU 76 -0.624 -8.812 -1.768
599 2HD1 LEU 76 2HD1 LEU 76 0.031 -7.857 -0.438
600 3HD1 LEU 76 3HD1 LEU 76 0.336 -7.374 -2.104
601 1HD2 LEU 76 1HD2 LEU 76 -1.705 -5.193 -2.615
602 2HD2 LEU 76 2HD2 LEU 76 -2.834 -6.447 -3.125
603 3HD2 LEU 76 3HD2 LEU 76 -1.113 -6.620 -3.462
604 HA PRO 77 HA PRO 77 -2.849 -5.587 3.692
605 1HB PRO 77 2HB PRO 77 0.113 -5.639 3.761
606 2HB PRO 77 1HB PRO 77 -1.047 -5.793 5.085
607 1HG PRO 77 2HG PRO 77 0.309 -7.910 4.208
608 2HG PRO 77 1HG PRO 77 -1.391 -8.054 4.696
609 1HD PRO 77 2HD PRO 77 -0.215 -7.903 1.943
610 2HD PRO 77 1HD PRO 77 -1.535 -8.927 2.548
611 H VAL 78 H VAL 78 -2.992 -3.497 3.391
612 HA VAL 78 HA VAL 78 -1.208 -2.131 1.520
613 HB VAL 78 HB VAL 78 -4.129 -1.449 1.737
614 1HG1 VAL 78 1HG1 VAL 78 -3.755 -0.270 -0.337
615 2HG1 VAL 78 2HG1 VAL 78 -2.100 -0.871 -0.420
616 3HG1 VAL 78 3HG1 VAL 78 -2.568 0.252 0.856
617 1HG2 VAL 78 1HG2 VAL 78 -4.487 -2.676 -0.348
618 2HG2 VAL 78 2HG2 VAL 78 -4.003 -3.748 0.964
619 3HG2 VAL 78 3HG2 VAL 78 -2.836 -3.284 -0.277
620 H ILE 79 H ILE 79 -0.916 0.102 1.946
621 HA ILE 79 HA ILE 79 -1.780 0.978 4.623
622 HB ILE 79 HB ILE 79 0.891 1.728 3.467
623 1HG1 ILE 79 2HG1 ILE 79 1.190 -0.215 5.545
624 2HG1 ILE 79 1HG1 ILE 79 0.140 -0.887 4.305
625 1HG2 ILE 79 1HG2 ILE 79 -0.539 2.574 5.688
626 2HG2 ILE 79 2HG2 ILE 79 1.165 2.880 5.338
627 3HG2 ILE 79 3HG2 ILE 79 0.703 1.495 6.333
628 1HD1 ILE 79 1HD1 ILE 79 2.991 -0.449 4.278
629 2HD1 ILE 79 2HD1 ILE 79 2.200 0.258 2.872
630 3HD1 ILE 79 3HD1 ILE 79 1.988 -1.454 3.236
631 H ILE 80 H ILE 80 -3.123 2.655 4.344
632 HA ILE 80 HA ILE 80 -2.734 4.384 2.014
633 HB ILE 80 HB ILE 80 -5.145 4.455 3.792
634 1HG1 ILE 80 2HG1 ILE 80 -4.791 2.119 3.059
635 2HG1 ILE 80 1HG1 ILE 80 -6.214 2.832 2.308
636 1HG2 ILE 80 1HG2 ILE 80 -4.460 5.358 1.020
637 2HG2 ILE 80 2HG2 ILE 80 -5.168 6.274 2.349
638 3HG2 ILE 80 3HG2 ILE 80 -6.136 5.077 1.489
639 1HD1 ILE 80 1HD1 ILE 80 -3.988 1.612 1.073
640 2HD1 ILE 80 2HD1 ILE 80 -4.005 3.314 0.610
641 3HD1 ILE 80 3HD1 ILE 80 -5.424 2.306 0.323
642 H MET 81 H MET 81 -2.293 6.469 2.104
643 HA MET 81 HA MET 81 -1.249 7.612 4.481
644 1HB MET 81 2HB MET 81 -0.917 9.613 3.097
645 2HB MET 81 1HB MET 81 -0.346 8.162 2.295
646 1HG MET 81 2HG MET 81 -2.082 8.188 0.756
647 2HG MET 81 1HG MET 81 -3.078 9.247 1.755
648 1HE MET 81 1HE MET 81 -2.878 11.673 -0.930
649 2HE MET 81 2HE MET 81 -3.155 12.104 0.758
650 3HE MET 81 3HE MET 81 -3.780 10.583 0.123
651 H THR 82 H THR 82 -4.345 7.938 2.822
652 HA THR 82 HA THR 82 -5.328 9.453 5.133
653 HB THR 82 HB THR 82 -6.050 10.226 2.308
654 HG1 THR 82 1HG THR 82 -4.549 11.818 2.431
655 1HG2 THR 82 1HG2 THR 82 -6.352 11.724 4.898
656 2HG2 THR 82 2HG2 THR 82 -7.650 10.912 4.023
657 3HG2 THR 82 3HG2 THR 82 -6.825 12.289 3.293
658 H ALA 83 H ALA 83 -7.568 9.256 5.543
659 HA ALA 83 HA ALA 83 -8.878 7.065 4.068
660 1HB ALA 83 1HB ALA 83 -9.728 7.481 6.847
661 2HB ALA 83 2HB ALA 83 -8.074 6.910 6.649
662 3HB ALA 83 3HB ALA 83 -9.411 5.988 5.964
663 H HIS 84 H HIS 84 -9.665 8.998 2.786
664 HA HIS 84 HA HIS 84 -11.867 10.396 4.126
665 1HB HIS 84 2HB HIS 84 -11.927 11.695 1.918
666 2HB HIS 84 1HB HIS 84 -10.528 11.944 2.958
667 HD1 HIS 84 1HD HIS 84 -11.281 9.366 0.256
668 HD2 HIS 84 2HD HIS 84 -8.365 12.109 1.359
669 HE1 HIS 84 1HE HIS 84 -9.450 9.122 -1.442
670 HE2 HIS 84 2HE HIS 84 -7.663 10.738 -0.718
671 H SER 85 H SER 85 -13.723 10.840 2.335
672 HA SER 85 HA SER 85 -15.498 9.957 1.217
673 1HB SER 85 2HB SER 85 -13.242 8.932 -0.065
674 2HB SER 85 1HB SER 85 -14.271 7.526 0.201
675 HG SER 85 HG SER 85 -14.974 9.940 -1.114
676 H ASP 86 H ASP 86 -16.208 7.257 0.741
677 HA ASP 86 HA ASP 86 -17.430 6.583 3.154
678 1HB ASP 86 2HB ASP 86 -17.628 5.731 0.542
679 2HB ASP 86 1HB ASP 86 -16.998 4.306 1.363
680 H LEU 87 H LEU 87 -15.897 6.535 4.796
681 HA LEU 87 HA LEU 87 -13.513 5.157 4.906
682 1HB LEU 87 2HB LEU 87 -14.936 6.669 6.636
683 2HB LEU 87 1HB LEU 87 -15.170 5.089 7.354
684 HG LEU 87 HG LEU 87 -13.262 6.461 8.273
685 1HD1 LEU 87 1HD1 LEU 87 -13.427 3.684 7.684
686 2HD1 LEU 87 2HD1 LEU 87 -12.629 4.486 9.036
687 3HD1 LEU 87 3HD1 LEU 87 -11.744 4.190 7.541
688 1HD2 LEU 87 1HD2 LEU 87 -11.399 5.624 6.217
689 2HD2 LEU 87 2HD2 LEU 87 -11.603 7.195 6.992
690 3HD2 LEU 87 3HD2 LEU 87 -12.596 6.764 5.601
691 H ASP 88 H ASP 88 -16.721 3.905 4.971
692 HA ASP 88 HA ASP 88 -16.519 1.531 6.313
693 1HB ASP 88 2HB ASP 88 -18.546 2.519 5.118
694 2HB ASP 88 1HB ASP 88 -17.934 1.743 3.660
695 H ALA 89 H ALA 89 -15.286 2.245 3.068
696 HA ALA 89 HA ALA 89 -14.656 -0.467 2.483
697 1HB ALA 89 1HB ALA 89 -13.625 2.061 1.217
698 2HB ALA 89 2HB ALA 89 -15.015 1.115 0.685
699 3HB ALA 89 3HB ALA 89 -13.393 0.431 0.583
700 H ALA 90 H ALA 90 -13.141 1.969 4.347
701 HA ALA 90 HA ALA 90 -10.453 1.091 4.107
702 1HB ALA 90 1HB ALA 90 -9.937 2.566 5.859
703 2HB ALA 90 2HB ALA 90 -11.575 2.489 6.516
704 3HB ALA 90 3HB ALA 90 -11.276 3.332 4.997
705 H VAL 91 H VAL 91 -12.921 0.542 6.640
706 HA VAL 91 HA VAL 91 -11.302 -1.249 8.112
707 HB VAL 91 HB VAL 91 -14.306 -1.289 8.166
708 1HG1 VAL 91 1HG1 VAL 91 -13.385 -1.633 10.707
709 2HG1 VAL 91 2HG1 VAL 91 -12.107 -2.405 9.761
710 3HG1 VAL 91 3HG1 VAL 91 -13.781 -2.946 9.594
711 1HG2 VAL 91 1HG2 VAL 91 -13.140 1.043 8.424
712 2HG2 VAL 91 2HG2 VAL 91 -12.697 0.424 10.014
713 3HG2 VAL 91 3HG2 VAL 91 -14.395 0.552 9.561
714 H SER 92 H SER 92 -13.842 -1.768 5.696
715 HA SER 92 HA SER 92 -13.825 -4.575 5.798
716 1HB SER 92 2HB SER 92 -14.354 -3.008 3.277
717 2HB SER 92 1HB SER 92 -15.059 -4.546 3.784
718 HG SER 92 HG SER 92 -15.945 -3.235 5.602
719 H ALA 93 H ALA 93 -11.487 -2.382 4.718
720 HA ALA 93 HA ALA 93 -10.275 -3.975 2.705
721 1HB ALA 93 1HB ALA 93 -8.721 -2.289 2.496
722 2HB ALA 93 2HB ALA 93 -8.791 -1.884 4.212
723 3HB ALA 93 3HB ALA 93 -10.110 -1.420 3.143
724 H TYR 94 H TYR 94 -9.162 -3.015 5.909
725 HA TYR 94 HA TYR 94 -6.952 -4.565 6.178
726 1HB TYR 94 2HB TYR 94 -8.810 -4.397 8.519
727 2HB TYR 94 1HB TYR 94 -7.057 -4.282 8.488
728 HD1 TYR 94 1HD TYR 94 -9.851 -2.455 9.177
729 HD2 TYR 94 2HD TYR 94 -6.312 -2.185 6.825
730 HE1 TYR 94 1HE TYR 94 -10.006 -0.003 9.225
731 HE2 TYR 94 2HE TYR 94 -6.465 0.264 6.867
732 HH TYR 94 HH TYR 94 -7.970 1.978 8.906
733 H GLN 95 H GLN 95 -10.253 -5.583 6.525
734 HA GLN 95 HA GLN 95 -9.618 -8.207 7.481
735 1HB GLN 95 2HB GLN 95 -11.988 -8.658 7.249
736 2HB GLN 95 1HB GLN 95 -11.759 -7.075 7.980
737 1HG GLN 95 2HG GLN 95 -13.291 -6.443 6.479
738 2HG GLN 95 1HG GLN 95 -11.904 -6.380 5.399
739 1HE2 GLN 95 1HE2 GLN 95 -14.194 -6.624 4.164
740 2HE2 GLN 95 2HE2 GLN 95 -14.468 -8.237 3.602
741 H GLN 96 H GLN 96 -10.338 -6.771 4.348
742 HA GLN 96 HA GLN 96 -10.081 -9.370 3.082
743 1HB GLN 96 2HB GLN 96 -11.101 -8.433 1.158
744 2HB GLN 96 1HB GLN 96 -12.032 -7.909 2.551
745 1HG GLN 96 2HG GLN 96 -10.520 -5.802 2.433
746 2HG GLN 96 1HG GLN 96 -10.235 -6.324 0.776
747 1HE2 GLN 96 1HE2 GLN 96 -11.366 -3.947 1.061
748 2HE2 GLN 96 2HE2 GLN 96 -13.048 -3.990 0.674
749 H GLY 97 H GLY 97 -7.888 -7.319 4.076
750 1HA GLY 97 2HA GLY 97 -5.635 -7.824 3.151
751 2HA GLY 97 1HA GLY 97 -6.321 -7.473 1.574
752 H ALA 98 H ALA 98 -5.504 -6.049 4.700
753 HA ALA 98 HA ALA 98 -4.371 -3.767 3.504
754 1HB ALA 98 1HB ALA 98 -6.125 -2.449 3.251
755 2HB ALA 98 2HB ALA 98 -6.262 -2.401 5.007
756 3HB ALA 98 3HB ALA 98 -7.171 -3.590 4.084
757 H PHE 99 H PHE 99 -3.081 -2.631 4.947
758 HA PHE 99 HA PHE 99 -2.654 -3.946 7.462
759 1HB PHE 99 2HB PHE 99 -0.847 -3.104 5.817
760 2HB PHE 99 1HB PHE 99 -1.149 -1.524 6.533
761 HD1 PHE 99 1HD PHE 99 -1.050 -4.891 8.108
762 HD2 PHE 99 2HD PHE 99 0.719 -1.036 7.795
763 HE1 PHE 99 1HE PHE 99 0.461 -5.440 9.967
764 HE2 PHE 99 2HE PHE 99 2.240 -1.583 9.655
765 HZ PHE 99 HZ PHE 99 2.110 -3.785 10.742
766 H ASP 100 H ASP 100 -3.289 -0.582 6.446
767 HA ASP 100 HA ASP 100 -5.150 -0.046 8.439
768 1HB ASP 100 2HB ASP 100 -2.518 -0.137 9.479
769 2HB ASP 100 1HB ASP 100 -3.006 1.556 9.463
770 H TYR 101 H TYR 101 -4.672 2.583 9.062
771 HA TYR 101 HA TYR 101 -4.353 3.947 6.479
772 1HB TYR 101 2HB TYR 101 -6.784 3.753 8.143
773 2HB TYR 101 1HB TYR 101 -6.378 5.378 7.610
774 HD1 TYR 101 1HD TYR 101 -7.125 1.951 6.407
775 HD2 TYR 101 2HD TYR 101 -6.815 6.068 5.395
776 HE1 TYR 101 1HE TYR 101 -8.205 1.494 4.246
777 HE2 TYR 101 2HE TYR 101 -7.891 5.622 3.226
778 HH TYR 101 HH TYR 101 -9.623 2.977 2.550
779 H LEU 102 H LEU 102 -3.845 6.202 6.661
780 HA LEU 102 HA LEU 102 -2.607 6.867 9.239
781 1HB LEU 102 2HB LEU 102 -2.056 7.623 6.409
782 2HB LEU 102 1HB LEU 102 -1.673 8.793 7.649
783 HG LEU 102 HG LEU 102 0.352 7.755 7.448
784 1HD1 LEU 102 1HD1 LEU 102 0.725 6.140 9.224
785 2HD1 LEU 102 2HD1 LEU 102 -1.015 5.912 9.390
786 3HD1 LEU 102 3HD1 LEU 102 -0.291 7.476 9.768
787 1HD2 LEU 102 1HD2 LEU 102 0.546 6.059 6.054
788 2HD2 LEU 102 2HD2 LEU 102 -1.180 5.732 6.171
789 3HD2 LEU 102 3HD2 LEU 102 -0.064 4.976 7.305
790 HA PRO 103 HA PRO 103 -6.156 9.488 10.029
791 1HB PRO 103 2HB PRO 103 -4.160 10.800 11.814
792 2HB PRO 103 1HB PRO 103 -5.802 10.256 12.172
793 1HG PRO 103 2HG PRO 103 -3.691 8.860 13.005
794 2HG PRO 103 1HG PRO 103 -5.157 8.046 12.429
795 1HD PRO 103 2HD PRO 103 -2.524 8.393 11.078
796 2HD PRO 103 1HD PRO 103 -3.672 7.041 10.988
797 H LYS 104 H LYS 104 -2.913 10.867 9.673
798 HA LYS 104 HA LYS 104 -3.870 12.760 7.731
799 1HB LYS 104 2HB LYS 104 -2.652 13.831 10.283
800 2HB LYS 104 1HB LYS 104 -3.173 14.772 8.894
801 1HG LYS 104 2HG LYS 104 -5.478 14.154 9.299
802 2HG LYS 104 1HG LYS 104 -4.986 13.115 10.637
803 1HD LYS 104 2HD LYS 104 -3.918 15.277 11.591
804 2HD LYS 104 1HD LYS 104 -4.999 16.101 10.466
805 1HE LYS 104 2HE LYS 104 -6.114 15.958 12.576
806 2HE LYS 104 1HE LYS 104 -6.897 14.828 11.471
807 1HZ LYS 104 1HZ LYS 104 -6.261 13.073 12.686
808 2HZ LYS 104 2HZ LYS 104 -6.078 14.197 13.936
809 3HZ LYS 104 3HZ LYS 104 -4.733 13.710 13.033
810 HA PRO 105 HA PRO 105 0.891 12.898 7.823
811 1HB PRO 105 2HB PRO 105 2.294 11.725 9.782
812 2HB PRO 105 1HB PRO 105 1.586 13.331 9.987
813 1HG PRO 105 2HG PRO 105 0.620 10.691 10.992
814 2HG PRO 105 1HG PRO 105 0.621 12.267 11.801
815 1HD PRO 105 2HD PRO 105 -1.565 11.135 10.562
816 2HD PRO 105 1HD PRO 105 -1.364 12.866 10.872
817 H PHE 106 H PHE 106 2.613 11.441 7.123
818 HA PHE 106 HA PHE 106 2.433 8.653 7.315
819 1HB PHE 106 2HB PHE 106 2.114 8.443 4.678
820 2HB PHE 106 1HB PHE 106 0.777 8.314 5.804
821 HD1 PHE 106 1HD PHE 106 -0.767 10.226 6.101
822 HD2 PHE 106 2HD PHE 106 2.237 10.174 3.090
823 HE1 PHE 106 1HE PHE 106 -1.954 12.015 4.888
824 HE2 PHE 106 2HE PHE 106 1.065 11.969 1.879
825 HZ PHE 106 HZ PHE 106 -1.035 12.889 2.778
826 H ASP 107 H ASP 107 3.291 10.651 4.492
827 HA ASP 107 HA ASP 107 5.240 10.632 3.270
828 1HB ASP 107 2HB ASP 107 7.054 11.768 4.477
829 2HB ASP 107 1HB ASP 107 5.496 12.512 4.825
830 H ILE 108 H ILE 108 7.909 10.094 3.965
831 HA ILE 108 HA ILE 108 7.867 7.274 3.795
832 HB ILE 108 HB ILE 108 9.862 9.332 3.545
833 1HG1 ILE 108 2HG1 ILE 108 10.822 7.745 1.965
834 2HG1 ILE 108 1HG1 ILE 108 9.792 6.471 2.605
835 1HG2 ILE 108 1HG2 ILE 108 11.800 7.832 4.144
836 2HG2 ILE 108 2HG2 ILE 108 10.648 6.855 5.052
837 3HG2 ILE 108 3HG2 ILE 108 10.926 8.538 5.504
838 1HD1 ILE 108 1HD1 ILE 108 9.156 7.749 0.415
839 2HD1 ILE 108 2HD1 ILE 108 8.518 8.936 1.553
840 3HD1 ILE 108 3HD1 ILE 108 7.920 7.276 1.583
841 H ASP 109 H ASP 109 8.750 9.460 6.374
842 HA ASP 109 HA ASP 109 9.696 7.631 8.216
843 1HB ASP 109 2HB ASP 109 8.344 10.284 8.496
844 2HB ASP 109 1HB ASP 109 8.659 9.322 9.936
845 H GLU 110 H GLU 110 6.325 8.843 8.068
846 HA GLU 110 HA GLU 110 5.464 6.834 9.890
847 1HB GLU 110 2HB GLU 110 3.782 8.727 8.267
848 2HB GLU 110 1HB GLU 110 3.231 7.770 9.625
849 1HG GLU 110 2HG GLU 110 5.509 9.477 10.236
850 2HG GLU 110 1HG GLU 110 4.075 10.361 9.699
851 H ALA 111 H ALA 111 5.518 7.113 6.404
852 HA ALA 111 HA ALA 111 3.601 5.007 6.052
853 1HB ALA 111 1HB ALA 111 4.015 6.845 4.370
854 2HB ALA 111 2HB ALA 111 3.946 5.206 3.722
855 3HB ALA 111 3HB ALA 111 5.505 6.000 3.944
856 H VAL 112 H VAL 112 7.127 5.279 5.492
857 HA VAL 112 HA VAL 112 7.574 2.562 4.965
858 HB VAL 112 HB VAL 112 9.468 4.499 6.295
859 1HG1 VAL 112 1HG1 VAL 112 10.707 2.506 4.632
860 2HG1 VAL 112 2HG1 VAL 112 9.705 1.737 5.864
861 3HG1 VAL 112 3HG1 VAL 112 10.977 2.865 6.339
862 1HG2 VAL 112 1HG2 VAL 112 10.271 4.213 3.679
863 2HG2 VAL 112 2HG2 VAL 112 9.368 5.578 4.331
864 3HG2 VAL 112 3HG2 VAL 112 8.513 4.251 3.545
865 H ALA 113 H ALA 113 7.124 4.314 7.911
866 HA ALA 113 HA ALA 113 8.122 2.402 9.729
867 1HB ALA 113 1HB ALA 113 7.435 4.865 10.128
868 2HB ALA 113 2HB ALA 113 7.144 3.690 11.407
869 3HB ALA 113 3HB ALA 113 5.819 4.210 10.366
870 H LEU 114 H LEU 114 4.891 3.066 8.471
871 HA LEU 114 HA LEU 114 3.650 0.882 9.798
872 1HB LEU 114 2HB LEU 114 2.623 3.094 8.928
873 2HB LEU 114 1HB LEU 114 2.528 2.267 7.387
874 HG LEU 114 HG LEU 114 0.998 0.644 8.252
875 1HD1 LEU 114 1HD1 LEU 114 1.551 0.042 10.367
876 2HD1 LEU 114 2HD1 LEU 114 0.222 1.140 10.730
877 3HD1 LEU 114 3HD1 LEU 114 1.892 1.695 10.877
878 1HD2 LEU 114 1HD2 LEU 114 -0.254 2.494 7.632
879 2HD2 LEU 114 2HD2 LEU 114 0.404 3.503 8.914
880 3HD2 LEU 114 3HD2 LEU 114 -0.772 2.246 9.293
881 H VAL 115 H VAL 115 5.426 1.194 6.864
882 HA VAL 115 HA VAL 115 4.228 -1.067 5.573
883 HB VAL 115 HB VAL 115 5.440 0.899 4.415
884 1HG1 VAL 115 1HG1 VAL 115 7.537 0.679 5.685
885 2HG1 VAL 115 2HG1 VAL 115 7.788 0.588 3.949
886 3HG1 VAL 115 3HG1 VAL 115 7.820 -0.880 4.926
887 1HG2 VAL 115 1HG2 VAL 115 5.177 -1.899 3.731
888 2HG2 VAL 115 2HG2 VAL 115 6.500 -1.129 2.859
889 3HG2 VAL 115 3HG2 VAL 115 4.872 -0.465 2.753
890 H GLU 116 H GLU 116 7.228 -0.483 7.346
891 HA GLU 116 HA GLU 116 8.308 -3.070 6.981
892 1HB GLU 116 2HB GLU 116 8.807 -0.927 9.044
893 2HB GLU 116 1HB GLU 116 9.706 -2.438 9.007
894 1HG GLU 116 2HG GLU 116 10.294 -1.855 6.609
895 2HG GLU 116 1HG GLU 116 9.669 -0.244 6.964
896 H ARG 117 H ARG 117 6.303 -1.656 9.533
897 HA ARG 117 HA ARG 117 6.368 -3.838 11.293
898 1HB ARG 117 2HB ARG 117 4.211 -1.769 10.846
899 2HB ARG 117 1HB ARG 117 4.241 -2.896 12.196
900 1HG ARG 117 2HG ARG 117 6.205 -1.911 13.090
901 2HG ARG 117 1HG ARG 117 6.460 -0.950 11.633
902 1HD ARG 117 2HD ARG 117 5.559 0.479 13.328
903 2HD ARG 117 1HD ARG 117 4.318 0.221 12.105
904 HE ARG 117 HE ARG 117 4.349 -0.899 14.816
905 1HH1 ARG 117 1HH1 ARG 117 2.683 -0.418 11.783
906 2HH1 ARG 117 2HH1 ARG 117 1.143 -0.887 12.414
907 1HH2 ARG 117 1HH2 ARG 117 2.324 -1.519 15.640
908 2HH2 ARG 117 2HH2 ARG 117 0.938 -1.513 14.601
909 H ALA 118 H ALA 118 4.671 -3.315 8.344
910 HA ALA 118 HA ALA 118 2.654 -5.277 8.731
911 1HB ALA 118 1HB ALA 118 2.409 -5.027 6.206
912 2HB ALA 118 2HB ALA 118 3.659 -3.787 6.335
913 3HB ALA 118 3HB ALA 118 2.132 -3.589 7.192
914 H ILE 119 H ILE 119 5.842 -5.289 7.171
915 HA ILE 119 HA ILE 119 5.588 -7.976 6.234
916 HB ILE 119 HB ILE 119 8.168 -6.492 6.668
917 1HG1 ILE 119 2HG1 ILE 119 6.951 -6.459 3.977
918 2HG1 ILE 119 1HG1 ILE 119 6.169 -5.438 5.184
919 1HG2 ILE 119 1HG2 ILE 119 8.864 -7.866 4.688
920 2HG2 ILE 119 2HG2 ILE 119 7.348 -8.753 4.859
921 3HG2 ILE 119 3HG2 ILE 119 8.537 -8.781 6.160
922 1HD1 ILE 119 1HD1 ILE 119 9.127 -5.352 4.798
923 2HD1 ILE 119 2HD1 ILE 119 8.049 -4.134 5.482
924 3HD1 ILE 119 3HD1 ILE 119 8.046 -4.438 3.745
925 H SER 120 H SER 120 6.751 -6.410 9.089
926 HA SER 120 HA SER 120 8.264 -8.531 10.166
927 1HB SER 120 2HB SER 120 8.228 -7.269 12.236
928 2HB SER 120 1HB SER 120 8.445 -6.158 10.883
929 HG SER 120 HG SER 120 6.141 -6.615 12.444
930 H HIS 121 H HIS 121 4.885 -7.549 10.620
931 HA HIS 121 HA HIS 121 4.299 -9.487 12.593
932 1HB HIS 121 2HB HIS 121 2.698 -7.699 10.826
933 2HB HIS 121 1HB HIS 121 1.870 -9.038 11.619
934 HD1 HIS 121 1HD HIS 121 3.522 -5.765 12.312
935 HD2 HIS 121 2HD HIS 121 1.632 -8.810 14.414
936 HE1 HIS 121 1HE HIS 121 3.102 -4.835 14.611
937 HE2 HIS 121 2HE HIS 121 2.031 -6.724 15.889
938 H TYR 122 H TYR 122 4.571 -9.638 9.172
939 HA TYR 122 HA TYR 122 3.037 -12.026 8.828
940 1HB TYR 122 2HB TYR 122 4.288 -10.098 7.140
941 2HB TYR 122 1HB TYR 122 4.856 -11.697 6.678
942 HD1 TYR 122 1HD TYR 122 2.631 -13.444 6.960
943 HD2 TYR 122 2HD TYR 122 2.645 -9.383 5.692
944 HE1 TYR 122 1HE TYR 122 0.544 -13.831 5.718
945 HE2 TYR 122 2HE TYR 122 0.559 -9.761 4.447
946 HH TYR 122 HH TYR 122 -1.485 -12.026 4.921
947 H GLN 123 H GLN 123 6.503 -11.252 8.788
948 HA GLN 123 HA GLN 123 7.281 -13.992 8.628
949 1HB GLN 123 2HB GLN 123 9.577 -13.125 8.939
950 2HB GLN 123 1HB GLN 123 8.709 -12.298 7.657
951 1HG GLN 123 2HG GLN 123 8.183 -10.496 9.336
952 2HG GLN 123 1HG GLN 123 9.328 -11.290 10.413
953 1HE2 GLN 123 1HE2 GLN 123 9.013 -8.851 8.292
954 2HE2 GLN 123 2HE2 GLN 123 10.647 -8.691 7.758
955 H GLU 124 H GLU 124 9.270 -14.412 10.372
956 HA GLU 124 HA GLU 124 9.745 -15.110 12.485
957 1HB GLU 124 2HB GLU 124 7.884 -12.913 13.403
958 2HB GLU 124 1HB GLU 124 9.134 -13.702 14.352
959 1HG GLU 124 2HG GLU 124 9.860 -12.261 11.846
960 2HG GLU 124 1HG GLU 124 9.558 -11.357 13.328
Start of MODEL 19
1 1H MET 1 1HT MET 1 7.425 -18.084 2.855
2 2H MET 1 2HT MET 1 8.688 -19.243 2.816
3 3H MET 1 3HT MET 1 8.183 -18.475 1.370
4 HA MET 1 HA MET 1 8.873 -16.556 3.296
5 1HB MET 1 2HB MET 1 10.419 -18.932 3.422
6 2HB MET 1 1HB MET 1 11.404 -17.728 2.606
7 1HG MET 1 2HG MET 1 10.024 -16.784 5.016
8 2HG MET 1 1HG MET 1 11.246 -18.027 5.282
9 1HE MET 1 1HE MET 1 12.381 -14.682 6.456
10 2HE MET 1 2HE MET 1 13.613 -15.943 6.402
11 3HE MET 1 3HE MET 1 11.949 -16.352 6.822
12 H GLN 2 H GLN 2 9.337 -14.796 2.146
13 HA GLN 2 HA GLN 2 10.240 -15.148 -0.636
14 1HB GLN 2 2HB GLN 2 7.960 -13.698 0.456
15 2HB GLN 2 1HB GLN 2 8.986 -12.667 -0.529
16 1HG GLN 2 2HG GLN 2 8.510 -13.782 -2.448
17 2HG GLN 2 1HG GLN 2 8.254 -15.319 -1.626
18 1HE2 GLN 2 1HE2 GLN 2 6.769 -12.905 -3.264
19 2HE2 GLN 2 2HE2 GLN 2 5.152 -13.104 -2.685
20 H ARG 3 H ARG 3 11.442 -13.285 -1.511
21 HA ARG 3 HA ARG 3 13.529 -12.504 0.240
22 1HB ARG 3 2HB ARG 3 14.359 -11.203 -1.686
23 2HB ARG 3 1HB ARG 3 13.957 -12.859 -2.119
24 1HG ARG 3 2HG ARG 3 11.625 -11.368 -2.555
25 2HG ARG 3 1HG ARG 3 12.953 -10.397 -3.195
26 1HD ARG 3 2HD ARG 3 13.661 -12.778 -4.172
27 2HD ARG 3 1HD ARG 3 11.920 -13.032 -4.074
28 HE ARG 3 HE ARG 3 11.962 -10.726 -5.344
29 1HH1 ARG 3 1HH1 ARG 3 13.995 -13.523 -5.851
30 2HH1 ARG 3 2HH1 ARG 3 14.233 -13.195 -7.533
31 1HH2 ARG 3 1HH2 ARG 3 12.288 -10.294 -7.556
32 2HH2 ARG 3 2HH2 ARG 3 13.269 -11.365 -8.500
33 H GLY 4 H GLY 4 10.450 -11.291 -0.047
34 1HA GLY 4 2HA GLY 4 9.597 -9.495 1.196
35 2HA GLY 4 1HA GLY 4 11.223 -8.840 1.323
36 H ILE 5 H ILE 5 8.472 -9.258 -0.842
37 HA ILE 5 HA ILE 5 9.556 -7.151 -2.576
38 HB ILE 5 HB ILE 5 7.161 -8.901 -3.123
39 1HG1 ILE 5 2HG1 ILE 5 9.084 -9.843 -4.789
40 2HG1 ILE 5 1HG1 ILE 5 10.058 -9.433 -3.380
41 1HG2 ILE 5 1HG2 ILE 5 8.612 -7.954 -5.420
42 2HG2 ILE 5 2HG2 ILE 5 8.136 -6.606 -4.387
43 3HG2 ILE 5 3HG2 ILE 5 6.917 -7.727 -4.992
44 1HD1 ILE 5 1HD1 ILE 5 9.427 -11.297 -2.384
45 2HD1 ILE 5 2HD1 ILE 5 8.495 -11.730 -3.817
46 3HD1 ILE 5 3HD1 ILE 5 7.733 -10.823 -2.510
47 H VAL 6 H VAL 6 8.930 -5.169 -2.055
48 HA VAL 6 HA VAL 6 6.223 -4.770 -0.975
49 HB VAL 6 HB VAL 6 7.910 -3.922 0.528
50 1HG1 VAL 6 1HG1 VAL 6 8.916 -2.049 -1.585
51 2HG1 VAL 6 2HG1 VAL 6 9.610 -3.654 -1.372
52 3HG1 VAL 6 3HG1 VAL 6 9.661 -2.500 -0.053
53 1HG2 VAL 6 1HG2 VAL 6 5.790 -2.481 -0.354
54 2HG2 VAL 6 2HG2 VAL 6 7.106 -1.335 -0.607
55 3HG2 VAL 6 3HG2 VAL 6 6.821 -2.012 0.996
56 H TRP 7 H TRP 7 4.737 -3.778 -2.178
57 HA TRP 7 HA TRP 7 5.656 -2.315 -4.563
58 1HB TRP 7 2HB TRP 7 3.200 -3.998 -4.100
59 2HB TRP 7 1HB TRP 7 3.286 -2.831 -5.417
60 HD1 TRP 7 HD1 TRP 7 6.627 -4.299 -4.940
61 HE1 TRP 7 1HE TRP 7 7.098 -6.118 -6.688
62 HE3 TRP 7 3HE TRP 7 1.877 -4.949 -6.740
63 HZ2 TRP 7 2HZ TRP 7 5.655 -7.641 -8.566
64 HZ3 TRP 7 3HZ TRP 7 1.519 -6.615 -8.513
65 HH2 TRP 7 HH2 TRP 7 3.366 -7.931 -9.407
66 H VAL 8 H VAL 8 4.985 -0.267 -4.892
67 HA VAL 8 HA VAL 8 3.106 0.878 -2.925
68 HB VAL 8 HB VAL 8 5.029 2.795 -3.999
69 1HG1 VAL 8 1HG1 VAL 8 4.235 2.018 -1.200
70 2HG1 VAL 8 2HG1 VAL 8 3.556 3.329 -2.166
71 3HG1 VAL 8 3HG1 VAL 8 5.234 3.407 -1.626
72 1HG2 VAL 8 1HG2 VAL 8 6.047 0.337 -2.649
73 2HG2 VAL 8 2HG2 VAL 8 6.819 1.890 -2.319
74 3HG2 VAL 8 3HG2 VAL 8 6.747 1.274 -3.972
75 H VAL 9 H VAL 9 1.568 2.285 -3.693
76 HA VAL 9 HA VAL 9 1.654 2.847 -6.585
77 HB VAL 9 HB VAL 9 -1.017 3.117 -5.469
78 1HG1 VAL 9 1HG1 VAL 9 -0.914 3.028 -7.766
79 2HG1 VAL 9 2HG1 VAL 9 -1.320 1.346 -7.408
80 3HG1 VAL 9 3HG1 VAL 9 0.337 1.802 -7.760
81 1HG2 VAL 9 1HG2 VAL 9 0.432 0.529 -5.054
82 2HG2 VAL 9 2HG2 VAL 9 -1.292 0.534 -5.421
83 3HG2 VAL 9 3HG2 VAL 9 -0.696 1.361 -3.988
84 H ASP 10 H ASP 10 2.357 4.849 -6.797
85 HA ASP 10 HA ASP 10 0.810 7.063 -5.990
86 1HB ASP 10 2HB ASP 10 2.159 6.281 -3.859
87 2HB ASP 10 1HB ASP 10 3.465 7.150 -4.653
88 H ASP 11 H ASP 11 0.999 8.325 -7.630
89 HA ASP 11 HA ASP 11 1.756 9.328 -9.513
90 1HB ASP 11 2HB ASP 11 3.273 10.175 -7.301
91 2HB ASP 11 1HB ASP 11 4.417 9.989 -8.625
92 H ASP 12 H ASP 12 5.003 8.309 -8.586
93 HA ASP 12 HA ASP 12 5.331 6.003 -10.029
94 1HB ASP 12 2HB ASP 12 4.563 7.654 -11.913
95 2HB ASP 12 1HB ASP 12 6.213 8.244 -11.829
96 H SER 13 H SER 13 7.805 7.409 -11.471
97 HA SER 13 HA SER 13 9.834 6.566 -9.942
98 1HB SER 13 2HB SER 13 9.750 9.070 -11.612
99 2HB SER 13 1HB SER 13 11.235 8.348 -10.994
100 HG SER 13 HG SER 13 11.101 7.357 -12.873
101 H SER 14 H SER 14 8.235 9.658 -9.607
102 HA SER 14 HA SER 14 9.884 10.887 -7.749
103 1HB SER 14 2HB SER 14 6.898 11.028 -8.170
104 2HB SER 14 1HB SER 14 7.715 12.020 -6.965
105 HG SER 14 HG SER 14 9.131 12.497 -8.983
106 H ILE 15 H ILE 15 6.867 9.132 -6.936
107 HA ILE 15 HA ILE 15 7.580 8.974 -4.194
108 HB ILE 15 HB ILE 15 5.503 7.257 -5.561
109 1HG1 ILE 15 2HG1 ILE 15 5.213 9.702 -6.060
110 2HG1 ILE 15 1HG1 ILE 15 3.887 8.994 -5.148
111 1HG2 ILE 15 1HG2 ILE 15 4.574 6.964 -3.419
112 2HG2 ILE 15 2HG2 ILE 15 5.491 8.302 -2.741
113 3HG2 ILE 15 3HG2 ILE 15 6.308 6.802 -3.167
114 1HD1 ILE 15 1HD1 ILE 15 4.254 11.041 -4.122
115 2HD1 ILE 15 2HD1 ILE 15 6.008 10.881 -4.216
116 3HD1 ILE 15 3HD1 ILE 15 5.093 9.895 -3.077
117 H ARG 16 H ARG 16 8.347 7.102 -6.956
118 HA ARG 16 HA ARG 16 8.866 4.621 -5.668
119 1HB ARG 16 2HB ARG 16 8.529 4.847 -8.116
120 2HB ARG 16 1HB ARG 16 10.056 5.707 -8.226
121 1HG ARG 16 2HG ARG 16 10.942 3.507 -7.031
122 2HG ARG 16 1HG ARG 16 9.531 2.818 -7.835
123 1HD ARG 16 2HD ARG 16 10.614 4.322 -9.827
124 2HD ARG 16 1HD ARG 16 12.055 3.799 -8.956
125 HE ARG 16 HE ARG 16 10.086 1.769 -9.685
126 1HH1 ARG 16 1HH1 ARG 16 13.187 3.258 -10.306
127 2HH1 ARG 16 2HH1 ARG 16 13.781 1.919 -11.227
128 1HH2 ARG 16 1HH2 ARG 16 10.878 0.006 -10.881
129 2HH2 ARG 16 2HH2 ARG 16 12.477 0.071 -11.545
130 H TRP 17 H TRP 17 11.054 7.176 -6.838
131 HA TRP 17 HA TRP 17 13.437 6.141 -5.903
132 1HB TRP 17 2HB TRP 17 13.295 8.080 -7.401
133 2HB TRP 17 1HB TRP 17 12.662 9.058 -6.080
134 HD1 TRP 17 HD1 TRP 17 15.910 7.353 -7.241
135 HE1 TRP 17 1HE TRP 17 17.887 8.455 -6.014
136 HE3 TRP 17 3HE TRP 17 13.299 10.370 -4.056
137 HZ2 TRP 17 2HZ TRP 17 18.285 10.353 -3.960
138 HZ3 TRP 17 3HZ TRP 17 14.549 11.796 -2.483
139 HH2 TRP 17 HH2 TRP 17 16.993 11.787 -2.441
140 H VAL 18 H VAL 18 11.158 8.264 -4.177
141 HA VAL 18 HA VAL 18 12.731 8.551 -1.865
142 HB VAL 18 HB VAL 18 9.738 8.638 -1.772
143 1HG1 VAL 18 1HG1 VAL 18 11.555 9.052 0.166
144 2HG1 VAL 18 2HG1 VAL 18 9.990 9.861 0.109
145 3HG1 VAL 18 3HG1 VAL 18 11.431 10.684 -0.486
146 1HG2 VAL 18 1HG2 VAL 18 11.537 10.326 -3.358
147 2HG2 VAL 18 2HG2 VAL 18 10.413 11.207 -2.325
148 3HG2 VAL 18 3HG2 VAL 18 9.804 10.055 -3.510
149 H LEU 19 H LEU 19 10.121 6.297 -2.585
150 HA LEU 19 HA LEU 19 10.347 5.061 -0.011
151 1HB LEU 19 2HB LEU 19 8.286 5.340 -1.711
152 2HB LEU 19 1HB LEU 19 8.791 3.711 -2.115
153 HG LEU 19 HG LEU 19 7.007 3.718 -0.439
154 1HD1 LEU 19 1HD1 LEU 19 7.859 1.947 0.655
155 2HD1 LEU 19 2HD1 LEU 19 9.295 2.825 1.181
156 3HD1 LEU 19 3HD1 LEU 19 9.211 2.174 -0.454
157 1HD2 LEU 19 1HD2 LEU 19 7.302 4.635 1.740
158 2HD2 LEU 19 2HD2 LEU 19 7.675 5.906 0.575
159 3HD2 LEU 19 3HD2 LEU 19 8.980 5.055 1.400
160 H GLU 20 H GLU 20 11.592 4.403 -3.183
161 HA GLU 20 HA GLU 20 12.090 1.660 -2.805
162 1HB GLU 20 2HB GLU 20 13.625 1.859 -4.717
163 2HB GLU 20 1HB GLU 20 12.049 2.571 -5.019
164 1HG GLU 20 2HG GLU 20 13.216 4.271 -5.832
165 2HG GLU 20 1HG GLU 20 13.427 4.717 -4.144
166 H ARG 21 H ARG 21 14.451 4.354 -2.733
167 HA ARG 21 HA ARG 21 16.614 2.905 -1.832
168 1HB ARG 21 2HB ARG 21 15.822 5.776 -1.505
169 2HB ARG 21 1HB ARG 21 17.274 5.168 -0.724
170 1HG ARG 21 2HG ARG 21 16.869 4.672 -3.628
171 2HG ARG 21 1HG ARG 21 17.393 6.265 -3.085
172 1HD ARG 21 2HD ARG 21 18.767 3.628 -2.584
173 2HD ARG 21 1HD ARG 21 19.328 4.932 -3.630
174 HE ARG 21 HE ARG 21 19.547 4.784 -0.758
175 1HH1 ARG 21 1HH1 ARG 21 19.560 6.893 -3.540
176 2HH1 ARG 21 2HH1 ARG 21 20.479 8.131 -2.752
177 1HH2 ARG 21 1HH2 ARG 21 20.757 6.412 0.278
178 2HH2 ARG 21 2HH2 ARG 21 21.159 7.859 -0.586
179 H ALA 22 H ALA 22 14.563 4.938 0.274
180 HA ALA 22 HA ALA 22 15.590 4.153 2.692
181 1HB ALA 22 1HB ALA 22 12.787 4.456 3.036
182 2HB ALA 22 2HB ALA 22 13.327 5.591 1.798
183 3HB ALA 22 3HB ALA 22 14.073 5.608 3.398
184 H LEU 23 H LEU 23 12.786 2.722 1.101
185 HA LEU 23 HA LEU 23 12.514 0.628 2.986
186 1HB LEU 23 2HB LEU 23 10.722 1.464 1.441
187 2HB LEU 23 1HB LEU 23 11.547 0.640 0.137
188 HG LEU 23 HG LEU 23 11.048 -1.492 1.011
189 1HD1 LEU 23 1HD1 LEU 23 9.808 -1.650 3.258
190 2HD1 LEU 23 2HD1 LEU 23 10.444 -0.030 3.560
191 3HD1 LEU 23 3HD1 LEU 23 11.550 -1.374 3.285
192 1HD2 LEU 23 1HD2 LEU 23 8.609 -1.466 1.304
193 2HD2 LEU 23 2HD2 LEU 23 9.142 -0.485 -0.062
194 3HD2 LEU 23 3HD2 LEU 23 8.659 0.293 1.447
195 H ALA 24 H ALA 24 14.651 1.142 0.371
196 HA ALA 24 HA ALA 24 15.244 -1.577 -0.215
197 1HB ALA 24 1HB ALA 24 17.518 0.012 -0.752
198 2HB ALA 24 2HB ALA 24 16.106 0.990 -1.137
199 3HB ALA 24 3HB ALA 24 16.317 -0.585 -1.897
200 H GLY 25 H GLY 25 16.396 0.849 2.055
201 1HA GLY 25 2HA GLY 25 18.694 -0.448 3.007
202 2HA GLY 25 1HA GLY 25 17.695 0.660 3.941
203 H ALA 26 H ALA 26 15.314 -1.053 3.548
204 HA ALA 26 HA ALA 26 15.712 -2.744 5.821
205 1HB ALA 26 1HB ALA 26 13.250 -3.395 5.125
206 2HB ALA 26 2HB ALA 26 13.387 -1.925 4.159
207 3HB ALA 26 3HB ALA 26 13.607 -1.856 5.907
208 H GLY 27 H GLY 27 16.035 -3.086 2.449
209 1HA GLY 27 2HA GLY 27 17.023 -4.962 1.442
210 2HA GLY 27 1HA GLY 27 16.493 -5.942 2.797
211 H LEU 28 H LEU 28 14.192 -3.855 1.095
212 HA LEU 28 HA LEU 28 13.058 -6.317 -0.025
213 1HB LEU 28 2HB LEU 28 11.308 -3.970 0.394
214 2HB LEU 28 1HB LEU 28 10.931 -5.677 0.484
215 HG LEU 28 HG LEU 28 12.489 -5.506 2.638
216 1HD1 LEU 28 1HD1 LEU 28 11.531 -3.240 3.644
217 2HD1 LEU 28 2HD1 LEU 28 11.753 -2.770 1.959
218 3HD1 LEU 28 3HD1 LEU 28 13.117 -3.387 2.883
219 1HD2 LEU 28 1HD2 LEU 28 10.584 -5.892 3.776
220 2HD2 LEU 28 2HD2 LEU 28 9.865 -5.925 2.166
221 3HD2 LEU 28 3HD2 LEU 28 9.794 -4.451 3.132
222 H THR 29 H THR 29 11.629 -6.005 -1.923
223 HA THR 29 HA THR 29 12.941 -4.243 -3.854
224 HB THR 29 HB THR 29 11.055 -6.585 -4.171
225 HG1 THR 29 1HG THR 29 12.898 -7.469 -5.215
226 1HG2 THR 29 1HG2 THR 29 10.425 -5.675 -6.112
227 2HG2 THR 29 2HG2 THR 29 12.029 -6.163 -6.664
228 3HG2 THR 29 3HG2 THR 29 11.749 -4.511 -6.114
229 H CYS 30 H CYS 30 12.064 -2.337 -4.272
230 HA CYS 30 HA CYS 30 9.208 -1.966 -3.715
231 1HB CYS 30 2HB CYS 30 11.138 0.295 -4.051
232 2HB CYS 30 1HB CYS 30 9.638 0.240 -3.131
233 HG CYS 30 HG CYS 30 11.667 -1.601 -1.899
234 H THR 31 H THR 31 7.887 -1.835 -5.366
235 HA THR 31 HA THR 31 8.841 -0.592 -7.856
236 HB THR 31 HB THR 31 8.414 -3.161 -7.927
237 HG1 THR 31 1HG THR 31 8.458 -1.559 -9.742
238 1HG2 THR 31 1HG2 THR 31 5.616 -2.576 -8.561
239 2HG2 THR 31 2HG2 THR 31 6.014 -2.637 -6.844
240 3HG2 THR 31 3HG2 THR 31 6.352 -4.021 -7.885
241 H THR 32 H THR 32 7.441 0.941 -8.744
242 HA THR 32 HA THR 32 5.098 1.521 -7.083
243 HB THR 32 HB THR 32 5.414 3.892 -7.689
244 HG1 THR 32 1HG THR 32 7.824 2.958 -8.852
245 1HG2 THR 32 1HG2 THR 32 8.083 3.215 -6.704
246 2HG2 THR 32 2HG2 THR 32 6.754 2.508 -5.792
247 3HG2 THR 32 3HG2 THR 32 6.844 4.259 -6.011
248 H PHE 33 H PHE 33 3.346 2.700 -8.069
249 HA PHE 33 HA PHE 33 2.992 2.152 -10.917
250 1HB PHE 33 2HB PHE 33 0.996 1.424 -8.795
251 2HB PHE 33 1HB PHE 33 0.783 1.232 -10.520
252 HD1 PHE 33 1HD PHE 33 1.323 -0.814 -11.492
253 HD2 PHE 33 2HD PHE 33 3.059 0.247 -7.759
254 HE1 PHE 33 1HE PHE 33 2.347 -3.033 -11.343
255 HE2 PHE 33 2HE PHE 33 4.092 -1.970 -7.607
256 HZ PHE 33 HZ PHE 33 3.727 -3.629 -9.405
257 H GLU 34 H GLU 34 0.777 3.097 -11.635
258 HA GLU 34 HA GLU 34 0.994 5.871 -11.462
259 1HB GLU 34 2HB GLU 34 -0.986 5.963 -12.813
260 2HB GLU 34 1HB GLU 34 0.000 4.609 -13.348
261 1HG GLU 34 2HG GLU 34 -1.619 3.389 -11.551
262 2HG GLU 34 1HG GLU 34 -2.686 4.647 -12.165
263 H ASN 35 H ASN 35 -1.478 3.773 -9.863
264 HA ASN 35 HA ASN 35 -1.710 5.614 -7.720
265 1HB ASN 35 2HB ASN 35 -4.218 6.068 -8.186
266 2HB ASN 35 1HB ASN 35 -3.009 7.050 -9.007
267 1HD2 ASN 35 1HD2 ASN 35 -4.843 4.052 -9.412
268 2HD2 ASN 35 2HD2 ASN 35 -5.128 4.247 -11.104
269 H GLY 36 H GLY 36 -2.900 2.817 -9.393
270 1HA GLY 36 2HA GLY 36 -3.104 1.233 -7.126
271 2HA GLY 36 1HA GLY 36 -4.692 1.941 -7.368
272 H ASN 37 H ASN 37 -5.294 1.834 -9.882
273 HA ASN 37 HA ASN 37 -5.960 -0.766 -10.449
274 1HB ASN 37 2HB ASN 37 -5.675 1.661 -12.173
275 2HB ASN 37 1HB ASN 37 -6.024 0.104 -12.922
276 1HD2 ASN 37 1HD2 ASN 37 -7.675 -1.058 -11.088
277 2HD2 ASN 37 2HD2 ASN 37 -9.136 -0.151 -10.945
278 H GLU 38 H GLU 38 -3.001 0.922 -11.257
279 HA GLU 38 HA GLU 38 -1.975 -0.945 -13.077
280 1HB GLU 38 2HB GLU 38 -1.110 1.434 -12.154
281 2HB GLU 38 1HB GLU 38 -0.065 0.354 -11.255
282 1HG GLU 38 2HG GLU 38 0.612 -0.700 -13.393
283 2HG GLU 38 1HG GLU 38 -0.330 0.525 -14.240
284 H VAL 39 H VAL 39 -1.323 -0.673 -9.505
285 HA VAL 39 HA VAL 39 0.208 -3.006 -9.317
286 HB VAL 39 HB VAL 39 -1.779 -2.259 -7.184
287 1HG1 VAL 39 1HG1 VAL 39 -0.046 -4.304 -7.274
288 2HG1 VAL 39 2HG1 VAL 39 -0.523 -3.499 -5.779
289 3HG1 VAL 39 3HG1 VAL 39 0.993 -3.064 -6.569
290 1HG2 VAL 39 1HG2 VAL 39 0.243 -0.579 -8.286
291 2HG2 VAL 39 2HG2 VAL 39 0.690 -1.018 -6.637
292 3HG2 VAL 39 3HG2 VAL 39 -0.867 -0.266 -6.963
293 H LEU 40 H LEU 40 -3.299 -2.608 -9.145
294 HA LEU 40 HA LEU 40 -4.014 -5.235 -8.549
295 1HB LEU 40 2HB LEU 40 -5.599 -3.432 -10.365
296 2HB LEU 40 1HB LEU 40 -6.204 -4.678 -9.289
297 HG LEU 40 HG LEU 40 -4.933 -2.093 -8.394
298 1HD1 LEU 40 1HD1 LEU 40 -6.932 -1.318 -9.125
299 2HD1 LEU 40 2HD1 LEU 40 -7.417 -1.878 -7.531
300 3HD1 LEU 40 3HD1 LEU 40 -7.729 -2.878 -8.949
301 1HD2 LEU 40 1HD2 LEU 40 -4.592 -3.868 -6.784
302 2HD2 LEU 40 2HD2 LEU 40 -6.308 -4.273 -6.838
303 3HD2 LEU 40 3HD2 LEU 40 -5.788 -2.720 -6.183
304 H ALA 41 H ALA 41 -3.433 -3.673 -11.672
305 HA ALA 41 HA ALA 41 -4.111 -5.947 -13.234
306 1HB ALA 41 1HB ALA 41 -4.151 -3.644 -14.116
307 2HB ALA 41 2HB ALA 41 -3.183 -4.737 -15.107
308 3HB ALA 41 3HB ALA 41 -2.390 -3.604 -14.013
309 H ALA 42 H ALA 42 -1.037 -4.529 -12.277
310 HA ALA 42 HA ALA 42 0.619 -6.474 -13.461
311 1HB ALA 42 1HB ALA 42 1.595 -5.164 -10.995
312 2HB ALA 42 2HB ALA 42 1.092 -4.098 -12.308
313 3HB ALA 42 3HB ALA 42 2.347 -5.302 -12.586
314 H LEU 43 H LEU 43 -1.150 -6.373 -10.484
315 HA LEU 43 HA LEU 43 0.248 -8.395 -9.100
316 1HB LEU 43 2HB LEU 43 -2.398 -7.068 -8.831
317 2HB LEU 43 1HB LEU 43 -2.136 -8.566 -7.956
318 HG LEU 43 HG LEU 43 -0.139 -6.360 -7.706
319 1HD1 LEU 43 1HD1 LEU 43 -2.334 -5.319 -7.356
320 2HD1 LEU 43 2HD1 LEU 43 -1.377 -5.384 -5.877
321 3HD1 LEU 43 3HD1 LEU 43 -2.691 -6.528 -6.133
322 1HD2 LEU 43 1HD2 LEU 43 -0.877 -8.844 -6.306
323 2HD2 LEU 43 2HD2 LEU 43 -0.427 -7.485 -5.277
324 3HD2 LEU 43 3HD2 LEU 43 0.695 -8.071 -6.505
325 H ALA 44 H ALA 44 -2.087 -8.490 -11.626
326 HA ALA 44 HA ALA 44 -3.234 -10.999 -11.212
327 1HB ALA 44 1HB ALA 44 -2.587 -9.808 -13.901
328 2HB ALA 44 2HB ALA 44 -3.949 -9.299 -12.903
329 3HB ALA 44 3HB ALA 44 -3.869 -10.954 -13.509
330 H SER 45 H SER 45 -0.015 -10.193 -12.006
331 HA SER 45 HA SER 45 0.517 -12.950 -12.805
332 1HB SER 45 2HB SER 45 1.385 -10.419 -13.940
333 2HB SER 45 1HB SER 45 2.747 -11.475 -13.564
334 HG SER 45 HG SER 45 1.994 -11.922 -15.636
335 H LYS 46 H LYS 46 0.828 -10.866 -10.242
336 HA LYS 46 HA LYS 46 2.624 -12.595 -8.880
337 1HB LYS 46 2HB LYS 46 4.014 -10.908 -10.400
338 2HB LYS 46 1HB LYS 46 3.752 -9.852 -9.020
339 1HG LYS 46 2HG LYS 46 4.643 -12.496 -8.228
340 2HG LYS 46 1HG LYS 46 5.783 -11.686 -9.305
341 1HD LYS 46 2HD LYS 46 5.272 -9.644 -7.690
342 2HD LYS 46 1HD LYS 46 4.904 -10.952 -6.563
343 1HE LYS 46 2HE LYS 46 7.381 -11.345 -8.065
344 2HE LYS 46 1HE LYS 46 7.393 -9.909 -7.042
345 1HZ LYS 46 1HZ LYS 46 7.108 -11.164 -5.137
346 2HZ LYS 46 2HZ LYS 46 8.144 -12.137 -6.052
347 3HZ LYS 46 3HZ LYS 46 6.494 -12.504 -5.969
348 H THR 47 H THR 47 3.081 -11.863 -6.655
349 HA THR 47 HA THR 47 1.250 -9.833 -5.668
350 HB THR 47 HB THR 47 1.391 -12.673 -4.656
351 HG1 THR 47 1HG THR 47 -0.838 -11.195 -5.582
352 1HG2 THR 47 1HG2 THR 47 1.193 -10.948 -2.819
353 2HG2 THR 47 2HG2 THR 47 -0.095 -12.150 -2.917
354 3HG2 THR 47 3HG2 THR 47 -0.365 -10.519 -3.529
355 HA PRO 48 HA PRO 48 5.128 -9.047 -3.474
356 1HB PRO 48 2HB PRO 48 4.459 -6.612 -2.519
357 2HB PRO 48 1HB PRO 48 4.939 -6.862 -4.203
358 1HG PRO 48 2HG PRO 48 2.192 -6.608 -3.035
359 2HG PRO 48 1HG PRO 48 2.854 -5.863 -4.499
360 1HD PRO 48 2HD PRO 48 1.299 -8.078 -4.565
361 2HD PRO 48 1HD PRO 48 2.575 -7.771 -5.755
362 H ASP 49 H ASP 49 5.672 -8.609 -1.179
363 HA ASP 49 HA ASP 49 3.935 -10.082 0.549
364 1HB ASP 49 2HB ASP 49 6.534 -8.625 1.003
365 2HB ASP 49 1HB ASP 49 5.658 -9.410 2.314
366 H VAL 50 H VAL 50 4.392 -6.718 -0.146
367 HA VAL 50 HA VAL 50 2.262 -6.058 1.741
368 HB VAL 50 HB VAL 50 4.305 -5.613 3.004
369 1HG1 VAL 50 1HG1 VAL 50 5.202 -3.436 1.241
370 2HG1 VAL 50 2HG1 VAL 50 5.478 -5.073 0.647
371 3HG1 VAL 50 3HG1 VAL 50 6.139 -4.577 2.204
372 1HG2 VAL 50 1HG2 VAL 50 3.378 -2.897 2.174
373 2HG2 VAL 50 2HG2 VAL 50 3.727 -3.522 3.787
374 3HG2 VAL 50 3HG2 VAL 50 2.253 -4.009 2.954
375 H LEU 51 H LEU 51 1.458 -3.754 1.330
376 HA LEU 51 HA LEU 51 2.067 -2.685 -1.296
377 1HB LEU 51 2HB LEU 51 0.359 -4.544 -1.559
378 2HB LEU 51 1HB LEU 51 -0.756 -3.530 -0.669
379 HG LEU 51 HG LEU 51 -0.570 -1.809 -2.438
380 1HD1 LEU 51 1HD1 LEU 51 0.930 -3.872 -4.034
381 2HD1 LEU 51 2HD1 LEU 51 1.726 -2.558 -3.170
382 3HD1 LEU 51 3HD1 LEU 51 0.585 -2.197 -4.463
383 1HD2 LEU 51 1HD2 LEU 51 -2.103 -4.018 -2.418
384 2HD2 LEU 51 2HD2 LEU 51 -1.270 -4.246 -3.956
385 3HD2 LEU 51 3HD2 LEU 51 -2.204 -2.778 -3.668
386 H LEU 52 H LEU 52 1.841 -0.541 -1.360
387 HA LEU 52 HA LEU 52 0.389 0.782 0.843
388 1HB LEU 52 2HB LEU 52 3.052 0.945 0.327
389 2HB LEU 52 1HB LEU 52 2.457 2.296 -0.614
390 HG LEU 52 HG LEU 52 1.926 1.919 2.329
391 1HD1 LEU 52 1HD1 LEU 52 3.541 4.122 2.021
392 2HD1 LEU 52 2HD1 LEU 52 4.230 2.955 0.892
393 3HD1 LEU 52 3HD1 LEU 52 4.049 2.535 2.596
394 1HD2 LEU 52 1HD2 LEU 52 1.553 4.513 1.908
395 2HD2 LEU 52 2HD2 LEU 52 0.259 3.338 1.709
396 3HD2 LEU 52 3HD2 LEU 52 1.130 3.930 0.298
397 H SER 53 H SER 53 -1.047 2.414 0.349
398 HA SER 53 HA SER 53 -1.317 3.128 -2.495
399 1HB SER 53 2HB SER 53 -3.434 2.253 -0.558
400 2HB SER 53 1HB SER 53 -3.848 3.293 -1.918
401 HG SER 53 HG SER 53 -2.490 0.814 -2.155
402 H ASP 54 H ASP 54 -1.357 5.229 -2.919
403 HA ASP 54 HA ASP 54 -1.017 7.152 -0.858
404 1HB ASP 54 2HB ASP 54 -0.090 7.281 -3.202
405 2HB ASP 54 1HB ASP 54 -1.709 7.713 -3.741
406 H ILE 55 H ILE 55 -3.775 5.782 -2.292
407 HA ILE 55 HA ILE 55 -5.977 6.319 -2.348
408 HB ILE 55 HB ILE 55 -5.785 5.616 -0.058
409 1HG1 ILE 55 2HG1 ILE 55 -7.396 8.065 0.377
410 2HG1 ILE 55 1HG1 ILE 55 -7.847 7.070 -0.997
411 1HG2 ILE 55 1HG2 ILE 55 -4.858 8.420 0.435
412 2HG2 ILE 55 2HG2 ILE 55 -4.062 6.900 0.842
413 3HG2 ILE 55 3HG2 ILE 55 -5.502 7.407 1.723
414 1HD1 ILE 55 1HD1 ILE 55 -9.006 6.631 1.223
415 2HD1 ILE 55 2HD1 ILE 55 -7.489 5.898 1.728
416 3HD1 ILE 55 3HD1 ILE 55 -8.366 5.238 0.350
417 H ARG 56 H ARG 56 -5.513 7.970 -3.998
418 HA ARG 56 HA ARG 56 -7.033 10.255 -3.617
419 1HB ARG 56 2HB ARG 56 -5.288 12.030 -3.666
420 2HB ARG 56 1HB ARG 56 -5.309 11.116 -2.166
421 1HG ARG 56 2HG ARG 56 -3.415 9.759 -3.046
422 2HG ARG 56 1HG ARG 56 -3.347 10.851 -4.431
423 1HD ARG 56 2HD ARG 56 -3.398 12.370 -1.998
424 2HD ARG 56 1HD ARG 56 -2.116 11.163 -1.920
425 HE ARG 56 HE ARG 56 -1.887 12.355 -4.394
426 1HH1 ARG 56 1HH1 ARG 56 -1.746 13.377 -1.061
427 2HH1 ARG 56 2HH1 ARG 56 -0.653 14.683 -1.376
428 1HH2 ARG 56 1HH2 ARG 56 -0.439 14.066 -4.812
429 2HH2 ARG 56 2HH2 ARG 56 0.090 15.076 -3.508
430 H MET 57 H MET 57 -7.318 8.710 -5.615
431 HA MET 57 HA MET 57 -6.546 10.246 -7.906
432 1HB MET 57 2HB MET 57 -4.651 8.462 -7.249
433 2HB MET 57 1HB MET 57 -5.682 7.428 -8.221
434 1HG MET 57 2HG MET 57 -4.402 8.180 -9.890
435 2HG MET 57 1HG MET 57 -5.530 9.531 -9.856
436 1HE MET 57 1HE MET 57 -4.116 12.024 -7.722
437 2HE MET 57 2HE MET 57 -5.339 11.509 -8.884
438 3HE MET 57 3HE MET 57 -3.925 12.409 -9.433
439 HA PRO 58 HA PRO 58 -9.376 6.617 -9.473
440 1HB PRO 58 2HB PRO 58 -10.194 4.818 -7.580
441 2HB PRO 58 1HB PRO 58 -8.783 4.580 -8.617
442 1HG PRO 58 2HG PRO 58 -8.912 5.628 -5.809
443 2HG PRO 58 1HG PRO 58 -7.818 4.415 -6.499
444 1HD PRO 58 2HD PRO 58 -6.998 6.919 -6.159
445 2HD PRO 58 1HD PRO 58 -6.546 6.008 -7.611
446 H GLY 59 H GLY 59 -11.683 5.622 -8.522
447 1HA GLY 59 2HA GLY 59 -13.295 7.895 -8.145
448 2HA GLY 59 1HA GLY 59 -13.820 6.230 -7.966
449 H MET 60 H MET 60 -12.994 5.174 -5.848
450 HA MET 60 HA MET 60 -13.905 6.869 -3.702
451 1HB MET 60 2HB MET 60 -12.970 3.998 -3.732
452 2HB MET 60 1HB MET 60 -13.548 4.823 -2.295
453 1HG MET 60 2HG MET 60 -15.625 4.313 -2.819
454 2HG MET 60 1HG MET 60 -15.469 5.201 -4.334
455 1HE MET 60 1HE MET 60 -17.103 1.476 -4.799
456 2HE MET 60 2HE MET 60 -17.505 3.184 -4.983
457 3HE MET 60 3HE MET 60 -17.161 2.525 -3.383
458 H ASP 61 H ASP 61 -11.752 8.079 -4.606
459 HA ASP 61 HA ASP 61 -9.720 8.950 -4.091
460 1HB ASP 61 2HB ASP 61 -11.098 8.415 -1.615
461 2HB ASP 61 1HB ASP 61 -9.359 8.258 -1.388
462 H GLY 62 H GLY 62 -9.666 6.180 -1.875
463 1HA GLY 62 2HA GLY 62 -7.534 4.955 -3.473
464 2HA GLY 62 1HA GLY 62 -7.193 5.362 -1.803
465 H LEU 63 H LEU 63 -9.811 4.712 -0.807
466 HA LEU 63 HA LEU 63 -9.416 2.057 -0.120
467 1HB LEU 63 2HB LEU 63 -12.183 3.187 -0.224
468 2HB LEU 63 1HB LEU 63 -11.471 2.117 0.969
469 HG LEU 63 HG LEU 63 -9.945 4.289 1.381
470 1HD1 LEU 63 1HD1 LEU 63 -10.851 6.274 0.847
471 2HD1 LEU 63 2HD1 LEU 63 -12.505 5.701 1.047
472 3HD1 LEU 63 3HD1 LEU 63 -11.620 5.339 -0.432
473 1HD2 LEU 63 1HD2 LEU 63 -11.962 2.955 2.727
474 2HD2 LEU 63 2HD2 LEU 63 -12.451 4.645 2.774
475 3HD2 LEU 63 3HD2 LEU 63 -10.873 4.169 3.392
476 H ALA 64 H ALA 64 -10.767 3.444 -2.971
477 HA ALA 64 HA ALA 64 -12.383 1.398 -3.946
478 1HB ALA 64 1HB ALA 64 -10.662 3.466 -5.273
479 2HB ALA 64 2HB ALA 64 -12.419 3.341 -5.230
480 3HB ALA 64 3HB ALA 64 -11.486 2.241 -6.239
481 H LEU 65 H LEU 65 -8.891 1.750 -3.887
482 HA LEU 65 HA LEU 65 -8.150 -0.356 -5.580
483 1HB LEU 65 2HB LEU 65 -6.854 1.064 -3.291
484 2HB LEU 65 1HB LEU 65 -6.107 -0.397 -3.905
485 HG LEU 65 HG LEU 65 -5.856 0.612 -6.102
486 1HD1 LEU 65 1HD1 LEU 65 -6.959 3.157 -4.948
487 2HD1 LEU 65 2HD1 LEU 65 -7.944 2.023 -5.870
488 3HD1 LEU 65 3HD1 LEU 65 -6.554 2.802 -6.627
489 1HD2 LEU 65 1HD2 LEU 65 -4.094 0.952 -4.445
490 2HD2 LEU 65 2HD2 LEU 65 -4.894 2.422 -3.891
491 3HD2 LEU 65 3HD2 LEU 65 -4.234 2.341 -5.521
492 H LEU 66 H LEU 66 -8.411 -0.300 -2.035
493 HA LEU 66 HA LEU 66 -7.846 -2.883 -1.392
494 1HB LEU 66 2HB LEU 66 -10.128 -1.303 -0.208
495 2HB LEU 66 1HB LEU 66 -9.267 -2.627 0.557
496 HG LEU 66 HG LEU 66 -7.853 -0.094 -0.243
497 1HD1 LEU 66 1HD1 LEU 66 -9.932 -0.028 1.482
498 2HD1 LEU 66 2HD1 LEU 66 -8.525 1.032 1.573
499 3HD1 LEU 66 3HD1 LEU 66 -8.604 -0.417 2.576
500 1HD2 LEU 66 1HD2 LEU 66 -7.268 -2.424 1.543
501 2HD2 LEU 66 2HD2 LEU 66 -6.452 -0.876 1.765
502 3HD2 LEU 66 3HD2 LEU 66 -6.293 -1.747 0.240
503 H LYS 67 H LYS 67 -10.923 -1.639 -2.605
504 HA LYS 67 HA LYS 67 -12.436 -3.978 -2.395
505 1HB LYS 67 2HB LYS 67 -12.582 -1.674 -4.340
506 2HB LYS 67 1HB LYS 67 -13.749 -2.988 -4.342
507 1HG LYS 67 2HG LYS 67 -14.553 -2.419 -2.204
508 2HG LYS 67 1HG LYS 67 -13.186 -1.347 -1.894
509 1HD LYS 67 2HD LYS 67 -14.225 0.378 -2.849
510 2HD LYS 67 1HD LYS 67 -14.597 -0.567 -4.292
511 1HE LYS 67 2HE LYS 67 -16.692 0.031 -3.458
512 2HE LYS 67 1HE LYS 67 -16.463 -1.619 -2.883
513 1HZ LYS 67 1HZ LYS 67 -15.669 -0.647 -0.757
514 2HZ LYS 67 2HZ LYS 67 -17.293 -0.314 -1.095
515 3HZ LYS 67 3HZ LYS 67 -16.120 0.883 -1.325
516 H GLN 68 H GLN 68 -10.421 -2.778 -5.070
517 HA GLN 68 HA GLN 68 -10.879 -4.996 -6.769
518 1HB GLN 68 2HB GLN 68 -8.652 -2.962 -6.693
519 2HB GLN 68 1HB GLN 68 -8.819 -4.172 -7.956
520 1HG GLN 68 2HG GLN 68 -10.785 -1.987 -7.312
521 2HG GLN 68 1HG GLN 68 -9.684 -2.036 -8.690
522 1HE2 GLN 68 1HE2 GLN 68 -10.544 -2.684 -10.510
523 2HE2 GLN 68 2HE2 GLN 68 -11.919 -3.714 -10.688
524 H ILE 69 H ILE 69 -8.642 -4.343 -4.180
525 HA ILE 69 HA ILE 69 -6.756 -6.355 -4.729
526 HB ILE 69 HB ILE 69 -7.505 -5.093 -2.096
527 1HG1 ILE 69 2HG1 ILE 69 -5.083 -4.545 -3.804
528 2HG1 ILE 69 1HG1 ILE 69 -6.584 -3.645 -3.991
529 1HG2 ILE 69 1HG2 ILE 69 -5.374 -5.917 -1.250
530 2HG2 ILE 69 2HG2 ILE 69 -5.069 -6.725 -2.779
531 3HG2 ILE 69 3HG2 ILE 69 -6.397 -7.253 -1.765
532 1HD1 ILE 69 1HD1 ILE 69 -4.469 -3.232 -2.143
533 2HD1 ILE 69 2HD1 ILE 69 -5.935 -3.631 -1.246
534 3HD1 ILE 69 3HD1 ILE 69 -5.936 -2.282 -2.382
535 H LYS 70 H LYS 70 -9.631 -6.320 -2.709
536 HA LYS 70 HA LYS 70 -9.340 -8.929 -1.707
537 1HB LYS 70 2HB LYS 70 -11.664 -8.756 -0.999
538 2HB LYS 70 1HB LYS 70 -10.794 -7.272 -0.641
539 1HG LYS 70 2HG LYS 70 -11.864 -6.100 -2.355
540 2HG LYS 70 1HG LYS 70 -12.439 -7.578 -3.126
541 1HD LYS 70 2HD LYS 70 -13.335 -7.284 -0.365
542 2HD LYS 70 1HD LYS 70 -13.888 -5.982 -1.419
543 1HE LYS 70 2HE LYS 70 -14.712 -7.707 -3.009
544 2HE LYS 70 1HE LYS 70 -14.279 -8.942 -1.829
545 1HZ LYS 70 1HZ LYS 70 -16.192 -6.729 -1.316
546 2HZ LYS 70 2HZ LYS 70 -15.849 -8.029 -0.288
547 3HZ LYS 70 3HZ LYS 70 -16.641 -8.300 -1.757
548 H GLN 71 H GLN 71 -10.644 -7.690 -4.664
549 HA GLN 71 HA GLN 71 -12.050 -10.044 -5.417
550 1HB GLN 71 2HB GLN 71 -11.346 -7.473 -6.676
551 2HB GLN 71 1HB GLN 71 -11.585 -8.820 -7.782
552 1HG GLN 71 2HG GLN 71 -13.805 -8.980 -7.330
553 2HG GLN 71 1HG GLN 71 -13.628 -8.381 -5.682
554 1HE2 GLN 71 1HE2 GLN 71 -12.880 -6.043 -5.579
555 2HE2 GLN 71 2HE2 GLN 71 -13.663 -4.945 -6.659
556 H ARG 72 H ARG 72 -8.835 -8.812 -5.940
557 HA ARG 72 HA ARG 72 -8.129 -11.121 -7.581
558 1HB ARG 72 2HB ARG 72 -6.855 -8.470 -7.054
559 2HB ARG 72 1HB ARG 72 -5.870 -9.802 -7.642
560 1HG ARG 72 2HG ARG 72 -6.624 -9.564 -9.716
561 2HG ARG 72 1HG ARG 72 -8.304 -9.500 -9.181
562 1HD ARG 72 2HD ARG 72 -6.743 -7.099 -8.562
563 2HD ARG 72 1HD ARG 72 -6.925 -7.420 -10.285
564 HE ARG 72 HE ARG 72 -8.895 -6.379 -8.589
565 1HH1 ARG 72 1HH1 ARG 72 -8.538 -8.778 -11.104
566 2HH1 ARG 72 2HH1 ARG 72 -10.185 -8.659 -11.620
567 1HH2 ARG 72 1HH2 ARG 72 -11.053 -6.214 -9.277
568 2HH2 ARG 72 2HH2 ARG 72 -11.616 -7.207 -10.578
569 H HIS 73 H HIS 73 -6.385 -9.347 -5.099
570 HA HIS 73 HA HIS 73 -5.548 -11.915 -3.931
571 1HB HIS 73 2HB HIS 73 -3.471 -10.753 -3.215
572 2HB HIS 73 1HB HIS 73 -3.654 -10.835 -4.966
573 HD1 HIS 73 1HD HIS 73 -2.406 -8.636 -2.659
574 HD2 HIS 73 2HD HIS 73 -5.147 -8.131 -5.711
575 HE1 HIS 73 1HE HIS 73 -2.397 -6.178 -3.149
576 HE2 HIS 73 2HE HIS 73 -4.141 -5.883 -4.939
577 HA PRO 74 HA PRO 74 -7.806 -9.626 -0.610
578 1HB PRO 74 2HB PRO 74 -9.335 -11.669 0.230
579 2HB PRO 74 1HB PRO 74 -9.775 -10.690 -1.174
580 1HG PRO 74 2HG PRO 74 -8.475 -13.384 -1.080
581 2HG PRO 74 1HG PRO 74 -9.774 -12.805 -2.140
582 1HD PRO 74 2HD PRO 74 -7.155 -12.951 -2.907
583 2HD PRO 74 1HD PRO 74 -8.309 -11.783 -3.580
584 H MET 75 H MET 75 -5.219 -10.278 -0.197
585 HA MET 75 HA MET 75 -5.279 -11.364 2.474
586 1HB MET 75 2HB MET 75 -3.427 -12.645 0.473
587 2HB MET 75 1HB MET 75 -3.688 -13.118 2.146
588 1HG MET 75 2HG MET 75 -5.981 -13.770 1.601
589 2HG MET 75 1HG MET 75 -5.706 -13.312 -0.079
590 1HE MET 75 1HE MET 75 -6.021 -17.252 0.395
591 2HE MET 75 2HE MET 75 -6.313 -16.165 -0.961
592 3HE MET 75 3HE MET 75 -6.937 -15.765 0.638
593 H LEU 76 H LEU 76 -3.305 -10.191 -0.169
594 HA LEU 76 HA LEU 76 -0.990 -9.474 1.157
595 1HB LEU 76 2HB LEU 76 -1.903 -9.275 -1.353
596 2HB LEU 76 1HB LEU 76 -2.000 -7.590 -0.880
597 HG LEU 76 HG LEU 76 0.515 -9.221 -0.618
598 1HD1 LEU 76 1HD1 LEU 76 1.035 -8.895 -2.770
599 2HD1 LEU 76 2HD1 LEU 76 0.389 -7.256 -2.771
600 3HD1 LEU 76 3HD1 LEU 76 -0.690 -8.628 -3.004
601 1HD2 LEU 76 1HD2 LEU 76 0.084 -6.247 -0.748
602 2HD2 LEU 76 2HD2 LEU 76 1.589 -7.096 -0.396
603 3HD2 LEU 76 3HD2 LEU 76 0.251 -7.159 0.748
604 HA PRO 77 HA PRO 77 -2.451 -6.358 4.022
605 1HB PRO 77 2HB PRO 77 0.401 -5.616 4.186
606 2HB PRO 77 1HB PRO 77 -0.703 -6.138 5.462
607 1HG PRO 77 2HG PRO 77 1.248 -7.735 4.539
608 2HG PRO 77 1HG PRO 77 -0.319 -8.374 5.061
609 1HD PRO 77 2HD PRO 77 0.725 -7.930 2.305
610 2HD PRO 77 1HD PRO 77 -0.286 -9.247 2.932
611 H VAL 78 H VAL 78 -3.217 -4.394 3.586
612 HA VAL 78 HA VAL 78 -1.822 -2.750 1.575
613 HB VAL 78 HB VAL 78 -4.688 -2.349 2.404
614 1HG1 VAL 78 1HG1 VAL 78 -2.847 -1.154 0.482
615 2HG1 VAL 78 2HG1 VAL 78 -4.345 -0.521 1.168
616 3HG1 VAL 78 3HG1 VAL 78 -4.400 -1.607 -0.223
617 1HG2 VAL 78 1HG2 VAL 78 -5.495 -3.830 0.842
618 2HG2 VAL 78 2HG2 VAL 78 -4.072 -4.700 1.411
619 3HG2 VAL 78 3HG2 VAL 78 -4.011 -3.809 -0.109
620 H ILE 79 H ILE 79 -1.264 -0.687 2.040
621 HA ILE 79 HA ILE 79 -1.935 0.313 4.729
622 HB ILE 79 HB ILE 79 0.669 0.883 3.321
623 1HG1 ILE 79 2HG1 ILE 79 0.978 -0.813 5.626
624 2HG1 ILE 79 1HG1 ILE 79 -0.131 -1.573 4.491
625 1HG2 ILE 79 1HG2 ILE 79 0.774 1.050 6.163
626 2HG2 ILE 79 2HG2 ILE 79 -0.617 1.970 5.593
627 3HG2 ILE 79 3HG2 ILE 79 0.994 2.330 4.970
628 1HD1 ILE 79 1HD1 ILE 79 2.282 -0.461 3.269
629 2HD1 ILE 79 2HD1 ILE 79 1.490 -2.015 3.020
630 3HD1 ILE 79 3HD1 ILE 79 2.562 -1.784 4.401
631 H ILE 80 H ILE 80 -3.247 2.010 4.518
632 HA ILE 80 HA ILE 80 -2.966 3.732 2.158
633 HB ILE 80 HB ILE 80 -5.230 3.834 4.142
634 1HG1 ILE 80 2HG1 ILE 80 -5.027 1.538 3.248
635 2HG1 ILE 80 1HG1 ILE 80 -6.477 2.340 2.656
636 1HG2 ILE 80 1HG2 ILE 80 -5.636 5.650 2.894
637 2HG2 ILE 80 2HG2 ILE 80 -6.200 4.497 1.686
638 3HG2 ILE 80 3HG2 ILE 80 -4.556 5.128 1.604
639 1HD1 ILE 80 1HD1 ILE 80 -4.055 1.478 1.203
640 2HD1 ILE 80 2HD1 ILE 80 -4.854 2.952 0.654
641 3HD1 ILE 80 3HD1 ILE 80 -5.751 1.433 0.720
642 H MET 81 H MET 81 -2.739 5.961 2.307
643 HA MET 81 HA MET 81 -1.335 6.882 4.648
644 1HB MET 81 2HB MET 81 -0.904 8.901 3.379
645 2HB MET 81 1HB MET 81 -0.611 7.494 2.366
646 1HG MET 81 2HG MET 81 -2.016 8.270 0.852
647 2HG MET 81 1HG MET 81 -3.313 8.261 2.039
648 1HE MET 81 1HE MET 81 -0.347 11.588 2.251
649 2HE MET 81 2HE MET 81 -0.455 11.113 0.555
650 3HE MET 81 3HE MET 81 -0.054 9.914 1.783
651 H THR 82 H THR 82 -4.533 7.331 3.293
652 HA THR 82 HA THR 82 -5.309 8.735 5.724
653 HB THR 82 HB THR 82 -6.090 9.893 3.056
654 HG1 THR 82 1HG THR 82 -3.974 10.715 4.753
655 1HG2 THR 82 1HG2 THR 82 -7.326 11.296 4.226
656 2HG2 THR 82 2HG2 THR 82 -5.924 11.772 5.183
657 3HG2 THR 82 3HG2 THR 82 -6.920 10.409 5.694
658 H ALA 83 H ALA 83 -7.481 8.544 6.258
659 HA ALA 83 HA ALA 83 -8.977 6.622 4.602
660 1HB ALA 83 1HB ALA 83 -8.187 6.153 7.088
661 2HB ALA 83 2HB ALA 83 -9.727 5.555 6.469
662 3HB ALA 83 3HB ALA 83 -9.681 7.014 7.457
663 H HIS 84 H HIS 84 -9.197 9.216 3.814
664 HA HIS 84 HA HIS 84 -11.657 10.248 5.029
665 1HB HIS 84 2HB HIS 84 -11.204 12.246 3.550
666 2HB HIS 84 1HB HIS 84 -9.981 11.932 4.775
667 HD1 HIS 84 1HD HIS 84 -8.332 13.325 3.250
668 HD2 HIS 84 2HD HIS 84 -9.667 9.745 1.617
669 HE1 HIS 84 1HE HIS 84 -6.794 12.851 1.319
670 HE2 HIS 84 2HE HIS 84 -7.544 10.618 0.429
671 H SER 85 H SER 85 -12.940 11.504 3.085
672 HA SER 85 HA SER 85 -14.311 11.326 1.288
673 1HB SER 85 2HB SER 85 -12.495 9.067 0.415
674 2HB SER 85 1HB SER 85 -13.722 9.846 -0.582
675 HG SER 85 HG SER 85 -12.465 11.855 -0.004
676 H ASP 86 H ASP 86 -13.505 7.864 1.555
677 HA ASP 86 HA ASP 86 -16.166 7.386 2.687
678 1HB ASP 86 2HB ASP 86 -15.070 6.074 0.195
679 2HB ASP 86 1HB ASP 86 -16.483 5.491 1.070
680 H LEU 87 H LEU 87 -14.541 7.138 4.516
681 HA LEU 87 HA LEU 87 -12.668 5.179 4.814
682 1HB LEU 87 2HB LEU 87 -14.031 6.895 6.494
683 2HB LEU 87 1HB LEU 87 -14.441 5.314 7.125
684 HG LEU 87 HG LEU 87 -11.656 6.409 6.760
685 1HD1 LEU 87 1HD1 LEU 87 -13.438 6.030 9.137
686 2HD1 LEU 87 2HD1 LEU 87 -12.562 7.472 8.630
687 3HD1 LEU 87 3HD1 LEU 87 -11.683 6.095 9.295
688 1HD2 LEU 87 1HD2 LEU 87 -12.647 3.726 7.672
689 2HD2 LEU 87 2HD2 LEU 87 -11.039 4.336 8.064
690 3HD2 LEU 87 3HD2 LEU 87 -11.504 4.096 6.381
691 H ASP 88 H ASP 88 -16.064 4.735 4.454
692 HA ASP 88 HA ASP 88 -16.597 2.356 5.678
693 1HB ASP 88 2HB ASP 88 -17.590 3.597 3.145
694 2HB ASP 88 1HB ASP 88 -18.106 1.966 3.565
695 H ALA 89 H ALA 89 -15.108 2.736 2.449
696 HA ALA 89 HA ALA 89 -14.980 -0.025 1.893
697 1HB ALA 89 1HB ALA 89 -14.760 1.306 0.013
698 2HB ALA 89 2HB ALA 89 -13.110 0.742 0.279
699 3HB ALA 89 3HB ALA 89 -13.582 2.366 0.781
700 H ALA 90 H ALA 90 -13.101 1.959 3.950
701 HA ALA 90 HA ALA 90 -10.677 0.485 3.894
702 1HB ALA 90 1HB ALA 90 -10.748 2.758 4.746
703 2HB ALA 90 2HB ALA 90 -10.153 1.654 5.987
704 3HB ALA 90 3HB ALA 90 -11.809 2.249 6.060
705 H VAL 91 H VAL 91 -13.648 0.232 5.764
706 HA VAL 91 HA VAL 91 -12.719 -1.583 7.693
707 HB VAL 91 HB VAL 91 -15.544 -1.528 6.665
708 1HG1 VAL 91 1HG1 VAL 91 -15.641 -1.789 9.365
709 2HG1 VAL 91 2HG1 VAL 91 -14.132 -2.630 8.997
710 3HG1 VAL 91 3HG1 VAL 91 -15.638 -3.142 8.232
711 1HG2 VAL 91 1HG2 VAL 91 -14.074 0.449 8.364
712 2HG2 VAL 91 2HG2 VAL 91 -15.797 0.173 8.612
713 3HG2 VAL 91 3HG2 VAL 91 -15.211 0.737 7.048
714 H SER 92 H SER 92 -14.154 -2.070 4.506
715 HA SER 92 HA SER 92 -14.365 -4.874 4.640
716 1HB SER 92 2HB SER 92 -14.104 -2.972 2.307
717 2HB SER 92 1HB SER 92 -14.326 -4.708 2.100
718 HG SER 92 HG SER 92 -16.330 -4.568 2.904
719 H ALA 93 H ALA 93 -11.760 -2.707 3.779
720 HA ALA 93 HA ALA 93 -9.993 -4.504 2.602
721 1HB ALA 93 1HB ALA 93 -8.258 -2.910 3.109
722 2HB ALA 93 2HB ALA 93 -9.280 -2.144 4.322
723 3HB ALA 93 3HB ALA 93 -9.716 -2.056 2.617
724 H TYR 94 H TYR 94 -10.570 -3.749 5.971
725 HA TYR 94 HA TYR 94 -8.430 -5.233 7.049
726 1HB TYR 94 2HB TYR 94 -11.098 -4.789 8.395
727 2HB TYR 94 1HB TYR 94 -9.535 -5.049 9.162
728 HD1 TYR 94 1HD TYR 94 -11.813 -2.680 9.032
729 HD2 TYR 94 2HD TYR 94 -7.788 -3.196 7.750
730 HE1 TYR 94 1HE TYR 94 -11.465 -0.248 9.156
731 HE2 TYR 94 2HE TYR 94 -7.430 -0.767 7.872
732 HH TYR 94 HH TYR 94 -8.414 1.185 9.067
733 H GLN 95 H GLN 95 -11.407 -6.156 5.644
734 HA GLN 95 HA GLN 95 -11.665 -8.698 6.932
735 1HB GLN 95 2HB GLN 95 -13.644 -8.827 5.855
736 2HB GLN 95 1HB GLN 95 -13.354 -7.139 5.479
737 1HG GLN 95 2HG GLN 95 -12.096 -8.324 3.401
738 2HG GLN 95 1HG GLN 95 -13.368 -9.498 3.725
739 1HE2 GLN 95 1HE2 GLN 95 -12.747 -7.356 1.619
740 2HE2 GLN 95 2HE2 GLN 95 -14.261 -6.543 1.424
741 H GLN 96 H GLN 96 -10.316 -7.572 3.879
742 HA GLN 96 HA GLN 96 -9.639 -10.198 2.974
743 1HB GLN 96 2HB GLN 96 -8.594 -9.063 1.104
744 2HB GLN 96 1HB GLN 96 -10.170 -8.350 1.428
745 1HG GLN 96 2HG GLN 96 -9.269 -6.350 1.698
746 2HG GLN 96 1HG GLN 96 -8.165 -6.969 2.923
747 1HE2 GLN 96 1HE2 GLN 96 -6.770 -5.302 1.952
748 2HE2 GLN 96 2HE2 GLN 96 -5.808 -5.751 0.592
749 H GLY 97 H GLY 97 -8.166 -7.895 5.043
750 1HA GLY 97 2HA GLY 97 -6.311 -8.881 6.383
751 2HA GLY 97 1HA GLY 97 -5.605 -9.358 4.848
752 H ALA 98 H ALA 98 -7.164 -6.253 5.296
753 HA ALA 98 HA ALA 98 -4.937 -4.821 4.339
754 1HB ALA 98 1HB ALA 98 -7.252 -4.020 4.166
755 2HB ALA 98 2HB ALA 98 -6.187 -2.824 4.900
756 3HB ALA 98 3HB ALA 98 -7.283 -3.767 5.911
757 H PHE 99 H PHE 99 -3.382 -3.587 5.386
758 HA PHE 99 HA PHE 99 -2.616 -4.482 7.968
759 1HB PHE 99 2HB PHE 99 -1.026 -3.763 6.164
760 2HB PHE 99 1HB PHE 99 -1.526 -2.100 6.465
761 HD1 PHE 99 1HD PHE 99 -0.687 -4.955 8.713
762 HD2 PHE 99 2HD PHE 99 0.155 -0.955 7.530
763 HE1 PHE 99 1HE PHE 99 0.982 -4.779 10.512
764 HE2 PHE 99 2HE PHE 99 1.825 -0.774 9.325
765 HZ PHE 99 HZ PHE 99 2.242 -2.687 10.819
766 H ASP 100 H ASP 100 -3.645 -1.278 6.767
767 HA ASP 100 HA ASP 100 -5.401 -0.602 8.751
768 1HB ASP 100 2HB ASP 100 -2.786 -0.719 9.852
769 2HB ASP 100 1HB ASP 100 -3.214 0.983 9.748
770 H TYR 101 H TYR 101 -4.843 2.039 9.314
771 HA TYR 101 HA TYR 101 -4.472 3.281 6.679
772 1HB TYR 101 2HB TYR 101 -6.835 3.341 8.442
773 2HB TYR 101 1HB TYR 101 -6.325 4.914 7.841
774 HD1 TYR 101 1HD TYR 101 -7.314 1.496 6.753
775 HD2 TYR 101 2HD TYR 101 -6.832 5.585 5.657
776 HE1 TYR 101 1HE TYR 101 -8.473 1.065 4.624
777 HE2 TYR 101 2HE TYR 101 -7.988 5.158 3.532
778 HH TYR 101 HH TYR 101 -9.702 2.269 2.917
779 H LEU 102 H LEU 102 -3.693 5.428 6.718
780 HA LEU 102 HA LEU 102 -2.275 6.092 9.193
781 1HB LEU 102 2HB LEU 102 -1.364 5.846 6.645
782 2HB LEU 102 1HB LEU 102 -1.676 7.563 6.714
783 HG LEU 102 HG LEU 102 -0.115 7.857 8.508
784 1HD1 LEU 102 1HD1 LEU 102 0.876 6.207 9.743
785 2HD1 LEU 102 2HD1 LEU 102 0.706 4.999 8.473
786 3HD1 LEU 102 3HD1 LEU 102 -0.690 5.463 9.436
787 1HD2 LEU 102 1HD2 LEU 102 0.600 6.613 5.983
788 2HD2 LEU 102 2HD2 LEU 102 1.835 6.399 7.225
789 3HD2 LEU 102 3HD2 LEU 102 1.290 8.017 6.793
790 HA PRO 103 HA PRO 103 -4.998 9.583 9.656
791 1HB PRO 103 2HB PRO 103 -3.820 10.747 11.769
792 2HB PRO 103 1HB PRO 103 -4.655 9.200 11.918
793 1HG PRO 103 2HG PRO 103 -1.726 9.754 11.687
794 2HG PRO 103 1HG PRO 103 -2.569 8.612 12.747
795 1HD PRO 103 2HD PRO 103 -1.342 7.906 10.394
796 2HD PRO 103 1HD PRO 103 -2.686 7.007 11.124
797 H LYS 104 H LYS 104 -3.964 12.072 10.684
798 HA LYS 104 HA LYS 104 -3.500 13.546 8.462
799 1HB LYS 104 2HB LYS 104 -2.933 13.915 11.328
800 2HB LYS 104 1HB LYS 104 -2.005 14.950 10.253
801 1HG LYS 104 2HG LYS 104 -4.180 15.619 9.186
802 2HG LYS 104 1HG LYS 104 -4.995 14.759 10.495
803 1HD LYS 104 2HD LYS 104 -4.920 16.983 11.221
804 2HD LYS 104 1HD LYS 104 -3.588 16.200 12.073
805 1HE LYS 104 2HE LYS 104 -2.248 17.003 9.929
806 2HE LYS 104 1HE LYS 104 -3.536 18.208 9.882
807 1HZ LYS 104 1HZ LYS 104 -1.846 17.669 12.263
808 2HZ LYS 104 2HZ LYS 104 -2.973 18.917 12.078
809 3HZ LYS 104 3HZ LYS 104 -1.557 18.914 11.154
810 HA PRO 105 HA PRO 105 1.372 13.241 9.034
811 1HB PRO 105 2HB PRO 105 2.105 10.846 10.234
812 2HB PRO 105 1HB PRO 105 2.104 12.424 11.026
813 1HG PRO 105 2HG PRO 105 0.063 10.251 11.120
814 2HG PRO 105 1HG PRO 105 0.616 11.330 12.414
815 1HD PRO 105 2HD PRO 105 -1.728 11.716 11.182
816 2HD PRO 105 1HD PRO 105 -0.721 13.085 11.691
817 H PHE 106 H PHE 106 2.875 11.937 7.774
818 HA PHE 106 HA PHE 106 2.160 9.479 6.618
819 1HB PHE 106 2HB PHE 106 0.466 10.736 5.423
820 2HB PHE 106 1HB PHE 106 1.659 11.917 4.895
821 HD1 PHE 106 1HD PHE 106 2.241 11.758 2.689
822 HD2 PHE 106 2HD PHE 106 1.300 8.199 4.817
823 HE1 PHE 106 1HE PHE 106 2.649 10.440 0.652
824 HE2 PHE 106 2HE PHE 106 1.704 6.871 2.787
825 HZ PHE 106 HZ PHE 106 2.381 7.991 0.702
826 H ASP 107 H ASP 107 3.500 11.669 4.309
827 HA ASP 107 HA ASP 107 5.544 11.618 3.298
828 1HB ASP 107 2HB ASP 107 7.338 12.468 4.687
829 2HB ASP 107 1HB ASP 107 5.835 13.277 5.113
830 H ILE 108 H ILE 108 7.975 10.709 3.685
831 HA ILE 108 HA ILE 108 7.682 7.904 3.516
832 HB ILE 108 HB ILE 108 9.730 9.793 2.938
833 1HG1 ILE 108 2HG1 ILE 108 10.463 8.028 1.409
834 2HG1 ILE 108 1HG1 ILE 108 9.449 6.868 2.257
835 1HG2 ILE 108 1HG2 ILE 108 10.974 9.104 4.837
836 2HG2 ILE 108 2HG2 ILE 108 11.681 8.282 3.445
837 3HG2 ILE 108 3HG2 ILE 108 10.609 7.406 4.535
838 1HD1 ILE 108 1HD1 ILE 108 8.580 7.837 0.065
839 2HD1 ILE 108 2HD1 ILE 108 8.284 9.315 0.983
840 3HD1 ILE 108 3HD1 ILE 108 7.481 7.813 1.443
841 H ASP 109 H ASP 109 8.925 10.006 6.008
842 HA ASP 109 HA ASP 109 10.050 8.183 7.736
843 1HB ASP 109 2HB ASP 109 9.956 10.709 7.987
844 2HB ASP 109 1HB ASP 109 8.359 10.488 8.696
845 H GLU 110 H GLU 110 6.652 9.305 7.928
846 HA GLU 110 HA GLU 110 6.000 7.246 9.786
847 1HB GLU 110 2HB GLU 110 4.155 9.111 8.292
848 2HB GLU 110 1HB GLU 110 3.710 8.099 9.656
849 1HG GLU 110 2HG GLU 110 5.800 10.253 9.788
850 2HG GLU 110 1HG GLU 110 4.103 10.494 10.205
851 H ALA 111 H ALA 111 5.733 7.643 6.339
852 HA ALA 111 HA ALA 111 3.889 5.528 5.900
853 1HB ALA 111 1HB ALA 111 4.589 5.657 3.554
854 2HB ALA 111 2HB ALA 111 5.929 6.708 4.013
855 3HB ALA 111 3HB ALA 111 4.267 7.258 4.218
856 H VAL 112 H VAL 112 7.402 5.683 5.278
857 HA VAL 112 HA VAL 112 7.767 2.951 4.830
858 HB VAL 112 HB VAL 112 9.766 4.869 6.027
859 1HG1 VAL 112 1HG1 VAL 112 11.254 3.212 5.969
860 2HG1 VAL 112 2HG1 VAL 112 10.825 2.804 4.308
861 3HG1 VAL 112 3HG1 VAL 112 9.915 2.108 5.651
862 1HG2 VAL 112 1HG2 VAL 112 8.704 4.529 3.302
863 2HG2 VAL 112 2HG2 VAL 112 10.460 4.642 3.424
864 3HG2 VAL 112 3HG2 VAL 112 9.445 5.935 4.062
865 H ALA 113 H ALA 113 7.519 4.800 7.738
866 HA ALA 113 HA ALA 113 8.573 2.937 9.566
867 1HB ALA 113 1HB ALA 113 8.188 5.256 10.164
868 2HB ALA 113 2HB ALA 113 7.287 4.194 11.245
869 3HB ALA 113 3HB ALA 113 6.451 5.041 9.939
870 H LEU 114 H LEU 114 5.295 3.566 8.412
871 HA LEU 114 HA LEU 114 4.114 1.482 9.934
872 1HB LEU 114 2HB LEU 114 2.878 3.486 9.248
873 2HB LEU 114 1HB LEU 114 3.010 2.984 7.569
874 HG LEU 114 HG LEU 114 1.741 0.890 8.207
875 1HD1 LEU 114 1HD1 LEU 114 1.530 2.419 10.776
876 2HD1 LEU 114 2HD1 LEU 114 1.963 0.730 10.524
877 3HD1 LEU 114 3HD1 LEU 114 0.295 1.257 10.290
878 1HD2 LEU 114 1HD2 LEU 114 0.853 3.235 7.309
879 2HD2 LEU 114 2HD2 LEU 114 -0.026 3.179 8.837
880 3HD2 LEU 114 3HD2 LEU 114 -0.222 1.883 7.661
881 H VAL 115 H VAL 115 5.663 1.601 6.850
882 HA VAL 115 HA VAL 115 4.357 -0.765 5.878
883 HB VAL 115 HB VAL 115 5.304 1.056 4.383
884 1HG1 VAL 115 1HG1 VAL 115 7.883 -0.433 4.844
885 2HG1 VAL 115 2HG1 VAL 115 7.515 1.168 5.474
886 3HG1 VAL 115 3HG1 VAL 115 7.615 0.914 3.737
887 1HG2 VAL 115 1HG2 VAL 115 5.046 -0.425 2.741
888 2HG2 VAL 115 2HG2 VAL 115 4.885 -1.652 3.997
889 3HG2 VAL 115 3HG2 VAL 115 6.455 -1.353 3.253
890 H GLU 116 H GLU 116 7.575 -0.017 7.162
891 HA GLU 116 HA GLU 116 8.617 -2.622 6.918
892 1HB GLU 116 2HB GLU 116 9.350 -0.391 8.822
893 2HB GLU 116 1HB GLU 116 10.293 -1.859 8.600
894 1HG GLU 116 2HG GLU 116 10.160 -1.074 6.061
895 2HG GLU 116 1HG GLU 116 10.000 0.496 6.842
896 H ARG 117 H ARG 117 6.996 -0.984 9.633
897 HA ARG 117 HA ARG 117 7.260 -3.047 11.501
898 1HB ARG 117 2HB ARG 117 5.415 -2.005 12.704
899 2HB ARG 117 1HB ARG 117 6.524 -0.781 12.105
900 1HG ARG 117 2HG ARG 117 4.984 0.147 10.777
901 2HG ARG 117 1HG ARG 117 4.300 -1.406 10.297
902 1HD ARG 117 2HD ARG 117 2.561 -0.897 11.599
903 2HD ARG 117 1HD ARG 117 3.628 -1.185 12.969
904 HE ARG 117 HE ARG 117 3.318 1.481 11.757
905 1HH1 ARG 117 1HH1 ARG 117 3.357 -0.606 14.564
906 2HH1 ARG 117 2HH1 ARG 117 3.206 0.703 15.684
907 1HH2 ARG 117 1HH2 ARG 117 3.092 3.183 13.222
908 2HH2 ARG 117 2HH2 ARG 117 3.051 2.857 14.922
909 H ALA 118 H ALA 118 5.151 -2.690 8.793
910 HA ALA 118 HA ALA 118 3.175 -4.559 9.572
911 1HB ALA 118 1HB ALA 118 3.766 -2.949 7.262
912 2HB ALA 118 2HB ALA 118 2.223 -3.609 7.803
913 3HB ALA 118 3HB ALA 118 3.285 -4.577 6.778
914 H ILE 119 H ILE 119 6.073 -4.828 7.535
915 HA ILE 119 HA ILE 119 5.748 -7.619 7.082
916 HB ILE 119 HB ILE 119 8.278 -6.013 6.791
917 1HG1 ILE 119 2HG1 ILE 119 6.577 -6.492 4.421
918 2HG1 ILE 119 1HG1 ILE 119 5.968 -5.308 5.574
919 1HG2 ILE 119 1HG2 ILE 119 7.311 -8.551 5.493
920 2HG2 ILE 119 2HG2 ILE 119 8.666 -8.367 6.611
921 3HG2 ILE 119 3HG2 ILE 119 8.748 -7.656 4.998
922 1HD1 ILE 119 1HD1 ILE 119 7.658 -3.846 5.174
923 2HD1 ILE 119 2HD1 ILE 119 7.547 -4.622 3.592
924 3HD1 ILE 119 3HD1 ILE 119 8.798 -5.117 4.732
925 H SER 120 H SER 120 7.382 -5.644 9.416
926 HA SER 120 HA SER 120 9.071 -7.643 10.500
927 1HB SER 120 2HB SER 120 9.249 -5.082 10.748
928 2HB SER 120 1HB SER 120 8.065 -5.260 12.043
929 HG SER 120 HG SER 120 9.915 -7.073 12.485
930 H HIS 121 H HIS 121 5.855 -6.440 11.360
931 HA HIS 121 HA HIS 121 5.565 -7.970 13.718
932 1HB HIS 121 2HB HIS 121 3.766 -6.414 11.944
933 2HB HIS 121 1HB HIS 121 3.006 -7.621 12.975
934 HD1 HIS 121 1HD HIS 121 5.861 -5.250 13.817
935 HD2 HIS 121 2HD HIS 121 1.977 -6.144 14.993
936 HE1 HIS 121 1HE HIS 121 5.422 -3.814 15.835
937 HE2 HIS 121 2HE HIS 121 3.101 -4.443 16.584
938 H TYR 122 H TYR 122 5.313 -8.762 10.385
939 HA TYR 122 HA TYR 122 3.646 -11.048 10.684
940 1HB TYR 122 2HB TYR 122 5.222 -9.811 8.499
941 2HB TYR 122 1HB TYR 122 4.887 -11.535 8.350
942 HD1 TYR 122 1HD TYR 122 2.278 -12.030 9.137
943 HD2 TYR 122 2HD TYR 122 3.757 -8.484 7.312
944 HE1 TYR 122 1HE TYR 122 0.018 -11.520 8.318
945 HE2 TYR 122 2HE TYR 122 1.498 -7.961 6.487
946 HH TYR 122 HH TYR 122 -1.022 -10.206 6.486
947 H GLN 123 H GLN 123 7.146 -10.590 10.281
948 HA GLN 123 HA GLN 123 7.715 -13.370 10.567
949 1HB GLN 123 2HB GLN 123 10.112 -12.512 10.833
950 2HB GLN 123 1HB GLN 123 9.314 -12.219 9.297
951 1HG GLN 123 2HG GLN 123 9.872 -10.090 9.512
952 2HG GLN 123 1HG GLN 123 8.717 -9.983 10.835
953 1HE2 GLN 123 1HE2 GLN 123 11.822 -9.393 9.981
954 2HE2 GLN 123 2HE2 GLN 123 12.565 -9.402 11.540
955 H GLU 124 H GLU 124 8.287 -10.556 12.594
956 HA GLU 124 HA GLU 124 8.524 -10.285 14.840
957 1HB GLU 124 2HB GLU 124 6.335 -11.862 14.529
958 2HB GLU 124 1HB GLU 124 7.335 -12.898 15.537
959 1HG GLU 124 2HG GLU 124 7.406 -11.302 17.275
960 2HG GLU 124 1HG GLU 124 6.740 -10.040 16.239
Start of MODEL 20
1 1H MET 1 1HT MET 1 17.172 -14.299 6.978
2 2H MET 1 2HT MET 1 17.121 -15.106 5.464
3 3H MET 1 3HT MET 1 15.698 -14.967 6.413
4 HA MET 1 HA MET 1 15.721 -12.610 6.158
5 1HB MET 1 2HB MET 1 17.352 -11.634 4.543
6 2HB MET 1 1HB MET 1 18.101 -12.261 6.005
7 1HG MET 1 2HG MET 1 19.319 -13.743 4.882
8 2HG MET 1 1HG MET 1 17.958 -14.238 3.877
9 1HE MET 1 1HE MET 1 20.487 -13.898 1.422
10 2HE MET 1 2HE MET 1 18.865 -13.610 0.789
11 3HE MET 1 3HE MET 1 19.107 -14.750 2.113
12 H GLN 2 H GLN 2 13.745 -13.163 5.267
13 HA GLN 2 HA GLN 2 13.335 -14.571 2.891
14 1HB GLN 2 2HB GLN 2 11.725 -13.416 4.819
15 2HB GLN 2 1HB GLN 2 11.342 -12.491 3.373
16 1HG GLN 2 2HG GLN 2 10.685 -14.445 2.195
17 2HG GLN 2 1HG GLN 2 11.309 -15.493 3.466
18 1HE2 GLN 2 1HE2 GLN 2 8.667 -13.633 2.361
19 2HE2 GLN 2 2HE2 GLN 2 7.588 -13.965 3.670
20 H ARG 3 H ARG 3 12.109 -13.478 0.974
21 HA ARG 3 HA ARG 3 13.970 -11.860 -0.380
22 1HB ARG 3 2HB ARG 3 12.332 -13.444 -1.441
23 2HB ARG 3 1HB ARG 3 11.075 -12.261 -1.113
24 1HG ARG 3 2HG ARG 3 11.546 -11.605 -3.212
25 2HG ARG 3 1HG ARG 3 12.829 -10.699 -2.405
26 1HD ARG 3 2HD ARG 3 14.444 -11.951 -3.327
27 2HD ARG 3 1HD ARG 3 13.573 -13.453 -3.029
28 HE ARG 3 HE ARG 3 12.408 -11.976 -5.166
29 1HH1 ARG 3 1HH1 ARG 3 15.074 -14.086 -4.369
30 2HH1 ARG 3 2HH1 ARG 3 15.253 -14.676 -5.987
31 1HH2 ARG 3 1HH2 ARG 3 12.646 -12.753 -7.294
32 2HH2 ARG 3 2HH2 ARG 3 13.876 -13.919 -7.648
33 H GLY 4 H GLY 4 10.881 -11.160 1.123
34 1HA GLY 4 2HA GLY 4 9.940 -9.195 1.844
35 2HA GLY 4 1HA GLY 4 11.574 -8.549 1.883
36 H ILE 5 H ILE 5 8.690 -8.951 -0.043
37 HA ILE 5 HA ILE 5 9.746 -7.003 -1.985
38 HB ILE 5 HB ILE 5 7.362 -8.810 -2.373
39 1HG1 ILE 5 2HG1 ILE 5 9.207 -9.878 -4.008
40 2HG1 ILE 5 1HG1 ILE 5 10.270 -9.313 -2.723
41 1HG2 ILE 5 1HG2 ILE 5 8.610 -8.106 -4.801
42 2HG2 ILE 5 2HG2 ILE 5 8.458 -6.627 -3.853
43 3HG2 ILE 5 3HG2 ILE 5 7.030 -7.602 -4.201
44 1HD1 ILE 5 1HD1 ILE 5 9.054 -11.721 -2.761
45 2HD1 ILE 5 2HD1 ILE 5 7.901 -10.783 -1.812
46 3HD1 ILE 5 3HD1 ILE 5 9.584 -10.896 -1.296
47 H VAL 6 H VAL 6 9.085 -4.985 -1.556
48 HA VAL 6 HA VAL 6 6.361 -4.591 -0.500
49 HB VAL 6 HB VAL 6 7.961 -3.574 0.994
50 1HG1 VAL 6 1HG1 VAL 6 9.206 -2.630 -1.527
51 2HG1 VAL 6 2HG1 VAL 6 9.953 -3.283 -0.072
52 3HG1 VAL 6 3HG1 VAL 6 9.357 -1.625 -0.091
53 1HG2 VAL 6 1HG2 VAL 6 5.886 -2.318 0.476
54 2HG2 VAL 6 2HG2 VAL 6 6.784 -1.401 -0.739
55 3HG2 VAL 6 3HG2 VAL 6 7.224 -1.281 0.965
56 H TRP 7 H TRP 7 4.878 -3.707 -1.811
57 HA TRP 7 HA TRP 7 5.848 -2.330 -4.226
58 1HB TRP 7 2HB TRP 7 3.516 -4.160 -3.802
59 2HB TRP 7 1HB TRP 7 3.462 -2.959 -5.088
60 HD1 TRP 7 HD1 TRP 7 6.940 -4.046 -4.731
61 HE1 TRP 7 1HE TRP 7 7.568 -5.770 -6.526
62 HE3 TRP 7 3HE TRP 7 2.245 -5.238 -6.387
63 HZ2 TRP 7 2HZ TRP 7 6.253 -7.434 -8.385
64 HZ3 TRP 7 3HZ TRP 7 2.025 -6.912 -8.176
65 HH2 TRP 7 HH2 TRP 7 3.987 -7.986 -9.153
66 H VAL 8 H VAL 8 5.014 -0.368 -4.751
67 HA VAL 8 HA VAL 8 3.132 0.810 -2.809
68 HB VAL 8 HB VAL 8 5.070 2.574 -4.220
69 1HG1 VAL 8 1HG1 VAL 8 3.173 3.131 -2.484
70 2HG1 VAL 8 2HG1 VAL 8 4.706 4.012 -2.485
71 3HG1 VAL 8 3HG1 VAL 8 4.434 2.715 -1.316
72 1HG2 VAL 8 1HG2 VAL 8 5.965 0.358 -2.633
73 2HG2 VAL 8 2HG2 VAL 8 6.336 1.865 -1.809
74 3HG2 VAL 8 3HG2 VAL 8 6.912 1.598 -3.451
75 H VAL 9 H VAL 9 1.625 2.313 -3.596
76 HA VAL 9 HA VAL 9 1.538 2.614 -6.514
77 HB VAL 9 HB VAL 9 -1.154 2.542 -5.486
78 1HG1 VAL 9 1HG1 VAL 9 0.411 0.973 -7.509
79 2HG1 VAL 9 2HG1 VAL 9 -0.677 2.320 -7.805
80 3HG1 VAL 9 3HG1 VAL 9 -1.319 0.765 -7.272
81 1HG2 VAL 9 1HG2 VAL 9 0.626 0.280 -4.700
82 2HG2 VAL 9 2HG2 VAL 9 -1.006 -0.080 -5.259
83 3HG2 VAL 9 3HG2 VAL 9 -0.765 0.963 -3.862
84 H ASP 10 H ASP 10 1.771 4.669 -6.929
85 HA ASP 10 HA ASP 10 0.019 6.650 -5.799
86 1HB ASP 10 2HB ASP 10 2.222 6.183 -4.292
87 2HB ASP 10 1HB ASP 10 2.851 7.402 -5.395
88 H ASP 11 H ASP 11 1.671 8.888 -6.431
89 HA ASP 11 HA ASP 11 1.157 9.095 -9.195
90 1HB ASP 11 2HB ASP 11 2.205 10.828 -7.080
91 2HB ASP 11 1HB ASP 11 2.870 11.172 -8.675
92 H ASP 12 H ASP 12 3.614 7.415 -7.761
93 HA ASP 12 HA ASP 12 5.501 6.449 -8.596
94 1HB ASP 12 2HB ASP 12 3.957 7.019 -10.860
95 2HB ASP 12 1HB ASP 12 5.559 7.637 -11.246
96 H SER 13 H SER 13 7.347 7.547 -10.512
97 HA SER 13 HA SER 13 9.328 8.668 -10.238
98 1HB SER 13 2HB SER 13 7.681 9.932 -11.703
99 2HB SER 13 1HB SER 13 7.515 11.053 -10.355
100 HG SER 13 HG SER 13 9.130 11.839 -11.654
101 H SER 14 H SER 14 7.549 11.240 -8.672
102 HA SER 14 HA SER 14 9.461 11.792 -6.762
103 1HB SER 14 2HB SER 14 6.535 12.380 -6.975
104 2HB SER 14 1HB SER 14 7.378 12.767 -5.476
105 HG SER 14 HG SER 14 7.301 14.453 -7.160
106 H ILE 15 H ILE 15 6.348 10.165 -6.088
107 HA ILE 15 HA ILE 15 7.062 9.323 -3.507
108 HB ILE 15 HB ILE 15 5.095 7.899 -5.295
109 1HG1 ILE 15 2HG1 ILE 15 4.607 10.303 -5.344
110 2HG1 ILE 15 1HG1 ILE 15 3.379 9.434 -4.432
111 1HG2 ILE 15 1HG2 ILE 15 4.775 8.303 -2.356
112 2HG2 ILE 15 2HG2 ILE 15 5.879 7.060 -2.945
113 3HG2 ILE 15 3HG2 ILE 15 4.174 7.007 -3.390
114 1HD1 ILE 15 1HD1 ILE 15 5.604 10.470 -2.826
115 2HD1 ILE 15 2HD1 ILE 15 3.865 10.499 -2.526
116 3HD1 ILE 15 3HD1 ILE 15 4.596 11.693 -3.599
117 H ARG 16 H ARG 16 7.752 8.029 -6.629
118 HA ARG 16 HA ARG 16 8.359 5.376 -5.814
119 1HB ARG 16 2HB ARG 16 7.790 5.943 -8.135
120 2HB ARG 16 1HB ARG 16 9.262 6.899 -8.262
121 1HG ARG 16 2HG ARG 16 10.542 4.791 -7.770
122 2HG ARG 16 1HG ARG 16 9.024 3.918 -7.953
123 1HD ARG 16 2HD ARG 16 8.803 4.642 -10.228
124 2HD ARG 16 1HD ARG 16 10.189 5.720 -10.063
125 HE ARG 16 HE ARG 16 10.393 2.778 -9.933
126 1HH1 ARG 16 1HH1 ARG 16 11.629 5.881 -10.978
127 2HH1 ARG 16 2HH1 ARG 16 13.033 5.202 -11.724
128 1HH2 ARG 16 1HH2 ARG 16 12.241 1.899 -10.912
129 2HH2 ARG 16 2HH2 ARG 16 13.380 2.947 -11.689
130 H TRP 17 H TRP 17 10.492 8.099 -6.720
131 HA TRP 17 HA TRP 17 12.897 6.833 -6.110
132 1HB TRP 17 2HB TRP 17 12.617 9.000 -7.363
133 2HB TRP 17 1HB TRP 17 12.396 9.791 -5.805
134 HD1 TRP 17 HD1 TRP 17 15.086 7.716 -7.668
135 HE1 TRP 17 1HE TRP 17 17.397 8.467 -6.821
136 HE3 TRP 17 3HE TRP 17 13.596 10.999 -4.041
137 HZ2 TRP 17 2HZ TRP 17 18.450 10.220 -4.874
138 HZ3 TRP 17 3HZ TRP 17 15.320 12.173 -2.731
139 HH2 TRP 17 HH2 TRP 17 17.694 11.789 -3.141
140 H VAL 18 H VAL 18 10.784 8.768 -4.026
141 HA VAL 18 HA VAL 18 12.542 8.872 -1.841
142 HB VAL 18 HB VAL 18 9.579 8.878 -1.440
143 1HG1 VAL 18 1HG1 VAL 18 11.686 9.287 0.250
144 2HG1 VAL 18 2HG1 VAL 18 10.043 9.876 0.512
145 3HG1 VAL 18 3HG1 VAL 18 11.256 10.933 -0.211
146 1HG2 VAL 18 1HG2 VAL 18 10.941 10.536 -3.311
147 2HG2 VAL 18 2HG2 VAL 18 10.469 11.528 -1.933
148 3HG2 VAL 18 3HG2 VAL 18 9.252 10.598 -2.806
149 H LEU 19 H LEU 19 9.848 6.684 -2.463
150 HA LEU 19 HA LEU 19 10.422 5.176 -0.100
151 1HB LEU 19 2HB LEU 19 8.119 5.609 -1.191
152 2HB LEU 19 1HB LEU 19 8.539 4.267 -2.235
153 HG LEU 19 HG LEU 19 8.594 2.737 -0.404
154 1HD1 LEU 19 1HD1 LEU 19 9.510 3.593 1.462
155 2HD1 LEU 19 2HD1 LEU 19 7.830 3.928 1.888
156 3HD1 LEU 19 3HD1 LEU 19 8.831 5.197 1.185
157 1HD2 LEU 19 1HD2 LEU 19 6.361 2.620 0.006
158 2HD2 LEU 19 2HD2 LEU 19 6.337 3.825 -1.282
159 3HD2 LEU 19 3HD2 LEU 19 6.228 4.334 0.402
160 H GLU 20 H GLU 20 11.287 4.903 -3.446
161 HA GLU 20 HA GLU 20 11.790 2.128 -3.464
162 1HB GLU 20 2HB GLU 20 12.921 2.435 -5.515
163 2HB GLU 20 1HB GLU 20 11.597 3.581 -5.498
164 1HG GLU 20 2HG GLU 20 13.165 5.365 -4.926
165 2HG GLU 20 1HG GLU 20 14.484 4.200 -4.954
166 H ARG 21 H ARG 21 14.089 4.806 -3.188
167 HA ARG 21 HA ARG 21 16.296 3.159 -2.583
168 1HB ARG 21 2HB ARG 21 15.863 6.107 -2.090
169 2HB ARG 21 1HB ARG 21 17.407 5.286 -1.897
170 1HG ARG 21 2HG ARG 21 16.242 4.758 -4.492
171 2HG ARG 21 1HG ARG 21 16.427 6.487 -4.197
172 1HD ARG 21 2HD ARG 21 18.683 6.384 -4.222
173 2HD ARG 21 1HD ARG 21 18.723 4.807 -3.438
174 HE ARG 21 HE ARG 21 18.170 5.220 -6.306
175 1HH1 ARG 21 1HH1 ARG 21 19.498 3.294 -3.703
176 2HH1 ARG 21 2HH1 ARG 21 20.101 2.068 -4.764
177 1HH2 ARG 21 1HH2 ARG 21 18.962 3.602 -7.685
178 2HH2 ARG 21 2HH2 ARG 21 19.797 2.240 -7.016
179 H ALA 22 H ALA 22 14.234 5.160 -0.468
180 HA ALA 22 HA ALA 22 15.562 4.617 1.911
181 1HB ALA 22 1HB ALA 22 13.661 6.304 1.383
182 2HB ALA 22 2HB ALA 22 13.818 5.644 3.011
183 3HB ALA 22 3HB ALA 22 12.607 4.992 1.908
184 H LEU 23 H LEU 23 12.984 2.800 0.359
185 HA LEU 23 HA LEU 23 12.818 0.932 2.541
186 1HB LEU 23 2HB LEU 23 11.201 1.532 0.342
187 2HB LEU 23 1HB LEU 23 11.739 -0.115 0.079
188 HG LEU 23 HG LEU 23 10.619 0.701 2.735
189 1HD1 LEU 23 1HD1 LEU 23 8.766 1.325 1.588
190 2HD1 LEU 23 2HD1 LEU 23 8.479 -0.413 1.653
191 3HD1 LEU 23 3HD1 LEU 23 9.148 0.315 0.193
192 1HD2 LEU 23 1HD2 LEU 23 9.833 -1.805 2.373
193 2HD2 LEU 23 2HD2 LEU 23 11.458 -1.402 2.968
194 3HD2 LEU 23 3HD2 LEU 23 11.209 -1.812 1.265
195 H ALA 24 H ALA 24 14.670 1.277 -0.332
196 HA ALA 24 HA ALA 24 15.497 -1.418 -0.618
197 1HB ALA 24 1HB ALA 24 17.096 1.027 -1.376
198 2HB ALA 24 2HB ALA 24 15.761 0.407 -2.347
199 3HB ALA 24 3HB ALA 24 17.191 -0.589 -2.080
200 H GLY 25 H GLY 25 16.495 1.324 1.323
201 1HA GLY 25 2HA GLY 25 18.922 0.214 2.304
202 2HA GLY 25 1HA GLY 25 17.987 1.499 3.064
203 H ALA 26 H ALA 26 15.580 -0.311 3.000
204 HA ALA 26 HA ALA 26 15.979 -1.475 5.578
205 1HB ALA 26 1HB ALA 26 13.574 -2.259 5.216
206 2HB ALA 26 2HB ALA 26 13.605 -1.328 3.717
207 3HB ALA 26 3HB ALA 26 13.853 -0.520 5.267
208 H GLY 27 H GLY 27 16.418 -2.511 2.370
209 1HA GLY 27 2HA GLY 27 17.510 -4.529 1.833
210 2HA GLY 27 1HA GLY 27 16.901 -5.229 3.319
211 H LEU 28 H LEU 28 14.718 -3.534 1.146
212 HA LEU 28 HA LEU 28 13.760 -6.119 0.189
213 1HB LEU 28 2HB LEU 28 11.720 -4.072 0.810
214 2HB LEU 28 1HB LEU 28 11.619 -5.819 0.904
215 HG LEU 28 HG LEU 28 13.355 -5.399 2.879
216 1HD1 LEU 28 1HD1 LEU 28 13.592 -3.305 3.422
217 2HD1 LEU 28 2HD1 LEU 28 11.888 -3.259 3.878
218 3HD1 LEU 28 3HD1 LEU 28 12.385 -2.817 2.241
219 1HD2 LEU 28 1HD2 LEU 28 11.702 -6.203 4.162
220 2HD2 LEU 28 2HD2 LEU 28 10.758 -6.221 2.672
221 3HD2 LEU 28 3HD2 LEU 28 10.635 -4.851 3.777
222 H THR 29 H THR 29 12.087 -5.880 -1.557
223 HA THR 29 HA THR 29 13.142 -4.071 -3.576
224 HB THR 29 HB THR 29 11.203 -6.384 -3.687
225 HG1 THR 29 1HG THR 29 12.885 -7.491 -4.286
226 1HG2 THR 29 1HG2 THR 29 11.620 -4.302 -5.652
227 2HG2 THR 29 2HG2 THR 29 10.424 -5.598 -5.605
228 3HG2 THR 29 3HG2 THR 29 12.031 -5.902 -6.270
229 H CYS 30 H CYS 30 12.306 -2.076 -3.593
230 HA CYS 30 HA CYS 30 9.428 -1.763 -3.096
231 1HB CYS 30 2HB CYS 30 10.814 -0.506 -1.551
232 2HB CYS 30 1HB CYS 30 11.652 0.265 -2.891
233 HG CYS 30 HG CYS 30 9.589 1.695 -3.357
234 H THR 31 H THR 31 8.278 -1.710 -4.867
235 HA THR 31 HA THR 31 9.284 -0.152 -7.156
236 HB THR 31 HB THR 31 9.000 -2.733 -7.429
237 HG1 THR 31 1HG THR 31 7.975 -0.737 -9.132
238 1HG2 THR 31 1HG2 THR 31 6.201 -2.209 -8.166
239 2HG2 THR 31 2HG2 THR 31 6.539 -2.408 -6.444
240 3HG2 THR 31 3HG2 THR 31 6.977 -3.685 -7.586
241 H THR 32 H THR 32 7.641 1.066 -8.319
242 HA THR 32 HA THR 32 5.215 1.487 -6.724
243 HB THR 32 HB THR 32 5.340 3.858 -7.108
244 HG1 THR 32 1HG THR 32 6.363 4.438 -8.839
245 1HG2 THR 32 1HG2 THR 32 6.793 4.258 -5.471
246 2HG2 THR 32 2HG2 THR 32 8.131 3.520 -6.349
247 3HG2 THR 32 3HG2 THR 32 7.012 2.506 -5.442
248 H PHE 33 H PHE 33 3.454 2.541 -7.870
249 HA PHE 33 HA PHE 33 3.402 1.859 -10.722
250 1HB PHE 33 2HB PHE 33 1.218 1.321 -8.723
251 2HB PHE 33 1HB PHE 33 1.123 1.013 -10.442
252 HD1 PHE 33 1HD PHE 33 1.329 -1.199 -11.027
253 HD2 PHE 33 2HD PHE 33 3.518 0.217 -7.678
254 HE1 PHE 33 1HE PHE 33 2.254 -3.431 -10.692
255 HE2 PHE 33 2HE PHE 33 4.457 -2.018 -7.336
256 HZ PHE 33 HZ PHE 33 3.808 -3.868 -8.857
257 H GLU 34 H GLU 34 1.291 2.773 -11.731
258 HA GLU 34 HA GLU 34 1.526 5.548 -11.729
259 1HB GLU 34 2HB GLU 34 -0.203 5.558 -13.339
260 2HB GLU 34 1HB GLU 34 0.676 4.054 -13.578
261 1HG GLU 34 2HG GLU 34 -1.353 3.402 -11.786
262 2HG GLU 34 1HG GLU 34 -2.111 4.483 -12.951
263 H ASN 35 H ASN 35 -0.874 3.537 -10.003
264 HA ASN 35 HA ASN 35 -1.417 5.654 -8.204
265 1HB ASN 35 2HB ASN 35 -3.255 5.272 -10.504
266 2HB ASN 35 1HB ASN 35 -3.974 5.601 -8.929
267 1HD2 ASN 35 1HD2 ASN 35 -2.558 7.411 -7.755
268 2HD2 ASN 35 2HD2 ASN 35 -2.364 8.841 -8.703
269 H GLY 36 H GLY 36 -3.100 2.908 -9.643
270 1HA GLY 36 2HA GLY 36 -2.973 1.422 -7.185
271 2HA GLY 36 1HA GLY 36 -4.576 2.049 -7.518
272 H ASN 37 H ASN 37 -5.104 1.683 -10.019
273 HA ASN 37 HA ASN 37 -5.748 -0.953 -10.341
274 1HB ASN 37 2HB ASN 37 -6.045 1.394 -11.833
275 2HB ASN 37 1HB ASN 37 -5.296 0.232 -12.924
276 1HD2 ASN 37 1HD2 ASN 37 -7.718 -0.007 -10.327
277 2HD2 ASN 37 2HD2 ASN 37 -8.907 -0.817 -11.283
278 H GLU 38 H GLU 38 -2.779 0.652 -11.304
279 HA GLU 38 HA GLU 38 -1.752 -1.282 -13.006
280 1HB GLU 38 2HB GLU 38 -0.838 1.080 -11.946
281 2HB GLU 38 1HB GLU 38 0.265 -0.098 -11.269
282 1HG GLU 38 2HG GLU 38 -0.228 -0.502 -14.107
283 2HG GLU 38 1HG GLU 38 0.479 1.069 -13.737
284 H VAL 39 H VAL 39 -1.173 -1.070 -9.437
285 HA VAL 39 HA VAL 39 0.338 -3.438 -9.284
286 HB VAL 39 HB VAL 39 -1.523 -2.420 -7.130
287 1HG1 VAL 39 1HG1 VAL 39 -0.040 -4.737 -7.233
288 2HG1 VAL 39 2HG1 VAL 39 -0.635 -3.956 -5.771
289 3HG1 VAL 39 3HG1 VAL 39 1.002 -3.634 -6.342
290 1HG2 VAL 39 1HG2 VAL 39 0.292 -1.104 -6.302
291 2HG2 VAL 39 2HG2 VAL 39 0.043 -0.694 -8.008
292 3HG2 VAL 39 3HG2 VAL 39 1.381 -1.749 -7.532
293 H LEU 40 H LEU 40 -3.130 -2.886 -9.049
294 HA LEU 40 HA LEU 40 -3.997 -5.390 -8.304
295 1HB LEU 40 2HB LEU 40 -5.474 -3.884 -10.419
296 2HB LEU 40 1HB LEU 40 -6.114 -4.776 -9.055
297 HG LEU 40 HG LEU 40 -4.854 -2.038 -9.032
298 1HD1 LEU 40 1HD1 LEU 40 -6.943 -1.328 -9.162
299 2HD1 LEU 40 2HD1 LEU 40 -7.305 -2.162 -7.658
300 3HD1 LEU 40 3HD1 LEU 40 -7.533 -2.989 -9.201
301 1HD2 LEU 40 1HD2 LEU 40 -4.900 -1.993 -6.694
302 2HD2 LEU 40 2HD2 LEU 40 -4.168 -3.548 -7.089
303 3HD2 LEU 40 3HD2 LEU 40 -5.861 -3.468 -6.597
304 H ALA 41 H ALA 41 -3.262 -4.225 -11.572
305 HA ALA 41 HA ALA 41 -3.880 -6.714 -12.825
306 1HB ALA 41 1HB ALA 41 -3.072 -5.732 -14.836
307 2HB ALA 41 2HB ALA 41 -2.170 -4.508 -13.939
308 3HB ALA 41 3HB ALA 41 -3.934 -4.473 -13.952
309 H ALA 42 H ALA 42 -0.907 -5.065 -11.955
310 HA ALA 42 HA ALA 42 0.911 -6.980 -12.899
311 1HB ALA 42 1HB ALA 42 1.049 -4.526 -11.562
312 2HB ALA 42 2HB ALA 42 2.390 -5.461 -12.220
313 3HB ALA 42 3HB ALA 42 1.917 -5.668 -10.532
314 H LEU 43 H LEU 43 -0.937 -6.779 -9.956
315 HA LEU 43 HA LEU 43 0.502 -8.699 -8.468
316 1HB LEU 43 2HB LEU 43 -2.164 -7.405 -8.264
317 2HB LEU 43 1HB LEU 43 -1.863 -8.839 -7.301
318 HG LEU 43 HG LEU 43 0.010 -6.501 -7.234
319 1HD1 LEU 43 1HD1 LEU 43 -2.172 -5.607 -6.695
320 2HD1 LEU 43 2HD1 LEU 43 -1.191 -5.726 -5.234
321 3HD1 LEU 43 3HD1 LEU 43 -2.446 -6.919 -5.550
322 1HD2 LEU 43 1HD2 LEU 43 -0.294 -9.050 -5.845
323 2HD2 LEU 43 2HD2 LEU 43 -0.073 -7.672 -4.767
324 3HD2 LEU 43 3HD2 LEU 43 1.121 -8.012 -6.020
325 H ALA 44 H ALA 44 -1.763 -8.978 -11.022
326 HA ALA 44 HA ALA 44 -2.966 -11.422 -10.484
327 1HB ALA 44 1HB ALA 44 -3.178 -9.667 -12.484
328 2HB ALA 44 2HB ALA 44 -3.757 -11.329 -12.607
329 3HB ALA 44 3HB ALA 44 -2.192 -10.889 -13.289
330 H SER 45 H SER 45 0.317 -10.752 -11.212
331 HA SER 45 HA SER 45 0.819 -13.600 -11.631
332 1HB SER 45 2HB SER 45 1.360 -12.574 -13.687
333 2HB SER 45 1HB SER 45 2.151 -11.218 -12.886
334 HG SER 45 HG SER 45 3.426 -13.130 -13.839
335 H LYS 46 H LYS 46 1.158 -11.207 -9.402
336 HA LYS 46 HA LYS 46 3.084 -12.694 -7.921
337 1HB LYS 46 2HB LYS 46 4.214 -10.898 -9.649
338 2HB LYS 46 1HB LYS 46 4.078 -9.946 -8.176
339 1HG LYS 46 2HG LYS 46 5.101 -12.349 -7.289
340 2HG LYS 46 1HG LYS 46 5.907 -12.097 -8.840
341 1HD LYS 46 2HD LYS 46 6.306 -9.690 -7.962
342 2HD LYS 46 1HD LYS 46 5.958 -10.386 -6.379
343 1HE LYS 46 2HE LYS 46 8.092 -11.006 -6.278
344 2HE LYS 46 1HE LYS 46 7.747 -12.163 -7.565
345 1HZ LYS 46 1HZ LYS 46 9.646 -10.568 -7.953
346 2HZ LYS 46 2HZ LYS 46 8.485 -9.352 -8.128
347 3HZ LYS 46 3HZ LYS 46 8.494 -10.667 -9.190
348 H THR 47 H THR 47 3.407 -11.878 -5.761
349 HA THR 47 HA THR 47 1.582 -9.780 -4.932
350 HB THR 47 HB THR 47 1.662 -12.532 -3.701
351 HG1 THR 47 1HG THR 47 0.387 -12.351 -5.593
352 1HG2 THR 47 1HG2 THR 47 -0.131 -11.767 -2.237
353 2HG2 THR 47 2HG2 THR 47 0.054 -10.129 -2.865
354 3HG2 THR 47 3HG2 THR 47 1.367 -10.880 -1.951
355 HA PRO 48 HA PRO 48 5.378 -8.873 -2.701
356 1HB PRO 48 2HB PRO 48 4.614 -6.452 -1.760
357 2HB PRO 48 1HB PRO 48 5.141 -6.696 -3.430
358 1HG PRO 48 2HG PRO 48 2.370 -6.479 -2.330
359 2HG PRO 48 1HG PRO 48 3.042 -5.788 -3.814
360 1HD PRO 48 2HD PRO 48 1.521 -8.042 -3.779
361 2HD PRO 48 1HD PRO 48 2.770 -7.726 -5.000
362 H ASP 49 H ASP 49 5.898 -8.407 -0.415
363 HA ASP 49 HA ASP 49 4.182 -9.908 1.309
364 1HB ASP 49 2HB ASP 49 6.739 -8.375 1.818
365 2HB ASP 49 1HB ASP 49 5.897 -9.290 3.066
366 H VAL 50 H VAL 50 4.687 -6.521 0.664
367 HA VAL 50 HA VAL 50 2.479 -5.874 2.461
368 HB VAL 50 HB VAL 50 4.442 -5.594 3.871
369 1HG1 VAL 50 1HG1 VAL 50 5.818 -5.028 1.668
370 2HG1 VAL 50 2HG1 VAL 50 6.357 -4.538 3.276
371 3HG1 VAL 50 3HG1 VAL 50 5.525 -3.382 2.233
372 1HG2 VAL 50 1HG2 VAL 50 3.153 -3.026 2.975
373 2HG2 VAL 50 2HG2 VAL 50 4.196 -3.148 4.392
374 3HG2 VAL 50 3HG2 VAL 50 2.687 -4.058 4.327
375 H LEU 51 H LEU 51 1.119 -5.024 0.966
376 HA LEU 51 HA LEU 51 2.120 -3.344 -1.173
377 1HB LEU 51 2HB LEU 51 0.368 -5.076 -1.525
378 2HB LEU 51 1HB LEU 51 -0.724 -4.127 -0.541
379 HG LEU 51 HG LEU 51 -0.724 -2.339 -2.176
380 1HD1 LEU 51 1HD1 LEU 51 0.928 -2.021 -3.614
381 2HD1 LEU 51 2HD1 LEU 51 0.651 -3.604 -4.339
382 3HD1 LEU 51 3HD1 LEU 51 1.731 -3.448 -2.961
383 1HD2 LEU 51 1HD2 LEU 51 -1.154 -5.068 -3.416
384 2HD2 LEU 51 2HD2 LEU 51 -1.726 -3.549 -4.106
385 3HD2 LEU 51 3HD2 LEU 51 -2.347 -4.097 -2.550
386 H LEU 52 H LEU 52 2.016 -1.199 -1.325
387 HA LEU 52 HA LEU 52 0.589 0.298 0.785
388 1HB LEU 52 2HB LEU 52 3.287 0.363 0.128
389 2HB LEU 52 1HB LEU 52 2.637 1.778 -0.675
390 HG LEU 52 HG LEU 52 2.062 1.283 2.227
391 1HD1 LEU 52 1HD1 LEU 52 4.236 1.431 2.688
392 2HD1 LEU 52 2HD1 LEU 52 4.121 3.113 2.175
393 3HD1 LEU 52 3HD1 LEU 52 4.644 1.877 1.032
394 1HD2 LEU 52 1HD2 LEU 52 1.817 3.507 0.292
395 2HD2 LEU 52 2HD2 LEU 52 2.307 3.932 1.931
396 3HD2 LEU 52 3HD2 LEU 52 0.791 3.072 1.660
397 H SER 53 H SER 53 -1.100 1.489 0.089
398 HA SER 53 HA SER 53 -1.095 2.375 -2.721
399 1HB SER 53 2HB SER 53 -2.971 0.657 -1.367
400 2HB SER 53 1HB SER 53 -3.785 2.117 -1.930
401 HG SER 53 HG SER 53 -3.019 0.010 -3.351
402 H ASP 54 H ASP 54 -1.767 4.395 -3.184
403 HA ASP 54 HA ASP 54 -1.995 6.244 -0.968
404 1HB ASP 54 2HB ASP 54 -0.920 6.444 -3.495
405 2HB ASP 54 1HB ASP 54 -2.444 7.308 -3.672
406 H ILE 55 H ILE 55 -3.683 8.172 -1.873
407 HA ILE 55 HA ILE 55 -6.218 7.028 -2.617
408 HB ILE 55 HB ILE 55 -6.350 6.534 -0.312
409 1HG1 ILE 55 2HG1 ILE 55 -7.820 9.128 -0.833
410 2HG1 ILE 55 1HG1 ILE 55 -8.409 7.507 -1.168
411 1HG2 ILE 55 1HG2 ILE 55 -5.507 9.352 0.280
412 2HG2 ILE 55 2HG2 ILE 55 -4.494 7.914 0.433
413 3HG2 ILE 55 3HG2 ILE 55 -5.915 8.110 1.465
414 1HD1 ILE 55 1HD1 ILE 55 -9.496 7.927 0.778
415 2HD1 ILE 55 2HD1 ILE 55 -8.210 8.959 1.405
416 3HD1 ILE 55 3HD1 ILE 55 -8.021 7.204 1.421
417 H ARG 56 H ARG 56 -6.159 8.436 -4.353
418 HA ARG 56 HA ARG 56 -7.424 10.868 -4.135
419 1HB ARG 56 2HB ARG 56 -5.593 12.489 -4.580
420 2HB ARG 56 1HB ARG 56 -5.500 11.767 -2.980
421 1HG ARG 56 2HG ARG 56 -3.783 10.202 -3.834
422 2HG ARG 56 1HG ARG 56 -3.836 11.043 -5.384
423 1HD ARG 56 2HD ARG 56 -3.287 12.500 -2.815
424 2HD ARG 56 1HD ARG 56 -2.002 11.700 -3.717
425 HE ARG 56 HE ARG 56 -3.648 13.569 -5.209
426 1HH1 ARG 56 1HH1 ARG 56 -0.683 13.039 -3.438
427 2HH1 ARG 56 2HH1 ARG 56 0.131 14.386 -4.159
428 1HH2 ARG 56 1HH2 ARG 56 -2.573 15.342 -6.150
429 2HH2 ARG 56 2HH2 ARG 56 -0.938 15.691 -5.693
430 H MET 57 H MET 57 -7.634 8.772 -5.881
431 HA MET 57 HA MET 57 -7.310 10.130 -8.388
432 1HB MET 57 2HB MET 57 -5.086 9.066 -8.054
433 2HB MET 57 1HB MET 57 -5.868 7.497 -8.058
434 1HG MET 57 2HG MET 57 -5.266 7.577 -10.231
435 2HG MET 57 1HG MET 57 -6.816 8.408 -10.362
436 1HE MET 57 1HE MET 57 -6.074 11.872 -11.410
437 2HE MET 57 2HE MET 57 -6.609 11.430 -9.788
438 3HE MET 57 3HE MET 57 -7.209 10.540 -11.189
439 HA PRO 58 HA PRO 58 -9.669 5.941 -9.313
440 1HB PRO 58 2HB PRO 58 -10.344 4.591 -6.973
441 2HB PRO 58 1HB PRO 58 -9.062 4.121 -8.095
442 1HG PRO 58 2HG PRO 58 -8.880 5.659 -5.540
443 2HG PRO 58 1HG PRO 58 -7.788 4.419 -6.185
444 1HD PRO 58 2HD PRO 58 -7.141 6.999 -6.319
445 2HD PRO 58 1HD PRO 58 -6.781 5.902 -7.671
446 H GLY 59 H GLY 59 -11.985 5.253 -8.722
447 1HA GLY 59 2HA GLY 59 -13.626 7.473 -8.529
448 2HA GLY 59 1HA GLY 59 -14.151 5.827 -8.205
449 H MET 60 H MET 60 -13.157 5.049 -5.954
450 HA MET 60 HA MET 60 -14.316 6.829 -3.990
451 1HB MET 60 2HB MET 60 -14.332 4.160 -4.174
452 2HB MET 60 1HB MET 60 -12.895 4.345 -3.180
453 1HG MET 60 2HG MET 60 -14.227 4.437 -1.420
454 2HG MET 60 1HG MET 60 -14.768 6.011 -1.996
455 1HE MET 60 1HE MET 60 -17.424 3.018 -0.772
456 2HE MET 60 2HE MET 60 -17.339 4.727 -0.344
457 3HE MET 60 3HE MET 60 -15.904 3.710 -0.208
458 H ASP 61 H ASP 61 -12.256 8.188 -4.962
459 HA ASP 61 HA ASP 61 -10.332 9.287 -4.478
460 1HB ASP 61 2HB ASP 61 -11.591 8.654 -1.933
461 2HB ASP 61 1HB ASP 61 -9.843 8.815 -1.782
462 H GLY 62 H GLY 62 -10.072 6.579 -2.211
463 1HA GLY 62 2HA GLY 62 -7.848 5.463 -3.739
464 2HA GLY 62 1HA GLY 62 -7.505 6.001 -2.102
465 H LEU 63 H LEU 63 -10.035 5.244 -0.993
466 HA LEU 63 HA LEU 63 -9.471 2.678 -0.155
467 1HB LEU 63 2HB LEU 63 -12.244 3.845 -0.253
468 2HB LEU 63 1HB LEU 63 -11.648 2.605 0.837
469 HG LEU 63 HG LEU 63 -9.945 4.585 1.465
470 1HD1 LEU 63 1HD1 LEU 63 -11.564 6.619 1.696
471 2HD1 LEU 63 2HD1 LEU 63 -12.340 5.901 0.286
472 3HD1 LEU 63 3HD1 LEU 63 -10.643 6.371 0.213
473 1HD2 LEU 63 1HD2 LEU 63 -11.158 4.863 3.446
474 2HD2 LEU 63 2HD2 LEU 63 -11.527 3.227 2.898
475 3HD2 LEU 63 3HD2 LEU 63 -12.696 4.519 2.653
476 H ALA 64 H ALA 64 -10.993 3.758 -3.056
477 HA ALA 64 HA ALA 64 -12.468 1.500 -3.797
478 1HB ALA 64 1HB ALA 64 -10.967 2.829 -5.954
479 2HB ALA 64 2HB ALA 64 -11.951 3.894 -4.948
480 3HB ALA 64 3HB ALA 64 -12.699 2.535 -5.793
481 H LEU 65 H LEU 65 -9.036 2.178 -3.889
482 HA LEU 65 HA LEU 65 -8.158 0.093 -5.542
483 1HB LEU 65 2HB LEU 65 -6.992 1.980 -3.674
484 2HB LEU 65 1HB LEU 65 -6.200 0.425 -3.566
485 HG LEU 65 HG LEU 65 -6.565 1.379 -6.316
486 1HD1 LEU 65 1HD1 LEU 65 -5.621 3.385 -6.200
487 2HD1 LEU 65 2HD1 LEU 65 -4.293 2.764 -5.220
488 3HD1 LEU 65 3HD1 LEU 65 -5.782 3.305 -4.446
489 1HD2 LEU 65 1HD2 LEU 65 -4.881 -0.037 -6.604
490 2HD2 LEU 65 2HD2 LEU 65 -4.930 -0.395 -4.877
491 3HD2 LEU 65 3HD2 LEU 65 -3.867 0.874 -5.485
492 H LEU 66 H LEU 66 -8.975 0.200 -2.136
493 HA LEU 66 HA LEU 66 -7.941 -2.310 -1.393
494 1HB LEU 66 2HB LEU 66 -10.184 -0.663 -0.236
495 2HB LEU 66 1HB LEU 66 -9.609 -2.151 0.491
496 HG LEU 66 HG LEU 66 -8.613 -0.299 1.652
497 1HD1 LEU 66 1HD1 LEU 66 -6.447 -1.335 -0.146
498 2HD1 LEU 66 2HD1 LEU 66 -7.228 -2.354 1.063
499 3HD1 LEU 66 3HD1 LEU 66 -6.350 -0.907 1.561
500 1HD2 LEU 66 1HD2 LEU 66 -8.801 1.077 -0.645
501 2HD2 LEU 66 2HD2 LEU 66 -7.081 0.691 -0.660
502 3HD2 LEU 66 3HD2 LEU 66 -7.780 1.564 0.702
503 H LYS 67 H LYS 67 -11.094 -1.281 -2.560
504 HA LYS 67 HA LYS 67 -12.489 -3.655 -2.319
505 1HB LYS 67 2HB LYS 67 -12.651 -1.470 -4.388
506 2HB LYS 67 1HB LYS 67 -13.766 -2.832 -4.370
507 1HG LYS 67 2HG LYS 67 -13.392 -1.228 -1.886
508 2HG LYS 67 1HG LYS 67 -14.385 -0.586 -3.194
509 1HD LYS 67 2HD LYS 67 -15.985 -1.714 -2.013
510 2HD LYS 67 1HD LYS 67 -15.453 -2.999 -3.099
511 1HE LYS 67 2HE LYS 67 -14.234 -4.071 -1.434
512 2HE LYS 67 1HE LYS 67 -14.149 -2.623 -0.430
513 1HZ LYS 67 1HZ LYS 67 -16.740 -2.960 -0.416
514 2HZ LYS 67 2HZ LYS 67 -15.743 -3.781 0.675
515 3HZ LYS 67 3HZ LYS 67 -16.313 -4.571 -0.707
516 H GLN 68 H GLN 68 -10.523 -2.530 -5.069
517 HA GLN 68 HA GLN 68 -10.827 -4.837 -6.647
518 1HB GLN 68 2HB GLN 68 -8.420 -3.025 -6.607
519 2HB GLN 68 1HB GLN 68 -8.951 -4.047 -7.931
520 1HG GLN 68 2HG GLN 68 -10.423 -1.652 -6.869
521 2HG GLN 68 1HG GLN 68 -9.435 -1.691 -8.333
522 1HE2 GLN 68 1HE2 GLN 68 -10.152 -2.995 -10.092
523 2HE2 GLN 68 2HE2 GLN 68 -11.829 -3.357 -10.289
524 H ILE 69 H ILE 69 -8.511 -3.939 -4.154
525 HA ILE 69 HA ILE 69 -6.624 -5.919 -4.473
526 HB ILE 69 HB ILE 69 -7.556 -4.525 -1.977
527 1HG1 ILE 69 2HG1 ILE 69 -4.848 -4.217 -3.181
528 2HG1 ILE 69 1HG1 ILE 69 -6.202 -3.469 -4.023
529 1HG2 ILE 69 1HG2 ILE 69 -5.078 -5.454 -1.353
530 2HG2 ILE 69 2HG2 ILE 69 -5.741 -6.804 -2.266
531 3HG2 ILE 69 3HG2 ILE 69 -6.588 -6.205 -0.843
532 1HD1 ILE 69 1HD1 ILE 69 -4.720 -2.364 -2.006
533 2HD1 ILE 69 2HD1 ILE 69 -6.167 -2.922 -1.166
534 3HD1 ILE 69 3HD1 ILE 69 -6.309 -1.819 -2.535
535 H LYS 70 H LYS 70 -9.579 -6.030 -2.577
536 HA LYS 70 HA LYS 70 -9.158 -8.651 -1.598
537 1HB LYS 70 2HB LYS 70 -11.441 -8.562 -0.800
538 2HB LYS 70 1HB LYS 70 -10.642 -7.031 -0.488
539 1HG LYS 70 2HG LYS 70 -11.901 -5.895 -2.029
540 2HG LYS 70 1HG LYS 70 -12.248 -7.346 -2.975
541 1HD LYS 70 2HD LYS 70 -13.339 -7.788 -0.419
542 2HD LYS 70 1HD LYS 70 -13.774 -6.136 -0.861
543 1HE LYS 70 2HE LYS 70 -15.524 -7.411 -1.716
544 2HE LYS 70 1HE LYS 70 -14.484 -7.143 -3.113
545 1HZ LYS 70 1HZ LYS 70 -14.675 -9.599 -1.463
546 2HZ LYS 70 2HZ LYS 70 -13.489 -9.357 -2.642
547 3HZ LYS 70 3HZ LYS 70 -15.121 -9.417 -3.086
548 H GLN 71 H GLN 71 -10.491 -7.426 -4.536
549 HA GLN 71 HA GLN 71 -11.791 -9.895 -5.210
550 1HB GLN 71 2HB GLN 71 -11.465 -7.269 -6.603
551 2HB GLN 71 1HB GLN 71 -12.098 -8.669 -7.457
552 1HG GLN 71 2HG GLN 71 -14.038 -8.717 -6.220
553 2HG GLN 71 1HG GLN 71 -13.318 -7.856 -4.861
554 1HE2 GLN 71 1HE2 GLN 71 -12.389 -5.617 -5.741
555 2HE2 GLN 71 2HE2 GLN 71 -13.575 -4.660 -6.552
556 H ARG 72 H ARG 72 -8.896 -8.178 -6.196
557 HA ARG 72 HA ARG 72 -8.202 -10.394 -7.973
558 1HB ARG 72 2HB ARG 72 -6.968 -7.655 -7.738
559 2HB ARG 72 1HB ARG 72 -6.482 -8.889 -8.897
560 1HG ARG 72 2HG ARG 72 -9.196 -8.664 -9.310
561 2HG ARG 72 1HG ARG 72 -8.693 -7.004 -8.984
562 1HD ARG 72 2HD ARG 72 -6.961 -8.546 -10.803
563 2HD ARG 72 1HD ARG 72 -8.569 -8.166 -11.413
564 HE ARG 72 HE ARG 72 -6.661 -6.128 -10.455
565 1HH1 ARG 72 1HH1 ARG 72 -9.150 -7.176 -12.683
566 2HH1 ARG 72 2HH1 ARG 72 -9.122 -5.704 -13.591
567 1HH2 ARG 72 1HH2 ARG 72 -6.641 -4.199 -11.661
568 2HH2 ARG 72 2HH2 ARG 72 -7.703 -4.021 -13.013
569 H HIS 73 H HIS 73 -6.890 -8.574 -5.264
570 HA HIS 73 HA HIS 73 -4.525 -10.240 -5.187
571 1HB HIS 73 2HB HIS 73 -5.234 -8.357 -2.973
572 2HB HIS 73 1HB HIS 73 -3.650 -8.800 -3.586
573 HD1 HIS 73 1HD HIS 73 -3.882 -5.934 -3.282
574 HD2 HIS 73 2HD HIS 73 -5.372 -7.796 -6.661
575 HE1 HIS 73 1HE HIS 73 -4.005 -4.144 -5.044
576 HE2 HIS 73 2HE HIS 73 -5.153 -5.263 -6.983
577 HA PRO 74 HA PRO 74 -6.252 -13.320 -2.501
578 1HB PRO 74 2HB PRO 74 -3.497 -13.873 -1.628
579 2HB PRO 74 1HB PRO 74 -4.632 -14.918 -2.486
580 1HG PRO 74 2HG PRO 74 -2.468 -13.880 -3.693
581 2HG PRO 74 1HG PRO 74 -3.998 -14.124 -4.557
582 1HD PRO 74 2HD PRO 74 -2.851 -11.603 -3.412
583 2HD PRO 74 1HD PRO 74 -3.676 -11.863 -4.963
584 H MET 75 H MET 75 -6.939 -11.269 -1.229
585 HA MET 75 HA MET 75 -7.131 -10.126 0.726
586 1HB MET 75 2HB MET 75 -7.402 -11.469 2.589
587 2HB MET 75 1HB MET 75 -7.565 -12.629 1.288
588 1HG MET 75 2HG MET 75 -4.873 -12.698 1.843
589 2HG MET 75 1HG MET 75 -5.607 -12.476 3.428
590 1HE MET 75 1HE MET 75 -5.030 -14.355 4.523
591 2HE MET 75 2HE MET 75 -4.197 -15.431 3.403
592 3HE MET 75 3HE MET 75 -5.621 -15.999 4.274
593 H LEU 76 H LEU 76 -4.664 -9.759 -0.655
594 HA LEU 76 HA LEU 76 -2.442 -9.806 1.084
595 1HB LEU 76 2HB LEU 76 -2.202 -9.692 -1.331
596 2HB LEU 76 1HB LEU 76 -2.995 -8.129 -1.361
597 HG LEU 76 HG LEU 76 -1.051 -7.321 0.114
598 1HD1 LEU 76 1HD1 LEU 76 -0.385 -10.033 -0.029
599 2HD1 LEU 76 2HD1 LEU 76 0.588 -8.724 0.639
600 3HD1 LEU 76 3HD1 LEU 76 0.786 -9.198 -1.047
601 1HD2 LEU 76 1HD2 LEU 76 -1.438 -6.790 -2.302
602 2HD2 LEU 76 2HD2 LEU 76 -0.393 -8.154 -2.706
603 3HD2 LEU 76 3HD2 LEU 76 0.257 -6.782 -1.811
604 HA PRO 77 HA PRO 77 -3.471 -6.367 3.729
605 1HB PRO 77 2HB PRO 77 -0.939 -5.875 4.664
606 2HB PRO 77 1HB PRO 77 -1.997 -7.141 5.294
607 1HG PRO 77 2HG PRO 77 0.257 -7.347 3.346
608 2HG PRO 77 1HG PRO 77 -0.199 -8.447 4.660
609 1HD PRO 77 2HD PRO 77 -0.782 -8.963 2.074
610 2HD PRO 77 1HD PRO 77 -1.843 -9.467 3.404
611 H VAL 78 H VAL 78 -3.802 -4.332 3.138
612 HA VAL 78 HA VAL 78 -1.809 -3.013 1.409
613 HB VAL 78 HB VAL 78 -4.738 -2.316 1.477
614 1HG1 VAL 78 1HG1 VAL 78 -4.325 -0.922 -0.258
615 2HG1 VAL 78 2HG1 VAL 78 -3.044 -1.939 -0.917
616 3HG1 VAL 78 3HG1 VAL 78 -2.717 -0.894 0.464
617 1HG2 VAL 78 1HG2 VAL 78 -3.729 -4.747 0.572
618 2HG2 VAL 78 2HG2 VAL 78 -3.920 -3.773 -0.885
619 3HG2 VAL 78 3HG2 VAL 78 -5.297 -4.041 0.184
620 H ILE 79 H ILE 79 -1.352 -0.840 1.761
621 HA ILE 79 HA ILE 79 -2.337 0.272 4.305
622 HB ILE 79 HB ILE 79 0.405 0.739 3.152
623 1HG1 ILE 79 2HG1 ILE 79 0.523 -0.708 5.594
624 2HG1 ILE 79 1HG1 ILE 79 -0.602 -1.554 4.538
625 1HG2 ILE 79 1HG2 ILE 79 -0.922 2.314 4.841
626 2HG2 ILE 79 2HG2 ILE 79 0.822 2.074 4.933
627 3HG2 ILE 79 3HG2 ILE 79 -0.250 1.171 6.003
628 1HD1 ILE 79 1HD1 ILE 79 1.015 -2.215 3.128
629 2HD1 ILE 79 2HD1 ILE 79 2.049 -1.948 4.533
630 3HD1 ILE 79 3HD1 ILE 79 1.919 -0.708 3.287
631 H ILE 80 H ILE 80 -3.605 1.956 3.889
632 HA ILE 80 HA ILE 80 -3.063 3.590 1.527
633 HB ILE 80 HB ILE 80 -5.482 3.756 3.300
634 1HG1 ILE 80 2HG1 ILE 80 -5.267 1.476 2.416
635 2HG1 ILE 80 1HG1 ILE 80 -6.613 2.323 1.666
636 1HG2 ILE 80 1HG2 ILE 80 -4.934 5.664 1.771
637 2HG2 ILE 80 2HG2 ILE 80 -6.499 4.907 1.475
638 3HG2 ILE 80 3HG2 ILE 80 -5.135 4.552 0.417
639 1HD1 ILE 80 1HD1 ILE 80 -5.223 0.953 0.115
640 2HD1 ILE 80 2HD1 ILE 80 -3.899 2.080 0.405
641 3HD1 ILE 80 3HD1 ILE 80 -5.390 2.647 -0.345
642 H MET 81 H MET 81 -2.754 5.790 1.594
643 HA MET 81 HA MET 81 -1.451 6.804 3.904
644 1HB MET 81 2HB MET 81 -0.850 7.519 1.653
645 2HB MET 81 1HB MET 81 -2.435 8.248 1.435
646 1HG MET 81 2HG MET 81 -1.971 9.953 2.993
647 2HG MET 81 1HG MET 81 -0.545 9.112 3.601
648 1HE MET 81 1HE MET 81 -1.794 11.826 2.017
649 2HE MET 81 2HE MET 81 -0.736 12.360 0.713
650 3HE MET 81 3HE MET 81 -0.184 12.444 2.386
651 H THR 82 H THR 82 -4.332 8.163 2.313
652 HA THR 82 HA THR 82 -5.232 9.140 4.935
653 HB THR 82 HB THR 82 -6.273 10.065 2.265
654 HG1 THR 82 1HG THR 82 -3.912 10.293 2.516
655 1HG2 THR 82 1HG2 THR 82 -6.859 10.792 4.938
656 2HG2 THR 82 2HG2 THR 82 -7.495 11.472 3.440
657 3HG2 THR 82 3HG2 THR 82 -6.032 12.143 4.165
658 H ALA 83 H ALA 83 -7.734 9.284 5.108
659 HA ALA 83 HA ALA 83 -8.912 6.839 3.963
660 1HB ALA 83 1HB ALA 83 -8.545 7.594 6.726
661 2HB ALA 83 2HB ALA 83 -9.015 6.041 6.031
662 3HB ALA 83 3HB ALA 83 -10.240 7.270 6.361
663 H HIS 84 H HIS 84 -9.147 10.131 3.986
664 HA HIS 84 HA HIS 84 -10.868 11.662 3.829
665 1HB HIS 84 2HB HIS 84 -11.246 9.668 1.610
666 2HB HIS 84 1HB HIS 84 -12.022 11.251 1.631
667 HD1 HIS 84 1HD HIS 84 -9.516 9.949 -0.172
668 HD2 HIS 84 2HD HIS 84 -9.505 13.062 2.572
669 HE1 HIS 84 1HE HIS 84 -7.463 11.296 -0.680
670 HE2 HIS 84 2HE HIS 84 -7.449 13.151 1.012
671 H SER 85 H SER 85 -13.435 11.370 2.644
672 HA SER 85 HA SER 85 -14.925 10.624 4.987
673 1HB SER 85 2HB SER 85 -15.675 11.848 2.341
674 2HB SER 85 1HB SER 85 -16.896 11.367 3.519
675 HG SER 85 HG SER 85 -15.488 12.707 5.015
676 H ASP 86 H ASP 86 -14.157 9.125 1.966
677 HA ASP 86 HA ASP 86 -16.388 7.298 1.999
678 1HB ASP 86 2HB ASP 86 -13.837 7.257 0.372
679 2HB ASP 86 1HB ASP 86 -15.219 6.196 0.118
680 H LEU 87 H LEU 87 -14.423 7.453 4.294
681 HA LEU 87 HA LEU 87 -12.707 5.398 4.609
682 1HB LEU 87 2HB LEU 87 -13.338 7.191 6.247
683 2HB LEU 87 1HB LEU 87 -14.729 6.221 6.682
684 HG LEU 87 HG LEU 87 -12.696 6.112 8.209
685 1HD1 LEU 87 1HD1 LEU 87 -14.669 4.342 7.707
686 2HD1 LEU 87 2HD1 LEU 87 -13.449 4.145 8.966
687 3HD1 LEU 87 3HD1 LEU 87 -13.247 3.344 7.408
688 1HD2 LEU 87 1HD2 LEU 87 -11.272 5.701 5.979
689 2HD2 LEU 87 2HD2 LEU 87 -11.564 4.033 6.460
690 3HD2 LEU 87 3HD2 LEU 87 -10.764 5.139 7.573
691 H ASP 88 H ASP 88 -16.136 5.089 4.298
692 HA ASP 88 HA ASP 88 -16.725 2.732 5.560
693 1HB ASP 88 2HB ASP 88 -17.721 3.827 2.936
694 2HB ASP 88 1HB ASP 88 -18.382 2.362 3.658
695 H ALA 89 H ALA 89 -15.084 3.116 2.445
696 HA ALA 89 HA ALA 89 -15.123 0.359 1.792
697 1HB ALA 89 1HB ALA 89 -13.751 2.758 0.699
698 2HB ALA 89 2HB ALA 89 -14.834 1.609 -0.094
699 3HB ALA 89 3HB ALA 89 -13.159 1.160 0.235
700 H ALA 90 H ALA 90 -13.072 2.247 3.825
701 HA ALA 90 HA ALA 90 -10.805 0.503 3.706
702 1HB ALA 90 1HB ALA 90 -9.934 1.732 5.586
703 2HB ALA 90 2HB ALA 90 -11.520 2.441 5.897
704 3HB ALA 90 3HB ALA 90 -10.635 2.868 4.434
705 H VAL 91 H VAL 91 -13.756 0.628 5.567
706 HA VAL 91 HA VAL 91 -12.963 -1.056 7.661
707 HB VAL 91 HB VAL 91 -15.769 -1.094 6.602
708 1HG1 VAL 91 1HG1 VAL 91 -14.338 -1.903 9.012
709 2HG1 VAL 91 2HG1 VAL 91 -15.926 -2.401 8.414
710 3HG1 VAL 91 3HG1 VAL 91 -15.764 -0.916 9.353
711 1HG2 VAL 91 1HG2 VAL 91 -16.183 0.897 8.063
712 2HG2 VAL 91 2HG2 VAL 91 -15.213 1.245 6.632
713 3HG2 VAL 91 3HG2 VAL 91 -14.436 1.089 8.207
714 H SER 92 H SER 92 -14.440 -1.764 4.517
715 HA SER 92 HA SER 92 -14.516 -4.569 4.916
716 1HB SER 92 2HB SER 92 -14.994 -4.746 2.557
717 2HB SER 92 1HB SER 92 -15.877 -3.359 3.192
718 HG SER 92 HG SER 92 -13.523 -2.464 2.405
719 H ALA 93 H ALA 93 -12.039 -2.323 4.105
720 HA ALA 93 HA ALA 93 -10.274 -4.050 2.757
721 1HB ALA 93 1HB ALA 93 -8.522 -2.421 3.423
722 2HB ALA 93 2HB ALA 93 -9.733 -1.591 4.394
723 3HB ALA 93 3HB ALA 93 -9.920 -1.683 2.641
724 H TYR 94 H TYR 94 -10.820 -3.302 6.118
725 HA TYR 94 HA TYR 94 -8.666 -4.845 7.158
726 1HB TYR 94 2HB TYR 94 -11.211 -4.250 8.658
727 2HB TYR 94 1HB TYR 94 -9.586 -4.445 9.302
728 HD1 TYR 94 1HD TYR 94 -12.012 -2.118 8.943
729 HD2 TYR 94 2HD TYR 94 -7.903 -2.648 7.946
730 HE1 TYR 94 1HE TYR 94 -11.706 0.321 8.903
731 HE2 TYR 94 2HE TYR 94 -7.592 -0.208 7.905
732 HH TYR 94 HH TYR 94 -8.530 1.785 8.425
733 H GLN 95 H GLN 95 -11.824 -5.524 6.006
734 HA GLN 95 HA GLN 95 -12.268 -7.980 7.356
735 1HB GLN 95 2HB GLN 95 -14.230 -7.136 6.496
736 2HB GLN 95 1HB GLN 95 -13.474 -6.588 5.012
737 1HG GLN 95 2HG GLN 95 -13.717 -9.512 5.504
738 2HG GLN 95 1HG GLN 95 -15.147 -8.598 5.023
739 1HE2 GLN 95 1HE2 GLN 95 -14.266 -6.833 3.230
740 2HE2 GLN 95 2HE2 GLN 95 -13.550 -7.625 1.871
741 H GLN 96 H GLN 96 -10.935 -7.203 4.149
742 HA GLN 96 HA GLN 96 -10.406 -9.948 3.560
743 1HB GLN 96 2HB GLN 96 -9.343 -9.157 1.545
744 2HB GLN 96 1HB GLN 96 -10.848 -8.283 1.785
745 1HG GLN 96 2HG GLN 96 -8.736 -6.835 3.030
746 2HG GLN 96 1HG GLN 96 -8.260 -7.246 1.381
747 1HE2 GLN 96 1HE2 GLN 96 -8.394 -5.113 0.691
748 2HE2 GLN 96 2HE2 GLN 96 -9.906 -4.311 0.467
749 H GLY 97 H GLY 97 -8.801 -7.516 5.356
750 1HA GLY 97 2HA GLY 97 -7.029 -8.402 6.818
751 2HA GLY 97 1HA GLY 97 -6.382 -9.216 5.404
752 H ALA 98 H ALA 98 -7.550 -5.884 5.436
753 HA ALA 98 HA ALA 98 -5.223 -4.895 4.203
754 1HB ALA 98 1HB ALA 98 -7.033 -3.529 3.843
755 2HB ALA 98 2HB ALA 98 -6.191 -2.637 5.112
756 3HB ALA 98 3HB ALA 98 -7.585 -3.639 5.515
757 H PHE 99 H PHE 99 -3.622 -3.401 5.091
758 HA PHE 99 HA PHE 99 -2.671 -4.305 7.628
759 1HB PHE 99 2HB PHE 99 -1.249 -3.615 5.598
760 2HB PHE 99 1HB PHE 99 -1.530 -1.960 6.137
761 HD1 PHE 99 1HD PHE 99 -0.474 -5.239 7.567
762 HD2 PHE 99 2HD PHE 99 0.048 -1.018 7.514
763 HE1 PHE 99 1HE PHE 99 1.362 -5.453 9.187
764 HE2 PHE 99 2HE PHE 99 1.893 -1.223 9.133
765 HZ PHE 99 HZ PHE 99 2.551 -3.442 9.968
766 H ASP 100 H ASP 100 -3.682 -1.111 6.387
767 HA ASP 100 HA ASP 100 -5.257 -0.335 8.482
768 1HB ASP 100 2HB ASP 100 -2.525 -0.437 9.333
769 2HB ASP 100 1HB ASP 100 -3.047 1.243 9.330
770 H TYR 101 H TYR 101 -4.666 2.286 8.946
771 HA TYR 101 HA TYR 101 -4.351 3.525 6.306
772 1HB TYR 101 2HB TYR 101 -6.767 3.492 8.002
773 2HB TYR 101 1HB TYR 101 -6.305 5.082 7.409
774 HD1 TYR 101 1HD TYR 101 -7.058 1.614 6.274
775 HD2 TYR 101 2HD TYR 101 -6.855 5.739 5.231
776 HE1 TYR 101 1HE TYR 101 -8.122 1.119 4.112
777 HE2 TYR 101 2HE TYR 101 -7.925 5.251 3.070
778 HH TYR 101 HH TYR 101 -8.271 3.406 1.561
779 H LEU 102 H LEU 102 -3.716 5.760 6.399
780 HA LEU 102 HA LEU 102 -2.349 6.410 8.913
781 1HB LEU 102 2HB LEU 102 -1.782 6.837 6.065
782 2HB LEU 102 1HB LEU 102 -1.452 8.233 7.070
783 HG LEU 102 HG LEU 102 0.091 6.912 8.425
784 1HD1 LEU 102 1HD1 LEU 102 -1.029 4.739 8.192
785 2HD1 LEU 102 2HD1 LEU 102 0.690 4.657 7.803
786 3HD1 LEU 102 3HD1 LEU 102 -0.506 4.674 6.510
787 1HD2 LEU 102 1HD2 LEU 102 1.190 7.990 6.698
788 2HD2 LEU 102 2HD2 LEU 102 0.448 6.980 5.460
789 3HD2 LEU 102 3HD2 LEU 102 1.708 6.316 6.503
790 HA PRO 103 HA PRO 103 -5.583 9.449 9.579
791 1HB PRO 103 2HB PRO 103 -4.312 10.725 11.672
792 2HB PRO 103 1HB PRO 103 -5.314 9.283 11.832
793 1HG PRO 103 2HG PRO 103 -2.343 9.524 11.728
794 2HG PRO 103 1HG PRO 103 -3.350 8.441 12.703
795 1HD PRO 103 2HD PRO 103 -2.055 7.606 10.485
796 2HD PRO 103 1HD PRO 103 -3.621 6.936 10.982
797 H LYS 104 H LYS 104 -2.386 10.831 10.303
798 HA LYS 104 HA LYS 104 -2.881 12.857 8.231
799 1HB LYS 104 2HB LYS 104 -3.295 13.837 10.428
800 2HB LYS 104 1HB LYS 104 -1.695 13.354 10.964
801 1HG LYS 104 2HG LYS 104 -0.963 14.773 8.850
802 2HG LYS 104 1HG LYS 104 -2.511 15.561 9.166
803 1HD LYS 104 2HD LYS 104 -1.245 15.280 11.662
804 2HD LYS 104 1HD LYS 104 -0.005 15.851 10.543
805 1HE LYS 104 2HE LYS 104 -2.629 17.186 10.361
806 2HE LYS 104 1HE LYS 104 -1.717 17.476 11.842
807 1HZ LYS 104 1HZ LYS 104 -0.202 18.698 10.763
808 2HZ LYS 104 2HZ LYS 104 -1.393 18.857 9.574
809 3HZ LYS 104 3HZ LYS 104 -0.178 17.693 9.402
810 HA PRO 105 HA PRO 105 1.971 12.395 8.754
811 1HB PRO 105 2HB PRO 105 2.079 9.728 10.046
812 2HB PRO 105 1HB PRO 105 3.080 11.156 10.325
813 1HG PRO 105 2HG PRO 105 1.227 10.422 12.094
814 2HG PRO 105 1HG PRO 105 1.521 12.136 11.737
815 1HD PRO 105 2HD PRO 105 -0.683 10.348 10.786
816 2HD PRO 105 1HD PRO 105 -0.755 12.042 11.307
817 H PHE 106 H PHE 106 3.429 11.085 7.458
818 HA PHE 106 HA PHE 106 2.601 8.698 6.178
819 1HB PHE 106 2HB PHE 106 1.031 10.136 4.997
820 2HB PHE 106 1HB PHE 106 2.318 11.258 4.571
821 HD1 PHE 106 1HD PHE 106 1.386 7.673 4.175
822 HD2 PHE 106 2HD PHE 106 3.285 11.080 2.485
823 HE1 PHE 106 1HE PHE 106 1.763 6.421 2.094
824 HE2 PHE 106 2HE PHE 106 3.669 9.837 0.399
825 HZ PHE 106 HZ PHE 106 2.908 7.503 0.200
826 H ASP 107 H ASP 107 4.185 11.119 4.214
827 HA ASP 107 HA ASP 107 6.265 10.997 3.245
828 1HB ASP 107 2HB ASP 107 8.050 11.287 5.157
829 2HB ASP 107 1HB ASP 107 6.883 12.560 4.809
830 H ILE 108 H ILE 108 8.617 10.014 3.558
831 HA ILE 108 HA ILE 108 8.293 7.229 3.258
832 HB ILE 108 HB ILE 108 10.380 9.134 2.797
833 1HG1 ILE 108 2HG1 ILE 108 10.883 7.737 0.964
834 2HG1 ILE 108 1HG1 ILE 108 10.225 6.319 1.760
835 1HG2 ILE 108 1HG2 ILE 108 11.192 6.553 4.093
836 2HG2 ILE 108 2HG2 ILE 108 11.645 8.192 4.559
837 3HG2 ILE 108 3HG2 ILE 108 12.273 7.492 3.063
838 1HD1 ILE 108 1HD1 ILE 108 8.010 7.014 1.397
839 2HD1 ILE 108 2HD1 ILE 108 8.860 7.313 -0.121
840 3HD1 ILE 108 3HD1 ILE 108 8.511 8.652 0.973
841 H ASP 109 H ASP 109 9.833 9.125 5.774
842 HA ASP 109 HA ASP 109 10.847 7.138 7.352
843 1HB ASP 109 2HB ASP 109 10.395 8.733 9.280
844 2HB ASP 109 1HB ASP 109 11.315 9.376 7.923
845 H GLU 110 H GLU 110 7.586 8.564 7.814
846 HA GLU 110 HA GLU 110 6.826 6.586 9.686
847 1HB GLU 110 2HB GLU 110 5.094 8.488 8.102
848 2HB GLU 110 1HB GLU 110 4.563 7.540 9.481
849 1HG GLU 110 2HG GLU 110 6.905 9.302 9.874
850 2HG GLU 110 1HG GLU 110 5.331 10.072 9.673
851 H ALA 111 H ALA 111 6.583 6.862 6.231
852 HA ALA 111 HA ALA 111 4.650 4.825 5.855
853 1HB ALA 111 1HB ALA 111 6.668 6.109 4.048
854 2HB ALA 111 2HB ALA 111 4.909 6.272 4.042
855 3HB ALA 111 3HB ALA 111 5.660 4.766 3.501
856 H VAL 112 H VAL 112 8.165 4.779 5.227
857 HA VAL 112 HA VAL 112 8.420 2.029 4.904
858 HB VAL 112 HB VAL 112 10.507 3.846 6.104
859 1HG1 VAL 112 1HG1 VAL 112 10.553 1.122 5.793
860 2HG1 VAL 112 2HG1 VAL 112 11.974 2.166 5.890
861 3HG1 VAL 112 3HG1 VAL 112 11.335 1.689 4.316
862 1HG2 VAL 112 1HG2 VAL 112 9.378 3.683 3.415
863 2HG2 VAL 112 2HG2 VAL 112 11.137 3.578 3.461
864 3HG2 VAL 112 3HG2 VAL 112 10.316 4.965 4.173
865 H ALA 113 H ALA 113 8.339 3.985 7.764
866 HA ALA 113 HA ALA 113 9.262 2.144 9.663
867 1HB ALA 113 1HB ALA 113 8.090 3.526 11.295
868 2HB ALA 113 2HB ALA 113 7.187 4.307 9.994
869 3HB ALA 113 3HB ALA 113 8.933 4.534 10.117
870 H LEU 114 H LEU 114 6.027 2.846 8.467
871 HA LEU 114 HA LEU 114 4.773 0.827 10.044
872 1HB LEU 114 2HB LEU 114 3.540 2.808 9.526
873 2HB LEU 114 1HB LEU 114 3.819 2.598 7.809
874 HG LEU 114 HG LEU 114 2.478 0.334 8.267
875 1HD1 LEU 114 1HD1 LEU 114 1.907 2.087 10.577
876 2HD1 LEU 114 2HD1 LEU 114 1.850 0.328 10.444
877 3HD1 LEU 114 3HD1 LEU 114 0.524 1.305 9.808
878 1HD2 LEU 114 1HD2 LEU 114 1.604 1.603 6.615
879 2HD2 LEU 114 2HD2 LEU 114 1.649 3.083 7.567
880 3HD2 LEU 114 3HD2 LEU 114 0.380 1.891 7.851
881 H VAL 115 H VAL 115 6.289 0.924 6.948
882 HA VAL 115 HA VAL 115 4.867 -1.329 5.902
883 HB VAL 115 HB VAL 115 6.085 0.534 4.552
884 1HG1 VAL 115 1HG1 VAL 115 8.328 -0.451 5.715
885 2HG1 VAL 115 2HG1 VAL 115 8.301 0.420 4.182
886 3HG1 VAL 115 3HG1 VAL 115 8.319 -1.345 4.195
887 1HG2 VAL 115 1HG2 VAL 115 4.841 -1.181 3.476
888 2HG2 VAL 115 2HG2 VAL 115 6.076 -2.388 3.839
889 3HG2 VAL 115 3HG2 VAL 115 6.412 -1.102 2.681
890 H GLU 116 H GLU 116 7.914 -0.850 7.566
891 HA GLU 116 HA GLU 116 8.924 -3.463 7.150
892 1HB GLU 116 2HB GLU 116 9.541 -1.436 9.301
893 2HB GLU 116 1HB GLU 116 10.463 -2.909 9.022
894 1HG GLU 116 2HG GLU 116 10.126 -1.281 6.627
895 2HG GLU 116 1HG GLU 116 10.984 -0.455 7.928
896 H ARG 117 H ARG 117 7.005 -1.986 9.721
897 HA ARG 117 HA ARG 117 7.047 -4.125 11.522
898 1HB ARG 117 2HB ARG 117 4.929 -2.026 11.056
899 2HB ARG 117 1HB ARG 117 4.939 -3.133 12.424
900 1HG ARG 117 2HG ARG 117 7.156 -1.198 11.804
901 2HG ARG 117 1HG ARG 117 5.836 -0.874 12.928
902 1HD ARG 117 2HD ARG 117 6.903 -1.959 14.544
903 2HD ARG 117 1HD ARG 117 6.976 -3.414 13.553
904 HE ARG 117 HE ARG 117 9.136 -2.845 12.896
905 1HH1 ARG 117 1HH1 ARG 117 7.762 -0.358 14.928
906 2HH1 ARG 117 2HH1 ARG 117 9.286 0.397 15.246
907 1HH2 ARG 117 1HH2 ARG 117 11.137 -1.849 13.311
908 2HH2 ARG 117 2HH2 ARG 117 11.200 -0.448 14.327
909 H ALA 118 H ALA 118 5.318 -3.691 8.571
910 HA ALA 118 HA ALA 118 3.257 -5.578 9.070
911 1HB ALA 118 1HB ALA 118 3.250 -3.745 7.314
912 2HB ALA 118 2HB ALA 118 2.657 -5.325 6.803
913 3HB ALA 118 3HB ALA 118 4.281 -4.804 6.351
914 H ILE 119 H ILE 119 6.394 -5.734 7.457
915 HA ILE 119 HA ILE 119 6.147 -8.461 6.700
916 HB ILE 119 HB ILE 119 8.679 -6.854 6.975
917 1HG1 ILE 119 2HG1 ILE 119 7.398 -7.147 4.327
918 2HG1 ILE 119 1HG1 ILE 119 6.583 -6.069 5.456
919 1HG2 ILE 119 1HG2 ILE 119 9.459 -8.346 5.153
920 2HG2 ILE 119 2HG2 ILE 119 7.982 -9.291 5.357
921 3HG2 ILE 119 3HG2 ILE 119 9.146 -9.175 6.677
922 1HD1 ILE 119 1HD1 ILE 119 8.298 -4.573 5.478
923 2HD1 ILE 119 2HD1 ILE 119 8.427 -5.186 3.829
924 3HD1 ILE 119 3HD1 ILE 119 9.511 -5.791 5.084
925 H SER 120 H SER 120 7.402 -6.765 9.458
926 HA SER 120 HA SER 120 8.913 -8.851 10.597
927 1HB SER 120 2HB SER 120 9.219 -6.572 11.354
928 2HB SER 120 1HB SER 120 7.539 -6.482 11.886
929 HG SER 120 HG SER 120 9.701 -7.859 13.028
930 H HIS 121 H HIS 121 5.538 -7.880 10.981
931 HA HIS 121 HA HIS 121 4.875 -9.702 13.017
932 1HB HIS 121 2HB HIS 121 3.340 -8.095 11.029
933 2HB HIS 121 1HB HIS 121 2.498 -9.393 11.870
934 HD1 HIS 121 1HD HIS 121 3.817 -5.973 12.321
935 HD2 HIS 121 2HD HIS 121 2.276 -9.015 14.695
936 HE1 HIS 121 1HE HIS 121 3.271 -4.894 14.525
937 HE2 HIS 121 2HE HIS 121 2.270 -6.737 15.921
938 H TYR 122 H TYR 122 5.220 -10.064 9.601
939 HA TYR 122 HA TYR 122 3.833 -12.573 9.478
940 1HB TYR 122 2HB TYR 122 5.211 -10.790 7.546
941 2HB TYR 122 1HB TYR 122 5.139 -12.499 7.133
942 HD1 TYR 122 1HD TYR 122 2.577 -13.419 7.912
943 HD2 TYR 122 2HD TYR 122 3.630 -9.598 6.369
944 HE1 TYR 122 1HE TYR 122 0.281 -13.128 7.084
945 HE2 TYR 122 2HE TYR 122 1.337 -9.294 5.536
946 HH TYR 122 HH TYR 122 -0.953 -11.867 5.480
947 H GLN 123 H GLN 123 7.217 -11.554 9.030
948 HA GLN 123 HA GLN 123 9.188 -12.652 9.303
949 1HB GLN 123 2HB GLN 123 7.829 -13.077 11.581
950 2HB GLN 123 1HB GLN 123 7.996 -14.742 11.039
951 1HG GLN 123 2HG GLN 123 10.502 -13.382 10.785
952 2HG GLN 123 1HG GLN 123 9.868 -13.181 12.418
953 1HE2 GLN 123 1HE2 GLN 123 11.694 -14.467 13.068
954 2HE2 GLN 123 2HE2 GLN 123 11.612 -16.189 12.962
955 H GLU 124 H GLU 124 10.091 -15.110 9.401
956 HA GLU 124 HA GLU 124 9.220 -16.254 6.899
957 1HB GLU 124 2HB GLU 124 11.644 -16.095 8.194
958 2HB GLU 124 1HB GLU 124 11.192 -17.775 8.442
959 1HG GLU 124 2HG GLU 124 11.511 -18.314 6.292
960 2HG GLU 124 1HG GLU 124 10.818 -16.803 5.704
Start of MODEL 21
1 1H MET 1 1HT MET 1 14.436 -15.988 6.977
2 2H MET 1 2HT MET 1 13.141 -16.016 5.851
3 3H MET 1 3HT MET 1 13.833 -14.521 6.329
4 HA MET 1 HA MET 1 15.737 -14.859 5.168
5 1HB MET 1 2HB MET 1 16.324 -17.082 4.226
6 2HB MET 1 1HB MET 1 16.220 -17.083 5.981
7 1HG MET 1 2HG MET 1 13.723 -17.830 5.416
8 2HG MET 1 1HG MET 1 14.532 -18.442 3.976
9 1HE MET 1 1HE MET 1 13.450 -20.519 4.665
10 2HE MET 1 2HE MET 1 14.120 -21.691 5.799
11 3HE MET 1 3HE MET 1 14.986 -21.312 4.309
12 H GLN 2 H GLN 2 12.849 -14.338 4.556
13 HA GLN 2 HA GLN 2 12.504 -15.256 1.837
14 1HB GLN 2 2HB GLN 2 10.784 -14.403 3.844
15 2HB GLN 2 1HB GLN 2 10.752 -13.083 2.682
16 1HG GLN 2 2HG GLN 2 10.544 -15.687 1.415
17 2HG GLN 2 1HG GLN 2 9.258 -15.392 2.582
18 1HE2 GLN 2 1HE2 GLN 2 7.722 -15.292 0.930
19 2HE2 GLN 2 2HE2 GLN 2 7.589 -13.919 -0.110
20 H ARG 3 H ARG 3 12.211 -13.759 0.030
21 HA ARG 3 HA ARG 3 14.353 -11.956 -0.184
22 1HB ARG 3 2HB ARG 3 13.226 -11.264 -2.345
23 2HB ARG 3 1HB ARG 3 13.645 -12.962 -2.192
24 1HG ARG 3 2HG ARG 3 11.063 -12.820 -1.206
25 2HG ARG 3 1HG ARG 3 11.066 -11.714 -2.575
26 1HD ARG 3 2HD ARG 3 12.331 -14.382 -2.911
27 2HD ARG 3 1HD ARG 3 10.573 -14.289 -2.865
28 HE ARG 3 HE ARG 3 12.125 -12.649 -4.752
29 1HH1 ARG 3 1HH1 ARG 3 9.656 -15.056 -4.141
30 2HH1 ARG 3 2HH1 ARG 3 9.080 -15.045 -5.771
31 1HH2 ARG 3 1HH2 ARG 3 11.360 -12.657 -6.893
32 2HH2 ARG 3 2HH2 ARG 3 10.043 -13.693 -7.328
33 H GLY 4 H GLY 4 10.881 -11.323 -0.073
34 1HA GLY 4 2HA GLY 4 9.881 -9.584 1.200
35 2HA GLY 4 1HA GLY 4 11.441 -8.775 1.261
36 H ILE 5 H ILE 5 8.449 -9.046 -0.368
37 HA ILE 5 HA ILE 5 9.421 -7.226 -2.478
38 HB ILE 5 HB ILE 5 6.858 -8.765 -2.652
39 1HG1 ILE 5 2HG1 ILE 5 8.500 -10.478 -2.330
40 2HG1 ILE 5 1HG1 ILE 5 8.141 -10.417 -4.053
41 1HG2 ILE 5 1HG2 ILE 5 6.750 -8.038 -4.785
42 2HG2 ILE 5 2HG2 ILE 5 8.494 -8.132 -5.018
43 3HG2 ILE 5 3HG2 ILE 5 7.791 -6.755 -4.170
44 1HD1 ILE 5 1HD1 ILE 5 10.244 -8.684 -3.825
45 2HD1 ILE 5 2HD1 ILE 5 10.348 -10.373 -4.324
46 3HD1 ILE 5 3HD1 ILE 5 10.636 -9.929 -2.638
47 H VAL 6 H VAL 6 8.916 -5.192 -2.107
48 HA VAL 6 HA VAL 6 6.323 -4.604 -0.841
49 HB VAL 6 HB VAL 6 8.087 -3.794 0.583
50 1HG1 VAL 6 1HG1 VAL 6 9.161 -2.354 -1.841
51 2HG1 VAL 6 2HG1 VAL 6 9.878 -3.771 -1.082
52 3HG1 VAL 6 3HG1 VAL 6 9.803 -2.249 -0.208
53 1HG2 VAL 6 1HG2 VAL 6 6.056 -2.393 0.178
54 2HG2 VAL 6 2HG2 VAL 6 7.005 -1.446 -0.967
55 3HG2 VAL 6 3HG2 VAL 6 7.462 -1.489 0.733
56 H TRP 7 H TRP 7 4.872 -3.769 -2.176
57 HA TRP 7 HA TRP 7 5.844 -2.330 -4.549
58 1HB TRP 7 2HB TRP 7 3.443 -4.089 -4.125
59 2HB TRP 7 1HB TRP 7 3.512 -2.940 -5.461
60 HD1 TRP 7 HD1 TRP 7 6.914 -4.169 -4.908
61 HE1 TRP 7 1HE TRP 7 7.529 -6.000 -6.596
62 HE3 TRP 7 3HE TRP 7 2.237 -5.222 -6.685
63 HZ2 TRP 7 2HZ TRP 7 6.204 -7.689 -8.433
64 HZ3 TRP 7 3HZ TRP 7 2.000 -6.963 -8.408
65 HH2 TRP 7 HH2 TRP 7 3.942 -8.172 -9.261
66 H VAL 8 H VAL 8 4.947 -0.383 -5.110
67 HA VAL 8 HA VAL 8 3.071 0.779 -3.163
68 HB VAL 8 HB VAL 8 5.001 2.643 -4.396
69 1HG1 VAL 8 1HG1 VAL 8 3.282 2.446 -2.079
70 2HG1 VAL 8 2HG1 VAL 8 3.945 3.871 -2.872
71 3HG1 VAL 8 3HG1 VAL 8 4.893 3.019 -1.654
72 1HG2 VAL 8 1HG2 VAL 8 6.812 1.431 -3.854
73 2HG2 VAL 8 2HG2 VAL 8 5.900 0.348 -2.805
74 3HG2 VAL 8 3HG2 VAL 8 6.442 1.911 -2.199
75 H VAL 9 H VAL 9 1.459 1.990 -3.957
76 HA VAL 9 HA VAL 9 1.430 2.441 -6.868
77 HB VAL 9 HB VAL 9 -1.114 2.483 -6.538
78 1HG1 VAL 9 1HG1 VAL 9 -0.596 -0.277 -6.066
79 2HG1 VAL 9 2HG1 VAL 9 0.724 0.386 -7.027
80 3HG1 VAL 9 3HG1 VAL 9 -0.939 0.530 -7.596
81 1HG2 VAL 9 1HG2 VAL 9 -0.777 0.635 -4.269
82 2HG2 VAL 9 2HG2 VAL 9 -2.060 1.795 -4.612
83 3HG2 VAL 9 3HG2 VAL 9 -0.537 2.344 -3.922
84 H ASP 10 H ASP 10 1.852 4.511 -7.236
85 HA ASP 10 HA ASP 10 0.223 6.571 -6.083
86 1HB ASP 10 2HB ASP 10 2.195 7.796 -5.088
87 2HB ASP 10 1HB ASP 10 1.734 6.327 -4.235
88 H ASP 11 H ASP 11 2.022 8.717 -6.556
89 HA ASP 11 HA ASP 11 1.655 9.085 -9.322
90 1HB ASP 11 2HB ASP 11 3.010 10.600 -7.133
91 2HB ASP 11 1HB ASP 11 3.306 11.078 -8.801
92 H ASP 12 H ASP 12 3.927 7.195 -7.815
93 HA ASP 12 HA ASP 12 5.800 6.133 -8.544
94 1HB ASP 12 2HB ASP 12 4.322 6.544 -10.811
95 2HB ASP 12 1HB ASP 12 5.839 7.330 -11.237
96 H SER 13 H SER 13 7.652 7.179 -10.588
97 HA SER 13 HA SER 13 9.686 8.198 -10.389
98 1HB SER 13 2HB SER 13 9.451 10.492 -11.028
99 2HB SER 13 1HB SER 13 8.135 9.558 -11.746
100 HG SER 13 HG SER 13 6.740 10.641 -10.599
101 H SER 14 H SER 14 8.295 10.883 -8.702
102 HA SER 14 HA SER 14 10.326 11.132 -6.858
103 1HB SER 14 2HB SER 14 8.533 12.836 -7.430
104 2HB SER 14 1HB SER 14 7.488 11.986 -6.293
105 HG SER 14 HG SER 14 8.513 13.632 -5.195
106 H ILE 15 H ILE 15 7.058 9.871 -6.106
107 HA ILE 15 HA ILE 15 7.724 9.016 -3.524
108 HB ILE 15 HB ILE 15 5.631 7.664 -5.202
109 1HG1 ILE 15 2HG1 ILE 15 5.427 10.152 -5.407
110 2HG1 ILE 15 1HG1 ILE 15 4.047 9.389 -4.629
111 1HG2 ILE 15 1HG2 ILE 15 5.049 6.676 -3.303
112 2HG2 ILE 15 2HG2 ILE 15 4.865 8.237 -2.507
113 3HG2 ILE 15 3HG2 ILE 15 6.433 7.430 -2.515
114 1HD1 ILE 15 1HD1 ILE 15 6.131 10.295 -2.785
115 2HD1 ILE 15 2HD1 ILE 15 4.378 10.477 -2.709
116 3HD1 ILE 15 3HD1 ILE 15 5.337 11.576 -3.701
117 H ARG 16 H ARG 16 8.314 7.587 -6.617
118 HA ARG 16 HA ARG 16 8.715 4.919 -5.680
119 1HB ARG 16 2HB ARG 16 8.247 5.281 -8.034
120 2HB ARG 16 1HB ARG 16 9.682 6.284 -8.202
121 1HG ARG 16 2HG ARG 16 10.661 3.900 -7.199
122 2HG ARG 16 1HG ARG 16 9.404 3.397 -8.324
123 1HD ARG 16 2HD ARG 16 11.662 5.291 -8.964
124 2HD ARG 16 1HD ARG 16 11.625 3.582 -9.381
125 HE ARG 16 HE ARG 16 9.864 5.653 -10.506
126 1HH1 ARG 16 1HH1 ARG 16 11.275 2.454 -10.671
127 2HH1 ARG 16 2HH1 ARG 16 10.748 2.178 -12.296
128 1HH2 ARG 16 1HH2 ARG 16 9.186 5.281 -12.642
129 2HH2 ARG 16 2HH2 ARG 16 9.567 3.776 -13.412
130 H TRP 17 H TRP 17 10.964 7.531 -6.576
131 HA TRP 17 HA TRP 17 13.312 6.179 -5.924
132 1HB TRP 17 2HB TRP 17 13.166 8.338 -7.202
133 2HB TRP 17 1HB TRP 17 12.910 9.156 -5.661
134 HD1 TRP 17 HD1 TRP 17 15.585 7.002 -7.437
135 HE1 TRP 17 1HE TRP 17 17.887 7.616 -6.465
136 HE3 TRP 17 3HE TRP 17 14.090 10.258 -3.783
137 HZ2 TRP 17 2HZ TRP 17 18.933 9.257 -4.424
138 HZ3 TRP 17 3HZ TRP 17 15.808 11.302 -2.362
139 HH2 TRP 17 HH2 TRP 17 18.179 10.810 -2.679
140 H VAL 18 H VAL 18 11.166 8.109 -3.895
141 HA VAL 18 HA VAL 18 12.853 8.227 -1.656
142 HB VAL 18 HB VAL 18 9.850 8.251 -1.565
143 1HG1 VAL 18 1HG1 VAL 18 11.101 10.098 0.197
144 2HG1 VAL 18 2HG1 VAL 18 11.848 8.515 0.416
145 3HG1 VAL 18 3HG1 VAL 18 10.104 8.699 0.576
146 1HG2 VAL 18 1HG2 VAL 18 10.030 9.972 -3.000
147 2HG2 VAL 18 2HG2 VAL 18 11.744 10.217 -2.666
148 3HG2 VAL 18 3HG2 VAL 18 10.525 10.860 -1.563
149 H LEU 19 H LEU 19 10.100 6.107 -2.264
150 HA LEU 19 HA LEU 19 10.587 4.560 0.071
151 1HB LEU 19 2HB LEU 19 8.477 4.870 -1.764
152 2HB LEU 19 1HB LEU 19 8.918 3.175 -1.799
153 HG LEU 19 HG LEU 19 7.119 3.581 -0.209
154 1HD1 LEU 19 1HD1 LEU 19 7.940 1.911 0.985
155 2HD1 LEU 19 2HD1 LEU 19 9.024 3.013 1.835
156 3HD1 LEU 19 3HD1 LEU 19 9.544 2.247 0.334
157 1HD2 LEU 19 1HD2 LEU 19 9.059 5.274 1.350
158 2HD2 LEU 19 2HD2 LEU 19 7.361 4.963 1.717
159 3HD2 LEU 19 3HD2 LEU 19 7.799 5.932 0.309
160 H GLU 20 H GLU 20 11.609 4.283 -3.239
161 HA GLU 20 HA GLU 20 12.160 1.519 -3.157
162 1HB GLU 20 2HB GLU 20 13.285 1.746 -5.213
163 2HB GLU 20 1HB GLU 20 11.942 2.869 -5.254
164 1HG GLU 20 2HG GLU 20 13.526 4.690 -4.701
165 2HG GLU 20 1HG GLU 20 14.841 3.523 -4.817
166 H ARG 21 H ARG 21 14.450 4.214 -3.045
167 HA ARG 21 HA ARG 21 16.693 2.695 -2.427
168 1HB ARG 21 2HB ARG 21 16.052 5.573 -1.785
169 2HB ARG 21 1HB ARG 21 17.639 4.851 -1.551
170 1HG ARG 21 2HG ARG 21 16.708 4.322 -4.212
171 2HG ARG 21 1HG ARG 21 16.621 6.050 -3.869
172 1HD ARG 21 2HD ARG 21 19.033 4.262 -3.606
173 2HD ARG 21 1HD ARG 21 18.784 5.540 -4.796
174 HE ARG 21 HE ARG 21 18.572 6.779 -2.363
175 1HH1 ARG 21 1HH1 ARG 21 21.014 4.874 -3.973
176 2HH1 ARG 21 2HH1 ARG 21 22.332 5.672 -3.183
177 1HH2 ARG 21 1HH2 ARG 21 20.300 7.828 -1.326
178 2HH2 ARG 21 2HH2 ARG 21 21.927 7.349 -1.679
179 H ALA 22 H ALA 22 14.683 4.576 -0.142
180 HA ALA 22 HA ALA 22 15.992 3.832 2.169
181 1HB ALA 22 1HB ALA 22 13.871 5.411 1.637
182 2HB ALA 22 2HB ALA 22 14.363 4.935 3.263
183 3HB ALA 22 3HB ALA 22 13.078 4.053 2.438
184 H LEU 23 H LEU 23 13.219 2.216 0.701
185 HA LEU 23 HA LEU 23 13.186 0.145 2.645
186 1HB LEU 23 2HB LEU 23 11.715 0.761 0.208
187 2HB LEU 23 1HB LEU 23 11.986 -0.954 0.423
188 HG LEU 23 HG LEU 23 10.595 0.890 2.362
189 1HD1 LEU 23 1HD1 LEU 23 8.649 0.167 1.518
190 2HD1 LEU 23 2HD1 LEU 23 9.240 -1.482 1.311
191 3HD1 LEU 23 3HD1 LEU 23 9.603 -0.257 0.092
192 1HD2 LEU 23 1HD2 LEU 23 12.067 -1.304 3.049
193 2HD2 LEU 23 2HD2 LEU 23 10.472 -2.007 2.796
194 3HD2 LEU 23 3HD2 LEU 23 10.683 -0.692 3.953
195 H ALA 24 H ALA 24 14.881 0.668 -0.331
196 HA ALA 24 HA ALA 24 15.674 -1.986 -0.841
197 1HB ALA 24 1HB ALA 24 15.970 -0.155 -2.472
198 2HB ALA 24 2HB ALA 24 17.475 -1.023 -2.173
199 3HB ALA 24 3HB ALA 24 17.205 0.556 -1.433
200 H GLY 25 H GLY 25 16.839 0.536 1.320
201 1HA GLY 25 2HA GLY 25 19.252 -0.712 2.106
202 2HA GLY 25 1HA GLY 25 18.336 0.446 3.066
203 H ALA 26 H ALA 26 15.913 -1.246 2.922
204 HA ALA 26 HA ALA 26 16.447 -2.857 5.226
205 1HB ALA 26 1HB ALA 26 14.036 -2.012 3.729
206 2HB ALA 26 2HB ALA 26 14.366 -1.969 5.460
207 3HB ALA 26 3HB ALA 26 13.923 -3.490 4.684
208 H GLY 27 H GLY 27 16.492 -3.356 1.850
209 1HA GLY 27 2HA GLY 27 17.348 -5.312 0.865
210 2HA GLY 27 1HA GLY 27 16.912 -6.205 2.308
211 H LEU 28 H LEU 28 14.531 -4.148 0.674
212 HA LEU 28 HA LEU 28 13.253 -6.625 -0.238
213 1HB LEU 28 2HB LEU 28 11.529 -4.275 0.216
214 2HB LEU 28 1HB LEU 28 11.201 -5.975 0.476
215 HG LEU 28 HG LEU 28 12.942 -5.609 2.462
216 1HD1 LEU 28 1HD1 LEU 28 13.534 -3.442 2.450
217 2HD1 LEU 28 2HD1 LEU 28 12.048 -3.284 3.386
218 3HD1 LEU 28 3HD1 LEU 28 12.048 -2.922 1.658
219 1HD2 LEU 28 1HD2 LEU 28 11.156 -5.937 3.789
220 2HD2 LEU 28 2HD2 LEU 28 10.287 -6.093 2.261
221 3HD2 LEU 28 3HD2 LEU 28 10.283 -4.554 3.126
222 H THR 29 H THR 29 11.597 -6.279 -1.987
223 HA THR 29 HA THR 29 12.836 -4.740 -4.123
224 HB THR 29 HB THR 29 10.507 -6.675 -4.148
225 HG1 THR 29 1HG THR 29 13.248 -6.920 -4.769
226 1HG2 THR 29 1HG2 THR 29 10.196 -6.385 -6.340
227 2HG2 THR 29 2HG2 THR 29 11.912 -6.135 -6.658
228 3HG2 THR 29 3HG2 THR 29 10.922 -4.804 -6.059
229 H CYS 30 H CYS 30 12.240 -2.726 -4.484
230 HA CYS 30 HA CYS 30 9.554 -1.853 -3.653
231 1HB CYS 30 2HB CYS 30 11.796 0.016 -4.313
232 2HB CYS 30 1HB CYS 30 10.421 0.263 -3.242
233 HG CYS 30 HG CYS 30 11.638 -1.349 -1.522
234 H THR 31 H THR 31 8.165 -1.831 -5.346
235 HA THR 31 HA THR 31 9.066 -0.517 -7.815
236 HB THR 31 HB THR 31 8.838 -3.101 -7.991
237 HG1 THR 31 1HG THR 31 7.562 -2.706 -10.059
238 1HG2 THR 31 1HG2 THR 31 6.348 -2.716 -6.954
239 2HG2 THR 31 2HG2 THR 31 6.873 -4.119 -7.883
240 3HG2 THR 31 3HG2 THR 31 6.030 -2.800 -8.686
241 H THR 32 H THR 32 7.647 1.007 -8.598
242 HA THR 32 HA THR 32 5.163 1.302 -7.070
243 HB THR 32 HB THR 32 5.256 3.667 -7.428
244 HG1 THR 32 1HG THR 32 7.668 3.325 -8.855
245 1HG2 THR 32 1HG2 THR 32 6.914 4.211 -5.987
246 2HG2 THR 32 2HG2 THR 32 8.107 3.188 -6.789
247 3HG2 THR 32 3HG2 THR 32 6.887 2.464 -5.740
248 H PHE 33 H PHE 33 3.394 2.441 -8.192
249 HA PHE 33 HA PHE 33 3.266 1.814 -11.055
250 1HB PHE 33 2HB PHE 33 1.160 1.096 -9.010
251 2HB PHE 33 1HB PHE 33 1.072 0.808 -10.738
252 HD1 PHE 33 1HD PHE 33 1.574 -1.325 -11.470
253 HD2 PHE 33 2HD PHE 33 3.370 0.089 -7.891
254 HE1 PHE 33 1HE PHE 33 2.645 -3.504 -11.157
255 HE2 PHE 33 2HE PHE 33 4.462 -2.087 -7.571
256 HZ PHE 33 HZ PHE 33 4.079 -3.906 -9.211
257 H GLU 34 H GLU 34 1.128 2.736 -12.002
258 HA GLU 34 HA GLU 34 1.117 5.532 -11.589
259 1HB GLU 34 2HB GLU 34 -0.545 5.644 -13.251
260 2HB GLU 34 1HB GLU 34 0.389 4.223 -13.685
261 1HG GLU 34 2HG GLU 34 -1.818 3.518 -11.950
262 2HG GLU 34 1HG GLU 34 -2.373 4.401 -13.368
263 H ASN 35 H ASN 35 -0.768 2.913 -10.329
264 HA ASN 35 HA ASN 35 -1.628 4.215 -8.031
265 1HB ASN 35 2HB ASN 35 -3.061 5.249 -10.060
266 2HB ASN 35 1HB ASN 35 -4.044 3.827 -9.725
267 1HD2 ASN 35 1HD2 ASN 35 -5.182 6.217 -9.387
268 2HD2 ASN 35 2HD2 ASN 35 -5.376 6.583 -7.710
269 H GLY 36 H GLY 36 -3.429 2.861 -6.944
270 1HA GLY 36 2HA GLY 36 -2.652 0.287 -6.594
271 2HA GLY 36 1HA GLY 36 -4.302 0.812 -6.360
272 H ASN 37 H ASN 37 -4.651 1.446 -9.221
273 HA ASN 37 HA ASN 37 -5.761 -0.966 -10.058
274 1HB ASN 37 2HB ASN 37 -5.487 1.703 -11.099
275 2HB ASN 37 1HB ASN 37 -5.271 0.516 -12.381
276 1HD2 ASN 37 1HD2 ASN 37 -7.294 0.321 -9.493
277 2HD2 ASN 37 2HD2 ASN 37 -8.794 0.183 -10.336
278 H GLU 38 H GLU 38 -2.758 0.612 -11.181
279 HA GLU 38 HA GLU 38 -1.988 -1.270 -13.048
280 1HB GLU 38 2HB GLU 38 -0.837 0.962 -11.879
281 2HB GLU 38 1HB GLU 38 0.258 -0.338 -11.460
282 1HG GLU 38 2HG GLU 38 -0.649 -0.046 -14.280
283 2HG GLU 38 1HG GLU 38 0.604 1.017 -13.646
284 H VAL 39 H VAL 39 -1.216 -1.304 -9.536
285 HA VAL 39 HA VAL 39 0.277 -3.682 -9.606
286 HB VAL 39 HB VAL 39 -1.315 -2.481 -7.339
287 1HG1 VAL 39 1HG1 VAL 39 0.598 -4.809 -7.350
288 2HG1 VAL 39 2HG1 VAL 39 -1.092 -4.814 -6.855
289 3HG1 VAL 39 3HG1 VAL 39 0.107 -3.952 -5.891
290 1HG2 VAL 39 1HG2 VAL 39 0.828 -1.698 -6.557
291 2HG2 VAL 39 2HG2 VAL 39 0.584 -1.167 -8.221
292 3HG2 VAL 39 3HG2 VAL 39 1.644 -2.531 -7.878
293 H LEU 40 H LEU 40 -3.172 -3.144 -9.649
294 HA LEU 40 HA LEU 40 -4.061 -5.639 -8.750
295 1HB LEU 40 2HB LEU 40 -5.323 -4.057 -10.989
296 2HB LEU 40 1HB LEU 40 -6.109 -5.227 -9.949
297 HG LEU 40 HG LEU 40 -5.126 -2.489 -9.177
298 1HD1 LEU 40 1HD1 LEU 40 -7.613 -2.374 -8.496
299 2HD1 LEU 40 2HD1 LEU 40 -7.806 -3.736 -9.600
300 3HD1 LEU 40 3HD1 LEU 40 -7.182 -2.199 -10.198
301 1HD2 LEU 40 1HD2 LEU 40 -5.862 -4.836 -7.524
302 2HD2 LEU 40 2HD2 LEU 40 -6.445 -3.253 -7.010
303 3HD2 LEU 40 3HD2 LEU 40 -4.714 -3.537 -7.199
304 H ALA 41 H ALA 41 -3.166 -4.537 -11.986
305 HA ALA 41 HA ALA 41 -3.587 -7.056 -13.237
306 1HB ALA 41 1HB ALA 41 -2.671 -6.081 -15.193
307 2HB ALA 41 2HB ALA 41 -1.835 -4.841 -14.255
308 3HB ALA 41 3HB ALA 41 -3.595 -4.815 -14.383
309 H ALA 42 H ALA 42 -0.702 -5.330 -12.189
310 HA ALA 42 HA ALA 42 1.198 -7.231 -12.968
311 1HB ALA 42 1HB ALA 42 2.755 -5.984 -11.824
312 2HB ALA 42 2HB ALA 42 1.664 -5.637 -10.484
313 3HB ALA 42 3HB ALA 42 1.471 -4.793 -12.021
314 H LEU 43 H LEU 43 -0.873 -7.056 -10.168
315 HA LEU 43 HA LEU 43 0.467 -9.011 -8.620
316 1HB LEU 43 2HB LEU 43 -2.214 -7.718 -8.544
317 2HB LEU 43 1HB LEU 43 -1.949 -9.167 -7.589
318 HG LEU 43 HG LEU 43 -0.288 -6.667 -7.363
319 1HD1 LEU 43 1HD1 LEU 43 -1.489 -6.382 -5.217
320 2HD1 LEU 43 2HD1 LEU 43 -2.557 -7.708 -5.671
321 3HD1 LEU 43 3HD1 LEU 43 -2.548 -6.220 -6.619
322 1HD2 LEU 43 1HD2 LEU 43 -0.225 -9.376 -6.209
323 2HD2 LEU 43 2HD2 LEU 43 0.049 -8.039 -5.090
324 3HD2 LEU 43 3HD2 LEU 43 1.092 -8.238 -6.501
325 H ALA 44 H ALA 44 -1.771 -9.168 -11.230
326 HA ALA 44 HA ALA 44 -2.976 -11.631 -10.825
327 1HB ALA 44 1HB ALA 44 -2.172 -10.333 -13.422
328 2HB ALA 44 2HB ALA 44 -3.701 -10.128 -12.567
329 3HB ALA 44 3HB ALA 44 -3.286 -11.691 -13.270
330 H SER 45 H SER 45 0.310 -10.958 -11.560
331 HA SER 45 HA SER 45 0.774 -13.800 -12.038
332 1HB SER 45 2HB SER 45 1.418 -11.619 -13.736
333 2HB SER 45 1HB SER 45 2.931 -12.284 -13.125
334 HG SER 45 HG SER 45 2.534 -13.563 -14.805
335 H LYS 46 H LYS 46 1.153 -11.481 -9.791
336 HA LYS 46 HA LYS 46 3.166 -12.941 -8.402
337 1HB LYS 46 2HB LYS 46 4.153 -10.992 -10.097
338 2HB LYS 46 1HB LYS 46 4.081 -10.174 -8.543
339 1HG LYS 46 2HG LYS 46 5.197 -12.695 -8.035
340 2HG LYS 46 1HG LYS 46 5.980 -12.092 -9.497
341 1HD LYS 46 2HD LYS 46 5.960 -9.870 -7.903
342 2HD LYS 46 1HD LYS 46 6.189 -11.164 -6.726
343 1HE LYS 46 2HE LYS 46 8.279 -11.578 -7.421
344 2HE LYS 46 1HE LYS 46 7.835 -11.455 -9.122
345 1HZ LYS 46 1HZ LYS 46 9.371 -9.724 -8.598
346 2HZ LYS 46 2HZ LYS 46 8.449 -9.213 -7.276
347 3HZ LYS 46 3HZ LYS 46 7.858 -9.010 -8.849
348 H THR 47 H THR 47 3.442 -12.201 -6.210
349 HA THR 47 HA THR 47 1.547 -10.182 -5.338
350 HB THR 47 HB THR 47 1.705 -12.963 -4.177
351 HG1 THR 47 1HG THR 47 0.174 -13.343 -5.536
352 1HG2 THR 47 1HG2 THR 47 -0.280 -10.868 -3.390
353 2HG2 THR 47 2HG2 THR 47 1.254 -11.059 -2.537
354 3HG2 THR 47 3HG2 THR 47 0.100 -12.392 -2.592
355 HA PRO 48 HA PRO 48 5.275 -9.353 -2.956
356 1HB PRO 48 2HB PRO 48 4.699 -6.831 -2.267
357 2HB PRO 48 1HB PRO 48 5.202 -7.233 -3.914
358 1HG PRO 48 2HG PRO 48 2.457 -6.748 -2.830
359 2HG PRO 48 1HG PRO 48 3.175 -6.184 -4.351
360 1HD PRO 48 2HD PRO 48 1.512 -8.354 -4.159
361 2HD PRO 48 1HD PRO 48 2.728 -8.157 -5.434
362 H ASP 49 H ASP 49 5.657 -8.744 -0.679
363 HA ASP 49 HA ASP 49 3.706 -9.972 0.999
364 1HB ASP 49 2HB ASP 49 5.295 -9.579 2.799
365 2HB ASP 49 1HB ASP 49 6.135 -10.198 1.381
366 H VAL 50 H VAL 50 5.126 -6.692 1.029
367 HA VAL 50 HA VAL 50 2.738 -5.736 2.440
368 HB VAL 50 HB VAL 50 4.886 -5.270 3.514
369 1HG1 VAL 50 1HG1 VAL 50 6.311 -3.459 2.349
370 2HG1 VAL 50 2HG1 VAL 50 5.513 -4.018 0.877
371 3HG1 VAL 50 3HG1 VAL 50 6.472 -5.141 1.840
372 1HG2 VAL 50 1HG2 VAL 50 4.368 -3.138 4.174
373 2HG2 VAL 50 2HG2 VAL 50 2.851 -3.625 3.426
374 3HG2 VAL 50 3HG2 VAL 50 3.980 -2.603 2.538
375 H LEU 51 H LEU 51 1.966 -3.497 1.798
376 HA LEU 51 HA LEU 51 2.497 -2.701 -0.931
377 1HB LEU 51 2HB LEU 51 0.715 -4.566 -0.900
378 2HB LEU 51 1HB LEU 51 -0.343 -3.361 -0.197
379 HG LEU 51 HG LEU 51 -0.132 -1.973 -2.204
380 1HD1 LEU 51 1HD1 LEU 51 2.222 -2.995 -2.693
381 2HD1 LEU 51 2HD1 LEU 51 1.193 -2.457 -4.018
382 3HD1 LEU 51 3HD1 LEU 51 1.297 -4.172 -3.622
383 1HD2 LEU 51 1HD2 LEU 51 -1.361 -4.549 -2.056
384 2HD2 LEU 51 2HD2 LEU 51 -0.838 -4.250 -3.714
385 3HD2 LEU 51 3HD2 LEU 51 -1.909 -3.104 -2.907
386 H LEU 52 H LEU 52 1.969 -0.562 -1.353
387 HA LEU 52 HA LEU 52 0.659 0.925 0.828
388 1HB LEU 52 2HB LEU 52 3.375 1.147 -0.060
389 2HB LEU 52 1HB LEU 52 2.531 2.635 -0.444
390 HG LEU 52 HG LEU 52 2.144 1.596 2.293
391 1HD1 LEU 52 1HD1 LEU 52 4.744 2.838 1.414
392 2HD1 LEU 52 2HD1 LEU 52 4.524 1.173 1.958
393 3HD1 LEU 52 3HD1 LEU 52 4.260 2.509 3.078
394 1HD2 LEU 52 1HD2 LEU 52 2.281 3.977 2.826
395 2HD2 LEU 52 2HD2 LEU 52 1.114 3.677 1.540
396 3HD2 LEU 52 3HD2 LEU 52 2.703 4.329 1.150
397 H SER 53 H SER 53 -0.687 2.600 0.216
398 HA SER 53 HA SER 53 -0.958 3.087 -2.666
399 1HB SER 53 2HB SER 53 -3.016 2.211 -0.717
400 2HB SER 53 1HB SER 53 -3.514 3.329 -1.984
401 HG SER 53 HG SER 53 -3.640 0.973 -2.424
402 H ASP 54 H ASP 54 -1.271 5.134 -3.305
403 HA ASP 54 HA ASP 54 -0.781 7.205 -1.399
404 1HB ASP 54 2HB ASP 54 -0.744 8.699 -3.325
405 2HB ASP 54 1HB ASP 54 0.209 7.254 -3.641
406 H ILE 55 H ILE 55 -3.632 5.839 -2.713
407 HA ILE 55 HA ILE 55 -5.831 6.483 -2.747
408 HB ILE 55 HB ILE 55 -5.631 5.975 -0.419
409 1HG1 ILE 55 2HG1 ILE 55 -7.000 8.465 0.144
410 2HG1 ILE 55 1HG1 ILE 55 -7.503 7.798 -1.403
411 1HG2 ILE 55 1HG2 ILE 55 -5.060 7.733 1.246
412 2HG2 ILE 55 2HG2 ILE 55 -4.525 8.748 -0.085
413 3HG2 ILE 55 3HG2 ILE 55 -3.717 7.213 0.235
414 1HD1 ILE 55 1HD1 ILE 55 -7.481 5.624 0.330
415 2HD1 ILE 55 2HD1 ILE 55 -8.895 6.493 -0.266
416 3HD1 ILE 55 3HD1 ILE 55 -8.163 6.952 1.269
417 H ARG 56 H ARG 56 -5.917 7.911 -4.494
418 HA ARG 56 HA ARG 56 -6.081 10.750 -3.742
419 1HB ARG 56 2HB ARG 56 -3.988 9.785 -5.171
420 2HB ARG 56 1HB ARG 56 -5.097 10.212 -6.467
421 1HG ARG 56 2HG ARG 56 -3.841 12.132 -6.191
422 2HG ARG 56 1HG ARG 56 -5.297 12.475 -5.256
423 1HD ARG 56 2HD ARG 56 -4.198 12.444 -3.282
424 2HD ARG 56 1HD ARG 56 -3.110 11.153 -3.789
425 HE ARG 56 HE ARG 56 -2.588 13.941 -3.864
426 1HH1 ARG 56 1HH1 ARG 56 -1.994 10.975 -5.609
427 2HH1 ARG 56 2HH1 ARG 56 -0.518 11.540 -6.315
428 1HH2 ARG 56 1HH2 ARG 56 -0.649 14.685 -4.793
429 2HH2 ARG 56 2HH2 ARG 56 0.248 13.648 -5.852
430 H MET 57 H MET 57 -8.348 9.308 -3.847
431 HA MET 57 HA MET 57 -10.422 9.204 -4.751
432 1HB MET 57 2HB MET 57 -9.978 11.692 -4.733
433 2HB MET 57 1HB MET 57 -9.614 11.552 -6.449
434 1HG MET 57 2HG MET 57 -11.982 10.333 -6.428
435 2HG MET 57 1HG MET 57 -12.202 11.388 -5.035
436 1HE MET 57 1HE MET 57 -14.252 12.509 -6.243
437 2HE MET 57 2HE MET 57 -13.872 14.109 -6.882
438 3HE MET 57 3HE MET 57 -13.267 13.625 -5.296
439 HA PRO 58 HA PRO 58 -8.791 7.350 -8.806
440 1HB PRO 58 2HB PRO 58 -8.868 4.736 -8.044
441 2HB PRO 58 1HB PRO 58 -7.430 5.750 -7.882
442 1HG PRO 58 2HG PRO 58 -9.446 4.975 -5.813
443 2HG PRO 58 1HG PRO 58 -7.684 5.110 -5.671
444 1HD PRO 58 2HD PRO 58 -9.409 7.014 -4.785
445 2HD PRO 58 1HD PRO 58 -7.766 7.376 -5.335
446 H GLY 59 H GLY 59 -10.746 5.001 -7.009
447 1HA GLY 59 2HA GLY 59 -12.930 5.450 -8.940
448 2HA GLY 59 1HA GLY 59 -12.561 3.897 -8.202
449 H MET 60 H MET 60 -12.062 5.433 -5.615
450 HA MET 60 HA MET 60 -14.625 6.468 -4.857
451 1HB MET 60 2HB MET 60 -14.867 3.916 -4.818
452 2HB MET 60 1HB MET 60 -13.765 3.948 -3.449
453 1HG MET 60 2HG MET 60 -15.609 4.105 -2.218
454 2HG MET 60 1HG MET 60 -15.598 5.802 -2.700
455 1HE MET 60 1HE MET 60 -17.579 3.323 -1.855
456 2HE MET 60 2HE MET 60 -17.730 2.303 -3.287
457 3HE MET 60 3HE MET 60 -19.051 3.374 -2.824
458 H ASP 61 H ASP 61 -12.758 8.033 -4.648
459 HA ASP 61 HA ASP 61 -11.589 9.422 -3.292
460 1HB ASP 61 2HB ASP 61 -13.228 7.867 -1.476
461 2HB ASP 61 1HB ASP 61 -11.730 8.406 -0.723
462 H GLY 62 H GLY 62 -11.005 6.017 -3.163
463 1HA GLY 62 2HA GLY 62 -8.487 5.707 -3.659
464 2HA GLY 62 1HA GLY 62 -8.322 6.420 -2.072
465 H LEU 63 H LEU 63 -10.741 5.155 -1.063
466 HA LEU 63 HA LEU 63 -9.578 2.750 -0.139
467 1HB LEU 63 2HB LEU 63 -12.502 3.446 0.041
468 2HB LEU 63 1HB LEU 63 -11.582 2.389 1.096
469 HG LEU 63 HG LEU 63 -10.225 4.659 1.507
470 1HD1 LEU 63 1HD1 LEU 63 -12.165 5.650 -0.082
471 2HD1 LEU 63 2HD1 LEU 63 -11.327 6.581 1.158
472 3HD1 LEU 63 3HD1 LEU 63 -12.900 5.864 1.505
473 1HD2 LEU 63 1HD2 LEU 63 -12.715 4.559 3.056
474 2HD2 LEU 63 2HD2 LEU 63 -11.036 4.497 3.590
475 3HD2 LEU 63 3HD2 LEU 63 -11.819 3.047 2.968
476 H ALA 64 H ALA 64 -11.656 3.588 -2.796
477 HA ALA 64 HA ALA 64 -12.796 1.121 -3.426
478 1HB ALA 64 1HB ALA 64 -12.051 2.271 -5.873
479 2HB ALA 64 2HB ALA 64 -12.321 3.622 -4.771
480 3HB ALA 64 3HB ALA 64 -13.598 2.433 -5.041
481 H LEU 65 H LEU 65 -9.554 2.288 -3.719
482 HA LEU 65 HA LEU 65 -8.394 0.612 -5.573
483 1HB LEU 65 2HB LEU 65 -7.422 2.522 -4.090
484 2HB LEU 65 1HB LEU 65 -7.054 1.228 -2.964
485 HG LEU 65 HG LEU 65 -6.115 1.165 -5.813
486 1HD1 LEU 65 1HD1 LEU 65 -3.912 1.834 -4.418
487 2HD1 LEU 65 2HD1 LEU 65 -5.131 2.759 -3.545
488 3HD1 LEU 65 3HD1 LEU 65 -4.917 2.994 -5.280
489 1HD2 LEU 65 1HD2 LEU 65 -5.258 -0.234 -3.284
490 2HD2 LEU 65 2HD2 LEU 65 -4.402 -0.337 -4.821
491 3HD2 LEU 65 3HD2 LEU 65 -6.046 -0.957 -4.684
492 H LEU 66 H LEU 66 -8.590 0.125 -2.081
493 HA LEU 66 HA LEU 66 -7.562 -2.445 -1.956
494 1HB LEU 66 2HB LEU 66 -9.682 -1.231 -0.192
495 2HB LEU 66 1HB LEU 66 -8.609 -2.555 0.233
496 HG LEU 66 HG LEU 66 -7.243 -0.084 -0.610
497 1HD1 LEU 66 1HD1 LEU 66 -9.380 0.135 1.240
498 2HD1 LEU 66 2HD1 LEU 66 -8.207 1.358 0.753
499 3HD1 LEU 66 3HD1 LEU 66 -7.864 0.309 2.128
500 1HD2 LEU 66 1HD2 LEU 66 -6.883 -1.760 1.856
501 2HD2 LEU 66 2HD2 LEU 66 -5.720 -0.669 1.107
502 3HD2 LEU 66 3HD2 LEU 66 -6.174 -2.168 0.296
503 H LYS 67 H LYS 67 -10.893 -1.355 -2.471
504 HA LYS 67 HA LYS 67 -12.293 -3.709 -2.283
505 1HB LYS 67 2HB LYS 67 -13.046 -1.291 -2.972
506 2HB LYS 67 1HB LYS 67 -12.837 -1.899 -4.608
507 1HG LYS 67 2HG LYS 67 -14.514 -3.382 -2.620
508 2HG LYS 67 1HG LYS 67 -15.166 -2.018 -3.527
509 1HD LYS 67 2HD LYS 67 -13.743 -3.967 -5.182
510 2HD LYS 67 1HD LYS 67 -15.157 -4.625 -4.365
511 1HE LYS 67 2HE LYS 67 -15.896 -3.819 -6.464
512 2HE LYS 67 1HE LYS 67 -16.457 -2.670 -5.250
513 1HZ LYS 67 1HZ LYS 67 -15.202 -1.046 -6.102
514 2HZ LYS 67 2HZ LYS 67 -15.128 -2.009 -7.490
515 3HZ LYS 67 3HZ LYS 67 -13.867 -2.053 -6.364
516 H GLN 68 H GLN 68 -10.559 -2.531 -5.173
517 HA GLN 68 HA GLN 68 -11.150 -4.816 -6.744
518 1HB GLN 68 2HB GLN 68 -8.781 -2.994 -7.123
519 2HB GLN 68 1HB GLN 68 -9.603 -3.953 -8.344
520 1HG GLN 68 2HG GLN 68 -11.030 -1.775 -6.880
521 2HG GLN 68 1HG GLN 68 -10.002 -1.427 -8.269
522 1HE2 GLN 68 1HE2 GLN 68 -12.647 -3.572 -7.280
523 2HE2 GLN 68 2HE2 GLN 68 -13.472 -3.539 -8.798
524 H ILE 69 H ILE 69 -8.595 -3.987 -4.523
525 HA ILE 69 HA ILE 69 -6.712 -5.913 -5.242
526 HB ILE 69 HB ILE 69 -7.249 -4.635 -2.567
527 1HG1 ILE 69 2HG1 ILE 69 -5.179 -4.056 -4.696
528 2HG1 ILE 69 1HG1 ILE 69 -6.637 -3.111 -4.417
529 1HG2 ILE 69 1HG2 ILE 69 -5.309 -5.515 -1.687
530 2HG2 ILE 69 2HG2 ILE 69 -4.621 -5.863 -3.272
531 3HG2 ILE 69 3HG2 ILE 69 -5.908 -6.879 -2.628
532 1HD1 ILE 69 1HD1 ILE 69 -4.242 -2.491 -3.399
533 2HD1 ILE 69 2HD1 ILE 69 -4.876 -3.490 -2.090
534 3HD1 ILE 69 3HD1 ILE 69 -5.768 -2.065 -2.624
535 H LYS 70 H LYS 70 -9.435 -6.100 -3.042
536 HA LYS 70 HA LYS 70 -8.830 -8.730 -2.141
537 1HB LYS 70 2HB LYS 70 -10.937 -8.661 -0.990
538 2HB LYS 70 1HB LYS 70 -10.155 -7.097 -0.818
539 1HG LYS 70 2HG LYS 70 -11.979 -6.119 -1.594
540 2HG LYS 70 1HG LYS 70 -11.755 -6.959 -3.129
541 1HD LYS 70 2HD LYS 70 -13.315 -8.538 -2.655
542 2HD LYS 70 1HD LYS 70 -12.972 -8.512 -0.924
543 1HE LYS 70 2HE LYS 70 -14.984 -7.478 -0.852
544 2HE LYS 70 1HE LYS 70 -13.999 -6.057 -1.196
545 1HZ LYS 70 1HZ LYS 70 -16.039 -7.238 -2.769
546 2HZ LYS 70 2HZ LYS 70 -14.593 -7.181 -3.646
547 3HZ LYS 70 3HZ LYS 70 -15.239 -5.764 -2.987
548 H GLN 71 H GLN 71 -10.635 -7.411 -4.781
549 HA GLN 71 HA GLN 71 -12.166 -9.728 -5.330
550 1HB GLN 71 2HB GLN 71 -13.192 -7.926 -6.256
551 2HB GLN 71 1HB GLN 71 -11.682 -7.112 -6.605
552 1HG GLN 71 2HG GLN 71 -11.800 -9.339 -8.327
553 2HG GLN 71 1HG GLN 71 -13.395 -8.596 -8.345
554 1HE2 GLN 71 1HE2 GLN 71 -10.323 -6.949 -7.830
555 2HE2 GLN 71 2HE2 GLN 71 -10.394 -5.989 -9.265
556 H ARG 72 H ARG 72 -9.132 -8.494 -6.592
557 HA ARG 72 HA ARG 72 -8.862 -10.838 -8.304
558 1HB ARG 72 2HB ARG 72 -7.180 -8.349 -8.060
559 2HB ARG 72 1HB ARG 72 -6.810 -9.681 -9.148
560 1HG ARG 72 2HG ARG 72 -9.527 -8.862 -9.525
561 2HG ARG 72 1HG ARG 72 -8.463 -7.458 -9.625
562 1HD ARG 72 2HD ARG 72 -7.651 -8.100 -11.601
563 2HD ARG 72 1HD ARG 72 -7.382 -9.746 -11.037
564 HE ARG 72 HE ARG 72 -10.007 -8.793 -11.985
565 1HH1 ARG 72 1HH1 ARG 72 -7.484 -11.216 -11.908
566 2HH1 ARG 72 2HH1 ARG 72 -8.362 -12.331 -12.894
567 1HH2 ARG 72 1HH2 ARG 72 -11.150 -10.265 -13.282
568 2HH2 ARG 72 2HH2 ARG 72 -10.437 -11.795 -13.675
569 H HIS 73 H HIS 73 -7.599 -9.559 -5.348
570 HA HIS 73 HA HIS 73 -5.800 -11.886 -5.171
571 1HB HIS 73 2HB HIS 73 -5.108 -9.515 -3.539
572 2HB HIS 73 1HB HIS 73 -4.064 -10.622 -4.429
573 HD1 HIS 73 1HD HIS 73 -4.259 -10.250 -7.188
574 HD2 HIS 73 2HD HIS 73 -5.275 -7.091 -4.701
575 HE1 HIS 73 1HE HIS 73 -4.130 -8.194 -8.630
576 HE2 HIS 73 2HE HIS 73 -4.668 -6.284 -7.079
577 HA PRO 74 HA PRO 74 -7.639 -12.993 -1.357
578 1HB PRO 74 2HB PRO 74 -5.535 -13.506 0.310
579 2HB PRO 74 1HB PRO 74 -6.049 -14.584 -0.991
580 1HG PRO 74 2HG PRO 74 -3.778 -12.662 -0.907
581 2HG PRO 74 1HG PRO 74 -3.881 -14.251 -1.681
582 1HD PRO 74 2HD PRO 74 -4.086 -11.874 -3.024
583 2HD PRO 74 1HD PRO 74 -4.804 -13.394 -3.588
584 H MET 75 H MET 75 -4.841 -11.573 0.275
585 HA MET 75 HA MET 75 -6.422 -9.283 1.125
586 1HB MET 75 2HB MET 75 -5.451 -11.455 2.962
587 2HB MET 75 1HB MET 75 -5.714 -9.817 3.547
588 1HG MET 75 2HG MET 75 -7.978 -9.959 3.355
589 2HG MET 75 1HG MET 75 -7.906 -11.122 2.034
590 1HE MET 75 1HE MET 75 -8.441 -14.411 3.604
591 2HE MET 75 2HE MET 75 -7.389 -13.717 2.370
592 3HE MET 75 3HE MET 75 -9.083 -13.234 2.458
593 H LEU 76 H LEU 76 -4.417 -8.904 -0.512
594 HA LEU 76 HA LEU 76 -1.818 -8.772 0.488
595 1HB LEU 76 2HB LEU 76 -2.854 -8.298 -1.889
596 2HB LEU 76 1HB LEU 76 -2.803 -6.630 -1.337
597 HG LEU 76 HG LEU 76 -0.812 -6.894 -2.516
598 1HD1 LEU 76 1HD1 LEU 76 -0.580 -6.069 -0.102
599 2HD1 LEU 76 2HD1 LEU 76 0.888 -6.565 -0.946
600 3HD1 LEU 76 3HD1 LEU 76 0.136 -7.645 0.225
601 1HD2 LEU 76 1HD2 LEU 76 0.190 -8.852 -2.905
602 2HD2 LEU 76 2HD2 LEU 76 -1.243 -9.556 -2.155
603 3HD2 LEU 76 3HD2 LEU 76 0.215 -9.289 -1.195
604 HA PRO 77 HA PRO 77 -2.549 -5.679 3.719
605 1HB PRO 77 2HB PRO 77 0.409 -5.885 3.893
606 2HB PRO 77 1HB PRO 77 -0.806 -6.020 5.169
607 1HG PRO 77 2HG PRO 77 0.445 -8.184 4.264
608 2HG PRO 77 1HG PRO 77 -1.284 -8.235 4.659
609 1HD PRO 77 2HD PRO 77 0.046 -8.059 1.984
610 2HD PRO 77 1HD PRO 77 -1.375 -9.006 2.473
611 H VAL 78 H VAL 78 -2.932 -3.702 3.009
612 HA VAL 78 HA VAL 78 -0.852 -2.246 1.544
613 HB VAL 78 HB VAL 78 -3.782 -1.569 1.428
614 1HG1 VAL 78 1HG1 VAL 78 -1.970 -1.033 -0.828
615 2HG1 VAL 78 2HG1 VAL 78 -1.640 -0.127 0.648
616 3HG1 VAL 78 3HG1 VAL 78 -3.226 -0.023 -0.113
617 1HG2 VAL 78 1HG2 VAL 78 -3.668 -3.813 0.610
618 2HG2 VAL 78 2HG2 VAL 78 -2.251 -3.441 -0.369
619 3HG2 VAL 78 3HG2 VAL 78 -3.811 -2.733 -0.774
620 H ILE 79 H ILE 79 -0.428 -0.120 2.131
621 HA ILE 79 HA ILE 79 -1.641 0.781 4.665
622 HB ILE 79 HB ILE 79 1.126 1.520 3.715
623 1HG1 ILE 79 2HG1 ILE 79 1.278 -0.222 5.948
624 2HG1 ILE 79 1HG1 ILE 79 0.232 -1.001 4.766
625 1HG2 ILE 79 1HG2 ILE 79 1.139 2.894 5.450
626 2HG2 ILE 79 2HG2 ILE 79 0.783 1.554 6.543
627 3HG2 ILE 79 3HG2 ILE 79 -0.536 2.457 5.792
628 1HD1 ILE 79 1HD1 ILE 79 2.002 -0.722 3.072
629 2HD1 ILE 79 2HD1 ILE 79 2.501 -1.711 4.441
630 3HD1 ILE 79 3HD1 ILE 79 3.046 -0.040 4.316
631 H ILE 80 H ILE 80 -3.002 2.419 4.261
632 HA ILE 80 HA ILE 80 -2.578 4.111 1.924
633 HB ILE 80 HB ILE 80 -4.910 4.251 3.818
634 1HG1 ILE 80 2HG1 ILE 80 -4.698 1.932 3.053
635 2HG1 ILE 80 1HG1 ILE 80 -6.081 2.704 2.295
636 1HG2 ILE 80 1HG2 ILE 80 -6.055 5.062 1.746
637 2HG2 ILE 80 2HG2 ILE 80 -4.481 5.075 0.955
638 3HG2 ILE 80 3HG2 ILE 80 -4.777 6.116 2.343
639 1HD1 ILE 80 1HD1 ILE 80 -3.953 1.374 1.061
640 2HD1 ILE 80 2HD1 ILE 80 -3.808 3.081 0.645
641 3HD1 ILE 80 3HD1 ILE 80 -5.305 2.214 0.303
642 H MET 81 H MET 81 -1.911 6.148 1.970
643 HA MET 81 HA MET 81 -0.942 7.315 4.382
644 1HB MET 81 2HB MET 81 -0.565 9.330 2.826
645 2HB MET 81 1HB MET 81 0.344 7.862 2.517
646 1HG MET 81 2HG MET 81 -1.216 7.284 0.730
647 2HG MET 81 1HG MET 81 -2.137 8.751 1.060
648 1HE MET 81 1HE MET 81 -1.229 11.025 1.017
649 2HE MET 81 2HE MET 81 -1.617 10.913 -0.701
650 3HE MET 81 3HE MET 81 -0.076 11.602 -0.188
651 H THR 82 H THR 82 -3.845 7.674 2.509
652 HA THR 82 HA THR 82 -4.877 9.551 4.519
653 HB THR 82 HB THR 82 -5.500 9.839 1.582
654 HG1 THR 82 1HG THR 82 -3.983 11.547 1.603
655 1HG2 THR 82 1HG2 THR 82 -7.108 10.956 2.919
656 2HG2 THR 82 2HG2 THR 82 -6.018 12.177 2.264
657 3HG2 THR 82 3HG2 THR 82 -5.857 11.661 3.943
658 H ALA 83 H ALA 83 -6.964 9.204 5.154
659 HA ALA 83 HA ALA 83 -8.224 6.779 4.165
660 1HB ALA 83 1HB ALA 83 -8.123 6.902 6.523
661 2HB ALA 83 2HB ALA 83 -9.809 7.168 6.080
662 3HB ALA 83 3HB ALA 83 -8.791 8.535 6.536
663 H HIS 84 H HIS 84 -8.664 10.212 4.010
664 HA HIS 84 HA HIS 84 -10.301 11.537 3.124
665 1HB HIS 84 2HB HIS 84 -9.860 9.297 1.196
666 2HB HIS 84 1HB HIS 84 -11.091 10.499 0.835
667 HD1 HIS 84 1HD HIS 84 -9.155 12.784 2.243
668 HD2 HIS 84 2HD HIS 84 -8.345 10.293 -0.980
669 HE1 HIS 84 1HE HIS 84 -7.335 13.933 0.948
670 HE2 HIS 84 2HE HIS 84 -6.945 12.465 -1.062
671 H SER 85 H SER 85 -12.594 10.818 1.554
672 HA SER 85 HA SER 85 -14.391 10.152 3.703
673 1HB SER 85 2HB SER 85 -14.726 11.899 1.795
674 2HB SER 85 1HB SER 85 -15.265 10.507 0.854
675 HG SER 85 HG SER 85 -16.963 10.245 2.182
676 H ASP 86 H ASP 86 -16.190 8.605 3.358
677 HA ASP 86 HA ASP 86 -17.031 6.537 2.912
678 1HB ASP 86 2HB ASP 86 -15.605 7.193 0.535
679 2HB ASP 86 1HB ASP 86 -15.264 5.507 0.913
680 H LEU 87 H LEU 87 -14.904 7.049 4.798
681 HA LEU 87 HA LEU 87 -12.823 5.305 4.925
682 1HB LEU 87 2HB LEU 87 -14.296 6.896 6.761
683 2HB LEU 87 1HB LEU 87 -14.009 5.338 7.510
684 HG LEU 87 HG LEU 87 -11.879 7.156 6.381
685 1HD1 LEU 87 1HD1 LEU 87 -13.157 7.744 8.574
686 2HD1 LEU 87 2HD1 LEU 87 -11.397 7.842 8.526
687 3HD1 LEU 87 3HD1 LEU 87 -12.184 6.446 9.263
688 1HD2 LEU 87 1HD2 LEU 87 -10.705 5.253 6.258
689 2HD2 LEU 87 2HD2 LEU 87 -11.881 4.355 7.218
690 3HD2 LEU 87 3HD2 LEU 87 -10.655 5.339 8.020
691 H ASP 88 H ASP 88 -16.160 4.448 5.061
692 HA ASP 88 HA ASP 88 -16.222 2.140 6.531
693 1HB ASP 88 2HB ASP 88 -17.627 2.900 3.983
694 2HB ASP 88 1HB ASP 88 -17.900 1.328 4.729
695 H ALA 89 H ALA 89 -15.116 2.495 3.172
696 HA ALA 89 HA ALA 89 -14.587 -0.251 2.759
697 1HB ALA 89 1HB ALA 89 -13.165 0.592 0.843
698 2HB ALA 89 2HB ALA 89 -13.607 2.222 1.356
699 3HB ALA 89 3HB ALA 89 -14.857 1.097 0.830
700 H ALA 90 H ALA 90 -12.900 2.210 4.443
701 HA ALA 90 HA ALA 90 -10.260 1.293 4.194
702 1HB ALA 90 1HB ALA 90 -11.231 3.481 5.254
703 2HB ALA 90 2HB ALA 90 -9.706 2.809 5.828
704 3HB ALA 90 3HB ALA 90 -11.189 2.535 6.741
705 H VAL 91 H VAL 91 -12.707 0.619 6.708
706 HA VAL 91 HA VAL 91 -11.056 -1.212 8.101
707 HB VAL 91 HB VAL 91 -14.060 -1.273 8.190
708 1HG1 VAL 91 1HG1 VAL 91 -11.822 -2.381 9.747
709 2HG1 VAL 91 2HG1 VAL 91 -13.478 -2.966 9.559
710 3HG1 VAL 91 3HG1 VAL 91 -13.125 -1.673 10.707
711 1HG2 VAL 91 1HG2 VAL 91 -14.181 0.687 9.272
712 2HG2 VAL 91 2HG2 VAL 91 -12.569 1.013 8.637
713 3HG2 VAL 91 3HG2 VAL 91 -12.758 0.328 10.248
714 H SER 92 H SER 92 -13.635 -1.632 5.701
715 HA SER 92 HA SER 92 -13.566 -4.445 5.658
716 1HB SER 92 2HB SER 92 -14.239 -2.677 3.298
717 2HB SER 92 1HB SER 92 -14.795 -4.324 3.603
718 HG SER 92 HG SER 92 -16.454 -3.179 4.335
719 H ALA 93 H ALA 93 -11.303 -2.147 4.662
720 HA ALA 93 HA ALA 93 -10.103 -3.580 2.524
721 1HB ALA 93 1HB ALA 93 -9.984 -1.046 3.185
722 2HB ALA 93 2HB ALA 93 -8.643 -1.836 2.365
723 3HB ALA 93 3HB ALA 93 -8.591 -1.594 4.112
724 H TYR 94 H TYR 94 -9.157 -2.945 5.859
725 HA TYR 94 HA TYR 94 -6.822 -4.439 5.923
726 1HB TYR 94 2HB TYR 94 -8.598 -4.346 8.336
727 2HB TYR 94 1HB TYR 94 -6.845 -4.251 8.249
728 HD1 TYR 94 1HD TYR 94 -6.141 -2.111 6.631
729 HD2 TYR 94 2HD TYR 94 -9.581 -2.418 9.118
730 HE1 TYR 94 1HE TYR 94 -6.252 0.334 6.768
731 HE2 TYR 94 2HE TYR 94 -9.697 0.032 9.261
732 HH TYR 94 HH TYR 94 -8.522 1.961 8.901
733 H GLN 95 H GLN 95 -10.119 -5.427 6.306
734 HA GLN 95 HA GLN 95 -9.518 -8.083 7.195
735 1HB GLN 95 2HB GLN 95 -11.887 -8.515 6.925
736 2HB GLN 95 1HB GLN 95 -11.667 -6.939 7.676
737 1HG GLN 95 2HG GLN 95 -13.198 -6.327 6.152
738 2HG GLN 95 1HG GLN 95 -11.773 -6.181 5.131
739 1HE2 GLN 95 1HE2 GLN 95 -13.947 -6.431 3.756
740 2HE2 GLN 95 2HE2 GLN 95 -14.174 -8.032 3.138
741 H GLN 96 H GLN 96 -10.082 -6.526 4.127
742 HA GLN 96 HA GLN 96 -9.893 -9.064 2.731
743 1HB GLN 96 2HB GLN 96 -10.823 -7.970 0.846
744 2HB GLN 96 1HB GLN 96 -11.741 -7.434 2.244
745 1HG GLN 96 2HG GLN 96 -10.167 -5.426 2.281
746 2HG GLN 96 1HG GLN 96 -9.711 -5.918 0.652
747 1HE2 GLN 96 1HE2 GLN 96 -10.541 -3.933 -0.110
748 2HE2 GLN 96 2HE2 GLN 96 -12.242 -3.698 -0.312
749 H GLY 97 H GLY 97 -7.650 -7.161 3.930
750 1HA GLY 97 2HA GLY 97 -5.373 -7.677 3.099
751 2HA GLY 97 1HA GLY 97 -5.972 -7.287 1.497
752 H ALA 98 H ALA 98 -5.295 -5.905 4.690
753 HA ALA 98 HA ALA 98 -4.047 -3.641 3.566
754 1HB ALA 98 1HB ALA 98 -5.914 -2.501 3.094
755 2HB ALA 98 2HB ALA 98 -5.800 -2.069 4.795
756 3HB ALA 98 3HB ALA 98 -6.875 -3.363 4.284
757 H PHE 99 H PHE 99 -2.683 -2.733 4.973
758 HA PHE 99 HA PHE 99 -2.433 -3.923 7.544
759 1HB PHE 99 2HB PHE 99 -0.550 -3.085 5.994
760 2HB PHE 99 1HB PHE 99 -0.913 -1.491 6.654
761 HD1 PHE 99 1HD PHE 99 -0.913 -4.789 8.365
762 HD2 PHE 99 2HD PHE 99 0.926 -0.976 7.963
763 HE1 PHE 99 1HE PHE 99 0.489 -5.265 10.327
764 HE2 PHE 99 2HE PHE 99 2.334 -1.444 9.928
765 HZ PHE 99 HZ PHE 99 2.116 -3.591 11.111
766 H ASP 100 H ASP 100 -3.073 -0.579 6.459
767 HA ASP 100 HA ASP 100 -5.017 -0.057 8.390
768 1HB ASP 100 2HB ASP 100 -2.540 -0.197 9.603
769 2HB ASP 100 1HB ASP 100 -2.771 1.534 9.365
770 H TYR 101 H TYR 101 -4.686 2.563 8.993
771 HA TYR 101 HA TYR 101 -4.261 3.950 6.436
772 1HB TYR 101 2HB TYR 101 -6.779 3.678 7.968
773 2HB TYR 101 1HB TYR 101 -6.401 5.305 7.420
774 HD1 TYR 101 1HD TYR 101 -7.010 1.844 6.284
775 HD2 TYR 101 2HD TYR 101 -6.679 5.921 5.152
776 HE1 TYR 101 1HE TYR 101 -7.956 1.297 4.080
777 HE2 TYR 101 2HE TYR 101 -7.614 5.392 2.940
778 HH TYR 101 HH TYR 101 -8.136 3.702 1.513
779 H LEU 102 H LEU 102 -3.822 6.227 6.667
780 HA LEU 102 HA LEU 102 -2.795 6.888 9.334
781 1HB LEU 102 2HB LEU 102 -2.090 7.860 6.585
782 2HB LEU 102 1HB LEU 102 -1.643 8.777 8.006
783 HG LEU 102 HG LEU 102 0.285 7.586 7.575
784 1HD1 LEU 102 1HD1 LEU 102 -1.320 6.423 9.704
785 2HD1 LEU 102 2HD1 LEU 102 0.354 6.960 9.700
786 3HD1 LEU 102 3HD1 LEU 102 -0.058 5.357 9.102
787 1HD2 LEU 102 1HD2 LEU 102 -1.527 5.414 6.637
788 2HD2 LEU 102 2HD2 LEU 102 0.160 5.078 7.026
789 3HD2 LEU 102 3HD2 LEU 102 -0.237 6.254 5.772
790 HA PRO 103 HA PRO 103 -6.286 9.654 9.676
791 1HB PRO 103 2HB PRO 103 -5.517 10.805 12.041
792 2HB PRO 103 1HB PRO 103 -6.353 9.254 11.920
793 1HG PRO 103 2HG PRO 103 -3.454 9.817 12.340
794 2HG PRO 103 1HG PRO 103 -4.465 8.542 13.038
795 1HD PRO 103 2HD PRO 103 -2.734 8.112 10.987
796 2HD PRO 103 1HD PRO 103 -4.224 7.176 11.213
797 H LYS 104 H LYS 104 -3.606 11.366 11.250
798 HA LYS 104 HA LYS 104 -3.945 13.491 9.251
799 1HB LYS 104 2HB LYS 104 -4.366 13.841 11.822
800 2HB LYS 104 1HB LYS 104 -2.618 14.014 11.872
801 1HG LYS 104 2HG LYS 104 -3.042 16.166 11.458
802 2HG LYS 104 1HG LYS 104 -3.227 15.625 9.788
803 1HD LYS 104 2HD LYS 104 -5.264 16.542 9.891
804 2HD LYS 104 1HD LYS 104 -5.706 15.133 10.857
805 1HE LYS 104 2HE LYS 104 -5.813 16.319 12.767
806 2HE LYS 104 1HE LYS 104 -4.415 17.308 12.350
807 1HZ LYS 104 1HZ LYS 104 -6.109 18.828 12.266
808 2HZ LYS 104 2HZ LYS 104 -7.246 17.721 11.682
809 3HZ LYS 104 3HZ LYS 104 -6.058 18.338 10.647
810 HA PRO 105 HA PRO 105 0.772 13.196 9.593
811 1HB PRO 105 2HB PRO 105 1.974 11.517 11.307
812 2HB PRO 105 1HB PRO 105 1.397 13.106 11.822
813 1HG PRO 105 2HG PRO 105 0.168 10.420 12.231
814 2HG PRO 105 1HG PRO 105 0.245 11.799 13.340
815 1HD PRO 105 2HD PRO 105 -1.952 11.124 11.802
816 2HD PRO 105 1HD PRO 105 -1.645 12.733 12.476
817 H PHE 106 H PHE 106 2.378 11.732 8.612
818 HA PHE 106 HA PHE 106 2.076 9.034 8.282
819 1HB PHE 106 2HB PHE 106 1.117 8.819 6.022
820 2HB PHE 106 1HB PHE 106 -0.040 9.362 7.219
821 HD1 PHE 106 1HD PHE 106 -0.045 12.145 7.315
822 HD2 PHE 106 2HD PHE 106 0.856 9.646 3.995
823 HE1 PHE 106 1HE PHE 106 -0.704 13.955 5.789
824 HE2 PHE 106 2HE PHE 106 0.200 11.459 2.453
825 HZ PHE 106 HZ PHE 106 -0.581 13.615 3.353
826 H ASP 107 H ASP 107 2.456 10.977 5.364
827 HA ASP 107 HA ASP 107 4.233 11.081 3.933
828 1HB ASP 107 2HB ASP 107 6.196 12.223 4.895
829 2HB ASP 107 1HB ASP 107 4.690 12.968 5.415
830 H ILE 108 H ILE 108 6.979 10.592 4.270
831 HA ILE 108 HA ILE 108 7.014 7.783 4.037
832 HB ILE 108 HB ILE 108 8.848 9.900 3.544
833 1HG1 ILE 108 2HG1 ILE 108 9.822 8.208 2.026
834 2HG1 ILE 108 1HG1 ILE 108 8.815 6.982 2.781
835 1HG2 ILE 108 1HG2 ILE 108 10.129 9.293 5.450
836 2HG2 ILE 108 2HG2 ILE 108 10.944 8.601 4.046
837 3HG2 ILE 108 3HG2 ILE 108 9.959 7.574 5.087
838 1HD1 ILE 108 1HD1 ILE 108 7.683 9.417 1.439
839 2HD1 ILE 108 2HD1 ILE 108 6.837 7.950 1.945
840 3HD1 ILE 108 3HD1 ILE 108 7.979 7.894 0.599
841 H ASP 109 H ASP 109 8.086 9.932 6.585
842 HA ASP 109 HA ASP 109 9.356 8.171 8.259
843 1HB ASP 109 2HB ASP 109 8.990 10.681 8.570
844 2HB ASP 109 1HB ASP 109 7.448 10.254 9.308
845 H GLU 110 H GLU 110 5.877 8.978 8.451
846 HA GLU 110 HA GLU 110 5.385 6.790 10.212
847 1HB GLU 110 2HB GLU 110 3.639 8.840 8.914
848 2HB GLU 110 1HB GLU 110 2.934 7.483 9.769
849 1HG GLU 110 2HG GLU 110 5.002 8.974 11.227
850 2HG GLU 110 1HG GLU 110 3.521 9.867 10.869
851 H ALA 111 H ALA 111 5.045 7.358 6.784
852 HA ALA 111 HA ALA 111 3.392 5.132 6.212
853 1HB ALA 111 1HB ALA 111 5.316 6.645 4.453
854 2HB ALA 111 2HB ALA 111 3.565 6.854 4.557
855 3HB ALA 111 3HB ALA 111 4.243 5.374 3.872
856 H VAL 112 H VAL 112 6.903 5.563 5.706
857 HA VAL 112 HA VAL 112 7.439 2.875 5.137
858 HB VAL 112 HB VAL 112 9.305 4.858 6.424
859 1HG1 VAL 112 1HG1 VAL 112 9.621 2.119 5.910
860 2HG1 VAL 112 2HG1 VAL 112 10.876 3.280 6.348
861 3HG1 VAL 112 3HG1 VAL 112 10.533 2.951 4.649
862 1HG2 VAL 112 1HG2 VAL 112 8.833 5.956 4.483
863 2HG2 VAL 112 2HG2 VAL 112 8.365 4.483 3.634
864 3HG2 VAL 112 3HG2 VAL 112 10.071 4.859 3.873
865 H ALA 113 H ALA 113 7.024 4.577 8.112
866 HA ALA 113 HA ALA 113 8.152 2.667 9.868
867 1HB ALA 113 1HB ALA 113 6.825 3.818 11.601
868 2HB ALA 113 2HB ALA 113 5.986 4.712 10.333
869 3HB ALA 113 3HB ALA 113 7.716 4.948 10.583
870 H LEU 114 H LEU 114 4.878 3.296 8.720
871 HA LEU 114 HA LEU 114 3.705 1.083 10.068
872 1HB LEU 114 2HB LEU 114 2.572 3.254 9.362
873 2HB LEU 114 1HB LEU 114 2.541 2.595 7.740
874 HG LEU 114 HG LEU 114 1.076 0.797 8.441
875 1HD1 LEU 114 1HD1 LEU 114 0.231 1.489 10.996
876 2HD1 LEU 114 2HD1 LEU 114 1.995 1.531 11.074
877 3HD1 LEU 114 3HD1 LEU 114 1.169 0.070 10.534
878 1HD2 LEU 114 1HD2 LEU 114 -0.181 2.640 7.789
879 2HD2 LEU 114 2HD2 LEU 114 0.293 3.580 9.197
880 3HD2 LEU 114 3HD2 LEU 114 -0.843 2.245 9.371
881 H VAL 115 H VAL 115 5.377 1.458 7.069
882 HA VAL 115 HA VAL 115 4.156 -0.825 5.824
883 HB VAL 115 HB VAL 115 5.170 1.107 4.527
884 1HG1 VAL 115 1HG1 VAL 115 7.760 -0.366 4.938
885 2HG1 VAL 115 2HG1 VAL 115 7.318 1.075 5.841
886 3HG1 VAL 115 3HG1 VAL 115 7.496 1.160 4.095
887 1HG2 VAL 115 1HG2 VAL 115 6.325 -0.636 2.897
888 2HG2 VAL 115 2HG2 VAL 115 4.576 -0.583 3.124
889 3HG2 VAL 115 3HG2 VAL 115 5.543 -1.778 3.985
890 H GLU 116 H GLU 116 7.316 -0.164 7.301
891 HA GLU 116 HA GLU 116 8.376 -2.742 6.937
892 1HB GLU 116 2HB GLU 116 9.021 -0.596 8.955
893 2HB GLU 116 1HB GLU 116 9.957 -2.075 8.772
894 1HG GLU 116 2HG GLU 116 10.250 -1.412 6.340
895 2HG GLU 116 1HG GLU 116 9.622 0.167 6.810
896 H ARG 117 H ARG 117 6.459 -1.317 9.520
897 HA ARG 117 HA ARG 117 6.705 -3.448 11.347
898 1HB ARG 117 2HB ARG 117 4.622 -1.297 11.000
899 2HB ARG 117 1HB ARG 117 4.569 -2.467 12.313
900 1HG ARG 117 2HG ARG 117 6.872 -0.602 11.788
901 2HG ARG 117 1HG ARG 117 5.574 -0.296 12.946
902 1HD ARG 117 2HD ARG 117 6.331 -2.763 13.716
903 2HD ARG 117 1HD ARG 117 7.864 -2.151 13.098
904 HE ARG 117 HE ARG 117 6.694 -0.228 14.789
905 1HH1 ARG 117 1HH1 ARG 117 8.252 -3.348 14.923
906 2HH1 ARG 117 2HH1 ARG 117 8.860 -3.115 16.527
907 1HH2 ARG 117 1HH2 ARG 117 7.491 0.080 16.897
908 2HH2 ARG 117 2HH2 ARG 117 8.427 -1.168 17.650
909 H ALA 118 H ALA 118 4.807 -3.011 8.510
910 HA ALA 118 HA ALA 118 2.823 -4.969 9.098
911 1HB ALA 118 1HB ALA 118 3.537 -4.125 6.320
912 2HB ALA 118 2HB ALA 118 2.716 -3.013 7.416
913 3HB ALA 118 3HB ALA 118 1.958 -4.545 6.987
914 H ILE 119 H ILE 119 5.871 -4.957 7.330
915 HA ILE 119 HA ILE 119 5.614 -7.608 6.350
916 HB ILE 119 HB ILE 119 8.172 -6.073 6.750
917 1HG1 ILE 119 2HG1 ILE 119 6.818 -6.051 4.116
918 2HG1 ILE 119 1HG1 ILE 119 6.080 -5.068 5.371
919 1HG2 ILE 119 1HG2 ILE 119 8.589 -8.354 6.196
920 2HG2 ILE 119 2HG2 ILE 119 8.868 -7.393 4.743
921 3HG2 ILE 119 3HG2 ILE 119 7.378 -8.322 4.913
922 1HD1 ILE 119 1HD1 ILE 119 7.782 -3.971 3.836
923 2HD1 ILE 119 2HD1 ILE 119 8.994 -4.876 4.742
924 3HD1 ILE 119 3HD1 ILE 119 7.953 -3.720 5.571
925 H SER 120 H SER 120 6.845 -6.163 9.242
926 HA SER 120 HA SER 120 8.335 -8.367 10.197
927 1HB SER 120 2HB SER 120 8.786 -6.222 11.149
928 2HB SER 120 1HB SER 120 7.097 -5.995 11.600
929 HG SER 120 HG SER 120 8.378 -8.234 12.641
930 H HIS 121 H HIS 121 4.961 -7.422 10.493
931 HA HIS 121 HA HIS 121 4.281 -9.326 12.484
932 1HB HIS 121 2HB HIS 121 2.734 -7.590 10.605
933 2HB HIS 121 1HB HIS 121 1.900 -8.897 11.438
934 HD1 HIS 121 1HD HIS 121 4.043 -5.878 12.291
935 HD2 HIS 121 2HD HIS 121 1.048 -8.245 13.932
936 HE1 HIS 121 1HE HIS 121 3.429 -4.773 14.463
937 HE2 HIS 121 2HE HIS 121 1.663 -6.262 15.473
938 H TYR 122 H TYR 122 4.624 -9.479 9.053
939 HA TYR 122 HA TYR 122 3.103 -11.852 8.666
940 1HB TYR 122 2HB TYR 122 4.113 -9.964 6.987
941 2HB TYR 122 1HB TYR 122 5.252 -11.284 6.734
942 HD1 TYR 122 1HD TYR 122 3.517 -13.642 6.973
943 HD2 TYR 122 2HD TYR 122 2.801 -9.907 5.069
944 HE1 TYR 122 1HE TYR 122 1.919 -14.731 5.455
945 HE2 TYR 122 2HE TYR 122 1.201 -10.984 3.543
946 HH TYR 122 HH TYR 122 0.753 -13.260 2.652
947 H GLN 123 H GLN 123 6.602 -11.202 8.724
948 HA GLN 123 HA GLN 123 7.260 -13.984 8.733
949 1HB GLN 123 2HB GLN 123 9.573 -13.229 8.940
950 2HB GLN 123 1HB GLN 123 8.734 -12.333 7.680
951 1HG GLN 123 2HG GLN 123 8.303 -10.631 9.636
952 2HG GLN 123 1HG GLN 123 9.722 -11.416 10.328
953 1HE2 GLN 123 1HE2 GLN 123 11.115 -9.729 10.123
954 2HE2 GLN 123 2HE2 GLN 123 11.641 -9.096 8.605
955 H GLU 124 H GLU 124 9.226 -14.352 10.516
956 HA GLU 124 HA GLU 124 7.772 -14.425 13.031
957 1HB GLU 124 2HB GLU 124 8.902 -16.453 12.203
958 2HB GLU 124 1HB GLU 124 10.448 -15.618 12.280
959 1HG GLU 124 2HG GLU 124 8.868 -15.672 14.769
960 2HG GLU 124 1HG GLU 124 9.524 -17.213 14.219
Start of MODEL 22
1 1H MET 1 1HT MET 1 13.493 -17.073 7.224
2 2H MET 1 2HT MET 1 12.733 -17.230 5.694
3 3H MET 1 3HT MET 1 11.942 -16.390 6.965
4 HA MET 1 HA MET 1 13.545 -14.686 6.933
5 1HB MET 1 2HB MET 1 14.847 -16.377 4.789
6 2HB MET 1 1HB MET 1 15.348 -14.747 5.221
7 1HG MET 1 2HG MET 1 15.456 -17.202 6.956
8 2HG MET 1 1HG MET 1 16.815 -16.326 6.257
9 1HE MET 1 1HE MET 1 14.704 -16.995 9.112
10 2HE MET 1 2HE MET 1 13.656 -15.616 8.784
11 3HE MET 1 3HE MET 1 14.739 -15.586 10.173
12 H GLN 2 H GLN 2 12.958 -16.277 3.790
13 HA GLN 2 HA GLN 2 11.799 -15.627 1.947
14 1HB GLN 2 2HB GLN 2 10.250 -14.743 4.190
15 2HB GLN 2 1HB GLN 2 10.096 -13.573 2.885
16 1HG GLN 2 2HG GLN 2 8.350 -15.074 2.547
17 2HG GLN 2 1HG GLN 2 9.584 -15.563 1.386
18 1HE2 GLN 2 1HE2 GLN 2 8.340 -16.259 4.616
19 2HE2 GLN 2 2HE2 GLN 2 8.707 -17.946 4.590
20 H ARG 3 H ARG 3 11.678 -13.986 0.361
21 HA ARG 3 HA ARG 3 13.811 -12.134 0.462
22 1HB ARG 3 2HB ARG 3 12.895 -11.376 -1.764
23 2HB ARG 3 1HB ARG 3 13.328 -13.076 -1.651
24 1HG ARG 3 2HG ARG 3 10.752 -13.263 -0.990
25 2HG ARG 3 1HG ARG 3 10.681 -11.808 -1.974
26 1HD ARG 3 2HD ARG 3 11.628 -12.944 -3.849
27 2HD ARG 3 1HD ARG 3 11.977 -14.371 -2.874
28 HE ARG 3 HE ARG 3 9.527 -13.756 -4.161
29 1HH1 ARG 3 1HH1 ARG 3 10.841 -15.225 -1.278
30 2HH1 ARG 3 2HH1 ARG 3 9.451 -16.220 -1.001
31 1HH2 ARG 3 1HH2 ARG 3 7.700 -15.061 -3.796
32 2HH2 ARG 3 2HH2 ARG 3 7.667 -16.127 -2.432
33 H GLY 4 H GLY 4 10.353 -11.555 0.028
34 1HA GLY 4 2HA GLY 4 9.104 -9.932 1.247
35 2HA GLY 4 1HA GLY 4 10.612 -9.102 1.616
36 H ILE 5 H ILE 5 7.952 -9.331 -0.504
37 HA ILE 5 HA ILE 5 9.199 -7.415 -2.362
38 HB ILE 5 HB ILE 5 6.676 -8.949 -2.919
39 1HG1 ILE 5 2HG1 ILE 5 8.285 -10.662 -2.496
40 2HG1 ILE 5 1HG1 ILE 5 8.149 -10.510 -4.245
41 1HG2 ILE 5 1HG2 ILE 5 8.307 -8.411 -5.197
42 2HG2 ILE 5 2HG2 ILE 5 8.096 -6.923 -4.273
43 3HG2 ILE 5 3HG2 ILE 5 6.686 -7.824 -4.830
44 1HD1 ILE 5 1HD1 ILE 5 10.180 -8.796 -3.718
45 2HD1 ILE 5 2HD1 ILE 5 10.379 -10.483 -4.187
46 3HD1 ILE 5 3HD1 ILE 5 10.427 -10.027 -2.481
47 H VAL 6 H VAL 6 8.673 -5.382 -1.924
48 HA VAL 6 HA VAL 6 5.970 -4.825 -0.912
49 HB VAL 6 HB VAL 6 7.682 -4.068 0.635
50 1HG1 VAL 6 1HG1 VAL 6 9.625 -3.190 0.019
51 2HG1 VAL 6 2HG1 VAL 6 8.831 -1.943 -0.945
52 3HG1 VAL 6 3HG1 VAL 6 9.166 -3.521 -1.649
53 1HG2 VAL 6 1HG2 VAL 6 6.548 -2.208 1.123
54 2HG2 VAL 6 2HG2 VAL 6 5.618 -2.541 -0.338
55 3HG2 VAL 6 3HG2 VAL 6 6.991 -1.432 -0.400
56 H TRP 7 H TRP 7 4.589 -3.862 -2.234
57 HA TRP 7 HA TRP 7 5.665 -2.432 -4.574
58 1HB TRP 7 2HB TRP 7 3.184 -4.101 -4.219
59 2HB TRP 7 1HB TRP 7 3.343 -2.961 -5.551
60 HD1 TRP 7 HD1 TRP 7 6.653 -4.425 -4.877
61 HE1 TRP 7 1HE TRP 7 7.199 -6.271 -6.575
62 HE3 TRP 7 3HE TRP 7 1.992 -5.098 -6.858
63 HZ2 TRP 7 2HZ TRP 7 5.825 -7.830 -8.493
64 HZ3 TRP 7 3HZ TRP 7 1.689 -6.787 -8.617
65 HH2 TRP 7 HH2 TRP 7 3.568 -8.126 -9.417
66 H VAL 8 H VAL 8 5.088 -0.352 -4.904
67 HA VAL 8 HA VAL 8 3.089 0.797 -3.061
68 HB VAL 8 HB VAL 8 5.136 2.590 -4.232
69 1HG1 VAL 8 1HG1 VAL 8 3.609 3.646 -2.834
70 2HG1 VAL 8 2HG1 VAL 8 5.020 3.410 -1.802
71 3HG1 VAL 8 3HG1 VAL 8 3.635 2.333 -1.659
72 1HG2 VAL 8 1HG2 VAL 8 5.807 0.316 -2.463
73 2HG2 VAL 8 2HG2 VAL 8 6.500 1.882 -2.039
74 3HG2 VAL 8 3HG2 VAL 8 6.806 1.187 -3.631
75 H VAL 9 H VAL 9 1.666 2.346 -3.834
76 HA VAL 9 HA VAL 9 1.722 2.783 -6.742
77 HB VAL 9 HB VAL 9 -0.970 3.018 -5.838
78 1HG1 VAL 9 1HG1 VAL 9 0.566 1.304 -7.735
79 2HG1 VAL 9 2HG1 VAL 9 -0.624 2.551 -8.082
80 3HG1 VAL 9 3HG1 VAL 9 -1.140 0.984 -7.462
81 1HG2 VAL 9 1HG2 VAL 9 0.380 0.441 -5.045
82 2HG2 VAL 9 2HG2 VAL 9 -1.365 0.626 -5.227
83 3HG2 VAL 9 3HG2 VAL 9 -0.503 1.554 -4.000
84 H ASP 10 H ASP 10 2.218 4.816 -7.091
85 HA ASP 10 HA ASP 10 0.612 6.934 -6.011
86 1HB ASP 10 2HB ASP 10 2.605 6.293 -4.353
87 2HB ASP 10 1HB ASP 10 3.512 7.331 -5.448
88 H ASP 11 H ASP 11 2.341 9.077 -6.566
89 HA ASP 11 HA ASP 11 2.026 9.287 -9.356
90 1HB ASP 11 2HB ASP 11 3.701 11.017 -7.529
91 2HB ASP 11 1HB ASP 11 3.124 11.453 -9.134
92 H ASP 12 H ASP 12 4.341 7.542 -7.755
93 HA ASP 12 HA ASP 12 6.286 6.569 -8.428
94 1HB ASP 12 2HB ASP 12 4.808 6.643 -10.649
95 2HB ASP 12 1HB ASP 12 6.084 7.738 -11.166
96 H SER 13 H SER 13 7.906 7.893 -10.688
97 HA SER 13 HA SER 13 9.865 9.057 -10.598
98 1HB SER 13 2HB SER 13 7.839 10.460 -11.429
99 2HB SER 13 1HB SER 13 8.170 11.425 -9.993
100 HG SER 13 HG SER 13 10.253 10.741 -11.758
101 H SER 14 H SER 14 8.211 11.128 -8.305
102 HA SER 14 HA SER 14 10.553 11.252 -6.658
103 1HB SER 14 2HB SER 14 7.943 12.655 -6.796
104 2HB SER 14 1HB SER 14 8.766 12.650 -5.236
105 HG SER 14 HG SER 14 10.101 13.350 -7.624
106 H ILE 15 H ILE 15 7.256 9.990 -6.237
107 HA ILE 15 HA ILE 15 7.587 9.253 -3.546
108 HB ILE 15 HB ILE 15 5.720 7.913 -5.488
109 1HG1 ILE 15 2HG1 ILE 15 5.466 10.349 -5.647
110 2HG1 ILE 15 1HG1 ILE 15 4.075 9.630 -4.844
111 1HG2 ILE 15 1HG2 ILE 15 5.159 8.452 -2.606
112 2HG2 ILE 15 2HG2 ILE 15 6.188 7.091 -3.052
113 3HG2 ILE 15 3HG2 ILE 15 4.533 7.179 -3.655
114 1HD1 ILE 15 1HD1 ILE 15 4.727 11.661 -3.728
115 2HD1 ILE 15 2HD1 ILE 15 6.366 11.048 -3.510
116 3HD1 ILE 15 3HD1 ILE 15 5.018 10.279 -2.674
117 H ARG 16 H ARG 16 8.302 7.574 -6.511
118 HA ARG 16 HA ARG 16 8.698 5.015 -5.317
119 1HB ARG 16 2HB ARG 16 9.818 4.465 -7.476
120 2HB ARG 16 1HB ARG 16 8.180 5.073 -7.621
121 1HG ARG 16 2HG ARG 16 8.975 6.441 -9.171
122 2HG ARG 16 1HG ARG 16 9.715 7.343 -7.849
123 1HD ARG 16 2HD ARG 16 11.784 6.223 -8.121
124 2HD ARG 16 1HD ARG 16 11.064 4.999 -9.164
125 HE ARG 16 HE ARG 16 10.862 7.641 -10.240
126 1HH1 ARG 16 1HH1 ARG 16 12.956 4.873 -9.914
127 2HH1 ARG 16 2HH1 ARG 16 13.881 5.249 -11.327
128 1HH2 ARG 16 1HH2 ARG 16 12.074 8.140 -12.101
129 2HH2 ARG 16 2HH2 ARG 16 13.382 7.106 -12.569
130 H TRP 17 H TRP 17 11.018 7.398 -6.593
131 HA TRP 17 HA TRP 17 13.372 6.156 -5.999
132 1HB TRP 17 2HB TRP 17 13.158 8.315 -7.198
133 2HB TRP 17 1HB TRP 17 12.874 9.112 -5.651
134 HD1 TRP 17 HD1 TRP 17 15.652 7.339 -7.625
135 HE1 TRP 17 1HE TRP 17 17.923 8.029 -6.632
136 HE3 TRP 17 3HE TRP 17 13.997 9.980 -3.572
137 HZ2 TRP 17 2HZ TRP 17 18.886 9.499 -4.423
138 HZ3 TRP 17 3HZ TRP 17 15.658 10.995 -2.067
139 HH2 TRP 17 HH2 TRP 17 18.052 10.758 -2.485
140 H VAL 18 H VAL 18 11.426 8.082 -3.723
141 HA VAL 18 HA VAL 18 13.365 7.906 -1.657
142 HB VAL 18 HB VAL 18 10.546 8.329 -0.865
143 1HG1 VAL 18 1HG1 VAL 18 11.451 9.624 0.779
144 2HG1 VAL 18 2HG1 VAL 18 12.795 10.162 -0.225
145 3HG1 VAL 18 3HG1 VAL 18 12.808 8.541 0.473
146 1HG2 VAL 18 1HG2 VAL 18 10.107 9.858 -2.415
147 2HG2 VAL 18 2HG2 VAL 18 11.759 9.825 -3.031
148 3HG2 VAL 18 3HG2 VAL 18 11.347 10.857 -1.664
149 H LEU 19 H LEU 19 10.193 6.410 -1.973
150 HA LEU 19 HA LEU 19 10.482 4.765 0.270
151 1HB LEU 19 2HB LEU 19 8.563 4.985 -1.946
152 2HB LEU 19 1HB LEU 19 8.628 3.421 -1.148
153 HG LEU 19 HG LEU 19 8.111 4.425 0.987
154 1HD1 LEU 19 1HD1 LEU 19 8.065 6.662 1.451
155 2HD1 LEU 19 2HD1 LEU 19 7.696 7.112 -0.218
156 3HD1 LEU 19 3HD1 LEU 19 9.331 6.619 0.223
157 1HD2 LEU 19 1HD2 LEU 19 5.863 4.959 0.617
158 2HD2 LEU 19 2HD2 LEU 19 6.305 3.902 -0.721
159 3HD2 LEU 19 3HD2 LEU 19 6.197 5.646 -0.974
160 H GLU 20 H GLU 20 11.415 4.265 -3.043
161 HA GLU 20 HA GLU 20 11.730 1.466 -2.860
162 1HB GLU 20 2HB GLU 20 12.835 1.555 -4.956
163 2HB GLU 20 1HB GLU 20 11.554 2.748 -4.999
164 1HG GLU 20 2HG GLU 20 13.262 4.486 -4.501
165 2HG GLU 20 1HG GLU 20 14.498 3.239 -4.674
166 H ARG 21 H ARG 21 14.201 4.010 -2.887
167 HA ARG 21 HA ARG 21 16.382 2.400 -2.270
168 1HB ARG 21 2HB ARG 21 15.839 5.320 -1.776
169 2HB ARG 21 1HB ARG 21 17.366 4.574 -1.324
170 1HG ARG 21 2HG ARG 21 16.446 4.125 -4.094
171 2HG ARG 21 1HG ARG 21 16.953 5.762 -3.678
172 1HD ARG 21 2HD ARG 21 18.583 3.249 -3.320
173 2HD ARG 21 1HD ARG 21 18.811 4.462 -4.576
174 HE ARG 21 HE ARG 21 19.621 5.966 -2.940
175 1HH1 ARG 21 1HH1 ARG 21 18.953 2.789 -1.636
176 2HH1 ARG 21 2HH1 ARG 21 19.937 3.027 -0.235
177 1HH2 ARG 21 1HH2 ARG 21 20.912 6.268 -1.094
178 2HH2 ARG 21 2HH2 ARG 21 21.048 4.997 0.076
179 H ALA 22 H ALA 22 14.373 4.323 -0.025
180 HA ALA 22 HA ALA 22 15.705 3.569 2.307
181 1HB ALA 22 1HB ALA 22 13.958 5.413 1.977
182 2HB ALA 22 2HB ALA 22 13.952 4.537 3.508
183 3HB ALA 22 3HB ALA 22 12.766 4.145 2.262
184 H LEU 23 H LEU 23 12.951 2.091 0.706
185 HA LEU 23 HA LEU 23 12.662 0.069 2.702
186 1HB LEU 23 2HB LEU 23 10.888 0.948 1.030
187 2HB LEU 23 1HB LEU 23 11.610 -0.187 -0.095
188 HG LEU 23 HG LEU 23 10.783 -2.023 0.998
189 1HD1 LEU 23 1HD1 LEU 23 11.823 -1.637 3.147
190 2HD1 LEU 23 2HD1 LEU 23 10.136 -2.089 3.370
191 3HD1 LEU 23 3HD1 LEU 23 10.625 -0.400 3.535
192 1HD2 LEU 23 1HD2 LEU 23 8.946 -0.468 0.245
193 2HD2 LEU 23 2HD2 LEU 23 8.756 -0.018 1.941
194 3HD2 LEU 23 3HD2 LEU 23 8.495 -1.691 1.436
195 H ALA 24 H ALA 24 14.580 0.487 -0.113
196 HA ALA 24 HA ALA 24 15.187 -2.248 -0.595
197 1HB ALA 24 1HB ALA 24 17.176 -1.260 -1.826
198 2HB ALA 24 2HB ALA 24 16.558 0.325 -1.361
199 3HB ALA 24 3HB ALA 24 15.586 -0.735 -2.382
200 H GLY 25 H GLY 25 16.485 0.307 1.441
201 1HA GLY 25 2HA GLY 25 18.873 -0.998 2.219
202 2HA GLY 25 1HA GLY 25 18.048 0.267 3.125
203 H ALA 26 H ALA 26 15.555 -1.377 3.154
204 HA ALA 26 HA ALA 26 16.072 -2.755 5.602
205 1HB ALA 26 1HB ALA 26 13.672 -2.133 3.962
206 2HB ALA 26 2HB ALA 26 13.998 -1.788 5.662
207 3HB ALA 26 3HB ALA 26 13.563 -3.425 5.158
208 H GLY 27 H GLY 27 16.133 -3.620 2.299
209 1HA GLY 27 2HA GLY 27 17.063 -5.698 1.617
210 2HA GLY 27 1HA GLY 27 16.432 -6.427 3.080
211 H LEU 28 H LEU 28 14.348 -4.416 1.045
212 HA LEU 28 HA LEU 28 13.107 -6.890 0.090
213 1HB LEU 28 2HB LEU 28 11.314 -4.593 0.502
214 2HB LEU 28 1HB LEU 28 11.018 -6.305 0.733
215 HG LEU 28 HG LEU 28 12.695 -5.873 2.780
216 1HD1 LEU 28 1HD1 LEU 28 13.168 -3.708 2.860
217 2HD1 LEU 28 2HD1 LEU 28 11.617 -3.621 3.694
218 3HD1 LEU 28 3HD1 LEU 28 11.718 -3.252 1.973
219 1HD2 LEU 28 1HD2 LEU 28 10.914 -6.389 4.030
220 2HD2 LEU 28 2HD2 LEU 28 10.069 -6.508 2.487
221 3HD2 LEU 28 3HD2 LEU 28 9.978 -5.019 3.429
222 H THR 29 H THR 29 11.481 -6.439 -1.715
223 HA THR 29 HA THR 29 12.832 -4.752 -3.692
224 HB THR 29 HB THR 29 10.878 -7.036 -3.960
225 HG1 THR 29 1HG THR 29 13.622 -6.713 -4.281
226 1HG2 THR 29 1HG2 THR 29 10.241 -6.189 -5.909
227 2HG2 THR 29 2HG2 THR 29 11.861 -6.601 -6.474
228 3HG2 THR 29 3HG2 THR 29 11.515 -4.970 -5.897
229 H CYS 30 H CYS 30 12.054 -2.739 -3.683
230 HA CYS 30 HA CYS 30 9.189 -2.271 -3.324
231 1HB CYS 30 2HB CYS 30 11.087 -1.009 -2.084
232 2HB CYS 30 1HB CYS 30 11.249 -0.121 -3.597
233 HG CYS 30 HG CYS 30 9.607 1.292 -2.333
234 H THR 31 H THR 31 7.944 -2.105 -5.096
235 HA THR 31 HA THR 31 9.103 -0.775 -7.452
236 HB THR 31 HB THR 31 8.741 -3.356 -7.655
237 HG1 THR 31 1HG THR 31 7.511 -1.642 -9.560
238 1HG2 THR 31 1HG2 THR 31 6.686 -4.222 -7.879
239 2HG2 THR 31 2HG2 THR 31 6.017 -2.740 -8.557
240 3HG2 THR 31 3HG2 THR 31 6.244 -2.886 -6.815
241 H THR 32 H THR 32 7.910 0.882 -8.186
242 HA THR 32 HA THR 32 5.368 1.375 -6.860
243 HB THR 32 HB THR 32 5.747 3.724 -7.433
244 HG1 THR 32 1HG THR 32 6.973 3.966 -9.130
245 1HG2 THR 32 1HG2 THR 32 8.388 3.160 -6.378
246 2HG2 THR 32 2HG2 THR 32 7.118 2.254 -5.550
247 3HG2 THR 32 3HG2 THR 32 7.033 4.018 -5.644
248 H PHE 33 H PHE 33 3.731 2.609 -8.047
249 HA PHE 33 HA PHE 33 3.589 1.937 -10.893
250 1HB PHE 33 2HB PHE 33 1.418 1.396 -8.884
251 2HB PHE 33 1HB PHE 33 1.283 1.161 -10.613
252 HD1 PHE 33 1HD PHE 33 1.564 -0.987 -11.387
253 HD2 PHE 33 2HD PHE 33 3.548 0.178 -7.819
254 HE1 PHE 33 1HE PHE 33 2.443 -3.261 -11.142
255 HE2 PHE 33 2HE PHE 33 4.456 -2.082 -7.571
256 HZ PHE 33 HZ PHE 33 3.889 -3.827 -9.236
257 H GLU 34 H GLU 34 1.488 2.942 -11.854
258 HA GLU 34 HA GLU 34 1.792 5.712 -11.794
259 1HB GLU 34 2HB GLU 34 -0.240 5.771 -13.199
260 2HB GLU 34 1HB GLU 34 0.932 4.575 -13.737
261 1HG GLU 34 2HG GLU 34 -1.002 3.374 -13.899
262 2HG GLU 34 1HG GLU 34 -0.492 2.956 -12.268
263 H ASN 35 H ASN 35 -0.730 3.746 -10.127
264 HA ASN 35 HA ASN 35 -1.128 5.856 -8.271
265 1HB ASN 35 2HB ASN 35 -2.397 6.452 -10.515
266 2HB ASN 35 1HB ASN 35 -3.625 5.409 -9.804
267 1HD2 ASN 35 1HD2 ASN 35 -1.578 8.199 -9.101
268 2HD2 ASN 35 2HD2 ASN 35 -2.707 8.987 -8.059
269 H GLY 36 H GLY 36 -2.743 3.047 -9.676
270 1HA GLY 36 2HA GLY 36 -2.803 1.655 -7.206
271 2HA GLY 36 1HA GLY 36 -4.350 2.427 -7.483
272 H ASN 37 H ASN 37 -4.722 2.096 -10.174
273 HA ASN 37 HA ASN 37 -5.617 -0.571 -10.283
274 1HB ASN 37 2HB ASN 37 -6.156 1.741 -11.682
275 2HB ASN 37 1HB ASN 37 -5.377 0.720 -12.888
276 1HD2 ASN 37 1HD2 ASN 37 -7.657 0.201 -10.214
277 2HD2 ASN 37 2HD2 ASN 37 -8.811 -0.682 -11.146
278 H GLU 38 H GLU 38 -2.694 0.968 -11.318
279 HA GLU 38 HA GLU 38 -1.793 -0.867 -13.215
280 1HB GLU 38 2HB GLU 38 -0.796 1.399 -11.956
281 2HB GLU 38 1HB GLU 38 0.339 0.137 -11.535
282 1HG GLU 38 2HG GLU 38 -0.422 0.169 -14.355
283 2HG GLU 38 1HG GLU 38 0.422 1.618 -13.806
284 H VAL 39 H VAL 39 -1.092 -0.790 -9.681
285 HA VAL 39 HA VAL 39 0.448 -3.096 -9.580
286 HB VAL 39 HB VAL 39 -1.569 -2.456 -7.432
287 1HG1 VAL 39 1HG1 VAL 39 1.091 -3.196 -6.590
288 2HG1 VAL 39 2HG1 VAL 39 0.403 -4.404 -7.673
289 3HG1 VAL 39 3HG1 VAL 39 -0.459 -3.942 -6.206
290 1HG2 VAL 39 1HG2 VAL 39 0.136 -0.558 -8.400
291 2HG2 VAL 39 2HG2 VAL 39 1.105 -1.294 -7.123
292 3HG2 VAL 39 3HG2 VAL 39 -0.481 -0.621 -6.748
293 H LEU 40 H LEU 40 -3.061 -2.774 -9.291
294 HA LEU 40 HA LEU 40 -3.817 -5.374 -8.856
295 1HB LEU 40 2HB LEU 40 -5.256 -3.567 -10.784
296 2HB LEU 40 1HB LEU 40 -5.944 -4.815 -9.764
297 HG LEU 40 HG LEU 40 -4.804 -2.175 -8.846
298 1HD1 LEU 40 1HD1 LEU 40 -6.914 -1.726 -9.696
299 2HD1 LEU 40 2HD1 LEU 40 -7.219 -1.994 -7.982
300 3HD1 LEU 40 3HD1 LEU 40 -7.571 -3.266 -9.155
301 1HD2 LEU 40 1HD2 LEU 40 -6.066 -4.343 -7.176
302 2HD2 LEU 40 2HD2 LEU 40 -5.385 -2.817 -6.611
303 3HD2 LEU 40 3HD2 LEU 40 -4.328 -4.057 -7.287
304 H ALA 41 H ALA 41 -3.012 -3.864 -11.959
305 HA ALA 41 HA ALA 41 -3.617 -6.127 -13.548
306 1HB ALA 41 1HB ALA 41 -1.613 -4.030 -14.301
307 2HB ALA 41 2HB ALA 41 -3.348 -3.712 -14.315
308 3HB ALA 41 3HB ALA 41 -2.674 -4.966 -15.354
309 H ALA 42 H ALA 42 -0.586 -4.851 -12.299
310 HA ALA 42 HA ALA 42 1.090 -6.872 -13.315
311 1HB ALA 42 1HB ALA 42 2.780 -6.018 -11.866
312 2HB ALA 42 2HB ALA 42 1.583 -5.287 -10.797
313 3HB ALA 42 3HB ALA 42 1.829 -4.640 -12.419
314 H LEU 43 H LEU 43 -0.995 -6.712 -10.560
315 HA LEU 43 HA LEU 43 0.179 -8.777 -9.042
316 1HB LEU 43 2HB LEU 43 -2.444 -7.370 -9.029
317 2HB LEU 43 1HB LEU 43 -2.249 -8.824 -8.067
318 HG LEU 43 HG LEU 43 -0.108 -6.847 -7.722
319 1HD1 LEU 43 1HD1 LEU 43 -1.700 -5.634 -6.064
320 2HD1 LEU 43 2HD1 LEU 43 -2.960 -6.191 -7.167
321 3HD1 LEU 43 3HD1 LEU 43 -1.665 -5.160 -7.752
322 1HD2 LEU 43 1HD2 LEU 43 -1.868 -8.237 -5.724
323 2HD2 LEU 43 2HD2 LEU 43 -0.271 -7.539 -5.464
324 3HD2 LEU 43 3HD2 LEU 43 -0.449 -8.984 -6.463
325 H ALA 44 H ALA 44 -2.031 -8.801 -11.704
326 HA ALA 44 HA ALA 44 -3.357 -11.188 -11.404
327 1HB ALA 44 1HB ALA 44 -2.455 -9.629 -13.762
328 2HB ALA 44 2HB ALA 44 -4.083 -10.087 -13.258
329 3HB ALA 44 3HB ALA 44 -3.033 -11.273 -14.032
330 H SER 45 H SER 45 0.011 -10.733 -11.922
331 HA SER 45 HA SER 45 0.329 -13.616 -12.254
332 1HB SER 45 2HB SER 45 0.934 -12.635 -14.350
333 2HB SER 45 1HB SER 45 1.921 -11.411 -13.552
334 HG SER 45 HG SER 45 3.421 -12.938 -13.054
335 H LYS 46 H LYS 46 0.670 -11.324 -10.010
336 HA LYS 46 HA LYS 46 2.588 -12.812 -8.531
337 1HB LYS 46 2HB LYS 46 3.717 -10.958 -10.227
338 2HB LYS 46 1HB LYS 46 3.611 -10.080 -8.709
339 1HG LYS 46 2HG LYS 46 4.615 -12.647 -8.107
340 2HG LYS 46 1HG LYS 46 5.498 -12.056 -9.514
341 1HD LYS 46 2HD LYS 46 5.696 -9.855 -8.150
342 2HD LYS 46 1HD LYS 46 5.310 -10.880 -6.766
343 1HE LYS 46 2HE LYS 46 7.244 -12.179 -7.049
344 2HE LYS 46 1HE LYS 46 7.506 -11.582 -8.690
345 1HZ LYS 46 1HZ LYS 46 8.355 -9.605 -7.929
346 2HZ LYS 46 2HZ LYS 46 8.924 -10.670 -6.743
347 3HZ LYS 46 3HZ LYS 46 7.573 -9.700 -6.432
348 H THR 47 H THR 47 2.855 -12.031 -6.350
349 HA THR 47 HA THR 47 1.030 -9.924 -5.538
350 HB THR 47 HB THR 47 1.055 -12.703 -4.361
351 HG1 THR 47 1HG THR 47 -1.056 -11.274 -5.592
352 1HG2 THR 47 1HG2 THR 47 -0.781 -10.485 -3.530
353 2HG2 THR 47 2HG2 THR 47 0.727 -10.832 -2.682
354 3HG2 THR 47 3HG2 THR 47 -0.539 -12.058 -2.774
355 HA PRO 48 HA PRO 48 4.819 -9.141 -3.215
356 1HB PRO 48 2HB PRO 48 4.145 -6.666 -2.344
357 2HB PRO 48 1HB PRO 48 4.733 -6.966 -3.985
358 1HG PRO 48 2HG PRO 48 1.927 -6.592 -3.013
359 2HG PRO 48 1HG PRO 48 2.703 -5.950 -4.471
360 1HD PRO 48 2HD PRO 48 1.068 -8.116 -4.495
361 2HD PRO 48 1HD PRO 48 2.394 -7.894 -5.645
362 H ASP 49 H ASP 49 5.269 -8.662 -0.905
363 HA ASP 49 HA ASP 49 3.369 -10.019 0.755
364 1HB ASP 49 2HB ASP 49 6.035 -8.726 1.329
365 2HB ASP 49 1HB ASP 49 5.052 -9.479 2.583
366 H VAL 50 H VAL 50 4.040 -6.710 -0.003
367 HA VAL 50 HA VAL 50 1.917 -5.880 1.828
368 HB VAL 50 HB VAL 50 3.998 -5.561 3.074
369 1HG1 VAL 50 1HG1 VAL 50 5.045 -4.905 0.596
370 2HG1 VAL 50 2HG1 VAL 50 5.877 -4.825 2.151
371 3HG1 VAL 50 3HG1 VAL 50 5.073 -3.393 1.506
372 1HG2 VAL 50 1HG2 VAL 50 3.099 -2.831 2.219
373 2HG2 VAL 50 2HG2 VAL 50 3.590 -3.392 3.820
374 3HG2 VAL 50 3HG2 VAL 50 2.043 -3.902 3.144
375 H LEU 51 H LEU 51 1.229 -3.573 1.375
376 HA LEU 51 HA LEU 51 1.936 -2.525 -1.239
377 1HB LEU 51 2HB LEU 51 0.032 -4.322 -1.362
378 2HB LEU 51 1HB LEU 51 -0.969 -3.026 -0.734
379 HG LEU 51 HG LEU 51 -0.413 -1.639 -2.675
380 1HD1 LEU 51 1HD1 LEU 51 1.430 -2.045 -3.839
381 2HD1 LEU 51 2HD1 LEU 51 0.667 -3.507 -4.477
382 3HD1 LEU 51 3HD1 LEU 51 1.657 -3.592 -3.018
383 1HD2 LEU 51 1HD2 LEU 51 -2.333 -2.615 -3.303
384 2HD2 LEU 51 2HD2 LEU 51 -1.788 -4.223 -2.820
385 3HD2 LEU 51 3HD2 LEU 51 -1.318 -3.566 -4.388
386 H LEU 52 H LEU 52 1.706 -0.367 -1.365
387 HA LEU 52 HA LEU 52 0.259 1.020 0.803
388 1HB LEU 52 2HB LEU 52 2.977 1.038 0.381
389 2HB LEU 52 1HB LEU 52 2.461 2.479 -0.470
390 HG LEU 52 HG LEU 52 1.754 1.948 2.407
391 1HD1 LEU 52 1HD1 LEU 52 3.758 3.984 1.969
392 2HD1 LEU 52 2HD1 LEU 52 4.314 2.399 1.431
393 3HD1 LEU 52 3HD1 LEU 52 3.758 2.622 3.090
394 1HD2 LEU 52 1HD2 LEU 52 0.394 3.671 1.995
395 2HD2 LEU 52 2HD2 LEU 52 1.175 4.035 0.456
396 3HD2 LEU 52 3HD2 LEU 52 1.855 4.655 1.960
397 H SER 53 H SER 53 -1.457 2.113 0.002
398 HA SER 53 HA SER 53 -1.329 3.038 -2.786
399 1HB SER 53 2HB SER 53 -3.572 2.149 -1.036
400 2HB SER 53 1HB SER 53 -3.915 3.315 -2.311
401 HG SER 53 HG SER 53 -2.650 1.680 -3.648
402 H ASP 54 H ASP 54 -1.489 5.107 -3.324
403 HA ASP 54 HA ASP 54 -1.267 7.101 -1.255
404 1HB ASP 54 2HB ASP 54 0.139 7.089 -3.303
405 2HB ASP 54 1HB ASP 54 -1.293 7.464 -4.253
406 H ILE 55 H ILE 55 -3.957 5.714 -2.029
407 HA ILE 55 HA ILE 55 -6.119 6.316 -2.581
408 HB ILE 55 HB ILE 55 -6.157 6.343 -0.249
409 1HG1 ILE 55 2HG1 ILE 55 -7.321 9.035 -0.414
410 2HG1 ILE 55 1HG1 ILE 55 -7.895 7.897 -1.626
411 1HG2 ILE 55 1HG2 ILE 55 -5.520 9.052 0.443
412 2HG2 ILE 55 2HG2 ILE 55 -4.176 8.278 -0.392
413 3HG2 ILE 55 3HG2 ILE 55 -4.857 7.536 1.053
414 1HD1 ILE 55 1HD1 ILE 55 -8.444 8.042 1.224
415 2HD1 ILE 55 2HD1 ILE 55 -7.977 6.426 0.690
416 3HD1 ILE 55 3HD1 ILE 55 -9.347 7.243 -0.065
417 H ARG 56 H ARG 56 -6.005 9.584 -1.453
418 HA ARG 56 HA ARG 56 -6.471 11.546 -2.479
419 1HB ARG 56 2HB ARG 56 -4.078 10.620 -3.455
420 2HB ARG 56 1HB ARG 56 -4.967 11.001 -4.923
421 1HG ARG 56 2HG ARG 56 -5.251 13.264 -4.265
422 2HG ARG 56 1HG ARG 56 -4.660 12.927 -2.636
423 1HD ARG 56 2HD ARG 56 -2.462 12.705 -3.340
424 2HD ARG 56 1HD ARG 56 -2.925 12.398 -5.013
425 HE ARG 56 HE ARG 56 -3.758 14.919 -4.662
426 1HH1 ARG 56 1HH1 ARG 56 -0.726 13.350 -3.938
427 2HH1 ARG 56 2HH1 ARG 56 0.212 14.792 -4.140
428 1HH2 ARG 56 1HH2 ARG 56 -2.526 16.815 -4.929
429 2HH2 ARG 56 2HH2 ARG 56 -0.809 16.758 -4.702
430 H MET 57 H MET 57 -8.499 9.688 -2.942
431 HA MET 57 HA MET 57 -10.240 9.168 -4.303
432 1HB MET 57 2HB MET 57 -10.266 11.755 -3.962
433 2HB MET 57 1HB MET 57 -9.890 11.793 -5.679
434 1HG MET 57 2HG MET 57 -11.929 10.179 -5.873
435 2HG MET 57 1HG MET 57 -12.360 10.850 -4.300
436 1HE MET 57 1HE MET 57 -14.382 11.685 -4.749
437 2HE MET 57 2HE MET 57 -14.854 12.994 -5.830
438 3HE MET 57 3HE MET 57 -13.972 13.352 -4.346
439 HA PRO 58 HA PRO 58 -7.735 8.167 -8.107
440 1HB PRO 58 2HB PRO 58 -7.648 5.479 -7.748
441 2HB PRO 58 1HB PRO 58 -6.430 6.570 -7.083
442 1HG PRO 58 2HG PRO 58 -8.724 5.240 -5.721
443 2HG PRO 58 1HG PRO 58 -7.100 5.583 -5.111
444 1HD PRO 58 2HD PRO 58 -9.343 7.062 -4.532
445 2HD PRO 58 1HD PRO 58 -7.688 7.665 -4.416
446 H GLY 59 H GLY 59 -9.773 5.436 -7.104
447 1HA GLY 59 2HA GLY 59 -11.521 5.986 -9.413
448 2HA GLY 59 1HA GLY 59 -11.205 4.386 -8.755
449 H MET 60 H MET 60 -11.432 5.394 -5.986
450 HA MET 60 HA MET 60 -14.172 6.285 -5.723
451 1HB MET 60 2HB MET 60 -14.427 3.840 -5.985
452 2HB MET 60 1HB MET 60 -13.330 3.596 -4.636
453 1HG MET 60 2HG MET 60 -15.181 3.468 -3.413
454 2HG MET 60 1HG MET 60 -15.165 5.229 -3.509
455 1HE MET 60 1HE MET 60 -17.347 2.910 -3.043
456 2HE MET 60 2HE MET 60 -17.277 1.979 -4.541
457 3HE MET 60 3HE MET 60 -18.688 2.979 -4.187
458 H ASP 61 H ASP 61 -12.491 7.896 -4.966
459 HA ASP 61 HA ASP 61 -11.733 9.177 -3.271
460 1HB ASP 61 2HB ASP 61 -13.678 7.458 -2.035
461 2HB ASP 61 1HB ASP 61 -12.377 7.841 -0.910
462 H GLY 62 H GLY 62 -11.012 5.787 -3.277
463 1HA GLY 62 2HA GLY 62 -8.424 5.625 -3.269
464 2HA GLY 62 1HA GLY 62 -8.640 6.177 -1.617
465 H LEU 63 H LEU 63 -11.137 4.784 -1.285
466 HA LEU 63 HA LEU 63 -10.092 2.303 -0.397
467 1HB LEU 63 2HB LEU 63 -13.016 2.949 -0.593
468 2HB LEU 63 1HB LEU 63 -12.203 1.903 0.558
469 HG LEU 63 HG LEU 63 -11.005 4.224 1.174
470 1HD1 LEU 63 1HD1 LEU 63 -12.990 5.069 -0.579
471 2HD1 LEU 63 2HD1 LEU 63 -12.035 6.066 0.516
472 3HD1 LEU 63 3HD1 LEU 63 -13.605 5.447 1.030
473 1HD2 LEU 63 1HD2 LEU 63 -12.709 2.511 2.396
474 2HD2 LEU 63 2HD2 LEU 63 -13.635 4.010 2.422
475 3HD2 LEU 63 3HD2 LEU 63 -12.028 3.959 3.139
476 H ALA 64 H ALA 64 -11.362 3.407 -3.370
477 HA ALA 64 HA ALA 64 -12.617 1.150 -4.418
478 1HB ALA 64 1HB ALA 64 -12.702 2.510 -6.187
479 2HB ALA 64 2HB ALA 64 -10.983 2.233 -6.468
480 3HB ALA 64 3HB ALA 64 -11.504 3.571 -5.445
481 H LEU 65 H LEU 65 -9.216 1.940 -4.080
482 HA LEU 65 HA LEU 65 -8.124 -0.203 -5.524
483 1HB LEU 65 2HB LEU 65 -7.164 1.718 -3.478
484 2HB LEU 65 1HB LEU 65 -6.200 0.278 -3.727
485 HG LEU 65 HG LEU 65 -7.011 1.989 -6.047
486 1HD1 LEU 65 1HD1 LEU 65 -5.339 3.497 -5.737
487 2HD1 LEU 65 2HD1 LEU 65 -4.350 2.379 -4.796
488 3HD1 LEU 65 3HD1 LEU 65 -5.736 3.172 -4.050
489 1HD2 LEU 65 1HD2 LEU 65 -4.398 0.745 -6.067
490 2HD2 LEU 65 2HD2 LEU 65 -5.723 0.615 -7.224
491 3HD2 LEU 65 3HD2 LEU 65 -5.684 -0.433 -5.807
492 H LEU 66 H LEU 66 -9.107 0.106 -2.148
493 HA LEU 66 HA LEU 66 -8.052 -2.305 -1.191
494 1HB LEU 66 2HB LEU 66 -10.355 -0.572 -0.376
495 2HB LEU 66 1HB LEU 66 -10.133 -2.128 0.395
496 HG LEU 66 HG LEU 66 -9.074 -0.709 1.873
497 1HD1 LEU 66 1HD1 LEU 66 -6.825 -1.391 -0.014
498 2HD1 LEU 66 2HD1 LEU 66 -7.540 -2.506 1.150
499 3HD1 LEU 66 3HD1 LEU 66 -6.698 -1.063 1.714
500 1HD2 LEU 66 1HD2 LEU 66 -7.322 0.982 0.618
501 2HD2 LEU 66 2HD2 LEU 66 -8.931 1.410 1.197
502 3HD2 LEU 66 3HD2 LEU 66 -8.691 0.953 -0.490
503 H LYS 67 H LYS 67 -11.146 -1.532 -2.685
504 HA LYS 67 HA LYS 67 -12.372 -4.026 -2.465
505 1HB LYS 67 2HB LYS 67 -13.211 -1.686 -3.381
506 2HB LYS 67 1HB LYS 67 -12.793 -2.407 -4.930
507 1HG LYS 67 2HG LYS 67 -14.479 -3.946 -3.018
508 2HG LYS 67 1HG LYS 67 -15.202 -2.642 -3.962
509 1HD LYS 67 2HD LYS 67 -13.544 -4.312 -5.628
510 2HD LYS 67 1HD LYS 67 -14.748 -5.281 -4.777
511 1HE LYS 67 2HE LYS 67 -16.473 -3.628 -5.549
512 2HE LYS 67 1HE LYS 67 -15.224 -2.904 -6.562
513 1HZ LYS 67 1HZ LYS 67 -16.563 -4.477 -7.804
514 2HZ LYS 67 2HZ LYS 67 -16.166 -5.714 -6.723
515 3HZ LYS 67 3HZ LYS 67 -14.965 -5.023 -7.693
516 H GLN 68 H GLN 68 -10.244 -2.736 -4.993
517 HA GLN 68 HA GLN 68 -10.376 -5.087 -6.604
518 1HB GLN 68 2HB GLN 68 -8.480 -2.737 -6.583
519 2HB GLN 68 1HB GLN 68 -8.363 -4.057 -7.734
520 1HG GLN 68 2HG GLN 68 -10.629 -2.109 -7.425
521 2HG GLN 68 1HG GLN 68 -9.487 -2.222 -8.763
522 1HE2 GLN 68 1HE2 GLN 68 -9.412 -4.698 -9.530
523 2HE2 GLN 68 2HE2 GLN 68 -10.971 -5.313 -9.956
524 H ILE 69 H ILE 69 -8.163 -3.840 -4.153
525 HA ILE 69 HA ILE 69 -6.131 -5.730 -4.524
526 HB ILE 69 HB ILE 69 -6.874 -4.204 -2.038
527 1HG1 ILE 69 2HG1 ILE 69 -4.449 -3.630 -3.667
528 2HG1 ILE 69 1HG1 ILE 69 -6.008 -3.122 -4.309
529 1HG2 ILE 69 1HG2 ILE 69 -5.172 -6.416 -2.221
530 2HG2 ILE 69 2HG2 ILE 69 -5.296 -5.271 -0.891
531 3HG2 ILE 69 3HG2 ILE 69 -4.110 -5.008 -2.171
532 1HD1 ILE 69 1HD1 ILE 69 -5.822 -1.298 -3.077
533 2HD1 ILE 69 2HD1 ILE 69 -4.397 -1.929 -2.255
534 3HD1 ILE 69 3HD1 ILE 69 -6.011 -2.307 -1.645
535 H LYS 70 H LYS 70 -9.061 -5.822 -2.630
536 HA LYS 70 HA LYS 70 -8.380 -8.231 -1.275
537 1HB LYS 70 2HB LYS 70 -10.612 -8.195 -0.384
538 2HB LYS 70 1HB LYS 70 -9.977 -6.556 -0.360
539 1HG LYS 70 2HG LYS 70 -11.929 -6.010 -1.281
540 2HG LYS 70 1HG LYS 70 -11.203 -6.611 -2.769
541 1HD LYS 70 2HD LYS 70 -12.135 -8.915 -1.744
542 2HD LYS 70 1HD LYS 70 -13.318 -7.784 -1.082
543 1HE LYS 70 2HE LYS 70 -12.870 -7.116 -3.810
544 2HE LYS 70 1HE LYS 70 -13.159 -8.851 -3.710
545 1HZ LYS 70 1HZ LYS 70 -14.919 -6.710 -2.644
546 2HZ LYS 70 2HZ LYS 70 -15.189 -8.367 -2.449
547 3HZ LYS 70 3HZ LYS 70 -15.225 -7.683 -3.995
548 H GLN 71 H GLN 71 -9.876 -7.445 -4.287
549 HA GLN 71 HA GLN 71 -10.957 -10.079 -4.644
550 1HB GLN 71 2HB GLN 71 -12.362 -8.515 -5.589
551 2HB GLN 71 1HB GLN 71 -11.039 -7.522 -6.173
552 1HG GLN 71 2HG GLN 71 -10.977 -10.058 -7.504
553 2HG GLN 71 1HG GLN 71 -12.601 -9.385 -7.594
554 1HE2 GLN 71 1HE2 GLN 71 -9.694 -7.446 -7.388
555 2HE2 GLN 71 2HE2 GLN 71 -9.790 -6.796 -8.986
556 H ARG 72 H ARG 72 -8.163 -8.273 -5.681
557 HA ARG 72 HA ARG 72 -7.359 -10.431 -7.475
558 1HB ARG 72 2HB ARG 72 -6.195 -7.695 -6.983
559 2HB ARG 72 1HB ARG 72 -5.423 -8.894 -8.012
560 1HG ARG 72 2HG ARG 72 -7.788 -8.904 -9.177
561 2HG ARG 72 1HG ARG 72 -7.876 -7.292 -8.460
562 1HD ARG 72 2HD ARG 72 -6.710 -6.552 -10.200
563 2HD ARG 72 1HD ARG 72 -5.328 -7.429 -9.553
564 HE ARG 72 HE ARG 72 -5.820 -9.224 -11.037
565 1HH1 ARG 72 1HH1 ARG 72 -7.789 -6.382 -11.575
566 2HH1 ARG 72 2HH1 ARG 72 -8.200 -6.827 -13.194
567 1HH2 ARG 72 1HH2 ARG 72 -6.369 -9.803 -13.163
568 2HH2 ARG 72 2HH2 ARG 72 -7.398 -8.766 -14.096
569 H HIS 73 H HIS 73 -6.638 -9.216 -4.323
570 HA HIS 73 HA HIS 73 -4.269 -10.957 -4.210
571 1HB HIS 73 2HB HIS 73 -4.844 -8.955 -2.065
572 2HB HIS 73 1HB HIS 73 -3.307 -9.610 -2.602
573 HD1 HIS 73 1HD HIS 73 -2.433 -7.148 -2.655
574 HD2 HIS 73 2HD HIS 73 -5.452 -7.941 -5.372
575 HE1 HIS 73 1HE HIS 73 -2.408 -5.240 -4.274
576 HE2 HIS 73 2HE HIS 73 -4.281 -5.711 -5.874
577 HA PRO 74 HA PRO 74 -6.504 -13.775 -1.602
578 1HB PRO 74 2HB PRO 74 -3.843 -14.364 -0.439
579 2HB PRO 74 1HB PRO 74 -5.002 -15.455 -1.200
580 1HG PRO 74 2HG PRO 74 -2.759 -14.748 -2.455
581 2HG PRO 74 1HG PRO 74 -4.283 -14.941 -3.341
582 1HD PRO 74 2HD PRO 74 -2.909 -12.433 -2.456
583 2HD PRO 74 1HD PRO 74 -3.761 -12.778 -3.976
584 H MET 75 H MET 75 -3.731 -12.194 0.021
585 HA MET 75 HA MET 75 -5.472 -11.024 2.002
586 1HB MET 75 2HB MET 75 -3.567 -13.250 2.694
587 2HB MET 75 1HB MET 75 -4.094 -12.075 3.889
588 1HG MET 75 2HG MET 75 -6.443 -12.730 3.403
589 2HG MET 75 1HG MET 75 -5.819 -14.003 2.356
590 1HE MET 75 1HE MET 75 -7.275 -15.808 3.898
591 2HE MET 75 2HE MET 75 -6.085 -16.779 4.764
592 3HE MET 75 3HE MET 75 -5.769 -16.268 3.107
593 H LEU 76 H LEU 76 -3.690 -9.970 0.056
594 HA LEU 76 HA LEU 76 -1.211 -9.214 1.213
595 1HB LEU 76 2HB LEU 76 -2.250 -9.162 -1.277
596 2HB LEU 76 1HB LEU 76 -2.368 -7.469 -0.843
597 HG LEU 76 HG LEU 76 0.197 -9.012 -0.583
598 1HD1 LEU 76 1HD1 LEU 76 0.028 -7.229 -2.863
599 2HD1 LEU 76 2HD1 LEU 76 -1.112 -8.571 -2.973
600 3HD1 LEU 76 3HD1 LEU 76 0.609 -8.891 -2.764
601 1HD2 LEU 76 1HD2 LEU 76 1.076 -6.635 -0.894
602 2HD2 LEU 76 2HD2 LEU 76 0.307 -7.027 0.644
603 3HD2 LEU 76 3HD2 LEU 76 -0.579 -6.114 -0.575
604 HA PRO 77 HA PRO 77 -2.910 -6.072 3.914
605 1HB PRO 77 2HB PRO 77 -0.107 -5.344 4.398
606 2HB PRO 77 1HB PRO 77 -1.317 -5.960 5.526
607 1HG PRO 77 2HG PRO 77 0.770 -7.455 4.715
608 2HG PRO 77 1HG PRO 77 -0.816 -8.161 5.076
609 1HD PRO 77 2HD PRO 77 0.415 -7.512 2.425
610 2HD PRO 77 1HD PRO 77 -0.529 -8.937 2.913
611 H VAL 78 H VAL 78 -3.680 -4.226 3.172
612 HA VAL 78 HA VAL 78 -2.097 -2.609 1.318
613 HB VAL 78 HB VAL 78 -4.981 -2.147 2.054
614 1HG1 VAL 78 1HG1 VAL 78 -4.921 -1.125 -0.282
615 2HG1 VAL 78 2HG1 VAL 78 -3.166 -1.222 -0.151
616 3HG1 VAL 78 3HG1 VAL 78 -4.083 -0.258 1.003
617 1HG2 VAL 78 1HG2 VAL 78 -4.116 -3.628 -0.404
618 2HG2 VAL 78 2HG2 VAL 78 -5.718 -3.528 0.326
619 3HG2 VAL 78 3HG2 VAL 78 -4.453 -4.478 1.103
620 H ILE 79 H ILE 79 -1.542 -0.525 1.731
621 HA ILE 79 HA ILE 79 -2.255 0.549 4.376
622 HB ILE 79 HB ILE 79 0.427 0.913 3.063
623 1HG1 ILE 79 2HG1 ILE 79 0.467 -0.637 5.504
624 2HG1 ILE 79 1HG1 ILE 79 -0.548 -1.413 4.293
625 1HG2 ILE 79 1HG2 ILE 79 0.911 2.338 4.706
626 2HG2 ILE 79 2HG2 ILE 79 0.231 1.272 5.936
627 3HG2 ILE 79 3HG2 ILE 79 -0.821 2.370 5.042
628 1HD1 ILE 79 1HD1 ILE 79 2.194 -1.587 4.511
629 2HD1 ILE 79 2HD1 ILE 79 1.937 -0.485 3.160
630 3HD1 ILE 79 3HD1 ILE 79 1.211 -2.090 3.138
631 H ILE 80 H ILE 80 -3.519 2.238 4.025
632 HA ILE 80 HA ILE 80 -3.033 3.953 1.696
633 HB ILE 80 HB ILE 80 -5.382 4.255 3.517
634 1HG1 ILE 80 2HG1 ILE 80 -5.349 1.879 2.988
635 2HG1 ILE 80 1HG1 ILE 80 -6.642 2.668 2.090
636 1HG2 ILE 80 1HG2 ILE 80 -4.535 5.628 1.324
637 2HG2 ILE 80 2HG2 ILE 80 -6.194 5.587 1.912
638 3HG2 ILE 80 3HG2 ILE 80 -5.690 4.497 0.621
639 1HD1 ILE 80 1HD1 ILE 80 -5.250 2.693 0.095
640 2HD1 ILE 80 2HD1 ILE 80 -5.458 1.056 0.717
641 3HD1 ILE 80 3HD1 ILE 80 -3.946 1.917 0.994
642 H MET 81 H MET 81 -2.626 6.134 1.880
643 HA MET 81 HA MET 81 -1.378 7.012 4.273
644 1HB MET 81 2HB MET 81 -1.100 9.148 3.149
645 2HB MET 81 1HB MET 81 -0.680 7.825 2.083
646 1HG MET 81 2HG MET 81 -2.883 8.040 1.014
647 2HG MET 81 1HG MET 81 -3.209 9.446 2.026
648 1HE MET 81 1HE MET 81 -1.712 12.091 1.321
649 2HE MET 81 2HE MET 81 -0.046 11.585 1.042
650 3HE MET 81 3HE MET 81 -0.954 10.922 2.401
651 H THR 82 H THR 82 -4.446 8.165 2.736
652 HA THR 82 HA THR 82 -5.320 8.835 5.466
653 HB THR 82 HB THR 82 -6.042 10.567 3.118
654 HG1 THR 82 1HG THR 82 -4.332 11.957 4.009
655 1HG2 THR 82 1HG2 THR 82 -5.919 11.117 6.074
656 2HG2 THR 82 2HG2 THR 82 -7.382 10.878 5.119
657 3HG2 THR 82 3HG2 THR 82 -6.354 12.281 4.821
658 H ALA 83 H ALA 83 -7.565 8.810 5.865
659 HA ALA 83 HA ALA 83 -9.103 7.249 3.900
660 1HB ALA 83 1HB ALA 83 -8.427 6.504 6.453
661 2HB ALA 83 2HB ALA 83 -9.727 5.813 5.484
662 3HB ALA 83 3HB ALA 83 -10.076 7.099 6.638
663 H HIS 84 H HIS 84 -9.171 10.002 3.623
664 HA HIS 84 HA HIS 84 -11.372 11.140 5.083
665 1HB HIS 84 2HB HIS 84 -11.132 13.012 3.389
666 2HB HIS 84 1HB HIS 84 -9.703 12.678 4.361
667 HD1 HIS 84 1HD HIS 84 -11.042 12.327 0.867
668 HD2 HIS 84 2HD HIS 84 -7.475 11.837 2.936
669 HE1 HIS 84 1HE HIS 84 -9.278 12.015 -0.898
670 HE2 HIS 84 2HE HIS 84 -7.143 11.629 0.379
671 H SER 85 H SER 85 -12.535 8.953 4.231
672 HA SER 85 HA SER 85 -14.534 9.899 2.385
673 1HB SER 85 2HB SER 85 -13.329 7.318 1.531
674 2HB SER 85 1HB SER 85 -14.130 8.559 0.568
675 HG SER 85 HG SER 85 -11.519 8.194 0.978
676 H ASP 86 H ASP 86 -15.608 7.384 1.689
677 HA ASP 86 HA ASP 86 -17.116 6.776 4.005
678 1HB ASP 86 2HB ASP 86 -17.441 6.373 1.313
679 2HB ASP 86 1HB ASP 86 -17.100 4.741 1.878
680 H LEU 87 H LEU 87 -15.695 6.136 5.636
681 HA LEU 87 HA LEU 87 -13.623 4.381 5.612
682 1HB LEU 87 2HB LEU 87 -15.231 5.561 7.566
683 2HB LEU 87 1HB LEU 87 -15.290 3.843 7.916
684 HG LEU 87 HG LEU 87 -13.506 5.102 9.133
685 1HD1 LEU 87 1HD1 LEU 87 -12.498 3.141 9.302
686 2HD1 LEU 87 2HD1 LEU 87 -11.806 3.312 7.690
687 3HD1 LEU 87 3HD1 LEU 87 -13.402 2.591 7.893
688 1HD2 LEU 87 1HD2 LEU 87 -13.024 6.328 6.774
689 2HD2 LEU 87 2HD2 LEU 87 -11.755 5.106 6.779
690 3HD2 LEU 87 3HD2 LEU 87 -11.875 6.256 8.108
691 H ASP 88 H ASP 88 -16.919 3.570 5.063
692 HA ASP 88 HA ASP 88 -17.181 0.986 5.888
693 1HB ASP 88 2HB ASP 88 -18.281 2.569 3.650
694 2HB ASP 88 1HB ASP 88 -18.429 0.822 3.494
695 H ALA 89 H ALA 89 -15.828 1.949 2.703
696 HA ALA 89 HA ALA 89 -15.158 -0.695 1.966
697 1HB ALA 89 1HB ALA 89 -15.347 0.775 0.167
698 2HB ALA 89 2HB ALA 89 -13.609 0.503 0.301
699 3HB ALA 89 3HB ALA 89 -14.322 1.990 0.931
700 H ALA 90 H ALA 90 -13.608 1.585 4.017
701 HA ALA 90 HA ALA 90 -10.966 0.479 3.793
702 1HB ALA 90 1HB ALA 90 -10.470 1.883 5.787
703 2HB ALA 90 2HB ALA 90 -12.172 2.354 5.829
704 3HB ALA 90 3HB ALA 90 -11.170 2.783 4.441
705 H VAL 91 H VAL 91 -13.647 0.193 6.093
706 HA VAL 91 HA VAL 91 -12.275 -1.449 7.928
707 HB VAL 91 HB VAL 91 -15.251 -1.531 7.470
708 1HG1 VAL 91 1HG1 VAL 91 -14.863 -1.736 10.130
709 2HG1 VAL 91 2HG1 VAL 91 -13.376 -2.479 9.539
710 3HG1 VAL 91 3HG1 VAL 91 -14.942 -3.122 9.043
711 1HG2 VAL 91 1HG2 VAL 91 -14.109 0.813 7.796
712 2HG2 VAL 91 2HG2 VAL 91 -14.004 0.295 9.476
713 3HG2 VAL 91 3HG2 VAL 91 -15.575 0.401 8.682
714 H SER 92 H SER 92 -14.274 -2.146 5.112
715 HA SER 92 HA SER 92 -14.369 -4.942 5.383
716 1HB SER 92 2HB SER 92 -14.565 -3.105 2.997
717 2HB SER 92 1HB SER 92 -14.667 -4.857 2.827
718 HG SER 92 HG SER 92 -16.695 -4.556 3.275
719 H ALA 93 H ALA 93 -11.997 -2.759 4.005
720 HA ALA 93 HA ALA 93 -10.391 -4.565 2.647
721 1HB ALA 93 1HB ALA 93 -10.288 -1.884 3.181
722 2HB ALA 93 2HB ALA 93 -9.056 -2.805 2.321
723 3HB ALA 93 3HB ALA 93 -8.885 -2.505 4.051
724 H TYR 94 H TYR 94 -10.310 -3.590 6.024
725 HA TYR 94 HA TYR 94 -8.066 -5.010 6.841
726 1HB TYR 94 2HB TYR 94 -10.546 -4.648 8.526
727 2HB TYR 94 1HB TYR 94 -8.885 -4.812 9.084
728 HD1 TYR 94 1HD TYR 94 -11.082 -2.568 9.523
729 HD2 TYR 94 2HD TYR 94 -7.622 -2.907 7.072
730 HE1 TYR 94 1HE TYR 94 -10.856 -0.118 9.513
731 HE2 TYR 94 2HE TYR 94 -7.388 -0.459 7.054
732 HH TYR 94 HH TYR 94 -9.853 1.631 8.222
733 H GLN 95 H GLN 95 -11.213 -6.112 5.998
734 HA GLN 95 HA GLN 95 -11.075 -8.649 7.303
735 1HB GLN 95 2HB GLN 95 -13.194 -8.931 6.575
736 2HB GLN 95 1HB GLN 95 -13.093 -7.234 6.140
737 1HG GLN 95 2HG GLN 95 -12.114 -8.379 3.894
738 2HG GLN 95 1HG GLN 95 -13.229 -9.625 4.436
739 1HE2 GLN 95 1HE2 GLN 95 -13.097 -7.458 2.248
740 2HE2 GLN 95 2HE2 GLN 95 -14.681 -6.764 2.293
741 H GLN 96 H GLN 96 -10.325 -7.475 4.071
742 HA GLN 96 HA GLN 96 -9.656 -10.042 3.030
743 1HB GLN 96 2HB GLN 96 -9.009 -8.883 1.038
744 2HB GLN 96 1HB GLN 96 -10.471 -8.118 1.655
745 1HG GLN 96 2HG GLN 96 -9.462 -6.155 1.820
746 2HG GLN 96 1HG GLN 96 -8.128 -6.851 2.738
747 1HE2 GLN 96 1HE2 GLN 96 -8.594 -4.968 0.284
748 2HE2 GLN 96 2HE2 GLN 96 -7.347 -5.470 -0.797
749 H GLY 97 H GLY 97 -7.983 -7.733 4.937
750 1HA GLY 97 2HA GLY 97 -5.898 -8.895 5.864
751 2HA GLY 97 1HA GLY 97 -5.397 -8.928 4.182
752 H ALA 98 H ALA 98 -6.948 -6.108 4.259
753 HA ALA 98 HA ALA 98 -4.822 -4.447 3.983
754 1HB ALA 98 1HB ALA 98 -6.996 -3.634 3.486
755 2HB ALA 98 2HB ALA 98 -6.317 -2.583 4.730
756 3HB ALA 98 3HB ALA 98 -7.507 -3.806 5.165
757 H PHE 99 H PHE 99 -3.514 -3.149 5.280
758 HA PHE 99 HA PHE 99 -3.123 -4.130 7.946
759 1HB PHE 99 2HB PHE 99 -1.224 -3.561 6.440
760 2HB PHE 99 1HB PHE 99 -1.693 -1.868 6.541
761 HD1 PHE 99 1HD PHE 99 -1.101 -4.675 8.941
762 HD2 PHE 99 2HD PHE 99 -0.397 -0.598 7.934
763 HE1 PHE 99 1HE PHE 99 0.284 -4.418 10.961
764 HE2 PHE 99 2HE PHE 99 0.988 -0.336 9.951
765 HZ PHE 99 HZ PHE 99 1.331 -2.246 11.466
766 H ASP 100 H ASP 100 -3.802 -0.891 6.564
767 HA ASP 100 HA ASP 100 -5.820 -0.120 8.236
768 1HB ASP 100 2HB ASP 100 -3.391 -0.327 9.743
769 2HB ASP 100 1HB ASP 100 -3.861 1.366 9.670
770 H TYR 101 H TYR 101 -5.348 2.480 8.908
771 HA TYR 101 HA TYR 101 -4.526 3.720 6.364
772 1HB TYR 101 2HB TYR 101 -6.939 4.148 8.054
773 2HB TYR 101 1HB TYR 101 -6.216 5.578 7.327
774 HD1 TYR 101 1HD TYR 101 -7.625 2.229 6.505
775 HD2 TYR 101 2HD TYR 101 -6.590 6.105 5.093
776 HE1 TYR 101 1HE TYR 101 -8.774 1.760 4.381
777 HE2 TYR 101 2HE TYR 101 -7.741 5.652 2.968
778 HH TYR 101 HH TYR 101 -8.915 4.177 1.779
779 H LEU 102 H LEU 102 -3.514 5.809 6.520
780 HA LEU 102 HA LEU 102 -2.086 6.152 9.057
781 1HB LEU 102 2HB LEU 102 -0.905 5.747 6.867
782 2HB LEU 102 1HB LEU 102 -1.452 7.323 6.355
783 HG LEU 102 HG LEU 102 -0.188 8.298 8.301
784 1HD1 LEU 102 1HD1 LEU 102 1.162 7.055 9.638
785 2HD1 LEU 102 2HD1 LEU 102 1.444 5.830 8.401
786 3HD1 LEU 102 3HD1 LEU 102 -0.069 5.833 9.308
787 1HD2 LEU 102 1HD2 LEU 102 0.648 7.426 5.769
788 2HD2 LEU 102 2HD2 LEU 102 1.975 7.083 6.880
789 3HD2 LEU 102 3HD2 LEU 102 1.334 8.721 6.752
790 HA PRO 103 HA PRO 103 -4.219 9.981 9.766
791 1HB PRO 103 2HB PRO 103 -2.684 11.014 11.715
792 2HB PRO 103 1HB PRO 103 -3.681 9.579 11.973
793 1HG PRO 103 2HG PRO 103 -0.747 9.785 11.461
794 2HG PRO 103 1HG PRO 103 -1.619 8.719 12.575
795 1HD PRO 103 2HD PRO 103 -0.690 7.965 10.098
796 2HD PRO 103 1HD PRO 103 -2.017 7.165 10.954
797 H LYS 104 H LYS 104 -3.107 12.369 10.575
798 HA LYS 104 HA LYS 104 -2.670 13.790 8.331
799 1HB LYS 104 2HB LYS 104 -2.398 14.257 11.117
800 2HB LYS 104 1HB LYS 104 -1.002 14.972 10.321
801 1HG LYS 104 2HG LYS 104 -2.240 16.717 9.768
802 2HG LYS 104 1HG LYS 104 -3.253 15.667 8.776
803 1HD LYS 104 2HD LYS 104 -4.940 15.729 10.247
804 2HD LYS 104 1HD LYS 104 -3.863 15.480 11.622
805 1HE LYS 104 2HE LYS 104 -4.146 17.610 12.178
806 2HE LYS 104 1HE LYS 104 -3.353 18.079 10.678
807 1HZ LYS 104 1HZ LYS 104 -5.939 17.430 9.981
808 2HZ LYS 104 2HZ LYS 104 -5.274 18.982 10.081
809 3HZ LYS 104 3HZ LYS 104 -6.083 18.325 11.412
810 HA PRO 105 HA PRO 105 2.189 13.498 8.693
811 1HB PRO 105 2HB PRO 105 3.061 11.152 9.862
812 2HB PRO 105 1HB PRO 105 2.997 12.720 10.673
813 1HG PRO 105 2HG PRO 105 1.053 10.450 10.776
814 2HG PRO 105 1HG PRO 105 1.618 11.504 12.087
815 1HD PRO 105 2HD PRO 105 -0.781 11.857 10.952
816 2HD PRO 105 1HD PRO 105 0.207 13.241 11.464
817 H PHE 106 H PHE 106 3.564 12.380 7.216
818 HA PHE 106 HA PHE 106 2.714 9.881 6.065
819 1HB PHE 106 2HB PHE 106 2.513 12.438 4.453
820 2HB PHE 106 1HB PHE 106 2.475 10.822 3.749
821 HD1 PHE 106 1HD PHE 106 0.745 9.197 4.958
822 HD2 PHE 106 2HD PHE 106 0.510 13.449 4.837
823 HE1 PHE 106 1HE PHE 106 -1.645 9.089 5.458
824 HE2 PHE 106 2HE PHE 106 -1.902 13.335 5.308
825 HZ PHE 106 HZ PHE 106 -2.984 11.147 5.630
826 H ASP 107 H ASP 107 4.280 11.884 3.790
827 HA ASP 107 HA ASP 107 6.337 11.666 2.837
828 1HB ASP 107 2HB ASP 107 8.166 12.387 4.246
829 2HB ASP 107 1HB ASP 107 6.727 13.311 4.661
830 H ILE 108 H ILE 108 8.640 10.602 3.270
831 HA ILE 108 HA ILE 108 8.277 7.852 3.057
832 HB ILE 108 HB ILE 108 10.090 8.909 1.978
833 1HG1 ILE 108 2HG1 ILE 108 12.002 7.568 3.477
834 2HG1 ILE 108 1HG1 ILE 108 10.516 6.681 3.765
835 1HG2 ILE 108 1HG2 ILE 108 11.682 10.186 2.943
836 2HG2 ILE 108 2HG2 ILE 108 11.472 9.421 4.519
837 3HG2 ILE 108 3HG2 ILE 108 10.264 10.545 3.917
838 1HD1 ILE 108 1HD1 ILE 108 10.936 7.371 0.971
839 2HD1 ILE 108 2HD1 ILE 108 10.498 5.831 1.715
840 3HD1 ILE 108 3HD1 ILE 108 12.189 6.327 1.651
841 H ASP 109 H ASP 109 9.826 9.689 5.558
842 HA ASP 109 HA ASP 109 10.565 7.686 7.263
843 1HB ASP 109 2HB ASP 109 9.882 10.545 7.635
844 2HB ASP 109 1HB ASP 109 9.894 9.556 9.094
845 H GLU 110 H GLU 110 7.407 9.385 7.422
846 HA GLU 110 HA GLU 110 6.465 7.543 9.384
847 1HB GLU 110 2HB GLU 110 4.886 9.628 7.897
848 2HB GLU 110 1HB GLU 110 4.417 8.817 9.380
849 1HG GLU 110 2HG GLU 110 6.984 10.235 9.482
850 2HG GLU 110 1HG GLU 110 5.560 11.252 9.267
851 H ALA 111 H ALA 111 6.214 7.819 5.915
852 HA ALA 111 HA ALA 111 3.968 6.049 5.743
853 1HB ALA 111 1HB ALA 111 5.884 6.971 3.607
854 2HB ALA 111 2HB ALA 111 4.296 7.658 3.977
855 3HB ALA 111 3HB ALA 111 4.422 6.023 3.320
856 H VAL 112 H VAL 112 7.429 5.708 4.922
857 HA VAL 112 HA VAL 112 7.352 2.954 4.418
858 HB VAL 112 HB VAL 112 9.667 4.520 5.551
859 1HG1 VAL 112 1HG1 VAL 112 10.287 2.305 3.786
860 2HG1 VAL 112 2HG1 VAL 112 9.380 1.780 5.203
861 3HG1 VAL 112 3HG1 VAL 112 10.896 2.661 5.403
862 1HG2 VAL 112 1HG2 VAL 112 9.043 5.589 3.542
863 2HG2 VAL 112 2HG2 VAL 112 8.739 4.054 2.733
864 3HG2 VAL 112 3HG2 VAL 112 10.390 4.532 3.124
865 H ALA 113 H ALA 113 7.500 4.785 7.350
866 HA ALA 113 HA ALA 113 8.338 2.785 9.131
867 1HB ALA 113 1HB ALA 113 7.721 4.228 10.821
868 2HB ALA 113 2HB ALA 113 6.324 4.828 9.929
869 3HB ALA 113 3HB ALA 113 7.945 5.342 9.475
870 H LEU 114 H LEU 114 5.130 3.826 8.097
871 HA LEU 114 HA LEU 114 3.729 1.951 9.674
872 1HB LEU 114 2HB LEU 114 2.727 4.042 8.941
873 2HB LEU 114 1HB LEU 114 2.840 3.525 7.269
874 HG LEU 114 HG LEU 114 1.329 1.565 7.966
875 1HD1 LEU 114 1HD1 LEU 114 -0.174 2.183 9.885
876 2HD1 LEU 114 2HD1 LEU 114 1.024 3.398 10.331
877 3HD1 LEU 114 3HD1 LEU 114 1.460 1.690 10.328
878 1HD2 LEU 114 1HD2 LEU 114 -0.499 2.735 7.240
879 2HD2 LEU 114 2HD2 LEU 114 0.790 3.831 6.738
880 3HD2 LEU 114 3HD2 LEU 114 -0.118 4.155 8.216
881 H VAL 115 H VAL 115 5.146 1.800 6.522
882 HA VAL 115 HA VAL 115 3.606 -0.494 5.723
883 HB VAL 115 HB VAL 115 4.630 1.199 4.115
884 1HG1 VAL 115 1HG1 VAL 115 7.077 -0.498 4.592
885 2HG1 VAL 115 2HG1 VAL 115 6.887 1.197 5.024
886 3HG1 VAL 115 3HG1 VAL 115 6.892 0.720 3.329
887 1HG2 VAL 115 1HG2 VAL 115 4.023 -1.529 3.865
888 2HG2 VAL 115 2HG2 VAL 115 5.497 -1.271 2.932
889 3HG2 VAL 115 3HG2 VAL 115 4.057 -0.312 2.591
890 H GLU 116 H GLU 116 6.835 0.079 6.996
891 HA GLU 116 HA GLU 116 7.752 -2.580 6.722
892 1HB GLU 116 2HB GLU 116 8.637 -0.273 8.446
893 2HB GLU 116 1HB GLU 116 9.433 -1.842 8.504
894 1HG GLU 116 2HG GLU 116 9.937 -1.670 6.116
895 2HG GLU 116 1HG GLU 116 9.162 -0.087 6.075
896 H ARG 117 H ARG 117 6.240 -0.843 9.433
897 HA ARG 117 HA ARG 117 6.467 -2.909 11.305
898 1HB ARG 117 2HB ARG 117 4.756 -1.773 12.586
899 2HB ARG 117 1HB ARG 117 5.871 -0.600 11.909
900 1HG ARG 117 2HG ARG 117 4.196 -0.228 10.071
901 2HG ARG 117 1HG ARG 117 3.070 -1.208 11.013
902 1HD ARG 117 2HD ARG 117 4.429 0.944 12.496
903 2HD ARG 117 1HD ARG 117 3.317 1.481 11.242
904 HE ARG 117 HE ARG 117 2.183 -0.510 12.961
905 1HH1 ARG 117 1HH1 ARG 117 2.848 2.897 12.602
906 2HH1 ARG 117 2HH1 ARG 117 1.560 3.389 13.650
907 1HH2 ARG 117 1HH2 ARG 117 0.479 0.140 14.344
908 2HH2 ARG 117 2HH2 ARG 117 0.217 1.827 14.638
909 H ALA 118 H ALA 118 4.385 -2.550 8.594
910 HA ALA 118 HA ALA 118 2.338 -4.337 9.444
911 1HB ALA 118 1HB ALA 118 1.334 -3.885 7.468
912 2HB ALA 118 2HB ALA 118 2.832 -4.036 6.549
913 3HB ALA 118 3HB ALA 118 2.490 -2.553 7.439
914 H ILE 119 H ILE 119 5.132 -4.667 7.256
915 HA ILE 119 HA ILE 119 4.755 -7.435 6.789
916 HB ILE 119 HB ILE 119 7.357 -5.944 6.547
917 1HG1 ILE 119 2HG1 ILE 119 5.625 -6.201 4.163
918 2HG1 ILE 119 1HG1 ILE 119 5.094 -5.037 5.373
919 1HG2 ILE 119 1HG2 ILE 119 7.717 -8.237 6.206
920 2HG2 ILE 119 2HG2 ILE 119 7.609 -7.537 4.591
921 3HG2 ILE 119 3HG2 ILE 119 6.235 -8.416 5.266
922 1HD1 ILE 119 1HD1 ILE 119 7.339 -4.001 5.272
923 2HD1 ILE 119 2HD1 ILE 119 6.432 -3.906 3.760
924 3HD1 ILE 119 3HD1 ILE 119 7.731 -5.090 3.940
925 H SER 120 H SER 120 6.537 -5.556 9.100
926 HA SER 120 HA SER 120 8.172 -7.578 10.167
927 1HB SER 120 2HB SER 120 8.309 -5.029 10.503
928 2HB SER 120 1HB SER 120 7.106 -5.260 11.771
929 HG SER 120 HG SER 120 9.077 -5.400 12.748
930 H HIS 121 H HIS 121 4.904 -6.512 10.949
931 HA HIS 121 HA HIS 121 4.566 -7.995 13.305
932 1HB HIS 121 2HB HIS 121 2.717 -6.759 11.312
933 2HB HIS 121 1HB HIS 121 2.051 -7.869 12.508
934 HD1 HIS 121 1HD HIS 121 4.815 -6.086 13.978
935 HD2 HIS 121 2HD HIS 121 0.790 -5.299 13.309
936 HE1 HIS 121 1HE HIS 121 4.237 -4.186 15.521
937 HE2 HIS 121 2HE HIS 121 1.775 -3.785 15.161
938 H TYR 122 H TYR 122 4.377 -8.881 9.963
939 HA TYR 122 HA TYR 122 3.037 -11.369 10.384
940 1HB TYR 122 2HB TYR 122 4.414 -10.077 8.057
941 2HB TYR 122 1HB TYR 122 3.980 -11.784 7.985
942 HD1 TYR 122 1HD TYR 122 2.862 -8.497 7.378
943 HD2 TYR 122 2HD TYR 122 1.490 -12.331 8.604
944 HE1 TYR 122 1HE TYR 122 0.575 -7.881 6.720
945 HE2 TYR 122 2HE TYR 122 -0.804 -11.729 7.940
946 HH TYR 122 HH TYR 122 -1.808 -9.961 6.173
947 H GLN 123 H GLN 123 6.399 -10.506 9.556
948 HA GLN 123 HA GLN 123 7.339 -13.176 9.916
949 1HB GLN 123 2HB GLN 123 8.308 -10.992 8.612
950 2HB GLN 123 1HB GLN 123 9.315 -10.998 10.052
951 1HG GLN 123 2HG GLN 123 10.589 -12.556 9.151
952 2HG GLN 123 1HG GLN 123 9.210 -13.653 9.100
953 1HE2 GLN 123 1HE2 GLN 123 9.596 -14.617 7.180
954 2HE2 GLN 123 2HE2 GLN 123 9.604 -13.789 5.665
955 H GLU 124 H GLU 124 9.272 -13.555 11.417
956 HA GLU 124 HA GLU 124 10.048 -13.817 13.537
957 1HB GLU 124 2HB GLU 124 9.060 -10.991 13.943
958 2HB GLU 124 1HB GLU 124 10.236 -11.836 14.939
959 1HG GLU 124 2HG GLU 124 10.783 -11.511 12.033
960 2HG GLU 124 1HG GLU 124 10.988 -10.126 13.106
Start of MODEL 23
1 1H MET 1 1HT MET 1 12.273 -16.520 7.695
2 2H MET 1 2HT MET 1 13.985 -16.630 7.719
3 3H MET 1 3HT MET 1 13.092 -17.329 6.430
4 HA MET 1 HA MET 1 12.740 -14.501 6.936
5 1HB MET 1 2HB MET 1 15.310 -15.707 6.587
6 2HB MET 1 1HB MET 1 14.913 -14.822 5.120
7 1HG MET 1 2HG MET 1 14.846 -12.790 6.199
8 2HG MET 1 1HG MET 1 14.544 -13.519 7.776
9 1HE MET 1 1HE MET 1 17.934 -11.638 8.192
10 2HE MET 1 2HE MET 1 16.184 -11.430 8.120
11 3HE MET 1 3HE MET 1 17.154 -11.240 6.660
12 H GLN 2 H GLN 2 11.856 -13.518 5.153
13 HA GLN 2 HA GLN 2 11.219 -15.297 2.892
14 1HB GLN 2 2HB GLN 2 9.397 -14.211 4.487
15 2HB GLN 2 1HB GLN 2 9.628 -12.830 3.423
16 1HG GLN 2 2HG GLN 2 8.280 -13.743 1.933
17 2HG GLN 2 1HG GLN 2 9.358 -15.131 1.796
18 1HE2 GLN 2 1HE2 GLN 2 6.683 -15.440 1.421
19 2HE2 GLN 2 2HE2 GLN 2 5.999 -16.335 2.731
20 H ARG 3 H ARG 3 10.608 -13.898 0.870
21 HA ARG 3 HA ARG 3 12.973 -12.610 0.037
22 1HB ARG 3 2HB ARG 3 11.510 -13.792 -1.532
23 2HB ARG 3 1HB ARG 3 10.232 -12.620 -1.235
24 1HG ARG 3 2HG ARG 3 11.019 -11.602 -3.059
25 2HG ARG 3 1HG ARG 3 12.288 -11.003 -1.992
26 1HD ARG 3 2HD ARG 3 13.287 -13.431 -2.655
27 2HD ARG 3 1HD ARG 3 12.404 -13.025 -4.126
28 HE ARG 3 HE ARG 3 14.078 -10.895 -3.174
29 1HH1 ARG 3 1HH1 ARG 3 13.982 -13.806 -5.096
30 2HH1 ARG 3 2HH1 ARG 3 15.347 -13.362 -6.065
31 1HH2 ARG 3 1HH2 ARG 3 15.875 -10.308 -4.444
32 2HH2 ARG 3 2HH2 ARG 3 16.422 -11.376 -5.695
33 H GLY 4 H GLY 4 10.030 -11.471 1.447
34 1HA GLY 4 2HA GLY 4 9.330 -9.383 2.099
35 2HA GLY 4 1HA GLY 4 11.039 -8.976 2.176
36 H ILE 5 H ILE 5 8.192 -9.015 0.138
37 HA ILE 5 HA ILE 5 9.538 -7.139 -1.694
38 HB ILE 5 HB ILE 5 7.153 -8.862 -2.355
39 1HG1 ILE 5 2HG1 ILE 5 9.213 -9.855 -3.844
40 2HG1 ILE 5 1HG1 ILE 5 10.038 -9.457 -2.340
41 1HG2 ILE 5 1HG2 ILE 5 9.021 -7.613 -4.324
42 2HG2 ILE 5 2HG2 ILE 5 7.726 -6.659 -3.601
43 3HG2 ILE 5 3HG2 ILE 5 7.341 -8.108 -4.530
44 1HD1 ILE 5 1HD1 ILE 5 8.991 -11.814 -2.696
45 2HD1 ILE 5 2HD1 ILE 5 7.496 -10.999 -2.237
46 3HD1 ILE 5 3HD1 ILE 5 8.869 -11.010 -1.132
47 H VAL 6 H VAL 6 8.875 -5.108 -1.486
48 HA VAL 6 HA VAL 6 6.159 -4.600 -0.474
49 HB VAL 6 HB VAL 6 8.188 -3.566 0.705
50 1HG1 VAL 6 1HG1 VAL 6 9.322 -1.792 -0.266
51 2HG1 VAL 6 2HG1 VAL 6 8.086 -1.515 -1.476
52 3HG1 VAL 6 3HG1 VAL 6 9.156 -2.903 -1.607
53 1HG2 VAL 6 1HG2 VAL 6 5.891 -2.821 1.076
54 2HG2 VAL 6 2HG2 VAL 6 6.002 -1.755 -0.321
55 3HG2 VAL 6 3HG2 VAL 6 7.005 -1.456 1.098
56 H TRP 7 H TRP 7 4.674 -3.723 -1.764
57 HA TRP 7 HA TRP 7 5.587 -2.576 -4.313
58 1HB TRP 7 2HB TRP 7 3.269 -4.353 -3.666
59 2HB TRP 7 1HB TRP 7 3.174 -3.267 -5.050
60 HD1 TRP 7 HD1 TRP 7 6.642 -4.467 -4.532
61 HE1 TRP 7 1HE TRP 7 7.240 -6.289 -6.227
62 HE3 TRP 7 3HE TRP 7 1.960 -5.449 -6.332
63 HZ2 TRP 7 2HZ TRP 7 5.907 -7.944 -8.075
64 HZ3 TRP 7 3HZ TRP 7 1.713 -7.178 -8.066
65 HH2 TRP 7 HH2 TRP 7 3.652 -8.400 -8.916
66 H VAL 8 H VAL 8 5.026 -0.555 -4.745
67 HA VAL 8 HA VAL 8 3.159 0.758 -2.886
68 HB VAL 8 HB VAL 8 5.126 2.334 -4.475
69 1HG1 VAL 8 1HG1 VAL 8 3.299 3.242 -2.928
70 2HG1 VAL 8 2HG1 VAL 8 4.929 3.893 -2.751
71 3HG1 VAL 8 3HG1 VAL 8 4.331 2.691 -1.607
72 1HG2 VAL 8 1HG2 VAL 8 6.908 1.278 -3.643
73 2HG2 VAL 8 2HG2 VAL 8 5.905 0.255 -2.617
74 3HG2 VAL 8 3HG2 VAL 8 6.413 1.842 -2.048
75 H VAL 9 H VAL 9 1.474 1.900 -3.665
76 HA VAL 9 HA VAL 9 1.306 2.211 -6.587
77 HB VAL 9 HB VAL 9 -1.324 2.175 -5.452
78 1HG1 VAL 9 1HG1 VAL 9 -1.568 0.268 -7.051
79 2HG1 VAL 9 2HG1 VAL 9 0.167 0.348 -7.318
80 3HG1 VAL 9 3HG1 VAL 9 -0.844 1.713 -7.766
81 1HG2 VAL 9 1HG2 VAL 9 -1.245 -0.332 -4.854
82 2HG2 VAL 9 2HG2 VAL 9 -0.703 0.825 -3.642
83 3HG2 VAL 9 3HG2 VAL 9 0.480 -0.072 -4.593
84 H ASP 10 H ASP 10 1.682 4.287 -6.970
85 HA ASP 10 HA ASP 10 -0.063 6.311 -5.874
86 1HB ASP 10 2HB ASP 10 1.882 7.675 -4.999
87 2HB ASP 10 1HB ASP 10 1.505 6.232 -4.062
88 H ASP 11 H ASP 11 1.570 8.543 -6.493
89 HA ASP 11 HA ASP 11 1.119 8.749 -9.263
90 1HB ASP 11 2HB ASP 11 2.636 10.498 -7.332
91 2HB ASP 11 1HB ASP 11 2.426 10.912 -9.030
92 H ASP 12 H ASP 12 3.583 7.103 -7.773
93 HA ASP 12 HA ASP 12 5.498 6.166 -8.563
94 1HB ASP 12 2HB ASP 12 3.901 6.476 -10.785
95 2HB ASP 12 1HB ASP 12 5.383 7.288 -11.274
96 H SER 13 H SER 13 7.165 7.371 -10.727
97 HA SER 13 HA SER 13 9.126 8.534 -10.624
98 1HB SER 13 2HB SER 13 8.708 10.803 -11.236
99 2HB SER 13 1HB SER 13 7.401 9.798 -11.872
100 HG SER 13 HG SER 13 6.021 10.658 -10.467
101 H SER 14 H SER 14 7.705 11.135 -8.847
102 HA SER 14 HA SER 14 9.806 11.441 -7.087
103 1HB SER 14 2HB SER 14 7.981 13.106 -7.568
104 2HB SER 14 1HB SER 14 6.940 12.193 -6.478
105 HG SER 14 HG SER 14 8.766 12.522 -4.921
106 H ILE 15 H ILE 15 6.628 9.992 -6.274
107 HA ILE 15 HA ILE 15 7.387 9.175 -3.705
108 HB ILE 15 HB ILE 15 5.335 7.752 -5.384
109 1HG1 ILE 15 2HG1 ILE 15 4.982 10.217 -5.470
110 2HG1 ILE 15 1HG1 ILE 15 3.693 9.374 -4.621
111 1HG2 ILE 15 1HG2 ILE 15 5.805 6.635 -3.323
112 2HG2 ILE 15 2HG2 ILE 15 4.251 7.451 -3.155
113 3HG2 ILE 15 3HG2 ILE 15 5.695 8.144 -2.419
114 1HD1 ILE 15 1HD1 ILE 15 4.143 10.382 -2.675
115 2HD1 ILE 15 2HD1 ILE 15 4.922 11.584 -3.707
116 3HD1 ILE 15 3HD1 ILE 15 5.888 10.330 -2.927
117 H ARG 16 H ARG 16 8.002 7.779 -6.799
118 HA ARG 16 HA ARG 16 8.547 5.126 -5.913
119 1HB ARG 16 2HB ARG 16 8.023 5.555 -8.243
120 2HB ARG 16 1HB ARG 16 9.432 6.596 -8.399
121 1HG ARG 16 2HG ARG 16 10.663 4.373 -7.608
122 2HG ARG 16 1HG ARG 16 9.244 3.644 -8.353
123 1HD ARG 16 2HD ARG 16 10.466 5.770 -9.949
124 2HD ARG 16 1HD ARG 16 11.523 4.386 -9.671
125 HE ARG 16 HE ARG 16 9.164 3.271 -10.443
126 1HH1 ARG 16 1HH1 ARG 16 11.298 5.660 -11.828
127 2HH1 ARG 16 2HH1 ARG 16 10.885 5.263 -13.462
128 1HH2 ARG 16 1HH2 ARG 16 8.620 2.747 -12.589
129 2HH2 ARG 16 2HH2 ARG 16 9.365 3.611 -13.894
130 H TRP 17 H TRP 17 10.712 7.800 -6.856
131 HA TRP 17 HA TRP 17 13.102 6.516 -6.203
132 1HB TRP 17 2HB TRP 17 12.940 8.562 -7.586
133 2HB TRP 17 1HB TRP 17 12.553 9.484 -6.136
134 HD1 TRP 17 HD1 TRP 17 15.470 7.790 -7.915
135 HE1 TRP 17 1HE TRP 17 17.667 8.528 -6.794
136 HE3 TRP 17 3HE TRP 17 13.530 10.294 -3.908
137 HZ2 TRP 17 2HZ TRP 17 18.470 9.982 -4.512
138 HZ3 TRP 17 3HZ TRP 17 15.080 11.331 -2.300
139 HH2 TRP 17 HH2 TRP 17 17.501 11.178 -2.597
140 H VAL 18 H VAL 18 11.064 8.650 -4.236
141 HA VAL 18 HA VAL 18 12.799 8.789 -2.039
142 HB VAL 18 HB VAL 18 9.811 8.968 -1.783
143 1HG1 VAL 18 1HG1 VAL 18 11.684 9.142 0.116
144 2HG1 VAL 18 2HG1 VAL 18 10.188 10.072 0.159
145 3HG1 VAL 18 3HG1 VAL 18 11.674 10.821 -0.425
146 1HG2 VAL 18 1HG2 VAL 18 9.706 10.744 -3.117
147 2HG2 VAL 18 2HG2 VAL 18 11.385 10.476 -3.578
148 3HG2 VAL 18 3HG2 VAL 18 11.004 11.533 -2.221
149 H LEU 19 H LEU 19 10.067 6.659 -2.654
150 HA LEU 19 HA LEU 19 10.478 5.266 -0.189
151 1HB LEU 19 2HB LEU 19 8.244 5.734 -1.404
152 2HB LEU 19 1HB LEU 19 8.650 4.312 -2.346
153 HG LEU 19 HG LEU 19 8.642 2.929 -0.362
154 1HD1 LEU 19 1HD1 LEU 19 9.187 5.270 1.001
155 2HD1 LEU 19 2HD1 LEU 19 8.844 3.699 1.717
156 3HD1 LEU 19 3HD1 LEU 19 7.545 4.869 1.494
157 1HD2 LEU 19 1HD2 LEU 19 6.161 4.522 0.003
158 2HD2 LEU 19 2HD2 LEU 19 6.375 2.778 -0.158
159 3HD2 LEU 19 3HD2 LEU 19 6.472 3.814 -1.580
160 H GLU 20 H GLU 20 11.508 4.798 -3.459
161 HA GLU 20 HA GLU 20 11.854 2.001 -3.286
162 1HB GLU 20 2HB GLU 20 13.170 2.132 -5.275
163 2HB GLU 20 1HB GLU 20 11.813 3.225 -5.438
164 1HG GLU 20 2HG GLU 20 13.319 5.100 -4.898
165 2HG GLU 20 1HG GLU 20 14.665 3.964 -4.845
166 H ARG 21 H ARG 21 14.279 4.582 -3.110
167 HA ARG 21 HA ARG 21 16.419 2.955 -2.356
168 1HB ARG 21 2HB ARG 21 15.900 5.888 -1.900
169 2HB ARG 21 1HB ARG 21 17.416 5.110 -1.470
170 1HG ARG 21 2HG ARG 21 16.526 4.607 -4.216
171 2HG ARG 21 1HG ARG 21 16.895 6.293 -3.854
172 1HD ARG 21 2HD ARG 21 18.803 4.166 -2.996
173 2HD ARG 21 1HD ARG 21 18.766 4.655 -4.688
174 HE ARG 21 HE ARG 21 19.146 6.632 -2.543
175 1HH1 ARG 21 1HH1 ARG 21 20.253 5.100 -5.489
176 2HH1 ARG 21 2HH1 ARG 21 21.521 6.250 -5.749
177 1HH2 ARG 21 1HH2 ARG 21 20.815 8.132 -2.893
178 2HH2 ARG 21 2HH2 ARG 21 21.840 7.964 -4.279
179 H ALA 22 H ALA 22 14.271 4.916 -0.294
180 HA ALA 22 HA ALA 22 15.426 4.337 2.148
181 1HB ALA 22 1HB ALA 22 13.445 5.919 1.492
182 2HB ALA 22 2HB ALA 22 13.580 5.282 3.131
183 3HB ALA 22 3HB ALA 22 12.463 4.540 1.986
184 H LEU 23 H LEU 23 12.846 2.579 0.517
185 HA LEU 23 HA LEU 23 12.638 0.600 2.543
186 1HB LEU 23 2HB LEU 23 10.882 1.223 0.812
187 2HB LEU 23 1HB LEU 23 11.803 0.254 -0.322
188 HG LEU 23 HG LEU 23 9.789 -0.820 0.845
189 1HD1 LEU 23 1HD1 LEU 23 11.719 -1.915 -0.447
190 2HD1 LEU 23 2HD1 LEU 23 10.736 -2.929 0.605
191 3HD1 LEU 23 3HD1 LEU 23 12.323 -2.385 1.140
192 1HD2 LEU 23 1HD2 LEU 23 11.796 -1.131 3.070
193 2HD2 LEU 23 2HD2 LEU 23 10.163 -1.795 3.005
194 3HD2 LEU 23 3HD2 LEU 23 10.400 -0.052 3.119
195 H ALA 24 H ALA 24 14.588 0.978 -0.294
196 HA ALA 24 HA ALA 24 15.482 -1.708 -0.480
197 1HB ALA 24 1HB ALA 24 16.996 -0.966 -2.083
198 2HB ALA 24 2HB ALA 24 17.160 0.626 -1.340
199 3HB ALA 24 3HB ALA 24 15.688 0.208 -2.219
200 H GLY 25 H GLY 25 16.384 1.100 1.402
201 1HA GLY 25 2HA GLY 25 18.884 0.189 2.358
202 2HA GLY 25 1HA GLY 25 17.829 1.342 3.174
203 H ALA 26 H ALA 26 15.594 -0.584 3.187
204 HA ALA 26 HA ALA 26 16.221 -1.868 5.661
205 1HB ALA 26 1HB ALA 26 13.836 -2.759 5.381
206 2HB ALA 26 2HB ALA 26 13.755 -1.714 3.961
207 3HB ALA 26 3HB ALA 26 14.044 -1.016 5.553
208 H GLY 27 H GLY 27 16.453 -2.722 2.372
209 1HA GLY 27 2HA GLY 27 17.570 -4.654 1.637
210 2HA GLY 27 1HA GLY 27 17.154 -5.444 3.144
211 H LEU 28 H LEU 28 14.654 -3.824 1.242
212 HA LEU 28 HA LEU 28 13.797 -6.486 0.378
213 1HB LEU 28 2HB LEU 28 11.660 -4.542 0.948
214 2HB LEU 28 1HB LEU 28 11.690 -6.276 1.165
215 HG LEU 28 HG LEU 28 13.416 -5.603 3.089
216 1HD1 LEU 28 1HD1 LEU 28 12.448 -3.600 4.252
217 2HD1 LEU 28 2HD1 LEU 28 11.632 -3.219 2.739
218 3HD1 LEU 28 3HD1 LEU 28 13.393 -3.259 2.803
219 1HD2 LEU 28 1HD2 LEU 28 10.879 -6.615 2.945
220 2HD2 LEU 28 2HD2 LEU 28 10.663 -5.201 3.978
221 3HD2 LEU 28 3HD2 LEU 28 11.830 -6.443 4.422
222 H THR 29 H THR 29 12.103 -6.444 -1.347
223 HA THR 29 HA THR 29 13.056 -4.777 -3.506
224 HB THR 29 HB THR 29 10.907 -6.906 -3.423
225 HG1 THR 29 1HG THR 29 13.335 -7.331 -3.196
226 1HG2 THR 29 1HG2 THR 29 11.939 -6.625 -6.020
227 2HG2 THR 29 2HG2 THR 29 11.466 -5.014 -5.478
228 3HG2 THR 29 3HG2 THR 29 10.293 -6.331 -5.462
229 H CYS 30 H CYS 30 12.177 -2.959 -4.205
230 HA CYS 30 HA CYS 30 9.448 -2.242 -3.325
231 1HB CYS 30 2HB CYS 30 10.393 0.149 -3.433
232 2HB CYS 30 1HB CYS 30 10.857 -0.860 -2.069
233 HG CYS 30 HG CYS 30 12.886 -0.872 -4.351
234 H THR 31 H THR 31 8.102 -2.116 -4.972
235 HA THR 31 HA THR 31 9.052 -0.883 -7.464
236 HB THR 31 HB THR 31 8.714 -3.463 -7.565
237 HG1 THR 31 1HG THR 31 7.115 -2.253 -9.497
238 1HG2 THR 31 1HG2 THR 31 5.884 -2.895 -8.170
239 2HG2 THR 31 2HG2 THR 31 6.327 -3.075 -6.474
240 3HG2 THR 31 3HG2 THR 31 6.654 -4.381 -7.618
241 H THR 32 H THR 32 7.738 0.707 -8.215
242 HA THR 32 HA THR 32 5.297 1.223 -6.690
243 HB THR 32 HB THR 32 5.567 3.556 -7.287
244 HG1 THR 32 1HG THR 32 6.678 4.055 -8.977
245 1HG2 THR 32 1HG2 THR 32 8.343 3.214 -6.620
246 2HG2 THR 32 2HG2 THR 32 7.321 2.151 -5.650
247 3HG2 THR 32 3HG2 THR 32 7.029 3.892 -5.662
248 H PHE 33 H PHE 33 3.520 2.319 -7.814
249 HA PHE 33 HA PHE 33 3.257 1.467 -10.615
250 1HB PHE 33 2HB PHE 33 1.198 1.126 -8.439
251 2HB PHE 33 1HB PHE 33 0.958 0.743 -10.131
252 HD1 PHE 33 1HD PHE 33 1.027 -1.504 -10.610
253 HD2 PHE 33 2HD PHE 33 3.524 -0.022 -7.522
254 HE1 PHE 33 1HE PHE 33 1.904 -3.753 -10.251
255 HE2 PHE 33 2HE PHE 33 4.421 -2.266 -7.154
256 HZ PHE 33 HZ PHE 33 3.597 -4.159 -8.529
257 H GLU 34 H GLU 34 1.179 2.434 -11.594
258 HA GLU 34 HA GLU 34 1.434 5.226 -11.645
259 1HB GLU 34 2HB GLU 34 -0.583 5.162 -13.083
260 2HB GLU 34 1HB GLU 34 0.652 4.007 -13.564
261 1HG GLU 34 2HG GLU 34 -1.183 2.681 -13.713
262 2HG GLU 34 1HG GLU 34 -0.740 2.389 -12.035
263 H ASN 35 H ASN 35 -1.044 3.189 -10.084
264 HA ASN 35 HA ASN 35 -1.613 5.223 -8.183
265 1HB ASN 35 2HB ASN 35 -2.872 5.774 -10.450
266 2HB ASN 35 1HB ASN 35 -4.015 4.592 -9.821
267 1HD2 ASN 35 1HD2 ASN 35 -4.229 5.024 -7.252
268 2HD2 ASN 35 2HD2 ASN 35 -4.720 6.639 -6.896
269 H GLY 36 H GLY 36 -3.309 2.574 -9.765
270 1HA GLY 36 2HA GLY 36 -3.155 0.927 -7.409
271 2HA GLY 36 1HA GLY 36 -4.760 1.569 -7.700
272 H ASN 37 H ASN 37 -5.139 1.417 -10.320
273 HA ASN 37 HA ASN 37 -5.851 -1.181 -10.813
274 1HB ASN 37 2HB ASN 37 -5.616 1.254 -12.406
275 2HB ASN 37 1HB ASN 37 -5.439 -0.221 -13.352
276 1HD2 ASN 37 1HD2 ASN 37 -7.405 0.423 -10.485
277 2HD2 ASN 37 2HD2 ASN 37 -8.925 0.064 -11.225
278 H GLU 38 H GLU 38 -2.769 0.312 -11.262
279 HA GLU 38 HA GLU 38 -1.626 -1.533 -13.039
280 1HB GLU 38 2HB GLU 38 -0.771 0.749 -12.198
281 2HB GLU 38 1HB GLU 38 -0.068 -0.167 -10.883
282 1HG GLU 38 2HG GLU 38 1.702 -0.212 -12.275
283 2HG GLU 38 1HG GLU 38 0.848 -1.609 -12.929
284 H VAL 39 H VAL 39 -1.311 -1.411 -9.442
285 HA VAL 39 HA VAL 39 0.055 -3.866 -9.257
286 HB VAL 39 HB VAL 39 -1.770 -2.689 -7.156
287 1HG1 VAL 39 1HG1 VAL 39 -1.103 -4.346 -5.824
288 2HG1 VAL 39 2HG1 VAL 39 0.590 -4.028 -6.198
289 3HG1 VAL 39 3HG1 VAL 39 -0.352 -5.100 -7.226
290 1HG2 VAL 39 1HG2 VAL 39 -0.008 -1.373 -6.392
291 2HG2 VAL 39 2HG2 VAL 39 0.069 -1.202 -8.144
292 3HG2 VAL 39 3HG2 VAL 39 1.192 -2.277 -7.315
293 H LEU 40 H LEU 40 -3.344 -3.105 -9.506
294 HA LEU 40 HA LEU 40 -4.489 -5.496 -8.673
295 1HB LEU 40 2HB LEU 40 -5.401 -3.806 -11.000
296 2HB LEU 40 1HB LEU 40 -6.384 -4.914 -10.065
297 HG LEU 40 HG LEU 40 -5.212 -2.306 -9.121
298 1HD1 LEU 40 1HD1 LEU 40 -7.528 -1.651 -8.877
299 2HD1 LEU 40 2HD1 LEU 40 -8.042 -3.233 -9.461
300 3HD1 LEU 40 3HD1 LEU 40 -7.195 -2.142 -10.545
301 1HD2 LEU 40 1HD2 LEU 40 -5.071 -3.710 -7.240
302 2HD2 LEU 40 2HD2 LEU 40 -6.597 -4.509 -7.623
303 3HD2 LEU 40 3HD2 LEU 40 -6.593 -2.841 -7.052
304 H ALA 41 H ALA 41 -3.196 -4.567 -11.827
305 HA ALA 41 HA ALA 41 -3.763 -7.124 -13.007
306 1HB ALA 41 1HB ALA 41 -2.030 -4.926 -14.104
307 2HB ALA 41 2HB ALA 41 -3.784 -4.982 -14.283
308 3HB ALA 41 3HB ALA 41 -2.782 -6.244 -15.003
309 H ALA 42 H ALA 42 -0.861 -5.375 -12.053
310 HA ALA 42 HA ALA 42 1.034 -7.286 -12.766
311 1HB ALA 42 1HB ALA 42 1.706 -5.849 -10.305
312 2HB ALA 42 2HB ALA 42 1.136 -4.811 -11.613
313 3HB ALA 42 3HB ALA 42 2.518 -5.873 -11.871
314 H LEU 43 H LEU 43 -1.058 -7.130 -9.965
315 HA LEU 43 HA LEU 43 0.311 -8.990 -8.356
316 1HB LEU 43 2HB LEU 43 -2.525 -8.024 -8.446
317 2HB LEU 43 1HB LEU 43 -2.075 -9.354 -7.391
318 HG LEU 43 HG LEU 43 -0.748 -6.663 -7.300
319 1HD1 LEU 43 1HD1 LEU 43 -3.229 -6.682 -6.734
320 2HD1 LEU 43 2HD1 LEU 43 -2.132 -6.070 -5.494
321 3HD1 LEU 43 3HD1 LEU 43 -2.791 -7.701 -5.363
322 1HD2 LEU 43 1HD2 LEU 43 0.695 -8.235 -6.389
323 2HD2 LEU 43 2HD2 LEU 43 -0.629 -9.174 -5.698
324 3HD2 LEU 43 3HD2 LEU 43 -0.183 -7.617 -4.991
325 H ALA 44 H ALA 44 -1.677 -9.379 -11.127
326 HA ALA 44 HA ALA 44 -2.620 -11.985 -10.738
327 1HB ALA 44 1HB ALA 44 -3.072 -12.032 -13.072
328 2HB ALA 44 2HB ALA 44 -1.868 -10.784 -13.392
329 3HB ALA 44 3HB ALA 44 -3.347 -10.380 -12.521
330 H SER 45 H SER 45 0.569 -10.889 -11.242
331 HA SER 45 HA SER 45 1.410 -13.594 -11.946
332 1HB SER 45 2HB SER 45 1.950 -12.143 -13.777
333 2HB SER 45 1HB SER 45 2.668 -10.956 -12.689
334 HG SER 45 HG SER 45 4.439 -12.122 -12.567
335 H LYS 46 H LYS 46 1.424 -11.328 -9.479
336 HA LYS 46 HA LYS 46 3.228 -12.891 -7.923
337 1HB LYS 46 2HB LYS 46 4.537 -11.099 -9.449
338 2HB LYS 46 1HB LYS 46 4.178 -10.094 -8.054
339 1HG LYS 46 2HG LYS 46 5.132 -12.401 -6.910
340 2HG LYS 46 1HG LYS 46 6.118 -12.237 -8.367
341 1HD LYS 46 2HD LYS 46 5.970 -9.666 -7.284
342 2HD LYS 46 1HD LYS 46 6.212 -10.735 -5.901
343 1HE LYS 46 2HE LYS 46 8.340 -11.100 -6.450
344 2HE LYS 46 1HE LYS 46 7.914 -11.476 -8.118
345 1HZ LYS 46 1HZ LYS 46 7.633 -8.743 -7.861
346 2HZ LYS 46 2HZ LYS 46 8.862 -9.567 -8.678
347 3HZ LYS 46 3HZ LYS 46 9.075 -9.118 -7.062
348 H THR 47 H THR 47 3.467 -12.033 -5.694
349 HA THR 47 HA THR 47 1.411 -10.119 -4.951
350 HB THR 47 HB THR 47 1.696 -12.889 -3.790
351 HG1 THR 47 1HG THR 47 -0.535 -12.970 -4.420
352 1HG2 THR 47 1HG2 THR 47 1.244 -11.592 -1.895
353 2HG2 THR 47 2HG2 THR 47 -0.324 -12.209 -2.420
354 3HG2 THR 47 3HG2 THR 47 0.135 -10.543 -2.772
355 HA PRO 48 HA PRO 48 5.020 -8.826 -2.580
356 1HB PRO 48 2HB PRO 48 3.974 -6.475 -1.727
357 2HB PRO 48 1HB PRO 48 4.621 -6.695 -3.358
358 1HG PRO 48 2HG PRO 48 1.778 -6.739 -2.422
359 2HG PRO 48 1HG PRO 48 2.467 -5.991 -3.874
360 1HD PRO 48 2HD PRO 48 1.175 -8.377 -3.911
361 2HD PRO 48 1HD PRO 48 2.477 -7.970 -5.043
362 H ASP 49 H ASP 49 5.522 -8.799 -0.381
363 HA ASP 49 HA ASP 49 3.634 -10.081 1.342
364 1HB ASP 49 2HB ASP 49 6.381 -8.941 1.891
365 2HB ASP 49 1HB ASP 49 5.436 -9.863 3.058
366 H VAL 50 H VAL 50 4.510 -6.800 0.712
367 HA VAL 50 HA VAL 50 2.546 -5.898 2.669
368 HB VAL 50 HB VAL 50 4.610 -5.869 3.929
369 1HG1 VAL 50 1HG1 VAL 50 6.550 -5.610 2.897
370 2HG1 VAL 50 2HG1 VAL 50 6.165 -3.914 2.621
371 3HG1 VAL 50 3HG1 VAL 50 5.726 -5.128 1.413
372 1HG2 VAL 50 1HG2 VAL 50 3.074 -4.031 4.325
373 2HG2 VAL 50 2HG2 VAL 50 3.836 -3.094 3.041
374 3HG2 VAL 50 3HG2 VAL 50 4.743 -3.490 4.501
375 H LEU 51 H LEU 51 1.225 -5.067 1.075
376 HA LEU 51 HA LEU 51 2.318 -3.393 -1.023
377 1HB LEU 51 2HB LEU 51 0.529 -5.051 -1.455
378 2HB LEU 51 1HB LEU 51 -0.544 -4.130 -0.424
379 HG LEU 51 HG LEU 51 -0.352 -2.214 -2.011
380 1HD1 LEU 51 1HD1 LEU 51 1.550 -2.365 -3.246
381 2HD1 LEU 51 2HD1 LEU 51 0.432 -3.131 -4.371
382 3HD1 LEU 51 3HD1 LEU 51 1.476 -4.121 -3.353
383 1HD2 LEU 51 1HD2 LEU 51 -1.717 -4.712 -2.372
384 2HD2 LEU 51 2HD2 LEU 51 -1.353 -3.989 -3.938
385 3HD2 LEU 51 3HD2 LEU 51 -2.265 -3.078 -2.735
386 H LEU 52 H LEU 52 1.923 -1.220 -1.342
387 HA LEU 52 HA LEU 52 0.693 0.226 0.919
388 1HB LEU 52 2HB LEU 52 3.342 0.269 0.364
389 2HB LEU 52 1HB LEU 52 2.798 1.603 -0.636
390 HG LEU 52 HG LEU 52 2.270 1.376 2.327
391 1HD1 LEU 52 1HD1 LEU 52 4.554 1.695 2.267
392 2HD1 LEU 52 2HD1 LEU 52 3.949 3.351 2.305
393 3HD1 LEU 52 3HD1 LEU 52 4.489 2.645 0.781
394 1HD2 LEU 52 1HD2 LEU 52 2.033 3.781 0.536
395 2HD2 LEU 52 2HD2 LEU 52 1.492 3.605 2.207
396 3HD2 LEU 52 3HD2 LEU 52 0.678 2.718 0.920
397 H SER 53 H SER 53 -1.125 1.197 0.248
398 HA SER 53 HA SER 53 -1.212 2.220 -2.513
399 1HB SER 53 2HB SER 53 -3.051 0.556 -1.035
400 2HB SER 53 1HB SER 53 -3.850 2.029 -1.579
401 HG SER 53 HG SER 53 -2.839 1.500 -3.691
402 H ASP 54 H ASP 54 -1.669 4.287 -2.887
403 HA ASP 54 HA ASP 54 -1.817 6.091 -0.636
404 1HB ASP 54 2HB ASP 54 -0.813 6.238 -3.252
405 2HB ASP 54 1HB ASP 54 -2.168 7.362 -3.220
406 H ILE 55 H ILE 55 -3.344 8.127 -1.274
407 HA ILE 55 HA ILE 55 -5.961 7.246 -2.163
408 HB ILE 55 HB ILE 55 -6.099 6.661 0.156
409 1HG1 ILE 55 2HG1 ILE 55 -7.911 8.197 -1.080
410 2HG1 ILE 55 1HG1 ILE 55 -8.137 7.601 0.556
411 1HG2 ILE 55 1HG2 ILE 55 -4.334 7.877 1.142
412 2HG2 ILE 55 2HG2 ILE 55 -5.813 8.410 1.934
413 3HG2 ILE 55 3HG2 ILE 55 -5.057 9.425 0.710
414 1HD1 ILE 55 1HD1 ILE 55 -7.853 9.660 1.477
415 2HD1 ILE 55 2HD1 ILE 55 -8.539 10.115 -0.082
416 3HD1 ILE 55 3HD1 ILE 55 -6.799 10.222 0.179
417 H ARG 56 H ARG 56 -6.346 8.742 -3.676
418 HA ARG 56 HA ARG 56 -6.589 11.496 -2.918
419 1HB ARG 56 2HB ARG 56 -4.158 10.575 -4.208
420 2HB ARG 56 1HB ARG 56 -4.970 11.805 -5.166
421 1HG ARG 56 2HG ARG 56 -5.056 13.219 -3.093
422 2HG ARG 56 1HG ARG 56 -4.004 12.025 -2.328
423 1HD ARG 56 2HD ARG 56 -2.190 12.724 -3.453
424 2HD ARG 56 1HD ARG 56 -3.088 12.952 -4.954
425 HE ARG 56 HE ARG 56 -3.172 15.165 -4.454
426 1HH1 ARG 56 1HH1 ARG 56 -2.830 13.407 -1.460
427 2HH1 ARG 56 2HH1 ARG 56 -2.772 14.835 -0.483
428 1HH2 ARG 56 1HH2 ARG 56 -3.104 17.042 -3.173
429 2HH2 ARG 56 2HH2 ARG 56 -2.928 16.899 -1.455
430 H MET 57 H MET 57 -8.724 10.687 -3.561
431 HA MET 57 HA MET 57 -10.449 10.333 -5.023
432 1HB MET 57 2HB MET 57 -10.770 12.271 -6.510
433 2HB MET 57 1HB MET 57 -10.308 12.730 -4.876
434 1HG MET 57 2HG MET 57 -8.282 13.536 -5.523
435 2HG MET 57 1HG MET 57 -8.151 12.428 -6.887
436 1HE MET 57 1HE MET 57 -7.958 15.618 -8.924
437 2HE MET 57 2HE MET 57 -7.766 13.877 -9.141
438 3HE MET 57 3HE MET 57 -7.029 14.679 -7.753
439 HA PRO 58 HA PRO 58 -7.970 8.582 -8.633
440 1HB PRO 58 2HB PRO 58 -7.928 5.962 -7.931
441 2HB PRO 58 1HB PRO 58 -6.654 7.099 -7.476
442 1HG PRO 58 2HG PRO 58 -8.871 5.984 -5.838
443 2HG PRO 58 1HG PRO 58 -7.230 6.433 -5.355
444 1HD PRO 58 2HD PRO 58 -9.519 7.943 -4.928
445 2HD PRO 58 1HD PRO 58 -7.859 8.553 -4.866
446 H GLY 59 H GLY 59 -10.083 6.170 -7.102
447 1HA GLY 59 2HA GLY 59 -11.923 6.418 -9.397
448 2HA GLY 59 1HA GLY 59 -11.554 4.887 -8.612
449 H MET 60 H MET 60 -11.583 6.211 -5.955
450 HA MET 60 HA MET 60 -14.239 7.197 -5.528
451 1HB MET 60 2HB MET 60 -14.728 4.792 -5.674
452 2HB MET 60 1HB MET 60 -13.510 4.469 -4.449
453 1HG MET 60 2HG MET 60 -15.262 4.479 -3.061
454 2HG MET 60 1HG MET 60 -15.034 6.225 -3.113
455 1HE MET 60 1HE MET 60 -18.744 4.919 -2.907
456 2HE MET 60 2HE MET 60 -18.247 6.589 -2.636
457 3HE MET 60 3HE MET 60 -17.271 5.263 -2.002
458 H ASP 61 H ASP 61 -12.526 8.764 -4.901
459 HA ASP 61 HA ASP 61 -11.599 10.042 -3.276
460 1HB ASP 61 2HB ASP 61 -13.448 8.365 -1.889
461 2HB ASP 61 1HB ASP 61 -12.014 8.580 -0.888
462 H GLY 62 H GLY 62 -10.880 6.646 -3.371
463 1HA GLY 62 2HA GLY 62 -8.298 6.505 -3.620
464 2HA GLY 62 1HA GLY 62 -8.357 7.053 -1.962
465 H LEU 63 H LEU 63 -10.813 5.584 -1.401
466 HA LEU 63 HA LEU 63 -9.603 3.131 -0.632
467 1HB LEU 63 2HB LEU 63 -12.538 3.804 -0.525
468 2HB LEU 63 1HB LEU 63 -11.701 2.571 0.400
469 HG LEU 63 HG LEU 63 -10.338 4.724 1.234
470 1HD1 LEU 63 1HD1 LEU 63 -12.126 6.022 -0.278
471 2HD1 LEU 63 2HD1 LEU 63 -11.425 6.700 1.192
472 3HD1 LEU 63 3HD1 LEU 63 -13.019 5.951 1.238
473 1HD2 LEU 63 1HD2 LEU 63 -11.777 4.717 3.210
474 2HD2 LEU 63 2HD2 LEU 63 -11.418 3.082 2.655
475 3HD2 LEU 63 3HD2 LEU 63 -12.991 3.804 2.319
476 H ALA 64 H ALA 64 -11.358 4.213 -3.394
477 HA ALA 64 HA ALA 64 -12.567 1.883 -4.317
478 1HB ALA 64 1HB ALA 64 -11.403 3.129 -6.565
479 2HB ALA 64 2HB ALA 64 -11.795 4.407 -5.415
480 3HB ALA 64 3HB ALA 64 -13.052 3.298 -5.966
481 H LEU 65 H LEU 65 -9.213 2.954 -4.613
482 HA LEU 65 HA LEU 65 -8.204 1.022 -6.305
483 1HB LEU 65 2HB LEU 65 -6.804 2.119 -3.865
484 2HB LEU 65 1HB LEU 65 -6.040 1.433 -5.286
485 HG LEU 65 HG LEU 65 -7.758 3.894 -5.470
486 1HD1 LEU 65 1HD1 LEU 65 -5.597 5.167 -5.404
487 2HD1 LEU 65 2HD1 LEU 65 -4.839 3.709 -4.766
488 3HD1 LEU 65 3HD1 LEU 65 -6.124 4.503 -3.858
489 1HD2 LEU 65 1HD2 LEU 65 -6.963 4.101 -7.581
490 2HD2 LEU 65 2HD2 LEU 65 -6.807 2.352 -7.427
491 3HD2 LEU 65 3HD2 LEU 65 -5.400 3.387 -7.183
492 H LEU 66 H LEU 66 -8.487 0.906 -2.769
493 HA LEU 66 HA LEU 66 -7.426 -1.592 -2.272
494 1HB LEU 66 2HB LEU 66 -9.528 0.056 -0.949
495 2HB LEU 66 1HB LEU 66 -9.264 -1.583 -0.392
496 HG LEU 66 HG LEU 66 -7.059 0.462 -0.547
497 1HD1 LEU 66 1HD1 LEU 66 -8.587 -0.293 1.926
498 2HD1 LEU 66 2HD1 LEU 66 -9.000 1.111 0.951
499 3HD1 LEU 66 3HD1 LEU 66 -7.420 1.002 1.711
500 1HD2 LEU 66 1HD2 LEU 66 -6.031 -1.592 -0.389
501 2HD2 LEU 66 2HD2 LEU 66 -7.355 -2.306 0.531
502 3HD2 LEU 66 3HD2 LEU 66 -6.240 -1.185 1.314
503 H LYS 67 H LYS 67 -10.878 -0.846 -2.758
504 HA LYS 67 HA LYS 67 -12.033 -3.275 -2.598
505 1HB LYS 67 2HB LYS 67 -12.586 -1.145 -4.664
506 2HB LYS 67 1HB LYS 67 -13.638 -2.523 -4.372
507 1HG LYS 67 2HG LYS 67 -13.497 -1.615 -1.883
508 2HG LYS 67 1HG LYS 67 -13.185 -0.101 -2.737
509 1HD LYS 67 2HD LYS 67 -15.238 -0.554 -4.102
510 2HD LYS 67 1HD LYS 67 -15.577 -1.912 -3.027
511 1HE LYS 67 2HE LYS 67 -16.839 -0.195 -2.108
512 2HE LYS 67 1HE LYS 67 -15.369 -0.167 -1.136
513 1HZ LYS 67 1HZ LYS 67 -16.463 1.950 -2.466
514 2HZ LYS 67 2HZ LYS 67 -15.163 1.498 -3.449
515 3HZ LYS 67 3HZ LYS 67 -14.901 1.879 -1.822
516 H GLN 68 H GLN 68 -10.416 -2.034 -5.511
517 HA GLN 68 HA GLN 68 -10.878 -4.364 -7.047
518 1HB GLN 68 2HB GLN 68 -8.673 -2.357 -7.472
519 2HB GLN 68 1HB GLN 68 -9.411 -3.414 -8.666
520 1HG GLN 68 2HG GLN 68 -10.899 -1.234 -7.235
521 2HG GLN 68 1HG GLN 68 -10.106 -1.027 -8.800
522 1HE2 GLN 68 1HE2 GLN 68 -12.928 -0.796 -8.129
523 2HE2 GLN 68 2HE2 GLN 68 -13.756 -1.945 -9.118
524 H ILE 69 H ILE 69 -8.258 -3.329 -4.951
525 HA ILE 69 HA ILE 69 -6.284 -5.154 -5.640
526 HB ILE 69 HB ILE 69 -6.944 -4.012 -2.927
527 1HG1 ILE 69 2HG1 ILE 69 -4.965 -3.177 -5.058
528 2HG1 ILE 69 1HG1 ILE 69 -6.434 -2.323 -4.615
529 1HG2 ILE 69 1HG2 ILE 69 -5.503 -5.554 -2.170
530 2HG2 ILE 69 2HG2 ILE 69 -4.275 -4.499 -2.863
531 3HG2 ILE 69 3HG2 ILE 69 -4.859 -5.885 -3.775
532 1HD1 ILE 69 1HD1 ILE 69 -4.273 -2.828 -2.606
533 2HD1 ILE 69 2HD1 ILE 69 -5.551 -1.614 -2.578
534 3HD1 ILE 69 3HD1 ILE 69 -4.204 -1.454 -3.705
535 H LYS 70 H LYS 70 -8.917 -5.537 -3.344
536 HA LYS 70 HA LYS 70 -8.211 -8.175 -2.601
537 1HB LYS 70 2HB LYS 70 -10.297 -8.256 -1.415
538 2HB LYS 70 1HB LYS 70 -9.560 -6.678 -1.174
539 1HG LYS 70 2HG LYS 70 -11.420 -5.712 -1.881
540 2HG LYS 70 1HG LYS 70 -11.214 -6.493 -3.449
541 1HD LYS 70 2HD LYS 70 -12.712 -8.140 -2.985
542 2HD LYS 70 1HD LYS 70 -12.343 -8.137 -1.258
543 1HE LYS 70 2HE LYS 70 -14.251 -7.021 -0.974
544 2HE LYS 70 1HE LYS 70 -13.443 -5.638 -1.708
545 1HZ LYS 70 1HZ LYS 70 -14.197 -6.741 -3.904
546 2HZ LYS 70 2HZ LYS 70 -15.319 -5.858 -2.995
547 3HZ LYS 70 3HZ LYS 70 -15.320 -7.548 -2.927
548 H GLN 71 H GLN 71 -10.125 -6.893 -5.194
549 HA GLN 71 HA GLN 71 -11.678 -9.168 -5.719
550 1HB GLN 71 2HB GLN 71 -10.910 -6.747 -7.202
551 2HB GLN 71 1HB GLN 71 -11.334 -8.127 -8.207
552 1HG GLN 71 2HG GLN 71 -13.510 -8.092 -7.592
553 2HG GLN 71 1HG GLN 71 -13.156 -7.492 -5.971
554 1HE2 GLN 71 1HE2 GLN 71 -12.695 -5.252 -5.715
555 2HE2 GLN 71 2HE2 GLN 71 -13.326 -4.095 -6.835
556 H ARG 72 H ARG 72 -8.377 -8.438 -6.490
557 HA ARG 72 HA ARG 72 -8.130 -10.750 -8.231
558 1HB ARG 72 2HB ARG 72 -6.212 -8.597 -7.392
559 2HB ARG 72 1HB ARG 72 -5.686 -10.013 -8.292
560 1HG ARG 72 2HG ARG 72 -6.123 -8.817 -10.114
561 2HG ARG 72 1HG ARG 72 -7.824 -9.132 -9.762
562 1HD ARG 72 2HD ARG 72 -7.498 -7.029 -8.184
563 2HD ARG 72 1HD ARG 72 -6.215 -6.671 -9.339
564 HE ARG 72 HE ARG 72 -8.992 -6.360 -9.754
565 1HH1 ARG 72 1HH1 ARG 72 -6.069 -7.328 -11.406
566 2HH1 ARG 72 2HH1 ARG 72 -6.676 -6.920 -12.975
567 1HH2 ARG 72 1HH2 ARG 72 -9.787 -5.830 -11.814
568 2HH2 ARG 72 2HH2 ARG 72 -8.786 -6.069 -13.208
569 H HIS 73 H HIS 73 -6.441 -9.584 -5.379
570 HA HIS 73 HA HIS 73 -5.359 -12.185 -4.782
571 1HB HIS 73 2HB HIS 73 -4.150 -11.080 -3.054
572 2HB HIS 73 1HB HIS 73 -4.201 -9.960 -4.408
573 HD1 HIS 73 1HD HIS 73 -6.450 -10.577 -1.390
574 HD2 HIS 73 2HD HIS 73 -4.721 -7.475 -3.519
575 HE1 HIS 73 1HE HIS 73 -7.118 -8.492 -0.179
576 HE2 HIS 73 2HE HIS 73 -5.863 -6.667 -1.332
577 HA PRO 74 HA PRO 74 -8.325 -13.358 -1.689
578 1HB PRO 74 2HB PRO 74 -6.833 -14.717 0.094
579 2HB PRO 74 1HB PRO 74 -7.089 -15.300 -1.552
580 1HG PRO 74 2HG PRO 74 -4.680 -14.099 -0.332
581 2HG PRO 74 1HG PRO 74 -4.812 -15.231 -1.687
582 1HD PRO 74 2HD PRO 74 -4.425 -12.419 -1.807
583 2HD PRO 74 1HD PRO 74 -4.695 -13.529 -3.164
584 H MET 75 H MET 75 -5.387 -12.243 0.023
585 HA MET 75 HA MET 75 -6.880 -10.247 1.457
586 1HB MET 75 2HB MET 75 -5.830 -12.704 2.845
587 2HB MET 75 1HB MET 75 -6.039 -11.183 3.702
588 1HG MET 75 2HG MET 75 -8.425 -11.195 3.032
589 2HG MET 75 1HG MET 75 -8.178 -12.794 2.332
590 1HE MET 75 1HE MET 75 -10.411 -13.583 4.703
591 2HE MET 75 2HE MET 75 -9.288 -14.943 4.778
592 3HE MET 75 3HE MET 75 -9.553 -14.102 3.252
593 H LEU 76 H LEU 76 -4.862 -9.798 -0.282
594 HA LEU 76 HA LEU 76 -2.268 -9.777 0.776
595 1HB LEU 76 2HB LEU 76 -3.174 -9.414 -1.648
596 2HB LEU 76 1HB LEU 76 -3.226 -7.727 -1.176
597 HG LEU 76 HG LEU 76 -0.773 -9.477 -1.225
598 1HD1 LEU 76 1HD1 LEU 76 -0.505 -8.810 -3.323
599 2HD1 LEU 76 2HD1 LEU 76 -0.734 -7.120 -2.872
600 3HD1 LEU 76 3HD1 LEU 76 -2.129 -8.127 -3.264
601 1HD2 LEU 76 1HD2 LEU 76 -0.533 -7.909 0.559
602 2HD2 LEU 76 2HD2 LEU 76 -1.180 -6.600 -0.427
603 3HD2 LEU 76 3HD2 LEU 76 0.395 -7.295 -0.811
604 HA PRO 77 HA PRO 77 -3.053 -6.514 3.780
605 1HB PRO 77 2HB PRO 77 -0.479 -6.427 4.719
606 2HB PRO 77 1HB PRO 77 -1.697 -7.582 5.270
607 1HG PRO 77 2HG PRO 77 0.507 -7.951 3.285
608 2HG PRO 77 1HG PRO 77 -0.088 -9.068 4.523
609 1HD PRO 77 2HD PRO 77 -0.737 -9.325 1.925
610 2HD PRO 77 1HD PRO 77 -1.851 -9.774 3.234
611 H VAL 78 H VAL 78 -3.280 -4.559 2.977
612 HA VAL 78 HA VAL 78 -1.049 -3.254 1.591
613 HB VAL 78 HB VAL 78 -3.927 -2.412 1.365
614 1HG1 VAL 78 1HG1 VAL 78 -2.325 -0.756 0.690
615 2HG1 VAL 78 2HG1 VAL 78 -3.110 -1.409 -0.747
616 3HG1 VAL 78 3HG1 VAL 78 -1.478 -1.926 -0.323
617 1HG2 VAL 78 1HG2 VAL 78 -2.630 -4.059 -0.758
618 2HG2 VAL 78 2HG2 VAL 78 -4.340 -3.810 -0.419
619 3HG2 VAL 78 3HG2 VAL 78 -3.378 -4.856 0.621
620 H ILE 79 H ILE 79 -0.737 -0.991 1.985
621 HA ILE 79 HA ILE 79 -1.881 -0.050 4.540
622 HB ILE 79 HB ILE 79 0.855 0.675 3.493
623 1HG1 ILE 79 2HG1 ILE 79 1.028 -0.883 5.865
624 2HG1 ILE 79 1HG1 ILE 79 -0.011 -1.761 4.748
625 1HG2 ILE 79 1HG2 ILE 79 -0.788 1.816 5.452
626 2HG2 ILE 79 2HG2 ILE 79 0.917 2.150 5.152
627 3HG2 ILE 79 3HG2 ILE 79 0.453 0.923 6.331
628 1HD1 ILE 79 1HD1 ILE 79 1.673 -2.112 3.247
629 2HD1 ILE 79 2HD1 ILE 79 2.588 -2.092 4.755
630 3HD1 ILE 79 3HD1 ILE 79 2.553 -0.659 3.729
631 H ILE 80 H ILE 80 -3.178 1.644 4.231
632 HA ILE 80 HA ILE 80 -2.796 3.307 1.857
633 HB ILE 80 HB ILE 80 -5.150 3.479 3.702
634 1HG1 ILE 80 2HG1 ILE 80 -4.855 1.121 3.006
635 2HG1 ILE 80 1HG1 ILE 80 -6.300 1.848 2.315
636 1HG2 ILE 80 1HG2 ILE 80 -4.872 4.035 0.752
637 2HG2 ILE 80 2HG2 ILE 80 -4.800 5.259 2.019
638 3HG2 ILE 80 3HG2 ILE 80 -6.288 4.350 1.757
639 1HD1 ILE 80 1HD1 ILE 80 -5.234 0.537 0.631
640 2HD1 ILE 80 2HD1 ILE 80 -3.685 1.322 0.935
641 3HD1 ILE 80 3HD1 ILE 80 -5.007 2.239 0.221
642 H MET 81 H MET 81 -2.782 5.556 1.925
643 HA MET 81 HA MET 81 -1.285 6.657 4.056
644 1HB MET 81 2HB MET 81 -0.902 7.549 1.916
645 2HB MET 81 1HB MET 81 -2.607 7.859 1.644
646 1HG MET 81 2HG MET 81 -2.570 9.632 3.303
647 2HG MET 81 1HG MET 81 -0.872 9.301 3.633
648 1HE MET 81 1HE MET 81 -2.455 10.940 -0.373
649 2HE MET 81 2HE MET 81 -3.413 11.053 1.102
650 3HE MET 81 3HE MET 81 -3.022 9.473 0.425
651 H THR 82 H THR 82 -4.674 7.358 3.072
652 HA THR 82 HA THR 82 -5.254 8.037 5.859
653 HB THR 82 HB THR 82 -6.186 9.877 3.670
654 HG1 THR 82 1HG THR 82 -4.285 10.706 3.573
655 1HG2 THR 82 1HG2 THR 82 -6.505 11.478 5.405
656 2HG2 THR 82 2HG2 THR 82 -5.759 10.414 6.596
657 3HG2 THR 82 3HG2 THR 82 -7.311 9.983 5.876
658 H ALA 83 H ALA 83 -7.422 7.784 6.483
659 HA ALA 83 HA ALA 83 -9.108 6.415 4.489
660 1HB ALA 83 1HB ALA 83 -9.417 4.764 5.935
661 2HB ALA 83 2HB ALA 83 -9.909 5.885 7.203
662 3HB ALA 83 3HB ALA 83 -8.201 5.515 6.967
663 H HIS 84 H HIS 84 -9.503 8.981 4.211
664 HA HIS 84 HA HIS 84 -11.688 9.774 5.995
665 1HB HIS 84 2HB HIS 84 -11.419 12.017 5.140
666 2HB HIS 84 1HB HIS 84 -9.845 11.390 5.614
667 HD1 HIS 84 1HD HIS 84 -8.042 11.556 3.908
668 HD2 HIS 84 2HD HIS 84 -11.825 11.938 2.245
669 HE1 HIS 84 1HE HIS 84 -7.655 12.146 1.493
670 HE2 HIS 84 2HE HIS 84 -9.958 12.219 0.476
671 H SER 85 H SER 85 -13.295 11.311 4.568
672 HA SER 85 HA SER 85 -14.991 11.403 3.062
673 1HB SER 85 2HB SER 85 -14.739 10.601 0.870
674 2HB SER 85 1HB SER 85 -13.092 10.945 1.384
675 HG SER 85 HG SER 85 -14.280 8.556 0.748
676 H ASP 86 H ASP 86 -13.932 7.973 3.109
677 HA ASP 86 HA ASP 86 -16.431 7.249 4.387
678 1HB ASP 86 2HB ASP 86 -16.985 5.588 2.587
679 2HB ASP 86 1HB ASP 86 -17.168 7.274 2.110
680 H LEU 87 H LEU 87 -15.021 6.529 6.048
681 HA LEU 87 HA LEU 87 -12.891 4.779 5.819
682 1HB LEU 87 2HB LEU 87 -14.452 5.852 7.911
683 2HB LEU 87 1HB LEU 87 -14.417 4.119 8.162
684 HG LEU 87 HG LEU 87 -12.009 5.927 7.925
685 1HD1 LEU 87 1HD1 LEU 87 -12.588 6.331 10.062
686 2HD1 LEU 87 2HD1 LEU 87 -11.847 4.755 10.347
687 3HD1 LEU 87 3HD1 LEU 87 -13.597 4.889 10.174
688 1HD2 LEU 87 1HD2 LEU 87 -11.061 3.597 8.902
689 2HD2 LEU 87 2HD2 LEU 87 -11.033 4.022 7.191
690 3HD2 LEU 87 3HD2 LEU 87 -12.319 2.995 7.823
691 H ASP 88 H ASP 88 -16.230 4.139 5.331
692 HA ASP 88 HA ASP 88 -16.586 1.522 6.018
693 1HB ASP 88 2HB ASP 88 -17.546 2.964 3.543
694 2HB ASP 88 1HB ASP 88 -18.115 1.367 4.019
695 H ALA 89 H ALA 89 -15.372 2.590 2.816
696 HA ALA 89 HA ALA 89 -14.764 -0.015 1.931
697 1HB ALA 89 1HB ALA 89 -13.670 2.635 1.007
698 2HB ALA 89 2HB ALA 89 -15.045 1.763 0.332
699 3HB ALA 89 3HB ALA 89 -13.417 1.099 0.178
700 H ALA 90 H ALA 90 -13.136 2.091 4.081
701 HA ALA 90 HA ALA 90 -10.508 1.010 3.703
702 1HB ALA 90 1HB ALA 90 -10.074 2.227 5.914
703 2HB ALA 90 2HB ALA 90 -11.721 2.839 5.747
704 3HB ALA 90 3HB ALA 90 -10.520 3.200 4.509
705 H VAL 91 H VAL 91 -13.052 0.588 6.169
706 HA VAL 91 HA VAL 91 -11.596 -1.190 7.782
707 HB VAL 91 HB VAL 91 -14.585 -1.295 7.504
708 1HG1 VAL 91 1HG1 VAL 91 -14.260 -2.852 9.076
709 2HG1 VAL 91 2HG1 VAL 91 -13.889 -1.509 10.158
710 3HG1 VAL 91 3HG1 VAL 91 -12.581 -2.365 9.334
711 1HG2 VAL 91 1HG2 VAL 91 -14.268 0.998 7.785
712 2HG2 VAL 91 2HG2 VAL 91 -12.861 0.774 8.824
713 3HG2 VAL 91 3HG2 VAL 91 -14.475 0.413 9.436
714 H SER 92 H SER 92 -13.966 -1.840 5.210
715 HA SER 92 HA SER 92 -13.897 -4.627 5.351
716 1HB SER 92 2HB SER 92 -14.875 -4.660 3.180
717 2HB SER 92 1HB SER 92 -15.473 -3.189 3.947
718 HG SER 92 HG SER 92 -13.529 -2.206 2.841
719 H ALA 93 H ALA 93 -11.609 -2.347 4.126
720 HA ALA 93 HA ALA 93 -10.152 -3.955 2.380
721 1HB ALA 93 1HB ALA 93 -9.964 -1.372 3.299
722 2HB ALA 93 2HB ALA 93 -8.876 -2.158 2.154
723 3HB ALA 93 3HB ALA 93 -8.480 -2.135 3.874
724 H TYR 94 H TYR 94 -9.593 -3.295 5.803
725 HA TYR 94 HA TYR 94 -7.390 -4.964 6.153
726 1HB TYR 94 2HB TYR 94 -9.435 -4.750 8.330
727 2HB TYR 94 1HB TYR 94 -7.682 -4.747 8.454
728 HD1 TYR 94 1HD TYR 94 -10.317 -2.788 9.147
729 HD2 TYR 94 2HD TYR 94 -6.761 -2.624 6.811
730 HE1 TYR 94 1HE TYR 94 -10.327 -0.335 9.314
731 HE2 TYR 94 2HE TYR 94 -6.763 -0.175 6.973
732 HH TYR 94 HH TYR 94 -9.394 1.568 8.600
733 H GLN 95 H GLN 95 -10.764 -5.641 5.973
734 HA GLN 95 HA GLN 95 -10.603 -8.345 6.905
735 1HB GLN 95 2HB GLN 95 -12.680 -7.343 7.264
736 2HB GLN 95 1HB GLN 95 -12.726 -6.626 5.663
737 1HG GLN 95 2HG GLN 95 -12.728 -9.345 5.157
738 2HG GLN 95 1HG GLN 95 -13.731 -9.179 6.595
739 1HE2 GLN 95 1HE2 GLN 95 -13.254 -7.044 3.811
740 2HE2 GLN 95 2HE2 GLN 95 -14.917 -6.995 3.342
741 H GLN 96 H GLN 96 -10.799 -6.764 3.744
742 HA GLN 96 HA GLN 96 -10.751 -9.285 2.361
743 1HB GLN 96 2HB GLN 96 -10.834 -7.977 0.330
744 2HB GLN 96 1HB GLN 96 -12.055 -7.410 1.461
745 1HG GLN 96 2HG GLN 96 -10.148 -5.726 2.130
746 2HG GLN 96 1HG GLN 96 -9.575 -6.076 0.505
747 1HE2 GLN 96 1HE2 GLN 96 -9.981 -3.908 -0.078
748 2HE2 GLN 96 2HE2 GLN 96 -11.584 -3.347 -0.394
749 H GLY 97 H GLY 97 -8.441 -7.048 3.542
750 1HA GLY 97 2HA GLY 97 -6.164 -8.273 3.387
751 2HA GLY 97 1HA GLY 97 -6.403 -8.005 1.666
752 H ALA 98 H ALA 98 -5.898 -6.450 4.764
753 HA ALA 98 HA ALA 98 -4.317 -4.404 3.609
754 1HB ALA 98 1HB ALA 98 -5.874 -2.929 3.073
755 2HB ALA 98 2HB ALA 98 -6.155 -2.722 4.802
756 3HB ALA 98 3HB ALA 98 -7.125 -3.865 3.880
757 H PHE 99 H PHE 99 -2.806 -3.928 5.023
758 HA PHE 99 HA PHE 99 -2.767 -4.887 7.641
759 1HB PHE 99 2HB PHE 99 -0.728 -4.297 6.389
760 2HB PHE 99 1HB PHE 99 -1.165 -2.593 6.478
761 HD1 PHE 99 1HD PHE 99 -1.033 -5.393 8.944
762 HD2 PHE 99 2HD PHE 99 0.186 -1.440 7.939
763 HE1 PHE 99 1HE PHE 99 0.141 -5.212 11.097
764 HE2 PHE 99 2HE PHE 99 1.363 -1.254 10.093
765 HZ PHE 99 HZ PHE 99 1.342 -3.142 11.675
766 H ASP 100 H ASP 100 -3.277 -1.538 6.495
767 HA ASP 100 HA ASP 100 -5.332 -0.864 8.192
768 1HB ASP 100 2HB ASP 100 -2.898 -1.159 9.662
769 2HB ASP 100 1HB ASP 100 -3.344 0.544 9.667
770 H TYR 101 H TYR 101 -4.994 1.659 8.932
771 HA TYR 101 HA TYR 101 -4.194 3.031 6.456
772 1HB TYR 101 2HB TYR 101 -6.549 3.331 8.236
773 2HB TYR 101 1HB TYR 101 -5.862 4.817 7.587
774 HD1 TYR 101 1HD TYR 101 -7.288 1.534 6.620
775 HD2 TYR 101 2HD TYR 101 -6.258 5.457 5.362
776 HE1 TYR 101 1HE TYR 101 -8.486 1.161 4.507
777 HE2 TYR 101 2HE TYR 101 -7.455 5.097 3.241
778 HH TYR 101 HH TYR 101 -8.973 3.746 2.187
779 H LEU 102 H LEU 102 -3.261 5.126 6.662
780 HA LEU 102 HA LEU 102 -1.740 5.413 9.149
781 1HB LEU 102 2HB LEU 102 -0.375 5.177 7.211
782 2HB LEU 102 1HB LEU 102 -1.294 6.384 6.337
783 HG LEU 102 HG LEU 102 -0.423 7.974 8.254
784 1HD1 LEU 102 1HD1 LEU 102 0.734 5.738 9.177
785 2HD1 LEU 102 2HD1 LEU 102 1.420 7.347 9.405
786 3HD1 LEU 102 3HD1 LEU 102 2.013 6.310 8.107
787 1HD2 LEU 102 1HD2 LEU 102 1.007 8.805 6.691
788 2HD2 LEU 102 2HD2 LEU 102 0.080 7.716 5.668
789 3HD2 LEU 102 3HD2 LEU 102 1.660 7.225 6.278
790 HA PRO 103 HA PRO 103 -4.004 9.023 10.318
791 1HB PRO 103 2HB PRO 103 -1.540 10.072 11.534
792 2HB PRO 103 1HB PRO 103 -3.058 9.607 12.301
793 1HG PRO 103 2HG PRO 103 -0.827 8.139 12.577
794 2HG PRO 103 1HG PRO 103 -2.435 7.393 12.495
795 1HD PRO 103 2HD PRO 103 -0.343 7.633 10.363
796 2HD PRO 103 1HD PRO 103 -1.387 6.254 10.768
797 H LYS 104 H LYS 104 -2.904 11.570 10.787
798 HA LYS 104 HA LYS 104 -3.141 12.766 8.295
799 1HB LYS 104 2HB LYS 104 -3.054 13.675 10.856
800 2HB LYS 104 1HB LYS 104 -1.516 14.262 10.240
801 1HG LYS 104 2HG LYS 104 -2.729 16.021 9.577
802 2HG LYS 104 1HG LYS 104 -3.155 14.977 8.220
803 1HD LYS 104 2HD LYS 104 -5.262 15.490 8.843
804 2HD LYS 104 1HD LYS 104 -5.006 14.192 10.010
805 1HE LYS 104 2HE LYS 104 -5.950 16.158 11.092
806 2HE LYS 104 1HE LYS 104 -4.323 15.838 11.687
807 1HZ LYS 104 1HZ LYS 104 -4.849 17.775 9.511
808 2HZ LYS 104 2HZ LYS 104 -3.461 17.626 10.467
809 3HZ LYS 104 3HZ LYS 104 -4.890 18.223 11.143
810 HA PRO 105 HA PRO 105 1.767 13.347 8.326
811 1HB PRO 105 2HB PRO 105 2.368 10.830 9.807
812 2HB PRO 105 1HB PRO 105 3.232 12.372 9.810
813 1HG PRO 105 2HG PRO 105 1.704 11.694 11.871
814 2HG PRO 105 1HG PRO 105 1.730 13.365 11.275
815 1HD PRO 105 2HD PRO 105 -0.337 11.245 10.887
816 2HD PRO 105 1HD PRO 105 -0.546 12.986 11.144
817 H PHE 106 H PHE 106 3.292 12.159 6.936
818 HA PHE 106 HA PHE 106 2.514 9.605 5.900
819 1HB PHE 106 2HB PHE 106 0.945 11.086 4.696
820 2HB PHE 106 1HB PHE 106 2.309 11.998 4.060
821 HD1 PHE 106 1HD PHE 106 1.143 8.461 4.265
822 HD2 PHE 106 2HD PHE 106 3.013 11.478 1.924
823 HE1 PHE 106 1HE PHE 106 1.283 6.895 2.377
824 HE2 PHE 106 2HE PHE 106 3.156 9.919 0.026
825 HZ PHE 106 HZ PHE 106 2.289 7.624 0.252
826 H ASP 107 H ASP 107 4.055 11.629 3.575
827 HA ASP 107 HA ASP 107 6.129 11.405 2.633
828 1HB ASP 107 2HB ASP 107 7.935 12.183 4.114
829 2HB ASP 107 1HB ASP 107 6.484 13.163 4.301
830 H ILE 108 H ILE 108 8.505 10.428 3.237
831 HA ILE 108 HA ILE 108 8.111 7.628 3.175
832 HB ILE 108 HB ILE 108 10.263 9.423 2.670
833 1HG1 ILE 108 2HG1 ILE 108 11.019 7.650 1.228
834 2HG1 ILE 108 1HG1 ILE 108 10.051 6.474 2.106
835 1HG2 ILE 108 1HG2 ILE 108 11.370 8.816 4.654
836 2HG2 ILE 108 2HG2 ILE 108 12.106 7.840 3.384
837 3HG2 ILE 108 3HG2 ILE 108 10.924 7.123 4.471
838 1HD1 ILE 108 1HD1 ILE 108 8.059 7.250 1.200
839 2HD1 ILE 108 2HD1 ILE 108 9.192 7.331 -0.151
840 3HD1 ILE 108 3HD1 ILE 108 8.766 8.798 0.730
841 H ASP 109 H ASP 109 9.249 9.819 5.633
842 HA ASP 109 HA ASP 109 10.191 8.081 7.539
843 1HB ASP 109 2HB ASP 109 10.118 10.633 7.588
844 2HB ASP 109 1HB ASP 109 8.494 10.464 8.251
845 H GLU 110 H GLU 110 6.828 9.305 7.447
846 HA GLU 110 HA GLU 110 5.978 7.397 9.374
847 1HB GLU 110 2HB GLU 110 4.362 9.279 7.652
848 2HB GLU 110 1HB GLU 110 3.707 8.298 8.953
849 1HG GLU 110 2HG GLU 110 5.986 10.072 9.593
850 2HG GLU 110 1HG GLU 110 4.420 10.821 9.291
851 H ALA 111 H ALA 111 5.972 7.547 5.896
852 HA ALA 111 HA ALA 111 4.088 5.451 5.500
853 1HB ALA 111 1HB ALA 111 6.121 6.778 3.751
854 2HB ALA 111 2HB ALA 111 4.364 6.752 3.601
855 3HB ALA 111 3HB ALA 111 5.305 5.313 3.210
856 H VAL 112 H VAL 112 7.647 5.531 5.257
857 HA VAL 112 HA VAL 112 7.963 2.769 4.940
858 HB VAL 112 HB VAL 112 9.934 4.667 6.205
859 1HG1 VAL 112 1HG1 VAL 112 10.998 2.468 4.647
860 2HG1 VAL 112 2HG1 VAL 112 10.009 1.904 5.994
861 3HG1 VAL 112 3HG1 VAL 112 11.381 2.975 6.292
862 1HG2 VAL 112 1HG2 VAL 112 10.089 5.628 4.207
863 2HG2 VAL 112 2HG2 VAL 112 8.936 4.495 3.518
864 3HG2 VAL 112 3HG2 VAL 112 10.652 4.094 3.552
865 H ALA 113 H ALA 113 7.629 4.787 7.728
866 HA ALA 113 HA ALA 113 8.441 3.006 9.736
867 1HB ALA 113 1HB ALA 113 6.340 5.166 9.880
868 2HB ALA 113 2HB ALA 113 8.076 5.416 10.073
869 3HB ALA 113 3HB ALA 113 7.191 4.441 11.247
870 H LEU 114 H LEU 114 5.262 3.666 8.342
871 HA LEU 114 HA LEU 114 3.932 1.699 9.904
872 1HB LEU 114 2HB LEU 114 2.811 3.713 9.073
873 2HB LEU 114 1HB LEU 114 3.037 3.163 7.422
874 HG LEU 114 HG LEU 114 1.591 1.198 7.926
875 1HD1 LEU 114 1HD1 LEU 114 1.620 0.769 10.169
876 2HD1 LEU 114 2HD1 LEU 114 0.117 1.684 10.055
877 3HD1 LEU 114 3HD1 LEU 114 1.593 2.475 10.609
878 1HD2 LEU 114 1HD2 LEU 114 -0.398 2.345 7.602
879 2HD2 LEU 114 2HD2 LEU 114 0.813 3.501 7.047
880 3HD2 LEU 114 3HD2 LEU 114 0.087 3.682 8.644
881 H VAL 115 H VAL 115 5.682 1.628 6.932
882 HA VAL 115 HA VAL 115 4.360 -0.720 5.949
883 HB VAL 115 HB VAL 115 5.511 1.056 4.502
884 1HG1 VAL 115 1HG1 VAL 115 7.684 1.357 4.806
885 2HG1 VAL 115 2HG1 VAL 115 7.934 -0.200 4.037
886 3HG1 VAL 115 3HG1 VAL 115 7.841 -0.086 5.788
887 1HG2 VAL 115 1HG2 VAL 115 5.213 -0.391 2.842
888 2HG2 VAL 115 2HG2 VAL 115 4.853 -1.583 4.089
889 3HG2 VAL 115 3HG2 VAL 115 6.486 -1.462 3.437
890 H GLU 116 H GLU 116 7.359 -0.047 7.672
891 HA GLU 116 HA GLU 116 8.388 -2.687 7.497
892 1HB GLU 116 2HB GLU 116 8.967 -0.398 9.373
893 2HB GLU 116 1HB GLU 116 9.805 -1.942 9.470
894 1HG GLU 116 2HG GLU 116 10.712 -1.667 7.280
895 2HG GLU 116 1HG GLU 116 9.734 -0.228 7.003
896 H ARG 117 H ARG 117 6.339 -1.024 9.834
897 HA ARG 117 HA ARG 117 6.346 -3.043 11.798
898 1HB ARG 117 2HB ARG 117 4.327 -0.895 11.143
899 2HB ARG 117 1HB ARG 117 4.191 -1.955 12.539
900 1HG ARG 117 2HG ARG 117 6.500 -1.127 13.200
901 2HG ARG 117 1HG ARG 117 6.272 0.129 11.981
902 1HD ARG 117 2HD ARG 117 4.214 0.836 13.118
903 2HD ARG 117 1HD ARG 117 4.477 -0.402 14.345
904 HE ARG 117 HE ARG 117 6.772 1.101 14.328
905 1HH1 ARG 117 1HH1 ARG 117 3.378 1.736 14.833
906 2HH1 ARG 117 2HH1 ARG 117 3.659 3.062 15.911
907 1HH2 ARG 117 1HH2 ARG 117 7.142 2.843 15.745
908 2HH2 ARG 117 2HH2 ARG 117 5.797 3.691 16.428
909 H ALA 118 H ALA 118 4.733 -2.719 8.778
910 HA ALA 118 HA ALA 118 2.613 -4.546 9.245
911 1HB ALA 118 1HB ALA 118 2.727 -2.794 7.422
912 2HB ALA 118 2HB ALA 118 2.160 -4.389 6.928
913 3HB ALA 118 3HB ALA 118 3.813 -3.888 6.568
914 H ILE 119 H ILE 119 5.768 -4.838 7.611
915 HA ILE 119 HA ILE 119 5.498 -7.611 7.086
916 HB ILE 119 HB ILE 119 8.076 -6.066 7.269
917 1HG1 ILE 119 2HG1 ILE 119 6.777 -6.465 4.639
918 2HG1 ILE 119 1HG1 ILE 119 6.023 -5.277 5.698
919 1HG2 ILE 119 1HG2 ILE 119 7.272 -8.589 5.841
920 2HG2 ILE 119 2HG2 ILE 119 8.489 -8.397 7.103
921 3HG2 ILE 119 3HG2 ILE 119 8.764 -7.710 5.500
922 1HD1 ILE 119 1HD1 ILE 119 8.943 -5.256 5.004
923 2HD1 ILE 119 2HD1 ILE 119 8.007 -3.990 5.803
924 3HD1 ILE 119 3HD1 ILE 119 7.712 -4.367 4.105
925 H SER 120 H SER 120 6.784 -5.731 9.700
926 HA SER 120 HA SER 120 8.188 -7.813 11.007
927 1HB SER 120 2HB SER 120 7.207 -5.101 11.857
928 2HB SER 120 1HB SER 120 7.956 -6.200 13.017
929 HG SER 120 HG SER 120 9.501 -4.821 12.085
930 H HIS 121 H HIS 121 4.947 -6.436 11.426
931 HA HIS 121 HA HIS 121 4.202 -7.914 13.679
932 1HB HIS 121 2HB HIS 121 2.749 -6.441 11.544
933 2HB HIS 121 1HB HIS 121 1.816 -7.580 12.510
934 HD1 HIS 121 1HD HIS 121 4.188 -4.666 13.112
935 HD2 HIS 121 2HD HIS 121 0.853 -6.493 14.789
936 HE1 HIS 121 1HE HIS 121 3.558 -3.236 15.080
937 HE2 HIS 121 2HE HIS 121 1.524 -4.347 16.071
938 H TYR 122 H TYR 122 4.484 -8.836 10.373
939 HA TYR 122 HA TYR 122 2.758 -11.089 10.458
940 1HB TYR 122 2HB TYR 122 4.563 -9.857 8.539
941 2HB TYR 122 1HB TYR 122 4.599 -11.616 8.465
942 HD1 TYR 122 1HD TYR 122 3.189 -8.932 6.960
943 HD2 TYR 122 2HD TYR 122 2.004 -12.574 8.810
944 HE1 TYR 122 1HE TYR 122 1.111 -8.905 5.666
945 HE2 TYR 122 2HE TYR 122 -0.083 -12.564 7.510
946 HH TYR 122 HH TYR 122 -1.336 -9.997 6.072
947 H GLN 123 H GLN 123 6.291 -10.778 10.522
948 HA GLN 123 HA GLN 123 6.682 -13.543 11.110
949 1HB GLN 123 2HB GLN 123 9.046 -12.940 11.341
950 2HB GLN 123 1HB GLN 123 8.360 -12.255 9.875
951 1HG GLN 123 2HG GLN 123 7.975 -10.157 11.355
952 2HG GLN 123 1HG GLN 123 9.201 -10.889 12.389
953 1HE2 GLN 123 1HE2 GLN 123 11.259 -11.433 11.359
954 2HE2 GLN 123 2HE2 GLN 123 11.849 -10.416 10.094
955 H GLU 124 H GLU 124 8.589 -13.582 13.083
956 HA GLU 124 HA GLU 124 8.629 -14.007 15.332
957 1HB GLU 124 2HB GLU 124 8.779 -12.021 16.667
958 2HB GLU 124 1HB GLU 124 9.485 -11.679 15.095
959 1HG GLU 124 2HG GLU 124 7.987 -10.086 14.637
960 2HG GLU 124 1HG GLU 124 6.645 -11.023 15.286
Start of MODEL 24
1 1H MET 1 1HT MET 1 9.264 -14.482 -3.308
2 2H MET 1 2HT MET 1 9.576 -13.032 -2.445
3 3H MET 1 3HT MET 1 8.410 -13.050 -3.701
4 HA MET 1 HA MET 1 6.944 -13.319 -2.126
5 1HB MET 1 2HB MET 1 8.282 -16.019 -2.252
6 2HB MET 1 1HB MET 1 6.824 -15.748 -1.309
7 1HG MET 1 2HG MET 1 5.619 -16.117 -3.121
8 2HG MET 1 1HG MET 1 6.321 -14.678 -3.856
9 1HE MET 1 1HE MET 1 7.518 -14.862 -6.182
10 2HE MET 1 2HE MET 1 5.903 -15.573 -6.170
11 3HE MET 1 3HE MET 1 7.223 -16.395 -7.003
12 H GLN 2 H GLN 2 10.137 -14.316 -1.033
13 HA GLN 2 HA GLN 2 9.378 -13.514 1.695
14 1HB GLN 2 2HB GLN 2 9.904 -15.938 1.448
15 2HB GLN 2 1HB GLN 2 11.532 -15.486 0.956
16 1HG GLN 2 2HG GLN 2 11.639 -14.218 3.180
17 2HG GLN 2 1HG GLN 2 10.227 -15.174 3.629
18 1HE2 GLN 2 1HE2 GLN 2 10.514 -17.583 3.184
19 2HE2 GLN 2 2HE2 GLN 2 12.024 -18.265 3.667
20 H ARG 3 H ARG 3 11.568 -13.068 -0.918
21 HA ARG 3 HA ARG 3 13.762 -11.948 0.411
22 1HB ARG 3 2HB ARG 3 14.109 -10.707 -1.786
23 2HB ARG 3 1HB ARG 3 14.055 -12.462 -1.868
24 1HG ARG 3 2HG ARG 3 11.416 -11.386 -2.211
25 2HG ARG 3 1HG ARG 3 12.540 -10.629 -3.343
26 1HD ARG 3 2HD ARG 3 13.252 -12.786 -4.144
27 2HD ARG 3 1HD ARG 3 12.257 -13.602 -2.941
28 HE ARG 3 HE ARG 3 10.359 -12.357 -4.194
29 1HH1 ARG 3 1HH1 ARG 3 13.208 -13.774 -5.638
30 2HH1 ARG 3 2HH1 ARG 3 12.436 -14.085 -7.154
31 1HH2 ARG 3 1HH2 ARG 3 9.343 -12.774 -6.186
32 2HH2 ARG 3 2HH2 ARG 3 10.243 -13.518 -7.467
33 H GLY 4 H GLY 4 10.591 -10.816 0.205
34 1HA GLY 4 2HA GLY 4 9.759 -8.931 1.309
35 2HA GLY 4 1HA GLY 4 11.392 -8.278 1.377
36 H ILE 5 H ILE 5 8.457 -8.440 -0.400
37 HA ILE 5 HA ILE 5 9.606 -6.613 -2.405
38 HB ILE 5 HB ILE 5 7.196 -8.329 -2.914
39 1HG1 ILE 5 2HG1 ILE 5 8.831 -9.976 -2.463
40 2HG1 ILE 5 1HG1 ILE 5 8.833 -9.807 -4.215
41 1HG2 ILE 5 1HG2 ILE 5 8.102 -6.228 -4.281
42 2HG2 ILE 5 2HG2 ILE 5 7.317 -7.603 -5.056
43 3HG2 ILE 5 3HG2 ILE 5 9.078 -7.487 -5.034
44 1HD1 ILE 5 1HD1 ILE 5 10.971 -9.451 -2.340
45 2HD1 ILE 5 2HD1 ILE 5 10.731 -7.987 -3.289
46 3HD1 ILE 5 3HD1 ILE 5 11.022 -9.523 -4.102
47 H VAL 6 H VAL 6 8.928 -4.610 -2.015
48 HA VAL 6 HA VAL 6 6.200 -4.233 -0.990
49 HB VAL 6 HB VAL 6 7.953 -3.212 0.394
50 1HG1 VAL 6 1HG1 VAL 6 9.709 -2.697 -1.029
51 2HG1 VAL 6 2HG1 VAL 6 9.035 -1.113 -0.656
52 3HG1 VAL 6 3HG1 VAL 6 8.668 -1.886 -2.188
53 1HG2 VAL 6 1HG2 VAL 6 5.619 -2.179 -0.105
54 2HG2 VAL 6 2HG2 VAL 6 6.549 -0.940 -0.946
55 3HG2 VAL 6 3HG2 VAL 6 6.819 -1.231 0.772
56 H TRP 7 H TRP 7 4.700 -3.405 -2.260
57 HA TRP 7 HA TRP 7 5.571 -2.101 -4.746
58 1HB TRP 7 2HB TRP 7 3.253 -3.930 -4.173
59 2HB TRP 7 1HB TRP 7 3.231 -2.843 -5.561
60 HD1 TRP 7 HD1 TRP 7 6.658 -4.116 -4.856
61 HE1 TRP 7 1HE TRP 7 7.306 -5.926 -6.548
62 HE3 TRP 7 3HE TRP 7 2.069 -4.940 -6.937
63 HZ2 TRP 7 2HZ TRP 7 6.041 -7.514 -8.501
64 HZ3 TRP 7 3HZ TRP 7 1.874 -6.628 -8.716
65 HH2 TRP 7 HH2 TRP 7 3.821 -7.888 -9.481
66 H VAL 8 H VAL 8 5.061 -0.058 -4.988
67 HA VAL 8 HA VAL 8 3.029 1.087 -3.189
68 HB VAL 8 HB VAL 8 5.004 2.911 -4.410
69 1HG1 VAL 8 1HG1 VAL 8 3.447 2.626 -1.918
70 2HG1 VAL 8 2HG1 VAL 8 3.753 4.050 -2.910
71 3HG1 VAL 8 3HG1 VAL 8 4.990 3.471 -1.796
72 1HG2 VAL 8 1HG2 VAL 8 6.789 1.634 -3.896
73 2HG2 VAL 8 2HG2 VAL 8 5.858 0.575 -2.838
74 3HG2 VAL 8 3HG2 VAL 8 6.449 2.122 -2.235
75 H VAL 9 H VAL 9 1.413 2.318 -4.019
76 HA VAL 9 HA VAL 9 1.481 2.772 -6.929
77 HB VAL 9 HB VAL 9 -1.008 2.766 -6.858
78 1HG1 VAL 9 1HG1 VAL 9 -0.727 0.700 -7.629
79 2HG1 VAL 9 2HG1 VAL 9 -0.735 0.099 -5.973
80 3HG1 VAL 9 3HG1 VAL 9 0.786 0.553 -6.739
81 1HG2 VAL 9 1HG2 VAL 9 -0.619 1.672 -4.083
82 2HG2 VAL 9 2HG2 VAL 9 -2.145 1.751 -4.958
83 3HG2 VAL 9 3HG2 VAL 9 -1.322 3.235 -4.493
84 H ASP 10 H ASP 10 1.907 4.801 -7.344
85 HA ASP 10 HA ASP 10 0.274 6.928 -6.323
86 1HB ASP 10 2HB ASP 10 2.316 6.354 -4.674
87 2HB ASP 10 1HB ASP 10 3.154 7.421 -5.793
88 H ASP 11 H ASP 11 2.124 9.017 -6.929
89 HA ASP 11 HA ASP 11 1.757 9.177 -9.722
90 1HB ASP 11 2HB ASP 11 3.529 10.920 -8.006
91 2HB ASP 11 1HB ASP 11 2.847 11.326 -9.578
92 H ASP 12 H ASP 12 3.994 7.350 -8.142
93 HA ASP 12 HA ASP 12 5.855 6.239 -8.855
94 1HB ASP 12 2HB ASP 12 4.451 6.616 -11.130
95 2HB ASP 12 1HB ASP 12 5.904 7.525 -11.529
96 H SER 13 H SER 13 7.826 7.254 -10.783
97 HA SER 13 HA SER 13 9.872 8.230 -10.435
98 1HB SER 13 2HB SER 13 9.738 10.513 -11.147
99 2HB SER 13 1HB SER 13 8.467 9.586 -11.950
100 HG SER 13 HG SER 13 7.003 10.405 -10.393
101 H SER 14 H SER 14 8.428 10.996 -8.933
102 HA SER 14 HA SER 14 10.296 11.224 -6.914
103 1HB SER 14 2HB SER 14 8.531 12.922 -7.734
104 2HB SER 14 1HB SER 14 7.469 12.183 -6.536
105 HG SER 14 HG SER 14 10.034 13.253 -5.965
106 H ILE 15 H ILE 15 6.947 10.018 -6.515
107 HA ILE 15 HA ILE 15 7.263 9.233 -3.844
108 HB ILE 15 HB ILE 15 5.379 7.960 -5.824
109 1HG1 ILE 15 2HG1 ILE 15 5.169 10.414 -5.898
110 2HG1 ILE 15 1HG1 ILE 15 3.749 9.668 -5.177
111 1HG2 ILE 15 1HG2 ILE 15 3.962 7.778 -3.723
112 2HG2 ILE 15 2HG2 ILE 15 5.430 8.171 -2.827
113 3HG2 ILE 15 3HG2 ILE 15 5.369 6.718 -3.825
114 1HD1 ILE 15 1HD1 ILE 15 4.965 11.791 -4.134
115 2HD1 ILE 15 2HD1 ILE 15 5.880 10.521 -3.323
116 3HD1 ILE 15 3HD1 ILE 15 4.126 10.590 -3.154
117 H ARG 16 H ARG 16 8.175 7.714 -6.807
118 HA ARG 16 HA ARG 16 8.484 5.079 -5.714
119 1HB ARG 16 2HB ARG 16 8.064 5.337 -8.089
120 2HB ARG 16 1HB ARG 16 9.506 6.321 -8.274
121 1HG ARG 16 2HG ARG 16 10.902 4.404 -7.687
122 2HG ARG 16 1HG ARG 16 9.457 3.411 -7.497
123 1HD ARG 16 2HD ARG 16 8.976 3.475 -9.793
124 2HD ARG 16 1HD ARG 16 10.060 4.839 -10.066
125 HE ARG 16 HE ARG 16 11.357 2.441 -9.121
126 1HH1 ARG 16 1HH1 ARG 16 10.324 4.258 -11.915
127 2HH1 ARG 16 2HH1 ARG 16 11.448 3.490 -12.986
128 1HH2 ARG 16 1HH2 ARG 16 12.836 1.431 -10.522
129 2HH2 ARG 16 2HH2 ARG 16 12.873 1.882 -12.195
130 H TRP 17 H TRP 17 10.652 7.759 -6.517
131 HA TRP 17 HA TRP 17 13.043 6.450 -5.858
132 1HB TRP 17 2HB TRP 17 12.985 8.487 -7.213
133 2HB TRP 17 1HB TRP 17 12.448 9.409 -5.812
134 HD1 TRP 17 HD1 TRP 17 15.524 7.383 -6.991
135 HE1 TRP 17 1HE TRP 17 17.608 8.335 -5.820
136 HE3 TRP 17 3HE TRP 17 13.252 10.808 -3.951
137 HZ2 TRP 17 2HZ TRP 17 18.211 10.287 -3.867
138 HZ3 TRP 17 3HZ TRP 17 14.653 12.178 -2.463
139 HH2 TRP 17 HH2 TRP 17 17.081 11.922 -2.422
140 H VAL 18 H VAL 18 10.861 8.430 -3.884
141 HA VAL 18 HA VAL 18 12.561 8.489 -1.623
142 HB VAL 18 HB VAL 18 9.581 8.768 -1.451
143 1HG1 VAL 18 1HG1 VAL 18 11.439 8.863 0.488
144 2HG1 VAL 18 2HG1 VAL 18 9.944 9.797 0.529
145 3HG1 VAL 18 3HG1 VAL 18 11.440 10.553 -0.013
146 1HG2 VAL 18 1HG2 VAL 18 9.653 10.411 -2.952
147 2HG2 VAL 18 2HG2 VAL 18 11.414 10.366 -3.024
148 3HG2 VAL 18 3HG2 VAL 18 10.606 11.326 -1.784
149 H LEU 19 H LEU 19 9.975 6.354 -2.601
150 HA LEU 19 HA LEU 19 10.044 4.911 -0.123
151 1HB LEU 19 2HB LEU 19 8.092 5.307 -1.937
152 2HB LEU 19 1HB LEU 19 8.657 3.724 -2.435
153 HG LEU 19 HG LEU 19 6.761 3.553 -0.904
154 1HD1 LEU 19 1HD1 LEU 19 8.360 1.745 -0.885
155 2HD1 LEU 19 2HD1 LEU 19 7.773 2.033 0.752
156 3HD1 LEU 19 3HD1 LEU 19 9.367 2.610 0.275
157 1HD2 LEU 19 1HD2 LEU 19 7.088 5.607 0.346
158 2HD2 LEU 19 2HD2 LEU 19 8.558 4.955 1.069
159 3HD2 LEU 19 3HD2 LEU 19 6.996 4.227 1.440
160 H GLU 20 H GLU 20 11.397 4.571 -3.299
161 HA GLU 20 HA GLU 20 11.986 1.829 -3.090
162 1HB GLU 20 2HB GLU 20 13.355 2.068 -5.028
163 2HB GLU 20 1HB GLU 20 11.916 3.043 -5.239
164 1HG GLU 20 2HG GLU 20 13.249 5.033 -4.616
165 2HG GLU 20 1HG GLU 20 14.680 4.003 -4.574
166 H ARG 21 H ARG 21 14.199 4.586 -2.838
167 HA ARG 21 HA ARG 21 16.406 3.137 -1.957
168 1HB ARG 21 2HB ARG 21 15.647 6.015 -1.474
169 2HB ARG 21 1HB ARG 21 17.223 5.340 -1.078
170 1HG ARG 21 2HG ARG 21 16.461 4.733 -3.799
171 2HG ARG 21 1HG ARG 21 16.450 6.470 -3.490
172 1HD ARG 21 2HD ARG 21 18.749 6.008 -2.368
173 2HD ARG 21 1HD ARG 21 18.711 4.520 -3.310
174 HE ARG 21 HE ARG 21 18.597 5.895 -5.311
175 1HH1 ARG 21 1HH1 ARG 21 19.572 7.502 -2.360
176 2HH1 ARG 21 2HH1 ARG 21 20.375 8.791 -3.188
177 1HH2 ARG 21 1HH2 ARG 21 19.661 7.591 -6.389
178 2HH2 ARG 21 2HH2 ARG 21 20.425 8.843 -5.469
179 H ALA 22 H ALA 22 14.093 4.993 0.046
180 HA ALA 22 HA ALA 22 15.184 4.374 2.514
181 1HB ALA 22 1HB ALA 22 12.497 4.484 3.057
182 2HB ALA 22 2HB ALA 22 12.634 5.388 1.549
183 3HB ALA 22 3HB ALA 22 13.582 5.869 2.955
184 H LEU 23 H LEU 23 12.560 2.700 0.870
185 HA LEU 23 HA LEU 23 12.369 0.609 2.759
186 1HB LEU 23 2HB LEU 23 10.643 1.333 1.041
187 2HB LEU 23 1HB LEU 23 11.588 0.445 -0.138
188 HG LEU 23 HG LEU 23 9.543 -0.695 0.921
189 1HD1 LEU 23 1HD1 LEU 23 12.176 -2.144 0.953
190 2HD1 LEU 23 2HD1 LEU 23 11.259 -1.763 -0.500
191 3HD1 LEU 23 3HD1 LEU 23 10.576 -2.839 0.715
192 1HD2 LEU 23 1HD2 LEU 23 10.051 -0.160 3.245
193 2HD2 LEU 23 2HD2 LEU 23 11.545 -1.094 3.139
194 3HD2 LEU 23 3HD2 LEU 23 9.986 -1.903 2.990
195 H ALA 24 H ALA 24 14.388 1.172 0.012
196 HA ALA 24 HA ALA 24 15.256 -1.496 -0.377
197 1HB ALA 24 1HB ALA 24 16.417 1.176 -1.126
198 2HB ALA 24 2HB ALA 24 15.660 -0.026 -2.173
199 3HB ALA 24 3HB ALA 24 17.252 -0.337 -1.478
200 H GLY 25 H GLY 25 16.201 1.165 1.712
201 1HA GLY 25 2HA GLY 25 18.640 0.114 2.658
202 2HA GLY 25 1HA GLY 25 17.597 1.231 3.536
203 H ALA 26 H ALA 26 15.322 -0.685 3.328
204 HA ALA 26 HA ALA 26 15.863 -2.131 5.736
205 1HB ALA 26 1HB ALA 26 13.488 -3.044 5.217
206 2HB ALA 26 2HB ALA 26 13.468 -1.782 3.985
207 3HB ALA 26 3HB ALA 26 13.684 -1.355 5.681
208 H GLY 27 H GLY 27 16.191 -2.768 2.404
209 1HA GLY 27 2HA GLY 27 17.369 -4.662 1.618
210 2HA GLY 27 1HA GLY 27 16.832 -5.549 3.030
211 H LEU 28 H LEU 28 14.451 -3.750 1.175
212 HA LEU 28 HA LEU 28 13.594 -6.303 0.017
213 1HB LEU 28 2HB LEU 28 11.543 -4.283 0.664
214 2HB LEU 28 1HB LEU 28 11.424 -6.024 0.663
215 HG LEU 28 HG LEU 28 13.094 -5.725 2.729
216 1HD1 LEU 28 1HD1 LEU 28 13.284 -3.399 2.778
217 2HD1 LEU 28 2HD1 LEU 28 12.133 -3.783 4.060
218 3HD1 LEU 28 3HD1 LEU 28 11.558 -3.172 2.512
219 1HD2 LEU 28 1HD2 LEU 28 10.486 -6.495 2.361
220 2HD2 LEU 28 2HD2 LEU 28 10.343 -5.202 3.554
221 3HD2 LEU 28 3HD2 LEU 28 11.379 -6.592 3.879
222 H THR 29 H THR 29 12.019 -6.047 -1.817
223 HA THR 29 HA THR 29 13.161 -4.179 -3.724
224 HB THR 29 HB THR 29 11.028 -6.294 -4.063
225 HG1 THR 29 1HG THR 29 13.645 -6.390 -5.094
226 1HG2 THR 29 1HG2 THR 29 12.076 -5.930 -6.528
227 2HG2 THR 29 2HG2 THR 29 12.056 -4.276 -5.914
228 3HG2 THR 29 3HG2 THR 29 10.566 -5.218 -5.963
229 H CYS 30 H CYS 30 12.164 -2.453 -4.641
230 HA CYS 30 HA CYS 30 9.429 -1.832 -3.738
231 1HB CYS 30 2HB CYS 30 11.040 0.528 -4.232
232 2HB CYS 30 1HB CYS 30 10.076 0.102 -2.824
233 HG CYS 30 HG CYS 30 12.992 0.157 -2.812
234 H THR 31 H THR 31 8.090 -1.758 -5.378
235 HA THR 31 HA THR 31 8.986 -0.493 -7.873
236 HB THR 31 HB THR 31 8.742 -3.098 -7.968
237 HG1 THR 31 1HG THR 31 8.290 -1.188 -9.730
238 1HG2 THR 31 1HG2 THR 31 6.237 -2.641 -6.986
239 2HG2 THR 31 2HG2 THR 31 6.762 -4.083 -7.853
240 3HG2 THR 31 3HG2 THR 31 5.955 -2.781 -8.720
241 H THR 32 H THR 32 7.608 1.060 -8.587
242 HA THR 32 HA THR 32 5.135 1.381 -7.067
243 HB THR 32 HB THR 32 5.288 3.785 -7.719
244 HG1 THR 32 1HG THR 32 6.740 4.344 -9.106
245 1HG2 THR 32 1HG2 THR 32 7.882 3.391 -6.468
246 2HG2 THR 32 2HG2 THR 32 6.584 2.482 -5.700
247 3HG2 THR 32 3HG2 THR 32 6.452 4.235 -5.876
248 H PHE 33 H PHE 33 3.359 2.522 -8.193
249 HA PHE 33 HA PHE 33 3.219 1.793 -11.031
250 1HB PHE 33 2HB PHE 33 1.115 1.205 -8.949
251 2HB PHE 33 1HB PHE 33 0.976 0.900 -10.672
252 HD1 PHE 33 1HD PHE 33 1.325 -1.264 -11.354
253 HD2 PHE 33 2HD PHE 33 3.365 0.155 -7.905
254 HE1 PHE 33 1HE PHE 33 2.317 -3.478 -11.036
255 HE2 PHE 33 2HE PHE 33 4.383 -2.055 -7.591
256 HZ PHE 33 HZ PHE 33 3.830 -3.902 -9.164
257 H GLU 34 H GLU 34 1.122 2.666 -12.027
258 HA GLU 34 HA GLU 34 1.151 5.475 -11.839
259 1HB GLU 34 2HB GLU 34 -0.426 5.484 -13.562
260 2HB GLU 34 1HB GLU 34 0.435 3.974 -13.821
261 1HG GLU 34 2HG GLU 34 -1.831 3.539 -12.100
262 2HG GLU 34 1HG GLU 34 -2.329 4.364 -13.572
263 H ASN 35 H ASN 35 -0.843 3.028 -10.357
264 HA ASN 35 HA ASN 35 -1.709 4.653 -8.260
265 1HB ASN 35 2HB ASN 35 -4.020 5.083 -8.809
266 2HB ASN 35 1HB ASN 35 -3.018 5.746 -10.094
267 1HD2 ASN 35 1HD2 ASN 35 -5.539 5.411 -10.729
268 2HD2 ASN 35 2HD2 ASN 35 -5.777 4.030 -11.740
269 H GLY 36 H GLY 36 -3.841 3.572 -7.255
270 1HA GLY 36 2HA GLY 36 -3.122 1.015 -6.469
271 2HA GLY 36 1HA GLY 36 -4.727 1.694 -6.285
272 H ASN 37 H ASN 37 -4.464 1.830 -9.492
273 HA ASN 37 HA ASN 37 -5.876 -0.643 -9.822
274 1HB ASN 37 2HB ASN 37 -5.502 1.798 -11.449
275 2HB ASN 37 1HB ASN 37 -5.875 0.307 -12.307
276 1HD2 ASN 37 1HD2 ASN 37 -7.584 -0.958 -10.633
277 2HD2 ASN 37 2HD2 ASN 37 -9.021 -0.027 -10.421
278 H GLU 38 H GLU 38 -2.870 0.756 -11.111
279 HA GLU 38 HA GLU 38 -2.177 -1.191 -12.926
280 1HB GLU 38 2HB GLU 38 -0.985 1.022 -12.039
281 2HB GLU 38 1HB GLU 38 -0.042 -0.159 -11.160
282 1HG GLU 38 2HG GLU 38 0.441 -1.294 -13.328
283 2HG GLU 38 1HG GLU 38 -0.344 0.059 -14.140
284 H VAL 39 H VAL 39 -1.066 -1.147 -9.501
285 HA VAL 39 HA VAL 39 0.288 -3.531 -9.447
286 HB VAL 39 HB VAL 39 -1.427 -2.304 -7.289
287 1HG1 VAL 39 1HG1 VAL 39 0.138 -3.790 -5.820
288 2HG1 VAL 39 2HG1 VAL 39 0.222 -4.792 -7.266
289 3HG1 VAL 39 3HG1 VAL 39 -1.335 -4.466 -6.506
290 1HG2 VAL 39 1HG2 VAL 39 1.568 -2.414 -7.543
291 2HG2 VAL 39 2HG2 VAL 39 0.617 -1.471 -6.398
292 3HG2 VAL 39 3HG2 VAL 39 0.585 -1.067 -8.115
293 H LEU 40 H LEU 40 -3.178 -3.025 -9.239
294 HA LEU 40 HA LEU 40 -3.988 -5.592 -8.512
295 1HB LEU 40 2HB LEU 40 -5.489 -3.842 -10.446
296 2HB LEU 40 1HB LEU 40 -6.145 -4.993 -9.293
297 HG LEU 40 HG LEU 40 -4.791 -2.392 -8.602
298 1HD1 LEU 40 1HD1 LEU 40 -7.386 -2.442 -7.598
299 2HD1 LEU 40 2HD1 LEU 40 -7.517 -3.016 -9.258
300 3HD1 LEU 40 3HD1 LEU 40 -6.772 -1.459 -8.915
301 1HD2 LEU 40 1HD2 LEU 40 -5.443 -2.867 -6.307
302 2HD2 LEU 40 2HD2 LEU 40 -4.374 -4.123 -6.931
303 3HD2 LEU 40 3HD2 LEU 40 -6.108 -4.422 -6.808
304 H ALA 41 H ALA 41 -3.279 -4.232 -11.695
305 HA ALA 41 HA ALA 41 -3.960 -6.612 -13.118
306 1HB ALA 41 1HB ALA 41 -3.167 -5.525 -15.058
307 2HB ALA 41 2HB ALA 41 -2.146 -4.437 -14.116
308 3HB ALA 41 3HB ALA 41 -3.902 -4.263 -14.070
309 H ALA 42 H ALA 42 -0.946 -5.106 -12.126
310 HA ALA 42 HA ALA 42 0.815 -7.049 -13.134
311 1HB ALA 42 1HB ALA 42 1.846 -5.847 -10.715
312 2HB ALA 42 2HB ALA 42 1.045 -4.644 -11.726
313 3HB ALA 42 3HB ALA 42 2.353 -5.620 -12.390
314 H LEU 43 H LEU 43 -1.117 -6.949 -10.231
315 HA LEU 43 HA LEU 43 0.271 -8.898 -8.753
316 1HB LEU 43 2HB LEU 43 -2.496 -7.790 -8.655
317 2HB LEU 43 1HB LEU 43 -2.110 -9.218 -7.712
318 HG LEU 43 HG LEU 43 -0.485 -6.707 -7.477
319 1HD1 LEU 43 1HD1 LEU 43 -3.043 -7.440 -6.078
320 2HD1 LEU 43 2HD1 LEU 43 -2.687 -5.977 -6.997
321 3HD1 LEU 43 3HD1 LEU 43 -1.895 -6.258 -5.447
322 1HD2 LEU 43 1HD2 LEU 43 0.694 -7.963 -6.085
323 2HD2 LEU 43 2HD2 LEU 43 -0.376 -9.331 -6.373
324 3HD2 LEU 43 3HD2 LEU 43 -0.729 -8.190 -5.077
325 H ALA 44 H ALA 44 -1.930 -9.160 -11.393
326 HA ALA 44 HA ALA 44 -2.944 -11.727 -10.998
327 1HB ALA 44 1HB ALA 44 -4.036 -11.097 -12.820
328 2HB ALA 44 2HB ALA 44 -2.585 -11.442 -13.762
329 3HB ALA 44 3HB ALA 44 -2.863 -9.819 -13.133
330 H SER 45 H SER 45 0.268 -10.790 -11.671
331 HA SER 45 HA SER 45 0.937 -13.557 -12.303
332 1HB SER 45 2HB SER 45 1.634 -11.104 -13.722
333 2HB SER 45 1HB SER 45 3.032 -12.114 -13.354
334 HG SER 45 HG SER 45 0.663 -12.978 -14.661
335 H LYS 46 H LYS 46 1.190 -11.230 -9.981
336 HA LYS 46 HA LYS 46 3.225 -12.667 -8.598
337 1HB LYS 46 2HB LYS 46 4.241 -10.781 -10.268
338 2HB LYS 46 1HB LYS 46 4.023 -9.838 -8.800
339 1HG LYS 46 2HG LYS 46 5.230 -12.339 -8.135
340 2HG LYS 46 1HG LYS 46 6.131 -11.584 -9.451
341 1HD LYS 46 2HD LYS 46 5.747 -9.451 -7.843
342 2HD LYS 46 1HD LYS 46 5.805 -10.741 -6.642
343 1HE LYS 46 2HE LYS 46 8.003 -11.094 -6.948
344 2HE LYS 46 1HE LYS 46 7.887 -10.911 -8.698
345 1HZ LYS 46 1HZ LYS 46 7.457 -8.417 -7.445
346 2HZ LYS 46 2HZ LYS 46 8.672 -8.861 -8.533
347 3HZ LYS 46 3HZ LYS 46 8.901 -9.087 -6.873
348 H THR 47 H THR 47 3.585 -11.845 -6.409
349 HA THR 47 HA THR 47 1.565 -9.981 -5.459
350 HB THR 47 HB THR 47 2.019 -12.756 -4.361
351 HG1 THR 47 1HG THR 47 -0.078 -13.101 -4.988
352 1HG2 THR 47 1HG2 THR 47 0.279 -10.555 -3.279
353 2HG2 THR 47 2HG2 THR 47 1.658 -11.313 -2.482
354 3HG2 THR 47 3HG2 THR 47 0.195 -12.247 -2.786
355 HA PRO 48 HA PRO 48 5.325 -8.782 -3.264
356 1HB PRO 48 2HB PRO 48 4.486 -6.382 -2.402
357 2HB PRO 48 1HB PRO 48 4.927 -6.656 -4.093
358 1HG PRO 48 2HG PRO 48 2.215 -6.547 -2.838
359 2HG PRO 48 1HG PRO 48 2.765 -5.854 -4.372
360 1HD PRO 48 2HD PRO 48 1.376 -8.206 -4.173
361 2HD PRO 48 1HD PRO 48 2.490 -7.824 -5.500
362 H ASP 49 H ASP 49 5.859 -8.295 -0.996
363 HA ASP 49 HA ASP 49 4.199 -9.786 0.789
364 1HB ASP 49 2HB ASP 49 6.724 -8.189 1.209
365 2HB ASP 49 1HB ASP 49 5.904 -9.045 2.513
366 H VAL 50 H VAL 50 4.457 -6.451 -0.050
367 HA VAL 50 HA VAL 50 2.350 -5.813 1.861
368 HB VAL 50 HB VAL 50 4.424 -5.299 3.054
369 1HG1 VAL 50 1HG1 VAL 50 5.163 -3.104 1.243
370 2HG1 VAL 50 2HG1 VAL 50 5.491 -4.736 0.661
371 3HG1 VAL 50 3HG1 VAL 50 6.177 -4.188 2.187
372 1HG2 VAL 50 1HG2 VAL 50 3.852 -3.172 3.803
373 2HG2 VAL 50 2HG2 VAL 50 2.340 -3.808 3.163
374 3HG2 VAL 50 3HG2 VAL 50 3.283 -2.659 2.215
375 H LEU 51 H LEU 51 1.531 -3.492 1.425
376 HA LEU 51 HA LEU 51 2.029 -2.513 -1.260
377 1HB LEU 51 2HB LEU 51 0.184 -4.406 -1.173
378 2HB LEU 51 1HB LEU 51 -0.827 -3.097 -0.595
379 HG LEU 51 HG LEU 51 -0.511 -1.859 -2.634
380 1HD1 LEU 51 1HD1 LEU 51 1.397 -2.055 -3.740
381 2HD1 LEU 51 2HD1 LEU 51 0.822 -3.600 -4.360
382 3HD1 LEU 51 3HD1 LEU 51 1.799 -3.552 -2.898
383 1HD2 LEU 51 1HD2 LEU 51 -1.095 -4.019 -4.234
384 2HD2 LEU 51 2HD2 LEU 51 -2.254 -3.103 -3.273
385 3HD2 LEU 51 3HD2 LEU 51 -1.547 -4.584 -2.626
386 H LEU 52 H LEU 52 1.877 -0.376 -1.334
387 HA LEU 52 HA LEU 52 0.466 1.045 0.839
388 1HB LEU 52 2HB LEU 52 3.153 1.262 -0.180
389 2HB LEU 52 1HB LEU 52 2.309 2.778 -0.426
390 HG LEU 52 HG LEU 52 2.133 1.550 2.270
391 1HD1 LEU 52 1HD1 LEU 52 4.416 1.239 2.109
392 2HD1 LEU 52 2HD1 LEU 52 4.308 2.875 2.759
393 3HD1 LEU 52 3HD1 LEU 52 4.634 2.627 1.043
394 1HD2 LEU 52 1HD2 LEU 52 2.215 3.903 2.936
395 2HD2 LEU 52 2HD2 LEU 52 0.953 3.618 1.736
396 3HD2 LEU 52 3HD2 LEU 52 2.475 4.367 1.254
397 H SER 53 H SER 53 -1.222 2.323 0.203
398 HA SER 53 HA SER 53 -1.336 3.016 -2.652
399 1HB SER 53 2HB SER 53 -3.078 1.384 -1.388
400 2HB SER 53 1HB SER 53 -3.892 2.935 -1.204
401 HG SER 53 HG SER 53 -3.461 3.154 -3.561
402 H ASP 54 H ASP 54 -1.433 5.020 -3.221
403 HA ASP 54 HA ASP 54 -1.710 7.103 -1.231
404 1HB ASP 54 2HB ASP 54 0.006 7.267 -3.016
405 2HB ASP 54 1HB ASP 54 -1.274 7.321 -4.223
406 H ILE 55 H ILE 55 -3.763 7.354 -0.589
407 HA ILE 55 HA ILE 55 -6.051 6.994 -2.234
408 HB ILE 55 HB ILE 55 -6.256 6.692 0.142
409 1HG1 ILE 55 2HG1 ILE 55 -7.737 9.170 -0.773
410 2HG1 ILE 55 1HG1 ILE 55 -8.314 7.508 -0.800
411 1HG2 ILE 55 1HG2 ILE 55 -5.509 9.583 0.465
412 2HG2 ILE 55 2HG2 ILE 55 -4.423 8.223 0.733
413 3HG2 ILE 55 3HG2 ILE 55 -5.850 8.423 1.741
414 1HD1 ILE 55 1HD1 ILE 55 -9.370 8.673 0.997
415 2HD1 ILE 55 2HD1 ILE 55 -7.819 9.202 1.646
416 3HD1 ILE 55 3HD1 ILE 55 -8.258 7.492 1.672
417 H ARG 56 H ARG 56 -5.905 8.306 -4.052
418 HA ARG 56 HA ARG 56 -6.341 11.159 -3.538
419 1HB ARG 56 2HB ARG 56 -4.893 11.760 -5.420
420 2HB ARG 56 1HB ARG 56 -4.000 10.906 -4.170
421 1HG ARG 56 2HG ARG 56 -3.418 9.269 -5.562
422 2HG ARG 56 1HG ARG 56 -5.056 9.113 -6.199
423 1HD ARG 56 2HD ARG 56 -4.665 11.055 -7.648
424 2HD ARG 56 1HD ARG 56 -3.026 11.193 -7.016
425 HE ARG 56 HE ARG 56 -2.398 9.558 -8.470
426 1HH1 ARG 56 1HH1 ARG 56 -5.842 9.319 -7.980
427 2HH1 ARG 56 2HH1 ARG 56 -6.047 8.076 -9.164
428 1HH2 ARG 56 1HH2 ARG 56 -2.672 7.926 -10.035
429 2HH2 ARG 56 2HH2 ARG 56 -4.254 7.283 -10.329
430 H MET 57 H MET 57 -8.512 9.858 -3.865
431 HA MET 57 HA MET 57 -10.314 9.296 -5.147
432 1HB MET 57 2HB MET 57 -11.144 11.129 -6.483
433 2HB MET 57 1HB MET 57 -10.409 11.749 -5.011
434 1HG MET 57 2HG MET 57 -8.340 12.197 -6.363
435 2HG MET 57 1HG MET 57 -9.286 11.809 -7.798
436 1HE MET 57 1HE MET 57 -11.790 12.606 -7.637
437 2HE MET 57 2HE MET 57 -11.496 14.028 -8.636
438 3HE MET 57 3HE MET 57 -12.294 14.200 -7.073
439 HA PRO 58 HA PRO 58 -7.844 7.844 -8.914
440 1HB PRO 58 2HB PRO 58 -7.537 5.234 -8.199
441 2HB PRO 58 1HB PRO 58 -6.340 6.482 -7.837
442 1HG PRO 58 2HG PRO 58 -8.406 5.263 -6.059
443 2HG PRO 58 1HG PRO 58 -6.745 5.750 -5.685
444 1HD PRO 58 2HD PRO 58 -8.947 7.226 -5.032
445 2HD PRO 58 1HD PRO 58 -7.342 7.918 -5.299
446 H GLY 59 H GLY 59 -9.530 5.108 -7.441
447 1HA GLY 59 2HA GLY 59 -11.462 5.203 -9.659
448 2HA GLY 59 1HA GLY 59 -10.981 3.745 -8.801
449 H MET 60 H MET 60 -11.106 5.298 -6.231
450 HA MET 60 HA MET 60 -13.833 6.055 -5.857
451 1HB MET 60 2HB MET 60 -13.899 3.511 -5.931
452 2HB MET 60 1HB MET 60 -12.971 3.537 -4.437
453 1HG MET 60 2HG MET 60 -15.286 3.251 -3.915
454 2HG MET 60 1HG MET 60 -14.766 4.845 -3.376
455 1HE MET 60 1HE MET 60 -17.456 4.844 -3.119
456 2HE MET 60 2HE MET 60 -17.970 3.586 -4.242
457 3HE MET 60 3HE MET 60 -18.544 5.240 -4.450
458 H ASP 61 H ASP 61 -12.242 7.791 -5.281
459 HA ASP 61 HA ASP 61 -11.446 9.210 -3.700
460 1HB ASP 61 2HB ASP 61 -13.280 7.596 -2.307
461 2HB ASP 61 1HB ASP 61 -11.858 7.732 -1.278
462 H GLY 62 H GLY 62 -10.511 5.879 -3.577
463 1HA GLY 62 2HA GLY 62 -7.934 5.850 -3.780
464 2HA GLY 62 1HA GLY 62 -8.032 6.527 -2.161
465 H LEU 63 H LEU 63 -10.454 4.989 -1.547
466 HA LEU 63 HA LEU 63 -9.162 2.636 -0.581
467 1HB LEU 63 2HB LEU 63 -12.112 3.213 -0.474
468 2HB LEU 63 1HB LEU 63 -11.184 2.162 0.580
469 HG LEU 63 HG LEU 63 -9.930 4.459 1.117
470 1HD1 LEU 63 1HD1 LEU 63 -10.961 6.294 0.430
471 2HD1 LEU 63 2HD1 LEU 63 -12.450 5.784 1.222
472 3HD1 LEU 63 3HD1 LEU 63 -12.128 5.302 -0.443
473 1HD2 LEU 63 1HD2 LEU 63 -11.252 2.811 2.590
474 2HD2 LEU 63 2HD2 LEU 63 -12.580 3.953 2.413
475 3HD2 LEU 63 3HD2 LEU 63 -11.064 4.474 3.146
476 H ALA 64 H ALA 64 -10.700 3.451 -3.474
477 HA ALA 64 HA ALA 64 -12.092 1.161 -4.205
478 1HB ALA 64 1HB ALA 64 -10.488 2.202 -6.392
479 2HB ALA 64 2HB ALA 64 -11.274 3.480 -5.466
480 3HB ALA 64 3HB ALA 64 -12.239 2.191 -6.182
481 H LEU 65 H LEU 65 -8.680 1.683 -3.855
482 HA LEU 65 HA LEU 65 -7.653 -0.419 -5.397
483 1HB LEU 65 2HB LEU 65 -6.110 1.163 -4.583
484 2HB LEU 65 1HB LEU 65 -6.703 1.026 -2.941
485 HG LEU 65 HG LEU 65 -5.704 -1.521 -3.603
486 1HD1 LEU 65 1HD1 LEU 65 -4.536 -0.450 -5.490
487 2HD1 LEU 65 2HD1 LEU 65 -3.435 -1.111 -4.284
488 3HD1 LEU 65 3HD1 LEU 65 -3.732 0.624 -4.349
489 1HD2 LEU 65 1HD2 LEU 65 -3.838 0.035 -2.083
490 2HD2 LEU 65 2HD2 LEU 65 -4.901 -1.251 -1.543
491 3HD2 LEU 65 3HD2 LEU 65 -5.482 0.408 -1.575
492 H LEU 66 H LEU 66 -8.168 -0.345 -1.878
493 HA LEU 66 HA LEU 66 -7.722 -2.940 -1.204
494 1HB LEU 66 2HB LEU 66 -10.001 -1.277 -0.140
495 2HB LEU 66 1HB LEU 66 -9.219 -2.620 0.676
496 HG LEU 66 HG LEU 66 -7.584 -0.239 -0.109
497 1HD1 LEU 66 1HD1 LEU 66 -9.694 0.513 1.082
498 2HD1 LEU 66 2HD1 LEU 66 -8.157 0.985 1.806
499 3HD1 LEU 66 3HD1 LEU 66 -9.078 -0.351 2.488
500 1HD2 LEU 66 1HD2 LEU 66 -7.102 -1.373 2.487
501 2HD2 LEU 66 2HD2 LEU 66 -6.026 -1.253 1.096
502 3HD2 LEU 66 3HD2 LEU 66 -7.108 -2.635 1.256
503 H LYS 67 H LYS 67 -10.727 -1.630 -2.550
504 HA LYS 67 HA LYS 67 -12.339 -3.881 -2.377
505 1HB LYS 67 2HB LYS 67 -12.223 -1.675 -4.428
506 2HB LYS 67 1HB LYS 67 -13.444 -2.940 -4.482
507 1HG LYS 67 2HG LYS 67 -13.953 -2.247 -2.053
508 2HG LYS 67 1HG LYS 67 -13.064 -0.775 -2.454
509 1HD LYS 67 2HD LYS 67 -14.628 -0.711 -4.531
510 2HD LYS 67 1HD LYS 67 -15.640 -1.803 -3.582
511 1HE LYS 67 2HE LYS 67 -14.980 0.214 -1.802
512 2HE LYS 67 1HE LYS 67 -15.236 1.063 -3.326
513 1HZ LYS 67 1HZ LYS 67 -17.397 0.918 -2.922
514 2HZ LYS 67 2HZ LYS 67 -17.152 -0.072 -1.574
515 3HZ LYS 67 3HZ LYS 67 -17.300 -0.760 -3.113
516 H GLN 68 H GLN 68 -10.394 -2.898 -5.215
517 HA GLN 68 HA GLN 68 -10.836 -5.254 -6.677
518 1HB GLN 68 2HB GLN 68 -8.425 -3.459 -6.851
519 2HB GLN 68 1HB GLN 68 -9.021 -4.537 -8.103
520 1HG GLN 68 2HG GLN 68 -10.751 -2.334 -7.058
521 2HG GLN 68 1HG GLN 68 -9.500 -1.998 -8.254
522 1HE2 GLN 68 1HE2 GLN 68 -11.240 -1.350 -9.636
523 2HE2 GLN 68 2HE2 GLN 68 -12.144 -2.536 -10.507
524 H ILE 69 H ILE 69 -8.569 -4.489 -4.150
525 HA ILE 69 HA ILE 69 -6.695 -6.531 -4.597
526 HB ILE 69 HB ILE 69 -7.489 -5.216 -2.004
527 1HG1 ILE 69 2HG1 ILE 69 -5.050 -4.686 -3.696
528 2HG1 ILE 69 1HG1 ILE 69 -6.555 -3.796 -3.903
529 1HG2 ILE 69 1HG2 ILE 69 -5.920 -7.508 -2.353
530 2HG2 ILE 69 2HG2 ILE 69 -6.063 -6.525 -0.905
531 3HG2 ILE 69 3HG2 ILE 69 -4.781 -6.193 -2.067
532 1HD1 ILE 69 1HD1 ILE 69 -6.175 -2.534 -2.118
533 2HD1 ILE 69 2HD1 ILE 69 -4.514 -3.112 -2.228
534 3HD1 ILE 69 3HD1 ILE 69 -5.657 -3.906 -1.149
535 H LYS 70 H LYS 70 -9.662 -6.472 -2.720
536 HA LYS 70 HA LYS 70 -9.341 -9.059 -1.645
537 1HB LYS 70 2HB LYS 70 -11.643 -8.914 -0.941
538 2HB LYS 70 1HB LYS 70 -10.849 -7.373 -0.657
539 1HG LYS 70 2HG LYS 70 -12.127 -6.280 -2.152
540 2HG LYS 70 1HG LYS 70 -12.238 -7.665 -3.241
541 1HD LYS 70 2HD LYS 70 -14.393 -7.569 -2.461
542 2HD LYS 70 1HD LYS 70 -13.676 -8.669 -1.281
543 1HE LYS 70 2HE LYS 70 -14.111 -7.260 0.376
544 2HE LYS 70 1HE LYS 70 -13.290 -5.944 -0.459
545 1HZ LYS 70 1HZ LYS 70 -15.914 -5.996 0.088
546 2HZ LYS 70 2HZ LYS 70 -15.911 -6.593 -1.494
547 3HZ LYS 70 3HZ LYS 70 -15.220 -5.085 -1.158
548 H GLN 71 H GLN 71 -10.577 -7.849 -4.628
549 HA GLN 71 HA GLN 71 -11.981 -10.167 -5.432
550 1HB GLN 71 2HB GLN 71 -10.982 -7.711 -6.773
551 2HB GLN 71 1HB GLN 71 -11.414 -9.080 -7.788
552 1HG GLN 71 2HG GLN 71 -13.641 -8.961 -7.239
553 2HG GLN 71 1HG GLN 71 -13.329 -8.142 -5.709
554 1HE2 GLN 71 1HE2 GLN 71 -12.678 -5.914 -5.791
555 2HE2 GLN 71 2HE2 GLN 71 -13.206 -4.911 -7.095
556 H ARG 72 H ARG 72 -8.697 -9.052 -5.900
557 HA ARG 72 HA ARG 72 -8.004 -11.463 -7.384
558 1HB ARG 72 2HB ARG 72 -6.342 -9.041 -6.690
559 2HB ARG 72 1HB ARG 72 -5.799 -10.383 -7.685
560 1HG ARG 72 2HG ARG 72 -7.168 -9.793 -9.454
561 2HG ARG 72 1HG ARG 72 -8.251 -8.849 -8.430
562 1HD ARG 72 2HD ARG 72 -6.272 -7.297 -8.042
563 2HD ARG 72 1HD ARG 72 -5.489 -8.140 -9.379
564 HE ARG 72 HE ARG 72 -7.561 -6.184 -9.556
565 1HH1 ARG 72 1HH1 ARG 72 -6.256 -9.025 -11.108
566 2HH1 ARG 72 2HH1 ARG 72 -6.846 -8.592 -12.677
567 1HH2 ARG 72 1HH2 ARG 72 -8.326 -5.607 -11.618
568 2HH2 ARG 72 2HH2 ARG 72 -8.020 -6.650 -12.967
569 H HIS 73 H HIS 73 -6.193 -9.727 -4.943
570 HA HIS 73 HA HIS 73 -5.690 -12.273 -3.563
571 1HB HIS 73 2HB HIS 73 -3.550 -11.321 -2.814
572 2HB HIS 73 1HB HIS 73 -3.657 -11.365 -4.569
573 HD1 HIS 73 1HD HIS 73 -1.633 -9.529 -3.387
574 HD2 HIS 73 2HD HIS 73 -5.535 -8.320 -4.104
575 HE1 HIS 73 1HE HIS 73 -1.555 -7.018 -3.514
576 HE2 HIS 73 2HE HIS 73 -3.940 -6.311 -3.865
577 HA PRO 74 HA PRO 74 -8.059 -9.606 -0.603
578 1HB PRO 74 2HB PRO 74 -9.581 -11.610 0.405
579 2HB PRO 74 1HB PRO 74 -10.011 -10.735 -1.069
580 1HG PRO 74 2HG PRO 74 -8.680 -13.400 -0.768
581 2HG PRO 74 1HG PRO 74 -9.972 -12.914 -1.881
582 1HD PRO 74 2HD PRO 74 -7.381 -13.096 -2.649
583 2HD PRO 74 1HD PRO 74 -8.506 -11.914 -3.349
584 H MET 75 H MET 75 -5.459 -10.322 -0.085
585 HA MET 75 HA MET 75 -5.603 -10.972 2.734
586 1HB MET 75 2HB MET 75 -3.949 -12.577 0.795
587 2HB MET 75 1HB MET 75 -3.712 -12.606 2.537
588 1HG MET 75 2HG MET 75 -5.532 -13.877 2.904
589 2HG MET 75 1HG MET 75 -6.451 -13.136 1.597
590 1HE MET 75 1HE MET 75 -5.194 -17.093 1.897
591 2HE MET 75 2HE MET 75 -4.846 -15.793 3.038
592 3HE MET 75 3HE MET 75 -3.586 -16.372 1.947
593 H LEU 76 H LEU 76 -3.716 -10.027 -0.031
594 HA LEU 76 HA LEU 76 -1.344 -9.212 1.038
595 1HB LEU 76 2HB LEU 76 -2.655 -8.941 -1.371
596 2HB LEU 76 1HB LEU 76 -2.429 -7.279 -0.862
597 HG LEU 76 HG LEU 76 -0.643 -8.278 -2.361
598 1HD1 LEU 76 1HD1 LEU 76 0.779 -7.360 0.007
599 2HD1 LEU 76 2HD1 LEU 76 -0.596 -6.353 -0.462
600 3HD1 LEU 76 3HD1 LEU 76 0.697 -6.676 -1.619
601 1HD2 LEU 76 1HD2 LEU 76 0.899 -9.773 -1.545
602 2HD2 LEU 76 2HD2 LEU 76 -0.620 -10.412 -0.923
603 3HD2 LEU 76 3HD2 LEU 76 0.449 -9.489 0.136
604 HA PRO 77 HA PRO 77 -2.726 -6.053 3.937
605 1HB PRO 77 2HB PRO 77 -0.212 -5.298 4.714
606 2HB PRO 77 1HB PRO 77 -1.073 -6.689 5.378
607 1HG PRO 77 2HG PRO 77 1.045 -6.601 3.273
608 2HG PRO 77 1HG PRO 77 0.829 -7.759 4.598
609 1HD PRO 77 2HD PRO 77 0.111 -8.322 2.056
610 2HD PRO 77 1HD PRO 77 -0.776 -8.959 3.456
611 H VAL 78 H VAL 78 -3.174 -3.962 3.554
612 HA VAL 78 HA VAL 78 -1.485 -2.533 1.605
613 HB VAL 78 HB VAL 78 -4.428 -2.012 1.958
614 1HG1 VAL 78 1HG1 VAL 78 -3.028 -1.510 -0.587
615 2HG1 VAL 78 2HG1 VAL 78 -2.553 -0.493 0.773
616 3HG1 VAL 78 3HG1 VAL 78 -4.238 -0.545 0.258
617 1HG2 VAL 78 1HG2 VAL 78 -3.520 -3.493 -0.431
618 2HG2 VAL 78 2HG2 VAL 78 -5.028 -3.606 0.476
619 3HG2 VAL 78 3HG2 VAL 78 -3.578 -4.404 1.077
620 H ILE 79 H ILE 79 -1.014 -0.390 1.995
621 HA ILE 79 HA ILE 79 -1.914 0.693 4.584
622 HB ILE 79 HB ILE 79 0.795 1.220 3.391
623 1HG1 ILE 79 2HG1 ILE 79 0.914 -0.417 5.741
624 2HG1 ILE 79 1HG1 ILE 79 -0.121 -1.198 4.549
625 1HG2 ILE 79 1HG2 ILE 79 1.140 2.584 5.115
626 2HG2 ILE 79 2HG2 ILE 79 0.481 1.418 6.261
627 3HG2 ILE 79 3HG2 ILE 79 -0.600 2.505 5.391
628 1HD1 ILE 79 1HD1 ILE 79 2.139 -1.955 4.300
629 2HD1 ILE 79 2HD1 ILE 79 2.715 -0.295 4.144
630 3HD1 ILE 79 3HD1 ILE 79 1.683 -0.992 2.893
631 H ILE 80 H ILE 80 -3.233 2.312 4.179
632 HA ILE 80 HA ILE 80 -2.777 3.994 1.828
633 HB ILE 80 HB ILE 80 -5.171 4.176 3.624
634 1HG1 ILE 80 2HG1 ILE 80 -5.038 1.827 3.092
635 2HG1 ILE 80 1HG1 ILE 80 -6.284 2.541 2.077
636 1HG2 ILE 80 1HG2 ILE 80 -5.962 5.563 2.077
637 2HG2 ILE 80 2HG2 ILE 80 -5.573 4.442 0.772
638 3HG2 ILE 80 3HG2 ILE 80 -4.348 5.562 1.367
639 1HD1 ILE 80 1HD1 ILE 80 -3.856 2.688 0.653
640 2HD1 ILE 80 2HD1 ILE 80 -5.277 1.707 0.299
641 3HD1 ILE 80 3HD1 ILE 80 -3.990 1.061 1.315
642 H MET 81 H MET 81 -2.680 6.235 1.933
643 HA MET 81 HA MET 81 -1.370 7.286 4.255
644 1HB MET 81 2HB MET 81 -0.618 8.014 2.106
645 2HB MET 81 1HB MET 81 -2.237 8.518 1.643
646 1HG MET 81 2HG MET 81 -2.163 10.298 3.309
647 2HG MET 81 1HG MET 81 -0.544 9.790 3.782
648 1HE MET 81 1HE MET 81 -2.061 12.115 0.300
649 2HE MET 81 2HE MET 81 -2.822 10.707 1.038
650 3HE MET 81 3HE MET 81 -1.736 10.501 -0.335
651 H THR 82 H THR 82 -4.284 8.379 2.550
652 HA THR 82 HA THR 82 -5.245 9.612 5.037
653 HB THR 82 HB THR 82 -5.752 10.283 2.137
654 HG1 THR 82 1HG THR 82 -4.511 11.956 2.510
655 1HG2 THR 82 1HG2 THR 82 -7.409 11.713 2.561
656 2HG2 THR 82 2HG2 THR 82 -6.788 12.124 4.158
657 3HG2 THR 82 3HG2 THR 82 -7.716 10.643 3.926
658 H ALA 83 H ALA 83 -7.469 9.431 5.616
659 HA ALA 83 HA ALA 83 -8.986 7.315 4.243
660 1HB ALA 83 1HB ALA 83 -9.109 5.959 6.026
661 2HB ALA 83 2HB ALA 83 -9.251 7.301 7.164
662 3HB ALA 83 3HB ALA 83 -7.665 6.820 6.562
663 H HIS 84 H HIS 84 -8.990 10.416 5.399
664 HA HIS 84 HA HIS 84 -11.591 10.629 6.497
665 1HB HIS 84 2HB HIS 84 -10.212 12.960 5.217
666 2HB HIS 84 1HB HIS 84 -11.178 12.907 6.687
667 HD1 HIS 84 1HD HIS 84 -9.853 13.048 8.778
668 HD2 HIS 84 2HD HIS 84 -7.612 11.495 5.641
669 HE1 HIS 84 1HE HIS 84 -7.551 12.672 9.706
670 HE2 HIS 84 2HE HIS 84 -6.188 11.828 7.770
671 H SER 85 H SER 85 -11.677 9.253 3.942
672 HA SER 85 HA SER 85 -13.801 10.768 2.754
673 1HB SER 85 2HB SER 85 -12.833 10.853 0.484
674 2HB SER 85 1HB SER 85 -11.903 11.818 1.628
675 HG SER 85 HG SER 85 -10.911 9.354 1.627
676 H ASP 86 H ASP 86 -15.218 9.128 2.911
677 HA ASP 86 HA ASP 86 -16.304 7.205 2.366
678 1HB ASP 86 2HB ASP 86 -15.065 7.842 0.078
679 2HB ASP 86 1HB ASP 86 -14.234 6.328 0.420
680 H LEU 87 H LEU 87 -14.384 7.259 4.473
681 HA LEU 87 HA LEU 87 -12.557 5.245 4.658
682 1HB LEU 87 2HB LEU 87 -13.877 6.942 6.444
683 2HB LEU 87 1HB LEU 87 -14.147 5.329 7.072
684 HG LEU 87 HG LEU 87 -11.438 6.513 6.464
685 1HD1 LEU 87 1HD1 LEU 87 -11.150 6.634 8.871
686 2HD1 LEU 87 2HD1 LEU 87 -12.792 6.033 9.112
687 3HD1 LEU 87 3HD1 LEU 87 -12.530 7.608 8.362
688 1HD2 LEU 87 1HD2 LEU 87 -11.770 4.001 6.283
689 2HD2 LEU 87 2HD2 LEU 87 -12.023 4.023 8.026
690 3HD2 LEU 87 3HD2 LEU 87 -10.489 4.572 7.347
691 H ASP 88 H ASP 88 -15.968 4.868 4.387
692 HA ASP 88 HA ASP 88 -16.515 2.491 5.618
693 1HB ASP 88 2HB ASP 88 -17.504 3.593 2.994
694 2HB ASP 88 1HB ASP 88 -18.135 2.100 3.678
695 H ALA 89 H ALA 89 -15.196 2.849 2.316
696 HA ALA 89 HA ALA 89 -15.027 0.112 1.750
697 1HB ALA 89 1HB ALA 89 -13.330 0.790 0.036
698 2HB ALA 89 2HB ALA 89 -13.451 2.432 0.670
699 3HB ALA 89 3HB ALA 89 -14.865 1.659 -0.045
700 H ALA 90 H ALA 90 -13.088 2.078 3.786
701 HA ALA 90 HA ALA 90 -10.699 0.533 3.681
702 1HB ALA 90 1HB ALA 90 -11.626 2.233 5.982
703 2HB ALA 90 2HB ALA 90 -10.877 2.892 4.530
704 3HB ALA 90 3HB ALA 90 -9.976 1.790 5.567
705 H VAL 91 H VAL 91 -13.656 0.387 5.565
706 HA VAL 91 HA VAL 91 -12.774 -1.383 7.547
707 HB VAL 91 HB VAL 91 -15.583 -1.391 6.493
708 1HG1 VAL 91 1HG1 VAL 91 -15.696 -1.509 9.201
709 2HG1 VAL 91 2HG1 VAL 91 -14.161 -2.332 8.893
710 3HG1 VAL 91 3HG1 VAL 91 -15.651 -2.923 8.145
711 1HG2 VAL 91 1HG2 VAL 91 -15.530 0.390 8.607
712 2HG2 VAL 91 2HG2 VAL 91 -15.685 0.806 6.901
713 3HG2 VAL 91 3HG2 VAL 91 -14.099 0.816 7.670
714 H SER 92 H SER 92 -14.419 -2.059 4.458
715 HA SER 92 HA SER 92 -14.451 -4.851 4.737
716 1HB SER 92 2HB SER 92 -14.212 -3.314 2.140
717 2HB SER 92 1HB SER 92 -14.825 -4.957 2.345
718 HG SER 92 HG SER 92 -16.472 -3.970 3.720
719 H ALA 93 H ALA 93 -11.908 -2.654 4.041
720 HA ALA 93 HA ALA 93 -10.149 -4.386 2.704
721 1HB ALA 93 1HB ALA 93 -9.286 -2.131 4.475
722 2HB ALA 93 2HB ALA 93 -10.023 -1.860 2.896
723 3HB ALA 93 3HB ALA 93 -8.504 -2.744 3.017
724 H TYR 94 H TYR 94 -10.399 -3.480 6.104
725 HA TYR 94 HA TYR 94 -8.347 -5.072 7.110
726 1HB TYR 94 2HB TYR 94 -10.924 -4.647 8.613
727 2HB TYR 94 1HB TYR 94 -9.290 -4.775 9.256
728 HD1 TYR 94 1HD TYR 94 -11.832 -2.549 8.879
729 HD2 TYR 94 2HD TYR 94 -7.679 -2.890 7.976
730 HE1 TYR 94 1HE TYR 94 -11.633 -0.100 8.858
731 HE2 TYR 94 2HE TYR 94 -7.478 -0.439 7.954
732 HH TYR 94 HH TYR 94 -10.005 1.606 7.700
733 H GLN 95 H GLN 95 -11.453 -5.902 5.928
734 HA GLN 95 HA GLN 95 -11.612 -8.496 7.137
735 1HB GLN 95 2HB GLN 95 -13.720 -7.747 6.644
736 2HB GLN 95 1HB GLN 95 -13.201 -6.894 5.203
737 1HG GLN 95 2HG GLN 95 -12.869 -9.567 4.547
738 2HG GLN 95 1HG GLN 95 -14.355 -9.530 5.492
739 1HE2 GLN 95 1HE2 GLN 95 -12.844 -7.352 3.127
740 2HE2 GLN 95 2HE2 GLN 95 -14.245 -7.197 2.129
741 H GLN 96 H GLN 96 -10.315 -7.138 4.185
742 HA GLN 96 HA GLN 96 -9.836 -9.767 3.077
743 1HB GLN 96 2HB GLN 96 -9.005 -8.638 1.103
744 2HB GLN 96 1HB GLN 96 -10.577 -7.983 1.562
745 1HG GLN 96 2HG GLN 96 -9.757 -5.939 1.877
746 2HG GLN 96 1HG GLN 96 -8.347 -6.537 2.748
747 1HE2 GLN 96 1HE2 GLN 96 -7.191 -4.869 1.627
748 2HE2 GLN 96 2HE2 GLN 96 -6.644 -5.136 0.013
749 H GLY 97 H GLY 97 -8.227 -7.436 4.997
750 1HA GLY 97 2HA GLY 97 -6.219 -8.508 6.077
751 2HA GLY 97 1HA GLY 97 -5.655 -8.775 4.439
752 H ALA 98 H ALA 98 -7.254 -5.771 4.884
753 HA ALA 98 HA ALA 98 -5.056 -4.239 4.131
754 1HB ALA 98 1HB ALA 98 -6.426 -2.446 4.313
755 2HB ALA 98 2HB ALA 98 -7.051 -2.942 5.885
756 3HB ALA 98 3HB ALA 98 -7.645 -3.708 4.419
757 H PHE 99 H PHE 99 -3.539 -3.012 5.259
758 HA PHE 99 HA PHE 99 -2.842 -4.051 7.830
759 1HB PHE 99 2HB PHE 99 -1.231 -3.325 5.962
760 2HB PHE 99 1HB PHE 99 -1.530 -1.683 6.524
761 HD1 PHE 99 1HD PHE 99 -0.819 -4.996 8.083
762 HD2 PHE 99 2HD PHE 99 0.086 -0.845 7.907
763 HE1 PHE 99 1HE PHE 99 0.862 -5.293 9.850
764 HE2 PHE 99 2HE PHE 99 1.775 -1.134 9.671
765 HZ PHE 99 HZ PHE 99 2.164 -3.359 10.649
766 H ASP 100 H ASP 100 -3.621 -0.780 6.628
767 HA ASP 100 HA ASP 100 -5.345 -0.047 8.661
768 1HB ASP 100 2HB ASP 100 -4.024 1.193 10.245
769 2HB ASP 100 1HB ASP 100 -3.316 -0.411 10.119
770 H TYR 101 H TYR 101 -4.728 2.597 9.135
771 HA TYR 101 HA TYR 101 -4.348 3.848 6.508
772 1HB TYR 101 2HB TYR 101 -6.820 3.827 8.137
773 2HB TYR 101 1HB TYR 101 -6.344 5.395 7.500
774 HD1 TYR 101 1HD TYR 101 -7.228 1.928 6.548
775 HD2 TYR 101 2HD TYR 101 -6.671 5.931 5.211
776 HE1 TYR 101 1HE TYR 101 -8.279 1.356 4.395
777 HE2 TYR 101 2HE TYR 101 -7.719 5.369 3.060
778 HH TYR 101 HH TYR 101 -8.003 3.043 1.695
779 H LEU 102 H LEU 102 -3.758 6.106 6.638
780 HA LEU 102 HA LEU 102 -2.527 6.767 9.221
781 1HB LEU 102 2HB LEU 102 -1.808 7.214 6.412
782 2HB LEU 102 1HB LEU 102 -1.546 8.603 7.449
783 HG LEU 102 HG LEU 102 -0.059 7.332 8.866
784 1HD1 LEU 102 1HD1 LEU 102 -1.385 5.153 8.389
785 2HD1 LEU 102 2HD1 LEU 102 0.349 5.080 8.700
786 3HD1 LEU 102 3HD1 LEU 102 -0.252 4.980 7.047
787 1HD2 LEU 102 1HD2 LEU 102 0.361 7.498 5.962
788 2HD2 LEU 102 2HD2 LEU 102 1.493 6.481 6.853
789 3HD2 LEU 102 3HD2 LEU 102 1.298 8.177 7.289
790 HA PRO 103 HA PRO 103 -5.610 9.973 9.561
791 1HB PRO 103 2HB PRO 103 -4.773 11.012 11.933
792 2HB PRO 103 1HB PRO 103 -5.720 9.530 11.798
793 1HG PRO 103 2HG PRO 103 -2.845 9.885 12.390
794 2HG PRO 103 1HG PRO 103 -3.941 8.581 12.861
795 1HD PRO 103 2HD PRO 103 -2.042 8.498 10.795
796 2HD PRO 103 1HD PRO 103 -3.344 7.330 11.078
797 H LYS 104 H LYS 104 -2.688 11.264 11.093
798 HA LYS 104 HA LYS 104 -2.816 13.524 9.232
799 1HB LYS 104 2HB LYS 104 -2.103 13.286 12.105
800 2HB LYS 104 1HB LYS 104 -1.259 14.504 11.158
801 1HG LYS 104 2HG LYS 104 -3.026 15.851 11.141
802 2HG LYS 104 1HG LYS 104 -4.111 14.544 10.665
803 1HD LYS 104 2HD LYS 104 -4.984 15.016 12.716
804 2HD LYS 104 1HD LYS 104 -3.763 13.835 13.197
805 1HE LYS 104 2HE LYS 104 -2.880 15.365 14.543
806 2HE LYS 104 1HE LYS 104 -2.464 16.327 13.124
807 1HZ LYS 104 1HZ LYS 104 -4.845 17.180 13.290
808 2HZ LYS 104 2HZ LYS 104 -3.736 17.741 14.438
809 3HZ LYS 104 3HZ LYS 104 -4.848 16.539 14.857
810 HA PRO 105 HA PRO 105 1.925 12.604 9.521
811 1HB PRO 105 2HB PRO 105 2.633 10.150 10.502
812 2HB PRO 105 1HB PRO 105 2.586 11.626 11.474
813 1HG PRO 105 2HG PRO 105 0.556 9.441 11.247
814 2HG PRO 105 1HG PRO 105 1.119 10.304 12.692
815 1HD PRO 105 2HD PRO 105 -1.215 10.895 11.500
816 2HD PRO 105 1HD PRO 105 -0.218 12.146 12.263
817 H PHE 106 H PHE 106 3.265 11.429 8.069
818 HA PHE 106 HA PHE 106 2.380 9.106 6.693
819 1HB PHE 106 2HB PHE 106 0.807 10.654 5.650
820 2HB PHE 106 1HB PHE 106 2.116 11.754 5.237
821 HD1 PHE 106 1HD PHE 106 2.696 11.761 3.022
822 HD2 PHE 106 2HD PHE 106 1.371 8.124 4.771
823 HE1 PHE 106 1HE PHE 106 2.968 10.622 0.858
824 HE2 PHE 106 2HE PHE 106 1.639 6.976 2.618
825 HZ PHE 106 HZ PHE 106 2.441 8.225 0.655
826 H ASP 107 H ASP 107 3.930 11.387 4.621
827 HA ASP 107 HA ASP 107 5.989 11.272 3.635
828 1HB ASP 107 2HB ASP 107 7.841 11.782 5.199
829 2HB ASP 107 1HB ASP 107 6.432 12.806 5.457
830 H ILE 108 H ILE 108 8.325 10.174 3.882
831 HA ILE 108 HA ILE 108 7.836 7.401 3.610
832 HB ILE 108 HB ILE 108 9.996 9.153 3.005
833 1HG1 ILE 108 2HG1 ILE 108 10.525 7.404 1.390
834 2HG1 ILE 108 1HG1 ILE 108 9.496 6.273 2.260
835 1HG2 ILE 108 1HG2 ILE 108 11.842 7.468 3.371
836 2HG2 ILE 108 2HG2 ILE 108 10.761 6.666 4.505
837 3HG2 ILE 108 3HG2 ILE 108 11.283 8.320 4.811
838 1HD1 ILE 108 1HD1 ILE 108 8.590 7.396 0.137
839 2HD1 ILE 108 2HD1 ILE 108 8.374 8.813 1.164
840 3HD1 ILE 108 3HD1 ILE 108 7.551 7.305 1.560
841 H ASP 109 H ASP 109 9.351 9.288 6.125
842 HA ASP 109 HA ASP 109 10.379 7.319 7.734
843 1HB ASP 109 2HB ASP 109 9.139 9.974 8.361
844 2HB ASP 109 1HB ASP 109 9.646 8.915 9.671
845 H GLU 110 H GLU 110 7.058 8.641 8.081
846 HA GLU 110 HA GLU 110 6.322 6.565 9.875
847 1HB GLU 110 2HB GLU 110 4.662 8.660 8.484
848 2HB GLU 110 1HB GLU 110 4.003 7.503 9.626
849 1HG GLU 110 2HG GLU 110 6.331 9.017 10.578
850 2HG GLU 110 1HG GLU 110 4.873 9.966 10.280
851 H ALA 111 H ALA 111 5.902 7.114 6.448
852 HA ALA 111 HA ALA 111 4.024 5.050 6.008
853 1HB ALA 111 1HB ALA 111 4.919 7.019 4.459
854 2HB ALA 111 2HB ALA 111 4.165 5.570 3.806
855 3HB ALA 111 3HB ALA 111 5.923 5.713 3.835
856 H VAL 112 H VAL 112 7.555 5.117 5.422
857 HA VAL 112 HA VAL 112 7.767 2.390 4.800
858 HB VAL 112 HB VAL 112 9.916 4.148 5.979
859 1HG1 VAL 112 1HG1 VAL 112 10.759 2.066 4.151
860 2HG1 VAL 112 2HG1 VAL 112 9.901 1.399 5.542
861 3HG1 VAL 112 3HG1 VAL 112 11.320 2.422 5.786
862 1HG2 VAL 112 1HG2 VAL 112 9.562 5.286 4.060
863 2HG2 VAL 112 2HG2 VAL 112 8.725 3.940 3.292
864 3HG2 VAL 112 3HG2 VAL 112 10.487 3.968 3.347
865 H ALA 113 H ALA 113 7.809 4.121 7.797
866 HA ALA 113 HA ALA 113 8.784 2.119 9.508
867 1HB ALA 113 1HB ALA 113 7.693 3.412 11.280
868 2HB ALA 113 2HB ALA 113 6.803 4.324 10.057
869 3HB ALA 113 3HB ALA 113 8.558 4.462 10.159
870 H LEU 114 H LEU 114 5.522 3.009 8.528
871 HA LEU 114 HA LEU 114 4.233 0.967 10.018
872 1HB LEU 114 2HB LEU 114 3.173 3.096 9.496
873 2HB LEU 114 1HB LEU 114 3.263 2.738 7.785
874 HG LEU 114 HG LEU 114 1.720 0.780 8.222
875 1HD1 LEU 114 1HD1 LEU 114 1.504 2.159 10.892
876 2HD1 LEU 114 2HD1 LEU 114 1.963 0.487 10.583
877 3HD1 LEU 114 3HD1 LEU 114 0.310 1.018 10.273
878 1HD2 LEU 114 1HD2 LEU 114 1.152 3.170 7.409
879 2HD2 LEU 114 2HD2 LEU 114 0.444 3.358 9.013
880 3HD2 LEU 114 3HD2 LEU 114 -0.156 2.110 7.930
881 H VAL 115 H VAL 115 5.659 1.110 6.860
882 HA VAL 115 HA VAL 115 4.161 -1.131 5.852
883 HB VAL 115 HB VAL 115 5.122 0.672 4.365
884 1HG1 VAL 115 1HG1 VAL 115 7.330 0.922 5.110
885 2HG1 VAL 115 2HG1 VAL 115 7.454 0.163 3.533
886 3HG1 VAL 115 3HG1 VAL 115 7.666 -0.797 4.994
887 1HG2 VAL 115 1HG2 VAL 115 5.809 -0.997 2.582
888 2HG2 VAL 115 2HG2 VAL 115 4.219 -1.219 3.307
889 3HG2 VAL 115 3HG2 VAL 115 5.565 -2.244 3.805
890 H GLU 116 H GLU 116 7.425 -0.636 7.116
891 HA GLU 116 HA GLU 116 8.388 -3.238 6.664
892 1HB GLU 116 2HB GLU 116 9.149 -1.148 8.705
893 2HB GLU 116 1HB GLU 116 10.023 -2.661 8.505
894 1HG GLU 116 2HG GLU 116 10.109 -1.863 5.989
895 2HG GLU 116 1HG GLU 116 9.912 -0.281 6.740
896 H ARG 117 H ARG 117 6.858 -1.794 9.522
897 HA ARG 117 HA ARG 117 6.999 -4.054 11.168
898 1HB ARG 117 2HB ARG 117 5.237 -2.987 12.491
899 2HB ARG 117 1HB ARG 117 6.472 -1.828 12.023
900 1HG ARG 117 2HG ARG 117 5.008 -1.046 10.201
901 2HG ARG 117 1HG ARG 117 3.758 -2.161 10.764
902 1HD ARG 117 2HD ARG 117 3.346 0.067 11.623
903 2HD ARG 117 1HD ARG 117 3.747 -1.027 12.940
904 HE ARG 117 HE ARG 117 6.052 -0.038 12.776
905 1HH1 ARG 117 1HH1 ARG 117 3.215 1.778 11.824
906 2HH1 ARG 117 2HH1 ARG 117 3.959 3.314 12.103
907 1HH2 ARG 117 1HH2 ARG 117 7.016 1.986 13.144
908 2HH2 ARG 117 2HH2 ARG 117 6.111 3.434 12.852
909 H ALA 118 H ALA 118 4.975 -3.315 8.492
910 HA ALA 118 HA ALA 118 2.868 -5.120 9.123
911 1HB ALA 118 1HB ALA 118 2.650 -3.134 7.612
912 2HB ALA 118 2HB ALA 118 2.003 -4.638 6.954
913 3HB ALA 118 3HB ALA 118 3.569 -4.035 6.405
914 H ILE 119 H ILE 119 5.648 -5.250 6.915
915 HA ILE 119 HA ILE 119 5.121 -7.878 6.007
916 HB ILE 119 HB ILE 119 7.818 -6.550 6.065
917 1HG1 ILE 119 2HG1 ILE 119 6.176 -6.322 3.620
918 2HG1 ILE 119 1HG1 ILE 119 5.652 -5.333 4.980
919 1HG2 ILE 119 1HG2 ILE 119 6.588 -8.739 4.431
920 2HG2 ILE 119 2HG2 ILE 119 8.074 -8.764 5.381
921 3HG2 ILE 119 3HG2 ILE 119 8.005 -7.846 3.876
922 1HD1 ILE 119 1HD1 ILE 119 7.879 -4.358 5.128
923 2HD1 ILE 119 2HD1 ILE 119 7.165 -4.107 3.538
924 3HD1 ILE 119 3HD1 ILE 119 8.397 -5.347 3.762
925 H SER 120 H SER 120 6.896 -6.528 8.661
926 HA SER 120 HA SER 120 8.336 -8.851 9.391
927 1HB SER 120 2HB SER 120 9.000 -6.587 10.110
928 2HB SER 120 1HB SER 120 7.543 -6.480 11.098
929 HG SER 120 HG SER 120 9.041 -8.725 11.590
930 H HIS 121 H HIS 121 5.434 -7.349 10.825
931 HA HIS 121 HA HIS 121 4.934 -9.355 12.698
932 1HB HIS 121 2HB HIS 121 3.297 -7.208 11.440
933 2HB HIS 121 1HB HIS 121 2.465 -8.456 12.362
934 HD1 HIS 121 1HD HIS 121 5.650 -6.474 13.043
935 HD2 HIS 121 2HD HIS 121 2.034 -7.467 14.834
936 HE1 HIS 121 1HE HIS 121 5.723 -5.432 15.331
937 HE2 HIS 121 2HE HIS 121 3.503 -6.000 16.376
938 H TYR 122 H TYR 122 4.303 -9.256 9.306
939 HA TYR 122 HA TYR 122 2.392 -11.392 9.364
940 1HB TYR 122 2HB TYR 122 3.529 -9.605 7.330
941 2HB TYR 122 1HB TYR 122 3.150 -11.225 6.753
942 HD1 TYR 122 1HD TYR 122 1.876 -8.048 6.980
943 HD2 TYR 122 2HD TYR 122 0.747 -12.068 7.780
944 HE1 TYR 122 1HE TYR 122 -0.487 -7.411 6.804
945 HE2 TYR 122 2HE TYR 122 -1.624 -11.445 7.595
946 HH TYR 122 HH TYR 122 -2.651 -8.152 7.437
947 H GLN 123 H GLN 123 5.824 -11.033 8.792
948 HA GLN 123 HA GLN 123 6.206 -13.692 7.829
949 1HB GLN 123 2HB GLN 123 7.705 -11.449 7.708
950 2HB GLN 123 1HB GLN 123 8.494 -12.269 9.046
951 1HG GLN 123 2HG GLN 123 9.520 -13.680 7.680
952 2HG GLN 123 1HG GLN 123 8.012 -14.087 6.863
953 1HE2 GLN 123 1HE2 GLN 123 10.963 -13.183 6.197
954 2HE2 GLN 123 2HE2 GLN 123 10.715 -12.131 4.849
955 H GLU 124 H GLU 124 8.035 -15.000 9.071
956 HA GLU 124 HA GLU 124 8.515 -16.349 10.839
957 1HB GLU 124 2HB GLU 124 7.752 -13.830 12.307
958 2HB GLU 124 1HB GLU 124 8.318 -15.272 13.140
959 1HG GLU 124 2HG GLU 124 10.295 -15.053 11.401
960 2HG GLU 124 1HG GLU 124 9.798 -13.363 11.425
Start of MODEL 25
1 1H MET 1 1HT MET 1 15.352 -17.442 5.013
2 2H MET 1 2HT MET 1 14.844 -15.853 5.414
3 3H MET 1 3HT MET 1 15.513 -16.175 3.869
4 HA MET 1 HA MET 1 13.691 -17.538 3.295
5 1HB MET 1 2HB MET 1 11.777 -17.733 4.847
6 2HB MET 1 1HB MET 1 13.237 -18.467 5.489
7 1HG MET 1 2HG MET 1 13.262 -15.832 6.418
8 2HG MET 1 1HG MET 1 11.596 -16.381 6.585
9 1HE MET 1 1HE MET 1 15.150 -16.674 8.668
10 2HE MET 1 2HE MET 1 15.189 -17.180 6.980
11 3HE MET 1 3HE MET 1 15.311 -18.383 8.263
12 H GLN 2 H GLN 2 12.172 -16.574 2.058
13 HA GLN 2 HA GLN 2 10.978 -14.933 1.045
14 1HB GLN 2 2HB GLN 2 10.847 -14.068 3.908
15 2HB GLN 2 1HB GLN 2 10.219 -13.014 2.648
16 1HG GLN 2 2HG GLN 2 8.415 -14.289 2.303
17 2HG GLN 2 1HG GLN 2 9.321 -15.793 2.463
18 1HE2 GLN 2 1HE2 GLN 2 7.087 -13.754 3.881
19 2HE2 GLN 2 2HE2 GLN 2 7.070 -14.440 5.467
20 H ARG 3 H ARG 3 11.492 -13.235 -0.201
21 HA ARG 3 HA ARG 3 14.051 -11.976 0.258
22 1HB ARG 3 2HB ARG 3 13.670 -11.047 -2.055
23 2HB ARG 3 1HB ARG 3 13.769 -12.800 -1.949
24 1HG ARG 3 2HG ARG 3 11.043 -11.960 -1.647
25 2HG ARG 3 1HG ARG 3 11.738 -11.250 -3.106
26 1HD ARG 3 2HD ARG 3 12.493 -14.028 -2.817
27 2HD ARG 3 1HD ARG 3 10.741 -13.834 -2.806
28 HE ARG 3 HE ARG 3 12.559 -13.123 -4.992
29 1HH1 ARG 3 1HH1 ARG 3 9.288 -13.451 -3.795
30 2HH1 ARG 3 2HH1 ARG 3 8.576 -13.336 -5.368
31 1HH2 ARG 3 1HH2 ARG 3 11.615 -12.978 -7.054
32 2HH2 ARG 3 2HH2 ARG 3 9.893 -13.065 -7.216
33 H GLY 4 H GLY 4 10.710 -11.235 0.511
34 1HA GLY 4 2HA GLY 4 9.711 -9.367 1.446
35 2HA GLY 4 1HA GLY 4 11.304 -8.634 1.594
36 H ILE 5 H ILE 5 8.421 -8.811 -0.232
37 HA ILE 5 HA ILE 5 9.558 -6.986 -2.247
38 HB ILE 5 HB ILE 5 7.131 -8.729 -2.634
39 1HG1 ILE 5 2HG1 ILE 5 9.038 -9.785 -4.271
40 2HG1 ILE 5 1HG1 ILE 5 10.004 -9.339 -2.868
41 1HG2 ILE 5 1HG2 ILE 5 8.175 -6.548 -4.075
42 2HG2 ILE 5 2HG2 ILE 5 6.857 -7.628 -4.538
43 3HG2 ILE 5 3HG2 ILE 5 8.511 -7.995 -5.028
44 1HD1 ILE 5 1HD1 ILE 5 8.754 -11.690 -3.133
45 2HD1 ILE 5 2HD1 ILE 5 7.502 -10.773 -2.296
46 3HD1 ILE 5 3HD1 ILE 5 9.103 -10.939 -1.577
47 H VAL 6 H VAL 6 8.953 -4.969 -1.872
48 HA VAL 6 HA VAL 6 6.289 -4.458 -0.740
49 HB VAL 6 HB VAL 6 8.243 -3.522 0.514
50 1HG1 VAL 6 1HG1 VAL 6 9.888 -2.778 -0.809
51 2HG1 VAL 6 2HG1 VAL 6 8.973 -1.274 -0.806
52 3HG1 VAL 6 3HG1 VAL 6 8.807 -2.408 -2.132
53 1HG2 VAL 6 1HG2 VAL 6 6.967 -1.051 -0.342
54 2HG2 VAL 6 2HG2 VAL 6 6.916 -1.866 1.220
55 3HG2 VAL 6 3HG2 VAL 6 5.806 -2.349 -0.062
56 H TRP 7 H TRP 7 4.777 -3.520 -1.966
57 HA TRP 7 HA TRP 7 5.657 -2.315 -4.502
58 1HB TRP 7 2HB TRP 7 3.276 -4.009 -3.822
59 2HB TRP 7 1HB TRP 7 3.225 -2.919 -5.209
60 HD1 TRP 7 HD1 TRP 7 6.624 -4.334 -4.650
61 HE1 TRP 7 1HE TRP 7 7.142 -6.159 -6.367
62 HE3 TRP 7 3HE TRP 7 1.922 -4.975 -6.579
63 HZ2 TRP 7 2HZ TRP 7 5.751 -7.691 -8.270
64 HZ3 TRP 7 3HZ TRP 7 1.613 -6.655 -8.349
65 HH2 TRP 7 HH2 TRP 7 3.494 -7.987 -9.173
66 H VAL 8 H VAL 8 5.083 -0.266 -4.926
67 HA VAL 8 HA VAL 8 3.227 1.025 -3.034
68 HB VAL 8 HB VAL 8 5.231 2.788 -4.261
69 1HG1 VAL 8 1HG1 VAL 8 3.835 2.432 -1.679
70 2HG1 VAL 8 2HG1 VAL 8 4.048 3.878 -2.659
71 3HG1 VAL 8 3HG1 VAL 8 5.374 3.283 -1.662
72 1HG2 VAL 8 1HG2 VAL 8 6.141 0.355 -2.969
73 2HG2 VAL 8 2HG2 VAL 8 6.676 1.791 -2.103
74 3HG2 VAL 8 3HG2 VAL 8 7.063 1.597 -3.811
75 H VAL 9 H VAL 9 1.779 2.488 -3.826
76 HA VAL 9 HA VAL 9 1.818 2.905 -6.738
77 HB VAL 9 HB VAL 9 -0.647 2.877 -6.709
78 1HG1 VAL 9 1HG1 VAL 9 -0.347 0.797 -7.420
79 2HG1 VAL 9 2HG1 VAL 9 -0.450 0.246 -5.747
80 3HG1 VAL 9 3HG1 VAL 9 1.116 0.650 -6.446
81 1HG2 VAL 9 1HG2 VAL 9 -0.328 1.876 -3.889
82 2HG2 VAL 9 2HG2 VAL 9 -1.838 1.930 -4.797
83 3HG2 VAL 9 3HG2 VAL 9 -1.019 3.426 -4.363
84 H ASP 10 H ASP 10 2.263 4.951 -7.111
85 HA ASP 10 HA ASP 10 0.634 7.055 -6.031
86 1HB ASP 10 2HB ASP 10 2.682 6.447 -4.402
87 2HB ASP 10 1HB ASP 10 3.519 7.538 -5.502
88 H ASP 11 H ASP 11 2.500 9.152 -6.598
89 HA ASP 11 HA ASP 11 2.139 9.337 -9.406
90 1HB ASP 11 2HB ASP 11 3.379 11.088 -7.320
91 2HB ASP 11 1HB ASP 11 3.621 11.456 -9.026
92 H ASP 12 H ASP 12 4.237 7.417 -7.972
93 HA ASP 12 HA ASP 12 6.297 6.576 -8.376
94 1HB ASP 12 2HB ASP 12 6.752 6.135 -10.746
95 2HB ASP 12 1HB ASP 12 5.068 5.834 -10.349
96 H SER 13 H SER 13 7.767 7.686 -10.939
97 HA SER 13 HA SER 13 9.728 8.824 -11.081
98 1HB SER 13 2HB SER 13 7.693 10.227 -11.830
99 2HB SER 13 1HB SER 13 8.084 11.231 -10.437
100 HG SER 13 HG SER 13 10.099 11.628 -11.309
101 H SER 14 H SER 14 8.351 11.054 -8.757
102 HA SER 14 HA SER 14 10.810 11.144 -7.295
103 1HB SER 14 2HB SER 14 9.450 13.159 -7.645
104 2HB SER 14 1HB SER 14 8.145 12.444 -6.699
105 HG SER 14 HG SER 14 10.760 12.888 -5.699
106 H ILE 15 H ILE 15 7.536 9.961 -6.604
107 HA ILE 15 HA ILE 15 8.011 9.272 -3.926
108 HB ILE 15 HB ILE 15 6.047 7.900 -5.750
109 1HG1 ILE 15 2HG1 ILE 15 5.811 10.343 -5.929
110 2HG1 ILE 15 1HG1 ILE 15 4.437 9.627 -5.095
111 1HG2 ILE 15 1HG2 ILE 15 4.891 7.266 -3.836
112 2HG2 ILE 15 2HG2 ILE 15 5.692 8.476 -2.832
113 3HG2 ILE 15 3HG2 ILE 15 6.580 7.052 -3.374
114 1HD1 ILE 15 1HD1 ILE 15 5.584 11.803 -4.204
115 2HD1 ILE 15 2HD1 ILE 15 6.706 10.655 -3.475
116 3HD1 ILE 15 3HD1 ILE 15 4.988 10.572 -3.091
117 H ARG 16 H ARG 16 8.538 7.520 -6.892
118 HA ARG 16 HA ARG 16 8.968 4.978 -5.718
119 1HB ARG 16 2HB ARG 16 10.148 4.462 -7.877
120 2HB ARG 16 1HB ARG 16 8.487 5.004 -8.029
121 1HG ARG 16 2HG ARG 16 9.099 7.016 -8.964
122 2HG ARG 16 1HG ARG 16 10.717 6.964 -8.281
123 1HD ARG 16 2HD ARG 16 10.991 6.539 -10.578
124 2HD ARG 16 1HD ARG 16 11.151 4.979 -9.775
125 HE ARG 16 HE ARG 16 8.477 5.331 -10.534
126 1HH1 ARG 16 1HH1 ARG 16 11.613 4.814 -11.972
127 2HH1 ARG 16 2HH1 ARG 16 10.980 4.017 -13.372
128 1HH2 ARG 16 1HH2 ARG 16 7.639 4.285 -12.381
129 2HH2 ARG 16 2HH2 ARG 16 8.726 3.720 -13.606
130 H TRP 17 H TRP 17 11.271 7.405 -6.901
131 HA TRP 17 HA TRP 17 13.603 6.072 -6.260
132 1HB TRP 17 2HB TRP 17 13.346 8.217 -7.569
133 2HB TRP 17 1HB TRP 17 13.265 9.052 -6.022
134 HD1 TRP 17 HD1 TRP 17 15.717 6.877 -8.071
135 HE1 TRP 17 1HE TRP 17 18.112 7.511 -7.372
136 HE3 TRP 17 3HE TRP 17 14.613 10.122 -4.285
137 HZ2 TRP 17 2HZ TRP 17 19.365 9.175 -5.461
138 HZ3 TRP 17 3HZ TRP 17 16.464 11.195 -3.071
139 HH2 TRP 17 HH2 TRP 17 18.790 10.731 -3.647
140 H VAL 18 H VAL 18 11.661 8.182 -4.177
141 HA VAL 18 HA VAL 18 13.470 8.205 -2.024
142 HB VAL 18 HB VAL 18 10.496 8.527 -1.767
143 1HG1 VAL 18 1HG1 VAL 18 10.904 9.596 0.222
144 2HG1 VAL 18 2HG1 VAL 18 12.538 10.072 -0.242
145 3HG1 VAL 18 3HG1 VAL 18 12.203 8.403 0.217
146 1HG2 VAL 18 1HG2 VAL 18 11.839 11.037 -2.006
147 2HG2 VAL 18 2HG2 VAL 18 10.541 10.374 -2.999
148 3HG2 VAL 18 3HG2 VAL 18 12.222 10.044 -3.414
149 H LEU 19 H LEU 19 10.565 6.293 -2.560
150 HA LEU 19 HA LEU 19 10.941 4.813 -0.152
151 1HB LEU 19 2HB LEU 19 8.890 5.008 -2.227
152 2HB LEU 19 1HB LEU 19 9.061 3.404 -1.537
153 HG LEU 19 HG LEU 19 8.565 5.922 0.050
154 1HD1 LEU 19 1HD1 LEU 19 6.728 4.880 -1.507
155 2HD1 LEU 19 2HD1 LEU 19 6.337 5.415 0.127
156 3HD1 LEU 19 3HD1 LEU 19 6.603 3.703 -0.199
157 1HD2 LEU 19 1HD2 LEU 19 9.133 3.102 0.765
158 2HD2 LEU 19 2HD2 LEU 19 7.928 3.966 1.719
159 3HD2 LEU 19 3HD2 LEU 19 9.573 4.594 1.594
160 H GLU 20 H GLU 20 11.830 4.325 -3.472
161 HA GLU 20 HA GLU 20 12.140 1.523 -3.315
162 1HB GLU 20 2HB GLU 20 13.323 1.629 -5.377
163 2HB GLU 20 1HB GLU 20 12.009 2.784 -5.452
164 1HG GLU 20 2HG GLU 20 13.636 4.581 -4.962
165 2HG GLU 20 1HG GLU 20 14.924 3.377 -5.033
166 H ARG 21 H ARG 21 14.594 4.065 -3.242
167 HA ARG 21 HA ARG 21 16.749 2.409 -2.591
168 1HB ARG 21 2HB ARG 21 16.307 5.351 -2.091
169 2HB ARG 21 1HB ARG 21 17.841 4.537 -1.811
170 1HG ARG 21 2HG ARG 21 16.816 3.982 -4.456
171 2HG ARG 21 1HG ARG 21 16.980 5.715 -4.170
172 1HD ARG 21 2HD ARG 21 19.289 5.505 -3.668
173 2HD ARG 21 1HD ARG 21 19.177 3.747 -3.568
174 HE ARG 21 HE ARG 21 19.529 5.318 -5.933
175 1HH1 ARG 21 1HH1 ARG 21 18.222 2.327 -4.699
176 2HH1 ARG 21 2HH1 ARG 21 18.330 1.506 -6.221
177 1HH2 ARG 21 1HH2 ARG 21 19.667 4.242 -7.937
178 2HH2 ARG 21 2HH2 ARG 21 19.148 2.594 -8.059
179 H ALA 22 H ALA 22 14.841 4.504 -0.398
180 HA ALA 22 HA ALA 22 16.130 3.757 1.953
181 1HB ALA 22 1HB ALA 22 13.322 4.284 2.406
182 2HB ALA 22 2HB ALA 22 14.039 5.449 1.291
183 3HB ALA 22 3HB ALA 22 14.740 5.216 2.892
184 H LEU 23 H LEU 23 13.561 2.167 0.223
185 HA LEU 23 HA LEU 23 12.973 0.327 2.340
186 1HB LEU 23 2HB LEU 23 11.392 1.037 0.495
187 2HB LEU 23 1HB LEU 23 12.304 -0.012 -0.574
188 HG LEU 23 HG LEU 23 10.141 -0.913 0.440
189 1HD1 LEU 23 1HD1 LEU 23 12.604 -2.574 0.873
190 2HD1 LEU 23 2HD1 LEU 23 11.902 -2.249 -0.711
191 3HD1 LEU 23 3HD1 LEU 23 10.976 -3.134 0.504
192 1HD2 LEU 23 1HD2 LEU 23 11.916 -1.326 2.832
193 2HD2 LEU 23 2HD2 LEU 23 10.251 -1.874 2.633
194 3HD2 LEU 23 3HD2 LEU 23 10.604 -0.149 2.743
195 H ALA 24 H ALA 24 15.121 0.444 -0.369
196 HA ALA 24 HA ALA 24 15.802 -2.295 -0.481
197 1HB ALA 24 1HB ALA 24 16.826 0.209 -1.604
198 2HB ALA 24 2HB ALA 24 16.688 -1.388 -2.338
199 3HB ALA 24 3HB ALA 24 18.070 -1.006 -1.312
200 H GLY 25 H GLY 25 16.838 0.414 1.486
201 1HA GLY 25 2HA GLY 25 19.146 -0.759 2.620
202 2HA GLY 25 1HA GLY 25 18.185 0.528 3.343
203 H ALA 26 H ALA 26 15.753 -1.193 3.187
204 HA ALA 26 HA ALA 26 16.048 -2.438 5.746
205 1HB ALA 26 1HB ALA 26 13.977 -1.428 5.495
206 2HB ALA 26 2HB ALA 26 13.610 -3.128 5.212
207 3HB ALA 26 3HB ALA 26 13.776 -2.022 3.848
208 H GLY 27 H GLY 27 16.458 -3.419 2.512
209 1HA GLY 27 2HA GLY 27 17.439 -5.495 1.952
210 2HA GLY 27 1HA GLY 27 16.749 -6.186 3.410
211 H LEU 28 H LEU 28 14.743 -4.279 1.245
212 HA LEU 28 HA LEU 28 13.660 -6.764 0.169
213 1HB LEU 28 2HB LEU 28 11.646 -4.715 0.737
214 2HB LEU 28 1HB LEU 28 11.558 -6.452 0.903
215 HG LEU 28 HG LEU 28 13.197 -5.941 2.948
216 1HD1 LEU 28 1HD1 LEU 28 13.381 -3.621 2.816
217 2HD1 LEU 28 2HD1 LEU 28 12.194 -3.893 4.092
218 3HD1 LEU 28 3HD1 LEU 28 11.664 -3.414 2.483
219 1HD2 LEU 28 1HD2 LEU 28 10.541 -5.389 3.864
220 2HD2 LEU 28 2HD2 LEU 28 11.485 -6.872 4.007
221 3HD2 LEU 28 3HD2 LEU 28 10.485 -6.599 2.581
222 H THR 29 H THR 29 11.999 -6.292 -1.614
223 HA THR 29 HA THR 29 13.279 -4.410 -3.451
224 HB THR 29 HB THR 29 11.377 -6.720 -3.870
225 HG1 THR 29 1HG THR 29 14.070 -6.233 -4.597
226 1HG2 THR 29 1HG2 THR 29 12.274 -6.104 -6.362
227 2HG2 THR 29 2HG2 THR 29 11.962 -4.507 -5.683
228 3HG2 THR 29 3HG2 THR 29 10.676 -5.713 -5.731
229 H CYS 30 H CYS 30 12.263 -2.677 -4.330
230 HA CYS 30 HA CYS 30 9.473 -2.213 -3.526
231 1HB CYS 30 2HB CYS 30 11.210 -0.878 -2.246
232 2HB CYS 30 1HB CYS 30 11.536 -0.042 -3.759
233 HG CYS 30 HG CYS 30 9.514 0.857 -1.931
234 H THR 31 H THR 31 8.161 -2.031 -5.157
235 HA THR 31 HA THR 31 9.147 -0.802 -7.640
236 HB THR 31 HB THR 31 8.757 -3.383 -7.697
237 HG1 THR 31 1HG THR 31 8.995 -2.241 -9.600
238 1HG2 THR 31 1HG2 THR 31 6.405 -2.981 -6.622
239 2HG2 THR 31 2HG2 THR 31 6.657 -4.235 -7.841
240 3HG2 THR 31 3HG2 THR 31 5.949 -2.691 -8.298
241 H THR 32 H THR 32 7.888 0.817 -8.371
242 HA THR 32 HA THR 32 5.502 1.412 -6.812
243 HB THR 32 HB THR 32 5.834 3.721 -7.508
244 HG1 THR 32 1HG THR 32 6.904 4.018 -9.281
245 1HG2 THR 32 1HG2 THR 32 7.330 4.046 -5.904
246 2HG2 THR 32 2HG2 THR 32 8.589 3.197 -6.801
247 3HG2 THR 32 3HG2 THR 32 7.461 2.288 -5.796
248 H PHE 33 H PHE 33 3.754 2.596 -7.865
249 HA PHE 33 HA PHE 33 3.320 1.773 -10.641
250 1HB PHE 33 2HB PHE 33 1.403 1.360 -8.348
251 2HB PHE 33 1HB PHE 33 1.020 1.085 -10.041
252 HD1 PHE 33 1HD PHE 33 1.185 -1.081 -10.812
253 HD2 PHE 33 2HD PHE 33 3.642 0.111 -7.563
254 HE1 PHE 33 1HE PHE 33 2.055 -3.357 -10.646
255 HE2 PHE 33 2HE PHE 33 4.531 -2.160 -7.390
256 HZ PHE 33 HZ PHE 33 3.721 -3.924 -8.943
257 H GLU 34 H GLU 34 1.199 2.798 -11.476
258 HA GLU 34 HA GLU 34 1.584 5.559 -11.541
259 1HB GLU 34 2HB GLU 34 -0.258 5.643 -13.021
260 2HB GLU 34 1HB GLU 34 0.529 4.098 -13.297
261 1HG GLU 34 2HG GLU 34 -1.417 3.603 -11.350
262 2HG GLU 34 1HG GLU 34 -2.181 4.661 -12.532
263 H ASN 35 H ASN 35 -0.706 3.695 -9.551
264 HA ASN 35 HA ASN 35 -0.958 5.788 -7.706
265 1HB ASN 35 2HB ASN 35 -3.294 6.482 -8.089
266 2HB ASN 35 1HB ASN 35 -2.223 6.958 -9.401
267 1HD2 ASN 35 1HD2 ASN 35 -2.977 6.616 -11.347
268 2HD2 ASN 35 2HD2 ASN 35 -4.138 5.421 -11.799
269 H GLY 36 H GLY 36 -2.183 2.821 -9.012
270 1HA GLY 36 2HA GLY 36 -2.297 1.434 -6.682
271 2HA GLY 36 1HA GLY 36 -3.841 2.261 -6.725
272 H ASN 37 H ASN 37 -4.769 2.091 -9.171
273 HA ASN 37 HA ASN 37 -5.758 -0.461 -9.443
274 1HB ASN 37 2HB ASN 37 -6.123 1.923 -10.764
275 2HB ASN 37 1HB ASN 37 -5.457 0.886 -12.021
276 1HD2 ASN 37 1HD2 ASN 37 -7.708 0.441 -9.306
277 2HD2 ASN 37 2HD2 ASN 37 -8.951 -0.308 -10.242
278 H GLU 38 H GLU 38 -2.819 0.893 -10.723
279 HA GLU 38 HA GLU 38 -2.120 -0.995 -12.615
280 1HB GLU 38 2HB GLU 38 -0.961 1.224 -11.607
281 2HB GLU 38 1HB GLU 38 0.050 -0.006 -10.885
282 1HG GLU 38 2HG GLU 38 -0.489 0.323 -13.823
283 2HG GLU 38 1HG GLU 38 0.989 0.787 -12.980
284 H VAL 39 H VAL 39 -1.275 -1.021 -9.116
285 HA VAL 39 HA VAL 39 0.107 -3.450 -9.165
286 HB VAL 39 HB VAL 39 -1.442 -2.162 -6.915
287 1HG1 VAL 39 1HG1 VAL 39 -0.331 -4.834 -7.082
288 2HG1 VAL 39 2HG1 VAL 39 -1.342 -4.114 -5.831
289 3HG1 VAL 39 3HG1 VAL 39 0.407 -3.899 -5.786
290 1HG2 VAL 39 1HG2 VAL 39 0.592 -1.036 -7.827
291 2HG2 VAL 39 2HG2 VAL 39 1.528 -2.442 -7.326
292 3HG2 VAL 39 3HG2 VAL 39 0.696 -1.460 -6.121
293 H LEU 40 H LEU 40 -3.346 -2.818 -8.746
294 HA LEU 40 HA LEU 40 -4.217 -5.357 -8.065
295 1HB LEU 40 2HB LEU 40 -5.667 -3.550 -9.984
296 2HB LEU 40 1HB LEU 40 -6.365 -4.712 -8.871
297 HG LEU 40 HG LEU 40 -5.064 -2.078 -8.162
298 1HD1 LEU 40 1HD1 LEU 40 -7.164 -1.396 -8.578
299 2HD1 LEU 40 2HD1 LEU 40 -7.520 -2.123 -7.011
300 3HD1 LEU 40 3HD1 LEU 40 -7.820 -3.030 -8.493
301 1HD2 LEU 40 1HD2 LEU 40 -5.226 -2.585 -5.904
302 2HD2 LEU 40 2HD2 LEU 40 -4.625 -4.090 -6.598
303 3HD2 LEU 40 3HD2 LEU 40 -6.332 -3.929 -6.183
304 H ALA 41 H ALA 41 -3.469 -4.014 -11.239
305 HA ALA 41 HA ALA 41 -4.224 -6.386 -12.664
306 1HB ALA 41 1HB ALA 41 -2.488 -4.176 -13.714
307 2HB ALA 41 2HB ALA 41 -4.243 -4.037 -13.602
308 3HB ALA 41 3HB ALA 41 -3.520 -5.279 -14.625
309 H ALA 42 H ALA 42 -1.170 -4.857 -11.822
310 HA ALA 42 HA ALA 42 0.522 -6.788 -12.960
311 1HB ALA 42 1HB ALA 42 0.935 -4.383 -11.806
312 2HB ALA 42 2HB ALA 42 2.217 -5.545 -12.142
313 3HB ALA 42 3HB ALA 42 1.519 -5.449 -10.525
314 H LEU 43 H LEU 43 -1.296 -6.736 -10.031
315 HA LEU 43 HA LEU 43 0.160 -8.666 -8.583
316 1HB LEU 43 2HB LEU 43 -2.508 -7.400 -8.393
317 2HB LEU 43 1HB LEU 43 -2.288 -8.917 -7.534
318 HG LEU 43 HG LEU 43 -0.411 -6.600 -7.178
319 1HD1 LEU 43 1HD1 LEU 43 -1.660 -5.954 -5.219
320 2HD1 LEU 43 2HD1 LEU 43 -2.827 -7.244 -5.504
321 3HD1 LEU 43 3HD1 LEU 43 -2.714 -5.893 -6.633
322 1HD2 LEU 43 1HD2 LEU 43 0.682 -8.265 -6.151
323 2HD2 LEU 43 2HD2 LEU 43 -0.758 -9.277 -6.040
324 3HD2 LEU 43 3HD2 LEU 43 -0.489 -7.996 -4.859
325 H ALA 44 H ALA 44 -2.063 -8.939 -11.191
326 HA ALA 44 HA ALA 44 -3.123 -11.483 -10.721
327 1HB ALA 44 1HB ALA 44 -3.022 -9.622 -12.915
328 2HB ALA 44 2HB ALA 44 -4.242 -10.830 -12.524
329 3HB ALA 44 3HB ALA 44 -2.837 -11.277 -13.489
330 H SER 45 H SER 45 0.083 -10.585 -11.497
331 HA SER 45 HA SER 45 0.703 -13.366 -12.132
332 1HB SER 45 2HB SER 45 1.158 -12.187 -14.122
333 2HB SER 45 1HB SER 45 1.887 -10.839 -13.251
334 HG SER 45 HG SER 45 2.989 -13.435 -13.153
335 H LYS 46 H LYS 46 1.022 -11.050 -9.791
336 HA LYS 46 HA LYS 46 2.989 -12.574 -8.395
337 1HB LYS 46 2HB LYS 46 4.089 -10.710 -10.030
338 2HB LYS 46 1HB LYS 46 3.873 -9.773 -8.558
339 1HG LYS 46 2HG LYS 46 4.973 -12.182 -7.708
340 2HG LYS 46 1HG LYS 46 5.848 -11.768 -9.185
341 1HD LYS 46 2HD LYS 46 6.281 -9.524 -8.273
342 2HD LYS 46 1HD LYS 46 5.448 -9.980 -6.788
343 1HE LYS 46 2HE LYS 46 7.468 -11.923 -7.457
344 2HE LYS 46 1HE LYS 46 8.163 -10.304 -7.387
345 1HZ LYS 46 1HZ LYS 46 7.204 -10.033 -5.182
346 2HZ LYS 46 2HZ LYS 46 8.232 -11.373 -5.230
347 3HZ LYS 46 3HZ LYS 46 6.556 -11.593 -5.248
348 H THR 47 H THR 47 3.333 -11.804 -6.191
349 HA THR 47 HA THR 47 1.405 -9.840 -5.271
350 HB THR 47 HB THR 47 1.646 -12.631 -4.156
351 HG1 THR 47 1HG THR 47 0.329 -12.232 -6.089
352 1HG2 THR 47 1HG2 THR 47 -0.038 -12.088 -2.560
353 2HG2 THR 47 2HG2 THR 47 -0.201 -10.457 -3.210
354 3HG2 THR 47 3HG2 THR 47 1.281 -10.931 -2.379
355 HA PRO 48 HA PRO 48 5.179 -8.870 -3.000
356 1HB PRO 48 2HB PRO 48 4.452 -6.418 -2.164
357 2HB PRO 48 1HB PRO 48 4.934 -6.720 -3.837
358 1HG PRO 48 2HG PRO 48 2.186 -6.469 -2.676
359 2HG PRO 48 1HG PRO 48 2.830 -5.790 -4.181
360 1HD PRO 48 2HD PRO 48 1.312 -8.051 -4.083
361 2HD PRO 48 1HD PRO 48 2.523 -7.741 -5.341
362 H ASP 49 H ASP 49 5.677 -8.466 -0.721
363 HA ASP 49 HA ASP 49 3.859 -9.835 1.011
364 1HB ASP 49 2HB ASP 49 6.439 -8.373 1.609
365 2HB ASP 49 1HB ASP 49 5.552 -9.349 2.774
366 H VAL 50 H VAL 50 4.373 -6.535 0.167
367 HA VAL 50 HA VAL 50 2.264 -5.734 2.003
368 HB VAL 50 HB VAL 50 4.267 -5.333 3.311
369 1HG1 VAL 50 1HG1 VAL 50 5.420 -4.776 0.837
370 2HG1 VAL 50 2HG1 VAL 50 6.200 -4.718 2.420
371 3HG1 VAL 50 3HG1 VAL 50 5.482 -3.258 1.738
372 1HG2 VAL 50 1HG2 VAL 50 3.903 -3.082 3.904
373 2HG2 VAL 50 2HG2 VAL 50 2.359 -3.657 3.276
374 3HG2 VAL 50 3HG2 VAL 50 3.398 -2.651 2.270
375 H LEU 51 H LEU 51 1.569 -3.415 1.512
376 HA LEU 51 HA LEU 51 2.290 -2.431 -1.118
377 1HB LEU 51 2HB LEU 51 0.507 -4.211 -1.408
378 2HB LEU 51 1HB LEU 51 -0.582 -3.142 -0.546
379 HG LEU 51 HG LEU 51 -0.154 -1.415 -2.332
380 1HD1 LEU 51 1HD1 LEU 51 1.390 -3.717 -3.454
381 2HD1 LEU 51 2HD1 LEU 51 1.807 -2.002 -3.393
382 3HD1 LEU 51 3HD1 LEU 51 0.591 -2.570 -4.529
383 1HD2 LEU 51 1HD2 LEU 51 -1.941 -3.489 -2.233
384 2HD2 LEU 51 2HD2 LEU 51 -1.251 -3.656 -3.848
385 3HD2 LEU 51 3HD2 LEU 51 -2.003 -2.136 -3.363
386 H LEU 52 H LEU 52 2.200 -0.260 -1.170
387 HA LEU 52 HA LEU 52 0.744 1.106 1.001
388 1HB LEU 52 2HB LEU 52 3.435 1.280 0.226
389 2HB LEU 52 1HB LEU 52 2.692 2.757 -0.350
390 HG LEU 52 HG LEU 52 2.275 1.897 2.483
391 1HD1 LEU 52 1HD1 LEU 52 4.314 3.717 2.612
392 2HD1 LEU 52 2HD1 LEU 52 4.792 2.710 1.243
393 3HD1 LEU 52 3HD1 LEU 52 4.484 1.977 2.814
394 1HD2 LEU 52 1HD2 LEU 52 2.528 4.591 2.430
395 2HD2 LEU 52 2HD2 LEU 52 0.996 3.737 2.249
396 3HD2 LEU 52 3HD2 LEU 52 1.873 4.287 0.821
397 H SER 53 H SER 53 -0.991 2.239 0.392
398 HA SER 53 HA SER 53 -1.198 3.041 -2.424
399 1HB SER 53 2HB SER 53 -3.200 2.227 -0.370
400 2HB SER 53 1HB SER 53 -3.708 3.344 -1.637
401 HG SER 53 HG SER 53 -3.324 0.686 -1.773
402 H ASP 54 H ASP 54 -1.284 5.117 -2.999
403 HA ASP 54 HA ASP 54 -0.809 7.151 -1.055
404 1HB ASP 54 2HB ASP 54 0.130 7.151 -3.378
405 2HB ASP 54 1HB ASP 54 -1.486 7.511 -3.974
406 H ILE 55 H ILE 55 -3.627 5.873 -2.555
407 HA ILE 55 HA ILE 55 -5.819 6.522 -2.624
408 HB ILE 55 HB ILE 55 -5.612 5.774 -0.321
409 1HG1 ILE 55 2HG1 ILE 55 -7.682 7.104 -1.342
410 2HG1 ILE 55 1HG1 ILE 55 -7.696 6.475 0.296
411 1HG2 ILE 55 1HG2 ILE 55 -4.781 8.602 0.229
412 2HG2 ILE 55 2HG2 ILE 55 -3.931 7.108 0.615
413 3HG2 ILE 55 3HG2 ILE 55 -5.403 7.538 1.481
414 1HD1 ILE 55 1HD1 ILE 55 -6.943 8.737 1.058
415 2HD1 ILE 55 2HD1 ILE 55 -8.555 8.682 0.349
416 3HD1 ILE 55 3HD1 ILE 55 -7.198 9.300 -0.592
417 H ARG 56 H ARG 56 -6.125 8.114 -4.100
418 HA ARG 56 HA ARG 56 -6.301 10.844 -3.066
419 1HB ARG 56 2HB ARG 56 -5.244 11.661 -5.225
420 2HB ARG 56 1HB ARG 56 -4.157 10.923 -4.056
421 1HG ARG 56 2HG ARG 56 -3.858 9.020 -5.338
422 2HG ARG 56 1HG ARG 56 -5.350 9.279 -6.247
423 1HD ARG 56 2HD ARG 56 -3.083 11.227 -6.426
424 2HD ARG 56 1HD ARG 56 -3.086 9.755 -7.398
425 HE ARG 56 HE ARG 56 -5.548 11.119 -7.670
426 1HH1 ARG 56 1HH1 ARG 56 -2.202 11.297 -8.634
427 2HH1 ARG 56 2HH1 ARG 56 -2.537 12.159 -10.098
428 1HH2 ARG 56 1HH2 ARG 56 -5.997 12.247 -9.595
429 2HH2 ARG 56 2HH2 ARG 56 -4.697 12.699 -10.645
430 H MET 57 H MET 57 -8.444 9.154 -3.516
431 HA MET 57 HA MET 57 -10.463 9.046 -4.531
432 1HB MET 57 2HB MET 57 -10.041 11.620 -4.190
433 2HB MET 57 1HB MET 57 -9.991 11.624 -5.949
434 1HG MET 57 2HG MET 57 -12.240 10.209 -5.559
435 2HG MET 57 1HG MET 57 -12.259 11.219 -4.115
436 1HE MET 57 1HE MET 57 -14.830 11.954 -6.330
437 2HE MET 57 2HE MET 57 -13.786 10.680 -6.960
438 3HE MET 57 3HE MET 57 -14.046 12.153 -7.896
439 HA PRO 58 HA PRO 58 -8.441 8.081 -8.724
440 1HB PRO 58 2HB PRO 58 -8.211 5.384 -8.409
441 2HB PRO 58 1HB PRO 58 -6.919 6.522 -8.011
442 1HG PRO 58 2HG PRO 58 -8.888 5.183 -6.199
443 2HG PRO 58 1HG PRO 58 -7.157 5.478 -5.955
444 1HD PRO 58 2HD PRO 58 -9.087 7.013 -4.829
445 2HD PRO 58 1HD PRO 58 -7.497 7.649 -5.285
446 H GLY 59 H GLY 59 -10.154 5.244 -7.456
447 1HA GLY 59 2HA GLY 59 -12.275 5.735 -9.442
448 2HA GLY 59 1HA GLY 59 -11.804 4.151 -8.842
449 H MET 60 H MET 60 -11.641 5.278 -6.065
450 HA MET 60 HA MET 60 -14.324 6.066 -5.389
451 1HB MET 60 2HB MET 60 -14.295 3.488 -5.732
452 2HB MET 60 1HB MET 60 -13.420 3.459 -4.208
453 1HG MET 60 2HG MET 60 -15.293 3.658 -3.061
454 2HG MET 60 1HG MET 60 -15.730 5.121 -3.945
455 1HE MET 60 1HE MET 60 -18.220 3.843 -3.098
456 2HE MET 60 2HE MET 60 -19.101 3.582 -4.604
457 3HE MET 60 3HE MET 60 -18.159 5.056 -4.378
458 H ASP 61 H ASP 61 -12.537 7.677 -4.800
459 HA ASP 61 HA ASP 61 -11.594 8.896 -3.125
460 1HB ASP 61 2HB ASP 61 -13.370 7.144 -1.782
461 2HB ASP 61 1HB ASP 61 -11.882 7.229 -0.844
462 H GLY 62 H GLY 62 -10.790 5.592 -3.588
463 1HA GLY 62 2HA GLY 62 -8.289 5.353 -3.931
464 2HA GLY 62 1HA GLY 62 -8.182 5.958 -2.285
465 H LEU 63 H LEU 63 -10.629 4.619 -1.494
466 HA LEU 63 HA LEU 63 -9.496 2.162 -0.674
467 1HB LEU 63 2HB LEU 63 -12.422 2.765 -0.486
468 2HB LEU 63 1HB LEU 63 -11.425 1.816 0.600
469 HG LEU 63 HG LEU 63 -10.257 4.202 0.950
470 1HD1 LEU 63 1HD1 LEU 63 -12.086 5.093 -0.701
471 2HD1 LEU 63 2HD1 LEU 63 -11.624 6.029 0.720
472 3HD1 LEU 63 3HD1 LEU 63 -13.098 5.064 0.738
473 1HD2 LEU 63 1HD2 LEU 63 -11.430 2.562 2.553
474 2HD2 LEU 63 2HD2 LEU 63 -12.816 3.635 2.382
475 3HD2 LEU 63 3HD2 LEU 63 -11.296 4.258 3.026
476 H ALA 64 H ALA 64 -11.160 3.192 -3.457
477 HA ALA 64 HA ALA 64 -12.654 0.983 -4.221
478 1HB ALA 64 1HB ALA 64 -12.904 2.137 -6.118
479 2HB ALA 64 2HB ALA 64 -11.178 2.064 -6.470
480 3HB ALA 64 3HB ALA 64 -11.813 3.346 -5.436
481 H LEU 65 H LEU 65 -9.201 1.477 -4.229
482 HA LEU 65 HA LEU 65 -8.421 -0.661 -5.873
483 1HB LEU 65 2HB LEU 65 -7.182 1.254 -4.166
484 2HB LEU 65 1HB LEU 65 -6.551 -0.325 -3.742
485 HG LEU 65 HG LEU 65 -6.304 -0.474 -6.409
486 1HD1 LEU 65 1HD1 LEU 65 -5.565 2.377 -5.971
487 2HD1 LEU 65 2HD1 LEU 65 -7.234 1.974 -6.364
488 3HD1 LEU 65 3HD1 LEU 65 -5.938 1.524 -7.467
489 1HD2 LEU 65 1HD2 LEU 65 -4.071 -0.413 -6.013
490 2HD2 LEU 65 2HD2 LEU 65 -4.621 -0.477 -4.339
491 3HD2 LEU 65 3HD2 LEU 65 -4.165 1.067 -5.060
492 H LEU 66 H LEU 66 -9.027 -0.431 -2.422
493 HA LEU 66 HA LEU 66 -8.226 -2.974 -1.635
494 1HB LEU 66 2HB LEU 66 -10.322 -1.116 -0.526
495 2HB LEU 66 1HB LEU 66 -9.852 -2.606 0.270
496 HG LEU 66 HG LEU 66 -8.651 -0.878 1.349
497 1HD1 LEU 66 1HD1 LEU 66 -6.445 -1.612 -0.443
498 2HD1 LEU 66 2HD1 LEU 66 -7.367 -2.964 0.213
499 3HD1 LEU 66 3HD1 LEU 66 -6.605 -1.805 1.303
500 1HD2 LEU 66 1HD2 LEU 66 -8.893 0.503 -1.011
501 2HD2 LEU 66 2HD2 LEU 66 -7.159 0.216 -0.881
502 3HD2 LEU 66 3HD2 LEU 66 -8.018 1.034 0.424
503 H LYS 67 H LYS 67 -11.407 -1.843 -2.734
504 HA LYS 67 HA LYS 67 -12.835 -4.208 -2.371
505 1HB LYS 67 2HB LYS 67 -13.121 -2.080 -4.496
506 2HB LYS 67 1HB LYS 67 -14.278 -3.382 -4.262
507 1HG LYS 67 2HG LYS 67 -13.934 -2.234 -1.740
508 2HG LYS 67 1HG LYS 67 -14.035 -0.883 -2.871
509 1HD LYS 67 2HD LYS 67 -16.259 -1.311 -2.260
510 2HD LYS 67 1HD LYS 67 -16.077 -2.078 -3.840
511 1HE LYS 67 2HE LYS 67 -16.092 -4.211 -2.951
512 2HE LYS 67 1HE LYS 67 -15.572 -3.661 -1.358
513 1HZ LYS 67 1HZ LYS 67 -18.128 -2.619 -2.195
514 2HZ LYS 67 2HZ LYS 67 -17.667 -3.301 -0.717
515 3HZ LYS 67 3HZ LYS 67 -18.100 -4.302 -2.011
516 H GLN 68 H GLN 68 -10.970 -3.114 -5.189
517 HA GLN 68 HA GLN 68 -11.450 -5.328 -6.843
518 1HB GLN 68 2HB GLN 68 -8.847 -3.811 -6.838
519 2HB GLN 68 1HB GLN 68 -9.656 -4.580 -8.194
520 1HG GLN 68 2HG GLN 68 -10.894 -2.260 -6.768
521 2HG GLN 68 1HG GLN 68 -9.683 -2.025 -8.025
522 1HE2 GLN 68 1HE2 GLN 68 -12.580 -1.365 -7.870
523 2HE2 GLN 68 2HE2 GLN 68 -13.276 -2.076 -9.283
524 H ILE 69 H ILE 69 -9.253 -4.845 -4.179
525 HA ILE 69 HA ILE 69 -7.427 -6.884 -4.645
526 HB ILE 69 HB ILE 69 -8.462 -5.782 -2.043
527 1HG1 ILE 69 2HG1 ILE 69 -5.873 -5.354 -3.549
528 2HG1 ILE 69 1HG1 ILE 69 -7.201 -4.209 -3.439
529 1HG2 ILE 69 1HG2 ILE 69 -7.696 -7.782 -1.261
530 2HG2 ILE 69 2HG2 ILE 69 -6.205 -6.837 -1.216
531 3HG2 ILE 69 3HG2 ILE 69 -6.499 -7.956 -2.546
532 1HD1 ILE 69 1HD1 ILE 69 -4.999 -4.618 -1.660
533 2HD1 ILE 69 2HD1 ILE 69 -6.522 -4.843 -0.801
534 3HD1 ILE 69 3HD1 ILE 69 -6.213 -3.338 -1.668
535 H LYS 70 H LYS 70 -10.455 -6.988 -2.869
536 HA LYS 70 HA LYS 70 -10.337 -9.694 -2.157
537 1HB LYS 70 2HB LYS 70 -12.637 -9.495 -1.526
538 2HB LYS 70 1HB LYS 70 -11.822 -7.992 -1.126
539 1HG LYS 70 2HG LYS 70 -13.106 -6.785 -2.486
540 2HG LYS 70 1HG LYS 70 -13.041 -7.985 -3.776
541 1HD LYS 70 2HD LYS 70 -14.656 -9.360 -2.384
542 2HD LYS 70 1HD LYS 70 -14.867 -7.919 -1.388
543 1HE LYS 70 2HE LYS 70 -15.487 -6.682 -3.481
544 2HE LYS 70 1HE LYS 70 -15.481 -8.232 -4.321
545 1HZ LYS 70 1HZ LYS 70 -17.044 -8.517 -2.026
546 2HZ LYS 70 2HZ LYS 70 -17.550 -8.548 -3.640
547 3HZ LYS 70 3HZ LYS 70 -17.534 -7.087 -2.786
548 H GLN 71 H GLN 71 -11.503 -8.132 -5.043
549 HA GLN 71 HA GLN 71 -12.839 -10.416 -6.077
550 1HB GLN 71 2HB GLN 71 -12.024 -7.767 -7.172
551 2HB GLN 71 1HB GLN 71 -12.515 -9.033 -8.291
552 1HG GLN 71 2HG GLN 71 -14.685 -8.995 -7.608
553 2HG GLN 71 1HG GLN 71 -14.277 -8.469 -5.973
554 1HE2 GLN 71 1HE2 GLN 71 -13.142 -6.219 -6.020
555 2HE2 GLN 71 2HE2 GLN 71 -13.969 -5.015 -6.941
556 H ARG 72 H ARG 72 -9.592 -9.187 -6.326
557 HA ARG 72 HA ARG 72 -8.911 -11.379 -8.153
558 1HB ARG 72 2HB ARG 72 -7.494 -8.783 -7.600
559 2HB ARG 72 1HB ARG 72 -6.842 -10.058 -8.621
560 1HG ARG 72 2HG ARG 72 -8.439 -9.734 -10.270
561 2HG ARG 72 1HG ARG 72 -9.545 -8.907 -9.174
562 1HD ARG 72 2HD ARG 72 -8.668 -6.925 -9.670
563 2HD ARG 72 1HD ARG 72 -7.032 -7.503 -9.355
564 HE ARG 72 HE ARG 72 -7.721 -8.528 -11.812
565 1HH1 ARG 72 1HH1 ARG 72 -7.451 -5.345 -10.406
566 2HH1 ARG 72 2HH1 ARG 72 -7.023 -4.587 -11.903
567 1HH2 ARG 72 1HH2 ARG 72 -7.163 -7.529 -13.778
568 2HH2 ARG 72 2HH2 ARG 72 -6.862 -5.824 -13.815
569 H HIS 73 H HIS 73 -7.201 -9.578 -5.648
570 HA HIS 73 HA HIS 73 -5.569 -11.874 -5.026
571 1HB HIS 73 2HB HIS 73 -5.453 -9.543 -3.218
572 2HB HIS 73 1HB HIS 73 -4.151 -10.417 -4.019
573 HD1 HIS 73 1HD HIS 73 -4.438 -9.928 -6.879
574 HD2 HIS 73 2HD HIS 73 -5.487 -7.022 -4.113
575 HE1 HIS 73 1HE HIS 73 -4.416 -7.756 -8.146
576 HE2 HIS 73 2HE HIS 73 -5.156 -6.024 -6.473
577 HA PRO 74 HA PRO 74 -7.743 -13.269 -1.452
578 1HB PRO 74 2HB PRO 74 -5.733 -14.127 0.163
579 2HB PRO 74 1HB PRO 74 -6.212 -14.955 -1.319
580 1HG PRO 74 2HG PRO 74 -3.816 -13.347 -0.761
581 2HG PRO 74 1HG PRO 74 -4.085 -14.573 -2.008
582 1HD PRO 74 2HD PRO 74 -4.133 -11.734 -2.301
583 2HD PRO 74 1HD PRO 74 -4.467 -12.961 -3.536
584 H MET 75 H MET 75 -4.845 -11.905 0.110
585 HA MET 75 HA MET 75 -6.445 -9.903 1.475
586 1HB MET 75 2HB MET 75 -5.078 -12.175 2.915
587 2HB MET 75 1HB MET 75 -5.524 -10.676 3.715
588 1HG MET 75 2HG MET 75 -7.857 -11.061 3.207
589 2HG MET 75 1HG MET 75 -7.441 -12.523 2.314
590 1HE MET 75 1HE MET 75 -5.534 -13.978 3.520
591 2HE MET 75 2HE MET 75 -6.868 -15.065 3.902
592 3HE MET 75 3HE MET 75 -5.734 -14.583 5.163
593 H LEU 76 H LEU 76 -4.494 -9.474 -0.393
594 HA LEU 76 HA LEU 76 -1.878 -9.225 0.503
595 1HB LEU 76 2HB LEU 76 -2.553 -8.952 -1.836
596 2HB LEU 76 1HB LEU 76 -3.347 -7.442 -1.434
597 HG LEU 76 HG LEU 76 -1.049 -6.623 -0.667
598 1HD1 LEU 76 1HD1 LEU 76 0.600 -8.049 -2.324
599 2HD1 LEU 76 2HD1 LEU 76 -0.412 -9.305 -1.614
600 3HD1 LEU 76 3HD1 LEU 76 0.507 -8.220 -0.572
601 1HD2 LEU 76 1HD2 LEU 76 -1.994 -7.080 -3.443
602 2HD2 LEU 76 2HD2 LEU 76 -0.349 -6.480 -3.223
603 3HD2 LEU 76 3HD2 LEU 76 -1.715 -5.570 -2.573
604 HA PRO 77 HA PRO 77 -2.525 -6.141 3.718
605 1HB PRO 77 2HB PRO 77 0.173 -5.797 4.217
606 2HB PRO 77 1HB PRO 77 -0.849 -7.019 4.977
607 1HG PRO 77 2HG PRO 77 1.042 -7.283 2.691
608 2HG PRO 77 1HG PRO 77 0.694 -8.426 3.999
609 1HD PRO 77 2HD PRO 77 -0.290 -8.735 1.507
610 2HD PRO 77 1HD PRO 77 -1.191 -9.242 2.950
611 H VAL 78 H VAL 78 -2.946 -4.126 3.252
612 HA VAL 78 HA VAL 78 -1.130 -2.599 1.530
613 HB VAL 78 HB VAL 78 -4.091 -2.073 1.660
614 1HG1 VAL 78 1HG1 VAL 78 -1.806 -0.908 0.307
615 2HG1 VAL 78 2HG1 VAL 78 -3.431 -0.265 0.542
616 3HG1 VAL 78 3HG1 VAL 78 -3.095 -1.343 -0.814
617 1HG2 VAL 78 1HG2 VAL 78 -4.588 -3.741 0.269
618 2HG2 VAL 78 2HG2 VAL 78 -2.978 -4.389 0.580
619 3HG2 VAL 78 3HG2 VAL 78 -3.250 -3.330 -0.803
620 H ILE 79 H ILE 79 -0.978 -0.352 1.964
621 HA ILE 79 HA ILE 79 -1.967 0.465 4.612
622 HB ILE 79 HB ILE 79 0.735 1.238 3.526
623 1HG1 ILE 79 2HG1 ILE 79 0.921 -0.485 5.803
624 2HG1 ILE 79 1HG1 ILE 79 -0.053 -1.285 4.574
625 1HG2 ILE 79 1HG2 ILE 79 0.129 1.278 6.408
626 2HG2 ILE 79 2HG2 ILE 79 -0.727 2.461 5.419
627 3HG2 ILE 79 3HG2 ILE 79 1.035 2.423 5.420
628 1HD1 ILE 79 1HD1 ILE 79 1.685 -1.249 3.016
629 2HD1 ILE 79 2HD1 ILE 79 2.448 -1.697 4.542
630 3HD1 ILE 79 3HD1 ILE 79 2.596 -0.050 3.933
631 H ILE 80 H ILE 80 -3.323 2.094 4.347
632 HA ILE 80 HA ILE 80 -3.048 3.870 2.047
633 HB ILE 80 HB ILE 80 -5.250 3.921 4.100
634 1HG1 ILE 80 2HG1 ILE 80 -5.003 1.641 3.132
635 2HG1 ILE 80 1HG1 ILE 80 -6.523 2.412 2.699
636 1HG2 ILE 80 1HG2 ILE 80 -4.732 5.204 1.500
637 2HG2 ILE 80 2HG2 ILE 80 -5.650 5.778 2.891
638 3HG2 ILE 80 3HG2 ILE 80 -6.377 4.628 1.769
639 1HD1 ILE 80 1HD1 ILE 80 -6.090 2.103 0.562
640 2HD1 ILE 80 2HD1 ILE 80 -4.588 1.289 0.998
641 3HD1 ILE 80 3HD1 ILE 80 -4.597 3.029 0.706
642 H MET 81 H MET 81 -2.669 6.047 2.187
643 HA MET 81 HA MET 81 -1.370 6.957 4.585
644 1HB MET 81 2HB MET 81 -0.766 8.916 3.334
645 2HB MET 81 1HB MET 81 -0.503 7.498 2.332
646 1HG MET 81 2HG MET 81 -1.895 8.229 0.772
647 2HG MET 81 1HG MET 81 -3.148 8.597 1.953
648 1HE MET 81 1HE MET 81 -4.097 11.076 1.641
649 2HE MET 81 2HE MET 81 -3.709 10.362 0.077
650 3HE MET 81 3HE MET 81 -3.265 12.035 0.418
651 H THR 82 H THR 82 -4.437 7.543 2.981
652 HA THR 82 HA THR 82 -5.379 8.945 5.354
653 HB THR 82 HB THR 82 -5.698 10.149 2.605
654 HG1 THR 82 1HG THR 82 -4.240 11.605 4.358
655 1HG2 THR 82 1HG2 THR 82 -6.277 12.193 3.956
656 2HG2 THR 82 2HG2 THR 82 -6.438 11.120 5.346
657 3HG2 THR 82 3HG2 THR 82 -7.478 10.905 3.938
658 H ALA 83 H ALA 83 -7.591 8.807 5.706
659 HA ALA 83 HA ALA 83 -8.946 6.744 4.179
660 1HB ALA 83 1HB ALA 83 -10.316 8.126 6.413
661 2HB ALA 83 2HB ALA 83 -8.895 7.154 6.799
662 3HB ALA 83 3HB ALA 83 -10.277 6.414 5.989
663 H HIS 84 H HIS 84 -9.017 10.185 4.536
664 HA HIS 84 HA HIS 84 -10.346 11.828 3.698
665 1HB HIS 84 2HB HIS 84 -10.036 9.819 1.518
666 2HB HIS 84 1HB HIS 84 -11.068 11.220 1.247
667 HD1 HIS 84 1HD HIS 84 -8.971 12.995 3.106
668 HD2 HIS 84 2HD HIS 84 -8.229 10.880 -0.387
669 HE1 HIS 84 1HE HIS 84 -6.899 14.025 2.125
670 HE2 HIS 84 2HE HIS 84 -6.427 12.680 0.048
671 H SER 85 H SER 85 -11.790 10.295 5.445
672 HA SER 85 HA SER 85 -13.901 9.751 6.094
673 1HB SER 85 2HB SER 85 -14.434 11.829 3.975
674 2HB SER 85 1HB SER 85 -15.720 11.137 4.962
675 HG SER 85 HG SER 85 -14.141 11.795 6.763
676 H ASP 86 H ASP 86 -13.786 7.571 5.418
677 HA ASP 86 HA ASP 86 -15.890 6.676 3.836
678 1HB ASP 86 2HB ASP 86 -13.579 7.436 2.299
679 2HB ASP 86 1HB ASP 86 -13.832 5.703 2.164
680 H LEU 87 H LEU 87 -14.568 6.088 6.310
681 HA LEU 87 HA LEU 87 -12.915 3.912 6.368
682 1HB LEU 87 2HB LEU 87 -14.613 5.258 8.202
683 2HB LEU 87 1HB LEU 87 -14.867 3.537 8.407
684 HG LEU 87 HG LEU 87 -13.168 4.337 9.943
685 1HD1 LEU 87 1HD1 LEU 87 -11.917 2.490 9.740
686 2HD1 LEU 87 2HD1 LEU 87 -11.427 2.878 8.090
687 3HD1 LEU 87 3HD1 LEU 87 -12.991 2.119 8.390
688 1HD2 LEU 87 1HD2 LEU 87 -12.453 6.132 8.116
689 2HD2 LEU 87 2HD2 LEU 87 -11.236 4.904 7.768
690 3HD2 LEU 87 3HD2 LEU 87 -11.357 5.590 9.387
691 H ASP 88 H ASP 88 -16.199 3.967 5.318
692 HA ASP 88 HA ASP 88 -17.129 1.453 5.839
693 1HB ASP 88 2HB ASP 88 -18.373 1.629 3.666
694 2HB ASP 88 1HB ASP 88 -18.528 3.033 4.717
695 H ALA 89 H ALA 89 -15.348 2.297 2.842
696 HA ALA 89 HA ALA 89 -14.956 -0.451 2.193
697 1HB ALA 89 1HB ALA 89 -15.137 1.311 0.471
698 2HB ALA 89 2HB ALA 89 -13.675 0.339 0.308
699 3HB ALA 89 3HB ALA 89 -13.587 1.956 1.008
700 H ALA 90 H ALA 90 -13.328 1.831 4.144
701 HA ALA 90 HA ALA 90 -10.686 0.896 3.990
702 1HB ALA 90 1HB ALA 90 -10.324 2.039 6.097
703 2HB ALA 90 2HB ALA 90 -12.065 2.154 6.355
704 3HB ALA 90 3HB ALA 90 -11.311 3.032 5.024
705 H VAL 91 H VAL 91 -13.332 0.001 6.221
706 HA VAL 91 HA VAL 91 -11.770 -1.888 7.640
707 HB VAL 91 HB VAL 91 -14.762 -2.045 7.413
708 1HG1 VAL 91 1HG1 VAL 91 -12.648 -3.205 9.105
709 2HG1 VAL 91 2HG1 VAL 91 -14.250 -3.831 8.693
710 3HG1 VAL 91 3HG1 VAL 91 -14.076 -2.628 9.972
711 1HG2 VAL 91 1HG2 VAL 91 -14.909 -0.518 9.306
712 2HG2 VAL 91 2HG2 VAL 91 -14.126 0.276 7.940
713 3HG2 VAL 91 3HG2 VAL 91 -13.157 -0.307 9.292
714 H SER 92 H SER 92 -13.953 -2.146 4.871
715 HA SER 92 HA SER 92 -13.881 -4.956 4.671
716 1HB SER 92 2HB SER 92 -14.206 -2.951 2.420
717 2HB SER 92 1HB SER 92 -14.627 -4.664 2.360
718 HG SER 92 HG SER 92 -15.752 -3.101 4.386
719 H ALA 93 H ALA 93 -11.503 -2.590 4.147
720 HA ALA 93 HA ALA 93 -9.999 -3.972 2.172
721 1HB ALA 93 1HB ALA 93 -8.343 -2.325 2.487
722 2HB ALA 93 2HB ALA 93 -8.990 -1.896 4.070
723 3HB ALA 93 3HB ALA 93 -9.907 -1.515 2.609
724 H TYR 94 H TYR 94 -9.235 -3.227 5.527
725 HA TYR 94 HA TYR 94 -7.031 -4.717 5.941
726 1HB TYR 94 2HB TYR 94 -9.195 -4.861 8.012
727 2HB TYR 94 1HB TYR 94 -7.461 -4.678 8.245
728 HD1 TYR 94 1HD TYR 94 -10.343 -3.033 8.818
729 HD2 TYR 94 2HD TYR 94 -6.673 -2.418 6.747
730 HE1 TYR 94 1HE TYR 94 -10.630 -0.598 9.034
731 HE2 TYR 94 2HE TYR 94 -6.954 0.010 6.955
732 HH TYR 94 HH TYR 94 -9.282 1.430 9.003
733 H GLN 95 H GLN 95 -10.309 -5.889 6.056
734 HA GLN 95 HA GLN 95 -9.656 -8.574 6.684
735 1HB GLN 95 2HB GLN 95 -12.055 -8.954 5.921
736 2HB GLN 95 1HB GLN 95 -11.799 -7.824 7.244
737 1HG GLN 95 2HG GLN 95 -12.715 -6.156 6.142
738 2HG GLN 95 1HG GLN 95 -11.747 -6.474 4.713
739 1HE2 GLN 95 1HE2 GLN 95 -13.131 -6.444 3.070
740 2HE2 GLN 95 2HE2 GLN 95 -14.612 -7.332 2.993
741 H GLN 96 H GLN 96 -10.549 -6.960 3.638
742 HA GLN 96 HA GLN 96 -10.204 -9.297 2.060
743 1HB GLN 96 2HB GLN 96 -10.692 -6.395 1.498
744 2HB GLN 96 1HB GLN 96 -10.346 -7.521 0.184
745 1HG GLN 96 2HG GLN 96 -12.291 -8.719 0.558
746 2HG GLN 96 1HG GLN 96 -12.466 -8.074 2.191
747 1HE2 GLN 96 1HE2 GLN 96 -14.695 -7.858 1.065
748 2HE2 GLN 96 2HE2 GLN 96 -15.014 -6.313 0.364
749 H GLY 97 H GLY 97 -8.006 -7.150 3.427
750 1HA GLY 97 2HA GLY 97 -5.654 -8.038 2.967
751 2HA GLY 97 1HA GLY 97 -6.027 -7.630 1.298
752 H ALA 98 H ALA 98 -5.618 -6.290 4.531
753 HA ALA 98 HA ALA 98 -4.213 -4.039 3.545
754 1HB ALA 98 1HB ALA 98 -5.873 -2.645 3.120
755 2HB ALA 98 2HB ALA 98 -6.251 -2.657 4.842
756 3HB ALA 98 3HB ALA 98 -7.053 -3.784 3.754
757 H PHE 99 H PHE 99 -2.902 -3.237 5.097
758 HA PHE 99 HA PHE 99 -2.908 -4.494 7.651
759 1HB PHE 99 2HB PHE 99 -0.801 -3.881 6.577
760 2HB PHE 99 1HB PHE 99 -1.252 -2.180 6.625
761 HD1 PHE 99 1HD PHE 99 -1.068 -5.037 9.023
762 HD2 PHE 99 2HD PHE 99 -0.216 -0.938 8.250
763 HE1 PHE 99 1HE PHE 99 -0.046 -4.833 11.252
764 HE2 PHE 99 2HE PHE 99 0.809 -0.729 10.478
765 HZ PHE 99 HZ PHE 99 0.894 -2.677 11.983
766 H ASP 100 H ASP 100 -3.361 -1.109 6.611
767 HA ASP 100 HA ASP 100 -5.495 -0.543 8.300
768 1HB ASP 100 2HB ASP 100 -3.322 -0.927 9.896
769 2HB ASP 100 1HB ASP 100 -3.210 0.805 9.603
770 H TYR 101 H TYR 101 -5.216 2.025 9.015
771 HA TYR 101 HA TYR 101 -4.519 3.379 6.496
772 1HB TYR 101 2HB TYR 101 -6.861 3.615 8.301
773 2HB TYR 101 1HB TYR 101 -6.230 5.123 7.643
774 HD1 TYR 101 1HD TYR 101 -7.480 1.765 6.663
775 HD2 TYR 101 2HD TYR 101 -6.733 5.772 5.447
776 HE1 TYR 101 1HE TYR 101 -8.681 1.345 4.556
777 HE2 TYR 101 2HE TYR 101 -7.922 5.359 3.338
778 HH TYR 101 HH TYR 101 -8.503 3.393 1.902
779 H LEU 102 H LEU 102 -3.632 5.497 6.649
780 HA LEU 102 HA LEU 102 -2.143 5.901 9.146
781 1HB LEU 102 2HB LEU 102 -0.788 5.530 7.173
782 2HB LEU 102 1HB LEU 102 -1.614 6.823 6.331
783 HG LEU 102 HG LEU 102 -0.656 8.254 8.364
784 1HD1 LEU 102 1HD1 LEU 102 1.014 5.783 8.245
785 2HD1 LEU 102 2HD1 LEU 102 0.521 6.739 9.643
786 3HD1 LEU 102 3HD1 LEU 102 1.786 7.335 8.569
787 1HD2 LEU 102 1HD2 LEU 102 1.427 7.691 6.383
788 2HD2 LEU 102 2HD2 LEU 102 0.599 9.195 6.763
789 3HD2 LEU 102 3HD2 LEU 102 -0.161 8.022 5.697
790 HA PRO 103 HA PRO 103 -4.547 9.527 10.030
791 1HB PRO 103 2HB PRO 103 -2.762 10.804 11.661
792 2HB PRO 103 1HB PRO 103 -3.757 9.438 12.175
793 1HG PRO 103 2HG PRO 103 -0.904 9.468 11.265
794 2HG PRO 103 1HG PRO 103 -1.635 8.597 12.628
795 1HD PRO 103 2HD PRO 103 -1.082 7.371 10.306
796 2HD PRO 103 1HD PRO 103 -2.512 6.945 11.263
797 H LYS 104 H LYS 104 -3.566 12.052 10.544
798 HA LYS 104 HA LYS 104 -3.438 13.253 8.086
799 1HB LYS 104 2HB LYS 104 -2.911 14.067 10.843
800 2HB LYS 104 1HB LYS 104 -2.010 15.007 9.661
801 1HG LYS 104 2HG LYS 104 -3.841 16.058 8.911
802 2HG LYS 104 1HG LYS 104 -4.838 14.606 9.005
803 1HD LYS 104 2HD LYS 104 -4.920 14.905 11.478
804 2HD LYS 104 1HD LYS 104 -4.072 16.439 11.275
805 1HE LYS 104 2HE LYS 104 -6.331 16.297 9.500
806 2HE LYS 104 1HE LYS 104 -6.835 15.978 11.159
807 1HZ LYS 104 1HZ LYS 104 -6.385 18.073 11.792
808 2HZ LYS 104 2HZ LYS 104 -6.575 18.419 10.148
809 3HZ LYS 104 3HZ LYS 104 -5.027 18.219 10.795
810 HA PRO 105 HA PRO 105 1.489 13.652 8.538
811 1HB PRO 105 2HB PRO 105 1.796 11.104 10.064
812 2HB PRO 105 1HB PRO 105 2.775 12.575 10.123
813 1HG PRO 105 2HG PRO 105 1.026 12.022 12.057
814 2HG PRO 105 1HG PRO 105 1.265 13.684 11.487
815 1HD PRO 105 2HD PRO 105 -0.994 11.811 10.982
816 2HD PRO 105 1HD PRO 105 -0.996 13.582 11.113
817 H PHE 106 H PHE 106 3.062 12.388 7.273
818 HA PHE 106 HA PHE 106 2.310 9.854 6.201
819 1HB PHE 106 2HB PHE 106 0.789 11.226 4.883
820 2HB PHE 106 1HB PHE 106 2.119 12.261 4.376
821 HD1 PHE 106 1HD PHE 106 3.018 11.883 2.293
822 HD2 PHE 106 2HD PHE 106 1.187 8.639 4.356
823 HE1 PHE 106 1HE PHE 106 3.407 10.427 0.349
824 HE2 PHE 106 2HE PHE 106 1.579 7.180 2.419
825 HZ PHE 106 HZ PHE 106 2.690 8.072 0.411
826 H ASP 107 H ASP 107 3.972 11.977 4.012
827 HA ASP 107 HA ASP 107 6.083 11.772 3.151
828 1HB ASP 107 2HB ASP 107 7.734 12.674 4.582
829 2HB ASP 107 1HB ASP 107 6.214 13.356 5.148
830 H ILE 108 H ILE 108 8.405 10.701 3.675
831 HA ILE 108 HA ILE 108 7.941 7.913 3.531
832 HB ILE 108 HB ILE 108 10.146 9.657 3.060
833 1HG1 ILE 108 2HG1 ILE 108 10.852 7.830 1.590
834 2HG1 ILE 108 1HG1 ILE 108 9.694 6.756 2.368
835 1HG2 ILE 108 1HG2 ILE 108 11.199 8.893 5.047
836 2HG2 ILE 108 2HG2 ILE 108 11.953 8.043 3.698
837 3HG2 ILE 108 3HG2 ILE 108 10.763 7.220 4.700
838 1HD1 ILE 108 1HD1 ILE 108 7.869 7.832 1.414
839 2HD1 ILE 108 2HD1 ILE 108 9.067 7.801 0.118
840 3HD1 ILE 108 3HD1 ILE 108 8.801 9.282 1.039
841 H ASP 109 H ASP 109 9.214 9.980 6.045
842 HA ASP 109 HA ASP 109 10.085 8.097 7.859
843 1HB ASP 109 2HB ASP 109 9.933 10.774 7.926
844 2HB ASP 109 1HB ASP 109 8.589 10.393 8.997
845 H GLU 110 H GLU 110 6.806 9.565 7.884
846 HA GLU 110 HA GLU 110 5.867 7.640 9.755
847 1HB GLU 110 2HB GLU 110 4.272 9.602 8.100
848 2HB GLU 110 1HB GLU 110 3.673 8.687 9.474
849 1HG GLU 110 2HG GLU 110 6.069 10.272 10.025
850 2HG GLU 110 1HG GLU 110 4.644 11.213 9.583
851 H ALA 111 H ALA 111 5.904 7.846 6.293
852 HA ALA 111 HA ALA 111 3.871 5.883 5.865
853 1HB ALA 111 1HB ALA 111 6.030 6.913 4.025
854 2HB ALA 111 2HB ALA 111 4.359 7.471 4.107
855 3HB ALA 111 3HB ALA 111 4.717 5.840 3.537
856 H VAL 112 H VAL 112 7.392 5.777 5.293
857 HA VAL 112 HA VAL 112 7.591 3.025 4.959
858 HB VAL 112 HB VAL 112 9.673 4.823 6.196
859 1HG1 VAL 112 1HG1 VAL 112 10.644 2.669 4.535
860 2HG1 VAL 112 2HG1 VAL 112 9.643 2.055 5.854
861 3HG1 VAL 112 3HG1 VAL 112 11.044 3.068 6.207
862 1HG2 VAL 112 1HG2 VAL 112 8.629 4.630 3.479
863 2HG2 VAL 112 2HG2 VAL 112 10.379 4.430 3.567
864 3HG2 VAL 112 3HG2 VAL 112 9.621 5.879 4.223
865 H ALA 113 H ALA 113 7.350 4.960 7.812
866 HA ALA 113 HA ALA 113 8.226 3.076 9.709
867 1HB ALA 113 1HB ALA 113 7.201 4.467 11.346
868 2HB ALA 113 2HB ALA 113 6.108 5.173 10.154
869 3HB ALA 113 3HB ALA 113 7.829 5.537 10.098
870 H LEU 114 H LEU 114 4.993 3.928 8.543
871 HA LEU 114 HA LEU 114 3.675 1.876 9.983
872 1HB LEU 114 2HB LEU 114 2.549 3.939 9.339
873 2HB LEU 114 1HB LEU 114 2.749 3.533 7.643
874 HG LEU 114 HG LEU 114 1.273 1.588 7.934
875 1HD1 LEU 114 1HD1 LEU 114 1.035 2.579 10.770
876 2HD1 LEU 114 2HD1 LEU 114 1.707 1.039 10.233
877 3HD1 LEU 114 3HD1 LEU 114 -0.015 1.367 10.035
878 1HD2 LEU 114 1HD2 LEU 114 -0.212 3.896 9.111
879 2HD2 LEU 114 2HD2 LEU 114 -0.700 2.776 7.840
880 3HD2 LEU 114 3HD2 LEU 114 0.486 4.035 7.498
881 H VAL 115 H VAL 115 5.334 1.914 6.957
882 HA VAL 115 HA VAL 115 3.878 -0.312 5.881
883 HB VAL 115 HB VAL 115 5.100 1.481 4.511
884 1HG1 VAL 115 1HG1 VAL 115 7.430 -0.392 4.836
885 2HG1 VAL 115 2HG1 VAL 115 7.287 1.142 5.686
886 3HG1 VAL 115 3HG1 VAL 115 7.371 1.119 3.931
887 1HG2 VAL 115 1HG2 VAL 115 4.688 0.139 2.779
888 2HG2 VAL 115 2HG2 VAL 115 4.303 -1.107 3.962
889 3HG2 VAL 115 3HG2 VAL 115 5.924 -1.014 3.281
890 H GLU 116 H GLU 116 7.117 0.103 7.295
891 HA GLU 116 HA GLU 116 7.874 -2.603 7.049
892 1HB GLU 116 2HB GLU 116 8.817 -0.451 8.949
893 2HB GLU 116 1HB GLU 116 9.573 -2.033 8.807
894 1HG GLU 116 2HG GLU 116 9.776 -1.447 6.300
895 2HG GLU 116 1HG GLU 116 9.510 0.211 6.836
896 H ARG 117 H ARG 117 6.311 -0.804 9.671
897 HA ARG 117 HA ARG 117 6.274 -2.913 11.535
898 1HB ARG 117 2HB ARG 117 4.414 -0.548 11.255
899 2HB ARG 117 1HB ARG 117 4.463 -1.622 12.647
900 1HG ARG 117 2HG ARG 117 7.037 -0.940 12.567
901 2HG ARG 117 1HG ARG 117 6.346 0.498 11.822
902 1HD ARG 117 2HD ARG 117 4.815 0.713 13.756
903 2HD ARG 117 1HD ARG 117 5.626 -0.659 14.507
904 HE ARG 117 HE ARG 117 7.464 0.678 14.951
905 1HH1 ARG 117 1HH1 ARG 117 5.132 2.437 13.027
906 2HH1 ARG 117 2HH1 ARG 117 5.893 3.970 13.291
907 1HH2 ARG 117 1HH2 ARG 117 8.458 2.694 15.289
908 2HH2 ARG 117 2HH2 ARG 117 7.778 4.116 14.570
909 H ALA 118 H ALA 118 4.399 -2.263 8.733
910 HA ALA 118 HA ALA 118 2.106 -3.803 9.387
911 1HB ALA 118 1HB ALA 118 1.389 -3.409 7.217
912 2HB ALA 118 2HB ALA 118 3.031 -3.376 6.575
913 3HB ALA 118 3HB ALA 118 2.431 -2.020 7.530
914 H ILE 119 H ILE 119 5.015 -4.455 7.461
915 HA ILE 119 HA ILE 119 4.365 -7.136 6.847
916 HB ILE 119 HB ILE 119 7.123 -5.927 6.964
917 1HG1 ILE 119 2HG1 ILE 119 5.684 -6.054 4.385
918 2HG1 ILE 119 1HG1 ILE 119 5.102 -4.844 5.524
919 1HG2 ILE 119 1HG2 ILE 119 7.483 -7.551 5.057
920 2HG2 ILE 119 2HG2 ILE 119 5.954 -8.294 5.534
921 3HG2 ILE 119 3HG2 ILE 119 7.306 -8.252 6.667
922 1HD1 ILE 119 1HD1 ILE 119 6.722 -3.831 4.102
923 2HD1 ILE 119 2HD1 ILE 119 7.881 -5.123 4.424
924 3HD1 ILE 119 3HD1 ILE 119 7.427 -4.002 5.709
925 H SER 120 H SER 120 6.006 -5.596 9.485
926 HA SER 120 HA SER 120 7.144 -7.955 10.591
927 1HB SER 120 2HB SER 120 7.966 -6.589 12.293
928 2HB SER 120 1HB SER 120 7.822 -5.464 10.944
929 HG SER 120 HG SER 120 6.868 -4.473 12.660
930 H HIS 121 H HIS 121 4.334 -5.956 11.448
931 HA HIS 121 HA HIS 121 3.494 -7.452 13.649
932 1HB HIS 121 2HB HIS 121 2.154 -5.539 11.789
933 2HB HIS 121 1HB HIS 121 1.160 -6.471 12.905
934 HD1 HIS 121 1HD HIS 121 4.545 -4.934 13.642
935 HD2 HIS 121 2HD HIS 121 0.560 -4.559 14.753
936 HE1 HIS 121 1HE HIS 121 4.531 -3.294 15.547
937 HE2 HIS 121 2HE HIS 121 2.102 -3.034 16.164
938 H TYR 122 H TYR 122 3.105 -8.009 10.258
939 HA TYR 122 HA TYR 122 1.058 -9.995 10.600
940 1HB TYR 122 2HB TYR 122 2.488 -8.787 8.288
941 2HB TYR 122 1HB TYR 122 1.782 -10.386 8.065
942 HD1 TYR 122 1HD TYR 122 -0.709 -10.362 9.424
943 HD2 TYR 122 2HD TYR 122 1.161 -7.176 7.313
944 HE1 TYR 122 1HE TYR 122 -2.910 -9.337 9.034
945 HE2 TYR 122 2HE TYR 122 -1.035 -6.143 6.915
946 HH TYR 122 HH TYR 122 -3.466 -6.982 6.786
947 H GLN 123 H GLN 123 4.440 -10.031 9.472
948 HA GLN 123 HA GLN 123 6.030 -11.657 9.485
949 1HB GLN 123 2HB GLN 123 5.025 -11.618 11.990
950 2HB GLN 123 1HB GLN 123 4.659 -13.279 11.548
951 1HG GLN 123 2HG GLN 123 7.351 -12.608 10.800
952 2HG GLN 123 1HG GLN 123 7.072 -12.258 12.505
953 1HE2 GLN 123 1HE2 GLN 123 8.850 -14.120 12.088
954 2HE2 GLN 123 2HE2 GLN 123 8.232 -15.706 12.378
955 H GLU 124 H GLU 124 6.217 -14.249 9.568
956 HA GLU 124 HA GLU 124 4.445 -15.153 7.447
957 1HB GLU 124 2HB GLU 124 6.009 -17.067 7.282
958 2HB GLU 124 1HB GLU 124 6.814 -15.513 7.117
959 1HG GLU 124 2HG GLU 124 6.777 -16.363 9.868
960 2HG GLU 124 1HG GLU 124 7.490 -17.598 8.833
Start of MODEL 26
1 1H MET 1 1HT MET 1 13.344 -16.861 0.547
2 2H MET 1 2HT MET 1 13.315 -16.368 -1.095
3 3H MET 1 3HT MET 1 13.514 -18.028 -0.698
4 HA MET 1 HA MET 1 11.331 -17.766 -1.390
5 1HB MET 1 2HB MET 1 12.029 -18.889 0.922
6 2HB MET 1 1HB MET 1 10.986 -17.633 1.570
7 1HG MET 1 2HG MET 1 9.782 -19.719 1.251
8 2HG MET 1 1HG MET 1 9.136 -18.438 0.227
9 1HE MET 1 1HE MET 1 12.559 -20.399 -1.286
10 2HE MET 1 2HE MET 1 11.763 -21.934 -0.935
11 3HE MET 1 3HE MET 1 12.021 -20.760 0.355
12 H GLN 2 H GLN 2 11.549 -15.748 1.547
13 HA GLN 2 HA GLN 2 9.450 -14.035 0.542
14 1HB GLN 2 2HB GLN 2 10.517 -14.693 3.117
15 2HB GLN 2 1HB GLN 2 10.564 -12.949 2.905
16 1HG GLN 2 2HG GLN 2 8.196 -12.910 2.424
17 2HG GLN 2 1HG GLN 2 8.124 -14.669 2.527
18 1HE2 GLN 2 1HE2 GLN 2 8.499 -15.658 4.578
19 2HE2 GLN 2 2HE2 GLN 2 8.172 -14.792 6.036
20 H ARG 3 H ARG 3 12.578 -13.317 1.983
21 HA ARG 3 HA ARG 3 14.231 -11.870 1.461
22 1HB ARG 3 2HB ARG 3 14.816 -11.606 -0.710
23 2HB ARG 3 1HB ARG 3 13.598 -12.849 -0.937
24 1HG ARG 3 2HG ARG 3 11.954 -10.983 -1.386
25 2HG ARG 3 1HG ARG 3 13.341 -9.895 -1.419
26 1HD ARG 3 2HD ARG 3 13.810 -12.225 -3.059
27 2HD ARG 3 1HD ARG 3 12.321 -11.409 -3.529
28 HE ARG 3 HE ARG 3 14.894 -9.987 -3.320
29 1HH1 ARG 3 1HH1 ARG 3 11.961 -10.741 -5.080
30 2HH1 ARG 3 2HH1 ARG 3 12.306 -9.628 -6.358
31 1HH2 ARG 3 1HH2 ARG 3 15.332 -8.534 -5.008
32 2HH2 ARG 3 2HH2 ARG 3 14.211 -8.381 -6.319
33 H GLY 4 H GLY 4 10.977 -10.824 0.753
34 1HA GLY 4 2HA GLY 4 10.067 -8.943 1.931
35 2HA GLY 4 1HA GLY 4 11.665 -8.213 1.907
36 H ILE 5 H ILE 5 8.655 -8.471 0.336
37 HA ILE 5 HA ILE 5 9.670 -6.759 -1.835
38 HB ILE 5 HB ILE 5 7.368 -8.652 -2.193
39 1HG1 ILE 5 2HG1 ILE 5 9.195 -10.115 -1.686
40 2HG1 ILE 5 1HG1 ILE 5 9.034 -10.106 -3.439
41 1HG2 ILE 5 1HG2 ILE 5 8.650 -6.627 -3.785
42 2HG2 ILE 5 2HG2 ILE 5 7.178 -7.543 -4.110
43 3HG2 ILE 5 3HG2 ILE 5 8.744 -8.196 -4.589
44 1HD1 ILE 5 1HD1 ILE 5 11.252 -9.321 -1.767
45 2HD1 ILE 5 2HD1 ILE 5 10.828 -8.081 -2.945
46 3HD1 ILE 5 3HD1 ILE 5 11.213 -9.716 -3.484
47 H VAL 6 H VAL 6 8.904 -4.783 -1.551
48 HA VAL 6 HA VAL 6 6.194 -4.429 -0.458
49 HB VAL 6 HB VAL 6 8.105 -3.335 0.758
50 1HG1 VAL 6 1HG1 VAL 6 9.656 -2.454 -0.593
51 2HG1 VAL 6 2HG1 VAL 6 8.604 -1.043 -0.606
52 3HG1 VAL 6 3HG1 VAL 6 8.531 -2.212 -1.913
53 1HG2 VAL 6 1HG2 VAL 6 6.588 -1.008 -0.123
54 2HG2 VAL 6 2HG2 VAL 6 6.664 -1.775 1.460
55 3HG2 VAL 6 3HG2 VAL 6 5.569 -2.400 0.233
56 H TRP 7 H TRP 7 4.630 -3.417 -1.656
57 HA TRP 7 HA TRP 7 5.473 -2.308 -4.254
58 1HB TRP 7 2HB TRP 7 3.175 -4.104 -3.570
59 2HB TRP 7 1HB TRP 7 3.043 -3.003 -4.937
60 HD1 TRP 7 HD1 TRP 7 6.513 -4.313 -4.470
61 HE1 TRP 7 1HE TRP 7 7.044 -6.084 -6.241
62 HE3 TRP 7 3HE TRP 7 1.801 -5.031 -6.315
63 HZ2 TRP 7 2HZ TRP 7 5.650 -7.612 -8.154
64 HZ3 TRP 7 3HZ TRP 7 1.491 -6.677 -8.115
65 HH2 TRP 7 HH2 TRP 7 3.378 -7.941 -9.013
66 H VAL 8 H VAL 8 4.996 -0.261 -4.591
67 HA VAL 8 HA VAL 8 3.020 1.050 -2.830
68 HB VAL 8 HB VAL 8 5.032 2.699 -4.253
69 1HG1 VAL 8 1HG1 VAL 8 3.528 3.838 -2.825
70 2HG1 VAL 8 2HG1 VAL 8 5.083 3.806 -1.989
71 3HG1 VAL 8 3HG1 VAL 8 3.803 2.695 -1.512
72 1HG2 VAL 8 1HG2 VAL 8 5.781 0.547 -2.375
73 2HG2 VAL 8 2HG2 VAL 8 6.495 2.125 -2.065
74 3HG2 VAL 8 3HG2 VAL 8 6.731 1.345 -3.629
75 H VAL 9 H VAL 9 1.568 2.560 -3.718
76 HA VAL 9 HA VAL 9 1.522 2.675 -6.664
77 HB VAL 9 HB VAL 9 -1.132 3.004 -5.551
78 1HG1 VAL 9 1HG1 VAL 9 -1.602 1.172 -7.217
79 2HG1 VAL 9 2HG1 VAL 9 0.127 1.131 -7.543
80 3HG1 VAL 9 3HG1 VAL 9 -0.793 2.596 -7.877
81 1HG2 VAL 9 1HG2 VAL 9 0.214 0.355 -5.021
82 2HG2 VAL 9 2HG2 VAL 9 -1.511 0.684 -4.858
83 3HG2 VAL 9 3HG2 VAL 9 -0.356 1.492 -3.798
84 H ASP 10 H ASP 10 2.010 4.676 -7.238
85 HA ASP 10 HA ASP 10 0.460 6.904 -6.294
86 1HB ASP 10 2HB ASP 10 2.612 6.341 -4.732
87 2HB ASP 10 1HB ASP 10 3.333 7.442 -5.903
88 H ASP 11 H ASP 11 2.242 8.951 -7.064
89 HA ASP 11 HA ASP 11 1.824 8.958 -9.852
90 1HB ASP 11 2HB ASP 11 2.880 10.806 -7.844
91 2HB ASP 11 1HB ASP 11 3.638 10.983 -9.423
92 H ASP 12 H ASP 12 4.111 7.243 -8.228
93 HA ASP 12 HA ASP 12 5.955 6.106 -8.916
94 1HB ASP 12 2HB ASP 12 4.540 6.489 -11.235
95 2HB ASP 12 1HB ASP 12 6.088 7.223 -11.635
96 H SER 13 H SER 13 7.942 6.966 -10.808
97 HA SER 13 HA SER 13 9.984 7.958 -10.520
98 1HB SER 13 2HB SER 13 8.385 9.292 -12.053
99 2HB SER 13 1HB SER 13 8.460 10.511 -10.785
100 HG SER 13 HG SER 13 10.854 10.190 -11.021
101 H SER 14 H SER 14 8.340 10.723 -9.137
102 HA SER 14 HA SER 14 10.248 11.172 -7.175
103 1HB SER 14 2HB SER 14 8.770 12.952 -7.794
104 2HB SER 14 1HB SER 14 7.350 12.022 -7.312
105 HG SER 14 HG SER 14 7.898 13.518 -5.704
106 H ILE 15 H ILE 15 6.971 9.844 -6.675
107 HA ILE 15 HA ILE 15 7.444 9.121 -3.993
108 HB ILE 15 HB ILE 15 5.407 7.826 -5.791
109 1HG1 ILE 15 2HG1 ILE 15 5.276 10.292 -5.990
110 2HG1 ILE 15 1HG1 ILE 15 3.867 9.616 -5.182
111 1HG2 ILE 15 1HG2 ILE 15 5.191 8.445 -2.860
112 2HG2 ILE 15 2HG2 ILE 15 5.896 6.941 -3.456
113 3HG2 ILE 15 3HG2 ILE 15 4.218 7.334 -3.823
114 1HD1 ILE 15 1HD1 ILE 15 6.199 10.976 -3.858
115 2HD1 ILE 15 2HD1 ILE 15 4.823 10.258 -3.020
116 3HD1 ILE 15 3HD1 ILE 15 4.582 11.640 -4.086
117 H ARG 16 H ARG 16 8.183 7.567 -6.983
118 HA ARG 16 HA ARG 16 8.478 4.937 -5.866
119 1HB ARG 16 2HB ARG 16 7.930 5.233 -8.241
120 2HB ARG 16 1HB ARG 16 9.462 6.057 -8.498
121 1HG ARG 16 2HG ARG 16 10.527 3.883 -7.606
122 2HG ARG 16 1HG ARG 16 8.955 3.161 -7.943
123 1HD ARG 16 2HD ARG 16 9.307 4.367 -10.267
124 2HD ARG 16 1HD ARG 16 11.002 4.222 -9.817
125 HE ARG 16 HE ARG 16 9.132 2.007 -10.279
126 1HH1 ARG 16 1HH1 ARG 16 12.402 3.132 -9.746
127 2HH1 ARG 16 2HH1 ARG 16 13.118 1.612 -10.158
128 1HH2 ARG 16 1HH2 ARG 16 10.084 0.013 -10.813
129 2HH2 ARG 16 2HH2 ARG 16 11.806 -0.155 -10.760
130 H TRP 17 H TRP 17 10.641 7.595 -6.738
131 HA TRP 17 HA TRP 17 13.040 6.214 -6.246
132 1HB TRP 17 2HB TRP 17 12.931 8.305 -7.549
133 2HB TRP 17 1HB TRP 17 12.542 9.187 -6.074
134 HD1 TRP 17 HD1 TRP 17 15.449 7.261 -7.711
135 HE1 TRP 17 1HE TRP 17 17.646 8.018 -6.604
136 HE3 TRP 17 3HE TRP 17 13.515 10.233 -4.029
137 HZ2 TRP 17 2HZ TRP 17 18.451 9.663 -4.451
138 HZ3 TRP 17 3HZ TRP 17 15.063 11.361 -2.487
139 HH2 TRP 17 HH2 TRP 17 17.479 11.081 -2.693
140 H VAL 18 H VAL 18 10.990 8.197 -4.171
141 HA VAL 18 HA VAL 18 12.767 8.226 -1.980
142 HB VAL 18 HB VAL 18 9.793 8.492 -1.700
143 1HG1 VAL 18 1HG1 VAL 18 11.095 8.488 0.343
144 2HG1 VAL 18 2HG1 VAL 18 10.426 10.092 0.054
145 3HG1 VAL 18 3HG1 VAL 18 12.127 9.770 -0.283
146 1HG2 VAL 18 1HG2 VAL 18 10.928 11.049 -2.057
147 2HG2 VAL 18 2HG2 VAL 18 9.750 10.228 -3.080
148 3HG2 VAL 18 3HG2 VAL 18 11.475 10.054 -3.407
149 H LEU 19 H LEU 19 10.135 6.101 -2.872
150 HA LEU 19 HA LEU 19 10.316 4.624 -0.420
151 1HB LEU 19 2HB LEU 19 8.371 4.979 -2.405
152 2HB LEU 19 1HB LEU 19 8.781 3.277 -2.432
153 HG LEU 19 HG LEU 19 6.902 3.602 -0.961
154 1HD1 LEU 19 1HD1 LEU 19 7.672 2.097 0.480
155 2HD1 LEU 19 2HD1 LEU 19 8.785 3.259 1.206
156 3HD1 LEU 19 3HD1 LEU 19 9.269 2.351 -0.226
157 1HD2 LEU 19 1HD2 LEU 19 8.032 6.045 -0.418
158 2HD2 LEU 19 2HD2 LEU 19 8.250 5.159 1.092
159 3HD2 LEU 19 3HD2 LEU 19 6.637 5.344 0.400
160 H GLU 20 H GLU 20 11.524 4.282 -3.660
161 HA GLU 20 HA GLU 20 12.109 1.526 -3.502
162 1HB GLU 20 2HB GLU 20 13.433 1.800 -5.481
163 2HB GLU 20 1HB GLU 20 11.958 2.730 -5.639
164 1HG GLU 20 2HG GLU 20 13.257 4.751 -5.011
165 2HG GLU 20 1HG GLU 20 14.715 3.762 -5.066
166 H ARG 21 H ARG 21 14.323 4.287 -3.296
167 HA ARG 21 HA ARG 21 16.541 2.753 -2.509
168 1HB ARG 21 2HB ARG 21 15.973 5.695 -2.150
169 2HB ARG 21 1HB ARG 21 17.532 4.943 -1.836
170 1HG ARG 21 2HG ARG 21 16.535 4.268 -4.465
171 2HG ARG 21 1HG ARG 21 16.655 6.013 -4.236
172 1HD ARG 21 2HD ARG 21 18.983 5.752 -3.520
173 2HD ARG 21 1HD ARG 21 18.858 4.009 -3.752
174 HE ARG 21 HE ARG 21 18.204 5.510 -6.105
175 1HH1 ARG 21 1HH1 ARG 21 20.822 4.143 -4.244
176 2HH1 ARG 21 2HH1 ARG 21 21.893 4.038 -5.600
177 1HH2 ARG 21 1HH2 ARG 21 19.611 5.368 -7.888
178 2HH2 ARG 21 2HH2 ARG 21 21.208 4.734 -7.668
179 H ALA 22 H ALA 22 14.372 4.801 -0.539
180 HA ALA 22 HA ALA 22 15.582 4.327 1.913
181 1HB ALA 22 1HB ALA 22 13.847 5.452 2.841
182 2HB ALA 22 2HB ALA 22 12.637 4.556 1.919
183 3HB ALA 22 3HB ALA 22 13.538 5.867 1.154
184 H LEU 23 H LEU 23 13.037 2.514 0.320
185 HA LEU 23 HA LEU 23 12.755 0.633 2.443
186 1HB LEU 23 2HB LEU 23 11.039 1.212 0.646
187 2HB LEU 23 1HB LEU 23 11.967 0.181 -0.424
188 HG LEU 23 HG LEU 23 9.889 -0.770 0.784
189 1HD1 LEU 23 1HD1 LEU 23 12.450 -2.337 0.930
190 2HD1 LEU 23 2HD1 LEU 23 11.580 -2.013 -0.569
191 3HD1 LEU 23 3HD1 LEU 23 10.811 -2.957 0.713
192 1HD2 LEU 23 1HD2 LEU 23 11.931 -1.153 2.964
193 2HD2 LEU 23 2HD2 LEU 23 10.264 -1.728 2.945
194 3HD2 LEU 23 3HD2 LEU 23 10.597 0.001 3.036
195 H ALA 24 H ALA 24 14.794 0.938 -0.324
196 HA ALA 24 HA ALA 24 15.670 -1.746 -0.490
197 1HB ALA 24 1HB ALA 24 16.332 0.777 -1.733
198 2HB ALA 24 2HB ALA 24 16.526 -0.861 -2.353
199 3HB ALA 24 3HB ALA 24 17.786 -0.143 -1.352
200 H GLY 25 H GLY 25 16.577 1.049 1.425
201 1HA GLY 25 2HA GLY 25 19.021 0.093 2.451
202 2HA GLY 25 1HA GLY 25 17.967 1.261 3.242
203 H ALA 26 H ALA 26 15.710 -0.640 3.220
204 HA ALA 26 HA ALA 26 16.277 -1.914 5.713
205 1HB ALA 26 1HB ALA 26 13.871 -2.824 5.280
206 2HB ALA 26 2HB ALA 26 13.859 -1.621 3.988
207 3HB ALA 26 3HB ALA 26 14.117 -1.119 5.659
208 H GLY 27 H GLY 27 16.584 -2.802 2.444
209 1HA GLY 27 2HA GLY 27 17.710 -4.768 1.780
210 2HA GLY 27 1HA GLY 27 17.182 -5.543 3.264
211 H LEU 28 H LEU 28 14.872 -3.814 1.267
212 HA LEU 28 HA LEU 28 13.949 -6.378 0.222
213 1HB LEU 28 2HB LEU 28 11.819 -4.481 0.908
214 2HB LEU 28 1HB LEU 28 11.863 -6.220 1.056
215 HG LEU 28 HG LEU 28 13.552 -5.625 3.030
216 1HD1 LEU 28 1HD1 LEU 28 11.847 -3.196 2.650
217 2HD1 LEU 28 2HD1 LEU 28 13.587 -3.297 2.926
218 3HD1 LEU 28 3HD1 LEU 28 12.461 -3.653 4.238
219 1HD2 LEU 28 1HD2 LEU 28 10.996 -6.601 2.810
220 2HD2 LEU 28 2HD2 LEU 28 10.791 -5.226 3.895
221 3HD2 LEU 28 3HD2 LEU 28 11.933 -6.507 4.303
222 H THR 29 H THR 29 12.124 -5.997 -1.462
223 HA THR 29 HA THR 29 13.186 -4.035 -3.358
224 HB THR 29 HB THR 29 11.441 -6.465 -3.679
225 HG1 THR 29 1HG THR 29 13.233 -6.931 -5.172
226 1HG2 THR 29 1HG2 THR 29 11.630 -4.174 -5.471
227 2HG2 THR 29 2HG2 THR 29 10.472 -5.503 -5.436
228 3HG2 THR 29 3HG2 THR 29 12.033 -5.713 -6.229
229 H CYS 30 H CYS 30 12.046 -2.386 -4.201
230 HA CYS 30 HA CYS 30 9.257 -2.060 -3.325
231 1HB CYS 30 2HB CYS 30 10.985 -0.643 -2.084
232 2HB CYS 30 1HB CYS 30 11.175 0.224 -3.599
233 HG CYS 30 HG CYS 30 9.244 1.048 -1.702
234 H THR 31 H THR 31 7.942 -1.996 -4.990
235 HA THR 31 HA THR 31 8.852 -0.646 -7.443
236 HB THR 31 HB THR 31 8.526 -3.230 -7.560
237 HG1 THR 31 1HG THR 31 8.677 -1.921 -9.411
238 1HG2 THR 31 1HG2 THR 31 6.478 -4.149 -7.563
239 2HG2 THR 31 2HG2 THR 31 5.702 -2.683 -8.156
240 3HG2 THR 31 3HG2 THR 31 6.141 -2.819 -6.453
241 H THR 32 H THR 32 7.371 0.749 -8.395
242 HA THR 32 HA THR 32 4.950 1.228 -6.817
243 HB THR 32 HB THR 32 5.165 3.603 -7.363
244 HG1 THR 32 1HG THR 32 6.306 3.351 -9.332
245 1HG2 THR 32 1HG2 THR 32 6.704 2.226 -5.551
246 2HG2 THR 32 2HG2 THR 32 6.506 3.980 -5.631
247 3HG2 THR 32 3HG2 THR 32 7.879 3.210 -6.420
248 H PHE 33 H PHE 33 3.155 2.234 -7.925
249 HA PHE 33 HA PHE 33 3.073 1.683 -10.805
250 1HB PHE 33 2HB PHE 33 0.830 0.953 -8.942
251 2HB PHE 33 1HB PHE 33 0.984 0.584 -10.642
252 HD1 PHE 33 1HD PHE 33 1.270 -1.590 -11.069
253 HD2 PHE 33 2HD PHE 33 3.120 0.030 -7.616
254 HE1 PHE 33 1HE PHE 33 2.229 -3.778 -10.553
255 HE2 PHE 33 2HE PHE 33 4.088 -2.160 -7.096
256 HZ PHE 33 HZ PHE 33 3.622 -4.092 -8.577
257 H GLU 34 H GLU 34 0.951 2.537 -11.762
258 HA GLU 34 HA GLU 34 0.849 5.315 -11.378
259 1HB GLU 34 2HB GLU 34 -0.441 5.366 -13.252
260 2HB GLU 34 1HB GLU 34 0.203 3.746 -13.423
261 1HG GLU 34 2HG GLU 34 -2.193 3.539 -11.912
262 2HG GLU 34 1HG GLU 34 -2.510 4.600 -13.276
263 H ASN 35 H ASN 35 -1.399 2.758 -10.362
264 HA ASN 35 HA ASN 35 -2.284 4.231 -8.128
265 1HB ASN 35 2HB ASN 35 -4.628 4.631 -8.834
266 2HB ASN 35 1HB ASN 35 -3.473 5.591 -9.754
267 1HD2 ASN 35 1HD2 ASN 35 -4.543 5.855 -11.616
268 2HD2 ASN 35 2HD2 ASN 35 -5.062 4.568 -12.645
269 H GLY 36 H GLY 36 -4.492 3.225 -7.349
270 1HA GLY 36 2HA GLY 36 -4.081 0.691 -6.506
271 2HA GLY 36 1HA GLY 36 -5.680 1.365 -6.740
272 H ASN 37 H ASN 37 -5.400 1.567 -9.652
273 HA ASN 37 HA ASN 37 -6.304 -1.050 -10.254
274 1HB ASN 37 2HB ASN 37 -6.570 1.466 -11.427
275 2HB ASN 37 1HB ASN 37 -5.723 0.490 -12.623
276 1HD2 ASN 37 1HD2 ASN 37 -8.156 -0.421 -10.222
277 2HD2 ASN 37 2HD2 ASN 37 -9.310 -1.023 -11.359
278 H GLU 38 H GLU 38 -3.392 0.768 -11.154
279 HA GLU 38 HA GLU 38 -2.234 -1.042 -12.877
280 1HB GLU 38 2HB GLU 38 -1.471 1.311 -11.798
281 2HB GLU 38 1HB GLU 38 -0.411 0.212 -10.943
282 1HG GLU 38 2HG GLU 38 -0.614 0.592 -13.915
283 2HG GLU 38 1HG GLU 38 0.740 1.011 -12.871
284 H VAL 39 H VAL 39 -1.689 -0.911 -9.303
285 HA VAL 39 HA VAL 39 0.012 -3.068 -9.094
286 HB VAL 39 HB VAL 39 -2.199 -2.714 -7.091
287 1HG1 VAL 39 1HG1 VAL 39 0.555 -3.060 -6.188
288 2HG1 VAL 39 2HG1 VAL 39 -0.030 -4.396 -7.184
289 3HG1 VAL 39 3HG1 VAL 39 -0.909 -3.928 -5.724
290 1HG2 VAL 39 1HG2 VAL 39 -0.273 -0.731 -7.938
291 2HG2 VAL 39 2HG2 VAL 39 -0.076 -1.148 -6.235
292 3HG2 VAL 39 3HG2 VAL 39 -1.636 -0.582 -6.830
293 H LEU 40 H LEU 40 -3.480 -3.128 -9.495
294 HA LEU 40 HA LEU 40 -3.870 -5.869 -8.959
295 1HB LEU 40 2HB LEU 40 -5.505 -4.469 -11.034
296 2HB LEU 40 1HB LEU 40 -6.005 -5.658 -9.849
297 HG LEU 40 HG LEU 40 -5.250 -2.824 -9.162
298 1HD1 LEU 40 1HD1 LEU 40 -7.797 -2.756 -8.760
299 2HD1 LEU 40 2HD1 LEU 40 -7.840 -4.080 -9.923
300 3HD1 LEU 40 3HD1 LEU 40 -7.171 -2.518 -10.389
301 1HD2 LEU 40 1HD2 LEU 40 -5.128 -3.780 -7.122
302 2HD2 LEU 40 2HD2 LEU 40 -6.048 -5.199 -7.623
303 3HD2 LEU 40 3HD2 LEU 40 -6.891 -3.707 -7.206
304 H ALA 41 H ALA 41 -3.354 -4.152 -12.032
305 HA ALA 41 HA ALA 41 -3.480 -6.311 -13.749
306 1HB ALA 41 1HB ALA 41 -3.278 -3.830 -14.306
307 2HB ALA 41 2HB ALA 41 -2.456 -4.971 -15.369
308 3HB ALA 41 3HB ALA 41 -1.537 -4.070 -14.162
309 H ALA 42 H ALA 42 -0.632 -4.987 -12.155
310 HA ALA 42 HA ALA 42 1.137 -6.969 -13.153
311 1HB ALA 42 1HB ALA 42 1.974 -5.676 -10.664
312 2HB ALA 42 2HB ALA 42 1.458 -4.551 -11.925
313 3HB ALA 42 3HB ALA 42 2.746 -5.708 -12.254
314 H LEU 43 H LEU 43 -0.819 -6.658 -10.263
315 HA LEU 43 HA LEU 43 0.374 -8.661 -8.729
316 1HB LEU 43 2HB LEU 43 -2.360 -7.465 -8.803
317 2HB LEU 43 1HB LEU 43 -2.048 -8.862 -7.791
318 HG LEU 43 HG LEU 43 -0.358 -6.396 -7.582
319 1HD1 LEU 43 1HD1 LEU 43 -3.074 -6.371 -7.164
320 2HD1 LEU 43 2HD1 LEU 43 -1.911 -5.265 -6.450
321 3HD1 LEU 43 3HD1 LEU 43 -2.426 -6.691 -5.557
322 1HD2 LEU 43 1HD2 LEU 43 -0.315 -7.377 -5.177
323 2HD2 LEU 43 2HD2 LEU 43 0.672 -8.112 -6.442
324 3HD2 LEU 43 3HD2 LEU 43 -0.855 -8.859 -5.970
325 H ALA 44 H ALA 44 -1.775 -8.824 -11.424
326 HA ALA 44 HA ALA 44 -2.931 -11.317 -11.108
327 1HB ALA 44 1HB ALA 44 -2.197 -9.679 -13.487
328 2HB ALA 44 2HB ALA 44 -3.789 -10.144 -12.886
329 3HB ALA 44 3HB ALA 44 -2.779 -11.327 -13.717
330 H SER 45 H SER 45 0.371 -10.571 -11.627
331 HA SER 45 HA SER 45 0.916 -13.376 -12.226
332 1HB SER 45 2HB SER 45 1.496 -11.862 -14.098
333 2HB SER 45 1HB SER 45 2.599 -11.001 -13.026
334 HG SER 45 HG SER 45 3.629 -13.132 -12.732
335 H LYS 46 H LYS 46 1.121 -11.100 -9.828
336 HA LYS 46 HA LYS 46 2.839 -12.715 -8.247
337 1HB LYS 46 2HB LYS 46 4.316 -11.199 -9.839
338 2HB LYS 46 1HB LYS 46 3.970 -9.985 -8.616
339 1HG LYS 46 2HG LYS 46 4.746 -12.293 -7.223
340 2HG LYS 46 1HG LYS 46 5.878 -12.113 -8.564
341 1HD LYS 46 2HD LYS 46 6.800 -10.252 -7.698
342 2HD LYS 46 1HD LYS 46 5.245 -9.618 -7.152
343 1HE LYS 46 2HE LYS 46 5.427 -11.556 -5.397
344 2HE LYS 46 1HE LYS 46 7.148 -11.450 -5.763
345 1HZ LYS 46 1HZ LYS 46 5.471 -9.647 -4.275
346 2HZ LYS 46 2HZ LYS 46 6.463 -8.869 -5.401
347 3HZ LYS 46 3HZ LYS 46 7.148 -9.861 -4.215
348 H THR 47 H THR 47 3.227 -11.725 -6.068
349 HA THR 47 HA THR 47 1.328 -9.639 -5.389
350 HB THR 47 HB THR 47 1.442 -12.343 -4.058
351 HG1 THR 47 1HG THR 47 0.099 -11.811 -6.046
352 1HG2 THR 47 1HG2 THR 47 1.182 -10.583 -2.364
353 2HG2 THR 47 2HG2 THR 47 -0.258 -11.589 -2.530
354 3HG2 THR 47 3HG2 THR 47 -0.222 -9.974 -3.241
355 HA PRO 48 HA PRO 48 4.897 -8.417 -2.994
356 1HB PRO 48 2HB PRO 48 3.922 -6.124 -2.005
357 2HB PRO 48 1HB PRO 48 4.365 -6.290 -3.706
358 1HG PRO 48 2HG PRO 48 1.661 -6.389 -2.438
359 2HG PRO 48 1HG PRO 48 2.159 -5.606 -3.948
360 1HD PRO 48 2HD PRO 48 0.910 -8.048 -3.820
361 2HD PRO 48 1HD PRO 48 1.964 -7.535 -5.152
362 H ASP 49 H ASP 49 5.469 -8.119 -0.766
363 HA ASP 49 HA ASP 49 3.857 -9.691 1.003
364 1HB ASP 49 2HB ASP 49 6.453 -8.193 1.352
365 2HB ASP 49 1HB ASP 49 5.664 -9.030 2.687
366 H VAL 50 H VAL 50 4.433 -6.278 0.480
367 HA VAL 50 HA VAL 50 2.233 -5.667 2.287
368 HB VAL 50 HB VAL 50 4.261 -5.578 3.677
369 1HG1 VAL 50 1HG1 VAL 50 5.498 -4.667 1.454
370 2HG1 VAL 50 2HG1 VAL 50 6.152 -4.523 3.084
371 3HG1 VAL 50 3HG1 VAL 50 5.296 -3.163 2.358
372 1HG2 VAL 50 1HG2 VAL 50 2.878 -2.966 3.098
373 2HG2 VAL 50 2HG2 VAL 50 3.963 -3.213 4.468
374 3HG2 VAL 50 3HG2 VAL 50 2.482 -4.155 4.339
375 H LEU 51 H LEU 51 0.909 -4.535 0.989
376 HA LEU 51 HA LEU 51 1.975 -2.873 -1.133
377 1HB LEU 51 2HB LEU 51 -0.042 -4.424 -1.326
378 2HB LEU 51 1HB LEU 51 -0.921 -3.217 -0.410
379 HG LEU 51 HG LEU 51 -0.549 -1.567 -2.161
380 1HD1 LEU 51 1HD1 LEU 51 0.921 -1.781 -3.833
381 2HD1 LEU 51 2HD1 LEU 51 0.468 -3.460 -4.141
382 3HD1 LEU 51 3HD1 LEU 51 1.617 -3.078 -2.864
383 1HD2 LEU 51 1HD2 LEU 51 -1.529 -3.476 -4.003
384 2HD2 LEU 51 2HD2 LEU 51 -2.444 -2.334 -3.024
385 3HD2 LEU 51 3HD2 LEU 51 -2.097 -3.948 -2.403
386 H LEU 52 H LEU 52 1.534 -0.659 -1.423
387 HA LEU 52 HA LEU 52 0.501 0.816 0.896
388 1HB LEU 52 2HB LEU 52 3.115 0.585 0.729
389 2HB LEU 52 1HB LEU 52 2.945 1.818 -0.497
390 HG LEU 52 HG LEU 52 2.192 2.059 2.413
391 1HD1 LEU 52 1HD1 LEU 52 3.893 4.012 2.077
392 2HD1 LEU 52 2HD1 LEU 52 4.450 3.015 0.732
393 3HD1 LEU 52 3HD1 LEU 52 4.455 2.366 2.373
394 1HD2 LEU 52 1HD2 LEU 52 2.033 4.258 0.370
395 2HD2 LEU 52 2HD2 LEU 52 1.410 4.241 2.020
396 3HD2 LEU 52 3HD2 LEU 52 0.645 3.256 0.783
397 H SER 53 H SER 53 -1.085 2.103 0.186
398 HA SER 53 HA SER 53 -0.883 3.171 -2.555
399 1HB SER 53 2HB SER 53 -3.196 2.201 -0.945
400 2HB SER 53 1HB SER 53 -3.476 3.486 -2.116
401 HG SER 53 HG SER 53 -3.021 0.833 -2.513
402 H ASP 54 H ASP 54 -0.977 5.299 -2.903
403 HA ASP 54 HA ASP 54 -0.637 7.067 -0.681
404 1HB ASP 54 2HB ASP 54 0.588 7.253 -2.848
405 2HB ASP 54 1HB ASP 54 -0.914 7.781 -3.600
406 H ILE 55 H ILE 55 -3.419 5.943 -2.192
407 HA ILE 55 HA ILE 55 -5.559 6.748 -2.464
408 HB ILE 55 HB ILE 55 -5.458 6.021 -0.143
409 1HG1 ILE 55 2HG1 ILE 55 -7.489 7.213 -1.260
410 2HG1 ILE 55 1HG1 ILE 55 -7.536 6.823 0.449
411 1HG2 ILE 55 1HG2 ILE 55 -4.228 8.624 0.269
412 2HG2 ILE 55 2HG2 ILE 55 -4.127 7.155 1.230
413 3HG2 ILE 55 3HG2 ILE 55 -5.497 8.245 1.430
414 1HD1 ILE 55 1HD1 ILE 55 -6.790 9.195 0.870
415 2HD1 ILE 55 2HD1 ILE 55 -8.412 8.995 0.208
416 3HD1 ILE 55 3HD1 ILE 55 -7.088 9.496 -0.842
417 H ARG 56 H ARG 56 -5.772 8.343 -3.945
418 HA ARG 56 HA ARG 56 -5.933 11.063 -2.916
419 1HB ARG 56 2HB ARG 56 -4.634 11.971 -4.813
420 2HB ARG 56 1HB ARG 56 -3.663 10.957 -3.752
421 1HG ARG 56 2HG ARG 56 -4.306 9.082 -5.460
422 2HG ARG 56 1HG ARG 56 -4.593 10.452 -6.533
423 1HD ARG 56 2HD ARG 56 -2.400 10.923 -6.726
424 2HD ARG 56 1HD ARG 56 -2.069 10.556 -5.032
425 HE ARG 56 HE ARG 56 -1.326 8.525 -5.725
426 1HH1 ARG 56 1HH1 ARG 56 -3.656 9.664 -8.063
427 2HH1 ARG 56 2HH1 ARG 56 -3.511 8.266 -9.073
428 1HH2 ARG 56 1HH2 ARG 56 -1.149 6.678 -7.057
429 2HH2 ARG 56 2HH2 ARG 56 -2.089 6.579 -8.506
430 H MET 57 H MET 57 -8.046 9.415 -3.558
431 HA MET 57 HA MET 57 -10.016 9.442 -4.662
432 1HB MET 57 2HB MET 57 -9.696 11.917 -4.389
433 2HB MET 57 1HB MET 57 -9.054 11.947 -6.027
434 1HG MET 57 2HG MET 57 -11.119 11.313 -6.958
435 2HG MET 57 1HG MET 57 -11.770 10.847 -5.387
436 1HE MET 57 1HE MET 57 -11.024 13.347 -7.937
437 2HE MET 57 2HE MET 57 -10.128 14.411 -6.853
438 3HE MET 57 3HE MET 57 -11.741 14.868 -7.405
439 HA PRO 58 HA PRO 58 -7.868 7.979 -8.623
440 1HB PRO 58 2HB PRO 58 -7.721 5.330 -8.059
441 2HB PRO 58 1HB PRO 58 -6.433 6.469 -7.644
442 1HG PRO 58 2HG PRO 58 -8.574 5.316 -5.903
443 2HG PRO 58 1HG PRO 58 -6.864 5.602 -5.539
444 1HD PRO 58 2HD PRO 58 -8.880 7.252 -4.739
445 2HD PRO 58 1HD PRO 58 -7.222 7.802 -5.020
446 H GLY 59 H GLY 59 -9.654 5.224 -7.309
447 1HA GLY 59 2HA GLY 59 -11.656 5.599 -9.422
448 2HA GLY 59 1HA GLY 59 -11.305 4.088 -8.593
449 H MET 60 H MET 60 -11.305 5.407 -5.964
450 HA MET 60 HA MET 60 -13.951 6.468 -5.570
451 1HB MET 60 2HB MET 60 -14.428 4.041 -5.660
452 2HB MET 60 1HB MET 60 -13.263 3.779 -4.370
453 1HG MET 60 2HG MET 60 -14.976 3.945 -2.978
454 2HG MET 60 1HG MET 60 -14.909 5.678 -3.295
455 1HE MET 60 1HE MET 60 -18.480 6.185 -3.984
456 2HE MET 60 2HE MET 60 -16.934 7.006 -4.211
457 3HE MET 60 3HE MET 60 -17.273 6.169 -2.696
458 H ASP 61 H ASP 61 -12.224 8.032 -4.969
459 HA ASP 61 HA ASP 61 -11.291 9.337 -3.369
460 1HB ASP 61 2HB ASP 61 -13.150 7.693 -1.937
461 2HB ASP 61 1HB ASP 61 -11.726 7.993 -0.945
462 H GLY 62 H GLY 62 -10.618 5.959 -3.472
463 1HA GLY 62 2HA GLY 62 -8.077 5.709 -3.699
464 2HA GLY 62 1HA GLY 62 -8.079 6.355 -2.075
465 H LEU 63 H LEU 63 -10.613 4.947 -1.485
466 HA LEU 63 HA LEU 63 -9.401 2.536 -0.582
467 1HB LEU 63 2HB LEU 63 -12.337 3.099 -0.443
468 2HB LEU 63 1HB LEU 63 -11.354 2.138 0.645
469 HG LEU 63 HG LEU 63 -10.193 4.517 1.040
470 1HD1 LEU 63 1HD1 LEU 63 -12.805 5.102 -0.189
471 2HD1 LEU 63 2HD1 LEU 63 -11.342 6.082 -0.100
472 3HD1 LEU 63 3HD1 LEU 63 -12.428 5.990 1.286
473 1HD2 LEU 63 1HD2 LEU 63 -11.683 4.743 3.008
474 2HD2 LEU 63 2HD2 LEU 63 -11.025 3.120 2.782
475 3HD2 LEU 63 3HD2 LEU 63 -12.693 3.464 2.334
476 H ALA 64 H ALA 64 -11.082 3.510 -3.377
477 HA ALA 64 HA ALA 64 -12.454 1.224 -4.167
478 1HB ALA 64 1HB ALA 64 -11.058 2.333 -6.417
479 2HB ALA 64 2HB ALA 64 -11.620 3.628 -5.362
480 3HB ALA 64 3HB ALA 64 -12.768 2.451 -5.999
481 H LEU 65 H LEU 65 -9.016 1.967 -4.344
482 HA LEU 65 HA LEU 65 -8.195 -0.164 -5.942
483 1HB LEU 65 2HB LEU 65 -5.982 0.182 -5.009
484 2HB LEU 65 1HB LEU 65 -6.753 1.704 -5.404
485 HG LEU 65 HG LEU 65 -7.422 1.555 -2.817
486 1HD1 LEU 65 1HD1 LEU 65 -4.923 -0.066 -3.140
487 2HD1 LEU 65 2HD1 LEU 65 -6.371 -0.440 -2.204
488 3HD1 LEU 65 3HD1 LEU 65 -5.269 0.825 -1.658
489 1HD2 LEU 65 1HD2 LEU 65 -6.166 3.322 -4.161
490 2HD2 LEU 65 2HD2 LEU 65 -4.695 2.501 -3.645
491 3HD2 LEU 65 3HD2 LEU 65 -5.782 3.199 -2.443
492 H LEU 66 H LEU 66 -8.821 -0.004 -2.484
493 HA LEU 66 HA LEU 66 -7.718 -2.501 -1.805
494 1HB LEU 66 2HB LEU 66 -10.043 -1.074 -0.512
495 2HB LEU 66 1HB LEU 66 -9.105 -2.373 0.204
496 HG LEU 66 HG LEU 66 -7.704 0.126 -0.645
497 1HD1 LEU 66 1HD1 LEU 66 -8.129 0.765 1.869
498 2HD1 LEU 66 2HD1 LEU 66 -9.607 -0.163 1.620
499 3HD1 LEU 66 3HD1 LEU 66 -9.262 1.233 0.605
500 1HD2 LEU 66 1HD2 LEU 66 -6.742 -0.743 1.784
501 2HD2 LEU 66 2HD2 LEU 66 -6.045 -1.105 0.204
502 3HD2 LEU 66 3HD2 LEU 66 -7.160 -2.244 0.957
503 H LYS 67 H LYS 67 -10.975 -1.549 -2.822
504 HA LYS 67 HA LYS 67 -12.303 -3.958 -2.507
505 1HB LYS 67 2HB LYS 67 -12.637 -1.588 -4.251
506 2HB LYS 67 1HB LYS 67 -13.469 -3.050 -4.765
507 1HG LYS 67 2HG LYS 67 -13.759 -2.275 -1.926
508 2HG LYS 67 1HG LYS 67 -14.562 -1.260 -3.125
509 1HD LYS 67 2HD LYS 67 -14.989 -4.041 -3.728
510 2HD LYS 67 1HD LYS 67 -15.460 -3.699 -2.061
511 1HE LYS 67 2HE LYS 67 -16.762 -1.735 -2.959
512 2HE LYS 67 1HE LYS 67 -16.454 -2.371 -4.574
513 1HZ LYS 67 1HZ LYS 67 -17.575 -4.210 -2.603
514 2HZ LYS 67 2HZ LYS 67 -17.867 -4.096 -4.266
515 3HZ LYS 67 3HZ LYS 67 -18.603 -3.006 -3.203
516 H GLN 68 H GLN 68 -10.790 -2.794 -5.531
517 HA GLN 68 HA GLN 68 -11.048 -5.138 -7.005
518 1HB GLN 68 2HB GLN 68 -8.849 -3.061 -7.106
519 2HB GLN 68 1HB GLN 68 -9.166 -4.256 -8.356
520 1HG GLN 68 2HG GLN 68 -10.471 -2.761 -9.315
521 2HG GLN 68 1HG GLN 68 -11.599 -3.001 -7.980
522 1HE2 GLN 68 1HE2 GLN 68 -8.471 -1.334 -8.249
523 2HE2 GLN 68 2HE2 GLN 68 -9.041 0.183 -7.664
524 H ILE 69 H ILE 69 -8.549 -4.137 -4.742
525 HA ILE 69 HA ILE 69 -6.674 -6.127 -5.264
526 HB ILE 69 HB ILE 69 -7.226 -4.415 -2.869
527 1HG1 ILE 69 2HG1 ILE 69 -6.215 -3.580 -5.083
528 2HG1 ILE 69 1HG1 ILE 69 -5.369 -3.161 -3.592
529 1HG2 ILE 69 1HG2 ILE 69 -5.540 -6.807 -2.945
530 2HG2 ILE 69 2HG2 ILE 69 -6.164 -5.901 -1.569
531 3HG2 ILE 69 3HG2 ILE 69 -4.706 -5.355 -2.395
532 1HD1 ILE 69 1HD1 ILE 69 -3.760 -3.799 -5.227
533 2HD1 ILE 69 2HD1 ILE 69 -4.627 -5.296 -5.574
534 3HD1 ILE 69 3HD1 ILE 69 -3.834 -5.077 -4.014
535 H LYS 70 H LYS 70 -9.461 -6.144 -3.151
536 HA LYS 70 HA LYS 70 -8.808 -8.644 -1.935
537 1HB LYS 70 2HB LYS 70 -10.937 -8.475 -0.834
538 2HB LYS 70 1HB LYS 70 -10.144 -6.907 -0.793
539 1HG LYS 70 2HG LYS 70 -11.792 -5.928 -1.928
540 2HG LYS 70 1HG LYS 70 -11.862 -7.235 -3.110
541 1HD LYS 70 2HD LYS 70 -13.013 -8.547 -1.170
542 2HD LYS 70 1HD LYS 70 -13.336 -6.933 -0.533
543 1HE LYS 70 2HE LYS 70 -14.637 -6.337 -2.377
544 2HE LYS 70 1HE LYS 70 -13.974 -7.627 -3.378
545 1HZ LYS 70 1HZ LYS 70 -15.204 -9.237 -2.184
546 2HZ LYS 70 2HZ LYS 70 -16.287 -7.993 -2.560
547 3HZ LYS 70 3HZ LYS 70 -15.664 -8.125 -0.994
548 H GLN 71 H GLN 71 -10.531 -7.654 -4.749
549 HA GLN 71 HA GLN 71 -12.012 -10.077 -4.999
550 1HB GLN 71 2HB GLN 71 -13.158 -8.302 -5.916
551 2HB GLN 71 1HB GLN 71 -11.712 -7.577 -6.596
552 1HG GLN 71 2HG GLN 71 -12.216 -10.114 -7.844
553 2HG GLN 71 1HG GLN 71 -13.663 -9.115 -7.893
554 1HE2 GLN 71 1HE2 GLN 71 -10.419 -7.809 -7.851
555 2HE2 GLN 71 2HE2 GLN 71 -10.446 -7.191 -9.463
556 H ARG 72 H ARG 72 -8.967 -8.882 -6.175
557 HA ARG 72 HA ARG 72 -8.688 -11.258 -7.874
558 1HB ARG 72 2HB ARG 72 -7.337 -8.589 -7.862
559 2HB ARG 72 1HB ARG 72 -6.533 -9.969 -8.597
560 1HG ARG 72 2HG ARG 72 -8.927 -10.193 -9.767
561 2HG ARG 72 1HG ARG 72 -8.897 -8.454 -9.490
562 1HD ARG 72 2HD ARG 72 -6.822 -8.250 -10.692
563 2HD ARG 72 1HD ARG 72 -6.715 -10.001 -10.870
564 HE ARG 72 HE ARG 72 -9.131 -9.003 -11.977
565 1HH1 ARG 72 1HH1 ARG 72 -5.706 -9.269 -12.604
566 2HH1 ARG 72 2HH1 ARG 72 -5.894 -9.236 -14.326
567 1HH2 ARG 72 1HH2 ARG 72 -9.378 -8.960 -14.234
568 2HH2 ARG 72 2HH2 ARG 72 -7.980 -9.061 -15.252
569 H HIS 73 H HIS 73 -7.525 -9.870 -4.945
570 HA HIS 73 HA HIS 73 -5.584 -12.074 -4.727
571 1HB HIS 73 2HB HIS 73 -5.013 -9.551 -3.267
572 2HB HIS 73 1HB HIS 73 -3.902 -10.688 -4.033
573 HD1 HIS 73 1HD HIS 73 -4.101 -10.614 -6.810
574 HD2 HIS 73 2HD HIS 73 -5.303 -7.267 -4.679
575 HE1 HIS 73 1HE HIS 73 -4.197 -8.746 -8.488
576 HE2 HIS 73 2HE HIS 73 -5.043 -6.764 -7.196
577 HA PRO 74 HA PRO 74 -7.546 -12.770 -0.821
578 1HB PRO 74 2HB PRO 74 -5.903 -14.610 0.173
579 2HB PRO 74 1HB PRO 74 -6.815 -14.905 -1.312
580 1HG PRO 74 2HG PRO 74 -3.932 -14.324 -0.953
581 2HG PRO 74 1HG PRO 74 -4.741 -15.252 -2.225
582 1HD PRO 74 2HD PRO 74 -3.874 -12.526 -2.320
583 2HD PRO 74 1HD PRO 74 -4.752 -13.427 -3.571
584 H MET 75 H MET 75 -7.451 -10.942 0.442
585 HA MET 75 HA MET 75 -6.860 -9.582 2.147
586 1HB MET 75 2HB MET 75 -5.618 -12.198 2.855
587 2HB MET 75 1HB MET 75 -5.407 -10.807 3.909
588 1HG MET 75 2HG MET 75 -8.077 -10.757 3.545
589 2HG MET 75 1HG MET 75 -7.763 -12.489 3.420
590 1HE MET 75 1HE MET 75 -8.151 -13.855 5.950
591 2HE MET 75 2HE MET 75 -9.335 -12.811 5.163
592 3HE MET 75 3HE MET 75 -9.033 -12.656 6.894
593 H LEU 76 H LEU 76 -5.245 -9.282 -0.186
594 HA LEU 76 HA LEU 76 -2.490 -9.255 0.341
595 1HB LEU 76 2HB LEU 76 -3.933 -8.775 -1.845
596 2HB LEU 76 1HB LEU 76 -3.635 -7.117 -1.362
597 HG LEU 76 HG LEU 76 -1.494 -9.178 -1.881
598 1HD1 LEU 76 1HD1 LEU 76 -1.480 -6.920 -3.640
599 2HD1 LEU 76 2HD1 LEU 76 -3.059 -7.708 -3.686
600 3HD1 LEU 76 3HD1 LEU 76 -1.598 -8.638 -4.024
601 1HD2 LEU 76 1HD2 LEU 76 -1.490 -6.484 -0.715
602 2HD2 LEU 76 2HD2 LEU 76 -0.309 -6.735 -2.000
603 3HD2 LEU 76 3HD2 LEU 76 -0.304 -7.782 -0.579
604 HA PRO 77 HA PRO 77 -2.500 -6.099 3.554
605 1HB PRO 77 2HB PRO 77 0.414 -6.249 2.966
606 2HB PRO 77 1HB PRO 77 -0.430 -6.331 4.516
607 1HG PRO 77 2HG PRO 77 0.568 -8.533 3.425
608 2HG PRO 77 1HG PRO 77 -1.014 -8.565 4.227
609 1HD PRO 77 2HD PRO 77 -0.372 -8.510 1.304
610 2HD PRO 77 1HD PRO 77 -1.636 -9.414 2.166
611 H VAL 78 H VAL 78 -2.784 -4.004 3.292
612 HA VAL 78 HA VAL 78 -1.195 -2.525 1.333
613 HB VAL 78 HB VAL 78 -4.141 -1.998 1.613
614 1HG1 VAL 78 1HG1 VAL 78 -1.974 -1.145 -0.281
615 2HG1 VAL 78 2HG1 VAL 78 -3.054 -0.144 0.689
616 3HG1 VAL 78 3HG1 VAL 78 -3.681 -1.018 -0.708
617 1HG2 VAL 78 1HG2 VAL 78 -4.606 -3.325 -0.290
618 2HG2 VAL 78 2HG2 VAL 78 -3.665 -4.334 0.806
619 3HG2 VAL 78 3HG2 VAL 78 -2.891 -3.605 -0.601
620 H ILE 79 H ILE 79 -0.843 -0.364 1.816
621 HA ILE 79 HA ILE 79 -1.756 0.509 4.479
622 HB ILE 79 HB ILE 79 0.867 1.348 3.282
623 1HG1 ILE 79 2HG1 ILE 79 0.996 -0.632 5.444
624 2HG1 ILE 79 1HG1 ILE 79 0.336 -1.270 3.944
625 1HG2 ILE 79 1HG2 ILE 79 -0.544 2.314 5.398
626 2HG2 ILE 79 2HG2 ILE 79 1.203 2.461 5.198
627 3HG2 ILE 79 3HG2 ILE 79 0.532 1.156 6.179
628 1HD1 ILE 79 1HD1 ILE 79 2.924 -1.278 4.478
629 2HD1 ILE 79 2HD1 ILE 79 2.816 0.328 3.759
630 3HD1 ILE 79 3HD1 ILE 79 2.302 -1.086 2.840
631 H ILE 80 H ILE 80 -3.184 2.089 4.180
632 HA ILE 80 HA ILE 80 -2.872 3.885 1.892
633 HB ILE 80 HB ILE 80 -5.251 3.851 3.725
634 1HG1 ILE 80 2HG1 ILE 80 -4.863 1.529 2.994
635 2HG1 ILE 80 1HG1 ILE 80 -6.296 2.204 2.230
636 1HG2 ILE 80 1HG2 ILE 80 -4.719 5.597 1.875
637 2HG2 ILE 80 2HG2 ILE 80 -6.348 4.948 2.014
638 3HG2 ILE 80 3HG2 ILE 80 -5.257 4.327 0.779
639 1HD1 ILE 80 1HD1 ILE 80 -3.592 1.863 0.971
640 2HD1 ILE 80 2HD1 ILE 80 -4.974 2.649 0.207
641 3HD1 ILE 80 3HD1 ILE 80 -5.052 0.937 0.626
642 H MET 81 H MET 81 -2.704 6.071 2.055
643 HA MET 81 HA MET 81 -1.496 7.120 4.403
644 1HB MET 81 2HB MET 81 -0.780 7.960 2.295
645 2HB MET 81 1HB MET 81 -2.418 8.392 1.830
646 1HG MET 81 2HG MET 81 -2.451 10.128 3.547
647 2HG MET 81 1HG MET 81 -0.813 9.685 4.024
648 1HE MET 81 1HE MET 81 -2.126 12.253 3.398
649 2HE MET 81 2HE MET 81 -2.167 12.825 1.730
650 3HE MET 81 3HE MET 81 -0.740 13.113 2.727
651 H THR 82 H THR 82 -4.264 8.603 2.736
652 HA THR 82 HA THR 82 -5.339 9.316 5.372
653 HB THR 82 HB THR 82 -6.203 10.525 2.757
654 HG1 THR 82 1HG THR 82 -4.305 11.369 2.593
655 1HG2 THR 82 1HG2 THR 82 -6.231 11.481 5.603
656 2HG2 THR 82 2HG2 THR 82 -7.605 11.197 4.533
657 3HG2 THR 82 3HG2 THR 82 -6.504 12.537 4.217
658 H ALA 83 H ALA 83 -7.495 9.038 5.877
659 HA ALA 83 HA ALA 83 -8.968 7.153 4.156
660 1HB ALA 83 1HB ALA 83 -9.373 5.838 5.913
661 2HB ALA 83 2HB ALA 83 -9.799 7.202 6.947
662 3HB ALA 83 3HB ALA 83 -8.109 6.745 6.741
663 H HIS 84 H HIS 84 -9.475 9.561 3.333
664 HA HIS 84 HA HIS 84 -11.718 10.653 4.866
665 1HB HIS 84 2HB HIS 84 -11.540 12.606 3.363
666 2HB HIS 84 1HB HIS 84 -10.039 12.274 4.218
667 HD1 HIS 84 1HD HIS 84 -11.569 11.529 0.811
668 HD2 HIS 84 2HD HIS 84 -7.880 12.235 2.590
669 HE1 HIS 84 1HE HIS 84 -9.910 11.582 -1.078
670 HE2 HIS 84 2HE HIS 84 -7.677 11.949 0.029
671 H SER 85 H SER 85 -13.777 10.631 4.182
672 HA SER 85 HA SER 85 -15.634 10.103 2.986
673 1HB SER 85 2HB SER 85 -14.514 11.662 1.344
674 2HB SER 85 1HB SER 85 -13.884 10.231 0.535
675 HG SER 85 HG SER 85 -15.809 10.856 -0.447
676 H ASP 86 H ASP 86 -16.686 8.255 2.586
677 HA ASP 86 HA ASP 86 -17.069 6.030 2.350
678 1HB ASP 86 2HB ASP 86 -16.086 6.849 0.010
679 2HB ASP 86 1HB ASP 86 -14.800 5.728 0.446
680 H LEU 87 H LEU 87 -15.305 6.772 4.458
681 HA LEU 87 HA LEU 87 -12.959 5.328 4.654
682 1HB LEU 87 2HB LEU 87 -14.547 6.855 6.368
683 2HB LEU 87 1HB LEU 87 -14.404 5.296 7.160
684 HG LEU 87 HG LEU 87 -12.125 7.064 6.288
685 1HD1 LEU 87 1HD1 LEU 87 -13.341 6.424 8.952
686 2HD1 LEU 87 2HD1 LEU 87 -13.041 8.004 8.228
687 3HD1 LEU 87 3HD1 LEU 87 -11.689 7.021 8.792
688 1HD2 LEU 87 1HD2 LEU 87 -11.314 4.894 6.015
689 2HD2 LEU 87 2HD2 LEU 87 -12.192 4.291 7.420
690 3HD2 LEU 87 3HD2 LEU 87 -10.797 5.348 7.637
691 H ASP 88 H ASP 88 -16.207 4.178 4.725
692 HA ASP 88 HA ASP 88 -16.064 1.849 6.168
693 1HB ASP 88 2HB ASP 88 -18.073 2.816 4.941
694 2HB ASP 88 1HB ASP 88 -17.457 2.014 3.498
695 H ALA 89 H ALA 89 -15.150 2.306 2.769
696 HA ALA 89 HA ALA 89 -14.410 -0.354 2.282
697 1HB ALA 89 1HB ALA 89 -14.841 1.298 0.510
698 2HB ALA 89 2HB ALA 89 -13.288 0.485 0.304
699 3HB ALA 89 3HB ALA 89 -13.350 2.128 0.948
700 H ALA 90 H ALA 90 -12.845 2.124 4.068
701 HA ALA 90 HA ALA 90 -10.161 1.190 3.785
702 1HB ALA 90 1HB ALA 90 -10.601 3.481 4.496
703 2HB ALA 90 2HB ALA 90 -9.660 2.624 5.712
704 3HB ALA 90 3HB ALA 90 -11.384 2.887 5.958
705 H VAL 91 H VAL 91 -12.468 0.989 6.504
706 HA VAL 91 HA VAL 91 -10.919 -0.734 8.060
707 HB VAL 91 HB VAL 91 -13.915 -0.782 8.142
708 1HG1 VAL 91 1HG1 VAL 91 -13.495 -2.066 9.912
709 2HG1 VAL 91 2HG1 VAL 91 -12.756 -0.669 10.694
710 3HG1 VAL 91 3HG1 VAL 91 -11.758 -1.789 9.763
711 1HG2 VAL 91 1HG2 VAL 91 -13.358 1.126 9.932
712 2HG2 VAL 91 2HG2 VAL 91 -13.753 1.484 8.251
713 3HG2 VAL 91 3HG2 VAL 91 -12.068 1.447 8.772
714 H SER 92 H SER 92 -13.642 -1.518 5.905
715 HA SER 92 HA SER 92 -13.509 -4.295 6.246
716 1HB SER 92 2HB SER 92 -14.778 -4.476 4.174
717 2HB SER 92 1HB SER 92 -15.400 -3.128 5.131
718 HG SER 92 HG SER 92 -14.975 -1.902 3.493
719 H ALA 93 H ALA 93 -11.472 -2.107 4.551
720 HA ALA 93 HA ALA 93 -10.341 -3.783 2.625
721 1HB ALA 93 1HB ALA 93 -9.994 -1.187 3.332
722 2HB ALA 93 2HB ALA 93 -8.964 -2.064 2.202
723 3HB ALA 93 3HB ALA 93 -8.490 -1.909 3.897
724 H TYR 94 H TYR 94 -9.369 -3.097 5.934
725 HA TYR 94 HA TYR 94 -7.110 -4.725 6.047
726 1HB TYR 94 2HB TYR 94 -8.911 -4.427 8.428
727 2HB TYR 94 1HB TYR 94 -7.153 -4.468 8.373
728 HD1 TYR 94 1HD TYR 94 -6.451 -2.433 6.456
729 HD2 TYR 94 2HD TYR 94 -9.560 -2.413 9.364
730 HE1 TYR 94 1HE TYR 94 -6.379 0.019 6.510
731 HE2 TYR 94 2HE TYR 94 -9.489 0.042 9.424
732 HH TYR 94 HH TYR 94 -8.796 1.897 8.047
733 H GLN 95 H GLN 95 -10.470 -5.441 6.281
734 HA GLN 95 HA GLN 95 -10.159 -8.106 7.288
735 1HB GLN 95 2HB GLN 95 -12.228 -7.167 7.809
736 2HB GLN 95 1HB GLN 95 -12.425 -6.462 6.216
737 1HG GLN 95 2HG GLN 95 -12.442 -9.163 5.695
738 2HG GLN 95 1HG GLN 95 -13.272 -9.048 7.243
739 1HE2 GLN 95 1HE2 GLN 95 -13.191 -6.852 4.461
740 2HE2 GLN 95 2HE2 GLN 95 -14.898 -6.848 4.193
741 H GLN 96 H GLN 96 -10.496 -6.608 4.140
742 HA GLN 96 HA GLN 96 -10.433 -9.207 2.849
743 1HB GLN 96 2HB GLN 96 -11.099 -8.041 0.840
744 2HB GLN 96 1HB GLN 96 -12.170 -7.623 2.164
745 1HG GLN 96 2HG GLN 96 -10.644 -5.589 2.482
746 2HG GLN 96 1HG GLN 96 -10.054 -5.957 0.865
747 1HE2 GLN 96 1HE2 GLN 96 -10.873 -4.298 -0.264
748 2HE2 GLN 96 2HE2 GLN 96 -12.557 -3.938 -0.405
749 H GLY 97 H GLY 97 -8.165 -7.083 3.908
750 1HA GLY 97 2HA GLY 97 -5.872 -7.887 3.215
751 2HA GLY 97 1HA GLY 97 -6.415 -7.567 1.577
752 H ALA 98 H ALA 98 -5.655 -6.076 4.669
753 HA ALA 98 HA ALA 98 -4.323 -3.902 3.458
754 1HB ALA 98 1HB ALA 98 -7.043 -3.347 4.583
755 2HB ALA 98 2HB ALA 98 -6.439 -2.969 2.973
756 3HB ALA 98 3HB ALA 98 -5.819 -2.102 4.378
757 H PHE 99 H PHE 99 -2.900 -3.021 4.899
758 HA PHE 99 HA PHE 99 -2.724 -4.249 7.460
759 1HB PHE 99 2HB PHE 99 -0.737 -3.613 6.083
760 2HB PHE 99 1HB PHE 99 -1.097 -1.923 6.431
761 HD1 PHE 99 1HD PHE 99 -0.855 -5.099 8.376
762 HD2 PHE 99 2HD PHE 99 0.216 -0.995 8.058
763 HE1 PHE 99 1HE PHE 99 0.395 -5.268 10.488
764 HE2 PHE 99 2HE PHE 99 1.471 -1.161 10.168
765 HZ PHE 99 HZ PHE 99 1.558 -3.295 11.387
766 H ASP 100 H ASP 100 -3.190 -0.862 6.421
767 HA ASP 100 HA ASP 100 -5.132 -0.283 8.346
768 1HB ASP 100 2HB ASP 100 -2.846 -0.640 9.689
769 2HB ASP 100 1HB ASP 100 -2.635 1.052 9.258
770 H TYR 101 H TYR 101 -4.863 2.269 8.944
771 HA TYR 101 HA TYR 101 -4.338 3.684 6.422
772 1HB TYR 101 2HB TYR 101 -6.828 3.508 8.003
773 2HB TYR 101 1HB TYR 101 -6.373 5.137 7.517
774 HD1 TYR 101 1HD TYR 101 -6.916 1.724 6.131
775 HD2 TYR 101 2HD TYR 101 -6.923 5.910 5.411
776 HE1 TYR 101 1HE TYR 101 -7.908 1.334 3.913
777 HE2 TYR 101 2HE TYR 101 -7.911 5.543 3.192
778 HH TYR 101 HH TYR 101 -7.899 3.439 1.498
779 H LEU 102 H LEU 102 -3.796 5.935 6.683
780 HA LEU 102 HA LEU 102 -2.589 6.450 9.303
781 1HB LEU 102 2HB LEU 102 -1.927 7.217 6.524
782 2HB LEU 102 1HB LEU 102 -1.587 8.410 7.761
783 HG LEU 102 HG LEU 102 -0.166 6.783 8.932
784 1HD1 LEU 102 1HD1 LEU 102 -1.308 4.995 6.886
785 2HD1 LEU 102 2HD1 LEU 102 -0.776 4.651 8.530
786 3HD1 LEU 102 3HD1 LEU 102 0.409 4.799 7.231
787 1HD2 LEU 102 1HD2 LEU 102 1.657 6.814 7.386
788 2HD2 LEU 102 2HD2 LEU 102 0.724 8.295 7.172
789 3HD2 LEU 102 3HD2 LEU 102 0.553 6.974 6.020
790 HA PRO 103 HA PRO 103 -5.885 9.380 9.963
791 1HB PRO 103 2HB PRO 103 -4.897 10.433 12.287
792 2HB PRO 103 1HB PRO 103 -5.798 8.920 12.197
793 1HG PRO 103 2HG PRO 103 -2.866 9.368 12.443
794 2HG PRO 103 1HG PRO 103 -3.875 8.093 13.142
795 1HD PRO 103 2HD PRO 103 -2.275 7.740 10.952
796 2HD PRO 103 1HD PRO 103 -3.737 6.787 11.274
797 H LYS 104 H LYS 104 -2.797 10.708 11.120
798 HA LYS 104 HA LYS 104 -3.235 13.020 9.359
799 1HB LYS 104 2HB LYS 104 -1.994 12.996 12.112
800 2HB LYS 104 1HB LYS 104 -2.100 14.402 11.064
801 1HG LYS 104 2HG LYS 104 -4.127 14.851 11.818
802 2HG LYS 104 1HG LYS 104 -4.694 13.256 11.320
803 1HD LYS 104 2HD LYS 104 -3.907 12.315 13.437
804 2HD LYS 104 1HD LYS 104 -3.326 13.906 13.932
805 1HE LYS 104 2HE LYS 104 -5.327 14.255 14.839
806 2HE LYS 104 1HE LYS 104 -5.982 14.317 13.204
807 1HZ LYS 104 1HZ LYS 104 -7.165 12.528 13.702
808 2HZ LYS 104 2HZ LYS 104 -6.426 12.386 15.215
809 3HZ LYS 104 3HZ LYS 104 -5.738 11.634 13.863
810 HA PRO 105 HA PRO 105 1.616 12.510 9.641
811 1HB PRO 105 2HB PRO 105 2.425 10.020 10.514
812 2HB PRO 105 1HB PRO 105 2.397 11.476 11.513
813 1HG PRO 105 2HG PRO 105 0.391 9.264 11.326
814 2HG PRO 105 1HG PRO 105 0.987 10.120 12.761
815 1HD PRO 105 2HD PRO 105 -1.392 10.692 11.703
816 2HD PRO 105 1HD PRO 105 -0.360 11.970 12.369
817 H PHE 106 H PHE 106 3.050 11.386 8.169
818 HA PHE 106 HA PHE 106 2.233 9.076 6.729
819 1HB PHE 106 2HB PHE 106 0.631 10.651 5.730
820 2HB PHE 106 1HB PHE 106 1.946 11.734 5.288
821 HD1 PHE 106 1HD PHE 106 1.279 8.083 4.909
822 HD2 PHE 106 2HD PHE 106 2.379 11.729 3.035
823 HE1 PHE 106 1HE PHE 106 1.500 6.899 2.770
824 HE2 PHE 106 2HE PHE 106 2.609 10.555 0.885
825 HZ PHE 106 HZ PHE 106 2.166 8.135 0.750
826 H ASP 107 H ASP 107 3.731 11.392 4.664
827 HA ASP 107 HA ASP 107 5.807 11.332 3.706
828 1HB ASP 107 2HB ASP 107 7.579 12.019 5.227
829 2HB ASP 107 1HB ASP 107 6.085 12.867 5.614
830 H ILE 108 H ILE 108 8.157 10.293 3.970
831 HA ILE 108 HA ILE 108 7.751 7.502 3.744
832 HB ILE 108 HB ILE 108 9.862 9.314 3.157
833 1HG1 ILE 108 2HG1 ILE 108 10.506 7.484 1.625
834 2HG1 ILE 108 1HG1 ILE 108 9.363 6.429 2.443
835 1HG2 ILE 108 1HG2 ILE 108 11.111 8.544 5.020
836 2HG2 ILE 108 2HG2 ILE 108 11.758 7.722 3.600
837 3HG2 ILE 108 3HG2 ILE 108 10.674 6.867 4.696
838 1HD1 ILE 108 1HD1 ILE 108 8.353 8.991 1.350
839 2HD1 ILE 108 2HD1 ILE 108 7.551 7.428 1.512
840 3HD1 ILE 108 3HD1 ILE 108 8.730 7.688 0.224
841 H ASP 109 H ASP 109 9.089 9.511 6.253
842 HA ASP 109 HA ASP 109 10.219 7.633 7.905
843 1HB ASP 109 2HB ASP 109 9.886 10.256 8.153
844 2HB ASP 109 1HB ASP 109 8.569 9.743 9.205
845 H GLU 110 H GLU 110 6.829 8.771 8.163
846 HA GLU 110 HA GLU 110 6.175 6.637 9.937
847 1HB GLU 110 2HB GLU 110 4.332 8.577 8.554
848 2HB GLU 110 1HB GLU 110 3.894 7.511 9.877
849 1HG GLU 110 2HG GLU 110 6.172 9.067 10.619
850 2HG GLU 110 1HG GLU 110 4.899 10.126 10.018
851 H ALA 111 H ALA 111 5.772 7.239 6.516
852 HA ALA 111 HA ALA 111 3.939 5.149 6.012
853 1HB ALA 111 1HB ALA 111 5.960 5.938 3.959
854 2HB ALA 111 2HB ALA 111 4.719 7.090 4.453
855 3HB ALA 111 3HB ALA 111 4.253 5.539 3.762
856 H VAL 112 H VAL 112 7.459 5.281 5.428
857 HA VAL 112 HA VAL 112 7.760 2.552 4.896
858 HB VAL 112 HB VAL 112 9.821 4.380 6.119
859 1HG1 VAL 112 1HG1 VAL 112 10.830 2.339 4.355
860 2HG1 VAL 112 2HG1 VAL 112 9.875 1.619 5.651
861 3HG1 VAL 112 3HG1 VAL 112 11.241 2.667 6.039
862 1HG2 VAL 112 1HG2 VAL 112 10.562 4.302 3.578
863 2HG2 VAL 112 2HG2 VAL 112 9.388 5.483 4.157
864 3HG2 VAL 112 3HG2 VAL 112 8.837 4.027 3.330
865 H ALA 113 H ALA 113 7.566 4.320 7.867
866 HA ALA 113 HA ALA 113 8.601 2.351 9.607
867 1HB ALA 113 1HB ALA 113 8.334 4.655 10.321
868 2HB ALA 113 2HB ALA 113 7.411 3.583 11.374
869 3HB ALA 113 3HB ALA 113 6.584 4.527 10.134
870 H LEU 114 H LEU 114 5.324 3.167 8.590
871 HA LEU 114 HA LEU 114 4.087 1.060 10.034
872 1HB LEU 114 2HB LEU 114 2.939 3.149 9.455
873 2HB LEU 114 1HB LEU 114 3.039 2.730 7.756
874 HG LEU 114 HG LEU 114 1.655 0.660 8.346
875 1HD1 LEU 114 1HD1 LEU 114 1.834 0.572 10.697
876 2HD1 LEU 114 2HD1 LEU 114 0.177 1.073 10.349
877 3HD1 LEU 114 3HD1 LEU 114 1.371 2.266 10.868
878 1HD2 LEU 114 1HD2 LEU 114 0.937 2.982 7.347
879 2HD2 LEU 114 2HD2 LEU 114 0.093 3.127 8.890
880 3HD2 LEU 114 3HD2 LEU 114 -0.269 1.779 7.812
881 H VAL 115 H VAL 115 5.642 1.243 6.961
882 HA VAL 115 HA VAL 115 4.254 -1.013 5.846
883 HB VAL 115 HB VAL 115 5.298 0.842 4.460
884 1HG1 VAL 115 1HG1 VAL 115 7.627 0.671 3.879
885 2HG1 VAL 115 2HG1 VAL 115 7.821 -0.739 4.925
886 3HG1 VAL 115 3HG1 VAL 115 7.474 0.835 5.622
887 1HG2 VAL 115 1HG2 VAL 115 6.459 -1.480 3.216
888 2HG2 VAL 115 2HG2 VAL 115 5.030 -0.556 2.751
889 3HG2 VAL 115 3HG2 VAL 115 4.896 -1.859 3.927
890 H GLU 116 H GLU 116 7.490 -0.468 7.192
891 HA GLU 116 HA GLU 116 8.369 -3.138 6.852
892 1HB GLU 116 2HB GLU 116 9.327 -0.926 8.668
893 2HB GLU 116 1HB GLU 116 10.140 -2.477 8.517
894 1HG GLU 116 2HG GLU 116 10.249 -1.968 6.014
895 2HG GLU 116 1HG GLU 116 9.838 -0.315 6.468
896 H ARG 117 H ARG 117 7.039 -1.389 9.636
897 HA ARG 117 HA ARG 117 7.193 -3.511 11.461
898 1HB ARG 117 2HB ARG 117 5.326 -1.144 11.325
899 2HB ARG 117 1HB ARG 117 5.366 -2.267 12.678
900 1HG ARG 117 2HG ARG 117 7.823 -1.704 12.900
901 2HG ARG 117 1HG ARG 117 7.521 -0.386 11.766
902 1HD ARG 117 2HD ARG 117 7.351 0.534 13.947
903 2HD ARG 117 1HD ARG 117 5.712 0.398 13.316
904 HE ARG 117 HE ARG 117 6.718 -1.759 15.010
905 1HH1 ARG 117 1HH1 ARG 117 4.641 1.032 14.655
906 2HH1 ARG 117 2HH1 ARG 117 3.682 0.644 16.042
907 1HH2 ARG 117 1HH2 ARG 117 5.459 -2.256 16.836
908 2HH2 ARG 117 2HH2 ARG 117 4.144 -1.219 17.278
909 H ALA 118 H ALA 118 5.045 -2.881 8.849
910 HA ALA 118 HA ALA 118 2.883 -4.512 9.702
911 1HB ALA 118 1HB ALA 118 2.537 -2.785 8.037
912 2HB ALA 118 2HB ALA 118 2.124 -4.361 7.364
913 3HB ALA 118 3HB ALA 118 3.655 -3.592 6.937
914 H ILE 119 H ILE 119 5.608 -5.027 7.494
915 HA ILE 119 HA ILE 119 4.957 -7.660 6.773
916 HB ILE 119 HB ILE 119 7.743 -6.527 6.945
917 1HG1 ILE 119 2HG1 ILE 119 6.287 -6.414 4.374
918 2HG1 ILE 119 1HG1 ILE 119 5.755 -5.272 5.606
919 1HG2 ILE 119 1HG2 ILE 119 7.813 -8.846 6.478
920 2HG2 ILE 119 2HG2 ILE 119 8.060 -8.020 4.937
921 3HG2 ILE 119 3HG2 ILE 119 6.487 -8.726 5.320
922 1HD1 ILE 119 1HD1 ILE 119 8.525 -5.574 4.487
923 2HD1 ILE 119 2HD1 ILE 119 8.101 -4.534 5.847
924 3HD1 ILE 119 3HD1 ILE 119 7.417 -4.220 4.255
925 H SER 120 H SER 120 6.618 -6.334 9.515
926 HA SER 120 HA SER 120 7.749 -8.780 10.426
927 1HB SER 120 2HB SER 120 8.789 -6.697 11.071
928 2HB SER 120 1HB SER 120 7.294 -6.141 11.825
929 HG SER 120 HG SER 120 8.611 -8.501 12.654
930 H HIS 121 H HIS 121 4.988 -6.816 11.519
931 HA HIS 121 HA HIS 121 4.167 -8.661 13.503
932 1HB HIS 121 2HB HIS 121 2.880 -6.297 12.187
933 2HB HIS 121 1HB HIS 121 1.955 -7.319 13.282
934 HD1 HIS 121 1HD HIS 121 3.815 -4.329 13.326
935 HD2 HIS 121 2HD HIS 121 3.572 -7.602 15.872
936 HE1 HIS 121 1HE HIS 121 4.699 -3.527 15.537
937 HE2 HIS 121 2HE HIS 121 4.644 -5.553 17.030
938 H TYR 122 H TYR 122 3.616 -8.451 10.106
939 HA TYR 122 HA TYR 122 1.237 -9.973 9.985
940 1HB TYR 122 2HB TYR 122 3.195 -8.917 8.082
941 2HB TYR 122 1HB TYR 122 2.465 -10.438 7.578
942 HD1 TYR 122 1HD TYR 122 2.185 -7.086 7.121
943 HD2 TYR 122 2HD TYR 122 -0.238 -10.392 8.254
944 HE1 TYR 122 1HE TYR 122 0.188 -5.870 6.368
945 HE2 TYR 122 2HE TYR 122 -2.244 -9.186 7.502
946 HH TYR 122 HH TYR 122 -2.097 -5.835 6.455
947 H GLN 123 H GLN 123 4.615 -10.893 9.317
948 HA GLN 123 HA GLN 123 3.973 -13.668 9.190
949 1HB GLN 123 2HB GLN 123 6.413 -12.017 8.938
950 2HB GLN 123 1HB GLN 123 6.652 -13.680 9.452
951 1HG GLN 123 2HG GLN 123 6.857 -13.422 7.033
952 2HG GLN 123 1HG GLN 123 5.527 -14.492 7.478
953 1HE2 GLN 123 1HE2 GLN 123 3.499 -13.996 6.860
954 2HE2 GLN 123 2HE2 GLN 123 3.068 -12.591 5.951
955 H GLU 124 H GLU 124 5.741 -15.072 10.558
956 HA GLU 124 HA GLU 124 6.202 -15.986 12.592
957 1HB GLU 124 2HB GLU 124 5.993 -13.161 13.645
958 2HB GLU 124 1HB GLU 124 6.830 -14.510 14.401
959 1HG GLU 124 2HG GLU 124 8.629 -14.337 13.045
960 2HG GLU 124 1HG GLU 124 7.680 -13.778 11.669
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