NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
277886 |
2kpm   |
16560 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 1H MET 1 -1.975 -14.542 -3.117
2 H2 MET 1 2H MET 1 -2.040 -13.405 -4.372
3 H3 MET 1 3H MET 1 -0.543 -13.964 -3.821
4 HA MET 1 HA MET 1 -1.124 -16.216 -4.582
5 HB2 MET 1 2HB MET 1 -3.524 -14.744 -5.708
6 HB3 MET 1 1HB MET 1 -3.023 -16.336 -6.260
7 HG2 MET 1 2HG MET 1 -3.359 -17.218 -3.993
8 HG3 MET 1 1HG MET 1 -3.886 -15.619 -3.464
9 HE1 MET 1 3HE MET 1 -6.110 -16.838 -2.509
10 HE2 MET 1 1HE MET 1 -5.565 -18.386 -3.151
11 HE3 MET 1 2HE MET 1 -7.188 -17.802 -3.520
12 H ASP 2 H ASP 2 0.855 -15.836 -5.513
13 HA ASP 2 HA ASP 2 1.011 -14.657 -8.135
14 HB2 ASP 2 2HB ASP 2 2.744 -12.930 -7.189
15 HB3 ASP 2 1HB ASP 2 1.022 -12.576 -7.081
16 H GLN 3 H GLN 3 3.563 -14.220 -8.534
17 HA GLN 3 HA GLN 3 4.828 -16.803 -8.032
18 HB2 GLN 3 2HB GLN 3 5.621 -14.500 -9.831
19 HB3 GLN 3 1HB GLN 3 6.500 -16.017 -9.713
20 HG2 GLN 3 2HG GLN 3 3.664 -15.669 -10.674
21 HG3 GLN 3 1HG GLN 3 5.076 -15.997 -11.677
22 HE21 GLN 3 1HE2 GLN 3 6.012 -18.067 -11.602
23 HE22 GLN 3 2HE2 GLN 3 5.148 -19.427 -10.985
24 H LYS 4 H LYS 4 5.941 -16.963 -6.177
25 HA LYS 4 HA LYS 4 6.946 -14.688 -4.773
26 HB2 LYS 4 2HB LYS 4 7.503 -17.616 -4.254
27 HB3 LYS 4 1HB LYS 4 7.762 -16.292 -3.126
28 HG2 LYS 4 2HG LYS 4 5.099 -17.230 -4.198
29 HG3 LYS 4 1HG LYS 4 5.734 -17.503 -2.573
30 HD2 LYS 4 2HD LYS 4 5.683 -15.115 -2.119
31 HD3 LYS 4 1HD LYS 4 5.159 -14.780 -3.771
32 HE2 LYS 4 2HE LYS 4 3.250 -14.661 -2.307
33 HE3 LYS 4 1HE LYS 4 3.089 -16.082 -3.335
34 HZ1 LYS 4 3HZ LYS 4 3.844 -17.458 -1.507
35 HZ2 LYS 4 1HZ LYS 4 2.502 -16.547 -1.035
36 HZ3 LYS 4 2HZ LYS 4 4.050 -16.100 -0.525
37 H SER 5 H SER 5 8.329 -13.766 -6.364
38 HA SER 5 HA SER 5 10.874 -15.137 -6.901
39 HB2 SER 5 2HB SER 5 11.268 -13.330 -8.532
40 HB3 SER 5 1HB SER 5 9.711 -14.106 -8.816
41 HG SER 5 HG SER 5 9.301 -11.956 -8.895
42 H SER 6 H SER 6 12.892 -13.850 -6.728
43 HA SER 6 HA SER 6 12.854 -11.668 -4.776
44 HB2 SER 6 2HB SER 6 13.136 -13.720 -3.426
45 HB3 SER 6 1HB SER 6 14.548 -14.153 -4.388
46 HG SER 6 HG SER 6 15.331 -13.132 -2.610
47 H SER 7 H SER 7 15.239 -10.871 -4.438
48 HA SER 7 HA SER 7 16.960 -11.154 -6.740
49 HB2 SER 7 2HB SER 7 15.288 -9.652 -7.697
50 HB3 SER 7 1HB SER 7 15.457 -8.551 -6.331
51 HG SER 7 HG SER 7 17.064 -8.886 -8.551
52 HA PRO 8 HA PRO 8 19.855 -10.010 -3.514
53 HB2 PRO 8 2HB PRO 8 21.747 -9.574 -5.751
54 HB3 PRO 8 1HB PRO 8 21.865 -10.676 -4.376
55 HG2 PRO 8 2HG PRO 8 21.371 -11.586 -6.847
56 HG3 PRO 8 1HG PRO 8 20.617 -12.328 -5.421
57 HD2 PRO 8 2HD PRO 8 19.441 -10.399 -7.402
58 HD3 PRO 8 1HD PRO 8 18.709 -11.839 -6.659
59 H GLN 9 H GLN 9 19.817 -8.085 -6.525
60 HA GLN 9 HA GLN 9 19.947 -5.869 -6.955
61 HB2 GLN 9 2HB GLN 9 18.990 -5.666 -4.096
62 HB3 GLN 9 1HB GLN 9 19.111 -4.290 -5.185
63 HG2 GLN 9 2HG GLN 9 17.412 -6.736 -5.669
64 HG3 GLN 9 1HG GLN 9 16.826 -5.196 -5.042
65 HE21 GLN 9 1HE2 GLN 9 16.234 -6.716 -7.547
66 HE22 GLN 9 2HE2 GLN 9 16.484 -5.575 -8.817
67 HA PRO 10 HA PRO 10 24.227 -5.438 -5.439
68 HB2 PRO 10 2HB PRO 10 25.147 -4.166 -7.664
69 HB3 PRO 10 1HB PRO 10 24.958 -5.920 -7.567
70 HG2 PRO 10 2HG PRO 10 23.120 -3.883 -8.785
71 HG3 PRO 10 1HG PRO 10 23.634 -5.455 -9.433
72 HD2 PRO 10 2HD PRO 10 21.233 -5.107 -8.230
73 HD3 PRO 10 1HD PRO 10 22.137 -6.631 -8.107
74 H ALA 11 H ALA 11 24.674 -3.864 -4.020
75 HA ALA 11 HA ALA 11 23.413 -1.279 -4.138
76 HB1 ALA 11 3HB ALA 11 23.785 -2.437 -2.012
77 HB2 ALA 11 1HB ALA 11 24.568 -0.856 -2.029
78 HB3 ALA 11 2HB ALA 11 25.528 -2.319 -2.251
79 H ALA 12 H ALA 12 25.027 -1.624 -6.431
80 HA ALA 12 HA ALA 12 27.551 -0.278 -6.116
81 HB1 ALA 12 3HB ALA 12 26.001 -0.901 -8.633
82 HB2 ALA 12 1HB ALA 12 27.196 -1.953 -7.875
83 HB3 ALA 12 2HB ALA 12 27.690 -0.400 -8.550
84 H GLN 13 H GLN 13 24.338 0.787 -6.329
85 HA GLN 13 HA GLN 13 24.770 3.286 -7.671
86 HB2 GLN 13 2HB GLN 13 22.534 2.436 -5.811
87 HB3 GLN 13 1HB GLN 13 22.521 3.871 -6.826
88 HG2 GLN 13 2HG GLN 13 22.651 1.033 -7.828
89 HG3 GLN 13 1HG GLN 13 21.194 2.020 -7.754
90 HE21 GLN 13 1HE2 GLN 13 20.968 3.747 -9.201
91 HE22 GLN 13 2HE2 GLN 13 21.928 3.860 -10.634
92 H ALA 14 H ALA 14 25.106 5.333 -6.784
93 HA ALA 14 HA ALA 14 26.387 5.528 -4.251
94 HB1 ALA 14 3HB ALA 14 26.447 7.929 -4.679
95 HB2 ALA 14 1HB ALA 14 25.299 7.733 -6.004
96 HB3 ALA 14 2HB ALA 14 26.910 7.026 -6.123
97 HA PRO 15 HA PRO 15 22.829 5.592 -1.563
98 HB2 PRO 15 2HB PRO 15 24.588 7.361 0.086
99 HB3 PRO 15 1HB PRO 15 23.688 5.913 0.556
100 HG2 PRO 15 2HG PRO 15 26.319 5.793 0.191
101 HG3 PRO 15 1HG PRO 15 25.271 4.472 -0.363
102 HD2 PRO 15 2HD PRO 15 26.597 6.632 -1.953
103 HD3 PRO 15 1HD PRO 15 26.325 4.928 -2.371
104 H GLU 16 H GLU 16 21.166 6.799 -2.309
105 HA GLU 16 HA GLU 16 21.398 9.706 -2.487
106 HB2 GLU 16 2HB GLU 16 19.205 9.622 -3.572
107 HB3 GLU 16 1HB GLU 16 20.334 8.516 -4.339
108 HG2 GLU 16 2HG GLU 16 19.300 6.641 -3.126
109 HG3 GLU 16 1HG GLU 16 18.146 7.763 -2.404
110 H THR 17 H THR 17 18.634 10.309 -1.943
111 HA THR 17 HA THR 17 18.755 11.079 0.702
112 HB THR 17 HB THR 17 16.201 10.528 -0.834
113 HG1 THR 17 HG1 THR 17 17.227 11.984 -2.077
114 HG21 THR 17 3HG2 THR 17 15.257 12.311 0.599
115 HG22 THR 17 1HG2 THR 17 16.773 12.368 1.500
116 HG23 THR 17 2HG2 THR 17 15.780 10.912 1.536
117 H LYS 18 H LYS 18 18.774 9.945 2.538
118 HA LYS 18 HA LYS 18 17.227 7.441 2.742
119 HB2 LYS 18 2HB LYS 18 19.559 7.261 3.441
120 HB3 LYS 18 1HB LYS 18 19.364 8.609 4.553
121 HG2 LYS 18 2HG LYS 18 17.660 7.212 5.784
122 HG3 LYS 18 1HG LYS 18 18.147 5.859 4.760
123 HD2 LYS 18 2HD LYS 18 20.435 6.028 5.593
124 HD3 LYS 18 1HD LYS 18 19.993 7.428 6.570
125 HE2 LYS 18 2HE LYS 18 18.347 5.969 7.772
126 HE3 LYS 18 1HE LYS 18 19.007 4.592 6.892
127 HZ1 LYS 18 3HZ LYS 18 21.169 5.056 7.895
128 HZ2 LYS 18 1HZ LYS 18 19.994 4.787 9.083
129 HZ3 LYS 18 2HZ LYS 18 20.513 6.357 8.745
130 H GLN 19 H GLN 19 15.183 7.763 3.432
131 HA GLN 19 HA GLN 19 14.731 9.694 5.625
132 HB2 GLN 19 2HB GLN 19 12.872 8.830 3.402
133 HB3 GLN 19 1HB GLN 19 12.334 9.730 4.813
134 HG2 GLN 19 2HG GLN 19 14.365 10.669 2.791
135 HG3 GLN 19 1HG GLN 19 12.680 11.179 2.879
136 HE21 GLN 19 1HE2 GLN 19 12.030 12.512 4.630
137 HE22 GLN 19 2HE2 GLN 19 13.183 13.416 5.543
138 H ALA 20 H ALA 20 13.245 9.113 7.280
139 HA ALA 20 HA ALA 20 13.226 6.302 7.934
140 HB1 ALA 20 3HB ALA 20 12.168 7.008 10.021
141 HB2 ALA 20 1HB ALA 20 11.977 8.640 9.378
142 HB3 ALA 20 2HB ALA 20 13.590 7.987 9.661
143 H PHE 21 H PHE 21 11.390 4.985 8.270
144 HA PHE 21 HA PHE 21 9.072 5.655 6.619
145 HB2 PHE 21 2HB PHE 21 9.962 3.085 7.949
146 HB3 PHE 21 1HB PHE 21 8.430 3.246 7.099
147 HD1 PHE 21 HD1 PHE 21 8.578 4.086 4.637
148 HD2 PHE 21 HD2 PHE 21 11.847 2.391 6.781
149 HE1 PHE 21 HE1 PHE 21 9.687 3.533 2.515
150 HE2 PHE 21 HE2 PHE 21 12.954 1.836 4.658
151 HZ PHE 21 HZ PHE 21 11.872 2.404 2.519
152 HA PRO 22 HA PRO 22 6.878 6.482 10.549
153 HB2 PRO 22 2HB PRO 22 4.939 8.041 9.486
154 HB3 PRO 22 1HB PRO 22 6.550 8.672 9.846
155 HG2 PRO 22 2HG PRO 22 5.403 7.804 7.215
156 HG3 PRO 22 1HG PRO 22 6.415 9.214 7.584
157 HD2 PRO 22 2HD PRO 22 7.381 6.885 6.495
158 HD3 PRO 22 1HD PRO 22 8.360 7.993 7.477
159 H ARG 23 H ARG 23 6.073 4.393 10.856
160 HA ARG 23 HA ARG 23 4.397 3.199 8.823
161 HB2 ARG 23 2HB ARG 23 4.550 1.154 10.141
162 HB3 ARG 23 1HB ARG 23 6.135 1.861 9.870
163 HG2 ARG 23 2HG ARG 23 6.144 2.753 12.144
164 HG3 ARG 23 1HG ARG 23 4.535 2.081 12.421
165 HD2 ARG 23 2HD ARG 23 5.445 -0.182 11.994
166 HD3 ARG 23 1HD ARG 23 7.053 0.521 11.816
167 HE ARG 23 HE ARG 23 6.072 1.320 14.290
168 HH11 ARG 23 1HH1 ARG 23 6.937 -1.606 12.707
169 HH12 ARG 23 2HH1 ARG 23 7.367 -2.406 14.172
170 HH21 ARG 23 1HH2 ARG 23 6.608 0.287 16.172
171 HH22 ARG 23 2HH2 ARG 23 7.182 -1.347 16.118
172 H LYS 24 H LYS 24 3.864 4.788 11.857
173 HA LYS 24 HA LYS 24 1.465 3.539 12.631
174 HB2 LYS 24 2HB LYS 24 2.348 6.390 13.126
175 HB3 LYS 24 1HB LYS 24 1.045 5.565 13.974
176 HG2 LYS 24 2HG LYS 24 2.710 3.892 14.787
177 HG3 LYS 24 1HG LYS 24 3.979 4.868 14.043
178 HD2 LYS 24 2HD LYS 24 3.791 5.350 16.427
179 HD3 LYS 24 1HD LYS 24 3.358 6.765 15.465
180 HE2 LYS 24 2HE LYS 24 1.825 6.412 17.362
181 HE3 LYS 24 1HE LYS 24 0.995 6.312 15.810
182 HZ1 LYS 24 3HZ LYS 24 0.290 4.561 17.315
183 HZ2 LYS 24 1HZ LYS 24 1.878 3.993 17.447
184 HZ3 LYS 24 2HZ LYS 24 1.067 3.903 15.966
185 H PHE 25 H PHE 25 1.923 6.576 10.797
186 HA PHE 25 HA PHE 25 -0.819 6.963 10.211
187 HB2 PHE 25 2HB PHE 25 1.661 7.989 8.816
188 HB3 PHE 25 1HB PHE 25 0.029 8.515 8.422
189 HD1 PHE 25 HD2 PHE 25 2.676 8.593 10.982
190 HD2 PHE 25 HD1 PHE 25 -1.167 10.036 9.840
191 HE1 PHE 25 HE2 PHE 25 2.808 10.322 12.726
192 HE2 PHE 25 HE1 PHE 25 -1.038 11.765 11.585
193 HZ PHE 25 HZ PHE 25 0.951 11.911 13.029
194 H VAL 26 H VAL 26 1.793 5.410 8.358
195 HA VAL 26 HA VAL 26 0.336 4.952 5.998
196 HB VAL 26 HB VAL 26 2.634 3.325 7.108
197 HG11 VAL 26 1HG1 VAL 26 1.509 3.447 4.304
198 HG12 VAL 26 2HG1 VAL 26 1.429 2.070 5.403
199 HG13 VAL 26 3HG1 VAL 26 2.986 2.607 4.775
200 HG21 VAL 26 3HG2 VAL 26 3.186 5.698 6.799
201 HG22 VAL 26 1HG2 VAL 26 2.633 5.611 5.127
202 HG23 VAL 26 2HG2 VAL 26 4.043 4.680 5.639
203 H LEU 27 H LEU 27 0.931 2.699 8.727
204 HA LEU 27 HA LEU 27 -0.717 0.627 7.774
205 HB2 LEU 27 2HB LEU 27 -0.001 1.346 10.624
206 HB3 LEU 27 1HB LEU 27 -0.768 -0.156 10.140
207 HG LEU 27 HG LEU 27 2.010 0.765 9.363
208 HD11 LEU 27 1HD1 LEU 27 1.115 -1.505 11.142
209 HD12 LEU 27 2HD1 LEU 27 1.831 0.014 11.684
210 HD13 LEU 27 3HD1 LEU 27 2.781 -1.107 10.711
211 HD21 LEU 27 3HD2 LEU 27 0.525 -1.760 8.621
212 HD22 LEU 27 1HD2 LEU 27 2.238 -1.460 8.320
213 HD23 LEU 27 2HD2 LEU 27 1.017 -0.468 7.527
214 H ALA 28 H ALA 28 -1.458 3.474 9.751
215 HA ALA 28 HA ALA 28 -4.123 2.894 10.395
216 HB1 ALA 28 3HB ALA 28 -2.891 4.754 11.390
217 HB2 ALA 28 1HB ALA 28 -4.404 5.313 10.679
218 HB3 ALA 28 2HB ALA 28 -2.878 5.591 9.837
219 H ALA 29 H ALA 29 -2.799 4.574 7.532
220 HA ALA 29 HA ALA 29 -5.288 4.951 6.220
221 HB1 ALA 29 3HB ALA 29 -2.525 4.718 5.012
222 HB2 ALA 29 1HB ALA 29 -3.257 6.201 5.626
223 HB3 ALA 29 2HB ALA 29 -3.953 5.392 4.223
224 H LEU 30 H LEU 30 -2.852 2.407 6.071
225 HA LEU 30 HA LEU 30 -3.815 0.864 3.971
226 HB2 LEU 30 2HB LEU 30 -1.625 0.599 5.095
227 HB3 LEU 30 1HB LEU 30 -2.437 -0.066 6.498
228 HG LEU 30 HG LEU 30 -3.153 -2.013 5.177
229 HD11 LEU 30 1HD1 LEU 30 -3.334 -0.951 2.986
230 HD12 LEU 30 2HD1 LEU 30 -2.273 -2.357 2.911
231 HD13 LEU 30 3HD1 LEU 30 -1.585 -0.733 2.932
232 HD21 LEU 30 3HD2 LEU 30 -0.945 -3.032 4.908
233 HD22 LEU 30 1HD2 LEU 30 -1.020 -2.073 6.386
234 HD23 LEU 30 2HD2 LEU 30 -0.191 -1.439 4.964
235 H GLU 31 H GLU 31 -4.451 0.354 7.466
236 HA GLU 31 HA GLU 31 -6.257 -1.770 7.139
237 HB2 GLU 31 2HB GLU 31 -6.930 -1.348 9.460
238 HB3 GLU 31 1HB GLU 31 -5.181 -1.296 9.278
239 HG2 GLU 31 2HG GLU 31 -5.255 1.155 9.282
240 HG3 GLU 31 1HG GLU 31 -7.006 1.099 9.470
241 H GLN 32 H GLN 32 -6.868 1.730 7.352
242 HA GLN 32 HA GLN 32 -9.703 1.537 7.298
243 HB2 GLN 32 2HB GLN 32 -7.865 3.823 6.555
244 HB3 GLN 32 1HB GLN 32 -9.613 3.964 6.678
245 HG2 GLN 32 2HG GLN 32 -9.489 3.325 9.047
246 HG3 GLN 32 1HG GLN 32 -7.736 3.215 8.917
247 HE21 GLN 32 1HE2 GLN 32 -6.534 5.125 8.676
248 HE22 GLN 32 2HE2 GLN 32 -7.198 6.670 9.078
249 H SER 33 H SER 33 -7.283 1.461 4.788
250 HA SER 33 HA SER 33 -9.267 1.771 2.659
251 HB2 SER 33 2HB SER 33 -7.076 2.841 2.369
252 HB3 SER 33 1HB SER 33 -6.277 1.278 2.516
253 HG SER 33 HG SER 33 -7.571 0.656 0.624
254 H SER 34 H SER 34 -8.695 -0.679 4.629
255 HA SER 34 HA SER 34 -8.301 -2.817 2.681
256 HB2 SER 34 2HB SER 34 -8.679 -2.927 5.685
257 HB3 SER 34 1HB SER 34 -8.341 -4.318 4.657
258 HG SER 34 HG SER 34 -6.625 -2.095 4.571
259 H ASP 35 H ASP 35 -9.780 -4.431 2.199
260 HA ASP 35 HA ASP 35 -12.573 -3.916 2.580
261 HB2 ASP 35 2HB ASP 35 -11.104 -6.332 1.496
262 HB3 ASP 35 1HB ASP 35 -12.856 -6.154 1.487
263 H ASP 36 H ASP 36 -13.889 -6.050 3.291
264 HA ASP 36 HA ASP 36 -13.845 -6.033 6.048
265 HB2 ASP 36 2HB ASP 36 -15.770 -6.703 4.663
266 HB3 ASP 36 1HB ASP 36 -14.957 -8.214 4.272
267 H ALA 37 H ALA 37 -12.161 -8.312 3.911
268 HA ALA 37 HA ALA 37 -11.525 -10.139 6.061
269 HB1 ALA 37 3HB ALA 37 -11.916 -10.939 3.779
270 HB2 ALA 37 1HB ALA 37 -10.329 -11.420 4.385
271 HB3 ALA 37 2HB ALA 37 -10.469 -10.088 3.238
272 H GLY 38 H GLY 38 -10.195 -7.181 5.264
273 HA2 GLY 38 2HA GLY 38 -8.386 -6.199 6.397
274 HA3 GLY 38 1HA GLY 38 -7.813 -7.796 6.837
275 H TRP 39 H TRP 39 -8.549 -6.602 3.586
276 HA TRP 39 HA TRP 39 -5.672 -6.439 2.969
277 HB2 TRP 39 2HB TRP 39 -7.783 -7.882 1.351
278 HB3 TRP 39 1HB TRP 39 -6.242 -7.384 0.667
279 HD1 TRP 39 HD1 TRP 39 -7.803 -10.012 2.923
280 HE1 TRP 39 HE1 TRP 39 -6.049 -11.832 3.408
281 HE3 TRP 39 HE3 TRP 39 -3.680 -7.716 0.952
282 HZ2 TRP 39 HZ2 TRP 39 -3.283 -12.239 3.010
283 HZ3 TRP 39 HZ3 TRP 39 -1.515 -8.887 1.045
284 HH2 TRP 39 HH2 TRP 39 -1.323 -11.103 2.054
285 H ALA 40 H ALA 40 -5.110 -4.603 1.919
286 HA ALA 40 HA ALA 40 -7.282 -2.868 0.924
287 HB1 ALA 40 3HB ALA 40 -5.784 -0.992 1.338
288 HB2 ALA 40 1HB ALA 40 -4.501 -2.103 1.824
289 HB3 ALA 40 2HB ALA 40 -5.968 -1.970 2.794
290 H ASN 41 H ASN 41 -7.427 -2.492 -1.197
291 HA ASN 41 HA ASN 41 -5.599 -3.553 -3.090
292 HB2 ASN 41 2HB ASN 41 -8.030 -3.195 -3.510
293 HB3 ASN 41 1HB ASN 41 -7.752 -1.458 -3.519
294 HD21 ASN 41 1HD2 ASN 41 -8.733 -3.359 -5.585
295 HD22 ASN 41 2HD2 ASN 41 -7.734 -3.062 -6.961
296 H LEU 42 H LEU 42 -3.880 -2.682 -4.098
297 HA LEU 42 HA LEU 42 -2.295 -0.740 -3.063
298 HB2 LEU 42 2HB LEU 42 -1.558 -2.315 -4.753
299 HB3 LEU 42 1HB LEU 42 -2.551 -1.529 -5.966
300 HG LEU 42 HG LEU 42 -1.143 0.523 -5.717
301 HD11 LEU 42 1HD1 LEU 42 -0.310 0.179 -3.468
302 HD12 LEU 42 2HD1 LEU 42 1.033 0.324 -4.600
303 HD13 LEU 42 3HD1 LEU 42 0.567 -1.263 -3.985
304 HD21 LEU 42 3HD2 LEU 42 0.798 -0.374 -6.934
305 HD22 LEU 42 1HD2 LEU 42 -0.725 -1.027 -7.536
306 HD23 LEU 42 2HD2 LEU 42 0.306 -2.011 -6.497
307 H GLY 43 H GLY 43 -4.613 -0.185 -5.736
308 HA2 GLY 43 2HA GLY 43 -4.037 2.515 -6.203
309 HA3 GLY 43 1HA GLY 43 -5.580 1.746 -6.535
310 H ASN 44 H ASN 44 -6.608 1.177 -4.131
311 HA ASN 44 HA ASN 44 -7.515 3.690 -3.190
312 HB2 ASN 44 2HB ASN 44 -7.845 0.930 -1.978
313 HB3 ASN 44 1HB ASN 44 -8.726 2.368 -1.465
314 HD21 ASN 44 1HD2 ASN 44 -9.777 -0.116 -2.569
315 HD22 ASN 44 2HD2 ASN 44 -10.650 0.325 -3.993
316 H PHE 45 H PHE 45 -5.092 1.433 -1.994
317 HA PHE 45 HA PHE 45 -4.588 2.640 0.502
318 HB2 PHE 45 2HB PHE 45 -3.714 0.444 0.068
319 HB3 PHE 45 1HB PHE 45 -2.814 1.014 -1.333
320 HD1 PHE 45 HD1 PHE 45 -3.095 1.962 2.280
321 HD2 PHE 45 HD2 PHE 45 -0.543 1.109 -1.022
322 HE1 PHE 45 HE1 PHE 45 -1.127 2.330 3.710
323 HE2 PHE 45 HE2 PHE 45 1.428 1.470 0.406
324 HZ PHE 45 HZ PHE 45 1.138 2.082 2.773
325 H GLY 46 H GLY 46 -2.842 3.041 -2.609
326 HA2 GLY 46 2HA GLY 46 -1.145 5.120 -1.795
327 HA3 GLY 46 1HA GLY 46 -1.645 4.819 -3.451
328 H ASN 47 H ASN 47 -4.507 5.196 -2.676
329 HA ASN 47 HA ASN 47 -4.684 8.032 -3.070
330 HB2 ASN 47 2HB ASN 47 -6.272 6.326 -4.023
331 HB3 ASN 47 1HB ASN 47 -6.904 6.078 -2.400
332 HD21 ASN 47 1HD2 ASN 47 -8.335 6.939 -4.699
333 HD22 ASN 47 2HD2 ASN 47 -8.964 8.511 -4.353
334 H TYR 48 H TYR 48 -5.924 5.897 -0.469
335 HA TYR 48 HA TYR 48 -6.717 8.040 1.205
336 HB2 TYR 48 2HB TYR 48 -7.574 5.617 1.200
337 HB3 TYR 48 1HB TYR 48 -6.159 5.235 2.172
338 HD1 TYR 48 HD2 TYR 48 -9.244 7.287 2.082
339 HD2 TYR 48 HD1 TYR 48 -6.153 5.672 4.518
340 HE1 TYR 48 HE2 TYR 48 -10.476 7.978 4.090
341 HE2 TYR 48 HE1 TYR 48 -7.378 6.361 6.532
342 HH TYR 48 HH TYR 48 -10.607 7.317 6.485
343 H LEU 49 H LEU 49 -3.753 6.161 0.997
344 HA LEU 49 HA LEU 49 -2.526 6.917 3.390
345 HB2 LEU 49 2HB LEU 49 -1.594 5.185 1.973
346 HB3 LEU 49 1HB LEU 49 -1.305 6.340 0.686
347 HG LEU 49 HG LEU 49 0.388 7.475 2.079
348 HD11 LEU 49 1HD1 LEU 49 -0.126 5.257 4.061
349 HD12 LEU 49 2HD1 LEU 49 -0.540 6.958 4.279
350 HD13 LEU 49 3HD1 LEU 49 1.151 6.472 4.164
351 HD21 LEU 49 3HD2 LEU 49 0.855 4.501 1.822
352 HD22 LEU 49 1HD2 LEU 49 2.097 5.744 1.973
353 HD23 LEU 49 2HD2 LEU 49 1.072 5.694 0.540
354 H ASN 50 H ASN 50 -2.471 8.543 0.220
355 HA ASN 50 HA ASN 50 -0.745 10.642 0.996
356 HB2 ASN 50 2HB ASN 50 -1.231 9.974 -1.367
357 HB3 ASN 50 1HB ASN 50 -2.823 10.709 -1.207
358 HD21 ASN 50 1HD2 ASN 50 0.609 11.319 -1.318
359 HD22 ASN 50 2HD2 ASN 50 0.494 13.005 -1.659
360 H LYS 51 H LYS 51 -4.177 10.168 1.399
361 HA LYS 51 HA LYS 51 -4.916 12.837 1.973
362 HB2 LYS 51 2HB LYS 51 -6.107 10.276 3.078
363 HB3 LYS 51 1HB LYS 51 -6.870 11.861 3.108
364 HG2 LYS 51 2HG LYS 51 -6.936 11.864 0.643
365 HG3 LYS 51 1HG LYS 51 -6.198 10.260 0.633
366 HD2 LYS 51 2HD LYS 51 -8.591 10.037 0.344
367 HD3 LYS 51 1HD LYS 51 -8.135 9.397 1.922
368 HE2 LYS 51 2HE LYS 51 -8.828 11.538 2.956
369 HE3 LYS 51 1HE LYS 51 -9.352 12.110 1.374
370 HZ1 LYS 51 3HZ LYS 51 -11.235 11.291 2.551
371 HZ2 LYS 51 1HZ LYS 51 -10.478 9.826 2.904
372 HZ3 LYS 51 2HZ LYS 51 -10.905 10.194 1.311
373 H LEU 52 H LEU 52 -3.632 10.240 4.021
374 HA LEU 52 HA LEU 52 -3.748 11.886 6.410
375 HB2 LEU 52 2HB LEU 52 -2.450 9.188 5.996
376 HB3 LEU 52 1HB LEU 52 -2.734 9.971 7.539
377 HG LEU 52 HG LEU 52 -4.798 8.829 5.653
378 HD11 LEU 52 1HD1 LEU 52 -4.073 8.159 8.508
379 HD12 LEU 52 2HD1 LEU 52 -3.681 7.202 7.081
380 HD13 LEU 52 3HD1 LEU 52 -5.361 7.408 7.566
381 HD21 LEU 52 3HD2 LEU 52 -6.505 9.588 7.237
382 HD22 LEU 52 1HD2 LEU 52 -5.642 10.946 6.519
383 HD23 LEU 52 2HD2 LEU 52 -5.270 10.438 8.166
384 H GLN 53 H GLN 53 -1.248 10.642 4.225
385 HA GLN 53 HA GLN 53 0.661 12.580 5.369
386 HB2 GLN 53 2HB GLN 53 1.173 9.718 4.551
387 HB3 GLN 53 1HB GLN 53 2.470 10.885 4.743
388 HG2 GLN 53 2HG GLN 53 0.536 10.031 6.896
389 HG3 GLN 53 1HG GLN 53 2.197 9.468 6.716
390 HE21 GLN 53 1HE2 GLN 53 0.161 12.108 7.666
391 HE22 GLN 53 2HE2 GLN 53 1.395 13.060 8.403
392 HA PRO 54 HA PRO 54 0.514 13.536 0.839
393 HB2 PRO 54 2HB PRO 54 0.819 16.221 1.169
394 HB3 PRO 54 1HB PRO 54 -0.754 15.421 1.243
395 HG2 PRO 54 2HG PRO 54 1.027 16.301 3.489
396 HG3 PRO 54 1HG PRO 54 -0.732 16.471 3.323
397 HD2 PRO 54 2HD PRO 54 0.414 14.525 4.832
398 HD3 PRO 54 1HD PRO 54 -1.130 14.293 3.987
399 H ASP 55 H ASP 55 2.665 14.215 3.460
400 HA ASP 55 HA ASP 55 4.876 15.182 1.897
401 HB2 ASP 55 2HB ASP 55 4.553 15.916 4.198
402 HB3 ASP 55 1HB ASP 55 4.659 14.258 4.776
403 H PHE 56 H PHE 56 3.597 12.095 2.447
404 HA PHE 56 HA PHE 56 6.102 10.662 2.613
405 HB2 PHE 56 2HB PHE 56 4.020 9.892 3.736
406 HB3 PHE 56 1HB PHE 56 3.296 9.608 2.159
407 HD1 PHE 56 HD1 PHE 56 6.105 8.573 4.363
408 HD2 PHE 56 HD2 PHE 56 3.614 7.568 1.057
409 HE1 PHE 56 HE1 PHE 56 7.023 6.290 4.369
410 HE2 PHE 56 HE2 PHE 56 4.534 5.286 1.055
411 HZ PHE 56 HZ PHE 56 6.238 4.642 2.712
412 H ASP 57 H ASP 57 7.334 10.860 0.815
413 HA ASP 57 HA ASP 57 6.122 10.207 -1.804
414 HB2 ASP 57 2HB ASP 57 6.786 12.526 -1.772
415 HB3 ASP 57 1HB ASP 57 8.377 12.116 -1.137
416 H SER 58 H SER 58 7.076 8.691 -3.070
417 HA SER 58 HA SER 58 8.758 6.782 -1.799
418 HB2 SER 58 2HB SER 58 7.890 6.984 -4.693
419 HB3 SER 58 1HB SER 58 8.673 5.579 -3.969
420 HG SER 58 HG SER 58 6.211 6.698 -3.081
421 H ARG 59 H ARG 59 9.459 9.413 -4.040
422 HA ARG 59 HA ARG 59 12.050 8.439 -4.794
423 HB2 ARG 59 2HB ARG 59 10.985 11.272 -4.908
424 HB3 ARG 59 1HB ARG 59 12.434 10.685 -5.712
425 HG2 ARG 59 2HG ARG 59 9.605 9.808 -6.273
426 HG3 ARG 59 1HG ARG 59 10.592 10.871 -7.277
427 HD2 ARG 59 2HD ARG 59 11.139 7.965 -6.658
428 HD3 ARG 59 1HD ARG 59 10.564 8.618 -8.190
429 HE ARG 59 HE ARG 59 13.261 8.941 -7.069
430 HH11 ARG 59 1HH1 ARG 59 11.075 9.247 -9.720
431 HH12 ARG 59 2HH1 ARG 59 12.331 9.606 -10.852
432 HH21 ARG 59 1HH2 ARG 59 14.867 9.337 -8.539
433 HH22 ARG 59 2HH2 ARG 59 14.460 9.636 -10.197
434 H LEU 60 H LEU 60 10.827 10.215 -2.071
435 HA LEU 60 HA LEU 60 13.272 11.194 -1.037
436 HB2 LEU 60 2HB LEU 60 10.793 10.271 0.433
437 HB3 LEU 60 1HB LEU 60 12.109 11.169 1.161
438 HG LEU 60 HG LEU 60 10.279 12.184 -1.021
439 HD11 LEU 60 1HD1 LEU 60 9.449 13.710 0.715
440 HD12 LEU 60 2HD1 LEU 60 10.459 12.893 1.907
441 HD13 LEU 60 3HD1 LEU 60 9.144 12.021 1.118
442 HD21 LEU 60 3HD2 LEU 60 11.388 14.339 -0.684
443 HD22 LEU 60 1HD2 LEU 60 12.530 13.112 -1.231
444 HD23 LEU 60 2HD2 LEU 60 12.500 13.592 0.464
445 H TYR 61 H TYR 61 11.922 8.016 -1.202
446 HA TYR 61 HA TYR 61 13.980 6.954 0.615
447 HB2 TYR 61 2HB TYR 61 11.547 5.580 -0.553
448 HB3 TYR 61 1HB TYR 61 12.662 4.879 0.616
449 HD1 TYR 61 HD2 TYR 61 12.633 5.604 2.956
450 HD2 TYR 61 HD1 TYR 61 9.928 7.273 0.125
451 HE1 TYR 61 HE2 TYR 61 11.289 6.537 4.791
452 HE2 TYR 61 HE1 TYR 61 8.584 8.213 1.956
453 HH TYR 61 HH TYR 61 9.683 8.248 5.221
454 H GLY 62 H GLY 62 13.289 7.325 -2.696
455 HA2 GLY 62 2HA GLY 62 15.014 6.982 -4.311
456 HA3 GLY 62 1HA GLY 62 15.632 5.662 -3.339
457 H TYR 63 H TYR 63 12.226 5.651 -3.820
458 HA TYR 63 HA TYR 63 12.531 3.377 -5.669
459 HB2 TYR 63 2HB TYR 63 10.279 4.135 -3.798
460 HB3 TYR 63 1HB TYR 63 10.190 2.801 -4.947
461 HD1 TYR 63 HD1 TYR 63 12.042 4.058 -1.981
462 HD2 TYR 63 HD2 TYR 63 11.135 0.695 -4.431
463 HE1 TYR 63 HE1 TYR 63 13.103 2.580 -0.331
464 HE2 TYR 63 HE2 TYR 63 12.191 -0.792 -2.788
465 HH TYR 63 HH TYR 63 13.969 -0.576 -0.972
466 H LYS 64 H LYS 64 11.352 3.196 -7.552
467 HA LYS 64 HA LYS 64 10.806 5.527 -9.014
468 HB2 LYS 64 2HB LYS 64 9.851 2.697 -9.518
469 HB3 LYS 64 1HB LYS 64 9.811 4.001 -10.697
470 HG2 LYS 64 2HG LYS 64 12.313 2.878 -9.439
471 HG3 LYS 64 1HG LYS 64 11.695 2.456 -11.038
472 HD2 LYS 64 2HD LYS 64 11.885 4.864 -11.675
473 HD3 LYS 64 1HD LYS 64 12.655 5.172 -10.116
474 HE2 LYS 64 2HE LYS 64 14.321 4.913 -11.889
475 HE3 LYS 64 1HE LYS 64 14.459 3.620 -10.697
476 HZ1 LYS 64 3HZ LYS 64 14.618 2.779 -12.965
477 HZ2 LYS 64 1HZ LYS 64 13.084 3.397 -13.323
478 HZ3 LYS 64 2HZ LYS 64 13.251 2.155 -12.189
479 H LYS 65 H LYS 65 8.647 3.381 -7.220
480 HA LYS 65 HA LYS 65 6.578 5.402 -7.152
481 HB2 LYS 65 2HB LYS 65 4.821 3.952 -8.103
482 HB3 LYS 65 1HB LYS 65 6.064 4.331 -9.288
483 HG2 LYS 65 2HG LYS 65 7.061 2.135 -9.001
484 HG3 LYS 65 1HG LYS 65 5.904 1.754 -7.725
485 HD2 LYS 65 2HD LYS 65 5.159 0.694 -9.750
486 HD3 LYS 65 1HD LYS 65 4.062 2.027 -9.389
487 HE2 LYS 65 2HE LYS 65 5.239 3.425 -11.041
488 HE3 LYS 65 1HE LYS 65 6.321 2.078 -11.398
489 HZ1 LYS 65 3HZ LYS 65 4.592 2.173 -13.035
490 HZ2 LYS 65 1HZ LYS 65 3.387 2.151 -11.849
491 HZ3 LYS 65 2HZ LYS 65 4.360 0.791 -12.092
492 H LEU 66 H LEU 66 4.897 4.936 -5.624
493 HA LEU 66 HA LEU 66 5.621 3.804 -3.233
494 HB2 LEU 66 2HB LEU 66 3.694 5.280 -3.493
495 HB3 LEU 66 1HB LEU 66 2.832 4.035 -4.379
496 HG LEU 66 HG LEU 66 2.818 2.620 -2.340
497 HD11 LEU 66 1HD1 LEU 66 3.404 3.620 -0.177
498 HD12 LEU 66 2HD1 LEU 66 4.032 5.043 -1.012
499 HD13 LEU 66 3HD1 LEU 66 4.804 3.474 -1.240
500 HD21 LEU 66 3HD2 LEU 66 0.899 4.031 -2.852
501 HD22 LEU 66 1HD2 LEU 66 1.636 5.376 -1.979
502 HD23 LEU 66 2HD2 LEU 66 1.146 3.920 -1.111
503 H SER 67 H SER 67 3.909 2.185 -5.884
504 HA SER 67 HA SER 67 3.267 -0.238 -4.726
505 HB2 SER 67 2HB SER 67 2.553 0.250 -6.978
506 HB3 SER 67 1HB SER 67 4.217 0.329 -7.548
507 HG SER 67 HG SER 67 2.654 -1.776 -7.511
508 H ASP 68 H ASP 68 6.370 0.621 -6.284
509 HA ASP 68 HA ASP 68 7.561 -1.928 -5.892
510 HB2 ASP 68 2HB ASP 68 8.269 -0.180 -7.589
511 HB3 ASP 68 1HB ASP 68 9.019 0.698 -6.254
512 H LEU 69 H LEU 69 7.525 1.053 -4.032
513 HA LEU 69 HA LEU 69 9.422 0.479 -2.073
514 HB2 LEU 69 2HB LEU 69 8.430 2.668 -2.261
515 HB3 LEU 69 1HB LEU 69 6.836 2.032 -1.906
516 HG LEU 69 HG LEU 69 7.558 1.513 0.399
517 HD11 LEU 69 1HD1 LEU 69 9.683 2.275 1.248
518 HD12 LEU 69 2HD1 LEU 69 10.129 2.910 -0.334
519 HD13 LEU 69 3HD1 LEU 69 9.951 1.170 -0.098
520 HD21 LEU 69 3HD2 LEU 69 7.701 3.822 1.206
521 HD22 LEU 69 1HD2 LEU 69 6.487 3.653 -0.061
522 HD23 LEU 69 2HD2 LEU 69 8.053 4.375 -0.431
523 H VAL 70 H VAL 70 5.941 -0.312 -2.095
524 HA VAL 70 HA VAL 70 5.920 -1.500 0.479
525 HB VAL 70 HB VAL 70 3.999 -1.997 -1.804
526 HG11 VAL 70 1HG1 VAL 70 3.669 -2.380 1.175
527 HG12 VAL 70 2HG1 VAL 70 3.808 -3.657 -0.032
528 HG13 VAL 70 3HG1 VAL 70 2.405 -2.593 -0.036
529 HG21 VAL 70 3HG2 VAL 70 4.195 0.391 -1.308
530 HG22 VAL 70 1HG2 VAL 70 3.880 0.074 0.399
531 HG23 VAL 70 2HG2 VAL 70 2.625 -0.229 -0.803
532 H LYS 71 H LYS 71 6.015 -2.994 -2.780
533 HA LYS 71 HA LYS 71 6.121 -5.667 -1.837
534 HB2 LYS 71 2HB LYS 71 6.928 -6.211 -4.156
535 HB3 LYS 71 1HB LYS 71 5.414 -5.321 -4.076
536 HG2 LYS 71 2HG LYS 71 6.540 -3.266 -4.649
537 HG3 LYS 71 1HG LYS 71 8.105 -4.079 -4.627
538 HD2 LYS 71 2HD LYS 71 5.888 -4.991 -6.448
539 HD3 LYS 71 1HD LYS 71 6.966 -3.671 -6.907
540 HE2 LYS 71 2HE LYS 71 7.871 -6.449 -6.130
541 HE3 LYS 71 1HE LYS 71 7.698 -5.866 -7.787
542 HZ1 LYS 71 3HZ LYS 71 9.983 -5.720 -7.038
543 HZ2 LYS 71 1HZ LYS 71 9.532 -4.738 -5.739
544 HZ3 LYS 71 2HZ LYS 71 9.364 -4.170 -7.322
545 H ALA 72 H ALA 72 8.594 -3.254 -2.146
546 HA ALA 72 HA ALA 72 10.785 -5.133 -1.922
547 HB1 ALA 72 3HB ALA 72 10.757 -2.132 -1.559
548 HB2 ALA 72 1HB ALA 72 11.115 -2.993 -3.057
549 HB3 ALA 72 2HB ALA 72 12.195 -3.149 -1.672
550 H ARG 73 H ARG 73 9.223 -2.770 0.235
551 HA ARG 73 HA ARG 73 10.738 -3.702 2.533
552 HB2 ARG 73 2HB ARG 73 8.578 -1.593 2.288
553 HB3 ARG 73 1HB ARG 73 9.515 -1.913 3.743
554 HG2 ARG 73 2HG ARG 73 10.615 -0.938 1.104
555 HG3 ARG 73 1HG ARG 73 10.373 0.032 2.558
556 HD2 ARG 73 2HD ARG 73 11.981 -1.382 3.760
557 HD3 ARG 73 1HD ARG 73 12.232 -2.337 2.300
558 HE ARG 73 HE ARG 73 12.775 0.282 1.611
559 HH11 ARG 73 1HH1 ARG 73 14.004 -2.030 3.851
560 HH12 ARG 73 2HH1 ARG 73 15.615 -1.406 3.782
561 HH21 ARG 73 1HH2 ARG 73 14.840 1.114 1.571
562 HH22 ARG 73 2HH2 ARG 73 16.074 0.368 2.523
563 H THR 74 H THR 74 9.309 -5.818 1.632
564 HA THR 74 HA THR 74 6.718 -6.197 2.629
565 HB THR 74 HB THR 74 7.193 -8.635 2.520
566 HG1 THR 74 HG1 THR 74 9.199 -9.264 2.656
567 HG21 THR 74 3HG2 THR 74 6.508 -7.459 0.490
568 HG22 THR 74 1HG2 THR 74 7.673 -8.725 0.105
569 HG23 THR 74 2HG2 THR 74 8.186 -7.038 0.148
570 H ASP 75 H ASP 75 9.675 -6.012 4.372
571 HA ASP 75 HA ASP 75 9.073 -7.531 6.647
572 HB2 ASP 75 2HB ASP 75 11.290 -6.575 6.272
573 HB3 ASP 75 1HB ASP 75 10.639 -4.945 6.432
574 H LEU 76 H LEU 76 8.189 -4.217 5.779
575 HA LEU 76 HA LEU 76 6.711 -3.812 8.251
576 HB2 LEU 76 2HB LEU 76 7.076 -2.072 5.805
577 HB3 LEU 76 1HB LEU 76 6.176 -1.587 7.231
578 HG LEU 76 HG LEU 76 9.117 -2.298 7.246
579 HD11 LEU 76 1HD1 LEU 76 9.517 0.112 7.440
580 HD12 LEU 76 2HD1 LEU 76 7.796 0.418 7.204
581 HD13 LEU 76 3HD1 LEU 76 8.752 -0.301 5.906
582 HD21 LEU 76 3HD2 LEU 76 8.015 -2.630 9.400
583 HD22 LEU 76 1HD2 LEU 76 7.357 -0.993 9.330
584 HD23 LEU 76 2HD2 LEU 76 9.100 -1.240 9.459
585 H PHE 77 H PHE 77 6.018 -4.506 4.858
586 HA PHE 77 HA PHE 77 3.124 -4.517 5.481
587 HB2 PHE 77 2HB PHE 77 4.335 -3.791 2.802
588 HB3 PHE 77 1HB PHE 77 2.648 -3.646 3.286
589 HD1 PHE 77 HD1 PHE 77 2.429 -2.204 5.608
590 HD2 PHE 77 HD2 PHE 77 5.475 -1.795 2.655
591 HE1 PHE 77 HE1 PHE 77 2.851 0.100 6.361
592 HE2 PHE 77 HE2 PHE 77 5.895 0.511 3.404
593 HZ PHE 77 HZ PHE 77 4.583 1.459 5.260
594 H VAL 78 H VAL 78 1.979 -6.283 4.889
595 HA VAL 78 HA VAL 78 3.341 -8.532 3.640
596 HB VAL 78 HB VAL 78 0.468 -8.333 4.590
597 HG11 VAL 78 1HG1 VAL 78 0.554 -10.794 4.631
598 HG12 VAL 78 2HG1 VAL 78 2.174 -10.740 3.937
599 HG13 VAL 78 3HG1 VAL 78 0.797 -10.149 3.006
600 HG21 VAL 78 3HG2 VAL 78 2.002 -7.923 6.440
601 HG22 VAL 78 1HG2 VAL 78 2.893 -9.395 6.051
602 HG23 VAL 78 2HG2 VAL 78 1.225 -9.494 6.618
603 H THR 79 H THR 79 3.246 -8.942 1.493
604 HA THR 79 HA THR 79 1.295 -7.400 -0.115
605 HB THR 79 HB THR 79 2.960 -7.277 -1.900
606 HG1 THR 79 HG1 THR 79 4.246 -9.023 -1.755
607 HG21 THR 79 3HG2 THR 79 4.151 -6.460 0.762
608 HG22 THR 79 1HG2 THR 79 3.002 -5.511 -0.183
609 HG23 THR 79 2HG2 THR 79 4.616 -5.831 -0.818
610 H GLU 80 H GLU 80 -0.071 -8.529 -1.350
611 HA GLU 80 HA GLU 80 0.917 -10.901 -2.757
612 HB2 GLU 80 2HB GLU 80 -1.653 -10.838 -1.179
613 HB3 GLU 80 1HB GLU 80 -1.389 -11.966 -2.493
614 HG2 GLU 80 2HG GLU 80 0.637 -12.781 -1.217
615 HG3 GLU 80 1HG GLU 80 0.040 -11.826 0.144
616 H GLU 81 H GLU 81 0.184 -11.108 -4.826
617 HA GLU 81 HA GLU 81 -1.702 -9.139 -5.861
618 HB2 GLU 81 2HB GLU 81 -0.371 -11.481 -7.264
619 HB3 GLU 81 1HB GLU 81 -1.324 -10.226 -8.041
620 HG2 GLU 81 2HG GLU 81 0.366 -8.561 -7.288
621 HG3 GLU 81 1HG GLU 81 1.344 -9.897 -6.681
622 H ARG 82 H ARG 82 -3.860 -9.510 -5.818
623 HA ARG 82 HA ARG 82 -4.794 -12.313 -5.622
624 HB2 ARG 82 2HB ARG 82 -6.222 -9.873 -4.537
625 HB3 ARG 82 1HB ARG 82 -6.657 -11.558 -4.280
626 HG2 ARG 82 2HG ARG 82 -4.135 -10.244 -3.267
627 HG3 ARG 82 1HG ARG 82 -5.593 -10.516 -2.313
628 HD2 ARG 82 2HD ARG 82 -3.954 -12.703 -3.611
629 HD3 ARG 82 1HD ARG 82 -3.812 -12.209 -1.925
630 HE ARG 82 HE ARG 82 -6.455 -13.029 -2.816
631 HH11 ARG 82 1HH1 ARG 82 -3.529 -13.929 -1.188
632 HH12 ARG 82 2HH1 ARG 82 -4.278 -15.264 -0.392
633 HH21 ARG 82 1HH2 ARG 82 -7.368 -14.748 -1.771
634 HH22 ARG 82 2HH2 ARG 82 -6.404 -15.721 -0.709
635 H GLN 83 H GLN 83 -6.473 -12.960 -6.951
636 HA GLN 83 HA GLN 83 -6.866 -11.352 -9.320
637 HB2 GLN 83 2HB GLN 83 -6.566 -13.808 -9.443
638 HB3 GLN 83 1HB GLN 83 -8.076 -14.029 -8.569
639 HG2 GLN 83 2HG GLN 83 -9.263 -12.888 -10.426
640 HG3 GLN 83 1HG GLN 83 -7.739 -12.814 -11.310
641 HE21 GLN 83 1HE2 GLN 83 -8.485 -14.103 -12.984
642 HE22 GLN 83 2HE2 GLN 83 -8.779 -15.793 -12.800
643 H VAL 84 H VAL 84 -8.622 -10.153 -9.852
644 HA VAL 84 HA VAL 84 -10.661 -9.764 -7.806
645 HB VAL 84 HB VAL 84 -10.236 -8.275 -10.412
646 HG11 VAL 84 1HG1 VAL 84 -12.529 -8.077 -9.586
647 HG12 VAL 84 2HG1 VAL 84 -11.668 -6.547 -9.431
648 HG13 VAL 84 3HG1 VAL 84 -11.927 -7.559 -8.009
649 HG21 VAL 84 3HG2 VAL 84 -9.206 -6.524 -9.032
650 HG22 VAL 84 1HG2 VAL 84 -8.313 -8.042 -8.923
651 HG23 VAL 84 2HG2 VAL 84 -9.377 -7.549 -7.605
652 HA PRO 85 HA PRO 85 -13.452 -12.654 -9.746
653 HB2 PRO 85 2HB PRO 85 -15.777 -11.568 -8.638
654 HB3 PRO 85 1HB PRO 85 -14.745 -12.786 -7.879
655 HG2 PRO 85 2HG PRO 85 -14.794 -9.818 -7.477
656 HG3 PRO 85 1HG PRO 85 -14.586 -11.111 -6.279
657 HD2 PRO 85 2HD PRO 85 -12.489 -9.698 -7.135
658 HD3 PRO 85 1HD PRO 85 -12.343 -11.446 -6.848
659 H GLY 86 H GLY 86 -13.728 -12.397 -11.892
660 HA2 GLY 86 2HA GLY 86 -15.159 -11.856 -13.692
661 HA3 GLY 86 1HA GLY 86 -15.752 -10.473 -12.791
662 H SER 87 H SER 87 -12.510 -10.248 -12.456
663 HA SER 87 HA SER 87 -12.280 -8.417 -14.759
664 HB2 SER 87 2HB SER 87 -10.656 -8.553 -12.198
665 HB3 SER 87 1HB SER 87 -10.358 -7.422 -13.514
666 HG SER 87 HG SER 87 -12.933 -7.548 -12.391
667 H THR 88 H THR 88 -10.368 -8.387 -16.063
668 HA THR 88 HA THR 88 -9.274 -11.025 -16.534
669 HB THR 88 HB THR 88 -9.829 -9.628 -18.458
670 HG1 THR 88 HG1 THR 88 -7.935 -10.015 -19.600
671 HG21 THR 88 3HG2 THR 88 -8.480 -7.651 -19.029
672 HG22 THR 88 1HG2 THR 88 -7.642 -7.782 -17.483
673 HG23 THR 88 2HG2 THR 88 -9.367 -7.416 -17.522
674 H GLN 89 H GLN 89 -8.093 -7.993 -15.173
675 HA GLN 89 HA GLN 89 -5.398 -9.105 -14.871
676 HB2 GLN 89 2HB GLN 89 -4.732 -6.874 -14.154
677 HB3 GLN 89 1HB GLN 89 -5.602 -6.791 -15.678
678 HG2 GLN 89 2HG GLN 89 -7.565 -5.955 -14.610
679 HG3 GLN 89 1HG GLN 89 -6.895 -6.266 -13.009
680 HE21 GLN 89 1HE2 GLN 89 -7.883 -3.774 -14.168
681 HE22 GLN 89 2HE2 GLN 89 -6.571 -2.654 -14.074
682 H LYS 90 H LYS 90 -4.308 -9.072 -12.807
683 HA LYS 90 HA LYS 90 -6.107 -9.467 -10.512
684 HB2 LYS 90 2HB LYS 90 -4.108 -10.404 -9.379
685 HB3 LYS 90 1HB LYS 90 -4.506 -11.248 -10.870
686 HG2 LYS 90 2HG LYS 90 -2.711 -10.168 -12.041
687 HG3 LYS 90 1HG LYS 90 -2.386 -9.117 -10.661
688 HD2 LYS 90 2HD LYS 90 -0.751 -10.906 -10.745
689 HD3 LYS 90 1HD LYS 90 -1.773 -11.084 -9.320
690 HE2 LYS 90 2HE LYS 90 -3.098 -12.794 -10.503
691 HE3 LYS 90 1HE LYS 90 -2.038 -12.629 -11.905
692 HZ1 LYS 90 3HZ LYS 90 -0.181 -13.371 -10.558
693 HZ2 LYS 90 1HZ LYS 90 -1.426 -14.517 -10.511
694 HZ3 LYS 90 2HZ LYS 90 -1.174 -13.492 -9.193
695 H ALA 91 H ALA 91 -5.791 -8.352 -8.527
696 HA ALA 91 HA ALA 91 -4.407 -5.760 -8.845
697 HB1 ALA 91 3HB ALA 91 -6.839 -5.588 -8.578
698 HB2 ALA 91 1HB ALA 91 -5.984 -4.854 -7.220
699 HB3 ALA 91 2HB ALA 91 -6.732 -6.442 -7.038
700 H LEU 92 H LEU 92 -2.971 -5.057 -7.317
701 HA LEU 92 HA LEU 92 -1.854 -7.033 -5.537
702 HB2 LEU 92 2HB LEU 92 -0.438 -5.455 -6.793
703 HB3 LEU 92 1HB LEU 92 -1.152 -4.116 -5.913
704 HG LEU 92 HG LEU 92 -0.210 -5.129 -3.791
705 HD11 LEU 92 1HD1 LEU 92 1.611 -6.737 -4.005
706 HD12 LEU 92 2HD1 LEU 92 1.322 -6.851 -5.743
707 HD13 LEU 92 3HD1 LEU 92 0.095 -7.410 -4.605
708 HD21 LEU 92 3HD2 LEU 92 2.068 -4.299 -4.207
709 HD22 LEU 92 1HD2 LEU 92 0.846 -3.222 -4.882
710 HD23 LEU 92 2HD2 LEU 92 1.749 -4.302 -5.943
711 H TYR 93 H TYR 93 -2.804 -7.465 -3.627
712 HA TYR 93 HA TYR 93 -4.041 -5.280 -2.095
713 HB2 TYR 93 2HB TYR 93 -4.296 -8.281 -1.880
714 HB3 TYR 93 1HB TYR 93 -4.906 -7.193 -0.639
715 HD1 TYR 93 HD1 TYR 93 -5.130 -7.744 -4.339
716 HD2 TYR 93 HD2 TYR 93 -7.107 -6.475 -0.788
717 HE1 TYR 93 HE1 TYR 93 -7.226 -7.496 -5.601
718 HE2 TYR 93 HE2 TYR 93 -9.202 -6.217 -2.041
719 HH TYR 93 HH TYR 93 -10.021 -5.960 -4.232
720 H LEU 94 H LEU 94 -3.435 -4.769 -0.028
721 HA LEU 94 HA LEU 94 -0.861 -5.873 0.926
722 HB2 LEU 94 2HB LEU 94 -1.681 -2.963 1.039
723 HB3 LEU 94 1HB LEU 94 -0.108 -3.639 1.425
724 HG LEU 94 HG LEU 94 -1.331 -3.592 -1.345
725 HD11 LEU 94 1HD1 LEU 94 0.341 -1.853 -1.832
726 HD12 LEU 94 2HD1 LEU 94 0.773 -1.809 -0.122
727 HD13 LEU 94 3HD1 LEU 94 -0.846 -1.339 -0.637
728 HD21 LEU 94 3HD2 LEU 94 1.449 -4.331 -0.423
729 HD22 LEU 94 1HD2 LEU 94 0.916 -4.210 -2.100
730 HD23 LEU 94 2HD2 LEU 94 0.223 -5.438 -1.042
731 H ARG 95 H ARG 95 -0.637 -6.040 3.192
732 HA ARG 95 HA ARG 95 -2.584 -4.681 4.893
733 HB2 ARG 95 2HB ARG 95 -3.287 -6.614 6.109
734 HB3 ARG 95 1HB ARG 95 -3.559 -6.926 4.402
735 HG2 ARG 95 2HG ARG 95 -1.492 -8.276 4.343
736 HG3 ARG 95 1HG ARG 95 -1.291 -8.001 6.076
737 HD2 ARG 95 2HD ARG 95 -3.441 -9.560 4.659
738 HD3 ARG 95 1HD ARG 95 -2.321 -10.119 5.901
739 HE ARG 95 HE ARG 95 -4.512 -8.213 6.426
740 HH11 ARG 95 1HH1 ARG 95 -2.591 -10.924 7.354
741 HH12 ARG 95 2HH1 ARG 95 -3.461 -11.169 8.829
742 HH21 ARG 95 1HH2 ARG 95 -5.608 -8.536 8.317
743 HH22 ARG 95 2HH2 ARG 95 -5.155 -9.831 9.368
744 H ALA 96 H ALA 96 -2.005 -5.087 7.309
745 HA ALA 96 HA ALA 96 0.681 -4.095 7.535
746 HB1 ALA 96 3HB ALA 96 -1.202 -3.159 8.815
747 HB2 ALA 96 1HB ALA 96 0.126 -3.674 9.855
748 HB3 ALA 96 2HB ALA 96 -1.324 -4.668 9.718
749 H LYS 97 H LYS 97 2.480 -5.034 8.341
750 HA LYS 97 HA LYS 97 2.427 -7.852 9.136
751 HB2 LYS 97 2HB LYS 97 4.175 -7.152 7.573
752 HB3 LYS 97 1HB LYS 97 4.722 -5.920 8.702
753 HG2 LYS 97 2HG LYS 97 6.272 -7.582 9.067
754 HG3 LYS 97 1HG LYS 97 5.084 -7.940 10.318
755 HD2 LYS 97 2HD LYS 97 5.666 -10.012 9.285
756 HD3 LYS 97 1HD LYS 97 4.042 -9.596 8.730
757 HE2 LYS 97 2HE LYS 97 5.540 -10.439 6.919
758 HE3 LYS 97 1HE LYS 97 4.907 -8.820 6.615
759 HZ1 LYS 97 3HZ LYS 97 7.610 -9.463 7.664
760 HZ2 LYS 97 1HZ LYS 97 7.001 -7.905 7.424
761 HZ3 LYS 97 2HZ LYS 97 7.252 -8.928 6.100
762 H LEU 98 H LEU 98 2.197 -8.365 11.236
763 HA LEU 98 HA LEU 98 3.226 -6.471 13.263
764 HB2 LEU 98 2HB LEU 98 0.794 -8.256 13.428
765 HB3 LEU 98 1HB LEU 98 1.450 -7.355 14.783
766 HG LEU 98 HG LEU 98 0.305 -6.154 12.251
767 HD11 LEU 98 1HD1 LEU 98 -0.773 -6.187 15.072
768 HD12 LEU 98 2HD1 LEU 98 -1.406 -7.108 13.707
769 HD13 LEU 98 3HD1 LEU 98 -1.490 -5.348 13.695
770 HD21 LEU 98 3HD2 LEU 98 0.561 -3.993 13.401
771 HD22 LEU 98 1HD2 LEU 98 2.117 -4.778 13.119
772 HD23 LEU 98 2HD2 LEU 98 1.395 -4.805 14.728
773 H GLU 99 H GLU 99 4.155 -7.289 15.148
774 HA GLU 99 HA GLU 99 5.690 -9.669 14.900
775 HB2 GLU 99 2HB GLU 99 5.164 -7.865 17.270
776 HB3 GLU 99 1HB GLU 99 6.304 -9.198 17.300
777 HG2 GLU 99 2HG GLU 99 7.645 -8.121 15.582
778 HG3 GLU 99 1HG GLU 99 6.478 -6.801 15.483
779 H HIS 100 H HIS 100 5.763 -11.055 17.100
780 HA HIS 100 HA HIS 100 3.054 -11.810 17.948
781 HB2 HIS 100 2HB HIS 100 3.584 -14.188 17.798
782 HB3 HIS 100 1HB HIS 100 3.765 -13.433 16.219
783 HD1 HIS 100 HD1 HIS 100 5.394 -15.755 18.336
784 HD2 HIS 100 HD2 HIS 100 6.707 -12.731 15.813
785 HE1 HIS 100 HE1 HIS 100 7.796 -16.280 17.854
786 HE2 HIS 100 HE2 HIS 100 8.609 -14.354 16.463
787 H HIS 101 H HIS 101 2.877 -12.342 20.094
788 HA HIS 101 HA HIS 101 4.504 -11.168 21.927
789 HB2 HIS 101 2HB HIS 101 3.432 -12.728 23.627
790 HB3 HIS 101 1HB HIS 101 2.338 -11.800 22.611
791 HD1 HIS 101 HD1 HIS 101 0.858 -13.089 20.962
792 HD2 HIS 101 HD2 HIS 101 3.400 -15.524 23.182
793 HE1 HIS 101 HE1 HIS 101 0.059 -15.437 20.573
794 HE2 HIS 101 HE2 HIS 101 1.532 -16.879 22.008
795 H HIS 102 H HIS 102 6.591 -11.423 22.215
796 HA HIS 102 HA HIS 102 7.682 -14.147 22.588
797 HB2 HIS 102 2HB HIS 102 9.889 -13.138 21.876
798 HB3 HIS 102 1HB HIS 102 8.673 -13.252 20.611
799 HD1 HIS 102 HD1 HIS 102 10.569 -10.771 22.664
800 HD2 HIS 102 HD2 HIS 102 7.752 -10.794 19.612
801 HE1 HIS 102 HE1 HIS 102 10.493 -8.419 21.807
802 HE2 HIS 102 HE2 HIS 102 8.938 -8.506 19.832
803 H HIS 103 H HIS 103 9.320 -14.410 24.229
804 HA HIS 103 HA HIS 103 9.616 -12.271 26.194
805 HB2 HIS 103 2HB HIS 103 8.691 -13.652 28.044
806 HB3 HIS 103 1HB HIS 103 7.477 -13.205 26.850
807 HD1 HIS 103 HD1 HIS 103 8.876 -16.096 28.575
808 HD2 HIS 103 HD2 HIS 103 6.844 -15.401 25.017
809 HE1 HIS 103 HE1 HIS 103 8.048 -18.339 27.820
810 HE2 HIS 103 HE2 HIS 103 6.981 -17.914 25.588
811 H HIS 104 H HIS 104 10.881 -13.083 28.160
812 HA HIS 104 HA HIS 104 13.005 -14.918 27.237
813 HB2 HIS 104 2HB HIS 104 13.146 -12.753 29.355
814 HB3 HIS 104 1HB HIS 104 14.488 -13.761 28.815
815 HD1 HIS 104 HD1 HIS 104 15.390 -13.303 26.370
816 HD2 HIS 104 HD2 HIS 104 12.594 -10.566 27.763
817 HE1 HIS 104 HE1 HIS 104 15.516 -11.352 24.796
818 HE2 HIS 104 HE2 HIS 104 13.692 -9.797 25.553
819 H HIS 105 H HIS 105 12.703 -16.896 28.023
820 HA HIS 105 HA HIS 105 12.405 -18.647 29.425
821 HB2 HIS 105 2HB HIS 105 14.078 -17.428 30.828
822 HB3 HIS 105 1HB HIS 105 12.748 -16.665 31.693
823 HD1 HIS 105 HD1 HIS 105 11.616 -18.010 33.512
824 HD2 HIS 105 HD2 HIS 105 14.386 -20.222 31.346
825 HE1 HIS 105 HE1 HIS 105 11.873 -20.169 34.759
826 HE2 HIS 105 HE2 HIS 105 13.650 -21.427 33.512
Start of MODEL 2
1 H1 MET 1 1H MET 1 55.450 13.774 20.771
2 H2 MET 1 2H MET 1 56.620 12.625 20.359
3 H3 MET 1 3H MET 1 56.499 13.174 21.955
4 HA MET 1 HA MET 1 55.554 10.975 21.725
5 HB2 MET 1 2HB MET 1 53.509 13.159 22.220
6 HB3 MET 1 1HB MET 1 53.309 11.471 22.680
7 HG2 MET 1 2HG MET 1 53.977 12.746 24.601
8 HG3 MET 1 1HG MET 1 55.293 11.669 24.138
9 HE1 MET 1 3HE MET 1 54.029 15.350 24.397
10 HE2 MET 1 1HE MET 1 54.110 15.140 22.647
11 HE3 MET 1 2HE MET 1 55.233 16.230 23.457
12 H ASP 2 H ASP 2 55.260 9.782 19.933
13 HA ASP 2 HA ASP 2 53.688 10.789 17.714
14 HB2 ASP 2 2HB ASP 2 55.853 9.652 17.338
15 HB3 ASP 2 1HB ASP 2 55.175 8.169 18.005
16 H GLN 3 H GLN 3 51.584 10.430 17.508
17 HA GLN 3 HA GLN 3 50.354 8.182 18.968
18 HB2 GLN 3 2HB GLN 3 49.476 10.318 19.658
19 HB3 GLN 3 1HB GLN 3 49.181 10.793 17.990
20 HG2 GLN 3 2HG GLN 3 47.499 9.005 17.799
21 HG3 GLN 3 1HG GLN 3 47.775 8.580 19.487
22 HE21 GLN 3 1HE2 GLN 3 45.363 9.536 18.094
23 HE22 GLN 3 2HE2 GLN 3 44.856 10.943 18.961
24 H LYS 4 H LYS 4 49.522 6.538 17.882
25 HA LYS 4 HA LYS 4 48.509 6.964 15.148
26 HB2 LYS 4 2HB LYS 4 50.218 4.659 16.114
27 HB3 LYS 4 1HB LYS 4 49.264 4.587 14.639
28 HG2 LYS 4 2HG LYS 4 50.519 6.525 13.760
29 HG3 LYS 4 1HG LYS 4 51.515 6.515 15.216
30 HD2 LYS 4 2HD LYS 4 51.255 4.143 13.357
31 HD3 LYS 4 1HD LYS 4 52.517 5.366 13.201
32 HE2 LYS 4 2HE LYS 4 52.053 3.744 15.707
33 HE3 LYS 4 1HE LYS 4 53.200 3.294 14.447
34 HZ1 LYS 4 3HZ LYS 4 54.345 5.402 14.812
35 HZ2 LYS 4 1HZ LYS 4 54.305 4.469 16.221
36 HZ3 LYS 4 2HZ LYS 4 53.266 5.792 16.052
37 H SER 5 H SER 5 46.416 7.148 16.008
38 HA SER 5 HA SER 5 45.280 5.012 17.605
39 HB2 SER 5 2HB SER 5 43.188 6.347 17.462
40 HB3 SER 5 1HB SER 5 44.558 7.300 18.028
41 HG SER 5 HG SER 5 44.295 7.363 15.308
42 H SER 6 H SER 6 42.933 4.306 16.841
43 HA SER 6 HA SER 6 43.267 3.212 14.113
44 HB2 SER 6 2HB SER 6 43.289 1.461 15.788
45 HB3 SER 6 1HB SER 6 41.784 2.059 16.490
46 HG SER 6 HG SER 6 41.674 0.210 14.951
47 H SER 7 H SER 7 41.665 3.306 12.641
48 HA SER 7 HA SER 7 39.725 3.781 11.584
49 HB2 SER 7 2HB SER 7 38.524 3.451 14.344
50 HB3 SER 7 1HB SER 7 37.607 3.500 12.837
51 HG SER 7 HG SER 7 39.388 1.525 13.784
52 HA PRO 8 HA PRO 8 39.291 8.220 12.625
53 HB2 PRO 8 2HB PRO 8 40.862 9.304 10.763
54 HB3 PRO 8 1HB PRO 8 41.557 8.592 12.225
55 HG2 PRO 8 2HG PRO 8 41.478 7.510 9.447
56 HG3 PRO 8 1HG PRO 8 42.724 7.321 10.693
57 HD2 PRO 8 2HD PRO 8 40.661 5.473 10.041
58 HD3 PRO 8 1HD PRO 8 41.781 5.382 11.415
59 H GLN 9 H GLN 9 37.558 9.305 11.771
60 HA GLN 9 HA GLN 9 36.495 8.495 9.174
61 HB2 GLN 9 2HB GLN 9 35.011 8.735 11.174
62 HB3 GLN 9 1HB GLN 9 35.349 10.460 11.174
63 HG2 GLN 9 2HG GLN 9 33.237 10.137 10.132
64 HG3 GLN 9 1HG GLN 9 34.385 10.582 8.870
65 HE21 GLN 9 1HE2 GLN 9 32.418 8.041 10.183
66 HE22 GLN 9 2HE2 GLN 9 32.547 6.972 8.832
67 HA PRO 10 HA PRO 10 38.703 12.081 7.450
68 HB2 PRO 10 2HB PRO 10 38.144 11.485 4.831
69 HB3 PRO 10 1HB PRO 10 39.468 10.755 5.746
70 HG2 PRO 10 2HG PRO 10 36.756 9.657 5.129
71 HG3 PRO 10 1HG PRO 10 38.325 8.832 5.130
72 HD2 PRO 10 2HD PRO 10 36.542 8.610 7.167
73 HD3 PRO 10 1HD PRO 10 38.299 8.523 7.416
74 H ALA 11 H ALA 11 37.923 14.092 7.182
75 HA ALA 11 HA ALA 11 35.195 14.720 7.268
76 HB1 ALA 11 3HB ALA 11 36.986 16.227 8.028
77 HB2 ALA 11 1HB ALA 11 35.870 17.026 6.918
78 HB3 ALA 11 2HB ALA 11 37.453 16.499 6.350
79 H ALA 12 H ALA 12 37.113 13.847 4.564
80 HA ALA 12 HA ALA 12 35.649 15.196 2.519
81 HB1 ALA 12 3HB ALA 12 37.933 14.383 2.179
82 HB2 ALA 12 1HB ALA 12 36.829 13.718 0.974
83 HB3 ALA 12 2HB ALA 12 37.367 12.720 2.325
84 H GLN 13 H GLN 13 34.718 12.681 4.542
85 HA GLN 13 HA GLN 13 33.094 11.226 2.627
86 HB2 GLN 13 2HB GLN 13 33.307 11.057 5.640
87 HB3 GLN 13 1HB GLN 13 32.255 10.029 4.676
88 HG2 GLN 13 2HG GLN 13 35.259 10.164 4.450
89 HG3 GLN 13 1HG GLN 13 34.344 8.909 5.286
90 HE21 GLN 13 1HE2 GLN 13 33.133 7.436 4.054
91 HE22 GLN 13 2HE2 GLN 13 33.435 7.202 2.369
92 H ALA 14 H ALA 14 31.033 11.604 2.121
93 HA ALA 14 HA ALA 14 29.611 13.832 3.288
94 HB1 ALA 14 3HB ALA 14 27.888 13.331 1.610
95 HB2 ALA 14 1HB ALA 14 28.748 11.855 1.168
96 HB3 ALA 14 2HB ALA 14 29.491 13.430 0.882
97 HA PRO 15 HA PRO 15 27.391 11.500 6.344
98 HB2 PRO 15 2HB PRO 15 25.215 13.093 6.702
99 HB3 PRO 15 1HB PRO 15 26.826 13.529 7.283
100 HG2 PRO 15 2HG PRO 15 25.416 14.410 4.785
101 HG3 PRO 15 1HG PRO 15 26.335 15.384 5.950
102 HD2 PRO 15 2HD PRO 15 27.397 14.561 3.604
103 HD3 PRO 15 1HD PRO 15 28.375 14.731 5.076
104 H GLU 16 H GLU 16 25.898 9.882 6.421
105 HA GLU 16 HA GLU 16 24.533 8.960 4.168
106 HB2 GLU 16 2HB GLU 16 23.245 7.553 5.884
107 HB3 GLU 16 1HB GLU 16 24.995 7.385 5.852
108 HG2 GLU 16 2HG GLU 16 25.249 8.702 7.815
109 HG3 GLU 16 1HG GLU 16 23.560 9.201 7.776
110 H THR 17 H THR 17 23.209 10.456 3.181
111 HA THR 17 HA THR 17 21.146 11.886 4.578
112 HB THR 17 HB THR 17 21.499 11.442 1.592
113 HG1 THR 17 HG1 THR 17 22.981 12.936 1.781
114 HG21 THR 17 3HG2 THR 17 19.785 13.456 3.067
115 HG22 THR 17 1HG2 THR 17 19.190 12.067 2.156
116 HG23 THR 17 2HG2 THR 17 20.019 13.380 1.320
117 H LYS 18 H LYS 18 19.593 10.672 5.530
118 HA LYS 18 HA LYS 18 18.044 8.825 3.846
119 HB2 LYS 18 2HB LYS 18 19.608 7.388 5.020
120 HB3 LYS 18 1HB LYS 18 19.211 8.145 6.557
121 HG2 LYS 18 2HG LYS 18 16.886 7.280 6.316
122 HG3 LYS 18 1HG LYS 18 17.407 6.413 4.871
123 HD2 LYS 18 2HD LYS 18 18.966 5.094 6.172
124 HD3 LYS 18 1HD LYS 18 18.616 6.044 7.620
125 HE2 LYS 18 2HE LYS 18 16.659 4.283 6.133
126 HE3 LYS 18 1HE LYS 18 17.441 3.898 7.665
127 HZ1 LYS 18 3HZ LYS 18 16.315 5.755 8.694
128 HZ2 LYS 18 1HZ LYS 18 15.177 4.735 7.967
129 HZ3 LYS 18 2HZ LYS 18 15.603 6.192 7.224
130 H GLN 19 H GLN 19 15.890 8.719 4.301
131 HA GLN 19 HA GLN 19 14.813 10.423 6.447
132 HB2 GLN 19 2HB GLN 19 13.534 9.221 3.979
133 HB3 GLN 19 1HB GLN 19 12.621 10.059 5.224
134 HG2 GLN 19 2HG GLN 19 14.870 11.311 3.661
135 HG3 GLN 19 1HG GLN 19 13.170 11.420 3.206
136 HE21 GLN 19 1HE2 GLN 19 11.776 12.659 4.468
137 HE22 GLN 19 2HE2 GLN 19 12.358 13.823 5.604
138 H ALA 20 H ALA 20 13.130 9.587 7.834
139 HA ALA 20 HA ALA 20 13.420 6.700 8.332
140 HB1 ALA 20 3HB ALA 20 13.957 8.221 10.191
141 HB2 ALA 20 1HB ALA 20 12.608 7.153 10.579
142 HB3 ALA 20 2HB ALA 20 12.305 8.840 10.156
143 H PHE 21 H PHE 21 11.837 5.354 7.732
144 HA PHE 21 HA PHE 21 9.385 6.143 6.598
145 HB2 PHE 21 2HB PHE 21 10.287 3.497 7.754
146 HB3 PHE 21 1HB PHE 21 8.751 3.706 6.923
147 HD1 PHE 21 HD1 PHE 21 8.896 4.701 4.510
148 HD2 PHE 21 HD2 PHE 21 12.152 2.845 6.543
149 HE1 PHE 21 HE1 PHE 21 9.981 4.239 2.353
150 HE2 PHE 21 HE2 PHE 21 13.240 2.386 4.385
151 HZ PHE 21 HZ PHE 21 12.155 3.079 2.287
152 HA PRO 22 HA PRO 22 7.114 6.525 10.524
153 HB2 PRO 22 2HB PRO 22 5.172 8.160 9.655
154 HB3 PRO 22 1HB PRO 22 6.803 8.762 9.974
155 HG2 PRO 22 2HG PRO 22 5.488 8.151 7.365
156 HG3 PRO 22 1HG PRO 22 6.628 9.445 7.772
157 HD2 PRO 22 2HD PRO 22 7.273 7.031 6.497
158 HD3 PRO 22 1HD PRO 22 8.426 8.142 7.261
159 H ARG 23 H ARG 23 6.361 4.374 10.628
160 HA ARG 23 HA ARG 23 4.472 3.394 8.674
161 HB2 ARG 23 2HB ARG 23 4.581 1.279 9.858
162 HB3 ARG 23 1HB ARG 23 6.199 1.915 9.598
163 HG2 ARG 23 2HG ARG 23 6.236 2.706 11.935
164 HG3 ARG 23 1HG ARG 23 4.641 1.988 12.180
165 HD2 ARG 23 2HD ARG 23 5.583 -0.219 11.560
166 HD3 ARG 23 1HD ARG 23 7.176 0.524 11.429
167 HE ARG 23 HE ARG 23 5.803 0.802 13.982
168 HH11 ARG 23 1HH1 ARG 23 8.205 -0.844 12.122
169 HH12 ARG 23 2HH1 ARG 23 8.976 -1.512 13.514
170 HH21 ARG 23 1HH2 ARG 23 6.786 -0.105 15.743
171 HH22 ARG 23 2HH2 ARG 23 8.162 -1.132 15.525
172 H LYS 24 H LYS 24 4.254 4.863 11.792
173 HA LYS 24 HA LYS 24 1.869 3.923 12.819
174 HB2 LYS 24 2HB LYS 24 2.855 6.786 12.818
175 HB3 LYS 24 1HB LYS 24 1.614 6.143 13.887
176 HG2 LYS 24 2HG LYS 24 3.237 4.637 14.902
177 HG3 LYS 24 1HG LYS 24 4.491 5.225 13.810
178 HD2 LYS 24 2HD LYS 24 2.997 6.932 15.814
179 HD3 LYS 24 1HD LYS 24 4.604 6.252 16.069
180 HE2 LYS 24 2HE LYS 24 5.466 7.533 14.175
181 HE3 LYS 24 1HE LYS 24 3.854 8.181 13.864
182 HZ1 LYS 24 3HZ LYS 24 5.444 8.627 16.335
183 HZ2 LYS 24 1HZ LYS 24 3.906 9.259 16.023
184 HZ3 LYS 24 2HZ LYS 24 5.223 9.751 15.089
185 H PHE 25 H PHE 25 2.267 6.588 10.481
186 HA PHE 25 HA PHE 25 -0.571 6.973 10.183
187 HB2 PHE 25 2HB PHE 25 1.771 8.108 8.633
188 HB3 PHE 25 1HB PHE 25 0.097 8.618 8.435
189 HD1 PHE 25 HD2 PHE 25 2.939 8.519 10.810
190 HD2 PHE 25 HD1 PHE 25 -0.902 10.153 9.941
191 HE1 PHE 25 HE2 PHE 25 3.225 10.155 12.627
192 HE2 PHE 25 HE1 PHE 25 -0.618 11.790 11.756
193 HZ PHE 25 HZ PHE 25 1.447 11.793 13.101
194 H VAL 26 H VAL 26 1.983 5.447 8.236
195 HA VAL 26 HA VAL 26 0.479 5.016 5.902
196 HB VAL 26 HB VAL 26 2.743 3.310 6.977
197 HG11 VAL 26 1HG1 VAL 26 1.610 3.551 4.185
198 HG12 VAL 26 2HG1 VAL 26 1.502 2.144 5.244
199 HG13 VAL 26 3HG1 VAL 26 3.068 2.660 4.621
200 HG21 VAL 26 3HG2 VAL 26 3.413 5.645 6.745
201 HG22 VAL 26 1HG2 VAL 26 2.803 5.673 5.089
202 HG23 VAL 26 2HG2 VAL 26 4.183 4.655 5.505
203 H LEU 27 H LEU 27 1.089 2.771 8.621
204 HA LEU 27 HA LEU 27 -0.572 0.691 7.694
205 HB2 LEU 27 2HB LEU 27 0.176 1.386 10.541
206 HB3 LEU 27 1HB LEU 27 -0.518 -0.139 10.018
207 HG LEU 27 HG LEU 27 2.202 0.939 9.234
208 HD11 LEU 27 1HD1 LEU 27 3.080 -0.923 10.547
209 HD12 LEU 27 2HD1 LEU 27 1.440 -1.382 11.010
210 HD13 LEU 27 3HD1 LEU 27 2.109 0.160 11.545
211 HD21 LEU 27 3HD2 LEU 27 0.889 -1.687 8.510
212 HD22 LEU 27 1HD2 LEU 27 2.546 -1.217 8.133
213 HD23 LEU 27 2HD2 LEU 27 1.198 -0.345 7.408
214 H ALA 28 H ALA 28 -1.263 3.538 9.659
215 HA ALA 28 HA ALA 28 -3.924 2.922 10.372
216 HB1 ALA 28 3HB ALA 28 -2.699 5.647 9.905
217 HB2 ALA 28 1HB ALA 28 -2.636 4.736 11.415
218 HB3 ALA 28 2HB ALA 28 -4.184 5.309 10.796
219 H ALA 29 H ALA 29 -2.601 4.651 7.544
220 HA ALA 29 HA ALA 29 -5.065 5.207 6.279
221 HB1 ALA 29 3HB ALA 29 -2.349 4.754 5.026
222 HB2 ALA 29 1HB ALA 29 -2.973 6.291 5.623
223 HB3 ALA 29 2HB ALA 29 -3.737 5.510 4.239
224 H LEU 30 H LEU 30 -2.911 2.424 6.162
225 HA LEU 30 HA LEU 30 -4.136 0.965 4.107
226 HB2 LEU 30 2HB LEU 30 -1.904 0.502 5.092
227 HB3 LEU 30 1HB LEU 30 -2.686 -0.079 6.549
228 HG LEU 30 HG LEU 30 -3.716 -1.920 5.250
229 HD11 LEU 30 1HD1 LEU 30 -3.824 -0.882 3.064
230 HD12 LEU 30 2HD1 LEU 30 -2.896 -2.378 2.972
231 HD13 LEU 30 3HD1 LEU 30 -2.064 -0.822 2.972
232 HD21 LEU 30 3HD2 LEU 30 -0.713 -1.733 4.985
233 HD22 LEU 30 1HD2 LEU 30 -1.671 -3.214 4.936
234 HD23 LEU 30 2HD2 LEU 30 -1.596 -2.261 6.417
235 H GLU 31 H GLU 31 -4.549 0.550 7.650
236 HA GLU 31 HA GLU 31 -6.535 -1.420 7.491
237 HB2 GLU 31 2HB GLU 31 -6.984 -0.969 9.838
238 HB3 GLU 31 1HB GLU 31 -5.253 -0.972 9.532
239 HG2 GLU 31 2HG GLU 31 -5.172 1.430 9.623
240 HG3 GLU 31 1HG GLU 31 -6.928 1.529 9.739
241 H GLN 32 H GLN 32 -6.843 2.110 7.567
242 HA GLN 32 HA GLN 32 -9.658 2.194 7.885
243 HB2 GLN 32 2HB GLN 32 -7.696 4.197 6.762
244 HB3 GLN 32 1HB GLN 32 -9.409 4.546 6.938
245 HG2 GLN 32 2HG GLN 32 -9.243 4.167 9.358
246 HG3 GLN 32 1HG GLN 32 -7.526 3.808 9.181
247 HE21 GLN 32 1HE2 GLN 32 -6.104 5.482 8.713
248 HE22 GLN 32 2HE2 GLN 32 -6.526 7.138 8.948
249 H SER 33 H SER 33 -7.771 1.317 5.178
250 HA SER 33 HA SER 33 -10.140 1.567 3.418
251 HB2 SER 33 2HB SER 33 -8.265 2.941 2.623
252 HB3 SER 33 1HB SER 33 -7.213 1.527 2.625
253 HG SER 33 HG SER 33 -8.489 0.621 1.003
254 H SER 34 H SER 34 -8.961 -0.652 5.296
255 HA SER 34 HA SER 34 -8.588 -2.816 3.351
256 HB2 SER 34 2HB SER 34 -8.214 -2.724 6.354
257 HB3 SER 34 1HB SER 34 -8.029 -4.191 5.394
258 HG SER 34 HG SER 34 -6.604 -1.848 4.738
259 H ASP 35 H ASP 35 -9.830 -4.708 3.323
260 HA ASP 35 HA ASP 35 -12.569 -4.594 3.960
261 HB2 ASP 35 2HB ASP 35 -10.766 -6.958 3.383
262 HB3 ASP 35 1HB ASP 35 -12.519 -7.075 3.519
263 H ASP 36 H ASP 36 -13.611 -6.444 5.312
264 HA ASP 36 HA ASP 36 -13.146 -6.003 8.022
265 HB2 ASP 36 2HB ASP 36 -15.248 -6.880 7.032
266 HB3 ASP 36 1HB ASP 36 -14.453 -8.424 6.752
267 H ALA 37 H ALA 37 -11.859 -8.517 5.898
268 HA ALA 37 HA ALA 37 -10.537 -9.966 8.022
269 HB1 ALA 37 3HB ALA 37 -9.616 -11.342 6.233
270 HB2 ALA 37 1HB ALA 37 -10.213 -10.201 5.029
271 HB3 ALA 37 2HB ALA 37 -11.352 -11.116 6.018
272 H GLY 38 H GLY 38 -9.807 -7.093 6.450
273 HA2 GLY 38 2HA GLY 38 -7.937 -5.750 6.878
274 HA3 GLY 38 1HA GLY 38 -7.070 -7.164 7.449
275 H TRP 39 H TRP 39 -8.573 -6.193 4.343
276 HA TRP 39 HA TRP 39 -5.929 -6.391 3.063
277 HB2 TRP 39 2HB TRP 39 -8.473 -7.702 2.084
278 HB3 TRP 39 1HB TRP 39 -7.093 -7.402 1.032
279 HD1 TRP 39 HD1 TRP 39 -8.347 -9.779 3.691
280 HE1 TRP 39 HE1 TRP 39 -6.651 -11.693 3.985
281 HE3 TRP 39 HE3 TRP 39 -4.493 -7.877 0.926
282 HZ2 TRP 39 HZ2 TRP 39 -4.020 -12.310 3.146
283 HZ3 TRP 39 HZ3 TRP 39 -2.422 -9.182 0.727
284 HH2 TRP 39 HH2 TRP 39 -2.191 -11.352 1.815
285 H ALA 40 H ALA 40 -5.461 -4.545 2.026
286 HA ALA 40 HA ALA 40 -7.705 -2.918 0.982
287 HB1 ALA 40 3HB ALA 40 -6.397 -0.925 1.416
288 HB2 ALA 40 1HB ALA 40 -5.043 -1.904 1.982
289 HB3 ALA 40 2HB ALA 40 -6.550 -1.874 2.896
290 H ASN 41 H ASN 41 -7.733 -2.559 -1.153
291 HA ASN 41 HA ASN 41 -5.782 -3.544 -2.941
292 HB2 ASN 41 2HB ASN 41 -8.161 -3.180 -3.543
293 HB3 ASN 41 1HB ASN 41 -7.917 -1.441 -3.432
294 HD21 ASN 41 1HD2 ASN 41 -8.759 -3.113 -5.690
295 HD22 ASN 41 2HD2 ASN 41 -7.639 -2.770 -6.963
296 H LEU 42 H LEU 42 -4.028 -2.628 -3.882
297 HA LEU 42 HA LEU 42 -2.532 -0.636 -2.759
298 HB2 LEU 42 2HB LEU 42 -1.672 -2.215 -4.404
299 HB3 LEU 42 1HB LEU 42 -2.621 -1.455 -5.666
300 HG LEU 42 HG LEU 42 -1.280 0.630 -5.361
301 HD11 LEU 42 1HD1 LEU 42 0.833 0.504 -4.126
302 HD12 LEU 42 2HD1 LEU 42 0.407 -1.109 -3.553
303 HD13 LEU 42 3HD1 LEU 42 -0.554 0.286 -3.059
304 HD21 LEU 42 3HD2 LEU 42 0.687 -0.195 -6.527
305 HD22 LEU 42 1HD2 LEU 42 -0.764 -1.002 -7.122
306 HD23 LEU 42 2HD2 LEU 42 0.324 -1.845 -6.017
307 H GLY 43 H GLY 43 -4.925 -0.228 -5.353
308 HA2 GLY 43 2HA GLY 43 -4.426 2.466 -5.968
309 HA3 GLY 43 1HA GLY 43 -5.957 1.640 -6.203
310 H ASN 44 H ASN 44 -6.979 1.177 -3.820
311 HA ASN 44 HA ASN 44 -7.836 3.709 -2.899
312 HB2 ASN 44 2HB ASN 44 -8.137 0.985 -1.606
313 HB3 ASN 44 1HB ASN 44 -9.017 2.434 -1.124
314 HD21 ASN 44 1HD2 ASN 44 -10.022 -0.106 -2.132
315 HD22 ASN 44 2HD2 ASN 44 -10.944 0.270 -3.542
316 H PHE 45 H PHE 45 -5.503 1.384 -1.590
317 HA PHE 45 HA PHE 45 -4.915 2.679 0.829
318 HB2 PHE 45 2HB PHE 45 -4.122 0.447 0.509
319 HB3 PHE 45 1HB PHE 45 -3.251 0.894 -0.953
320 HD1 PHE 45 HD1 PHE 45 -3.342 2.196 2.564
321 HD2 PHE 45 HD2 PHE 45 -0.971 0.761 -0.676
322 HE1 PHE 45 HE1 PHE 45 -1.304 2.548 3.896
323 HE2 PHE 45 HE2 PHE 45 1.067 1.117 0.656
324 HZ PHE 45 HZ PHE 45 0.899 2.006 2.943
325 H GLY 46 H GLY 46 -3.217 2.920 -2.311
326 HA2 GLY 46 2HA GLY 46 -1.351 4.867 -1.594
327 HA3 GLY 46 1HA GLY 46 -1.950 4.606 -3.225
328 H ASN 47 H ASN 47 -4.635 5.286 -2.861
329 HA ASN 47 HA ASN 47 -4.612 8.091 -3.093
330 HB2 ASN 47 2HB ASN 47 -6.330 6.516 -4.043
331 HB3 ASN 47 1HB ASN 47 -6.997 6.342 -2.425
332 HD21 ASN 47 1HD2 ASN 47 -8.262 7.350 -4.815
333 HD22 ASN 47 2HD2 ASN 47 -8.767 8.963 -4.462
334 H TYR 48 H TYR 48 -5.913 6.061 -0.434
335 HA TYR 48 HA TYR 48 -6.591 8.272 1.210
336 HB2 TYR 48 2HB TYR 48 -7.544 5.891 1.325
337 HB3 TYR 48 1HB TYR 48 -6.097 5.471 2.237
338 HD1 TYR 48 HD2 TYR 48 -9.073 7.684 2.225
339 HD2 TYR 48 HD1 TYR 48 -5.952 5.975 4.565
340 HE1 TYR 48 HE2 TYR 48 -10.143 8.528 4.266
341 HE2 TYR 48 HE1 TYR 48 -7.014 6.825 6.609
342 HH TYR 48 HH TYR 48 -8.557 8.607 7.269
343 H LEU 49 H LEU 49 -3.672 6.360 0.895
344 HA LEU 49 HA LEU 49 -2.386 7.009 3.293
345 HB2 LEU 49 2HB LEU 49 -1.531 5.283 1.817
346 HB3 LEU 49 1HB LEU 49 -1.216 6.467 0.561
347 HG LEU 49 HG LEU 49 0.525 7.504 1.958
348 HD11 LEU 49 1HD1 LEU 49 1.274 6.428 4.017
349 HD12 LEU 49 2HD1 LEU 49 -0.057 5.275 3.909
350 HD13 LEU 49 3HD1 LEU 49 -0.390 6.990 4.160
351 HD21 LEU 49 3HD2 LEU 49 1.159 5.749 0.390
352 HD22 LEU 49 1HD2 LEU 49 0.864 4.521 1.622
353 HD23 LEU 49 2HD2 LEU 49 2.167 5.691 1.835
354 H ASN 50 H ASN 50 -2.186 8.674 0.139
355 HA ASN 50 HA ASN 50 -0.393 10.675 1.018
356 HB2 ASN 50 2HB ASN 50 -0.814 10.064 -1.375
357 HB3 ASN 50 1HB ASN 50 -2.362 10.896 -1.272
358 HD21 ASN 50 1HD2 ASN 50 1.099 11.286 -1.221
359 HD22 ASN 50 2HD2 ASN 50 1.106 12.979 -1.551
360 H LYS 51 H LYS 51 -3.830 10.348 1.369
361 HA LYS 51 HA LYS 51 -4.491 13.044 1.916
362 HB2 LYS 51 2HB LYS 51 -5.760 10.505 2.977
363 HB3 LYS 51 1HB LYS 51 -6.463 12.113 3.097
364 HG2 LYS 51 2HG LYS 51 -6.606 12.241 0.657
365 HG3 LYS 51 1HG LYS 51 -5.880 10.635 0.530
366 HD2 LYS 51 2HD LYS 51 -8.301 10.483 0.292
367 HD3 LYS 51 1HD LYS 51 -7.783 9.690 1.780
368 HE2 LYS 51 2HE LYS 51 -9.779 10.985 2.197
369 HE3 LYS 51 1HE LYS 51 -8.418 11.706 3.049
370 HZ1 LYS 51 3HZ LYS 51 -9.448 12.649 0.431
371 HZ2 LYS 51 1HZ LYS 51 -8.252 13.390 1.371
372 HZ3 LYS 51 2HZ LYS 51 -9.853 13.338 1.920
373 H LEU 52 H LEU 52 -3.236 10.435 3.938
374 HA LEU 52 HA LEU 52 -3.375 12.051 6.350
375 HB2 LEU 52 2HB LEU 52 -2.146 9.322 5.937
376 HB3 LEU 52 1HB LEU 52 -2.432 10.104 7.483
377 HG LEU 52 HG LEU 52 -4.496 9.042 5.550
378 HD11 LEU 52 1HD1 LEU 52 -5.138 7.611 7.411
379 HD12 LEU 52 2HD1 LEU 52 -3.889 8.338 8.424
380 HD13 LEU 52 3HD1 LEU 52 -3.436 7.385 7.010
381 HD21 LEU 52 3HD2 LEU 52 -6.200 9.839 7.142
382 HD22 LEU 52 1HD2 LEU 52 -5.313 11.166 6.394
383 HD23 LEU 52 2HD2 LEU 52 -4.943 10.681 8.049
384 H GLN 53 H GLN 53 -0.873 10.847 4.138
385 HA GLN 53 HA GLN 53 1.037 12.720 5.394
386 HB2 GLN 53 2HB GLN 53 1.583 9.871 4.544
387 HB3 GLN 53 1HB GLN 53 2.854 11.033 4.876
388 HG2 GLN 53 2HG GLN 53 0.764 10.210 6.878
389 HG3 GLN 53 1HG GLN 53 2.352 9.459 6.742
390 HE21 GLN 53 1HE2 GLN 53 0.595 12.280 7.724
391 HE22 GLN 53 2HE2 GLN 53 1.895 13.049 8.559
392 HA PRO 54 HA PRO 54 1.051 13.626 0.834
393 HB2 PRO 54 2HB PRO 54 1.305 16.398 1.784
394 HB3 PRO 54 1HB PRO 54 0.130 15.704 0.665
395 HG2 PRO 54 2HG PRO 54 -0.532 16.510 3.161
396 HG3 PRO 54 1HG PRO 54 -1.353 15.171 2.337
397 HD2 PRO 54 2HD PRO 54 0.740 15.090 4.480
398 HD3 PRO 54 1HD PRO 54 -0.684 14.053 4.251
399 H ASP 55 H ASP 55 2.930 14.470 3.615
400 HA ASP 55 HA ASP 55 5.244 15.454 2.268
401 HB2 ASP 55 2HB ASP 55 4.846 16.104 4.553
402 HB3 ASP 55 1HB ASP 55 4.765 14.427 5.076
403 H PHE 56 H PHE 56 3.986 12.313 2.745
404 HA PHE 56 HA PHE 56 6.555 10.947 2.735
405 HB2 PHE 56 2HB PHE 56 4.734 10.100 4.152
406 HB3 PHE 56 1HB PHE 56 3.737 9.835 2.727
407 HD1 PHE 56 HD1 PHE 56 6.875 8.772 4.399
408 HD2 PHE 56 HD2 PHE 56 3.893 7.823 1.508
409 HE1 PHE 56 HE1 PHE 56 7.799 6.503 4.196
410 HE2 PHE 56 HE2 PHE 56 4.814 5.554 1.305
411 HZ PHE 56 HZ PHE 56 6.767 4.891 2.648
412 H ASP 57 H ASP 57 7.578 10.883 0.834
413 HA ASP 57 HA ASP 57 6.052 10.117 -1.573
414 HB2 ASP 57 2HB ASP 57 6.648 12.401 -1.863
415 HB3 ASP 57 1HB ASP 57 8.280 12.129 -1.264
416 H SER 58 H SER 58 6.818 8.474 -2.778
417 HA SER 58 HA SER 58 8.740 6.696 -1.703
418 HB2 SER 58 2HB SER 58 7.537 6.745 -4.485
419 HB3 SER 58 1HB SER 58 8.416 5.391 -3.775
420 HG SER 58 HG SER 58 6.499 4.821 -3.118
421 H ARG 59 H ARG 59 8.971 9.152 -4.234
422 HA ARG 59 HA ARG 59 11.390 8.267 -5.402
423 HB2 ARG 59 2HB ARG 59 10.295 11.090 -5.272
424 HB3 ARG 59 1HB ARG 59 11.548 10.525 -6.367
425 HG2 ARG 59 2HG ARG 59 8.728 9.454 -6.328
426 HG3 ARG 59 1HG ARG 59 9.290 10.735 -7.401
427 HD2 ARG 59 2HD ARG 59 10.900 9.220 -8.410
428 HD3 ARG 59 1HD ARG 59 10.446 7.944 -7.287
429 HE ARG 59 HE ARG 59 8.226 7.985 -8.377
430 HH11 ARG 59 1HH1 ARG 59 10.934 9.257 -10.101
431 HH12 ARG 59 2HH1 ARG 59 10.232 8.925 -11.647
432 HH21 ARG 59 1HH2 ARG 59 7.368 7.530 -10.362
433 HH22 ARG 59 2HH2 ARG 59 8.229 7.986 -11.790
434 H LEU 60 H LEU 60 10.737 10.356 -2.631
435 HA LEU 60 HA LEU 60 13.276 11.361 -2.093
436 HB2 LEU 60 2HB LEU 60 11.252 10.381 -0.067
437 HB3 LEU 60 1HB LEU 60 12.594 11.459 0.270
438 HG LEU 60 HG LEU 60 10.244 12.105 -1.519
439 HD11 LEU 60 1HD1 LEU 60 10.913 13.041 1.274
440 HD12 LEU 60 2HD1 LEU 60 9.581 11.979 0.816
441 HD13 LEU 60 3HD1 LEU 60 9.595 13.657 0.274
442 HD21 LEU 60 3HD2 LEU 60 12.272 13.251 -2.238
443 HD22 LEU 60 1HD2 LEU 60 12.549 13.825 -0.592
444 HD23 LEU 60 2HD2 LEU 60 11.145 14.388 -1.499
445 H TYR 61 H TYR 61 11.961 8.167 -1.393
446 HA TYR 61 HA TYR 61 14.308 7.378 0.147
447 HB2 TYR 61 2HB TYR 61 11.755 5.897 -0.526
448 HB3 TYR 61 1HB TYR 61 13.037 5.260 0.500
449 HD1 TYR 61 HD1 TYR 61 10.412 7.855 0.236
450 HD2 TYR 61 HD2 TYR 61 13.268 5.973 2.778
451 HE1 TYR 61 HE1 TYR 61 9.399 8.958 2.188
452 HE2 TYR 61 HE2 TYR 61 12.259 7.068 4.730
453 HH TYR 61 HH TYR 61 9.282 8.871 4.511
454 H GLY 62 H GLY 62 13.896 7.647 -3.043
455 HA2 GLY 62 2HA GLY 62 15.297 6.814 -4.719
456 HA3 GLY 62 1HA GLY 62 15.851 5.567 -3.613
457 H TYR 63 H TYR 63 12.441 5.867 -3.879
458 HA TYR 63 HA TYR 63 12.345 3.474 -5.598
459 HB2 TYR 63 2HB TYR 63 10.425 4.524 -3.511
460 HB3 TYR 63 1HB TYR 63 10.001 3.232 -4.630
461 HD1 TYR 63 HD1 TYR 63 12.309 4.152 -1.867
462 HD2 TYR 63 HD2 TYR 63 10.750 1.024 -4.292
463 HE1 TYR 63 HE1 TYR 63 13.356 2.485 -0.388
464 HE2 TYR 63 HE2 TYR 63 11.774 -0.642 -2.824
465 HH TYR 63 HH TYR 63 13.641 -0.799 -1.236
466 H LYS 64 H LYS 64 10.707 3.309 -7.230
467 HA LYS 64 HA LYS 64 10.287 5.852 -8.568
468 HB2 LYS 64 2HB LYS 64 9.779 2.994 -9.393
469 HB3 LYS 64 1HB LYS 64 9.327 4.365 -10.396
470 HG2 LYS 64 2HG LYS 64 12.132 3.791 -9.446
471 HG3 LYS 64 1HG LYS 64 11.493 3.359 -11.035
472 HD2 LYS 64 2HD LYS 64 11.081 5.728 -11.521
473 HD3 LYS 64 1HD LYS 64 11.683 6.170 -9.923
474 HE2 LYS 64 2HE LYS 64 13.315 4.760 -12.036
475 HE3 LYS 64 1HE LYS 64 13.334 6.500 -11.756
476 HZ1 LYS 64 3HZ LYS 64 15.172 5.455 -10.631
477 HZ2 LYS 64 1HZ LYS 64 14.128 4.414 -9.805
478 HZ3 LYS 64 2HZ LYS 64 14.093 6.071 -9.487
479 H LYS 65 H LYS 65 8.255 3.392 -7.032
480 HA LYS 65 HA LYS 65 6.095 5.348 -6.938
481 HB2 LYS 65 2HB LYS 65 4.418 3.693 -7.759
482 HB3 LYS 65 1HB LYS 65 5.562 4.210 -8.989
483 HG2 LYS 65 2HG LYS 65 6.805 2.137 -8.753
484 HG3 LYS 65 1HG LYS 65 5.736 1.623 -7.447
485 HD2 LYS 65 2HD LYS 65 5.145 0.547 -9.571
486 HD3 LYS 65 1HD LYS 65 3.842 1.583 -8.986
487 HE2 LYS 65 2HE LYS 65 4.480 3.324 -10.553
488 HE3 LYS 65 1HE LYS 65 5.870 2.374 -11.081
489 HZ1 LYS 65 3HZ LYS 65 4.053 2.170 -12.635
490 HZ2 LYS 65 1HZ LYS 65 3.018 1.621 -11.417
491 HZ3 LYS 65 2HZ LYS 65 4.341 0.679 -11.893
492 H LEU 66 H LEU 66 4.081 4.117 -5.775
493 HA LEU 66 HA LEU 66 5.037 3.604 -3.157
494 HB2 LEU 66 2HB LEU 66 2.861 4.645 -3.606
495 HB3 LEU 66 1HB LEU 66 2.282 3.142 -4.304
496 HG LEU 66 HG LEU 66 2.506 2.030 -2.117
497 HD11 LEU 66 1HD1 LEU 66 4.345 3.331 -1.193
498 HD12 LEU 66 2HD1 LEU 66 2.962 3.345 -0.102
499 HD13 LEU 66 3HD1 LEU 66 3.311 4.757 -1.099
500 HD21 LEU 66 3HD2 LEU 66 0.664 3.174 -0.983
501 HD22 LEU 66 1HD2 LEU 66 0.376 3.039 -2.717
502 HD23 LEU 66 2HD2 LEU 66 0.889 4.579 -2.026
503 H SER 67 H SER 67 3.561 1.423 -5.583
504 HA SER 67 HA SER 67 3.571 -0.930 -4.081
505 HB2 SER 67 2HB SER 67 3.497 -2.139 -6.207
506 HB3 SER 67 1HB SER 67 2.464 -0.714 -6.285
507 HG SER 67 HG SER 67 4.005 -1.189 -8.101
508 H ASP 68 H ASP 68 6.101 0.303 -6.260
509 HA ASP 68 HA ASP 68 8.089 -1.565 -6.009
510 HB2 ASP 68 2HB ASP 68 8.172 0.549 -7.360
511 HB3 ASP 68 1HB ASP 68 8.487 1.438 -5.877
512 H LEU 69 H LEU 69 7.357 1.071 -3.757
513 HA LEU 69 HA LEU 69 9.370 0.446 -1.849
514 HB2 LEU 69 2HB LEU 69 8.408 2.668 -2.015
515 HB3 LEU 69 1HB LEU 69 6.815 2.043 -1.630
516 HG LEU 69 HG LEU 69 7.585 1.470 0.640
517 HD11 LEU 69 1HD1 LEU 69 10.165 2.807 -0.168
518 HD12 LEU 69 2HD1 LEU 69 9.947 1.084 0.135
519 HD13 LEU 69 3HD1 LEU 69 9.745 2.241 1.450
520 HD21 LEU 69 3HD2 LEU 69 6.535 3.634 0.247
521 HD22 LEU 69 1HD2 LEU 69 8.104 4.340 -0.145
522 HD23 LEU 69 2HD2 LEU 69 7.780 3.760 1.489
523 H VAL 70 H VAL 70 5.887 -0.272 -1.983
524 HA VAL 70 HA VAL 70 5.642 -1.436 0.559
525 HB VAL 70 HB VAL 70 3.990 -1.936 -1.928
526 HG11 VAL 70 1HG1 VAL 70 3.348 -2.567 0.956
527 HG12 VAL 70 2HG1 VAL 70 3.695 -3.745 -0.308
528 HG13 VAL 70 3HG1 VAL 70 2.247 -2.744 -0.408
529 HG21 VAL 70 3HG2 VAL 70 2.437 -0.315 -0.966
530 HG22 VAL 70 1HG2 VAL 70 4.026 0.411 -1.202
531 HG23 VAL 70 2HG2 VAL 70 3.513 -0.080 0.412
532 H LYS 71 H LYS 71 5.884 -3.119 -2.607
533 HA LYS 71 HA LYS 71 6.016 -5.698 -1.434
534 HB2 LYS 71 2HB LYS 71 6.551 -6.534 -3.636
535 HB3 LYS 71 1HB LYS 71 5.285 -5.322 -3.763
536 HG2 LYS 71 2HG LYS 71 6.854 -3.688 -4.582
537 HG3 LYS 71 1HG LYS 71 8.204 -4.790 -4.304
538 HD2 LYS 71 2HD LYS 71 5.923 -5.263 -6.237
539 HD3 LYS 71 1HD LYS 71 7.541 -4.716 -6.683
540 HE2 LYS 71 2HE LYS 71 8.489 -6.795 -5.794
541 HE3 LYS 71 1HE LYS 71 6.878 -7.336 -5.331
542 HZ1 LYS 71 3HZ LYS 71 7.787 -6.802 -8.104
543 HZ2 LYS 71 1HZ LYS 71 6.243 -7.329 -7.652
544 HZ3 LYS 71 2HZ LYS 71 7.585 -8.325 -7.405
545 H ALA 72 H ALA 72 8.434 -3.284 -1.997
546 HA ALA 72 HA ALA 72 10.689 -5.059 -1.733
547 HB1 ALA 72 3HB ALA 72 10.910 -2.936 -2.924
548 HB2 ALA 72 1HB ALA 72 12.016 -3.004 -1.553
549 HB3 ALA 72 2HB ALA 72 10.535 -2.053 -1.445
550 H ARG 73 H ARG 73 8.883 -2.894 0.430
551 HA ARG 73 HA ARG 73 10.509 -3.717 2.712
552 HB2 ARG 73 2HB ARG 73 8.244 -1.716 2.522
553 HB3 ARG 73 1HB ARG 73 9.150 -2.061 3.987
554 HG2 ARG 73 2HG ARG 73 10.207 -0.828 1.450
555 HG3 ARG 73 1HG ARG 73 9.980 -0.037 3.011
556 HD2 ARG 73 2HD ARG 73 11.935 -2.243 2.360
557 HD3 ARG 73 1HD ARG 73 12.319 -0.557 2.697
558 HE ARG 73 HE ARG 73 11.096 -1.287 4.966
559 HH11 ARG 73 1HH1 ARG 73 13.589 -2.814 3.129
560 HH12 ARG 73 2HH1 ARG 73 14.312 -3.551 4.517
561 HH21 ARG 73 1HH2 ARG 73 12.049 -2.234 6.740
562 HH22 ARG 73 2HH2 ARG 73 13.446 -3.232 6.538
563 H THR 74 H THR 74 9.402 -5.949 1.975
564 HA THR 74 HA THR 74 6.848 -6.626 2.916
565 HB THR 74 HB THR 74 7.636 -8.947 3.081
566 HG1 THR 74 HG1 THR 74 10.031 -9.084 2.345
567 HG21 THR 74 3HG2 THR 74 8.457 -9.219 0.768
568 HG22 THR 74 1HG2 THR 74 8.739 -7.481 0.678
569 HG23 THR 74 2HG2 THR 74 7.096 -8.101 0.862
570 H ASP 75 H ASP 75 9.734 -5.893 4.605
571 HA ASP 75 HA ASP 75 9.442 -6.972 7.112
572 HB2 ASP 75 2HB ASP 75 11.339 -5.597 6.419
573 HB3 ASP 75 1HB ASP 75 10.307 -4.173 6.337
574 H LEU 76 H LEU 76 7.795 -4.145 5.759
575 HA LEU 76 HA LEU 76 6.207 -3.828 8.217
576 HB2 LEU 76 2HB LEU 76 6.579 -1.990 5.847
577 HB3 LEU 76 1HB LEU 76 5.555 -1.637 7.226
578 HG LEU 76 HG LEU 76 8.561 -1.998 7.326
579 HD11 LEU 76 1HD1 LEU 76 6.881 0.503 7.517
580 HD12 LEU 76 2HD1 LEU 76 7.944 0.055 6.182
581 HD13 LEU 76 3HD1 LEU 76 8.624 0.408 7.770
582 HD21 LEU 76 3HD2 LEU 76 7.495 -2.697 9.402
583 HD22 LEU 76 1HD2 LEU 76 6.598 -1.178 9.475
584 HD23 LEU 76 2HD2 LEU 76 8.355 -1.177 9.631
585 H PHE 77 H PHE 77 5.895 -4.543 4.777
586 HA PHE 77 HA PHE 77 2.953 -4.601 5.090
587 HB2 PHE 77 2HB PHE 77 4.447 -3.932 2.547
588 HB3 PHE 77 1HB PHE 77 2.716 -3.796 2.834
589 HD1 PHE 77 HD1 PHE 77 2.268 -2.337 5.140
590 HD2 PHE 77 HD2 PHE 77 5.528 -1.896 2.429
591 HE1 PHE 77 HE1 PHE 77 2.572 -0.014 5.880
592 HE2 PHE 77 HE2 PHE 77 5.833 0.430 3.175
593 HZ PHE 77 HZ PHE 77 4.354 1.371 4.902
594 H VAL 78 H VAL 78 1.907 -6.409 4.534
595 HA VAL 78 HA VAL 78 3.354 -8.600 3.217
596 HB VAL 78 HB VAL 78 0.577 -8.608 4.436
597 HG11 VAL 78 1HG1 VAL 78 2.359 -10.897 3.581
598 HG12 VAL 78 2HG1 VAL 78 0.904 -10.348 2.749
599 HG13 VAL 78 3HG1 VAL 78 0.782 -11.049 4.362
600 HG21 VAL 78 3HG2 VAL 78 2.265 -8.148 6.145
601 HG22 VAL 78 1HG2 VAL 78 3.192 -9.554 5.624
602 HG23 VAL 78 2HG2 VAL 78 1.598 -9.769 6.348
603 H THR 79 H THR 79 3.045 -9.036 1.084
604 HA THR 79 HA THR 79 0.829 -7.632 -0.297
605 HB THR 79 HB THR 79 2.233 -7.382 -2.246
606 HG1 THR 79 HG1 THR 79 4.146 -8.376 -2.471
607 HG21 THR 79 3HG2 THR 79 4.014 -5.937 -1.379
608 HG22 THR 79 1HG2 THR 79 3.799 -6.624 0.231
609 HG23 THR 79 2HG2 THR 79 2.508 -5.673 -0.503
610 H GLU 80 H GLU 80 -0.601 -8.834 -1.402
611 HA GLU 80 HA GLU 80 0.346 -11.227 -2.809
612 HB2 GLU 80 2HB GLU 80 -2.088 -11.187 -1.012
613 HB3 GLU 80 1HB GLU 80 -1.845 -12.402 -2.261
614 HG2 GLU 80 2HG GLU 80 0.346 -12.949 -1.124
615 HG3 GLU 80 1HG GLU 80 -0.191 -11.922 0.205
616 H GLU 81 H GLU 81 -0.256 -11.228 -4.881
617 HA GLU 81 HA GLU 81 -2.150 -9.225 -5.820
618 HB2 GLU 81 2HB GLU 81 -0.459 -11.206 -7.375
619 HB3 GLU 81 1HB GLU 81 -1.400 -9.894 -8.074
620 HG2 GLU 81 2HG GLU 81 0.003 -8.271 -6.851
621 HG3 GLU 81 1HG GLU 81 0.967 -9.607 -6.227
622 H ARG 82 H ARG 82 -4.225 -9.654 -6.277
623 HA ARG 82 HA ARG 82 -5.083 -12.484 -6.401
624 HB2 ARG 82 2HB ARG 82 -6.752 -10.142 -5.451
625 HB3 ARG 82 1HB ARG 82 -7.121 -11.853 -5.293
626 HG2 ARG 82 2HG ARG 82 -4.908 -10.370 -3.874
627 HG3 ARG 82 1HG ARG 82 -6.424 -10.917 -3.159
628 HD2 ARG 82 2HD ARG 82 -4.350 -12.746 -4.376
629 HD3 ARG 82 1HD ARG 82 -4.463 -12.378 -2.655
630 HE ARG 82 HE ARG 82 -6.952 -13.319 -3.538
631 HH11 ARG 82 1HH1 ARG 82 -3.738 -14.441 -3.050
632 HH12 ARG 82 2HH1 ARG 82 -4.233 -16.054 -2.690
633 HH21 ARG 82 1HH2 ARG 82 -7.581 -15.402 -3.079
634 HH22 ARG 82 2HH2 ARG 82 -6.382 -16.593 -2.712
635 H GLN 83 H GLN 83 -6.439 -13.091 -8.081
636 HA GLN 83 HA GLN 83 -6.586 -11.283 -10.320
637 HB2 GLN 83 2HB GLN 83 -6.135 -13.722 -10.573
638 HB3 GLN 83 1HB GLN 83 -7.776 -14.054 -10.038
639 HG2 GLN 83 2HG GLN 83 -8.634 -12.793 -11.981
640 HG3 GLN 83 1HG GLN 83 -6.975 -12.549 -12.527
641 HE21 GLN 83 1HE2 GLN 83 -9.162 -13.906 -13.871
642 HE22 GLN 83 2HE2 GLN 83 -8.624 -15.521 -14.157
643 H VAL 84 H VAL 84 -8.362 -10.265 -11.168
644 HA VAL 84 HA VAL 84 -10.557 -9.864 -9.291
645 HB VAL 84 HB VAL 84 -9.989 -8.409 -11.884
646 HG11 VAL 84 1HG1 VAL 84 -12.302 -8.179 -11.133
647 HG12 VAL 84 2HG1 VAL 84 -11.433 -6.656 -10.954
648 HG13 VAL 84 3HG1 VAL 84 -11.749 -7.663 -9.541
649 HG21 VAL 84 3HG2 VAL 84 -8.115 -8.191 -10.325
650 HG22 VAL 84 1HG2 VAL 84 -9.217 -7.652 -9.058
651 HG23 VAL 84 2HG2 VAL 84 -8.976 -6.663 -10.499
652 HA PRO 85 HA PRO 85 -13.330 -12.682 -11.470
653 HB2 PRO 85 2HB PRO 85 -15.351 -10.958 -10.091
654 HB3 PRO 85 1HB PRO 85 -15.218 -12.721 -10.139
655 HG2 PRO 85 2HG PRO 85 -14.493 -11.384 -7.958
656 HG3 PRO 85 1HG PRO 85 -13.538 -12.768 -8.522
657 HD2 PRO 85 2HD PRO 85 -12.963 -9.841 -8.775
658 HD3 PRO 85 1HD PRO 85 -11.847 -11.186 -8.462
659 H GLY 86 H GLY 86 -14.031 -12.506 -13.532
660 HA2 GLY 86 2HA GLY 86 -15.257 -11.608 -15.326
661 HA3 GLY 86 1HA GLY 86 -15.472 -10.121 -14.417
662 H SER 87 H SER 87 -12.429 -10.258 -13.911
663 HA SER 87 HA SER 87 -11.615 -9.063 -16.493
664 HB2 SER 87 2HB SER 87 -10.588 -8.421 -13.706
665 HB3 SER 87 1HB SER 87 -10.043 -7.662 -15.202
666 HG SER 87 HG SER 87 -11.580 -6.355 -14.193
667 H THR 88 H THR 88 -9.544 -9.552 -17.317
668 HA THR 88 HA THR 88 -8.450 -12.091 -16.390
669 HB THR 88 HB THR 88 -8.773 -11.677 -18.819
670 HG1 THR 88 HG1 THR 88 -6.287 -12.377 -17.690
671 HG21 THR 88 3HG2 THR 88 -7.210 -10.232 -20.027
672 HG22 THR 88 1HG2 THR 88 -6.493 -9.715 -18.502
673 HG23 THR 88 2HG2 THR 88 -8.165 -9.296 -18.876
674 H GLN 89 H GLN 89 -7.924 -8.927 -15.580
675 HA GLN 89 HA GLN 89 -5.035 -9.154 -15.186
676 HB2 GLN 89 2HB GLN 89 -5.101 -6.827 -14.522
677 HB3 GLN 89 1HB GLN 89 -6.017 -7.020 -16.011
678 HG2 GLN 89 2HG GLN 89 -8.106 -7.015 -14.711
679 HG3 GLN 89 1HG GLN 89 -7.172 -6.776 -13.235
680 HE21 GLN 89 1HE2 GLN 89 -8.296 -5.326 -16.176
681 HE22 GLN 89 2HE2 GLN 89 -7.924 -3.693 -15.748
682 H LYS 90 H LYS 90 -4.062 -8.757 -13.098
683 HA LYS 90 HA LYS 90 -5.741 -9.613 -10.822
684 HB2 LYS 90 2HB LYS 90 -3.681 -10.363 -9.753
685 HB3 LYS 90 1HB LYS 90 -3.848 -11.093 -11.342
686 HG2 LYS 90 2HG LYS 90 -2.244 -9.500 -12.268
687 HG3 LYS 90 1HG LYS 90 -2.094 -8.721 -10.693
688 HD2 LYS 90 2HD LYS 90 -0.218 -10.204 -11.055
689 HD3 LYS 90 1HD LYS 90 -1.230 -10.837 -9.756
690 HE2 LYS 90 2HE LYS 90 -2.242 -12.429 -11.311
691 HE3 LYS 90 1HE LYS 90 -1.275 -11.771 -12.632
692 HZ1 LYS 90 3HZ LYS 90 0.727 -12.473 -11.467
693 HZ2 LYS 90 1HZ LYS 90 -0.296 -13.792 -11.748
694 HZ3 LYS 90 2HZ LYS 90 -0.203 -13.112 -10.206
695 H ALA 91 H ALA 91 -5.797 -8.408 -8.932
696 HA ALA 91 HA ALA 91 -4.507 -5.755 -9.007
697 HB1 ALA 91 3HB ALA 91 -6.967 -5.725 -8.974
698 HB2 ALA 91 1HB ALA 91 -6.280 -4.988 -7.527
699 HB3 ALA 91 2HB ALA 91 -6.952 -6.616 -7.452
700 H LEU 92 H LEU 92 -3.205 -5.102 -7.350
701 HA LEU 92 HA LEU 92 -2.214 -7.136 -5.553
702 HB2 LEU 92 2HB LEU 92 -0.660 -5.652 -6.686
703 HB3 LEU 92 1HB LEU 92 -1.428 -4.249 -5.967
704 HG LEU 92 HG LEU 92 -0.716 -5.125 -3.708
705 HD11 LEU 92 1HD1 LEU 92 0.969 -6.999 -5.378
706 HD12 LEU 92 2HD1 LEU 92 -0.371 -7.467 -4.331
707 HD13 LEU 92 3HD1 LEU 92 1.090 -6.770 -3.632
708 HD21 LEU 92 3HD2 LEU 92 0.473 -3.315 -4.837
709 HD22 LEU 92 1HD2 LEU 92 1.470 -4.488 -5.698
710 HD23 LEU 92 2HD2 LEU 92 1.592 -4.343 -3.944
711 H TYR 93 H TYR 93 -3.087 -7.529 -3.608
712 HA TYR 93 HA TYR 93 -4.339 -5.303 -2.127
713 HB2 TYR 93 2HB TYR 93 -4.775 -8.288 -1.951
714 HB3 TYR 93 1HB TYR 93 -5.384 -7.164 -0.739
715 HD1 TYR 93 HD1 TYR 93 -5.618 -8.109 -4.323
716 HD2 TYR 93 HD2 TYR 93 -7.334 -5.866 -1.131
717 HE1 TYR 93 HE1 TYR 93 -7.598 -7.655 -5.707
718 HE2 TYR 93 HE2 TYR 93 -9.320 -5.420 -2.505
719 HH TYR 93 HH TYR 93 -10.051 -7.089 -5.281
720 H LEU 94 H LEU 94 -3.757 -4.864 -0.019
721 HA LEU 94 HA LEU 94 -1.189 -6.043 0.863
722 HB2 LEU 94 2HB LEU 94 -2.012 -3.146 1.139
723 HB3 LEU 94 1HB LEU 94 -0.440 -3.837 1.492
724 HG LEU 94 HG LEU 94 -1.672 -3.611 -1.262
725 HD11 LEU 94 1HD1 LEU 94 -0.005 -1.890 -1.677
726 HD12 LEU 94 2HD1 LEU 94 0.565 -2.021 -0.012
727 HD13 LEU 94 3HD1 LEU 94 -1.064 -1.431 -0.346
728 HD21 LEU 94 3HD2 LEU 94 -0.205 -5.530 -1.119
729 HD22 LEU 94 1HD2 LEU 94 1.065 -4.540 -0.398
730 HD23 LEU 94 2HD2 LEU 94 0.560 -4.255 -2.064
731 H ARG 95 H ARG 95 -0.864 -6.267 3.095
732 HA ARG 95 HA ARG 95 -2.779 -5.033 4.923
733 HB2 ARG 95 2HB ARG 95 -3.241 -7.028 6.172
734 HB3 ARG 95 1HB ARG 95 -3.650 -7.317 4.490
735 HG2 ARG 95 2HG ARG 95 -1.539 -8.554 4.208
736 HG3 ARG 95 1HG ARG 95 -1.180 -8.295 5.917
737 HD2 ARG 95 2HD ARG 95 -3.520 -9.823 4.768
738 HD3 ARG 95 1HD ARG 95 -2.129 -10.503 5.608
739 HE ARG 95 HE ARG 95 -2.955 -9.241 7.604
740 HH11 ARG 95 1HH1 ARG 95 -5.138 -10.175 5.105
741 HH12 ARG 95 2HH1 ARG 95 -6.492 -10.234 6.169
742 HH21 ARG 95 1HH2 ARG 95 -4.702 -9.309 8.944
743 HH22 ARG 95 2HH2 ARG 95 -6.262 -9.707 8.305
744 H ALA 96 H ALA 96 -2.035 -4.950 7.143
745 HA ALA 96 HA ALA 96 0.691 -4.130 7.199
746 HB1 ALA 96 3HB ALA 96 0.244 -3.486 9.516
747 HB2 ALA 96 1HB ALA 96 -1.292 -4.353 9.462
748 HB3 ALA 96 2HB ALA 96 -1.041 -2.939 8.438
749 H LYS 97 H LYS 97 2.458 -4.975 8.260
750 HA LYS 97 HA LYS 97 2.449 -7.788 8.900
751 HB2 LYS 97 2HB LYS 97 4.402 -6.761 7.818
752 HB3 LYS 97 1HB LYS 97 4.625 -5.698 9.199
753 HG2 LYS 97 2HG LYS 97 6.223 -7.442 9.384
754 HG3 LYS 97 1HG LYS 97 4.991 -7.736 10.610
755 HD2 LYS 97 2HD LYS 97 5.524 -9.836 9.566
756 HD3 LYS 97 1HD LYS 97 3.908 -9.359 9.041
757 HE2 LYS 97 2HE LYS 97 5.176 -10.212 7.158
758 HE3 LYS 97 1HE LYS 97 4.878 -8.487 6.940
759 HZ1 LYS 97 3HZ LYS 97 7.399 -9.725 7.898
760 HZ2 LYS 97 1HZ LYS 97 7.128 -8.062 7.768
761 HZ3 LYS 97 2HZ LYS 97 7.148 -9.022 6.380
762 H LEU 98 H LEU 98 1.399 -8.321 10.750
763 HA LEU 98 HA LEU 98 1.663 -6.643 13.126
764 HB2 LEU 98 2HB LEU 98 0.035 -9.152 12.652
765 HB3 LEU 98 1HB LEU 98 -0.010 -8.177 14.111
766 HG LEU 98 HG LEU 98 -0.877 -7.282 11.354
767 HD11 LEU 98 1HD1 LEU 98 -3.126 -7.230 12.336
768 HD12 LEU 98 2HD1 LEU 98 -2.481 -7.898 13.835
769 HD13 LEU 98 3HD1 LEU 98 -2.438 -8.854 12.354
770 HD21 LEU 98 3HD2 LEU 98 -1.669 -5.248 12.480
771 HD22 LEU 98 1HD2 LEU 98 0.081 -5.424 12.610
772 HD23 LEU 98 2HD2 LEU 98 -0.949 -5.805 13.991
773 H GLU 99 H GLU 99 3.375 -6.935 14.380
774 HA GLU 99 HA GLU 99 4.943 -9.345 14.393
775 HB2 GLU 99 2HB GLU 99 6.358 -8.150 16.011
776 HB3 GLU 99 1HB GLU 99 6.002 -7.154 14.608
777 HG2 GLU 99 2HG GLU 99 4.356 -5.901 15.861
778 HG3 GLU 99 1HG GLU 99 4.567 -6.958 17.255
779 H HIS 100 H HIS 100 2.329 -9.943 15.259
780 HA HIS 100 HA HIS 100 1.222 -11.185 16.782
781 HB2 HIS 100 2HB HIS 100 3.377 -12.423 16.931
782 HB3 HIS 100 1HB HIS 100 3.848 -11.385 18.273
783 HD1 HIS 100 HD1 HIS 100 3.485 -12.465 20.450
784 HD2 HIS 100 HD2 HIS 100 0.717 -13.753 17.633
785 HE1 HIS 100 HE1 HIS 100 2.059 -14.151 21.638
786 HE2 HIS 100 HE2 HIS 100 0.333 -14.850 19.946
787 H HIS 101 H HIS 101 2.675 -8.250 17.682
788 HA HIS 101 HA HIS 101 1.539 -8.044 20.300
789 HB2 HIS 101 2HB HIS 101 2.571 -5.942 18.380
790 HB3 HIS 101 1HB HIS 101 1.961 -5.566 19.986
791 HD1 HIS 101 HD1 HIS 101 4.687 -4.690 19.773
792 HD2 HIS 101 HD2 HIS 101 3.859 -8.682 20.545
793 HE1 HIS 101 HE1 HIS 101 6.773 -5.619 20.805
794 HE2 HIS 101 HE2 HIS 101 6.156 -7.960 21.473
795 H HIS 102 H HIS 102 -0.589 -8.769 19.977
796 HA HIS 102 HA HIS 102 -2.375 -7.226 18.277
797 HB2 HIS 102 2HB HIS 102 -2.531 -9.724 18.429
798 HB3 HIS 102 1HB HIS 102 -3.035 -9.552 20.110
799 HD1 HIS 102 HD1 HIS 102 -5.499 -9.342 20.476
800 HD2 HIS 102 HD2 HIS 102 -4.410 -8.410 16.574
801 HE1 HIS 102 HE1 HIS 102 -7.657 -8.981 19.238
802 HE2 HIS 102 HE2 HIS 102 -6.973 -8.516 16.860
803 H HIS 103 H HIS 103 -3.234 -5.383 19.036
804 HA HIS 103 HA HIS 103 -3.217 -4.566 21.718
805 HB2 HIS 103 2HB HIS 103 -4.915 -3.605 19.404
806 HB3 HIS 103 1HB HIS 103 -4.811 -2.788 20.962
807 HD1 HIS 103 HD1 HIS 103 -2.996 -3.254 17.764
808 HD2 HIS 103 HD2 HIS 103 -2.272 -1.578 21.493
809 HE1 HIS 103 HE1 HIS 103 -0.938 -1.855 17.483
810 HE2 HIS 103 HE2 HIS 103 -0.427 -0.985 19.784
811 H HIS 104 H HIS 104 -4.210 -5.558 23.304
812 HA HIS 104 HA HIS 104 -6.291 -7.421 23.027
813 HB2 HIS 104 2HB HIS 104 -4.799 -7.681 24.845
814 HB3 HIS 104 1HB HIS 104 -5.057 -6.034 25.404
815 HD1 HIS 104 HD1 HIS 104 -7.026 -9.275 25.099
816 HD2 HIS 104 HD2 HIS 104 -6.856 -5.840 27.431
817 HE1 HIS 104 HE1 HIS 104 -8.692 -9.625 26.936
818 HE2 HIS 104 HE2 HIS 104 -8.702 -7.469 28.218
819 H HIS 105 H HIS 105 -8.453 -7.335 23.213
820 HA HIS 105 HA HIS 105 -9.711 -4.822 24.132
821 HB2 HIS 105 2HB HIS 105 -10.610 -6.649 21.888
822 HB3 HIS 105 1HB HIS 105 -11.605 -5.362 22.560
823 HD1 HIS 105 HD1 HIS 105 -9.354 -5.979 19.862
824 HD2 HIS 105 HD2 HIS 105 -10.135 -2.730 22.335
825 HE1 HIS 105 HE1 HIS 105 -8.428 -3.978 18.664
826 HE2 HIS 105 HE2 HIS 105 -8.833 -2.041 20.212
Start of MODEL 3
1 H1 MET 1 1H MET 1 27.904 -23.651 -2.330
2 H2 MET 1 2H MET 1 27.279 -22.798 -1.009
3 H3 MET 1 3H MET 1 28.529 -22.127 -1.933
4 HA MET 1 HA MET 1 27.106 -21.970 -3.844
5 HB2 MET 1 2HB MET 1 25.015 -23.119 -1.981
6 HB3 MET 1 1HB MET 1 24.648 -22.378 -3.535
7 HG2 MET 1 2HG MET 1 24.687 -24.779 -3.763
8 HG3 MET 1 1HG MET 1 26.034 -24.071 -4.656
9 HE1 MET 1 3HE MET 1 26.350 -26.430 -0.717
10 HE2 MET 1 1HE MET 1 24.886 -26.254 -1.684
11 HE3 MET 1 2HE MET 1 25.533 -24.871 -0.800
12 H ASP 2 H ASP 2 26.638 -19.909 -4.189
13 HA ASP 2 HA ASP 2 25.600 -18.263 -1.966
14 HB2 ASP 2 2HB ASP 2 26.865 -16.357 -3.111
15 HB3 ASP 2 1HB ASP 2 27.844 -17.554 -2.269
16 H GLN 3 H GLN 3 24.566 -16.152 -2.871
17 HA GLN 3 HA GLN 3 22.776 -16.961 -5.067
18 HB2 GLN 3 2HB GLN 3 22.404 -14.931 -2.860
19 HB3 GLN 3 1HB GLN 3 21.270 -15.150 -4.186
20 HG2 GLN 3 2HG GLN 3 22.029 -17.239 -2.146
21 HG3 GLN 3 1HG GLN 3 20.528 -16.313 -2.178
22 HE21 GLN 3 1HE2 GLN 3 22.340 -18.875 -3.683
23 HE22 GLN 3 2HE2 GLN 3 21.038 -19.506 -4.624
24 H LYS 4 H LYS 4 24.524 -14.059 -3.896
25 HA LYS 4 HA LYS 4 25.408 -12.263 -4.979
26 HB2 LYS 4 2HB LYS 4 24.972 -13.929 -7.469
27 HB3 LYS 4 1HB LYS 4 25.870 -12.418 -7.425
28 HG2 LYS 4 2HG LYS 4 27.567 -13.370 -6.049
29 HG3 LYS 4 1HG LYS 4 26.614 -14.831 -5.781
30 HD2 LYS 4 2HD LYS 4 27.700 -13.931 -8.457
31 HD3 LYS 4 1HD LYS 4 28.439 -15.159 -7.426
32 HE2 LYS 4 2HE LYS 4 26.341 -16.483 -7.583
33 HE3 LYS 4 1HE LYS 4 25.707 -15.285 -8.710
34 HZ1 LYS 4 3HZ LYS 4 27.554 -15.791 -10.202
35 HZ2 LYS 4 1HZ LYS 4 26.625 -17.168 -9.887
36 HZ3 LYS 4 2HZ LYS 4 28.121 -16.964 -9.125
37 H SER 5 H SER 5 22.807 -13.433 -7.154
38 HA SER 5 HA SER 5 21.589 -10.988 -7.699
39 HB2 SER 5 2HB SER 5 20.966 -13.009 -8.899
40 HB3 SER 5 1HB SER 5 20.360 -13.748 -7.418
41 HG SER 5 HG SER 5 18.533 -12.942 -8.079
42 H SER 6 H SER 6 21.420 -12.993 -4.855
43 HA SER 6 HA SER 6 19.733 -10.955 -3.534
44 HB2 SER 6 2HB SER 6 19.894 -13.909 -2.844
45 HB3 SER 6 1HB SER 6 18.892 -12.706 -2.033
46 HG SER 6 HG SER 6 17.624 -12.542 -3.824
47 H SER 7 H SER 7 21.525 -9.737 -2.862
48 HA SER 7 HA SER 7 22.999 -10.769 -0.579
49 HB2 SER 7 2HB SER 7 24.419 -9.922 -3.128
50 HB3 SER 7 1HB SER 7 25.222 -10.161 -1.577
51 HG SER 7 HG SER 7 25.430 -12.055 -2.686
52 HA PRO 8 HA PRO 8 22.916 -6.462 0.603
53 HB2 PRO 8 2HB PRO 8 25.099 -6.238 2.179
54 HB3 PRO 8 1HB PRO 8 23.681 -7.175 2.664
55 HG2 PRO 8 2HG PRO 8 26.265 -8.142 1.472
56 HG3 PRO 8 1HG PRO 8 25.356 -8.798 2.849
57 HD2 PRO 8 2HD PRO 8 25.209 -9.864 0.354
58 HD3 PRO 8 1HD PRO 8 23.844 -9.897 1.489
59 H GLN 9 H GLN 9 24.587 -4.503 0.887
60 HA GLN 9 HA GLN 9 26.324 -4.435 -1.504
61 HB2 GLN 9 2HB GLN 9 24.468 -2.294 -0.449
62 HB3 GLN 9 1HB GLN 9 25.711 -1.981 -1.653
63 HG2 GLN 9 2HG GLN 9 23.489 -3.990 -1.998
64 HG3 GLN 9 1HG GLN 9 23.434 -2.331 -2.592
65 HE21 GLN 9 1HE2 GLN 9 24.919 -5.460 -2.979
66 HE22 GLN 9 2HE2 GLN 9 25.611 -5.153 -4.533
67 HA PRO 10 HA PRO 10 29.437 -3.391 1.536
68 HB2 PRO 10 2HB PRO 10 31.493 -2.980 -0.176
69 HB3 PRO 10 1HB PRO 10 30.873 -4.593 0.192
70 HG2 PRO 10 2HG PRO 10 30.286 -2.840 -2.175
71 HG3 PRO 10 1HG PRO 10 30.665 -4.573 -2.137
72 HD2 PRO 10 2HD PRO 10 28.129 -3.645 -2.352
73 HD3 PRO 10 1HD PRO 10 28.520 -5.158 -1.507
74 H ALA 11 H ALA 11 31.120 -1.607 1.838
75 HA ALA 11 HA ALA 11 29.726 0.837 1.993
76 HB1 ALA 11 3HB ALA 11 32.673 0.356 2.399
77 HB2 ALA 11 1HB ALA 11 31.417 0.089 3.607
78 HB3 ALA 11 2HB ALA 11 31.735 1.720 3.013
79 H ALA 12 H ALA 12 31.055 -0.349 -0.779
80 HA ALA 12 HA ALA 12 32.409 1.856 -1.895
81 HB1 ALA 12 3HB ALA 12 32.025 0.786 -4.044
82 HB2 ALA 12 1HB ALA 12 30.799 -0.260 -3.325
83 HB3 ALA 12 2HB ALA 12 32.487 -0.411 -2.834
84 H GLN 13 H GLN 13 29.036 1.323 -1.331
85 HA GLN 13 HA GLN 13 28.031 3.049 -3.381
86 HB2 GLN 13 2HB GLN 13 26.683 2.049 -0.863
87 HB3 GLN 13 1HB GLN 13 25.870 2.831 -2.212
88 HG2 GLN 13 2HG GLN 13 27.303 0.176 -2.278
89 HG3 GLN 13 1HG GLN 13 25.560 0.431 -2.308
90 HE21 GLN 13 1HE2 GLN 13 24.606 1.263 -4.204
91 HE22 GLN 13 2HE2 GLN 13 25.429 1.222 -5.721
92 H ALA 14 H ALA 14 27.348 5.150 -3.286
93 HA ALA 14 HA ALA 14 28.723 6.919 -1.557
94 HB1 ALA 14 3HB ALA 14 28.120 7.473 -3.871
95 HB2 ALA 14 1HB ALA 14 27.527 8.687 -2.735
96 HB3 ALA 14 2HB ALA 14 26.415 7.498 -3.418
97 HA PRO 15 HA PRO 15 26.167 7.555 2.004
98 HB2 PRO 15 2HB PRO 15 26.010 10.343 2.055
99 HB3 PRO 15 1HB PRO 15 27.321 9.372 2.734
100 HG2 PRO 15 2HG PRO 15 27.169 10.769 0.091
101 HG3 PRO 15 1HG PRO 15 28.540 10.625 1.208
102 HD2 PRO 15 2HD PRO 15 28.408 9.129 -0.999
103 HD3 PRO 15 1HD PRO 15 29.026 8.448 0.523
104 H GLU 16 H GLU 16 24.096 6.969 1.882
105 HA GLU 16 HA GLU 16 22.273 8.123 -0.030
106 HB2 GLU 16 2HB GLU 16 20.647 6.545 1.425
107 HB3 GLU 16 1HB GLU 16 21.665 5.946 0.130
108 HG2 GLU 16 2HG GLU 16 21.731 4.525 2.130
109 HG3 GLU 16 1HG GLU 16 23.312 5.166 1.697
110 H THR 17 H THR 17 20.380 9.257 0.382
111 HA THR 17 HA THR 17 20.386 10.976 2.702
112 HB THR 17 HB THR 17 18.306 10.750 0.499
113 HG1 THR 17 HG1 THR 17 19.580 12.876 0.016
114 HG21 THR 17 3HG2 THR 17 18.841 12.956 2.508
115 HG22 THR 17 1HG2 THR 17 17.447 11.874 2.506
116 HG23 THR 17 2HG2 THR 17 17.669 13.029 1.192
117 H LYS 18 H LYS 18 19.652 10.233 4.600
118 HA LYS 18 HA LYS 18 17.921 7.883 4.600
119 HB2 LYS 18 2HB LYS 18 19.994 7.689 5.791
120 HB3 LYS 18 1HB LYS 18 19.655 9.139 6.723
121 HG2 LYS 18 2HG LYS 18 17.920 8.043 7.947
122 HG3 LYS 18 1HG LYS 18 17.983 6.635 6.884
123 HD2 LYS 18 2HD LYS 18 19.125 6.278 9.063
124 HD3 LYS 18 1HD LYS 18 20.188 6.065 7.672
125 HE2 LYS 18 2HE LYS 18 20.882 8.504 8.043
126 HE3 LYS 18 1HE LYS 18 20.074 8.376 9.605
127 HZ1 LYS 18 3HZ LYS 18 22.461 7.919 9.735
128 HZ2 LYS 18 1HZ LYS 18 22.277 6.615 8.677
129 HZ3 LYS 18 2HZ LYS 18 21.546 6.579 10.203
130 H GLN 19 H GLN 19 15.845 8.060 4.900
131 HA GLN 19 HA GLN 19 14.823 9.852 7.003
132 HB2 GLN 19 2HB GLN 19 13.619 9.306 4.288
133 HB3 GLN 19 1HB GLN 19 12.656 9.914 5.629
134 HG2 GLN 19 2HG GLN 19 15.117 11.297 4.563
135 HG3 GLN 19 1HG GLN 19 13.467 11.671 4.056
136 HE21 GLN 19 1HE2 GLN 19 15.477 13.318 5.494
137 HE22 GLN 19 2HE2 GLN 19 14.688 13.825 6.945
138 H ALA 20 H ALA 20 13.305 8.974 8.397
139 HA ALA 20 HA ALA 20 13.143 6.065 8.386
140 HB1 ALA 20 3HB ALA 20 12.224 6.312 10.636
141 HB2 ALA 20 1HB ALA 20 12.162 8.063 10.428
142 HB3 ALA 20 2HB ALA 20 13.717 7.232 10.458
143 H PHE 21 H PHE 21 11.418 4.922 7.718
144 HA PHE 21 HA PHE 21 9.135 6.049 6.523
145 HB2 PHE 21 2HB PHE 21 9.599 3.255 7.607
146 HB3 PHE 21 1HB PHE 21 8.201 3.716 6.645
147 HD1 PHE 21 HD1 PHE 21 8.732 4.764 4.306
148 HD2 PHE 21 HD2 PHE 21 11.469 2.392 6.555
149 HE1 PHE 21 HE1 PHE 21 9.966 4.231 2.243
150 HE2 PHE 21 HE2 PHE 21 12.705 1.864 4.495
151 HZ PHE 21 HZ PHE 21 11.953 2.779 2.338
152 HA PRO 22 HA PRO 22 6.896 6.739 10.428
153 HB2 PRO 22 2HB PRO 22 4.964 8.350 9.425
154 HB3 PRO 22 1HB PRO 22 6.595 8.939 9.765
155 HG2 PRO 22 2HG PRO 22 5.372 8.150 7.146
156 HG3 PRO 22 1HG PRO 22 6.448 9.510 7.516
157 HD2 PRO 22 2HD PRO 22 7.283 7.153 6.369
158 HD3 PRO 22 1HD PRO 22 8.336 8.222 7.317
159 H ARG 23 H ARG 23 6.108 4.645 10.706
160 HA ARG 23 HA ARG 23 4.113 3.599 8.885
161 HB2 ARG 23 2HB ARG 23 4.221 1.548 10.357
162 HB3 ARG 23 1HB ARG 23 5.696 1.991 9.518
163 HG2 ARG 23 2HG ARG 23 6.581 2.962 11.589
164 HG3 ARG 23 1HG ARG 23 5.098 2.504 12.432
165 HD2 ARG 23 2HD ARG 23 5.535 0.173 12.091
166 HD3 ARG 23 1HD ARG 23 6.877 0.525 11.004
167 HE ARG 23 HE ARG 23 7.526 1.685 13.422
168 HH11 ARG 23 1HH1 ARG 23 6.847 -1.498 12.276
169 HH12 ARG 23 2HH1 ARG 23 7.920 -2.244 13.411
170 HH21 ARG 23 1HH2 ARG 23 8.891 0.703 14.862
171 HH22 ARG 23 2HH2 ARG 23 9.033 -1.021 14.874
172 H LYS 24 H LYS 24 4.077 5.182 11.952
173 HA LYS 24 HA LYS 24 1.694 4.335 13.075
174 HB2 LYS 24 2HB LYS 24 2.722 7.178 12.911
175 HB3 LYS 24 1HB LYS 24 1.485 6.612 14.026
176 HG2 LYS 24 2HG LYS 24 3.108 5.141 15.101
177 HG3 LYS 24 1HG LYS 24 4.350 5.662 13.961
178 HD2 LYS 24 2HD LYS 24 4.120 7.974 14.797
179 HD3 LYS 24 1HD LYS 24 2.917 7.420 15.964
180 HE2 LYS 24 2HE LYS 24 4.599 5.957 16.993
181 HE3 LYS 24 1HE LYS 24 5.800 6.524 15.831
182 HZ1 LYS 24 3HZ LYS 24 5.449 8.788 16.716
183 HZ2 LYS 24 1HZ LYS 24 6.055 7.714 17.877
184 HZ3 LYS 24 2HZ LYS 24 4.422 8.150 17.897
185 H PHE 25 H PHE 25 2.091 6.888 10.608
186 HA PHE 25 HA PHE 25 -0.757 7.180 10.250
187 HB2 PHE 25 2HB PHE 25 1.601 8.325 8.745
188 HB3 PHE 25 1HB PHE 25 -0.076 8.696 8.354
189 HD1 PHE 25 HD2 PHE 25 2.591 9.092 10.863
190 HD2 PHE 25 HD1 PHE 25 -1.368 10.186 9.723
191 HE1 PHE 25 HE2 PHE 25 2.605 10.895 12.538
192 HE2 PHE 25 HE1 PHE 25 -1.353 11.989 11.395
193 HZ PHE 25 HZ PHE 25 0.635 12.345 12.803
194 H VAL 26 H VAL 26 1.884 5.697 8.368
195 HA VAL 26 HA VAL 26 0.438 5.099 6.051
196 HB VAL 26 HB VAL 26 2.775 3.594 7.254
197 HG11 VAL 26 1HG1 VAL 26 1.603 3.412 4.470
198 HG12 VAL 26 2HG1 VAL 26 1.603 2.142 5.693
199 HG13 VAL 26 3HG1 VAL 26 3.123 2.683 4.987
200 HG21 VAL 26 3HG2 VAL 26 3.231 5.950 6.711
201 HG22 VAL 26 1HG2 VAL 26 2.670 5.678 5.061
202 HG23 VAL 26 2HG2 VAL 26 4.115 4.856 5.649
203 H LEU 27 H LEU 27 1.065 2.914 8.837
204 HA LEU 27 HA LEU 27 -0.538 0.784 7.944
205 HB2 LEU 27 2HB LEU 27 0.131 1.610 10.777
206 HB3 LEU 27 1HB LEU 27 -0.582 0.071 10.328
207 HG LEU 27 HG LEU 27 2.163 1.049 9.506
208 HD11 LEU 27 1HD1 LEU 27 2.995 -0.733 10.969
209 HD12 LEU 27 2HD1 LEU 27 1.341 -1.090 11.471
210 HD13 LEU 27 3HD1 LEU 27 2.065 0.469 11.863
211 HD21 LEU 27 3HD2 LEU 27 0.798 -1.596 8.988
212 HD22 LEU 27 1HD2 LEU 27 2.474 -1.205 8.596
213 HD23 LEU 27 2HD2 LEU 27 1.157 -0.356 7.786
214 H ALA 28 H ALA 28 -1.355 3.686 9.766
215 HA ALA 28 HA ALA 28 -4.016 3.043 10.434
216 HB1 ALA 28 3HB ALA 28 -2.795 4.925 11.439
217 HB2 ALA 28 1HB ALA 28 -4.339 5.438 10.758
218 HB3 ALA 28 2HB ALA 28 -2.838 5.773 9.893
219 H ALA 29 H ALA 29 -2.657 4.631 7.552
220 HA ALA 29 HA ALA 29 -5.166 5.079 6.266
221 HB1 ALA 29 3HB ALA 29 -2.398 4.882 5.069
222 HB2 ALA 29 1HB ALA 29 -3.162 6.350 5.679
223 HB3 ALA 29 2HB ALA 29 -3.828 5.531 4.265
224 H LEU 30 H LEU 30 -2.891 2.425 6.312
225 HA LEU 30 HA LEU 30 -3.954 0.941 4.147
226 HB2 LEU 30 2HB LEU 30 -1.690 0.666 5.136
227 HB3 LEU 30 1HB LEU 30 -2.421 -0.041 6.560
228 HG LEU 30 HG LEU 30 -3.179 -1.965 5.285
229 HD11 LEU 30 1HD1 LEU 30 -2.623 -2.246 2.926
230 HD12 LEU 30 2HD1 LEU 30 -1.944 -0.619 2.878
231 HD13 LEU 30 3HD1 LEU 30 -3.669 -0.847 3.166
232 HD21 LEU 30 3HD2 LEU 30 -0.978 -2.882 4.626
233 HD22 LEU 30 1HD2 LEU 30 -0.944 -2.076 6.194
234 HD23 LEU 30 2HD2 LEU 30 -0.285 -1.267 4.772
235 H GLU 31 H GLU 31 -4.434 0.595 7.683
236 HA GLU 31 HA GLU 31 -6.304 -1.508 7.541
237 HB2 GLU 31 2HB GLU 31 -6.906 -0.908 9.858
238 HB3 GLU 31 1HB GLU 31 -5.163 -0.973 9.625
239 HG2 GLU 31 2HG GLU 31 -5.021 1.426 9.567
240 HG3 GLU 31 1HG GLU 31 -6.776 1.572 9.600
241 H GLN 32 H GLN 32 -6.764 2.008 7.493
242 HA GLN 32 HA GLN 32 -9.619 1.897 7.698
243 HB2 GLN 32 2HB GLN 32 -7.717 4.105 6.907
244 HB3 GLN 32 1HB GLN 32 -9.460 4.332 6.989
245 HG2 GLN 32 2HG GLN 32 -9.443 3.759 9.357
246 HG3 GLN 32 1HG GLN 32 -7.704 3.475 9.288
247 HE21 GLN 32 1HE2 GLN 32 -6.316 5.233 9.149
248 HE22 GLN 32 2HE2 GLN 32 -6.834 6.845 9.481
249 H SER 33 H SER 33 -7.642 1.052 5.163
250 HA SER 33 HA SER 33 -9.827 1.507 3.218
251 HB2 SER 33 2HB SER 33 -8.095 1.356 1.432
252 HB3 SER 33 1HB SER 33 -7.823 2.711 2.527
253 HG SER 33 HG SER 33 -6.037 1.809 3.218
254 H SER 34 H SER 34 -8.461 -0.813 5.112
255 HA SER 34 HA SER 34 -8.232 -3.006 3.280
256 HB2 SER 34 2HB SER 34 -8.462 -2.989 6.304
257 HB3 SER 34 1HB SER 34 -8.067 -4.405 5.329
258 HG SER 34 HG SER 34 -6.492 -2.176 4.859
259 H ASP 35 H ASP 35 -9.707 -4.442 2.620
260 HA ASP 35 HA ASP 35 -12.497 -4.068 3.240
261 HB2 ASP 35 2HB ASP 35 -11.039 -6.061 1.482
262 HB3 ASP 35 1HB ASP 35 -12.793 -5.968 1.617
263 H ASP 36 H ASP 36 -13.595 -6.569 3.255
264 HA ASP 36 HA ASP 36 -13.601 -7.143 5.971
265 HB2 ASP 36 2HB ASP 36 -15.471 -7.691 4.498
266 HB3 ASP 36 1HB ASP 36 -14.500 -8.919 3.692
267 H ALA 37 H ALA 37 -11.716 -8.748 3.422
268 HA ALA 37 HA ALA 37 -10.849 -10.882 5.150
269 HB1 ALA 37 3HB ALA 37 -11.056 -11.170 2.716
270 HB2 ALA 37 1HB ALA 37 -9.446 -11.581 3.309
271 HB3 ALA 37 2HB ALA 37 -9.716 -10.046 2.485
272 H GLY 38 H GLY 38 -10.050 -7.705 5.247
273 HA2 GLY 38 2HA GLY 38 -8.439 -6.722 6.630
274 HA3 GLY 38 1HA GLY 38 -7.570 -8.247 6.679
275 H TRP 39 H TRP 39 -8.177 -7.726 3.503
276 HA TRP 39 HA TRP 39 -5.504 -6.606 3.052
277 HB2 TRP 39 2HB TRP 39 -7.412 -8.046 1.188
278 HB3 TRP 39 1HB TRP 39 -5.834 -7.432 0.712
279 HD1 TRP 39 HD1 TRP 39 -7.464 -10.217 2.787
280 HE1 TRP 39 HE1 TRP 39 -5.707 -12.046 3.227
281 HE3 TRP 39 HE3 TRP 39 -3.339 -7.833 0.930
282 HZ2 TRP 39 HZ2 TRP 39 -2.931 -12.420 2.843
283 HZ3 TRP 39 HZ3 TRP 39 -1.171 -8.994 1.006
284 HH2 TRP 39 HH2 TRP 39 -0.973 -11.240 1.943
285 H ALA 40 H ALA 40 -5.140 -4.727 1.939
286 HA ALA 40 HA ALA 40 -7.497 -3.174 1.060
287 HB1 ALA 40 3HB ALA 40 -6.231 -1.155 1.563
288 HB2 ALA 40 1HB ALA 40 -4.839 -2.128 2.044
289 HB3 ALA 40 2HB ALA 40 -6.329 -2.194 2.985
290 H ASN 41 H ASN 41 -7.623 -2.716 -1.061
291 HA ASN 41 HA ASN 41 -5.702 -3.590 -2.938
292 HB2 ASN 41 2HB ASN 41 -8.125 -3.348 -3.405
293 HB3 ASN 41 1HB ASN 41 -7.958 -1.598 -3.317
294 HD21 ASN 41 1HD2 ASN 41 -8.792 -3.425 -5.509
295 HD22 ASN 41 2HD2 ASN 41 -7.779 -3.010 -6.841
296 H LEU 42 H LEU 42 -4.011 -2.591 -3.908
297 HA LEU 42 HA LEU 42 -2.549 -0.584 -2.802
298 HB2 LEU 42 2HB LEU 42 -1.698 -2.058 -4.536
299 HB3 LEU 42 1HB LEU 42 -2.734 -1.308 -5.733
300 HG LEU 42 HG LEU 42 -1.465 0.814 -5.465
301 HD11 LEU 42 1HD1 LEU 42 0.681 0.782 -4.285
302 HD12 LEU 42 2HD1 LEU 42 0.335 -0.845 -3.699
303 HD13 LEU 42 3HD1 LEU 42 -0.673 0.509 -3.188
304 HD21 LEU 42 3HD2 LEU 42 0.190 -1.612 -6.185
305 HD22 LEU 42 1HD2 LEU 42 0.550 0.053 -6.647
306 HD23 LEU 42 2HD2 LEU 42 -0.904 -0.735 -7.258
307 H GLY 43 H GLY 43 -5.026 -0.143 -5.320
308 HA2 GLY 43 2HA GLY 43 -4.633 2.607 -5.786
309 HA3 GLY 43 1HA GLY 43 -6.128 1.731 -6.073
310 H ASN 44 H ASN 44 -6.739 0.964 -3.439
311 HA ASN 44 HA ASN 44 -7.913 3.367 -2.420
312 HB2 ASN 44 2HB ASN 44 -7.738 0.594 -1.208
313 HB3 ASN 44 1HB ASN 44 -8.738 1.902 -0.583
314 HD21 ASN 44 1HD2 ASN 44 -9.527 -0.721 -1.595
315 HD22 ASN 44 2HD2 ASN 44 -10.632 -0.410 -2.885
316 H PHE 45 H PHE 45 -5.260 1.278 -1.352
317 HA PHE 45 HA PHE 45 -4.602 2.563 1.039
318 HB2 PHE 45 2HB PHE 45 -3.645 0.416 0.466
319 HB3 PHE 45 1HB PHE 45 -2.842 1.098 -0.942
320 HD1 PHE 45 HD1 PHE 45 -3.031 2.197 2.636
321 HD2 PHE 45 HD2 PHE 45 -0.562 0.994 -0.623
322 HE1 PHE 45 HE1 PHE 45 -1.027 2.615 3.999
323 HE2 PHE 45 HE2 PHE 45 1.441 1.413 0.741
324 HZ PHE 45 HZ PHE 45 1.210 2.221 3.050
325 H GLY 46 H GLY 46 -3.096 3.070 -2.178
326 HA2 GLY 46 2HA GLY 46 -1.496 5.263 -1.450
327 HA3 GLY 46 1HA GLY 46 -2.036 4.898 -3.081
328 H ASN 47 H ASN 47 -4.884 5.124 -2.287
329 HA ASN 47 HA ASN 47 -5.315 7.865 -2.821
330 HB2 ASN 47 2HB ASN 47 -6.907 6.004 -3.355
331 HB3 ASN 47 1HB ASN 47 -7.271 5.868 -1.640
332 HD21 ASN 47 1HD2 ASN 47 -9.119 6.403 -3.705
333 HD22 ASN 47 2HD2 ASN 47 -9.798 7.965 -3.416
334 H TYR 48 H TYR 48 -6.126 6.030 0.153
335 HA TYR 48 HA TYR 48 -6.707 8.420 1.607
336 HB2 TYR 48 2HB TYR 48 -7.767 6.142 1.968
337 HB3 TYR 48 1HB TYR 48 -6.283 5.673 2.792
338 HD1 TYR 48 HD2 TYR 48 -9.075 8.128 2.886
339 HD2 TYR 48 HD1 TYR 48 -5.977 6.204 5.083
340 HE1 TYR 48 HE2 TYR 48 -9.955 9.096 4.966
341 HE2 TYR 48 HE1 TYR 48 -6.848 7.171 7.168
342 HH TYR 48 HH TYR 48 -9.892 8.586 7.415
343 H LEU 49 H LEU 49 -3.854 6.408 1.289
344 HA LEU 49 HA LEU 49 -2.435 7.170 3.570
345 HB2 LEU 49 2HB LEU 49 -1.677 5.374 2.123
346 HB3 LEU 49 1HB LEU 49 -1.395 6.505 0.813
347 HG LEU 49 HG LEU 49 0.410 7.573 2.097
348 HD11 LEU 49 1HD1 LEU 49 -0.122 5.438 4.167
349 HD12 LEU 49 2HD1 LEU 49 -0.420 7.167 4.355
350 HD13 LEU 49 3HD1 LEU 49 1.229 6.573 4.172
351 HD21 LEU 49 3HD2 LEU 49 0.723 4.577 1.880
352 HD22 LEU 49 1HD2 LEU 49 2.034 5.752 1.980
353 HD23 LEU 49 2HD2 LEU 49 0.963 5.744 0.579
354 H ASN 50 H ASN 50 -2.377 8.686 0.335
355 HA ASN 50 HA ASN 50 -0.542 10.713 1.057
356 HB2 ASN 50 2HB ASN 50 -0.929 10.041 -1.272
357 HB3 ASN 50 1HB ASN 50 -2.561 10.695 -1.198
358 HD21 ASN 50 1HD2 ASN 50 0.835 11.545 -0.974
359 HD22 ASN 50 2HD2 ASN 50 0.647 13.182 -1.482
360 H LYS 51 H LYS 51 -3.960 10.433 1.576
361 HA LYS 51 HA LYS 51 -4.540 13.175 2.040
362 HB2 LYS 51 2HB LYS 51 -5.808 10.719 3.277
363 HB3 LYS 51 1HB LYS 51 -6.471 12.346 3.342
364 HG2 LYS 51 2HG LYS 51 -6.670 12.327 0.869
365 HG3 LYS 51 1HG LYS 51 -6.087 10.660 0.866
366 HD2 LYS 51 2HD LYS 51 -8.508 10.673 0.730
367 HD3 LYS 51 1HD LYS 51 -8.008 10.015 2.291
368 HE2 LYS 51 2HE LYS 51 -8.385 12.279 3.282
369 HE3 LYS 51 1HE LYS 51 -9.035 12.799 1.728
370 HZ1 LYS 51 3HZ LYS 51 -10.824 12.177 3.180
371 HZ2 LYS 51 1HZ LYS 51 -10.128 10.669 3.478
372 HZ3 LYS 51 2HZ LYS 51 -10.721 11.030 1.943
373 H LEU 52 H LEU 52 -3.471 10.548 4.187
374 HA LEU 52 HA LEU 52 -3.383 12.227 6.521
375 HB2 LEU 52 2HB LEU 52 -2.147 9.502 6.070
376 HB3 LEU 52 1HB LEU 52 -2.352 10.295 7.621
377 HG LEU 52 HG LEU 52 -4.539 9.247 5.818
378 HD11 LEU 52 1HD1 LEU 52 -5.018 7.750 7.690
379 HD12 LEU 52 2HD1 LEU 52 -3.654 8.424 8.585
380 HD13 LEU 52 3HD1 LEU 52 -3.376 7.529 7.091
381 HD21 LEU 52 3HD2 LEU 52 -6.119 9.974 7.538
382 HD22 LEU 52 1HD2 LEU 52 -5.256 11.345 6.839
383 HD23 LEU 52 2HD2 LEU 52 -4.803 10.739 8.433
384 H GLN 53 H GLN 53 -0.940 10.889 4.303
385 HA GLN 53 HA GLN 53 1.018 12.811 5.408
386 HB2 GLN 53 2HB GLN 53 1.498 9.972 4.486
387 HB3 GLN 53 1HB GLN 53 2.793 11.131 4.758
388 HG2 GLN 53 2HG GLN 53 0.820 10.216 6.844
389 HG3 GLN 53 1HG GLN 53 2.459 9.598 6.650
390 HE21 GLN 53 1HE2 GLN 53 0.524 12.296 7.685
391 HE22 GLN 53 2HE2 GLN 53 1.797 13.156 8.472
392 HA PRO 54 HA PRO 54 0.805 13.833 0.909
393 HB2 PRO 54 2HB PRO 54 1.224 16.582 1.829
394 HB3 PRO 54 1HB PRO 54 -0.111 15.916 0.887
395 HG2 PRO 54 2HG PRO 54 -0.396 16.746 3.458
396 HG3 PRO 54 1HG PRO 54 -1.369 15.441 2.755
397 HD2 PRO 54 2HD PRO 54 1.027 15.262 4.557
398 HD3 PRO 54 1HD PRO 54 -0.474 14.308 4.577
399 H ASP 55 H ASP 55 3.004 14.391 3.497
400 HA ASP 55 HA ASP 55 5.156 15.499 1.934
401 HB2 ASP 55 2HB ASP 55 4.858 16.050 4.318
402 HB3 ASP 55 1HB ASP 55 5.114 14.362 4.747
403 H PHE 56 H PHE 56 3.967 12.334 2.499
404 HA PHE 56 HA PHE 56 6.528 10.997 2.547
405 HB2 PHE 56 2HB PHE 56 4.586 10.121 3.801
406 HB3 PHE 56 1HB PHE 56 3.749 9.817 2.285
407 HD1 PHE 56 HD1 PHE 56 6.932 8.979 4.046
408 HD2 PHE 56 HD2 PHE 56 3.900 7.701 1.334
409 HE1 PHE 56 HE1 PHE 56 7.950 6.742 3.963
410 HE2 PHE 56 HE2 PHE 56 4.919 5.460 1.249
411 HZ PHE 56 HZ PHE 56 6.947 4.979 2.564
412 H ASP 57 H ASP 57 7.678 11.050 0.726
413 HA ASP 57 HA ASP 57 6.372 10.319 -1.818
414 HB2 ASP 57 2HB ASP 57 7.160 12.556 -1.983
415 HB3 ASP 57 1HB ASP 57 8.695 12.151 -1.223
416 H SER 58 H SER 58 7.284 8.753 -3.104
417 HA SER 58 HA SER 58 8.993 6.838 -1.779
418 HB2 SER 58 2HB SER 58 7.848 6.798 -4.588
419 HB3 SER 58 1HB SER 58 8.626 5.439 -3.775
420 HG SER 58 HG SER 58 6.762 6.285 -2.137
421 H ARG 59 H ARG 59 9.400 9.289 -4.238
422 HA ARG 59 HA ARG 59 11.746 8.284 -5.465
423 HB2 ARG 59 2HB ARG 59 10.866 11.173 -5.210
424 HB3 ARG 59 1HB ARG 59 12.009 10.534 -6.385
425 HG2 ARG 59 2HG ARG 59 9.124 9.665 -6.224
426 HG3 ARG 59 1HG ARG 59 9.701 10.970 -7.261
427 HD2 ARG 59 2HD ARG 59 10.911 8.220 -7.389
428 HD3 ARG 59 1HD ARG 59 9.443 8.618 -8.283
429 HE ARG 59 HE ARG 59 10.818 10.447 -9.325
430 HH11 ARG 59 1HH1 ARG 59 12.337 7.613 -8.085
431 HH12 ARG 59 2HH1 ARG 59 13.642 7.687 -9.211
432 HH21 ARG 59 1HH2 ARG 59 12.495 10.524 -10.771
433 HH22 ARG 59 2HH2 ARG 59 13.738 9.323 -10.707
434 H LEU 60 H LEU 60 11.203 10.226 -2.596
435 HA LEU 60 HA LEU 60 13.731 11.101 -1.930
436 HB2 LEU 60 2HB LEU 60 11.659 9.902 -0.078
437 HB3 LEU 60 1HB LEU 60 13.028 10.866 0.440
438 HG LEU 60 HG LEU 60 10.763 11.856 -1.303
439 HD11 LEU 60 1HD1 LEU 60 11.350 12.347 1.619
440 HD12 LEU 60 2HD1 LEU 60 9.997 11.425 0.961
441 HD13 LEU 60 3HD1 LEU 60 10.102 13.160 0.673
442 HD21 LEU 60 3HD2 LEU 60 12.846 13.013 -1.783
443 HD22 LEU 60 1HD2 LEU 60 13.092 13.328 -0.066
444 HD23 LEU 60 2HD2 LEU 60 11.739 14.076 -0.915
445 H TYR 61 H TYR 61 12.466 7.823 -1.733
446 HA TYR 61 HA TYR 61 14.897 6.867 -0.390
447 HB2 TYR 61 2HB TYR 61 12.278 5.468 -0.990
448 HB3 TYR 61 1HB TYR 61 13.630 4.745 -0.127
449 HD1 TYR 61 HD1 TYR 61 11.003 7.347 0.052
450 HD2 TYR 61 HD2 TYR 61 14.024 5.231 2.185
451 HE1 TYR 61 HE1 TYR 61 10.125 8.233 2.173
452 HE2 TYR 61 HE2 TYR 61 13.147 6.110 4.305
453 HH TYR 61 HH TYR 61 11.812 7.949 5.133
454 H GLY 62 H GLY 62 13.949 7.342 -3.514
455 HA2 GLY 62 2HA GLY 62 15.363 6.732 -5.334
456 HA3 GLY 62 1HA GLY 62 15.822 5.278 -4.468
457 H TYR 63 H TYR 63 12.605 5.292 -4.067
458 HA TYR 63 HA TYR 63 12.196 3.408 -6.252
459 HB2 TYR 63 2HB TYR 63 10.322 4.220 -4.009
460 HB3 TYR 63 1HB TYR 63 10.068 2.886 -5.128
461 HD1 TYR 63 HD1 TYR 63 12.093 4.076 -2.281
462 HD2 TYR 63 HD2 TYR 63 11.193 0.767 -4.811
463 HE1 TYR 63 HE1 TYR 63 13.275 2.581 -0.731
464 HE2 TYR 63 HE2 TYR 63 12.373 -0.741 -3.262
465 HH TYR 63 HH TYR 63 14.187 -0.553 -1.508
466 H LYS 64 H LYS 64 10.887 3.740 -8.028
467 HA LYS 64 HA LYS 64 10.268 6.406 -8.762
468 HB2 LYS 64 2HB LYS 64 9.400 3.801 -10.027
469 HB3 LYS 64 1HB LYS 64 9.151 5.389 -10.743
470 HG2 LYS 64 2HG LYS 64 11.628 5.717 -10.702
471 HG3 LYS 64 1HG LYS 64 11.789 4.042 -10.174
472 HD2 LYS 64 2HD LYS 64 12.124 4.180 -12.574
473 HD3 LYS 64 1HD LYS 64 10.628 3.307 -12.235
474 HE2 LYS 64 2HE LYS 64 9.347 5.371 -12.673
475 HE3 LYS 64 1HE LYS 64 10.850 6.213 -13.052
476 HZ1 LYS 64 3HZ LYS 64 9.732 5.500 -15.052
477 HZ2 LYS 64 1HZ LYS 64 9.731 3.894 -14.528
478 HZ3 LYS 64 2HZ LYS 64 11.192 4.671 -14.890
479 H LYS 65 H LYS 65 8.350 3.894 -7.247
480 HA LYS 65 HA LYS 65 6.334 5.806 -6.559
481 HB2 LYS 65 2HB LYS 65 4.428 4.583 -7.576
482 HB3 LYS 65 1HB LYS 65 5.498 5.328 -8.753
483 HG2 LYS 65 2HG LYS 65 6.557 3.121 -9.133
484 HG3 LYS 65 1HG LYS 65 5.387 2.404 -8.022
485 HD2 LYS 65 2HD LYS 65 4.700 2.110 -10.363
486 HD3 LYS 65 1HD LYS 65 3.548 3.110 -9.474
487 HE2 LYS 65 2HE LYS 65 4.625 5.131 -10.419
488 HE3 LYS 65 1HE LYS 65 5.704 4.097 -11.352
489 HZ1 LYS 65 3HZ LYS 65 3.839 4.883 -12.667
490 HZ2 LYS 65 1HZ LYS 65 2.743 4.164 -11.604
491 HZ3 LYS 65 2HZ LYS 65 3.793 3.204 -12.519
492 H LEU 66 H LEU 66 4.450 4.694 -5.397
493 HA LEU 66 HA LEU 66 5.499 3.529 -3.093
494 HB2 LEU 66 2HB LEU 66 3.444 4.875 -3.196
495 HB3 LEU 66 1HB LEU 66 2.635 3.579 -4.053
496 HG LEU 66 HG LEU 66 2.894 2.129 -2.051
497 HD11 LEU 66 1HD1 LEU 66 4.881 3.208 -1.094
498 HD12 LEU 66 2HD1 LEU 66 3.570 3.088 0.077
499 HD13 LEU 66 3HD1 LEU 66 3.914 4.632 -0.702
500 HD21 LEU 66 3HD2 LEU 66 1.196 3.271 -0.688
501 HD22 LEU 66 1HD2 LEU 66 0.826 3.359 -2.411
502 HD23 LEU 66 2HD2 LEU 66 1.493 4.764 -1.578
503 H SER 67 H SER 67 3.937 1.975 -5.862
504 HA SER 67 HA SER 67 3.278 -0.493 -4.799
505 HB2 SER 67 2HB SER 67 3.491 -1.369 -7.121
506 HB3 SER 67 1HB SER 67 2.610 0.157 -7.042
507 HG SER 67 HG SER 67 4.315 -0.082 -8.718
508 H ASP 68 H ASP 68 6.336 0.313 -6.453
509 HA ASP 68 HA ASP 68 7.557 -2.198 -5.993
510 HB2 ASP 68 2HB ASP 68 8.209 -0.534 -7.766
511 HB3 ASP 68 1HB ASP 68 8.949 0.446 -6.503
512 H LEU 69 H LEU 69 7.432 0.764 -4.121
513 HA LEU 69 HA LEU 69 9.481 0.209 -2.259
514 HB2 LEU 69 2HB LEU 69 8.599 2.432 -2.429
515 HB3 LEU 69 1HB LEU 69 6.973 1.879 -2.073
516 HG LEU 69 HG LEU 69 7.689 1.325 0.238
517 HD11 LEU 69 1HD1 LEU 69 9.839 2.146 1.070
518 HD12 LEU 69 2HD1 LEU 69 10.296 2.616 -0.567
519 HD13 LEU 69 3HD1 LEU 69 10.053 0.915 -0.173
520 HD21 LEU 69 3HD2 LEU 69 7.858 3.634 1.034
521 HD22 LEU 69 1HD2 LEU 69 6.648 3.476 -0.239
522 HD23 LEU 69 2HD2 LEU 69 8.225 4.177 -0.605
523 H VAL 70 H VAL 70 5.959 -0.346 -2.033
524 HA VAL 70 HA VAL 70 5.940 -1.384 0.568
525 HB VAL 70 HB VAL 70 3.994 -2.017 -1.666
526 HG11 VAL 70 1HG1 VAL 70 3.649 -2.187 1.332
527 HG12 VAL 70 2HG1 VAL 70 3.788 -3.555 0.229
528 HG13 VAL 70 3HG1 VAL 70 2.395 -2.480 0.127
529 HG21 VAL 70 3HG2 VAL 70 3.891 0.171 0.419
530 HG22 VAL 70 1HG2 VAL 70 2.664 -0.166 -0.803
531 HG23 VAL 70 2HG2 VAL 70 4.262 0.401 -1.291
532 H LYS 71 H LYS 71 6.083 -3.143 -2.543
533 HA LYS 71 HA LYS 71 6.026 -5.744 -1.457
534 HB2 LYS 71 2HB LYS 71 6.977 -6.479 -3.627
535 HB3 LYS 71 1HB LYS 71 5.600 -5.401 -3.809
536 HG2 LYS 71 2HG LYS 71 6.999 -3.570 -4.405
537 HG3 LYS 71 1HG LYS 71 8.456 -4.461 -3.964
538 HD2 LYS 71 2HD LYS 71 6.575 -5.273 -6.183
539 HD3 LYS 71 1HD LYS 71 8.036 -4.312 -6.425
540 HE2 LYS 71 2HE LYS 71 9.345 -6.182 -5.395
541 HE3 LYS 71 1HE LYS 71 7.865 -7.141 -5.375
542 HZ1 LYS 71 3HZ LYS 71 9.108 -5.993 -7.810
543 HZ2 LYS 71 1HZ LYS 71 7.753 -7.000 -7.760
544 HZ3 LYS 71 2HZ LYS 71 9.268 -7.599 -7.315
545 H ALA 72 H ALA 72 8.653 -3.466 -1.802
546 HA ALA 72 HA ALA 72 10.725 -5.435 -1.289
547 HB1 ALA 72 3HB ALA 72 10.891 -2.420 -1.434
548 HB2 ALA 72 1HB ALA 72 11.157 -3.536 -2.776
549 HB3 ALA 72 2HB ALA 72 12.258 -3.536 -1.398
550 H ARG 73 H ARG 73 8.491 -3.995 0.665
551 HA ARG 73 HA ARG 73 10.295 -4.023 3.010
552 HB2 ARG 73 2HB ARG 73 7.867 -2.258 2.577
553 HB3 ARG 73 1HB ARG 73 8.868 -2.284 4.025
554 HG2 ARG 73 2HG ARG 73 9.808 -1.503 1.265
555 HG3 ARG 73 1HG ARG 73 9.389 -0.381 2.561
556 HD2 ARG 73 2HD ARG 73 11.233 -1.036 3.872
557 HD3 ARG 73 1HD ARG 73 11.500 -2.498 2.922
558 HE ARG 73 HE ARG 73 11.932 -0.595 1.099
559 HH11 ARG 73 1HH1 ARG 73 13.042 -0.828 4.344
560 HH12 ARG 73 2HH1 ARG 73 14.572 -0.114 3.987
561 HH21 ARG 73 1HH2 ARG 73 13.908 0.299 0.636
562 HH22 ARG 73 2HH2 ARG 73 15.062 0.525 1.906
563 H THR 74 H THR 74 9.184 -6.375 2.284
564 HA THR 74 HA THR 74 6.643 -7.058 3.189
565 HB THR 74 HB THR 74 7.489 -9.380 3.417
566 HG1 THR 74 HG1 THR 74 9.605 -9.795 3.469
567 HG21 THR 74 3HG2 THR 74 8.271 -9.648 1.086
568 HG22 THR 74 1HG2 THR 74 8.476 -7.899 0.970
569 HG23 THR 74 2HG2 THR 74 6.868 -8.586 1.199
570 H ASP 75 H ASP 75 9.546 -6.511 5.057
571 HA ASP 75 HA ASP 75 8.865 -7.657 7.503
572 HB2 ASP 75 2HB ASP 75 11.058 -6.710 7.128
573 HB3 ASP 75 1HB ASP 75 10.377 -5.106 6.877
574 H LEU 76 H LEU 76 7.912 -4.551 6.120
575 HA LEU 76 HA LEU 76 6.349 -3.837 8.483
576 HB2 LEU 76 2HB LEU 76 6.886 -2.327 5.918
577 HB3 LEU 76 1HB LEU 76 6.024 -1.685 7.304
578 HG LEU 76 HG LEU 76 8.926 -2.545 7.325
579 HD11 LEU 76 1HD1 LEU 76 9.422 -0.141 7.465
580 HD12 LEU 76 2HD1 LEU 76 7.712 0.218 7.219
581 HD13 LEU 76 3HD1 LEU 76 8.643 -0.573 5.945
582 HD21 LEU 76 3HD2 LEU 76 7.845 -2.786 9.501
583 HD22 LEU 76 1HD2 LEU 76 7.270 -1.119 9.412
584 HD23 LEU 76 2HD2 LEU 76 9.000 -1.455 9.513
585 H PHE 77 H PHE 77 5.845 -4.618 5.050
586 HA PHE 77 HA PHE 77 2.923 -4.573 5.511
587 HB2 PHE 77 2HB PHE 77 4.288 -3.810 2.918
588 HB3 PHE 77 1HB PHE 77 2.579 -3.650 3.312
589 HD1 PHE 77 HD1 PHE 77 2.316 -2.281 5.718
590 HD2 PHE 77 HD2 PHE 77 5.393 -1.791 2.803
591 HE1 PHE 77 HE1 PHE 77 2.722 0.006 6.525
592 HE2 PHE 77 HE2 PHE 77 5.798 0.496 3.616
593 HZ PHE 77 HZ PHE 77 4.464 1.395 5.478
594 H VAL 78 H VAL 78 1.792 -6.327 4.868
595 HA VAL 78 HA VAL 78 3.182 -8.561 3.606
596 HB VAL 78 HB VAL 78 0.302 -8.359 4.532
597 HG11 VAL 78 1HG1 VAL 78 0.325 -10.818 4.459
598 HG12 VAL 78 2HG1 VAL 78 1.958 -10.778 3.791
599 HG13 VAL 78 3HG1 VAL 78 0.611 -10.114 2.867
600 HG21 VAL 78 3HG2 VAL 78 1.841 -8.056 6.394
601 HG22 VAL 78 1HG2 VAL 78 2.711 -9.521 5.938
602 HG23 VAL 78 2HG2 VAL 78 1.044 -9.626 6.503
603 H THR 79 H THR 79 3.204 -8.826 1.438
604 HA THR 79 HA THR 79 1.218 -7.335 -0.181
605 HB THR 79 HB THR 79 2.960 -7.064 -1.895
606 HG1 THR 79 HG1 THR 79 5.175 -7.663 -0.597
607 HG21 THR 79 3HG2 THR 79 4.420 -5.510 -0.695
608 HG22 THR 79 1HG2 THR 79 3.919 -6.209 0.845
609 HG23 THR 79 2HG2 THR 79 2.752 -5.342 -0.152
610 H GLU 80 H GLU 80 -0.005 -8.459 -1.573
611 HA GLU 80 HA GLU 80 1.070 -10.784 -2.973
612 HB2 GLU 80 2HB GLU 80 -1.411 -10.923 -1.250
613 HB3 GLU 80 1HB GLU 80 -1.089 -12.070 -2.541
614 HG2 GLU 80 2HG GLU 80 0.993 -12.735 -1.405
615 HG3 GLU 80 1HG GLU 80 0.621 -11.611 -0.098
616 H GLU 81 H GLU 81 0.401 -10.842 -5.064
617 HA GLU 81 HA GLU 81 -1.608 -8.933 -5.974
618 HB2 GLU 81 2HB GLU 81 0.034 -10.903 -7.598
619 HB3 GLU 81 1HB GLU 81 -0.952 -9.596 -8.235
620 HG2 GLU 81 2HG GLU 81 0.514 -7.954 -7.188
621 HG3 GLU 81 1HG GLU 81 1.499 -9.253 -6.514
622 H ARG 82 H ARG 82 -3.698 -9.474 -6.227
623 HA ARG 82 HA ARG 82 -4.415 -12.344 -6.353
624 HB2 ARG 82 2HB ARG 82 -6.103 -10.110 -5.200
625 HB3 ARG 82 1HB ARG 82 -6.388 -11.840 -5.062
626 HG2 ARG 82 2HG ARG 82 -4.027 -10.397 -3.857
627 HG3 ARG 82 1HG ARG 82 -5.511 -10.784 -2.991
628 HD2 ARG 82 2HD ARG 82 -3.832 -12.900 -4.332
629 HD3 ARG 82 1HD ARG 82 -3.530 -12.360 -2.680
630 HE ARG 82 HE ARG 82 -6.189 -13.369 -3.411
631 HH11 ARG 82 1HH1 ARG 82 -3.257 -13.742 -1.636
632 HH12 ARG 82 2HH1 ARG 82 -3.933 -14.906 -0.556
633 HH21 ARG 82 1HH2 ARG 82 -7.040 -14.879 -2.032
634 HH22 ARG 82 2HH2 ARG 82 -6.046 -15.558 -0.785
635 H GLN 83 H GLN 83 -6.030 -12.970 -7.830
636 HA GLN 83 HA GLN 83 -6.416 -11.191 -10.071
637 HB2 GLN 83 2HB GLN 83 -6.032 -13.661 -10.324
638 HB3 GLN 83 1HB GLN 83 -7.636 -13.929 -9.654
639 HG2 GLN 83 2HG GLN 83 -8.546 -12.517 -11.522
640 HG3 GLN 83 1HG GLN 83 -6.935 -12.537 -12.231
641 HE21 GLN 83 1HE2 GLN 83 -9.422 -13.572 -13.304
642 HE22 GLN 83 2HE2 GLN 83 -9.159 -15.253 -13.598
643 H VAL 84 H VAL 84 -8.314 -10.209 -10.746
644 HA VAL 84 HA VAL 84 -10.320 -9.828 -8.665
645 HB VAL 84 HB VAL 84 -10.095 -8.488 -11.373
646 HG11 VAL 84 1HG1 VAL 84 -12.345 -8.348 -10.445
647 HG12 VAL 84 2HG1 VAL 84 -11.560 -6.770 -10.405
648 HG13 VAL 84 3HG1 VAL 84 -11.700 -7.723 -8.927
649 HG21 VAL 84 3HG2 VAL 84 -9.095 -6.596 -10.153
650 HG22 VAL 84 1HG2 VAL 84 -8.107 -8.050 -10.040
651 HG23 VAL 84 2HG2 VAL 84 -9.104 -7.554 -8.670
652 HA PRO 85 HA PRO 85 -12.951 -13.022 -10.400
653 HB2 PRO 85 2HB PRO 85 -15.252 -12.194 -9.070
654 HB3 PRO 85 1HB PRO 85 -14.028 -13.282 -8.408
655 HG2 PRO 85 2HG PRO 85 -14.361 -10.333 -8.012
656 HG3 PRO 85 1HG PRO 85 -13.926 -11.581 -6.828
657 HD2 PRO 85 2HD PRO 85 -12.064 -9.969 -7.860
658 HD3 PRO 85 1HD PRO 85 -11.715 -11.688 -7.574
659 H GLY 86 H GLY 86 -14.246 -13.163 -12.173
660 HA2 GLY 86 2HA GLY 86 -15.570 -12.526 -13.952
661 HA3 GLY 86 1HA GLY 86 -16.076 -11.135 -13.008
662 H SER 87 H SER 87 -12.721 -11.265 -13.234
663 HA SER 87 HA SER 87 -12.622 -9.601 -15.665
664 HB2 SER 87 2HB SER 87 -11.445 -8.869 -12.969
665 HB3 SER 87 1HB SER 87 -11.085 -8.022 -14.472
666 HG SER 87 HG SER 87 -13.352 -7.942 -12.879
667 H THR 88 H THR 88 -10.399 -9.290 -16.487
668 HA THR 88 HA THR 88 -8.866 -11.775 -16.219
669 HB THR 88 HB THR 88 -9.313 -11.178 -18.493
670 HG1 THR 88 HG1 THR 88 -7.297 -11.990 -18.503
671 HG21 THR 88 3HG2 THR 88 -8.542 -9.046 -19.485
672 HG22 THR 88 1HG2 THR 88 -8.055 -8.497 -17.881
673 HG23 THR 88 2HG2 THR 88 -9.758 -8.799 -18.231
674 H GLN 89 H GLN 89 -8.513 -8.337 -15.587
675 HA GLN 89 HA GLN 89 -5.691 -8.344 -15.195
676 HB2 GLN 89 2HB GLN 89 -5.975 -6.124 -14.278
677 HB3 GLN 89 1HB GLN 89 -7.012 -6.301 -15.690
678 HG2 GLN 89 2HG GLN 89 -8.944 -6.665 -14.238
679 HG3 GLN 89 1HG GLN 89 -7.908 -6.518 -12.818
680 HE21 GLN 89 1HE2 GLN 89 -9.426 -4.813 -15.437
681 HE22 GLN 89 2HE2 GLN 89 -9.177 -3.224 -14.809
682 H LYS 90 H LYS 90 -4.565 -7.979 -13.168
683 HA LYS 90 HA LYS 90 -5.894 -9.202 -10.829
684 HB2 LYS 90 2HB LYS 90 -3.744 -10.163 -10.181
685 HB3 LYS 90 1HB LYS 90 -4.192 -10.699 -11.794
686 HG2 LYS 90 2HG LYS 90 -2.672 -8.965 -12.735
687 HG3 LYS 90 1HG LYS 90 -2.158 -8.584 -11.092
688 HD2 LYS 90 2HD LYS 90 -1.799 -11.203 -12.559
689 HD3 LYS 90 1HD LYS 90 -0.540 -10.062 -12.086
690 HE2 LYS 90 2HE LYS 90 -1.119 -10.483 -9.710
691 HE3 LYS 90 1HE LYS 90 -2.268 -11.712 -10.240
692 HZ1 LYS 90 3HZ LYS 90 -0.172 -12.707 -9.601
693 HZ2 LYS 90 1HZ LYS 90 0.663 -11.749 -10.715
694 HZ3 LYS 90 2HZ LYS 90 -0.428 -12.916 -11.257
695 H ALA 91 H ALA 91 -5.663 -8.188 -8.859
696 HA ALA 91 HA ALA 91 -4.408 -5.514 -8.949
697 HB1 ALA 91 3HB ALA 91 -6.855 -5.510 -8.685
698 HB2 ALA 91 1HB ALA 91 -6.036 -4.811 -7.288
699 HB3 ALA 91 2HB ALA 91 -6.692 -6.448 -7.201
700 H LEU 92 H LEU 92 -3.027 -4.867 -7.363
701 HA LEU 92 HA LEU 92 -1.852 -6.900 -5.680
702 HB2 LEU 92 2HB LEU 92 -0.420 -5.310 -6.850
703 HB3 LEU 92 1HB LEU 92 -1.209 -3.966 -6.048
704 HG LEU 92 HG LEU 92 -0.339 -4.874 -3.859
705 HD11 LEU 92 1HD1 LEU 92 1.568 -6.427 -3.959
706 HD12 LEU 92 2HD1 LEU 92 1.288 -6.646 -5.686
707 HD13 LEU 92 3HD1 LEU 92 0.075 -7.176 -4.522
708 HD21 LEU 92 3HD2 LEU 92 1.708 -4.093 -5.938
709 HD22 LEU 92 1HD2 LEU 92 1.922 -3.998 -4.189
710 HD23 LEU 92 2HD2 LEU 92 0.719 -2.985 -4.987
711 H TYR 93 H TYR 93 -2.687 -7.390 -3.748
712 HA TYR 93 HA TYR 93 -4.078 -5.318 -2.192
713 HB2 TYR 93 2HB TYR 93 -4.142 -8.334 -2.041
714 HB3 TYR 93 1HB TYR 93 -4.838 -7.311 -0.789
715 HD1 TYR 93 HD1 TYR 93 -5.005 -7.954 -4.470
716 HD2 TYR 93 HD2 TYR 93 -7.029 -6.543 -0.996
717 HE1 TYR 93 HE1 TYR 93 -7.088 -7.771 -5.762
718 HE2 TYR 93 HE2 TYR 93 -9.118 -6.365 -2.279
719 HH TYR 93 HH TYR 93 -9.934 -6.239 -4.461
720 H LEU 94 H LEU 94 -3.400 -4.631 -0.275
721 HA LEU 94 HA LEU 94 -0.852 -5.684 0.804
722 HB2 LEU 94 2HB LEU 94 -1.760 -2.798 0.870
723 HB3 LEU 94 1HB LEU 94 -0.179 -3.424 1.297
724 HG LEU 94 HG LEU 94 -1.339 -3.378 -1.497
725 HD11 LEU 94 1HD1 LEU 94 0.279 -1.620 -1.950
726 HD12 LEU 94 2HD1 LEU 94 0.807 -1.646 -0.267
727 HD13 LEU 94 3HD1 LEU 94 -0.834 -1.136 -0.672
728 HD21 LEU 94 3HD2 LEU 94 1.418 -4.140 -0.535
729 HD22 LEU 94 1HD2 LEU 94 0.912 -4.000 -2.218
730 HD23 LEU 94 2HD2 LEU 94 0.198 -5.237 -1.185
731 H ARG 95 H ARG 95 -0.806 -6.014 3.035
732 HA ARG 95 HA ARG 95 -2.839 -4.646 4.653
733 HB2 ARG 95 2HB ARG 95 -3.453 -6.631 5.885
734 HB3 ARG 95 1HB ARG 95 -3.773 -6.871 4.175
735 HG2 ARG 95 2HG ARG 95 -1.854 -8.287 3.947
736 HG3 ARG 95 1HG ARG 95 -1.326 -7.918 5.591
737 HD2 ARG 95 2HD ARG 95 -3.870 -9.361 4.826
738 HD3 ARG 95 1HD ARG 95 -2.414 -10.109 5.485
739 HE ARG 95 HE ARG 95 -3.001 -8.327 7.385
740 HH11 ARG 95 1HH1 ARG 95 -5.018 -10.599 5.766
741 HH12 ARG 95 2HH1 ARG 95 -6.068 -10.794 7.124
742 HH21 ARG 95 1HH2 ARG 95 -4.357 -8.559 9.106
743 HH22 ARG 95 2HH2 ARG 95 -5.709 -9.639 9.001
744 H ALA 96 H ALA 96 -2.345 -4.410 6.867
745 HA ALA 96 HA ALA 96 0.348 -3.821 7.412
746 HB1 ALA 96 3HB ALA 96 -1.510 -2.713 8.547
747 HB2 ALA 96 1HB ALA 96 -0.386 -3.412 9.711
748 HB3 ALA 96 2HB ALA 96 -1.918 -4.218 9.370
749 H LYS 97 H LYS 97 1.911 -4.818 8.725
750 HA LYS 97 HA LYS 97 1.834 -7.691 8.666
751 HB2 LYS 97 2HB LYS 97 3.934 -6.649 8.170
752 HB3 LYS 97 1HB LYS 97 3.907 -5.728 9.667
753 HG2 LYS 97 2HG LYS 97 5.495 -7.512 9.886
754 HG3 LYS 97 1HG LYS 97 4.120 -7.855 10.933
755 HD2 LYS 97 2HD LYS 97 4.630 -9.908 9.907
756 HD3 LYS 97 1HD LYS 97 3.227 -9.304 9.025
757 HE2 LYS 97 2HE LYS 97 4.881 -10.209 7.483
758 HE3 LYS 97 1HE LYS 97 4.723 -8.467 7.255
759 HZ1 LYS 97 3HZ LYS 97 7.046 -9.342 7.289
760 HZ2 LYS 97 1HZ LYS 97 6.840 -9.703 8.929
761 HZ3 LYS 97 2HZ LYS 97 6.750 -8.098 8.395
762 H LEU 98 H LEU 98 0.263 -8.404 10.079
763 HA LEU 98 HA LEU 98 0.697 -7.984 12.945
764 HB2 LEU 98 2HB LEU 98 -1.304 -9.740 11.495
765 HB3 LEU 98 1HB LEU 98 -1.249 -9.489 13.229
766 HG LEU 98 HG LEU 98 -1.852 -7.363 11.164
767 HD11 LEU 98 1HD1 LEU 98 -3.674 -8.958 11.382
768 HD12 LEU 98 2HD1 LEU 98 -4.118 -7.411 12.098
769 HD13 LEU 98 3HD1 LEU 98 -3.663 -8.763 13.136
770 HD21 LEU 98 3HD2 LEU 98 -2.408 -5.946 13.090
771 HD22 LEU 98 1HD2 LEU 98 -0.708 -6.417 13.092
772 HD23 LEU 98 2HD2 LEU 98 -1.845 -7.212 14.181
773 H GLU 99 H GLU 99 2.486 -9.020 13.628
774 HA GLU 99 HA GLU 99 3.181 -11.586 12.359
775 HB2 GLU 99 2HB GLU 99 4.673 -9.587 12.023
776 HB3 GLU 99 1HB GLU 99 5.029 -9.633 13.742
777 HG2 GLU 99 2HG GLU 99 6.157 -11.697 13.556
778 HG3 GLU 99 1HG GLU 99 5.536 -11.976 11.929
779 H HIS 100 H HIS 100 3.111 -13.365 13.554
780 HA HIS 100 HA HIS 100 2.494 -13.309 16.341
781 HB2 HIS 100 2HB HIS 100 3.390 -15.663 14.653
782 HB3 HIS 100 1HB HIS 100 2.582 -15.751 16.214
783 HD1 HIS 100 HD1 HIS 100 1.908 -15.714 12.647
784 HD2 HIS 100 HD2 HIS 100 -0.149 -14.651 16.101
785 HE1 HIS 100 HE1 HIS 100 -0.501 -15.535 11.970
786 HE2 HIS 100 HE2 HIS 100 -1.707 -14.765 14.040
787 H HIS 101 H HIS 101 3.940 -12.767 17.851
788 HA HIS 101 HA HIS 101 6.798 -13.201 17.296
789 HB2 HIS 101 2HB HIS 101 6.049 -10.870 17.551
790 HB3 HIS 101 1HB HIS 101 5.470 -11.234 19.172
791 HD1 HIS 101 HD1 HIS 101 8.685 -10.951 17.205
792 HD2 HIS 101 HD2 HIS 101 7.378 -11.076 21.149
793 HE1 HIS 101 HE1 HIS 101 10.706 -10.427 18.599
794 HE2 HIS 101 HE2 HIS 101 9.904 -10.531 20.982
795 H HIS 102 H HIS 102 6.826 -15.366 18.062
796 HA HIS 102 HA HIS 102 7.324 -16.985 19.576
797 HB2 HIS 102 2HB HIS 102 9.232 -15.406 19.770
798 HB3 HIS 102 1HB HIS 102 8.431 -14.640 21.136
799 HD1 HIS 102 HD1 HIS 102 8.366 -15.970 23.365
800 HD2 HIS 102 HD2 HIS 102 10.508 -17.816 20.324
801 HE1 HIS 102 HE1 HIS 102 9.686 -17.786 24.482
802 HE2 HIS 102 HE2 HIS 102 11.133 -18.733 22.657
803 H HIS 103 H HIS 103 4.908 -17.183 20.021
804 HA HIS 103 HA HIS 103 4.554 -17.303 22.889
805 HB2 HIS 103 2HB HIS 103 2.950 -15.401 21.210
806 HB3 HIS 103 1HB HIS 103 2.196 -16.175 22.600
807 HD1 HIS 103 HD1 HIS 103 4.582 -13.490 21.676
808 HD2 HIS 103 HD2 HIS 103 3.316 -15.443 25.117
809 HE1 HIS 103 HE1 HIS 103 5.384 -12.081 23.585
810 HE2 HIS 103 HE2 HIS 103 4.525 -13.225 25.649
811 H HIS 104 H HIS 104 3.413 -19.029 23.485
812 HA HIS 104 HA HIS 104 1.638 -20.339 21.512
813 HB2 HIS 104 2HB HIS 104 3.723 -21.624 21.716
814 HB3 HIS 104 1HB HIS 104 3.530 -21.689 23.464
815 HD1 HIS 104 HD1 HIS 104 1.613 -23.238 24.381
816 HD2 HIS 104 HD2 HIS 104 2.285 -23.532 20.290
817 HE1 HIS 104 HE1 HIS 104 0.424 -25.325 23.656
818 HE2 HIS 104 HE2 HIS 104 0.891 -25.519 21.191
819 H HIS 105 H HIS 105 -0.407 -20.635 22.238
820 HA HIS 105 HA HIS 105 -1.174 -19.715 24.799
821 HB2 HIS 105 2HB HIS 105 -3.448 -20.609 24.225
822 HB3 HIS 105 1HB HIS 105 -2.768 -19.500 23.047
823 HD1 HIS 105 HD1 HIS 105 -2.554 -20.336 20.673
824 HD2 HIS 105 HD2 HIS 105 -3.540 -23.349 23.357
825 HE1 HIS 105 HE1 HIS 105 -3.153 -22.323 19.267
826 HE2 HIS 105 HE2 HIS 105 -3.940 -24.054 20.903
Start of MODEL 4
1 H1 MET 1 1H MET 1 27.397 20.080 -37.445
2 H2 MET 1 2H MET 1 28.475 19.312 -38.496
3 H3 MET 1 3H MET 1 28.112 18.612 -37.000
4 HA MET 1 HA MET 1 26.210 19.014 -39.239
5 HB2 MET 1 2HB MET 1 27.451 16.475 -38.146
6 HB3 MET 1 1HB MET 1 26.205 16.539 -39.387
7 HG2 MET 1 2HG MET 1 28.381 16.165 -40.374
8 HG3 MET 1 1HG MET 1 27.744 17.734 -40.868
9 HE1 MET 1 3HE MET 1 30.175 18.454 -41.699
10 HE2 MET 1 1HE MET 1 30.804 16.883 -41.208
11 HE3 MET 1 2HE MET 1 31.618 18.359 -40.688
12 H ASP 2 H ASP 2 26.559 16.902 -36.371
13 HA ASP 2 HA ASP 2 23.778 17.571 -35.649
14 HB2 ASP 2 2HB ASP 2 23.730 15.370 -34.501
15 HB3 ASP 2 1HB ASP 2 24.027 15.231 -36.229
16 H GLN 3 H GLN 3 23.428 18.622 -33.776
17 HA GLN 3 HA GLN 3 25.705 19.158 -32.033
18 HB2 GLN 3 2HB GLN 3 24.261 21.031 -32.774
19 HB3 GLN 3 1HB GLN 3 22.905 20.306 -31.915
20 HG2 GLN 3 2HG GLN 3 24.143 20.538 -29.799
21 HG3 GLN 3 1HG GLN 3 25.470 21.300 -30.672
22 HE21 GLN 3 1HE2 GLN 3 23.828 22.340 -28.515
23 HE22 GLN 3 2HE2 GLN 3 23.117 23.795 -29.112
24 H LYS 4 H LYS 4 26.107 17.644 -30.546
25 HA LYS 4 HA LYS 4 23.908 16.288 -29.165
26 HB2 LYS 4 2HB LYS 4 26.901 15.825 -29.077
27 HB3 LYS 4 1HB LYS 4 25.705 14.858 -28.222
28 HG2 LYS 4 2HG LYS 4 24.783 14.049 -30.278
29 HG3 LYS 4 1HG LYS 4 25.761 15.177 -31.218
30 HD2 LYS 4 2HD LYS 4 26.671 12.895 -31.288
31 HD3 LYS 4 1HD LYS 4 27.796 14.025 -30.537
32 HE2 LYS 4 2HE LYS 4 27.108 13.237 -28.322
33 HE3 LYS 4 1HE LYS 4 25.957 12.128 -29.067
34 HZ1 LYS 4 3HZ LYS 4 28.903 12.044 -29.454
35 HZ2 LYS 4 1HZ LYS 4 27.779 10.957 -30.098
36 HZ3 LYS 4 2HZ LYS 4 28.024 11.030 -28.427
37 H SER 5 H SER 5 23.152 17.968 -27.815
38 HA SER 5 HA SER 5 24.934 19.334 -26.005
39 HB2 SER 5 2HB SER 5 22.887 20.428 -26.858
40 HB3 SER 5 1HB SER 5 21.903 19.250 -25.989
41 HG SER 5 HG SER 5 22.166 20.369 -24.238
42 H SER 6 H SER 6 25.859 17.322 -25.135
43 HA SER 6 HA SER 6 24.783 16.610 -22.597
44 HB2 SER 6 2HB SER 6 24.304 14.233 -23.007
45 HB3 SER 6 1HB SER 6 23.261 15.245 -24.005
46 HG SER 6 HG SER 6 25.433 14.794 -25.419
47 H SER 7 H SER 7 26.317 15.660 -21.309
48 HA SER 7 HA SER 7 29.004 15.423 -22.366
49 HB2 SER 7 2HB SER 7 27.938 14.975 -19.561
50 HB3 SER 7 1HB SER 7 29.643 14.967 -20.006
51 HG SER 7 HG SER 7 29.525 17.026 -19.623
52 HA PRO 8 HA PRO 8 28.708 11.058 -23.362
53 HB2 PRO 8 2HB PRO 8 31.453 10.568 -23.031
54 HB3 PRO 8 1HB PRO 8 30.651 11.038 -24.529
55 HG2 PRO 8 2HG PRO 8 32.136 12.724 -22.563
56 HG3 PRO 8 1HG PRO 8 32.064 12.854 -24.330
57 HD2 PRO 8 2HD PRO 8 30.698 14.538 -22.755
58 HD3 PRO 8 1HD PRO 8 30.012 13.957 -24.290
59 H GLN 9 H GLN 9 30.533 12.195 -20.534
60 HA GLN 9 HA GLN 9 29.501 9.860 -19.043
61 HB2 GLN 9 2HB GLN 9 32.204 11.193 -18.794
62 HB3 GLN 9 1HB GLN 9 31.558 10.107 -17.571
63 HG2 GLN 9 2HG GLN 9 32.035 9.352 -20.454
64 HG3 GLN 9 1HG GLN 9 33.153 9.032 -19.131
65 HE21 GLN 9 1HE2 GLN 9 30.151 8.152 -20.612
66 HE22 GLN 9 2HE2 GLN 9 29.885 6.718 -19.691
67 HA PRO 10 HA PRO 10 27.797 13.622 -16.970
68 HB2 PRO 10 2HB PRO 10 25.589 11.782 -16.317
69 HB3 PRO 10 1HB PRO 10 25.537 13.334 -17.155
70 HG2 PRO 10 2HG PRO 10 25.111 11.008 -18.446
71 HG3 PRO 10 1HG PRO 10 25.923 12.378 -19.229
72 HD2 PRO 10 2HD PRO 10 27.125 9.906 -18.013
73 HD3 PRO 10 1HD PRO 10 27.531 10.720 -19.542
74 H ALA 11 H ALA 11 27.864 14.100 -14.788
75 HA ALA 11 HA ALA 11 29.325 12.470 -13.055
76 HB1 ALA 11 3HB ALA 11 28.740 14.074 -11.305
77 HB2 ALA 11 1HB ALA 11 27.470 14.744 -12.329
78 HB3 ALA 11 2HB ALA 11 29.162 14.900 -12.805
79 H ALA 12 H ALA 12 28.694 10.522 -12.348
80 HA ALA 12 HA ALA 12 26.015 9.653 -12.100
81 HB1 ALA 12 3HB ALA 12 27.890 8.115 -12.463
82 HB2 ALA 12 1HB ALA 12 26.949 7.656 -11.044
83 HB3 ALA 12 2HB ALA 12 28.500 8.471 -10.847
84 H GLN 13 H GLN 13 24.553 10.087 -10.559
85 HA GLN 13 HA GLN 13 25.404 11.358 -8.078
86 HB2 GLN 13 2HB GLN 13 22.657 10.885 -9.253
87 HB3 GLN 13 1HB GLN 13 22.947 11.705 -7.722
88 HG2 GLN 13 2HG GLN 13 23.949 12.614 -10.419
89 HG3 GLN 13 1HG GLN 13 22.565 13.281 -9.552
90 HE21 GLN 13 1HE2 GLN 13 22.924 14.556 -7.736
91 HE22 GLN 13 2HE2 GLN 13 24.469 15.243 -7.386
92 H ALA 14 H ALA 14 26.113 9.937 -6.581
93 HA ALA 14 HA ALA 14 24.905 7.368 -6.139
94 HB1 ALA 14 3HB ALA 14 26.454 7.200 -4.251
95 HB2 ALA 14 1HB ALA 14 26.871 8.905 -4.434
96 HB3 ALA 14 2HB ALA 14 27.285 7.754 -5.704
97 HA PRO 15 HA PRO 15 21.530 8.545 -3.538
98 HB2 PRO 15 2HB PRO 15 21.482 6.388 -1.807
99 HB3 PRO 15 1HB PRO 15 20.764 6.415 -3.419
100 HG2 PRO 15 2HG PRO 15 23.396 5.297 -2.536
101 HG3 PRO 15 1HG PRO 15 22.231 4.636 -3.699
102 HD2 PRO 15 2HD PRO 15 24.477 5.890 -4.499
103 HD3 PRO 15 1HD PRO 15 22.956 6.030 -5.409
104 H GLU 16 H GLU 16 22.251 10.321 -2.456
105 HA GLU 16 HA GLU 16 23.651 9.913 0.110
106 HB2 GLU 16 2HB GLU 16 24.876 11.319 -1.480
107 HB3 GLU 16 1HB GLU 16 23.486 12.380 -1.640
108 HG2 GLU 16 2HG GLU 16 25.223 13.344 -0.219
109 HG3 GLU 16 1HG GLU 16 23.718 13.095 0.665
110 H THR 17 H THR 17 22.878 10.912 1.974
111 HA THR 17 HA THR 17 21.355 11.683 3.474
112 HB THR 17 HB THR 17 19.869 12.857 1.103
113 HG1 THR 17 HG1 THR 17 20.921 14.810 2.368
114 HG21 THR 17 3HG2 THR 17 19.593 13.425 4.065
115 HG22 THR 17 1HG2 THR 17 18.403 12.611 3.049
116 HG23 THR 17 2HG2 THR 17 18.783 14.312 2.773
117 H LYS 18 H LYS 18 20.358 10.014 4.412
118 HA LYS 18 HA LYS 18 18.577 8.294 2.852
119 HB2 LYS 18 2HB LYS 18 20.260 7.162 4.160
120 HB3 LYS 18 1HB LYS 18 19.771 8.013 5.618
121 HG2 LYS 18 2HG LYS 18 17.561 6.868 5.476
122 HG3 LYS 18 1HG LYS 18 18.186 5.930 4.118
123 HD2 LYS 18 2HD LYS 18 19.875 4.925 5.515
124 HD3 LYS 18 1HD LYS 18 19.447 5.980 6.864
125 HE2 LYS 18 2HE LYS 18 17.651 3.891 5.624
126 HE3 LYS 18 1HE LYS 18 18.527 3.723 7.145
127 HZ1 LYS 18 3HZ LYS 18 16.258 4.339 7.569
128 HZ2 LYS 18 1HZ LYS 18 16.383 5.699 6.566
129 HZ3 LYS 18 2HZ LYS 18 17.269 5.623 8.007
130 H GLN 19 H GLN 19 16.439 7.991 3.243
131 HA GLN 19 HA GLN 19 15.080 9.897 4.998
132 HB2 GLN 19 2HB GLN 19 14.051 8.004 2.871
133 HB3 GLN 19 1HB GLN 19 13.008 9.014 3.859
134 HG2 GLN 19 2HG GLN 19 15.164 10.068 2.038
135 HG3 GLN 19 1HG GLN 19 13.462 9.925 1.598
136 HE21 GLN 19 1HE2 GLN 19 15.084 12.306 1.716
137 HE22 GLN 19 2HE2 GLN 19 14.331 13.360 2.861
138 H ALA 20 H ALA 20 13.516 9.265 6.538
139 HA ALA 20 HA ALA 20 13.755 6.487 7.517
140 HB1 ALA 20 3HB ALA 20 14.501 8.206 9.105
141 HB2 ALA 20 1HB ALA 20 13.083 7.345 9.705
142 HB3 ALA 20 2HB ALA 20 12.911 8.967 9.031
143 H PHE 21 H PHE 21 11.942 5.239 7.801
144 HA PHE 21 HA PHE 21 9.555 6.021 6.398
145 HB2 PHE 21 2HB PHE 21 10.341 3.508 7.879
146 HB3 PHE 21 1HB PHE 21 8.774 3.705 7.107
147 HD1 PHE 21 HD1 PHE 21 8.823 4.345 4.584
148 HD2 PHE 21 HD2 PHE 21 12.103 2.588 6.662
149 HE1 PHE 21 HE1 PHE 21 9.751 3.553 2.452
150 HE2 PHE 21 HE2 PHE 21 13.032 1.798 4.524
151 HZ PHE 21 HZ PHE 21 11.855 2.278 2.419
152 HA PRO 22 HA PRO 22 7.219 6.886 10.204
153 HB2 PRO 22 2HB PRO 22 5.283 8.374 9.074
154 HB3 PRO 22 1HB PRO 22 6.890 9.041 9.395
155 HG2 PRO 22 2HG PRO 22 5.685 8.168 6.815
156 HG3 PRO 22 1HG PRO 22 6.847 9.466 7.132
157 HD2 PRO 22 2HD PRO 22 7.439 6.874 6.168
158 HD3 PRO 22 1HD PRO 22 8.608 8.074 6.751
159 H ARG 23 H ARG 23 6.426 4.787 10.582
160 HA ARG 23 HA ARG 23 4.763 3.516 8.580
161 HB2 ARG 23 2HB ARG 23 4.858 1.530 10.023
162 HB3 ARG 23 1HB ARG 23 6.452 2.171 9.658
163 HG2 ARG 23 2HG ARG 23 6.604 3.158 11.864
164 HG3 ARG 23 1HG ARG 23 4.959 2.637 12.237
165 HD2 ARG 23 2HD ARG 23 5.637 0.298 12.025
166 HD3 ARG 23 1HD ARG 23 7.272 0.799 11.597
167 HE ARG 23 HE ARG 23 7.706 1.198 13.813
168 HH11 ARG 23 1HH1 ARG 23 4.291 0.893 13.420
169 HH12 ARG 23 2HH1 ARG 23 4.009 0.722 15.113
170 HH21 ARG 23 1HH2 ARG 23 7.307 0.956 15.984
171 HH22 ARG 23 2HH2 ARG 23 5.686 0.734 16.541
172 H LYS 24 H LYS 24 4.217 5.118 11.647
173 HA LYS 24 HA LYS 24 1.817 3.950 12.424
174 HB2 LYS 24 2HB LYS 24 2.754 6.804 12.742
175 HB3 LYS 24 1HB LYS 24 1.313 6.161 13.521
176 HG2 LYS 24 2HG LYS 24 2.778 4.426 14.593
177 HG3 LYS 24 1HG LYS 24 4.168 5.315 13.963
178 HD2 LYS 24 2HD LYS 24 3.543 7.281 15.224
179 HD3 LYS 24 1HD LYS 24 2.043 6.513 15.748
180 HE2 LYS 24 2HE LYS 24 3.438 4.763 16.877
181 HE3 LYS 24 1HE LYS 24 4.859 5.731 16.489
182 HZ1 LYS 24 3HZ LYS 24 3.981 7.529 17.795
183 HZ2 LYS 24 1HZ LYS 24 4.019 6.128 18.740
184 HZ3 LYS 24 2HZ LYS 24 2.553 6.678 18.101
185 H PHE 25 H PHE 25 2.092 6.999 10.562
186 HA PHE 25 HA PHE 25 -0.643 7.268 10.026
187 HB2 PHE 25 2HB PHE 25 1.759 8.320 8.516
188 HB3 PHE 25 1HB PHE 25 0.105 8.807 8.175
189 HD1 PHE 25 HD2 PHE 25 2.836 8.961 10.646
190 HD2 PHE 25 HD1 PHE 25 -1.065 10.323 9.607
191 HE1 PHE 25 HE2 PHE 25 2.983 10.700 12.381
192 HE2 PHE 25 HE1 PHE 25 -0.922 12.062 11.340
193 HZ PHE 25 HZ PHE 25 1.103 12.253 12.731
194 H VAL 26 H VAL 26 1.863 5.534 8.257
195 HA VAL 26 HA VAL 26 0.347 5.003 5.922
196 HB VAL 26 HB VAL 26 2.673 3.432 7.064
197 HG11 VAL 26 1HG1 VAL 26 2.987 2.633 4.758
198 HG12 VAL 26 2HG1 VAL 26 1.510 3.468 4.274
199 HG13 VAL 26 3HG1 VAL 26 1.431 2.128 5.421
200 HG21 VAL 26 3HG2 VAL 26 3.241 5.780 6.677
201 HG22 VAL 26 1HG2 VAL 26 2.631 5.667 5.024
202 HG23 VAL 26 2HG2 VAL 26 4.052 4.739 5.507
203 H LEU 27 H LEU 27 1.001 2.986 8.805
204 HA LEU 27 HA LEU 27 -0.662 0.828 8.037
205 HB2 LEU 27 2HB LEU 27 0.210 1.728 10.789
206 HB3 LEU 27 1HB LEU 27 -0.599 0.210 10.456
207 HG LEU 27 HG LEU 27 2.119 1.013 9.389
208 HD11 LEU 27 1HD1 LEU 27 2.977 -0.726 10.898
209 HD12 LEU 27 2HD1 LEU 27 1.356 -0.943 11.559
210 HD13 LEU 27 3HD1 LEU 27 2.199 0.590 11.774
211 HD21 LEU 27 3HD2 LEU 27 0.613 -1.596 9.146
212 HD22 LEU 27 1HD2 LEU 27 2.266 -1.300 8.604
213 HD23 LEU 27 2HD2 LEU 27 0.924 -0.449 7.842
214 H ALA 28 H ALA 28 -1.314 3.832 9.750
215 HA ALA 28 HA ALA 28 -3.958 3.293 10.573
216 HB1 ALA 28 3HB ALA 28 -2.651 5.212 11.384
217 HB2 ALA 28 1HB ALA 28 -4.218 5.706 10.748
218 HB3 ALA 28 2HB ALA 28 -2.759 5.952 9.787
219 H ALA 29 H ALA 29 -2.715 4.824 7.598
220 HA ALA 29 HA ALA 29 -5.205 5.135 6.302
221 HB1 ALA 29 3HB ALA 29 -3.133 6.272 5.594
222 HB2 ALA 29 1HB ALA 29 -3.907 5.413 4.262
223 HB3 ALA 29 2HB ALA 29 -2.485 4.726 5.046
224 H LEU 30 H LEU 30 -2.886 2.487 6.368
225 HA LEU 30 HA LEU 30 -3.963 0.844 4.390
226 HB2 LEU 30 2HB LEU 30 -1.753 0.563 5.436
227 HB3 LEU 30 1HB LEU 30 -2.525 0.051 6.923
228 HG LEU 30 HG LEU 30 -3.393 -1.955 5.811
229 HD11 LEU 30 1HD1 LEU 30 -2.657 -2.528 3.531
230 HD12 LEU 30 2HD1 LEU 30 -1.942 -0.924 3.368
231 HD13 LEU 30 3HD1 LEU 30 -3.687 -1.097 3.556
232 HD21 LEU 30 3HD2 LEU 30 -0.429 -1.542 5.393
233 HD22 LEU 30 1HD2 LEU 30 -1.254 -3.100 5.468
234 HD23 LEU 30 2HD2 LEU 30 -1.211 -2.058 6.889
235 H GLU 31 H GLU 31 -4.493 0.581 7.939
236 HA GLU 31 HA GLU 31 -6.377 -1.495 7.795
237 HB2 GLU 31 2HB GLU 31 -6.977 -0.926 10.090
238 HB3 GLU 31 1HB GLU 31 -5.234 -0.874 9.874
239 HG2 GLU 31 2HG GLU 31 -5.276 1.543 9.783
240 HG3 GLU 31 1HG GLU 31 -7.037 1.543 9.875
241 H GLN 32 H GLN 32 -6.848 2.013 7.676
242 HA GLN 32 HA GLN 32 -9.708 1.890 7.754
243 HB2 GLN 32 2HB GLN 32 -7.813 4.106 6.952
244 HB3 GLN 32 1HB GLN 32 -9.559 4.303 7.057
245 HG2 GLN 32 2HG GLN 32 -9.494 3.758 9.433
246 HG3 GLN 32 1HG GLN 32 -7.754 3.499 9.338
247 HE21 GLN 32 1HE2 GLN 32 -6.399 5.275 9.116
248 HE22 GLN 32 2HE2 GLN 32 -6.921 6.880 9.472
249 H SER 33 H SER 33 -7.369 1.508 5.240
250 HA SER 33 HA SER 33 -9.416 1.769 3.142
251 HB2 SER 33 2HB SER 33 -7.246 2.844 2.709
252 HB3 SER 33 1HB SER 33 -6.426 1.295 2.912
253 HG SER 33 HG SER 33 -7.700 0.539 1.108
254 H SER 34 H SER 34 -8.482 -0.568 5.217
255 HA SER 34 HA SER 34 -8.086 -2.803 3.462
256 HB2 SER 34 2HB SER 34 -8.708 -2.711 6.427
257 HB3 SER 34 1HB SER 34 -8.269 -4.169 5.537
258 HG SER 34 HG SER 34 -6.536 -2.046 5.215
259 H ASP 35 H ASP 35 -9.485 -4.329 2.770
260 HA ASP 35 HA ASP 35 -12.322 -3.851 2.944
261 HB2 ASP 35 2HB ASP 35 -10.734 -6.101 1.682
262 HB3 ASP 35 1HB ASP 35 -12.473 -5.881 1.506
263 H ASP 36 H ASP 36 -13.585 -6.201 3.163
264 HA ASP 36 HA ASP 36 -13.790 -6.702 5.881
265 HB2 ASP 36 2HB ASP 36 -15.540 -7.268 4.263
266 HB3 ASP 36 1HB ASP 36 -14.523 -8.538 3.586
267 H ALA 37 H ALA 37 -11.771 -8.370 3.509
268 HA ALA 37 HA ALA 37 -11.003 -10.500 5.281
269 HB1 ALA 37 3HB ALA 37 -11.091 -10.823 2.860
270 HB2 ALA 37 1HB ALA 37 -9.479 -11.162 3.492
271 HB3 ALA 37 2HB ALA 37 -9.796 -9.644 2.651
272 H GLY 38 H GLY 38 -10.143 -7.301 5.308
273 HA2 GLY 38 2HA GLY 38 -8.545 -6.301 6.701
274 HA3 GLY 38 1HA GLY 38 -7.724 -7.846 6.841
275 H TRP 39 H TRP 39 -8.142 -7.602 3.653
276 HA TRP 39 HA TRP 39 -5.489 -6.436 3.221
277 HB2 TRP 39 2HB TRP 39 -7.287 -8.071 1.412
278 HB3 TRP 39 1HB TRP 39 -5.726 -7.424 0.926
279 HD1 TRP 39 HD1 TRP 39 -7.266 -10.083 3.242
280 HE1 TRP 39 HE1 TRP 39 -5.448 -11.823 3.787
281 HE3 TRP 39 HE3 TRP 39 -3.252 -7.761 1.111
282 HZ2 TRP 39 HZ2 TRP 39 -2.678 -12.160 3.375
283 HZ3 TRP 39 HZ3 TRP 39 -1.055 -8.854 1.229
284 HH2 TRP 39 HH2 TRP 39 -0.775 -11.010 2.337
285 H ALA 40 H ALA 40 -5.145 -4.595 2.091
286 HA ALA 40 HA ALA 40 -7.487 -3.138 1.043
287 HB1 ALA 40 3HB ALA 40 -6.205 -1.100 1.412
288 HB2 ALA 40 1HB ALA 40 -4.822 -2.051 1.954
289 HB3 ALA 40 2HB ALA 40 -6.312 -2.044 2.898
290 H ASN 41 H ASN 41 -7.619 -2.768 -1.094
291 HA ASN 41 HA ASN 41 -5.699 -3.683 -2.960
292 HB2 ASN 41 2HB ASN 41 -8.158 -3.398 -3.396
293 HB3 ASN 41 1HB ASN 41 -7.913 -1.657 -3.416
294 HD21 ASN 41 1HD2 ASN 41 -8.865 -3.530 -5.482
295 HD22 ASN 41 2HD2 ASN 41 -7.847 -3.256 -6.850
296 H LEU 42 H LEU 42 -3.951 -2.715 -3.835
297 HA LEU 42 HA LEU 42 -2.565 -0.664 -2.722
298 HB2 LEU 42 2HB LEU 42 -1.635 -2.192 -4.377
299 HB3 LEU 42 1HB LEU 42 -2.598 -1.450 -5.639
300 HG LEU 42 HG LEU 42 -1.329 0.684 -5.265
301 HD11 LEU 42 1HD1 LEU 42 0.803 0.565 -4.058
302 HD12 LEU 42 2HD1 LEU 42 0.401 -1.068 -3.522
303 HD13 LEU 42 3HD1 LEU 42 -0.579 0.300 -2.993
304 HD21 LEU 42 3HD2 LEU 42 -0.769 -0.813 -7.101
305 HD22 LEU 42 1HD2 LEU 42 0.294 -1.741 -6.042
306 HD23 LEU 42 2HD2 LEU 42 0.686 -0.068 -6.441
307 H GLY 43 H GLY 43 -4.859 -0.319 -5.428
308 HA2 GLY 43 2HA GLY 43 -4.452 2.416 -5.945
309 HA3 GLY 43 1HA GLY 43 -5.911 1.518 -6.330
310 H ASN 44 H ASN 44 -6.580 0.833 -3.606
311 HA ASN 44 HA ASN 44 -7.875 3.285 -2.798
312 HB2 ASN 44 2HB ASN 44 -7.826 0.589 -1.407
313 HB3 ASN 44 1HB ASN 44 -8.943 1.910 -1.076
314 HD21 ASN 44 1HD2 ASN 44 -9.558 -0.793 -1.867
315 HD22 ASN 44 2HD2 ASN 44 -10.425 -0.684 -3.356
316 H PHE 45 H PHE 45 -5.364 1.163 -1.486
317 HA PHE 45 HA PHE 45 -4.865 2.422 0.941
318 HB2 PHE 45 2HB PHE 45 -3.896 0.279 0.477
319 HB3 PHE 45 1HB PHE 45 -3.034 0.901 -0.925
320 HD1 PHE 45 HD1 PHE 45 -3.319 1.801 2.700
321 HD2 PHE 45 HD2 PHE 45 -0.778 1.060 -0.635
322 HE1 PHE 45 HE1 PHE 45 -1.348 2.211 4.112
323 HE2 PHE 45 HE2 PHE 45 1.197 1.462 0.774
324 HZ PHE 45 HZ PHE 45 0.912 2.039 3.149
325 H GLY 46 H GLY 46 -3.173 2.968 -2.171
326 HA2 GLY 46 2HA GLY 46 -1.500 5.047 -1.323
327 HA3 GLY 46 1HA GLY 46 -2.032 4.798 -2.978
328 H ASN 47 H ASN 47 -4.826 5.168 -2.491
329 HA ASN 47 HA ASN 47 -5.070 7.944 -2.815
330 HB2 ASN 47 2HB ASN 47 -6.703 6.255 -3.637
331 HB3 ASN 47 1HB ASN 47 -7.224 5.978 -1.980
332 HD21 ASN 47 1HD2 ASN 47 -8.748 6.894 -4.270
333 HD22 ASN 47 2HD2 ASN 47 -9.418 8.424 -3.818
334 H TYR 48 H TYR 48 -6.160 5.965 -0.010
335 HA TYR 48 HA TYR 48 -6.768 8.267 1.559
336 HB2 TYR 48 2HB TYR 48 -7.806 5.956 1.809
337 HB3 TYR 48 1HB TYR 48 -6.329 5.477 2.641
338 HD1 TYR 48 HD2 TYR 48 -9.162 7.876 2.771
339 HD2 TYR 48 HD1 TYR 48 -6.045 5.971 4.953
340 HE1 TYR 48 HE2 TYR 48 -10.061 8.807 4.859
341 HE2 TYR 48 HE1 TYR 48 -6.935 6.902 7.047
342 HH TYR 48 HH TYR 48 -9.998 8.285 7.294
343 H LEU 49 H LEU 49 -3.905 6.284 1.208
344 HA LEU 49 HA LEU 49 -2.488 7.024 3.503
345 HB2 LEU 49 2HB LEU 49 -1.733 5.244 2.048
346 HB3 LEU 49 1HB LEU 49 -1.490 6.374 0.728
347 HG LEU 49 HG LEU 49 0.363 7.428 1.933
348 HD11 LEU 49 1HD1 LEU 49 1.208 6.488 4.025
349 HD12 LEU 49 2HD1 LEU 49 -0.167 5.385 4.088
350 HD13 LEU 49 3HD1 LEU 49 -0.425 7.125 4.215
351 HD21 LEU 49 3HD2 LEU 49 0.619 4.420 1.819
352 HD22 LEU 49 1HD2 LEU 49 1.957 5.569 1.854
353 HD23 LEU 49 2HD2 LEU 49 0.861 5.535 0.474
354 H ASN 50 H ASN 50 -2.512 8.578 0.286
355 HA ASN 50 HA ASN 50 -0.719 10.656 0.985
356 HB2 ASN 50 2HB ASN 50 -1.229 9.952 -1.349
357 HB3 ASN 50 1HB ASN 50 -2.822 10.683 -1.194
358 HD21 ASN 50 1HD2 ASN 50 0.602 11.299 -1.408
359 HD22 ASN 50 2HD2 ASN 50 0.468 12.980 -1.781
360 H LYS 51 H LYS 51 -4.088 10.231 1.651
361 HA LYS 51 HA LYS 51 -4.741 12.980 2.105
362 HB2 LYS 51 2HB LYS 51 -6.031 10.492 3.259
363 HB3 LYS 51 1HB LYS 51 -6.716 12.111 3.296
364 HG2 LYS 51 2HG LYS 51 -6.846 12.117 0.853
365 HG3 LYS 51 1HG LYS 51 -6.142 10.501 0.810
366 HD2 LYS 51 2HD LYS 51 -8.452 10.150 0.575
367 HD3 LYS 51 1HD LYS 51 -8.114 9.776 2.263
368 HE2 LYS 51 2HE LYS 51 -9.199 12.418 1.271
369 HE3 LYS 51 1HE LYS 51 -10.185 11.113 1.924
370 HZ1 LYS 51 3HZ LYS 51 -8.126 12.690 3.366
371 HZ2 LYS 51 1HZ LYS 51 -8.893 11.325 4.012
372 HZ3 LYS 51 2HZ LYS 51 -9.794 12.703 3.628
373 H LEU 52 H LEU 52 -3.324 10.439 4.067
374 HA LEU 52 HA LEU 52 -3.426 12.058 6.490
375 HB2 LEU 52 2HB LEU 52 -2.145 9.358 6.024
376 HB3 LEU 52 1HB LEU 52 -2.363 10.140 7.579
377 HG LEU 52 HG LEU 52 -4.519 9.039 5.770
378 HD11 LEU 52 1HD1 LEU 52 -3.668 8.296 8.569
379 HD12 LEU 52 2HD1 LEU 52 -3.345 7.372 7.103
380 HD13 LEU 52 3HD1 LEU 52 -5.003 7.578 7.666
381 HD21 LEU 52 3HD2 LEU 52 -6.124 9.762 7.486
382 HD22 LEU 52 1HD2 LEU 52 -5.319 11.125 6.707
383 HD23 LEU 52 2HD2 LEU 52 -4.828 10.617 8.324
384 H GLN 53 H GLN 53 -0.977 10.820 4.229
385 HA GLN 53 HA GLN 53 0.870 12.898 5.209
386 HB2 GLN 53 2HB GLN 53 1.542 9.996 4.697
387 HB3 GLN 53 1HB GLN 53 2.764 11.255 4.788
388 HG2 GLN 53 2HG GLN 53 0.840 10.608 7.011
389 HG3 GLN 53 1HG GLN 53 2.466 9.939 6.876
390 HE21 GLN 53 1HE2 GLN 53 0.590 12.761 7.591
391 HE22 GLN 53 2HE2 GLN 53 1.884 13.712 8.219
392 HA PRO 54 HA PRO 54 0.651 13.258 0.573
393 HB2 PRO 54 2HB PRO 54 0.709 15.996 0.600
394 HB3 PRO 54 1HB PRO 54 -0.785 15.055 0.665
395 HG2 PRO 54 2HG PRO 54 0.743 16.335 2.904
396 HG3 PRO 54 1HG PRO 54 -1.007 16.311 2.614
397 HD2 PRO 54 2HD PRO 54 0.172 14.665 4.403
398 HD3 PRO 54 1HD PRO 54 -1.244 14.160 3.454
399 H ASP 55 H ASP 55 2.668 14.319 3.161
400 HA ASP 55 HA ASP 55 4.893 15.178 1.535
401 HB2 ASP 55 2HB ASP 55 4.440 16.061 3.819
402 HB3 ASP 55 1HB ASP 55 4.786 14.467 4.480
403 H PHE 56 H PHE 56 3.607 12.170 2.320
404 HA PHE 56 HA PHE 56 6.192 10.770 2.282
405 HB2 PHE 56 2HB PHE 56 4.648 10.131 4.065
406 HB3 PHE 56 1HB PHE 56 3.397 9.763 2.886
407 HD1 PHE 56 HD1 PHE 56 6.747 8.716 4.097
408 HD2 PHE 56 HD2 PHE 56 3.270 7.630 1.882
409 HE1 PHE 56 HE1 PHE 56 7.545 6.391 3.984
410 HE2 PHE 56 HE2 PHE 56 4.064 5.304 1.775
411 HZ PHE 56 HZ PHE 56 6.203 4.683 2.824
412 H ASP 57 H ASP 57 6.853 10.643 0.183
413 HA ASP 57 HA ASP 57 5.051 9.232 -1.672
414 HB2 ASP 57 2HB ASP 57 5.309 11.659 -2.251
415 HB3 ASP 57 1HB ASP 57 7.030 11.362 -2.507
416 H SER 58 H SER 58 5.930 7.662 -2.965
417 HA SER 58 HA SER 58 8.031 6.143 -1.989
418 HB2 SER 58 2HB SER 58 7.914 4.915 -4.164
419 HB3 SER 58 1HB SER 58 6.340 5.170 -3.411
420 HG SER 58 HG SER 58 5.773 6.475 -4.989
421 H ARG 59 H ARG 59 8.177 8.724 -4.395
422 HA ARG 59 HA ARG 59 10.650 8.124 -5.565
423 HB2 ARG 59 2HB ARG 59 9.400 10.835 -5.072
424 HB3 ARG 59 1HB ARG 59 10.779 10.551 -6.123
425 HG2 ARG 59 2HG ARG 59 7.998 9.450 -6.500
426 HG3 ARG 59 1HG ARG 59 8.737 10.768 -7.408
427 HD2 ARG 59 2HD ARG 59 10.504 9.144 -8.154
428 HD3 ARG 59 1HD ARG 59 9.550 7.860 -7.405
429 HE ARG 59 HE ARG 59 7.790 9.124 -9.045
430 HH11 ARG 59 1HH1 ARG 59 10.867 7.662 -9.518
431 HH12 ARG 59 2HH1 ARG 59 10.552 7.273 -11.170
432 HH21 ARG 59 1HH2 ARG 59 7.392 8.632 -11.147
433 HH22 ARG 59 2HH2 ARG 59 8.586 7.807 -12.085
434 H LEU 60 H LEU 60 9.926 9.816 -2.558
435 HA LEU 60 HA LEU 60 12.426 10.972 -2.054
436 HB2 LEU 60 2HB LEU 60 10.426 9.905 -0.053
437 HB3 LEU 60 1HB LEU 60 11.728 11.025 0.306
438 HG LEU 60 HG LEU 60 9.359 11.585 -1.489
439 HD11 LEU 60 1HD1 LEU 60 10.043 12.633 1.257
440 HD12 LEU 60 2HD1 LEU 60 8.742 11.507 0.863
441 HD13 LEU 60 3HD1 LEU 60 8.688 13.163 0.258
442 HD21 LEU 60 3HD2 LEU 60 10.201 13.874 -1.585
443 HD22 LEU 60 1HD2 LEU 60 11.379 12.744 -2.250
444 HD23 LEU 60 2HD2 LEU 60 11.611 13.409 -0.633
445 H TYR 61 H TYR 61 11.384 7.669 -1.760
446 HA TYR 61 HA TYR 61 13.778 6.952 -0.202
447 HB2 TYR 61 2HB TYR 61 11.305 5.331 -0.851
448 HB3 TYR 61 1HB TYR 61 12.651 4.776 0.139
449 HD1 TYR 61 HD1 TYR 61 9.763 7.056 -0.005
450 HD2 TYR 61 HD2 TYR 61 12.947 5.571 2.409
451 HE1 TYR 61 HE1 TYR 61 8.706 8.031 1.989
452 HE2 TYR 61 HE2 TYR 61 11.887 6.543 4.404
453 HH TYR 61 HH TYR 61 10.318 8.265 5.007
454 H GLY 62 H GLY 62 13.239 7.394 -3.324
455 HA2 GLY 62 2HA GLY 62 14.600 6.791 -5.105
456 HA3 GLY 62 1HA GLY 62 15.345 5.568 -4.093
457 H TYR 63 H TYR 63 11.877 5.569 -4.398
458 HA TYR 63 HA TYR 63 12.061 3.179 -6.126
459 HB2 TYR 63 2HB TYR 63 9.939 4.010 -4.134
460 HB3 TYR 63 1HB TYR 63 9.770 2.640 -5.227
461 HD1 TYR 63 HD1 TYR 63 11.675 3.954 -2.345
462 HD2 TYR 63 HD2 TYR 63 10.882 0.565 -4.796
463 HE1 TYR 63 HE1 TYR 63 12.847 2.519 -0.731
464 HE2 TYR 63 HE2 TYR 63 12.046 -0.878 -3.186
465 HH TYR 63 HH TYR 63 13.746 -0.691 -1.420
466 H LYS 64 H LYS 64 10.491 2.874 -7.808
467 HA LYS 64 HA LYS 64 9.946 5.317 -9.229
468 HB2 LYS 64 2HB LYS 64 9.218 2.470 -9.958
469 HB3 LYS 64 1HB LYS 64 9.185 3.855 -11.041
470 HG2 LYS 64 2HG LYS 64 11.626 4.120 -10.728
471 HG3 LYS 64 1HG LYS 64 11.630 2.668 -9.729
472 HD2 LYS 64 2HD LYS 64 12.337 2.071 -11.950
473 HD3 LYS 64 1HD LYS 64 10.732 1.394 -11.676
474 HE2 LYS 64 2HE LYS 64 9.707 3.118 -12.995
475 HE3 LYS 64 1HE LYS 64 11.227 4.007 -13.105
476 HZ1 LYS 64 3HZ LYS 64 10.745 2.775 -15.138
477 HZ2 LYS 64 1HZ LYS 64 10.726 1.321 -14.273
478 HZ3 LYS 64 2HZ LYS 64 12.159 2.210 -14.407
479 H LYS 65 H LYS 65 7.998 2.964 -7.467
480 HA LYS 65 HA LYS 65 5.932 4.943 -7.161
481 HB2 LYS 65 2HB LYS 65 4.075 3.531 -7.979
482 HB3 LYS 65 1HB LYS 65 5.174 4.013 -9.260
483 HG2 LYS 65 2HG LYS 65 6.138 1.829 -9.367
484 HG3 LYS 65 1HG LYS 65 5.293 1.325 -7.902
485 HD2 LYS 65 2HD LYS 65 4.219 0.442 -9.943
486 HD3 LYS 65 1HD LYS 65 3.148 1.507 -9.034
487 HE2 LYS 65 2HE LYS 65 3.811 3.363 -10.588
488 HE3 LYS 65 1HE LYS 65 4.683 2.168 -11.550
489 HZ1 LYS 65 3HZ LYS 65 1.780 2.048 -10.947
490 HZ2 LYS 65 1HZ LYS 65 2.637 1.018 -11.976
491 HZ3 LYS 65 2HZ LYS 65 2.434 2.647 -12.382
492 H LEU 66 H LEU 66 3.999 3.899 -5.882
493 HA LEU 66 HA LEU 66 5.053 3.252 -3.376
494 HB2 LEU 66 2HB LEU 66 2.888 4.361 -3.735
495 HB3 LEU 66 1HB LEU 66 2.228 2.870 -4.382
496 HG LEU 66 HG LEU 66 2.531 1.789 -2.176
497 HD11 LEU 66 1HD1 LEU 66 4.413 3.094 -1.352
498 HD12 LEU 66 2HD1 LEU 66 3.069 3.159 -0.214
499 HD13 LEU 66 3HD1 LEU 66 3.401 4.535 -1.266
500 HD21 LEU 66 3HD2 LEU 66 0.742 3.007 -1.010
501 HD22 LEU 66 1HD2 LEU 66 0.390 2.800 -2.726
502 HD23 LEU 66 2HD2 LEU 66 0.947 4.360 -2.122
503 H SER 67 H SER 67 3.574 1.107 -5.805
504 HA SER 67 HA SER 67 3.341 -1.212 -4.277
505 HB2 SER 67 2HB SER 67 3.364 -2.457 -6.393
506 HB3 SER 67 1HB SER 67 2.397 -0.992 -6.545
507 HG SER 67 HG SER 67 3.796 -1.299 -8.333
508 H ASP 68 H ASP 68 6.087 -0.228 -6.326
509 HA ASP 68 HA ASP 68 7.776 -2.393 -5.805
510 HB2 ASP 68 2HB ASP 68 8.070 -0.680 -7.608
511 HB3 ASP 68 1HB ASP 68 8.601 0.466 -6.381
512 H LEU 69 H LEU 69 7.265 0.594 -4.007
513 HA LEU 69 HA LEU 69 9.352 0.288 -2.119
514 HB2 LEU 69 2HB LEU 69 8.285 2.421 -2.370
515 HB3 LEU 69 1HB LEU 69 6.710 1.744 -2.006
516 HG LEU 69 HG LEU 69 7.467 1.313 0.325
517 HD11 LEU 69 1HD1 LEU 69 9.919 2.878 -0.474
518 HD12 LEU 69 2HD1 LEU 69 9.874 1.152 -0.114
519 HD13 LEU 69 3HD1 LEU 69 9.512 2.325 1.151
520 HD21 LEU 69 3HD2 LEU 69 6.210 3.332 -0.208
521 HD22 LEU 69 1HD2 LEU 69 7.709 4.183 -0.584
522 HD23 LEU 69 2HD2 LEU 69 7.390 3.643 1.065
523 H VAL 70 H VAL 70 5.880 -0.505 -1.896
524 HA VAL 70 HA VAL 70 5.920 -1.518 0.714
525 HB VAL 70 HB VAL 70 4.023 -2.295 -1.516
526 HG11 VAL 70 1HG1 VAL 70 3.687 -2.412 1.486
527 HG12 VAL 70 2HG1 VAL 70 3.894 -3.795 0.411
528 HG13 VAL 70 3HG1 VAL 70 2.446 -2.797 0.292
529 HG21 VAL 70 3HG2 VAL 70 4.133 0.138 -1.214
530 HG22 VAL 70 1HG2 VAL 70 3.812 -0.054 0.509
531 HG23 VAL 70 2HG2 VAL 70 2.581 -0.501 -0.674
532 H LYS 71 H LYS 71 6.144 -3.299 -2.389
533 HA LYS 71 HA LYS 71 6.288 -5.871 -1.199
534 HB2 LYS 71 2HB LYS 71 7.040 -6.664 -3.401
535 HB3 LYS 71 1HB LYS 71 5.652 -5.591 -3.537
536 HG2 LYS 71 2HG LYS 71 7.197 -3.746 -4.142
537 HG3 LYS 71 1HG LYS 71 8.533 -4.899 -4.118
538 HD2 LYS 71 2HD LYS 71 6.080 -5.183 -5.865
539 HD3 LYS 71 1HD LYS 71 7.586 -4.436 -6.398
540 HE2 LYS 71 2HE LYS 71 7.394 -7.257 -5.343
541 HE3 LYS 71 1HE LYS 71 7.309 -6.843 -7.055
542 HZ1 LYS 71 3HZ LYS 71 9.605 -6.282 -5.251
543 HZ2 LYS 71 1HZ LYS 71 9.519 -5.873 -6.887
544 HZ3 LYS 71 2HZ LYS 71 9.541 -7.495 -6.422
545 H ALA 72 H ALA 72 8.726 -3.441 -1.815
546 HA ALA 72 HA ALA 72 10.968 -5.212 -1.354
547 HB1 ALA 72 3HB ALA 72 11.198 -3.239 -2.792
548 HB2 ALA 72 1HB ALA 72 12.332 -3.195 -1.443
549 HB3 ALA 72 2HB ALA 72 10.881 -2.192 -1.407
550 H ARG 73 H ARG 73 8.703 -3.731 0.645
551 HA ARG 73 HA ARG 73 10.488 -3.965 2.986
552 HB2 ARG 73 2HB ARG 73 8.300 -1.949 2.444
553 HB3 ARG 73 1HB ARG 73 8.958 -2.222 4.054
554 HG2 ARG 73 2HG ARG 73 10.573 -1.366 1.649
555 HG3 ARG 73 1HG ARG 73 9.972 -0.283 2.908
556 HD2 ARG 73 2HD ARG 73 11.295 -1.421 4.583
557 HD3 ARG 73 1HD ARG 73 11.802 -2.635 3.411
558 HE ARG 73 HE ARG 73 12.576 -0.108 2.478
559 HH11 ARG 73 1HH1 ARG 73 13.294 -2.247 5.082
560 HH12 ARG 73 2HH1 ARG 73 14.959 -1.789 5.147
561 HH21 ARG 73 1HH2 ARG 73 14.695 0.502 2.591
562 HH22 ARG 73 2HH2 ARG 73 15.748 -0.243 3.743
563 H THR 74 H THR 74 9.252 -6.236 2.217
564 HA THR 74 HA THR 74 6.711 -6.773 3.290
565 HB THR 74 HB THR 74 7.412 -9.152 3.406
566 HG1 THR 74 HG1 THR 74 9.653 -9.480 2.494
567 HG21 THR 74 3HG2 THR 74 8.296 -7.716 0.890
568 HG22 THR 74 1HG2 THR 74 6.652 -8.237 1.267
569 HG23 THR 74 2HG2 THR 74 7.921 -9.435 1.012
570 H ASP 75 H ASP 75 9.720 -6.223 4.852
571 HA ASP 75 HA ASP 75 9.376 -7.285 7.376
572 HB2 ASP 75 2HB ASP 75 11.407 -6.131 6.765
573 HB3 ASP 75 1HB ASP 75 10.535 -4.622 6.514
574 H LEU 76 H LEU 76 8.031 -4.284 6.052
575 HA LEU 76 HA LEU 76 6.583 -3.727 8.525
576 HB2 LEU 76 2HB LEU 76 6.834 -2.150 5.960
577 HB3 LEU 76 1HB LEU 76 5.982 -1.600 7.392
578 HG LEU 76 HG LEU 76 8.952 -2.174 7.250
579 HD11 LEU 76 1HD1 LEU 76 9.233 0.246 7.399
580 HD12 LEU 76 2HD1 LEU 76 7.484 0.464 7.329
581 HD13 LEU 76 3HD1 LEU 76 8.348 -0.205 5.942
582 HD21 LEU 76 3HD2 LEU 76 8.074 -2.573 9.476
583 HD22 LEU 76 1HD2 LEU 76 7.251 -1.011 9.462
584 HD23 LEU 76 2HD2 LEU 76 9.014 -1.081 9.461
585 H PHE 77 H PHE 77 5.899 -4.557 5.132
586 HA PHE 77 HA PHE 77 3.013 -4.668 5.802
587 HB2 PHE 77 2HB PHE 77 4.146 -3.923 3.095
588 HB3 PHE 77 1HB PHE 77 2.471 -3.814 3.624
589 HD1 PHE 77 HD1 PHE 77 2.265 -2.348 5.928
590 HD2 PHE 77 HD2 PHE 77 5.242 -1.911 2.905
591 HE1 PHE 77 HE1 PHE 77 2.650 -0.024 6.639
592 HE2 PHE 77 HE2 PHE 77 5.628 0.410 3.614
593 HZ PHE 77 HZ PHE 77 4.335 1.357 5.485
594 H VAL 78 H VAL 78 1.818 -6.386 5.001
595 HA VAL 78 HA VAL 78 3.297 -8.569 3.700
596 HB VAL 78 HB VAL 78 0.483 -8.584 4.835
597 HG11 VAL 78 1HG1 VAL 78 2.250 -10.865 3.919
598 HG12 VAL 78 2HG1 VAL 78 0.809 -10.267 3.094
599 HG13 VAL 78 3HG1 VAL 78 0.665 -11.029 4.677
600 HG21 VAL 78 3HG2 VAL 78 2.131 -8.223 6.603
601 HG22 VAL 78 1HG2 VAL 78 3.058 -9.617 6.047
602 HG23 VAL 78 2HG2 VAL 78 1.443 -9.842 6.721
603 H THR 79 H THR 79 3.105 -8.903 1.548
604 HA THR 79 HA THR 79 0.952 -7.463 0.117
605 HB THR 79 HB THR 79 2.441 -7.072 -1.722
606 HG1 THR 79 HG1 THR 79 4.354 -8.075 -1.960
607 HG21 THR 79 3HG2 THR 79 3.967 -6.541 0.835
608 HG22 THR 79 1HG2 THR 79 2.687 -5.522 0.179
609 HG23 THR 79 2HG2 THR 79 4.199 -5.718 -0.707
610 H GLU 80 H GLU 80 -0.401 -8.643 -1.125
611 HA GLU 80 HA GLU 80 0.667 -11.057 -2.443
612 HB2 GLU 80 2HB GLU 80 -2.048 -10.797 -1.142
613 HB3 GLU 80 1HB GLU 80 -1.675 -12.035 -2.325
614 HG2 GLU 80 2HG GLU 80 0.181 -12.781 -0.790
615 HG3 GLU 80 1HG GLU 80 -0.509 -11.702 0.423
616 H GLU 81 H GLU 81 0.442 -11.026 -4.595
617 HA GLU 81 HA GLU 81 -1.308 -9.071 -5.863
618 HB2 GLU 81 2HB GLU 81 0.482 -11.158 -7.141
619 HB3 GLU 81 1HB GLU 81 -0.289 -9.806 -7.959
620 HG2 GLU 81 2HG GLU 81 1.051 -8.248 -6.592
621 HG3 GLU 81 1HG GLU 81 1.858 -9.628 -5.848
622 H ARG 82 H ARG 82 -3.399 -9.565 -6.201
623 HA ARG 82 HA ARG 82 -4.169 -12.421 -6.267
624 HB2 ARG 82 2HB ARG 82 -5.749 -10.078 -5.175
625 HB3 ARG 82 1HB ARG 82 -6.236 -11.767 -5.125
626 HG2 ARG 82 2HG ARG 82 -3.781 -10.672 -3.751
627 HG3 ARG 82 1HG ARG 82 -5.349 -10.874 -2.972
628 HD2 ARG 82 2HD ARG 82 -3.699 -13.085 -4.207
629 HD3 ARG 82 1HD ARG 82 -3.835 -12.744 -2.482
630 HE ARG 82 HE ARG 82 -6.042 -13.686 -4.193
631 HH11 ARG 82 1HH1 ARG 82 -4.522 -13.426 -1.103
632 HH12 ARG 82 2HH1 ARG 82 -5.732 -14.379 -0.316
633 HH21 ARG 82 1HH2 ARG 82 -7.558 -14.934 -3.176
634 HH22 ARG 82 2HH2 ARG 82 -7.415 -15.242 -1.480
635 H GLN 83 H GLN 83 -5.783 -13.099 -7.657
636 HA GLN 83 HA GLN 83 -6.197 -11.504 -10.029
637 HB2 GLN 83 2HB GLN 83 -5.785 -13.974 -10.048
638 HB3 GLN 83 1HB GLN 83 -7.364 -14.208 -9.311
639 HG2 GLN 83 2HG GLN 83 -8.430 -13.209 -11.274
640 HG3 GLN 83 1HG GLN 83 -6.845 -12.965 -12.009
641 HE21 GLN 83 1HE2 GLN 83 -9.097 -14.536 -12.977
642 HE22 GLN 83 2HE2 GLN 83 -8.516 -16.153 -13.159
643 H VAL 84 H VAL 84 -7.849 -10.109 -10.316
644 HA VAL 84 HA VAL 84 -9.972 -10.023 -8.310
645 HB VAL 84 HB VAL 84 -9.258 -8.015 -10.458
646 HG11 VAL 84 1HG1 VAL 84 -11.079 -7.725 -8.059
647 HG12 VAL 84 2HG1 VAL 84 -11.595 -7.827 -9.742
648 HG13 VAL 84 3HG1 VAL 84 -10.648 -6.445 -9.196
649 HG21 VAL 84 3HG2 VAL 84 -7.456 -8.315 -8.826
650 HG22 VAL 84 1HG2 VAL 84 -8.590 -8.015 -7.508
651 HG23 VAL 84 2HG2 VAL 84 -8.212 -6.730 -8.658
652 HA PRO 85 HA PRO 85 -12.981 -11.914 -11.136
653 HB2 PRO 85 2HB PRO 85 -14.847 -10.673 -9.164
654 HB3 PRO 85 1HB PRO 85 -14.779 -12.337 -9.758
655 HG2 PRO 85 2HG PRO 85 -13.920 -11.743 -7.309
656 HG3 PRO 85 1HG PRO 85 -13.053 -12.923 -8.312
657 HD2 PRO 85 2HD PRO 85 -12.364 -10.065 -7.717
658 HD3 PRO 85 1HD PRO 85 -11.297 -11.479 -7.838
659 H GLY 86 H GLY 86 -13.913 -11.041 -12.931
660 HA2 GLY 86 2HA GLY 86 -15.117 -9.471 -14.203
661 HA3 GLY 86 1HA GLY 86 -14.999 -8.322 -12.879
662 H SER 87 H SER 87 -12.045 -8.886 -12.707
663 HA SER 87 HA SER 87 -11.220 -7.086 -14.887
664 HB2 SER 87 2HB SER 87 -9.864 -7.737 -12.251
665 HB3 SER 87 1HB SER 87 -9.220 -6.635 -13.468
666 HG SER 87 HG SER 87 -11.657 -6.349 -12.014
667 H THR 88 H THR 88 -9.661 -7.663 -16.347
668 HA THR 88 HA THR 88 -8.963 -10.454 -16.537
669 HB THR 88 HB THR 88 -9.455 -9.232 -18.594
670 HG1 THR 88 HG1 THR 88 -6.989 -9.638 -19.396
671 HG21 THR 88 3HG2 THR 88 -7.919 -7.547 -19.487
672 HG22 THR 88 1HG2 THR 88 -6.954 -7.629 -18.011
673 HG23 THR 88 2HG2 THR 88 -8.606 -7.016 -17.953
674 H GLN 89 H GLN 89 -7.337 -7.484 -15.594
675 HA GLN 89 HA GLN 89 -4.800 -8.910 -15.239
676 HB2 GLN 89 2HB GLN 89 -3.825 -6.733 -14.704
677 HB3 GLN 89 1HB GLN 89 -4.687 -6.671 -16.234
678 HG2 GLN 89 2HG GLN 89 -6.521 -5.499 -15.233
679 HG3 GLN 89 1HG GLN 89 -5.841 -5.719 -13.620
680 HE21 GLN 89 1HE2 GLN 89 -5.587 -3.982 -16.621
681 HE22 GLN 89 2HE2 GLN 89 -4.538 -2.740 -16.035
682 H LYS 90 H LYS 90 -3.674 -8.884 -13.214
683 HA LYS 90 HA LYS 90 -5.485 -9.203 -10.942
684 HB2 LYS 90 2HB LYS 90 -3.605 -10.343 -9.872
685 HB3 LYS 90 1HB LYS 90 -3.898 -10.999 -11.476
686 HG2 LYS 90 2HG LYS 90 -2.040 -9.497 -12.303
687 HG3 LYS 90 1HG LYS 90 -1.668 -9.172 -10.608
688 HD2 LYS 90 2HD LYS 90 -1.602 -11.847 -12.013
689 HD3 LYS 90 1HD LYS 90 -0.223 -10.931 -11.410
690 HE2 LYS 90 2HE LYS 90 -0.975 -11.254 -9.122
691 HE3 LYS 90 1HE LYS 90 -2.420 -12.091 -9.688
692 HZ1 LYS 90 3HZ LYS 90 -0.992 -13.804 -10.643
693 HZ2 LYS 90 1HZ LYS 90 -0.745 -13.665 -8.978
694 HZ3 LYS 90 2HZ LYS 90 0.379 -13.013 -10.056
695 H ALA 91 H ALA 91 -5.031 -8.254 -8.855
696 HA ALA 91 HA ALA 91 -3.618 -5.658 -9.051
697 HB1 ALA 91 3HB ALA 91 -6.061 -5.405 -8.897
698 HB2 ALA 91 1HB ALA 91 -5.244 -4.740 -7.483
699 HB3 ALA 91 2HB ALA 91 -6.053 -6.303 -7.379
700 H LEU 92 H LEU 92 -2.861 -4.789 -6.920
701 HA LEU 92 HA LEU 92 -1.669 -6.971 -5.337
702 HB2 LEU 92 2HB LEU 92 -0.074 -5.480 -6.409
703 HB3 LEU 92 1HB LEU 92 -0.839 -4.083 -5.671
704 HG LEU 92 HG LEU 92 -0.180 -5.020 -3.418
705 HD11 LEU 92 1HD1 LEU 92 1.503 -6.883 -5.094
706 HD12 LEU 92 2HD1 LEU 92 0.131 -7.349 -4.090
707 HD13 LEU 92 3HD1 LEU 92 1.587 -6.696 -3.342
708 HD21 LEU 92 3HD2 LEU 92 1.067 -3.212 -4.500
709 HD22 LEU 92 1HD2 LEU 92 2.070 -4.397 -5.337
710 HD23 LEU 92 2HD2 LEU 92 2.135 -4.269 -3.579
711 H TYR 93 H TYR 93 -2.648 -7.409 -3.469
712 HA TYR 93 HA TYR 93 -3.982 -5.253 -1.977
713 HB2 TYR 93 2HB TYR 93 -4.249 -8.261 -1.841
714 HB3 TYR 93 1HB TYR 93 -4.952 -7.191 -0.632
715 HD1 TYR 93 HD1 TYR 93 -5.024 -8.047 -4.254
716 HD2 TYR 93 HD2 TYR 93 -6.992 -6.064 -1.039
717 HE1 TYR 93 HE1 TYR 93 -7.006 -7.720 -5.672
718 HE2 TYR 93 HE2 TYR 93 -8.977 -5.734 -2.449
719 HH TYR 93 HH TYR 93 -9.433 -7.350 -5.387
720 H LEU 94 H LEU 94 -3.450 -4.730 0.099
721 HA LEU 94 HA LEU 94 -0.919 -5.848 1.148
722 HB2 LEU 94 2HB LEU 94 -1.801 -2.964 1.350
723 HB3 LEU 94 1HB LEU 94 -0.229 -3.626 1.752
724 HG LEU 94 HG LEU 94 -1.386 -3.381 -1.034
725 HD11 LEU 94 1HD1 LEU 94 0.317 -1.682 -1.384
726 HD12 LEU 94 2HD1 LEU 94 0.854 -1.853 0.289
727 HD13 LEU 94 3HD1 LEU 94 -0.759 -1.231 -0.062
728 HD21 LEU 94 3HD2 LEU 94 1.341 -4.323 -0.163
729 HD22 LEU 94 1HD2 LEU 94 0.805 -4.076 -1.825
730 HD23 LEU 94 2HD2 LEU 94 0.062 -5.332 -0.837
731 H ARG 95 H ARG 95 -0.842 -6.237 3.376
732 HA ARG 95 HA ARG 95 -2.849 -4.905 5.053
733 HB2 ARG 95 2HB ARG 95 -3.476 -6.869 6.260
734 HB3 ARG 95 1HB ARG 95 -3.699 -7.207 4.552
735 HG2 ARG 95 2HG ARG 95 -1.694 -8.537 4.495
736 HG3 ARG 95 1HG ARG 95 -1.302 -8.082 6.156
737 HD2 ARG 95 2HD ARG 95 -3.668 -9.725 5.241
738 HD3 ARG 95 1HD ARG 95 -2.260 -10.306 6.130
739 HE ARG 95 HE ARG 95 -3.545 -8.238 7.573
740 HH11 ARG 95 1HH1 ARG 95 -3.912 -11.565 6.736
741 HH12 ARG 95 2HH1 ARG 95 -4.880 -11.916 8.125
742 HH21 ARG 95 1HH2 ARG 95 -4.789 -8.702 9.341
743 HH22 ARG 95 2HH2 ARG 95 -5.355 -10.317 9.592
744 H ALA 96 H ALA 96 -2.321 -5.258 7.455
745 HA ALA 96 HA ALA 96 0.353 -4.247 7.779
746 HB1 ALA 96 3HB ALA 96 -1.555 -3.263 8.971
747 HB2 ALA 96 1HB ALA 96 -0.291 -3.801 10.077
748 HB3 ALA 96 2HB ALA 96 -1.755 -4.765 9.876
749 H LYS 97 H LYS 97 2.075 -5.135 8.795
750 HA LYS 97 HA LYS 97 2.175 -7.995 9.099
751 HB2 LYS 97 2HB LYS 97 4.106 -6.894 8.184
752 HB3 LYS 97 1HB LYS 97 4.205 -5.803 9.558
753 HG2 LYS 97 2HG LYS 97 5.918 -7.361 9.898
754 HG3 LYS 97 1HG LYS 97 4.627 -7.860 10.988
755 HD2 LYS 97 2HD LYS 97 5.344 -9.864 10.021
756 HD3 LYS 97 1HD LYS 97 3.907 -9.446 9.086
757 HE2 LYS 97 2HE LYS 97 5.764 -10.196 7.651
758 HE3 LYS 97 1HE LYS 97 5.295 -8.531 7.312
759 HZ1 LYS 97 3HZ LYS 97 7.567 -9.293 9.065
760 HZ2 LYS 97 1HZ LYS 97 7.166 -7.735 8.543
761 HZ3 LYS 97 2HZ LYS 97 7.731 -8.882 7.433
762 H LEU 98 H LEU 98 1.806 -9.126 10.927
763 HA LEU 98 HA LEU 98 1.992 -7.727 13.524
764 HB2 LEU 98 2HB LEU 98 0.492 -10.253 12.795
765 HB3 LEU 98 1HB LEU 98 0.601 -9.590 14.414
766 HG LEU 98 HG LEU 98 -0.748 -8.281 12.044
767 HD11 LEU 98 1HD1 LEU 98 -1.898 -9.459 14.578
768 HD12 LEU 98 2HD1 LEU 98 -2.007 -10.164 12.963
769 HD13 LEU 98 3HD1 LEU 98 -2.806 -8.631 13.311
770 HD21 LEU 98 3HD2 LEU 98 -0.463 -7.318 14.895
771 HD22 LEU 98 1HD2 LEU 98 -1.481 -6.574 13.661
772 HD23 LEU 98 2HD2 LEU 98 0.270 -6.591 13.463
773 H GLU 99 H GLU 99 4.096 -7.976 14.115
774 HA GLU 99 HA GLU 99 5.376 -10.601 13.932
775 HB2 GLU 99 2HB GLU 99 6.477 -7.942 14.891
776 HB3 GLU 99 1HB GLU 99 7.411 -9.420 14.716
777 HG2 GLU 99 2HG GLU 99 5.988 -8.113 12.407
778 HG3 GLU 99 1HG GLU 99 7.631 -7.693 12.876
779 H HIS 100 H HIS 100 4.725 -11.956 15.510
780 HA HIS 100 HA HIS 100 3.942 -11.151 18.130
781 HB2 HIS 100 2HB HIS 100 4.758 -13.903 17.147
782 HB3 HIS 100 1HB HIS 100 3.879 -13.556 18.635
783 HD1 HIS 100 HD1 HIS 100 1.372 -13.353 18.468
784 HD2 HIS 100 HD2 HIS 100 3.224 -13.392 14.745
785 HE1 HIS 100 HE1 HIS 100 -0.491 -13.497 16.788
786 HE2 HIS 100 HE2 HIS 100 0.652 -13.561 14.548
787 H HIS 101 H HIS 101 6.947 -11.965 16.661
788 HA HIS 101 HA HIS 101 8.339 -11.247 19.142
789 HB2 HIS 101 2HB HIS 101 8.366 -13.729 18.926
790 HB3 HIS 101 1HB HIS 101 9.135 -13.570 17.352
791 HD1 HIS 101 HD1 HIS 101 9.824 -12.975 21.024
792 HD2 HIS 101 HD2 HIS 101 11.867 -13.281 17.419
793 HE1 HIS 101 HE1 HIS 101 12.254 -13.042 21.633
794 HE2 HIS 101 HE2 HIS 101 13.461 -13.373 19.451
795 H HIS 102 H HIS 102 9.102 -9.288 18.509
796 HA HIS 102 HA HIS 102 9.381 -8.420 15.881
797 HB2 HIS 102 2HB HIS 102 10.674 -7.307 18.378
798 HB3 HIS 102 1HB HIS 102 10.585 -6.463 16.836
799 HD1 HIS 102 HD1 HIS 102 8.893 -6.651 19.965
800 HD2 HIS 102 HD2 HIS 102 7.670 -6.214 16.013
801 HE1 HIS 102 HE1 HIS 102 6.576 -5.692 20.076
802 HE2 HIS 102 HE2 HIS 102 5.898 -5.341 17.684
803 H HIS 103 H HIS 103 12.114 -9.094 18.123
804 HA HIS 103 HA HIS 103 13.942 -9.171 15.850
805 HB2 HIS 103 2HB HIS 103 14.416 -9.441 18.826
806 HB3 HIS 103 1HB HIS 103 15.694 -9.573 17.621
807 HD1 HIS 103 HD1 HIS 103 16.824 -7.496 18.757
808 HD2 HIS 103 HD2 HIS 103 13.120 -6.733 17.035
809 HE1 HIS 103 HE1 HIS 103 16.649 -4.996 18.609
810 HE2 HIS 103 HE2 HIS 103 14.330 -4.566 17.743
811 H HIS 104 H HIS 104 13.288 -11.036 14.739
812 HA HIS 104 HA HIS 104 13.163 -13.609 15.986
813 HB2 HIS 104 2HB HIS 104 13.509 -12.894 13.059
814 HB3 HIS 104 1HB HIS 104 13.134 -14.498 13.675
815 HD1 HIS 104 HD1 HIS 104 10.728 -14.907 14.552
816 HD2 HIS 104 HD2 HIS 104 11.350 -11.108 12.982
817 HE1 HIS 104 HE1 HIS 104 8.444 -13.924 14.242
818 HE2 HIS 104 HE2 HIS 104 8.846 -11.590 13.399
819 H HIS 105 H HIS 105 15.115 -13.702 17.176
820 HA HIS 105 HA HIS 105 17.622 -13.839 15.638
821 HB2 HIS 105 2HB HIS 105 17.495 -12.305 17.598
822 HB3 HIS 105 1HB HIS 105 17.213 -13.694 18.639
823 HD1 HIS 105 HD1 HIS 105 19.235 -15.153 19.240
824 HD2 HIS 105 HD2 HIS 105 20.145 -12.028 16.654
825 HE1 HIS 105 HE1 HIS 105 21.738 -15.018 19.203
826 HE2 HIS 105 HE2 HIS 105 22.264 -13.239 17.510
Start of MODEL 5
1 H1 MET 1 1H MET 1 22.638 -12.031 44.474
2 H2 MET 1 2H MET 1 21.032 -12.304 44.917
3 H3 MET 1 3H MET 1 21.781 -10.844 45.314
4 HA MET 1 HA MET 1 21.192 -11.791 42.570
5 HB2 MET 1 2HB MET 1 19.974 -9.452 44.059
6 HB3 MET 1 1HB MET 1 19.506 -10.071 42.481
7 HG2 MET 1 2HG MET 1 17.882 -10.735 44.114
8 HG3 MET 1 1HG MET 1 18.757 -12.157 43.551
9 HE1 MET 1 3HE MET 1 17.767 -13.502 45.687
10 HE2 MET 1 1HE MET 1 16.939 -12.029 46.198
11 HE3 MET 1 2HE MET 1 17.938 -12.925 47.343
12 H ASP 2 H ASP 2 21.928 -10.478 40.900
13 HA ASP 2 HA ASP 2 22.943 -7.847 41.321
14 HB2 ASP 2 2HB ASP 2 24.870 -9.193 42.159
15 HB3 ASP 2 1HB ASP 2 24.996 -9.950 40.572
16 H GLN 3 H GLN 3 22.271 -6.819 39.559
17 HA GLN 3 HA GLN 3 22.516 -8.124 36.931
18 HB2 GLN 3 2HB GLN 3 20.207 -8.439 37.731
19 HB3 GLN 3 1HB GLN 3 20.040 -6.703 37.948
20 HG2 GLN 3 2HG GLN 3 20.337 -6.388 35.525
21 HG3 GLN 3 1HG GLN 3 20.463 -8.136 35.328
22 HE21 GLN 3 1HE2 GLN 3 18.507 -6.234 34.241
23 HE22 GLN 3 2HE2 GLN 3 16.966 -6.833 34.740
24 H LYS 4 H LYS 4 24.313 -6.750 36.545
25 HA LYS 4 HA LYS 4 23.815 -3.862 36.478
26 HB2 LYS 4 2HB LYS 4 26.376 -5.393 35.973
27 HB3 LYS 4 1HB LYS 4 26.225 -3.643 36.057
28 HG2 LYS 4 2HG LYS 4 25.431 -3.930 38.432
29 HG3 LYS 4 1HG LYS 4 25.888 -5.632 38.298
30 HD2 LYS 4 2HD LYS 4 28.194 -4.959 37.760
31 HD3 LYS 4 1HD LYS 4 27.730 -3.264 37.916
32 HE2 LYS 4 2HE LYS 4 28.811 -3.951 39.947
33 HE3 LYS 4 1HE LYS 4 27.099 -3.706 40.279
34 HZ1 LYS 4 3HZ LYS 4 27.917 -5.712 41.318
35 HZ2 LYS 4 1HZ LYS 4 28.413 -6.326 39.825
36 HZ3 LYS 4 2HZ LYS 4 26.772 -6.097 40.138
37 H SER 5 H SER 5 22.905 -3.103 34.662
38 HA SER 5 HA SER 5 23.187 -4.327 32.088
39 HB2 SER 5 2HB SER 5 22.187 -1.553 32.817
40 HB3 SER 5 1HB SER 5 22.012 -2.319 31.238
41 HG SER 5 HG SER 5 20.380 -3.415 31.968
42 H SER 6 H SER 6 25.128 -4.346 31.084
43 HA SER 6 HA SER 6 26.678 -1.835 31.007
44 HB2 SER 6 2HB SER 6 27.809 -4.592 31.559
45 HB3 SER 6 1HB SER 6 28.776 -3.148 31.262
46 HG SER 6 HG SER 6 28.083 -2.278 33.150
47 H SER 7 H SER 7 26.394 -1.280 28.936
48 HA SER 7 HA SER 7 27.524 -3.085 26.898
49 HB2 SER 7 2HB SER 7 25.060 -1.349 26.535
50 HB3 SER 7 1HB SER 7 25.849 -2.273 25.258
51 HG SER 7 HG SER 7 24.988 -4.062 26.001
52 HA PRO 8 HA PRO 8 30.374 0.363 26.687
53 HB2 PRO 8 2HB PRO 8 30.892 -0.847 23.996
54 HB3 PRO 8 1HB PRO 8 32.037 -0.362 25.252
55 HG2 PRO 8 2HG PRO 8 31.461 -2.927 24.902
56 HG3 PRO 8 1HG PRO 8 31.633 -2.262 26.539
57 HD2 PRO 8 2HD PRO 8 29.149 -2.985 25.036
58 HD3 PRO 8 1HD PRO 8 29.512 -3.163 26.764
59 H GLN 9 H GLN 9 28.359 -0.384 23.845
60 HA GLN 9 HA GLN 9 27.475 0.883 22.180
61 HB2 GLN 9 2HB GLN 9 27.343 2.941 24.397
62 HB3 GLN 9 1HB GLN 9 26.491 3.063 22.863
63 HG2 GLN 9 2HG GLN 9 26.086 0.927 24.956
64 HG3 GLN 9 1HG GLN 9 25.011 2.286 24.631
65 HE21 GLN 9 1HE2 GLN 9 24.402 -0.539 24.537
66 HE22 GLN 9 2HE2 GLN 9 23.891 -0.883 22.922
67 HA PRO 10 HA PRO 10 31.489 3.024 21.232
68 HB2 PRO 10 2HB PRO 10 31.452 1.427 18.778
69 HB3 PRO 10 1HB PRO 10 32.668 1.477 20.055
70 HG2 PRO 10 2HG PRO 10 31.083 -0.676 19.652
71 HG3 PRO 10 1HG PRO 10 31.663 -0.207 21.262
72 HD2 PRO 10 2HD PRO 10 28.985 0.304 19.992
73 HD3 PRO 10 1HD PRO 10 29.359 -0.253 21.640
74 H ALA 11 H ALA 11 31.951 4.617 19.662
75 HA ALA 11 HA ALA 11 29.714 5.998 18.616
76 HB1 ALA 11 3HB ALA 11 31.749 7.139 19.333
77 HB2 ALA 11 1HB ALA 11 31.344 7.550 17.666
78 HB3 ALA 11 2HB ALA 11 32.642 6.403 18.003
79 H ALA 12 H ALA 12 28.527 5.144 17.009
80 HA ALA 12 HA ALA 12 29.741 3.696 14.805
81 HB1 ALA 12 3HB ALA 12 27.477 3.222 14.104
82 HB2 ALA 12 1HB ALA 12 26.838 4.414 15.237
83 HB3 ALA 12 2HB ALA 12 27.617 2.953 15.842
84 H GLN 13 H GLN 13 29.684 4.296 12.626
85 HA GLN 13 HA GLN 13 29.717 7.153 12.130
86 HB2 GLN 13 2HB GLN 13 30.215 4.864 10.210
87 HB3 GLN 13 1HB GLN 13 30.597 6.560 9.933
88 HG2 GLN 13 2HG GLN 13 31.827 4.801 12.051
89 HG3 GLN 13 1HG GLN 13 32.580 5.257 10.526
90 HE21 GLN 13 1HE2 GLN 13 33.434 5.726 13.291
91 HE22 GLN 13 2HE2 GLN 13 33.633 7.433 13.434
92 H ALA 14 H ALA 14 28.448 8.242 10.573
93 HA ALA 14 HA ALA 14 25.741 7.194 10.406
94 HB1 ALA 14 3HB ALA 14 26.819 9.901 9.623
95 HB2 ALA 14 1HB ALA 14 26.111 9.484 11.181
96 HB3 ALA 14 2HB ALA 14 25.118 9.448 9.724
97 HA PRO 15 HA PRO 15 26.177 6.119 6.021
98 HB2 PRO 15 2HB PRO 15 23.315 5.492 6.166
99 HB3 PRO 15 1HB PRO 15 24.679 4.411 5.870
100 HG2 PRO 15 2HG PRO 15 23.245 4.331 8.162
101 HG3 PRO 15 1HG PRO 15 24.977 3.953 8.108
102 HD2 PRO 15 2HD PRO 15 23.625 6.501 8.957
103 HD3 PRO 15 1HD PRO 15 24.974 5.631 9.725
104 H GLU 16 H GLU 16 24.321 6.475 4.140
105 HA GLU 16 HA GLU 16 24.172 9.244 3.665
106 HB2 GLU 16 2HB GLU 16 22.618 6.967 2.418
107 HB3 GLU 16 1HB GLU 16 22.569 8.623 1.827
108 HG2 GLU 16 2HG GLU 16 24.948 8.546 1.336
109 HG3 GLU 16 1HG GLU 16 25.043 6.909 1.988
110 H THR 17 H THR 17 21.961 10.293 3.021
111 HA THR 17 HA THR 17 20.478 10.790 5.339
112 HB THR 17 HB THR 17 19.543 11.253 2.492
113 HG1 THR 17 HG1 THR 17 20.629 13.184 2.598
114 HG21 THR 17 3HG2 THR 17 18.786 12.650 5.071
115 HG22 THR 17 1HG2 THR 17 17.764 11.526 4.173
116 HG23 THR 17 2HG2 THR 17 18.215 13.073 3.457
117 H LYS 18 H LYS 18 19.648 8.930 6.286
118 HA LYS 18 HA LYS 18 17.850 7.226 4.725
119 HB2 LYS 18 2HB LYS 18 19.569 6.208 6.215
120 HB3 LYS 18 1HB LYS 18 18.759 6.933 7.600
121 HG2 LYS 18 2HG LYS 18 16.746 5.622 7.110
122 HG3 LYS 18 1HG LYS 18 17.559 4.895 5.721
123 HD2 LYS 18 2HD LYS 18 19.287 3.990 7.275
124 HD3 LYS 18 1HD LYS 18 18.347 4.622 8.630
125 HE2 LYS 18 2HE LYS 18 17.881 2.253 8.306
126 HE3 LYS 18 1HE LYS 18 16.446 3.216 7.954
127 HZ1 LYS 18 3HZ LYS 18 16.942 3.023 5.597
128 HZ2 LYS 18 1HZ LYS 18 16.779 1.494 6.300
129 HZ3 LYS 18 2HZ LYS 18 18.314 2.100 5.937
130 H GLN 19 H GLN 19 15.670 7.139 5.015
131 HA GLN 19 HA GLN 19 14.489 9.022 6.963
132 HB2 GLN 19 2HB GLN 19 13.270 8.001 4.383
133 HB3 GLN 19 1HB GLN 19 12.575 9.203 5.458
134 HG2 GLN 19 2HG GLN 19 15.140 9.533 3.901
135 HG3 GLN 19 1HG GLN 19 13.570 10.186 3.439
136 HE21 GLN 19 1HE2 GLN 19 16.257 10.476 5.617
137 HE22 GLN 19 2HE2 GLN 19 15.831 12.023 6.246
138 H ALA 20 H ALA 20 13.156 8.236 8.498
139 HA ALA 20 HA ALA 20 12.720 5.369 8.649
140 HB1 ALA 20 3HB ALA 20 11.892 5.809 10.895
141 HB2 ALA 20 1HB ALA 20 11.938 7.546 10.587
142 HB3 ALA 20 2HB ALA 20 13.437 6.617 10.632
143 H PHE 21 H PHE 21 10.973 4.407 7.830
144 HA PHE 21 HA PHE 21 8.740 5.711 6.740
145 HB2 PHE 21 2HB PHE 21 9.035 2.839 7.662
146 HB3 PHE 21 1HB PHE 21 7.704 3.437 6.680
147 HD1 PHE 21 HD1 PHE 21 8.383 4.580 4.425
148 HD2 PHE 21 HD2 PHE 21 10.903 1.940 6.627
149 HE1 PHE 21 HE1 PHE 21 9.672 4.106 2.382
150 HE2 PHE 21 HE2 PHE 21 12.199 1.471 4.589
151 HZ PHE 21 HZ PHE 21 11.582 2.551 2.462
152 HA PRO 22 HA PRO 22 6.573 6.340 10.683
153 HB2 PRO 22 2HB PRO 22 4.694 8.049 9.771
154 HB3 PRO 22 1HB PRO 22 6.363 8.558 10.058
155 HG2 PRO 22 2HG PRO 22 5.019 7.836 7.476
156 HG3 PRO 22 1HG PRO 22 6.138 9.171 7.818
157 HD2 PRO 22 2HD PRO 22 6.893 6.816 6.623
158 HD3 PRO 22 1HD PRO 22 7.993 7.832 7.575
159 H ARG 23 H ARG 23 5.663 4.316 11.013
160 HA ARG 23 HA ARG 23 3.653 3.281 9.231
161 HB2 ARG 23 2HB ARG 23 3.540 1.371 10.855
162 HB3 ARG 23 1HB ARG 23 5.118 1.663 10.146
163 HG2 ARG 23 2HG ARG 23 5.910 2.680 12.176
164 HG3 ARG 23 1HG ARG 23 4.298 2.596 12.894
165 HD2 ARG 23 2HD ARG 23 4.362 0.184 12.884
166 HD3 ARG 23 1HD ARG 23 5.884 0.187 11.996
167 HE ARG 23 HE ARG 23 6.722 1.408 14.121
168 HH11 ARG 23 1HH1 ARG 23 4.323 -1.073 14.085
169 HH12 ARG 23 2HH1 ARG 23 4.800 -1.706 15.621
170 HH21 ARG 23 1HH2 ARG 23 7.321 0.562 16.103
171 HH22 ARG 23 2HH2 ARG 23 6.456 -0.799 16.738
172 H LYS 24 H LYS 24 3.615 5.110 12.170
173 HA LYS 24 HA LYS 24 1.111 4.574 13.226
174 HB2 LYS 24 2HB LYS 24 2.466 7.267 12.933
175 HB3 LYS 24 1HB LYS 24 1.064 6.967 13.952
176 HG2 LYS 24 2HG LYS 24 2.391 5.361 15.268
177 HG3 LYS 24 1HG LYS 24 3.799 5.737 14.271
178 HD2 LYS 24 2HD LYS 24 3.691 8.077 14.994
179 HD3 LYS 24 1HD LYS 24 2.269 7.714 15.976
180 HE2 LYS 24 2HE LYS 24 5.027 6.537 16.337
181 HE3 LYS 24 1HE LYS 24 4.300 7.792 17.339
182 HZ1 LYS 24 3HZ LYS 24 4.092 5.668 18.410
183 HZ2 LYS 24 1HZ LYS 24 3.346 4.996 17.052
184 HZ3 LYS 24 2HZ LYS 24 2.553 6.193 17.944
185 H PHE 25 H PHE 25 1.924 6.546 10.414
186 HA PHE 25 HA PHE 25 -0.877 7.225 9.944
187 HB2 PHE 25 2HB PHE 25 1.581 7.972 8.338
188 HB3 PHE 25 1HB PHE 25 -0.033 8.650 8.148
189 HD1 PHE 25 HD1 PHE 25 -0.958 10.154 9.872
190 HD2 PHE 25 HD2 PHE 25 3.042 8.701 10.092
191 HE1 PHE 25 HE1 PHE 25 -0.413 11.898 11.516
192 HE2 PHE 25 HE2 PHE 25 3.584 10.444 11.736
193 HZ PHE 25 HZ PHE 25 1.857 12.044 12.449
194 H VAL 26 H VAL 26 1.762 5.475 8.292
195 HA VAL 26 HA VAL 26 0.343 4.841 5.956
196 HB VAL 26 HB VAL 26 2.621 3.292 7.214
197 HG11 VAL 26 1HG1 VAL 26 1.581 3.281 4.375
198 HG12 VAL 26 2HG1 VAL 26 1.448 1.961 5.538
199 HG13 VAL 26 3HG1 VAL 26 3.031 2.454 4.940
200 HG21 VAL 26 3HG2 VAL 26 3.169 5.652 6.811
201 HG22 VAL 26 1HG2 VAL 26 2.664 5.485 5.128
202 HG23 VAL 26 2HG2 VAL 26 4.064 4.591 5.723
203 H LEU 27 H LEU 27 0.868 2.793 8.862
204 HA LEU 27 HA LEU 27 -0.754 0.657 7.951
205 HB2 LEU 27 2HB LEU 27 0.015 1.449 10.766
206 HB3 LEU 27 1HB LEU 27 -0.798 -0.049 10.346
207 HG LEU 27 HG LEU 27 1.974 0.773 9.449
208 HD11 LEU 27 1HD1 LEU 27 1.874 0.146 11.807
209 HD12 LEU 27 2HD1 LEU 27 2.740 -1.062 10.860
210 HD13 LEU 27 3HD1 LEU 27 1.082 -1.370 11.376
211 HD21 LEU 27 3HD2 LEU 27 0.880 -0.529 7.715
212 HD22 LEU 27 1HD2 LEU 27 0.407 -1.750 8.900
213 HD23 LEU 27 2HD2 LEU 27 2.112 -1.507 8.515
214 H ALA 28 H ALA 28 -1.503 3.638 9.645
215 HA ALA 28 HA ALA 28 -4.169 3.053 10.383
216 HB1 ALA 28 3HB ALA 28 -2.959 5.731 9.673
217 HB2 ALA 28 1HB ALA 28 -2.952 4.984 11.272
218 HB3 ALA 28 2HB ALA 28 -4.478 5.474 10.536
219 H ALA 29 H ALA 29 -2.850 4.652 7.484
220 HA ALA 29 HA ALA 29 -5.277 4.936 6.093
221 HB1 ALA 29 3HB ALA 29 -2.509 4.554 4.943
222 HB2 ALA 29 1HB ALA 29 -3.196 6.092 5.467
223 HB3 ALA 29 2HB ALA 29 -3.906 5.229 4.103
224 H LEU 30 H LEU 30 -2.925 2.324 6.192
225 HA LEU 30 HA LEU 30 -3.954 0.656 4.207
226 HB2 LEU 30 2HB LEU 30 -1.756 0.416 5.298
227 HB3 LEU 30 1HB LEU 30 -2.547 -0.093 6.777
228 HG LEU 30 HG LEU 30 -3.371 -2.121 5.656
229 HD11 LEU 30 1HD1 LEU 30 -3.564 -1.242 3.381
230 HD12 LEU 30 2HD1 LEU 30 -2.587 -2.709 3.419
231 HD13 LEU 30 3HD1 LEU 30 -1.804 -1.136 3.268
232 HD21 LEU 30 3HD2 LEU 30 -1.186 -3.231 5.376
233 HD22 LEU 30 1HD2 LEU 30 -1.251 -2.226 6.823
234 HD23 LEU 30 2HD2 LEU 30 -0.397 -1.654 5.389
235 H GLU 31 H GLU 31 -4.554 0.471 7.740
236 HA GLU 31 HA GLU 31 -6.413 -1.638 7.584
237 HB2 GLU 31 2HB GLU 31 -6.987 -1.091 9.892
238 HB3 GLU 31 1HB GLU 31 -5.246 -1.044 9.655
239 HG2 GLU 31 2HG GLU 31 -5.367 1.420 9.493
240 HG3 GLU 31 1HG GLU 31 -7.096 1.333 9.826
241 H GLN 32 H GLN 32 -6.830 1.822 7.225
242 HA GLN 32 HA GLN 32 -9.722 1.676 7.391
243 HB2 GLN 32 2HB GLN 32 -7.831 3.951 6.768
244 HB3 GLN 32 1HB GLN 32 -9.583 4.126 6.798
245 HG2 GLN 32 2HG GLN 32 -9.648 3.500 9.135
246 HG3 GLN 32 1HG GLN 32 -7.914 3.191 9.130
247 HE21 GLN 32 1HE2 GLN 32 -6.500 4.921 9.101
248 HE22 GLN 32 2HE2 GLN 32 -6.993 6.528 9.492
249 H SER 33 H SER 33 -7.583 0.875 4.994
250 HA SER 33 HA SER 33 -9.603 1.403 2.892
251 HB2 SER 33 2HB SER 33 -7.751 1.409 1.247
252 HB3 SER 33 1HB SER 33 -7.567 2.685 2.447
253 HG SER 33 HG SER 33 -5.858 1.704 3.264
254 H SER 34 H SER 34 -8.722 -0.964 4.810
255 HA SER 34 HA SER 34 -8.342 -3.076 2.814
256 HB2 SER 34 2HB SER 34 -8.246 -3.164 5.844
257 HB3 SER 34 1HB SER 34 -7.999 -4.564 4.801
258 HG SER 34 HG SER 34 -6.447 -2.226 4.485
259 H ASP 35 H ASP 35 -9.736 -4.832 2.556
260 HA ASP 35 HA ASP 35 -12.493 -4.559 3.115
261 HB2 ASP 35 2HB ASP 35 -10.938 -7.093 2.508
262 HB3 ASP 35 1HB ASP 35 -12.682 -6.906 2.384
263 H ASP 36 H ASP 36 -13.735 -6.318 4.375
264 HA ASP 36 HA ASP 36 -13.161 -6.253 7.097
265 HB2 ASP 36 2HB ASP 36 -15.385 -6.751 6.264
266 HB3 ASP 36 1HB ASP 36 -14.815 -8.244 5.525
267 H ALA 37 H ALA 37 -12.136 -8.576 4.661
268 HA ALA 37 HA ALA 37 -11.052 -10.484 6.518
269 HB1 ALA 37 3HB ALA 37 -10.129 -11.589 4.550
270 HB2 ALA 37 1HB ALA 37 -10.548 -10.192 3.556
271 HB3 ALA 37 2HB ALA 37 -11.822 -11.162 4.300
272 H GLY 38 H GLY 38 -10.004 -7.446 5.742
273 HA2 GLY 38 2HA GLY 38 -8.062 -6.368 6.410
274 HA3 GLY 38 1HA GLY 38 -7.379 -7.924 6.848
275 H TRP 39 H TRP 39 -8.533 -6.571 3.742
276 HA TRP 39 HA TRP 39 -5.795 -6.721 2.694
277 HB2 TRP 39 2HB TRP 39 -8.210 -8.043 1.438
278 HB3 TRP 39 1HB TRP 39 -6.740 -7.690 0.535
279 HD1 TRP 39 HD1 TRP 39 -8.231 -10.257 2.838
280 HE1 TRP 39 HE1 TRP 39 -6.489 -12.091 3.338
281 HE3 TRP 39 HE3 TRP 39 -4.080 -7.978 0.905
282 HZ2 TRP 39 HZ2 TRP 39 -3.720 -12.513 2.943
283 HZ3 TRP 39 HZ3 TRP 39 -1.927 -9.165 1.001
284 HH2 TRP 39 HH2 TRP 39 -1.754 -11.382 2.001
285 H ALA 40 H ALA 40 -5.271 -4.823 1.835
286 HA ALA 40 HA ALA 40 -7.431 -3.020 0.942
287 HB1 ALA 40 3HB ALA 40 -5.870 -1.191 1.396
288 HB2 ALA 40 1HB ALA 40 -4.634 -2.358 1.865
289 HB3 ALA 40 2HB ALA 40 -6.106 -2.201 2.822
290 H ASN 41 H ASN 41 -7.623 -2.641 -1.176
291 HA ASN 41 HA ASN 41 -5.776 -3.496 -3.138
292 HB2 ASN 41 2HB ASN 41 -8.187 -3.141 -3.577
293 HB3 ASN 41 1HB ASN 41 -7.968 -1.409 -3.372
294 HD21 ASN 41 1HD2 ASN 41 -8.907 -2.972 -5.672
295 HD22 ASN 41 2HD2 ASN 41 -7.876 -2.527 -6.984
296 H LEU 42 H LEU 42 -3.969 -2.582 -3.889
297 HA LEU 42 HA LEU 42 -2.559 -0.552 -2.755
298 HB2 LEU 42 2HB LEU 42 -1.641 -2.127 -4.383
299 HB3 LEU 42 1HB LEU 42 -2.552 -1.354 -5.667
300 HG LEU 42 HG LEU 42 -1.225 0.731 -5.281
301 HD11 LEU 42 1HD1 LEU 42 0.843 0.601 -3.991
302 HD12 LEU 42 2HD1 LEU 42 0.431 -1.035 -3.475
303 HD13 LEU 42 3HD1 LEU 42 -0.563 0.330 -2.963
304 HD21 LEU 42 3HD2 LEU 42 -0.645 -0.812 -7.072
305 HD22 LEU 42 1HD2 LEU 42 0.352 -1.751 -5.961
306 HD23 LEU 42 2HD2 LEU 42 0.807 -0.098 -6.373
307 H GLY 43 H GLY 43 -4.799 -0.203 -5.507
308 HA2 GLY 43 2HA GLY 43 -4.317 2.511 -6.071
309 HA3 GLY 43 1HA GLY 43 -5.784 1.634 -6.474
310 H ASN 44 H ASN 44 -6.430 1.028 -3.679
311 HA ASN 44 HA ASN 44 -7.696 3.556 -2.995
312 HB2 ASN 44 2HB ASN 44 -7.889 0.858 -1.619
313 HB3 ASN 44 1HB ASN 44 -8.922 2.255 -1.314
314 HD21 ASN 44 1HD2 ASN 44 -9.700 -0.397 -2.198
315 HD22 ASN 44 2HD2 ASN 44 -10.487 -0.190 -3.721
316 H PHE 45 H PHE 45 -5.301 1.352 -1.643
317 HA PHE 45 HA PHE 45 -4.851 2.542 0.832
318 HB2 PHE 45 2HB PHE 45 -3.897 0.399 0.365
319 HB3 PHE 45 1HB PHE 45 -3.013 1.022 -1.024
320 HD1 PHE 45 HD1 PHE 45 -3.309 1.794 2.633
321 HD2 PHE 45 HD2 PHE 45 -0.741 1.241 -0.725
322 HE1 PHE 45 HE1 PHE 45 -1.348 2.181 4.065
323 HE2 PHE 45 HE2 PHE 45 1.218 1.624 0.710
324 HZ PHE 45 HZ PHE 45 0.913 2.097 3.103
325 H GLY 46 H GLY 46 -2.999 3.085 -2.191
326 HA2 GLY 46 2HA GLY 46 -1.341 5.123 -1.223
327 HA3 GLY 46 1HA GLY 46 -1.760 4.884 -2.910
328 H ASN 47 H ASN 47 -4.582 5.337 -2.610
329 HA ASN 47 HA ASN 47 -4.680 8.132 -2.958
330 HB2 ASN 47 2HB ASN 47 -6.281 6.422 -3.915
331 HB3 ASN 47 1HB ASN 47 -7.020 6.309 -2.322
332 HD21 ASN 47 1HD2 ASN 47 -8.306 7.081 -4.715
333 HD22 ASN 47 2HD2 ASN 47 -8.867 8.700 -4.503
334 H TYR 48 H TYR 48 -5.975 6.123 -0.283
335 HA TYR 48 HA TYR 48 -6.733 8.349 1.318
336 HB2 TYR 48 2HB TYR 48 -7.724 6.041 1.480
337 HB3 TYR 48 1HB TYR 48 -6.233 5.510 2.252
338 HD1 TYR 48 HD2 TYR 48 -8.920 8.068 2.596
339 HD2 TYR 48 HD1 TYR 48 -6.076 5.611 4.585
340 HE1 TYR 48 HE2 TYR 48 -9.808 8.806 4.768
341 HE2 TYR 48 HE1 TYR 48 -6.953 6.339 6.760
342 HH TYR 48 HH TYR 48 -8.196 8.141 7.735
343 H LEU 49 H LEU 49 -3.803 6.403 1.124
344 HA LEU 49 HA LEU 49 -2.546 7.137 3.505
345 HB2 LEU 49 2HB LEU 49 -1.682 5.379 2.061
346 HB3 LEU 49 1HB LEU 49 -1.339 6.547 0.797
347 HG LEU 49 HG LEU 49 0.394 7.582 2.190
348 HD11 LEU 49 1HD1 LEU 49 -0.564 7.160 4.384
349 HD12 LEU 49 2HD1 LEU 49 1.090 6.557 4.295
350 HD13 LEU 49 3HD1 LEU 49 -0.266 5.432 4.201
351 HD21 LEU 49 3HD2 LEU 49 1.074 5.801 0.694
352 HD22 LEU 49 1HD2 LEU 49 0.681 4.585 1.912
353 HD23 LEU 49 2HD2 LEU 49 2.008 5.713 2.185
354 H ASN 50 H ASN 50 -2.454 8.758 0.331
355 HA ASN 50 HA ASN 50 -0.630 10.782 1.022
356 HB2 ASN 50 2HB ASN 50 -1.281 10.228 -1.310
357 HB3 ASN 50 1HB ASN 50 -2.863 10.943 -1.019
358 HD21 ASN 50 1HD2 ASN 50 0.544 11.598 -1.384
359 HD22 ASN 50 2HD2 ASN 50 0.377 13.287 -1.696
360 H LYS 51 H LYS 51 -4.008 10.459 1.802
361 HA LYS 51 HA LYS 51 -4.532 13.208 2.380
362 HB2 LYS 51 2HB LYS 51 -5.878 10.801 3.629
363 HB3 LYS 51 1HB LYS 51 -6.512 12.440 3.539
364 HG2 LYS 51 2HG LYS 51 -6.506 12.191 1.032
365 HG3 LYS 51 1HG LYS 51 -6.121 10.487 1.280
366 HD2 LYS 51 2HD LYS 51 -8.481 10.636 0.996
367 HD3 LYS 51 1HD LYS 51 -8.185 10.323 2.708
368 HE2 LYS 51 2HE LYS 51 -9.894 12.009 2.500
369 HE3 LYS 51 1HE LYS 51 -8.434 12.756 3.147
370 HZ1 LYS 51 3HZ LYS 51 -9.335 14.178 1.478
371 HZ2 LYS 51 1HZ LYS 51 -9.442 12.912 0.358
372 HZ3 LYS 51 2HZ LYS 51 -7.927 13.489 0.838
373 H LEU 52 H LEU 52 -3.131 10.557 4.188
374 HA LEU 52 HA LEU 52 -3.132 12.040 6.692
375 HB2 LEU 52 2HB LEU 52 -1.893 9.364 6.024
376 HB3 LEU 52 1HB LEU 52 -2.048 10.050 7.631
377 HG LEU 52 HG LEU 52 -4.313 9.141 5.839
378 HD11 LEU 52 1HD1 LEU 52 -4.715 7.494 7.620
379 HD12 LEU 52 2HD1 LEU 52 -3.271 8.062 8.462
380 HD13 LEU 52 3HD1 LEU 52 -3.129 7.296 6.878
381 HD21 LEU 52 3HD2 LEU 52 -4.998 11.123 7.071
382 HD22 LEU 52 1HD2 LEU 52 -4.431 10.408 8.580
383 HD23 LEU 52 2HD2 LEU 52 -5.795 9.691 7.721
384 H GLN 53 H GLN 53 -0.726 10.826 4.358
385 HA GLN 53 HA GLN 53 1.170 12.854 5.377
386 HB2 GLN 53 2HB GLN 53 1.794 10.004 4.568
387 HB3 GLN 53 1HB GLN 53 3.023 11.241 4.782
388 HG2 GLN 53 2HG GLN 53 1.134 10.300 6.936
389 HG3 GLN 53 1HG GLN 53 2.786 9.730 6.718
390 HE21 GLN 53 1HE2 GLN 53 0.789 12.341 7.802
391 HE22 GLN 53 2HE2 GLN 53 2.045 13.269 8.533
392 HA PRO 54 HA PRO 54 0.679 13.521 0.804
393 HB2 PRO 54 2HB PRO 54 0.641 16.230 0.923
394 HB3 PRO 54 1HB PRO 54 -0.807 15.251 1.179
395 HG2 PRO 54 2HG PRO 54 1.009 16.510 3.211
396 HG3 PRO 54 1HG PRO 54 -0.764 16.477 3.169
397 HD2 PRO 54 2HD PRO 54 0.689 14.788 4.716
398 HD3 PRO 54 1HD PRO 54 -0.871 14.324 4.004
399 H ASP 55 H ASP 55 2.911 14.437 3.233
400 HA ASP 55 HA ASP 55 4.901 15.471 1.369
401 HB2 ASP 55 2HB ASP 55 4.471 16.538 3.598
402 HB3 ASP 55 1HB ASP 55 5.095 15.084 4.368
403 H PHE 56 H PHE 56 3.893 12.479 2.095
404 HA PHE 56 HA PHE 56 6.514 11.210 2.415
405 HB2 PHE 56 2HB PHE 56 4.588 10.378 3.730
406 HB3 PHE 56 1HB PHE 56 3.752 9.969 2.237
407 HD1 PHE 56 HD1 PHE 56 6.836 9.232 4.180
408 HD2 PHE 56 HD2 PHE 56 4.043 7.847 1.272
409 HE1 PHE 56 HE1 PHE 56 7.887 7.009 4.237
410 HE2 PHE 56 HE2 PHE 56 5.094 5.619 1.324
411 HZ PHE 56 HZ PHE 56 7.020 5.198 2.806
412 H ASP 57 H ASP 57 7.663 11.119 0.579
413 HA ASP 57 HA ASP 57 6.282 10.446 -1.940
414 HB2 ASP 57 2HB ASP 57 7.116 12.661 -2.103
415 HB3 ASP 57 1HB ASP 57 8.660 12.213 -1.387
416 H SER 58 H SER 58 7.097 8.896 -3.288
417 HA SER 58 HA SER 58 8.785 6.883 -2.117
418 HB2 SER 58 2HB SER 58 7.634 7.076 -4.916
419 HB3 SER 58 1HB SER 58 8.407 5.651 -4.229
420 HG SER 58 HG SER 58 6.629 6.209 -2.480
421 H ARG 59 H ARG 59 9.251 9.447 -4.492
422 HA ARG 59 HA ARG 59 11.626 8.463 -5.673
423 HB2 ARG 59 2HB ARG 59 10.702 11.331 -5.369
424 HB3 ARG 59 1HB ARG 59 11.991 10.791 -6.436
425 HG2 ARG 59 2HG ARG 59 9.104 9.926 -6.636
426 HG3 ARG 59 1HG ARG 59 9.857 11.189 -7.609
427 HD2 ARG 59 2HD ARG 59 10.728 8.296 -7.548
428 HD3 ARG 59 1HD ARG 59 9.713 9.021 -8.791
429 HE ARG 59 HE ARG 59 11.600 10.407 -9.416
430 HH11 ARG 59 1HH1 ARG 59 12.323 7.740 -7.351
431 HH12 ARG 59 2HH1 ARG 59 13.986 7.693 -7.825
432 HH21 ARG 59 1HH2 ARG 59 13.713 10.304 -10.037
433 HH22 ARG 59 2HH2 ARG 59 14.760 9.115 -9.343
434 H LEU 60 H LEU 60 11.072 10.433 -2.793
435 HA LEU 60 HA LEU 60 13.632 11.213 -2.114
436 HB2 LEU 60 2HB LEU 60 11.543 10.129 -0.215
437 HB3 LEU 60 1HB LEU 60 12.903 11.144 0.229
438 HG LEU 60 HG LEU 60 10.586 11.979 -1.528
439 HD11 LEU 60 1HD1 LEU 60 9.962 13.412 0.362
440 HD12 LEU 60 2HD1 LEU 60 11.256 12.699 1.326
441 HD13 LEU 60 3HD1 LEU 60 9.906 11.700 0.783
442 HD21 LEU 60 3HD2 LEU 60 12.640 13.125 -2.160
443 HD22 LEU 60 1HD2 LEU 60 12.924 13.585 -0.481
444 HD23 LEU 60 2HD2 LEU 60 11.533 14.235 -1.353
445 H TYR 61 H TYR 61 12.125 8.052 -1.590
446 HA TYR 61 HA TYR 61 14.455 6.983 -0.232
447 HB2 TYR 61 2HB TYR 61 11.858 5.699 -1.107
448 HB3 TYR 61 1HB TYR 61 13.118 4.864 -0.204
449 HD1 TYR 61 HD1 TYR 61 10.544 7.509 -0.036
450 HD2 TYR 61 HD2 TYR 61 13.399 5.221 2.147
451 HE1 TYR 61 HE1 TYR 61 9.540 8.278 2.074
452 HE2 TYR 61 HE2 TYR 61 12.402 5.984 4.257
453 HH TYR 61 HH TYR 61 9.392 7.561 4.412
454 H GLY 62 H GLY 62 13.999 7.646 -3.373
455 HA2 GLY 62 2HA GLY 62 15.468 7.016 -5.096
456 HA3 GLY 62 1HA GLY 62 15.854 5.547 -4.221
457 H TYR 63 H TYR 63 12.617 5.557 -4.091
458 HA TYR 63 HA TYR 63 12.411 3.601 -6.214
459 HB2 TYR 63 2HB TYR 63 10.319 4.611 -4.272
460 HB3 TYR 63 1HB TYR 63 10.104 3.260 -5.380
461 HD1 TYR 63 HD1 TYR 63 11.953 4.424 -2.402
462 HD2 TYR 63 HD2 TYR 63 10.931 1.079 -4.825
463 HE1 TYR 63 HE1 TYR 63 12.827 2.912 -0.674
464 HE2 TYR 63 HE2 TYR 63 11.800 -0.444 -3.098
465 HH TYR 63 HH TYR 63 13.409 -0.367 -1.222
466 H LYS 64 H LYS 64 10.543 3.604 -7.696
467 HA LYS 64 HA LYS 64 10.098 6.260 -8.855
468 HB2 LYS 64 2HB LYS 64 9.590 3.488 -9.959
469 HB3 LYS 64 1HB LYS 64 9.213 4.977 -10.814
470 HG2 LYS 64 2HG LYS 64 11.961 4.080 -9.950
471 HG3 LYS 64 1HG LYS 64 11.309 4.012 -11.589
472 HD2 LYS 64 2HD LYS 64 11.063 6.485 -11.552
473 HD3 LYS 64 1HD LYS 64 11.817 6.509 -9.957
474 HE2 LYS 64 2HE LYS 64 13.457 7.055 -11.654
475 HE3 LYS 64 1HE LYS 64 13.847 5.502 -10.920
476 HZ1 LYS 64 3HZ LYS 64 12.426 5.831 -13.506
477 HZ2 LYS 64 1HZ LYS 64 12.953 4.374 -12.822
478 HZ3 LYS 64 2HZ LYS 64 14.078 5.520 -13.351
479 H LYS 65 H LYS 65 8.234 3.397 -7.803
480 HA LYS 65 HA LYS 65 5.904 5.151 -7.412
481 HB2 LYS 65 2HB LYS 65 4.416 3.390 -8.387
482 HB3 LYS 65 1HB LYS 65 5.480 4.164 -9.552
483 HG2 LYS 65 2HG LYS 65 6.968 2.242 -9.520
484 HG3 LYS 65 1HG LYS 65 5.976 1.471 -8.282
485 HD2 LYS 65 2HD LYS 65 5.491 0.535 -10.482
486 HD3 LYS 65 1HD LYS 65 4.084 1.394 -9.852
487 HE2 LYS 65 2HE LYS 65 4.402 1.885 -12.220
488 HE3 LYS 65 1HE LYS 65 4.649 3.335 -11.252
489 HZ1 LYS 65 3HZ LYS 65 6.311 2.978 -13.042
490 HZ2 LYS 65 1HZ LYS 65 6.863 1.612 -12.214
491 HZ3 LYS 65 2HZ LYS 65 6.989 3.143 -11.505
492 H LEU 66 H LEU 66 4.307 4.388 -5.960
493 HA LEU 66 HA LEU 66 5.257 3.424 -3.554
494 HB2 LEU 66 2HB LEU 66 3.198 4.725 -3.819
495 HB3 LEU 66 1HB LEU 66 2.418 3.357 -4.593
496 HG LEU 66 HG LEU 66 2.642 2.073 -2.468
497 HD11 LEU 66 1HD1 LEU 66 3.597 4.702 -1.331
498 HD12 LEU 66 2HD1 LEU 66 4.557 3.233 -1.512
499 HD13 LEU 66 3HD1 LEU 66 3.189 3.260 -0.400
500 HD21 LEU 66 3HD2 LEU 66 0.862 3.238 -1.275
501 HD22 LEU 66 1HD2 LEU 66 0.568 3.249 -3.014
502 HD23 LEU 66 2HD2 LEU 66 1.172 4.699 -2.212
503 H SER 67 H SER 67 3.705 1.542 -6.142
504 HA SER 67 HA SER 67 3.105 -0.809 -4.803
505 HB2 SER 67 2HB SER 67 3.260 -1.946 -6.973
506 HB3 SER 67 1HB SER 67 2.478 -0.376 -7.154
507 HG SER 67 HG SER 67 4.450 -1.211 -8.555
508 H ASP 68 H ASP 68 6.120 -0.105 -6.552
509 HA ASP 68 HA ASP 68 7.503 -2.436 -5.825
510 HB2 ASP 68 2HB ASP 68 8.171 -0.998 -7.691
511 HB3 ASP 68 1HB ASP 68 8.584 0.294 -6.570
512 H LEU 69 H LEU 69 7.352 0.742 -4.250
513 HA LEU 69 HA LEU 69 9.251 0.382 -2.241
514 HB2 LEU 69 2HB LEU 69 8.220 2.531 -2.588
515 HB3 LEU 69 1HB LEU 69 6.633 1.890 -2.205
516 HG LEU 69 HG LEU 69 7.409 1.500 0.141
517 HD11 LEU 69 1HD1 LEU 69 9.441 2.582 0.922
518 HD12 LEU 69 2HD1 LEU 69 9.839 3.059 -0.728
519 HD13 LEU 69 3HD1 LEU 69 9.804 1.353 -0.287
520 HD21 LEU 69 3HD2 LEU 69 6.122 3.491 -0.451
521 HD22 LEU 69 1HD2 LEU 69 7.616 4.355 -0.824
522 HD23 LEU 69 2HD2 LEU 69 7.284 3.831 0.830
523 H VAL 70 H VAL 70 5.768 -0.379 -2.126
524 HA VAL 70 HA VAL 70 5.743 -1.352 0.516
525 HB VAL 70 HB VAL 70 3.874 -2.090 -1.754
526 HG11 VAL 70 1HG1 VAL 70 3.509 -2.308 1.240
527 HG12 VAL 70 2HG1 VAL 70 3.679 -3.647 0.108
528 HG13 VAL 70 3HG1 VAL 70 2.258 -2.608 0.034
529 HG21 VAL 70 3HG2 VAL 70 3.973 0.324 -1.416
530 HG22 VAL 70 1HG2 VAL 70 3.672 0.113 0.309
531 HG23 VAL 70 2HG2 VAL 70 2.423 -0.312 -0.862
532 H LYS 71 H LYS 71 5.954 -3.152 -2.577
533 HA LYS 71 HA LYS 71 6.071 -5.711 -1.323
534 HB2 LYS 71 2HB LYS 71 6.649 -6.579 -3.536
535 HB3 LYS 71 1HB LYS 71 5.294 -5.463 -3.623
536 HG2 LYS 71 2HG LYS 71 6.787 -3.701 -4.435
537 HG3 LYS 71 1HG LYS 71 8.156 -4.808 -4.327
538 HD2 LYS 71 2HD LYS 71 5.716 -5.235 -6.065
539 HD3 LYS 71 1HD LYS 71 7.261 -4.591 -6.629
540 HE2 LYS 71 2HE LYS 71 8.381 -6.653 -6.092
541 HE3 LYS 71 1HE LYS 71 6.929 -7.294 -5.322
542 HZ1 LYS 71 3HZ LYS 71 7.106 -6.576 -8.191
543 HZ2 LYS 71 1HZ LYS 71 5.825 -7.362 -7.415
544 HZ3 LYS 71 2HZ LYS 71 7.312 -8.145 -7.583
545 H ALA 72 H ALA 72 8.511 -3.333 -2.028
546 HA ALA 72 HA ALA 72 10.748 -5.110 -1.695
547 HB1 ALA 72 3HB ALA 72 12.097 -3.082 -1.609
548 HB2 ALA 72 1HB ALA 72 10.642 -2.099 -1.444
549 HB3 ALA 72 2HB ALA 72 10.939 -2.992 -2.935
550 H ARG 73 H ARG 73 8.845 -3.024 0.409
551 HA ARG 73 HA ARG 73 10.555 -3.625 2.713
552 HB2 ARG 73 2HB ARG 73 8.181 -1.754 2.502
553 HB3 ARG 73 1HB ARG 73 9.286 -1.881 3.866
554 HG2 ARG 73 2HG ARG 73 10.016 -0.961 1.082
555 HG3 ARG 73 1HG ARG 73 9.783 0.074 2.490
556 HD2 ARG 73 2HD ARG 73 11.683 -0.913 3.599
557 HD3 ARG 73 1HD ARG 73 11.859 -2.112 2.317
558 HE ARG 73 HE ARG 73 12.086 0.246 1.008
559 HH11 ARG 73 1HH1 ARG 73 13.712 -1.093 3.743
560 HH12 ARG 73 2HH1 ARG 73 15.186 -0.263 3.396
561 HH21 ARG 73 1HH2 ARG 73 13.978 1.291 0.574
562 HH22 ARG 73 2HH2 ARG 73 15.335 1.084 1.623
563 H THR 74 H THR 74 9.326 -5.889 1.917
564 HA THR 74 HA THR 74 6.818 -6.480 3.041
565 HB THR 74 HB THR 74 7.558 -8.871 3.017
566 HG1 THR 74 HG1 THR 74 9.647 -9.294 2.131
567 HG21 THR 74 3HG2 THR 74 6.581 -7.861 1.013
568 HG22 THR 74 1HG2 THR 74 7.833 -9.026 0.581
569 HG23 THR 74 2HG2 THR 74 8.174 -7.297 0.511
570 H ASP 75 H ASP 75 9.869 -6.012 4.559
571 HA ASP 75 HA ASP 75 9.573 -7.295 7.008
572 HB2 ASP 75 2HB ASP 75 11.610 -6.126 6.383
573 HB3 ASP 75 1HB ASP 75 10.762 -4.584 6.353
574 H LEU 76 H LEU 76 8.021 -4.414 5.780
575 HA LEU 76 HA LEU 76 6.700 -3.873 8.354
576 HB2 LEU 76 2HB LEU 76 6.922 -2.205 5.841
577 HB3 LEU 76 1HB LEU 76 6.082 -1.712 7.301
578 HG LEU 76 HG LEU 76 9.043 -2.329 7.206
579 HD11 LEU 76 1HD1 LEU 76 9.357 0.120 7.284
580 HD12 LEU 76 2HD1 LEU 76 7.624 0.331 7.033
581 HD13 LEU 76 3HD1 LEU 76 8.616 -0.423 5.781
582 HD21 LEU 76 3HD2 LEU 76 7.994 -2.567 9.417
583 HD22 LEU 76 1HD2 LEU 76 7.350 -0.931 9.286
584 HD23 LEU 76 2HD2 LEU 76 9.094 -1.189 9.367
585 H PHE 77 H PHE 77 5.998 -4.573 4.944
586 HA PHE 77 HA PHE 77 3.109 -4.652 5.593
587 HB2 PHE 77 2HB PHE 77 4.306 -3.922 2.906
588 HB3 PHE 77 1HB PHE 77 2.617 -3.796 3.389
589 HD1 PHE 77 HD1 PHE 77 2.536 -2.413 5.840
590 HD2 PHE 77 HD2 PHE 77 5.269 -1.850 2.614
591 HE1 PHE 77 HE1 PHE 77 2.939 -0.103 6.579
592 HE2 PHE 77 HE2 PHE 77 5.670 0.458 3.352
593 HZ PHE 77 HZ PHE 77 4.505 1.335 5.335
594 H VAL 78 H VAL 78 1.911 -6.361 4.898
595 HA VAL 78 HA VAL 78 3.252 -8.615 3.594
596 HB VAL 78 HB VAL 78 0.422 -8.419 4.671
597 HG11 VAL 78 1HG1 VAL 78 0.424 -10.878 4.521
598 HG12 VAL 78 2HG1 VAL 78 2.017 -10.820 3.765
599 HG13 VAL 78 3HG1 VAL 78 0.624 -10.120 2.940
600 HG21 VAL 78 3HG2 VAL 78 2.881 -9.665 5.914
601 HG22 VAL 78 1HG2 VAL 78 1.244 -9.733 6.573
602 HG23 VAL 78 2HG2 VAL 78 2.083 -8.186 6.453
603 H THR 79 H THR 79 3.108 -8.920 1.436
604 HA THR 79 HA THR 79 1.052 -7.404 -0.060
605 HB THR 79 HB THR 79 2.630 -7.190 -1.898
606 HG1 THR 79 HG1 THR 79 3.779 -9.276 -1.050
607 HG21 THR 79 3HG2 THR 79 2.716 -5.467 -0.162
608 HG22 THR 79 1HG2 THR 79 4.322 -5.749 -0.835
609 HG23 THR 79 2HG2 THR 79 3.896 -6.417 0.740
610 H GLU 80 H GLU 80 -0.340 -8.559 -1.267
611 HA GLU 80 HA GLU 80 0.695 -10.878 -2.737
612 HB2 GLU 80 2HB GLU 80 -1.876 -10.882 -1.153
613 HB3 GLU 80 1HB GLU 80 -1.565 -12.012 -2.459
614 HG2 GLU 80 2HG GLU 80 0.492 -12.734 -1.184
615 HG3 GLU 80 1HG GLU 80 -0.126 -11.783 0.169
616 H GLU 81 H GLU 81 0.143 -10.884 -4.836
617 HA GLU 81 HA GLU 81 -1.751 -8.896 -5.813
618 HB2 GLU 81 2HB GLU 81 -0.023 -10.902 -7.289
619 HB3 GLU 81 1HB GLU 81 -1.099 -9.753 -8.073
620 HG2 GLU 81 2HG GLU 81 0.184 -7.905 -7.030
621 HG3 GLU 81 1HG GLU 81 1.309 -9.098 -6.385
622 H ARG 82 H ARG 82 -3.844 -9.335 -6.005
623 HA ARG 82 HA ARG 82 -4.703 -12.163 -6.107
624 HB2 ARG 82 2HB ARG 82 -6.211 -9.813 -4.928
625 HB3 ARG 82 1HB ARG 82 -6.691 -11.504 -4.862
626 HG2 ARG 82 2HG ARG 82 -4.228 -10.343 -3.551
627 HG3 ARG 82 1HG ARG 82 -5.756 -10.680 -2.736
628 HD2 ARG 82 2HD ARG 82 -4.035 -12.739 -4.124
629 HD3 ARG 82 1HD ARG 82 -4.066 -12.450 -2.385
630 HE ARG 82 HE ARG 82 -6.634 -13.058 -3.551
631 HH11 ARG 82 1HH1 ARG 82 -3.797 -14.349 -2.066
632 HH12 ARG 82 2HH1 ARG 82 -4.597 -15.799 -1.574
633 HH21 ARG 82 1HH2 ARG 82 -7.638 -14.922 -2.901
634 HH22 ARG 82 2HH2 ARG 82 -6.729 -16.132 -2.066
635 H GLN 83 H GLN 83 -6.517 -12.684 -7.406
636 HA GLN 83 HA GLN 83 -6.591 -11.119 -9.831
637 HB2 GLN 83 2HB GLN 83 -6.481 -13.595 -9.838
638 HB3 GLN 83 1HB GLN 83 -8.079 -13.653 -9.108
639 HG2 GLN 83 2HG GLN 83 -9.057 -12.642 -11.079
640 HG3 GLN 83 1HG GLN 83 -7.460 -12.445 -11.801
641 HE21 GLN 83 1HE2 GLN 83 -9.965 -14.704 -10.971
642 HE22 GLN 83 2HE2 GLN 83 -9.354 -16.025 -11.903
643 H VAL 84 H VAL 84 -8.266 -9.926 -10.630
644 HA VAL 84 HA VAL 84 -10.239 -9.064 -8.668
645 HB VAL 84 HB VAL 84 -9.658 -7.930 -11.418
646 HG11 VAL 84 1HG1 VAL 84 -10.793 -5.916 -10.578
647 HG12 VAL 84 2HG1 VAL 84 -11.172 -6.762 -9.079
648 HG13 VAL 84 3HG1 VAL 84 -11.868 -7.314 -10.602
649 HG21 VAL 84 3HG2 VAL 84 -7.674 -7.812 -10.003
650 HG22 VAL 84 1HG2 VAL 84 -8.615 -7.055 -8.716
651 HG23 VAL 84 2HG2 VAL 84 -8.359 -6.205 -10.240
652 HA PRO 85 HA PRO 85 -13.482 -11.638 -10.406
653 HB2 PRO 85 2HB PRO 85 -15.584 -10.158 -9.349
654 HB3 PRO 85 1HB PRO 85 -14.713 -11.435 -8.496
655 HG2 PRO 85 2HG PRO 85 -14.341 -8.467 -8.362
656 HG3 PRO 85 1HG PRO 85 -14.310 -9.662 -7.049
657 HD2 PRO 85 2HD PRO 85 -12.044 -8.645 -8.040
658 HD3 PRO 85 1HD PRO 85 -12.145 -10.355 -7.567
659 H GLY 86 H GLY 86 -14.442 -11.594 -12.359
660 HA2 GLY 86 2HA GLY 86 -15.553 -10.755 -14.224
661 HA3 GLY 86 1HA GLY 86 -15.572 -9.166 -13.478
662 H SER 87 H SER 87 -12.466 -10.204 -13.242
663 HA SER 87 HA SER 87 -11.663 -9.174 -15.888
664 HB2 SER 87 2HB SER 87 -10.502 -8.324 -13.217
665 HB3 SER 87 1HB SER 87 -9.832 -7.887 -14.789
666 HG SER 87 HG SER 87 -11.750 -6.665 -13.431
667 H THR 88 H THR 88 -9.567 -9.852 -16.605
668 HA THR 88 HA THR 88 -8.759 -12.444 -15.508
669 HB THR 88 HB THR 88 -9.051 -12.257 -17.952
670 HG1 THR 88 HG1 THR 88 -7.615 -13.800 -17.813
671 HG21 THR 88 3HG2 THR 88 -7.385 -11.017 -19.299
672 HG22 THR 88 1HG2 THR 88 -6.727 -10.321 -17.819
673 HG23 THR 88 2HG2 THR 88 -8.379 -9.946 -18.312
674 H GLN 89 H GLN 89 -7.778 -9.178 -15.405
675 HA GLN 89 HA GLN 89 -4.989 -9.685 -14.826
676 HB2 GLN 89 2HB GLN 89 -4.829 -7.270 -14.494
677 HB3 GLN 89 1HB GLN 89 -5.648 -7.646 -16.003
678 HG2 GLN 89 2HG GLN 89 -7.813 -7.194 -14.937
679 HG3 GLN 89 1HG GLN 89 -6.982 -6.807 -13.430
680 HE21 GLN 89 1HE2 GLN 89 -8.709 -5.130 -15.113
681 HE22 GLN 89 2HE2 GLN 89 -7.755 -3.753 -15.529
682 H LYS 90 H LYS 90 -3.945 -8.979 -12.837
683 HA LYS 90 HA LYS 90 -5.667 -9.353 -10.459
684 HB2 LYS 90 2HB LYS 90 -3.703 -10.323 -9.329
685 HB3 LYS 90 1HB LYS 90 -4.152 -11.235 -10.763
686 HG2 LYS 90 2HG LYS 90 -2.337 -10.255 -12.016
687 HG3 LYS 90 1HG LYS 90 -1.928 -9.197 -10.665
688 HD2 LYS 90 2HD LYS 90 -0.402 -11.104 -10.797
689 HD3 LYS 90 1HD LYS 90 -1.340 -11.141 -9.304
690 HE2 LYS 90 2HE LYS 90 -2.832 -12.812 -10.266
691 HE3 LYS 90 1HE LYS 90 -1.951 -12.737 -11.793
692 HZ1 LYS 90 3HZ LYS 90 -0.834 -13.631 -9.191
693 HZ2 LYS 90 1HZ LYS 90 0.024 -13.533 -10.648
694 HZ3 LYS 90 2HZ LYS 90 -1.256 -14.630 -10.490
695 H ALA 91 H ALA 91 -5.441 -7.994 -8.719
696 HA ALA 91 HA ALA 91 -3.693 -5.639 -9.085
697 HB1 ALA 91 3HB ALA 91 -6.084 -5.130 -9.057
698 HB2 ALA 91 1HB ALA 91 -5.267 -4.424 -7.663
699 HB3 ALA 91 2HB ALA 91 -6.236 -5.886 -7.471
700 H LEU 92 H LEU 92 -2.610 -4.758 -7.237
701 HA LEU 92 HA LEU 92 -1.642 -6.824 -5.450
702 HB2 LEU 92 2HB LEU 92 -0.084 -5.260 -6.507
703 HB3 LEU 92 1HB LEU 92 -0.873 -3.913 -5.707
704 HG LEU 92 HG LEU 92 -0.191 -4.939 -3.500
705 HD11 LEU 92 1HD1 LEU 92 1.664 -6.560 -3.545
706 HD12 LEU 92 2HD1 LEU 92 1.476 -6.707 -5.295
707 HD13 LEU 92 3HD1 LEU 92 0.176 -7.223 -4.218
708 HD21 LEU 92 3HD2 LEU 92 1.007 -3.051 -4.463
709 HD22 LEU 92 1HD2 LEU 92 2.008 -4.146 -5.414
710 HD23 LEU 92 2HD2 LEU 92 2.126 -4.146 -3.655
711 H TYR 93 H TYR 93 -2.742 -7.308 -3.648
712 HA TYR 93 HA TYR 93 -4.043 -5.153 -2.118
713 HB2 TYR 93 2HB TYR 93 -4.472 -8.147 -2.121
714 HB3 TYR 93 1HB TYR 93 -5.160 -7.091 -0.890
715 HD1 TYR 93 HD1 TYR 93 -5.118 -7.745 -4.561
716 HD2 TYR 93 HD2 TYR 93 -7.163 -5.903 -1.308
717 HE1 TYR 93 HE1 TYR 93 -7.028 -7.267 -6.036
718 HE2 TYR 93 HE2 TYR 93 -9.075 -5.421 -2.775
719 HH TYR 93 HH TYR 93 -9.492 -6.847 -5.795
720 H LEU 94 H LEU 94 -3.584 -4.792 0.034
721 HA LEU 94 HA LEU 94 -1.037 -5.964 0.993
722 HB2 LEU 94 2HB LEU 94 -1.947 -3.109 1.381
723 HB3 LEU 94 1HB LEU 94 -0.363 -3.780 1.726
724 HG LEU 94 HG LEU 94 -1.541 -3.448 -1.044
725 HD11 LEU 94 1HD1 LEU 94 0.588 -1.837 0.368
726 HD12 LEU 94 2HD1 LEU 94 -1.048 -1.290 -0.010
727 HD13 LEU 94 3HD1 LEU 94 0.088 -1.645 -1.313
728 HD21 LEU 94 3HD2 LEU 94 1.237 -4.263 -0.182
729 HD22 LEU 94 1HD2 LEU 94 0.700 -3.990 -1.838
730 HD23 LEU 94 2HD2 LEU 94 0.025 -5.321 -0.903
731 H ARG 95 H ARG 95 -0.723 -6.039 3.304
732 HA ARG 95 HA ARG 95 -2.703 -4.880 5.054
733 HB2 ARG 95 2HB ARG 95 -3.363 -6.872 6.229
734 HB3 ARG 95 1HB ARG 95 -3.742 -7.061 4.525
735 HG2 ARG 95 2HG ARG 95 -1.831 -8.515 4.221
736 HG3 ARG 95 1HG ARG 95 -1.334 -8.253 5.896
737 HD2 ARG 95 2HD ARG 95 -3.870 -9.603 4.947
738 HD3 ARG 95 1HD ARG 95 -2.486 -10.378 5.723
739 HE ARG 95 HE ARG 95 -3.101 -8.789 7.659
740 HH11 ARG 95 1HH1 ARG 95 -5.373 -10.307 5.556
741 HH12 ARG 95 2HH1 ARG 95 -6.641 -10.278 6.727
742 HH21 ARG 95 1HH2 ARG 95 -4.728 -8.741 9.143
743 HH22 ARG 95 2HH2 ARG 95 -6.276 -9.406 8.748
744 H ALA 96 H ALA 96 -2.127 -5.310 7.430
745 HA ALA 96 HA ALA 96 0.568 -4.425 7.737
746 HB1 ALA 96 3HB ALA 96 -1.302 -3.593 9.111
747 HB2 ALA 96 1HB ALA 96 0.044 -4.188 10.084
748 HB3 ALA 96 2HB ALA 96 -1.409 -5.171 9.894
749 H LYS 97 H LYS 97 2.306 -5.344 8.805
750 HA LYS 97 HA LYS 97 2.451 -8.250 8.749
751 HB2 LYS 97 2HB LYS 97 4.287 -7.034 7.768
752 HB3 LYS 97 1HB LYS 97 4.515 -6.091 9.233
753 HG2 LYS 97 2HG LYS 97 6.258 -7.678 9.180
754 HG3 LYS 97 1HG LYS 97 5.118 -8.247 10.396
755 HD2 LYS 97 2HD LYS 97 5.833 -10.132 9.087
756 HD3 LYS 97 1HD LYS 97 4.151 -9.788 8.685
757 HE2 LYS 97 2HE LYS 97 4.787 -8.729 6.626
758 HE3 LYS 97 1HE LYS 97 6.493 -8.789 7.062
759 HZ1 LYS 97 3HZ LYS 97 5.919 -10.512 5.478
760 HZ2 LYS 97 1HZ LYS 97 4.767 -11.148 6.539
761 HZ3 LYS 97 2HZ LYS 97 6.408 -11.195 6.946
762 H LEU 98 H LEU 98 2.624 -9.584 10.476
763 HA LEU 98 HA LEU 98 2.752 -8.399 13.180
764 HB2 LEU 98 2HB LEU 98 1.629 -11.077 12.326
765 HB3 LEU 98 1HB LEU 98 1.694 -10.487 13.976
766 HG LEU 98 HG LEU 98 0.072 -9.252 11.737
767 HD11 LEU 98 1HD1 LEU 98 -0.819 -10.856 14.139
768 HD12 LEU 98 2HD1 LEU 98 -0.797 -11.427 12.470
769 HD13 LEU 98 3HD1 LEU 98 -1.868 -10.106 12.935
770 HD21 LEU 98 3HD2 LEU 98 -0.911 -7.864 13.506
771 HD22 LEU 98 1HD2 LEU 98 0.823 -7.579 13.353
772 HD23 LEU 98 2HD2 LEU 98 0.204 -8.563 14.680
773 H GLU 99 H GLU 99 4.702 -8.604 14.104
774 HA GLU 99 HA GLU 99 6.590 -10.591 13.075
775 HB2 GLU 99 2HB GLU 99 8.285 -9.306 14.357
776 HB3 GLU 99 1HB GLU 99 7.409 -8.328 13.187
777 HG2 GLU 99 2HG GLU 99 6.019 -7.417 14.976
778 HG3 GLU 99 1HG GLU 99 6.872 -8.413 16.154
779 H HIS 100 H HIS 100 4.763 -9.923 15.964
780 HA HIS 100 HA HIS 100 5.912 -12.345 17.211
781 HB2 HIS 100 2HB HIS 100 5.491 -9.680 18.328
782 HB3 HIS 100 1HB HIS 100 4.680 -10.918 19.280
783 HD1 HIS 100 HD1 HIS 100 7.929 -9.378 18.752
784 HD2 HIS 100 HD2 HIS 100 6.532 -13.016 20.194
785 HE1 HIS 100 HE1 HIS 100 9.843 -10.376 20.027
786 HE2 HIS 100 HE2 HIS 100 8.927 -12.497 21.012
787 H HIS 101 H HIS 101 4.521 -13.974 17.002
788 HA HIS 101 HA HIS 101 1.756 -13.500 16.363
789 HB2 HIS 101 2HB HIS 101 3.111 -16.153 16.917
790 HB3 HIS 101 1HB HIS 101 1.614 -15.889 16.026
791 HD1 HIS 101 HD1 HIS 101 5.325 -15.649 15.701
792 HD2 HIS 101 HD2 HIS 101 1.943 -14.996 13.373
793 HE1 HIS 101 HE1 HIS 101 6.173 -15.324 13.361
794 HE2 HIS 101 HE2 HIS 101 4.133 -14.757 12.010
795 H HIS 102 H HIS 102 -0.014 -13.643 17.649
796 HA HIS 102 HA HIS 102 0.417 -13.431 20.461
797 HB2 HIS 102 2HB HIS 102 -2.076 -13.406 18.767
798 HB3 HIS 102 1HB HIS 102 -2.133 -13.277 20.524
799 HD1 HIS 102 HD1 HIS 102 -2.567 -10.897 21.040
800 HD2 HIS 102 HD2 HIS 102 0.204 -11.324 17.979
801 HE1 HIS 102 HE1 HIS 102 -1.778 -8.576 20.524
802 HE2 HIS 102 HE2 HIS 102 0.046 -8.887 18.820
803 H HIS 103 H HIS 103 0.135 -16.188 18.579
804 HA HIS 103 HA HIS 103 -0.910 -17.860 20.708
805 HB2 HIS 103 2HB HIS 103 0.500 -18.526 18.109
806 HB3 HIS 103 1HB HIS 103 -0.046 -19.748 19.255
807 HD1 HIS 103 HD1 HIS 103 -1.124 -18.129 16.280
808 HD2 HIS 103 HD2 HIS 103 -3.014 -19.337 19.780
809 HE1 HIS 103 HE1 HIS 103 -3.565 -18.274 15.715
810 HE2 HIS 103 HE2 HIS 103 -4.700 -18.820 17.888
811 H HIS 104 H HIS 104 1.582 -16.017 20.854
812 HA HIS 104 HA HIS 104 3.306 -15.880 22.302
813 HB2 HIS 104 2HB HIS 104 2.572 -18.720 23.047
814 HB3 HIS 104 1HB HIS 104 3.763 -17.737 23.896
815 HD1 HIS 104 HD1 HIS 104 0.286 -18.620 24.003
816 HD2 HIS 104 HD2 HIS 104 2.492 -15.215 24.908
817 HE1 HIS 104 HE1 HIS 104 -1.196 -17.229 25.476
818 HE2 HIS 104 HE2 HIS 104 0.075 -15.087 25.819
819 H HIS 105 H HIS 105 3.716 -16.560 19.576
820 HA HIS 105 HA HIS 105 6.505 -16.941 19.712
821 HB2 HIS 105 2HB HIS 105 5.784 -19.329 20.039
822 HB3 HIS 105 1HB HIS 105 5.072 -19.284 18.429
823 HD1 HIS 105 HD1 HIS 105 6.728 -19.169 16.408
824 HD2 HIS 105 HD2 HIS 105 8.556 -19.573 20.117
825 HE1 HIS 105 HE1 HIS 105 9.111 -19.792 15.919
826 HE2 HIS 105 HE2 HIS 105 10.173 -20.120 18.175
Start of MODEL 6
1 H1 MET 1 1H MET 1 26.530 -5.347 39.267
2 H2 MET 1 2H MET 1 26.770 -6.514 38.065
3 H3 MET 1 3H MET 1 26.913 -6.935 39.695
4 HA MET 1 HA MET 1 24.830 -7.739 38.827
5 HB2 MET 1 2HB MET 1 24.960 -6.988 41.185
6 HB3 MET 1 1HB MET 1 24.455 -5.379 40.689
7 HG2 MET 1 2HG MET 1 22.331 -6.358 39.858
8 HG3 MET 1 1HG MET 1 22.839 -7.913 40.514
9 HE1 MET 1 3HE MET 1 24.340 -6.922 43.202
10 HE2 MET 1 1HE MET 1 23.274 -8.326 43.144
11 HE3 MET 1 2HE MET 1 23.028 -7.081 44.369
12 H ASP 2 H ASP 2 25.241 -4.250 38.426
13 HA ASP 2 HA ASP 2 22.717 -3.727 37.253
14 HB2 ASP 2 2HB ASP 2 23.762 -1.563 36.586
15 HB3 ASP 2 1HB ASP 2 23.997 -1.952 38.288
16 H GLN 3 H GLN 3 22.039 -3.616 35.137
17 HA GLN 3 HA GLN 3 23.474 -5.139 33.196
18 HB2 GLN 3 2HB GLN 3 21.588 -4.438 31.648
19 HB3 GLN 3 1HB GLN 3 21.131 -5.332 33.085
20 HG2 GLN 3 2HG GLN 3 19.536 -3.743 33.206
21 HG3 GLN 3 1HG GLN 3 20.808 -2.845 34.028
22 HE21 GLN 3 1HE2 GLN 3 19.909 -0.877 33.441
23 HE22 GLN 3 2HE2 GLN 3 19.965 -0.272 31.825
24 H LYS 4 H LYS 4 25.434 -4.137 32.824
25 HA LYS 4 HA LYS 4 25.539 -1.418 31.827
26 HB2 LYS 4 2HB LYS 4 27.596 -3.525 32.417
27 HB3 LYS 4 1HB LYS 4 28.034 -2.113 31.466
28 HG2 LYS 4 2HG LYS 4 27.371 -0.648 33.294
29 HG3 LYS 4 1HG LYS 4 26.869 -2.044 34.250
30 HD2 LYS 4 2HD LYS 4 29.686 -1.675 33.225
31 HD3 LYS 4 1HD LYS 4 29.151 -1.079 34.797
32 HE2 LYS 4 2HE LYS 4 28.942 -3.962 33.924
33 HE3 LYS 4 1HE LYS 4 30.289 -3.311 34.856
34 HZ1 LYS 4 3HZ LYS 4 28.846 -2.805 36.648
35 HZ2 LYS 4 1HZ LYS 4 28.530 -4.401 36.202
36 HZ3 LYS 4 2HZ LYS 4 27.464 -3.167 35.754
37 H SER 5 H SER 5 23.908 -2.661 30.123
38 HA SER 5 HA SER 5 25.266 -3.712 27.822
39 HB2 SER 5 2HB SER 5 22.434 -2.677 28.152
40 HB3 SER 5 1HB SER 5 23.044 -3.465 26.697
41 HG SER 5 HG SER 5 21.916 -4.726 28.533
42 H SER 6 H SER 6 26.786 -2.284 27.074
43 HA SER 6 HA SER 6 25.783 0.241 25.930
44 HB2 SER 6 2HB SER 6 28.395 -0.013 27.459
45 HB3 SER 6 1HB SER 6 27.762 1.451 26.707
46 HG SER 6 HG SER 6 25.934 1.218 28.170
47 H SER 7 H SER 7 26.323 0.451 23.833
48 HA SER 7 HA SER 7 28.763 -0.907 22.856
49 HB2 SER 7 2HB SER 7 26.792 -2.218 22.161
50 HB3 SER 7 1HB SER 7 26.111 -0.786 21.391
51 HG SER 7 HG SER 7 27.439 -1.011 19.756
52 HA PRO 8 HA PRO 8 29.085 3.413 21.403
53 HB2 PRO 8 2HB PRO 8 31.669 3.788 22.005
54 HB3 PRO 8 1HB PRO 8 30.416 3.833 23.251
55 HG2 PRO 8 2HG PRO 8 32.343 1.649 22.577
56 HG3 PRO 8 1HG PRO 8 31.772 2.190 24.164
57 HD2 PRO 8 2HD PRO 8 30.798 -0.017 22.766
58 HD3 PRO 8 1HD PRO 8 29.955 0.810 24.093
59 H GLN 9 H GLN 9 28.933 3.138 19.173
60 HA GLN 9 HA GLN 9 30.888 1.807 17.592
61 HB2 GLN 9 2HB GLN 9 28.784 3.873 16.924
62 HB3 GLN 9 1HB GLN 9 29.880 3.238 15.708
63 HG2 GLN 9 2HG GLN 9 27.747 2.095 15.623
64 HG3 GLN 9 1HG GLN 9 29.028 0.984 16.100
65 HE21 GLN 9 1HE2 GLN 9 26.221 2.740 17.181
66 HE22 GLN 9 2HE2 GLN 9 25.957 1.814 18.612
67 HA PRO 10 HA PRO 10 34.310 4.596 17.789
68 HB2 PRO 10 2HB PRO 10 35.221 4.337 15.166
69 HB3 PRO 10 1HB PRO 10 35.633 3.262 16.506
70 HG2 PRO 10 2HG PRO 10 33.551 2.930 14.379
71 HG3 PRO 10 1HG PRO 10 34.642 1.719 15.084
72 HD2 PRO 10 2HD PRO 10 32.073 1.838 15.813
73 HD3 PRO 10 1HD PRO 10 33.341 1.493 17.010
74 H ALA 11 H ALA 11 34.771 6.720 17.400
75 HA ALA 11 HA ALA 11 32.830 8.482 16.568
76 HB1 ALA 11 3HB ALA 11 34.740 9.120 17.948
77 HB2 ALA 11 1HB ALA 11 34.560 10.206 16.570
78 HB3 ALA 11 2HB ALA 11 35.810 8.962 16.556
79 H ALA 12 H ALA 12 31.899 8.037 14.597
80 HA ALA 12 HA ALA 12 33.535 8.608 12.204
81 HB1 ALA 12 3HB ALA 12 32.225 6.972 10.953
82 HB2 ALA 12 1HB ALA 12 31.290 6.592 12.402
83 HB3 ALA 12 2HB ALA 12 33.010 6.213 12.337
84 H GLN 13 H GLN 13 31.839 8.944 10.254
85 HA GLN 13 HA GLN 13 30.235 11.242 11.088
86 HB2 GLN 13 2HB GLN 13 30.990 10.291 8.314
87 HB3 GLN 13 1HB GLN 13 30.150 11.793 8.687
88 HG2 GLN 13 2HG GLN 13 32.941 11.069 9.575
89 HG3 GLN 13 1HG GLN 13 32.529 12.151 8.247
90 HE21 GLN 13 1HE2 GLN 13 30.316 13.416 9.619
91 HE22 GLN 13 2HE2 GLN 13 31.011 14.435 10.830
92 H ALA 14 H ALA 14 28.080 11.596 10.281
93 HA ALA 14 HA ALA 14 26.420 9.269 10.499
94 HB1 ALA 14 3HB ALA 14 25.759 11.414 11.461
95 HB2 ALA 14 1HB ALA 14 24.557 10.837 10.307
96 HB3 ALA 14 2HB ALA 14 25.677 12.121 9.848
97 HA PRO 15 HA PRO 15 25.866 8.107 6.244
98 HB2 PRO 15 2HB PRO 15 22.986 7.725 6.876
99 HB3 PRO 15 1HB PRO 15 24.169 6.566 6.262
100 HG2 PRO 15 2HG PRO 15 23.334 6.432 8.786
101 HG3 PRO 15 1HG PRO 15 25.034 6.128 8.379
102 HD2 PRO 15 2HD PRO 15 23.774 8.603 9.524
103 HD3 PRO 15 1HD PRO 15 25.293 7.800 9.981
104 H GLU 16 H GLU 16 24.091 8.379 4.421
105 HA GLU 16 HA GLU 16 23.859 11.175 3.866
106 HB2 GLU 16 2HB GLU 16 22.677 8.811 2.381
107 HB3 GLU 16 1HB GLU 16 22.838 10.446 1.754
108 HG2 GLU 16 2HG GLU 16 25.154 8.686 2.558
109 HG3 GLU 16 1HG GLU 16 24.549 8.854 0.912
110 H THR 17 H THR 17 21.522 11.723 2.715
111 HA THR 17 HA THR 17 19.726 11.972 4.930
112 HB THR 17 HB THR 17 19.259 12.695 2.023
113 HG1 THR 17 HG1 THR 17 19.766 14.835 2.865
114 HG21 THR 17 3HG2 THR 17 17.785 13.565 4.524
115 HG22 THR 17 1HG2 THR 17 17.145 12.509 3.262
116 HG23 THR 17 2HG2 THR 17 17.511 14.196 2.901
117 H LYS 18 H LYS 18 19.257 9.820 5.473
118 HA LYS 18 HA LYS 18 17.606 8.255 3.615
119 HB2 LYS 18 2HB LYS 18 19.439 7.079 4.707
120 HB3 LYS 18 1HB LYS 18 18.850 7.562 6.290
121 HG2 LYS 18 2HG LYS 18 16.886 6.179 6.034
122 HG3 LYS 18 1HG LYS 18 17.343 5.784 4.375
123 HD2 LYS 18 2HD LYS 18 17.903 3.961 5.928
124 HD3 LYS 18 1HD LYS 18 19.347 4.642 5.176
125 HE2 LYS 18 2HE LYS 18 19.754 4.257 7.533
126 HE3 LYS 18 1HE LYS 18 19.744 5.988 7.207
127 HZ1 LYS 18 3HZ LYS 18 18.526 5.445 9.221
128 HZ2 LYS 18 1HZ LYS 18 17.487 4.439 8.351
129 HZ3 LYS 18 2HZ LYS 18 17.488 6.104 8.063
130 H GLN 19 H GLN 19 15.446 8.318 3.753
131 HA GLN 19 HA GLN 19 14.163 9.892 5.804
132 HB2 GLN 19 2HB GLN 19 13.000 8.373 3.463
133 HB3 GLN 19 1HB GLN 19 12.109 9.498 4.480
134 HG2 GLN 19 2HG GLN 19 14.490 10.205 2.768
135 HG3 GLN 19 1HG GLN 19 12.804 10.484 2.340
136 HE21 GLN 19 1HE2 GLN 19 15.448 11.487 4.345
137 HE22 GLN 19 2HE2 GLN 19 14.735 12.957 4.902
138 H ALA 20 H ALA 20 12.367 9.205 7.106
139 HA ALA 20 HA ALA 20 12.584 6.381 7.948
140 HB1 ALA 20 3HB ALA 20 11.817 7.121 10.141
141 HB2 ALA 20 1HB ALA 20 11.642 8.770 9.540
142 HB3 ALA 20 2HB ALA 20 13.240 8.032 9.638
143 H PHE 21 H PHE 21 10.858 5.070 7.901
144 HA PHE 21 HA PHE 21 8.407 5.891 6.653
145 HB2 PHE 21 2HB PHE 21 9.242 3.281 7.942
146 HB3 PHE 21 1HB PHE 21 7.718 3.513 7.097
147 HD1 PHE 21 HD1 PHE 21 7.899 4.334 4.625
148 HD2 PHE 21 HD2 PHE 21 11.084 2.486 6.775
149 HE1 PHE 21 HE1 PHE 21 8.974 3.715 2.502
150 HE2 PHE 21 HE2 PHE 21 12.158 1.865 4.650
151 HZ PHE 21 HZ PHE 21 11.103 2.481 2.511
152 HA PRO 22 HA PRO 22 6.395 6.624 10.678
153 HB2 PRO 22 2HB PRO 22 4.411 8.202 9.803
154 HB3 PRO 22 1HB PRO 22 6.067 8.805 9.946
155 HG2 PRO 22 2HG PRO 22 4.569 7.941 7.506
156 HG3 PRO 22 1HG PRO 22 5.703 9.288 7.706
157 HD2 PRO 22 2HD PRO 22 6.329 6.801 6.609
158 HD3 PRO 22 1HD PRO 22 7.506 7.964 7.248
159 H ARG 23 H ARG 23 5.609 4.548 11.080
160 HA ARG 23 HA ARG 23 3.624 3.359 9.354
161 HB2 ARG 23 2HB ARG 23 3.730 1.452 11.026
162 HB3 ARG 23 1HB ARG 23 5.211 1.831 10.161
163 HG2 ARG 23 2HG ARG 23 6.014 3.079 12.131
164 HG3 ARG 23 1HG ARG 23 4.552 2.603 13.000
165 HD2 ARG 23 2HD ARG 23 5.178 0.327 13.019
166 HD3 ARG 23 1HD ARG 23 6.397 0.565 11.765
167 HE ARG 23 HE ARG 23 6.902 2.055 14.171
168 HH11 ARG 23 1HH1 ARG 23 7.267 -1.034 12.687
169 HH12 ARG 23 2HH1 ARG 23 8.739 -1.382 13.522
170 HH21 ARG 23 1HH2 ARG 23 8.776 1.605 15.239
171 HH22 ARG 23 2HH2 ARG 23 9.573 0.090 14.980
172 H LYS 24 H LYS 24 3.542 5.155 12.332
173 HA LYS 24 HA LYS 24 1.033 4.492 13.331
174 HB2 LYS 24 2HB LYS 24 2.410 7.180 13.173
175 HB3 LYS 24 1HB LYS 24 0.894 6.936 14.031
176 HG2 LYS 24 2HG LYS 24 1.991 5.316 15.506
177 HG3 LYS 24 1HG LYS 24 3.514 5.571 14.650
178 HD2 LYS 24 2HD LYS 24 3.617 7.859 15.367
179 HD3 LYS 24 1HD LYS 24 1.981 7.785 16.023
180 HE2 LYS 24 2HE LYS 24 4.317 6.164 17.040
181 HE3 LYS 24 1HE LYS 24 3.751 7.671 17.760
182 HZ1 LYS 24 3HZ LYS 24 1.646 6.641 18.237
183 HZ2 LYS 24 1HZ LYS 24 2.887 5.696 18.890
184 HZ3 LYS 24 2HZ LYS 24 2.112 5.211 17.468
185 H PHE 25 H PHE 25 1.842 6.444 10.516
186 HA PHE 25 HA PHE 25 -0.978 7.101 10.060
187 HB2 PHE 25 2HB PHE 25 1.529 8.059 8.664
188 HB3 PHE 25 1HB PHE 25 -0.103 8.595 8.279
189 HD1 PHE 25 HD1 PHE 25 -1.373 9.968 9.875
190 HD2 PHE 25 HD2 PHE 25 2.685 8.889 10.604
191 HE1 PHE 25 HE1 PHE 25 -1.219 11.713 11.598
192 HE2 PHE 25 HE2 PHE 25 2.841 10.641 12.325
193 HZ PHE 25 HZ PHE 25 0.888 12.052 12.828
194 H VAL 26 H VAL 26 1.742 5.513 8.372
195 HA VAL 26 HA VAL 26 0.371 4.898 6.009
196 HB VAL 26 HB VAL 26 2.629 3.337 7.286
197 HG11 VAL 26 1HG1 VAL 26 1.594 3.321 4.446
198 HG12 VAL 26 2HG1 VAL 26 1.514 1.990 5.603
199 HG13 VAL 26 3HG1 VAL 26 3.075 2.536 4.989
200 HG21 VAL 26 3HG2 VAL 26 3.197 5.688 6.901
201 HG22 VAL 26 1HG2 VAL 26 2.686 5.544 5.218
202 HG23 VAL 26 2HG2 VAL 26 4.084 4.637 5.798
203 H LEU 27 H LEU 27 0.851 2.804 8.885
204 HA LEU 27 HA LEU 27 -0.749 0.671 7.950
205 HB2 LEU 27 2HB LEU 27 -0.127 1.510 10.788
206 HB3 LEU 27 1HB LEU 27 -0.877 -0.013 10.341
207 HG LEU 27 HG LEU 27 1.917 0.873 9.579
208 HD11 LEU 27 1HD1 LEU 27 1.732 0.304 11.943
209 HD12 LEU 27 2HD1 LEU 27 2.657 -0.918 11.073
210 HD13 LEU 27 3HD1 LEU 27 0.983 -1.240 11.526
211 HD21 LEU 27 3HD2 LEU 27 0.935 -0.508 7.833
212 HD22 LEU 27 1HD2 LEU 27 0.475 -1.724 9.025
213 HD23 LEU 27 2HD2 LEU 27 2.178 -1.406 8.699
214 H ALA 28 H ALA 28 -1.547 3.628 9.682
215 HA ALA 28 HA ALA 28 -4.222 3.053 10.337
216 HB1 ALA 28 3HB ALA 28 -2.971 4.956 11.261
217 HB2 ALA 28 1HB ALA 28 -4.510 5.460 10.561
218 HB3 ALA 28 2HB ALA 28 -3.006 5.740 9.683
219 H ALA 29 H ALA 29 -2.849 4.670 7.465
220 HA ALA 29 HA ALA 29 -5.288 5.015 6.081
221 HB1 ALA 29 3HB ALA 29 -2.497 4.711 4.958
222 HB2 ALA 29 1HB ALA 29 -3.247 6.220 5.478
223 HB3 ALA 29 2HB ALA 29 -3.895 5.347 4.089
224 H LEU 30 H LEU 30 -2.933 2.396 6.126
225 HA LEU 30 HA LEU 30 -3.966 0.790 4.092
226 HB2 LEU 30 2HB LEU 30 -1.777 0.490 5.210
227 HB3 LEU 30 1HB LEU 30 -2.606 -0.074 6.648
228 HG LEU 30 HG LEU 30 -3.454 -2.022 5.406
229 HD11 LEU 30 1HD1 LEU 30 -3.553 -1.047 3.175
230 HD12 LEU 30 2HD1 LEU 30 -2.599 -2.527 3.172
231 HD13 LEU 30 3HD1 LEU 30 -1.791 -0.959 3.119
232 HD21 LEU 30 3HD2 LEU 30 -0.460 -1.644 5.237
233 HD22 LEU 30 1HD2 LEU 30 -1.305 -3.191 5.177
234 HD23 LEU 30 2HD2 LEU 30 -1.364 -2.212 6.641
235 H GLU 31 H GLU 31 -4.628 0.583 7.613
236 HA GLU 31 HA GLU 31 -6.517 -1.511 7.400
237 HB2 GLU 31 2HB GLU 31 -7.101 -1.021 9.706
238 HB3 GLU 31 1HB GLU 31 -5.357 -0.960 9.500
239 HG2 GLU 31 2HG GLU 31 -5.464 1.494 9.418
240 HG3 GLU 31 1HG GLU 31 -7.208 1.418 9.667
241 H GLN 32 H GLN 32 -6.933 2.021 7.462
242 HA GLN 32 HA GLN 32 -9.781 1.979 7.461
243 HB2 GLN 32 2HB GLN 32 -7.809 4.115 6.631
244 HB3 GLN 32 1HB GLN 32 -9.546 4.375 6.698
245 HG2 GLN 32 2HG GLN 32 -9.553 3.936 9.087
246 HG3 GLN 32 1HG GLN 32 -7.831 3.563 9.043
247 HE21 GLN 32 1HE2 GLN 32 -6.359 5.233 8.798
248 HE22 GLN 32 2HE2 GLN 32 -6.781 6.884 9.056
249 H SER 33 H SER 33 -7.558 1.190 5.062
250 HA SER 33 HA SER 33 -9.550 1.575 2.910
251 HB2 SER 33 2HB SER 33 -7.403 2.680 2.462
252 HB3 SER 33 1HB SER 33 -6.546 1.161 2.714
253 HG SER 33 HG SER 33 -7.722 0.328 0.903
254 H SER 34 H SER 34 -8.874 -0.712 5.033
255 HA SER 34 HA SER 34 -8.471 -2.970 3.207
256 HB2 SER 34 2HB SER 34 -8.616 -2.872 6.235
257 HB3 SER 34 1HB SER 34 -8.324 -4.332 5.294
258 HG SER 34 HG SER 34 -6.668 -2.152 4.780
259 H ASP 35 H ASP 35 -9.842 -4.805 3.160
260 HA ASP 35 HA ASP 35 -12.643 -4.341 3.861
261 HB2 ASP 35 2HB ASP 35 -11.242 -6.535 2.318
262 HB3 ASP 35 1HB ASP 35 -12.961 -6.577 2.701
263 H ASP 36 H ASP 36 -13.699 -6.644 4.615
264 HA ASP 36 HA ASP 36 -13.139 -6.954 7.291
265 HB2 ASP 36 2HB ASP 36 -15.209 -7.744 6.313
266 HB3 ASP 36 1HB ASP 36 -14.345 -8.965 5.383
267 H ALA 37 H ALA 37 -11.718 -8.756 4.599
268 HA ALA 37 HA ALA 37 -10.394 -10.681 6.268
269 HB1 ALA 37 3HB ALA 37 -9.350 -11.456 4.210
270 HB2 ALA 37 1HB ALA 37 -9.927 -10.021 3.361
271 HB3 ALA 37 2HB ALA 37 -11.081 -11.205 3.977
272 H GLY 38 H GLY 38 -9.724 -7.453 5.731
273 HA2 GLY 38 2HA GLY 38 -7.917 -6.290 6.671
274 HA3 GLY 38 1HA GLY 38 -6.999 -7.785 6.736
275 H TRP 39 H TRP 39 -8.338 -7.512 3.694
276 HA TRP 39 HA TRP 39 -5.777 -6.729 2.549
277 HB2 TRP 39 2HB TRP 39 -8.298 -7.870 1.331
278 HB3 TRP 39 1HB TRP 39 -6.908 -7.379 0.368
279 HD1 TRP 39 HD1 TRP 39 -8.277 -10.322 2.147
280 HE1 TRP 39 HE1 TRP 39 -6.511 -12.193 2.276
281 HE3 TRP 39 HE3 TRP 39 -4.145 -7.640 0.776
282 HZ2 TRP 39 HZ2 TRP 39 -3.732 -12.483 1.862
283 HZ3 TRP 39 HZ3 TRP 39 -1.976 -8.791 0.668
284 HH2 TRP 39 HH2 TRP 39 -1.779 -11.157 1.201
285 H ALA 40 H ALA 40 -5.337 -4.780 1.757
286 HA ALA 40 HA ALA 40 -7.560 -2.952 1.074
287 HB1 ALA 40 3HB ALA 40 -6.063 -1.105 1.615
288 HB2 ALA 40 1HB ALA 40 -4.769 -2.244 1.988
289 HB3 ALA 40 2HB ALA 40 -6.221 -2.200 2.990
290 H ASN 41 H ASN 41 -7.750 -2.450 -1.040
291 HA ASN 41 HA ASN 41 -5.960 -3.396 -3.012
292 HB2 ASN 41 2HB ASN 41 -8.390 -2.944 -3.380
293 HB3 ASN 41 1HB ASN 41 -8.051 -1.218 -3.307
294 HD21 ASN 41 1HD2 ASN 41 -9.152 -2.850 -5.476
295 HD22 ASN 41 2HD2 ASN 41 -8.113 -2.586 -6.830
296 H LEU 42 H LEU 42 -4.189 -2.541 -3.912
297 HA LEU 42 HA LEU 42 -2.629 -0.570 -2.870
298 HB2 LEU 42 2HB LEU 42 -1.846 -2.173 -4.519
299 HB3 LEU 42 1HB LEU 42 -2.835 -1.428 -5.759
300 HG LEU 42 HG LEU 42 -1.447 0.646 -5.547
301 HD11 LEU 42 1HD1 LEU 42 0.704 0.509 -4.402
302 HD12 LEU 42 2HD1 LEU 42 0.294 -1.100 -3.805
303 HD13 LEU 42 3HD1 LEU 42 -0.635 0.303 -3.273
304 HD21 LEU 42 3HD2 LEU 42 0.452 -0.235 -6.788
305 HD22 LEU 42 1HD2 LEU 42 -1.043 -1.007 -7.311
306 HD23 LEU 42 2HD2 LEU 42 0.072 -1.871 -6.250
307 H GLY 43 H GLY 43 -5.040 -0.100 -5.457
308 HA2 GLY 43 2HA GLY 43 -4.462 2.592 -6.035
309 HA3 GLY 43 1HA GLY 43 -6.013 1.806 -6.297
310 H ASN 44 H ASN 44 -6.818 1.220 -3.751
311 HA ASN 44 HA ASN 44 -7.810 3.725 -2.840
312 HB2 ASN 44 2HB ASN 44 -7.909 1.007 -1.503
313 HB3 ASN 44 1HB ASN 44 -8.879 2.407 -1.046
314 HD21 ASN 44 1HD2 ASN 44 -9.671 -0.264 -2.032
315 HD22 ASN 44 2HD2 ASN 44 -10.644 0.034 -3.435
316 H PHE 45 H PHE 45 -5.428 1.448 -1.503
317 HA PHE 45 HA PHE 45 -4.778 2.807 0.842
318 HB2 PHE 45 2HB PHE 45 -3.983 0.564 0.488
319 HB3 PHE 45 1HB PHE 45 -3.079 1.052 -0.942
320 HD1 PHE 45 HD1 PHE 45 -3.303 2.111 2.647
321 HD2 PHE 45 HD2 PHE 45 -0.796 1.137 -0.658
322 HE1 PHE 45 HE1 PHE 45 -1.312 2.489 4.044
323 HE2 PHE 45 HE2 PHE 45 1.198 1.507 0.738
324 HZ PHE 45 HZ PHE 45 0.939 2.187 3.089
325 H GLY 46 H GLY 46 -3.192 3.053 -2.357
326 HA2 GLY 46 2HA GLY 46 -1.285 4.985 -1.683
327 HA3 GLY 46 1HA GLY 46 -1.934 4.738 -3.294
328 H ASN 47 H ASN 47 -4.630 5.431 -2.774
329 HA ASN 47 HA ASN 47 -4.515 8.258 -3.016
330 HB2 ASN 47 2HB ASN 47 -6.254 6.747 -4.023
331 HB3 ASN 47 1HB ASN 47 -6.944 6.548 -2.418
332 HD21 ASN 47 1HD2 ASN 47 -8.205 7.616 -4.748
333 HD22 ASN 47 2HD2 ASN 47 -8.673 9.235 -4.373
334 H TYR 48 H TYR 48 -5.683 6.142 -0.393
335 HA TYR 48 HA TYR 48 -6.517 8.292 1.288
336 HB2 TYR 48 2HB TYR 48 -7.310 5.815 1.242
337 HB3 TYR 48 1HB TYR 48 -5.929 5.510 2.287
338 HD1 TYR 48 HD2 TYR 48 -9.101 7.391 1.992
339 HD2 TYR 48 HD1 TYR 48 -6.027 6.059 4.622
340 HE1 TYR 48 HE2 TYR 48 -10.456 8.078 3.919
341 HE2 TYR 48 HE1 TYR 48 -7.380 6.748 6.555
342 HH TYR 48 HH TYR 48 -9.221 8.337 7.050
343 H LEU 49 H LEU 49 -3.540 6.453 0.995
344 HA LEU 49 HA LEU 49 -2.346 7.105 3.456
345 HB2 LEU 49 2HB LEU 49 -1.474 5.337 2.057
346 HB3 LEU 49 1HB LEU 49 -1.101 6.478 0.778
347 HG LEU 49 HG LEU 49 0.630 7.514 2.180
348 HD11 LEU 49 1HD1 LEU 49 -0.135 5.413 4.207
349 HD12 LEU 49 2HD1 LEU 49 -0.326 7.159 4.371
350 HD13 LEU 49 3HD1 LEU 49 1.288 6.454 4.305
351 HD21 LEU 49 3HD2 LEU 49 1.256 5.674 0.704
352 HD22 LEU 49 1HD2 LEU 49 0.900 4.513 1.983
353 HD23 LEU 49 2HD2 LEU 49 2.227 5.659 2.176
354 H ASN 50 H ASN 50 -2.134 8.749 0.298
355 HA ASN 50 HA ASN 50 -0.261 10.706 1.075
356 HB2 ASN 50 2HB ASN 50 -0.773 10.151 -1.274
357 HB3 ASN 50 1HB ASN 50 -2.369 10.874 -1.094
358 HD21 ASN 50 1HD2 ASN 50 1.071 11.538 -1.113
359 HD22 ASN 50 2HD2 ASN 50 0.932 13.214 -1.499
360 H LYS 51 H LYS 51 -3.640 10.448 1.760
361 HA LYS 51 HA LYS 51 -4.146 13.200 2.330
362 HB2 LYS 51 2HB LYS 51 -5.497 10.744 3.480
363 HB3 LYS 51 1HB LYS 51 -6.105 12.393 3.574
364 HG2 LYS 51 2HG LYS 51 -6.260 12.427 1.094
365 HG3 LYS 51 1HG LYS 51 -5.769 10.730 1.079
366 HD2 LYS 51 2HD LYS 51 -8.186 10.889 0.911
367 HD3 LYS 51 1HD LYS 51 -7.742 10.176 2.466
368 HE2 LYS 51 2HE LYS 51 -8.108 12.295 3.581
369 HE3 LYS 51 1HE LYS 51 -8.432 13.086 2.038
370 HZ1 LYS 51 3HZ LYS 51 -10.478 12.588 3.166
371 HZ2 LYS 51 1HZ LYS 51 -10.071 10.954 3.300
372 HZ3 LYS 51 2HZ LYS 51 -10.367 11.631 1.779
373 H LEU 52 H LEU 52 -3.058 10.451 4.291
374 HA LEU 52 HA LEU 52 -2.959 12.001 6.731
375 HB2 LEU 52 2HB LEU 52 -1.839 9.252 6.143
376 HB3 LEU 52 1HB LEU 52 -2.008 9.974 7.734
377 HG LEU 52 HG LEU 52 -4.250 9.143 5.882
378 HD11 LEU 52 1HD1 LEU 52 -4.798 7.554 7.660
379 HD12 LEU 52 2HD1 LEU 52 -3.388 8.090 8.576
380 HD13 LEU 52 3HD1 LEU 52 -3.175 7.282 7.022
381 HD21 LEU 52 3HD2 LEU 52 -4.873 11.193 7.038
382 HD22 LEU 52 1HD2 LEU 52 -4.409 10.485 8.586
383 HD23 LEU 52 2HD2 LEU 52 -5.773 9.823 7.682
384 H GLN 53 H GLN 53 -0.570 10.681 4.450
385 HA GLN 53 HA GLN 53 1.411 12.578 5.549
386 HB2 GLN 53 2HB GLN 53 1.885 9.742 4.611
387 HB3 GLN 53 1HB GLN 53 3.177 10.899 4.892
388 HG2 GLN 53 2HG GLN 53 1.205 10.004 6.991
389 HG3 GLN 53 1HG GLN 53 2.810 9.313 6.762
390 HE21 GLN 53 1HE2 GLN 53 1.022 12.093 7.851
391 HE22 GLN 53 2HE2 GLN 53 2.343 12.879 8.635
392 HA PRO 54 HA PRO 54 0.818 13.554 1.057
393 HB2 PRO 54 2HB PRO 54 1.177 16.241 1.343
394 HB3 PRO 54 1HB PRO 54 -0.380 15.440 1.594
395 HG2 PRO 54 2HG PRO 54 1.657 16.297 3.623
396 HG3 PRO 54 1HG PRO 54 -0.106 16.496 3.658
397 HD2 PRO 54 2HD PRO 54 1.144 14.534 5.033
398 HD3 PRO 54 1HD PRO 54 -0.467 14.300 4.318
399 H ASP 55 H ASP 55 3.343 14.312 3.350
400 HA ASP 55 HA ASP 55 5.249 15.173 1.347
401 HB2 ASP 55 2HB ASP 55 5.187 16.036 3.710
402 HB3 ASP 55 1HB ASP 55 5.737 14.455 4.251
403 H PHE 56 H PHE 56 4.128 12.192 2.482
404 HA PHE 56 HA PHE 56 6.633 10.742 2.230
405 HB2 PHE 56 2HB PHE 56 5.062 10.125 4.001
406 HB3 PHE 56 1HB PHE 56 3.814 9.790 2.809
407 HD1 PHE 56 HD1 PHE 56 7.081 8.652 4.126
408 HD2 PHE 56 HD2 PHE 56 3.705 7.686 1.710
409 HE1 PHE 56 HE1 PHE 56 7.826 6.309 4.021
410 HE2 PHE 56 HE2 PHE 56 4.445 5.343 1.606
411 HZ PHE 56 HZ PHE 56 6.508 4.652 2.765
412 H ASP 57 H ASP 57 7.266 10.732 0.096
413 HA ASP 57 HA ASP 57 5.537 9.171 -1.711
414 HB2 ASP 57 2HB ASP 57 5.650 11.589 -2.364
415 HB3 ASP 57 1HB ASP 57 7.384 11.393 -2.614
416 H SER 58 H SER 58 6.540 7.628 -2.992
417 HA SER 58 HA SER 58 8.621 6.204 -1.849
418 HB2 SER 58 2HB SER 58 8.640 4.849 -3.902
419 HB3 SER 58 1HB SER 58 6.992 5.214 -3.393
420 HG SER 58 HG SER 58 6.741 6.557 -5.069
421 H ARG 59 H ARG 59 8.868 8.744 -4.285
422 HA ARG 59 HA ARG 59 11.397 8.179 -5.333
423 HB2 ARG 59 2HB ARG 59 10.218 10.922 -4.837
424 HB3 ARG 59 1HB ARG 59 11.523 10.543 -5.955
425 HG2 ARG 59 2HG ARG 59 8.683 9.546 -6.160
426 HG3 ARG 59 1HG ARG 59 9.393 10.850 -7.111
427 HD2 ARG 59 2HD ARG 59 10.952 9.292 -8.132
428 HD3 ARG 59 1HD ARG 59 10.348 7.985 -7.118
429 HE ARG 59 HE ARG 59 8.187 8.275 -8.291
430 HH11 ARG 59 1HH1 ARG 59 11.090 9.365 -9.793
431 HH12 ARG 59 2HH1 ARG 59 10.430 9.275 -11.383
432 HH21 ARG 59 1HH2 ARG 59 7.360 8.139 -10.344
433 HH22 ARG 59 2HH2 ARG 59 8.337 8.584 -11.696
434 H LEU 60 H LEU 60 10.544 9.698 -2.284
435 HA LEU 60 HA LEU 60 13.065 10.818 -1.657
436 HB2 LEU 60 2HB LEU 60 10.899 9.831 0.204
437 HB3 LEU 60 1HB LEU 60 12.251 10.844 0.676
438 HG LEU 60 HG LEU 60 10.040 11.621 -1.234
439 HD11 LEU 60 1HD1 LEU 60 10.634 12.562 1.572
440 HD12 LEU 60 2HD1 LEU 60 9.299 11.516 1.088
441 HD13 LEU 60 3HD1 LEU 60 9.364 13.182 0.515
442 HD21 LEU 60 3HD2 LEU 60 12.141 12.669 -1.872
443 HD22 LEU 60 1HD2 LEU 60 12.390 13.227 -0.218
444 HD23 LEU 60 2HD2 LEU 60 11.048 13.861 -1.172
445 H TYR 61 H TYR 61 11.981 7.560 -1.653
446 HA TYR 61 HA TYR 61 14.266 6.683 -0.002
447 HB2 TYR 61 2HB TYR 61 11.766 5.189 -0.843
448 HB3 TYR 61 1HB TYR 61 13.068 4.505 0.127
449 HD1 TYR 61 HD1 TYR 61 10.303 6.953 0.103
450 HD2 TYR 61 HD2 TYR 61 13.277 5.021 2.464
451 HE1 TYR 61 HE1 TYR 61 9.225 7.795 2.144
452 HE2 TYR 61 HE2 TYR 61 12.202 5.860 4.508
453 HH TYR 61 HH TYR 61 9.105 7.250 4.530
454 H GLY 62 H GLY 62 13.807 7.338 -3.107
455 HA2 GLY 62 2HA GLY 62 15.124 6.773 -4.933
456 HA3 GLY 62 1HA GLY 62 15.819 5.459 -3.999
457 H TYR 63 H TYR 63 12.357 5.702 -4.285
458 HA TYR 63 HA TYR 63 12.371 3.425 -6.168
459 HB2 TYR 63 2HB TYR 63 10.364 4.166 -4.025
460 HB3 TYR 63 1HB TYR 63 10.077 2.922 -5.238
461 HD1 TYR 63 HD1 TYR 63 12.195 3.851 -2.350
462 HD2 TYR 63 HD2 TYR 63 11.047 0.752 -5.036
463 HE1 TYR 63 HE1 TYR 63 13.341 2.205 -0.932
464 HE2 TYR 63 HE2 TYR 63 12.190 -0.903 -3.624
465 HH TYR 63 HH TYR 63 14.164 -0.811 -1.893
466 H LYS 64 H LYS 64 11.011 3.429 -7.944
467 HA LYS 64 HA LYS 64 10.379 6.051 -8.969
468 HB2 LYS 64 2HB LYS 64 9.961 3.308 -10.184
469 HB3 LYS 64 1HB LYS 64 9.752 4.835 -11.034
470 HG2 LYS 64 2HG LYS 64 12.333 3.792 -9.867
471 HG3 LYS 64 1HG LYS 64 11.891 3.814 -11.576
472 HD2 LYS 64 2HD LYS 64 11.757 6.284 -11.480
473 HD3 LYS 64 1HD LYS 64 12.276 6.231 -9.794
474 HE2 LYS 64 2HE LYS 64 14.151 6.758 -11.262
475 HE3 LYS 64 1HE LYS 64 14.395 5.196 -10.483
476 HZ1 LYS 64 3HZ LYS 64 13.390 5.596 -13.250
477 HZ2 LYS 64 1HZ LYS 64 13.674 4.104 -12.505
478 HZ3 LYS 64 2HZ LYS 64 14.964 5.142 -12.838
479 H LYS 65 H LYS 65 8.593 3.662 -7.287
480 HA LYS 65 HA LYS 65 6.171 5.197 -7.500
481 HB2 LYS 65 2HB LYS 65 4.792 3.287 -8.372
482 HB3 LYS 65 1HB LYS 65 5.898 3.985 -9.549
483 HG2 LYS 65 2HG LYS 65 7.473 2.131 -9.141
484 HG3 LYS 65 1HG LYS 65 6.315 1.423 -8.012
485 HD2 LYS 65 2HD LYS 65 4.678 1.180 -9.808
486 HD3 LYS 65 1HD LYS 65 5.791 1.947 -10.946
487 HE2 LYS 65 2HE LYS 65 7.377 0.113 -10.649
488 HE3 LYS 65 1HE LYS 65 6.303 -0.642 -9.472
489 HZ1 LYS 65 3HZ LYS 65 4.662 -0.958 -11.192
490 HZ2 LYS 65 1HZ LYS 65 6.131 -1.636 -11.684
491 HZ3 LYS 65 2HZ LYS 65 5.627 -0.155 -12.319
492 H LEU 66 H LEU 66 4.638 4.699 -5.914
493 HA LEU 66 HA LEU 66 5.570 3.776 -3.472
494 HB2 LEU 66 2HB LEU 66 3.629 5.244 -3.722
495 HB3 LEU 66 1HB LEU 66 2.713 3.935 -4.445
496 HG LEU 66 HG LEU 66 2.853 2.685 -2.300
497 HD11 LEU 66 1HD1 LEU 66 4.115 5.218 -1.253
498 HD12 LEU 66 2HD1 LEU 66 4.900 3.646 -1.417
499 HD13 LEU 66 3HD1 LEU 66 3.575 3.853 -0.272
500 HD21 LEU 66 3HD2 LEU 66 1.239 4.055 -1.077
501 HD22 LEU 66 1HD2 LEU 66 0.889 4.046 -2.806
502 HD23 LEU 66 2HD2 LEU 66 1.661 5.451 -2.069
503 H SER 67 H SER 67 3.703 2.002 -5.918
504 HA SER 67 HA SER 67 3.107 -0.311 -4.506
505 HB2 SER 67 2HB SER 67 2.953 -1.449 -6.670
506 HB3 SER 67 1HB SER 67 2.258 0.168 -6.779
507 HG SER 67 HG SER 67 3.900 -0.710 -8.443
508 H ASP 68 H ASP 68 6.020 0.338 -6.459
509 HA ASP 68 HA ASP 68 7.237 -2.168 -5.971
510 HB2 ASP 68 2HB ASP 68 7.773 -0.596 -7.863
511 HB3 ASP 68 1HB ASP 68 8.642 0.406 -6.705
512 H LEU 69 H LEU 69 7.345 0.906 -4.256
513 HA LEU 69 HA LEU 69 9.405 0.339 -2.427
514 HB2 LEU 69 2HB LEU 69 8.541 2.572 -2.599
515 HB3 LEU 69 1HB LEU 69 6.926 2.043 -2.174
516 HG LEU 69 HG LEU 69 7.761 1.470 0.112
517 HD11 LEU 69 1HD1 LEU 69 10.275 2.848 -0.821
518 HD12 LEU 69 2HD1 LEU 69 10.109 1.146 -0.386
519 HD13 LEU 69 3HD1 LEU 69 9.909 2.394 0.842
520 HD21 LEU 69 3HD2 LEU 69 8.160 4.344 -0.723
521 HD22 LEU 69 1HD2 LEU 69 7.858 3.767 0.916
522 HD23 LEU 69 2HD2 LEU 69 6.618 3.586 -0.324
523 H VAL 70 H VAL 70 5.882 -0.154 -2.103
524 HA VAL 70 HA VAL 70 5.946 -1.221 0.502
525 HB VAL 70 HB VAL 70 3.857 -1.759 -1.626
526 HG11 VAL 70 1HG1 VAL 70 3.652 -1.831 1.390
527 HG12 VAL 70 2HG1 VAL 70 3.692 -3.237 0.330
528 HG13 VAL 70 3HG1 VAL 70 2.335 -2.117 0.251
529 HG21 VAL 70 3HG2 VAL 70 4.235 0.645 -1.351
530 HG22 VAL 70 1HG2 VAL 70 4.008 0.491 0.391
531 HG23 VAL 70 2HG2 VAL 70 2.662 0.177 -0.706
532 H LYS 71 H LYS 71 5.893 -2.894 -2.667
533 HA LYS 71 HA LYS 71 5.921 -5.520 -1.568
534 HB2 LYS 71 2HB LYS 71 6.645 -6.234 -3.862
535 HB3 LYS 71 1HB LYS 71 5.171 -5.277 -3.821
536 HG2 LYS 71 2HG LYS 71 6.436 -3.296 -4.489
537 HG3 LYS 71 1HG LYS 71 7.915 -4.252 -4.526
538 HD2 LYS 71 2HD LYS 71 5.519 -4.988 -6.196
539 HD3 LYS 71 1HD LYS 71 6.703 -3.806 -6.753
540 HE2 LYS 71 2HE LYS 71 7.298 -6.665 -5.970
541 HE3 LYS 71 1HE LYS 71 7.186 -6.051 -7.620
542 HZ1 LYS 71 3HZ LYS 71 9.032 -4.495 -7.024
543 HZ2 LYS 71 1HZ LYS 71 9.469 -6.131 -7.035
544 HZ3 LYS 71 2HZ LYS 71 9.208 -5.339 -5.569
545 H ALA 72 H ALA 72 8.434 -3.195 -2.044
546 HA ALA 72 HA ALA 72 10.607 -5.094 -1.861
547 HB1 ALA 72 3HB ALA 72 10.901 -2.981 -3.059
548 HB2 ALA 72 1HB ALA 72 12.047 -3.118 -1.725
549 HB3 ALA 72 2HB ALA 72 10.625 -2.087 -1.564
550 H ARG 73 H ARG 73 8.791 -3.055 0.362
551 HA ARG 73 HA ARG 73 10.579 -3.673 2.590
552 HB2 ARG 73 2HB ARG 73 8.043 -2.019 2.566
553 HB3 ARG 73 1HB ARG 73 9.194 -2.131 3.889
554 HG2 ARG 73 2HG ARG 73 9.728 -0.950 1.164
555 HG3 ARG 73 1HG ARG 73 9.476 -0.052 2.661
556 HD2 ARG 73 2HD ARG 73 11.497 -1.115 3.605
557 HD3 ARG 73 1HD ARG 73 11.755 -1.945 2.070
558 HE ARG 73 HE ARG 73 11.589 0.942 1.931
559 HH11 ARG 73 1HH1 ARG 73 13.636 -1.822 2.125
560 HH12 ARG 73 2HH1 ARG 73 15.024 -0.956 1.564
561 HH21 ARG 73 1HH2 ARG 73 13.398 2.030 1.223
562 HH22 ARG 73 2HH2 ARG 73 14.891 1.178 1.062
563 H THR 74 H THR 74 9.952 -6.039 2.253
564 HA THR 74 HA THR 74 7.335 -6.918 3.016
565 HB THR 74 HB THR 74 8.232 -9.179 3.003
566 HG1 THR 74 HG1 THR 74 10.577 -9.358 2.483
567 HG21 THR 74 3HG2 THR 74 9.103 -9.273 0.713
568 HG22 THR 74 1HG2 THR 74 9.403 -7.535 0.748
569 HG23 THR 74 2HG2 THR 74 7.752 -8.147 0.826
570 H ASP 75 H ASP 75 9.953 -5.795 4.829
571 HA ASP 75 HA ASP 75 9.595 -7.301 7.217
572 HB2 ASP 75 2HB ASP 75 11.654 -6.058 6.786
573 HB3 ASP 75 1HB ASP 75 10.763 -4.539 6.775
574 H LEU 76 H LEU 76 8.362 -4.149 6.141
575 HA LEU 76 HA LEU 76 6.821 -3.799 8.585
576 HB2 LEU 76 2HB LEU 76 7.171 -2.062 6.140
577 HB3 LEU 76 1HB LEU 76 6.188 -1.616 7.521
578 HG LEU 76 HG LEU 76 9.167 -2.137 7.651
579 HD11 LEU 76 1HD1 LEU 76 8.711 -0.164 6.296
580 HD12 LEU 76 2HD1 LEU 76 9.399 0.296 7.852
581 HD13 LEU 76 3HD1 LEU 76 7.668 0.485 7.563
582 HD21 LEU 76 3HD2 LEU 76 7.992 -2.538 9.762
583 HD22 LEU 76 1HD2 LEU 76 7.266 -0.931 9.669
584 HD23 LEU 76 2HD2 LEU 76 9.013 -1.104 9.859
585 H PHE 77 H PHE 77 6.195 -4.435 5.142
586 HA PHE 77 HA PHE 77 3.295 -4.541 5.748
587 HB2 PHE 77 2HB PHE 77 4.516 -3.748 3.092
588 HB3 PHE 77 1HB PHE 77 2.822 -3.648 3.558
589 HD1 PHE 77 HD1 PHE 77 2.709 -2.315 6.044
590 HD2 PHE 77 HD2 PHE 77 5.446 -1.649 2.839
591 HE1 PHE 77 HE1 PHE 77 3.073 -0.014 6.828
592 HE2 PHE 77 HE2 PHE 77 5.810 0.647 3.629
593 HZ PHE 77 HZ PHE 77 4.627 1.467 5.623
594 H VAL 78 H VAL 78 2.035 -6.115 4.678
595 HA VAL 78 HA VAL 78 3.533 -8.321 3.413
596 HB VAL 78 HB VAL 78 0.704 -8.330 4.500
597 HG11 VAL 78 1HG1 VAL 78 0.842 -10.781 4.230
598 HG12 VAL 78 2HG1 VAL 78 2.411 -10.591 3.448
599 HG13 VAL 78 3HG1 VAL 78 0.962 -9.928 2.692
600 HG21 VAL 78 3HG2 VAL 78 2.297 -8.120 6.317
601 HG22 VAL 78 1HG2 VAL 78 3.242 -9.468 5.681
602 HG23 VAL 78 2HG2 VAL 78 1.617 -9.746 6.308
603 H THR 79 H THR 79 3.480 -8.394 1.241
604 HA THR 79 HA THR 79 1.195 -7.125 -0.161
605 HB THR 79 HB THR 79 2.662 -6.523 -1.976
606 HG1 THR 79 HG1 THR 79 5.018 -7.370 -0.763
607 HG21 THR 79 3HG2 THR 79 4.174 -4.972 -0.904
608 HG22 THR 79 1HG2 THR 79 4.118 -5.898 0.597
609 HG23 THR 79 2HG2 THR 79 2.682 -5.051 0.030
610 H GLU 80 H GLU 80 -0.002 -8.409 -1.462
611 HA GLU 80 HA GLU 80 1.216 -10.745 -2.721
612 HB2 GLU 80 2HB GLU 80 -1.202 -10.977 -0.903
613 HB3 GLU 80 1HB GLU 80 -0.618 -12.253 -1.963
614 HG2 GLU 80 2HG GLU 80 1.553 -12.196 -0.734
615 HG3 GLU 80 1HG GLU 80 0.834 -11.048 0.390
616 H GLU 81 H GLU 81 0.218 -11.416 -4.592
617 HA GLU 81 HA GLU 81 -1.414 -9.373 -5.864
618 HB2 GLU 81 2HB GLU 81 -0.092 -11.860 -6.980
619 HB3 GLU 81 1HB GLU 81 -0.874 -10.608 -7.937
620 HG2 GLU 81 2HG GLU 81 0.784 -9.005 -7.359
621 HG3 GLU 81 1HG GLU 81 1.472 -10.061 -6.126
622 H ARG 82 H ARG 82 -3.572 -9.521 -5.956
623 HA ARG 82 HA ARG 82 -4.833 -12.196 -5.856
624 HB2 ARG 82 2HB ARG 82 -6.003 -9.582 -4.866
625 HB3 ARG 82 1HB ARG 82 -6.731 -11.175 -4.715
626 HG2 ARG 82 2HG ARG 82 -4.131 -10.360 -3.415
627 HG3 ARG 82 1HG ARG 82 -5.706 -10.318 -2.622
628 HD2 ARG 82 2HD ARG 82 -4.370 -12.780 -3.756
629 HD3 ARG 82 1HD ARG 82 -4.436 -12.340 -2.050
630 HE ARG 82 HE ARG 82 -6.875 -12.870 -3.625
631 HH11 ARG 82 1HH1 ARG 82 -4.954 -13.349 -0.800
632 HH12 ARG 82 2HH1 ARG 82 -6.155 -14.312 -0.014
633 HH21 ARG 82 1HH2 ARG 82 -8.402 -14.112 -2.615
634 HH22 ARG 82 2HH2 ARG 82 -8.070 -14.767 -1.047
635 H GLN 83 H GLN 83 -6.253 -12.712 -7.454
636 HA GLN 83 HA GLN 83 -6.396 -10.944 -9.735
637 HB2 GLN 83 2HB GLN 83 -6.036 -13.401 -9.939
638 HB3 GLN 83 1HB GLN 83 -7.680 -13.658 -9.366
639 HG2 GLN 83 2HG GLN 83 -8.580 -12.514 -11.298
640 HG3 GLN 83 1HG GLN 83 -6.956 -12.101 -11.848
641 HE21 GLN 83 1HE2 GLN 83 -9.311 -14.627 -11.534
642 HE22 GLN 83 2HE2 GLN 83 -8.516 -15.770 -12.553
643 H VAL 84 H VAL 84 -8.185 -9.922 -10.588
644 HA VAL 84 HA VAL 84 -10.338 -9.407 -8.689
645 HB VAL 84 HB VAL 84 -9.832 -8.124 -11.385
646 HG11 VAL 84 1HG1 VAL 84 -12.125 -7.842 -10.642
647 HG12 VAL 84 2HG1 VAL 84 -11.261 -6.309 -10.517
648 HG13 VAL 84 3HG1 VAL 84 -11.576 -7.268 -9.068
649 HG21 VAL 84 3HG2 VAL 84 -7.923 -7.766 -9.922
650 HG22 VAL 84 1HG2 VAL 84 -8.988 -7.222 -8.625
651 HG23 VAL 84 2HG2 VAL 84 -8.835 -6.265 -10.100
652 HA PRO 85 HA PRO 85 -13.022 -12.452 -10.700
653 HB2 PRO 85 2HB PRO 85 -15.066 -10.969 -9.110
654 HB3 PRO 85 1HB PRO 85 -14.739 -12.705 -9.184
655 HG2 PRO 85 2HG PRO 85 -13.985 -11.286 -7.065
656 HG3 PRO 85 1HG PRO 85 -12.936 -12.559 -7.718
657 HD2 PRO 85 2HD PRO 85 -12.723 -9.583 -8.026
658 HD3 PRO 85 1HD PRO 85 -11.441 -10.786 -7.767
659 H GLY 86 H GLY 86 -14.055 -12.326 -12.631
660 HA2 GLY 86 2HA GLY 86 -15.454 -11.441 -14.293
661 HA3 GLY 86 1HA GLY 86 -15.588 -9.954 -13.370
662 H SER 87 H SER 87 -12.580 -9.922 -13.115
663 HA SER 87 HA SER 87 -12.005 -8.735 -15.751
664 HB2 SER 87 2HB SER 87 -10.587 -8.329 -13.094
665 HB3 SER 87 1HB SER 87 -10.211 -7.492 -14.600
666 HG SER 87 HG SER 87 -11.628 -6.090 -13.943
667 H THR 88 H THR 88 -9.846 -9.076 -16.678
668 HA THR 88 HA THR 88 -8.874 -11.793 -16.190
669 HB THR 88 HB THR 88 -9.216 -11.095 -18.526
670 HG1 THR 88 HG1 THR 88 -6.782 -11.983 -17.519
671 HG21 THR 88 3HG2 THR 88 -7.693 -9.476 -19.571
672 HG22 THR 88 1HG2 THR 88 -6.972 -9.132 -18.001
673 HG23 THR 88 2HG2 THR 88 -8.660 -8.718 -18.306
674 H GLN 89 H GLN 89 -7.937 -8.530 -15.536
675 HA GLN 89 HA GLN 89 -5.138 -9.155 -15.077
676 HB2 GLN 89 2HB GLN 89 -4.879 -6.807 -14.526
677 HB3 GLN 89 1HB GLN 89 -5.805 -6.965 -16.013
678 HG2 GLN 89 2HG GLN 89 -7.872 -6.537 -14.805
679 HG3 GLN 89 1HG GLN 89 -6.987 -6.454 -13.283
680 HE21 GLN 89 1HE2 GLN 89 -5.780 -5.108 -16.277
681 HE22 GLN 89 2HE2 GLN 89 -5.922 -3.455 -15.804
682 H LYS 90 H LYS 90 -4.072 -8.729 -13.037
683 HA LYS 90 HA LYS 90 -5.763 -9.368 -10.705
684 HB2 LYS 90 2HB LYS 90 -3.686 -10.124 -9.626
685 HB3 LYS 90 1HB LYS 90 -3.970 -10.971 -11.141
686 HG2 LYS 90 2HG LYS 90 -2.323 -9.601 -12.266
687 HG3 LYS 90 1HG LYS 90 -2.097 -8.631 -10.811
688 HD2 LYS 90 2HD LYS 90 -0.296 -10.277 -11.094
689 HD3 LYS 90 1HD LYS 90 -1.224 -10.565 -9.622
690 HE2 LYS 90 2HE LYS 90 -2.464 -12.346 -10.735
691 HE3 LYS 90 1HE LYS 90 -1.585 -12.040 -12.235
692 HZ1 LYS 90 3HZ LYS 90 -0.370 -12.929 -9.679
693 HZ2 LYS 90 1HZ LYS 90 0.458 -12.658 -11.129
694 HZ3 LYS 90 2HZ LYS 90 -0.670 -13.914 -11.021
695 H ALA 91 H ALA 91 -5.599 -8.170 -8.805
696 HA ALA 91 HA ALA 91 -4.247 -5.553 -9.028
697 HB1 ALA 91 3HB ALA 91 -6.664 -5.378 -8.788
698 HB2 ALA 91 1HB ALA 91 -5.858 -4.757 -7.348
699 HB3 ALA 91 2HB ALA 91 -6.608 -6.353 -7.319
700 H LEU 92 H LEU 92 -3.063 -4.757 -7.227
701 HA LEU 92 HA LEU 92 -1.943 -6.884 -5.562
702 HB2 LEU 92 2HB LEU 92 -0.375 -5.440 -6.739
703 HB3 LEU 92 1HB LEU 92 -1.075 -4.018 -5.982
704 HG LEU 92 HG LEU 92 -0.327 -4.963 -3.752
705 HD11 LEU 92 1HD1 LEU 92 1.262 -6.846 -5.497
706 HD12 LEU 92 2HD1 LEU 92 -0.080 -7.296 -4.443
707 HD13 LEU 92 3HD1 LEU 92 1.412 -6.663 -3.748
708 HD21 LEU 92 3HD2 LEU 92 1.844 -4.371 -5.773
709 HD22 LEU 92 1HD2 LEU 92 1.988 -4.242 -4.019
710 HD23 LEU 92 2HD2 LEU 92 0.898 -3.168 -4.894
711 H TYR 93 H TYR 93 -2.943 -7.279 -3.699
712 HA TYR 93 HA TYR 93 -4.180 -5.067 -2.209
713 HB2 TYR 93 2HB TYR 93 -4.520 -8.066 -2.020
714 HB3 TYR 93 1HB TYR 93 -5.207 -6.949 -0.846
715 HD1 TYR 93 HD1 TYR 93 -5.196 -7.725 -4.498
716 HD2 TYR 93 HD2 TYR 93 -7.314 -5.982 -1.242
717 HE1 TYR 93 HE1 TYR 93 -7.166 -7.434 -5.939
718 HE2 TYR 93 HE2 TYR 93 -9.289 -5.686 -2.679
719 HH TYR 93 HH TYR 93 -9.615 -7.201 -5.694
720 H LEU 94 H LEU 94 -3.648 -4.625 -0.080
721 HA LEU 94 HA LEU 94 -1.079 -5.763 0.844
722 HB2 LEU 94 2HB LEU 94 -1.985 -2.897 1.171
723 HB3 LEU 94 1HB LEU 94 -0.403 -3.558 1.542
724 HG LEU 94 HG LEU 94 -1.573 -3.308 -1.237
725 HD11 LEU 94 1HD1 LEU 94 0.081 -1.532 -1.556
726 HD12 LEU 94 2HD1 LEU 94 0.558 -1.670 0.136
727 HD13 LEU 94 3HD1 LEU 94 -1.068 -1.127 -0.281
728 HD21 LEU 94 3HD2 LEU 94 0.685 -3.876 -1.996
729 HD22 LEU 94 1HD2 LEU 94 -0.025 -5.184 -1.050
730 HD23 LEU 94 2HD2 LEU 94 1.184 -4.125 -0.325
731 H ARG 95 H ARG 95 -0.820 -6.055 3.066
732 HA ARG 95 HA ARG 95 -2.919 -5.109 4.871
733 HB2 ARG 95 2HB ARG 95 -3.055 -7.352 5.979
734 HB3 ARG 95 1HB ARG 95 -3.748 -7.292 4.366
735 HG2 ARG 95 2HG ARG 95 -1.794 -8.389 3.444
736 HG3 ARG 95 1HG ARG 95 -1.012 -8.371 5.026
737 HD2 ARG 95 2HD ARG 95 -2.676 -9.857 5.930
738 HD3 ARG 95 1HD ARG 95 -3.626 -9.767 4.447
739 HE ARG 95 HE ARG 95 -1.426 -10.785 3.460
740 HH11 ARG 95 1HH1 ARG 95 -2.861 -11.559 6.507
741 HH12 ARG 95 2HH1 ARG 95 -2.359 -13.216 6.430
742 HH21 ARG 95 1HH2 ARG 95 -0.813 -12.891 3.378
743 HH22 ARG 95 2HH2 ARG 95 -1.214 -13.954 4.681
744 H ALA 96 H ALA 96 -2.335 -5.289 7.161
745 HA ALA 96 HA ALA 96 0.313 -4.290 7.539
746 HB1 ALA 96 3HB ALA 96 -1.604 -3.423 8.793
747 HB2 ALA 96 1HB ALA 96 -0.334 -3.999 9.871
748 HB3 ALA 96 2HB ALA 96 -1.778 -4.977 9.607
749 H LYS 97 H LYS 97 2.091 -5.208 8.442
750 HA LYS 97 HA LYS 97 2.209 -8.081 8.604
751 HB2 LYS 97 2HB LYS 97 4.086 -6.863 7.654
752 HB3 LYS 97 1HB LYS 97 4.303 -5.964 9.151
753 HG2 LYS 97 2HG LYS 97 5.968 -7.632 9.139
754 HG3 LYS 97 1HG LYS 97 4.741 -8.173 10.286
755 HD2 LYS 97 2HD LYS 97 5.087 -10.119 9.106
756 HD3 LYS 97 1HD LYS 97 3.771 -9.416 8.168
757 HE2 LYS 97 2HE LYS 97 5.508 -10.243 6.693
758 HE3 LYS 97 1HE LYS 97 5.416 -8.484 6.595
759 HZ1 LYS 97 3HZ LYS 97 7.307 -8.343 8.096
760 HZ2 LYS 97 1HZ LYS 97 7.699 -9.240 6.718
761 HZ3 LYS 97 2HZ LYS 97 7.394 -10.032 8.183
762 H LEU 98 H LEU 98 1.259 -8.985 10.362
763 HA LEU 98 HA LEU 98 2.260 -8.121 13.008
764 HB2 LEU 98 2HB LEU 98 -0.381 -9.446 12.350
765 HB3 LEU 98 1HB LEU 98 0.188 -9.079 13.969
766 HG LEU 98 HG LEU 98 -0.454 -7.037 11.826
767 HD11 LEU 98 1HD1 LEU 98 -1.939 -7.735 14.361
768 HD12 LEU 98 2HD1 LEU 98 -2.458 -8.118 12.718
769 HD13 LEU 98 3HD1 LEU 98 -2.348 -6.436 13.239
770 HD21 LEU 98 3HD2 LEU 98 1.332 -6.240 13.259
771 HD22 LEU 98 1HD2 LEU 98 0.410 -6.672 14.698
772 HD23 LEU 98 2HD2 LEU 98 -0.163 -5.385 13.637
773 H GLU 99 H GLU 99 3.968 -9.473 13.289
774 HA GLU 99 HA GLU 99 3.555 -12.370 12.894
775 HB2 GLU 99 2HB GLU 99 6.118 -10.765 13.026
776 HB3 GLU 99 1HB GLU 99 6.047 -12.517 12.892
777 HG2 GLU 99 2HG GLU 99 4.903 -12.315 10.743
778 HG3 GLU 99 1HG GLU 99 4.952 -10.559 10.880
779 H HIS 100 H HIS 100 4.260 -13.853 14.485
780 HA HIS 100 HA HIS 100 3.636 -13.029 17.130
781 HB2 HIS 100 2HB HIS 100 4.219 -15.412 17.731
782 HB3 HIS 100 1HB HIS 100 2.986 -15.220 16.492
783 HD1 HIS 100 HD1 HIS 100 3.357 -16.435 14.349
784 HD2 HIS 100 HD2 HIS 100 6.836 -16.162 16.610
785 HE1 HIS 100 HE1 HIS 100 5.050 -17.833 13.145
786 HE2 HIS 100 HE2 HIS 100 7.124 -17.707 14.556
787 H HIS 101 H HIS 101 6.422 -12.300 15.649
788 HA HIS 101 HA HIS 101 8.398 -13.075 17.507
789 HB2 HIS 101 2HB HIS 101 9.771 -11.229 16.579
790 HB3 HIS 101 1HB HIS 101 9.066 -12.252 15.338
791 HD1 HIS 101 HD1 HIS 101 8.640 -10.795 13.401
792 HD2 HIS 101 HD2 HIS 101 7.580 -8.931 16.962
793 HE1 HIS 101 HE1 HIS 101 7.653 -8.590 12.735
794 HE2 HIS 101 HE2 HIS 101 7.207 -7.403 14.906
795 H HIS 102 H HIS 102 5.811 -10.944 17.928
796 HA HIS 102 HA HIS 102 7.021 -9.235 19.899
797 HB2 HIS 102 2HB HIS 102 4.682 -8.559 20.411
798 HB3 HIS 102 1HB HIS 102 5.068 -8.446 18.699
799 HD1 HIS 102 HD1 HIS 102 3.606 -9.726 17.100
800 HD2 HIS 102 HD2 HIS 102 2.937 -10.781 21.069
801 HE1 HIS 102 HE1 HIS 102 1.556 -11.176 17.083
802 HE2 HIS 102 HE2 HIS 102 1.084 -11.663 19.500
803 H HIS 103 H HIS 103 7.828 -11.686 20.596
804 HA HIS 103 HA HIS 103 6.080 -13.235 22.195
805 HB2 HIS 103 2HB HIS 103 8.103 -14.088 21.013
806 HB3 HIS 103 1HB HIS 103 9.112 -13.212 22.155
807 HD1 HIS 103 HD1 HIS 103 6.987 -16.253 21.816
808 HD2 HIS 103 HD2 HIS 103 9.328 -14.402 24.705
809 HE1 HIS 103 HE1 HIS 103 7.289 -17.957 23.628
810 HE2 HIS 103 HE2 HIS 103 8.900 -16.893 25.235
811 H HIS 104 H HIS 104 5.167 -11.759 23.698
812 HA HIS 104 HA HIS 104 6.956 -10.977 25.924
813 HB2 HIS 104 2HB HIS 104 4.271 -9.793 25.160
814 HB3 HIS 104 1HB HIS 104 5.292 -9.261 26.491
815 HD1 HIS 104 HD1 HIS 104 4.534 -8.519 23.064
816 HD2 HIS 104 HD2 HIS 104 7.912 -8.243 25.472
817 HE1 HIS 104 HE1 HIS 104 6.062 -6.903 21.900
818 HE2 HIS 104 HE2 HIS 104 8.167 -6.902 23.278
819 H HIS 105 H HIS 105 6.351 -11.484 28.039
820 HA HIS 105 HA HIS 105 4.415 -13.674 28.273
821 HB2 HIS 105 2HB HIS 105 6.387 -12.602 30.307
822 HB3 HIS 105 1HB HIS 105 5.412 -14.058 30.483
823 HD1 HIS 105 HD1 HIS 105 6.346 -16.187 29.506
824 HD2 HIS 105 HD2 HIS 105 8.443 -12.814 28.290
825 HE1 HIS 105 HE1 HIS 105 8.380 -17.051 28.327
826 HE2 HIS 105 HE2 HIS 105 9.731 -15.002 27.802
Start of MODEL 7
1 H1 MET 1 1H MET 1 46.582 1.261 -1.584
2 H2 MET 1 2H MET 1 46.840 1.412 -3.245
3 H3 MET 1 3H MET 1 46.477 -0.099 -2.578
4 HA MET 1 HA MET 1 44.566 0.857 -3.715
5 HB2 MET 1 2HB MET 1 44.238 -0.671 -1.817
6 HB3 MET 1 1HB MET 1 44.289 0.686 -0.702
7 HG2 MET 1 2HG MET 1 42.235 1.558 -1.555
8 HG3 MET 1 1HG MET 1 42.219 0.384 -2.869
9 HE1 MET 1 3HE MET 1 41.872 -2.241 -2.499
10 HE2 MET 1 1HE MET 1 41.649 -2.977 -0.913
11 HE3 MET 1 2HE MET 1 43.201 -2.253 -1.339
12 H ASP 2 H ASP 2 45.383 2.774 -0.799
13 HA ASP 2 HA ASP 2 43.820 5.036 -1.803
14 HB2 ASP 2 2HB ASP 2 44.338 6.041 0.396
15 HB3 ASP 2 1HB ASP 2 43.638 4.433 0.570
16 H GLN 3 H GLN 3 45.006 7.282 -1.248
17 HA GLN 3 HA GLN 3 47.840 7.121 -2.078
18 HB2 GLN 3 2HB GLN 3 45.853 9.362 -2.510
19 HB3 GLN 3 1HB GLN 3 47.584 9.536 -2.770
20 HG2 GLN 3 2HG GLN 3 47.412 7.618 -4.403
21 HG3 GLN 3 1HG GLN 3 45.662 7.762 -4.259
22 HE21 GLN 3 1HE2 GLN 3 48.577 9.292 -5.381
23 HE22 GLN 3 2HE2 GLN 3 47.811 10.443 -6.415
24 H LYS 4 H LYS 4 48.469 6.723 0.084
25 HA LYS 4 HA LYS 4 47.877 8.437 2.255
26 HB2 LYS 4 2HB LYS 4 49.885 7.319 3.324
27 HB3 LYS 4 1HB LYS 4 48.606 6.249 2.767
28 HG2 LYS 4 2HG LYS 4 49.970 5.937 0.651
29 HG3 LYS 4 1HG LYS 4 51.287 6.748 1.494
30 HD2 LYS 4 2HD LYS 4 51.450 4.285 1.616
31 HD3 LYS 4 1HD LYS 4 51.296 5.028 3.209
32 HE2 LYS 4 2HE LYS 4 49.909 2.987 2.927
33 HE3 LYS 4 1HE LYS 4 48.967 4.420 3.327
34 HZ1 LYS 4 3HZ LYS 4 49.278 3.279 0.598
35 HZ2 LYS 4 1HZ LYS 4 48.343 4.628 1.008
36 HZ3 LYS 4 2HZ LYS 4 47.917 3.101 1.586
37 H SER 5 H SER 5 50.393 8.553 -0.200
38 HA SER 5 HA SER 5 51.453 11.026 0.978
39 HB2 SER 5 2HB SER 5 53.135 10.962 -0.813
40 HB3 SER 5 1HB SER 5 53.086 9.415 0.032
41 HG SER 5 HG SER 5 52.752 9.894 -2.563
42 H SER 6 H SER 6 49.100 11.745 0.612
43 HA SER 6 HA SER 6 48.218 12.253 -2.059
44 HB2 SER 6 2HB SER 6 46.346 13.466 -0.971
45 HB3 SER 6 1HB SER 6 46.595 11.865 -0.276
46 HG SER 6 HG SER 6 46.799 12.835 1.564
47 H SER 7 H SER 7 47.494 14.437 -2.754
48 HA SER 7 HA SER 7 49.702 16.304 -2.679
49 HB2 SER 7 2HB SER 7 47.005 16.443 -4.079
50 HB3 SER 7 1HB SER 7 48.340 17.565 -4.339
51 HG SER 7 HG SER 7 49.000 16.191 -5.774
52 HA PRO 8 HA PRO 8 48.477 19.466 0.230
53 HB2 PRO 8 2HB PRO 8 47.676 21.530 -1.585
54 HB3 PRO 8 1HB PRO 8 49.213 21.372 -0.734
55 HG2 PRO 8 2HG PRO 8 48.492 20.593 -3.508
56 HG3 PRO 8 1HG PRO 8 50.058 21.099 -2.850
57 HD2 PRO 8 2HD PRO 8 49.591 18.545 -3.493
58 HD3 PRO 8 1HD PRO 8 50.553 18.962 -2.057
59 H GLN 9 H GLN 9 46.250 18.945 -2.475
60 HA GLN 9 HA GLN 9 43.989 19.353 -0.621
61 HB2 GLN 9 2HB GLN 9 44.168 20.887 -2.650
62 HB3 GLN 9 1HB GLN 9 43.830 19.477 -3.642
63 HG2 GLN 9 2HG GLN 9 41.982 20.359 -1.436
64 HG3 GLN 9 1HG GLN 9 41.888 21.029 -3.061
65 HE21 GLN 9 1HE2 GLN 9 39.975 19.411 -1.519
66 HE22 GLN 9 2HE2 GLN 9 39.622 18.046 -2.512
67 HA PRO 10 HA PRO 10 43.716 14.886 -1.318
68 HB2 PRO 10 2HB PRO 10 42.403 14.266 0.922
69 HB3 PRO 10 1HB PRO 10 44.087 14.801 0.976
70 HG2 PRO 10 2HG PRO 10 41.586 16.345 1.556
71 HG3 PRO 10 1HG PRO 10 43.133 16.356 2.421
72 HD2 PRO 10 2HD PRO 10 42.348 18.245 0.542
73 HD3 PRO 10 1HD PRO 10 44.028 17.923 1.015
74 H ALA 11 H ALA 11 41.921 13.244 -1.333
75 HA ALA 11 HA ALA 11 39.422 14.421 -2.368
76 HB1 ALA 11 3HB ALA 11 40.555 11.657 -2.828
77 HB2 ALA 11 1HB ALA 11 40.679 13.015 -3.946
78 HB3 ALA 11 2HB ALA 11 39.101 12.324 -3.570
79 H ALA 12 H ALA 12 37.440 13.830 -1.539
80 HA ALA 12 HA ALA 12 37.397 11.945 0.742
81 HB1 ALA 12 3HB ALA 12 35.893 14.561 0.558
82 HB2 ALA 12 1HB ALA 12 37.318 14.261 1.552
83 HB3 ALA 12 2HB ALA 12 35.813 13.404 1.887
84 H GLN 13 H GLN 13 34.917 11.537 1.324
85 HA GLN 13 HA GLN 13 33.449 10.982 -1.191
86 HB2 GLN 13 2HB GLN 13 33.580 9.325 1.342
87 HB3 GLN 13 1HB GLN 13 32.476 9.007 0.009
88 HG2 GLN 13 2HG GLN 13 35.482 9.026 -0.244
89 HG3 GLN 13 1HG GLN 13 34.510 7.581 0.020
90 HE21 GLN 13 1HE2 GLN 13 35.344 10.089 -2.271
91 HE22 GLN 13 2HE2 GLN 13 34.701 9.282 -3.655
92 H ALA 14 H ALA 14 31.142 11.102 -1.116
93 HA ALA 14 HA ALA 14 30.199 13.126 0.772
94 HB1 ALA 14 3HB ALA 14 29.871 13.512 -1.618
95 HB2 ALA 14 1HB ALA 14 28.329 13.410 -0.767
96 HB3 ALA 14 2HB ALA 14 28.900 12.045 -1.727
97 HA PRO 15 HA PRO 15 27.670 10.126 2.968
98 HB2 PRO 15 2HB PRO 15 26.370 11.794 4.608
99 HB3 PRO 15 1HB PRO 15 28.113 11.533 4.767
100 HG2 PRO 15 2HG PRO 15 26.652 13.806 3.461
101 HG3 PRO 15 1HG PRO 15 28.059 13.857 4.539
102 HD2 PRO 15 2HD PRO 15 28.214 14.009 1.791
103 HD3 PRO 15 1HD PRO 15 29.531 13.427 2.831
104 H GLU 16 H GLU 16 25.369 9.604 3.353
105 HA GLU 16 HA GLU 16 23.700 10.555 1.128
106 HB2 GLU 16 2HB GLU 16 22.334 8.434 1.738
107 HB3 GLU 16 1HB GLU 16 23.862 8.256 0.892
108 HG2 GLU 16 2HG GLU 16 23.659 6.574 2.610
109 HG3 GLU 16 1HG GLU 16 24.970 7.680 2.999
110 H THR 17 H THR 17 21.253 10.326 1.622
111 HA THR 17 HA THR 17 20.629 11.509 4.257
112 HB THR 17 HB THR 17 19.506 12.399 1.580
113 HG1 THR 17 HG1 THR 17 21.255 13.673 3.454
114 HG21 THR 17 3HG2 THR 17 18.323 14.128 2.863
115 HG22 THR 17 1HG2 THR 17 18.919 13.429 4.367
116 HG23 THR 17 2HG2 THR 17 17.803 12.514 3.349
117 H LYS 18 H LYS 18 19.481 9.945 5.266
118 HA LYS 18 HA LYS 18 17.605 8.294 3.699
119 HB2 LYS 18 2HB LYS 18 19.394 7.116 4.916
120 HB3 LYS 18 1HB LYS 18 18.813 7.794 6.430
121 HG2 LYS 18 2HG LYS 18 16.672 6.605 6.107
122 HG3 LYS 18 1HG LYS 18 17.320 5.883 4.633
123 HD2 LYS 18 2HD LYS 18 18.391 5.521 7.437
124 HD3 LYS 18 1HD LYS 18 17.508 4.322 6.492
125 HE2 LYS 18 2HE LYS 18 19.344 4.366 4.814
126 HE3 LYS 18 1HE LYS 18 20.234 5.470 5.862
127 HZ1 LYS 18 3HZ LYS 18 19.436 2.682 6.505
128 HZ2 LYS 18 1HZ LYS 18 20.186 3.742 7.591
129 HZ3 LYS 18 2HZ LYS 18 21.002 3.242 6.200
130 H GLN 19 H GLN 19 15.465 8.491 3.971
131 HA GLN 19 HA GLN 19 14.396 10.101 6.175
132 HB2 GLN 19 2HB GLN 19 13.031 8.938 3.732
133 HB3 GLN 19 1HB GLN 19 12.264 9.990 4.914
134 HG2 GLN 19 2HG GLN 19 14.634 10.782 3.229
135 HG3 GLN 19 1HG GLN 19 12.958 11.112 2.798
136 HE21 GLN 19 1HE2 GLN 19 13.282 13.336 2.833
137 HE22 GLN 19 2HE2 GLN 19 13.490 14.217 4.301
138 H ALA 20 H ALA 20 12.591 9.318 7.473
139 HA ALA 20 HA ALA 20 12.912 6.462 8.092
140 HB1 ALA 20 3HB ALA 20 12.012 6.993 10.278
141 HB2 ALA 20 1HB ALA 20 11.657 8.642 9.761
142 HB3 ALA 20 2HB ALA 20 13.330 8.095 9.878
143 H PHE 21 H PHE 21 11.158 5.079 8.489
144 HA PHE 21 HA PHE 21 8.647 5.777 7.128
145 HB2 PHE 21 2HB PHE 21 9.791 3.107 7.976
146 HB3 PHE 21 1HB PHE 21 8.203 3.305 7.250
147 HD1 PHE 21 HD1 PHE 21 8.176 4.513 4.920
148 HD2 PHE 21 HD2 PHE 21 11.606 2.639 6.620
149 HE1 PHE 21 HE1 PHE 21 9.156 4.274 2.676
150 HE2 PHE 21 HE2 PHE 21 12.587 2.407 4.378
151 HZ PHE 21 HZ PHE 21 11.364 3.221 2.405
152 HA PRO 22 HA PRO 22 6.804 5.645 11.314
153 HB2 PRO 22 2HB PRO 22 4.824 7.403 10.896
154 HB3 PRO 22 1HB PRO 22 6.492 7.946 11.120
155 HG2 PRO 22 2HG PRO 22 4.899 7.701 8.599
156 HG3 PRO 22 1HG PRO 22 6.083 8.935 9.062
157 HD2 PRO 22 2HD PRO 22 6.583 6.732 7.405
158 HD3 PRO 22 1HD PRO 22 7.816 7.728 8.203
159 H ARG 23 H ARG 23 5.965 3.525 11.258
160 HA ARG 23 HA ARG 23 4.095 2.708 9.264
161 HB2 ARG 23 2HB ARG 23 3.990 0.571 10.442
162 HB3 ARG 23 1HB ARG 23 5.649 1.099 10.214
163 HG2 ARG 23 2HG ARG 23 5.825 1.738 12.528
164 HG3 ARG 23 1HG ARG 23 4.109 1.419 12.790
165 HD2 ARG 23 2HD ARG 23 4.436 -0.942 12.386
166 HD3 ARG 23 1HD ARG 23 6.121 -0.671 11.941
167 HE ARG 23 HE ARG 23 6.306 0.168 14.358
168 HH11 ARG 23 1HH1 ARG 23 4.206 -2.379 13.362
169 HH12 ARG 23 2HH1 ARG 23 4.305 -3.193 14.878
170 HH21 ARG 23 1HH2 ARG 23 6.452 -0.927 16.285
171 HH22 ARG 23 2HH2 ARG 23 5.546 -2.382 16.512
172 H LYS 24 H LYS 24 3.690 3.938 12.519
173 HA LYS 24 HA LYS 24 1.124 2.955 13.065
174 HB2 LYS 24 2HB LYS 24 2.422 5.532 13.970
175 HB3 LYS 24 1HB LYS 24 0.935 4.877 14.646
176 HG2 LYS 24 2HG LYS 24 2.163 2.858 15.346
177 HG3 LYS 24 1HG LYS 24 3.651 3.560 14.709
178 HD2 LYS 24 2HD LYS 24 3.555 3.893 17.107
179 HD3 LYS 24 1HD LYS 24 3.407 5.449 16.290
180 HE2 LYS 24 2HE LYS 24 1.833 5.287 18.151
181 HE3 LYS 24 1HE LYS 24 0.976 5.393 16.614
182 HZ1 LYS 24 3HZ LYS 24 1.529 2.815 17.979
183 HZ2 LYS 24 1HZ LYS 24 0.464 3.097 16.697
184 HZ3 LYS 24 2HZ LYS 24 0.115 3.702 18.237
185 H PHE 25 H PHE 25 2.110 5.634 11.032
186 HA PHE 25 HA PHE 25 -0.652 6.542 10.700
187 HB2 PHE 25 2HB PHE 25 1.968 7.576 9.594
188 HB3 PHE 25 1HB PHE 25 0.397 8.267 9.194
189 HD1 PHE 25 HD1 PHE 25 -0.901 9.471 10.855
190 HD2 PHE 25 HD2 PHE 25 2.951 7.901 11.778
191 HE1 PHE 25 HE1 PHE 25 -0.827 10.857 12.881
192 HE2 PHE 25 HE2 PHE 25 3.031 9.294 13.805
193 HZ PHE 25 HZ PHE 25 1.143 10.770 14.361
194 H VAL 26 H VAL 26 1.941 5.108 8.724
195 HA VAL 26 HA VAL 26 0.548 5.011 6.291
196 HB VAL 26 HB VAL 26 2.631 3.041 7.270
197 HG11 VAL 26 1HG1 VAL 26 1.718 3.745 4.477
198 HG12 VAL 26 2HG1 VAL 26 1.448 2.215 5.316
199 HG13 VAL 26 3HG1 VAL 26 3.084 2.703 4.871
200 HG21 VAL 26 3HG2 VAL 26 3.438 5.344 7.418
201 HG22 VAL 26 1HG2 VAL 26 2.977 5.626 5.738
202 HG23 VAL 26 2HG2 VAL 26 4.257 4.473 6.120
203 H LEU 27 H LEU 27 0.810 2.527 8.850
204 HA LEU 27 HA LEU 27 -0.963 0.682 7.630
205 HB2 LEU 27 2HB LEU 27 -0.254 1.009 10.551
206 HB3 LEU 27 1HB LEU 27 -1.079 -0.377 9.861
207 HG LEU 27 HG LEU 27 1.758 0.487 9.251
208 HD11 LEU 27 1HD1 LEU 27 2.403 -1.578 10.391
209 HD12 LEU 27 2HD1 LEU 27 0.714 -1.892 10.789
210 HD13 LEU 27 3HD1 LEU 27 1.534 -0.486 11.469
211 HD21 LEU 27 3HD2 LEU 27 0.187 -1.880 8.225
212 HD22 LEU 27 1HD2 LEU 27 1.915 -1.618 7.984
213 HD23 LEU 27 2HD2 LEU 27 0.748 -0.501 7.281
214 H ALA 28 H ALA 28 -1.480 3.479 9.681
215 HA ALA 28 HA ALA 28 -4.174 3.015 10.381
216 HB1 ALA 28 3HB ALA 28 -2.775 4.738 11.439
217 HB2 ALA 28 1HB ALA 28 -4.301 5.397 10.850
218 HB3 ALA 28 2HB ALA 28 -2.811 5.676 9.946
219 H ALA 29 H ALA 29 -2.698 4.502 7.532
220 HA ALA 29 HA ALA 29 -5.161 5.152 6.232
221 HB1 ALA 29 3HB ALA 29 -2.422 4.691 5.040
222 HB2 ALA 29 1HB ALA 29 -3.049 6.235 5.621
223 HB3 ALA 29 2HB ALA 29 -3.789 5.452 4.225
224 H LEU 30 H LEU 30 -2.943 2.410 6.110
225 HA LEU 30 HA LEU 30 -4.086 0.907 4.077
226 HB2 LEU 30 2HB LEU 30 -1.926 0.441 5.174
227 HB3 LEU 30 1HB LEU 30 -2.775 -0.082 6.614
228 HG LEU 30 HG LEU 30 -3.753 -1.968 5.350
229 HD11 LEU 30 1HD1 LEU 30 -3.785 -0.974 3.131
230 HD12 LEU 30 2HD1 LEU 30 -2.906 -2.502 3.116
231 HD13 LEU 30 3HD1 LEU 30 -2.023 -0.974 3.086
232 HD21 LEU 30 3HD2 LEU 30 -1.701 -3.274 5.139
233 HD22 LEU 30 1HD2 LEU 30 -1.669 -2.272 6.591
234 HD23 LEU 30 2HD2 LEU 30 -0.743 -1.794 5.167
235 H GLU 31 H GLU 31 -4.773 0.626 7.592
236 HA GLU 31 HA GLU 31 -6.743 -1.351 7.431
237 HB2 GLU 31 2HB GLU 31 -7.411 -0.695 9.660
238 HB3 GLU 31 1HB GLU 31 -5.659 -0.586 9.539
239 HG2 GLU 31 2HG GLU 31 -5.771 1.810 9.324
240 HG3 GLU 31 1HG GLU 31 -7.530 1.763 9.263
241 H GLN 32 H GLN 32 -6.989 2.113 6.940
242 HA GLN 32 HA GLN 32 -9.893 2.087 6.876
243 HB2 GLN 32 2HB GLN 32 -7.889 4.300 6.376
244 HB3 GLN 32 1HB GLN 32 -9.635 4.526 6.388
245 HG2 GLN 32 2HG GLN 32 -9.702 3.770 8.727
246 HG3 GLN 32 1HG GLN 32 -7.951 3.584 8.706
247 HE21 GLN 32 1HE2 GLN 32 -6.654 5.436 8.706
248 HE22 GLN 32 2HE2 GLN 32 -7.276 6.985 9.138
249 H SER 33 H SER 33 -7.449 1.383 4.722
250 HA SER 33 HA SER 33 -9.118 1.944 2.358
251 HB2 SER 33 2HB SER 33 -6.831 2.767 2.172
252 HB3 SER 33 1HB SER 33 -6.193 1.176 2.586
253 HG SER 33 HG SER 33 -7.165 0.392 0.647
254 H SER 34 H SER 34 -8.003 -0.579 4.404
255 HA SER 34 HA SER 34 -8.303 -2.749 2.546
256 HB2 SER 34 2HB SER 34 -8.029 -2.699 5.561
257 HB3 SER 34 1HB SER 34 -8.113 -4.182 4.611
258 HG SER 34 HG SER 34 -6.040 -3.942 4.426
259 H ASP 35 H ASP 35 -10.028 -4.031 2.167
260 HA ASP 35 HA ASP 35 -12.609 -3.297 3.210
261 HB2 ASP 35 2HB ASP 35 -11.763 -5.599 1.433
262 HB3 ASP 35 1HB ASP 35 -13.432 -5.146 1.780
263 H ASP 36 H ASP 36 -13.925 -5.728 3.582
264 HA ASP 36 HA ASP 36 -13.450 -6.045 6.326
265 HB2 ASP 36 2HB ASP 36 -15.632 -6.424 5.165
266 HB3 ASP 36 1HB ASP 36 -14.998 -7.957 4.569
267 H ALA 37 H ALA 37 -12.240 -7.943 3.615
268 HA ALA 37 HA ALA 37 -11.340 -10.135 5.263
269 HB1 ALA 37 3HB ALA 37 -11.990 -10.514 2.938
270 HB2 ALA 37 1HB ALA 37 -10.319 -11.008 3.222
271 HB3 ALA 37 2HB ALA 37 -10.663 -9.491 2.390
272 H GLY 38 H GLY 38 -10.177 -7.041 4.900
273 HA2 GLY 38 2HA GLY 38 -8.305 -6.242 6.099
274 HA3 GLY 38 1HA GLY 38 -7.588 -7.840 6.021
275 H TRP 39 H TRP 39 -8.562 -7.357 2.959
276 HA TRP 39 HA TRP 39 -5.877 -6.584 2.130
277 HB2 TRP 39 2HB TRP 39 -8.236 -7.714 0.616
278 HB3 TRP 39 1HB TRP 39 -6.732 -7.237 -0.165
279 HD1 TRP 39 HD1 TRP 39 -8.321 -10.131 1.587
280 HE1 TRP 39 HE1 TRP 39 -6.595 -12.021 1.885
281 HE3 TRP 39 HE3 TRP 39 -4.080 -7.549 0.386
282 HZ2 TRP 39 HZ2 TRP 39 -3.796 -12.359 1.643
283 HZ3 TRP 39 HZ3 TRP 39 -1.921 -8.722 0.447
284 HH2 TRP 39 HH2 TRP 39 -1.785 -11.076 1.065
285 H ALA 40 H ALA 40 -5.343 -4.622 1.461
286 HA ALA 40 HA ALA 40 -7.448 -2.760 0.552
287 HB1 ALA 40 3HB ALA 40 -5.860 -0.967 1.067
288 HB2 ALA 40 1HB ALA 40 -4.668 -2.165 1.574
289 HB3 ALA 40 2HB ALA 40 -6.173 -1.981 2.475
290 H ASN 41 H ASN 41 -7.542 -2.279 -1.561
291 HA ASN 41 HA ASN 41 -5.667 -3.206 -3.467
292 HB2 ASN 41 2HB ASN 41 -8.055 -2.693 -3.965
293 HB3 ASN 41 1HB ASN 41 -7.704 -0.979 -3.779
294 HD21 ASN 41 1HD2 ASN 41 -8.681 -2.492 -6.104
295 HD22 ASN 41 2HD2 ASN 41 -7.559 -2.164 -7.374
296 H LEU 42 H LEU 42 -3.784 -2.354 -4.152
297 HA LEU 42 HA LEU 42 -2.335 -0.435 -2.873
298 HB2 LEU 42 2HB LEU 42 -1.400 -1.990 -4.509
299 HB3 LEU 42 1HB LEU 42 -2.204 -1.130 -5.809
300 HG LEU 42 HG LEU 42 -0.818 0.874 -5.304
301 HD11 LEU 42 1HD1 LEU 42 1.162 0.622 -3.874
302 HD12 LEU 42 2HD1 LEU 42 0.598 -0.976 -3.381
303 HD13 LEU 42 3HD1 LEU 42 -0.335 0.459 -2.958
304 HD21 LEU 42 3HD2 LEU 42 1.246 0.006 -6.259
305 HD22 LEU 42 1HD2 LEU 42 -0.161 -0.695 -7.055
306 HD23 LEU 42 2HD2 LEU 42 0.749 -1.641 -5.874
307 H GLY 43 H GLY 43 -4.465 0.134 -5.676
308 HA2 GLY 43 2HA GLY 43 -3.908 2.850 -6.101
309 HA3 GLY 43 1HA GLY 43 -5.424 2.055 -6.495
310 H ASN 44 H ASN 44 -6.211 1.337 -3.868
311 HA ASN 44 HA ASN 44 -7.289 3.838 -2.944
312 HB2 ASN 44 2HB ASN 44 -7.483 1.074 -1.704
313 HB3 ASN 44 1HB ASN 44 -8.465 2.470 -1.272
314 HD21 ASN 44 1HD2 ASN 44 -9.348 -0.105 -2.243
315 HD22 ASN 44 2HD2 ASN 44 -10.213 0.200 -3.708
316 H PHE 45 H PHE 45 -4.842 1.561 -1.816
317 HA PHE 45 HA PHE 45 -4.306 2.622 0.707
318 HB2 PHE 45 2HB PHE 45 -3.384 0.493 0.037
319 HB3 PHE 45 1HB PHE 45 -2.482 1.240 -1.276
320 HD1 PHE 45 HD1 PHE 45 -2.830 1.542 2.440
321 HD2 PHE 45 HD2 PHE 45 -0.229 1.585 -0.936
322 HE1 PHE 45 HE1 PHE 45 -0.893 1.792 3.934
323 HE2 PHE 45 HE2 PHE 45 1.710 1.836 0.558
324 HZ PHE 45 HZ PHE 45 1.377 1.938 2.994
325 H GLY 46 H GLY 46 -2.574 3.318 -2.359
326 HA2 GLY 46 2HA GLY 46 -0.960 5.397 -1.365
327 HA3 GLY 46 1HA GLY 46 -1.400 5.174 -3.051
328 H ASN 47 H ASN 47 -4.277 5.428 -2.464
329 HA ASN 47 HA ASN 47 -4.571 8.231 -2.764
330 HB2 ASN 47 2HB ASN 47 -6.122 6.515 -3.702
331 HB3 ASN 47 1HB ASN 47 -6.687 6.172 -2.071
332 HD21 ASN 47 1HD2 ASN 47 -8.075 7.183 -4.470
333 HD22 ASN 47 2HD2 ASN 47 -8.846 8.643 -3.958
334 H TYR 48 H TYR 48 -5.626 6.081 -0.085
335 HA TYR 48 HA TYR 48 -6.377 8.295 1.557
336 HB2 TYR 48 2HB TYR 48 -7.216 5.801 1.589
337 HB3 TYR 48 1HB TYR 48 -5.877 5.567 2.711
338 HD1 TYR 48 HD2 TYR 48 -9.102 7.251 2.184
339 HD2 TYR 48 HD1 TYR 48 -5.958 6.514 4.959
340 HE1 TYR 48 HE2 TYR 48 -10.504 8.129 3.999
341 HE2 TYR 48 HE1 TYR 48 -7.353 7.393 6.781
342 HH TYR 48 HH TYR 48 -9.291 8.959 7.025
343 H LEU 49 H LEU 49 -3.437 6.429 1.216
344 HA LEU 49 HA LEU 49 -2.162 7.104 3.627
345 HB2 LEU 49 2HB LEU 49 -1.321 5.365 2.147
346 HB3 LEU 49 1HB LEU 49 -0.975 6.550 0.903
347 HG LEU 49 HG LEU 49 0.771 7.547 2.302
348 HD11 LEU 49 1HD1 LEU 49 0.064 5.389 4.294
349 HD12 LEU 49 2HD1 LEU 49 -0.166 7.127 4.501
350 HD13 LEU 49 3HD1 LEU 49 1.463 6.460 4.395
351 HD21 LEU 49 3HD2 LEU 49 1.032 4.550 2.029
352 HD22 LEU 49 1HD2 LEU 49 2.366 5.683 2.250
353 HD23 LEU 49 2HD2 LEU 49 1.389 5.749 0.783
354 H ASN 50 H ASN 50 -2.223 8.818 0.509
355 HA ASN 50 HA ASN 50 -0.387 10.851 1.255
356 HB2 ASN 50 2HB ASN 50 -0.971 10.256 -1.096
357 HB3 ASN 50 1HB ASN 50 -2.557 10.984 -0.854
358 HD21 ASN 50 1HD2 ASN 50 0.869 11.606 -1.114
359 HD22 ASN 50 2HD2 ASN 50 0.733 13.298 -1.434
360 H LYS 51 H LYS 51 -3.631 10.325 2.166
361 HA LYS 51 HA LYS 51 -4.297 13.075 2.725
362 HB2 LYS 51 2HB LYS 51 -5.580 10.540 3.776
363 HB3 LYS 51 1HB LYS 51 -6.255 12.162 3.875
364 HG2 LYS 51 2HG LYS 51 -6.323 12.238 1.394
365 HG3 LYS 51 1HG LYS 51 -5.758 10.566 1.363
366 HD2 LYS 51 2HD LYS 51 -8.177 10.639 1.104
367 HD3 LYS 51 1HD LYS 51 -7.746 9.878 2.639
368 HE2 LYS 51 2HE LYS 51 -9.629 11.430 2.894
369 HE3 LYS 51 1HE LYS 51 -8.229 11.956 3.824
370 HZ1 LYS 51 3HZ LYS 51 -8.963 13.016 1.154
371 HZ2 LYS 51 1HZ LYS 51 -7.727 13.585 2.157
372 HZ3 LYS 51 2HZ LYS 51 -9.344 13.768 2.616
373 H LEU 52 H LEU 52 -3.258 10.280 4.684
374 HA LEU 52 HA LEU 52 -3.130 11.805 7.122
375 HB2 LEU 52 2HB LEU 52 -1.873 9.120 6.522
376 HB3 LEU 52 1HB LEU 52 -2.141 9.816 8.112
377 HG LEU 52 HG LEU 52 -4.250 8.839 6.177
378 HD11 LEU 52 1HD1 LEU 52 -4.761 7.235 7.952
379 HD12 LEU 52 2HD1 LEU 52 -3.428 7.875 8.917
380 HD13 LEU 52 3HD1 LEU 52 -3.103 7.069 7.381
381 HD21 LEU 52 3HD2 LEU 52 -5.895 9.428 7.897
382 HD22 LEU 52 1HD2 LEU 52 -5.056 10.853 7.290
383 HD23 LEU 52 2HD2 LEU 52 -4.623 10.178 8.861
384 H GLN 53 H GLN 53 -0.729 10.537 4.834
385 HA GLN 53 HA GLN 53 1.247 12.456 5.906
386 HB2 GLN 53 2HB GLN 53 1.729 9.653 4.871
387 HB3 GLN 53 1HB GLN 53 3.011 10.814 5.177
388 HG2 GLN 53 2HG GLN 53 1.093 9.770 7.255
389 HG3 GLN 53 1HG GLN 53 2.730 9.172 6.989
390 HE21 GLN 53 1HE2 GLN 53 0.809 11.784 8.229
391 HE22 GLN 53 2HE2 GLN 53 2.090 12.606 9.040
392 HA PRO 54 HA PRO 54 0.484 13.496 1.429
393 HB2 PRO 54 2HB PRO 54 1.114 16.223 2.350
394 HB3 PRO 54 1HB PRO 54 -0.313 15.632 1.497
395 HG2 PRO 54 2HG PRO 54 -0.370 16.386 4.092
396 HG3 PRO 54 1HG PRO 54 -1.421 15.113 3.448
397 HD2 PRO 54 2HD PRO 54 1.082 14.875 5.070
398 HD3 PRO 54 1HD PRO 54 -0.407 13.907 5.142
399 H ASP 55 H ASP 55 3.058 14.252 3.668
400 HA ASP 55 HA ASP 55 4.877 15.127 1.589
401 HB2 ASP 55 2HB ASP 55 4.815 16.184 3.853
402 HB3 ASP 55 1HB ASP 55 5.414 14.677 4.536
403 H PHE 56 H PHE 56 3.856 12.147 2.541
404 HA PHE 56 HA PHE 56 6.455 10.808 2.453
405 HB2 PHE 56 2HB PHE 56 4.789 10.072 4.109
406 HB3 PHE 56 1HB PHE 56 3.664 9.682 2.815
407 HD1 PHE 56 HD1 PHE 56 6.918 8.759 4.323
408 HD2 PHE 56 HD2 PHE 56 3.764 7.595 1.704
409 HE1 PHE 56 HE1 PHE 56 7.844 6.484 4.226
410 HE2 PHE 56 HE2 PHE 56 4.688 5.317 1.606
411 HZ PHE 56 HZ PHE 56 6.730 4.756 2.864
412 H ASP 57 H ASP 57 7.225 10.817 0.377
413 HA ASP 57 HA ASP 57 5.572 9.452 -1.649
414 HB2 ASP 57 2HB ASP 57 5.710 11.865 -2.158
415 HB3 ASP 57 1HB ASP 57 7.469 11.751 -2.194
416 H SER 58 H SER 58 6.582 7.999 -3.006
417 HA SER 58 HA SER 58 8.646 6.471 -1.930
418 HB2 SER 58 2HB SER 58 7.743 6.533 -4.820
419 HB3 SER 58 1HB SER 58 8.620 5.220 -4.034
420 HG SER 58 HG SER 58 5.955 5.832 -3.975
421 H ARG 59 H ARG 59 8.865 9.137 -4.239
422 HA ARG 59 HA ARG 59 11.410 8.565 -5.305
423 HB2 ARG 59 2HB ARG 59 10.051 11.242 -4.930
424 HB3 ARG 59 1HB ARG 59 11.499 10.989 -5.896
425 HG2 ARG 59 2HG ARG 59 8.799 9.745 -6.408
426 HG3 ARG 59 1HG ARG 59 9.489 11.115 -7.276
427 HD2 ARG 59 2HD ARG 59 10.531 8.279 -7.229
428 HD3 ARG 59 1HD ARG 59 9.770 9.105 -8.587
429 HE ARG 59 HE ARG 59 12.374 9.935 -7.465
430 HH11 ARG 59 1HH1 ARG 59 10.329 9.298 -10.166
431 HH12 ARG 59 2HH1 ARG 59 11.551 9.703 -11.317
432 HH21 ARG 59 1HH2 ARG 59 13.918 10.450 -8.941
433 HH22 ARG 59 2HH2 ARG 59 13.561 10.354 -10.629
434 H LEU 60 H LEU 60 10.530 9.843 -2.208
435 HA LEU 60 HA LEU 60 12.959 11.158 -1.549
436 HB2 LEU 60 2HB LEU 60 10.943 9.814 0.264
437 HB3 LEU 60 1HB LEU 60 12.207 10.909 0.797
438 HG LEU 60 HG LEU 60 9.904 11.655 -1.021
439 HD11 LEU 60 1HD1 LEU 60 9.066 12.915 0.893
440 HD12 LEU 60 2HD1 LEU 60 10.394 12.315 1.887
441 HD13 LEU 60 3HD1 LEU 60 9.178 11.196 1.270
442 HD21 LEU 60 3HD2 LEU 60 11.914 12.970 -1.476
443 HD22 LEU 60 1HD2 LEU 60 12.051 13.371 0.237
444 HD23 LEU 60 2HD2 LEU 60 10.674 13.955 -0.701
445 H TYR 61 H TYR 61 12.056 7.811 -1.639
446 HA TYR 61 HA TYR 61 14.475 7.028 -0.147
447 HB2 TYR 61 2HB TYR 61 12.068 5.345 -0.900
448 HB3 TYR 61 1HB TYR 61 13.399 4.852 0.145
449 HD1 TYR 61 HD2 TYR 61 13.596 5.747 2.415
450 HD2 TYR 61 HD1 TYR 61 10.341 6.861 -0.091
451 HE1 TYR 61 HE2 TYR 61 12.414 6.662 4.363
452 HE2 TYR 61 HE1 TYR 61 9.157 7.789 1.853
453 HH TYR 61 HH TYR 61 9.175 7.446 4.362
454 H GLY 62 H GLY 62 13.787 7.692 -3.207
455 HA2 GLY 62 2HA GLY 62 15.160 7.259 -5.056
456 HA3 GLY 62 1HA GLY 62 15.808 5.855 -4.229
457 H TYR 63 H TYR 63 12.480 5.687 -4.022
458 HA TYR 63 HA TYR 63 12.391 3.754 -6.224
459 HB2 TYR 63 2HB TYR 63 10.512 4.237 -3.897
460 HB3 TYR 63 1HB TYR 63 10.209 3.060 -5.174
461 HD1 TYR 63 HD1 TYR 63 12.557 3.942 -2.430
462 HD2 TYR 63 HD2 TYR 63 11.236 0.918 -5.125
463 HE1 TYR 63 HE1 TYR 63 13.905 2.281 -1.219
464 HE2 TYR 63 HE2 TYR 63 12.582 -0.749 -3.920
465 HH TYR 63 HH TYR 63 14.553 -0.823 -2.457
466 H LYS 64 H LYS 64 11.148 3.984 -8.011
467 HA LYS 64 HA LYS 64 10.237 6.657 -8.610
468 HB2 LYS 64 2HB LYS 64 10.150 4.153 -10.308
469 HB3 LYS 64 1HB LYS 64 9.871 5.794 -10.878
470 HG2 LYS 64 2HG LYS 64 12.184 6.386 -10.278
471 HG3 LYS 64 1HG LYS 64 12.458 4.725 -9.744
472 HD2 LYS 64 2HD LYS 64 13.343 5.027 -11.988
473 HD3 LYS 64 1HD LYS 64 11.959 3.933 -12.035
474 HE2 LYS 64 2HE LYS 64 10.526 5.790 -12.769
475 HE3 LYS 64 1HE LYS 64 11.915 6.876 -12.732
476 HZ1 LYS 64 3HZ LYS 64 11.572 4.506 -14.490
477 HZ2 LYS 64 1HZ LYS 64 12.971 5.455 -14.415
478 HZ3 LYS 64 2HZ LYS 64 11.522 6.130 -14.963
479 H LYS 65 H LYS 65 8.715 3.682 -7.680
480 HA LYS 65 HA LYS 65 6.088 4.971 -7.848
481 HB2 LYS 65 2HB LYS 65 5.086 2.900 -8.810
482 HB3 LYS 65 1HB LYS 65 6.186 3.722 -9.906
483 HG2 LYS 65 2HG LYS 65 7.928 2.106 -9.426
484 HG3 LYS 65 1HG LYS 65 6.897 1.309 -8.240
485 HD2 LYS 65 2HD LYS 65 6.848 0.017 -10.260
486 HD3 LYS 65 1HD LYS 65 5.282 0.803 -10.081
487 HE2 LYS 65 2HE LYS 65 7.493 1.945 -11.786
488 HE3 LYS 65 1HE LYS 65 6.311 0.797 -12.410
489 HZ1 LYS 65 3HZ LYS 65 4.558 2.388 -11.725
490 HZ2 LYS 65 1HZ LYS 65 5.591 2.995 -12.919
491 HZ3 LYS 65 2HZ LYS 65 5.761 3.504 -11.321
492 H LEU 66 H LEU 66 4.601 4.308 -6.304
493 HA LEU 66 HA LEU 66 5.569 3.294 -3.869
494 HB2 LEU 66 2HB LEU 66 3.567 4.728 -4.087
495 HB3 LEU 66 1HB LEU 66 2.709 3.401 -4.847
496 HG LEU 66 HG LEU 66 2.935 2.092 -2.735
497 HD11 LEU 66 1HD1 LEU 66 4.930 3.186 -1.844
498 HD12 LEU 66 2HD1 LEU 66 3.603 3.226 -0.684
499 HD13 LEU 66 3HD1 LEU 66 4.017 4.674 -1.603
500 HD21 LEU 66 3HD2 LEU 66 0.898 3.354 -3.217
501 HD22 LEU 66 1HD2 LEU 66 1.585 4.782 -2.444
502 HD23 LEU 66 2HD2 LEU 66 1.241 3.338 -1.488
503 H SER 67 H SER 67 3.920 1.711 -6.555
504 HA SER 67 HA SER 67 3.310 -0.781 -5.616
505 HB2 SER 67 2HB SER 67 4.740 -0.254 -8.242
506 HB3 SER 67 1HB SER 67 3.728 -1.646 -7.865
507 HG SER 67 HG SER 67 2.616 -0.053 -9.073
508 H ASP 68 H ASP 68 6.528 0.428 -6.431
509 HA ASP 68 HA ASP 68 7.751 -2.170 -5.984
510 HB2 ASP 68 2HB ASP 68 8.419 -0.668 -7.873
511 HB3 ASP 68 1HB ASP 68 9.087 0.451 -6.689
512 H LEU 69 H LEU 69 7.425 0.898 -4.307
513 HA LEU 69 HA LEU 69 9.457 0.531 -2.371
514 HB2 LEU 69 2HB LEU 69 8.402 2.703 -2.721
515 HB3 LEU 69 1HB LEU 69 6.856 2.068 -2.187
516 HG LEU 69 HG LEU 69 7.888 1.657 0.071
517 HD11 LEU 69 1HD1 LEU 69 9.963 2.822 0.634
518 HD12 LEU 69 2HD1 LEU 69 10.166 3.285 -1.055
519 HD13 LEU 69 3HD1 LEU 69 10.229 1.584 -0.595
520 HD21 LEU 69 3HD2 LEU 69 6.479 3.594 -0.342
521 HD22 LEU 69 1HD2 LEU 69 7.874 4.513 -0.908
522 HD23 LEU 69 2HD2 LEU 69 7.782 3.994 0.777
523 H VAL 70 H VAL 70 5.971 -0.228 -2.273
524 HA VAL 70 HA VAL 70 5.890 -1.173 0.367
525 HB VAL 70 HB VAL 70 4.121 -2.078 -1.918
526 HG11 VAL 70 1HG1 VAL 70 3.632 -2.016 1.066
527 HG12 VAL 70 2HG1 VAL 70 3.893 -3.456 0.083
528 HG13 VAL 70 3HG1 VAL 70 2.451 -2.475 -0.163
529 HG21 VAL 70 3HG2 VAL 70 4.170 0.361 -1.795
530 HG22 VAL 70 1HG2 VAL 70 3.802 0.296 -0.070
531 HG23 VAL 70 2HG2 VAL 70 2.611 -0.257 -1.249
532 H LYS 71 H LYS 71 6.218 -3.049 -2.674
533 HA LYS 71 HA LYS 71 6.540 -5.572 -1.444
534 HB2 LYS 71 2HB LYS 71 7.543 -6.271 -3.629
535 HB3 LYS 71 1HB LYS 71 5.985 -5.470 -3.775
536 HG2 LYS 71 2HG LYS 71 7.167 -3.366 -4.350
537 HG3 LYS 71 1HG LYS 71 8.691 -4.250 -4.313
538 HD2 LYS 71 2HD LYS 71 6.406 -5.101 -6.081
539 HD3 LYS 71 1HD LYS 71 7.564 -3.875 -6.594
540 HE2 LYS 71 2HE LYS 71 8.320 -6.663 -5.706
541 HE3 LYS 71 1HE LYS 71 8.089 -6.184 -7.388
542 HZ1 LYS 71 3HZ LYS 71 10.154 -5.196 -5.503
543 HZ2 LYS 71 1HZ LYS 71 9.852 -4.472 -6.998
544 HZ3 LYS 71 2HZ LYS 71 10.395 -6.071 -6.924
545 H ALA 72 H ALA 72 8.738 -2.929 -1.800
546 HA ALA 72 HA ALA 72 11.122 -4.498 -1.305
547 HB1 ALA 72 3HB ALA 72 11.261 -2.476 -2.656
548 HB2 ALA 72 1HB ALA 72 12.272 -2.337 -1.217
549 HB3 ALA 72 2HB ALA 72 10.717 -1.506 -1.287
550 H ARG 73 H ARG 73 8.682 -3.012 0.625
551 HA ARG 73 HA ARG 73 10.405 -3.203 3.021
552 HB2 ARG 73 2HB ARG 73 7.947 -1.486 2.590
553 HB3 ARG 73 1HB ARG 73 8.881 -1.570 4.080
554 HG2 ARG 73 2HG ARG 73 9.878 -0.578 1.407
555 HG3 ARG 73 1HG ARG 73 9.473 0.418 2.809
556 HD2 ARG 73 2HD ARG 73 11.309 -0.429 4.055
557 HD3 ARG 73 1HD ARG 73 11.582 -1.740 2.907
558 HE ARG 73 HE ARG 73 12.265 1.086 2.507
559 HH11 ARG 73 1HH1 ARG 73 12.492 -2.211 1.540
560 HH12 ARG 73 2HH1 ARG 73 13.648 -1.882 0.298
561 HH21 ARG 73 1HH2 ARG 73 13.768 1.486 0.916
562 HH22 ARG 73 2HH2 ARG 73 14.350 0.180 -0.058
563 H THR 74 H THR 74 9.420 -5.572 2.220
564 HA THR 74 HA THR 74 6.941 -6.387 3.247
565 HB THR 74 HB THR 74 7.906 -8.668 3.371
566 HG1 THR 74 HG1 THR 74 9.978 -8.743 3.787
567 HG21 THR 74 3HG2 THR 74 8.706 -7.141 0.882
568 HG22 THR 74 1HG2 THR 74 7.108 -7.812 1.211
569 HG23 THR 74 2HG2 THR 74 8.490 -8.888 0.994
570 H ASP 75 H ASP 75 9.788 -5.442 4.878
571 HA ASP 75 HA ASP 75 9.594 -6.624 7.377
572 HB2 ASP 75 2HB ASP 75 11.445 -5.168 6.654
573 HB3 ASP 75 1HB ASP 75 10.369 -3.777 6.681
574 H LEU 76 H LEU 76 7.785 -3.920 6.029
575 HA LEU 76 HA LEU 76 6.240 -3.645 8.527
576 HB2 LEU 76 2HB LEU 76 6.610 -1.718 6.228
577 HB3 LEU 76 1HB LEU 76 5.611 -1.414 7.638
578 HG LEU 76 HG LEU 76 8.609 -1.838 7.720
579 HD11 LEU 76 1HD1 LEU 76 8.739 0.574 8.173
580 HD12 LEU 76 2HD1 LEU 76 7.005 0.717 7.874
581 HD13 LEU 76 3HD1 LEU 76 8.089 0.235 6.570
582 HD21 LEU 76 3HD2 LEU 76 6.685 -0.909 9.858
583 HD22 LEU 76 1HD2 LEU 76 8.437 -1.044 10.019
584 HD23 LEU 76 2HD2 LEU 76 7.461 -2.492 9.785
585 H PHE 77 H PHE 77 5.978 -4.373 5.111
586 HA PHE 77 HA PHE 77 3.027 -4.376 5.343
587 HB2 PHE 77 2HB PHE 77 4.597 -3.764 2.829
588 HB3 PHE 77 1HB PHE 77 2.859 -3.602 3.065
589 HD1 PHE 77 HD1 PHE 77 2.451 -2.126 5.421
590 HD2 PHE 77 HD2 PHE 77 5.628 -1.714 2.605
591 HE1 PHE 77 HE1 PHE 77 2.779 0.206 6.122
592 HE2 PHE 77 HE2 PHE 77 5.954 0.613 3.311
593 HZ PHE 77 HZ PHE 77 4.529 1.578 5.070
594 H VAL 78 H VAL 78 1.915 -6.099 4.507
595 HA VAL 78 HA VAL 78 3.460 -8.337 3.377
596 HB VAL 78 HB VAL 78 0.592 -8.286 4.355
597 HG11 VAL 78 1HG1 VAL 78 2.322 -10.629 3.545
598 HG12 VAL 78 2HG1 VAL 78 0.939 -9.995 2.651
599 HG13 VAL 78 3HG1 VAL 78 0.703 -10.734 4.235
600 HG21 VAL 78 3HG2 VAL 78 2.133 -7.950 6.202
601 HG22 VAL 78 1HG2 VAL 78 3.077 -9.354 5.703
602 HG23 VAL 78 2HG2 VAL 78 1.426 -9.563 6.288
603 H THR 79 H THR 79 3.450 -8.606 1.206
604 HA THR 79 HA THR 79 1.287 -7.294 -0.351
605 HB THR 79 HB THR 79 2.857 -6.932 -2.159
606 HG1 THR 79 HG1 THR 79 4.259 -8.886 -0.945
607 HG21 THR 79 3HG2 THR 79 4.456 -5.405 -1.105
608 HG22 THR 79 1HG2 THR 79 4.131 -6.134 0.467
609 HG23 THR 79 2HG2 THR 79 2.860 -5.247 -0.374
610 H GLU 80 H GLU 80 0.043 -8.561 -1.592
611 HA GLU 80 HA GLU 80 1.135 -10.954 -2.847
612 HB2 GLU 80 2HB GLU 80 -1.216 -11.033 -0.940
613 HB3 GLU 80 1HB GLU 80 -0.904 -12.299 -2.119
614 HG2 GLU 80 2HG GLU 80 1.226 -12.801 -1.082
615 HG3 GLU 80 1HG GLU 80 1.031 -11.459 0.040
616 H GLU 81 H GLU 81 0.140 -11.485 -4.766
617 HA GLU 81 HA GLU 81 -1.503 -9.384 -5.925
618 HB2 GLU 81 2HB GLU 81 -0.276 -11.834 -7.222
619 HB3 GLU 81 1HB GLU 81 -1.014 -10.479 -8.066
620 HG2 GLU 81 2HG GLU 81 0.716 -8.987 -7.290
621 HG3 GLU 81 1HG GLU 81 1.417 -10.264 -6.297
622 H ARG 82 H ARG 82 -3.656 -9.510 -6.080
623 HA ARG 82 HA ARG 82 -4.942 -12.166 -5.871
624 HB2 ARG 82 2HB ARG 82 -5.930 -9.506 -4.813
625 HB3 ARG 82 1HB ARG 82 -6.814 -11.025 -4.721
626 HG2 ARG 82 2HG ARG 82 -4.117 -10.549 -3.450
627 HG3 ARG 82 1HG ARG 82 -5.661 -10.389 -2.609
628 HD2 ARG 82 2HD ARG 82 -4.734 -12.917 -3.980
629 HD3 ARG 82 1HD ARG 82 -4.499 -12.579 -2.265
630 HE ARG 82 HE ARG 82 -6.953 -12.503 -2.075
631 HH11 ARG 82 1HH1 ARG 82 -5.606 -14.107 -4.835
632 HH12 ARG 82 2HH1 ARG 82 -6.974 -15.148 -5.009
633 HH21 ARG 82 1HH2 ARG 82 -8.679 -13.847 -2.335
634 HH22 ARG 82 2HH2 ARG 82 -8.684 -14.998 -3.627
635 H GLN 83 H GLN 83 -6.393 -12.728 -7.385
636 HA GLN 83 HA GLN 83 -6.727 -11.037 -9.700
637 HB2 GLN 83 2HB GLN 83 -6.347 -13.479 -9.880
638 HB3 GLN 83 1HB GLN 83 -7.902 -13.766 -9.113
639 HG2 GLN 83 2HG GLN 83 -9.050 -12.708 -10.978
640 HG3 GLN 83 1HG GLN 83 -7.502 -12.340 -11.741
641 HE21 GLN 83 1HE2 GLN 83 -7.960 -13.527 -13.575
642 HE22 GLN 83 2HE2 GLN 83 -8.014 -15.252 -13.583
643 H VAL 84 H VAL 84 -8.622 -10.080 -10.448
644 HA VAL 84 HA VAL 84 -10.564 -9.481 -8.365
645 HB VAL 84 HB VAL 84 -10.404 -8.353 -11.172
646 HG11 VAL 84 1HG1 VAL 84 -12.563 -7.989 -10.109
647 HG12 VAL 84 2HG1 VAL 84 -11.672 -6.471 -10.223
648 HG13 VAL 84 3HG1 VAL 84 -11.769 -7.322 -8.681
649 HG21 VAL 84 3HG2 VAL 84 -8.297 -7.953 -10.021
650 HG22 VAL 84 1HG2 VAL 84 -9.160 -7.297 -8.628
651 HG23 VAL 84 2HG2 VAL 84 -9.209 -6.450 -10.175
652 HA PRO 85 HA PRO 85 -13.356 -12.761 -9.741
653 HB2 PRO 85 2HB PRO 85 -15.289 -10.955 -8.329
654 HB3 PRO 85 1HB PRO 85 -15.073 -12.705 -8.190
655 HG2 PRO 85 2HG PRO 85 -14.124 -11.103 -6.305
656 HG3 PRO 85 1HG PRO 85 -13.175 -12.498 -6.852
657 HD2 PRO 85 2HD PRO 85 -12.810 -9.595 -7.473
658 HD3 PRO 85 1HD PRO 85 -11.588 -10.859 -7.220
659 H GLY 86 H GLY 86 -14.423 -12.990 -11.625
660 HA2 GLY 86 2HA GLY 86 -15.858 -12.465 -13.395
661 HA3 GLY 86 1HA GLY 86 -16.096 -10.868 -12.706
662 H SER 87 H SER 87 -12.871 -11.138 -12.676
663 HA SER 87 HA SER 87 -12.505 -10.251 -15.469
664 HB2 SER 87 2HB SER 87 -11.373 -8.903 -12.995
665 HB3 SER 87 1HB SER 87 -10.936 -8.490 -14.654
666 HG SER 87 HG SER 87 -13.588 -8.395 -13.636
667 H THR 88 H THR 88 -10.557 -10.812 -16.442
668 HA THR 88 HA THR 88 -9.087 -12.979 -15.217
669 HB THR 88 HB THR 88 -9.561 -13.068 -17.614
670 HG1 THR 88 HG1 THR 88 -7.404 -13.565 -18.301
671 HG21 THR 88 3HG2 THR 88 -8.386 -11.586 -19.192
672 HG22 THR 88 1HG2 THR 88 -7.749 -10.657 -17.834
673 HG23 THR 88 2HG2 THR 88 -9.484 -10.685 -18.147
674 H GLN 89 H GLN 89 -8.657 -9.565 -15.540
675 HA GLN 89 HA GLN 89 -5.837 -9.459 -15.191
676 HB2 GLN 89 2HB GLN 89 -6.130 -7.093 -14.773
677 HB3 GLN 89 1HB GLN 89 -7.181 -7.571 -16.098
678 HG2 GLN 89 2HG GLN 89 -9.100 -7.581 -14.620
679 HG3 GLN 89 1HG GLN 89 -8.069 -7.212 -13.241
680 HE21 GLN 89 1HE2 GLN 89 -7.700 -5.756 -16.412
681 HE22 GLN 89 2HE2 GLN 89 -8.178 -4.168 -15.936
682 H LYS 90 H LYS 90 -4.683 -8.714 -13.292
683 HA LYS 90 HA LYS 90 -5.994 -9.495 -10.757
684 HB2 LYS 90 2HB LYS 90 -3.859 -10.270 -9.932
685 HB3 LYS 90 1HB LYS 90 -4.199 -11.058 -11.467
686 HG2 LYS 90 2HG LYS 90 -2.687 -9.511 -12.607
687 HG3 LYS 90 1HG LYS 90 -2.362 -8.696 -11.077
688 HD2 LYS 90 2HD LYS 90 -0.556 -10.234 -11.618
689 HD3 LYS 90 1HD LYS 90 -1.415 -10.781 -10.177
690 HE2 LYS 90 2HE LYS 90 -2.604 -12.444 -11.464
691 HE3 LYS 90 1HE LYS 90 -1.905 -11.834 -12.965
692 HZ1 LYS 90 3HZ LYS 90 -0.714 -13.765 -12.296
693 HZ2 LYS 90 1HZ LYS 90 -0.462 -13.161 -10.738
694 HZ3 LYS 90 2HZ LYS 90 0.298 -12.435 -12.064
695 H ALA 91 H ALA 91 -5.453 -8.323 -8.876
696 HA ALA 91 HA ALA 91 -4.132 -5.719 -9.322
697 HB1 ALA 91 3HB ALA 91 -6.569 -5.433 -9.162
698 HB2 ALA 91 1HB ALA 91 -5.732 -4.673 -7.807
699 HB3 ALA 91 2HB ALA 91 -6.556 -6.216 -7.582
700 H LEU 92 H LEU 92 -2.813 -4.949 -7.671
701 HA LEU 92 HA LEU 92 -1.856 -6.945 -5.805
702 HB2 LEU 92 2HB LEU 92 -0.258 -5.537 -6.990
703 HB3 LEU 92 1HB LEU 92 -0.972 -4.095 -6.289
704 HG LEU 92 HG LEU 92 -0.291 -4.994 -4.015
705 HD11 LEU 92 1HD1 LEU 92 1.508 -6.674 -3.984
706 HD12 LEU 92 2HD1 LEU 92 1.270 -6.941 -5.711
707 HD13 LEU 92 3HD1 LEU 92 -0.021 -7.325 -4.571
708 HD21 LEU 92 3HD2 LEU 92 0.957 -3.213 -5.092
709 HD22 LEU 92 1HD2 LEU 92 1.892 -4.387 -6.019
710 HD23 LEU 92 2HD2 LEU 92 2.062 -4.307 -4.265
711 H TYR 93 H TYR 93 -2.730 -7.235 -3.876
712 HA TYR 93 HA TYR 93 -3.976 -4.946 -2.492
713 HB2 TYR 93 2HB TYR 93 -4.540 -7.912 -2.301
714 HB3 TYR 93 1HB TYR 93 -5.167 -6.740 -1.147
715 HD1 TYR 93 HD1 TYR 93 -5.228 -7.715 -4.732
716 HD2 TYR 93 HD2 TYR 93 -7.100 -5.451 -1.650
717 HE1 TYR 93 HE1 TYR 93 -7.142 -7.286 -6.211
718 HE2 TYR 93 HE2 TYR 93 -9.018 -5.021 -3.126
719 HH TYR 93 HH TYR 93 -9.479 -6.696 -6.071
720 H LEU 94 H LEU 94 -3.579 -4.670 -0.251
721 HA LEU 94 HA LEU 94 -1.065 -5.917 0.685
722 HB2 LEU 94 2HB LEU 94 -1.892 -3.049 1.161
723 HB3 LEU 94 1HB LEU 94 -0.344 -3.784 1.536
724 HG LEU 94 HG LEU 94 -1.418 -3.311 -1.255
725 HD11 LEU 94 1HD1 LEU 94 0.725 -1.849 0.289
726 HD12 LEU 94 2HD1 LEU 94 -0.862 -1.218 -0.154
727 HD13 LEU 94 3HD1 LEU 94 0.319 -1.590 -1.409
728 HD21 LEU 94 3HD2 LEU 94 1.278 -4.309 -0.327
729 HD22 LEU 94 1HD2 LEU 94 0.838 -3.927 -1.993
730 HD23 LEU 94 2HD2 LEU 94 0.045 -5.260 -1.155
731 H ARG 95 H ARG 95 -0.812 -6.199 2.949
732 HA ARG 95 HA ARG 95 -2.906 -5.199 4.714
733 HB2 ARG 95 2HB ARG 95 -3.061 -7.405 5.917
734 HB3 ARG 95 1HB ARG 95 -3.805 -7.358 4.328
735 HG2 ARG 95 2HG ARG 95 -1.909 -8.555 3.379
736 HG3 ARG 95 1HG ARG 95 -1.105 -8.548 4.952
737 HD2 ARG 95 2HD ARG 95 -2.764 -9.968 5.904
738 HD3 ARG 95 1HD ARG 95 -3.826 -9.775 4.509
739 HE ARG 95 HE ARG 95 -1.372 -10.931 3.715
740 HH11 ARG 95 1HH1 ARG 95 -4.266 -11.686 5.421
741 HH12 ARG 95 2HH1 ARG 95 -4.229 -13.353 4.962
742 HH21 ARG 95 1HH2 ARG 95 -1.345 -13.059 3.107
743 HH22 ARG 95 2HH2 ARG 95 -2.594 -14.120 3.661
744 H ALA 96 H ALA 96 -2.308 -5.484 7.065
745 HA ALA 96 HA ALA 96 0.278 -4.254 7.310
746 HB1 ALA 96 3HB ALA 96 -0.385 -3.836 9.636
747 HB2 ALA 96 1HB ALA 96 -1.814 -4.845 9.404
748 HB3 ALA 96 2HB ALA 96 -1.634 -3.343 8.493
749 H LYS 97 H LYS 97 2.035 -4.882 8.537
750 HA LYS 97 HA LYS 97 2.354 -7.719 9.086
751 HB2 LYS 97 2HB LYS 97 4.215 -6.621 8.046
752 HB3 LYS 97 1HB LYS 97 4.222 -5.351 9.259
753 HG2 LYS 97 2HG LYS 97 6.065 -6.809 9.688
754 HG3 LYS 97 1HG LYS 97 4.870 -7.048 10.960
755 HD2 LYS 97 2HD LYS 97 5.766 -9.187 10.247
756 HD3 LYS 97 1HD LYS 97 4.063 -9.071 9.793
757 HE2 LYS 97 2HE LYS 97 4.633 -8.622 7.511
758 HE3 LYS 97 1HE LYS 97 6.340 -8.442 7.915
759 HZ1 LYS 97 3HZ LYS 97 4.806 -10.966 8.205
760 HZ2 LYS 97 1HZ LYS 97 6.466 -10.758 8.437
761 HZ3 LYS 97 2HZ LYS 97 5.799 -10.593 6.894
762 H LEU 98 H LEU 98 1.475 -8.447 10.936
763 HA LEU 98 HA LEU 98 2.248 -7.096 13.445
764 HB2 LEU 98 2HB LEU 98 -0.433 -8.385 12.875
765 HB3 LEU 98 1HB LEU 98 0.080 -7.773 14.436
766 HG LEU 98 HG LEU 98 -0.306 -6.076 11.958
767 HD11 LEU 98 1HD1 LEU 98 -2.067 -6.343 14.398
768 HD12 LEU 98 2HD1 LEU 98 -2.426 -6.981 12.793
769 HD13 LEU 98 3HD1 LEU 98 -2.316 -5.239 13.042
770 HD21 LEU 98 3HD2 LEU 98 -0.113 -4.181 13.512
771 HD22 LEU 98 1HD2 LEU 98 1.363 -5.145 13.469
772 HD23 LEU 98 2HD2 LEU 98 0.249 -5.301 14.827
773 H GLU 99 H GLU 99 3.866 -8.492 14.031
774 HA GLU 99 HA GLU 99 3.124 -11.334 14.371
775 HB2 GLU 99 2HB GLU 99 5.350 -12.019 13.908
776 HB3 GLU 99 1HB GLU 99 4.913 -10.889 12.637
777 HG2 GLU 99 2HG GLU 99 6.505 -10.075 15.062
778 HG3 GLU 99 1HG GLU 99 7.250 -10.701 13.596
779 H HIS 100 H HIS 100 4.898 -12.347 16.012
780 HA HIS 100 HA HIS 100 4.401 -10.952 18.506
781 HB2 HIS 100 2HB HIS 100 5.484 -13.679 17.836
782 HB3 HIS 100 1HB HIS 100 5.572 -13.042 19.474
783 HD1 HIS 100 HD1 HIS 100 3.082 -14.189 16.894
784 HD2 HIS 100 HD2 HIS 100 3.193 -13.060 20.893
785 HE1 HIS 100 HE1 HIS 100 0.836 -14.804 17.832
786 HE2 HIS 100 HE2 HIS 100 0.992 -14.270 20.282
787 H HIS 101 H HIS 101 5.769 -9.187 18.635
788 HA HIS 101 HA HIS 101 8.649 -9.708 18.794
789 HB2 HIS 101 2HB HIS 101 7.067 -7.155 19.239
790 HB3 HIS 101 1HB HIS 101 8.815 -7.280 19.367
791 HD1 HIS 101 HD1 HIS 101 10.152 -7.539 17.146
792 HD2 HIS 101 HD2 HIS 101 6.066 -6.988 16.641
793 HE1 HIS 101 HE1 HIS 101 9.850 -6.957 14.727
794 HE2 HIS 101 HE2 HIS 101 7.354 -6.842 14.403
795 H HIS 102 H HIS 102 8.773 -11.111 20.563
796 HA HIS 102 HA HIS 102 7.230 -10.653 22.941
797 HB2 HIS 102 2HB HIS 102 7.843 -12.914 21.996
798 HB3 HIS 102 1HB HIS 102 9.478 -12.643 22.591
799 HD1 HIS 102 HD1 HIS 102 6.083 -12.180 24.275
800 HD2 HIS 102 HD2 HIS 102 9.712 -14.121 24.837
801 HE1 HIS 102 HE1 HIS 102 5.895 -13.328 26.495
802 HE2 HIS 102 HE2 HIS 102 8.021 -14.648 26.716
803 H HIS 103 H HIS 103 9.862 -9.030 21.959
804 HA HIS 103 HA HIS 103 10.738 -8.555 24.744
805 HB2 HIS 103 2HB HIS 103 12.365 -8.242 22.211
806 HB3 HIS 103 1HB HIS 103 12.910 -7.785 23.821
807 HD1 HIS 103 HD1 HIS 103 13.812 -10.191 21.653
808 HD2 HIS 103 HD2 HIS 103 12.198 -10.484 25.475
809 HE1 HIS 103 HE1 HIS 103 14.474 -12.462 22.492
810 HE2 HIS 103 HE2 HIS 103 13.329 -12.683 24.716
811 H HIS 104 H HIS 104 10.337 -6.983 21.555
812 HA HIS 104 HA HIS 104 9.610 -4.497 22.988
813 HB2 HIS 104 2HB HIS 104 11.033 -4.720 20.322
814 HB3 HIS 104 1HB HIS 104 10.490 -3.217 21.060
815 HD1 HIS 104 HD1 HIS 104 11.587 -2.901 23.621
816 HD2 HIS 104 HD2 HIS 104 13.637 -5.229 20.859
817 HE1 HIS 104 HE1 HIS 104 13.953 -2.993 24.444
818 HE2 HIS 104 HE2 HIS 104 15.203 -4.243 22.662
819 H HIS 105 H HIS 105 7.386 -5.092 22.939
820 HA HIS 105 HA HIS 105 6.132 -5.214 20.273
821 HB2 HIS 105 2HB HIS 105 5.577 -6.989 21.950
822 HB3 HIS 105 1HB HIS 105 4.864 -5.749 22.977
823 HD1 HIS 105 HD1 HIS 105 2.660 -4.604 22.062
824 HD2 HIS 105 HD2 HIS 105 3.957 -7.918 19.915
825 HE1 HIS 105 HE1 HIS 105 0.716 -5.277 20.630
826 HE2 HIS 105 HE2 HIS 105 1.478 -7.346 19.422
Start of MODEL 8
1 H1 MET 1 1H MET 1 46.191 16.144 9.818
2 H2 MET 1 2H MET 1 47.684 15.911 10.568
3 H3 MET 1 3H MET 1 46.777 17.294 10.913
4 HA MET 1 HA MET 1 45.049 15.953 11.919
5 HB2 MET 1 2HB MET 1 46.942 13.682 11.275
6 HB3 MET 1 1HB MET 1 45.610 13.539 12.415
7 HG2 MET 1 2HG MET 1 45.370 14.180 9.480
8 HG3 MET 1 1HG MET 1 45.023 12.628 10.244
9 HE1 MET 1 3HE MET 1 42.897 13.914 8.370
10 HE2 MET 1 1HE MET 1 41.425 13.762 9.327
11 HE3 MET 1 2HE MET 1 42.595 12.443 9.295
12 H ASP 2 H ASP 2 45.482 17.190 13.677
13 HA ASP 2 HA ASP 2 47.547 16.183 15.512
14 HB2 ASP 2 2HB ASP 2 47.949 18.604 16.192
15 HB3 ASP 2 1HB ASP 2 48.583 18.119 14.624
16 H GLN 3 H GLN 3 47.021 16.196 17.671
17 HA GLN 3 HA GLN 3 44.186 16.159 18.207
18 HB2 GLN 3 2HB GLN 3 46.549 15.570 20.009
19 HB3 GLN 3 1HB GLN 3 44.866 15.318 20.450
20 HG2 GLN 3 2HG GLN 3 45.714 13.207 19.828
21 HG3 GLN 3 1HG GLN 3 44.694 13.737 18.495
22 HE21 GLN 3 1HE2 GLN 3 47.965 13.132 19.535
23 HE22 GLN 3 2HE2 GLN 3 48.680 13.169 17.962
24 H LYS 4 H LYS 4 43.184 18.050 18.542
25 HA LYS 4 HA LYS 4 44.456 20.097 20.246
26 HB2 LYS 4 2HB LYS 4 42.060 20.343 18.408
27 HB3 LYS 4 1HB LYS 4 42.809 21.657 19.298
28 HG2 LYS 4 2HG LYS 4 44.205 20.057 17.154
29 HG3 LYS 4 1HG LYS 4 43.359 21.576 16.866
30 HD2 LYS 4 2HD LYS 4 45.544 22.303 17.102
31 HD3 LYS 4 1HD LYS 4 44.937 22.496 18.745
32 HE2 LYS 4 2HE LYS 4 45.984 20.419 19.415
33 HE3 LYS 4 1HE LYS 4 46.484 20.098 17.756
34 HZ1 LYS 4 3HZ LYS 4 47.407 22.358 19.439
35 HZ2 LYS 4 1HZ LYS 4 47.882 22.068 17.843
36 HZ3 LYS 4 2HZ LYS 4 48.300 20.976 19.065
37 H SER 5 H SER 5 42.538 21.491 21.329
38 HA SER 5 HA SER 5 41.221 19.830 23.251
39 HB2 SER 5 2HB SER 5 41.963 22.102 23.827
40 HB3 SER 5 1HB SER 5 40.846 22.779 22.645
41 HG SER 5 HG SER 5 39.360 22.691 24.109
42 H SER 6 H SER 6 38.935 19.569 23.555
43 HA SER 6 HA SER 6 37.571 18.733 21.279
44 HB2 SER 6 2HB SER 6 37.012 17.894 23.503
45 HB3 SER 6 1HB SER 6 36.405 19.482 23.974
46 HG SER 6 HG SER 6 34.848 17.784 23.191
47 H SER 7 H SER 7 36.664 19.836 19.665
48 HA SER 7 HA SER 7 35.632 22.551 20.092
49 HB2 SER 7 2HB SER 7 35.888 20.951 17.520
50 HB3 SER 7 1HB SER 7 35.415 22.647 17.638
51 HG SER 7 HG SER 7 37.560 22.821 18.808
52 HA PRO 8 HA PRO 8 31.534 20.871 20.628
53 HB2 PRO 8 2HB PRO 8 30.121 23.200 20.458
54 HB3 PRO 8 1HB PRO 8 31.048 22.727 21.886
55 HG2 PRO 8 2HG PRO 8 31.801 24.607 19.675
56 HG3 PRO 8 1HG PRO 8 32.041 24.783 21.425
57 HD2 PRO 8 2HD PRO 8 34.029 24.007 19.749
58 HD3 PRO 8 1HD PRO 8 33.923 23.437 21.427
59 H GLN 9 H GLN 9 31.439 19.674 18.688
60 HA GLN 9 HA GLN 9 30.609 19.018 16.689
61 HB2 GLN 9 2HB GLN 9 28.656 21.299 17.068
62 HB3 GLN 9 1HB GLN 9 28.451 19.923 15.990
63 HG2 GLN 9 2HG GLN 9 28.484 18.427 17.971
64 HG3 GLN 9 1HG GLN 9 28.548 19.854 19.003
65 HE21 GLN 9 1HE2 GLN 9 26.724 21.208 19.104
66 HE22 GLN 9 2HE2 GLN 9 25.161 20.649 18.627
67 HA PRO 10 HA PRO 10 32.762 22.103 14.012
68 HB2 PRO 10 2HB PRO 10 34.104 19.748 12.900
69 HB3 PRO 10 1HB PRO 10 34.812 21.165 13.678
70 HG2 PRO 10 2HG PRO 10 34.829 18.706 14.829
71 HG3 PRO 10 1HG PRO 10 34.766 20.208 15.773
72 HD2 PRO 10 2HD PRO 10 32.528 18.335 15.037
73 HD3 PRO 10 1HD PRO 10 32.864 19.133 16.591
74 H ALA 11 H ALA 11 32.281 22.525 11.844
75 HA ALA 11 HA ALA 11 30.010 21.221 10.728
76 HB1 ALA 11 3HB ALA 11 30.472 23.617 10.417
77 HB2 ALA 11 1HB ALA 11 30.258 22.785 8.877
78 HB3 ALA 11 2HB ALA 11 31.878 23.214 9.432
79 H ALA 12 H ALA 12 30.070 19.261 9.805
80 HA ALA 12 HA ALA 12 32.214 18.621 7.891
81 HB1 ALA 12 3HB ALA 12 32.466 16.387 8.790
82 HB2 ALA 12 1HB ALA 12 31.216 16.696 9.996
83 HB3 ALA 12 2HB ALA 12 32.745 17.569 10.069
84 H GLN 13 H GLN 13 31.539 16.304 6.871
85 HA GLN 13 HA GLN 13 29.057 16.835 5.496
86 HB2 GLN 13 2HB GLN 13 31.003 14.526 5.236
87 HB3 GLN 13 1HB GLN 13 29.635 14.815 4.169
88 HG2 GLN 13 2HG GLN 13 32.028 16.618 4.535
89 HG3 GLN 13 1HG GLN 13 31.708 15.569 3.156
90 HE21 GLN 13 1HE2 GLN 13 30.855 18.520 4.765
91 HE22 GLN 13 2HE2 GLN 13 29.885 19.173 3.492
92 H ALA 14 H ALA 14 27.319 15.305 5.261
93 HA ALA 14 HA ALA 14 26.740 13.877 7.764
94 HB1 ALA 14 3HB ALA 14 25.135 15.587 7.040
95 HB2 ALA 14 1HB ALA 14 24.398 13.986 7.062
96 HB3 ALA 14 2HB ALA 14 24.881 14.713 5.528
97 HA PRO 15 HA PRO 15 26.841 9.830 5.825
98 HB2 PRO 15 2HB PRO 15 24.749 8.560 7.026
99 HB3 PRO 15 1HB PRO 15 26.270 8.905 7.854
100 HG2 PRO 15 2HG PRO 15 23.684 10.425 7.948
101 HG3 PRO 15 1HG PRO 15 24.757 9.965 9.285
102 HD2 PRO 15 2HD PRO 15 24.771 12.447 8.229
103 HD3 PRO 15 1HD PRO 15 26.253 11.679 8.839
104 H GLU 16 H GLU 16 24.925 8.101 5.025
105 HA GLU 16 HA GLU 16 23.995 9.239 2.620
106 HB2 GLU 16 2HB GLU 16 22.893 7.106 2.190
107 HB3 GLU 16 1HB GLU 16 24.517 6.850 2.808
108 HG2 GLU 16 2HG GLU 16 22.218 6.802 4.719
109 HG3 GLU 16 1HG GLU 16 22.478 5.422 3.657
110 H THR 17 H THR 17 22.074 10.110 2.006
111 HA THR 17 HA THR 17 20.273 11.060 3.987
112 HB THR 17 HB THR 17 19.859 10.989 0.984
113 HG1 THR 17 HG1 THR 17 20.831 12.996 0.972
114 HG21 THR 17 3HG2 THR 17 18.562 12.695 3.127
115 HG22 THR 17 1HG2 THR 17 17.774 11.431 2.182
116 HG23 THR 17 2HG2 THR 17 18.342 12.899 1.389
117 H LYS 18 H LYS 18 19.274 9.436 5.109
118 HA LYS 18 HA LYS 18 17.478 7.643 3.589
119 HB2 LYS 18 2HB LYS 18 19.267 6.461 4.827
120 HB3 LYS 18 1HB LYS 18 18.708 7.199 6.324
121 HG2 LYS 18 2HG LYS 18 16.504 6.060 5.974
122 HG3 LYS 18 1HG LYS 18 17.230 5.212 4.606
123 HD2 LYS 18 2HD LYS 18 18.202 5.089 7.468
124 HD3 LYS 18 1HD LYS 18 17.244 3.852 6.658
125 HE2 LYS 18 2HE LYS 18 19.046 3.466 5.064
126 HE3 LYS 18 1HE LYS 18 20.003 4.748 5.803
127 HZ1 LYS 18 3HZ LYS 18 20.700 2.568 6.564
128 HZ2 LYS 18 1HZ LYS 18 19.143 2.239 7.142
129 HZ3 LYS 18 2HZ LYS 18 20.066 3.465 7.849
130 H GLN 19 H GLN 19 15.416 8.328 3.707
131 HA GLN 19 HA GLN 19 14.470 10.005 5.852
132 HB2 GLN 19 2HB GLN 19 13.016 8.734 3.519
133 HB3 GLN 19 1HB GLN 19 12.277 9.857 4.652
134 HG2 GLN 19 2HG GLN 19 14.593 10.466 2.822
135 HG3 GLN 19 1HG GLN 19 12.916 10.955 2.573
136 HE21 GLN 19 1HE2 GLN 19 12.043 12.567 3.891
137 HE22 GLN 19 2HE2 GLN 19 13.038 13.634 4.810
138 H ALA 20 H ALA 20 12.745 9.517 7.290
139 HA ALA 20 HA ALA 20 12.830 6.761 8.237
140 HB1 ALA 20 3HB ALA 20 13.185 8.550 9.850
141 HB2 ALA 20 1HB ALA 20 11.726 7.642 10.244
142 HB3 ALA 20 2HB ALA 20 11.599 9.226 9.476
143 H PHE 21 H PHE 21 11.145 5.367 8.267
144 HA PHE 21 HA PHE 21 8.767 5.978 6.715
145 HB2 PHE 21 2HB PHE 21 9.682 3.446 8.108
146 HB3 PHE 21 1HB PHE 21 8.203 3.569 7.164
147 HD1 PHE 21 HD1 PHE 21 8.484 4.362 4.696
148 HD2 PHE 21 HD2 PHE 21 11.642 2.764 7.071
149 HE1 PHE 21 HE1 PHE 21 9.724 3.772 2.653
150 HE2 PHE 21 HE2 PHE 21 12.883 2.181 5.031
151 HZ PHE 21 HZ PHE 21 11.926 2.681 2.822
152 HA PRO 22 HA PRO 22 6.564 6.688 10.654
153 HB2 PRO 22 2HB PRO 22 4.648 8.319 9.706
154 HB3 PRO 22 1HB PRO 22 6.297 8.899 9.977
155 HG2 PRO 22 2HG PRO 22 4.956 8.129 7.415
156 HG3 PRO 22 1HG PRO 22 6.079 9.462 7.738
157 HD2 PRO 22 2HD PRO 22 6.778 7.018 6.596
158 HD3 PRO 22 1HD PRO 22 7.910 8.140 7.375
159 H ARG 23 H ARG 23 5.731 4.610 10.950
160 HA ARG 23 HA ARG 23 3.863 3.524 9.024
161 HB2 ARG 23 2HB ARG 23 4.014 1.459 10.228
162 HB3 ARG 23 1HB ARG 23 5.630 2.125 10.048
163 HG2 ARG 23 2HG ARG 23 5.477 2.962 12.394
164 HG3 ARG 23 1HG ARG 23 3.933 2.117 12.544
165 HD2 ARG 23 2HD ARG 23 5.157 0.007 11.865
166 HD3 ARG 23 1HD ARG 23 6.658 0.917 12.036
167 HE ARG 23 HE ARG 23 4.794 0.627 14.296
168 HH11 ARG 23 1HH1 ARG 23 7.945 0.288 12.949
169 HH12 ARG 23 2HH1 ARG 23 8.634 -0.303 14.417
170 HH21 ARG 23 1HH2 ARG 23 5.685 -0.175 16.172
171 HH22 ARG 23 2HH2 ARG 23 7.370 -0.561 16.220
172 H LYS 24 H LYS 24 3.649 5.124 12.097
173 HA LYS 24 HA LYS 24 1.092 4.292 12.914
174 HB2 LYS 24 2HB LYS 24 2.487 6.949 13.287
175 HB3 LYS 24 1HB LYS 24 0.970 6.523 14.071
176 HG2 LYS 24 2HG LYS 24 2.148 4.574 15.118
177 HG3 LYS 24 1HG LYS 24 3.658 5.214 14.459
178 HD2 LYS 24 2HD LYS 24 3.390 7.263 15.725
179 HD3 LYS 24 1HD LYS 24 1.807 6.735 16.305
180 HE2 LYS 24 2HE LYS 24 2.945 4.793 17.396
181 HE3 LYS 24 1HE LYS 24 4.491 5.512 16.943
182 HZ1 LYS 24 3HZ LYS 24 3.813 6.043 19.222
183 HZ2 LYS 24 1HZ LYS 24 2.439 6.833 18.631
184 HZ3 LYS 24 2HZ LYS 24 3.982 7.430 18.271
185 H PHE 25 H PHE 25 2.069 6.404 10.343
186 HA PHE 25 HA PHE 25 -0.694 7.256 9.854
187 HB2 PHE 25 2HB PHE 25 1.887 8.041 8.476
188 HB3 PHE 25 1HB PHE 25 0.296 8.669 8.065
189 HD1 PHE 25 HD1 PHE 25 -0.896 10.161 9.611
190 HD2 PHE 25 HD2 PHE 25 3.065 8.816 10.424
191 HE1 PHE 25 HE1 PHE 25 -0.637 11.943 11.288
192 HE2 PHE 25 HE2 PHE 25 3.326 10.595 12.103
193 HZ PHE 25 HZ PHE 25 1.478 12.159 12.536
194 H VAL 26 H VAL 26 1.962 5.558 8.156
195 HA VAL 26 HA VAL 26 0.482 4.937 5.839
196 HB VAL 26 HB VAL 26 2.835 3.408 6.973
197 HG11 VAL 26 1HG1 VAL 26 1.694 3.494 4.173
198 HG12 VAL 26 2HG1 VAL 26 1.633 2.125 5.287
199 HG13 VAL 26 3HG1 VAL 26 3.181 2.674 4.650
200 HG21 VAL 26 3HG2 VAL 26 3.377 5.767 6.647
201 HG22 VAL 26 1HG2 VAL 26 2.765 5.696 4.994
202 HG23 VAL 26 2HG2 VAL 26 4.200 4.772 5.446
203 H LEU 27 H LEU 27 1.248 2.799 8.630
204 HA LEU 27 HA LEU 27 -0.377 0.654 7.765
205 HB2 LEU 27 2HB LEU 27 0.565 1.410 10.534
206 HB3 LEU 27 1HB LEU 27 -0.275 -0.086 10.168
207 HG LEU 27 HG LEU 27 2.410 0.738 9.037
208 HD11 LEU 27 1HD1 LEU 27 3.300 -1.082 10.423
209 HD12 LEU 27 2HD1 LEU 27 1.698 -1.332 11.116
210 HD13 LEU 27 3HD1 LEU 27 2.556 0.183 11.401
211 HD21 LEU 27 3HD2 LEU 27 2.496 -1.531 8.133
212 HD22 LEU 27 1HD2 LEU 27 1.129 -0.635 7.470
213 HD23 LEU 27 2HD2 LEU 27 0.866 -1.840 8.732
214 H ALA 28 H ALA 28 -1.097 3.512 9.699
215 HA ALA 28 HA ALA 28 -3.697 2.811 10.523
216 HB1 ALA 28 3HB ALA 28 -2.591 5.554 9.937
217 HB2 ALA 28 1HB ALA 28 -2.474 4.696 11.475
218 HB3 ALA 28 2HB ALA 28 -4.050 5.203 10.865
219 H ALA 29 H ALA 29 -2.573 4.541 7.617
220 HA ALA 29 HA ALA 29 -5.120 4.865 6.417
221 HB1 ALA 29 3HB ALA 29 -2.415 4.648 5.083
222 HB2 ALA 29 1HB ALA 29 -3.127 6.128 5.723
223 HB3 ALA 29 2HB ALA 29 -3.883 5.307 4.358
224 H LEU 30 H LEU 30 -2.687 2.329 6.242
225 HA LEU 30 HA LEU 30 -3.794 0.747 4.224
226 HB2 LEU 30 2HB LEU 30 -1.515 0.502 5.089
227 HB3 LEU 30 1HB LEU 30 -2.146 -0.070 6.620
228 HG LEU 30 HG LEU 30 -2.991 -2.099 5.553
229 HD11 LEU 30 1HD1 LEU 30 -2.507 -2.599 3.215
230 HD12 LEU 30 2HD1 LEU 30 -1.808 -0.992 3.002
231 HD13 LEU 30 3HD1 LEU 30 -3.528 -1.168 3.354
232 HD21 LEU 30 3HD2 LEU 30 -0.106 -1.516 4.866
233 HD22 LEU 30 1HD2 LEU 30 -0.833 -3.118 4.970
234 HD23 LEU 30 2HD2 LEU 30 -0.711 -2.112 6.411
235 H GLU 31 H GLU 31 -4.155 0.366 7.780
236 HA GLU 31 HA GLU 31 -5.932 -1.803 7.674
237 HB2 GLU 31 2HB GLU 31 -6.509 -1.257 9.999
238 HB3 GLU 31 1HB GLU 31 -4.772 -1.177 9.736
239 HG2 GLU 31 2HG GLU 31 -4.870 1.248 9.635
240 HG3 GLU 31 1HG GLU 31 -6.623 1.203 9.810
241 H GLN 32 H GLN 32 -6.578 1.690 7.711
242 HA GLN 32 HA GLN 32 -9.414 1.450 7.770
243 HB2 GLN 32 2HB GLN 32 -7.645 3.732 6.863
244 HB3 GLN 32 1HB GLN 32 -9.390 3.846 7.049
245 HG2 GLN 32 2HG GLN 32 -9.172 3.342 9.435
246 HG3 GLN 32 1HG GLN 32 -7.424 3.218 9.250
247 HE21 GLN 32 1HE2 GLN 32 -6.224 5.109 8.889
248 HE22 GLN 32 2HE2 GLN 32 -6.872 6.677 9.223
249 H SER 33 H SER 33 -7.059 1.352 5.198
250 HA SER 33 HA SER 33 -9.070 1.513 3.095
251 HB2 SER 33 2HB SER 33 -6.838 2.463 2.686
252 HB3 SER 33 1HB SER 33 -6.106 0.883 2.944
253 HG SER 33 HG SER 33 -7.600 0.226 1.133
254 H SER 34 H SER 34 -7.880 -0.882 5.145
255 HA SER 34 HA SER 34 -8.113 -3.112 3.320
256 HB2 SER 34 2HB SER 34 -7.780 -3.035 6.334
257 HB3 SER 34 1HB SER 34 -7.779 -4.510 5.370
258 HG SER 34 HG SER 34 -6.005 -2.385 4.805
259 H ASP 35 H ASP 35 -9.914 -4.164 2.818
260 HA ASP 35 HA ASP 35 -12.449 -3.507 3.961
261 HB2 ASP 35 2HB ASP 35 -11.608 -5.714 2.063
262 HB3 ASP 35 1HB ASP 35 -13.281 -5.351 2.481
263 H ASP 36 H ASP 36 -13.929 -5.632 4.414
264 HA ASP 36 HA ASP 36 -13.369 -6.457 6.990
265 HB2 ASP 36 2HB ASP 36 -15.597 -6.569 5.992
266 HB3 ASP 36 1HB ASP 36 -15.073 -7.864 4.920
267 H ALA 37 H ALA 37 -12.299 -7.941 3.995
268 HA ALA 37 HA ALA 37 -11.604 -10.474 5.156
269 HB1 ALA 37 3HB ALA 37 -10.612 -10.974 2.983
270 HB2 ALA 37 1HB ALA 37 -10.782 -9.286 2.503
271 HB3 ALA 37 2HB ALA 37 -12.218 -10.270 2.795
272 H GLY 38 H GLY 38 -10.172 -7.525 5.559
273 HA2 GLY 38 2HA GLY 38 -8.184 -6.991 6.627
274 HA3 GLY 38 1HA GLY 38 -7.742 -8.690 6.581
275 H TRP 39 H TRP 39 -8.627 -6.973 3.678
276 HA TRP 39 HA TRP 39 -5.799 -6.745 2.885
277 HB2 TRP 39 2HB TRP 39 -8.036 -7.997 1.276
278 HB3 TRP 39 1HB TRP 39 -6.503 -7.497 0.567
279 HD1 TRP 39 HD1 TRP 39 -8.094 -10.301 2.538
280 HE1 TRP 39 HE1 TRP 39 -6.364 -12.170 2.900
281 HE3 TRP 39 HE3 TRP 39 -3.896 -7.852 0.940
282 HZ2 TRP 39 HZ2 TRP 39 -3.597 -12.559 2.555
283 HZ3 TRP 39 HZ3 TRP 39 -1.741 -9.045 0.989
284 HH2 TRP 39 HH2 TRP 39 -1.599 -11.353 1.782
285 H ALA 40 H ALA 40 -5.274 -4.965 1.725
286 HA ALA 40 HA ALA 40 -7.452 -3.111 0.975
287 HB1 ALA 40 3HB ALA 40 -5.885 -1.283 1.355
288 HB2 ALA 40 1HB ALA 40 -4.614 -2.437 1.766
289 HB3 ALA 40 2HB ALA 40 -6.032 -2.282 2.802
290 H ASN 41 H ASN 41 -7.693 -2.799 -1.170
291 HA ASN 41 HA ASN 41 -5.915 -3.790 -3.134
292 HB2 ASN 41 2HB ASN 41 -8.339 -3.361 -3.512
293 HB3 ASN 41 1HB ASN 41 -8.032 -1.633 -3.432
294 HD21 ASN 41 1HD2 ASN 41 -9.159 -3.176 -5.585
295 HD22 ASN 41 2HD2 ASN 41 -8.142 -2.928 -6.958
296 H LEU 42 H LEU 42 -4.145 -2.900 -4.100
297 HA LEU 42 HA LEU 42 -2.648 -0.861 -3.064
298 HB2 LEU 42 2HB LEU 42 -1.820 -2.457 -4.721
299 HB3 LEU 42 1HB LEU 42 -2.797 -1.701 -5.965
300 HG LEU 42 HG LEU 42 -1.462 0.387 -5.696
301 HD11 LEU 42 1HD1 LEU 42 -0.723 0.069 -3.389
302 HD12 LEU 42 2HD1 LEU 42 0.651 0.307 -4.466
303 HD13 LEU 42 3HD1 LEU 42 0.259 -1.312 -3.883
304 HD21 LEU 42 3HD2 LEU 42 0.513 -0.432 -6.854
305 HD22 LEU 42 1HD2 LEU 42 -0.930 -1.256 -7.440
306 HD23 LEU 42 2HD2 LEU 42 0.165 -2.079 -6.327
307 H GLY 43 H GLY 43 -5.145 -0.569 -5.567
308 HA2 GLY 43 2HA GLY 43 -4.776 2.152 -6.217
309 HA3 GLY 43 1HA GLY 43 -6.267 1.247 -6.421
310 H ASN 44 H ASN 44 -6.656 0.627 -3.640
311 HA ASN 44 HA ASN 44 -7.843 3.100 -2.748
312 HB2 ASN 44 2HB ASN 44 -7.657 0.419 -1.346
313 HB3 ASN 44 1HB ASN 44 -8.662 1.772 -0.835
314 HD21 ASN 44 1HD2 ASN 44 -9.530 -0.869 -1.478
315 HD22 ASN 44 2HD2 ASN 44 -10.614 -0.733 -2.816
316 H PHE 45 H PHE 45 -5.162 1.041 -1.703
317 HA PHE 45 HA PHE 45 -4.470 2.385 0.651
318 HB2 PHE 45 2HB PHE 45 -3.571 0.189 0.110
319 HB3 PHE 45 1HB PHE 45 -2.719 0.846 -1.283
320 HD1 PHE 45 HD1 PHE 45 -2.988 1.615 2.376
321 HD2 PHE 45 HD2 PHE 45 -0.443 1.078 -1.000
322 HE1 PHE 45 HE1 PHE 45 -1.020 2.025 3.793
323 HE2 PHE 45 HE2 PHE 45 1.528 1.485 0.419
324 HZ PHE 45 HZ PHE 45 1.237 1.960 2.817
325 H GLY 46 H GLY 46 -3.031 2.775 -2.614
326 HA2 GLY 46 2HA GLY 46 -1.318 4.911 -1.997
327 HA3 GLY 46 1HA GLY 46 -1.963 4.564 -3.594
328 H ASN 47 H ASN 47 -4.744 4.885 -2.605
329 HA ASN 47 HA ASN 47 -5.035 7.704 -3.050
330 HB2 ASN 47 2HB ASN 47 -6.649 5.955 -3.847
331 HB3 ASN 47 1HB ASN 47 -7.124 5.681 -2.176
332 HD21 ASN 47 1HD2 ASN 47 -8.734 6.547 -4.418
333 HD22 ASN 47 2HD2 ASN 47 -9.406 8.075 -3.967
334 H TYR 48 H TYR 48 -6.164 5.652 -0.335
335 HA TYR 48 HA TYR 48 -6.836 7.835 1.316
336 HB2 TYR 48 2HB TYR 48 -7.700 5.438 1.459
337 HB3 TYR 48 1HB TYR 48 -6.213 5.055 2.319
338 HD1 TYR 48 HD2 TYR 48 -9.208 7.265 2.433
339 HD2 TYR 48 HD1 TYR 48 -6.067 5.427 4.644
340 HE1 TYR 48 HE2 TYR 48 -10.262 7.996 4.527
341 HE2 TYR 48 HE1 TYR 48 -7.113 6.161 6.744
342 HH TYR 48 HH TYR 48 -8.667 7.834 7.553
343 H LEU 49 H LEU 49 -3.870 5.930 1.065
344 HA LEU 49 HA LEU 49 -2.559 6.829 3.372
345 HB2 LEU 49 2HB LEU 49 -1.655 5.011 2.073
346 HB3 LEU 49 1HB LEU 49 -1.437 6.052 0.678
347 HG LEU 49 HG LEU 49 0.298 7.321 1.887
348 HD11 LEU 49 1HD1 LEU 49 1.180 6.480 4.016
349 HD12 LEU 49 2HD1 LEU 49 -0.137 5.310 4.094
350 HD13 LEU 49 3HD1 LEU 49 -0.487 7.038 4.161
351 HD21 LEU 49 3HD2 LEU 49 0.968 5.444 0.487
352 HD22 LEU 49 1HD2 LEU 49 0.779 4.339 1.848
353 HD23 LEU 49 2HD2 LEU 49 2.027 5.585 1.891
354 H ASN 50 H ASN 50 -2.482 8.217 0.079
355 HA ASN 50 HA ASN 50 -0.732 10.344 0.779
356 HB2 ASN 50 2HB ASN 50 -1.046 9.459 -1.535
357 HB3 ASN 50 1HB ASN 50 -2.633 10.222 -1.574
358 HD21 ASN 50 1HD2 ASN 50 0.805 10.788 -1.433
359 HD22 ASN 50 2HD2 ASN 50 0.747 12.427 -1.966
360 H LYS 51 H LYS 51 -4.175 9.945 1.089
361 HA LYS 51 HA LYS 51 -4.877 12.682 1.407
362 HB2 LYS 51 2HB LYS 51 -6.172 10.235 2.647
363 HB3 LYS 51 1HB LYS 51 -6.886 11.841 2.563
364 HG2 LYS 51 2HG LYS 51 -6.918 11.705 0.120
365 HG3 LYS 51 1HG LYS 51 -6.190 10.098 0.198
366 HD2 LYS 51 2HD LYS 51 -8.555 9.831 -0.119
367 HD3 LYS 51 1HD LYS 51 -8.167 9.345 1.533
368 HE2 LYS 51 2HE LYS 51 -10.165 10.660 1.599
369 HE3 LYS 51 1HE LYS 51 -8.863 11.624 2.291
370 HZ1 LYS 51 3HZ LYS 51 -10.196 12.955 0.813
371 HZ2 LYS 51 1HZ LYS 51 -9.955 11.870 -0.459
372 HZ3 LYS 51 2HZ LYS 51 -8.657 12.762 0.143
373 H LEU 52 H LEU 52 -3.633 10.231 3.619
374 HA LEU 52 HA LEU 52 -3.779 12.033 5.907
375 HB2 LEU 52 2HB LEU 52 -2.591 9.260 5.719
376 HB3 LEU 52 1HB LEU 52 -2.908 10.157 7.192
377 HG LEU 52 HG LEU 52 -4.966 9.032 5.283
378 HD11 LEU 52 1HD1 LEU 52 -5.622 7.659 7.197
379 HD12 LEU 52 2HD1 LEU 52 -4.326 8.371 8.160
380 HD13 LEU 52 3HD1 LEU 52 -3.939 7.377 6.755
381 HD21 LEU 52 3HD2 LEU 52 -6.658 9.891 6.824
382 HD22 LEU 52 1HD2 LEU 52 -5.711 11.203 6.124
383 HD23 LEU 52 2HD2 LEU 52 -5.400 10.677 7.778
384 H GLN 53 H GLN 53 -1.375 10.750 3.699
385 HA GLN 53 HA GLN 53 0.649 12.536 4.872
386 HB2 GLN 53 2HB GLN 53 1.011 9.642 4.087
387 HB3 GLN 53 1HB GLN 53 2.366 10.742 4.282
388 HG2 GLN 53 2HG GLN 53 0.365 10.151 6.452
389 HG3 GLN 53 1HG GLN 53 1.885 9.280 6.249
390 HE21 GLN 53 1HE2 GLN 53 0.411 12.286 7.152
391 HE22 GLN 53 2HE2 GLN 53 1.817 12.994 7.863
392 HA PRO 54 HA PRO 54 0.705 13.342 0.311
393 HB2 PRO 54 2HB PRO 54 0.793 16.057 0.558
394 HB3 PRO 54 1HB PRO 54 -0.724 15.151 0.472
395 HG2 PRO 54 2HG PRO 54 0.694 16.257 2.867
396 HG3 PRO 54 1HG PRO 54 -1.039 16.254 2.493
397 HD2 PRO 54 2HD PRO 54 0.116 14.479 4.214
398 HD3 PRO 54 1HD PRO 54 -1.326 14.093 3.251
399 H ASP 55 H ASP 55 2.454 14.285 3.152
400 HA ASP 55 HA ASP 55 4.825 15.262 1.904
401 HB2 ASP 55 2HB ASP 55 4.122 15.799 4.230
402 HB3 ASP 55 1HB ASP 55 4.412 14.125 4.687
403 H PHE 56 H PHE 56 3.547 12.118 2.401
404 HA PHE 56 HA PHE 56 6.099 10.733 2.475
405 HB2 PHE 56 2HB PHE 56 4.125 9.916 3.753
406 HB3 PHE 56 1HB PHE 56 3.288 9.614 2.236
407 HD1 PHE 56 HD1 PHE 56 6.249 8.633 4.247
408 HD2 PHE 56 HD2 PHE 56 3.601 7.578 1.076
409 HE1 PHE 56 HE1 PHE 56 7.223 6.375 4.187
410 HE2 PHE 56 HE2 PHE 56 4.573 5.317 1.017
411 HZ PHE 56 HZ PHE 56 6.385 4.716 2.572
412 H ASP 57 H ASP 57 7.224 10.636 0.634
413 HA ASP 57 HA ASP 57 5.829 9.917 -1.864
414 HB2 ASP 57 2HB ASP 57 6.489 12.294 -1.905
415 HB3 ASP 57 1HB ASP 57 8.158 11.835 -1.575
416 H SER 58 H SER 58 6.858 8.437 -3.211
417 HA SER 58 HA SER 58 8.590 6.581 -1.898
418 HB2 SER 58 2HB SER 58 6.886 5.820 -3.480
419 HB3 SER 58 1HB SER 58 7.690 6.686 -4.790
420 HG SER 58 HG SER 58 8.112 4.240 -4.145
421 H ARG 59 H ARG 59 9.130 9.079 -4.337
422 HA ARG 59 HA ARG 59 11.629 8.183 -5.291
423 HB2 ARG 59 2HB ARG 59 10.674 11.050 -5.106
424 HB3 ARG 59 1HB ARG 59 11.934 10.436 -6.168
425 HG2 ARG 59 2HG ARG 59 8.999 9.748 -6.297
426 HG3 ARG 59 1HG ARG 59 9.879 10.805 -7.401
427 HD2 ARG 59 2HD ARG 59 11.312 8.853 -8.014
428 HD3 ARG 59 1HD ARG 59 10.273 7.833 -7.022
429 HE ARG 59 HE ARG 59 8.464 8.840 -8.624
430 HH11 ARG 59 1HH1 ARG 59 11.641 7.780 -9.437
431 HH12 ARG 59 2HH1 ARG 59 11.191 7.337 -11.046
432 HH21 ARG 59 1HH2 ARG 59 7.916 8.283 -10.696
433 HH22 ARG 59 2HH2 ARG 59 9.118 7.632 -11.754
434 H LEU 60 H LEU 60 10.753 9.985 -2.432
435 HA LEU 60 HA LEU 60 13.243 11.018 -1.670
436 HB2 LEU 60 2HB LEU 60 11.067 9.960 0.148
437 HB3 LEU 60 1HB LEU 60 12.344 11.072 0.604
438 HG LEU 60 HG LEU 60 10.124 11.668 -1.361
439 HD11 LEU 60 1HD1 LEU 60 10.560 12.596 1.476
440 HD12 LEU 60 2HD1 LEU 60 9.276 11.535 0.896
441 HD13 LEU 60 3HD1 LEU 60 9.327 13.219 0.377
442 HD21 LEU 60 3HD2 LEU 60 12.172 12.860 -1.928
443 HD22 LEU 60 1HD2 LEU 60 12.301 13.455 -0.271
444 HD23 LEU 60 2HD2 LEU 60 10.958 13.969 -1.295
445 H TYR 61 H TYR 61 12.010 7.765 -1.521
446 HA TYR 61 HA TYR 61 14.256 6.855 0.137
447 HB2 TYR 61 2HB TYR 61 11.834 5.316 -0.829
448 HB3 TYR 61 1HB TYR 61 13.022 4.759 0.345
449 HD1 TYR 61 HD2 TYR 61 13.043 5.664 2.627
450 HD2 TYR 61 HD1 TYR 61 10.147 6.960 -0.213
451 HE1 TYR 61 HE2 TYR 61 11.722 6.674 4.437
452 HE2 TYR 61 HE1 TYR 61 8.829 7.976 1.595
453 HH TYR 61 HH TYR 61 8.549 7.653 4.074
454 H GLY 62 H GLY 62 13.714 7.363 -3.065
455 HA2 GLY 62 2HA GLY 62 15.319 6.890 -4.723
456 HA3 GLY 62 1HA GLY 62 15.872 5.520 -3.780
457 H TYR 63 H TYR 63 12.544 5.320 -3.919
458 HA TYR 63 HA TYR 63 12.724 3.198 -5.911
459 HB2 TYR 63 2HB TYR 63 10.581 3.990 -3.943
460 HB3 TYR 63 1HB TYR 63 10.330 2.742 -5.160
461 HD1 TYR 63 HD1 TYR 63 12.454 3.664 -2.241
462 HD2 TYR 63 HD2 TYR 63 11.106 0.557 -4.823
463 HE1 TYR 63 HE1 TYR 63 13.483 1.990 -0.760
464 HE2 TYR 63 HE2 TYR 63 12.123 -1.117 -3.355
465 HH TYR 63 HH TYR 63 13.916 -1.252 -1.679
466 H LYS 64 H LYS 64 10.831 2.888 -7.422
467 HA LYS 64 HA LYS 64 10.556 5.329 -8.991
468 HB2 LYS 64 2HB LYS 64 9.616 2.534 -9.679
469 HB3 LYS 64 1HB LYS 64 9.778 3.894 -10.780
470 HG2 LYS 64 2HG LYS 64 12.267 3.861 -10.172
471 HG3 LYS 64 1HG LYS 64 11.943 2.273 -9.479
472 HD2 LYS 64 2HD LYS 64 12.747 2.002 -11.743
473 HD3 LYS 64 1HD LYS 64 11.043 1.542 -11.680
474 HE2 LYS 64 2HE LYS 64 11.539 2.890 -13.667
475 HE3 LYS 64 1HE LYS 64 10.410 3.718 -12.595
476 HZ1 LYS 64 3HZ LYS 64 13.324 4.249 -12.815
477 HZ2 LYS 64 1HZ LYS 64 12.272 5.024 -11.741
478 HZ3 LYS 64 2HZ LYS 64 12.084 5.231 -13.406
479 H LYS 65 H LYS 65 8.527 3.201 -7.087
480 HA LYS 65 HA LYS 65 6.318 5.061 -7.251
481 HB2 LYS 65 2HB LYS 65 4.671 3.424 -8.068
482 HB3 LYS 65 1HB LYS 65 5.929 3.714 -9.264
483 HG2 LYS 65 2HG LYS 65 7.042 1.617 -8.548
484 HG3 LYS 65 1HG LYS 65 5.708 1.324 -7.434
485 HD2 LYS 65 2HD LYS 65 5.327 0.025 -9.418
486 HD3 LYS 65 1HD LYS 65 4.150 1.339 -9.390
487 HE2 LYS 65 2HE LYS 65 5.479 2.593 -10.996
488 HE3 LYS 65 1HE LYS 65 6.727 1.348 -10.968
489 HZ1 LYS 65 3HZ LYS 65 5.332 1.090 -12.895
490 HZ2 LYS 65 1HZ LYS 65 3.938 1.009 -11.936
491 HZ3 LYS 65 2HZ LYS 65 5.094 -0.223 -11.857
492 H LEU 66 H LEU 66 4.340 4.015 -5.953
493 HA LEU 66 HA LEU 66 5.362 3.613 -3.330
494 HB2 LEU 66 2HB LEU 66 3.260 4.791 -3.741
495 HB3 LEU 66 1HB LEU 66 2.540 3.321 -4.372
496 HG LEU 66 HG LEU 66 2.726 2.269 -2.149
497 HD11 LEU 66 1HD1 LEU 66 4.678 3.419 -1.294
498 HD12 LEU 66 2HD1 LEU 66 3.319 3.639 -0.192
499 HD13 LEU 66 3HD1 LEU 66 3.802 4.950 -1.271
500 HD21 LEU 66 3HD2 LEU 66 0.674 3.459 -2.758
501 HD22 LEU 66 1HD2 LEU 66 1.336 4.952 -2.089
502 HD23 LEU 66 2HD2 LEU 66 1.000 3.584 -1.030
503 H SER 67 H SER 67 3.564 1.415 -5.512
504 HA SER 67 HA SER 67 3.476 -0.850 -3.892
505 HB2 SER 67 2HB SER 67 3.300 -2.160 -5.979
506 HB3 SER 67 1HB SER 67 2.315 -0.700 -6.057
507 HG SER 67 HG SER 67 4.085 -1.438 -7.795
508 H ASP 68 H ASP 68 6.046 0.179 -6.097
509 HA ASP 68 HA ASP 68 7.838 -1.925 -5.862
510 HB2 ASP 68 2HB ASP 68 7.994 0.080 -7.392
511 HB3 ASP 68 1HB ASP 68 8.562 1.015 -6.015
512 H LEU 69 H LEU 69 7.576 0.979 -3.821
513 HA LEU 69 HA LEU 69 9.581 0.351 -1.953
514 HB2 LEU 69 2HB LEU 69 8.619 2.577 -2.147
515 HB3 LEU 69 1HB LEU 69 7.046 1.972 -1.661
516 HG LEU 69 HG LEU 69 8.021 1.407 0.580
517 HD11 LEU 69 1HD1 LEU 69 10.150 2.403 1.221
518 HD12 LEU 69 2HD1 LEU 69 10.396 2.968 -0.431
519 HD13 LEU 69 3HD1 LEU 69 10.361 1.238 -0.086
520 HD21 LEU 69 3HD2 LEU 69 6.732 3.442 0.274
521 HD22 LEU 69 1HD2 LEU 69 8.173 4.303 -0.276
522 HD23 LEU 69 2HD2 LEU 69 8.068 3.729 1.388
523 H VAL 70 H VAL 70 6.073 -0.237 -1.841
524 HA VAL 70 HA VAL 70 5.910 -1.334 0.711
525 HB VAL 70 HB VAL 70 4.179 -1.966 -1.691
526 HG11 VAL 70 1HG1 VAL 70 3.607 -2.349 1.254
527 HG12 VAL 70 2HG1 VAL 70 3.890 -3.632 0.079
528 HG13 VAL 70 3HG1 VAL 70 2.461 -2.608 -0.062
529 HG21 VAL 70 3HG2 VAL 70 4.269 0.425 -1.187
530 HG22 VAL 70 1HG2 VAL 70 3.841 0.100 0.492
531 HG23 VAL 70 2HG2 VAL 70 2.682 -0.237 -0.795
532 H LYS 71 H LYS 71 6.262 -3.102 -2.396
533 HA LYS 71 HA LYS 71 6.320 -5.651 -1.112
534 HB2 LYS 71 2HB LYS 71 6.933 -6.563 -3.293
535 HB3 LYS 71 1HB LYS 71 5.579 -5.452 -3.420
536 HG2 LYS 71 2HG LYS 71 7.114 -3.704 -4.241
537 HG3 LYS 71 1HG LYS 71 8.449 -4.857 -4.149
538 HD2 LYS 71 2HD LYS 71 5.973 -5.160 -5.862
539 HD3 LYS 71 1HD LYS 71 7.567 -4.668 -6.437
540 HE2 LYS 71 2HE LYS 71 8.489 -6.829 -5.754
541 HE3 LYS 71 1HE LYS 71 6.916 -7.319 -5.131
542 HZ1 LYS 71 3HZ LYS 71 6.019 -7.245 -7.340
543 HZ2 LYS 71 1HZ LYS 71 7.395 -8.225 -7.340
544 HZ3 LYS 71 2HZ LYS 71 7.472 -6.658 -7.970
545 H ALA 72 H ALA 72 8.766 -3.285 -1.754
546 HA ALA 72 HA ALA 72 10.970 -5.121 -1.259
547 HB1 ALA 72 3HB ALA 72 11.256 -3.215 -2.780
548 HB2 ALA 72 1HB ALA 72 12.396 -3.159 -1.436
549 HB3 ALA 72 2HB ALA 72 10.981 -2.106 -1.438
550 H ARG 73 H ARG 73 8.840 -3.156 0.589
551 HA ARG 73 HA ARG 73 10.532 -3.444 2.991
552 HB2 ARG 73 2HB ARG 73 8.277 -1.502 2.429
553 HB3 ARG 73 1HB ARG 73 9.119 -1.631 3.966
554 HG2 ARG 73 2HG ARG 73 10.318 -0.802 1.326
555 HG3 ARG 73 1HG ARG 73 9.981 0.242 2.707
556 HD2 ARG 73 2HD ARG 73 11.972 -2.030 2.609
557 HD3 ARG 73 1HD ARG 73 12.349 -0.308 2.621
558 HE ARG 73 HE ARG 73 10.933 -0.644 4.896
559 HH11 ARG 73 1HH1 ARG 73 13.685 -2.278 3.594
560 HH12 ARG 73 2HH1 ARG 73 14.343 -2.622 5.156
561 HH21 ARG 73 1HH2 ARG 73 11.795 -1.138 6.890
562 HH22 ARG 73 2HH2 ARG 73 13.285 -2.003 6.987
563 H THR 74 H THR 74 9.157 -5.704 2.150
564 HA THR 74 HA THR 74 6.648 -6.086 3.383
565 HB THR 74 HB THR 74 7.219 -8.542 3.378
566 HG1 THR 74 HG1 THR 74 9.286 -8.977 3.319
567 HG21 THR 74 3HG2 THR 74 7.263 -8.747 0.928
568 HG22 THR 74 1HG2 THR 74 7.708 -7.044 0.794
569 HG23 THR 74 2HG2 THR 74 6.133 -7.496 1.448
570 H ASP 75 H ASP 75 9.688 -5.621 4.775
571 HA ASP 75 HA ASP 75 9.553 -6.859 7.246
572 HB2 ASP 75 2HB ASP 75 11.470 -5.567 6.472
573 HB3 ASP 75 1HB ASP 75 10.525 -4.085 6.513
574 H LEU 76 H LEU 76 7.721 -4.148 6.014
575 HA LEU 76 HA LEU 76 6.332 -3.836 8.605
576 HB2 LEU 76 2HB LEU 76 6.613 -1.904 6.294
577 HB3 LEU 76 1HB LEU 76 5.616 -1.616 7.707
578 HG LEU 76 HG LEU 76 8.617 -1.996 7.807
579 HD11 LEU 76 1HD1 LEU 76 6.994 0.551 7.881
580 HD12 LEU 76 2HD1 LEU 76 8.065 0.034 6.577
581 HD13 LEU 76 3HD1 LEU 76 8.732 0.427 8.161
582 HD21 LEU 76 3HD2 LEU 76 7.475 -2.596 9.880
583 HD22 LEU 76 1HD2 LEU 76 6.636 -1.043 9.882
584 HD23 LEU 76 2HD2 LEU 76 8.388 -1.101 10.081
585 H PHE 77 H PHE 77 5.912 -4.534 5.192
586 HA PHE 77 HA PHE 77 2.973 -4.588 5.550
587 HB2 PHE 77 2HB PHE 77 4.431 -4.013 2.956
588 HB3 PHE 77 1HB PHE 77 2.704 -3.865 3.265
589 HD1 PHE 77 HD1 PHE 77 2.358 -2.328 5.583
590 HD2 PHE 77 HD2 PHE 77 5.442 -1.961 2.661
591 HE1 PHE 77 HE1 PHE 77 2.685 0.023 6.216
592 HE2 PHE 77 HE2 PHE 77 5.768 0.391 3.303
593 HZ PHE 77 HZ PHE 77 4.392 1.380 5.083
594 H VAL 78 H VAL 78 1.796 -6.134 4.245
595 HA VAL 78 HA VAL 78 3.384 -8.456 3.330
596 HB VAL 78 HB VAL 78 0.525 -8.460 4.350
597 HG11 VAL 78 1HG1 VAL 78 2.305 -10.749 3.496
598 HG12 VAL 78 2HG1 VAL 78 0.858 -10.175 2.668
599 HG13 VAL 78 3HG1 VAL 78 0.725 -10.916 4.262
600 HG21 VAL 78 3HG2 VAL 78 2.108 -8.078 6.168
601 HG22 VAL 78 1HG2 VAL 78 3.048 -9.483 5.668
602 HG23 VAL 78 2HG2 VAL 78 1.408 -9.692 6.285
603 H THR 79 H THR 79 3.256 -8.900 1.192
604 HA THR 79 HA THR 79 1.241 -7.412 -0.389
605 HB THR 79 HB THR 79 2.886 -7.235 -2.182
606 HG1 THR 79 HG1 THR 79 5.107 -7.908 -1.646
607 HG21 THR 79 3HG2 THR 79 4.498 -5.728 -1.109
608 HG22 THR 79 1HG2 THR 79 4.035 -6.350 0.477
609 HG23 THR 79 2HG2 THR 79 2.867 -5.455 -0.500
610 H GLU 80 H GLU 80 -0.084 -8.554 -1.670
611 HA GLU 80 HA GLU 80 0.944 -10.906 -3.071
612 HB2 GLU 80 2HB GLU 80 -1.564 -10.957 -1.380
613 HB3 GLU 80 1HB GLU 80 -1.249 -12.126 -2.652
614 HG2 GLU 80 2HG GLU 80 0.881 -12.717 -1.443
615 HG3 GLU 80 1HG GLU 80 0.309 -11.716 -0.110
616 H GLU 81 H GLU 81 0.406 -10.846 -5.176
617 HA GLU 81 HA GLU 81 -1.560 -8.905 -6.108
618 HB2 GLU 81 2HB GLU 81 0.337 -10.742 -7.595
619 HB3 GLU 81 1HB GLU 81 -0.768 -9.622 -8.383
620 HG2 GLU 81 2HG GLU 81 0.344 -7.733 -7.386
621 HG3 GLU 81 1HG GLU 81 1.374 -8.797 -6.430
622 H ARG 82 H ARG 82 -3.632 -9.458 -6.266
623 HA ARG 82 HA ARG 82 -4.344 -12.313 -6.620
624 HB2 ARG 82 2HB ARG 82 -5.977 -10.201 -5.189
625 HB3 ARG 82 1HB ARG 82 -6.226 -11.943 -5.168
626 HG2 ARG 82 2HG ARG 82 -3.804 -10.566 -4.009
627 HG3 ARG 82 1HG ARG 82 -5.236 -11.004 -3.079
628 HD2 ARG 82 2HD ARG 82 -3.609 -13.011 -4.641
629 HD3 ARG 82 1HD ARG 82 -3.287 -12.613 -2.951
630 HE ARG 82 HE ARG 82 -5.884 -13.672 -3.853
631 HH11 ARG 82 1HH1 ARG 82 -3.177 -13.770 -1.713
632 HH12 ARG 82 2HH1 ARG 82 -3.924 -14.919 -0.666
633 HH21 ARG 82 1HH2 ARG 82 -6.804 -15.165 -2.505
634 HH22 ARG 82 2HH2 ARG 82 -5.939 -15.706 -1.109
635 H GLN 83 H GLN 83 -5.941 -12.816 -8.143
636 HA GLN 83 HA GLN 83 -6.511 -10.771 -10.104
637 HB2 GLN 83 2HB GLN 83 -5.991 -13.160 -10.678
638 HB3 GLN 83 1HB GLN 83 -7.557 -13.610 -10.018
639 HG2 GLN 83 2HG GLN 83 -8.696 -12.312 -11.698
640 HG3 GLN 83 1HG GLN 83 -7.168 -11.677 -12.302
641 HE21 GLN 83 1HE2 GLN 83 -5.800 -13.062 -13.489
642 HE22 GLN 83 2HE2 GLN 83 -6.391 -14.520 -14.202
643 H VAL 84 H VAL 84 -8.379 -9.660 -10.399
644 HA VAL 84 HA VAL 84 -10.172 -9.675 -8.105
645 HB VAL 84 HB VAL 84 -10.026 -7.710 -10.398
646 HG11 VAL 84 1HG1 VAL 84 -12.162 -7.608 -9.248
647 HG12 VAL 84 2HG1 VAL 84 -11.198 -6.183 -8.862
648 HG13 VAL 84 3HG1 VAL 84 -11.345 -7.492 -7.689
649 HG21 VAL 84 3HG2 VAL 84 -7.899 -7.788 -9.221
650 HG22 VAL 84 1HG2 VAL 84 -8.722 -7.592 -7.674
651 HG23 VAL 84 2HG2 VAL 84 -8.740 -6.283 -8.857
652 HA PRO 85 HA PRO 85 -13.531 -11.756 -10.340
653 HB2 PRO 85 2HB PRO 85 -15.102 -10.511 -8.132
654 HB3 PRO 85 1HB PRO 85 -15.064 -12.193 -8.675
655 HG2 PRO 85 2HG PRO 85 -13.853 -11.477 -6.412
656 HG3 PRO 85 1HG PRO 85 -13.109 -12.667 -7.499
657 HD2 PRO 85 2HD PRO 85 -12.446 -9.763 -7.126
658 HD3 PRO 85 1HD PRO 85 -11.355 -11.145 -7.359
659 H GLY 86 H GLY 86 -14.385 -10.828 -12.115
660 HA2 GLY 86 2HA GLY 86 -15.921 -9.279 -13.154
661 HA3 GLY 86 1HA GLY 86 -15.506 -8.098 -11.920
662 H SER 87 H SER 87 -12.640 -9.404 -12.651
663 HA SER 87 HA SER 87 -12.116 -7.766 -15.044
664 HB2 SER 87 2HB SER 87 -10.498 -7.717 -12.476
665 HB3 SER 87 1HB SER 87 -9.968 -6.994 -13.993
666 HG SER 87 HG SER 87 -11.329 -5.799 -12.174
667 H THR 88 H THR 88 -10.153 -8.378 -16.211
668 HA THR 88 HA THR 88 -9.428 -11.201 -15.810
669 HB THR 88 HB THR 88 -10.047 -10.571 -18.096
670 HG1 THR 88 HG1 THR 88 -8.655 -12.112 -18.472
671 HG21 THR 88 3HG2 THR 88 -7.647 -8.731 -18.014
672 HG22 THR 88 1HG2 THR 88 -9.335 -8.226 -18.085
673 HG23 THR 88 2HG2 THR 88 -8.618 -9.099 -19.439
674 H GLN 89 H GLN 89 -8.198 -8.053 -15.272
675 HA GLN 89 HA GLN 89 -5.413 -8.868 -15.095
676 HB2 GLN 89 2HB GLN 89 -4.965 -6.557 -14.498
677 HB3 GLN 89 1HB GLN 89 -6.016 -6.610 -15.907
678 HG2 GLN 89 2HG GLN 89 -7.959 -6.197 -14.402
679 HG3 GLN 89 1HG GLN 89 -6.824 -6.002 -13.066
680 HE21 GLN 89 1HE2 GLN 89 -6.194 -4.901 -16.331
681 HE22 GLN 89 2HE2 GLN 89 -6.255 -3.214 -15.970
682 H LYS 90 H LYS 90 -4.172 -8.571 -13.112
683 HA LYS 90 HA LYS 90 -5.758 -9.158 -10.693
684 HB2 LYS 90 2HB LYS 90 -3.788 -10.385 -9.870
685 HB3 LYS 90 1HB LYS 90 -4.400 -11.045 -11.379
686 HG2 LYS 90 2HG LYS 90 -2.599 -9.722 -12.558
687 HG3 LYS 90 1HG LYS 90 -1.924 -9.379 -10.962
688 HD2 LYS 90 2HD LYS 90 -2.311 -12.096 -12.234
689 HD3 LYS 90 1HD LYS 90 -0.777 -11.283 -11.917
690 HE2 LYS 90 2HE LYS 90 -1.134 -11.458 -9.531
691 HE3 LYS 90 1HE LYS 90 -2.739 -12.145 -9.787
692 HZ1 LYS 90 3HZ LYS 90 -1.710 -14.054 -10.849
693 HZ2 LYS 90 1HZ LYS 90 -1.112 -13.852 -9.280
694 HZ3 LYS 90 2HZ LYS 90 -0.172 -13.392 -10.608
695 H ALA 91 H ALA 91 -5.407 -7.996 -8.838
696 HA ALA 91 HA ALA 91 -3.660 -5.629 -9.124
697 HB1 ALA 91 3HB ALA 91 -6.057 -5.122 -9.007
698 HB2 ALA 91 1HB ALA 91 -5.188 -4.471 -7.616
699 HB3 ALA 91 2HB ALA 91 -6.153 -5.937 -7.448
700 H LEU 92 H LEU 92 -2.443 -4.911 -7.349
701 HA LEU 92 HA LEU 92 -1.509 -7.004 -5.595
702 HB2 LEU 92 2HB LEU 92 0.066 -5.466 -6.641
703 HB3 LEU 92 1HB LEU 92 -0.720 -4.099 -5.876
704 HG LEU 92 HG LEU 92 -0.035 -5.065 -3.645
705 HD11 LEU 92 1HD1 LEU 92 1.710 -6.849 -5.344
706 HD12 LEU 92 2HD1 LEU 92 0.332 -7.378 -4.381
707 HD13 LEU 92 3HD1 LEU 92 1.751 -6.705 -3.585
708 HD21 LEU 92 3HD2 LEU 92 1.164 -3.206 -4.644
709 HD22 LEU 92 1HD2 LEU 92 2.159 -4.320 -5.585
710 HD23 LEU 92 2HD2 LEU 92 2.289 -4.287 -3.826
711 H TYR 93 H TYR 93 -2.662 -7.496 -3.830
712 HA TYR 93 HA TYR 93 -3.995 -5.395 -2.290
713 HB2 TYR 93 2HB TYR 93 -4.162 -8.410 -2.172
714 HB3 TYR 93 1HB TYR 93 -4.909 -7.368 -0.965
715 HD1 TYR 93 HD1 TYR 93 -4.900 -8.149 -4.607
716 HD2 TYR 93 HD2 TYR 93 -7.019 -6.406 -1.351
717 HE1 TYR 93 HE1 TYR 93 -6.896 -7.923 -6.026
718 HE2 TYR 93 HE2 TYR 93 -9.013 -6.171 -2.764
719 HH TYR 93 HH TYR 93 -9.329 -7.717 -5.763
720 H LEU 94 H LEU 94 -3.493 -4.874 -0.205
721 HA LEU 94 HA LEU 94 -0.930 -5.928 0.825
722 HB2 LEU 94 2HB LEU 94 -1.881 -3.070 1.032
723 HB3 LEU 94 1HB LEU 94 -0.302 -3.695 1.467
724 HG LEU 94 HG LEU 94 -1.402 -3.508 -1.346
725 HD11 LEU 94 1HD1 LEU 94 0.259 -1.750 -1.670
726 HD12 LEU 94 2HD1 LEU 94 0.721 -1.860 0.030
727 HD13 LEU 94 3HD1 LEU 94 -0.897 -1.314 -0.414
728 HD21 LEU 94 3HD2 LEU 94 1.331 -4.336 -0.374
729 HD22 LEU 94 1HD2 LEU 94 0.851 -4.116 -2.058
730 HD23 LEU 94 2HD2 LEU 94 0.115 -5.393 -1.091
731 H ARG 95 H ARG 95 -0.720 -6.122 3.064
732 HA ARG 95 HA ARG 95 -2.705 -4.880 4.792
733 HB2 ARG 95 2HB ARG 95 -3.206 -6.896 6.055
734 HB3 ARG 95 1HB ARG 95 -3.669 -7.101 4.374
735 HG2 ARG 95 2HG ARG 95 -1.798 -8.521 3.948
736 HG3 ARG 95 1HG ARG 95 -1.089 -8.157 5.524
737 HD2 ARG 95 2HD ARG 95 -3.671 -9.652 5.011
738 HD3 ARG 95 1HD ARG 95 -2.147 -10.349 5.567
739 HE ARG 95 HE ARG 95 -2.895 -8.339 7.362
740 HH11 ARG 95 1HH1 ARG 95 -3.917 -11.476 6.395
741 HH12 ARG 95 2HH1 ARG 95 -4.711 -11.799 7.895
742 HH21 ARG 95 1HH2 ARG 95 -3.883 -8.759 9.278
743 HH22 ARG 95 2HH2 ARG 95 -4.694 -10.271 9.521
744 H ALA 96 H ALA 96 -2.068 -5.032 7.131
745 HA ALA 96 HA ALA 96 0.655 -4.216 7.370
746 HB1 ALA 96 3HB ALA 96 -1.131 -3.201 8.687
747 HB2 ALA 96 1HB ALA 96 0.137 -3.855 9.728
748 HB3 ALA 96 2HB ALA 96 -1.385 -4.727 9.534
749 H LYS 97 H LYS 97 2.379 -5.157 8.481
750 HA LYS 97 HA LYS 97 2.443 -8.035 8.553
751 HB2 LYS 97 2HB LYS 97 4.430 -6.855 7.851
752 HB3 LYS 97 1HB LYS 97 4.467 -5.920 9.338
753 HG2 LYS 97 2HG LYS 97 6.177 -7.582 9.463
754 HG3 LYS 97 1HG LYS 97 4.899 -8.035 10.591
755 HD2 LYS 97 2HD LYS 97 5.651 -10.008 9.420
756 HD3 LYS 97 1HD LYS 97 4.018 -9.616 8.884
757 HE2 LYS 97 2HE LYS 97 4.856 -8.650 6.842
758 HE3 LYS 97 1HE LYS 97 6.522 -8.818 7.397
759 HZ1 LYS 97 3HZ LYS 97 4.668 -11.074 6.867
760 HZ2 LYS 97 1HZ LYS 97 6.289 -11.203 7.334
761 HZ3 LYS 97 2HZ LYS 97 5.893 -10.548 5.830
762 H LEU 98 H LEU 98 1.250 -8.951 10.157
763 HA LEU 98 HA LEU 98 1.462 -7.901 12.885
764 HB2 LEU 98 2HB LEU 98 -0.368 -10.006 11.725
765 HB3 LEU 98 1HB LEU 98 -0.398 -9.464 13.393
766 HG LEU 98 HG LEU 98 -1.045 -7.782 10.962
767 HD11 LEU 98 1HD1 LEU 98 -2.816 -8.829 13.175
768 HD12 LEU 98 2HD1 LEU 98 -2.786 -9.402 11.506
769 HD13 LEU 98 3HD1 LEU 98 -3.316 -7.760 11.864
770 HD21 LEU 98 3HD2 LEU 98 -1.665 -6.040 12.561
771 HD22 LEU 98 1HD2 LEU 98 0.047 -6.447 12.687
772 HD23 LEU 98 2HD2 LEU 98 -1.093 -7.047 13.892
773 H GLU 99 H GLU 99 3.409 -8.623 13.653
774 HA GLU 99 HA GLU 99 4.108 -11.439 13.575
775 HB2 GLU 99 2HB GLU 99 5.887 -9.771 13.446
776 HB3 GLU 99 1HB GLU 99 5.386 -9.066 14.973
777 HG2 GLU 99 2HG GLU 99 6.283 -11.927 14.834
778 HG3 GLU 99 1HG GLU 99 7.459 -10.616 14.893
779 H HIS 100 H HIS 100 2.872 -9.094 15.874
780 HA HIS 100 HA HIS 100 3.123 -10.671 18.199
781 HB2 HIS 100 2HB HIS 100 1.236 -8.364 17.686
782 HB3 HIS 100 1HB HIS 100 1.679 -9.008 19.264
783 HD1 HIS 100 HD1 HIS 100 2.355 -6.187 17.404
784 HD2 HIS 100 HD2 HIS 100 4.823 -8.941 19.287
785 HE1 HIS 100 HE1 HIS 100 4.539 -5.006 17.736
786 HE2 HIS 100 HE2 HIS 100 6.057 -6.733 18.762
787 H HIS 101 H HIS 101 2.262 -12.720 17.752
788 HA HIS 101 HA HIS 101 -0.475 -13.189 17.149
789 HB2 HIS 101 2HB HIS 101 0.018 -15.489 18.185
790 HB3 HIS 101 1HB HIS 101 0.964 -15.026 16.776
791 HD1 HIS 101 HD1 HIS 101 1.267 -15.256 20.541
792 HD2 HIS 101 HD2 HIS 101 3.692 -15.052 17.170
793 HE1 HIS 101 HE1 HIS 101 3.603 -15.645 21.366
794 HE2 HIS 101 HE2 HIS 101 5.066 -15.422 19.335
795 H HIS 102 H HIS 102 -1.585 -11.719 18.473
796 HA HIS 102 HA HIS 102 -1.150 -11.375 21.209
797 HB2 HIS 102 2HB HIS 102 -3.418 -10.197 21.148
798 HB3 HIS 102 1HB HIS 102 -2.150 -9.580 20.096
799 HD1 HIS 102 HD1 HIS 102 -5.156 -11.911 19.840
800 HD2 HIS 102 HD2 HIS 102 -2.924 -9.284 17.520
801 HE1 HIS 102 HE1 HIS 102 -6.349 -11.783 17.633
802 HE2 HIS 102 HE2 HIS 102 -5.009 -10.154 16.265
803 H HIS 103 H HIS 103 -1.148 -13.476 22.155
804 HA HIS 103 HA HIS 103 -3.809 -14.466 22.897
805 HB2 HIS 103 2HB HIS 103 -0.996 -15.370 23.464
806 HB3 HIS 103 1HB HIS 103 -2.316 -15.922 24.486
807 HD1 HIS 103 HD1 HIS 103 -2.543 -18.302 23.811
808 HD2 HIS 103 HD2 HIS 103 -2.397 -15.758 20.525
809 HE1 HIS 103 HE1 HIS 103 -3.028 -19.747 21.819
810 HE2 HIS 103 HE2 HIS 103 -3.054 -18.172 19.862
811 H HIS 104 H HIS 104 -1.227 -12.447 24.023
812 HA HIS 104 HA HIS 104 -1.948 -12.133 26.727
813 HB2 HIS 104 2HB HIS 104 0.207 -11.395 25.872
814 HB3 HIS 104 1HB HIS 104 -0.569 -10.237 24.801
815 HD1 HIS 104 HD1 HIS 104 -1.298 -8.001 25.815
816 HD2 HIS 104 HD2 HIS 104 0.343 -10.625 28.584
817 HE1 HIS 104 HE1 HIS 104 -0.876 -6.629 27.869
818 HE2 HIS 104 HE2 HIS 104 -0.024 -8.267 29.574
819 H HIS 105 H HIS 105 -4.218 -11.981 26.828
820 HA HIS 105 HA HIS 105 -5.366 -9.415 25.901
821 HB2 HIS 105 2HB HIS 105 -6.298 -11.377 24.728
822 HB3 HIS 105 1HB HIS 105 -6.776 -12.076 26.270
823 HD1 HIS 105 HD1 HIS 105 -9.068 -11.526 27.050
824 HD2 HIS 105 HD2 HIS 105 -7.748 -8.877 24.139
825 HE1 HIS 105 HE1 HIS 105 -11.044 -10.077 26.520
826 HE2 HIS 105 HE2 HIS 105 -10.172 -8.370 24.889
Start of MODEL 9
1 H1 MET 1 1H MET 1 37.550 -25.476 -1.149
2 H2 MET 1 2H MET 1 39.084 -25.689 -1.832
3 H3 MET 1 3H MET 1 37.977 -24.636 -2.555
4 HA MET 1 HA MET 1 39.168 -24.284 0.135
5 HB2 MET 1 2HB MET 1 40.451 -22.441 -0.853
6 HB3 MET 1 1HB MET 1 40.831 -23.964 -1.643
7 HG2 MET 1 2HG MET 1 39.382 -23.358 -3.519
8 HG3 MET 1 1HG MET 1 38.984 -21.837 -2.722
9 HE1 MET 1 3HE MET 1 39.689 -20.482 -4.892
10 HE2 MET 1 1HE MET 1 40.093 -21.988 -5.720
11 HE3 MET 1 2HE MET 1 41.249 -20.657 -5.692
12 H ASP 2 H ASP 2 38.210 -22.764 1.398
13 HA ASP 2 HA ASP 2 35.958 -21.260 0.252
14 HB2 ASP 2 2HB ASP 2 35.643 -22.717 2.316
15 HB3 ASP 2 1HB ASP 2 36.647 -21.561 3.186
16 H GLN 3 H GLN 3 36.978 -19.542 -0.732
17 HA GLN 3 HA GLN 3 38.976 -17.991 0.714
18 HB2 GLN 3 2HB GLN 3 37.912 -17.804 -2.109
19 HB3 GLN 3 1HB GLN 3 39.114 -16.705 -1.449
20 HG2 GLN 3 2HG GLN 3 39.452 -19.693 -1.678
21 HG3 GLN 3 1HG GLN 3 40.091 -18.510 -2.818
22 HE21 GLN 3 1HE2 GLN 3 41.788 -17.166 -2.163
23 HE22 GLN 3 2HE2 GLN 3 42.781 -17.549 -0.803
24 H LYS 4 H LYS 4 38.138 -16.651 2.207
25 HA LYS 4 HA LYS 4 35.632 -15.286 1.830
26 HB2 LYS 4 2HB LYS 4 37.745 -14.880 3.963
27 HB3 LYS 4 1HB LYS 4 36.112 -14.226 3.998
28 HG2 LYS 4 2HG LYS 4 36.860 -17.149 4.076
29 HG3 LYS 4 1HG LYS 4 36.304 -16.175 5.437
30 HD2 LYS 4 2HD LYS 4 34.705 -16.791 2.941
31 HD3 LYS 4 1HD LYS 4 34.506 -17.583 4.505
32 HE2 LYS 4 2HE LYS 4 33.882 -15.422 5.504
33 HE3 LYS 4 1HE LYS 4 34.069 -14.647 3.930
34 HZ1 LYS 4 3HZ LYS 4 32.325 -16.157 3.088
35 HZ2 LYS 4 1HZ LYS 4 31.773 -15.117 4.301
36 HZ3 LYS 4 2HZ LYS 4 32.090 -16.735 4.656
37 H SER 5 H SER 5 35.910 -14.013 -0.035
38 HA SER 5 HA SER 5 38.025 -12.083 -0.266
39 HB2 SER 5 2HB SER 5 36.941 -12.977 -2.275
40 HB3 SER 5 1HB SER 5 35.402 -12.276 -1.778
41 HG SER 5 HG SER 5 36.738 -11.052 -3.349
42 H SER 6 H SER 6 38.163 -10.231 0.824
43 HA SER 6 HA SER 6 35.843 -8.570 1.298
44 HB2 SER 6 2HB SER 6 36.097 -8.498 3.756
45 HB3 SER 6 1HB SER 6 35.681 -10.118 3.198
46 HG SER 6 HG SER 6 38.401 -9.537 3.401
47 H SER 7 H SER 7 36.693 -6.721 0.487
48 HA SER 7 HA SER 7 38.894 -5.509 1.997
49 HB2 SER 7 2HB SER 7 38.891 -5.740 -1.026
50 HB3 SER 7 1HB SER 7 39.986 -4.703 -0.112
51 HG SER 7 HG SER 7 40.040 -7.193 0.904
52 HA PRO 8 HA PRO 8 35.470 -2.538 0.721
53 HB2 PRO 8 2HB PRO 8 33.962 -2.403 2.932
54 HB3 PRO 8 1HB PRO 8 33.748 -3.708 1.756
55 HG2 PRO 8 2HG PRO 8 35.181 -3.743 4.389
56 HG3 PRO 8 1HG PRO 8 34.124 -4.975 3.674
57 HD2 PRO 8 2HD PRO 8 36.895 -5.039 3.615
58 HD3 PRO 8 1HD PRO 8 35.840 -5.905 2.481
59 H GLN 9 H GLN 9 37.454 -1.208 0.826
60 HA GLN 9 HA GLN 9 38.233 -0.037 3.350
61 HB2 GLN 9 2HB GLN 9 39.926 -0.467 1.668
62 HB3 GLN 9 1HB GLN 9 39.083 0.544 0.504
63 HG2 GLN 9 2HG GLN 9 39.531 2.514 1.858
64 HG3 GLN 9 1HG GLN 9 40.321 1.513 3.076
65 HE21 GLN 9 1HE2 GLN 9 42.254 2.648 2.853
66 HE22 GLN 9 2HE2 GLN 9 43.284 2.443 1.478
67 HA PRO 10 HA PRO 10 35.081 3.180 2.884
68 HB2 PRO 10 2HB PRO 10 35.310 4.219 5.370
69 HB3 PRO 10 1HB PRO 10 34.499 2.677 5.068
70 HG2 PRO 10 2HG PRO 10 37.286 3.190 6.045
71 HG3 PRO 10 1HG PRO 10 36.099 2.009 6.630
72 HD2 PRO 10 2HD PRO 10 38.140 1.365 4.932
73 HD3 PRO 10 1HD PRO 10 36.587 0.505 4.951
74 H ALA 11 H ALA 11 35.083 5.468 2.690
75 HA ALA 11 HA ALA 11 37.762 6.674 2.449
76 HB1 ALA 11 3HB ALA 11 35.103 7.573 1.322
77 HB2 ALA 11 1HB ALA 11 36.378 6.731 0.441
78 HB3 ALA 11 2HB ALA 11 36.656 8.365 1.046
79 H ALA 12 H ALA 12 37.444 9.273 2.738
80 HA ALA 12 HA ALA 12 36.783 9.681 5.526
81 HB1 ALA 12 3HB ALA 12 37.695 11.681 3.450
82 HB2 ALA 12 1HB ALA 12 38.751 10.748 4.510
83 HB3 ALA 12 2HB ALA 12 37.644 11.938 5.195
84 H GLN 13 H GLN 13 34.805 9.380 3.024
85 HA GLN 13 HA GLN 13 33.084 11.693 3.614
86 HB2 GLN 13 2HB GLN 13 32.935 9.726 1.316
87 HB3 GLN 13 1HB GLN 13 31.953 11.173 1.507
88 HG2 GLN 13 2HG GLN 13 34.940 11.100 1.110
89 HG3 GLN 13 1HG GLN 13 33.737 11.512 -0.111
90 HE21 GLN 13 1HE2 GLN 13 32.632 13.479 0.065
91 HE22 GLN 13 2HE2 GLN 13 33.233 14.777 1.030
92 H ALA 14 H ALA 14 31.029 11.456 4.376
93 HA ALA 14 HA ALA 14 30.317 8.879 5.527
94 HB1 ALA 14 3HB ALA 14 30.129 10.915 6.887
95 HB2 ALA 14 1HB ALA 14 28.566 10.120 6.694
96 HB3 ALA 14 2HB ALA 14 28.943 11.563 5.753
97 HA PRO 15 HA PRO 15 27.391 7.619 2.414
98 HB2 PRO 15 2HB PRO 15 25.676 6.685 4.655
99 HB3 PRO 15 1HB PRO 15 26.343 5.777 3.293
100 HG2 PRO 15 2HG PRO 15 27.340 5.483 5.751
101 HG3 PRO 15 1HG PRO 15 28.404 5.485 4.329
102 HD2 PRO 15 2HD PRO 15 27.878 7.679 6.312
103 HD3 PRO 15 1HD PRO 15 29.413 7.174 5.572
104 H GLU 16 H GLU 16 25.085 7.815 1.784
105 HA GLU 16 HA GLU 16 24.165 10.463 1.969
106 HB2 GLU 16 2HB GLU 16 23.691 8.927 0.079
107 HB3 GLU 16 1HB GLU 16 22.617 8.001 1.116
108 HG2 GLU 16 2HG GLU 16 21.319 9.440 -0.306
109 HG3 GLU 16 1HG GLU 16 21.175 9.989 1.363
110 H THR 17 H THR 17 22.133 11.277 2.820
111 HA THR 17 HA THR 17 21.703 10.654 5.541
112 HB THR 17 HB THR 17 21.227 12.885 4.648
113 HG1 THR 17 HG1 THR 17 20.120 12.577 6.499
114 HG21 THR 17 3HG2 THR 17 18.865 11.598 3.266
115 HG22 THR 17 1HG2 THR 17 20.307 12.225 2.465
116 HG23 THR 17 2HG2 THR 17 19.223 13.323 3.319
117 H LYS 18 H LYS 18 19.698 9.931 6.565
118 HA LYS 18 HA LYS 18 18.383 7.810 4.972
119 HB2 LYS 18 2HB LYS 18 19.928 6.930 6.683
120 HB3 LYS 18 1HB LYS 18 19.037 7.794 7.930
121 HG2 LYS 18 2HG LYS 18 17.046 6.443 7.438
122 HG3 LYS 18 1HG LYS 18 17.947 5.577 6.194
123 HD2 LYS 18 2HD LYS 18 19.529 4.785 7.912
124 HD3 LYS 18 1HD LYS 18 18.587 5.618 9.149
125 HE2 LYS 18 2HE LYS 18 18.021 3.250 9.102
126 HE3 LYS 18 1HE LYS 18 16.638 4.219 8.592
127 HZ1 LYS 18 3HZ LYS 18 17.139 3.693 6.299
128 HZ2 LYS 18 1HZ LYS 18 16.975 2.264 7.185
129 HZ3 LYS 18 2HZ LYS 18 18.513 2.818 6.755
130 H GLN 19 H GLN 19 16.253 8.095 4.678
131 HA GLN 19 HA GLN 19 14.734 9.831 6.478
132 HB2 GLN 19 2HB GLN 19 13.863 8.438 3.932
133 HB3 GLN 19 1HB GLN 19 12.910 9.609 4.835
134 HG2 GLN 19 2HG GLN 19 15.499 10.122 3.376
135 HG3 GLN 19 1HG GLN 19 13.888 10.657 2.900
136 HE21 GLN 19 1HE2 GLN 19 16.552 11.160 5.058
137 HE22 GLN 19 2HE2 GLN 19 16.039 12.687 5.670
138 H ALA 20 H ALA 20 12.930 9.154 7.670
139 HA ALA 20 HA ALA 20 12.955 6.289 8.330
140 HB1 ALA 20 3HB ALA 20 11.895 6.949 10.429
141 HB2 ALA 20 1HB ALA 20 11.835 8.623 9.880
142 HB3 ALA 20 2HB ALA 20 13.392 7.840 10.158
143 H PHE 21 H PHE 21 11.187 4.991 8.179
144 HA PHE 21 HA PHE 21 8.854 5.944 6.729
145 HB2 PHE 21 2HB PHE 21 9.627 3.203 7.769
146 HB3 PHE 21 1HB PHE 21 8.156 3.527 6.863
147 HD1 PHE 21 HD1 PHE 21 8.488 4.627 4.521
148 HD2 PHE 21 HD2 PHE 21 11.542 2.550 6.646
149 HE1 PHE 21 HE1 PHE 21 9.692 4.246 2.413
150 HE2 PHE 21 HE2 PHE 21 12.750 2.169 4.537
151 HZ PHE 21 HZ PHE 21 11.825 3.016 2.418
152 HA PRO 22 HA PRO 22 6.706 6.413 10.734
153 HB2 PRO 22 2HB PRO 22 4.651 7.921 9.830
154 HB3 PRO 22 1HB PRO 22 6.257 8.601 10.113
155 HG2 PRO 22 2HG PRO 22 4.988 7.762 7.531
156 HG3 PRO 22 1HG PRO 22 5.972 9.196 7.881
157 HD2 PRO 22 2HD PRO 22 6.947 6.928 6.673
158 HD3 PRO 22 1HD PRO 22 7.944 8.052 7.617
159 H ARG 23 H ARG 23 6.013 4.295 11.053
160 HA ARG 23 HA ARG 23 4.269 2.997 9.191
161 HB2 ARG 23 2HB ARG 23 4.430 1.052 10.579
162 HB3 ARG 23 1HB ARG 23 6.020 1.797 10.502
163 HG2 ARG 23 2HG ARG 23 5.673 2.770 12.725
164 HG3 ARG 23 1HG ARG 23 4.072 2.031 12.798
165 HD2 ARG 23 2HD ARG 23 5.264 -0.201 12.451
166 HD3 ARG 23 1HD ARG 23 6.762 0.668 12.781
167 HE ARG 23 HE ARG 23 4.593 0.123 14.677
168 HH11 ARG 23 1HH1 ARG 23 7.719 1.467 14.090
169 HH12 ARG 23 2HH1 ARG 23 8.123 1.549 15.769
170 HH21 ARG 23 1HH2 ARG 23 5.152 0.202 16.831
171 HH22 ARG 23 2HH2 ARG 23 6.697 0.837 17.288
172 H LYS 24 H LYS 24 3.760 4.659 12.251
173 HA LYS 24 HA LYS 24 1.267 3.436 12.860
174 HB2 LYS 24 2HB LYS 24 2.378 6.074 13.850
175 HB3 LYS 24 1HB LYS 24 1.021 5.203 14.554
176 HG2 LYS 24 2HG LYS 24 2.600 3.279 14.953
177 HG3 LYS 24 1HG LYS 24 3.911 4.356 14.480
178 HD2 LYS 24 2HD LYS 24 1.991 4.876 16.758
179 HD3 LYS 24 1HD LYS 24 3.595 4.174 16.942
180 HE2 LYS 24 2HE LYS 24 3.883 6.442 17.461
181 HE3 LYS 24 1HE LYS 24 4.469 6.296 15.807
182 HZ1 LYS 24 3HZ LYS 24 1.763 7.265 16.572
183 HZ2 LYS 24 1HZ LYS 24 2.402 7.213 15.008
184 HZ3 LYS 24 2HZ LYS 24 3.069 8.254 16.154
185 H PHE 25 H PHE 25 2.125 6.118 10.810
186 HA PHE 25 HA PHE 25 -0.668 6.890 10.459
187 HB2 PHE 25 2HB PHE 25 1.896 7.922 9.240
188 HB3 PHE 25 1HB PHE 25 0.307 8.477 8.724
189 HD1 PHE 25 HD1 PHE 25 -1.209 9.562 10.434
190 HD2 PHE 25 HD2 PHE 25 2.931 8.847 11.153
191 HE1 PHE 25 HE1 PHE 25 -1.241 11.224 12.244
192 HE2 PHE 25 HE2 PHE 25 2.901 10.515 12.962
193 HZ PHE 25 HZ PHE 25 0.815 11.702 13.510
194 H VAL 26 H VAL 26 1.939 5.508 8.429
195 HA VAL 26 HA VAL 26 0.429 5.159 6.100
196 HB VAL 26 HB VAL 26 2.736 3.452 7.067
197 HG11 VAL 26 1HG1 VAL 26 1.475 2.335 5.301
198 HG12 VAL 26 2HG1 VAL 26 3.038 2.881 4.692
199 HG13 VAL 26 3HG1 VAL 26 1.573 3.781 4.295
200 HG21 VAL 26 3HG2 VAL 26 3.357 5.802 6.920
201 HG22 VAL 26 1HG2 VAL 26 2.694 5.900 5.288
202 HG23 VAL 26 2HG2 VAL 26 4.110 4.895 5.607
203 H LEU 27 H LEU 27 1.046 2.774 8.703
204 HA LEU 27 HA LEU 27 -0.588 0.735 7.638
205 HB2 LEU 27 2HB LEU 27 0.191 1.277 10.509
206 HB3 LEU 27 1HB LEU 27 -0.582 -0.197 9.954
207 HG LEU 27 HG LEU 27 2.162 0.777 9.119
208 HD11 LEU 27 1HD1 LEU 27 2.981 -1.158 10.384
209 HD12 LEU 27 2HD1 LEU 27 1.336 -1.506 10.916
210 HD13 LEU 27 3HD1 LEU 27 2.129 -0.013 11.419
211 HD21 LEU 27 3HD2 LEU 27 0.697 -1.773 8.417
212 HD22 LEU 27 1HD2 LEU 27 2.372 -1.400 8.009
213 HD23 LEU 27 2HD2 LEU 27 1.063 -0.446 7.314
214 H ALA 28 H ALA 28 -1.315 3.442 9.793
215 HA ALA 28 HA ALA 28 -3.950 2.756 10.487
216 HB1 ALA 28 3HB ALA 28 -4.257 5.141 10.974
217 HB2 ALA 28 1HB ALA 28 -2.750 5.508 10.135
218 HB3 ALA 28 2HB ALA 28 -2.727 4.541 11.610
219 H ALA 29 H ALA 29 -2.683 4.492 7.669
220 HA ALA 29 HA ALA 29 -5.216 5.006 6.466
221 HB1 ALA 29 3HB ALA 29 -2.492 4.780 5.169
222 HB2 ALA 29 1HB ALA 29 -3.195 6.249 5.848
223 HB3 ALA 29 2HB ALA 29 -3.934 5.489 4.438
224 H LEU 30 H LEU 30 -2.860 2.407 6.206
225 HA LEU 30 HA LEU 30 -3.986 0.946 4.107
226 HB2 LEU 30 2HB LEU 30 -1.725 0.625 5.036
227 HB3 LEU 30 1HB LEU 30 -2.424 -0.052 6.493
228 HG LEU 30 HG LEU 30 -3.264 -1.971 5.236
229 HD11 LEU 30 1HD1 LEU 30 -3.686 -0.878 3.090
230 HD12 LEU 30 2HD1 LEU 30 -2.670 -2.303 2.889
231 HD13 LEU 30 3HD1 LEU 30 -1.948 -0.695 2.834
232 HD21 LEU 30 3HD2 LEU 30 -1.103 -2.988 4.676
233 HD22 LEU 30 1HD2 LEU 30 -1.029 -2.095 6.192
234 HD23 LEU 30 2HD2 LEU 30 -0.343 -1.398 4.723
235 H GLU 31 H GLU 31 -4.409 0.417 7.635
236 HA GLU 31 HA GLU 31 -6.276 -1.670 7.426
237 HB2 GLU 31 2HB GLU 31 -6.855 -1.146 9.781
238 HB3 GLU 31 1HB GLU 31 -5.119 -1.240 9.511
239 HG2 GLU 31 2HG GLU 31 -4.962 1.179 9.493
240 HG3 GLU 31 1HG GLU 31 -6.711 1.315 9.673
241 H GLN 32 H GLN 32 -6.776 1.847 7.527
242 HA GLN 32 HA GLN 32 -9.641 1.645 7.608
243 HB2 GLN 32 2HB GLN 32 -7.808 3.967 6.989
244 HB3 GLN 32 1HB GLN 32 -9.559 4.104 7.086
245 HG2 GLN 32 2HG GLN 32 -9.468 3.316 9.422
246 HG3 GLN 32 1HG GLN 32 -7.710 3.258 9.313
247 HE21 GLN 32 1HE2 GLN 32 -6.551 5.197 9.237
248 HE22 GLN 32 2HE2 GLN 32 -7.262 6.702 9.706
249 H SER 33 H SER 33 -7.362 1.296 5.112
250 HA SER 33 HA SER 33 -9.379 1.759 3.020
251 HB2 SER 33 2HB SER 33 -7.137 2.673 2.597
252 HB3 SER 33 1HB SER 33 -6.429 1.069 2.786
253 HG SER 33 HG SER 33 -8.399 1.683 0.837
254 H SER 34 H SER 34 -8.167 -0.736 4.952
255 HA SER 34 HA SER 34 -8.307 -2.909 3.089
256 HB2 SER 34 2HB SER 34 -8.279 -2.929 6.123
257 HB3 SER 34 1HB SER 34 -8.086 -4.352 5.100
258 HG SER 34 HG SER 34 -6.390 -2.161 4.687
259 H ASP 35 H ASP 35 -9.934 -4.342 2.682
260 HA ASP 35 HA ASP 35 -12.624 -3.702 3.453
261 HB2 ASP 35 2HB ASP 35 -11.542 -6.189 2.102
262 HB3 ASP 35 1HB ASP 35 -13.235 -5.708 2.177
263 H ASP 36 H ASP 36 -13.969 -5.896 4.105
264 HA ASP 36 HA ASP 36 -13.482 -6.373 6.810
265 HB2 ASP 36 2HB ASP 36 -15.664 -6.730 5.719
266 HB3 ASP 36 1HB ASP 36 -15.010 -8.119 4.857
267 H ALA 37 H ALA 37 -12.142 -7.943 4.014
268 HA ALA 37 HA ALA 37 -11.248 -10.327 5.349
269 HB1 ALA 37 3HB ALA 37 -11.736 -10.274 2.933
270 HB2 ALA 37 1HB ALA 37 -10.094 -10.828 3.265
271 HB3 ALA 37 2HB ALA 37 -10.371 -9.182 2.692
272 H GLY 38 H GLY 38 -10.160 -7.167 5.542
273 HA2 GLY 38 2HA GLY 38 -8.331 -6.369 6.744
274 HA3 GLY 38 1HA GLY 38 -7.671 -7.995 6.777
275 H TRP 39 H TRP 39 -8.499 -7.200 3.630
276 HA TRP 39 HA TRP 39 -5.716 -6.445 2.997
277 HB2 TRP 39 2HB TRP 39 -7.801 -7.892 1.348
278 HB3 TRP 39 1HB TRP 39 -6.272 -7.319 0.688
279 HD1 TRP 39 HD1 TRP 39 -7.754 -10.096 2.809
280 HE1 TRP 39 HE1 TRP 39 -5.939 -11.869 3.252
281 HE3 TRP 39 HE3 TRP 39 -3.692 -7.559 1.026
282 HZ2 TRP 39 HZ2 TRP 39 -3.156 -12.150 2.900
283 HZ3 TRP 39 HZ3 TRP 39 -1.483 -8.651 1.122
284 HH2 TRP 39 HH2 TRP 39 -1.225 -10.899 2.042
285 H ALA 40 H ALA 40 -5.274 -4.644 1.824
286 HA ALA 40 HA ALA 40 -7.554 -2.981 0.936
287 HB1 ALA 40 3HB ALA 40 -6.125 -1.030 1.301
288 HB2 ALA 40 1HB ALA 40 -4.810 -2.080 1.829
289 HB3 ALA 40 2HB ALA 40 -6.292 -1.974 2.780
290 H ASN 41 H ASN 41 -7.604 -2.267 -1.146
291 HA ASN 41 HA ASN 41 -5.864 -3.428 -3.093
292 HB2 ASN 41 2HB ASN 41 -8.264 -2.895 -3.491
293 HB3 ASN 41 1HB ASN 41 -7.880 -1.181 -3.405
294 HD21 ASN 41 1HD2 ASN 41 -9.032 -2.771 -5.551
295 HD22 ASN 41 2HD2 ASN 41 -8.012 -2.537 -6.925
296 H LEU 42 H LEU 42 -3.972 -2.661 -3.876
297 HA LEU 42 HA LEU 42 -2.441 -0.701 -2.782
298 HB2 LEU 42 2HB LEU 42 -1.566 -2.320 -4.351
299 HB3 LEU 42 1HB LEU 42 -2.484 -1.604 -5.662
300 HG LEU 42 HG LEU 42 -1.115 0.450 -5.489
301 HD11 LEU 42 1HD1 LEU 42 0.922 0.459 -4.140
302 HD12 LEU 42 2HD1 LEU 42 0.477 -1.100 -3.446
303 HD13 LEU 42 3HD1 LEU 42 -0.517 0.323 -3.130
304 HD21 LEU 42 3HD2 LEU 42 0.937 -0.492 -6.425
305 HD22 LEU 42 1HD2 LEU 42 -0.496 -1.293 -7.072
306 HD23 LEU 42 2HD2 LEU 42 0.479 -2.090 -5.836
307 H GLY 43 H GLY 43 -4.734 -0.226 -5.454
308 HA2 GLY 43 2HA GLY 43 -4.084 2.457 -6.056
309 HA3 GLY 43 1HA GLY 43 -5.614 1.671 -6.407
310 H ASN 44 H ASN 44 -6.473 1.104 -3.812
311 HA ASN 44 HA ASN 44 -7.506 3.668 -3.028
312 HB2 ASN 44 2HB ASN 44 -7.812 0.964 -1.690
313 HB3 ASN 44 1HB ASN 44 -8.770 2.401 -1.343
314 HD21 ASN 44 1HD2 ASN 44 -9.600 -0.232 -2.292
315 HD22 ASN 44 2HD2 ASN 44 -10.447 0.042 -3.771
316 H PHE 45 H PHE 45 -5.145 1.397 -1.725
317 HA PHE 45 HA PHE 45 -4.635 2.587 0.746
318 HB2 PHE 45 2HB PHE 45 -3.705 0.438 0.300
319 HB3 PHE 45 1HB PHE 45 -2.864 1.016 -1.132
320 HD1 PHE 45 HD1 PHE 45 -3.026 1.925 2.499
321 HD2 PHE 45 HD2 PHE 45 -0.583 1.183 -0.914
322 HE1 PHE 45 HE1 PHE 45 -1.012 2.318 3.857
323 HE2 PHE 45 HE2 PHE 45 1.433 1.571 0.441
324 HZ PHE 45 HZ PHE 45 1.219 2.138 2.828
325 H GLY 46 H GLY 46 -2.835 3.087 -2.314
326 HA2 GLY 46 2HA GLY 46 -1.173 5.158 -1.447
327 HA3 GLY 46 1HA GLY 46 -1.682 4.914 -3.110
328 H ASN 47 H ASN 47 -4.518 5.271 -2.480
329 HA ASN 47 HA ASN 47 -4.730 8.086 -2.791
330 HB2 ASN 47 2HB ASN 47 -6.336 6.370 -3.699
331 HB3 ASN 47 1HB ASN 47 -6.929 6.128 -2.061
332 HD21 ASN 47 1HD2 ASN 47 -8.422 6.992 -4.324
333 HD22 ASN 47 2HD2 ASN 47 -9.029 8.571 -3.964
334 H TYR 48 H TYR 48 -6.057 6.020 -0.164
335 HA TYR 48 HA TYR 48 -6.699 8.202 1.507
336 HB2 TYR 48 2HB TYR 48 -7.684 5.868 1.624
337 HB3 TYR 48 1HB TYR 48 -6.213 5.367 2.449
338 HD1 TYR 48 HD2 TYR 48 -8.926 7.927 2.690
339 HD2 TYR 48 HD1 TYR 48 -6.159 5.455 4.776
340 HE1 TYR 48 HE2 TYR 48 -9.906 8.639 4.827
341 HE2 TYR 48 HE1 TYR 48 -7.131 6.170 6.917
342 HH TYR 48 HH TYR 48 -10.091 7.825 7.121
343 H LEU 49 H LEU 49 -3.756 6.354 1.147
344 HA LEU 49 HA LEU 49 -2.458 7.003 3.543
345 HB2 LEU 49 2HB LEU 49 -1.583 5.314 2.041
346 HB3 LEU 49 1HB LEU 49 -1.324 6.511 0.786
347 HG LEU 49 HG LEU 49 0.430 7.577 2.128
348 HD11 LEU 49 1HD1 LEU 49 -0.143 5.396 4.135
349 HD12 LEU 49 2HD1 LEU 49 -0.405 7.128 4.353
350 HD13 LEU 49 3HD1 LEU 49 1.233 6.497 4.193
351 HD21 LEU 49 3HD2 LEU 49 0.818 4.592 1.844
352 HD22 LEU 49 1HD2 LEU 49 2.103 5.790 2.008
353 HD23 LEU 49 2HD2 LEU 49 1.067 5.796 0.580
354 H ASN 50 H ASN 50 -2.232 8.667 0.378
355 HA ASN 50 HA ASN 50 -0.519 10.722 1.270
356 HB2 ASN 50 2HB ASN 50 -0.870 10.116 -1.124
357 HB3 ASN 50 1HB ASN 50 -2.470 10.850 -1.047
358 HD21 ASN 50 1HD2 ASN 50 0.961 11.458 -0.949
359 HD22 ASN 50 2HD2 ASN 50 0.865 13.149 -1.274
360 H LYS 51 H LYS 51 -3.997 10.376 1.444
361 HA LYS 51 HA LYS 51 -4.695 13.043 2.030
362 HB2 LYS 51 2HB LYS 51 -5.979 10.500 3.063
363 HB3 LYS 51 1HB LYS 51 -6.709 12.102 3.084
364 HG2 LYS 51 2HG LYS 51 -6.686 12.148 0.641
365 HG3 LYS 51 1HG LYS 51 -5.946 10.547 0.615
366 HD2 LYS 51 2HD LYS 51 -8.344 10.377 0.222
367 HD3 LYS 51 1HD LYS 51 -7.920 9.626 1.763
368 HE2 LYS 51 2HE LYS 51 -8.693 11.583 2.969
369 HE3 LYS 51 1HE LYS 51 -9.017 12.424 1.454
370 HZ1 LYS 51 3HZ LYS 51 -10.660 10.689 0.938
371 HZ2 LYS 51 1HZ LYS 51 -11.048 11.551 2.339
372 HZ3 LYS 51 2HZ LYS 51 -10.397 9.998 2.455
373 H LEU 52 H LEU 52 -3.254 10.541 4.008
374 HA LEU 52 HA LEU 52 -3.494 12.196 6.424
375 HB2 LEU 52 2HB LEU 52 -2.297 9.431 6.156
376 HB3 LEU 52 1HB LEU 52 -2.695 10.267 7.646
377 HG LEU 52 HG LEU 52 -4.633 9.167 5.604
378 HD11 LEU 52 1HD1 LEU 52 -5.361 7.730 7.434
379 HD12 LEU 52 2HD1 LEU 52 -4.155 8.452 8.500
380 HD13 LEU 52 3HD1 LEU 52 -3.644 7.506 7.102
381 HD21 LEU 52 3HD2 LEU 52 -6.424 9.960 7.072
382 HD22 LEU 52 1HD2 LEU 52 -5.473 11.302 6.437
383 HD23 LEU 52 2HD2 LEU 52 -5.234 10.761 8.100
384 H GLN 53 H GLN 53 -1.023 10.785 4.307
385 HA GLN 53 HA GLN 53 0.988 12.585 5.512
386 HB2 GLN 53 2HB GLN 53 1.390 9.740 4.551
387 HB3 GLN 53 1HB GLN 53 2.706 10.833 4.955
388 HG2 GLN 53 2HG GLN 53 0.558 9.953 6.879
389 HG3 GLN 53 1HG GLN 53 2.156 9.220 6.749
390 HE21 GLN 53 1HE2 GLN 53 0.355 11.981 7.820
391 HE22 GLN 53 2HE2 GLN 53 1.631 12.713 8.724
392 HA PRO 54 HA PRO 54 0.918 13.556 0.976
393 HB2 PRO 54 2HB PRO 54 1.229 16.244 1.273
394 HB3 PRO 54 1HB PRO 54 -0.348 15.448 1.338
395 HG2 PRO 54 2HG PRO 54 1.397 16.380 3.589
396 HG3 PRO 54 1HG PRO 54 -0.363 16.514 3.404
397 HD2 PRO 54 2HD PRO 54 0.833 14.607 4.946
398 HD3 PRO 54 1HD PRO 54 -0.730 14.364 4.142
399 H ASP 55 H ASP 55 3.064 14.167 3.609
400 HA ASP 55 HA ASP 55 5.304 15.096 2.085
401 HB2 ASP 55 2HB ASP 55 5.036 15.618 4.474
402 HB3 ASP 55 1HB ASP 55 5.165 13.909 4.873
403 H PHE 56 H PHE 56 3.961 11.990 2.765
404 HA PHE 56 HA PHE 56 6.429 10.517 2.501
405 HB2 PHE 56 2HB PHE 56 4.539 9.753 3.945
406 HB3 PHE 56 1HB PHE 56 3.580 9.482 2.495
407 HD1 PHE 56 HD1 PHE 56 6.726 8.459 4.186
408 HD2 PHE 56 HD2 PHE 56 3.695 7.425 1.379
409 HE1 PHE 56 HE1 PHE 56 7.652 6.187 4.028
410 HE2 PHE 56 HE2 PHE 56 4.616 5.148 1.215
411 HZ PHE 56 HZ PHE 56 6.599 4.526 2.543
412 H ASP 57 H ASP 57 7.355 10.664 0.528
413 HA ASP 57 HA ASP 57 5.748 9.849 -1.810
414 HB2 ASP 57 2HB ASP 57 6.313 12.295 -1.779
415 HB3 ASP 57 1HB ASP 57 8.018 11.857 -1.825
416 H SER 58 H SER 58 6.706 8.407 -3.242
417 HA SER 58 HA SER 58 8.642 6.647 -2.161
418 HB2 SER 58 2HB SER 58 7.630 6.827 -5.015
419 HB3 SER 58 1HB SER 58 8.502 5.461 -4.318
420 HG SER 58 HG SER 58 5.887 5.998 -4.220
421 H ARG 59 H ARG 59 8.932 9.312 -4.447
422 HA ARG 59 HA ARG 59 11.465 8.601 -5.508
423 HB2 ARG 59 2HB ARG 59 10.177 11.336 -5.307
424 HB3 ARG 59 1HB ARG 59 11.558 10.933 -6.318
425 HG2 ARG 59 2HG ARG 59 8.770 9.807 -6.590
426 HG3 ARG 59 1HG ARG 59 9.515 11.021 -7.631
427 HD2 ARG 59 2HD ARG 59 10.468 8.174 -7.271
428 HD3 ARG 59 1HD ARG 59 9.571 8.796 -8.658
429 HE ARG 59 HE ARG 59 11.602 10.378 -8.840
430 HH11 ARG 59 1HH1 ARG 59 11.750 7.107 -7.797
431 HH12 ARG 59 2HH1 ARG 59 13.362 6.881 -8.388
432 HH21 ARG 59 1HH2 ARG 59 13.654 10.082 -9.601
433 HH22 ARG 59 2HH2 ARG 59 14.416 8.537 -9.422
434 H LEU 60 H LEU 60 10.532 10.164 -2.546
435 HA LEU 60 HA LEU 60 13.018 11.421 -1.938
436 HB2 LEU 60 2HB LEU 60 10.842 10.456 -0.072
437 HB3 LEU 60 1HB LEU 60 12.148 11.544 0.365
438 HG LEU 60 HG LEU 60 9.957 12.143 -1.637
439 HD11 LEU 60 1HD1 LEU 60 10.412 13.199 1.157
440 HD12 LEU 60 2HD1 LEU 60 9.133 12.092 0.658
441 HD13 LEU 60 3HD1 LEU 60 9.161 13.741 0.035
442 HD21 LEU 60 3HD2 LEU 60 12.044 13.258 -2.228
443 HD22 LEU 60 1HD2 LEU 60 12.187 13.893 -0.590
444 HD23 LEU 60 2HD2 LEU 60 10.863 14.421 -1.628
445 H TYR 61 H TYR 61 11.996 8.146 -1.854
446 HA TYR 61 HA TYR 61 14.238 7.378 -0.090
447 HB2 TYR 61 2HB TYR 61 11.751 5.831 -0.875
448 HB3 TYR 61 1HB TYR 61 13.044 5.203 0.143
449 HD1 TYR 61 HD1 TYR 61 10.325 7.708 -0.050
450 HD2 TYR 61 HD2 TYR 61 13.185 5.798 2.462
451 HE1 TYR 61 HE1 TYR 61 9.220 8.663 1.927
452 HE2 TYR 61 HE2 TYR 61 12.080 6.743 4.443
453 HH TYR 61 HH TYR 61 9.014 8.172 4.338
454 H GLY 62 H GLY 62 13.886 7.862 -3.226
455 HA2 GLY 62 2HA GLY 62 15.293 7.202 -4.952
456 HA3 GLY 62 1HA GLY 62 15.929 5.936 -3.921
457 H TYR 63 H TYR 63 12.549 5.802 -4.020
458 HA TYR 63 HA TYR 63 12.658 3.556 -5.909
459 HB2 TYR 63 2HB TYR 63 10.593 4.382 -3.859
460 HB3 TYR 63 1HB TYR 63 10.316 3.095 -5.030
461 HD1 TYR 63 HD1 TYR 63 12.440 4.117 -2.161
462 HD2 TYR 63 HD2 TYR 63 11.230 0.927 -4.708
463 HE1 TYR 63 HE1 TYR 63 13.541 2.508 -0.662
464 HE2 TYR 63 HE2 TYR 63 12.327 -0.687 -3.216
465 HH TYR 63 HH TYR 63 14.118 -0.722 -1.530
466 H LYS 64 H LYS 64 11.219 3.349 -7.651
467 HA LYS 64 HA LYS 64 10.601 5.774 -9.018
468 HB2 LYS 64 2HB LYS 64 9.949 2.885 -9.611
469 HB3 LYS 64 1HB LYS 64 9.507 4.207 -10.683
470 HG2 LYS 64 2HG LYS 64 12.331 3.540 -9.852
471 HG3 LYS 64 1HG LYS 64 11.577 3.051 -11.372
472 HD2 LYS 64 2HD LYS 64 11.225 5.441 -11.929
473 HD3 LYS 64 1HD LYS 64 12.057 5.889 -10.441
474 HE2 LYS 64 2HE LYS 64 14.109 4.860 -11.240
475 HE3 LYS 64 1HE LYS 64 13.285 4.293 -12.694
476 HZ1 LYS 64 3HZ LYS 64 13.673 7.142 -11.941
477 HZ2 LYS 64 1HZ LYS 64 12.924 6.583 -13.351
478 HZ3 LYS 64 2HZ LYS 64 14.574 6.306 -13.103
479 H LYS 65 H LYS 65 8.493 3.215 -7.663
480 HA LYS 65 HA LYS 65 6.420 5.220 -7.198
481 HB2 LYS 65 2HB LYS 65 4.678 3.754 -8.221
482 HB3 LYS 65 1HB LYS 65 5.816 4.423 -9.381
483 HG2 LYS 65 2HG LYS 65 7.022 2.287 -9.427
484 HG3 LYS 65 1HG LYS 65 5.874 1.619 -8.265
485 HD2 LYS 65 2HD LYS 65 5.185 0.860 -10.410
486 HD3 LYS 65 1HD LYS 65 4.050 2.121 -9.941
487 HE2 LYS 65 2HE LYS 65 6.426 2.573 -11.750
488 HE3 LYS 65 1HE LYS 65 4.805 2.211 -12.333
489 HZ1 LYS 65 3HZ LYS 65 4.048 4.246 -11.153
490 HZ2 LYS 65 1HZ LYS 65 5.136 4.545 -12.412
491 HZ3 LYS 65 2HZ LYS 65 5.664 4.613 -10.813
492 H LEU 66 H LEU 66 4.638 4.423 -5.849
493 HA LEU 66 HA LEU 66 5.577 3.376 -3.463
494 HB2 LEU 66 2HB LEU 66 3.573 4.777 -3.690
495 HB3 LEU 66 1HB LEU 66 2.729 3.448 -4.461
496 HG LEU 66 HG LEU 66 2.903 2.139 -2.363
497 HD11 LEU 66 1HD1 LEU 66 4.920 3.149 -1.440
498 HD12 LEU 66 2HD1 LEU 66 3.586 3.247 -0.292
499 HD13 LEU 66 3HD1 LEU 66 4.066 4.676 -1.209
500 HD21 LEU 66 3HD2 LEU 66 1.238 3.398 -1.106
501 HD22 LEU 66 1HD2 LEU 66 0.903 3.475 -2.834
502 HD23 LEU 66 2HD2 LEU 66 1.631 4.858 -2.015
503 H SER 67 H SER 67 3.917 1.650 -6.083
504 HA SER 67 HA SER 67 3.317 -0.743 -4.823
505 HB2 SER 67 2HB SER 67 3.406 -1.789 -7.046
506 HB3 SER 67 1HB SER 67 2.632 -0.206 -7.136
507 HG SER 67 HG SER 67 4.644 -1.035 -8.557
508 H ASP 68 H ASP 68 6.364 0.168 -6.408
509 HA ASP 68 HA ASP 68 7.670 -2.306 -5.873
510 HB2 ASP 68 2HB ASP 68 8.285 -0.706 -7.710
511 HB3 ASP 68 1HB ASP 68 8.970 0.358 -6.483
512 H LEU 69 H LEU 69 7.562 0.815 -4.211
513 HA LEU 69 HA LEU 69 9.512 0.378 -2.250
514 HB2 LEU 69 2HB LEU 69 8.520 2.556 -2.583
515 HB3 LEU 69 1HB LEU 69 6.937 1.954 -2.133
516 HG LEU 69 HG LEU 69 7.766 1.570 0.179
517 HD11 LEU 69 1HD1 LEU 69 9.898 2.515 0.883
518 HD12 LEU 69 2HD1 LEU 69 10.265 2.967 -0.782
519 HD13 LEU 69 3HD1 LEU 69 10.141 1.265 -0.336
520 HD21 LEU 69 3HD2 LEU 69 6.591 3.626 -0.334
521 HD22 LEU 69 1HD2 LEU 69 8.093 4.382 -0.870
522 HD23 LEU 69 2HD2 LEU 69 7.880 3.943 0.826
523 H VAL 70 H VAL 70 6.045 -0.405 -2.215
524 HA VAL 70 HA VAL 70 5.929 -1.423 0.403
525 HB VAL 70 HB VAL 70 4.204 -2.161 -1.975
526 HG11 VAL 70 1HG1 VAL 70 3.685 -2.528 0.980
527 HG12 VAL 70 2HG1 VAL 70 4.022 -3.815 -0.180
528 HG13 VAL 70 3HG1 VAL 70 2.542 -2.867 -0.320
529 HG21 VAL 70 3HG2 VAL 70 4.204 0.245 -1.481
530 HG22 VAL 70 1HG2 VAL 70 3.773 -0.095 0.196
531 HG23 VAL 70 2HG2 VAL 70 2.646 -0.486 -1.104
532 H LYS 71 H LYS 71 6.199 -3.234 -2.686
533 HA LYS 71 HA LYS 71 6.500 -5.775 -1.482
534 HB2 LYS 71 2HB LYS 71 7.370 -6.501 -3.712
535 HB3 LYS 71 1HB LYS 71 5.831 -5.655 -3.781
536 HG2 LYS 71 2HG LYS 71 6.994 -3.607 -4.464
537 HG3 LYS 71 1HG LYS 71 8.531 -4.470 -4.413
538 HD2 LYS 71 2HD LYS 71 6.221 -5.343 -6.150
539 HD3 LYS 71 1HD LYS 71 7.451 -4.205 -6.702
540 HE2 LYS 71 2HE LYS 71 7.973 -7.016 -5.727
541 HE3 LYS 71 1HE LYS 71 7.928 -6.513 -7.415
542 HZ1 LYS 71 3HZ LYS 71 9.874 -5.633 -5.353
543 HZ2 LYS 71 1HZ LYS 71 9.782 -4.976 -6.911
544 HZ3 LYS 71 2HZ LYS 71 10.188 -6.603 -6.697
545 H ALA 72 H ALA 72 8.795 -3.213 -1.987
546 HA ALA 72 HA ALA 72 11.113 -4.869 -1.488
547 HB1 ALA 72 3HB ALA 72 10.825 -1.862 -1.432
548 HB2 ALA 72 1HB ALA 72 11.312 -2.833 -2.821
549 HB3 ALA 72 2HB ALA 72 12.347 -2.755 -1.394
550 H ARG 73 H ARG 73 8.957 -2.820 0.415
551 HA ARG 73 HA ARG 73 10.534 -3.321 2.849
552 HB2 ARG 73 2HB ARG 73 8.225 -1.428 2.335
553 HB3 ARG 73 1HB ARG 73 9.044 -1.604 3.881
554 HG2 ARG 73 2HG ARG 73 10.279 -0.629 1.305
555 HG3 ARG 73 1HG ARG 73 9.849 0.357 2.705
556 HD2 ARG 73 2HD ARG 73 11.937 -1.827 2.614
557 HD3 ARG 73 1HD ARG 73 12.237 -0.091 2.687
558 HE ARG 73 HE ARG 73 10.668 -0.802 4.887
559 HH11 ARG 73 1HH1 ARG 73 13.857 -1.336 3.691
560 HH12 ARG 73 2HH1 ARG 73 14.535 -1.515 5.268
561 HH21 ARG 73 1HH2 ARG 73 11.562 -1.063 6.922
562 HH22 ARG 73 2HH2 ARG 73 13.257 -1.376 7.058
563 H THR 74 H THR 74 9.285 -5.592 1.913
564 HA THR 74 HA THR 74 6.731 -6.172 2.868
565 HB THR 74 HB THR 74 7.413 -8.551 2.933
566 HG1 THR 74 HG1 THR 74 9.447 -8.998 3.282
567 HG21 THR 74 3HG2 THR 74 8.085 -8.750 0.568
568 HG22 THR 74 1HG2 THR 74 8.454 -7.025 0.537
569 HG23 THR 74 2HG2 THR 74 6.794 -7.567 0.787
570 H ASP 75 H ASP 75 9.593 -5.605 4.656
571 HA ASP 75 HA ASP 75 9.168 -7.004 7.021
572 HB2 ASP 75 2HB ASP 75 11.223 -5.745 6.452
573 HB3 ASP 75 1HB ASP 75 10.350 -4.233 6.684
574 H LEU 76 H LEU 76 7.746 -3.985 5.894
575 HA LEU 76 HA LEU 76 6.185 -3.712 8.379
576 HB2 LEU 76 2HB LEU 76 6.634 -1.804 6.074
577 HB3 LEU 76 1HB LEU 76 5.584 -1.467 7.437
578 HG LEU 76 HG LEU 76 8.563 -1.951 7.645
579 HD11 LEU 76 1HD1 LEU 76 7.017 0.644 7.730
580 HD12 LEU 76 2HD1 LEU 76 8.101 0.116 6.442
581 HD13 LEU 76 3HD1 LEU 76 8.743 0.456 8.047
582 HD21 LEU 76 3HD2 LEU 76 7.363 -2.564 9.675
583 HD22 LEU 76 1HD2 LEU 76 6.551 -0.996 9.691
584 HD23 LEU 76 2HD2 LEU 76 8.299 -1.092 9.930
585 H PHE 77 H PHE 77 5.845 -4.268 4.924
586 HA PHE 77 HA PHE 77 2.904 -4.317 5.224
587 HB2 PHE 77 2HB PHE 77 4.420 -3.638 2.695
588 HB3 PHE 77 1HB PHE 77 2.691 -3.474 2.981
589 HD1 PHE 77 HD1 PHE 77 2.260 -2.016 5.291
590 HD2 PHE 77 HD2 PHE 77 5.547 -1.631 2.602
591 HE1 PHE 77 HE1 PHE 77 2.615 0.293 6.052
592 HE2 PHE 77 HE2 PHE 77 5.900 0.681 3.368
593 HZ PHE 77 HZ PHE 77 4.435 1.642 5.094
594 H VAL 78 H VAL 78 1.904 -6.175 4.731
595 HA VAL 78 HA VAL 78 3.402 -8.358 3.498
596 HB VAL 78 HB VAL 78 0.560 -8.348 4.552
597 HG11 VAL 78 1HG1 VAL 78 0.793 -10.796 4.588
598 HG12 VAL 78 2HG1 VAL 78 2.390 -10.651 3.852
599 HG13 VAL 78 3HG1 VAL 78 0.957 -10.147 2.956
600 HG21 VAL 78 3HG2 VAL 78 2.139 -7.821 6.334
601 HG22 VAL 78 1HG2 VAL 78 3.114 -9.230 5.911
602 HG23 VAL 78 2HG2 VAL 78 1.484 -9.444 6.551
603 H THR 79 H THR 79 3.186 -8.968 1.394
604 HA THR 79 HA THR 79 1.125 -7.575 -0.222
605 HB THR 79 HB THR 79 2.681 -7.611 -2.105
606 HG1 THR 79 HG1 THR 79 4.121 -9.178 -2.000
607 HG21 THR 79 3HG2 THR 79 2.795 -5.699 -0.552
608 HG22 THR 79 1HG2 THR 79 4.367 -6.049 -1.270
609 HG23 THR 79 2HG2 THR 79 4.026 -6.545 0.387
610 H GLU 80 H GLU 80 -0.288 -8.796 -1.315
611 HA GLU 80 HA GLU 80 0.631 -11.291 -2.537
612 HB2 GLU 80 2HB GLU 80 -1.849 -11.102 -0.811
613 HB3 GLU 80 1HB GLU 80 -1.617 -12.375 -2.000
614 HG2 GLU 80 2HG GLU 80 0.493 -12.999 -0.800
615 HG3 GLU 80 1HG GLU 80 0.050 -11.845 0.454
616 H GLU 81 H GLU 81 -0.041 -11.533 -4.586
617 HA GLU 81 HA GLU 81 -1.740 -9.472 -5.758
618 HB2 GLU 81 2HB GLU 81 -0.268 -11.775 -7.076
619 HB3 GLU 81 1HB GLU 81 -1.075 -10.458 -7.917
620 HG2 GLU 81 2HG GLU 81 0.498 -8.862 -6.989
621 HG3 GLU 81 1HG GLU 81 1.275 -10.140 -6.056
622 H ARG 82 H ARG 82 -3.893 -9.753 -5.915
623 HA ARG 82 HA ARG 82 -4.948 -12.523 -6.030
624 HB2 ARG 82 2HB ARG 82 -6.402 -10.107 -4.930
625 HB3 ARG 82 1HB ARG 82 -6.898 -11.790 -4.819
626 HG2 ARG 82 2HG ARG 82 -4.556 -10.493 -3.432
627 HG3 ARG 82 1HG ARG 82 -6.057 -11.054 -2.693
628 HD2 ARG 82 2HD ARG 82 -4.011 -12.806 -4.061
629 HD3 ARG 82 1HD ARG 82 -4.192 -12.612 -2.319
630 HE ARG 82 HE ARG 82 -6.604 -13.483 -3.604
631 HH11 ARG 82 1HH1 ARG 82 -3.587 -14.514 -2.314
632 HH12 ARG 82 2HH1 ARG 82 -4.155 -16.108 -1.963
633 HH21 ARG 82 1HH2 ARG 82 -7.321 -15.544 -3.171
634 HH22 ARG 82 2HH2 ARG 82 -6.246 -16.683 -2.439
635 H GLN 83 H GLN 83 -6.282 -13.039 -7.720
636 HA GLN 83 HA GLN 83 -6.625 -11.072 -9.806
637 HB2 GLN 83 2HB GLN 83 -6.064 -13.411 -10.348
638 HB3 GLN 83 1HB GLN 83 -7.606 -13.928 -9.679
639 HG2 GLN 83 2HG GLN 83 -8.809 -12.726 -11.397
640 HG3 GLN 83 1HG GLN 83 -7.304 -12.054 -12.024
641 HE21 GLN 83 1HE2 GLN 83 -7.657 -12.940 -14.062
642 HE22 GLN 83 2HE2 GLN 83 -7.495 -14.632 -14.368
643 H VAL 84 H VAL 84 -8.479 -10.066 -10.458
644 HA VAL 84 HA VAL 84 -10.541 -9.905 -8.405
645 HB VAL 84 HB VAL 84 -10.183 -8.222 -10.903
646 HG11 VAL 84 1HG1 VAL 84 -12.457 -8.117 -10.016
647 HG12 VAL 84 2HG1 VAL 84 -11.612 -6.592 -9.750
648 HG13 VAL 84 3HG1 VAL 84 -11.829 -7.724 -8.415
649 HG21 VAL 84 3HG2 VAL 84 -8.225 -8.055 -9.457
650 HG22 VAL 84 1HG2 VAL 84 -9.258 -7.704 -8.070
651 HG23 VAL 84 2HG2 VAL 84 -9.157 -6.557 -9.407
652 HA PRO 85 HA PRO 85 -13.375 -12.562 -10.670
653 HB2 PRO 85 2HB PRO 85 -15.654 -11.749 -9.320
654 HB3 PRO 85 1HB PRO 85 -14.532 -12.987 -8.745
655 HG2 PRO 85 2HG PRO 85 -14.696 -10.089 -8.005
656 HG3 PRO 85 1HG PRO 85 -14.411 -11.496 -6.964
657 HD2 PRO 85 2HD PRO 85 -12.397 -9.902 -7.728
658 HD3 PRO 85 1HD PRO 85 -12.171 -11.657 -7.582
659 H GLY 86 H GLY 86 -14.008 -12.090 -12.682
660 HA2 GLY 86 2HA GLY 86 -15.578 -11.079 -14.192
661 HA3 GLY 86 1HA GLY 86 -15.594 -9.646 -13.176
662 H SER 87 H SER 87 -12.613 -9.717 -12.950
663 HA SER 87 HA SER 87 -12.026 -8.459 -15.551
664 HB2 SER 87 2HB SER 87 -10.586 -8.176 -12.896
665 HB3 SER 87 1HB SER 87 -10.191 -7.301 -14.376
666 HG SER 87 HG SER 87 -11.550 -5.890 -13.576
667 H THR 88 H THR 88 -10.191 -9.019 -16.743
668 HA THR 88 HA THR 88 -9.207 -11.706 -16.340
669 HB THR 88 HB THR 88 -9.695 -10.920 -18.607
670 HG1 THR 88 HG1 THR 88 -7.624 -11.562 -19.533
671 HG21 THR 88 3HG2 THR 88 -8.260 -9.288 -19.728
672 HG22 THR 88 1HG2 THR 88 -7.351 -9.038 -18.238
673 HG23 THR 88 2HG2 THR 88 -9.044 -8.555 -18.329
674 H GLN 89 H GLN 89 -8.250 -8.765 -15.117
675 HA GLN 89 HA GLN 89 -5.387 -9.440 -15.015
676 HB2 GLN 89 2HB GLN 89 -5.029 -7.119 -14.333
677 HB3 GLN 89 1HB GLN 89 -5.926 -7.199 -15.844
678 HG2 GLN 89 2HG GLN 89 -8.006 -6.747 -14.658
679 HG3 GLN 89 1HG GLN 89 -7.141 -6.724 -13.122
680 HE21 GLN 89 1HE2 GLN 89 -7.775 -5.023 -16.072
681 HE22 GLN 89 2HE2 GLN 89 -7.097 -3.513 -15.585
682 H LYS 90 H LYS 90 -4.227 -9.207 -12.998
683 HA LYS 90 HA LYS 90 -5.889 -9.692 -10.617
684 HB2 LYS 90 2HB LYS 90 -3.931 -10.720 -9.597
685 HB3 LYS 90 1HB LYS 90 -4.265 -11.465 -11.151
686 HG2 LYS 90 2HG LYS 90 -2.462 -10.176 -12.177
687 HG3 LYS 90 1HG LYS 90 -2.142 -9.381 -10.637
688 HD2 LYS 90 2HD LYS 90 -0.527 -11.140 -10.948
689 HD3 LYS 90 1HD LYS 90 -1.625 -11.605 -9.647
690 HE2 LYS 90 2HE LYS 90 -2.883 -13.007 -11.246
691 HE3 LYS 90 1HE LYS 90 -1.738 -12.565 -12.514
692 HZ1 LYS 90 3HZ LYS 90 -1.049 -14.642 -11.683
693 HZ2 LYS 90 1HZ LYS 90 -1.216 -14.159 -10.070
694 HZ3 LYS 90 2HZ LYS 90 0.026 -13.520 -11.018
695 H ALA 91 H ALA 91 -5.676 -8.465 -8.769
696 HA ALA 91 HA ALA 91 -4.138 -5.965 -9.065
697 HB1 ALA 91 3HB ALA 91 -6.577 -5.693 -8.911
698 HB2 ALA 91 1HB ALA 91 -5.741 -4.944 -7.549
699 HB3 ALA 91 2HB ALA 91 -6.561 -6.491 -7.339
700 H LEU 92 H LEU 92 -2.672 -5.360 -7.530
701 HA LEU 92 HA LEU 92 -1.809 -7.299 -5.597
702 HB2 LEU 92 2HB LEU 92 -0.207 -5.893 -6.795
703 HB3 LEU 92 1HB LEU 92 -0.911 -4.455 -6.083
704 HG LEU 92 HG LEU 92 -0.225 -5.351 -3.817
705 HD11 LEU 92 1HD1 LEU 92 1.362 -7.293 -5.496
706 HD12 LEU 92 2HD1 LEU 92 0.016 -7.697 -4.431
707 HD13 LEU 92 3HD1 LEU 92 1.515 -7.062 -3.754
708 HD21 LEU 92 3HD2 LEU 92 2.113 -4.664 -4.055
709 HD22 LEU 92 1HD2 LEU 92 1.037 -3.588 -4.945
710 HD23 LEU 92 2HD2 LEU 92 1.982 -4.803 -5.808
711 H TYR 93 H TYR 93 -2.760 -7.580 -3.683
712 HA TYR 93 HA TYR 93 -3.994 -5.273 -2.328
713 HB2 TYR 93 2HB TYR 93 -4.385 -8.252 -1.978
714 HB3 TYR 93 1HB TYR 93 -5.022 -7.069 -0.840
715 HD1 TYR 93 HD1 TYR 93 -5.200 -8.207 -4.373
716 HD2 TYR 93 HD2 TYR 93 -7.024 -5.880 -1.306
717 HE1 TYR 93 HE1 TYR 93 -7.198 -7.922 -5.778
718 HE2 TYR 93 HE2 TYR 93 -9.027 -5.598 -2.701
719 HH TYR 93 HH TYR 93 -9.611 -7.436 -5.473
720 H LEU 94 H LEU 94 -3.451 -4.712 -0.239
721 HA LEU 94 HA LEU 94 -0.927 -5.863 0.798
722 HB2 LEU 94 2HB LEU 94 -1.758 -2.962 0.981
723 HB3 LEU 94 1HB LEU 94 -0.205 -3.651 1.415
724 HG LEU 94 HG LEU 94 -1.313 -3.404 -1.389
725 HD11 LEU 94 1HD1 LEU 94 0.506 -1.777 -1.700
726 HD12 LEU 94 2HD1 LEU 94 0.897 -1.904 0.016
727 HD13 LEU 94 3HD1 LEU 94 -0.666 -1.257 -0.489
728 HD21 LEU 94 3HD2 LEU 94 1.347 -4.464 -0.431
729 HD22 LEU 94 1HD2 LEU 94 0.919 -4.144 -2.112
730 HD23 LEU 94 2HD2 LEU 94 0.061 -5.389 -1.208
731 H ARG 95 H ARG 95 -0.657 -5.883 3.076
732 HA ARG 95 HA ARG 95 -2.729 -4.710 4.746
733 HB2 ARG 95 2HB ARG 95 -3.256 -6.701 5.978
734 HB3 ARG 95 1HB ARG 95 -3.542 -7.013 4.273
735 HG2 ARG 95 2HG ARG 95 -1.533 -8.306 4.100
736 HG3 ARG 95 1HG ARG 95 -1.044 -7.853 5.734
737 HD2 ARG 95 2HD ARG 95 -3.436 -9.530 4.966
738 HD3 ARG 95 1HD ARG 95 -1.957 -10.098 5.741
739 HE ARG 95 HE ARG 95 -3.393 -8.047 7.188
740 HH11 ARG 95 1HH1 ARG 95 -2.896 -11.427 6.744
741 HH12 ARG 95 2HH1 ARG 95 -3.582 -11.831 8.278
742 HH21 ARG 95 1HH2 ARG 95 -4.248 -8.570 9.149
743 HH22 ARG 95 2HH2 ARG 95 -4.328 -10.229 9.632
744 H ALA 96 H ALA 96 -2.163 -5.019 7.136
745 HA ALA 96 HA ALA 96 0.503 -3.990 7.442
746 HB1 ALA 96 3HB ALA 96 -1.374 -3.016 8.659
747 HB2 ALA 96 1HB ALA 96 -0.137 -3.603 9.770
748 HB3 ALA 96 2HB ALA 96 -1.615 -4.534 9.526
749 H LYS 97 H LYS 97 2.210 -4.821 8.634
750 HA LYS 97 HA LYS 97 2.371 -7.679 8.969
751 HB2 LYS 97 2HB LYS 97 4.350 -6.487 8.253
752 HB3 LYS 97 1HB LYS 97 4.277 -5.427 9.650
753 HG2 LYS 97 2HG LYS 97 6.034 -7.032 9.969
754 HG3 LYS 97 1HG LYS 97 4.735 -7.372 11.112
755 HD2 LYS 97 2HD LYS 97 5.544 -9.447 10.172
756 HD3 LYS 97 1HD LYS 97 3.905 -9.143 9.596
757 HE2 LYS 97 2HE LYS 97 4.797 -8.310 7.474
758 HE3 LYS 97 1HE LYS 97 6.441 -8.564 8.057
759 HZ1 LYS 97 3HZ LYS 97 5.719 -10.367 6.632
760 HZ2 LYS 97 1HZ LYS 97 4.407 -10.689 7.647
761 HZ3 LYS 97 2HZ LYS 97 5.985 -10.932 8.203
762 H LEU 98 H LEU 98 1.214 -8.541 10.613
763 HA LEU 98 HA LEU 98 1.324 -7.220 13.253
764 HB2 LEU 98 2HB LEU 98 -0.805 -9.063 12.157
765 HB3 LEU 98 1HB LEU 98 -0.818 -8.317 13.744
766 HG LEU 98 HG LEU 98 -0.972 -6.834 11.109
767 HD11 LEU 98 1HD1 LEU 98 -3.101 -7.381 13.182
768 HD12 LEU 98 2HD1 LEU 98 -3.011 -8.080 11.565
769 HD13 LEU 98 3HD1 LEU 98 -3.286 -6.350 11.761
770 HD21 LEU 98 3HD2 LEU 98 -1.161 -5.813 13.949
771 HD22 LEU 98 1HD2 LEU 98 -1.461 -4.860 12.493
772 HD23 LEU 98 2HD2 LEU 98 0.150 -5.503 12.811
773 H GLU 99 H GLU 99 3.044 -8.228 14.218
774 HA GLU 99 HA GLU 99 2.553 -10.968 15.076
775 HB2 GLU 99 2HB GLU 99 4.797 -11.762 14.592
776 HB3 GLU 99 1HB GLU 99 4.012 -11.237 13.110
777 HG2 GLU 99 2HG GLU 99 5.299 -9.215 13.066
778 HG3 GLU 99 1HG GLU 99 5.971 -9.556 14.661
779 H HIS 100 H HIS 100 4.667 -11.537 16.621
780 HA HIS 100 HA HIS 100 4.362 -9.441 18.673
781 HB2 HIS 100 2HB HIS 100 4.961 -12.391 18.989
782 HB3 HIS 100 1HB HIS 100 4.744 -11.242 20.308
783 HD1 HIS 100 HD1 HIS 100 2.278 -10.005 20.258
784 HD2 HIS 100 HD2 HIS 100 2.656 -13.625 18.250
785 HE1 HIS 100 HE1 HIS 100 -0.063 -10.839 19.926
786 HE2 HIS 100 HE2 HIS 100 0.186 -13.064 18.782
787 H HIS 101 H HIS 101 6.547 -9.638 16.548
788 HA HIS 101 HA HIS 101 9.006 -10.153 17.784
789 HB2 HIS 101 2HB HIS 101 8.804 -9.746 15.367
790 HB3 HIS 101 1HB HIS 101 8.366 -8.068 15.675
791 HD1 HIS 101 HD1 HIS 101 11.316 -10.425 16.021
792 HD2 HIS 101 HD2 HIS 101 10.496 -6.350 15.941
793 HE1 HIS 101 HE1 HIS 101 13.554 -9.289 15.945
794 HE2 HIS 101 HE2 HIS 101 13.027 -6.840 15.735
795 H HIS 102 H HIS 102 10.099 -9.155 19.363
796 HA HIS 102 HA HIS 102 8.871 -7.279 21.024
797 HB2 HIS 102 2HB HIS 102 11.799 -8.026 20.834
798 HB3 HIS 102 1HB HIS 102 11.077 -7.131 22.167
799 HD1 HIS 102 HD1 HIS 102 11.607 -8.952 23.898
800 HD2 HIS 102 HD2 HIS 102 9.268 -10.310 20.742
801 HE1 HIS 102 HE1 HIS 102 10.768 -11.209 24.596
802 HE2 HIS 102 HE2 HIS 102 9.490 -12.073 22.618
803 H HIS 103 H HIS 103 8.364 -5.257 20.475
804 HA HIS 103 HA HIS 103 9.651 -3.819 18.384
805 HB2 HIS 103 2HB HIS 103 7.744 -2.721 20.465
806 HB3 HIS 103 1HB HIS 103 8.101 -2.023 18.890
807 HD1 HIS 103 HD1 HIS 103 5.727 -4.126 20.570
808 HD2 HIS 103 HD2 HIS 103 7.189 -3.828 16.692
809 HE1 HIS 103 HE1 HIS 103 4.062 -5.330 19.132
810 HE2 HIS 103 HE2 HIS 103 4.851 -4.934 16.777
811 H HIS 104 H HIS 104 11.253 -2.361 18.405
812 HA HIS 104 HA HIS 104 12.531 -1.655 20.933
813 HB2 HIS 104 2HB HIS 104 13.917 -2.347 18.994
814 HB3 HIS 104 1HB HIS 104 13.327 -0.959 18.087
815 HD1 HIS 104 HD1 HIS 104 15.575 -1.855 20.974
816 HD2 HIS 104 HD2 HIS 104 14.582 1.451 18.662
817 HE1 HIS 104 HE1 HIS 104 17.259 -0.096 21.561
818 HE2 HIS 104 HE2 HIS 104 16.739 1.831 20.034
819 H HIS 105 H HIS 105 10.745 -0.157 18.315
820 HA HIS 105 HA HIS 105 9.628 1.870 19.913
821 HB2 HIS 105 2HB HIS 105 11.857 2.895 19.818
822 HB3 HIS 105 1HB HIS 105 11.829 2.831 18.058
823 HD1 HIS 105 HD1 HIS 105 9.861 4.440 20.884
824 HD2 HIS 105 HD2 HIS 105 10.875 5.102 16.911
825 HE1 HIS 105 HE1 HIS 105 8.970 6.716 20.337
826 HE2 HIS 105 HE2 HIS 105 9.816 7.184 18.015
Start of MODEL 10
1 H1 MET 1 1H MET 1 35.666 24.158 16.783
2 H2 MET 1 2H MET 1 37.076 23.227 16.773
3 H3 MET 1 3H MET 1 36.785 24.306 18.042
4 HA MET 1 HA MET 1 35.129 21.929 17.419
5 HB2 MET 1 2HB MET 1 37.286 22.369 19.486
6 HB3 MET 1 1HB MET 1 36.104 21.073 19.612
7 HG2 MET 1 2HG MET 1 38.102 21.463 17.394
8 HG3 MET 1 1HG MET 1 38.160 20.240 18.665
9 HE1 MET 1 3HE MET 1 37.384 18.081 15.506
10 HE2 MET 1 1HE MET 1 38.425 18.282 16.915
11 HE3 MET 1 2HE MET 1 38.448 19.483 15.624
12 H ASP 2 H ASP 2 34.462 24.834 18.038
13 HA ASP 2 HA ASP 2 33.382 25.021 20.624
14 HB2 ASP 2 2HB ASP 2 32.409 26.345 18.078
15 HB3 ASP 2 1HB ASP 2 32.057 26.877 19.721
16 H GLN 3 H GLN 3 32.113 23.611 17.670
17 HA GLN 3 HA GLN 3 29.625 22.841 19.033
18 HB2 GLN 3 2HB GLN 3 30.408 22.517 16.120
19 HB3 GLN 3 1HB GLN 3 28.843 22.120 16.809
20 HG2 GLN 3 2HG GLN 3 28.577 24.186 15.715
21 HG3 GLN 3 1HG GLN 3 28.620 24.547 17.440
22 HE21 GLN 3 1HE2 GLN 3 29.242 26.679 17.076
23 HE22 GLN 3 2HE2 GLN 3 30.826 27.104 16.535
24 H LYS 4 H LYS 4 29.417 20.844 19.877
25 HA LYS 4 HA LYS 4 31.476 18.851 19.450
26 HB2 LYS 4 2HB LYS 4 28.925 18.713 21.078
27 HB3 LYS 4 1HB LYS 4 30.206 17.509 21.091
28 HG2 LYS 4 2HG LYS 4 31.765 19.220 21.965
29 HG3 LYS 4 1HG LYS 4 30.429 20.371 22.023
30 HD2 LYS 4 2HD LYS 4 30.572 17.755 23.541
31 HD3 LYS 4 1HD LYS 4 30.844 19.359 24.225
32 HE2 LYS 4 2HE LYS 4 28.548 19.989 23.702
33 HE3 LYS 4 1HE LYS 4 28.265 18.416 22.958
34 HZ1 LYS 4 3HZ LYS 4 28.937 18.869 25.817
35 HZ2 LYS 4 1HZ LYS 4 28.626 17.373 25.097
36 HZ3 LYS 4 2HZ LYS 4 27.394 18.524 25.216
37 H SER 5 H SER 5 31.427 17.708 17.603
38 HA SER 5 HA SER 5 29.123 17.195 16.043
39 HB2 SER 5 2HB SER 5 31.364 17.156 15.055
40 HB3 SER 5 1HB SER 5 31.795 15.760 16.042
41 HG SER 5 HG SER 5 31.174 14.844 14.190
42 H SER 6 H SER 6 28.504 14.856 15.397
43 HA SER 6 HA SER 6 27.279 13.613 17.613
44 HB2 SER 6 2HB SER 6 26.664 11.816 16.022
45 HB3 SER 6 1HB SER 6 26.354 13.422 15.363
46 HG SER 6 HG SER 6 27.404 11.970 13.883
47 H SER 7 H SER 7 30.274 12.884 15.912
48 HA SER 7 HA SER 7 30.721 10.432 17.409
49 HB2 SER 7 2HB SER 7 31.414 10.603 15.032
50 HB3 SER 7 1HB SER 7 32.556 11.872 15.472
51 HG SER 7 HG SER 7 33.794 10.425 16.524
52 HA PRO 8 HA PRO 8 33.082 12.803 20.520
53 HB2 PRO 8 2HB PRO 8 32.993 10.924 22.458
54 HB3 PRO 8 1HB PRO 8 31.617 11.977 22.109
55 HG2 PRO 8 2HG PRO 8 32.081 9.135 21.304
56 HG3 PRO 8 1HG PRO 8 30.587 9.917 21.851
57 HD2 PRO 8 2HD PRO 8 31.200 9.410 19.212
58 HD3 PRO 8 1HD PRO 8 30.078 10.672 19.751
59 H GLN 9 H GLN 9 33.543 9.271 20.182
60 HA GLN 9 HA GLN 9 36.381 9.362 20.482
61 HB2 GLN 9 2HB GLN 9 36.238 6.966 19.708
62 HB3 GLN 9 1HB GLN 9 35.234 7.347 21.101
63 HG2 GLN 9 2HG GLN 9 33.266 7.474 19.696
64 HG3 GLN 9 1HG GLN 9 34.243 7.198 18.257
65 HE21 GLN 9 1HE2 GLN 9 31.989 5.684 19.354
66 HE22 GLN 9 2HE2 GLN 9 32.566 4.070 19.567
67 HA PRO 10 HA PRO 10 37.666 10.386 16.387
68 HB2 PRO 10 2HB PRO 10 39.888 8.826 16.043
69 HB3 PRO 10 1HB PRO 10 39.850 10.257 17.082
70 HG2 PRO 10 2HG PRO 10 39.563 7.363 17.836
71 HG3 PRO 10 1HG PRO 10 40.520 8.633 18.623
72 HD2 PRO 10 2HD PRO 10 38.126 7.860 19.583
73 HD3 PRO 10 1HD PRO 10 38.671 9.547 19.683
74 H ALA 11 H ALA 11 37.082 9.878 14.371
75 HA ALA 11 HA ALA 11 36.772 8.747 12.427
76 HB1 ALA 11 3HB ALA 11 37.875 6.321 13.831
77 HB2 ALA 11 1HB ALA 11 38.835 7.542 12.995
78 HB3 ALA 11 2HB ALA 11 37.696 6.543 12.090
79 H ALA 12 H ALA 12 35.041 8.042 15.202
80 HA ALA 12 HA ALA 12 33.389 5.933 14.112
81 HB1 ALA 12 3HB ALA 12 32.030 6.221 16.122
82 HB2 ALA 12 1HB ALA 12 32.940 7.676 16.534
83 HB3 ALA 12 2HB ALA 12 33.745 6.106 16.521
84 H GLN 13 H GLN 13 33.180 7.478 12.104
85 HA GLN 13 HA GLN 13 31.336 9.683 12.387
86 HB2 GLN 13 2HB GLN 13 32.468 8.449 9.868
87 HB3 GLN 13 1HB GLN 13 31.671 10.011 9.997
88 HG2 GLN 13 2HG GLN 13 34.302 9.233 11.247
89 HG3 GLN 13 1HG GLN 13 34.071 10.283 9.851
90 HE21 GLN 13 1HE2 GLN 13 35.384 10.834 12.383
91 HE22 GLN 13 2HE2 GLN 13 34.574 12.195 13.062
92 H ALA 14 H ALA 14 29.341 9.910 11.206
93 HA ALA 14 HA ALA 14 27.787 7.422 11.203
94 HB1 ALA 14 3HB ALA 14 26.969 9.325 12.534
95 HB2 ALA 14 1HB ALA 14 25.824 8.870 11.271
96 HB3 ALA 14 2HB ALA 14 26.847 10.293 11.065
97 HA PRO 15 HA PRO 15 27.403 7.153 6.779
98 HB2 PRO 15 2HB PRO 15 24.608 6.262 7.123
99 HB3 PRO 15 1HB PRO 15 25.996 5.379 6.481
100 HG2 PRO 15 2HG PRO 15 24.946 4.781 8.877
101 HG3 PRO 15 1HG PRO 15 26.695 4.688 8.586
102 HD2 PRO 15 2HD PRO 15 25.115 6.858 9.946
103 HD3 PRO 15 1HD PRO 15 26.655 6.115 10.435
104 H GLU 16 H GLU 16 25.222 7.400 5.139
105 HA GLU 16 HA GLU 16 24.952 10.233 4.901
106 HB2 GLU 16 2HB GLU 16 23.544 8.028 3.373
107 HB3 GLU 16 1HB GLU 16 23.585 9.725 2.914
108 HG2 GLU 16 2HG GLU 16 26.025 9.585 2.658
109 HG3 GLU 16 1HG GLU 16 25.962 7.874 3.083
110 H THR 17 H THR 17 22.540 10.944 4.147
111 HA THR 17 HA THR 17 20.954 10.789 6.574
112 HB THR 17 HB THR 17 20.480 12.375 4.037
113 HG1 THR 17 HG1 THR 17 21.395 14.064 5.156
114 HG21 THR 17 3HG2 THR 17 19.130 12.578 6.741
115 HG22 THR 17 1HG2 THR 17 18.385 11.983 5.255
116 HG23 THR 17 2HG2 THR 17 18.877 13.671 5.380
117 H LYS 18 H LYS 18 19.368 9.367 6.879
118 HA LYS 18 HA LYS 18 17.984 8.203 4.537
119 HB2 LYS 18 2HB LYS 18 19.278 6.566 5.860
120 HB3 LYS 18 1HB LYS 18 18.376 7.018 7.301
121 HG2 LYS 18 2HG LYS 18 16.286 6.277 6.079
122 HG3 LYS 18 1HG LYS 18 17.348 5.609 4.840
123 HD2 LYS 18 2HD LYS 18 16.729 3.855 6.389
124 HD3 LYS 18 1HD LYS 18 18.445 4.223 6.589
125 HE2 LYS 18 2HE LYS 18 17.919 5.616 8.539
126 HE3 LYS 18 1HE LYS 18 16.206 5.256 8.337
127 HZ1 LYS 18 3HZ LYS 18 17.204 3.878 10.037
128 HZ2 LYS 18 1HZ LYS 18 18.333 3.276 8.932
129 HZ3 LYS 18 2HZ LYS 18 16.694 2.924 8.735
130 H GLN 19 H GLN 19 15.754 8.239 4.482
131 HA GLN 19 HA GLN 19 14.384 9.845 6.501
132 HB2 GLN 19 2HB GLN 19 13.290 8.576 3.974
133 HB3 GLN 19 1HB GLN 19 12.453 9.737 4.995
134 HG2 GLN 19 2HG GLN 19 14.927 10.241 3.351
135 HG3 GLN 19 1HG GLN 19 13.301 10.832 3.022
136 HE21 GLN 19 1HE2 GLN 19 16.143 11.217 4.967
137 HE22 GLN 19 2HE2 GLN 19 15.698 12.729 5.671
138 H ALA 20 H ALA 20 12.846 9.073 7.928
139 HA ALA 20 HA ALA 20 12.863 6.160 8.318
140 HB1 ALA 20 3HB ALA 20 13.638 7.501 10.196
141 HB2 ALA 20 1HB ALA 20 12.150 6.650 10.616
142 HB3 ALA 20 2HB ALA 20 12.104 8.371 10.233
143 H PHE 21 H PHE 21 11.115 4.951 7.930
144 HA PHE 21 HA PHE 21 8.677 6.011 6.929
145 HB2 PHE 21 2HB PHE 21 9.377 3.227 7.900
146 HB3 PHE 21 1HB PHE 21 7.888 3.639 7.056
147 HD1 PHE 21 HD1 PHE 21 8.188 4.749 4.712
148 HD2 PHE 21 HD2 PHE 21 11.205 2.487 6.695
149 HE1 PHE 21 HE1 PHE 21 9.291 4.329 2.557
150 HE2 PHE 21 HE2 PHE 21 12.309 2.064 4.541
151 HZ PHE 21 HZ PHE 21 11.352 2.986 2.468
152 HA PRO 22 HA PRO 22 6.679 6.361 11.013
153 HB2 PRO 22 2HB PRO 22 4.639 7.947 10.250
154 HB3 PRO 22 1HB PRO 22 6.267 8.587 10.507
155 HG2 PRO 22 2HG PRO 22 4.883 7.909 7.938
156 HG3 PRO 22 1HG PRO 22 5.934 9.287 8.318
157 HD2 PRO 22 2HD PRO 22 6.764 7.018 6.976
158 HD3 PRO 22 1HD PRO 22 7.843 8.101 7.876
159 H ARG 23 H ARG 23 5.926 4.256 11.260
160 HA ARG 23 HA ARG 23 4.201 3.028 9.344
161 HB2 ARG 23 2HB ARG 23 4.175 1.095 10.811
162 HB3 ARG 23 1HB ARG 23 5.812 1.716 10.660
163 HG2 ARG 23 2HG ARG 23 5.705 2.715 12.828
164 HG3 ARG 23 1HG ARG 23 3.993 2.323 12.985
165 HD2 ARG 23 2HD ARG 23 4.659 -0.107 12.802
166 HD3 ARG 23 1HD ARG 23 6.337 0.424 12.933
167 HE ARG 23 HE ARG 23 4.344 1.009 15.028
168 HH11 ARG 23 1HH1 ARG 23 7.452 -0.162 14.088
169 HH12 ARG 23 2HH1 ARG 23 7.943 -0.442 15.721
170 HH21 ARG 23 1HH2 ARG 23 5.002 0.654 17.096
171 HH22 ARG 23 2HH2 ARG 23 6.585 0.022 17.400
172 H LYS 24 H LYS 24 3.629 4.763 12.326
173 HA LYS 24 HA LYS 24 1.104 3.861 13.044
174 HB2 LYS 24 2HB LYS 24 2.201 6.682 13.172
175 HB3 LYS 24 1HB LYS 24 0.736 6.151 13.990
176 HG2 LYS 24 2HG LYS 24 2.067 4.529 15.284
177 HG3 LYS 24 1HG LYS 24 3.527 5.118 14.487
178 HD2 LYS 24 2HD LYS 24 3.124 7.362 15.428
179 HD3 LYS 24 1HD LYS 24 1.677 6.753 16.238
180 HE2 LYS 24 2HE LYS 24 3.094 5.148 17.483
181 HE3 LYS 24 1HE LYS 24 4.520 5.849 16.720
182 HZ1 LYS 24 3HZ LYS 24 4.028 7.949 17.769
183 HZ2 LYS 24 1HZ LYS 24 4.119 6.736 18.945
184 HZ3 LYS 24 2HZ LYS 24 2.613 7.326 18.450
185 H PHE 25 H PHE 25 1.703 6.757 11.011
186 HA PHE 25 HA PHE 25 -1.003 7.064 10.257
187 HB2 PHE 25 2HB PHE 25 1.506 8.112 8.929
188 HB3 PHE 25 1HB PHE 25 -0.129 8.643 8.545
189 HD1 PHE 25 HD1 PHE 25 -1.448 9.902 10.214
190 HD2 PHE 25 HD2 PHE 25 2.642 8.903 10.876
191 HE1 PHE 25 HE1 PHE 25 -1.326 11.588 12.000
192 HE2 PHE 25 HE2 PHE 25 2.766 10.589 12.665
193 HZ PHE 25 HZ PHE 25 0.780 11.933 13.228
194 H VAL 26 H VAL 26 1.730 5.534 8.548
195 HA VAL 26 HA VAL 26 0.393 5.073 6.118
196 HB VAL 26 HB VAL 26 2.645 3.426 7.304
197 HG11 VAL 26 1HG1 VAL 26 1.641 3.689 4.464
198 HG12 VAL 26 2HG1 VAL 26 1.571 2.252 5.484
199 HG13 VAL 26 3HG1 VAL 26 3.129 2.866 4.934
200 HG21 VAL 26 3HG2 VAL 26 3.251 5.790 7.164
201 HG22 VAL 26 1HG2 VAL 26 2.740 5.838 5.476
202 HG23 VAL 26 2HG2 VAL 26 4.128 4.856 5.950
203 H LEU 27 H LEU 27 0.872 2.843 8.880
204 HA LEU 27 HA LEU 27 -0.672 0.733 7.792
205 HB2 LEU 27 2HB LEU 27 -0.004 1.361 10.673
206 HB3 LEU 27 1HB LEU 27 -0.735 -0.138 10.127
207 HG LEU 27 HG LEU 27 2.025 0.863 9.383
208 HD11 LEU 27 1HD1 LEU 27 2.804 -1.077 10.678
209 HD12 LEU 27 2HD1 LEU 27 1.140 -1.417 11.157
210 HD13 LEU 27 3HD1 LEU 27 1.922 0.077 11.677
211 HD21 LEU 27 3HD2 LEU 27 1.004 -0.367 7.543
212 HD22 LEU 27 1HD2 LEU 27 0.619 -1.701 8.632
213 HD23 LEU 27 2HD2 LEU 27 2.302 -1.305 8.281
214 H ALA 28 H ALA 28 -1.508 3.492 9.846
215 HA ALA 28 HA ALA 28 -4.178 2.842 10.428
216 HB1 ALA 28 3HB ALA 28 -2.985 5.589 9.987
217 HB2 ALA 28 1HB ALA 28 -3.011 4.705 11.515
218 HB3 ALA 28 2HB ALA 28 -4.521 5.249 10.783
219 H ALA 29 H ALA 29 -2.802 4.612 7.666
220 HA ALA 29 HA ALA 29 -5.221 5.042 6.273
221 HB1 ALA 29 3HB ALA 29 -2.434 4.723 5.147
222 HB2 ALA 29 1HB ALA 29 -3.141 6.229 5.734
223 HB3 ALA 29 2HB ALA 29 -3.815 5.433 4.312
224 H LEU 30 H LEU 30 -2.800 2.471 6.039
225 HA LEU 30 HA LEU 30 -3.868 0.973 3.971
226 HB2 LEU 30 2HB LEU 30 -1.652 0.646 4.996
227 HB3 LEU 30 1HB LEU 30 -2.414 -0.014 6.430
228 HG LEU 30 HG LEU 30 -3.260 -1.919 5.095
229 HD11 LEU 30 1HD1 LEU 30 -2.428 -2.273 2.817
230 HD12 LEU 30 2HD1 LEU 30 -1.661 -0.684 2.846
231 HD13 LEU 30 3HD1 LEU 30 -3.418 -0.819 2.921
232 HD21 LEU 30 3HD2 LEU 30 -0.277 -1.463 4.877
233 HD22 LEU 30 1HD2 LEU 30 -1.093 -3.023 4.773
234 HD23 LEU 30 2HD2 LEU 30 -1.129 -2.110 6.280
235 H GLU 31 H GLU 31 -4.446 0.499 7.481
236 HA GLU 31 HA GLU 31 -6.184 -1.696 7.183
237 HB2 GLU 31 2HB GLU 31 -6.805 -1.350 9.515
238 HB3 GLU 31 1HB GLU 31 -5.068 -1.178 9.310
239 HG2 GLU 31 2HG GLU 31 -5.323 1.270 9.348
240 HG3 GLU 31 1HG GLU 31 -7.058 1.071 9.596
241 H GLN 32 H GLN 32 -6.877 1.779 7.386
242 HA GLN 32 HA GLN 32 -9.718 1.492 7.368
243 HB2 GLN 32 2HB GLN 32 -7.929 3.831 6.669
244 HB3 GLN 32 1HB GLN 32 -9.685 3.933 6.717
245 HG2 GLN 32 2HG GLN 32 -9.669 3.336 9.083
246 HG3 GLN 32 1HG GLN 32 -7.911 3.195 9.044
247 HE21 GLN 32 1HE2 GLN 32 -6.668 5.063 8.874
248 HE22 GLN 32 2HE2 GLN 32 -7.316 6.628 9.211
249 H SER 33 H SER 33 -7.286 1.658 4.870
250 HA SER 33 HA SER 33 -9.197 1.897 2.702
251 HB2 SER 33 2HB SER 33 -6.979 2.895 2.457
252 HB3 SER 33 1HB SER 33 -6.218 1.324 2.685
253 HG SER 33 HG SER 33 -7.787 0.863 0.739
254 H SER 34 H SER 34 -8.280 -0.613 4.677
255 HA SER 34 HA SER 34 -8.209 -2.725 2.691
256 HB2 SER 34 2HB SER 34 -8.179 -2.802 5.720
257 HB3 SER 34 1HB SER 34 -8.101 -4.240 4.703
258 HG SER 34 HG SER 34 -6.271 -2.081 4.536
259 H ASP 35 H ASP 35 -9.760 -4.273 2.311
260 HA ASP 35 HA ASP 35 -12.483 -3.702 3.035
261 HB2 ASP 35 2HB ASP 35 -11.238 -6.046 1.578
262 HB3 ASP 35 1HB ASP 35 -12.972 -5.798 1.765
263 H ASP 36 H ASP 36 -13.691 -6.069 3.574
264 HA ASP 36 HA ASP 36 -13.593 -6.207 6.314
265 HB2 ASP 36 2HB ASP 36 -15.426 -7.088 4.898
266 HB3 ASP 36 1HB ASP 36 -14.418 -8.470 4.481
267 H ALA 37 H ALA 37 -11.977 -8.464 4.075
268 HA ALA 37 HA ALA 37 -10.954 -10.088 6.226
269 HB1 ALA 37 3HB ALA 37 -9.964 -11.445 4.476
270 HB2 ALA 37 1HB ALA 37 -10.316 -10.199 3.278
271 HB3 ALA 37 2HB ALA 37 -11.636 -11.056 4.072
272 H GLY 38 H GLY 38 -9.992 -7.153 5.782
273 HA2 GLY 38 2HA GLY 38 -8.056 -6.050 6.362
274 HA3 GLY 38 1HA GLY 38 -7.385 -7.606 6.820
275 H TRP 39 H TRP 39 -8.445 -6.273 3.699
276 HA TRP 39 HA TRP 39 -5.686 -6.353 2.713
277 HB2 TRP 39 2HB TRP 39 -8.033 -7.759 1.426
278 HB3 TRP 39 1HB TRP 39 -6.566 -7.362 0.540
279 HD1 TRP 39 HD1 TRP 39 -8.015 -9.970 2.795
280 HE1 TRP 39 HE1 TRP 39 -6.225 -11.739 3.347
281 HE3 TRP 39 HE3 TRP 39 -3.894 -7.536 1.010
282 HZ2 TRP 39 HZ2 TRP 39 -3.434 -12.052 3.057
283 HZ3 TRP 39 HZ3 TRP 39 -1.704 -8.636 1.184
284 HH2 TRP 39 HH2 TRP 39 -1.481 -10.848 2.188
285 H ALA 40 H ALA 40 -5.201 -4.455 1.838
286 HA ALA 40 HA ALA 40 -7.375 -2.751 0.797
287 HB1 ALA 40 3HB ALA 40 -6.080 -1.831 2.671
288 HB2 ALA 40 1HB ALA 40 -5.899 -0.865 1.206
289 HB3 ALA 40 2HB ALA 40 -4.609 -1.957 1.707
290 H ASN 41 H ASN 41 -7.517 -2.491 -1.346
291 HA ASN 41 HA ASN 41 -5.609 -3.482 -3.178
292 HB2 ASN 41 2HB ASN 41 -8.046 -3.141 -3.679
293 HB3 ASN 41 1HB ASN 41 -7.753 -1.407 -3.721
294 HD21 ASN 41 1HD2 ASN 41 -8.698 -3.240 -5.818
295 HD22 ASN 41 2HD2 ASN 41 -7.599 -3.035 -7.135
296 H LEU 42 H LEU 42 -3.917 -2.563 -4.177
297 HA LEU 42 HA LEU 42 -2.388 -0.598 -3.080
298 HB2 LEU 42 2HB LEU 42 -1.622 -2.177 -4.782
299 HB3 LEU 42 1HB LEU 42 -2.576 -1.352 -6.000
300 HG LEU 42 HG LEU 42 -1.159 0.679 -5.664
301 HD11 LEU 42 1HD1 LEU 42 -0.389 0.226 -3.392
302 HD12 LEU 42 2HD1 LEU 42 0.974 0.453 -4.486
303 HD13 LEU 42 3HD1 LEU 42 0.522 -1.171 -3.967
304 HD21 LEU 42 3HD2 LEU 42 0.764 -0.197 -6.896
305 HD22 LEU 42 1HD2 LEU 42 -0.746 -0.877 -7.502
306 HD23 LEU 42 2HD2 LEU 42 0.302 -1.843 -6.463
307 H GLY 43 H GLY 43 -4.857 -0.123 -5.600
308 HA2 GLY 43 2HA GLY 43 -4.326 2.562 -6.233
309 HA3 GLY 43 1HA GLY 43 -5.881 1.769 -6.417
310 H ASN 44 H ASN 44 -6.704 1.280 -3.902
311 HA ASN 44 HA ASN 44 -7.578 3.819 -3.002
312 HB2 ASN 44 2HB ASN 44 -7.728 1.116 -1.648
313 HB3 ASN 44 1HB ASN 44 -8.574 2.560 -1.095
314 HD21 ASN 44 1HD2 ASN 44 -9.606 -0.014 -2.015
315 HD22 ASN 44 2HD2 ASN 44 -10.673 0.350 -3.321
316 H PHE 45 H PHE 45 -5.150 1.555 -1.734
317 HA PHE 45 HA PHE 45 -4.481 2.875 0.626
318 HB2 PHE 45 2HB PHE 45 -3.650 0.647 0.135
319 HB3 PHE 45 1HB PHE 45 -2.727 1.253 -1.236
320 HD1 PHE 45 HD1 PHE 45 -3.074 2.222 2.367
321 HD2 PHE 45 HD2 PHE 45 -0.452 1.222 -0.841
322 HE1 PHE 45 HE1 PHE 45 -1.138 2.548 3.848
323 HE2 PHE 45 HE2 PHE 45 1.487 1.552 0.639
324 HZ PHE 45 HZ PHE 45 1.142 2.215 2.985
325 H GLY 46 H GLY 46 -3.005 3.267 -2.612
326 HA2 GLY 46 2HA GLY 46 -1.162 5.275 -1.953
327 HA3 GLY 46 1HA GLY 46 -1.852 5.025 -3.549
328 H ASN 47 H ASN 47 -4.600 5.508 -2.526
329 HA ASN 47 HA ASN 47 -4.654 8.360 -2.858
330 HB2 ASN 47 2HB ASN 47 -6.401 6.925 -3.820
331 HB3 ASN 47 1HB ASN 47 -6.882 6.404 -2.211
332 HD21 ASN 47 1HD2 ASN 47 -8.334 7.814 -4.379
333 HD22 ASN 47 2HD2 ASN 47 -8.992 9.223 -3.629
334 H TYR 48 H TYR 48 -5.974 6.299 -0.216
335 HA TYR 48 HA TYR 48 -6.486 8.522 1.457
336 HB2 TYR 48 2HB TYR 48 -7.649 6.294 1.602
337 HB3 TYR 48 1HB TYR 48 -6.201 5.649 2.372
338 HD1 TYR 48 HD2 TYR 48 -8.552 8.537 2.732
339 HD2 TYR 48 HD1 TYR 48 -6.158 5.627 4.705
340 HE1 TYR 48 HE2 TYR 48 -9.354 9.361 4.903
341 HE2 TYR 48 HE1 TYR 48 -6.950 6.448 6.885
342 HH TYR 48 HH TYR 48 -9.581 8.627 7.179
343 H LEU 49 H LEU 49 -3.655 6.459 1.155
344 HA LEU 49 HA LEU 49 -2.351 7.061 3.552
345 HB2 LEU 49 2HB LEU 49 -1.523 5.336 2.081
346 HB3 LEU 49 1HB LEU 49 -1.204 6.507 0.815
347 HG LEU 49 HG LEU 49 0.570 7.523 2.174
348 HD11 LEU 49 1HD1 LEU 49 1.314 6.479 4.246
349 HD12 LEU 49 2HD1 LEU 49 -0.038 5.348 4.171
350 HD13 LEU 49 3HD1 LEU 49 -0.339 7.073 4.389
351 HD21 LEU 49 3HD2 LEU 49 1.156 5.726 0.635
352 HD22 LEU 49 1HD2 LEU 49 0.860 4.530 1.901
353 HD23 LEU 49 2HD2 LEU 49 2.181 5.687 2.068
354 H ASN 50 H ASN 50 -2.171 8.787 0.431
355 HA ASN 50 HA ASN 50 -0.294 10.727 1.262
356 HB2 ASN 50 2HB ASN 50 -0.856 10.205 -1.121
357 HB3 ASN 50 1HB ASN 50 -2.397 11.029 -0.901
358 HD21 ASN 50 1HD2 ASN 50 1.043 11.424 -1.172
359 HD22 ASN 50 2HD2 ASN 50 1.025 13.131 -1.412
360 H LYS 51 H LYS 51 -3.760 10.521 1.712
361 HA LYS 51 HA LYS 51 -4.259 13.229 2.382
362 HB2 LYS 51 2HB LYS 51 -5.688 10.749 3.381
363 HB3 LYS 51 1HB LYS 51 -6.295 12.396 3.495
364 HG2 LYS 51 2HG LYS 51 -6.314 12.523 1.024
365 HG3 LYS 51 1HG LYS 51 -5.794 10.838 0.962
366 HD2 LYS 51 2HD LYS 51 -8.110 10.709 0.676
367 HD3 LYS 51 1HD LYS 51 -7.887 10.346 2.385
368 HE2 LYS 51 2HE LYS 51 -8.656 13.050 1.266
369 HE3 LYS 51 1HE LYS 51 -9.782 11.885 1.953
370 HZ1 LYS 51 3HZ LYS 51 -8.593 12.082 4.071
371 HZ2 LYS 51 1HZ LYS 51 -9.221 13.565 3.561
372 HZ3 LYS 51 2HZ LYS 51 -7.572 13.247 3.398
373 H LEU 52 H LEU 52 -3.170 10.464 4.297
374 HA LEU 52 HA LEU 52 -3.160 11.978 6.769
375 HB2 LEU 52 2HB LEU 52 -1.982 9.251 6.204
376 HB3 LEU 52 1HB LEU 52 -2.249 9.960 7.787
377 HG LEU 52 HG LEU 52 -4.333 8.989 5.827
378 HD11 LEU 52 1HD1 LEU 52 -4.976 7.508 7.648
379 HD12 LEU 52 2HD1 LEU 52 -3.708 8.189 8.669
380 HD13 LEU 52 3HD1 LEU 52 -3.281 7.279 7.219
381 HD21 LEU 52 3HD2 LEU 52 -6.025 9.737 7.444
382 HD22 LEU 52 1HD2 LEU 52 -5.130 11.088 6.752
383 HD23 LEU 52 2HD2 LEU 52 -4.764 10.533 8.386
384 H GLN 53 H GLN 53 -0.763 10.770 4.452
385 HA GLN 53 HA GLN 53 1.248 12.531 5.713
386 HB2 GLN 53 2HB GLN 53 1.668 9.762 4.565
387 HB3 GLN 53 1HB GLN 53 2.979 10.850 4.999
388 HG2 GLN 53 2HG GLN 53 0.887 9.874 6.935
389 HG3 GLN 53 1HG GLN 53 2.450 9.098 6.700
390 HE21 GLN 53 1HE2 GLN 53 0.798 11.891 7.955
391 HE22 GLN 53 2HE2 GLN 53 2.126 12.514 8.861
392 HA PRO 54 HA PRO 54 0.863 13.749 1.252
393 HB2 PRO 54 2HB PRO 54 0.940 16.427 1.676
394 HB3 PRO 54 1HB PRO 54 -0.550 15.487 1.817
395 HG2 PRO 54 2HG PRO 54 1.301 16.436 3.980
396 HG3 PRO 54 1HG PRO 54 -0.472 16.478 3.929
397 HD2 PRO 54 2HD PRO 54 0.915 14.569 5.278
398 HD3 PRO 54 1HD PRO 54 -0.666 14.256 4.534
399 H ASP 55 H ASP 55 3.123 14.402 3.792
400 HA ASP 55 HA ASP 55 5.172 15.456 2.008
401 HB2 ASP 55 2HB ASP 55 4.879 16.390 4.277
402 HB3 ASP 55 1HB ASP 55 5.259 14.820 4.974
403 H PHE 56 H PHE 56 4.013 12.442 2.757
404 HA PHE 56 HA PHE 56 6.559 11.028 2.715
405 HB2 PHE 56 2HB PHE 56 4.702 10.240 4.164
406 HB3 PHE 56 1HB PHE 56 3.721 9.964 2.732
407 HD1 PHE 56 HD1 PHE 56 6.824 8.892 4.462
408 HD2 PHE 56 HD2 PHE 56 3.862 7.923 1.553
409 HE1 PHE 56 HE1 PHE 56 7.713 6.605 4.315
410 HE2 PHE 56 HE2 PHE 56 4.754 5.634 1.404
411 HZ PHE 56 HZ PHE 56 6.680 4.974 2.788
412 H ASP 57 H ASP 57 7.528 10.944 0.753
413 HA ASP 57 HA ASP 57 5.880 10.175 -1.573
414 HB2 ASP 57 2HB ASP 57 6.554 12.573 -1.651
415 HB3 ASP 57 1HB ASP 57 8.243 12.072 -1.623
416 H SER 58 H SER 58 6.683 8.615 -2.913
417 HA SER 58 HA SER 58 8.550 6.784 -1.863
418 HB2 SER 58 2HB SER 58 7.479 6.960 -4.693
419 HB3 SER 58 1HB SER 58 8.265 5.554 -3.980
420 HG SER 58 HG SER 58 5.700 6.550 -3.608
421 H ARG 59 H ARG 59 8.933 9.314 -4.326
422 HA ARG 59 HA ARG 59 11.370 8.400 -5.416
423 HB2 ARG 59 2HB ARG 59 10.417 11.266 -5.206
424 HB3 ARG 59 1HB ARG 59 11.661 10.668 -6.294
425 HG2 ARG 59 2HG ARG 59 8.728 9.957 -6.367
426 HG3 ARG 59 1HG ARG 59 9.578 11.026 -7.482
427 HD2 ARG 59 2HD ARG 59 10.002 8.054 -7.137
428 HD3 ARG 59 1HD ARG 59 9.254 8.863 -8.512
429 HE ARG 59 HE ARG 59 12.109 8.885 -7.828
430 HH11 ARG 59 1HH1 ARG 59 9.586 9.703 -10.028
431 HH12 ARG 59 2HH1 ARG 59 10.672 9.973 -11.343
432 HH21 ARG 59 1HH2 ARG 59 13.487 9.200 -9.516
433 HH22 ARG 59 2HH2 ARG 59 12.867 9.665 -11.066
434 H LEU 60 H LEU 60 10.677 10.187 -2.500
435 HA LEU 60 HA LEU 60 13.232 11.241 -1.947
436 HB2 LEU 60 2HB LEU 60 11.094 10.323 -0.015
437 HB3 LEU 60 1HB LEU 60 12.468 11.330 0.402
438 HG LEU 60 HG LEU 60 10.257 12.110 -1.514
439 HD11 LEU 60 1HD1 LEU 60 9.552 13.654 0.242
440 HD12 LEU 60 2HD1 LEU 60 10.803 13.022 1.314
441 HD13 LEU 60 3HD1 LEU 60 9.475 11.981 0.799
442 HD21 LEU 60 3HD2 LEU 60 12.374 13.164 -2.098
443 HD22 LEU 60 1HD2 LEU 60 12.592 13.699 -0.430
444 HD23 LEU 60 2HD2 LEU 60 11.272 14.350 -1.401
445 H TYR 61 H TYR 61 11.963 8.020 -1.630
446 HA TYR 61 HA TYR 61 14.278 7.130 -0.059
447 HB2 TYR 61 2HB TYR 61 11.761 5.664 -0.890
448 HB3 TYR 61 1HB TYR 61 13.048 4.972 0.092
449 HD1 TYR 61 HD1 TYR 61 10.272 7.388 0.036
450 HD2 TYR 61 HD2 TYR 61 13.313 5.600 2.417
451 HE1 TYR 61 HE1 TYR 61 9.189 8.259 2.061
452 HE2 TYR 61 HE2 TYR 61 12.234 6.462 4.449
453 HH TYR 61 HH TYR 61 9.102 7.748 4.466
454 H GLY 62 H GLY 62 13.586 7.565 -3.259
455 HA2 GLY 62 2HA GLY 62 15.167 7.035 -4.955
456 HA3 GLY 62 1HA GLY 62 15.647 5.616 -4.043
457 H TYR 63 H TYR 63 12.379 5.502 -3.957
458 HA TYR 63 HA TYR 63 12.304 3.480 -6.054
459 HB2 TYR 63 2HB TYR 63 10.173 4.314 -4.069
460 HB3 TYR 63 1HB TYR 63 10.093 2.915 -5.134
461 HD1 TYR 63 HD1 TYR 63 11.942 4.376 -2.269
462 HD2 TYR 63 HD2 TYR 63 11.086 0.855 -4.499
463 HE1 TYR 63 HE1 TYR 63 13.020 3.020 -0.528
464 HE2 TYR 63 HE2 TYR 63 12.165 -0.510 -2.769
465 HH TYR 63 HH TYR 63 13.784 -0.287 -0.957
466 H LYS 64 H LYS 64 11.004 3.525 -7.885
467 HA LYS 64 HA LYS 64 10.308 6.075 -8.955
468 HB2 LYS 64 2HB LYS 64 9.483 3.337 -9.958
469 HB3 LYS 64 1HB LYS 64 9.462 4.833 -10.881
470 HG2 LYS 64 2HG LYS 64 11.939 3.514 -9.779
471 HG3 LYS 64 1HG LYS 64 11.365 3.372 -11.440
472 HD2 LYS 64 2HD LYS 64 11.668 5.756 -11.785
473 HD3 LYS 64 1HD LYS 64 12.128 5.972 -10.094
474 HE2 LYS 64 2HE LYS 64 14.079 5.931 -11.597
475 HE3 LYS 64 1HE LYS 64 14.113 4.612 -10.426
476 HZ1 LYS 64 3HZ LYS 64 13.177 3.165 -12.197
477 HZ2 LYS 64 1HZ LYS 64 14.719 3.761 -12.553
478 HZ3 LYS 64 2HZ LYS 64 13.364 4.437 -13.296
479 H LYS 65 H LYS 65 8.373 3.358 -7.740
480 HA LYS 65 HA LYS 65 6.051 5.148 -7.448
481 HB2 LYS 65 2HB LYS 65 4.571 3.319 -8.258
482 HB3 LYS 65 1HB LYS 65 5.661 3.921 -9.499
483 HG2 LYS 65 2HG LYS 65 7.129 1.997 -9.175
484 HG3 LYS 65 1HG LYS 65 6.078 1.400 -7.888
485 HD2 LYS 65 2HD LYS 65 4.242 1.166 -9.510
486 HD3 LYS 65 1HD LYS 65 5.302 1.756 -10.792
487 HE2 LYS 65 2HE LYS 65 6.769 -0.165 -10.495
488 HE3 LYS 65 1HE LYS 65 5.783 -0.739 -9.152
489 HZ1 LYS 65 3HZ LYS 65 3.922 -0.983 -10.707
490 HZ2 LYS 65 1HZ LYS 65 5.245 -1.936 -11.158
491 HZ3 LYS 65 2HZ LYS 65 4.914 -0.498 -11.984
492 H LEU 66 H LEU 66 4.447 4.410 -5.908
493 HA LEU 66 HA LEU 66 5.484 3.533 -3.472
494 HB2 LEU 66 2HB LEU 66 3.404 4.828 -3.714
495 HB3 LEU 66 1HB LEU 66 2.616 3.437 -4.434
496 HG LEU 66 HG LEU 66 2.876 2.203 -2.294
497 HD11 LEU 66 1HD1 LEU 66 3.931 4.829 -1.239
498 HD12 LEU 66 2HD1 LEU 66 4.849 3.333 -1.418
499 HD13 LEU 66 3HD1 LEU 66 3.518 3.417 -0.264
500 HD21 LEU 66 3HD2 LEU 66 0.799 3.387 -2.757
501 HD22 LEU 66 1HD2 LEU 66 1.467 4.865 -2.061
502 HD23 LEU 66 2HD2 LEU 66 1.182 3.457 -1.037
503 H SER 67 H SER 67 3.852 1.699 -6.024
504 HA SER 67 HA SER 67 3.468 -0.764 -4.840
505 HB2 SER 67 2HB SER 67 4.598 -0.500 -7.633
506 HB3 SER 67 1HB SER 67 3.450 -1.695 -7.028
507 HG SER 67 HG SER 67 2.234 -0.246 -8.126
508 H ASP 68 H ASP 68 6.450 0.509 -6.269
509 HA ASP 68 HA ASP 68 7.974 -1.881 -5.959
510 HB2 ASP 68 2HB ASP 68 8.420 -0.003 -7.605
511 HB3 ASP 68 1HB ASP 68 9.016 0.948 -6.249
512 H LEU 69 H LEU 69 7.473 1.009 -4.024
513 HA LEU 69 HA LEU 69 9.468 0.583 -2.070
514 HB2 LEU 69 2HB LEU 69 8.432 2.741 -2.328
515 HB3 LEU 69 1HB LEU 69 6.847 2.079 -1.981
516 HG LEU 69 HG LEU 69 7.536 1.635 0.347
517 HD11 LEU 69 1HD1 LEU 69 9.632 2.552 1.211
518 HD12 LEU 69 2HD1 LEU 69 10.114 3.001 -0.425
519 HD13 LEU 69 3HD1 LEU 69 9.919 1.301 0.002
520 HD21 LEU 69 3HD2 LEU 69 6.428 3.733 -0.179
521 HD22 LEU 69 1HD2 LEU 69 7.980 4.485 -0.546
522 HD23 LEU 69 2HD2 LEU 69 7.618 3.965 1.101
523 H VAL 70 H VAL 70 5.981 -0.187 -2.018
524 HA VAL 70 HA VAL 70 5.863 -1.272 0.546
525 HB VAL 70 HB VAL 70 4.197 -2.072 -1.851
526 HG11 VAL 70 1HG1 VAL 70 3.624 -2.365 1.104
527 HG12 VAL 70 2HG1 VAL 70 3.983 -3.675 -0.021
528 HG13 VAL 70 3HG1 VAL 70 2.503 -2.735 -0.204
529 HG21 VAL 70 3HG2 VAL 70 3.670 0.049 0.238
530 HG22 VAL 70 1HG2 VAL 70 2.606 -0.389 -1.097
531 HG23 VAL 70 2HG2 VAL 70 4.173 0.353 -1.425
532 H LYS 71 H LYS 71 6.256 -3.057 -2.546
533 HA LYS 71 HA LYS 71 6.468 -5.605 -1.323
534 HB2 LYS 71 2HB LYS 71 7.178 -6.419 -3.504
535 HB3 LYS 71 1HB LYS 71 5.833 -5.301 -3.682
536 HG2 LYS 71 2HG LYS 71 7.450 -3.520 -4.294
537 HG3 LYS 71 1HG LYS 71 8.747 -4.711 -4.216
538 HD2 LYS 71 2HD LYS 71 6.344 -4.967 -6.032
539 HD3 LYS 71 1HD LYS 71 7.867 -4.231 -6.523
540 HE2 LYS 71 2HE LYS 71 7.801 -6.523 -7.282
541 HE3 LYS 71 1HE LYS 71 9.026 -6.357 -6.028
542 HZ1 LYS 71 3HZ LYS 71 7.601 -7.407 -4.460
543 HZ2 LYS 71 1HZ LYS 71 7.616 -8.370 -5.846
544 HZ3 LYS 71 2HZ LYS 71 6.287 -7.382 -5.525
545 H ALA 72 H ALA 72 8.795 -3.089 -1.778
546 HA ALA 72 HA ALA 72 11.105 -4.794 -1.436
547 HB1 ALA 72 3HB ALA 72 11.231 -2.704 -2.734
548 HB2 ALA 72 1HB ALA 72 12.387 -2.737 -1.402
549 HB3 ALA 72 2HB ALA 72 10.907 -1.788 -1.261
550 H ARG 73 H ARG 73 8.890 -3.131 0.628
551 HA ARG 73 HA ARG 73 10.678 -3.464 2.957
552 HB2 ARG 73 2HB ARG 73 8.252 -1.674 2.666
553 HB3 ARG 73 1HB ARG 73 9.315 -1.753 4.066
554 HG2 ARG 73 2HG ARG 73 10.099 -0.835 1.298
555 HG3 ARG 73 1HG ARG 73 9.802 0.202 2.696
556 HD2 ARG 73 2HD ARG 73 11.686 -0.739 3.862
557 HD3 ARG 73 1HD ARG 73 11.923 -1.946 2.599
558 HE ARG 73 HE ARG 73 12.197 0.349 1.241
559 HH11 ARG 73 1HH1 ARG 73 13.601 -0.782 4.162
560 HH12 ARG 73 2HH1 ARG 73 15.076 0.092 3.934
561 HH21 ARG 73 1HH2 ARG 73 14.089 1.448 0.920
562 HH22 ARG 73 2HH2 ARG 73 15.349 1.362 2.105
563 H THR 74 H THR 74 9.616 -5.793 2.259
564 HA THR 74 HA THR 74 7.011 -6.407 3.139
565 HB THR 74 HB THR 74 7.782 -8.793 3.191
566 HG1 THR 74 HG1 THR 74 10.203 -8.202 2.009
567 HG21 THR 74 3HG2 THR 74 8.581 -7.244 0.720
568 HG22 THR 74 1HG2 THR 74 6.941 -7.764 1.117
569 HG23 THR 74 2HG2 THR 74 8.193 -8.962 0.790
570 H ASP 75 H ASP 75 9.866 -5.863 4.989
571 HA ASP 75 HA ASP 75 9.185 -7.331 7.321
572 HB2 ASP 75 2HB ASP 75 11.432 -6.491 7.026
573 HB3 ASP 75 1HB ASP 75 10.854 -4.831 6.946
574 H LEU 76 H LEU 76 8.080 -4.320 6.015
575 HA LEU 76 HA LEU 76 6.532 -3.676 8.432
576 HB2 LEU 76 2HB LEU 76 7.075 -2.124 5.891
577 HB3 LEU 76 1HB LEU 76 6.005 -1.561 7.164
578 HG LEU 76 HG LEU 76 8.948 -2.136 7.593
579 HD11 LEU 76 1HD1 LEU 76 9.282 0.284 7.519
580 HD12 LEU 76 2HD1 LEU 76 7.587 0.517 7.087
581 HD13 LEU 76 3HD1 LEU 76 8.678 -0.316 5.974
582 HD21 LEU 76 3HD2 LEU 76 7.585 -2.256 9.621
583 HD22 LEU 76 1HD2 LEU 76 6.902 -0.665 9.277
584 HD23 LEU 76 2HD2 LEU 76 8.620 -0.829 9.650
585 H PHE 77 H PHE 77 6.094 -4.299 4.942
586 HA PHE 77 HA PHE 77 3.176 -4.489 5.402
587 HB2 PHE 77 2HB PHE 77 4.546 -3.696 2.819
588 HB3 PHE 77 1HB PHE 77 2.818 -3.652 3.160
589 HD1 PHE 77 HD1 PHE 77 2.272 -2.215 5.399
590 HD2 PHE 77 HD2 PHE 77 5.628 -1.667 2.827
591 HE1 PHE 77 HE1 PHE 77 2.496 0.108 6.183
592 HE2 PHE 77 HE2 PHE 77 5.859 0.652 3.616
593 HZ PHE 77 HZ PHE 77 4.298 1.538 5.296
594 H VAL 78 H VAL 78 2.013 -6.101 4.365
595 HA VAL 78 HA VAL 78 3.548 -8.334 3.200
596 HB VAL 78 HB VAL 78 0.721 -8.343 4.302
597 HG11 VAL 78 1HG1 VAL 78 2.492 -10.633 3.428
598 HG12 VAL 78 2HG1 VAL 78 1.056 -10.045 2.588
599 HG13 VAL 78 3HG1 VAL 78 0.902 -10.789 4.179
600 HG21 VAL 78 3HG2 VAL 78 2.363 -7.965 6.076
601 HG22 VAL 78 1HG2 VAL 78 3.259 -9.395 5.559
602 HG23 VAL 78 2HG2 VAL 78 1.630 -9.563 6.215
603 H THR 79 H THR 79 3.262 -8.855 1.078
604 HA THR 79 HA THR 79 1.137 -7.408 -0.403
605 HB THR 79 HB THR 79 2.598 -7.395 -2.363
606 HG1 THR 79 HG1 THR 79 3.833 -9.375 -1.223
607 HG21 THR 79 3HG2 THR 79 4.055 -6.379 0.091
608 HG22 THR 79 1HG2 THR 79 2.814 -5.506 -0.810
609 HG23 THR 79 2HG2 THR 79 4.360 -5.879 -1.573
610 H GLU 80 H GLU 80 -0.320 -8.600 -1.489
611 HA GLU 80 HA GLU 80 0.494 -11.182 -2.623
612 HB2 GLU 80 2HB GLU 80 -1.907 -10.796 -0.829
613 HB3 GLU 80 1HB GLU 80 -1.765 -12.150 -1.942
614 HG2 GLU 80 2HG GLU 80 0.366 -12.772 -0.795
615 HG3 GLU 80 1HG GLU 80 0.029 -11.514 0.393
616 H GLU 81 H GLU 81 -0.402 -11.676 -4.552
617 HA GLU 81 HA GLU 81 -1.962 -9.611 -5.894
618 HB2 GLU 81 2HB GLU 81 -0.828 -12.208 -6.966
619 HB3 GLU 81 1HB GLU 81 -1.510 -10.905 -7.926
620 HG2 GLU 81 2HG GLU 81 0.305 -9.432 -7.289
621 HG3 GLU 81 1HG GLU 81 0.962 -10.666 -6.213
622 H ARG 82 H ARG 82 -4.128 -9.709 -5.935
623 HA ARG 82 HA ARG 82 -5.444 -12.332 -5.552
624 HB2 ARG 82 2HB ARG 82 -6.582 -9.624 -4.813
625 HB3 ARG 82 1HB ARG 82 -7.196 -11.207 -4.353
626 HG2 ARG 82 2HG ARG 82 -4.580 -10.009 -3.441
627 HG3 ARG 82 1HG ARG 82 -6.062 -10.068 -2.491
628 HD2 ARG 82 2HD ARG 82 -4.736 -12.555 -3.555
629 HD3 ARG 82 1HD ARG 82 -4.275 -11.831 -2.018
630 HE ARG 82 HE ARG 82 -7.079 -12.555 -2.464
631 HH11 ARG 82 1HH1 ARG 82 -4.087 -13.127 -0.832
632 HH12 ARG 82 2HH1 ARG 82 -4.820 -14.098 0.390
633 HH21 ARG 82 1HH2 ARG 82 -7.991 -13.811 -0.888
634 HH22 ARG 82 2HH2 ARG 82 -6.998 -14.498 0.351
635 H GLN 83 H GLN 83 -6.638 -13.004 -7.263
636 HA GLN 83 HA GLN 83 -6.890 -11.274 -9.558
637 HB2 GLN 83 2HB GLN 83 -6.253 -13.691 -9.697
638 HB3 GLN 83 1HB GLN 83 -7.897 -14.107 -9.229
639 HG2 GLN 83 2HG GLN 83 -8.759 -13.018 -11.235
640 HG3 GLN 83 1HG GLN 83 -7.121 -12.551 -11.693
641 HE21 GLN 83 1HE2 GLN 83 -9.391 -15.145 -11.463
642 HE22 GLN 83 2HE2 GLN 83 -8.486 -16.288 -12.382
643 H VAL 84 H VAL 84 -8.703 -10.376 -10.401
644 HA VAL 84 HA VAL 84 -10.967 -10.167 -8.573
645 HB VAL 84 HB VAL 84 -10.425 -8.614 -11.114
646 HG11 VAL 84 1HG1 VAL 84 -12.777 -8.578 -10.450
647 HG12 VAL 84 2HG1 VAL 84 -12.033 -6.997 -10.202
648 HG13 VAL 84 3HG1 VAL 84 -12.322 -8.061 -8.824
649 HG21 VAL 84 3HG2 VAL 84 -8.626 -8.287 -9.488
650 HG22 VAL 84 1HG2 VAL 84 -9.810 -7.868 -8.248
651 HG23 VAL 84 2HG2 VAL 84 -9.600 -6.826 -9.656
652 HA PRO 85 HA PRO 85 -13.432 -12.930 -11.202
653 HB2 PRO 85 2HB PRO 85 -15.747 -12.622 -9.750
654 HB3 PRO 85 1HB PRO 85 -14.469 -13.769 -9.342
655 HG2 PRO 85 2HG PRO 85 -15.034 -11.071 -8.188
656 HG3 PRO 85 1HG PRO 85 -14.507 -12.553 -7.371
657 HD2 PRO 85 2HD PRO 85 -12.807 -10.515 -7.955
658 HD3 PRO 85 1HD PRO 85 -12.287 -12.211 -7.914
659 H GLY 86 H GLY 86 -14.394 -12.328 -13.061
660 HA2 GLY 86 2HA GLY 86 -15.906 -11.026 -14.386
661 HA3 GLY 86 1HA GLY 86 -15.805 -9.737 -13.196
662 H SER 87 H SER 87 -12.734 -10.718 -13.474
663 HA SER 87 HA SER 87 -12.077 -9.118 -15.865
664 HB2 SER 87 2HB SER 87 -10.692 -8.906 -13.171
665 HB3 SER 87 1HB SER 87 -10.217 -8.053 -14.637
666 HG SER 87 HG SER 87 -12.622 -7.339 -14.454
667 H THR 88 H THR 88 -9.980 -9.631 -16.806
668 HA THR 88 HA THR 88 -9.104 -12.374 -16.257
669 HB THR 88 HB THR 88 -9.415 -11.757 -18.605
670 HG1 THR 88 HG1 THR 88 -6.616 -12.048 -18.153
671 HG21 THR 88 3HG2 THR 88 -7.894 -10.165 -19.709
672 HG22 THR 88 1HG2 THR 88 -7.185 -9.759 -18.144
673 HG23 THR 88 2HG2 THR 88 -8.874 -9.371 -18.477
674 H GLN 89 H GLN 89 -8.183 -9.198 -15.455
675 HA GLN 89 HA GLN 89 -5.375 -9.881 -15.002
676 HB2 GLN 89 2HB GLN 89 -5.057 -7.505 -14.545
677 HB3 GLN 89 1HB GLN 89 -5.885 -7.735 -16.081
678 HG2 GLN 89 2HG GLN 89 -8.019 -7.182 -15.034
679 HG3 GLN 89 1HG GLN 89 -7.216 -6.998 -13.475
680 HE21 GLN 89 1HE2 GLN 89 -7.711 -5.604 -16.620
681 HE22 GLN 89 2HE2 GLN 89 -7.049 -4.051 -16.253
682 H LYS 90 H LYS 90 -4.347 -9.381 -12.961
683 HA LYS 90 HA LYS 90 -6.090 -9.916 -10.649
684 HB2 LYS 90 2HB LYS 90 -4.006 -10.584 -9.491
685 HB3 LYS 90 1HB LYS 90 -4.291 -11.516 -10.955
686 HG2 LYS 90 2HG LYS 90 -2.660 -10.121 -12.155
687 HG3 LYS 90 1HG LYS 90 -2.364 -9.207 -10.676
688 HD2 LYS 90 2HD LYS 90 -0.613 -10.856 -10.972
689 HD3 LYS 90 1HD LYS 90 -1.598 -11.289 -9.574
690 HE2 LYS 90 2HE LYS 90 -2.809 -12.931 -10.937
691 HE3 LYS 90 1HE LYS 90 -1.834 -12.492 -12.338
692 HZ1 LYS 90 3HZ LYS 90 -0.978 -14.480 -11.326
693 HZ2 LYS 90 1HZ LYS 90 -0.843 -13.720 -9.825
694 HZ3 LYS 90 2HZ LYS 90 0.141 -13.233 -11.109
695 H ALA 91 H ALA 91 -5.949 -8.675 -8.737
696 HA ALA 91 HA ALA 91 -4.692 -6.016 -9.055
697 HB1 ALA 91 3HB ALA 91 -7.139 -5.935 -8.910
698 HB2 ALA 91 1HB ALA 91 -6.385 -5.159 -7.515
699 HB3 ALA 91 2HB ALA 91 -7.078 -6.776 -7.359
700 H LEU 92 H LEU 92 -3.473 -5.156 -7.349
701 HA LEU 92 HA LEU 92 -2.355 -7.181 -5.566
702 HB2 LEU 92 2HB LEU 92 -0.827 -5.781 -6.857
703 HB3 LEU 92 1HB LEU 92 -1.501 -4.335 -6.129
704 HG LEU 92 HG LEU 92 -0.689 -5.203 -3.889
705 HD11 LEU 92 1HD1 LEU 92 0.824 -7.145 -5.637
706 HD12 LEU 92 2HD1 LEU 92 -0.456 -7.552 -4.492
707 HD13 LEU 92 3HD1 LEU 92 1.073 -6.895 -3.909
708 HD21 LEU 92 3HD2 LEU 92 0.494 -3.440 -5.095
709 HD22 LEU 92 1HD2 LEU 92 1.398 -4.652 -6.004
710 HD23 LEU 92 2HD2 LEU 92 1.627 -4.502 -4.262
711 H TYR 93 H TYR 93 -3.000 -7.420 -3.534
712 HA TYR 93 HA TYR 93 -4.177 -5.112 -2.116
713 HB2 TYR 93 2HB TYR 93 -4.728 -8.066 -1.854
714 HB3 TYR 93 1HB TYR 93 -5.211 -6.909 -0.618
715 HD1 TYR 93 HD1 TYR 93 -5.557 -7.526 -4.302
716 HD2 TYR 93 HD2 TYR 93 -7.284 -5.883 -0.772
717 HE1 TYR 93 HE1 TYR 93 -7.621 -7.028 -5.546
718 HE2 TYR 93 HE2 TYR 93 -9.348 -5.386 -2.005
719 HH TYR 93 HH TYR 93 -10.133 -5.060 -4.214
720 H LEU 94 H LEU 94 -3.578 -4.680 0.003
721 HA LEU 94 HA LEU 94 -1.022 -5.905 0.863
722 HB2 LEU 94 2HB LEU 94 -1.779 -2.989 1.160
723 HB3 LEU 94 1HB LEU 94 -0.220 -3.722 1.491
724 HG LEU 94 HG LEU 94 -1.470 -3.420 -1.250
725 HD11 LEU 94 1HD1 LEU 94 0.306 -1.771 -1.633
726 HD12 LEU 94 2HD1 LEU 94 0.813 -1.926 0.049
727 HD13 LEU 94 3HD1 LEU 94 -0.782 -1.276 -0.337
728 HD21 LEU 94 3HD2 LEU 94 1.245 -4.458 -0.432
729 HD22 LEU 94 1HD2 LEU 94 0.726 -4.134 -2.087
730 HD23 LEU 94 2HD2 LEU 94 -0.066 -5.398 -1.147
731 H ARG 95 H ARG 95 -0.623 -5.998 3.114
732 HA ARG 95 HA ARG 95 -2.505 -4.773 4.975
733 HB2 ARG 95 2HB ARG 95 -2.791 -6.817 6.331
734 HB3 ARG 95 1HB ARG 95 -3.519 -6.969 4.737
735 HG2 ARG 95 2HG ARG 95 -1.786 -8.393 3.980
736 HG3 ARG 95 1HG ARG 95 -0.784 -8.041 5.389
737 HD2 ARG 95 2HD ARG 95 -1.936 -10.271 5.432
738 HD3 ARG 95 1HD ARG 95 -2.238 -9.245 6.833
739 HE ARG 95 HE ARG 95 -4.260 -8.913 4.861
740 HH11 ARG 95 1HH1 ARG 95 -3.177 -11.019 7.356
741 HH12 ARG 95 2HH1 ARG 95 -4.746 -11.681 7.646
742 HH21 ARG 95 1HH2 ARG 95 -6.273 -9.796 5.207
743 HH22 ARG 95 2HH2 ARG 95 -6.481 -11.010 6.416
744 H ALA 96 H ALA 96 -1.702 -5.063 7.305
745 HA ALA 96 HA ALA 96 1.074 -4.305 7.374
746 HB1 ALA 96 3HB ALA 96 -0.606 -3.222 8.799
747 HB2 ALA 96 1HB ALA 96 0.705 -3.923 9.749
748 HB3 ALA 96 2HB ALA 96 -0.854 -4.744 9.658
749 H LYS 97 H LYS 97 2.824 -5.390 8.237
750 HA LYS 97 HA LYS 97 2.659 -8.260 8.518
751 HB2 LYS 97 2HB LYS 97 4.616 -7.245 7.471
752 HB3 LYS 97 1HB LYS 97 4.955 -6.327 8.929
753 HG2 LYS 97 2HG LYS 97 6.485 -8.112 8.932
754 HG3 LYS 97 1HG LYS 97 5.252 -8.547 10.111
755 HD2 LYS 97 2HD LYS 97 5.783 -10.495 8.803
756 HD3 LYS 97 1HD LYS 97 4.158 -9.959 8.372
757 HE2 LYS 97 2HE LYS 97 4.940 -8.986 6.333
758 HE3 LYS 97 1HE LYS 97 6.623 -9.210 6.799
759 HZ1 LYS 97 3HZ LYS 97 5.944 -10.869 5.202
760 HZ2 LYS 97 1HZ LYS 97 4.683 -11.382 6.205
761 HZ3 LYS 97 2HZ LYS 97 6.287 -11.609 6.685
762 H LEU 98 H LEU 98 1.890 -9.155 10.354
763 HA LEU 98 HA LEU 98 2.512 -7.846 12.934
764 HB2 LEU 98 2HB LEU 98 0.039 -9.398 12.152
765 HB3 LEU 98 1HB LEU 98 0.373 -8.808 13.770
766 HG LEU 98 HG LEU 98 -0.050 -7.087 11.316
767 HD11 LEU 98 1HD1 LEU 98 -1.808 -7.569 13.722
768 HD12 LEU 98 2HD1 LEU 98 -2.114 -8.119 12.074
769 HD13 LEU 98 3HD1 LEU 98 -2.116 -6.396 12.442
770 HD21 LEU 98 3HD2 LEU 98 -0.001 -5.197 12.868
771 HD22 LEU 98 1HD2 LEU 98 1.536 -6.062 12.867
772 HD23 LEU 98 2HD2 LEU 98 0.397 -6.288 14.195
773 H GLU 99 H GLU 99 3.958 -8.975 14.036
774 HA GLU 99 HA GLU 99 3.403 -11.717 14.738
775 HB2 GLU 99 2HB GLU 99 5.594 -12.613 14.078
776 HB3 GLU 99 1HB GLU 99 4.670 -12.070 12.690
777 HG2 GLU 99 2HG GLU 99 6.713 -11.244 12.138
778 HG3 GLU 99 1HG GLU 99 6.073 -9.865 13.026
779 H HIS 100 H HIS 100 5.750 -12.389 16.060
780 HA HIS 100 HA HIS 100 6.669 -10.231 17.704
781 HB2 HIS 100 2HB HIS 100 5.612 -11.220 19.850
782 HB3 HIS 100 1HB HIS 100 4.611 -10.221 18.805
783 HD1 HIS 100 HD1 HIS 100 2.344 -11.147 18.745
784 HD2 HIS 100 HD2 HIS 100 5.203 -14.163 18.779
785 HE1 HIS 100 HE1 HIS 100 1.055 -13.295 18.596
786 HE2 HIS 100 HE2 HIS 100 2.810 -15.084 18.413
787 H HIS 101 H HIS 101 6.973 -13.359 16.595
788 HA HIS 101 HA HIS 101 8.457 -15.045 16.902
789 HB2 HIS 101 2HB HIS 101 9.923 -13.000 18.580
790 HB3 HIS 101 1HB HIS 101 10.587 -14.562 18.113
791 HD1 HIS 101 HD1 HIS 101 10.855 -14.925 15.461
792 HD2 HIS 101 HD2 HIS 101 10.293 -11.011 16.734
793 HE1 HIS 101 HE1 HIS 101 11.586 -13.487 13.542
794 HE2 HIS 101 HE2 HIS 101 11.069 -11.135 14.268
795 H HIS 102 H HIS 102 7.016 -13.658 19.735
796 HA HIS 102 HA HIS 102 8.054 -15.466 21.650
797 HB2 HIS 102 2HB HIS 102 7.125 -13.228 22.201
798 HB3 HIS 102 1HB HIS 102 5.517 -13.823 21.804
799 HD1 HIS 102 HD1 HIS 102 4.469 -15.578 23.475
800 HD2 HIS 102 HD2 HIS 102 8.080 -13.933 24.707
801 HE1 HIS 102 HE1 HIS 102 4.670 -16.138 25.910
802 HE2 HIS 102 HE2 HIS 102 6.950 -15.315 26.570
803 H HIS 103 H HIS 103 7.687 -17.489 20.432
804 HA HIS 103 HA HIS 103 4.992 -18.582 20.912
805 HB2 HIS 103 2HB HIS 103 6.188 -18.931 18.680
806 HB3 HIS 103 1HB HIS 103 7.309 -19.976 19.542
807 HD1 HIS 103 HD1 HIS 103 6.689 -22.380 19.493
808 HD2 HIS 103 HD2 HIS 103 3.377 -19.912 19.005
809 HE1 HIS 103 HE1 HIS 103 4.747 -23.922 19.099
810 HE2 HIS 103 HE2 HIS 103 2.780 -22.411 18.697
811 H HIS 104 H HIS 104 8.328 -18.737 21.911
812 HA HIS 104 HA HIS 104 7.635 -20.532 24.149
813 HB2 HIS 104 2HB HIS 104 10.336 -19.507 23.216
814 HB3 HIS 104 1HB HIS 104 10.079 -20.606 24.565
815 HD1 HIS 104 HD1 HIS 104 8.923 -22.972 23.851
816 HD2 HIS 104 HD2 HIS 104 10.717 -20.758 20.825
817 HE1 HIS 104 HE1 HIS 104 9.305 -24.588 21.967
818 HE2 HIS 104 HE2 HIS 104 10.234 -23.192 20.098
819 H HIS 105 H HIS 105 9.109 -19.733 26.210
820 HA HIS 105 HA HIS 105 7.959 -17.292 27.079
821 HB2 HIS 105 2HB HIS 105 9.583 -17.533 29.039
822 HB3 HIS 105 1HB HIS 105 8.414 -18.821 28.795
823 HD1 HIS 105 HD1 HIS 105 12.061 -18.132 27.924
824 HD2 HIS 105 HD2 HIS 105 9.523 -21.288 28.839
825 HE1 HIS 105 HE1 HIS 105 13.533 -20.156 28.066
826 HE2 HIS 105 HE2 HIS 105 12.003 -22.011 28.790
Start of MODEL 11
1 H1 MET 1 1H MET 1 36.913 33.966 33.103
2 H2 MET 1 2H MET 1 38.472 33.831 32.467
3 H3 MET 1 3H MET 1 37.718 32.479 33.143
4 HA MET 1 HA MET 1 36.061 32.461 31.416
5 HB2 MET 1 2HB MET 1 37.616 34.817 30.314
6 HB3 MET 1 1HB MET 1 36.308 33.987 29.479
7 HG2 MET 1 2HG MET 1 34.736 34.668 31.197
8 HG3 MET 1 1HG MET 1 36.036 35.441 32.106
9 HE1 MET 1 3HE MET 1 34.572 36.910 27.974
10 HE2 MET 1 1HE MET 1 33.881 35.523 28.815
11 HE3 MET 1 2HE MET 1 35.527 35.442 28.183
12 H ASP 2 H ASP 2 36.837 30.477 30.908
13 HA ASP 2 HA ASP 2 39.490 30.277 29.632
14 HB2 ASP 2 2HB ASP 2 37.882 28.109 31.005
15 HB3 ASP 2 1HB ASP 2 39.533 27.970 30.407
16 H GLN 3 H GLN 3 39.694 29.518 27.604
17 HA GLN 3 HA GLN 3 37.417 28.075 26.401
18 HB2 GLN 3 2HB GLN 3 37.966 28.945 24.242
19 HB3 GLN 3 1HB GLN 3 37.878 30.302 25.350
20 HG2 GLN 3 2HG GLN 3 40.423 29.011 24.369
21 HG3 GLN 3 1HG GLN 3 39.720 30.498 23.741
22 HE21 GLN 3 1HE2 GLN 3 42.320 30.061 24.920
23 HE22 GLN 3 2HE2 GLN 3 42.426 31.118 26.283
24 H LYS 4 H LYS 4 37.786 26.048 25.709
25 HA LYS 4 HA LYS 4 40.301 24.819 26.316
26 HB2 LYS 4 2HB LYS 4 37.826 23.706 24.970
27 HB3 LYS 4 1HB LYS 4 39.208 22.741 25.473
28 HG2 LYS 4 2HG LYS 4 37.444 24.364 27.310
29 HG3 LYS 4 1HG LYS 4 37.368 22.614 27.083
30 HD2 LYS 4 2HD LYS 4 39.643 22.385 27.939
31 HD3 LYS 4 1HD LYS 4 39.767 24.135 28.121
32 HE2 LYS 4 2HE LYS 4 37.997 24.113 29.789
33 HE3 LYS 4 1HE LYS 4 37.772 22.379 29.561
34 HZ1 LYS 4 3HZ LYS 4 40.232 23.681 30.596
35 HZ2 LYS 4 1HZ LYS 4 40.020 22.019 30.378
36 HZ3 LYS 4 2HZ LYS 4 39.096 22.846 31.527
37 H SER 5 H SER 5 41.989 25.318 25.032
38 HA SER 5 HA SER 5 41.781 25.768 22.219
39 HB2 SER 5 2HB SER 5 44.300 25.205 23.814
40 HB3 SER 5 1HB SER 5 44.187 26.032 22.260
41 HG SER 5 HG SER 5 43.417 27.796 23.225
42 H SER 6 H SER 6 40.714 23.782 21.564
43 HA SER 6 HA SER 6 42.229 21.291 21.792
44 HB2 SER 6 2HB SER 6 39.468 21.806 20.646
45 HB3 SER 6 1HB SER 6 40.198 20.219 20.884
46 HG SER 6 HG SER 6 38.725 21.407 22.593
47 H SER 7 H SER 7 42.982 20.075 20.067
48 HA SER 7 HA SER 7 42.972 21.408 17.424
49 HB2 SER 7 2HB SER 7 45.228 19.837 18.700
50 HB3 SER 7 1HB SER 7 45.219 20.393 17.027
51 HG SER 7 HG SER 7 46.315 21.904 18.211
52 HA PRO 8 HA PRO 8 41.262 17.270 16.493
53 HB2 PRO 8 2HB PRO 8 39.345 18.064 14.806
54 HB3 PRO 8 1HB PRO 8 39.162 18.284 16.551
55 HG2 PRO 8 2HG PRO 8 39.943 20.284 14.462
56 HG3 PRO 8 1HG PRO 8 38.851 20.479 15.845
57 HD2 PRO 8 2HD PRO 8 41.506 21.281 15.798
58 HD3 PRO 8 1HD PRO 8 40.566 20.966 17.270
59 H GLN 9 H GLN 9 40.251 17.193 13.720
60 HA GLN 9 HA GLN 9 42.473 18.024 12.024
61 HB2 GLN 9 2HB GLN 9 42.828 15.813 11.065
62 HB3 GLN 9 1HB GLN 9 43.128 15.766 12.795
63 HG2 GLN 9 2HG GLN 9 40.557 14.865 11.499
64 HG3 GLN 9 1HG GLN 9 41.896 13.791 11.900
65 HE21 GLN 9 1HE2 GLN 9 42.314 13.330 14.066
66 HE22 GLN 9 2HE2 GLN 9 41.175 13.670 15.316
67 HA PRO 10 HA PRO 10 39.222 18.766 9.056
68 HB2 PRO 10 2HB PRO 10 41.068 17.672 7.000
69 HB3 PRO 10 1HB PRO 10 40.260 19.242 7.064
70 HG2 PRO 10 2HG PRO 10 42.874 19.036 7.567
71 HG3 PRO 10 1HG PRO 10 41.851 20.158 8.487
72 HD2 PRO 10 2HD PRO 10 42.937 17.481 9.292
73 HD3 PRO 10 1HD PRO 10 42.754 18.961 10.258
74 H ALA 11 H ALA 11 37.512 17.584 8.354
75 HA ALA 11 HA ALA 11 37.886 14.665 8.073
76 HB1 ALA 11 3HB ALA 11 35.442 16.153 9.024
77 HB2 ALA 11 1HB ALA 11 36.601 15.310 10.049
78 HB3 ALA 11 2HB ALA 11 35.613 14.401 8.905
79 H ALA 12 H ALA 12 36.757 13.546 6.473
80 HA ALA 12 HA ALA 12 35.518 15.192 4.349
81 HB1 ALA 12 3HB ALA 12 36.444 13.613 2.712
82 HB2 ALA 12 1HB ALA 12 37.228 12.721 4.018
83 HB3 ALA 12 2HB ALA 12 37.715 14.380 3.663
84 H GLN 13 H GLN 13 34.261 13.752 6.629
85 HA GLN 13 HA GLN 13 33.138 11.304 5.676
86 HB2 GLN 13 2HB GLN 13 32.190 13.062 7.953
87 HB3 GLN 13 1HB GLN 13 31.739 11.385 7.685
88 HG2 GLN 13 2HG GLN 13 34.502 12.400 8.336
89 HG3 GLN 13 1HG GLN 13 33.406 11.576 9.444
90 HE21 GLN 13 1HE2 GLN 13 33.086 9.350 9.206
91 HE22 GLN 13 2HE2 GLN 13 34.140 8.366 8.257
92 H ALA 14 H ALA 14 31.169 10.877 4.761
93 HA ALA 14 HA ALA 14 29.641 13.215 3.797
94 HB1 ALA 14 3HB ALA 14 30.713 11.866 2.044
95 HB2 ALA 14 1HB ALA 14 28.954 11.842 1.914
96 HB3 ALA 14 2HB ALA 14 29.809 10.451 2.585
97 HA PRO 15 HA PRO 15 26.412 11.508 6.533
98 HB2 PRO 15 2HB PRO 15 24.985 13.984 5.788
99 HB3 PRO 15 1HB PRO 15 25.472 13.406 7.385
100 HG2 PRO 15 2HG PRO 15 26.680 15.508 6.205
101 HG3 PRO 15 1HG PRO 15 27.566 14.377 7.247
102 HD2 PRO 15 2HD PRO 15 27.472 14.512 4.243
103 HD3 PRO 15 1HD PRO 15 28.865 14.246 5.316
104 H GLU 16 H GLU 16 24.977 10.046 5.789
105 HA GLU 16 HA GLU 16 23.966 10.246 3.072
106 HB2 GLU 16 2HB GLU 16 23.050 7.946 3.527
107 HB3 GLU 16 1HB GLU 16 24.791 8.096 3.649
108 HG2 GLU 16 2HG GLU 16 24.254 6.753 5.454
109 HG3 GLU 16 1HG GLU 16 24.403 8.354 6.175
110 H THR 17 H THR 17 21.580 9.314 2.845
111 HA THR 17 HA THR 17 19.851 10.907 4.644
112 HB THR 17 HB THR 17 19.599 10.655 1.629
113 HG1 THR 17 HG1 THR 17 20.241 12.733 1.597
114 HG21 THR 17 3HG2 THR 17 17.779 12.060 3.600
115 HG22 THR 17 1HG2 THR 17 17.376 10.612 2.675
116 HG23 THR 17 2HG2 THR 17 17.650 12.144 1.844
117 H LYS 18 H LYS 18 18.521 9.634 5.732
118 HA LYS 18 HA LYS 18 16.979 7.618 4.269
119 HB2 LYS 18 2HB LYS 18 18.866 6.419 5.333
120 HB3 LYS 18 1HB LYS 18 18.380 7.054 6.898
121 HG2 LYS 18 2HG LYS 18 16.291 5.827 6.788
122 HG3 LYS 18 1HG LYS 18 16.690 5.251 5.168
123 HD2 LYS 18 2HD LYS 18 17.139 3.519 6.818
124 HD3 LYS 18 1HD LYS 18 18.646 4.066 6.081
125 HE2 LYS 18 2HE LYS 18 18.939 3.801 8.479
126 HE3 LYS 18 1HE LYS 18 19.058 5.505 8.045
127 HZ1 LYS 18 3HZ LYS 18 16.799 5.834 8.799
128 HZ2 LYS 18 1HZ LYS 18 17.720 5.150 10.039
129 HZ3 LYS 18 2HZ LYS 18 16.639 4.193 9.163
130 H GLN 19 H GLN 19 14.931 8.295 4.515
131 HA GLN 19 HA GLN 19 14.121 9.844 6.823
132 HB2 GLN 19 2HB GLN 19 12.466 8.864 4.486
133 HB3 GLN 19 1HB GLN 19 11.959 10.049 5.681
134 HG2 GLN 19 2HG GLN 19 14.170 10.361 3.658
135 HG3 GLN 19 1HG GLN 19 12.598 11.156 3.641
136 HE21 GLN 19 1HE2 GLN 19 15.257 12.332 3.641
137 HE22 GLN 19 2HE2 GLN 19 15.344 13.344 5.039
138 H ALA 20 H ALA 20 12.305 9.301 8.191
139 HA ALA 20 HA ALA 20 12.352 6.485 8.927
140 HB1 ALA 20 3HB ALA 20 11.229 7.209 10.971
141 HB2 ALA 20 1HB ALA 20 11.054 8.835 10.311
142 HB3 ALA 20 2HB ALA 20 12.659 8.191 10.654
143 H PHE 21 H PHE 21 10.853 5.078 8.253
144 HA PHE 21 HA PHE 21 8.386 5.822 7.025
145 HB2 PHE 21 2HB PHE 21 9.377 3.152 8.062
146 HB3 PHE 21 1HB PHE 21 7.879 3.363 7.166
147 HD1 PHE 21 HD1 PHE 21 8.107 4.489 4.820
148 HD2 PHE 21 HD2 PHE 21 11.327 2.641 6.914
149 HE1 PHE 21 HE1 PHE 21 9.319 4.198 2.700
150 HE2 PHE 21 HE2 PHE 21 12.539 2.351 4.795
151 HZ PHE 21 HZ PHE 21 11.537 3.128 2.686
152 HA PRO 22 HA PRO 22 6.288 6.050 11.054
153 HB2 PRO 22 2HB PRO 22 4.322 7.728 10.354
154 HB3 PRO 22 1HB PRO 22 5.979 8.304 10.567
155 HG2 PRO 22 2HG PRO 22 4.483 7.731 8.042
156 HG3 PRO 22 1HG PRO 22 5.628 9.037 8.395
157 HD2 PRO 22 2HD PRO 22 6.234 6.669 7.037
158 HD3 PRO 22 1HD PRO 22 7.419 7.762 7.779
159 H ARG 23 H ARG 23 5.507 3.913 11.171
160 HA ARG 23 HA ARG 23 3.566 2.988 9.253
161 HB2 ARG 23 2HB ARG 23 3.661 0.848 10.397
162 HB3 ARG 23 1HB ARG 23 5.274 1.460 10.079
163 HG2 ARG 23 2HG ARG 23 5.456 2.166 12.428
164 HG3 ARG 23 1HG ARG 23 3.849 1.498 12.736
165 HD2 ARG 23 2HD ARG 23 4.690 -0.721 11.957
166 HD3 ARG 23 1HD ARG 23 6.304 -0.019 11.830
167 HE ARG 23 HE ARG 23 5.082 0.233 14.435
168 HH11 ARG 23 1HH1 ARG 23 7.091 -1.690 12.391
169 HH12 ARG 23 2HH1 ARG 23 7.820 -2.532 13.710
170 HH21 ARG 23 1HH2 ARG 23 6.013 -0.887 16.123
171 HH22 ARG 23 2HH2 ARG 23 7.205 -2.096 15.791
172 H LYS 24 H LYS 24 3.402 4.437 12.387
173 HA LYS 24 HA LYS 24 0.814 3.573 13.131
174 HB2 LYS 24 2HB LYS 24 2.209 6.183 13.777
175 HB3 LYS 24 1HB LYS 24 0.771 5.572 14.586
176 HG2 LYS 24 2HG LYS 24 2.058 3.601 15.331
177 HG3 LYS 24 1HG LYS 24 3.500 4.285 14.581
178 HD2 LYS 24 2HD LYS 24 1.905 5.558 16.816
179 HD3 LYS 24 1HD LYS 24 3.433 4.697 17.005
180 HE2 LYS 24 2HE LYS 24 4.475 6.375 15.459
181 HE3 LYS 24 1HE LYS 24 2.962 7.282 15.517
182 HZ1 LYS 24 3HZ LYS 24 3.244 7.416 17.950
183 HZ2 LYS 24 1HZ LYS 24 4.493 8.182 17.105
184 HZ3 LYS 24 2HZ LYS 24 4.751 6.666 17.804
185 H PHE 25 H PHE 25 1.895 5.944 10.808
186 HA PHE 25 HA PHE 25 -0.832 6.923 10.355
187 HB2 PHE 25 2HB PHE 25 1.829 7.698 9.137
188 HB3 PHE 25 1HB PHE 25 0.290 8.371 8.609
189 HD1 PHE 25 HD2 PHE 25 2.781 8.293 11.298
190 HD2 PHE 25 HD1 PHE 25 -0.926 9.943 9.997
191 HE1 PHE 25 HE2 PHE 25 2.933 10.018 13.049
192 HE2 PHE 25 HE1 PHE 25 -0.776 11.665 11.744
193 HZ PHE 25 HZ PHE 25 1.156 11.705 13.272
194 H VAL 26 H VAL 26 1.778 5.332 8.494
195 HA VAL 26 HA VAL 26 0.339 4.979 6.116
196 HB VAL 26 HB VAL 26 2.573 3.229 7.178
197 HG11 VAL 26 1HG1 VAL 26 1.547 3.595 4.358
198 HG12 VAL 26 2HG1 VAL 26 1.356 2.153 5.354
199 HG13 VAL 26 3HG1 VAL 26 2.962 2.652 4.823
200 HG21 VAL 26 3HG2 VAL 26 3.225 5.584 7.066
201 HG22 VAL 26 1HG2 VAL 26 2.676 5.668 5.391
202 HG23 VAL 26 2HG2 VAL 26 4.050 4.649 5.820
203 H LEU 27 H LEU 27 0.850 2.583 8.756
204 HA LEU 27 HA LEU 27 -0.785 0.582 7.612
205 HB2 LEU 27 2HB LEU 27 -0.072 1.043 10.512
206 HB3 LEU 27 1HB LEU 27 -0.843 -0.407 9.896
207 HG LEU 27 HG LEU 27 1.941 0.570 9.227
208 HD11 LEU 27 1HD1 LEU 27 2.654 -1.492 10.358
209 HD12 LEU 27 2HD1 LEU 27 0.975 -1.835 10.779
210 HD13 LEU 27 3HD1 LEU 27 1.780 -0.412 11.442
211 HD21 LEU 27 3HD2 LEU 27 0.466 -1.869 8.219
212 HD22 LEU 27 1HD2 LEU 27 2.172 -1.516 7.949
213 HD23 LEU 27 2HD2 LEU 27 0.936 -0.463 7.263
214 H ALA 28 H ALA 28 -1.553 3.380 9.558
215 HA ALA 28 HA ALA 28 -4.209 2.688 10.262
216 HB1 ALA 28 3HB ALA 28 -2.965 4.523 11.335
217 HB2 ALA 28 1HB ALA 28 -4.523 5.064 10.708
218 HB3 ALA 28 2HB ALA 28 -3.040 5.443 9.833
219 H ALA 29 H ALA 29 -2.899 4.579 7.533
220 HA ALA 29 HA ALA 29 -5.370 4.985 6.209
221 HB1 ALA 29 3HB ALA 29 -2.584 4.872 5.041
222 HB2 ALA 29 1HB ALA 29 -3.371 6.305 5.705
223 HB3 ALA 29 2HB ALA 29 -4.011 5.543 4.250
224 H LEU 30 H LEU 30 -2.962 2.438 6.044
225 HA LEU 30 HA LEU 30 -3.896 0.986 3.856
226 HB2 LEU 30 2HB LEU 30 -1.729 0.654 4.962
227 HB3 LEU 30 1HB LEU 30 -2.541 -0.000 6.372
228 HG LEU 30 HG LEU 30 -3.292 -1.934 5.065
229 HD11 LEU 30 1HD1 LEU 30 -3.513 -0.873 2.881
230 HD12 LEU 30 2HD1 LEU 30 -2.479 -2.296 2.787
231 HD13 LEU 30 3HD1 LEU 30 -1.760 -0.685 2.781
232 HD21 LEU 30 3HD2 LEU 30 -0.330 -1.377 4.836
233 HD22 LEU 30 1HD2 LEU 30 -1.084 -2.965 4.698
234 HD23 LEU 30 2HD2 LEU 30 -1.163 -2.084 6.222
235 H GLU 31 H GLU 31 -4.572 0.335 7.325
236 HA GLU 31 HA GLU 31 -6.378 -1.776 6.876
237 HB2 GLU 31 2HB GLU 31 -7.054 -1.482 9.217
238 HB3 GLU 31 1HB GLU 31 -5.306 -1.427 9.040
239 HG2 GLU 31 2HG GLU 31 -5.356 1.010 9.195
240 HG3 GLU 31 1HG GLU 31 -7.113 0.970 9.335
241 H GLN 32 H GLN 32 -6.899 1.695 6.980
242 HA GLN 32 HA GLN 32 -9.779 1.496 7.070
243 HB2 GLN 32 2HB GLN 32 -7.943 3.848 6.570
244 HB3 GLN 32 1HB GLN 32 -9.692 3.973 6.720
245 HG2 GLN 32 2HG GLN 32 -9.555 3.079 9.005
246 HG3 GLN 32 1HG GLN 32 -7.804 2.973 8.854
247 HE21 GLN 32 1HE2 GLN 32 -6.593 4.872 8.860
248 HE22 GLN 32 2HE2 GLN 32 -7.238 6.365 9.439
249 H SER 33 H SER 33 -7.603 0.923 4.641
250 HA SER 33 HA SER 33 -9.575 1.618 2.542
251 HB2 SER 33 2HB SER 33 -6.581 1.226 2.233
252 HB3 SER 33 1HB SER 33 -7.705 1.663 0.946
253 HG SER 33 HG SER 33 -6.840 3.191 3.153
254 H SER 34 H SER 34 -9.033 -0.856 4.350
255 HA SER 34 HA SER 34 -8.355 -2.908 2.383
256 HB2 SER 34 2HB SER 34 -8.886 -3.121 5.356
257 HB3 SER 34 1HB SER 34 -8.357 -4.445 4.323
258 HG SER 34 HG SER 34 -6.391 -3.728 4.459
259 H ASP 35 H ASP 35 -9.600 -4.846 2.146
260 HA ASP 35 HA ASP 35 -12.461 -4.551 2.152
261 HB2 ASP 35 2HB ASP 35 -10.814 -7.068 1.746
262 HB3 ASP 35 1HB ASP 35 -12.502 -6.839 1.305
263 H ASP 36 H ASP 36 -13.557 -6.828 3.052
264 HA ASP 36 HA ASP 36 -13.632 -6.538 5.855
265 HB2 ASP 36 2HB ASP 36 -15.465 -7.454 4.384
266 HB3 ASP 36 1HB ASP 36 -14.544 -8.948 4.257
267 H ALA 37 H ALA 37 -11.745 -8.607 3.768
268 HA ALA 37 HA ALA 37 -10.831 -10.404 5.803
269 HB1 ALA 37 3HB ALA 37 -9.324 -11.252 4.093
270 HB2 ALA 37 1HB ALA 37 -9.679 -9.860 3.066
271 HB3 ALA 37 2HB ALA 37 -10.944 -11.033 3.431
272 H GLY 38 H GLY 38 -9.872 -7.230 4.869
273 HA2 GLY 38 2HA GLY 38 -8.371 -5.986 6.284
274 HA3 GLY 38 1HA GLY 38 -7.466 -7.460 6.574
275 H TRP 39 H TRP 39 -8.057 -7.553 3.359
276 HA TRP 39 HA TRP 39 -5.415 -6.496 2.712
277 HB2 TRP 39 2HB TRP 39 -7.420 -8.101 1.118
278 HB3 TRP 39 1HB TRP 39 -5.898 -7.519 0.448
279 HD1 TRP 39 HD1 TRP 39 -7.321 -10.182 2.766
280 HE1 TRP 39 HE1 TRP 39 -5.452 -11.849 3.366
281 HE3 TRP 39 HE3 TRP 39 -3.338 -7.676 0.788
282 HZ2 TRP 39 HZ2 TRP 39 -2.662 -12.071 3.038
283 HZ3 TRP 39 HZ3 TRP 39 -1.097 -8.681 0.972
284 HH2 TRP 39 HH2 TRP 39 -0.770 -10.835 2.076
285 H ALA 40 H ALA 40 -5.038 -4.612 1.700
286 HA ALA 40 HA ALA 40 -7.351 -3.047 0.748
287 HB1 ALA 40 3HB ALA 40 -6.118 -2.078 2.630
288 HB2 ALA 40 1HB ALA 40 -6.004 -1.064 1.191
289 HB3 ALA 40 2HB ALA 40 -4.641 -2.078 1.666
290 H ASN 41 H ASN 41 -7.489 -2.466 -1.345
291 HA ASN 41 HA ASN 41 -5.655 -3.434 -3.276
292 HB2 ASN 41 2HB ASN 41 -8.081 -3.078 -3.704
293 HB3 ASN 41 1HB ASN 41 -7.819 -1.339 -3.626
294 HD21 ASN 41 1HD2 ASN 41 -8.792 -3.042 -5.813
295 HD22 ASN 41 2HD2 ASN 41 -7.751 -2.720 -7.152
296 H LEU 42 H LEU 42 -3.840 -2.598 -3.987
297 HA LEU 42 HA LEU 42 -2.384 -0.559 -2.992
298 HB2 LEU 42 2HB LEU 42 -1.540 -2.216 -4.553
299 HB3 LEU 42 1HB LEU 42 -2.467 -1.501 -5.856
300 HG LEU 42 HG LEU 42 -1.088 0.550 -5.693
301 HD11 LEU 42 1HD1 LEU 42 -0.430 0.413 -3.349
302 HD12 LEU 42 2HD1 LEU 42 0.992 0.506 -4.385
303 HD13 LEU 42 3HD1 LEU 42 0.515 -1.039 -3.681
304 HD21 LEU 42 3HD2 LEU 42 0.914 -0.408 -6.695
305 HD22 LEU 42 1HD2 LEU 42 -0.534 -1.220 -7.285
306 HD23 LEU 42 2HD2 LEU 42 0.481 -2.000 -6.071
307 H GLY 43 H GLY 43 -4.735 -0.220 -5.646
308 HA2 GLY 43 2HA GLY 43 -4.144 2.427 -6.392
309 HA3 GLY 43 1HA GLY 43 -5.685 1.625 -6.645
310 H ASN 44 H ASN 44 -6.468 1.224 -3.982
311 HA ASN 44 HA ASN 44 -7.395 3.873 -3.311
312 HB2 ASN 44 2HB ASN 44 -7.881 1.191 -1.991
313 HB3 ASN 44 1HB ASN 44 -8.661 2.694 -1.502
314 HD21 ASN 44 1HD2 ASN 44 -9.850 0.245 -2.534
315 HD22 ASN 44 2HD2 ASN 44 -10.731 0.711 -3.945
316 H PHE 45 H PHE 45 -5.159 1.524 -1.905
317 HA PHE 45 HA PHE 45 -4.592 2.712 0.529
318 HB2 PHE 45 2HB PHE 45 -3.662 0.562 -0.030
319 HB3 PHE 45 1HB PHE 45 -2.767 1.238 -1.386
320 HD1 PHE 45 HD1 PHE 45 -3.105 1.968 2.277
321 HD2 PHE 45 HD2 PHE 45 -0.499 1.379 -1.046
322 HE1 PHE 45 HE1 PHE 45 -1.155 2.309 3.742
323 HE2 PHE 45 HE2 PHE 45 1.448 1.712 0.419
324 HZ PHE 45 HZ PHE 45 1.120 2.177 2.814
325 H GLY 46 H GLY 46 -2.992 3.350 -2.601
326 HA2 GLY 46 2HA GLY 46 -1.257 5.380 -1.742
327 HA3 GLY 46 1HA GLY 46 -1.845 5.180 -3.384
328 H ASN 47 H ASN 47 -4.682 5.521 -2.341
329 HA ASN 47 HA ASN 47 -4.801 8.384 -2.671
330 HB2 ASN 47 2HB ASN 47 -6.481 6.807 -3.650
331 HB3 ASN 47 1HB ASN 47 -7.043 6.447 -2.024
332 HD21 ASN 47 1HD2 ASN 47 -8.511 7.563 -4.245
333 HD22 ASN 47 2HD2 ASN 47 -9.119 9.086 -3.709
334 H TYR 48 H TYR 48 -6.008 6.186 -0.105
335 HA TYR 48 HA TYR 48 -6.623 8.327 1.661
336 HB2 TYR 48 2HB TYR 48 -7.581 5.911 1.589
337 HB3 TYR 48 1HB TYR 48 -6.200 5.491 2.594
338 HD1 TYR 48 HD2 TYR 48 -9.261 7.568 2.424
339 HD2 TYR 48 HD1 TYR 48 -6.190 6.027 4.937
340 HE1 TYR 48 HE2 TYR 48 -10.508 8.319 4.403
341 HE2 TYR 48 HE1 TYR 48 -7.434 6.772 6.923
342 HH TYR 48 HH TYR 48 -9.165 8.544 7.454
343 H LEU 49 H LEU 49 -3.729 6.446 1.130
344 HA LEU 49 HA LEU 49 -2.389 7.020 3.551
345 HB2 LEU 49 2HB LEU 49 -1.585 5.289 2.062
346 HB3 LEU 49 1HB LEU 49 -1.284 6.467 0.798
347 HG LEU 49 HG LEU 49 0.500 7.486 2.139
348 HD11 LEU 49 1HD1 LEU 49 -0.059 5.313 4.159
349 HD12 LEU 49 2HD1 LEU 49 -0.402 7.032 4.367
350 HD13 LEU 49 3HD1 LEU 49 1.265 6.477 4.216
351 HD21 LEU 49 3HD2 LEU 49 0.792 4.495 1.863
352 HD22 LEU 49 1HD2 LEU 49 2.117 5.645 2.045
353 HD23 LEU 49 2HD2 LEU 49 1.099 5.695 0.606
354 H ASN 50 H ASN 50 -2.194 8.677 0.383
355 HA ASN 50 HA ASN 50 -0.394 10.671 1.200
356 HB2 ASN 50 2HB ASN 50 -0.879 10.160 -1.164
357 HB3 ASN 50 1HB ASN 50 -2.490 10.849 -0.976
358 HD21 ASN 50 1HD2 ASN 50 0.934 11.563 -0.978
359 HD22 ASN 50 2HD2 ASN 50 0.775 13.252 -1.299
360 H LYS 51 H LYS 51 -3.859 10.433 1.604
361 HA LYS 51 HA LYS 51 -4.462 13.067 2.344
362 HB2 LYS 51 2HB LYS 51 -5.602 10.455 3.364
363 HB3 LYS 51 1HB LYS 51 -6.290 12.034 3.726
364 HG2 LYS 51 2HG LYS 51 -6.748 12.404 1.366
365 HG3 LYS 51 1HG LYS 51 -5.992 10.861 0.961
366 HD2 LYS 51 2HD LYS 51 -8.447 10.694 1.012
367 HD3 LYS 51 1HD LYS 51 -7.691 9.664 2.229
368 HE2 LYS 51 2HE LYS 51 -9.639 10.803 3.149
369 HE3 LYS 51 1HE LYS 51 -8.165 11.345 3.948
370 HZ1 LYS 51 3HZ LYS 51 -9.597 13.201 3.453
371 HZ2 LYS 51 1HZ LYS 51 -9.632 12.798 1.811
372 HZ3 LYS 51 2HZ LYS 51 -8.191 13.319 2.527
373 H LEU 52 H LEU 52 -3.198 10.374 4.295
374 HA LEU 52 HA LEU 52 -3.110 12.001 6.697
375 HB2 LEU 52 2HB LEU 52 -2.006 9.223 6.242
376 HB3 LEU 52 1HB LEU 52 -2.235 10.007 7.792
377 HG LEU 52 HG LEU 52 -4.379 9.040 5.900
378 HD11 LEU 52 1HD1 LEU 52 -5.024 7.608 7.767
379 HD12 LEU 52 2HD1 LEU 52 -3.681 8.238 8.721
380 HD13 LEU 52 3HD1 LEU 52 -3.363 7.304 7.258
381 HD21 LEU 52 3HD2 LEU 52 -6.013 9.845 7.551
382 HD22 LEU 52 1HD2 LEU 52 -5.109 11.164 6.810
383 HD23 LEU 52 2HD2 LEU 52 -4.712 10.632 8.445
384 H GLN 53 H GLN 53 -0.830 10.781 4.300
385 HA GLN 53 HA GLN 53 1.288 12.426 5.534
386 HB2 GLN 53 2HB GLN 53 1.576 9.629 4.414
387 HB3 GLN 53 1HB GLN 53 2.936 10.674 4.795
388 HG2 GLN 53 2HG GLN 53 0.874 9.798 6.810
389 HG3 GLN 53 1HG GLN 53 2.398 8.961 6.528
390 HE21 GLN 53 1HE2 GLN 53 0.889 11.786 7.849
391 HE22 GLN 53 2HE2 GLN 53 2.276 12.375 8.693
392 HA PRO 54 HA PRO 54 0.880 13.585 1.037
393 HB2 PRO 54 2HB PRO 54 1.084 16.270 1.427
394 HB3 PRO 54 1HB PRO 54 -0.447 15.395 1.548
395 HG2 PRO 54 2HG PRO 54 1.397 16.290 3.738
396 HG3 PRO 54 1HG PRO 54 -0.372 16.396 3.651
397 HD2 PRO 54 2HD PRO 54 0.904 14.454 5.052
398 HD3 PRO 54 1HD PRO 54 -0.659 14.184 4.255
399 H ASP 55 H ASP 55 3.174 14.376 3.556
400 HA ASP 55 HA ASP 55 5.220 15.328 1.733
401 HB2 ASP 55 2HB ASP 55 4.993 16.270 4.003
402 HB3 ASP 55 1HB ASP 55 5.347 14.693 4.698
403 H PHE 56 H PHE 56 4.087 12.302 2.616
404 HA PHE 56 HA PHE 56 6.646 10.915 2.599
405 HB2 PHE 56 2HB PHE 56 4.824 10.157 4.080
406 HB3 PHE 56 1HB PHE 56 3.814 9.829 2.677
407 HD1 PHE 56 HD1 PHE 56 6.960 8.829 4.372
408 HD2 PHE 56 HD2 PHE 56 3.939 7.755 1.564
409 HE1 PHE 56 HE1 PHE 56 7.868 6.545 4.276
410 HE2 PHE 56 HE2 PHE 56 4.847 5.468 1.462
411 HZ PHE 56 HZ PHE 56 6.812 4.860 2.819
412 H ASP 57 H ASP 57 7.635 10.703 0.670
413 HA ASP 57 HA ASP 57 6.026 9.872 -1.659
414 HB2 ASP 57 2HB ASP 57 6.630 12.215 -1.907
415 HB3 ASP 57 1HB ASP 57 8.325 11.838 -1.620
416 H SER 58 H SER 58 6.900 8.360 -3.046
417 HA SER 58 HA SER 58 8.718 6.501 -1.886
418 HB2 SER 58 2HB SER 58 8.427 5.204 -3.928
419 HB3 SER 58 1HB SER 58 6.869 5.836 -3.398
420 HG SER 58 HG SER 58 8.470 6.627 -5.580
421 H ARG 59 H ARG 59 9.110 9.025 -4.305
422 HA ARG 59 HA ARG 59 11.505 8.149 -5.494
423 HB2 ARG 59 2HB ARG 59 10.521 10.984 -5.103
424 HB3 ARG 59 1HB ARG 59 11.775 10.488 -6.231
425 HG2 ARG 59 2HG ARG 59 8.925 9.506 -6.334
426 HG3 ARG 59 1HG ARG 59 9.540 10.873 -7.266
427 HD2 ARG 59 2HD ARG 59 10.555 8.029 -7.423
428 HD3 ARG 59 1HD ARG 59 9.490 8.809 -8.592
429 HE ARG 59 HE ARG 59 11.379 10.413 -8.960
430 HH11 ARG 59 1HH1 ARG 59 11.999 7.236 -7.787
431 HH12 ARG 59 2HH1 ARG 59 13.606 7.193 -8.421
432 HH21 ARG 59 1HH2 ARG 59 13.433 10.352 -9.767
433 HH22 ARG 59 2HH2 ARG 59 14.412 8.946 -9.537
434 H LEU 60 H LEU 60 10.911 9.807 -2.489
435 HA LEU 60 HA LEU 60 13.482 10.833 -1.974
436 HB2 LEU 60 2HB LEU 60 11.480 9.843 0.061
437 HB3 LEU 60 1HB LEU 60 12.768 11.005 0.331
438 HG LEU 60 HG LEU 60 10.317 11.420 -1.390
439 HD11 LEU 60 1HD1 LEU 60 9.849 11.496 1.000
440 HD12 LEU 60 2HD1 LEU 60 9.700 13.094 0.271
441 HD13 LEU 60 3HD1 LEU 60 11.128 12.691 1.224
442 HD21 LEU 60 3HD2 LEU 60 12.231 12.554 -2.375
443 HD22 LEU 60 1HD2 LEU 60 12.610 13.304 -0.821
444 HD23 LEU 60 2HD2 LEU 60 11.119 13.723 -1.665
445 H TYR 61 H TYR 61 12.251 7.600 -1.808
446 HA TYR 61 HA TYR 61 14.607 6.688 -0.293
447 HB2 TYR 61 2HB TYR 61 12.069 5.180 -0.977
448 HB3 TYR 61 1HB TYR 61 13.371 4.603 0.057
449 HD1 TYR 61 HD2 TYR 61 13.663 5.494 2.317
450 HD2 TYR 61 HD1 TYR 61 10.488 6.856 -0.178
451 HE1 TYR 61 HE2 TYR 61 12.567 6.505 4.269
452 HE2 TYR 61 HE1 TYR 61 9.388 7.872 1.771
453 HH TYR 61 HH TYR 61 9.358 7.660 4.191
454 H GLY 62 H GLY 62 14.009 7.268 -3.392
455 HA2 GLY 62 2HA GLY 62 15.332 6.605 -5.210
456 HA3 GLY 62 1HA GLY 62 15.845 5.193 -4.306
457 H TYR 63 H TYR 63 12.470 5.527 -4.250
458 HA TYR 63 HA TYR 63 12.219 3.390 -6.253
459 HB2 TYR 63 2HB TYR 63 10.337 4.290 -4.059
460 HB3 TYR 63 1HB TYR 63 9.961 3.024 -5.225
461 HD1 TYR 63 HD1 TYR 63 12.051 3.926 -2.335
462 HD2 TYR 63 HD2 TYR 63 10.992 0.844 -5.072
463 HE1 TYR 63 HE1 TYR 63 13.166 2.276 -0.897
464 HE2 TYR 63 HE2 TYR 63 12.100 -0.814 -3.636
465 HH TYR 63 HH TYR 63 13.816 -0.916 -1.923
466 H LYS 64 H LYS 64 11.109 3.615 -8.100
467 HA LYS 64 HA LYS 64 10.536 6.233 -9.044
468 HB2 LYS 64 2HB LYS 64 9.984 3.529 -10.283
469 HB3 LYS 64 1HB LYS 64 9.816 5.068 -11.121
470 HG2 LYS 64 2HG LYS 64 12.196 5.522 -10.786
471 HG3 LYS 64 1HG LYS 64 12.370 3.988 -9.934
472 HD2 LYS 64 2HD LYS 64 11.761 2.772 -11.963
473 HD3 LYS 64 1HD LYS 64 11.514 4.297 -12.820
474 HE2 LYS 64 2HE LYS 64 13.878 4.861 -12.506
475 HE3 LYS 64 1HE LYS 64 14.127 3.349 -11.634
476 HZ1 LYS 64 3HZ LYS 64 13.244 3.537 -14.460
477 HZ2 LYS 64 1HZ LYS 64 13.625 2.123 -13.615
478 HZ3 LYS 64 2HZ LYS 64 14.836 3.254 -13.967
479 H LYS 65 H LYS 65 8.524 3.806 -7.573
480 HA LYS 65 HA LYS 65 6.390 5.737 -7.385
481 HB2 LYS 65 2HB LYS 65 4.632 4.233 -8.285
482 HB3 LYS 65 1HB LYS 65 5.762 4.792 -9.508
483 HG2 LYS 65 2HG LYS 65 6.841 2.663 -9.603
484 HG3 LYS 65 1HG LYS 65 5.971 2.095 -8.174
485 HD2 LYS 65 2HD LYS 65 5.021 1.176 -10.257
486 HD3 LYS 65 1HD LYS 65 3.862 2.176 -9.381
487 HE2 LYS 65 2HE LYS 65 4.541 4.080 -10.918
488 HE3 LYS 65 1HE LYS 65 5.409 2.878 -11.873
489 HZ1 LYS 65 3HZ LYS 65 3.348 1.704 -12.235
490 HZ2 LYS 65 1HZ LYS 65 3.179 3.312 -12.729
491 HZ3 LYS 65 2HZ LYS 65 2.503 2.800 -11.267
492 H LEU 66 H LEU 66 4.673 5.081 -5.911
493 HA LEU 66 HA LEU 66 5.585 3.952 -3.535
494 HB2 LEU 66 2HB LEU 66 3.663 5.455 -3.664
495 HB3 LEU 66 1HB LEU 66 2.746 4.241 -4.537
496 HG LEU 66 HG LEU 66 2.842 2.774 -2.517
497 HD11 LEU 66 1HD1 LEU 66 4.848 3.627 -1.470
498 HD12 LEU 66 2HD1 LEU 66 3.484 3.785 -0.362
499 HD13 LEU 66 3HD1 LEU 66 4.090 5.200 -1.224
500 HD21 LEU 66 3HD2 LEU 66 0.889 4.177 -2.950
501 HD22 LEU 66 1HD2 LEU 66 1.636 5.508 -2.067
502 HD23 LEU 66 2HD2 LEU 66 1.191 4.025 -1.220
503 H SER 67 H SER 67 3.746 2.466 -6.161
504 HA SER 67 HA SER 67 3.061 0.012 -5.126
505 HB2 SER 67 2HB SER 67 4.166 0.464 -7.918
506 HB3 SER 67 1HB SER 67 3.111 -0.853 -7.407
507 HG SER 67 HG SER 67 1.639 0.494 -8.122
508 H ASP 68 H ASP 68 6.219 1.000 -6.388
509 HA ASP 68 HA ASP 68 7.329 -1.655 -6.110
510 HB2 ASP 68 2HB ASP 68 7.957 -0.055 -7.948
511 HB3 ASP 68 1HB ASP 68 8.786 0.923 -6.739
512 H LEU 69 H LEU 69 7.201 1.264 -4.224
513 HA LEU 69 HA LEU 69 9.332 0.747 -2.433
514 HB2 LEU 69 2HB LEU 69 8.358 2.947 -2.558
515 HB3 LEU 69 1HB LEU 69 6.776 2.329 -2.124
516 HG LEU 69 HG LEU 69 7.647 1.769 0.141
517 HD11 LEU 69 1HD1 LEU 69 10.016 1.521 -0.430
518 HD12 LEU 69 2HD1 LEU 69 9.776 2.667 0.888
519 HD13 LEU 69 3HD1 LEU 69 10.121 3.256 -0.739
520 HD21 LEU 69 3HD2 LEU 69 6.458 3.861 -0.259
521 HD22 LEU 69 1HD2 LEU 69 7.979 4.658 -0.664
522 HD23 LEU 69 2HD2 LEU 69 7.703 4.057 0.972
523 H VAL 70 H VAL 70 5.846 0.048 -2.200
524 HA VAL 70 HA VAL 70 5.865 -1.057 0.380
525 HB VAL 70 HB VAL 70 3.957 -1.719 -1.878
526 HG11 VAL 70 1HG1 VAL 70 3.612 -1.931 1.118
527 HG12 VAL 70 2HG1 VAL 70 3.812 -3.283 0.004
528 HG13 VAL 70 3HG1 VAL 70 2.376 -2.265 -0.093
529 HG21 VAL 70 3HG2 VAL 70 4.120 0.698 -1.498
530 HG22 VAL 70 1HG2 VAL 70 3.796 0.455 0.219
531 HG23 VAL 70 2HG2 VAL 70 2.554 0.076 -0.977
532 H LYS 71 H LYS 71 5.969 -2.744 -2.776
533 HA LYS 71 HA LYS 71 6.096 -5.361 -1.761
534 HB2 LYS 71 2HB LYS 71 7.056 -5.941 -4.025
535 HB3 LYS 71 1HB LYS 71 5.522 -5.082 -4.044
536 HG2 LYS 71 2HG LYS 71 6.729 -2.980 -4.498
537 HG3 LYS 71 1HG LYS 71 8.240 -3.885 -4.556
538 HD2 LYS 71 2HD LYS 71 5.907 -4.560 -6.338
539 HD3 LYS 71 1HD LYS 71 7.096 -3.337 -6.785
540 HE2 LYS 71 2HE LYS 71 7.762 -6.205 -6.107
541 HE3 LYS 71 1HE LYS 71 7.551 -5.589 -7.746
542 HZ1 LYS 71 3HZ LYS 71 9.860 -5.614 -7.235
543 HZ2 LYS 71 1HZ LYS 71 9.624 -4.771 -5.789
544 HZ3 LYS 71 2HZ LYS 71 9.367 -3.995 -7.267
545 H ALA 72 H ALA 72 8.562 -2.943 -1.895
546 HA ALA 72 HA ALA 72 10.742 -4.851 -1.591
547 HB1 ALA 72 3HB ALA 72 11.093 -2.811 -2.895
548 HB2 ALA 72 1HB ALA 72 12.192 -2.896 -1.518
549 HB3 ALA 72 2HB ALA 72 10.784 -1.837 -1.458
550 H ARG 73 H ARG 73 8.569 -3.174 0.468
551 HA ARG 73 HA ARG 73 10.362 -3.480 2.803
552 HB2 ARG 73 2HB ARG 73 7.866 -1.778 2.549
553 HB3 ARG 73 1HB ARG 73 8.966 -1.814 3.920
554 HG2 ARG 73 2HG ARG 73 9.642 -0.861 1.135
555 HG3 ARG 73 1HG ARG 73 9.321 0.165 2.535
556 HD2 ARG 73 2HD ARG 73 11.278 -0.759 3.671
557 HD3 ARG 73 1HD ARG 73 11.586 -1.825 2.299
558 HE ARG 73 HE ARG 73 11.609 0.616 1.164
559 HH11 ARG 73 1HH1 ARG 73 13.241 -0.665 3.909
560 HH12 ARG 73 2HH1 ARG 73 14.596 0.389 3.730
561 HH21 ARG 73 1HH2 ARG 73 13.396 1.953 0.943
562 HH22 ARG 73 2HH2 ARG 73 14.691 1.823 2.078
563 H THR 74 H THR 74 9.342 -5.826 2.048
564 HA THR 74 HA THR 74 6.726 -6.501 2.815
565 HB THR 74 HB THR 74 7.500 -8.862 2.803
566 HG1 THR 74 HG1 THR 74 9.605 -9.344 2.758
567 HG21 THR 74 3HG2 THR 74 8.526 -7.178 0.506
568 HG22 THR 74 1HG2 THR 74 6.879 -7.779 0.697
569 HG23 THR 74 2HG2 THR 74 8.207 -8.912 0.446
570 H ASP 75 H ASP 75 9.570 -6.112 4.781
571 HA ASP 75 HA ASP 75 8.770 -7.644 7.027
572 HB2 ASP 75 2HB ASP 75 11.086 -6.831 6.630
573 HB3 ASP 75 1HB ASP 75 10.546 -5.189 6.959
574 H LEU 76 H LEU 76 7.838 -4.519 5.874
575 HA LEU 76 HA LEU 76 6.396 -3.903 8.368
576 HB2 LEU 76 2HB LEU 76 6.993 -2.189 5.946
577 HB3 LEU 76 1HB LEU 76 6.069 -1.654 7.338
578 HG LEU 76 HG LEU 76 8.968 -2.512 7.429
579 HD11 LEU 76 1HD1 LEU 76 9.444 -0.114 7.749
580 HD12 LEU 76 2HD1 LEU 76 7.747 0.253 7.430
581 HD13 LEU 76 3HD1 LEU 76 8.752 -0.457 6.164
582 HD21 LEU 76 3HD2 LEU 76 7.800 -2.886 9.535
583 HD22 LEU 76 1HD2 LEU 76 7.202 -1.226 9.518
584 HD23 LEU 76 2HD2 LEU 76 8.930 -1.542 9.682
585 H PHE 77 H PHE 77 5.934 -4.309 4.882
586 HA PHE 77 HA PHE 77 3.005 -4.313 5.291
587 HB2 PHE 77 2HB PHE 77 4.452 -3.609 2.724
588 HB3 PHE 77 1HB PHE 77 2.741 -3.394 3.082
589 HD1 PHE 77 HD1 PHE 77 2.542 -2.038 5.533
590 HD2 PHE 77 HD2 PHE 77 5.550 -1.588 2.547
591 HE1 PHE 77 HE1 PHE 77 2.998 0.243 6.334
592 HE2 PHE 77 HE2 PHE 77 6.010 0.689 3.348
593 HZ PHE 77 HZ PHE 77 4.735 1.608 5.242
594 H VAL 78 H VAL 78 1.926 -6.116 4.735
595 HA VAL 78 HA VAL 78 3.341 -8.345 3.508
596 HB VAL 78 HB VAL 78 0.450 -8.204 4.405
597 HG11 VAL 78 1HG1 VAL 78 2.235 -10.577 3.823
598 HG12 VAL 78 2HG1 VAL 78 0.876 -10.026 2.842
599 HG13 VAL 78 3HG1 VAL 78 0.594 -10.661 4.464
600 HG21 VAL 78 3HG2 VAL 78 1.986 -7.728 6.263
601 HG22 VAL 78 1HG2 VAL 78 2.849 -9.228 5.931
602 HG23 VAL 78 2HG2 VAL 78 1.170 -9.276 6.472
603 H THR 79 H THR 79 3.376 -8.617 1.345
604 HA THR 79 HA THR 79 1.260 -7.316 -0.270
605 HB THR 79 HB THR 79 2.881 -7.013 -2.046
606 HG1 THR 79 HG1 THR 79 4.252 -8.731 -1.910
607 HG21 THR 79 3HG2 THR 79 4.102 -6.157 0.589
608 HG22 THR 79 1HG2 THR 79 2.847 -5.280 -0.287
609 HG23 THR 79 2HG2 THR 79 4.452 -5.458 -0.992
610 H GLU 80 H GLU 80 0.041 -8.585 -1.544
611 HA GLU 80 HA GLU 80 1.218 -10.955 -2.787
612 HB2 GLU 80 2HB GLU 80 -1.283 -11.048 -1.090
613 HB3 GLU 80 1HB GLU 80 -0.915 -12.271 -2.297
614 HG2 GLU 80 2HG GLU 80 1.233 -12.702 -1.078
615 HG3 GLU 80 1HG GLU 80 0.662 -11.614 0.186
616 H GLU 81 H GLU 81 0.363 -11.486 -4.768
617 HA GLU 81 HA GLU 81 -1.383 -9.510 -6.008
618 HB2 GLU 81 2HB GLU 81 -0.061 -11.965 -7.190
619 HB3 GLU 81 1HB GLU 81 -0.911 -10.721 -8.097
620 HG2 GLU 81 2HG GLU 81 0.777 -9.075 -7.365
621 HG3 GLU 81 1HG GLU 81 1.642 -10.366 -6.532
622 H ARG 82 H ARG 82 -3.523 -9.758 -5.845
623 HA ARG 82 HA ARG 82 -4.646 -12.499 -5.834
624 HB2 ARG 82 2HB ARG 82 -5.880 -10.028 -4.589
625 HB3 ARG 82 1HB ARG 82 -6.454 -11.683 -4.444
626 HG2 ARG 82 2HG ARG 82 -3.786 -10.744 -3.403
627 HG3 ARG 82 1HG ARG 82 -5.260 -10.794 -2.436
628 HD2 ARG 82 2HD ARG 82 -4.195 -13.228 -3.864
629 HD3 ARG 82 1HD ARG 82 -3.669 -12.785 -2.240
630 HE ARG 82 HE ARG 82 -6.436 -12.807 -2.184
631 HH11 ARG 82 1HH1 ARG 82 -3.956 -15.101 -2.868
632 HH12 ARG 82 2HH1 ARG 82 -4.831 -16.420 -2.174
633 HH21 ARG 82 1HH2 ARG 82 -7.551 -14.506 -1.297
634 HH22 ARG 82 2HH2 ARG 82 -6.839 -16.085 -1.286
635 H GLN 83 H GLN 83 -6.133 -12.982 -7.385
636 HA GLN 83 HA GLN 83 -6.580 -11.033 -9.466
637 HB2 GLN 83 2HB GLN 83 -6.133 -13.464 -9.927
638 HB3 GLN 83 1HB GLN 83 -7.723 -13.830 -9.270
639 HG2 GLN 83 2HG GLN 83 -8.754 -12.452 -11.015
640 HG3 GLN 83 1HG GLN 83 -7.162 -12.093 -11.675
641 HE21 GLN 83 1HE2 GLN 83 -6.066 -13.692 -12.814
642 HE22 GLN 83 2HE2 GLN 83 -6.850 -15.122 -13.374
643 H VAL 84 H VAL 84 -8.391 -9.879 -9.849
644 HA VAL 84 HA VAL 84 -10.238 -9.720 -7.598
645 HB VAL 84 HB VAL 84 -9.989 -7.897 -10.005
646 HG11 VAL 84 1HG1 VAL 84 -12.170 -7.700 -8.934
647 HG12 VAL 84 2HG1 VAL 84 -11.201 -6.263 -8.617
648 HG13 VAL 84 3HG1 VAL 84 -11.402 -7.485 -7.361
649 HG21 VAL 84 3HG2 VAL 84 -7.915 -7.959 -8.720
650 HG22 VAL 84 1HG2 VAL 84 -8.807 -7.618 -7.237
651 HG23 VAL 84 2HG2 VAL 84 -8.733 -6.409 -8.519
652 HA PRO 85 HA PRO 85 -13.672 -11.880 -9.629
653 HB2 PRO 85 2HB PRO 85 -15.167 -10.084 -7.754
654 HB3 PRO 85 1HB PRO 85 -15.360 -11.819 -8.043
655 HG2 PRO 85 2HG PRO 85 -14.123 -10.957 -5.854
656 HG3 PRO 85 1HG PRO 85 -13.514 -12.375 -6.733
657 HD2 PRO 85 2HD PRO 85 -12.453 -9.574 -6.680
658 HD3 PRO 85 1HD PRO 85 -11.572 -11.113 -6.754
659 H GLY 86 H GLY 86 -14.567 -11.307 -11.533
660 HA2 GLY 86 2HA GLY 86 -15.851 -9.913 -12.982
661 HA3 GLY 86 1HA GLY 86 -15.444 -8.528 -11.979
662 H SER 87 H SER 87 -12.587 -9.648 -11.996
663 HA SER 87 HA SER 87 -11.785 -8.630 -14.655
664 HB2 SER 87 2HB SER 87 -10.230 -8.508 -12.047
665 HB3 SER 87 1HB SER 87 -9.673 -7.897 -13.603
666 HG SER 87 HG SER 87 -11.684 -6.559 -13.495
667 H THR 88 H THR 88 -10.398 -9.890 -15.875
668 HA THR 88 HA THR 88 -9.634 -12.510 -14.867
669 HB THR 88 HB THR 88 -10.275 -12.331 -17.230
670 HG1 THR 88 HG1 THR 88 -8.651 -13.633 -17.948
671 HG21 THR 88 3HG2 THR 88 -8.813 -11.188 -18.849
672 HG22 THR 88 1HG2 THR 88 -7.820 -10.583 -17.521
673 HG23 THR 88 2HG2 THR 88 -9.495 -10.051 -17.685
674 H GLN 89 H GLN 89 -8.263 -9.358 -15.135
675 HA GLN 89 HA GLN 89 -5.530 -10.260 -14.781
676 HB2 GLN 89 2HB GLN 89 -4.925 -7.914 -14.791
677 HB3 GLN 89 1HB GLN 89 -6.017 -8.250 -16.127
678 HG2 GLN 89 2HG GLN 89 -7.867 -7.265 -14.901
679 HG3 GLN 89 1HG GLN 89 -6.821 -6.988 -13.507
680 HE21 GLN 89 1HE2 GLN 89 -7.632 -5.963 -16.723
681 HE22 GLN 89 2HE2 GLN 89 -6.732 -4.490 -16.696
682 H LYS 90 H LYS 90 -4.213 -9.489 -12.976
683 HA LYS 90 HA LYS 90 -5.651 -9.866 -10.450
684 HB2 LYS 90 2HB LYS 90 -3.447 -10.377 -9.511
685 HB3 LYS 90 1HB LYS 90 -3.800 -11.388 -10.908
686 HG2 LYS 90 2HG LYS 90 -2.376 -10.034 -12.317
687 HG3 LYS 90 1HG LYS 90 -2.102 -8.891 -11.003
688 HD2 LYS 90 2HD LYS 90 -0.190 -10.395 -11.301
689 HD3 LYS 90 1HD LYS 90 -0.941 -10.611 -9.722
690 HE2 LYS 90 2HE LYS 90 -2.088 -12.609 -10.517
691 HE3 LYS 90 1HE LYS 90 -1.408 -12.376 -12.128
692 HZ1 LYS 90 3HZ LYS 90 -0.213 -14.022 -10.730
693 HZ2 LYS 90 1HZ LYS 90 0.244 -12.765 -9.695
694 HZ3 LYS 90 2HZ LYS 90 0.770 -12.770 -11.300
695 H ALA 91 H ALA 91 -5.092 -8.594 -8.571
696 HA ALA 91 HA ALA 91 -3.806 -5.990 -9.121
697 HB1 ALA 91 3HB ALA 91 -6.224 -5.646 -8.959
698 HB2 ALA 91 1HB ALA 91 -5.391 -4.908 -7.588
699 HB3 ALA 91 2HB ALA 91 -6.239 -6.441 -7.385
700 H LEU 92 H LEU 92 -2.608 -5.087 -7.386
701 HA LEU 92 HA LEU 92 -1.532 -7.073 -5.561
702 HB2 LEU 92 2HB LEU 92 -0.041 -5.531 -6.778
703 HB3 LEU 92 1HB LEU 92 -0.785 -4.169 -5.962
704 HG LEU 92 HG LEU 92 0.022 -5.154 -3.777
705 HD11 LEU 92 1HD1 LEU 92 1.669 -6.914 -5.593
706 HD12 LEU 92 2HD1 LEU 92 0.338 -7.455 -4.568
707 HD13 LEU 92 3HD1 LEU 92 1.802 -6.797 -3.838
708 HD21 LEU 92 3HD2 LEU 92 1.172 -3.283 -4.838
709 HD22 LEU 92 1HD2 LEU 92 2.125 -4.403 -5.814
710 HD23 LEU 92 2HD2 LEU 92 2.325 -4.367 -4.061
711 H TYR 93 H TYR 93 -2.434 -7.429 -3.639
712 HA TYR 93 HA TYR 93 -3.832 -5.231 -2.264
713 HB2 TYR 93 2HB TYR 93 -4.060 -8.229 -1.986
714 HB3 TYR 93 1HB TYR 93 -4.758 -7.113 -0.815
715 HD1 TYR 93 HD1 TYR 93 -4.869 -8.125 -4.391
716 HD2 TYR 93 HD2 TYR 93 -6.819 -6.045 -1.229
717 HE1 TYR 93 HE1 TYR 93 -6.891 -7.921 -5.775
718 HE2 TYR 93 HE2 TYR 93 -8.842 -5.837 -2.603
719 HH TYR 93 HH TYR 93 -9.335 -7.612 -5.424
720 H LEU 94 H LEU 94 -3.391 -4.703 -0.144
721 HA LEU 94 HA LEU 94 -0.803 -5.675 0.913
722 HB2 LEU 94 2HB LEU 94 -1.789 -2.820 1.017
723 HB3 LEU 94 1HB LEU 94 -0.196 -3.411 1.455
724 HG LEU 94 HG LEU 94 -1.333 -3.375 -1.348
725 HD11 LEU 94 1HD1 LEU 94 0.315 -1.593 -1.755
726 HD12 LEU 94 2HD1 LEU 94 0.687 -1.569 -0.030
727 HD13 LEU 94 3HD1 LEU 94 -0.926 -1.128 -0.593
728 HD21 LEU 94 3HD2 LEU 94 1.424 -4.090 -0.349
729 HD22 LEU 94 1HD2 LEU 94 0.966 -3.910 -2.044
730 HD23 LEU 94 2HD2 LEU 94 0.247 -5.188 -1.068
731 H ARG 95 H ARG 95 -0.675 -5.958 3.145
732 HA ARG 95 HA ARG 95 -2.642 -4.619 4.848
733 HB2 ARG 95 2HB ARG 95 -3.293 -6.581 6.077
734 HB3 ARG 95 1HB ARG 95 -3.606 -6.870 4.373
735 HG2 ARG 95 2HG ARG 95 -1.675 -8.284 4.190
736 HG3 ARG 95 1HG ARG 95 -1.164 -7.872 5.829
737 HD2 ARG 95 2HD ARG 95 -3.672 -9.370 5.059
738 HD3 ARG 95 1HD ARG 95 -2.221 -10.068 5.779
739 HE ARG 95 HE ARG 95 -3.364 -7.976 7.376
740 HH11 ARG 95 1HH1 ARG 95 -3.510 -11.338 6.638
741 HH12 ARG 95 2HH1 ARG 95 -4.266 -11.741 8.139
742 HH21 ARG 95 1HH2 ARG 95 -4.337 -8.514 9.298
743 HH22 ARG 95 2HH2 ARG 95 -4.727 -10.169 9.622
744 H ALA 96 H ALA 96 -2.073 -4.948 7.241
745 HA ALA 96 HA ALA 96 0.645 -4.122 7.566
746 HB1 ALA 96 3HB ALA 96 -1.193 -3.163 8.883
747 HB2 ALA 96 1HB ALA 96 0.075 -3.829 9.911
748 HB3 ALA 96 2HB ALA 96 -1.429 -4.719 9.677
749 H LYS 97 H LYS 97 2.362 -5.138 8.550
750 HA LYS 97 HA LYS 97 2.278 -8.029 8.743
751 HB2 LYS 97 2HB LYS 97 4.253 -7.034 7.766
752 HB3 LYS 97 1HB LYS 97 4.509 -6.030 9.185
753 HG2 LYS 97 2HG LYS 97 6.089 -7.853 9.194
754 HG3 LYS 97 1HG LYS 97 4.948 -8.063 10.522
755 HD2 LYS 97 2HD LYS 97 5.297 -10.200 9.485
756 HD3 LYS 97 1HD LYS 97 3.667 -9.659 9.078
757 HE2 LYS 97 2HE LYS 97 4.506 -8.875 6.888
758 HE3 LYS 97 1HE LYS 97 6.109 -9.475 7.310
759 HZ1 LYS 97 3HZ LYS 97 5.172 -11.713 7.459
760 HZ2 LYS 97 1HZ LYS 97 4.951 -11.046 5.919
761 HZ3 LYS 97 2HZ LYS 97 3.658 -11.120 7.007
762 H LEU 98 H LEU 98 1.679 -9.076 10.528
763 HA LEU 98 HA LEU 98 1.809 -7.782 13.145
764 HB2 LEU 98 2HB LEU 98 0.703 -10.488 12.365
765 HB3 LEU 98 1HB LEU 98 0.518 -9.713 13.929
766 HG LEU 98 HG LEU 98 -0.652 -8.721 11.317
767 HD11 LEU 98 1HD1 LEU 98 -2.001 -9.956 13.722
768 HD12 LEU 98 2HD1 LEU 98 -1.756 -10.738 12.160
769 HD13 LEU 98 3HD1 LEU 98 -2.806 -9.329 12.282
770 HD21 LEU 98 3HD2 LEU 98 -1.839 -7.079 12.718
771 HD22 LEU 98 1HD2 LEU 98 -0.091 -6.860 12.783
772 HD23 LEU 98 2HD2 LEU 98 -0.933 -7.635 14.125
773 H GLU 99 H GLU 99 3.594 -8.020 14.370
774 HA GLU 99 HA GLU 99 5.593 -9.980 13.736
775 HB2 GLU 99 2HB GLU 99 6.956 -8.935 15.402
776 HB3 GLU 99 1HB GLU 99 6.124 -7.668 14.517
777 HG2 GLU 99 2HG GLU 99 5.901 -6.889 16.654
778 HG3 GLU 99 1HG GLU 99 4.410 -7.816 16.504
779 H HIS 100 H HIS 100 6.577 -11.373 15.450
780 HA HIS 100 HA HIS 100 4.505 -12.533 17.209
781 HB2 HIS 100 2HB HIS 100 6.655 -14.071 15.725
782 HB3 HIS 100 1HB HIS 100 5.354 -14.748 16.705
783 HD1 HIS 100 HD1 HIS 100 6.104 -13.394 13.337
784 HD2 HIS 100 HD2 HIS 100 2.767 -14.621 15.490
785 HE1 HIS 100 HE1 HIS 100 4.252 -13.575 11.658
786 HE2 HIS 100 HE2 HIS 100 2.295 -14.475 12.949
787 H HIS 101 H HIS 101 5.282 -11.303 18.937
788 HA HIS 101 HA HIS 101 7.805 -10.937 19.879
789 HB2 HIS 101 2HB HIS 101 6.710 -10.863 22.195
790 HB3 HIS 101 1HB HIS 101 6.086 -9.774 20.961
791 HD1 HIS 101 HD1 HIS 101 5.212 -12.965 22.766
792 HD2 HIS 101 HD2 HIS 101 3.401 -10.120 20.336
793 HE1 HIS 101 HE1 HIS 101 2.760 -13.496 22.821
794 HE2 HIS 101 HE2 HIS 101 1.713 -11.878 21.213
795 H HIS 102 H HIS 102 9.279 -12.539 19.795
796 HA HIS 102 HA HIS 102 9.102 -14.546 21.943
797 HB2 HIS 102 2HB HIS 102 10.107 -15.087 19.130
798 HB3 HIS 102 1HB HIS 102 10.321 -16.184 20.489
799 HD1 HIS 102 HD1 HIS 102 7.879 -15.114 17.940
800 HD2 HIS 102 HD2 HIS 102 7.899 -17.428 21.389
801 HE1 HIS 102 HE1 HIS 102 5.758 -16.447 17.864
802 HE2 HIS 102 HE2 HIS 102 5.872 -17.958 19.870
803 H HIS 103 H HIS 103 10.479 -13.424 23.298
804 HA HIS 103 HA HIS 103 13.221 -12.927 22.306
805 HB2 HIS 103 2HB HIS 103 11.641 -11.112 24.147
806 HB3 HIS 103 1HB HIS 103 13.297 -10.848 23.606
807 HD1 HIS 103 HD1 HIS 103 13.488 -10.645 20.837
808 HD2 HIS 103 HD2 HIS 103 9.779 -9.909 22.570
809 HE1 HIS 103 HE1 HIS 103 12.183 -9.363 19.117
810 HE2 HIS 103 HE2 HIS 103 9.904 -9.049 20.132
811 H HIS 104 H HIS 104 14.819 -12.638 24.103
812 HA HIS 104 HA HIS 104 14.421 -14.781 26.053
813 HB2 HIS 104 2HB HIS 104 16.922 -13.268 25.260
814 HB3 HIS 104 1HB HIS 104 16.869 -14.619 26.389
815 HD1 HIS 104 HD1 HIS 104 16.800 -16.949 25.432
816 HD2 HIS 104 HD2 HIS 104 16.463 -14.000 22.521
817 HE1 HIS 104 HE1 HIS 104 17.026 -18.137 23.243
818 HE2 HIS 104 HE2 HIS 104 17.025 -16.319 21.511
819 H HIS 105 H HIS 105 15.677 -14.405 28.209
820 HA HIS 105 HA HIS 105 15.025 -11.725 29.285
821 HB2 HIS 105 2HB HIS 105 14.859 -14.411 30.677
822 HB3 HIS 105 1HB HIS 105 14.621 -12.860 31.469
823 HD1 HIS 105 HD1 HIS 105 12.309 -11.921 31.427
824 HD2 HIS 105 HD2 HIS 105 12.799 -15.009 28.694
825 HE1 HIS 105 HE1 HIS 105 10.016 -12.397 30.534
826 HE2 HIS 105 HE2 HIS 105 10.380 -14.093 28.720
Start of MODEL 12
1 H1 MET 1 1H MET 1 37.459 5.963 29.980
2 H2 MET 1 2H MET 1 36.919 4.365 30.044
3 H3 MET 1 3H MET 1 36.335 5.400 28.846
4 HA MET 1 HA MET 1 37.954 3.858 27.962
5 HB2 MET 1 2HB MET 1 39.479 5.561 26.934
6 HB3 MET 1 1HB MET 1 37.770 5.960 26.836
7 HG2 MET 1 2HG MET 1 38.983 7.942 27.366
8 HG3 MET 1 1HG MET 1 38.060 7.464 28.787
9 HE1 MET 1 3HE MET 1 41.250 9.085 30.357
10 HE2 MET 1 1HE MET 1 39.486 9.065 30.343
11 HE3 MET 1 2HE MET 1 40.374 9.599 28.916
12 H ASP 2 H ASP 2 40.339 3.435 27.718
13 HA ASP 2 HA ASP 2 41.306 2.812 30.381
14 HB2 ASP 2 2HB ASP 2 41.227 1.091 28.619
15 HB3 ASP 2 1HB ASP 2 42.404 2.004 27.679
16 H GLN 3 H GLN 3 43.217 3.857 27.520
17 HA GLN 3 HA GLN 3 45.123 5.060 29.405
18 HB2 GLN 3 2HB GLN 3 45.706 3.275 27.594
19 HB3 GLN 3 1HB GLN 3 45.665 4.625 26.475
20 HG2 GLN 3 2HG GLN 3 47.419 4.538 28.924
21 HG3 GLN 3 1HG GLN 3 47.934 3.989 27.333
22 HE21 GLN 3 1HE2 GLN 3 47.225 6.736 29.319
23 HE22 GLN 3 2HE2 GLN 3 47.845 7.925 28.235
24 H LYS 4 H LYS 4 43.621 6.910 29.645
25 HA LYS 4 HA LYS 4 43.177 9.119 29.400
26 HB2 LYS 4 2HB LYS 4 45.697 9.013 29.588
27 HB3 LYS 4 1HB LYS 4 45.764 9.204 27.842
28 HG2 LYS 4 2HG LYS 4 46.149 11.323 28.967
29 HG3 LYS 4 1HG LYS 4 44.656 11.377 28.028
30 HD2 LYS 4 2HD LYS 4 44.346 12.443 30.201
31 HD3 LYS 4 1HD LYS 4 43.354 10.992 30.075
32 HE2 LYS 4 2HE LYS 4 44.391 11.123 32.272
33 HE3 LYS 4 1HE LYS 4 45.029 9.745 31.381
34 HZ1 LYS 4 3HZ LYS 4 46.388 12.375 31.592
35 HZ2 LYS 4 1HZ LYS 4 47.013 10.969 30.897
36 HZ3 LYS 4 2HZ LYS 4 46.740 11.040 32.562
37 H SER 5 H SER 5 42.337 7.299 27.092
38 HA SER 5 HA SER 5 42.483 8.761 24.676
39 HB2 SER 5 2HB SER 5 41.913 6.411 24.610
40 HB3 SER 5 1HB SER 5 40.465 6.689 25.579
41 HG SER 5 HG SER 5 39.784 6.613 23.484
42 H SER 6 H SER 6 41.091 10.200 23.685
43 HA SER 6 HA SER 6 39.309 11.691 25.428
44 HB2 SER 6 2HB SER 6 39.060 13.225 23.507
45 HB3 SER 6 1HB SER 6 40.758 12.923 23.875
46 HG SER 6 HG SER 6 39.447 12.507 21.582
47 H SER 7 H SER 7 39.024 9.071 23.297
48 HA SER 7 HA SER 7 36.099 9.458 23.113
49 HB2 SER 7 2HB SER 7 37.058 9.696 20.880
50 HB3 SER 7 1HB SER 7 37.904 8.159 21.051
51 HG SER 7 HG SER 7 36.103 7.577 20.000
52 HA PRO 8 HA PRO 8 36.150 5.402 25.150
53 HB2 PRO 8 2HB PRO 8 33.534 5.330 25.781
54 HB3 PRO 8 1HB PRO 8 34.670 6.351 26.673
55 HG2 PRO 8 2HG PRO 8 32.769 7.109 24.478
56 HG3 PRO 8 1HG PRO 8 33.094 7.944 26.009
57 HD2 PRO 8 2HD PRO 8 34.216 8.691 23.627
58 HD3 PRO 8 1HD PRO 8 35.001 8.955 25.196
59 H GLN 9 H GLN 9 34.679 6.519 22.312
60 HA GLN 9 HA GLN 9 33.456 3.961 21.584
61 HB2 GLN 9 2HB GLN 9 33.442 6.708 20.328
62 HB3 GLN 9 1HB GLN 9 32.798 5.299 19.499
63 HG2 GLN 9 2HG GLN 9 31.835 6.333 22.161
64 HG3 GLN 9 1HG GLN 9 31.059 6.632 20.606
65 HE21 GLN 9 1HE2 GLN 9 30.074 4.890 19.523
66 HE22 GLN 9 2HE2 GLN 9 29.605 3.456 20.367
67 HA PRO 10 HA PRO 10 36.862 2.936 18.822
68 HB2 PRO 10 2HB PRO 10 35.683 0.996 17.376
69 HB3 PRO 10 1HB PRO 10 36.088 0.753 19.080
70 HG2 PRO 10 2HG PRO 10 33.446 1.439 17.841
71 HG3 PRO 10 1HG PRO 10 33.809 0.269 19.125
72 HD2 PRO 10 2HD PRO 10 32.837 2.797 19.589
73 HD3 PRO 10 1HD PRO 10 33.813 1.886 20.759
74 H ALA 11 H ALA 11 37.283 2.823 16.416
75 HA ALA 11 HA ALA 11 36.156 5.107 15.126
76 HB1 ALA 11 3HB ALA 11 37.966 2.974 13.998
77 HB2 ALA 11 1HB ALA 11 38.486 4.460 14.793
78 HB3 ALA 11 2HB ALA 11 37.624 4.536 13.255
79 H ALA 12 H ALA 12 33.892 4.467 15.161
80 HA ALA 12 HA ALA 12 33.115 2.514 13.097
81 HB1 ALA 12 3HB ALA 12 30.903 2.558 14.108
82 HB2 ALA 12 1HB ALA 12 31.409 3.838 15.213
83 HB3 ALA 12 2HB ALA 12 32.128 2.231 15.334
84 H GLN 13 H GLN 13 32.542 3.254 11.141
85 HA GLN 13 HA GLN 13 32.162 6.109 10.734
86 HB2 GLN 13 2HB GLN 13 32.136 3.855 8.710
87 HB3 GLN 13 1HB GLN 13 32.202 5.573 8.347
88 HG2 GLN 13 2HG GLN 13 34.326 3.944 9.733
89 HG3 GLN 13 1HG GLN 13 34.389 4.595 8.098
90 HE21 GLN 13 1HE2 GLN 13 34.630 5.336 11.481
91 HE22 GLN 13 2HE2 GLN 13 35.275 6.925 11.293
92 H ALA 14 H ALA 14 30.359 7.024 9.591
93 HA ALA 14 HA ALA 14 27.819 5.639 10.132
94 HB1 ALA 14 3HB ALA 14 28.343 8.565 9.589
95 HB2 ALA 14 1HB ALA 14 28.089 7.831 11.173
96 HB3 ALA 14 2HB ALA 14 26.779 7.854 9.992
97 HA PRO 15 HA PRO 15 27.155 5.125 5.730
98 HB2 PRO 15 2HB PRO 15 24.557 4.410 5.766
99 HB3 PRO 15 1HB PRO 15 25.825 3.347 6.384
100 HG2 PRO 15 2HG PRO 15 23.973 5.157 7.898
101 HG3 PRO 15 1HG PRO 15 24.437 3.482 8.257
102 HD2 PRO 15 2HD PRO 15 25.571 5.645 9.485
103 HD3 PRO 15 1HD PRO 15 26.431 4.115 9.228
104 H GLU 16 H GLU 16 25.486 5.834 4.013
105 HA GLU 16 HA GLU 16 25.327 8.667 4.047
106 HB2 GLU 16 2HB GLU 16 24.204 6.614 2.142
107 HB3 GLU 16 1HB GLU 16 24.000 8.344 1.899
108 HG2 GLU 16 2HG GLU 16 26.534 8.510 2.004
109 HG3 GLU 16 1HG GLU 16 26.549 6.752 1.882
110 H THR 17 H THR 17 23.275 9.816 3.330
111 HA THR 17 HA THR 17 21.553 10.027 5.477
112 HB THR 17 HB THR 17 20.912 10.809 2.616
113 HG1 THR 17 HG1 THR 17 22.121 12.571 2.941
114 HG21 THR 17 3HG2 THR 17 19.535 12.575 3.672
115 HG22 THR 17 1HG2 THR 17 19.867 11.867 5.253
116 HG23 THR 17 2HG2 THR 17 18.949 10.956 4.052
117 H LYS 18 H LYS 18 19.520 9.319 6.000
118 HA LYS 18 HA LYS 18 18.051 7.595 4.134
119 HB2 LYS 18 2HB LYS 18 19.202 5.988 5.507
120 HB3 LYS 18 1HB LYS 18 18.784 6.856 6.978
121 HG2 LYS 18 2HG LYS 18 16.397 6.324 6.573
122 HG3 LYS 18 1HG LYS 18 16.871 5.379 5.162
123 HD2 LYS 18 2HD LYS 18 18.036 4.788 7.871
124 HD3 LYS 18 1HD LYS 18 16.445 4.173 7.425
125 HE2 LYS 18 2HE LYS 18 18.121 2.489 6.986
126 HE3 LYS 18 1HE LYS 18 17.452 3.061 5.462
127 HZ1 LYS 18 3HZ LYS 18 20.001 4.055 6.602
128 HZ2 LYS 18 1HZ LYS 18 19.402 4.315 5.042
129 HZ3 LYS 18 2HZ LYS 18 19.908 2.770 5.510
130 H GLN 19 H GLN 19 15.838 7.870 4.224
131 HA GLN 19 HA GLN 19 14.830 9.905 6.080
132 HB2 GLN 19 2HB GLN 19 13.496 8.630 3.681
133 HB3 GLN 19 1HB GLN 19 12.835 9.947 4.635
134 HG2 GLN 19 2HG GLN 19 15.353 10.053 2.979
135 HG3 GLN 19 1HG GLN 19 13.791 10.749 2.545
136 HE21 GLN 19 1HE2 GLN 19 16.581 11.038 4.604
137 HE22 GLN 19 2HE2 GLN 19 16.262 12.644 5.147
138 H ALA 20 H ALA 20 13.227 9.517 7.590
139 HA ALA 20 HA ALA 20 13.036 6.826 8.548
140 HB1 ALA 20 3HB ALA 20 11.755 7.769 10.382
141 HB2 ALA 20 1HB ALA 20 11.605 9.297 9.512
142 HB3 ALA 20 2HB ALA 20 13.188 8.745 10.059
143 H PHE 21 H PHE 21 11.554 5.335 8.102
144 HA PHE 21 HA PHE 21 9.200 5.886 6.534
145 HB2 PHE 21 2HB PHE 21 10.231 3.376 7.874
146 HB3 PHE 21 1HB PHE 21 8.732 3.422 6.958
147 HD1 PHE 21 HD1 PHE 21 8.917 4.275 4.505
148 HD2 PHE 21 HD2 PHE 21 12.215 2.846 6.794
149 HE1 PHE 21 HE1 PHE 21 10.152 3.814 2.430
150 HE2 PHE 21 HE2 PHE 21 13.457 2.390 4.720
151 HZ PHE 21 HZ PHE 21 12.426 2.873 2.536
152 HA PRO 22 HA PRO 22 6.750 6.458 10.327
153 HB2 PRO 22 2HB PRO 22 4.649 7.704 9.205
154 HB3 PRO 22 1HB PRO 22 6.187 8.541 9.460
155 HG2 PRO 22 2HG PRO 22 5.076 7.339 6.947
156 HG3 PRO 22 1HG PRO 22 5.940 8.873 7.165
157 HD2 PRO 22 2HD PRO 22 7.100 6.536 6.254
158 HD3 PRO 22 1HD PRO 22 7.992 7.861 7.025
159 H ARG 23 H ARG 23 6.245 4.306 10.759
160 HA ARG 23 HA ARG 23 4.504 2.787 9.028
161 HB2 ARG 23 2HB ARG 23 4.726 1.007 10.743
162 HB3 ARG 23 1HB ARG 23 6.276 1.615 10.181
163 HG2 ARG 23 2HG ARG 23 6.485 2.971 12.209
164 HG3 ARG 23 1HG ARG 23 4.923 2.369 12.770
165 HD2 ARG 23 2HD ARG 23 5.817 0.090 12.829
166 HD3 ARG 23 1HD ARG 23 7.374 0.674 12.236
167 HE ARG 23 HE ARG 23 6.841 2.126 14.513
168 HH11 ARG 23 1HH1 ARG 23 7.260 -1.218 13.752
169 HH12 ARG 23 2HH1 ARG 23 7.892 -1.590 15.317
170 HH21 ARG 23 1HH2 ARG 23 7.663 1.620 16.499
171 HH22 ARG 23 2HH2 ARG 23 8.121 -0.015 16.841
172 H LYS 24 H LYS 24 4.192 4.560 12.032
173 HA LYS 24 HA LYS 24 1.756 3.585 12.983
174 HB2 LYS 24 2HB LYS 24 2.828 6.414 13.169
175 HB3 LYS 24 1HB LYS 24 1.608 5.703 14.223
176 HG2 LYS 24 2HG LYS 24 3.192 4.187 15.167
177 HG3 LYS 24 1HG LYS 24 4.407 4.616 13.963
178 HD2 LYS 24 2HD LYS 24 4.971 5.707 16.023
179 HD3 LYS 24 1HD LYS 24 4.419 6.933 14.884
180 HE2 LYS 24 2HE LYS 24 2.187 6.872 15.960
181 HE3 LYS 24 1HE LYS 24 2.817 5.719 17.137
182 HZ1 LYS 24 3HZ LYS 24 3.643 8.540 16.757
183 HZ2 LYS 24 1HZ LYS 24 4.510 7.445 17.713
184 HZ3 LYS 24 2HZ LYS 24 2.923 7.845 18.119
185 H PHE 25 H PHE 25 2.376 6.221 10.675
186 HA PHE 25 HA PHE 25 -0.392 6.883 10.329
187 HB2 PHE 25 2HB PHE 25 2.070 7.624 8.737
188 HB3 PHE 25 1HB PHE 25 0.457 8.229 8.372
189 HD1 PHE 25 HD1 PHE 25 -0.682 9.757 9.917
190 HD2 PHE 25 HD2 PHE 25 3.325 8.472 10.594
191 HE1 PHE 25 HE1 PHE 25 -0.371 11.595 11.518
192 HE2 PHE 25 HE2 PHE 25 3.637 10.307 12.205
193 HZ PHE 25 HZ PHE 25 1.794 11.869 12.666
194 H VAL 26 H VAL 26 1.989 5.263 8.203
195 HA VAL 26 HA VAL 26 0.234 4.821 6.066
196 HB VAL 26 HB VAL 26 2.633 3.125 6.791
197 HG11 VAL 26 1HG1 VAL 26 1.228 3.562 4.149
198 HG12 VAL 26 2HG1 VAL 26 1.228 2.078 5.104
199 HG13 VAL 26 3HG1 VAL 26 2.725 2.655 4.372
200 HG21 VAL 26 3HG2 VAL 26 3.213 5.513 6.679
201 HG22 VAL 26 1HG2 VAL 26 2.501 5.611 5.068
202 HG23 VAL 26 2HG2 VAL 26 3.927 4.610 5.344
203 H LEU 27 H LEU 27 1.074 2.642 8.778
204 HA LEU 27 HA LEU 27 -0.568 0.494 7.921
205 HB2 LEU 27 2HB LEU 27 0.444 1.226 10.673
206 HB3 LEU 27 1HB LEU 27 -0.415 -0.262 10.315
207 HG LEU 27 HG LEU 27 2.252 0.554 9.130
208 HD11 LEU 27 1HD1 LEU 27 2.414 -0.035 11.498
209 HD12 LEU 27 2HD1 LEU 27 3.172 -1.259 10.481
210 HD13 LEU 27 3HD1 LEU 27 1.582 -1.558 11.184
211 HD21 LEU 27 3HD2 LEU 27 0.932 -0.792 7.573
212 HD22 LEU 27 1HD2 LEU 27 0.669 -2.004 8.826
213 HD23 LEU 27 2HD2 LEU 27 2.295 -1.717 8.202
214 H ALA 28 H ALA 28 -1.260 3.408 9.758
215 HA ALA 28 HA ALA 28 -3.889 2.661 10.584
216 HB1 ALA 28 3HB ALA 28 -2.652 4.462 11.693
217 HB2 ALA 28 1HB ALA 28 -4.204 5.038 11.082
218 HB3 ALA 28 2HB ALA 28 -2.715 5.424 10.218
219 H ALA 29 H ALA 29 -2.610 4.417 7.769
220 HA ALA 29 HA ALA 29 -5.099 4.918 6.511
221 HB1 ALA 29 3HB ALA 29 -2.386 4.549 5.227
222 HB2 ALA 29 1HB ALA 29 -3.010 6.060 5.881
223 HB3 ALA 29 2HB ALA 29 -3.795 5.315 4.490
224 H LEU 30 H LEU 30 -2.875 2.205 6.452
225 HA LEU 30 HA LEU 30 -3.981 0.687 4.388
226 HB2 LEU 30 2HB LEU 30 -1.801 0.235 5.409
227 HB3 LEU 30 1HB LEU 30 -2.587 -0.227 6.906
228 HG LEU 30 HG LEU 30 -3.592 -2.178 5.804
229 HD11 LEU 30 1HD1 LEU 30 -3.830 -1.272 3.553
230 HD12 LEU 30 2HD1 LEU 30 -2.944 -2.796 3.526
231 HD13 LEU 30 3HD1 LEU 30 -2.076 -1.271 3.352
232 HD21 LEU 30 3HD2 LEU 30 -0.609 -1.958 5.367
233 HD22 LEU 30 1HD2 LEU 30 -1.532 -3.460 5.447
234 HD23 LEU 30 2HD2 LEU 30 -1.412 -2.422 6.866
235 H GLU 31 H GLU 31 -4.527 0.250 7.915
236 HA GLU 31 HA GLU 31 -6.513 -1.708 7.651
237 HB2 GLU 31 2HB GLU 31 -7.110 -1.214 9.984
238 HB3 GLU 31 1HB GLU 31 -5.370 -1.333 9.760
239 HG2 GLU 31 2HG GLU 31 -5.156 1.078 9.818
240 HG3 GLU 31 1HG GLU 31 -6.907 1.258 9.909
241 H GLN 32 H GLN 32 -6.782 1.787 7.488
242 HA GLN 32 HA GLN 32 -9.650 1.840 7.648
243 HB2 GLN 32 2HB GLN 32 -7.648 3.915 6.731
244 HB3 GLN 32 1HB GLN 32 -9.379 4.208 6.839
245 HG2 GLN 32 2HG GLN 32 -9.299 3.692 9.250
246 HG3 GLN 32 1HG GLN 32 -7.555 3.475 9.125
247 HE21 GLN 32 1HE2 GLN 32 -6.247 5.281 8.837
248 HE22 GLN 32 2HE2 GLN 32 -6.824 6.884 9.107
249 H SER 33 H SER 33 -7.379 1.243 5.128
250 HA SER 33 HA SER 33 -9.429 1.512 3.038
251 HB2 SER 33 2HB SER 33 -6.486 0.802 2.802
252 HB3 SER 33 1HB SER 33 -7.588 1.084 1.453
253 HG SER 33 HG SER 33 -6.582 2.920 3.346
254 H SER 34 H SER 34 -7.877 -0.845 5.002
255 HA SER 34 HA SER 34 -8.280 -3.134 3.355
256 HB2 SER 34 2HB SER 34 -7.777 -2.864 6.331
257 HB3 SER 34 1HB SER 34 -7.897 -4.417 5.506
258 HG SER 34 HG SER 34 -5.932 -4.168 4.821
259 H ASP 35 H ASP 35 -10.085 -4.230 2.957
260 HA ASP 35 HA ASP 35 -12.569 -3.559 4.225
261 HB2 ASP 35 2HB ASP 35 -11.778 -5.637 2.179
262 HB3 ASP 35 1HB ASP 35 -13.432 -5.461 2.762
263 H ASP 36 H ASP 36 -13.976 -5.832 4.543
264 HA ASP 36 HA ASP 36 -13.583 -6.652 7.110
265 HB2 ASP 36 2HB ASP 36 -15.639 -7.081 5.896
266 HB3 ASP 36 1HB ASP 36 -14.817 -8.219 4.835
267 H ALA 37 H ALA 37 -12.185 -8.210 4.238
268 HA ALA 37 HA ALA 37 -11.118 -10.448 5.701
269 HB1 ALA 37 3HB ALA 37 -10.105 -11.090 3.575
270 HB2 ALA 37 1HB ALA 37 -10.541 -9.526 2.885
271 HB3 ALA 37 2HB ALA 37 -11.803 -10.662 3.367
272 H GLY 38 H GLY 38 -10.137 -7.351 5.841
273 HA2 GLY 38 2HA GLY 38 -8.201 -6.472 6.769
274 HA3 GLY 38 1HA GLY 38 -7.458 -8.058 6.669
275 H TRP 39 H TRP 39 -8.585 -7.589 3.662
276 HA TRP 39 HA TRP 39 -5.967 -6.785 2.673
277 HB2 TRP 39 2HB TRP 39 -8.402 -7.961 1.321
278 HB3 TRP 39 1HB TRP 39 -6.966 -7.460 0.433
279 HD1 TRP 39 HD1 TRP 39 -8.388 -10.385 2.232
280 HE1 TRP 39 HE1 TRP 39 -6.605 -12.229 2.471
281 HE3 TRP 39 HE3 TRP 39 -4.268 -7.689 0.898
282 HZ2 TRP 39 HZ2 TRP 39 -3.807 -12.496 2.133
283 HZ3 TRP 39 HZ3 TRP 39 -2.075 -8.804 0.877
284 HH2 TRP 39 HH2 TRP 39 -1.853 -11.156 1.483
285 H ALA 40 H ALA 40 -5.493 -4.912 1.714
286 HA ALA 40 HA ALA 40 -7.687 -3.083 0.942
287 HB1 ALA 40 3HB ALA 40 -6.185 -1.224 1.430
288 HB2 ALA 40 1HB ALA 40 -4.916 -2.357 1.898
289 HB3 ALA 40 2HB ALA 40 -6.397 -2.249 2.850
290 H ASN 41 H ASN 41 -7.832 -2.699 -1.185
291 HA ASN 41 HA ASN 41 -5.961 -3.645 -3.083
292 HB2 ASN 41 2HB ASN 41 -8.388 -3.294 -3.522
293 HB3 ASN 41 1HB ASN 41 -8.120 -1.553 -3.477
294 HD21 ASN 41 1HD2 ASN 41 -8.959 -3.558 -5.603
295 HD22 ASN 41 2HD2 ASN 41 -7.958 -3.157 -6.952
296 H LEU 42 H LEU 42 -4.157 -2.777 -3.890
297 HA LEU 42 HA LEU 42 -2.747 -0.740 -2.728
298 HB2 LEU 42 2HB LEU 42 -1.779 -2.425 -4.221
299 HB3 LEU 42 1HB LEU 42 -2.559 -1.671 -5.597
300 HG LEU 42 HG LEU 42 -1.188 0.374 -5.214
301 HD11 LEU 42 1HD1 LEU 42 0.743 0.267 -3.723
302 HD12 LEU 42 2HD1 LEU 42 0.227 -1.320 -3.153
303 HD13 LEU 42 3HD1 LEU 42 -0.767 0.100 -2.827
304 HD21 LEU 42 3HD2 LEU 42 0.913 -0.570 -6.060
305 HD22 LEU 42 1HD2 LEU 42 -0.488 -1.293 -6.852
306 HD23 LEU 42 2HD2 LEU 42 0.375 -2.187 -5.600
307 H GLY 43 H GLY 43 -4.840 -0.445 -5.602
308 HA2 GLY 43 2HA GLY 43 -4.253 2.178 -6.343
309 HA3 GLY 43 1HA GLY 43 -5.803 1.394 -6.594
310 H ASN 44 H ASN 44 -6.772 1.087 -4.062
311 HA ASN 44 HA ASN 44 -7.553 3.769 -3.389
312 HB2 ASN 44 2HB ASN 44 -8.205 1.122 -2.067
313 HB3 ASN 44 1HB ASN 44 -8.952 2.666 -1.653
314 HD21 ASN 44 1HD2 ASN 44 -10.110 0.196 -2.735
315 HD22 ASN 44 2HD2 ASN 44 -10.924 0.670 -4.183
316 H PHE 45 H PHE 45 -5.449 1.332 -1.949
317 HA PHE 45 HA PHE 45 -4.952 2.464 0.540
318 HB2 PHE 45 2HB PHE 45 -4.109 0.270 0.064
319 HB3 PHE 45 1HB PHE 45 -3.154 0.859 -1.292
320 HD1 PHE 45 HD1 PHE 45 -3.499 1.343 2.401
321 HD2 PHE 45 HD2 PHE 45 -0.888 1.225 -0.968
322 HE1 PHE 45 HE1 PHE 45 -1.560 1.609 3.891
323 HE2 PHE 45 HE2 PHE 45 1.051 1.482 0.527
324 HZ PHE 45 HZ PHE 45 0.716 1.678 2.953
325 H GLY 46 H GLY 46 -3.084 2.974 -2.476
326 HA2 GLY 46 2HA GLY 46 -1.294 4.881 -1.482
327 HA3 GLY 46 1HA GLY 46 -1.767 4.730 -3.167
328 H ASN 47 H ASN 47 -4.537 5.304 -2.801
329 HA ASN 47 HA ASN 47 -4.512 8.124 -2.956
330 HB2 ASN 47 2HB ASN 47 -6.158 6.599 -4.079
331 HB3 ASN 47 1HB ASN 47 -6.913 6.328 -2.513
332 HD21 ASN 47 1HD2 ASN 47 -7.961 7.513 -4.985
333 HD22 ASN 47 2HD2 ASN 47 -8.540 9.075 -4.540
334 H TYR 48 H TYR 48 -5.966 5.992 -0.445
335 HA TYR 48 HA TYR 48 -6.678 8.131 1.272
336 HB2 TYR 48 2HB TYR 48 -7.619 5.750 1.307
337 HB3 TYR 48 1HB TYR 48 -6.164 5.293 2.185
338 HD1 TYR 48 HD2 TYR 48 -9.213 7.384 2.322
339 HD2 TYR 48 HD1 TYR 48 -5.934 5.792 4.523
340 HE1 TYR 48 HE2 TYR 48 -10.272 8.110 4.418
341 HE2 TYR 48 HE1 TYR 48 -6.982 6.518 6.620
342 HH TYR 48 HH TYR 48 -10.169 7.406 6.876
343 H LEU 49 H LEU 49 -3.784 6.142 1.038
344 HA LEU 49 HA LEU 49 -2.504 6.882 3.414
345 HB2 LEU 49 2HB LEU 49 -1.659 5.067 2.080
346 HB3 LEU 49 1HB LEU 49 -1.369 6.133 0.717
347 HG LEU 49 HG LEU 49 0.413 7.271 1.964
348 HD11 LEU 49 1HD1 LEU 49 -0.152 5.268 4.149
349 HD12 LEU 49 2HD1 LEU 49 -0.460 7.005 4.220
350 HD13 LEU 49 3HD1 LEU 49 1.194 6.407 4.107
351 HD21 LEU 49 3HD2 LEU 49 0.989 5.349 0.568
352 HD22 LEU 49 1HD2 LEU 49 0.746 4.269 1.942
353 HD23 LEU 49 2HD2 LEU 49 2.047 5.459 1.974
354 H ASN 50 H ASN 50 -2.332 8.397 0.191
355 HA ASN 50 HA ASN 50 -0.438 10.368 0.916
356 HB2 ASN 50 2HB ASN 50 -0.977 9.621 -1.423
357 HB3 ASN 50 1HB ASN 50 -2.470 10.549 -1.319
358 HD21 ASN 50 1HD2 ASN 50 1.021 10.753 -1.367
359 HD22 ASN 50 2HD2 ASN 50 1.105 12.413 -1.834
360 H LYS 51 H LYS 51 -3.803 10.141 1.581
361 HA LYS 51 HA LYS 51 -4.323 12.916 2.038
362 HB2 LYS 51 2HB LYS 51 -5.661 10.489 3.268
363 HB3 LYS 51 1HB LYS 51 -6.271 12.136 3.342
364 HG2 LYS 51 2HG LYS 51 -6.507 12.142 0.895
365 HG3 LYS 51 1HG LYS 51 -5.932 10.476 0.850
366 HD2 LYS 51 2HD LYS 51 -8.281 10.301 0.750
367 HD3 LYS 51 1HD LYS 51 -7.870 9.926 2.420
368 HE2 LYS 51 2HE LYS 51 -8.794 12.638 1.466
369 HE3 LYS 51 1HE LYS 51 -9.855 11.413 2.150
370 HZ1 LYS 51 3HZ LYS 51 -8.575 11.518 4.208
371 HZ2 LYS 51 1HZ LYS 51 -9.218 13.028 3.808
372 HZ3 LYS 51 2HZ LYS 51 -7.582 12.717 3.547
373 H LEU 52 H LEU 52 -3.286 10.236 4.127
374 HA LEU 52 HA LEU 52 -3.129 11.929 6.472
375 HB2 LEU 52 2HB LEU 52 -2.192 9.083 6.062
376 HB3 LEU 52 1HB LEU 52 -2.277 9.917 7.604
377 HG LEU 52 HG LEU 52 -4.614 9.126 5.851
378 HD11 LEU 52 1HD1 LEU 52 -5.211 7.673 7.726
379 HD12 LEU 52 2HD1 LEU 52 -3.757 8.180 8.590
380 HD13 LEU 52 3HD1 LEU 52 -3.619 7.270 7.086
381 HD21 LEU 52 3HD2 LEU 52 -4.619 10.605 8.487
382 HD22 LEU 52 1HD2 LEU 52 -6.042 10.009 7.633
383 HD23 LEU 52 2HD2 LEU 52 -5.053 11.280 6.917
384 H GLN 53 H GLN 53 -0.900 10.645 4.082
385 HA GLN 53 HA GLN 53 1.249 12.273 5.271
386 HB2 GLN 53 2HB GLN 53 1.471 9.415 4.311
387 HB3 GLN 53 1HB GLN 53 2.868 10.459 4.521
388 HG2 GLN 53 2HG GLN 53 0.929 9.805 6.730
389 HG3 GLN 53 1HG GLN 53 2.401 8.892 6.412
390 HE21 GLN 53 1HE2 GLN 53 1.094 11.893 7.575
391 HE22 GLN 53 2HE2 GLN 53 2.556 12.485 8.281
392 HA PRO 54 HA PRO 54 0.851 13.284 0.720
393 HB2 PRO 54 2HB PRO 54 1.146 16.046 1.702
394 HB3 PRO 54 1HB PRO 54 -0.098 15.362 0.654
395 HG2 PRO 54 2HG PRO 54 -0.600 16.111 3.198
396 HG3 PRO 54 1HG PRO 54 -1.444 14.755 2.424
397 HD2 PRO 54 2HD PRO 54 0.825 14.714 4.384
398 HD3 PRO 54 1HD PRO 54 -0.599 13.654 4.283
399 H ASP 55 H ASP 55 2.889 14.431 3.338
400 HA ASP 55 HA ASP 55 5.084 15.324 1.773
401 HB2 ASP 55 2HB ASP 55 4.699 16.070 4.080
402 HB3 ASP 55 1HB ASP 55 4.955 14.430 4.667
403 H PHE 56 H PHE 56 3.960 12.196 2.535
404 HA PHE 56 HA PHE 56 6.572 10.909 2.432
405 HB2 PHE 56 2HB PHE 56 4.873 10.085 4.015
406 HB3 PHE 56 1HB PHE 56 3.792 9.724 2.677
407 HD1 PHE 56 HD1 PHE 56 7.148 8.868 4.046
408 HD2 PHE 56 HD2 PHE 56 3.826 7.610 1.691
409 HE1 PHE 56 HE1 PHE 56 8.109 6.610 3.899
410 HE2 PHE 56 HE2 PHE 56 4.787 5.349 1.541
411 HZ PHE 56 HZ PHE 56 6.930 4.847 2.647
412 H ASP 57 H ASP 57 7.460 10.784 0.447
413 HA ASP 57 HA ASP 57 5.802 9.770 -1.773
414 HB2 ASP 57 2HB ASP 57 6.225 12.158 -2.094
415 HB3 ASP 57 1HB ASP 57 7.957 11.890 -1.922
416 H SER 58 H SER 58 6.721 8.282 -3.133
417 HA SER 58 HA SER 58 8.668 6.558 -2.035
418 HB2 SER 58 2HB SER 58 7.663 6.628 -4.893
419 HB3 SER 58 1HB SER 58 8.434 5.262 -4.086
420 HG SER 58 HG SER 58 5.871 6.353 -3.706
421 H ARG 59 H ARG 59 8.943 9.107 -4.472
422 HA ARG 59 HA ARG 59 11.414 8.312 -5.588
423 HB2 ARG 59 2HB ARG 59 10.299 11.118 -5.339
424 HB3 ARG 59 1HB ARG 59 11.574 10.612 -6.437
425 HG2 ARG 59 2HG ARG 59 8.753 9.552 -6.513
426 HG3 ARG 59 1HG ARG 59 9.345 10.885 -7.502
427 HD2 ARG 59 2HD ARG 59 11.028 9.377 -8.491
428 HD3 ARG 59 1HD ARG 59 10.379 8.046 -7.532
429 HE ARG 59 HE ARG 59 8.213 8.588 -8.780
430 HH11 ARG 59 1HH1 ARG 59 11.370 8.895 -10.142
431 HH12 ARG 59 2HH1 ARG 59 10.790 8.728 -11.763
432 HH21 ARG 59 1HH2 ARG 59 7.509 8.329 -10.846
433 HH22 ARG 59 2HH2 ARG 59 8.632 8.396 -12.158
434 H LEU 60 H LEU 60 10.640 9.906 -2.609
435 HA LEU 60 HA LEU 60 13.124 11.143 -2.044
436 HB2 LEU 60 2HB LEU 60 11.135 9.990 -0.076
437 HB3 LEU 60 1HB LEU 60 12.363 11.194 0.272
438 HG LEU 60 HG LEU 60 9.986 11.597 -1.557
439 HD11 LEU 60 1HD1 LEU 60 9.320 11.431 0.779
440 HD12 LEU 60 2HD1 LEU 60 9.157 13.087 0.198
441 HD13 LEU 60 3HD1 LEU 60 10.522 12.643 1.226
442 HD21 LEU 60 3HD2 LEU 60 11.930 12.913 -2.248
443 HD22 LEU 60 1HD2 LEU 60 12.083 13.560 -0.615
444 HD23 LEU 60 2HD2 LEU 60 10.661 13.943 -1.587
445 H TYR 61 H TYR 61 12.135 7.844 -1.983
446 HA TYR 61 HA TYR 61 14.522 7.044 -0.442
447 HB2 TYR 61 2HB TYR 61 12.027 5.444 -1.091
448 HB3 TYR 61 1HB TYR 61 13.369 4.899 -0.090
449 HD1 TYR 61 HD1 TYR 61 10.511 7.233 -0.279
450 HD2 TYR 61 HD2 TYR 61 13.561 5.601 2.203
451 HE1 TYR 61 HE1 TYR 61 9.405 8.181 1.699
452 HE2 TYR 61 HE2 TYR 61 12.458 6.549 4.184
453 HH TYR 61 HH TYR 61 10.897 8.284 4.783
454 H GLY 62 H GLY 62 13.968 7.668 -3.494
455 HA2 GLY 62 2HA GLY 62 15.153 7.044 -5.385
456 HA3 GLY 62 1HA GLY 62 15.854 5.717 -4.477
457 H TYR 63 H TYR 63 12.446 5.757 -4.316
458 HA TYR 63 HA TYR 63 12.312 3.565 -6.271
459 HB2 TYR 63 2HB TYR 63 10.472 4.318 -3.987
460 HB3 TYR 63 1HB TYR 63 10.104 3.050 -5.155
461 HD1 TYR 63 HD1 TYR 63 12.343 4.030 -2.393
462 HD2 TYR 63 HD2 TYR 63 11.226 0.921 -5.076
463 HE1 TYR 63 HE1 TYR 63 13.648 2.423 -1.067
464 HE2 TYR 63 HE2 TYR 63 12.527 -0.695 -3.758
465 HH TYR 63 HH TYR 63 14.573 -0.537 -2.172
466 H LYS 64 H LYS 64 11.043 3.640 -8.056
467 HA LYS 64 HA LYS 64 10.333 6.254 -8.989
468 HB2 LYS 64 2HB LYS 64 9.969 3.549 -10.298
469 HB3 LYS 64 1HB LYS 64 9.773 5.103 -11.101
470 HG2 LYS 64 2HG LYS 64 12.127 5.621 -10.721
471 HG3 LYS 64 1HG LYS 64 12.332 4.097 -9.858
472 HD2 LYS 64 2HD LYS 64 13.167 3.905 -12.133
473 HD3 LYS 64 1HD LYS 64 11.761 2.866 -11.909
474 HE2 LYS 64 2HE LYS 64 10.347 4.497 -13.026
475 HE3 LYS 64 1HE LYS 64 11.709 5.607 -13.176
476 HZ1 LYS 64 3HZ LYS 64 12.810 4.057 -14.619
477 HZ2 LYS 64 1HZ LYS 64 11.264 4.373 -15.225
478 HZ3 LYS 64 2HZ LYS 64 11.581 2.917 -14.423
479 H LYS 65 H LYS 65 8.547 3.804 -7.389
480 HA LYS 65 HA LYS 65 6.257 5.486 -7.289
481 HB2 LYS 65 2HB LYS 65 4.618 3.934 -8.302
482 HB3 LYS 65 1HB LYS 65 5.751 4.595 -9.468
483 HG2 LYS 65 2HG LYS 65 6.946 2.523 -9.596
484 HG3 LYS 65 1HG LYS 65 6.037 1.858 -8.235
485 HD2 LYS 65 2HD LYS 65 5.242 1.014 -10.429
486 HD3 LYS 65 1HD LYS 65 3.992 1.871 -9.527
487 HE2 LYS 65 2HE LYS 65 4.603 3.925 -10.890
488 HE3 LYS 65 1HE LYS 65 5.575 2.856 -11.900
489 HZ1 LYS 65 3HZ LYS 65 2.662 2.560 -11.412
490 HZ2 LYS 65 1HZ LYS 65 3.602 1.600 -12.437
491 HZ3 LYS 65 2HZ LYS 65 3.349 3.233 -12.800
492 H LEU 66 H LEU 66 4.505 4.614 -5.963
493 HA LEU 66 HA LEU 66 5.480 3.596 -3.555
494 HB2 LEU 66 2HB LEU 66 3.454 4.985 -3.800
495 HB3 LEU 66 1HB LEU 66 2.620 3.629 -4.538
496 HG LEU 66 HG LEU 66 2.877 2.355 -2.412
497 HD11 LEU 66 1HD1 LEU 66 3.941 4.969 -1.328
498 HD12 LEU 66 2HD1 LEU 66 4.863 3.481 -1.541
499 HD13 LEU 66 3HD1 LEU 66 3.541 3.538 -0.375
500 HD21 LEU 66 3HD2 LEU 66 0.819 3.600 -2.898
501 HD22 LEU 66 1HD2 LEU 66 1.496 5.028 -2.114
502 HD23 LEU 66 2HD2 LEU 66 1.168 3.575 -1.170
503 H SER 67 H SER 67 3.882 1.923 -6.224
504 HA SER 67 HA SER 67 3.277 -0.522 -5.090
505 HB2 SER 67 2HB SER 67 4.409 -0.130 -7.876
506 HB3 SER 67 1HB SER 67 3.378 -1.454 -7.331
507 HG SER 67 HG SER 67 1.865 -0.177 -8.093
508 H ASP 68 H ASP 68 6.404 0.639 -6.229
509 HA ASP 68 HA ASP 68 7.713 -1.920 -5.868
510 HB2 ASP 68 2HB ASP 68 8.325 -0.281 -7.669
511 HB3 ASP 68 1HB ASP 68 8.940 0.797 -6.420
512 H LEU 69 H LEU 69 7.425 1.117 -4.121
513 HA LEU 69 HA LEU 69 9.427 0.648 -2.168
514 HB2 LEU 69 2HB LEU 69 8.550 2.874 -2.566
515 HB3 LEU 69 1HB LEU 69 6.942 2.363 -2.084
516 HG LEU 69 HG LEU 69 7.875 1.916 0.222
517 HD11 LEU 69 1HD1 LEU 69 9.973 2.965 0.843
518 HD12 LEU 69 2HD1 LEU 69 10.251 3.447 -0.831
519 HD13 LEU 69 3HD1 LEU 69 10.232 1.737 -0.394
520 HD21 LEU 69 3HD2 LEU 69 6.569 3.909 -0.274
521 HD22 LEU 69 1HD2 LEU 69 8.030 4.756 -0.794
522 HD23 LEU 69 2HD2 LEU 69 7.843 4.262 0.889
523 H VAL 70 H VAL 70 5.899 0.120 -2.091
524 HA VAL 70 HA VAL 70 5.651 -0.762 0.531
525 HB VAL 70 HB VAL 70 4.053 -1.663 -1.881
526 HG11 VAL 70 1HG1 VAL 70 3.357 -1.869 1.055
527 HG12 VAL 70 2HG1 VAL 70 3.766 -3.215 -0.008
528 HG13 VAL 70 3HG1 VAL 70 2.296 -2.283 -0.292
529 HG21 VAL 70 3HG2 VAL 70 3.975 0.745 -1.572
530 HG22 VAL 70 1HG2 VAL 70 3.553 0.540 0.130
531 HG23 VAL 70 2HG2 VAL 70 2.424 0.032 -1.127
532 H LYS 71 H LYS 71 6.078 -2.815 -2.380
533 HA LYS 71 HA LYS 71 6.331 -5.232 -0.933
534 HB2 LYS 71 2HB LYS 71 7.194 -6.206 -3.014
535 HB3 LYS 71 1HB LYS 71 5.752 -5.242 -3.298
536 HG2 LYS 71 2HG LYS 71 7.054 -3.444 -4.214
537 HG3 LYS 71 1HG LYS 71 8.560 -4.244 -3.761
538 HD2 LYS 71 2HD LYS 71 6.544 -5.300 -5.757
539 HD3 LYS 71 1HD LYS 71 8.066 -4.499 -6.160
540 HE2 LYS 71 2HE LYS 71 9.313 -6.278 -5.045
541 HE3 LYS 71 1HE LYS 71 7.804 -7.074 -4.597
542 HZ1 LYS 71 3HZ LYS 71 7.319 -7.350 -6.961
543 HZ2 LYS 71 1HZ LYS 71 8.769 -8.102 -6.534
544 HZ3 LYS 71 2HZ LYS 71 8.798 -6.632 -7.362
545 H ALA 72 H ALA 72 8.599 -2.691 -1.560
546 HA ALA 72 HA ALA 72 10.976 -4.223 -1.077
547 HB1 ALA 72 3HB ALA 72 11.050 -2.148 -2.352
548 HB2 ALA 72 1HB ALA 72 12.097 -2.049 -0.936
549 HB3 ALA 72 2HB ALA 72 10.528 -1.242 -0.933
550 H ARG 73 H ARG 73 8.579 -2.764 0.946
551 HA ARG 73 HA ARG 73 10.304 -3.141 3.320
552 HB2 ARG 73 2HB ARG 73 7.868 -1.354 3.043
553 HB3 ARG 73 1HB ARG 73 8.871 -1.520 4.479
554 HG2 ARG 73 2HG ARG 73 9.689 -0.350 1.823
555 HG3 ARG 73 1HG ARG 73 9.437 0.518 3.340
556 HD2 ARG 73 2HD ARG 73 11.574 -1.556 2.814
557 HD3 ARG 73 1HD ARG 73 11.820 0.187 2.880
558 HE ARG 73 HE ARG 73 10.666 -0.643 5.301
559 HH11 ARG 73 1HH1 ARG 73 13.621 -1.029 3.564
560 HH12 ARG 73 2HH1 ARG 73 14.575 -1.136 5.002
561 HH21 ARG 73 1HH2 ARG 73 11.911 -0.836 7.145
562 HH22 ARG 73 2HH2 ARG 73 13.623 -1.043 6.993
563 H THR 74 H THR 74 9.199 -5.417 2.339
564 HA THR 74 HA THR 74 6.674 -6.193 3.235
565 HB THR 74 HB THR 74 7.562 -8.525 3.304
566 HG1 THR 74 HG1 THR 74 9.814 -8.694 2.509
567 HG21 THR 74 3HG2 THR 74 8.176 -8.643 0.916
568 HG22 THR 74 1HG2 THR 74 8.353 -6.889 0.887
569 HG23 THR 74 2HG2 THR 74 6.772 -7.612 1.192
570 H ASP 75 H ASP 75 9.481 -5.503 5.076
571 HA ASP 75 HA ASP 75 9.135 -6.855 7.449
572 HB2 ASP 75 2HB ASP 75 10.997 -5.311 6.978
573 HB3 ASP 75 1HB ASP 75 9.892 -3.943 7.065
574 H LEU 76 H LEU 76 7.588 -3.808 6.467
575 HA LEU 76 HA LEU 76 5.774 -3.908 8.766
576 HB2 LEU 76 2HB LEU 76 6.160 -1.784 6.648
577 HB3 LEU 76 1HB LEU 76 5.125 -1.638 8.056
578 HG LEU 76 HG LEU 76 8.131 -1.964 8.172
579 HD11 LEU 76 1HD1 LEU 76 6.442 0.515 8.520
580 HD12 LEU 76 2HD1 LEU 76 7.527 0.176 7.170
581 HD13 LEU 76 3HD1 LEU 76 8.181 0.401 8.792
582 HD21 LEU 76 3HD2 LEU 76 6.984 -2.827 10.145
583 HD22 LEU 76 1HD2 LEU 76 6.112 -1.303 10.320
584 HD23 LEU 76 2HD2 LEU 76 7.864 -1.348 10.524
585 H PHE 77 H PHE 77 5.699 -3.957 5.220
586 HA PHE 77 HA PHE 77 2.755 -4.142 5.290
587 HB2 PHE 77 2HB PHE 77 4.496 -3.484 2.900
588 HB3 PHE 77 1HB PHE 77 2.753 -3.273 3.044
589 HD1 PHE 77 HD1 PHE 77 2.380 -1.924 5.561
590 HD2 PHE 77 HD2 PHE 77 5.474 -1.388 2.673
591 HE1 PHE 77 HE1 PHE 77 2.748 0.369 6.370
592 HE2 PHE 77 HE2 PHE 77 5.842 0.898 3.489
593 HZ PHE 77 HZ PHE 77 4.481 1.778 5.337
594 H VAL 78 H VAL 78 1.867 -6.087 4.908
595 HA VAL 78 HA VAL 78 3.394 -8.204 3.610
596 HB VAL 78 HB VAL 78 0.547 -8.228 4.652
597 HG11 VAL 78 1HG1 VAL 78 2.322 -10.514 3.775
598 HG12 VAL 78 2HG1 VAL 78 0.886 -9.928 2.937
599 HG13 VAL 78 3HG1 VAL 78 0.734 -10.679 4.525
600 HG21 VAL 78 3HG2 VAL 78 2.147 -7.851 6.448
601 HG22 VAL 78 1HG2 VAL 78 3.098 -9.239 5.917
602 HG23 VAL 78 2HG2 VAL 78 1.473 -9.478 6.561
603 H THR 79 H THR 79 3.342 -8.540 1.455
604 HA THR 79 HA THR 79 1.160 -7.275 -0.100
605 HB THR 79 HB THR 79 2.738 -7.049 -1.959
606 HG1 THR 79 HG1 THR 79 4.073 -8.890 -1.438
607 HG21 THR 79 3HG2 THR 79 2.651 -5.210 -0.352
608 HG22 THR 79 1HG2 THR 79 4.284 -5.400 -0.987
609 HG23 THR 79 2HG2 THR 79 3.890 -5.988 0.629
610 H GLU 80 H GLU 80 -0.116 -8.586 -1.256
611 HA GLU 80 HA GLU 80 0.912 -11.037 -2.452
612 HB2 GLU 80 2HB GLU 80 -1.352 -11.021 -0.440
613 HB3 GLU 80 1HB GLU 80 -1.098 -12.339 -1.577
614 HG2 GLU 80 2HG GLU 80 1.038 -12.853 -0.602
615 HG3 GLU 80 1HG GLU 80 0.966 -11.426 0.428
616 H GLU 81 H GLU 81 -0.092 -11.518 -4.374
617 HA GLU 81 HA GLU 81 -1.812 -9.408 -5.411
618 HB2 GLU 81 2HB GLU 81 -0.541 -11.748 -6.845
619 HB3 GLU 81 1HB GLU 81 -1.330 -10.372 -7.602
620 HG2 GLU 81 2HG GLU 81 0.398 -8.883 -6.766
621 HG3 GLU 81 1HG GLU 81 1.167 -10.222 -5.915
622 H ARG 82 H ARG 82 -3.897 -9.624 -6.013
623 HA ARG 82 HA ARG 82 -5.158 -12.300 -5.887
624 HB2 ARG 82 2HB ARG 82 -6.390 -9.651 -5.058
625 HB3 ARG 82 1HB ARG 82 -7.197 -11.213 -5.024
626 HG2 ARG 82 2HG ARG 82 -4.774 -10.480 -3.373
627 HG3 ARG 82 1HG ARG 82 -6.443 -10.458 -2.797
628 HD2 ARG 82 2HD ARG 82 -4.939 -12.879 -3.804
629 HD3 ARG 82 1HD ARG 82 -5.298 -12.511 -2.116
630 HE ARG 82 HE ARG 82 -7.739 -12.539 -3.380
631 HH11 ARG 82 1HH1 ARG 82 -5.174 -14.804 -2.914
632 HH12 ARG 82 2HH1 ARG 82 -6.236 -16.169 -3.020
633 HH21 ARG 82 1HH2 ARG 82 -9.071 -14.307 -3.500
634 HH22 ARG 82 2HH2 ARG 82 -8.394 -15.895 -3.354
635 H GLN 83 H GLN 83 -6.430 -12.849 -7.637
636 HA GLN 83 HA GLN 83 -6.414 -11.074 -9.920
637 HB2 GLN 83 2HB GLN 83 -6.085 -13.560 -10.091
638 HB3 GLN 83 1HB GLN 83 -7.782 -13.762 -9.670
639 HG2 GLN 83 2HG GLN 83 -8.459 -12.575 -11.671
640 HG3 GLN 83 1HG GLN 83 -6.777 -12.239 -12.074
641 HE21 GLN 83 1HE2 GLN 83 -6.882 -13.287 -14.045
642 HE22 GLN 83 2HE2 GLN 83 -7.006 -15.006 -14.180
643 H VAL 84 H VAL 84 -8.171 -10.023 -10.850
644 HA VAL 84 HA VAL 84 -10.176 -9.314 -8.860
645 HB VAL 84 HB VAL 84 -9.601 -8.042 -11.546
646 HG11 VAL 84 1HG1 VAL 84 -11.819 -7.486 -10.722
647 HG12 VAL 84 2HG1 VAL 84 -10.760 -6.082 -10.605
648 HG13 VAL 84 3HG1 VAL 84 -11.147 -7.016 -9.159
649 HG21 VAL 84 3HG2 VAL 84 -7.627 -7.972 -10.122
650 HG22 VAL 84 1HG2 VAL 84 -8.580 -7.299 -8.798
651 HG23 VAL 84 2HG2 VAL 84 -8.333 -6.362 -10.272
652 HA PRO 85 HA PRO 85 -13.363 -11.872 -10.887
653 HB2 PRO 85 2HB PRO 85 -15.045 -10.268 -9.011
654 HB3 PRO 85 1HB PRO 85 -14.994 -12.017 -9.266
655 HG2 PRO 85 2HG PRO 85 -13.896 -10.939 -7.097
656 HG3 PRO 85 1HG PRO 85 -13.107 -12.286 -7.937
657 HD2 PRO 85 2HD PRO 85 -12.440 -9.365 -7.996
658 HD3 PRO 85 1HD PRO 85 -11.354 -10.769 -7.954
659 H GLY 86 H GLY 86 -14.402 -11.379 -12.746
660 HA2 GLY 86 2HA GLY 86 -15.766 -10.117 -14.200
661 HA3 GLY 86 1HA GLY 86 -15.583 -8.724 -13.143
662 H SER 87 H SER 87 -12.573 -9.906 -13.428
663 HA SER 87 HA SER 87 -11.920 -8.679 -16.014
664 HB2 SER 87 2HB SER 87 -10.560 -7.971 -13.390
665 HB3 SER 87 1HB SER 87 -9.999 -7.471 -14.985
666 HG SER 87 HG SER 87 -12.226 -6.610 -13.511
667 H THR 88 H THR 88 -9.803 -9.344 -16.829
668 HA THR 88 HA THR 88 -9.103 -12.037 -15.925
669 HB THR 88 HB THR 88 -9.352 -11.690 -18.343
670 HG1 THR 88 HG1 THR 88 -7.100 -12.677 -17.123
671 HG21 THR 88 3HG2 THR 88 -8.594 -9.350 -18.474
672 HG22 THR 88 1HG2 THR 88 -7.718 -10.379 -19.607
673 HG23 THR 88 2HG2 THR 88 -6.948 -9.868 -18.106
674 H GLN 89 H GLN 89 -7.856 -8.813 -15.758
675 HA GLN 89 HA GLN 89 -5.121 -9.537 -15.284
676 HB2 GLN 89 2HB GLN 89 -4.775 -7.188 -14.760
677 HB3 GLN 89 1HB GLN 89 -5.737 -7.347 -16.223
678 HG2 GLN 89 2HG GLN 89 -7.742 -6.761 -15.053
679 HG3 GLN 89 1HG GLN 89 -6.912 -6.819 -13.499
680 HE21 GLN 89 1HE2 GLN 89 -7.393 -4.987 -16.416
681 HE22 GLN 89 2HE2 GLN 89 -6.662 -3.531 -15.846
682 H LYS 90 H LYS 90 -3.948 -9.109 -13.297
683 HA LYS 90 HA LYS 90 -5.562 -9.633 -10.883
684 HB2 LYS 90 2HB LYS 90 -3.578 -10.640 -9.917
685 HB3 LYS 90 1HB LYS 90 -3.917 -11.379 -11.475
686 HG2 LYS 90 2HG LYS 90 -2.173 -9.918 -12.489
687 HG3 LYS 90 1HG LYS 90 -1.787 -9.327 -10.872
688 HD2 LYS 90 2HD LYS 90 -1.477 -12.131 -11.943
689 HD3 LYS 90 1HD LYS 90 -0.207 -11.036 -11.393
690 HE2 LYS 90 2HE LYS 90 -1.214 -11.135 -9.113
691 HE3 LYS 90 1HE LYS 90 -2.326 -12.367 -9.707
692 HZ1 LYS 90 3HZ LYS 90 0.630 -12.560 -9.546
693 HZ2 LYS 90 1HZ LYS 90 -0.357 -13.711 -10.300
694 HZ3 LYS 90 2HZ LYS 90 -0.502 -13.431 -8.639
695 H ALA 91 H ALA 91 -5.162 -8.448 -8.980
696 HA ALA 91 HA ALA 91 -3.557 -5.984 -9.317
697 HB1 ALA 91 3HB ALA 91 -5.940 -5.479 -9.342
698 HB2 ALA 91 1HB ALA 91 -5.186 -4.830 -7.885
699 HB3 ALA 91 2HB ALA 91 -6.149 -6.307 -7.799
700 H LEU 92 H LEU 92 -2.817 -5.014 -7.227
701 HA LEU 92 HA LEU 92 -1.866 -7.144 -5.449
702 HB2 LEU 92 2HB LEU 92 -0.199 -5.657 -6.466
703 HB3 LEU 92 1HB LEU 92 -0.969 -4.270 -5.719
704 HG LEU 92 HG LEU 92 -0.436 -5.304 -3.469
705 HD11 LEU 92 1HD1 LEU 92 1.263 -7.144 -5.158
706 HD12 LEU 92 2HD1 LEU 92 -0.124 -7.609 -4.171
707 HD13 LEU 92 3HD1 LEU 92 1.342 -7.000 -3.403
708 HD21 LEU 92 3HD2 LEU 92 0.881 -3.466 -4.378
709 HD22 LEU 92 1HD2 LEU 92 1.886 -4.604 -5.277
710 HD23 LEU 92 2HD2 LEU 92 1.918 -4.598 -3.513
711 H TYR 93 H TYR 93 -2.770 -7.460 -3.528
712 HA TYR 93 HA TYR 93 -4.125 -5.207 -2.187
713 HB2 TYR 93 2HB TYR 93 -4.684 -8.177 -2.070
714 HB3 TYR 93 1HB TYR 93 -5.322 -7.051 -0.875
715 HD1 TYR 93 HD1 TYR 93 -5.236 -7.635 -4.578
716 HD2 TYR 93 HD2 TYR 93 -7.347 -5.990 -1.264
717 HE1 TYR 93 HE1 TYR 93 -7.136 -7.107 -6.051
718 HE2 TYR 93 HE2 TYR 93 -9.244 -5.460 -2.727
719 HH TYR 93 HH TYR 93 -9.666 -6.737 -5.758
720 H LEU 94 H LEU 94 -3.786 -4.895 0.051
721 HA LEU 94 HA LEU 94 -1.235 -6.050 1.018
722 HB2 LEU 94 2HB LEU 94 -2.178 -3.217 1.460
723 HB3 LEU 94 1HB LEU 94 -0.610 -3.888 1.867
724 HG LEU 94 HG LEU 94 -1.672 -3.442 -0.931
725 HD11 LEU 94 1HD1 LEU 94 0.066 -1.724 -1.068
726 HD12 LEU 94 2HD1 LEU 94 0.463 -1.994 0.631
727 HD13 LEU 94 3HD1 LEU 94 -1.122 -1.362 0.183
728 HD21 LEU 94 3HD2 LEU 94 1.014 -4.457 -0.002
729 HD22 LEU 94 1HD2 LEU 94 0.597 -4.035 -1.662
730 HD23 LEU 94 2HD2 LEU 94 -0.216 -5.381 -0.866
731 H ARG 95 H ARG 95 -0.967 -6.335 3.243
732 HA ARG 95 HA ARG 95 -3.052 -5.423 5.067
733 HB2 ARG 95 2HB ARG 95 -3.194 -7.645 6.192
734 HB3 ARG 95 1HB ARG 95 -3.886 -7.611 4.576
735 HG2 ARG 95 2HG ARG 95 -1.885 -8.706 3.692
736 HG3 ARG 95 1HG ARG 95 -1.179 -8.733 5.312
737 HD2 ARG 95 2HD ARG 95 -2.967 -10.171 6.104
738 HD3 ARG 95 1HD ARG 95 -3.785 -10.066 4.544
739 HE ARG 95 HE ARG 95 -1.303 -11.076 3.970
740 HH11 ARG 95 1HH1 ARG 95 -3.979 -12.023 5.919
741 HH12 ARG 95 2HH1 ARG 95 -3.586 -13.701 5.828
742 HH21 ARG 95 1HH2 ARG 95 -0.840 -13.231 3.808
743 HH22 ARG 95 2HH2 ARG 95 -1.828 -14.385 4.636
744 H ALA 96 H ALA 96 -2.387 -5.686 7.392
745 HA ALA 96 HA ALA 96 0.270 -4.618 7.628
746 HB1 ALA 96 3HB ALA 96 -1.610 -3.689 8.889
747 HB2 ALA 96 1HB ALA 96 -0.309 -4.212 9.958
748 HB3 ALA 96 2HB ALA 96 -1.760 -5.201 9.786
749 H LYS 97 H LYS 97 2.021 -5.404 8.811
750 HA LYS 97 HA LYS 97 2.257 -8.267 9.039
751 HB2 LYS 97 2HB LYS 97 4.160 -6.902 8.308
752 HB3 LYS 97 1HB LYS 97 4.160 -6.053 9.849
753 HG2 LYS 97 2HG LYS 97 5.921 -7.664 9.889
754 HG3 LYS 97 1HG LYS 97 4.652 -8.226 10.975
755 HD2 LYS 97 2HD LYS 97 5.453 -10.102 9.696
756 HD3 LYS 97 1HD LYS 97 3.822 -9.709 9.147
757 HE2 LYS 97 2HE LYS 97 5.281 -10.179 7.252
758 HE3 LYS 97 1HE LYS 97 4.767 -8.493 7.234
759 HZ1 LYS 97 3HZ LYS 97 7.392 -9.498 8.202
760 HZ2 LYS 97 1HZ LYS 97 6.901 -7.877 8.198
761 HZ3 LYS 97 2HZ LYS 97 7.114 -8.699 6.737
762 H LEU 98 H LEU 98 1.011 -9.103 10.652
763 HA LEU 98 HA LEU 98 1.269 -7.971 13.359
764 HB2 LEU 98 2HB LEU 98 -0.802 -9.878 12.252
765 HB3 LEU 98 1HB LEU 98 -0.767 -9.260 13.894
766 HG LEU 98 HG LEU 98 -1.193 -7.618 11.389
767 HD11 LEU 98 1HD1 LEU 98 -3.095 -8.337 13.618
768 HD12 LEU 98 2HD1 LEU 98 -3.118 -8.999 11.983
769 HD13 LEU 98 3HD1 LEU 98 -3.449 -7.287 12.246
770 HD21 LEU 98 3HD2 LEU 98 -1.622 -5.748 12.927
771 HD22 LEU 98 1HD2 LEU 98 0.035 -6.335 13.054
772 HD23 LEU 98 2HD2 LEU 98 -1.149 -6.766 14.289
773 H GLU 99 H GLU 99 2.629 -8.966 14.706
774 HA GLU 99 HA GLU 99 3.853 -11.465 14.071
775 HB2 GLU 99 2HB GLU 99 5.031 -11.224 16.216
776 HB3 GLU 99 1HB GLU 99 5.090 -9.743 15.271
777 HG2 GLU 99 2HG GLU 99 3.515 -8.666 16.668
778 HG3 GLU 99 1HG GLU 99 3.068 -10.179 17.455
779 H HIS 100 H HIS 100 1.031 -10.654 15.897
780 HA HIS 100 HA HIS 100 1.118 -12.821 17.753
781 HB2 HIS 100 2HB HIS 100 -1.051 -10.886 16.963
782 HB3 HIS 100 1HB HIS 100 -1.331 -12.170 18.135
783 HD1 HIS 100 HD1 HIS 100 -0.670 -11.710 20.486
784 HD2 HIS 100 HD2 HIS 100 1.047 -9.011 17.839
785 HE1 HIS 100 HE1 HIS 100 0.443 -9.983 21.919
786 HE2 HIS 100 HE2 HIS 100 1.395 -8.305 20.300
787 H HIS 101 H HIS 101 1.169 -13.576 14.796
788 HA HIS 101 HA HIS 101 -0.513 -15.908 15.279
789 HB2 HIS 101 2HB HIS 101 -1.398 -15.939 12.968
790 HB3 HIS 101 1HB HIS 101 -1.971 -14.568 13.902
791 HD1 HIS 101 HD1 HIS 101 -1.738 -12.341 12.836
792 HD2 HIS 101 HD2 HIS 101 0.690 -15.187 11.028
793 HE1 HIS 101 HE1 HIS 101 -0.809 -11.229 10.790
794 HE2 HIS 101 HE2 HIS 101 0.467 -13.036 9.602
795 H HIS 102 H HIS 102 2.317 -15.496 15.442
796 HA HIS 102 HA HIS 102 3.391 -17.132 13.262
797 HB2 HIS 102 2HB HIS 102 4.650 -15.749 15.629
798 HB3 HIS 102 1HB HIS 102 5.538 -16.952 14.700
799 HD1 HIS 102 HD1 HIS 102 5.526 -16.346 11.976
800 HD2 HIS 102 HD2 HIS 102 5.034 -13.243 14.686
801 HE1 HIS 102 HE1 HIS 102 6.140 -14.265 10.723
802 HE2 HIS 102 HE2 HIS 102 6.102 -12.454 12.465
803 H HIS 103 H HIS 103 3.209 -19.277 13.354
804 HA HIS 103 HA HIS 103 2.536 -20.655 15.795
805 HB2 HIS 103 2HB HIS 103 1.514 -21.423 13.755
806 HB3 HIS 103 1HB HIS 103 3.082 -21.634 12.983
807 HD1 HIS 103 HD1 HIS 103 1.032 -23.120 15.813
808 HD2 HIS 103 HD2 HIS 103 4.139 -24.141 13.250
809 HE1 HIS 103 HE1 HIS 103 1.493 -25.544 16.248
810 HE2 HIS 103 HE2 HIS 103 3.515 -26.070 14.855
811 H HIS 104 H HIS 104 3.944 -21.415 17.250
812 HA HIS 104 HA HIS 104 6.768 -21.528 16.751
813 HB2 HIS 104 2HB HIS 104 5.148 -22.537 19.103
814 HB3 HIS 104 1HB HIS 104 6.905 -22.443 19.057
815 HD1 HIS 104 HD1 HIS 104 3.947 -20.505 19.909
816 HD2 HIS 104 HD2 HIS 104 7.880 -19.684 18.845
817 HE1 HIS 104 HE1 HIS 104 4.352 -18.132 20.618
818 HE2 HIS 104 HE2 HIS 104 6.688 -17.618 19.847
819 H HIS 105 H HIS 105 8.093 -23.489 17.160
820 HA HIS 105 HA HIS 105 7.563 -25.446 15.262
821 HB2 HIS 105 2HB HIS 105 9.801 -24.833 16.194
822 HB3 HIS 105 1HB HIS 105 9.406 -25.739 17.650
823 HD1 HIS 105 HD1 HIS 105 10.099 -28.133 17.625
824 HD2 HIS 105 HD2 HIS 105 9.795 -26.556 13.795
825 HE1 HIS 105 HE1 HIS 105 10.948 -29.929 16.091
826 HE2 HIS 105 HE2 HIS 105 10.925 -28.879 13.807
Start of MODEL 13
1 H1 MET 1 1H MET 1 9.001 24.973 -22.670
2 H2 MET 1 2H MET 1 8.401 23.638 -21.824
3 H3 MET 1 3H MET 1 8.425 23.628 -23.513
4 HA MET 1 HA MET 1 10.846 23.695 -23.497
5 HB2 MET 1 2HB MET 1 10.473 23.401 -20.503
6 HB3 MET 1 1HB MET 1 12.011 23.277 -21.343
7 HG2 MET 1 2HG MET 1 11.864 25.601 -22.018
8 HG3 MET 1 1HG MET 1 10.272 25.738 -21.272
9 HE1 MET 1 3HE MET 1 11.128 25.325 -17.461
10 HE2 MET 1 1HE MET 1 10.649 24.054 -18.588
11 HE3 MET 1 2HE MET 1 9.850 25.626 -18.638
12 H ASP 2 H ASP 2 12.002 21.701 -23.615
13 HA ASP 2 HA ASP 2 10.355 19.447 -24.023
14 HB2 ASP 2 2HB ASP 2 12.514 18.239 -24.401
15 HB3 ASP 2 1HB ASP 2 12.363 19.735 -25.319
16 H GLN 3 H GLN 3 9.907 17.662 -22.827
17 HA GLN 3 HA GLN 3 11.211 17.366 -20.198
18 HB2 GLN 3 2HB GLN 3 9.007 16.576 -19.296
19 HB3 GLN 3 1HB GLN 3 9.055 18.281 -19.716
20 HG2 GLN 3 2HG GLN 3 7.873 17.809 -21.803
21 HG3 GLN 3 1HG GLN 3 7.827 16.095 -21.395
22 HE21 GLN 3 1HE2 GLN 3 5.638 17.981 -21.861
23 HE22 GLN 3 2HE2 GLN 3 4.669 17.942 -20.432
24 H LYS 4 H LYS 4 12.443 15.622 -20.419
25 HA LYS 4 HA LYS 4 11.239 13.144 -21.474
26 HB2 LYS 4 2HB LYS 4 12.637 14.095 -23.243
27 HB3 LYS 4 1HB LYS 4 14.001 14.202 -22.138
28 HG2 LYS 4 2HG LYS 4 14.016 11.742 -21.948
29 HG3 LYS 4 1HG LYS 4 12.678 11.662 -23.095
30 HD2 LYS 4 2HD LYS 4 14.811 11.225 -24.206
31 HD3 LYS 4 1HD LYS 4 14.082 12.713 -24.811
32 HE2 LYS 4 2HE LYS 4 15.566 14.033 -23.391
33 HE3 LYS 4 1HE LYS 4 16.259 12.558 -22.720
34 HZ1 LYS 4 3HZ LYS 4 17.661 13.510 -24.436
35 HZ2 LYS 4 1HZ LYS 4 16.409 13.387 -25.563
36 HZ3 LYS 4 2HZ LYS 4 17.092 11.990 -24.903
37 H SER 5 H SER 5 11.278 11.640 -19.941
38 HA SER 5 HA SER 5 12.914 11.865 -17.597
39 HB2 SER 5 2HB SER 5 10.683 10.935 -17.387
40 HB3 SER 5 1HB SER 5 11.068 9.649 -18.527
41 HG SER 5 HG SER 5 11.264 8.799 -16.496
42 H SER 6 H SER 6 15.020 11.847 -18.607
43 HA SER 6 HA SER 6 15.970 9.203 -19.504
44 HB2 SER 6 2HB SER 6 17.984 10.415 -20.298
45 HB3 SER 6 1HB SER 6 16.507 11.067 -21.006
46 HG SER 6 HG SER 6 17.968 12.153 -18.812
47 H SER 7 H SER 7 17.394 8.020 -18.301
48 HA SER 7 HA SER 7 18.196 9.139 -15.696
49 HB2 SER 7 2HB SER 7 18.509 6.720 -15.037
50 HB3 SER 7 1HB SER 7 16.851 7.176 -15.423
51 HG SER 7 HG SER 7 16.883 5.664 -16.856
52 HA PRO 8 HA PRO 8 22.417 8.930 -17.435
53 HB2 PRO 8 2HB PRO 8 23.507 10.600 -15.571
54 HB3 PRO 8 1HB PRO 8 22.674 11.186 -17.016
55 HG2 PRO 8 2HG PRO 8 21.653 10.935 -14.213
56 HG3 PRO 8 1HG PRO 8 21.416 12.250 -15.378
57 HD2 PRO 8 2HD PRO 8 19.529 10.350 -14.889
58 HD3 PRO 8 1HD PRO 8 19.707 11.149 -16.465
59 H GLN 9 H GLN 9 22.800 6.786 -16.870
60 HA GLN 9 HA GLN 9 22.879 6.016 -14.068
61 HB2 GLN 9 2HB GLN 9 23.174 4.372 -16.591
62 HB3 GLN 9 1HB GLN 9 23.067 3.718 -14.958
63 HG2 GLN 9 2HG GLN 9 20.832 4.606 -14.701
64 HG3 GLN 9 1HG GLN 9 20.934 5.394 -16.273
65 HE21 GLN 9 1HE2 GLN 9 19.104 4.316 -16.996
66 HE22 GLN 9 2HE2 GLN 9 19.137 2.640 -17.420
67 HA PRO 10 HA PRO 10 27.405 6.153 -14.171
68 HB2 PRO 10 2HB PRO 10 27.785 6.559 -11.564
69 HB3 PRO 10 1HB PRO 10 27.128 7.842 -12.588
70 HG2 PRO 10 2HG PRO 10 25.715 6.044 -10.663
71 HG3 PRO 10 1HG PRO 10 25.429 7.757 -11.017
72 HD2 PRO 10 2HD PRO 10 23.992 5.582 -12.075
73 HD3 PRO 10 1HD PRO 10 23.959 7.250 -12.682
74 H ALA 11 H ALA 11 29.088 4.757 -13.371
75 HA ALA 11 HA ALA 11 28.248 2.061 -12.771
76 HB1 ALA 11 3HB ALA 11 30.636 1.523 -12.884
77 HB2 ALA 11 1HB ALA 11 31.022 3.243 -12.965
78 HB3 ALA 11 2HB ALA 11 30.128 2.477 -14.278
79 H ALA 12 H ALA 12 29.536 4.783 -11.001
80 HA ALA 12 HA ALA 12 29.790 3.161 -8.551
81 HB1 ALA 12 3HB ALA 12 30.752 5.974 -9.102
82 HB2 ALA 12 1HB ALA 12 31.739 4.514 -9.164
83 HB3 ALA 12 2HB ALA 12 31.045 5.044 -7.632
84 H GLN 13 H GLN 13 28.295 3.300 -6.985
85 HA GLN 13 HA GLN 13 26.058 5.139 -7.289
86 HB2 GLN 13 2HB GLN 13 26.498 2.950 -5.240
87 HB3 GLN 13 1HB GLN 13 24.983 3.787 -5.560
88 HG2 GLN 13 2HG GLN 13 26.456 2.016 -7.507
89 HG3 GLN 13 1HG GLN 13 25.041 1.555 -6.563
90 HE21 GLN 13 1HE2 GLN 13 25.468 1.710 -9.476
91 HE22 GLN 13 2HE2 GLN 13 24.215 2.737 -10.070
92 H ALA 14 H ALA 14 25.323 6.585 -5.653
93 HA ALA 14 HA ALA 14 27.470 7.486 -3.833
94 HB1 ALA 14 3HB ALA 14 26.461 9.702 -3.953
95 HB2 ALA 14 1HB ALA 14 25.169 9.074 -4.976
96 HB3 ALA 14 2HB ALA 14 26.830 9.095 -5.568
97 HA PRO 15 HA PRO 15 24.747 6.345 -0.415
98 HB2 PRO 15 2HB PRO 15 26.613 7.930 1.236
99 HB3 PRO 15 1HB PRO 15 26.217 6.212 1.330
100 HG2 PRO 15 2HG PRO 15 28.604 7.065 0.434
101 HG3 PRO 15 1HG PRO 15 27.818 5.620 -0.234
102 HD2 PRO 15 2HD PRO 15 27.947 8.403 -1.363
103 HD3 PRO 15 1HD PRO 15 28.145 6.842 -2.190
104 H GLU 16 H GLU 16 22.880 7.536 -0.676
105 HA GLU 16 HA GLU 16 22.942 10.428 -0.138
106 HB2 GLU 16 2HB GLU 16 20.829 8.712 -1.460
107 HB3 GLU 16 1HB GLU 16 20.717 10.453 -1.233
108 HG2 GLU 16 2HG GLU 16 22.634 10.809 -2.669
109 HG3 GLU 16 1HG GLU 16 22.868 9.069 -2.828
110 H THR 17 H THR 17 20.514 11.094 0.655
111 HA THR 17 HA THR 17 20.496 10.264 3.410
112 HB THR 17 HB THR 17 18.673 12.173 1.921
113 HG1 THR 17 HG1 THR 17 20.501 13.088 3.811
114 HG21 THR 17 3HG2 THR 17 18.983 11.694 4.891
115 HG22 THR 17 1HG2 THR 17 17.548 11.367 3.921
116 HG23 THR 17 2HG2 THR 17 18.084 13.029 4.170
117 H LYS 18 H LYS 18 19.061 8.987 4.485
118 HA LYS 18 HA LYS 18 16.900 7.714 2.930
119 HB2 LYS 18 2HB LYS 18 18.533 6.179 3.945
120 HB3 LYS 18 1HB LYS 18 18.189 6.850 5.534
121 HG2 LYS 18 2HG LYS 18 15.835 6.069 5.290
122 HG3 LYS 18 1HG LYS 18 16.297 5.282 3.782
123 HD2 LYS 18 2HD LYS 18 17.565 4.699 6.466
124 HD3 LYS 18 1HD LYS 18 16.233 3.769 5.785
125 HE2 LYS 18 2HE LYS 18 18.215 2.556 5.314
126 HE3 LYS 18 1HE LYS 18 17.729 3.302 3.794
127 HZ1 LYS 18 3HZ LYS 18 19.408 4.959 4.056
128 HZ2 LYS 18 1HZ LYS 18 20.134 3.452 4.283
129 HZ3 LYS 18 2HZ LYS 18 19.786 4.429 5.615
130 H GLN 19 H GLN 19 14.846 8.283 3.340
131 HA GLN 19 HA GLN 19 14.211 10.022 5.561
132 HB2 GLN 19 2HB GLN 19 12.440 8.867 3.393
133 HB3 GLN 19 1HB GLN 19 11.926 10.053 4.584
134 HG2 GLN 19 2HG GLN 19 14.079 10.461 2.508
135 HG3 GLN 19 1HG GLN 19 12.431 11.080 2.425
136 HE21 GLN 19 1HE2 GLN 19 11.818 12.760 3.817
137 HE22 GLN 19 2HE2 GLN 19 12.993 13.748 4.616
138 H ALA 20 H ALA 20 12.529 9.608 7.116
139 HA ALA 20 HA ALA 20 12.664 6.888 8.141
140 HB1 ALA 20 3HB ALA 20 13.023 8.810 9.635
141 HB2 ALA 20 1HB ALA 20 11.682 7.795 10.164
142 HB3 ALA 20 2HB ALA 20 11.362 9.328 9.351
143 H PHE 21 H PHE 21 11.009 5.455 8.327
144 HA PHE 21 HA PHE 21 8.518 5.996 6.907
145 HB2 PHE 21 2HB PHE 21 9.623 3.473 8.167
146 HB3 PHE 21 1HB PHE 21 8.062 3.561 7.362
147 HD1 PHE 21 HD1 PHE 21 8.104 4.443 4.901
148 HD2 PHE 21 HD2 PHE 21 11.489 2.846 6.941
149 HE1 PHE 21 HE1 PHE 21 9.167 3.933 2.742
150 HE2 PHE 21 HE2 PHE 21 12.553 2.342 4.784
151 HZ PHE 21 HZ PHE 21 11.391 2.882 2.680
152 HA PRO 22 HA PRO 22 6.509 6.517 10.984
153 HB2 PRO 22 2HB PRO 22 4.484 8.087 10.161
154 HB3 PRO 22 1HB PRO 22 6.111 8.734 10.406
155 HG2 PRO 22 2HG PRO 22 4.732 7.991 7.857
156 HG3 PRO 22 1HG PRO 22 5.791 9.371 8.198
157 HD2 PRO 22 2HD PRO 22 6.588 7.032 6.933
158 HD3 PRO 22 1HD PRO 22 7.682 8.164 7.751
159 H ARG 23 H ARG 23 5.740 4.417 11.276
160 HA ARG 23 HA ARG 23 3.987 3.251 9.295
161 HB2 ARG 23 2HB ARG 23 4.158 1.181 10.615
162 HB3 ARG 23 1HB ARG 23 5.730 1.856 10.218
163 HG2 ARG 23 2HG ARG 23 5.884 2.790 12.493
164 HG3 ARG 23 1HG ARG 23 4.335 2.040 12.885
165 HD2 ARG 23 2HD ARG 23 5.278 -0.171 12.473
166 HD3 ARG 23 1HD ARG 23 6.812 0.554 11.988
167 HE ARG 23 HE ARG 23 6.053 1.342 14.618
168 HH11 ARG 23 1HH1 ARG 23 7.428 -1.282 12.844
169 HH12 ARG 23 2HH1 ARG 23 8.327 -1.865 14.197
170 HH21 ARG 23 1HH2 ARG 23 7.196 0.577 16.340
171 HH22 ARG 23 2HH2 ARG 23 8.194 -0.824 16.163
172 H LYS 24 H LYS 24 3.543 4.769 12.402
173 HA LYS 24 HA LYS 24 1.083 3.615 13.141
174 HB2 LYS 24 2HB LYS 24 2.013 6.464 13.585
175 HB3 LYS 24 1HB LYS 24 0.675 5.691 14.422
176 HG2 LYS 24 2HG LYS 24 2.271 4.048 15.372
177 HG3 LYS 24 1HG LYS 24 3.590 4.934 14.603
178 HD2 LYS 24 2HD LYS 24 1.680 6.013 16.688
179 HD3 LYS 24 1HD LYS 24 3.373 5.587 16.944
180 HE2 LYS 24 2HE LYS 24 4.058 7.351 15.388
181 HE3 LYS 24 1HE LYS 24 2.369 7.757 15.090
182 HZ1 LYS 24 3HZ LYS 24 3.368 9.269 16.674
183 HZ2 LYS 24 1HZ LYS 24 3.776 7.986 17.697
184 HZ3 LYS 24 2HZ LYS 24 2.152 8.368 17.425
185 H PHE 25 H PHE 25 1.753 6.477 11.125
186 HA PHE 25 HA PHE 25 -0.992 7.011 10.537
187 HB2 PHE 25 2HB PHE 25 1.511 7.935 9.098
188 HB3 PHE 25 1HB PHE 25 -0.104 8.584 8.845
189 HD1 PHE 25 HD1 PHE 25 -1.202 9.917 10.604
190 HD2 PHE 25 HD2 PHE 25 2.822 8.569 11.007
191 HE1 PHE 25 HE1 PHE 25 -0.837 11.546 12.408
192 HE2 PHE 25 HE2 PHE 25 3.185 10.197 12.813
193 HZ PHE 25 HZ PHE 25 1.356 11.688 13.515
194 H VAL 26 H VAL 26 1.615 5.380 8.739
195 HA VAL 26 HA VAL 26 0.188 4.948 6.353
196 HB VAL 26 HB VAL 26 2.438 3.278 7.503
197 HG11 VAL 26 1HG1 VAL 26 1.348 3.450 4.689
198 HG12 VAL 26 2HG1 VAL 26 1.266 2.056 5.767
199 HG13 VAL 26 3HG1 VAL 26 2.825 2.604 5.153
200 HG21 VAL 26 3HG2 VAL 26 3.002 5.672 7.214
201 HG22 VAL 26 1HG2 VAL 26 2.544 5.558 5.517
202 HG23 VAL 26 2HG2 VAL 26 3.916 4.631 6.124
203 H LEU 27 H LEU 27 0.709 2.683 9.091
204 HA LEU 27 HA LEU 27 -0.900 0.614 8.031
205 HB2 LEU 27 2HB LEU 27 -0.187 1.198 10.910
206 HB3 LEU 27 1HB LEU 27 -0.905 -0.298 10.338
207 HG LEU 27 HG LEU 27 1.836 0.760 9.612
208 HD11 LEU 27 1HD1 LEU 27 1.722 -0.123 11.883
209 HD12 LEU 27 2HD1 LEU 27 2.668 -1.185 10.841
210 HD13 LEU 27 3HD1 LEU 27 1.016 -1.624 11.279
211 HD21 LEU 27 3HD2 LEU 27 0.461 -1.788 8.744
212 HD22 LEU 27 1HD2 LEU 27 2.143 -1.365 8.424
213 HD23 LEU 27 2HD2 LEU 27 0.844 -0.407 7.716
214 H ALA 28 H ALA 28 -1.676 3.370 10.114
215 HA ALA 28 HA ALA 28 -4.344 2.724 10.711
216 HB1 ALA 28 3HB ALA 28 -3.133 4.574 11.775
217 HB2 ALA 28 1HB ALA 28 -4.673 5.110 11.101
218 HB3 ALA 28 2HB ALA 28 -3.166 5.469 10.256
219 H ALA 29 H ALA 29 -3.011 4.549 7.945
220 HA ALA 29 HA ALA 29 -5.475 4.919 6.595
221 HB1 ALA 29 3HB ALA 29 -3.449 6.238 6.114
222 HB2 ALA 29 1HB ALA 29 -4.128 5.508 4.659
223 HB3 ALA 29 2HB ALA 29 -2.698 4.804 5.416
224 H LEU 30 H LEU 30 -3.069 2.349 6.515
225 HA LEU 30 HA LEU 30 -3.944 0.890 4.307
226 HB2 LEU 30 2HB LEU 30 -1.835 0.477 5.494
227 HB3 LEU 30 1HB LEU 30 -2.721 -0.117 6.883
228 HG LEU 30 HG LEU 30 -3.543 -2.023 5.542
229 HD11 LEU 30 1HD1 LEU 30 -2.589 -2.484 3.346
230 HD12 LEU 30 2HD1 LEU 30 -1.739 -0.937 3.381
231 HD13 LEU 30 3HD1 LEU 30 -3.502 -0.975 3.335
232 HD21 LEU 30 3HD2 LEU 30 -1.406 -3.220 5.387
233 HD22 LEU 30 1HD2 LEU 30 -1.521 -2.281 6.875
234 HD23 LEU 30 2HD2 LEU 30 -0.540 -1.689 5.533
235 H GLU 31 H GLU 31 -4.769 0.257 7.749
236 HA GLU 31 HA GLU 31 -6.685 -1.732 7.232
237 HB2 GLU 31 2HB GLU 31 -7.492 -1.294 9.546
238 HB3 GLU 31 1HB GLU 31 -5.749 -1.504 9.440
239 HG2 GLU 31 2HG GLU 31 -5.443 0.918 9.552
240 HG3 GLU 31 1HG GLU 31 -7.190 1.138 9.635
241 H GLN 32 H GLN 32 -7.088 1.788 7.589
242 HA GLN 32 HA GLN 32 -9.919 1.784 7.389
243 HB2 GLN 32 2HB GLN 32 -7.862 3.935 6.868
244 HB3 GLN 32 1HB GLN 32 -9.597 4.226 6.781
245 HG2 GLN 32 2HG GLN 32 -9.848 3.614 9.116
246 HG3 GLN 32 1HG GLN 32 -8.132 3.221 9.222
247 HE21 GLN 32 1HE2 GLN 32 -6.634 4.894 9.281
248 HE22 GLN 32 2HE2 GLN 32 -7.087 6.528 9.597
249 H SER 33 H SER 33 -7.490 1.280 5.040
250 HA SER 33 HA SER 33 -9.384 1.755 2.824
251 HB2 SER 33 2HB SER 33 -6.400 1.199 2.731
252 HB3 SER 33 1HB SER 33 -7.424 1.531 1.335
253 HG SER 33 HG SER 33 -6.648 3.264 3.419
254 H SER 34 H SER 34 -8.904 -0.634 4.866
255 HA SER 34 HA SER 34 -8.522 -2.828 2.961
256 HB2 SER 34 2HB SER 34 -8.689 -2.849 5.986
257 HB3 SER 34 1HB SER 34 -8.415 -4.273 4.985
258 HG SER 34 HG SER 34 -6.727 -2.041 4.705
259 H ASP 35 H ASP 35 -10.066 -4.221 2.355
260 HA ASP 35 HA ASP 35 -12.817 -3.762 2.981
261 HB2 ASP 35 2HB ASP 35 -11.445 -6.005 1.479
262 HB3 ASP 35 1HB ASP 35 -13.191 -5.770 1.552
263 H ASP 36 H ASP 36 -14.077 -6.102 3.352
264 HA ASP 36 HA ASP 36 -13.844 -6.471 6.123
265 HB2 ASP 36 2HB ASP 36 -15.920 -6.872 4.837
266 HB3 ASP 36 1HB ASP 36 -15.194 -8.313 4.133
267 H ALA 37 H ALA 37 -12.309 -8.205 3.498
268 HA ALA 37 HA ALA 37 -11.494 -10.475 5.069
269 HB1 ALA 37 3HB ALA 37 -10.194 -11.115 3.119
270 HB2 ALA 37 1HB ALA 37 -10.439 -9.520 2.406
271 HB3 ALA 37 2HB ALA 37 -11.811 -10.605 2.634
272 H GLY 38 H GLY 38 -10.511 -7.353 5.317
273 HA2 GLY 38 2HA GLY 38 -8.755 -6.481 6.569
274 HA3 GLY 38 1HA GLY 38 -8.036 -8.081 6.633
275 H TRP 39 H TRP 39 -8.722 -7.437 3.462
276 HA TRP 39 HA TRP 39 -5.940 -6.719 2.893
277 HB2 TRP 39 2HB TRP 39 -8.162 -7.835 1.169
278 HB3 TRP 39 1HB TRP 39 -6.612 -7.316 0.515
279 HD1 TRP 39 HD1 TRP 39 -8.266 -10.211 2.295
280 HE1 TRP 39 HE1 TRP 39 -6.559 -12.118 2.558
281 HE3 TRP 39 HE3 TRP 39 -4.034 -7.699 0.927
282 HZ2 TRP 39 HZ2 TRP 39 -3.774 -12.499 2.228
283 HZ3 TRP 39 HZ3 TRP 39 -1.892 -8.900 0.928
284 HH2 TRP 39 HH2 TRP 39 -1.768 -11.251 1.567
285 H ALA 40 H ALA 40 -5.345 -4.802 2.056
286 HA ALA 40 HA ALA 40 -7.457 -2.898 1.257
287 HB1 ALA 40 3HB ALA 40 -6.053 -2.178 3.133
288 HB2 ALA 40 1HB ALA 40 -5.845 -1.133 1.728
289 HB3 ALA 40 2HB ALA 40 -4.618 -2.339 2.119
290 H ASN 41 H ASN 41 -7.694 -2.592 -0.866
291 HA ASN 41 HA ASN 41 -5.891 -3.530 -2.829
292 HB2 ASN 41 2HB ASN 41 -8.323 -3.177 -3.209
293 HB3 ASN 41 1HB ASN 41 -8.069 -1.439 -3.129
294 HD21 ASN 41 1HD2 ASN 41 -9.070 -3.200 -5.287
295 HD22 ASN 41 2HD2 ASN 41 -8.080 -2.844 -6.658
296 H LEU 42 H LEU 42 -4.170 -2.625 -3.801
297 HA LEU 42 HA LEU 42 -2.662 -0.596 -2.784
298 HB2 LEU 42 2HB LEU 42 -1.893 -2.202 -4.475
299 HB3 LEU 42 1HB LEU 42 -2.871 -1.404 -5.691
300 HG LEU 42 HG LEU 42 -1.477 0.646 -5.418
301 HD11 LEU 42 1HD1 LEU 42 -0.715 0.315 -3.141
302 HD12 LEU 42 2HD1 LEU 42 0.667 0.465 -4.225
303 HD13 LEU 42 3HD1 LEU 42 0.188 -1.122 -3.624
304 HD21 LEU 42 3HD2 LEU 42 0.032 -1.876 -6.123
305 HD22 LEU 42 1HD2 LEU 42 0.492 -0.236 -6.587
306 HD23 LEU 42 2HD2 LEU 42 -1.003 -0.940 -7.203
307 H GLY 43 H GLY 43 -5.180 -0.256 -5.278
308 HA2 GLY 43 2HA GLY 43 -4.799 2.438 -5.938
309 HA3 GLY 43 1HA GLY 43 -6.329 1.584 -6.041
310 H ASN 44 H ASN 44 -6.776 1.037 -3.327
311 HA ASN 44 HA ASN 44 -7.759 3.565 -2.399
312 HB2 ASN 44 2HB ASN 44 -7.653 0.894 -0.968
313 HB3 ASN 44 1HB ASN 44 -8.578 2.299 -0.443
314 HD21 ASN 44 1HD2 ASN 44 -9.578 -0.302 -1.039
315 HD22 ASN 44 2HD2 ASN 44 -10.696 -0.127 -2.343
316 H PHE 45 H PHE 45 -5.227 1.338 -1.290
317 HA PHE 45 HA PHE 45 -4.406 2.664 1.008
318 HB2 PHE 45 2HB PHE 45 -3.617 0.435 0.466
319 HB3 PHE 45 1HB PHE 45 -2.769 1.038 -0.952
320 HD1 PHE 45 HD1 PHE 45 -2.895 1.660 2.738
321 HD2 PHE 45 HD2 PHE 45 -0.488 1.354 -0.767
322 HE1 PHE 45 HE1 PHE 45 -0.873 1.983 4.101
323 HE2 PHE 45 HE2 PHE 45 1.537 1.675 0.596
324 HZ PHE 45 HZ PHE 45 1.346 1.990 3.029
325 H GLY 46 H GLY 46 -3.007 3.002 -2.278
326 HA2 GLY 46 2HA GLY 46 -1.163 5.019 -1.642
327 HA3 GLY 46 1HA GLY 46 -1.814 4.717 -3.245
328 H ASN 47 H ASN 47 -4.592 5.237 -2.307
329 HA ASN 47 HA ASN 47 -4.641 8.071 -2.744
330 HB2 ASN 47 2HB ASN 47 -6.375 6.464 -3.586
331 HB3 ASN 47 1HB ASN 47 -6.914 6.239 -1.925
332 HD21 ASN 47 1HD2 ASN 47 -8.457 7.197 -4.121
333 HD22 ASN 47 2HD2 ASN 47 -8.962 8.802 -3.735
334 H TYR 48 H TYR 48 -5.719 6.018 -0.011
335 HA TYR 48 HA TYR 48 -6.398 8.272 1.599
336 HB2 TYR 48 2HB TYR 48 -7.329 5.817 1.654
337 HB3 TYR 48 1HB TYR 48 -6.002 5.539 2.778
338 HD1 TYR 48 HD2 TYR 48 -9.051 7.538 2.189
339 HD2 TYR 48 HD1 TYR 48 -6.138 6.324 5.047
340 HE1 TYR 48 HE2 TYR 48 -10.409 8.520 3.980
341 HE2 TYR 48 HE1 TYR 48 -7.492 7.311 6.846
342 HH TYR 48 HH TYR 48 -9.227 9.099 7.076
343 H LEU 49 H LEU 49 -3.551 6.210 1.364
344 HA LEU 49 HA LEU 49 -2.250 6.978 3.726
345 HB2 LEU 49 2HB LEU 49 -1.416 5.130 2.443
346 HB3 LEU 49 1HB LEU 49 -1.138 6.151 1.046
347 HG LEU 49 HG LEU 49 0.655 7.334 2.251
348 HD11 LEU 49 1HD1 LEU 49 1.458 6.540 4.396
349 HD12 LEU 49 2HD1 LEU 49 0.164 5.341 4.462
350 HD13 LEU 49 3HD1 LEU 49 -0.221 7.062 4.522
351 HD21 LEU 49 3HD2 LEU 49 1.007 4.334 2.285
352 HD22 LEU 49 1HD2 LEU 49 2.294 5.539 2.244
353 HD23 LEU 49 2HD2 LEU 49 1.197 5.377 0.874
354 H ASN 50 H ASN 50 -2.084 8.409 0.472
355 HA ASN 50 HA ASN 50 -0.202 10.405 1.077
356 HB2 ASN 50 2HB ASN 50 -0.863 9.688 -1.225
357 HB3 ASN 50 1HB ASN 50 -2.385 10.548 -1.017
358 HD21 ASN 50 1HD2 ASN 50 1.061 10.885 -1.408
359 HD22 ASN 50 2HD2 ASN 50 1.044 12.569 -1.788
360 H LYS 51 H LYS 51 -3.647 10.255 1.666
361 HA LYS 51 HA LYS 51 -4.192 12.975 2.123
362 HB2 LYS 51 2HB LYS 51 -5.359 10.559 3.527
363 HB3 LYS 51 1HB LYS 51 -6.014 12.185 3.615
364 HG2 LYS 51 2HG LYS 51 -6.317 12.081 1.115
365 HG3 LYS 51 1HG LYS 51 -5.901 10.368 1.219
366 HD2 LYS 51 2HD LYS 51 -8.310 10.601 1.248
367 HD3 LYS 51 1HD LYS 51 -7.764 10.057 2.837
368 HE2 LYS 51 2HE LYS 51 -7.858 12.417 3.619
369 HE3 LYS 51 1HE LYS 51 -8.522 12.876 2.053
370 HZ1 LYS 51 3HZ LYS 51 -9.773 11.095 4.070
371 HZ2 LYS 51 1HZ LYS 51 -10.383 11.337 2.508
372 HZ3 LYS 51 2HZ LYS 51 -10.293 12.628 3.592
373 H LEU 52 H LEU 52 -2.992 10.470 4.332
374 HA LEU 52 HA LEU 52 -2.839 12.282 6.571
375 HB2 LEU 52 2HB LEU 52 -1.752 9.478 6.260
376 HB3 LEU 52 1HB LEU 52 -1.847 10.373 7.766
377 HG LEU 52 HG LEU 52 -4.190 9.412 6.107
378 HD11 LEU 52 1HD1 LEU 52 -3.192 8.558 8.824
379 HD12 LEU 52 2HD1 LEU 52 -3.078 7.624 7.331
380 HD13 LEU 52 3HD1 LEU 52 -4.658 7.977 8.033
381 HD21 LEU 52 3HD2 LEU 52 -5.584 10.244 7.965
382 HD22 LEU 52 1HD2 LEU 52 -4.742 11.545 7.123
383 HD23 LEU 52 2HD2 LEU 52 -4.156 10.983 8.691
384 H GLN 53 H GLN 53 -0.496 10.749 4.369
385 HA GLN 53 HA GLN 53 1.531 12.684 5.316
386 HB2 GLN 53 2HB GLN 53 1.946 9.761 4.656
387 HB3 GLN 53 1HB GLN 53 3.261 10.908 4.862
388 HG2 GLN 53 2HG GLN 53 1.223 10.249 6.981
389 HG3 GLN 53 1HG GLN 53 2.816 9.504 6.854
390 HE21 GLN 53 1HE2 GLN 53 1.061 12.379 7.677
391 HE22 GLN 53 2HE2 GLN 53 2.378 13.210 8.416
392 HA PRO 54 HA PRO 54 1.262 13.174 0.696
393 HB2 PRO 54 2HB PRO 54 1.378 15.893 0.719
394 HB3 PRO 54 1HB PRO 54 -0.139 15.002 0.895
395 HG2 PRO 54 2HG PRO 54 1.581 16.246 3.014
396 HG3 PRO 54 1HG PRO 54 -0.184 16.287 2.841
397 HD2 PRO 54 2HD PRO 54 1.079 14.597 4.551
398 HD3 PRO 54 1HD PRO 54 -0.448 14.176 3.747
399 H ASP 55 H ASP 55 3.381 14.063 3.238
400 HA ASP 55 HA ASP 55 5.576 14.937 1.564
401 HB2 ASP 55 2HB ASP 55 5.198 15.791 3.880
402 HB3 ASP 55 1HB ASP 55 5.544 14.182 4.502
403 H PHE 56 H PHE 56 4.223 11.972 2.299
404 HA PHE 56 HA PHE 56 6.731 10.460 2.278
405 HB2 PHE 56 2HB PHE 56 4.947 9.827 3.874
406 HB3 PHE 56 1HB PHE 56 3.857 9.524 2.530
407 HD1 PHE 56 HD1 PHE 56 7.029 8.405 4.086
408 HD2 PHE 56 HD2 PHE 56 3.811 7.418 1.473
409 HE1 PHE 56 HE1 PHE 56 7.808 6.076 4.008
410 HE2 PHE 56 HE2 PHE 56 4.589 5.085 1.396
411 HZ PHE 56 HZ PHE 56 6.589 4.412 2.662
412 H ASP 57 H ASP 57 7.541 10.470 0.215
413 HA ASP 57 HA ASP 57 5.802 9.397 -1.916
414 HB2 ASP 57 2HB ASP 57 6.217 11.868 -2.123
415 HB3 ASP 57 1HB ASP 57 7.930 11.512 -2.322
416 H SER 58 H SER 58 6.701 7.917 -3.312
417 HA SER 58 HA SER 58 8.799 6.305 -2.353
418 HB2 SER 58 2HB SER 58 8.556 5.032 -4.422
419 HB3 SER 58 1HB SER 58 6.965 5.479 -3.803
420 HG SER 58 HG SER 58 8.290 6.314 -6.102
421 H ARG 59 H ARG 59 8.803 8.860 -4.809
422 HA ARG 59 HA ARG 59 11.291 8.222 -5.985
423 HB2 ARG 59 2HB ARG 59 9.839 10.872 -5.826
424 HB3 ARG 59 1HB ARG 59 11.255 10.583 -6.826
425 HG2 ARG 59 2HG ARG 59 8.614 9.135 -7.075
426 HG3 ARG 59 1HG ARG 59 9.169 10.450 -8.113
427 HD2 ARG 59 2HD ARG 59 11.059 9.071 -8.843
428 HD3 ARG 59 1HD ARG 59 10.527 7.766 -7.790
429 HE ARG 59 HE ARG 59 8.400 7.917 -9.247
430 HH11 ARG 59 1HH1 ARG 59 11.622 8.415 -10.374
431 HH12 ARG 59 2HH1 ARG 59 11.271 7.833 -11.962
432 HH21 ARG 59 1HH2 ARG 59 7.961 7.165 -11.283
433 HH22 ARG 59 2HH2 ARG 59 9.215 7.130 -12.476
434 H LEU 60 H LEU 60 10.517 9.940 -3.051
435 HA LEU 60 HA LEU 60 13.023 11.179 -2.598
436 HB2 LEU 60 2HB LEU 60 11.033 10.134 -0.570
437 HB3 LEU 60 1HB LEU 60 12.324 11.274 -0.241
438 HG LEU 60 HG LEU 60 9.957 11.788 -2.056
439 HD11 LEU 60 1HD1 LEU 60 10.568 12.828 0.712
440 HD12 LEU 60 2HD1 LEU 60 9.295 11.685 0.281
441 HD13 LEU 60 3HD1 LEU 60 9.224 13.344 -0.310
442 HD21 LEU 60 3HD2 LEU 60 10.758 14.097 -2.121
443 HD22 LEU 60 1HD2 LEU 60 11.969 12.992 -2.773
444 HD23 LEU 60 2HD2 LEU 60 12.159 13.649 -1.147
445 H TYR 61 H TYR 61 11.871 7.907 -2.124
446 HA TYR 61 HA TYR 61 14.297 7.088 -0.710
447 HB2 TYR 61 2HB TYR 61 11.852 5.503 -1.550
448 HB3 TYR 61 1HB TYR 61 13.194 4.860 -0.608
449 HD1 TYR 61 HD2 TYR 61 13.508 5.510 1.720
450 HD2 TYR 61 HD1 TYR 61 10.227 7.015 -0.540
451 HE1 TYR 61 HE2 TYR 61 12.429 6.258 3.794
452 HE2 TYR 61 HE1 TYR 61 9.143 7.772 1.534
453 HH TYR 61 HH TYR 61 9.194 7.234 3.946
454 H GLY 62 H GLY 62 13.433 7.519 -3.895
455 HA2 GLY 62 2HA GLY 62 14.813 7.064 -5.748
456 HA3 GLY 62 1HA GLY 62 15.627 5.820 -4.815
457 H TYR 63 H TYR 63 12.237 5.595 -4.640
458 HA TYR 63 HA TYR 63 12.267 3.302 -6.473
459 HB2 TYR 63 2HB TYR 63 10.399 4.098 -4.236
460 HB3 TYR 63 1HB TYR 63 10.025 2.791 -5.358
461 HD1 TYR 63 HD1 TYR 63 12.537 3.906 -2.837
462 HD2 TYR 63 HD2 TYR 63 10.925 0.657 -5.051
463 HE1 TYR 63 HE1 TYR 63 13.866 2.330 -1.491
464 HE2 TYR 63 HE2 TYR 63 12.226 -0.918 -3.723
465 HH TYR 63 HH TYR 63 14.363 -0.864 -2.367
466 H LYS 64 H LYS 64 10.813 3.042 -8.149
467 HA LYS 64 HA LYS 64 10.223 5.448 -9.538
468 HB2 LYS 64 2HB LYS 64 9.281 2.658 -10.225
469 HB3 LYS 64 1HB LYS 64 9.412 4.026 -11.322
470 HG2 LYS 64 2HG LYS 64 11.674 2.541 -9.989
471 HG3 LYS 64 1HG LYS 64 11.266 2.549 -11.705
472 HD2 LYS 64 2HD LYS 64 11.834 4.912 -11.854
473 HD3 LYS 64 1HD LYS 64 12.158 4.967 -10.121
474 HE2 LYS 64 2HE LYS 64 14.255 4.822 -11.284
475 HE3 LYS 64 1HE LYS 64 13.968 3.292 -10.460
476 HZ1 LYS 64 3HZ LYS 64 13.624 3.859 -13.349
477 HZ2 LYS 64 1HZ LYS 64 13.143 2.416 -12.607
478 HZ3 LYS 64 2HZ LYS 64 14.775 2.846 -12.637
479 H LYS 65 H LYS 65 8.189 3.206 -7.727
480 HA LYS 65 HA LYS 65 6.141 5.255 -7.567
481 HB2 LYS 65 2HB LYS 65 4.309 3.633 -8.180
482 HB3 LYS 65 1HB LYS 65 5.328 4.137 -9.522
483 HG2 LYS 65 2HG LYS 65 6.511 2.039 -9.488
484 HG3 LYS 65 1HG LYS 65 5.663 1.540 -8.022
485 HD2 LYS 65 2HD LYS 65 4.753 0.481 -10.073
486 HD3 LYS 65 1HD LYS 65 3.557 1.450 -9.215
487 HE2 LYS 65 2HE LYS 65 3.413 1.799 -11.627
488 HE3 LYS 65 1HE LYS 65 3.888 3.281 -10.799
489 HZ1 LYS 65 3HZ LYS 65 5.730 1.430 -12.217
490 HZ2 LYS 65 1HZ LYS 65 6.176 2.862 -11.439
491 HZ3 LYS 65 2HZ LYS 65 5.185 2.922 -12.799
492 H LEU 66 H LEU 66 4.228 4.333 -6.113
493 HA LEU 66 HA LEU 66 5.410 3.857 -3.604
494 HB2 LEU 66 2HB LEU 66 3.267 5.016 -3.862
495 HB3 LEU 66 1HB LEU 66 2.518 3.530 -4.420
496 HG LEU 66 HG LEU 66 2.894 2.500 -2.213
497 HD11 LEU 66 1HD1 LEU 66 4.908 3.712 -1.556
498 HD12 LEU 66 2HD1 LEU 66 3.655 3.849 -0.324
499 HD13 LEU 66 3HD1 LEU 66 3.975 5.203 -1.408
500 HD21 LEU 66 3HD2 LEU 66 1.265 3.824 -0.953
501 HD22 LEU 66 1HD2 LEU 66 0.784 3.646 -2.640
502 HD23 LEU 66 2HD2 LEU 66 1.479 5.166 -2.077
503 H SER 67 H SER 67 3.567 1.611 -5.700
504 HA SER 67 HA SER 67 3.569 -0.618 -4.015
505 HB2 SER 67 2HB SER 67 3.223 -1.981 -6.016
506 HB3 SER 67 1HB SER 67 2.290 -0.493 -6.143
507 HG SER 67 HG SER 67 3.964 -1.413 -7.899
508 H ASP 68 H ASP 68 6.043 0.498 -6.267
509 HA ASP 68 HA ASP 68 7.830 -1.646 -6.192
510 HB2 ASP 68 2HB ASP 68 7.906 0.417 -7.682
511 HB3 ASP 68 1HB ASP 68 8.589 1.285 -6.311
512 H LEU 69 H LEU 69 7.408 1.076 -3.987
513 HA LEU 69 HA LEU 69 9.602 0.418 -2.258
514 HB2 LEU 69 2HB LEU 69 8.786 2.699 -2.426
515 HB3 LEU 69 1HB LEU 69 7.193 2.203 -1.886
516 HG LEU 69 HG LEU 69 8.201 1.582 0.326
517 HD11 LEU 69 1HD1 LEU 69 10.411 2.442 0.892
518 HD12 LEU 69 2HD1 LEU 69 10.643 2.973 -0.774
519 HD13 LEU 69 3HD1 LEU 69 10.507 1.253 -0.407
520 HD21 LEU 69 3HD2 LEU 69 7.044 3.706 0.008
521 HD22 LEU 69 1HD2 LEU 69 8.546 4.456 -0.535
522 HD23 LEU 69 2HD2 LEU 69 8.394 3.883 1.126
523 H VAL 70 H VAL 70 6.061 0.039 -2.014
524 HA VAL 70 HA VAL 70 5.902 -1.015 0.552
525 HB VAL 70 HB VAL 70 4.110 -1.684 -1.800
526 HG11 VAL 70 1HG1 VAL 70 3.601 -1.924 1.172
527 HG12 VAL 70 2HG1 VAL 70 3.790 -3.257 0.033
528 HG13 VAL 70 3HG1 VAL 70 2.401 -2.180 -0.096
529 HG21 VAL 70 3HG2 VAL 70 2.679 0.128 -0.974
530 HG22 VAL 70 1HG2 VAL 70 4.281 0.729 -1.401
531 HG23 VAL 70 2HG2 VAL 70 3.853 0.488 0.293
532 H LYS 71 H LYS 71 6.143 -2.857 -2.516
533 HA LYS 71 HA LYS 71 6.211 -5.408 -1.282
534 HB2 LYS 71 2HB LYS 71 6.949 -6.256 -3.441
535 HB3 LYS 71 1HB LYS 71 5.661 -5.082 -3.661
536 HG2 LYS 71 2HG LYS 71 7.292 -3.382 -4.292
537 HG3 LYS 71 1HG LYS 71 8.603 -4.530 -4.036
538 HD2 LYS 71 2HD LYS 71 6.372 -5.016 -6.006
539 HD3 LYS 71 1HD LYS 71 7.853 -4.167 -6.442
540 HE2 LYS 71 2HE LYS 71 8.130 -6.439 -7.096
541 HE3 LYS 71 1HE LYS 71 9.131 -6.193 -5.669
542 HZ1 LYS 71 3HZ LYS 71 6.422 -7.404 -5.619
543 HZ2 LYS 71 1HZ LYS 71 7.514 -7.309 -4.330
544 HZ3 LYS 71 2HZ LYS 71 7.860 -8.291 -5.662
545 H ALA 72 H ALA 72 8.635 -2.985 -1.682
546 HA ALA 72 HA ALA 72 10.864 -4.818 -1.284
547 HB1 ALA 72 3HB ALA 72 11.099 -2.919 -2.815
548 HB2 ALA 72 1HB ALA 72 12.263 -2.836 -1.494
549 HB3 ALA 72 2HB ALA 72 10.833 -1.804 -1.475
550 H ARG 73 H ARG 73 8.620 -3.509 0.740
551 HA ARG 73 HA ARG 73 10.496 -3.498 3.023
552 HB2 ARG 73 2HB ARG 73 8.056 -1.733 2.687
553 HB3 ARG 73 1HB ARG 73 9.076 -1.798 4.118
554 HG2 ARG 73 2HG ARG 73 9.915 -0.879 1.373
555 HG3 ARG 73 1HG ARG 73 9.593 0.152 2.768
556 HD2 ARG 73 2HD ARG 73 11.464 -0.867 3.969
557 HD3 ARG 73 1HD ARG 73 11.769 -1.947 2.610
558 HE ARG 73 HE ARG 73 12.335 0.919 2.729
559 HH11 ARG 73 1HH1 ARG 73 12.460 -2.043 0.966
560 HH12 ARG 73 2HH1 ARG 73 13.534 -1.400 -0.228
561 HH21 ARG 73 1HH2 ARG 73 13.725 1.704 1.195
562 HH22 ARG 73 2HH2 ARG 73 14.247 0.675 -0.096
563 H THR 74 H THR 74 9.485 -5.859 2.426
564 HA THR 74 HA THR 74 6.930 -6.541 3.376
565 HB THR 74 HB THR 74 7.763 -8.864 3.534
566 HG1 THR 74 HG1 THR 74 9.869 -9.315 3.494
567 HG21 THR 74 3HG2 THR 74 8.745 -7.410 1.067
568 HG22 THR 74 1HG2 THR 74 7.097 -7.976 1.340
569 HG23 THR 74 2HG2 THR 74 8.415 -9.139 1.185
570 H ASP 75 H ASP 75 9.815 -5.789 5.104
571 HA ASP 75 HA ASP 75 9.364 -7.022 7.574
572 HB2 ASP 75 2HB ASP 75 11.460 -5.882 6.975
573 HB3 ASP 75 1HB ASP 75 10.631 -4.331 6.977
574 H LEU 76 H LEU 76 7.832 -4.256 6.113
575 HA LEU 76 HA LEU 76 6.292 -3.739 8.581
576 HB2 LEU 76 2HB LEU 76 6.842 -1.934 6.218
577 HB3 LEU 76 1HB LEU 76 5.789 -1.518 7.556
578 HG LEU 76 HG LEU 76 8.758 -2.063 7.796
579 HD11 LEU 76 1HD1 LEU 76 8.952 0.355 8.192
580 HD12 LEU 76 2HD1 LEU 76 7.235 0.547 7.834
581 HD13 LEU 76 3HD1 LEU 76 8.343 0.001 6.576
582 HD21 LEU 76 3HD2 LEU 76 7.558 -2.634 9.831
583 HD22 LEU 76 1HD2 LEU 76 6.745 -1.067 9.818
584 HD23 LEU 76 2HD2 LEU 76 8.488 -1.155 10.069
585 H PHE 77 H PHE 77 6.018 -4.290 5.089
586 HA PHE 77 HA PHE 77 3.074 -4.365 5.370
587 HB2 PHE 77 2HB PHE 77 4.596 -3.628 2.858
588 HB3 PHE 77 1HB PHE 77 2.862 -3.498 3.130
589 HD1 PHE 77 HD1 PHE 77 2.429 -2.108 5.505
590 HD2 PHE 77 HD2 PHE 77 5.644 -1.578 2.754
591 HE1 PHE 77 HE1 PHE 77 2.736 0.196 6.307
592 HE2 PHE 77 HE2 PHE 77 5.953 0.727 3.556
593 HZ PHE 77 HZ PHE 77 4.501 1.616 5.333
594 H VAL 78 H VAL 78 2.100 -6.240 4.886
595 HA VAL 78 HA VAL 78 3.539 -8.359 3.482
596 HB VAL 78 HB VAL 78 0.735 -8.363 4.639
597 HG11 VAL 78 1HG1 VAL 78 2.441 -10.639 3.616
598 HG12 VAL 78 2HG1 VAL 78 0.959 -10.023 2.883
599 HG13 VAL 78 3HG1 VAL 78 0.899 -10.821 4.455
600 HG21 VAL 78 3HG2 VAL 78 2.454 -8.053 6.365
601 HG22 VAL 78 1HG2 VAL 78 3.286 -9.500 5.797
602 HG23 VAL 78 2HG2 VAL 78 1.675 -9.629 6.503
603 H THR 79 H THR 79 3.390 -8.615 1.324
604 HA THR 79 HA THR 79 1.145 -7.309 -0.103
605 HB THR 79 HB THR 79 2.626 -6.953 -1.995
606 HG1 THR 79 HG1 THR 79 4.596 -7.836 -2.134
607 HG21 THR 79 3HG2 THR 79 3.964 -6.104 0.579
608 HG22 THR 79 1HG2 THR 79 2.675 -5.237 -0.254
609 HG23 THR 79 2HG2 THR 79 4.259 -5.399 -1.010
610 H GLU 80 H GLU 80 -0.153 -8.571 -1.305
611 HA GLU 80 HA GLU 80 0.919 -10.978 -2.574
612 HB2 GLU 80 2HB GLU 80 -1.483 -11.008 -0.729
613 HB3 GLU 80 1HB GLU 80 -1.138 -12.288 -1.882
614 HG2 GLU 80 2HG GLU 80 1.049 -12.646 -0.755
615 HG3 GLU 80 1HG GLU 80 0.581 -11.450 0.452
616 H GLU 81 H GLU 81 0.191 -11.256 -4.588
617 HA GLU 81 HA GLU 81 -1.690 -9.303 -5.659
618 HB2 GLU 81 2HB GLU 81 -0.032 -11.398 -7.083
619 HB3 GLU 81 1HB GLU 81 -0.926 -10.087 -7.845
620 HG2 GLU 81 2HG GLU 81 0.520 -8.444 -6.864
621 HG3 GLU 81 1HG GLU 81 1.333 -9.672 -5.894
622 H ARG 82 H ARG 82 -3.775 -9.740 -6.001
623 HA ARG 82 HA ARG 82 -4.638 -12.567 -6.105
624 HB2 ARG 82 2HB ARG 82 -6.214 -10.206 -5.048
625 HB3 ARG 82 1HB ARG 82 -6.702 -11.896 -5.006
626 HG2 ARG 82 2HG ARG 82 -4.337 -10.727 -3.535
627 HG3 ARG 82 1HG ARG 82 -5.909 -11.082 -2.822
628 HD2 ARG 82 2HD ARG 82 -4.088 -13.121 -4.110
629 HD3 ARG 82 1HD ARG 82 -4.221 -12.839 -2.375
630 HE ARG 82 HE ARG 82 -6.779 -13.366 -3.356
631 HH11 ARG 82 1HH1 ARG 82 -3.769 -15.011 -2.949
632 HH12 ARG 82 2HH1 ARG 82 -4.524 -16.559 -2.763
633 HH21 ARG 82 1HH2 ARG 82 -7.723 -15.365 -3.099
634 HH22 ARG 82 2HH2 ARG 82 -6.720 -16.754 -2.841
635 H GLN 83 H GLN 83 -6.061 -13.190 -7.686
636 HA GLN 83 HA GLN 83 -6.444 -11.427 -9.940
637 HB2 GLN 83 2HB GLN 83 -5.979 -13.873 -10.175
638 HB3 GLN 83 1HB GLN 83 -7.555 -14.209 -9.478
639 HG2 GLN 83 2HG GLN 83 -8.590 -12.957 -11.377
640 HG3 GLN 83 1HG GLN 83 -6.985 -12.829 -12.097
641 HE21 GLN 83 1HE2 GLN 83 -9.325 -14.136 -13.182
642 HE22 GLN 83 2HE2 GLN 83 -8.898 -15.795 -13.407
643 H VAL 84 H VAL 84 -8.228 -10.236 -10.395
644 HA VAL 84 HA VAL 84 -10.384 -10.220 -8.434
645 HB VAL 84 HB VAL 84 -9.933 -8.368 -10.788
646 HG11 VAL 84 1HG1 VAL 84 -12.259 -8.387 -10.041
647 HG12 VAL 84 2HG1 VAL 84 -11.482 -6.861 -9.616
648 HG13 VAL 84 3HG1 VAL 84 -11.743 -8.093 -8.379
649 HG21 VAL 84 3HG2 VAL 84 -8.076 -8.260 -9.198
650 HG22 VAL 84 1HG2 VAL 84 -9.213 -7.997 -7.873
651 HG23 VAL 84 2HG2 VAL 84 -9.040 -6.785 -9.142
652 HA PRO 85 HA PRO 85 -12.897 -12.900 -11.049
653 HB2 PRO 85 2HB PRO 85 -15.253 -12.472 -9.645
654 HB3 PRO 85 1HB PRO 85 -14.024 -13.662 -9.213
655 HG2 PRO 85 2HG PRO 85 -14.462 -10.910 -8.116
656 HG3 PRO 85 1HG PRO 85 -14.043 -12.406 -7.258
657 HD2 PRO 85 2HD PRO 85 -12.189 -10.542 -7.791
658 HD3 PRO 85 1HD PRO 85 -11.800 -12.274 -7.868
659 H GLY 86 H GLY 86 -13.673 -12.321 -12.985
660 HA2 GLY 86 2HA GLY 86 -15.208 -11.254 -14.437
661 HA3 GLY 86 1HA GLY 86 -15.468 -10.008 -13.228
662 H SER 87 H SER 87 -12.347 -10.021 -13.028
663 HA SER 87 HA SER 87 -11.969 -8.054 -15.196
664 HB2 SER 87 2HB SER 87 -10.445 -8.400 -12.591
665 HB3 SER 87 1HB SER 87 -10.122 -7.157 -13.800
666 HG SER 87 HG SER 87 -12.719 -7.097 -13.190
667 H THR 88 H THR 88 -9.969 -7.989 -16.356
668 HA THR 88 HA THR 88 -8.787 -10.630 -16.782
669 HB THR 88 HB THR 88 -9.401 -9.379 -18.784
670 HG1 THR 88 HG1 THR 88 -6.609 -9.755 -18.341
671 HG21 THR 88 3HG2 THR 88 -8.253 -7.310 -19.414
672 HG22 THR 88 1HG2 THR 88 -7.385 -7.310 -17.876
673 HG23 THR 88 2HG2 THR 88 -9.137 -7.100 -17.903
674 H GLN 89 H GLN 89 -8.051 -7.764 -15.083
675 HA GLN 89 HA GLN 89 -5.170 -8.343 -14.999
676 HB2 GLN 89 2HB GLN 89 -4.918 -6.153 -13.962
677 HB3 GLN 89 1HB GLN 89 -5.848 -6.014 -15.448
678 HG2 GLN 89 2HG GLN 89 -7.896 -5.769 -14.229
679 HG3 GLN 89 1HG GLN 89 -7.095 -6.144 -12.704
680 HE21 GLN 89 1HE2 GLN 89 -7.577 -3.730 -15.165
681 HE22 GLN 89 2HE2 GLN 89 -6.921 -2.410 -14.267
682 H LYS 90 H LYS 90 -4.045 -8.428 -12.959
683 HA LYS 90 HA LYS 90 -5.720 -9.301 -10.693
684 HB2 LYS 90 2HB LYS 90 -3.664 -10.305 -9.772
685 HB3 LYS 90 1HB LYS 90 -4.044 -10.939 -11.368
686 HG2 LYS 90 2HG LYS 90 -2.349 -9.503 -12.369
687 HG3 LYS 90 1HG LYS 90 -1.991 -8.805 -10.789
688 HD2 LYS 90 2HD LYS 90 -0.339 -10.509 -11.434
689 HD3 LYS 90 1HD LYS 90 -1.222 -10.970 -9.978
690 HE2 LYS 90 2HE LYS 90 -2.614 -12.483 -11.246
691 HE3 LYS 90 1HE LYS 90 -1.892 -11.938 -12.760
692 HZ1 LYS 90 3HZ LYS 90 -0.317 -13.219 -10.604
693 HZ2 LYS 90 1HZ LYS 90 0.150 -12.936 -12.203
694 HZ3 LYS 90 2HZ LYS 90 -1.033 -14.093 -11.863
695 H ALA 91 H ALA 91 -5.474 -8.350 -8.649
696 HA ALA 91 HA ALA 91 -4.197 -5.684 -8.717
697 HB1 ALA 91 3HB ALA 91 -6.635 -5.633 -8.513
698 HB2 ALA 91 1HB ALA 91 -5.857 -4.983 -7.071
699 HB3 ALA 91 2HB ALA 91 -6.541 -6.610 -7.049
700 H LEU 92 H LEU 92 -2.818 -5.049 -7.119
701 HA LEU 92 HA LEU 92 -1.782 -7.091 -5.340
702 HB2 LEU 92 2HB LEU 92 -0.222 -5.630 -6.526
703 HB3 LEU 92 1HB LEU 92 -0.946 -4.217 -5.780
704 HG LEU 92 HG LEU 92 -0.197 -5.135 -3.541
705 HD11 LEU 92 1HD1 LEU 92 1.394 -7.014 -5.281
706 HD12 LEU 92 2HD1 LEU 92 0.085 -7.459 -4.184
707 HD13 LEU 92 3HD1 LEU 92 1.588 -6.798 -3.541
708 HD21 LEU 92 3HD2 LEU 92 1.011 -3.331 -4.630
709 HD22 LEU 92 1HD2 LEU 92 1.937 -4.492 -5.584
710 HD23 LEU 92 2HD2 LEU 92 2.140 -4.424 -3.832
711 H TYR 93 H TYR 93 -2.879 -7.473 -3.512
712 HA TYR 93 HA TYR 93 -4.090 -5.232 -2.052
713 HB2 TYR 93 2HB TYR 93 -4.422 -8.228 -1.768
714 HB3 TYR 93 1HB TYR 93 -5.151 -7.061 -0.669
715 HD1 TYR 93 HD1 TYR 93 -5.107 -8.221 -4.192
716 HD2 TYR 93 HD2 TYR 93 -7.154 -5.924 -1.251
717 HE1 TYR 93 HE1 TYR 93 -7.020 -7.989 -5.714
718 HE2 TYR 93 HE2 TYR 93 -9.076 -5.687 -2.766
719 HH TYR 93 HH TYR 93 -9.439 -7.545 -5.577
720 H LEU 94 H LEU 94 -3.626 -4.817 0.121
721 HA LEU 94 HA LEU 94 -1.018 -5.872 1.041
722 HB2 LEU 94 2HB LEU 94 -2.028 -3.052 1.428
723 HB3 LEU 94 1HB LEU 94 -0.427 -3.666 1.792
724 HG LEU 94 HG LEU 94 -1.593 -3.353 -0.986
725 HD11 LEU 94 1HD1 LEU 94 0.032 -1.550 -1.239
726 HD12 LEU 94 2HD1 LEU 94 0.530 -1.752 0.441
727 HD13 LEU 94 3HD1 LEU 94 -1.105 -1.208 0.065
728 HD21 LEU 94 3HD2 LEU 94 1.177 -4.178 -0.110
729 HD22 LEU 94 1HD2 LEU 94 0.659 -3.892 -1.772
730 HD23 LEU 94 2HD2 LEU 94 -0.032 -5.226 -0.850
731 H ARG 95 H ARG 95 -0.742 -6.215 3.242
732 HA ARG 95 HA ARG 95 -2.748 -5.225 5.116
733 HB2 ARG 95 2HB ARG 95 -2.904 -7.450 6.259
734 HB3 ARG 95 1HB ARG 95 -3.668 -7.387 4.678
735 HG2 ARG 95 2HG ARG 95 -1.774 -8.559 3.691
736 HG3 ARG 95 1HG ARG 95 -0.954 -8.576 5.255
737 HD2 ARG 95 2HD ARG 95 -2.660 -9.985 6.202
738 HD3 ARG 95 1HD ARG 95 -3.649 -9.841 4.749
739 HE ARG 95 HE ARG 95 -1.235 -10.942 3.954
740 HH11 ARG 95 1HH1 ARG 95 -3.886 -11.777 5.985
741 HH12 ARG 95 2HH1 ARG 95 -3.653 -13.477 5.780
742 HH21 ARG 95 1HH2 ARG 95 -1.005 -13.133 3.608
743 HH22 ARG 95 2HH2 ARG 95 -2.059 -14.235 4.430
744 H ALA 96 H ALA 96 -2.025 -5.322 7.373
745 HA ALA 96 HA ALA 96 0.650 -4.350 7.504
746 HB1 ALA 96 3HB ALA 96 -1.153 -3.370 8.824
747 HB2 ALA 96 1HB ALA 96 0.174 -3.908 9.853
748 HB3 ALA 96 2HB ALA 96 -1.302 -4.868 9.744
749 H LYS 97 H LYS 97 2.495 -5.235 8.263
750 HA LYS 97 HA LYS 97 2.572 -8.040 8.997
751 HB2 LYS 97 2HB LYS 97 4.354 -7.276 7.601
752 HB3 LYS 97 1HB LYS 97 4.697 -5.917 8.658
753 HG2 LYS 97 2HG LYS 97 6.422 -7.579 8.897
754 HG3 LYS 97 1HG LYS 97 5.492 -7.485 10.390
755 HD2 LYS 97 2HD LYS 97 5.896 -9.795 9.924
756 HD3 LYS 97 1HD LYS 97 4.190 -9.477 9.614
757 HE2 LYS 97 2HE LYS 97 4.618 -9.374 7.223
758 HE3 LYS 97 1HE LYS 97 6.347 -9.583 7.501
759 HZ1 LYS 97 3HZ LYS 97 5.312 -11.657 6.855
760 HZ2 LYS 97 1HZ LYS 97 4.237 -11.565 8.160
761 HZ3 LYS 97 2HZ LYS 97 5.892 -11.762 8.440
762 H LEU 98 H LEU 98 1.613 -8.299 10.995
763 HA LEU 98 HA LEU 98 2.858 -6.868 13.258
764 HB2 LEU 98 2HB LEU 98 0.176 -8.261 13.122
765 HB3 LEU 98 1HB LEU 98 0.840 -7.490 14.551
766 HG LEU 98 HG LEU 98 0.063 -6.094 11.981
767 HD11 LEU 98 1HD1 LEU 98 -1.711 -5.086 13.312
768 HD12 LEU 98 2HD1 LEU 98 -1.201 -6.013 14.723
769 HD13 LEU 98 3HD1 LEU 98 -1.854 -6.844 13.310
770 HD21 LEU 98 3HD2 LEU 98 1.129 -4.942 14.565
771 HD22 LEU 98 1HD2 LEU 98 0.542 -4.014 13.183
772 HD23 LEU 98 2HD2 LEU 98 1.989 -5.009 13.026
773 H GLU 99 H GLU 99 4.564 -8.123 13.834
774 HA GLU 99 HA GLU 99 4.392 -11.004 13.847
775 HB2 GLU 99 2HB GLU 99 6.589 -9.114 14.711
776 HB3 GLU 99 1HB GLU 99 6.742 -10.867 14.713
777 HG2 GLU 99 2HG GLU 99 6.119 -9.229 12.259
778 HG3 GLU 99 1HG GLU 99 7.742 -9.730 12.730
779 H HIS 100 H HIS 100 3.611 -12.176 15.455
780 HA HIS 100 HA HIS 100 2.960 -10.992 17.999
781 HB2 HIS 100 2HB HIS 100 2.668 -13.816 16.948
782 HB3 HIS 100 1HB HIS 100 2.077 -13.285 18.519
783 HD1 HIS 100 HD1 HIS 100 1.646 -12.113 14.899
784 HD2 HIS 100 HD2 HIS 100 -0.529 -12.615 18.407
785 HE1 HIS 100 HE1 HIS 100 -0.704 -11.446 14.336
786 HE2 HIS 100 HE2 HIS 100 -2.026 -11.930 16.416
787 H HIS 101 H HIS 101 4.774 -10.519 19.176
788 HA HIS 101 HA HIS 101 7.024 -12.303 19.334
789 HB2 HIS 101 2HB HIS 101 6.386 -9.772 20.872
790 HB3 HIS 101 1HB HIS 101 7.916 -10.639 20.959
791 HD1 HIS 101 HD1 HIS 101 5.799 -8.720 18.456
792 HD2 HIS 101 HD2 HIS 101 9.718 -10.002 18.994
793 HE1 HIS 101 HE1 HIS 101 7.121 -7.642 16.618
794 HE2 HIS 101 HE2 HIS 101 9.503 -8.268 17.091
795 H HIS 102 H HIS 102 6.403 -14.221 20.232
796 HA HIS 102 HA HIS 102 5.940 -14.192 23.128
797 HB2 HIS 102 2HB HIS 102 4.264 -15.738 21.139
798 HB3 HIS 102 1HB HIS 102 4.274 -16.061 22.869
799 HD1 HIS 102 HD1 HIS 102 3.111 -14.347 24.405
800 HD2 HIS 102 HD2 HIS 102 2.855 -13.432 20.361
801 HE1 HIS 102 HE1 HIS 102 1.403 -12.521 24.240
802 HE2 HIS 102 HE2 HIS 102 1.329 -11.914 21.799
803 H HIS 103 H HIS 103 7.216 -15.798 20.298
804 HA HIS 103 HA HIS 103 7.942 -18.237 21.636
805 HB2 HIS 103 2HB HIS 103 8.985 -17.116 19.022
806 HB3 HIS 103 1HB HIS 103 9.173 -18.770 19.587
807 HD1 HIS 103 HD1 HIS 103 6.988 -16.646 17.616
808 HD2 HIS 103 HD2 HIS 103 6.594 -20.191 19.744
809 HE1 HIS 103 HE1 HIS 103 4.875 -17.703 16.775
810 HE2 HIS 103 HE2 HIS 103 4.573 -19.752 18.190
811 H HIS 104 H HIS 104 8.994 -17.022 23.496
812 HA HIS 104 HA HIS 104 11.887 -17.014 23.059
813 HB2 HIS 104 2HB HIS 104 10.430 -14.675 24.330
814 HB3 HIS 104 1HB HIS 104 12.177 -14.900 24.354
815 HD1 HIS 104 HD1 HIS 104 9.573 -13.279 22.480
816 HD2 HIS 104 HD2 HIS 104 13.283 -14.915 21.573
817 HE1 HIS 104 HE1 HIS 104 10.212 -12.303 20.260
818 HE2 HIS 104 HE2 HIS 104 12.477 -13.265 19.748
819 H HIS 105 H HIS 105 12.968 -17.954 24.695
820 HA HIS 105 HA HIS 105 11.531 -18.733 27.118
821 HB2 HIS 105 2HB HIS 105 12.778 -20.482 26.015
822 HB3 HIS 105 1HB HIS 105 14.242 -19.507 26.010
823 HD1 HIS 105 HD1 HIS 105 15.520 -19.287 28.260
824 HD2 HIS 105 HD2 HIS 105 12.250 -21.839 28.389
825 HE1 HIS 105 HE1 HIS 105 15.778 -20.600 30.379
826 HE2 HIS 105 HE2 HIS 105 13.683 -21.975 30.537
Start of MODEL 14
1 H1 MET 1 1H MET 1 42.643 -8.473 2.353
2 H2 MET 1 2H MET 1 43.208 -9.530 1.156
3 H3 MET 1 3H MET 1 42.317 -10.131 2.458
4 HA MET 1 HA MET 1 40.362 -8.948 1.746
5 HB2 MET 1 2HB MET 1 41.541 -7.040 0.729
6 HB3 MET 1 1HB MET 1 42.097 -8.071 -0.581
7 HG2 MET 1 2HG MET 1 40.202 -6.679 -1.246
8 HG3 MET 1 1HG MET 1 39.813 -8.396 -1.333
9 HE1 MET 1 3HE MET 1 37.625 -6.049 -1.376
10 HE2 MET 1 1HE MET 1 36.400 -6.742 -0.315
11 HE3 MET 1 2HE MET 1 37.228 -7.766 -1.488
12 H ASP 2 H ASP 2 39.639 -11.079 1.677
13 HA ASP 2 HA ASP 2 40.329 -12.845 -0.493
14 HB2 ASP 2 2HB ASP 2 38.087 -13.075 1.534
15 HB3 ASP 2 1HB ASP 2 38.711 -14.372 0.515
16 H GLN 3 H GLN 3 39.637 -12.322 -2.500
17 HA GLN 3 HA GLN 3 37.307 -10.690 -2.894
18 HB2 GLN 3 2HB GLN 3 39.419 -10.523 -4.240
19 HB3 GLN 3 1HB GLN 3 39.001 -12.052 -4.994
20 HG2 GLN 3 2HG GLN 3 38.407 -10.183 -6.422
21 HG3 GLN 3 1HG GLN 3 36.970 -11.065 -5.909
22 HE21 GLN 3 1HE2 GLN 3 35.685 -9.252 -6.361
23 HE22 GLN 3 2HE2 GLN 3 35.654 -7.877 -5.317
24 H LYS 4 H LYS 4 35.732 -12.148 -1.963
25 HA LYS 4 HA LYS 4 34.758 -14.147 -3.921
26 HB2 LYS 4 2HB LYS 4 34.298 -14.019 -0.926
27 HB3 LYS 4 1HB LYS 4 33.499 -15.153 -2.006
28 HG2 LYS 4 2HG LYS 4 35.654 -16.151 -2.575
29 HG3 LYS 4 1HG LYS 4 36.476 -14.995 -1.524
30 HD2 LYS 4 2HD LYS 4 36.190 -17.173 -0.428
31 HD3 LYS 4 1HD LYS 4 35.306 -15.903 0.420
32 HE2 LYS 4 2HE LYS 4 33.954 -17.924 0.267
33 HE3 LYS 4 1HE LYS 4 33.226 -16.631 -0.686
34 HZ1 LYS 4 3HZ LYS 4 34.164 -17.617 -2.678
35 HZ2 LYS 4 1HZ LYS 4 33.199 -18.741 -1.868
36 HZ3 LYS 4 2HZ LYS 4 34.880 -18.852 -1.771
37 H SER 5 H SER 5 33.690 -12.481 -5.128
38 HA SER 5 HA SER 5 31.945 -11.150 -5.758
39 HB2 SER 5 2HB SER 5 30.449 -12.705 -3.623
40 HB3 SER 5 1HB SER 5 29.712 -11.787 -4.937
41 HG SER 5 HG SER 5 31.353 -13.364 -6.156
42 H SER 6 H SER 6 33.695 -10.140 -3.665
43 HA SER 6 HA SER 6 31.932 -8.596 -1.906
44 HB2 SER 6 2HB SER 6 33.850 -9.676 -0.845
45 HB3 SER 6 1HB SER 6 34.955 -8.847 -1.943
46 HG SER 6 HG SER 6 34.191 -7.995 0.374
47 H SER 7 H SER 7 32.727 -6.268 -1.483
48 HA SER 7 HA SER 7 32.632 -4.130 -2.250
49 HB2 SER 7 2HB SER 7 35.027 -4.468 -2.539
50 HB3 SER 7 1HB SER 7 34.763 -5.157 -4.140
51 HG SER 7 HG SER 7 34.529 -3.217 -4.948
52 HA PRO 8 HA PRO 8 29.955 -4.662 -5.948
53 HB2 PRO 8 2HB PRO 8 27.621 -3.967 -4.863
54 HB3 PRO 8 1HB PRO 8 28.308 -5.569 -4.560
55 HG2 PRO 8 2HG PRO 8 28.279 -3.152 -2.792
56 HG3 PRO 8 1HG PRO 8 28.049 -4.857 -2.363
57 HD2 PRO 8 2HD PRO 8 30.439 -3.422 -2.114
58 HD3 PRO 8 1HD PRO 8 30.290 -5.189 -2.103
59 H GLN 9 H GLN 9 31.689 -2.412 -5.162
60 HA GLN 9 HA GLN 9 30.328 0.023 -4.885
61 HB2 GLN 9 2HB GLN 9 32.693 -0.216 -4.350
62 HB3 GLN 9 1HB GLN 9 33.067 -0.529 -6.040
63 HG2 GLN 9 2HG GLN 9 32.363 1.741 -6.624
64 HG3 GLN 9 1HG GLN 9 31.962 2.055 -4.937
65 HE21 GLN 9 1HE2 GLN 9 33.428 3.756 -4.811
66 HE22 GLN 9 2HE2 GLN 9 35.135 3.500 -4.765
67 HA PRO 10 HA PRO 10 29.152 0.604 -9.219
68 HB2 PRO 10 2HB PRO 10 27.105 2.251 -8.788
69 HB3 PRO 10 1HB PRO 10 27.003 0.554 -8.303
70 HG2 PRO 10 2HG PRO 10 27.447 2.978 -6.624
71 HG3 PRO 10 1HG PRO 10 26.554 1.496 -6.244
72 HD2 PRO 10 2HD PRO 10 29.223 2.109 -5.498
73 HD3 PRO 10 1HD PRO 10 28.407 0.543 -5.331
74 H ALA 11 H ALA 11 29.019 2.475 -10.688
75 HA ALA 11 HA ALA 11 30.882 4.590 -10.011
76 HB1 ALA 11 3HB ALA 11 30.963 3.579 -12.227
77 HB2 ALA 11 1HB ALA 11 30.589 5.300 -12.347
78 HB3 ALA 11 2HB ALA 11 29.309 4.100 -12.544
79 H ALA 12 H ALA 12 27.437 4.168 -10.189
80 HA ALA 12 HA ALA 12 26.640 6.876 -10.423
81 HB1 ALA 12 3HB ALA 12 25.126 4.996 -10.844
82 HB2 ALA 12 1HB ALA 12 24.456 6.108 -9.652
83 HB3 ALA 12 2HB ALA 12 25.164 4.578 -9.131
84 H GLN 13 H GLN 13 26.691 8.506 -8.981
85 HA GLN 13 HA GLN 13 27.677 7.998 -6.301
86 HB2 GLN 13 2HB GLN 13 26.989 10.603 -7.686
87 HB3 GLN 13 1HB GLN 13 27.777 10.465 -6.121
88 HG2 GLN 13 2HG GLN 13 28.885 9.583 -8.786
89 HG3 GLN 13 1HG GLN 13 29.414 10.959 -7.821
90 HE21 GLN 13 1HE2 GLN 13 29.534 7.527 -8.215
91 HE22 GLN 13 2HE2 GLN 13 30.762 7.230 -7.040
92 H ALA 14 H ALA 14 26.182 7.242 -4.917
93 HA ALA 14 HA ALA 14 23.537 8.515 -4.762
94 HB1 ALA 14 3HB ALA 14 23.627 6.055 -4.894
95 HB2 ALA 14 1HB ALA 14 22.882 6.613 -3.395
96 HB3 ALA 14 2HB ALA 14 24.544 6.018 -3.387
97 HA PRO 15 HA PRO 15 25.327 10.947 -1.374
98 HB2 PRO 15 2HB PRO 15 22.552 11.969 -1.154
99 HB3 PRO 15 1HB PRO 15 24.062 12.850 -1.409
100 HG2 PRO 15 2HG PRO 15 22.288 12.544 -3.390
101 HG3 PRO 15 1HG PRO 15 24.034 12.497 -3.707
102 HD2 PRO 15 2HD PRO 15 22.088 10.220 -3.463
103 HD3 PRO 15 1HD PRO 15 23.404 10.454 -4.634
104 H GLU 16 H GLU 16 24.901 11.283 0.920
105 HA GLU 16 HA GLU 16 24.042 8.865 2.188
106 HB2 GLU 16 2HB GLU 16 25.085 11.489 3.254
107 HB3 GLU 16 1HB GLU 16 24.552 10.200 4.323
108 HG2 GLU 16 2HG GLU 16 26.973 10.196 4.024
109 HG3 GLU 16 1HG GLU 16 26.239 8.709 3.431
110 H THR 17 H THR 17 22.370 11.661 1.273
111 HA THR 17 HA THR 17 20.498 12.118 3.242
112 HB THR 17 HB THR 17 19.940 12.074 0.261
113 HG1 THR 17 HG1 THR 17 20.391 14.410 0.581
114 HG21 THR 17 3HG2 THR 17 17.879 12.196 1.584
115 HG22 THR 17 1HG2 THR 17 18.199 13.735 0.783
116 HG23 THR 17 2HG2 THR 17 18.538 13.548 2.503
117 H LYS 18 H LYS 18 19.253 10.739 4.319
118 HA LYS 18 HA LYS 18 17.967 8.510 2.874
119 HB2 LYS 18 2HB LYS 18 19.840 7.671 4.223
120 HB3 LYS 18 1HB LYS 18 19.170 8.441 5.655
121 HG2 LYS 18 2HG LYS 18 17.242 6.972 5.585
122 HG3 LYS 18 1HG LYS 18 17.823 6.245 4.085
123 HD2 LYS 18 2HD LYS 18 18.365 4.775 5.918
124 HD3 LYS 18 1HD LYS 18 19.857 5.478 5.296
125 HE2 LYS 18 2HE LYS 18 19.886 5.445 7.721
126 HE3 LYS 18 1HE LYS 18 19.833 7.111 7.142
127 HZ1 LYS 18 3HZ LYS 18 17.395 5.634 7.941
128 HZ2 LYS 18 1HZ LYS 18 17.582 7.301 7.732
129 HZ3 LYS 18 2HZ LYS 18 18.307 6.529 9.047
130 H GLN 19 H GLN 19 15.827 8.298 3.171
131 HA GLN 19 HA GLN 19 14.462 10.166 4.958
132 HB2 GLN 19 2HB GLN 19 13.421 8.341 2.780
133 HB3 GLN 19 1HB GLN 19 12.404 9.398 3.750
134 HG2 GLN 19 2HG GLN 19 14.655 10.340 1.975
135 HG3 GLN 19 1HG GLN 19 12.953 10.313 1.517
136 HE21 GLN 19 1HE2 GLN 19 11.541 11.787 2.477
137 HE22 GLN 19 2HE2 GLN 19 12.104 13.180 3.324
138 H ALA 20 H ALA 20 13.085 9.574 6.607
139 HA ALA 20 HA ALA 20 13.358 6.834 7.615
140 HB1 ALA 20 3HB ALA 20 12.575 7.731 9.741
141 HB2 ALA 20 1HB ALA 20 12.265 9.298 8.988
142 HB3 ALA 20 2HB ALA 20 13.917 8.693 9.123
143 H PHE 21 H PHE 21 11.541 5.627 8.367
144 HA PHE 21 HA PHE 21 9.089 6.154 6.826
145 HB2 PHE 21 2HB PHE 21 10.178 3.648 8.118
146 HB3 PHE 21 1HB PHE 21 8.556 3.744 7.447
147 HD1 PHE 21 HD1 PHE 21 8.371 4.472 4.967
148 HD2 PHE 21 HD2 PHE 21 11.945 3.000 6.758
149 HE1 PHE 21 HE1 PHE 21 9.233 3.863 2.745
150 HE2 PHE 21 HE2 PHE 21 12.810 2.396 4.539
151 HZ PHE 21 HZ PHE 21 11.454 2.823 2.530
152 HA PRO 22 HA PRO 22 6.962 6.642 10.825
153 HB2 PRO 22 2HB PRO 22 4.976 8.233 9.966
154 HB3 PRO 22 1HB PRO 22 6.594 8.875 10.280
155 HG2 PRO 22 2HG PRO 22 5.273 8.258 7.676
156 HG3 PRO 22 1HG PRO 22 6.412 9.553 8.081
157 HD2 PRO 22 2HD PRO 22 7.042 7.122 6.803
158 HD3 PRO 22 1HD PRO 22 8.202 8.264 7.510
159 H ARG 23 H ARG 23 6.191 4.508 10.989
160 HA ARG 23 HA ARG 23 4.499 3.473 8.875
161 HB2 ARG 23 2HB ARG 23 4.707 1.299 9.955
162 HB3 ARG 23 1HB ARG 23 6.274 2.046 9.700
163 HG2 ARG 23 2HG ARG 23 6.357 2.672 12.070
164 HG3 ARG 23 1HG ARG 23 4.787 1.904 12.323
165 HD2 ARG 23 2HD ARG 23 5.732 -0.251 11.604
166 HD3 ARG 23 1HD ARG 23 7.299 0.518 11.356
167 HE ARG 23 HE ARG 23 6.409 0.922 14.011
168 HH11 ARG 23 1HH1 ARG 23 7.711 -1.505 11.937
169 HH12 ARG 23 2HH1 ARG 23 8.449 -2.374 13.235
170 HH21 ARG 23 1HH2 ARG 23 7.338 -0.219 15.672
171 HH22 ARG 23 2HH2 ARG 23 8.235 -1.661 15.328
172 H LYS 24 H LYS 24 3.996 4.729 12.081
173 HA LYS 24 HA LYS 24 1.555 3.516 12.719
174 HB2 LYS 24 2HB LYS 24 2.593 6.287 13.333
175 HB3 LYS 24 1HB LYS 24 1.075 5.679 13.980
176 HG2 LYS 24 2HG LYS 24 2.258 3.885 15.126
177 HG3 LYS 24 1HG LYS 24 3.788 4.433 14.437
178 HD2 LYS 24 2HD LYS 24 3.641 6.519 15.645
179 HD3 LYS 24 1HD LYS 24 2.028 6.109 16.233
180 HE2 LYS 24 2HE LYS 24 4.535 4.542 16.867
181 HE3 LYS 24 1HE LYS 24 3.823 5.764 17.921
182 HZ1 LYS 24 3HZ LYS 24 3.184 3.487 18.527
183 HZ2 LYS 24 1HZ LYS 24 2.435 3.294 17.027
184 HZ3 LYS 24 2HZ LYS 24 1.844 4.433 18.125
185 H PHE 25 H PHE 25 2.095 6.565 10.929
186 HA PHE 25 HA PHE 25 -0.633 7.030 10.334
187 HB2 PHE 25 2HB PHE 25 1.885 8.033 8.983
188 HB3 PHE 25 1HB PHE 25 0.268 8.614 8.602
189 HD1 PHE 25 HD2 PHE 25 2.937 8.575 11.129
190 HD2 PHE 25 HD1 PHE 25 -0.922 10.073 10.111
191 HE1 PHE 25 HE2 PHE 25 3.102 10.231 12.940
192 HE2 PHE 25 HE1 PHE 25 -0.756 11.733 11.919
193 HZ PHE 25 HZ PHE 25 1.257 11.812 13.338
194 H VAL 26 H VAL 26 1.966 5.550 8.381
195 HA VAL 26 HA VAL 26 0.438 5.148 6.049
196 HB VAL 26 HB VAL 26 2.784 3.481 6.996
197 HG11 VAL 26 1HG1 VAL 26 1.618 3.898 4.237
198 HG12 VAL 26 2HG1 VAL 26 1.563 2.411 5.184
199 HG13 VAL 26 3HG1 VAL 26 3.106 3.023 4.594
200 HG21 VAL 26 3HG2 VAL 26 3.354 5.860 6.937
201 HG22 VAL 26 1HG2 VAL 26 2.749 5.973 5.283
202 HG23 VAL 26 2HG2 VAL 26 4.167 4.985 5.639
203 H LEU 27 H LEU 27 1.199 2.830 8.680
204 HA LEU 27 HA LEU 27 -0.425 0.738 7.729
205 HB2 LEU 27 2HB LEU 27 0.480 1.397 10.533
206 HB3 LEU 27 1HB LEU 27 -0.368 -0.080 10.111
207 HG LEU 27 HG LEU 27 2.318 0.747 8.989
208 HD11 LEU 27 1HD1 LEU 27 3.264 -1.000 10.386
209 HD12 LEU 27 2HD1 LEU 27 1.672 -1.360 11.055
210 HD13 LEU 27 3HD1 LEU 27 2.435 0.196 11.382
211 HD21 LEU 27 3HD2 LEU 27 0.753 -1.825 8.706
212 HD22 LEU 27 1HD2 LEU 27 2.393 -1.547 8.116
213 HD23 LEU 27 2HD2 LEU 27 1.047 -0.635 7.437
214 H ALA 28 H ALA 28 -1.189 3.554 9.709
215 HA ALA 28 HA ALA 28 -3.823 2.836 10.423
216 HB1 ALA 28 3HB ALA 28 -2.627 4.731 11.433
217 HB2 ALA 28 1HB ALA 28 -4.202 5.211 10.802
218 HB3 ALA 28 2HB ALA 28 -2.736 5.607 9.906
219 H ALA 29 H ALA 29 -2.577 4.627 7.598
220 HA ALA 29 HA ALA 29 -5.055 4.983 6.290
221 HB1 ALA 29 3HB ALA 29 -2.283 4.753 5.103
222 HB2 ALA 29 1HB ALA 29 -3.061 6.234 5.659
223 HB3 ALA 29 2HB ALA 29 -3.708 5.370 4.265
224 H LEU 30 H LEU 30 -2.740 2.349 6.300
225 HA LEU 30 HA LEU 30 -3.825 0.798 4.213
226 HB2 LEU 30 2HB LEU 30 -1.569 0.502 5.135
227 HB3 LEU 30 1HB LEU 30 -2.251 -0.045 6.652
228 HG LEU 30 HG LEU 30 -3.154 -2.046 5.544
229 HD11 LEU 30 1HD1 LEU 30 -3.526 -1.151 3.315
230 HD12 LEU 30 2HD1 LEU 30 -2.497 -2.581 3.240
231 HD13 LEU 30 3HD1 LEU 30 -1.786 -0.974 3.072
232 HD21 LEU 30 3HD2 LEU 30 -0.998 -3.147 5.094
233 HD22 LEU 30 1HD2 LEU 30 -0.950 -2.155 6.552
234 HD23 LEU 30 2HD2 LEU 30 -0.210 -1.571 5.063
235 H GLU 31 H GLU 31 -4.176 0.334 7.760
236 HA GLU 31 HA GLU 31 -6.037 -1.753 7.623
237 HB2 GLU 31 2HB GLU 31 -6.535 -1.257 9.982
238 HB3 GLU 31 1HB GLU 31 -4.805 -1.253 9.667
239 HG2 GLU 31 2HG GLU 31 -4.804 1.186 9.633
240 HG3 GLU 31 1HG GLU 31 -6.544 1.202 9.908
241 H GLN 32 H GLN 32 -6.584 1.757 7.767
242 HA GLN 32 HA GLN 32 -9.423 1.582 7.985
243 HB2 GLN 32 2HB GLN 32 -7.624 3.849 7.099
244 HB3 GLN 32 1HB GLN 32 -9.357 4.017 7.356
245 HG2 GLN 32 2HG GLN 32 -9.080 3.393 9.701
246 HG3 GLN 32 1HG GLN 32 -7.351 3.177 9.447
247 HE21 GLN 32 1HE2 GLN 32 -6.061 5.016 9.123
248 HE22 GLN 32 2HE2 GLN 32 -6.594 6.587 9.595
249 H SER 33 H SER 33 -7.281 1.235 5.317
250 HA SER 33 HA SER 33 -9.458 1.582 3.368
251 HB2 SER 33 2HB SER 33 -6.495 1.104 2.935
252 HB3 SER 33 1HB SER 33 -7.682 1.315 1.647
253 HG SER 33 HG SER 33 -6.491 3.181 3.282
254 H SER 34 H SER 34 -8.244 -0.835 5.277
255 HA SER 34 HA SER 34 -8.310 -3.019 3.392
256 HB2 SER 34 2HB SER 34 -8.230 -3.025 6.423
257 HB3 SER 34 1HB SER 34 -8.066 -4.458 5.410
258 HG SER 34 HG SER 34 -6.363 -2.235 5.049
259 H ASP 35 H ASP 35 -10.000 -4.288 2.851
260 HA ASP 35 HA ASP 35 -12.636 -3.528 3.783
261 HB2 ASP 35 2HB ASP 35 -11.802 -5.612 1.750
262 HB3 ASP 35 1HB ASP 35 -13.444 -5.024 2.010
263 H ASP 36 H ASP 36 -13.970 -6.054 3.507
264 HA ASP 36 HA ASP 36 -14.091 -6.726 6.198
265 HB2 ASP 36 2HB ASP 36 -15.930 -7.129 4.645
266 HB3 ASP 36 1HB ASP 36 -14.989 -8.371 3.824
267 H ALA 37 H ALA 37 -12.232 -8.366 3.643
268 HA ALA 37 HA ALA 37 -11.530 -10.605 5.313
269 HB1 ALA 37 3HB ALA 37 -11.699 -10.839 2.884
270 HB2 ALA 37 1HB ALA 37 -10.096 -11.292 3.462
271 HB3 ALA 37 2HB ALA 37 -10.343 -9.731 2.677
272 H GLY 38 H GLY 38 -10.378 -7.429 5.114
273 HA2 GLY 38 2HA GLY 38 -8.737 -6.492 6.508
274 HA3 GLY 38 1HA GLY 38 -8.095 -8.098 6.806
275 H TRP 39 H TRP 39 -8.696 -7.061 3.559
276 HA TRP 39 HA TRP 39 -5.815 -6.538 3.142
277 HB2 TRP 39 2HB TRP 39 -7.814 -7.858 1.287
278 HB3 TRP 39 1HB TRP 39 -6.201 -7.358 0.791
279 HD1 TRP 39 HD1 TRP 39 -8.026 -10.053 2.778
280 HE1 TRP 39 HE1 TRP 39 -6.381 -11.964 3.284
281 HE3 TRP 39 HE3 TRP 39 -3.698 -7.843 1.191
282 HZ2 TRP 39 HZ2 TRP 39 -3.614 -12.471 3.045
283 HZ3 TRP 39 HZ3 TRP 39 -1.594 -9.108 1.364
284 HH2 TRP 39 HH2 TRP 39 -1.553 -11.373 2.272
285 H ALA 40 H ALA 40 -5.284 -4.657 2.162
286 HA ALA 40 HA ALA 40 -7.465 -2.934 1.174
287 HB1 ALA 40 3HB ALA 40 -5.985 -1.051 1.622
288 HB2 ALA 40 1HB ALA 40 -4.702 -2.159 2.114
289 HB3 ALA 40 2HB ALA 40 -6.180 -2.044 3.067
290 H ASN 41 H ASN 41 -7.595 -2.607 -0.968
291 HA ASN 41 HA ASN 41 -5.715 -3.576 -2.840
292 HB2 ASN 41 2HB ASN 41 -8.124 -3.206 -3.330
293 HB3 ASN 41 1HB ASN 41 -7.865 -1.468 -3.236
294 HD21 ASN 41 1HD2 ASN 41 -8.825 -3.110 -5.439
295 HD22 ASN 41 2HD2 ASN 41 -7.762 -2.795 -6.760
296 H LEU 42 H LEU 42 -3.929 -2.669 -3.733
297 HA LEU 42 HA LEU 42 -2.448 -0.680 -2.630
298 HB2 LEU 42 2HB LEU 42 -1.608 -2.214 -4.332
299 HB3 LEU 42 1HB LEU 42 -2.574 -1.418 -5.560
300 HG LEU 42 HG LEU 42 -1.228 0.656 -5.213
301 HD11 LEU 42 1HD1 LEU 42 0.867 0.541 -3.989
302 HD12 LEU 42 2HD1 LEU 42 0.509 -1.113 -3.496
303 HD13 LEU 42 3HD1 LEU 42 -0.495 0.217 -2.918
304 HD21 LEU 42 3HD2 LEU 42 0.757 -0.137 -6.393
305 HD22 LEU 42 1HD2 LEU 42 -0.704 -0.891 -7.032
306 HD23 LEU 42 2HD2 LEU 42 0.362 -1.801 -5.960
307 H GLY 43 H GLY 43 -4.891 -0.231 -5.172
308 HA2 GLY 43 2HA GLY 43 -4.459 2.490 -5.712
309 HA3 GLY 43 1HA GLY 43 -5.986 1.646 -5.922
310 H ASN 44 H ASN 44 -6.777 1.026 -3.416
311 HA ASN 44 HA ASN 44 -7.727 3.506 -2.401
312 HB2 ASN 44 2HB ASN 44 -7.798 0.786 -1.059
313 HB3 ASN 44 1HB ASN 44 -8.804 2.177 -0.658
314 HD21 ASN 44 1HD2 ASN 44 -9.644 -0.469 -1.485
315 HD22 ASN 44 2HD2 ASN 44 -10.566 -0.251 -2.931
316 H PHE 45 H PHE 45 -5.207 1.269 -1.347
317 HA PHE 45 HA PHE 45 -4.479 2.467 1.069
318 HB2 PHE 45 2HB PHE 45 -3.575 0.323 0.489
319 HB3 PHE 45 1HB PHE 45 -2.840 0.962 -0.977
320 HD1 PHE 45 HD1 PHE 45 -2.768 1.594 2.712
321 HD2 PHE 45 HD2 PHE 45 -0.566 1.326 -0.926
322 HE1 PHE 45 HE1 PHE 45 -0.676 1.973 3.950
323 HE2 PHE 45 HE2 PHE 45 1.525 1.704 0.309
324 HZ PHE 45 HZ PHE 45 1.472 2.031 2.748
325 H GLY 46 H GLY 46 -2.943 2.973 -2.135
326 HA2 GLY 46 2HA GLY 46 -1.242 5.062 -1.398
327 HA3 GLY 46 1HA GLY 46 -1.848 4.790 -3.023
328 H ASN 47 H ASN 47 -4.630 5.192 -2.382
329 HA ASN 47 HA ASN 47 -4.819 8.002 -2.686
330 HB2 ASN 47 2HB ASN 47 -6.457 6.336 -3.569
331 HB3 ASN 47 1HB ASN 47 -7.005 6.045 -1.923
332 HD21 ASN 47 1HD2 ASN 47 -8.455 7.026 -4.247
333 HD22 ASN 47 2HD2 ASN 47 -9.134 8.541 -3.772
334 H TYR 48 H TYR 48 -6.073 5.973 0.001
335 HA TYR 48 HA TYR 48 -6.681 8.162 1.674
336 HB2 TYR 48 2HB TYR 48 -7.510 5.703 1.778
337 HB3 TYR 48 1HB TYR 48 -6.066 5.410 2.740
338 HD1 TYR 48 HD2 TYR 48 -9.124 7.519 2.581
339 HD2 TYR 48 HD1 TYR 48 -6.084 5.867 5.064
340 HE1 TYR 48 HE2 TYR 48 -10.332 8.303 4.570
341 HE2 TYR 48 HE1 TYR 48 -7.290 6.649 7.060
342 HH TYR 48 HH TYR 48 -9.001 8.536 7.573
343 H LEU 49 H LEU 49 -3.765 6.266 1.270
344 HA LEU 49 HA LEU 49 -2.329 7.122 3.532
345 HB2 LEU 49 2HB LEU 49 -1.560 5.264 2.181
346 HB3 LEU 49 1HB LEU 49 -1.360 6.309 0.788
347 HG LEU 49 HG LEU 49 0.476 7.489 1.925
348 HD11 LEU 49 1HD1 LEU 49 -0.236 7.222 4.233
349 HD12 LEU 49 2HD1 LEU 49 1.403 6.608 4.015
350 HD13 LEU 49 3HD1 LEU 49 0.049 5.484 4.139
351 HD21 LEU 49 3HD2 LEU 49 0.821 4.490 1.876
352 HD22 LEU 49 1HD2 LEU 49 2.121 5.681 1.840
353 HD23 LEU 49 2HD2 LEU 49 0.984 5.575 0.496
354 H ASN 50 H ASN 50 -2.579 8.541 0.275
355 HA ASN 50 HA ASN 50 -0.739 10.653 0.760
356 HB2 ASN 50 2HB ASN 50 -1.413 9.853 -1.506
357 HB3 ASN 50 1HB ASN 50 -3.000 10.577 -1.257
358 HD21 ASN 50 1HD2 ASN 50 0.398 11.218 -1.720
359 HD22 ASN 50 2HD2 ASN 50 0.219 12.879 -2.161
360 H LYS 51 H LYS 51 -4.181 10.284 1.352
361 HA LYS 51 HA LYS 51 -4.827 12.976 1.903
362 HB2 LYS 51 2HB LYS 51 -5.988 10.459 3.129
363 HB3 LYS 51 1HB LYS 51 -6.709 12.059 3.225
364 HG2 LYS 51 2HG LYS 51 -7.016 12.086 0.802
365 HG3 LYS 51 1HG LYS 51 -6.254 10.497 0.683
366 HD2 LYS 51 2HD LYS 51 -8.664 10.250 0.603
367 HD3 LYS 51 1HD LYS 51 -8.048 9.561 2.107
368 HE2 LYS 51 2HE LYS 51 -10.053 10.817 2.570
369 HE3 LYS 51 1HE LYS 51 -8.671 11.651 3.280
370 HZ1 LYS 51 3HZ LYS 51 -10.117 13.217 2.196
371 HZ2 LYS 51 1HZ LYS 51 -10.038 12.361 0.740
372 HZ3 LYS 51 2HZ LYS 51 -8.661 13.136 1.341
373 H LEU 52 H LEU 52 -3.668 10.381 4.048
374 HA LEU 52 HA LEU 52 -3.604 12.091 6.369
375 HB2 LEU 52 2HB LEU 52 -2.377 9.355 5.966
376 HB3 LEU 52 1HB LEU 52 -2.601 10.168 7.505
377 HG LEU 52 HG LEU 52 -4.772 9.109 5.685
378 HD11 LEU 52 1HD1 LEU 52 -3.913 8.292 8.463
379 HD12 LEU 52 2HD1 LEU 52 -3.637 7.386 6.975
380 HD13 LEU 52 3HD1 LEU 52 -5.280 7.626 7.568
381 HD21 LEU 52 3HD2 LEU 52 -6.364 9.838 7.406
382 HD22 LEU 52 1HD2 LEU 52 -5.518 11.205 6.683
383 HD23 LEU 52 2HD2 LEU 52 -5.053 10.629 8.284
384 H GLN 53 H GLN 53 -1.199 10.758 4.136
385 HA GLN 53 HA GLN 53 0.804 12.640 5.217
386 HB2 GLN 53 2HB GLN 53 1.262 9.819 4.210
387 HB3 GLN 53 1HB GLN 53 2.547 10.953 4.601
388 HG2 GLN 53 2HG GLN 53 0.484 9.962 6.566
389 HG3 GLN 53 1HG GLN 53 2.091 9.269 6.364
390 HE21 GLN 53 1HE2 GLN 53 0.284 11.999 7.534
391 HE22 GLN 53 2HE2 GLN 53 1.577 12.717 8.422
392 HA PRO 54 HA PRO 54 0.166 13.595 0.730
393 HB2 PRO 54 2HB PRO 54 0.530 16.278 0.953
394 HB3 PRO 54 1HB PRO 54 -1.011 15.489 1.302
395 HG2 PRO 54 2HG PRO 54 1.124 16.393 3.204
396 HG3 PRO 54 1HG PRO 54 -0.638 16.584 3.324
397 HD2 PRO 54 2HD PRO 54 0.718 14.649 4.660
398 HD3 PRO 54 1HD PRO 54 -0.945 14.422 4.084
399 H ASP 55 H ASP 55 2.786 14.170 2.915
400 HA ASP 55 HA ASP 55 4.619 14.948 0.767
401 HB2 ASP 55 2HB ASP 55 4.602 16.169 2.951
402 HB3 ASP 55 1HB ASP 55 5.145 14.693 3.740
403 H PHE 56 H PHE 56 3.462 12.089 1.829
404 HA PHE 56 HA PHE 56 6.003 10.651 1.977
405 HB2 PHE 56 2HB PHE 56 4.148 10.099 3.539
406 HB3 PHE 56 1HB PHE 56 3.168 9.593 2.169
407 HD1 PHE 56 HD1 PHE 56 6.155 8.798 4.179
408 HD2 PHE 56 HD2 PHE 56 3.471 7.445 1.158
409 HE1 PHE 56 HE1 PHE 56 7.087 6.529 4.371
410 HE2 PHE 56 HE2 PHE 56 4.405 5.175 1.343
411 HZ PHE 56 HZ PHE 56 6.215 4.713 2.950
412 H ASP 57 H ASP 57 6.889 10.583 -0.045
413 HA ASP 57 HA ASP 57 5.370 9.073 -2.066
414 HB2 ASP 57 2HB ASP 57 5.587 11.490 -2.685
415 HB3 ASP 57 1HB ASP 57 7.336 11.275 -2.728
416 H SER 58 H SER 58 6.433 7.507 -3.180
417 HA SER 58 HA SER 58 8.549 6.165 -1.963
418 HB2 SER 58 2HB SER 58 8.590 4.782 -4.041
419 HB3 SER 58 1HB SER 58 6.973 4.993 -3.367
420 HG SER 58 HG SER 58 6.434 6.298 -5.006
421 H ARG 59 H ARG 59 8.652 8.533 -4.604
422 HA ARG 59 HA ARG 59 11.236 7.986 -5.552
423 HB2 ARG 59 2HB ARG 59 9.703 10.591 -5.477
424 HB3 ARG 59 1HB ARG 59 11.241 10.397 -6.309
425 HG2 ARG 59 2HG ARG 59 8.716 8.863 -6.924
426 HG3 ARG 59 1HG ARG 59 9.332 10.241 -7.836
427 HD2 ARG 59 2HD ARG 59 10.690 7.569 -7.483
428 HD3 ARG 59 1HD ARG 59 9.929 8.172 -8.953
429 HE ARG 59 HE ARG 59 11.751 10.046 -8.571
430 HH11 ARG 59 1HH1 ARG 59 12.068 6.633 -8.266
431 HH12 ARG 59 2HH1 ARG 59 13.731 6.632 -8.734
432 HH21 ARG 59 1HH2 ARG 59 13.893 10.032 -9.157
433 HH22 ARG 59 2HH2 ARG 59 14.750 8.536 -9.232
434 H LEU 60 H LEU 60 10.196 9.868 -2.765
435 HA LEU 60 HA LEU 60 12.634 11.148 -2.169
436 HB2 LEU 60 2HB LEU 60 10.479 10.199 -0.267
437 HB3 LEU 60 1HB LEU 60 11.754 11.337 0.134
438 HG LEU 60 HG LEU 60 9.546 11.804 -1.888
439 HD11 LEU 60 1HD1 LEU 60 10.003 12.979 0.859
440 HD12 LEU 60 2HD1 LEU 60 8.726 11.849 0.406
441 HD13 LEU 60 3HD1 LEU 60 8.747 13.474 -0.277
442 HD21 LEU 60 3HD2 LEU 60 11.613 12.920 -2.547
443 HD22 LEU 60 1HD2 LEU 60 11.757 13.631 -0.938
444 HD23 LEU 60 2HD2 LEU 60 10.420 14.095 -1.992
445 H TYR 61 H TYR 61 11.545 7.878 -1.623
446 HA TYR 61 HA TYR 61 13.804 7.261 0.132
447 HB2 TYR 61 2HB TYR 61 11.490 5.539 -0.800
448 HB3 TYR 61 1HB TYR 61 12.728 5.034 0.347
449 HD1 TYR 61 HD1 TYR 61 9.832 7.275 -0.153
450 HD2 TYR 61 HD2 TYR 61 12.676 5.770 2.636
451 HE1 TYR 61 HE1 TYR 61 8.508 8.213 1.696
452 HE2 TYR 61 HE2 TYR 61 11.357 6.700 4.491
453 HH TYR 61 HH TYR 61 9.703 8.359 4.934
454 H GLY 62 H GLY 62 13.548 7.604 -3.064
455 HA2 GLY 62 2HA GLY 62 15.056 7.025 -4.724
456 HA3 GLY 62 1HA GLY 62 15.813 5.898 -3.611
457 H TYR 63 H TYR 63 12.372 5.734 -4.272
458 HA TYR 63 HA TYR 63 12.816 3.221 -5.751
459 HB2 TYR 63 2HB TYR 63 10.504 4.169 -4.063
460 HB3 TYR 63 1HB TYR 63 10.376 2.776 -5.134
461 HD1 TYR 63 HD1 TYR 63 12.242 4.105 -2.198
462 HD2 TYR 63 HD2 TYR 63 11.185 0.681 -4.486
463 HE1 TYR 63 HE1 TYR 63 13.205 2.651 -0.461
464 HE2 TYR 63 HE2 TYR 63 12.125 -0.777 -2.765
465 HH TYR 63 HH TYR 63 13.853 -0.617 -0.948
466 H LYS 64 H LYS 64 11.186 2.657 -7.416
467 HA LYS 64 HA LYS 64 10.974 4.801 -9.320
468 HB2 LYS 64 2HB LYS 64 9.795 2.020 -9.508
469 HB3 LYS 64 1HB LYS 64 10.150 3.110 -10.840
470 HG2 LYS 64 2HG LYS 64 12.195 1.821 -9.029
471 HG3 LYS 64 1HG LYS 64 11.788 1.296 -10.662
472 HD2 LYS 64 2HD LYS 64 12.945 3.991 -9.930
473 HD3 LYS 64 1HD LYS 64 13.857 2.632 -10.591
474 HE2 LYS 64 2HE LYS 64 12.430 2.698 -12.608
475 HE3 LYS 64 1HE LYS 64 11.599 4.110 -11.954
476 HZ1 LYS 64 3HZ LYS 64 13.723 5.291 -11.955
477 HZ2 LYS 64 1HZ LYS 64 13.305 4.766 -13.507
478 HZ3 LYS 64 2HZ LYS 64 14.484 3.939 -12.627
479 H LYS 65 H LYS 65 8.700 2.994 -7.313
480 HA LYS 65 HA LYS 65 6.672 5.022 -7.513
481 HB2 LYS 65 2HB LYS 65 4.926 3.477 -8.429
482 HB3 LYS 65 1HB LYS 65 6.179 3.900 -9.592
483 HG2 LYS 65 2HG LYS 65 7.300 1.745 -9.120
484 HG3 LYS 65 1HG LYS 65 5.964 1.317 -8.047
485 HD2 LYS 65 2HD LYS 65 4.399 1.436 -9.919
486 HD3 LYS 65 1HD LYS 65 5.705 1.932 -10.999
487 HE2 LYS 65 2HE LYS 65 6.834 -0.206 -10.636
488 HE3 LYS 65 1HE LYS 65 5.557 -0.703 -9.525
489 HZ1 LYS 65 3HZ LYS 65 3.978 -0.597 -11.347
490 HZ2 LYS 65 1HZ LYS 65 5.249 -1.650 -11.725
491 HZ3 LYS 65 2HZ LYS 65 5.196 -0.103 -12.411
492 H LEU 66 H LEU 66 4.659 4.338 -6.231
493 HA LEU 66 HA LEU 66 5.397 3.723 -3.639
494 HB2 LEU 66 2HB LEU 66 3.305 4.844 -4.189
495 HB3 LEU 66 1HB LEU 66 2.683 3.374 -4.915
496 HG LEU 66 HG LEU 66 2.710 2.271 -2.707
497 HD11 LEU 66 1HD1 LEU 66 4.548 3.489 -1.681
498 HD12 LEU 66 2HD1 LEU 66 3.101 3.587 -0.677
499 HD13 LEU 66 3HD1 LEU 66 3.585 4.967 -1.665
500 HD21 LEU 66 3HD2 LEU 66 0.848 3.521 -1.712
501 HD22 LEU 66 1HD2 LEU 66 0.673 3.379 -3.461
502 HD23 LEU 66 2HD2 LEU 66 1.216 4.898 -2.749
503 H SER 67 H SER 67 3.942 1.471 -6.010
504 HA SER 67 HA SER 67 3.731 -0.760 -4.327
505 HB2 SER 67 2HB SER 67 3.727 -2.110 -6.419
506 HB3 SER 67 1HB SER 67 2.652 -0.717 -6.512
507 HG SER 67 HG SER 67 3.864 -0.843 -8.396
508 H ASP 68 H ASP 68 6.440 0.277 -6.378
509 HA ASP 68 HA ASP 68 8.187 -1.865 -5.975
510 HB2 ASP 68 2HB ASP 68 8.473 0.092 -7.575
511 HB3 ASP 68 1HB ASP 68 8.998 1.043 -6.187
512 H LEU 69 H LEU 69 7.598 1.004 -4.008
513 HA LEU 69 HA LEU 69 9.586 0.545 -2.037
514 HB2 LEU 69 2HB LEU 69 8.603 2.726 -2.292
515 HB3 LEU 69 1HB LEU 69 6.996 2.098 -1.981
516 HG LEU 69 HG LEU 69 7.678 1.603 0.363
517 HD11 LEU 69 1HD1 LEU 69 9.740 2.578 1.241
518 HD12 LEU 69 2HD1 LEU 69 10.209 3.064 -0.389
519 HD13 LEU 69 3HD1 LEU 69 10.076 1.353 0.019
520 HD21 LEU 69 3HD2 LEU 69 6.516 3.688 -0.204
521 HD22 LEU 69 1HD2 LEU 69 8.071 4.477 -0.477
522 HD23 LEU 69 2HD2 LEU 69 7.639 3.912 1.138
523 H VAL 70 H VAL 70 6.089 -0.150 -2.044
524 HA VAL 70 HA VAL 70 5.932 -1.241 0.526
525 HB VAL 70 HB VAL 70 4.177 -1.882 -1.856
526 HG11 VAL 70 1HG1 VAL 70 3.630 -2.209 1.100
527 HG12 VAL 70 2HG1 VAL 70 3.917 -3.515 -0.049
528 HG13 VAL 70 3HG1 VAL 70 2.482 -2.506 -0.205
529 HG21 VAL 70 3HG2 VAL 70 4.281 0.521 -1.390
530 HG22 VAL 70 1HG2 VAL 70 3.866 0.221 0.299
531 HG23 VAL 70 2HG2 VAL 70 2.695 -0.133 -0.974
532 H LYS 71 H LYS 71 6.260 -2.982 -2.594
533 HA LYS 71 HA LYS 71 6.261 -5.573 -1.465
534 HB2 LYS 71 2HB LYS 71 7.151 -6.337 -3.624
535 HB3 LYS 71 1HB LYS 71 5.809 -5.221 -3.830
536 HG2 LYS 71 2HG LYS 71 7.396 -3.412 -4.321
537 HG3 LYS 71 1HG LYS 71 8.735 -4.545 -4.144
538 HD2 LYS 71 2HD LYS 71 6.518 -5.126 -6.084
539 HD3 LYS 71 1HD LYS 71 7.794 -3.993 -6.523
540 HE2 LYS 71 2HE LYS 71 8.251 -6.275 -7.326
541 HE3 LYS 71 1HE LYS 71 9.479 -5.713 -6.194
542 HZ1 LYS 71 3HZ LYS 71 7.204 -7.454 -5.427
543 HZ2 LYS 71 1HZ LYS 71 8.546 -7.047 -4.482
544 HZ3 LYS 71 2HZ LYS 71 8.736 -8.035 -5.839
545 H ALA 72 H ALA 72 8.802 -3.218 -1.786
546 HA ALA 72 HA ALA 72 10.969 -5.057 -1.312
547 HB1 ALA 72 3HB ALA 72 10.910 -2.045 -1.095
548 HB2 ALA 72 1HB ALA 72 11.308 -2.966 -2.543
549 HB3 ALA 72 2HB ALA 72 12.353 -3.058 -1.127
550 H ARG 73 H ARG 73 8.989 -2.908 0.670
551 HA ARG 73 HA ARG 73 10.567 -3.516 3.060
552 HB2 ARG 73 2HB ARG 73 8.174 -1.685 2.743
553 HB3 ARG 73 1HB ARG 73 9.214 -1.797 4.158
554 HG2 ARG 73 2HG ARG 73 10.079 -0.881 1.413
555 HG3 ARG 73 1HG ARG 73 9.734 0.170 2.787
556 HD2 ARG 73 2HD ARG 73 11.616 -0.605 3.985
557 HD3 ARG 73 1HD ARG 73 11.817 -2.002 2.928
558 HE ARG 73 HE ARG 73 12.329 -0.208 1.163
559 HH11 ARG 73 1HH1 ARG 73 13.150 0.110 4.503
560 HH12 ARG 73 2HH1 ARG 73 14.555 1.057 4.168
561 HH21 ARG 73 1HH2 ARG 73 14.110 0.992 0.765
562 HH22 ARG 73 2HH2 ARG 73 15.095 1.557 2.074
563 H THR 74 H THR 74 9.540 -5.819 2.308
564 HA THR 74 HA THR 74 6.939 -6.502 3.121
565 HB THR 74 HB THR 74 7.767 -8.846 3.250
566 HG1 THR 74 HG1 THR 74 9.888 -9.293 3.146
567 HG21 THR 74 3HG2 THR 74 8.433 -9.039 0.896
568 HG22 THR 74 1HG2 THR 74 8.731 -7.301 0.837
569 HG23 THR 74 2HG2 THR 74 7.094 -7.906 1.092
570 H ASP 75 H ASP 75 9.731 -5.842 5.024
571 HA ASP 75 HA ASP 75 8.982 -7.251 7.383
572 HB2 ASP 75 2HB ASP 75 11.291 -6.465 6.919
573 HB3 ASP 75 1HB ASP 75 10.743 -4.801 7.089
574 H LEU 76 H LEU 76 7.898 -4.343 5.929
575 HA LEU 76 HA LEU 76 6.475 -3.468 8.353
576 HB2 LEU 76 2HB LEU 76 6.885 -2.110 5.678
577 HB3 LEU 76 1HB LEU 76 5.957 -1.429 7.001
578 HG LEU 76 HG LEU 76 8.915 -2.051 7.115
579 HD11 LEU 76 1HD1 LEU 76 9.232 0.381 7.035
580 HD12 LEU 76 2HD1 LEU 76 7.501 0.598 6.781
581 HD13 LEU 76 3HD1 LEU 76 8.472 -0.226 5.562
582 HD21 LEU 76 3HD2 LEU 76 7.824 -2.190 9.290
583 HD22 LEU 76 1HD2 LEU 76 7.110 -0.594 9.050
584 HD23 LEU 76 2HD2 LEU 76 8.858 -0.767 9.200
585 H PHE 77 H PHE 77 5.895 -4.140 4.894
586 HA PHE 77 HA PHE 77 2.998 -4.375 5.464
587 HB2 PHE 77 2HB PHE 77 4.256 -3.640 2.805
588 HB3 PHE 77 1HB PHE 77 2.555 -3.541 3.249
589 HD1 PHE 77 HD1 PHE 77 2.189 -2.039 5.484
590 HD2 PHE 77 HD2 PHE 77 5.385 -1.647 2.692
591 HE1 PHE 77 HE1 PHE 77 2.534 0.290 6.200
592 HE2 PHE 77 HE2 PHE 77 5.729 0.681 3.407
593 HZ PHE 77 HZ PHE 77 4.306 1.649 5.164
594 H VAL 78 H VAL 78 1.907 -6.165 4.750
595 HA VAL 78 HA VAL 78 3.429 -8.338 3.495
596 HB VAL 78 HB VAL 78 0.566 -8.353 4.499
597 HG11 VAL 78 1HG1 VAL 78 2.408 -10.628 3.750
598 HG12 VAL 78 2HG1 VAL 78 1.001 -10.085 2.836
599 HG13 VAL 78 3HG1 VAL 78 0.790 -10.799 4.436
600 HG21 VAL 78 3HG2 VAL 78 2.132 -7.910 6.329
601 HG22 VAL 78 1HG2 VAL 78 3.070 -9.334 5.876
602 HG23 VAL 78 2HG2 VAL 78 1.420 -9.517 6.475
603 H THR 79 H THR 79 3.307 -8.728 1.341
604 HA THR 79 HA THR 79 1.185 -7.337 -0.200
605 HB THR 79 HB THR 79 2.755 -7.096 -2.042
606 HG1 THR 79 HG1 THR 79 4.023 -9.119 -0.947
607 HG21 THR 79 3HG2 THR 79 2.831 -5.338 -0.359
608 HG22 THR 79 1HG2 THR 79 4.445 -5.622 -1.009
609 HG23 THR 79 2HG2 THR 79 4.010 -6.255 0.579
610 H GLU 80 H GLU 80 -0.178 -8.605 -1.315
611 HA GLU 80 HA GLU 80 0.858 -10.900 -2.779
612 HB2 GLU 80 2HB GLU 80 -1.472 -11.201 -0.857
613 HB3 GLU 80 1HB GLU 80 -1.005 -12.394 -2.062
614 HG2 GLU 80 2HG GLU 80 1.242 -12.504 -0.916
615 HG3 GLU 80 1HG GLU 80 0.540 -11.530 0.373
616 H GLU 81 H GLU 81 -0.085 -11.093 -4.755
617 HA GLU 81 HA GLU 81 -2.135 -9.146 -5.466
618 HB2 GLU 81 2HB GLU 81 -0.560 -11.084 -7.173
619 HB3 GLU 81 1HB GLU 81 -1.705 -9.903 -7.792
620 HG2 GLU 81 2HG GLU 81 -0.286 -8.100 -6.849
621 HG3 GLU 81 1HG GLU 81 0.887 -9.327 -6.367
622 H ARG 82 H ARG 82 -4.224 -9.609 -5.714
623 HA ARG 82 HA ARG 82 -5.045 -12.427 -6.080
624 HB2 ARG 82 2HB ARG 82 -6.664 -10.190 -4.838
625 HB3 ARG 82 1HB ARG 82 -7.129 -11.881 -4.944
626 HG2 ARG 82 2HG ARG 82 -4.779 -10.833 -3.370
627 HG3 ARG 82 1HG ARG 82 -6.366 -11.209 -2.697
628 HD2 ARG 82 2HD ARG 82 -4.590 -13.199 -4.121
629 HD3 ARG 82 1HD ARG 82 -4.686 -13.012 -2.369
630 HE ARG 82 HE ARG 82 -7.274 -13.405 -3.271
631 HH11 ARG 82 1HH1 ARG 82 -4.320 -15.176 -3.233
632 HH12 ARG 82 2HH1 ARG 82 -5.118 -16.708 -3.147
633 HH21 ARG 82 1HH2 ARG 82 -8.271 -15.361 -3.149
634 HH22 ARG 82 2HH2 ARG 82 -7.326 -16.808 -3.094
635 H GLN 83 H GLN 83 -6.289 -12.898 -7.852
636 HA GLN 83 HA GLN 83 -6.571 -10.838 -9.862
637 HB2 GLN 83 2HB GLN 83 -5.863 -13.173 -10.387
638 HB3 GLN 83 1HB GLN 83 -7.477 -13.726 -9.957
639 HG2 GLN 83 2HG GLN 83 -8.425 -12.382 -11.770
640 HG3 GLN 83 1HG GLN 83 -6.812 -11.808 -12.192
641 HE21 GLN 83 1HE2 GLN 83 -8.984 -14.513 -12.231
642 HE22 GLN 83 2HE2 GLN 83 -8.080 -15.476 -13.343
643 H VAL 84 H VAL 84 -8.431 -9.842 -10.544
644 HA VAL 84 HA VAL 84 -10.659 -9.981 -8.670
645 HB VAL 84 HB VAL 84 -10.208 -8.051 -10.958
646 HG11 VAL 84 1HG1 VAL 84 -11.793 -6.607 -9.743
647 HG12 VAL 84 2HG1 VAL 84 -12.057 -7.898 -8.570
648 HG13 VAL 84 3HG1 VAL 84 -12.536 -8.124 -10.252
649 HG21 VAL 84 3HG2 VAL 84 -9.363 -6.491 -9.267
650 HG22 VAL 84 1HG2 VAL 84 -8.370 -7.945 -9.342
651 HG23 VAL 84 2HG2 VAL 84 -9.527 -7.734 -8.027
652 HA PRO 85 HA PRO 85 -13.082 -12.634 -11.420
653 HB2 PRO 85 2HB PRO 85 -15.287 -11.557 -9.713
654 HB3 PRO 85 1HB PRO 85 -14.893 -13.233 -10.121
655 HG2 PRO 85 2HG PRO 85 -14.320 -12.279 -7.705
656 HG3 PRO 85 1HG PRO 85 -13.178 -13.353 -8.540
657 HD2 PRO 85 2HD PRO 85 -13.079 -10.371 -8.206
658 HD3 PRO 85 1HD PRO 85 -11.760 -11.558 -8.119
659 H GLY 86 H GLY 86 -13.959 -12.160 -13.372
660 HA2 GLY 86 2HA GLY 86 -15.142 -11.010 -15.007
661 HA3 GLY 86 1HA GLY 86 -15.684 -9.875 -13.781
662 H SER 87 H SER 87 -12.307 -10.315 -13.808
663 HA SER 87 HA SER 87 -11.858 -8.087 -15.691
664 HB2 SER 87 2HB SER 87 -10.661 -8.324 -12.910
665 HB3 SER 87 1HB SER 87 -10.153 -7.148 -14.121
666 HG SER 87 HG SER 87 -12.765 -7.379 -13.016
667 H THR 88 H THR 88 -9.819 -8.083 -16.733
668 HA THR 88 HA THR 88 -8.519 -10.695 -16.825
669 HB THR 88 HB THR 88 -8.971 -9.621 -18.967
670 HG1 THR 88 HG1 THR 88 -7.210 -10.748 -19.372
671 HG21 THR 88 3HG2 THR 88 -7.762 -7.582 -19.648
672 HG22 THR 88 1HG2 THR 88 -7.112 -7.426 -18.017
673 HG23 THR 88 2HG2 THR 88 -8.846 -7.271 -18.293
674 H GLN 89 H GLN 89 -8.002 -7.637 -15.368
675 HA GLN 89 HA GLN 89 -5.131 -8.029 -15.026
676 HB2 GLN 89 2HB GLN 89 -5.112 -5.865 -13.966
677 HB3 GLN 89 1HB GLN 89 -6.078 -5.759 -15.431
678 HG2 GLN 89 2HG GLN 89 -8.117 -5.781 -14.161
679 HG3 GLN 89 1HG GLN 89 -7.236 -6.111 -12.671
680 HE21 GLN 89 1HE2 GLN 89 -8.037 -3.699 -15.041
681 HE22 GLN 89 2HE2 GLN 89 -7.510 -2.342 -14.115
682 H LYS 90 H LYS 90 -4.119 -8.041 -12.925
683 HA LYS 90 HA LYS 90 -5.823 -9.147 -10.777
684 HB2 LYS 90 2HB LYS 90 -3.759 -10.171 -9.886
685 HB3 LYS 90 1HB LYS 90 -4.131 -10.721 -11.513
686 HG2 LYS 90 2HG LYS 90 -2.458 -9.035 -12.358
687 HG3 LYS 90 1HG LYS 90 -1.994 -8.766 -10.675
688 HD2 LYS 90 2HD LYS 90 -1.827 -11.371 -12.204
689 HD3 LYS 90 1HD LYS 90 -0.476 -10.358 -11.693
690 HE2 LYS 90 2HE LYS 90 -0.982 -10.787 -9.369
691 HE3 LYS 90 1HE LYS 90 -2.422 -11.699 -9.817
692 HZ1 LYS 90 3HZ LYS 90 -0.983 -13.306 -10.929
693 HZ2 LYS 90 1HZ LYS 90 -0.620 -13.174 -9.283
694 HZ3 LYS 90 2HZ LYS 90 0.384 -12.445 -10.434
695 H ALA 91 H ALA 91 -5.603 -8.329 -8.659
696 HA ALA 91 HA ALA 91 -4.469 -5.601 -8.584
697 HB1 ALA 91 3HB ALA 91 -6.924 -5.759 -8.390
698 HB2 ALA 91 1HB ALA 91 -6.177 -5.066 -6.948
699 HB3 ALA 91 2HB ALA 91 -6.729 -6.741 -6.938
700 H LEU 92 H LEU 92 -2.997 -5.056 -7.077
701 HA LEU 92 HA LEU 92 -1.921 -7.095 -5.341
702 HB2 LEU 92 2HB LEU 92 -0.426 -5.569 -6.505
703 HB3 LEU 92 1HB LEU 92 -1.182 -4.191 -5.728
704 HG LEU 92 HG LEU 92 -0.371 -5.116 -3.513
705 HD11 LEU 92 1HD1 LEU 92 1.238 -6.931 -5.314
706 HD12 LEU 92 2HD1 LEU 92 -0.006 -7.425 -4.166
707 HD13 LEU 92 3HD1 LEU 92 1.496 -6.713 -3.583
708 HD21 LEU 92 3HD2 LEU 92 1.909 -4.285 -3.807
709 HD22 LEU 92 1HD2 LEU 92 0.748 -3.253 -4.640
710 HD23 LEU 92 2HD2 LEU 92 1.733 -4.392 -5.558
711 H TYR 93 H TYR 93 -2.839 -7.554 -3.448
712 HA TYR 93 HA TYR 93 -4.179 -5.438 -1.914
713 HB2 TYR 93 2HB TYR 93 -4.254 -8.451 -1.700
714 HB3 TYR 93 1HB TYR 93 -4.975 -7.391 -0.494
715 HD1 TYR 93 HD1 TYR 93 -5.106 -8.270 -4.112
716 HD2 TYR 93 HD2 TYR 93 -7.146 -6.528 -0.804
717 HE1 TYR 93 HE1 TYR 93 -7.174 -8.180 -5.438
718 HE2 TYR 93 HE2 TYR 93 -9.217 -6.436 -2.124
719 HH TYR 93 HH TYR 93 -9.934 -6.428 -4.441
720 H LEU 94 H LEU 94 -3.572 -4.856 0.137
721 HA LEU 94 HA LEU 94 -0.984 -5.901 1.122
722 HB2 LEU 94 2HB LEU 94 -1.910 -3.030 1.300
723 HB3 LEU 94 1HB LEU 94 -0.330 -3.661 1.724
724 HG LEU 94 HG LEU 94 -1.468 -3.522 -1.079
725 HD11 LEU 94 1HD1 LEU 94 0.186 -1.767 -1.451
726 HD12 LEU 94 2HD1 LEU 94 0.672 -1.851 0.242
727 HD13 LEU 94 3HD1 LEU 94 -0.953 -1.312 -0.183
728 HD21 LEU 94 3HD2 LEU 94 0.046 -5.402 -0.850
729 HD22 LEU 94 1HD2 LEU 94 1.260 -4.365 -0.098
730 HD23 LEU 94 2HD2 LEU 94 0.814 -4.122 -1.785
731 H ARG 95 H ARG 95 -0.770 -6.152 3.351
732 HA ARG 95 HA ARG 95 -2.773 -4.929 5.101
733 HB2 ARG 95 2HB ARG 95 -3.326 -6.939 6.282
734 HB3 ARG 95 1HB ARG 95 -3.591 -7.245 4.571
735 HG2 ARG 95 2HG ARG 95 -1.356 -8.361 4.506
736 HG3 ARG 95 1HG ARG 95 -1.280 -8.186 6.259
737 HD2 ARG 95 2HD ARG 95 -3.228 -9.807 4.633
738 HD3 ARG 95 1HD ARG 95 -2.077 -10.382 5.836
739 HE ARG 95 HE ARG 95 -4.571 -8.920 6.400
740 HH11 ARG 95 1HH1 ARG 95 -1.928 -10.833 7.500
741 HH12 ARG 95 2HH1 ARG 95 -2.723 -11.283 8.966
742 HH21 ARG 95 1HH2 ARG 95 -5.581 -9.491 8.295
743 HH22 ARG 95 2HH2 ARG 95 -4.761 -10.509 9.427
744 H ALA 96 H ALA 96 -2.117 -4.952 7.390
745 HA ALA 96 HA ALA 96 0.613 -4.182 7.631
746 HB1 ALA 96 3HB ALA 96 -1.193 -3.118 8.909
747 HB2 ALA 96 1HB ALA 96 0.088 -3.721 9.960
748 HB3 ALA 96 2HB ALA 96 -1.428 -4.611 9.816
749 H LYS 97 H LYS 97 2.313 -5.117 8.786
750 HA LYS 97 HA LYS 97 2.300 -7.992 8.973
751 HB2 LYS 97 2HB LYS 97 4.309 -6.795 8.220
752 HB3 LYS 97 1HB LYS 97 4.419 -5.976 9.772
753 HG2 LYS 97 2HG LYS 97 6.028 -7.765 9.695
754 HG3 LYS 97 1HG LYS 97 4.777 -8.161 10.872
755 HD2 LYS 97 2HD LYS 97 5.282 -10.137 9.597
756 HD3 LYS 97 1HD LYS 97 3.675 -9.575 9.136
757 HE2 LYS 97 2HE LYS 97 4.854 -10.210 7.143
758 HE3 LYS 97 1HE LYS 97 4.700 -8.457 7.155
759 HZ1 LYS 97 3HZ LYS 97 6.895 -8.959 6.503
760 HZ2 LYS 97 1HZ LYS 97 7.114 -10.065 7.762
761 HZ3 LYS 97 2HZ LYS 97 7.009 -8.416 8.102
762 H LEU 98 H LEU 98 1.250 -8.916 10.620
763 HA LEU 98 HA LEU 98 1.209 -7.678 13.264
764 HB2 LEU 98 2HB LEU 98 -0.159 -10.184 12.261
765 HB3 LEU 98 1HB LEU 98 -0.428 -9.429 13.821
766 HG LEU 98 HG LEU 98 -1.107 -8.219 11.131
767 HD11 LEU 98 1HD1 LEU 98 -2.889 -9.316 13.310
768 HD12 LEU 98 2HD1 LEU 98 -2.599 -10.050 11.732
769 HD13 LEU 98 3HD1 LEU 98 -3.434 -8.501 11.844
770 HD21 LEU 98 3HD2 LEU 98 -2.187 -6.441 12.419
771 HD22 LEU 98 1HD2 LEU 98 -0.456 -6.504 12.744
772 HD23 LEU 98 2HD2 LEU 98 -1.598 -7.157 13.919
773 H GLU 99 H GLU 99 2.074 -8.600 15.119
774 HA GLU 99 HA GLU 99 4.322 -10.392 14.662
775 HB2 GLU 99 2HB GLU 99 3.453 -8.931 17.170
776 HB3 GLU 99 1HB GLU 99 4.973 -9.792 16.963
777 HG2 GLU 99 2HG GLU 99 5.670 -8.224 15.250
778 HG3 GLU 99 1HG GLU 99 4.117 -7.396 15.343
779 H HIS 100 H HIS 100 3.929 -12.541 14.722
780 HA HIS 100 HA HIS 100 2.864 -13.721 17.113
781 HB2 HIS 100 2HB HIS 100 1.088 -15.069 15.859
782 HB3 HIS 100 1HB HIS 100 0.717 -13.386 16.202
783 HD1 HIS 100 HD1 HIS 100 0.341 -11.838 14.238
784 HD2 HIS 100 HD2 HIS 100 1.533 -15.647 13.090
785 HE1 HIS 100 HE1 HIS 100 -0.006 -11.929 11.756
786 HE2 HIS 100 HE2 HIS 100 0.538 -14.295 11.121
787 H HIS 101 H HIS 101 4.366 -15.189 17.486
788 HA HIS 101 HA HIS 101 5.511 -16.762 15.285
789 HB2 HIS 101 2HB HIS 101 6.343 -16.471 18.189
790 HB3 HIS 101 1HB HIS 101 7.169 -17.495 17.016
791 HD1 HIS 101 HD1 HIS 101 6.537 -13.867 17.834
792 HD2 HIS 101 HD2 HIS 101 8.905 -16.166 15.306
793 HE1 HIS 101 HE1 HIS 101 8.176 -12.271 16.810
794 HE2 HIS 101 HE2 HIS 101 9.493 -13.650 15.173
795 H HIS 102 H HIS 102 5.933 -19.158 15.821
796 HA HIS 102 HA HIS 102 3.345 -20.307 16.484
797 HB2 HIS 102 2HB HIS 102 5.883 -21.657 15.530
798 HB3 HIS 102 1HB HIS 102 4.298 -22.412 15.648
799 HD1 HIS 102 HD1 HIS 102 2.708 -22.070 13.715
800 HD2 HIS 102 HD2 HIS 102 6.109 -19.702 13.437
801 HE1 HIS 102 HE1 HIS 102 2.615 -21.024 11.436
802 HE2 HIS 102 HE2 HIS 102 4.729 -19.680 11.251
803 H HIS 103 H HIS 103 6.707 -20.771 17.617
804 HA HIS 103 HA HIS 103 5.791 -22.317 19.909
805 HB2 HIS 103 2HB HIS 103 8.555 -21.456 19.026
806 HB3 HIS 103 1HB HIS 103 8.240 -22.413 20.470
807 HD1 HIS 103 HD1 HIS 103 9.980 -23.937 18.853
808 HD2 HIS 103 HD2 HIS 103 5.940 -23.814 17.885
809 HE1 HIS 103 HE1 HIS 103 9.568 -25.951 17.417
810 HE2 HIS 103 HE2 HIS 103 7.101 -25.933 16.963
811 H HIS 104 H HIS 104 4.934 -21.234 21.587
812 HA HIS 104 HA HIS 104 6.475 -19.420 23.115
813 HB2 HIS 104 2HB HIS 104 5.810 -17.865 21.275
814 HB3 HIS 104 1HB HIS 104 4.122 -18.142 21.693
815 HD1 HIS 104 HD1 HIS 104 3.176 -16.837 23.656
816 HD2 HIS 104 HD2 HIS 104 7.281 -16.362 23.219
817 HE1 HIS 104 HE1 HIS 104 3.802 -14.964 25.201
818 HE2 HIS 104 HE2 HIS 104 6.303 -14.779 25.017
819 H HIS 105 H HIS 105 5.940 -20.174 25.063
820 HA HIS 105 HA HIS 105 3.079 -20.558 25.722
821 HB2 HIS 105 2HB HIS 105 4.367 -22.664 25.760
822 HB3 HIS 105 1HB HIS 105 5.476 -21.966 26.937
823 HD1 HIS 105 HD1 HIS 105 4.564 -21.613 29.353
824 HD2 HIS 105 HD2 HIS 105 1.953 -23.603 26.810
825 HE1 HIS 105 HE1 HIS 105 2.817 -22.620 30.840
826 HE2 HIS 105 HE2 HIS 105 1.168 -23.683 29.274
Start of MODEL 15
1 H1 MET 1 1H MET 1 21.035 -25.962 12.033
2 H2 MET 1 2H MET 1 22.084 -25.530 13.286
3 H3 MET 1 3H MET 1 22.707 -26.110 11.826
4 HA MET 1 HA MET 1 22.946 -23.709 12.064
5 HB2 MET 1 2HB MET 1 21.911 -23.133 9.827
6 HB3 MET 1 1HB MET 1 22.971 -24.534 9.844
7 HG2 MET 1 2HG MET 1 21.071 -26.025 9.821
8 HG3 MET 1 1HG MET 1 19.961 -24.660 9.943
9 HE1 MET 1 3HE MET 1 19.477 -26.091 6.280
10 HE2 MET 1 1HE MET 1 18.680 -25.761 7.819
11 HE3 MET 1 2HE MET 1 19.901 -27.029 7.712
12 H ASP 2 H ASP 2 22.006 -22.627 13.778
13 HA ASP 2 HA ASP 2 19.374 -21.452 13.186
14 HB2 ASP 2 2HB ASP 2 18.912 -21.464 15.681
15 HB3 ASP 2 1HB ASP 2 18.841 -23.025 14.874
16 H GLN 3 H GLN 3 22.514 -21.097 14.760
17 HA GLN 3 HA GLN 3 22.268 -18.424 15.561
18 HB2 GLN 3 2HB GLN 3 24.711 -18.313 15.528
19 HB3 GLN 3 1HB GLN 3 24.166 -19.810 16.264
20 HG2 GLN 3 2HG GLN 3 25.074 -19.615 13.399
21 HG3 GLN 3 1HG GLN 3 26.160 -19.974 14.738
22 HE21 GLN 3 1HE2 GLN 3 25.450 -21.591 12.415
23 HE22 GLN 3 2HE2 GLN 3 24.845 -23.081 13.054
24 H LYS 4 H LYS 4 22.118 -16.564 14.459
25 HA LYS 4 HA LYS 4 21.837 -16.650 11.613
26 HB2 LYS 4 2HB LYS 4 20.438 -15.198 13.035
27 HB3 LYS 4 1HB LYS 4 21.860 -14.257 13.471
28 HG2 LYS 4 2HG LYS 4 22.125 -13.528 11.173
29 HG3 LYS 4 1HG LYS 4 20.777 -14.546 10.668
30 HD2 LYS 4 2HD LYS 4 19.913 -12.343 10.832
31 HD3 LYS 4 1HD LYS 4 19.322 -13.208 12.249
32 HE2 LYS 4 2HE LYS 4 21.729 -11.376 12.236
33 HE3 LYS 4 1HE LYS 4 20.109 -10.890 12.728
34 HZ1 LYS 4 3HZ LYS 4 21.255 -11.405 14.689
35 HZ2 LYS 4 1HZ LYS 4 21.909 -12.829 14.055
36 HZ3 LYS 4 2HZ LYS 4 20.260 -12.740 14.414
37 H SER 5 H SER 5 23.543 -16.763 10.301
38 HA SER 5 HA SER 5 26.139 -15.778 10.906
39 HB2 SER 5 2HB SER 5 24.977 -16.547 8.210
40 HB3 SER 5 1HB SER 5 26.690 -16.323 8.564
41 HG SER 5 HG SER 5 26.596 -18.384 8.984
42 H SER 6 H SER 6 25.618 -13.590 11.535
43 HA SER 6 HA SER 6 24.529 -11.708 9.675
44 HB2 SER 6 2HB SER 6 26.100 -11.157 12.213
45 HB3 SER 6 1HB SER 6 25.062 -10.017 11.358
46 HG SER 6 HG SER 6 24.337 -11.553 13.292
47 H SER 7 H SER 7 25.685 -11.424 7.816
48 HA SER 7 HA SER 7 28.527 -11.346 7.690
49 HB2 SER 7 2HB SER 7 27.131 -11.937 5.734
50 HB3 SER 7 1HB SER 7 26.530 -10.281 5.672
51 HG SER 7 HG SER 7 28.284 -9.714 4.669
52 HA PRO 8 HA PRO 8 28.851 -7.137 9.265
53 HB2 PRO 8 2HB PRO 8 31.558 -7.008 9.345
54 HB3 PRO 8 1HB PRO 8 30.611 -7.916 10.530
55 HG2 PRO 8 2HG PRO 8 32.067 -8.913 8.105
56 HG3 PRO 8 1HG PRO 8 32.019 -9.599 9.741
57 HD2 PRO 8 2HD PRO 8 30.501 -10.552 7.695
58 HD3 PRO 8 1HD PRO 8 29.975 -10.612 9.390
59 H GLN 9 H GLN 9 29.447 -5.082 8.521
60 HA GLN 9 HA GLN 9 30.394 -4.906 5.727
61 HB2 GLN 9 2HB GLN 9 28.113 -3.400 7.020
62 HB3 GLN 9 1HB GLN 9 28.833 -2.924 5.490
63 HG2 GLN 9 2HG GLN 9 27.600 -5.630 5.964
64 HG3 GLN 9 1HG GLN 9 26.704 -4.246 5.344
65 HE21 GLN 9 1HE2 GLN 9 26.266 -5.187 3.378
66 HE22 GLN 9 2HE2 GLN 9 27.476 -5.459 2.174
67 HA PRO 10 HA PRO 10 33.159 -2.150 8.195
68 HB2 PRO 10 2HB PRO 10 35.046 -2.755 6.011
69 HB3 PRO 10 1HB PRO 10 35.245 -2.965 7.753
70 HG2 PRO 10 2HG PRO 10 34.957 -5.071 6.096
71 HG3 PRO 10 1HG PRO 10 34.296 -5.076 7.744
72 HD2 PRO 10 2HD PRO 10 32.883 -4.587 5.138
73 HD3 PRO 10 1HD PRO 10 32.366 -5.558 6.535
74 H ALA 11 H ALA 11 33.362 0.012 7.859
75 HA ALA 11 HA ALA 11 33.320 2.067 6.893
76 HB1 ALA 11 3HB ALA 11 35.260 1.235 5.666
77 HB2 ALA 11 1HB ALA 11 34.303 2.334 4.673
78 HB3 ALA 11 2HB ALA 11 34.203 0.592 4.409
79 H ALA 12 H ALA 12 30.864 0.437 6.873
80 HA ALA 12 HA ALA 12 29.384 0.885 4.504
81 HB1 ALA 12 3HB ALA 12 28.679 -0.712 6.230
82 HB2 ALA 12 1HB ALA 12 27.400 0.442 5.851
83 HB3 ALA 12 2HB ALA 12 28.344 0.626 7.329
84 H GLN 13 H GLN 13 29.423 2.918 3.685
85 HA GLN 13 HA GLN 13 29.447 5.275 5.298
86 HB2 GLN 13 2HB GLN 13 29.017 5.027 2.311
87 HB3 GLN 13 1HB GLN 13 29.472 6.488 3.177
88 HG2 GLN 13 2HG GLN 13 31.130 3.981 2.951
89 HG3 GLN 13 1HG GLN 13 31.376 5.468 2.039
90 HE21 GLN 13 1HE2 GLN 13 33.143 4.049 3.907
91 HE22 GLN 13 2HE2 GLN 13 33.575 5.210 5.110
92 H ALA 14 H ALA 14 27.871 6.711 5.773
93 HA ALA 14 HA ALA 14 25.110 6.034 5.005
94 HB1 ALA 14 3HB ALA 14 26.121 7.756 7.271
95 HB2 ALA 14 1HB ALA 14 25.547 6.092 7.407
96 HB3 ALA 14 2HB ALA 14 24.430 7.376 6.943
97 HA PRO 15 HA PRO 15 25.043 9.674 2.348
98 HB2 PRO 15 2HB PRO 15 22.100 9.496 2.681
99 HB3 PRO 15 1HB PRO 15 23.070 9.436 1.207
100 HG2 PRO 15 2HG PRO 15 21.894 7.237 2.174
101 HG3 PRO 15 1HG PRO 15 23.500 7.166 1.422
102 HD2 PRO 15 2HD PRO 15 22.771 7.162 4.336
103 HD3 PRO 15 1HD PRO 15 23.984 6.186 3.478
104 H GLU 16 H GLU 16 24.104 11.905 2.374
105 HA GLU 16 HA GLU 16 24.313 13.076 4.969
106 HB2 GLU 16 2HB GLU 16 25.029 14.194 2.860
107 HB3 GLU 16 1HB GLU 16 23.342 14.342 2.392
108 HG2 GLU 16 2HG GLU 16 24.104 16.438 3.270
109 HG3 GLU 16 1HG GLU 16 22.942 15.733 4.396
110 H THR 17 H THR 17 21.590 12.573 2.745
111 HA THR 17 HA THR 17 19.685 13.488 4.783
112 HB THR 17 HB THR 17 19.207 12.707 1.889
113 HG1 THR 17 HG1 THR 17 18.968 15.320 2.966
114 HG21 THR 17 3HG2 THR 17 16.980 13.699 2.180
115 HG22 THR 17 1HG2 THR 17 17.322 13.976 3.886
116 HG23 THR 17 2HG2 THR 17 17.209 12.330 3.266
117 H LYS 18 H LYS 18 18.985 11.990 6.199
118 HA LYS 18 HA LYS 18 18.360 9.281 5.184
119 HB2 LYS 18 2HB LYS 18 20.229 9.187 6.739
120 HB3 LYS 18 1HB LYS 18 19.314 10.087 7.942
121 HG2 LYS 18 2HG LYS 18 17.720 8.240 8.126
122 HG3 LYS 18 1HG LYS 18 18.623 7.335 6.911
123 HD2 LYS 18 2HD LYS 18 19.764 8.261 9.555
124 HD3 LYS 18 1HD LYS 18 19.113 6.647 9.261
125 HE2 LYS 18 2HE LYS 18 20.804 6.251 7.555
126 HE3 LYS 18 1HE LYS 18 21.421 7.889 7.755
127 HZ1 LYS 18 3HZ LYS 18 22.746 6.213 8.919
128 HZ2 LYS 18 1HZ LYS 18 21.409 5.817 9.877
129 HZ3 LYS 18 2HZ LYS 18 22.093 7.357 9.984
130 H GLN 19 H GLN 19 16.230 9.070 4.981
131 HA GLN 19 HA GLN 19 14.422 10.381 6.901
132 HB2 GLN 19 2HB GLN 19 13.907 9.206 4.159
133 HB3 GLN 19 1HB GLN 19 12.648 9.847 5.204
134 HG2 GLN 19 2HG GLN 19 14.984 11.439 4.164
135 HG3 GLN 19 1HG GLN 19 13.379 11.410 3.435
136 HE21 GLN 19 1HE2 GLN 19 14.857 13.648 4.570
137 HE22 GLN 19 2HE2 GLN 19 13.855 14.302 5.811
138 H ALA 20 H ALA 20 12.664 9.197 7.822
139 HA ALA 20 HA ALA 20 13.034 6.262 7.882
140 HB1 ALA 20 3HB ALA 20 12.367 6.272 10.227
141 HB2 ALA 20 1HB ALA 20 12.179 8.025 10.186
142 HB3 ALA 20 2HB ALA 20 13.776 7.304 9.983
143 H PHE 21 H PHE 21 11.243 5.015 7.599
144 HA PHE 21 HA PHE 21 8.922 6.128 6.437
145 HB2 PHE 21 2HB PHE 21 9.349 3.350 7.574
146 HB3 PHE 21 1HB PHE 21 8.019 3.824 6.523
147 HD1 PHE 21 HD1 PHE 21 8.705 4.842 4.212
148 HD2 PHE 21 HD2 PHE 21 11.268 2.442 6.629
149 HE1 PHE 21 HE1 PHE 21 10.059 4.298 2.234
150 HE2 PHE 21 HE2 PHE 21 12.623 1.896 4.650
151 HZ PHE 21 HZ PHE 21 12.021 2.824 2.450
152 HA PRO 22 HA PRO 22 6.833 6.933 10.404
153 HB2 PRO 22 2HB PRO 22 4.914 8.575 9.444
154 HB3 PRO 22 1HB PRO 22 6.578 9.119 9.700
155 HG2 PRO 22 2HG PRO 22 5.216 8.310 7.162
156 HG3 PRO 22 1HG PRO 22 6.349 9.642 7.448
157 HD2 PRO 22 2HD PRO 22 7.053 7.227 6.327
158 HD3 PRO 22 1HD PRO 22 8.184 8.291 7.186
159 H ARG 23 H ARG 23 5.958 4.917 10.818
160 HA ARG 23 HA ARG 23 3.900 3.803 9.122
161 HB2 ARG 23 2HB ARG 23 3.922 1.917 10.769
162 HB3 ARG 23 1HB ARG 23 5.473 2.253 10.012
163 HG2 ARG 23 2HG ARG 23 6.207 3.437 12.024
164 HG3 ARG 23 1HG ARG 23 4.647 3.113 12.785
165 HD2 ARG 23 2HD ARG 23 5.061 0.741 12.752
166 HD3 ARG 23 1HD ARG 23 6.537 0.968 11.812
167 HE ARG 23 HE ARG 23 6.774 2.428 14.182
168 HH11 ARG 23 1HH1 ARG 23 6.546 -0.873 13.201
169 HH12 ARG 23 2HH1 ARG 23 7.531 -1.440 14.499
170 HH21 ARG 23 1HH2 ARG 23 8.023 1.668 15.860
171 HH22 ARG 23 2HH2 ARG 23 8.354 -0.024 15.980
172 H LYS 24 H LYS 24 3.963 5.692 12.022
173 HA LYS 24 HA LYS 24 1.576 4.993 13.260
174 HB2 LYS 24 2HB LYS 24 2.792 7.756 12.998
175 HB3 LYS 24 1HB LYS 24 1.531 7.315 14.143
176 HG2 LYS 24 2HG LYS 24 3.072 5.668 15.158
177 HG3 LYS 24 1HG LYS 24 4.339 6.214 14.061
178 HD2 LYS 24 2HD LYS 24 2.928 7.960 16.091
179 HD3 LYS 24 1HD LYS 24 4.501 7.205 16.334
180 HE2 LYS 24 2HE LYS 24 5.085 9.346 15.668
181 HE3 LYS 24 1HE LYS 24 5.160 8.460 14.149
182 HZ1 LYS 24 3HZ LYS 24 2.939 10.194 15.076
183 HZ2 LYS 24 1HZ LYS 24 2.905 9.278 13.658
184 HZ3 LYS 24 2HZ LYS 24 4.028 10.528 13.827
185 H PHE 25 H PHE 25 2.053 6.942 10.370
186 HA PHE 25 HA PHE 25 -0.821 7.450 10.127
187 HB2 PHE 25 2HB PHE 25 1.518 8.293 8.397
188 HB3 PHE 25 1HB PHE 25 -0.158 8.709 8.068
189 HD1 PHE 25 HD1 PHE 25 -1.387 10.208 9.623
190 HD2 PHE 25 HD2 PHE 25 2.799 9.492 10.010
191 HE1 PHE 25 HE1 PHE 25 -1.172 12.223 11.015
192 HE2 PHE 25 HE2 PHE 25 3.011 11.505 11.407
193 HZ PHE 25 HZ PHE 25 1.027 12.871 11.911
194 H VAL 26 H VAL 26 1.786 5.794 8.334
195 HA VAL 26 HA VAL 26 0.268 5.043 6.112
196 HB VAL 26 HB VAL 26 2.680 3.595 7.223
197 HG11 VAL 26 1HG1 VAL 26 1.480 3.607 4.448
198 HG12 VAL 26 2HG1 VAL 26 1.483 2.256 5.581
199 HG13 VAL 26 3HG1 VAL 26 3.001 2.837 4.901
200 HG21 VAL 26 3HG2 VAL 26 3.126 5.981 6.848
201 HG22 VAL 26 1HG2 VAL 26 2.531 5.838 5.195
202 HG23 VAL 26 2HG2 VAL 26 3.992 4.979 5.683
203 H LEU 27 H LEU 27 1.065 3.030 8.990
204 HA LEU 27 HA LEU 27 -0.426 0.785 8.116
205 HB2 LEU 27 2HB LEU 27 0.378 1.603 10.912
206 HB3 LEU 27 1HB LEU 27 -0.325 0.052 10.500
207 HG LEU 27 HG LEU 27 2.331 1.101 9.505
208 HD11 LEU 27 1HD1 LEU 27 3.290 -0.698 10.874
209 HD12 LEU 27 2HD1 LEU 27 1.683 -1.071 11.500
210 HD13 LEU 27 3HD1 LEU 27 2.427 0.490 11.851
211 HD21 LEU 27 3HD2 LEU 27 1.259 -0.300 7.834
212 HD22 LEU 27 1HD2 LEU 27 0.973 -1.555 9.040
213 HD23 LEU 27 2HD2 LEU 27 2.621 -1.149 8.562
214 H ALA 28 H ALA 28 -1.344 3.680 9.869
215 HA ALA 28 HA ALA 28 -3.938 2.849 10.672
216 HB1 ALA 28 3HB ALA 28 -2.907 5.635 10.107
217 HB2 ALA 28 1HB ALA 28 -2.846 4.797 11.657
218 HB3 ALA 28 2HB ALA 28 -4.402 5.245 10.959
219 H ALA 29 H ALA 29 -2.733 4.521 7.773
220 HA ALA 29 HA ALA 29 -5.232 4.771 6.459
221 HB1 ALA 29 3HB ALA 29 -2.470 4.576 5.243
222 HB2 ALA 29 1HB ALA 29 -3.244 6.056 5.809
223 HB3 ALA 29 2HB ALA 29 -3.921 5.178 4.438
224 H LEU 30 H LEU 30 -2.765 2.262 6.460
225 HA LEU 30 HA LEU 30 -3.674 0.623 4.408
226 HB2 LEU 30 2HB LEU 30 -1.509 0.379 5.534
227 HB3 LEU 30 1HB LEU 30 -2.316 -0.149 6.998
228 HG LEU 30 HG LEU 30 -3.111 -2.170 5.828
229 HD11 LEU 30 1HD1 LEU 30 -3.217 -1.275 3.558
230 HD12 LEU 30 2HD1 LEU 30 -2.238 -2.738 3.621
231 HD13 LEU 30 3HD1 LEU 30 -1.458 -1.160 3.514
232 HD21 LEU 30 3HD2 LEU 30 -0.127 -1.744 5.633
233 HD22 LEU 30 1HD2 LEU 30 -0.953 -3.302 5.677
234 HD23 LEU 30 2HD2 LEU 30 -1.010 -2.234 7.079
235 H GLU 31 H GLU 31 -4.370 0.238 7.907
236 HA GLU 31 HA GLU 31 -6.187 -1.887 7.622
237 HB2 GLU 31 2HB GLU 31 -6.953 -1.289 9.917
238 HB3 GLU 31 1HB GLU 31 -5.204 -1.414 9.774
239 HG2 GLU 31 2HG GLU 31 -5.030 1.021 9.668
240 HG3 GLU 31 1HG GLU 31 -6.784 1.154 9.779
241 H GLN 32 H GLN 32 -6.736 1.612 7.578
242 HA GLN 32 HA GLN 32 -9.594 1.422 7.515
243 HB2 GLN 32 2HB GLN 32 -7.734 3.697 6.791
244 HB3 GLN 32 1HB GLN 32 -9.487 3.838 6.860
245 HG2 GLN 32 2HG GLN 32 -9.441 3.251 9.237
246 HG3 GLN 32 1HG GLN 32 -7.684 3.118 9.169
247 HE21 GLN 32 1HE2 GLN 32 -6.454 5.008 8.936
248 HE22 GLN 32 2HE2 GLN 32 -7.112 6.570 9.271
249 H SER 33 H SER 33 -7.128 1.157 5.109
250 HA SER 33 HA SER 33 -9.027 1.523 2.900
251 HB2 SER 33 2HB SER 33 -6.047 0.967 2.871
252 HB3 SER 33 1HB SER 33 -7.037 1.260 1.442
253 HG SER 33 HG SER 33 -6.510 3.058 3.574
254 H SER 34 H SER 34 -8.535 -0.884 4.938
255 HA SER 34 HA SER 34 -8.124 -3.085 3.088
256 HB2 SER 34 2HB SER 34 -8.756 -3.086 6.053
257 HB3 SER 34 1HB SER 34 -8.361 -4.518 5.103
258 HG SER 34 HG SER 34 -6.598 -2.330 5.096
259 H ASP 35 H ASP 35 -9.640 -4.554 2.412
260 HA ASP 35 HA ASP 35 -12.435 -3.888 2.615
261 HB2 ASP 35 2HB ASP 35 -11.091 -6.351 1.459
262 HB3 ASP 35 1HB ASP 35 -12.786 -5.921 1.257
263 H ASP 36 H ASP 36 -13.985 -5.841 3.138
264 HA ASP 36 HA ASP 36 -13.786 -6.452 5.864
265 HB2 ASP 36 2HB ASP 36 -15.900 -6.389 4.569
266 HB3 ASP 36 1HB ASP 36 -15.435 -7.884 3.764
267 H ALA 37 H ALA 37 -12.364 -8.039 3.150
268 HA ALA 37 HA ALA 37 -11.995 -10.610 4.384
269 HB1 ALA 37 3HB ALA 37 -12.103 -10.348 1.947
270 HB2 ALA 37 1HB ALA 37 -10.599 -11.119 2.457
271 HB3 ALA 37 2HB ALA 37 -10.604 -9.420 1.984
272 H GLY 38 H GLY 38 -10.457 -7.610 4.779
273 HA2 GLY 38 2HA GLY 38 -8.852 -7.241 6.488
274 HA3 GLY 38 1HA GLY 38 -8.290 -8.891 6.300
275 H TRP 39 H TRP 39 -8.539 -7.853 3.226
276 HA TRP 39 HA TRP 39 -5.713 -7.028 3.144
277 HB2 TRP 39 2HB TRP 39 -7.487 -8.276 1.037
278 HB3 TRP 39 1HB TRP 39 -5.866 -7.673 0.707
279 HD1 TRP 39 HD1 TRP 39 -7.690 -10.524 2.498
280 HE1 TRP 39 HE1 TRP 39 -5.992 -12.388 3.001
281 HE3 TRP 39 HE3 TRP 39 -3.404 -8.097 1.140
282 HZ2 TRP 39 HZ2 TRP 39 -3.197 -12.775 2.845
283 HZ3 TRP 39 HZ3 TRP 39 -1.259 -9.280 1.346
284 HH2 TRP 39 HH2 TRP 39 -1.158 -11.574 2.182
285 H ALA 40 H ALA 40 -5.064 -5.157 2.189
286 HA ALA 40 HA ALA 40 -7.169 -3.272 1.343
287 HB1 ALA 40 3HB ALA 40 -5.605 -1.494 1.945
288 HB2 ALA 40 1HB ALA 40 -4.390 -2.697 2.373
289 HB3 ALA 40 2HB ALA 40 -5.881 -2.581 3.307
290 H ASN 41 H ASN 41 -7.322 -3.024 -0.803
291 HA ASN 41 HA ASN 41 -5.371 -3.855 -2.667
292 HB2 ASN 41 2HB ASN 41 -7.815 -3.649 -3.139
293 HB3 ASN 41 1HB ASN 41 -7.648 -1.900 -3.104
294 HD21 ASN 41 1HD2 ASN 41 -8.439 -3.847 -5.231
295 HD22 ASN 41 2HD2 ASN 41 -7.426 -3.453 -6.573
296 H LEU 42 H LEU 42 -3.724 -2.806 -3.671
297 HA LEU 42 HA LEU 42 -2.394 -0.686 -2.523
298 HB2 LEU 42 2HB LEU 42 -1.412 -2.266 -4.137
299 HB3 LEU 42 1HB LEU 42 -2.337 -1.521 -5.428
300 HG LEU 42 HG LEU 42 -1.093 0.609 -5.039
301 HD11 LEU 42 1HD1 LEU 42 0.966 0.557 -3.709
302 HD12 LEU 42 2HD1 LEU 42 0.572 -1.072 -3.160
303 HD13 LEU 42 3HD1 LEU 42 -0.461 0.284 -2.711
304 HD21 LEU 42 3HD2 LEU 42 0.972 -0.116 -6.103
305 HD22 LEU 42 1HD2 LEU 42 -0.409 -0.971 -6.789
306 HD23 LEU 42 2HD2 LEU 42 0.651 -1.786 -5.637
307 H GLY 43 H GLY 43 -4.839 -0.577 -5.078
308 HA2 GLY 43 2HA GLY 43 -4.672 2.135 -5.781
309 HA3 GLY 43 1HA GLY 43 -6.129 1.155 -5.873
310 H ASN 44 H ASN 44 -6.568 0.585 -3.199
311 HA ASN 44 HA ASN 44 -7.710 3.018 -2.230
312 HB2 ASN 44 2HB ASN 44 -7.318 0.448 -0.675
313 HB3 ASN 44 1HB ASN 44 -8.489 1.721 -0.347
314 HD21 ASN 44 1HD2 ASN 44 -9.012 -1.046 -0.731
315 HD22 ASN 44 2HD2 ASN 44 -10.050 -1.177 -2.106
316 H PHE 45 H PHE 45 -4.993 0.994 -1.207
317 HA PHE 45 HA PHE 45 -4.185 2.292 1.089
318 HB2 PHE 45 2HB PHE 45 -3.243 0.168 0.380
319 HB3 PHE 45 1HB PHE 45 -2.510 0.924 -1.028
320 HD1 PHE 45 HD1 PHE 45 -2.495 1.148 2.701
321 HD2 PHE 45 HD2 PHE 45 -0.281 1.564 -0.918
322 HE1 PHE 45 HE1 PHE 45 -0.442 1.535 4.001
323 HE2 PHE 45 HE2 PHE 45 1.775 1.950 0.381
324 HZ PHE 45 HZ PHE 45 1.693 1.934 2.841
325 H GLY 46 H GLY 46 -2.786 2.857 -2.174
326 HA2 GLY 46 2HA GLY 46 -1.206 5.063 -1.427
327 HA3 GLY 46 1HA GLY 46 -1.727 4.695 -3.065
328 H ASN 47 H ASN 47 -4.558 4.918 -2.509
329 HA ASN 47 HA ASN 47 -4.904 7.682 -3.009
330 HB2 ASN 47 2HB ASN 47 -6.382 5.823 -3.835
331 HB3 ASN 47 1HB ASN 47 -7.027 5.675 -2.206
332 HD21 ASN 47 1HD2 ASN 47 -8.315 6.375 -4.753
333 HD22 ASN 47 2HD2 ASN 47 -9.092 7.891 -4.474
334 H TYR 48 H TYR 48 -5.869 5.704 -0.176
335 HA TYR 48 HA TYR 48 -6.729 7.998 1.310
336 HB2 TYR 48 2HB TYR 48 -7.649 5.654 1.562
337 HB3 TYR 48 1HB TYR 48 -6.169 5.240 2.421
338 HD1 TYR 48 HD2 TYR 48 -9.018 7.637 2.483
339 HD2 TYR 48 HD1 TYR 48 -6.045 5.601 4.753
340 HE1 TYR 48 HE2 TYR 48 -10.011 8.512 4.557
341 HE2 TYR 48 HE1 TYR 48 -7.027 6.477 6.830
342 HH TYR 48 HH TYR 48 -8.417 8.358 7.561
343 H LEU 49 H LEU 49 -3.767 6.057 1.264
344 HA LEU 49 HA LEU 49 -2.522 7.053 3.560
345 HB2 LEU 49 2HB LEU 49 -1.589 5.182 2.360
346 HB3 LEU 49 1HB LEU 49 -1.330 6.164 0.932
347 HG LEU 49 HG LEU 49 0.384 7.469 2.112
348 HD11 LEU 49 1HD1 LEU 49 -0.127 5.587 4.416
349 HD12 LEU 49 2HD1 LEU 49 -0.480 7.317 4.375
350 HD13 LEU 49 3HD1 LEU 49 1.190 6.757 4.314
351 HD21 LEU 49 3HD2 LEU 49 1.063 5.499 0.843
352 HD22 LEU 49 1HD2 LEU 49 0.843 4.486 2.271
353 HD23 LEU 49 2HD2 LEU 49 2.095 5.729 2.254
354 H ASN 50 H ASN 50 -2.512 8.331 0.249
355 HA ASN 50 HA ASN 50 -0.742 10.471 0.726
356 HB2 ASN 50 2HB ASN 50 -1.379 9.551 -1.521
357 HB3 ASN 50 1HB ASN 50 -2.937 10.355 -1.355
358 HD21 ASN 50 1HD2 ASN 50 0.522 10.875 -1.623
359 HD22 ASN 50 2HD2 ASN 50 0.417 12.495 -2.207
360 H LYS 51 H LYS 51 -3.996 10.048 1.714
361 HA LYS 51 HA LYS 51 -4.636 12.847 2.005
362 HB2 LYS 51 2HB LYS 51 -5.908 10.417 3.291
363 HB3 LYS 51 1HB LYS 51 -6.558 12.050 3.335
364 HG2 LYS 51 2HG LYS 51 -6.785 12.004 0.880
365 HG3 LYS 51 1HG LYS 51 -6.189 10.343 0.877
366 HD2 LYS 51 2HD LYS 51 -8.615 10.362 0.749
367 HD3 LYS 51 1HD LYS 51 -8.096 9.673 2.289
368 HE2 LYS 51 2HE LYS 51 -9.991 11.204 2.579
369 HE3 LYS 51 1HE LYS 51 -8.554 11.793 3.411
370 HZ1 LYS 51 3HZ LYS 51 -9.719 13.549 2.216
371 HZ2 LYS 51 1HZ LYS 51 -9.493 12.731 0.755
372 HZ3 LYS 51 2HZ LYS 51 -8.160 13.328 1.608
373 H LEU 52 H LEU 52 -3.471 10.262 4.152
374 HA LEU 52 HA LEU 52 -3.393 11.974 6.468
375 HB2 LEU 52 2HB LEU 52 -2.106 9.269 6.045
376 HB3 LEU 52 1HB LEU 52 -2.318 10.080 7.586
377 HG LEU 52 HG LEU 52 -4.482 8.935 5.814
378 HD11 LEU 52 1HD1 LEU 52 -4.931 7.487 7.727
379 HD12 LEU 52 2HD1 LEU 52 -3.599 8.233 8.614
380 HD13 LEU 52 3HD1 LEU 52 -3.274 7.298 7.154
381 HD21 LEU 52 3HD2 LEU 52 -6.079 9.665 7.534
382 HD22 LEU 52 1HD2 LEU 52 -5.289 11.031 6.744
383 HD23 LEU 52 2HD2 LEU 52 -4.782 10.533 8.360
384 H GLN 53 H GLN 53 -1.030 10.745 4.148
385 HA GLN 53 HA GLN 53 0.846 12.837 5.018
386 HB2 GLN 53 2HB GLN 53 1.512 9.928 4.544
387 HB3 GLN 53 1HB GLN 53 2.732 11.192 4.546
388 HG2 GLN 53 2HG GLN 53 0.911 10.612 6.872
389 HG3 GLN 53 1HG GLN 53 2.520 9.921 6.682
390 HE21 GLN 53 1HE2 GLN 53 0.705 12.787 7.389
391 HE22 GLN 53 2HE2 GLN 53 2.039 13.739 7.932
392 HA PRO 54 HA PRO 54 0.209 13.025 0.407
393 HB2 PRO 54 2HB PRO 54 0.223 15.763 0.310
394 HB3 PRO 54 1HB PRO 54 -1.236 14.800 0.573
395 HG2 PRO 54 2HG PRO 54 0.489 16.208 2.578
396 HG3 PRO 54 1HG PRO 54 -1.280 16.126 2.483
397 HD2 PRO 54 2HD PRO 54 0.140 14.593 4.197
398 HD3 PRO 54 1HD PRO 54 -1.359 14.016 3.437
399 H ASP 55 H ASP 55 2.519 14.213 2.661
400 HA ASP 55 HA ASP 55 4.468 15.083 0.714
401 HB2 ASP 55 2HB ASP 55 4.282 16.100 2.974
402 HB3 ASP 55 1HB ASP 55 4.755 14.565 3.691
403 H PHE 56 H PHE 56 3.483 12.069 1.963
404 HA PHE 56 HA PHE 56 6.127 10.838 1.821
405 HB2 PHE 56 2HB PHE 56 4.638 10.254 3.695
406 HB3 PHE 56 1HB PHE 56 3.446 9.633 2.560
407 HD1 PHE 56 HD1 PHE 56 6.930 9.128 3.752
408 HD2 PHE 56 HD2 PHE 56 3.528 7.396 1.856
409 HE1 PHE 56 HE1 PHE 56 7.999 6.916 3.860
410 HE2 PHE 56 HE2 PHE 56 4.597 5.181 1.961
411 HZ PHE 56 HZ PHE 56 6.835 4.940 2.965
412 H ASP 57 H ASP 57 6.717 10.661 -0.292
413 HA ASP 57 HA ASP 57 5.098 8.825 -1.933
414 HB2 ASP 57 2HB ASP 57 4.982 11.097 -2.881
415 HB3 ASP 57 1HB ASP 57 6.744 11.143 -2.975
416 H SER 58 H SER 58 6.188 7.262 -3.102
417 HA SER 58 HA SER 58 8.378 6.045 -1.947
418 HB2 SER 58 2HB SER 58 8.497 4.641 -3.955
419 HB3 SER 58 1HB SER 58 6.820 4.909 -3.482
420 HG SER 58 HG SER 58 8.249 5.936 -5.678
421 H ARG 59 H ARG 59 8.407 8.525 -4.451
422 HA ARG 59 HA ARG 59 10.973 8.110 -5.492
423 HB2 ARG 59 2HB ARG 59 9.323 10.623 -5.233
424 HB3 ARG 59 1HB ARG 59 10.864 10.586 -6.079
425 HG2 ARG 59 2HG ARG 59 8.444 8.925 -6.788
426 HG3 ARG 59 1HG ARG 59 8.954 10.401 -7.611
427 HD2 ARG 59 2HD ARG 59 10.462 7.789 -7.448
428 HD3 ARG 59 1HD ARG 59 9.698 8.488 -8.877
429 HE ARG 59 HE ARG 59 11.522 10.355 -7.961
430 HH11 ARG 59 1HH1 ARG 59 11.614 7.144 -9.212
431 HH12 ARG 59 2HH1 ARG 59 13.207 7.329 -9.854
432 HH21 ARG 59 1HH2 ARG 59 13.571 10.558 -8.775
433 HH22 ARG 59 2HH2 ARG 59 14.304 9.221 -9.591
434 H LEU 60 H LEU 60 10.024 9.608 -2.487
435 HA LEU 60 HA LEU 60 12.320 11.138 -1.949
436 HB2 LEU 60 2HB LEU 60 10.519 9.699 0.007
437 HB3 LEU 60 1HB LEU 60 11.651 10.973 0.417
438 HG LEU 60 HG LEU 60 9.222 11.291 -1.356
439 HD11 LEU 60 1HD1 LEU 60 9.740 12.239 1.462
440 HD12 LEU 60 2HD1 LEU 60 8.631 10.954 0.981
441 HD13 LEU 60 3HD1 LEU 60 8.318 12.617 0.488
442 HD21 LEU 60 3HD2 LEU 60 11.217 13.340 -0.367
443 HD22 LEU 60 1HD2 LEU 60 9.728 13.699 -1.242
444 HD23 LEU 60 2HD2 LEU 60 11.018 12.796 -2.034
445 H TYR 61 H TYR 61 11.711 7.697 -1.553
446 HA TYR 61 HA TYR 61 14.300 7.344 -0.199
447 HB2 TYR 61 2HB TYR 61 11.947 5.460 -0.492
448 HB3 TYR 61 1HB TYR 61 13.455 5.055 0.325
449 HD1 TYR 61 HD1 TYR 61 10.419 7.159 0.484
450 HD2 TYR 61 HD2 TYR 61 13.920 5.865 2.540
451 HE1 TYR 61 HE1 TYR 61 9.547 8.122 2.571
452 HE2 TYR 61 HE2 TYR 61 13.053 6.821 4.631
453 HH TYR 61 HH TYR 61 9.842 7.832 5.007
454 H GLY 62 H GLY 62 13.626 7.672 -3.219
455 HA2 GLY 62 2HA GLY 62 14.803 7.034 -5.107
456 HA3 GLY 62 1HA GLY 62 15.701 5.893 -4.122
457 H TYR 63 H TYR 63 12.188 5.862 -4.322
458 HA TYR 63 HA TYR 63 12.337 3.392 -5.941
459 HB2 TYR 63 2HB TYR 63 10.266 4.259 -3.907
460 HB3 TYR 63 1HB TYR 63 10.085 2.858 -4.958
461 HD1 TYR 63 HD1 TYR 63 11.932 4.249 -2.094
462 HD2 TYR 63 HD2 TYR 63 11.330 0.823 -4.548
463 HE1 TYR 63 HE1 TYR 63 13.141 2.870 -0.456
464 HE2 TYR 63 HE2 TYR 63 12.534 -0.564 -2.917
465 HH TYR 63 HH TYR 63 14.250 -0.242 -1.127
466 H LYS 64 H LYS 64 11.404 3.367 -7.880
467 HA LYS 64 HA LYS 64 10.583 5.779 -9.094
468 HB2 LYS 64 2HB LYS 64 10.252 2.942 -10.097
469 HB3 LYS 64 1HB LYS 64 10.140 4.399 -11.078
470 HG2 LYS 64 2HG LYS 64 12.476 4.907 -10.662
471 HG3 LYS 64 1HG LYS 64 12.611 3.519 -9.582
472 HD2 LYS 64 2HD LYS 64 13.555 2.965 -11.746
473 HD3 LYS 64 1HD LYS 64 12.086 2.021 -11.482
474 HE2 LYS 64 2HE LYS 64 10.828 3.596 -12.882
475 HE3 LYS 64 1HE LYS 64 12.296 4.540 -13.141
476 HZ1 LYS 64 3HZ LYS 64 11.880 3.079 -15.000
477 HZ2 LYS 64 1HZ LYS 64 11.857 1.728 -13.986
478 HZ3 LYS 64 2HZ LYS 64 13.292 2.598 -14.205
479 H LYS 65 H LYS 65 8.734 3.264 -7.534
480 HA LYS 65 HA LYS 65 6.347 4.879 -7.711
481 HB2 LYS 65 2HB LYS 65 4.949 3.039 -8.673
482 HB3 LYS 65 1HB LYS 65 6.100 3.744 -9.801
483 HG2 LYS 65 2HG LYS 65 7.631 1.813 -9.310
484 HG3 LYS 65 1HG LYS 65 6.308 1.083 -8.396
485 HD2 LYS 65 2HD LYS 65 6.404 0.198 -10.685
486 HD3 LYS 65 1HD LYS 65 4.905 1.088 -10.410
487 HE2 LYS 65 2HE LYS 65 5.854 3.043 -11.540
488 HE3 LYS 65 1HE LYS 65 7.363 2.168 -11.801
489 HZ1 LYS 65 3HZ LYS 65 5.980 2.144 -13.773
490 HZ2 LYS 65 1HZ LYS 65 4.712 1.426 -12.915
491 HZ3 LYS 65 2HZ LYS 65 6.149 0.576 -13.164
492 H LEU 66 H LEU 66 4.591 4.098 -6.367
493 HA LEU 66 HA LEU 66 5.489 3.387 -3.823
494 HB2 LEU 66 2HB LEU 66 3.436 4.659 -4.251
495 HB3 LEU 66 1HB LEU 66 2.684 3.234 -4.940
496 HG LEU 66 HG LEU 66 2.832 2.114 -2.722
497 HD11 LEU 66 1HD1 LEU 66 3.328 3.460 -0.731
498 HD12 LEU 66 2HD1 LEU 66 3.797 4.810 -1.766
499 HD13 LEU 66 3HD1 LEU 66 4.728 3.312 -1.793
500 HD21 LEU 66 3HD2 LEU 66 1.043 3.407 -1.651
501 HD22 LEU 66 1HD2 LEU 66 0.774 3.230 -3.385
502 HD23 LEU 66 2HD2 LEU 66 1.372 4.758 -2.736
503 H SER 67 H SER 67 4.045 1.342 -6.334
504 HA SER 67 HA SER 67 3.472 -0.935 -4.852
505 HB2 SER 67 2HB SER 67 3.689 -2.193 -6.967
506 HB3 SER 67 1HB SER 67 2.805 -0.684 -7.197
507 HG SER 67 HG SER 67 4.716 -1.400 -8.662
508 H ASP 68 H ASP 68 6.532 -0.129 -6.498
509 HA ASP 68 HA ASP 68 7.932 -2.450 -5.734
510 HB2 ASP 68 2HB ASP 68 8.619 -0.867 -7.551
511 HB3 ASP 68 1HB ASP 68 9.122 0.276 -6.307
512 H LEU 69 H LEU 69 7.709 0.748 -4.205
513 HA LEU 69 HA LEU 69 9.495 0.417 -2.101
514 HB2 LEU 69 2HB LEU 69 8.482 2.555 -2.516
515 HB3 LEU 69 1HB LEU 69 6.875 1.915 -2.222
516 HG LEU 69 HG LEU 69 7.493 1.551 0.165
517 HD11 LEU 69 1HD1 LEU 69 10.005 3.059 -0.554
518 HD12 LEU 69 2HD1 LEU 69 9.914 1.353 -0.116
519 HD13 LEU 69 3HD1 LEU 69 9.498 2.590 1.068
520 HD21 LEU 69 3HD2 LEU 69 6.288 3.559 -0.510
521 HD22 LEU 69 1HD2 LEU 69 7.814 4.385 -0.827
522 HD23 LEU 69 2HD2 LEU 69 7.395 3.903 0.817
523 H VAL 70 H VAL 70 6.002 -0.305 -2.103
524 HA VAL 70 HA VAL 70 5.872 -1.278 0.527
525 HB VAL 70 HB VAL 70 4.089 -2.023 -1.800
526 HG11 VAL 70 1HG1 VAL 70 3.585 -2.165 1.177
527 HG12 VAL 70 2HG1 VAL 70 3.838 -3.541 0.105
528 HG13 VAL 70 3HG1 VAL 70 2.412 -2.524 -0.090
529 HG21 VAL 70 3HG2 VAL 70 4.215 0.398 -1.483
530 HG22 VAL 70 1HG2 VAL 70 3.819 0.203 0.224
531 HG23 VAL 70 2HG2 VAL 70 2.632 -0.220 -1.009
532 H LYS 71 H LYS 71 6.168 -3.105 -2.552
533 HA LYS 71 HA LYS 71 6.166 -5.658 -1.311
534 HB2 LYS 71 2HB LYS 71 6.891 -6.540 -3.470
535 HB3 LYS 71 1HB LYS 71 5.596 -5.369 -3.677
536 HG2 LYS 71 2HG LYS 71 7.268 -3.664 -4.294
537 HG3 LYS 71 1HG LYS 71 8.536 -4.881 -4.148
538 HD2 LYS 71 2HD LYS 71 6.188 -5.040 -6.049
539 HD3 LYS 71 1HD LYS 71 7.812 -4.506 -6.490
540 HE2 LYS 71 2HE LYS 71 7.089 -7.236 -5.404
541 HE3 LYS 71 1HE LYS 71 7.409 -6.860 -7.097
542 HZ1 LYS 71 3HZ LYS 71 9.662 -6.174 -6.437
543 HZ2 LYS 71 1HZ LYS 71 9.357 -7.799 -6.088
544 HZ3 LYS 71 2HZ LYS 71 9.342 -6.646 -4.850
545 H ALA 72 H ALA 72 8.705 -3.338 -1.821
546 HA ALA 72 HA ALA 72 10.868 -5.185 -1.349
547 HB1 ALA 72 3HB ALA 72 10.855 -2.165 -1.255
548 HB2 ALA 72 1HB ALA 72 11.203 -3.151 -2.676
549 HB3 ALA 72 2HB ALA 72 12.286 -3.199 -1.283
550 H ARG 73 H ARG 73 8.800 -3.192 0.638
551 HA ARG 73 HA ARG 73 10.533 -3.606 2.984
552 HB2 ARG 73 2HB ARG 73 8.185 -1.729 2.597
553 HB3 ARG 73 1HB ARG 73 9.157 -1.846 4.060
554 HG2 ARG 73 2HG ARG 73 10.173 -1.026 1.338
555 HG3 ARG 73 1HG ARG 73 9.814 0.064 2.679
556 HD2 ARG 73 2HD ARG 73 11.594 -0.783 3.982
557 HD3 ARG 73 1HD ARG 73 11.793 -2.193 2.941
558 HE ARG 73 HE ARG 73 12.287 0.028 1.366
559 HH11 ARG 73 1HH1 ARG 73 13.622 -1.383 4.207
560 HH12 ARG 73 2HH1 ARG 73 15.239 -0.921 3.809
561 HH21 ARG 73 1HH2 ARG 73 14.371 0.614 0.857
562 HH22 ARG 73 2HH2 ARG 73 15.661 0.210 1.940
563 H THR 74 H THR 74 9.549 -5.931 2.491
564 HA THR 74 HA THR 74 6.970 -6.621 3.341
565 HB THR 74 HB THR 74 7.892 -8.909 3.733
566 HG1 THR 74 HG1 THR 74 10.001 -9.213 3.864
567 HG21 THR 74 3HG2 THR 74 8.820 -7.589 1.174
568 HG22 THR 74 1HG2 THR 74 7.204 -8.227 1.477
569 HG23 THR 74 2HG2 THR 74 8.585 -9.320 1.416
570 H ASP 75 H ASP 75 9.860 -5.976 5.199
571 HA ASP 75 HA ASP 75 9.239 -6.996 7.695
572 HB2 ASP 75 2HB ASP 75 11.381 -5.956 7.150
573 HB3 ASP 75 1HB ASP 75 10.604 -4.386 6.979
574 H LEU 76 H LEU 76 7.935 -4.182 6.078
575 HA LEU 76 HA LEU 76 6.363 -3.436 8.450
576 HB2 LEU 76 2HB LEU 76 6.804 -1.967 5.841
577 HB3 LEU 76 1HB LEU 76 5.860 -1.364 7.191
578 HG LEU 76 HG LEU 76 8.829 -1.947 7.306
579 HD11 LEU 76 1HD1 LEU 76 9.131 0.483 7.281
580 HD12 LEU 76 2HD1 LEU 76 7.397 0.700 7.032
581 HD13 LEU 76 3HD1 LEU 76 8.376 -0.090 5.793
582 HD21 LEU 76 3HD2 LEU 76 7.712 -2.147 9.474
583 HD22 LEU 76 1HD2 LEU 76 6.995 -0.550 9.263
584 HD23 LEU 76 2HD2 LEU 76 8.743 -0.718 9.426
585 H PHE 77 H PHE 77 5.991 -4.296 5.014
586 HA PHE 77 HA PHE 77 3.070 -4.513 5.432
587 HB2 PHE 77 2HB PHE 77 4.414 -3.696 2.848
588 HB3 PHE 77 1HB PHE 77 2.694 -3.650 3.221
589 HD1 PHE 77 HD1 PHE 77 2.238 -2.235 5.523
590 HD2 PHE 77 HD2 PHE 77 5.449 -1.641 2.781
591 HE1 PHE 77 HE1 PHE 77 2.474 0.086 6.299
592 HE2 PHE 77 HE2 PHE 77 5.686 0.679 3.560
593 HZ PHE 77 HZ PHE 77 4.202 1.543 5.321
594 H VAL 78 H VAL 78 2.179 -6.424 4.935
595 HA VAL 78 HA VAL 78 3.686 -8.476 3.519
596 HB VAL 78 HB VAL 78 0.850 -8.588 4.578
597 HG11 VAL 78 1HG1 VAL 78 2.730 -10.805 3.761
598 HG12 VAL 78 2HG1 VAL 78 1.297 -10.278 2.878
599 HG13 VAL 78 3HG1 VAL 78 1.130 -11.022 4.468
600 HG21 VAL 78 3HG2 VAL 78 2.449 -8.130 6.378
601 HG22 VAL 78 1HG2 VAL 78 3.386 -9.548 5.902
602 HG23 VAL 78 2HG2 VAL 78 1.745 -9.741 6.523
603 H THR 79 H THR 79 3.425 -8.957 1.386
604 HA THR 79 HA THR 79 1.297 -7.501 -0.074
605 HB THR 79 HB THR 79 2.830 -7.319 -1.983
606 HG1 THR 79 HG1 THR 79 5.066 -8.054 -0.492
607 HG21 THR 79 3HG2 THR 79 2.801 -5.515 -0.300
608 HG22 THR 79 1HG2 THR 79 4.386 -5.690 -1.050
609 HG23 THR 79 2HG2 THR 79 4.105 -6.320 0.572
610 H GLU 80 H GLU 80 -0.078 -8.679 -1.231
611 HA GLU 80 HA GLU 80 0.870 -10.999 -2.728
612 HB2 GLU 80 2HB GLU 80 -1.455 -11.145 -0.798
613 HB3 GLU 80 1HB GLU 80 -1.245 -12.285 -2.118
614 HG2 GLU 80 2HG GLU 80 1.005 -12.847 -1.145
615 HG3 GLU 80 1HG GLU 80 0.565 -11.868 0.255
616 H GLU 81 H GLU 81 0.040 -11.053 -4.745
617 HA GLU 81 HA GLU 81 -1.864 -8.980 -5.506
618 HB2 GLU 81 2HB GLU 81 -0.399 -10.991 -7.236
619 HB3 GLU 81 1HB GLU 81 -1.304 -9.597 -7.810
620 HG2 GLU 81 2HG GLU 81 0.285 -8.096 -6.745
621 HG3 GLU 81 1HG GLU 81 1.176 -9.473 -6.097
622 H ARG 82 H ARG 82 -3.998 -9.344 -5.735
623 HA ARG 82 HA ARG 82 -4.922 -12.131 -6.126
624 HB2 ARG 82 2HB ARG 82 -6.483 -9.920 -4.767
625 HB3 ARG 82 1HB ARG 82 -6.904 -11.625 -4.850
626 HG2 ARG 82 2HG ARG 82 -4.587 -10.423 -3.335
627 HG3 ARG 82 1HG ARG 82 -6.077 -11.062 -2.645
628 HD2 ARG 82 2HD ARG 82 -4.036 -12.662 -4.197
629 HD3 ARG 82 1HD ARG 82 -4.183 -12.634 -2.441
630 HE ARG 82 HE ARG 82 -6.353 -13.607 -4.187
631 HH11 ARG 82 1HH1 ARG 82 -4.263 -13.988 -1.489
632 HH12 ARG 82 2HH1 ARG 82 -5.009 -15.453 -0.963
633 HH21 ARG 82 1HH2 ARG 82 -7.330 -15.496 -3.493
634 HH22 ARG 82 2HH2 ARG 82 -6.732 -16.283 -2.071
635 H GLN 83 H GLN 83 -6.668 -12.485 -7.555
636 HA GLN 83 HA GLN 83 -6.731 -10.606 -9.750
637 HB2 GLN 83 2HB GLN 83 -6.622 -13.087 -10.050
638 HB3 GLN 83 1HB GLN 83 -8.272 -13.190 -9.451
639 HG2 GLN 83 2HG GLN 83 -9.046 -11.823 -11.327
640 HG3 GLN 83 1HG GLN 83 -7.391 -11.699 -11.923
641 HE21 GLN 83 1HE2 GLN 83 -9.718 -12.799 -13.256
642 HE22 GLN 83 2HE2 GLN 83 -9.329 -14.439 -13.632
643 H VAL 84 H VAL 84 -8.413 -9.346 -10.441
644 HA VAL 84 HA VAL 84 -10.490 -8.795 -8.471
645 HB VAL 84 HB VAL 84 -9.921 -7.323 -11.057
646 HG11 VAL 84 1HG1 VAL 84 -12.129 -6.853 -10.147
647 HG12 VAL 84 2HG1 VAL 84 -11.079 -5.451 -9.949
648 HG13 VAL 84 3HG1 VAL 84 -11.425 -6.493 -8.570
649 HG21 VAL 84 3HG2 VAL 84 -7.916 -7.327 -9.672
650 HG22 VAL 84 1HG2 VAL 84 -8.850 -6.768 -8.283
651 HG23 VAL 84 2HG2 VAL 84 -8.644 -5.724 -9.687
652 HA PRO 85 HA PRO 85 -13.395 -11.410 -10.694
653 HB2 PRO 85 2HB PRO 85 -15.660 -10.527 -9.386
654 HB3 PRO 85 1HB PRO 85 -14.550 -11.747 -8.751
655 HG2 PRO 85 2HG PRO 85 -14.689 -8.814 -8.143
656 HG3 PRO 85 1HG PRO 85 -14.445 -10.177 -7.033
657 HD2 PRO 85 2HD PRO 85 -12.387 -8.655 -7.843
658 HD3 PRO 85 1HD PRO 85 -12.201 -10.407 -7.612
659 H GLY 86 H GLY 86 -14.125 -11.035 -12.691
660 HA2 GLY 86 2HA GLY 86 -15.546 -10.010 -14.298
661 HA3 GLY 86 1HA GLY 86 -15.624 -8.572 -13.294
662 H SER 87 H SER 87 -12.496 -9.221 -13.170
663 HA SER 87 HA SER 87 -11.811 -7.880 -15.715
664 HB2 SER 87 2HB SER 87 -10.649 -7.399 -12.957
665 HB3 SER 87 1HB SER 87 -9.920 -6.789 -14.444
666 HG SER 87 HG SER 87 -12.325 -6.052 -13.186
667 H THR 88 H THR 88 -9.798 -8.433 -16.656
668 HA THR 88 HA THR 88 -8.962 -11.160 -16.084
669 HB THR 88 HB THR 88 -9.288 -10.437 -18.426
670 HG1 THR 88 HG1 THR 88 -7.828 -11.876 -18.910
671 HG21 THR 88 3HG2 THR 88 -7.658 -8.977 -19.520
672 HG22 THR 88 1HG2 THR 88 -6.848 -8.704 -17.977
673 HG23 THR 88 2HG2 THR 88 -8.493 -8.117 -18.226
674 H GLN 89 H GLN 89 -7.859 -7.981 -15.380
675 HA GLN 89 HA GLN 89 -5.098 -8.760 -14.901
676 HB2 GLN 89 2HB GLN 89 -4.710 -6.433 -14.357
677 HB3 GLN 89 1HB GLN 89 -5.634 -6.538 -15.849
678 HG2 GLN 89 2HG GLN 89 -7.676 -5.969 -14.668
679 HG3 GLN 89 1HG GLN 89 -6.812 -5.960 -13.132
680 HE21 GLN 89 1HE2 GLN 89 -7.374 -4.273 -16.109
681 HE22 GLN 89 2HE2 GLN 89 -6.640 -2.782 -15.636
682 H LYS 90 H LYS 90 -4.038 -8.375 -12.829
683 HA LYS 90 HA LYS 90 -5.823 -8.877 -10.528
684 HB2 LYS 90 2HB LYS 90 -3.856 -9.900 -9.428
685 HB3 LYS 90 1HB LYS 90 -4.303 -10.722 -10.916
686 HG2 LYS 90 2HG LYS 90 -2.473 -9.670 -12.099
687 HG3 LYS 90 1HG LYS 90 -2.066 -8.707 -10.677
688 HD2 LYS 90 2HD LYS 90 -0.555 -10.614 -10.905
689 HD3 LYS 90 1HD LYS 90 -1.527 -10.751 -9.439
690 HE2 LYS 90 2HE LYS 90 -3.054 -12.288 -10.649
691 HE3 LYS 90 1HE LYS 90 -1.987 -12.202 -12.050
692 HZ1 LYS 90 3HZ LYS 90 -0.228 -13.188 -10.766
693 HZ2 LYS 90 1HZ LYS 90 -1.597 -14.173 -10.658
694 HZ3 LYS 90 2HZ LYS 90 -1.164 -13.169 -9.364
695 H ALA 91 H ALA 91 -5.230 -7.930 -8.468
696 HA ALA 91 HA ALA 91 -3.698 -5.410 -8.707
697 HB1 ALA 91 3HB ALA 91 -6.106 -4.978 -8.552
698 HB2 ALA 91 1HB ALA 91 -5.256 -4.391 -7.121
699 HB3 ALA 91 2HB ALA 91 -6.176 -5.896 -7.048
700 H LEU 92 H LEU 92 -2.477 -4.763 -6.914
701 HA LEU 92 HA LEU 92 -1.494 -6.951 -5.287
702 HB2 LEU 92 2HB LEU 92 0.081 -5.390 -6.314
703 HB3 LEU 92 1HB LEU 92 -0.666 -4.049 -5.465
704 HG LEU 92 HG LEU 92 0.047 -5.133 -3.297
705 HD11 LEU 92 1HD1 LEU 92 1.680 -6.878 -5.140
706 HD12 LEU 92 2HD1 LEU 92 0.354 -7.407 -4.103
707 HD13 LEU 92 3HD1 LEU 92 1.840 -6.789 -3.386
708 HD21 LEU 92 3HD2 LEU 92 1.262 -3.247 -4.238
709 HD22 LEU 92 1HD2 LEU 92 2.225 -4.338 -5.233
710 HD23 LEU 92 2HD2 LEU 92 2.374 -4.382 -3.476
711 H TYR 93 H TYR 93 -2.528 -7.485 -3.456
712 HA TYR 93 HA TYR 93 -3.801 -5.385 -1.847
713 HB2 TYR 93 2HB TYR 93 -4.134 -8.382 -1.877
714 HB3 TYR 93 1HB TYR 93 -4.772 -7.383 -0.572
715 HD1 TYR 93 HD1 TYR 93 -4.928 -7.867 -4.276
716 HD2 TYR 93 HD2 TYR 93 -6.817 -6.273 -0.808
717 HE1 TYR 93 HE1 TYR 93 -6.931 -7.355 -5.606
718 HE2 TYR 93 HE2 TYR 93 -8.826 -5.765 -2.127
719 HH TYR 93 HH TYR 93 -9.416 -7.017 -5.156
720 H LEU 94 H LEU 94 -3.357 -5.046 0.293
721 HA LEU 94 HA LEU 94 -0.737 -6.057 1.220
722 HB2 LEU 94 2HB LEU 94 -1.795 -3.255 1.613
723 HB3 LEU 94 1HB LEU 94 -0.178 -3.842 1.961
724 HG LEU 94 HG LEU 94 -1.377 -3.546 -0.801
725 HD11 LEU 94 1HD1 LEU 94 0.235 -1.716 -1.061
726 HD12 LEU 94 2HD1 LEU 94 0.699 -1.893 0.631
727 HD13 LEU 94 3HD1 LEU 94 -0.939 -1.388 0.214
728 HD21 LEU 94 3HD2 LEU 94 1.416 -4.311 0.044
729 HD22 LEU 94 1HD2 LEU 94 0.879 -4.023 -1.610
730 HD23 LEU 94 2HD2 LEU 94 0.226 -5.382 -0.696
731 H ARG 95 H ARG 95 -0.425 -6.183 3.495
732 HA ARG 95 HA ARG 95 -2.510 -5.266 5.296
733 HB2 ARG 95 2HB ARG 95 -2.931 -7.385 6.373
734 HB3 ARG 95 1HB ARG 95 -3.250 -7.564 4.654
735 HG2 ARG 95 2HG ARG 95 -0.986 -8.582 4.409
736 HG3 ARG 95 1HG ARG 95 -0.831 -8.538 6.165
737 HD2 ARG 95 2HD ARG 95 -2.883 -10.055 4.551
738 HD3 ARG 95 1HD ARG 95 -1.545 -10.736 5.476
739 HE ARG 95 HE ARG 95 -3.201 -9.233 7.186
740 HH11 ARG 95 1HH1 ARG 95 -3.131 -12.210 5.455
741 HH12 ARG 95 2HH1 ARG 95 -4.308 -12.956 6.479
742 HH21 ARG 95 1HH2 ARG 95 -4.694 -10.224 8.511
743 HH22 ARG 95 2HH2 ARG 95 -5.150 -11.864 8.197
744 H ALA 96 H ALA 96 -1.811 -5.245 7.549
745 HA ALA 96 HA ALA 96 0.874 -4.385 7.775
746 HB1 ALA 96 3HB ALA 96 0.404 -4.059 10.131
747 HB2 ALA 96 1HB ALA 96 -1.046 -5.056 10.006
748 HB3 ALA 96 2HB ALA 96 -0.960 -3.511 9.158
749 H LYS 97 H LYS 97 2.713 -5.323 8.541
750 HA LYS 97 HA LYS 97 2.817 -8.199 8.715
751 HB2 LYS 97 2HB LYS 97 4.636 -7.091 7.614
752 HB3 LYS 97 1HB LYS 97 4.923 -6.048 8.998
753 HG2 LYS 97 2HG LYS 97 6.643 -7.736 8.887
754 HG3 LYS 97 1HG LYS 97 5.640 -8.014 10.310
755 HD2 LYS 97 2HD LYS 97 6.088 -10.132 9.265
756 HD3 LYS 97 1HD LYS 97 4.386 -9.740 9.018
757 HE2 LYS 97 2HE LYS 97 4.907 -8.953 6.747
758 HE3 LYS 97 1HE LYS 97 6.604 -9.365 7.000
759 HZ1 LYS 97 3HZ LYS 97 6.035 -11.661 7.178
760 HZ2 LYS 97 1HZ LYS 97 5.322 -11.065 5.767
761 HZ3 LYS 97 2HZ LYS 97 4.379 -11.325 7.143
762 H LEU 98 H LEU 98 2.124 -9.177 10.517
763 HA LEU 98 HA LEU 98 2.715 -8.019 13.149
764 HB2 LEU 98 2HB LEU 98 0.961 -10.369 12.398
765 HB3 LEU 98 1HB LEU 98 1.131 -9.698 14.010
766 HG LEU 98 HG LEU 98 -0.080 -8.282 11.622
767 HD11 LEU 98 1HD1 LEU 98 -1.367 -9.371 14.130
768 HD12 LEU 98 2HD1 LEU 98 -1.518 -10.046 12.506
769 HD13 LEU 98 3HD1 LEU 98 -2.181 -8.450 12.862
770 HD21 LEU 98 3HD2 LEU 98 -0.680 -6.520 13.227
771 HD22 LEU 98 1HD2 LEU 98 1.068 -6.701 13.075
772 HD23 LEU 98 2HD2 LEU 98 0.233 -7.358 14.483
773 H GLU 99 H GLU 99 4.266 -8.827 14.436
774 HA GLU 99 HA GLU 99 5.108 -11.583 14.332
775 HB2 GLU 99 2HB GLU 99 6.333 -10.361 12.429
776 HB3 GLU 99 1HB GLU 99 7.205 -9.494 13.682
777 HG2 GLU 99 2HG GLU 99 7.176 -12.494 13.602
778 HG3 GLU 99 1HG GLU 99 8.280 -11.570 12.594
779 H HIS 100 H HIS 100 5.198 -12.046 16.446
780 HA HIS 100 HA HIS 100 5.597 -10.042 18.448
781 HB2 HIS 100 2HB HIS 100 4.152 -11.987 18.860
782 HB3 HIS 100 1HB HIS 100 5.543 -13.060 18.735
783 HD1 HIS 100 HD1 HIS 100 7.103 -13.218 20.766
784 HD2 HIS 100 HD2 HIS 100 4.036 -10.452 21.242
785 HE1 HIS 100 HE1 HIS 100 7.147 -12.571 23.191
786 HE2 HIS 100 HE2 HIS 100 5.357 -10.825 23.432
787 H HIS 101 H HIS 101 7.626 -9.139 18.092
788 HA HIS 101 HA HIS 101 9.997 -10.578 17.640
789 HB2 HIS 101 2HB HIS 101 9.562 -7.786 18.725
790 HB3 HIS 101 1HB HIS 101 11.142 -8.430 18.292
791 HD1 HIS 101 HD1 HIS 101 7.772 -7.807 16.627
792 HD2 HIS 101 HD2 HIS 101 11.814 -7.991 15.692
793 HE1 HIS 101 HE1 HIS 101 7.936 -7.113 14.225
794 HE2 HIS 101 HE2 HIS 101 10.398 -7.071 13.733
795 H HIS 102 H HIS 102 11.136 -11.843 18.967
796 HA HIS 102 HA HIS 102 10.791 -12.181 21.708
797 HB2 HIS 102 2HB HIS 102 13.260 -12.619 20.011
798 HB3 HIS 102 1HB HIS 102 13.110 -13.167 21.678
799 HD1 HIS 102 HD1 HIS 102 11.882 -13.883 18.214
800 HD2 HIS 102 HD2 HIS 102 11.495 -15.412 22.057
801 HE1 HIS 102 HE1 HIS 102 10.775 -16.114 17.940
802 HE2 HIS 102 HE2 HIS 102 10.347 -16.903 20.287
803 H HIS 103 H HIS 103 12.106 -11.498 23.540
804 HA HIS 103 HA HIS 103 12.431 -8.669 23.464
805 HB2 HIS 103 2HB HIS 103 11.567 -9.870 25.450
806 HB3 HIS 103 1HB HIS 103 13.168 -10.559 25.702
807 HD1 HIS 103 HD1 HIS 103 14.953 -9.065 26.738
808 HD2 HIS 103 HD2 HIS 103 11.357 -7.094 26.057
809 HE1 HIS 103 HE1 HIS 103 15.165 -6.855 27.912
810 HE2 HIS 103 HE2 HIS 103 13.051 -5.615 27.336
811 H HIS 104 H HIS 104 14.083 -8.319 21.940
812 HA HIS 104 HA HIS 104 16.749 -8.409 23.188
813 HB2 HIS 104 2HB HIS 104 17.733 -8.614 20.878
814 HB3 HIS 104 1HB HIS 104 16.885 -10.044 21.449
815 HD1 HIS 104 HD1 HIS 104 16.365 -7.109 19.094
816 HD2 HIS 104 HD2 HIS 104 14.907 -10.939 19.799
817 HE1 HIS 104 HE1 HIS 104 14.838 -7.611 17.172
818 HE2 HIS 104 HE2 HIS 104 14.130 -10.002 17.518
819 H HIS 105 H HIS 105 14.386 -6.453 22.654
820 HA HIS 105 HA HIS 105 16.131 -4.148 22.230
821 HB2 HIS 105 2HB HIS 105 15.211 -4.605 19.996
822 HB3 HIS 105 1HB HIS 105 13.576 -4.590 20.647
823 HD1 HIS 105 HD1 HIS 105 12.397 -2.442 20.316
824 HD2 HIS 105 HD2 HIS 105 16.515 -1.917 20.491
825 HE1 HIS 105 HE1 HIS 105 12.778 0.007 19.931
826 HE2 HIS 105 HE2 HIS 105 15.246 0.325 20.284
Start of MODEL 16
1 H1 MET 1 1H MET 1 64.633 19.188 17.946
2 H2 MET 1 2H MET 1 64.610 19.304 16.264
3 H3 MET 1 3H MET 1 63.952 17.944 17.031
4 HA MET 1 HA MET 1 62.235 19.292 18.047
5 HB2 MET 1 2HB MET 1 61.989 21.634 17.522
6 HB3 MET 1 1HB MET 1 63.614 21.372 18.137
7 HG2 MET 1 2HG MET 1 64.496 21.424 15.859
8 HG3 MET 1 1HG MET 1 62.866 21.654 15.227
9 HE1 MET 1 3HE MET 1 64.520 25.138 14.597
10 HE2 MET 1 1HE MET 1 63.626 23.798 13.877
11 HE3 MET 1 2HE MET 1 65.273 23.548 14.460
12 H ASP 2 H ASP 2 63.230 18.058 15.232
13 HA ASP 2 HA ASP 2 61.585 19.202 13.250
14 HB2 ASP 2 2HB ASP 2 62.820 16.445 13.385
15 HB3 ASP 2 1HB ASP 2 62.137 17.182 11.936
16 H GLN 3 H GLN 3 59.841 18.174 12.079
17 HA GLN 3 HA GLN 3 58.132 16.428 13.736
18 HB2 GLN 3 2HB GLN 3 56.162 17.658 12.770
19 HB3 GLN 3 1HB GLN 3 57.146 18.593 13.884
20 HG2 GLN 3 2HG GLN 3 58.232 19.711 11.990
21 HG3 GLN 3 1HG GLN 3 57.230 18.782 10.875
22 HE21 GLN 3 1HE2 GLN 3 57.419 21.662 11.243
23 HE22 GLN 3 2HE2 GLN 3 55.826 22.206 11.626
24 H LYS 4 H LYS 4 58.632 14.550 12.651
25 HA LYS 4 HA LYS 4 58.413 14.438 9.753
26 HB2 LYS 4 2HB LYS 4 60.184 13.172 10.942
27 HB3 LYS 4 1HB LYS 4 58.948 12.215 11.741
28 HG2 LYS 4 2HG LYS 4 59.919 10.981 9.899
29 HG3 LYS 4 1HG LYS 4 58.221 11.331 9.572
30 HD2 LYS 4 2HD LYS 4 59.556 11.684 7.563
31 HD3 LYS 4 1HD LYS 4 58.906 13.220 8.135
32 HE2 LYS 4 2HE LYS 4 61.235 13.460 7.437
33 HE3 LYS 4 1HE LYS 4 61.067 13.753 9.166
34 HZ1 LYS 4 3HZ LYS 4 62.046 11.248 7.905
35 HZ2 LYS 4 1HZ LYS 4 61.840 11.480 9.567
36 HZ3 LYS 4 2HZ LYS 4 62.985 12.390 8.718
37 H SER 5 H SER 5 56.151 15.079 9.722
38 HA SER 5 HA SER 5 54.183 13.216 10.779
39 HB2 SER 5 2HB SER 5 53.798 15.732 9.131
40 HB3 SER 5 1HB SER 5 52.520 14.820 9.932
41 HG SER 5 HG SER 5 53.695 15.269 11.933
42 H SER 6 H SER 6 52.889 11.853 9.611
43 HA SER 6 HA SER 6 53.706 11.085 6.960
44 HB2 SER 6 2HB SER 6 51.294 10.225 8.596
45 HB3 SER 6 1HB SER 6 51.834 9.459 7.103
46 HG SER 6 HG SER 6 53.626 9.729 9.263
47 H SER 7 H SER 7 50.882 12.721 8.340
48 HA SER 7 HA SER 7 50.425 14.306 6.024
49 HB2 SER 7 2HB SER 7 48.309 13.412 5.265
50 HB3 SER 7 1HB SER 7 49.473 12.088 5.261
51 HG SER 7 HG SER 7 47.665 11.297 6.236
52 HA PRO 8 HA PRO 8 48.147 16.797 8.976
53 HB2 PRO 8 2HB PRO 8 45.961 17.104 6.977
54 HB3 PRO 8 1HB PRO 8 46.917 18.340 7.804
55 HG2 PRO 8 2HG PRO 8 47.349 17.790 5.232
56 HG3 PRO 8 1HG PRO 8 48.703 18.135 6.324
57 HD2 PRO 8 2HD PRO 8 47.729 15.493 5.290
58 HD3 PRO 8 1HD PRO 8 49.396 16.076 5.499
59 H GLN 9 H GLN 9 46.760 13.993 7.572
60 HA GLN 9 HA GLN 9 45.179 12.504 8.182
61 HB2 GLN 9 2HB GLN 9 45.484 13.848 10.874
62 HB3 GLN 9 1HB GLN 9 44.568 12.370 10.603
63 HG2 GLN 9 2HG GLN 9 46.635 11.278 9.789
64 HG3 GLN 9 1HG GLN 9 47.528 12.750 10.166
65 HE21 GLN 9 1HE2 GLN 9 45.814 10.025 11.485
66 HE22 GLN 9 2HE2 GLN 9 46.427 10.170 13.094
67 HA PRO 10 HA PRO 10 41.560 15.268 7.785
68 HB2 PRO 10 2HB PRO 10 40.870 14.440 5.257
69 HB3 PRO 10 1HB PRO 10 41.981 15.767 5.593
70 HG2 PRO 10 2HG PRO 10 42.558 13.155 4.462
71 HG3 PRO 10 1HG PRO 10 43.619 14.565 4.602
72 HD2 PRO 10 2HD PRO 10 43.484 12.173 6.292
73 HD3 PRO 10 1HD PRO 10 44.745 13.421 6.211
74 H ALA 11 H ALA 11 39.239 14.686 7.308
75 HA ALA 11 HA ALA 11 38.546 12.203 8.578
76 HB1 ALA 11 3HB ALA 11 36.779 14.260 7.241
77 HB2 ALA 11 1HB ALA 11 37.213 14.213 8.951
78 HB3 ALA 11 2HB ALA 11 36.220 12.931 8.256
79 H ALA 12 H ALA 12 38.465 10.281 7.579
80 HA ALA 12 HA ALA 12 38.336 10.105 4.669
81 HB1 ALA 12 3HB ALA 12 38.890 7.752 5.002
82 HB2 ALA 12 1HB ALA 12 38.681 7.935 6.741
83 HB3 ALA 12 2HB ALA 12 39.986 8.789 5.917
84 H GLN 13 H GLN 13 35.914 10.860 6.274
85 HA GLN 13 HA GLN 13 34.118 8.619 5.588
86 HB2 GLN 13 2HB GLN 13 33.686 10.864 7.576
87 HB3 GLN 13 1HB GLN 13 32.548 9.571 7.232
88 HG2 GLN 13 2HG GLN 13 35.301 9.172 8.397
89 HG3 GLN 13 1HG GLN 13 33.810 9.250 9.330
90 HE21 GLN 13 1HE2 GLN 13 33.967 7.200 10.134
91 HE22 GLN 13 2HE2 GLN 13 33.775 5.785 9.163
92 H ALA 14 H ALA 14 32.521 8.919 4.131
93 HA ALA 14 HA ALA 14 32.064 11.636 3.079
94 HB1 ALA 14 3HB ALA 14 31.102 10.560 1.121
95 HB2 ALA 14 1HB ALA 14 31.276 8.976 1.879
96 HB3 ALA 14 2HB ALA 14 32.709 9.908 1.443
97 HA PRO 15 HA PRO 15 28.347 11.918 5.538
98 HB2 PRO 15 2HB PRO 15 27.493 13.677 3.269
99 HB3 PRO 15 1HB PRO 15 27.448 13.983 5.010
100 HG2 PRO 15 2HG PRO 15 29.333 15.102 3.509
101 HG3 PRO 15 1HG PRO 15 29.727 14.466 5.118
102 HD2 PRO 15 2HD PRO 15 30.302 13.300 2.423
103 HD3 PRO 15 1HD PRO 15 31.291 13.273 3.899
104 H GLU 16 H GLU 16 27.014 10.195 5.557
105 HA GLU 16 HA GLU 16 25.484 9.530 3.114
106 HB2 GLU 16 2HB GLU 16 26.819 7.670 3.993
107 HB3 GLU 16 1HB GLU 16 26.046 7.836 5.566
108 HG2 GLU 16 2HG GLU 16 23.850 7.351 4.409
109 HG3 GLU 16 1HG GLU 16 24.793 6.944 2.976
110 H THR 17 H THR 17 23.357 10.032 3.086
111 HA THR 17 HA THR 17 22.009 10.591 5.656
112 HB THR 17 HB THR 17 21.268 11.489 2.857
113 HG1 THR 17 HG1 THR 17 21.837 13.552 3.684
114 HG21 THR 17 3HG2 THR 17 19.941 12.099 5.506
115 HG22 THR 17 1HG2 THR 17 19.247 11.162 4.182
116 HG23 THR 17 2HG2 THR 17 19.561 12.885 3.975
117 H LYS 18 H LYS 18 20.534 9.212 6.382
118 HA LYS 18 HA LYS 18 19.240 7.349 4.484
119 HB2 LYS 18 2HB LYS 18 20.631 6.145 6.072
120 HB3 LYS 18 1HB LYS 18 19.872 6.978 7.423
121 HG2 LYS 18 2HG LYS 18 17.720 5.909 6.823
122 HG3 LYS 18 1HG LYS 18 18.552 5.013 5.552
123 HD2 LYS 18 2HD LYS 18 19.932 3.887 7.192
124 HD3 LYS 18 1HD LYS 18 19.250 4.872 8.489
125 HE2 LYS 18 2HE LYS 18 17.707 2.921 6.772
126 HE3 LYS 18 1HE LYS 18 18.260 2.618 8.419
127 HZ1 LYS 18 3HZ LYS 18 16.287 4.673 7.562
128 HZ2 LYS 18 1HZ LYS 18 16.893 4.524 9.134
129 HZ3 LYS 18 2HZ LYS 18 15.974 3.276 8.467
130 H GLN 19 H GLN 19 17.027 7.136 4.504
131 HA GLN 19 HA GLN 19 15.527 9.128 6.051
132 HB2 GLN 19 2HB GLN 19 14.569 7.308 3.826
133 HB3 GLN 19 1HB GLN 19 13.673 8.642 4.535
134 HG2 GLN 19 2HG GLN 19 16.238 8.888 2.965
135 HG3 GLN 19 1HG GLN 19 14.618 9.217 2.352
136 HE21 GLN 19 1HE2 GLN 19 13.695 10.501 4.768
137 HE22 GLN 19 2HE2 GLN 19 14.472 12.037 4.835
138 H ALA 20 H ALA 20 13.645 8.563 7.270
139 HA ALA 20 HA ALA 20 13.606 5.769 8.234
140 HB1 ALA 20 3HB ALA 20 12.744 6.622 10.349
141 HB2 ALA 20 1HB ALA 20 12.753 8.267 9.707
142 HB3 ALA 20 2HB ALA 20 14.272 7.401 9.939
143 H PHE 21 H PHE 21 11.801 4.606 7.944
144 HA PHE 21 HA PHE 21 9.549 5.693 6.518
145 HB2 PHE 21 2HB PHE 21 10.112 2.947 7.664
146 HB3 PHE 21 1HB PHE 21 8.650 3.337 6.766
147 HD1 PHE 21 HD1 PHE 21 8.996 4.322 4.385
148 HD2 PHE 21 HD2 PHE 21 11.976 2.156 6.528
149 HE1 PHE 21 HE1 PHE 21 10.142 3.811 2.273
150 HE2 PHE 21 HE2 PHE 21 13.126 1.645 4.414
151 HZ PHE 21 HZ PHE 21 12.207 2.471 2.281
152 HA PRO 22 HA PRO 22 7.281 6.432 10.403
153 HB2 PRO 22 2HB PRO 22 5.317 7.974 9.343
154 HB3 PRO 22 1HB PRO 22 6.930 8.612 9.697
155 HG2 PRO 22 2HG PRO 22 5.755 7.763 7.078
156 HG3 PRO 22 1HG PRO 22 6.810 9.140 7.439
157 HD2 PRO 22 2HD PRO 22 7.678 6.765 6.339
158 HD3 PRO 22 1HD PRO 22 8.716 7.877 7.253
159 H ARG 23 H ARG 23 6.483 4.350 10.764
160 HA ARG 23 HA ARG 23 4.725 3.094 8.860
161 HB2 ARG 23 2HB ARG 23 4.782 1.163 10.322
162 HB3 ARG 23 1HB ARG 23 6.406 1.807 10.129
163 HG2 ARG 23 2HG ARG 23 6.195 2.924 12.327
164 HG3 ARG 23 1HG ARG 23 4.610 2.175 12.526
165 HD2 ARG 23 2HD ARG 23 5.676 -0.053 12.349
166 HD3 ARG 23 1HD ARG 23 7.251 0.731 12.230
167 HE ARG 23 HE ARG 23 5.834 1.537 14.576
168 HH11 ARG 23 1HH1 ARG 23 7.814 -0.970 13.255
169 HH12 ARG 23 2HH1 ARG 23 8.335 -1.518 14.811
170 HH21 ARG 23 1HH2 ARG 23 6.507 0.801 16.561
171 HH22 ARG 23 2HH2 ARG 23 7.586 -0.549 16.652
172 H LYS 24 H LYS 24 4.306 4.862 11.832
173 HA LYS 24 HA LYS 24 1.870 3.890 12.727
174 HB2 LYS 24 2HB LYS 24 2.924 6.721 12.876
175 HB3 LYS 24 1HB LYS 24 1.575 6.100 13.820
176 HG2 LYS 24 2HG LYS 24 3.083 4.453 14.862
177 HG3 LYS 24 1HG LYS 24 4.431 5.135 13.946
178 HD2 LYS 24 2HD LYS 24 4.141 7.276 15.063
179 HD3 LYS 24 1HD LYS 24 2.728 6.662 15.925
180 HE2 LYS 24 2HE LYS 24 5.557 5.630 16.188
181 HE3 LYS 24 1HE LYS 24 4.719 6.657 17.349
182 HZ1 LYS 24 3HZ LYS 24 4.649 4.370 18.057
183 HZ2 LYS 24 1HZ LYS 24 3.958 3.889 16.588
184 HZ3 LYS 24 2HZ LYS 24 3.084 4.875 17.646
185 H PHE 25 H PHE 25 2.244 6.863 10.752
186 HA PHE 25 HA PHE 25 -0.515 7.185 10.288
187 HB2 PHE 25 2HB PHE 25 1.851 8.260 8.734
188 HB3 PHE 25 1HB PHE 25 0.190 8.783 8.496
189 HD1 PHE 25 HD1 PHE 25 -0.955 10.124 10.178
190 HD2 PHE 25 HD2 PHE 25 3.109 8.942 10.689
191 HE1 PHE 25 HE1 PHE 25 -0.696 11.792 11.968
192 HE2 PHE 25 HE2 PHE 25 3.371 10.612 12.476
193 HZ PHE 25 HZ PHE 25 1.467 12.038 13.120
194 H VAL 26 H VAL 26 1.992 5.643 8.281
195 HA VAL 26 HA VAL 26 0.357 5.235 6.013
196 HB VAL 26 HB VAL 26 2.768 3.599 6.838
197 HG11 VAL 26 1HG1 VAL 26 1.468 4.025 4.141
198 HG12 VAL 26 2HG1 VAL 26 1.476 2.531 5.080
199 HG13 VAL 26 3HG1 VAL 26 2.983 3.166 4.419
200 HG21 VAL 26 3HG2 VAL 26 3.315 5.984 6.774
201 HG22 VAL 26 1HG2 VAL 26 2.626 6.111 5.155
202 HG23 VAL 26 2HG2 VAL 26 4.070 5.134 5.426
203 H LEU 27 H LEU 27 1.201 3.004 8.684
204 HA LEU 27 HA LEU 27 -0.446 0.874 7.815
205 HB2 LEU 27 2HB LEU 27 0.583 1.584 10.564
206 HB3 LEU 27 1HB LEU 27 -0.303 0.110 10.216
207 HG LEU 27 HG LEU 27 2.360 0.874 8.994
208 HD11 LEU 27 1HD1 LEU 27 3.271 -0.941 10.362
209 HD12 LEU 27 2HD1 LEU 27 1.691 -1.173 11.111
210 HD13 LEU 27 3HD1 LEU 27 2.571 0.335 11.359
211 HD21 LEU 27 3HD2 LEU 27 0.710 -1.645 8.739
212 HD22 LEU 27 1HD2 LEU 27 2.359 -1.441 8.140
213 HD23 LEU 27 2HD2 LEU 27 1.049 -0.476 7.462
214 H ALA 28 H ALA 28 -1.087 3.689 9.865
215 HA ALA 28 HA ALA 28 -3.689 3.025 10.711
216 HB1 ALA 28 3HB ALA 28 -2.382 4.914 11.621
217 HB2 ALA 28 1HB ALA 28 -4.001 5.404 11.114
218 HB3 ALA 28 2HB ALA 28 -2.605 5.784 10.104
219 H ALA 29 H ALA 29 -2.529 4.601 7.762
220 HA ALA 29 HA ALA 29 -5.063 5.019 6.564
221 HB1 ALA 29 3HB ALA 29 -2.368 4.629 5.258
222 HB2 ALA 29 1HB ALA 29 -3.061 6.165 5.780
223 HB3 ALA 29 2HB ALA 29 -3.813 5.260 4.465
224 H LEU 30 H LEU 30 -2.706 2.388 6.284
225 HA LEU 30 HA LEU 30 -4.014 0.819 4.386
226 HB2 LEU 30 2HB LEU 30 -1.696 0.471 5.061
227 HB3 LEU 30 1HB LEU 30 -2.211 -0.023 6.662
228 HG LEU 30 HG LEU 30 -3.259 -2.034 5.733
229 HD11 LEU 30 1HD1 LEU 30 -3.901 -1.175 3.543
230 HD12 LEU 30 2HD1 LEU 30 -2.946 -2.649 3.388
231 HD13 LEU 30 3HD1 LEU 30 -2.204 -1.081 3.070
232 HD21 LEU 30 3HD2 LEU 30 -0.406 -1.673 4.804
233 HD22 LEU 30 1HD2 LEU 30 -1.223 -3.212 5.080
234 HD23 LEU 30 2HD2 LEU 30 -0.915 -2.124 6.433
235 H GLU 31 H GLU 31 -4.093 0.395 7.952
236 HA GLU 31 HA GLU 31 -5.883 -1.747 7.974
237 HB2 GLU 31 2HB GLU 31 -6.211 -1.302 10.324
238 HB3 GLU 31 1HB GLU 31 -4.521 -1.045 9.916
239 HG2 GLU 31 2HG GLU 31 -4.815 1.342 9.954
240 HG3 GLU 31 1HG GLU 31 -6.554 1.163 10.174
241 H GLN 32 H GLN 32 -6.538 1.727 7.916
242 HA GLN 32 HA GLN 32 -9.383 1.408 8.256
243 HB2 GLN 32 2HB GLN 32 -7.686 3.777 7.452
244 HB3 GLN 32 1HB GLN 32 -9.433 3.857 7.637
245 HG2 GLN 32 2HG GLN 32 -9.176 3.140 9.997
246 HG3 GLN 32 1HG GLN 32 -7.426 3.188 9.789
247 HE21 GLN 32 1HE2 GLN 32 -6.404 5.196 9.592
248 HE22 GLN 32 2HE2 GLN 32 -7.190 6.673 10.033
249 H SER 33 H SER 33 -7.219 1.269 5.592
250 HA SER 33 HA SER 33 -9.287 1.765 3.589
251 HB2 SER 33 2HB SER 33 -6.969 2.593 3.233
252 HB3 SER 33 1HB SER 33 -6.395 0.928 3.215
253 HG SER 33 HG SER 33 -7.437 2.369 1.217
254 H SER 34 H SER 34 -7.842 -0.893 5.232
255 HA SER 34 HA SER 34 -8.320 -2.929 3.299
256 HB2 SER 34 2HB SER 34 -7.860 -3.082 6.290
257 HB3 SER 34 1HB SER 34 -7.985 -4.497 5.247
258 HG SER 34 HG SER 34 -5.966 -4.216 4.807
259 H ASP 35 H ASP 35 -9.985 -4.354 3.045
260 HA ASP 35 HA ASP 35 -12.591 -3.662 3.983
261 HB2 ASP 35 2HB ASP 35 -11.656 -6.234 2.680
262 HB3 ASP 35 1HB ASP 35 -13.326 -5.693 2.824
263 H ASP 36 H ASP 36 -13.966 -5.764 4.807
264 HA ASP 36 HA ASP 36 -13.228 -6.269 7.467
265 HB2 ASP 36 2HB ASP 36 -15.541 -6.437 6.697
266 HB3 ASP 36 1HB ASP 36 -15.123 -7.804 5.665
267 H ALA 37 H ALA 37 -12.462 -7.961 4.511
268 HA ALA 37 HA ALA 37 -11.397 -10.315 5.781
269 HB1 ALA 37 3HB ALA 37 -12.336 -10.369 3.513
270 HB2 ALA 37 1HB ALA 37 -10.672 -10.950 3.549
271 HB3 ALA 37 2HB ALA 37 -11.029 -9.328 2.950
272 H GLY 38 H GLY 38 -10.252 -7.297 6.001
273 HA2 GLY 38 2HA GLY 38 -8.223 -6.591 6.864
274 HA3 GLY 38 1HA GLY 38 -7.602 -8.217 6.667
275 H TRP 39 H TRP 39 -8.666 -7.687 3.695
276 HA TRP 39 HA TRP 39 -6.028 -6.865 2.762
277 HB2 TRP 39 2HB TRP 39 -8.387 -8.139 1.369
278 HB3 TRP 39 1HB TRP 39 -6.941 -7.613 0.512
279 HD1 TRP 39 HD1 TRP 39 -8.290 -10.462 2.572
280 HE1 TRP 39 HE1 TRP 39 -6.484 -12.285 2.807
281 HE3 TRP 39 HE3 TRP 39 -4.282 -7.863 0.756
282 HZ2 TRP 39 HZ2 TRP 39 -3.723 -12.573 2.297
283 HZ3 TRP 39 HZ3 TRP 39 -2.090 -8.978 0.675
284 HH2 TRP 39 HH2 TRP 39 -1.818 -11.283 1.434
285 H ALA 40 H ALA 40 -5.566 -5.016 1.753
286 HA ALA 40 HA ALA 40 -7.773 -3.223 0.930
287 HB1 ALA 40 3HB ALA 40 -6.335 -1.331 1.433
288 HB2 ALA 40 1HB ALA 40 -5.018 -2.417 1.882
289 HB3 ALA 40 2HB ALA 40 -6.486 -2.360 2.856
290 H ASN 41 H ASN 41 -7.895 -2.921 -1.212
291 HA ASN 41 HA ASN 41 -5.950 -3.778 -3.073
292 HB2 ASN 41 2HB ASN 41 -8.384 -3.459 -3.571
293 HB3 ASN 41 1HB ASN 41 -8.139 -1.720 -3.498
294 HD21 ASN 41 1HD2 ASN 41 -9.041 -3.440 -5.704
295 HD22 ASN 41 2HD2 ASN 41 -7.956 -3.128 -7.013
296 H LEU 42 H LEU 42 -4.278 -2.733 -4.085
297 HA LEU 42 HA LEU 42 -2.866 -0.725 -2.839
298 HB2 LEU 42 2HB LEU 42 -1.950 -2.226 -4.568
299 HB3 LEU 42 1HB LEU 42 -2.859 -1.361 -5.795
300 HG LEU 42 HG LEU 42 -1.543 0.685 -5.305
301 HD11 LEU 42 1HD1 LEU 42 -0.970 0.238 -2.982
302 HD12 LEU 42 2HD1 LEU 42 0.482 0.522 -3.940
303 HD13 LEU 42 3HD1 LEU 42 0.040 -1.121 -3.473
304 HD21 LEU 42 3HD2 LEU 42 0.517 -0.049 -6.365
305 HD22 LEU 42 1HD2 LEU 42 -0.870 -0.850 -7.102
306 HD23 LEU 42 2HD2 LEU 42 0.152 -1.728 -5.963
307 H GLY 43 H GLY 43 -5.293 -0.352 -5.403
308 HA2 GLY 43 2HA GLY 43 -5.026 2.405 -5.879
309 HA3 GLY 43 1HA GLY 43 -6.501 1.477 -6.099
310 H ASN 44 H ASN 44 -6.907 0.700 -3.402
311 HA ASN 44 HA ASN 44 -8.097 3.086 -2.329
312 HB2 ASN 44 2HB ASN 44 -7.830 0.325 -1.103
313 HB3 ASN 44 1HB ASN 44 -8.869 1.616 -0.507
314 HD21 ASN 44 1HD2 ASN 44 -9.562 -1.062 -1.441
315 HD22 ASN 44 2HD2 ASN 44 -10.686 -0.831 -2.731
316 H PHE 45 H PHE 45 -5.299 1.092 -1.537
317 HA PHE 45 HA PHE 45 -4.574 2.257 0.904
318 HB2 PHE 45 2HB PHE 45 -3.565 0.188 0.140
319 HB3 PHE 45 1HB PHE 45 -2.855 1.001 -1.249
320 HD1 PHE 45 HD1 PHE 45 -2.862 1.180 2.484
321 HD2 PHE 45 HD2 PHE 45 -0.636 1.659 -1.120
322 HE1 PHE 45 HE1 PHE 45 -0.823 1.597 3.798
323 HE2 PHE 45 HE2 PHE 45 1.402 2.080 0.194
324 HZ PHE 45 HZ PHE 45 1.308 2.048 2.655
325 H GLY 46 H GLY 46 -3.163 2.959 -2.327
326 HA2 GLY 46 2HA GLY 46 -1.634 5.176 -1.544
327 HA3 GLY 46 1HA GLY 46 -2.201 4.871 -3.179
328 H ASN 47 H ASN 47 -5.040 4.965 -2.252
329 HA ASN 47 HA ASN 47 -5.529 7.743 -2.644
330 HB2 ASN 47 2HB ASN 47 -7.056 5.914 -3.385
331 HB3 ASN 47 1HB ASN 47 -7.446 5.592 -1.702
332 HD21 ASN 47 1HD2 ASN 47 -9.159 6.394 -3.931
333 HD22 ASN 47 2HD2 ASN 47 -9.954 7.842 -3.405
334 H TYR 48 H TYR 48 -6.380 5.661 0.163
335 HA TYR 48 HA TYR 48 -7.049 7.896 1.792
336 HB2 TYR 48 2HB TYR 48 -7.947 5.538 2.049
337 HB3 TYR 48 1HB TYR 48 -6.411 5.107 2.790
338 HD1 TYR 48 HD2 TYR 48 -9.224 7.541 3.124
339 HD2 TYR 48 HD1 TYR 48 -6.160 5.351 5.107
340 HE1 TYR 48 HE2 TYR 48 -10.072 8.326 5.291
341 HE2 TYR 48 HE1 TYR 48 -7.000 6.139 7.280
342 HH TYR 48 HH TYR 48 -8.326 8.020 8.175
343 H LEU 49 H LEU 49 -4.075 6.092 1.318
344 HA LEU 49 HA LEU 49 -2.623 7.026 3.539
345 HB2 LEU 49 2HB LEU 49 -1.785 5.221 2.155
346 HB3 LEU 49 1HB LEU 49 -1.667 6.286 0.767
347 HG LEU 49 HG LEU 49 0.114 7.566 1.881
348 HD11 LEU 49 1HD1 LEU 49 -0.152 5.529 4.096
349 HD12 LEU 49 2HD1 LEU 49 -0.555 7.244 4.199
350 HD13 LEU 49 3HD1 LEU 49 1.119 6.748 3.960
351 HD21 LEU 49 3HD2 LEU 49 0.633 4.591 1.813
352 HD22 LEU 49 1HD2 LEU 49 1.862 5.857 1.776
353 HD23 LEU 49 2HD2 LEU 49 0.723 5.697 0.441
354 H ASN 50 H ASN 50 -3.024 8.424 0.289
355 HA ASN 50 HA ASN 50 -1.286 10.623 0.711
356 HB2 ASN 50 2HB ASN 50 -2.047 9.758 -1.526
357 HB3 ASN 50 1HB ASN 50 -3.617 10.495 -1.218
358 HD21 ASN 50 1HD2 ASN 50 -0.215 11.144 -1.735
359 HD22 ASN 50 2HD2 ASN 50 -0.411 12.788 -2.221
360 H LYS 51 H LYS 51 -4.535 10.022 1.723
361 HA LYS 51 HA LYS 51 -5.295 12.751 2.179
362 HB2 LYS 51 2HB LYS 51 -6.359 10.177 3.368
363 HB3 LYS 51 1HB LYS 51 -7.100 11.758 3.581
364 HG2 LYS 51 2HG LYS 51 -7.493 11.901 1.165
365 HG3 LYS 51 1HG LYS 51 -6.735 10.321 0.953
366 HD2 LYS 51 2HD LYS 51 -9.167 10.114 0.962
367 HD3 LYS 51 1HD LYS 51 -8.465 9.302 2.363
368 HE2 LYS 51 2HE LYS 51 -10.451 10.543 3.011
369 HE3 LYS 51 1HE LYS 51 -9.019 11.243 3.759
370 HZ1 LYS 51 3HZ LYS 51 -10.387 12.288 1.340
371 HZ2 LYS 51 1HZ LYS 51 -9.022 12.971 2.068
372 HZ3 LYS 51 2HZ LYS 51 -10.497 12.944 2.893
373 H LEU 52 H LEU 52 -3.661 10.280 4.089
374 HA LEU 52 HA LEU 52 -3.627 11.967 6.470
375 HB2 LEU 52 2HB LEU 52 -2.244 9.313 6.024
376 HB3 LEU 52 1HB LEU 52 -2.492 10.121 7.561
377 HG LEU 52 HG LEU 52 -4.579 8.816 5.812
378 HD11 LEU 52 1HD1 LEU 52 -3.677 8.247 8.636
379 HD12 LEU 52 2HD1 LEU 52 -3.291 7.291 7.204
380 HD13 LEU 52 3HD1 LEU 52 -4.958 7.402 7.764
381 HD21 LEU 52 3HD2 LEU 52 -6.242 9.494 7.480
382 HD22 LEU 52 1HD2 LEU 52 -5.515 10.889 6.683
383 HD23 LEU 52 2HD2 LEU 52 -5.017 10.449 8.317
384 H GLN 53 H GLN 53 -1.217 10.514 4.274
385 HA GLN 53 HA GLN 53 0.607 12.744 4.912
386 HB2 GLN 53 2HB GLN 53 1.268 9.841 4.405
387 HB3 GLN 53 1HB GLN 53 2.475 11.116 4.315
388 HG2 GLN 53 2HG GLN 53 0.842 10.419 6.756
389 HG3 GLN 53 1HG GLN 53 2.512 9.938 6.462
390 HE21 GLN 53 1HE2 GLN 53 0.402 12.521 7.359
391 HE22 GLN 53 2HE2 GLN 53 1.630 13.650 7.799
392 HA PRO 54 HA PRO 54 -0.294 13.006 0.387
393 HB2 PRO 54 2HB PRO 54 0.115 15.881 0.797
394 HB3 PRO 54 1HB PRO 54 -1.309 15.033 0.192
395 HG2 PRO 54 2HG PRO 54 -1.250 16.239 2.616
396 HG3 PRO 54 1HG PRO 54 -2.223 14.792 2.291
397 HD2 PRO 54 2HD PRO 54 0.432 15.026 3.673
398 HD3 PRO 54 1HD PRO 54 -0.972 14.017 4.090
399 H ASP 55 H ASP 55 2.246 14.361 2.367
400 HA ASP 55 HA ASP 55 3.942 15.013 0.104
401 HB2 ASP 55 2HB ASP 55 3.755 16.456 2.147
402 HB3 ASP 55 1HB ASP 55 4.545 15.182 3.067
403 H PHE 56 H PHE 56 3.221 12.150 1.484
404 HA PHE 56 HA PHE 56 5.844 11.093 2.029
405 HB2 PHE 56 2HB PHE 56 3.881 10.216 3.193
406 HB3 PHE 56 1HB PHE 56 3.192 9.673 1.669
407 HD1 PHE 56 HD1 PHE 56 6.195 9.235 3.838
408 HD2 PHE 56 HD2 PHE 56 3.589 7.497 0.949
409 HE1 PHE 56 HE1 PHE 56 7.335 7.070 4.116
410 HE2 PHE 56 HE2 PHE 56 4.731 5.332 1.217
411 HZ PHE 56 HZ PHE 56 6.607 5.115 2.803
412 H ASP 57 H ASP 57 7.208 11.063 0.332
413 HA ASP 57 HA ASP 57 6.261 9.968 -2.229
414 HB2 ASP 57 2HB ASP 57 6.936 12.244 -2.493
415 HB3 ASP 57 1HB ASP 57 8.445 11.963 -1.626
416 H SER 58 H SER 58 7.373 8.384 -3.287
417 HA SER 58 HA SER 58 9.075 6.686 -1.687
418 HB2 SER 58 2HB SER 58 8.141 6.377 -4.554
419 HB3 SER 58 1HB SER 58 8.962 5.135 -3.610
420 HG SER 58 HG SER 58 6.506 6.335 -2.835
421 H ARG 59 H ARG 59 9.530 8.868 -4.436
422 HA ARG 59 HA ARG 59 12.057 8.003 -5.296
423 HB2 ARG 59 2HB ARG 59 10.930 10.813 -5.288
424 HB3 ARG 59 1HB ARG 59 12.353 10.309 -6.185
425 HG2 ARG 59 2HG ARG 59 9.613 9.124 -6.599
426 HG3 ARG 59 1HG ARG 59 10.246 10.486 -7.525
427 HD2 ARG 59 2HD ARG 59 12.076 9.108 -8.343
428 HD3 ARG 59 1HD ARG 59 11.522 7.750 -7.367
429 HE ARG 59 HE ARG 59 9.397 7.993 -8.788
430 HH11 ARG 59 1HH1 ARG 59 12.575 8.651 -9.953
431 HH12 ARG 59 2HH1 ARG 59 12.189 8.195 -11.574
432 HH21 ARG 59 1HH2 ARG 59 8.911 7.429 -10.869
433 HH22 ARG 59 2HH2 ARG 59 10.140 7.491 -12.087
434 H LEU 60 H LEU 60 11.142 10.069 -2.595
435 HA LEU 60 HA LEU 60 13.556 11.126 -1.770
436 HB2 LEU 60 2HB LEU 60 11.489 9.880 0.053
437 HB3 LEU 60 1HB LEU 60 12.675 11.090 0.503
438 HG LEU 60 HG LEU 60 10.363 11.510 -1.402
439 HD11 LEU 60 1HD1 LEU 60 9.458 12.949 0.356
440 HD12 LEU 60 2HD1 LEU 60 10.798 12.507 1.414
441 HD13 LEU 60 3HD1 LEU 60 9.632 11.283 0.909
442 HD21 LEU 60 3HD2 LEU 60 11.007 13.880 -1.328
443 HD22 LEU 60 1HD2 LEU 60 12.271 12.875 -2.033
444 HD23 LEU 60 2HD2 LEU 60 12.431 13.460 -0.375
445 H TYR 61 H TYR 61 12.364 7.835 -1.308
446 HA TYR 61 HA TYR 61 14.715 7.061 0.247
447 HB2 TYR 61 2HB TYR 61 12.311 5.425 -0.618
448 HB3 TYR 61 1HB TYR 61 13.550 4.916 0.525
449 HD1 TYR 61 HD1 TYR 61 10.852 7.424 -0.004
450 HD2 TYR 61 HD2 TYR 61 13.355 5.457 2.826
451 HE1 TYR 61 HE1 TYR 61 9.546 8.404 1.830
452 HE2 TYR 61 HE2 TYR 61 12.044 6.433 4.664
453 HH TYR 61 HH TYR 61 9.036 7.934 4.185
454 H GLY 62 H GLY 62 14.211 7.471 -2.942
455 HA2 GLY 62 2HA GLY 62 15.749 6.865 -4.627
456 HA3 GLY 62 1HA GLY 62 16.241 5.485 -3.662
457 H TYR 63 H TYR 63 12.987 5.326 -3.559
458 HA TYR 63 HA TYR 63 12.905 3.192 -5.500
459 HB2 TYR 63 2HB TYR 63 10.871 4.279 -3.553
460 HB3 TYR 63 1HB TYR 63 10.493 2.991 -4.693
461 HD1 TYR 63 HD1 TYR 63 12.833 3.877 -1.922
462 HD2 TYR 63 HD2 TYR 63 10.994 0.780 -4.188
463 HE1 TYR 63 HE1 TYR 63 13.748 2.205 -0.370
464 HE2 TYR 63 HE2 TYR 63 11.899 -0.895 -2.652
465 HH TYR 63 HH TYR 63 13.779 -1.116 -1.062
466 H LYS 64 H LYS 64 11.283 2.969 -7.156
467 HA LYS 64 HA LYS 64 11.189 5.325 -8.791
468 HB2 LYS 64 2HB LYS 64 9.863 2.654 -9.305
469 HB3 LYS 64 1HB LYS 64 10.238 3.891 -10.498
470 HG2 LYS 64 2HG LYS 64 12.215 2.230 -8.936
471 HG3 LYS 64 1HG LYS 64 11.835 2.090 -10.654
472 HD2 LYS 64 2HD LYS 64 13.061 4.525 -9.340
473 HD3 LYS 64 1HD LYS 64 13.960 3.296 -10.227
474 HE2 LYS 64 2HE LYS 64 11.787 5.059 -11.367
475 HE3 LYS 64 1HE LYS 64 13.520 5.277 -11.606
476 HZ1 LYS 64 3HZ LYS 64 13.576 3.091 -12.687
477 HZ2 LYS 64 1HZ LYS 64 12.549 4.170 -13.490
478 HZ3 LYS 64 2HZ LYS 64 11.900 2.961 -12.511
479 H LYS 65 H LYS 65 8.757 3.392 -7.074
480 HA LYS 65 HA LYS 65 7.068 5.661 -6.718
481 HB2 LYS 65 2HB LYS 65 5.088 4.783 -7.925
482 HB3 LYS 65 1HB LYS 65 6.407 5.217 -9.002
483 HG2 LYS 65 2HG LYS 65 7.023 2.833 -9.172
484 HG3 LYS 65 1HG LYS 65 5.650 2.426 -8.137
485 HD2 LYS 65 2HD LYS 65 4.117 3.408 -9.794
486 HD3 LYS 65 1HD LYS 65 5.490 3.797 -10.832
487 HE2 LYS 65 2HE LYS 65 6.007 1.424 -11.059
488 HE3 LYS 65 1HE LYS 65 4.679 1.016 -9.973
489 HZ1 LYS 65 3HZ LYS 65 3.197 2.156 -11.630
490 HZ2 LYS 65 1HZ LYS 65 3.892 0.704 -12.152
491 HZ3 LYS 65 2HZ LYS 65 4.515 2.177 -12.687
492 H LEU 66 H LEU 66 4.866 4.899 -5.725
493 HA LEU 66 HA LEU 66 5.450 3.762 -3.284
494 HB2 LEU 66 2HB LEU 66 3.485 5.168 -3.753
495 HB3 LEU 66 1HB LEU 66 2.756 3.849 -4.649
496 HG LEU 66 HG LEU 66 2.668 2.506 -2.570
497 HD11 LEU 66 1HD1 LEU 66 3.672 5.025 -1.241
498 HD12 LEU 66 2HD1 LEU 66 4.550 3.502 -1.386
499 HD13 LEU 66 3HD1 LEU 66 3.083 3.584 -0.411
500 HD21 LEU 66 3HD2 LEU 66 0.856 3.756 -1.500
501 HD22 LEU 66 1HD2 LEU 66 0.729 3.824 -3.258
502 HD23 LEU 66 2HD2 LEU 66 1.344 5.215 -2.363
503 H SER 67 H SER 67 3.981 2.115 -6.086
504 HA SER 67 HA SER 67 3.418 -0.341 -4.876
505 HB2 SER 67 2HB SER 67 3.522 -1.284 -7.198
506 HB3 SER 67 1HB SER 67 2.537 0.175 -7.072
507 HG SER 67 HG SER 67 4.846 -0.273 -8.473
508 H ASP 68 H ASP 68 6.430 0.769 -6.404
509 HA ASP 68 HA ASP 68 7.830 -1.699 -6.227
510 HB2 ASP 68 2HB ASP 68 8.439 0.303 -7.674
511 HB3 ASP 68 1HB ASP 68 9.047 1.075 -6.210
512 H LEU 69 H LEU 69 7.442 1.048 -4.083
513 HA LEU 69 HA LEU 69 9.400 0.346 -2.152
514 HB2 LEU 69 2HB LEU 69 8.587 2.618 -2.371
515 HB3 LEU 69 1HB LEU 69 6.954 2.111 -1.985
516 HG LEU 69 HG LEU 69 7.691 1.527 0.308
517 HD11 LEU 69 1HD1 LEU 69 10.329 2.733 -0.527
518 HD12 LEU 69 2HD1 LEU 69 10.033 1.029 -0.182
519 HD13 LEU 69 3HD1 LEU 69 9.885 2.227 1.102
520 HD21 LEU 69 3HD2 LEU 69 7.991 3.827 1.111
521 HD22 LEU 69 1HD2 LEU 69 6.733 3.727 -0.121
522 HD23 LEU 69 2HD2 LEU 69 8.327 4.360 -0.538
523 H VAL 70 H VAL 70 5.859 -0.061 -2.185
524 HA VAL 70 HA VAL 70 5.549 -1.083 0.380
525 HB VAL 70 HB VAL 70 3.872 -1.712 -2.062
526 HG11 VAL 70 1HG1 VAL 70 3.208 -2.008 0.873
527 HG12 VAL 70 2HG1 VAL 70 3.455 -3.322 -0.276
528 HG13 VAL 70 3HG1 VAL 70 2.079 -2.236 -0.463
529 HG21 VAL 70 3HG2 VAL 70 4.065 0.697 -1.573
530 HG22 VAL 70 1HG2 VAL 70 3.492 0.403 0.068
531 HG23 VAL 70 2HG2 VAL 70 2.429 0.099 -1.307
532 H LYS 71 H LYS 71 5.650 -3.054 -2.637
533 HA LYS 71 HA LYS 71 5.632 -5.497 -1.197
534 HB2 LYS 71 2HB LYS 71 6.011 -6.607 -3.313
535 HB3 LYS 71 1HB LYS 71 4.816 -5.333 -3.506
536 HG2 LYS 71 2HG LYS 71 6.502 -3.891 -4.530
537 HG3 LYS 71 1HG LYS 71 7.720 -5.151 -4.308
538 HD2 LYS 71 2HD LYS 71 5.227 -5.350 -6.012
539 HD3 LYS 71 1HD LYS 71 6.879 -5.164 -6.599
540 HE2 LYS 71 2HE LYS 71 7.468 -7.342 -5.623
541 HE3 LYS 71 1HE LYS 71 5.818 -7.529 -5.033
542 HZ1 LYS 71 3HZ LYS 71 6.722 -7.460 -7.859
543 HZ2 LYS 71 1HZ LYS 71 5.095 -7.384 -7.397
544 HZ3 LYS 71 2HZ LYS 71 6.013 -8.755 -7.036
545 H ALA 72 H ALA 72 8.207 -3.360 -2.027
546 HA ALA 72 HA ALA 72 10.325 -5.268 -1.694
547 HB1 ALA 72 3HB ALA 72 11.807 -3.336 -1.655
548 HB2 ALA 72 1HB ALA 72 10.419 -2.256 -1.511
549 HB3 ALA 72 2HB ALA 72 10.648 -3.209 -2.977
550 H ARG 73 H ARG 73 8.830 -2.810 0.410
551 HA ARG 73 HA ARG 73 10.500 -3.618 2.666
552 HB2 ARG 73 2HB ARG 73 8.396 -1.456 2.405
553 HB3 ARG 73 1HB ARG 73 9.320 -1.763 3.869
554 HG2 ARG 73 2HG ARG 73 10.429 -0.892 1.203
555 HG3 ARG 73 1HG ARG 73 10.253 0.109 2.643
556 HD2 ARG 73 2HD ARG 73 12.040 -2.312 2.350
557 HD3 ARG 73 1HD ARG 73 12.556 -0.626 2.385
558 HE ARG 73 HE ARG 73 11.337 -0.796 4.733
559 HH11 ARG 73 1HH1 ARG 73 13.512 -3.026 3.252
560 HH12 ARG 73 2HH1 ARG 73 14.155 -3.561 4.762
561 HH21 ARG 73 1HH2 ARG 73 12.157 -1.515 6.663
562 HH22 ARG 73 2HH2 ARG 73 13.382 -2.738 6.677
563 H THR 74 H THR 74 9.354 -5.822 2.381
564 HA THR 74 HA THR 74 6.765 -6.261 3.394
565 HB THR 74 HB THR 74 7.499 -8.571 3.887
566 HG1 THR 74 HG1 THR 74 9.647 -9.139 3.672
567 HG21 THR 74 3HG2 THR 74 8.183 -9.191 1.599
568 HG22 THR 74 1HG2 THR 74 8.528 -7.496 1.250
569 HG23 THR 74 2HG2 THR 74 6.875 -8.008 1.591
570 H ASP 75 H ASP 75 9.640 -5.311 4.974
571 HA ASP 75 HA ASP 75 9.440 -6.083 7.586
572 HB2 ASP 75 2HB ASP 75 11.191 -4.602 6.666
573 HB3 ASP 75 1HB ASP 75 10.024 -3.292 6.545
574 H LEU 76 H LEU 76 7.429 -3.756 5.889
575 HA LEU 76 HA LEU 76 5.851 -3.275 8.338
576 HB2 LEU 76 2HB LEU 76 6.087 -1.584 5.843
577 HB3 LEU 76 1HB LEU 76 5.117 -1.191 7.249
578 HG LEU 76 HG LEU 76 8.133 -1.415 7.226
579 HD11 LEU 76 1HD1 LEU 76 7.351 0.520 5.954
580 HD12 LEU 76 2HD1 LEU 76 8.124 1.017 7.459
581 HD13 LEU 76 3HD1 LEU 76 6.365 1.033 7.325
582 HD21 LEU 76 3HD2 LEU 76 7.138 -1.997 9.390
583 HD22 LEU 76 1HD2 LEU 76 6.259 -0.467 9.397
584 HD23 LEU 76 2HD2 LEU 76 8.022 -0.474 9.469
585 H PHE 77 H PHE 77 5.615 -4.095 4.889
586 HA PHE 77 HA PHE 77 2.686 -4.381 5.212
587 HB2 PHE 77 2HB PHE 77 4.123 -3.655 2.649
588 HB3 PHE 77 1HB PHE 77 2.392 -3.587 2.966
589 HD1 PHE 77 HD1 PHE 77 1.950 -2.106 5.284
590 HD2 PHE 77 HD2 PHE 77 5.095 -1.588 2.451
591 HE1 PHE 77 HE1 PHE 77 2.211 0.240 5.993
592 HE2 PHE 77 HE2 PHE 77 5.350 0.752 3.153
593 HZ PHE 77 HZ PHE 77 3.911 1.665 4.926
594 H VAL 78 H VAL 78 1.912 -6.393 4.887
595 HA VAL 78 HA VAL 78 3.451 -8.388 3.420
596 HB VAL 78 HB VAL 78 0.688 -8.608 4.646
597 HG11 VAL 78 1HG1 VAL 78 2.548 -10.750 3.604
598 HG12 VAL 78 2HG1 VAL 78 1.014 -10.253 2.888
599 HG13 VAL 78 3HG1 VAL 78 1.034 -11.044 4.464
600 HG21 VAL 78 3HG2 VAL 78 2.359 -8.169 6.356
601 HG22 VAL 78 1HG2 VAL 78 3.362 -9.482 5.741
602 HG23 VAL 78 2HG2 VAL 78 1.793 -9.836 6.466
603 H THR 79 H THR 79 3.218 -8.706 1.268
604 HA THR 79 HA THR 79 0.888 -7.450 -0.065
605 HB THR 79 HB THR 79 2.290 -6.993 -1.984
606 HG1 THR 79 HG1 THR 79 3.909 -8.351 -2.244
607 HG21 THR 79 3HG2 THR 79 3.820 -5.366 -1.041
608 HG22 THR 79 1HG2 THR 79 3.769 -6.175 0.525
609 HG23 THR 79 2HG2 THR 79 2.331 -5.374 -0.101
610 H GLU 80 H GLU 80 -0.400 -8.701 -1.270
611 HA GLU 80 HA GLU 80 0.692 -11.014 -2.683
612 HB2 GLU 80 2HB GLU 80 -1.613 -11.197 -0.731
613 HB3 GLU 80 1HB GLU 80 -1.325 -12.402 -1.977
614 HG2 GLU 80 2HG GLU 80 0.895 -12.850 -1.007
615 HG3 GLU 80 1HG GLU 80 0.562 -11.678 0.266
616 H GLU 81 H GLU 81 -0.086 -11.158 -4.693
617 HA GLU 81 HA GLU 81 -2.052 -9.186 -5.543
618 HB2 GLU 81 2HB GLU 81 -0.424 -11.131 -7.194
619 HB3 GLU 81 1HB GLU 81 -1.351 -9.767 -7.808
620 HG2 GLU 81 2HG GLU 81 0.118 -8.216 -6.658
621 HG3 GLU 81 1HG GLU 81 1.015 -9.558 -5.950
622 H ARG 82 H ARG 82 -4.116 -9.608 -6.052
623 HA ARG 82 HA ARG 82 -4.980 -12.439 -6.235
624 HB2 ARG 82 2HB ARG 82 -6.638 -10.082 -5.310
625 HB3 ARG 82 1HB ARG 82 -7.114 -11.771 -5.292
626 HG2 ARG 82 2HG ARG 82 -4.853 -10.641 -3.651
627 HG3 ARG 82 1HG ARG 82 -6.507 -10.822 -3.070
628 HD2 ARG 82 2HD ARG 82 -6.240 -13.303 -3.745
629 HD3 ARG 82 1HD ARG 82 -4.509 -12.949 -3.775
630 HE ARG 82 HE ARG 82 -5.685 -12.048 -1.359
631 HH11 ARG 82 1HH1 ARG 82 -4.631 -14.918 -2.933
632 HH12 ARG 82 2HH1 ARG 82 -4.363 -15.762 -1.452
633 HH21 ARG 82 1HH2 ARG 82 -5.343 -13.151 0.532
634 HH22 ARG 82 2HH2 ARG 82 -4.774 -14.781 0.483
635 H GLN 83 H GLN 83 -6.486 -12.990 -7.856
636 HA GLN 83 HA GLN 83 -6.761 -11.138 -10.061
637 HB2 GLN 83 2HB GLN 83 -6.494 -13.566 -10.472
638 HB3 GLN 83 1HB GLN 83 -8.034 -13.863 -9.673
639 HG2 GLN 83 2HG GLN 83 -9.177 -12.527 -11.390
640 HG3 GLN 83 1HG GLN 83 -7.631 -12.251 -12.191
641 HE21 GLN 83 1HE2 GLN 83 -10.083 -13.554 -13.141
642 HE22 GLN 83 2HE2 GLN 83 -9.603 -15.134 -13.651
643 H VAL 84 H VAL 84 -8.443 -9.802 -10.440
644 HA VAL 84 HA VAL 84 -10.476 -9.583 -8.369
645 HB VAL 84 HB VAL 84 -9.981 -7.767 -10.743
646 HG11 VAL 84 1HG1 VAL 84 -12.205 -7.494 -9.781
647 HG12 VAL 84 2HG1 VAL 84 -11.203 -6.088 -9.429
648 HG13 VAL 84 3HG1 VAL 84 -11.504 -7.290 -8.174
649 HG21 VAL 84 3HG2 VAL 84 -7.971 -7.886 -9.375
650 HG22 VAL 84 1HG2 VAL 84 -8.916 -7.558 -7.919
651 HG23 VAL 84 2HG2 VAL 84 -8.753 -6.320 -9.163
652 HA PRO 85 HA PRO 85 -13.658 -11.785 -10.657
653 HB2 PRO 85 2HB PRO 85 -15.383 -9.778 -9.251
654 HB3 PRO 85 1HB PRO 85 -15.575 -11.532 -9.384
655 HG2 PRO 85 2HG PRO 85 -14.662 -10.449 -7.131
656 HG3 PRO 85 1HG PRO 85 -13.971 -11.961 -7.749
657 HD2 PRO 85 2HD PRO 85 -12.841 -9.196 -7.810
658 HD3 PRO 85 1HD PRO 85 -12.007 -10.753 -7.620
659 H GLY 86 H GLY 86 -13.802 -11.365 -12.790
660 HA2 GLY 86 2HA GLY 86 -14.872 -10.339 -14.633
661 HA3 GLY 86 1HA GLY 86 -15.121 -8.895 -13.667
662 H SER 87 H SER 87 -11.972 -9.905 -13.253
663 HA SER 87 HA SER 87 -11.004 -8.104 -15.391
664 HB2 SER 87 2HB SER 87 -9.829 -8.533 -12.627
665 HB3 SER 87 1HB SER 87 -9.105 -7.540 -13.892
666 HG SER 87 HG SER 87 -10.604 -6.591 -12.152
667 H THR 88 H THR 88 -9.590 -8.928 -16.817
668 HA THR 88 HA THR 88 -8.600 -11.635 -16.517
669 HB THR 88 HB THR 88 -9.232 -10.929 -18.748
670 HG1 THR 88 HG1 THR 88 -7.035 -12.148 -18.189
671 HG21 THR 88 3HG2 THR 88 -8.032 -9.200 -19.980
672 HG22 THR 88 1HG2 THR 88 -7.024 -8.870 -18.572
673 HG23 THR 88 2HG2 THR 88 -8.752 -8.518 -18.520
674 H GLN 89 H GLN 89 -7.449 -8.479 -15.814
675 HA GLN 89 HA GLN 89 -4.728 -9.488 -15.308
676 HB2 GLN 89 2HB GLN 89 -4.067 -7.159 -15.049
677 HB3 GLN 89 1HB GLN 89 -4.897 -7.378 -16.585
678 HG2 GLN 89 2HG GLN 89 -6.959 -6.469 -15.555
679 HG3 GLN 89 1HG GLN 89 -6.052 -6.189 -14.067
680 HE21 GLN 89 1HE2 GLN 89 -6.461 -5.203 -17.392
681 HE22 GLN 89 2HE2 GLN 89 -5.621 -3.702 -17.245
682 H LYS 90 H LYS 90 -3.831 -9.407 -13.240
683 HA LYS 90 HA LYS 90 -5.805 -9.353 -11.076
684 HB2 LYS 90 2HB LYS 90 -4.136 -10.599 -9.790
685 HB3 LYS 90 1HB LYS 90 -4.479 -11.380 -11.326
686 HG2 LYS 90 2HG LYS 90 -2.406 -10.314 -12.244
687 HG3 LYS 90 1HG LYS 90 -2.040 -9.765 -10.608
688 HD2 LYS 90 2HD LYS 90 -2.287 -12.618 -11.577
689 HD3 LYS 90 1HD LYS 90 -0.822 -11.804 -11.029
690 HE2 LYS 90 2HE LYS 90 -1.798 -11.611 -8.771
691 HE3 LYS 90 1HE LYS 90 -3.242 -12.450 -9.339
692 HZ1 LYS 90 3HZ LYS 90 -1.773 -13.962 -8.205
693 HZ2 LYS 90 1HZ LYS 90 -0.498 -13.573 -9.243
694 HZ3 LYS 90 2HZ LYS 90 -1.861 -14.377 -9.839
695 H ALA 91 H ALA 91 -5.465 -8.229 -9.119
696 HA ALA 91 HA ALA 91 -3.705 -5.867 -9.402
697 HB1 ALA 91 3HB ALA 91 -6.100 -5.336 -9.387
698 HB2 ALA 91 1HB ALA 91 -5.284 -4.671 -7.972
699 HB3 ALA 91 2HB ALA 91 -6.266 -6.127 -7.818
700 H LEU 92 H LEU 92 -2.826 -4.960 -7.419
701 HA LEU 92 HA LEU 92 -1.803 -7.052 -5.667
702 HB2 LEU 92 2HB LEU 92 -0.204 -5.516 -6.638
703 HB3 LEU 92 1HB LEU 92 -1.076 -4.138 -5.995
704 HG LEU 92 HG LEU 92 -0.527 -4.975 -3.677
705 HD11 LEU 92 1HD1 LEU 92 1.347 -6.803 -5.179
706 HD12 LEU 92 2HD1 LEU 92 -0.078 -7.308 -4.270
707 HD13 LEU 92 3HD1 LEU 92 1.286 -6.572 -3.430
708 HD21 LEU 92 3HD2 LEU 92 0.713 -3.147 -4.691
709 HD22 LEU 92 1HD2 LEU 92 1.790 -4.294 -5.490
710 HD23 LEU 92 2HD2 LEU 92 1.784 -4.166 -3.731
711 H TYR 93 H TYR 93 -2.635 -7.472 -3.723
712 HA TYR 93 HA TYR 93 -4.167 -5.369 -2.331
713 HB2 TYR 93 2HB TYR 93 -4.389 -8.386 -2.203
714 HB3 TYR 93 1HB TYR 93 -5.163 -7.320 -1.034
715 HD1 TYR 93 HD1 TYR 93 -5.006 -8.092 -4.675
716 HD2 TYR 93 HD2 TYR 93 -7.244 -6.343 -1.504
717 HE1 TYR 93 HE1 TYR 93 -6.925 -7.821 -6.186
718 HE2 TYR 93 HE2 TYR 93 -9.169 -6.072 -3.007
719 HH TYR 93 HH TYR 93 -9.590 -5.889 -5.447
720 H LEU 94 H LEU 94 -3.830 -5.018 -0.113
721 HA LEU 94 HA LEU 94 -1.187 -5.935 0.851
722 HB2 LEU 94 2HB LEU 94 -2.349 -3.169 1.219
723 HB3 LEU 94 1HB LEU 94 -0.739 -3.706 1.660
724 HG LEU 94 HG LEU 94 -1.793 -3.422 -1.162
725 HD11 LEU 94 1HD1 LEU 94 -0.188 -1.575 -1.325
726 HD12 LEU 94 2HD1 LEU 94 0.198 -1.765 0.385
727 HD13 LEU 94 3HD1 LEU 94 -1.424 -1.271 -0.104
728 HD21 LEU 94 3HD2 LEU 94 -0.182 -5.249 -0.979
729 HD22 LEU 94 1HD2 LEU 94 0.964 -4.165 -0.191
730 HD23 LEU 94 2HD2 LEU 94 0.495 -3.885 -1.867
731 H ARG 95 H ARG 95 -0.887 -6.113 3.086
732 HA ARG 95 HA ARG 95 -2.957 -5.237 4.922
733 HB2 ARG 95 2HB ARG 95 -3.063 -7.454 6.084
734 HB3 ARG 95 1HB ARG 95 -3.799 -7.448 4.487
735 HG2 ARG 95 2HG ARG 95 -1.847 -8.545 3.551
736 HG3 ARG 95 1HG ARG 95 -1.039 -8.485 5.117
737 HD2 ARG 95 2HD ARG 95 -2.645 -9.986 6.080
738 HD3 ARG 95 1HD ARG 95 -3.654 -9.913 4.635
739 HE ARG 95 HE ARG 95 -1.267 -10.854 3.728
740 HH11 ARG 95 1HH1 ARG 95 -3.457 -11.872 6.188
741 HH12 ARG 95 2HH1 ARG 95 -3.085 -13.545 5.970
742 HH21 ARG 95 1HH2 ARG 95 -0.828 -13.011 3.442
743 HH22 ARG 95 2HH2 ARG 95 -1.609 -14.175 4.458
744 H ALA 96 H ALA 96 -2.218 -5.208 7.150
745 HA ALA 96 HA ALA 96 0.452 -4.259 7.298
746 HB1 ALA 96 3HB ALA 96 -0.017 -3.829 9.647
747 HB2 ALA 96 1HB ALA 96 -1.472 -4.827 9.555
748 HB3 ALA 96 2HB ALA 96 -1.373 -3.321 8.641
749 H LYS 97 H LYS 97 2.256 -5.046 8.378
750 HA LYS 97 HA LYS 97 2.490 -7.903 8.661
751 HB2 LYS 97 2HB LYS 97 4.393 -6.678 7.825
752 HB3 LYS 97 1HB LYS 97 4.401 -5.623 9.228
753 HG2 LYS 97 2HG LYS 97 6.201 -7.151 9.479
754 HG3 LYS 97 1HG LYS 97 4.957 -7.618 10.636
755 HD2 LYS 97 2HD LYS 97 5.832 -9.608 9.615
756 HD3 LYS 97 1HD LYS 97 4.192 -9.360 9.014
757 HE2 LYS 97 2HE LYS 97 5.019 -8.513 6.923
758 HE3 LYS 97 1HE LYS 97 6.673 -8.475 7.535
759 HZ1 LYS 97 3HZ LYS 97 6.271 -10.380 6.096
760 HZ2 LYS 97 1HZ LYS 97 5.056 -10.936 7.133
761 HZ3 LYS 97 2HZ LYS 97 6.662 -10.872 7.663
762 H LEU 98 H LEU 98 1.251 -8.654 10.319
763 HA LEU 98 HA LEU 98 1.622 -7.488 13.001
764 HB2 LEU 98 2HB LEU 98 -0.545 -9.333 11.982
765 HB3 LEU 98 1HB LEU 98 -0.465 -8.647 13.594
766 HG LEU 98 HG LEU 98 -0.839 -7.083 11.031
767 HD11 LEU 98 1HD1 LEU 98 -2.793 -7.722 13.246
768 HD12 LEU 98 2HD1 LEU 98 -2.817 -8.380 11.609
769 HD13 LEU 98 3HD1 LEU 98 -3.104 -6.661 11.871
770 HD21 LEU 98 3HD2 LEU 98 0.397 -5.798 12.703
771 HD22 LEU 98 1HD2 LEU 98 -0.855 -6.138 13.901
772 HD23 LEU 98 2HD2 LEU 98 -1.229 -5.156 12.485
773 H GLU 99 H GLU 99 3.313 -8.505 13.957
774 HA GLU 99 HA GLU 99 2.993 -11.317 14.582
775 HB2 GLU 99 2HB GLU 99 5.125 -12.067 13.797
776 HB3 GLU 99 1HB GLU 99 4.334 -11.261 12.455
777 HG2 GLU 99 2HG GLU 99 6.418 -10.384 12.223
778 HG3 GLU 99 1HG GLU 99 5.744 -9.191 13.331
779 H HIS 100 H HIS 100 5.039 -11.977 16.009
780 HA HIS 100 HA HIS 100 5.994 -9.751 17.637
781 HB2 HIS 100 2HB HIS 100 3.944 -10.415 18.783
782 HB3 HIS 100 1HB HIS 100 4.469 -12.095 18.809
783 HD1 HIS 100 HD1 HIS 100 6.404 -12.697 20.468
784 HD2 HIS 100 HD2 HIS 100 5.003 -8.798 20.779
785 HE1 HIS 100 HE1 HIS 100 7.314 -11.830 22.638
786 HE2 HIS 100 HE2 HIS 100 6.351 -9.516 22.867
787 H HIS 101 H HIS 101 8.112 -10.077 17.196
788 HA HIS 101 HA HIS 101 9.530 -12.370 16.782
789 HB2 HIS 101 2HB HIS 101 10.496 -9.972 18.362
790 HB3 HIS 101 1HB HIS 101 11.527 -11.183 17.603
791 HD1 HIS 101 HD1 HIS 101 10.173 -7.936 16.998
792 HD2 HIS 101 HD2 HIS 101 10.990 -11.256 14.634
793 HE1 HIS 101 HE1 HIS 101 10.258 -7.080 14.639
794 HE2 HIS 101 HE2 HIS 101 10.608 -9.125 13.222
795 H HIS 102 H HIS 102 9.732 -14.185 17.886
796 HA HIS 102 HA HIS 102 8.679 -14.547 20.469
797 HB2 HIS 102 2HB HIS 102 10.576 -16.374 18.977
798 HB3 HIS 102 1HB HIS 102 9.527 -16.832 20.314
799 HD1 HIS 102 HD1 HIS 102 9.379 -18.250 17.591
800 HD2 HIS 102 HD2 HIS 102 6.949 -15.066 18.701
801 HE1 HIS 102 HE1 HIS 102 7.345 -18.421 16.138
802 HE2 HIS 102 HE2 HIS 102 5.946 -16.422 16.737
803 H HIS 103 H HIS 103 9.529 -14.272 22.438
804 HA HIS 103 HA HIS 103 12.411 -13.855 22.747
805 HB2 HIS 103 2HB HIS 103 10.818 -12.273 23.821
806 HB3 HIS 103 1HB HIS 103 10.199 -13.593 24.808
807 HD1 HIS 103 HD1 HIS 103 11.014 -13.096 27.110
808 HD2 HIS 103 HD2 HIS 103 13.988 -12.538 24.260
809 HE1 HIS 103 HE1 HIS 103 13.098 -12.565 28.403
810 HE2 HIS 103 HE2 HIS 103 14.818 -12.036 26.658
811 H HIS 104 H HIS 104 10.178 -16.381 22.975
812 HA HIS 104 HA HIS 104 11.725 -17.921 24.923
813 HB2 HIS 104 2HB HIS 104 9.324 -18.755 23.272
814 HB3 HIS 104 1HB HIS 104 10.040 -19.674 24.591
815 HD1 HIS 104 HD1 HIS 104 9.866 -18.433 27.020
816 HD2 HIS 104 HD2 HIS 104 7.314 -17.098 24.019
817 HE1 HIS 104 HE1 HIS 104 8.017 -17.216 28.200
818 HE2 HIS 104 HE2 HIS 104 6.395 -16.590 26.388
819 H HIS 105 H HIS 105 10.680 -18.328 21.528
820 HA HIS 105 HA HIS 105 13.215 -19.381 20.686
821 HB2 HIS 105 2HB HIS 105 12.349 -21.374 21.801
822 HB3 HIS 105 1HB HIS 105 10.848 -21.263 20.891
823 HD1 HIS 105 HD1 HIS 105 14.498 -22.120 20.444
824 HD2 HIS 105 HD2 HIS 105 10.892 -22.418 18.395
825 HE1 HIS 105 HE1 HIS 105 14.963 -23.598 18.472
826 HE2 HIS 105 HE2 HIS 105 12.723 -23.917 17.363
Start of MODEL 17
1 H1 MET 1 1H MET 1 34.289 -15.384 -1.197
2 H2 MET 1 2H MET 1 33.596 -14.356 -2.349
3 H3 MET 1 3H MET 1 34.358 -15.781 -2.840
4 HA MET 1 HA MET 1 31.951 -15.986 -2.915
5 HB2 MET 1 2HB MET 1 33.349 -17.664 -0.821
6 HB3 MET 1 1HB MET 1 31.777 -18.055 -1.505
7 HG2 MET 1 2HG MET 1 34.350 -17.828 -3.058
8 HG3 MET 1 1HG MET 1 33.594 -19.334 -2.540
9 HE1 MET 1 3HE MET 1 30.285 -19.351 -4.635
10 HE2 MET 1 1HE MET 1 30.541 -18.822 -2.972
11 HE3 MET 1 2HE MET 1 31.317 -20.293 -3.562
12 H ASP 2 H ASP 2 29.977 -15.574 -2.024
13 HA ASP 2 HA ASP 2 29.875 -13.651 0.055
14 HB2 ASP 2 2HB ASP 2 27.672 -15.165 -1.355
15 HB3 ASP 2 1HB ASP 2 27.392 -13.841 -0.227
16 H GLN 3 H GLN 3 29.344 -17.143 0.093
17 HA GLN 3 HA GLN 3 28.106 -17.218 2.656
18 HB2 GLN 3 2HB GLN 3 28.893 -19.668 2.644
19 HB3 GLN 3 1HB GLN 3 27.754 -19.156 1.412
20 HG2 GLN 3 2HG GLN 3 29.408 -20.607 0.443
21 HG3 GLN 3 1HG GLN 3 29.593 -18.980 -0.206
22 HE21 GLN 3 1HE2 GLN 3 30.982 -21.398 1.885
23 HE22 GLN 3 2HE2 GLN 3 32.552 -20.681 1.969
24 H LYS 4 H LYS 4 31.294 -16.519 1.780
25 HA LYS 4 HA LYS 4 32.210 -16.885 4.563
26 HB2 LYS 4 2HB LYS 4 33.725 -16.547 1.970
27 HB3 LYS 4 1HB LYS 4 34.499 -16.365 3.538
28 HG2 LYS 4 2HG LYS 4 33.942 -18.668 4.103
29 HG3 LYS 4 1HG LYS 4 33.100 -18.856 2.565
30 HD2 LYS 4 2HD LYS 4 35.356 -19.834 2.497
31 HD3 LYS 4 1HD LYS 4 35.188 -18.500 1.354
32 HE2 LYS 4 2HE LYS 4 36.321 -17.004 2.910
33 HE3 LYS 4 1HE LYS 4 36.443 -18.303 4.095
34 HZ1 LYS 4 3HZ LYS 4 38.499 -17.957 2.845
35 HZ2 LYS 4 1HZ LYS 4 37.697 -18.338 1.404
36 HZ3 LYS 4 2HZ LYS 4 37.874 -19.512 2.609
37 H SER 5 H SER 5 30.392 -14.774 3.681
38 HA SER 5 HA SER 5 31.551 -12.313 3.177
39 HB2 SER 5 2HB SER 5 29.134 -12.631 3.132
40 HB3 SER 5 1HB SER 5 29.108 -12.894 4.875
41 HG SER 5 HG SER 5 29.420 -10.524 3.420
42 H SER 6 H SER 6 33.449 -11.918 4.256
43 HA SER 6 HA SER 6 33.750 -12.038 7.088
44 HB2 SER 6 2HB SER 6 35.712 -12.186 5.671
45 HB3 SER 6 1HB SER 6 35.383 -10.603 4.974
46 HG SER 6 HG SER 6 36.291 -9.688 6.636
47 H SER 7 H SER 7 33.840 -9.128 5.005
48 HA SER 7 HA SER 7 32.242 -7.699 7.043
49 HB2 SER 7 2HB SER 7 34.576 -6.562 5.470
50 HB3 SER 7 1HB SER 7 33.545 -5.649 6.570
51 HG SER 7 HG SER 7 35.677 -7.215 7.118
52 HA PRO 8 HA PRO 8 29.917 -7.378 3.121
53 HB2 PRO 8 2HB PRO 8 27.494 -6.907 4.256
54 HB3 PRO 8 1HB PRO 8 28.191 -8.526 4.130
55 HG2 PRO 8 2HG PRO 8 28.168 -6.654 6.474
56 HG3 PRO 8 1HG PRO 8 27.840 -8.396 6.434
57 HD2 PRO 8 2HD PRO 8 30.233 -7.385 7.213
58 HD3 PRO 8 1HD PRO 8 30.086 -8.947 6.382
59 H GLN 9 H GLN 9 30.627 -5.483 2.226
60 HA GLN 9 HA GLN 9 29.146 -3.067 2.875
61 HB2 GLN 9 2HB GLN 9 31.075 -2.924 4.390
62 HB3 GLN 9 1HB GLN 9 32.171 -3.128 3.030
63 HG2 GLN 9 2HG GLN 9 31.288 -1.017 2.064
64 HG3 GLN 9 1HG GLN 9 30.323 -0.800 3.522
65 HE21 GLN 9 1HE2 GLN 9 31.364 -0.295 5.460
66 HE22 GLN 9 2HE2 GLN 9 32.987 0.295 5.493
67 HA PRO 10 HA PRO 10 29.851 -3.251 -1.625
68 HB2 PRO 10 2HB PRO 10 27.540 -2.091 -2.364
69 HB3 PRO 10 1HB PRO 10 27.599 -3.769 -1.809
70 HG2 PRO 10 2HG PRO 10 26.789 -1.303 -0.306
71 HG3 PRO 10 1HG PRO 10 26.025 -2.904 -0.322
72 HD2 PRO 10 2HD PRO 10 27.726 -2.030 1.656
73 HD3 PRO 10 1HD PRO 10 27.475 -3.741 1.253
74 H ALA 11 H ALA 11 30.997 -1.773 -2.759
75 HA ALA 11 HA ALA 11 31.260 0.946 -1.857
76 HB1 ALA 11 3HB ALA 11 33.156 -0.247 -2.848
77 HB2 ALA 11 1HB ALA 11 32.780 1.218 -3.755
78 HB3 ALA 11 2HB ALA 11 32.293 -0.357 -4.382
79 H ALA 12 H ALA 12 29.330 2.048 -2.052
80 HA ALA 12 HA ALA 12 28.245 2.387 -4.779
81 HB1 ALA 12 3HB ALA 12 26.815 0.849 -3.502
82 HB2 ALA 12 1HB ALA 12 25.979 2.353 -3.894
83 HB3 ALA 12 2HB ALA 12 26.602 2.087 -2.265
84 H GLN 13 H GLN 13 26.447 4.271 -4.590
85 HA GLN 13 HA GLN 13 27.940 6.589 -3.566
86 HB2 GLN 13 2HB GLN 13 25.595 6.565 -5.478
87 HB3 GLN 13 1HB GLN 13 26.669 7.917 -5.135
88 HG2 GLN 13 2HG GLN 13 27.423 5.345 -6.518
89 HG3 GLN 13 1HG GLN 13 27.174 6.909 -7.288
90 HE21 GLN 13 1HE2 GLN 13 29.537 5.164 -7.227
91 HE22 GLN 13 2HE2 GLN 13 30.818 6.134 -6.590
92 H ALA 14 H ALA 14 27.327 7.291 -1.591
93 HA ALA 14 HA ALA 14 24.603 6.962 -0.625
94 HB1 ALA 14 3HB ALA 14 26.506 6.608 0.890
95 HB2 ALA 14 1HB ALA 14 25.441 7.891 1.467
96 HB3 ALA 14 2HB ALA 14 26.973 8.297 0.691
97 HA PRO 15 HA PRO 15 23.778 11.076 -2.267
98 HB2 PRO 15 2HB PRO 15 21.134 10.826 -2.556
99 HB3 PRO 15 1HB PRO 15 22.278 9.980 -3.603
100 HG2 PRO 15 2HG PRO 15 20.603 8.917 -1.388
101 HG3 PRO 15 1HG PRO 15 21.172 8.104 -2.855
102 HD2 PRO 15 2HD PRO 15 22.303 7.933 -0.248
103 HD3 PRO 15 1HD PRO 15 22.972 7.269 -1.751
104 H GLU 16 H GLU 16 24.084 12.617 -0.769
105 HA GLU 16 HA GLU 16 23.531 14.334 0.569
106 HB2 GLU 16 2HB GLU 16 20.775 13.527 -0.336
107 HB3 GLU 16 1HB GLU 16 21.070 14.958 0.639
108 HG2 GLU 16 2HG GLU 16 20.883 15.568 -1.687
109 HG3 GLU 16 1HG GLU 16 22.524 15.858 -1.119
110 H THR 17 H THR 17 20.700 12.320 1.464
111 HA THR 17 HA THR 17 21.552 12.504 4.277
112 HB THR 17 HB THR 17 20.244 14.540 3.830
113 HG1 THR 17 HG1 THR 17 19.233 14.368 5.705
114 HG21 THR 17 3HG2 THR 17 17.854 14.407 3.303
115 HG22 THR 17 1HG2 THR 17 17.977 12.653 3.149
116 HG23 THR 17 2HG2 THR 17 18.824 13.702 2.010
117 H LYS 18 H LYS 18 19.524 11.581 5.651
118 HA LYS 18 HA LYS 18 18.788 8.986 4.432
119 HB2 LYS 18 2HB LYS 18 20.453 8.710 6.188
120 HB3 LYS 18 1HB LYS 18 19.468 9.635 7.310
121 HG2 LYS 18 2HG LYS 18 17.748 7.885 7.245
122 HG3 LYS 18 1HG LYS 18 18.742 6.960 6.115
123 HD2 LYS 18 2HD LYS 18 18.997 6.102 8.381
124 HD3 LYS 18 1HD LYS 18 20.513 6.798 7.810
125 HE2 LYS 18 2HE LYS 18 20.110 7.451 10.115
126 HE3 LYS 18 1HE LYS 18 20.011 8.863 9.066
127 HZ1 LYS 18 3HZ LYS 18 17.624 8.756 9.159
128 HZ2 LYS 18 1HZ LYS 18 18.242 8.786 10.732
129 HZ3 LYS 18 2HZ LYS 18 17.675 7.334 10.073
130 H GLN 19 H GLN 19 16.707 8.201 4.739
131 HA GLN 19 HA GLN 19 14.768 10.046 5.992
132 HB2 GLN 19 2HB GLN 19 14.379 8.112 3.697
133 HB3 GLN 19 1HB GLN 19 13.085 9.041 4.442
134 HG2 GLN 19 2HG GLN 19 15.477 10.188 3.008
135 HG3 GLN 19 1HG GLN 19 13.846 10.047 2.351
136 HE21 GLN 19 1HE2 GLN 19 15.530 12.405 2.816
137 HE22 GLN 19 2HE2 GLN 19 14.589 13.458 3.808
138 H ALA 20 H ALA 20 12.960 9.126 7.119
139 HA ALA 20 HA ALA 20 13.541 6.471 8.284
140 HB1 ALA 20 3HB ALA 20 12.308 7.209 10.241
141 HB2 ALA 20 1HB ALA 20 11.906 8.731 9.439
142 HB3 ALA 20 2HB ALA 20 13.581 8.363 9.846
143 H PHE 21 H PHE 21 11.816 4.997 8.687
144 HA PHE 21 HA PHE 21 9.461 5.377 6.949
145 HB2 PHE 21 2HB PHE 21 10.813 2.868 7.963
146 HB3 PHE 21 1HB PHE 21 9.245 2.855 7.166
147 HD1 PHE 21 HD1 PHE 21 9.158 3.994 4.818
148 HD2 PHE 21 HD2 PHE 21 12.735 2.613 6.680
149 HE1 PHE 21 HE1 PHE 21 10.252 3.869 2.619
150 HE2 PHE 21 HE2 PHE 21 13.833 2.489 4.483
151 HZ PHE 21 HZ PHE 21 12.592 3.116 2.447
152 HA PRO 22 HA PRO 22 7.233 5.259 10.940
153 HB2 PRO 22 2HB PRO 22 5.321 7.033 10.327
154 HB3 PRO 22 1HB PRO 22 6.956 7.561 10.746
155 HG2 PRO 22 2HG PRO 22 5.656 7.358 8.059
156 HG3 PRO 22 1HG PRO 22 6.777 8.587 8.673
157 HD2 PRO 22 2HD PRO 22 7.473 6.414 7.048
158 HD3 PRO 22 1HD PRO 22 8.605 7.387 8.010
159 H ARG 23 H ARG 23 6.364 3.162 10.795
160 HA ARG 23 HA ARG 23 4.698 2.443 8.564
161 HB2 ARG 23 2HB ARG 23 4.598 0.231 9.482
162 HB3 ARG 23 1HB ARG 23 6.246 0.819 9.615
163 HG2 ARG 23 2HG ARG 23 6.000 1.180 11.976
164 HG3 ARG 23 1HG ARG 23 4.269 0.836 11.894
165 HD2 ARG 23 2HD ARG 23 4.754 -1.466 11.204
166 HD3 ARG 23 1HD ARG 23 6.482 -1.126 11.262
167 HE ARG 23 HE ARG 23 5.958 -0.624 13.739
168 HH11 ARG 23 1HH1 ARG 23 4.416 -3.067 11.853
169 HH12 ARG 23 2HH1 ARG 23 4.167 -4.110 13.209
170 HH21 ARG 23 1HH2 ARG 23 5.640 -1.988 15.464
171 HH22 ARG 23 2HH2 ARG 23 4.839 -3.503 15.217
172 H LYS 24 H LYS 24 4.064 3.464 11.868
173 HA LYS 24 HA LYS 24 1.459 2.456 12.144
174 HB2 LYS 24 2HB LYS 24 2.759 4.896 13.351
175 HB3 LYS 24 1HB LYS 24 1.131 4.375 13.771
176 HG2 LYS 24 2HG LYS 24 2.069 2.178 14.461
177 HG3 LYS 24 1HG LYS 24 3.686 2.824 14.173
178 HD2 LYS 24 2HD LYS 24 3.373 4.510 15.873
179 HD3 LYS 24 1HD LYS 24 1.684 4.041 16.082
180 HE2 LYS 24 2HE LYS 24 2.438 1.810 16.851
181 HE3 LYS 24 1HE LYS 24 4.110 2.356 16.716
182 HZ1 LYS 24 3HZ LYS 24 3.674 4.031 18.384
183 HZ2 LYS 24 1HZ LYS 24 3.277 2.500 18.981
184 HZ3 LYS 24 2HZ LYS 24 2.054 3.558 18.492
185 H PHE 25 H PHE 25 2.418 5.737 11.036
186 HA PHE 25 HA PHE 25 -0.130 6.675 10.405
187 HB2 PHE 25 2HB PHE 25 2.544 7.297 9.135
188 HB3 PHE 25 1HB PHE 25 1.065 8.157 8.723
189 HD1 PHE 25 HD1 PHE 25 -0.072 9.548 10.437
190 HD2 PHE 25 HD2 PHE 25 3.744 7.784 11.140
191 HE1 PHE 25 HE1 PHE 25 0.300 11.100 12.305
192 HE2 PHE 25 HE2 PHE 25 4.117 9.335 13.013
193 HZ PHE 25 HZ PHE 25 2.395 10.996 13.599
194 H VAL 26 H VAL 26 2.134 4.876 8.345
195 HA VAL 26 HA VAL 26 0.579 4.939 5.993
196 HB VAL 26 HB VAL 26 2.639 2.879 6.806
197 HG11 VAL 26 1HG1 VAL 26 1.564 3.636 4.086
198 HG12 VAL 26 2HG1 VAL 26 1.313 2.107 4.929
199 HG13 VAL 26 3HG1 VAL 26 2.926 2.552 4.374
200 HG21 VAL 26 3HG2 VAL 26 3.555 5.140 6.920
201 HG22 VAL 26 1HG2 VAL 26 2.984 5.468 5.283
202 HG23 VAL 26 2HG2 VAL 26 4.239 4.259 5.553
203 H LEU 27 H LEU 27 0.905 2.421 8.502
204 HA LEU 27 HA LEU 27 -0.926 0.607 7.338
205 HB2 LEU 27 2HB LEU 27 -0.010 0.891 10.203
206 HB3 LEU 27 1HB LEU 27 -0.964 -0.454 9.604
207 HG LEU 27 HG LEU 27 1.840 0.264 8.722
208 HD11 LEU 27 1HD1 LEU 27 2.488 -1.820 9.825
209 HD12 LEU 27 2HD1 LEU 27 0.827 -2.054 10.372
210 HD13 LEU 27 3HD1 LEU 27 1.768 -0.686 10.968
211 HD21 LEU 27 3HD2 LEU 27 0.067 -2.035 7.887
212 HD22 LEU 27 1HD2 LEU 27 1.769 -1.845 7.462
213 HD23 LEU 27 2HD2 LEU 27 0.578 -0.686 6.873
214 H ALA 28 H ALA 28 -1.344 3.283 9.592
215 HA ALA 28 HA ALA 28 -4.007 2.826 10.357
216 HB1 ALA 28 3HB ALA 28 -2.617 5.481 9.953
217 HB2 ALA 28 1HB ALA 28 -2.585 4.510 11.426
218 HB3 ALA 28 2HB ALA 28 -4.101 5.215 10.868
219 H ALA 29 H ALA 29 -2.672 4.435 7.495
220 HA ALA 29 HA ALA 29 -5.206 5.136 6.365
221 HB1 ALA 29 3HB ALA 29 -2.540 4.781 4.983
222 HB2 ALA 29 1HB ALA 29 -3.105 6.267 5.746
223 HB3 ALA 29 2HB ALA 29 -3.951 5.624 4.340
224 H LEU 30 H LEU 30 -2.967 2.432 5.957
225 HA LEU 30 HA LEU 30 -4.191 1.089 3.852
226 HB2 LEU 30 2HB LEU 30 -1.964 0.570 4.750
227 HB3 LEU 30 1HB LEU 30 -2.697 -0.063 6.211
228 HG LEU 30 HG LEU 30 -3.727 -1.886 4.915
229 HD11 LEU 30 1HD1 LEU 30 -4.000 -0.765 2.779
230 HD12 LEU 30 2HD1 LEU 30 -3.081 -2.257 2.580
231 HD13 LEU 30 3HD1 LEU 30 -2.249 -0.700 2.565
232 HD21 LEU 30 3HD2 LEU 30 -1.667 -3.110 4.403
233 HD22 LEU 30 1HD2 LEU 30 -1.539 -2.231 5.926
234 HD23 LEU 30 2HD2 LEU 30 -0.750 -1.603 4.478
235 H GLU 31 H GLU 31 -4.600 0.372 7.347
236 HA GLU 31 HA GLU 31 -6.525 -1.616 7.098
237 HB2 GLU 31 2HB GLU 31 -7.107 -1.148 9.446
238 HB3 GLU 31 1HB GLU 31 -5.368 -1.176 9.199
239 HG2 GLU 31 2HG GLU 31 -5.275 1.237 9.241
240 HG3 GLU 31 1HG GLU 31 -7.030 1.333 9.346
241 H GLN 32 H GLN 32 -6.968 1.887 7.136
242 HA GLN 32 HA GLN 32 -9.846 1.741 7.270
243 HB2 GLN 32 2HB GLN 32 -7.945 4.025 6.713
244 HB3 GLN 32 1HB GLN 32 -9.691 4.219 6.776
245 HG2 GLN 32 2HG GLN 32 -9.676 3.386 9.099
246 HG3 GLN 32 1HG GLN 32 -7.921 3.262 9.022
247 HE21 GLN 32 1HE2 GLN 32 -6.693 5.145 9.005
248 HE22 GLN 32 2HE2 GLN 32 -7.346 6.668 9.481
249 H SER 33 H SER 33 -7.527 1.520 4.757
250 HA SER 33 HA SER 33 -9.534 2.041 2.666
251 HB2 SER 33 2HB SER 33 -7.298 3.053 2.357
252 HB3 SER 33 1HB SER 33 -6.565 1.451 2.406
253 HG SER 33 HG SER 33 -7.902 0.955 0.537
254 H SER 34 H SER 34 -8.511 -0.489 4.533
255 HA SER 34 HA SER 34 -8.557 -2.565 2.497
256 HB2 SER 34 2HB SER 34 -8.220 -2.686 5.504
257 HB3 SER 34 1HB SER 34 -8.218 -4.107 4.461
258 HG SER 34 HG SER 34 -6.154 -3.688 4.344
259 H ASP 35 H ASP 35 -10.041 -4.261 2.363
260 HA ASP 35 HA ASP 35 -12.740 -3.717 3.231
261 HB2 ASP 35 2HB ASP 35 -11.486 -6.005 1.702
262 HB3 ASP 35 1HB ASP 35 -13.199 -5.958 2.112
263 H ASP 36 H ASP 36 -13.832 -6.130 3.856
264 HA ASP 36 HA ASP 36 -13.396 -6.361 6.600
265 HB2 ASP 36 2HB ASP 36 -15.475 -7.042 5.478
266 HB3 ASP 36 1HB ASP 36 -14.629 -8.390 4.722
267 H ALA 37 H ALA 37 -11.995 -8.211 3.938
268 HA ALA 37 HA ALA 37 -10.784 -10.196 5.621
269 HB1 ALA 37 3HB ALA 37 -11.405 -10.685 3.311
270 HB2 ALA 37 1HB ALA 37 -9.687 -10.969 3.585
271 HB3 ALA 37 2HB ALA 37 -10.216 -9.514 2.738
272 H GLY 38 H GLY 38 -10.019 -7.002 5.250
273 HA2 GLY 38 2HA GLY 38 -8.229 -5.901 6.272
274 HA3 GLY 38 1HA GLY 38 -7.362 -7.424 6.370
275 H TRP 39 H TRP 39 -8.380 -7.274 3.263
276 HA TRP 39 HA TRP 39 -5.770 -6.330 2.343
277 HB2 TRP 39 2HB TRP 39 -8.003 -7.746 0.866
278 HB3 TRP 39 1HB TRP 39 -6.450 -7.311 0.161
279 HD1 TRP 39 HD1 TRP 39 -8.046 -9.796 2.590
280 HE1 TRP 39 HE1 TRP 39 -6.393 -11.724 3.001
281 HE3 TRP 39 HE3 TRP 39 -3.957 -7.875 0.204
282 HZ2 TRP 39 HZ2 TRP 39 -3.718 -12.352 2.388
283 HZ3 TRP 39 HZ3 TRP 39 -1.884 -9.203 0.159
284 HH2 TRP 39 HH2 TRP 39 -1.766 -11.395 1.229
285 H ALA 40 H ALA 40 -5.462 -4.389 1.415
286 HA ALA 40 HA ALA 40 -7.807 -2.848 0.479
287 HB1 ALA 40 3HB ALA 40 -6.441 -0.850 0.795
288 HB2 ALA 40 1HB ALA 40 -5.069 -1.848 1.280
289 HB3 ALA 40 2HB ALA 40 -6.519 -1.792 2.281
290 H ASN 41 H ASN 41 -7.818 -1.910 -1.558
291 HA ASN 41 HA ASN 41 -6.122 -3.041 -3.574
292 HB2 ASN 41 2HB ASN 41 -8.503 -2.412 -3.971
293 HB3 ASN 41 1HB ASN 41 -8.067 -0.719 -3.783
294 HD21 ASN 41 1HD2 ASN 41 -9.193 -2.217 -6.058
295 HD22 ASN 41 2HD2 ASN 41 -8.129 -1.911 -7.385
296 H LEU 42 H LEU 42 -4.247 -2.287 -4.339
297 HA LEU 42 HA LEU 42 -2.621 -0.442 -3.182
298 HB2 LEU 42 2HB LEU 42 -1.896 -2.042 -4.872
299 HB3 LEU 42 1HB LEU 42 -2.766 -1.161 -6.112
300 HG LEU 42 HG LEU 42 -1.235 0.768 -5.783
301 HD11 LEU 42 1HD1 LEU 42 0.812 0.486 -4.485
302 HD12 LEU 42 2HD1 LEU 42 0.261 -1.098 -3.939
303 HD13 LEU 42 3HD1 LEU 42 -0.615 0.357 -3.457
304 HD21 LEU 42 3HD2 LEU 42 0.705 -0.248 -6.874
305 HD22 LEU 42 1HD2 LEU 42 -0.803 -0.877 -7.537
306 HD23 LEU 42 2HD2 LEU 42 0.137 -1.852 -6.407
307 H GLY 43 H GLY 43 -4.903 0.239 -5.836
308 HA2 GLY 43 2HA GLY 43 -4.130 2.900 -6.330
309 HA3 GLY 43 1HA GLY 43 -5.692 2.208 -6.722
310 H ASN 44 H ASN 44 -6.508 1.617 -4.034
311 HA ASN 44 HA ASN 44 -7.397 4.258 -3.252
312 HB2 ASN 44 2HB ASN 44 -7.968 1.530 -2.073
313 HB3 ASN 44 1HB ASN 44 -8.720 3.028 -1.530
314 HD21 ASN 44 1HD2 ASN 44 -9.942 0.652 -2.685
315 HD22 ASN 44 2HD2 ASN 44 -10.794 1.195 -4.089
316 H PHE 45 H PHE 45 -5.233 1.788 -1.975
317 HA PHE 45 HA PHE 45 -4.659 2.857 0.531
318 HB2 PHE 45 2HB PHE 45 -3.856 0.673 -0.028
319 HB3 PHE 45 1HB PHE 45 -2.945 1.287 -1.403
320 HD1 PHE 45 HD1 PHE 45 -3.159 2.061 2.261
321 HD2 PHE 45 HD2 PHE 45 -0.665 1.241 -1.098
322 HE1 PHE 45 HE1 PHE 45 -1.168 2.275 3.685
323 HE2 PHE 45 HE2 PHE 45 1.328 1.454 0.331
324 HZ PHE 45 HZ PHE 45 1.076 1.972 2.719
325 H GLY 46 H GLY 46 -2.858 3.409 -2.524
326 HA2 GLY 46 2HA GLY 46 -1.057 5.323 -1.564
327 HA3 GLY 46 1HA GLY 46 -1.595 5.200 -3.231
328 H ASN 47 H ASN 47 -4.394 5.690 -2.554
329 HA ASN 47 HA ASN 47 -4.421 8.538 -2.695
330 HB2 ASN 47 2HB ASN 47 -6.073 7.019 -3.808
331 HB3 ASN 47 1HB ASN 47 -6.740 6.639 -2.227
332 HD21 ASN 47 1HD2 ASN 47 -7.997 7.867 -4.551
333 HD22 ASN 47 2HD2 ASN 47 -8.609 9.391 -4.012
334 H TYR 48 H TYR 48 -5.825 6.320 -0.237
335 HA TYR 48 HA TYR 48 -6.522 8.389 1.555
336 HB2 TYR 48 2HB TYR 48 -7.365 5.928 1.436
337 HB3 TYR 48 1HB TYR 48 -5.996 5.571 2.485
338 HD1 TYR 48 HD2 TYR 48 -9.086 7.609 2.210
339 HD2 TYR 48 HD1 TYR 48 -6.135 6.014 4.834
340 HE1 TYR 48 HE2 TYR 48 -10.423 8.321 4.140
341 HE2 TYR 48 HE1 TYR 48 -7.469 6.726 6.774
342 HH TYR 48 HH TYR 48 -10.704 7.727 6.519
343 H LEU 49 H LEU 49 -3.567 6.514 1.195
344 HA LEU 49 HA LEU 49 -2.298 7.211 3.608
345 HB2 LEU 49 2HB LEU 49 -1.407 5.480 2.166
346 HB3 LEU 49 1HB LEU 49 -1.127 6.639 0.881
347 HG LEU 49 HG LEU 49 0.604 7.747 2.238
348 HD11 LEU 49 1HD1 LEU 49 0.069 5.562 4.254
349 HD12 LEU 49 2HD1 LEU 49 -0.268 7.281 4.461
350 HD13 LEU 49 3HD1 LEU 49 1.398 6.720 4.319
351 HD21 LEU 49 3HD2 LEU 49 1.013 4.762 1.974
352 HD22 LEU 49 1HD2 LEU 49 2.288 5.971 2.135
353 HD23 LEU 49 2HD2 LEU 49 1.259 5.962 0.705
354 H ASN 50 H ASN 50 -2.549 8.947 0.537
355 HA ASN 50 HA ASN 50 -0.680 10.997 1.112
356 HB2 ASN 50 2HB ASN 50 -1.568 10.435 -1.162
357 HB3 ASN 50 1HB ASN 50 -3.103 11.166 -0.705
358 HD21 ASN 50 1HD2 ASN 50 0.249 11.763 -1.420
359 HD22 ASN 50 2HD2 ASN 50 0.096 13.464 -1.676
360 H LYS 51 H LYS 51 -3.953 10.483 2.121
361 HA LYS 51 HA LYS 51 -4.558 13.177 2.854
362 HB2 LYS 51 2HB LYS 51 -5.778 10.592 3.853
363 HB3 LYS 51 1HB LYS 51 -6.455 12.201 4.077
364 HG2 LYS 51 2HG LYS 51 -6.732 12.433 1.659
365 HG3 LYS 51 1HG LYS 51 -6.031 10.832 1.419
366 HD2 LYS 51 2HD LYS 51 -8.442 10.670 1.295
367 HD3 LYS 51 1HD LYS 51 -7.879 9.862 2.761
368 HE2 LYS 51 2HE LYS 51 -9.873 11.193 3.210
369 HE3 LYS 51 1HE LYS 51 -8.482 11.829 4.083
370 HZ1 LYS 51 3HZ LYS 51 -9.492 12.928 1.514
371 HZ2 LYS 51 1HZ LYS 51 -8.265 13.576 2.479
372 HZ3 LYS 51 2HZ LYS 51 -9.861 13.560 3.036
373 H LEU 52 H LEU 52 -3.235 10.393 4.609
374 HA LEU 52 HA LEU 52 -3.082 11.884 7.102
375 HB2 LEU 52 2HB LEU 52 -1.958 9.151 6.460
376 HB3 LEU 52 1HB LEU 52 -2.135 9.857 8.056
377 HG LEU 52 HG LEU 52 -4.350 8.962 6.205
378 HD11 LEU 52 1HD1 LEU 52 -4.871 7.392 8.012
379 HD12 LEU 52 2HD1 LEU 52 -3.480 7.980 8.925
380 HD13 LEU 52 3HD1 LEU 52 -3.240 7.152 7.386
381 HD21 LEU 52 3HD2 LEU 52 -5.054 11.012 7.308
382 HD22 LEU 52 1HD2 LEU 52 -4.575 10.361 8.877
383 HD23 LEU 52 2HD2 LEU 52 -5.910 9.629 7.986
384 H GLN 53 H GLN 53 -0.875 10.728 4.602
385 HA GLN 53 HA GLN 53 1.260 12.417 5.748
386 HB2 GLN 53 2HB GLN 53 1.543 9.778 4.290
387 HB3 GLN 53 1HB GLN 53 2.888 10.814 4.740
388 HG2 GLN 53 2HG GLN 53 0.968 9.563 6.699
389 HG3 GLN 53 1HG GLN 53 2.537 8.890 6.260
390 HE21 GLN 53 1HE2 GLN 53 0.902 11.433 7.979
391 HE22 GLN 53 2HE2 GLN 53 2.279 12.001 8.846
392 HA PRO 54 HA PRO 54 0.196 14.014 1.528
393 HB2 PRO 54 2HB PRO 54 0.524 16.644 2.100
394 HB3 PRO 54 1HB PRO 54 -0.954 15.759 2.496
395 HG2 PRO 54 2HG PRO 54 1.363 16.459 4.269
396 HG3 PRO 54 1HG PRO 54 -0.375 16.572 4.605
397 HD2 PRO 54 2HD PRO 54 1.162 14.512 5.488
398 HD3 PRO 54 1HD PRO 54 -0.557 14.324 5.087
399 H ASP 55 H ASP 55 3.040 14.263 3.475
400 HA ASP 55 HA ASP 55 4.602 15.318 1.204
401 HB2 ASP 55 2HB ASP 55 4.746 16.526 3.384
402 HB3 ASP 55 1HB ASP 55 5.403 15.068 4.120
403 H PHE 56 H PHE 56 3.630 12.412 2.014
404 HA PHE 56 HA PHE 56 6.192 11.032 2.219
405 HB2 PHE 56 2HB PHE 56 4.201 10.291 3.536
406 HB3 PHE 56 1HB PHE 56 3.409 9.843 2.029
407 HD1 PHE 56 HD1 PHE 56 6.268 9.087 4.250
408 HD2 PHE 56 HD2 PHE 56 3.908 7.778 0.953
409 HE1 PHE 56 HE1 PHE 56 7.326 6.871 4.375
410 HE2 PHE 56 HE2 PHE 56 4.959 5.559 1.080
411 HZ PHE 56 HZ PHE 56 6.673 5.102 2.792
412 H ASP 57 H ASP 57 7.290 11.069 0.340
413 HA ASP 57 HA ASP 57 5.948 10.028 -2.072
414 HB2 ASP 57 2HB ASP 57 6.426 12.314 -2.515
415 HB3 ASP 57 1HB ASP 57 8.040 12.189 -1.820
416 H SER 58 H SER 58 7.022 8.534 -3.322
417 HA SER 58 HA SER 58 8.774 6.792 -1.879
418 HB2 SER 58 2HB SER 58 8.652 5.367 -3.899
419 HB3 SER 58 1HB SER 58 7.054 5.904 -3.376
420 HG SER 58 HG SER 58 8.554 6.660 -5.625
421 H ARG 59 H ARG 59 9.287 9.218 -4.370
422 HA ARG 59 HA ARG 59 11.781 8.309 -5.348
423 HB2 ARG 59 2HB ARG 59 10.918 11.200 -5.123
424 HB3 ARG 59 1HB ARG 59 12.075 10.522 -6.259
425 HG2 ARG 59 2HG ARG 59 9.134 9.866 -6.207
426 HG3 ARG 59 1HG ARG 59 9.882 11.059 -7.265
427 HD2 ARG 59 2HD ARG 59 11.221 9.321 -8.318
428 HD3 ARG 59 1HD ARG 59 10.558 8.114 -7.216
429 HE ARG 59 HE ARG 59 8.341 8.705 -8.260
430 HH11 ARG 59 1HH1 ARG 59 11.310 8.966 -9.993
431 HH12 ARG 59 2HH1 ARG 59 10.549 8.797 -11.532
432 HH21 ARG 59 1HH2 ARG 59 7.384 8.475 -10.219
433 HH22 ARG 59 2HH2 ARG 59 8.334 8.527 -11.661
434 H LEU 60 H LEU 60 10.894 10.230 -2.552
435 HA LEU 60 HA LEU 60 13.419 11.127 -1.717
436 HB2 LEU 60 2HB LEU 60 11.085 10.285 0.013
437 HB3 LEU 60 1HB LEU 60 12.406 11.331 0.502
438 HG LEU 60 HG LEU 60 10.357 11.994 -1.626
439 HD11 LEU 60 1HD1 LEU 60 10.625 12.988 1.214
440 HD12 LEU 60 2HD1 LEU 60 9.342 11.957 0.577
441 HD13 LEU 60 3HD1 LEU 60 9.500 13.617 0.007
442 HD21 LEU 60 3HD2 LEU 60 12.521 13.047 -2.042
443 HD22 LEU 60 1HD2 LEU 60 12.540 13.683 -0.399
444 HD23 LEU 60 2HD2 LEU 60 11.320 14.239 -1.545
445 H TYR 61 H TYR 61 12.083 7.945 -1.696
446 HA TYR 61 HA TYR 61 14.172 6.972 0.151
447 HB2 TYR 61 2HB TYR 61 11.598 5.615 -0.700
448 HB3 TYR 61 1HB TYR 61 12.755 4.991 0.473
449 HD1 TYR 61 HD2 TYR 61 12.926 5.991 2.705
450 HD2 TYR 61 HD1 TYR 61 10.095 7.442 -0.122
451 HE1 TYR 61 HE2 TYR 61 11.758 7.201 4.498
452 HE2 TYR 61 HE1 TYR 61 8.928 8.660 1.665
453 HH TYR 61 HH TYR 61 8.681 8.493 4.155
454 H GLY 62 H GLY 62 13.850 7.390 -3.035
455 HA2 GLY 62 2HA GLY 62 15.210 6.559 -4.731
456 HA3 GLY 62 1HA GLY 62 15.732 5.276 -3.657
457 H TYR 63 H TYR 63 12.332 5.889 -4.295
458 HA TYR 63 HA TYR 63 12.238 3.522 -6.064
459 HB2 TYR 63 2HB TYR 63 10.342 4.226 -3.804
460 HB3 TYR 63 1HB TYR 63 10.014 2.981 -5.008
461 HD1 TYR 63 HD1 TYR 63 12.148 3.904 -2.142
462 HD2 TYR 63 HD2 TYR 63 11.131 0.849 -4.930
463 HE1 TYR 63 HE1 TYR 63 13.389 2.265 -0.793
464 HE2 TYR 63 HE2 TYR 63 12.367 -0.796 -3.590
465 HH TYR 63 HH TYR 63 14.162 -0.854 -1.942
466 H LYS 64 H LYS 64 10.877 3.626 -7.830
467 HA LYS 64 HA LYS 64 10.296 6.225 -8.806
468 HB2 LYS 64 2HB LYS 64 9.426 3.536 -9.886
469 HB3 LYS 64 1HB LYS 64 9.327 5.061 -10.757
470 HG2 LYS 64 2HG LYS 64 11.845 3.672 -9.840
471 HG3 LYS 64 1HG LYS 64 11.256 3.814 -11.498
472 HD2 LYS 64 2HD LYS 64 11.492 6.269 -11.346
473 HD3 LYS 64 1HD LYS 64 12.135 6.091 -9.713
474 HE2 LYS 64 2HE LYS 64 14.005 4.764 -10.605
475 HE3 LYS 64 1HE LYS 64 13.365 4.971 -12.236
476 HZ1 LYS 64 3HZ LYS 64 14.393 7.095 -10.440
477 HZ2 LYS 64 1HZ LYS 64 13.618 7.396 -11.916
478 HZ3 LYS 64 2HZ LYS 64 15.083 6.559 -11.889
479 H LYS 65 H LYS 65 8.273 3.788 -7.277
480 HA LYS 65 HA LYS 65 6.280 5.808 -6.756
481 HB2 LYS 65 2HB LYS 65 4.384 4.488 -7.679
482 HB3 LYS 65 1HB LYS 65 5.471 5.109 -8.913
483 HG2 LYS 65 2HG LYS 65 6.502 2.921 -9.152
484 HG3 LYS 65 1HG LYS 65 5.495 2.285 -7.850
485 HD2 LYS 65 2HD LYS 65 4.657 1.690 -10.105
486 HD3 LYS 65 1HD LYS 65 3.496 2.620 -9.160
487 HE2 LYS 65 2HE LYS 65 3.652 3.334 -11.539
488 HE3 LYS 65 1HE LYS 65 4.010 4.623 -10.391
489 HZ1 LYS 65 3HZ LYS 65 6.148 3.004 -11.635
490 HZ2 LYS 65 1HZ LYS 65 6.282 4.501 -10.866
491 HZ3 LYS 65 2HZ LYS 65 5.535 4.393 -12.375
492 H LEU 66 H LEU 66 4.482 4.953 -5.382
493 HA LEU 66 HA LEU 66 5.491 3.774 -3.072
494 HB2 LEU 66 2HB LEU 66 3.476 5.185 -3.177
495 HB3 LEU 66 1HB LEU 66 2.617 3.903 -4.005
496 HG LEU 66 HG LEU 66 2.834 2.477 -1.988
497 HD11 LEU 66 1HD1 LEU 66 4.867 3.407 -1.051
498 HD12 LEU 66 2HD1 LEU 66 3.559 3.493 0.128
499 HD13 LEU 66 3HD1 LEU 66 4.052 4.943 -0.747
500 HD21 LEU 66 3HD2 LEU 66 0.814 3.793 -2.313
501 HD22 LEU 66 1HD2 LEU 66 1.564 5.177 -1.514
502 HD23 LEU 66 2HD2 LEU 66 1.221 3.709 -0.600
503 H SER 67 H SER 67 3.817 2.295 -5.793
504 HA SER 67 HA SER 67 3.173 -0.209 -4.855
505 HB2 SER 67 2HB SER 67 4.388 0.310 -7.584
506 HB3 SER 67 1HB SER 67 3.280 -0.989 -7.144
507 HG SER 67 HG SER 67 1.981 0.495 -8.047
508 H ASP 68 H ASP 68 6.326 0.815 -6.159
509 HA ASP 68 HA ASP 68 7.511 -1.786 -5.840
510 HB2 ASP 68 2HB ASP 68 8.130 -0.160 -7.636
511 HB3 ASP 68 1HB ASP 68 8.864 0.862 -6.406
512 H LEU 69 H LEU 69 7.283 1.106 -3.908
513 HA LEU 69 HA LEU 69 9.395 0.520 -2.079
514 HB2 LEU 69 2HB LEU 69 8.569 2.780 -2.277
515 HB3 LEU 69 1HB LEU 69 6.948 2.280 -1.829
516 HG LEU 69 HG LEU 69 7.790 1.708 0.447
517 HD11 LEU 69 1HD1 LEU 69 10.120 1.267 -0.107
518 HD12 LEU 69 2HD1 LEU 69 9.991 2.496 1.151
519 HD13 LEU 69 3HD1 LEU 69 10.360 2.969 -0.508
520 HD21 LEU 69 3HD2 LEU 69 6.750 3.869 0.027
521 HD22 LEU 69 1HD2 LEU 69 8.310 4.547 -0.440
522 HD23 LEU 69 2HD2 LEU 69 8.039 4.016 1.220
523 H VAL 70 H VAL 70 5.861 0.069 -1.889
524 HA VAL 70 HA VAL 70 5.705 -1.017 0.664
525 HB VAL 70 HB VAL 70 3.946 -1.688 -1.712
526 HG11 VAL 70 1HG1 VAL 70 3.391 -1.938 1.248
527 HG12 VAL 70 2HG1 VAL 70 3.672 -3.276 0.135
528 HG13 VAL 70 3HG1 VAL 70 2.242 -2.260 -0.052
529 HG21 VAL 70 3HG2 VAL 70 4.051 0.719 -1.306
530 HG22 VAL 70 1HG2 VAL 70 3.662 0.462 0.396
531 HG23 VAL 70 2HG2 VAL 70 2.470 0.086 -0.847
532 H LYS 71 H LYS 71 5.945 -2.793 -2.429
533 HA LYS 71 HA LYS 71 6.124 -5.368 -1.275
534 HB2 LYS 71 2HB LYS 71 6.876 -6.110 -3.488
535 HB3 LYS 71 1HB LYS 71 5.490 -5.035 -3.607
536 HG2 LYS 71 2HG LYS 71 6.996 -3.180 -4.192
537 HG3 LYS 71 1HG LYS 71 8.369 -4.285 -4.116
538 HD2 LYS 71 2HD LYS 71 6.011 -4.524 -6.000
539 HD3 LYS 71 1HD LYS 71 7.613 -3.923 -6.426
540 HE2 LYS 71 2HE LYS 71 8.554 -6.136 -5.771
541 HE3 LYS 71 1HE LYS 71 6.909 -6.716 -5.513
542 HZ1 LYS 71 3HZ LYS 71 8.019 -5.723 -8.083
543 HZ2 LYS 71 1HZ LYS 71 6.432 -6.263 -7.843
544 HZ3 LYS 71 2HZ LYS 71 7.722 -7.341 -7.687
545 H ALA 72 H ALA 72 8.480 -2.872 -1.630
546 HA ALA 72 HA ALA 72 10.774 -4.609 -1.311
547 HB1 ALA 72 3HB ALA 72 10.946 -2.527 -2.595
548 HB2 ALA 72 1HB ALA 72 12.073 -2.554 -1.241
549 HB3 ALA 72 2HB ALA 72 10.591 -1.602 -1.135
550 H ARG 73 H ARG 73 8.519 -3.064 0.783
551 HA ARG 73 HA ARG 73 10.291 -3.597 3.086
552 HB2 ARG 73 2HB ARG 73 7.929 -1.710 2.949
553 HB3 ARG 73 1HB ARG 73 8.914 -2.009 4.374
554 HG2 ARG 73 2HG ARG 73 9.746 -0.657 1.814
555 HG3 ARG 73 1HG ARG 73 9.638 0.047 3.428
556 HD2 ARG 73 2HD ARG 73 11.605 -2.051 2.492
557 HD3 ARG 73 1HD ARG 73 11.960 -0.366 2.859
558 HE ARG 73 HE ARG 73 11.450 -0.884 5.202
559 HH11 ARG 73 1HH1 ARG 73 12.061 -3.547 3.094
560 HH12 ARG 73 2HH1 ARG 73 12.590 -4.580 4.374
561 HH21 ARG 73 1HH2 ARG 73 12.151 -2.204 6.830
562 HH22 ARG 73 2HH2 ARG 73 12.665 -3.817 6.477
563 H THR 74 H THR 74 9.258 -5.815 2.188
564 HA THR 74 HA THR 74 6.713 -6.646 2.944
565 HB THR 74 HB THR 74 7.666 -8.949 3.065
566 HG1 THR 74 HG1 THR 74 9.964 -9.103 2.544
567 HG21 THR 74 3HG2 THR 74 8.649 -7.306 0.724
568 HG22 THR 74 1HG2 THR 74 7.038 -8.008 0.888
569 HG23 THR 74 2HG2 THR 74 8.449 -9.057 0.741
570 H ASP 75 H ASP 75 9.543 -6.132 4.914
571 HA ASP 75 HA ASP 75 8.818 -7.513 7.239
572 HB2 ASP 75 2HB ASP 75 11.047 -6.541 6.871
573 HB3 ASP 75 1HB ASP 75 10.364 -4.919 6.963
574 H LEU 76 H LEU 76 7.835 -4.357 6.026
575 HA LEU 76 HA LEU 76 6.293 -3.792 8.463
576 HB2 LEU 76 2HB LEU 76 6.817 -2.054 6.041
577 HB3 LEU 76 1HB LEU 76 5.984 -1.548 7.500
578 HG LEU 76 HG LEU 76 8.894 -2.348 7.315
579 HD11 LEU 76 1HD1 LEU 76 9.358 0.006 7.729
580 HD12 LEU 76 2HD1 LEU 76 7.630 0.362 7.747
581 HD13 LEU 76 3HD1 LEU 76 8.402 -0.188 6.259
582 HD21 LEU 76 3HD2 LEU 76 7.938 -2.947 9.481
583 HD22 LEU 76 1HD2 LEU 76 7.297 -1.313 9.663
584 HD23 LEU 76 2HD2 LEU 76 9.041 -1.581 9.641
585 H PHE 77 H PHE 77 5.865 -4.474 5.037
586 HA PHE 77 HA PHE 77 2.933 -4.289 5.361
587 HB2 PHE 77 2HB PHE 77 4.453 -3.625 2.826
588 HB3 PHE 77 1HB PHE 77 2.740 -3.367 3.141
589 HD1 PHE 77 HD1 PHE 77 2.585 -2.012 5.643
590 HD2 PHE 77 HD2 PHE 77 5.541 -1.610 2.597
591 HE1 PHE 77 HE1 PHE 77 3.105 0.257 6.444
592 HE2 PHE 77 HE2 PHE 77 6.057 0.654 3.391
593 HZ PHE 77 HZ PHE 77 4.843 1.592 5.317
594 H VAL 78 H VAL 78 1.762 -6.014 4.644
595 HA VAL 78 HA VAL 78 3.205 -8.263 3.431
596 HB VAL 78 HB VAL 78 0.337 -8.159 4.405
597 HG11 VAL 78 1HG1 VAL 78 0.482 -10.621 4.370
598 HG12 VAL 78 2HG1 VAL 78 2.091 -10.504 3.658
599 HG13 VAL 78 3HG1 VAL 78 0.687 -9.919 2.765
600 HG21 VAL 78 3HG2 VAL 78 1.862 -7.767 6.256
601 HG22 VAL 78 1HG2 VAL 78 2.809 -9.185 5.805
602 HG23 VAL 78 2HG2 VAL 78 1.155 -9.378 6.384
603 H THR 79 H THR 79 3.232 -8.453 1.273
604 HA THR 79 HA THR 79 1.040 -7.208 -0.289
605 HB THR 79 HB THR 79 2.563 -6.595 -2.010
606 HG1 THR 79 HG1 THR 79 4.168 -8.538 -0.884
607 HG21 THR 79 3HG2 THR 79 2.599 -5.092 -0.075
608 HG22 THR 79 1HG2 THR 79 4.174 -5.143 -0.869
609 HG23 THR 79 2HG2 THR 79 3.912 -6.030 0.633
610 H GLU 80 H GLU 80 -0.079 -8.495 -1.622
611 HA GLU 80 HA GLU 80 1.256 -10.745 -2.930
612 HB2 GLU 80 2HB GLU 80 -1.283 -11.018 -1.304
613 HB3 GLU 80 1HB GLU 80 -0.783 -12.198 -2.506
614 HG2 GLU 80 2HG GLU 80 1.355 -12.470 -1.204
615 HG3 GLU 80 1HG GLU 80 0.624 -11.480 0.058
616 H GLU 81 H GLU 81 0.530 -11.146 -4.990
617 HA GLU 81 HA GLU 81 -1.339 -9.212 -6.110
618 HB2 GLU 81 2HB GLU 81 0.380 -11.334 -7.418
619 HB3 GLU 81 1HB GLU 81 -0.686 -10.244 -8.299
620 HG2 GLU 81 2HG GLU 81 0.589 -8.324 -7.417
621 HG3 GLU 81 1HG GLU 81 1.683 -9.445 -6.610
622 H ARG 82 H ARG 82 -3.420 -9.625 -6.259
623 HA ARG 82 HA ARG 82 -4.340 -12.427 -6.022
624 HB2 ARG 82 2HB ARG 82 -5.760 -9.948 -5.006
625 HB3 ARG 82 1HB ARG 82 -6.154 -11.627 -4.653
626 HG2 ARG 82 2HG ARG 82 -3.571 -10.304 -3.821
627 HG3 ARG 82 1HG ARG 82 -5.007 -10.387 -2.799
628 HD2 ARG 82 2HD ARG 82 -3.685 -12.829 -3.967
629 HD3 ARG 82 1HD ARG 82 -3.236 -12.154 -2.401
630 HE ARG 82 HE ARG 82 -5.835 -12.437 -2.057
631 HH11 ARG 82 1HH1 ARG 82 -3.574 -14.643 -3.454
632 HH12 ARG 82 2HH1 ARG 82 -4.487 -16.032 -2.976
633 HH21 ARG 82 1HH2 ARG 82 -6.957 -14.206 -1.421
634 HH22 ARG 82 2HH2 ARG 82 -6.391 -15.785 -1.839
635 H GLN 83 H GLN 83 -5.688 -13.146 -7.604
636 HA GLN 83 HA GLN 83 -6.421 -11.352 -9.745
637 HB2 GLN 83 2HB GLN 83 -5.706 -13.697 -10.170
638 HB3 GLN 83 1HB GLN 83 -7.167 -14.265 -9.375
639 HG2 GLN 83 2HG GLN 83 -8.548 -13.269 -11.080
640 HG3 GLN 83 1HG GLN 83 -7.145 -12.507 -11.825
641 HE21 GLN 83 1HE2 GLN 83 -7.487 -13.510 -13.802
642 HE22 GLN 83 2HE2 GLN 83 -7.234 -15.199 -14.043
643 H VAL 84 H VAL 84 -8.346 -10.406 -10.095
644 HA VAL 84 HA VAL 84 -10.170 -10.409 -7.824
645 HB VAL 84 HB VAL 84 -10.152 -8.618 -10.264
646 HG11 VAL 84 1HG1 VAL 84 -12.303 -8.623 -9.127
647 HG12 VAL 84 2HG1 VAL 84 -11.475 -7.087 -8.873
648 HG13 VAL 84 3HG1 VAL 84 -11.510 -8.292 -7.587
649 HG21 VAL 84 3HG2 VAL 84 -9.009 -6.976 -8.837
650 HG22 VAL 84 1HG2 VAL 84 -8.043 -8.437 -9.051
651 HG23 VAL 84 2HG2 VAL 84 -8.916 -8.168 -7.541
652 HA PRO 85 HA PRO 85 -13.213 -13.073 -9.795
653 HB2 PRO 85 2HB PRO 85 -15.355 -12.139 -8.263
654 HB3 PRO 85 1HB PRO 85 -14.260 -13.448 -7.809
655 HG2 PRO 85 2HG PRO 85 -14.199 -10.564 -7.009
656 HG3 PRO 85 1HG PRO 85 -13.874 -12.008 -6.031
657 HD2 PRO 85 2HD PRO 85 -11.871 -10.497 -6.945
658 HD3 PRO 85 1HD PRO 85 -11.728 -12.270 -6.904
659 H GLY 86 H GLY 86 -14.103 -12.681 -11.728
660 HA2 GLY 86 2HA GLY 86 -15.669 -11.658 -13.195
661 HA3 GLY 86 1HA GLY 86 -15.672 -10.231 -12.170
662 H SER 87 H SER 87 -12.564 -10.732 -12.250
663 HA SER 87 HA SER 87 -12.096 -9.350 -14.824
664 HB2 SER 87 2HB SER 87 -10.630 -8.948 -12.194
665 HB3 SER 87 1HB SER 87 -10.203 -8.177 -13.721
666 HG SER 87 HG SER 87 -12.710 -7.895 -12.405
667 H THR 88 H THR 88 -10.447 -10.104 -16.110
668 HA THR 88 HA THR 88 -9.277 -12.665 -15.440
669 HB THR 88 HB THR 88 -9.961 -12.209 -17.762
670 HG1 THR 88 HG1 THR 88 -7.751 -12.754 -18.688
671 HG21 THR 88 3HG2 THR 88 -8.668 -10.707 -19.193
672 HG22 THR 88 1HG2 THR 88 -7.678 -10.218 -17.816
673 HG23 THR 88 2HG2 THR 88 -9.393 -9.809 -17.861
674 H GLN 89 H GLN 89 -8.320 -9.352 -15.273
675 HA GLN 89 HA GLN 89 -5.484 -9.901 -15.044
676 HB2 GLN 89 2HB GLN 89 -5.251 -7.497 -14.623
677 HB3 GLN 89 1HB GLN 89 -6.233 -7.793 -16.049
678 HG2 GLN 89 2HG GLN 89 -8.246 -7.274 -14.869
679 HG3 GLN 89 1HG GLN 89 -7.384 -7.204 -13.332
680 HE21 GLN 89 1HE2 GLN 89 -8.030 -5.569 -16.326
681 HE22 GLN 89 2HE2 GLN 89 -7.394 -4.038 -15.856
682 H LYS 90 H LYS 90 -4.215 -9.495 -13.159
683 HA LYS 90 HA LYS 90 -5.641 -9.942 -10.629
684 HB2 LYS 90 2HB LYS 90 -3.473 -10.545 -9.702
685 HB3 LYS 90 1HB LYS 90 -3.767 -11.454 -11.178
686 HG2 LYS 90 2HG LYS 90 -2.301 -9.952 -12.420
687 HG3 LYS 90 1HG LYS 90 -2.032 -8.990 -10.968
688 HD2 LYS 90 2HD LYS 90 -0.150 -10.468 -11.324
689 HD3 LYS 90 1HD LYS 90 -1.026 -10.962 -9.874
690 HE2 LYS 90 2HE LYS 90 -2.122 -12.746 -11.132
691 HE3 LYS 90 1HE LYS 90 -1.302 -12.225 -12.605
692 HZ1 LYS 90 3HZ LYS 90 -0.120 -14.064 -11.711
693 HZ2 LYS 90 1HZ LYS 90 -0.056 -13.365 -10.170
694 HZ3 LYS 90 2HZ LYS 90 0.825 -12.688 -11.439
695 H ALA 91 H ALA 91 -5.164 -8.666 -8.761
696 HA ALA 91 HA ALA 91 -3.956 -6.032 -9.305
697 HB1 ALA 91 3HB ALA 91 -6.390 -5.797 -9.255
698 HB2 ALA 91 1HB ALA 91 -5.642 -4.974 -7.886
699 HB3 ALA 91 2HB ALA 91 -6.438 -6.531 -7.653
700 H LEU 92 H LEU 92 -2.660 -5.185 -7.715
701 HA LEU 92 HA LEU 92 -1.685 -6.998 -5.707
702 HB2 LEU 92 2HB LEU 92 -0.175 -5.498 -6.927
703 HB3 LEU 92 1HB LEU 92 -0.993 -4.105 -6.240
704 HG LEU 92 HG LEU 92 -0.264 -4.917 -3.954
705 HD11 LEU 92 1HD1 LEU 92 1.484 -6.763 -5.587
706 HD12 LEU 92 2HD1 LEU 92 0.158 -7.257 -4.534
707 HD13 LEU 92 3HD1 LEU 92 1.595 -6.499 -3.847
708 HD21 LEU 92 3HD2 LEU 92 2.008 -4.059 -4.180
709 HD22 LEU 92 1HD2 LEU 92 0.878 -3.093 -5.129
710 HD23 LEU 92 2HD2 LEU 92 1.926 -4.263 -5.930
711 H TYR 93 H TYR 93 -2.974 -7.358 -3.993
712 HA TYR 93 HA TYR 93 -4.213 -5.091 -2.594
713 HB2 TYR 93 2HB TYR 93 -4.605 -8.078 -2.334
714 HB3 TYR 93 1HB TYR 93 -5.290 -6.926 -1.194
715 HD1 TYR 93 HD1 TYR 93 -5.339 -7.970 -4.764
716 HD2 TYR 93 HD2 TYR 93 -7.288 -5.753 -1.694
717 HE1 TYR 93 HE1 TYR 93 -7.294 -7.676 -6.222
718 HE2 TYR 93 HE2 TYR 93 -9.250 -5.460 -3.146
719 HH TYR 93 HH TYR 93 -9.695 -7.229 -6.011
720 H LEU 94 H LEU 94 -3.771 -4.605 -0.442
721 HA LEU 94 HA LEU 94 -1.244 -5.748 0.598
722 HB2 LEU 94 2HB LEU 94 -2.134 -2.871 0.857
723 HB3 LEU 94 1HB LEU 94 -0.575 -3.542 1.294
724 HG LEU 94 HG LEU 94 -1.644 -3.281 -1.522
725 HD11 LEU 94 1HD1 LEU 94 0.062 -1.556 -1.805
726 HD12 LEU 94 2HD1 LEU 94 0.493 -1.700 -0.100
727 HD13 LEU 94 3HD1 LEU 94 -1.105 -1.118 -0.560
728 HD21 LEU 94 3HD2 LEU 94 1.082 -4.159 -0.573
729 HD22 LEU 94 1HD2 LEU 94 0.573 -3.946 -2.251
730 HD23 LEU 94 2HD2 LEU 94 -0.158 -5.208 -1.261
731 H ARG 95 H ARG 95 -1.051 -6.019 2.833
732 HA ARG 95 HA ARG 95 -3.181 -4.999 4.564
733 HB2 ARG 95 2HB ARG 95 -3.495 -7.152 5.695
734 HB3 ARG 95 1HB ARG 95 -3.948 -7.244 4.001
735 HG2 ARG 95 2HG ARG 95 -1.805 -8.334 3.497
736 HG3 ARG 95 1HG ARG 95 -1.386 -8.269 5.212
737 HD2 ARG 95 2HD ARG 95 -3.786 -9.697 4.056
738 HD3 ARG 95 1HD ARG 95 -2.272 -10.472 4.515
739 HE ARG 95 HE ARG 95 -2.762 -9.783 6.825
740 HH11 ARG 95 1HH1 ARG 95 -5.380 -9.886 4.578
741 HH12 ARG 95 2HH1 ARG 95 -6.567 -10.133 5.808
742 HH21 ARG 95 1HH2 ARG 95 -4.279 -10.127 8.381
743 HH22 ARG 95 2HH2 ARG 95 -5.947 -10.281 7.945
744 H ALA 96 H ALA 96 -2.623 -5.229 6.908
745 HA ALA 96 HA ALA 96 0.012 -4.146 7.246
746 HB1 ALA 96 3HB ALA 96 -1.913 -3.206 8.411
747 HB2 ALA 96 1HB ALA 96 -0.670 -3.729 9.549
748 HB3 ALA 96 2HB ALA 96 -2.115 -4.711 9.308
749 H LYS 97 H LYS 97 1.729 -4.905 8.442
750 HA LYS 97 HA LYS 97 1.959 -7.748 8.869
751 HB2 LYS 97 2HB LYS 97 3.883 -6.430 8.096
752 HB3 LYS 97 1HB LYS 97 3.832 -5.468 9.563
753 HG2 LYS 97 2HG LYS 97 5.592 -7.003 9.845
754 HG3 LYS 97 1HG LYS 97 4.269 -7.594 10.850
755 HD2 LYS 97 2HD LYS 97 5.312 -9.445 9.671
756 HD3 LYS 97 1HD LYS 97 3.672 -9.204 9.066
757 HE2 LYS 97 2HE LYS 97 4.501 -8.094 7.097
758 HE3 LYS 97 1HE LYS 97 6.146 -8.094 7.733
759 HZ1 LYS 97 3HZ LYS 97 4.594 -10.533 7.067
760 HZ2 LYS 97 1HZ LYS 97 6.210 -10.469 7.566
761 HZ3 LYS 97 2HZ LYS 97 5.764 -9.829 6.067
762 H LEU 98 H LEU 98 1.075 -8.687 10.615
763 HA LEU 98 HA LEU 98 0.698 -7.170 13.085
764 HB2 LEU 98 2HB LEU 98 -0.247 -9.940 12.317
765 HB3 LEU 98 1HB LEU 98 -0.663 -9.107 13.805
766 HG LEU 98 HG LEU 98 -1.442 -8.240 11.010
767 HD11 LEU 98 1HD1 LEU 98 -3.112 -9.370 13.258
768 HD12 LEU 98 2HD1 LEU 98 -2.654 -10.214 11.778
769 HD13 LEU 98 3HD1 LEU 98 -3.710 -8.806 11.697
770 HD21 LEU 98 3HD2 LEU 98 -2.790 -6.526 12.114
771 HD22 LEU 98 1HD2 LEU 98 -1.078 -6.316 12.475
772 HD23 LEU 98 2HD2 LEU 98 -2.153 -7.019 13.684
773 H GLU 99 H GLU 99 1.708 -7.597 15.001
774 HA GLU 99 HA GLU 99 4.168 -9.045 14.956
775 HB2 GLU 99 2HB GLU 99 2.638 -7.702 17.188
776 HB3 GLU 99 1HB GLU 99 4.164 -8.527 17.456
777 HG2 GLU 99 2HG GLU 99 4.517 -6.147 17.256
778 HG3 GLU 99 1HG GLU 99 5.274 -6.988 15.906
779 H HIS 100 H HIS 100 3.362 -11.153 14.332
780 HA HIS 100 HA HIS 100 1.718 -12.754 15.990
781 HB2 HIS 100 2HB HIS 100 2.776 -14.687 14.717
782 HB3 HIS 100 1HB HIS 100 1.990 -13.457 13.735
783 HD1 HIS 100 HD1 HIS 100 5.547 -13.430 15.116
784 HD2 HIS 100 HD2 HIS 100 3.513 -13.430 11.492
785 HE1 HIS 100 HE1 HIS 100 7.302 -13.122 13.357
786 HE2 HIS 100 HE2 HIS 100 6.078 -13.353 11.180
787 H HIS 101 H HIS 101 2.277 -14.497 17.413
788 HA HIS 101 HA HIS 101 4.648 -13.876 19.010
789 HB2 HIS 101 2HB HIS 101 2.372 -15.792 19.596
790 HB3 HIS 101 1HB HIS 101 3.620 -15.277 20.731
791 HD1 HIS 101 HD1 HIS 101 0.246 -14.630 20.063
792 HD2 HIS 101 HD2 HIS 101 3.527 -12.184 20.794
793 HE1 HIS 101 HE1 HIS 101 -0.708 -12.424 20.786
794 HE2 HIS 101 HE2 HIS 101 1.286 -10.910 21.024
795 H HIS 102 H HIS 102 6.146 -15.474 19.710
796 HA HIS 102 HA HIS 102 6.404 -17.797 17.897
797 HB2 HIS 102 2HB HIS 102 8.910 -17.381 18.066
798 HB3 HIS 102 1HB HIS 102 7.993 -16.214 17.123
799 HD1 HIS 102 HD1 HIS 102 9.836 -16.578 20.369
800 HD2 HIS 102 HD2 HIS 102 8.007 -13.606 18.118
801 HE1 HIS 102 HE1 HIS 102 10.505 -14.418 21.449
802 HE2 HIS 102 HE2 HIS 102 9.262 -12.644 20.171
803 H HIS 103 H HIS 103 6.333 -19.659 18.995
804 HA HIS 103 HA HIS 103 6.717 -19.616 21.883
805 HB2 HIS 103 2HB HIS 103 5.642 -21.732 20.020
806 HB3 HIS 103 1HB HIS 103 5.835 -21.979 21.752
807 HD1 HIS 103 HD1 HIS 103 3.711 -21.649 22.958
808 HD2 HIS 103 HD2 HIS 103 4.006 -19.147 19.650
809 HE1 HIS 103 HE1 HIS 103 1.581 -20.319 22.925
810 HE2 HIS 103 HE2 HIS 103 1.702 -18.961 20.810
811 H HIS 104 H HIS 104 9.123 -19.191 21.115
812 HA HIS 104 HA HIS 104 10.527 -21.601 21.960
813 HB2 HIS 104 2HB HIS 104 11.250 -20.107 19.422
814 HB3 HIS 104 1HB HIS 104 12.367 -21.178 20.254
815 HD1 HIS 104 HD1 HIS 104 12.073 -23.686 19.900
816 HD2 HIS 104 HD2 HIS 104 9.090 -21.423 18.104
817 HE1 HIS 104 HE1 HIS 104 10.863 -25.264 18.376
818 HE2 HIS 104 HE2 HIS 104 8.969 -23.916 17.414
819 H HIS 105 H HIS 105 12.958 -20.947 22.414
820 HA HIS 105 HA HIS 105 12.944 -18.201 23.511
821 HB2 HIS 105 2HB HIS 105 14.480 -19.082 25.325
822 HB3 HIS 105 1HB HIS 105 12.807 -19.613 25.403
823 HD1 HIS 105 HD1 HIS 105 16.271 -20.851 25.077
824 HD2 HIS 105 HD2 HIS 105 12.421 -22.378 24.761
825 HE1 HIS 105 HE1 HIS 105 16.525 -23.342 25.193
826 HE2 HIS 105 HE2 HIS 105 14.178 -24.232 25.162
Start of MODEL 18
1 H1 MET 1 1H MET 1 51.173 20.993 12.013
2 H2 MET 1 2H MET 1 52.110 19.622 11.691
3 H3 MET 1 3H MET 1 50.432 19.571 11.485
4 HA MET 1 HA MET 1 50.510 21.086 9.677
5 HB2 MET 1 2HB MET 1 52.601 22.005 8.837
6 HB3 MET 1 1HB MET 1 52.392 22.448 10.525
7 HG2 MET 1 2HG MET 1 54.190 20.288 9.443
8 HG3 MET 1 1HG MET 1 54.687 21.840 10.115
9 HE1 MET 1 3HE MET 1 56.393 20.287 11.601
10 HE2 MET 1 1HE MET 1 55.662 18.816 10.962
11 HE3 MET 1 2HE MET 1 55.821 19.036 12.704
12 H ASP 2 H ASP 2 50.447 20.160 7.673
13 HA ASP 2 HA ASP 2 51.745 17.526 7.400
14 HB2 ASP 2 2HB ASP 2 49.309 17.415 7.400
15 HB3 ASP 2 1HB ASP 2 49.229 18.609 6.110
16 H GLN 3 H GLN 3 52.469 16.900 5.260
17 HA GLN 3 HA GLN 3 52.893 18.968 3.267
18 HB2 GLN 3 2HB GLN 3 54.766 19.365 4.803
19 HB3 GLN 3 1HB GLN 3 55.239 17.675 4.690
20 HG2 GLN 3 2HG GLN 3 55.741 17.974 2.314
21 HG3 GLN 3 1HG GLN 3 55.260 19.666 2.426
22 HE21 GLN 3 1HE2 GLN 3 57.844 18.453 1.703
23 HE22 GLN 3 2HE2 GLN 3 58.994 19.124 2.807
24 H LYS 4 H LYS 4 52.059 17.849 1.595
25 HA LYS 4 HA LYS 4 53.300 15.273 0.880
26 HB2 LYS 4 2HB LYS 4 50.333 15.885 0.781
27 HB3 LYS 4 1HB LYS 4 51.084 14.449 0.100
28 HG2 LYS 4 2HG LYS 4 51.793 13.756 2.336
29 HG3 LYS 4 1HG LYS 4 51.047 15.201 3.024
30 HD2 LYS 4 2HD LYS 4 49.620 12.972 1.551
31 HD3 LYS 4 1HD LYS 4 49.583 13.264 3.291
32 HE2 LYS 4 2HE LYS 4 48.519 15.450 2.884
33 HE3 LYS 4 1HE LYS 4 48.533 15.127 1.154
34 HZ1 LYS 4 3HZ LYS 4 47.052 13.583 3.207
35 HZ2 LYS 4 1HZ LYS 4 47.090 13.215 1.561
36 HZ3 LYS 4 2HZ LYS 4 46.380 14.654 2.090
37 H SER 5 H SER 5 52.902 14.697 -1.436
38 HA SER 5 HA SER 5 53.217 17.013 -3.163
39 HB2 SER 5 2HB SER 5 53.183 14.049 -3.828
40 HB3 SER 5 1HB SER 5 53.636 15.341 -4.941
41 HG SER 5 HG SER 5 55.442 14.301 -3.913
42 H SER 6 H SER 6 50.567 16.032 -1.843
43 HA SER 6 HA SER 6 48.907 15.265 -4.063
44 HB2 SER 6 2HB SER 6 48.173 15.958 -1.205
45 HB3 SER 6 1HB SER 6 47.079 15.255 -2.399
46 HG SER 6 HG SER 6 47.985 13.654 -1.053
47 H SER 7 H SER 7 47.655 16.496 -5.303
48 HA SER 7 HA SER 7 47.401 19.361 -4.793
49 HB2 SER 7 2HB SER 7 46.277 17.687 -7.068
50 HB3 SER 7 1HB SER 7 46.302 19.449 -6.989
51 HG SER 7 HG SER 7 48.082 18.061 -8.119
52 HA PRO 8 HA PRO 8 43.497 18.924 -2.665
53 HB2 PRO 8 2HB PRO 8 42.393 21.372 -3.342
54 HB3 PRO 8 1HB PRO 8 43.530 21.111 -2.016
55 HG2 PRO 8 2HG PRO 8 44.054 22.115 -4.790
56 HG3 PRO 8 1HG PRO 8 44.738 22.669 -3.250
57 HD2 PRO 8 2HD PRO 8 46.130 21.088 -4.920
58 HD3 PRO 8 1HD PRO 8 46.264 20.914 -3.156
59 H GLN 9 H GLN 9 42.592 17.270 -3.921
60 HA GLN 9 HA GLN 9 40.750 18.127 -6.068
61 HB2 GLN 9 2HB GLN 9 42.372 15.574 -5.879
62 HB3 GLN 9 1HB GLN 9 41.087 15.830 -7.051
63 HG2 GLN 9 2HG GLN 9 42.322 17.655 -8.060
64 HG3 GLN 9 1HG GLN 9 43.581 17.510 -6.833
65 HE21 GLN 9 1HE2 GLN 9 45.144 17.142 -8.440
66 HE22 GLN 9 2HE2 GLN 9 45.267 15.631 -9.264
67 HA PRO 10 HA PRO 10 37.388 16.423 -3.699
68 HB2 PRO 10 2HB PRO 10 36.293 15.484 -6.304
69 HB3 PRO 10 1HB PRO 10 35.565 16.542 -5.090
70 HG2 PRO 10 2HG PRO 10 36.478 17.546 -7.379
71 HG3 PRO 10 1HG PRO 10 36.706 18.422 -5.852
72 HD2 PRO 10 2HD PRO 10 38.672 16.761 -7.397
73 HD3 PRO 10 1HD PRO 10 38.913 18.321 -6.578
74 H ALA 11 H ALA 11 36.282 14.418 -3.158
75 HA ALA 11 HA ALA 11 37.952 12.054 -3.715
76 HB1 ALA 11 3HB ALA 11 37.770 12.747 -1.374
77 HB2 ALA 11 1HB ALA 11 37.083 11.143 -1.633
78 HB3 ALA 11 2HB ALA 11 36.020 12.538 -1.447
79 H ALA 12 H ALA 12 36.429 9.960 -3.114
80 HA ALA 12 HA ALA 12 34.456 9.915 -5.279
81 HB1 ALA 12 3HB ALA 12 36.251 8.249 -5.308
82 HB2 ALA 12 1HB ALA 12 34.664 7.489 -5.173
83 HB3 ALA 12 2HB ALA 12 35.699 7.629 -3.752
84 H GLN 13 H GLN 13 33.952 10.941 -2.413
85 HA GLN 13 HA GLN 13 32.066 9.063 -1.304
86 HB2 GLN 13 2HB GLN 13 32.796 11.897 -0.567
87 HB3 GLN 13 1HB GLN 13 31.559 10.980 0.284
88 HG2 GLN 13 2HG GLN 13 34.457 10.184 0.028
89 HG3 GLN 13 1HG GLN 13 33.718 10.940 1.441
90 HE21 GLN 13 1HE2 GLN 13 32.257 9.721 2.696
91 HE22 GLN 13 2HE2 GLN 13 32.211 7.998 2.601
92 H ALA 14 H ALA 14 30.231 8.714 -2.386
93 HA ALA 14 HA ALA 14 28.758 10.897 -3.639
94 HB1 ALA 14 3HB ALA 14 27.272 9.152 -4.479
95 HB2 ALA 14 1HB ALA 14 28.108 7.950 -3.495
96 HB3 ALA 14 2HB ALA 14 28.957 8.752 -4.818
97 HA PRO 15 HA PRO 15 26.615 11.793 0.227
98 HB2 PRO 15 2HB PRO 15 24.657 12.919 -1.745
99 HB3 PRO 15 1HB PRO 15 25.305 13.640 -0.263
100 HG2 PRO 15 2HG PRO 15 26.242 14.402 -2.627
101 HG3 PRO 15 1HG PRO 15 27.350 14.165 -1.262
102 HD2 PRO 15 2HD PRO 15 26.867 12.416 -3.640
103 HD3 PRO 15 1HD PRO 15 28.380 12.740 -2.766
104 H GLU 16 H GLU 16 25.678 10.106 1.212
105 HA GLU 16 HA GLU 16 23.454 8.690 -0.097
106 HB2 GLU 16 2HB GLU 16 25.457 7.407 0.743
107 HB3 GLU 16 1HB GLU 16 25.009 7.880 2.374
108 HG2 GLU 16 2HG GLU 16 24.237 5.647 1.972
109 HG3 GLU 16 1HG GLU 16 22.840 6.717 2.072
110 H THR 17 H THR 17 21.460 9.386 0.465
111 HA THR 17 HA THR 17 21.046 10.529 3.169
112 HB THR 17 HB THR 17 19.469 11.060 0.631
113 HG1 THR 17 HG1 THR 17 20.409 13.198 0.938
114 HG21 THR 17 3HG2 THR 17 19.209 12.309 3.378
115 HG22 THR 17 1HG2 THR 17 18.050 11.210 2.627
116 HG23 THR 17 2HG2 THR 17 18.330 12.805 1.931
117 H LYS 18 H LYS 18 19.580 9.603 4.518
118 HA LYS 18 HA LYS 18 17.785 7.519 3.427
119 HB2 LYS 18 2HB LYS 18 19.395 6.664 5.080
120 HB3 LYS 18 1HB LYS 18 18.834 7.855 6.251
121 HG2 LYS 18 2HG LYS 18 16.546 6.805 6.064
122 HG3 LYS 18 1HG LYS 18 17.301 5.516 5.130
123 HD2 LYS 18 2HD LYS 18 18.019 6.292 7.962
124 HD3 LYS 18 1HD LYS 18 17.025 4.913 7.495
125 HE2 LYS 18 2HE LYS 18 18.947 3.972 6.261
126 HE3 LYS 18 1HE LYS 18 19.934 5.335 6.792
127 HZ1 LYS 18 3HZ LYS 18 19.589 4.654 9.080
128 HZ2 LYS 18 1HZ LYS 18 20.274 3.391 8.187
129 HZ3 LYS 18 2HZ LYS 18 18.630 3.357 8.578
130 H GLN 19 H GLN 19 15.604 7.582 3.894
131 HA GLN 19 HA GLN 19 14.617 9.756 5.643
132 HB2 GLN 19 2HB GLN 19 13.287 8.551 3.198
133 HB3 GLN 19 1HB GLN 19 12.512 9.690 4.288
134 HG2 GLN 19 2HG GLN 19 14.973 10.254 2.637
135 HG3 GLN 19 1HG GLN 19 13.332 10.744 2.223
136 HE21 GLN 19 1HE2 GLN 19 16.066 11.349 4.275
137 HE22 GLN 19 2HE2 GLN 19 15.498 12.842 4.929
138 H ALA 20 H ALA 20 12.998 9.207 7.149
139 HA ALA 20 HA ALA 20 13.008 6.379 7.861
140 HB1 ALA 20 3HB ALA 20 13.536 8.057 9.566
141 HB2 ALA 20 1HB ALA 20 12.118 7.104 10.005
142 HB3 ALA 20 2HB ALA 20 11.922 8.745 9.388
143 H PHE 21 H PHE 21 11.317 5.021 7.750
144 HA PHE 21 HA PHE 21 8.854 5.844 6.468
145 HB2 PHE 21 2HB PHE 21 9.749 3.154 7.554
146 HB3 PHE 21 1HB PHE 21 8.265 3.424 6.649
147 HD1 PHE 21 HD1 PHE 21 8.544 4.470 4.281
148 HD2 PHE 21 HD2 PHE 21 11.680 2.546 6.429
149 HE1 PHE 21 HE1 PHE 21 9.755 4.090 2.175
150 HE2 PHE 21 HE2 PHE 21 12.891 2.162 4.325
151 HZ PHE 21 HZ PHE 21 11.929 2.932 2.194
152 HA PRO 22 HA PRO 22 6.880 6.225 10.570
153 HB2 PRO 22 2HB PRO 22 4.855 7.829 9.842
154 HB3 PRO 22 1HB PRO 22 6.502 8.447 10.026
155 HG2 PRO 22 2HG PRO 22 5.017 7.731 7.527
156 HG3 PRO 22 1HG PRO 22 6.090 9.108 7.835
157 HD2 PRO 22 2HD PRO 22 6.842 6.786 6.524
158 HD3 PRO 22 1HD PRO 22 7.967 7.898 7.328
159 H ARG 23 H ARG 23 6.129 4.110 10.841
160 HA ARG 23 HA ARG 23 4.224 2.920 9.075
161 HB2 ARG 23 2HB ARG 23 4.181 1.048 10.686
162 HB3 ARG 23 1HB ARG 23 5.812 1.503 10.217
163 HG2 ARG 23 2HG ARG 23 6.173 2.611 12.317
164 HG3 ARG 23 1HG ARG 23 4.486 2.383 12.782
165 HD2 ARG 23 2HD ARG 23 4.825 -0.051 12.780
166 HD3 ARG 23 1HD ARG 23 6.508 0.185 12.312
167 HE ARG 23 HE ARG 23 6.892 1.205 14.471
168 HH11 ARG 23 1HH1 ARG 23 3.916 -0.509 14.139
169 HH12 ARG 23 2HH1 ARG 23 3.748 -0.761 15.838
170 HH21 ARG 23 1HH2 ARG 23 6.644 0.847 16.675
171 HH22 ARG 23 2HH2 ARG 23 5.255 -0.022 17.235
172 H LYS 24 H LYS 24 3.942 4.723 12.052
173 HA LYS 24 HA LYS 24 1.431 3.844 12.926
174 HB2 LYS 24 2HB LYS 24 2.863 6.472 13.280
175 HB3 LYS 24 1HB LYS 24 1.329 6.113 14.066
176 HG2 LYS 24 2HG LYS 24 2.348 4.183 15.175
177 HG3 LYS 24 1HG LYS 24 3.889 4.552 14.396
178 HD2 LYS 24 2HD LYS 24 4.112 6.588 15.611
179 HD3 LYS 24 1HD LYS 24 2.443 6.511 16.177
180 HE2 LYS 24 2HE LYS 24 4.629 4.564 16.917
181 HE3 LYS 24 1HE LYS 24 4.053 5.888 17.931
182 HZ1 LYS 24 3HZ LYS 24 2.434 3.575 16.999
183 HZ2 LYS 24 1HZ LYS 24 1.850 4.864 17.930
184 HZ3 LYS 24 2HZ LYS 24 3.013 3.818 18.570
185 H PHE 25 H PHE 25 2.234 6.216 10.450
186 HA PHE 25 HA PHE 25 -0.576 6.950 10.122
187 HB2 PHE 25 2HB PHE 25 1.932 7.866 8.705
188 HB3 PHE 25 1HB PHE 25 0.317 8.412 8.270
189 HD1 PHE 25 HD2 PHE 25 2.976 8.585 10.778
190 HD2 PHE 25 HD1 PHE 25 -0.924 9.925 9.698
191 HE1 PHE 25 HE2 PHE 25 3.113 10.356 12.475
192 HE2 PHE 25 HE1 PHE 25 -0.785 11.697 11.401
193 HZ PHE 25 HZ PHE 25 1.237 11.913 12.791
194 H VAL 26 H VAL 26 1.986 5.346 8.241
195 HA VAL 26 HA VAL 26 0.501 4.863 5.917
196 HB VAL 26 HB VAL 26 2.773 3.206 7.044
197 HG11 VAL 26 1HG1 VAL 26 1.657 3.355 4.237
198 HG12 VAL 26 2HG1 VAL 26 1.572 1.973 5.331
199 HG13 VAL 26 3HG1 VAL 26 3.132 2.508 4.705
200 HG21 VAL 26 3HG2 VAL 26 3.384 5.557 6.762
201 HG22 VAL 26 1HG2 VAL 26 2.807 5.524 5.095
202 HG23 VAL 26 2HG2 VAL 26 4.204 4.553 5.568
203 H LEU 27 H LEU 27 1.018 2.692 8.723
204 HA LEU 27 HA LEU 27 -0.622 0.593 7.779
205 HB2 LEU 27 2HB LEU 27 0.109 1.352 10.613
206 HB3 LEU 27 1HB LEU 27 -0.692 -0.142 10.165
207 HG LEU 27 HG LEU 27 2.089 0.689 9.310
208 HD11 LEU 27 1HD1 LEU 27 2.838 -1.151 10.735
209 HD12 LEU 27 2HD1 LEU 27 1.173 -1.440 11.243
210 HD13 LEU 27 3HD1 LEU 27 1.975 0.074 11.665
211 HD21 LEU 27 3HD2 LEU 27 0.574 -1.872 8.777
212 HD22 LEU 27 1HD2 LEU 27 2.256 -1.553 8.345
213 HD23 LEU 27 2HD2 LEU 27 0.960 -0.631 7.583
214 H ALA 28 H ALA 28 -1.357 3.519 9.600
215 HA ALA 28 HA ALA 28 -3.997 2.922 10.352
216 HB1 ALA 28 3HB ALA 28 -2.853 5.640 9.679
217 HB2 ALA 28 1HB ALA 28 -2.727 4.834 11.245
218 HB3 ALA 28 2HB ALA 28 -4.306 5.320 10.626
219 H ALA 29 H ALA 29 -2.792 4.632 7.449
220 HA ALA 29 HA ALA 29 -5.308 4.893 6.185
221 HB1 ALA 29 3HB ALA 29 -2.577 4.737 4.901
222 HB2 ALA 29 1HB ALA 29 -3.332 6.200 5.533
223 HB3 ALA 29 2HB ALA 29 -4.047 5.363 4.154
224 H LEU 30 H LEU 30 -2.852 2.372 6.089
225 HA LEU 30 HA LEU 30 -3.837 0.797 4.005
226 HB2 LEU 30 2HB LEU 30 -1.619 0.533 5.021
227 HB3 LEU 30 1HB LEU 30 -2.353 -0.050 6.501
228 HG LEU 30 HG LEU 30 -3.171 -2.051 5.322
229 HD11 LEU 30 1HD1 LEU 30 -2.472 -2.538 3.048
230 HD12 LEU 30 2HD1 LEU 30 -1.679 -0.966 2.934
231 HD13 LEU 30 3HD1 LEU 30 -3.432 -1.059 3.093
232 HD21 LEU 30 3HD2 LEU 30 -0.216 -1.534 4.958
233 HD22 LEU 30 1HD2 LEU 30 -0.991 -3.119 4.967
234 HD23 LEU 30 2HD2 LEU 30 -1.000 -2.128 6.423
235 H GLU 31 H GLU 31 -4.437 0.423 7.519
236 HA GLU 31 HA GLU 31 -6.173 -1.803 7.230
237 HB2 GLU 31 2HB GLU 31 -6.680 -1.511 9.582
238 HB3 GLU 31 1HB GLU 31 -4.957 -1.285 9.313
239 HG2 GLU 31 2HG GLU 31 -5.357 1.184 9.339
240 HG3 GLU 31 1HG GLU 31 -7.025 0.852 9.806
241 H GLN 32 H GLN 32 -6.752 1.645 7.107
242 HA GLN 32 HA GLN 32 -9.607 1.458 7.356
243 HB2 GLN 32 2HB GLN 32 -7.797 3.672 6.375
244 HB3 GLN 32 1HB GLN 32 -9.546 3.834 6.496
245 HG2 GLN 32 2HG GLN 32 -9.426 3.409 8.899
246 HG3 GLN 32 1HG GLN 32 -7.674 3.231 8.782
247 HE21 GLN 32 1HE2 GLN 32 -6.414 5.068 8.449
248 HE22 GLN 32 2HE2 GLN 32 -7.034 6.661 8.688
249 H SER 33 H SER 33 -7.350 1.655 4.617
250 HA SER 33 HA SER 33 -9.452 1.584 2.637
251 HB2 SER 33 2HB SER 33 -6.461 1.150 2.368
252 HB3 SER 33 1HB SER 33 -7.583 1.265 1.013
253 HG SER 33 HG SER 33 -6.899 3.301 1.223
254 H SER 34 H SER 34 -8.451 -0.717 4.728
255 HA SER 34 HA SER 34 -8.212 -3.010 3.041
256 HB2 SER 34 2HB SER 34 -8.842 -2.797 5.997
257 HB3 SER 34 1HB SER 34 -8.532 -4.315 5.154
258 HG SER 34 HG SER 34 -6.650 -2.254 4.913
259 H ASP 35 H ASP 35 -9.721 -4.334 2.224
260 HA ASP 35 HA ASP 35 -12.502 -3.602 2.407
261 HB2 ASP 35 2HB ASP 35 -11.185 -5.913 0.959
262 HB3 ASP 35 1HB ASP 35 -12.847 -5.370 0.737
263 H ASP 36 H ASP 36 -13.990 -5.770 2.364
264 HA ASP 36 HA ASP 36 -14.274 -6.509 5.036
265 HB2 ASP 36 2HB ASP 36 -16.058 -6.505 3.279
266 HB3 ASP 36 1HB ASP 36 -15.362 -7.984 2.626
267 H ALA 37 H ALA 37 -12.208 -7.884 2.646
268 HA ALA 37 HA ALA 37 -11.989 -10.481 3.934
269 HB1 ALA 37 3HB ALA 37 -10.432 -11.030 2.157
270 HB2 ALA 37 1HB ALA 37 -10.400 -9.346 1.633
271 HB3 ALA 37 2HB ALA 37 -11.884 -10.288 1.483
272 H GLY 38 H GLY 38 -10.765 -7.538 4.761
273 HA2 GLY 38 2HA GLY 38 -9.121 -6.994 6.310
274 HA3 GLY 38 1HA GLY 38 -8.630 -8.678 6.337
275 H TRP 39 H TRP 39 -8.794 -7.165 3.261
276 HA TRP 39 HA TRP 39 -5.890 -6.644 3.230
277 HB2 TRP 39 2HB TRP 39 -7.532 -8.146 1.177
278 HB3 TRP 39 1HB TRP 39 -5.934 -7.497 0.829
279 HD1 TRP 39 HD1 TRP 39 -7.654 -10.195 2.967
280 HE1 TRP 39 HE1 TRP 39 -5.897 -11.961 3.598
281 HE3 TRP 39 HE3 TRP 39 -3.500 -7.873 1.129
282 HZ2 TRP 39 HZ2 TRP 39 -3.099 -12.325 3.339
283 HZ3 TRP 39 HZ3 TRP 39 -1.316 -8.989 1.355
284 HH2 TRP 39 HH2 TRP 39 -1.121 -11.169 2.438
285 H ALA 40 H ALA 40 -5.235 -4.859 2.074
286 HA ALA 40 HA ALA 40 -7.381 -3.137 0.997
287 HB1 ALA 40 3HB ALA 40 -5.902 -1.258 1.447
288 HB2 ALA 40 1HB ALA 40 -4.633 -2.360 1.984
289 HB3 ALA 40 2HB ALA 40 -6.133 -2.225 2.902
290 H ASN 41 H ASN 41 -7.445 -2.773 -1.136
291 HA ASN 41 HA ASN 41 -5.560 -3.805 -2.971
292 HB2 ASN 41 2HB ASN 41 -7.948 -3.372 -3.514
293 HB3 ASN 41 1HB ASN 41 -7.645 -1.642 -3.416
294 HD21 ASN 41 1HD2 ASN 41 -8.609 -3.255 -5.646
295 HD22 ASN 41 2HD2 ASN 41 -7.503 -2.979 -6.943
296 H LEU 42 H LEU 42 -3.738 -2.972 -3.791
297 HA LEU 42 HA LEU 42 -2.217 -1.010 -2.721
298 HB2 LEU 42 2HB LEU 42 -1.394 -2.579 -4.374
299 HB3 LEU 42 1HB LEU 42 -2.368 -1.829 -5.623
300 HG LEU 42 HG LEU 42 -1.003 0.252 -5.365
301 HD11 LEU 42 1HD1 LEU 42 -0.214 -0.070 -3.090
302 HD12 LEU 42 2HD1 LEU 42 1.149 0.103 -4.195
303 HD13 LEU 42 3HD1 LEU 42 0.703 -1.492 -3.586
304 HD21 LEU 42 3HD2 LEU 42 0.901 -0.591 -6.592
305 HD22 LEU 42 1HD2 LEU 42 -0.562 -1.412 -7.120
306 HD23 LEU 42 2HD2 LEU 42 0.571 -2.234 -6.045
307 H GLY 43 H GLY 43 -4.505 -0.518 -5.421
308 HA2 GLY 43 2HA GLY 43 -4.016 2.208 -5.871
309 HA3 GLY 43 1HA GLY 43 -5.521 1.379 -6.231
310 H ASN 44 H ASN 44 -6.611 0.766 -3.875
311 HA ASN 44 HA ASN 44 -7.620 3.214 -2.890
312 HB2 ASN 44 2HB ASN 44 -7.790 0.421 -1.729
313 HB3 ASN 44 1HB ASN 44 -8.711 1.797 -1.130
314 HD21 ASN 44 1HD2 ASN 44 -9.656 -0.702 -2.300
315 HD22 ASN 44 2HD2 ASN 44 -10.623 -0.249 -3.656
316 H PHE 45 H PHE 45 -5.061 1.105 -1.730
317 HA PHE 45 HA PHE 45 -4.628 2.320 0.783
318 HB2 PHE 45 2HB PHE 45 -3.664 0.172 0.376
319 HB3 PHE 45 1HB PHE 45 -2.828 0.743 -1.062
320 HD1 PHE 45 HD1 PHE 45 -3.013 1.885 2.505
321 HD2 PHE 45 HD2 PHE 45 -0.548 0.765 -0.785
322 HE1 PHE 45 HE1 PHE 45 -1.008 2.338 3.856
323 HE2 PHE 45 HE2 PHE 45 1.461 1.217 0.563
324 HZ PHE 45 HZ PHE 45 1.232 2.005 2.883
325 H GLY 46 H GLY 46 -2.744 2.730 -2.249
326 HA2 GLY 46 2HA GLY 46 -1.172 4.879 -1.395
327 HA3 GLY 46 1HA GLY 46 -1.565 4.528 -3.071
328 H ASN 47 H ASN 47 -4.379 4.884 -2.863
329 HA ASN 47 HA ASN 47 -4.706 7.613 -3.329
330 HB2 ASN 47 2HB ASN 47 -6.245 5.784 -4.068
331 HB3 ASN 47 1HB ASN 47 -6.830 5.648 -2.414
332 HD21 ASN 47 1HD2 ASN 47 -8.325 6.265 -4.797
333 HD22 ASN 47 2HD2 ASN 47 -9.045 7.816 -4.535
334 H TYR 48 H TYR 48 -5.799 5.779 -0.452
335 HA TYR 48 HA TYR 48 -6.561 8.162 0.945
336 HB2 TYR 48 2HB TYR 48 -7.596 5.832 1.182
337 HB3 TYR 48 1HB TYR 48 -6.206 5.429 2.186
338 HD1 TYR 48 HD2 TYR 48 -9.010 7.859 1.888
339 HD2 TYR 48 HD1 TYR 48 -6.243 5.937 4.496
340 HE1 TYR 48 HE2 TYR 48 -10.161 8.842 3.822
341 HE2 TYR 48 HE1 TYR 48 -7.392 6.916 6.439
342 HH TYR 48 HH TYR 48 -10.442 8.286 6.268
343 H LEU 49 H LEU 49 -3.655 6.263 0.778
344 HA LEU 49 HA LEU 49 -2.443 6.942 3.213
345 HB2 LEU 49 2HB LEU 49 -1.576 5.183 1.776
346 HB3 LEU 49 1HB LEU 49 -1.172 6.355 0.536
347 HG LEU 49 HG LEU 49 0.519 7.360 2.033
348 HD11 LEU 49 1HD1 LEU 49 -0.251 5.135 3.926
349 HD12 LEU 49 2HD1 LEU 49 -0.492 6.864 4.182
350 HD13 LEU 49 3HD1 LEU 49 1.140 6.204 4.116
351 HD21 LEU 49 3HD2 LEU 49 1.168 5.575 0.472
352 HD22 LEU 49 1HD2 LEU 49 0.845 4.371 1.719
353 HD23 LEU 49 2HD2 LEU 49 2.143 5.546 1.942
354 H ASN 50 H ASN 50 -2.033 8.514 0.020
355 HA ASN 50 HA ASN 50 -0.286 10.521 0.944
356 HB2 ASN 50 2HB ASN 50 -0.534 9.923 -1.437
357 HB3 ASN 50 1HB ASN 50 -2.149 10.631 -1.440
358 HD21 ASN 50 1HD2 ASN 50 1.275 11.322 -1.224
359 HD22 ASN 50 2HD2 ASN 50 1.141 13.004 -1.582
360 H LYS 51 H LYS 51 -3.775 10.319 1.021
361 HA LYS 51 HA LYS 51 -4.384 13.031 1.516
362 HB2 LYS 51 2HB LYS 51 -5.804 10.558 2.549
363 HB3 LYS 51 1HB LYS 51 -6.476 12.184 2.510
364 HG2 LYS 51 2HG LYS 51 -6.434 12.181 0.086
365 HG3 LYS 51 1HG LYS 51 -5.652 10.598 0.079
366 HD2 LYS 51 2HD LYS 51 -8.001 10.300 -0.367
367 HD3 LYS 51 1HD LYS 51 -7.642 9.662 1.239
368 HE2 LYS 51 2HE LYS 51 -9.715 10.913 1.295
369 HE3 LYS 51 1HE LYS 51 -8.485 11.758 2.233
370 HZ1 LYS 51 3HZ LYS 51 -9.230 12.426 -0.558
371 HZ2 LYS 51 1HZ LYS 51 -8.162 13.286 0.427
372 HZ3 LYS 51 2HZ LYS 51 -9.806 13.235 0.809
373 H LEU 52 H LEU 52 -3.320 10.427 3.648
374 HA LEU 52 HA LEU 52 -3.540 12.117 6.018
375 HB2 LEU 52 2HB LEU 52 -2.445 9.307 5.759
376 HB3 LEU 52 1HB LEU 52 -2.791 10.152 7.258
377 HG LEU 52 HG LEU 52 -4.787 9.156 5.217
378 HD11 LEU 52 1HD1 LEU 52 -4.364 8.444 8.119
379 HD12 LEU 52 2HD1 LEU 52 -3.901 7.457 6.732
380 HD13 LEU 52 3HD1 LEU 52 -5.604 7.781 7.052
381 HD21 LEU 52 3HD2 LEU 52 -6.533 10.045 6.716
382 HD22 LEU 52 1HD2 LEU 52 -5.548 11.322 6.002
383 HD23 LEU 52 2HD2 LEU 52 -5.285 10.839 7.678
384 H GLN 53 H GLN 53 -1.053 10.869 3.865
385 HA GLN 53 HA GLN 53 0.953 12.484 5.298
386 HB2 GLN 53 2HB GLN 53 1.272 9.667 4.267
387 HB3 GLN 53 1HB GLN 53 2.643 10.698 4.638
388 HG2 GLN 53 2HG GLN 53 0.505 9.932 6.618
389 HG3 GLN 53 1HG GLN 53 2.054 9.110 6.440
390 HE21 GLN 53 1HE2 GLN 53 0.471 12.018 7.513
391 HE22 GLN 53 2HE2 GLN 53 1.823 12.662 8.372
392 HA PRO 54 HA PRO 54 1.332 13.777 0.870
393 HB2 PRO 54 2HB PRO 54 1.603 16.425 1.430
394 HB3 PRO 54 1HB PRO 54 0.027 15.655 1.214
395 HG2 PRO 54 2HG PRO 54 1.451 16.375 3.752
396 HG3 PRO 54 1HG PRO 54 -0.267 16.540 3.343
397 HD2 PRO 54 2HD PRO 54 0.720 14.504 4.867
398 HD3 PRO 54 1HD PRO 54 -0.729 14.349 3.853
399 H ASP 55 H ASP 55 3.052 14.065 3.829
400 HA ASP 55 HA ASP 55 5.529 15.045 2.729
401 HB2 ASP 55 2HB ASP 55 4.802 15.503 5.059
402 HB3 ASP 55 1HB ASP 55 4.920 13.787 5.419
403 H PHE 56 H PHE 56 3.968 12.053 2.750
404 HA PHE 56 HA PHE 56 6.467 10.490 2.706
405 HB2 PHE 56 2HB PHE 56 4.641 9.746 4.231
406 HB3 PHE 56 1HB PHE 56 3.590 9.532 2.837
407 HD1 PHE 56 HD1 PHE 56 6.689 8.305 4.453
408 HD2 PHE 56 HD2 PHE 56 3.662 7.542 1.553
409 HE1 PHE 56 HE1 PHE 56 7.498 5.996 4.221
410 HE2 PHE 56 HE2 PHE 56 4.472 5.229 1.314
411 HZ PHE 56 HZ PHE 56 6.391 4.453 2.651
412 H ASP 57 H ASP 57 7.289 10.657 0.661
413 HA ASP 57 HA ASP 57 5.519 9.888 -1.576
414 HB2 ASP 57 2HB ASP 57 6.049 12.345 -1.528
415 HB3 ASP 57 1HB ASP 57 7.746 11.933 -1.751
416 H SER 58 H SER 58 6.312 8.420 -3.019
417 HA SER 58 HA SER 58 8.381 6.705 -2.196
418 HB2 SER 58 2HB SER 58 7.101 6.921 -4.934
419 HB3 SER 58 1HB SER 58 8.042 5.551 -4.344
420 HG SER 58 HG SER 58 5.496 5.831 -4.114
421 H ARG 59 H ARG 59 8.398 9.297 -4.634
422 HA ARG 59 HA ARG 59 10.864 8.701 -5.833
423 HB2 ARG 59 2HB ARG 59 9.513 11.381 -5.436
424 HB3 ARG 59 1HB ARG 59 10.907 11.124 -6.476
425 HG2 ARG 59 2HG ARG 59 8.227 9.779 -6.822
426 HG3 ARG 59 1HG ARG 59 8.769 11.208 -7.705
427 HD2 ARG 59 2HD ARG 59 10.041 8.465 -7.770
428 HD3 ARG 59 1HD ARG 59 9.073 9.197 -9.049
429 HE ARG 59 HE ARG 59 11.524 10.568 -8.217
430 HH11 ARG 59 1HH1 ARG 59 9.846 8.727 -10.588
431 HH12 ARG 59 2HH1 ARG 59 11.027 9.026 -11.814
432 HH21 ARG 59 1HH2 ARG 59 13.030 10.934 -9.782
433 HH22 ARG 59 2HH2 ARG 59 12.820 10.250 -11.360
434 H LEU 60 H LEU 60 10.123 10.403 -2.847
435 HA LEU 60 HA LEU 60 12.620 11.585 -2.336
436 HB2 LEU 60 2HB LEU 60 10.631 10.477 -0.344
437 HB3 LEU 60 1HB LEU 60 11.938 11.583 0.034
438 HG LEU 60 HG LEU 60 9.599 12.226 -1.773
439 HD11 LEU 60 1HD1 LEU 60 8.830 13.657 0.054
440 HD12 LEU 60 2HD1 LEU 60 10.153 13.081 1.069
441 HD13 LEU 60 3HD1 LEU 60 8.893 11.964 0.542
442 HD21 LEU 60 3HD2 LEU 60 11.646 13.455 -2.348
443 HD22 LEU 60 1HD2 LEU 60 11.774 14.017 -0.681
444 HD23 LEU 60 2HD2 LEU 60 10.410 14.518 -1.679
445 H TYR 61 H TYR 61 11.539 8.284 -1.981
446 HA TYR 61 HA TYR 61 13.925 7.513 -0.465
447 HB2 TYR 61 2HB TYR 61 11.496 5.910 -1.308
448 HB3 TYR 61 1HB TYR 61 12.809 5.298 -0.308
449 HD1 TYR 61 HD1 TYR 61 9.938 7.619 -0.411
450 HD2 TYR 61 HD2 TYR 61 12.963 5.872 2.028
451 HE1 TYR 61 HE1 TYR 61 8.787 8.443 1.599
452 HE2 TYR 61 HE2 TYR 61 11.817 6.697 4.040
453 HH TYR 61 HH TYR 61 8.661 7.880 4.013
454 H GLY 62 H GLY 62 13.253 7.968 -3.651
455 HA2 GLY 62 2HA GLY 62 14.675 7.458 -5.439
456 HA3 GLY 62 1HA GLY 62 15.425 6.206 -4.470
457 H TYR 63 H TYR 63 12.040 5.975 -4.432
458 HA TYR 63 HA TYR 63 12.130 3.720 -6.320
459 HB2 TYR 63 2HB TYR 63 10.052 4.507 -4.257
460 HB3 TYR 63 1HB TYR 63 9.904 3.129 -5.340
461 HD1 TYR 63 HD1 TYR 63 12.068 4.539 -2.649
462 HD2 TYR 63 HD2 TYR 63 10.793 1.048 -4.723
463 HE1 TYR 63 HE1 TYR 63 13.239 3.138 -1.004
464 HE2 TYR 63 HE2 TYR 63 11.961 -0.360 -3.085
465 HH TYR 63 HH TYR 63 13.797 -0.189 -1.471
466 H LYS 64 H LYS 64 10.636 3.524 -8.050
467 HA LYS 64 HA LYS 64 9.906 5.955 -9.321
468 HB2 LYS 64 2HB LYS 64 9.078 3.111 -9.935
469 HB3 LYS 64 1HB LYS 64 8.741 4.489 -10.975
470 HG2 LYS 64 2HG LYS 64 11.458 3.404 -10.239
471 HG3 LYS 64 1HG LYS 64 10.657 3.293 -11.807
472 HD2 LYS 64 2HD LYS 64 11.547 5.850 -10.453
473 HD3 LYS 64 1HD LYS 64 12.382 5.048 -11.784
474 HE2 LYS 64 2HE LYS 64 9.583 6.186 -11.891
475 HE3 LYS 64 1HE LYS 64 11.026 6.939 -12.566
476 HZ1 LYS 64 3HZ LYS 64 11.274 5.003 -14.025
477 HZ2 LYS 64 1HZ LYS 64 9.804 5.803 -14.275
478 HZ3 LYS 64 2HZ LYS 64 9.836 4.353 -13.412
479 H LYS 65 H LYS 65 7.921 3.466 -7.698
480 HA LYS 65 HA LYS 65 6.066 5.528 -6.888
481 HB2 LYS 65 2HB LYS 65 4.059 4.418 -7.769
482 HB3 LYS 65 1HB LYS 65 5.126 4.964 -9.054
483 HG2 LYS 65 2HG LYS 65 5.886 2.727 -9.466
484 HG3 LYS 65 1HG LYS 65 5.026 2.123 -8.047
485 HD2 LYS 65 2HD LYS 65 3.784 1.600 -10.078
486 HD3 LYS 65 1HD LYS 65 2.884 2.744 -9.082
487 HE2 LYS 65 2HE LYS 65 2.706 3.477 -11.341
488 HE3 LYS 65 1HE LYS 65 3.810 4.582 -10.527
489 HZ1 LYS 65 3HZ LYS 65 4.721 4.032 -12.640
490 HZ2 LYS 65 1HZ LYS 65 4.518 2.373 -12.377
491 HZ3 LYS 65 2HZ LYS 65 5.656 3.234 -11.478
492 H LEU 66 H LEU 66 4.165 4.453 -5.630
493 HA LEU 66 HA LEU 66 5.253 3.417 -3.306
494 HB2 LEU 66 2HB LEU 66 3.089 4.606 -3.518
495 HB3 LEU 66 1HB LEU 66 2.393 3.168 -4.239
496 HG LEU 66 HG LEU 66 2.783 1.932 -2.133
497 HD11 LEU 66 1HD1 LEU 66 4.714 3.198 -1.321
498 HD12 LEU 66 2HD1 LEU 66 3.434 3.123 -0.111
499 HD13 LEU 66 3HD1 LEU 66 3.681 4.601 -1.042
500 HD21 LEU 66 3HD2 LEU 66 1.232 4.503 -1.824
501 HD22 LEU 66 1HD2 LEU 66 1.053 3.064 -0.818
502 HD23 LEU 66 2HD2 LEU 66 0.636 3.000 -2.530
503 H SER 67 H SER 67 3.684 1.630 -5.952
504 HA SER 67 HA SER 67 3.454 -0.886 -4.817
505 HB2 SER 67 2HB SER 67 3.556 -1.793 -7.089
506 HB3 SER 67 1HB SER 67 2.616 -0.303 -7.066
507 HG SER 67 HG SER 67 4.050 -0.301 -8.808
508 H ASP 68 H ASP 68 6.291 0.459 -6.488
509 HA ASP 68 HA ASP 68 7.932 -1.832 -6.217
510 HB2 ASP 68 2HB ASP 68 8.285 0.029 -7.857
511 HB3 ASP 68 1HB ASP 68 8.813 1.052 -6.525
512 H LEU 69 H LEU 69 7.244 0.843 -4.085
513 HA LEU 69 HA LEU 69 9.438 0.438 -2.288
514 HB2 LEU 69 2HB LEU 69 8.384 2.607 -2.440
515 HB3 LEU 69 1HB LEU 69 6.829 1.928 -1.998
516 HG LEU 69 HG LEU 69 7.737 1.388 0.256
517 HD11 LEU 69 1HD1 LEU 69 9.849 2.383 0.970
518 HD12 LEU 69 2HD1 LEU 69 10.151 2.941 -0.675
519 HD13 LEU 69 3HD1 LEU 69 10.095 1.213 -0.327
520 HD21 LEU 69 3HD2 LEU 69 6.466 3.434 -0.086
521 HD22 LEU 69 1HD2 LEU 69 7.935 4.291 -0.556
522 HD23 LEU 69 2HD2 LEU 69 7.750 3.691 1.094
523 H VAL 70 H VAL 70 5.941 -0.230 -1.984
524 HA VAL 70 HA VAL 70 5.984 -1.309 0.574
525 HB VAL 70 HB VAL 70 4.083 -2.050 -1.662
526 HG11 VAL 70 1HG1 VAL 70 3.972 -3.603 0.234
527 HG12 VAL 70 2HG1 VAL 70 2.515 -2.620 0.125
528 HG13 VAL 70 3HG1 VAL 70 3.740 -2.245 1.336
529 HG21 VAL 70 3HG2 VAL 70 4.194 0.373 -1.293
530 HG22 VAL 70 1HG2 VAL 70 3.875 0.130 0.426
531 HG23 VAL 70 2HG2 VAL 70 2.643 -0.282 -0.768
532 H LYS 71 H LYS 71 6.175 -3.091 -2.527
533 HA LYS 71 HA LYS 71 6.236 -5.671 -1.386
534 HB2 LYS 71 2HB LYS 71 7.035 -6.454 -3.549
535 HB3 LYS 71 1HB LYS 71 5.742 -5.279 -3.761
536 HG2 LYS 71 2HG LYS 71 7.291 -3.578 -4.411
537 HG3 LYS 71 1HG LYS 71 8.669 -4.588 -3.967
538 HD2 LYS 71 2HD LYS 71 8.041 -6.195 -5.730
539 HD3 LYS 71 1HD LYS 71 6.697 -5.145 -6.190
540 HE2 LYS 71 2HE LYS 71 8.174 -3.423 -6.905
541 HE3 LYS 71 1HE LYS 71 9.564 -4.209 -6.165
542 HZ1 LYS 71 3HZ LYS 71 9.493 -4.477 -8.579
543 HZ2 LYS 71 1HZ LYS 71 8.023 -5.300 -8.452
544 HZ3 LYS 71 2HZ LYS 71 9.422 -5.967 -7.778
545 H ALA 72 H ALA 72 8.699 -3.269 -1.643
546 HA ALA 72 HA ALA 72 10.903 -5.135 -1.257
547 HB1 ALA 72 3HB ALA 72 10.890 -2.113 -1.314
548 HB2 ALA 72 1HB ALA 72 11.220 -3.174 -2.684
549 HB3 ALA 72 2HB ALA 72 12.322 -3.144 -1.309
550 H ARG 73 H ARG 73 8.624 -3.754 0.733
551 HA ARG 73 HA ARG 73 10.413 -3.761 3.094
552 HB2 ARG 73 2HB ARG 73 7.839 -2.208 2.699
553 HB3 ARG 73 1HB ARG 73 8.871 -2.146 4.122
554 HG2 ARG 73 2HG ARG 73 9.677 -1.274 1.345
555 HG3 ARG 73 1HG ARG 73 9.189 -0.197 2.656
556 HD2 ARG 73 2HD ARG 73 11.109 -0.707 3.927
557 HD3 ARG 73 1HD ARG 73 11.479 -2.126 2.950
558 HE ARG 73 HE ARG 73 11.619 0.026 1.234
559 HH11 ARG 73 1HH1 ARG 73 13.200 -0.916 4.150
560 HH12 ARG 73 2HH1 ARG 73 14.711 -0.208 3.683
561 HH21 ARG 73 1HH2 ARG 73 13.574 0.928 0.649
562 HH22 ARG 73 2HH2 ARG 73 14.906 0.849 1.751
563 H THR 74 H THR 74 9.579 -6.179 2.396
564 HA THR 74 HA THR 74 7.017 -7.066 3.070
565 HB THR 74 HB THR 74 8.028 -9.336 3.256
566 HG1 THR 74 HG1 THR 74 10.141 -9.567 3.487
567 HG21 THR 74 3HG2 THR 74 8.850 -9.455 0.951
568 HG22 THR 74 1HG2 THR 74 9.020 -7.697 0.912
569 HG23 THR 74 2HG2 THR 74 7.421 -8.427 1.058
570 H ASP 75 H ASP 75 9.692 -6.343 5.183
571 HA ASP 75 HA ASP 75 8.741 -7.866 7.422
572 HB2 ASP 75 2HB ASP 75 11.116 -7.291 7.136
573 HB3 ASP 75 1HB ASP 75 10.725 -5.583 7.305
574 H LEU 76 H LEU 76 8.064 -4.728 6.148
575 HA LEU 76 HA LEU 76 6.673 -3.865 8.581
576 HB2 LEU 76 2HB LEU 76 7.268 -2.423 5.992
577 HB3 LEU 76 1HB LEU 76 6.362 -1.721 7.321
578 HG LEU 76 HG LEU 76 9.243 -2.636 7.505
579 HD11 LEU 76 1HD1 LEU 76 9.812 -0.259 7.524
580 HD12 LEU 76 2HD1 LEU 76 8.121 0.157 7.246
581 HD13 LEU 76 3HD1 LEU 76 9.030 -0.716 6.011
582 HD21 LEU 76 3HD2 LEU 76 8.091 -2.744 9.646
583 HD22 LEU 76 1HD2 LEU 76 7.505 -1.089 9.441
584 HD23 LEU 76 2HD2 LEU 76 9.231 -1.400 9.636
585 H PHE 77 H PHE 77 6.035 -4.649 5.179
586 HA PHE 77 HA PHE 77 3.134 -4.516 5.742
587 HB2 PHE 77 2HB PHE 77 4.439 -3.916 3.074
588 HB3 PHE 77 1HB PHE 77 2.746 -3.696 3.504
589 HD1 PHE 77 HD1 PHE 77 2.574 -2.202 5.835
590 HD2 PHE 77 HD2 PHE 77 5.590 -1.930 2.832
591 HE1 PHE 77 HE1 PHE 77 3.055 0.112 6.519
592 HE2 PHE 77 HE2 PHE 77 6.072 0.378 3.523
593 HZ PHE 77 HZ PHE 77 4.805 1.400 5.369
594 H VAL 78 H VAL 78 1.891 -6.225 5.101
595 HA VAL 78 HA VAL 78 3.204 -8.573 3.964
596 HB VAL 78 HB VAL 78 0.303 -8.233 4.779
597 HG11 VAL 78 1HG1 VAL 78 1.941 -10.724 4.296
598 HG12 VAL 78 2HG1 VAL 78 0.664 -10.100 3.253
599 HG13 VAL 78 3HG1 VAL 78 0.275 -10.685 4.871
600 HG21 VAL 78 3HG2 VAL 78 1.765 -7.827 6.696
601 HG22 VAL 78 1HG2 VAL 78 2.608 -9.347 6.389
602 HG23 VAL 78 2HG2 VAL 78 0.911 -9.361 6.874
603 H THR 79 H THR 79 3.281 -8.891 1.800
604 HA THR 79 HA THR 79 1.337 -7.439 0.090
605 HB THR 79 HB THR 79 3.072 -7.255 -1.609
606 HG1 THR 79 HG1 THR 79 4.138 -9.330 -0.735
607 HG21 THR 79 3HG2 THR 79 4.120 -6.431 1.111
608 HG22 THR 79 1HG2 THR 79 3.034 -5.493 0.085
609 HG23 THR 79 2HG2 THR 79 4.687 -5.805 -0.437
610 H GLU 80 H GLU 80 0.048 -8.654 -1.179
611 HA GLU 80 HA GLU 80 1.155 -10.987 -2.538
612 HB2 GLU 80 2HB GLU 80 -1.322 -11.167 -0.804
613 HB3 GLU 80 1HB GLU 80 -0.974 -12.320 -2.083
614 HG2 GLU 80 2HG GLU 80 1.211 -12.791 -0.910
615 HG3 GLU 80 1HG GLU 80 0.599 -11.832 0.437
616 H GLU 81 H GLU 81 0.345 -11.288 -4.582
617 HA GLU 81 HA GLU 81 -1.472 -9.252 -5.600
618 HB2 GLU 81 2HB GLU 81 0.022 -11.477 -7.011
619 HB3 GLU 81 1HB GLU 81 -0.992 -10.291 -7.822
620 HG2 GLU 81 2HG GLU 81 0.491 -8.498 -7.020
621 HG3 GLU 81 1HG GLU 81 1.522 -9.709 -6.258
622 H ARG 82 H ARG 82 -3.603 -9.560 -5.558
623 HA ARG 82 HA ARG 82 -4.654 -12.310 -5.849
624 HB2 ARG 82 2HB ARG 82 -5.925 -9.982 -4.376
625 HB3 ARG 82 1HB ARG 82 -6.615 -11.590 -4.545
626 HG2 ARG 82 2HG ARG 82 -4.072 -10.901 -3.075
627 HG3 ARG 82 1HG ARG 82 -5.635 -11.280 -2.344
628 HD2 ARG 82 2HD ARG 82 -3.951 -13.145 -4.032
629 HD3 ARG 82 1HD ARG 82 -4.141 -13.216 -2.281
630 HE ARG 82 HE ARG 82 -6.686 -13.373 -3.384
631 HH11 ARG 82 1HH1 ARG 82 -3.788 -15.240 -3.344
632 HH12 ARG 82 2HH1 ARG 82 -4.622 -16.731 -3.603
633 HH21 ARG 82 1HH2 ARG 82 -7.741 -15.312 -3.701
634 HH22 ARG 82 2HH2 ARG 82 -6.825 -16.776 -3.776
635 H GLN 83 H GLN 83 -6.167 -12.679 -7.421
636 HA GLN 83 HA GLN 83 -6.491 -10.637 -9.430
637 HB2 GLN 83 2HB GLN 83 -6.156 -13.033 -10.003
638 HB3 GLN 83 1HB GLN 83 -7.723 -13.401 -9.293
639 HG2 GLN 83 2HG GLN 83 -8.781 -11.897 -10.964
640 HG3 GLN 83 1HG GLN 83 -7.199 -11.677 -11.711
641 HE21 GLN 83 1HE2 GLN 83 -7.868 -12.583 -13.660
642 HE22 GLN 83 2HE2 GLN 83 -8.178 -14.274 -13.838
643 H VAL 84 H VAL 84 -8.301 -9.489 -9.958
644 HA VAL 84 HA VAL 84 -10.315 -9.292 -7.865
645 HB VAL 84 HB VAL 84 -9.990 -7.606 -10.362
646 HG11 VAL 84 1HG1 VAL 84 -12.224 -7.451 -9.391
647 HG12 VAL 84 2HG1 VAL 84 -11.333 -5.946 -9.151
648 HG13 VAL 84 3HG1 VAL 84 -11.528 -7.079 -7.815
649 HG21 VAL 84 3HG2 VAL 84 -7.975 -7.482 -8.996
650 HG22 VAL 84 1HG2 VAL 84 -8.942 -7.116 -7.567
651 HG23 VAL 84 2HG2 VAL 84 -8.874 -5.967 -8.904
652 HA PRO 85 HA PRO 85 -13.111 -11.999 -10.138
653 HB2 PRO 85 2HB PRO 85 -15.361 -11.374 -8.653
654 HB3 PRO 85 1HB PRO 85 -14.146 -12.565 -8.176
655 HG2 PRO 85 2HG PRO 85 -14.432 -9.702 -7.328
656 HG3 PRO 85 1HG PRO 85 -14.046 -11.128 -6.345
657 HD2 PRO 85 2HD PRO 85 -12.130 -9.420 -7.119
658 HD3 PRO 85 1HD PRO 85 -11.825 -11.171 -7.059
659 H GLY 86 H GLY 86 -14.156 -11.606 -12.006
660 HA2 GLY 86 2HA GLY 86 -15.561 -10.547 -13.538
661 HA3 GLY 86 1HA GLY 86 -15.860 -9.277 -12.361
662 H SER 87 H SER 87 -12.559 -9.950 -12.788
663 HA SER 87 HA SER 87 -12.211 -7.901 -14.877
664 HB2 SER 87 2HB SER 87 -10.735 -7.896 -12.221
665 HB3 SER 87 1HB SER 87 -10.473 -6.769 -13.553
666 HG SER 87 HG SER 87 -12.760 -7.044 -11.902
667 H THR 88 H THR 88 -10.024 -7.899 -15.823
668 HA THR 88 HA THR 88 -9.100 -10.656 -16.119
669 HB THR 88 HB THR 88 -9.509 -9.469 -18.182
670 HG1 THR 88 HG1 THR 88 -6.854 -9.376 -18.566
671 HG21 THR 88 3HG2 THR 88 -7.413 -7.483 -17.279
672 HG22 THR 88 1HG2 THR 88 -9.146 -7.171 -17.393
673 HG23 THR 88 2HG2 THR 88 -8.211 -7.503 -18.851
674 H GLN 89 H GLN 89 -7.936 -7.637 -14.800
675 HA GLN 89 HA GLN 89 -5.178 -8.556 -14.662
676 HB2 GLN 89 2HB GLN 89 -4.674 -6.363 -13.783
677 HB3 GLN 89 1HB GLN 89 -5.730 -6.193 -15.180
678 HG2 GLN 89 2HG GLN 89 -7.654 -5.930 -13.638
679 HG3 GLN 89 1HG GLN 89 -6.531 -5.979 -12.281
680 HE21 GLN 89 1HE2 GLN 89 -7.735 -4.114 -14.928
681 HE22 GLN 89 2HE2 GLN 89 -6.980 -2.625 -14.492
682 H LYS 90 H LYS 90 -3.985 -8.864 -12.727
683 HA LYS 90 HA LYS 90 -5.591 -9.381 -10.320
684 HB2 LYS 90 2HB LYS 90 -3.573 -10.510 -9.430
685 HB3 LYS 90 1HB LYS 90 -4.144 -11.225 -10.930
686 HG2 LYS 90 2HG LYS 90 -2.368 -10.212 -12.173
687 HG3 LYS 90 1HG LYS 90 -1.874 -9.247 -10.782
688 HD2 LYS 90 2HD LYS 90 -0.373 -11.158 -11.103
689 HD3 LYS 90 1HD LYS 90 -1.242 -11.280 -9.574
690 HE2 LYS 90 2HE LYS 90 -2.810 -12.869 -10.595
691 HE3 LYS 90 1HE LYS 90 -1.945 -12.742 -12.126
692 HZ1 LYS 90 3HZ LYS 90 -1.285 -14.714 -10.899
693 HZ2 LYS 90 1HZ LYS 90 -0.814 -13.769 -9.578
694 HZ3 LYS 90 2HZ LYS 90 0.019 -13.646 -11.041
695 H ALA 91 H ALA 91 -5.323 -8.232 -8.445
696 HA ALA 91 HA ALA 91 -3.675 -5.793 -8.669
697 HB1 ALA 91 3HB ALA 91 -6.186 -6.262 -7.053
698 HB2 ALA 91 1HB ALA 91 -6.079 -5.376 -8.575
699 HB3 ALA 91 2HB ALA 91 -5.278 -4.751 -7.134
700 H LEU 92 H LEU 92 -2.307 -5.195 -7.034
701 HA LEU 92 HA LEU 92 -1.452 -7.248 -5.207
702 HB2 LEU 92 2HB LEU 92 0.155 -5.772 -6.324
703 HB3 LEU 92 1HB LEU 92 -0.555 -4.380 -5.530
704 HG LEU 92 HG LEU 92 0.138 -5.408 -3.320
705 HD11 LEU 92 1HD1 LEU 92 1.871 -7.117 -3.351
706 HD12 LEU 92 2HD1 LEU 92 1.757 -7.222 -5.109
707 HD13 LEU 92 3HD1 LEU 92 0.392 -7.714 -4.104
708 HD21 LEU 92 3HD2 LEU 92 1.386 -3.576 -4.371
709 HD22 LEU 92 1HD2 LEU 92 2.348 -4.747 -5.276
710 HD23 LEU 92 2HD2 LEU 92 2.460 -4.682 -3.516
711 H TYR 93 H TYR 93 -2.625 -7.640 -3.414
712 HA TYR 93 HA TYR 93 -3.807 -5.400 -1.939
713 HB2 TYR 93 2HB TYR 93 -4.219 -8.381 -1.752
714 HB3 TYR 93 1HB TYR 93 -4.818 -7.276 -0.517
715 HD1 TYR 93 HD1 TYR 93 -5.078 -8.112 -4.141
716 HD2 TYR 93 HD2 TYR 93 -6.795 -6.050 -0.836
717 HE1 TYR 93 HE1 TYR 93 -7.103 -7.673 -5.469
718 HE2 TYR 93 HE2 TYR 93 -8.819 -5.605 -2.152
719 HH TYR 93 HH TYR 93 -9.457 -5.430 -4.553
720 H LEU 94 H LEU 94 -3.404 -4.974 0.202
721 HA LEU 94 HA LEU 94 -0.869 -6.032 1.295
722 HB2 LEU 94 2HB LEU 94 -1.702 -3.126 1.340
723 HB3 LEU 94 1HB LEU 94 -0.151 -3.794 1.812
724 HG LEU 94 HG LEU 94 -1.216 -3.786 -1.018
725 HD11 LEU 94 1HD1 LEU 94 0.407 -2.004 -1.436
726 HD12 LEU 94 2HD1 LEU 94 0.803 -1.962 0.282
727 HD13 LEU 94 3HD1 LEU 94 -0.813 -1.513 -0.263
728 HD21 LEU 94 3HD2 LEU 94 1.508 -4.455 0.091
729 HD22 LEU 94 1HD2 LEU 94 1.091 -4.354 -1.621
730 HD23 LEU 94 2HD2 LEU 94 0.350 -5.589 -0.604
731 H ARG 95 H ARG 95 -0.732 -6.063 3.595
732 HA ARG 95 HA ARG 95 -2.746 -4.667 5.143
733 HB2 ARG 95 2HB ARG 95 -3.608 -6.547 6.357
734 HB3 ARG 95 1HB ARG 95 -3.808 -6.874 4.644
735 HG2 ARG 95 2HG ARG 95 -1.799 -8.315 4.716
736 HG3 ARG 95 1HG ARG 95 -1.696 -8.037 6.457
737 HD2 ARG 95 2HD ARG 95 -3.849 -9.479 4.919
738 HD3 ARG 95 1HD ARG 95 -2.813 -10.112 6.197
739 HE ARG 95 HE ARG 95 -5.034 -8.211 6.586
740 HH11 ARG 95 1HH1 ARG 95 -2.930 -10.655 7.799
741 HH12 ARG 95 2HH1 ARG 95 -3.767 -10.792 9.302
742 HH21 ARG 95 1HH2 ARG 95 -6.113 -8.397 8.521
743 HH22 ARG 95 2HH2 ARG 95 -5.543 -9.519 9.709
744 H ALA 96 H ALA 96 -2.319 -4.899 7.548
745 HA ALA 96 HA ALA 96 0.344 -4.041 7.966
746 HB1 ALA 96 3HB ALA 96 -0.294 -3.714 10.278
747 HB2 ALA 96 1HB ALA 96 -1.735 -4.709 10.050
748 HB3 ALA 96 2HB ALA 96 -1.588 -3.165 9.213
749 H LYS 97 H LYS 97 2.034 -4.912 9.131
750 HA LYS 97 HA LYS 97 2.185 -7.803 9.287
751 HB2 LYS 97 2HB LYS 97 4.099 -6.545 8.431
752 HB3 LYS 97 1HB LYS 97 4.214 -5.644 9.934
753 HG2 LYS 97 2HG LYS 97 5.922 -7.282 10.001
754 HG3 LYS 97 1HG LYS 97 4.659 -7.838 11.098
755 HD2 LYS 97 2HD LYS 97 5.473 -9.703 9.773
756 HD3 LYS 97 1HD LYS 97 3.808 -9.336 9.319
757 HE2 LYS 97 2HE LYS 97 4.551 -8.176 7.337
758 HE3 LYS 97 1HE LYS 97 6.238 -8.352 7.818
759 HZ1 LYS 97 3HZ LYS 97 5.667 -9.970 6.156
760 HZ2 LYS 97 1HZ LYS 97 4.387 -10.558 7.090
761 HZ3 LYS 97 2HZ LYS 97 5.980 -10.759 7.614
762 H LEU 98 H LEU 98 1.544 -8.896 11.039
763 HA LEU 98 HA LEU 98 1.681 -7.593 13.686
764 HB2 LEU 98 2HB LEU 98 0.057 -9.993 12.811
765 HB3 LEU 98 1HB LEU 98 0.042 -9.281 14.413
766 HG LEU 98 HG LEU 98 -0.901 -7.921 11.881
767 HD11 LEU 98 1HD1 LEU 98 -2.464 -9.041 14.209
768 HD12 LEU 98 2HD1 LEU 98 -2.406 -9.704 12.576
769 HD13 LEU 98 3HD1 LEU 98 -3.136 -8.125 12.860
770 HD21 LEU 98 3HD2 LEU 98 -1.735 -6.164 13.393
771 HD22 LEU 98 1HD2 LEU 98 0.022 -6.308 13.452
772 HD23 LEU 98 2HD2 LEU 98 -0.961 -6.978 14.753
773 H GLU 99 H GLU 99 3.655 -8.050 14.498
774 HA GLU 99 HA GLU 99 5.079 -10.458 13.914
775 HB2 GLU 99 2HB GLU 99 6.818 -9.602 15.344
776 HB3 GLU 99 1HB GLU 99 6.186 -8.271 14.390
777 HG2 GLU 99 2HG GLU 99 5.252 -8.802 17.201
778 HG3 GLU 99 1HG GLU 99 6.685 -7.842 16.852
779 H HIS 100 H HIS 100 5.727 -12.127 15.396
780 HA HIS 100 HA HIS 100 3.841 -12.774 17.477
781 HB2 HIS 100 2HB HIS 100 6.533 -14.054 16.913
782 HB3 HIS 100 1HB HIS 100 5.239 -14.733 17.894
783 HD1 HIS 100 HD1 HIS 100 6.570 -14.739 14.530
784 HD2 HIS 100 HD2 HIS 100 2.836 -15.335 16.257
785 HE1 HIS 100 HE1 HIS 100 5.198 -15.903 12.780
786 HE2 HIS 100 HE2 HIS 100 2.927 -16.205 13.821
787 H HIS 101 H HIS 101 3.942 -10.995 18.878
788 HA HIS 101 HA HIS 101 6.150 -9.586 19.693
789 HB2 HIS 101 2HB HIS 101 4.822 -8.689 21.493
790 HB3 HIS 101 1HB HIS 101 3.781 -8.926 20.095
791 HD1 HIS 101 HD1 HIS 101 4.171 -9.844 23.628
792 HD2 HIS 101 HD2 HIS 101 1.984 -11.185 20.364
793 HE1 HIS 101 HE1 HIS 101 2.377 -11.312 24.583
794 HE2 HIS 101 HE2 HIS 101 1.182 -12.244 22.581
795 H HIS 102 H HIS 102 7.947 -10.190 20.688
796 HA HIS 102 HA HIS 102 8.019 -12.466 22.485
797 HB2 HIS 102 2HB HIS 102 9.866 -12.098 20.900
798 HB3 HIS 102 1HB HIS 102 10.207 -10.539 21.642
799 HD1 HIS 102 HD1 HIS 102 12.059 -10.598 23.278
800 HD2 HIS 102 HD2 HIS 102 10.181 -14.293 22.939
801 HE1 HIS 102 HE1 HIS 102 13.342 -12.146 24.776
802 HE2 HIS 102 HE2 HIS 102 12.303 -14.406 24.411
803 H HIS 103 H HIS 103 7.468 -12.247 24.583
804 HA HIS 103 HA HIS 103 7.219 -9.665 25.806
805 HB2 HIS 103 2HB HIS 103 6.386 -10.826 27.750
806 HB3 HIS 103 1HB HIS 103 5.699 -11.574 26.317
807 HD1 HIS 103 HD1 HIS 103 7.574 -12.319 29.356
808 HD2 HIS 103 HD2 HIS 103 6.916 -14.159 25.691
809 HE1 HIS 103 HE1 HIS 103 8.253 -14.715 29.675
810 HE2 HIS 103 HE2 HIS 103 7.728 -15.835 27.480
811 H HIS 104 H HIS 104 8.645 -8.560 27.032
812 HA HIS 104 HA HIS 104 11.276 -9.721 27.519
813 HB2 HIS 104 2HB HIS 104 11.231 -7.502 26.565
814 HB3 HIS 104 1HB HIS 104 10.192 -6.914 27.858
815 HD1 HIS 104 HD1 HIS 104 13.733 -8.125 27.291
816 HD2 HIS 104 HD2 HIS 104 11.521 -5.959 30.062
817 HE1 HIS 104 HE1 HIS 104 15.404 -7.202 28.911
818 HE2 HIS 104 HE2 HIS 104 14.037 -6.037 30.665
819 H HIS 105 H HIS 105 11.744 -10.708 29.377
820 HA HIS 105 HA HIS 105 10.976 -9.487 31.907
821 HB2 HIS 105 2HB HIS 105 9.127 -11.087 31.372
822 HB3 HIS 105 1HB HIS 105 10.306 -12.395 31.365
823 HD1 HIS 105 HD1 HIS 105 11.484 -12.890 33.717
824 HD2 HIS 105 HD2 HIS 105 8.162 -10.402 33.850
825 HE1 HIS 105 HE1 HIS 105 10.780 -12.838 36.122
826 HE2 HIS 105 HE2 HIS 105 8.873 -11.202 36.200
Start of MODEL 19
1 H1 MET 1 1H MET 1 45.749 -19.417 18.802
2 H2 MET 1 2H MET 1 47.120 -20.372 19.044
3 H3 MET 1 3H MET 1 46.472 -19.488 20.329
4 HA MET 1 HA MET 1 45.133 -21.730 18.923
5 HB2 MET 1 2HB MET 1 47.086 -22.372 20.350
6 HB3 MET 1 1HB MET 1 46.283 -21.626 21.723
7 HG2 MET 1 2HG MET 1 44.428 -23.221 21.487
8 HG3 MET 1 1HG MET 1 45.274 -23.982 20.142
9 HE1 MET 1 3HE MET 1 45.324 -23.173 23.959
10 HE2 MET 1 1HE MET 1 46.916 -22.578 23.488
11 HE3 MET 1 2HE MET 1 46.776 -24.008 24.512
12 H ASP 2 H ASP 2 44.652 -18.819 20.482
13 HA ASP 2 HA ASP 2 42.648 -19.413 22.375
14 HB2 ASP 2 2HB ASP 2 42.973 -16.833 20.825
15 HB3 ASP 2 1HB ASP 2 42.186 -17.038 22.388
16 H GLN 3 H GLN 3 40.490 -19.707 22.225
17 HA GLN 3 HA GLN 3 39.333 -20.196 19.648
18 HB2 GLN 3 2HB GLN 3 37.227 -20.651 21.017
19 HB3 GLN 3 1HB GLN 3 38.618 -21.674 21.323
20 HG2 GLN 3 2HG GLN 3 37.784 -21.237 23.440
21 HG3 GLN 3 1HG GLN 3 39.116 -20.098 23.285
22 HE21 GLN 3 1HE2 GLN 3 38.662 -17.903 23.178
23 HE22 GLN 3 2HE2 GLN 3 37.109 -17.258 23.562
24 H LYS 4 H LYS 4 37.486 -19.210 18.719
25 HA LYS 4 HA LYS 4 36.240 -17.469 17.950
26 HB2 LYS 4 2HB LYS 4 36.344 -16.541 20.828
27 HB3 LYS 4 1HB LYS 4 35.210 -15.975 19.610
28 HG2 LYS 4 2HG LYS 4 35.407 -18.820 20.595
29 HG3 LYS 4 1HG LYS 4 34.241 -17.627 21.169
30 HD2 LYS 4 2HD LYS 4 33.309 -17.446 18.910
31 HD3 LYS 4 1HD LYS 4 34.482 -18.632 18.326
32 HE2 LYS 4 2HE LYS 4 32.276 -19.642 18.746
33 HE3 LYS 4 1HE LYS 4 33.525 -20.333 19.780
34 HZ1 LYS 4 3HZ LYS 4 31.542 -18.271 20.582
35 HZ2 LYS 4 1HZ LYS 4 32.752 -18.899 21.583
36 HZ3 LYS 4 2HZ LYS 4 31.513 -19.900 21.020
37 H SER 5 H SER 5 39.344 -17.071 18.499
38 HA SER 5 HA SER 5 39.632 -14.254 18.907
39 HB2 SER 5 2HB SER 5 42.020 -14.622 18.485
40 HB3 SER 5 1HB SER 5 41.386 -15.838 19.592
41 HG SER 5 HG SER 5 41.997 -17.299 18.225
42 H SER 6 H SER 6 39.002 -12.818 17.447
43 HA SER 6 HA SER 6 40.277 -12.624 14.907
44 HB2 SER 6 2HB SER 6 38.582 -14.300 14.272
45 HB3 SER 6 1HB SER 6 37.305 -13.241 14.870
46 HG SER 6 HG SER 6 37.992 -13.263 12.473
47 H SER 7 H SER 7 39.381 -10.683 13.638
48 HA SER 7 HA SER 7 37.751 -8.815 15.136
49 HB2 SER 7 2HB SER 7 39.923 -8.383 16.178
50 HB3 SER 7 1HB SER 7 40.656 -8.128 14.594
51 HG SER 7 HG SER 7 39.537 -6.320 16.107
52 HA PRO 8 HA PRO 8 37.474 -7.846 10.652
53 HB2 PRO 8 2HB PRO 8 35.220 -9.094 9.988
54 HB3 PRO 8 1HB PRO 8 36.731 -9.997 10.151
55 HG2 PRO 8 2HG PRO 8 34.391 -9.872 11.992
56 HG3 PRO 8 1HG PRO 8 35.501 -11.216 11.674
57 HD2 PRO 8 2HD PRO 8 35.602 -9.366 13.844
58 HD3 PRO 8 1HD PRO 8 36.800 -10.612 13.439
59 H GLN 9 H GLN 9 36.229 -6.158 9.770
60 HA GLN 9 HA GLN 9 33.695 -5.425 10.987
61 HB2 GLN 9 2HB GLN 9 35.237 -4.218 12.426
62 HB3 GLN 9 1HB GLN 9 36.043 -3.515 11.029
63 HG2 GLN 9 2HG GLN 9 34.011 -2.295 10.450
64 HG3 GLN 9 1HG GLN 9 33.170 -3.025 11.816
65 HE21 GLN 9 1HE2 GLN 9 33.694 -0.224 11.180
66 HE22 GLN 9 2HE2 GLN 9 34.519 0.422 12.551
67 HA PRO 10 HA PRO 10 33.408 -4.344 6.552
68 HB2 PRO 10 2HB PRO 10 30.827 -5.057 6.253
69 HB3 PRO 10 1HB PRO 10 32.124 -6.257 6.261
70 HG2 PRO 10 2HG PRO 10 30.251 -5.477 8.468
71 HG3 PRO 10 1HG PRO 10 30.788 -7.095 7.978
72 HD2 PRO 10 2HD PRO 10 31.853 -5.703 10.093
73 HD3 PRO 10 1HD PRO 10 32.738 -6.941 9.180
74 H ALA 11 H ALA 11 32.594 -2.431 5.658
75 HA ALA 11 HA ALA 11 30.654 -0.880 7.235
76 HB1 ALA 11 3HB ALA 11 32.864 -0.180 8.015
77 HB2 ALA 11 1HB ALA 11 32.027 1.126 7.175
78 HB3 ALA 11 2HB ALA 11 33.317 0.239 6.363
79 H ALA 12 H ALA 12 29.050 -0.789 5.756
80 HA ALA 12 HA ALA 12 29.589 -0.053 2.987
81 HB1 ALA 12 3HB ALA 12 27.181 -0.354 2.657
82 HB2 ALA 12 1HB ALA 12 26.966 -0.584 4.391
83 HB3 ALA 12 2HB ALA 12 27.896 -1.755 3.456
84 H GLN 13 H GLN 13 29.699 2.025 2.344
85 HA GLN 13 HA GLN 13 29.159 4.170 4.158
86 HB2 GLN 13 2HB GLN 13 29.800 4.276 1.198
87 HB3 GLN 13 1HB GLN 13 29.860 5.635 2.310
88 HG2 GLN 13 2HG GLN 13 31.602 3.176 2.417
89 HG3 GLN 13 1HG GLN 13 32.087 4.771 1.846
90 HE21 GLN 13 1HE2 GLN 13 33.186 3.153 4.007
91 HE22 GLN 13 2HE2 GLN 13 33.076 4.122 5.434
92 H ALA 14 H ALA 14 27.258 5.089 4.552
93 HA ALA 14 HA ALA 14 24.995 4.657 2.767
94 HB1 ALA 14 3HB ALA 14 25.111 5.963 5.490
95 HB2 ALA 14 1HB ALA 14 24.726 4.272 5.171
96 HB3 ALA 14 2HB ALA 14 23.647 5.544 4.601
97 HA PRO 15 HA PRO 15 24.880 8.725 0.924
98 HB2 PRO 15 2HB PRO 15 22.187 9.256 0.945
99 HB3 PRO 15 1HB PRO 15 22.963 8.168 -0.209
100 HG2 PRO 15 2HG PRO 15 21.515 7.506 2.334
101 HG3 PRO 15 1HG PRO 15 21.393 6.725 0.745
102 HD2 PRO 15 2HD PRO 15 22.860 5.639 2.712
103 HD3 PRO 15 1HD PRO 15 23.400 5.569 1.021
104 H GLU 16 H GLU 16 24.084 10.998 1.318
105 HA GLU 16 HA GLU 16 24.771 11.725 4.000
106 HB2 GLU 16 2HB GLU 16 23.810 13.447 1.699
107 HB3 GLU 16 1HB GLU 16 24.452 14.061 3.214
108 HG2 GLU 16 2HG GLU 16 26.191 14.204 1.619
109 HG3 GLU 16 1HG GLU 16 26.594 12.868 2.694
110 H THR 17 H THR 17 21.790 11.125 2.410
111 HA THR 17 HA THR 17 20.309 12.321 4.676
112 HB THR 17 HB THR 17 19.395 12.042 1.801
113 HG1 THR 17 HG1 THR 17 19.562 14.435 3.309
114 HG21 THR 17 3HG2 THR 17 17.891 13.054 4.225
115 HG22 THR 17 1HG2 THR 17 17.508 11.618 3.275
116 HG23 THR 17 2HG2 THR 17 17.345 13.221 2.556
117 H LYS 18 H LYS 18 19.351 10.880 5.957
118 HA LYS 18 HA LYS 18 18.398 8.332 4.787
119 HB2 LYS 18 2HB LYS 18 20.287 8.101 6.417
120 HB3 LYS 18 1HB LYS 18 19.259 8.806 7.655
121 HG2 LYS 18 2HG LYS 18 17.672 6.924 7.341
122 HG3 LYS 18 1HG LYS 18 18.803 6.206 6.197
123 HD2 LYS 18 2HD LYS 18 19.359 6.776 9.117
124 HD3 LYS 18 1HD LYS 18 18.996 5.196 8.430
125 HE2 LYS 18 2HE LYS 18 21.320 5.185 8.636
126 HE3 LYS 18 1HE LYS 18 21.066 5.594 6.941
127 HZ1 LYS 18 3HZ LYS 18 21.515 7.882 7.414
128 HZ2 LYS 18 1HZ LYS 18 22.770 6.962 8.075
129 HZ3 LYS 18 2HZ LYS 18 21.568 7.597 9.080
130 H GLN 19 H GLN 19 16.240 8.403 4.573
131 HA GLN 19 HA GLN 19 14.596 9.971 6.414
132 HB2 GLN 19 2HB GLN 19 13.854 8.421 3.918
133 HB3 GLN 19 1HB GLN 19 12.743 9.406 4.858
134 HG2 GLN 19 2HG GLN 19 15.191 10.433 3.433
135 HG3 GLN 19 1HG GLN 19 13.541 10.527 2.821
136 HE21 GLN 19 1HE2 GLN 19 15.377 12.684 3.379
137 HE22 GLN 19 2HE2 GLN 19 14.616 13.685 4.564
138 H ALA 20 H ALA 20 12.792 9.061 7.552
139 HA ALA 20 HA ALA 20 13.074 6.174 8.130
140 HB1 ALA 20 3HB ALA 20 12.145 6.645 10.342
141 HB2 ALA 20 1HB ALA 20 11.983 8.349 9.922
142 HB3 ALA 20 2HB ALA 20 13.585 7.620 10.041
143 H PHE 21 H PHE 21 11.312 4.839 8.003
144 HA PHE 21 HA PHE 21 8.992 5.756 6.568
145 HB2 PHE 21 2HB PHE 21 9.666 3.072 7.797
146 HB3 PHE 21 1HB PHE 21 8.231 3.379 6.827
147 HD1 PHE 21 HD1 PHE 21 8.664 4.351 4.439
148 HD2 PHE 21 HD2 PHE 21 11.590 2.287 6.754
149 HE1 PHE 21 HE1 PHE 21 9.917 3.824 2.389
150 HE2 PHE 21 HE2 PHE 21 12.842 1.764 4.704
151 HZ PHE 21 HZ PHE 21 12.006 2.532 2.521
152 HA PRO 22 HA PRO 22 6.767 6.484 10.464
153 HB2 PRO 22 2HB PRO 22 4.815 8.050 9.474
154 HB3 PRO 22 1HB PRO 22 6.457 8.662 9.719
155 HG2 PRO 22 2HG PRO 22 5.126 7.764 7.190
156 HG3 PRO 22 1HG PRO 22 6.211 9.140 7.454
157 HD2 PRO 22 2HD PRO 22 6.986 6.707 6.390
158 HD3 PRO 22 1HD PRO 22 8.085 7.853 7.182
159 H ARG 23 H ARG 23 5.992 4.387 10.813
160 HA ARG 23 HA ARG 23 3.970 3.289 9.056
161 HB2 ARG 23 2HB ARG 23 4.084 1.286 10.512
162 HB3 ARG 23 1HB ARG 23 5.636 1.758 9.839
163 HG2 ARG 23 2HG ARG 23 6.241 2.794 11.987
164 HG3 ARG 23 1HG ARG 23 4.692 2.276 12.659
165 HD2 ARG 23 2HD ARG 23 5.303 -0.070 12.240
166 HD3 ARG 23 1HD ARG 23 6.851 0.456 11.578
167 HE ARG 23 HE ARG 23 6.531 1.481 14.182
168 HH11 ARG 23 1HH1 ARG 23 7.155 -1.497 12.558
169 HH12 ARG 23 2HH1 ARG 23 8.010 -2.161 13.899
170 HH21 ARG 23 1HH2 ARG 23 7.622 0.603 15.887
171 HH22 ARG 23 2HH2 ARG 23 8.294 -0.986 15.751
172 H LYS 24 H LYS 24 4.019 4.987 12.066
173 HA LYS 24 HA LYS 24 1.597 4.215 13.215
174 HB2 LYS 24 2HB LYS 24 2.867 6.965 13.153
175 HB3 LYS 24 1HB LYS 24 1.546 6.501 14.217
176 HG2 LYS 24 2HG LYS 24 3.012 4.782 15.230
177 HG3 LYS 24 1HG LYS 24 4.337 5.351 14.214
178 HD2 LYS 24 2HD LYS 24 2.843 7.015 16.251
179 HD3 LYS 24 1HD LYS 24 4.436 6.300 16.490
180 HE2 LYS 24 2HE LYS 24 5.349 7.667 14.697
181 HE3 LYS 24 1HE LYS 24 3.750 8.330 14.358
182 HZ1 LYS 24 3HZ LYS 24 5.168 8.647 16.948
183 HZ2 LYS 24 1HZ LYS 24 3.722 9.393 16.484
184 HZ3 LYS 24 2HZ LYS 24 5.171 9.805 15.714
185 H PHE 25 H PHE 25 2.195 6.466 10.555
186 HA PHE 25 HA PHE 25 -0.637 7.111 10.305
187 HB2 PHE 25 2HB PHE 25 1.753 7.967 8.649
188 HB3 PHE 25 1HB PHE 25 0.109 8.550 8.416
189 HD1 PHE 25 HD1 PHE 25 -0.929 10.045 10.051
190 HD2 PHE 25 HD2 PHE 25 3.112 8.760 10.479
191 HE1 PHE 25 HE1 PHE 25 -0.533 11.839 11.687
192 HE2 PHE 25 HE2 PHE 25 3.508 10.550 12.119
193 HZ PHE 25 HZ PHE 25 1.687 12.091 12.726
194 H VAL 26 H VAL 26 1.878 5.505 8.345
195 HA VAL 26 HA VAL 26 0.301 4.965 6.102
196 HB VAL 26 HB VAL 26 2.697 3.419 7.116
197 HG11 VAL 26 1HG1 VAL 26 1.397 3.437 4.386
198 HG12 VAL 26 2HG1 VAL 26 1.459 2.082 5.513
199 HG13 VAL 26 3HG1 VAL 26 2.943 2.677 4.770
200 HG21 VAL 26 3HG2 VAL 26 3.187 5.780 6.742
201 HG22 VAL 26 1HG2 VAL 26 2.490 5.685 5.124
202 HG23 VAL 26 2HG2 VAL 26 3.961 4.789 5.505
203 H LEU 27 H LEU 27 1.012 2.789 8.876
204 HA LEU 27 HA LEU 27 -0.547 0.627 7.944
205 HB2 LEU 27 2HB LEU 27 0.179 1.402 10.777
206 HB3 LEU 27 1HB LEU 27 -0.554 -0.128 10.328
207 HG LEU 27 HG LEU 27 2.170 0.851 9.440
208 HD11 LEU 27 1HD1 LEU 27 3.047 -0.934 10.862
209 HD12 LEU 27 2HD1 LEU 27 1.413 -1.326 11.396
210 HD13 LEU 27 3HD1 LEU 27 2.123 0.238 11.803
211 HD21 LEU 27 3HD2 LEU 27 1.118 -0.530 7.729
212 HD22 LEU 27 1HD2 LEU 27 0.779 -1.783 8.923
213 HD23 LEU 27 2HD2 LEU 27 2.446 -1.396 8.498
214 H ALA 28 H ALA 28 -1.382 3.419 9.945
215 HA ALA 28 HA ALA 28 -4.022 2.695 10.597
216 HB1 ALA 28 3HB ALA 28 -2.835 4.518 11.709
217 HB2 ALA 28 1HB ALA 28 -4.375 5.073 11.053
218 HB3 ALA 28 2HB ALA 28 -2.869 5.461 10.220
219 H ALA 29 H ALA 29 -2.731 4.533 7.833
220 HA ALA 29 HA ALA 29 -5.241 4.959 6.558
221 HB1 ALA 29 3HB ALA 29 -2.463 4.900 5.364
222 HB2 ALA 29 1HB ALA 29 -3.274 6.314 6.035
223 HB3 ALA 29 2HB ALA 29 -3.907 5.543 4.580
224 H LEU 30 H LEU 30 -2.895 2.369 6.481
225 HA LEU 30 HA LEU 30 -3.789 0.977 4.210
226 HB2 LEU 30 2HB LEU 30 -1.620 0.633 5.323
227 HB3 LEU 30 1HB LEU 30 -2.440 -0.065 6.704
228 HG LEU 30 HG LEU 30 -3.171 -1.966 5.350
229 HD11 LEU 30 1HD1 LEU 30 -3.394 -0.830 3.193
230 HD12 LEU 30 2HD1 LEU 30 -2.380 -2.266 3.062
231 HD13 LEU 30 3HD1 LEU 30 -1.641 -0.665 3.092
232 HD21 LEU 30 3HD2 LEU 30 -0.212 -1.396 5.113
233 HD22 LEU 30 1HD2 LEU 30 -0.969 -2.982 4.967
234 HD23 LEU 30 2HD2 LEU 30 -1.031 -2.115 6.500
235 H GLU 31 H GLU 31 -4.478 0.273 7.671
236 HA GLU 31 HA GLU 31 -6.339 -1.773 7.190
237 HB2 GLU 31 2HB GLU 31 -7.131 -1.344 9.524
238 HB3 GLU 31 1HB GLU 31 -5.390 -1.538 9.384
239 HG2 GLU 31 2HG GLU 31 -5.024 0.807 9.626
240 HG3 GLU 31 1HG GLU 31 -6.748 1.149 9.494
241 H GLN 32 H GLN 32 -6.821 1.725 7.437
242 HA GLN 32 HA GLN 32 -9.673 1.608 7.407
243 HB2 GLN 32 2HB GLN 32 -7.777 3.885 6.801
244 HB3 GLN 32 1HB GLN 32 -9.523 4.061 6.924
245 HG2 GLN 32 2HG GLN 32 -9.414 3.267 9.257
246 HG3 GLN 32 1HG GLN 32 -7.659 3.169 9.123
247 HE21 GLN 32 1HE2 GLN 32 -6.464 5.084 9.003
248 HE22 GLN 32 2HE2 GLN 32 -7.129 6.611 9.464
249 H SER 33 H SER 33 -7.323 1.298 4.928
250 HA SER 33 HA SER 33 -9.303 1.845 2.812
251 HB2 SER 33 2HB SER 33 -6.333 1.259 2.606
252 HB3 SER 33 1HB SER 33 -7.391 1.635 1.249
253 HG SER 33 HG SER 33 -6.421 3.299 3.274
254 H SER 34 H SER 34 -8.805 -0.638 4.718
255 HA SER 34 HA SER 34 -8.339 -2.752 2.772
256 HB2 SER 34 2HB SER 34 -8.754 -2.844 5.769
257 HB3 SER 34 1HB SER 34 -8.427 -4.258 4.767
258 HG SER 34 HG SER 34 -6.697 -2.030 4.693
259 H ASP 35 H ASP 35 -9.700 -4.701 2.770
260 HA ASP 35 HA ASP 35 -12.558 -4.101 2.831
261 HB2 ASP 35 2HB ASP 35 -11.053 -6.562 1.887
262 HB3 ASP 35 1HB ASP 35 -12.791 -6.324 1.742
263 H ASP 36 H ASP 36 -13.773 -6.393 3.438
264 HA ASP 36 HA ASP 36 -14.026 -6.571 6.138
265 HB2 ASP 36 2HB ASP 36 -15.610 -7.561 4.608
266 HB3 ASP 36 1HB ASP 36 -14.422 -8.743 4.072
267 H ALA 37 H ALA 37 -11.730 -8.465 4.196
268 HA ALA 37 HA ALA 37 -10.921 -10.055 6.491
269 HB1 ALA 37 3HB ALA 37 -11.175 -11.098 4.291
270 HB2 ALA 37 1HB ALA 37 -9.533 -11.274 4.912
271 HB3 ALA 37 2HB ALA 37 -9.880 -10.081 3.660
272 H GLY 38 H GLY 38 -10.127 -6.994 5.661
273 HA2 GLY 38 2HA GLY 38 -8.422 -5.659 6.504
274 HA3 GLY 38 1HA GLY 38 -7.614 -7.098 7.096
275 H TRP 39 H TRP 39 -8.540 -6.896 3.744
276 HA TRP 39 HA TRP 39 -5.728 -6.453 2.963
277 HB2 TRP 39 2HB TRP 39 -8.012 -7.787 1.492
278 HB3 TRP 39 1HB TRP 39 -6.485 -7.374 0.721
279 HD1 TRP 39 HD1 TRP 39 -8.061 -9.938 3.026
280 HE1 TRP 39 HE1 TRP 39 -6.370 -11.835 3.448
281 HE3 TRP 39 HE3 TRP 39 -3.912 -7.799 0.948
282 HZ2 TRP 39 HZ2 TRP 39 -3.638 -12.351 2.966
283 HZ3 TRP 39 HZ3 TRP 39 -1.797 -9.057 0.971
284 HH2 TRP 39 HH2 TRP 39 -1.663 -11.285 1.959
285 H ALA 40 H ALA 40 -5.198 -4.568 2.048
286 HA ALA 40 HA ALA 40 -7.358 -2.809 1.072
287 HB1 ALA 40 3HB ALA 40 -5.831 -0.947 1.494
288 HB2 ALA 40 1HB ALA 40 -4.576 -2.079 2.001
289 HB3 ALA 40 2HB ALA 40 -6.056 -1.920 2.947
290 H ASN 41 H ASN 41 -7.519 -2.509 -1.056
291 HA ASN 41 HA ASN 41 -5.688 -3.504 -2.959
292 HB2 ASN 41 2HB ASN 41 -8.121 -3.096 -3.372
293 HB3 ASN 41 1HB ASN 41 -7.807 -1.365 -3.342
294 HD21 ASN 41 1HD2 ASN 41 -8.878 -3.053 -5.476
295 HD22 ASN 41 2HD2 ASN 41 -7.832 -2.819 -6.835
296 H LEU 42 H LEU 42 -3.969 -2.598 -3.981
297 HA LEU 42 HA LEU 42 -2.431 -0.585 -2.951
298 HB2 LEU 42 2HB LEU 42 -1.654 -2.174 -4.635
299 HB3 LEU 42 1HB LEU 42 -2.662 -1.412 -5.849
300 HG LEU 42 HG LEU 42 -1.307 0.671 -5.609
301 HD11 LEU 42 1HD1 LEU 42 0.878 0.525 -4.493
302 HD12 LEU 42 2HD1 LEU 42 0.436 -1.059 -3.855
303 HD13 LEU 42 3HD1 LEU 42 -0.465 0.375 -3.361
304 HD21 LEU 42 3HD2 LEU 42 0.652 -0.172 -6.822
305 HD22 LEU 42 1HD2 LEU 42 -0.846 -0.896 -7.409
306 HD23 LEU 42 2HD2 LEU 42 0.226 -1.819 -6.356
307 H GLY 43 H GLY 43 -4.981 -0.237 -5.391
308 HA2 GLY 43 2HA GLY 43 -4.610 2.494 -5.996
309 HA3 GLY 43 1HA GLY 43 -6.111 1.601 -6.182
310 H ASN 44 H ASN 44 -6.662 0.943 -3.535
311 HA ASN 44 HA ASN 44 -7.779 3.387 -2.572
312 HB2 ASN 44 2HB ASN 44 -7.599 0.655 -1.277
313 HB3 ASN 44 1HB ASN 44 -8.568 1.994 -0.668
314 HD21 ASN 44 1HD2 ASN 44 -9.359 -0.671 -1.606
315 HD22 ASN 44 2HD2 ASN 44 -10.517 -0.390 -2.853
316 H PHE 45 H PHE 45 -5.138 1.300 -1.478
317 HA PHE 45 HA PHE 45 -4.452 2.484 0.911
318 HB2 PHE 45 2HB PHE 45 -3.431 0.424 0.203
319 HB3 PHE 45 1HB PHE 45 -2.694 1.202 -1.190
320 HD1 PHE 45 HD1 PHE 45 -2.786 1.829 2.505
321 HD2 PHE 45 HD2 PHE 45 -0.412 1.427 -1.013
322 HE1 PHE 45 HE1 PHE 45 -0.754 2.229 3.833
323 HE2 PHE 45 HE2 PHE 45 1.621 1.827 0.314
324 HZ PHE 45 HZ PHE 45 1.452 2.230 2.736
325 H GLY 46 H GLY 46 -2.905 3.239 -2.245
326 HA2 GLY 46 2HA GLY 46 -1.375 5.410 -1.340
327 HA3 GLY 46 1HA GLY 46 -1.866 5.144 -3.005
328 H ASN 47 H ASN 47 -4.707 5.306 -2.454
329 HA ASN 47 HA ASN 47 -5.095 8.069 -2.873
330 HB2 ASN 47 2HB ASN 47 -6.573 6.198 -3.692
331 HB3 ASN 47 1HB ASN 47 -7.181 6.028 -2.051
332 HD21 ASN 47 1HD2 ASN 47 -8.592 6.686 -4.490
333 HD22 ASN 47 2HD2 ASN 47 -9.352 8.212 -4.217
334 H TYR 48 H TYR 48 -5.958 6.016 -0.069
335 HA TYR 48 HA TYR 48 -6.821 8.254 1.507
336 HB2 TYR 48 2HB TYR 48 -7.709 5.881 1.664
337 HB3 TYR 48 1HB TYR 48 -6.216 5.459 2.497
338 HD1 TYR 48 HD2 TYR 48 -9.154 7.727 2.676
339 HD2 TYR 48 HD1 TYR 48 -6.041 5.779 4.829
340 HE1 TYR 48 HE2 TYR 48 -10.165 8.457 4.793
341 HE2 TYR 48 HE1 TYR 48 -7.046 6.503 6.952
342 HH TYR 48 HH TYR 48 -8.542 8.228 7.785
343 H LEU 49 H LEU 49 -3.854 6.374 1.261
344 HA LEU 49 HA LEU 49 -2.582 7.182 3.614
345 HB2 LEU 49 2HB LEU 49 -1.702 5.395 2.231
346 HB3 LEU 49 1HB LEU 49 -1.404 6.514 0.916
347 HG LEU 49 HG LEU 49 0.319 7.652 2.259
348 HD11 LEU 49 1HD1 LEU 49 -0.576 7.235 4.482
349 HD12 LEU 49 2HD1 LEU 49 1.096 6.692 4.361
350 HD13 LEU 49 3HD1 LEU 49 -0.218 5.515 4.318
351 HD21 LEU 49 3HD2 LEU 49 0.724 4.665 2.056
352 HD22 LEU 49 1HD2 LEU 49 1.999 5.875 2.211
353 HD23 LEU 49 2HD2 LEU 49 0.985 5.842 0.768
354 H ASN 50 H ASN 50 -2.485 8.694 0.383
355 HA ASN 50 HA ASN 50 -0.679 10.745 1.039
356 HB2 ASN 50 2HB ASN 50 -1.319 10.024 -1.274
357 HB3 ASN 50 1HB ASN 50 -2.853 10.863 -1.066
358 HD21 ASN 50 1HD2 ASN 50 0.603 11.250 -1.307
359 HD22 ASN 50 2HD2 ASN 50 0.585 12.919 -1.739
360 H LYS 51 H LYS 51 -4.105 10.462 1.657
361 HA LYS 51 HA LYS 51 -4.719 13.166 2.181
362 HB2 LYS 51 2HB LYS 51 -5.847 10.657 3.451
363 HB3 LYS 51 1HB LYS 51 -6.543 12.262 3.627
364 HG2 LYS 51 2HG LYS 51 -7.006 12.349 1.238
365 HG3 LYS 51 1HG LYS 51 -6.248 10.768 1.018
366 HD2 LYS 51 2HD LYS 51 -8.691 10.577 1.099
367 HD3 LYS 51 1HD LYS 51 -7.942 9.742 2.460
368 HE2 LYS 51 2HE LYS 51 -9.885 10.970 3.225
369 HE3 LYS 51 1HE LYS 51 -8.429 11.699 3.894
370 HZ1 LYS 51 3HZ LYS 51 -9.999 12.701 1.582
371 HZ2 LYS 51 1HZ LYS 51 -8.548 13.380 2.124
372 HZ3 LYS 51 2HZ LYS 51 -9.914 13.397 3.119
373 H LEU 52 H LEU 52 -3.383 10.618 4.252
374 HA LEU 52 HA LEU 52 -3.279 12.371 6.570
375 HB2 LEU 52 2HB LEU 52 -2.159 9.582 6.230
376 HB3 LEU 52 1HB LEU 52 -2.374 10.441 7.745
377 HG LEU 52 HG LEU 52 -4.570 9.422 5.926
378 HD11 LEU 52 1HD1 LEU 52 -5.116 7.952 7.793
379 HD12 LEU 52 2HD1 LEU 52 -3.758 8.598 8.716
380 HD13 LEU 52 3HD1 LEU 52 -3.464 7.680 7.238
381 HD21 LEU 52 3HD2 LEU 52 -6.118 10.202 7.696
382 HD22 LEU 52 1HD2 LEU 52 -5.274 11.523 6.890
383 HD23 LEU 52 2HD2 LEU 52 -4.761 11.001 8.495
384 H GLN 53 H GLN 53 -1.035 10.967 4.237
385 HA GLN 53 HA GLN 53 1.093 12.740 5.252
386 HB2 GLN 53 2HB GLN 53 1.353 9.829 4.463
387 HB3 GLN 53 1HB GLN 53 2.731 10.905 4.630
388 HG2 GLN 53 2HG GLN 53 0.781 10.297 6.847
389 HG3 GLN 53 1HG GLN 53 2.309 9.452 6.602
390 HE21 GLN 53 1HE2 GLN 53 0.812 12.413 7.607
391 HE22 GLN 53 2HE2 GLN 53 2.226 13.123 8.297
392 HA PRO 54 HA PRO 54 0.688 13.429 0.653
393 HB2 PRO 54 2HB PRO 54 0.798 16.145 0.788
394 HB3 PRO 54 1HB PRO 54 -0.714 15.243 0.949
395 HG2 PRO 54 2HG PRO 54 1.044 16.382 3.100
396 HG3 PRO 54 1HG PRO 54 -0.723 16.452 2.948
397 HD2 PRO 54 2HD PRO 54 0.512 14.672 4.570
398 HD3 PRO 54 1HD PRO 54 -1.003 14.288 3.727
399 H ASP 55 H ASP 55 2.838 14.097 3.184
400 HA ASP 55 HA ASP 55 4.991 15.166 1.536
401 HB2 ASP 55 2HB ASP 55 4.516 16.041 3.817
402 HB3 ASP 55 1HB ASP 55 4.918 14.463 4.483
403 H PHE 56 H PHE 56 3.797 12.126 2.293
404 HA PHE 56 HA PHE 56 6.416 10.811 2.398
405 HB2 PHE 56 2HB PHE 56 4.709 10.100 4.025
406 HB3 PHE 56 1HB PHE 56 3.626 9.666 2.709
407 HD1 PHE 56 HD1 PHE 56 6.996 8.878 4.094
408 HD2 PHE 56 HD2 PHE 56 3.621 7.484 1.893
409 HE1 PHE 56 HE1 PHE 56 7.947 6.611 4.074
410 HE2 PHE 56 HE2 PHE 56 4.572 5.215 1.872
411 HZ PHE 56 HZ PHE 56 6.736 4.777 2.963
412 H ASP 57 H ASP 57 7.276 10.691 0.396
413 HA ASP 57 HA ASP 57 5.642 9.474 -1.735
414 HB2 ASP 57 2HB ASP 57 6.025 11.921 -2.077
415 HB3 ASP 57 1HB ASP 57 7.758 11.600 -2.137
416 H SER 58 H SER 58 6.632 7.985 -3.067
417 HA SER 58 HA SER 58 8.565 6.337 -1.878
418 HB2 SER 58 2HB SER 58 8.529 5.067 -3.991
419 HB3 SER 58 1HB SER 58 6.900 5.488 -3.463
420 HG SER 58 HG SER 58 8.348 6.358 -5.676
421 H ARG 59 H ARG 59 8.948 8.915 -4.253
422 HA ARG 59 HA ARG 59 11.467 8.191 -5.275
423 HB2 ARG 59 2HB ARG 59 10.388 10.996 -4.919
424 HB3 ARG 59 1HB ARG 59 11.673 10.507 -6.015
425 HG2 ARG 59 2HG ARG 59 8.791 9.637 -6.176
426 HG3 ARG 59 1HG ARG 59 9.562 10.859 -7.185
427 HD2 ARG 59 2HD ARG 59 11.077 9.155 -8.088
428 HD3 ARG 59 1HD ARG 59 10.311 7.934 -7.072
429 HE ARG 59 HE ARG 59 8.379 8.054 -8.412
430 HH11 ARG 59 1HH1 ARG 59 10.914 10.086 -9.559
431 HH12 ARG 59 2HH1 ARG 59 10.200 10.273 -11.120
432 HH21 ARG 59 1HH2 ARG 59 7.467 8.316 -10.407
433 HH22 ARG 59 2HH2 ARG 59 8.265 9.284 -11.595
434 H LEU 60 H LEU 60 10.584 9.797 -2.299
435 HA LEU 60 HA LEU 60 13.028 10.990 -1.615
436 HB2 LEU 60 2HB LEU 60 10.981 9.757 0.242
437 HB3 LEU 60 1HB LEU 60 12.226 10.902 0.708
438 HG LEU 60 HG LEU 60 9.917 11.482 -1.164
439 HD11 LEU 60 1HD1 LEU 60 10.410 12.342 1.691
440 HD12 LEU 60 2HD1 LEU 60 9.166 11.222 1.130
441 HD13 LEU 60 3HD1 LEU 60 9.101 12.919 0.656
442 HD21 LEU 60 3HD2 LEU 60 11.877 12.791 -1.764
443 HD22 LEU 60 1HD2 LEU 60 12.078 13.303 -0.087
444 HD23 LEU 60 2HD2 LEU 60 10.665 13.820 -1.006
445 H TYR 61 H TYR 61 12.039 7.650 -1.484
446 HA TYR 61 HA TYR 61 14.458 6.910 0.032
447 HB2 TYR 61 2HB TYR 61 11.981 5.274 -0.582
448 HB3 TYR 61 1HB TYR 61 13.346 4.735 0.390
449 HD1 TYR 61 HD1 TYR 61 10.445 7.006 0.277
450 HD2 TYR 61 HD2 TYR 61 13.619 5.477 2.669
451 HE1 TYR 61 HE1 TYR 61 9.384 7.955 2.279
452 HE2 TYR 61 HE2 TYR 61 12.563 6.420 4.679
453 HH TYR 61 HH TYR 61 9.375 7.637 4.688
454 H GLY 62 H GLY 62 13.824 7.401 -3.062
455 HA2 GLY 62 2HA GLY 62 15.060 6.765 -4.927
456 HA3 GLY 62 1HA GLY 62 15.811 5.500 -3.970
457 H TYR 63 H TYR 63 12.324 5.757 -4.192
458 HA TYR 63 HA TYR 63 12.286 3.334 -5.886
459 HB2 TYR 63 2HB TYR 63 10.339 4.292 -3.778
460 HB3 TYR 63 1HB TYR 63 9.998 2.957 -4.873
461 HD1 TYR 63 HD1 TYR 63 12.120 4.066 -2.057
462 HD2 TYR 63 HD2 TYR 63 10.993 0.798 -4.538
463 HE1 TYR 63 HE1 TYR 63 13.227 2.511 -0.504
464 HE2 TYR 63 HE2 TYR 63 12.089 -0.761 -2.999
465 HH TYR 63 HH TYR 63 13.859 -0.739 -1.270
466 H LYS 64 H LYS 64 11.295 3.400 -7.812
467 HA LYS 64 HA LYS 64 10.596 5.799 -9.046
468 HB2 LYS 64 2HB LYS 64 9.767 2.998 -9.823
469 HB3 LYS 64 1HB LYS 64 9.674 4.410 -10.867
470 HG2 LYS 64 2HG LYS 64 12.124 4.645 -10.739
471 HG3 LYS 64 1HG LYS 64 12.195 3.192 -9.736
472 HD2 LYS 64 2HD LYS 64 11.150 1.907 -11.582
473 HD3 LYS 64 1HD LYS 64 11.177 3.361 -12.581
474 HE2 LYS 64 2HE LYS 64 13.636 3.420 -12.387
475 HE3 LYS 64 1HE LYS 64 13.582 1.931 -11.443
476 HZ1 LYS 64 3HZ LYS 64 14.078 1.404 -13.701
477 HZ2 LYS 64 1HZ LYS 64 12.743 2.273 -14.265
478 HZ3 LYS 64 2HZ LYS 64 12.514 0.858 -13.371
479 H LYS 65 H LYS 65 8.524 3.481 -7.375
480 HA LYS 65 HA LYS 65 6.366 5.402 -7.287
481 HB2 LYS 65 2HB LYS 65 4.696 3.791 -8.262
482 HB3 LYS 65 1HB LYS 65 5.840 4.464 -9.417
483 HG2 LYS 65 2HG LYS 65 7.187 2.347 -9.165
484 HG3 LYS 65 1HG LYS 65 5.843 1.690 -8.228
485 HD2 LYS 65 2HD LYS 65 5.710 0.974 -10.563
486 HD3 LYS 65 1HD LYS 65 4.345 2.015 -10.153
487 HE2 LYS 65 2HE LYS 65 5.453 3.911 -11.224
488 HE3 LYS 65 1HE LYS 65 6.855 2.906 -11.588
489 HZ1 LYS 65 3HZ LYS 65 5.416 3.149 -13.506
490 HZ2 LYS 65 1HZ LYS 65 4.111 2.503 -12.652
491 HZ3 LYS 65 2HZ LYS 65 5.450 1.536 -13.008
492 H LEU 66 H LEU 66 4.516 4.630 -5.957
493 HA LEU 66 HA LEU 66 5.399 3.781 -3.464
494 HB2 LEU 66 2HB LEU 66 3.357 5.081 -3.821
495 HB3 LEU 66 1HB LEU 66 2.591 3.697 -4.576
496 HG LEU 66 HG LEU 66 2.717 2.472 -2.422
497 HD11 LEU 66 1HD1 LEU 66 4.668 3.595 -1.471
498 HD12 LEU 66 2HD1 LEU 66 3.293 3.659 -0.370
499 HD13 LEU 66 3HD1 LEU 66 3.738 5.086 -1.306
500 HD21 LEU 66 3HD2 LEU 66 0.963 3.733 -1.280
501 HD22 LEU 66 1HD2 LEU 66 0.696 3.715 -3.022
502 HD23 LEU 66 2HD2 LEU 66 1.346 5.159 -2.245
503 H SER 67 H SER 67 3.805 1.858 -5.987
504 HA SER 67 HA SER 67 3.381 -0.510 -4.602
505 HB2 SER 67 2HB SER 67 3.528 -1.630 -6.837
506 HB3 SER 67 1HB SER 67 2.499 -0.199 -6.834
507 HG SER 67 HG SER 67 3.722 0.196 -8.539
508 H ASP 68 H ASP 68 6.269 0.406 -6.487
509 HA ASP 68 HA ASP 68 7.756 -1.929 -6.040
510 HB2 ASP 68 2HB ASP 68 8.249 -0.112 -7.729
511 HB3 ASP 68 1HB ASP 68 8.903 0.851 -6.407
512 H LEU 69 H LEU 69 7.412 0.991 -4.107
513 HA LEU 69 HA LEU 69 9.435 0.518 -2.199
514 HB2 LEU 69 2HB LEU 69 8.386 2.681 -2.387
515 HB3 LEU 69 1HB LEU 69 6.811 2.003 -2.021
516 HG LEU 69 HG LEU 69 7.591 1.483 0.278
517 HD11 LEU 69 1HD1 LEU 69 9.979 1.284 -0.178
518 HD12 LEU 69 2HD1 LEU 69 9.663 2.446 1.107
519 HD13 LEU 69 3HD1 LEU 69 10.068 3.013 -0.515
520 HD21 LEU 69 3HD2 LEU 69 6.369 3.544 -0.158
521 HD22 LEU 69 1HD2 LEU 69 7.877 4.379 -0.535
522 HD23 LEU 69 2HD2 LEU 69 7.578 3.787 1.102
523 H VAL 70 H VAL 70 5.936 -0.189 -2.032
524 HA VAL 70 HA VAL 70 5.969 -1.347 0.523
525 HB VAL 70 HB VAL 70 4.024 -1.903 -1.727
526 HG11 VAL 70 1HG1 VAL 70 3.713 -2.259 1.258
527 HG12 VAL 70 2HG1 VAL 70 3.847 -3.548 0.064
528 HG13 VAL 70 3HG1 VAL 70 2.442 -2.484 0.056
529 HG21 VAL 70 3HG2 VAL 70 4.197 0.484 -1.277
530 HG22 VAL 70 1HG2 VAL 70 3.944 0.198 0.446
531 HG23 VAL 70 2HG2 VAL 70 2.649 -0.137 -0.704
532 H LYS 71 H LYS 71 6.130 -2.930 -2.687
533 HA LYS 71 HA LYS 71 6.168 -5.575 -1.641
534 HB2 LYS 71 2HB LYS 71 6.873 -6.261 -3.909
535 HB3 LYS 71 1HB LYS 71 5.479 -5.189 -3.926
536 HG2 LYS 71 2HG LYS 71 6.932 -3.308 -4.510
537 HG3 LYS 71 1HG LYS 71 8.329 -4.387 -4.505
538 HD2 LYS 71 2HD LYS 71 5.913 -4.728 -6.290
539 HD3 LYS 71 1HD LYS 71 7.402 -3.914 -6.780
540 HE2 LYS 71 2HE LYS 71 8.642 -6.019 -6.277
541 HE3 LYS 71 1HE LYS 71 7.095 -6.803 -5.955
542 HZ1 LYS 71 3HZ LYS 71 6.428 -6.360 -8.229
543 HZ2 LYS 71 1HZ LYS 71 7.879 -7.230 -8.202
544 HZ3 LYS 71 2HZ LYS 71 7.892 -5.572 -8.537
545 H ALA 72 H ALA 72 8.676 -3.204 -2.026
546 HA ALA 72 HA ALA 72 10.853 -5.097 -1.779
547 HB1 ALA 72 3HB ALA 72 10.855 -2.091 -1.466
548 HB2 ALA 72 1HB ALA 72 11.181 -2.975 -2.955
549 HB3 ALA 72 2HB ALA 72 12.282 -3.121 -1.585
550 H ARG 73 H ARG 73 9.038 -2.954 0.348
551 HA ARG 73 HA ARG 73 10.651 -3.763 2.665
552 HB2 ARG 73 2HB ARG 73 8.528 -1.615 2.414
553 HB3 ARG 73 1HB ARG 73 9.509 -1.920 3.843
554 HG2 ARG 73 2HG ARG 73 10.538 -1.033 1.146
555 HG3 ARG 73 1HG ARG 73 10.348 -0.009 2.570
556 HD2 ARG 73 2HD ARG 73 11.989 -1.353 3.775
557 HD3 ARG 73 1HD ARG 73 12.155 -2.425 2.386
558 HE ARG 73 HE ARG 73 12.919 -0.257 1.215
559 HH11 ARG 73 1HH1 ARG 73 13.534 -1.058 4.512
560 HH12 ARG 73 2HH1 ARG 73 15.023 -0.184 4.568
561 HH21 ARG 73 1HH2 ARG 73 14.859 0.850 1.296
562 HH22 ARG 73 2HH2 ARG 73 15.743 0.907 2.782
563 H THR 74 H THR 74 9.235 -5.869 1.808
564 HA THR 74 HA THR 74 6.631 -6.192 2.849
565 HB THR 74 HB THR 74 7.016 -8.632 2.655
566 HG1 THR 74 HG1 THR 74 9.142 -9.200 1.685
567 HG21 THR 74 3HG2 THR 74 7.452 -8.684 0.231
568 HG22 THR 74 1HG2 THR 74 8.026 -7.017 0.304
569 HG23 THR 74 2HG2 THR 74 6.340 -7.388 0.669
570 H ASP 75 H ASP 75 9.648 -6.079 4.423
571 HA ASP 75 HA ASP 75 9.144 -7.485 6.799
572 HB2 ASP 75 2HB ASP 75 11.346 -6.620 6.252
573 HB3 ASP 75 1HB ASP 75 10.748 -4.966 6.272
574 H LEU 76 H LEU 76 8.031 -4.381 5.660
575 HA LEU 76 HA LEU 76 6.762 -3.695 8.207
576 HB2 LEU 76 2HB LEU 76 6.950 -2.184 5.589
577 HB3 LEU 76 1HB LEU 76 6.175 -1.572 7.039
578 HG LEU 76 HG LEU 76 9.110 -2.276 6.860
579 HD11 LEU 76 1HD1 LEU 76 9.504 0.146 6.799
580 HD12 LEU 76 2HD1 LEU 76 7.765 0.421 6.671
581 HD13 LEU 76 3HD1 LEU 76 8.625 -0.417 5.377
582 HD21 LEU 76 3HD2 LEU 76 8.176 -2.403 9.125
583 HD22 LEU 76 1HD2 LEU 76 7.549 -0.760 8.964
584 HD23 LEU 76 2HD2 LEU 76 9.291 -1.048 8.963
585 H PHE 77 H PHE 77 5.926 -4.429 4.834
586 HA PHE 77 HA PHE 77 3.069 -4.554 5.602
587 HB2 PHE 77 2HB PHE 77 4.133 -3.787 2.873
588 HB3 PHE 77 1HB PHE 77 2.473 -3.668 3.447
589 HD1 PHE 77 HD1 PHE 77 2.316 -2.214 5.743
590 HD2 PHE 77 HD2 PHE 77 5.275 -1.796 2.702
591 HE1 PHE 77 HE1 PHE 77 2.743 0.095 6.473
592 HE2 PHE 77 HE2 PHE 77 5.703 0.512 3.434
593 HZ PHE 77 HZ PHE 77 4.439 1.459 5.321
594 H VAL 78 H VAL 78 1.912 -6.324 4.945
595 HA VAL 78 HA VAL 78 3.320 -8.519 3.654
596 HB VAL 78 HB VAL 78 0.451 -8.373 4.621
597 HG11 VAL 78 1HG1 VAL 78 2.110 -10.759 3.781
598 HG12 VAL 78 2HG1 VAL 78 0.724 -10.092 2.919
599 HG13 VAL 78 3HG1 VAL 78 0.499 -10.835 4.501
600 HG21 VAL 78 3HG2 VAL 78 2.010 -8.092 6.462
601 HG22 VAL 78 1HG2 VAL 78 2.904 -9.525 5.958
602 HG23 VAL 78 2HG2 VAL 78 1.250 -9.681 6.552
603 H THR 79 H THR 79 3.257 -8.892 1.517
604 HA THR 79 HA THR 79 1.290 -7.396 -0.111
605 HB THR 79 HB THR 79 2.996 -7.336 -1.901
606 HG1 THR 79 HG1 THR 79 4.917 -8.330 -1.671
607 HG21 THR 79 3HG2 THR 79 4.551 -5.757 -0.849
608 HG22 THR 79 1HG2 THR 79 4.045 -6.306 0.751
609 HG23 THR 79 2HG2 THR 79 2.902 -5.468 -0.299
610 H GLU 80 H GLU 80 -0.063 -8.553 -1.339
611 HA GLU 80 HA GLU 80 0.881 -10.944 -2.703
612 HB2 GLU 80 2HB GLU 80 -1.555 -11.000 -0.901
613 HB3 GLU 80 1HB GLU 80 -1.217 -12.219 -2.121
614 HG2 GLU 80 2HG GLU 80 0.966 -12.647 -0.931
615 HG3 GLU 80 1HG GLU 80 0.370 -11.614 0.366
616 H GLU 81 H GLU 81 0.029 -11.151 -4.710
617 HA GLU 81 HA GLU 81 -1.801 -9.073 -5.616
618 HB2 GLU 81 2HB GLU 81 -0.335 -11.241 -7.148
619 HB3 GLU 81 1HB GLU 81 -1.319 -9.980 -7.882
620 HG2 GLU 81 2HG GLU 81 0.192 -8.270 -7.001
621 HG3 GLU 81 1HG GLU 81 1.172 -9.521 -6.241
622 H ARG 82 H ARG 82 -3.920 -9.372 -5.951
623 HA ARG 82 HA ARG 82 -4.999 -12.118 -5.759
624 HB2 ARG 82 2HB ARG 82 -6.273 -9.526 -4.836
625 HB3 ARG 82 1HB ARG 82 -6.989 -11.125 -4.697
626 HG2 ARG 82 2HG ARG 82 -4.418 -10.294 -3.353
627 HG3 ARG 82 1HG ARG 82 -6.005 -10.259 -2.583
628 HD2 ARG 82 2HD ARG 82 -4.661 -12.720 -3.713
629 HD3 ARG 82 1HD ARG 82 -4.734 -12.285 -2.006
630 HE ARG 82 HE ARG 82 -7.342 -12.327 -2.819
631 HH11 ARG 82 1HH1 ARG 82 -4.756 -14.612 -2.843
632 HH12 ARG 82 2HH1 ARG 82 -5.821 -15.968 -2.715
633 HH21 ARG 82 1HH2 ARG 82 -8.684 -14.077 -2.644
634 HH22 ARG 82 2HH2 ARG 82 -8.013 -15.673 -2.610
635 H GLN 83 H GLN 83 -6.811 -12.644 -7.045
636 HA GLN 83 HA GLN 83 -6.803 -11.312 -9.605
637 HB2 GLN 83 2HB GLN 83 -6.816 -13.780 -9.395
638 HB3 GLN 83 1HB GLN 83 -8.415 -13.695 -8.670
639 HG2 GLN 83 2HG GLN 83 -9.324 -12.783 -10.733
640 HG3 GLN 83 1HG GLN 83 -7.717 -12.776 -11.457
641 HE21 GLN 83 1HE2 GLN 83 -7.004 -15.360 -10.249
642 HE22 GLN 83 2HE2 GLN 83 -7.867 -16.551 -11.151
643 H VAL 84 H VAL 84 -8.438 -10.138 -10.547
644 HA VAL 84 HA VAL 84 -10.413 -9.024 -8.718
645 HB VAL 84 HB VAL 84 -9.808 -8.275 -11.594
646 HG11 VAL 84 1HG1 VAL 84 -12.027 -7.548 -10.952
647 HG12 VAL 84 2HG1 VAL 84 -10.953 -6.152 -11.035
648 HG13 VAL 84 3HG1 VAL 84 -11.397 -6.831 -9.469
649 HG21 VAL 84 3HG2 VAL 84 -7.851 -7.948 -10.180
650 HG22 VAL 84 1HG2 VAL 84 -8.819 -7.031 -9.023
651 HG23 VAL 84 2HG2 VAL 84 -8.543 -6.393 -10.643
652 HA PRO 85 HA PRO 85 -13.737 -11.792 -9.749
653 HB2 PRO 85 2HB PRO 85 -15.317 -9.249 -9.520
654 HB3 PRO 85 1HB PRO 85 -15.646 -10.845 -8.830
655 HG2 PRO 85 2HG PRO 85 -14.617 -8.926 -7.311
656 HG3 PRO 85 1HG PRO 85 -14.041 -10.597 -7.156
657 HD2 PRO 85 2HD PRO 85 -12.717 -8.245 -8.425
658 HD3 PRO 85 1HD PRO 85 -11.996 -9.627 -7.575
659 H GLY 86 H GLY 86 -13.616 -12.424 -11.853
660 HA2 GLY 86 2HA GLY 86 -14.483 -12.633 -13.982
661 HA3 GLY 86 1HA GLY 86 -15.459 -11.209 -13.682
662 H SER 87 H SER 87 -12.091 -10.790 -13.182
663 HA SER 87 HA SER 87 -11.868 -9.400 -15.783
664 HB2 SER 87 2HB SER 87 -10.484 -8.786 -13.159
665 HB3 SER 87 1HB SER 87 -10.173 -7.945 -14.678
666 HG SER 87 HG SER 87 -12.632 -8.046 -13.256
667 H THR 88 H THR 88 -9.834 -9.451 -16.889
668 HA THR 88 HA THR 88 -8.412 -11.958 -16.610
669 HB THR 88 HB THR 88 -8.796 -11.178 -18.864
670 HG1 THR 88 HG1 THR 88 -6.901 -11.934 -19.409
671 HG21 THR 88 3HG2 THR 88 -7.175 -8.737 -18.114
672 HG22 THR 88 1HG2 THR 88 -8.906 -8.770 -18.457
673 HG23 THR 88 2HG2 THR 88 -7.745 -9.128 -19.737
674 H GLN 89 H GLN 89 -7.928 -8.692 -15.587
675 HA GLN 89 HA GLN 89 -5.089 -9.122 -15.006
676 HB2 GLN 89 2HB GLN 89 -5.010 -6.753 -14.445
677 HB3 GLN 89 1HB GLN 89 -5.743 -6.981 -16.027
678 HG2 GLN 89 2HG GLN 89 -7.925 -6.554 -15.162
679 HG3 GLN 89 1HG GLN 89 -7.336 -6.584 -13.500
680 HE21 GLN 89 1HE2 GLN 89 -7.501 -4.734 -16.444
681 HE22 GLN 89 2HE2 GLN 89 -6.996 -3.232 -15.753
682 H LYS 90 H LYS 90 -4.226 -8.579 -12.880
683 HA LYS 90 HA LYS 90 -6.104 -9.237 -10.691
684 HB2 LYS 90 2HB LYS 90 -4.187 -10.199 -9.490
685 HB3 LYS 90 1HB LYS 90 -4.421 -10.984 -11.045
686 HG2 LYS 90 2HG LYS 90 -2.580 -9.730 -12.007
687 HG3 LYS 90 1HG LYS 90 -2.385 -8.820 -10.511
688 HD2 LYS 90 2HD LYS 90 -0.703 -10.579 -10.685
689 HD3 LYS 90 1HD LYS 90 -1.785 -10.877 -9.325
690 HE2 LYS 90 2HE LYS 90 -3.022 -12.513 -10.645
691 HE3 LYS 90 1HE LYS 90 -1.991 -12.188 -12.041
692 HZ1 LYS 90 3HZ LYS 90 -1.048 -13.271 -9.441
693 HZ2 LYS 90 1HZ LYS 90 -0.103 -13.022 -10.819
694 HZ3 LYS 90 2HZ LYS 90 -1.325 -14.186 -10.831
695 H ALA 91 H ALA 91 -5.847 -8.152 -8.677
696 HA ALA 91 HA ALA 91 -4.460 -5.551 -8.865
697 HB1 ALA 91 3HB ALA 91 -6.893 -5.382 -8.629
698 HB2 ALA 91 1HB ALA 91 -6.064 -4.724 -7.220
699 HB3 ALA 91 2HB ALA 91 -6.817 -6.318 -7.135
700 H LEU 92 H LEU 92 -2.947 -4.997 -7.354
701 HA LEU 92 HA LEU 92 -1.979 -7.021 -5.544
702 HB2 LEU 92 2HB LEU 92 -0.404 -5.609 -6.726
703 HB3 LEU 92 1HB LEU 92 -1.111 -4.166 -6.027
704 HG LEU 92 HG LEU 92 -0.365 -5.024 -3.759
705 HD11 LEU 92 1HD1 LEU 92 1.197 -6.971 -5.460
706 HD12 LEU 92 2HD1 LEU 92 -0.095 -7.376 -4.331
707 HD13 LEU 92 3HD1 LEU 92 1.421 -6.708 -3.729
708 HD21 LEU 92 3HD2 LEU 92 0.845 -3.260 -4.945
709 HD22 LEU 92 1HD2 LEU 92 1.780 -4.476 -5.818
710 HD23 LEU 92 2HD2 LEU 92 1.959 -4.310 -4.070
711 H TYR 93 H TYR 93 -2.734 -7.351 -3.551
712 HA TYR 93 HA TYR 93 -3.956 -5.102 -2.097
713 HB2 TYR 93 2HB TYR 93 -4.371 -8.077 -1.863
714 HB3 TYR 93 1HB TYR 93 -4.895 -6.964 -0.603
715 HD1 TYR 93 HD1 TYR 93 -5.327 -7.760 -4.226
716 HD2 TYR 93 HD2 TYR 93 -6.924 -5.801 -0.797
717 HE1 TYR 93 HE1 TYR 93 -7.419 -7.323 -5.446
718 HE2 TYR 93 HE2 TYR 93 -9.014 -5.370 -2.008
719 HH TYR 93 HH TYR 93 -9.738 -5.131 -4.379
720 H LEU 94 H LEU 94 -3.393 -4.594 -0.046
721 HA LEU 94 HA LEU 94 -0.835 -5.696 0.943
722 HB2 LEU 94 2HB LEU 94 -1.689 -2.799 1.103
723 HB3 LEU 94 1HB LEU 94 -0.111 -3.467 1.483
724 HG LEU 94 HG LEU 94 -1.324 -3.349 -1.287
725 HD11 LEU 94 1HD1 LEU 94 0.351 -1.617 -1.730
726 HD12 LEU 94 2HD1 LEU 94 0.821 -1.642 -0.030
727 HD13 LEU 94 3HD1 LEU 94 -0.801 -1.126 -0.490
728 HD21 LEU 94 3HD2 LEU 94 1.450 -4.140 -0.396
729 HD22 LEU 94 1HD2 LEU 94 0.901 -3.984 -2.064
730 HD23 LEU 94 2HD2 LEU 94 0.210 -5.226 -1.022
731 H ARG 95 H ARG 95 -0.613 -5.848 3.205
732 HA ARG 95 HA ARG 95 -2.597 -4.585 4.916
733 HB2 ARG 95 2HB ARG 95 -3.294 -6.579 6.061
734 HB3 ARG 95 1HB ARG 95 -3.603 -6.777 4.344
735 HG2 ARG 95 2HG ARG 95 -1.561 -8.148 4.159
736 HG3 ARG 95 1HG ARG 95 -1.324 -7.986 5.902
737 HD2 ARG 95 2HD ARG 95 -3.658 -9.294 4.498
738 HD3 ARG 95 1HD ARG 95 -2.397 -10.104 5.428
739 HE ARG 95 HE ARG 95 -3.342 -8.677 7.351
740 HH11 ARG 95 1HH1 ARG 95 -5.238 -9.996 4.795
741 HH12 ARG 95 2HH1 ARG 95 -6.655 -10.128 5.772
742 HH21 ARG 95 1HH2 ARG 95 -5.202 -8.861 8.587
743 HH22 ARG 95 2HH2 ARG 95 -6.633 -9.516 7.871
744 H ALA 96 H ALA 96 -2.058 -4.898 7.275
745 HA ALA 96 HA ALA 96 0.626 -4.105 7.685
746 HB1 ALA 96 3HB ALA 96 0.036 -4.050 10.068
747 HB2 ALA 96 1HB ALA 96 -1.475 -4.884 9.705
748 HB3 ALA 96 2HB ALA 96 -1.184 -3.267 9.064
749 H LYS 97 H LYS 97 2.338 -5.097 8.750
750 HA LYS 97 HA LYS 97 2.501 -7.966 8.596
751 HB2 LYS 97 2HB LYS 97 4.450 -6.644 8.039
752 HB3 LYS 97 1HB LYS 97 4.443 -5.871 9.614
753 HG2 LYS 97 2HG LYS 97 6.197 -7.507 9.560
754 HG3 LYS 97 1HG LYS 97 4.938 -8.074 10.654
755 HD2 LYS 97 2HD LYS 97 5.789 -9.890 9.250
756 HD3 LYS 97 1HD LYS 97 4.086 -9.570 8.915
757 HE2 LYS 97 2HE LYS 97 4.696 -8.304 6.924
758 HE3 LYS 97 1HE LYS 97 6.410 -8.544 7.276
759 HZ1 LYS 97 3HZ LYS 97 4.504 -10.764 6.785
760 HZ2 LYS 97 1HZ LYS 97 6.187 -10.863 6.898
761 HZ3 LYS 97 2HZ LYS 97 5.477 -10.077 5.584
762 H LEU 98 H LEU 98 1.303 -9.050 10.068
763 HA LEU 98 HA LEU 98 1.133 -8.071 12.825
764 HB2 LEU 98 2HB LEU 98 -0.378 -10.298 11.447
765 HB3 LEU 98 1HB LEU 98 -0.689 -9.702 13.068
766 HG LEU 98 HG LEU 98 -1.036 -8.116 10.512
767 HD11 LEU 98 1HD1 LEU 98 -3.432 -8.245 11.018
768 HD12 LEU 98 2HD1 LEU 98 -3.084 -9.299 12.390
769 HD13 LEU 98 3HD1 LEU 98 -2.732 -9.841 10.749
770 HD21 LEU 98 3HD2 LEU 98 -0.383 -6.662 12.347
771 HD22 LEU 98 1HD2 LEU 98 -1.623 -7.369 13.383
772 HD23 LEU 98 2HD2 LEU 98 -2.089 -6.425 11.968
773 H GLU 99 H GLU 99 2.939 -8.686 13.909
774 HA GLU 99 HA GLU 99 4.049 -11.355 13.693
775 HB2 GLU 99 2HB GLU 99 4.733 -9.184 15.689
776 HB3 GLU 99 1HB GLU 99 5.699 -10.597 15.298
777 HG2 GLU 99 2HG GLU 99 6.023 -9.714 13.018
778 HG3 GLU 99 1HG GLU 99 5.110 -8.274 13.474
779 H HIS 100 H HIS 100 2.566 -9.423 16.285
780 HA HIS 100 HA HIS 100 2.804 -11.420 18.268
781 HB2 HIS 100 2HB HIS 100 0.999 -8.991 18.198
782 HB3 HIS 100 1HB HIS 100 1.364 -9.948 19.630
783 HD1 HIS 100 HD1 HIS 100 2.252 -6.858 18.334
784 HD2 HIS 100 HD2 HIS 100 4.510 -10.046 19.750
785 HE1 HIS 100 HE1 HIS 100 4.485 -5.890 18.933
786 HE2 HIS 100 HE2 HIS 100 5.754 -7.792 19.963
787 H HIS 101 H HIS 101 0.019 -10.480 16.242
788 HA HIS 101 HA HIS 101 -1.188 -13.044 16.388
789 HB2 HIS 101 2HB HIS 101 -3.212 -12.428 17.703
790 HB3 HIS 101 1HB HIS 101 -1.742 -12.418 18.671
791 HD1 HIS 101 HD1 HIS 101 -1.240 -10.311 19.928
792 HD2 HIS 101 HD2 HIS 101 -4.117 -9.740 16.978
793 HE1 HIS 101 HE1 HIS 101 -2.053 -7.954 20.222
794 HE2 HIS 101 HE2 HIS 101 -3.826 -7.650 18.471
795 H HIS 102 H HIS 102 -3.376 -13.086 15.358
796 HA HIS 102 HA HIS 102 -3.707 -10.916 13.405
797 HB2 HIS 102 2HB HIS 102 -4.936 -13.683 13.539
798 HB3 HIS 102 1HB HIS 102 -5.307 -12.492 12.295
799 HD1 HIS 102 HD1 HIS 102 -3.237 -15.327 12.801
800 HD2 HIS 102 HD2 HIS 102 -2.704 -11.639 10.964
801 HE1 HIS 102 HE1 HIS 102 -1.304 -15.630 11.233
802 HE2 HIS 102 HE2 HIS 102 -1.102 -13.437 10.021
803 H HIS 103 H HIS 103 -6.208 -10.565 12.841
804 HA HIS 103 HA HIS 103 -7.268 -9.469 15.331
805 HB2 HIS 103 2HB HIS 103 -8.610 -8.005 13.969
806 HB3 HIS 103 1HB HIS 103 -6.969 -8.004 13.343
807 HD1 HIS 103 HD1 HIS 103 -10.342 -8.133 12.212
808 HD2 HIS 103 HD2 HIS 103 -6.797 -9.942 11.006
809 HE1 HIS 103 HE1 HIS 103 -10.739 -8.891 9.856
810 HE2 HIS 103 HE2 HIS 103 -8.659 -10.152 9.226
811 H HIS 104 H HIS 104 -9.222 -9.914 16.239
812 HA HIS 104 HA HIS 104 -10.681 -12.252 15.276
813 HB2 HIS 104 2HB HIS 104 -11.010 -10.552 17.764
814 HB3 HIS 104 1HB HIS 104 -12.024 -11.940 17.383
815 HD1 HIS 104 HD1 HIS 104 -11.178 -14.183 18.062
816 HD2 HIS 104 HD2 HIS 104 -8.221 -11.270 18.230
817 HE1 HIS 104 HE1 HIS 104 -9.219 -15.282 19.169
818 HE2 HIS 104 HE2 HIS 104 -7.499 -13.463 19.394
819 H HIS 105 H HIS 105 -11.252 -8.803 15.817
820 HA HIS 105 HA HIS 105 -13.774 -8.960 14.307
821 HB2 HIS 105 2HB HIS 105 -12.568 -6.698 15.922
822 HB3 HIS 105 1HB HIS 105 -14.084 -6.588 15.033
823 HD1 HIS 105 HD1 HIS 105 -16.151 -7.403 16.201
824 HD2 HIS 105 HD2 HIS 105 -12.669 -8.576 18.140
825 HE1 HIS 105 HE1 HIS 105 -16.900 -8.416 18.368
826 HE2 HIS 105 HE2 HIS 105 -14.793 -9.287 19.432
Start of MODEL 20
1 H1 MET 1 1H MET 1 32.309 -29.877 25.610
2 H2 MET 1 2H MET 1 31.737 -28.534 24.763
3 H3 MET 1 3H MET 1 33.301 -28.528 25.395
4 HA MET 1 HA MET 1 33.988 -30.263 23.926
5 HB2 MET 1 2HB MET 1 32.437 -31.042 22.133
6 HB3 MET 1 1HB MET 1 31.943 -31.513 23.752
7 HG2 MET 1 2HG MET 1 30.316 -29.666 23.771
8 HG3 MET 1 1HG MET 1 30.790 -29.253 22.126
9 HE1 MET 1 3HE MET 1 28.668 -33.169 23.327
10 HE2 MET 1 1HE MET 1 29.018 -31.853 24.445
11 HE3 MET 1 2HE MET 1 30.337 -32.811 23.776
12 H ASP 2 H ASP 2 31.683 -27.738 22.803
13 HA ASP 2 HA ASP 2 33.829 -26.730 21.039
14 HB2 ASP 2 2HB ASP 2 30.846 -26.626 20.517
15 HB3 ASP 2 1HB ASP 2 32.111 -26.027 19.448
16 H GLN 3 H GLN 3 34.320 -24.603 21.168
17 HA GLN 3 HA GLN 3 33.077 -23.054 23.296
18 HB2 GLN 3 2HB GLN 3 35.481 -22.475 21.540
19 HB3 GLN 3 1HB GLN 3 34.919 -21.424 22.833
20 HG2 GLN 3 2HG GLN 3 36.776 -22.708 23.628
21 HG3 GLN 3 1HG GLN 3 35.318 -23.258 24.448
22 HE21 GLN 3 1HE2 GLN 3 36.228 -25.240 24.955
23 HE22 GLN 3 2HE2 GLN 3 36.502 -26.469 23.770
24 H LYS 4 H LYS 4 31.756 -21.327 23.022
25 HA LYS 4 HA LYS 4 30.371 -21.042 20.581
26 HB2 LYS 4 2HB LYS 4 30.365 -19.370 23.096
27 HB3 LYS 4 1HB LYS 4 29.279 -19.076 21.743
28 HG2 LYS 4 2HG LYS 4 28.272 -21.255 22.018
29 HG3 LYS 4 1HG LYS 4 29.429 -21.663 23.291
30 HD2 LYS 4 2HD LYS 4 28.510 -20.028 24.764
31 HD3 LYS 4 1HD LYS 4 27.541 -19.315 23.474
32 HE2 LYS 4 2HE LYS 4 27.176 -22.106 24.572
33 HE3 LYS 4 1HE LYS 4 26.208 -20.703 25.027
34 HZ1 LYS 4 3HZ LYS 4 26.390 -21.921 22.324
35 HZ2 LYS 4 1HZ LYS 4 25.550 -20.496 22.679
36 HZ3 LYS 4 2HZ LYS 4 25.057 -21.960 23.363
37 H SER 5 H SER 5 31.157 -20.125 18.790
38 HA SER 5 HA SER 5 33.028 -17.916 18.847
39 HB2 SER 5 2HB SER 5 31.625 -19.327 16.559
40 HB3 SER 5 1HB SER 5 32.771 -18.006 16.336
41 HG SER 5 HG SER 5 33.528 -20.347 16.295
42 H SER 6 H SER 6 32.449 -15.861 19.083
43 HA SER 6 HA SER 6 29.656 -15.078 18.783
44 HB2 SER 6 2HB SER 6 30.429 -12.928 19.812
45 HB3 SER 6 1HB SER 6 30.778 -14.348 20.797
46 HG SER 6 HG SER 6 32.886 -14.144 20.405
47 H SER 7 H SER 7 32.768 -13.680 17.717
48 HA SER 7 HA SER 7 33.430 -12.661 15.804
49 HB2 SER 7 2HB SER 7 32.692 -14.654 14.647
50 HB3 SER 7 1HB SER 7 31.026 -14.078 14.628
51 HG SER 7 HG SER 7 31.489 -12.690 13.062
52 HA PRO 8 HA PRO 8 30.620 -9.026 16.009
53 HB2 PRO 8 2HB PRO 8 32.488 -7.213 16.652
54 HB3 PRO 8 1HB PRO 8 31.787 -8.279 17.877
55 HG2 PRO 8 2HG PRO 8 34.413 -8.514 16.446
56 HG3 PRO 8 1HG PRO 8 34.052 -8.749 18.168
57 HD2 PRO 8 2HD PRO 8 34.297 -10.808 16.359
58 HD3 PRO 8 1HD PRO 8 33.326 -10.905 17.841
59 H GLN 9 H GLN 9 31.175 -6.748 14.875
60 HA GLN 9 HA GLN 9 32.987 -6.917 12.641
61 HB2 GLN 9 2HB GLN 9 31.121 -8.266 11.798
62 HB3 GLN 9 1HB GLN 9 30.008 -6.942 12.105
63 HG2 GLN 9 2HG GLN 9 31.051 -5.594 10.411
64 HG3 GLN 9 1HG GLN 9 32.325 -6.789 10.186
65 HE21 GLN 9 1HE2 GLN 9 28.956 -7.660 10.623
66 HE22 GLN 9 2HE2 GLN 9 28.720 -8.249 9.016
67 HA PRO 10 HA PRO 10 32.222 -2.502 13.550
68 HB2 PRO 10 2HB PRO 10 34.771 -1.728 13.737
69 HB3 PRO 10 1HB PRO 10 33.998 -2.631 15.051
70 HG2 PRO 10 2HG PRO 10 35.914 -3.584 12.959
71 HG3 PRO 10 1HG PRO 10 35.799 -4.044 14.667
72 HD2 PRO 10 2HD PRO 10 34.753 -5.489 12.500
73 HD3 PRO 10 1HD PRO 10 34.321 -5.719 14.206
74 H ALA 11 H ALA 11 31.781 -1.122 11.889
75 HA ALA 11 HA ALA 11 33.510 -1.225 9.487
76 HB1 ALA 11 3HB ALA 11 31.570 -0.928 8.079
77 HB2 ALA 11 1HB ALA 11 30.519 -0.826 9.492
78 HB3 ALA 11 2HB ALA 11 31.340 -2.339 9.113
79 H ALA 12 H ALA 12 34.661 0.623 9.532
80 HA ALA 12 HA ALA 12 33.614 3.127 10.470
81 HB1 ALA 12 3HB ALA 12 36.123 2.583 8.870
82 HB2 ALA 12 1HB ALA 12 36.004 2.585 10.631
83 HB3 ALA 12 2HB ALA 12 35.734 4.076 9.728
84 H GLN 13 H GLN 13 31.756 3.545 9.239
85 HA GLN 13 HA GLN 13 32.212 4.207 6.391
86 HB2 GLN 13 2HB GLN 13 29.708 3.044 7.638
87 HB3 GLN 13 1HB GLN 13 29.862 3.550 5.963
88 HG2 GLN 13 2HG GLN 13 31.477 1.349 7.244
89 HG3 GLN 13 1HG GLN 13 30.018 1.105 6.287
90 HE21 GLN 13 1HE2 GLN 13 33.382 1.957 6.200
91 HE22 GLN 13 2HE2 GLN 13 33.571 1.837 4.491
92 H ALA 14 H ALA 14 31.487 6.178 5.698
93 HA ALA 14 HA ALA 14 30.574 8.120 7.588
94 HB1 ALA 14 3HB ALA 14 30.512 9.651 5.691
95 HB2 ALA 14 1HB ALA 14 30.694 8.298 4.574
96 HB3 ALA 14 2HB ALA 14 32.005 8.713 5.678
97 HA PRO 15 HA PRO 15 26.244 7.035 7.528
98 HB2 PRO 15 2HB PRO 15 25.891 9.887 8.326
99 HB3 PRO 15 1HB PRO 15 25.308 8.415 9.113
100 HG2 PRO 15 2HG PRO 15 27.358 9.764 10.136
101 HG3 PRO 15 1HG PRO 15 27.363 7.991 10.125
102 HD2 PRO 15 2HD PRO 15 28.814 9.898 8.325
103 HD3 PRO 15 1HD PRO 15 29.376 8.371 9.041
104 H GLU 16 H GLU 16 24.827 6.992 5.884
105 HA GLU 16 HA GLU 16 24.819 9.183 3.918
106 HB2 GLU 16 2HB GLU 16 25.260 6.995 2.964
107 HB3 GLU 16 1HB GLU 16 23.819 6.330 3.720
108 HG2 GLU 16 2HG GLU 16 22.401 7.702 2.321
109 HG3 GLU 16 1HG GLU 16 23.810 8.495 1.622
110 H THR 17 H THR 17 22.819 10.033 3.139
111 HA THR 17 HA THR 17 20.944 10.633 5.154
112 HB THR 17 HB THR 17 20.672 11.004 2.158
113 HG1 THR 17 HG1 THR 17 21.963 12.670 2.434
114 HG21 THR 17 3HG2 THR 17 19.208 12.359 4.436
115 HG22 THR 17 1HG2 THR 17 18.509 11.205 3.302
116 HG23 THR 17 2HG2 THR 17 19.064 12.778 2.728
117 H LYS 18 H LYS 18 19.902 8.877 6.011
118 HA LYS 18 HA LYS 18 18.134 7.336 4.207
119 HB2 LYS 18 2HB LYS 18 19.786 5.958 5.401
120 HB3 LYS 18 1HB LYS 18 19.217 6.586 6.940
121 HG2 LYS 18 2HG LYS 18 17.049 5.529 6.598
122 HG3 LYS 18 1HG LYS 18 17.567 4.944 5.015
123 HD2 LYS 18 2HD LYS 18 18.798 4.185 7.677
124 HD3 LYS 18 1HD LYS 18 17.708 3.182 6.720
125 HE2 LYS 18 2HE LYS 18 19.353 3.166 4.886
126 HE3 LYS 18 1HE LYS 18 20.448 4.135 5.869
127 HZ1 LYS 18 3HZ LYS 18 20.573 2.337 7.463
128 HZ2 LYS 18 1HZ LYS 18 20.989 1.771 5.926
129 HZ3 LYS 18 2HZ LYS 18 19.468 1.420 6.571
130 H GLN 19 H GLN 19 16.029 7.865 4.327
131 HA GLN 19 HA GLN 19 15.094 9.623 6.431
132 HB2 GLN 19 2HB GLN 19 13.604 8.516 4.038
133 HB3 GLN 19 1HB GLN 19 13.045 9.806 5.092
134 HG2 GLN 19 2HG GLN 19 15.466 9.898 3.293
135 HG3 GLN 19 1HG GLN 19 13.918 10.690 3.003
136 HE21 GLN 19 1HE2 GLN 19 13.383 12.517 4.205
137 HE22 GLN 19 2HE2 GLN 19 14.557 13.396 5.116
138 H ALA 20 H ALA 20 13.193 9.269 7.698
139 HA ALA 20 HA ALA 20 12.935 6.477 8.549
140 HB1 ALA 20 3HB ALA 20 11.995 7.370 10.605
141 HB2 ALA 20 1HB ALA 20 12.011 8.998 9.925
142 HB3 ALA 20 2HB ALA 20 13.529 8.156 10.233
143 H PHE 21 H PHE 21 11.257 5.289 7.923
144 HA PHE 21 HA PHE 21 8.914 6.283 6.661
145 HB2 PHE 21 2HB PHE 21 9.561 3.599 7.904
146 HB3 PHE 21 1HB PHE 21 8.052 3.923 7.063
147 HD1 PHE 21 HD1 PHE 21 8.286 4.798 4.617
148 HD2 PHE 21 HD2 PHE 21 11.360 2.740 6.732
149 HE1 PHE 21 HE1 PHE 21 9.325 4.165 2.483
150 HE2 PHE 21 HE2 PHE 21 12.402 2.100 4.597
151 HZ PHE 21 HZ PHE 21 11.386 2.814 2.468
152 HA PRO 22 HA PRO 22 6.594 7.012 10.525
153 HB2 PRO 22 2HB PRO 22 4.551 8.394 9.430
154 HB3 PRO 22 1HB PRO 22 6.129 9.136 9.715
155 HG2 PRO 22 2HG PRO 22 4.957 8.094 7.164
156 HG3 PRO 22 1HG PRO 22 5.934 9.548 7.438
157 HD2 PRO 22 2HD PRO 22 6.920 7.158 6.449
158 HD3 PRO 22 1HD PRO 22 7.905 8.395 7.255
159 H ARG 23 H ARG 23 5.898 4.911 10.991
160 HA ARG 23 HA ARG 23 4.298 3.483 9.047
161 HB2 ARG 23 2HB ARG 23 4.447 1.585 10.703
162 HB3 ARG 23 1HB ARG 23 5.970 2.169 10.048
163 HG2 ARG 23 2HG ARG 23 6.401 3.409 12.097
164 HG3 ARG 23 1HG ARG 23 4.856 2.875 12.762
165 HD2 ARG 23 2HD ARG 23 5.597 0.573 12.735
166 HD3 ARG 23 1HD ARG 23 7.095 1.028 11.922
167 HE ARG 23 HE ARG 23 6.887 2.435 14.348
168 HH11 ARG 23 1HH1 ARG 23 7.409 -0.764 13.191
169 HH12 ARG 23 2HH1 ARG 23 8.375 -1.221 14.546
170 HH21 ARG 23 1HH2 ARG 23 8.112 1.859 16.083
171 HH22 ARG 23 2HH2 ARG 23 8.753 0.256 16.194
172 H LYS 24 H LYS 24 3.609 5.181 12.035
173 HA LYS 24 HA LYS 24 1.174 3.910 12.666
174 HB2 LYS 24 2HB LYS 24 2.118 6.737 13.173
175 HB3 LYS 24 1HB LYS 24 0.575 6.125 13.764
176 HG2 LYS 24 2HG LYS 24 1.809 4.330 14.967
177 HG3 LYS 24 1HG LYS 24 3.321 5.093 14.467
178 HD2 LYS 24 2HD LYS 24 2.877 7.036 15.748
179 HD3 LYS 24 1HD LYS 24 1.186 6.584 15.989
180 HE2 LYS 24 2HE LYS 24 3.597 5.157 17.128
181 HE3 LYS 24 1HE LYS 24 2.491 6.203 18.019
182 HZ1 LYS 24 3HZ LYS 24 1.955 3.884 18.370
183 HZ2 LYS 24 1HZ LYS 24 1.774 3.633 16.708
184 HZ3 LYS 24 2HZ LYS 24 0.698 4.642 17.535
185 H PHE 25 H PHE 25 1.751 6.834 10.696
186 HA PHE 25 HA PHE 25 -0.943 7.227 9.944
187 HB2 PHE 25 2HB PHE 25 1.603 8.067 8.528
188 HB3 PHE 25 1HB PHE 25 -0.008 8.642 8.114
189 HD1 PHE 25 HD2 PHE 25 2.710 8.802 10.564
190 HD2 PHE 25 HD1 PHE 25 -1.172 10.220 9.530
191 HE1 PHE 25 HE2 PHE 25 2.932 10.608 12.214
192 HE2 PHE 25 HE1 PHE 25 -0.949 12.035 11.177
193 HZ PHE 25 HZ PHE 25 1.103 12.230 12.523
194 H VAL 26 H VAL 26 1.705 5.502 8.307
195 HA VAL 26 HA VAL 26 0.275 4.896 5.945
196 HB VAL 26 HB VAL 26 2.607 3.367 7.133
197 HG11 VAL 26 1HG1 VAL 26 1.554 3.474 4.298
198 HG12 VAL 26 2HG1 VAL 26 1.443 2.100 5.399
199 HG13 VAL 26 3HG1 VAL 26 3.017 2.641 4.819
200 HG21 VAL 26 3HG2 VAL 26 2.614 5.649 5.146
201 HG22 VAL 26 1HG2 VAL 26 4.024 4.745 5.691
202 HG23 VAL 26 2HG2 VAL 26 3.129 5.751 6.829
203 H LEU 27 H LEU 27 0.971 2.833 8.792
204 HA LEU 27 HA LEU 27 -0.532 0.619 7.912
205 HB2 LEU 27 2HB LEU 27 0.210 1.466 10.713
206 HB3 LEU 27 1HB LEU 27 -0.517 -0.081 10.314
207 HG LEU 27 HG LEU 27 2.186 0.898 9.360
208 HD11 LEU 27 1HD1 LEU 27 1.483 -1.253 11.357
209 HD12 LEU 27 2HD1 LEU 27 2.170 0.326 11.736
210 HD13 LEU 27 3HD1 LEU 27 3.105 -0.841 10.801
211 HD21 LEU 27 3HD2 LEU 27 1.114 -0.532 7.698
212 HD22 LEU 27 1HD2 LEU 27 0.814 -1.759 8.930
213 HD23 LEU 27 2HD2 LEU 27 2.467 -1.363 8.463
214 H ALA 28 H ALA 28 -1.474 3.403 9.925
215 HA ALA 28 HA ALA 28 -4.104 2.612 10.490
216 HB1 ALA 28 3HB ALA 28 -3.040 4.541 11.559
217 HB2 ALA 28 1HB ALA 28 -4.585 4.987 10.833
218 HB3 ALA 28 2HB ALA 28 -3.074 5.412 10.027
219 H ALA 29 H ALA 29 -2.830 4.462 7.716
220 HA ALA 29 HA ALA 29 -5.243 4.743 6.294
221 HB1 ALA 29 3HB ALA 29 -2.438 4.489 5.192
222 HB2 ALA 29 1HB ALA 29 -3.211 5.985 5.717
223 HB3 ALA 29 2HB ALA 29 -3.838 5.114 4.319
224 H LEU 30 H LEU 30 -2.838 2.180 6.323
225 HA LEU 30 HA LEU 30 -3.804 0.598 4.227
226 HB2 LEU 30 2HB LEU 30 -1.589 0.408 5.334
227 HB3 LEU 30 1HB LEU 30 -2.372 -0.287 6.738
228 HG LEU 30 HG LEU 30 -3.067 -2.232 5.411
229 HD11 LEU 30 1HD1 LEU 30 -3.292 -1.145 3.233
230 HD12 LEU 30 2HD1 LEU 30 -2.234 -2.552 3.138
231 HD13 LEU 30 3HD1 LEU 30 -1.544 -0.928 3.152
232 HD21 LEU 30 3HD2 LEU 30 -0.119 -1.623 5.151
233 HD22 LEU 30 1HD2 LEU 30 -0.862 -3.223 5.112
234 HD23 LEU 30 2HD2 LEU 30 -0.915 -2.264 6.590
235 H GLU 31 H GLU 31 -4.360 0.155 7.752
236 HA GLU 31 HA GLU 31 -6.196 -1.975 7.430
237 HB2 GLU 31 2HB GLU 31 -6.746 -1.621 9.811
238 HB3 GLU 31 1HB GLU 31 -5.014 -1.668 9.523
239 HG2 GLU 31 2HG GLU 31 -4.967 0.803 9.607
240 HG3 GLU 31 1HG GLU 31 -6.688 0.797 9.989
241 H GLN 32 H GLN 32 -6.641 1.474 7.261
242 HA GLN 32 HA GLN 32 -9.546 1.278 7.397
243 HB2 GLN 32 2HB GLN 32 -7.685 3.603 6.883
244 HB3 GLN 32 1HB GLN 32 -9.439 3.745 6.860
245 HG2 GLN 32 2HG GLN 32 -9.560 3.052 9.183
246 HG3 GLN 32 1HG GLN 32 -7.814 2.811 9.222
247 HE21 GLN 32 1HE2 GLN 32 -6.467 4.603 9.267
248 HE22 GLN 32 2HE2 GLN 32 -7.042 6.182 9.658
249 H SER 33 H SER 33 -7.114 1.078 4.989
250 HA SER 33 HA SER 33 -9.016 1.563 2.802
251 HB2 SER 33 2HB SER 33 -6.778 2.526 2.536
252 HB3 SER 33 1HB SER 33 -6.046 0.933 2.735
253 HG SER 33 HG SER 33 -7.206 0.300 0.818
254 H SER 34 H SER 34 -8.550 -0.906 4.775
255 HA SER 34 HA SER 34 -8.166 -3.052 2.857
256 HB2 SER 34 2HB SER 34 -8.624 -3.113 5.847
257 HB3 SER 34 1HB SER 34 -8.329 -4.540 4.856
258 HG SER 34 HG SER 34 -6.512 -2.399 4.739
259 H ASP 35 H ASP 35 -9.677 -4.375 2.050
260 HA ASP 35 HA ASP 35 -12.461 -4.003 2.400
261 HB2 ASP 35 2HB ASP 35 -10.864 -6.320 1.274
262 HB3 ASP 35 1HB ASP 35 -12.621 -6.239 1.227
263 H ASP 36 H ASP 36 -13.907 -5.860 3.113
264 HA ASP 36 HA ASP 36 -13.737 -6.376 5.809
265 HB2 ASP 36 2HB ASP 36 -15.796 -6.575 4.545
266 HB3 ASP 36 1HB ASP 36 -15.155 -7.946 3.646
267 H ALA 37 H ALA 37 -12.243 -8.198 3.209
268 HA ALA 37 HA ALA 37 -11.734 -10.567 4.746
269 HB1 ALA 37 3HB ALA 37 -11.929 -10.682 2.336
270 HB2 ALA 37 1HB ALA 37 -10.330 -11.234 2.835
271 HB3 ALA 37 2HB ALA 37 -10.533 -9.623 2.142
272 H GLY 38 H GLY 38 -10.360 -7.548 5.012
273 HA2 GLY 38 2HA GLY 38 -8.628 -6.942 6.453
274 HA3 GLY 38 1HA GLY 38 -8.107 -8.618 6.512
275 H TRP 39 H TRP 39 -8.586 -7.238 3.393
276 HA TRP 39 HA TRP 39 -5.687 -6.774 3.071
277 HB2 TRP 39 2HB TRP 39 -7.600 -8.161 1.181
278 HB3 TRP 39 1HB TRP 39 -6.021 -7.567 0.677
279 HD1 TRP 39 HD1 TRP 39 -7.663 -10.358 2.699
280 HE1 TRP 39 HE1 TRP 39 -5.886 -12.144 3.223
281 HE3 TRP 39 HE3 TRP 39 -3.503 -7.866 1.073
282 HZ2 TRP 39 HZ2 TRP 39 -3.088 -12.453 2.973
283 HZ3 TRP 39 HZ3 TRP 39 -1.314 -8.976 1.250
284 HH2 TRP 39 HH2 TRP 39 -1.115 -11.227 2.183
285 H ALA 40 H ALA 40 -5.086 -4.950 1.979
286 HA ALA 40 HA ALA 40 -7.259 -3.115 1.200
287 HB1 ALA 40 3HB ALA 40 -5.688 -1.306 1.626
288 HB2 ALA 40 1HB ALA 40 -4.415 -2.477 1.980
289 HB3 ALA 40 2HB ALA 40 -5.822 -2.357 3.036
290 H ASN 41 H ASN 41 -7.553 -2.784 -0.916
291 HA ASN 41 HA ASN 41 -5.770 -3.667 -2.928
292 HB2 ASN 41 2HB ASN 41 -8.235 -3.383 -3.225
293 HB3 ASN 41 1HB ASN 41 -8.010 -1.639 -3.192
294 HD21 ASN 41 1HD2 ASN 41 -9.044 -3.432 -5.288
295 HD22 ASN 41 2HD2 ASN 41 -8.080 -3.109 -6.685
296 H LEU 42 H LEU 42 -4.036 -2.738 -3.797
297 HA LEU 42 HA LEU 42 -2.605 -0.654 -2.825
298 HB2 LEU 42 2HB LEU 42 -1.763 -2.230 -4.482
299 HB3 LEU 42 1HB LEU 42 -2.791 -1.521 -5.713
300 HG LEU 42 HG LEU 42 -1.513 0.612 -5.491
301 HD11 LEU 42 1HD1 LEU 42 0.652 0.580 -4.345
302 HD12 LEU 42 2HD1 LEU 42 0.301 -1.036 -3.728
303 HD13 LEU 42 3HD1 LEU 42 -0.685 0.336 -3.219
304 HD21 LEU 42 3HD2 LEU 42 0.476 -0.191 -6.687
305 HD22 LEU 42 1HD2 LEU 42 -1.000 -0.960 -7.271
306 HD23 LEU 42 2HD2 LEU 42 0.092 -1.843 -6.204
307 H GLY 43 H GLY 43 -5.170 -0.384 -5.266
308 HA2 GLY 43 2HA GLY 43 -4.791 2.266 -6.080
309 HA3 GLY 43 1HA GLY 43 -6.330 1.424 -6.089
310 H ASN 44 H ASN 44 -7.047 1.107 -3.556
311 HA ASN 44 HA ASN 44 -7.770 3.727 -2.717
312 HB2 ASN 44 2HB ASN 44 -8.073 1.061 -1.317
313 HB3 ASN 44 1HB ASN 44 -8.798 2.566 -0.758
314 HD21 ASN 44 1HD2 ASN 44 -10.114 0.110 -1.557
315 HD22 ASN 44 2HD2 ASN 44 -11.165 0.532 -2.861
316 H PHE 45 H PHE 45 -5.275 1.466 -1.699
317 HA PHE 45 HA PHE 45 -4.512 2.712 0.700
318 HB2 PHE 45 2HB PHE 45 -3.730 0.480 0.073
319 HB3 PHE 45 1HB PHE 45 -2.814 1.157 -1.270
320 HD1 PHE 45 HD1 PHE 45 -3.155 1.731 2.414
321 HD2 PHE 45 HD2 PHE 45 -0.538 1.334 -0.926
322 HE1 PHE 45 HE1 PHE 45 -1.213 1.990 3.903
323 HE2 PHE 45 HE2 PHE 45 1.405 1.590 0.562
324 HZ PHE 45 HZ PHE 45 1.067 1.918 2.978
325 H GLY 46 H GLY 46 -3.084 3.087 -2.564
326 HA2 GLY 46 2HA GLY 46 -1.305 5.165 -1.961
327 HA3 GLY 46 1HA GLY 46 -1.996 4.860 -3.546
328 H ASN 47 H ASN 47 -4.743 5.255 -2.462
329 HA ASN 47 HA ASN 47 -4.969 8.084 -2.850
330 HB2 ASN 47 2HB ASN 47 -6.679 6.442 -3.612
331 HB3 ASN 47 1HB ASN 47 -7.054 6.077 -1.933
332 HD21 ASN 47 1HD2 ASN 47 -8.790 7.088 -4.015
333 HD22 ASN 47 2HD2 ASN 47 -9.412 8.592 -3.437
334 H TYR 48 H TYR 48 -6.003 6.035 -0.092
335 HA TYR 48 HA TYR 48 -6.541 8.267 1.575
336 HB2 TYR 48 2HB TYR 48 -7.571 5.935 1.711
337 HB3 TYR 48 1HB TYR 48 -6.102 5.435 2.539
338 HD1 TYR 48 HD2 TYR 48 -8.836 7.978 2.742
339 HD2 TYR 48 HD1 TYR 48 -5.992 5.631 4.875
340 HE1 TYR 48 HE2 TYR 48 -9.797 8.749 4.868
341 HE2 TYR 48 HE1 TYR 48 -6.949 6.398 7.004
342 HH TYR 48 HH TYR 48 -9.934 7.967 7.207
343 H LEU 49 H LEU 49 -3.689 6.240 1.182
344 HA LEU 49 HA LEU 49 -2.289 6.948 3.502
345 HB2 LEU 49 2HB LEU 49 -1.502 5.156 2.098
346 HB3 LEU 49 1HB LEU 49 -1.285 6.247 0.743
347 HG LEU 49 HG LEU 49 0.557 7.370 1.910
348 HD11 LEU 49 1HD1 LEU 49 -0.199 7.061 4.208
349 HD12 LEU 49 2HD1 LEU 49 1.453 6.483 3.997
350 HD13 LEU 49 3HD1 LEU 49 0.122 5.329 4.090
351 HD21 LEU 49 3HD2 LEU 49 1.070 5.478 0.459
352 HD22 LEU 49 1HD2 LEU 49 0.880 4.368 1.819
353 HD23 LEU 49 2HD2 LEU 49 2.188 5.552 1.821
354 H ASN 50 H ASN 50 -2.161 8.487 0.274
355 HA ASN 50 HA ASN 50 -0.293 10.478 0.992
356 HB2 ASN 50 2HB ASN 50 -0.856 9.772 -1.353
357 HB3 ASN 50 1HB ASN 50 -2.366 10.665 -1.210
358 HD21 ASN 50 1HD2 ASN 50 1.088 10.900 -1.447
359 HD22 ASN 50 2HD2 ASN 50 1.147 12.583 -1.826
360 H LYS 51 H LYS 51 -3.749 10.271 1.402
361 HA LYS 51 HA LYS 51 -4.316 12.981 1.958
362 HB2 LYS 51 2HB LYS 51 -5.615 10.462 3.019
363 HB3 LYS 51 1HB LYS 51 -6.269 12.080 3.234
364 HG2 LYS 51 2HG LYS 51 -6.505 12.319 0.814
365 HG3 LYS 51 1HG LYS 51 -5.833 10.701 0.584
366 HD2 LYS 51 2HD LYS 51 -8.281 10.688 0.449
367 HD3 LYS 51 1HD LYS 51 -7.704 9.734 1.816
368 HE2 LYS 51 2HE LYS 51 -9.645 11.094 2.426
369 HE3 LYS 51 1HE LYS 51 -8.214 11.577 3.335
370 HZ1 LYS 51 3HZ LYS 51 -9.471 13.480 2.522
371 HZ2 LYS 51 1HZ LYS 51 -9.272 12.961 0.930
372 HZ3 LYS 51 2HZ LYS 51 -7.928 13.444 1.836
373 H LEU 52 H LEU 52 -3.190 10.334 4.032
374 HA LEU 52 HA LEU 52 -3.225 11.965 6.420
375 HB2 LEU 52 2HB LEU 52 -1.957 9.254 5.988
376 HB3 LEU 52 1HB LEU 52 -2.272 10.018 7.535
377 HG LEU 52 HG LEU 52 -4.299 8.927 5.579
378 HD11 LEU 52 1HD1 LEU 52 -4.916 7.469 7.427
379 HD12 LEU 52 2HD1 LEU 52 -3.688 8.215 8.449
380 HD13 LEU 52 3HD1 LEU 52 -3.208 7.283 7.031
381 HD21 LEU 52 3HD2 LEU 52 -4.822 10.504 8.105
382 HD22 LEU 52 1HD2 LEU 52 -6.037 9.676 7.131
383 HD23 LEU 52 2HD2 LEU 52 -5.148 11.040 6.456
384 H GLN 53 H GLN 53 -0.747 10.723 4.198
385 HA GLN 53 HA GLN 53 1.159 12.662 5.356
386 HB2 GLN 53 2HB GLN 53 1.721 9.854 4.386
387 HB3 GLN 53 1HB GLN 53 2.984 11.045 4.658
388 HG2 GLN 53 2HG GLN 53 1.066 10.052 6.761
389 HG3 GLN 53 1HG GLN 53 2.711 9.463 6.524
390 HE21 GLN 53 1HE2 GLN 53 0.748 12.088 7.649
391 HE22 GLN 53 2HE2 GLN 53 2.009 12.959 8.443
392 HA PRO 54 HA PRO 54 0.730 13.713 0.848
393 HB2 PRO 54 2HB PRO 54 0.894 16.411 1.228
394 HB3 PRO 54 1HB PRO 54 -0.623 15.513 1.337
395 HG2 PRO 54 2HG PRO 54 1.196 16.417 3.548
396 HG3 PRO 54 1HG PRO 54 -0.573 16.524 3.446
397 HD2 PRO 54 2HD PRO 54 0.662 14.589 4.864
398 HD3 PRO 54 1HD PRO 54 -0.861 14.289 3.998
399 H ASP 55 H ASP 55 3.035 14.371 3.349
400 HA ASP 55 HA ASP 55 5.041 15.465 1.545
401 HB2 ASP 55 2HB ASP 55 4.742 16.293 3.882
402 HB3 ASP 55 1HB ASP 55 5.273 14.722 4.474
403 H PHE 56 H PHE 56 3.957 12.404 2.273
404 HA PHE 56 HA PHE 56 6.548 11.066 2.216
405 HB2 PHE 56 2HB PHE 56 4.708 10.287 3.708
406 HB3 PHE 56 1HB PHE 56 3.756 9.886 2.285
407 HD1 PHE 56 HD1 PHE 56 6.899 9.084 4.086
408 HD2 PHE 56 HD2 PHE 56 4.020 7.795 1.218
409 HE1 PHE 56 HE1 PHE 56 7.923 6.849 4.069
410 HE2 PHE 56 HE2 PHE 56 5.041 5.554 1.202
411 HZ PHE 56 HZ PHE 56 6.995 5.081 2.626
412 H ASP 57 H ASP 57 7.458 11.136 0.214
413 HA ASP 57 HA ASP 57 5.823 10.266 -2.087
414 HB2 ASP 57 2HB ASP 57 6.683 12.611 -2.214
415 HB3 ASP 57 1HB ASP 57 8.325 11.973 -2.180
416 H SER 58 H SER 58 6.601 8.692 -3.451
417 HA SER 58 HA SER 58 8.206 6.666 -2.403
418 HB2 SER 58 2HB SER 58 6.576 6.209 -4.131
419 HB3 SER 58 1HB SER 58 7.451 7.218 -5.282
420 HG SER 58 HG SER 58 9.055 5.729 -5.388
421 H ARG 59 H ARG 59 9.155 9.383 -4.482
422 HA ARG 59 HA ARG 59 11.668 8.294 -5.272
423 HB2 ARG 59 2HB ARG 59 10.695 11.157 -5.218
424 HB3 ARG 59 1HB ARG 59 12.238 10.665 -5.903
425 HG2 ARG 59 2HG ARG 59 9.506 9.802 -6.846
426 HG3 ARG 59 1HG ARG 59 10.576 10.955 -7.643
427 HD2 ARG 59 2HD ARG 59 11.101 8.007 -7.214
428 HD3 ARG 59 1HD ARG 59 10.696 8.788 -8.741
429 HE ARG 59 HE ARG 59 13.152 9.542 -7.317
430 HH11 ARG 59 1HH1 ARG 59 11.604 8.221 -10.098
431 HH12 ARG 59 2HH1 ARG 59 13.072 8.151 -11.013
432 HH21 ARG 59 1HH2 ARG 59 15.009 9.460 -8.487
433 HH22 ARG 59 2HH2 ARG 59 14.984 8.851 -10.108
434 H LEU 60 H LEU 60 10.638 9.813 -2.347
435 HA LEU 60 HA LEU 60 13.075 10.913 -1.455
436 HB2 LEU 60 2HB LEU 60 10.835 9.728 0.196
437 HB3 LEU 60 1HB LEU 60 12.112 10.768 0.807
438 HG LEU 60 HG LEU 60 9.969 11.557 -1.178
439 HD11 LEU 60 1HD1 LEU 60 10.387 12.385 1.695
440 HD12 LEU 60 2HD1 LEU 60 9.142 11.283 1.108
441 HD13 LEU 60 3HD1 LEU 60 9.125 12.973 0.610
442 HD21 LEU 60 3HD2 LEU 60 12.055 12.724 -1.654
443 HD22 LEU 60 1HD2 LEU 60 12.193 13.206 0.037
444 HD23 LEU 60 2HD2 LEU 60 10.873 13.830 -0.954
445 H TYR 61 H TYR 61 12.061 7.624 -1.704
446 HA TYR 61 HA TYR 61 14.361 6.753 -0.062
447 HB2 TYR 61 2HB TYR 61 11.765 5.314 -0.664
448 HB3 TYR 61 1HB TYR 61 13.117 4.607 0.218
449 HD1 TYR 61 HD1 TYR 61 10.392 7.072 0.355
450 HD2 TYR 61 HD2 TYR 61 13.616 5.300 2.499
451 HE1 TYR 61 HE1 TYR 61 9.534 8.048 2.443
452 HE2 TYR 61 HE2 TYR 61 12.763 6.263 4.595
453 HH TYR 61 HH TYR 61 9.662 7.655 4.854
454 H GLY 62 H GLY 62 13.937 7.382 -3.096
455 HA2 GLY 62 2HA GLY 62 15.142 6.737 -4.952
456 HA3 GLY 62 1HA GLY 62 15.858 5.453 -3.997
457 H TYR 63 H TYR 63 12.385 5.697 -4.288
458 HA TYR 63 HA TYR 63 12.396 3.326 -6.054
459 HB2 TYR 63 2HB TYR 63 10.422 4.193 -3.932
460 HB3 TYR 63 1HB TYR 63 10.074 2.923 -5.100
461 HD1 TYR 63 HD1 TYR 63 12.246 3.857 -2.251
462 HD2 TYR 63 HD2 TYR 63 10.987 0.735 -4.853
463 HE1 TYR 63 HE1 TYR 63 13.334 2.206 -0.788
464 HE2 TYR 63 HE2 TYR 63 12.067 -0.922 -3.403
465 HH TYR 63 HH TYR 63 13.892 -0.997 -1.733
466 H LYS 64 H LYS 64 11.009 3.230 -7.817
467 HA LYS 64 HA LYS 64 10.471 5.707 -9.102
468 HB2 LYS 64 2HB LYS 64 9.554 2.919 -9.851
469 HB3 LYS 64 1HB LYS 64 9.484 4.328 -10.900
470 HG2 LYS 64 2HG LYS 64 11.979 3.026 -9.809
471 HG3 LYS 64 1HG LYS 64 11.385 2.937 -11.469
472 HD2 LYS 64 2HD LYS 64 12.303 5.444 -10.039
473 HD3 LYS 64 1HD LYS 64 13.210 4.560 -11.265
474 HE2 LYS 64 2HE LYS 64 10.536 5.894 -11.692
475 HE3 LYS 64 1HE LYS 64 12.095 6.559 -12.174
476 HZ1 LYS 64 3HZ LYS 64 10.975 5.493 -14.024
477 HZ2 LYS 64 1HZ LYS 64 10.912 4.029 -13.180
478 HZ3 LYS 64 2HZ LYS 64 12.403 4.672 -13.644
479 H LYS 65 H LYS 65 8.327 3.313 -7.576
480 HA LYS 65 HA LYS 65 6.285 5.351 -7.234
481 HB2 LYS 65 2HB LYS 65 4.495 3.945 -8.247
482 HB3 LYS 65 1HB LYS 65 5.669 4.533 -9.415
483 HG2 LYS 65 2HG LYS 65 6.779 2.341 -9.396
484 HG3 LYS 65 1HG LYS 65 5.573 1.751 -8.250
485 HD2 LYS 65 2HD LYS 65 3.806 2.074 -9.879
486 HD3 LYS 65 1HD LYS 65 4.943 2.811 -11.012
487 HE2 LYS 65 2HE LYS 65 6.164 0.695 -11.169
488 HE3 LYS 65 1HE LYS 65 5.051 -0.040 -10.015
489 HZ1 LYS 65 3HZ LYS 65 4.560 -0.542 -12.377
490 HZ2 LYS 65 1HZ LYS 65 4.206 1.090 -12.624
491 HZ3 LYS 65 2HZ LYS 65 3.267 0.172 -11.558
492 H LEU 66 H LEU 66 4.447 4.576 -5.878
493 HA LEU 66 HA LEU 66 5.345 3.508 -3.488
494 HB2 LEU 66 2HB LEU 66 3.299 4.852 -3.739
495 HB3 LEU 66 1HB LEU 66 2.517 3.512 -4.555
496 HG LEU 66 HG LEU 66 2.711 2.167 -2.468
497 HD11 LEU 66 1HD1 LEU 66 4.645 3.320 -1.491
498 HD12 LEU 66 2HD1 LEU 66 3.283 3.261 -0.372
499 HD13 LEU 66 3HD1 LEU 66 3.655 4.757 -1.231
500 HD21 LEU 66 3HD2 LEU 66 0.955 3.371 -1.232
501 HD22 LEU 66 1HD2 LEU 66 0.644 3.337 -2.967
502 HD23 LEU 66 2HD2 LEU 66 1.263 4.805 -2.211
503 H SER 67 H SER 67 3.750 1.838 -6.169
504 HA SER 67 HA SER 67 3.310 -0.670 -5.088
505 HB2 SER 67 2HB SER 67 4.339 -0.179 -7.898
506 HB3 SER 67 1HB SER 67 3.327 -1.518 -7.351
507 HG SER 67 HG SER 67 2.001 -0.020 -8.340
508 H ASP 68 H ASP 68 6.311 0.626 -6.452
509 HA ASP 68 HA ASP 68 7.784 -1.823 -6.244
510 HB2 ASP 68 2HB ASP 68 8.234 0.033 -7.890
511 HB3 ASP 68 1HB ASP 68 8.844 0.999 -6.550
512 H LEU 69 H LEU 69 7.301 0.984 -4.205
513 HA LEU 69 HA LEU 69 9.410 0.509 -2.359
514 HB2 LEU 69 2HB LEU 69 8.424 2.695 -2.542
515 HB3 LEU 69 1HB LEU 69 6.836 2.069 -2.142
516 HG LEU 69 HG LEU 69 7.662 1.531 0.151
517 HD11 LEU 69 1HD1 LEU 69 10.033 1.300 -0.334
518 HD12 LEU 69 2HD1 LEU 69 9.767 2.510 0.921
519 HD13 LEU 69 3HD1 LEU 69 10.138 3.016 -0.727
520 HD21 LEU 69 3HD2 LEU 69 7.941 4.419 -0.693
521 HD22 LEU 69 1HD2 LEU 69 7.698 3.847 0.959
522 HD23 LEU 69 2HD2 LEU 69 6.444 3.596 -0.253
523 H VAL 70 H VAL 70 5.895 -0.103 -2.099
524 HA VAL 70 HA VAL 70 5.898 -1.122 0.492
525 HB VAL 70 HB VAL 70 4.005 -1.849 -1.751
526 HG11 VAL 70 1HG1 VAL 70 3.628 -2.057 1.240
527 HG12 VAL 70 2HG1 VAL 70 3.853 -3.411 0.131
528 HG13 VAL 70 3HG1 VAL 70 2.410 -2.405 0.012
529 HG21 VAL 70 3HG2 VAL 70 2.578 -0.071 -0.871
530 HG22 VAL 70 1HG2 VAL 70 4.142 0.570 -1.375
531 HG23 VAL 70 2HG2 VAL 70 3.800 0.327 0.338
532 H LYS 71 H LYS 71 6.033 -2.987 -2.565
533 HA LYS 71 HA LYS 71 6.023 -5.531 -1.363
534 HB2 LYS 71 2HB LYS 71 6.799 -6.374 -3.532
535 HB3 LYS 71 1HB LYS 71 5.491 -5.213 -3.709
536 HG2 LYS 71 2HG LYS 71 7.179 -3.478 -4.267
537 HG3 LYS 71 1HG LYS 71 8.424 -4.725 -4.208
538 HD2 LYS 71 2HD LYS 71 6.009 -4.903 -6.013
539 HD3 LYS 71 1HD LYS 71 7.515 -4.135 -6.508
540 HE2 LYS 71 2HE LYS 71 7.471 -6.397 -7.336
541 HE3 LYS 71 1HE LYS 71 8.702 -6.267 -6.087
542 HZ1 LYS 71 3HZ LYS 71 5.977 -7.393 -5.692
543 HZ2 LYS 71 1HZ LYS 71 7.204 -7.324 -4.526
544 HZ3 LYS 71 2HZ LYS 71 7.392 -8.296 -5.893
545 H ALA 72 H ALA 72 8.611 -3.251 -1.757
546 HA ALA 72 HA ALA 72 10.727 -5.152 -1.276
547 HB1 ALA 72 3HB ALA 72 10.781 -2.137 -1.083
548 HB2 ALA 72 1HB ALA 72 11.118 -3.076 -2.538
549 HB3 ALA 72 2HB ALA 72 12.182 -3.211 -1.137
550 H ARG 73 H ARG 73 8.749 -2.997 0.674
551 HA ARG 73 HA ARG 73 10.378 -3.434 3.060
552 HB2 ARG 73 2HB ARG 73 7.873 -1.768 2.698
553 HB3 ARG 73 1HB ARG 73 8.928 -1.760 4.107
554 HG2 ARG 73 2HG ARG 73 9.641 -0.846 1.320
555 HG3 ARG 73 1HG ARG 73 9.359 0.179 2.728
556 HD2 ARG 73 2HD ARG 73 11.305 -0.785 3.840
557 HD3 ARG 73 1HD ARG 73 11.570 -1.864 2.470
558 HE ARG 73 HE ARG 73 11.550 0.868 1.681
559 HH11 ARG 73 1HH1 ARG 73 13.529 -1.576 3.090
560 HH12 ARG 73 2HH1 ARG 73 15.007 -0.796 2.636
561 HH21 ARG 73 1HH2 ARG 73 13.453 1.833 1.065
562 HH22 ARG 73 2HH2 ARG 73 14.959 1.104 1.479
563 H THR 74 H THR 74 9.324 -5.809 2.276
564 HA THR 74 HA THR 74 6.829 -6.591 3.222
565 HB THR 74 HB THR 74 7.808 -8.897 3.420
566 HG1 THR 74 HG1 THR 74 9.964 -9.191 2.978
567 HG21 THR 74 3HG2 THR 74 8.509 -7.406 0.886
568 HG22 THR 74 1HG2 THR 74 6.918 -8.058 1.284
569 HG23 THR 74 2HG2 THR 74 8.284 -9.148 1.039
570 H ASP 75 H ASP 75 9.736 -5.945 5.038
571 HA ASP 75 HA ASP 75 9.226 -7.250 7.446
572 HB2 ASP 75 2HB ASP 75 11.330 -6.110 6.999
573 HB3 ASP 75 1HB ASP 75 10.513 -4.553 6.938
574 H LEU 76 H LEU 76 7.835 -4.294 6.157
575 HA LEU 76 HA LEU 76 6.249 -3.880 8.601
576 HB2 LEU 76 2HB LEU 76 6.702 -2.100 6.200
577 HB3 LEU 76 1HB LEU 76 5.674 -1.690 7.560
578 HG LEU 76 HG LEU 76 8.648 -2.212 7.797
579 HD11 LEU 76 1HD1 LEU 76 8.881 0.226 7.998
580 HD12 LEU 76 2HD1 LEU 76 7.167 0.417 7.624
581 HD13 LEU 76 3HD1 LEU 76 8.266 -0.246 6.413
582 HD21 LEU 76 3HD2 LEU 76 7.395 -2.601 9.862
583 HD22 LEU 76 1HD2 LEU 76 6.654 -1.004 9.731
584 HD23 LEU 76 2HD2 LEU 76 8.392 -1.155 9.998
585 H PHE 77 H PHE 77 5.905 -4.382 5.098
586 HA PHE 77 HA PHE 77 2.965 -4.547 5.431
587 HB2 PHE 77 2HB PHE 77 4.445 -3.765 2.907
588 HB3 PHE 77 1HB PHE 77 2.715 -3.645 3.210
589 HD1 PHE 77 HD1 PHE 77 2.326 -2.272 5.614
590 HD2 PHE 77 HD2 PHE 77 5.472 -1.708 2.791
591 HE1 PHE 77 HE1 PHE 77 2.649 0.028 6.425
592 HE2 PHE 77 HE2 PHE 77 5.796 0.587 3.603
593 HZ PHE 77 HZ PHE 77 4.389 1.456 5.424
594 H VAL 78 H VAL 78 2.055 -6.478 4.964
595 HA VAL 78 HA VAL 78 3.534 -8.531 3.517
596 HB VAL 78 HB VAL 78 0.729 -8.634 4.667
597 HG11 VAL 78 1HG1 VAL 78 2.540 -10.842 3.685
598 HG12 VAL 78 2HG1 VAL 78 1.046 -10.293 2.924
599 HG13 VAL 78 3HG1 VAL 78 0.994 -11.079 4.501
600 HG21 VAL 78 3HG2 VAL 78 2.422 -8.244 6.406
601 HG22 VAL 78 1HG2 VAL 78 3.309 -9.664 5.852
602 HG23 VAL 78 2HG2 VAL 78 1.699 -9.848 6.547
603 H THR 79 H THR 79 3.327 -8.859 1.365
604 HA THR 79 HA THR 79 1.127 -7.473 -0.051
605 HB THR 79 HB THR 79 2.618 -7.159 -1.946
606 HG1 THR 79 HG1 THR 79 3.885 -9.172 -1.352
607 HG21 THR 79 3HG2 THR 79 4.240 -5.613 -0.982
608 HG22 THR 79 1HG2 THR 79 4.015 -6.339 0.611
609 HG23 THR 79 2HG2 THR 79 2.691 -5.463 -0.154
610 H GLU 80 H GLU 80 -0.224 -8.683 -1.246
611 HA GLU 80 HA GLU 80 0.848 -10.973 -2.713
612 HB2 GLU 80 2HB GLU 80 -1.598 -11.145 -0.943
613 HB3 GLU 80 1HB GLU 80 -1.268 -12.290 -2.235
614 HG2 GLU 80 2HG GLU 80 0.928 -12.777 -1.094
615 HG3 GLU 80 1HG GLU 80 0.338 -11.824 0.268
616 H GLU 81 H GLU 81 0.328 -10.803 -4.802
617 HA GLU 81 HA GLU 81 -1.836 -9.039 -5.634
618 HB2 GLU 81 2HB GLU 81 0.196 -10.615 -7.234
619 HB3 GLU 81 1HB GLU 81 -1.011 -9.548 -7.941
620 HG2 GLU 81 2HG GLU 81 -0.045 -7.649 -6.763
621 HG3 GLU 81 1HG GLU 81 1.149 -8.707 -6.014
622 H ARG 82 H ARG 82 -3.835 -9.730 -5.975
623 HA ARG 82 HA ARG 82 -4.295 -12.624 -6.394
624 HB2 ARG 82 2HB ARG 82 -6.183 -10.676 -5.045
625 HB3 ARG 82 1HB ARG 82 -6.318 -12.428 -5.096
626 HG2 ARG 82 2HG ARG 82 -4.118 -10.912 -3.690
627 HG3 ARG 82 1HG ARG 82 -5.559 -11.558 -2.906
628 HD2 ARG 82 2HD ARG 82 -3.591 -13.257 -4.436
629 HD3 ARG 82 1HD ARG 82 -3.482 -12.971 -2.701
630 HE ARG 82 HE ARG 82 -5.537 -14.536 -4.092
631 HH11 ARG 82 1HH1 ARG 82 -4.199 -13.373 -1.128
632 HH12 ARG 82 2HH1 ARG 82 -5.079 -14.498 -0.157
633 HH21 ARG 82 1HH2 ARG 82 -6.627 -16.003 -2.838
634 HH22 ARG 82 2HH2 ARG 82 -6.433 -15.980 -1.117
635 H GLN 83 H GLN 83 -6.033 -13.226 -7.794
636 HA GLN 83 HA GLN 83 -6.480 -11.371 -9.965
637 HB2 GLN 83 2HB GLN 83 -6.047 -13.769 -10.387
638 HB3 GLN 83 1HB GLN 83 -7.541 -14.183 -9.557
639 HG2 GLN 83 2HG GLN 83 -8.828 -13.002 -11.259
640 HG3 GLN 83 1HG GLN 83 -7.338 -12.542 -12.081
641 HE21 GLN 83 1HE2 GLN 83 -9.612 -14.104 -13.036
642 HE22 GLN 83 2HE2 GLN 83 -8.966 -15.622 -13.543
643 H VAL 84 H VAL 84 -8.272 -10.191 -10.357
644 HA VAL 84 HA VAL 84 -10.263 -10.070 -8.237
645 HB VAL 84 HB VAL 84 -9.918 -8.299 -10.673
646 HG11 VAL 84 1HG1 VAL 84 -12.189 -8.198 -9.808
647 HG12 VAL 84 2HG1 VAL 84 -11.333 -6.702 -9.430
648 HG13 VAL 84 3HG1 VAL 84 -11.579 -7.918 -8.176
649 HG21 VAL 84 3HG2 VAL 84 -7.962 -8.206 -9.198
650 HG22 VAL 84 1HG2 VAL 84 -9.010 -7.869 -7.819
651 HG23 VAL 84 2HG2 VAL 84 -8.876 -6.697 -9.132
652 HA PRO 85 HA PRO 85 -13.127 -12.686 -10.553
653 HB2 PRO 85 2HB PRO 85 -15.337 -12.056 -9.002
654 HB3 PRO 85 1HB PRO 85 -14.152 -13.304 -8.607
655 HG2 PRO 85 2HG PRO 85 -14.334 -10.482 -7.608
656 HG3 PRO 85 1HG PRO 85 -13.953 -11.968 -6.715
657 HD2 PRO 85 2HD PRO 85 -12.019 -10.268 -7.452
658 HD3 PRO 85 1HD PRO 85 -11.759 -12.025 -7.496
659 H GLY 86 H GLY 86 -14.181 -12.216 -12.392
660 HA2 GLY 86 2HA GLY 86 -15.717 -11.124 -13.786
661 HA3 GLY 86 1HA GLY 86 -15.863 -9.838 -12.601
662 H SER 87 H SER 87 -12.834 -9.671 -12.514
663 HA SER 87 HA SER 87 -12.514 -8.039 -14.953
664 HB2 SER 87 2HB SER 87 -11.132 -7.873 -12.264
665 HB3 SER 87 1HB SER 87 -10.645 -6.930 -13.672
666 HG SER 87 HG SER 87 -12.983 -6.740 -12.116
667 H THR 88 H THR 88 -10.452 -8.051 -16.067
668 HA THR 88 HA THR 88 -9.318 -10.751 -16.128
669 HB THR 88 HB THR 88 -10.029 -9.745 -18.260
670 HG1 THR 88 HG1 THR 88 -7.232 -10.247 -17.964
671 HG21 THR 88 3HG2 THR 88 -8.743 -7.915 -19.268
672 HG22 THR 88 1HG2 THR 88 -7.795 -7.760 -17.786
673 HG23 THR 88 2HG2 THR 88 -9.522 -7.397 -17.774
674 H GLN 89 H GLN 89 -8.564 -7.966 -14.525
675 HA GLN 89 HA GLN 89 -5.650 -8.316 -14.749
676 HB2 GLN 89 2HB GLN 89 -5.459 -6.145 -13.668
677 HB3 GLN 89 1HB GLN 89 -6.536 -6.038 -15.055
678 HG2 GLN 89 2HG GLN 89 -8.476 -6.109 -13.559
679 HG3 GLN 89 1HG GLN 89 -7.398 -6.225 -12.169
680 HE21 GLN 89 1HE2 GLN 89 -8.635 -4.146 -14.665
681 HE22 GLN 89 2HE2 GLN 89 -8.086 -2.663 -13.973
682 H LYS 90 H LYS 90 -4.330 -8.386 -12.839
683 HA LYS 90 HA LYS 90 -5.713 -9.349 -10.417
684 HB2 LYS 90 2HB LYS 90 -3.571 -10.388 -9.771
685 HB3 LYS 90 1HB LYS 90 -4.158 -10.995 -11.312
686 HG2 LYS 90 2HG LYS 90 -2.554 -9.652 -12.511
687 HG3 LYS 90 1HG LYS 90 -2.036 -8.873 -11.016
688 HD2 LYS 90 2HD LYS 90 -0.437 -10.593 -11.673
689 HD3 LYS 90 1HD LYS 90 -1.238 -11.036 -10.164
690 HE2 LYS 90 2HE LYS 90 -2.771 -12.500 -11.453
691 HE3 LYS 90 1HE LYS 90 -1.880 -12.101 -12.922
692 HZ1 LYS 90 3HZ LYS 90 -1.150 -14.202 -12.007
693 HZ2 LYS 90 1HZ LYS 90 -0.764 -13.472 -10.530
694 HZ3 LYS 90 2HZ LYS 90 0.104 -13.072 -11.925
695 H ALA 91 H ALA 91 -5.408 -8.299 -8.472
696 HA ALA 91 HA ALA 91 -4.021 -5.699 -8.681
697 HB1 ALA 91 3HB ALA 91 -6.436 -5.528 -8.415
698 HB2 ALA 91 1HB ALA 91 -5.600 -4.881 -7.003
699 HB3 ALA 91 2HB ALA 91 -6.354 -6.474 -6.929
700 H LEU 92 H LEU 92 -2.698 -4.972 -7.063
701 HA LEU 92 HA LEU 92 -1.500 -6.957 -5.343
702 HB2 LEU 92 2HB LEU 92 -0.080 -5.359 -6.478
703 HB3 LEU 92 1HB LEU 92 -0.948 -4.014 -5.766
704 HG LEU 92 HG LEU 92 -0.115 -4.791 -3.507
705 HD11 LEU 92 1HD1 LEU 92 1.662 -6.552 -5.200
706 HD12 LEU 92 2HD1 LEU 92 0.410 -7.101 -4.085
707 HD13 LEU 92 3HD1 LEU 92 1.836 -6.272 -3.467
708 HD21 LEU 92 3HD2 LEU 92 0.903 -2.905 -4.676
709 HD22 LEU 92 1HD2 LEU 92 1.960 -4.006 -5.561
710 HD23 LEU 92 2HD2 LEU 92 2.126 -3.837 -3.813
711 H TYR 93 H TYR 93 -2.623 -7.510 -3.548
712 HA TYR 93 HA TYR 93 -3.942 -5.419 -1.978
713 HB2 TYR 93 2HB TYR 93 -4.077 -8.431 -1.847
714 HB3 TYR 93 1HB TYR 93 -4.789 -7.400 -0.609
715 HD1 TYR 93 HD1 TYR 93 -4.949 -8.304 -4.212
716 HD2 TYR 93 HD2 TYR 93 -6.855 -6.294 -0.973
717 HE1 TYR 93 HE1 TYR 93 -6.977 -8.036 -5.578
718 HE2 TYR 93 HE2 TYR 93 -8.885 -6.031 -2.326
719 HH TYR 93 HH TYR 93 -9.379 -7.694 -5.251
720 H LEU 94 H LEU 94 -3.386 -4.851 0.051
721 HA LEU 94 HA LEU 94 -0.783 -5.837 1.055
722 HB2 LEU 94 2HB LEU 94 -1.814 -3.002 1.255
723 HB3 LEU 94 1HB LEU 94 -0.201 -3.578 1.630
724 HG LEU 94 HG LEU 94 -1.416 -3.446 -1.139
725 HD11 LEU 94 1HD1 LEU 94 0.170 -1.641 -1.539
726 HD12 LEU 94 2HD1 LEU 94 0.709 -1.730 0.139
727 HD13 LEU 94 3HD1 LEU 94 -0.943 -1.235 -0.232
728 HD21 LEU 94 3HD2 LEU 94 1.379 -4.176 -0.274
729 HD22 LEU 94 1HD2 LEU 94 0.822 -3.986 -1.936
730 HD23 LEU 94 2HD2 LEU 94 0.171 -5.280 -0.932
731 H ARG 95 H ARG 95 -0.667 -6.252 3.257
732 HA ARG 95 HA ARG 95 -2.608 -4.949 5.018
733 HB2 ARG 95 2HB ARG 95 -3.293 -6.941 6.146
734 HB3 ARG 95 1HB ARG 95 -3.560 -7.185 4.428
735 HG2 ARG 95 2HG ARG 95 -1.512 -8.532 4.298
736 HG3 ARG 95 1HG ARG 95 -1.254 -8.293 6.029
737 HD2 ARG 95 2HD ARG 95 -3.508 -9.772 4.679
738 HD3 ARG 95 1HD ARG 95 -2.282 -10.430 5.761
739 HE ARG 95 HE ARG 95 -3.667 -8.497 7.191
740 HH11 ARG 95 1HH1 ARG 95 -4.298 -11.559 5.733
741 HH12 ARG 95 2HH1 ARG 95 -5.630 -11.901 6.780
742 HH21 ARG 95 1HH2 ARG 95 -5.407 -8.951 8.520
743 HH22 ARG 95 2HH2 ARG 95 -6.260 -10.437 8.303
744 H ALA 96 H ALA 96 -1.975 -5.017 7.295
745 HA ALA 96 HA ALA 96 0.800 -4.373 7.497
746 HB1 ALA 96 3HB ALA 96 0.298 -3.742 9.786
747 HB2 ALA 96 1HB ALA 96 -1.268 -4.548 9.689
748 HB3 ALA 96 2HB ALA 96 -0.945 -3.126 8.698
749 H LYS 97 H LYS 97 2.456 -5.384 8.582
750 HA LYS 97 HA LYS 97 2.215 -8.192 9.169
751 HB2 LYS 97 2HB LYS 97 4.293 -7.467 8.249
752 HB3 LYS 97 1HB LYS 97 4.462 -6.188 9.438
753 HG2 LYS 97 2HG LYS 97 6.012 -8.023 9.859
754 HG3 LYS 97 1HG LYS 97 4.873 -7.817 11.187
755 HD2 LYS 97 2HD LYS 97 5.166 -10.166 10.759
756 HD3 LYS 97 1HD LYS 97 3.535 -9.703 10.279
757 HE2 LYS 97 2HE LYS 97 4.164 -9.703 7.952
758 HE3 LYS 97 1HE LYS 97 5.859 -9.958 8.369
759 HZ1 LYS 97 3HZ LYS 97 4.690 -11.995 7.645
760 HZ2 LYS 97 1HZ LYS 97 3.691 -11.880 9.005
761 HZ3 LYS 97 2HZ LYS 97 5.355 -12.118 9.194
762 H LEU 98 H LEU 98 0.890 -8.582 10.860
763 HA LEU 98 HA LEU 98 1.345 -7.154 13.399
764 HB2 LEU 98 2HB LEU 98 -1.051 -8.777 12.514
765 HB3 LEU 98 1HB LEU 98 -0.905 -7.917 14.036
766 HG LEU 98 HG LEU 98 -0.980 -6.635 11.294
767 HD11 LEU 98 1HD1 LEU 98 -3.052 -6.675 13.493
768 HD12 LEU 98 2HD1 LEU 98 -3.144 -7.555 11.967
769 HD13 LEU 98 3HD1 LEU 98 -3.168 -5.793 11.968
770 HD21 LEU 98 3HD2 LEU 98 0.407 -5.347 12.819
771 HD22 LEU 98 1HD2 LEU 98 -0.860 -5.386 14.046
772 HD23 LEU 98 2HD2 LEU 98 -1.119 -4.510 12.535
773 H GLU 99 H GLU 99 2.915 -8.283 14.427
774 HA GLU 99 HA GLU 99 2.293 -11.068 15.156
775 HB2 GLU 99 2HB GLU 99 3.983 -11.175 13.414
776 HB3 GLU 99 1HB GLU 99 4.987 -10.017 14.276
777 HG2 GLU 99 2HG GLU 99 5.324 -11.614 16.079
778 HG3 GLU 99 1HG GLU 99 4.263 -12.769 15.272
779 H HIS 100 H HIS 100 4.287 -8.216 15.909
780 HA HIS 100 HA HIS 100 4.951 -9.038 18.542
781 HB2 HIS 100 2HB HIS 100 4.996 -6.316 17.224
782 HB3 HIS 100 1HB HIS 100 5.606 -6.617 18.849
783 HD1 HIS 100 HD1 HIS 100 7.856 -7.821 19.066
784 HD2 HIS 100 HD2 HIS 100 6.566 -7.445 15.137
785 HE1 HIS 100 HE1 HIS 100 9.820 -8.465 17.650
786 HE2 HIS 100 HE2 HIS 100 8.945 -8.437 15.295
787 H HIS 101 H HIS 101 1.994 -8.141 17.333
788 HA HIS 101 HA HIS 101 0.940 -8.067 20.054
789 HB2 HIS 101 2HB HIS 101 0.287 -6.031 17.922
790 HB3 HIS 101 1HB HIS 101 -0.826 -6.378 19.241
791 HD1 HIS 101 HD1 HIS 101 1.323 -3.844 18.462
792 HD2 HIS 101 HD2 HIS 101 1.045 -6.295 21.800
793 HE1 HIS 101 HE1 HIS 101 2.478 -2.599 20.309
794 HE2 HIS 101 HE2 HIS 101 2.434 -4.174 22.270
795 H HIS 102 H HIS 102 -0.001 -10.002 20.042
796 HA HIS 102 HA HIS 102 -2.043 -10.569 17.988
797 HB2 HIS 102 2HB HIS 102 0.281 -11.820 17.801
798 HB3 HIS 102 1HB HIS 102 -0.372 -12.812 19.097
799 HD1 HIS 102 HD1 HIS 102 -1.127 -14.928 18.060
800 HD2 HIS 102 HD2 HIS 102 -2.101 -11.640 15.717
801 HE1 HIS 102 HE1 HIS 102 -2.344 -15.853 16.079
802 HE2 HIS 102 HE2 HIS 102 -2.762 -13.874 14.595
803 H HIS 103 H HIS 103 -3.957 -10.723 18.995
804 HA HIS 103 HA HIS 103 -4.122 -10.643 21.831
805 HB2 HIS 103 2HB HIS 103 -6.303 -10.930 19.753
806 HB3 HIS 103 1HB HIS 103 -6.585 -10.614 21.462
807 HD1 HIS 103 HD1 HIS 103 -6.253 -8.233 22.288
808 HD2 HIS 103 HD2 HIS 103 -5.172 -8.738 18.314
809 HE1 HIS 103 HE1 HIS 103 -5.911 -5.923 21.389
810 HE2 HIS 103 HE2 HIS 103 -5.465 -6.253 18.942
811 H HIS 104 H HIS 104 -4.511 -13.260 19.526
812 HA HIS 104 HA HIS 104 -4.556 -15.186 21.702
813 HB2 HIS 104 2HB HIS 104 -6.592 -16.331 20.984
814 HB3 HIS 104 1HB HIS 104 -6.959 -14.662 21.401
815 HD1 HIS 104 HD1 HIS 104 -7.668 -13.084 19.481
816 HD2 HIS 104 HD2 HIS 104 -6.987 -17.003 18.286
817 HE1 HIS 104 HE1 HIS 104 -8.594 -13.250 17.156
818 HE2 HIS 104 HE2 HIS 104 -8.177 -15.625 16.453
819 H HIS 105 H HIS 105 -4.730 -17.515 20.685
820 HA HIS 105 HA HIS 105 -2.599 -17.890 18.895
821 HB2 HIS 105 2HB HIS 105 -3.255 -19.624 20.461
822 HB3 HIS 105 1HB HIS 105 -4.825 -19.786 19.681
823 HD1 HIS 105 HD1 HIS 105 -1.153 -20.435 18.999
824 HD2 HIS 105 HD2 HIS 105 -4.896 -21.562 17.590
825 HE1 HIS 105 HE1 HIS 105 -0.724 -22.274 17.347
826 HE2 HIS 105 HE2 HIS 105 -2.989 -22.854 16.417
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