NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
495794 |
2l4d   |
17236 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H SER 1 H SER 1 13.427 5.022 7.309
2 HA SER 1 HA SER 1 12.591 7.244 9.139
3 HB2 SER 1 HB2 SER 1 13.278 7.343 6.174
4 HB3 SER 1 HB3 SER 1 12.767 8.706 7.187
5 HG SER 1 HG SER 1 15.159 7.147 7.427
6 H GLY 2 H GLY 2 11.652 5.100 6.447
7 HA2 GLY 2 HA2 GLY 2 9.020 5.994 5.981
8 HA3 GLY 2 HA3 GLY 2 9.602 4.369 5.767
9 H GLU 3 H GLU 3 10.201 4.145 8.790
10 HA GLU 3 HA GLU 3 7.697 3.111 9.710
11 HB2 GLU 3 HB2 GLU 3 9.953 2.468 10.529
12 HB3 GLU 3 HB3 GLU 3 10.112 4.040 11.315
13 HG2 GLU 3 HG2 GLU 3 8.159 3.492 12.765
14 HG3 GLU 3 HG3 GLU 3 7.992 1.934 11.943
15 H GLN 4 H GLN 4 9.228 6.317 10.239
16 HA GLN 4 HA GLN 4 7.213 7.291 12.067
17 HB2 GLN 4 HB2 GLN 4 9.520 8.212 11.818
18 HB3 GLN 4 HB3 GLN 4 9.094 8.816 10.212
19 HG2 GLN 4 HG2 GLN 4 7.361 10.285 11.210
20 HG3 GLN 4 HG3 GLN 4 7.731 9.649 12.814
21 HE21 GLN 4 HE21 GLN 4 10.037 10.013 13.618
22 HE22 GLN 4 HE22 GLN 4 10.808 11.504 13.101
23 H ILE 5 H ILE 5 7.563 7.304 8.535
24 HA ILE 5 HA ILE 5 5.228 8.894 7.938
25 HB ILE 5 HB ILE 5 6.670 6.811 6.241
26 HG12 ILE 5 HG12 ILE 5 7.122 9.822 6.460
27 HG13 ILE 5 HG13 ILE 5 8.220 8.565 7.020
28 HG21 ILE 5 HG21 ILE 5 4.930 9.103 5.274
29 HG22 ILE 5 HG22 ILE 5 5.685 7.846 4.297
30 HG23 ILE 5 HG23 ILE 5 4.377 7.423 5.394
31 HD11 ILE 5 HD11 ILE 5 7.559 9.237 4.148
32 HD12 ILE 5 HD12 ILE 5 9.111 9.357 4.985
33 HD13 ILE 5 HD13 ILE 5 8.416 7.757 4.637
34 H PHE 6 H PHE 6 5.734 5.331 8.216
35 HA PHE 6 HA PHE 6 3.061 4.569 7.725
36 HB2 PHE 6 HB2 PHE 6 4.720 2.873 7.809
37 HB3 PHE 6 HB3 PHE 6 5.258 3.348 9.407
38 HD1 PHE 6 HD1 PHE 6 2.324 1.881 7.582
39 HD2 PHE 6 HD2 PHE 6 4.334 2.383 11.366
40 HE1 PHE 6 HE1 PHE 6 0.657 0.396 8.668
41 HE2 PHE 6 HE2 PHE 6 2.678 0.882 12.441
42 HZ PHE 6 HZ PHE 6 0.813 -0.067 11.112
43 H ARG 7 H ARG 7 4.601 5.420 10.860
44 HA ARG 7 HA ARG 7 2.284 5.044 12.447
45 HB2 ARG 7 HB2 ARG 7 4.639 5.087 13.187
46 HB3 ARG 7 HB3 ARG 7 4.708 6.830 12.910
47 HG2 ARG 7 HG2 ARG 7 3.114 7.233 14.713
48 HG3 ARG 7 HG3 ARG 7 2.766 5.500 14.847
49 HD2 ARG 7 HD2 ARG 7 4.211 6.186 16.663
50 HD3 ARG 7 HD3 ARG 7 5.082 5.081 15.603
51 HE ARG 7 HE ARG 7 5.461 8.036 15.847
52 HH11 ARG 7 HH11 ARG 7 6.741 4.931 14.621
53 HH12 ARG 7 HH12 ARG 7 8.315 5.611 14.272
54 HH21 ARG 7 HH21 ARG 7 7.505 8.854 15.380
55 HH22 ARG 7 HH22 ARG 7 8.744 7.824 14.698
56 H THR 8 H THR 8 3.013 7.744 10.365
57 HA THR 8 HA THR 8 1.015 9.473 11.768
58 HB THR 8 HB THR 8 2.275 11.386 10.680
59 HG1 THR 8 HG1 THR 8 4.324 9.512 10.315
60 HG21 THR 8 HG21 THR 8 3.941 9.607 12.518
61 HG22 THR 8 HG22 THR 8 2.716 10.786 13.032
62 HG23 THR 8 HG23 THR 8 4.184 11.341 12.213
63 H ARG 9 H ARG 9 1.448 7.953 8.710
64 HA ARG 9 HA ARG 9 -1.161 9.021 7.990
65 HB2 ARG 9 HB2 ARG 9 -0.531 9.681 5.658
66 HB3 ARG 9 HB3 ARG 9 -0.121 10.771 6.941
67 HG2 ARG 9 HG2 ARG 9 1.959 8.906 5.735
68 HG3 ARG 9 HG3 ARG 9 1.540 10.484 5.053
69 HD2 ARG 9 HD2 ARG 9 2.013 11.458 7.407
70 HD3 ARG 9 HD3 ARG 9 2.826 9.906 7.706
71 HE ARG 9 HE ARG 9 3.860 10.812 5.315
72 HH11 ARG 9 HH11 ARG 9 3.799 12.109 8.642
73 HH12 ARG 9 HH12 ARG 9 5.330 12.932 8.451
74 HH21 ARG 9 HH21 ARG 9 5.844 11.885 5.133
75 HH22 ARG 9 HH22 ARG 9 6.485 12.802 6.480
76 H CYS 10 H CYS 10 -0.520 6.472 8.821
77 HA CYS 10 HA CYS 10 -1.484 4.929 6.537
78 HB2 CYS 10 HB2 CYS 10 1.183 5.213 6.475
79 HB3 CYS 10 HB3 CYS 10 1.102 3.922 7.658
80 H SER 11 H SER 11 -0.324 4.781 9.927
81 HA SER 11 HA SER 11 -1.092 2.062 10.354
82 HB2 SER 11 HB2 SER 11 0.572 3.287 11.678
83 HB3 SER 11 HB3 SER 11 -0.714 4.277 12.396
84 HG SER 11 HG SER 11 0.080 2.248 13.548
85 H SER 12 H SER 12 -3.118 4.811 10.116
86 HA SER 12 HA SER 12 -5.329 4.178 11.751
87 HB2 SER 12 HB2 SER 12 -6.599 5.589 10.163
88 HB3 SER 12 HB3 SER 12 -5.056 6.317 10.638
89 HG SER 12 HG SER 12 -5.418 6.455 8.385
90 H CYS 13 H CYS 13 -4.319 2.497 8.853
91 HA CYS 13 HA CYS 13 -6.707 0.724 9.216
92 HB2 CYS 13 HB2 CYS 13 -5.579 1.537 6.543
93 HB3 CYS 13 HB3 CYS 13 -6.958 0.479 6.816
94 H HIS 14 H HIS 14 -3.408 0.726 9.437
95 HA HIS 14 HA HIS 14 -3.174 -2.050 8.415
96 HB2 HIS 14 2HB HIS 14 -1.602 0.344 7.468
97 HB3 HIS 14 3HB HIS 14 -0.908 -1.259 7.376
98 HD1 HIS 14 1HD HIS 14 -2.760 -3.146 6.056
99 HD2 HIS 14 2HD HIS 14 -2.606 0.966 5.327
100 HE1 HIS 14 1HE HIS 14 -3.679 -2.857 3.724
101 H THR 15 H THR 15 -1.055 -2.849 8.633
102 HA THR 15 HA THR 15 0.578 -2.279 10.998
103 HB THR 15 HB THR 15 0.449 -4.584 11.843
104 HG1 THR 15 HG1 THR 15 -1.851 -4.821 10.209
105 HG21 THR 15 HG21 THR 15 -2.311 -3.317 11.911
106 HG22 THR 15 HG22 THR 15 -0.934 -2.801 12.914
107 HG23 THR 15 HG23 THR 15 -1.599 -4.429 13.094
108 H VAL 16 H VAL 16 2.527 -3.658 11.001
109 HA VAL 16 HA VAL 16 3.096 -4.975 8.372
110 HB VAL 16 HB VAL 16 5.220 -3.508 9.969
111 HG11 VAL 16 HG11 VAL 16 5.158 -4.684 7.150
112 HG12 VAL 16 HG12 VAL 16 6.512 -3.794 7.883
113 HG13 VAL 16 HG13 VAL 16 6.038 -5.354 8.545
114 HG21 VAL 16 HG21 VAL 16 3.757 -1.784 9.105
115 HG22 VAL 16 HG22 VAL 16 5.167 -1.886 8.044
116 HG23 VAL 16 HG23 VAL 16 3.627 -2.603 7.535
117 H GLY 17 H GLY 17 2.145 -6.751 9.306
118 HA2 GLY 17 HA2 GLY 17 2.941 -8.930 9.907
119 HA3 GLY 17 HA3 GLY 17 3.777 -8.253 11.304
120 H ASN 18 H ASN 18 0.809 -6.701 11.385
121 HA ASN 18 HA ASN 18 -0.034 -8.653 13.484
122 HB2 ASN 18 HB2 ASN 18 0.454 -5.667 13.770
123 HB3 ASN 18 HB3 ASN 18 -0.189 -6.718 15.024
124 HD21 ASN 18 HD21 ASN 18 2.654 -5.376 13.883
125 HD22 ASN 18 HD22 ASN 18 3.742 -6.486 14.708
126 H THR 19 H THR 19 -1.536 -8.416 11.026
127 HA THR 19 HA THR 19 -4.176 -7.432 11.884
128 HB THR 19 HB THR 19 -5.033 -8.937 10.117
129 HG1 THR 19 HG1 THR 19 -3.814 -10.147 9.000
130 HG21 THR 19 HG21 THR 19 -4.051 -7.857 8.148
131 HG22 THR 19 HG22 THR 19 -2.823 -7.087 9.184
132 HG23 THR 19 HG23 THR 19 -4.558 -6.726 9.383
133 H GLU 20 H GLU 20 -5.963 -9.131 12.086
134 HA GLU 20 HA GLU 20 -5.207 -11.268 13.958
135 HB2 GLU 20 HB2 GLU 20 -7.908 -10.316 12.969
136 HB3 GLU 20 HB3 GLU 20 -7.648 -11.622 14.138
137 HG2 GLU 20 HG2 GLU 20 -6.403 -9.996 15.599
138 HG3 GLU 20 HG3 GLU 20 -6.835 -8.698 14.476
139 HA PRO 21 HA PRO 21 -4.704 -14.493 11.067
140 HB2 PRO 21 HB2 PRO 21 -6.431 -16.194 12.887
141 HB3 PRO 21 HB3 PRO 21 -4.878 -16.608 12.094
142 HG2 PRO 21 HG2 PRO 21 -4.875 -15.828 14.675
143 HG3 PRO 21 HG3 PRO 21 -3.671 -15.135 13.544
144 HD2 PRO 21 HD2 PRO 21 -6.269 -13.905 14.506
145 HD3 PRO 21 HD3 PRO 21 -4.646 -13.175 14.371
146 H GLY 22 H GLY 22 -5.617 -14.489 9.095
147 HA2 GLY 22 HA2 GLY 22 -7.148 -14.667 7.381
148 HA3 GLY 22 HA3 GLY 22 -8.098 -15.736 8.416
149 H GLN 23 H GLN 23 -7.447 -12.462 9.470
150 HA GLN 23 HA GLN 23 -10.177 -11.500 8.773
151 HB2 GLN 23 HB2 GLN 23 -10.251 -12.734 10.885
152 HB3 GLN 23 HB3 GLN 23 -8.971 -11.721 11.549
153 HG2 GLN 23 HG2 GLN 23 -10.453 -9.732 11.322
154 HG3 GLN 23 HG3 GLN 23 -11.723 -10.757 10.642
155 HE21 GLN 23 HE21 GLN 23 -12.241 -9.217 12.841
156 HE22 GLN 23 HE22 GLN 23 -12.415 -10.219 14.273
157 HA PRO 24 HA PRO 24 -6.743 -8.653 8.036
158 HB2 PRO 24 HB2 PRO 24 -7.470 -7.531 5.658
159 HB3 PRO 24 HB3 PRO 24 -7.024 -9.257 5.816
160 HG2 PRO 24 HG2 PRO 24 -9.814 -8.046 5.864
161 HG3 PRO 24 HG3 PRO 24 -9.214 -9.396 4.845
162 HD2 PRO 24 HD2 PRO 24 -10.540 -9.846 7.172
163 HD3 PRO 24 HD3 PRO 24 -9.186 -10.893 6.650
164 H GLY 25 H GLY 25 -9.433 -7.662 9.479
165 HA2 GLY 25 HA2 GLY 25 -10.014 -5.703 10.560
166 HA3 GLY 25 HA3 GLY 25 -8.392 -5.117 10.187
167 H ILE 26 H ILE 26 -8.705 -3.102 9.486
168 HA ILE 26 HA ILE 26 -10.769 -2.368 7.485
169 HB ILE 26 HB ILE 26 -8.614 -0.678 8.800
170 HG12 ILE 26 HG12 ILE 26 -11.598 -0.873 9.464
171 HG13 ILE 26 HG13 ILE 26 -10.302 -1.558 10.438
172 HG21 ILE 26 HG21 ILE 26 -9.915 1.244 7.953
173 HG22 ILE 26 HG22 ILE 26 -9.444 0.227 6.609
174 HG23 ILE 26 HG23 ILE 26 -11.105 0.149 7.232
175 HD11 ILE 26 HD11 ILE 26 -10.924 0.470 11.487
176 HD12 ILE 26 HD12 ILE 26 -9.342 0.749 10.728
177 HD13 ILE 26 HD13 ILE 26 -10.828 1.388 9.980
178 H GLY 27 H GLY 27 -7.350 -3.202 7.733
179 HA2 GLY 27 HA2 GLY 27 -7.202 -3.459 4.835
180 HA3 GLY 27 HA3 GLY 27 -6.107 -2.255 5.511
181 HA PRO 28 HA PRO 28 -4.932 -6.955 6.187
182 HB2 PRO 28 HB2 PRO 28 -3.726 -7.803 3.855
183 HB3 PRO 28 HB3 PRO 28 -5.485 -7.886 4.158
184 HG2 PRO 28 HG2 PRO 28 -3.953 -5.679 2.730
185 HG3 PRO 28 HG3 PRO 28 -5.382 -6.586 2.133
186 HD2 PRO 28 HD2 PRO 28 -5.721 -4.207 3.304
187 HD3 PRO 28 HD3 PRO 28 -6.819 -5.552 3.732
188 H ASP 29 H ASP 29 -2.854 -8.042 6.267
189 HA ASP 29 HA ASP 29 -0.805 -6.406 7.368
190 HB2 ASP 29 HB2 ASP 29 -1.244 -8.681 8.099
191 HB3 ASP 29 HB3 ASP 29 -0.867 -9.316 6.500
192 H LEU 30 H LEU 30 0.910 -5.462 6.583
193 HA LEU 30 HA LEU 30 1.497 -5.546 3.695
194 HB2 LEU 30 HB2 LEU 30 2.639 -3.831 5.923
195 HB3 LEU 30 HB3 LEU 30 2.850 -3.563 4.196
196 HG LEU 30 HG LEU 30 0.199 -3.375 5.714
197 HD11 LEU 30 HD11 LEU 30 1.960 -1.196 4.519
198 HD12 LEU 30 HD12 LEU 30 1.739 -1.542 6.248
199 HD13 LEU 30 HD13 LEU 30 0.375 -0.965 5.284
200 HD21 LEU 30 HD21 LEU 30 -0.634 -2.336 3.600
201 HD22 LEU 30 HD22 LEU 30 -0.222 -4.042 3.402
202 HD23 LEU 30 HD23 LEU 30 0.890 -2.789 2.800
203 H LEU 31 H LEU 31 2.825 -7.111 6.526
204 HA LEU 31 HA LEU 31 5.598 -7.017 5.689
205 HB2 LEU 31 HB2 LEU 31 4.747 -7.413 7.973
206 HB3 LEU 31 HB3 LEU 31 4.439 -9.089 7.504
207 HG LEU 31 HG LEU 31 7.169 -7.805 7.112
208 HD11 LEU 31 HD11 LEU 31 7.824 -8.647 9.323
209 HD12 LEU 31 HD12 LEU 31 6.140 -9.128 9.643
210 HD13 LEU 31 HD13 LEU 31 6.563 -7.415 9.424
211 HD21 LEU 31 HD21 LEU 31 8.009 -10.108 7.469
212 HD22 LEU 31 HD22 LEU 31 6.906 -10.062 6.104
213 HD23 LEU 31 HD23 LEU 31 6.345 -10.695 7.660
214 H GLY 32 H GLY 32 6.611 -8.107 4.318
215 HA2 GLY 32 HA2 GLY 32 7.236 -9.673 2.697
216 HA3 GLY 32 HA3 GLY 32 5.939 -10.725 3.254
217 H VAL 33 H VAL 33 4.393 -7.809 2.405
218 HA VAL 33 HA VAL 33 3.321 -9.057 0.036
219 HB VAL 33 HB VAL 33 2.151 -7.411 1.604
220 HG11 VAL 33 HG11 VAL 33 3.810 -5.507 1.333
221 HG12 VAL 33 HG12 VAL 33 3.229 -5.313 -0.332
222 HG13 VAL 33 HG13 VAL 33 2.120 -5.083 1.034
223 HG21 VAL 33 HG21 VAL 33 0.649 -6.692 -0.202
224 HG22 VAL 33 HG22 VAL 33 1.865 -7.118 -1.415
225 HG23 VAL 33 HG23 VAL 33 1.133 -8.378 -0.400
226 H THR 34 H THR 34 5.877 -6.759 0.540
227 HA THR 34 HA THR 34 6.454 -5.735 -2.030
228 HB THR 34 HB THR 34 8.844 -5.661 -0.956
229 HG1 THR 34 HG1 THR 34 9.002 -6.851 0.755
230 HG21 THR 34 HG21 THR 34 8.203 -3.907 0.607
231 HG22 THR 34 HG22 THR 34 6.505 -4.434 0.560
232 HG23 THR 34 HG23 THR 34 7.275 -3.751 -0.893
233 H ARG 35 H ARG 35 6.951 -8.925 -0.750
234 HA ARG 35 HA ARG 35 8.416 -9.740 -3.204
235 HB2 ARG 35 HB2 ARG 35 9.502 -11.499 -1.957
236 HB3 ARG 35 HB3 ARG 35 9.865 -9.899 -1.316
237 HG2 ARG 35 HG2 ARG 35 8.292 -10.231 0.544
238 HG3 ARG 35 HG3 ARG 35 7.827 -11.826 -0.102
239 HD2 ARG 35 HD2 ARG 35 10.153 -12.610 0.156
240 HD3 ARG 35 HD3 ARG 35 10.632 -11.001 0.734
241 HE ARG 35 HE ARG 35 8.490 -12.404 2.213
242 HH11 ARG 35 HH11 ARG 35 11.926 -11.479 2.100
243 HH12 ARG 35 HH12 ARG 35 12.179 -11.795 3.801
244 HH21 ARG 35 HH21 ARG 35 8.855 -12.819 4.410
245 HH22 ARG 35 HH22 ARG 35 10.439 -12.564 5.109
246 H GLN 36 H GLN 36 5.500 -9.545 -2.821
247 HA GLN 36 HA GLN 36 4.796 -12.256 -3.806
248 HB2 GLN 36 HB2 GLN 36 4.118 -12.169 -1.509
249 HB3 GLN 36 HB3 GLN 36 3.461 -10.538 -1.678
250 HG2 GLN 36 HG2 GLN 36 1.654 -11.307 -3.050
251 HG3 GLN 36 HG3 GLN 36 2.354 -12.930 -3.151
252 HE21 GLN 36 HE21 GLN 36 0.391 -13.864 -2.263
253 HE22 GLN 36 HE22 GLN 36 0.180 -13.840 -0.517
254 H ARG 37 H ARG 37 3.567 -8.871 -3.498
255 HA ARG 37 HA ARG 37 1.986 -9.136 -5.974
256 HB2 ARG 37 HB2 ARG 37 1.174 -8.026 -3.874
257 HB3 ARG 37 HB3 ARG 37 2.397 -6.798 -4.096
258 HG2 ARG 37 HG2 ARG 37 0.300 -5.909 -4.830
259 HG3 ARG 37 HG3 ARG 37 1.303 -6.123 -6.254
260 HD2 ARG 37 HD2 ARG 37 -0.919 -6.839 -6.796
261 HD3 ARG 37 HD3 ARG 37 0.080 -8.297 -6.708
262 HE ARG 37 HE ARG 37 -1.320 -7.516 -4.236
263 HH11 ARG 37 HH11 ARG 37 -1.491 -9.578 -7.142
264 HH12 ARG 37 HH12 ARG 37 -2.679 -10.648 -6.431
265 HH21 ARG 37 HH21 ARG 37 -2.843 -8.911 -3.363
266 HH22 ARG 37 HH22 ARG 37 -3.447 -10.268 -4.288
267 H ASP 38 H ASP 38 2.247 -7.631 -7.806
268 HA ASP 38 HA ASP 38 4.874 -7.426 -8.793
269 HB2 ASP 38 HB2 ASP 38 2.938 -7.454 -10.233
270 HB3 ASP 38 HB3 ASP 38 2.351 -5.926 -9.575
271 H ALA 39 H ALA 39 6.486 -6.007 -8.685
272 HA ALA 39 HA ALA 39 6.475 -4.187 -6.484
273 HB1 ALA 39 HB1 ALA 39 8.566 -4.649 -8.650
274 HB2 ALA 39 HB2 ALA 39 8.833 -3.893 -7.067
275 HB3 ALA 39 HB3 ALA 39 8.392 -5.606 -7.161
276 H ASN 40 H ASN 40 5.664 -3.602 -9.830
277 HA ASN 40 HA ASN 40 6.189 -0.692 -9.611
278 HB2 ASN 40 HB2 ASN 40 4.942 -2.355 -11.838
279 HB3 ASN 40 HB3 ASN 40 5.255 -0.635 -11.911
280 HD21 ASN 40 HD21 ASN 40 7.516 0.081 -11.917
281 HD22 ASN 40 HD22 ASN 40 8.756 -1.061 -12.426
282 H TRP 41 H TRP 41 3.481 -2.991 -9.865
283 HA TRP 41 HA TRP 41 1.324 -1.183 -9.656
284 HB2 TRP 41 HB2 TRP 41 1.207 -3.599 -10.295
285 HB3 TRP 41 HB3 TRP 41 1.481 -4.032 -8.612
286 HD1 TRP 41 HD1 TRP 41 -1.189 -2.821 -10.990
287 HE1 TRP 41 HE1 TRP 41 -3.502 -2.777 -9.830
288 HE3 TRP 41 HE3 TRP 41 0.300 -3.725 -6.174
289 HZ2 TRP 41 HZ2 TRP 41 -4.506 -2.914 -7.164
290 HZ3 TRP 41 HZ3 TRP 41 -1.365 -3.690 -4.323
291 HH2 TRP 41 HH2 TRP 41 -3.754 -3.233 -4.798
292 H LEU 42 H LEU 42 3.076 -2.881 -6.988
293 HA LEU 42 HA LEU 42 1.528 -2.002 -4.823
294 HB2 LEU 42 HB2 LEU 42 4.495 -2.562 -5.187
295 HB3 LEU 42 HB3 LEU 42 3.898 -2.017 -3.627
296 HG LEU 42 HG LEU 42 2.827 -4.508 -5.013
297 HD11 LEU 42 HD11 LEU 42 5.215 -4.763 -4.495
298 HD12 LEU 42 HD12 LEU 42 4.255 -5.719 -3.365
299 HD13 LEU 42 HD13 LEU 42 4.944 -4.165 -2.839
300 HD21 LEU 42 HD21 LEU 42 2.599 -3.437 -2.163
301 HD22 LEU 42 HD22 LEU 42 2.031 -5.030 -2.694
302 HD23 LEU 42 HD23 LEU 42 1.273 -3.579 -3.344
303 H VAL 43 H VAL 43 4.146 -0.181 -6.401
304 HA VAL 43 HA VAL 43 3.912 2.040 -4.490
305 HB VAL 43 HB VAL 43 5.598 1.842 -7.009
306 HG11 VAL 43 HG11 VAL 43 5.347 4.164 -6.154
307 HG12 VAL 43 HG12 VAL 43 5.853 3.612 -4.541
308 HG13 VAL 43 HG13 VAL 43 6.988 3.562 -5.901
309 HG21 VAL 43 HG21 VAL 43 6.251 1.079 -4.120
310 HG22 VAL 43 HG22 VAL 43 6.259 0.015 -5.542
311 HG23 VAL 43 HG23 VAL 43 7.462 1.292 -5.401
312 H ARG 44 H ARG 44 2.936 1.414 -7.887
313 HA ARG 44 HA ARG 44 1.971 4.067 -8.364
314 HB2 ARG 44 HB2 ARG 44 2.646 2.456 -10.117
315 HB3 ARG 44 HB3 ARG 44 1.282 1.424 -9.706
316 HG2 ARG 44 HG2 ARG 44 0.836 2.756 -11.719
317 HG3 ARG 44 HG3 ARG 44 -0.310 3.130 -10.439
318 HD2 ARG 44 HD2 ARG 44 0.410 5.163 -11.630
319 HD3 ARG 44 HD3 ARG 44 0.858 5.224 -9.929
320 HE ARG 44 HE ARG 44 3.092 5.203 -10.482
321 HH11 ARG 44 HH11 ARG 44 1.250 4.393 -13.432
322 HH12 ARG 44 HH12 ARG 44 2.659 4.517 -14.463
323 HH21 ARG 44 HH21 ARG 44 4.879 5.344 -11.856
324 HH22 ARG 44 HH22 ARG 44 4.706 5.053 -13.573
325 H TRP 45 H TRP 45 0.286 1.061 -7.307
326 HA TRP 45 HA TRP 45 -2.382 1.996 -7.194
327 HB2 TRP 45 HB2 TRP 45 -1.819 -0.333 -6.820
328 HB3 TRP 45 HB3 TRP 45 -0.832 0.068 -5.417
329 HD1 TRP 45 HD1 TRP 45 -1.973 0.060 -3.125
330 HE1 TRP 45 HE1 TRP 45 -4.425 -0.395 -2.303
331 HE3 TRP 45 HE3 TRP 45 -4.480 0.188 -7.589
332 HZ2 TRP 45 HZ2 TRP 45 -7.039 -0.223 -3.343
333 HZ3 TRP 45 HZ3 TRP 45 -6.976 0.052 -7.629
334 HH2 TRP 45 HH2 TRP 45 -8.255 -0.106 -5.521
335 H LEU 46 H LEU 46 0.169 2.214 -4.699
336 HA LEU 46 HA LEU 46 -1.311 3.572 -2.723
337 HB2 LEU 46 HB2 LEU 46 0.796 2.340 -2.478
338 HB3 LEU 46 HB3 LEU 46 1.650 3.547 -3.430
339 HG LEU 46 HG LEU 46 1.434 5.206 -1.673
340 HD11 LEU 46 HD11 LEU 46 0.457 4.604 0.535
341 HD12 LEU 46 HD12 LEU 46 -0.150 3.080 -0.158
342 HD13 LEU 46 HD13 LEU 46 -0.775 4.646 -0.719
343 HD21 LEU 46 HD21 LEU 46 3.239 3.494 -1.618
344 HD22 LEU 46 HD22 LEU 46 2.217 2.458 -0.608
345 HD23 LEU 46 HD23 LEU 46 2.799 4.037 0.010
346 H LYS 47 H LYS 47 -0.099 4.853 -5.702
347 HA LYS 47 HA LYS 47 -0.269 7.695 -4.834
348 HB2 LYS 47 HB2 LYS 47 0.899 6.229 -7.217
349 HB3 LYS 47 HB3 LYS 47 0.650 7.963 -7.257
350 HG2 LYS 47 HG2 LYS 47 2.141 8.337 -5.401
351 HG3 LYS 47 HG3 LYS 47 2.217 6.614 -5.021
352 HD2 LYS 47 HD2 LYS 47 4.282 7.354 -6.137
353 HD3 LYS 47 HD3 LYS 47 3.422 6.122 -7.052
354 HE2 LYS 47 HE2 LYS 47 4.149 7.667 -8.671
355 HE3 LYS 47 HE3 LYS 47 2.424 7.975 -8.479
356 HZ1 LYS 47 HZ1 LYS 47 4.689 9.615 -7.522
357 HZ2 LYS 47 HZ2 LYS 47 3.193 9.836 -6.875
358 HZ3 LYS 47 HZ3 LYS 47 3.443 10.052 -8.483
359 H VAL 48 H VAL 48 -2.411 5.418 -6.310
360 HA VAL 48 HA VAL 48 -4.371 7.522 -6.916
361 HB VAL 48 HB VAL 48 -2.785 7.563 -8.835
362 HG11 VAL 48 HG11 VAL 48 -3.824 4.845 -9.665
363 HG12 VAL 48 HG12 VAL 48 -2.698 5.899 -10.536
364 HG13 VAL 48 HG13 VAL 48 -2.206 5.163 -9.004
365 HG21 VAL 48 HG21 VAL 48 -5.162 8.248 -9.062
366 HG22 VAL 48 HG22 VAL 48 -4.316 7.808 -10.556
367 HG23 VAL 48 HG23 VAL 48 -5.462 6.670 -9.839
368 HA PRO 49 HA PRO 49 -5.503 2.953 -6.156
369 HB2 PRO 49 HB2 PRO 49 -6.583 2.892 -3.643
370 HB3 PRO 49 HB3 PRO 49 -4.825 2.837 -3.958
371 HG2 PRO 49 HG2 PRO 49 -6.504 5.265 -3.269
372 HG3 PRO 49 HG3 PRO 49 -4.967 4.740 -2.514
373 HD2 PRO 49 HD2 PRO 49 -5.021 6.626 -4.476
374 HD3 PRO 49 HD3 PRO 49 -3.711 5.444 -4.373
375 H ASP 50 H ASP 50 -7.739 5.528 -4.859
376 HA ASP 50 HA ASP 50 -10.057 3.968 -5.560
377 HB2 ASP 50 HB2 ASP 50 -11.386 5.784 -4.858
378 HB3 ASP 50 HB3 ASP 50 -10.047 5.631 -3.740
379 H GLN 51 H GLN 51 -8.093 6.163 -7.407
380 HA GLN 51 HA GLN 51 -10.042 6.312 -9.613
381 HB2 GLN 51 HB2 GLN 51 -7.361 7.557 -9.042
382 HB3 GLN 51 HB3 GLN 51 -8.075 7.641 -10.646
383 HG2 GLN 51 HG2 GLN 51 -10.164 8.613 -9.563
384 HG3 GLN 51 HG3 GLN 51 -9.304 8.629 -8.027
385 HE21 GLN 51 HE21 GLN 51 -9.463 10.910 -7.787
386 HE22 GLN 51 HE22 GLN 51 -8.569 12.011 -8.835
387 H MET 52 H MET 52 -7.205 4.321 -8.801
388 HA MET 52 HA MET 52 -7.072 3.001 -11.389
389 HB2 MET 52 HB2 MET 52 -5.286 2.922 -9.571
390 HB3 MET 52 HB3 MET 52 -6.374 1.879 -8.650
391 HG2 MET 52 HG2 MET 52 -4.865 0.432 -9.752
392 HG3 MET 52 HG3 MET 52 -6.394 0.288 -10.584
393 HE1 MET 52 HE1 MET 52 -3.145 2.582 -10.649
394 HE2 MET 52 HE2 MET 52 -2.672 0.870 -10.757
395 HE3 MET 52 HE3 MET 52 -2.399 1.958 -12.136
396 H LEU 53 H LEU 53 -8.903 2.413 -8.345
397 HA LEU 53 HA LEU 53 -10.309 0.123 -9.344
398 HB2 LEU 53 HB2 LEU 53 -10.006 0.993 -6.900
399 HB3 LEU 53 HB3 LEU 53 -11.352 2.070 -7.265
400 HG LEU 53 HG LEU 53 -12.680 -0.038 -7.912
401 HD11 LEU 53 HD11 LEU 53 -10.428 -1.434 -6.379
402 HD12 LEU 53 HD12 LEU 53 -10.727 -1.617 -8.120
403 HD13 LEU 53 HD13 LEU 53 -11.932 -2.176 -6.968
404 HD21 LEU 53 HD21 LEU 53 -13.179 -0.607 -5.563
405 HD22 LEU 53 HD22 LEU 53 -13.034 1.144 -5.789
406 HD23 LEU 53 HD23 LEU 53 -11.701 0.230 -5.038
407 H ALA 54 H ALA 54 -11.074 3.640 -9.510
408 HA ALA 54 HA ALA 54 -13.541 3.274 -10.939
409 HB1 ALA 54 HB1 ALA 54 -11.686 5.680 -10.911
410 HB2 ALA 54 HB2 ALA 54 -13.402 5.656 -11.349
411 HB3 ALA 54 HB3 ALA 54 -12.923 5.325 -9.678
412 H GLU 55 H GLU 55 -10.168 3.406 -12.116
413 HA GLU 55 HA GLU 55 -10.821 3.354 -14.928
414 HB2 GLU 55 HB2 GLU 55 -8.626 3.950 -14.255
415 HB3 GLU 55 HB3 GLU 55 -8.388 2.465 -13.339
416 HG2 GLU 55 HG2 GLU 55 -8.298 1.128 -15.341
417 HG3 GLU 55 HG3 GLU 55 -8.778 2.485 -16.348
418 H LYS 56 H LYS 56 -11.425 1.053 -12.473
419 HA LYS 56 HA LYS 56 -11.867 -1.149 -12.351
420 HB2 LYS 56 HB2 LYS 56 -13.120 -0.605 -15.061
421 HB3 LYS 56 HB3 LYS 56 -13.291 -2.132 -14.184
422 HG2 LYS 56 HG2 LYS 56 -14.272 -0.984 -12.257
423 HG3 LYS 56 HG3 LYS 56 -14.101 0.586 -13.056
424 HD2 LYS 56 HD2 LYS 56 -15.714 0.003 -14.744
425 HD3 LYS 56 HD3 LYS 56 -15.713 -1.693 -14.259
426 HE2 LYS 56 HE2 LYS 56 -17.759 -0.601 -13.513
427 HE3 LYS 56 HE3 LYS 56 -16.805 -1.177 -12.142
428 HZ1 LYS 56 HZ1 LYS 56 -16.087 1.049 -11.713
429 HZ2 LYS 56 HZ2 LYS 56 -17.704 1.070 -11.790
430 HZ3 LYS 56 HZ3 LYS 56 -16.840 1.642 -13.071
431 H ASP 57 H ASP 57 -9.390 -0.709 -12.671
432 HA ASP 57 HA ASP 57 -8.057 -2.422 -14.651
433 HB2 ASP 57 HB2 ASP 57 -7.106 -0.230 -13.731
434 HB3 ASP 57 HB3 ASP 57 -6.867 -1.070 -12.211
435 HA PRO 58 HA PRO 58 -10.032 -5.243 -12.268
436 HB2 PRO 58 HB2 PRO 58 -9.478 -7.598 -13.527
437 HB3 PRO 58 HB3 PRO 58 -10.325 -6.175 -14.239
438 HG2 PRO 58 HG2 PRO 58 -7.337 -6.690 -14.508
439 HG3 PRO 58 HG3 PRO 58 -8.548 -6.623 -15.852
440 HD2 PRO 58 HD2 PRO 58 -7.190 -4.471 -15.073
441 HD3 PRO 58 HD3 PRO 58 -8.961 -4.327 -15.320
442 H LEU 59 H LEU 59 -6.618 -5.741 -12.303
443 HA LEU 59 HA LEU 59 -6.215 -7.767 -10.402
444 HB2 LEU 59 HB2 LEU 59 -4.549 -6.193 -11.747
445 HB3 LEU 59 HB3 LEU 59 -4.577 -5.212 -10.305
446 HG LEU 59 HG LEU 59 -2.631 -6.640 -10.408
447 HD11 LEU 59 HD11 LEU 59 -4.412 -7.699 -8.194
448 HD12 LEU 59 HD12 LEU 59 -3.547 -6.142 -8.152
449 HD13 LEU 59 HD13 LEU 59 -2.650 -7.673 -8.232
450 HD21 LEU 59 HD21 LEU 59 -2.680 -9.043 -10.334
451 HD22 LEU 59 HD22 LEU 59 -3.651 -8.508 -11.714
452 HD23 LEU 59 HD23 LEU 59 -4.447 -9.074 -10.232
453 H ALA 60 H ALA 60 -6.861 -4.275 -9.683
454 HA ALA 60 HA ALA 60 -7.006 -4.686 -6.828
455 HB1 ALA 60 HB1 ALA 60 -7.991 -2.491 -6.779
456 HB2 ALA 60 HB2 ALA 60 -6.597 -2.482 -7.885
457 HB3 ALA 60 HB3 ALA 60 -8.248 -2.500 -8.539
458 H MET 61 H MET 61 -9.507 -4.590 -9.374
459 HA MET 61 HA MET 61 -11.845 -4.683 -7.762
460 HB2 MET 61 HB2 MET 61 -11.449 -6.016 -10.470
461 HB3 MET 61 HB3 MET 61 -12.964 -5.486 -9.762
462 HG2 MET 61 HG2 MET 61 -10.712 -3.598 -10.565
463 HG3 MET 61 HG3 MET 61 -12.028 -4.066 -11.625
464 HE1 MET 61 HE1 MET 61 -14.402 -3.409 -11.486
465 HE2 MET 61 HE2 MET 61 -14.663 -4.025 -9.839
466 HE3 MET 61 HE3 MET 61 -15.147 -2.365 -10.246
467 H LEU 62 H LEU 62 -9.737 -7.301 -8.895
468 HA LEU 62 HA LEU 62 -11.271 -9.513 -7.850
469 HB2 LEU 62 HB2 LEU 62 -8.379 -9.016 -8.563
470 HB3 LEU 62 HB3 LEU 62 -8.916 -10.579 -7.980
471 HG LEU 62 HG LEU 62 -10.094 -9.279 -10.481
472 HD11 LEU 62 HD11 LEU 62 -7.936 -11.418 -10.243
473 HD12 LEU 62 HD12 LEU 62 -7.688 -9.739 -10.782
474 HD13 LEU 62 HD13 LEU 62 -8.683 -10.841 -11.748
475 HD21 LEU 62 HD21 LEU 62 -11.563 -10.981 -9.469
476 HD22 LEU 62 HD22 LEU 62 -10.211 -12.132 -9.404
477 HD23 LEU 62 HD23 LEU 62 -10.855 -11.587 -10.966
478 H LEU 63 H LEU 63 -8.669 -7.439 -6.401
479 HA LEU 63 HA LEU 63 -8.362 -9.459 -4.254
480 HB2 LEU 63 HB2 LEU 63 -6.334 -8.590 -3.773
481 HB3 LEU 63 HB3 LEU 63 -6.477 -8.458 -5.512
482 HG LEU 63 HG LEU 63 -7.259 -5.971 -4.967
483 HD11 LEU 63 HD11 LEU 63 -5.435 -6.528 -2.601
484 HD12 LEU 63 HD12 LEU 63 -7.196 -6.471 -2.435
485 HD13 LEU 63 HD13 LEU 63 -6.309 -5.035 -2.985
486 HD21 LEU 63 HD21 LEU 63 -4.372 -6.910 -4.680
487 HD22 LEU 63 HD22 LEU 63 -4.902 -5.254 -5.063
488 HD23 LEU 63 HD23 LEU 63 -5.219 -6.568 -6.203
489 H PHE 64 H PHE 64 -9.772 -6.298 -4.616
490 HA PHE 64 HA PHE 64 -9.751 -5.769 -1.763
491 HB2 PHE 64 HB2 PHE 64 -10.451 -3.719 -2.192
492 HB3 PHE 64 HB3 PHE 64 -9.966 -4.102 -3.824
493 HD1 PHE 64 HD2 PHE 64 -11.762 -4.638 -5.544
494 HD2 PHE 64 HD1 PHE 64 -12.721 -3.303 -1.570
495 HE1 PHE 64 HE2 PHE 64 -14.049 -4.015 -6.305
496 HE2 PHE 64 HE1 PHE 64 -15.003 -2.668 -2.326
497 HZ PHE 64 HZ PHE 64 -15.667 -3.029 -4.701
498 H GLU 65 H GLU 65 -12.370 -6.967 -3.882
499 HA GLU 65 HA GLU 65 -14.349 -7.157 -1.848
500 HB2 GLU 65 HB2 GLU 65 -14.065 -8.913 -4.319
501 HB3 GLU 65 HB3 GLU 65 -15.506 -8.708 -3.313
502 HG2 GLU 65 HG2 GLU 65 -15.319 -6.184 -3.867
503 HG3 GLU 65 HG3 GLU 65 -14.209 -6.682 -5.147
504 H GLN 66 H GLN 66 -11.536 -9.114 -2.233
505 HA GLN 66 HA GLN 66 -12.699 -11.362 -0.712
506 HB2 GLN 66 HB2 GLN 66 -10.108 -10.936 -2.265
507 HB3 GLN 66 HB3 GLN 66 -10.330 -12.363 -1.273
508 HG2 GLN 66 HG2 GLN 66 -12.139 -11.555 -3.598
509 HG3 GLN 66 HG3 GLN 66 -10.811 -12.706 -3.688
510 HE21 GLN 66 HE21 GLN 66 -13.401 -13.421 -4.446
511 HE22 GLN 66 HE22 GLN 66 -13.951 -14.657 -3.323
512 H TYR 67 H TYR 67 -10.932 -8.572 0.092
513 HA TYR 67 HA TYR 67 -9.902 -9.870 2.579
514 HB2 TYR 67 HB2 TYR 67 -9.568 -7.081 1.444
515 HB3 TYR 67 HB3 TYR 67 -9.096 -7.520 3.078
516 HD1 TYR 67 HD2 TYR 67 -7.646 -9.838 3.208
517 HD2 TYR 67 HD1 TYR 67 -7.820 -7.130 -0.149
518 HE1 TYR 67 HE2 TYR 67 -5.409 -10.603 2.476
519 HE2 TYR 67 HE1 TYR 67 -5.554 -7.888 -0.852
520 HH TYR 67 HH TYR 67 -3.697 -9.015 -0.231
521 H ASN 68 H ASN 68 -11.859 -6.948 1.870
522 HA ASN 68 HA ASN 68 -13.825 -7.677 3.937
523 HB2 ASN 68 HB2 ASN 68 -13.296 -5.713 5.328
524 HB3 ASN 68 HB3 ASN 68 -11.912 -6.784 5.219
525 HD21 ASN 68 HD21 ASN 68 -11.119 -4.527 6.098
526 HD22 ASN 68 HD22 ASN 68 -10.472 -3.473 4.843
527 H ARG 69 H ARG 69 -13.798 -6.838 0.943
528 HA ARG 69 HA ARG 69 -14.966 -5.427 -0.464
529 HB2 ARG 69 HB2 ARG 69 -16.739 -6.471 1.662
530 HB3 ARG 69 HB3 ARG 69 -17.452 -5.116 0.847
531 HG2 ARG 69 HG2 ARG 69 -16.293 -7.517 -0.619
532 HG3 ARG 69 HG3 ARG 69 -17.972 -7.407 -0.093
533 HD2 ARG 69 HD2 ARG 69 -16.647 -5.446 -2.015
534 HD3 ARG 69 HD3 ARG 69 -17.677 -6.814 -2.467
535 HE ARG 69 HE ARG 69 -18.936 -5.032 -0.559
536 HH11 ARG 69 HH11 ARG 69 -18.385 -5.534 -4.046
537 HH12 ARG 69 HH12 ARG 69 -19.790 -4.596 -4.505
538 HH21 ARG 69 HH21 ARG 69 -20.733 -3.840 -1.189
539 HH22 ARG 69 HH22 ARG 69 -21.123 -3.634 -2.882
540 H LEU 70 H LEU 70 -13.247 -3.839 1.286
541 HA LEU 70 HA LEU 70 -14.745 -1.245 1.307
542 HB2 LEU 70 HB2 LEU 70 -14.154 -2.095 3.547
543 HB3 LEU 70 HB3 LEU 70 -12.467 -2.233 3.055
544 HG LEU 70 HG LEU 70 -12.305 0.217 2.796
545 HD11 LEU 70 HD11 LEU 70 -14.114 1.650 3.749
546 HD12 LEU 70 HD12 LEU 70 -15.154 0.218 3.882
547 HD13 LEU 70 HD13 LEU 70 -14.643 0.815 2.289
548 HD21 LEU 70 HD21 LEU 70 -12.394 0.754 5.183
549 HD22 LEU 70 HD22 LEU 70 -11.727 -0.868 4.927
550 HD23 LEU 70 HD23 LEU 70 -13.403 -0.679 5.489
551 H ALA 71 H ALA 71 -13.932 0.439 0.139
552 HA ALA 71 HA ALA 71 -11.536 0.033 -1.482
553 HB1 ALA 71 HB1 ALA 71 -12.160 2.196 -2.472
554 HB2 ALA 71 HB2 ALA 71 -13.540 1.080 -2.415
555 HB3 ALA 71 HB3 ALA 71 -13.420 2.406 -1.232
556 H MET 72 H MET 72 -9.657 1.249 -1.499
557 HA MET 72 HA MET 72 -8.917 2.744 0.957
558 HB2 MET 72 HB2 MET 72 -7.446 0.933 0.461
559 HB3 MET 72 HB3 MET 72 -7.291 1.422 -1.230
560 HG2 MET 72 HG2 MET 72 -6.041 3.377 -0.657
561 HG3 MET 72 HG3 MET 72 -6.364 3.173 1.068
562 HE1 MET 72 HE1 MET 72 -3.622 3.430 -1.007
563 HE2 MET 72 HE2 MET 72 -3.566 3.816 0.731
564 HE3 MET 72 HE3 MET 72 -2.435 2.629 0.039
565 HA PRO 73 HA PRO 73 -9.256 6.361 -1.826
566 HB2 PRO 73 HB2 PRO 73 -9.142 8.345 -0.015
567 HB3 PRO 73 HB3 PRO 73 -10.563 7.260 -0.102
568 HG2 PRO 73 HG2 PRO 73 -8.189 7.075 1.788
569 HG3 PRO 73 HG3 PRO 73 -9.933 7.005 2.196
570 HD2 PRO 73 HD2 PRO 73 -8.359 4.770 1.811
571 HD3 PRO 73 HD3 PRO 73 -10.113 4.793 1.443
572 H ASN 74 H ASN 74 -7.801 8.149 -2.476
573 HA ASN 74 HA ASN 74 -4.990 7.500 -2.141
574 HB2 ASN 74 HB2 ASN 74 -6.021 8.432 -4.236
575 HB3 ASN 74 HB3 ASN 74 -6.199 9.969 -3.453
576 HD21 ASN 74 HD21 ASN 74 -4.755 10.033 -5.696
577 HD22 ASN 74 HD22 ASN 74 -3.034 10.124 -5.325
578 H MET 75 H MET 75 -3.679 8.086 -0.541
579 HA MET 75 HA MET 75 -4.421 10.022 1.510
580 HB2 MET 75 HB2 MET 75 -1.854 8.491 0.935
581 HB3 MET 75 HB3 MET 75 -2.101 9.507 2.356
582 HG2 MET 75 HG2 MET 75 -3.691 7.024 1.614
583 HG3 MET 75 HG3 MET 75 -2.463 7.142 2.868
584 HE1 MET 75 HE1 MET 75 -4.183 9.232 5.675
585 HE2 MET 75 HE2 MET 75 -2.704 8.446 5.099
586 HE3 MET 75 HE3 MET 75 -3.240 9.980 4.371
587 H ARG 76 H ARG 76 -2.920 10.353 -1.541
588 HA ARG 76 HA ARG 76 -1.765 11.914 -2.640
589 HB2 ARG 76 HB2 ARG 76 -3.168 13.849 -0.771
590 HB3 ARG 76 HB3 ARG 76 -2.250 14.297 -2.214
591 HG2 ARG 76 HG2 ARG 76 -3.777 12.838 -3.597
592 HG3 ARG 76 HG3 ARG 76 -4.744 12.544 -2.143
593 HD2 ARG 76 HD2 ARG 76 -5.801 14.294 -3.423
594 HD3 ARG 76 HD3 ARG 76 -5.138 15.008 -1.943
595 HE ARG 76 HE ARG 76 -3.232 15.181 -4.076
596 HH11 ARG 76 HH11 ARG 76 -6.280 16.698 -3.008
597 HH12 ARG 76 HH12 ARG 76 -5.921 18.215 -3.803
598 HH21 ARG 76 HH21 ARG 76 -2.811 17.161 -5.086
599 HH22 ARG 76 HH22 ARG 76 -3.959 18.476 -4.979
600 H LEU 77 H LEU 77 -0.040 10.683 -1.581
601 HA LEU 77 HA LEU 77 1.810 12.265 0.118
602 HB2 LEU 77 HB2 LEU 77 2.102 9.492 -1.078
603 HB3 LEU 77 HB3 LEU 77 3.136 10.223 0.147
604 HG LEU 77 HG LEU 77 0.231 9.367 0.479
605 HD11 LEU 77 HD11 LEU 77 2.813 8.294 1.679
606 HD12 LEU 77 HD12 LEU 77 1.825 7.513 0.421
607 HD13 LEU 77 HD13 LEU 77 1.170 7.726 2.053
608 HD21 LEU 77 HD21 LEU 77 2.098 10.592 2.545
609 HD22 LEU 77 HD22 LEU 77 0.502 9.878 2.875
610 HD23 LEU 77 HD23 LEU 77 0.623 11.336 1.892
611 H GLY 78 H GLY 78 4.014 12.577 -0.517
612 HA2 GLY 78 HA2 GLY 78 4.431 13.262 -3.380
613 HA3 GLY 78 HA3 GLY 78 5.499 13.649 -2.037
614 H ASP 79 H ASP 79 6.341 12.525 -4.555
615 HA ASP 79 HA ASP 79 6.480 9.689 -4.581
616 HB2 ASP 79 HB2 ASP 79 8.100 11.853 -5.952
617 HB3 ASP 79 HB3 ASP 79 8.506 10.148 -6.145
618 H ALA 80 H ALA 80 8.907 11.986 -3.187
619 HA ALA 80 HA ALA 80 10.738 9.819 -2.542
620 HB1 ALA 80 HB1 ALA 80 12.020 11.584 -1.411
621 HB2 ALA 80 HB2 ALA 80 11.510 12.099 -3.027
622 HB3 ALA 80 HB3 ALA 80 10.656 12.710 -1.591
623 H GLU 81 H GLU 81 8.033 11.281 -0.862
624 HA GLU 81 HA GLU 81 8.591 10.254 1.814
625 HB2 GLU 81 HB2 GLU 81 7.262 12.158 1.790
626 HB3 GLU 81 HB3 GLU 81 6.416 11.705 0.321
627 HG2 GLU 81 HG2 GLU 81 5.096 10.049 1.515
628 HG3 GLU 81 HG3 GLU 81 5.945 10.428 3.025
629 H VAL 82 H VAL 82 6.631 9.257 -1.032
630 HA VAL 82 HA VAL 82 5.820 6.704 0.023
631 HB VAL 82 HB VAL 82 6.201 7.691 -2.825
632 HG11 VAL 82 HG11 VAL 82 5.029 5.056 -1.841
633 HG12 VAL 82 HG12 VAL 82 4.837 5.703 -3.491
634 HG13 VAL 82 HG13 VAL 82 6.441 5.266 -2.905
635 HG21 VAL 82 HG21 VAL 82 3.748 7.727 -2.840
636 HG22 VAL 82 HG22 VAL 82 3.704 7.113 -1.172
637 HG23 VAL 82 HG23 VAL 82 4.356 8.726 -1.518
638 H SER 83 H SER 83 8.736 7.554 -2.012
639 HA SER 83 HA SER 83 9.872 5.027 -2.133
640 HB2 SER 83 HB2 SER 83 11.315 7.691 -1.750
641 HB3 SER 83 HB3 SER 83 12.095 6.186 -2.248
642 HG SER 83 HG SER 83 11.350 7.770 -3.940
643 H ALA 84 H ALA 84 10.228 7.300 0.651
644 HA ALA 84 HA ALA 84 11.987 5.602 2.181
645 HB1 ALA 84 HB1 ALA 84 10.044 7.813 2.959
646 HB2 ALA 84 HB2 ALA 84 11.182 7.038 4.088
647 HB3 ALA 84 HB3 ALA 84 11.790 7.953 2.703
648 H LEU 85 H LEU 85 8.397 5.867 2.082
649 HA LEU 85 HA LEU 85 7.966 3.906 4.135
650 HB2 LEU 85 HB2 LEU 85 6.383 5.689 3.460
651 HB3 LEU 85 HB3 LEU 85 6.144 4.890 1.908
652 HG LEU 85 HG LEU 85 5.157 2.924 3.048
653 HD11 LEU 85 HD11 LEU 85 5.472 4.573 5.599
654 HD12 LEU 85 HD12 LEU 85 6.296 3.043 5.240
655 HD13 LEU 85 HD13 LEU 85 4.543 3.064 5.438
656 HD21 LEU 85 HD21 LEU 85 3.709 4.759 2.324
657 HD22 LEU 85 HD22 LEU 85 3.962 5.604 3.865
658 HD23 LEU 85 HD23 LEU 85 3.111 4.051 3.844
659 H ILE 86 H ILE 86 8.400 3.603 0.630
660 HA ILE 86 HA ILE 86 7.748 0.794 0.369
661 HB ILE 86 HB ILE 86 9.831 2.309 -1.234
662 HG12 ILE 86 HG12 ILE 86 7.976 3.567 -1.807
663 HG13 ILE 86 HG13 ILE 86 7.963 2.341 -3.013
664 HG21 ILE 86 HG21 ILE 86 8.242 -0.212 -1.864
665 HG22 ILE 86 HG22 ILE 86 9.419 0.590 -2.927
666 HG23 ILE 86 HG23 ILE 86 9.960 -0.154 -1.428
667 HD11 ILE 86 HD11 ILE 86 6.196 1.099 -1.650
668 HD12 ILE 86 HD12 ILE 86 6.134 2.523 -0.583
669 HD13 ILE 86 HD13 ILE 86 5.702 2.679 -2.286
670 H SER 87 H SER 87 10.756 2.581 1.170
671 HA SER 87 HA SER 87 12.344 0.219 1.593
672 HB2 SER 87 HB2 SER 87 13.029 2.746 1.187
673 HB3 SER 87 HB3 SER 87 13.054 2.805 2.953
674 HG SER 87 HG SER 87 14.659 1.231 2.964
675 H TYR 88 H TYR 88 10.114 1.980 3.785
676 HA TYR 88 HA TYR 88 11.067 0.513 6.135
677 HB2 TYR 88 HB2 TYR 88 9.903 2.442 6.594
678 HB3 TYR 88 HB3 TYR 88 8.534 2.028 5.554
679 HD1 TYR 88 HD1 TYR 88 10.382 0.663 8.562
680 HD2 TYR 88 HD2 TYR 88 6.579 1.310 6.640
681 HE1 TYR 88 HE1 TYR 88 9.214 -0.273 10.546
682 HE2 TYR 88 HE2 TYR 88 5.417 0.386 8.637
683 HH TYR 88 HH TYR 88 7.180 -0.686 11.546
684 H LEU 89 H LEU 89 8.334 -0.109 3.842
685 HA LEU 89 HA LEU 89 7.579 -2.597 5.056
686 HB2 LEU 89 HB2 LEU 89 7.165 -1.261 2.387
687 HB3 LEU 89 HB3 LEU 89 6.872 -2.991 2.492
688 HG LEU 89 HG LEU 89 5.200 -2.751 4.185
689 HD11 LEU 89 HD11 LEU 89 4.353 -0.541 4.927
690 HD12 LEU 89 HD12 LEU 89 5.729 0.247 4.120
691 HD13 LEU 89 HD13 LEU 89 5.990 -0.854 5.496
692 HD21 LEU 89 HD21 LEU 89 3.512 -1.522 2.868
693 HD22 LEU 89 HD22 LEU 89 4.555 -2.492 1.819
694 HD23 LEU 89 HD23 LEU 89 4.803 -0.733 1.935
695 H GLU 90 H GLU 90 9.909 -1.980 2.389
696 HA GLU 90 HA GLU 90 10.719 -4.674 2.022
697 HB2 GLU 90 HB2 GLU 90 11.097 -2.814 0.446
698 HB3 GLU 90 HB3 GLU 90 12.240 -2.073 1.578
699 HG2 GLU 90 HG2 GLU 90 13.747 -4.008 1.356
700 HG3 GLU 90 HG3 GLU 90 12.567 -4.827 0.325
701 H GLU 91 H GLU 91 12.323 -2.142 4.114
702 HA GLU 91 HA GLU 91 14.325 -4.098 4.945
703 HB2 GLU 91 HB2 GLU 91 13.814 -1.267 5.919
704 HB3 GLU 91 HB3 GLU 91 15.164 -2.295 6.397
705 HG2 GLU 91 HG2 GLU 91 15.964 -2.453 4.097
706 HG3 GLU 91 HG3 GLU 91 14.607 -1.482 3.520
707 H GLU 92 H GLU 92 11.299 -2.888 6.459
708 HA GLU 92 HA GLU 92 11.873 -4.246 8.987
709 HB2 GLU 92 HB2 GLU 92 10.212 -2.304 8.599
710 HB3 GLU 92 HB3 GLU 92 9.134 -3.533 7.932
711 HG2 GLU 92 HG2 GLU 92 8.457 -3.354 10.146
712 HG3 GLU 92 HG3 GLU 92 9.472 -4.789 10.180
713 H THR 93 H THR 93 10.168 -5.194 5.930
714 HA THR 93 HA THR 93 9.546 -7.875 6.762
715 HB THR 93 HB THR 93 10.274 -6.789 4.016
716 HG1 THR 93 HG1 THR 93 8.421 -5.983 4.496
717 HG21 THR 93 HG21 THR 93 9.195 -8.772 3.084
718 HG22 THR 93 HG22 THR 93 9.026 -9.479 4.717
719 HG23 THR 93 HG23 THR 93 10.632 -9.225 3.989
720 H ALA 94 H ALA 94 12.603 -6.509 5.403
721 HA ALA 94 HA ALA 94 13.972 -8.983 5.265
722 HB1 ALA 94 HB1 ALA 94 15.138 -6.201 5.694
723 HB2 ALA 94 HB2 ALA 94 15.985 -7.613 5.050
724 HB3 ALA 94 HB3 ALA 94 14.665 -6.886 4.123
725 H ARG 95 H ARG 95 13.313 -7.055 8.121
726 HA ARG 95 HA ARG 95 15.260 -8.648 9.742
727 HB2 ARG 95 HB2 ARG 95 13.866 -6.030 10.362
728 HB3 ARG 95 HB3 ARG 95 14.928 -6.915 11.467
729 HG2 ARG 95 HG2 ARG 95 16.740 -6.762 9.650
730 HG3 ARG 95 HG3 ARG 95 15.695 -5.587 8.840
731 HD2 ARG 95 HD2 ARG 95 16.886 -5.391 11.631
732 HD3 ARG 95 HD3 ARG 95 17.355 -4.439 10.218
733 HE ARG 95 HE ARG 95 14.863 -3.649 10.312
734 HH11 ARG 95 HH11 ARG 95 16.925 -4.228 13.167
735 HH12 ARG 95 HH12 ARG 95 16.040 -3.092 14.162
736 HH21 ARG 95 HH21 ARG 95 13.754 -2.195 11.634
737 HH22 ARG 95 HH22 ARG 95 14.249 -1.943 13.293
738 H LEU 96 H LEU 96 11.793 -7.823 9.650
739 HA LEU 96 HA LEU 96 11.293 -9.340 12.139
740 HB2 LEU 96 HB2 LEU 96 9.661 -7.328 10.568
741 HB3 LEU 96 HB3 LEU 96 8.958 -8.298 11.789
742 HG LEU 96 HG LEU 96 9.465 -6.019 12.476
743 HD11 LEU 96 HD11 LEU 96 9.073 -7.844 14.018
744 HD12 LEU 96 HD12 LEU 96 10.248 -6.691 14.688
745 HD13 LEU 96 HD13 LEU 96 10.802 -8.255 14.031
746 HD21 LEU 96 HD21 LEU 96 11.651 -5.862 11.357
747 HD22 LEU 96 HD22 LEU 96 12.313 -6.997 12.571
748 HD23 LEU 96 HD23 LEU 96 11.705 -5.401 13.079
749 H GLN 97 H GLN 97 11.446 -10.284 9.003
750 HA GLN 97 HA GLN 97 9.234 -11.984 8.595
751 HB2 GLN 97 HB2 GLN 97 10.904 -13.348 7.268
752 HB3 GLN 97 HB3 GLN 97 10.744 -11.653 6.826
753 HG2 GLN 97 HG2 GLN 97 12.866 -11.107 7.957
754 HG3 GLN 97 HG3 GLN 97 12.991 -12.737 8.591
755 HE21 GLN 97 HE21 GLN 97 15.186 -12.383 7.448
756 HE22 GLN 97 HE22 GLN 97 15.234 -12.875 5.751
757 H THR 98 H THR 98 11.773 -12.366 10.938
758 HA THR 98 HA THR 98 12.435 -14.076 12.308
759 HB THR 98 HB THR 98 9.463 -14.002 12.892
760 HG1 THR 98 HG1 THR 98 9.844 -12.158 13.960
761 HG21 THR 98 HG21 THR 98 10.298 -13.983 15.281
762 HG22 THR 98 HG22 THR 98 11.930 -14.334 14.671
763 HG23 THR 98 HG23 THR 98 10.604 -15.501 14.451
764 HA PRO 99 HA PRO 99 10.915 -17.905 10.032
765 HB2 PRO 99 HB2 PRO 99 12.901 -18.500 8.313
766 HB3 PRO 99 HB3 PRO 99 11.782 -17.148 7.977
767 HG2 PRO 99 HG2 PRO 99 14.495 -16.972 9.354
768 HG3 PRO 99 HG3 PRO 99 13.965 -16.084 7.883
769 HD2 PRO 99 HD2 PRO 99 13.756 -14.976 10.359
770 HD3 PRO 99 HD3 PRO 99 12.484 -14.762 9.115
771 H VAL 100 H VAL 100 12.155 -17.523 12.625
772 HA VAL 100 HA VAL 100 14.453 -19.329 12.865
773 HB VAL 100 HB VAL 100 14.220 -17.026 13.865
774 HG11 VAL 100 HG11 VAL 100 11.910 -17.356 14.815
775 HG12 VAL 100 HG12 VAL 100 12.637 -18.373 16.074
776 HG13 VAL 100 HG13 VAL 100 13.101 -16.674 15.931
777 HG21 VAL 100 HG21 VAL 100 16.028 -18.521 14.497
778 HG22 VAL 100 HG22 VAL 100 15.496 -17.517 15.856
779 HG23 VAL 100 HG23 VAL 100 15.022 -19.222 15.784
780 H THR 101 H THR 101 11.802 -20.414 12.199
781 HA THR 101 HA THR 101 10.208 -21.890 12.702
782 HB THR 101 HB THR 101 11.977 -23.349 14.646
783 HG1 THR 101 HG1 THR 101 12.168 -23.331 11.827
784 HG21 THR 101 HG21 THR 101 11.069 -25.333 13.423
785 HG22 THR 101 HG22 THR 101 10.125 -24.258 12.376
786 HG23 THR 101 HG23 THR 101 9.761 -24.372 14.104
787 H ASN 102 H ASN 102 10.437 -19.481 14.414
788 HA ASN 102 HA ASN 102 8.257 -20.080 16.213
789 HB2 ASN 102 HB2 ASN 102 10.121 -20.859 17.643
790 HB3 ASN 102 HB3 ASN 102 10.934 -19.305 17.441
791 HD21 ASN 102 HD21 ASN 102 10.867 -18.649 19.579
792 HD22 ASN 102 HD22 ASN 102 9.361 -18.214 20.376
793 H ARG 103 H ARG 103 7.417 -18.551 14.675
794 HA ARG 103 HA ARG 103 8.139 -15.681 15.068
795 HB2 ARG 103 HB2 ARG 103 7.927 -16.551 12.788
796 HB3 ARG 103 HB3 ARG 103 6.265 -17.056 13.105
797 HG2 ARG 103 HG2 ARG 103 5.535 -14.759 13.343
798 HG3 ARG 103 HG3 ARG 103 7.204 -14.160 13.306
799 HD2 ARG 103 HD2 ARG 103 7.442 -14.873 10.980
800 HD3 ARG 103 HD3 ARG 103 5.835 -15.629 11.014
801 HE ARG 103 HE ARG 103 5.513 -12.939 11.775
802 HH11 ARG 103 HH11 ARG 103 6.466 -14.720 8.837
803 HH12 ARG 103 HH12 ARG 103 5.780 -13.520 7.765
804 HH21 ARG 103 HH21 ARG 103 4.632 -11.422 10.358
805 HH22 ARG 103 HH22 ARG 103 4.743 -11.652 8.628
806 H GLY 104 H GLY 104 5.735 -18.020 16.060
807 HA2 GLY 104 HA2 GLY 104 3.527 -16.317 16.584
808 HA3 GLY 104 HA3 GLY 104 3.847 -17.865 17.364
809 H ILE 105 H ILE 105 2.588 -15.857 18.704
810 HA ILE 105 HA ILE 105 4.580 -14.825 20.678
811 HB ILE 105 HB ILE 105 1.977 -13.580 19.757
812 HG12 ILE 105 HG12 ILE 105 4.890 -12.661 19.525
813 HG13 ILE 105 HG13 ILE 105 3.929 -13.318 18.203
814 HG21 ILE 105 HG21 ILE 105 3.947 -12.634 21.890
815 HG22 ILE 105 HG22 ILE 105 2.507 -11.758 21.335
816 HG23 ILE 105 HG23 ILE 105 2.315 -13.260 22.211
817 HD11 ILE 105 HD11 ILE 105 3.448 -10.674 19.611
818 HD12 ILE 105 HD12 ILE 105 3.982 -10.953 17.950
819 HD13 ILE 105 HD13 ILE 105 2.335 -11.407 18.424
820 HA PRO 106 HA PRO 106 2.257 -17.756 23.153
821 HB2 PRO 106 HB2 PRO 106 3.720 -17.767 25.427
822 HB3 PRO 106 HB3 PRO 106 4.323 -18.409 23.873
823 HG2 PRO 106 HG2 PRO 106 4.874 -15.680 25.077
824 HG3 PRO 106 HG3 PRO 106 6.042 -16.845 24.378
825 HD2 PRO 106 HD2 PRO 106 4.990 -14.740 22.962
826 HD3 PRO 106 HD3 PRO 106 5.426 -16.295 22.197
827 HHA HEC 107 HHA HEC 107 -4.737 -3.849 0.263
828 HHB HEC 107 HHB HEC 107 0.510 -0.221 0.979
829 HHC HEC 107 HHC HEC 107 -3.033 4.182 4.166
830 HHD HEC 107 HHD HEC 107 -8.206 0.418 3.629
831 HMA1 HEC 107 HMA1 HEC 107 1.119 -2.388 0.361
832 HMA2 HEC 107 HMA2 HEC 107 0.432 -3.713 -0.575
833 HMA3 HEC 107 HMA3 HEC 107 0.536 -2.092 -1.296
834 HAA1 HEC 107 HAA1 HEC 107 -3.253 -4.184 -1.526
835 HAA2 HEC 107 HAA2 HEC 107 -1.530 -4.183 -1.756
836 HBA1 HEC 107 HBA1 HEC 107 -1.311 -5.653 0.311
837 HBA2 HEC 107 HBA2 HEC 107 -3.071 -5.759 0.347
838 HMB1 HEC 107 HMB1 HEC 107 1.953 1.920 3.297
839 HMB2 HEC 107 HMB2 HEC 107 1.872 1.293 1.652
840 HMB3 HEC 107 HMB3 HEC 107 1.829 3.021 1.920
841 HAB HEC 107 HAB HEC 107 -1.109 4.491 4.588
842 HBB1 HEC 107 HBB1 HEC 107 0.938 5.840 4.291
843 HBB2 HEC 107 HBB2 HEC 107 1.269 4.898 2.832
844 HBB3 HEC 107 HBB3 HEC 107 -0.217 5.835 2.961
845 HMC1 HEC 107 HMC1 HEC 107 -4.569 4.686 5.912
846 HMC2 HEC 107 HMC2 HEC 107 -5.302 5.495 4.507
847 HMC3 HEC 107 HMC3 HEC 107 -6.300 4.930 5.847
848 HAC HEC 107 HAC HEC 107 -8.529 1.810 5.134
849 HBC1 HEC 107 HBC1 HEC 107 -9.721 3.904 5.318
850 HBC2 HEC 107 HBC2 HEC 107 -8.278 4.814 4.850
851 HBC3 HEC 107 HBC3 HEC 107 -9.036 3.689 3.708
852 HMD1 HEC 107 HMD1 HEC 107 -9.580 -2.811 2.264
853 HMD2 HEC 107 HMD2 HEC 107 -9.536 -1.287 3.146
854 HMD3 HEC 107 HMD3 HEC 107 -9.582 -1.273 1.383
855 HAD1 HEC 107 HAD1 HEC 107 -6.903 -4.364 0.026
856 HAD2 HEC 107 HAD2 HEC 107 -8.517 -3.804 0.426
857 HBD1 HEC 107 HBD1 HEC 107 -7.895 -3.248 -1.921
858 HBD2 HEC 107 HBD2 HEC 107 -8.234 -1.801 -0.966
Start of MODEL 2
1 H SER 1 H SER 1 14.329 5.020 9.737
2 HA SER 1 HA SER 1 13.169 6.665 7.763
3 HB2 SER 1 HB2 SER 1 14.510 3.969 7.337
4 HB3 SER 1 HB3 SER 1 14.229 5.214 6.111
5 HG SER 1 HG SER 1 16.296 5.487 6.784
6 H GLY 2 H GLY 2 11.260 6.632 6.797
7 HA2 GLY 2 HA2 GLY 2 9.270 6.016 5.879
8 HA3 GLY 2 HA3 GLY 2 9.862 4.388 5.761
9 H GLU 3 H GLU 3 10.145 4.153 8.786
10 HA GLU 3 HA GLU 3 7.605 3.085 9.399
11 HB2 GLU 3 HB2 GLU 3 9.781 2.492 10.494
12 HB3 GLU 3 HB3 GLU 3 9.729 4.034 11.366
13 HG2 GLU 3 HG2 GLU 3 7.454 3.300 12.296
14 HG3 GLU 3 HG3 GLU 3 7.744 1.723 11.569
15 H GLN 4 H GLN 4 8.958 6.286 10.362
16 HA GLN 4 HA GLN 4 6.546 6.919 11.838
17 HB2 GLN 4 HB2 GLN 4 8.830 8.763 11.117
18 HB3 GLN 4 HB3 GLN 4 7.511 9.082 12.257
19 HG2 GLN 4 HG2 GLN 4 8.194 6.948 13.494
20 HG3 GLN 4 HG3 GLN 4 9.632 6.891 12.478
21 HE21 GLN 4 HE21 GLN 4 10.320 6.841 14.932
22 HE22 GLN 4 HE22 GLN 4 10.761 8.442 15.551
23 H ILE 5 H ILE 5 7.360 7.194 8.501
24 HA ILE 5 HA ILE 5 5.105 8.933 7.741
25 HB ILE 5 HB ILE 5 6.605 6.865 6.088
26 HG12 ILE 5 HG12 ILE 5 7.036 9.881 6.309
27 HG13 ILE 5 HG13 ILE 5 8.118 8.644 6.961
28 HG21 ILE 5 HG21 ILE 5 4.823 9.182 5.222
29 HG22 ILE 5 HG22 ILE 5 5.629 8.000 4.164
30 HG23 ILE 5 HG23 ILE 5 4.332 7.474 5.220
31 HD11 ILE 5 HD11 ILE 5 8.453 7.757 4.642
32 HD12 ILE 5 HD12 ILE 5 7.553 9.162 4.036
33 HD13 ILE 5 HD13 ILE 5 9.065 9.403 4.916
34 H PHE 6 H PHE 6 5.613 5.304 7.873
35 HA PHE 6 HA PHE 6 2.919 4.641 7.285
36 HB2 PHE 6 HB2 PHE 6 4.466 2.860 7.342
37 HB3 PHE 6 HB3 PHE 6 5.062 3.280 8.929
38 HD1 PHE 6 HD1 PHE 6 2.026 1.990 7.156
39 HD2 PHE 6 HD2 PHE 6 4.133 2.336 10.905
40 HE1 PHE 6 HE1 PHE 6 0.332 0.542 8.250
41 HE2 PHE 6 HE2 PHE 6 2.446 0.877 11.988
42 HZ PHE 6 HZ PHE 6 0.529 0.008 10.676
43 H ARG 7 H ARG 7 4.332 5.218 10.518
44 HA ARG 7 HA ARG 7 2.048 4.922 12.113
45 HB2 ARG 7 HB2 ARG 7 4.355 5.019 12.909
46 HB3 ARG 7 HB3 ARG 7 4.473 6.722 12.442
47 HG2 ARG 7 HG2 ARG 7 2.853 7.368 14.137
48 HG3 ARG 7 HG3 ARG 7 2.570 5.668 14.571
49 HD2 ARG 7 HD2 ARG 7 4.846 5.448 15.404
50 HD3 ARG 7 HD3 ARG 7 5.295 7.022 14.729
51 HE ARG 7 HE ARG 7 4.385 8.103 16.516
52 HH11 ARG 7 HH11 ARG 7 3.226 4.728 16.664
53 HH12 ARG 7 HH12 ARG 7 2.527 4.940 18.254
54 HH21 ARG 7 HH21 ARG 7 3.470 8.322 18.560
55 HH22 ARG 7 HH22 ARG 7 2.665 6.969 19.325
56 H THR 8 H THR 8 2.940 7.782 10.184
57 HA THR 8 HA THR 8 0.768 9.400 11.445
58 HB THR 8 HB THR 8 1.778 11.262 10.157
59 HG1 THR 8 HG1 THR 8 4.043 9.672 9.798
60 HG21 THR 8 HG21 THR 8 3.823 11.472 11.521
61 HG22 THR 8 HG22 THR 8 3.659 9.781 12.038
62 HG23 THR 8 HG23 THR 8 2.418 10.968 12.477
63 H ARG 9 H ARG 9 1.661 8.069 8.282
64 HA ARG 9 HA ARG 9 -0.550 9.413 6.974
65 HB2 ARG 9 HB2 ARG 9 2.001 9.474 6.444
66 HB3 ARG 9 HB3 ARG 9 1.748 7.896 5.715
67 HG2 ARG 9 HG2 ARG 9 1.776 9.656 4.057
68 HG3 ARG 9 HG3 ARG 9 0.174 8.912 4.075
69 HD2 ARG 9 HD2 ARG 9 -0.846 10.805 4.954
70 HD3 ARG 9 HD3 ARG 9 0.604 11.316 5.835
71 HE ARG 9 HE ARG 9 1.375 11.632 3.247
72 HH11 ARG 9 HH11 ARG 9 -1.442 12.834 5.068
73 HH12 ARG 9 HH12 ARG 9 -1.463 14.368 4.227
74 HH21 ARG 9 HH21 ARG 9 1.322 13.649 2.199
75 HH22 ARG 9 HH22 ARG 9 0.096 14.827 2.606
76 H CYS 10 H CYS 10 0.160 6.140 7.920
77 HA CYS 10 HA CYS 10 -2.018 5.105 6.132
78 HB2 CYS 10 HB2 CYS 10 0.757 3.944 6.521
79 HB3 CYS 10 HB3 CYS 10 -0.538 3.144 5.646
80 H SER 11 H SER 11 -0.850 5.030 9.354
81 HA SER 11 HA SER 11 -1.221 2.211 9.831
82 HB2 SER 11 HB2 SER 11 0.518 3.610 10.856
83 HB3 SER 11 HB3 SER 11 -0.720 4.484 11.774
84 HG SER 11 HG SER 11 0.261 2.890 12.984
85 H SER 12 H SER 12 -3.543 4.816 10.053
86 HA SER 12 HA SER 12 -5.038 3.862 12.289
87 HB2 SER 12 HB2 SER 12 -5.965 5.589 9.972
88 HB3 SER 12 HB3 SER 12 -6.803 5.384 11.520
89 HG SER 12 HG SER 12 -5.451 7.267 11.406
90 H CYS 13 H CYS 13 -4.804 2.404 9.270
91 HA CYS 13 HA CYS 13 -7.125 0.616 9.873
92 HB2 CYS 13 HB2 CYS 13 -6.138 1.332 7.119
93 HB3 CYS 13 HB3 CYS 13 -7.551 0.358 7.513
94 H HIS 14 H HIS 14 -3.894 0.604 10.073
95 HA HIS 14 HA HIS 14 -3.515 -2.098 8.930
96 HB2 HIS 14 2HB HIS 14 -2.097 0.427 8.055
97 HB3 HIS 14 3HB HIS 14 -1.324 -1.134 7.871
98 HD1 HIS 14 1HD HIS 14 -3.524 -2.975 6.762
99 HD2 HIS 14 2HD HIS 14 -2.801 1.017 5.723
100 HE1 HIS 14 1HE HIS 14 -4.461 -2.727 4.442
101 H THR 15 H THR 15 -1.273 -2.744 9.095
102 HA THR 15 HA THR 15 0.255 -2.116 11.520
103 HB THR 15 HB THR 15 0.300 -4.566 12.195
104 HG1 THR 15 HG1 THR 15 -0.624 -5.679 10.681
105 HG21 THR 15 HG21 THR 15 -1.781 -4.514 13.500
106 HG22 THR 15 HG22 THR 15 -2.373 -3.151 12.551
107 HG23 THR 15 HG23 THR 15 -0.931 -2.959 13.572
108 H VAL 16 H VAL 16 2.383 -2.848 11.363
109 HA VAL 16 HA VAL 16 3.118 -4.495 8.962
110 HB VAL 16 HB VAL 16 5.044 -2.595 10.345
111 HG11 VAL 16 HG11 VAL 16 5.076 -4.004 7.631
112 HG12 VAL 16 HG12 VAL 16 6.368 -2.991 8.312
113 HG13 VAL 16 HG13 VAL 16 5.977 -4.536 9.071
114 HG21 VAL 16 HG21 VAL 16 3.434 -1.117 9.374
115 HG22 VAL 16 HG22 VAL 16 4.799 -1.195 8.252
116 HG23 VAL 16 HG23 VAL 16 3.319 -2.095 7.904
117 H GLY 17 H GLY 17 2.591 -6.325 10.060
118 HA2 GLY 17 HA2 GLY 17 3.313 -8.272 11.135
119 HA3 GLY 17 HA3 GLY 17 4.716 -7.409 11.777
120 H ASN 18 H ASN 18 2.826 -5.333 13.025
121 HA ASN 18 HA ASN 18 2.316 -6.677 15.537
122 HB2 ASN 18 HB2 ASN 18 1.538 -3.862 14.680
123 HB3 ASN 18 HB3 ASN 18 1.530 -4.495 16.317
124 HD21 ASN 18 HD21 ASN 18 2.892 -2.718 16.934
125 HD22 ASN 18 HD22 ASN 18 4.601 -2.726 16.482
126 H THR 19 H THR 19 0.854 -7.906 13.471
127 HA THR 19 HA THR 19 -1.688 -6.974 12.847
128 HB THR 19 HB THR 19 -1.035 -9.923 12.986
129 HG1 THR 19 HG1 THR 19 0.104 -8.013 11.210
130 HG21 THR 19 HG21 THR 19 -2.064 -9.877 10.687
131 HG22 THR 19 HG22 THR 19 -2.482 -8.167 10.962
132 HG23 THR 19 HG23 THR 19 -3.177 -9.438 11.982
133 H GLU 20 H GLU 20 -3.812 -7.520 13.439
134 HA GLU 20 HA GLU 20 -4.264 -8.225 16.232
135 HB2 GLU 20 HB2 GLU 20 -6.187 -7.844 13.919
136 HB3 GLU 20 HB3 GLU 20 -6.648 -8.050 15.606
137 HG2 GLU 20 HG2 GLU 20 -4.913 -5.737 14.636
138 HG3 GLU 20 HG3 GLU 20 -6.667 -5.682 14.758
139 HA PRO 21 HA PRO 21 -4.682 -12.650 15.602
140 HB2 PRO 21 HB2 PRO 21 -6.118 -13.380 17.802
141 HB3 PRO 21 HB3 PRO 21 -4.410 -12.845 17.896
142 HG2 PRO 21 HG2 PRO 21 -6.906 -11.179 18.364
143 HG3 PRO 21 HG3 PRO 21 -5.456 -11.313 19.411
144 HD2 PRO 21 HD2 PRO 21 -5.769 -9.273 17.633
145 HD3 PRO 21 HD3 PRO 21 -4.160 -9.995 17.941
146 H GLY 22 H GLY 22 -6.222 -14.096 14.734
147 HA2 GLY 22 HA2 GLY 22 -8.280 -14.830 13.887
148 HA3 GLY 22 HA3 GLY 22 -9.101 -13.606 14.858
149 H GLN 23 H GLN 23 -10.362 -12.432 13.453
150 HA GLN 23 HA GLN 23 -9.537 -11.810 10.739
151 HB2 GLN 23 HB2 GLN 23 -11.862 -12.182 11.446
152 HB3 GLN 23 HB3 GLN 23 -11.828 -10.716 12.416
153 HG2 GLN 23 HG2 GLN 23 -11.335 -10.769 9.397
154 HG3 GLN 23 HG3 GLN 23 -12.922 -10.612 10.100
155 HE21 GLN 23 HE21 GLN 23 -11.612 -8.618 8.376
156 HE22 GLN 23 HE22 GLN 23 -11.484 -7.174 9.406
157 HA PRO 24 HA PRO 24 -6.859 -8.648 11.951
158 HB2 PRO 24 HB2 PRO 24 -6.202 -7.367 9.610
159 HB3 PRO 24 HB3 PRO 24 -5.775 -9.056 9.979
160 HG2 PRO 24 HG2 PRO 24 -8.190 -8.053 8.428
161 HG3 PRO 24 HG3 PRO 24 -6.996 -9.300 7.928
162 HD2 PRO 24 HD2 PRO 24 -9.331 -10.019 9.046
163 HD3 PRO 24 HD3 PRO 24 -7.825 -10.858 9.514
164 H GLY 25 H GLY 25 -9.903 -7.615 11.724
165 HA2 GLY 25 HA2 GLY 25 -10.807 -5.686 12.702
166 HA3 GLY 25 HA3 GLY 25 -9.259 -4.862 12.568
167 H ILE 26 H ILE 26 -9.406 -3.134 11.249
168 HA ILE 26 HA ILE 26 -11.509 -2.747 9.300
169 HB ILE 26 HB ILE 26 -8.906 -1.210 9.675
170 HG12 ILE 26 HG12 ILE 26 -11.697 -0.690 10.806
171 HG13 ILE 26 HG13 ILE 26 -10.292 -1.231 11.718
172 HG21 ILE 26 HG21 ILE 26 -11.476 -0.417 8.227
173 HG22 ILE 26 HG22 ILE 26 -10.070 0.633 8.466
174 HG23 ILE 26 HG23 ILE 26 -9.926 -0.781 7.445
175 HD11 ILE 26 HD11 ILE 26 -10.651 1.494 10.445
176 HD12 ILE 26 HD12 ILE 26 -10.569 1.081 12.161
177 HD13 ILE 26 HD13 ILE 26 -9.124 0.902 11.149
178 H GLY 27 H GLY 27 -8.117 -3.817 9.039
179 HA2 GLY 27 HA2 GLY 27 -8.563 -5.045 6.459
180 HA3 GLY 27 HA3 GLY 27 -7.671 -3.528 6.313
181 HA PRO 28 HA PRO 28 -5.119 -7.442 7.201
182 HB2 PRO 28 HB2 PRO 28 -3.805 -7.768 4.808
183 HB3 PRO 28 HB3 PRO 28 -5.465 -8.355 5.121
184 HG2 PRO 28 HG2 PRO 28 -4.642 -5.735 3.814
185 HG3 PRO 28 HG3 PRO 28 -5.789 -6.964 3.187
186 HD2 PRO 28 HD2 PRO 28 -6.704 -4.814 4.520
187 HD3 PRO 28 HD3 PRO 28 -7.413 -6.425 4.839
188 H ASP 29 H ASP 29 -2.786 -7.879 7.107
189 HA ASP 29 HA ASP 29 -1.221 -5.615 8.081
190 HB2 ASP 29 HB2 ASP 29 -1.347 -8.008 8.996
191 HB3 ASP 29 HB3 ASP 29 -0.353 -8.487 7.627
192 H LEU 30 H LEU 30 1.053 -5.284 7.374
193 HA LEU 30 HA LEU 30 1.298 -5.319 4.385
194 HB2 LEU 30 HB2 LEU 30 2.547 -3.373 6.326
195 HB3 LEU 30 HB3 LEU 30 2.434 -3.213 4.579
196 HG LEU 30 HG LEU 30 0.127 -3.074 6.566
197 HD11 LEU 30 HD11 LEU 30 1.480 -0.927 4.863
198 HD12 LEU 30 HD12 LEU 30 1.589 -1.104 6.625
199 HD13 LEU 30 HD13 LEU 30 0.040 -0.686 5.881
200 HD21 LEU 30 HD21 LEU 30 -1.191 -2.261 4.577
201 HD22 LEU 30 HD22 LEU 30 -0.688 -3.943 4.397
202 HD23 LEU 30 HD23 LEU 30 0.185 -2.666 3.524
203 H LEU 31 H LEU 31 2.753 -6.843 7.042
204 HA LEU 31 HA LEU 31 5.488 -6.298 6.681
205 HB2 LEU 31 HB2 LEU 31 4.571 -7.256 8.608
206 HB3 LEU 31 HB3 LEU 31 4.236 -8.774 7.771
207 HG LEU 31 HG LEU 31 7.038 -7.849 7.530
208 HD11 LEU 31 HD11 LEU 31 7.707 -8.447 9.789
209 HD12 LEU 31 HD12 LEU 31 6.008 -8.709 10.248
210 HD13 LEU 31 HD13 LEU 31 6.582 -7.079 9.802
211 HD21 LEU 31 HD21 LEU 31 7.510 -10.179 8.061
212 HD22 LEU 31 HD22 LEU 31 6.282 -10.049 6.780
213 HD23 LEU 31 HD23 LEU 31 5.799 -10.457 8.443
214 H GLY 32 H GLY 32 6.930 -6.771 5.424
215 HA2 GLY 32 HA2 GLY 32 8.130 -7.356 3.557
216 HA3 GLY 32 HA3 GLY 32 7.465 -8.969 3.775
217 H VAL 33 H VAL 33 4.974 -6.655 3.021
218 HA VAL 33 HA VAL 33 4.044 -8.321 1.067
219 HB VAL 33 HB VAL 33 2.762 -6.662 2.341
220 HG11 VAL 33 HG11 VAL 33 3.597 -4.646 0.219
221 HG12 VAL 33 HG12 VAL 33 2.444 -4.397 1.546
222 HG13 VAL 33 HG13 VAL 33 4.155 -4.651 1.908
223 HG21 VAL 33 HG21 VAL 33 2.143 -6.526 -0.632
224 HG22 VAL 33 HG22 VAL 33 1.729 -7.871 0.456
225 HG23 VAL 33 HG23 VAL 33 1.028 -6.277 0.723
226 H THR 34 H THR 34 6.479 -5.966 0.361
227 HA THR 34 HA THR 34 6.275 -5.774 -2.490
228 HB THR 34 HB THR 34 7.814 -4.378 -1.297
229 HG1 THR 34 HG1 THR 34 9.478 -4.568 -2.626
230 HG21 THR 34 HG21 THR 34 9.909 -5.244 -0.322
231 HG22 THR 34 HG22 THR 34 9.315 -6.905 -0.526
232 HG23 THR 34 HG23 THR 34 8.495 -5.784 0.589
233 H ARG 35 H ARG 35 7.358 -8.506 -0.483
234 HA ARG 35 HA ARG 35 8.201 -10.014 -2.866
235 HB2 ARG 35 HB2 ARG 35 9.228 -11.513 -1.466
236 HB3 ARG 35 HB3 ARG 35 9.406 -9.980 -0.621
237 HG2 ARG 35 HG2 ARG 35 7.238 -10.736 0.685
238 HG3 ARG 35 HG3 ARG 35 7.590 -12.331 0.042
239 HD2 ARG 35 HD2 ARG 35 9.510 -10.639 1.703
240 HD3 ARG 35 HD3 ARG 35 8.517 -11.957 2.326
241 HE ARG 35 HE ARG 35 10.954 -12.156 0.705
242 HH11 ARG 35 HH11 ARG 35 8.136 -13.945 1.973
243 HH12 ARG 35 HH12 ARG 35 8.898 -15.504 1.746
244 HH21 ARG 35 HH21 ARG 35 11.894 -14.194 0.431
245 HH22 ARG 35 HH22 ARG 35 11.020 -15.643 0.876
246 H GLN 36 H GLN 36 5.226 -9.410 -1.683
247 HA GLN 36 HA GLN 36 4.061 -12.118 -2.225
248 HB2 GLN 36 HB2 GLN 36 2.972 -9.634 -0.826
249 HB3 GLN 36 HB3 GLN 36 1.980 -11.011 -1.243
250 HG2 GLN 36 HG2 GLN 36 4.379 -11.113 0.639
251 HG3 GLN 36 HG3 GLN 36 2.680 -11.032 1.123
252 HE21 GLN 36 HE21 GLN 36 1.275 -12.847 -0.165
253 HE22 GLN 36 HE22 GLN 36 2.032 -14.435 -0.229
254 H ARG 37 H ARG 37 4.271 -8.877 -3.528
255 HA ARG 37 HA ARG 37 2.136 -9.438 -5.551
256 HB2 ARG 37 HB2 ARG 37 1.598 -7.874 -3.568
257 HB3 ARG 37 HB3 ARG 37 2.798 -6.779 -4.222
258 HG2 ARG 37 HG2 ARG 37 0.587 -6.045 -4.843
259 HG3 ARG 37 HG3 ARG 37 1.441 -6.529 -6.296
260 HD2 ARG 37 HD2 ARG 37 -0.863 -7.300 -6.383
261 HD3 ARG 37 HD3 ARG 37 0.213 -8.693 -6.297
262 HE ARG 37 HE ARG 37 -1.243 -7.542 -3.935
263 HH11 ARG 37 HH11 ARG 37 -0.244 -10.451 -5.757
264 HH12 ARG 37 HH12 ARG 37 -0.922 -11.539 -4.568
265 HH21 ARG 37 HH21 ARG 37 -2.086 -8.990 -2.436
266 HH22 ARG 37 HH22 ARG 37 -1.960 -10.715 -2.696
267 H ASP 38 H ASP 38 2.403 -8.190 -7.589
268 HA ASP 38 HA ASP 38 5.041 -7.767 -8.630
269 HB2 ASP 38 HB2 ASP 38 2.953 -7.982 -9.995
270 HB3 ASP 38 HB3 ASP 38 2.392 -6.444 -9.389
271 H ALA 39 H ALA 39 6.496 -6.430 -7.814
272 HA ALA 39 HA ALA 39 5.893 -4.486 -5.850
273 HB1 ALA 39 HB1 ALA 39 7.924 -5.871 -5.953
274 HB2 ALA 39 HB2 ALA 39 8.439 -5.021 -7.428
275 HB3 ALA 39 HB3 ALA 39 8.335 -4.145 -5.882
276 H ASN 40 H ASN 40 5.801 -4.113 -9.257
277 HA ASN 40 HA ASN 40 6.313 -1.174 -9.161
278 HB2 ASN 40 HB2 ASN 40 5.918 -3.069 -11.518
279 HB3 ASN 40 HB3 ASN 40 6.285 -1.354 -11.620
280 HD21 ASN 40 HD21 ASN 40 8.456 -0.780 -11.730
281 HD22 ASN 40 HD22 ASN 40 9.746 -1.937 -11.407
282 H TRP 41 H TRP 41 3.735 -3.579 -9.814
283 HA TRP 41 HA TRP 41 1.586 -1.648 -10.150
284 HB2 TRP 41 HB2 TRP 41 1.420 -4.096 -10.726
285 HB3 TRP 41 HB3 TRP 41 1.527 -4.459 -9.018
286 HD1 TRP 41 HD1 TRP 41 -0.949 -3.155 -11.600
287 HE1 TRP 41 HE1 TRP 41 -3.327 -3.274 -10.657
288 HE3 TRP 41 HE3 TRP 41 0.199 -4.309 -6.750
289 HZ2 TRP 41 HZ2 TRP 41 -4.552 -3.728 -8.085
290 HZ3 TRP 41 HZ3 TRP 41 -1.612 -4.535 -5.052
291 HH2 TRP 41 HH2 TRP 41 -3.986 -4.233 -5.710
292 H LEU 42 H LEU 42 2.961 -3.309 -7.301
293 HA LEU 42 HA LEU 42 1.181 -2.597 -5.334
294 HB2 LEU 42 HB2 LEU 42 3.058 -4.156 -5.098
295 HB3 LEU 42 HB3 LEU 42 4.216 -2.836 -5.251
296 HG LEU 42 HG LEU 42 3.439 -1.905 -3.079
297 HD11 LEU 42 HD11 LEU 42 1.739 -4.440 -2.972
298 HD12 LEU 42 HD12 LEU 42 1.134 -2.768 -3.003
299 HD13 LEU 42 HD13 LEU 42 2.059 -3.355 -1.606
300 HD21 LEU 42 HD21 LEU 42 4.482 -3.613 -1.696
301 HD22 LEU 42 HD22 LEU 42 5.339 -3.500 -3.237
302 HD23 LEU 42 HD23 LEU 42 4.210 -4.845 -2.953
303 H VAL 43 H VAL 43 3.934 -0.562 -6.389
304 HA VAL 43 HA VAL 43 3.368 1.583 -4.497
305 HB VAL 43 HB VAL 43 5.125 1.623 -6.981
306 HG11 VAL 43 HG11 VAL 43 4.562 3.896 -6.124
307 HG12 VAL 43 HG12 VAL 43 5.013 3.387 -4.478
308 HG13 VAL 43 HG13 VAL 43 6.239 3.498 -5.755
309 HG21 VAL 43 HG21 VAL 43 5.716 0.961 -4.052
310 HG22 VAL 43 HG22 VAL 43 5.911 -0.116 -5.443
311 HG23 VAL 43 HG23 VAL 43 6.961 1.286 -5.276
312 H ARG 44 H ARG 44 2.530 1.072 -7.972
313 HA ARG 44 HA ARG 44 1.194 3.596 -8.328
314 HB2 ARG 44 HB2 ARG 44 0.940 0.907 -9.722
315 HB3 ARG 44 HB3 ARG 44 -0.068 2.299 -10.148
316 HG2 ARG 44 HG2 ARG 44 1.937 3.671 -10.555
317 HG3 ARG 44 HG3 ARG 44 2.987 2.300 -10.182
318 HD2 ARG 44 HD2 ARG 44 0.892 2.221 -12.401
319 HD3 ARG 44 HD3 ARG 44 2.523 2.839 -12.651
320 HE ARG 44 HE ARG 44 3.467 0.716 -12.276
321 HH11 ARG 44 HH11 ARG 44 -0.100 0.515 -12.321
322 HH12 ARG 44 HH12 ARG 44 -0.089 -1.189 -12.719
323 HH21 ARG 44 HH21 ARG 44 3.423 -1.461 -12.802
324 HH22 ARG 44 HH22 ARG 44 1.903 -2.306 -12.990
325 H TRP 45 H TRP 45 -0.041 0.417 -7.305
326 HA TRP 45 HA TRP 45 -2.747 1.042 -6.773
327 HB2 TRP 45 HB2 TRP 45 -2.199 -1.219 -6.689
328 HB3 TRP 45 HB3 TRP 45 -0.735 -0.959 -5.769
329 HD1 TRP 45 HD1 TRP 45 -0.793 -1.086 -3.229
330 HE1 TRP 45 HE1 TRP 45 -2.571 -1.754 -1.484
331 HE3 TRP 45 HE3 TRP 45 -4.958 -0.910 -6.192
332 HZ2 TRP 45 HZ2 TRP 45 -5.453 -1.984 -1.355
333 HZ3 TRP 45 HZ3 TRP 45 -7.212 -1.264 -5.215
334 HH2 TRP 45 HH2 TRP 45 -7.469 -1.809 -2.802
335 H LEU 46 H LEU 46 0.022 1.279 -4.447
336 HA LEU 46 HA LEU 46 -1.815 2.384 -2.483
337 HB2 LEU 46 HB2 LEU 46 -0.097 2.184 -0.913
338 HB3 LEU 46 HB3 LEU 46 -0.036 0.787 -1.978
339 HG LEU 46 HG LEU 46 1.825 2.103 -3.236
340 HD11 LEU 46 HD11 LEU 46 1.906 3.429 -0.506
341 HD12 LEU 46 HD12 LEU 46 1.733 4.229 -2.079
342 HD13 LEU 46 HD13 LEU 46 3.243 3.422 -1.674
343 HD21 LEU 46 HD21 LEU 46 2.099 -0.026 -1.949
344 HD22 LEU 46 HD22 LEU 46 2.351 0.928 -0.466
345 HD23 LEU 46 HD23 LEU 46 3.498 1.028 -1.815
346 H LYS 47 H LYS 47 0.101 3.898 -4.909
347 HA LYS 47 HA LYS 47 0.025 6.576 -3.701
348 HB2 LYS 47 HB2 LYS 47 0.707 5.459 -6.451
349 HB3 LYS 47 HB3 LYS 47 0.482 7.188 -6.209
350 HG2 LYS 47 HG2 LYS 47 2.205 7.214 -4.451
351 HG3 LYS 47 HG3 LYS 47 2.466 5.482 -4.656
352 HD2 LYS 47 HD2 LYS 47 4.216 6.630 -5.827
353 HD3 LYS 47 HD3 LYS 47 3.148 5.910 -7.041
354 HE2 LYS 47 HE2 LYS 47 2.066 8.108 -7.409
355 HE3 LYS 47 HE3 LYS 47 3.032 8.822 -6.112
356 HZ1 LYS 47 HZ1 LYS 47 5.026 8.334 -7.420
357 HZ2 LYS 47 HZ2 LYS 47 4.023 9.318 -8.247
358 HZ3 LYS 47 HZ3 LYS 47 4.099 7.739 -8.660
359 H VAL 48 H VAL 48 -1.970 4.850 -6.120
360 HA VAL 48 HA VAL 48 -4.073 6.955 -5.822
361 HB VAL 48 HB VAL 48 -4.282 7.068 -8.287
362 HG11 VAL 48 HG11 VAL 48 -3.144 8.817 -6.974
363 HG12 VAL 48 HG12 VAL 48 -1.591 8.021 -7.312
364 HG13 VAL 48 HG13 VAL 48 -2.561 8.675 -8.642
365 HG21 VAL 48 HG21 VAL 48 -2.446 6.465 -9.755
366 HG22 VAL 48 HG22 VAL 48 -1.504 5.819 -8.401
367 HG23 VAL 48 HG23 VAL 48 -2.987 5.000 -8.924
368 HA PRO 49 HA PRO 49 -5.636 2.521 -5.963
369 HB2 PRO 49 HB2 PRO 49 -7.133 2.508 -3.651
370 HB3 PRO 49 HB3 PRO 49 -5.384 2.147 -3.702
371 HG2 PRO 49 HG2 PRO 49 -6.725 4.787 -3.044
372 HG3 PRO 49 HG3 PRO 49 -5.415 3.959 -2.142
373 HD2 PRO 49 HD2 PRO 49 -4.879 5.962 -3.891
374 HD3 PRO 49 HD3 PRO 49 -3.803 4.540 -3.767
375 H ASP 50 H ASP 50 -7.363 5.534 -5.157
376 HA ASP 50 HA ASP 50 -9.966 4.677 -6.041
377 HB2 ASP 50 HB2 ASP 50 -9.581 6.525 -4.481
378 HB3 ASP 50 HB3 ASP 50 -8.715 7.433 -5.712
379 H GLN 51 H GLN 51 -7.232 6.289 -7.716
380 HA GLN 51 HA GLN 51 -8.575 6.608 -10.250
381 HB2 GLN 51 HB2 GLN 51 -6.470 7.765 -9.352
382 HB3 GLN 51 HB3 GLN 51 -5.602 6.273 -9.772
383 HG2 GLN 51 HG2 GLN 51 -6.176 6.584 -12.133
384 HG3 GLN 51 HG3 GLN 51 -7.161 7.996 -11.720
385 HE21 GLN 51 HE21 GLN 51 -3.886 6.842 -12.283
386 HE22 GLN 51 HE22 GLN 51 -3.086 8.375 -11.948
387 H MET 52 H MET 52 -6.721 3.959 -8.770
388 HA MET 52 HA MET 52 -6.459 2.284 -11.081
389 HB2 MET 52 HB2 MET 52 -5.177 2.155 -8.877
390 HB3 MET 52 HB3 MET 52 -6.618 1.436 -8.161
391 HG2 MET 52 HG2 MET 52 -5.304 -0.400 -8.710
392 HG3 MET 52 HG3 MET 52 -6.487 -0.336 -10.006
393 HE1 MET 52 HE1 MET 52 -2.900 -0.511 -8.930
394 HE2 MET 52 HE2 MET 52 -1.935 0.239 -10.218
395 HE3 MET 52 HE3 MET 52 -2.899 1.261 -9.126
396 H LEU 53 H LEU 53 -8.932 2.280 -8.441
397 HA LEU 53 HA LEU 53 -10.562 0.240 -9.712
398 HB2 LEU 53 HB2 LEU 53 -11.157 2.274 -7.531
399 HB3 LEU 53 HB3 LEU 53 -12.291 1.025 -8.043
400 HG LEU 53 HG LEU 53 -9.533 0.451 -6.878
401 HD11 LEU 53 HD11 LEU 53 -10.753 -0.214 -4.849
402 HD12 LEU 53 HD12 LEU 53 -12.291 0.269 -5.596
403 HD13 LEU 53 HD13 LEU 53 -11.048 1.491 -5.227
404 HD21 LEU 53 HD21 LEU 53 -10.304 -1.419 -8.277
405 HD22 LEU 53 HD22 LEU 53 -11.879 -1.408 -7.456
406 HD23 LEU 53 HD23 LEU 53 -10.410 -1.853 -6.568
407 H ALA 54 H ALA 54 -10.473 3.775 -10.068
408 HA ALA 54 HA ALA 54 -12.873 3.848 -11.718
409 HB1 ALA 54 HB1 ALA 54 -10.621 5.851 -11.322
410 HB2 ALA 54 HB2 ALA 54 -12.152 6.162 -12.170
411 HB3 ALA 54 HB3 ALA 54 -12.162 5.799 -10.441
412 H GLU 55 H GLU 55 -9.457 3.201 -12.430
413 HA GLU 55 HA GLU 55 -9.841 3.277 -15.351
414 HB2 GLU 55 HB2 GLU 55 -7.676 3.833 -14.424
415 HB3 GLU 55 HB3 GLU 55 -7.626 2.335 -13.511
416 HG2 GLU 55 HG2 GLU 55 -6.095 2.164 -15.315
417 HG3 GLU 55 HG3 GLU 55 -7.381 1.024 -15.575
418 H LYS 56 H LYS 56 -10.529 1.072 -12.832
419 HA LYS 56 HA LYS 56 -11.033 -1.103 -12.639
420 HB2 LYS 56 HB2 LYS 56 -12.110 -0.894 -15.465
421 HB3 LYS 56 HB3 LYS 56 -12.482 -2.142 -14.263
422 HG2 LYS 56 HG2 LYS 56 -13.441 -0.387 -12.766
423 HG3 LYS 56 HG3 LYS 56 -13.198 0.806 -14.054
424 HD2 LYS 56 HD2 LYS 56 -14.670 -0.511 -15.557
425 HD3 LYS 56 HD3 LYS 56 -14.908 -1.720 -14.274
426 HE2 LYS 56 HE2 LYS 56 -15.882 0.033 -12.808
427 HE3 LYS 56 HE3 LYS 56 -15.649 1.234 -14.086
428 HZ1 LYS 56 HZ1 LYS 56 -17.416 -1.156 -14.315
429 HZ2 LYS 56 HZ2 LYS 56 -17.195 -0.028 -15.474
430 HZ3 LYS 56 HZ3 LYS 56 -17.907 0.398 -14.052
431 H ASP 57 H ASP 57 -8.594 -0.931 -12.733
432 HA ASP 57 HA ASP 57 -7.236 -2.884 -14.495
433 HB2 ASP 57 HB2 ASP 57 -6.057 -0.876 -13.446
434 HB3 ASP 57 HB3 ASP 57 -6.278 -1.660 -11.883
435 HA PRO 58 HA PRO 58 -10.003 -5.339 -12.297
436 HB2 PRO 58 HB2 PRO 58 -9.712 -7.737 -13.513
437 HB3 PRO 58 HB3 PRO 58 -10.237 -6.216 -14.337
438 HG2 PRO 58 HG2 PRO 58 -7.363 -7.198 -14.229
439 HG3 PRO 58 HG3 PRO 58 -8.376 -7.008 -15.713
440 HD2 PRO 58 HD2 PRO 58 -6.793 -5.051 -14.810
441 HD3 PRO 58 HD3 PRO 58 -8.466 -4.649 -15.311
442 H LEU 59 H LEU 59 -6.654 -6.214 -12.182
443 HA LEU 59 HA LEU 59 -6.594 -8.120 -10.066
444 HB2 LEU 59 HB2 LEU 59 -4.636 -7.474 -11.405
445 HB3 LEU 59 HB3 LEU 59 -4.687 -5.837 -10.751
446 HG LEU 59 HG LEU 59 -4.096 -6.652 -8.515
447 HD11 LEU 59 HD11 LEU 59 -3.396 -9.041 -8.208
448 HD12 LEU 59 HD12 LEU 59 -4.105 -9.418 -9.794
449 HD13 LEU 59 HD13 LEU 59 -5.132 -8.862 -8.456
450 HD21 LEU 59 HD21 LEU 59 -2.295 -7.817 -10.676
451 HD22 LEU 59 HD22 LEU 59 -1.812 -7.412 -9.014
452 HD23 LEU 59 HD23 LEU 59 -2.299 -6.135 -10.136
453 H ALA 60 H ALA 60 -6.897 -4.522 -9.911
454 HA ALA 60 HA ALA 60 -6.982 -4.469 -7.000
455 HB1 ALA 60 HB1 ALA 60 -7.938 -2.435 -9.043
456 HB2 ALA 60 HB2 ALA 60 -7.743 -2.182 -7.299
457 HB3 ALA 60 HB3 ALA 60 -6.317 -2.495 -8.311
458 H MET 61 H MET 61 -9.400 -4.465 -9.624
459 HA MET 61 HA MET 61 -11.755 -4.080 -8.100
460 HB2 MET 61 HB2 MET 61 -11.493 -5.752 -10.622
461 HB3 MET 61 HB3 MET 61 -12.946 -4.984 -10.008
462 HG2 MET 61 HG2 MET 61 -10.473 -3.488 -10.963
463 HG3 MET 61 HG3 MET 61 -11.885 -3.817 -11.948
464 HE1 MET 61 HE1 MET 61 -14.396 -3.221 -10.048
465 HE2 MET 61 HE2 MET 61 -14.627 -1.560 -10.630
466 HE3 MET 61 HE3 MET 61 -14.101 -2.840 -11.757
467 H LEU 62 H LEU 62 -9.940 -7.049 -8.754
468 HA LEU 62 HA LEU 62 -11.714 -8.814 -7.228
469 HB2 LEU 62 HB2 LEU 62 -8.860 -8.994 -8.238
470 HB3 LEU 62 HB3 LEU 62 -9.653 -10.296 -7.359
471 HG LEU 62 HG LEU 62 -10.639 -9.209 -10.039
472 HD11 LEU 62 HD11 LEU 62 -9.730 -11.311 -10.951
473 HD12 LEU 62 HD12 LEU 62 -9.093 -11.744 -9.351
474 HD13 LEU 62 HD13 LEU 62 -8.452 -10.330 -10.220
475 HD21 LEU 62 HD21 LEU 62 -11.462 -11.662 -8.420
476 HD22 LEU 62 HD22 LEU 62 -12.001 -11.283 -10.070
477 HD23 LEU 62 HD23 LEU 62 -12.462 -10.225 -8.737
478 H LEU 63 H LEU 63 -8.535 -7.121 -6.545
479 HA LEU 63 HA LEU 63 -8.157 -8.605 -4.137
480 HB2 LEU 63 HB2 LEU 63 -6.406 -7.659 -5.507
481 HB3 LEU 63 HB3 LEU 63 -6.947 -6.014 -5.198
482 HG LEU 63 HG LEU 63 -6.193 -7.743 -2.831
483 HD11 LEU 63 HD11 LEU 63 -3.813 -7.094 -3.155
484 HD12 LEU 63 HD12 LEU 63 -4.235 -6.439 -4.760
485 HD13 LEU 63 HD13 LEU 63 -4.408 -8.172 -4.431
486 HD21 LEU 63 HD21 LEU 63 -5.336 -5.604 -1.969
487 HD22 LEU 63 HD22 LEU 63 -7.005 -5.380 -2.505
488 HD23 LEU 63 HD23 LEU 63 -5.675 -4.805 -3.522
489 H PHE 64 H PHE 64 -9.785 -5.543 -4.767
490 HA PHE 64 HA PHE 64 -10.003 -4.936 -1.907
491 HB2 PHE 64 HB2 PHE 64 -10.695 -2.925 -2.443
492 HB3 PHE 64 HB3 PHE 64 -10.044 -3.302 -4.015
493 HD1 PHE 64 HD1 PHE 64 -11.809 -4.362 -5.746
494 HD2 PHE 64 HD2 PHE 64 -12.856 -2.117 -2.234
495 HE1 PHE 64 HE1 PHE 64 -13.994 -3.778 -6.776
496 HE2 PHE 64 HE2 PHE 64 -15.010 -1.475 -3.284
497 HZ PHE 64 HZ PHE 64 -15.579 -2.300 -5.562
498 H GLU 65 H GLU 65 -12.209 -6.396 -4.312
499 HA GLU 65 HA GLU 65 -14.489 -6.734 -2.657
500 HB2 GLU 65 HB2 GLU 65 -14.675 -6.938 -4.991
501 HB3 GLU 65 HB3 GLU 65 -13.269 -7.975 -5.127
502 HG2 GLU 65 HG2 GLU 65 -15.226 -9.228 -5.591
503 HG3 GLU 65 HG3 GLU 65 -14.417 -9.840 -4.154
504 H GLN 66 H GLN 66 -11.618 -8.819 -3.220
505 HA GLN 66 HA GLN 66 -12.495 -10.777 -1.249
506 HB2 GLN 66 HB2 GLN 66 -10.004 -10.507 -2.970
507 HB3 GLN 66 HB3 GLN 66 -10.287 -11.838 -1.842
508 HG2 GLN 66 HG2 GLN 66 -12.414 -12.381 -3.043
509 HG3 GLN 66 HG3 GLN 66 -12.028 -11.148 -4.244
510 HE21 GLN 66 HE21 GLN 66 -12.466 -13.693 -5.098
511 HE22 GLN 66 HE22 GLN 66 -10.938 -14.445 -5.573
512 H TYR 67 H TYR 67 -11.481 -7.900 -0.579
513 HA TYR 67 HA TYR 67 -10.598 -8.846 2.100
514 HB2 TYR 67 HB2 TYR 67 -9.570 -6.399 0.639
515 HB3 TYR 67 HB3 TYR 67 -9.402 -6.631 2.372
516 HD1 TYR 67 HD2 TYR 67 -8.516 -9.301 2.867
517 HD2 TYR 67 HD1 TYR 67 -7.459 -6.633 -0.354
518 HE1 TYR 67 HE2 TYR 67 -6.283 -10.375 2.704
519 HE2 TYR 67 HE1 TYR 67 -5.201 -7.677 -0.473
520 HH TYR 67 HH TYR 67 -3.751 -9.100 0.515
521 H ASN 68 H ASN 68 -13.170 -8.755 1.350
522 HA ASN 68 HA ASN 68 -15.224 -7.988 1.711
523 HB2 ASN 68 HB2 ASN 68 -14.274 -8.591 3.988
524 HB3 ASN 68 HB3 ASN 68 -14.140 -6.860 4.289
525 HD21 ASN 68 HD21 ASN 68 -15.603 -7.046 6.039
526 HD22 ASN 68 HD22 ASN 68 -17.338 -7.245 5.773
527 H ARG 69 H ARG 69 -13.860 -6.265 0.051
528 HA ARG 69 HA ARG 69 -14.218 -4.439 -1.159
529 HB2 ARG 69 HB2 ARG 69 -16.324 -5.922 -1.063
530 HB3 ARG 69 HB3 ARG 69 -17.071 -4.574 -0.204
531 HG2 ARG 69 HG2 ARG 69 -16.522 -3.103 -2.190
532 HG3 ARG 69 HG3 ARG 69 -15.823 -4.520 -2.994
533 HD2 ARG 69 HD2 ARG 69 -18.026 -5.633 -2.962
534 HD3 ARG 69 HD3 ARG 69 -18.707 -4.294 -2.033
535 HE ARG 69 HE ARG 69 -18.921 -3.044 -3.927
536 HH11 ARG 69 HH11 ARG 69 -16.740 -5.752 -4.740
537 HH12 ARG 69 HH12 ARG 69 -16.757 -5.378 -6.449
538 HH21 ARG 69 HH21 ARG 69 -18.915 -2.607 -6.131
539 HH22 ARG 69 HH22 ARG 69 -17.989 -3.598 -7.237
540 H LEU 70 H LEU 70 -13.180 -3.464 1.336
541 HA LEU 70 HA LEU 70 -14.738 -1.214 2.245
542 HB2 LEU 70 HB2 LEU 70 -13.122 -2.471 3.595
543 HB3 LEU 70 HB3 LEU 70 -11.805 -1.856 2.608
544 HG LEU 70 HG LEU 70 -13.613 0.169 3.936
545 HD11 LEU 70 HD11 LEU 70 -13.256 -1.454 5.727
546 HD12 LEU 70 HD12 LEU 70 -12.373 0.041 6.031
547 HD13 LEU 70 HD13 LEU 70 -11.500 -1.400 5.455
548 HD21 LEU 70 HD21 LEU 70 -11.710 0.995 2.583
549 HD22 LEU 70 HD22 LEU 70 -10.583 0.007 3.526
550 HD23 LEU 70 HD23 LEU 70 -11.457 1.363 4.283
551 H ALA 71 H ALA 71 -11.992 -1.389 -0.031
552 HA ALA 71 HA ALA 71 -11.154 -0.010 -1.566
553 HB1 ALA 71 HB1 ALA 71 -12.508 1.655 -2.697
554 HB2 ALA 71 HB2 ALA 71 -13.436 0.168 -2.468
555 HB3 ALA 71 HB3 ALA 71 -13.744 1.570 -1.431
556 H MET 72 H MET 72 -9.460 0.560 -0.099
557 HA MET 72 HA MET 72 -9.617 2.820 1.595
558 HB2 MET 72 HB2 MET 72 -7.292 2.656 1.895
559 HB3 MET 72 HB3 MET 72 -7.902 1.014 1.709
560 HG2 MET 72 HG2 MET 72 -7.097 1.041 -0.676
561 HG3 MET 72 HG3 MET 72 -6.458 2.670 -0.399
562 HE1 MET 72 HE1 MET 72 -4.480 0.882 -1.591
563 HE2 MET 72 HE2 MET 72 -3.931 2.398 -0.840
564 HE3 MET 72 HE3 MET 72 -3.070 0.879 -0.504
565 HA PRO 73 HA PRO 73 -9.283 6.199 -1.270
566 HB2 PRO 73 HB2 PRO 73 -8.816 8.287 0.376
567 HB3 PRO 73 HB3 PRO 73 -10.318 7.319 0.501
568 HG2 PRO 73 HG2 PRO 73 -7.789 7.028 2.150
569 HG3 PRO 73 HG3 PRO 73 -9.475 7.186 2.740
570 HD2 PRO 73 HD2 PRO 73 -8.247 4.757 2.412
571 HD3 PRO 73 HD3 PRO 73 -9.998 4.984 2.113
572 H ASN 74 H ASN 74 -7.873 7.980 -2.019
573 HA ASN 74 HA ASN 74 -4.966 7.503 -1.840
574 HB2 ASN 74 HB2 ASN 74 -5.906 8.274 -3.958
575 HB3 ASN 74 HB3 ASN 74 -6.681 9.640 -3.167
576 HD21 ASN 74 HD21 ASN 74 -5.482 10.700 -5.008
577 HD22 ASN 74 HD22 ASN 74 -3.830 11.235 -4.642
578 H MET 75 H MET 75 -3.705 8.375 -0.323
579 HA MET 75 HA MET 75 -4.883 10.095 1.778
580 HB2 MET 75 HB2 MET 75 -2.166 8.744 1.652
581 HB3 MET 75 HB3 MET 75 -2.822 9.602 3.037
582 HG2 MET 75 HG2 MET 75 -3.931 7.057 1.800
583 HG3 MET 75 HG3 MET 75 -3.050 7.195 3.319
584 HE1 MET 75 HE1 MET 75 -4.233 9.643 4.814
585 HE2 MET 75 HE2 MET 75 -5.600 8.941 5.697
586 HE3 MET 75 HE3 MET 75 -4.058 8.059 5.604
587 H ARG 76 H ARG 76 -3.592 10.872 -1.106
588 HA ARG 76 HA ARG 76 -2.564 12.571 -2.054
589 HB2 ARG 76 HB2 ARG 76 -4.285 13.715 -0.180
590 HB3 ARG 76 HB3 ARG 76 -2.814 14.638 0.027
591 HG2 ARG 76 HG2 ARG 76 -4.303 14.144 -2.594
592 HG3 ARG 76 HG3 ARG 76 -4.394 15.616 -1.633
593 HD2 ARG 76 HD2 ARG 76 -1.868 14.582 -2.997
594 HD3 ARG 76 HD3 ARG 76 -2.945 15.833 -3.629
595 HE ARG 76 HE ARG 76 -2.039 16.456 -0.960
596 HH11 ARG 76 HH11 ARG 76 -1.030 16.585 -4.380
597 HH12 ARG 76 HH12 ARG 76 0.102 17.890 -4.104
598 HH21 ARG 76 HH21 ARG 76 -0.556 18.146 -0.651
599 HH22 ARG 76 HH22 ARG 76 0.370 18.771 -1.998
600 H LEU 77 H LEU 77 -0.940 10.817 -0.415
601 HA LEU 77 HA LEU 77 1.171 12.346 0.796
602 HB2 LEU 77 HB2 LEU 77 2.169 10.338 1.378
603 HB3 LEU 77 HB3 LEU 77 0.445 10.075 1.544
604 HG LEU 77 HG LEU 77 2.155 9.117 -0.797
605 HD11 LEU 77 HD11 LEU 77 1.142 7.676 1.683
606 HD12 LEU 77 HD12 LEU 77 2.830 8.006 1.245
607 HD13 LEU 77 HD13 LEU 77 1.875 6.869 0.279
608 HD21 LEU 77 HD21 LEU 77 -0.710 8.407 -0.055
609 HD22 LEU 77 HD22 LEU 77 0.262 7.583 -1.284
610 HD23 LEU 77 HD23 LEU 77 -0.167 9.271 -1.521
611 H GLY 78 H GLY 78 3.368 12.495 0.250
612 HA2 GLY 78 HA2 GLY 78 3.710 13.244 -2.561
613 HA3 GLY 78 HA3 GLY 78 4.827 13.530 -1.236
614 H ASP 79 H ASP 79 4.968 12.238 -4.108
615 HA ASP 79 HA ASP 79 5.642 9.570 -3.983
616 HB2 ASP 79 HB2 ASP 79 5.313 10.839 -6.020
617 HB3 ASP 79 HB3 ASP 79 6.806 11.738 -5.761
618 H ALA 80 H ALA 80 7.807 12.190 -2.915
619 HA ALA 80 HA ALA 80 10.135 10.435 -2.663
620 HB1 ALA 80 HB1 ALA 80 11.101 12.326 -1.433
621 HB2 ALA 80 HB2 ALA 80 10.369 12.858 -2.954
622 HB3 ALA 80 HB3 ALA 80 9.525 13.143 -1.414
623 H GLU 81 H GLU 81 7.435 11.387 -0.516
624 HA GLU 81 HA GLU 81 8.545 9.996 1.801
625 HB2 GLU 81 HB2 GLU 81 7.083 11.136 2.956
626 HB3 GLU 81 HB3 GLU 81 6.714 12.020 1.499
627 HG2 GLU 81 HG2 GLU 81 4.802 10.437 1.071
628 HG3 GLU 81 HG3 GLU 81 5.163 9.643 2.602
629 H VAL 82 H VAL 82 6.327 9.193 -0.847
630 HA VAL 82 HA VAL 82 5.724 6.492 -0.061
631 HB VAL 82 HB VAL 82 6.152 7.617 -2.852
632 HG11 VAL 82 HG11 VAL 82 4.787 5.676 -3.624
633 HG12 VAL 82 HG12 VAL 82 6.326 5.162 -2.945
634 HG13 VAL 82 HG13 VAL 82 4.838 5.007 -1.987
635 HG21 VAL 82 HG21 VAL 82 3.764 7.804 -2.982
636 HG22 VAL 82 HG22 VAL 82 3.554 7.029 -1.396
637 HG23 VAL 82 HG23 VAL 82 4.271 8.648 -1.528
638 H SER 83 H SER 83 8.590 7.792 -1.913
639 HA SER 83 HA SER 83 9.836 5.275 -2.212
640 HB2 SER 83 HB2 SER 83 10.479 7.392 -3.384
641 HB3 SER 83 HB3 SER 83 11.273 7.930 -1.888
642 HG SER 83 HG SER 83 12.791 6.928 -3.179
643 H ALA 84 H ALA 84 10.048 7.496 0.573
644 HA ALA 84 HA ALA 84 11.939 5.868 2.052
645 HB1 ALA 84 HB1 ALA 84 11.712 8.227 2.507
646 HB2 ALA 84 HB2 ALA 84 9.987 8.048 2.871
647 HB3 ALA 84 HB3 ALA 84 11.209 7.325 3.948
648 H LEU 85 H LEU 85 8.331 6.004 2.018
649 HA LEU 85 HA LEU 85 7.944 4.011 4.050
650 HB2 LEU 85 HB2 LEU 85 6.291 5.686 3.386
651 HB3 LEU 85 HB3 LEU 85 6.212 5.016 1.760
652 HG LEU 85 HG LEU 85 5.193 2.946 2.611
653 HD11 LEU 85 HD11 LEU 85 5.334 4.312 5.333
654 HD12 LEU 85 HD12 LEU 85 6.165 2.815 4.856
655 HD13 LEU 85 HD13 LEU 85 4.402 2.840 4.962
656 HD21 LEU 85 HD21 LEU 85 3.758 4.838 1.968
657 HD22 LEU 85 HD22 LEU 85 3.846 5.489 3.618
658 HD23 LEU 85 HD23 LEU 85 3.046 3.938 3.318
659 H ILE 86 H ILE 86 8.316 3.764 0.554
660 HA ILE 86 HA ILE 86 7.917 0.905 0.214
661 HB ILE 86 HB ILE 86 9.024 3.177 -1.389
662 HG12 ILE 86 HG12 ILE 86 7.494 2.454 -3.037
663 HG13 ILE 86 HG13 ILE 86 7.323 0.850 -2.322
664 HG21 ILE 86 HG21 ILE 86 9.789 1.647 -3.189
665 HG22 ILE 86 HG22 ILE 86 10.837 1.619 -1.778
666 HG23 ILE 86 HG23 ILE 86 9.688 0.284 -2.057
667 HD11 ILE 86 HD11 ILE 86 6.241 3.365 -1.006
668 HD12 ILE 86 HD12 ILE 86 5.326 2.330 -2.098
669 HD13 ILE 86 HD13 ILE 86 5.914 1.680 -0.556
670 H SER 87 H SER 87 10.783 2.991 0.815
671 HA SER 87 HA SER 87 12.652 0.851 1.038
672 HB2 SER 87 HB2 SER 87 12.723 3.616 2.307
673 HB3 SER 87 HB3 SER 87 14.077 2.483 2.229
674 HG SER 87 HG SER 87 12.701 3.740 0.084
675 H TYR 88 H TYR 88 10.383 2.135 3.492
676 HA TYR 88 HA TYR 88 11.543 0.568 5.659
677 HB2 TYR 88 HB2 TYR 88 10.242 2.418 6.226
678 HB3 TYR 88 HB3 TYR 88 8.872 1.922 5.245
679 HD1 TYR 88 HD2 TYR 88 10.895 0.174 7.923
680 HD2 TYR 88 HD1 TYR 88 7.039 1.636 6.670
681 HE1 TYR 88 HE2 TYR 88 9.864 -0.838 9.928
682 HE2 TYR 88 HE1 TYR 88 6.009 0.668 8.711
683 HH TYR 88 HH TYR 88 6.360 -0.521 10.624
684 H LEU 89 H LEU 89 8.880 -0.106 3.347
685 HA LEU 89 HA LEU 89 8.377 -2.772 4.394
686 HB2 LEU 89 HB2 LEU 89 7.508 -1.133 2.026
687 HB3 LEU 89 HB3 LEU 89 7.322 -2.879 1.932
688 HG LEU 89 HG LEU 89 5.906 -2.971 3.864
689 HD11 LEU 89 HD11 LEU 89 6.278 0.037 4.171
690 HD12 LEU 89 HD12 LEU 89 6.806 -1.211 5.320
691 HD13 LEU 89 HD13 LEU 89 5.084 -0.953 5.045
692 HD21 LEU 89 HD21 LEU 89 4.916 -2.364 1.656
693 HD22 LEU 89 HD22 LEU 89 5.048 -0.648 2.091
694 HD23 LEU 89 HD23 LEU 89 3.983 -1.729 3.025
695 H GLU 90 H GLU 90 10.577 -1.551 1.887
696 HA GLU 90 HA GLU 90 11.450 -4.123 0.987
697 HB2 GLU 90 HB2 GLU 90 11.673 -1.940 -0.201
698 HB3 GLU 90 HB3 GLU 90 12.971 -1.492 0.900
699 HG2 GLU 90 HG2 GLU 90 13.187 -4.139 -0.551
700 HG3 GLU 90 HG3 GLU 90 13.310 -2.676 -1.519
701 H GLU 91 H GLU 91 12.821 -1.971 3.593
702 HA GLU 91 HA GLU 91 14.817 -3.933 4.386
703 HB2 GLU 91 HB2 GLU 91 13.434 -1.782 6.027
704 HB3 GLU 91 HB3 GLU 91 14.818 -2.731 6.564
705 HG2 GLU 91 HG2 GLU 91 14.871 -0.882 4.163
706 HG3 GLU 91 HG3 GLU 91 15.347 -0.412 5.785
707 H GLU 92 H GLU 92 11.336 -3.702 5.010
708 HA GLU 92 HA GLU 92 11.354 -5.674 7.092
709 HB2 GLU 92 HB2 GLU 92 9.496 -3.927 6.378
710 HB3 GLU 92 HB3 GLU 92 8.931 -5.261 5.377
711 HG2 GLU 92 HG2 GLU 92 7.753 -5.326 7.467
712 HG3 GLU 92 HG3 GLU 92 8.856 -6.697 7.423
713 H THR 93 H THR 93 11.983 -6.096 3.776
714 HA THR 93 HA THR 93 11.265 -8.955 3.674
715 HB THR 93 HB THR 93 12.563 -9.117 1.691
716 HG1 THR 93 HG1 THR 93 13.441 -6.443 2.018
717 HG21 THR 93 HG21 THR 93 10.407 -7.908 1.493
718 HG22 THR 93 HG22 THR 93 11.610 -7.377 0.284
719 HG23 THR 93 HG23 THR 93 11.282 -6.376 1.718
720 H ALA 94 H ALA 94 14.079 -7.033 4.439
721 HA ALA 94 HA ALA 94 15.809 -9.291 5.106
722 HB1 ALA 94 HB1 ALA 94 16.141 -6.345 5.818
723 HB2 ALA 94 HB2 ALA 94 17.401 -7.593 5.772
724 HB3 ALA 94 HB3 ALA 94 16.628 -7.073 4.276
725 H ARG 95 H ARG 95 13.569 -7.292 6.902
726 HA ARG 95 HA ARG 95 14.231 -8.539 9.508
727 HB2 ARG 95 HB2 ARG 95 12.381 -6.259 8.809
728 HB3 ARG 95 HB3 ARG 95 12.777 -6.780 10.444
729 HG2 ARG 95 HG2 ARG 95 15.069 -6.057 10.215
730 HG3 ARG 95 HG3 ARG 95 14.876 -5.759 8.480
731 HD2 ARG 95 HD2 ARG 95 13.114 -4.059 8.992
732 HD3 ARG 95 HD3 ARG 95 13.476 -4.251 10.720
733 HE ARG 95 HE ARG 95 15.931 -3.723 9.661
734 HH11 ARG 95 HH11 ARG 95 12.813 -2.013 9.337
735 HH12 ARG 95 HH12 ARG 95 13.575 -0.465 9.055
736 HH21 ARG 95 HH21 ARG 95 16.869 -1.694 9.281
737 HH22 ARG 95 HH22 ARG 95 15.866 -0.285 9.023
738 H LEU 96 H LEU 96 12.605 -9.788 7.171
739 HA LEU 96 HA LEU 96 9.879 -10.078 7.758
740 HB2 LEU 96 HB2 LEU 96 11.268 -10.588 5.685
741 HB3 LEU 96 HB3 LEU 96 11.667 -12.120 6.379
742 HG LEU 96 HG LEU 96 10.057 -12.549 4.790
743 HD11 LEU 96 HD11 LEU 96 9.463 -13.521 6.986
744 HD12 LEU 96 HD12 LEU 96 8.067 -13.275 5.908
745 HD13 LEU 96 HD13 LEU 96 8.370 -12.131 7.236
746 HD21 LEU 96 HD21 LEU 96 9.477 -10.291 4.286
747 HD22 LEU 96 HD22 LEU 96 8.609 -10.100 5.814
748 HD23 LEU 96 HD23 LEU 96 7.973 -11.206 4.563
749 H GLN 97 H GLN 97 12.585 -12.272 8.711
750 HA GLN 97 HA GLN 97 10.827 -14.193 9.870
751 HB2 GLN 97 HB2 GLN 97 12.740 -15.371 10.561
752 HB3 GLN 97 HB3 GLN 97 13.086 -14.666 8.987
753 HG2 GLN 97 HG2 GLN 97 14.402 -12.850 10.117
754 HG3 GLN 97 HG3 GLN 97 14.101 -13.621 11.675
755 HE21 GLN 97 HE21 GLN 97 16.753 -13.159 10.486
756 HE22 GLN 97 HE22 GLN 97 17.426 -14.751 10.166
757 H THR 98 H THR 98 11.462 -11.215 11.142
758 HA THR 98 HA THR 98 10.790 -12.013 13.950
759 HB THR 98 HB THR 98 13.019 -11.370 14.008
760 HG1 THR 98 HG1 THR 98 12.830 -9.683 15.423
761 HG21 THR 98 HG21 THR 98 13.907 -9.190 13.439
762 HG22 THR 98 HG22 THR 98 12.364 -8.681 12.744
763 HG23 THR 98 HG23 THR 98 13.305 -9.985 11.983
764 HA PRO 99 HA PRO 99 7.335 -9.251 12.757
765 HB2 PRO 99 HB2 PRO 99 5.248 -10.894 13.212
766 HB3 PRO 99 HB3 PRO 99 6.232 -11.060 11.729
767 HG2 PRO 99 HG2 PRO 99 6.496 -12.650 14.307
768 HG3 PRO 99 HG3 PRO 99 6.375 -13.275 12.633
769 HD2 PRO 99 HD2 PRO 99 8.774 -12.879 13.938
770 HD3 PRO 99 HD3 PRO 99 8.595 -12.719 12.164
771 H VAL 100 H VAL 100 8.938 -8.871 14.841
772 HA VAL 100 HA VAL 100 7.955 -9.758 17.381
773 HB VAL 100 HB VAL 100 10.279 -9.445 16.997
774 HG11 VAL 100 HG11 VAL 100 9.822 -6.433 16.793
775 HG12 VAL 100 HG12 VAL 100 11.384 -7.274 16.832
776 HG13 VAL 100 HG13 VAL 100 10.306 -7.507 15.459
777 HG21 VAL 100 HG21 VAL 100 10.886 -8.277 19.046
778 HG22 VAL 100 HG22 VAL 100 9.343 -7.409 19.076
779 HG23 VAL 100 HG23 VAL 100 9.384 -9.171 19.315
780 H THR 101 H THR 101 6.537 -8.931 18.764
781 HA THR 101 HA THR 101 5.801 -6.104 18.797
782 HB THR 101 HB THR 101 4.461 -7.022 16.895
783 HG1 THR 101 HG1 THR 101 2.378 -6.342 18.099
784 HG21 THR 101 HG21 THR 101 2.574 -8.461 17.279
785 HG22 THR 101 HG22 THR 101 2.906 -8.550 19.022
786 HG23 THR 101 HG23 THR 101 4.022 -9.293 17.855
787 H ASN 102 H ASN 102 3.783 -5.914 20.295
788 HA ASN 102 HA ASN 102 3.774 -7.672 22.634
789 HB2 ASN 102 HB2 ASN 102 4.496 -5.923 24.183
790 HB3 ASN 102 HB3 ASN 102 5.770 -6.218 23.016
791 HD21 ASN 102 HD21 ASN 102 3.909 -3.805 24.501
792 HD22 ASN 102 HD22 ASN 102 4.211 -2.510 23.351
793 H ARG 103 H ARG 103 1.936 -7.331 23.929
794 HA ARG 103 HA ARG 103 -0.401 -6.273 22.700
795 HB2 ARG 103 HB2 ARG 103 -0.268 -8.152 24.328
796 HB3 ARG 103 HB3 ARG 103 0.136 -7.001 25.605
797 HG2 ARG 103 HG2 ARG 103 -2.114 -5.897 25.247
798 HG3 ARG 103 HG3 ARG 103 -2.469 -7.119 24.015
799 HD2 ARG 103 HD2 ARG 103 -3.519 -7.801 26.073
800 HD3 ARG 103 HD3 ARG 103 -2.159 -8.894 25.768
801 HE ARG 103 HE ARG 103 -1.755 -6.525 27.520
802 HH11 ARG 103 HH11 ARG 103 -2.064 -10.079 27.350
803 HH12 ARG 103 HH12 ARG 103 -1.420 -10.306 28.960
804 HH21 ARG 103 HH21 ARG 103 -0.929 -6.873 29.585
805 HH22 ARG 103 HH22 ARG 103 -0.779 -8.495 30.222
806 H GLY 104 H GLY 104 -1.475 -4.424 22.878
807 HA2 GLY 104 HA2 GLY 104 -1.464 -2.684 25.124
808 HA3 GLY 104 HA3 GLY 104 -0.485 -1.952 23.854
809 H ILE 105 H ILE 105 -3.194 -1.343 25.073
810 HA ILE 105 HA ILE 105 -4.714 -0.831 22.603
811 HB ILE 105 HB ILE 105 -6.785 -1.610 23.445
812 HG12 ILE 105 HG12 ILE 105 -6.744 -1.208 25.789
813 HG13 ILE 105 HG13 ILE 105 -7.146 -2.882 25.478
814 HG21 ILE 105 HG21 ILE 105 -6.525 -3.989 23.379
815 HG22 ILE 105 HG22 ILE 105 -5.395 -3.234 22.251
816 HG23 ILE 105 HG23 ILE 105 -4.812 -3.882 23.802
817 HD11 ILE 105 HD11 ILE 105 -5.724 -2.802 27.400
818 HD12 ILE 105 HD12 ILE 105 -4.766 -3.513 26.089
819 HD13 ILE 105 HD13 ILE 105 -4.517 -1.815 26.568
820 HA PRO 106 HA PRO 106 -5.461 3.129 24.315
821 HB2 PRO 106 HB2 PRO 106 -8.410 2.805 23.755
822 HB3 PRO 106 HB3 PRO 106 -7.330 4.178 23.359
823 HG2 PRO 106 HG2 PRO 106 -7.947 2.408 21.434
824 HG3 PRO 106 HG3 PRO 106 -6.238 2.922 21.632
825 HD2 PRO 106 HD2 PRO 106 -7.577 0.412 22.683
826 HD3 PRO 106 HD3 PRO 106 -6.038 0.576 21.781
827 HHA HEC 107 HHA HEC 107 -5.174 -3.938 0.850
828 HHB HEC 107 HHB HEC 107 -0.037 -0.036 1.262
829 HHC HEC 107 HHC HEC 107 -3.740 4.432 4.144
830 HHD HEC 107 HHD HEC 107 -8.411 0.006 4.796
831 HMA1 HEC 107 HMA1 HEC 107 0.645 -2.340 0.820
832 HMA2 HEC 107 HMA2 HEC 107 -0.001 -3.559 -0.276
833 HMA3 HEC 107 HMA3 HEC 107 0.099 -1.869 -0.808
834 HAA1 HEC 107 HAA1 HEC 107 -3.656 -4.441 -0.856
835 HAA2 HEC 107 HAA2 HEC 107 -1.996 -4.189 -1.301
836 HBA1 HEC 107 HBA1 HEC 107 -1.283 -5.452 0.776
837 HBA2 HEC 107 HBA2 HEC 107 -2.978 -5.820 1.077
838 HMB1 HEC 107 HMB1 HEC 107 1.076 3.516 1.943
839 HMB2 HEC 107 HMB2 HEC 107 1.387 2.088 2.933
840 HMB3 HEC 107 HMB3 HEC 107 1.037 1.933 1.199
841 HAB HEC 107 HAB HEC 107 -1.853 5.217 3.923
842 HBB1 HEC 107 HBB1 HEC 107 -0.836 6.651 2.344
843 HBB2 HEC 107 HBB2 HEC 107 -0.144 5.294 1.439
844 HBB3 HEC 107 HBB3 HEC 107 -1.900 5.516 1.488
845 HMC1 HEC 107 HMC1 HEC 107 -5.159 5.188 5.626
846 HMC2 HEC 107 HMC2 HEC 107 -6.660 5.474 4.722
847 HMC3 HEC 107 HMC3 HEC 107 -6.700 4.862 6.381
848 HAC HEC 107 HAC HEC 107 -8.995 1.693 5.797
849 HBC1 HEC 107 HBC1 HEC 107 -8.897 4.700 5.587
850 HBC2 HEC 107 HBC2 HEC 107 -9.590 3.585 4.389
851 HBC3 HEC 107 HBC3 HEC 107 -10.274 3.679 6.018
852 HMD1 HEC 107 HMD1 HEC 107 -9.236 -2.074 5.032
853 HMD2 HEC 107 HMD2 HEC 107 -9.929 -2.372 3.422
854 HMD3 HEC 107 HMD3 HEC 107 -9.152 -3.681 4.307
855 HAD1 HEC 107 HAD1 HEC 107 -7.273 -4.933 1.495
856 HAD2 HEC 107 HAD2 HEC 107 -8.839 -4.342 2.044
857 HBD1 HEC 107 HBD1 HEC 107 -7.320 -3.288 -0.373
858 HBD2 HEC 107 HBD2 HEC 107 -8.770 -4.281 -0.370
Start of MODEL 3
1 H SER 1 H SER 1 14.472 5.311 7.620
2 HA SER 1 HA SER 1 13.637 7.140 6.624
3 HB2 SER 1 HB2 SER 1 13.200 5.518 4.107
4 HB3 SER 1 HB3 SER 1 13.187 7.279 4.270
5 HG SER 1 HG SER 1 15.433 5.646 4.952
6 H GLY 2 H GLY 2 11.489 4.369 5.743
7 HA2 GLY 2 HA2 GLY 2 9.181 6.071 5.614
8 HA3 GLY 2 HA3 GLY 2 9.210 4.348 5.468
9 H GLU 3 H GLU 3 10.380 4.176 8.408
10 HA GLU 3 HA GLU 3 8.001 3.306 9.495
11 HB2 GLU 3 HB2 GLU 3 10.301 2.810 10.386
12 HB3 GLU 3 HB3 GLU 3 10.299 4.412 11.138
13 HG2 GLU 3 HG2 GLU 3 7.979 3.456 12.182
14 HG3 GLU 3 HG3 GLU 3 8.743 1.916 11.825
15 H GLN 4 H GLN 4 9.438 6.555 10.284
16 HA GLN 4 HA GLN 4 7.358 7.343 12.068
17 HB2 GLN 4 HB2 GLN 4 9.171 8.997 10.259
18 HB3 GLN 4 HB3 GLN 4 8.065 9.695 11.450
19 HG2 GLN 4 HG2 GLN 4 9.203 8.474 13.273
20 HG3 GLN 4 HG3 GLN 4 10.325 7.766 12.111
21 HE21 GLN 4 HE21 GLN 4 11.787 8.894 13.812
22 HE22 GLN 4 HE22 GLN 4 12.275 10.539 13.356
23 H ILE 5 H ILE 5 7.460 7.466 8.534
24 HA ILE 5 HA ILE 5 5.128 9.193 8.223
25 HB ILE 5 HB ILE 5 6.410 7.268 6.222
26 HG12 ILE 5 HG12 ILE 5 7.034 10.235 6.566
27 HG13 ILE 5 HG13 ILE 5 8.077 8.934 7.140
28 HG21 ILE 5 HG21 ILE 5 4.088 8.129 5.665
29 HG22 ILE 5 HG22 ILE 5 4.742 9.777 5.714
30 HG23 ILE 5 HG23 ILE 5 5.325 8.601 4.515
31 HD11 ILE 5 HD11 ILE 5 7.424 9.512 4.243
32 HD12 ILE 5 HD12 ILE 5 8.969 9.688 5.071
33 HD13 ILE 5 HD13 ILE 5 8.289 8.069 4.810
34 H PHE 6 H PHE 6 5.719 5.631 8.060
35 HA PHE 6 HA PHE 6 2.976 4.928 7.593
36 HB2 PHE 6 HB2 PHE 6 4.859 3.365 7.242
37 HB3 PHE 6 HB3 PHE 6 5.198 3.354 8.969
38 HD1 PHE 6 HD1 PHE 6 2.648 2.467 6.388
39 HD2 PHE 6 HD2 PHE 6 3.911 1.970 10.479
40 HE1 PHE 6 HE1 PHE 6 0.831 0.811 6.755
41 HE2 PHE 6 HE2 PHE 6 2.141 0.270 10.819
42 HZ PHE 6 HZ PHE 6 0.577 -0.291 8.969
43 H ARG 7 H ARG 7 4.846 5.131 10.631
44 HA ARG 7 HA ARG 7 2.798 4.473 12.435
45 HB2 ARG 7 HB2 ARG 7 5.243 4.506 12.840
46 HB3 ARG 7 HB3 ARG 7 5.199 6.276 12.925
47 HG2 ARG 7 HG2 ARG 7 3.764 6.194 14.894
48 HG3 ARG 7 HG3 ARG 7 3.547 4.446 14.736
49 HD2 ARG 7 HD2 ARG 7 6.201 5.842 15.295
50 HD3 ARG 7 HD3 ARG 7 5.163 5.128 16.532
51 HE ARG 7 HE ARG 7 6.924 3.750 14.660
52 HH11 ARG 7 HH11 ARG 7 4.134 3.292 16.839
53 HH12 ARG 7 HH12 ARG 7 4.397 1.568 16.973
54 HH21 ARG 7 HH21 ARG 7 7.222 1.530 14.863
55 HH22 ARG 7 HH22 ARG 7 6.147 0.571 15.854
56 H THR 8 H THR 8 3.324 7.536 10.793
57 HA THR 8 HA THR 8 1.348 8.897 12.563
58 HB THR 8 HB THR 8 2.045 10.975 11.359
59 HG1 THR 8 HG1 THR 8 4.241 9.485 10.478
60 HG21 THR 8 HG21 THR 8 4.268 11.101 12.496
61 HG22 THR 8 HG22 THR 8 4.183 9.357 12.820
62 HG23 THR 8 HG23 THR 8 2.992 10.458 13.533
63 H ARG 9 H ARG 9 1.594 7.817 9.185
64 HA ARG 9 HA ARG 9 -1.033 9.137 8.645
65 HB2 ARG 9 HB2 ARG 9 1.097 8.204 6.697
66 HB3 ARG 9 HB3 ARG 9 -0.434 8.982 6.293
67 HG2 ARG 9 HG2 ARG 9 0.337 10.939 7.815
68 HG3 ARG 9 HG3 ARG 9 1.934 10.181 7.771
69 HD2 ARG 9 HD2 ARG 9 1.897 11.867 6.081
70 HD3 ARG 9 HD3 ARG 9 1.847 10.306 5.243
71 HE ARG 9 HE ARG 9 -0.789 10.872 5.459
72 HH11 ARG 9 HH11 ARG 9 1.878 12.933 4.283
73 HH12 ARG 9 HH12 ARG 9 0.828 13.854 3.229
74 HH21 ARG 9 HH21 ARG 9 -2.096 12.087 4.091
75 HH22 ARG 9 HH22 ARG 9 -1.417 13.373 3.119
76 H CYS 10 H CYS 10 0.285 5.937 8.900
77 HA CYS 10 HA CYS 10 -2.012 4.797 7.332
78 HB2 CYS 10 HB2 CYS 10 0.829 3.827 7.494
79 HB3 CYS 10 HB3 CYS 10 -0.404 3.262 6.371
80 H SER 11 H SER 11 -0.357 4.530 10.353
81 HA SER 11 HA SER 11 -0.524 1.647 10.552
82 HB2 SER 11 HB2 SER 11 1.343 3.098 11.359
83 HB3 SER 11 HB3 SER 11 0.302 3.638 12.689
84 HG SER 11 HG SER 11 1.838 1.759 12.946
85 H SER 12 H SER 12 -3.017 3.783 11.066
86 HA SER 12 HA SER 12 -4.128 2.246 13.380
87 HB2 SER 12 HB2 SER 12 -4.797 5.006 12.352
88 HB3 SER 12 HB3 SER 12 -5.686 4.153 13.636
89 HG SER 12 HG SER 12 -4.007 5.525 14.434
90 H CYS 13 H CYS 13 -4.657 2.659 9.951
91 HA CYS 13 HA CYS 13 -7.049 0.867 10.163
92 HB2 CYS 13 HB2 CYS 13 -5.553 1.994 7.778
93 HB3 CYS 13 HB3 CYS 13 -6.796 0.758 7.666
94 H HIS 14 H HIS 14 -3.620 0.799 9.056
95 HA HIS 14 HA HIS 14 -3.773 -2.086 8.440
96 HB2 HIS 14 2HB HIS 14 -1.747 0.115 7.956
97 HB3 HIS 14 3HB HIS 14 -1.357 -1.554 7.649
98 HD1 HIS 14 1HD HIS 14 -2.775 -2.873 5.760
99 HD2 HIS 14 2HD HIS 14 -3.002 1.285 6.111
100 HE1 HIS 14 1HE HIS 14 -3.585 -2.069 3.502
101 H THR 15 H THR 15 -1.726 -3.151 8.714
102 HA THR 15 HA THR 15 -0.143 -2.693 11.117
103 HB THR 15 HB THR 15 -0.046 -5.207 11.601
104 HG1 THR 15 HG1 THR 15 -2.655 -5.166 10.507
105 HG21 THR 15 HG21 THR 15 -1.098 -3.652 13.170
106 HG22 THR 15 HG22 THR 15 -1.964 -5.198 13.118
107 HG23 THR 15 HG23 THR 15 -2.633 -3.769 12.293
108 H VAL 16 H VAL 16 1.988 -3.615 10.933
109 HA VAL 16 HA VAL 16 2.599 -4.922 8.293
110 HB VAL 16 HB VAL 16 4.739 -3.382 9.783
111 HG11 VAL 16 HG11 VAL 16 5.784 -3.490 7.527
112 HG12 VAL 16 HG12 VAL 16 5.379 -5.105 8.130
113 HG13 VAL 16 HG13 VAL 16 4.371 -4.347 6.899
114 HG21 VAL 16 HG21 VAL 16 4.506 -1.555 8.161
115 HG22 VAL 16 HG22 VAL 16 2.976 -2.249 7.593
116 HG23 VAL 16 HG23 VAL 16 3.136 -1.671 9.263
117 H GLY 17 H GLY 17 2.133 -6.903 9.077
118 HA2 GLY 17 HA2 GLY 17 2.738 -8.947 9.942
119 HA3 GLY 17 HA3 GLY 17 4.277 -8.243 10.432
120 H ASN 18 H ASN 18 2.219 -6.347 12.125
121 HA ASN 18 HA ASN 18 1.992 -8.058 14.502
122 HB2 ASN 18 HB2 ASN 18 2.336 -5.551 14.557
123 HB3 ASN 18 HB3 ASN 18 0.701 -5.358 13.929
124 HD21 ASN 18 HD21 ASN 18 0.023 -4.201 15.832
125 HD22 ASN 18 HD22 ASN 18 -0.173 -5.054 17.355
126 H THR 19 H THR 19 0.488 -8.291 11.626
127 HA THR 19 HA THR 19 -2.287 -8.378 12.256
128 HB THR 19 HB THR 19 -1.163 -9.921 9.937
129 HG1 THR 19 HG1 THR 19 -1.199 -7.092 10.010
130 HG21 THR 19 HG21 THR 19 -3.613 -9.593 10.190
131 HG22 THR 19 HG22 THR 19 -3.005 -8.776 8.746
132 HG23 THR 19 HG23 THR 19 -3.374 -7.832 10.201
133 H GLU 20 H GLU 20 -3.641 -10.039 12.658
134 HA GLU 20 HA GLU 20 -2.522 -12.780 13.124
135 HB2 GLU 20 HB2 GLU 20 -4.832 -11.329 14.470
136 HB3 GLU 20 HB3 GLU 20 -4.444 -13.030 14.718
137 HG2 GLU 20 HG2 GLU 20 -2.069 -12.211 15.370
138 HG3 GLU 20 HG3 GLU 20 -2.802 -10.608 15.524
139 HA PRO 21 HA PRO 21 -5.273 -14.259 9.978
140 HB2 PRO 21 HB2 PRO 21 -6.113 -16.721 10.884
141 HB3 PRO 21 HB3 PRO 21 -4.443 -16.376 10.350
142 HG2 PRO 21 HG2 PRO 21 -5.528 -16.322 13.190
143 HG3 PRO 21 HG3 PRO 21 -4.083 -17.196 12.579
144 HD2 PRO 21 HD2 PRO 21 -3.815 -14.806 13.751
145 HD3 PRO 21 HD3 PRO 21 -2.871 -15.178 12.283
146 H GLY 22 H GLY 22 -7.554 -15.244 9.608
147 HA2 GLY 22 HA2 GLY 22 -9.852 -15.412 10.189
148 HA3 GLY 22 HA3 GLY 22 -9.582 -14.404 11.603
149 H GLN 23 H GLN 23 -11.623 -13.408 10.841
150 HA GLN 23 HA GLN 23 -11.857 -12.318 8.292
151 HB2 GLN 23 HB2 GLN 23 -13.902 -11.298 8.976
152 HB3 GLN 23 HB3 GLN 23 -13.749 -12.879 9.725
153 HG2 GLN 23 HG2 GLN 23 -13.100 -11.791 11.875
154 HG3 GLN 23 HG3 GLN 23 -13.289 -10.204 11.113
155 HE21 GLN 23 HE21 GLN 23 -15.504 -9.462 10.535
156 HE22 GLN 23 HE22 GLN 23 -16.861 -10.317 11.257
157 HA PRO 24 HA PRO 24 -9.577 -8.550 8.274
158 HB2 PRO 24 HB2 PRO 24 -10.680 -7.207 6.170
159 HB3 PRO 24 HB3 PRO 24 -9.760 -8.732 5.970
160 HG2 PRO 24 HG2 PRO 24 -12.768 -8.392 6.188
161 HG3 PRO 24 HG3 PRO 24 -11.850 -9.289 4.930
162 HD2 PRO 24 HD2 PRO 24 -12.916 -10.571 7.041
163 HD3 PRO 24 HD3 PRO 24 -11.300 -11.024 6.422
164 H GLY 25 H GLY 25 -9.588 -6.333 8.661
165 HA2 GLY 25 HA2 GLY 25 -12.103 -5.008 9.622
166 HA3 GLY 25 HA3 GLY 25 -10.497 -4.716 10.298
167 H ILE 26 H ILE 26 -9.954 -2.684 9.712
168 HA ILE 26 HA ILE 26 -10.889 -1.505 7.227
169 HB ILE 26 HB ILE 26 -8.978 0.126 8.694
170 HG12 ILE 26 HG12 ILE 26 -11.492 -0.756 10.153
171 HG13 ILE 26 HG13 ILE 26 -9.801 -0.969 10.668
172 HG21 ILE 26 HG21 ILE 26 -10.652 1.810 8.235
173 HG22 ILE 26 HG22 ILE 26 -10.550 0.789 6.809
174 HG23 ILE 26 HG23 ILE 26 -11.898 0.577 7.948
175 HD11 ILE 26 HD11 ILE 26 -9.560 1.535 10.627
176 HD12 ILE 26 HD12 ILE 26 -11.329 1.622 10.409
177 HD13 ILE 26 HD13 ILE 26 -10.650 0.891 11.879
178 H GLY 27 H GLY 27 -7.880 -3.025 8.176
179 HA2 GLY 27 HA2 GLY 27 -6.604 -2.225 5.601
180 HA3 GLY 27 HA3 GLY 27 -5.854 -1.699 7.083
181 HA PRO 28 HA PRO 28 -5.142 -6.437 6.472
182 HB2 PRO 28 HB2 PRO 28 -3.944 -6.288 3.740
183 HB3 PRO 28 HB3 PRO 28 -5.070 -7.488 4.416
184 HG2 PRO 28 HG2 PRO 28 -5.903 -5.622 2.621
185 HG3 PRO 28 HG3 PRO 28 -6.943 -6.141 3.984
186 HD2 PRO 28 HD2 PRO 28 -5.224 -3.670 3.784
187 HD3 PRO 28 HD3 PRO 28 -6.909 -3.849 4.357
188 H ASP 29 H ASP 29 -2.971 -7.682 6.073
189 HA ASP 29 HA ASP 29 -0.794 -6.345 7.353
190 HB2 ASP 29 HB2 ASP 29 -1.251 -8.824 7.342
191 HB3 ASP 29 HB3 ASP 29 -0.862 -8.863 5.636
192 H LEU 30 H LEU 30 1.360 -6.192 6.487
193 HA LEU 30 HA LEU 30 1.696 -5.381 3.641
194 HB2 LEU 30 HB2 LEU 30 2.367 -3.703 6.080
195 HB3 LEU 30 HB3 LEU 30 2.784 -3.271 4.424
196 HG LEU 30 HG LEU 30 -0.046 -3.555 5.503
197 HD11 LEU 30 HD11 LEU 30 -0.086 -1.067 5.338
198 HD12 LEU 30 HD12 LEU 30 1.669 -1.088 5.015
199 HD13 LEU 30 HD13 LEU 30 1.022 -1.687 6.561
200 HD21 LEU 30 HD21 LEU 30 -0.651 -2.334 3.396
201 HD22 LEU 30 HD22 LEU 30 0.156 -3.852 3.005
202 HD23 LEU 30 HD23 LEU 30 1.058 -2.330 2.901
203 H LEU 31 H LEU 31 3.056 -7.032 6.382
204 HA LEU 31 HA LEU 31 5.769 -6.173 6.331
205 HB2 LEU 31 HB2 LEU 31 4.706 -7.391 8.110
206 HB3 LEU 31 HB3 LEU 31 4.662 -8.862 7.159
207 HG LEU 31 HG LEU 31 7.316 -7.422 7.451
208 HD11 LEU 31 HD11 LEU 31 6.368 -7.335 9.699
209 HD12 LEU 31 HD12 LEU 31 7.783 -8.391 9.601
210 HD13 LEU 31 HD13 LEU 31 6.161 -9.113 9.683
211 HD21 LEU 31 HD21 LEU 31 6.570 -10.377 7.592
212 HD22 LEU 31 HD22 LEU 31 8.216 -9.693 7.570
213 HD23 LEU 31 HD23 LEU 31 7.183 -9.537 6.151
214 H GLY 32 H GLY 32 4.307 -8.756 4.555
215 HA2 GLY 32 HA2 GLY 32 6.851 -9.331 3.073
216 HA3 GLY 32 HA3 GLY 32 5.422 -10.360 3.128
217 H VAL 33 H VAL 33 3.975 -7.493 2.552
218 HA VAL 33 HA VAL 33 3.194 -8.494 0.098
219 HB VAL 33 HB VAL 33 1.958 -6.911 1.657
220 HG11 VAL 33 HG11 VAL 33 3.548 -4.966 1.506
221 HG12 VAL 33 HG12 VAL 33 3.057 -4.749 -0.188
222 HG13 VAL 33 HG13 VAL 33 1.867 -4.570 1.112
223 HG21 VAL 33 HG21 VAL 33 1.713 -6.506 -1.346
224 HG22 VAL 33 HG22 VAL 33 1.054 -7.879 -0.426
225 HG23 VAL 33 HG23 VAL 33 0.457 -6.249 -0.120
226 H THR 34 H THR 34 5.720 -6.032 0.538
227 HA THR 34 HA THR 34 6.003 -5.295 -2.237
228 HB THR 34 HB THR 34 8.341 -4.632 -1.588
229 HG1 THR 34 HG1 THR 34 7.571 -5.358 1.033
230 HG21 THR 34 HG21 THR 34 6.175 -3.668 0.316
231 HG22 THR 34 HG22 THR 34 6.489 -3.046 -1.318
232 HG23 THR 34 HG23 THR 34 7.716 -2.858 -0.057
233 H ARG 35 H ARG 35 6.948 -8.165 -0.557
234 HA ARG 35 HA ARG 35 8.652 -9.162 -2.767
235 HB2 ARG 35 HB2 ARG 35 9.476 -9.294 -0.447
236 HB3 ARG 35 HB3 ARG 35 8.069 -10.242 0.016
237 HG2 ARG 35 HG2 ARG 35 9.970 -11.683 -0.214
238 HG3 ARG 35 HG3 ARG 35 8.798 -12.088 -1.464
239 HD2 ARG 35 HD2 ARG 35 10.142 -10.855 -3.141
240 HD3 ARG 35 HD3 ARG 35 11.284 -10.372 -1.867
241 HE ARG 35 HE ARG 35 10.891 -13.243 -2.030
242 HH11 ARG 35 HH11 ARG 35 12.772 -10.556 -3.434
243 HH12 ARG 35 HH12 ARG 35 14.085 -11.602 -3.929
244 HH21 ARG 35 HH21 ARG 35 12.611 -14.552 -2.683
245 HH22 ARG 35 HH22 ARG 35 13.992 -13.863 -3.505
246 H GLN 36 H GLN 36 5.491 -9.685 -1.264
247 HA GLN 36 HA GLN 36 5.080 -12.198 -2.742
248 HB2 GLN 36 HB2 GLN 36 3.331 -10.850 -0.683
249 HB3 GLN 36 HB3 GLN 36 3.094 -12.461 -1.348
250 HG2 GLN 36 HG2 GLN 36 5.433 -11.571 0.388
251 HG3 GLN 36 HG3 GLN 36 4.083 -12.555 0.888
252 HE21 GLN 36 HE21 GLN 36 3.881 -14.763 -0.319
253 HE22 GLN 36 HE22 GLN 36 5.438 -15.560 -0.407
254 H ARG 37 H ARG 37 3.991 -8.879 -3.205
255 HA ARG 37 HA ARG 37 2.300 -9.870 -5.468
256 HB2 ARG 37 HB2 ARG 37 1.548 -7.946 -3.303
257 HB3 ARG 37 HB3 ARG 37 1.032 -7.558 -4.948
258 HG2 ARG 37 HG2 ARG 37 0.044 -9.807 -5.205
259 HG3 ARG 37 HG3 ARG 37 0.492 -10.213 -3.545
260 HD2 ARG 37 HD2 ARG 37 -1.293 -7.850 -4.277
261 HD3 ARG 37 HD3 ARG 37 -1.926 -9.467 -3.976
262 HE ARG 37 HE ARG 37 -0.776 -7.597 -2.013
263 HH11 ARG 37 HH11 ARG 37 -2.039 -10.889 -2.564
264 HH12 ARG 37 HH12 ARG 37 -2.335 -11.166 -0.861
265 HH21 ARG 37 HH21 ARG 37 -1.181 -7.995 0.162
266 HH22 ARG 37 HH22 ARG 37 -1.848 -9.526 0.683
267 H ASP 38 H ASP 38 1.848 -8.228 -7.111
268 HA ASP 38 HA ASP 38 4.232 -7.804 -8.475
269 HB2 ASP 38 HB2 ASP 38 1.407 -6.817 -8.930
270 HB3 ASP 38 HB3 ASP 38 2.719 -6.380 -10.025
271 H ALA 39 H ALA 39 5.763 -6.379 -8.563
272 HA ALA 39 HA ALA 39 5.929 -4.697 -6.307
273 HB1 ALA 39 HB1 ALA 39 8.295 -4.453 -7.113
274 HB2 ALA 39 HB2 ALA 39 7.731 -6.135 -7.131
275 HB3 ALA 39 HB3 ALA 39 7.825 -5.209 -8.645
276 H ASN 40 H ASN 40 5.642 -3.739 -9.748
277 HA ASN 40 HA ASN 40 5.978 -0.871 -9.144
278 HB2 ASN 40 HB2 ASN 40 6.640 -1.756 -11.331
279 HB3 ASN 40 HB3 ASN 40 5.012 -2.386 -11.610
280 HD21 ASN 40 HD21 ASN 40 3.775 -1.111 -12.938
281 HD22 ASN 40 HD22 ASN 40 4.131 0.608 -13.185
282 H TRP 41 H TRP 41 3.280 -3.097 -9.863
283 HA TRP 41 HA TRP 41 1.151 -1.257 -9.892
284 HB2 TRP 41 HB2 TRP 41 0.959 -3.582 -10.619
285 HB3 TRP 41 HB3 TRP 41 1.209 -4.154 -8.973
286 HD1 TRP 41 HD1 TRP 41 -1.406 -2.499 -11.199
287 HE1 TRP 41 HE1 TRP 41 -3.721 -2.714 -10.136
288 HE3 TRP 41 HE3 TRP 41 -0.017 -4.395 -6.652
289 HZ2 TRP 41 HZ2 TRP 41 -4.820 -3.475 -7.562
290 HZ3 TRP 41 HZ3 TRP 41 -1.725 -4.818 -4.891
291 HH2 TRP 41 HH2 TRP 41 -4.121 -4.350 -5.336
292 H LEU 42 H LEU 42 2.513 -3.003 -7.048
293 HA LEU 42 HA LEU 42 0.820 -1.950 -5.055
294 HB2 LEU 42 HB2 LEU 42 3.734 -2.814 -5.136
295 HB3 LEU 42 HB3 LEU 42 3.031 -2.253 -3.634
296 HG LEU 42 HG LEU 42 1.876 -4.585 -5.221
297 HD11 LEU 42 HD11 LEU 42 2.991 -5.995 -3.547
298 HD12 LEU 42 HD12 LEU 42 3.732 -4.564 -2.800
299 HD13 LEU 42 HD13 LEU 42 4.174 -5.060 -4.453
300 HD21 LEU 42 HD21 LEU 42 0.750 -5.120 -3.095
301 HD22 LEU 42 HD22 LEU 42 0.250 -3.535 -3.679
302 HD23 LEU 42 HD23 LEU 42 1.432 -3.656 -2.352
303 H VAL 43 H VAL 43 3.641 -0.362 -6.542
304 HA VAL 43 HA VAL 43 3.609 1.804 -4.557
305 HB VAL 43 HB VAL 43 5.417 1.400 -6.962
306 HG11 VAL 43 HG11 VAL 43 5.660 3.256 -4.549
307 HG12 VAL 43 HG12 VAL 43 6.937 2.967 -5.749
308 HG13 VAL 43 HG13 VAL 43 5.438 3.755 -6.239
309 HG21 VAL 43 HG21 VAL 43 5.688 -0.418 -5.303
310 HG22 VAL 43 HG22 VAL 43 7.080 0.659 -5.252
311 HG23 VAL 43 HG23 VAL 43 5.831 0.763 -3.995
312 H ARG 44 H ARG 44 2.472 1.318 -7.850
313 HA ARG 44 HA ARG 44 1.526 4.083 -8.230
314 HB2 ARG 44 HB2 ARG 44 0.852 1.374 -9.442
315 HB3 ARG 44 HB3 ARG 44 -0.043 2.819 -9.881
316 HG2 ARG 44 HG2 ARG 44 2.994 2.676 -10.125
317 HG3 ARG 44 HG3 ARG 44 1.923 2.092 -11.397
318 HD2 ARG 44 HD2 ARG 44 1.847 4.937 -10.303
319 HD3 ARG 44 HD3 ARG 44 2.738 4.434 -11.750
320 HE ARG 44 HE ARG 44 0.106 3.525 -12.076
321 HH11 ARG 44 HH11 ARG 44 1.739 6.688 -11.848
322 HH12 ARG 44 HH12 ARG 44 0.540 7.491 -12.836
323 HH21 ARG 44 HH21 ARG 44 -1.418 4.603 -13.347
324 HH22 ARG 44 HH22 ARG 44 -1.247 6.312 -13.683
325 H TRP 45 H TRP 45 0.047 1.015 -7.063
326 HA TRP 45 HA TRP 45 -2.574 1.887 -6.688
327 HB2 TRP 45 HB2 TRP 45 -1.920 -0.460 -6.546
328 HB3 TRP 45 HB3 TRP 45 -0.999 -0.159 -5.076
329 HD1 TRP 45 HD1 TRP 45 -2.302 -0.259 -2.824
330 HE1 TRP 45 HE1 TRP 45 -4.809 -0.614 -2.150
331 HE3 TRP 45 HE3 TRP 45 -4.500 0.243 -7.385
332 HZ2 TRP 45 HZ2 TRP 45 -7.303 -0.973 -3.470
333 HZ3 TRP 45 HZ3 TRP 45 -6.982 0.021 -7.638
334 HH2 TRP 45 HH2 TRP 45 -8.377 -0.615 -5.687
335 H LEU 46 H LEU 46 0.011 1.937 -4.138
336 HA LEU 46 HA LEU 46 -1.823 3.096 -2.276
337 HB2 LEU 46 HB2 LEU 46 -0.244 2.863 -0.718
338 HB3 LEU 46 HB3 LEU 46 0.370 1.737 -1.926
339 HG LEU 46 HG LEU 46 1.475 4.477 -1.199
340 HD11 LEU 46 HD11 LEU 46 3.446 3.155 -0.621
341 HD12 LEU 46 HD12 LEU 46 2.681 1.674 -1.239
342 HD13 LEU 46 HD13 LEU 46 2.047 2.476 0.212
343 HD21 LEU 46 HD21 LEU 46 1.881 4.485 -3.521
344 HD22 LEU 46 HD22 LEU 46 1.978 2.720 -3.594
345 HD23 LEU 46 HD23 LEU 46 3.312 3.667 -2.917
346 H LYS 47 H LYS 47 -0.260 4.613 -4.845
347 HA LYS 47 HA LYS 47 -0.372 7.340 -3.691
348 HB2 LYS 47 HB2 LYS 47 0.885 6.070 -6.111
349 HB3 LYS 47 HB3 LYS 47 0.303 7.714 -6.314
350 HG2 LYS 47 HG2 LYS 47 1.553 8.364 -4.216
351 HG3 LYS 47 HG3 LYS 47 2.255 6.744 -4.192
352 HD2 LYS 47 HD2 LYS 47 2.597 8.785 -6.435
353 HD3 LYS 47 HD3 LYS 47 3.746 8.527 -5.122
354 HE2 LYS 47 HE2 LYS 47 4.046 6.152 -5.867
355 HE3 LYS 47 HE3 LYS 47 2.941 6.457 -7.203
356 HZ1 LYS 47 HZ1 LYS 47 4.520 8.222 -7.962
357 HZ2 LYS 47 HZ2 LYS 47 5.123 6.707 -8.005
358 HZ3 LYS 47 HZ3 LYS 47 5.612 7.758 -6.836
359 H VAL 48 H VAL 48 -2.038 5.479 -6.273
360 HA VAL 48 HA VAL 48 -4.230 7.497 -6.120
361 HB VAL 48 HB VAL 48 -2.571 8.115 -7.815
362 HG11 VAL 48 HG11 VAL 48 -1.985 5.866 -8.702
363 HG12 VAL 48 HG12 VAL 48 -3.560 5.814 -9.523
364 HG13 VAL 48 HG13 VAL 48 -2.388 7.066 -9.939
365 HG21 VAL 48 HG21 VAL 48 -4.768 9.033 -7.894
366 HG22 VAL 48 HG22 VAL 48 -4.208 8.711 -9.542
367 HG23 VAL 48 HG23 VAL 48 -5.388 7.630 -8.776
368 HA PRO 49 HA PRO 49 -5.507 2.962 -6.221
369 HB2 PRO 49 HB2 PRO 49 -6.985 2.816 -3.904
370 HB3 PRO 49 HB3 PRO 49 -5.212 2.629 -3.951
371 HG2 PRO 49 HG2 PRO 49 -6.808 5.128 -3.321
372 HG3 PRO 49 HG3 PRO 49 -5.426 4.450 -2.411
373 HD2 PRO 49 HD2 PRO 49 -5.163 6.494 -4.186
374 HD3 PRO 49 HD3 PRO 49 -3.898 5.254 -4.009
375 H ASP 50 H ASP 50 -7.577 5.702 -5.228
376 HA ASP 50 HA ASP 50 -10.068 4.589 -5.904
377 HB2 ASP 50 HB2 ASP 50 -9.671 6.596 -4.496
378 HB3 ASP 50 HB3 ASP 50 -9.204 7.513 -5.929
379 H GLN 51 H GLN 51 -7.751 6.273 -8.032
380 HA GLN 51 HA GLN 51 -9.616 6.366 -10.277
381 HB2 GLN 51 HB2 GLN 51 -7.725 8.027 -9.809
382 HB3 GLN 51 HB3 GLN 51 -6.612 6.768 -10.392
383 HG2 GLN 51 HG2 GLN 51 -7.786 6.713 -12.554
384 HG3 GLN 51 HG3 GLN 51 -8.953 7.904 -11.978
385 HE21 GLN 51 HE21 GLN 51 -6.198 7.579 -13.847
386 HE22 GLN 51 HE22 GLN 51 -5.761 9.293 -13.812
387 H MET 52 H MET 52 -6.934 4.223 -9.227
388 HA MET 52 HA MET 52 -6.897 2.553 -11.570
389 HB2 MET 52 HB2 MET 52 -5.075 2.657 -9.887
390 HB3 MET 52 HB3 MET 52 -6.152 1.951 -8.684
391 HG2 MET 52 HG2 MET 52 -4.875 0.127 -9.424
392 HG3 MET 52 HG3 MET 52 -6.383 -0.067 -10.277
393 HE1 MET 52 HE1 MET 52 -2.753 1.668 -10.712
394 HE2 MET 52 HE2 MET 52 -2.712 -0.066 -10.306
395 HE3 MET 52 HE3 MET 52 -2.176 0.479 -11.902
396 H LEU 53 H LEU 53 -8.800 2.314 -8.484
397 HA LEU 53 HA LEU 53 -10.118 -0.097 -9.355
398 HB2 LEU 53 HB2 LEU 53 -9.821 0.690 -6.974
399 HB3 LEU 53 HB3 LEU 53 -11.049 1.917 -7.275
400 HG LEU 53 HG LEU 53 -12.700 0.126 -7.763
401 HD11 LEU 53 HD11 LEU 53 -12.209 -2.230 -7.148
402 HD12 LEU 53 HD12 LEU 53 -10.497 -1.817 -6.924
403 HD13 LEU 53 HD13 LEU 53 -11.256 -1.729 -8.534
404 HD21 LEU 53 HD21 LEU 53 -11.263 -0.218 -5.093
405 HD22 LEU 53 HD22 LEU 53 -12.940 -0.680 -5.443
406 HD23 LEU 53 HD23 LEU 53 -12.469 1.027 -5.474
407 H ALA 54 H ALA 54 -10.981 3.384 -9.670
408 HA ALA 54 HA ALA 54 -13.522 2.904 -10.939
409 HB1 ALA 54 HB1 ALA 54 -11.666 5.314 -11.052
410 HB2 ALA 54 HB2 ALA 54 -13.372 5.281 -11.540
411 HB3 ALA 54 HB3 ALA 54 -12.938 5.021 -9.844
412 H GLU 55 H GLU 55 -10.242 2.910 -12.206
413 HA GLU 55 HA GLU 55 -10.831 2.929 -15.017
414 HB2 GLU 55 HB2 GLU 55 -8.656 3.475 -14.097
415 HB3 GLU 55 HB3 GLU 55 -8.483 1.893 -13.380
416 HG2 GLU 55 HG2 GLU 55 -8.046 0.824 -15.380
417 HG3 GLU 55 HG3 GLU 55 -8.794 2.087 -16.363
418 H LYS 56 H LYS 56 -11.528 0.570 -12.655
419 HA LYS 56 HA LYS 56 -12.040 -1.632 -12.646
420 HB2 LYS 56 HB2 LYS 56 -12.809 -1.237 -15.559
421 HB3 LYS 56 HB3 LYS 56 -13.297 -2.577 -14.521
422 HG2 LYS 56 HG2 LYS 56 -14.500 -1.056 -13.024
423 HG3 LYS 56 HG3 LYS 56 -14.001 0.348 -13.970
424 HD2 LYS 56 HD2 LYS 56 -15.742 -1.911 -15.024
425 HD3 LYS 56 HD3 LYS 56 -16.327 -0.357 -14.410
426 HE2 LYS 56 HE2 LYS 56 -14.990 0.825 -16.169
427 HE3 LYS 56 HE3 LYS 56 -14.512 -0.743 -16.831
428 HZ1 LYS 56 HZ1 LYS 56 -17.290 0.282 -16.644
429 HZ2 LYS 56 HZ2 LYS 56 -16.862 -1.213 -17.222
430 HZ3 LYS 56 HZ3 LYS 56 -16.402 0.143 -18.022
431 H ASP 57 H ASP 57 -9.496 -1.257 -12.619
432 HA ASP 57 HA ASP 57 -7.967 -2.782 -14.600
433 HB2 ASP 57 HB2 ASP 57 -6.963 -0.802 -13.459
434 HB3 ASP 57 HB3 ASP 57 -7.081 -1.670 -11.918
435 HA PRO 58 HA PRO 58 -9.942 -6.011 -12.673
436 HB2 PRO 58 HB2 PRO 58 -9.130 -8.110 -14.138
437 HB3 PRO 58 HB3 PRO 58 -9.953 -6.627 -14.775
438 HG2 PRO 58 HG2 PRO 58 -6.931 -6.978 -14.745
439 HG3 PRO 58 HG3 PRO 58 -7.981 -6.859 -16.214
440 HD2 PRO 58 HD2 PRO 58 -6.894 -4.706 -15.055
441 HD3 PRO 58 HD3 PRO 58 -8.613 -4.659 -15.564
442 H LEU 59 H LEU 59 -6.483 -6.018 -12.485
443 HA LEU 59 HA LEU 59 -6.173 -8.050 -10.430
444 HB2 LEU 59 HB2 LEU 59 -4.258 -7.246 -11.706
445 HB3 LEU 59 HB3 LEU 59 -4.512 -5.599 -11.140
446 HG LEU 59 HG LEU 59 -3.896 -6.208 -8.862
447 HD11 LEU 59 HD11 LEU 59 -3.555 -9.050 -9.913
448 HD12 LEU 59 HD12 LEU 59 -4.694 -8.507 -8.665
449 HD13 LEU 59 HD13 LEU 59 -2.971 -8.456 -8.327
450 HD21 LEU 59 HD21 LEU 59 -2.128 -5.629 -10.490
451 HD22 LEU 59 HD22 LEU 59 -1.913 -7.340 -10.879
452 HD23 LEU 59 HD23 LEU 59 -1.541 -6.734 -9.240
453 H ALA 60 H ALA 60 -6.913 -4.510 -10.290
454 HA ALA 60 HA ALA 60 -6.952 -4.501 -7.367
455 HB1 ALA 60 HB1 ALA 60 -6.534 -2.460 -8.663
456 HB2 ALA 60 HB2 ALA 60 -8.165 -2.572 -9.376
457 HB3 ALA 60 HB3 ALA 60 -7.978 -2.328 -7.627
458 H MET 61 H MET 61 -9.507 -4.599 -9.899
459 HA MET 61 HA MET 61 -11.758 -4.760 -8.180
460 HB2 MET 61 HB2 MET 61 -11.282 -5.989 -10.923
461 HB3 MET 61 HB3 MET 61 -12.857 -5.718 -10.188
462 HG2 MET 61 HG2 MET 61 -10.961 -3.392 -10.653
463 HG3 MET 61 HG3 MET 61 -11.922 -4.043 -11.967
464 HE1 MET 61 HE1 MET 61 -15.494 -3.208 -11.241
465 HE2 MET 61 HE2 MET 61 -14.254 -3.882 -12.333
466 HE3 MET 61 HE3 MET 61 -14.711 -4.760 -10.860
467 H LEU 62 H LEU 62 -9.476 -7.315 -9.139
468 HA LEU 62 HA LEU 62 -10.890 -9.500 -7.848
469 HB2 LEU 62 HB2 LEU 62 -9.260 -9.767 -9.685
470 HB3 LEU 62 HB3 LEU 62 -8.031 -8.997 -8.665
471 HG LEU 62 HG LEU 62 -8.109 -10.859 -7.096
472 HD11 LEU 62 HD11 LEU 62 -10.068 -12.141 -9.058
473 HD12 LEU 62 HD12 LEU 62 -10.434 -11.658 -7.384
474 HD13 LEU 62 HD13 LEU 62 -9.294 -12.965 -7.692
475 HD21 LEU 62 HD21 LEU 62 -7.044 -12.535 -8.546
476 HD22 LEU 62 HD22 LEU 62 -6.538 -10.902 -8.997
477 HD23 LEU 62 HD23 LEU 62 -7.744 -11.756 -9.984
478 H LEU 63 H LEU 63 -8.041 -7.370 -6.943
479 HA LEU 63 HA LEU 63 -7.508 -9.011 -4.666
480 HB2 LEU 63 HB2 LEU 63 -5.856 -7.825 -6.021
481 HB3 LEU 63 HB3 LEU 63 -6.512 -6.266 -5.562
482 HG LEU 63 HG LEU 63 -4.342 -6.965 -4.520
483 HD11 LEU 63 HD11 LEU 63 -5.854 -5.212 -3.543
484 HD12 LEU 63 HD12 LEU 63 -4.729 -5.986 -2.408
485 HD13 LEU 63 HD13 LEU 63 -6.438 -6.436 -2.396
486 HD21 LEU 63 HD21 LEU 63 -4.848 -9.328 -4.125
487 HD22 LEU 63 HD22 LEU 63 -6.066 -8.890 -2.913
488 HD23 LEU 63 HD23 LEU 63 -4.366 -8.509 -2.624
489 H PHE 64 H PHE 64 -9.268 -5.991 -5.099
490 HA PHE 64 HA PHE 64 -9.266 -5.380 -2.265
491 HB2 PHE 64 HB2 PHE 64 -10.103 -3.423 -2.795
492 HB3 PHE 64 HB3 PHE 64 -9.721 -3.854 -4.439
493 HD1 PHE 64 HD2 PHE 64 -11.708 -5.068 -5.789
494 HD2 PHE 64 HD1 PHE 64 -12.223 -2.711 -2.217
495 HE1 PHE 64 HE2 PHE 64 -14.105 -4.711 -6.364
496 HE2 PHE 64 HE1 PHE 64 -14.579 -2.330 -2.799
497 HZ PHE 64 HZ PHE 64 -15.550 -3.347 -4.872
498 H GLU 65 H GLU 65 -11.707 -7.084 -4.287
499 HA GLU 65 HA GLU 65 -13.512 -7.381 -2.069
500 HB2 GLU 65 HB2 GLU 65 -14.820 -8.837 -3.327
501 HB3 GLU 65 HB3 GLU 65 -14.282 -7.542 -4.386
502 HG2 GLU 65 HG2 GLU 65 -12.707 -9.015 -5.496
503 HG3 GLU 65 HG3 GLU 65 -12.998 -10.297 -4.307
504 H GLN 66 H GLN 66 -10.473 -8.896 -2.473
505 HA GLN 66 HA GLN 66 -11.192 -11.329 -1.076
506 HB2 GLN 66 HB2 GLN 66 -8.397 -10.122 -1.288
507 HB3 GLN 66 HB3 GLN 66 -8.808 -11.793 -0.931
508 HG2 GLN 66 HG2 GLN 66 -9.006 -10.346 -3.567
509 HG3 GLN 66 HG3 GLN 66 -7.961 -11.690 -3.160
510 HE21 GLN 66 HE21 GLN 66 -10.690 -10.909 -4.847
511 HE22 GLN 66 HE22 GLN 66 -11.536 -12.459 -4.807
512 H TYR 67 H TYR 67 -10.791 -8.165 0.068
513 HA TYR 67 HA TYR 67 -10.370 -9.152 2.866
514 HB2 TYR 67 HB2 TYR 67 -9.584 -6.495 1.636
515 HB3 TYR 67 HB3 TYR 67 -9.361 -6.961 3.323
516 HD1 TYR 67 HD1 TYR 67 -7.839 -8.888 3.918
517 HD2 TYR 67 HD2 TYR 67 -8.034 -7.235 -0.069
518 HE1 TYR 67 HE1 TYR 67 -5.694 -9.994 3.357
519 HE2 TYR 67 HE2 TYR 67 -5.868 -8.329 -0.620
520 HH TYR 67 HH TYR 67 -4.064 -10.208 1.827
521 H ASN 68 H ASN 68 -12.884 -9.364 1.885
522 HA ASN 68 HA ASN 68 -15.030 -8.682 1.845
523 HB2 ASN 68 HB2 ASN 68 -14.274 -7.508 4.542
524 HB3 ASN 68 HB3 ASN 68 -15.917 -7.675 3.943
525 HD21 ASN 68 HD21 ASN 68 -15.665 -8.743 6.220
526 HD22 ASN 68 HD22 ASN 68 -15.608 -10.509 6.109
527 H ARG 69 H ARG 69 -13.483 -7.154 0.220
528 HA ARG 69 HA ARG 69 -13.589 -5.309 -1.105
529 HB2 ARG 69 HB2 ARG 69 -16.306 -4.854 0.123
530 HB3 ARG 69 HB3 ARG 69 -15.706 -4.135 -1.371
531 HG2 ARG 69 HG2 ARG 69 -15.585 -6.302 -2.458
532 HG3 ARG 69 HG3 ARG 69 -16.008 -7.145 -0.970
533 HD2 ARG 69 HD2 ARG 69 -17.783 -5.272 -2.573
534 HD3 ARG 69 HD3 ARG 69 -17.954 -7.025 -2.424
535 HE ARG 69 HE ARG 69 -18.946 -5.004 -0.646
536 HH11 ARG 69 HH11 ARG 69 -17.685 -8.348 -0.532
537 HH12 ARG 69 HH12 ARG 69 -18.492 -8.696 0.981
538 HH21 ARG 69 HH21 ARG 69 -19.951 -5.508 1.300
539 HH22 ARG 69 HH22 ARG 69 -19.769 -7.095 2.014
540 H LEU 70 H LEU 70 -15.485 -3.175 0.770
541 HA LEU 70 HA LEU 70 -15.090 -1.142 1.624
542 HB2 LEU 70 HB2 LEU 70 -13.787 -2.687 3.286
543 HB3 LEU 70 HB3 LEU 70 -12.347 -1.985 2.568
544 HG LEU 70 HG LEU 70 -13.127 0.282 3.309
545 HD11 LEU 70 HD11 LEU 70 -15.343 -1.297 4.691
546 HD12 LEU 70 HD12 LEU 70 -15.566 -0.060 3.435
547 HD13 LEU 70 HD13 LEU 70 -14.938 0.405 5.012
548 HD21 LEU 70 HD21 LEU 70 -11.603 -1.061 4.694
549 HD22 LEU 70 HD22 LEU 70 -12.987 -1.842 5.484
550 HD23 LEU 70 HD23 LEU 70 -12.698 -0.095 5.695
551 H ALA 71 H ALA 71 -12.384 0.294 1.671
552 HA ALA 71 HA ALA 71 -11.482 0.399 -1.079
553 HB1 ALA 71 HB1 ALA 71 -13.116 2.753 -0.002
554 HB2 ALA 71 HB2 ALA 71 -12.300 2.648 -1.573
555 HB3 ALA 71 HB3 ALA 71 -13.683 1.604 -1.229
556 H MET 72 H MET 72 -9.871 2.233 -1.374
557 HA MET 72 HA MET 72 -9.007 3.679 1.065
558 HB2 MET 72 HB2 MET 72 -7.527 1.720 0.698
559 HB3 MET 72 HB3 MET 72 -7.129 2.333 -0.915
560 HG2 MET 72 HG2 MET 72 -6.071 4.314 0.071
561 HG3 MET 72 HG3 MET 72 -6.639 3.838 1.678
562 HE1 MET 72 HE1 MET 72 -3.916 3.336 -1.083
563 HE2 MET 72 HE2 MET 72 -3.186 1.783 -0.636
564 HE3 MET 72 HE3 MET 72 -4.844 1.830 -1.270
565 HA PRO 73 HA PRO 73 -9.200 6.952 -2.032
566 HB2 PRO 73 HB2 PRO 73 -8.827 9.145 -0.507
567 HB3 PRO 73 HB3 PRO 73 -10.220 8.052 -0.239
568 HG2 PRO 73 HG2 PRO 73 -7.572 8.086 1.245
569 HG3 PRO 73 HG3 PRO 73 -9.226 8.078 1.937
570 HD2 PRO 73 HD2 PRO 73 -7.713 5.799 1.585
571 HD3 PRO 73 HD3 PRO 73 -9.500 5.805 1.495
572 H ASN 74 H ASN 74 -7.992 8.845 -2.919
573 HA ASN 74 HA ASN 74 -5.036 8.528 -3.006
574 HB2 ASN 74 HB2 ASN 74 -6.196 9.026 -5.094
575 HB3 ASN 74 HB3 ASN 74 -6.971 10.435 -4.376
576 HD21 ASN 74 HD21 ASN 74 -5.862 11.067 -6.594
577 HD22 ASN 74 HD22 ASN 74 -4.328 11.882 -6.361
578 H MET 75 H MET 75 -4.064 9.149 -1.180
579 HA MET 75 HA MET 75 -5.096 11.379 0.452
580 HB2 MET 75 HB2 MET 75 -2.865 9.369 0.924
581 HB3 MET 75 HB3 MET 75 -3.396 10.585 2.090
582 HG2 MET 75 HG2 MET 75 -5.625 9.577 2.185
583 HG3 MET 75 HG3 MET 75 -5.180 8.416 0.934
584 HE1 MET 75 HE1 MET 75 -3.590 8.314 5.300
585 HE2 MET 75 HE2 MET 75 -3.079 9.587 4.175
586 HE3 MET 75 HE3 MET 75 -4.779 9.480 4.685
587 H ARG 76 H ARG 76 -3.206 11.456 -2.195
588 HA ARG 76 HA ARG 76 -1.545 12.708 -3.037
589 HB2 ARG 76 HB2 ARG 76 -2.742 14.858 -1.268
590 HB3 ARG 76 HB3 ARG 76 -1.712 15.111 -2.688
591 HG2 ARG 76 HG2 ARG 76 -3.433 13.821 -4.055
592 HG3 ARG 76 HG3 ARG 76 -4.505 13.890 -2.649
593 HD2 ARG 76 HD2 ARG 76 -3.360 16.266 -4.176
594 HD3 ARG 76 HD3 ARG 76 -5.016 15.651 -4.273
595 HE ARG 76 HE ARG 76 -4.109 16.421 -1.592
596 HH11 ARG 76 HH11 ARG 76 -5.817 17.529 -4.528
597 HH12 ARG 76 HH12 ARG 76 -6.575 18.873 -3.701
598 HH21 ARG 76 HH21 ARG 76 -5.107 18.183 -0.573
599 HH22 ARG 76 HH22 ARG 76 -6.174 19.240 -1.471
600 H LEU 77 H LEU 77 -0.197 11.149 -1.698
601 HA LEU 77 HA LEU 77 1.646 12.360 0.262
602 HB2 LEU 77 HB2 LEU 77 1.937 9.838 -1.423
603 HB3 LEU 77 HB3 LEU 77 2.957 10.336 -0.085
604 HG LEU 77 HG LEU 77 1.738 8.606 0.768
605 HD11 LEU 77 HD11 LEU 77 0.331 9.496 2.534
606 HD12 LEU 77 HD12 LEU 77 0.149 11.032 1.664
607 HD13 LEU 77 HD13 LEU 77 1.744 10.534 2.286
608 HD21 LEU 77 HD21 LEU 77 0.022 8.403 -0.988
609 HD22 LEU 77 HD22 LEU 77 -0.880 9.738 -0.255
610 HD23 LEU 77 HD23 LEU 77 -0.640 8.232 0.644
611 H GLY 78 H GLY 78 3.964 12.703 -0.228
612 HA2 GLY 78 HA2 GLY 78 4.559 13.628 -2.988
613 HA3 GLY 78 HA3 GLY 78 5.632 13.691 -1.596
614 H ASP 79 H ASP 79 6.009 12.545 -4.441
615 HA ASP 79 HA ASP 79 6.183 9.706 -4.306
616 HB2 ASP 79 HB2 ASP 79 6.289 10.957 -6.397
617 HB3 ASP 79 HB3 ASP 79 7.828 11.677 -5.927
618 H ALA 80 H ALA 80 8.537 12.132 -3.111
619 HA ALA 80 HA ALA 80 10.584 10.139 -2.547
620 HB1 ALA 80 HB1 ALA 80 11.101 12.521 -2.952
621 HB2 ALA 80 HB2 ALA 80 10.227 12.964 -1.470
622 HB3 ALA 80 HB3 ALA 80 11.697 11.978 -1.375
623 H GLU 81 H GLU 81 7.838 11.421 -0.738
624 HA GLU 81 HA GLU 81 8.446 10.207 1.838
625 HB2 GLU 81 HB2 GLU 81 7.130 12.065 2.039
626 HB3 GLU 81 HB3 GLU 81 6.293 11.808 0.519
627 HG2 GLU 81 HG2 GLU 81 4.863 10.113 1.507
628 HG3 GLU 81 HG3 GLU 81 5.718 10.260 3.050
629 H VAL 82 H VAL 82 6.477 9.327 -1.015
630 HA VAL 82 HA VAL 82 5.612 6.764 -0.005
631 HB VAL 82 HB VAL 82 5.907 7.849 -2.828
632 HG11 VAL 82 HG11 VAL 82 4.725 5.200 -1.900
633 HG12 VAL 82 HG12 VAL 82 4.441 5.923 -3.501
634 HG13 VAL 82 HG13 VAL 82 6.069 5.427 -3.044
635 HG21 VAL 82 HG21 VAL 82 3.477 8.025 -2.692
636 HG22 VAL 82 HG22 VAL 82 3.462 7.250 -1.091
637 HG23 VAL 82 HG23 VAL 82 4.182 8.856 -1.318
638 H SER 83 H SER 83 8.446 7.646 -2.084
639 HA SER 83 HA SER 83 9.507 5.020 -2.273
640 HB2 SER 83 HB2 SER 83 10.361 6.866 -3.603
641 HB3 SER 83 HB3 SER 83 10.900 7.730 -2.150
642 HG SER 83 HG SER 83 12.534 6.521 -3.311
643 H ALA 84 H ALA 84 9.951 7.427 0.371
644 HA ALA 84 HA ALA 84 11.731 5.858 1.953
645 HB1 ALA 84 HB1 ALA 84 9.667 7.969 2.710
646 HB2 ALA 84 HB2 ALA 84 10.911 7.342 3.798
647 HB3 ALA 84 HB3 ALA 84 11.379 8.237 2.337
648 H LEU 85 H LEU 85 8.112 5.898 1.890
649 HA LEU 85 HA LEU 85 7.733 3.882 3.908
650 HB2 LEU 85 HB2 LEU 85 6.060 4.758 1.527
651 HB3 LEU 85 HB3 LEU 85 5.533 3.514 2.628
652 HG LEU 85 HG LEU 85 6.276 6.292 3.636
653 HD11 LEU 85 HD11 LEU 85 3.802 6.741 3.571
654 HD12 LEU 85 HD12 LEU 85 3.598 5.261 2.606
655 HD13 LEU 85 HD13 LEU 85 4.542 6.627 1.974
656 HD21 LEU 85 HD21 LEU 85 4.706 5.631 5.449
657 HD22 LEU 85 HD22 LEU 85 6.093 4.538 5.350
658 HD23 LEU 85 HD23 LEU 85 4.510 4.039 4.705
659 H ILE 86 H ILE 86 8.342 3.572 0.399
660 HA ILE 86 HA ILE 86 7.946 0.696 0.313
661 HB ILE 86 HB ILE 86 9.648 2.321 -1.590
662 HG12 ILE 86 HG12 ILE 86 7.679 3.468 -1.925
663 HG13 ILE 86 HG13 ILE 86 7.584 2.228 -3.112
664 HG21 ILE 86 HG21 ILE 86 9.110 0.563 -3.189
665 HG22 ILE 86 HG22 ILE 86 9.868 -0.143 -1.770
666 HG23 ILE 86 HG23 ILE 86 8.114 -0.285 -1.984
667 HD11 ILE 86 HD11 ILE 86 5.417 2.472 -2.124
668 HD12 ILE 86 HD12 ILE 86 6.055 0.916 -1.554
669 HD13 ILE 86 HD13 ILE 86 6.051 2.337 -0.483
670 H SER 87 H SER 87 10.784 2.803 0.819
671 HA SER 87 HA SER 87 12.729 0.713 1.151
672 HB2 SER 87 HB2 SER 87 12.701 3.597 2.110
673 HB3 SER 87 HB3 SER 87 14.109 2.523 2.113
674 HG SER 87 HG SER 87 14.047 2.377 -0.087
675 H TYR 88 H TYR 88 10.354 2.067 3.437
676 HA TYR 88 HA TYR 88 11.579 0.645 5.710
677 HB2 TYR 88 HB2 TYR 88 10.350 2.506 6.350
678 HB3 TYR 88 HB3 TYR 88 9.003 2.129 5.274
679 HD1 TYR 88 HD1 TYR 88 10.747 0.126 7.976
680 HD2 TYR 88 HD2 TYR 88 7.058 1.819 6.513
681 HE1 TYR 88 HE1 TYR 88 9.501 -1.051 9.764
682 HE2 TYR 88 HE2 TYR 88 5.814 0.635 8.323
683 HH TYR 88 HH TYR 88 7.436 -1.678 10.509
684 H LEU 89 H LEU 89 8.832 -0.045 3.488
685 HA LEU 89 HA LEU 89 7.949 -2.351 4.851
686 HB2 LEU 89 HB2 LEU 89 7.809 -1.510 1.934
687 HB3 LEU 89 HB3 LEU 89 7.013 -2.964 2.528
688 HG LEU 89 HG LEU 89 6.439 -0.175 3.617
689 HD11 LEU 89 HD11 LEU 89 4.854 -1.880 1.653
690 HD12 LEU 89 HD12 LEU 89 5.762 -0.402 1.251
691 HD13 LEU 89 HD13 LEU 89 4.359 -0.306 2.327
692 HD21 LEU 89 HD21 LEU 89 4.394 -1.277 4.523
693 HD22 LEU 89 HD22 LEU 89 5.879 -1.877 5.258
694 HD23 LEU 89 HD23 LEU 89 5.061 -2.852 4.017
695 H GLU 90 H GLU 90 10.496 -2.214 2.333
696 HA GLU 90 HA GLU 90 11.013 -5.039 2.393
697 HB2 GLU 90 HB2 GLU 90 11.620 -3.471 0.585
698 HB3 GLU 90 HB3 GLU 90 12.859 -2.752 1.609
699 HG2 GLU 90 HG2 GLU 90 12.831 -5.728 0.943
700 HG3 GLU 90 HG3 GLU 90 13.486 -4.548 -0.181
701 H GLU 91 H GLU 91 12.265 -2.414 4.496
702 HA GLU 91 HA GLU 91 14.293 -4.047 5.820
703 HB2 GLU 91 HB2 GLU 91 12.716 -1.582 6.693
704 HB3 GLU 91 HB3 GLU 91 13.853 -2.389 7.748
705 HG2 GLU 91 HG2 GLU 91 14.691 -1.351 5.021
706 HG3 GLU 91 HG3 GLU 91 14.655 -0.328 6.461
707 H GLU 92 H GLU 92 10.809 -3.414 6.427
708 HA GLU 92 HA GLU 92 10.762 -5.054 8.788
709 HB2 GLU 92 HB2 GLU 92 9.127 -3.160 8.004
710 HB3 GLU 92 HB3 GLU 92 8.309 -4.465 7.144
711 HG2 GLU 92 HG2 GLU 92 7.204 -4.251 9.232
712 HG3 GLU 92 HG3 GLU 92 8.184 -5.695 9.392
713 H THR 93 H THR 93 10.237 -5.866 5.350
714 HA THR 93 HA THR 93 9.526 -8.627 5.761
715 HB THR 93 HB THR 93 11.320 -7.647 3.507
716 HG1 THR 93 HG1 THR 93 8.587 -7.255 3.887
717 HG21 THR 93 HG21 THR 93 9.252 -9.874 3.714
718 HG22 THR 93 HG22 THR 93 11.015 -10.058 3.550
719 HG23 THR 93 HG23 THR 93 10.076 -9.387 2.217
720 H ALA 94 H ALA 94 12.751 -7.072 5.293
721 HA ALA 94 HA ALA 94 14.185 -9.513 5.340
722 HB1 ALA 94 HB1 ALA 94 14.951 -7.430 4.297
723 HB2 ALA 94 HB2 ALA 94 15.112 -6.665 5.892
724 HB3 ALA 94 HB3 ALA 94 16.154 -8.040 5.446
725 H ARG 95 H ARG 95 13.476 -7.234 7.990
726 HA ARG 95 HA ARG 95 15.031 -8.328 10.073
727 HB2 ARG 95 HB2 ARG 95 12.325 -6.962 9.985
728 HB3 ARG 95 HB3 ARG 95 13.040 -7.469 11.517
729 HG2 ARG 95 HG2 ARG 95 14.940 -6.049 11.263
730 HG3 ARG 95 HG3 ARG 95 14.562 -5.688 9.574
731 HD2 ARG 95 HD2 ARG 95 12.489 -4.541 10.252
732 HD3 ARG 95 HD3 ARG 95 12.818 -4.922 11.956
733 HE ARG 95 HE ARG 95 15.084 -3.591 11.043
734 HH11 ARG 95 HH11 ARG 95 11.618 -2.789 11.314
735 HH12 ARG 95 HH12 ARG 95 11.926 -1.085 11.564
736 HH21 ARG 95 HH21 ARG 95 15.437 -1.379 11.376
737 HH22 ARG 95 HH22 ARG 95 14.084 -0.288 11.596
738 H LEU 96 H LEU 96 11.938 -9.505 8.796
739 HA LEU 96 HA LEU 96 11.575 -11.466 10.912
740 HB2 LEU 96 HB2 LEU 96 9.905 -10.082 9.217
741 HB3 LEU 96 HB3 LEU 96 9.918 -11.613 8.441
742 HG LEU 96 HG LEU 96 7.998 -11.357 9.799
743 HD11 LEU 96 HD11 LEU 96 8.106 -13.321 11.169
744 HD12 LEU 96 HD12 LEU 96 9.886 -13.224 11.231
745 HD13 LEU 96 HD13 LEU 96 9.060 -13.566 9.684
746 HD21 LEU 96 HD21 LEU 96 8.108 -10.983 12.194
747 HD22 LEU 96 HD22 LEU 96 8.952 -9.693 11.305
748 HD23 LEU 96 HD23 LEU 96 9.888 -10.947 12.138
749 H GLN 97 H GLN 97 13.580 -11.518 8.250
750 HA GLN 97 HA GLN 97 14.727 -13.137 7.140
751 HB2 GLN 97 HB2 GLN 97 14.694 -14.079 10.016
752 HB3 GLN 97 HB3 GLN 97 15.882 -14.556 8.794
753 HG2 GLN 97 HG2 GLN 97 16.731 -12.315 8.594
754 HG3 GLN 97 HG3 GLN 97 15.483 -11.678 9.661
755 HE21 GLN 97 HE21 GLN 97 18.636 -13.036 9.578
756 HE22 GLN 97 HE22 GLN 97 18.799 -13.226 11.330
757 H THR 98 H THR 98 12.342 -13.767 6.241
758 HA THR 98 HA THR 98 12.286 -16.751 6.276
759 HB THR 98 HB THR 98 10.596 -16.210 7.777
760 HG1 THR 98 HG1 THR 98 9.496 -16.649 5.226
761 HG21 THR 98 HG21 THR 98 9.244 -14.393 5.749
762 HG22 THR 98 HG22 THR 98 10.079 -13.844 7.216
763 HG23 THR 98 HG23 THR 98 8.642 -14.864 7.344
764 HA PRO 99 HA PRO 99 12.302 -15.512 1.840
765 HB2 PRO 99 HB2 PRO 99 14.517 -16.953 1.110
766 HB3 PRO 99 HB3 PRO 99 14.589 -15.259 1.682
767 HG2 PRO 99 HG2 PRO 99 15.055 -17.793 3.283
768 HG3 PRO 99 HG3 PRO 99 16.056 -16.308 3.247
769 HD2 PRO 99 HD2 PRO 99 14.248 -16.733 5.215
770 HD3 PRO 99 HD3 PRO 99 14.516 -15.107 4.542
771 H VAL 100 H VAL 100 12.590 -18.371 3.736
772 HA VAL 100 HA VAL 100 11.724 -20.373 3.830
773 HB VAL 100 HB VAL 100 9.766 -18.877 4.041
774 HG11 VAL 100 HG11 VAL 100 7.936 -19.014 2.458
775 HG12 VAL 100 HG12 VAL 100 9.329 -18.293 1.661
776 HG13 VAL 100 HG13 VAL 100 8.899 -19.990 1.341
777 HG21 VAL 100 HG21 VAL 100 9.207 -21.732 3.153
778 HG22 VAL 100 HG22 VAL 100 9.760 -21.213 4.763
779 HG23 VAL 100 HG23 VAL 100 8.171 -20.715 4.170
780 H THR 101 H THR 101 11.420 -19.485 0.389
781 HA THR 101 HA THR 101 11.263 -22.260 -0.506
782 HB THR 101 HB THR 101 11.435 -21.269 -2.775
783 HG1 THR 101 HG1 THR 101 11.148 -18.814 -2.501
784 HG21 THR 101 HG21 THR 101 9.491 -19.667 -1.058
785 HG22 THR 101 HG22 THR 101 9.248 -21.367 -1.504
786 HG23 THR 101 HG23 THR 101 9.329 -20.132 -2.769
787 H ASN 102 H ASN 102 13.783 -20.659 0.764
788 HA ASN 102 HA ASN 102 15.970 -20.765 0.867
789 HB2 ASN 102 HB2 ASN 102 15.420 -23.046 1.452
790 HB3 ASN 102 HB3 ASN 102 15.480 -23.549 -0.243
791 HD21 ASN 102 HD21 ASN 102 17.457 -22.161 2.397
792 HD22 ASN 102 HD22 ASN 102 18.990 -22.663 1.684
793 H ARG 103 H ARG 103 15.223 -21.924 -2.435
794 HA ARG 103 HA ARG 103 16.352 -21.773 -4.390
795 HB2 ARG 103 HB2 ARG 103 16.695 -18.917 -3.424
796 HB3 ARG 103 HB3 ARG 103 16.890 -19.458 -5.099
797 HG2 ARG 103 HG2 ARG 103 14.555 -20.282 -5.130
798 HG3 ARG 103 HG3 ARG 103 14.321 -19.693 -3.472
799 HD2 ARG 103 HD2 ARG 103 14.770 -17.390 -4.192
800 HD3 ARG 103 HD3 ARG 103 15.080 -17.949 -5.850
801 HE ARG 103 HE ARG 103 12.531 -18.887 -5.135
802 HH11 ARG 103 HH11 ARG 103 14.086 -15.719 -5.655
803 HH12 ARG 103 HH12 ARG 103 12.600 -14.959 -6.179
804 HH21 ARG 103 HH21 ARG 103 10.630 -17.861 -5.827
805 HH22 ARG 103 HH22 ARG 103 10.647 -16.170 -6.276
806 H GLY 104 H GLY 104 18.050 -22.768 -2.252
807 HA2 GLY 104 HA2 GLY 104 20.114 -23.822 -2.489
808 HA3 GLY 104 HA3 GLY 104 20.602 -22.653 -3.715
809 H ILE 105 H ILE 105 19.481 -20.801 -1.101
810 HA ILE 105 HA ILE 105 22.163 -19.972 -0.463
811 HB ILE 105 HB ILE 105 19.524 -19.302 0.870
812 HG12 ILE 105 HG12 ILE 105 19.564 -18.584 -1.478
813 HG13 ILE 105 HG13 ILE 105 19.584 -17.222 -0.386
814 HG21 ILE 105 HG21 ILE 105 21.285 -18.809 2.462
815 HG22 ILE 105 HG22 ILE 105 22.256 -17.995 1.218
816 HG23 ILE 105 HG23 ILE 105 20.722 -17.295 1.760
817 HD11 ILE 105 HD11 ILE 105 22.015 -16.895 -0.797
818 HD12 ILE 105 HD12 ILE 105 21.982 -18.276 -1.922
819 HD13 ILE 105 HD13 ILE 105 21.049 -16.815 -2.275
820 HA PRO 106 HA PRO 106 22.796 -23.000 2.836
821 HB2 PRO 106 HB2 PRO 106 25.308 -22.344 3.627
822 HB3 PRO 106 HB3 PRO 106 24.967 -23.102 2.047
823 HG2 PRO 106 HG2 PRO 106 25.394 -20.156 2.634
824 HG3 PRO 106 HG3 PRO 106 26.136 -21.147 1.345
825 HD2 PRO 106 HD2 PRO 106 23.934 -19.580 0.916
826 HD3 PRO 106 HD3 PRO 106 24.179 -21.132 0.063
827 HHA HEC 107 HHA HEC 107 -4.635 -2.671 0.354
828 HHB HEC 107 HHB HEC 107 0.272 1.442 1.288
829 HHC HEC 107 HHC HEC 107 -3.439 4.934 5.267
830 HHD HEC 107 HHD HEC 107 -8.293 0.846 4.308
831 HMA1 HEC 107 HMA1 HEC 107 0.158 -0.890 -1.527
832 HMA2 HEC 107 HMA2 HEC 107 0.925 0.024 -0.229
833 HMA3 HEC 107 HMA3 HEC 107 0.750 -1.728 -0.082
834 HAA1 HEC 107 HAA1 HEC 107 -3.095 -3.160 -1.082
835 HAA2 HEC 107 HAA2 HEC 107 -1.642 -2.569 -1.826
836 HBA1 HEC 107 HBA1 HEC 107 -0.301 -3.985 -0.661
837 HBA2 HEC 107 HBA2 HEC 107 -1.125 -3.684 0.860
838 HMB1 HEC 107 HMB1 HEC 107 1.629 2.823 2.610
839 HMB2 HEC 107 HMB2 HEC 107 1.032 4.165 1.590
840 HMB3 HEC 107 HMB3 HEC 107 1.502 4.444 3.265
841 HAB HEC 107 HAB HEC 107 -1.602 5.839 5.161
842 HBB1 HEC 107 HBB1 HEC 107 -1.418 6.748 2.894
843 HBB2 HEC 107 HBB2 HEC 107 -0.408 7.579 4.091
844 HBB3 HEC 107 HBB3 HEC 107 0.333 6.460 2.935
845 HMC1 HEC 107 HMC1 HEC 107 -6.887 5.272 6.822
846 HMC2 HEC 107 HMC2 HEC 107 -5.144 5.173 7.062
847 HMC3 HEC 107 HMC3 HEC 107 -5.803 5.973 5.619
848 HAC HEC 107 HAC HEC 107 -8.486 1.751 6.197
849 HBC1 HEC 107 HBC1 HEC 107 -9.399 3.520 4.760
850 HBC2 HEC 107 HBC2 HEC 107 -10.163 3.464 6.351
851 HBC3 HEC 107 HBC3 HEC 107 -8.969 4.730 5.980
852 HMD1 HEC 107 HMD1 HEC 107 -9.277 -2.133 3.531
853 HMD2 HEC 107 HMD2 HEC 107 -9.611 -0.435 3.143
854 HMD3 HEC 107 HMD3 HEC 107 -9.628 -1.625 1.862
855 HAD1 HEC 107 HAD1 HEC 107 -6.743 -3.914 0.938
856 HAD2 HEC 107 HAD2 HEC 107 -8.366 -3.278 1.059
857 HBD1 HEC 107 HBD1 HEC 107 -6.375 -2.922 -1.138
858 HBD2 HEC 107 HBD2 HEC 107 -8.118 -3.110 -1.213
Start of MODEL 4
1 H SER 1 H SER 1 14.315 6.394 6.573
2 HA SER 1 HA SER 1 12.021 7.720 5.612
3 HB2 SER 1 HB2 SER 1 13.626 5.425 4.402
4 HB3 SER 1 HB3 SER 1 12.457 6.411 3.516
5 HG SER 1 HG SER 1 14.524 7.164 3.191
6 H GLY 2 H GLY 2 9.912 7.192 5.459
7 HA2 GLY 2 HA2 GLY 2 7.998 5.854 5.113
8 HA3 GLY 2 HA3 GLY 2 8.993 4.447 5.131
9 H GLU 3 H GLU 3 10.263 4.813 7.703
10 HA GLU 3 HA GLU 3 8.489 3.395 9.314
11 HB2 GLU 3 HB2 GLU 3 10.950 3.409 9.536
12 HB3 GLU 3 HB3 GLU 3 10.900 5.054 10.173
13 HG2 GLU 3 HG2 GLU 3 9.642 4.292 12.146
14 HG3 GLU 3 HG3 GLU 3 9.539 2.664 11.486
15 H GLN 4 H GLN 4 9.252 6.913 9.645
16 HA GLN 4 HA GLN 4 7.257 7.163 11.798
17 HB2 GLN 4 HB2 GLN 4 8.877 9.353 10.456
18 HB3 GLN 4 HB3 GLN 4 7.907 9.489 11.921
19 HG2 GLN 4 HG2 GLN 4 10.471 7.893 11.548
20 HG3 GLN 4 HG3 GLN 4 10.234 9.305 12.566
21 HE21 GLN 4 HE21 GLN 4 11.051 6.362 13.134
22 HE22 GLN 4 HE22 GLN 4 9.872 5.778 14.296
23 H ILE 5 H ILE 5 7.379 7.720 8.299
24 HA ILE 5 HA ILE 5 4.854 9.093 8.114
25 HB ILE 5 HB ILE 5 6.044 7.150 6.096
26 HG12 ILE 5 HG12 ILE 5 6.321 10.193 6.256
27 HG13 ILE 5 HG13 ILE 5 7.590 9.045 6.651
28 HG21 ILE 5 HG21 ILE 5 3.593 7.682 5.774
29 HG22 ILE 5 HG22 ILE 5 3.997 9.408 5.776
30 HG23 ILE 5 HG23 ILE 5 4.585 8.345 4.482
31 HD11 ILE 5 HD11 ILE 5 6.406 9.525 3.904
32 HD12 ILE 5 HD12 ILE 5 8.049 9.849 4.467
33 HD13 ILE 5 HD13 ILE 5 7.498 8.171 4.290
34 H PHE 6 H PHE 6 5.625 5.561 8.201
35 HA PHE 6 HA PHE 6 2.921 4.693 8.128
36 HB2 PHE 6 HB2 PHE 6 4.925 3.269 7.725
37 HB3 PHE 6 HB3 PHE 6 5.294 3.323 9.444
38 HD1 PHE 6 HD1 PHE 6 2.892 2.127 6.887
39 HD2 PHE 6 HD2 PHE 6 3.973 2.004 11.058
40 HE1 PHE 6 HE1 PHE 6 1.196 0.352 7.280
41 HE2 PHE 6 HE2 PHE 6 2.298 0.224 11.441
42 HZ PHE 6 HZ PHE 6 0.895 -0.595 9.558
43 H ARG 7 H ARG 7 4.967 5.536 10.932
44 HA ARG 7 HA ARG 7 3.058 4.876 12.962
45 HB2 ARG 7 HB2 ARG 7 5.576 5.199 13.120
46 HB3 ARG 7 HB3 ARG 7 5.268 6.939 13.170
47 HG2 ARG 7 HG2 ARG 7 3.912 6.623 15.234
48 HG3 ARG 7 HG3 ARG 7 4.164 4.864 15.126
49 HD2 ARG 7 HD2 ARG 7 6.647 5.271 15.293
50 HD3 ARG 7 HD3 ARG 7 6.309 6.993 15.500
51 HE ARG 7 HE ARG 7 5.442 6.624 17.639
52 HH11 ARG 7 HH11 ARG 7 6.475 3.504 16.226
53 HH12 ARG 7 HH12 ARG 7 6.517 2.710 17.783
54 HH21 ARG 7 HH21 ARG 7 5.549 5.553 19.617
55 HH22 ARG 7 HH22 ARG 7 5.987 3.863 19.694
56 H THR 8 H THR 8 3.327 7.723 10.924
57 HA THR 8 HA THR 8 1.387 9.221 12.627
58 HB THR 8 HB THR 8 2.063 11.203 11.271
59 HG1 THR 8 HG1 THR 8 4.203 9.580 10.432
60 HG21 THR 8 HG21 THR 8 4.369 9.762 12.662
61 HG22 THR 8 HG22 THR 8 3.161 10.803 13.436
62 HG23 THR 8 HG23 THR 8 4.292 11.491 12.261
63 H ARG 9 H ARG 9 1.489 7.750 9.423
64 HA ARG 9 HA ARG 9 -1.224 8.935 8.901
65 HB2 ARG 9 HB2 ARG 9 0.800 8.005 6.845
66 HB3 ARG 9 HB3 ARG 9 -0.712 8.875 6.562
67 HG2 ARG 9 HG2 ARG 9 0.262 10.823 7.874
68 HG3 ARG 9 HG3 ARG 9 1.803 9.942 7.899
69 HD2 ARG 9 HD2 ARG 9 1.647 9.819 5.356
70 HD3 ARG 9 HD3 ARG 9 0.293 10.954 5.467
71 HE ARG 9 HE ARG 9 2.728 11.785 6.867
72 HH11 ARG 9 HH11 ARG 9 0.977 11.941 3.767
73 HH12 ARG 9 HH12 ARG 9 1.914 13.295 3.184
74 HH21 ARG 9 HH21 ARG 9 3.905 13.552 6.083
75 HH22 ARG 9 HH22 ARG 9 3.565 14.214 4.500
76 H CYS 10 H CYS 10 0.247 5.873 9.487
77 HA CYS 10 HA CYS 10 -1.874 4.474 7.876
78 HB2 CYS 10 HB2 CYS 10 0.940 3.520 8.290
79 HB3 CYS 10 HB3 CYS 10 -0.246 2.880 7.167
80 H SER 11 H SER 11 -0.478 4.630 11.048
81 HA SER 11 HA SER 11 -0.606 1.784 11.614
82 HB2 SER 11 HB2 SER 11 -0.102 4.194 13.392
83 HB3 SER 11 HB3 SER 11 0.029 2.514 13.927
84 HG SER 11 HG SER 11 1.472 3.627 11.748
85 H SER 12 H SER 12 -3.194 3.938 11.479
86 HA SER 12 HA SER 12 -4.681 2.734 13.738
87 HB2 SER 12 HB2 SER 12 -5.770 4.721 11.736
88 HB3 SER 12 HB3 SER 12 -6.366 4.338 13.355
89 HG SER 12 HG SER 12 -5.241 6.106 13.773
90 H CYS 13 H CYS 13 -4.346 2.247 10.316
91 HA CYS 13 HA CYS 13 -6.682 0.345 10.316
92 HB2 CYS 13 HB2 CYS 13 -5.408 1.822 8.001
93 HB3 CYS 13 HB3 CYS 13 -6.736 0.679 7.886
94 H HIS 14 H HIS 14 -3.336 0.224 10.520
95 HA HIS 14 HA HIS 14 -3.180 -2.448 9.263
96 HB2 HIS 14 2HB HIS 14 -1.515 -0.037 8.440
97 HB3 HIS 14 3HB HIS 14 -1.100 -1.684 8.005
98 HD1 HIS 14 1HD HIS 14 -3.465 -2.982 6.815
99 HD2 HIS 14 2HD HIS 14 -2.422 1.032 6.429
100 HE1 HIS 14 1HE HIS 14 -4.546 -2.222 4.620
101 H THR 15 H THR 15 -0.944 -3.188 9.259
102 HA THR 15 HA THR 15 0.849 -2.633 11.519
103 HB THR 15 HB THR 15 0.927 -5.122 12.097
104 HG1 THR 15 HG1 THR 15 -0.208 -6.197 10.746
105 HG21 THR 15 HG21 THR 15 -0.987 -5.090 13.636
106 HG22 THR 15 HG22 THR 15 -1.639 -3.658 12.827
107 HG23 THR 15 HG23 THR 15 -0.078 -3.576 13.686
108 H VAL 16 H VAL 16 2.981 -3.578 11.186
109 HA VAL 16 HA VAL 16 3.354 -4.953 8.541
110 HB VAL 16 HB VAL 16 5.496 -3.230 9.805
111 HG11 VAL 16 HG11 VAL 16 5.140 -4.441 7.011
112 HG12 VAL 16 HG12 VAL 16 6.492 -3.419 7.543
113 HG13 VAL 16 HG13 VAL 16 6.273 -5.022 8.247
114 HG21 VAL 16 HG21 VAL 16 3.522 -2.519 7.592
115 HG22 VAL 16 HG22 VAL 16 3.720 -1.708 9.163
116 HG23 VAL 16 HG23 VAL 16 5.007 -1.614 7.966
117 H GLY 17 H GLY 17 2.779 -6.829 9.738
118 HA2 GLY 17 HA2 GLY 17 3.914 -8.934 9.938
119 HA3 GLY 17 HA3 GLY 17 5.258 -8.168 10.779
120 H ASN 18 H ASN 18 1.958 -7.435 11.788
121 HA ASN 18 HA ASN 18 2.159 -9.292 14.118
122 HB2 ASN 18 HB2 ASN 18 3.176 -7.244 14.948
123 HB3 ASN 18 HB3 ASN 18 1.873 -6.269 14.276
124 HD21 ASN 18 HD21 ASN 18 -0.157 -6.218 15.335
125 HD22 ASN 18 HD22 ASN 18 -0.344 -6.802 16.984
126 H THR 19 H THR 19 0.275 -10.436 14.114
127 HA THR 19 HA THR 19 -2.238 -9.171 13.203
128 HB THR 19 HB THR 19 -3.346 -11.232 13.880
129 HG1 THR 19 HG1 THR 19 -0.743 -12.143 14.562
130 HG21 THR 19 HG21 THR 19 -0.843 -11.850 12.255
131 HG22 THR 19 HG22 THR 19 -2.332 -11.120 11.623
132 HG23 THR 19 HG23 THR 19 -2.368 -12.762 12.280
133 H GLU 20 H GLU 20 -3.993 -8.642 14.482
134 HA GLU 20 HA GLU 20 -3.445 -8.237 17.404
135 HB2 GLU 20 HB2 GLU 20 -5.092 -6.616 15.452
136 HB3 GLU 20 HB3 GLU 20 -5.090 -6.349 17.192
137 HG2 GLU 20 HG2 GLU 20 -2.548 -6.196 15.509
138 HG3 GLU 20 HG3 GLU 20 -3.637 -4.834 15.730
139 HA PRO 21 HA PRO 21 -7.148 -10.760 17.889
140 HB2 PRO 21 HB2 PRO 21 -7.493 -10.644 20.588
141 HB3 PRO 21 HB3 PRO 21 -6.211 -11.611 19.801
142 HG2 PRO 21 HG2 PRO 21 -5.977 -8.869 21.055
143 HG3 PRO 21 HG3 PRO 21 -4.879 -10.268 21.237
144 HD2 PRO 21 HD2 PRO 21 -4.392 -8.214 19.473
145 HD3 PRO 21 HD3 PRO 21 -3.893 -9.901 19.150
146 H GLY 22 H GLY 22 -9.066 -10.044 17.275
147 HA2 GLY 22 HA2 GLY 22 -11.135 -8.942 17.412
148 HA3 GLY 22 HA3 GLY 22 -10.508 -7.886 18.670
149 H GLN 23 H GLN 23 -11.731 -6.308 17.433
150 HA GLN 23 HA GLN 23 -12.081 -4.652 15.895
151 HB2 GLN 23 HB2 GLN 23 -9.133 -4.214 16.451
152 HB3 GLN 23 HB3 GLN 23 -10.290 -3.013 15.861
153 HG2 GLN 23 HG2 GLN 23 -11.647 -3.516 18.001
154 HG3 GLN 23 HG3 GLN 23 -10.175 -4.308 18.599
155 HE21 GLN 23 HE21 GLN 23 -8.073 -2.762 18.124
156 HE22 GLN 23 HE22 GLN 23 -8.374 -1.079 18.549
157 HA PRO 24 HA PRO 24 -10.181 -6.528 12.117
158 HB2 PRO 24 HB2 PRO 24 -12.152 -8.066 11.065
159 HB3 PRO 24 HB3 PRO 24 -11.283 -8.578 12.547
160 HG2 PRO 24 HG2 PRO 24 -13.940 -7.092 12.375
161 HG3 PRO 24 HG3 PRO 24 -13.582 -8.600 13.276
162 HD2 PRO 24 HD2 PRO 24 -13.488 -6.120 14.457
163 HD3 PRO 24 HD3 PRO 24 -12.394 -7.456 14.922
164 H GLY 25 H GLY 25 -12.350 -4.140 12.556
165 HA2 GLY 25 HA2 GLY 25 -13.802 -3.889 10.118
166 HA3 GLY 25 HA3 GLY 25 -13.469 -2.586 11.266
167 H ILE 26 H ILE 26 -10.746 -2.345 11.114
168 HA ILE 26 HA ILE 26 -9.759 -2.803 8.458
169 HB ILE 26 HB ILE 26 -8.629 -0.240 8.955
170 HG12 ILE 26 HG12 ILE 26 -10.534 1.251 8.410
171 HG13 ILE 26 HG13 ILE 26 -11.666 -0.024 8.838
172 HG21 ILE 26 HG21 ILE 26 -9.550 0.136 6.661
173 HG22 ILE 26 HG22 ILE 26 -8.693 -1.408 6.841
174 HG23 ILE 26 HG23 ILE 26 -10.471 -1.356 6.825
175 HD11 ILE 26 HD11 ILE 26 -11.355 1.631 10.642
176 HD12 ILE 26 HD12 ILE 26 -10.780 0.049 11.188
177 HD13 ILE 26 HD13 ILE 26 -9.613 1.290 10.684
178 H GLY 27 H GLY 27 -8.082 -3.974 8.795
179 HA2 GLY 27 HA2 GLY 27 -5.827 -3.051 10.419
180 HA3 GLY 27 HA3 GLY 27 -6.644 -4.465 11.046
181 HA PRO 28 HA PRO 28 -5.053 -6.901 7.492
182 HB2 PRO 28 HB2 PRO 28 -4.373 -5.015 5.235
183 HB3 PRO 28 HB3 PRO 28 -5.032 -6.675 5.166
184 HG2 PRO 28 HG2 PRO 28 -6.668 -4.547 4.803
185 HG3 PRO 28 HG3 PRO 28 -7.201 -5.914 5.837
186 HD2 PRO 28 HD2 PRO 28 -6.012 -3.263 6.716
187 HD3 PRO 28 HD3 PRO 28 -7.457 -4.126 7.290
188 H ASP 29 H ASP 29 -3.047 -7.732 7.769
189 HA ASP 29 HA ASP 29 -0.832 -6.007 8.485
190 HB2 ASP 29 HB2 ASP 29 -1.386 -8.189 9.602
191 HB3 ASP 29 HB3 ASP 29 -0.884 -9.018 8.113
192 H LEU 30 H LEU 30 1.002 -5.563 7.437
193 HA LEU 30 HA LEU 30 0.980 -6.036 4.506
194 HB2 LEU 30 HB2 LEU 30 2.286 -3.790 6.055
195 HB3 LEU 30 HB3 LEU 30 1.973 -3.863 4.321
196 HG LEU 30 HG LEU 30 -0.110 -3.652 6.525
197 HD11 LEU 30 HD11 LEU 30 1.232 -1.615 6.121
198 HD12 LEU 30 HD12 LEU 30 -0.444 -1.381 5.596
199 HD13 LEU 30 HD13 LEU 30 0.830 -1.672 4.390
200 HD21 LEU 30 HD21 LEU 30 -1.711 -3.230 4.625
201 HD22 LEU 30 HD22 LEU 30 -1.065 -4.867 4.587
202 HD23 LEU 30 HD23 LEU 30 -0.426 -3.646 3.467
203 H LEU 31 H LEU 31 2.845 -7.305 6.948
204 HA LEU 31 HA LEU 31 5.490 -7.013 5.732
205 HB2 LEU 31 HB2 LEU 31 5.209 -7.579 8.033
206 HB3 LEU 31 HB3 LEU 31 4.462 -9.131 7.615
207 HG LEU 31 HG LEU 31 7.108 -8.538 6.329
208 HD11 LEU 31 HD11 LEU 31 6.930 -9.113 9.292
209 HD12 LEU 31 HD12 LEU 31 7.476 -7.596 8.526
210 HD13 LEU 31 HD13 LEU 31 8.411 -9.083 8.308
211 HD21 LEU 31 HD21 LEU 31 6.178 -10.994 7.861
212 HD22 LEU 31 HD22 LEU 31 7.478 -10.868 6.652
213 HD23 LEU 31 HD23 LEU 31 5.800 -10.719 6.152
214 H GLY 32 H GLY 32 6.495 -8.341 4.292
215 HA2 GLY 32 HA2 GLY 32 6.724 -9.936 2.583
216 HA3 GLY 32 HA3 GLY 32 5.191 -10.654 3.066
217 H VAL 33 H VAL 33 4.112 -7.608 2.593
218 HA VAL 33 HA VAL 33 3.004 -8.055 0.032
219 HB VAL 33 HB VAL 33 3.426 -5.466 1.549
220 HG11 VAL 33 HG11 VAL 33 1.609 -4.534 0.148
221 HG12 VAL 33 HG12 VAL 33 3.041 -4.899 -0.815
222 HG13 VAL 33 HG13 VAL 33 1.636 -5.987 -0.865
223 HG21 VAL 33 HG21 VAL 33 1.937 -7.222 2.610
224 HG22 VAL 33 HG22 VAL 33 1.061 -5.755 2.148
225 HG23 VAL 33 HG23 VAL 33 0.950 -7.209 1.142
226 H THR 34 H THR 34 6.036 -6.519 0.877
227 HA THR 34 HA THR 34 6.954 -5.537 -1.605
228 HB THR 34 HB THR 34 7.978 -5.121 0.616
229 HG1 THR 34 HG1 THR 34 9.221 -4.797 -1.226
230 HG21 THR 34 HG21 THR 34 8.988 -7.991 0.411
231 HG22 THR 34 HG22 THR 34 7.875 -7.327 1.628
232 HG23 THR 34 HG23 THR 34 9.551 -6.777 1.558
233 H ARG 35 H ARG 35 6.339 -8.806 -0.872
234 HA ARG 35 HA ARG 35 7.843 -9.663 -3.290
235 HB2 ARG 35 HB2 ARG 35 8.191 -11.895 -2.284
236 HB3 ARG 35 HB3 ARG 35 9.138 -10.574 -1.607
237 HG2 ARG 35 HG2 ARG 35 7.659 -10.464 0.355
238 HG3 ARG 35 HG3 ARG 35 6.674 -11.799 -0.301
239 HD2 ARG 35 HD2 ARG 35 8.617 -13.297 -0.173
240 HD3 ARG 35 HD3 ARG 35 9.647 -11.947 0.334
241 HE ARG 35 HE ARG 35 7.276 -12.707 1.968
242 HH11 ARG 35 HH11 ARG 35 10.840 -12.481 1.763
243 HH12 ARG 35 HH12 ARG 35 11.047 -12.722 3.482
244 HH21 ARG 35 HH21 ARG 35 7.607 -13.007 4.176
245 HH22 ARG 35 HH22 ARG 35 9.227 -13.054 4.837
246 H GLN 36 H GLN 36 4.938 -10.085 -1.336
247 HA GLN 36 HA GLN 36 3.451 -11.818 -2.942
248 HB2 GLN 36 HB2 GLN 36 2.955 -10.731 -0.648
249 HB3 GLN 36 HB3 GLN 36 2.371 -9.341 -1.577
250 HG2 GLN 36 HG2 GLN 36 0.767 -10.983 -2.743
251 HG3 GLN 36 HG3 GLN 36 1.288 -12.182 -1.562
252 HE21 GLN 36 HE21 GLN 36 -1.118 -12.155 -1.083
253 HE22 GLN 36 HE22 GLN 36 -1.759 -10.882 -0.042
254 H ARG 37 H ARG 37 4.068 -8.337 -3.473
255 HA ARG 37 HA ARG 37 2.368 -8.365 -5.947
256 HB2 ARG 37 HB2 ARG 37 3.004 -6.011 -4.131
257 HB3 ARG 37 HB3 ARG 37 1.920 -6.007 -5.526
258 HG2 ARG 37 HG2 ARG 37 1.465 -7.471 -2.898
259 HG3 ARG 37 HG3 ARG 37 0.680 -5.997 -3.438
260 HD2 ARG 37 HD2 ARG 37 -0.386 -7.212 -5.305
261 HD3 ARG 37 HD3 ARG 37 0.435 -8.702 -4.810
262 HE ARG 37 HE ARG 37 -1.276 -7.321 -2.826
263 HH11 ARG 37 HH11 ARG 37 -0.944 -10.109 -5.035
264 HH12 ARG 37 HH12 ARG 37 -2.223 -11.002 -4.249
265 HH21 ARG 37 HH21 ARG 37 -2.909 -8.513 -1.857
266 HH22 ARG 37 HH22 ARG 37 -3.311 -10.116 -2.431
267 H ASP 38 H ASP 38 3.024 -7.153 -7.722
268 HA ASP 38 HA ASP 38 5.822 -6.797 -8.313
269 HB2 ASP 38 HB2 ASP 38 4.098 -7.091 -10.063
270 HB3 ASP 38 HB3 ASP 38 3.338 -5.575 -9.583
271 H ALA 39 H ALA 39 7.170 -5.099 -8.118
272 HA ALA 39 HA ALA 39 6.633 -3.256 -6.042
273 HB1 ALA 39 HB1 ALA 39 8.905 -2.445 -6.570
274 HB2 ALA 39 HB2 ALA 39 8.819 -4.221 -6.568
275 HB3 ALA 39 HB3 ALA 39 8.862 -3.341 -8.108
276 H ASN 40 H ASN 40 6.408 -2.715 -9.600
277 HA ASN 40 HA ASN 40 6.054 0.181 -9.235
278 HB2 ASN 40 HB2 ASN 40 7.016 -0.695 -11.335
279 HB3 ASN 40 HB3 ASN 40 5.500 -1.547 -11.676
280 HD21 ASN 40 HD21 ASN 40 6.834 1.722 -11.034
281 HD22 ASN 40 HD22 ASN 40 5.533 2.584 -11.841
282 H TRP 41 H TRP 41 3.883 -2.628 -9.822
283 HA TRP 41 HA TRP 41 1.442 -1.149 -9.853
284 HB2 TRP 41 HB2 TRP 41 1.798 -3.572 -10.495
285 HB3 TRP 41 HB3 TRP 41 1.861 -3.958 -8.783
286 HD1 TRP 41 HD1 TRP 41 -0.526 -3.231 -11.596
287 HE1 TRP 41 HE1 TRP 41 -2.970 -3.561 -10.837
288 HE3 TRP 41 HE3 TRP 41 0.252 -3.707 -6.548
289 HZ2 TRP 41 HZ2 TRP 41 -4.380 -3.826 -8.352
290 HZ3 TRP 41 HZ3 TRP 41 -1.678 -3.950 -5.005
291 HH2 TRP 41 HH2 TRP 41 -3.995 -3.992 -5.892
292 H LEU 42 H LEU 42 3.200 -2.596 -7.077
293 HA LEU 42 HA LEU 42 1.371 -1.917 -5.033
294 HB2 LEU 42 HB2 LEU 42 3.183 -3.539 -4.818
295 HB3 LEU 42 HB3 LEU 42 4.396 -2.286 -5.072
296 HG LEU 42 HG LEU 42 3.814 -1.236 -2.924
297 HD11 LEU 42 HD11 LEU 42 1.451 -1.832 -2.702
298 HD12 LEU 42 HD12 LEU 42 2.362 -2.448 -1.317
299 HD13 LEU 42 HD13 LEU 42 1.865 -3.559 -2.617
300 HD21 LEU 42 HD21 LEU 42 4.721 -3.013 -1.478
301 HD22 LEU 42 HD22 LEU 42 5.566 -2.959 -3.029
302 HD23 LEU 42 HD23 LEU 42 4.363 -4.227 -2.730
303 H VAL 43 H VAL 43 4.152 0.004 -6.271
304 HA VAL 43 HA VAL 43 3.674 2.220 -4.433
305 HB VAL 43 HB VAL 43 5.385 1.886 -6.913
306 HG11 VAL 43 HG11 VAL 43 6.434 4.049 -6.395
307 HG12 VAL 43 HG12 VAL 43 4.764 4.248 -6.907
308 HG13 VAL 43 HG13 VAL 43 5.189 4.382 -5.183
309 HG21 VAL 43 HG21 VAL 43 6.182 0.745 -4.900
310 HG22 VAL 43 HG22 VAL 43 7.213 2.138 -5.207
311 HG23 VAL 43 HG23 VAL 43 6.002 2.208 -3.918
312 H ARG 44 H ARG 44 2.718 1.623 -7.863
313 HA ARG 44 HA ARG 44 1.353 4.115 -8.223
314 HB2 ARG 44 HB2 ARG 44 0.969 1.372 -9.469
315 HB3 ARG 44 HB3 ARG 44 -0.036 2.761 -9.889
316 HG2 ARG 44 HG2 ARG 44 1.927 4.048 -10.607
317 HG3 ARG 44 HG3 ARG 44 2.992 2.706 -10.172
318 HD2 ARG 44 HD2 ARG 44 2.581 2.690 -12.572
319 HD3 ARG 44 HD3 ARG 44 1.861 1.257 -11.831
320 HE ARG 44 HE ARG 44 0.364 3.715 -12.682
321 HH11 ARG 44 HH11 ARG 44 0.376 0.162 -12.253
322 HH12 ARG 44 HH12 ARG 44 -1.246 -0.008 -12.883
323 HH21 ARG 44 HH21 ARG 44 -1.723 3.430 -13.464
324 HH22 ARG 44 HH22 ARG 44 -2.429 1.832 -13.566
325 H TRP 45 H TRP 45 0.109 0.977 -6.964
326 HA TRP 45 HA TRP 45 -2.567 1.803 -6.531
327 HB2 TRP 45 HB2 TRP 45 -1.764 -0.535 -6.411
328 HB3 TRP 45 HB3 TRP 45 -0.880 -0.169 -4.934
329 HD1 TRP 45 HD1 TRP 45 -2.167 -0.643 -2.758
330 HE1 TRP 45 HE1 TRP 45 -4.666 -1.073 -2.111
331 HE3 TRP 45 HE3 TRP 45 -4.443 0.558 -7.177
332 HZ2 TRP 45 HZ2 TRP 45 -7.164 -1.274 -3.441
333 HZ3 TRP 45 HZ3 TRP 45 -6.916 0.404 -7.402
334 HH2 TRP 45 HH2 TRP 45 -8.280 -0.568 -5.571
335 H LEU 46 H LEU 46 0.258 2.090 -4.325
336 HA LEU 46 HA LEU 46 -1.357 3.405 -2.310
337 HB2 LEU 46 HB2 LEU 46 0.579 1.939 -1.887
338 HB3 LEU 46 HB3 LEU 46 1.654 3.141 -2.591
339 HG LEU 46 HG LEU 46 1.228 4.690 -0.767
340 HD11 LEU 46 HD11 LEU 46 -0.814 2.651 0.250
341 HD12 LEU 46 HD12 LEU 46 -1.151 4.319 -0.262
342 HD13 LEU 46 HD13 LEU 46 -0.200 4.039 1.191
343 HD21 LEU 46 HD21 LEU 46 2.095 3.339 1.090
344 HD22 LEU 46 HD22 LEU 46 2.847 2.852 -0.429
345 HD23 LEU 46 HD23 LEU 46 1.563 1.841 0.262
346 H LYS 47 H LYS 47 0.312 4.603 -5.126
347 HA LYS 47 HA LYS 47 0.122 7.431 -4.372
348 HB2 LYS 47 HB2 LYS 47 0.552 6.019 -7.031
349 HB3 LYS 47 HB3 LYS 47 0.320 7.763 -6.907
350 HG2 LYS 47 HG2 LYS 47 2.259 8.006 -5.474
351 HG3 LYS 47 HG3 LYS 47 2.495 6.256 -5.412
352 HD2 LYS 47 HD2 LYS 47 2.987 6.207 -7.833
353 HD3 LYS 47 HD3 LYS 47 2.715 7.962 -7.925
354 HE2 LYS 47 HE2 LYS 47 4.521 8.277 -6.194
355 HE3 LYS 47 HE3 LYS 47 4.832 6.535 -6.238
356 HZ1 LYS 47 HZ1 LYS 47 6.378 7.684 -7.616
357 HZ2 LYS 47 HZ2 LYS 47 5.200 8.428 -8.494
358 HZ3 LYS 47 HZ3 LYS 47 5.442 6.786 -8.590
359 H VAL 48 H VAL 48 -1.915 5.401 -6.601
360 HA VAL 48 HA VAL 48 -4.116 7.364 -6.113
361 HB VAL 48 HB VAL 48 -2.529 8.074 -7.887
362 HG11 VAL 48 HG11 VAL 48 -2.177 5.887 -9.028
363 HG12 VAL 48 HG12 VAL 48 -3.804 6.019 -9.715
364 HG13 VAL 48 HG13 VAL 48 -2.590 7.242 -10.093
365 HG21 VAL 48 HG21 VAL 48 -4.362 8.855 -9.377
366 HG22 VAL 48 HG22 VAL 48 -5.480 7.855 -8.419
367 HG23 VAL 48 HG23 VAL 48 -4.581 9.165 -7.651
368 HA PRO 49 HA PRO 49 -5.442 2.904 -6.423
369 HB2 PRO 49 HB2 PRO 49 -6.939 2.691 -4.103
370 HB3 PRO 49 HB3 PRO 49 -5.173 2.478 -4.159
371 HG2 PRO 49 HG2 PRO 49 -6.738 4.955 -3.391
372 HG3 PRO 49 HG3 PRO 49 -5.323 4.238 -2.559
373 HD2 PRO 49 HD2 PRO 49 -5.141 6.363 -4.276
374 HD3 PRO 49 HD3 PRO 49 -3.839 5.161 -4.137
375 H ASP 50 H ASP 50 -7.552 5.623 -5.386
376 HA ASP 50 HA ASP 50 -10.002 4.510 -6.262
377 HB2 ASP 50 HB2 ASP 50 -9.697 6.438 -4.708
378 HB3 ASP 50 HB3 ASP 50 -9.192 7.440 -6.070
379 H GLN 51 H GLN 51 -7.449 5.958 -8.163
380 HA GLN 51 HA GLN 51 -9.115 6.302 -10.575
381 HB2 GLN 51 HB2 GLN 51 -7.335 7.918 -9.916
382 HB3 GLN 51 HB3 GLN 51 -6.129 6.639 -10.172
383 HG2 GLN 51 HG2 GLN 51 -6.749 6.489 -12.529
384 HG3 GLN 51 HG3 GLN 51 -8.000 7.719 -12.313
385 HE21 GLN 51 HE21 GLN 51 -5.416 7.641 -13.984
386 HE22 GLN 51 HE22 GLN 51 -4.619 9.158 -13.524
387 H MET 52 H MET 52 -6.426 4.152 -9.388
388 HA MET 52 HA MET 52 -6.380 2.424 -11.652
389 HB2 MET 52 HB2 MET 52 -5.486 2.392 -8.777
390 HB3 MET 52 HB3 MET 52 -5.657 0.808 -9.562
391 HG2 MET 52 HG2 MET 52 -4.211 1.449 -11.343
392 HG3 MET 52 HG3 MET 52 -4.102 3.118 -10.751
393 HE1 MET 52 HE1 MET 52 -2.817 -0.528 -10.547
394 HE2 MET 52 HE2 MET 52 -2.049 -0.611 -8.942
395 HE3 MET 52 HE3 MET 52 -3.817 -0.468 -9.080
396 H LEU 53 H LEU 53 -8.525 2.413 -8.791
397 HA LEU 53 HA LEU 53 -9.861 -0.023 -9.612
398 HB2 LEU 53 HB2 LEU 53 -9.591 0.852 -7.261
399 HB3 LEU 53 HB3 LEU 53 -10.749 2.121 -7.643
400 HG LEU 53 HG LEU 53 -12.501 0.419 -8.009
401 HD11 LEU 53 HD11 LEU 53 -10.397 -1.629 -7.177
402 HD12 LEU 53 HD12 LEU 53 -11.151 -1.506 -8.789
403 HD13 LEU 53 HD13 LEU 53 -12.132 -1.934 -7.403
404 HD21 LEU 53 HD21 LEU 53 -12.721 -0.314 -5.668
405 HD22 LEU 53 HD22 LEU 53 -12.124 1.348 -5.735
406 HD23 LEU 53 HD23 LEU 53 -11.009 0.018 -5.363
407 H ALA 54 H ALA 54 -10.476 3.457 -10.181
408 HA ALA 54 HA ALA 54 -13.039 3.073 -11.453
409 HB1 ALA 54 HB1 ALA 54 -12.433 5.214 -10.490
410 HB2 ALA 54 HB2 ALA 54 -11.037 5.364 -11.591
411 HB3 ALA 54 HB3 ALA 54 -12.690 5.409 -12.227
412 H GLU 55 H GLU 55 -9.691 3.198 -12.758
413 HA GLU 55 HA GLU 55 -10.506 3.009 -15.512
414 HB2 GLU 55 HB2 GLU 55 -8.215 2.840 -16.031
415 HB3 GLU 55 HB3 GLU 55 -8.294 3.902 -14.642
416 HG2 GLU 55 HG2 GLU 55 -7.563 2.059 -13.227
417 HG3 GLU 55 HG3 GLU 55 -7.611 0.918 -14.558
418 H LYS 56 H LYS 56 -10.638 0.726 -13.085
419 HA LYS 56 HA LYS 56 -10.745 -1.504 -12.857
420 HB2 LYS 56 HB2 LYS 56 -11.798 -1.531 -15.708
421 HB3 LYS 56 HB3 LYS 56 -11.955 -2.809 -14.491
422 HG2 LYS 56 HG2 LYS 56 -13.079 -1.060 -12.984
423 HG3 LYS 56 HG3 LYS 56 -13.152 -0.005 -14.400
424 HD2 LYS 56 HD2 LYS 56 -14.552 -1.616 -15.589
425 HD3 LYS 56 HD3 LYS 56 -14.397 -2.785 -14.258
426 HE2 LYS 56 HE2 LYS 56 -15.416 -1.123 -12.695
427 HE3 LYS 56 HE3 LYS 56 -15.603 0.012 -14.040
428 HZ1 LYS 56 HZ1 LYS 56 -16.915 -2.651 -13.892
429 HZ2 LYS 56 HZ2 LYS 56 -17.073 -1.575 -15.107
430 HZ3 LYS 56 HZ3 LYS 56 -17.653 -1.197 -13.628
431 H ASP 57 H ASP 57 -8.521 -1.292 -12.602
432 HA ASP 57 HA ASP 57 -6.754 -2.865 -14.386
433 HB2 ASP 57 HB2 ASP 57 -5.837 -0.894 -13.069
434 HB3 ASP 57 HB3 ASP 57 -6.218 -1.775 -11.589
435 HA PRO 58 HA PRO 58 -9.385 -5.840 -12.714
436 HB2 PRO 58 HB2 PRO 58 -8.490 -8.095 -13.921
437 HB3 PRO 58 HB3 PRO 58 -9.160 -6.640 -14.754
438 HG2 PRO 58 HG2 PRO 58 -6.190 -7.140 -14.315
439 HG3 PRO 58 HG3 PRO 58 -7.040 -7.015 -15.905
440 HD2 PRO 58 HD2 PRO 58 -5.936 -4.895 -14.701
441 HD3 PRO 58 HD3 PRO 58 -7.569 -4.736 -15.429
442 H LEU 59 H LEU 59 -6.000 -6.150 -12.050
443 HA LEU 59 HA LEU 59 -6.252 -8.064 -9.870
444 HB2 LEU 59 HB2 LEU 59 -4.116 -7.646 -11.025
445 HB3 LEU 59 HB3 LEU 59 -4.112 -5.977 -10.444
446 HG LEU 59 HG LEU 59 -3.904 -6.753 -8.112
447 HD11 LEU 59 HD11 LEU 59 -3.397 -9.156 -7.649
448 HD12 LEU 59 HD12 LEU 59 -3.874 -9.558 -9.312
449 HD13 LEU 59 HD13 LEU 59 -5.066 -8.908 -8.161
450 HD21 LEU 59 HD21 LEU 59 -1.631 -7.628 -8.263
451 HD22 LEU 59 HD22 LEU 59 -1.890 -6.389 -9.500
452 HD23 LEU 59 HD23 LEU 59 -1.895 -8.106 -9.956
453 H ALA 60 H ALA 60 -6.562 -4.485 -10.076
454 HA ALA 60 HA ALA 60 -6.749 -4.120 -7.193
455 HB1 ALA 60 HB1 ALA 60 -6.063 -2.267 -8.627
456 HB2 ALA 60 HB2 ALA 60 -7.605 -2.347 -9.513
457 HB3 ALA 60 HB3 ALA 60 -7.601 -1.911 -7.805
458 H MET 61 H MET 61 -9.162 -4.395 -9.836
459 HA MET 61 HA MET 61 -11.566 -4.198 -8.378
460 HB2 MET 61 HB2 MET 61 -10.754 -5.939 -10.743
461 HB3 MET 61 HB3 MET 61 -12.419 -5.689 -10.242
462 HG2 MET 61 HG2 MET 61 -10.567 -3.385 -10.993
463 HG3 MET 61 HG3 MET 61 -11.522 -4.258 -12.179
464 HE1 MET 61 HE1 MET 61 -14.349 -4.788 -10.791
465 HE2 MET 61 HE2 MET 61 -15.117 -3.388 -11.574
466 HE3 MET 61 HE3 MET 61 -13.874 -4.336 -12.440
467 H LEU 62 H LEU 62 -9.380 -6.971 -8.707
468 HA LEU 62 HA LEU 62 -10.991 -8.836 -7.175
469 HB2 LEU 62 HB2 LEU 62 -9.109 -9.140 -8.963
470 HB3 LEU 62 HB3 LEU 62 -8.001 -8.902 -7.616
471 HG LEU 62 HG LEU 62 -10.184 -11.038 -7.651
472 HD11 LEU 62 HD11 LEU 62 -7.272 -11.348 -8.509
473 HD12 LEU 62 HD12 LEU 62 -8.674 -11.330 -9.599
474 HD13 LEU 62 HD13 LEU 62 -8.513 -12.630 -8.428
475 HD21 LEU 62 HD21 LEU 62 -7.583 -10.825 -6.062
476 HD22 LEU 62 HD22 LEU 62 -8.689 -12.220 -6.053
477 HD23 LEU 62 HD23 LEU 62 -9.230 -10.679 -5.411
478 H LEU 63 H LEU 63 -8.090 -6.770 -6.458
479 HA LEU 63 HA LEU 63 -7.598 -7.947 -3.921
480 HB2 LEU 63 HB2 LEU 63 -5.951 -6.937 -5.398
481 HB3 LEU 63 HB3 LEU 63 -6.708 -5.361 -5.273
482 HG LEU 63 HG LEU 63 -4.528 -5.766 -4.063
483 HD11 LEU 63 HD11 LEU 63 -6.771 -4.749 -2.297
484 HD12 LEU 63 HD12 LEU 63 -5.983 -3.824 -3.592
485 HD13 LEU 63 HD13 LEU 63 -5.046 -4.364 -2.191
486 HD21 LEU 63 HD21 LEU 63 -5.093 -7.980 -3.122
487 HD22 LEU 63 HD22 LEU 63 -6.267 -7.212 -2.035
488 HD23 LEU 63 HD23 LEU 63 -4.550 -6.812 -1.894
489 H PHE 64 H PHE 64 -9.460 -5.114 -4.886
490 HA PHE 64 HA PHE 64 -9.804 -4.229 -2.098
491 HB2 PHE 64 HB2 PHE 64 -10.493 -2.341 -2.909
492 HB3 PHE 64 HB3 PHE 64 -10.056 -2.924 -4.490
493 HD1 PHE 64 HD2 PHE 64 -11.942 -4.171 -5.855
494 HD2 PHE 64 HD1 PHE 64 -12.673 -1.652 -2.442
495 HE1 PHE 64 HE2 PHE 64 -14.267 -3.775 -6.645
496 HE2 PHE 64 HE1 PHE 64 -14.973 -1.209 -3.252
497 HZ PHE 64 HZ PHE 64 -15.767 -2.253 -5.366
498 H GLU 65 H GLU 65 -11.858 -6.198 -4.340
499 HA GLU 65 HA GLU 65 -13.893 -6.577 -2.416
500 HB2 GLU 65 HB2 GLU 65 -14.112 -6.605 -4.870
501 HB3 GLU 65 HB3 GLU 65 -13.214 -8.134 -4.931
502 HG2 GLU 65 HG2 GLU 65 -14.892 -9.247 -3.679
503 HG3 GLU 65 HG3 GLU 65 -15.602 -7.711 -3.146
504 H GLN 66 H GLN 66 -10.774 -8.152 -2.841
505 HA GLN 66 HA GLN 66 -11.297 -10.531 -1.376
506 HB2 GLN 66 HB2 GLN 66 -9.224 -9.993 -2.754
507 HB3 GLN 66 HB3 GLN 66 -8.734 -8.880 -1.478
508 HG2 GLN 66 HG2 GLN 66 -8.741 -10.888 0.118
509 HG3 GLN 66 HG3 GLN 66 -8.925 -11.905 -1.311
510 HE21 GLN 66 HE21 GLN 66 -6.837 -9.277 0.060
511 HE22 GLN 66 HE22 GLN 66 -5.354 -10.012 -0.514
512 H TYR 67 H TYR 67 -10.574 -7.247 -0.247
513 HA TYR 67 HA TYR 67 -10.759 -8.120 2.587
514 HB2 TYR 67 HB2 TYR 67 -9.901 -5.513 1.322
515 HB3 TYR 67 HB3 TYR 67 -10.092 -5.758 3.055
516 HD1 TYR 67 HD1 TYR 67 -8.779 -7.652 4.203
517 HD2 TYR 67 HD2 TYR 67 -7.808 -6.173 0.265
518 HE1 TYR 67 HE1 TYR 67 -6.498 -8.613 4.410
519 HE2 TYR 67 HE2 TYR 67 -5.493 -7.105 0.501
520 HH TYR 67 HH TYR 67 -4.395 -8.786 3.458
521 H ASN 68 H ASN 68 -13.015 -8.689 1.369
522 HA ASN 68 HA ASN 68 -15.219 -8.421 1.150
523 HB2 ASN 68 HB2 ASN 68 -14.897 -8.875 3.571
524 HB3 ASN 68 HB3 ASN 68 -14.998 -7.148 3.892
525 HD21 ASN 68 HD21 ASN 68 -16.819 -7.844 5.319
526 HD22 ASN 68 HD22 ASN 68 -18.396 -7.968 4.560
527 H ARG 69 H ARG 69 -14.245 -6.712 -0.470
528 HA ARG 69 HA ARG 69 -14.467 -4.769 -1.640
529 HB2 ARG 69 HB2 ARG 69 -16.647 -6.149 -1.783
530 HB3 ARG 69 HB3 ARG 69 -17.374 -4.857 -0.834
531 HG2 ARG 69 HG2 ARG 69 -16.647 -3.226 -2.624
532 HG3 ARG 69 HG3 ARG 69 -15.983 -4.594 -3.544
533 HD2 ARG 69 HD2 ARG 69 -18.225 -5.578 -3.750
534 HD3 ARG 69 HD3 ARG 69 -18.897 -4.345 -2.682
535 HE ARG 69 HE ARG 69 -18.866 -2.782 -4.374
536 HH11 ARG 69 HH11 ARG 69 -17.179 -5.696 -5.565
537 HH12 ARG 69 HH12 ARG 69 -17.179 -5.132 -7.222
538 HH21 ARG 69 HH21 ARG 69 -18.821 -2.098 -6.521
539 HH22 ARG 69 HH22 ARG 69 -18.106 -3.105 -7.759
540 H LEU 70 H LEU 70 -13.382 -4.059 0.728
541 HA LEU 70 HA LEU 70 -14.537 -1.353 1.268
542 HB2 LEU 70 HB2 LEU 70 -14.267 -2.855 3.238
543 HB3 LEU 70 HB3 LEU 70 -12.545 -2.990 2.876
544 HG LEU 70 HG LEU 70 -12.333 -0.496 3.236
545 HD11 LEU 70 HD11 LEU 70 -14.692 0.179 2.868
546 HD12 LEU 70 HD12 LEU 70 -14.133 0.655 4.470
547 HD13 LEU 70 HD13 LEU 70 -15.186 -0.763 4.291
548 HD21 LEU 70 HD21 LEU 70 -11.806 -2.138 5.006
549 HD22 LEU 70 HD22 LEU 70 -13.495 -2.114 5.544
550 HD23 LEU 70 HD23 LEU 70 -12.490 -0.656 5.698
551 H ALA 71 H ALA 71 -13.503 0.319 0.337
552 HA ALA 71 HA ALA 71 -11.096 -0.193 -1.301
553 HB1 ALA 71 HB1 ALA 71 -11.679 1.946 -2.290
554 HB2 ALA 71 HB2 ALA 71 -13.106 0.905 -2.232
555 HB3 ALA 71 HB3 ALA 71 -12.917 2.227 -1.054
556 H MET 72 H MET 72 -9.432 1.590 -1.347
557 HA MET 72 HA MET 72 -8.997 2.967 1.259
558 HB2 MET 72 HB2 MET 72 -7.343 1.191 0.927
559 HB3 MET 72 HB3 MET 72 -6.887 1.875 -0.642
560 HG2 MET 72 HG2 MET 72 -6.014 3.876 0.420
561 HG3 MET 72 HG3 MET 72 -6.707 3.405 1.972
562 HE1 MET 72 HE1 MET 72 -4.577 1.227 -0.627
563 HE2 MET 72 HE2 MET 72 -3.816 2.835 -0.601
564 HE3 MET 72 HE3 MET 72 -2.961 1.432 0.079
565 HA PRO 73 HA PRO 73 -9.362 6.463 -1.553
566 HB2 PRO 73 HB2 PRO 73 -8.968 8.548 0.153
567 HB3 PRO 73 HB3 PRO 73 -10.434 7.520 0.223
568 HG2 PRO 73 HG2 PRO 73 -7.912 7.283 1.904
569 HG3 PRO 73 HG3 PRO 73 -9.614 7.324 2.467
570 HD2 PRO 73 HD2 PRO 73 -8.258 4.984 2.092
571 HD3 PRO 73 HD3 PRO 73 -10.006 5.116 1.743
572 H ASN 74 H ASN 74 -8.031 8.192 -2.444
573 HA ASN 74 HA ASN 74 -5.113 7.806 -2.363
574 HB2 ASN 74 HB2 ASN 74 -5.960 8.678 -4.423
575 HB3 ASN 74 HB3 ASN 74 -6.994 9.846 -3.610
576 HD21 ASN 74 HD21 ASN 74 -3.600 9.228 -4.610
577 HD22 ASN 74 HD22 ASN 74 -3.122 10.877 -4.333
578 H MET 75 H MET 75 -3.655 8.871 -1.090
579 HA MET 75 HA MET 75 -4.717 10.677 1.054
580 HB2 MET 75 HB2 MET 75 -2.446 8.667 1.208
581 HB3 MET 75 HB3 MET 75 -2.944 9.779 2.492
582 HG2 MET 75 HG2 MET 75 -5.217 8.720 2.473
583 HG3 MET 75 HG3 MET 75 -4.641 7.573 1.267
584 HE1 MET 75 HE1 MET 75 -3.469 7.645 5.738
585 HE2 MET 75 HE2 MET 75 -2.913 8.940 4.662
586 HE3 MET 75 HE3 MET 75 -4.654 8.706 4.955
587 H ARG 76 H ARG 76 -3.815 11.452 -1.601
588 HA ARG 76 HA ARG 76 -2.476 12.814 -2.754
589 HB2 ARG 76 HB2 ARG 76 -2.564 14.420 -0.182
590 HB3 ARG 76 HB3 ARG 76 -2.142 15.036 -1.788
591 HG2 ARG 76 HG2 ARG 76 -4.422 14.145 -2.580
592 HG3 ARG 76 HG3 ARG 76 -4.840 13.983 -0.869
593 HD2 ARG 76 HD2 ARG 76 -3.980 16.544 -2.293
594 HD3 ARG 76 HD3 ARG 76 -5.638 16.103 -1.883
595 HE ARG 76 HE ARG 76 -3.486 16.550 0.157
596 HH11 ARG 76 HH11 ARG 76 -6.878 17.076 -0.859
597 HH12 ARG 76 HH12 ARG 76 -7.249 18.025 0.561
598 HH21 ARG 76 HH21 ARG 76 -4.027 17.778 1.959
599 HH22 ARG 76 HH22 ARG 76 -5.645 18.419 2.148
600 H LEU 77 H LEU 77 -0.958 10.707 -1.810
601 HA LEU 77 HA LEU 77 1.647 11.746 -0.910
602 HB2 LEU 77 HB2 LEU 77 0.883 8.921 -1.716
603 HB3 LEU 77 HB3 LEU 77 2.315 9.434 -0.813
604 HG LEU 77 HG LEU 77 -0.541 9.564 0.214
605 HD11 LEU 77 HD11 LEU 77 1.734 7.676 0.938
606 HD12 LEU 77 HD12 LEU 77 0.290 7.256 -0.015
607 HD13 LEU 77 HD13 LEU 77 0.119 7.724 1.682
608 HD21 LEU 77 HD21 LEU 77 0.521 9.999 2.403
609 HD22 LEU 77 HD22 LEU 77 0.878 11.293 1.250
610 HD23 LEU 77 HD23 LEU 77 2.116 10.074 1.626
611 H GLY 78 H GLY 78 3.507 11.886 -2.083
612 HA2 GLY 78 HA2 GLY 78 3.530 10.974 -4.954
613 HA3 GLY 78 HA3 GLY 78 4.238 12.496 -4.431
614 H ASP 79 H ASP 79 6.158 11.542 -5.523
615 HA ASP 79 HA ASP 79 7.535 9.314 -4.359
616 HB2 ASP 79 HB2 ASP 79 7.900 10.232 -6.660
617 HB3 ASP 79 HB3 ASP 79 8.684 11.648 -5.947
618 H ALA 80 H ALA 80 9.514 9.359 -3.147
619 HA ALA 80 HA ALA 80 10.451 9.513 -1.159
620 HB1 ALA 80 HB1 ALA 80 10.154 12.518 -1.278
621 HB2 ALA 80 HB2 ALA 80 11.308 11.581 -0.318
622 HB3 ALA 80 HB3 ALA 80 11.439 11.585 -2.085
623 H GLU 81 H GLU 81 7.190 10.294 -1.374
624 HA GLU 81 HA GLU 81 6.912 9.712 1.558
625 HB2 GLU 81 HB2 GLU 81 4.801 10.473 -0.487
626 HB3 GLU 81 HB3 GLU 81 4.479 10.014 1.178
627 HG2 GLU 81 HG2 GLU 81 5.508 11.967 2.058
628 HG3 GLU 81 HG3 GLU 81 6.306 12.355 0.529
629 H VAL 82 H VAL 82 5.552 8.587 -1.600
630 HA VAL 82 HA VAL 82 4.779 6.049 -0.481
631 HB VAL 82 HB VAL 82 5.050 6.758 -3.429
632 HG11 VAL 82 HG11 VAL 82 3.284 4.972 -3.645
633 HG12 VAL 82 HG12 VAL 82 4.775 4.309 -2.976
634 HG13 VAL 82 HG13 VAL 82 3.413 4.660 -1.908
635 HG21 VAL 82 HG21 VAL 82 2.730 7.073 -1.465
636 HG22 VAL 82 HG22 VAL 82 3.538 8.358 -2.403
637 HG23 VAL 82 HG23 VAL 82 2.546 7.156 -3.223
638 H SER 83 H SER 83 7.593 6.913 -2.580
639 HA SER 83 HA SER 83 8.590 4.233 -2.779
640 HB2 SER 83 HB2 SER 83 10.748 5.384 -3.380
641 HB3 SER 83 HB3 SER 83 9.336 5.857 -4.332
642 HG SER 83 HG SER 83 10.085 7.734 -3.865
643 H ALA 84 H ALA 84 8.993 6.718 -0.303
644 HA ALA 84 HA ALA 84 10.993 5.337 1.248
645 HB1 ALA 84 HB1 ALA 84 10.640 7.765 1.379
646 HB2 ALA 84 HB2 ALA 84 8.985 7.521 1.978
647 HB3 ALA 84 HB3 ALA 84 10.365 7.023 2.962
648 H LEU 85 H LEU 85 7.386 5.490 1.479
649 HA LEU 85 HA LEU 85 7.118 3.643 3.666
650 HB2 LEU 85 HB2 LEU 85 5.343 4.528 1.367
651 HB3 LEU 85 HB3 LEU 85 4.800 3.294 2.490
652 HG LEU 85 HG LEU 85 5.720 6.031 3.466
653 HD11 LEU 85 HD11 LEU 85 3.907 6.428 1.924
654 HD12 LEU 85 HD12 LEU 85 3.251 6.544 3.563
655 HD13 LEU 85 HD13 LEU 85 2.960 5.086 2.594
656 HD21 LEU 85 HD21 LEU 85 5.623 4.285 5.196
657 HD22 LEU 85 HD22 LEU 85 3.988 3.825 4.680
658 HD23 LEU 85 HD23 LEU 85 4.280 5.408 5.412
659 H ILE 86 H ILE 86 7.459 3.067 0.168
660 HA ILE 86 HA ILE 86 6.973 0.220 0.391
661 HB ILE 86 HB ILE 86 7.459 2.019 -1.824
662 HG12 ILE 86 HG12 ILE 86 5.941 0.190 -2.833
663 HG13 ILE 86 HG13 ILE 86 6.009 -0.638 -1.312
664 HG21 ILE 86 HG21 ILE 86 8.542 -0.823 -2.014
665 HG22 ILE 86 HG22 ILE 86 8.250 0.283 -3.369
666 HG23 ILE 86 HG23 ILE 86 9.486 0.679 -2.176
667 HD11 ILE 86 HD11 ILE 86 4.898 1.256 -0.183
668 HD12 ILE 86 HD12 ILE 86 4.953 2.202 -1.688
669 HD13 ILE 86 HD13 ILE 86 3.953 0.740 -1.586
670 H SER 87 H SER 87 9.947 2.224 0.383
671 HA SER 87 HA SER 87 11.752 0.040 0.829
672 HB2 SER 87 HB2 SER 87 11.932 2.967 1.614
673 HB3 SER 87 HB3 SER 87 13.251 1.792 1.784
674 HG SER 87 HG SER 87 13.202 3.090 -0.198
675 H TYR 88 H TYR 88 9.678 1.866 3.205
676 HA TYR 88 HA TYR 88 10.916 0.564 5.471
677 HB2 TYR 88 HB2 TYR 88 9.615 2.542 5.753
678 HB3 TYR 88 HB3 TYR 88 8.152 1.770 5.140
679 HD1 TYR 88 HD2 TYR 88 10.773 1.294 7.817
680 HD2 TYR 88 HD1 TYR 88 6.596 1.025 6.766
681 HE1 TYR 88 HE2 TYR 88 10.220 0.635 10.147
682 HE2 TYR 88 HE1 TYR 88 6.053 0.341 9.104
683 HH TYR 88 HH TYR 88 6.920 -0.248 11.179
684 H LEU 89 H LEU 89 8.003 -0.390 3.569
685 HA LEU 89 HA LEU 89 7.541 -2.834 5.035
686 HB2 LEU 89 HB2 LEU 89 6.670 -1.662 2.396
687 HB3 LEU 89 HB3 LEU 89 6.471 -3.390 2.629
688 HG LEU 89 HG LEU 89 5.066 -3.087 4.571
689 HD11 LEU 89 HD11 LEU 89 5.971 -1.036 5.562
690 HD12 LEU 89 HD12 LEU 89 4.237 -0.869 5.273
691 HD13 LEU 89 HD13 LEU 89 5.398 -0.086 4.173
692 HD21 LEU 89 HD21 LEU 89 4.245 -1.301 2.241
693 HD22 LEU 89 HD22 LEU 89 3.142 -1.989 3.457
694 HD23 LEU 89 HD23 LEU 89 4.021 -3.063 2.353
695 H GLU 90 H GLU 90 9.678 -2.106 2.296
696 HA GLU 90 HA GLU 90 10.445 -4.834 1.775
697 HB2 GLU 90 HB2 GLU 90 10.583 -2.943 0.180
698 HB3 GLU 90 HB3 GLU 90 11.888 -2.236 1.134
699 HG2 GLU 90 HG2 GLU 90 13.351 -4.093 0.593
700 HG3 GLU 90 HG3 GLU 90 12.017 -4.996 -0.136
701 H GLU 91 H GLU 91 12.037 -2.246 3.779
702 HA GLU 91 HA GLU 91 14.116 -4.102 4.532
703 HB2 GLU 91 HB2 GLU 91 15.238 -2.429 5.450
704 HB3 GLU 91 HB3 GLU 91 14.299 -1.589 4.245
705 HG2 GLU 91 HG2 GLU 91 13.815 -0.141 5.877
706 HG3 GLU 91 HG3 GLU 91 12.662 -1.314 6.474
707 H GLU 92 H GLU 92 11.109 -3.110 6.218
708 HA GLU 92 HA GLU 92 11.664 -4.556 8.650
709 HB2 GLU 92 HB2 GLU 92 9.101 -3.776 7.213
710 HB3 GLU 92 HB3 GLU 92 9.058 -4.751 8.669
711 HG2 GLU 92 HG2 GLU 92 10.397 -2.021 8.557
712 HG3 GLU 92 HG3 GLU 92 8.711 -2.288 9.014
713 H THR 93 H THR 93 10.315 -5.623 5.505
714 HA THR 93 HA THR 93 9.789 -8.355 6.353
715 HB THR 93 HB THR 93 10.281 -7.226 3.579
716 HG1 THR 93 HG1 THR 93 8.490 -6.312 4.256
717 HG21 THR 93 HG21 THR 93 10.535 -9.641 3.511
718 HG22 THR 93 HG22 THR 93 8.974 -9.212 2.815
719 HG23 THR 93 HG23 THR 93 9.048 -9.868 4.468
720 H ALA 94 H ALA 94 12.668 -6.765 4.869
721 HA ALA 94 HA ALA 94 14.236 -9.160 4.717
722 HB1 ALA 94 HB1 ALA 94 16.126 -7.608 4.488
723 HB2 ALA 94 HB2 ALA 94 14.757 -7.075 3.504
724 HB3 ALA 94 HB3 ALA 94 15.117 -6.258 5.041
725 H ARG 95 H ARG 95 13.449 -7.114 7.476
726 HA ARG 95 HA ARG 95 15.472 -8.406 9.167
727 HB2 ARG 95 HB2 ARG 95 14.636 -5.886 9.167
728 HB3 ARG 95 HB3 ARG 95 13.400 -6.518 10.250
729 HG2 ARG 95 HG2 ARG 95 15.209 -5.673 11.583
730 HG3 ARG 95 HG3 ARG 95 15.293 -7.435 11.702
731 HD2 ARG 95 HD2 ARG 95 17.120 -7.487 10.048
732 HD3 ARG 95 HD3 ARG 95 16.971 -5.749 9.785
733 HE ARG 95 HE ARG 95 18.102 -7.156 12.136
734 HH11 ARG 95 HH11 ARG 95 17.397 -3.993 10.620
735 HH12 ARG 95 HH12 ARG 95 18.508 -3.141 11.667
736 HH21 ARG 95 HH21 ARG 95 19.519 -6.008 13.446
737 HH22 ARG 95 HH22 ARG 95 19.705 -4.278 13.264
738 H LEU 96 H LEU 96 12.024 -8.692 8.677
739 HA LEU 96 HA LEU 96 10.439 -10.049 9.571
740 HB2 LEU 96 HB2 LEU 96 12.229 -11.315 8.069
741 HB3 LEU 96 HB3 LEU 96 12.481 -12.255 9.481
742 HG LEU 96 HG LEU 96 11.064 -13.489 8.137
743 HD11 LEU 96 HD11 LEU 96 9.178 -11.940 9.923
744 HD12 LEU 96 HD12 LEU 96 10.128 -13.389 10.368
745 HD13 LEU 96 HD13 LEU 96 8.837 -13.517 9.163
746 HD21 LEU 96 HD21 LEU 96 10.628 -11.841 6.498
747 HD22 LEU 96 HD22 LEU 96 9.583 -10.923 7.594
748 HD23 LEU 96 HD23 LEU 96 9.081 -12.540 7.005
749 H GLN 97 H GLN 97 11.606 -8.656 11.725
750 HA GLN 97 HA GLN 97 11.522 -10.661 13.959
751 HB2 GLN 97 HB2 GLN 97 13.008 -9.269 15.198
752 HB3 GLN 97 HB3 GLN 97 13.719 -9.590 13.618
753 HG2 GLN 97 HG2 GLN 97 13.104 -7.335 12.841
754 HG3 GLN 97 HG3 GLN 97 12.221 -7.022 14.335
755 HE21 GLN 97 HE21 GLN 97 13.516 -5.139 14.712
756 HE22 GLN 97 HE22 GLN 97 15.165 -5.310 15.293
757 H THR 98 H THR 98 10.821 -9.877 16.075
758 HA THR 98 HA THR 98 9.250 -8.999 17.506
759 HB THR 98 HB THR 98 9.891 -6.437 16.040
760 HG1 THR 98 HG1 THR 98 11.609 -6.374 17.481
761 HG21 THR 98 HG21 THR 98 9.755 -5.515 18.398
762 HG22 THR 98 HG22 THR 98 9.062 -7.066 18.915
763 HG23 THR 98 HG23 THR 98 8.206 -6.029 17.745
764 HA PRO 99 HA PRO 99 5.462 -9.007 14.887
765 HB2 PRO 99 HB2 PRO 99 4.497 -11.479 15.394
766 HB3 PRO 99 HB3 PRO 99 5.786 -11.210 14.199
767 HG2 PRO 99 HG2 PRO 99 6.105 -12.123 17.071
768 HG3 PRO 99 HG3 PRO 99 6.835 -12.827 15.597
769 HD2 PRO 99 HD2 PRO 99 8.135 -11.012 17.224
770 HD3 PRO 99 HD3 PRO 99 8.437 -11.150 15.467
771 H VAL 100 H VAL 100 5.496 -7.389 16.652
772 HA VAL 100 HA VAL 100 3.692 -7.960 18.964
773 HB VAL 100 HB VAL 100 6.400 -6.560 18.978
774 HG11 VAL 100 HG11 VAL 100 4.326 -6.763 21.219
775 HG12 VAL 100 HG12 VAL 100 5.997 -6.201 21.424
776 HG13 VAL 100 HG13 VAL 100 4.887 -5.265 20.434
777 HG21 VAL 100 HG21 VAL 100 7.002 -8.195 20.701
778 HG22 VAL 100 HG22 VAL 100 5.421 -8.976 20.526
779 HG23 VAL 100 HG23 VAL 100 6.591 -8.991 19.186
780 H THR 101 H THR 101 2.265 -6.212 19.460
781 HA THR 101 HA THR 101 1.705 -4.429 17.320
782 HB THR 101 HB THR 101 0.096 -5.290 19.045
783 HG1 THR 101 HG1 THR 101 -1.185 -3.805 18.389
784 HG21 THR 101 HG21 THR 101 1.299 -4.494 21.106
785 HG22 THR 101 HG22 THR 101 -0.383 -3.949 20.999
786 HG23 THR 101 HG23 THR 101 0.934 -2.823 20.626
787 H ASN 102 H ASN 102 1.866 -2.165 17.082
788 HA ASN 102 HA ASN 102 4.551 -1.442 17.767
789 HB2 ASN 102 HB2 ASN 102 3.309 -1.157 15.556
790 HB3 ASN 102 HB3 ASN 102 2.496 0.232 16.277
791 HD21 ASN 102 HD21 ASN 102 3.479 1.607 14.659
792 HD22 ASN 102 HD22 ASN 102 5.194 1.999 14.784
793 H ARG 103 H ARG 103 1.538 -0.513 19.231
794 HA ARG 103 HA ARG 103 0.843 1.077 20.647
795 HB2 ARG 103 HB2 ARG 103 3.634 0.816 21.819
796 HB3 ARG 103 HB3 ARG 103 2.238 1.547 22.621
797 HG2 ARG 103 HG2 ARG 103 1.015 -0.621 22.456
798 HG3 ARG 103 HG3 ARG 103 2.477 -1.368 21.774
799 HD2 ARG 103 HD2 ARG 103 3.743 -0.811 23.805
800 HD3 ARG 103 HD3 ARG 103 2.321 0.005 24.488
801 HE ARG 103 HE ARG 103 1.547 -2.622 23.826
802 HH11 ARG 103 HH11 ARG 103 3.755 -1.036 26.136
803 HH12 ARG 103 HH12 ARG 103 3.594 -2.308 27.324
804 HH21 ARG 103 HH21 ARG 103 1.356 -4.240 25.405
805 HH22 ARG 103 HH22 ARG 103 2.237 -4.119 26.912
806 H GLY 104 H GLY 104 1.888 2.068 18.190
807 HA2 GLY 104 HA2 GLY 104 3.009 4.782 18.812
808 HA3 GLY 104 HA3 GLY 104 3.360 3.839 17.362
809 H ILE 105 H ILE 105 0.157 3.312 17.765
810 HA ILE 105 HA ILE 105 -0.863 4.866 15.732
811 HB ILE 105 HB ILE 105 -1.912 2.912 16.792
812 HG12 ILE 105 HG12 ILE 105 -3.765 5.312 16.628
813 HG13 ILE 105 HG13 ILE 105 -3.184 4.328 15.276
814 HG21 ILE 105 HG21 ILE 105 -1.556 3.593 19.197
815 HG22 ILE 105 HG22 ILE 105 -2.886 4.753 19.014
816 HG23 ILE 105 HG23 ILE 105 -3.176 3.012 18.847
817 HD11 ILE 105 HD11 ILE 105 -4.334 2.339 16.259
818 HD12 ILE 105 HD12 ILE 105 -5.012 3.392 17.525
819 HD13 ILE 105 HD13 ILE 105 -5.438 3.662 15.833
820 HA PRO 106 HA PRO 106 -1.531 8.902 17.723
821 HB2 PRO 106 HB2 PRO 106 -2.641 10.298 15.688
822 HB3 PRO 106 HB3 PRO 106 -0.924 9.793 15.698
823 HG2 PRO 106 HG2 PRO 106 -3.248 8.474 14.279
824 HG3 PRO 106 HG3 PRO 106 -1.609 8.823 13.647
825 HD2 PRO 106 HD2 PRO 106 -2.400 6.367 14.671
826 HD3 PRO 106 HD3 PRO 106 -0.710 6.951 14.695
827 HHA HEC 107 HHA HEC 107 -4.979 -2.916 1.070
828 HHB HEC 107 HHB HEC 107 0.333 0.513 2.274
829 HHC HEC 107 HHC HEC 107 -3.177 4.701 5.747
830 HHD HEC 107 HHD HEC 107 -8.399 1.075 4.832
831 HMA1 HEC 107 HMA1 HEC 107 0.844 -1.925 1.512
832 HMA2 HEC 107 HMA2 HEC 107 0.188 -2.572 0.007
833 HMA3 HEC 107 HMA3 HEC 107 0.553 -0.850 0.121
834 HAA1 HEC 107 HAA1 HEC 107 -3.449 -3.496 -0.394
835 HAA2 HEC 107 HAA2 HEC 107 -1.815 -3.183 -0.898
836 HBA1 HEC 107 HBA1 HEC 107 -0.943 -4.548 0.999
837 HBA2 HEC 107 HBA2 HEC 107 -2.600 -4.850 1.532
838 HMB1 HEC 107 HMB1 HEC 107 1.656 2.078 4.747
839 HMB2 HEC 107 HMB2 HEC 107 1.697 2.093 2.977
840 HMB3 HEC 107 HMB3 HEC 107 1.749 3.607 3.872
841 HAB HEC 107 HAB HEC 107 -1.278 5.451 5.608
842 HBB1 HEC 107 HBB1 HEC 107 0.167 6.912 4.398
843 HBB2 HEC 107 HBB2 HEC 107 0.742 5.575 3.387
844 HBB3 HEC 107 HBB3 HEC 107 -0.953 6.078 3.305
845 HMC1 HEC 107 HMC1 HEC 107 -6.445 5.217 7.550
846 HMC2 HEC 107 HMC2 HEC 107 -4.698 5.167 7.411
847 HMC3 HEC 107 HMC3 HEC 107 -5.664 5.972 6.153
848 HAC HEC 107 HAC HEC 107 -8.530 2.037 6.699
849 HBC1 HEC 107 HBC1 HEC 107 -9.901 3.902 7.203
850 HBC2 HEC 107 HBC2 HEC 107 -8.579 5.046 6.904
851 HBC3 HEC 107 HBC3 HEC 107 -9.243 4.085 5.571
852 HMD1 HEC 107 HMD1 HEC 107 -9.946 -0.853 2.452
853 HMD2 HEC 107 HMD2 HEC 107 -9.666 -2.157 3.614
854 HMD3 HEC 107 HMD3 HEC 107 -9.757 -0.483 4.170
855 HAD1 HEC 107 HAD1 HEC 107 -7.622 -3.876 1.765
856 HAD2 HEC 107 HAD2 HEC 107 -8.911 -2.759 1.358
857 HBD1 HEC 107 HBD1 HEC 107 -6.520 -3.462 -0.287
858 HBD2 HEC 107 HBD2 HEC 107 -8.207 -3.355 -0.713
Start of MODEL 5
1 H SER 1 H SER 1 12.867 5.419 9.821
2 HA SER 1 HA SER 1 12.101 6.595 8.020
3 HB2 SER 1 HB2 SER 1 13.916 5.184 7.197
4 HB3 SER 1 HB3 SER 1 12.753 3.944 6.708
5 HG SER 1 HG SER 1 13.312 5.265 4.977
6 H GLY 2 H GLY 2 10.807 3.818 6.347
7 HA2 GLY 2 HA2 GLY 2 8.369 4.841 5.536
8 HA3 GLY 2 HA3 GLY 2 8.713 3.159 5.745
9 H GLU 3 H GLU 3 9.135 3.264 8.666
10 HA GLU 3 HA GLU 3 6.575 2.699 9.712
11 HB2 GLU 3 HB2 GLU 3 8.878 2.152 10.677
12 HB3 GLU 3 HB3 GLU 3 8.991 3.817 11.192
13 HG2 GLU 3 HG2 GLU 3 8.326 2.574 13.094
14 HG3 GLU 3 HG3 GLU 3 6.902 3.478 12.595
15 H GLN 4 H GLN 4 8.398 5.804 9.775
16 HA GLN 4 HA GLN 4 6.401 7.171 11.374
17 HB2 GLN 4 HB2 GLN 4 8.882 7.668 11.254
18 HB3 GLN 4 HB3 GLN 4 8.599 8.377 9.656
19 HG2 GLN 4 HG2 GLN 4 7.037 10.032 10.690
20 HG3 GLN 4 HG3 GLN 4 7.270 9.266 12.266
21 HE21 GLN 4 HE21 GLN 4 7.954 11.523 12.922
22 HE22 GLN 4 HE22 GLN 4 9.627 11.973 12.589
23 H ILE 5 H ILE 5 6.946 6.766 7.891
24 HA ILE 5 HA ILE 5 4.925 8.725 7.097
25 HB ILE 5 HB ILE 5 6.347 6.511 5.595
26 HG12 ILE 5 HG12 ILE 5 7.121 8.401 4.234
27 HG13 ILE 5 HG13 ILE 5 6.214 9.542 5.224
28 HG21 ILE 5 HG21 ILE 5 4.129 8.372 4.607
29 HG22 ILE 5 HG22 ILE 5 5.162 7.390 3.557
30 HG23 ILE 5 HG23 ILE 5 4.057 6.599 4.677
31 HD11 ILE 5 HD11 ILE 5 8.570 7.884 6.199
32 HD12 ILE 5 HD12 ILE 5 8.657 9.560 5.607
33 HD13 ILE 5 HD13 ILE 5 7.749 9.203 7.081
34 H PHE 6 H PHE 6 4.911 5.157 7.633
35 HA PHE 6 HA PHE 6 2.138 4.746 7.193
36 HB2 PHE 6 HB2 PHE 6 3.278 2.767 7.466
37 HB3 PHE 6 HB3 PHE 6 4.311 3.385 8.738
38 HD1 PHE 6 HD1 PHE 6 0.651 2.688 8.190
39 HD2 PHE 6 HD2 PHE 6 3.994 2.570 10.909
40 HE1 PHE 6 HE1 PHE 6 -0.847 1.901 9.998
41 HE2 PHE 6 HE2 PHE 6 2.514 1.672 12.687
42 HZ PHE 6 HZ PHE 6 0.085 1.367 12.247
43 H ARG 7 H ARG 7 3.789 5.632 10.249
44 HA ARG 7 HA ARG 7 1.493 5.909 11.837
45 HB2 ARG 7 HB2 ARG 7 3.903 5.644 12.513
46 HB3 ARG 7 HB3 ARG 7 4.134 7.372 12.204
47 HG2 ARG 7 HG2 ARG 7 2.483 7.910 13.963
48 HG3 ARG 7 HG3 ARG 7 2.123 6.183 14.173
49 HD2 ARG 7 HD2 ARG 7 4.496 5.810 14.853
50 HD3 ARG 7 HD3 ARG 7 4.799 7.547 14.711
51 HE ARG 7 HE ARG 7 3.351 6.122 16.822
52 HH11 ARG 7 HH11 ARG 7 3.929 9.344 15.394
53 HH12 ARG 7 HH12 ARG 7 3.413 10.182 16.839
54 HH21 ARG 7 HH21 ARG 7 2.690 7.253 18.658
55 HH22 ARG 7 HH22 ARG 7 2.713 9.003 18.682
56 H THR 8 H THR 8 2.633 8.170 9.472
57 HA THR 8 HA THR 8 0.955 10.374 10.608
58 HB THR 8 HB THR 8 2.174 11.816 8.939
59 HG1 THR 8 HG1 THR 8 4.017 9.687 8.939
60 HG21 THR 8 HG21 THR 8 4.350 11.790 10.255
61 HG22 THR 8 HG22 THR 8 3.720 10.399 11.151
62 HG23 THR 8 HG23 THR 8 2.880 11.961 11.213
63 H ARG 9 H ARG 9 1.455 8.602 7.546
64 HA ARG 9 HA ARG 9 -0.890 9.942 6.342
65 HB2 ARG 9 HB2 ARG 9 1.132 8.015 5.165
66 HB3 ARG 9 HB3 ARG 9 -0.112 8.863 4.262
67 HG2 ARG 9 HG2 ARG 9 2.158 10.261 5.764
68 HG3 ARG 9 HG3 ARG 9 2.187 9.818 4.070
69 HD2 ARG 9 HD2 ARG 9 1.613 12.095 4.071
70 HD3 ARG 9 HD3 ARG 9 0.128 11.228 3.701
71 HE ARG 9 HE ARG 9 -0.806 11.941 5.696
72 HH11 ARG 9 HH11 ARG 9 2.657 12.803 5.735
73 HH12 ARG 9 HH12 ARG 9 2.486 13.831 7.140
74 HH21 ARG 9 HH21 ARG 9 -0.974 13.281 7.503
75 HH22 ARG 9 HH22 ARG 9 0.435 14.103 8.137
76 H CYS 10 H CYS 10 -0.089 6.733 7.569
77 HA CYS 10 HA CYS 10 -2.522 5.609 6.236
78 HB2 CYS 10 HB2 CYS 10 0.096 4.241 6.829
79 HB3 CYS 10 HB3 CYS 10 -1.218 3.610 5.844
80 H SER 11 H SER 11 -1.717 6.392 9.245
81 HA SER 11 HA SER 11 -2.285 4.059 10.821
82 HB2 SER 11 HB2 SER 11 -2.381 5.691 12.645
83 HB3 SER 11 HB3 SER 11 -1.002 6.016 11.599
84 HG SER 11 HG SER 11 -2.357 7.867 12.217
85 H SER 12 H SER 12 -4.189 4.353 12.521
86 HA SER 12 HA SER 12 -6.347 4.037 12.944
87 HB2 SER 12 HB2 SER 12 -7.112 5.866 10.667
88 HB3 SER 12 HB3 SER 12 -8.087 5.421 12.071
89 HG SER 12 HG SER 12 -6.932 7.516 12.012
90 H CYS 13 H CYS 13 -4.928 2.533 10.662
91 HA CYS 13 HA CYS 13 -7.143 0.709 10.125
92 HB2 CYS 13 HB2 CYS 13 -5.649 1.909 7.767
93 HB3 CYS 13 HB3 CYS 13 -6.684 0.488 7.720
94 H HIS 14 H HIS 14 -3.734 1.376 8.994
95 HA HIS 14 HA HIS 14 -3.265 -1.525 8.892
96 HB2 HIS 14 2HB HIS 14 -1.863 0.936 7.860
97 HB3 HIS 14 3HB HIS 14 -0.991 -0.568 7.911
98 HD1 HIS 14 1HD HIS 14 -2.226 -2.705 6.481
99 HD2 HIS 14 2HD HIS 14 -3.110 1.309 5.794
100 HE1 HIS 14 1HE HIS 14 -3.048 -2.630 4.097
101 H THR 15 H THR 15 -1.053 -2.176 9.221
102 HA THR 15 HA THR 15 0.721 -0.857 11.040
103 HB THR 15 HB THR 15 1.309 -2.773 12.451
104 HG1 THR 15 HG1 THR 15 0.138 -4.483 12.616
105 HG21 THR 15 HG21 THR 15 -0.242 -1.007 13.340
106 HG22 THR 15 HG22 THR 15 -0.364 -2.587 14.125
107 HG23 THR 15 HG23 THR 15 -1.600 -2.084 12.955
108 H VAL 16 H VAL 16 2.966 -1.827 10.878
109 HA VAL 16 HA VAL 16 3.249 -3.484 8.400
110 HB VAL 16 HB VAL 16 5.508 -1.955 9.706
111 HG11 VAL 16 HG11 VAL 16 6.465 -2.247 7.409
112 HG12 VAL 16 HG12 VAL 16 6.148 -3.801 8.185
113 HG13 VAL 16 HG13 VAL 16 5.046 -3.194 6.931
114 HG21 VAL 16 HG21 VAL 16 3.791 -1.030 7.370
115 HG22 VAL 16 HG22 VAL 16 3.813 -0.286 8.987
116 HG23 VAL 16 HG23 VAL 16 5.261 -0.250 7.980
117 H GLY 17 H GLY 17 2.680 -5.394 9.290
118 HA2 GLY 17 HA2 GLY 17 3.312 -7.523 9.995
119 HA3 GLY 17 HA3 GLY 17 4.834 -6.869 10.608
120 H ASN 18 H ASN 18 4.228 -5.117 12.482
121 HA ASN 18 HA ASN 18 3.723 -6.442 14.823
122 HB2 ASN 18 HB2 ASN 18 2.904 -3.542 14.293
123 HB3 ASN 18 HB3 ASN 18 3.336 -4.238 15.839
124 HD21 ASN 18 HD21 ASN 18 4.643 -2.144 15.719
125 HD22 ASN 18 HD22 ASN 18 6.172 -2.234 14.854
126 H THR 19 H THR 19 1.904 -7.687 15.342
127 HA THR 19 HA THR 19 -0.747 -6.842 14.417
128 HB THR 19 HB THR 19 -0.014 -9.182 14.491
129 HG1 THR 19 HG1 THR 19 -2.401 -8.784 15.921
130 HG21 THR 19 HG21 THR 19 0.888 -9.221 16.776
131 HG22 THR 19 HG22 THR 19 -0.368 -10.456 16.516
132 HG23 THR 19 HG23 THR 19 -0.742 -8.965 17.422
133 H GLU 20 H GLU 20 -2.101 -5.453 15.372
134 HA GLU 20 HA GLU 20 -1.787 -4.930 18.294
135 HB2 GLU 20 HB2 GLU 20 -1.946 -2.800 16.121
136 HB3 GLU 20 HB3 GLU 20 -2.021 -2.511 17.860
137 HG2 GLU 20 HG2 GLU 20 0.260 -3.658 18.029
138 HG3 GLU 20 HG3 GLU 20 0.358 -3.544 16.275
139 HA PRO 21 HA PRO 21 -6.245 -4.948 18.134
140 HB2 PRO 21 HB2 PRO 21 -6.863 -4.406 20.706
141 HB3 PRO 21 HB3 PRO 21 -5.891 -5.839 20.263
142 HG2 PRO 21 HG2 PRO 21 -4.885 -3.144 21.239
143 HG3 PRO 21 HG3 PRO 21 -4.432 -4.781 21.821
144 HD2 PRO 21 HD2 PRO 21 -2.971 -3.369 19.953
145 HD3 PRO 21 HD3 PRO 21 -3.025 -5.152 20.042
146 H GLY 22 H GLY 22 -4.789 -2.308 17.413
147 HA2 GLY 22 HA2 GLY 22 -6.113 -0.068 18.565
148 HA3 GLY 22 HA3 GLY 22 -5.177 -0.096 17.072
149 H GLN 23 H GLN 23 -6.423 -1.284 15.196
150 HA GLN 23 HA GLN 23 -9.295 -0.541 15.176
151 HB2 GLN 23 HB2 GLN 23 -7.264 0.414 13.136
152 HB3 GLN 23 HB3 GLN 23 -9.007 0.505 12.907
153 HG2 GLN 23 HG2 GLN 23 -7.496 1.905 15.164
154 HG3 GLN 23 HG3 GLN 23 -7.981 2.644 13.656
155 HE21 GLN 23 HE21 GLN 23 -8.872 3.982 15.810
156 HE22 GLN 23 HE22 GLN 23 -10.598 3.683 16.007
157 HA PRO 24 HA PRO 24 -8.330 -4.645 13.231
158 HB2 PRO 24 HB2 PRO 24 -9.508 -6.385 14.960
159 HB3 PRO 24 HB3 PRO 24 -7.923 -5.643 15.326
160 HG2 PRO 24 HG2 PRO 24 -10.666 -4.696 16.242
161 HG3 PRO 24 HG3 PRO 24 -9.221 -5.019 17.255
162 HD2 PRO 24 HD2 PRO 24 -9.809 -2.507 16.371
163 HD3 PRO 24 HD3 PRO 24 -8.123 -3.098 16.474
164 H GLY 25 H GLY 25 -11.025 -2.866 13.808
165 HA2 GLY 25 HA2 GLY 25 -13.170 -4.505 12.789
166 HA3 GLY 25 HA3 GLY 25 -13.158 -2.744 12.928
167 H ILE 26 H ILE 26 -10.677 -2.513 11.335
168 HA ILE 26 HA ILE 26 -11.569 -3.394 8.625
169 HB ILE 26 HB ILE 26 -9.263 -1.483 9.041
170 HG12 ILE 26 HG12 ILE 26 -11.067 0.315 8.316
171 HG13 ILE 26 HG13 ILE 26 -12.200 -0.738 9.154
172 HG21 ILE 26 HG21 ILE 26 -9.789 -2.680 6.846
173 HG22 ILE 26 HG22 ILE 26 -11.307 -1.792 6.812
174 HG23 ILE 26 HG23 ILE 26 -9.770 -0.902 6.755
175 HD11 ILE 26 HD11 ILE 26 -11.355 1.099 10.584
176 HD12 ILE 26 HD12 ILE 26 -10.822 -0.451 11.249
177 HD13 ILE 26 HD13 ILE 26 -9.686 0.559 10.329
178 H GLY 27 H GLY 27 -8.631 -3.152 10.665
179 HA2 GLY 27 HA2 GLY 27 -6.977 -4.634 11.168
180 HA3 GLY 27 HA3 GLY 27 -8.019 -5.925 10.595
181 HA PRO 28 HA PRO 28 -5.596 -5.559 6.652
182 HB2 PRO 28 HB2 PRO 28 -4.973 -3.303 5.359
183 HB3 PRO 28 HB3 PRO 28 -6.665 -3.809 5.565
184 HG2 PRO 28 HG2 PRO 28 -5.129 -1.876 7.364
185 HG3 PRO 28 HG3 PRO 28 -6.652 -1.549 6.463
186 HD2 PRO 28 HD2 PRO 28 -6.784 -2.429 9.005
187 HD3 PRO 28 HD3 PRO 28 -7.863 -3.069 7.742
188 H ASP 29 H ASP 29 -3.410 -5.245 5.637
189 HA ASP 29 HA ASP 29 -1.331 -4.995 7.793
190 HB2 ASP 29 HB2 ASP 29 -1.945 -7.272 5.869
191 HB3 ASP 29 HB3 ASP 29 -0.571 -7.238 6.956
192 H LEU 30 H LEU 30 0.949 -5.069 6.919
193 HA LEU 30 HA LEU 30 1.245 -4.035 4.121
194 HB2 LEU 30 HB2 LEU 30 2.367 -2.719 6.620
195 HB3 LEU 30 HB3 LEU 30 2.822 -2.278 4.984
196 HG LEU 30 HG LEU 30 0.042 -2.011 6.156
197 HD11 LEU 30 HD11 LEU 30 1.559 -0.439 7.212
198 HD12 LEU 30 HD12 LEU 30 0.510 0.436 6.095
199 HD13 LEU 30 HD13 LEU 30 2.189 0.081 5.629
200 HD21 LEU 30 HD21 LEU 30 1.247 -0.976 3.537
201 HD22 LEU 30 HD22 LEU 30 -0.368 -0.562 4.157
202 HD23 LEU 30 HD23 LEU 30 -0.006 -2.227 3.670
203 H LEU 31 H LEU 31 2.625 -6.019 6.648
204 HA LEU 31 HA LEU 31 5.341 -5.887 5.601
205 HB2 LEU 31 HB2 LEU 31 4.832 -6.290 7.887
206 HB3 LEU 31 HB3 LEU 31 4.158 -7.880 7.513
207 HG LEU 31 HG LEU 31 6.933 -7.247 6.496
208 HD11 LEU 31 HD11 LEU 31 8.005 -7.706 8.608
209 HD12 LEU 31 HD12 LEU 31 6.435 -7.872 9.423
210 HD13 LEU 31 HD13 LEU 31 6.948 -6.295 8.767
211 HD21 LEU 31 HD21 LEU 31 5.909 -9.473 6.124
212 HD22 LEU 31 HD22 LEU 31 5.734 -9.687 7.877
213 HD23 LEU 31 HD23 LEU 31 7.351 -9.570 7.157
214 H GLY 32 H GLY 32 6.398 -7.195 4.296
215 HA2 GLY 32 HA2 GLY 32 6.897 -8.984 2.880
216 HA3 GLY 32 HA3 GLY 32 5.339 -9.697 3.245
217 H VAL 33 H VAL 33 4.414 -6.697 2.158
218 HA VAL 33 HA VAL 33 3.102 -7.832 0.046
219 HB VAL 33 HB VAL 33 2.498 -5.540 -0.621
220 HG11 VAL 33 HG11 VAL 33 1.239 -6.618 1.135
221 HG12 VAL 33 HG12 VAL 33 2.414 -6.125 2.359
222 HG13 VAL 33 HG13 VAL 33 1.431 -4.908 1.532
223 HG21 VAL 33 HG21 VAL 33 3.273 -3.604 0.640
224 HG22 VAL 33 HG22 VAL 33 4.418 -4.604 1.547
225 HG23 VAL 33 HG23 VAL 33 4.631 -4.363 -0.198
226 H THR 34 H THR 34 6.370 -6.521 -0.268
227 HA THR 34 HA THR 34 6.155 -6.340 -3.185
228 HB THR 34 HB THR 34 7.719 -4.923 -1.862
229 HG1 THR 34 HG1 THR 34 9.219 -4.996 -3.493
230 HG21 THR 34 HG21 THR 34 9.945 -5.765 -1.366
231 HG22 THR 34 HG22 THR 34 9.488 -7.408 -1.849
232 HG23 THR 34 HG23 THR 34 8.749 -6.656 -0.414
233 H ARG 35 H ARG 35 6.738 -9.042 -1.012
234 HA ARG 35 HA ARG 35 7.852 -10.633 -3.226
235 HB2 ARG 35 HB2 ARG 35 7.953 -12.498 -1.841
236 HB3 ARG 35 HB3 ARG 35 8.667 -11.134 -1.012
237 HG2 ARG 35 HG2 ARG 35 7.091 -11.108 0.652
238 HG3 ARG 35 HG3 ARG 35 5.784 -11.728 -0.370
239 HD2 ARG 35 HD2 ARG 35 8.136 -13.379 0.643
240 HD3 ARG 35 HD3 ARG 35 6.561 -13.300 1.435
241 HE ARG 35 HE ARG 35 7.262 -14.750 -1.000
242 HH11 ARG 35 HH11 ARG 35 4.523 -13.434 0.879
243 HH12 ARG 35 HH12 ARG 35 3.361 -14.492 0.109
244 HH21 ARG 35 HH21 ARG 35 5.720 -16.086 -1.967
245 HH22 ARG 35 HH22 ARG 35 4.036 -15.987 -1.499
246 H GLN 36 H GLN 36 4.683 -9.725 -2.283
247 HA GLN 36 HA GLN 36 3.532 -12.007 -3.816
248 HB2 GLN 36 HB2 GLN 36 1.645 -11.937 -2.551
249 HB3 GLN 36 HB3 GLN 36 2.891 -11.534 -1.375
250 HG2 GLN 36 HG2 GLN 36 2.291 -9.067 -1.826
251 HG3 GLN 36 HG3 GLN 36 0.894 -9.673 -2.725
252 HE21 GLN 36 HE21 GLN 36 0.225 -8.003 -0.737
253 HE22 GLN 36 HE22 GLN 36 -0.136 -8.856 0.763
254 H ARG 37 H ARG 37 4.217 -8.714 -4.365
255 HA ARG 37 HA ARG 37 2.257 -8.590 -6.632
256 HB2 ARG 37 HB2 ARG 37 3.041 -6.322 -4.754
257 HB3 ARG 37 HB3 ARG 37 2.027 -6.161 -6.183
258 HG2 ARG 37 HG2 ARG 37 1.331 -7.758 -3.702
259 HG3 ARG 37 HG3 ARG 37 0.725 -6.170 -4.110
260 HD2 ARG 37 HD2 ARG 37 -0.400 -7.049 -6.113
261 HD3 ARG 37 HD3 ARG 37 0.265 -8.656 -5.804
262 HE ARG 37 HE ARG 37 -1.468 -7.337 -3.776
263 HH11 ARG 37 HH11 ARG 37 -0.996 -10.054 -6.043
264 HH12 ARG 37 HH12 ARG 37 -2.350 -10.956 -5.400
265 HH21 ARG 37 HH21 ARG 37 -3.209 -8.541 -2.985
266 HH22 ARG 37 HH22 ARG 37 -3.598 -10.102 -3.674
267 H ASP 38 H ASP 38 2.833 -7.009 -8.315
268 HA ASP 38 HA ASP 38 5.643 -7.109 -9.106
269 HB2 ASP 38 HB2 ASP 38 3.898 -7.341 -10.781
270 HB3 ASP 38 HB3 ASP 38 3.165 -5.812 -10.305
271 H ALA 39 H ALA 39 7.102 -5.439 -9.371
272 HA ALA 39 HA ALA 39 7.104 -3.525 -7.290
273 HB1 ALA 39 HB1 ALA 39 8.912 -3.790 -9.724
274 HB2 ALA 39 HB2 ALA 39 9.301 -2.963 -8.199
275 HB3 ALA 39 HB3 ALA 39 9.064 -4.727 -8.218
276 H ASN 40 H ASN 40 5.946 -3.101 -10.624
277 HA ASN 40 HA ASN 40 5.958 -0.130 -10.284
278 HB2 ASN 40 HB2 ASN 40 5.125 -1.933 -12.587
279 HB3 ASN 40 HB3 ASN 40 4.802 -0.205 -12.538
280 HD21 ASN 40 HD21 ASN 40 7.144 -2.572 -13.353
281 HD22 ASN 40 HD22 ASN 40 8.379 -1.407 -13.776
282 H TRP 41 H TRP 41 3.672 -2.880 -10.532
283 HA TRP 41 HA TRP 41 1.244 -1.454 -10.165
284 HB2 TRP 41 HB2 TRP 41 1.461 -3.887 -10.750
285 HB3 TRP 41 HB3 TRP 41 2.016 -4.214 -9.117
286 HD1 TRP 41 HD1 TRP 41 -1.114 -3.677 -11.132
287 HE1 TRP 41 HE1 TRP 41 -3.204 -4.089 -9.725
288 HE3 TRP 41 HE3 TRP 41 1.111 -4.024 -6.531
289 HZ2 TRP 41 HZ2 TRP 41 -3.834 -4.326 -6.903
290 HZ3 TRP 41 HZ3 TRP 41 -0.290 -4.209 -4.469
291 HH2 TRP 41 HH2 TRP 41 -2.730 -4.345 -4.647
292 H LEU 42 H LEU 42 3.461 -2.762 -7.637
293 HA LEU 42 HA LEU 42 1.798 -2.111 -5.448
294 HB2 LEU 42 HB2 LEU 42 3.654 -3.716 -5.387
295 HB3 LEU 42 HB3 LEU 42 4.820 -2.422 -5.648
296 HG LEU 42 HG LEU 42 4.279 -1.445 -3.446
297 HD11 LEU 42 HD11 LEU 42 2.908 -2.741 -1.827
298 HD12 LEU 42 HD12 LEU 42 2.411 -3.843 -3.131
299 HD13 LEU 42 HD13 LEU 42 1.930 -2.128 -3.167
300 HD21 LEU 42 HD21 LEU 42 4.838 -4.433 -3.271
301 HD22 LEU 42 HD22 LEU 42 5.304 -3.179 -2.091
302 HD23 LEU 42 HD23 LEU 42 6.040 -3.194 -3.698
303 H VAL 43 H VAL 43 4.347 -0.110 -6.966
304 HA VAL 43 HA VAL 43 4.136 2.042 -5.028
305 HB VAL 43 HB VAL 43 5.332 2.112 -7.815
306 HG11 VAL 43 HG11 VAL 43 5.739 3.911 -5.373
307 HG12 VAL 43 HG12 VAL 43 6.661 4.004 -6.888
308 HG13 VAL 43 HG13 VAL 43 4.938 4.385 -6.887
309 HG21 VAL 43 HG21 VAL 43 6.443 0.389 -6.443
310 HG22 VAL 43 HG22 VAL 43 7.497 1.799 -6.559
311 HG23 VAL 43 HG23 VAL 43 6.559 1.501 -5.082
312 H ARG 44 H ARG 44 2.598 1.408 -8.175
313 HA ARG 44 HA ARG 44 1.129 3.902 -8.264
314 HB2 ARG 44 HB2 ARG 44 0.690 1.209 -9.600
315 HB3 ARG 44 HB3 ARG 44 -0.291 2.647 -9.927
316 HG2 ARG 44 HG2 ARG 44 1.635 3.882 -10.738
317 HG3 ARG 44 HG3 ARG 44 2.738 2.578 -10.279
318 HD2 ARG 44 HD2 ARG 44 1.600 1.051 -11.873
319 HD3 ARG 44 HD3 ARG 44 0.542 2.375 -12.382
320 HE ARG 44 HE ARG 44 3.423 2.012 -12.949
321 HH11 ARG 44 HH11 ARG 44 0.602 4.179 -13.288
322 HH12 ARG 44 HH12 ARG 44 1.377 5.152 -14.518
323 HH21 ARG 44 HH21 ARG 44 4.378 3.307 -14.531
324 HH22 ARG 44 HH22 ARG 44 3.507 4.659 -15.219
325 H TRP 45 H TRP 45 0.239 0.620 -7.115
326 HA TRP 45 HA TRP 45 -2.419 1.174 -6.312
327 HB2 TRP 45 HB2 TRP 45 -1.635 -1.100 -6.523
328 HB3 TRP 45 HB3 TRP 45 -0.373 -0.845 -5.323
329 HD1 TRP 45 HD1 TRP 45 -0.928 -1.647 -2.963
330 HE1 TRP 45 HE1 TRP 45 -3.036 -2.250 -1.656
331 HE3 TRP 45 HE3 TRP 45 -4.454 -0.233 -6.398
332 HZ2 TRP 45 HZ2 TRP 45 -5.910 -2.019 -1.982
333 HZ3 TRP 45 HZ3 TRP 45 -6.869 -0.373 -5.853
334 HH2 TRP 45 HH2 TRP 45 -7.610 -1.274 -3.658
335 H LEU 46 H LEU 46 0.562 1.239 -4.247
336 HA LEU 46 HA LEU 46 -1.053 1.986 -1.984
337 HB2 LEU 46 HB2 LEU 46 0.624 1.391 -0.760
338 HB3 LEU 46 HB3 LEU 46 1.343 0.754 -2.224
339 HG LEU 46 HG LEU 46 2.021 3.457 -0.967
340 HD11 LEU 46 HD11 LEU 46 3.511 0.794 -1.010
341 HD12 LEU 46 HD12 LEU 46 2.742 1.522 0.412
342 HD13 LEU 46 HD13 LEU 46 4.124 2.324 -0.349
343 HD21 LEU 46 HD21 LEU 46 3.889 3.464 -2.517
344 HD22 LEU 46 HD22 LEU 46 2.395 3.300 -3.450
345 HD23 LEU 46 HD23 LEU 46 3.394 1.866 -3.133
346 H LYS 47 H LYS 47 -0.021 3.901 -4.509
347 HA LYS 47 HA LYS 47 -0.076 6.402 -2.922
348 HB2 LYS 47 HB2 LYS 47 1.781 5.795 -4.591
349 HB3 LYS 47 HB3 LYS 47 0.593 6.083 -5.875
350 HG2 LYS 47 HG2 LYS 47 0.256 8.390 -4.941
351 HG3 LYS 47 HG3 LYS 47 1.486 8.045 -3.715
352 HD2 LYS 47 HD2 LYS 47 3.152 7.644 -5.574
353 HD3 LYS 47 HD3 LYS 47 1.914 8.163 -6.738
354 HE2 LYS 47 HE2 LYS 47 1.750 10.359 -5.580
355 HE3 LYS 47 HE3 LYS 47 2.947 9.825 -4.394
356 HZ1 LYS 47 HZ1 LYS 47 4.544 9.602 -6.253
357 HZ2 LYS 47 HZ2 LYS 47 4.041 11.138 -6.004
358 HZ3 LYS 47 HZ3 LYS 47 3.457 10.260 -7.283
359 H VAL 48 H VAL 48 -1.775 4.956 -5.772
360 HA VAL 48 HA VAL 48 -4.004 6.908 -5.289
361 HB VAL 48 HB VAL 48 -4.285 7.067 -7.740
362 HG11 VAL 48 HG11 VAL 48 -3.208 8.803 -6.335
363 HG12 VAL 48 HG12 VAL 48 -1.624 8.101 -6.736
364 HG13 VAL 48 HG13 VAL 48 -2.654 8.785 -8.010
365 HG21 VAL 48 HG21 VAL 48 -2.525 6.517 -9.265
366 HG22 VAL 48 HG22 VAL 48 -1.453 5.979 -7.962
367 HG23 VAL 48 HG23 VAL 48 -2.898 5.038 -8.382
368 HA PRO 49 HA PRO 49 -5.316 2.420 -5.479
369 HB2 PRO 49 HB2 PRO 49 -6.676 2.210 -3.104
370 HB3 PRO 49 HB3 PRO 49 -4.901 2.078 -3.257
371 HG2 PRO 49 HG2 PRO 49 -6.508 4.572 -2.571
372 HG3 PRO 49 HG3 PRO 49 -5.118 3.892 -1.661
373 HD2 PRO 49 HD2 PRO 49 -4.754 5.879 -3.397
374 HD3 PRO 49 HD3 PRO 49 -3.601 4.507 -3.351
375 H ASP 50 H ASP 50 -7.421 5.280 -4.884
376 HA ASP 50 HA ASP 50 -9.842 3.767 -5.739
377 HB2 ASP 50 HB2 ASP 50 -10.016 5.533 -4.014
378 HB3 ASP 50 HB3 ASP 50 -9.447 6.720 -5.197
379 H GLN 51 H GLN 51 -7.446 5.981 -7.089
380 HA GLN 51 HA GLN 51 -8.716 6.359 -9.650
381 HB2 GLN 51 HB2 GLN 51 -6.388 7.242 -8.255
382 HB3 GLN 51 HB3 GLN 51 -5.793 6.492 -9.733
383 HG2 GLN 51 HG2 GLN 51 -7.926 8.669 -9.570
384 HG3 GLN 51 HG3 GLN 51 -6.215 8.958 -9.872
385 HE21 GLN 51 HE21 GLN 51 -5.254 8.072 -11.868
386 HE22 GLN 51 HE22 GLN 51 -6.290 7.750 -13.257
387 H MET 52 H MET 52 -6.382 3.937 -8.412
388 HA MET 52 HA MET 52 -6.169 2.428 -10.846
389 HB2 MET 52 HB2 MET 52 -4.630 2.294 -8.811
390 HB3 MET 52 HB3 MET 52 -5.911 1.407 -7.974
391 HG2 MET 52 HG2 MET 52 -4.479 -0.260 -8.811
392 HG3 MET 52 HG3 MET 52 -5.852 -0.270 -9.899
393 HE1 MET 52 HE1 MET 52 -2.245 1.162 -9.325
394 HE2 MET 52 HE2 MET 52 -2.219 -0.588 -9.639
395 HE3 MET 52 HE3 MET 52 -1.474 0.529 -10.804
396 H LEU 53 H LEU 53 -8.427 2.040 -8.024
397 HA LEU 53 HA LEU 53 -9.708 -0.252 -9.183
398 HB2 LEU 53 HB2 LEU 53 -9.630 0.478 -6.728
399 HB3 LEU 53 HB3 LEU 53 -10.860 1.672 -7.135
400 HG LEU 53 HG LEU 53 -12.319 -0.269 -7.936
401 HD11 LEU 53 HD11 LEU 53 -11.775 -2.524 -7.097
402 HD12 LEU 53 HD12 LEU 53 -10.212 -1.946 -6.480
403 HD13 LEU 53 HD13 LEU 53 -10.533 -2.000 -8.226
404 HD21 LEU 53 HD21 LEU 53 -12.941 -0.959 -5.645
405 HD22 LEU 53 HD22 LEU 53 -12.642 0.784 -5.738
406 HD23 LEU 53 HD23 LEU 53 -11.416 -0.289 -5.024
407 H ALA 54 H ALA 54 -10.237 3.221 -9.604
408 HA ALA 54 HA ALA 54 -12.635 2.973 -11.199
409 HB1 ALA 54 HB1 ALA 54 -10.544 5.181 -11.017
410 HB2 ALA 54 HB2 ALA 54 -12.116 5.310 -11.829
411 HB3 ALA 54 HB3 ALA 54 -12.046 5.066 -10.077
412 H GLU 55 H GLU 55 -9.151 2.651 -11.989
413 HA GLU 55 HA GLU 55 -9.774 2.489 -14.848
414 HB2 GLU 55 HB2 GLU 55 -7.638 2.401 -15.331
415 HB3 GLU 55 HB3 GLU 55 -7.524 3.281 -13.831
416 HG2 GLU 55 HG2 GLU 55 -6.426 1.484 -12.763
417 HG3 GLU 55 HG3 GLU 55 -7.054 0.272 -13.879
418 H LYS 56 H LYS 56 -10.322 0.426 -12.333
419 HA LYS 56 HA LYS 56 -10.803 -1.760 -12.056
420 HB2 LYS 56 HB2 LYS 56 -11.633 -1.579 -14.971
421 HB3 LYS 56 HB3 LYS 56 -12.121 -2.841 -13.832
422 HG2 LYS 56 HG2 LYS 56 -13.284 -1.207 -12.425
423 HG3 LYS 56 HG3 LYS 56 -12.710 0.126 -13.424
424 HD2 LYS 56 HD2 LYS 56 -14.960 -0.236 -14.016
425 HD3 LYS 56 HD3 LYS 56 -13.971 -0.795 -15.371
426 HE2 LYS 56 HE2 LYS 56 -14.268 -3.152 -14.575
427 HE3 LYS 56 HE3 LYS 56 -15.265 -2.554 -13.232
428 HZ1 LYS 56 HZ1 LYS 56 -16.615 -3.296 -15.130
429 HZ2 LYS 56 HZ2 LYS 56 -15.886 -2.228 -16.114
430 HZ3 LYS 56 HZ3 LYS 56 -16.852 -1.697 -14.886
431 H ASP 57 H ASP 57 -8.234 -1.553 -12.097
432 HA ASP 57 HA ASP 57 -6.728 -3.339 -13.805
433 HB2 ASP 57 HB2 ASP 57 -5.494 -1.707 -12.545
434 HB3 ASP 57 HB3 ASP 57 -6.203 -2.267 -11.022
435 HA PRO 58 HA PRO 58 -9.212 -6.521 -12.307
436 HB2 PRO 58 HB2 PRO 58 -8.597 -8.411 -14.041
437 HB3 PRO 58 HB3 PRO 58 -9.118 -6.722 -14.516
438 HG2 PRO 58 HG2 PRO 58 -6.214 -7.608 -14.287
439 HG3 PRO 58 HG3 PRO 58 -7.066 -7.150 -15.814
440 HD2 PRO 58 HD2 PRO 58 -5.793 -5.382 -14.240
441 HD3 PRO 58 HD3 PRO 58 -7.379 -4.968 -14.976
442 H LEU 59 H LEU 59 -6.052 -6.503 -11.691
443 HA LEU 59 HA LEU 59 -5.972 -8.860 -9.880
444 HB2 LEU 59 HB2 LEU 59 -3.933 -8.057 -11.133
445 HB3 LEU 59 HB3 LEU 59 -3.945 -6.596 -10.183
446 HG LEU 59 HG LEU 59 -2.289 -8.282 -9.485
447 HD11 LEU 59 HD11 LEU 59 -3.287 -6.611 -7.860
448 HD12 LEU 59 HD12 LEU 59 -2.476 -8.020 -7.177
449 HD13 LEU 59 HD13 LEU 59 -4.245 -7.958 -7.203
450 HD21 LEU 59 HD21 LEU 59 -3.731 -10.283 -9.947
451 HD22 LEU 59 HD22 LEU 59 -4.620 -9.945 -8.445
452 HD23 LEU 59 HD23 LEU 59 -2.893 -10.325 -8.385
453 H ALA 60 H ALA 60 -5.866 -5.223 -9.525
454 HA ALA 60 HA ALA 60 -6.357 -5.276 -6.722
455 HB1 ALA 60 HB1 ALA 60 -5.540 -3.305 -7.980
456 HB2 ALA 60 HB2 ALA 60 -7.153 -3.129 -8.707
457 HB3 ALA 60 HB3 ALA 60 -6.946 -2.961 -6.945
458 H MET 61 H MET 61 -8.734 -5.103 -9.428
459 HA MET 61 HA MET 61 -11.095 -4.899 -7.934
460 HB2 MET 61 HB2 MET 61 -10.445 -6.343 -10.522
461 HB3 MET 61 HB3 MET 61 -12.082 -6.065 -9.946
462 HG2 MET 61 HG2 MET 61 -10.136 -3.766 -10.340
463 HG3 MET 61 HG3 MET 61 -11.094 -4.408 -11.664
464 HE1 MET 61 HE1 MET 61 -13.453 -4.298 -11.957
465 HE2 MET 61 HE2 MET 61 -13.931 -5.024 -10.411
466 HE3 MET 61 HE3 MET 61 -14.668 -3.486 -10.923
467 H LEU 62 H LEU 62 -9.017 -7.778 -8.303
468 HA LEU 62 HA LEU 62 -11.014 -9.575 -7.077
469 HB2 LEU 62 HB2 LEU 62 -8.059 -9.862 -7.689
470 HB3 LEU 62 HB3 LEU 62 -9.010 -11.106 -6.907
471 HG LEU 62 HG LEU 62 -9.535 -10.066 -9.716
472 HD11 LEU 62 HD11 LEU 62 -7.420 -11.343 -9.502
473 HD12 LEU 62 HD12 LEU 62 -8.632 -12.252 -10.426
474 HD13 LEU 62 HD13 LEU 62 -8.298 -12.680 -8.733
475 HD21 LEU 62 HD21 LEU 62 -10.987 -12.063 -9.927
476 HD22 LEU 62 HD22 LEU 62 -11.596 -10.937 -8.713
477 HD23 LEU 62 HD23 LEU 62 -10.730 -12.420 -8.205
478 H LEU 63 H LEU 63 -8.042 -7.764 -6.006
479 HA LEU 63 HA LEU 63 -8.088 -9.185 -3.445
480 HB2 LEU 63 HB2 LEU 63 -6.190 -8.134 -2.858
481 HB3 LEU 63 HB3 LEU 63 -6.061 -8.280 -4.600
482 HG LEU 63 HG LEU 63 -7.082 -5.784 -4.516
483 HD11 LEU 63 HD11 LEU 63 -5.585 -6.043 -1.875
484 HD12 LEU 63 HD12 LEU 63 -7.329 -5.816 -2.030
485 HD13 LEU 63 HD13 LEU 63 -6.229 -4.543 -2.587
486 HD21 LEU 63 HD21 LEU 63 -4.855 -4.905 -4.610
487 HD22 LEU 63 HD22 LEU 63 -4.880 -6.464 -5.454
488 HD23 LEU 63 HD23 LEU 63 -4.183 -6.361 -3.828
489 H PHE 64 H PHE 64 -9.534 -6.211 -4.639
490 HA PHE 64 HA PHE 64 -10.050 -5.220 -1.961
491 HB2 PHE 64 HB2 PHE 64 -10.428 -3.339 -3.002
492 HB3 PHE 64 HB3 PHE 64 -10.150 -4.115 -4.536
493 HD1 PHE 64 HD2 PHE 64 -12.130 -5.053 -5.839
494 HD2 PHE 64 HD1 PHE 64 -12.599 -2.623 -2.324
495 HE1 PHE 64 HE2 PHE 64 -14.484 -4.624 -6.454
496 HE2 PHE 64 HE1 PHE 64 -14.917 -2.122 -2.954
497 HZ PHE 64 HZ PHE 64 -15.904 -3.143 -5.022
498 H GLU 65 H GLU 65 -12.060 -7.163 -4.229
499 HA GLU 65 HA GLU 65 -14.193 -7.252 -2.252
500 HB2 GLU 65 HB2 GLU 65 -15.470 -8.540 -3.667
501 HB3 GLU 65 HB3 GLU 65 -14.719 -7.289 -4.646
502 HG2 GLU 65 HG2 GLU 65 -13.179 -8.912 -5.627
503 HG3 GLU 65 HG3 GLU 65 -13.730 -10.170 -4.513
504 H GLN 66 H GLN 66 -11.248 -8.958 -2.433
505 HA GLN 66 HA GLN 66 -12.255 -11.186 -0.810
506 HB2 GLN 66 HB2 GLN 66 -10.388 -11.535 -2.377
507 HB3 GLN 66 HB3 GLN 66 -9.424 -10.308 -1.549
508 HG2 GLN 66 HG2 GLN 66 -9.293 -11.704 0.463
509 HG3 GLN 66 HG3 GLN 66 -10.354 -12.913 -0.268
510 HE21 GLN 66 HE21 GLN 66 -7.910 -13.766 0.733
511 HE22 GLN 66 HE22 GLN 66 -6.857 -14.153 -0.610
512 H TYR 67 H TYR 67 -11.062 -7.983 -0.188
513 HA TYR 67 HA TYR 67 -10.913 -8.574 2.734
514 HB2 TYR 67 HB2 TYR 67 -9.695 -6.338 1.101
515 HB3 TYR 67 HB3 TYR 67 -9.528 -6.559 2.843
516 HD1 TYR 67 HD2 TYR 67 -8.837 -9.210 3.432
517 HD2 TYR 67 HD1 TYR 67 -7.733 -6.929 -0.056
518 HE1 TYR 67 HE2 TYR 67 -6.786 -10.587 3.170
519 HE2 TYR 67 HE1 TYR 67 -5.634 -8.269 -0.282
520 HH TYR 67 HH TYR 67 -4.313 -9.838 0.727
521 H ASN 68 H ASN 68 -13.292 -8.645 2.549
522 HA ASN 68 HA ASN 68 -15.329 -7.894 3.004
523 HB2 ASN 68 HB2 ASN 68 -13.832 -7.067 4.996
524 HB3 ASN 68 HB3 ASN 68 -14.178 -5.463 4.374
525 HD21 ASN 68 HD21 ASN 68 -15.757 -8.506 5.368
526 HD22 ASN 68 HD22 ASN 68 -17.229 -7.733 5.978
527 H ARG 69 H ARG 69 -14.265 -6.832 0.368
528 HA ARG 69 HA ARG 69 -14.530 -5.151 -1.163
529 HB2 ARG 69 HB2 ARG 69 -17.305 -5.218 0.039
530 HB3 ARG 69 HB3 ARG 69 -16.907 -4.304 -1.415
531 HG2 ARG 69 HG2 ARG 69 -16.219 -6.252 -2.609
532 HG3 ARG 69 HG3 ARG 69 -16.390 -7.294 -1.186
533 HD2 ARG 69 HD2 ARG 69 -18.700 -5.735 -2.408
534 HD3 ARG 69 HD3 ARG 69 -18.268 -7.377 -2.902
535 HE ARG 69 HE ARG 69 -18.524 -7.955 -0.413
536 HH11 ARG 69 HH11 ARG 69 -20.586 -5.537 -2.044
537 HH12 ARG 69 HH12 ARG 69 -21.956 -5.867 -1.007
538 HH21 ARG 69 HH21 ARG 69 -20.320 -8.349 0.885
539 HH22 ARG 69 HH22 ARG 69 -21.805 -7.456 0.649
540 H LEU 70 H LEU 70 -13.579 -4.163 1.594
541 HA LEU 70 HA LEU 70 -14.846 -1.675 2.083
542 HB2 LEU 70 HB2 LEU 70 -13.642 -3.190 3.653
543 HB3 LEU 70 HB3 LEU 70 -12.109 -2.657 3.002
544 HG LEU 70 HG LEU 70 -12.938 -1.767 5.239
545 HD11 LEU 70 HD11 LEU 70 -12.117 0.392 3.275
546 HD12 LEU 70 HD12 LEU 70 -11.018 -0.764 4.047
547 HD13 LEU 70 HD13 LEU 70 -11.926 0.396 5.032
548 HD21 LEU 70 HD21 LEU 70 -15.244 -1.201 4.539
549 HD22 LEU 70 HD22 LEU 70 -14.598 0.147 3.575
550 HD23 LEU 70 HD23 LEU 70 -14.391 0.133 5.335
551 H ALA 71 H ALA 71 -12.128 -2.379 0.028
552 HA ALA 71 HA ALA 71 -10.820 -1.183 -1.370
553 HB1 ALA 71 HB1 ALA 71 -12.743 1.141 -1.175
554 HB2 ALA 71 HB2 ALA 71 -11.647 0.716 -2.499
555 HB3 ALA 71 HB3 ALA 71 -13.047 -0.302 -2.157
556 H MET 72 H MET 72 -9.955 1.514 -1.426
557 HA MET 72 HA MET 72 -9.806 2.696 1.118
558 HB2 MET 72 HB2 MET 72 -7.442 2.795 1.600
559 HB3 MET 72 HB3 MET 72 -7.964 1.121 1.587
560 HG2 MET 72 HG2 MET 72 -7.019 0.888 -0.732
561 HG3 MET 72 HG3 MET 72 -6.449 2.556 -0.602
562 HE1 MET 72 HE1 MET 72 -3.866 2.171 -0.974
563 HE2 MET 72 HE2 MET 72 -3.047 0.717 -0.392
564 HE3 MET 72 HE3 MET 72 -4.436 0.566 -1.487
565 HA PRO 73 HA PRO 73 -8.893 6.071 -1.798
566 HB2 PRO 73 HB2 PRO 73 -9.138 8.226 -0.165
567 HB3 PRO 73 HB3 PRO 73 -10.516 7.178 -0.587
568 HG2 PRO 73 HG2 PRO 73 -8.888 7.188 1.949
569 HG3 PRO 73 HG3 PRO 73 -10.652 7.028 1.755
570 HD2 PRO 73 HD2 PRO 73 -8.858 4.890 2.081
571 HD3 PRO 73 HD3 PRO 73 -10.495 4.768 1.376
572 H ASN 74 H ASN 74 -7.497 8.159 -1.816
573 HA ASN 74 HA ASN 74 -4.674 7.563 -1.194
574 HB2 ASN 74 HB2 ASN 74 -5.044 8.396 -3.370
575 HB3 ASN 74 HB3 ASN 74 -6.217 9.591 -2.841
576 HD21 ASN 74 HD21 ASN 74 -2.773 8.878 -3.149
577 HD22 ASN 74 HD22 ASN 74 -2.270 10.536 -2.927
578 H MET 75 H MET 75 -3.261 9.148 -0.136
579 HA MET 75 HA MET 75 -4.570 11.005 1.789
580 HB2 MET 75 HB2 MET 75 -2.416 9.010 2.594
581 HB3 MET 75 HB3 MET 75 -3.100 10.287 3.602
582 HG2 MET 75 HG2 MET 75 -4.385 8.611 4.349
583 HG3 MET 75 HG3 MET 75 -5.400 9.153 3.030
584 HE1 MET 75 HE1 MET 75 -6.771 7.249 2.292
585 HE2 MET 75 HE2 MET 75 -6.358 5.560 2.654
586 HE3 MET 75 HE3 MET 75 -6.414 6.773 3.964
587 H ARG 76 H ARG 76 -3.203 11.693 -0.691
588 HA ARG 76 HA ARG 76 -1.699 13.200 -1.507
589 HB2 ARG 76 HB2 ARG 76 -2.346 14.460 1.174
590 HB3 ARG 76 HB3 ARG 76 -1.564 15.303 -0.168
591 HG2 ARG 76 HG2 ARG 76 -3.507 15.009 -1.599
592 HG3 ARG 76 HG3 ARG 76 -4.304 13.987 -0.394
593 HD2 ARG 76 HD2 ARG 76 -5.252 16.226 -0.319
594 HD3 ARG 76 HD3 ARG 76 -4.416 15.855 1.187
595 HE ARG 76 HE ARG 76 -2.714 17.386 0.679
596 HH11 ARG 76 HH11 ARG 76 -5.158 17.394 -1.928
597 HH12 ARG 76 HH12 ARG 76 -4.592 18.916 -2.579
598 HH21 ARG 76 HH21 ARG 76 -2.028 19.337 -0.200
599 HH22 ARG 76 HH22 ARG 76 -2.824 20.014 -1.604
600 H LEU 77 H LEU 77 -0.036 11.474 -1.354
601 HA LEU 77 HA LEU 77 1.974 11.554 0.747
602 HB2 LEU 77 HB2 LEU 77 1.898 10.180 -1.973
603 HB3 LEU 77 HB3 LEU 77 3.209 10.021 -0.827
604 HG LEU 77 HG LEU 77 1.901 8.069 -0.722
605 HD11 LEU 77 HD11 LEU 77 1.406 7.916 1.633
606 HD12 LEU 77 HD12 LEU 77 1.229 9.677 1.768
607 HD13 LEU 77 HD13 LEU 77 2.820 8.962 1.422
608 HD21 LEU 77 HD21 LEU 77 -0.561 9.634 0.113
609 HD22 LEU 77 HD22 LEU 77 -0.407 7.891 -0.165
610 HD23 LEU 77 HD23 LEU 77 -0.277 9.009 -1.531
611 H GLY 78 H GLY 78 3.857 12.553 0.872
612 HA2 GLY 78 HA2 GLY 78 4.852 14.403 -1.164
613 HA3 GLY 78 HA3 GLY 78 5.663 13.919 0.328
614 H ASP 79 H ASP 79 6.890 14.164 -2.237
615 HA ASP 79 HA ASP 79 7.033 11.679 -3.678
616 HB2 ASP 79 HB2 ASP 79 9.027 13.967 -3.620
617 HB3 ASP 79 HB3 ASP 79 8.869 12.749 -4.893
618 H ALA 80 H ALA 80 8.995 12.968 -1.016
619 HA ALA 80 HA ALA 80 10.821 10.683 -0.967
620 HB1 ALA 80 HB1 ALA 80 10.347 12.885 1.078
621 HB2 ALA 80 HB2 ALA 80 11.755 11.816 0.969
622 HB3 ALA 80 HB3 ALA 80 11.458 13.005 -0.303
623 H GLU 81 H GLU 81 7.627 11.346 0.356
624 HA GLU 81 HA GLU 81 7.841 9.518 2.608
625 HB2 GLU 81 HB2 GLU 81 5.376 10.667 1.225
626 HB3 GLU 81 HB3 GLU 81 5.339 9.649 2.651
627 HG2 GLU 81 HG2 GLU 81 6.724 11.336 3.877
628 HG3 GLU 81 HG3 GLU 81 6.617 12.399 2.485
629 H VAL 82 H VAL 82 6.633 9.260 -0.744
630 HA VAL 82 HA VAL 82 5.928 6.454 -0.637
631 HB VAL 82 HB VAL 82 6.994 8.078 -3.001
632 HG11 VAL 82 HG11 VAL 82 5.816 6.388 -4.394
633 HG12 VAL 82 HG12 VAL 82 7.084 5.628 -3.435
634 HG13 VAL 82 HG13 VAL 82 5.385 5.470 -2.939
635 HG21 VAL 82 HG21 VAL 82 4.957 9.112 -2.125
636 HG22 VAL 82 HG22 VAL 82 4.614 8.296 -3.645
637 HG23 VAL 82 HG23 VAL 82 4.127 7.536 -2.113
638 H SER 83 H SER 83 9.063 8.065 -1.513
639 HA SER 83 HA SER 83 10.525 5.665 -1.879
640 HB2 SER 83 HB2 SER 83 11.541 7.680 -2.592
641 HB3 SER 83 HB3 SER 83 11.363 8.430 -0.996
642 HG SER 83 HG SER 83 13.197 6.398 -1.777
643 H ALA 84 H ALA 84 9.909 7.413 1.224
644 HA ALA 84 HA ALA 84 11.537 5.701 2.824
645 HB1 ALA 84 HB1 ALA 84 9.032 7.277 3.541
646 HB2 ALA 84 HB2 ALA 84 10.214 6.622 4.692
647 HB3 ALA 84 HB3 ALA 84 10.699 7.894 3.559
648 H LEU 85 H LEU 85 8.069 5.411 1.893
649 HA LEU 85 HA LEU 85 7.584 2.937 3.310
650 HB2 LEU 85 HB2 LEU 85 6.297 4.380 0.968
651 HB3 LEU 85 HB3 LEU 85 5.730 2.799 1.443
652 HG LEU 85 HG LEU 85 5.828 5.176 3.336
653 HD11 LEU 85 HD11 LEU 85 3.345 5.247 2.926
654 HD12 LEU 85 HD12 LEU 85 3.560 4.038 1.642
655 HD13 LEU 85 HD13 LEU 85 4.304 5.645 1.494
656 HD21 LEU 85 HD21 LEU 85 4.407 2.481 3.539
657 HD22 LEU 85 HD22 LEU 85 4.202 3.839 4.668
658 HD23 LEU 85 HD23 LEU 85 5.763 3.034 4.547
659 H ILE 86 H ILE 86 8.740 3.587 0.010
660 HA ILE 86 HA ILE 86 8.620 0.826 -0.909
661 HB ILE 86 HB ILE 86 9.509 3.468 -1.969
662 HG12 ILE 86 HG12 ILE 86 8.165 2.801 -3.865
663 HG13 ILE 86 HG13 ILE 86 8.077 1.134 -3.293
664 HG21 ILE 86 HG21 ILE 86 11.521 2.205 -2.548
665 HG22 ILE 86 HG22 ILE 86 10.522 0.890 -3.225
666 HG23 ILE 86 HG23 ILE 86 10.537 2.494 -3.976
667 HD11 ILE 86 HD11 ILE 86 6.612 1.828 -1.424
668 HD12 ILE 86 HD12 ILE 86 6.746 3.521 -1.956
669 HD13 ILE 86 HD13 ILE 86 5.958 2.324 -2.986
670 H SER 87 H SER 87 11.157 2.889 0.442
671 HA SER 87 HA SER 87 13.252 0.892 0.278
672 HB2 SER 87 HB2 SER 87 13.141 3.327 2.080
673 HB3 SER 87 HB3 SER 87 14.581 2.428 1.554
674 HG SER 87 HG SER 87 12.830 4.079 0.074
675 H TYR 88 H TYR 88 10.863 1.826 2.853
676 HA TYR 88 HA TYR 88 12.151 0.043 4.773
677 HB2 TYR 88 HB2 TYR 88 10.970 2.090 5.391
678 HB3 TYR 88 HB3 TYR 88 9.459 1.397 4.788
679 HD1 TYR 88 HD2 TYR 88 12.230 0.147 7.070
680 HD2 TYR 88 HD1 TYR 88 8.011 0.926 6.557
681 HE1 TYR 88 HE2 TYR 88 11.798 -0.629 9.387
682 HE2 TYR 88 HE1 TYR 88 7.603 0.207 8.904
683 HH TYR 88 HH TYR 88 8.540 -0.320 10.860
684 H LEU 89 H LEU 89 9.181 -0.309 2.724
685 HA LEU 89 HA LEU 89 8.411 -2.760 4.021
686 HB2 LEU 89 HB2 LEU 89 7.561 -1.296 1.528
687 HB3 LEU 89 HB3 LEU 89 7.063 -2.961 1.742
688 HG LEU 89 HG LEU 89 5.833 -2.541 3.702
689 HD11 LEU 89 HD11 LEU 89 7.231 -0.945 4.933
690 HD12 LEU 89 HD12 LEU 89 5.574 -0.358 4.796
691 HD13 LEU 89 HD13 LEU 89 6.839 0.329 3.757
692 HD21 LEU 89 HD21 LEU 89 5.354 -0.213 1.795
693 HD22 LEU 89 HD22 LEU 89 4.167 -0.927 2.919
694 HD23 LEU 89 HD23 LEU 89 4.784 -1.879 1.556
695 H GLU 90 H GLU 90 10.632 -2.218 1.288
696 HA GLU 90 HA GLU 90 11.001 -5.026 0.690
697 HB2 GLU 90 HB2 GLU 90 11.804 -3.228 -0.779
698 HB3 GLU 90 HB3 GLU 90 12.968 -2.700 0.455
699 HG2 GLU 90 HG2 GLU 90 14.114 -4.869 0.333
700 HG3 GLU 90 HG3 GLU 90 12.851 -5.488 -0.735
701 H GLU 91 H GLU 91 12.378 -2.875 3.173
702 HA GLU 91 HA GLU 91 14.353 -4.750 4.096
703 HB2 GLU 91 HB2 GLU 91 13.798 -1.997 4.358
704 HB3 GLU 91 HB3 GLU 91 13.510 -2.600 5.969
705 HG2 GLU 91 HG2 GLU 91 16.002 -3.726 4.882
706 HG3 GLU 91 HG3 GLU 91 15.969 -1.986 4.664
707 H GLU 92 H GLU 92 11.137 -3.802 5.332
708 HA GLU 92 HA GLU 92 11.054 -5.677 7.535
709 HB2 GLU 92 HB2 GLU 92 8.903 -4.335 5.852
710 HB3 GLU 92 HB3 GLU 92 8.541 -5.321 7.259
711 HG2 GLU 92 HG2 GLU 92 10.398 -2.919 7.464
712 HG3 GLU 92 HG3 GLU 92 8.657 -2.738 7.516
713 H THR 93 H THR 93 10.261 -5.987 4.053
714 HA THR 93 HA THR 93 9.249 -8.697 4.215
715 HB THR 93 HB THR 93 10.555 -7.250 1.880
716 HG1 THR 93 HG1 THR 93 8.745 -6.230 2.400
717 HG21 THR 93 HG21 THR 93 10.593 -9.640 1.440
718 HG22 THR 93 HG22 THR 93 9.315 -8.891 0.484
719 HG23 THR 93 HG23 THR 93 8.897 -9.800 1.952
720 H ALA 94 H ALA 94 12.560 -7.387 3.849
721 HA ALA 94 HA ALA 94 13.853 -9.955 3.777
722 HB1 ALA 94 HB1 ALA 94 15.897 -8.691 4.093
723 HB2 ALA 94 HB2 ALA 94 14.853 -7.909 2.903
724 HB3 ALA 94 HB3 ALA 94 14.974 -7.241 4.541
725 H ARG 95 H ARG 95 12.121 -8.724 6.325
726 HA ARG 95 HA ARG 95 13.514 -10.529 8.225
727 HB2 ARG 95 HB2 ARG 95 12.569 -7.717 8.768
728 HB3 ARG 95 HB3 ARG 95 12.750 -8.905 10.072
729 HG2 ARG 95 HG2 ARG 95 15.089 -9.336 9.425
730 HG3 ARG 95 HG3 ARG 95 14.982 -8.110 8.155
731 HD2 ARG 95 HD2 ARG 95 14.566 -7.535 11.117
732 HD3 ARG 95 HD3 ARG 95 16.106 -7.370 10.273
733 HE ARG 95 HE ARG 95 15.307 -5.557 9.020
734 HH11 ARG 95 HH11 ARG 95 12.809 -6.689 11.306
735 HH12 ARG 95 HH12 ARG 95 11.811 -5.273 11.063
736 HH21 ARG 95 HH21 ARG 95 13.984 -3.776 8.722
737 HH22 ARG 95 HH22 ARG 95 12.484 -3.621 9.602
738 H LEU 96 H LEU 96 11.398 -11.098 6.412
739 HA LEU 96 HA LEU 96 8.833 -11.307 7.427
740 HB2 LEU 96 HB2 LEU 96 10.224 -12.314 5.259
741 HB3 LEU 96 HB3 LEU 96 9.897 -13.773 6.101
742 HG LEU 96 HG LEU 96 8.278 -13.599 4.474
743 HD11 LEU 96 HD11 LEU 96 7.333 -14.102 6.672
744 HD12 LEU 96 HD12 LEU 96 6.159 -13.296 5.594
745 HD13 LEU 96 HD13 LEU 96 6.953 -12.379 6.900
746 HD21 LEU 96 HD21 LEU 96 8.725 -11.364 3.792
747 HD22 LEU 96 HD22 LEU 96 7.992 -10.696 5.258
748 HD23 LEU 96 HD23 LEU 96 6.971 -11.536 4.052
749 H GLN 97 H GLN 97 11.617 -13.112 8.554
750 HA GLN 97 HA GLN 97 10.202 -15.119 10.096
751 HB2 GLN 97 HB2 GLN 97 13.033 -14.047 9.974
752 HB3 GLN 97 HB3 GLN 97 12.570 -15.267 11.150
753 HG2 GLN 97 HG2 GLN 97 11.963 -16.855 9.430
754 HG3 GLN 97 HG3 GLN 97 12.173 -15.647 8.158
755 HE21 GLN 97 HE21 GLN 97 14.457 -14.607 8.127
756 HE22 GLN 97 HE22 GLN 97 15.829 -15.636 8.538
757 H THR 98 H THR 98 10.885 -11.734 10.804
758 HA THR 98 HA THR 98 10.128 -12.171 13.664
759 HB THR 98 HB THR 98 11.782 -10.363 14.274
760 HG1 THR 98 HG1 THR 98 12.377 -9.581 12.288
761 HG21 THR 98 HG21 THR 98 12.871 -12.996 13.230
762 HG22 THR 98 HG22 THR 98 12.161 -12.707 14.828
763 HG23 THR 98 HG23 THR 98 13.678 -11.912 14.382
764 HA PRO 99 HA PRO 99 7.482 -8.643 12.210
765 HB2 PRO 99 HB2 PRO 99 5.035 -9.804 12.199
766 HB3 PRO 99 HB3 PRO 99 6.136 -9.924 10.796
767 HG2 PRO 99 HG2 PRO 99 5.713 -11.978 12.992
768 HG3 PRO 99 HG3 PRO 99 5.716 -12.234 11.221
769 HD2 PRO 99 HD2 PRO 99 7.927 -12.666 12.792
770 HD3 PRO 99 HD3 PRO 99 8.042 -12.089 11.103
771 H VAL 100 H VAL 100 8.307 -7.992 14.238
772 HA VAL 100 HA VAL 100 6.982 -9.019 16.711
773 HB VAL 100 HB VAL 100 9.357 -9.569 16.398
774 HG11 VAL 100 HG11 VAL 100 9.891 -6.606 16.779
775 HG12 VAL 100 HG12 VAL 100 11.099 -7.906 16.707
776 HG13 VAL 100 HG13 VAL 100 10.143 -7.505 15.269
777 HG21 VAL 100 HG21 VAL 100 10.072 -8.991 18.649
778 HG22 VAL 100 HG22 VAL 100 8.811 -7.746 18.767
779 HG23 VAL 100 HG23 VAL 100 8.375 -9.469 18.640
780 H THR 101 H THR 101 6.115 -7.670 18.224
781 HA THR 101 HA THR 101 5.210 -5.118 17.173
782 HB THR 101 HB THR 101 3.837 -5.075 19.269
783 HG1 THR 101 HG1 THR 101 4.060 -7.428 20.203
784 HG21 THR 101 HG21 THR 101 2.954 -6.243 17.281
785 HG22 THR 101 HG22 THR 101 2.467 -7.065 18.767
786 HG23 THR 101 HG23 THR 101 3.770 -7.742 17.777
787 H ASN 102 H ASN 102 6.849 -5.984 20.201
788 HA ASN 102 HA ASN 102 8.367 -5.045 21.514
789 HB2 ASN 102 HB2 ASN 102 9.505 -5.455 19.301
790 HB3 ASN 102 HB3 ASN 102 9.363 -3.731 18.971
791 HD21 ASN 102 HD21 ASN 102 10.961 -2.391 19.816
792 HD22 ASN 102 HD22 ASN 102 12.199 -2.942 20.919
793 H ARG 103 H ARG 103 6.279 -2.691 20.163
794 HA ARG 103 HA ARG 103 7.502 -0.346 21.154
795 HB2 ARG 103 HB2 ARG 103 5.301 0.741 20.722
796 HB3 ARG 103 HB3 ARG 103 6.047 -0.117 19.394
797 HG2 ARG 103 HG2 ARG 103 3.680 -0.404 19.338
798 HG3 ARG 103 HG3 ARG 103 4.443 -1.962 19.584
799 HD2 ARG 103 HD2 ARG 103 3.503 -0.457 22.024
800 HD3 ARG 103 HD3 ARG 103 2.271 -1.098 20.945
801 HE ARG 103 HE ARG 103 4.153 -2.639 22.599
802 HH11 ARG 103 HH11 ARG 103 1.628 -2.793 20.077
803 HH12 ARG 103 HH12 ARG 103 1.326 -4.495 20.347
804 HH21 ARG 103 HH21 ARG 103 3.723 -4.826 22.912
805 HH22 ARG 103 HH22 ARG 103 2.510 -5.643 21.951
806 H GLY 104 H GLY 104 6.747 1.212 22.661
807 HA2 GLY 104 HA2 GLY 104 5.287 0.272 25.052
808 HA3 GLY 104 HA3 GLY 104 6.996 0.670 25.269
809 H ILE 105 H ILE 105 5.776 2.094 26.837
810 HA ILE 105 HA ILE 105 4.375 4.421 25.893
811 HB ILE 105 HB ILE 105 5.771 3.956 28.552
812 HG12 ILE 105 HG12 ILE 105 4.143 2.189 28.254
813 HG13 ILE 105 HG13 ILE 105 3.600 3.312 29.476
814 HG21 ILE 105 HG21 ILE 105 4.186 5.631 29.462
815 HG22 ILE 105 HG22 ILE 105 5.278 6.323 28.266
816 HG23 ILE 105 HG23 ILE 105 3.600 5.967 27.819
817 HD11 ILE 105 HD11 ILE 105 1.751 2.564 28.046
818 HD12 ILE 105 HD12 ILE 105 1.982 4.310 27.879
819 HD13 ILE 105 HD13 ILE 105 2.561 3.205 26.608
820 HA PRO 106 HA PRO 106 8.051 6.964 24.979
821 HB2 PRO 106 HB2 PRO 106 6.837 9.411 24.715
822 HB3 PRO 106 HB3 PRO 106 6.823 8.128 23.464
823 HG2 PRO 106 HG2 PRO 106 4.681 8.766 25.493
824 HG3 PRO 106 HG3 PRO 106 4.486 8.464 23.739
825 HD2 PRO 106 HD2 PRO 106 4.045 6.551 25.622
826 HD3 PRO 106 HD3 PRO 106 4.760 6.140 24.037
827 HHA HEC 107 HHA HEC 107 -4.297 -3.991 0.927
828 HHB HEC 107 HHB HEC 107 0.259 0.546 1.210
829 HHC HEC 107 HHC HEC 107 -3.793 4.458 4.383
830 HHD HEC 107 HHD HEC 107 -8.140 -0.326 4.580
831 HMA1 HEC 107 HMA1 HEC 107 0.675 -2.871 -0.512
832 HMA2 HEC 107 HMA2 HEC 107 0.749 -1.112 -0.621
833 HMA3 HEC 107 HMA3 HEC 107 1.215 -1.930 0.889
834 HAA1 HEC 107 HAA1 HEC 107 -0.630 -4.564 0.404
835 HAA2 HEC 107 HAA2 HEC 107 -2.307 -4.902 0.633
836 HBA1 HEC 107 HBA1 HEC 107 -2.808 -4.347 -1.717
837 HBA2 HEC 107 HBA2 HEC 107 -1.076 -4.030 -1.989
838 HMB1 HEC 107 HMB1 HEC 107 1.429 2.273 2.198
839 HMB2 HEC 107 HMB2 HEC 107 0.800 3.372 0.936
840 HMB3 HEC 107 HMB3 HEC 107 1.192 3.971 2.539
841 HAB HEC 107 HAB HEC 107 -2.101 5.547 3.917
842 HBB1 HEC 107 HBB1 HEC 107 -1.783 5.937 1.521
843 HBB2 HEC 107 HBB2 HEC 107 -0.882 7.060 2.557
844 HBB3 HEC 107 HBB3 HEC 107 -0.033 5.745 1.727
845 HMC1 HEC 107 HMC1 HEC 107 -5.642 4.277 6.893
846 HMC2 HEC 107 HMC2 HEC 107 -5.599 5.237 5.407
847 HMC3 HEC 107 HMC3 HEC 107 -7.142 4.742 6.087
848 HAC HEC 107 HAC HEC 107 -8.563 1.019 6.096
849 HBC1 HEC 107 HBC1 HEC 107 -9.597 2.478 4.436
850 HBC2 HEC 107 HBC2 HEC 107 -10.293 2.699 6.054
851 HBC3 HEC 107 HBC3 HEC 107 -9.162 3.898 5.410
852 HMD1 HEC 107 HMD1 HEC 107 -8.700 -4.024 3.897
853 HMD2 HEC 107 HMD2 HEC 107 -8.608 -2.617 4.929
854 HMD3 HEC 107 HMD3 HEC 107 -9.444 -2.506 3.360
855 HAD1 HEC 107 HAD1 HEC 107 -7.752 -4.976 2.095
856 HAD2 HEC 107 HAD2 HEC 107 -6.343 -4.964 1.069
857 HBD1 HEC 107 HBD1 HEC 107 -6.307 -5.553 4.067
858 HBD2 HEC 107 HBD2 HEC 107 -6.283 -6.759 2.799
Start of MODEL 6
1 H SER 1 H SER 1 13.715 7.256 8.243
2 HA SER 1 HA SER 1 12.294 7.724 5.720
3 HB2 SER 1 HB2 SER 1 14.502 5.765 6.396
4 HB3 SER 1 HB3 SER 1 13.835 6.060 4.782
5 HG SER 1 HG SER 1 15.756 7.199 5.228
6 H GLY 2 H GLY 2 10.257 7.151 6.805
7 HA2 GLY 2 HA2 GLY 2 8.540 5.809 5.798
8 HA3 GLY 2 HA3 GLY 2 9.571 4.425 5.859
9 H GLU 3 H GLU 3 10.276 4.279 8.679
10 HA GLU 3 HA GLU 3 7.845 3.125 9.651
11 HB2 GLU 3 HB2 GLU 3 10.089 2.367 10.353
12 HB3 GLU 3 HB3 GLU 3 10.309 3.865 11.270
13 HG2 GLU 3 HG2 GLU 3 8.331 3.320 12.651
14 HG3 GLU 3 HG3 GLU 3 8.079 1.834 11.740
15 H GLN 4 H GLN 4 9.477 6.163 10.732
16 HA GLN 4 HA GLN 4 7.348 6.849 12.566
17 HB2 GLN 4 HB2 GLN 4 9.487 8.598 11.308
18 HB3 GLN 4 HB3 GLN 4 8.429 9.066 12.640
19 HG2 GLN 4 HG2 GLN 4 9.357 7.220 14.035
20 HG3 GLN 4 HG3 GLN 4 10.444 6.769 12.729
21 HE21 GLN 4 HE21 GLN 4 12.088 7.178 14.563
22 HE22 GLN 4 HE22 GLN 4 12.633 8.843 14.737
23 H ILE 5 H ILE 5 7.579 7.179 9.144
24 HA ILE 5 HA ILE 5 5.438 9.184 8.850
25 HB ILE 5 HB ILE 5 6.738 7.262 6.843
26 HG12 ILE 5 HG12 ILE 5 7.191 10.258 7.205
27 HG13 ILE 5 HG13 ILE 5 8.286 9.007 7.787
28 HG21 ILE 5 HG21 ILE 5 4.932 9.661 6.284
29 HG22 ILE 5 HG22 ILE 5 5.654 8.568 5.089
30 HG23 ILE 5 HG23 ILE 5 4.416 7.964 6.166
31 HD11 ILE 5 HD11 ILE 5 8.607 8.189 5.456
32 HD12 ILE 5 HD12 ILE 5 7.635 9.557 4.867
33 HD13 ILE 5 HD13 ILE 5 9.151 9.855 5.725
34 H PHE 6 H PHE 6 5.772 5.608 8.486
35 HA PHE 6 HA PHE 6 3.106 4.986 7.878
36 HB2 PHE 6 HB2 PHE 6 4.982 3.411 7.761
37 HB3 PHE 6 HB3 PHE 6 5.173 3.447 9.504
38 HD1 PHE 6 HD2 PHE 6 3.534 2.360 11.009
39 HD2 PHE 6 HD1 PHE 6 3.204 2.110 6.716
40 HE1 PHE 6 HE2 PHE 6 1.883 0.528 11.246
41 HE2 PHE 6 HE1 PHE 6 1.545 0.271 6.962
42 HZ PHE 6 HZ PHE 6 0.898 -0.515 9.224
43 H ARG 7 H ARG 7 4.582 5.525 11.083
44 HA ARG 7 HA ARG 7 2.530 4.858 12.804
45 HB2 ARG 7 HB2 ARG 7 4.910 5.669 13.258
46 HB3 ARG 7 HB3 ARG 7 4.303 7.312 13.083
47 HG2 ARG 7 HG2 ARG 7 4.474 6.730 15.414
48 HG3 ARG 7 HG3 ARG 7 2.765 6.931 15.019
49 HD2 ARG 7 HD2 ARG 7 2.405 4.538 15.002
50 HD3 ARG 7 HD3 ARG 7 4.141 4.209 15.043
51 HE ARG 7 HE ARG 7 2.397 4.974 17.279
52 HH11 ARG 7 HH11 ARG 7 5.779 4.547 16.213
53 HH12 ARG 7 HH12 ARG 7 6.383 4.415 17.849
54 HH21 ARG 7 HH21 ARG 7 3.229 4.794 19.374
55 HH22 ARG 7 HH22 ARG 7 4.942 4.555 19.635
56 H THR 8 H THR 8 2.748 7.761 10.831
57 HA THR 8 HA THR 8 0.282 8.899 12.077
58 HB THR 8 HB THR 8 2.363 10.144 12.343
59 HG1 THR 8 HG1 THR 8 1.478 12.062 11.856
60 HG21 THR 8 HG21 THR 8 3.585 9.762 10.333
61 HG22 THR 8 HG22 THR 8 3.282 11.488 10.517
62 HG23 THR 8 HG23 THR 8 2.323 10.559 9.351
63 H ARG 9 H ARG 9 1.649 8.004 8.919
64 HA ARG 9 HA ARG 9 -0.722 8.997 7.479
65 HB2 ARG 9 HB2 ARG 9 1.743 7.477 6.543
66 HB3 ARG 9 HB3 ARG 9 0.474 8.097 5.494
67 HG2 ARG 9 HG2 ARG 9 2.386 9.791 7.132
68 HG3 ARG 9 HG3 ARG 9 2.397 9.508 5.399
69 HD2 ARG 9 HD2 ARG 9 1.259 11.452 5.270
70 HD3 ARG 9 HD3 ARG 9 -0.135 10.447 5.624
71 HE ARG 9 HE ARG 9 -0.232 11.315 7.801
72 HH11 ARG 9 HH11 ARG 9 2.692 12.546 6.160
73 HH12 ARG 9 HH12 ARG 9 2.965 13.792 7.356
74 HH21 ARG 9 HH21 ARG 9 0.158 12.946 9.317
75 HH22 ARG 9 HH22 ARG 9 1.528 14.020 9.142
76 H CYS 10 H CYS 10 0.270 5.881 8.788
77 HA CYS 10 HA CYS 10 -1.783 4.481 7.094
78 HB2 CYS 10 HB2 CYS 10 0.921 3.415 7.884
79 HB3 CYS 10 HB3 CYS 10 -0.211 2.696 6.746
80 H SER 11 H SER 11 -0.153 4.515 10.236
81 HA SER 11 HA SER 11 -0.755 1.923 11.112
82 HB2 SER 11 HB2 SER 11 0.880 3.615 12.047
83 HB3 SER 11 HB3 SER 11 -0.494 4.384 12.872
84 HG SER 11 HG SER 11 0.124 2.994 14.348
85 H SER 12 H SER 12 -2.973 4.639 10.964
86 HA SER 12 HA SER 12 -4.904 3.758 12.871
87 HB2 SER 12 HB2 SER 12 -6.476 5.151 11.595
88 HB3 SER 12 HB3 SER 12 -4.957 5.991 11.925
89 HG SER 12 HG SER 12 -6.023 5.935 9.676
90 H CYS 13 H CYS 13 -4.064 2.326 9.807
91 HA CYS 13 HA CYS 13 -6.392 0.458 10.050
92 HB2 CYS 13 HB2 CYS 13 -5.355 1.646 7.484
93 HB3 CYS 13 HB3 CYS 13 -6.732 0.563 7.656
94 H HIS 14 H HIS 14 -3.147 0.356 10.281
95 HA HIS 14 HA HIS 14 -2.887 -2.255 8.939
96 HB2 HIS 14 2HB HIS 14 -1.376 0.251 8.113
97 HB3 HIS 14 3HB HIS 14 -0.728 -1.347 7.780
98 HD1 HIS 14 1HD HIS 14 -3.216 -2.900 6.784
99 HD2 HIS 14 2HD HIS 14 -2.100 1.013 5.882
100 HE1 HIS 14 1HE HIS 14 -4.292 -2.406 4.520
101 H THR 15 H THR 15 -0.790 -3.081 8.967
102 HA THR 15 HA THR 15 1.119 -2.425 11.111
103 HB THR 15 HB THR 15 1.283 -4.826 11.811
104 HG1 THR 15 HG1 THR 15 0.243 -5.939 10.298
105 HG21 THR 15 HG21 THR 15 -0.655 -4.877 13.304
106 HG22 THR 15 HG22 THR 15 -1.447 -3.600 12.378
107 HG23 THR 15 HG23 THR 15 0.056 -3.247 13.270
108 H VAL 16 H VAL 16 3.207 -3.434 10.748
109 HA VAL 16 HA VAL 16 3.607 -4.740 8.084
110 HB VAL 16 HB VAL 16 5.653 -2.837 9.278
111 HG11 VAL 16 HG11 VAL 16 6.612 -2.959 7.005
112 HG12 VAL 16 HG12 VAL 16 6.505 -4.578 7.689
113 HG13 VAL 16 HG13 VAL 16 5.309 -4.054 6.484
114 HG21 VAL 16 HG21 VAL 16 4.987 -1.286 7.419
115 HG22 VAL 16 HG22 VAL 16 3.545 -2.290 7.150
116 HG23 VAL 16 HG23 VAL 16 3.781 -1.437 8.695
117 H GLY 17 H GLY 17 3.067 -6.491 9.558
118 HA2 GLY 17 HA2 GLY 17 4.443 -8.542 9.849
119 HA3 GLY 17 HA3 GLY 17 5.539 -7.620 10.873
120 H ASN 18 H ASN 18 2.190 -6.926 11.454
121 HA ASN 18 HA ASN 18 2.214 -8.718 13.853
122 HB2 ASN 18 HB2 ASN 18 1.529 -5.758 13.853
123 HB3 ASN 18 HB3 ASN 18 1.245 -6.870 15.184
124 HD21 ASN 18 HD21 ASN 18 2.496 -4.816 15.952
125 HD22 ASN 18 HD22 ASN 18 4.251 -5.118 16.083
126 H THR 19 H THR 19 0.910 -9.661 11.754
127 HA THR 19 HA THR 19 -1.686 -8.640 11.293
128 HB THR 19 HB THR 19 -0.283 -10.196 9.850
129 HG1 THR 19 HG1 THR 19 -2.094 -10.797 8.813
130 HG21 THR 19 HG21 THR 19 -0.239 -11.994 11.666
131 HG22 THR 19 HG22 THR 19 -0.652 -12.516 10.012
132 HG23 THR 19 HG23 THR 19 -1.929 -12.315 11.239
133 H GLU 20 H GLU 20 -3.690 -9.959 11.403
134 HA GLU 20 HA GLU 20 -5.530 -10.142 12.740
135 HB2 GLU 20 HB2 GLU 20 -3.877 -12.429 13.819
136 HB3 GLU 20 HB3 GLU 20 -5.595 -12.169 14.145
137 HG2 GLU 20 HG2 GLU 20 -5.925 -12.066 11.590
138 HG3 GLU 20 HG3 GLU 20 -4.291 -12.716 11.452
139 HA PRO 21 HA PRO 21 -4.388 -7.666 16.469
140 HB2 PRO 21 HB2 PRO 21 -5.538 -5.327 15.741
141 HB3 PRO 21 HB3 PRO 21 -3.937 -5.814 15.134
142 HG2 PRO 21 HG2 PRO 21 -6.618 -6.151 13.741
143 HG3 PRO 21 HG3 PRO 21 -5.128 -5.386 13.098
144 HD2 PRO 21 HD2 PRO 21 -5.756 -7.996 12.618
145 HD3 PRO 21 HD3 PRO 21 -4.064 -7.458 12.829
146 H GLY 22 H GLY 22 -6.585 -6.035 17.313
147 HA2 GLY 22 HA2 GLY 22 -8.869 -7.834 17.777
148 HA3 GLY 22 HA3 GLY 22 -8.719 -6.134 18.228
149 H GLN 23 H GLN 23 -10.992 -5.970 17.356
150 HA GLN 23 HA GLN 23 -11.315 -6.110 14.439
151 HB2 GLN 23 HB2 GLN 23 -13.118 -5.254 16.691
152 HB3 GLN 23 HB3 GLN 23 -13.475 -4.763 15.027
153 HG2 GLN 23 HG2 GLN 23 -13.398 -7.100 14.265
154 HG3 GLN 23 HG3 GLN 23 -13.002 -7.641 15.893
155 HE21 GLN 23 HE21 GLN 23 -14.699 -7.493 17.572
156 HE22 GLN 23 HE22 GLN 23 -16.377 -7.515 17.012
157 HA PRO 24 HA PRO 24 -10.467 -1.419 14.518
158 HB2 PRO 24 HB2 PRO 24 -8.916 -1.066 17.067
159 HB3 PRO 24 HB3 PRO 24 -10.081 0.059 16.305
160 HG2 PRO 24 HG2 PRO 24 -10.763 -1.375 18.518
161 HG3 PRO 24 HG3 PRO 24 -11.937 -1.154 17.179
162 HD2 PRO 24 HD2 PRO 24 -10.131 -3.533 17.723
163 HD3 PRO 24 HD3 PRO 24 -11.881 -3.507 17.348
164 H GLY 25 H GLY 25 -8.389 -0.222 14.049
165 HA2 GLY 25 HA2 GLY 25 -6.329 -0.375 12.963
166 HA3 GLY 25 HA3 GLY 25 -6.092 -2.014 13.576
167 H ILE 26 H ILE 26 -9.161 -1.939 12.293
168 HA ILE 26 HA ILE 26 -10.266 -2.495 10.447
169 HB ILE 26 HB ILE 26 -7.994 -1.207 8.929
170 HG12 ILE 26 HG12 ILE 26 -8.652 0.390 10.610
171 HG13 ILE 26 HG13 ILE 26 -9.303 0.894 9.071
172 HG21 ILE 26 HG21 ILE 26 -10.927 -1.562 8.184
173 HG22 ILE 26 HG22 ILE 26 -9.758 -0.553 7.317
174 HG23 ILE 26 HG23 ILE 26 -9.524 -2.301 7.392
175 HD11 ILE 26 HD11 ILE 26 -11.558 0.063 9.731
176 HD12 ILE 26 HD12 ILE 26 -10.892 -0.427 11.311
177 HD13 ILE 26 HD13 ILE 26 -10.914 1.280 10.846
178 H GLY 27 H GLY 27 -7.045 -3.781 10.441
179 HA2 GLY 27 HA2 GLY 27 -7.256 -6.262 10.634
180 HA3 GLY 27 HA3 GLY 27 -8.130 -6.259 9.120
181 HA PRO 28 HA PRO 28 -4.769 -7.111 6.811
182 HB2 PRO 28 HB2 PRO 28 -4.293 -4.641 5.214
183 HB3 PRO 28 HB3 PRO 28 -4.845 -6.252 4.681
184 HG2 PRO 28 HG2 PRO 28 -6.582 -4.168 4.849
185 HG3 PRO 28 HG3 PRO 28 -7.075 -5.812 5.366
186 HD2 PRO 28 HD2 PRO 28 -6.074 -3.533 7.111
187 HD3 PRO 28 HD3 PRO 28 -7.533 -4.542 7.302
188 H ASP 29 H ASP 29 -2.687 -7.609 6.829
189 HA ASP 29 HA ASP 29 -0.670 -5.727 7.973
190 HB2 ASP 29 HB2 ASP 29 -1.161 -7.705 9.323
191 HB3 ASP 29 HB3 ASP 29 -0.791 -8.758 7.952
192 H LEU 30 H LEU 30 1.285 -5.460 7.003
193 HA LEU 30 HA LEU 30 1.251 -6.041 4.090
194 HB2 LEU 30 HB2 LEU 30 2.699 -3.845 5.587
195 HB3 LEU 30 HB3 LEU 30 2.388 -3.934 3.856
196 HG LEU 30 HG LEU 30 0.306 -3.548 6.048
197 HD11 LEU 30 HD11 LEU 30 0.079 -1.294 5.134
198 HD12 LEU 30 HD12 LEU 30 1.298 -1.646 3.880
199 HD13 LEU 30 HD13 LEU 30 1.762 -1.593 5.593
200 HD21 LEU 30 HD21 LEU 30 -0.025 -3.595 3.006
201 HD22 LEU 30 HD22 LEU 30 -1.272 -3.077 4.165
202 HD23 LEU 30 HD23 LEU 30 -0.720 -4.752 4.157
203 H LEU 31 H LEU 31 3.062 -7.347 6.603
204 HA LEU 31 HA LEU 31 5.733 -7.055 5.510
205 HB2 LEU 31 HB2 LEU 31 5.298 -7.504 7.794
206 HB3 LEU 31 HB3 LEU 31 4.709 -9.133 7.418
207 HG LEU 31 HG LEU 31 7.439 -8.248 6.443
208 HD11 LEU 31 HD11 LEU 31 6.872 -9.168 9.274
209 HD12 LEU 31 HD12 LEU 31 7.404 -7.539 8.761
210 HD13 LEU 31 HD13 LEU 31 8.469 -8.939 8.528
211 HD21 LEU 31 HD21 LEU 31 8.023 -10.622 6.919
212 HD22 LEU 31 HD22 LEU 31 6.694 -10.491 5.776
213 HD23 LEU 31 HD23 LEU 31 6.353 -10.903 7.461
214 H GLY 32 H GLY 32 6.837 -8.174 4.136
215 HA2 GLY 32 HA2 GLY 32 7.411 -9.801 2.547
216 HA3 GLY 32 HA3 GLY 32 6.035 -10.757 3.062
217 H VAL 33 H VAL 33 4.377 -8.059 2.329
218 HA VAL 33 HA VAL 33 3.348 -9.185 -0.004
219 HB VAL 33 HB VAL 33 2.261 -7.518 1.553
220 HG11 VAL 33 HG11 VAL 33 3.343 -5.413 -0.365
221 HG12 VAL 33 HG12 VAL 33 2.269 -5.185 1.027
222 HG13 VAL 33 HG13 VAL 33 3.950 -5.661 1.289
223 HG21 VAL 33 HG21 VAL 33 1.142 -8.416 -0.417
224 HG22 VAL 33 HG22 VAL 33 0.720 -6.716 -0.183
225 HG23 VAL 33 HG23 VAL 33 1.882 -7.174 -1.445
226 H THR 34 H THR 34 5.862 -6.723 0.197
227 HA THR 34 HA THR 34 6.075 -6.104 -2.595
228 HB THR 34 HB THR 34 6.928 -4.756 -0.622
229 HG1 THR 34 HG1 THR 34 8.607 -3.949 -1.778
230 HG21 THR 34 HG21 THR 34 9.375 -6.557 -0.798
231 HG22 THR 34 HG22 THR 34 8.208 -6.555 0.549
232 HG23 THR 34 HG23 THR 34 9.152 -5.103 0.191
233 H ARG 35 H ARG 35 7.101 -8.882 -0.872
234 HA ARG 35 HA ARG 35 8.967 -9.831 -2.989
235 HB2 ARG 35 HB2 ARG 35 9.868 -9.981 -0.787
236 HB3 ARG 35 HB3 ARG 35 8.388 -10.665 -0.135
237 HG2 ARG 35 HG2 ARG 35 10.072 -12.365 -0.244
238 HG3 ARG 35 HG3 ARG 35 8.758 -12.768 -1.341
239 HD2 ARG 35 HD2 ARG 35 10.152 -11.928 -3.258
240 HD3 ARG 35 HD3 ARG 35 11.465 -11.592 -2.114
241 HE ARG 35 HE ARG 35 10.610 -14.284 -1.787
242 HH11 ARG 35 HH11 ARG 35 12.374 -12.308 -4.175
243 HH12 ARG 35 HH12 ARG 35 13.272 -13.677 -4.794
244 HH21 ARG 35 HH21 ARG 35 11.792 -16.023 -2.617
245 HH22 ARG 35 HH22 ARG 35 12.943 -15.780 -3.912
246 H GLN 36 H GLN 36 5.909 -10.590 -1.375
247 HA GLN 36 HA GLN 36 5.427 -13.102 -2.706
248 HB2 GLN 36 HB2 GLN 36 3.712 -11.201 -1.076
249 HB3 GLN 36 HB3 GLN 36 3.140 -12.775 -1.622
250 HG2 GLN 36 HG2 GLN 36 4.693 -13.970 -0.268
251 HG3 GLN 36 HG3 GLN 36 5.664 -12.543 0.061
252 HE21 GLN 36 HE21 GLN 36 5.068 -13.846 2.308
253 HE22 GLN 36 HE22 GLN 36 3.796 -12.996 3.165
254 H ARG 37 H ARG 37 4.301 -9.762 -3.407
255 HA ARG 37 HA ARG 37 3.141 -10.739 -5.950
256 HB2 ARG 37 HB2 ARG 37 1.578 -9.343 -3.786
257 HB3 ARG 37 HB3 ARG 37 1.170 -9.087 -5.489
258 HG2 ARG 37 HG2 ARG 37 1.199 -11.625 -5.786
259 HG3 ARG 37 HG3 ARG 37 1.225 -11.758 -4.025
260 HD2 ARG 37 HD2 ARG 37 -0.927 -10.245 -5.572
261 HD3 ARG 37 HD3 ARG 37 -1.012 -11.973 -5.242
262 HE ARG 37 HE ARG 37 -1.414 -11.615 -3.007
263 HH11 ARG 37 HH11 ARG 37 -0.709 -8.473 -4.541
264 HH12 ARG 37 HH12 ARG 37 -1.380 -7.561 -3.208
265 HH21 ARG 37 HH21 ARG 37 -2.276 -10.412 -1.324
266 HH22 ARG 37 HH22 ARG 37 -2.276 -8.664 -1.386
267 H ASP 38 H ASP 38 2.347 -8.883 -7.319
268 HA ASP 38 HA ASP 38 4.788 -7.957 -8.315
269 HB2 ASP 38 HB2 ASP 38 1.927 -7.308 -9.074
270 HB3 ASP 38 HB3 ASP 38 3.324 -6.737 -9.993
271 H ALA 39 H ALA 39 6.079 -6.334 -7.979
272 HA ALA 39 HA ALA 39 5.532 -4.454 -5.922
273 HB1 ALA 39 HB1 ALA 39 7.856 -4.667 -7.879
274 HB2 ALA 39 HB2 ALA 39 7.840 -3.695 -6.394
275 HB3 ALA 39 HB3 ALA 39 7.725 -5.461 -6.292
276 H ASN 40 H ASN 40 5.973 -3.856 -9.482
277 HA ASN 40 HA ASN 40 5.607 -1.019 -9.272
278 HB2 ASN 40 HB2 ASN 40 5.025 -2.928 -11.576
279 HB3 ASN 40 HB3 ASN 40 4.971 -1.182 -11.716
280 HD21 ASN 40 HD21 ASN 40 6.603 -2.645 -13.389
281 HD22 ASN 40 HD22 ASN 40 8.265 -2.325 -12.942
282 H TRP 41 H TRP 41 3.234 -3.651 -9.557
283 HA TRP 41 HA TRP 41 0.897 -1.993 -9.810
284 HB2 TRP 41 HB2 TRP 41 0.980 -4.371 -10.442
285 HB3 TRP 41 HB3 TRP 41 1.238 -4.829 -8.760
286 HD1 TRP 41 HD1 TRP 41 -1.439 -3.735 -11.183
287 HE1 TRP 41 HE1 TRP 41 -3.742 -3.804 -10.118
288 HE3 TRP 41 HE3 TRP 41 -0.017 -4.780 -6.387
289 HZ2 TRP 41 HZ2 TRP 41 -4.804 -3.969 -7.390
290 HZ3 TRP 41 HZ3 TRP 41 -1.699 -4.790 -4.545
291 HH2 TRP 41 HH2 TRP 41 -4.082 -4.321 -5.043
292 H LEU 42 H LEU 42 2.455 -3.508 -6.917
293 HA LEU 42 HA LEU 42 0.669 -2.467 -4.970
294 HB2 LEU 42 HB2 LEU 42 3.613 -3.229 -4.917
295 HB3 LEU 42 HB3 LEU 42 2.801 -2.661 -3.467
296 HG LEU 42 HG LEU 42 1.735 -5.039 -5.035
297 HD11 LEU 42 HD11 LEU 42 4.052 -5.536 -4.401
298 HD12 LEU 42 HD12 LEU 42 2.919 -6.478 -3.441
299 HD13 LEU 42 HD13 LEU 42 3.716 -5.053 -2.722
300 HD21 LEU 42 HD21 LEU 42 1.445 -4.213 -2.114
301 HD22 LEU 42 HD22 LEU 42 0.666 -5.595 -2.910
302 HD23 LEU 42 HD23 LEU 42 0.215 -3.952 -3.368
303 H VAL 43 H VAL 43 3.577 -0.931 -6.389
304 HA VAL 43 HA VAL 43 3.338 1.498 -4.809
305 HB VAL 43 HB VAL 43 4.804 0.975 -7.420
306 HG11 VAL 43 HG11 VAL 43 4.428 3.394 -7.171
307 HG12 VAL 43 HG12 VAL 43 4.987 3.329 -5.480
308 HG13 VAL 43 HG13 VAL 43 6.112 3.011 -6.821
309 HG21 VAL 43 HG21 VAL 43 5.678 -0.362 -5.519
310 HG22 VAL 43 HG22 VAL 43 6.802 0.942 -5.888
311 HG23 VAL 43 HG23 VAL 43 5.704 1.070 -4.498
312 H ARG 44 H ARG 44 1.952 0.561 -8.013
313 HA ARG 44 HA ARG 44 0.798 3.147 -8.500
314 HB2 ARG 44 HB2 ARG 44 1.086 1.220 -10.162
315 HB3 ARG 44 HB3 ARG 44 -0.407 0.544 -9.481
316 HG2 ARG 44 HG2 ARG 44 -1.535 2.763 -9.991
317 HG3 ARG 44 HG3 ARG 44 -0.032 3.312 -10.728
318 HD2 ARG 44 HD2 ARG 44 -0.179 1.542 -12.431
319 HD3 ARG 44 HD3 ARG 44 -1.611 0.870 -11.634
320 HE ARG 44 HE ARG 44 -2.932 2.478 -12.581
321 HH11 ARG 44 HH11 ARG 44 0.449 3.547 -12.988
322 HH12 ARG 44 HH12 ARG 44 0.003 4.894 -14.011
323 HH21 ARG 44 HH21 ARG 44 -3.458 4.222 -13.892
324 HH22 ARG 44 HH22 ARG 44 -2.216 5.276 -14.525
325 H TRP 45 H TRP 45 -0.548 0.229 -6.868
326 HA TRP 45 HA TRP 45 -3.064 1.378 -6.174
327 HB2 TRP 45 HB2 TRP 45 -2.503 -1.045 -6.018
328 HB3 TRP 45 HB3 TRP 45 -1.482 -0.709 -4.619
329 HD1 TRP 45 HD1 TRP 45 -2.684 -0.626 -2.310
330 HE1 TRP 45 HE1 TRP 45 -5.184 -0.631 -1.501
331 HE3 TRP 45 HE3 TRP 45 -5.063 -0.103 -6.810
332 HZ2 TRP 45 HZ2 TRP 45 -7.761 -0.356 -2.636
333 HZ3 TRP 45 HZ3 TRP 45 -7.531 0.191 -6.897
334 HH2 TRP 45 HH2 TRP 45 -8.887 0.040 -4.832
335 H LEU 46 H LEU 46 0.056 1.519 -4.415
336 HA LEU 46 HA LEU 46 -1.124 3.006 -2.247
337 HB2 LEU 46 HB2 LEU 46 0.840 1.496 -2.168
338 HB3 LEU 46 HB3 LEU 46 1.790 2.690 -3.044
339 HG LEU 46 HG LEU 46 1.839 4.178 -1.186
340 HD11 LEU 46 HD11 LEU 46 -0.332 2.475 0.123
341 HD12 LEU 46 HD12 LEU 46 -0.488 4.166 -0.400
342 HD13 LEU 46 HD13 LEU 46 0.585 3.773 0.932
343 HD21 LEU 46 HD21 LEU 46 3.169 2.058 -1.006
344 HD22 LEU 46 HD22 LEU 46 1.841 1.332 -0.086
345 HD23 LEU 46 HD23 LEU 46 2.748 2.733 0.575
346 H LYS 47 H LYS 47 0.045 4.020 -5.373
347 HA LYS 47 HA LYS 47 0.132 6.881 -4.644
348 HB2 LYS 47 HB2 LYS 47 0.449 5.361 -7.252
349 HB3 LYS 47 HB3 LYS 47 0.324 7.123 -7.191
350 HG2 LYS 47 HG2 LYS 47 2.269 7.287 -5.729
351 HG3 LYS 47 HG3 LYS 47 2.429 5.523 -5.668
352 HD2 LYS 47 HD2 LYS 47 2.859 5.453 -8.102
353 HD3 LYS 47 HD3 LYS 47 2.595 7.208 -8.203
354 HE2 LYS 47 HE2 LYS 47 4.476 7.502 -6.530
355 HE3 LYS 47 HE3 LYS 47 4.822 5.774 -6.685
356 HZ1 LYS 47 HZ1 LYS 47 6.195 7.155 -8.110
357 HZ2 LYS 47 HZ2 LYS 47 4.868 7.728 -8.921
358 HZ3 LYS 47 HZ3 LYS 47 5.298 6.127 -9.018
359 H VAL 48 H VAL 48 -2.081 4.875 -6.675
360 HA VAL 48 HA VAL 48 -4.091 7.076 -6.469
361 HB VAL 48 HB VAL 48 -2.489 7.322 -8.363
362 HG11 VAL 48 HG11 VAL 48 -3.989 5.085 -9.777
363 HG12 VAL 48 HG12 VAL 48 -2.689 6.113 -10.393
364 HG13 VAL 48 HG13 VAL 48 -2.357 4.947 -9.103
365 HG21 VAL 48 HG21 VAL 48 -4.451 8.603 -8.304
366 HG22 VAL 48 HG22 VAL 48 -4.286 7.994 -9.959
367 HG23 VAL 48 HG23 VAL 48 -5.458 7.255 -8.836
368 HA PRO 49 HA PRO 49 -5.831 2.701 -6.241
369 HB2 PRO 49 HB2 PRO 49 -7.011 2.689 -3.776
370 HB3 PRO 49 HB3 PRO 49 -5.278 2.383 -4.027
371 HG2 PRO 49 HG2 PRO 49 -6.625 4.990 -3.313
372 HG3 PRO 49 HG3 PRO 49 -5.210 4.238 -2.499
373 HD2 PRO 49 HD2 PRO 49 -4.954 6.213 -4.358
374 HD3 PRO 49 HD3 PRO 49 -3.783 4.875 -4.274
375 H ASP 50 H ASP 50 -7.368 5.827 -5.955
376 HA ASP 50 HA ASP 50 -10.113 4.819 -6.338
377 HB2 ASP 50 HB2 ASP 50 -8.824 7.556 -6.683
378 HB3 ASP 50 HB3 ASP 50 -10.517 7.227 -7.045
379 H GLN 51 H GLN 51 -7.593 6.272 -8.461
380 HA GLN 51 HA GLN 51 -9.176 6.146 -10.834
381 HB2 GLN 51 HB2 GLN 51 -7.112 7.585 -10.387
382 HB3 GLN 51 HB3 GLN 51 -6.151 6.126 -10.705
383 HG2 GLN 51 HG2 GLN 51 -7.330 6.022 -12.983
384 HG3 GLN 51 HG3 GLN 51 -7.985 7.621 -12.622
385 HE21 GLN 51 HE21 GLN 51 -5.256 5.844 -13.764
386 HE22 GLN 51 HE22 GLN 51 -4.145 7.205 -13.913
387 H MET 52 H MET 52 -6.844 3.801 -9.393
388 HA MET 52 HA MET 52 -6.750 2.031 -11.601
389 HB2 MET 52 HB2 MET 52 -6.291 1.844 -8.623
390 HB3 MET 52 HB3 MET 52 -6.284 0.358 -9.601
391 HG2 MET 52 HG2 MET 52 -4.545 1.341 -11.061
392 HG3 MET 52 HG3 MET 52 -4.586 2.828 -10.101
393 HE1 MET 52 HE1 MET 52 -4.575 -1.059 -9.246
394 HE2 MET 52 HE2 MET 52 -3.264 -0.802 -10.419
395 HE3 MET 52 HE3 MET 52 -2.879 -1.247 -8.740
396 H LEU 53 H LEU 53 -9.360 2.359 -9.172
397 HA LEU 53 HA LEU 53 -10.709 -0.059 -10.231
398 HB2 LEU 53 HB2 LEU 53 -11.669 2.114 -8.335
399 HB3 LEU 53 HB3 LEU 53 -12.606 0.698 -8.813
400 HG LEU 53 HG LEU 53 -9.964 0.611 -7.303
401 HD11 LEU 53 HD11 LEU 53 -12.813 0.108 -6.347
402 HD12 LEU 53 HD12 LEU 53 -11.819 1.536 -5.960
403 HD13 LEU 53 HD13 LEU 53 -11.338 -0.066 -5.376
404 HD21 LEU 53 HD21 LEU 53 -10.492 -1.757 -6.883
405 HD22 LEU 53 HD22 LEU 53 -10.276 -1.455 -8.606
406 HD23 LEU 53 HD23 LEU 53 -11.914 -1.636 -7.938
407 H ALA 54 H ALA 54 -10.988 3.491 -10.562
408 HA ALA 54 HA ALA 54 -13.223 3.452 -12.344
409 HB1 ALA 54 HB1 ALA 54 -11.042 5.544 -11.961
410 HB2 ALA 54 HB2 ALA 54 -12.665 5.797 -12.622
411 HB3 ALA 54 HB3 ALA 54 -12.477 5.353 -10.920
412 H GLU 55 H GLU 55 -9.825 2.951 -13.008
413 HA GLU 55 HA GLU 55 -10.202 3.078 -15.939
414 HB2 GLU 55 HB2 GLU 55 -7.893 3.174 -16.080
415 HB3 GLU 55 HB3 GLU 55 -8.275 4.099 -14.640
416 HG2 GLU 55 HG2 GLU 55 -7.700 1.902 -13.389
417 HG3 GLU 55 HG3 GLU 55 -7.047 1.326 -14.909
418 H LYS 56 H LYS 56 -10.824 0.834 -13.692
419 HA LYS 56 HA LYS 56 -10.681 -1.364 -13.301
420 HB2 LYS 56 HB2 LYS 56 -11.409 -1.431 -16.241
421 HB3 LYS 56 HB3 LYS 56 -11.378 -2.863 -15.197
422 HG2 LYS 56 HG2 LYS 56 -12.977 -1.770 -13.639
423 HG3 LYS 56 HG3 LYS 56 -13.058 -0.366 -14.717
424 HD2 LYS 56 HD2 LYS 56 -13.974 -1.770 -16.512
425 HD3 LYS 56 HD3 LYS 56 -13.784 -3.220 -15.525
426 HE2 LYS 56 HE2 LYS 56 -16.111 -2.461 -15.585
427 HE3 LYS 56 HE3 LYS 56 -15.467 -2.448 -13.942
428 HZ1 LYS 56 HZ1 LYS 56 -16.775 -0.422 -14.625
429 HZ2 LYS 56 HZ2 LYS 56 -15.528 -0.005 -15.625
430 HZ3 LYS 56 HZ3 LYS 56 -15.299 -0.107 -14.001
431 H ASP 57 H ASP 57 -8.578 -1.121 -12.670
432 HA ASP 57 HA ASP 57 -6.561 -2.764 -14.115
433 HB2 ASP 57 HB2 ASP 57 -5.877 -0.712 -12.802
434 HB3 ASP 57 HB3 ASP 57 -6.463 -1.508 -11.338
435 HA PRO 58 HA PRO 58 -9.617 -5.575 -12.577
436 HB2 PRO 58 HB2 PRO 58 -8.828 -7.892 -13.790
437 HB3 PRO 58 HB3 PRO 58 -9.470 -6.448 -14.646
438 HG2 PRO 58 HG2 PRO 58 -6.515 -7.052 -14.224
439 HG3 PRO 58 HG3 PRO 58 -7.383 -6.865 -15.799
440 HD2 PRO 58 HD2 PRO 58 -6.158 -4.806 -14.628
441 HD3 PRO 58 HD3 PRO 58 -7.801 -4.579 -15.309
442 H LEU 59 H LEU 59 -6.209 -6.202 -12.034
443 HA LEU 59 HA LEU 59 -6.518 -8.166 -9.927
444 HB2 LEU 59 HB2 LEU 59 -4.410 -7.841 -11.116
445 HB3 LEU 59 HB3 LEU 59 -4.281 -6.191 -10.509
446 HG LEU 59 HG LEU 59 -3.977 -7.006 -8.216
447 HD11 LEU 59 HD11 LEU 59 -4.208 -9.801 -9.419
448 HD12 LEU 59 HD12 LEU 59 -5.302 -9.070 -8.219
449 HD13 LEU 59 HD13 LEU 59 -3.633 -9.434 -7.777
450 HD21 LEU 59 HD21 LEU 59 -2.182 -8.501 -10.176
451 HD22 LEU 59 HD22 LEU 59 -1.783 -8.048 -8.504
452 HD23 LEU 59 HD23 LEU 59 -2.012 -6.793 -9.727
453 H ALA 60 H ALA 60 -6.630 -4.567 -9.920
454 HA ALA 60 HA ALA 60 -6.952 -4.426 -7.011
455 HB1 ALA 60 HB1 ALA 60 -6.119 -2.496 -8.330
456 HB2 ALA 60 HB2 ALA 60 -7.695 -2.396 -9.150
457 HB3 ALA 60 HB3 ALA 60 -7.594 -2.153 -7.397
458 H MET 61 H MET 61 -9.177 -4.378 -9.818
459 HA MET 61 HA MET 61 -11.637 -4.063 -8.488
460 HB2 MET 61 HB2 MET 61 -11.049 -5.894 -10.852
461 HB3 MET 61 HB3 MET 61 -12.629 -5.303 -10.388
462 HG2 MET 61 HG2 MET 61 -10.315 -3.547 -11.292
463 HG3 MET 61 HG3 MET 61 -11.627 -4.091 -12.316
464 HE1 MET 61 HE1 MET 61 -14.226 -3.704 -10.385
465 HE2 MET 61 HE2 MET 61 -14.678 -2.178 -11.179
466 HE3 MET 61 HE3 MET 61 -13.949 -3.513 -12.131
467 H LEU 62 H LEU 62 -9.648 -6.970 -8.731
468 HA LEU 62 HA LEU 62 -11.458 -8.733 -7.303
469 HB2 LEU 62 HB2 LEU 62 -9.825 -9.378 -9.092
470 HB3 LEU 62 HB3 LEU 62 -8.518 -8.829 -8.033
471 HG LEU 62 HG LEU 62 -9.198 -10.556 -6.365
472 HD11 LEU 62 HD11 LEU 62 -11.059 -11.435 -8.620
473 HD12 LEU 62 HD12 LEU 62 -11.532 -10.975 -6.971
474 HD13 LEU 62 HD13 LEU 62 -10.626 -12.466 -7.250
475 HD21 LEU 62 HD21 LEU 62 -7.378 -10.937 -7.974
476 HD22 LEU 62 HD22 LEU 62 -8.547 -11.571 -9.153
477 HD23 LEU 62 HD23 LEU 62 -8.245 -12.445 -7.628
478 H LEU 63 H LEU 63 -8.272 -7.063 -6.494
479 HA LEU 63 HA LEU 63 -8.140 -8.467 -4.002
480 HB2 LEU 63 HB2 LEU 63 -6.252 -7.799 -5.357
481 HB3 LEU 63 HB3 LEU 63 -6.605 -6.091 -5.136
482 HG LEU 63 HG LEU 63 -6.087 -7.843 -2.706
483 HD11 LEU 63 HD11 LEU 63 -3.664 -7.252 -2.983
484 HD12 LEU 63 HD12 LEU 63 -4.035 -6.699 -4.632
485 HD13 LEU 63 HD13 LEU 63 -4.279 -8.398 -4.191
486 HD21 LEU 63 HD21 LEU 63 -6.747 -5.487 -2.281
487 HD22 LEU 63 HD22 LEU 63 -5.490 -4.921 -3.382
488 HD23 LEU 63 HD23 LEU 63 -5.050 -5.730 -1.859
489 H PHE 64 H PHE 64 -9.350 -5.281 -4.896
490 HA PHE 64 HA PHE 64 -9.574 -4.354 -2.136
491 HB2 PHE 64 HB2 PHE 64 -10.073 -2.395 -3.017
492 HB3 PHE 64 HB3 PHE 64 -9.705 -3.072 -4.579
493 HD1 PHE 64 HD1 PHE 64 -11.699 -4.060 -5.972
494 HD2 PHE 64 HD2 PHE 64 -12.225 -1.639 -2.454
495 HE1 PHE 64 HE1 PHE 64 -14.066 -3.677 -6.595
496 HE2 PHE 64 HE2 PHE 64 -14.587 -1.214 -3.103
497 HZ PHE 64 HZ PHE 64 -15.521 -2.277 -5.144
498 H GLU 65 H GLU 65 -11.808 -5.960 -4.402
499 HA GLU 65 HA GLU 65 -14.122 -6.074 -2.762
500 HB2 GLU 65 HB2 GLU 65 -14.348 -6.353 -5.070
501 HB3 GLU 65 HB3 GLU 65 -12.980 -7.435 -5.185
502 HG2 GLU 65 HG2 GLU 65 -14.876 -8.689 -5.667
503 HG3 GLU 65 HG3 GLU 65 -14.233 -9.233 -4.127
504 H GLN 66 H GLN 66 -11.353 -8.342 -3.126
505 HA GLN 66 HA GLN 66 -12.446 -10.135 -1.161
506 HB2 GLN 66 HB2 GLN 66 -9.656 -9.908 -2.385
507 HB3 GLN 66 HB3 GLN 66 -10.148 -11.212 -1.297
508 HG2 GLN 66 HG2 GLN 66 -11.926 -11.889 -2.900
509 HG3 GLN 66 HG3 GLN 66 -11.394 -10.657 -4.029
510 HE21 GLN 66 HE21 GLN 66 -11.389 -13.248 -4.997
511 HE22 GLN 66 HE22 GLN 66 -9.750 -13.871 -5.027
512 H TYR 67 H TYR 67 -10.489 -7.282 -0.744
513 HA TYR 67 HA TYR 67 -10.274 -7.889 2.164
514 HB2 TYR 67 HB2 TYR 67 -8.939 -5.850 0.414
515 HB3 TYR 67 HB3 TYR 67 -9.055 -5.640 2.157
516 HD1 TYR 67 HD2 TYR 67 -8.216 -7.427 3.737
517 HD2 TYR 67 HD1 TYR 67 -7.124 -7.244 -0.431
518 HE1 TYR 67 HE2 TYR 67 -6.127 -8.696 4.224
519 HE2 TYR 67 HE1 TYR 67 -5.025 -8.500 0.064
520 HH TYR 67 HH TYR 67 -3.722 -9.515 1.720
521 H ASN 68 H ASN 68 -12.806 -7.831 1.377
522 HA ASN 68 HA ASN 68 -14.838 -7.071 1.916
523 HB2 ASN 68 HB2 ASN 68 -13.631 -7.316 4.128
524 HB3 ASN 68 HB3 ASN 68 -13.439 -5.570 4.136
525 HD21 ASN 68 HD21 ASN 68 -14.822 -4.842 5.680
526 HD22 ASN 68 HD22 ASN 68 -16.518 -5.300 5.776
527 H ARG 69 H ARG 69 -13.450 -5.433 -0.048
528 HA ARG 69 HA ARG 69 -13.565 -3.472 -1.167
529 HB2 ARG 69 HB2 ARG 69 -15.857 -2.919 -1.925
530 HB3 ARG 69 HB3 ARG 69 -15.380 -4.589 -2.047
531 HG2 ARG 69 HG2 ARG 69 -16.732 -5.182 -0.083
532 HG3 ARG 69 HG3 ARG 69 -17.222 -3.479 0.104
533 HD2 ARG 69 HD2 ARG 69 -18.335 -3.522 -2.067
534 HD3 ARG 69 HD3 ARG 69 -17.647 -5.104 -2.442
535 HE ARG 69 HE ARG 69 -19.158 -6.177 -1.062
536 HH11 ARG 69 HH11 ARG 69 -19.672 -2.654 -0.786
537 HH12 ARG 69 HH12 ARG 69 -21.243 -2.848 -0.040
538 HH21 ARG 69 HH21 ARG 69 -21.182 -6.372 -0.109
539 HH22 ARG 69 HH22 ARG 69 -22.097 -4.952 0.344
540 H LEU 70 H LEU 70 -12.965 -2.751 1.546
541 HA LEU 70 HA LEU 70 -14.307 -0.355 2.304
542 HB2 LEU 70 HB2 LEU 70 -12.834 -1.659 3.715
543 HB3 LEU 70 HB3 LEU 70 -11.440 -1.269 2.720
544 HG LEU 70 HG LEU 70 -13.015 0.945 4.094
545 HD11 LEU 70 HD11 LEU 70 -10.849 -0.760 5.338
546 HD12 LEU 70 HD12 LEU 70 -12.543 -0.684 5.831
547 HD13 LEU 70 HD13 LEU 70 -11.524 0.739 6.034
548 HD21 LEU 70 HD21 LEU 70 -10.065 0.635 3.324
549 HD22 LEU 70 HD22 LEU 70 -10.750 2.011 4.224
550 HD23 LEU 70 HD23 LEU 70 -11.233 1.727 2.562
551 H ALA 71 H ALA 71 -11.625 -0.818 0.014
552 HA ALA 71 HA ALA 71 -10.724 0.428 -1.611
553 HB1 ALA 71 HB1 ALA 71 -12.143 1.886 -2.903
554 HB2 ALA 71 HB2 ALA 71 -13.100 0.492 -2.386
555 HB3 ALA 71 HB3 ALA 71 -13.297 2.045 -1.568
556 H MET 72 H MET 72 -9.070 1.107 -0.044
557 HA MET 72 HA MET 72 -9.272 3.607 1.281
558 HB2 MET 72 HB2 MET 72 -7.103 3.408 1.934
559 HB3 MET 72 HB3 MET 72 -7.557 1.732 1.668
560 HG2 MET 72 HG2 MET 72 -6.397 1.882 -0.591
561 HG3 MET 72 HG3 MET 72 -5.880 3.509 -0.146
562 HE1 MET 72 HE1 MET 72 -2.504 1.594 0.140
563 HE2 MET 72 HE2 MET 72 -3.786 1.517 -1.089
564 HE3 MET 72 HE3 MET 72 -3.299 3.086 -0.413
565 HA PRO 73 HA PRO 73 -9.055 6.325 -2.168
566 HB2 PRO 73 HB2 PRO 73 -8.923 8.742 -0.974
567 HB3 PRO 73 HB3 PRO 73 -10.273 7.612 -0.642
568 HG2 PRO 73 HG2 PRO 73 -7.754 8.010 1.011
569 HG3 PRO 73 HG3 PRO 73 -9.457 8.065 1.572
570 HD2 PRO 73 HD2 PRO 73 -7.931 5.791 1.730
571 HD3 PRO 73 HD3 PRO 73 -9.695 5.747 1.419
572 H ASN 74 H ASN 74 -7.785 8.132 -3.224
573 HA ASN 74 HA ASN 74 -4.867 8.095 -2.771
574 HB2 ASN 74 HB2 ASN 74 -5.806 8.771 -4.969
575 HB3 ASN 74 HB3 ASN 74 -6.630 10.129 -4.193
576 HD21 ASN 74 HD21 ASN 74 -5.166 10.955 -6.168
577 HD22 ASN 74 HD22 ASN 74 -3.618 11.624 -5.611
578 H MET 75 H MET 75 -4.284 8.535 -0.768
579 HA MET 75 HA MET 75 -5.902 9.986 1.091
580 HB2 MET 75 HB2 MET 75 -3.130 8.766 1.262
581 HB3 MET 75 HB3 MET 75 -3.925 9.527 2.641
582 HG2 MET 75 HG2 MET 75 -5.571 7.917 2.811
583 HG3 MET 75 HG3 MET 75 -5.433 7.404 1.138
584 HE1 MET 75 HE1 MET 75 -3.968 5.571 0.208
585 HE2 MET 75 HE2 MET 75 -2.575 6.645 0.463
586 HE3 MET 75 HE3 MET 75 -2.503 4.955 1.004
587 H ARG 76 H ARG 76 -2.462 10.715 0.556
588 HA ARG 76 HA ARG 76 -2.795 13.567 0.246
589 HB2 ARG 76 HB2 ARG 76 -1.953 14.291 2.445
590 HB3 ARG 76 HB3 ARG 76 -3.498 13.477 2.576
591 HG2 ARG 76 HG2 ARG 76 -2.470 11.445 3.421
592 HG3 ARG 76 HG3 ARG 76 -0.841 12.071 3.132
593 HD2 ARG 76 HD2 ARG 76 -2.839 13.417 4.995
594 HD3 ARG 76 HD3 ARG 76 -1.684 12.188 5.532
595 HE ARG 76 HE ARG 76 -0.132 14.038 4.185
596 HH11 ARG 76 HH11 ARG 76 -2.309 14.200 7.004
597 HH12 ARG 76 HH12 ARG 76 -1.414 15.504 7.750
598 HH21 ARG 76 HH21 ARG 76 0.996 15.724 5.185
599 HH22 ARG 76 HH22 ARG 76 0.457 16.368 6.719
600 H LEU 77 H LEU 77 -0.962 11.003 -0.416
601 HA LEU 77 HA LEU 77 1.532 11.662 0.887
602 HB2 LEU 77 HB2 LEU 77 1.010 9.576 -1.244
603 HB3 LEU 77 HB3 LEU 77 2.371 9.628 -0.124
604 HG LEU 77 HG LEU 77 -0.540 9.167 0.666
605 HD11 LEU 77 HD11 LEU 77 1.785 7.212 0.582
606 HD12 LEU 77 HD12 LEU 77 0.521 7.336 -0.664
607 HD13 LEU 77 HD13 LEU 77 0.081 6.869 0.973
608 HD21 LEU 77 HD21 LEU 77 0.818 10.234 2.482
609 HD22 LEU 77 HD22 LEU 77 1.959 8.877 2.376
610 HD23 LEU 77 HD23 LEU 77 0.269 8.606 2.862
611 H GLY 78 H GLY 78 3.421 12.410 0.119
612 HA2 GLY 78 HA2 GLY 78 3.614 13.506 -2.645
613 HA3 GLY 78 HA3 GLY 78 4.782 13.712 -1.347
614 H ASP 79 H ASP 79 5.452 12.942 -4.027
615 HA ASP 79 HA ASP 79 5.767 10.184 -4.448
616 HB2 ASP 79 HB2 ASP 79 6.138 12.254 -5.998
617 HB3 ASP 79 HB3 ASP 79 7.792 12.244 -5.390
618 H ALA 80 H ALA 80 7.952 12.405 -2.681
619 HA ALA 80 HA ALA 80 10.015 10.424 -2.231
620 HB1 ALA 80 HB1 ALA 80 10.965 12.107 -0.776
621 HB2 ALA 80 HB2 ALA 80 10.408 12.873 -2.267
622 HB3 ALA 80 HB3 ALA 80 9.457 13.036 -0.772
623 H GLU 81 H GLU 81 7.050 11.351 -0.468
624 HA GLU 81 HA GLU 81 7.619 9.944 1.979
625 HB2 GLU 81 HB2 GLU 81 6.232 11.840 1.983
626 HB3 GLU 81 HB3 GLU 81 5.282 11.306 0.614
627 HG2 GLU 81 HG2 GLU 81 4.139 9.704 1.874
628 HG3 GLU 81 HG3 GLU 81 5.250 9.873 3.250
629 H VAL 82 H VAL 82 5.761 9.166 -1.019
630 HA VAL 82 HA VAL 82 5.202 6.415 -0.335
631 HB VAL 82 HB VAL 82 5.655 7.705 -3.059
632 HG11 VAL 82 HG11 VAL 82 4.436 5.754 -3.988
633 HG12 VAL 82 HG12 VAL 82 5.954 5.253 -3.251
634 HG13 VAL 82 HG13 VAL 82 4.419 4.990 -2.390
635 HG21 VAL 82 HG21 VAL 82 3.193 7.649 -3.228
636 HG22 VAL 82 HG22 VAL 82 3.081 6.961 -1.595
637 HG23 VAL 82 HG23 VAL 82 3.690 8.610 -1.837
638 H SER 83 H SER 83 8.033 7.914 -2.003
639 HA SER 83 HA SER 83 9.487 5.517 -2.415
640 HB2 SER 83 HB2 SER 83 10.626 8.283 -1.881
641 HB3 SER 83 HB3 SER 83 11.476 6.925 -2.623
642 HG SER 83 HG SER 83 9.161 8.245 -3.652
643 H ALA 84 H ALA 84 9.251 7.432 0.578
644 HA ALA 84 HA ALA 84 11.309 5.909 1.985
645 HB1 ALA 84 HB1 ALA 84 10.475 7.166 3.936
646 HB2 ALA 84 HB2 ALA 84 10.786 8.238 2.566
647 HB3 ALA 84 HB3 ALA 84 9.118 7.788 2.973
648 H LEU 85 H LEU 85 7.700 5.828 1.922
649 HA LEU 85 HA LEU 85 7.419 3.684 3.824
650 HB2 LEU 85 HB2 LEU 85 5.660 4.797 1.606
651 HB3 LEU 85 HB3 LEU 85 5.111 3.515 2.678
652 HG LEU 85 HG LEU 85 6.088 6.202 3.751
653 HD11 LEU 85 HD11 LEU 85 4.182 6.599 2.253
654 HD12 LEU 85 HD12 LEU 85 3.709 6.823 3.942
655 HD13 LEU 85 HD13 LEU 85 3.245 5.336 3.089
656 HD21 LEU 85 HD21 LEU 85 4.327 4.015 4.949
657 HD22 LEU 85 HD22 LEU 85 4.750 5.551 5.722
658 HD23 LEU 85 HD23 LEU 85 6.011 4.360 5.405
659 H ILE 86 H ILE 86 7.979 3.665 0.372
660 HA ILE 86 HA ILE 86 7.589 0.838 -0.177
661 HB ILE 86 HB ILE 86 8.694 3.226 -1.564
662 HG12 ILE 86 HG12 ILE 86 7.340 2.447 -3.377
663 HG13 ILE 86 HG13 ILE 86 7.184 0.836 -2.672
664 HG21 ILE 86 HG21 ILE 86 10.640 1.805 -1.921
665 HG22 ILE 86 HG22 ILE 86 9.590 0.455 -2.427
666 HG23 ILE 86 HG23 ILE 86 9.699 1.932 -3.401
667 HD11 ILE 86 HD11 ILE 86 5.102 2.183 -2.536
668 HD12 ILE 86 HD12 ILE 86 5.675 1.666 -0.945
669 HD13 ILE 86 HD13 ILE 86 5.926 3.338 -1.482
670 H SER 87 H SER 87 10.405 2.807 0.829
671 HA SER 87 HA SER 87 12.217 0.570 0.965
672 HB2 SER 87 HB2 SER 87 12.701 3.141 0.873
673 HB3 SER 87 HB3 SER 87 12.576 3.060 2.641
674 HG SER 87 HG SER 87 14.293 1.628 2.676
675 H TYR 88 H TYR 88 9.961 2.038 3.390
676 HA TYR 88 HA TYR 88 11.000 0.406 5.552
677 HB2 TYR 88 HB2 TYR 88 9.699 2.377 6.002
678 HB3 TYR 88 HB3 TYR 88 8.270 1.690 5.227
679 HD1 TYR 88 HD2 TYR 88 10.764 0.454 7.810
680 HD2 TYR 88 HD1 TYR 88 6.623 1.228 6.870
681 HE1 TYR 88 HE2 TYR 88 10.092 -0.464 10.002
682 HE2 TYR 88 HE1 TYR 88 5.961 0.298 9.089
683 HH TYR 88 HH TYR 88 6.669 -0.653 11.042
684 H LEU 89 H LEU 89 8.321 -0.205 3.234
685 HA LEU 89 HA LEU 89 7.671 -2.777 4.357
686 HB2 LEU 89 HB2 LEU 89 6.992 -1.257 1.859
687 HB3 LEU 89 HB3 LEU 89 6.816 -3.006 1.800
688 HG LEU 89 HG LEU 89 5.331 -3.007 3.744
689 HD11 LEU 89 HD11 LEU 89 6.085 -1.003 4.962
690 HD12 LEU 89 HD12 LEU 89 4.358 -0.912 4.615
691 HD13 LEU 89 HD13 LEU 89 5.509 0.034 3.641
692 HD21 LEU 89 HD21 LEU 89 3.399 -1.946 2.652
693 HD22 LEU 89 HD22 LEU 89 4.398 -2.810 1.476
694 HD23 LEU 89 HD23 LEU 89 4.490 -1.036 1.578
695 H GLU 90 H GLU 90 10.201 -1.888 2.016
696 HA GLU 90 HA GLU 90 10.891 -4.682 1.503
697 HB2 GLU 90 HB2 GLU 90 11.385 -2.694 -0.038
698 HB3 GLU 90 HB3 GLU 90 12.711 -2.291 1.065
699 HG2 GLU 90 HG2 GLU 90 13.566 -4.658 0.752
700 HG3 GLU 90 HG3 GLU 90 12.285 -4.920 -0.433
701 H GLU 91 H GLU 91 12.323 -2.135 3.602
702 HA GLU 91 HA GLU 91 14.480 -3.781 4.538
703 HB2 GLU 91 HB2 GLU 91 13.257 -1.194 5.578
704 HB3 GLU 91 HB3 GLU 91 14.684 -1.950 6.283
705 HG2 GLU 91 HG2 GLU 91 15.951 -1.698 4.232
706 HG3 GLU 91 HG3 GLU 91 14.541 -1.092 3.362
707 H GLU 92 H GLU 92 11.351 -2.891 6.169
708 HA GLU 92 HA GLU 92 11.990 -4.352 8.561
709 HB2 GLU 92 HB2 GLU 92 10.220 -2.515 8.210
710 HB3 GLU 92 HB3 GLU 92 9.216 -3.763 7.486
711 HG2 GLU 92 HG2 GLU 92 8.477 -3.626 9.695
712 HG3 GLU 92 HG3 GLU 92 9.467 -5.075 9.682
713 H THR 93 H THR 93 10.381 -5.289 5.532
714 HA THR 93 HA THR 93 9.661 -7.983 6.237
715 HB THR 93 HB THR 93 10.415 -6.726 3.573
716 HG1 THR 93 HG1 THR 93 8.531 -6.010 3.825
717 HG21 THR 93 HG21 THR 93 9.199 -9.465 4.083
718 HG22 THR 93 HG22 THR 93 10.773 -9.129 3.321
719 HG23 THR 93 HG23 THR 93 9.296 -8.640 2.502
720 H ALA 94 H ALA 94 12.736 -6.646 4.868
721 HA ALA 94 HA ALA 94 14.019 -9.204 4.699
722 HB1 ALA 94 HB1 ALA 94 14.712 -7.205 3.421
723 HB2 ALA 94 HB2 ALA 94 15.214 -6.405 4.925
724 HB3 ALA 94 HB3 ALA 94 16.047 -7.871 4.370
725 H ARG 95 H ARG 95 13.928 -6.761 7.324
726 HA ARG 95 HA ARG 95 15.761 -8.195 9.045
727 HB2 ARG 95 HB2 ARG 95 13.699 -6.053 9.646
728 HB3 ARG 95 HB3 ARG 95 14.833 -6.691 10.833
729 HG2 ARG 95 HG2 ARG 95 15.579 -5.145 8.313
730 HG3 ARG 95 HG3 ARG 95 15.584 -4.563 9.969
731 HD2 ARG 95 HD2 ARG 95 17.818 -4.994 9.623
732 HD3 ARG 95 HD3 ARG 95 17.294 -6.470 10.437
733 HE ARG 95 HE ARG 95 17.509 -6.223 7.451
734 HH11 ARG 95 HH11 ARG 95 18.378 -8.039 10.405
735 HH12 ARG 95 HH12 ARG 95 19.147 -9.323 9.500
736 HH21 ARG 95 HH21 ARG 95 18.510 -7.903 6.340
737 HH22 ARG 95 HH22 ARG 95 19.221 -9.246 7.207
738 H LEU 96 H LEU 96 12.199 -8.250 8.846
739 HA LEU 96 HA LEU 96 12.111 -10.183 11.094
740 HB2 LEU 96 HB2 LEU 96 10.119 -8.287 9.874
741 HB3 LEU 96 HB3 LEU 96 9.570 -9.600 10.833
742 HG LEU 96 HG LEU 96 9.613 -7.495 11.995
743 HD11 LEU 96 HD11 LEU 96 10.505 -8.420 14.049
744 HD12 LEU 96 HD12 LEU 96 11.445 -9.630 13.134
745 HD13 LEU 96 HD13 LEU 96 9.666 -9.667 13.107
746 HD21 LEU 96 HD21 LEU 96 11.695 -6.657 10.975
747 HD22 LEU 96 HD22 LEU 96 12.614 -7.815 11.979
748 HD23 LEU 96 HD23 LEU 96 11.668 -6.523 12.749
749 H GLN 97 H GLN 97 13.084 -11.224 8.574
750 HA GLN 97 HA GLN 97 11.088 -12.831 7.305
751 HB2 GLN 97 HB2 GLN 97 14.097 -13.151 7.656
752 HB3 GLN 97 HB3 GLN 97 13.130 -14.345 6.792
753 HG2 GLN 97 HG2 GLN 97 13.332 -11.409 6.028
754 HG3 GLN 97 HG3 GLN 97 14.181 -12.738 5.247
755 HE21 GLN 97 HE21 GLN 97 11.255 -10.927 5.272
756 HE22 GLN 97 HE22 GLN 97 10.340 -11.971 4.175
757 H THR 98 H THR 98 12.930 -13.465 10.309
758 HA THR 98 HA THR 98 10.903 -15.502 10.975
759 HB THR 98 HB THR 98 12.394 -16.963 9.997
760 HG1 THR 98 HG1 THR 98 12.975 -18.175 11.847
761 HG21 THR 98 HG21 THR 98 14.498 -15.704 9.937
762 HG22 THR 98 HG22 THR 98 14.715 -17.308 10.636
763 HG23 THR 98 HG23 THR 98 14.683 -15.891 11.694
764 HA PRO 99 HA PRO 99 11.659 -13.596 15.019
765 HB2 PRO 99 HB2 PRO 99 9.118 -12.866 15.588
766 HB3 PRO 99 HB3 PRO 99 10.158 -11.855 14.544
767 HG2 PRO 99 HG2 PRO 99 8.087 -13.904 13.674
768 HG3 PRO 99 HG3 PRO 99 8.250 -12.205 13.125
769 HD2 PRO 99 HD2 PRO 99 9.307 -14.332 11.749
770 HD3 PRO 99 HD3 PRO 99 10.088 -12.725 11.771
771 H VAL 100 H VAL 100 10.716 -16.325 13.582
772 HA VAL 100 HA VAL 100 8.759 -17.530 15.302
773 HB VAL 100 HB VAL 100 10.646 -18.766 13.254
774 HG11 VAL 100 HG11 VAL 100 9.605 -20.501 14.698
775 HG12 VAL 100 HG12 VAL 100 8.004 -19.828 14.307
776 HG13 VAL 100 HG13 VAL 100 9.000 -20.560 13.043
777 HG21 VAL 100 HG21 VAL 100 7.798 -17.711 12.937
778 HG22 VAL 100 HG22 VAL 100 9.261 -17.028 12.192
779 HG23 VAL 100 HG23 VAL 100 8.699 -18.621 11.707
780 H THR 101 H THR 101 8.988 -18.813 17.081
781 HA THR 101 HA THR 101 11.569 -20.183 17.622
782 HB THR 101 HB THR 101 10.261 -18.412 19.705
783 HG1 THR 101 HG1 THR 101 12.120 -17.979 17.801
784 HG21 THR 101 HG21 THR 101 12.846 -20.027 19.797
785 HG22 THR 101 HG22 THR 101 11.363 -20.409 20.703
786 HG23 THR 101 HG23 THR 101 12.255 -18.924 21.053
787 H ASN 102 H ASN 102 8.309 -19.629 19.088
788 HA ASN 102 HA ASN 102 7.673 -22.492 18.928
789 HB2 ASN 102 HB2 ASN 102 8.931 -22.606 20.972
790 HB3 ASN 102 HB3 ASN 102 8.281 -21.078 21.549
791 HD21 ASN 102 HD21 ASN 102 6.785 -21.306 23.151
792 HD22 ASN 102 HD22 ASN 102 5.716 -22.714 23.324
793 H ARG 103 H ARG 103 5.580 -22.643 18.463
794 HA ARG 103 HA ARG 103 3.628 -20.498 18.945
795 HB2 ARG 103 HB2 ARG 103 3.600 -21.997 16.954
796 HB3 ARG 103 HB3 ARG 103 3.186 -23.356 17.982
797 HG2 ARG 103 HG2 ARG 103 1.530 -20.801 17.661
798 HG3 ARG 103 HG3 ARG 103 1.272 -22.278 16.742
799 HD2 ARG 103 HD2 ARG 103 0.879 -21.954 19.740
800 HD3 ARG 103 HD3 ARG 103 -0.375 -22.094 18.511
801 HE ARG 103 HE ARG 103 1.049 -24.369 18.091
802 HH11 ARG 103 HH11 ARG 103 -0.368 -23.005 21.067
803 HH12 ARG 103 HH12 ARG 103 -0.594 -24.577 21.801
804 HH21 ARG 103 HH21 ARG 103 0.743 -26.378 19.080
805 HH22 ARG 103 HH22 ARG 103 0.034 -26.486 20.675
806 H GLY 104 H GLY 104 3.244 -20.112 21.007
807 HA2 GLY 104 HA2 GLY 104 2.751 -22.381 22.916
808 HA3 GLY 104 HA3 GLY 104 3.482 -20.841 23.350
809 H ILE 105 H ILE 105 1.044 -19.968 21.309
810 HA ILE 105 HA ILE 105 -0.639 -19.052 23.418
811 HB ILE 105 HB ILE 105 -0.097 -17.725 21.553
812 HG12 ILE 105 HG12 ILE 105 -2.245 -17.369 22.809
813 HG13 ILE 105 HG13 ILE 105 -2.037 -16.566 21.264
814 HG21 ILE 105 HG21 ILE 105 -1.060 -17.995 19.305
815 HG22 ILE 105 HG22 ILE 105 0.079 -19.274 19.713
816 HG23 ILE 105 HG23 ILE 105 -1.663 -19.597 19.748
817 HD11 ILE 105 HD11 ILE 105 -3.785 -19.017 21.688
818 HD12 ILE 105 HD12 ILE 105 -4.325 -17.345 21.527
819 HD13 ILE 105 HD13 ILE 105 -3.553 -18.145 20.157
820 HA PRO 106 HA PRO 106 -3.368 -22.639 23.349
821 HB2 PRO 106 HB2 PRO 106 -4.794 -22.200 25.605
822 HB3 PRO 106 HB3 PRO 106 -3.049 -22.608 25.632
823 HG2 PRO 106 HG2 PRO 106 -4.325 -19.874 25.859
824 HG3 PRO 106 HG3 PRO 106 -3.024 -20.576 26.867
825 HD2 PRO 106 HD2 PRO 106 -2.533 -18.902 24.728
826 HD3 PRO 106 HD3 PRO 106 -1.408 -20.190 25.238
827 HHA HEC 107 HHA HEC 107 -4.814 -3.329 0.813
828 HHB HEC 107 HHB HEC 107 0.517 0.147 1.781
829 HHC HEC 107 HHC HEC 107 -3.000 4.559 4.982
830 HHD HEC 107 HHD HEC 107 -7.980 0.450 4.952
831 HMA1 HEC 107 HMA1 HEC 107 0.400 -3.210 -0.021
832 HMA2 HEC 107 HMA2 HEC 107 0.524 -1.570 -0.683
833 HMA3 HEC 107 HMA3 HEC 107 1.087 -1.931 0.970
834 HAA1 HEC 107 HAA1 HEC 107 -3.276 -3.881 -0.814
835 HAA2 HEC 107 HAA2 HEC 107 -1.563 -3.780 -1.120
836 HBA1 HEC 107 HBA1 HEC 107 -1.115 -5.005 1.035
837 HBA2 HEC 107 HBA2 HEC 107 -2.858 -5.154 1.282
838 HMB1 HEC 107 HMB1 HEC 107 1.957 3.274 3.183
839 HMB2 HEC 107 HMB2 HEC 107 1.858 1.884 4.264
840 HMB3 HEC 107 HMB3 HEC 107 1.903 1.651 2.510
841 HAB HEC 107 HAB HEC 107 -1.040 5.112 5.044
842 HBB1 HEC 107 HBB1 HEC 107 0.568 6.540 3.894
843 HBB2 HEC 107 HBB2 HEC 107 0.901 5.229 2.759
844 HBB3 HEC 107 HBB3 HEC 107 -0.736 5.914 2.868
845 HMC1 HEC 107 HMC1 HEC 107 -6.127 5.067 7.021
846 HMC2 HEC 107 HMC2 HEC 107 -4.401 5.026 6.753
847 HMC3 HEC 107 HMC3 HEC 107 -5.461 5.797 5.553
848 HAC HEC 107 HAC HEC 107 -8.386 1.979 6.274
849 HBC1 HEC 107 HBC1 HEC 107 -9.609 3.979 6.714
850 HBC2 HEC 107 HBC2 HEC 107 -8.221 4.991 6.297
851 HBC3 HEC 107 HBC3 HEC 107 -8.994 3.996 5.049
852 HMD1 HEC 107 HMD1 HEC 107 -8.600 -1.840 5.219
853 HMD2 HEC 107 HMD2 HEC 107 -9.537 -1.741 3.705
854 HMD3 HEC 107 HMD3 HEC 107 -8.744 -3.249 4.170
855 HAD1 HEC 107 HAD1 HEC 107 -7.116 -4.312 1.407
856 HAD2 HEC 107 HAD2 HEC 107 -8.607 -3.407 1.724
857 HBD1 HEC 107 HBD1 HEC 107 -6.664 -3.029 -0.551
858 HBD2 HEC 107 HBD2 HEC 107 -8.411 -3.213 -0.581
Start of MODEL 7
1 H SER 1 H SER 1 13.794 6.307 5.775
2 HA SER 1 HA SER 1 12.556 7.042 8.181
3 HB2 SER 1 HB2 SER 1 11.973 8.269 5.466
4 HB3 SER 1 HB3 SER 1 11.998 9.072 7.045
5 HG SER 1 HG SER 1 13.838 9.453 5.738
6 H GLY 2 H GLY 2 11.119 5.174 5.621
7 HA2 GLY 2 HA2 GLY 2 8.501 5.998 5.418
8 HA3 GLY 2 HA3 GLY 2 8.997 4.345 5.337
9 H GLU 3 H GLU 3 9.865 4.305 8.271
10 HA GLU 3 HA GLU 3 7.474 3.471 9.554
11 HB2 GLU 3 HB2 GLU 3 9.908 3.056 10.272
12 HB3 GLU 3 HB3 GLU 3 9.908 4.699 10.914
13 HG2 GLU 3 HG2 GLU 3 7.650 3.753 12.113
14 HG3 GLU 3 HG3 GLU 3 8.486 2.235 11.905
15 H GLN 4 H GLN 4 8.988 6.698 9.389
16 HA GLN 4 HA GLN 4 7.406 8.024 11.389
17 HB2 GLN 4 HB2 GLN 4 8.730 9.197 8.901
18 HB3 GLN 4 HB3 GLN 4 8.271 10.076 10.355
19 HG2 GLN 4 HG2 GLN 4 10.008 8.962 11.656
20 HG3 GLN 4 HG3 GLN 4 10.394 7.878 10.323
21 HE21 GLN 4 HE21 GLN 4 12.646 8.671 10.579
22 HE22 GLN 4 HE22 GLN 4 13.052 10.259 9.937
23 H ILE 5 H ILE 5 7.016 7.423 7.962
24 HA ILE 5 HA ILE 5 4.662 9.102 7.563
25 HB ILE 5 HB ILE 5 5.895 7.017 5.728
26 HG12 ILE 5 HG12 ILE 5 6.425 10.022 5.901
27 HG13 ILE 5 HG13 ILE 5 7.566 8.748 6.344
28 HG21 ILE 5 HG21 ILE 5 4.053 9.395 5.158
29 HG22 ILE 5 HG22 ILE 5 4.663 8.238 3.960
30 HG23 ILE 5 HG23 ILE 5 3.531 7.699 5.193
31 HD11 ILE 5 HD11 ILE 5 8.222 9.510 4.207
32 HD12 ILE 5 HD12 ILE 5 7.491 7.904 3.982
33 HD13 ILE 5 HD13 ILE 5 6.582 9.378 3.563
34 H PHE 6 H PHE 6 5.327 5.564 7.860
35 HA PHE 6 HA PHE 6 2.642 4.678 7.660
36 HB2 PHE 6 HB2 PHE 6 4.644 3.224 7.607
37 HB3 PHE 6 HB3 PHE 6 4.927 3.534 9.315
38 HD1 PHE 6 HD2 PHE 6 2.575 1.980 6.870
39 HD2 PHE 6 HD1 PHE 6 3.698 2.322 11.021
40 HE1 PHE 6 HE2 PHE 6 0.953 0.189 7.467
41 HE2 PHE 6 HE1 PHE 6 2.100 0.521 11.599
42 HZ PHE 6 HZ PHE 6 0.703 -0.522 9.831
43 H ARG 7 H ARG 7 4.434 5.891 10.503
44 HA ARG 7 HA ARG 7 2.363 5.575 12.420
45 HB2 ARG 7 HB2 ARG 7 4.828 5.974 12.780
46 HB3 ARG 7 HB3 ARG 7 4.536 7.691 12.461
47 HG2 ARG 7 HG2 ARG 7 2.983 7.776 14.395
48 HG3 ARG 7 HG3 ARG 7 3.176 6.026 14.633
49 HD2 ARG 7 HD2 ARG 7 5.621 6.400 15.041
50 HD3 ARG 7 HD3 ARG 7 5.343 8.150 14.901
51 HE ARG 7 HE ARG 7 3.586 6.885 16.831
52 HH11 ARG 7 HH11 ARG 7 6.878 8.208 16.462
53 HH12 ARG 7 HH12 ARG 7 7.064 8.491 18.179
54 HH21 ARG 7 HH21 ARG 7 3.874 7.260 19.038
55 HH22 ARG 7 HH22 ARG 7 5.364 7.955 19.637
56 H THR 8 H THR 8 2.677 7.980 9.920
57 HA THR 8 HA THR 8 0.635 9.729 11.229
58 HB THR 8 HB THR 8 1.571 11.543 9.757
59 HG1 THR 8 HG1 THR 8 3.874 9.925 9.631
60 HG21 THR 8 HG21 THR 8 3.488 11.990 11.206
61 HG22 THR 8 HG22 THR 8 3.503 10.301 11.768
62 HG23 THR 8 HG23 THR 8 2.136 11.360 12.158
63 H ARG 9 H ARG 9 1.002 7.690 8.500
64 HA ARG 9 HA ARG 9 -1.510 8.813 7.298
65 HB2 ARG 9 HB2 ARG 9 0.754 7.353 5.902
66 HB3 ARG 9 HB3 ARG 9 -0.655 8.079 5.138
67 HG2 ARG 9 HG2 ARG 9 1.582 9.597 6.546
68 HG3 ARG 9 HG3 ARG 9 1.385 9.391 4.808
69 HD2 ARG 9 HD2 ARG 9 -0.742 10.634 4.862
70 HD3 ARG 9 HD3 ARG 9 -0.590 10.831 6.617
71 HE ARG 9 HE ARG 9 1.640 11.789 4.932
72 HH11 ARG 9 HH11 ARG 9 -1.218 12.710 6.858
73 HH12 ARG 9 HH12 ARG 9 -0.717 14.384 6.976
74 HH21 ARG 9 HH21 ARG 9 2.241 13.952 5.117
75 HH22 ARG 9 HH22 ARG 9 1.237 15.083 5.998
76 H CYS 10 H CYS 10 -0.149 5.871 8.603
77 HA CYS 10 HA CYS 10 -2.244 4.235 7.194
78 HB2 CYS 10 HB2 CYS 10 0.525 3.299 7.827
79 HB3 CYS 10 HB3 CYS 10 -0.637 2.554 6.739
80 H SER 11 H SER 11 -0.663 4.815 10.253
81 HA SER 11 HA SER 11 -1.089 2.202 11.441
82 HB2 SER 11 HB2 SER 11 -0.406 4.926 12.607
83 HB3 SER 11 HB3 SER 11 -0.481 3.434 13.555
84 HG SER 11 HG SER 11 1.147 3.887 11.274
85 H SER 12 H SER 12 -3.260 4.685 10.755
86 HA SER 12 HA SER 12 -5.229 4.332 12.820
87 HB2 SER 12 HB2 SER 12 -6.663 5.446 11.037
88 HB3 SER 12 HB3 SER 12 -5.211 6.326 11.521
89 HG SER 12 HG SER 12 -5.453 6.260 9.254
90 H CYS 13 H CYS 13 -4.352 2.340 10.087
91 HA CYS 13 HA CYS 13 -6.794 0.664 10.524
92 HB2 CYS 13 HB2 CYS 13 -5.686 1.496 7.841
93 HB3 CYS 13 HB3 CYS 13 -7.072 0.447 8.110
94 H HIS 14 H HIS 14 -3.370 0.620 9.976
95 HA HIS 14 HA HIS 14 -3.447 -2.269 9.195
96 HB2 HIS 14 2HB HIS 14 -1.780 0.037 8.171
97 HB3 HIS 14 3HB HIS 14 -1.229 -1.606 7.972
98 HD1 HIS 14 1HD HIS 14 -3.128 -3.318 6.637
99 HD2 HIS 14 2HD HIS 14 -2.986 0.849 6.192
100 HE1 HIS 14 1HE HIS 14 -4.142 -2.843 4.361
101 H THR 15 H THR 15 -1.135 -3.035 9.204
102 HA THR 15 HA THR 15 0.516 -2.479 11.567
103 HB THR 15 HB THR 15 0.645 -4.904 12.144
104 HG1 THR 15 HG1 THR 15 -1.741 -5.074 10.644
105 HG21 THR 15 HG21 THR 15 -2.182 -3.817 12.490
106 HG22 THR 15 HG22 THR 15 -0.796 -3.540 13.573
107 HG23 THR 15 HG23 THR 15 -1.463 -5.179 13.361
108 H VAL 16 H VAL 16 2.657 -3.741 11.306
109 HA VAL 16 HA VAL 16 3.053 -4.868 8.559
110 HB VAL 16 HB VAL 16 5.207 -3.182 9.861
111 HG11 VAL 16 HG11 VAL 16 5.969 -4.962 8.291
112 HG12 VAL 16 HG12 VAL 16 4.873 -4.352 7.042
113 HG13 VAL 16 HG13 VAL 16 6.228 -3.361 7.613
114 HG21 VAL 16 HG21 VAL 16 4.726 -1.578 7.975
115 HG22 VAL 16 HG22 VAL 16 3.201 -2.443 7.687
116 HG23 VAL 16 HG23 VAL 16 3.494 -1.614 9.233
117 H GLY 17 H GLY 17 3.072 -6.909 8.983
118 HA2 GLY 17 HA2 GLY 17 3.978 -8.956 9.629
119 HA3 GLY 17 HA3 GLY 17 5.263 -8.106 10.503
120 H ASN 18 H ASN 18 1.721 -8.513 10.754
121 HA ASN 18 HA ASN 18 1.928 -9.449 13.543
122 HB2 ASN 18 HB2 ASN 18 0.351 -6.948 12.843
123 HB3 ASN 18 HB3 ASN 18 0.232 -7.827 14.361
124 HD21 ASN 18 HD21 ASN 18 2.062 -7.800 15.848
125 HD22 ASN 18 HD22 ASN 18 3.253 -6.510 15.682
126 H THR 19 H THR 19 -1.065 -8.191 12.292
127 HA THR 19 HA THR 19 -3.052 -8.998 11.904
128 HB THR 19 HB THR 19 -1.825 -11.218 10.248
129 HG1 THR 19 HG1 THR 19 -0.793 -9.503 9.487
130 HG21 THR 19 HG21 THR 19 -4.359 -9.548 9.955
131 HG22 THR 19 HG22 THR 19 -4.254 -11.312 10.181
132 HG23 THR 19 HG23 THR 19 -3.693 -10.592 8.677
133 H GLU 20 H GLU 20 -1.111 -11.171 13.643
134 HA GLU 20 HA GLU 20 -2.925 -13.329 14.045
135 HB2 GLU 20 HB2 GLU 20 -1.287 -14.064 15.703
136 HB3 GLU 20 HB3 GLU 20 -0.511 -13.500 14.234
137 HG2 GLU 20 HG2 GLU 20 -0.040 -11.303 15.374
138 HG3 GLU 20 HG3 GLU 20 -0.738 -11.972 16.860
139 HA PRO 21 HA PRO 21 -5.920 -12.347 16.878
140 HB2 PRO 21 HB2 PRO 21 -4.762 -14.200 18.975
141 HB3 PRO 21 HB3 PRO 21 -6.466 -14.026 18.448
142 HG2 PRO 21 HG2 PRO 21 -4.977 -16.032 17.441
143 HG3 PRO 21 HG3 PRO 21 -6.001 -15.055 16.334
144 HD2 PRO 21 HD2 PRO 21 -3.028 -14.837 16.842
145 HD3 PRO 21 HD3 PRO 21 -3.918 -14.782 15.290
146 H GLY 22 H GLY 22 -6.465 -10.729 18.189
147 HA2 GLY 22 HA2 GLY 22 -6.336 -8.991 19.683
148 HA3 GLY 22 HA3 GLY 22 -4.936 -9.748 20.444
149 H GLN 23 H GLN 23 -4.115 -9.415 17.200
150 HA GLN 23 HA GLN 23 -3.471 -6.554 17.265
151 HB2 GLN 23 HB2 GLN 23 -1.066 -6.900 16.917
152 HB3 GLN 23 HB3 GLN 23 -1.628 -7.517 18.465
153 HG2 GLN 23 HG2 GLN 23 -1.669 -9.834 17.532
154 HG3 GLN 23 HG3 GLN 23 -1.055 -9.214 15.997
155 HE21 GLN 23 HE21 GLN 23 -0.316 -9.499 19.484
156 HE22 GLN 23 HE22 GLN 23 1.410 -9.659 19.263
157 HA PRO 24 HA PRO 24 -3.976 -7.334 12.753
158 HB2 PRO 24 HB2 PRO 24 -6.597 -7.421 12.232
159 HB3 PRO 24 HB3 PRO 24 -5.699 -8.928 12.589
160 HG2 PRO 24 HG2 PRO 24 -7.427 -7.300 14.474
161 HG3 PRO 24 HG3 PRO 24 -7.417 -9.071 14.229
162 HD2 PRO 24 HD2 PRO 24 -6.034 -7.738 16.242
163 HD3 PRO 24 HD3 PRO 24 -5.556 -9.335 15.585
164 H GLY 25 H GLY 25 -4.913 -5.522 11.501
165 HA2 GLY 25 HA2 GLY 25 -5.460 -3.072 13.120
166 HA3 GLY 25 HA3 GLY 25 -5.176 -3.157 11.384
167 H ILE 26 H ILE 26 -7.096 -1.924 11.113
168 HA ILE 26 HA ILE 26 -9.738 -3.176 11.173
169 HB ILE 26 HB ILE 26 -8.397 -0.971 9.586
170 HG12 ILE 26 HG12 ILE 26 -10.820 -0.925 11.444
171 HG13 ILE 26 HG13 ILE 26 -9.166 -0.705 12.016
172 HG21 ILE 26 HG21 ILE 26 -9.931 -1.962 7.953
173 HG22 ILE 26 HG22 ILE 26 -11.250 -1.921 9.139
174 HG23 ILE 26 HG23 ILE 26 -10.560 -0.422 8.502
175 HD11 ILE 26 HD11 ILE 26 -10.645 1.123 10.098
176 HD12 ILE 26 HD12 ILE 26 -10.117 1.463 11.759
177 HD13 ILE 26 HD13 ILE 26 -8.912 1.231 10.479
178 H GLY 27 H GLY 27 -6.832 -3.605 9.347
179 HA2 GLY 27 HA2 GLY 27 -7.964 -5.973 7.983
180 HA3 GLY 27 HA3 GLY 27 -7.315 -4.701 6.944
181 HA PRO 28 HA PRO 28 -4.120 -7.912 7.922
182 HB2 PRO 28 HB2 PRO 28 -3.427 -7.415 5.036
183 HB3 PRO 28 HB3 PRO 28 -3.560 -8.969 5.917
184 HG2 PRO 28 HG2 PRO 28 -5.522 -8.157 4.234
185 HG3 PRO 28 HG3 PRO 28 -5.940 -8.903 5.811
186 HD2 PRO 28 HD2 PRO 28 -5.833 -5.961 5.090
187 HD3 PRO 28 HD3 PRO 28 -7.104 -6.869 5.967
188 H ASP 29 H ASP 29 -1.785 -8.030 7.749
189 HA ASP 29 HA ASP 29 -0.498 -5.423 7.916
190 HB2 ASP 29 HB2 ASP 29 1.221 -6.389 9.060
191 HB3 ASP 29 HB3 ASP 29 -0.160 -7.323 9.584
192 H LEU 30 H LEU 30 1.494 -4.889 6.996
193 HA LEU 30 HA LEU 30 1.553 -5.498 4.114
194 HB2 LEU 30 HB2 LEU 30 2.994 -3.274 5.556
195 HB3 LEU 30 HB3 LEU 30 2.556 -3.357 3.856
196 HG LEU 30 HG LEU 30 0.649 -3.030 6.206
197 HD11 LEU 30 HD11 LEU 30 0.314 -0.761 5.282
198 HD12 LEU 30 HD12 LEU 30 1.501 -1.103 3.998
199 HD13 LEU 30 HD13 LEU 30 2.019 -1.035 5.693
200 HD21 LEU 30 HD21 LEU 30 -1.069 -2.542 4.433
201 HD22 LEU 30 HD22 LEU 30 -0.518 -4.212 4.390
202 HD23 LEU 30 HD23 LEU 30 0.092 -3.062 3.193
203 H LEU 31 H LEU 31 3.144 -7.176 6.292
204 HA LEU 31 HA LEU 31 5.938 -6.669 5.510
205 HB2 LEU 31 HB2 LEU 31 5.090 -7.297 7.765
206 HB3 LEU 31 HB3 LEU 31 4.728 -8.897 7.149
207 HG LEU 31 HG LEU 31 6.636 -8.972 8.528
208 HD11 LEU 31 HD11 LEU 31 8.283 -10.024 7.247
209 HD12 LEU 31 HD12 LEU 31 7.913 -9.091 5.802
210 HD13 LEU 31 HD13 LEU 31 6.765 -10.325 6.399
211 HD21 LEU 31 HD21 LEU 31 7.810 -6.727 6.858
212 HD22 LEU 31 HD22 LEU 31 8.684 -7.639 8.102
213 HD23 LEU 31 HD23 LEU 31 7.290 -6.686 8.564
214 H GLY 32 H GLY 32 7.111 -7.867 4.189
215 HA2 GLY 32 HA2 GLY 32 7.788 -9.461 2.621
216 HA3 GLY 32 HA3 GLY 32 6.553 -10.512 3.310
217 H VAL 33 H VAL 33 4.346 -8.612 2.371
218 HA VAL 33 HA VAL 33 3.747 -9.641 -0.149
219 HB VAL 33 HB VAL 33 2.173 -8.527 1.356
220 HG11 VAL 33 HG11 VAL 33 1.886 -6.119 1.421
221 HG12 VAL 33 HG12 VAL 33 3.501 -6.544 1.995
222 HG13 VAL 33 HG13 VAL 33 3.292 -5.873 0.366
223 HG21 VAL 33 HG21 VAL 33 0.751 -7.498 -0.298
224 HG22 VAL 33 HG22 VAL 33 2.128 -7.236 -1.390
225 HG23 VAL 33 HG23 VAL 33 1.582 -8.891 -1.009
226 H THR 34 H THR 34 5.814 -6.901 0.533
227 HA THR 34 HA THR 34 6.360 -5.779 -1.974
228 HB THR 34 HB THR 34 7.364 -4.825 -0.065
229 HG1 THR 34 HG1 THR 34 8.675 -4.819 -1.915
230 HG21 THR 34 HG21 THR 34 8.865 -7.426 0.479
231 HG22 THR 34 HG22 THR 34 7.566 -6.728 1.482
232 HG23 THR 34 HG23 THR 34 9.102 -5.885 1.315
233 H ARG 35 H ARG 35 7.512 -8.918 -0.760
234 HA ARG 35 HA ARG 35 8.999 -9.387 -3.293
235 HB2 ARG 35 HB2 ARG 35 10.308 -11.047 -2.117
236 HB3 ARG 35 HB3 ARG 35 10.433 -9.449 -1.380
237 HG2 ARG 35 HG2 ARG 35 8.974 -10.070 0.433
238 HG3 ARG 35 HG3 ARG 35 8.562 -11.620 -0.344
239 HD2 ARG 35 HD2 ARG 35 10.934 -12.319 -0.116
240 HD3 ARG 35 HD3 ARG 35 11.293 -10.775 0.693
241 HE ARG 35 HE ARG 35 9.081 -12.156 1.936
242 HH11 ARG 35 HH11 ARG 35 12.633 -12.135 1.772
243 HH12 ARG 35 HH12 ARG 35 12.816 -12.868 3.353
244 HH21 ARG 35 HH21 ARG 35 9.335 -13.092 3.959
245 HH22 ARG 35 HH22 ARG 35 10.933 -13.416 4.602
246 H GLN 36 H GLN 36 6.014 -9.915 -2.370
247 HA GLN 36 HA GLN 36 5.763 -12.560 -3.711
248 HB2 GLN 36 HB2 GLN 36 5.109 -11.789 -1.060
249 HB3 GLN 36 HB3 GLN 36 3.569 -11.856 -1.878
250 HG2 GLN 36 HG2 GLN 36 5.675 -14.050 -1.908
251 HG3 GLN 36 HG3 GLN 36 4.335 -13.975 -0.773
252 HE21 GLN 36 HE21 GLN 36 5.259 -15.279 -3.855
253 HE22 GLN 36 HE22 GLN 36 3.632 -15.710 -4.340
254 H ARG 37 H ARG 37 5.371 -9.498 -4.492
255 HA ARG 37 HA ARG 37 3.069 -9.962 -6.337
256 HB2 ARG 37 HB2 ARG 37 3.600 -7.441 -4.712
257 HB3 ARG 37 HB3 ARG 37 2.357 -7.602 -5.940
258 HG2 ARG 37 HG2 ARG 37 2.411 -9.152 -3.323
259 HG3 ARG 37 HG3 ARG 37 1.479 -7.690 -3.655
260 HD2 ARG 37 HD2 ARG 37 0.264 -8.873 -5.473
261 HD3 ARG 37 HD3 ARG 37 1.114 -10.366 -5.059
262 HE ARG 37 HE ARG 37 -1.042 -9.029 -3.580
263 HH11 ARG 37 HH11 ARG 37 1.483 -11.544 -3.366
264 HH12 ARG 37 HH12 ARG 37 0.734 -12.310 -1.982
265 HH21 ARG 37 HH21 ARG 37 -1.956 -10.050 -1.788
266 HH22 ARG 37 HH22 ARG 37 -1.202 -11.467 -1.095
267 H ASP 38 H ASP 38 3.066 -8.129 -8.012
268 HA ASP 38 HA ASP 38 5.658 -7.569 -9.239
269 HB2 ASP 38 HB2 ASP 38 3.708 -7.868 -10.602
270 HB3 ASP 38 HB3 ASP 38 2.810 -6.655 -9.733
271 H ALA 39 H ALA 39 7.063 -6.099 -8.611
272 HA ALA 39 HA ALA 39 6.664 -4.473 -6.329
273 HB1 ALA 39 HB1 ALA 39 8.994 -3.808 -6.774
274 HB2 ALA 39 HB2 ALA 39 8.790 -5.557 -7.019
275 HB3 ALA 39 HB3 ALA 39 8.877 -4.457 -8.418
276 H ASN 40 H ASN 40 5.758 -3.657 -9.527
277 HA ASN 40 HA ASN 40 5.872 -0.748 -8.833
278 HB2 ASN 40 HB2 ASN 40 7.084 -1.409 -10.902
279 HB3 ASN 40 HB3 ASN 40 5.547 -1.949 -11.602
280 HD21 ASN 40 HD21 ASN 40 4.142 -0.334 -12.437
281 HD22 ASN 40 HD22 ASN 40 4.509 1.392 -12.322
282 H TRP 41 H TRP 41 3.734 -3.362 -10.009
283 HA TRP 41 HA TRP 41 1.266 -1.938 -10.147
284 HB2 TRP 41 HB2 TRP 41 1.586 -4.238 -10.945
285 HB3 TRP 41 HB3 TRP 41 1.916 -4.773 -9.298
286 HD1 TRP 41 HD1 TRP 41 -0.959 -3.894 -11.602
287 HE1 TRP 41 HE1 TRP 41 -3.176 -4.730 -10.603
288 HE3 TRP 41 HE3 TRP 41 0.750 -5.386 -7.011
289 HZ2 TRP 41 HZ2 TRP 41 -4.096 -5.759 -8.071
290 HZ3 TRP 41 HZ3 TRP 41 -0.844 -6.270 -5.307
291 HH2 TRP 41 HH2 TRP 41 -3.244 -6.501 -5.856
292 H LEU 42 H LEU 42 2.747 -3.644 -7.335
293 HA LEU 42 HA LEU 42 0.669 -3.121 -5.491
294 HB2 LEU 42 HB2 LEU 42 2.499 -4.797 -5.254
295 HB3 LEU 42 HB3 LEU 42 3.668 -3.497 -5.063
296 HG LEU 42 HG LEU 42 2.524 -2.805 -2.938
297 HD11 LEU 42 HD11 LEU 42 0.263 -3.681 -3.318
298 HD12 LEU 42 HD12 LEU 42 0.960 -4.444 -1.881
299 HD13 LEU 42 HD13 LEU 42 0.889 -5.340 -3.412
300 HD21 LEU 42 HD21 LEU 42 4.476 -4.321 -2.943
301 HD22 LEU 42 HD22 LEU 42 3.389 -5.723 -3.032
302 HD23 LEU 42 HD23 LEU 42 3.368 -4.658 -1.607
303 H VAL 43 H VAL 43 3.454 -1.149 -6.364
304 HA VAL 43 HA VAL 43 3.057 0.880 -4.305
305 HB VAL 43 HB VAL 43 4.834 0.824 -6.778
306 HG11 VAL 43 HG11 VAL 43 6.109 2.623 -5.614
307 HG12 VAL 43 HG12 VAL 43 4.491 3.152 -6.075
308 HG13 VAL 43 HG13 VAL 43 4.825 2.708 -4.387
309 HG21 VAL 43 HG21 VAL 43 6.621 0.382 -5.059
310 HG22 VAL 43 HG22 VAL 43 5.352 0.198 -3.836
311 HG23 VAL 43 HG23 VAL 43 5.457 -0.932 -5.196
312 H ARG 44 H ARG 44 2.331 0.622 -7.803
313 HA ARG 44 HA ARG 44 1.233 3.246 -8.093
314 HB2 ARG 44 HB2 ARG 44 1.983 1.830 -9.956
315 HB3 ARG 44 HB3 ARG 44 0.633 0.714 -9.676
316 HG2 ARG 44 HG2 ARG 44 -0.985 2.481 -10.191
317 HG3 ARG 44 HG3 ARG 44 0.313 3.690 -10.304
318 HD2 ARG 44 HD2 ARG 44 1.263 2.564 -12.244
319 HD3 ARG 44 HD3 ARG 44 0.109 1.234 -12.084
320 HE ARG 44 HE ARG 44 -0.693 4.066 -12.664
321 HH11 ARG 44 HH11 ARG 44 -1.028 0.589 -13.425
322 HH12 ARG 44 HH12 ARG 44 -2.321 0.877 -14.570
323 HH21 ARG 44 HH21 ARG 44 -2.380 4.360 -14.143
324 HH22 ARG 44 HH22 ARG 44 -3.079 2.984 -14.971
325 H TRP 45 H TRP 45 -0.306 0.103 -7.330
326 HA TRP 45 HA TRP 45 -2.972 0.918 -6.885
327 HB2 TRP 45 HB2 TRP 45 -2.641 -1.375 -6.713
328 HB3 TRP 45 HB3 TRP 45 -1.178 -1.211 -5.760
329 HD1 TRP 45 HD1 TRP 45 -1.300 -1.350 -3.249
330 HE1 TRP 45 HE1 TRP 45 -3.156 -1.644 -1.493
331 HE3 TRP 45 HE3 TRP 45 -5.379 -0.509 -6.225
332 HZ2 TRP 45 HZ2 TRP 45 -6.036 -1.420 -1.373
333 HZ3 TRP 45 HZ3 TRP 45 -7.660 -0.457 -5.243
334 HH2 TRP 45 HH2 TRP 45 -8.000 -0.931 -2.829
335 H LEU 46 H LEU 46 -0.366 0.837 -4.359
336 HA LEU 46 HA LEU 46 -2.197 2.049 -2.516
337 HB2 LEU 46 HB2 LEU 46 -0.557 1.790 -0.864
338 HB3 LEU 46 HB3 LEU 46 -0.455 0.412 -1.945
339 HG LEU 46 HG LEU 46 1.507 1.689 -3.076
340 HD11 LEU 46 HD11 LEU 46 1.327 3.129 -0.413
341 HD12 LEU 46 HD12 LEU 46 1.403 3.849 -2.032
342 HD13 LEU 46 HD13 LEU 46 2.817 3.031 -1.381
343 HD21 LEU 46 HD21 LEU 46 1.800 0.584 -0.251
344 HD22 LEU 46 HD22 LEU 46 3.090 0.712 -1.469
345 HD23 LEU 46 HD23 LEU 46 1.737 -0.384 -1.747
346 H LYS 47 H LYS 47 -0.107 3.544 -4.799
347 HA LYS 47 HA LYS 47 -0.103 6.167 -3.483
348 HB2 LYS 47 HB2 LYS 47 1.796 5.391 -4.831
349 HB3 LYS 47 HB3 LYS 47 0.765 5.260 -6.265
350 HG2 LYS 47 HG2 LYS 47 0.390 7.634 -6.304
351 HG3 LYS 47 HG3 LYS 47 1.203 7.864 -4.743
352 HD2 LYS 47 HD2 LYS 47 3.335 7.064 -5.856
353 HD3 LYS 47 HD3 LYS 47 2.467 7.045 -7.400
354 HE2 LYS 47 HE2 LYS 47 2.856 9.477 -5.580
355 HE3 LYS 47 HE3 LYS 47 3.774 9.135 -7.054
356 HZ1 LYS 47 HZ1 LYS 47 1.653 9.270 -8.291
357 HZ2 LYS 47 HZ2 LYS 47 2.046 10.677 -7.556
358 HZ3 LYS 47 HZ3 LYS 47 0.857 9.695 -6.937
359 H VAL 48 H VAL 48 -2.213 4.572 -5.842
360 HA VAL 48 HA VAL 48 -3.918 7.000 -5.791
361 HB VAL 48 HB VAL 48 -2.203 6.913 -7.717
362 HG11 VAL 48 HG11 VAL 48 -4.294 5.405 -9.264
363 HG12 VAL 48 HG12 VAL 48 -2.658 5.886 -9.722
364 HG13 VAL 48 HG13 VAL 48 -2.896 4.596 -8.533
365 HG21 VAL 48 HG21 VAL 48 -3.618 8.694 -7.586
366 HG22 VAL 48 HG22 VAL 48 -3.911 8.061 -9.214
367 HG23 VAL 48 HG23 VAL 48 -5.069 7.740 -7.887
368 HA PRO 49 HA PRO 49 -5.729 2.642 -5.548
369 HB2 PRO 49 HB2 PRO 49 -6.870 2.597 -3.046
370 HB3 PRO 49 HB3 PRO 49 -5.142 2.293 -3.358
371 HG2 PRO 49 HG2 PRO 49 -6.430 4.945 -2.597
372 HG3 PRO 49 HG3 PRO 49 -5.040 4.136 -1.801
373 HD2 PRO 49 HD2 PRO 49 -4.640 6.057 -3.624
374 HD3 PRO 49 HD3 PRO 49 -3.649 4.567 -3.662
375 H ASP 50 H ASP 50 -7.460 5.685 -5.123
376 HA ASP 50 HA ASP 50 -10.098 4.356 -5.539
377 HB2 ASP 50 HB2 ASP 50 -9.827 6.223 -3.923
378 HB3 ASP 50 HB3 ASP 50 -9.408 7.292 -5.262
379 H GLN 51 H GLN 51 -7.667 6.214 -7.337
380 HA GLN 51 HA GLN 51 -9.276 6.651 -9.694
381 HB2 GLN 51 HB2 GLN 51 -7.301 8.039 -9.082
382 HB3 GLN 51 HB3 GLN 51 -6.277 6.612 -9.265
383 HG2 GLN 51 HG2 GLN 51 -6.033 8.090 -11.152
384 HG3 GLN 51 HG3 GLN 51 -6.705 6.549 -11.665
385 HE21 GLN 51 HE21 GLN 51 -9.047 6.483 -12.178
386 HE22 GLN 51 HE22 GLN 51 -9.857 7.984 -12.650
387 H MET 52 H MET 52 -6.898 4.138 -8.722
388 HA MET 52 HA MET 52 -6.641 2.693 -11.111
389 HB2 MET 52 HB2 MET 52 -6.679 1.922 -8.173
390 HB3 MET 52 HB3 MET 52 -6.357 0.717 -9.431
391 HG2 MET 52 HG2 MET 52 -4.810 3.301 -9.133
392 HG3 MET 52 HG3 MET 52 -4.341 1.820 -8.323
393 HE1 MET 52 HE1 MET 52 -4.546 -0.541 -10.146
394 HE2 MET 52 HE2 MET 52 -3.023 -0.490 -11.064
395 HE3 MET 52 HE3 MET 52 -3.032 -0.085 -9.332
396 H LEU 53 H LEU 53 -9.288 2.447 -8.712
397 HA LEU 53 HA LEU 53 -10.626 0.282 -10.072
398 HB2 LEU 53 HB2 LEU 53 -11.638 2.255 -7.992
399 HB3 LEU 53 HB3 LEU 53 -12.464 0.776 -8.477
400 HG LEU 53 HG LEU 53 -9.742 0.905 -7.098
401 HD11 LEU 53 HD11 LEU 53 -10.948 0.024 -5.144
402 HD12 LEU 53 HD12 LEU 53 -12.478 0.093 -6.044
403 HD13 LEU 53 HD13 LEU 53 -11.609 1.588 -5.641
404 HD21 LEU 53 HD21 LEU 53 -11.495 -1.478 -7.812
405 HD22 LEU 53 HD22 LEU 53 -10.066 -1.540 -6.756
406 HD23 LEU 53 HD23 LEU 53 -9.880 -1.119 -8.466
407 H ALA 54 H ALA 54 -10.729 3.775 -10.463
408 HA ALA 54 HA ALA 54 -13.156 3.774 -12.132
409 HB1 ALA 54 HB1 ALA 54 -12.748 5.648 -10.655
410 HB2 ALA 54 HB2 ALA 54 -11.160 5.939 -11.392
411 HB3 ALA 54 HB3 ALA 54 -12.633 6.173 -12.350
412 H GLU 55 H GLU 55 -9.631 3.909 -12.606
413 HA GLU 55 HA GLU 55 -9.667 4.138 -15.482
414 HB2 GLU 55 HB2 GLU 55 -7.761 4.634 -13.830
415 HB3 GLU 55 HB3 GLU 55 -7.556 2.890 -13.673
416 HG2 GLU 55 HG2 GLU 55 -5.929 3.609 -15.223
417 HG3 GLU 55 HG3 GLU 55 -7.144 2.819 -16.187
418 H LYS 56 H LYS 56 -10.429 1.601 -13.346
419 HA LYS 56 HA LYS 56 -10.807 -0.609 -13.439
420 HB2 LYS 56 HB2 LYS 56 -11.226 -0.309 -16.430
421 HB3 LYS 56 HB3 LYS 56 -11.785 -1.616 -15.383
422 HG2 LYS 56 HG2 LYS 56 -13.219 0.036 -14.140
423 HG3 LYS 56 HG3 LYS 56 -12.741 1.277 -15.319
424 HD2 LYS 56 HD2 LYS 56 -13.593 -0.223 -17.153
425 HD3 LYS 56 HD3 LYS 56 -14.216 -1.326 -15.922
426 HE2 LYS 56 HE2 LYS 56 -15.048 1.588 -16.340
427 HE3 LYS 56 HE3 LYS 56 -15.950 0.167 -16.865
428 HZ1 LYS 56 HZ1 LYS 56 -16.873 0.913 -14.817
429 HZ2 LYS 56 HZ2 LYS 56 -15.428 0.978 -14.072
430 HZ3 LYS 56 HZ3 LYS 56 -16.060 -0.484 -14.462
431 H ASP 57 H ASP 57 -8.373 -0.179 -13.007
432 HA ASP 57 HA ASP 57 -6.547 -1.608 -14.842
433 HB2 ASP 57 HB2 ASP 57 -6.156 0.367 -12.706
434 HB3 ASP 57 HB3 ASP 57 -5.209 -1.084 -12.457
435 HA PRO 58 HA PRO 58 -8.383 -4.896 -12.681
436 HB2 PRO 58 HB2 PRO 58 -7.493 -7.006 -14.106
437 HB3 PRO 58 HB3 PRO 58 -8.528 -5.678 -14.767
438 HG2 PRO 58 HG2 PRO 58 -5.488 -5.787 -14.958
439 HG3 PRO 58 HG3 PRO 58 -6.660 -5.751 -16.322
440 HD2 PRO 58 HD2 PRO 58 -5.542 -3.533 -15.265
441 HD3 PRO 58 HD3 PRO 58 -7.272 -3.545 -15.734
442 H LEU 59 H LEU 59 -7.593 -7.227 -11.850
443 HA LEU 59 HA LEU 59 -7.087 -8.123 -9.972
444 HB2 LEU 59 HB2 LEU 59 -4.945 -8.283 -11.201
445 HB3 LEU 59 HB3 LEU 59 -4.336 -6.912 -10.284
446 HG LEU 59 HG LEU 59 -4.459 -8.200 -8.206
447 HD11 LEU 59 HD11 LEU 59 -4.972 -10.663 -8.301
448 HD12 LEU 59 HD12 LEU 59 -5.637 -10.425 -9.935
449 HD13 LEU 59 HD13 LEU 59 -6.390 -9.639 -8.524
450 HD21 LEU 59 HD21 LEU 59 -2.506 -8.361 -9.713
451 HD22 LEU 59 HD22 LEU 59 -3.271 -9.717 -10.562
452 HD23 LEU 59 HD23 LEU 59 -2.759 -9.904 -8.862
453 H ALA 60 H ALA 60 -6.401 -4.572 -9.820
454 HA ALA 60 HA ALA 60 -6.649 -4.476 -6.931
455 HB1 ALA 60 HB1 ALA 60 -7.206 -2.148 -7.276
456 HB2 ALA 60 HB2 ALA 60 -5.809 -2.598 -8.288
457 HB3 ALA 60 HB3 ALA 60 -7.437 -2.402 -9.018
458 H MET 61 H MET 61 -8.973 -4.303 -9.571
459 HA MET 61 HA MET 61 -11.419 -3.904 -8.283
460 HB2 MET 61 HB2 MET 61 -10.968 -5.912 -10.536
461 HB3 MET 61 HB3 MET 61 -12.402 -4.932 -10.260
462 HG2 MET 61 HG2 MET 61 -9.670 -3.912 -11.172
463 HG3 MET 61 HG3 MET 61 -11.026 -4.243 -12.219
464 HE1 MET 61 HE1 MET 61 -12.556 -2.623 -13.018
465 HE2 MET 61 HE2 MET 61 -13.504 -3.057 -11.577
466 HE3 MET 61 HE3 MET 61 -13.317 -1.345 -12.032
467 H LEU 62 H LEU 62 -9.523 -6.907 -8.441
468 HA LEU 62 HA LEU 62 -11.578 -8.518 -7.168
469 HB2 LEU 62 HB2 LEU 62 -9.934 -9.240 -8.988
470 HB3 LEU 62 HB3 LEU 62 -8.657 -9.004 -7.785
471 HG LEU 62 HG LEU 62 -9.631 -10.720 -6.368
472 HD11 LEU 62 HD11 LEU 62 -11.706 -11.018 -8.585
473 HD12 LEU 62 HD12 LEU 62 -12.013 -10.637 -6.872
474 HD13 LEU 62 HD13 LEU 62 -11.437 -12.239 -7.330
475 HD21 LEU 62 HD21 LEU 62 -9.284 -11.642 -9.251
476 HD22 LEU 62 HD22 LEU 62 -9.164 -12.686 -7.815
477 HD23 LEU 62 HD23 LEU 62 -7.982 -11.395 -8.068
478 H LEU 63 H LEU 63 -8.384 -6.975 -6.315
479 HA LEU 63 HA LEU 63 -8.023 -8.332 -3.841
480 HB2 LEU 63 HB2 LEU 63 -6.296 -7.176 -5.089
481 HB3 LEU 63 HB3 LEU 63 -7.104 -5.623 -4.931
482 HG LEU 63 HG LEU 63 -6.281 -7.111 -2.431
483 HD11 LEU 63 HD11 LEU 63 -4.063 -6.037 -2.556
484 HD12 LEU 63 HD12 LEU 63 -4.473 -5.396 -4.172
485 HD13 LEU 63 HD13 LEU 63 -4.323 -7.150 -3.899
486 HD21 LEU 63 HD21 LEU 63 -5.892 -4.812 -1.576
487 HD22 LEU 63 HD22 LEU 63 -7.544 -4.955 -2.160
488 HD23 LEU 63 HD23 LEU 63 -6.337 -4.135 -3.160
489 H PHE 64 H PHE 64 -9.724 -5.369 -4.715
490 HA PHE 64 HA PHE 64 -10.146 -4.715 -1.898
491 HB2 PHE 64 HB2 PHE 64 -10.603 -2.671 -2.478
492 HB3 PHE 64 HB3 PHE 64 -9.921 -3.119 -4.021
493 HD1 PHE 64 HD1 PHE 64 -11.613 -3.990 -5.835
494 HD2 PHE 64 HD2 PHE 64 -12.707 -1.680 -2.370
495 HE1 PHE 64 HE1 PHE 64 -13.671 -3.219 -7.003
496 HE2 PHE 64 HE2 PHE 64 -14.741 -0.870 -3.556
497 HZ PHE 64 HZ PHE 64 -15.207 -1.643 -5.866
498 H GLU 65 H GLU 65 -12.366 -6.084 -4.409
499 HA GLU 65 HA GLU 65 -14.504 -6.264 -2.486
500 HB2 GLU 65 HB2 GLU 65 -15.678 -7.655 -3.939
501 HB3 GLU 65 HB3 GLU 65 -14.900 -6.406 -4.903
502 HG2 GLU 65 HG2 GLU 65 -13.253 -8.002 -5.728
503 HG3 GLU 65 HG3 GLU 65 -13.822 -9.250 -4.612
504 H GLN 66 H GLN 66 -11.702 -8.390 -2.942
505 HA GLN 66 HA GLN 66 -12.859 -10.479 -1.270
506 HB2 GLN 66 HB2 GLN 66 -10.059 -10.023 -2.386
507 HB3 GLN 66 HB3 GLN 66 -10.479 -11.393 -1.356
508 HG2 GLN 66 HG2 GLN 66 -12.215 -12.107 -2.991
509 HG3 GLN 66 HG3 GLN 66 -11.731 -10.806 -4.073
510 HE21 GLN 66 HE21 GLN 66 -11.593 -13.359 -5.139
511 HE22 GLN 66 HE22 GLN 66 -9.902 -13.870 -5.174
512 H TYR 67 H TYR 67 -10.826 -7.669 -0.565
513 HA TYR 67 HA TYR 67 -10.723 -8.470 2.285
514 HB2 TYR 67 HB2 TYR 67 -9.570 -6.091 0.839
515 HB3 TYR 67 HB3 TYR 67 -9.436 -6.376 2.572
516 HD1 TYR 67 HD1 TYR 67 -8.689 -9.077 3.032
517 HD2 TYR 67 HD2 TYR 67 -7.507 -6.511 -0.228
518 HE1 TYR 67 HE1 TYR 67 -6.619 -10.410 2.732
519 HE2 TYR 67 HE2 TYR 67 -5.378 -7.839 -0.479
520 HH TYR 67 HH TYR 67 -4.702 -10.706 1.505
521 H ASN 68 H ASN 68 -13.269 -8.296 1.292
522 HA ASN 68 HA ASN 68 -15.317 -7.664 1.804
523 HB2 ASN 68 HB2 ASN 68 -14.262 -8.017 4.119
524 HB3 ASN 68 HB3 ASN 68 -14.293 -6.263 4.275
525 HD21 ASN 68 HD21 ASN 68 -15.706 -6.694 6.168
526 HD22 ASN 68 HD22 ASN 68 -17.379 -7.159 5.896
527 H ARG 69 H ARG 69 -13.922 -5.859 0.035
528 HA ARG 69 HA ARG 69 -14.158 -3.875 -1.019
529 HB2 ARG 69 HB2 ARG 69 -16.286 -5.374 -1.266
530 HB3 ARG 69 HB3 ARG 69 -17.102 -4.071 -0.403
531 HG2 ARG 69 HG2 ARG 69 -16.252 -2.472 -2.173
532 HG3 ARG 69 HG3 ARG 69 -15.505 -3.854 -3.000
533 HD2 ARG 69 HD2 ARG 69 -17.751 -4.919 -3.197
534 HD3 ARG 69 HD3 ARG 69 -18.484 -3.490 -2.455
535 HE ARG 69 HE ARG 69 -17.536 -3.817 -5.187
536 HH11 ARG 69 HH11 ARG 69 -18.238 -1.343 -2.708
537 HH12 ARG 69 HH12 ARG 69 -18.508 -0.090 -3.900
538 HH21 ARG 69 HH21 ARG 69 -17.903 -2.166 -6.678
539 HH22 ARG 69 HH22 ARG 69 -18.315 -0.553 -6.138
540 H LEU 70 H LEU 70 -13.219 -3.173 1.431
541 HA LEU 70 HA LEU 70 -14.845 -1.093 2.678
542 HB2 LEU 70 HB2 LEU 70 -12.421 -2.600 3.262
543 HB3 LEU 70 HB3 LEU 70 -12.106 -0.888 3.449
544 HG LEU 70 HG LEU 70 -14.108 -0.712 4.964
545 HD11 LEU 70 HD11 LEU 70 -15.365 -2.723 4.200
546 HD12 LEU 70 HD12 LEU 70 -15.022 -2.803 5.932
547 HD13 LEU 70 HD13 LEU 70 -14.056 -3.763 4.790
548 HD21 LEU 70 HD21 LEU 70 -11.979 -2.729 5.784
549 HD22 LEU 70 HD22 LEU 70 -13.028 -1.810 6.886
550 HD23 LEU 70 HD23 LEU 70 -11.852 -0.953 5.882
551 H ALA 71 H ALA 71 -12.309 -1.145 0.287
552 HA ALA 71 HA ALA 71 -11.493 0.243 -1.207
553 HB1 ALA 71 HB1 ALA 71 -13.799 2.131 -0.682
554 HB2 ALA 71 HB2 ALA 71 -12.747 2.080 -2.110
555 HB3 ALA 71 HB3 ALA 71 -13.843 0.730 -1.774
556 H MET 72 H MET 72 -9.841 1.683 -1.355
557 HA MET 72 HA MET 72 -9.126 3.031 1.213
558 HB2 MET 72 HB2 MET 72 -7.820 1.036 0.707
559 HB3 MET 72 HB3 MET 72 -7.299 1.739 -0.830
560 HG2 MET 72 HG2 MET 72 -6.110 3.522 0.351
561 HG3 MET 72 HG3 MET 72 -6.829 3.023 1.886
562 HE1 MET 72 HE1 MET 72 -3.940 2.442 -0.681
563 HE2 MET 72 HE2 MET 72 -3.421 0.785 -0.317
564 HE3 MET 72 HE3 MET 72 -5.007 1.070 -1.069
565 HA PRO 73 HA PRO 73 -8.726 6.679 -1.432
566 HB2 PRO 73 HB2 PRO 73 -8.445 8.596 0.434
567 HB3 PRO 73 HB3 PRO 73 -9.967 7.675 0.305
568 HG2 PRO 73 HG2 PRO 73 -7.667 7.193 2.222
569 HG3 PRO 73 HG3 PRO 73 -9.416 7.301 2.598
570 HD2 PRO 73 HD2 PRO 73 -8.064 4.921 2.180
571 HD3 PRO 73 HD3 PRO 73 -9.801 5.137 1.819
572 H ASN 74 H ASN 74 -7.126 8.171 -2.076
573 HA ASN 74 HA ASN 74 -4.331 7.947 -1.063
574 HB2 ASN 74 HB2 ASN 74 -4.730 8.329 -3.490
575 HB3 ASN 74 HB3 ASN 74 -5.660 9.774 -3.112
576 HD21 ASN 74 HD21 ASN 74 -3.960 10.431 -4.782
577 HD22 ASN 74 HD22 ASN 74 -2.453 11.086 -4.103
578 H MET 75 H MET 75 -3.434 9.527 0.151
579 HA MET 75 HA MET 75 -5.275 11.271 1.718
580 HB2 MET 75 HB2 MET 75 -2.422 10.621 2.447
581 HB3 MET 75 HB3 MET 75 -3.716 11.255 3.468
582 HG2 MET 75 HG2 MET 75 -3.412 8.460 2.312
583 HG3 MET 75 HG3 MET 75 -3.178 8.927 3.982
584 HE1 MET 75 HE1 MET 75 -5.333 10.251 5.285
585 HE2 MET 75 HE2 MET 75 -6.601 9.031 5.542
586 HE3 MET 75 HE3 MET 75 -4.893 8.594 5.763
587 H ARG 76 H ARG 76 -1.854 11.803 1.135
588 HA ARG 76 HA ARG 76 -2.207 13.840 -0.975
589 HB2 ARG 76 HB2 ARG 76 -0.881 14.398 1.718
590 HB3 ARG 76 HB3 ARG 76 -0.717 15.441 0.312
591 HG2 ARG 76 HG2 ARG 76 -3.326 14.880 1.770
592 HG3 ARG 76 HG3 ARG 76 -2.327 16.311 1.948
593 HD2 ARG 76 HD2 ARG 76 -3.693 15.460 -0.637
594 HD3 ARG 76 HD3 ARG 76 -4.274 16.695 0.477
595 HE ARG 76 HE ARG 76 -2.096 17.901 0.048
596 HH11 ARG 76 HH11 ARG 76 -3.506 15.817 -2.491
597 HH12 ARG 76 HH12 ARG 76 -2.718 16.699 -3.781
598 HH21 ARG 76 HH21 ARG 76 -1.111 18.999 -1.653
599 HH22 ARG 76 HH22 ARG 76 -1.375 18.497 -3.308
600 H LEU 77 H LEU 77 -1.229 11.239 -1.197
601 HA LEU 77 HA LEU 77 1.458 10.867 -0.342
602 HB2 LEU 77 HB2 LEU 77 -0.275 9.319 -2.306
603 HB3 LEU 77 HB3 LEU 77 1.270 8.753 -1.702
604 HG LEU 77 HG LEU 77 -1.145 9.309 0.073
605 HD11 LEU 77 HD11 LEU 77 -1.350 6.862 0.194
606 HD12 LEU 77 HD12 LEU 77 0.008 6.668 -0.933
607 HD13 LEU 77 HD13 LEU 77 -1.505 7.411 -1.481
608 HD21 LEU 77 HD21 LEU 77 0.971 9.491 1.322
609 HD22 LEU 77 HD22 LEU 77 1.515 7.931 0.658
610 HD23 LEU 77 HD23 LEU 77 0.120 8.014 1.758
611 H GLY 78 H GLY 78 2.782 12.491 -1.160
612 HA2 GLY 78 HA2 GLY 78 3.383 12.812 -3.980
613 HA3 GLY 78 HA3 GLY 78 4.398 13.320 -2.626
614 H ASP 79 H ASP 79 5.155 11.988 -5.146
615 HA ASP 79 HA ASP 79 5.668 9.240 -4.932
616 HB2 ASP 79 HB2 ASP 79 7.261 9.565 -6.701
617 HB3 ASP 79 HB3 ASP 79 5.868 10.605 -6.979
618 H ALA 80 H ALA 80 7.616 11.893 -3.529
619 HA ALA 80 HA ALA 80 9.806 10.196 -2.708
620 HB1 ALA 80 HB1 ALA 80 10.421 12.218 -1.377
621 HB2 ALA 80 HB2 ALA 80 10.081 12.580 -3.082
622 HB3 ALA 80 HB3 ALA 80 8.876 12.960 -1.835
623 H GLU 81 H GLU 81 6.692 11.003 -1.189
624 HA GLU 81 HA GLU 81 7.424 9.975 1.462
625 HB2 GLU 81 HB2 GLU 81 4.648 10.363 0.261
626 HB3 GLU 81 HB3 GLU 81 5.030 10.126 1.956
627 HG2 GLU 81 HG2 GLU 81 5.755 12.556 0.274
628 HG3 GLU 81 HG3 GLU 81 4.450 12.449 1.443
629 H VAL 82 H VAL 82 5.685 8.794 -1.413
630 HA VAL 82 HA VAL 82 5.082 6.161 -0.446
631 HB VAL 82 HB VAL 82 5.497 7.205 -3.277
632 HG11 VAL 82 HG11 VAL 82 4.331 4.547 -2.342
633 HG12 VAL 82 HG12 VAL 82 4.207 5.191 -3.992
634 HG13 VAL 82 HG13 VAL 82 5.788 4.776 -3.332
635 HG21 VAL 82 HG21 VAL 82 2.976 6.614 -1.655
636 HG22 VAL 82 HG22 VAL 82 3.596 8.229 -2.062
637 HG23 VAL 82 HG23 VAL 82 3.027 7.163 -3.343
638 H SER 83 H SER 83 7.898 7.334 -2.377
639 HA SER 83 HA SER 83 9.239 4.860 -2.527
640 HB2 SER 83 HB2 SER 83 9.691 7.012 -3.767
641 HB3 SER 83 HB3 SER 83 10.503 7.633 -2.319
642 HG SER 83 HG SER 83 11.806 6.620 -4.007
643 H ALA 84 H ALA 84 9.345 7.236 0.180
644 HA ALA 84 HA ALA 84 11.330 5.752 1.690
645 HB1 ALA 84 HB1 ALA 84 10.585 7.247 3.538
646 HB2 ALA 84 HB2 ALA 84 10.998 8.124 2.054
647 HB3 ALA 84 HB3 ALA 84 9.296 7.870 2.480
648 H LEU 85 H LEU 85 7.712 5.729 1.703
649 HA LEU 85 HA LEU 85 7.387 3.762 3.774
650 HB2 LEU 85 HB2 LEU 85 5.751 4.531 1.335
651 HB3 LEU 85 HB3 LEU 85 5.268 3.195 2.354
652 HG LEU 85 HG LEU 85 5.692 5.995 3.460
653 HD11 LEU 85 HD11 LEU 85 3.194 6.172 3.328
654 HD12 LEU 85 HD12 LEU 85 3.161 4.661 2.395
655 HD13 LEU 85 HD13 LEU 85 3.965 6.107 1.738
656 HD21 LEU 85 HD21 LEU 85 5.667 4.179 5.150
657 HD22 LEU 85 HD22 LEU 85 4.152 3.548 4.469
658 HD23 LEU 85 HD23 LEU 85 4.186 5.138 5.251
659 H ILE 86 H ILE 86 8.204 3.391 0.332
660 HA ILE 86 HA ILE 86 7.800 0.518 0.295
661 HB ILE 86 HB ILE 86 9.532 2.200 -1.573
662 HG12 ILE 86 HG12 ILE 86 7.547 3.101 -2.208
663 HG13 ILE 86 HG13 ILE 86 7.500 1.690 -3.190
664 HG21 ILE 86 HG21 ILE 86 9.303 0.352 -3.159
665 HG22 ILE 86 HG22 ILE 86 10.093 -0.193 -1.688
666 HG23 ILE 86 HG23 ILE 86 8.381 -0.588 -1.963
667 HD11 ILE 86 HD11 ILE 86 5.327 2.009 -2.219
668 HD12 ILE 86 HD12 ILE 86 6.033 0.562 -1.464
669 HD13 ILE 86 HD13 ILE 86 5.975 2.117 -0.589
670 H SER 87 H SER 87 10.747 2.570 0.722
671 HA SER 87 HA SER 87 12.522 0.365 1.193
672 HB2 SER 87 HB2 SER 87 12.613 3.226 2.173
673 HB3 SER 87 HB3 SER 87 13.945 2.057 2.342
674 HG SER 87 HG SER 87 13.845 1.820 0.004
675 H TYR 88 H TYR 88 10.269 2.089 3.441
676 HA TYR 88 HA TYR 88 11.264 0.702 5.789
677 HB2 TYR 88 HB2 TYR 88 10.008 2.582 6.192
678 HB3 TYR 88 HB3 TYR 88 8.739 2.142 5.055
679 HD1 TYR 88 HD1 TYR 88 10.254 0.785 8.254
680 HD2 TYR 88 HD2 TYR 88 6.694 1.536 5.925
681 HE1 TYR 88 HE1 TYR 88 8.842 -0.023 10.134
682 HE2 TYR 88 HE2 TYR 88 5.297 0.717 7.822
683 HH TYR 88 HH TYR 88 6.694 -0.500 10.869
684 H LEU 89 H LEU 89 8.590 -0.205 3.504
685 HA LEU 89 HA LEU 89 8.061 -2.704 4.853
686 HB2 LEU 89 HB2 LEU 89 7.606 -1.960 1.932
687 HB3 LEU 89 HB3 LEU 89 6.930 -3.360 2.761
688 HG LEU 89 HG LEU 89 6.252 -0.439 3.264
689 HD11 LEU 89 HD11 LEU 89 5.212 -1.504 1.295
690 HD12 LEU 89 HD12 LEU 89 4.020 -1.126 2.552
691 HD13 LEU 89 HD13 LEU 89 4.579 -2.802 2.338
692 HD21 LEU 89 HD21 LEU 89 5.325 -2.886 4.792
693 HD22 LEU 89 HD22 LEU 89 4.577 -1.268 4.887
694 HD23 LEU 89 HD23 LEU 89 6.237 -1.497 5.435
695 H GLU 90 H GLU 90 10.307 -1.891 2.215
696 HA GLU 90 HA GLU 90 11.180 -4.525 1.600
697 HB2 GLU 90 HB2 GLU 90 11.529 -2.531 0.193
698 HB3 GLU 90 HB3 GLU 90 12.638 -1.860 1.398
699 HG2 GLU 90 HG2 GLU 90 14.205 -3.726 1.020
700 HG3 GLU 90 HG3 GLU 90 13.079 -4.453 -0.131
701 H GLU 91 H GLU 91 12.443 -2.187 4.027
702 HA GLU 91 HA GLU 91 14.570 -4.063 4.813
703 HB2 GLU 91 HB2 GLU 91 13.885 -1.228 5.664
704 HB3 GLU 91 HB3 GLU 91 15.228 -2.158 6.311
705 HG2 GLU 91 HG2 GLU 91 14.860 -1.374 3.383
706 HG3 GLU 91 HG3 GLU 91 16.006 -0.669 4.522
707 H GLU 92 H GLU 92 11.493 -2.980 6.304
708 HA GLU 92 HA GLU 92 11.988 -4.283 8.833
709 HB2 GLU 92 HB2 GLU 92 10.142 -2.614 8.266
710 HB3 GLU 92 HB3 GLU 92 9.341 -3.897 7.365
711 HG2 GLU 92 HG2 GLU 92 8.254 -3.818 9.452
712 HG3 GLU 92 HG3 GLU 92 9.293 -5.236 9.557
713 H THR 93 H THR 93 10.712 -5.432 5.718
714 HA THR 93 HA THR 93 9.971 -8.085 6.392
715 HB THR 93 HB THR 93 11.027 -6.899 3.809
716 HG1 THR 93 HG1 THR 93 9.141 -6.064 4.119
717 HG21 THR 93 HG21 THR 93 9.954 -8.796 2.652
718 HG22 THR 93 HG22 THR 93 9.693 -9.608 4.220
719 HG23 THR 93 HG23 THR 93 11.336 -9.317 3.609
720 H ALA 94 H ALA 94 13.254 -6.825 5.724
721 HA ALA 94 HA ALA 94 14.415 -9.438 5.410
722 HB1 ALA 94 HB1 ALA 94 15.415 -7.452 4.452
723 HB2 ALA 94 HB2 ALA 94 15.642 -6.731 6.063
724 HB3 ALA 94 HB3 ALA 94 16.548 -8.188 5.597
725 H ARG 95 H ARG 95 13.755 -7.516 8.288
726 HA ARG 95 HA ARG 95 15.360 -9.363 9.995
727 HB2 ARG 95 HB2 ARG 95 14.454 -6.527 10.247
728 HB3 ARG 95 HB3 ARG 95 14.409 -7.484 11.724
729 HG2 ARG 95 HG2 ARG 95 16.548 -6.408 11.623
730 HG3 ARG 95 HG3 ARG 95 16.764 -8.147 11.447
731 HD2 ARG 95 HD2 ARG 95 18.244 -7.014 9.920
732 HD3 ARG 95 HD3 ARG 95 17.009 -7.834 8.966
733 HE ARG 95 HE ARG 95 16.038 -5.251 9.430
734 HH11 ARG 95 HH11 ARG 95 18.863 -6.644 7.768
735 HH12 ARG 95 HH12 ARG 95 19.049 -5.257 6.715
736 HH21 ARG 95 HH21 ARG 95 16.320 -3.492 8.068
737 HH22 ARG 95 HH22 ARG 95 17.613 -3.474 6.888
738 H LEU 96 H LEU 96 12.012 -8.790 9.199
739 HA LEU 96 HA LEU 96 11.040 -10.121 11.624
740 HB2 LEU 96 HB2 LEU 96 9.955 -8.195 10.132
741 HB3 LEU 96 HB3 LEU 96 9.273 -9.520 9.278
742 HG LEU 96 HG LEU 96 7.696 -8.649 10.787
743 HD11 LEU 96 HD11 LEU 96 8.830 -11.171 11.997
744 HD12 LEU 96 HD12 LEU 96 7.762 -11.080 10.581
745 HD13 LEU 96 HD13 LEU 96 7.165 -10.566 12.181
746 HD21 LEU 96 HD21 LEU 96 9.324 -7.527 12.223
747 HD22 LEU 96 HD22 LEU 96 9.734 -9.076 12.989
748 HD23 LEU 96 HD23 LEU 96 8.098 -8.409 13.162
749 H GLN 97 H GLN 97 12.710 -11.804 10.869
750 HA GLN 97 HA GLN 97 11.398 -14.007 9.353
751 HB2 GLN 97 HB2 GLN 97 14.253 -13.014 8.929
752 HB3 GLN 97 HB3 GLN 97 13.480 -14.409 8.166
753 HG2 GLN 97 HG2 GLN 97 11.697 -12.673 7.329
754 HG3 GLN 97 HG3 GLN 97 12.926 -11.469 7.741
755 HE21 GLN 97 HE21 GLN 97 15.050 -11.627 6.509
756 HE22 GLN 97 HE22 GLN 97 14.990 -12.423 4.927
757 H THR 98 H THR 98 10.968 -14.750 11.522
758 HA THR 98 HA THR 98 13.190 -16.483 12.442
759 HB THR 98 HB THR 98 11.400 -15.320 14.575
760 HG1 THR 98 HG1 THR 98 12.311 -13.525 13.817
761 HG21 THR 98 HG21 THR 98 14.277 -16.350 14.581
762 HG22 THR 98 HG22 THR 98 12.867 -17.351 14.953
763 HG23 THR 98 HG23 THR 98 13.265 -15.986 15.999
764 HA PRO 99 HA PRO 99 9.283 -18.981 11.925
765 HB2 PRO 99 HB2 PRO 99 9.922 -20.476 9.771
766 HB3 PRO 99 HB3 PRO 99 9.237 -18.838 9.608
767 HG2 PRO 99 HG2 PRO 99 12.150 -19.647 9.417
768 HG3 PRO 99 HG3 PRO 99 11.214 -18.577 8.327
769 HD2 PRO 99 HD2 PRO 99 12.816 -17.643 10.370
770 HD3 PRO 99 HD3 PRO 99 11.350 -16.792 9.799
771 H VAL 100 H VAL 100 9.757 -20.067 13.817
772 HA VAL 100 HA VAL 100 11.874 -22.149 13.825
773 HB VAL 100 HB VAL 100 12.886 -19.925 14.422
774 HG11 VAL 100 HG11 VAL 100 11.255 -20.168 16.983
775 HG12 VAL 100 HG12 VAL 100 12.529 -18.991 16.654
776 HG13 VAL 100 HG13 VAL 100 11.021 -18.953 15.721
777 HG21 VAL 100 HG21 VAL 100 13.026 -21.983 16.642
778 HG22 VAL 100 HG22 VAL 100 13.919 -22.051 15.105
779 HG23 VAL 100 HG23 VAL 100 14.224 -20.739 16.251
780 H THR 101 H THR 101 11.617 -23.795 15.343
781 HA THR 101 HA THR 101 8.929 -24.060 16.464
782 HB THR 101 HB THR 101 11.256 -25.960 16.876
783 HG1 THR 101 HG1 THR 101 10.121 -27.088 15.135
784 HG21 THR 101 HG21 THR 101 8.233 -26.378 16.898
785 HG22 THR 101 HG22 THR 101 9.258 -26.290 18.345
786 HG23 THR 101 HG23 THR 101 9.477 -27.614 17.199
787 H ASN 102 H ASN 102 12.241 -23.890 17.753
788 HA ASN 102 HA ASN 102 13.175 -23.295 19.691
789 HB2 ASN 102 HB2 ASN 102 12.242 -21.182 18.777
790 HB3 ASN 102 HB3 ASN 102 10.871 -21.324 19.852
791 HD21 ASN 102 HD21 ASN 102 11.957 -19.026 20.073
792 HD22 ASN 102 HD22 ASN 102 13.064 -18.885 21.420
793 H ARG 103 H ARG 103 13.088 -23.085 22.034
794 HA ARG 103 HA ARG 103 10.996 -24.751 23.372
795 HB2 ARG 103 HB2 ARG 103 12.684 -26.015 24.540
796 HB3 ARG 103 HB3 ARG 103 12.935 -26.130 22.800
797 HG2 ARG 103 HG2 ARG 103 14.717 -24.261 23.075
798 HG3 ARG 103 HG3 ARG 103 14.530 -24.488 24.819
799 HD2 ARG 103 HD2 ARG 103 16.413 -25.796 24.126
800 HD3 ARG 103 HD3 ARG 103 15.102 -26.933 24.482
801 HE ARG 103 HE ARG 103 15.226 -26.100 21.691
802 HH11 ARG 103 HH11 ARG 103 16.528 -28.475 24.012
803 HH12 ARG 103 HH12 ARG 103 16.947 -29.621 22.756
804 HH21 ARG 103 HH21 ARG 103 15.786 -27.610 20.104
805 HH22 ARG 103 HH22 ARG 103 16.523 -29.132 20.548
806 H GLY 104 H GLY 104 12.614 -21.822 23.397
807 HA2 GLY 104 HA2 GLY 104 11.877 -20.110 24.966
808 HA3 GLY 104 HA3 GLY 104 11.981 -21.278 26.283
809 H ILE 105 H ILE 105 13.226 -18.861 26.526
810 HA ILE 105 HA ILE 105 16.131 -19.407 26.139
811 HB ILE 105 HB ILE 105 16.614 -17.183 25.687
812 HG12 ILE 105 HG12 ILE 105 13.662 -16.689 25.115
813 HG13 ILE 105 HG13 ILE 105 14.441 -16.201 26.638
814 HG21 ILE 105 HG21 ILE 105 16.035 -17.351 23.313
815 HG22 ILE 105 HG22 ILE 105 16.439 -18.917 23.971
816 HG23 ILE 105 HG23 ILE 105 14.737 -18.513 23.688
817 HD11 ILE 105 HD11 ILE 105 16.169 -15.005 25.408
818 HD12 ILE 105 HD12 ILE 105 15.350 -15.367 23.876
819 HD13 ILE 105 HD13 ILE 105 14.542 -14.340 25.080
820 HA PRO 106 HA PRO 106 16.825 -18.484 30.407
821 HB2 PRO 106 HB2 PRO 106 19.410 -17.225 29.494
822 HB3 PRO 106 HB3 PRO 106 19.137 -18.451 30.770
823 HG2 PRO 106 HG2 PRO 106 20.103 -19.204 28.371
824 HG3 PRO 106 HG3 PRO 106 18.802 -20.169 29.152
825 HD2 PRO 106 HD2 PRO 106 18.524 -18.045 27.002
826 HD3 PRO 106 HD3 PRO 106 17.858 -19.705 27.062
827 HHA HEC 107 HHA HEC 107 -5.519 -3.335 0.682
828 HHB HEC 107 HHB HEC 107 -0.032 -0.040 1.661
829 HHC HEC 107 HHC HEC 107 -3.378 4.293 5.113
830 HHD HEC 107 HHD HEC 107 -8.400 0.265 5.170
831 HMA1 HEC 107 HMA1 HEC 107 -0.474 -2.464 -1.089
832 HMA2 HEC 107 HMA2 HEC 107 0.387 -1.539 0.140
833 HMA3 HEC 107 HMA3 HEC 107 -0.002 -3.242 0.434
834 HAA1 HEC 107 HAA1 HEC 107 -3.658 -4.014 -1.125
835 HAA2 HEC 107 HAA2 HEC 107 -1.991 -4.295 -0.694
836 HBA1 HEC 107 HBA1 HEC 107 -4.426 -5.220 0.826
837 HBA2 HEC 107 HBA2 HEC 107 -3.041 -6.127 0.249
838 HMB1 HEC 107 HMB1 HEC 107 1.548 2.883 3.524
839 HMB2 HEC 107 HMB2 HEC 107 1.451 1.194 3.060
840 HMB3 HEC 107 HMB3 HEC 107 1.167 2.467 1.848
841 HAB HEC 107 HAB HEC 107 -1.472 4.993 4.864
842 HBB1 HEC 107 HBB1 HEC 107 0.657 4.927 2.732
843 HBB2 HEC 107 HBB2 HEC 107 -1.013 5.499 2.542
844 HBB3 HEC 107 HBB3 HEC 107 0.100 6.332 3.644
845 HMC1 HEC 107 HMC1 HEC 107 -6.579 4.944 7.032
846 HMC2 HEC 107 HMC2 HEC 107 -4.835 4.750 7.000
847 HMC3 HEC 107 HMC3 HEC 107 -5.666 5.536 5.641
848 HAC HEC 107 HAC HEC 107 -8.684 1.686 6.611
849 HBC1 HEC 107 HBC1 HEC 107 -9.999 3.674 6.896
850 HBC2 HEC 107 HBC2 HEC 107 -8.679 4.686 6.288
851 HBC3 HEC 107 HBC3 HEC 107 -9.461 3.503 5.215
852 HMD1 HEC 107 HMD1 HEC 107 -9.651 -1.468 4.880
853 HMD2 HEC 107 HMD2 HEC 107 -10.093 -2.294 3.386
854 HMD3 HEC 107 HMD3 HEC 107 -9.240 -3.175 4.662
855 HAD1 HEC 107 HAD1 HEC 107 -7.443 -4.394 1.372
856 HAD2 HEC 107 HAD2 HEC 107 -8.954 -4.046 2.187
857 HBD1 HEC 107 HBD1 HEC 107 -7.975 -2.474 -0.234
858 HBD2 HEC 107 HBD2 HEC 107 -9.071 -3.853 -0.301
Start of MODEL 8
1 H SER 1 H SER 1 14.126 5.550 5.898
2 HA SER 1 HA SER 1 12.648 6.343 8.035
3 HB2 SER 1 HB2 SER 1 12.959 7.957 5.499
4 HB3 SER 1 HB3 SER 1 12.827 8.552 7.167
5 HG SER 1 HG SER 1 14.991 8.534 6.688
6 H GLY 2 H GLY 2 10.961 4.679 5.876
7 HA2 GLY 2 HA2 GLY 2 8.522 6.238 5.542
8 HA3 GLY 2 HA3 GLY 2 8.729 4.529 5.300
9 H GLU 3 H GLU 3 9.908 4.461 8.213
10 HA GLU 3 HA GLU 3 7.708 3.086 9.222
11 HB2 GLU 3 HB2 GLU 3 10.098 2.755 9.764
12 HB3 GLU 3 HB3 GLU 3 10.088 4.221 10.720
13 HG2 GLU 3 HG2 GLU 3 8.519 3.249 12.310
14 HG3 GLU 3 HG3 GLU 3 8.351 1.801 11.312
15 H GLN 4 H GLN 4 8.729 6.408 10.284
16 HA GLN 4 HA GLN 4 6.350 6.690 11.944
17 HB2 GLN 4 HB2 GLN 4 8.462 8.669 11.041
18 HB3 GLN 4 HB3 GLN 4 7.049 9.122 12.014
19 HG2 GLN 4 HG2 GLN 4 7.659 7.364 13.685
20 HG3 GLN 4 HG3 GLN 4 9.156 7.080 12.796
21 HE21 GLN 4 HE21 GLN 4 8.616 8.106 15.612
22 HE22 GLN 4 HE22 GLN 4 9.336 9.704 15.663
23 H ILE 5 H ILE 5 6.877 7.234 8.531
24 HA ILE 5 HA ILE 5 4.517 8.932 8.163
25 HB ILE 5 HB ILE 5 5.879 7.148 6.106
26 HG12 ILE 5 HG12 ILE 5 6.476 10.062 6.790
27 HG13 ILE 5 HG13 ILE 5 7.540 8.685 7.086
28 HG21 ILE 5 HG21 ILE 5 3.586 7.960 5.514
29 HG22 ILE 5 HG22 ILE 5 4.134 9.632 5.770
30 HG23 ILE 5 HG23 ILE 5 4.818 8.639 4.464
31 HD11 ILE 5 HD11 ILE 5 6.777 9.815 4.382
32 HD12 ILE 5 HD12 ILE 5 8.367 9.771 5.152
33 HD13 ILE 5 HD13 ILE 5 7.612 8.259 4.606
34 H PHE 6 H PHE 6 5.211 5.403 8.004
35 HA PHE 6 HA PHE 6 2.510 4.584 7.559
36 HB2 PHE 6 HB2 PHE 6 4.481 3.128 7.255
37 HB3 PHE 6 HB3 PHE 6 4.774 3.137 8.991
38 HD1 PHE 6 HD1 PHE 6 2.461 2.014 6.318
39 HD2 PHE 6 HD2 PHE 6 3.374 1.839 10.526
40 HE1 PHE 6 HE1 PHE 6 0.680 0.308 6.649
41 HE2 PHE 6 HE2 PHE 6 1.630 0.126 10.840
42 HZ PHE 6 HZ PHE 6 0.272 -0.640 8.898
43 H ARG 7 H ARG 7 4.270 5.214 10.604
44 HA ARG 7 HA ARG 7 2.244 4.473 12.426
45 HB2 ARG 7 HB2 ARG 7 4.728 4.975 12.780
46 HB3 ARG 7 HB3 ARG 7 4.286 6.679 12.808
47 HG2 ARG 7 HG2 ARG 7 4.576 5.892 15.038
48 HG3 ARG 7 HG3 ARG 7 2.864 6.250 14.823
49 HD2 ARG 7 HD2 ARG 7 2.341 3.875 14.611
50 HD3 ARG 7 HD3 ARG 7 4.057 3.449 14.558
51 HE ARG 7 HE ARG 7 2.446 4.167 16.907
52 HH11 ARG 7 HH11 ARG 7 5.760 3.625 15.698
53 HH12 ARG 7 HH12 ARG 7 6.412 3.389 17.303
54 HH21 ARG 7 HH21 ARG 7 3.334 3.853 18.955
55 HH22 ARG 7 HH22 ARG 7 5.040 3.519 19.146
56 H THR 8 H THR 8 2.413 7.336 10.458
57 HA THR 8 HA THR 8 0.288 8.716 12.049
58 HB THR 8 HB THR 8 0.999 10.750 10.748
59 HG1 THR 8 HG1 THR 8 3.367 9.322 10.263
60 HG21 THR 8 HG21 THR 8 3.016 11.167 12.092
61 HG22 THR 8 HG22 THR 8 3.126 9.440 12.502
62 HG23 THR 8 HG23 THR 8 1.748 10.408 13.063
63 H ARG 9 H ARG 9 1.060 7.869 8.625
64 HA ARG 9 HA ARG 9 -1.610 8.799 7.796
65 HB2 ARG 9 HB2 ARG 9 0.638 7.564 6.173
66 HB3 ARG 9 HB3 ARG 9 -0.889 8.193 5.534
67 HG2 ARG 9 HG2 ARG 9 -0.313 10.428 6.612
68 HG3 ARG 9 HG3 ARG 9 1.312 9.776 6.917
69 HD2 ARG 9 HD2 ARG 9 1.579 9.339 4.482
70 HD3 ARG 9 HD3 ARG 9 -0.034 9.998 4.181
71 HE ARG 9 HE ARG 9 2.429 11.456 4.652
72 HH11 ARG 9 HH11 ARG 9 -1.126 11.746 4.903
73 HH12 ARG 9 HH12 ARG 9 -1.087 13.490 4.784
74 HH21 ARG 9 HH21 ARG 9 2.418 13.705 4.490
75 HH22 ARG 9 HH22 ARG 9 0.916 14.597 4.553
76 H CYS 10 H CYS 10 -0.211 5.689 8.613
77 HA CYS 10 HA CYS 10 -2.302 4.305 6.970
78 HB2 CYS 10 HB2 CYS 10 0.444 3.341 7.707
79 HB3 CYS 10 HB3 CYS 10 -0.642 2.643 6.516
80 H SER 11 H SER 11 -0.912 4.293 10.203
81 HA SER 11 HA SER 11 -1.529 1.543 10.818
82 HB2 SER 11 HB2 SER 11 -0.838 3.880 12.633
83 HB3 SER 11 HB3 SER 11 -0.900 2.176 13.118
84 HG SER 11 HG SER 11 0.747 3.258 11.053
85 H SER 12 H SER 12 -3.500 4.421 10.885
86 HA SER 12 HA SER 12 -5.635 3.760 12.528
87 HB2 SER 12 HB2 SER 12 -5.704 4.920 9.718
88 HB3 SER 12 HB3 SER 12 -7.072 4.901 10.841
89 HG SER 12 HG SER 12 -6.231 6.779 11.206
90 H CYS 13 H CYS 13 -4.796 2.129 9.486
91 HA CYS 13 HA CYS 13 -7.159 0.308 9.828
92 HB2 CYS 13 HB2 CYS 13 -6.009 1.295 7.218
93 HB3 CYS 13 HB3 CYS 13 -7.395 0.227 7.411
94 H HIS 14 H HIS 14 -3.840 0.292 9.934
95 HA HIS 14 HA HIS 14 -3.617 -2.520 9.011
96 HB2 HIS 14 2HB HIS 14 -1.942 -0.178 8.008
97 HB3 HIS 14 3HB HIS 14 -1.546 -1.865 7.705
98 HD1 HIS 14 1HD HIS 14 -3.905 -3.194 6.495
99 HD2 HIS 14 2HD HIS 14 -2.671 0.744 5.882
100 HE1 HIS 14 1HE HIS 14 -4.806 -2.579 4.215
101 H THR 15 H THR 15 -1.354 -3.166 9.186
102 HA THR 15 HA THR 15 0.481 -1.873 10.991
103 HB THR 15 HB THR 15 1.114 -3.926 12.236
104 HG1 THR 15 HG1 THR 15 -0.289 -5.523 12.500
105 HG21 THR 15 HG21 THR 15 -0.230 -2.118 13.297
106 HG22 THR 15 HG22 THR 15 -0.500 -3.722 13.997
107 HG23 THR 15 HG23 THR 15 -1.702 -3.025 12.889
108 H VAL 16 H VAL 16 2.667 -3.040 10.838
109 HA VAL 16 HA VAL 16 2.925 -4.711 8.333
110 HB VAL 16 HB VAL 16 5.146 -2.962 9.454
111 HG11 VAL 16 HG11 VAL 16 6.177 -3.436 7.271
112 HG12 VAL 16 HG12 VAL 16 5.814 -4.948 8.102
113 HG13 VAL 16 HG13 VAL 16 4.766 -4.389 6.777
114 HG21 VAL 16 HG21 VAL 16 3.540 -1.378 8.668
115 HG22 VAL 16 HG22 VAL 16 4.751 -1.546 7.396
116 HG23 VAL 16 HG23 VAL 16 3.171 -2.344 7.227
117 H GLY 17 H GLY 17 2.676 -6.642 9.248
118 HA2 GLY 17 HA2 GLY 17 3.431 -8.617 10.191
119 HA3 GLY 17 HA3 GLY 17 4.957 -7.812 10.542
120 H ASN 18 H ASN 18 3.535 -5.823 12.325
121 HA ASN 18 HA ASN 18 3.346 -7.171 14.873
122 HB2 ASN 18 HB2 ASN 18 4.077 -4.840 14.548
123 HB3 ASN 18 HB3 ASN 18 2.544 -4.422 13.806
124 HD21 ASN 18 HD21 ASN 18 1.959 -2.792 15.267
125 HD22 ASN 18 HD22 ASN 18 1.764 -3.107 16.974
126 H THR 19 H THR 19 1.782 -8.918 14.520
127 HA THR 19 HA THR 19 -0.967 -8.061 13.739
128 HB THR 19 HB THR 19 -1.341 -10.337 12.980
129 HG1 THR 19 HG1 THR 19 0.962 -11.366 12.660
130 HG21 THR 19 HG21 THR 19 -0.471 -8.599 11.419
131 HG22 THR 19 HG22 THR 19 -0.045 -10.259 10.969
132 HG23 THR 19 HG23 THR 19 1.171 -9.203 11.711
133 H GLU 20 H GLU 20 -2.723 -8.535 14.678
134 HA GLU 20 HA GLU 20 -2.908 -9.639 17.394
135 HB2 GLU 20 HB2 GLU 20 -5.359 -9.225 16.999
136 HB3 GLU 20 HB3 GLU 20 -4.351 -7.802 16.871
137 HG2 GLU 20 HG2 GLU 20 -5.106 -9.348 14.360
138 HG3 GLU 20 HG3 GLU 20 -6.278 -8.288 15.131
139 HA PRO 21 HA PRO 21 -4.260 -13.751 16.028
140 HB2 PRO 21 HB2 PRO 21 -6.073 -14.520 17.917
141 HB3 PRO 21 HB3 PRO 21 -4.315 -14.428 18.227
142 HG2 PRO 21 HG2 PRO 21 -6.443 -12.383 18.904
143 HG3 PRO 21 HG3 PRO 21 -5.121 -12.988 19.948
144 HD2 PRO 21 HD2 PRO 21 -4.954 -10.630 18.574
145 HD3 PRO 21 HD3 PRO 21 -3.530 -11.653 18.873
146 H GLY 22 H GLY 22 -5.826 -14.635 14.758
147 HA2 GLY 22 HA2 GLY 22 -7.619 -14.732 13.312
148 HA3 GLY 22 HA3 GLY 22 -8.525 -13.674 14.383
149 H GLN 23 H GLN 23 -9.352 -12.768 12.306
150 HA GLN 23 HA GLN 23 -7.420 -11.413 10.607
151 HB2 GLN 23 HB2 GLN 23 -9.325 -10.775 9.207
152 HB3 GLN 23 HB3 GLN 23 -9.148 -12.507 9.467
153 HG2 GLN 23 HG2 GLN 23 -11.032 -12.546 11.010
154 HG3 GLN 23 HG3 GLN 23 -11.141 -10.780 10.995
155 HE21 GLN 23 HE21 GLN 23 -12.379 -9.798 9.378
156 HE22 GLN 23 HE22 GLN 23 -13.057 -10.678 8.017
157 HA PRO 24 HA PRO 24 -7.672 -7.401 12.525
158 HB2 PRO 24 HB2 PRO 24 -6.671 -5.790 10.542
159 HB3 PRO 24 HB3 PRO 24 -5.672 -6.924 11.500
160 HG2 PRO 24 HG2 PRO 24 -6.888 -7.367 8.764
161 HG3 PRO 24 HG3 PRO 24 -5.206 -7.670 9.289
162 HD2 PRO 24 HD2 PRO 24 -7.071 -9.657 9.191
163 HD3 PRO 24 HD3 PRO 24 -5.838 -9.607 10.484
164 H GLY 25 H GLY 25 -8.734 -5.348 12.412
165 HA2 GLY 25 HA2 GLY 25 -11.459 -5.810 11.950
166 HA3 GLY 25 HA3 GLY 25 -10.745 -4.289 12.479
167 H ILE 26 H ILE 26 -9.264 -3.795 9.994
168 HA ILE 26 HA ILE 26 -11.567 -3.061 8.200
169 HB ILE 26 HB ILE 26 -9.023 -1.489 8.742
170 HG12 ILE 26 HG12 ILE 26 -11.908 -0.961 9.609
171 HG13 ILE 26 HG13 ILE 26 -10.593 -1.455 10.672
172 HG21 ILE 26 HG21 ILE 26 -11.485 -0.770 7.091
173 HG22 ILE 26 HG22 ILE 26 -10.073 0.266 7.360
174 HG23 ILE 26 HG23 ILE 26 -9.900 -1.204 6.415
175 HD11 ILE 26 HD11 ILE 26 -10.848 1.210 9.253
176 HD12 ILE 26 HD12 ILE 26 -10.877 0.876 10.986
177 HD13 ILE 26 HD13 ILE 26 -9.370 0.665 10.088
178 H GLY 27 H GLY 27 -8.055 -3.898 8.174
179 HA2 GLY 27 HA2 GLY 27 -8.372 -5.458 5.759
180 HA3 GLY 27 HA3 GLY 27 -7.578 -3.916 5.433
181 HA PRO 28 HA PRO 28 -4.901 -7.554 6.940
182 HB2 PRO 28 HB2 PRO 28 -3.313 -8.004 4.756
183 HB3 PRO 28 HB3 PRO 28 -4.990 -8.618 4.875
184 HG2 PRO 28 HG2 PRO 28 -4.056 -6.026 3.571
185 HG3 PRO 28 HG3 PRO 28 -5.029 -7.326 2.823
186 HD2 PRO 28 HD2 PRO 28 -6.263 -5.195 3.893
187 HD3 PRO 28 HD3 PRO 28 -6.915 -6.827 4.228
188 H ASP 29 H ASP 29 -2.701 -7.701 7.569
189 HA ASP 29 HA ASP 29 -1.198 -5.214 7.781
190 HB2 ASP 29 HB2 ASP 29 0.312 -6.370 9.133
191 HB3 ASP 29 HB3 ASP 29 -1.233 -7.135 9.499
192 H LEU 30 H LEU 30 1.030 -4.981 7.025
193 HA LEU 30 HA LEU 30 1.114 -5.785 4.168
194 HB2 LEU 30 HB2 LEU 30 2.553 -3.442 5.375
195 HB3 LEU 30 HB3 LEU 30 2.090 -3.703 3.702
196 HG LEU 30 HG LEU 30 0.227 -3.113 6.032
197 HD11 LEU 30 HD11 LEU 30 1.034 -1.467 3.583
198 HD12 LEU 30 HD12 LEU 30 1.614 -1.213 5.235
199 HD13 LEU 30 HD13 LEU 30 -0.105 -0.958 4.859
200 HD21 LEU 30 HD21 LEU 30 -0.405 -3.423 3.041
201 HD22 LEU 30 HD22 LEU 30 -1.542 -2.827 4.280
202 HD23 LEU 30 HD23 LEU 30 -0.968 -4.490 4.337
203 H LEU 31 H LEU 31 2.634 -7.320 6.487
204 HA LEU 31 HA LEU 31 5.417 -6.783 5.860
205 HB2 LEU 31 HB2 LEU 31 4.710 -7.555 7.963
206 HB3 LEU 31 HB3 LEU 31 4.066 -9.049 7.309
207 HG LEU 31 HG LEU 31 6.109 -9.295 8.625
208 HD11 LEU 31 HD11 LEU 31 6.872 -10.006 5.783
209 HD12 LEU 31 HD12 LEU 31 5.645 -10.886 6.729
210 HD13 LEU 31 HD13 LEU 31 7.313 -10.792 7.297
211 HD21 LEU 31 HD21 LEU 31 8.267 -8.477 7.901
212 HD22 LEU 31 HD22 LEU 31 7.145 -7.133 8.134
213 HD23 LEU 31 HD23 LEU 31 7.550 -7.684 6.487
214 H GLY 32 H GLY 32 6.701 -7.618 4.478
215 HA2 GLY 32 HA2 GLY 32 7.535 -8.622 2.594
216 HA3 GLY 32 HA3 GLY 32 6.524 -10.003 2.963
217 H VAL 33 H VAL 33 4.508 -7.199 2.310
218 HA VAL 33 HA VAL 33 3.564 -8.345 -0.099
219 HB VAL 33 HB VAL 33 2.269 -6.380 -0.385
220 HG11 VAL 33 HG11 VAL 33 0.991 -6.409 1.685
221 HG12 VAL 33 HG12 VAL 33 1.517 -8.032 1.228
222 HG13 VAL 33 HG13 VAL 33 2.350 -7.176 2.535
223 HG21 VAL 33 HG21 VAL 33 3.946 -5.069 1.762
224 HG22 VAL 33 HG22 VAL 33 3.721 -4.551 0.089
225 HG23 VAL 33 HG23 VAL 33 2.369 -4.463 1.221
226 H THR 34 H THR 34 6.266 -6.170 0.397
227 HA THR 34 HA THR 34 6.680 -5.272 -2.303
228 HB THR 34 HB THR 34 9.115 -5.138 -1.404
229 HG1 THR 34 HG1 THR 34 9.425 -5.960 0.469
230 HG21 THR 34 HG21 THR 34 6.870 -3.675 0.035
231 HG22 THR 34 HG22 THR 34 7.662 -3.181 -1.478
232 HG23 THR 34 HG23 THR 34 8.587 -3.206 0.031
233 H ARG 35 H ARG 35 6.981 -8.422 -0.938
234 HA ARG 35 HA ARG 35 8.454 -9.365 -3.368
235 HB2 ARG 35 HB2 ARG 35 8.261 -10.697 -0.646
236 HB3 ARG 35 HB3 ARG 35 9.104 -11.320 -2.072
237 HG2 ARG 35 HG2 ARG 35 10.486 -9.156 -2.051
238 HG3 ARG 35 HG3 ARG 35 9.808 -8.840 -0.447
239 HD2 ARG 35 HD2 ARG 35 11.475 -11.254 -1.280
240 HD3 ARG 35 HD3 ARG 35 12.017 -9.883 -0.301
241 HE ARG 35 HE ARG 35 9.707 -11.357 0.753
242 HH11 ARG 35 HH11 ARG 35 13.262 -11.043 0.839
243 HH12 ARG 35 HH12 ARG 35 13.404 -11.920 2.345
244 HH21 ARG 35 HH21 ARG 35 9.946 -12.496 2.692
245 HH22 ARG 35 HH22 ARG 35 11.530 -12.738 3.392
246 H GLN 36 H GLN 36 5.550 -9.885 -1.372
247 HA GLN 36 HA GLN 36 4.604 -12.077 -3.065
248 HB2 GLN 36 HB2 GLN 36 3.253 -10.495 -0.852
249 HB3 GLN 36 HB3 GLN 36 2.512 -11.848 -1.714
250 HG2 GLN 36 HG2 GLN 36 4.380 -13.334 -0.991
251 HG3 GLN 36 HG3 GLN 36 5.061 -12.001 -0.047
252 HE21 GLN 36 HE21 GLN 36 2.232 -14.227 -0.316
253 HE22 GLN 36 HE22 GLN 36 1.790 -14.029 1.365
254 H ARG 37 H ARG 37 4.152 -8.570 -3.217
255 HA ARG 37 HA ARG 37 2.163 -8.932 -5.422
256 HB2 ARG 37 HB2 ARG 37 2.872 -6.450 -3.820
257 HB3 ARG 37 HB3 ARG 37 1.829 -6.461 -5.228
258 HG2 ARG 37 HG2 ARG 37 1.251 -7.987 -2.655
259 HG3 ARG 37 HG3 ARG 37 0.559 -6.430 -3.124
260 HD2 ARG 37 HD2 ARG 37 -0.387 -7.511 -5.190
261 HD3 ARG 37 HD3 ARG 37 0.185 -9.079 -4.582
262 HE ARG 37 HE ARG 37 -1.405 -7.746 -2.606
263 HH11 ARG 37 HH11 ARG 37 -1.739 -9.562 -5.658
264 HH12 ARG 37 HH12 ARG 37 -3.355 -10.112 -5.274
265 HH21 ARG 37 HH21 ARG 37 -3.498 -8.482 -2.152
266 HH22 ARG 37 HH22 ARG 37 -4.350 -9.501 -3.291
267 H ASP 38 H ASP 38 2.417 -7.706 -7.324
268 HA ASP 38 HA ASP 38 4.997 -7.940 -8.546
269 HB2 ASP 38 HB2 ASP 38 2.402 -6.574 -9.332
270 HB3 ASP 38 HB3 ASP 38 3.817 -6.572 -10.376
271 H ALA 39 H ALA 39 6.705 -6.649 -8.641
272 HA ALA 39 HA ALA 39 6.975 -4.879 -6.545
273 HB1 ALA 39 HB1 ALA 39 8.775 -5.191 -8.983
274 HB2 ALA 39 HB2 ALA 39 9.259 -4.553 -7.398
275 HB3 ALA 39 HB3 ALA 39 8.766 -6.249 -7.553
276 H ASN 40 H ASN 40 6.243 -3.956 -9.902
277 HA ASN 40 HA ASN 40 6.603 -1.084 -9.240
278 HB2 ASN 40 HB2 ASN 40 7.450 -2.000 -11.389
279 HB3 ASN 40 HB3 ASN 40 5.796 -2.403 -11.860
280 HD21 ASN 40 HD21 ASN 40 4.445 -0.758 -12.610
281 HD22 ASN 40 HD22 ASN 40 4.975 0.913 -12.761
282 H TRP 41 H TRP 41 3.961 -3.344 -10.125
283 HA TRP 41 HA TRP 41 1.797 -1.513 -10.136
284 HB2 TRP 41 HB2 TRP 41 1.565 -3.801 -10.933
285 HB3 TRP 41 HB3 TRP 41 1.943 -4.431 -9.333
286 HD1 TRP 41 HD1 TRP 41 -0.940 -3.158 -11.390
287 HE1 TRP 41 HE1 TRP 41 -3.149 -3.256 -10.070
288 HE3 TRP 41 HE3 TRP 41 0.954 -4.539 -6.856
289 HZ2 TRP 41 HZ2 TRP 41 -3.882 -3.430 -7.244
290 HZ3 TRP 41 HZ3 TRP 41 -0.494 -4.561 -4.837
291 HH2 TRP 41 HH2 TRP 41 -2.877 -3.927 -5.012
292 H LEU 42 H LEU 42 3.296 -3.214 -7.358
293 HA LEU 42 HA LEU 42 1.509 -2.375 -5.342
294 HB2 LEU 42 HB2 LEU 42 3.256 -4.093 -5.072
295 HB3 LEU 42 HB3 LEU 42 4.514 -2.883 -5.306
296 HG LEU 42 HG LEU 42 3.792 -1.743 -3.182
297 HD11 LEU 42 HD11 LEU 42 2.008 -4.202 -2.875
298 HD12 LEU 42 HD12 LEU 42 1.455 -2.517 -3.038
299 HD13 LEU 42 HD13 LEU 42 2.371 -3.012 -1.603
300 HD21 LEU 42 HD21 LEU 42 5.635 -3.348 -3.243
301 HD22 LEU 42 HD22 LEU 42 4.495 -4.677 -2.935
302 HD23 LEU 42 HD23 LEU 42 4.767 -3.415 -1.703
303 H VAL 43 H VAL 43 4.250 -0.595 -6.769
304 HA VAL 43 HA VAL 43 4.097 1.576 -4.800
305 HB VAL 43 HB VAL 43 5.658 1.478 -7.408
306 HG11 VAL 43 HG11 VAL 43 5.959 3.215 -4.914
307 HG12 VAL 43 HG12 VAL 43 7.062 3.206 -6.302
308 HG13 VAL 43 HG13 VAL 43 5.403 3.771 -6.511
309 HG21 VAL 43 HG21 VAL 43 6.501 0.734 -4.556
310 HG22 VAL 43 HG22 VAL 43 6.394 -0.357 -5.944
311 HG23 VAL 43 HG23 VAL 43 7.606 0.929 -5.932
312 H ARG 44 H ARG 44 2.885 0.995 -8.115
313 HA ARG 44 HA ARG 44 1.709 3.601 -8.446
314 HB2 ARG 44 HB2 ARG 44 2.169 1.933 -10.245
315 HB3 ARG 44 HB3 ARG 44 0.796 0.971 -9.672
316 HG2 ARG 44 HG2 ARG 44 -0.740 2.834 -10.144
317 HG3 ARG 44 HG3 ARG 44 0.622 3.888 -10.572
318 HD2 ARG 44 HD2 ARG 44 1.198 2.448 -12.466
319 HD3 ARG 44 HD3 ARG 44 -0.074 1.303 -12.028
320 HE ARG 44 HE ARG 44 -0.416 4.048 -13.135
321 HH11 ARG 44 HH11 ARG 44 -1.952 0.953 -12.237
322 HH12 ARG 44 HH12 ARG 44 -3.458 1.360 -13.026
323 HH21 ARG 44 HH21 ARG 44 -2.382 4.528 -14.135
324 HH22 ARG 44 HH22 ARG 44 -3.699 3.379 -14.099
325 H TRP 45 H TRP 45 0.345 0.530 -7.186
326 HA TRP 45 HA TRP 45 -2.226 1.482 -6.426
327 HB2 TRP 45 HB2 TRP 45 -1.708 -0.869 -6.494
328 HB3 TRP 45 HB3 TRP 45 -0.405 -0.685 -5.330
329 HD1 TRP 45 HD1 TRP 45 -0.949 -1.304 -2.982
330 HE1 TRP 45 HE1 TRP 45 -3.056 -1.627 -1.541
331 HE3 TRP 45 HE3 TRP 45 -4.483 0.224 -6.354
332 HZ2 TRP 45 HZ2 TRP 45 -5.916 -1.189 -1.794
333 HZ3 TRP 45 HZ3 TRP 45 -6.885 0.277 -5.718
334 HH2 TRP 45 HH2 TRP 45 -7.602 -0.432 -3.446
335 H LEU 46 H LEU 46 0.873 1.639 -4.620
336 HA LEU 46 HA LEU 46 -0.384 3.090 -2.446
337 HB2 LEU 46 HB2 LEU 46 1.493 1.507 -2.174
338 HB3 LEU 46 HB3 LEU 46 2.557 2.619 -3.031
339 HG LEU 46 HG LEU 46 2.482 4.221 -1.233
340 HD11 LEU 46 HD11 LEU 46 1.155 3.909 0.813
341 HD12 LEU 46 HD12 LEU 46 0.333 2.497 0.079
342 HD13 LEU 46 HD13 LEU 46 0.115 4.137 -0.570
343 HD21 LEU 46 HD21 LEU 46 2.639 1.425 -0.045
344 HD22 LEU 46 HD22 LEU 46 3.356 2.913 0.626
345 HD23 LEU 46 HD23 LEU 46 3.935 2.269 -0.915
346 H LYS 47 H LYS 47 0.158 4.196 -5.489
347 HA LYS 47 HA LYS 47 0.591 7.010 -4.536
348 HB2 LYS 47 HB2 LYS 47 1.232 5.634 -7.160
349 HB3 LYS 47 HB3 LYS 47 1.015 7.387 -7.076
350 HG2 LYS 47 HG2 LYS 47 2.737 7.592 -5.366
351 HG3 LYS 47 HG3 LYS 47 2.963 5.835 -5.338
352 HD2 LYS 47 HD2 LYS 47 3.715 5.909 -7.716
353 HD3 LYS 47 HD3 LYS 47 3.510 7.682 -7.701
354 HE2 LYS 47 HE2 LYS 47 5.096 7.831 -5.786
355 HE3 LYS 47 HE3 LYS 47 5.324 6.077 -5.849
356 HZ1 LYS 47 HZ1 LYS 47 7.091 7.109 -6.987
357 HZ2 LYS 47 HZ2 LYS 47 6.129 8.050 -7.915
358 HZ3 LYS 47 HZ3 LYS 47 6.184 6.420 -8.168
359 H VAL 48 H VAL 48 -1.746 4.965 -6.252
360 HA VAL 48 HA VAL 48 -3.658 7.230 -6.216
361 HB VAL 48 HB VAL 48 -2.009 7.275 -8.218
362 HG11 VAL 48 HG11 VAL 48 -3.915 5.433 -9.633
363 HG12 VAL 48 HG12 VAL 48 -2.389 6.133 -10.176
364 HG13 VAL 48 HG13 VAL 48 -2.381 4.875 -8.925
365 HG21 VAL 48 HG21 VAL 48 -3.835 8.174 -9.700
366 HG22 VAL 48 HG22 VAL 48 -4.946 7.748 -8.365
367 HG23 VAL 48 HG23 VAL 48 -3.623 8.879 -8.090
368 HA PRO 49 HA PRO 49 -5.153 2.734 -5.844
369 HB2 PRO 49 HB2 PRO 49 -6.385 2.781 -3.374
370 HB3 PRO 49 HB3 PRO 49 -4.638 2.511 -3.613
371 HG2 PRO 49 HG2 PRO 49 -6.043 5.130 -2.970
372 HG3 PRO 49 HG3 PRO 49 -4.617 4.418 -2.157
373 HD2 PRO 49 HD2 PRO 49 -4.303 6.301 -4.061
374 HD3 PRO 49 HD3 PRO 49 -3.207 4.893 -4.002
375 H ASP 50 H ASP 50 -7.131 5.593 -4.880
376 HA ASP 50 HA ASP 50 -9.655 4.226 -5.398
377 HB2 ASP 50 HB2 ASP 50 -9.528 5.896 -3.672
378 HB3 ASP 50 HB3 ASP 50 -8.898 7.101 -4.785
379 H GLN 51 H GLN 51 -7.409 6.084 -7.342
380 HA GLN 51 HA GLN 51 -9.248 6.472 -9.588
381 HB2 GLN 51 HB2 GLN 51 -7.188 7.868 -8.974
382 HB3 GLN 51 HB3 GLN 51 -6.229 6.524 -9.639
383 HG2 GLN 51 HG2 GLN 51 -7.377 6.821 -11.821
384 HG3 GLN 51 HG3 GLN 51 -8.295 8.180 -11.144
385 HE21 GLN 51 HE21 GLN 51 -5.499 7.391 -12.882
386 HE22 GLN 51 HE22 GLN 51 -4.571 8.851 -12.528
387 H MET 52 H MET 52 -6.780 4.035 -8.646
388 HA MET 52 HA MET 52 -6.954 2.476 -11.056
389 HB2 MET 52 HB2 MET 52 -5.956 2.015 -8.234
390 HB3 MET 52 HB3 MET 52 -6.113 0.642 -9.343
391 HG2 MET 52 HG2 MET 52 -4.666 1.656 -10.951
392 HG3 MET 52 HG3 MET 52 -4.619 3.178 -10.047
393 HE1 MET 52 HE1 MET 52 -2.432 -0.726 -8.848
394 HE2 MET 52 HE2 MET 52 -4.206 -0.617 -8.809
395 HE3 MET 52 HE3 MET 52 -3.338 -0.492 -10.357
396 H LEU 53 H LEU 53 -8.834 2.303 -7.974
397 HA LEU 53 HA LEU 53 -10.396 0.051 -8.830
398 HB2 LEU 53 HB2 LEU 53 -10.135 0.901 -6.471
399 HB3 LEU 53 HB3 LEU 53 -11.148 2.276 -6.898
400 HG LEU 53 HG LEU 53 -13.008 0.639 -7.460
401 HD11 LEU 53 HD11 LEU 53 -11.124 -1.375 -6.163
402 HD12 LEU 53 HD12 LEU 53 -11.707 -1.399 -7.846
403 HD13 LEU 53 HD13 LEU 53 -12.842 -1.640 -6.519
404 HD21 LEU 53 HD21 LEU 53 -12.901 1.801 -5.276
405 HD22 LEU 53 HD22 LEU 53 -11.892 0.487 -4.627
406 HD23 LEU 53 HD23 LEU 53 -13.571 0.173 -5.108
407 H ALA 54 H ALA 54 -10.893 3.578 -9.241
408 HA ALA 54 HA ALA 54 -13.417 3.331 -10.602
409 HB1 ALA 54 HB1 ALA 54 -13.023 5.729 -11.119
410 HB2 ALA 54 HB2 ALA 54 -12.841 5.330 -9.403
411 HB3 ALA 54 HB3 ALA 54 -11.398 5.580 -10.406
412 H GLU 55 H GLU 55 -10.061 3.270 -11.867
413 HA GLU 55 HA GLU 55 -11.021 3.237 -14.639
414 HB2 GLU 55 HB2 GLU 55 -8.868 3.214 -15.328
415 HB3 GLU 55 HB3 GLU 55 -8.739 4.122 -13.833
416 HG2 GLU 55 HG2 GLU 55 -7.899 2.012 -12.766
417 HG3 GLU 55 HG3 GLU 55 -7.980 1.196 -14.306
418 H LYS 56 H LYS 56 -11.259 1.024 -12.246
419 HA LYS 56 HA LYS 56 -11.290 -1.199 -11.948
420 HB2 LYS 56 HB2 LYS 56 -12.663 -1.005 -14.646
421 HB3 LYS 56 HB3 LYS 56 -12.540 -2.509 -13.719
422 HG2 LYS 56 HG2 LYS 56 -13.545 -1.314 -11.734
423 HG3 LYS 56 HG3 LYS 56 -13.878 0.070 -12.792
424 HD2 LYS 56 HD2 LYS 56 -15.392 -1.262 -14.152
425 HD3 LYS 56 HD3 LYS 56 -14.862 -2.756 -13.353
426 HE2 LYS 56 HE2 LYS 56 -15.707 -1.805 -11.168
427 HE3 LYS 56 HE3 LYS 56 -16.446 -0.482 -12.077
428 HZ1 LYS 56 HZ1 LYS 56 -17.841 -2.101 -13.215
429 HZ2 LYS 56 HZ2 LYS 56 -17.921 -2.466 -11.598
430 HZ3 LYS 56 HZ3 LYS 56 -16.998 -3.351 -12.622
431 H ASP 57 H ASP 57 -8.953 -0.686 -12.090
432 HA ASP 57 HA ASP 57 -7.184 -2.189 -13.811
433 HB2 ASP 57 HB2 ASP 57 -6.367 -0.409 -12.297
434 HB3 ASP 57 HB3 ASP 57 -6.905 -1.337 -10.897
435 HA PRO 58 HA PRO 58 -9.512 -5.612 -12.559
436 HB2 PRO 58 HB2 PRO 58 -8.732 -7.406 -14.369
437 HB3 PRO 58 HB3 PRO 58 -9.426 -5.771 -14.764
438 HG2 PRO 58 HG2 PRO 58 -6.441 -6.364 -14.617
439 HG3 PRO 58 HG3 PRO 58 -7.367 -5.898 -16.100
440 HD2 PRO 58 HD2 PRO 58 -6.238 -4.080 -14.487
441 HD3 PRO 58 HD3 PRO 58 -7.895 -3.810 -15.107
442 H LEU 59 H LEU 59 -6.250 -5.585 -12.037
443 HA LEU 59 HA LEU 59 -6.114 -7.956 -10.273
444 HB2 LEU 59 HB2 LEU 59 -4.153 -6.909 -11.584
445 HB3 LEU 59 HB3 LEU 59 -4.170 -5.614 -10.410
446 HG LEU 59 HG LEU 59 -2.418 -7.201 -9.950
447 HD11 LEU 59 HD11 LEU 59 -2.731 -7.702 -7.643
448 HD12 LEU 59 HD12 LEU 59 -4.492 -7.688 -7.789
449 HD13 LEU 59 HD13 LEU 59 -3.568 -6.176 -7.970
450 HD21 LEU 59 HD21 LEU 59 -2.767 -9.526 -9.386
451 HD22 LEU 59 HD22 LEU 59 -3.455 -9.205 -10.985
452 HD23 LEU 59 HD23 LEU 59 -4.523 -9.367 -9.571
453 H ALA 60 H ALA 60 -6.167 -4.328 -9.788
454 HA ALA 60 HA ALA 60 -6.474 -4.526 -6.967
455 HB1 ALA 60 HB1 ALA 60 -7.409 -2.293 -8.786
456 HB2 ALA 60 HB2 ALA 60 -7.059 -2.210 -7.042
457 HB3 ALA 60 HB3 ALA 60 -5.742 -2.500 -8.207
458 H MET 61 H MET 61 -9.074 -4.084 -9.460
459 HA MET 61 HA MET 61 -11.147 -3.976 -7.460
460 HB2 MET 61 HB2 MET 61 -12.666 -3.817 -9.182
461 HB3 MET 61 HB3 MET 61 -11.269 -2.889 -9.673
462 HG2 MET 61 HG2 MET 61 -10.768 -4.224 -11.434
463 HG3 MET 61 HG3 MET 61 -11.278 -5.714 -10.643
464 HE1 MET 61 HE1 MET 61 -14.323 -4.984 -9.750
465 HE2 MET 61 HE2 MET 61 -15.100 -5.802 -11.126
466 HE3 MET 61 HE3 MET 61 -13.651 -6.507 -10.358
467 H LEU 62 H LEU 62 -9.408 -6.650 -8.580
468 HA LEU 62 HA LEU 62 -11.392 -8.675 -7.763
469 HB2 LEU 62 HB2 LEU 62 -9.902 -9.019 -9.693
470 HB3 LEU 62 HB3 LEU 62 -8.509 -8.718 -8.642
471 HG LEU 62 HG LEU 62 -8.949 -10.754 -7.378
472 HD11 LEU 62 HD11 LEU 62 -11.223 -11.219 -9.358
473 HD12 LEU 62 HD12 LEU 62 -11.402 -10.950 -7.608
474 HD13 LEU 62 HD13 LEU 62 -10.615 -12.417 -8.195
475 HD21 LEU 62 HD21 LEU 62 -7.498 -10.846 -9.354
476 HD22 LEU 62 HD22 LEU 62 -8.904 -11.200 -10.382
477 HD23 LEU 62 HD23 LEU 62 -8.382 -12.373 -9.154
478 H LEU 63 H LEU 63 -8.346 -7.072 -6.539
479 HA LEU 63 HA LEU 63 -8.202 -8.976 -4.313
480 HB2 LEU 63 HB2 LEU 63 -6.204 -8.107 -3.813
481 HB3 LEU 63 HB3 LEU 63 -6.297 -7.721 -5.510
482 HG LEU 63 HG LEU 63 -7.184 -5.365 -4.612
483 HD11 LEU 63 HD11 LEU 63 -6.139 -4.748 -2.468
484 HD12 LEU 63 HD12 LEU 63 -5.571 -6.422 -2.241
485 HD13 LEU 63 HD13 LEU 63 -7.296 -6.057 -2.206
486 HD21 LEU 63 HD21 LEU 63 -5.044 -5.798 -5.818
487 HD22 LEU 63 HD22 LEU 63 -4.277 -6.192 -4.273
488 HD23 LEU 63 HD23 LEU 63 -4.923 -4.551 -4.563
489 H PHE 64 H PHE 64 -9.682 -5.888 -4.847
490 HA PHE 64 HA PHE 64 -10.004 -5.247 -2.036
491 HB2 PHE 64 HB2 PHE 64 -10.404 -3.243 -2.807
492 HB3 PHE 64 HB3 PHE 64 -10.239 -3.828 -4.435
493 HD1 PHE 64 HD2 PHE 64 -12.433 -4.859 -5.523
494 HD2 PHE 64 HD1 PHE 64 -12.391 -2.193 -2.144
495 HE1 PHE 64 HE2 PHE 64 -14.792 -4.261 -5.979
496 HE2 PHE 64 HE1 PHE 64 -14.747 -1.551 -2.631
497 HZ PHE 64 HZ PHE 64 -15.953 -2.591 -4.537
498 H GLU 65 H GLU 65 -12.107 -7.013 -4.278
499 HA GLU 65 HA GLU 65 -14.386 -6.877 -2.537
500 HB2 GLU 65 HB2 GLU 65 -15.387 -8.599 -3.941
501 HB3 GLU 65 HB3 GLU 65 -14.766 -7.224 -4.854
502 HG2 GLU 65 HG2 GLU 65 -12.855 -8.503 -5.613
503 HG3 GLU 65 HG3 GLU 65 -13.278 -9.865 -4.561
504 H GLN 66 H GLN 66 -11.566 -8.922 -2.409
505 HA GLN 66 HA GLN 66 -12.795 -10.852 -0.611
506 HB2 GLN 66 HB2 GLN 66 -10.714 -11.398 -1.863
507 HB3 GLN 66 HB3 GLN 66 -9.869 -10.071 -1.060
508 HG2 GLN 66 HG2 GLN 66 -10.223 -11.225 1.151
509 HG3 GLN 66 HG3 GLN 66 -10.981 -12.570 0.302
510 HE21 GLN 66 HE21 GLN 66 -8.882 -13.069 1.964
511 HE22 GLN 66 HE22 GLN 66 -7.400 -13.370 1.072
512 H TYR 67 H TYR 67 -11.042 -7.782 -0.144
513 HA TYR 67 HA TYR 67 -11.263 -8.055 2.774
514 HB2 TYR 67 HB2 TYR 67 -9.974 -5.953 1.032
515 HB3 TYR 67 HB3 TYR 67 -9.930 -5.978 2.799
516 HD1 TYR 67 HD2 TYR 67 -9.290 -8.486 3.777
517 HD2 TYR 67 HD1 TYR 67 -8.008 -6.818 0.001
518 HE1 TYR 67 HE2 TYR 67 -7.361 -10.042 3.742
519 HE2 TYR 67 HE1 TYR 67 -6.033 -8.347 0.006
520 HH TYR 67 HH TYR 67 -4.840 -9.891 1.210
521 H ASN 68 H ASN 68 -13.615 -8.258 2.188
522 HA ASN 68 HA ASN 68 -15.743 -7.564 2.454
523 HB2 ASN 68 HB2 ASN 68 -14.481 -7.172 4.666
524 HB3 ASN 68 HB3 ASN 68 -14.583 -5.453 4.297
525 HD21 ASN 68 HD21 ASN 68 -15.661 -5.756 6.528
526 HD22 ASN 68 HD22 ASN 68 -17.397 -6.023 6.490
527 H ARG 69 H ARG 69 -14.370 -6.240 0.184
528 HA ARG 69 HA ARG 69 -14.500 -4.493 -1.270
529 HB2 ARG 69 HB2 ARG 69 -17.403 -4.479 -0.370
530 HB3 ARG 69 HB3 ARG 69 -16.790 -3.606 -1.775
531 HG2 ARG 69 HG2 ARG 69 -16.093 -5.641 -2.862
532 HG3 ARG 69 HG3 ARG 69 -16.588 -6.621 -1.457
533 HD2 ARG 69 HD2 ARG 69 -18.927 -5.851 -1.774
534 HD3 ARG 69 HD3 ARG 69 -18.428 -4.912 -3.189
535 HE ARG 69 HE ARG 69 -18.837 -7.794 -2.988
536 HH11 ARG 69 HH11 ARG 69 -17.280 -5.248 -4.942
537 HH12 ARG 69 HH12 ARG 69 -17.206 -6.251 -6.374
538 HH21 ARG 69 HH21 ARG 69 -18.718 -9.053 -4.854
539 HH22 ARG 69 HH22 ARG 69 -18.016 -8.406 -6.322
540 H LEU 70 H LEU 70 -13.501 -3.700 1.340
541 HA LEU 70 HA LEU 70 -14.945 -1.433 2.297
542 HB2 LEU 70 HB2 LEU 70 -13.426 -3.146 3.482
543 HB3 LEU 70 HB3 LEU 70 -12.081 -2.159 2.969
544 HG LEU 70 HG LEU 70 -12.669 -1.805 5.280
545 HD11 LEU 70 HD11 LEU 70 -13.563 0.726 3.884
546 HD12 LEU 70 HD12 LEU 70 -11.864 0.198 3.961
547 HD13 LEU 70 HD13 LEU 70 -12.771 0.560 5.446
548 HD21 LEU 70 HD21 LEU 70 -15.398 -0.803 4.388
549 HD22 LEU 70 HD22 LEU 70 -14.774 -0.884 6.043
550 HD23 LEU 70 HD23 LEU 70 -15.075 -2.379 5.141
551 H ALA 71 H ALA 71 -11.975 -1.594 0.324
552 HA ALA 71 HA ALA 71 -10.930 -0.205 -1.005
553 HB1 ALA 71 HB1 ALA 71 -13.161 0.290 -1.943
554 HB2 ALA 71 HB2 ALA 71 -13.262 1.717 -0.887
555 HB3 ALA 71 HB3 ALA 71 -12.000 1.614 -2.125
556 H MET 72 H MET 72 -9.699 1.702 -1.244
557 HA MET 72 HA MET 72 -9.038 3.079 1.312
558 HB2 MET 72 HB2 MET 72 -7.557 1.246 0.963
559 HB3 MET 72 HB3 MET 72 -7.292 1.670 -0.730
560 HG2 MET 72 HG2 MET 72 -6.003 3.594 -0.147
561 HG3 MET 72 HG3 MET 72 -6.411 3.442 1.571
562 HE1 MET 72 HE1 MET 72 -2.481 2.559 0.628
563 HE2 MET 72 HE2 MET 72 -3.590 3.449 -0.426
564 HE3 MET 72 HE3 MET 72 -3.506 3.849 1.305
565 HA PRO 73 HA PRO 73 -8.831 6.681 -1.493
566 HB2 PRO 73 HB2 PRO 73 -8.705 8.664 0.307
567 HB3 PRO 73 HB3 PRO 73 -10.159 7.626 0.206
568 HG2 PRO 73 HG2 PRO 73 -7.834 7.399 2.146
569 HG3 PRO 73 HG3 PRO 73 -9.586 7.372 2.515
570 HD2 PRO 73 HD2 PRO 73 -8.032 5.095 2.169
571 HD3 PRO 73 HD3 PRO 73 -9.791 5.158 1.843
572 H ASN 74 H ASN 74 -7.325 8.511 -1.929
573 HA ASN 74 HA ASN 74 -4.499 8.007 -1.176
574 HB2 ASN 74 HB2 ASN 74 -5.245 8.328 -3.563
575 HB3 ASN 74 HB3 ASN 74 -5.712 9.971 -3.173
576 HD21 ASN 74 HD21 ASN 74 -3.980 9.726 -5.177
577 HD22 ASN 74 HD22 ASN 74 -2.311 9.924 -4.660
578 H MET 75 H MET 75 -3.269 9.486 -0.025
579 HA MET 75 HA MET 75 -4.763 11.561 1.522
580 HB2 MET 75 HB2 MET 75 -2.118 10.371 2.381
581 HB3 MET 75 HB3 MET 75 -3.248 11.366 3.293
582 HG2 MET 75 HG2 MET 75 -3.671 9.258 4.136
583 HG3 MET 75 HG3 MET 75 -4.931 9.417 2.912
584 HE1 MET 75 HE1 MET 75 -5.543 7.042 2.607
585 HE2 MET 75 HE2 MET 75 -4.421 5.676 2.466
586 HE3 MET 75 HE3 MET 75 -4.513 6.601 3.988
587 H ARG 76 H ARG 76 -1.331 11.176 0.620
588 HA ARG 76 HA ARG 76 -1.402 13.603 -1.016
589 HB2 ARG 76 HB2 ARG 76 -0.696 14.198 1.347
590 HB3 ARG 76 HB3 ARG 76 0.757 13.247 1.102
591 HG2 ARG 76 HG2 ARG 76 -0.113 15.637 -0.587
592 HG3 ARG 76 HG3 ARG 76 1.016 15.707 0.765
593 HD2 ARG 76 HD2 ARG 76 2.562 14.172 -0.454
594 HD3 ARG 76 HD3 ARG 76 1.480 14.220 -1.852
595 HE ARG 76 HE ARG 76 3.299 16.302 -0.935
596 HH11 ARG 76 HH11 ARG 76 0.445 15.656 -2.983
597 HH12 ARG 76 HH12 ARG 76 0.689 17.096 -3.947
598 HH21 ARG 76 HH21 ARG 76 3.566 18.150 -2.210
599 HH22 ARG 76 HH22 ARG 76 2.450 18.502 -3.510
600 H LEU 77 H LEU 77 1.139 11.300 0.211
601 HA LEU 77 HA LEU 77 2.411 9.762 -0.891
602 HB2 LEU 77 HB2 LEU 77 -0.341 9.384 -2.067
603 HB3 LEU 77 HB3 LEU 77 0.965 8.314 -2.497
604 HG LEU 77 HG LEU 77 1.150 7.347 -0.403
605 HD11 LEU 77 HD11 LEU 77 -0.048 8.040 1.633
606 HD12 LEU 77 HD12 LEU 77 -0.612 9.497 0.803
607 HD13 LEU 77 HD13 LEU 77 1.127 9.250 1.120
608 HD21 LEU 77 HD21 LEU 77 -1.074 6.506 0.070
609 HD22 LEU 77 HD22 LEU 77 -0.962 6.791 -1.674
610 HD23 LEU 77 HD23 LEU 77 -1.828 7.943 -0.656
611 H GLY 78 H GLY 78 3.376 11.914 -1.757
612 HA2 GLY 78 HA2 GLY 78 3.678 11.972 -4.702
613 HA3 GLY 78 HA3 GLY 78 4.542 12.966 -3.525
614 H ASP 79 H ASP 79 6.165 11.944 -5.416
615 HA ASP 79 HA ASP 79 6.863 9.225 -5.217
616 HB2 ASP 79 HB2 ASP 79 8.500 11.599 -6.184
617 HB3 ASP 79 HB3 ASP 79 9.065 9.939 -6.270
618 H ALA 80 H ALA 80 8.379 11.978 -3.454
619 HA ALA 80 HA ALA 80 10.435 10.338 -2.293
620 HB1 ALA 80 HB1 ALA 80 10.868 12.311 -0.888
621 HB2 ALA 80 HB2 ALA 80 10.641 12.776 -2.585
622 HB3 ALA 80 HB3 ALA 80 9.339 13.040 -1.408
623 H GLU 81 H GLU 81 7.211 11.383 -1.069
624 HA GLU 81 HA GLU 81 7.399 10.315 1.522
625 HB2 GLU 81 HB2 GLU 81 5.891 12.105 0.571
626 HB3 GLU 81 HB3 GLU 81 4.974 10.850 -0.277
627 HG2 GLU 81 HG2 GLU 81 4.407 9.813 1.841
628 HG3 GLU 81 HG3 GLU 81 5.463 10.956 2.695
629 H VAL 82 H VAL 82 6.014 8.938 -1.509
630 HA VAL 82 HA VAL 82 5.334 6.369 -0.290
631 HB VAL 82 HB VAL 82 5.660 7.220 -3.199
632 HG11 VAL 82 HG11 VAL 82 4.391 5.086 -3.687
633 HG12 VAL 82 HG12 VAL 82 6.051 4.830 -3.144
634 HG13 VAL 82 HG13 VAL 82 4.703 4.580 -2.015
635 HG21 VAL 82 HG21 VAL 82 3.767 8.250 -2.003
636 HG22 VAL 82 HG22 VAL 82 3.172 7.059 -3.155
637 HG23 VAL 82 HG23 VAL 82 3.229 6.654 -1.433
638 H SER 83 H SER 83 8.234 7.588 -2.094
639 HA SER 83 HA SER 83 9.555 5.068 -2.284
640 HB2 SER 83 HB2 SER 83 10.296 6.990 -3.553
641 HB3 SER 83 HB3 SER 83 10.687 7.880 -2.068
642 HG SER 83 HG SER 83 12.490 6.977 -3.078
643 H ALA 84 H ALA 84 9.615 7.481 0.392
644 HA ALA 84 HA ALA 84 11.419 6.025 2.072
645 HB1 ALA 84 HB1 ALA 84 9.130 7.927 2.747
646 HB2 ALA 84 HB2 ALA 84 10.412 7.418 3.870
647 HB3 ALA 84 HB3 ALA 84 10.820 8.379 2.435
648 H LEU 85 H LEU 85 7.873 5.778 1.634
649 HA LEU 85 HA LEU 85 7.409 3.784 3.646
650 HB2 LEU 85 HB2 LEU 85 5.865 5.403 1.983
651 HB3 LEU 85 HB3 LEU 85 5.645 3.837 1.248
652 HG LEU 85 HG LEU 85 3.844 4.248 2.739
653 HD11 LEU 85 HD11 LEU 85 3.916 2.404 4.315
654 HD12 LEU 85 HD12 LEU 85 5.682 2.343 4.230
655 HD13 LEU 85 HD13 LEU 85 4.714 1.918 2.802
656 HD21 LEU 85 HD21 LEU 85 4.054 4.762 5.099
657 HD22 LEU 85 HD22 LEU 85 4.928 5.966 4.139
658 HD23 LEU 85 HD23 LEU 85 5.826 4.699 5.000
659 H ILE 86 H ILE 86 8.364 3.539 0.238
660 HA ILE 86 HA ILE 86 8.054 0.659 -0.053
661 HB ILE 86 HB ILE 86 9.915 2.489 -1.599
662 HG12 ILE 86 HG12 ILE 86 7.858 3.358 -2.217
663 HG13 ILE 86 HG13 ILE 86 8.120 2.151 -3.425
664 HG21 ILE 86 HG21 ILE 86 9.872 0.681 -3.282
665 HG22 ILE 86 HG22 ILE 86 10.554 0.120 -1.764
666 HG23 ILE 86 HG23 ILE 86 8.889 -0.323 -2.189
667 HD11 ILE 86 HD11 ILE 86 6.265 1.925 -1.012
668 HD12 ILE 86 HD12 ILE 86 5.803 2.083 -2.706
669 HD13 ILE 86 HD13 ILE 86 6.588 0.590 -2.141
670 H SER 87 H SER 87 10.827 2.823 0.645
671 HA SER 87 HA SER 87 12.744 0.832 1.248
672 HB2 SER 87 HB2 SER 87 13.263 3.201 0.806
673 HB3 SER 87 HB3 SER 87 12.479 3.666 2.325
674 HG SER 87 HG SER 87 14.678 1.858 2.109
675 H TYR 88 H TYR 88 10.313 2.377 3.472
676 HA TYR 88 HA TYR 88 11.290 0.953 5.773
677 HB2 TYR 88 HB2 TYR 88 9.834 2.772 6.111
678 HB3 TYR 88 HB3 TYR 88 8.564 2.079 5.096
679 HD1 TYR 88 HD1 TYR 88 10.647 0.791 7.979
680 HD2 TYR 88 HD2 TYR 88 6.693 1.525 6.414
681 HE1 TYR 88 HE1 TYR 88 9.658 -0.372 9.930
682 HE2 TYR 88 HE2 TYR 88 5.705 0.397 8.411
683 HH TYR 88 HH TYR 88 7.746 -1.063 10.971
684 H LEU 89 H LEU 89 8.729 -0.019 3.399
685 HA LEU 89 HA LEU 89 8.220 -2.522 4.734
686 HB2 LEU 89 HB2 LEU 89 7.475 -1.264 2.112
687 HB3 LEU 89 HB3 LEU 89 7.379 -3.017 2.231
688 HG LEU 89 HG LEU 89 5.833 -2.960 4.049
689 HD11 LEU 89 HD11 LEU 89 6.521 -1.019 5.337
690 HD12 LEU 89 HD12 LEU 89 4.827 -0.829 4.875
691 HD13 LEU 89 HD13 LEU 89 6.096 0.061 3.998
692 HD21 LEU 89 HD21 LEU 89 5.012 -0.944 1.915
693 HD22 LEU 89 HD22 LEU 89 3.917 -1.922 2.928
694 HD23 LEU 89 HD23 LEU 89 4.967 -2.714 1.740
695 H GLU 90 H GLU 90 10.519 -1.727 2.074
696 HA GLU 90 HA GLU 90 11.448 -4.422 1.710
697 HB2 GLU 90 HB2 GLU 90 12.819 -1.725 1.326
698 HB3 GLU 90 HB3 GLU 90 13.605 -3.267 0.997
699 HG2 GLU 90 HG2 GLU 90 11.703 -3.817 -0.596
700 HG3 GLU 90 HG3 GLU 90 11.172 -2.144 -0.435
701 H GLU 91 H GLU 91 12.727 -1.826 3.894
702 HA GLU 91 HA GLU 91 14.745 -3.620 4.954
703 HB2 GLU 91 HB2 GLU 91 13.834 -0.826 5.716
704 HB3 GLU 91 HB3 GLU 91 15.142 -1.660 6.540
705 HG2 GLU 91 HG2 GLU 91 15.095 -1.116 3.531
706 HG3 GLU 91 HG3 GLU 91 15.920 -0.109 4.715
707 H GLU 92 H GLU 92 11.461 -2.928 5.982
708 HA GLU 92 HA GLU 92 11.721 -4.347 8.541
709 HB2 GLU 92 HB2 GLU 92 9.919 -2.622 7.976
710 HB3 GLU 92 HB3 GLU 92 9.224 -3.807 6.883
711 HG2 GLU 92 HG2 GLU 92 8.019 -3.854 8.967
712 HG3 GLU 92 HG3 GLU 92 8.898 -5.370 8.807
713 H THR 93 H THR 93 10.700 -5.211 5.194
714 HA THR 93 HA THR 93 10.074 -7.956 5.807
715 HB THR 93 HB THR 93 10.885 -6.610 3.208
716 HG1 THR 93 HG1 THR 93 9.031 -5.838 3.743
717 HG21 THR 93 HG21 THR 93 11.271 -8.976 2.957
718 HG22 THR 93 HG22 THR 93 9.792 -8.530 2.102
719 HG23 THR 93 HG23 THR 93 9.688 -9.368 3.677
720 H ALA 94 H ALA 94 13.167 -6.358 5.002
721 HA ALA 94 HA ALA 94 14.748 -8.740 4.961
722 HB1 ALA 94 HB1 ALA 94 16.624 -7.203 5.364
723 HB2 ALA 94 HB2 ALA 94 15.503 -6.556 4.156
724 HB3 ALA 94 HB3 ALA 94 15.490 -5.912 5.814
725 H ARG 95 H ARG 95 13.356 -7.000 7.698
726 HA ARG 95 HA ARG 95 14.918 -8.457 9.714
727 HB2 ARG 95 HB2 ARG 95 14.172 -6.099 10.030
728 HB3 ARG 95 HB3 ARG 95 12.494 -6.663 10.111
729 HG2 ARG 95 HG2 ARG 95 13.032 -8.045 12.088
730 HG3 ARG 95 HG3 ARG 95 14.739 -7.568 11.968
731 HD2 ARG 95 HD2 ARG 95 14.092 -5.198 12.324
732 HD3 ARG 95 HD3 ARG 95 12.393 -5.687 12.474
733 HE ARG 95 HE ARG 95 13.782 -7.240 14.321
734 HH11 ARG 95 HH11 ARG 95 13.277 -3.742 13.834
735 HH12 ARG 95 HH12 ARG 95 13.445 -3.377 15.537
736 HH21 ARG 95 HH21 ARG 95 13.992 -6.718 16.517
737 HH22 ARG 95 HH22 ARG 95 13.845 -5.059 17.053
738 H LEU 96 H LEU 96 11.639 -8.500 8.401
739 HA LEU 96 HA LEU 96 10.047 -10.051 8.158
740 HB2 LEU 96 HB2 LEU 96 12.208 -11.228 7.340
741 HB3 LEU 96 HB3 LEU 96 12.050 -12.227 8.729
742 HG LEU 96 HG LEU 96 11.263 -13.405 6.886
743 HD11 LEU 96 HD11 LEU 96 8.996 -13.921 7.454
744 HD12 LEU 96 HD12 LEU 96 8.793 -12.329 8.226
745 HD13 LEU 96 HD13 LEU 96 9.894 -13.534 8.946
746 HD21 LEU 96 HD21 LEU 96 9.493 -12.551 5.395
747 HD22 LEU 96 HD22 LEU 96 10.963 -11.547 5.396
748 HD23 LEU 96 HD23 LEU 96 9.525 -10.999 6.269
749 H GLN 97 H GLN 97 11.869 -11.189 11.034
750 HA GLN 97 HA GLN 97 10.007 -13.135 11.566
751 HB2 GLN 97 HB2 GLN 97 11.993 -11.867 13.494
752 HB3 GLN 97 HB3 GLN 97 11.136 -13.386 13.777
753 HG2 GLN 97 HG2 GLN 97 12.160 -14.317 11.674
754 HG3 GLN 97 HG3 GLN 97 13.111 -12.840 11.520
755 HE21 GLN 97 HE21 GLN 97 15.055 -12.710 12.700
756 HE22 GLN 97 HE22 GLN 97 15.536 -13.898 13.901
757 H THR 98 H THR 98 10.055 -10.001 13.366
758 HA THR 98 HA THR 98 8.850 -9.327 15.219
759 HB THR 98 HB THR 98 6.471 -10.603 13.880
760 HG1 THR 98 HG1 THR 98 6.942 -9.312 12.379
761 HG21 THR 98 HG21 THR 98 6.771 -8.251 15.795
762 HG22 THR 98 HG22 THR 98 5.941 -9.788 16.110
763 HG23 THR 98 HG23 THR 98 5.279 -8.664 14.925
764 HA PRO 99 HA PRO 99 9.114 -13.550 17.066
765 HB2 PRO 99 HB2 PRO 99 11.246 -13.305 18.705
766 HB3 PRO 99 HB3 PRO 99 11.420 -13.373 16.932
767 HG2 PRO 99 HG2 PRO 99 11.293 -10.876 18.663
768 HG3 PRO 99 HG3 PRO 99 12.554 -11.317 17.462
769 HD2 PRO 99 HD2 PRO 99 10.442 -9.703 16.827
770 HD3 PRO 99 HD3 PRO 99 11.119 -10.873 15.653
771 H VAL 100 H VAL 100 7.075 -11.880 17.751
772 HA VAL 100 HA VAL 100 7.006 -11.498 20.718
773 HB VAL 100 HB VAL 100 6.548 -9.454 18.498
774 HG11 VAL 100 HG11 VAL 100 6.108 -7.817 20.277
775 HG12 VAL 100 HG12 VAL 100 4.911 -9.107 20.346
776 HG13 VAL 100 HG13 VAL 100 6.254 -9.076 21.513
777 HG21 VAL 100 HG21 VAL 100 8.350 -8.182 19.643
778 HG22 VAL 100 HG22 VAL 100 8.628 -9.566 20.721
779 HG23 VAL 100 HG23 VAL 100 8.926 -9.701 18.975
780 H THR 101 H THR 101 4.999 -12.059 21.603
781 HA THR 101 HA THR 101 3.200 -13.403 19.781
782 HB THR 101 HB THR 101 1.935 -14.156 21.642
783 HG1 THR 101 HG1 THR 101 1.808 -12.463 23.000
784 HG21 THR 101 HG21 THR 101 3.620 -15.339 22.909
785 HG22 THR 101 HG22 THR 101 4.874 -14.178 22.430
786 HG23 THR 101 HG23 THR 101 4.130 -15.246 21.214
787 H ASN 102 H ASN 102 2.793 -10.403 21.665
788 HA ASN 102 HA ASN 102 -0.011 -10.153 20.660
789 HB2 ASN 102 HB2 ASN 102 1.407 -8.783 22.985
790 HB3 ASN 102 HB3 ASN 102 -0.305 -8.671 22.599
791 HD21 ASN 102 HD21 ASN 102 0.242 -9.375 25.132
792 HD22 ASN 102 HD22 ASN 102 -0.098 -11.093 25.330
793 H ARG 103 H ARG 103 -0.781 -7.826 20.215
794 HA ARG 103 HA ARG 103 1.098 -6.425 18.489
795 HB2 ARG 103 HB2 ARG 103 -1.717 -5.840 19.416
796 HB3 ARG 103 HB3 ARG 103 -0.726 -4.570 18.693
797 HG2 ARG 103 HG2 ARG 103 -0.297 -6.110 16.716
798 HG3 ARG 103 HG3 ARG 103 -1.494 -7.215 17.406
799 HD2 ARG 103 HD2 ARG 103 -2.480 -5.802 15.660
800 HD3 ARG 103 HD3 ARG 103 -3.222 -5.447 17.233
801 HE ARG 103 HE ARG 103 -1.054 -3.676 16.881
802 HH11 ARG 103 HH11 ARG 103 -4.224 -4.230 15.345
803 HH12 ARG 103 HH12 ARG 103 -4.415 -2.549 14.904
804 HH21 ARG 103 HH21 ARG 103 -1.349 -1.518 16.307
805 HH22 ARG 103 HH22 ARG 103 -2.787 -1.014 15.448
806 H GLY 104 H GLY 104 2.268 -4.695 18.818
807 HA2 GLY 104 HA2 GLY 104 2.120 -3.096 21.336
808 HA3 GLY 104 HA3 GLY 104 3.681 -3.697 20.763
809 H ILE 105 H ILE 105 4.323 -1.437 20.606
810 HA ILE 105 HA ILE 105 4.437 0.665 19.762
811 HB ILE 105 HB ILE 105 5.140 0.718 17.392
812 HG12 ILE 105 HG12 ILE 105 3.862 -1.415 16.681
813 HG13 ILE 105 HG13 ILE 105 5.433 -1.047 16.011
814 HG21 ILE 105 HG21 ILE 105 6.556 -1.160 19.302
815 HG22 ILE 105 HG22 ILE 105 7.279 -0.383 17.880
816 HG23 ILE 105 HG23 ILE 105 6.691 0.608 19.217
817 HD11 ILE 105 HD11 ILE 105 5.171 -3.440 16.487
818 HD12 ILE 105 HD12 ILE 105 6.514 -2.742 17.394
819 HD13 ILE 105 HD13 ILE 105 4.980 -3.102 18.213
820 HA PRO 106 HA PRO 106 0.099 1.239 18.314
821 HB2 PRO 106 HB2 PRO 106 -1.018 2.452 20.437
822 HB3 PRO 106 HB3 PRO 106 -0.664 0.702 20.429
823 HG2 PRO 106 HG2 PRO 106 1.026 2.923 21.642
824 HG3 PRO 106 HG3 PRO 106 0.506 1.392 22.403
825 HD2 PRO 106 HD2 PRO 106 2.952 1.690 21.194
826 HD3 PRO 106 HD3 PRO 106 2.055 0.141 21.206
827 HHA HEC 107 HHA HEC 107 -4.959 -3.440 0.508
828 HHB HEC 107 HHB HEC 107 0.232 0.204 1.735
829 HHC HEC 107 HHC HEC 107 -3.512 4.381 4.977
830 HHD HEC 107 HHD HEC 107 -8.529 0.383 4.258
831 HMA1 HEC 107 HMA1 HEC 107 0.880 -1.973 1.037
832 HMA2 HEC 107 HMA2 HEC 107 0.291 -3.123 -0.153
833 HMA3 HEC 107 HMA3 HEC 107 0.442 -1.411 -0.594
834 HAA1 HEC 107 HAA1 HEC 107 -3.313 -4.047 -0.898
835 HAA2 HEC 107 HAA2 HEC 107 -1.608 -3.847 -1.205
836 HBA1 HEC 107 HBA1 HEC 107 -1.062 -5.001 0.932
837 HBA2 HEC 107 HBA2 HEC 107 -2.789 -5.196 1.263
838 HMB1 HEC 107 HMB1 HEC 107 1.520 3.433 3.221
839 HMB2 HEC 107 HMB2 HEC 107 1.532 1.853 4.006
840 HMB3 HEC 107 HMB3 HEC 107 1.490 1.989 2.239
841 HAB HEC 107 HAB HEC 107 -1.614 5.150 4.904
842 HBB1 HEC 107 HBB1 HEC 107 0.519 5.338 2.780
843 HBB2 HEC 107 HBB2 HEC 107 -1.201 5.695 2.549
844 HBB3 HEC 107 HBB3 HEC 107 -0.236 6.646 3.693
845 HMC1 HEC 107 HMC1 HEC 107 -6.783 4.791 6.801
846 HMC2 HEC 107 HMC2 HEC 107 -5.054 4.893 6.552
847 HMC3 HEC 107 HMC3 HEC 107 -6.172 5.542 5.332
848 HAC HEC 107 HAC HEC 107 -8.916 1.670 5.827
849 HBC1 HEC 107 HBC1 HEC 107 -8.851 4.693 5.884
850 HBC2 HEC 107 HBC2 HEC 107 -9.521 3.684 4.589
851 HBC3 HEC 107 HBC3 HEC 107 -10.234 3.637 6.210
852 HMD1 HEC 107 HMD1 HEC 107 -9.897 -0.981 2.729
853 HMD2 HEC 107 HMD2 HEC 107 -9.830 -2.713 2.479
854 HMD3 HEC 107 HMD3 HEC 107 -9.509 -2.064 4.091
855 HAD1 HEC 107 HAD1 HEC 107 -6.886 -4.548 1.101
856 HAD2 HEC 107 HAD2 HEC 107 -8.515 -4.174 1.604
857 HBD1 HEC 107 HBD1 HEC 107 -7.132 -3.086 -0.881
858 HBD2 HEC 107 HBD2 HEC 107 -8.439 -4.269 -0.821
Start of MODEL 9
1 H SER 1 H SER 1 13.291 7.679 7.577
2 HA SER 1 HA SER 1 10.936 9.261 8.251
3 HB2 SER 1 HB2 SER 1 12.491 8.873 5.679
4 HB3 SER 1 HB3 SER 1 11.015 9.854 5.769
5 HG SER 1 HG SER 1 13.020 11.035 6.120
6 H GLY 2 H GLY 2 11.406 6.309 6.261
7 HA2 GLY 2 HA2 GLY 2 8.746 5.986 5.308
8 HA3 GLY 2 HA3 GLY 2 9.889 4.714 5.647
9 H GLU 3 H GLU 3 10.162 5.004 8.481
10 HA GLU 3 HA GLU 3 7.794 3.780 9.525
11 HB2 GLU 3 HB2 GLU 3 10.131 3.562 10.439
12 HB3 GLU 3 HB3 GLU 3 10.008 5.204 11.064
13 HG2 GLU 3 HG2 GLU 3 8.107 4.567 12.493
14 HG3 GLU 3 HG3 GLU 3 8.107 2.936 11.807
15 H GLN 4 H GLN 4 8.995 7.156 9.823
16 HA GLN 4 HA GLN 4 6.856 8.175 11.432
17 HB2 GLN 4 HB2 GLN 4 8.699 9.478 9.390
18 HB3 GLN 4 HB3 GLN 4 7.615 10.395 10.430
19 HG2 GLN 4 HG2 GLN 4 8.761 9.746 12.420
20 HG3 GLN 4 HG3 GLN 4 9.676 8.486 11.609
21 HE21 GLN 4 HE21 GLN 4 11.032 10.327 13.157
22 HE22 GLN 4 HE22 GLN 4 11.945 11.414 12.102
23 H ILE 5 H ILE 5 7.190 7.851 7.904
24 HA ILE 5 HA ILE 5 4.655 9.041 7.200
25 HB ILE 5 HB ILE 5 6.545 7.151 5.748
26 HG12 ILE 5 HG12 ILE 5 5.993 10.097 5.167
27 HG13 ILE 5 HG13 ILE 5 7.181 9.647 6.370
28 HG21 ILE 5 HG21 ILE 5 4.155 8.695 4.614
29 HG22 ILE 5 HG22 ILE 5 5.308 7.724 3.682
30 HG23 ILE 5 HG23 ILE 5 4.218 6.935 4.819
31 HD11 ILE 5 HD11 ILE 5 7.260 8.858 3.449
32 HD12 ILE 5 HD12 ILE 5 8.301 10.034 4.270
33 HD13 ILE 5 HD13 ILE 5 8.418 8.310 4.671
34 H PHE 6 H PHE 6 5.634 5.582 7.740
35 HA PHE 6 HA PHE 6 3.025 4.518 7.317
36 HB2 PHE 6 HB2 PHE 6 5.104 3.177 7.371
37 HB3 PHE 6 HB3 PHE 6 5.261 3.471 9.098
38 HD1 PHE 6 HD1 PHE 6 3.020 1.957 6.505
39 HD2 PHE 6 HD2 PHE 6 4.089 2.083 10.679
40 HE1 PHE 6 HE1 PHE 6 1.454 0.081 6.968
41 HE2 PHE 6 HE2 PHE 6 2.541 0.195 11.131
42 HZ PHE 6 HZ PHE 6 1.206 -0.791 9.280
43 H ARG 7 H ARG 7 4.492 5.857 10.307
44 HA ARG 7 HA ARG 7 2.322 5.285 12.060
45 HB2 ARG 7 HB2 ARG 7 4.677 6.153 12.627
46 HB3 ARG 7 HB3 ARG 7 4.111 7.754 12.158
47 HG2 ARG 7 HG2 ARG 7 3.877 7.661 14.522
48 HG3 ARG 7 HG3 ARG 7 2.231 7.453 13.903
49 HD2 ARG 7 HD2 ARG 7 2.645 4.919 14.045
50 HD3 ARG 7 HD3 ARG 7 4.157 5.302 14.877
51 HE ARG 7 HE ARG 7 1.981 6.609 16.192
52 HH11 ARG 7 HH11 ARG 7 3.333 3.397 15.575
53 HH12 ARG 7 HH12 ARG 7 2.607 2.665 16.984
54 HH21 ARG 7 HH21 ARG 7 1.004 5.637 18.046
55 HH22 ARG 7 HH22 ARG 7 1.278 3.945 18.397
56 H THR 8 H THR 8 2.954 8.190 10.069
57 HA THR 8 HA THR 8 0.544 9.512 11.041
58 HB THR 8 HB THR 8 1.273 11.341 9.459
59 HG1 THR 8 HG1 THR 8 3.662 9.864 9.228
60 HG21 THR 8 HG21 THR 8 3.331 11.911 10.705
61 HG22 THR 8 HG22 THR 8 3.350 10.292 11.438
62 HG23 THR 8 HG23 THR 8 2.012 11.409 11.776
63 H ARG 9 H ARG 9 1.275 7.786 8.050
64 HA ARG 9 HA ARG 9 -1.306 8.690 6.873
65 HB2 ARG 9 HB2 ARG 9 0.939 7.057 5.665
66 HB3 ARG 9 HB3 ARG 9 -0.476 7.687 4.823
67 HG2 ARG 9 HG2 ARG 9 1.710 9.398 6.082
68 HG3 ARG 9 HG3 ARG 9 1.579 8.955 4.381
69 HD2 ARG 9 HD2 ARG 9 -0.693 10.074 4.331
70 HD3 ARG 9 HD3 ARG 9 -0.353 10.682 5.967
71 HE ARG 9 HE ARG 9 1.786 11.229 4.090
72 HH11 ARG 9 HH11 ARG 9 -1.371 12.463 5.189
73 HH12 ARG 9 HH12 ARG 9 -1.042 14.089 4.633
74 HH21 ARG 9 HH21 ARG 9 2.173 13.328 3.386
75 HH22 ARG 9 HH22 ARG 9 0.972 14.582 3.611
76 H CYS 10 H CYS 10 0.208 5.660 7.988
77 HA CYS 10 HA CYS 10 -2.005 4.124 6.699
78 HB2 CYS 10 HB2 CYS 10 0.783 3.202 7.366
79 HB3 CYS 10 HB3 CYS 10 -0.367 2.431 6.280
80 H SER 11 H SER 11 -0.691 4.611 9.858
81 HA SER 11 HA SER 11 -0.985 1.886 10.839
82 HB2 SER 11 HB2 SER 11 -0.418 4.548 12.182
83 HB3 SER 11 HB3 SER 11 -0.524 3.013 13.055
84 HG SER 11 HG SER 11 1.216 3.560 10.867
85 H SER 12 H SER 12 -3.290 4.454 10.458
86 HA SER 12 HA SER 12 -5.146 3.564 12.492
87 HB2 SER 12 HB2 SER 12 -6.705 5.081 11.495
88 HB3 SER 12 HB3 SER 12 -5.113 5.850 11.534
89 HG SER 12 HG SER 12 -5.989 6.208 9.522
90 H CYS 13 H CYS 13 -4.223 1.925 9.709
91 HA CYS 13 HA CYS 13 -6.686 0.248 9.820
92 HB2 CYS 13 HB2 CYS 13 -5.391 1.317 7.305
93 HB3 CYS 13 HB3 CYS 13 -6.649 0.091 7.342
94 H HIS 14 H HIS 14 -3.271 0.164 9.828
95 HA HIS 14 HA HIS 14 -3.221 -2.678 8.935
96 HB2 HIS 14 2HB HIS 14 -1.530 -0.379 7.886
97 HB3 HIS 14 3HB HIS 14 -1.069 -2.049 7.655
98 HD1 HIS 14 1HD HIS 14 -3.528 -3.494 6.590
99 HD2 HIS 14 2HD HIS 14 -2.258 0.373 5.664
100 HE1 HIS 14 1HE HIS 14 -4.493 -3.013 4.290
101 H THR 15 H THR 15 -1.062 -3.511 9.045
102 HA THR 15 HA THR 15 0.859 -2.547 11.015
103 HB THR 15 HB THR 15 1.268 -4.756 12.037
104 HG1 THR 15 HG1 THR 15 -1.268 -5.498 11.024
105 HG21 THR 15 HG21 THR 15 -0.567 -4.775 13.648
106 HG22 THR 15 HG22 THR 15 -1.515 -3.710 12.589
107 HG23 THR 15 HG23 THR 15 -0.008 -3.125 13.315
108 H VAL 16 H VAL 16 2.960 -3.870 10.745
109 HA VAL 16 HA VAL 16 3.133 -5.186 8.031
110 HB VAL 16 HB VAL 16 5.410 -3.765 9.451
111 HG11 VAL 16 HG11 VAL 16 6.546 -4.095 7.266
112 HG12 VAL 16 HG12 VAL 16 6.125 -5.642 7.999
113 HG13 VAL 16 HG13 VAL 16 5.143 -4.996 6.662
114 HG21 VAL 16 HG21 VAL 16 5.226 -2.123 7.576
115 HG22 VAL 16 HG22 VAL 16 3.694 -2.884 7.085
116 HG23 VAL 16 HG23 VAL 16 3.832 -2.077 8.655
117 H GLY 17 H GLY 17 2.731 -7.232 8.541
118 HA2 GLY 17 HA2 GLY 17 3.118 -9.370 9.321
119 HA3 GLY 17 HA3 GLY 17 4.568 -8.799 10.143
120 H ASN 18 H ASN 18 3.279 -6.841 11.820
121 HA ASN 18 HA ASN 18 3.315 -8.332 14.016
122 HB2 ASN 18 HB2 ASN 18 3.154 -5.649 13.550
123 HB3 ASN 18 HB3 ASN 18 1.625 -5.902 14.387
124 HD21 ASN 18 HD21 ASN 18 2.237 -7.792 16.384
125 HD22 ASN 18 HD22 ASN 18 3.533 -7.088 17.353
126 H THR 19 H THR 19 0.178 -7.522 12.483
127 HA THR 19 HA THR 19 -1.927 -8.359 12.829
128 HB THR 19 HB THR 19 -0.471 -10.974 13.312
129 HG1 THR 19 HG1 THR 19 0.450 -9.953 11.575
130 HG21 THR 19 HG21 THR 19 -2.947 -11.175 13.382
131 HG22 THR 19 HG22 THR 19 -2.305 -11.908 11.915
132 HG23 THR 19 HG23 THR 19 -3.073 -10.308 11.848
133 H GLU 20 H GLU 20 -1.711 -6.986 14.954
134 HA GLU 20 HA GLU 20 -1.896 -8.584 17.428
135 HB2 GLU 20 HB2 GLU 20 -2.028 -5.599 16.958
136 HB3 GLU 20 HB3 GLU 20 -2.026 -6.373 18.543
137 HG2 GLU 20 HG2 GLU 20 0.251 -6.629 16.523
138 HG3 GLU 20 HG3 GLU 20 0.170 -5.389 17.758
139 HA PRO 21 HA PRO 21 -6.246 -8.833 17.179
140 HB2 PRO 21 HB2 PRO 21 -7.021 -9.490 19.705
141 HB3 PRO 21 HB3 PRO 21 -6.026 -10.553 18.664
142 HG2 PRO 21 HG2 PRO 21 -5.093 -8.691 20.865
143 HG3 PRO 21 HG3 PRO 21 -4.603 -10.383 20.571
144 HD2 PRO 21 HD2 PRO 21 -3.104 -8.254 19.721
145 HD3 PRO 21 HD3 PRO 21 -3.187 -9.797 18.818
146 H GLY 22 H GLY 22 -7.574 -7.223 16.717
147 HA2 GLY 22 HA2 GLY 22 -9.067 -5.508 16.966
148 HA3 GLY 22 HA3 GLY 22 -8.776 -5.516 18.704
149 H GLN 23 H GLN 23 -5.752 -5.019 17.766
150 HA GLN 23 HA GLN 23 -5.817 -2.185 18.262
151 HB2 GLN 23 HB2 GLN 23 -3.469 -3.858 17.316
152 HB3 GLN 23 HB3 GLN 23 -3.385 -2.278 18.060
153 HG2 GLN 23 HG2 GLN 23 -4.450 -4.770 19.462
154 HG3 GLN 23 HG3 GLN 23 -2.798 -4.212 19.536
155 HE21 GLN 23 HE21 GLN 23 -3.781 -4.494 21.879
156 HE22 GLN 23 HE22 GLN 23 -4.129 -2.934 22.629
157 HA PRO 24 HA PRO 24 -4.053 -1.677 13.892
158 HB2 PRO 24 HB2 PRO 24 -5.421 -3.778 12.220
159 HB3 PRO 24 HB3 PRO 24 -3.738 -3.186 12.126
160 HG2 PRO 24 HG2 PRO 24 -4.295 -5.582 13.280
161 HG3 PRO 24 HG3 PRO 24 -3.126 -4.473 14.078
162 HD2 PRO 24 HD2 PRO 24 -6.073 -4.830 14.686
163 HD3 PRO 24 HD3 PRO 24 -4.668 -4.837 15.788
164 H GLY 25 H GLY 25 -7.153 -1.518 14.748
165 HA2 GLY 25 HA2 GLY 25 -9.047 -0.391 13.962
166 HA3 GLY 25 HA3 GLY 25 -8.037 0.324 12.709
167 H ILE 26 H ILE 26 -8.253 -0.385 10.703
168 HA ILE 26 HA ILE 26 -10.684 -1.789 10.150
169 HB ILE 26 HB ILE 26 -8.680 -0.185 8.619
170 HG12 ILE 26 HG12 ILE 26 -10.652 1.140 7.981
171 HG13 ILE 26 HG13 ILE 26 -11.716 -0.006 8.788
172 HG21 ILE 26 HG21 ILE 26 -9.002 -1.869 6.952
173 HG22 ILE 26 HG22 ILE 26 -10.753 -1.893 7.250
174 HG23 ILE 26 HG23 ILE 26 -9.997 -0.484 6.494
175 HD11 ILE 26 HD11 ILE 26 -11.320 2.092 10.073
176 HD12 ILE 26 HD12 ILE 26 -10.819 0.653 10.972
177 HD13 ILE 26 HD13 ILE 26 -9.596 1.685 10.185
178 H GLY 27 H GLY 27 -7.275 -2.795 9.480
179 HA2 GLY 27 HA2 GLY 27 -8.331 -5.276 8.179
180 HA3 GLY 27 HA3 GLY 27 -7.455 -4.062 7.264
181 HA PRO 28 HA PRO 28 -4.696 -7.423 8.797
182 HB2 PRO 28 HB2 PRO 28 -4.029 -8.662 6.500
183 HB3 PRO 28 HB3 PRO 28 -5.689 -8.776 7.159
184 HG2 PRO 28 HG2 PRO 28 -4.661 -6.852 5.044
185 HG3 PRO 28 HG3 PRO 28 -6.080 -7.939 4.931
186 HD2 PRO 28 HD2 PRO 28 -6.304 -5.320 5.691
187 HD3 PRO 28 HD3 PRO 28 -7.351 -6.598 6.376
188 H ASP 29 H ASP 29 -2.429 -8.111 8.189
189 HA ASP 29 HA ASP 29 -0.770 -5.778 8.229
190 HB2 ASP 29 HB2 ASP 29 0.874 -7.137 9.000
191 HB3 ASP 29 HB3 ASP 29 -0.534 -8.032 9.519
192 H LEU 30 H LEU 30 1.217 -5.488 6.984
193 HA LEU 30 HA LEU 30 0.920 -6.090 4.081
194 HB2 LEU 30 HB2 LEU 30 2.383 -3.806 5.440
195 HB3 LEU 30 HB3 LEU 30 2.068 -3.973 3.717
196 HG LEU 30 HG LEU 30 -0.023 -3.528 5.886
197 HD11 LEU 30 HD11 LEU 30 1.438 -1.588 5.358
198 HD12 LEU 30 HD12 LEU 30 -0.234 -1.311 4.854
199 HD13 LEU 30 HD13 LEU 30 1.005 -1.732 3.644
200 HD21 LEU 30 HD21 LEU 30 -1.067 -4.802 4.110
201 HD22 LEU 30 HD22 LEU 30 -0.269 -3.839 2.856
202 HD23 LEU 30 HD23 LEU 30 -1.538 -3.125 3.876
203 H LEU 31 H LEU 31 2.649 -7.722 6.167
204 HA LEU 31 HA LEU 31 5.400 -7.338 5.199
205 HB2 LEU 31 HB2 LEU 31 4.944 -7.987 7.408
206 HB3 LEU 31 HB3 LEU 31 4.189 -9.501 6.899
207 HG LEU 31 HG LEU 31 6.956 -8.908 5.904
208 HD11 LEU 31 HD11 LEU 31 7.103 -8.133 8.180
209 HD12 LEU 31 HD12 LEU 31 8.008 -9.647 7.986
210 HD13 LEU 31 HD13 LEU 31 6.421 -9.668 8.784
211 HD21 LEU 31 HD21 LEU 31 7.307 -11.298 6.311
212 HD22 LEU 31 HD22 LEU 31 5.862 -11.030 5.324
213 HD23 LEU 31 HD23 LEU 31 5.699 -11.411 7.047
214 H GLY 32 H GLY 32 6.461 -8.466 3.739
215 HA2 GLY 32 HA2 GLY 32 6.982 -9.827 1.948
216 HA3 GLY 32 HA3 GLY 32 5.709 -10.915 2.490
217 H VAL 33 H VAL 33 3.413 -9.014 1.927
218 HA VAL 33 HA VAL 33 2.927 -9.561 -0.759
219 HB VAL 33 HB VAL 33 1.156 -7.976 -0.664
220 HG11 VAL 33 HG11 VAL 33 0.829 -10.143 0.425
221 HG12 VAL 33 HG12 VAL 33 1.326 -9.432 1.980
222 HG13 VAL 33 HG13 VAL 33 -0.142 -8.853 1.155
223 HG21 VAL 33 HG21 VAL 33 2.104 -6.059 0.522
224 HG22 VAL 33 HG22 VAL 33 0.642 -6.611 1.331
225 HG23 VAL 33 HG23 VAL 33 2.223 -7.031 2.013
226 H THR 34 H THR 34 4.544 -6.750 0.605
227 HA THR 34 HA THR 34 4.762 -5.090 -1.635
228 HB THR 34 HB THR 34 5.459 -4.737 0.819
229 HG1 THR 34 HG1 THR 34 7.385 -3.554 -0.759
230 HG21 THR 34 HG21 THR 34 7.785 -4.919 1.378
231 HG22 THR 34 HG22 THR 34 8.197 -5.579 -0.211
232 HG23 THR 34 HG23 THR 34 7.204 -6.524 0.927
233 H ARG 35 H ARG 35 6.362 -8.156 -1.181
234 HA ARG 35 HA ARG 35 7.987 -7.634 -3.625
235 HB2 ARG 35 HB2 ARG 35 9.655 -9.128 -2.966
236 HB3 ARG 35 HB3 ARG 35 9.427 -7.926 -1.700
237 HG2 ARG 35 HG2 ARG 35 8.187 -9.570 -0.335
238 HG3 ARG 35 HG3 ARG 35 8.380 -10.798 -1.601
239 HD2 ARG 35 HD2 ARG 35 10.616 -9.424 -0.051
240 HD3 ARG 35 HD3 ARG 35 10.017 -11.064 0.237
241 HE ARG 35 HE ARG 35 10.719 -11.111 -2.416
242 HH11 ARG 35 HH11 ARG 35 12.516 -10.257 0.545
243 HH12 ARG 35 HH12 ARG 35 14.063 -10.690 -0.149
244 HH21 ARG 35 HH21 ARG 35 12.745 -11.650 -3.271
245 HH22 ARG 35 HH22 ARG 35 14.192 -11.475 -2.303
246 H GLN 36 H GLN 36 5.611 -9.771 -2.187
247 HA GLN 36 HA GLN 36 5.780 -11.748 -4.326
248 HB2 GLN 36 HB2 GLN 36 3.806 -11.271 -2.070
249 HB3 GLN 36 HB3 GLN 36 3.577 -12.540 -3.270
250 HG2 GLN 36 HG2 GLN 36 6.016 -12.282 -1.465
251 HG3 GLN 36 HG3 GLN 36 4.662 -13.365 -1.186
252 HE21 GLN 36 HE21 GLN 36 7.514 -14.016 -1.605
253 HE22 GLN 36 HE22 GLN 36 7.617 -14.980 -3.086
254 H ARG 37 H ARG 37 3.748 -8.829 -3.851
255 HA ARG 37 HA ARG 37 2.396 -9.407 -6.442
256 HB2 ARG 37 HB2 ARG 37 1.921 -7.093 -4.549
257 HB3 ARG 37 HB3 ARG 37 1.086 -7.415 -6.075
258 HG2 ARG 37 HG2 ARG 37 0.631 -9.808 -4.961
259 HG3 ARG 37 HG3 ARG 37 0.909 -8.908 -3.463
260 HD2 ARG 37 HD2 ARG 37 -0.853 -7.238 -4.348
261 HD3 ARG 37 HD3 ARG 37 -1.210 -8.419 -5.603
262 HE ARG 37 HE ARG 37 -1.742 -8.613 -2.701
263 HH11 ARG 37 HH11 ARG 37 -1.942 -10.309 -5.837
264 HH12 ARG 37 HH12 ARG 37 -3.096 -11.476 -5.233
265 HH21 ARG 37 HH21 ARG 37 -3.226 -10.128 -1.982
266 HH22 ARG 37 HH22 ARG 37 -3.824 -11.373 -3.057
267 H ASP 38 H ASP 38 2.411 -7.698 -8.102
268 HA ASP 38 HA ASP 38 5.085 -7.685 -8.964
269 HB2 ASP 38 HB2 ASP 38 2.552 -6.521 -10.142
270 HB3 ASP 38 HB3 ASP 38 4.110 -6.466 -10.977
271 H ALA 39 H ALA 39 6.611 -6.180 -9.565
272 HA ALA 39 HA ALA 39 6.975 -4.517 -7.322
273 HB1 ALA 39 HB1 ALA 39 8.719 -4.811 -9.793
274 HB2 ALA 39 HB2 ALA 39 9.223 -4.257 -8.186
275 HB3 ALA 39 HB3 ALA 39 8.698 -5.941 -8.407
276 H ASN 40 H ASN 40 5.924 -3.518 -10.502
277 HA ASN 40 HA ASN 40 6.331 -0.664 -9.710
278 HB2 ASN 40 HB2 ASN 40 5.677 -1.918 -12.398
279 HB3 ASN 40 HB3 ASN 40 5.443 -0.212 -12.060
280 HD21 ASN 40 HD21 ASN 40 6.956 -0.489 -14.082
281 HD22 ASN 40 HD22 ASN 40 8.666 -0.297 -13.683
282 H TRP 41 H TRP 41 3.810 -3.038 -10.651
283 HA TRP 41 HA TRP 41 1.481 -1.566 -10.390
284 HB2 TRP 41 HB2 TRP 41 1.587 -3.935 -11.050
285 HB3 TRP 41 HB3 TRP 41 2.038 -4.394 -9.411
286 HD1 TRP 41 HD1 TRP 41 -0.931 -3.350 -11.513
287 HE1 TRP 41 HE1 TRP 41 -3.122 -3.711 -10.261
288 HE3 TRP 41 HE3 TRP 41 0.980 -4.608 -6.905
289 HZ2 TRP 41 HZ2 TRP 41 -3.942 -4.317 -7.547
290 HZ3 TRP 41 HZ3 TRP 41 -0.560 -4.976 -4.969
291 HH2 TRP 41 HH2 TRP 41 -3.005 -4.829 -5.292
292 H LEU 42 H LEU 42 3.191 -3.173 -7.681
293 HA LEU 42 HA LEU 42 1.495 -2.479 -5.567
294 HB2 LEU 42 HB2 LEU 42 3.320 -4.112 -5.553
295 HB3 LEU 42 HB3 LEU 42 4.525 -2.857 -5.714
296 HG LEU 42 HG LEU 42 4.314 -3.963 -3.498
297 HD11 LEU 42 HD11 LEU 42 4.721 -2.050 -2.144
298 HD12 LEU 42 HD12 LEU 42 3.885 -0.968 -3.263
299 HD13 LEU 42 HD13 LEU 42 5.410 -1.749 -3.740
300 HD21 LEU 42 HD21 LEU 42 1.845 -4.089 -3.376
301 HD22 LEU 42 HD22 LEU 42 1.780 -2.324 -3.140
302 HD23 LEU 42 HD23 LEU 42 2.580 -3.368 -1.939
303 H VAL 43 H VAL 43 4.063 -0.531 -7.056
304 HA VAL 43 HA VAL 43 3.959 1.532 -5.005
305 HB VAL 43 HB VAL 43 5.423 1.651 -7.663
306 HG11 VAL 43 HG11 VAL 43 6.940 3.172 -6.414
307 HG12 VAL 43 HG12 VAL 43 5.300 3.817 -6.478
308 HG13 VAL 43 HG13 VAL 43 5.890 3.051 -4.988
309 HG21 VAL 43 HG21 VAL 43 7.412 0.878 -6.275
310 HG22 VAL 43 HG22 VAL 43 6.267 0.435 -4.992
311 HG23 VAL 43 HG23 VAL 43 6.196 -0.366 -6.568
312 H ARG 44 H ARG 44 2.517 1.115 -8.227
313 HA ARG 44 HA ARG 44 1.300 3.774 -8.201
314 HB2 ARG 44 HB2 ARG 44 1.592 2.482 -10.290
315 HB3 ARG 44 HB3 ARG 44 0.402 1.295 -9.718
316 HG2 ARG 44 HG2 ARG 44 -1.316 3.084 -9.585
317 HG3 ARG 44 HG3 ARG 44 -0.117 4.288 -10.076
318 HD2 ARG 44 HD2 ARG 44 0.082 3.254 -12.281
319 HD3 ARG 44 HD3 ARG 44 -0.948 1.904 -11.776
320 HE ARG 44 HE ARG 44 -2.819 3.163 -12.100
321 HH11 ARG 44 HH11 ARG 44 -0.062 5.428 -12.087
322 HH12 ARG 44 HH12 ARG 44 -1.058 6.798 -12.526
323 HH21 ARG 44 HH21 ARG 44 -4.062 4.953 -12.651
324 HH22 ARG 44 HH22 ARG 44 -3.325 6.527 -12.845
325 H TRP 45 H TRP 45 0.180 0.488 -7.283
326 HA TRP 45 HA TRP 45 -2.456 1.088 -6.539
327 HB2 TRP 45 HB2 TRP 45 -1.792 -1.193 -6.730
328 HB3 TRP 45 HB3 TRP 45 -0.464 -0.988 -5.607
329 HD1 TRP 45 HD1 TRP 45 -0.855 -2.204 -3.507
330 HE1 TRP 45 HE1 TRP 45 -2.814 -2.789 -1.967
331 HE3 TRP 45 HE3 TRP 45 -4.594 0.234 -6.002
332 HZ2 TRP 45 HZ2 TRP 45 -5.677 -2.298 -1.858
333 HZ3 TRP 45 HZ3 TRP 45 -6.917 0.166 -5.178
334 HH2 TRP 45 HH2 TRP 45 -7.485 -1.109 -3.111
335 H LEU 46 H LEU 46 0.371 0.971 -4.283
336 HA LEU 46 HA LEU 46 -1.306 1.947 -2.151
337 HB2 LEU 46 HB2 LEU 46 0.221 1.133 -0.834
338 HB3 LEU 46 HB3 LEU 46 1.000 0.483 -2.269
339 HG LEU 46 HG LEU 46 1.774 3.060 -0.838
340 HD11 LEU 46 HD11 LEU 46 2.324 0.888 0.320
341 HD12 LEU 46 HD12 LEU 46 3.748 1.814 -0.180
342 HD13 LEU 46 HD13 LEU 46 3.228 0.393 -1.114
343 HD21 LEU 46 HD21 LEU 46 3.721 3.018 -2.335
344 HD22 LEU 46 HD22 LEU 46 2.266 3.148 -3.315
345 HD23 LEU 46 HD23 LEU 46 3.065 1.579 -3.151
346 H LYS 47 H LYS 47 -0.039 3.663 -4.679
347 HA LYS 47 HA LYS 47 0.216 6.225 -3.186
348 HB2 LYS 47 HB2 LYS 47 2.060 5.678 -4.672
349 HB3 LYS 47 HB3 LYS 47 0.950 5.435 -6.030
350 HG2 LYS 47 HG2 LYS 47 0.357 7.801 -6.049
351 HG3 LYS 47 HG3 LYS 47 1.277 8.089 -4.570
352 HD2 LYS 47 HD2 LYS 47 2.431 8.901 -6.587
353 HD3 LYS 47 HD3 LYS 47 3.382 7.678 -5.732
354 HE2 LYS 47 HE2 LYS 47 2.837 5.979 -7.357
355 HE3 LYS 47 HE3 LYS 47 1.615 7.005 -8.125
356 HZ1 LYS 47 HZ1 LYS 47 3.295 8.429 -8.958
357 HZ2 LYS 47 HZ2 LYS 47 3.812 6.893 -9.289
358 HZ3 LYS 47 HZ3 LYS 47 4.476 7.787 -8.066
359 H VAL 48 H VAL 48 -1.657 4.850 -5.958
360 HA VAL 48 HA VAL 48 -3.664 7.009 -5.471
361 HB VAL 48 HB VAL 48 -2.107 7.561 -7.294
362 HG11 VAL 48 HG11 VAL 48 -1.906 5.330 -8.374
363 HG12 VAL 48 HG12 VAL 48 -3.550 5.532 -9.021
364 HG13 VAL 48 HG13 VAL 48 -2.273 6.665 -9.475
365 HG21 VAL 48 HG21 VAL 48 -5.082 7.475 -7.758
366 HG22 VAL 48 HG22 VAL 48 -4.093 8.768 -7.084
367 HG23 VAL 48 HG23 VAL 48 -3.952 8.368 -8.804
368 HA PRO 49 HA PRO 49 -5.379 2.655 -5.554
369 HB2 PRO 49 HB2 PRO 49 -6.557 2.585 -3.051
370 HB3 PRO 49 HB3 PRO 49 -4.831 2.243 -3.335
371 HG2 PRO 49 HG2 PRO 49 -6.082 4.894 -2.513
372 HG3 PRO 49 HG3 PRO 49 -4.692 4.051 -1.748
373 HD2 PRO 49 HD2 PRO 49 -4.309 6.028 -3.508
374 HD3 PRO 49 HD3 PRO 49 -3.284 4.561 -3.543
375 H ASP 50 H ASP 50 -6.985 5.778 -5.019
376 HA ASP 50 HA ASP 50 -9.678 4.582 -5.323
377 HB2 ASP 50 HB2 ASP 50 -9.062 6.628 -3.896
378 HB3 ASP 50 HB3 ASP 50 -9.015 7.531 -5.422
379 H GLN 51 H GLN 51 -7.283 6.312 -7.357
380 HA GLN 51 HA GLN 51 -9.011 6.308 -9.684
381 HB2 GLN 51 HB2 GLN 51 -7.065 7.886 -9.274
382 HB3 GLN 51 HB3 GLN 51 -5.981 6.509 -9.538
383 HG2 GLN 51 HG2 GLN 51 -6.185 7.854 -11.555
384 HG3 GLN 51 HG3 GLN 51 -6.804 6.224 -11.805
385 HE21 GLN 51 HE21 GLN 51 -8.225 6.818 -13.576
386 HE22 GLN 51 HE22 GLN 51 -9.673 7.768 -13.250
387 H MET 52 H MET 52 -6.596 4.019 -8.323
388 HA MET 52 HA MET 52 -6.431 2.355 -10.602
389 HB2 MET 52 HB2 MET 52 -4.898 2.269 -8.665
390 HB3 MET 52 HB3 MET 52 -6.176 1.532 -7.671
391 HG2 MET 52 HG2 MET 52 -6.285 -0.391 -9.124
392 HG3 MET 52 HG3 MET 52 -5.249 0.389 -10.316
393 HE1 MET 52 HE1 MET 52 -1.703 -0.114 -9.105
394 HE2 MET 52 HE2 MET 52 -2.792 0.287 -10.453
395 HE3 MET 52 HE3 MET 52 -2.693 1.367 -9.039
396 H LEU 53 H LEU 53 -8.993 2.462 -8.137
397 HA LEU 53 HA LEU 53 -10.379 0.141 -9.312
398 HB2 LEU 53 HB2 LEU 53 -11.225 2.106 -7.161
399 HB3 LEU 53 HB3 LEU 53 -12.175 0.718 -7.689
400 HG LEU 53 HG LEU 53 -9.413 0.552 -6.421
401 HD11 LEU 53 HD11 LEU 53 -10.595 -0.328 -4.459
402 HD12 LEU 53 HD12 LEU 53 -12.154 -0.135 -5.289
403 HD13 LEU 53 HD13 LEU 53 -11.191 1.289 -4.859
404 HD21 LEU 53 HD21 LEU 53 -9.768 -1.390 -7.865
405 HD22 LEU 53 HD22 LEU 53 -11.363 -1.663 -7.119
406 HD23 LEU 53 HD23 LEU 53 -9.880 -1.857 -6.167
407 H ALA 54 H ALA 54 -10.234 3.535 -10.000
408 HA ALA 54 HA ALA 54 -12.776 3.593 -11.476
409 HB1 ALA 54 HB1 ALA 54 -11.869 5.585 -10.261
410 HB2 ALA 54 HB2 ALA 54 -10.513 5.626 -11.409
411 HB3 ALA 54 HB3 ALA 54 -12.171 5.878 -11.983
412 H GLU 55 H GLU 55 -9.292 3.281 -12.251
413 HA GLU 55 HA GLU 55 -9.729 3.034 -15.114
414 HB2 GLU 55 HB2 GLU 55 -7.408 2.576 -15.262
415 HB3 GLU 55 HB3 GLU 55 -7.584 3.787 -14.006
416 HG2 GLU 55 HG2 GLU 55 -7.339 2.028 -12.335
417 HG3 GLU 55 HG3 GLU 55 -7.237 0.783 -13.568
418 H LYS 56 H LYS 56 -10.488 0.981 -12.614
419 HA LYS 56 HA LYS 56 -10.690 -1.207 -12.187
420 HB2 LYS 56 HB2 LYS 56 -11.546 -1.481 -15.080
421 HB3 LYS 56 HB3 LYS 56 -11.880 -2.593 -13.752
422 HG2 LYS 56 HG2 LYS 56 -13.116 -0.646 -12.599
423 HG3 LYS 56 HG3 LYS 56 -12.958 0.216 -14.141
424 HD2 LYS 56 HD2 LYS 56 -13.989 -1.970 -15.188
425 HD3 LYS 56 HD3 LYS 56 -14.432 -2.379 -13.538
426 HE2 LYS 56 HE2 LYS 56 -16.316 -1.368 -14.614
427 HE3 LYS 56 HE3 LYS 56 -15.734 -0.232 -13.389
428 HZ1 LYS 56 HZ1 LYS 56 -16.255 0.674 -15.703
429 HZ2 LYS 56 HZ2 LYS 56 -14.859 -0.017 -16.216
430 HZ3 LYS 56 HZ3 LYS 56 -14.861 1.148 -15.022
431 H ASP 57 H ASP 57 -8.348 -1.086 -11.929
432 HA ASP 57 HA ASP 57 -6.714 -2.815 -13.695
433 HB2 ASP 57 HB2 ASP 57 -5.793 -0.800 -12.384
434 HB3 ASP 57 HB3 ASP 57 -6.008 -1.792 -10.932
435 HA PRO 58 HA PRO 58 -9.473 -5.553 -12.000
436 HB2 PRO 58 HB2 PRO 58 -8.896 -7.858 -13.326
437 HB3 PRO 58 HB3 PRO 58 -9.446 -6.318 -14.090
438 HG2 PRO 58 HG2 PRO 58 -6.525 -7.133 -13.786
439 HG3 PRO 58 HG3 PRO 58 -7.417 -6.867 -15.335
440 HD2 PRO 58 HD2 PRO 58 -6.045 -4.918 -14.126
441 HD3 PRO 58 HD3 PRO 58 -7.679 -4.569 -14.758
442 H LEU 59 H LEU 59 -6.118 -6.300 -11.568
443 HA LEU 59 HA LEU 59 -6.304 -8.324 -9.523
444 HB2 LEU 59 HB2 LEU 59 -4.249 -7.840 -10.790
445 HB3 LEU 59 HB3 LEU 59 -4.172 -6.221 -10.093
446 HG LEU 59 HG LEU 59 -3.733 -7.139 -7.865
447 HD11 LEU 59 HD11 LEU 59 -4.977 -9.250 -7.916
448 HD12 LEU 59 HD12 LEU 59 -3.281 -9.566 -7.566
449 HD13 LEU 59 HD13 LEU 59 -3.906 -9.880 -9.195
450 HD21 LEU 59 HD21 LEU 59 -1.970 -8.452 -9.980
451 HD22 LEU 59 HD22 LEU 59 -1.519 -8.089 -8.300
452 HD23 LEU 59 HD23 LEU 59 -1.838 -6.768 -9.428
453 H ALA 60 H ALA 60 -6.300 -4.701 -9.299
454 HA ALA 60 HA ALA 60 -6.562 -4.753 -6.386
455 HB1 ALA 60 HB1 ALA 60 -5.611 -2.804 -7.527
456 HB2 ALA 60 HB2 ALA 60 -7.156 -2.545 -8.386
457 HB3 ALA 60 HB3 ALA 60 -7.077 -2.395 -6.617
458 H MET 61 H MET 61 -8.786 -4.401 -9.164
459 HA MET 61 HA MET 61 -11.222 -4.003 -7.789
460 HB2 MET 61 HB2 MET 61 -10.725 -5.631 -10.307
461 HB3 MET 61 HB3 MET 61 -12.282 -5.056 -9.771
462 HG2 MET 61 HG2 MET 61 -9.955 -3.224 -10.458
463 HG3 MET 61 HG3 MET 61 -11.229 -3.679 -11.578
464 HE1 MET 61 HE1 MET 61 -14.348 -1.933 -10.293
465 HE2 MET 61 HE2 MET 61 -13.611 -3.227 -11.296
466 HE3 MET 61 HE3 MET 61 -13.897 -3.490 -9.560
467 H LEU 62 H LEU 62 -9.460 -7.053 -8.363
468 HA LEU 62 HA LEU 62 -11.418 -8.798 -7.142
469 HB2 LEU 62 HB2 LEU 62 -9.729 -9.459 -8.845
470 HB3 LEU 62 HB3 LEU 62 -8.457 -8.979 -7.705
471 HG LEU 62 HG LEU 62 -9.103 -10.752 -6.169
472 HD11 LEU 62 HD11 LEU 62 -11.516 -10.992 -6.668
473 HD12 LEU 62 HD12 LEU 62 -10.691 -12.542 -6.871
474 HD13 LEU 62 HD13 LEU 62 -11.132 -11.577 -8.297
475 HD21 LEU 62 HD21 LEU 62 -8.347 -12.663 -7.521
476 HD22 LEU 62 HD22 LEU 62 -7.431 -11.202 -7.927
477 HD23 LEU 62 HD23 LEU 62 -8.727 -11.772 -9.011
478 H LEU 63 H LEU 63 -8.289 -7.252 -6.026
479 HA LEU 63 HA LEU 63 -8.187 -8.779 -3.617
480 HB2 LEU 63 HB2 LEU 63 -6.327 -7.730 -4.858
481 HB3 LEU 63 HB3 LEU 63 -6.911 -6.124 -4.430
482 HG LEU 63 HG LEU 63 -5.947 -8.179 -2.392
483 HD11 LEU 63 HD11 LEU 63 -3.834 -6.919 -2.413
484 HD12 LEU 63 HD12 LEU 63 -4.460 -5.839 -3.677
485 HD13 LEU 63 HD13 LEU 63 -4.165 -7.551 -4.031
486 HD21 LEU 63 HD21 LEU 63 -7.267 -6.416 -1.342
487 HD22 LEU 63 HD22 LEU 63 -6.449 -5.171 -2.308
488 HD23 LEU 63 HD23 LEU 63 -5.567 -6.077 -1.042
489 H PHE 64 H PHE 64 -9.471 -5.576 -4.408
490 HA PHE 64 HA PHE 64 -10.081 -4.962 -1.609
491 HB2 PHE 64 HB2 PHE 64 -10.331 -2.894 -2.272
492 HB3 PHE 64 HB3 PHE 64 -9.793 -3.388 -3.855
493 HD1 PHE 64 HD1 PHE 64 -11.680 -4.198 -5.521
494 HD2 PHE 64 HD2 PHE 64 -12.408 -1.846 -1.997
495 HE1 PHE 64 HE1 PHE 64 -13.857 -3.450 -6.473
496 HE2 PHE 64 HE2 PHE 64 -14.564 -1.078 -2.946
497 HZ PHE 64 HZ PHE 64 -15.292 -1.874 -5.190
498 H GLU 65 H GLU 65 -11.933 -6.543 -4.205
499 HA GLU 65 HA GLU 65 -14.462 -6.439 -2.832
500 HB2 GLU 65 HB2 GLU 65 -14.456 -6.485 -5.193
501 HB3 GLU 65 HB3 GLU 65 -13.309 -7.837 -5.268
502 HG2 GLU 65 HG2 GLU 65 -14.868 -9.400 -4.578
503 HG3 GLU 65 HG3 GLU 65 -15.983 -8.170 -3.954
504 H GLN 66 H GLN 66 -11.877 -8.924 -3.221
505 HA GLN 66 HA GLN 66 -13.209 -10.933 -1.666
506 HB2 GLN 66 HB2 GLN 66 -10.264 -10.452 -2.288
507 HB3 GLN 66 HB3 GLN 66 -10.862 -11.890 -1.460
508 HG2 GLN 66 HG2 GLN 66 -11.720 -11.046 -4.264
509 HG3 GLN 66 HG3 GLN 66 -10.480 -12.242 -3.899
510 HE21 GLN 66 HE21 GLN 66 -11.185 -14.276 -2.763
511 HE22 GLN 66 HE22 GLN 66 -12.888 -14.745 -2.970
512 H TYR 67 H TYR 67 -10.951 -8.328 -0.684
513 HA TYR 67 HA TYR 67 -11.263 -9.000 2.152
514 HB2 TYR 67 HB2 TYR 67 -9.748 -6.869 0.645
515 HB3 TYR 67 HB3 TYR 67 -9.944 -6.795 2.386
516 HD1 TYR 67 HD1 TYR 67 -9.204 -8.659 3.866
517 HD2 TYR 67 HD2 TYR 67 -8.031 -8.403 -0.275
518 HE1 TYR 67 HE1 TYR 67 -7.253 -10.111 4.315
519 HE2 TYR 67 HE2 TYR 67 -6.020 -9.795 0.199
520 HH TYR 67 HH TYR 67 -5.328 -10.974 3.524
521 H ASN 68 H ASN 68 -13.699 -8.742 1.041
522 HA ASN 68 HA ASN 68 -15.761 -7.998 1.440
523 HB2 ASN 68 HB2 ASN 68 -14.551 -6.755 3.928
524 HB3 ASN 68 HB3 ASN 68 -16.256 -7.067 3.657
525 HD21 ASN 68 HD21 ASN 68 -15.881 -8.200 5.835
526 HD22 ASN 68 HD22 ASN 68 -15.512 -9.910 5.650
527 H ARG 69 H ARG 69 -14.532 -6.402 -0.462
528 HA ARG 69 HA ARG 69 -14.782 -4.445 -1.628
529 HB2 ARG 69 HB2 ARG 69 -17.487 -4.629 -0.284
530 HB3 ARG 69 HB3 ARG 69 -17.128 -3.425 -1.511
531 HG2 ARG 69 HG2 ARG 69 -16.784 -6.405 -2.007
532 HG3 ARG 69 HG3 ARG 69 -18.288 -5.544 -2.310
533 HD2 ARG 69 HD2 ARG 69 -15.630 -4.791 -3.604
534 HD3 ARG 69 HD3 ARG 69 -16.836 -5.842 -4.343
535 HE ARG 69 HE ARG 69 -16.965 -2.931 -3.956
536 HH11 ARG 69 HH11 ARG 69 -18.787 -5.848 -4.922
537 HH12 ARG 69 HH12 ARG 69 -20.012 -4.922 -5.763
538 HH21 ARG 69 HH21 ARG 69 -18.573 -1.786 -5.053
539 HH22 ARG 69 HH22 ARG 69 -19.889 -2.631 -5.836
540 H LEU 70 H LEU 70 -13.066 -3.880 0.230
541 HA LEU 70 HA LEU 70 -13.976 -1.353 1.565
542 HB2 LEU 70 HB2 LEU 70 -13.435 -3.505 2.903
543 HB3 LEU 70 HB3 LEU 70 -11.757 -3.078 2.628
544 HG LEU 70 HG LEU 70 -13.917 -1.408 3.999
545 HD11 LEU 70 HD11 LEU 70 -12.636 -1.785 6.019
546 HD12 LEU 70 HD12 LEU 70 -11.404 -2.694 5.100
547 HD13 LEU 70 HD13 LEU 70 -13.047 -3.329 5.271
548 HD21 LEU 70 HD21 LEU 70 -10.993 -0.688 3.526
549 HD22 LEU 70 HD22 LEU 70 -12.029 0.096 4.738
550 HD23 LEU 70 HD23 LEU 70 -12.438 0.228 3.040
551 H ALA 71 H ALA 71 -13.285 0.358 0.548
552 HA ALA 71 HA ALA 71 -10.843 0.428 -1.029
553 HB1 ALA 71 HB1 ALA 71 -11.740 2.669 -1.635
554 HB2 ALA 71 HB2 ALA 71 -12.926 1.374 -1.847
555 HB3 ALA 71 HB3 ALA 71 -13.032 2.461 -0.444
556 H MET 72 H MET 72 -9.411 2.337 -0.979
557 HA MET 72 HA MET 72 -9.064 3.697 1.580
558 HB2 MET 72 HB2 MET 72 -6.762 3.189 1.934
559 HB3 MET 72 HB3 MET 72 -7.645 1.671 1.807
560 HG2 MET 72 HG2 MET 72 -6.833 1.415 -0.537
561 HG3 MET 72 HG3 MET 72 -5.960 2.943 -0.370
562 HE1 MET 72 HE1 MET 72 -4.433 0.544 -1.451
563 HE2 MET 72 HE2 MET 72 -3.589 2.048 -1.022
564 HE3 MET 72 HE3 MET 72 -2.954 0.486 -0.466
565 HA PRO 73 HA PRO 73 -7.850 6.852 -1.365
566 HB2 PRO 73 HB2 PRO 73 -7.594 8.974 0.247
567 HB3 PRO 73 HB3 PRO 73 -9.098 8.006 0.268
568 HG2 PRO 73 HG2 PRO 73 -6.740 7.808 2.164
569 HG3 PRO 73 HG3 PRO 73 -8.477 7.948 2.578
570 HD2 PRO 73 HD2 PRO 73 -7.096 5.532 2.396
571 HD3 PRO 73 HD3 PRO 73 -8.857 5.716 2.137
572 H ASN 74 H ASN 74 -6.294 8.557 -1.910
573 HA ASN 74 HA ASN 74 -3.446 7.933 -1.659
574 HB2 ASN 74 HB2 ASN 74 -4.202 8.683 -3.782
575 HB3 ASN 74 HB3 ASN 74 -5.210 9.944 -3.113
576 HD21 ASN 74 HD21 ASN 74 -1.875 9.051 -3.821
577 HD22 ASN 74 HD22 ASN 74 -1.312 10.714 -3.963
578 H MET 75 H MET 75 -5.648 10.015 0.044
579 HA MET 75 HA MET 75 -5.485 11.659 1.553
580 HB2 MET 75 HB2 MET 75 -2.689 10.781 2.358
581 HB3 MET 75 HB3 MET 75 -3.911 11.644 3.284
582 HG2 MET 75 HG2 MET 75 -4.115 9.590 4.200
583 HG3 MET 75 HG3 MET 75 -5.270 9.370 2.883
584 HE1 MET 75 HE1 MET 75 -5.034 6.686 3.152
585 HE2 MET 75 HE2 MET 75 -3.471 5.850 3.211
586 HE3 MET 75 HE3 MET 75 -3.926 6.973 4.520
587 H ARG 76 H ARG 76 -2.060 11.854 1.034
588 HA ARG 76 HA ARG 76 -2.086 14.236 -0.668
589 HB2 ARG 76 HB2 ARG 76 -1.012 14.336 2.182
590 HB3 ARG 76 HB3 ARG 76 -0.757 15.592 0.982
591 HG2 ARG 76 HG2 ARG 76 -3.453 14.820 2.154
592 HG3 ARG 76 HG3 ARG 76 -2.471 16.182 2.642
593 HD2 ARG 76 HD2 ARG 76 -3.543 15.849 -0.192
594 HD3 ARG 76 HD3 ARG 76 -4.376 16.739 1.076
595 HE ARG 76 HE ARG 76 -1.941 17.525 -0.370
596 HH11 ARG 76 HH11 ARG 76 -4.097 18.280 2.375
597 HH12 ARG 76 HH12 ARG 76 -3.526 19.928 2.499
598 HH21 ARG 76 HH21 ARG 76 -1.240 19.668 -0.167
599 HH22 ARG 76 HH22 ARG 76 -1.915 20.711 1.067
600 H LEU 77 H LEU 77 -0.957 11.375 -0.597
601 HA LEU 77 HA LEU 77 1.736 11.360 0.241
602 HB2 LEU 77 HB2 LEU 77 0.176 9.679 -1.746
603 HB3 LEU 77 HB3 LEU 77 1.850 9.321 -1.364
604 HG LEU 77 HG LEU 77 -0.319 9.437 0.770
605 HD11 LEU 77 HD11 LEU 77 0.832 7.013 -0.690
606 HD12 LEU 77 HD12 LEU 77 -0.798 7.682 -0.927
607 HD13 LEU 77 HD13 LEU 77 -0.358 6.997 0.631
608 HD21 LEU 77 HD21 LEU 77 1.939 9.686 1.685
609 HD22 LEU 77 HD22 LEU 77 2.500 8.277 0.755
610 HD23 LEU 77 HD23 LEU 77 1.311 8.078 2.055
611 H GLY 78 H GLY 78 3.597 12.123 -0.522
612 HA2 GLY 78 HA2 GLY 78 3.877 13.005 -3.356
613 HA3 GLY 78 HA3 GLY 78 4.977 13.351 -2.029
614 H ASP 79 H ASP 79 5.457 12.127 -4.754
615 HA ASP 79 HA ASP 79 6.001 9.348 -4.638
616 HB2 ASP 79 HB2 ASP 79 7.254 11.615 -6.220
617 HB3 ASP 79 HB3 ASP 79 7.793 9.946 -6.396
618 H ALA 80 H ALA 80 8.032 12.014 -3.374
619 HA ALA 80 HA ALA 80 10.320 10.269 -2.862
620 HB1 ALA 80 HB1 ALA 80 10.524 12.689 -3.346
621 HB2 ALA 80 HB2 ALA 80 9.683 13.060 -1.824
622 HB3 ALA 80 HB3 ALA 80 11.261 12.243 -1.795
623 H GLU 81 H GLU 81 7.392 11.028 -1.096
624 HA GLU 81 HA GLU 81 8.452 9.905 1.431
625 HB2 GLU 81 HB2 GLU 81 6.870 11.019 2.474
626 HB3 GLU 81 HB3 GLU 81 6.642 11.892 0.982
627 HG2 GLU 81 HG2 GLU 81 4.761 10.311 0.402
628 HG3 GLU 81 HG3 GLU 81 4.989 9.530 1.970
629 H VAL 82 H VAL 82 6.212 9.043 -1.195
630 HA VAL 82 HA VAL 82 5.566 6.373 -0.407
631 HB VAL 82 HB VAL 82 5.900 7.702 -3.121
632 HG11 VAL 82 HG11 VAL 82 6.222 5.322 -3.545
633 HG12 VAL 82 HG12 VAL 82 4.817 4.931 -2.527
634 HG13 VAL 82 HG13 VAL 82 4.607 5.790 -4.068
635 HG21 VAL 82 HG21 VAL 82 4.021 8.477 -1.658
636 HG22 VAL 82 HG22 VAL 82 3.447 7.671 -3.122
637 HG23 VAL 82 HG23 VAL 82 3.426 6.809 -1.570
638 H SER 83 H SER 83 8.498 7.616 -2.125
639 HA SER 83 HA SER 83 9.774 5.125 -2.555
640 HB2 SER 83 HB2 SER 83 10.539 7.242 -3.525
641 HB3 SER 83 HB3 SER 83 10.980 7.847 -1.915
642 HG SER 83 HG SER 83 12.064 5.589 -3.280
643 H ALA 84 H ALA 84 9.934 7.214 0.372
644 HA ALA 84 HA ALA 84 11.720 5.473 1.839
645 HB1 ALA 84 HB1 ALA 84 11.092 6.908 3.731
646 HB2 ALA 84 HB2 ALA 84 11.435 7.894 2.297
647 HB3 ALA 84 HB3 ALA 84 9.753 7.605 2.790
648 H LEU 85 H LEU 85 8.168 5.703 1.566
649 HA LEU 85 HA LEU 85 7.558 3.725 3.551
650 HB2 LEU 85 HB2 LEU 85 6.157 5.612 2.618
651 HB3 LEU 85 HB3 LEU 85 5.944 4.667 1.150
652 HG LEU 85 HG LEU 85 4.704 2.946 2.412
653 HD11 LEU 85 HD11 LEU 85 3.990 3.484 4.769
654 HD12 LEU 85 HD12 LEU 85 5.217 4.766 4.810
655 HD13 LEU 85 HD13 LEU 85 5.702 3.070 4.630
656 HD21 LEU 85 HD21 LEU 85 3.858 5.860 2.732
657 HD22 LEU 85 HD22 LEU 85 2.776 4.511 3.035
658 HD23 LEU 85 HD23 LEU 85 3.454 4.750 1.413
659 H ILE 86 H ILE 86 8.176 3.494 0.084
660 HA ILE 86 HA ILE 86 7.597 0.693 -0.343
661 HB ILE 86 HB ILE 86 8.704 2.937 -1.855
662 HG12 ILE 86 HG12 ILE 86 7.774 1.713 -3.741
663 HG13 ILE 86 HG13 ILE 86 7.563 0.262 -2.748
664 HG21 ILE 86 HG21 ILE 86 10.087 0.290 -2.377
665 HG22 ILE 86 HG22 ILE 86 10.080 1.695 -3.459
666 HG23 ILE 86 HG23 ILE 86 10.862 1.823 -1.893
667 HD11 ILE 86 HD11 ILE 86 5.868 1.444 -1.376
668 HD12 ILE 86 HD12 ILE 86 6.164 2.932 -2.304
669 HD13 ILE 86 HD13 ILE 86 5.459 1.505 -3.090
670 H SER 87 H SER 87 10.512 2.480 0.557
671 HA SER 87 HA SER 87 12.230 0.202 0.906
672 HB2 SER 87 HB2 SER 87 12.389 2.927 2.250
673 HB3 SER 87 HB3 SER 87 13.689 1.740 2.092
674 HG SER 87 HG SER 87 12.408 3.233 0.030
675 H TYR 88 H TYR 88 10.077 2.007 3.193
676 HA TYR 88 HA TYR 88 10.867 0.600 5.515
677 HB2 TYR 88 HB2 TYR 88 9.539 2.662 5.518
678 HB3 TYR 88 HB3 TYR 88 8.135 1.780 4.930
679 HD1 TYR 88 HD2 TYR 88 10.601 1.977 7.753
680 HD2 TYR 88 HD1 TYR 88 6.692 0.667 6.492
681 HE1 TYR 88 HE2 TYR 88 10.078 1.265 10.082
682 HE2 TYR 88 HE1 TYR 88 6.172 -0.029 8.829
683 HH TYR 88 HH TYR 88 7.083 -0.407 10.951
684 H LEU 89 H LEU 89 8.144 -0.218 3.298
685 HA LEU 89 HA LEU 89 7.291 -2.491 4.783
686 HB2 LEU 89 HB2 LEU 89 6.880 -1.400 2.024
687 HB3 LEU 89 HB3 LEU 89 6.594 -3.119 2.218
688 HG LEU 89 HG LEU 89 4.923 -2.804 3.899
689 HD11 LEU 89 HD11 LEU 89 4.077 -0.556 4.532
690 HD12 LEU 89 HD12 LEU 89 5.467 0.183 3.698
691 HD13 LEU 89 HD13 LEU 89 5.710 -0.860 5.121
692 HD21 LEU 89 HD21 LEU 89 4.491 -0.875 1.580
693 HD22 LEU 89 HD22 LEU 89 3.221 -1.645 2.564
694 HD23 LEU 89 HD23 LEU 89 4.262 -2.633 1.522
695 H GLU 90 H GLU 90 9.765 -2.399 2.137
696 HA GLU 90 HA GLU 90 10.108 -5.294 2.422
697 HB2 GLU 90 HB2 GLU 90 11.748 -5.213 0.745
698 HB3 GLU 90 HB3 GLU 90 10.299 -4.362 0.243
699 HG2 GLU 90 HG2 GLU 90 11.497 -2.196 0.622
700 HG3 GLU 90 HG3 GLU 90 12.932 -3.095 1.122
701 H GLU 91 H GLU 91 11.849 -2.518 3.801
702 HA GLU 91 HA GLU 91 14.005 -4.254 4.799
703 HB2 GLU 91 HB2 GLU 91 13.293 -1.346 5.193
704 HB3 GLU 91 HB3 GLU 91 14.585 -2.121 6.100
705 HG2 GLU 91 HG2 GLU 91 14.502 -2.163 3.050
706 HG3 GLU 91 HG3 GLU 91 15.272 -0.877 3.985
707 H GLU 92 H GLU 92 11.020 -2.830 6.249
708 HA GLU 92 HA GLU 92 11.562 -3.827 8.891
709 HB2 GLU 92 HB2 GLU 92 9.851 -2.105 8.414
710 HB3 GLU 92 HB3 GLU 92 8.941 -3.272 7.457
711 HG2 GLU 92 HG2 GLU 92 7.807 -3.045 9.492
712 HG3 GLU 92 HG3 GLU 92 8.547 -4.633 9.519
713 H THR 93 H THR 93 10.010 -5.267 6.030
714 HA THR 93 HA THR 93 9.411 -7.863 7.086
715 HB THR 93 HB THR 93 10.208 -7.020 4.269
716 HG1 THR 93 HG1 THR 93 8.337 -6.086 4.665
717 HG21 THR 93 HG21 THR 93 8.956 -9.101 3.580
718 HG22 THR 93 HG22 THR 93 9.017 -9.633 5.279
719 HG23 THR 93 HG23 THR 93 10.511 -9.401 4.357
720 H ALA 94 H ALA 94 12.403 -6.688 5.413
721 HA ALA 94 HA ALA 94 13.737 -9.211 5.640
722 HB1 ALA 94 HB1 ALA 94 14.202 -7.586 3.869
723 HB2 ALA 94 HB2 ALA 94 14.818 -6.423 5.071
724 HB3 ALA 94 HB3 ALA 94 15.674 -7.949 4.779
725 H ARG 95 H ARG 95 13.520 -6.571 7.929
726 HA ARG 95 HA ARG 95 15.718 -7.671 9.606
727 HB2 ARG 95 HB2 ARG 95 14.131 -5.082 9.698
728 HB3 ARG 95 HB3 ARG 95 15.369 -5.524 10.876
729 HG2 ARG 95 HG2 ARG 95 17.115 -5.531 9.209
730 HG3 ARG 95 HG3 ARG 95 15.955 -5.326 7.894
731 HD2 ARG 95 HD2 ARG 95 17.055 -3.215 8.358
732 HD3 ARG 95 HD3 ARG 95 15.329 -3.102 8.731
733 HE ARG 95 HE ARG 95 16.543 -3.803 11.131
734 HH11 ARG 95 HH11 ARG 95 16.851 -1.061 8.871
735 HH12 ARG 95 HH12 ARG 95 17.266 0.071 10.140
736 HH21 ARG 95 HH21 ARG 95 17.077 -2.296 12.741
737 HH22 ARG 95 HH22 ARG 95 17.394 -0.628 12.323
738 H LEU 96 H LEU 96 12.574 -8.487 9.370
739 HA LEU 96 HA LEU 96 11.465 -7.970 11.882
740 HB2 LEU 96 HB2 LEU 96 10.422 -8.664 9.610
741 HB3 LEU 96 HB3 LEU 96 10.549 -10.282 10.166
742 HG LEU 96 HG LEU 96 8.373 -9.698 10.620
743 HD11 LEU 96 HD11 LEU 96 8.072 -9.418 12.994
744 HD12 LEU 96 HD12 LEU 96 9.743 -8.831 13.171
745 HD13 LEU 96 HD13 LEU 96 9.431 -10.519 12.680
746 HD21 LEU 96 HD21 LEU 96 9.364 -6.992 11.571
747 HD22 LEU 96 HD22 LEU 96 7.659 -7.515 11.481
748 HD23 LEU 96 HD23 LEU 96 8.627 -7.360 10.002
749 H GLN 97 H GLN 97 13.130 -8.484 13.323
750 HA GLN 97 HA GLN 97 12.966 -11.270 14.433
751 HB2 GLN 97 HB2 GLN 97 15.303 -9.321 14.360
752 HB3 GLN 97 HB3 GLN 97 15.264 -10.736 15.410
753 HG2 GLN 97 HG2 GLN 97 15.115 -10.837 12.363
754 HG3 GLN 97 HG3 GLN 97 16.567 -11.099 13.328
755 HE21 GLN 97 HE21 GLN 97 13.399 -12.481 12.462
756 HE22 GLN 97 HE22 GLN 97 13.751 -14.074 13.131
757 H THR 98 H THR 98 12.356 -7.942 15.023
758 HA THR 98 HA THR 98 11.582 -8.540 17.877
759 HB THR 98 HB THR 98 12.306 -5.870 16.686
760 HG1 THR 98 HG1 THR 98 14.126 -6.044 17.895
761 HG21 THR 98 HG21 THR 98 12.396 -5.270 19.141
762 HG22 THR 98 HG22 THR 98 11.671 -6.843 19.508
763 HG23 THR 98 HG23 THR 98 10.775 -5.632 18.552
764 HA PRO 99 HA PRO 99 7.855 -8.172 15.209
765 HB2 PRO 99 HB2 PRO 99 6.396 -10.258 16.173
766 HB3 PRO 99 HB3 PRO 99 7.840 -10.512 15.159
767 HG2 PRO 99 HG2 PRO 99 7.713 -10.516 18.198
768 HG3 PRO 99 HG3 PRO 99 8.364 -11.800 17.123
769 HD2 PRO 99 HD2 PRO 99 9.989 -9.924 18.213
770 HD3 PRO 99 HD3 PRO 99 10.236 -10.498 16.538
771 H VAL 100 H VAL 100 8.309 -6.305 17.137
772 HA VAL 100 HA VAL 100 5.910 -6.123 18.901
773 HB VAL 100 HB VAL 100 8.864 -6.115 19.652
774 HG11 VAL 100 HG11 VAL 100 6.475 -5.106 21.300
775 HG12 VAL 100 HG12 VAL 100 8.084 -5.449 21.960
776 HG13 VAL 100 HG13 VAL 100 7.896 -4.151 20.789
777 HG21 VAL 100 HG21 VAL 100 6.460 -7.640 20.728
778 HG22 VAL 100 HG22 VAL 100 7.775 -8.301 19.730
779 HG23 VAL 100 HG23 VAL 100 8.121 -7.730 21.358
780 H THR 101 H THR 101 4.998 -4.202 18.740
781 HA THR 101 HA THR 101 6.566 -1.807 17.837
782 HB THR 101 HB THR 101 4.509 -1.230 16.462
783 HG1 THR 101 HG1 THR 101 4.026 -3.992 16.525
784 HG21 THR 101 HG21 THR 101 5.138 -2.644 14.560
785 HG22 THR 101 HG22 THR 101 6.107 -3.682 15.624
786 HG23 THR 101 HG23 THR 101 6.564 -1.990 15.379
787 H ASN 102 H ASN 102 5.335 0.254 18.043
788 HA ASN 102 HA ASN 102 4.034 0.537 20.677
789 HB2 ASN 102 HB2 ASN 102 5.623 2.241 19.898
790 HB3 ASN 102 HB3 ASN 102 4.679 2.507 18.434
791 HD21 ASN 102 HD21 ASN 102 4.581 4.833 19.077
792 HD22 ASN 102 HD22 ASN 102 3.385 5.277 20.280
793 H ARG 103 H ARG 103 2.407 -1.139 19.945
794 HA ARG 103 HA ARG 103 0.708 -0.725 17.731
795 HB2 ARG 103 HB2 ARG 103 -0.496 -2.644 18.476
796 HB3 ARG 103 HB3 ARG 103 1.216 -2.888 18.823
797 HG2 ARG 103 HG2 ARG 103 0.730 -2.159 21.230
798 HG3 ARG 103 HG3 ARG 103 -0.993 -2.171 20.799
799 HD2 ARG 103 HD2 ARG 103 -0.685 -4.582 20.061
800 HD3 ARG 103 HD3 ARG 103 0.945 -4.516 20.749
801 HE ARG 103 HE ARG 103 -0.568 -3.668 22.836
802 HH11 ARG 103 HH11 ARG 103 -0.899 -6.534 20.742
803 HH12 ARG 103 HH12 ARG 103 -1.663 -7.488 21.994
804 HH21 ARG 103 HH21 ARG 103 -1.558 -4.930 24.421
805 HH22 ARG 103 HH22 ARG 103 -2.035 -6.580 24.079
806 H GLY 104 H GLY 104 -1.627 -0.519 17.664
807 HA2 GLY 104 HA2 GLY 104 -3.740 0.258 18.562
808 HA3 GLY 104 HA3 GLY 104 -2.878 1.182 19.785
809 H ILE 105 H ILE 105 -3.961 3.092 19.288
810 HA ILE 105 HA ILE 105 -4.272 4.062 16.649
811 HB ILE 105 HB ILE 105 -5.263 5.994 17.506
812 HG12 ILE 105 HG12 ILE 105 -3.805 6.730 19.275
813 HG13 ILE 105 HG13 ILE 105 -5.465 6.646 19.815
814 HG21 ILE 105 HG21 ILE 105 -6.108 3.636 19.223
815 HG22 ILE 105 HG22 ILE 105 -7.080 5.062 18.810
816 HG23 ILE 105 HG23 ILE 105 -6.574 3.940 17.539
817 HD11 ILE 105 HD11 ILE 105 -3.935 5.908 21.552
818 HD12 ILE 105 HD12 ILE 105 -4.976 4.559 21.061
819 HD13 ILE 105 HD13 ILE 105 -3.279 4.639 20.519
820 HA PRO 106 HA PRO 106 -0.521 6.015 15.561
821 HB2 PRO 106 HB2 PRO 106 -2.242 8.304 14.572
822 HB3 PRO 106 HB3 PRO 106 -0.856 7.512 13.767
823 HG2 PRO 106 HG2 PRO 106 -3.374 6.824 13.094
824 HG3 PRO 106 HG3 PRO 106 -2.169 5.522 13.381
825 HD2 PRO 106 HD2 PRO 106 -4.290 6.575 15.267
826 HD3 PRO 106 HD3 PRO 106 -3.844 4.889 14.869
827 HHA HEC 107 HHA HEC 107 -4.643 -3.927 0.385
828 HHB HEC 107 HHB HEC 107 0.491 -0.233 1.465
829 HHC HEC 107 HHC HEC 107 -3.266 3.950 4.686
830 HHD HEC 107 HHD HEC 107 -8.130 -0.274 4.385
831 HMA1 HEC 107 HMA1 HEC 107 1.190 -2.413 1.018
832 HMA2 HEC 107 HMA2 HEC 107 0.640 -3.767 0.046
833 HMA3 HEC 107 HMA3 HEC 107 0.791 -2.163 -0.699
834 HAA1 HEC 107 HAA1 HEC 107 -1.302 -5.112 0.476
835 HAA2 HEC 107 HAA2 HEC 107 -2.921 -5.085 -0.145
836 HBA1 HEC 107 HBA1 HEC 107 -2.263 -4.739 -2.343
837 HBA2 HEC 107 HBA2 HEC 107 -0.714 -4.005 -1.887
838 HMB1 HEC 107 HMB1 HEC 107 1.530 2.757 1.786
839 HMB2 HEC 107 HMB2 HEC 107 1.818 2.563 3.520
840 HMB3 HEC 107 HMB3 HEC 107 1.794 1.157 2.519
841 HAB HEC 107 HAB HEC 107 -1.405 4.777 4.527
842 HBB1 HEC 107 HBB1 HEC 107 -1.150 5.327 2.197
843 HBB2 HEC 107 HBB2 HEC 107 -0.026 6.249 3.197
844 HBB3 HEC 107 HBB3 HEC 107 0.563 4.881 2.246
845 HMC1 HEC 107 HMC1 HEC 107 -4.886 4.282 6.570
846 HMC2 HEC 107 HMC2 HEC 107 -5.534 5.087 5.122
847 HMC3 HEC 107 HMC3 HEC 107 -6.618 4.487 6.369
848 HAC HEC 107 HAC HEC 107 -8.461 1.083 5.926
849 HBC1 HEC 107 HBC1 HEC 107 -8.664 4.075 5.571
850 HBC2 HEC 107 HBC2 HEC 107 -9.285 2.840 4.461
851 HBC3 HEC 107 HBC3 HEC 107 -9.940 2.967 6.107
852 HMD1 HEC 107 HMD1 HEC 107 -9.040 -2.341 4.318
853 HMD2 HEC 107 HMD2 HEC 107 -9.602 -2.400 2.629
854 HMD3 HEC 107 HMD3 HEC 107 -8.970 -3.851 3.429
855 HAD1 HEC 107 HAD1 HEC 107 -8.200 -4.651 1.382
856 HAD2 HEC 107 HAD2 HEC 107 -6.802 -4.600 0.348
857 HBD1 HEC 107 HBD1 HEC 107 -6.917 -5.722 3.186
858 HBD2 HEC 107 HBD2 HEC 107 -6.787 -6.623 1.675
Start of MODEL 10
1 H SER 1 H SER 1 15.678 5.224 7.827
2 HA SER 1 HA SER 1 14.670 5.688 5.839
3 HB2 SER 1 HB2 SER 1 13.729 2.827 6.237
4 HB3 SER 1 HB3 SER 1 13.720 3.694 4.687
5 HG SER 1 HG SER 1 15.675 2.316 5.551
6 H GLY 2 H GLY 2 11.968 4.393 5.008
7 HA2 GLY 2 HA2 GLY 2 10.234 6.502 5.531
8 HA3 GLY 2 HA3 GLY 2 9.773 4.928 4.968
9 H GLU 3 H GLU 3 11.101 4.653 8.167
10 HA GLU 3 HA GLU 3 8.578 3.611 9.098
11 HB2 GLU 3 HB2 GLU 3 10.843 2.778 9.736
12 HB3 GLU 3 HB3 GLU 3 11.107 4.277 10.628
13 HG2 GLU 3 HG2 GLU 3 9.148 3.676 12.098
14 HG3 GLU 3 HG3 GLU 3 8.982 2.166 11.200
15 H GLN 4 H GLN 4 10.205 6.747 9.723
16 HA GLN 4 HA GLN 4 8.273 7.515 11.803
17 HB2 GLN 4 HB2 GLN 4 10.520 9.014 10.430
18 HB3 GLN 4 HB3 GLN 4 9.391 9.773 11.563
19 HG2 GLN 4 HG2 GLN 4 10.032 8.191 13.338
20 HG3 GLN 4 HG3 GLN 4 11.119 7.353 12.234
21 HE21 GLN 4 HE21 GLN 4 12.715 7.870 14.047
22 HE22 GLN 4 HE22 GLN 4 13.598 9.378 13.778
23 H ILE 5 H ILE 5 8.427 7.738 8.315
24 HA ILE 5 HA ILE 5 5.929 9.313 8.191
25 HB ILE 5 HB ILE 5 7.254 7.454 6.145
26 HG12 ILE 5 HG12 ILE 5 7.207 10.495 6.091
27 HG13 ILE 5 HG13 ILE 5 8.545 9.583 6.767
28 HG21 ILE 5 HG21 ILE 5 5.001 9.457 5.716
29 HG22 ILE 5 HG22 ILE 5 5.761 8.447 4.470
30 HG23 ILE 5 HG23 ILE 5 4.812 7.683 5.728
31 HD11 ILE 5 HD11 ILE 5 9.162 10.136 4.534
32 HD12 ILE 5 HD12 ILE 5 8.825 8.399 4.560
33 HD13 ILE 5 HD13 ILE 5 7.639 9.534 3.868
34 H PHE 6 H PHE 6 6.636 5.716 7.790
35 HA PHE 6 HA PHE 6 4.014 4.992 7.394
36 HB2 PHE 6 HB2 PHE 6 5.829 3.369 7.226
37 HB3 PHE 6 HB3 PHE 6 6.085 3.416 8.963
38 HD1 PHE 6 HD2 PHE 6 3.579 2.474 6.331
39 HD2 PHE 6 HD1 PHE 6 4.745 2.078 10.461
40 HE1 PHE 6 HE2 PHE 6 1.770 0.825 6.679
41 HE2 PHE 6 HE1 PHE 6 2.928 0.425 10.807
42 HZ PHE 6 HZ PHE 6 1.421 -0.186 8.923
43 H ARG 7 H ARG 7 5.534 5.158 10.643
44 HA ARG 7 HA ARG 7 3.234 4.282 12.055
45 HB2 ARG 7 HB2 ARG 7 5.841 4.427 12.647
46 HB3 ARG 7 HB3 ARG 7 5.388 5.989 13.309
47 HG2 ARG 7 HG2 ARG 7 5.227 4.534 15.153
48 HG3 ARG 7 HG3 ARG 7 3.550 4.679 14.636
49 HD2 ARG 7 HD2 ARG 7 3.929 2.361 15.052
50 HD3 ARG 7 HD3 ARG 7 3.893 2.526 13.291
51 HE ARG 7 HE ARG 7 6.521 2.689 14.642
52 HH11 ARG 7 HH11 ARG 7 4.317 0.605 12.753
53 HH12 ARG 7 HH12 ARG 7 5.593 -0.516 12.334
54 HH21 ARG 7 HH21 ARG 7 8.116 1.229 14.069
55 HH22 ARG 7 HH22 ARG 7 7.738 -0.164 13.080
56 H THR 8 H THR 8 3.870 7.358 10.680
57 HA THR 8 HA THR 8 1.968 8.784 12.511
58 HB THR 8 HB THR 8 3.007 10.859 11.672
59 HG1 THR 8 HG1 THR 8 5.161 9.611 10.592
60 HG21 THR 8 HG21 THR 8 5.101 8.915 12.743
61 HG22 THR 8 HG22 THR 8 3.956 9.852 13.724
62 HG23 THR 8 HG23 THR 8 5.189 10.688 12.768
63 H ARG 9 H ARG 9 2.676 8.164 9.096
64 HA ARG 9 HA ARG 9 0.379 9.749 8.165
65 HB2 ARG 9 HB2 ARG 9 2.745 10.145 7.445
66 HB3 ARG 9 HB3 ARG 9 2.785 8.517 6.771
67 HG2 ARG 9 HG2 ARG 9 2.552 10.166 5.047
68 HG3 ARG 9 HG3 ARG 9 1.130 9.134 5.065
69 HD2 ARG 9 HD2 ARG 9 -0.193 10.870 6.146
70 HD3 ARG 9 HD3 ARG 9 1.251 11.858 6.420
71 HE ARG 9 HE ARG 9 1.482 12.179 4.027
72 HH11 ARG 9 HH11 ARG 9 -1.749 11.044 5.047
73 HH12 ARG 9 HH12 ARG 9 -2.512 11.640 3.592
74 HH21 ARG 9 HH21 ARG 9 0.469 12.900 2.189
75 HH22 ARG 9 HH22 ARG 9 -1.253 12.689 1.967
76 H CYS 10 H CYS 10 1.271 6.392 8.519
77 HA CYS 10 HA CYS 10 -0.680 5.612 6.389
78 HB2 CYS 10 HB2 CYS 10 1.714 5.574 5.721
79 HB3 CYS 10 HB3 CYS 10 2.023 4.418 7.009
80 H SER 11 H SER 11 0.491 4.739 9.623
81 HA SER 11 HA SER 11 -0.759 2.139 9.645
82 HB2 SER 11 HB2 SER 11 -0.042 2.096 11.952
83 HB3 SER 11 HB3 SER 11 1.240 2.735 10.921
84 HG SER 11 HG SER 11 0.748 3.840 12.947
85 H SER 12 H SER 12 -1.949 2.159 12.263
86 HA SER 12 HA SER 12 -3.904 2.193 13.267
87 HB2 SER 12 HB2 SER 12 -4.451 4.886 12.015
88 HB3 SER 12 HB3 SER 12 -5.263 4.162 13.412
89 HG SER 12 HG SER 12 -2.677 5.208 13.171
90 H CYS 13 H CYS 13 -3.849 1.496 10.159
91 HA CYS 13 HA CYS 13 -6.431 0.135 10.634
92 HB2 CYS 13 HB2 CYS 13 -5.576 0.782 7.813
93 HB3 CYS 13 HB3 CYS 13 -7.028 -0.030 8.342
94 H HIS 14 H HIS 14 -3.391 0.137 8.674
95 HA HIS 14 HA HIS 14 -3.131 -2.799 9.011
96 HB2 HIS 14 2HB HIS 14 -1.286 -0.892 7.537
97 HB3 HIS 14 3HB HIS 14 -1.222 -2.627 7.491
98 HD1 HIS 14 1HD HIS 14 -3.113 -3.870 5.926
99 HD2 HIS 14 2HD HIS 14 -2.727 0.280 5.953
100 HE1 HIS 14 1HE HIS 14 -4.182 -3.092 3.755
101 H THR 15 H THR 15 -1.122 -3.529 9.310
102 HA THR 15 HA THR 15 1.090 -2.024 10.312
103 HB THR 15 HB THR 15 1.851 -3.382 12.085
104 HG1 THR 15 HG1 THR 15 -0.488 -4.927 11.711
105 HG21 THR 15 HG21 THR 15 0.343 -3.062 13.904
106 HG22 THR 15 HG22 THR 15 -1.047 -2.858 12.815
107 HG23 THR 15 HG23 THR 15 0.253 -1.645 12.846
108 H VAL 16 H VAL 16 3.073 -3.568 10.277
109 HA VAL 16 HA VAL 16 2.900 -5.535 8.003
110 HB VAL 16 HB VAL 16 5.219 -4.005 9.242
111 HG11 VAL 16 HG11 VAL 16 6.034 -6.149 8.290
112 HG12 VAL 16 HG12 VAL 16 5.232 -5.763 6.747
113 HG13 VAL 16 HG13 VAL 16 6.572 -4.775 7.329
114 HG21 VAL 16 HG21 VAL 16 4.105 -3.646 6.436
115 HG22 VAL 16 HG22 VAL 16 3.579 -2.628 7.785
116 HG23 VAL 16 HG23 VAL 16 5.277 -2.637 7.289
117 H GLY 17 H GLY 17 1.687 -6.835 9.643
118 HA2 GLY 17 HA2 GLY 17 1.712 -8.876 10.719
119 HA3 GLY 17 HA3 GLY 17 3.467 -8.893 10.633
120 H ASN 18 H ASN 18 2.906 -6.078 12.203
121 HA ASN 18 HA ASN 18 3.675 -7.168 14.779
122 HB2 ASN 18 HB2 ASN 18 4.503 -5.017 13.776
123 HB3 ASN 18 HB3 ASN 18 2.891 -4.322 14.005
124 HD21 ASN 18 HD21 ASN 18 5.864 -5.336 15.622
125 HD22 ASN 18 HD22 ASN 18 5.336 -4.791 17.220
126 H THR 19 H THR 19 0.674 -6.116 13.386
127 HA THR 19 HA THR 19 -1.449 -5.948 13.949
128 HB THR 19 HB THR 19 -1.051 -7.526 16.488
129 HG1 THR 19 HG1 THR 19 -0.390 -9.007 15.268
130 HG21 THR 19 HG21 THR 19 -3.313 -8.375 15.926
131 HG22 THR 19 HG22 THR 19 -3.370 -7.285 14.522
132 HG23 THR 19 HG23 THR 19 -3.321 -6.624 16.173
133 H GLU 20 H GLU 20 0.784 -4.979 16.494
134 HA GLU 20 HA GLU 20 0.798 -3.401 18.045
135 HB2 GLU 20 HB2 GLU 20 -0.919 -2.064 15.970
136 HB3 GLU 20 HB3 GLU 20 -0.814 -1.323 17.550
137 HG2 GLU 20 HG2 GLU 20 1.710 -1.447 17.387
138 HG3 GLU 20 HG3 GLU 20 1.524 -2.007 15.721
139 HA PRO 21 HA PRO 21 -1.883 -4.382 21.210
140 HB2 PRO 21 HB2 PRO 21 -1.958 -2.229 22.932
141 HB3 PRO 21 HB3 PRO 21 -0.528 -3.270 22.674
142 HG2 PRO 21 HG2 PRO 21 -1.171 -0.617 21.340
143 HG3 PRO 21 HG3 PRO 21 0.366 -1.114 22.123
144 HD2 PRO 21 HD2 PRO 21 0.086 -1.263 19.473
145 HD3 PRO 21 HD3 PRO 21 0.907 -2.582 20.349
146 H GLY 22 H GLY 22 -2.988 -1.484 19.500
147 HA2 GLY 22 HA2 GLY 22 -5.671 -1.435 20.591
148 HA3 GLY 22 HA3 GLY 22 -5.116 -0.693 19.089
149 H GLN 23 H GLN 23 -7.537 -1.646 18.895
150 HA GLN 23 HA GLN 23 -7.720 -4.419 18.193
151 HB2 GLN 23 HB2 GLN 23 -9.614 -2.085 17.766
152 HB3 GLN 23 HB3 GLN 23 -9.979 -3.747 17.310
153 HG2 GLN 23 HG2 GLN 23 -10.995 -3.336 19.446
154 HG3 GLN 23 HG3 GLN 23 -9.693 -4.492 19.656
155 HE21 GLN 23 HE21 GLN 23 -9.528 -3.986 21.960
156 HE22 GLN 23 HE22 GLN 23 -8.809 -2.449 22.461
157 HA PRO 24 HA PRO 24 -6.711 -3.904 13.753
158 HB2 PRO 24 HB2 PRO 24 -6.548 -6.493 13.047
159 HB3 PRO 24 HB3 PRO 24 -5.396 -5.802 14.219
160 HG2 PRO 24 HG2 PRO 24 -7.928 -7.376 14.824
161 HG3 PRO 24 HG3 PRO 24 -6.273 -7.667 15.450
162 HD2 PRO 24 HD2 PRO 24 -8.192 -6.179 16.788
163 HD3 PRO 24 HD3 PRO 24 -6.432 -5.897 16.959
164 H GLY 25 H GLY 25 -7.906 -5.640 11.838
165 HA2 GLY 25 HA2 GLY 25 -9.960 -6.720 11.296
166 HA3 GLY 25 HA3 GLY 25 -10.846 -5.603 12.325
167 H ILE 26 H ILE 26 -9.045 -3.400 10.870
168 HA ILE 26 HA ILE 26 -10.872 -3.075 8.527
169 HB ILE 26 HB ILE 26 -8.853 -1.124 9.697
170 HG12 ILE 26 HG12 ILE 26 -11.897 -1.162 9.935
171 HG13 ILE 26 HG13 ILE 26 -10.771 -1.580 11.223
172 HG21 ILE 26 HG21 ILE 26 -11.012 -0.723 7.581
173 HG22 ILE 26 HG22 ILE 26 -9.924 0.524 8.208
174 HG23 ILE 26 HG23 ILE 26 -9.269 -0.802 7.260
175 HD11 ILE 26 HD11 ILE 26 -9.814 0.739 11.110
176 HD12 ILE 26 HD12 ILE 26 -11.138 1.168 9.995
177 HD13 ILE 26 HD13 ILE 26 -11.506 0.641 11.641
178 H GLY 27 H GLY 27 -7.352 -2.998 9.291
179 HA2 GLY 27 HA2 GLY 27 -6.649 -3.196 6.453
180 HA3 GLY 27 HA3 GLY 27 -5.545 -3.055 7.802
181 HA PRO 28 HA PRO 28 -5.557 -7.670 6.642
182 HB2 PRO 28 HB2 PRO 28 -4.473 -6.961 3.948
183 HB3 PRO 28 HB3 PRO 28 -5.490 -8.351 4.423
184 HG2 PRO 28 HG2 PRO 28 -6.531 -6.260 3.023
185 HG3 PRO 28 HG3 PRO 28 -7.463 -7.014 4.361
186 HD2 PRO 28 HD2 PRO 28 -5.759 -4.509 4.448
187 HD3 PRO 28 HD3 PRO 28 -7.429 -4.759 5.046
188 H ASP 29 H ASP 29 -3.305 -8.705 6.364
189 HA ASP 29 HA ASP 29 -1.440 -6.984 7.772
190 HB2 ASP 29 HB2 ASP 29 -0.144 -8.934 8.145
191 HB3 ASP 29 HB3 ASP 29 -1.837 -9.288 8.455
192 H LEU 30 H LEU 30 0.334 -5.904 7.055
193 HA LEU 30 HA LEU 30 1.090 -6.169 4.194
194 HB2 LEU 30 HB2 LEU 30 1.936 -4.175 6.308
195 HB3 LEU 30 HB3 LEU 30 2.371 -4.096 4.599
196 HG LEU 30 HG LEU 30 -0.427 -3.874 5.761
197 HD11 LEU 30 HD11 LEU 30 -0.235 -1.506 5.018
198 HD12 LEU 30 HD12 LEU 30 1.434 -1.810 4.485
199 HD13 LEU 30 HD13 LEU 30 1.010 -1.918 6.208
200 HD21 LEU 30 HD21 LEU 30 0.561 -3.585 2.877
201 HD22 LEU 30 HD22 LEU 30 -1.066 -3.141 3.444
202 HD23 LEU 30 HD23 LEU 30 -0.554 -4.825 3.494
203 H LEU 31 H LEU 31 1.990 -7.847 6.710
204 HA LEU 31 HA LEU 31 4.610 -7.901 7.397
205 HB2 LEU 31 HB2 LEU 31 2.875 -9.238 8.302
206 HB3 LEU 31 HB3 LEU 31 2.538 -9.997 6.792
207 HG LEU 31 HG LEU 31 3.520 -11.433 8.517
208 HD11 LEU 31 HD11 LEU 31 5.445 -11.387 6.183
209 HD12 LEU 31 HD12 LEU 31 3.776 -11.984 6.088
210 HD13 LEU 31 HD13 LEU 31 4.931 -12.746 7.181
211 HD21 LEU 31 HD21 LEU 31 5.889 -11.366 9.072
212 HD22 LEU 31 HD22 LEU 31 5.043 -9.904 9.583
213 HD23 LEU 31 HD23 LEU 31 6.085 -9.863 8.151
214 H GLY 32 H GLY 32 3.454 -9.169 4.291
215 HA2 GLY 32 HA2 GLY 32 6.301 -9.556 3.401
216 HA3 GLY 32 HA3 GLY 32 5.013 -10.691 3.011
217 H VAL 33 H VAL 33 4.162 -7.290 2.887
218 HA VAL 33 HA VAL 33 2.934 -7.775 0.461
219 HB VAL 33 HB VAL 33 2.311 -6.076 2.130
220 HG11 VAL 33 HG11 VAL 33 4.492 -4.901 2.360
221 HG12 VAL 33 HG12 VAL 33 4.295 -4.246 0.716
222 HG13 VAL 33 HG13 VAL 33 3.152 -3.808 1.999
223 HG21 VAL 33 HG21 VAL 33 2.376 -5.088 -0.740
224 HG22 VAL 33 HG22 VAL 33 1.201 -6.224 -0.050
225 HG23 VAL 33 HG23 VAL 33 1.264 -4.562 0.544
226 H THR 34 H THR 34 6.154 -6.320 0.753
227 HA THR 34 HA THR 34 6.392 -5.635 -2.050
228 HB THR 34 HB THR 34 7.809 -4.533 -0.457
229 HG1 THR 34 HG1 THR 34 9.813 -4.947 -1.519
230 HG21 THR 34 HG21 THR 34 8.159 -6.212 1.263
231 HG22 THR 34 HG22 THR 34 9.722 -5.713 0.615
232 HG23 THR 34 HG23 THR 34 9.018 -7.269 0.121
233 H ARG 35 H ARG 35 6.539 -8.714 -0.461
234 HA ARG 35 HA ARG 35 7.873 -10.015 -2.798
235 HB2 ARG 35 HB2 ARG 35 6.863 -11.330 -0.258
236 HB3 ARG 35 HB3 ARG 35 7.963 -11.993 -1.461
237 HG2 ARG 35 HG2 ARG 35 8.543 -9.744 0.511
238 HG3 ARG 35 HG3 ARG 35 9.169 -11.389 0.561
239 HD2 ARG 35 HD2 ARG 35 10.448 -11.022 -1.497
240 HD3 ARG 35 HD3 ARG 35 9.750 -9.404 -1.671
241 HE ARG 35 HE ARG 35 11.350 -10.152 0.736
242 HH11 ARG 35 HH11 ARG 35 10.927 -7.986 -2.072
243 HH12 ARG 35 HH12 ARG 35 12.144 -6.864 -1.511
244 HH21 ARG 35 HH21 ARG 35 12.897 -8.660 1.423
245 HH22 ARG 35 HH22 ARG 35 13.251 -7.242 0.461
246 H GLN 36 H GLN 36 4.726 -9.667 -1.208
247 HA GLN 36 HA GLN 36 3.294 -11.616 -2.783
248 HB2 GLN 36 HB2 GLN 36 2.389 -9.139 -1.267
249 HB3 GLN 36 HB3 GLN 36 1.279 -10.279 -2.019
250 HG2 GLN 36 HG2 GLN 36 1.932 -12.067 -0.554
251 HG3 GLN 36 HG3 GLN 36 3.285 -11.137 0.096
252 HE21 GLN 36 HE21 GLN 36 -0.265 -11.577 0.310
253 HE22 GLN 36 HE22 GLN 36 -0.421 -10.462 1.662
254 H ARG 37 H ARG 37 4.149 -8.233 -3.419
255 HA ARG 37 HA ARG 37 2.586 -8.275 -5.969
256 HB2 ARG 37 HB2 ARG 37 2.886 -5.974 -4.020
257 HB3 ARG 37 HB3 ARG 37 2.003 -5.928 -5.546
258 HG2 ARG 37 HG2 ARG 37 1.288 -7.628 -3.121
259 HG3 ARG 37 HG3 ARG 37 0.512 -6.130 -3.609
260 HD2 ARG 37 HD2 ARG 37 -0.413 -7.127 -5.596
261 HD3 ARG 37 HD3 ARG 37 0.557 -8.585 -5.408
262 HE ARG 37 HE ARG 37 -1.555 -7.757 -3.463
263 HH11 ARG 37 HH11 ARG 37 -0.053 -10.379 -5.372
264 HH12 ARG 37 HH12 ARG 37 -1.028 -11.612 -4.605
265 HH21 ARG 37 HH21 ARG 37 -2.758 -9.382 -2.506
266 HH22 ARG 37 HH22 ARG 37 -2.552 -11.052 -2.988
267 H ASP 38 H ASP 38 3.174 -6.827 -7.605
268 HA ASP 38 HA ASP 38 5.960 -6.993 -8.235
269 HB2 ASP 38 HB2 ASP 38 4.067 -7.163 -9.865
270 HB3 ASP 38 HB3 ASP 38 3.746 -5.451 -9.629
271 H ALA 39 H ALA 39 7.570 -5.549 -8.345
272 HA ALA 39 HA ALA 39 7.713 -3.532 -6.444
273 HB1 ALA 39 HB1 ALA 39 9.584 -4.875 -7.482
274 HB2 ALA 39 HB2 ALA 39 9.413 -3.886 -8.952
275 HB3 ALA 39 HB3 ALA 39 9.929 -3.131 -7.436
276 H ASN 40 H ASN 40 6.333 -3.117 -9.575
277 HA ASN 40 HA ASN 40 6.416 -0.166 -9.105
278 HB2 ASN 40 HB2 ASN 40 6.318 -1.655 -11.742
279 HB3 ASN 40 HB3 ASN 40 5.920 0.059 -11.551
280 HD21 ASN 40 HD21 ASN 40 8.560 -2.298 -11.432
281 HD22 ASN 40 HD22 ASN 40 9.837 -1.104 -11.297
282 H TRP 41 H TRP 41 4.197 -2.861 -10.148
283 HA TRP 41 HA TRP 41 1.841 -1.287 -10.144
284 HB2 TRP 41 HB2 TRP 41 1.907 -3.671 -10.912
285 HB3 TRP 41 HB3 TRP 41 2.066 -4.167 -9.231
286 HD1 TRP 41 HD1 TRP 41 -0.544 -2.637 -11.600
287 HE1 TRP 41 HE1 TRP 41 -2.894 -2.979 -10.605
288 HE3 TRP 41 HE3 TRP 41 0.782 -4.423 -6.982
289 HZ2 TRP 41 HZ2 TRP 41 -3.995 -3.522 -8.004
290 HZ3 TRP 41 HZ3 TRP 41 -0.948 -4.690 -5.206
291 HH2 TRP 41 HH2 TRP 41 -3.326 -4.219 -5.701
292 H LEU 42 H LEU 42 3.424 -2.908 -7.339
293 HA LEU 42 HA LEU 42 1.439 -2.421 -5.405
294 HB2 LEU 42 HB2 LEU 42 3.415 -3.835 -5.064
295 HB3 LEU 42 HB3 LEU 42 4.488 -2.450 -5.233
296 HG LEU 42 HG LEU 42 3.693 -1.491 -3.134
297 HD11 LEU 42 HD11 LEU 42 2.216 -2.775 -1.624
298 HD12 LEU 42 HD12 LEU 42 1.922 -3.964 -2.914
299 HD13 LEU 42 HD13 LEU 42 1.362 -2.290 -3.095
300 HD21 LEU 42 HD21 LEU 42 4.407 -4.435 -2.834
301 HD22 LEU 42 HD22 LEU 42 4.621 -3.163 -1.609
302 HD23 LEU 42 HD23 LEU 42 5.559 -3.110 -3.109
303 H VAL 43 H VAL 43 3.947 -0.262 -6.631
304 HA VAL 43 HA VAL 43 3.438 1.878 -4.731
305 HB VAL 43 HB VAL 43 5.035 2.077 -7.313
306 HG11 VAL 43 HG11 VAL 43 6.275 3.788 -6.046
307 HG12 VAL 43 HG12 VAL 43 4.558 4.201 -6.077
308 HG13 VAL 43 HG13 VAL 43 5.271 3.472 -4.616
309 HG21 VAL 43 HG21 VAL 43 7.041 1.522 -5.882
310 HG22 VAL 43 HG22 VAL 43 5.932 0.959 -4.615
311 HG23 VAL 43 HG23 VAL 43 5.984 0.151 -6.193
312 H ARG 44 H ARG 44 2.792 1.371 -8.225
313 HA ARG 44 HA ARG 44 1.401 3.810 -8.713
314 HB2 ARG 44 HB2 ARG 44 1.252 1.082 -10.049
315 HB3 ARG 44 HB3 ARG 44 0.398 2.508 -10.653
316 HG2 ARG 44 HG2 ARG 44 2.539 3.744 -10.827
317 HG3 ARG 44 HG3 ARG 44 3.427 2.309 -10.313
318 HD2 ARG 44 HD2 ARG 44 1.675 2.496 -12.805
319 HD3 ARG 44 HD3 ARG 44 3.426 2.682 -12.777
320 HE ARG 44 HE ARG 44 3.728 0.400 -12.271
321 HH11 ARG 44 HH11 ARG 44 0.274 1.124 -12.829
322 HH12 ARG 44 HH12 ARG 44 -0.113 -0.541 -13.198
323 HH21 ARG 44 HH21 ARG 44 3.176 -1.727 -12.776
324 HH22 ARG 44 HH22 ARG 44 1.524 -2.148 -13.168
325 H TRP 45 H TRP 45 0.232 0.751 -7.366
326 HA TRP 45 HA TRP 45 -2.569 1.486 -7.163
327 HB2 TRP 45 HB2 TRP 45 -2.103 -0.815 -7.035
328 HB3 TRP 45 HB3 TRP 45 -0.741 -0.589 -5.955
329 HD1 TRP 45 HD1 TRP 45 -1.079 -0.857 -3.498
330 HE1 TRP 45 HE1 TRP 45 -3.091 -1.384 -1.948
331 HE3 TRP 45 HE3 TRP 45 -4.884 0.032 -6.764
332 HZ2 TRP 45 HZ2 TRP 45 -5.982 -1.332 -2.114
333 HZ3 TRP 45 HZ3 TRP 45 -7.240 -0.146 -6.063
334 HH2 TRP 45 HH2 TRP 45 -7.804 -0.871 -3.725
335 H LEU 46 H LEU 46 -0.002 1.352 -4.631
336 HA LEU 46 HA LEU 46 -1.859 2.119 -2.679
337 HB2 LEU 46 HB2 LEU 46 -0.068 1.992 -1.100
338 HB3 LEU 46 HB3 LEU 46 0.095 0.728 -2.310
339 HG LEU 46 HG LEU 46 1.854 2.133 -3.443
340 HD11 LEU 46 HD11 LEU 46 1.685 4.310 -2.616
341 HD12 LEU 46 HD12 LEU 46 3.117 3.658 -1.836
342 HD13 LEU 46 HD13 LEU 46 1.589 3.768 -0.928
343 HD21 LEU 46 HD21 LEU 46 2.292 0.158 -1.966
344 HD22 LEU 46 HD22 LEU 46 2.438 1.266 -0.581
345 HD23 LEU 46 HD23 LEU 46 3.586 1.349 -1.927
346 H LYS 47 H LYS 47 -0.222 4.217 -4.746
347 HA LYS 47 HA LYS 47 -0.228 6.616 -3.115
348 HB2 LYS 47 HB2 LYS 47 1.222 6.102 -5.141
349 HB3 LYS 47 HB3 LYS 47 -0.204 6.274 -6.153
350 HG2 LYS 47 HG2 LYS 47 -0.453 8.632 -5.486
351 HG3 LYS 47 HG3 LYS 47 0.875 8.468 -4.317
352 HD2 LYS 47 HD2 LYS 47 2.432 7.916 -6.159
353 HD3 LYS 47 HD3 LYS 47 1.132 8.109 -7.335
354 HE2 LYS 47 HE2 LYS 47 2.170 10.284 -5.462
355 HE3 LYS 47 HE3 LYS 47 2.679 10.056 -7.139
356 HZ1 LYS 47 HZ1 LYS 47 1.006 11.718 -7.097
357 HZ2 LYS 47 HZ2 LYS 47 -0.056 10.832 -6.241
358 HZ3 LYS 47 HZ3 LYS 47 0.306 10.407 -7.792
359 H VAL 48 H VAL 48 -2.634 5.050 -5.161
360 HA VAL 48 HA VAL 48 -4.555 7.299 -4.891
361 HB VAL 48 HB VAL 48 -2.750 7.805 -6.588
362 HG11 VAL 48 HG11 VAL 48 -2.622 5.476 -7.552
363 HG12 VAL 48 HG12 VAL 48 -4.090 5.869 -8.475
364 HG13 VAL 48 HG13 VAL 48 -2.627 6.833 -8.678
365 HG21 VAL 48 HG21 VAL 48 -4.515 9.205 -6.761
366 HG22 VAL 48 HG22 VAL 48 -4.386 8.561 -8.398
367 HG23 VAL 48 HG23 VAL 48 -5.651 7.960 -7.300
368 HA PRO 49 HA PRO 49 -5.901 2.735 -5.840
369 HB2 PRO 49 HB2 PRO 49 -7.335 2.103 -3.568
370 HB3 PRO 49 HB3 PRO 49 -5.552 1.954 -3.676
371 HG2 PRO 49 HG2 PRO 49 -7.132 4.332 -2.622
372 HG3 PRO 49 HG3 PRO 49 -5.856 3.418 -1.768
373 HD2 PRO 49 HD2 PRO 49 -5.187 5.646 -3.052
374 HD3 PRO 49 HD3 PRO 49 -4.177 4.187 -3.298
375 H ASP 50 H ASP 50 -7.961 5.316 -4.385
376 HA ASP 50 HA ASP 50 -10.433 4.350 -5.407
377 HB2 ASP 50 HB2 ASP 50 -10.073 6.169 -3.656
378 HB3 ASP 50 HB3 ASP 50 -9.718 7.281 -4.986
379 H GLN 51 H GLN 51 -7.816 5.998 -7.085
380 HA GLN 51 HA GLN 51 -9.448 6.485 -9.497
381 HB2 GLN 51 HB2 GLN 51 -7.560 8.020 -8.661
382 HB3 GLN 51 HB3 GLN 51 -6.445 6.751 -9.209
383 HG2 GLN 51 HG2 GLN 51 -7.519 6.928 -11.495
384 HG3 GLN 51 HG3 GLN 51 -8.482 8.280 -10.887
385 HE21 GLN 51 HE21 GLN 51 -5.184 7.144 -11.581
386 HE22 GLN 51 HE22 GLN 51 -4.530 8.751 -11.866
387 H MET 52 H MET 52 -7.037 4.126 -8.220
388 HA MET 52 HA MET 52 -6.708 2.813 -10.728
389 HB2 MET 52 HB2 MET 52 -5.116 2.543 -8.879
390 HB3 MET 52 HB3 MET 52 -6.322 1.617 -7.954
391 HG2 MET 52 HG2 MET 52 -6.392 -0.118 -9.617
392 HG3 MET 52 HG3 MET 52 -5.506 0.874 -10.769
393 HE1 MET 52 HE1 MET 52 -3.001 1.011 -11.039
394 HE2 MET 52 HE2 MET 52 -2.951 1.897 -9.496
395 HE3 MET 52 HE3 MET 52 -1.834 0.540 -9.782
396 H LEU 53 H LEU 53 -9.064 2.188 -8.088
397 HA LEU 53 HA LEU 53 -10.402 0.050 -9.561
398 HB2 LEU 53 HB2 LEU 53 -11.303 1.771 -7.228
399 HB3 LEU 53 HB3 LEU 53 -12.238 0.428 -7.884
400 HG LEU 53 HG LEU 53 -9.442 0.150 -6.730
401 HD11 LEU 53 HD11 LEU 53 -10.538 -0.841 -4.769
402 HD12 LEU 53 HD12 LEU 53 -12.135 -0.541 -5.489
403 HD13 LEU 53 HD13 LEU 53 -11.087 0.822 -5.018
404 HD21 LEU 53 HD21 LEU 53 -9.973 -2.277 -6.618
405 HD22 LEU 53 HD22 LEU 53 -9.932 -1.695 -8.282
406 HD23 LEU 53 HD23 LEU 53 -11.493 -1.978 -7.482
407 H ALA 54 H ALA 54 -10.493 3.512 -9.905
408 HA ALA 54 HA ALA 54 -13.013 3.479 -11.429
409 HB1 ALA 54 HB1 ALA 54 -10.938 5.691 -11.159
410 HB2 ALA 54 HB2 ALA 54 -12.570 5.828 -11.828
411 HB3 ALA 54 HB3 ALA 54 -12.356 5.470 -10.107
412 H GLU 55 H GLU 55 -9.476 3.620 -12.198
413 HA GLU 55 HA GLU 55 -9.914 3.449 -15.050
414 HB2 GLU 55 HB2 GLU 55 -7.670 3.414 -15.325
415 HB3 GLU 55 HB3 GLU 55 -7.782 4.266 -13.805
416 HG2 GLU 55 HG2 GLU 55 -6.977 2.326 -12.619
417 HG3 GLU 55 HG3 GLU 55 -7.203 1.267 -13.988
418 H LYS 56 H LYS 56 -10.361 1.192 -12.637
419 HA LYS 56 HA LYS 56 -10.599 -1.038 -12.447
420 HB2 LYS 56 HB2 LYS 56 -11.776 -0.673 -15.223
421 HB3 LYS 56 HB3 LYS 56 -11.935 -2.141 -14.240
422 HG2 LYS 56 HG2 LYS 56 -12.899 -0.763 -12.390
423 HG3 LYS 56 HG3 LYS 56 -12.902 0.648 -13.451
424 HD2 LYS 56 HD2 LYS 56 -14.541 -0.378 -14.919
425 HD3 LYS 56 HD3 LYS 56 -14.373 -1.938 -14.077
426 HE2 LYS 56 HE2 LYS 56 -15.111 -0.802 -11.948
427 HE3 LYS 56 HE3 LYS 56 -15.456 0.663 -12.879
428 HZ1 LYS 56 HZ1 LYS 56 -16.722 -1.986 -13.369
429 HZ2 LYS 56 HZ2 LYS 56 -17.127 -0.558 -14.105
430 HZ3 LYS 56 HZ3 LYS 56 -17.421 -0.777 -12.522
431 H ASP 57 H ASP 57 -8.228 -0.768 -12.443
432 HA ASP 57 HA ASP 57 -6.705 -2.427 -14.350
433 HB2 ASP 57 HB2 ASP 57 -5.642 -0.480 -13.147
434 HB3 ASP 57 HB3 ASP 57 -5.860 -1.372 -11.632
435 HA PRO 58 HA PRO 58 -9.193 -5.352 -12.540
436 HB2 PRO 58 HB2 PRO 58 -8.632 -7.552 -14.006
437 HB3 PRO 58 HB3 PRO 58 -9.255 -5.988 -14.664
438 HG2 PRO 58 HG2 PRO 58 -6.302 -6.725 -14.551
439 HG3 PRO 58 HG3 PRO 58 -7.282 -6.441 -16.041
440 HD2 PRO 58 HD2 PRO 58 -5.933 -4.485 -14.824
441 HD3 PRO 58 HD3 PRO 58 -7.615 -4.178 -15.371
442 H LEU 59 H LEU 59 -5.818 -5.822 -12.260
443 HA LEU 59 HA LEU 59 -5.692 -7.996 -10.378
444 HB2 LEU 59 HB2 LEU 59 -3.799 -6.778 -11.669
445 HB3 LEU 59 HB3 LEU 59 -3.853 -5.576 -10.397
446 HG LEU 59 HG LEU 59 -2.038 -7.061 -10.003
447 HD11 LEU 59 HD11 LEU 59 -4.114 -8.071 -8.038
448 HD12 LEU 59 HD12 LEU 59 -3.342 -6.468 -7.943
449 HD13 LEU 59 HD13 LEU 59 -2.361 -7.933 -7.825
450 HD21 LEU 59 HD21 LEU 59 -3.956 -9.419 -10.098
451 HD22 LEU 59 HD22 LEU 59 -2.210 -9.469 -9.792
452 HD23 LEU 59 HD23 LEU 59 -2.803 -8.953 -11.377
453 H ALA 60 H ALA 60 -6.107 -4.404 -9.830
454 HA ALA 60 HA ALA 60 -6.374 -4.714 -6.977
455 HB1 ALA 60 HB1 ALA 60 -5.903 -2.519 -7.961
456 HB2 ALA 60 HB2 ALA 60 -7.483 -2.545 -8.787
457 HB3 ALA 60 HB3 ALA 60 -7.399 -2.526 -7.009
458 H MET 61 H MET 61 -8.669 -4.674 -9.670
459 HA MET 61 HA MET 61 -11.109 -4.655 -8.244
460 HB2 MET 61 HB2 MET 61 -10.555 -5.977 -10.918
461 HB3 MET 61 HB3 MET 61 -12.116 -5.476 -10.307
462 HG2 MET 61 HG2 MET 61 -9.843 -3.555 -10.897
463 HG3 MET 61 HG3 MET 61 -11.121 -3.959 -12.028
464 HE1 MET 61 HE1 MET 61 -13.773 -4.006 -10.108
465 HE2 MET 61 HE2 MET 61 -14.278 -2.366 -10.549
466 HE3 MET 61 HE3 MET 61 -13.549 -3.434 -11.778
467 H LEU 62 H LEU 62 -8.893 -7.335 -8.725
468 HA LEU 62 HA LEU 62 -10.672 -9.485 -7.885
469 HB2 LEU 62 HB2 LEU 62 -7.678 -9.097 -7.745
470 HB3 LEU 62 HB3 LEU 62 -8.470 -10.562 -7.232
471 HG LEU 62 HG LEU 62 -8.649 -9.538 -10.090
472 HD11 LEU 62 HD11 LEU 62 -6.996 -11.250 -10.630
473 HD12 LEU 62 HD12 LEU 62 -6.878 -11.707 -8.915
474 HD13 LEU 62 HD13 LEU 62 -6.327 -10.104 -9.450
475 HD21 LEU 62 HD21 LEU 62 -9.378 -11.837 -10.585
476 HD22 LEU 62 HD22 LEU 62 -10.481 -11.076 -9.436
477 HD23 LEU 62 HD23 LEU 62 -9.286 -12.257 -8.861
478 H LEU 63 H LEU 63 -8.355 -7.278 -6.187
479 HA LEU 63 HA LEU 63 -8.249 -9.070 -3.875
480 HB2 LEU 63 HB2 LEU 63 -7.326 -6.183 -4.176
481 HB3 LEU 63 HB3 LEU 63 -6.814 -7.288 -2.916
482 HG LEU 63 HG LEU 63 -6.248 -7.843 -5.853
483 HD11 LEU 63 HD11 LEU 63 -4.140 -6.668 -5.526
484 HD12 LEU 63 HD12 LEU 63 -4.593 -6.288 -3.842
485 HD13 LEU 63 HD13 LEU 63 -5.529 -5.594 -5.177
486 HD21 LEU 63 HD21 LEU 63 -4.406 -9.175 -4.915
487 HD22 LEU 63 HD22 LEU 63 -5.984 -9.737 -4.306
488 HD23 LEU 63 HD23 LEU 63 -4.942 -8.746 -3.271
489 H PHE 64 H PHE 64 -9.247 -5.802 -4.399
490 HA PHE 64 HA PHE 64 -10.327 -5.314 -1.820
491 HB2 PHE 64 HB2 PHE 64 -10.665 -3.255 -2.535
492 HB3 PHE 64 HB3 PHE 64 -9.963 -3.754 -4.054
493 HD1 PHE 64 HD2 PHE 64 -11.566 -4.548 -5.929
494 HD2 PHE 64 HD1 PHE 64 -12.907 -2.551 -2.357
495 HE1 PHE 64 HE2 PHE 64 -13.759 -4.098 -7.006
496 HE2 PHE 64 HE1 PHE 64 -15.091 -2.072 -3.437
497 HZ PHE 64 HZ PHE 64 -15.535 -2.879 -5.748
498 H GLU 65 H GLU 65 -11.955 -6.814 -4.572
499 HA GLU 65 HA GLU 65 -14.593 -7.011 -3.624
500 HB2 GLU 65 HB2 GLU 65 -13.685 -7.079 -5.932
501 HB3 GLU 65 HB3 GLU 65 -12.881 -8.611 -5.572
502 HG2 GLU 65 HG2 GLU 65 -15.051 -9.658 -5.227
503 HG3 GLU 65 HG3 GLU 65 -15.847 -8.104 -5.576
504 H GLN 66 H GLN 66 -11.713 -8.875 -2.785
505 HA GLN 66 HA GLN 66 -13.342 -10.836 -1.234
506 HB2 GLN 66 HB2 GLN 66 -10.374 -10.900 -1.866
507 HB3 GLN 66 HB3 GLN 66 -11.295 -12.129 -1.000
508 HG2 GLN 66 HG2 GLN 66 -11.550 -11.367 -3.921
509 HG3 GLN 66 HG3 GLN 66 -10.913 -12.870 -3.278
510 HE21 GLN 66 HE21 GLN 66 -13.369 -12.052 -5.049
511 HE22 GLN 66 HE22 GLN 66 -14.706 -12.930 -4.283
512 H TYR 67 H TYR 67 -11.784 -7.899 -0.809
513 HA TYR 67 HA TYR 67 -11.474 -8.307 2.119
514 HB2 TYR 67 HB2 TYR 67 -10.464 -6.125 0.285
515 HB3 TYR 67 HB3 TYR 67 -10.352 -6.070 2.040
516 HD1 TYR 67 HD1 TYR 67 -9.498 -8.603 2.968
517 HD2 TYR 67 HD2 TYR 67 -8.261 -6.494 -0.589
518 HE1 TYR 67 HE1 TYR 67 -7.336 -9.787 3.004
519 HE2 TYR 67 HE2 TYR 67 -6.053 -7.680 -0.515
520 HH TYR 67 HH TYR 67 -5.330 -10.011 2.131
521 H ASN 68 H ASN 68 -14.052 -8.459 1.220
522 HA ASN 68 HA ASN 68 -16.115 -7.804 1.673
523 HB2 ASN 68 HB2 ASN 68 -14.929 -7.695 3.954
524 HB3 ASN 68 HB3 ASN 68 -15.011 -5.941 3.778
525 HD21 ASN 68 HD21 ASN 68 -16.148 -6.138 5.798
526 HD22 ASN 68 HD22 ASN 68 -17.855 -6.594 5.819
527 H ARG 69 H ARG 69 -14.572 -6.209 -0.315
528 HA ARG 69 HA ARG 69 -14.711 -4.426 -1.660
529 HB2 ARG 69 HB2 ARG 69 -17.596 -4.198 -0.765
530 HB3 ARG 69 HB3 ARG 69 -16.885 -3.468 -2.205
531 HG2 ARG 69 HG2 ARG 69 -16.396 -5.695 -3.140
532 HG3 ARG 69 HG3 ARG 69 -17.102 -6.467 -1.702
533 HD2 ARG 69 HD2 ARG 69 -19.264 -5.320 -2.174
534 HD3 ARG 69 HD3 ARG 69 -18.572 -4.638 -3.651
535 HE ARG 69 HE ARG 69 -19.409 -7.411 -3.139
536 HH11 ARG 69 HH11 ARG 69 -17.657 -5.263 -5.392
537 HH12 ARG 69 HH12 ARG 69 -17.790 -6.392 -6.722
538 HH21 ARG 69 HH21 ARG 69 -19.549 -8.831 -4.887
539 HH22 ARG 69 HH22 ARG 69 -18.859 -8.406 -6.437
540 H LEU 70 H LEU 70 -13.909 -3.926 1.198
541 HA LEU 70 HA LEU 70 -14.870 -1.250 1.820
542 HB2 LEU 70 HB2 LEU 70 -14.342 -3.119 3.487
543 HB3 LEU 70 HB3 LEU 70 -12.641 -2.802 3.164
544 HG LEU 70 HG LEU 70 -13.176 -0.321 3.843
545 HD11 LEU 70 HD11 LEU 70 -15.594 -1.716 5.067
546 HD12 LEU 70 HD12 LEU 70 -15.653 -0.511 3.763
547 HD13 LEU 70 HD13 LEU 70 -15.071 -0.042 5.362
548 HD21 LEU 70 HD21 LEU 70 -13.316 -2.585 5.864
549 HD22 LEU 70 HD22 LEU 70 -12.988 -0.874 6.247
550 HD23 LEU 70 HD23 LEU 70 -11.857 -1.790 5.247
551 H ALA 71 H ALA 71 -14.030 -0.734 -0.501
552 HA ALA 71 HA ALA 71 -11.442 -0.592 -1.328
553 HB1 ALA 71 HB1 ALA 71 -13.651 1.436 -1.864
554 HB2 ALA 71 HB2 ALA 71 -12.203 1.204 -2.860
555 HB3 ALA 71 HB3 ALA 71 -13.403 -0.098 -2.729
556 H MET 72 H MET 72 -9.627 0.418 -0.819
557 HA MET 72 HA MET 72 -9.402 2.239 1.302
558 HB2 MET 72 HB2 MET 72 -7.713 0.624 0.514
559 HB3 MET 72 HB3 MET 72 -7.415 1.613 -0.917
560 HG2 MET 72 HG2 MET 72 -6.483 3.392 0.455
561 HG3 MET 72 HG3 MET 72 -7.087 2.622 1.924
562 HE1 MET 72 HE1 MET 72 -4.139 2.501 -0.796
563 HE2 MET 72 HE2 MET 72 -3.487 0.894 -0.465
564 HE3 MET 72 HE3 MET 72 -5.110 1.052 -1.165
565 HA PRO 73 HA PRO 73 -10.235 6.160 -0.768
566 HB2 PRO 73 HB2 PRO 73 -9.258 7.926 1.089
567 HB3 PRO 73 HB3 PRO 73 -10.781 7.010 1.311
568 HG2 PRO 73 HG2 PRO 73 -8.016 6.315 2.363
569 HG3 PRO 73 HG3 PRO 73 -9.562 6.377 3.275
570 HD2 PRO 73 HD2 PRO 73 -8.597 4.044 2.328
571 HD3 PRO 73 HD3 PRO 73 -10.345 4.384 2.252
572 H ASN 74 H ASN 74 -9.081 7.987 -1.715
573 HA ASN 74 HA ASN 74 -6.234 7.461 -2.338
574 HB2 ASN 74 HB2 ASN 74 -7.650 8.285 -4.143
575 HB3 ASN 74 HB3 ASN 74 -8.087 9.707 -3.199
576 HD21 ASN 74 HD21 ASN 74 -7.072 10.192 -5.646
577 HD22 ASN 74 HD22 ASN 74 -5.394 10.764 -5.467
578 H MET 75 H MET 75 -4.847 7.843 -0.837
579 HA MET 75 HA MET 75 -5.271 9.685 1.393
580 HB2 MET 75 HB2 MET 75 -3.015 7.781 0.681
581 HB3 MET 75 HB3 MET 75 -3.158 8.631 2.220
582 HG2 MET 75 HG2 MET 75 -5.098 7.439 2.856
583 HG3 MET 75 HG3 MET 75 -5.373 6.797 1.245
584 HE1 MET 75 HE1 MET 75 -2.821 3.944 0.832
585 HE2 MET 75 HE2 MET 75 -4.261 4.763 0.183
586 HE3 MET 75 HE3 MET 75 -2.688 5.594 0.205
587 H ARG 76 H ARG 76 -4.192 10.341 -1.652
588 HA ARG 76 HA ARG 76 -2.801 11.810 -2.657
589 HB2 ARG 76 HB2 ARG 76 -3.493 13.474 -0.209
590 HB3 ARG 76 HB3 ARG 76 -2.849 14.108 -1.720
591 HG2 ARG 76 HG2 ARG 76 -5.532 12.680 -1.433
592 HG3 ARG 76 HG3 ARG 76 -5.287 14.427 -1.497
593 HD2 ARG 76 HD2 ARG 76 -4.294 14.210 -3.765
594 HD3 ARG 76 HD3 ARG 76 -4.606 12.465 -3.726
595 HE ARG 76 HE ARG 76 -7.034 13.785 -3.152
596 HH11 ARG 76 HH11 ARG 76 -4.810 13.425 -5.916
597 HH12 ARG 76 HH12 ARG 76 -6.077 13.649 -7.100
598 HH21 ARG 76 HH21 ARG 76 -8.649 14.064 -4.728
599 HH22 ARG 76 HH22 ARG 76 -8.241 14.019 -6.430
600 H LEU 77 H LEU 77 -1.149 10.073 -1.993
601 HA LEU 77 HA LEU 77 0.959 10.993 -0.154
602 HB2 LEU 77 HB2 LEU 77 1.082 8.626 -2.019
603 HB3 LEU 77 HB3 LEU 77 2.064 8.955 -0.591
604 HG LEU 77 HG LEU 77 -0.873 8.172 -0.628
605 HD11 LEU 77 HD11 LEU 77 1.578 6.718 0.452
606 HD12 LEU 77 HD12 LEU 77 0.800 6.374 -1.107
607 HD13 LEU 77 HD13 LEU 77 -0.099 6.116 0.383
608 HD21 LEU 77 HD21 LEU 77 0.958 8.815 1.728
609 HD22 LEU 77 HD22 LEU 77 -0.625 8.011 1.859
610 HD23 LEU 77 HD23 LEU 77 -0.533 9.667 1.260
611 H GLY 78 H GLY 78 2.915 11.875 -0.671
612 HA2 GLY 78 HA2 GLY 78 3.233 13.014 -3.379
613 HA3 GLY 78 HA3 GLY 78 4.216 13.368 -1.969
614 H ASP 79 H ASP 79 5.033 12.701 -4.759
615 HA ASP 79 HA ASP 79 5.798 10.030 -5.106
616 HB2 ASP 79 HB2 ASP 79 7.156 12.534 -6.181
617 HB3 ASP 79 HB3 ASP 79 7.382 10.904 -6.811
618 H ALA 80 H ALA 80 7.586 12.533 -3.327
619 HA ALA 80 HA ALA 80 9.987 10.857 -3.011
620 HB1 ALA 80 HB1 ALA 80 10.821 12.810 -1.766
621 HB2 ALA 80 HB2 ALA 80 10.168 13.277 -3.347
622 HB3 ALA 80 HB3 ALA 80 9.219 13.573 -1.873
623 H GLU 81 H GLU 81 7.066 11.483 -1.177
624 HA GLU 81 HA GLU 81 7.971 10.391 1.374
625 HB2 GLU 81 HB2 GLU 81 6.345 12.053 1.511
626 HB3 GLU 81 HB3 GLU 81 5.484 11.503 0.080
627 HG2 GLU 81 HG2 GLU 81 4.529 9.639 1.269
628 HG3 GLU 81 HG3 GLU 81 5.403 10.100 2.748
629 H VAL 82 H VAL 82 6.022 9.295 -1.410
630 HA VAL 82 HA VAL 82 5.489 6.591 -0.600
631 HB VAL 82 HB VAL 82 5.815 7.945 -3.315
632 HG11 VAL 82 HG11 VAL 82 4.828 5.126 -2.741
633 HG12 VAL 82 HG12 VAL 82 4.646 5.989 -4.283
634 HG13 VAL 82 HG13 VAL 82 6.256 5.576 -3.705
635 HG21 VAL 82 HG21 VAL 82 3.861 8.624 -1.920
636 HG22 VAL 82 HG22 VAL 82 3.368 7.771 -3.384
637 HG23 VAL 82 HG23 VAL 82 3.355 6.926 -1.816
638 H SER 83 H SER 83 8.348 7.946 -2.478
639 HA SER 83 HA SER 83 9.498 5.357 -2.854
640 HB2 SER 83 HB2 SER 83 11.549 6.563 -3.479
641 HB3 SER 83 HB3 SER 83 10.103 7.209 -4.283
642 HG SER 83 HG SER 83 11.772 8.650 -3.092
643 H ALA 84 H ALA 84 9.967 7.702 -0.186
644 HA ALA 84 HA ALA 84 11.980 6.151 1.191
645 HB1 ALA 84 HB1 ALA 84 11.589 8.545 1.611
646 HB2 ALA 84 HB2 ALA 84 9.954 8.193 2.211
647 HB3 ALA 84 HB3 ALA 84 11.377 7.603 3.100
648 H LEU 85 H LEU 85 8.394 6.168 1.329
649 HA LEU 85 HA LEU 85 8.143 4.250 3.427
650 HB2 LEU 85 HB2 LEU 85 6.442 5.928 2.521
651 HB3 LEU 85 HB3 LEU 85 6.195 4.831 1.165
652 HG LEU 85 HG LEU 85 5.446 3.062 2.799
653 HD11 LEU 85 HD11 LEU 85 4.798 3.875 5.085
654 HD12 LEU 85 HD12 LEU 85 5.706 5.369 4.787
655 HD13 LEU 85 HD13 LEU 85 6.547 3.807 4.860
656 HD21 LEU 85 HD21 LEU 85 3.982 5.735 2.915
657 HD22 LEU 85 HD22 LEU 85 3.277 4.148 3.290
658 HD23 LEU 85 HD23 LEU 85 3.823 4.504 1.641
659 H ILE 86 H ILE 86 8.578 3.860 -0.036
660 HA ILE 86 HA ILE 86 8.081 1.012 -0.266
661 HB ILE 86 HB ILE 86 9.172 3.175 -1.958
662 HG12 ILE 86 HG12 ILE 86 7.848 2.024 -3.650
663 HG13 ILE 86 HG13 ILE 86 7.595 0.643 -2.580
664 HG21 ILE 86 HG21 ILE 86 10.093 0.314 -2.470
665 HG22 ILE 86 HG22 ILE 86 10.162 1.648 -3.632
666 HG23 ILE 86 HG23 ILE 86 11.135 1.729 -2.169
667 HD11 ILE 86 HD11 ILE 86 6.254 2.131 -1.049
668 HD12 ILE 86 HD12 ILE 86 6.498 3.455 -2.215
669 HD13 ILE 86 HD13 ILE 86 5.590 2.024 -2.681
670 H SER 87 H SER 87 11.034 2.940 0.433
671 HA SER 87 HA SER 87 12.750 0.660 0.864
672 HB2 SER 87 HB2 SER 87 12.934 3.553 1.778
673 HB3 SER 87 HB3 SER 87 14.171 2.332 2.101
674 HG SER 87 HG SER 87 14.753 3.369 0.275
675 H TYR 88 H TYR 88 10.527 2.452 3.103
676 HA TYR 88 HA TYR 88 11.369 0.914 5.426
677 HB2 TYR 88 HB2 TYR 88 10.142 2.807 5.882
678 HB3 TYR 88 HB3 TYR 88 8.867 2.446 4.724
679 HD1 TYR 88 HD1 TYR 88 10.367 1.375 7.976
680 HD2 TYR 88 HD2 TYR 88 6.932 1.208 5.373
681 HE1 TYR 88 HE1 TYR 88 9.034 0.331 9.804
682 HE2 TYR 88 HE2 TYR 88 5.613 0.126 7.202
683 HH TYR 88 HH TYR 88 7.078 -0.714 10.334
684 H LEU 89 H LEU 89 8.931 0.200 2.885
685 HA LEU 89 HA LEU 89 8.052 -2.245 4.120
686 HB2 LEU 89 HB2 LEU 89 7.913 -1.250 1.248
687 HB3 LEU 89 HB3 LEU 89 7.148 -2.734 1.799
688 HG LEU 89 HG LEU 89 6.492 0.037 2.896
689 HD11 LEU 89 HD11 LEU 89 5.813 -0.243 0.543
690 HD12 LEU 89 HD12 LEU 89 4.412 -0.180 1.621
691 HD13 LEU 89 HD13 LEU 89 4.957 -1.743 0.964
692 HD21 LEU 89 HD21 LEU 89 5.999 -1.654 4.572
693 HD22 LEU 89 HD22 LEU 89 5.182 -2.667 3.363
694 HD23 LEU 89 HD23 LEU 89 4.494 -1.098 3.844
695 H GLU 90 H GLU 90 10.960 -1.628 2.255
696 HA GLU 90 HA GLU 90 11.584 -4.480 1.905
697 HB2 GLU 90 HB2 GLU 90 13.334 -1.985 1.896
698 HB3 GLU 90 HB3 GLU 90 13.924 -3.606 1.576
699 HG2 GLU 90 HG2 GLU 90 11.831 -2.131 -0.064
700 HG3 GLU 90 HG3 GLU 90 13.519 -2.333 -0.488
701 H GLU 91 H GLU 91 12.214 -2.039 4.429
702 HA GLU 91 HA GLU 91 14.076 -3.768 5.863
703 HB2 GLU 91 HB2 GLU 91 12.844 -1.057 6.475
704 HB3 GLU 91 HB3 GLU 91 13.955 -1.900 7.572
705 HG2 GLU 91 HG2 GLU 91 15.691 -1.966 5.854
706 HG3 GLU 91 HG3 GLU 91 14.619 -1.202 4.681
707 H GLU 92 H GLU 92 10.769 -2.547 6.698
708 HA GLU 92 HA GLU 92 10.752 -3.933 9.197
709 HB2 GLU 92 HB2 GLU 92 9.327 -1.953 8.432
710 HB3 GLU 92 HB3 GLU 92 8.303 -3.123 7.609
711 HG2 GLU 92 HG2 GLU 92 7.164 -2.953 9.583
712 HG3 GLU 92 HG3 GLU 92 8.223 -4.272 10.030
713 H THR 93 H THR 93 9.582 -4.905 5.993
714 HA THR 93 HA THR 93 8.377 -7.405 6.491
715 HB THR 93 HB THR 93 10.177 -6.489 4.210
716 HG1 THR 93 HG1 THR 93 8.506 -5.439 3.716
717 HG21 THR 93 HG21 THR 93 9.012 -8.192 2.820
718 HG22 THR 93 HG22 THR 93 8.298 -8.880 4.289
719 HG23 THR 93 HG23 THR 93 10.057 -8.924 4.042
720 H ALA 94 H ALA 94 11.885 -6.603 6.252
721 HA ALA 94 HA ALA 94 12.677 -9.403 6.580
722 HB1 ALA 94 HB1 ALA 94 13.962 -7.906 5.165
723 HB2 ALA 94 HB2 ALA 94 14.287 -6.817 6.534
724 HB3 ALA 94 HB3 ALA 94 14.952 -8.466 6.521
725 H ARG 95 H ARG 95 12.670 -6.455 8.653
726 HA ARG 95 HA ARG 95 13.885 -7.585 10.955
727 HB2 ARG 95 HB2 ARG 95 11.982 -5.294 10.489
728 HB3 ARG 95 HB3 ARG 95 12.184 -5.879 12.133
729 HG2 ARG 95 HG2 ARG 95 13.707 -4.095 11.873
730 HG3 ARG 95 HG3 ARG 95 14.647 -5.586 11.964
731 HD2 ARG 95 HD2 ARG 95 14.888 -5.539 9.467
732 HD3 ARG 95 HD3 ARG 95 13.985 -4.015 9.441
733 HE ARG 95 HE ARG 95 16.742 -4.467 10.374
734 HH11 ARG 95 HH11 ARG 95 14.068 -2.118 10.084
735 HH12 ARG 95 HH12 ARG 95 15.119 -0.741 10.331
736 HH21 ARG 95 HH21 ARG 95 18.057 -2.657 10.664
737 HH22 ARG 95 HH22 ARG 95 17.374 -1.046 10.649
738 H LEU 96 H LEU 96 10.483 -7.850 9.888
739 HA LEU 96 HA LEU 96 9.491 -9.184 12.204
740 HB2 LEU 96 HB2 LEU 96 8.625 -8.722 9.389
741 HB3 LEU 96 HB3 LEU 96 8.012 -10.173 10.072
742 HG LEU 96 HG LEU 96 6.506 -8.261 10.206
743 HD11 LEU 96 HD11 LEU 96 7.363 -9.470 12.857
744 HD12 LEU 96 HD12 LEU 96 6.339 -10.242 11.628
745 HD13 LEU 96 HD13 LEU 96 5.764 -8.778 12.467
746 HD21 LEU 96 HD21 LEU 96 8.424 -7.305 12.334
747 HD22 LEU 96 HD22 LEU 96 6.854 -6.577 11.907
748 HD23 LEU 96 HD23 LEU 96 8.176 -6.581 10.719
749 H GLN 97 H GLN 97 11.574 -10.551 9.734
750 HA GLN 97 HA GLN 97 10.841 -13.312 10.485
751 HB2 GLN 97 HB2 GLN 97 12.954 -12.251 8.596
752 HB3 GLN 97 HB3 GLN 97 12.615 -13.958 8.888
753 HG2 GLN 97 HG2 GLN 97 10.275 -13.606 8.087
754 HG3 GLN 97 HG3 GLN 97 10.690 -11.934 7.670
755 HE21 GLN 97 HE21 GLN 97 11.264 -15.358 6.862
756 HE22 GLN 97 HE22 GLN 97 12.110 -15.031 5.345
757 H THR 98 H THR 98 13.102 -10.953 11.557
758 HA THR 98 HA THR 98 14.240 -12.840 13.592
759 HB THR 98 HB THR 98 15.788 -10.764 12.005
760 HG1 THR 98 HG1 THR 98 15.838 -12.780 11.106
761 HG21 THR 98 HG21 THR 98 16.631 -10.390 14.191
762 HG22 THR 98 HG22 THR 98 17.726 -11.580 13.511
763 HG23 THR 98 HG23 THR 98 16.462 -12.096 14.654
764 HA PRO 99 HA PRO 99 11.758 -9.253 15.097
765 HB2 PRO 99 HB2 PRO 99 9.858 -10.487 16.561
766 HB3 PRO 99 HB3 PRO 99 9.860 -10.545 14.774
767 HG2 PRO 99 HG2 PRO 99 10.979 -12.637 16.680
768 HG3 PRO 99 HG3 PRO 99 9.812 -12.880 15.337
769 HD2 PRO 99 HD2 PRO 99 12.497 -13.270 15.013
770 HD3 PRO 99 HD3 PRO 99 11.470 -12.594 13.713
771 H VAL 100 H VAL 100 14.085 -9.249 16.034
772 HA VAL 100 HA VAL 100 14.322 -10.251 18.794
773 HB VAL 100 HB VAL 100 15.758 -10.916 16.800
774 HG11 VAL 100 HG11 VAL 100 17.163 -8.280 17.404
775 HG12 VAL 100 HG12 VAL 100 17.687 -9.536 16.275
776 HG13 VAL 100 HG13 VAL 100 16.209 -8.620 15.942
777 HG21 VAL 100 HG21 VAL 100 17.254 -9.946 19.276
778 HG22 VAL 100 HG22 VAL 100 16.345 -11.464 19.148
779 HG23 VAL 100 HG23 VAL 100 17.769 -11.196 18.130
780 H THR 101 H THR 101 13.690 -7.258 17.454
781 HA THR 101 HA THR 101 13.808 -5.097 18.132
782 HB THR 101 HB THR 101 13.480 -6.202 20.931
783 HG1 THR 101 HG1 THR 101 11.952 -7.206 19.898
784 HG21 THR 101 HG21 THR 101 12.346 -3.710 19.564
785 HG22 THR 101 HG22 THR 101 13.681 -3.695 20.730
786 HG23 THR 101 HG23 THR 101 12.085 -4.210 21.252
787 H ASN 102 H ASN 102 16.124 -5.159 17.422
788 HA ASN 102 HA ASN 102 18.237 -4.942 19.393
789 HB2 ASN 102 HB2 ASN 102 18.074 -3.881 16.534
790 HB3 ASN 102 HB3 ASN 102 19.541 -4.004 17.502
791 HD21 ASN 102 HD21 ASN 102 20.195 -6.247 18.214
792 HD22 ASN 102 HD22 ASN 102 19.818 -7.557 17.091
793 H ARG 103 H ARG 103 16.024 -2.549 17.920
794 HA ARG 103 HA ARG 103 17.155 -0.402 19.651
795 HB2 ARG 103 HB2 ARG 103 16.755 0.061 17.236
796 HB3 ARG 103 HB3 ARG 103 15.027 -0.211 17.502
797 HG2 ARG 103 HG2 ARG 103 15.150 1.642 19.299
798 HG3 ARG 103 HG3 ARG 103 16.808 1.934 18.756
799 HD2 ARG 103 HD2 ARG 103 15.369 3.531 17.673
800 HD3 ARG 103 HD3 ARG 103 15.902 2.368 16.443
801 HE ARG 103 HE ARG 103 13.409 1.579 17.675
802 HH11 ARG 103 HH11 ARG 103 14.711 3.783 15.193
803 HH12 ARG 103 HH12 ARG 103 13.206 3.821 14.300
804 HH21 ARG 103 HH21 ARG 103 11.493 1.654 16.488
805 HH22 ARG 103 HH22 ARG 103 11.389 2.618 15.031
806 H GLY 104 H GLY 104 16.422 -0.474 21.643
807 HA2 GLY 104 HA2 GLY 104 13.729 -1.424 22.392
808 HA3 GLY 104 HA3 GLY 104 15.029 -0.909 23.462
809 H ILE 105 H ILE 105 13.344 0.144 24.645
810 HA ILE 105 HA ILE 105 12.546 2.822 23.576
811 HB ILE 105 HB ILE 105 11.283 1.265 25.837
812 HG12 ILE 105 HG12 ILE 105 10.273 1.921 23.025
813 HG13 ILE 105 HG13 ILE 105 10.783 0.327 23.578
814 HG21 ILE 105 HG21 ILE 105 11.243 3.760 26.171
815 HG22 ILE 105 HG22 ILE 105 10.486 3.939 24.575
816 HG23 ILE 105 HG23 ILE 105 9.642 3.105 25.897
817 HD11 ILE 105 HD11 ILE 105 8.406 0.366 23.579
818 HD12 ILE 105 HD12 ILE 105 8.946 0.349 25.271
819 HD13 ILE 105 HD13 ILE 105 8.347 1.856 24.529
820 HA PRO 106 HA PRO 106 16.028 4.145 25.970
821 HB2 PRO 106 HB2 PRO 106 14.552 6.773 26.190
822 HB3 PRO 106 HB3 PRO 106 16.270 6.477 25.778
823 HG2 PRO 106 HG2 PRO 106 14.488 6.967 23.810
824 HG3 PRO 106 HG3 PRO 106 15.678 5.639 23.611
825 HD2 PRO 106 HD2 PRO 106 12.769 5.453 24.430
826 HD3 PRO 106 HD3 PRO 106 13.703 4.456 23.273
827 HHA HEC 107 HHA HEC 107 -5.711 -3.499 0.420
828 HHB HEC 107 HHB HEC 107 -0.242 -0.096 0.749
829 HHC HEC 107 HHC HEC 107 -3.049 3.907 5.022
830 HHD HEC 107 HHD HEC 107 -8.252 0.111 5.118
831 HMA1 HEC 107 HMA1 HEC 107 -0.717 -3.343 -1.261
832 HMA2 HEC 107 HMA2 HEC 107 -0.401 -1.604 -1.419
833 HMA3 HEC 107 HMA3 HEC 107 0.144 -2.489 0.020
834 HAA1 HEC 107 HAA1 HEC 107 -4.466 -3.904 -1.435
835 HAA2 HEC 107 HAA2 HEC 107 -2.850 -3.698 -2.037
836 HBA1 HEC 107 HBA1 HEC 107 -2.122 -5.182 0.027
837 HBA2 HEC 107 HBA2 HEC 107 -3.839 -5.661 0.039
838 HMB1 HEC 107 HMB1 HEC 107 0.842 3.067 1.053
839 HMB2 HEC 107 HMB2 HEC 107 1.616 2.608 2.559
840 HMB3 HEC 107 HMB3 HEC 107 1.284 1.373 1.367
841 HAB HEC 107 HAB HEC 107 -1.122 4.446 4.782
842 HBB1 HEC 107 HBB1 HEC 107 -0.771 5.545 2.617
843 HBB2 HEC 107 HBB2 HEC 107 0.354 6.070 3.875
844 HBB3 HEC 107 HBB3 HEC 107 0.906 4.956 2.613
845 HMC1 HEC 107 HMC1 HEC 107 -4.323 4.450 6.884
846 HMC2 HEC 107 HMC2 HEC 107 -5.439 5.183 5.719
847 HMC3 HEC 107 HMC3 HEC 107 -6.045 4.523 7.240
848 HAC HEC 107 HAC HEC 107 -8.356 1.420 6.702
849 HBC1 HEC 107 HBC1 HEC 107 -9.038 3.349 5.402
850 HBC2 HEC 107 HBC2 HEC 107 -9.590 3.431 7.080
851 HBC3 HEC 107 HBC3 HEC 107 -8.224 4.432 6.550
852 HMD1 HEC 107 HMD1 HEC 107 -9.479 -1.686 4.946
853 HMD2 HEC 107 HMD2 HEC 107 -10.173 -1.916 3.336
854 HMD3 HEC 107 HMD3 HEC 107 -9.481 -3.287 4.215
855 HAD1 HEC 107 HAD1 HEC 107 -7.626 -4.434 1.037
856 HAD2 HEC 107 HAD2 HEC 107 -8.915 -4.285 2.204
857 HBD1 HEC 107 HBD1 HEC 107 -9.866 -3.897 0.021
858 HBD2 HEC 107 HBD2 HEC 107 -9.864 -2.361 0.885
Start of MODEL 11
1 H SER 1 H SER 1 13.593 7.431 6.554
2 HA SER 1 HA SER 1 12.810 5.988 4.981
3 HB2 SER 1 HB2 SER 1 13.980 4.056 6.982
4 HB3 SER 1 HB3 SER 1 13.550 3.642 5.316
5 HG SER 1 HG SER 1 15.667 4.223 5.209
6 H GLY 2 H GLY 2 10.646 6.895 6.079
7 HA2 GLY 2 HA2 GLY 2 8.420 6.353 5.576
8 HA3 GLY 2 HA3 GLY 2 8.739 4.699 5.686
9 H GLU 3 H GLU 3 10.041 5.389 8.568
10 HA GLU 3 HA GLU 3 7.899 4.177 9.939
11 HB2 GLU 3 HB2 GLU 3 10.371 4.261 10.611
12 HB3 GLU 3 HB3 GLU 3 10.060 5.864 11.271
13 HG2 GLU 3 HG2 GLU 3 8.010 4.189 12.344
14 HG3 GLU 3 HG3 GLU 3 9.453 3.201 12.360
15 H GLN 4 H GLN 4 8.857 7.632 10.038
16 HA GLN 4 HA GLN 4 6.850 8.490 11.859
17 HB2 GLN 4 HB2 GLN 4 8.919 9.698 11.231
18 HB3 GLN 4 HB3 GLN 4 8.253 10.022 9.624
19 HG2 GLN 4 HG2 GLN 4 6.422 11.340 10.689
20 HG3 GLN 4 HG3 GLN 4 7.117 11.025 12.275
21 HE21 GLN 4 HE21 GLN 4 6.725 13.627 10.666
22 HE22 GLN 4 HE22 GLN 4 8.336 14.353 10.764
23 H ILE 5 H ILE 5 6.698 8.009 8.331
24 HA ILE 5 HA ILE 5 4.120 9.321 7.975
25 HB ILE 5 HB ILE 5 5.488 7.210 6.211
26 HG12 ILE 5 HG12 ILE 5 5.650 10.249 5.998
27 HG13 ILE 5 HG13 ILE 5 6.944 9.197 6.583
28 HG21 ILE 5 HG21 ILE 5 3.057 7.534 5.721
29 HG22 ILE 5 HG22 ILE 5 3.317 9.285 5.600
30 HG23 ILE 5 HG23 ILE 5 4.039 8.179 4.415
31 HD11 ILE 5 HD11 ILE 5 6.950 8.030 4.361
32 HD12 ILE 5 HD12 ILE 5 5.852 9.296 3.761
33 HD13 ILE 5 HD13 ILE 5 7.465 9.730 4.334
34 H PHE 6 H PHE 6 5.154 5.895 8.404
35 HA PHE 6 HA PHE 6 2.543 4.781 8.214
36 HB2 PHE 6 HB2 PHE 6 4.539 3.419 8.036
37 HB3 PHE 6 HB3 PHE 6 5.012 3.808 9.686
38 HD1 PHE 6 HD2 PHE 6 2.435 2.038 7.627
39 HD2 PHE 6 HD1 PHE 6 4.081 2.618 11.573
40 HE1 PHE 6 HE2 PHE 6 1.112 0.114 8.466
41 HE2 PHE 6 HE1 PHE 6 2.759 0.683 12.401
42 HZ PHE 6 HZ PHE 6 1.283 -0.574 10.853
43 H ARG 7 H ARG 7 4.381 5.859 11.096
44 HA ARG 7 HA ARG 7 2.421 5.198 13.051
45 HB2 ARG 7 HB2 ARG 7 4.887 5.758 13.309
46 HB3 ARG 7 HB3 ARG 7 4.452 7.453 13.134
47 HG2 ARG 7 HG2 ARG 7 4.751 6.920 15.450
48 HG3 ARG 7 HG3 ARG 7 3.043 7.275 15.204
49 HD2 ARG 7 HD2 ARG 7 3.937 4.396 15.013
50 HD3 ARG 7 HD3 ARG 7 3.959 5.152 16.611
51 HE ARG 7 HE ARG 7 1.482 5.811 15.791
52 HH11 ARG 7 HH11 ARG 7 3.127 2.635 15.787
53 HH12 ARG 7 HH12 ARG 7 1.649 1.765 16.127
54 HH21 ARG 7 HH21 ARG 7 -0.389 4.625 16.269
55 HH22 ARG 7 HH22 ARG 7 -0.323 2.881 16.400
56 H THR 8 H THR 8 2.788 8.118 11.022
57 HA THR 8 HA THR 8 0.720 9.517 12.570
58 HB THR 8 HB THR 8 1.295 11.489 11.128
59 HG1 THR 8 HG1 THR 8 3.482 10.020 10.233
60 HG21 THR 8 HG21 THR 8 3.576 11.836 12.059
61 HG22 THR 8 HG22 THR 8 3.617 10.136 12.571
62 HG23 THR 8 HG23 THR 8 2.421 11.238 13.264
63 H ARG 9 H ARG 9 0.772 8.150 9.274
64 HA ARG 9 HA ARG 9 -2.127 8.590 9.370
65 HB2 ARG 9 HB2 ARG 9 -2.460 9.693 7.337
66 HB3 ARG 9 HB3 ARG 9 -1.413 10.631 8.388
67 HG2 ARG 9 HG2 ARG 9 0.569 9.855 7.024
68 HG3 ARG 9 HG3 ARG 9 -0.591 9.068 5.920
69 HD2 ARG 9 HD2 ARG 9 -1.796 11.391 5.884
70 HD3 ARG 9 HD3 ARG 9 -0.281 12.032 6.542
71 HE ARG 9 HE ARG 9 -0.844 11.038 3.857
72 HH11 ARG 9 HH11 ARG 9 1.813 11.799 6.116
73 HH12 ARG 9 HH12 ARG 9 3.025 11.673 4.854
74 HH21 ARG 9 HH21 ARG 9 0.701 10.854 2.324
75 HH22 ARG 9 HH22 ARG 9 2.383 11.184 2.689
76 H CYS 10 H CYS 10 -0.815 6.244 9.711
77 HA CYS 10 HA CYS 10 -2.115 4.640 7.575
78 HB2 CYS 10 HB2 CYS 10 0.541 5.217 7.329
79 HB3 CYS 10 HB3 CYS 10 0.628 3.785 8.337
80 H SER 11 H SER 11 -1.190 4.931 10.923
81 HA SER 11 HA SER 11 -0.996 2.071 11.412
82 HB2 SER 11 HB2 SER 11 -0.959 4.478 13.255
83 HB3 SER 11 HB3 SER 11 -0.732 2.814 13.796
84 HG SER 11 HG SER 11 0.827 3.994 11.750
85 H SER 12 H SER 12 -2.170 0.958 13.117
86 HA SER 12 HA SER 12 -3.953 -0.198 13.754
87 HB2 SER 12 HB2 SER 12 -4.621 1.969 14.874
88 HB3 SER 12 HB3 SER 12 -5.744 2.219 13.522
89 HG SER 12 HG SER 12 -5.765 0.382 15.600
90 H CYS 13 H CYS 13 -4.802 1.815 10.929
91 HA CYS 13 HA CYS 13 -6.648 -0.060 9.723
92 HB2 CYS 13 HB2 CYS 13 -5.278 2.475 9.101
93 HB3 CYS 13 HB3 CYS 13 -5.326 1.438 7.712
94 H HIS 14 H HIS 14 -3.335 -0.409 10.240
95 HA HIS 14 HA HIS 14 -3.183 -2.690 8.410
96 HB2 HIS 14 2HB HIS 14 -1.486 -0.209 8.176
97 HB3 HIS 14 3HB HIS 14 -0.672 -1.743 7.968
98 HD1 HIS 14 1HD HIS 14 -2.043 -3.468 6.092
99 HD2 HIS 14 2HD HIS 14 -2.664 0.651 6.171
100 HE1 HIS 14 1HE HIS 14 -2.988 -2.901 3.805
101 H THR 15 H THR 15 -1.252 -3.838 8.658
102 HA THR 15 HA THR 15 0.399 -3.390 11.036
103 HB THR 15 HB THR 15 0.546 -5.867 11.574
104 HG1 THR 15 HG1 THR 15 -1.953 -5.806 10.243
105 HG21 THR 15 HG21 THR 15 -2.058 -4.503 12.328
106 HG22 THR 15 HG22 THR 15 -0.472 -4.139 13.051
107 HG23 THR 15 HG23 THR 15 -1.161 -5.751 13.221
108 H VAL 16 H VAL 16 2.471 -3.606 10.633
109 HA VAL 16 HA VAL 16 3.374 -5.442 8.451
110 HB VAL 16 HB VAL 16 4.143 -3.420 7.636
111 HG11 VAL 16 HG11 VAL 16 4.878 -2.498 10.396
112 HG12 VAL 16 HG12 VAL 16 5.308 -1.703 8.863
113 HG13 VAL 16 HG13 VAL 16 3.602 -1.872 9.302
114 HG21 VAL 16 HG21 VAL 16 6.515 -3.474 7.753
115 HG22 VAL 16 HG22 VAL 16 6.492 -4.328 9.301
116 HG23 VAL 16 HG23 VAL 16 5.921 -5.143 7.820
117 H GLY 17 H GLY 17 3.637 -7.205 9.369
118 HA2 GLY 17 HA2 GLY 17 4.751 -8.856 10.588
119 HA3 GLY 17 HA3 GLY 17 6.016 -7.664 10.904
120 H ASN 18 H ASN 18 2.624 -7.823 11.963
121 HA ASN 18 HA ASN 18 3.225 -8.215 14.785
122 HB2 ASN 18 HB2 ASN 18 3.826 -5.797 14.411
123 HB3 ASN 18 HB3 ASN 18 2.199 -5.509 13.792
124 HD21 ASN 18 HD21 ASN 18 1.518 -4.048 15.373
125 HD22 ASN 18 HD22 ASN 18 1.327 -4.522 17.050
126 H THR 19 H THR 19 1.184 -8.364 16.093
127 HA THR 19 HA THR 19 -0.997 -9.459 14.517
128 HB THR 19 HB THR 19 -2.168 -9.834 16.613
129 HG1 THR 19 HG1 THR 19 -1.069 -9.488 18.539
130 HG21 THR 19 HG21 THR 19 -0.400 -11.409 15.690
131 HG22 THR 19 HG22 THR 19 -0.712 -11.554 17.419
132 HG23 THR 19 HG23 THR 19 0.743 -10.701 16.851
133 H GLU 20 H GLU 20 -2.858 -8.669 13.940
134 HA GLU 20 HA GLU 20 -3.331 -5.845 13.920
135 HB2 GLU 20 HB2 GLU 20 -5.472 -6.514 12.799
136 HB3 GLU 20 HB3 GLU 20 -4.009 -7.064 12.022
137 HG2 GLU 20 HG2 GLU 20 -5.452 -8.925 13.937
138 HG3 GLU 20 HG3 GLU 20 -6.108 -8.626 12.337
139 HA PRO 21 HA PRO 21 -5.569 -4.849 17.435
140 HB2 PRO 21 HB2 PRO 21 -7.887 -3.925 15.726
141 HB3 PRO 21 HB3 PRO 21 -7.110 -3.078 17.108
142 HG2 PRO 21 HG2 PRO 21 -6.453 -2.370 14.596
143 HG3 PRO 21 HG3 PRO 21 -5.137 -2.636 15.786
144 HD2 PRO 21 HD2 PRO 21 -6.186 -4.539 13.675
145 HD3 PRO 21 HD3 PRO 21 -4.495 -4.109 14.062
146 H GLY 22 H GLY 22 -7.421 -5.179 18.882
147 HA2 GLY 22 HA2 GLY 22 -8.654 -7.776 18.785
148 HA3 GLY 22 HA3 GLY 22 -9.100 -6.455 19.868
149 H GLN 23 H GLN 23 -10.359 -8.442 17.642
150 HA GLN 23 HA GLN 23 -11.910 -8.492 16.001
151 HB2 GLN 23 HB2 GLN 23 -13.238 -6.359 17.682
152 HB3 GLN 23 HB3 GLN 23 -14.016 -7.237 16.368
153 HG2 GLN 23 HG2 GLN 23 -12.862 -8.527 18.884
154 HG3 GLN 23 HG3 GLN 23 -14.554 -8.143 18.630
155 HE21 GLN 23 HE21 GLN 23 -13.612 -10.791 19.231
156 HE22 GLN 23 HE22 GLN 23 -14.012 -11.764 17.816
157 HA PRO 24 HA PRO 24 -9.941 -4.925 13.843
158 HB2 PRO 24 HB2 PRO 24 -8.465 -6.208 11.990
159 HB3 PRO 24 HB3 PRO 24 -8.006 -6.154 13.717
160 HG2 PRO 24 HG2 PRO 24 -9.399 -8.403 12.239
161 HG3 PRO 24 HG3 PRO 24 -8.037 -8.498 13.397
162 HD2 PRO 24 HD2 PRO 24 -10.666 -8.920 14.087
163 HD3 PRO 24 HD3 PRO 24 -9.435 -8.322 15.225
164 H GLY 25 H GLY 25 -11.741 -3.995 13.011
165 HA2 GLY 25 HA2 GLY 25 -13.281 -5.010 10.745
166 HA3 GLY 25 HA3 GLY 25 -13.269 -3.355 11.377
167 H ILE 26 H ILE 26 -10.388 -2.997 11.183
168 HA ILE 26 HA ILE 26 -9.514 -3.610 8.476
169 HB ILE 26 HB ILE 26 -8.584 -1.383 8.138
170 HG12 ILE 26 HG12 ILE 26 -8.721 -0.258 10.246
171 HG13 ILE 26 HG13 ILE 26 -9.649 0.566 9.014
172 HG21 ILE 26 HG21 ILE 26 -10.525 -0.468 7.057
173 HG22 ILE 26 HG22 ILE 26 -10.522 -2.228 6.886
174 HG23 ILE 26 HG23 ILE 26 -11.611 -1.452 8.047
175 HD11 ILE 26 HD11 ILE 26 -10.711 -0.939 11.400
176 HD12 ILE 26 HD12 ILE 26 -10.853 0.780 11.034
177 HD13 ILE 26 HD13 ILE 26 -11.755 -0.396 10.060
178 H GLY 27 H GLY 27 -7.559 -4.351 8.600
179 HA2 GLY 27 HA2 GLY 27 -5.391 -3.094 9.998
180 HA3 GLY 27 HA3 GLY 27 -5.878 -4.539 10.864
181 HA PRO 28 HA PRO 28 -4.651 -6.990 7.123
182 HB2 PRO 28 HB2 PRO 28 -4.052 -5.816 4.628
183 HB3 PRO 28 HB3 PRO 28 -5.570 -6.613 5.139
184 HG2 PRO 28 HG2 PRO 28 -4.897 -3.677 5.133
185 HG3 PRO 28 HG3 PRO 28 -6.436 -4.483 4.697
186 HD2 PRO 28 HD2 PRO 28 -6.128 -3.286 7.085
187 HD3 PRO 28 HD3 PRO 28 -6.986 -4.847 6.949
188 H ASP 29 H ASP 29 -2.816 -7.887 6.243
189 HA ASP 29 HA ASP 29 -0.455 -6.900 7.616
190 HB2 ASP 29 HB2 ASP 29 -1.478 -9.551 6.697
191 HB3 ASP 29 HB3 ASP 29 0.260 -9.365 6.885
192 H LEU 30 H LEU 30 1.394 -6.323 6.897
193 HA LEU 30 HA LEU 30 1.792 -5.821 3.992
194 HB2 LEU 30 HB2 LEU 30 2.853 -4.629 6.558
195 HB3 LEU 30 HB3 LEU 30 3.310 -3.991 5.002
196 HG LEU 30 HG LEU 30 0.569 -4.006 6.289
197 HD11 LEU 30 HD11 LEU 30 0.873 -1.510 6.204
198 HD12 LEU 30 HD12 LEU 30 2.531 -1.766 5.627
199 HD13 LEU 30 HD13 LEU 30 2.046 -2.335 7.240
200 HD21 LEU 30 HD21 LEU 30 0.242 -4.201 3.861
201 HD22 LEU 30 HD22 LEU 30 1.510 -2.999 3.541
202 HD23 LEU 30 HD23 LEU 30 -0.026 -2.503 4.265
203 H LEU 31 H LEU 31 3.394 -7.540 6.612
204 HA LEU 31 HA LEU 31 6.092 -7.140 5.920
205 HB2 LEU 31 HB2 LEU 31 5.183 -8.106 7.973
206 HB3 LEU 31 HB3 LEU 31 4.793 -9.590 7.113
207 HG LEU 31 HG LEU 31 6.673 -9.798 8.624
208 HD11 LEU 31 HD11 LEU 31 8.223 -10.958 7.255
209 HD12 LEU 31 HD12 LEU 31 7.739 -10.087 5.797
210 HD13 LEU 31 HD13 LEU 31 6.613 -11.222 6.581
211 HD21 LEU 31 HD21 LEU 31 8.115 -7.801 6.857
212 HD22 LEU 31 HD22 LEU 31 8.797 -8.689 8.234
213 HD23 LEU 31 HD23 LEU 31 7.498 -7.509 8.498
214 H GLY 32 H GLY 32 7.310 -7.805 4.448
215 HA2 GLY 32 HA2 GLY 32 8.102 -8.631 2.405
216 HA3 GLY 32 HA3 GLY 32 7.290 -10.125 2.837
217 H VAL 33 H VAL 33 4.933 -7.593 2.414
218 HA VAL 33 HA VAL 33 3.749 -9.171 0.443
219 HB VAL 33 HB VAL 33 2.646 -7.581 2.027
220 HG11 VAL 33 HG11 VAL 33 3.039 -5.503 -0.172
221 HG12 VAL 33 HG12 VAL 33 2.148 -5.324 1.352
222 HG13 VAL 33 HG13 VAL 33 3.903 -5.506 1.384
223 HG21 VAL 33 HG21 VAL 33 1.622 -7.442 -0.827
224 HG22 VAL 33 HG22 VAL 33 1.446 -8.839 0.262
225 HG23 VAL 33 HG23 VAL 33 0.691 -7.302 0.682
226 H THR 34 H THR 34 5.964 -6.533 -0.173
227 HA THR 34 HA THR 34 5.470 -6.165 -2.984
228 HB THR 34 HB THR 34 6.814 -4.670 -1.471
229 HG1 THR 34 HG1 THR 34 8.533 -5.067 -3.539
230 HG21 THR 34 HG21 THR 34 8.309 -6.351 -0.423
231 HG22 THR 34 HG22 THR 34 9.178 -5.021 -1.203
232 HG23 THR 34 HG23 THR 34 9.102 -6.607 -1.994
233 H ARG 35 H ARG 35 6.901 -8.822 -1.298
234 HA ARG 35 HA ARG 35 8.244 -9.931 -3.655
235 HB2 ARG 35 HB2 ARG 35 9.181 -9.948 -1.296
236 HB3 ARG 35 HB3 ARG 35 7.951 -11.141 -0.885
237 HG2 ARG 35 HG2 ARG 35 10.151 -12.133 -1.306
238 HG3 ARG 35 HG3 ARG 35 8.944 -12.763 -2.418
239 HD2 ARG 35 HD2 ARG 35 9.794 -11.360 -4.228
240 HD3 ARG 35 HD3 ARG 35 10.887 -10.519 -3.122
241 HE ARG 35 HE ARG 35 11.123 -13.292 -4.162
242 HH11 ARG 35 HH11 ARG 35 12.609 -10.706 -2.190
243 HH12 ARG 35 HH12 ARG 35 14.166 -11.503 -2.152
244 HH21 ARG 35 HH21 ARG 35 13.144 -14.286 -4.053
245 HH22 ARG 35 HH22 ARG 35 14.463 -13.527 -3.188
246 H GLN 36 H GLN 36 5.122 -9.888 -2.562
247 HA GLN 36 HA GLN 36 4.412 -12.551 -3.743
248 HB2 GLN 36 HB2 GLN 36 3.172 -11.101 -1.365
249 HB3 GLN 36 HB3 GLN 36 2.594 -12.623 -2.040
250 HG2 GLN 36 HG2 GLN 36 5.332 -12.181 -0.755
251 HG3 GLN 36 HG3 GLN 36 3.964 -12.971 -0.003
252 HE21 GLN 36 HE21 GLN 36 6.428 -14.348 -0.212
253 HE22 GLN 36 HE22 GLN 36 6.264 -15.571 -1.468
254 H ARG 37 H ARG 37 3.251 -9.185 -3.410
255 HA ARG 37 HA ARG 37 0.962 -9.770 -5.188
256 HB2 ARG 37 HB2 ARG 37 0.862 -8.526 -2.960
257 HB3 ARG 37 HB3 ARG 37 1.672 -7.189 -3.763
258 HG2 ARG 37 HG2 ARG 37 -0.672 -6.712 -3.652
259 HG3 ARG 37 HG3 ARG 37 -0.289 -7.015 -5.331
260 HD2 ARG 37 HD2 ARG 37 -2.322 -8.112 -5.001
261 HD3 ARG 37 HD3 ARG 37 -1.141 -9.426 -4.943
262 HE ARG 37 HE ARG 37 -1.783 -8.230 -2.349
263 HH11 ARG 37 HH11 ARG 37 -2.742 -10.769 -4.664
264 HH12 ARG 37 HH12 ARG 37 -3.681 -11.643 -3.472
265 HH21 ARG 37 HH21 ARG 37 -3.013 -9.392 -0.845
266 HH22 ARG 37 HH22 ARG 37 -3.819 -10.872 -1.310
267 H ASP 38 H ASP 38 3.942 -9.408 -6.052
268 HA ASP 38 HA ASP 38 5.290 -8.547 -7.516
269 HB2 ASP 38 HB2 ASP 38 2.760 -7.992 -9.071
270 HB3 ASP 38 HB3 ASP 38 4.391 -7.680 -9.624
271 H ALA 39 H ALA 39 6.594 -6.900 -7.692
272 HA ALA 39 HA ALA 39 6.115 -4.763 -5.926
273 HB1 ALA 39 HB1 ALA 39 8.391 -4.078 -6.542
274 HB2 ALA 39 HB2 ALA 39 8.290 -5.832 -6.289
275 HB3 ALA 39 HB3 ALA 39 8.362 -5.173 -7.941
276 H ASN 40 H ASN 40 6.453 -4.526 -9.576
277 HA ASN 40 HA ASN 40 6.181 -1.668 -9.420
278 HB2 ASN 40 HB2 ASN 40 7.273 -2.919 -11.319
279 HB3 ASN 40 HB3 ASN 40 5.655 -3.370 -11.889
280 HD21 ASN 40 HD21 ASN 40 7.572 -0.495 -10.890
281 HD22 ASN 40 HD22 ASN 40 6.773 0.611 -12.014
282 H TRP 41 H TRP 41 3.717 -4.218 -9.977
283 HA TRP 41 HA TRP 41 1.494 -2.450 -10.286
284 HB2 TRP 41 HB2 TRP 41 1.402 -4.890 -10.733
285 HB3 TRP 41 HB3 TRP 41 1.593 -5.214 -9.014
286 HD1 TRP 41 HD1 TRP 41 -0.943 -3.967 -11.564
287 HE1 TRP 41 HE1 TRP 41 -3.269 -3.720 -10.523
288 HE3 TRP 41 HE3 TRP 41 0.297 -4.950 -6.699
289 HZ2 TRP 41 HZ2 TRP 41 -4.397 -3.781 -7.841
290 HZ3 TRP 41 HZ3 TRP 41 -1.415 -4.720 -4.901
291 HH2 TRP 41 HH2 TRP 41 -3.751 -4.128 -5.463
292 H LEU 42 H LEU 42 2.888 -3.905 -7.294
293 HA LEU 42 HA LEU 42 1.050 -2.789 -5.471
294 HB2 LEU 42 HB2 LEU 42 2.671 -4.669 -5.170
295 HB3 LEU 42 HB3 LEU 42 3.994 -3.525 -5.084
296 HG LEU 42 HG LEU 42 3.348 -4.509 -2.953
297 HD11 LEU 42 HD11 LEU 42 2.686 -1.554 -2.834
298 HD12 LEU 42 HD12 LEU 42 4.330 -2.214 -2.979
299 HD13 LEU 42 HD13 LEU 42 3.347 -2.586 -1.553
300 HD21 LEU 42 HD21 LEU 42 0.913 -4.737 -3.460
301 HD22 LEU 42 HD22 LEU 42 0.723 -2.999 -3.146
302 HD23 LEU 42 HD23 LEU 42 1.278 -4.099 -1.853
303 H VAL 43 H VAL 43 4.180 -1.476 -6.590
304 HA VAL 43 HA VAL 43 4.011 0.927 -4.990
305 HB VAL 43 HB VAL 43 5.841 0.226 -7.316
306 HG11 VAL 43 HG11 VAL 43 5.885 2.655 -6.962
307 HG12 VAL 43 HG12 VAL 43 6.063 2.431 -5.211
308 HG13 VAL 43 HG13 VAL 43 7.362 1.948 -6.327
309 HG21 VAL 43 HG21 VAL 43 7.489 -0.255 -5.519
310 HG22 VAL 43 HG22 VAL 43 6.247 0.088 -4.291
311 HG23 VAL 43 HG23 VAL 43 6.086 -1.305 -5.348
312 H ARG 44 H ARG 44 2.917 0.173 -8.283
313 HA ARG 44 HA ARG 44 2.140 2.925 -8.895
314 HB2 ARG 44 HB2 ARG 44 1.446 0.231 -10.096
315 HB3 ARG 44 HB3 ARG 44 0.646 1.721 -10.608
316 HG2 ARG 44 HG2 ARG 44 2.753 2.746 -11.250
317 HG3 ARG 44 HG3 ARG 44 3.668 1.339 -10.679
318 HD2 ARG 44 HD2 ARG 44 2.564 -0.095 -12.335
319 HD3 ARG 44 HD3 ARG 44 1.544 1.245 -12.867
320 HE ARG 44 HE ARG 44 4.481 0.946 -13.282
321 HH11 ARG 44 HH11 ARG 44 1.484 2.688 -14.150
322 HH12 ARG 44 HH12 ARG 44 2.231 3.474 -15.523
323 HH21 ARG 44 HH21 ARG 44 5.394 2.000 -15.044
324 HH22 ARG 44 HH22 ARG 44 4.430 3.071 -16.038
325 H TRP 45 H TRP 45 0.476 0.137 -7.450
326 HA TRP 45 HA TRP 45 -2.162 1.199 -7.396
327 HB2 TRP 45 HB2 TRP 45 -1.799 -1.151 -7.197
328 HB3 TRP 45 HB3 TRP 45 -0.706 -0.955 -5.840
329 HD1 TRP 45 HD1 TRP 45 -1.680 -1.677 -3.662
330 HE1 TRP 45 HE1 TRP 45 -4.071 -1.989 -2.649
331 HE3 TRP 45 HE3 TRP 45 -4.477 0.389 -7.413
332 HZ2 TRP 45 HZ2 TRP 45 -6.725 -1.289 -3.302
333 HZ3 TRP 45 HZ3 TRP 45 -6.948 0.581 -7.177
334 HH2 TRP 45 HH2 TRP 45 -8.081 -0.247 -5.135
335 H LEU 46 H LEU 46 0.210 1.032 -4.694
336 HA LEU 46 HA LEU 46 -1.595 2.187 -2.861
337 HB2 LEU 46 HB2 LEU 46 -0.074 1.698 -1.296
338 HB3 LEU 46 HB3 LEU 46 0.601 0.730 -2.602
339 HG LEU 46 HG LEU 46 1.643 3.393 -1.551
340 HD11 LEU 46 HD11 LEU 46 2.845 0.603 -1.704
341 HD12 LEU 46 HD12 LEU 46 2.145 1.339 -0.245
342 HD13 LEU 46 HD13 LEU 46 3.592 2.042 -0.974
343 HD21 LEU 46 HD21 LEU 46 3.581 2.834 -3.195
344 HD22 LEU 46 HD22 LEU 46 2.135 3.559 -3.881
345 HD23 LEU 46 HD23 LEU 46 2.380 1.815 -4.020
346 H LYS 47 H LYS 47 -0.185 3.847 -5.277
347 HA LYS 47 HA LYS 47 0.244 6.430 -3.916
348 HB2 LYS 47 HB2 LYS 47 1.789 5.374 -5.639
349 HB3 LYS 47 HB3 LYS 47 0.540 5.644 -6.853
350 HG2 LYS 47 HG2 LYS 47 0.738 8.079 -6.554
351 HG3 LYS 47 HG3 LYS 47 1.799 7.842 -5.161
352 HD2 LYS 47 HD2 LYS 47 3.224 8.415 -6.979
353 HD3 LYS 47 HD3 LYS 47 3.458 6.689 -6.693
354 HE2 LYS 47 HE2 LYS 47 1.790 6.261 -8.591
355 HE3 LYS 47 HE3 LYS 47 1.821 8.001 -8.906
356 HZ1 LYS 47 HZ1 LYS 47 3.405 6.893 -10.327
357 HZ2 LYS 47 HZ2 LYS 47 4.102 6.116 -9.068
358 HZ3 LYS 47 HZ3 LYS 47 4.288 7.742 -9.198
359 H VAL 48 H VAL 48 -2.215 4.842 -5.844
360 HA VAL 48 HA VAL 48 -3.969 7.222 -5.910
361 HB VAL 48 HB VAL 48 -4.191 7.066 -8.400
362 HG11 VAL 48 HG11 VAL 48 -2.866 8.830 -7.310
363 HG12 VAL 48 HG12 VAL 48 -1.398 7.884 -7.669
364 HG13 VAL 48 HG13 VAL 48 -2.437 8.463 -8.986
365 HG21 VAL 48 HG21 VAL 48 -1.562 5.533 -8.371
366 HG22 VAL 48 HG22 VAL 48 -3.141 4.784 -8.684
367 HG23 VAL 48 HG23 VAL 48 -2.538 6.025 -9.772
368 HA PRO 49 HA PRO 49 -5.673 2.746 -5.962
369 HB2 PRO 49 HB2 PRO 49 -7.228 2.781 -3.656
370 HB3 PRO 49 HB3 PRO 49 -5.514 2.287 -3.745
371 HG2 PRO 49 HG2 PRO 49 -6.618 5.031 -3.032
372 HG3 PRO 49 HG3 PRO 49 -5.398 4.064 -2.138
373 HD2 PRO 49 HD2 PRO 49 -4.607 6.003 -3.815
374 HD3 PRO 49 HD3 PRO 49 -3.766 4.424 -3.847
375 H ASP 50 H ASP 50 -7.628 5.681 -5.134
376 HA ASP 50 HA ASP 50 -10.133 4.549 -6.108
377 HB2 ASP 50 HB2 ASP 50 -10.185 6.318 -4.467
378 HB3 ASP 50 HB3 ASP 50 -9.216 7.377 -5.484
379 H GLN 51 H GLN 51 -7.498 6.427 -7.575
380 HA GLN 51 HA GLN 51 -8.958 6.964 -10.045
381 HB2 GLN 51 HB2 GLN 51 -7.273 8.453 -8.969
382 HB3 GLN 51 HB3 GLN 51 -6.037 7.245 -9.328
383 HG2 GLN 51 HG2 GLN 51 -6.468 7.526 -11.740
384 HG3 GLN 51 HG3 GLN 51 -7.688 8.751 -11.387
385 HE21 GLN 51 HE21 GLN 51 -5.482 9.286 -13.020
386 HE22 GLN 51 HE22 GLN 51 -4.312 10.302 -12.172
387 H MET 52 H MET 52 -6.611 4.520 -8.902
388 HA MET 52 HA MET 52 -6.241 3.264 -11.470
389 HB2 MET 52 HB2 MET 52 -4.712 2.997 -9.474
390 HB3 MET 52 HB3 MET 52 -5.976 2.048 -8.684
391 HG2 MET 52 HG2 MET 52 -4.517 0.449 -9.615
392 HG3 MET 52 HG3 MET 52 -5.907 0.483 -10.675
393 HE1 MET 52 HE1 MET 52 -2.334 2.068 -10.124
394 HE2 MET 52 HE2 MET 52 -2.187 0.320 -10.456
395 HE3 MET 52 HE3 MET 52 -1.553 1.503 -11.621
396 H LEU 53 H LEU 53 -8.580 2.634 -8.758
397 HA LEU 53 HA LEU 53 -9.989 0.535 -10.169
398 HB2 LEU 53 HB2 LEU 53 -10.840 2.492 -8.002
399 HB3 LEU 53 HB3 LEU 53 -11.915 1.257 -8.646
400 HG LEU 53 HG LEU 53 -9.266 0.657 -7.276
401 HD11 LEU 53 HD11 LEU 53 -10.927 1.625 -5.732
402 HD12 LEU 53 HD12 LEU 53 -10.653 -0.089 -5.389
403 HD13 LEU 53 HD13 LEU 53 -12.122 0.413 -6.248
404 HD21 LEU 53 HD21 LEU 53 -11.534 -1.193 -8.151
405 HD22 LEU 53 HD22 LEU 53 -10.160 -1.667 -7.133
406 HD23 LEU 53 HD23 LEU 53 -9.879 -1.169 -8.799
407 H ALA 54 H ALA 54 -10.317 4.113 -10.291
408 HA ALA 54 HA ALA 54 -12.549 4.068 -12.089
409 HB1 ALA 54 HB1 ALA 54 -10.469 6.238 -11.619
410 HB2 ALA 54 HB2 ALA 54 -12.034 6.443 -12.424
411 HB3 ALA 54 HB3 ALA 54 -11.974 6.012 -10.710
412 H GLU 55 H GLU 55 -9.131 3.527 -12.764
413 HA GLU 55 HA GLU 55 -9.616 3.754 -15.677
414 HB2 GLU 55 HB2 GLU 55 -7.394 3.730 -16.054
415 HB3 GLU 55 HB3 GLU 55 -7.464 4.595 -14.546
416 HG2 GLU 55 HG2 GLU 55 -6.528 2.726 -13.375
417 HG3 GLU 55 HG3 GLU 55 -6.813 1.616 -14.707
418 H LYS 56 H LYS 56 -10.245 1.474 -13.427
419 HA LYS 56 HA LYS 56 -10.719 -0.717 -13.369
420 HB2 LYS 56 HB2 LYS 56 -11.097 -0.537 -16.372
421 HB3 LYS 56 HB3 LYS 56 -11.804 -1.715 -15.259
422 HG2 LYS 56 HG2 LYS 56 -12.998 0.175 -14.087
423 HG3 LYS 56 HG3 LYS 56 -12.366 1.286 -15.316
424 HD2 LYS 56 HD2 LYS 56 -13.485 -0.135 -17.081
425 HD3 LYS 56 HD3 LYS 56 -14.252 -1.052 -15.765
426 HE2 LYS 56 HE2 LYS 56 -15.288 1.035 -14.910
427 HE3 LYS 56 HE3 LYS 56 -14.475 1.966 -16.178
428 HZ1 LYS 56 HZ1 LYS 56 -15.724 0.712 -17.829
429 HZ2 LYS 56 HZ2 LYS 56 -16.743 1.477 -16.780
430 HZ3 LYS 56 HZ3 LYS 56 -16.508 -0.141 -16.639
431 H ASP 57 H ASP 57 -8.579 -1.007 -12.654
432 HA ASP 57 HA ASP 57 -6.630 -2.389 -14.413
433 HB2 ASP 57 HB2 ASP 57 -5.853 -0.535 -12.916
434 HB3 ASP 57 HB3 ASP 57 -6.305 -1.535 -11.520
435 HA PRO 58 HA PRO 58 -9.351 -5.508 -13.313
436 HB2 PRO 58 HB2 PRO 58 -8.356 -7.626 -14.678
437 HB3 PRO 58 HB3 PRO 58 -8.918 -6.083 -15.430
438 HG2 PRO 58 HG2 PRO 58 -6.023 -6.643 -14.674
439 HG3 PRO 58 HG3 PRO 58 -6.676 -6.410 -16.339
440 HD2 PRO 58 HD2 PRO 58 -5.790 -4.341 -14.916
441 HD3 PRO 58 HD3 PRO 58 -7.382 -4.181 -15.729
442 H LEU 59 H LEU 59 -6.074 -5.865 -12.366
443 HA LEU 59 HA LEU 59 -6.469 -8.122 -10.540
444 HB2 LEU 59 HB2 LEU 59 -4.300 -7.328 -11.729
445 HB3 LEU 59 HB3 LEU 59 -4.206 -6.090 -10.497
446 HG LEU 59 HG LEU 59 -2.739 -7.970 -10.067
447 HD11 LEU 59 HD11 LEU 59 -3.216 -8.464 -7.782
448 HD12 LEU 59 HD12 LEU 59 -4.935 -8.105 -7.982
449 HD13 LEU 59 HD13 LEU 59 -3.731 -6.799 -8.096
450 HD21 LEU 59 HD21 LEU 59 -3.492 -10.206 -9.562
451 HD22 LEU 59 HD22 LEU 59 -4.068 -9.751 -11.171
452 HD23 LEU 59 HD23 LEU 59 -5.188 -9.755 -9.786
453 H ALA 60 H ALA 60 -6.321 -4.502 -10.113
454 HA ALA 60 HA ALA 60 -6.590 -4.553 -7.276
455 HB1 ALA 60 HB1 ALA 60 -7.645 -2.446 -9.199
456 HB2 ALA 60 HB2 ALA 60 -7.324 -2.280 -7.459
457 HB3 ALA 60 HB3 ALA 60 -5.974 -2.510 -8.592
458 H MET 61 H MET 61 -9.053 -4.682 -9.805
459 HA MET 61 HA MET 61 -11.350 -4.162 -8.280
460 HB2 MET 61 HB2 MET 61 -11.493 -6.273 -10.412
461 HB3 MET 61 HB3 MET 61 -12.637 -4.997 -10.006
462 HG2 MET 61 HG2 MET 61 -10.007 -4.700 -11.456
463 HG3 MET 61 HG3 MET 61 -11.588 -4.668 -12.195
464 HE1 MET 61 HE1 MET 61 -13.424 -2.800 -10.687
465 HE2 MET 61 HE2 MET 61 -13.033 -1.226 -11.408
466 HE3 MET 61 HE3 MET 61 -13.091 -2.685 -12.430
467 H LEU 62 H LEU 62 -9.365 -7.077 -8.295
468 HA LEU 62 HA LEU 62 -11.313 -8.806 -7.010
469 HB2 LEU 62 HB2 LEU 62 -8.325 -8.902 -7.463
470 HB3 LEU 62 HB3 LEU 62 -9.054 -9.944 -6.272
471 HG LEU 62 HG LEU 62 -10.522 -10.980 -7.940
472 HD11 LEU 62 HD11 LEU 62 -10.740 -9.186 -9.599
473 HD12 LEU 62 HD12 LEU 62 -10.085 -10.641 -10.347
474 HD13 LEU 62 HD13 LEU 62 -8.996 -9.285 -9.952
475 HD21 LEU 62 HD21 LEU 62 -8.752 -12.247 -9.079
476 HD22 LEU 62 HD22 LEU 62 -8.301 -11.922 -7.405
477 HD23 LEU 62 HD23 LEU 62 -7.572 -10.967 -8.713
478 H LEU 63 H LEU 63 -8.604 -6.684 -5.789
479 HA LEU 63 HA LEU 63 -8.797 -8.056 -3.193
480 HB2 LEU 63 HB2 LEU 63 -7.382 -5.400 -3.643
481 HB3 LEU 63 HB3 LEU 63 -7.206 -6.524 -2.323
482 HG LEU 63 HG LEU 63 -5.263 -6.855 -3.435
483 HD11 LEU 63 HD11 LEU 63 -6.363 -9.054 -3.160
484 HD12 LEU 63 HD12 LEU 63 -5.260 -9.011 -4.549
485 HD13 LEU 63 HD13 LEU 63 -7.005 -8.932 -4.816
486 HD21 LEU 63 HD21 LEU 63 -6.720 -6.740 -6.080
487 HD22 LEU 63 HD22 LEU 63 -4.963 -6.891 -5.836
488 HD23 LEU 63 HD23 LEU 63 -5.807 -5.419 -5.326
489 H PHE 64 H PHE 64 -9.849 -5.026 -4.554
490 HA PHE 64 HA PHE 64 -10.678 -3.890 -2.044
491 HB2 PHE 64 HB2 PHE 64 -10.863 -2.028 -3.177
492 HB3 PHE 64 HB3 PHE 64 -10.316 -2.888 -4.596
493 HD1 PHE 64 HD2 PHE 64 -12.049 -3.795 -6.228
494 HD2 PHE 64 HD1 PHE 64 -13.087 -1.188 -2.969
495 HE1 PHE 64 HE2 PHE 64 -14.196 -3.233 -7.361
496 HE2 PHE 64 HE1 PHE 64 -15.204 -0.590 -4.108
497 HZ PHE 64 HZ PHE 64 -15.778 -1.636 -6.300
498 H GLU 65 H GLU 65 -12.538 -5.939 -4.313
499 HA GLU 65 HA GLU 65 -14.879 -5.658 -2.535
500 HB2 GLU 65 HB2 GLU 65 -16.183 -6.806 -3.935
501 HB3 GLU 65 HB3 GLU 65 -15.173 -5.855 -5.017
502 HG2 GLU 65 HG2 GLU 65 -13.837 -7.858 -5.544
503 HG3 GLU 65 HG3 GLU 65 -14.754 -8.815 -4.377
504 H GLN 66 H GLN 66 -12.210 -7.961 -2.898
505 HA GLN 66 HA GLN 66 -13.466 -10.048 -1.361
506 HB2 GLN 66 HB2 GLN 66 -11.586 -10.454 -2.900
507 HB3 GLN 66 HB3 GLN 66 -10.535 -9.448 -1.905
508 HG2 GLN 66 HG2 GLN 66 -10.039 -11.770 -1.496
509 HG3 GLN 66 HG3 GLN 66 -10.723 -11.075 -0.040
510 HE21 GLN 66 HE21 GLN 66 -10.847 -13.591 0.277
511 HE22 GLN 66 HE22 GLN 66 -12.440 -14.254 -0.128
512 H TYR 67 H TYR 67 -11.336 -7.316 -0.428
513 HA TYR 67 HA TYR 67 -11.646 -7.967 2.430
514 HB2 TYR 67 HB2 TYR 67 -10.097 -5.810 0.984
515 HB3 TYR 67 HB3 TYR 67 -10.205 -5.947 2.735
516 HD1 TYR 67 HD1 TYR 67 -9.459 -8.111 3.878
517 HD2 TYR 67 HD2 TYR 67 -8.439 -7.143 -0.190
518 HE1 TYR 67 HE1 TYR 67 -7.623 -9.779 3.945
519 HE2 TYR 67 HE2 TYR 67 -6.607 -8.826 -0.132
520 HH TYR 67 HH TYR 67 -5.984 -10.843 2.786
521 H ASN 68 H ASN 68 -14.032 -7.854 1.748
522 HA ASN 68 HA ASN 68 -16.083 -7.018 2.135
523 HB2 ASN 68 HB2 ASN 68 -14.898 -7.186 4.356
524 HB3 ASN 68 HB3 ASN 68 -14.712 -5.437 4.323
525 HD21 ASN 68 HD21 ASN 68 -15.875 -6.346 6.431
526 HD22 ASN 68 HD22 ASN 68 -17.605 -5.998 6.423
527 H ARG 69 H ARG 69 -15.115 -5.727 -0.019
528 HA ARG 69 HA ARG 69 -15.465 -4.027 -1.441
529 HB2 ARG 69 HB2 ARG 69 -17.923 -4.519 -0.049
530 HB3 ARG 69 HB3 ARG 69 -17.897 -2.836 -0.529
531 HG2 ARG 69 HG2 ARG 69 -17.238 -5.140 -2.407
532 HG3 ARG 69 HG3 ARG 69 -18.863 -4.496 -2.216
533 HD2 ARG 69 HD2 ARG 69 -16.616 -2.594 -2.945
534 HD3 ARG 69 HD3 ARG 69 -17.281 -3.671 -4.169
535 HE ARG 69 HE ARG 69 -19.465 -2.723 -3.877
536 HH11 ARG 69 HH11 ARG 69 -16.870 -0.713 -2.450
537 HH12 ARG 69 HH12 ARG 69 -17.838 0.741 -2.548
538 HH21 ARG 69 HH21 ARG 69 -20.646 -0.825 -3.955
539 HH22 ARG 69 HH22 ARG 69 -19.960 0.676 -3.371
540 H LEU 70 H LEU 70 -13.854 -3.194 0.997
541 HA LEU 70 HA LEU 70 -14.483 -0.319 1.151
542 HB2 LEU 70 HB2 LEU 70 -13.901 -1.569 3.170
543 HB3 LEU 70 HB3 LEU 70 -12.342 -2.016 2.478
544 HG LEU 70 HG LEU 70 -11.610 0.336 2.496
545 HD11 LEU 70 HD11 LEU 70 -12.976 2.058 3.679
546 HD12 LEU 70 HD12 LEU 70 -14.345 0.926 3.712
547 HD13 LEU 70 HD13 LEU 70 -13.715 1.547 2.165
548 HD21 LEU 70 HD21 LEU 70 -12.817 -0.557 5.144
549 HD22 LEU 70 HD22 LEU 70 -11.518 0.637 4.938
550 HD23 LEU 70 HD23 LEU 70 -11.250 -1.060 4.488
551 H ALA 71 H ALA 71 -13.924 0.874 -0.634
552 HA ALA 71 HA ALA 71 -11.387 0.425 -2.028
553 HB1 ALA 71 HB1 ALA 71 -13.351 1.323 -3.225
554 HB2 ALA 71 HB2 ALA 71 -13.296 2.777 -2.200
555 HB3 ALA 71 HB3 ALA 71 -11.955 2.416 -3.296
556 H MET 72 H MET 72 -9.553 0.791 -0.963
557 HA MET 72 HA MET 72 -9.178 2.373 1.318
558 HB2 MET 72 HB2 MET 72 -7.645 0.616 0.729
559 HB3 MET 72 HB3 MET 72 -7.233 1.400 -0.805
560 HG2 MET 72 HG2 MET 72 -6.116 3.226 0.357
561 HG3 MET 72 HG3 MET 72 -6.687 2.628 1.918
562 HE1 MET 72 HE1 MET 72 -3.353 0.630 -0.625
563 HE2 MET 72 HE2 MET 72 -5.054 0.546 -1.122
564 HE3 MET 72 HE3 MET 72 -4.217 2.117 -1.075
565 HA PRO 73 HA PRO 73 -9.077 6.415 -0.656
566 HB2 PRO 73 HB2 PRO 73 -8.552 8.023 1.491
567 HB3 PRO 73 HB3 PRO 73 -10.137 7.225 1.238
568 HG2 PRO 73 HG2 PRO 73 -7.828 6.278 2.973
569 HG3 PRO 73 HG3 PRO 73 -9.561 6.415 3.417
570 HD2 PRO 73 HD2 PRO 73 -8.447 4.060 2.610
571 HD3 PRO 73 HD3 PRO 73 -10.127 4.498 2.167
572 H ASN 74 H ASN 74 -7.533 7.875 -1.425
573 HA ASN 74 HA ASN 74 -4.682 7.206 -1.101
574 HB2 ASN 74 HB2 ASN 74 -5.507 7.993 -3.262
575 HB3 ASN 74 HB3 ASN 74 -6.102 9.487 -2.548
576 HD21 ASN 74 HD21 ASN 74 -4.669 10.346 -4.394
577 HD22 ASN 74 HD22 ASN 74 -2.955 10.501 -4.023
578 H MET 75 H MET 75 -3.752 7.683 0.805
579 HA MET 75 HA MET 75 -4.510 9.969 2.455
580 HB2 MET 75 HB2 MET 75 -2.126 8.103 2.753
581 HB3 MET 75 HB3 MET 75 -2.755 9.211 3.969
582 HG2 MET 75 HG2 MET 75 -4.165 6.764 2.846
583 HG3 MET 75 HG3 MET 75 -3.423 6.910 4.432
584 HE1 MET 75 HE1 MET 75 -5.872 9.172 6.425
585 HE2 MET 75 HE2 MET 75 -4.430 8.134 6.480
586 HE3 MET 75 HE3 MET 75 -4.385 9.687 5.609
587 H ARG 76 H ARG 76 -3.960 10.965 0.028
588 HA ARG 76 HA ARG 76 -2.689 12.158 -1.383
589 HB2 ARG 76 HB2 ARG 76 -1.975 14.314 -0.488
590 HB3 ARG 76 HB3 ARG 76 -3.585 13.823 0.014
591 HG2 ARG 76 HG2 ARG 76 -2.761 13.236 2.263
592 HG3 ARG 76 HG3 ARG 76 -1.106 13.662 1.785
593 HD2 ARG 76 HD2 ARG 76 -1.894 15.996 1.310
594 HD3 ARG 76 HD3 ARG 76 -3.508 15.532 1.865
595 HE ARG 76 HE ARG 76 -2.768 15.405 4.079
596 HH11 ARG 76 HH11 ARG 76 -0.029 16.289 1.958
597 HH12 ARG 76 HH12 ARG 76 0.962 16.815 3.301
598 HH21 ARG 76 HH21 ARG 76 -1.445 16.093 5.769
599 HH22 ARG 76 HH22 ARG 76 0.175 16.675 5.452
600 H LEU 77 H LEU 77 -1.240 10.009 -1.386
601 HA LEU 77 HA LEU 77 1.409 10.331 -0.268
602 HB2 LEU 77 HB2 LEU 77 0.260 8.373 -2.296
603 HB3 LEU 77 HB3 LEU 77 1.944 8.374 -1.826
604 HG LEU 77 HG LEU 77 0.979 6.679 -0.599
605 HD11 LEU 77 HD11 LEU 77 1.368 7.251 1.699
606 HD12 LEU 77 HD12 LEU 77 1.064 8.967 1.408
607 HD13 LEU 77 HD13 LEU 77 2.508 8.197 0.717
608 HD21 LEU 77 HD21 LEU 77 -0.956 6.815 0.837
609 HD22 LEU 77 HD22 LEU 77 -1.387 7.291 -0.814
610 HD23 LEU 77 HD23 LEU 77 -1.173 8.534 0.439
611 H GLY 78 H GLY 78 2.918 11.639 -0.848
612 HA2 GLY 78 HA2 GLY 78 3.300 12.618 -3.593
613 HA3 GLY 78 HA3 GLY 78 4.244 13.030 -2.163
614 H ASP 79 H ASP 79 5.489 12.557 -4.565
615 HA ASP 79 HA ASP 79 6.231 9.907 -5.198
616 HB2 ASP 79 HB2 ASP 79 6.548 11.924 -6.621
617 HB3 ASP 79 HB3 ASP 79 7.852 12.465 -5.558
618 H ALA 80 H ALA 80 7.901 12.173 -2.956
619 HA ALA 80 HA ALA 80 9.981 10.218 -2.295
620 HB1 ALA 80 HB1 ALA 80 10.773 11.987 -0.801
621 HB2 ALA 80 HB2 ALA 80 10.415 12.653 -2.404
622 HB3 ALA 80 HB3 ALA 80 9.280 12.915 -1.062
623 H GLU 81 H GLU 81 6.776 10.882 -1.119
624 HA GLU 81 HA GLU 81 7.188 9.602 1.511
625 HB2 GLU 81 HB2 GLU 81 4.638 10.383 0.044
626 HB3 GLU 81 HB3 GLU 81 4.722 9.701 1.674
627 HG2 GLU 81 HG2 GLU 81 6.214 11.590 2.357
628 HG3 GLU 81 HG3 GLU 81 5.966 12.327 0.756
629 H VAL 82 H VAL 82 5.977 8.688 -1.724
630 HA VAL 82 HA VAL 82 5.497 5.919 -1.089
631 HB VAL 82 HB VAL 82 6.256 7.257 -3.713
632 HG11 VAL 82 HG11 VAL 82 5.332 4.401 -3.191
633 HG12 VAL 82 HG12 VAL 82 5.452 5.161 -4.793
634 HG13 VAL 82 HG13 VAL 82 6.914 4.880 -3.848
635 HG21 VAL 82 HG21 VAL 82 4.033 7.876 -2.811
636 HG22 VAL 82 HG22 VAL 82 3.864 6.846 -4.233
637 HG23 VAL 82 HG23 VAL 82 3.621 6.160 -2.610
638 H SER 83 H SER 83 8.522 7.517 -2.372
639 HA SER 83 HA SER 83 10.091 5.172 -2.280
640 HB2 SER 83 HB2 SER 83 10.803 7.316 -3.313
641 HB3 SER 83 HB3 SER 83 11.038 8.003 -1.692
642 HG SER 83 HG SER 83 12.372 5.789 -2.893
643 H ALA 84 H ALA 84 9.470 7.461 0.410
644 HA ALA 84 HA ALA 84 11.096 6.176 2.362
645 HB1 ALA 84 HB1 ALA 84 8.587 7.872 2.653
646 HB2 ALA 84 HB2 ALA 84 9.769 7.528 3.938
647 HB3 ALA 84 HB3 ALA 84 10.249 8.476 2.526
648 H LEU 85 H LEU 85 7.577 5.758 1.664
649 HA LEU 85 HA LEU 85 7.163 3.678 3.621
650 HB2 LEU 85 HB2 LEU 85 5.682 4.600 1.127
651 HB3 LEU 85 HB3 LEU 85 5.081 3.289 2.134
652 HG LEU 85 HG LEU 85 5.668 6.052 3.295
653 HD11 LEU 85 HD11 LEU 85 3.203 6.404 3.115
654 HD12 LEU 85 HD12 LEU 85 3.098 4.928 2.128
655 HD13 LEU 85 HD13 LEU 85 4.017 6.325 1.545
656 HD21 LEU 85 HD21 LEU 85 5.498 4.248 4.968
657 HD22 LEU 85 HD22 LEU 85 3.955 3.717 4.261
658 HD23 LEU 85 HD23 LEU 85 4.089 5.301 5.051
659 H ILE 86 H ILE 86 8.321 3.576 0.306
660 HA ILE 86 HA ILE 86 8.087 0.687 0.008
661 HB ILE 86 HB ILE 86 9.146 2.957 -1.600
662 HG12 ILE 86 HG12 ILE 86 7.997 1.833 -3.398
663 HG13 ILE 86 HG13 ILE 86 7.856 0.340 -2.468
664 HG21 ILE 86 HG21 ILE 86 11.196 1.652 -1.602
665 HG22 ILE 86 HG22 ILE 86 10.296 0.176 -2.026
666 HG23 ILE 86 HG23 ILE 86 10.395 1.549 -3.161
667 HD11 ILE 86 HD11 ILE 86 5.709 1.587 -2.665
668 HD12 ILE 86 HD12 ILE 86 6.193 1.354 -0.984
669 HD13 ILE 86 HD13 ILE 86 6.418 2.929 -1.767
670 H SER 87 H SER 87 10.736 2.866 1.135
671 HA SER 87 HA SER 87 12.417 0.629 1.753
672 HB2 SER 87 HB2 SER 87 13.322 2.221 3.623
673 HB3 SER 87 HB3 SER 87 13.675 2.481 1.929
674 HG SER 87 HG SER 87 11.460 3.798 3.092
675 H TYR 88 H TYR 88 9.822 2.207 3.686
676 HA TYR 88 HA TYR 88 10.260 0.623 6.006
677 HB2 TYR 88 HB2 TYR 88 8.919 2.722 5.756
678 HB3 TYR 88 HB3 TYR 88 7.620 1.784 5.050
679 HD1 TYR 88 HD2 TYR 88 9.795 2.016 8.110
680 HD2 TYR 88 HD1 TYR 88 5.959 0.912 6.491
681 HE1 TYR 88 HE2 TYR 88 8.934 1.628 10.420
682 HE2 TYR 88 HE1 TYR 88 5.096 0.550 8.791
683 HH TYR 88 HH TYR 88 5.558 0.595 10.993
684 H LEU 89 H LEU 89 8.466 -0.230 3.062
685 HA LEU 89 HA LEU 89 7.659 -2.788 4.277
686 HB2 LEU 89 HB2 LEU 89 7.178 -1.407 1.633
687 HB3 LEU 89 HB3 LEU 89 7.080 -3.164 1.698
688 HG LEU 89 HG LEU 89 5.405 -3.067 3.481
689 HD11 LEU 89 HD11 LEU 89 5.425 -0.056 3.064
690 HD12 LEU 89 HD12 LEU 89 5.863 -0.920 4.553
691 HD13 LEU 89 HD13 LEU 89 4.197 -0.963 3.973
692 HD21 LEU 89 HD21 LEU 89 4.679 -1.391 1.044
693 HD22 LEU 89 HD22 LEU 89 3.547 -2.305 2.071
694 HD23 LEU 89 HD23 LEU 89 4.745 -3.166 1.095
695 H GLU 90 H GLU 90 9.868 -1.923 1.524
696 HA GLU 90 HA GLU 90 10.611 -4.684 1.254
697 HB2 GLU 90 HB2 GLU 90 10.555 -2.910 -0.578
698 HB3 GLU 90 HB3 GLU 90 12.067 -2.276 0.089
699 HG2 GLU 90 HG2 GLU 90 13.048 -4.619 -0.219
700 HG3 GLU 90 HG3 GLU 90 11.570 -5.060 -1.067
701 H GLU 91 H GLU 91 12.534 -1.924 2.741
702 HA GLU 91 HA GLU 91 14.679 -3.966 3.142
703 HB2 GLU 91 HB2 GLU 91 16.156 -2.136 3.775
704 HB3 GLU 91 HB3 GLU 91 15.581 -2.095 2.125
705 HG2 GLU 91 HG2 GLU 91 13.999 -0.328 2.686
706 HG3 GLU 91 HG3 GLU 91 14.524 -0.346 4.375
707 H GLU 92 H GLU 92 12.276 -2.288 5.071
708 HA GLU 92 HA GLU 92 13.580 -3.149 7.557
709 HB2 GLU 92 HB2 GLU 92 10.786 -2.091 7.198
710 HB3 GLU 92 HB3 GLU 92 11.669 -2.257 8.706
711 HG2 GLU 92 HG2 GLU 92 12.364 -0.386 6.405
712 HG3 GLU 92 HG3 GLU 92 11.671 0.067 7.951
713 H THR 93 H THR 93 11.294 -4.654 5.352
714 HA THR 93 HA THR 93 10.357 -6.805 6.984
715 HB THR 93 HB THR 93 11.027 -6.530 4.050
716 HG1 THR 93 HG1 THR 93 9.176 -5.641 4.432
717 HG21 THR 93 HG21 THR 93 9.930 -8.616 3.566
718 HG22 THR 93 HG22 THR 93 9.789 -9.007 5.306
719 HG23 THR 93 HG23 THR 93 11.377 -8.928 4.504
720 H ALA 94 H ALA 94 13.540 -6.260 5.529
721 HA ALA 94 HA ALA 94 14.630 -8.842 6.312
722 HB1 ALA 94 HB1 ALA 94 15.317 -7.511 4.281
723 HB2 ALA 94 HB2 ALA 94 16.048 -6.315 5.365
724 HB3 ALA 94 HB3 ALA 94 16.664 -7.981 5.325
725 H ARG 95 H ARG 95 13.809 -6.230 8.219
726 HA ARG 95 HA ARG 95 16.051 -6.566 10.137
727 HB2 ARG 95 HB2 ARG 95 16.299 -4.639 8.428
728 HB3 ARG 95 HB3 ARG 95 14.986 -3.853 9.301
729 HG2 ARG 95 HG2 ARG 95 16.924 -4.743 11.259
730 HG3 ARG 95 HG3 ARG 95 17.836 -4.026 9.934
731 HD2 ARG 95 HD2 ARG 95 15.505 -2.669 11.353
732 HD3 ARG 95 HD3 ARG 95 17.196 -2.443 11.795
733 HE ARG 95 HE ARG 95 15.834 -1.509 9.328
734 HH11 ARG 95 HH11 ARG 95 18.844 -1.512 11.262
735 HH12 ARG 95 HH12 ARG 95 19.507 -0.147 10.392
736 HH21 ARG 95 HH21 ARG 95 16.740 0.239 8.253
737 HH22 ARG 95 HH22 ARG 95 18.324 0.837 8.690
738 H LEU 96 H LEU 96 13.190 -7.444 10.250
739 HA LEU 96 HA LEU 96 11.646 -5.583 11.664
740 HB2 LEU 96 HB2 LEU 96 11.202 -7.997 10.377
741 HB3 LEU 96 HB3 LEU 96 10.850 -8.415 12.004
742 HG LEU 96 HG LEU 96 8.889 -7.921 10.746
743 HD11 LEU 96 HD11 LEU 96 7.806 -6.360 12.215
744 HD12 LEU 96 HD12 LEU 96 9.380 -5.682 12.708
745 HD13 LEU 96 HD13 LEU 96 8.962 -7.363 13.128
746 HD21 LEU 96 HD21 LEU 96 8.445 -5.732 9.816
747 HD22 LEU 96 HD22 LEU 96 9.974 -6.390 9.175
748 HD23 LEU 96 HD23 LEU 96 10.005 -5.122 10.407
749 H GLN 97 H GLN 97 14.219 -7.201 13.135
750 HA GLN 97 HA GLN 97 13.028 -7.312 15.831
751 HB2 GLN 97 HB2 GLN 97 15.947 -7.277 14.985
752 HB3 GLN 97 HB3 GLN 97 15.329 -7.636 16.589
753 HG2 GLN 97 HG2 GLN 97 14.296 -9.704 15.822
754 HG3 GLN 97 HG3 GLN 97 14.679 -9.331 14.139
755 HE21 GLN 97 HE21 GLN 97 16.429 -10.502 13.390
756 HE22 GLN 97 HE22 GLN 97 17.816 -10.921 14.390
757 H THR 98 H THR 98 14.734 -4.927 13.830
758 HA THR 98 HA THR 98 14.587 -2.883 15.995
759 HB THR 98 HB THR 98 16.951 -2.255 15.500
760 HG1 THR 98 HG1 THR 98 17.973 -4.372 14.524
761 HG21 THR 98 HG21 THR 98 18.052 -3.986 16.724
762 HG22 THR 98 HG22 THR 98 16.806 -5.182 16.314
763 HG23 THR 98 HG23 THR 98 16.422 -3.817 17.389
764 HA PRO 99 HA PRO 99 13.920 -0.982 11.730
765 HB2 PRO 99 HB2 PRO 99 11.267 -0.974 11.265
766 HB3 PRO 99 HB3 PRO 99 12.244 -2.456 11.013
767 HG2 PRO 99 HG2 PRO 99 10.595 -1.723 13.463
768 HG3 PRO 99 HG3 PRO 99 10.551 -3.248 12.520
769 HD2 PRO 99 HD2 PRO 99 12.074 -2.954 14.789
770 HD3 PRO 99 HD3 PRO 99 12.574 -3.979 13.420
771 H VAL 100 H VAL 100 12.909 -0.444 14.904
772 HA VAL 100 HA VAL 100 11.553 2.096 14.704
773 HB VAL 100 HB VAL 100 13.020 0.708 16.976
774 HG11 VAL 100 HG11 VAL 100 11.659 2.212 18.477
775 HG12 VAL 100 HG12 VAL 100 12.854 3.092 17.534
776 HG13 VAL 100 HG13 VAL 100 11.147 3.125 17.039
777 HG21 VAL 100 HG21 VAL 100 10.044 0.887 16.387
778 HG22 VAL 100 HG22 VAL 100 11.054 -0.563 16.184
779 HG23 VAL 100 HG23 VAL 100 10.786 0.105 17.791
780 H THR 101 H THR 101 12.353 4.022 14.367
781 HA THR 101 HA THR 101 15.128 4.725 15.230
782 HB THR 101 HB THR 101 14.960 4.232 12.756
783 HG1 THR 101 HG1 THR 101 16.114 6.243 12.275
784 HG21 THR 101 HG21 THR 101 13.639 6.961 12.582
785 HG22 THR 101 HG22 THR 101 12.768 5.425 12.366
786 HG23 THR 101 HG23 THR 101 14.076 5.852 11.260
787 H ASN 102 H ASN 102 11.833 5.438 15.324
788 HA ASN 102 HA ASN 102 12.428 7.711 17.118
789 HB2 ASN 102 HB2 ASN 102 11.873 8.822 15.047
790 HB3 ASN 102 HB3 ASN 102 10.493 7.762 14.766
791 HD21 ASN 102 HD21 ASN 102 11.644 9.963 17.432
792 HD22 ASN 102 HD22 ASN 102 10.015 10.620 17.674
793 H ARG 103 H ARG 103 9.670 5.700 15.876
794 HA ARG 103 HA ARG 103 8.971 4.970 18.709
795 HB2 ARG 103 HB2 ARG 103 7.082 6.141 16.631
796 HB3 ARG 103 HB3 ARG 103 6.542 5.285 18.077
797 HG2 ARG 103 HG2 ARG 103 7.586 6.964 19.530
798 HG3 ARG 103 HG3 ARG 103 8.262 7.801 18.126
799 HD2 ARG 103 HD2 ARG 103 6.300 8.994 18.853
800 HD3 ARG 103 HD3 ARG 103 5.988 8.259 17.274
801 HE ARG 103 HE ARG 103 5.144 6.606 19.524
802 HH11 ARG 103 HH11 ARG 103 4.108 9.263 17.377
803 HH12 ARG 103 HH12 ARG 103 2.407 8.975 17.677
804 HH21 ARG 103 HH21 ARG 103 2.932 6.247 19.841
805 HH22 ARG 103 HH22 ARG 103 1.746 7.274 19.066
806 H GLY 104 H GLY 104 8.015 4.407 15.311
807 HA2 GLY 104 HA2 GLY 104 7.338 2.544 14.154
808 HA3 GLY 104 HA3 GLY 104 8.411 1.612 15.185
809 H ILE 105 H ILE 105 7.526 0.346 16.803
810 HA ILE 105 HA ILE 105 4.554 0.313 17.147
811 HB ILE 105 HB ILE 105 6.303 -2.152 17.122
812 HG12 ILE 105 HG12 ILE 105 4.402 -1.050 14.998
813 HG13 ILE 105 HG13 ILE 105 6.151 -1.231 14.844
814 HG21 ILE 105 HG21 ILE 105 3.263 -1.783 17.200
815 HG22 ILE 105 HG22 ILE 105 4.146 -3.324 17.283
816 HG23 ILE 105 HG23 ILE 105 4.262 -2.184 18.609
817 HD11 ILE 105 HD11 ILE 105 5.872 -3.720 15.124
818 HD12 ILE 105 HD12 ILE 105 4.112 -3.456 14.990
819 HD13 ILE 105 HD13 ILE 105 5.178 -3.024 13.644
820 HA PRO 106 HA PRO 106 6.940 1.712 20.672
821 HB2 PRO 106 HB2 PRO 106 4.961 3.007 22.136
822 HB3 PRO 106 HB3 PRO 106 5.823 3.678 20.717
823 HG2 PRO 106 HG2 PRO 106 3.137 2.277 20.793
824 HG3 PRO 106 HG3 PRO 106 3.572 3.803 19.956
825 HD2 PRO 106 HD2 PRO 106 3.484 1.473 18.611
826 HD3 PRO 106 HD3 PRO 106 4.805 2.640 18.290
827 HHA HEC 107 HHA HEC 107 -4.101 -3.766 0.771
828 HHB HEC 107 HHB HEC 107 0.354 0.849 1.208
829 HHC HEC 107 HHC HEC 107 -3.518 4.140 5.183
830 HHD HEC 107 HHD HEC 107 -7.963 -0.486 4.746
831 HMA1 HEC 107 HMA1 HEC 107 0.608 -1.301 -1.178
832 HMA2 HEC 107 HMA2 HEC 107 1.328 -0.992 0.421
833 HMA3 HEC 107 HMA3 HEC 107 0.979 -2.637 -0.068
834 HAA1 HEC 107 HAA1 HEC 107 -2.589 -4.111 -0.813
835 HAA2 HEC 107 HAA2 HEC 107 -0.956 -3.695 -1.246
836 HBA1 HEC 107 HBA1 HEC 107 -0.913 -5.819 -0.095
837 HBA2 HEC 107 HBA2 HEC 107 -0.150 -4.627 0.961
838 HMB1 HEC 107 HMB1 HEC 107 0.718 4.503 2.031
839 HMB2 HEC 107 HMB2 HEC 107 1.617 3.174 2.813
840 HMB3 HEC 107 HMB3 HEC 107 0.943 2.999 1.172
841 HAB HEC 107 HAB HEC 107 -1.605 4.925 5.316
842 HBB1 HEC 107 HBB1 HEC 107 0.325 6.228 5.333
843 HBB2 HEC 107 HBB2 HEC 107 1.214 5.109 4.294
844 HBB3 HEC 107 HBB3 HEC 107 -0.146 6.070 3.639
845 HMC1 HEC 107 HMC1 HEC 107 -7.073 4.394 6.509
846 HMC2 HEC 107 HMC2 HEC 107 -5.413 4.318 7.109
847 HMC3 HEC 107 HMC3 HEC 107 -5.761 5.013 5.510
848 HAC HEC 107 HAC HEC 107 -7.988 0.528 6.752
849 HBC1 HEC 107 HBC1 HEC 107 -9.389 1.750 5.124
850 HBC2 HEC 107 HBC2 HEC 107 -9.989 1.931 6.788
851 HBC3 HEC 107 HBC3 HEC 107 -9.102 3.256 6.017
852 HMD1 HEC 107 HMD1 HEC 107 -9.321 -2.490 2.438
853 HMD2 HEC 107 HMD2 HEC 107 -8.738 -3.884 3.362
854 HMD3 HEC 107 HMD3 HEC 107 -8.990 -2.356 4.177
855 HAD1 HEC 107 HAD1 HEC 107 -5.997 -5.085 1.279
856 HAD2 HEC 107 HAD2 HEC 107 -7.682 -4.770 1.592
857 HBD1 HEC 107 HBD1 HEC 107 -7.624 -4.800 -0.728
858 HBD2 HEC 107 HBD2 HEC 107 -7.575 -3.075 -0.388
Start of MODEL 12
1 H SER 1 H SER 1 12.670 8.614 7.784
2 HA SER 1 HA SER 1 9.907 8.875 7.241
3 HB2 SER 1 HB2 SER 1 12.145 8.105 5.331
4 HB3 SER 1 HB3 SER 1 10.528 8.662 4.860
5 HG SER 1 HG SER 1 12.250 10.236 4.858
6 H GLY 2 H GLY 2 8.391 7.560 6.226
7 HA2 GLY 2 HA2 GLY 2 7.427 5.558 5.418
8 HA3 GLY 2 HA3 GLY 2 8.964 4.752 5.609
9 H GLU 3 H GLU 3 9.667 4.681 8.117
10 HA GLU 3 HA GLU 3 7.903 3.023 9.611
11 HB2 GLU 3 HB2 GLU 3 10.292 3.078 9.980
12 HB3 GLU 3 HB3 GLU 3 10.259 4.792 10.361
13 HG2 GLU 3 HG2 GLU 3 10.582 3.719 12.405
14 HG3 GLU 3 HG3 GLU 3 8.917 4.255 12.446
15 H GLN 4 H GLN 4 8.693 6.487 10.258
16 HA GLN 4 HA GLN 4 6.602 6.890 12.171
17 HB2 GLN 4 HB2 GLN 4 8.690 8.249 11.864
18 HB3 GLN 4 HB3 GLN 4 8.009 8.904 10.366
19 HG2 GLN 4 HG2 GLN 4 6.074 9.813 11.767
20 HG3 GLN 4 HG3 GLN 4 6.919 9.226 13.199
21 HE21 GLN 4 HE21 GLN 4 7.255 11.282 14.125
22 HE22 GLN 4 HE22 GLN 4 8.150 12.562 13.316
23 H ILE 5 H ILE 5 6.651 7.193 8.640
24 HA ILE 5 HA ILE 5 4.194 8.705 8.411
25 HB ILE 5 HB ILE 5 5.577 6.984 6.311
26 HG12 ILE 5 HG12 ILE 5 5.829 9.966 6.917
27 HG13 ILE 5 HG13 ILE 5 7.067 8.755 7.236
28 HG21 ILE 5 HG21 ILE 5 3.472 9.195 6.106
29 HG22 ILE 5 HG22 ILE 5 4.272 8.441 4.718
30 HG23 ILE 5 HG23 ILE 5 3.215 7.482 5.742
31 HD11 ILE 5 HD11 ILE 5 6.106 9.695 4.528
32 HD12 ILE 5 HD12 ILE 5 7.710 9.875 5.246
33 HD13 ILE 5 HD13 ILE 5 7.140 8.266 4.744
34 H PHE 6 H PHE 6 4.898 5.164 8.165
35 HA PHE 6 HA PHE 6 2.174 4.449 7.779
36 HB2 PHE 6 HB2 PHE 6 4.220 2.973 7.465
37 HB3 PHE 6 HB3 PHE 6 4.250 2.758 9.207
38 HD1 PHE 6 HD2 PHE 6 2.266 1.623 10.350
39 HD2 PHE 6 HD1 PHE 6 2.642 1.823 6.063
40 HE1 PHE 6 HE2 PHE 6 0.503 -0.105 10.113
41 HE2 PHE 6 HE1 PHE 6 0.880 0.087 5.827
42 HZ PHE 6 HZ PHE 6 -0.195 -0.879 7.858
43 H ARG 7 H ARG 7 4.076 4.860 10.765
44 HA ARG 7 HA ARG 7 2.078 4.127 12.624
45 HB2 ARG 7 HB2 ARG 7 4.588 4.346 12.876
46 HB3 ARG 7 HB3 ARG 7 4.361 6.089 13.053
47 HG2 ARG 7 HG2 ARG 7 3.025 5.703 15.102
48 HG3 ARG 7 HG3 ARG 7 3.133 3.946 14.848
49 HD2 ARG 7 HD2 ARG 7 5.624 4.113 15.016
50 HD3 ARG 7 HD3 ARG 7 5.464 5.846 15.336
51 HE ARG 7 HE ARG 7 4.201 3.766 17.080
52 HH11 ARG 7 HH11 ARG 7 6.341 6.621 16.834
53 HH12 ARG 7 HH12 ARG 7 6.537 6.736 18.569
54 HH21 ARG 7 HH21 ARG 7 4.498 3.963 19.303
55 HH22 ARG 7 HH22 ARG 7 5.496 5.242 19.959
56 H THR 8 H THR 8 2.311 7.088 10.813
57 HA THR 8 HA THR 8 0.373 8.469 12.639
58 HB THR 8 HB THR 8 1.153 10.569 11.489
59 HG1 THR 8 HG1 THR 8 3.349 8.973 10.734
60 HG21 THR 8 HG21 THR 8 3.269 10.739 12.728
61 HG22 THR 8 HG22 THR 8 3.293 8.979 12.983
62 HG23 THR 8 HG23 THR 8 2.016 9.970 13.715
63 H ARG 9 H ARG 9 0.739 7.442 9.275
64 HA ARG 9 HA ARG 9 -2.010 8.510 8.722
65 HB2 ARG 9 HB2 ARG 9 0.529 8.657 7.088
66 HB3 ARG 9 HB3 ARG 9 -1.050 8.739 6.309
67 HG2 ARG 9 HG2 ARG 9 -1.739 10.625 7.677
68 HG3 ARG 9 HG3 ARG 9 -0.216 10.595 8.580
69 HD2 ARG 9 HD2 ARG 9 -0.354 10.997 5.564
70 HD3 ARG 9 HD3 ARG 9 -0.395 12.330 6.730
71 HE ARG 9 HE ARG 9 1.823 10.754 7.400
72 HH11 ARG 9 HH11 ARG 9 0.820 12.793 4.644
73 HH12 ARG 9 HH12 ARG 9 2.462 13.268 4.274
74 HH21 ARG 9 HH21 ARG 9 3.930 11.421 6.884
75 HH22 ARG 9 HH22 ARG 9 4.210 12.499 5.536
76 H CYS 10 H CYS 10 -0.426 5.563 8.996
77 HA CYS 10 HA CYS 10 -2.368 4.313 7.069
78 HB2 CYS 10 HB2 CYS 10 0.415 3.320 7.547
79 HB3 CYS 10 HB3 CYS 10 -0.695 2.811 6.293
80 H SER 11 H SER 11 -0.908 4.058 10.247
81 HA SER 11 HA SER 11 -1.433 1.265 10.650
82 HB2 SER 11 HB2 SER 11 -0.667 1.717 12.931
83 HB3 SER 11 HB3 SER 11 0.430 2.395 11.722
84 HG SER 11 HG SER 11 -0.438 3.719 13.675
85 H SER 12 H SER 12 -3.784 3.248 10.195
86 HA SER 12 HA SER 12 -5.550 2.792 12.493
87 HB2 SER 12 HB2 SER 12 -7.030 4.266 11.041
88 HB3 SER 12 HB3 SER 12 -5.475 4.983 11.519
89 HG SER 12 HG SER 12 -5.843 5.295 9.301
90 H CYS 13 H CYS 13 -4.870 1.195 9.556
91 HA CYS 13 HA CYS 13 -7.460 -0.319 9.636
92 HB2 CYS 13 HB2 CYS 13 -5.994 0.680 7.177
93 HB3 CYS 13 HB3 CYS 13 -7.490 -0.246 7.192
94 H HIS 14 H HIS 14 -4.025 -0.544 9.419
95 HA HIS 14 HA HIS 14 -4.010 -3.433 9.248
96 HB2 HIS 14 2HB HIS 14 -2.066 -3.150 7.379
97 HB3 HIS 14 3HB HIS 14 -3.747 -3.508 7.003
98 HD1 HIS 14 1HD HIS 14 -2.496 0.077 7.745
99 HD2 HIS 14 2HD HIS 14 -3.779 -2.493 4.693
100 HE1 HIS 14 1HE HIS 14 -2.821 1.548 5.756
101 H THR 15 H THR 15 -1.697 -4.178 9.256
102 HA THR 15 HA THR 15 0.129 -2.382 10.779
103 HB THR 15 HB THR 15 0.874 -4.092 12.282
104 HG1 THR 15 HG1 THR 15 -1.292 -5.676 11.400
105 HG21 THR 15 HG21 THR 15 -2.115 -3.763 12.562
106 HG22 THR 15 HG22 THR 15 -0.880 -2.630 13.146
107 HG23 THR 15 HG23 THR 15 -0.986 -4.267 13.834
108 H VAL 16 H VAL 16 2.338 -2.933 10.678
109 HA VAL 16 HA VAL 16 3.063 -4.987 8.613
110 HB VAL 16 HB VAL 16 4.769 -2.561 9.239
111 HG11 VAL 16 HG11 VAL 16 5.854 -4.545 8.179
112 HG12 VAL 16 HG12 VAL 16 4.640 -4.504 6.879
113 HG13 VAL 16 HG13 VAL 16 5.791 -3.161 7.083
114 HG21 VAL 16 HG21 VAL 16 3.858 -1.738 6.969
115 HG22 VAL 16 HG22 VAL 16 2.498 -2.872 7.231
116 HG23 VAL 16 HG23 VAL 16 2.805 -1.573 8.373
117 H GLY 17 H GLY 17 2.917 -6.537 10.118
118 HA2 GLY 17 HA2 GLY 17 4.015 -8.138 11.362
119 HA3 GLY 17 HA3 GLY 17 5.295 -6.995 11.760
120 H ASN 18 H ASN 18 2.726 -5.234 12.789
121 HA ASN 18 HA ASN 18 3.239 -6.020 15.533
122 HB2 ASN 18 HB2 ASN 18 1.298 -3.935 14.474
123 HB3 ASN 18 HB3 ASN 18 1.757 -4.163 16.155
124 HD21 ASN 18 HD21 ASN 18 4.118 -3.937 16.688
125 HD22 ASN 18 HD22 ASN 18 5.091 -2.854 15.686
126 H THR 19 H THR 19 0.397 -6.587 13.408
127 HA THR 19 HA THR 19 -0.833 -8.212 15.590
128 HB THR 19 HB THR 19 -2.094 -7.290 13.007
129 HG1 THR 19 HG1 THR 19 -3.076 -5.798 14.205
130 HG21 THR 19 HG21 THR 19 -4.228 -7.801 14.162
131 HG22 THR 19 HG22 THR 19 -3.336 -8.480 15.533
132 HG23 THR 19 HG23 THR 19 -3.284 -9.265 13.939
133 H GLU 20 H GLU 20 -1.580 -10.437 15.028
134 HA GLU 20 HA GLU 20 0.190 -11.860 13.207
135 HB2 GLU 20 HB2 GLU 20 -2.298 -12.735 14.719
136 HB3 GLU 20 HB3 GLU 20 -1.279 -13.820 13.781
137 HG2 GLU 20 HG2 GLU 20 -0.404 -12.211 16.218
138 HG3 GLU 20 HG3 GLU 20 -0.747 -13.931 16.182
139 HA PRO 21 HA PRO 21 -1.993 -11.390 9.431
140 HB2 PRO 21 HB2 PRO 21 -1.446 -13.707 8.059
141 HB3 PRO 21 HB3 PRO 21 -0.205 -12.468 8.414
142 HG2 PRO 21 HG2 PRO 21 -0.820 -14.989 10.000
143 HG3 PRO 21 HG3 PRO 21 0.766 -14.440 9.376
144 HD2 PRO 21 HD2 PRO 21 0.061 -13.907 11.915
145 HD3 PRO 21 HD3 PRO 21 0.847 -12.634 10.932
146 H GLY 22 H GLY 22 -2.767 -14.318 11.295
147 HA2 GLY 22 HA2 GLY 22 -5.046 -15.108 9.738
148 HA3 GLY 22 HA3 GLY 22 -4.627 -15.668 11.361
149 H GLN 23 H GLN 23 -4.783 -12.413 11.773
150 HA GLN 23 HA GLN 23 -7.688 -12.432 12.509
151 HB2 GLN 23 HB2 GLN 23 -5.332 -11.660 14.271
152 HB3 GLN 23 HB3 GLN 23 -7.048 -11.505 14.687
153 HG2 GLN 23 HG2 GLN 23 -7.313 -13.984 14.431
154 HG3 GLN 23 HG3 GLN 23 -5.591 -14.125 14.083
155 HE21 GLN 23 HE21 GLN 23 -6.025 -15.711 15.940
156 HE22 GLN 23 HE22 GLN 23 -5.685 -15.081 17.546
157 HA PRO 24 HA PRO 24 -6.693 -8.411 10.443
158 HB2 PRO 24 HB2 PRO 24 -8.483 -8.430 8.415
159 HB3 PRO 24 HB3 PRO 24 -6.986 -9.408 8.352
160 HG2 PRO 24 HG2 PRO 24 -9.767 -10.326 9.155
161 HG3 PRO 24 HG3 PRO 24 -8.638 -11.094 7.994
162 HD2 PRO 24 HD2 PRO 24 -8.843 -11.883 10.619
163 HD3 PRO 24 HD3 PRO 24 -7.308 -11.962 9.703
164 H GLY 25 H GLY 25 -7.755 -6.450 10.548
165 HA2 GLY 25 HA2 GLY 25 -10.502 -6.230 11.722
166 HA3 GLY 25 HA3 GLY 25 -9.287 -4.947 11.644
167 H ILE 26 H ILE 26 -9.460 -3.511 9.941
168 HA ILE 26 HA ILE 26 -11.095 -3.985 7.575
169 HB ILE 26 HB ILE 26 -8.967 -1.950 8.280
170 HG12 ILE 26 HG12 ILE 26 -11.897 -1.555 7.559
171 HG13 ILE 26 HG13 ILE 26 -11.365 -1.848 9.212
172 HG21 ILE 26 HG21 ILE 26 -9.516 -0.791 6.121
173 HG22 ILE 26 HG22 ILE 26 -8.685 -2.309 5.869
174 HG23 ILE 26 HG23 ILE 26 -10.448 -2.212 5.622
175 HD11 ILE 26 HD11 ILE 26 -11.660 0.529 8.873
176 HD12 ILE 26 HD12 ILE 26 -9.936 0.189 9.113
177 HD13 ILE 26 HD13 ILE 26 -10.567 0.540 7.494
178 H GLY 27 H GLY 27 -7.534 -3.920 8.082
179 HA2 GLY 27 HA2 GLY 27 -7.156 -5.728 5.738
180 HA3 GLY 27 HA3 GLY 27 -6.037 -4.478 6.269
181 HA PRO 28 HA PRO 28 -4.820 -8.553 8.339
182 HB2 PRO 28 HB2 PRO 28 -3.247 -9.804 6.535
183 HB3 PRO 28 HB3 PRO 28 -5.020 -9.793 6.332
184 HG2 PRO 28 HG2 PRO 28 -3.007 -7.911 5.045
185 HG3 PRO 28 HG3 PRO 28 -4.261 -8.900 4.228
186 HD2 PRO 28 HD2 PRO 28 -4.651 -6.272 4.958
187 HD3 PRO 28 HD3 PRO 28 -5.975 -7.473 4.931
188 H ASP 29 H ASP 29 -2.211 -9.341 8.215
189 HA ASP 29 HA ASP 29 -0.475 -7.036 8.874
190 HB2 ASP 29 HB2 ASP 29 -0.240 -9.068 10.187
191 HB3 ASP 29 HB3 ASP 29 -0.051 -10.040 8.729
192 H LEU 30 H LEU 30 1.068 -6.246 7.505
193 HA LEU 30 HA LEU 30 0.981 -7.073 4.634
194 HB2 LEU 30 HB2 LEU 30 2.168 -4.555 5.805
195 HB3 LEU 30 HB3 LEU 30 1.810 -4.889 4.118
196 HG LEU 30 HG LEU 30 -0.206 -4.433 6.352
197 HD11 LEU 30 HD11 LEU 30 0.453 -2.819 3.852
198 HD12 LEU 30 HD12 LEU 30 0.957 -2.416 5.511
199 HD13 LEU 30 HD13 LEU 30 -0.761 -2.412 5.088
200 HD21 LEU 30 HD21 LEU 30 -1.941 -4.478 4.563
201 HD22 LEU 30 HD22 LEU 30 -1.168 -6.043 4.750
202 HD23 LEU 30 HD23 LEU 30 -0.713 -5.003 3.388
203 H LEU 31 H LEU 31 3.004 -7.694 7.298
204 HA LEU 31 HA LEU 31 5.567 -7.285 6.116
205 HB2 LEU 31 HB2 LEU 31 5.173 -7.497 8.409
206 HB3 LEU 31 HB3 LEU 31 4.772 -9.212 8.232
207 HG LEU 31 HG LEU 31 7.031 -9.811 7.789
208 HD11 LEU 31 HD11 LEU 31 7.854 -8.179 6.203
209 HD12 LEU 31 HD12 LEU 31 8.864 -8.042 7.626
210 HD13 LEU 31 HD13 LEU 31 7.583 -6.844 7.343
211 HD21 LEU 31 HD21 LEU 31 8.203 -8.842 9.726
212 HD22 LEU 31 HD22 LEU 31 6.492 -9.104 10.126
213 HD23 LEU 31 HD23 LEU 31 7.062 -7.467 9.717
214 H GLY 32 H GLY 32 6.626 -8.268 4.709
215 HA2 GLY 32 HA2 GLY 32 7.437 -9.929 3.181
216 HA3 GLY 32 HA3 GLY 32 6.069 -10.963 3.583
217 H VAL 33 H VAL 33 4.315 -8.304 2.980
218 HA VAL 33 HA VAL 33 3.402 -9.349 0.576
219 HB VAL 33 HB VAL 33 2.222 -7.821 2.226
220 HG11 VAL 33 HG11 VAL 33 2.078 -5.459 1.754
221 HG12 VAL 33 HG12 VAL 33 3.785 -5.840 2.028
222 HG13 VAL 33 HG13 VAL 33 3.180 -5.586 0.374
223 HG21 VAL 33 HG21 VAL 33 1.210 -8.698 0.132
224 HG22 VAL 33 HG22 VAL 33 0.574 -7.130 0.634
225 HG23 VAL 33 HG23 VAL 33 1.743 -7.212 -0.696
226 H THR 34 H THR 34 5.856 -6.867 0.917
227 HA THR 34 HA THR 34 6.035 -5.951 -1.780
228 HB THR 34 HB THR 34 7.146 -4.754 -0.065
229 HG1 THR 34 HG1 THR 34 9.329 -5.886 -1.431
230 HG21 THR 34 HG21 THR 34 9.094 -5.540 1.154
231 HG22 THR 34 HG22 THR 34 8.976 -7.143 0.413
232 HG23 THR 34 HG23 THR 34 7.718 -6.562 1.523
233 H ARG 35 H ARG 35 7.331 -8.950 -0.323
234 HA ARG 35 HA ARG 35 8.701 -9.557 -2.875
235 HB2 ARG 35 HB2 ARG 35 9.834 -11.330 -1.838
236 HB3 ARG 35 HB3 ARG 35 10.042 -9.859 -0.902
237 HG2 ARG 35 HG2 ARG 35 8.567 -10.623 0.830
238 HG3 ARG 35 HG3 ARG 35 8.015 -12.007 -0.131
239 HD2 ARG 35 HD2 ARG 35 10.881 -11.591 0.810
240 HD3 ARG 35 HD3 ARG 35 9.678 -12.570 1.669
241 HE ARG 35 HE ARG 35 9.578 -13.659 -0.807
242 HH11 ARG 35 HH11 ARG 35 12.363 -13.000 1.324
243 HH12 ARG 35 HH12 ARG 35 13.301 -14.325 0.673
244 HH21 ARG 35 HH21 ARG 35 10.828 -15.355 -1.619
245 HH22 ARG 35 HH22 ARG 35 12.433 -15.657 -0.991
246 H GLN 36 H GLN 36 5.672 -9.698 -2.103
247 HA GLN 36 HA GLN 36 5.095 -12.292 -3.484
248 HB2 GLN 36 HB2 GLN 36 3.631 -10.967 -1.162
249 HB3 GLN 36 HB3 GLN 36 3.042 -12.378 -2.049
250 HG2 GLN 36 HG2 GLN 36 5.017 -13.676 -1.381
251 HG3 GLN 36 HG3 GLN 36 5.677 -12.285 -0.514
252 HE21 GLN 36 HE21 GLN 36 3.142 -14.808 -0.406
253 HE22 GLN 36 HE22 GLN 36 2.751 -14.496 1.269
254 H ARG 37 H ARG 37 4.485 -8.858 -3.496
255 HA ARG 37 HA ARG 37 2.364 -9.160 -5.588
256 HB2 ARG 37 HB2 ARG 37 3.015 -6.828 -3.763
257 HB3 ARG 37 HB3 ARG 37 1.808 -6.789 -5.045
258 HG2 ARG 37 HG2 ARG 37 1.714 -8.626 -2.616
259 HG3 ARG 37 HG3 ARG 37 0.843 -7.104 -2.816
260 HD2 ARG 37 HD2 ARG 37 -0.327 -8.073 -4.809
261 HD3 ARG 37 HD3 ARG 37 0.465 -9.622 -4.472
262 HE ARG 37 HE ARG 37 -1.249 -8.229 -2.455
263 HH11 ARG 37 HH11 ARG 37 -0.598 -11.206 -4.319
264 HH12 ARG 37 HH12 ARG 37 -1.779 -12.134 -3.420
265 HH21 ARG 37 HH21 ARG 37 -2.748 -9.456 -1.341
266 HH22 ARG 37 HH22 ARG 37 -3.002 -11.141 -1.738
267 H ASP 38 H ASP 38 2.387 -7.782 -7.391
268 HA ASP 38 HA ASP 38 4.936 -7.611 -8.684
269 HB2 ASP 38 HB2 ASP 38 2.175 -6.612 -9.456
270 HB3 ASP 38 HB3 ASP 38 3.588 -6.521 -10.517
271 H ALA 39 H ALA 39 6.394 -6.057 -8.933
272 HA ALA 39 HA ALA 39 6.413 -4.183 -6.838
273 HB1 ALA 39 HB1 ALA 39 8.333 -5.508 -7.611
274 HB2 ALA 39 HB2 ALA 39 8.372 -4.594 -9.131
275 HB3 ALA 39 HB3 ALA 39 8.723 -3.780 -7.589
276 H ASN 40 H ASN 40 5.751 -3.488 -10.274
277 HA ASN 40 HA ASN 40 6.052 -0.580 -9.800
278 HB2 ASN 40 HB2 ASN 40 6.532 -1.773 -12.021
279 HB3 ASN 40 HB3 ASN 40 4.782 -1.920 -12.221
280 HD21 ASN 40 HD21 ASN 40 7.501 0.320 -11.923
281 HD22 ASN 40 HD22 ASN 40 6.649 1.713 -12.589
282 H TRP 41 H TRP 41 3.480 -2.967 -10.125
283 HA TRP 41 HA TRP 41 1.188 -1.295 -10.034
284 HB2 TRP 41 HB2 TRP 41 1.187 -3.600 -10.779
285 HB3 TRP 41 HB3 TRP 41 1.694 -4.172 -9.200
286 HD1 TRP 41 HD1 TRP 41 -1.368 -3.033 -11.124
287 HE1 TRP 41 HE1 TRP 41 -3.472 -3.743 -9.881
288 HE3 TRP 41 HE3 TRP 41 0.794 -4.545 -6.723
289 HZ2 TRP 41 HZ2 TRP 41 -4.161 -4.654 -7.197
290 HZ3 TRP 41 HZ3 TRP 41 -0.631 -5.277 -4.816
291 HH2 TRP 41 HH2 TRP 41 -3.089 -5.329 -5.042
292 H LEU 42 H LEU 42 2.899 -2.977 -7.337
293 HA LEU 42 HA LEU 42 1.133 -2.235 -5.303
294 HB2 LEU 42 HB2 LEU 42 3.010 -3.942 -5.269
295 HB3 LEU 42 HB3 LEU 42 4.154 -2.617 -5.090
296 HG LEU 42 HG LEU 42 3.004 -2.007 -2.911
297 HD11 LEU 42 HD11 LEU 42 0.794 -3.001 -3.238
298 HD12 LEU 42 HD12 LEU 42 1.580 -3.829 -1.885
299 HD13 LEU 42 HD13 LEU 42 1.506 -4.609 -3.467
300 HD21 LEU 42 HD21 LEU 42 3.964 -3.880 -1.639
301 HD22 LEU 42 HD22 LEU 42 5.045 -3.382 -2.953
302 HD23 LEU 42 HD23 LEU 42 4.069 -4.850 -3.127
303 H VAL 43 H VAL 43 3.819 -0.341 -6.623
304 HA VAL 43 HA VAL 43 3.550 1.811 -4.637
305 HB VAL 43 HB VAL 43 5.162 1.794 -7.216
306 HG11 VAL 43 HG11 VAL 43 5.381 3.486 -4.682
307 HG12 VAL 43 HG12 VAL 43 6.501 3.533 -6.058
308 HG13 VAL 43 HG13 VAL 43 4.830 4.060 -6.273
309 HG21 VAL 43 HG21 VAL 43 5.955 -0.056 -5.840
310 HG22 VAL 43 HG22 VAL 43 7.099 1.273 -5.670
311 HG23 VAL 43 HG23 VAL 43 5.926 0.942 -4.381
312 H ARG 44 H ARG 44 2.527 1.292 -8.036
313 HA ARG 44 HA ARG 44 1.363 3.877 -8.468
314 HB2 ARG 44 HB2 ARG 44 1.800 2.350 -10.295
315 HB3 ARG 44 HB3 ARG 44 0.705 1.138 -9.615
316 HG2 ARG 44 HG2 ARG 44 -1.221 2.635 -9.968
317 HG3 ARG 44 HG3 ARG 44 -0.154 3.894 -10.606
318 HD2 ARG 44 HD2 ARG 44 0.292 2.667 -12.587
319 HD3 ARG 44 HD3 ARG 44 -0.170 1.130 -11.843
320 HE ARG 44 HE ARG 44 -2.310 1.436 -12.475
321 HH11 ARG 44 HH11 ARG 44 -0.831 4.685 -12.547
322 HH12 ARG 44 HH12 ARG 44 -2.278 5.430 -13.192
323 HH21 ARG 44 HH21 ARG 44 -4.144 2.442 -13.294
324 HH22 ARG 44 HH22 ARG 44 -4.150 4.163 -13.611
325 H TRP 45 H TRP 45 -0.008 0.872 -7.099
326 HA TRP 45 HA TRP 45 -2.650 1.748 -6.532
327 HB2 TRP 45 HB2 TRP 45 -2.118 -0.553 -6.364
328 HB3 TRP 45 HB3 TRP 45 -0.731 -0.258 -5.333
329 HD1 TRP 45 HD1 TRP 45 -1.018 -0.777 -2.932
330 HE1 TRP 45 HE1 TRP 45 -2.964 -1.201 -1.320
331 HE3 TRP 45 HE3 TRP 45 -4.904 0.550 -5.985
332 HZ2 TRP 45 HZ2 TRP 45 -5.851 -0.877 -1.307
333 HZ3 TRP 45 HZ3 TRP 45 -7.238 0.526 -5.139
334 HH2 TRP 45 HH2 TRP 45 -7.722 -0.194 -2.816
335 H LEU 46 H LEU 46 0.336 2.232 -4.578
336 HA LEU 46 HA LEU 46 -1.152 3.537 -2.453
337 HB2 LEU 46 HB2 LEU 46 0.887 2.227 -2.084
338 HB3 LEU 46 HB3 LEU 46 1.825 3.363 -3.052
339 HG LEU 46 HG LEU 46 1.533 5.127 -1.409
340 HD11 LEU 46 HD11 LEU 46 -0.167 3.138 0.173
341 HD12 LEU 46 HD12 LEU 46 -0.750 4.642 -0.567
342 HD13 LEU 46 HD13 LEU 46 0.396 4.732 0.749
343 HD21 LEU 46 HD21 LEU 46 2.741 4.093 0.468
344 HD22 LEU 46 HD22 LEU 46 3.330 3.483 -1.080
345 HD23 LEU 46 HD23 LEU 46 2.253 2.471 -0.099
346 H LYS 47 H LYS 47 0.439 4.701 -5.376
347 HA LYS 47 HA LYS 47 0.263 7.539 -4.660
348 HB2 LYS 47 HB2 LYS 47 0.688 6.060 -7.283
349 HB3 LYS 47 HB3 LYS 47 0.574 7.819 -7.180
350 HG2 LYS 47 HG2 LYS 47 2.516 7.966 -5.747
351 HG3 LYS 47 HG3 LYS 47 2.623 6.201 -5.609
352 HD2 LYS 47 HD2 LYS 47 3.116 5.973 -7.971
353 HD3 LYS 47 HD3 LYS 47 2.852 7.708 -8.247
354 HE2 LYS 47 HE2 LYS 47 4.778 8.284 -6.875
355 HE3 LYS 47 HE3 LYS 47 5.047 6.584 -6.453
356 HZ1 LYS 47 HZ1 LYS 47 5.143 7.643 -9.230
357 HZ2 LYS 47 HZ2 LYS 47 5.540 6.120 -8.762
358 HZ3 LYS 47 HZ3 LYS 47 6.468 7.388 -8.295
359 H VAL 48 H VAL 48 -1.787 5.387 -6.685
360 HA VAL 48 HA VAL 48 -3.969 7.436 -6.516
361 HB VAL 48 HB VAL 48 -4.348 7.157 -8.929
362 HG11 VAL 48 HG11 VAL 48 -2.651 8.677 -9.626
363 HG12 VAL 48 HG12 VAL 48 -3.011 9.033 -7.932
364 HG13 VAL 48 HG13 VAL 48 -1.535 8.146 -8.360
365 HG21 VAL 48 HG21 VAL 48 -3.127 4.988 -9.350
366 HG22 VAL 48 HG22 VAL 48 -2.633 6.305 -10.421
367 HG23 VAL 48 HG23 VAL 48 -1.598 5.839 -9.061
368 HA PRO 49 HA PRO 49 -5.384 3.019 -5.765
369 HB2 PRO 49 HB2 PRO 49 -6.806 3.393 -3.422
370 HB3 PRO 49 HB3 PRO 49 -5.057 3.063 -3.490
371 HG2 PRO 49 HG2 PRO 49 -6.443 5.748 -3.261
372 HG3 PRO 49 HG3 PRO 49 -5.056 5.132 -2.304
373 HD2 PRO 49 HD2 PRO 49 -4.693 6.797 -4.408
374 HD3 PRO 49 HD3 PRO 49 -3.561 5.449 -4.105
375 H ASP 50 H ASP 50 -7.335 6.030 -5.576
376 HA ASP 50 HA ASP 50 -9.878 4.636 -6.017
377 HB2 ASP 50 HB2 ASP 50 -9.743 6.778 -4.782
378 HB3 ASP 50 HB3 ASP 50 -9.135 7.579 -6.236
379 H GLN 51 H GLN 51 -7.484 6.342 -7.986
380 HA GLN 51 HA GLN 51 -9.003 6.183 -10.451
381 HB2 GLN 51 HB2 GLN 51 -7.267 7.923 -9.552
382 HB3 GLN 51 HB3 GLN 51 -6.071 6.823 -10.256
383 HG2 GLN 51 HG2 GLN 51 -7.144 7.118 -12.472
384 HG3 GLN 51 HG3 GLN 51 -8.397 8.125 -11.734
385 HE21 GLN 51 HE21 GLN 51 -7.655 9.857 -13.319
386 HE22 GLN 51 HE22 GLN 51 -6.307 10.814 -12.749
387 H MET 52 H MET 52 -6.832 4.008 -8.834
388 HA MET 52 HA MET 52 -6.159 2.327 -11.091
389 HB2 MET 52 HB2 MET 52 -4.990 2.345 -8.856
390 HB3 MET 52 HB3 MET 52 -6.436 1.648 -8.125
391 HG2 MET 52 HG2 MET 52 -5.021 -0.176 -8.475
392 HG3 MET 52 HG3 MET 52 -6.201 -0.274 -9.764
393 HE1 MET 52 HE1 MET 52 -2.623 1.031 -8.816
394 HE2 MET 52 HE2 MET 52 -2.699 -0.749 -8.856
395 HE3 MET 52 HE3 MET 52 -1.682 0.115 -10.024
396 H LEU 53 H LEU 53 -8.805 2.282 -8.660
397 HA LEU 53 HA LEU 53 -10.207 0.042 -9.878
398 HB2 LEU 53 HB2 LEU 53 -11.091 2.106 -7.826
399 HB3 LEU 53 HB3 LEU 53 -11.996 0.656 -8.245
400 HG LEU 53 HG LEU 53 -9.197 0.601 -7.050
401 HD11 LEU 53 HD11 LEU 53 -11.880 0.252 -5.652
402 HD12 LEU 53 HD12 LEU 53 -10.779 1.637 -5.468
403 HD13 LEU 53 HD13 LEU 53 -10.283 0.035 -4.904
404 HD21 LEU 53 HD21 LEU 53 -9.702 -1.725 -6.466
405 HD22 LEU 53 HD22 LEU 53 -9.793 -1.494 -8.217
406 HD23 LEU 53 HD23 LEU 53 -11.283 -1.600 -7.254
407 H ALA 54 H ALA 54 -10.617 3.617 -10.043
408 HA ALA 54 HA ALA 54 -12.942 3.522 -11.720
409 HB1 ALA 54 HB1 ALA 54 -10.905 5.751 -11.406
410 HB2 ALA 54 HB2 ALA 54 -12.562 5.905 -12.012
411 HB3 ALA 54 HB3 ALA 54 -12.284 5.462 -10.319
412 H GLU 55 H GLU 55 -9.600 3.034 -12.514
413 HA GLU 55 HA GLU 55 -9.948 3.225 -15.419
414 HB2 GLU 55 HB2 GLU 55 -7.764 3.617 -14.562
415 HB3 GLU 55 HB3 GLU 55 -7.794 2.158 -13.591
416 HG2 GLU 55 HG2 GLU 55 -6.310 1.692 -15.296
417 HG3 GLU 55 HG3 GLU 55 -7.743 0.806 -15.736
418 H LYS 56 H LYS 56 -8.900 0.249 -13.761
419 HA LYS 56 HA LYS 56 -11.294 -1.287 -14.297
420 HB2 LYS 56 HB2 LYS 56 -10.706 -2.505 -16.256
421 HB3 LYS 56 HB3 LYS 56 -10.417 -0.830 -16.662
422 HG2 LYS 56 HG2 LYS 56 -7.914 -1.364 -15.959
423 HG3 LYS 56 HG3 LYS 56 -8.421 -3.040 -16.170
424 HD2 LYS 56 HD2 LYS 56 -9.205 -2.444 -18.503
425 HD3 LYS 56 HD3 LYS 56 -8.530 -0.818 -18.256
426 HE2 LYS 56 HE2 LYS 56 -6.302 -1.955 -17.732
427 HE3 LYS 56 HE3 LYS 56 -7.035 -3.476 -18.250
428 HZ1 LYS 56 HZ1 LYS 56 -5.854 -2.467 -20.078
429 HZ2 LYS 56 HZ2 LYS 56 -6.677 -1.047 -19.931
430 HZ3 LYS 56 HZ3 LYS 56 -7.460 -2.399 -20.424
431 H ASP 57 H ASP 57 -8.389 -1.099 -12.699
432 HA ASP 57 HA ASP 57 -6.934 -3.241 -13.664
433 HB2 ASP 57 HB2 ASP 57 -6.141 -1.168 -12.426
434 HB3 ASP 57 HB3 ASP 57 -6.503 -2.040 -10.928
435 HA PRO 58 HA PRO 58 -9.778 -5.851 -11.900
436 HB2 PRO 58 HB2 PRO 58 -9.439 -8.117 -13.341
437 HB3 PRO 58 HB3 PRO 58 -9.872 -6.491 -14.007
438 HG2 PRO 58 HG2 PRO 58 -7.044 -7.559 -13.873
439 HG3 PRO 58 HG3 PRO 58 -7.970 -7.152 -15.369
440 HD2 PRO 58 HD2 PRO 58 -6.409 -5.362 -14.136
441 HD3 PRO 58 HD3 PRO 58 -8.036 -4.876 -14.705
442 H LEU 59 H LEU 59 -6.463 -6.747 -11.609
443 HA LEU 59 HA LEU 59 -6.590 -8.709 -9.503
444 HB2 LEU 59 HB2 LEU 59 -4.544 -8.249 -10.742
445 HB3 LEU 59 HB3 LEU 59 -4.557 -6.561 -10.230
446 HG LEU 59 HG LEU 59 -4.113 -7.227 -7.898
447 HD11 LEU 59 HD11 LEU 59 -3.990 -10.068 -8.990
448 HD12 LEU 59 HD12 LEU 59 -5.165 -9.447 -7.810
449 HD13 LEU 59 HD13 LEU 59 -3.460 -9.559 -7.374
450 HD21 LEU 59 HD21 LEU 59 -2.254 -6.794 -9.475
451 HD22 LEU 59 HD22 LEU 59 -2.187 -8.528 -9.866
452 HD23 LEU 59 HD23 LEU 59 -1.813 -7.958 -8.221
453 H ALA 60 H ALA 60 -6.651 -5.080 -9.394
454 HA ALA 60 HA ALA 60 -6.894 -5.064 -6.475
455 HB1 ALA 60 HB1 ALA 60 -7.256 -2.704 -6.719
456 HB2 ALA 60 HB2 ALA 60 -5.868 -3.190 -7.716
457 HB3 ALA 60 HB3 ALA 60 -7.444 -2.854 -8.481
458 H MET 61 H MET 61 -9.169 -4.693 -9.240
459 HA MET 61 HA MET 61 -11.540 -4.292 -7.755
460 HB2 MET 61 HB2 MET 61 -11.221 -5.786 -10.365
461 HB3 MET 61 HB3 MET 61 -12.696 -5.037 -9.767
462 HG2 MET 61 HG2 MET 61 -10.181 -3.446 -10.378
463 HG3 MET 61 HG3 MET 61 -11.428 -3.761 -11.564
464 HE1 MET 61 HE1 MET 61 -14.316 -1.602 -10.648
465 HE2 MET 61 HE2 MET 61 -13.386 -2.475 -11.904
466 HE3 MET 61 HE3 MET 61 -14.082 -3.373 -10.537
467 H LEU 62 H LEU 62 -9.749 -7.283 -8.287
468 HA LEU 62 HA LEU 62 -11.716 -9.068 -7.060
469 HB2 LEU 62 HB2 LEU 62 -10.069 -9.845 -8.713
470 HB3 LEU 62 HB3 LEU 62 -8.765 -9.216 -7.707
471 HG LEU 62 HG LEU 62 -9.218 -10.879 -5.986
472 HD11 LEU 62 HD11 LEU 62 -11.641 -11.253 -6.279
473 HD12 LEU 62 HD12 LEU 62 -10.757 -12.778 -6.438
474 HD13 LEU 62 HD13 LEU 62 -11.347 -11.946 -7.890
475 HD21 LEU 62 HD21 LEU 62 -7.652 -11.388 -7.814
476 HD22 LEU 62 HD22 LEU 62 -8.986 -12.074 -8.773
477 HD23 LEU 62 HD23 LEU 62 -8.477 -12.849 -7.254
478 H LEU 63 H LEU 63 -8.531 -7.559 -6.069
479 HA LEU 63 HA LEU 63 -8.460 -9.010 -3.631
480 HB2 LEU 63 HB2 LEU 63 -6.541 -8.168 -4.867
481 HB3 LEU 63 HB3 LEU 63 -7.015 -6.495 -4.580
482 HG LEU 63 HG LEU 63 -6.491 -8.284 -2.212
483 HD11 LEU 63 HD11 LEU 63 -4.397 -6.962 -3.981
484 HD12 LEU 63 HD12 LEU 63 -4.582 -8.698 -3.662
485 HD13 LEU 63 HD13 LEU 63 -4.081 -7.605 -2.356
486 HD21 LEU 63 HD21 LEU 63 -5.917 -5.338 -2.802
487 HD22 LEU 63 HD22 LEU 63 -5.626 -6.162 -1.253
488 HD23 LEU 63 HD23 LEU 63 -7.280 -5.932 -1.839
489 H PHE 64 H PHE 64 -9.628 -5.785 -4.444
490 HA PHE 64 HA PHE 64 -9.952 -5.037 -1.648
491 HB2 PHE 64 HB2 PHE 64 -10.137 -2.987 -2.330
492 HB3 PHE 64 HB3 PHE 64 -9.692 -3.550 -3.914
493 HD1 PHE 64 HD2 PHE 64 -11.745 -4.268 -5.488
494 HD2 PHE 64 HD1 PHE 64 -12.046 -1.702 -2.044
495 HE1 PHE 64 HE2 PHE 64 -13.842 -3.290 -6.397
496 HE2 PHE 64 HE1 PHE 64 -14.141 -0.733 -2.945
497 HZ PHE 64 HZ PHE 64 -15.046 -1.527 -5.122
498 H GLU 65 H GLU 65 -12.337 -6.187 -4.133
499 HA GLU 65 HA GLU 65 -14.551 -6.040 -2.319
500 HB2 GLU 65 HB2 GLU 65 -14.166 -7.895 -4.701
501 HB3 GLU 65 HB3 GLU 65 -15.646 -7.731 -3.748
502 HG2 GLU 65 HG2 GLU 65 -15.452 -5.186 -4.288
503 HG3 GLU 65 HG3 GLU 65 -14.371 -5.686 -5.574
504 H GLN 66 H GLN 66 -12.090 -8.617 -2.749
505 HA GLN 66 HA GLN 66 -13.471 -10.385 -0.946
506 HB2 GLN 66 HB2 GLN 66 -10.614 -10.375 -2.014
507 HB3 GLN 66 HB3 GLN 66 -11.219 -11.596 -0.879
508 HG2 GLN 66 HG2 GLN 66 -13.120 -12.044 -2.475
509 HG3 GLN 66 HG3 GLN 66 -12.298 -11.046 -3.671
510 HE21 GLN 66 HE21 GLN 66 -12.903 -13.674 -4.270
511 HE22 GLN 66 HE22 GLN 66 -11.400 -14.592 -4.339
512 H TYR 67 H TYR 67 -11.224 -7.766 -0.241
513 HA TYR 67 HA TYR 67 -11.341 -8.518 2.643
514 HB2 TYR 67 HB2 TYR 67 -9.808 -6.311 1.259
515 HB3 TYR 67 HB3 TYR 67 -9.831 -6.598 2.992
516 HD1 TYR 67 HD1 TYR 67 -9.133 -9.059 3.790
517 HD2 TYR 67 HD2 TYR 67 -8.002 -7.218 0.066
518 HE1 TYR 67 HE1 TYR 67 -7.111 -10.513 3.681
519 HE2 TYR 67 HE2 TYR 67 -5.964 -8.660 -0.027
520 HH TYR 67 HH TYR 67 -5.114 -10.998 2.508
521 H ASN 68 H ASN 68 -13.799 -8.059 1.471
522 HA ASN 68 HA ASN 68 -15.720 -6.947 1.567
523 HB2 ASN 68 HB2 ASN 68 -15.410 -7.618 3.932
524 HB3 ASN 68 HB3 ASN 68 -14.712 -6.036 4.274
525 HD21 ASN 68 HD21 ASN 68 -16.173 -4.774 5.293
526 HD22 ASN 68 HD22 ASN 68 -17.859 -4.600 4.818
527 H ARG 69 H ARG 69 -14.043 -5.597 -0.049
528 HA ARG 69 HA ARG 69 -13.837 -3.674 -1.229
529 HB2 ARG 69 HB2 ARG 69 -16.450 -2.925 0.111
530 HB3 ARG 69 HB3 ARG 69 -15.668 -1.963 -1.151
531 HG2 ARG 69 HG2 ARG 69 -15.772 -3.781 -2.719
532 HG3 ARG 69 HG3 ARG 69 -16.440 -4.886 -1.494
533 HD2 ARG 69 HD2 ARG 69 -18.446 -3.415 -1.304
534 HD3 ARG 69 HD3 ARG 69 -17.776 -2.364 -2.561
535 HE ARG 69 HE ARG 69 -18.371 -3.880 -4.185
536 HH11 ARG 69 HH11 ARG 69 -18.703 -5.513 -1.027
537 HH12 ARG 69 HH12 ARG 69 -19.510 -6.902 -1.718
538 HH21 ARG 69 HH21 ARG 69 -19.414 -5.702 -5.028
539 HH22 ARG 69 HH22 ARG 69 -19.910 -7.008 -3.977
540 H LEU 70 H LEU 70 -15.224 -1.600 1.132
541 HA LEU 70 HA LEU 70 -14.557 0.118 2.335
542 HB2 LEU 70 HB2 LEU 70 -13.729 -1.917 3.580
543 HB3 LEU 70 HB3 LEU 70 -12.114 -1.538 3.039
544 HG LEU 70 HG LEU 70 -12.727 -0.926 5.384
545 HD11 LEU 70 HD11 LEU 70 -11.878 1.506 3.794
546 HD12 LEU 70 HD12 LEU 70 -10.816 0.160 4.227
547 HD13 LEU 70 HD13 LEU 70 -11.548 1.153 5.493
548 HD21 LEU 70 HD21 LEU 70 -14.296 1.397 4.201
549 HD22 LEU 70 HD22 LEU 70 -14.030 1.011 5.921
550 HD23 LEU 70 HD23 LEU 70 -15.020 -0.056 4.922
551 H ALA 71 H ALA 71 -11.837 -0.846 0.278
552 HA ALA 71 HA ALA 71 -10.306 0.290 -0.934
553 HB1 ALA 71 HB1 ALA 71 -12.359 1.187 -1.970
554 HB2 ALA 71 HB2 ALA 71 -12.279 2.593 -0.889
555 HB3 ALA 71 HB3 ALA 71 -10.992 2.302 -2.073
556 H MET 72 H MET 72 -9.191 2.721 -1.053
557 HA MET 72 HA MET 72 -8.993 4.009 1.516
558 HB2 MET 72 HB2 MET 72 -6.628 3.910 1.850
559 HB3 MET 72 HB3 MET 72 -7.261 2.276 1.751
560 HG2 MET 72 HG2 MET 72 -6.461 2.245 -0.685
561 HG3 MET 72 HG3 MET 72 -5.621 3.759 -0.312
562 HE1 MET 72 HE1 MET 72 -3.115 3.211 -0.511
563 HE2 MET 72 HE2 MET 72 -2.483 1.567 -0.266
564 HE3 MET 72 HE3 MET 72 -3.782 1.857 -1.449
565 HA PRO 73 HA PRO 73 -8.704 7.342 -1.405
566 HB2 PRO 73 HB2 PRO 73 -8.117 9.484 0.136
567 HB3 PRO 73 HB3 PRO 73 -9.627 8.554 0.372
568 HG2 PRO 73 HG2 PRO 73 -7.021 8.274 1.908
569 HG3 PRO 73 HG3 PRO 73 -8.676 8.465 2.571
570 HD2 PRO 73 HD2 PRO 73 -7.471 6.017 2.263
571 HD3 PRO 73 HD3 PRO 73 -9.235 6.244 2.066
572 H ASN 74 H ASN 74 -7.283 8.846 -2.498
573 HA ASN 74 HA ASN 74 -4.372 8.453 -2.305
574 HB2 ASN 74 HB2 ASN 74 -5.158 9.115 -4.457
575 HB3 ASN 74 HB3 ASN 74 -6.231 10.341 -3.793
576 HD21 ASN 74 HD21 ASN 74 -2.856 9.693 -4.732
577 HD22 ASN 74 HD22 ASN 74 -2.398 11.377 -4.591
578 H MET 75 H MET 75 -2.954 9.681 -1.124
579 HA MET 75 HA MET 75 -4.145 11.583 0.873
580 HB2 MET 75 HB2 MET 75 -1.913 9.579 1.313
581 HB3 MET 75 HB3 MET 75 -2.548 10.728 2.500
582 HG2 MET 75 HG2 MET 75 -4.812 9.644 2.241
583 HG3 MET 75 HG3 MET 75 -4.059 8.438 1.200
584 HE1 MET 75 HE1 MET 75 -3.608 8.795 5.781
585 HE2 MET 75 HE2 MET 75 -3.079 10.123 4.723
586 HE3 MET 75 HE3 MET 75 -4.792 9.645 4.768
587 H ARG 76 H ARG 76 -2.839 12.154 -1.776
588 HA ARG 76 HA ARG 76 -1.224 13.439 -2.740
589 HB2 ARG 76 HB2 ARG 76 -2.091 15.211 -0.432
590 HB3 ARG 76 HB3 ARG 76 -1.175 15.769 -1.844
591 HG2 ARG 76 HG2 ARG 76 -2.985 14.954 -3.346
592 HG3 ARG 76 HG3 ARG 76 -3.948 14.505 -1.925
593 HD2 ARG 76 HD2 ARG 76 -4.000 16.838 -1.177
594 HD3 ARG 76 HD3 ARG 76 -2.945 17.319 -2.524
595 HE ARG 76 HE ARG 76 -5.124 16.031 -3.691
596 HH11 ARG 76 HH11 ARG 76 -4.668 18.961 -1.703
597 HH12 ARG 76 HH12 ARG 76 -6.033 19.783 -2.423
598 HH21 ARG 76 HH21 ARG 76 -6.878 17.142 -4.596
599 HH22 ARG 76 HH22 ARG 76 -7.281 18.757 -4.057
600 H LEU 77 H LEU 77 0.092 11.538 -1.606
601 HA LEU 77 HA LEU 77 2.308 12.478 0.078
602 HB2 LEU 77 HB2 LEU 77 1.880 9.847 -1.380
603 HB3 LEU 77 HB3 LEU 77 3.101 10.165 -0.144
604 HG LEU 77 HG LEU 77 0.082 10.107 0.271
605 HD11 LEU 77 HD11 LEU 77 0.519 8.072 1.558
606 HD12 LEU 77 HD12 LEU 77 2.254 8.176 1.178
607 HD13 LEU 77 HD13 LEU 77 1.063 7.886 -0.115
608 HD21 LEU 77 HD21 LEU 77 2.336 10.477 2.291
609 HD22 LEU 77 HD22 LEU 77 0.626 10.195 2.693
610 HD23 LEU 77 HD23 LEU 77 1.093 11.674 1.849
611 H GLY 78 H GLY 78 4.316 13.045 -0.587
612 HA2 GLY 78 HA2 GLY 78 4.715 13.804 -3.340
613 HA3 GLY 78 HA3 GLY 78 5.890 13.930 -2.051
614 H ASP 79 H ASP 79 6.661 13.289 -4.585
615 HA ASP 79 HA ASP 79 6.478 10.553 -5.321
616 HB2 ASP 79 HB2 ASP 79 6.757 12.513 -6.817
617 HB3 ASP 79 HB3 ASP 79 8.407 12.721 -6.218
618 H ALA 80 H ALA 80 8.769 12.083 -3.201
619 HA ALA 80 HA ALA 80 10.489 9.641 -3.116
620 HB1 ALA 80 HB1 ALA 80 11.021 12.455 -2.085
621 HB2 ALA 80 HB2 ALA 80 12.137 11.071 -2.012
622 HB3 ALA 80 HB3 ALA 80 11.670 11.743 -3.582
623 H GLU 81 H GLU 81 8.155 11.559 -1.259
624 HA GLU 81 HA GLU 81 8.561 10.370 1.311
625 HB2 GLU 81 HB2 GLU 81 7.535 12.461 1.177
626 HB3 GLU 81 HB3 GLU 81 6.466 11.988 -0.146
627 HG2 GLU 81 HG2 GLU 81 5.096 10.687 1.279
628 HG3 GLU 81 HG3 GLU 81 6.225 10.884 2.637
629 H VAL 82 H VAL 82 6.360 9.547 -1.439
630 HA VAL 82 HA VAL 82 5.301 7.115 -0.310
631 HB VAL 82 HB VAL 82 5.870 7.874 -3.212
632 HG11 VAL 82 HG11 VAL 82 4.262 6.053 -3.802
633 HG12 VAL 82 HG12 VAL 82 5.748 5.426 -3.101
634 HG13 VAL 82 HG13 VAL 82 4.275 5.518 -2.108
635 HG21 VAL 82 HG21 VAL 82 4.150 9.268 -2.118
636 HG22 VAL 82 HG22 VAL 82 3.427 8.218 -3.333
637 HG23 VAL 82 HG23 VAL 82 3.275 7.804 -1.609
638 H SER 83 H SER 83 8.214 7.705 -2.307
639 HA SER 83 HA SER 83 9.057 5.022 -2.549
640 HB2 SER 83 HB2 SER 83 9.848 7.345 -3.611
641 HB3 SER 83 HB3 SER 83 11.047 7.305 -2.313
642 HG SER 83 HG SER 83 10.550 5.429 -4.389
643 H ALA 84 H ALA 84 9.932 7.387 0.041
644 HA ALA 84 HA ALA 84 11.663 5.631 1.483
645 HB1 ALA 84 HB1 ALA 84 11.517 8.090 1.765
646 HB2 ALA 84 HB2 ALA 84 9.907 7.914 2.490
647 HB3 ALA 84 HB3 ALA 84 11.342 7.224 3.292
648 H LEU 85 H LEU 85 8.143 5.877 1.429
649 HA LEU 85 HA LEU 85 7.713 4.133 3.735
650 HB2 LEU 85 HB2 LEU 85 6.273 6.028 3.191
651 HB3 LEU 85 HB3 LEU 85 5.872 5.332 1.635
652 HG LEU 85 HG LEU 85 4.602 3.538 2.659
653 HD11 LEU 85 HD11 LEU 85 5.268 4.800 5.348
654 HD12 LEU 85 HD12 LEU 85 5.879 3.222 4.784
655 HD13 LEU 85 HD13 LEU 85 4.152 3.461 5.059
656 HD21 LEU 85 HD21 LEU 85 2.889 5.055 3.826
657 HD22 LEU 85 HD22 LEU 85 3.429 5.612 2.223
658 HD23 LEU 85 HD23 LEU 85 4.064 6.353 3.695
659 H ILE 86 H ILE 86 7.964 3.706 0.223
660 HA ILE 86 HA ILE 86 7.253 0.888 0.179
661 HB ILE 86 HB ILE 86 9.219 2.326 -1.622
662 HG12 ILE 86 HG12 ILE 86 7.229 3.531 -1.952
663 HG13 ILE 86 HG13 ILE 86 7.305 2.394 -3.252
664 HG21 ILE 86 HG21 ILE 86 7.685 -0.285 -1.945
665 HG22 ILE 86 HG22 ILE 86 8.644 0.515 -3.208
666 HG23 ILE 86 HG23 ILE 86 9.440 -0.091 -1.759
667 HD11 ILE 86 HD11 ILE 86 5.526 2.227 -0.774
668 HD12 ILE 86 HD12 ILE 86 5.030 2.517 -2.449
669 HD13 ILE 86 HD13 ILE 86 5.653 0.922 -1.974
670 H SER 87 H SER 87 10.409 2.609 0.505
671 HA SER 87 HA SER 87 11.885 0.261 1.207
672 HB2 SER 87 HB2 SER 87 12.462 3.212 1.483
673 HB3 SER 87 HB3 SER 87 13.601 1.964 2.035
674 HG SER 87 HG SER 87 14.065 1.456 0.082
675 H TYR 88 H TYR 88 9.670 2.002 3.305
676 HA TYR 88 HA TYR 88 10.891 0.929 5.733
677 HB2 TYR 88 HB2 TYR 88 9.328 2.686 5.975
678 HB3 TYR 88 HB3 TYR 88 8.068 1.802 5.112
679 HD1 TYR 88 HD2 TYR 88 10.399 0.848 7.946
680 HD2 TYR 88 HD1 TYR 88 6.320 1.367 6.627
681 HE1 TYR 88 HE2 TYR 88 9.591 -0.215 10.028
682 HE2 TYR 88 HE1 TYR 88 5.514 0.361 8.755
683 HH TYR 88 HH TYR 88 6.111 -0.521 10.769
684 H LEU 89 H LEU 89 8.343 -0.272 3.517
685 HA LEU 89 HA LEU 89 7.984 -2.807 4.845
686 HB2 LEU 89 HB2 LEU 89 7.210 -1.623 2.159
687 HB3 LEU 89 HB3 LEU 89 7.001 -3.340 2.456
688 HG LEU 89 HG LEU 89 5.482 -2.953 4.297
689 HD11 LEU 89 HD11 LEU 89 4.575 -0.692 4.785
690 HD12 LEU 89 HD12 LEU 89 5.827 0.023 3.746
691 HD13 LEU 89 HD13 LEU 89 6.273 -0.838 5.240
692 HD21 LEU 89 HD21 LEU 89 4.771 -1.278 1.846
693 HD22 LEU 89 HD22 LEU 89 3.621 -1.998 3.002
694 HD23 LEU 89 HD23 LEU 89 4.614 -3.046 1.982
695 H GLU 90 H GLU 90 9.995 -1.849 2.025
696 HA GLU 90 HA GLU 90 10.886 -4.460 1.339
697 HB2 GLU 90 HB2 GLU 90 11.230 -1.984 0.266
698 HB3 GLU 90 HB3 GLU 90 12.822 -2.204 0.969
699 HG2 GLU 90 HG2 GLU 90 11.399 -4.005 -1.034
700 HG3 GLU 90 HG3 GLU 90 12.724 -2.904 -1.383
701 H GLU 91 H GLU 91 12.473 -2.061 3.523
702 HA GLU 91 HA GLU 91 14.591 -3.954 4.120
703 HB2 GLU 91 HB2 GLU 91 14.026 -1.288 5.404
704 HB3 GLU 91 HB3 GLU 91 15.505 -2.232 5.531
705 HG2 GLU 91 HG2 GLU 91 14.405 -0.892 3.020
706 HG3 GLU 91 HG3 GLU 91 15.777 -0.369 3.982
707 H GLU 92 H GLU 92 11.555 -3.097 5.824
708 HA GLU 92 HA GLU 92 12.193 -4.553 8.252
709 HB2 GLU 92 HB2 GLU 92 10.309 -2.957 8.113
710 HB3 GLU 92 HB3 GLU 92 9.558 -3.941 6.873
711 HG2 GLU 92 HG2 GLU 92 8.351 -4.317 8.848
712 HG3 GLU 92 HG3 GLU 92 9.246 -5.784 8.521
713 H THR 93 H THR 93 10.784 -5.517 5.117
714 HA THR 93 HA THR 93 10.423 -8.325 5.776
715 HB THR 93 HB THR 93 10.728 -6.937 3.082
716 HG1 THR 93 HG1 THR 93 8.989 -6.144 3.966
717 HG21 THR 93 HG21 THR 93 9.438 -8.884 2.220
718 HG22 THR 93 HG22 THR 93 9.667 -9.697 3.795
719 HG23 THR 93 HG23 THR 93 11.064 -9.306 2.765
720 H ALA 94 H ALA 94 13.111 -6.459 4.339
721 HA ALA 94 HA ALA 94 14.791 -8.708 3.775
722 HB1 ALA 94 HB1 ALA 94 16.554 -7.045 3.593
723 HB2 ALA 94 HB2 ALA 94 15.085 -6.410 2.833
724 HB3 ALA 94 HB3 ALA 94 15.590 -5.848 4.451
725 H ARG 95 H ARG 95 14.522 -6.614 6.680
726 HA ARG 95 HA ARG 95 16.578 -7.938 8.175
727 HB2 ARG 95 HB2 ARG 95 14.320 -6.071 8.946
728 HB3 ARG 95 HB3 ARG 95 15.469 -6.721 10.127
729 HG2 ARG 95 HG2 ARG 95 17.350 -5.700 9.065
730 HG3 ARG 95 HG3 ARG 95 16.428 -5.285 7.624
731 HD2 ARG 95 HD2 ARG 95 16.789 -3.286 8.955
732 HD3 ARG 95 HD3 ARG 95 15.070 -3.680 8.890
733 HE ARG 95 HE ARG 95 15.040 -4.015 11.155
734 HH11 ARG 95 HH11 ARG 95 18.472 -3.941 10.170
735 HH12 ARG 95 HH12 ARG 95 19.043 -3.889 11.823
736 HH21 ARG 95 HH21 ARG 95 15.824 -3.942 13.260
737 HH22 ARG 95 HH22 ARG 95 17.544 -3.888 13.572
738 H LEU 96 H LEU 96 13.037 -8.165 8.493
739 HA LEU 96 HA LEU 96 11.597 -9.585 9.376
740 HB2 LEU 96 HB2 LEU 96 13.008 -10.933 7.543
741 HB3 LEU 96 HB3 LEU 96 13.366 -11.950 8.879
742 HG LEU 96 HG LEU 96 11.656 -12.901 7.596
743 HD11 LEU 96 HD11 LEU 96 9.901 -13.218 9.172
744 HD12 LEU 96 HD12 LEU 96 10.246 -11.659 9.953
745 HD13 LEU 96 HD13 LEU 96 11.427 -12.995 10.064
746 HD21 LEU 96 HD21 LEU 96 10.139 -10.301 7.921
747 HD22 LEU 96 HD22 LEU 96 9.544 -11.768 7.102
748 HD23 LEU 96 HD23 LEU 96 10.954 -10.884 6.461
749 H GLN 97 H GLN 97 14.758 -10.096 10.877
750 HA GLN 97 HA GLN 97 13.687 -11.383 13.257
751 HB2 GLN 97 HB2 GLN 97 16.430 -10.404 12.424
752 HB3 GLN 97 HB3 GLN 97 16.122 -11.161 13.990
753 HG2 GLN 97 HG2 GLN 97 15.346 -13.222 12.947
754 HG3 GLN 97 HG3 GLN 97 15.444 -12.507 11.340
755 HE21 GLN 97 HE21 GLN 97 16.751 -14.728 11.246
756 HE22 GLN 97 HE22 GLN 97 18.473 -14.372 11.252
757 H THR 98 H THR 98 12.257 -9.090 12.930
758 HA THR 98 HA THR 98 13.182 -7.155 15.029
759 HB THR 98 HB THR 98 12.100 -5.406 13.659
760 HG1 THR 98 HG1 THR 98 11.563 -5.851 11.548
761 HG21 THR 98 HG21 THR 98 14.531 -5.838 13.423
762 HG22 THR 98 HG22 THR 98 13.791 -5.270 11.911
763 HG23 THR 98 HG23 THR 98 14.198 -6.986 12.107
764 HA PRO 99 HA PRO 99 8.887 -8.715 16.006
765 HB2 PRO 99 HB2 PRO 99 9.242 -10.220 18.220
766 HB3 PRO 99 HB3 PRO 99 9.803 -10.784 16.625
767 HG2 PRO 99 HG2 PRO 99 11.447 -9.333 18.744
768 HG3 PRO 99 HG3 PRO 99 11.809 -10.910 17.965
769 HD2 PRO 99 HD2 PRO 99 12.841 -8.561 17.016
770 HD3 PRO 99 HD3 PRO 99 12.354 -9.898 15.934
771 H VAL 100 H VAL 100 9.547 -6.100 16.370
772 HA VAL 100 HA VAL 100 9.385 -5.436 19.266
773 HB VAL 100 HB VAL 100 11.508 -5.056 17.992
774 HG11 VAL 100 HG11 VAL 100 11.755 -3.111 16.570
775 HG12 VAL 100 HG12 VAL 100 10.542 -4.189 15.867
776 HG13 VAL 100 HG13 VAL 100 10.039 -2.711 16.716
777 HG21 VAL 100 HG21 VAL 100 12.015 -2.931 19.043
778 HG22 VAL 100 HG22 VAL 100 10.294 -2.552 19.231
779 HG23 VAL 100 HG23 VAL 100 11.014 -3.906 20.127
780 H THR 101 H THR 101 8.134 -3.731 20.095
781 HA THR 101 HA THR 101 5.739 -2.957 18.695
782 HB THR 101 HB THR 101 5.482 -1.258 20.513
783 HG1 THR 101 HG1 THR 101 7.003 -0.918 21.915
784 HG21 THR 101 HG21 THR 101 6.185 -4.038 21.525
785 HG22 THR 101 HG22 THR 101 4.619 -3.551 20.838
786 HG23 THR 101 HG23 THR 101 5.188 -2.832 22.357
787 H ASN 102 H ASN 102 8.567 -0.970 19.610
788 HA ASN 102 HA ASN 102 8.722 0.248 16.969
789 HB2 ASN 102 HB2 ASN 102 7.018 1.714 17.978
790 HB3 ASN 102 HB3 ASN 102 8.035 1.960 19.406
791 HD21 ASN 102 HD21 ASN 102 7.748 2.647 15.902
792 HD22 ASN 102 HD22 ASN 102 8.885 3.997 15.972
793 H ARG 103 H ARG 103 10.797 0.819 16.537
794 HA ARG 103 HA ARG 103 12.851 -0.095 18.282
795 HB2 ARG 103 HB2 ARG 103 14.321 0.239 16.435
796 HB3 ARG 103 HB3 ARG 103 12.781 -0.374 15.830
797 HG2 ARG 103 HG2 ARG 103 12.151 2.011 15.223
798 HG3 ARG 103 HG3 ARG 103 13.783 2.501 15.718
799 HD2 ARG 103 HD2 ARG 103 14.711 0.891 14.012
800 HD3 ARG 103 HD3 ARG 103 13.052 0.587 13.468
801 HE ARG 103 HE ARG 103 14.153 3.358 13.535
802 HH11 ARG 103 HH11 ARG 103 12.888 0.697 11.521
803 HH12 ARG 103 HH12 ARG 103 12.726 1.720 10.112
804 HH21 ARG 103 HH21 ARG 103 13.915 4.627 11.721
805 HH22 ARG 103 HH22 ARG 103 13.307 3.951 10.225
806 H GLY 104 H GLY 104 11.517 3.018 18.310
807 HA2 GLY 104 HA2 GLY 104 12.118 4.969 19.385
808 HA3 GLY 104 HA3 GLY 104 13.603 4.211 19.959
809 H ILE 105 H ILE 105 12.476 6.691 18.086
810 HA ILE 105 HA ILE 105 14.562 6.458 15.982
811 HB ILE 105 HB ILE 105 13.000 7.065 14.282
812 HG12 ILE 105 HG12 ILE 105 11.240 8.300 15.349
813 HG13 ILE 105 HG13 ILE 105 10.591 6.933 14.475
814 HG21 ILE 105 HG21 ILE 105 13.523 4.729 14.716
815 HG22 ILE 105 HG22 ILE 105 12.094 4.574 15.756
816 HG23 ILE 105 HG23 ILE 105 11.908 4.927 14.025
817 HD11 ILE 105 HD11 ILE 105 10.789 7.201 17.490
818 HD12 ILE 105 HD12 ILE 105 9.340 7.184 16.487
819 HD13 ILE 105 HD13 ILE 105 10.301 5.705 16.654
820 HA PRO 106 HA PRO 106 14.980 10.881 16.690
821 HB2 PRO 106 HB2 PRO 106 16.970 11.455 14.945
822 HB3 PRO 106 HB3 PRO 106 17.238 10.470 16.413
823 HG2 PRO 106 HG2 PRO 106 16.795 9.488 13.577
824 HG3 PRO 106 HG3 PRO 106 18.049 8.973 14.747
825 HD2 PRO 106 HD2 PRO 106 15.674 7.624 14.360
826 HD3 PRO 106 HD3 PRO 106 16.537 7.647 15.927
827 HHA HEC 107 HHA HEC 107 -4.369 -3.300 0.362
828 HHB HEC 107 HHB HEC 107 0.533 0.613 1.669
829 HHC HEC 107 HHC HEC 107 -3.524 4.599 4.811
830 HHD HEC 107 HHD HEC 107 -8.206 0.172 4.189
831 HMA1 HEC 107 HMA1 HEC 107 0.828 -1.235 -0.781
832 HMA2 HEC 107 HMA2 HEC 107 1.366 -1.349 0.914
833 HMA3 HEC 107 HMA3 HEC 107 0.853 -2.796 0.065
834 HAA1 HEC 107 HAA1 HEC 107 -2.757 -3.578 -1.211
835 HAA2 HEC 107 HAA2 HEC 107 -1.047 -3.330 -1.448
836 HBA1 HEC 107 HBA1 HEC 107 -0.498 -4.851 0.379
837 HBA2 HEC 107 HBA2 HEC 107 -2.194 -4.941 0.853
838 HMB1 HEC 107 HMB1 HEC 107 1.657 2.970 4.053
839 HMB2 HEC 107 HMB2 HEC 107 1.730 2.135 2.513
840 HMB3 HEC 107 HMB3 HEC 107 1.484 3.866 2.539
841 HAB HEC 107 HAB HEC 107 -1.649 5.423 4.866
842 HBB1 HEC 107 HBB1 HEC 107 0.615 5.868 2.953
843 HBB2 HEC 107 HBB2 HEC 107 -1.104 6.163 2.595
844 HBB3 HEC 107 HBB3 HEC 107 -0.295 7.051 3.899
845 HMC1 HEC 107 HMC1 HEC 107 -6.334 5.466 5.521
846 HMC2 HEC 107 HMC2 HEC 107 -6.599 4.496 6.979
847 HMC3 HEC 107 HMC3 HEC 107 -4.969 4.890 6.498
848 HAC HEC 107 HAC HEC 107 -8.749 1.476 5.668
849 HBC1 HEC 107 HBC1 HEC 107 -9.243 3.680 4.683
850 HBC2 HEC 107 HBC2 HEC 107 -10.079 3.329 6.209
851 HBC3 HEC 107 HBC3 HEC 107 -8.710 4.441 6.195
852 HMD1 HEC 107 HMD1 HEC 107 -9.493 -1.244 3.044
853 HMD2 HEC 107 HMD2 HEC 107 -9.435 -2.477 1.797
854 HMD3 HEC 107 HMD3 HEC 107 -8.982 -2.902 3.454
855 HAD1 HEC 107 HAD1 HEC 107 -8.001 -4.056 0.888
856 HAD2 HEC 107 HAD2 HEC 107 -6.428 -4.057 0.134
857 HBD1 HEC 107 HBD1 HEC 107 -7.289 -5.259 2.742
858 HBD2 HEC 107 HBD2 HEC 107 -6.238 -5.917 1.482
Start of MODEL 13
1 H SER 1 H SER 1 13.378 6.834 8.026
2 HA SER 1 HA SER 1 10.981 7.427 9.469
3 HB2 SER 1 HB2 SER 1 12.278 8.975 7.217
4 HB3 SER 1 HB3 SER 1 10.964 9.550 8.262
5 HG SER 1 HG SER 1 12.511 10.143 9.529
6 H GLY 2 H GLY 2 11.243 5.660 6.501
7 HA2 GLY 2 HA2 GLY 2 8.642 6.119 5.395
8 HA3 GLY 2 HA3 GLY 2 9.534 4.614 5.376
9 H GLU 3 H GLU 3 9.650 4.363 8.356
10 HA GLU 3 HA GLU 3 7.022 3.232 8.916
11 HB2 GLU 3 HB2 GLU 3 9.006 2.219 9.793
12 HB3 GLU 3 HB3 GLU 3 9.510 3.686 10.591
13 HG2 GLU 3 HG2 GLU 3 6.916 2.283 11.324
14 HG3 GLU 3 HG3 GLU 3 8.472 1.777 11.978
15 H GLN 4 H GLN 4 8.600 6.337 9.648
16 HA GLN 4 HA GLN 4 6.530 7.246 11.487
17 HB2 GLN 4 HB2 GLN 4 8.592 8.834 9.908
18 HB3 GLN 4 HB3 GLN 4 7.592 9.462 11.205
19 HG2 GLN 4 HG2 GLN 4 9.596 7.190 11.616
20 HG3 GLN 4 HG3 GLN 4 9.990 8.891 11.802
21 HE21 GLN 4 HE21 GLN 4 8.286 6.158 13.326
22 HE22 GLN 4 HE22 GLN 4 7.918 7.064 14.791
23 H ILE 5 H ILE 5 7.109 7.547 7.962
24 HA ILE 5 HA ILE 5 4.728 9.050 7.366
25 HB ILE 5 HB ILE 5 6.225 7.057 5.621
26 HG12 ILE 5 HG12 ILE 5 6.292 10.108 5.575
27 HG13 ILE 5 HG13 ILE 5 7.505 9.123 6.389
28 HG21 ILE 5 HG21 ILE 5 3.879 7.369 4.820
29 HG22 ILE 5 HG22 ILE 5 4.063 9.128 4.920
30 HG23 ILE 5 HG23 ILE 5 4.988 8.182 3.733
31 HD11 ILE 5 HD11 ILE 5 8.377 9.757 4.254
32 HD12 ILE 5 HD12 ILE 5 8.050 8.014 4.216
33 HD13 ILE 5 HD13 ILE 5 6.952 9.152 3.406
34 H PHE 6 H PHE 6 5.282 5.443 7.432
35 HA PHE 6 HA PHE 6 2.597 4.769 6.873
36 HB2 PHE 6 HB2 PHE 6 4.603 3.207 6.969
37 HB3 PHE 6 HB3 PHE 6 4.422 3.184 8.717
38 HD1 PHE 6 HD2 PHE 6 2.204 2.309 9.715
39 HD2 PHE 6 HD1 PHE 6 3.229 1.844 5.556
40 HE1 PHE 6 HE2 PHE 6 0.439 0.591 9.477
41 HE2 PHE 6 HE1 PHE 6 1.472 0.113 5.319
42 HZ PHE 6 HZ PHE 6 0.069 -0.519 7.280
43 H ARG 7 H ARG 7 4.074 5.436 10.107
44 HA ARG 7 HA ARG 7 1.675 4.946 11.532
45 HB2 ARG 7 HB2 ARG 7 4.042 5.101 12.415
46 HB3 ARG 7 HB3 ARG 7 3.862 6.867 12.400
47 HG2 ARG 7 HG2 ARG 7 1.927 6.676 13.939
48 HG3 ARG 7 HG3 ARG 7 1.992 4.909 13.814
49 HD2 ARG 7 HD2 ARG 7 4.356 5.041 14.791
50 HD3 ARG 7 HD3 ARG 7 4.034 6.747 15.118
51 HE ARG 7 HE ARG 7 2.544 6.160 16.812
52 HH11 ARG 7 HH11 ARG 7 3.549 3.200 15.086
53 HH12 ARG 7 HH12 ARG 7 2.770 2.140 16.239
54 HH21 ARG 7 HH21 ARG 7 1.532 4.733 18.271
55 HH22 ARG 7 HH22 ARG 7 1.617 3.005 18.018
56 H THR 8 H THR 8 2.838 7.955 9.998
57 HA THR 8 HA THR 8 0.559 9.477 11.066
58 HB THR 8 HB THR 8 1.487 11.369 9.657
59 HG1 THR 8 HG1 THR 8 3.745 9.675 9.438
60 HG21 THR 8 HG21 THR 8 3.451 11.736 11.119
61 HG22 THR 8 HG22 THR 8 3.328 10.054 11.680
62 HG23 THR 8 HG23 THR 8 2.027 11.206 12.026
63 H ARG 9 H ARG 9 1.090 7.756 8.084
64 HA ARG 9 HA ARG 9 -1.392 9.026 6.966
65 HB2 ARG 9 HB2 ARG 9 1.004 7.815 5.543
66 HB3 ARG 9 HB3 ARG 9 -0.421 8.475 4.752
67 HG2 ARG 9 HG2 ARG 9 1.493 10.090 6.496
68 HG3 ARG 9 HG3 ARG 9 1.497 10.035 4.736
69 HD2 ARG 9 HD2 ARG 9 -0.807 10.950 4.684
70 HD3 ARG 9 HD3 ARG 9 -0.814 11.035 6.454
71 HE ARG 9 HE ARG 9 1.458 12.432 5.530
72 HH11 ARG 9 HH11 ARG 9 -2.094 12.763 5.451
73 HH12 ARG 9 HH12 ARG 9 -2.035 14.510 5.406
74 HH21 ARG 9 HH21 ARG 9 1.482 14.707 5.486
75 HH22 ARG 9 HH22 ARG 9 -0.016 15.606 5.405
76 H CYS 10 H CYS 10 -0.134 5.930 7.929
77 HA CYS 10 HA CYS 10 -2.199 4.539 6.295
78 HB2 CYS 10 HB2 CYS 10 0.586 3.568 6.884
79 HB3 CYS 10 HB3 CYS 10 -0.561 2.871 5.760
80 H SER 11 H SER 11 -1.538 4.967 9.533
81 HA SER 11 HA SER 11 -1.583 2.157 10.321
82 HB2 SER 11 HB2 SER 11 -0.430 4.315 11.397
83 HB3 SER 11 HB3 SER 11 -1.920 4.315 12.356
84 HG SER 11 HG SER 11 0.244 2.664 12.397
85 H SER 12 H SER 12 -2.979 1.929 12.541
86 HA SER 12 HA SER 12 -4.889 1.111 13.359
87 HB2 SER 12 HB2 SER 12 -5.828 3.834 12.462
88 HB3 SER 12 HB3 SER 12 -6.837 2.737 13.422
89 HG SER 12 HG SER 12 -5.204 2.642 14.978
90 H CYS 13 H CYS 13 -5.341 1.674 9.916
91 HA CYS 13 HA CYS 13 -7.717 -0.091 9.888
92 HB2 CYS 13 HB2 CYS 13 -6.012 0.909 7.597
93 HB3 CYS 13 HB3 CYS 13 -7.592 0.123 7.485
94 H HIS 14 H HIS 14 -4.244 -0.330 9.415
95 HA HIS 14 HA HIS 14 -4.241 -3.236 9.611
96 HB2 HIS 14 2HB HIS 14 -2.634 -3.326 7.544
97 HB3 HIS 14 3HB HIS 14 -4.378 -3.349 7.324
98 HD1 HIS 14 1HD HIS 14 -2.384 -0.036 7.772
99 HD2 HIS 14 2HD HIS 14 -4.449 -2.429 5.024
100 HE1 HIS 14 1HE HIS 14 -2.618 1.384 5.707
101 H THR 15 H THR 15 -2.000 -4.012 9.445
102 HA THR 15 HA THR 15 0.111 -2.212 10.515
103 HB THR 15 HB THR 15 0.725 -3.903 12.282
104 HG1 THR 15 HG1 THR 15 -0.382 -5.626 12.400
105 HG21 THR 15 HG21 THR 15 -1.966 -2.545 12.683
106 HG22 THR 15 HG22 THR 15 -0.375 -1.790 12.901
107 HG23 THR 15 HG23 THR 15 -0.871 -3.127 13.954
108 H VAL 16 H VAL 16 2.250 -3.323 10.582
109 HA VAL 16 HA VAL 16 2.474 -5.328 8.356
110 HB VAL 16 HB VAL 16 4.395 -3.031 8.859
111 HG11 VAL 16 HG11 VAL 16 5.246 -4.990 7.565
112 HG12 VAL 16 HG12 VAL 16 3.888 -4.811 6.426
113 HG13 VAL 16 HG13 VAL 16 5.119 -3.538 6.574
114 HG21 VAL 16 HG21 VAL 16 1.889 -3.142 7.129
115 HG22 VAL 16 HG22 VAL 16 2.385 -1.905 8.288
116 HG23 VAL 16 HG23 VAL 16 3.257 -2.050 6.765
117 H GLY 17 H GLY 17 2.302 -6.824 10.139
118 HA2 GLY 17 HA2 GLY 17 3.194 -8.325 11.653
119 HA3 GLY 17 HA3 GLY 17 4.799 -7.774 11.193
120 H ASN 18 H ASN 18 3.079 -5.118 12.359
121 HA ASN 18 HA ASN 18 4.809 -4.939 14.656
122 HB2 ASN 18 HB2 ASN 18 2.409 -3.150 14.282
123 HB3 ASN 18 HB3 ASN 18 3.992 -2.758 14.942
124 HD21 ASN 18 HD21 ASN 18 5.852 -3.097 13.088
125 HD22 ASN 18 HD22 ASN 18 5.384 -2.427 11.546
126 H THR 19 H THR 19 1.457 -5.929 14.310
127 HA THR 19 HA THR 19 -0.163 -6.590 15.789
128 HB THR 19 HB THR 19 2.158 -8.094 17.014
129 HG1 THR 19 HG1 THR 19 2.146 -9.337 15.289
130 HG21 THR 19 HG21 THR 19 -0.708 -8.942 16.333
131 HG22 THR 19 HG22 THR 19 -0.111 -8.610 17.971
132 HG23 THR 19 HG23 THR 19 0.550 -9.966 17.058
133 H GLU 20 H GLU 20 0.338 -4.104 16.532
134 HA GLU 20 HA GLU 20 1.446 -3.727 19.096
135 HB2 GLU 20 HB2 GLU 20 -0.352 -1.979 17.378
136 HB3 GLU 20 HB3 GLU 20 0.315 -1.438 18.918
137 HG2 GLU 20 HG2 GLU 20 2.620 -1.886 18.047
138 HG3 GLU 20 HG3 GLU 20 1.912 -2.295 16.479
139 HA PRO 21 HA PRO 21 -1.912 -4.200 22.071
140 HB2 PRO 21 HB2 PRO 21 -0.965 -1.518 23.101
141 HB3 PRO 21 HB3 PRO 21 -1.307 -3.022 24.013
142 HG2 PRO 21 HG2 PRO 21 1.249 -2.324 23.491
143 HG3 PRO 21 HG3 PRO 21 0.719 -4.028 23.297
144 HD2 PRO 21 HD2 PRO 21 1.056 -1.894 21.173
145 HD3 PRO 21 HD3 PRO 21 1.607 -3.599 21.174
146 H GLY 22 H GLY 22 -1.489 -1.130 20.333
147 HA2 GLY 22 HA2 GLY 22 -4.414 -0.614 20.175
148 HA3 GLY 22 HA3 GLY 22 -3.115 0.274 19.361
149 H GLN 23 H GLN 23 -5.106 -2.646 19.284
150 HA GLN 23 HA GLN 23 -3.815 -3.772 16.952
151 HB2 GLN 23 HB2 GLN 23 -5.438 -5.483 17.016
152 HB3 GLN 23 HB3 GLN 23 -4.920 -5.171 18.663
153 HG2 GLN 23 HG2 GLN 23 -7.545 -4.136 17.488
154 HG3 GLN 23 HG3 GLN 23 -7.368 -5.656 18.336
155 HE21 GLN 23 HE21 GLN 23 -7.571 -5.660 20.575
156 HE22 GLN 23 HE22 GLN 23 -7.608 -4.179 21.533
157 HA PRO 24 HA PRO 24 -5.894 -1.302 13.933
158 HB2 PRO 24 HB2 PRO 24 -5.858 -2.884 11.685
159 HB3 PRO 24 HB3 PRO 24 -4.405 -2.079 12.359
160 HG2 PRO 24 HG2 PRO 24 -5.331 -4.942 12.779
161 HG3 PRO 24 HG3 PRO 24 -3.692 -4.352 12.361
162 HD2 PRO 24 HD2 PRO 24 -4.399 -4.967 14.921
163 HD3 PRO 24 HD3 PRO 24 -3.302 -3.597 14.568
164 H GLY 25 H GLY 25 -7.982 -0.844 13.611
165 HA2 GLY 25 HA2 GLY 25 -10.015 -2.564 14.615
166 HA3 GLY 25 HA3 GLY 25 -10.253 -1.007 13.816
167 H ILE 26 H ILE 26 -9.038 -1.938 11.270
168 HA ILE 26 HA ILE 26 -11.424 -3.323 10.188
169 HB ILE 26 HB ILE 26 -9.083 -2.143 8.668
170 HG12 ILE 26 HG12 ILE 26 -10.033 -0.301 9.877
171 HG13 ILE 26 HG13 ILE 26 -10.524 -0.194 8.200
172 HG21 ILE 26 HG21 ILE 26 -10.637 -2.127 6.773
173 HG22 ILE 26 HG22 ILE 26 -10.356 -3.764 7.357
174 HG23 ILE 26 HG23 ILE 26 -11.872 -2.934 7.754
175 HD11 ILE 26 HD11 ILE 26 -12.784 -1.044 8.796
176 HD12 ILE 26 HD12 ILE 26 -12.278 -1.196 10.495
177 HD13 ILE 26 HD13 ILE 26 -12.351 0.394 9.741
178 H GLY 27 H GLY 27 -7.856 -3.786 10.011
179 HA2 GLY 27 HA2 GLY 27 -7.427 -5.551 11.638
180 HA3 GLY 27 HA3 GLY 27 -8.492 -6.610 10.760
181 HA PRO 28 HA PRO 28 -5.452 -8.289 8.330
182 HB2 PRO 28 HB2 PRO 28 -4.746 -7.374 5.855
183 HB3 PRO 28 HB3 PRO 28 -6.382 -7.969 6.268
184 HG2 PRO 28 HG2 PRO 28 -5.411 -5.104 6.174
185 HG3 PRO 28 HG3 PRO 28 -6.904 -5.791 5.459
186 HD2 PRO 28 HD2 PRO 28 -6.873 -4.508 7.875
187 HD3 PRO 28 HD3 PRO 28 -7.978 -5.873 7.549
188 H ASP 29 H ASP 29 -3.231 -8.733 7.604
189 HA ASP 29 HA ASP 29 -1.257 -6.722 8.589
190 HB2 ASP 29 HB2 ASP 29 -1.504 -8.797 9.955
191 HB3 ASP 29 HB3 ASP 29 -0.926 -9.730 8.570
192 H LEU 30 H LEU 30 0.350 -6.078 7.312
193 HA LEU 30 HA LEU 30 0.326 -7.030 4.489
194 HB2 LEU 30 HB2 LEU 30 1.647 -4.484 5.344
195 HB3 LEU 30 HB3 LEU 30 0.906 -4.895 3.809
196 HG LEU 30 HG LEU 30 -0.542 -4.239 6.409
197 HD11 LEU 30 HD11 LEU 30 0.587 -2.322 5.304
198 HD12 LEU 30 HD12 LEU 30 -1.171 -2.167 5.240
199 HD13 LEU 30 HD13 LEU 30 -0.272 -2.683 3.791
200 HD21 LEU 30 HD21 LEU 30 -1.686 -4.695 3.595
201 HD22 LEU 30 HD22 LEU 30 -2.608 -4.176 5.033
202 HD23 LEU 30 HD23 LEU 30 -1.897 -5.788 4.969
203 H LEU 31 H LEU 31 2.274 -7.787 7.067
204 HA LEU 31 HA LEU 31 4.879 -7.156 6.133
205 HB2 LEU 31 HB2 LEU 31 4.393 -7.883 8.356
206 HB3 LEU 31 HB3 LEU 31 4.161 -9.537 7.775
207 HG LEU 31 HG LEU 31 6.480 -9.727 7.116
208 HD11 LEU 31 HD11 LEU 31 7.059 -7.469 6.240
209 HD12 LEU 31 HD12 LEU 31 8.143 -7.900 7.548
210 HD13 LEU 31 HD13 LEU 31 6.804 -6.774 7.850
211 HD21 LEU 31 HD21 LEU 31 6.301 -8.173 9.698
212 HD22 LEU 31 HD22 LEU 31 7.535 -9.393 9.289
213 HD23 LEU 31 HD23 LEU 31 5.848 -9.890 9.537
214 H GLY 32 H GLY 32 6.225 -8.044 4.750
215 HA2 GLY 32 HA2 GLY 32 7.141 -9.395 3.102
216 HA3 GLY 32 HA3 GLY 32 5.857 -10.561 3.357
217 H VAL 33 H VAL 33 4.087 -7.780 2.730
218 HA VAL 33 HA VAL 33 3.198 -8.666 0.267
219 HB VAL 33 HB VAL 33 2.065 -7.046 1.743
220 HG11 VAL 33 HG11 VAL 33 2.431 -4.669 1.576
221 HG12 VAL 33 HG12 VAL 33 3.951 -5.418 2.073
222 HG13 VAL 33 HG13 VAL 33 3.734 -4.881 0.391
223 HG21 VAL 33 HG21 VAL 33 2.221 -6.151 -1.156
224 HG22 VAL 33 HG22 VAL 33 1.236 -7.492 -0.518
225 HG23 VAL 33 HG23 VAL 33 0.902 -5.837 -0.011
226 H THR 34 H THR 34 5.957 -6.501 0.745
227 HA THR 34 HA THR 34 6.442 -5.782 -2.006
228 HB THR 34 HB THR 34 8.785 -5.266 -0.938
229 HG1 THR 34 HG1 THR 34 8.443 -5.125 1.440
230 HG21 THR 34 HG21 THR 34 7.953 -3.264 0.120
231 HG22 THR 34 HG22 THR 34 6.318 -3.961 0.283
232 HG23 THR 34 HG23 THR 34 6.987 -3.576 -1.321
233 H ARG 35 H ARG 35 7.220 -8.635 -0.162
234 HA ARG 35 HA ARG 35 9.144 -9.664 -2.166
235 HB2 ARG 35 HB2 ARG 35 9.516 -9.872 0.306
236 HB3 ARG 35 HB3 ARG 35 8.080 -10.881 0.415
237 HG2 ARG 35 HG2 ARG 35 10.074 -12.234 0.473
238 HG3 ARG 35 HG3 ARG 35 9.163 -12.609 -0.987
239 HD2 ARG 35 HD2 ARG 35 10.721 -11.253 -2.337
240 HD3 ARG 35 HD3 ARG 35 11.560 -10.728 -0.863
241 HE ARG 35 HE ARG 35 11.397 -13.631 -1.429
242 HH11 ARG 35 HH11 ARG 35 13.467 -10.721 -1.411
243 HH12 ARG 35 HH12 ARG 35 14.945 -11.656 -1.460
244 HH21 ARG 35 HH21 ARG 35 13.335 -14.787 -1.497
245 HH22 ARG 35 HH22 ARG 35 14.869 -13.947 -1.536
246 H GLN 36 H GLN 36 5.781 -9.767 -1.443
247 HA GLN 36 HA GLN 36 5.289 -12.324 -2.848
248 HB2 GLN 36 HB2 GLN 36 3.496 -10.447 -1.289
249 HB3 GLN 36 HB3 GLN 36 2.999 -11.998 -1.967
250 HG2 GLN 36 HG2 GLN 36 4.410 -13.245 -0.475
251 HG3 GLN 36 HG3 GLN 36 5.240 -11.815 0.085
252 HE21 GLN 36 HE21 GLN 36 4.494 -12.784 2.299
253 HE22 GLN 36 HE22 GLN 36 2.839 -12.423 2.789
254 H ARG 37 H ARG 37 4.040 -8.937 -3.105
255 HA ARG 37 HA ARG 37 2.539 -9.509 -5.516
256 HB2 ARG 37 HB2 ARG 37 3.158 -6.899 -4.095
257 HB3 ARG 37 HB3 ARG 37 2.033 -7.050 -5.440
258 HG2 ARG 37 HG2 ARG 37 1.714 -8.437 -2.748
259 HG3 ARG 37 HG3 ARG 37 0.888 -6.967 -3.270
260 HD2 ARG 37 HD2 ARG 37 -0.161 -8.239 -5.148
261 HD3 ARG 37 HD3 ARG 37 0.616 -9.719 -4.548
262 HE ARG 37 HE ARG 37 -0.896 -8.401 -2.480
263 HH11 ARG 37 HH11 ARG 37 -1.299 -10.518 -5.320
264 HH12 ARG 37 HH12 ARG 37 -2.776 -11.229 -4.712
265 HH21 ARG 37 HH21 ARG 37 -2.820 -9.336 -1.737
266 HH22 ARG 37 HH22 ARG 37 -3.650 -10.540 -2.695
267 H ASP 38 H ASP 38 2.609 -8.296 -7.443
268 HA ASP 38 HA ASP 38 5.107 -7.987 -8.879
269 HB2 ASP 38 HB2 ASP 38 2.244 -6.992 -9.289
270 HB3 ASP 38 HB3 ASP 38 3.553 -6.586 -10.394
271 H ALA 39 H ALA 39 6.571 -6.434 -8.633
272 HA ALA 39 HA ALA 39 6.315 -4.548 -6.569
273 HB1 ALA 39 HB1 ALA 39 8.384 -5.652 -7.258
274 HB2 ALA 39 HB2 ALA 39 8.377 -4.770 -8.795
275 HB3 ALA 39 HB3 ALA 39 8.589 -3.882 -7.265
276 H ASN 40 H ASN 40 6.497 -3.773 -10.117
277 HA ASN 40 HA ASN 40 6.115 -0.945 -9.666
278 HB2 ASN 40 HB2 ASN 40 6.348 -2.754 -12.016
279 HB3 ASN 40 HB3 ASN 40 5.226 -1.429 -12.275
280 HD21 ASN 40 HD21 ASN 40 8.621 -2.235 -11.915
281 HD22 ASN 40 HD22 ASN 40 9.181 -0.586 -12.195
282 H TRP 41 H TRP 41 3.807 -3.586 -9.994
283 HA TRP 41 HA TRP 41 1.441 -1.913 -10.284
284 HB2 TRP 41 HB2 TRP 41 1.454 -4.261 -10.983
285 HB3 TRP 41 HB3 TRP 41 1.808 -4.769 -9.334
286 HD1 TRP 41 HD1 TRP 41 -1.038 -3.721 -11.574
287 HE1 TRP 41 HE1 TRP 41 -3.282 -4.023 -10.364
288 HE3 TRP 41 HE3 TRP 41 0.695 -4.856 -6.889
289 HZ2 TRP 41 HZ2 TRP 41 -4.180 -4.186 -7.608
290 HZ3 TRP 41 HZ3 TRP 41 -0.876 -4.959 -4.963
291 HH2 TRP 41 HH2 TRP 41 -3.296 -4.539 -5.307
292 H LEU 42 H LEU 42 3.025 -3.526 -7.465
293 HA LEU 42 HA LEU 42 1.175 -2.703 -5.509
294 HB2 LEU 42 HB2 LEU 42 2.837 -4.459 -5.158
295 HB3 LEU 42 HB3 LEU 42 4.155 -3.310 -5.360
296 HG LEU 42 HG LEU 42 3.465 -2.138 -3.269
297 HD11 LEU 42 HD11 LEU 42 1.085 -2.696 -3.171
298 HD12 LEU 42 HD12 LEU 42 1.905 -3.306 -1.723
299 HD13 LEU 42 HD13 LEU 42 1.465 -4.428 -3.030
300 HD21 LEU 42 HD21 LEU 42 5.177 -3.916 -3.255
301 HD22 LEU 42 HD22 LEU 42 3.920 -5.117 -2.891
302 HD23 LEU 42 HD23 LEU 42 4.280 -3.820 -1.733
303 H VAL 43 H VAL 43 4.164 -1.058 -6.571
304 HA VAL 43 HA VAL 43 3.911 1.181 -4.745
305 HB VAL 43 HB VAL 43 5.610 0.825 -7.233
306 HG11 VAL 43 HG11 VAL 43 5.796 2.849 -4.953
307 HG12 VAL 43 HG12 VAL 43 7.051 2.575 -6.185
308 HG13 VAL 43 HG13 VAL 43 5.478 3.204 -6.670
309 HG21 VAL 43 HG21 VAL 43 6.108 0.358 -4.247
310 HG22 VAL 43 HG22 VAL 43 6.125 -0.861 -5.527
311 HG23 VAL 43 HG23 VAL 43 7.383 0.367 -5.481
312 H ARG 44 H ARG 44 2.508 0.569 -7.900
313 HA ARG 44 HA ARG 44 1.482 3.308 -8.096
314 HB2 ARG 44 HB2 ARG 44 1.931 1.588 -10.031
315 HB3 ARG 44 HB3 ARG 44 0.261 1.088 -9.713
316 HG2 ARG 44 HG2 ARG 44 -0.461 3.477 -9.992
317 HG3 ARG 44 HG3 ARG 44 1.226 3.950 -10.201
318 HD2 ARG 44 HD2 ARG 44 0.759 3.821 -12.399
319 HD3 ARG 44 HD3 ARG 44 1.125 2.114 -12.170
320 HE ARG 44 HE ARG 44 -1.104 1.601 -12.527
321 HH11 ARG 44 HH11 ARG 44 -0.862 5.126 -11.966
322 HH12 ARG 44 HH12 ARG 44 -2.492 5.425 -12.520
323 HH21 ARG 44 HH21 ARG 44 -3.197 2.056 -13.245
324 HH22 ARG 44 HH22 ARG 44 -3.806 3.694 -13.241
325 H TRP 45 H TRP 45 0.036 0.144 -7.283
326 HA TRP 45 HA TRP 45 -2.584 0.997 -6.703
327 HB2 TRP 45 HB2 TRP 45 -2.191 -1.317 -6.948
328 HB3 TRP 45 HB3 TRP 45 -0.882 -1.317 -5.776
329 HD1 TRP 45 HD1 TRP 45 -1.414 -2.163 -3.510
330 HE1 TRP 45 HE1 TRP 45 -3.517 -2.561 -2.069
331 HE3 TRP 45 HE3 TRP 45 -4.928 -0.054 -6.582
332 HZ2 TRP 45 HZ2 TRP 45 -6.338 -1.950 -2.192
333 HZ3 TRP 45 HZ3 TRP 45 -7.304 0.081 -5.859
334 HH2 TRP 45 HH2 TRP 45 -8.014 -0.878 -3.679
335 H LEU 46 H LEU 46 0.121 0.687 -4.322
336 HA LEU 46 HA LEU 46 -1.612 1.493 -2.196
337 HB2 LEU 46 HB2 LEU 46 0.034 0.954 -0.838
338 HB3 LEU 46 HB3 LEU 46 0.718 0.203 -2.265
339 HG LEU 46 HG LEU 46 1.562 2.784 -0.900
340 HD11 LEU 46 HD11 LEU 46 3.082 0.241 -1.604
341 HD12 LEU 46 HD12 LEU 46 2.319 0.535 -0.027
342 HD13 LEU 46 HD13 LEU 46 3.636 1.580 -0.576
343 HD21 LEU 46 HD21 LEU 46 2.160 1.842 -3.681
344 HD22 LEU 46 HD22 LEU 46 3.480 2.575 -2.740
345 HD23 LEU 46 HD23 LEU 46 2.035 3.496 -3.054
346 H LYS 47 H LYS 47 -0.129 3.371 -4.568
347 HA LYS 47 HA LYS 47 -0.090 5.935 -3.104
348 HB2 LYS 47 HB2 LYS 47 1.727 5.385 -4.662
349 HB3 LYS 47 HB3 LYS 47 0.576 5.087 -5.949
350 HG2 LYS 47 HG2 LYS 47 -0.099 7.599 -5.710
351 HG3 LYS 47 HG3 LYS 47 1.337 7.732 -4.693
352 HD2 LYS 47 HD2 LYS 47 1.968 8.378 -6.927
353 HD3 LYS 47 HD3 LYS 47 2.669 6.779 -6.652
354 HE2 LYS 47 HE2 LYS 47 0.603 5.821 -7.843
355 HE3 LYS 47 HE3 LYS 47 0.127 7.491 -8.203
356 HZ1 LYS 47 HZ1 LYS 47 2.240 7.738 -9.402
357 HZ2 LYS 47 HZ2 LYS 47 1.343 6.516 -10.039
358 HZ3 LYS 47 HZ3 LYS 47 2.636 6.168 -9.061
359 H VAL 48 H VAL 48 -1.912 4.446 -5.833
360 HA VAL 48 HA VAL 48 -3.864 6.698 -5.621
361 HB VAL 48 HB VAL 48 -1.972 6.839 -7.343
362 HG11 VAL 48 HG11 VAL 48 -2.186 5.938 -9.471
363 HG12 VAL 48 HG12 VAL 48 -2.394 4.555 -8.377
364 HG13 VAL 48 HG13 VAL 48 -3.800 5.291 -9.170
365 HG21 VAL 48 HG21 VAL 48 -3.611 8.492 -7.200
366 HG22 VAL 48 HG22 VAL 48 -3.478 8.050 -8.910
367 HG23 VAL 48 HG23 VAL 48 -4.842 7.461 -7.935
368 HA PRO 49 HA PRO 49 -5.628 2.321 -5.862
369 HB2 PRO 49 HB2 PRO 49 -6.990 2.126 -3.476
370 HB3 PRO 49 HB3 PRO 49 -5.235 1.820 -3.625
371 HG2 PRO 49 HG2 PRO 49 -6.599 4.408 -2.794
372 HG3 PRO 49 HG3 PRO 49 -5.276 3.549 -1.954
373 HD2 PRO 49 HD2 PRO 49 -4.746 5.608 -3.597
374 HD3 PRO 49 HD3 PRO 49 -3.709 4.150 -3.594
375 H ASP 50 H ASP 50 -7.377 5.193 -4.618
376 HA ASP 50 HA ASP 50 -10.008 4.305 -5.294
377 HB2 ASP 50 HB2 ASP 50 -9.572 6.075 -3.672
378 HB3 ASP 50 HB3 ASP 50 -8.823 7.082 -4.903
379 H GLN 51 H GLN 51 -7.571 6.166 -7.159
380 HA GLN 51 HA GLN 51 -9.250 6.594 -9.443
381 HB2 GLN 51 HB2 GLN 51 -7.224 7.935 -8.888
382 HB3 GLN 51 HB3 GLN 51 -6.231 6.495 -9.204
383 HG2 GLN 51 HG2 GLN 51 -6.185 8.050 -11.082
384 HG3 GLN 51 HG3 GLN 51 -6.852 6.491 -11.542
385 HE21 GLN 51 HE21 GLN 51 -9.101 6.358 -12.109
386 HE22 GLN 51 HE22 GLN 51 -10.052 7.823 -12.388
387 H MET 52 H MET 52 -6.874 3.986 -8.598
388 HA MET 52 HA MET 52 -7.044 2.695 -11.151
389 HB2 MET 52 HB2 MET 52 -6.166 1.857 -8.354
390 HB3 MET 52 HB3 MET 52 -6.231 0.674 -9.678
391 HG2 MET 52 HG2 MET 52 -4.770 2.051 -11.035
392 HG3 MET 52 HG3 MET 52 -4.741 3.312 -9.800
393 HE1 MET 52 HE1 MET 52 -2.593 -0.787 -9.483
394 HE2 MET 52 HE2 MET 52 -4.367 -0.653 -9.489
395 HE3 MET 52 HE3 MET 52 -3.433 -0.195 -10.933
396 H LEU 53 H LEU 53 -9.099 2.415 -8.252
397 HA LEU 53 HA LEU 53 -10.774 0.326 -9.398
398 HB2 LEU 53 HB2 LEU 53 -10.699 2.041 -6.982
399 HB3 LEU 53 HB3 LEU 53 -12.340 1.815 -7.569
400 HG LEU 53 HG LEU 53 -10.499 -0.562 -7.419
401 HD11 LEU 53 HD11 LEU 53 -10.369 0.537 -5.192
402 HD12 LEU 53 HD12 LEU 53 -11.218 -1.011 -5.129
403 HD13 LEU 53 HD13 LEU 53 -12.147 0.505 -5.087
404 HD21 LEU 53 HD21 LEU 53 -13.501 -0.275 -7.018
405 HD22 LEU 53 HD22 LEU 53 -12.575 -1.782 -7.129
406 HD23 LEU 53 HD23 LEU 53 -12.724 -0.732 -8.545
407 H ALA 54 H ALA 54 -11.046 3.855 -9.211
408 HA ALA 54 HA ALA 54 -13.448 4.128 -10.679
409 HB1 ALA 54 HB1 ALA 54 -11.121 6.070 -10.447
410 HB2 ALA 54 HB2 ALA 54 -12.756 6.483 -10.974
411 HB3 ALA 54 HB3 ALA 54 -12.483 5.917 -9.315
412 H GLU 55 H GLU 55 -10.142 3.744 -11.952
413 HA GLU 55 HA GLU 55 -11.053 4.121 -14.725
414 HB2 GLU 55 HB2 GLU 55 -8.840 4.269 -15.299
415 HB3 GLU 55 HB3 GLU 55 -8.825 4.938 -13.691
416 HG2 GLU 55 HG2 GLU 55 -7.959 2.722 -12.899
417 HG3 GLU 55 HG3 GLU 55 -7.969 2.131 -14.550
418 H LYS 56 H LYS 56 -10.984 1.497 -12.615
419 HA LYS 56 HA LYS 56 -10.887 -0.754 -12.713
420 HB2 LYS 56 HB2 LYS 56 -11.840 -0.577 -15.583
421 HB3 LYS 56 HB3 LYS 56 -11.912 -1.984 -14.525
422 HG2 LYS 56 HG2 LYS 56 -13.409 0.624 -14.124
423 HG3 LYS 56 HG3 LYS 56 -14.066 -0.861 -14.791
424 HD2 LYS 56 HD2 LYS 56 -13.878 -2.044 -12.720
425 HD3 LYS 56 HD3 LYS 56 -12.975 -0.736 -11.956
426 HE2 LYS 56 HE2 LYS 56 -15.861 -0.583 -12.923
427 HE3 LYS 56 HE3 LYS 56 -15.339 -0.792 -11.245
428 HZ1 LYS 56 HZ1 LYS 56 -14.885 1.589 -12.955
429 HZ2 LYS 56 HZ2 LYS 56 -14.129 1.367 -11.506
430 HZ3 LYS 56 HZ3 LYS 56 -15.757 1.543 -11.580
431 H ASP 57 H ASP 57 -8.815 -0.750 -12.324
432 HA ASP 57 HA ASP 57 -6.865 -1.430 -14.456
433 HB2 ASP 57 HB2 ASP 57 -6.469 0.570 -12.655
434 HB3 ASP 57 HB3 ASP 57 -5.913 -0.782 -11.693
435 HA PRO 58 HA PRO 58 -8.001 -5.260 -12.771
436 HB2 PRO 58 HB2 PRO 58 -6.445 -6.935 -14.217
437 HB3 PRO 58 HB3 PRO 58 -7.764 -5.885 -14.877
438 HG2 PRO 58 HG2 PRO 58 -4.801 -5.188 -14.830
439 HG3 PRO 58 HG3 PRO 58 -5.868 -5.318 -16.280
440 HD2 PRO 58 HD2 PRO 58 -5.446 -2.999 -14.995
441 HD3 PRO 58 HD3 PRO 58 -7.095 -3.421 -15.549
442 H LEU 59 H LEU 59 -6.887 -7.363 -11.856
443 HA LEU 59 HA LEU 59 -6.554 -8.034 -9.830
444 HB2 LEU 59 HB2 LEU 59 -4.284 -8.036 -10.726
445 HB3 LEU 59 HB3 LEU 59 -3.979 -6.456 -10.008
446 HG LEU 59 HG LEU 59 -4.169 -7.348 -7.766
447 HD11 LEU 59 HD11 LEU 59 -4.359 -9.826 -7.395
448 HD12 LEU 59 HD12 LEU 59 -4.827 -10.016 -9.100
449 HD13 LEU 59 HD13 LEU 59 -5.860 -9.106 -7.972
450 HD21 LEU 59 HD21 LEU 59 -2.539 -9.094 -9.653
451 HD22 LEU 59 HD22 LEU 59 -2.207 -8.874 -7.910
452 HD23 LEU 59 HD23 LEU 59 -2.052 -7.501 -9.027
453 H ALA 60 H ALA 60 -6.175 -4.389 -9.792
454 HA ALA 60 HA ALA 60 -6.479 -4.232 -6.941
455 HB1 ALA 60 HB1 ALA 60 -5.619 -2.379 -8.273
456 HB2 ALA 60 HB2 ALA 60 -7.190 -2.221 -9.114
457 HB3 ALA 60 HB3 ALA 60 -7.084 -1.894 -7.383
458 H MET 61 H MET 61 -8.918 -3.739 -9.491
459 HA MET 61 HA MET 61 -11.161 -3.572 -7.673
460 HB2 MET 61 HB2 MET 61 -12.488 -3.529 -9.725
461 HB3 MET 61 HB3 MET 61 -11.167 -2.383 -9.745
462 HG2 MET 61 HG2 MET 61 -10.135 -3.319 -11.505
463 HG3 MET 61 HG3 MET 61 -10.352 -4.964 -10.916
464 HE1 MET 61 HE1 MET 61 -13.373 -5.274 -10.529
465 HE2 MET 61 HE2 MET 61 -13.811 -6.011 -12.095
466 HE3 MET 61 HE3 MET 61 -12.287 -6.458 -11.282
467 H LEU 62 H LEU 62 -9.392 -6.272 -8.392
468 HA LEU 62 HA LEU 62 -11.629 -8.095 -7.587
469 HB2 LEU 62 HB2 LEU 62 -8.805 -8.639 -8.516
470 HB3 LEU 62 HB3 LEU 62 -9.953 -9.866 -7.997
471 HG LEU 62 HG LEU 62 -10.181 -8.124 -10.492
472 HD11 LEU 62 HD11 LEU 62 -8.592 -10.038 -10.603
473 HD12 LEU 62 HD12 LEU 62 -9.990 -10.268 -11.668
474 HD13 LEU 62 HD13 LEU 62 -9.901 -11.136 -10.122
475 HD21 LEU 62 HD21 LEU 62 -12.127 -10.203 -9.388
476 HD22 LEU 62 HD22 LEU 62 -12.177 -9.528 -11.030
477 HD23 LEU 62 HD23 LEU 62 -12.452 -8.469 -9.646
478 H LEU 63 H LEU 63 -8.454 -6.722 -6.538
479 HA LEU 63 HA LEU 63 -8.178 -8.496 -4.280
480 HB2 LEU 63 HB2 LEU 63 -6.363 -7.398 -5.419
481 HB3 LEU 63 HB3 LEU 63 -6.973 -5.797 -5.030
482 HG LEU 63 HG LEU 63 -6.356 -7.674 -2.736
483 HD11 LEU 63 HD11 LEU 63 -4.449 -7.972 -4.192
484 HD12 LEU 63 HD12 LEU 63 -3.967 -6.899 -2.864
485 HD13 LEU 63 HD13 LEU 63 -4.329 -6.233 -4.473
486 HD21 LEU 63 HD21 LEU 63 -5.583 -5.574 -1.683
487 HD22 LEU 63 HD22 LEU 63 -7.237 -5.374 -2.268
488 HD23 LEU 63 HD23 LEU 63 -5.888 -4.681 -3.192
489 H PHE 64 H PHE 64 -9.766 -5.413 -4.814
490 HA PHE 64 HA PHE 64 -10.092 -4.870 -1.976
491 HB2 PHE 64 HB2 PHE 64 -10.844 -2.892 -2.508
492 HB3 PHE 64 HB3 PHE 64 -10.173 -3.248 -4.075
493 HD1 PHE 64 HD2 PHE 64 -12.102 -4.679 -5.619
494 HD2 PHE 64 HD1 PHE 64 -12.796 -1.727 -2.563
495 HE1 PHE 64 HE2 PHE 64 -14.287 -4.108 -6.661
496 HE2 PHE 64 HE1 PHE 64 -14.916 -1.078 -3.655
497 HZ PHE 64 HZ PHE 64 -15.680 -2.285 -5.708
498 H GLU 65 H GLU 65 -12.278 -6.422 -4.340
499 HA GLU 65 HA GLU 65 -14.358 -6.805 -2.373
500 HB2 GLU 65 HB2 GLU 65 -15.530 -8.087 -3.929
501 HB3 GLU 65 HB3 GLU 65 -14.852 -6.707 -4.778
502 HG2 GLU 65 HG2 GLU 65 -13.342 -8.020 -6.000
503 HG3 GLU 65 HG3 GLU 65 -13.361 -9.345 -4.830
504 H GLN 66 H GLN 66 -11.367 -8.231 -2.393
505 HA GLN 66 HA GLN 66 -12.330 -10.663 -0.972
506 HB2 GLN 66 HB2 GLN 66 -9.565 -9.808 -1.921
507 HB3 GLN 66 HB3 GLN 66 -9.865 -11.247 -0.954
508 HG2 GLN 66 HG2 GLN 66 -11.146 -12.295 -2.697
509 HG3 GLN 66 HG3 GLN 66 -11.188 -10.814 -3.658
510 HE21 GLN 66 HE21 GLN 66 -9.449 -10.311 -4.985
511 HE22 GLN 66 HE22 GLN 66 -7.996 -11.326 -5.105
512 H TYR 67 H TYR 67 -11.278 -7.461 -0.256
513 HA TYR 67 HA TYR 67 -10.916 -8.230 2.622
514 HB2 TYR 67 HB2 TYR 67 -9.909 -5.815 1.116
515 HB3 TYR 67 HB3 TYR 67 -9.844 -6.008 2.862
516 HD1 TYR 67 HD2 TYR 67 -8.494 -7.946 3.872
517 HD2 TYR 67 HD1 TYR 67 -8.117 -6.645 -0.222
518 HE1 TYR 67 HE2 TYR 67 -6.160 -8.845 3.791
519 HE2 TYR 67 HE1 TYR 67 -5.789 -7.523 -0.287
520 HH TYR 67 HH TYR 67 -4.061 -8.310 0.942
521 H ASN 68 H ASN 68 -13.366 -8.458 2.067
522 HA ASN 68 HA ASN 68 -15.482 -7.807 2.304
523 HB2 ASN 68 HB2 ASN 68 -14.409 -7.564 4.594
524 HB3 ASN 68 HB3 ASN 68 -14.424 -5.822 4.315
525 HD21 ASN 68 HD21 ASN 68 -15.903 -5.334 5.958
526 HD22 ASN 68 HD22 ASN 68 -17.561 -5.960 5.945
527 H ARG 69 H ARG 69 -14.024 -6.212 0.193
528 HA ARG 69 HA ARG 69 -14.243 -4.394 -1.126
529 HB2 ARG 69 HB2 ARG 69 -16.263 -5.989 -1.413
530 HB3 ARG 69 HB3 ARG 69 -17.228 -4.679 -0.737
531 HG2 ARG 69 HG2 ARG 69 -16.548 -3.198 -2.580
532 HG3 ARG 69 HG3 ARG 69 -15.333 -4.376 -3.108
533 HD2 ARG 69 HD2 ARG 69 -17.221 -4.462 -4.604
534 HD3 ARG 69 HD3 ARG 69 -17.090 -5.983 -3.709
535 HE ARG 69 HE ARG 69 -18.865 -4.313 -2.286
536 HH11 ARG 69 HH11 ARG 69 -18.762 -5.975 -5.440
537 HH12 ARG 69 HH12 ARG 69 -20.500 -6.149 -5.527
538 HH21 ARG 69 HH21 ARG 69 -21.122 -4.574 -2.435
539 HH22 ARG 69 HH22 ARG 69 -21.832 -5.355 -3.830
540 H LEU 70 H LEU 70 -13.499 -3.385 1.245
541 HA LEU 70 HA LEU 70 -15.254 -1.176 2.009
542 HB2 LEU 70 HB2 LEU 70 -13.970 -2.384 3.656
543 HB3 LEU 70 HB3 LEU 70 -12.452 -1.940 2.874
544 HG LEU 70 HG LEU 70 -12.717 0.383 3.494
545 HD11 LEU 70 HD11 LEU 70 -15.446 -0.408 4.588
546 HD12 LEU 70 HD12 LEU 70 -15.135 0.767 3.302
547 HD13 LEU 70 HD13 LEU 70 -14.631 1.129 4.952
548 HD21 LEU 70 HD21 LEU 70 -12.621 0.195 5.904
549 HD22 LEU 70 HD22 LEU 70 -11.868 -1.237 5.175
550 HD23 LEU 70 HD23 LEU 70 -13.494 -1.350 5.866
551 H ALA 71 H ALA 71 -12.203 -1.442 0.170
552 HA ALA 71 HA ALA 71 -11.207 -0.172 -1.335
553 HB1 ALA 71 HB1 ALA 71 -13.378 1.932 -1.218
554 HB2 ALA 71 HB2 ALA 71 -12.161 1.682 -2.477
555 HB3 ALA 71 HB3 ALA 71 -13.443 0.484 -2.240
556 H MET 72 H MET 72 -9.895 1.790 -1.543
557 HA MET 72 HA MET 72 -9.223 3.071 1.065
558 HB2 MET 72 HB2 MET 72 -7.868 1.079 0.589
559 HB3 MET 72 HB3 MET 72 -7.375 1.757 -0.967
560 HG2 MET 72 HG2 MET 72 -6.105 3.503 0.163
561 HG3 MET 72 HG3 MET 72 -6.804 3.042 1.718
562 HE1 MET 72 HE1 MET 72 -5.280 0.756 -1.184
563 HE2 MET 72 HE2 MET 72 -4.028 2.015 -1.015
564 HE3 MET 72 HE3 MET 72 -3.697 0.358 -0.488
565 HA PRO 73 HA PRO 73 -8.678 6.662 -1.694
566 HB2 PRO 73 HB2 PRO 73 -8.266 8.605 0.090
567 HB3 PRO 73 HB3 PRO 73 -9.790 7.668 0.110
568 HG2 PRO 73 HG2 PRO 73 -7.319 7.255 1.815
569 HG3 PRO 73 HG3 PRO 73 -9.019 7.375 2.364
570 HD2 PRO 73 HD2 PRO 73 -7.718 4.979 1.887
571 HD3 PRO 73 HD3 PRO 73 -9.483 5.193 1.697
572 H ASN 74 H ASN 74 -7.144 8.530 -2.019
573 HA ASN 74 HA ASN 74 -4.263 7.820 -1.738
574 HB2 ASN 74 HB2 ASN 74 -4.857 8.361 -3.971
575 HB3 ASN 74 HB3 ASN 74 -5.854 9.721 -3.479
576 HD21 ASN 74 HD21 ASN 74 -2.587 8.724 -4.252
577 HD22 ASN 74 HD22 ASN 74 -1.916 10.343 -4.193
578 H MET 75 H MET 75 -2.830 9.085 -0.606
579 HA MET 75 HA MET 75 -3.963 11.026 1.355
580 HB2 MET 75 HB2 MET 75 -1.644 9.069 1.514
581 HB3 MET 75 HB3 MET 75 -1.848 10.397 2.652
582 HG2 MET 75 HG2 MET 75 -2.802 8.631 3.752
583 HG3 MET 75 HG3 MET 75 -4.164 9.567 3.155
584 HE1 MET 75 HE1 MET 75 -5.850 7.713 3.668
585 HE2 MET 75 HE2 MET 75 -5.619 5.998 3.263
586 HE3 MET 75 HE3 MET 75 -4.516 6.809 4.406
587 H ARG 76 H ARG 76 -2.962 11.677 -1.448
588 HA ARG 76 HA ARG 76 -1.776 13.253 -2.528
589 HB2 ARG 76 HB2 ARG 76 -2.147 14.805 0.054
590 HB3 ARG 76 HB3 ARG 76 -1.819 15.490 -1.543
591 HG2 ARG 76 HG2 ARG 76 -3.966 14.600 -2.394
592 HG3 ARG 76 HG3 ARG 76 -4.319 13.905 -0.796
593 HD2 ARG 76 HD2 ARG 76 -4.199 16.173 0.208
594 HD3 ARG 76 HD3 ARG 76 -3.927 16.867 -1.395
595 HE ARG 76 HE ARG 76 -6.412 15.605 -0.350
596 HH11 ARG 76 HH11 ARG 76 -4.874 17.395 -3.033
597 HH12 ARG 76 HH12 ARG 76 -6.410 17.779 -3.778
598 HH21 ARG 76 HH21 ARG 76 -8.355 16.116 -1.358
599 HH22 ARG 76 HH22 ARG 76 -8.375 17.059 -2.832
600 H LEU 77 H LEU 77 -0.071 11.351 -1.530
601 HA LEU 77 HA LEU 77 2.191 12.440 -0.119
602 HB2 LEU 77 HB2 LEU 77 1.974 9.922 -1.817
603 HB3 LEU 77 HB3 LEU 77 3.261 10.287 -0.671
604 HG LEU 77 HG LEU 77 0.334 9.788 0.029
605 HD11 LEU 77 HD11 LEU 77 2.857 8.149 0.520
606 HD12 LEU 77 HD12 LEU 77 1.559 7.775 -0.641
607 HD13 LEU 77 HD13 LEU 77 1.219 7.752 1.092
608 HD21 LEU 77 HD21 LEU 77 1.253 11.354 1.656
609 HD22 LEU 77 HD22 LEU 77 2.714 10.353 1.853
610 HD23 LEU 77 HD23 LEU 77 1.124 9.755 2.386
611 H GLY 78 H GLY 78 4.315 12.732 -0.824
612 HA2 GLY 78 HA2 GLY 78 4.719 13.590 -3.650
613 HA3 GLY 78 HA3 GLY 78 5.832 13.822 -2.308
614 H ASP 79 H ASP 79 6.623 12.847 -4.822
615 HA ASP 79 HA ASP 79 7.016 9.974 -4.794
616 HB2 ASP 79 HB2 ASP 79 8.647 12.122 -6.206
617 HB3 ASP 79 HB3 ASP 79 8.606 10.397 -6.592
618 H ALA 80 H ALA 80 8.668 12.625 -3.220
619 HA ALA 80 HA ALA 80 10.961 11.109 -2.273
620 HB1 ALA 80 HB1 ALA 80 10.935 13.570 -2.418
621 HB2 ALA 80 HB2 ALA 80 9.606 13.639 -1.233
622 HB3 ALA 80 HB3 ALA 80 11.205 13.038 -0.749
623 H GLU 81 H GLU 81 7.575 11.187 -1.330
624 HA GLU 81 HA GLU 81 8.139 10.096 1.381
625 HB2 GLU 81 HB2 GLU 81 5.535 10.985 0.086
626 HB3 GLU 81 HB3 GLU 81 5.703 10.346 1.721
627 HG2 GLU 81 HG2 GLU 81 7.251 12.209 2.291
628 HG3 GLU 81 HG3 GLU 81 7.018 12.891 0.672
629 H VAL 82 H VAL 82 6.332 9.162 -1.615
630 HA VAL 82 HA VAL 82 5.676 6.500 -0.734
631 HB VAL 82 HB VAL 82 6.174 7.521 -3.563
632 HG11 VAL 82 HG11 VAL 82 4.754 4.978 -2.609
633 HG12 VAL 82 HG12 VAL 82 4.763 5.588 -4.274
634 HG13 VAL 82 HG13 VAL 82 6.267 5.048 -3.541
635 HG21 VAL 82 HG21 VAL 82 3.605 7.166 -1.947
636 HG22 VAL 82 HG22 VAL 82 4.331 8.715 -2.438
637 HG23 VAL 82 HG23 VAL 82 3.691 7.623 -3.661
638 H SER 83 H SER 83 8.657 7.750 -2.404
639 HA SER 83 HA SER 83 9.922 5.190 -2.592
640 HB2 SER 83 HB2 SER 83 12.024 6.446 -2.860
641 HB3 SER 83 HB3 SER 83 10.722 7.035 -3.906
642 HG SER 83 HG SER 83 10.642 8.848 -2.869
643 H ALA 84 H ALA 84 10.088 7.619 0.079
644 HA ALA 84 HA ALA 84 11.885 6.079 1.709
645 HB1 ALA 84 HB1 ALA 84 11.066 7.588 3.513
646 HB2 ALA 84 HB2 ALA 84 11.529 8.470 2.043
647 HB3 ALA 84 HB3 ALA 84 9.813 8.200 2.416
648 H LEU 85 H LEU 85 8.320 6.172 1.531
649 HA LEU 85 HA LEU 85 7.773 4.280 3.597
650 HB2 LEU 85 HB2 LEU 85 6.270 5.966 2.555
651 HB3 LEU 85 HB3 LEU 85 6.258 5.034 1.064
652 HG LEU 85 HG LEU 85 5.048 3.206 2.188
653 HD11 LEU 85 HD11 LEU 85 5.170 5.042 4.623
654 HD12 LEU 85 HD12 LEU 85 5.834 3.400 4.495
655 HD13 LEU 85 HD13 LEU 85 4.081 3.654 4.464
656 HD21 LEU 85 HD21 LEU 85 2.949 4.550 2.591
657 HD22 LEU 85 HD22 LEU 85 3.796 5.005 1.101
658 HD23 LEU 85 HD23 LEU 85 3.915 6.021 2.554
659 H ILE 86 H ILE 86 8.593 3.838 0.190
660 HA ILE 86 HA ILE 86 8.164 0.941 0.081
661 HB ILE 86 HB ILE 86 9.049 3.092 -1.767
662 HG12 ILE 86 HG12 ILE 86 7.729 1.830 -3.357
663 HG13 ILE 86 HG13 ILE 86 7.643 0.442 -2.269
664 HG21 ILE 86 HG21 ILE 86 10.142 0.283 -2.164
665 HG22 ILE 86 HG22 ILE 86 10.062 1.548 -3.404
666 HG23 ILE 86 HG23 ILE 86 11.077 1.796 -1.996
667 HD11 ILE 86 HD11 ILE 86 6.216 1.780 -0.709
668 HD12 ILE 86 HD12 ILE 86 6.296 3.139 -1.854
669 HD13 ILE 86 HD13 ILE 86 5.526 1.620 -2.327
670 H SER 87 H SER 87 11.017 3.100 0.536
671 HA SER 87 HA SER 87 12.978 1.085 0.905
672 HB2 SER 87 HB2 SER 87 12.624 3.870 2.055
673 HB3 SER 87 HB3 SER 87 14.016 2.869 2.461
674 HG SER 87 HG SER 87 14.057 4.404 0.573
675 H TYR 88 H TYR 88 10.616 2.415 3.287
676 HA TYR 88 HA TYR 88 11.617 0.714 5.437
677 HB2 TYR 88 HB2 TYR 88 10.396 2.628 6.087
678 HB3 TYR 88 HB3 TYR 88 9.041 2.244 5.023
679 HD1 TYR 88 HD1 TYR 88 10.938 0.292 7.647
680 HD2 TYR 88 HD2 TYR 88 7.113 1.740 6.268
681 HE1 TYR 88 HE1 TYR 88 9.800 -1.061 9.379
682 HE2 TYR 88 HE2 TYR 88 5.977 0.405 8.053
683 HH TYR 88 HH TYR 88 7.817 -1.890 10.090
684 H LEU 89 H LEU 89 8.828 0.352 3.188
685 HA LEU 89 HA LEU 89 8.025 -2.197 4.197
686 HB2 LEU 89 HB2 LEU 89 7.569 -0.783 1.545
687 HB3 LEU 89 HB3 LEU 89 6.774 -2.294 1.972
688 HG LEU 89 HG LEU 89 6.473 0.207 3.686
689 HD11 LEU 89 HD11 LEU 89 5.623 0.650 1.412
690 HD12 LEU 89 HD12 LEU 89 4.301 0.513 2.575
691 HD13 LEU 89 HD13 LEU 89 4.657 -0.841 1.469
692 HD21 LEU 89 HD21 LEU 89 5.928 -1.886 4.818
693 HD22 LEU 89 HD22 LEU 89 4.871 -2.366 3.470
694 HD23 LEU 89 HD23 LEU 89 4.465 -0.957 4.486
695 H GLU 90 H GLU 90 10.573 -1.448 1.893
696 HA GLU 90 HA GLU 90 11.042 -4.215 1.114
697 HB2 GLU 90 HB2 GLU 90 11.733 -2.303 -0.258
698 HB3 GLU 90 HB3 GLU 90 12.824 -1.744 1.012
699 HG2 GLU 90 HG2 GLU 90 14.226 -3.723 0.744
700 HG3 GLU 90 HG3 GLU 90 13.056 -4.449 -0.365
701 H GLU 91 H GLU 91 12.833 -2.020 3.413
702 HA GLU 91 HA GLU 91 14.418 -4.290 4.254
703 HB2 GLU 91 HB2 GLU 91 14.439 -1.367 4.970
704 HB3 GLU 91 HB3 GLU 91 15.384 -2.540 5.910
705 HG2 GLU 91 HG2 GLU 91 16.492 -3.366 3.898
706 HG3 GLU 91 HG3 GLU 91 15.505 -2.307 2.886
707 H GLU 92 H GLU 92 11.413 -3.100 5.579
708 HA GLU 92 HA GLU 92 11.652 -4.402 8.150
709 HB2 GLU 92 HB2 GLU 92 9.825 -2.834 7.447
710 HB3 GLU 92 HB3 GLU 92 9.209 -4.078 6.364
711 HG2 GLU 92 HG2 GLU 92 7.853 -4.091 8.319
712 HG3 GLU 92 HG3 GLU 92 8.816 -5.557 8.370
713 H THR 93 H THR 93 11.158 -5.747 4.894
714 HA THR 93 HA THR 93 10.579 -8.458 5.915
715 HB THR 93 HB THR 93 10.656 -9.234 3.685
716 HG1 THR 93 HG1 THR 93 11.778 -6.730 2.911
717 HG21 THR 93 HG21 THR 93 9.633 -6.395 3.480
718 HG22 THR 93 HG22 THR 93 8.717 -7.741 4.219
719 HG23 THR 93 HG23 THR 93 9.133 -7.789 2.490
720 H ALA 94 H ALA 94 13.360 -6.702 4.708
721 HA ALA 94 HA ALA 94 15.230 -8.882 4.823
722 HB1 ALA 94 HB1 ALA 94 15.598 -6.757 3.568
723 HB2 ALA 94 HB2 ALA 94 15.817 -5.906 5.116
724 HB3 ALA 94 HB3 ALA 94 16.951 -7.175 4.634
725 H ARG 95 H ARG 95 14.417 -6.399 7.276
726 HA ARG 95 HA ARG 95 16.228 -7.548 9.255
727 HB2 ARG 95 HB2 ARG 95 14.177 -5.319 9.404
728 HB3 ARG 95 HB3 ARG 95 15.252 -5.745 10.729
729 HG2 ARG 95 HG2 ARG 95 16.337 -4.906 8.000
730 HG3 ARG 95 HG3 ARG 95 15.871 -3.754 9.240
731 HD2 ARG 95 HD2 ARG 95 18.205 -4.015 9.426
732 HD3 ARG 95 HD3 ARG 95 17.488 -4.798 10.830
733 HE ARG 95 HE ARG 95 18.656 -6.148 8.421
734 HH11 ARG 95 HH11 ARG 95 17.753 -6.374 11.874
735 HH12 ARG 95 HH12 ARG 95 18.519 -7.935 12.066
736 HH21 ARG 95 HH21 ARG 95 19.635 -8.150 8.734
737 HH22 ARG 95 HH22 ARG 95 19.595 -8.927 10.300
738 H LEU 96 H LEU 96 12.666 -7.429 8.910
739 HA LEU 96 HA LEU 96 11.009 -8.411 9.989
740 HB2 LEU 96 HB2 LEU 96 12.658 -10.355 9.036
741 HB3 LEU 96 HB3 LEU 96 12.520 -10.881 10.667
742 HG LEU 96 HG LEU 96 11.011 -12.085 9.340
743 HD11 LEU 96 HD11 LEU 96 10.147 -11.372 11.500
744 HD12 LEU 96 HD12 LEU 96 8.846 -11.559 10.302
745 HD13 LEU 96 HD13 LEU 96 9.428 -9.930 10.737
746 HD21 LEU 96 HD21 LEU 96 10.986 -10.593 7.454
747 HD22 LEU 96 HD22 LEU 96 10.001 -9.411 8.336
748 HD23 LEU 96 HD23 LEU 96 9.320 -11.009 7.919
749 H GLN 97 H GLN 97 12.565 -6.677 11.690
750 HA GLN 97 HA GLN 97 11.998 -7.831 14.414
751 HB2 GLN 97 HB2 GLN 97 14.148 -5.884 13.518
752 HB3 GLN 97 HB3 GLN 97 13.780 -6.231 15.203
753 HG2 GLN 97 HG2 GLN 97 14.776 -8.276 13.196
754 HG3 GLN 97 HG3 GLN 97 15.754 -7.470 14.406
755 HE21 GLN 97 HE21 GLN 97 14.434 -10.378 13.829
756 HE22 GLN 97 HE22 GLN 97 14.084 -10.853 15.501
757 H THR 98 H THR 98 11.016 -5.275 12.295
758 HA THR 98 HA THR 98 9.923 -3.389 12.479
759 HB THR 98 HB THR 98 8.307 -2.973 13.908
760 HG1 THR 98 HG1 THR 98 9.723 -4.650 15.635
761 HG21 THR 98 HG21 THR 98 8.456 -5.994 13.780
762 HG22 THR 98 HG22 THR 98 7.873 -4.914 12.490
763 HG23 THR 98 HG23 THR 98 7.010 -5.013 14.033
764 HA PRO 99 HA PRO 99 12.548 -0.357 14.556
765 HB2 PRO 99 HB2 PRO 99 11.101 1.587 12.803
766 HB3 PRO 99 HB3 PRO 99 12.857 1.319 12.991
767 HG2 PRO 99 HG2 PRO 99 11.517 0.512 10.760
768 HG3 PRO 99 HG3 PRO 99 12.804 -0.516 11.476
769 HD2 PRO 99 HD2 PRO 99 9.800 -0.705 11.937
770 HD3 PRO 99 HD3 PRO 99 10.937 -1.975 11.413
771 H VAL 100 H VAL 100 10.136 -1.376 15.729
772 HA VAL 100 HA VAL 100 8.519 0.966 16.641
773 HB VAL 100 HB VAL 100 7.629 -1.637 15.326
774 HG11 VAL 100 HG11 VAL 100 5.297 -0.897 15.671
775 HG12 VAL 100 HG12 VAL 100 6.088 -1.162 17.226
776 HG13 VAL 100 HG13 VAL 100 5.858 0.492 16.606
777 HG21 VAL 100 HG21 VAL 100 7.164 1.268 14.569
778 HG22 VAL 100 HG22 VAL 100 8.199 0.104 13.716
779 HG23 VAL 100 HG23 VAL 100 6.454 -0.140 13.743
780 H THR 101 H THR 101 8.213 0.911 18.782
781 HA THR 101 HA THR 101 8.425 -1.646 20.321
782 HB THR 101 HB THR 101 9.828 -0.303 22.032
783 HG1 THR 101 HG1 THR 101 10.523 1.540 21.427
784 HG21 THR 101 HG21 THR 101 10.750 -2.227 20.909
785 HG22 THR 101 HG22 THR 101 11.960 -0.936 20.940
786 HG23 THR 101 HG23 THR 101 11.065 -1.284 19.442
787 H ASN 102 H ASN 102 8.064 1.894 20.845
788 HA ASN 102 HA ASN 102 5.331 1.532 21.693
789 HB2 ASN 102 HB2 ASN 102 6.733 0.910 23.771
790 HB3 ASN 102 HB3 ASN 102 7.291 2.576 23.783
791 HD21 ASN 102 HD21 ASN 102 6.310 2.999 25.800
792 HD22 ASN 102 HD22 ASN 102 4.548 3.033 25.991
793 H ARG 103 H ARG 103 4.172 3.498 21.865
794 HA ARG 103 HA ARG 103 5.452 6.102 21.583
795 HB2 ARG 103 HB2 ARG 103 5.528 5.131 19.232
796 HB3 ARG 103 HB3 ARG 103 3.776 5.056 19.263
797 HG2 ARG 103 HG2 ARG 103 4.478 6.990 18.029
798 HG3 ARG 103 HG3 ARG 103 3.703 7.555 19.513
799 HD2 ARG 103 HD2 ARG 103 5.872 8.068 20.512
800 HD3 ARG 103 HD3 ARG 103 6.720 7.234 19.205
801 HE ARG 103 HE ARG 103 6.421 9.021 17.785
802 HH11 ARG 103 HH11 ARG 103 4.553 9.677 20.759
803 HH12 ARG 103 HH12 ARG 103 4.290 11.352 20.334
804 HH21 ARG 103 HH21 ARG 103 6.067 11.181 17.295
805 HH22 ARG 103 HH22 ARG 103 5.151 12.207 18.375
806 H GLY 104 H GLY 104 4.124 7.618 22.568
807 HA2 GLY 104 HA2 GLY 104 1.440 6.701 23.444
808 HA3 GLY 104 HA3 GLY 104 2.410 7.977 24.166
809 H ILE 105 H ILE 105 -0.404 8.069 23.406
810 HA ILE 105 HA ILE 105 -0.319 10.616 22.021
811 HB ILE 105 HB ILE 105 -0.389 9.075 20.136
812 HG12 ILE 105 HG12 ILE 105 -2.932 10.717 20.393
813 HG13 ILE 105 HG13 ILE 105 -1.329 11.380 20.062
814 HG21 ILE 105 HG21 ILE 105 -2.244 7.685 19.581
815 HG22 ILE 105 HG22 ILE 105 -1.770 7.254 21.225
816 HG23 ILE 105 HG23 ILE 105 -3.195 8.280 20.946
817 HD11 ILE 105 HD11 ILE 105 -2.545 11.181 17.983
818 HD12 ILE 105 HD12 ILE 105 -1.212 10.010 17.972
819 HD13 ILE 105 HD13 ILE 105 -2.885 9.470 18.268
820 HA PRO 106 HA PRO 106 -3.843 11.161 24.839
821 HB2 PRO 106 HB2 PRO 106 -3.917 13.834 23.461
822 HB3 PRO 106 HB3 PRO 106 -4.007 13.457 25.206
823 HG2 PRO 106 HG2 PRO 106 -1.717 14.414 24.098
824 HG3 PRO 106 HG3 PRO 106 -1.658 13.113 25.336
825 HD2 PRO 106 HD2 PRO 106 -1.463 12.854 22.322
826 HD3 PRO 106 HD3 PRO 106 -0.488 12.079 23.606
827 HHA HEC 107 HHA HEC 107 -5.322 -3.563 0.977
828 HHB HEC 107 HHB HEC 107 -0.028 0.111 1.322
829 HHC HEC 107 HHC HEC 107 -3.443 4.599 4.549
830 HHD HEC 107 HHD HEC 107 -8.351 0.458 4.985
831 HMA1 HEC 107 HMA1 HEC 107 0.589 -2.109 0.779
832 HMA2 HEC 107 HMA2 HEC 107 -0.133 -3.423 -0.143
833 HMA3 HEC 107 HMA3 HEC 107 -0.096 -1.791 -0.835
834 HAA1 HEC 107 HAA1 HEC 107 -3.852 -4.192 -0.640
835 HAA2 HEC 107 HAA2 HEC 107 -2.192 -3.979 -1.142
836 HBA1 HEC 107 HBA1 HEC 107 -1.452 -5.245 0.917
837 HBA2 HEC 107 HBA2 HEC 107 -3.155 -5.573 1.263
838 HMB1 HEC 107 HMB1 HEC 107 1.002 3.461 1.338
839 HMB2 HEC 107 HMB2 HEC 107 1.498 2.936 2.956
840 HMB3 HEC 107 HMB3 HEC 107 1.306 1.763 1.680
841 HAB HEC 107 HAB HEC 107 -1.610 5.382 4.136
842 HBB1 HEC 107 HBB1 HEC 107 -0.342 6.823 2.832
843 HBB2 HEC 107 HBB2 HEC 107 0.464 5.507 1.976
844 HBB3 HEC 107 HBB3 HEC 107 -1.273 5.798 1.728
845 HMC1 HEC 107 HMC1 HEC 107 -4.494 5.016 6.503
846 HMC2 HEC 107 HMC2 HEC 107 -6.062 5.603 5.914
847 HMC3 HEC 107 HMC3 HEC 107 -5.959 4.602 7.371
848 HAC HEC 107 HAC HEC 107 -8.800 2.104 6.095
849 HBC1 HEC 107 HBC1 HEC 107 -9.760 4.125 6.743
850 HBC2 HEC 107 HBC2 HEC 107 -8.210 4.959 6.820
851 HBC3 HEC 107 HBC3 HEC 107 -8.856 4.429 5.248
852 HMD1 HEC 107 HMD1 HEC 107 -9.433 -2.407 4.753
853 HMD2 HEC 107 HMD2 HEC 107 -9.863 -0.837 4.023
854 HMD3 HEC 107 HMD3 HEC 107 -10.049 -2.301 3.091
855 HAD1 HEC 107 HAD1 HEC 107 -7.331 -4.515 1.727
856 HAD2 HEC 107 HAD2 HEC 107 -8.917 -3.953 2.202
857 HBD1 HEC 107 HBD1 HEC 107 -7.455 -3.022 -0.301
858 HBD2 HEC 107 HBD2 HEC 107 -8.726 -4.239 -0.249
Start of MODEL 14
1 H SER 1 H SER 1 12.748 9.085 8.132
2 HA SER 1 HA SER 1 10.219 10.011 6.975
3 HB2 SER 1 HB2 SER 1 13.027 9.764 5.836
4 HB3 SER 1 HB3 SER 1 11.641 10.523 5.017
5 HG SER 1 HG SER 1 11.540 12.073 6.579
6 H GLY 2 H GLY 2 9.277 7.942 7.454
7 HA2 GLY 2 HA2 GLY 2 8.558 6.157 5.422
8 HA3 GLY 2 HA3 GLY 2 10.031 5.525 6.107
9 H GLU 3 H GLU 3 10.135 5.296 8.560
10 HA GLU 3 HA GLU 3 7.899 3.664 9.355
11 HB2 GLU 3 HB2 GLU 3 10.175 3.104 9.993
12 HB3 GLU 3 HB3 GLU 3 10.333 4.601 10.930
13 HG2 GLU 3 HG2 GLU 3 8.644 3.879 12.515
14 HG3 GLU 3 HG3 GLU 3 8.200 2.507 11.494
15 H GLN 4 H GLN 4 9.059 6.821 10.734
16 HA GLN 4 HA GLN 4 6.831 6.999 12.573
17 HB2 GLN 4 HB2 GLN 4 8.604 9.172 11.421
18 HB3 GLN 4 HB3 GLN 4 7.447 9.425 12.713
19 HG2 GLN 4 HG2 GLN 4 9.819 7.511 12.880
20 HG3 GLN 4 HG3 GLN 4 9.826 9.168 13.467
21 HE21 GLN 4 HE21 GLN 4 10.481 7.186 15.202
22 HE22 GLN 4 HE22 GLN 4 9.180 6.914 16.352
23 H ILE 5 H ILE 5 7.247 7.884 9.190
24 HA ILE 5 HA ILE 5 4.772 9.338 8.852
25 HB ILE 5 HB ILE 5 6.585 7.794 6.894
26 HG12 ILE 5 HG12 ILE 5 6.108 10.764 7.451
27 HG13 ILE 5 HG13 ILE 5 7.542 9.829 7.867
28 HG21 ILE 5 HG21 ILE 5 5.246 8.828 5.067
29 HG22 ILE 5 HG22 ILE 5 4.232 7.771 6.030
30 HG23 ILE 5 HG23 ILE 5 4.132 9.526 6.262
31 HD11 ILE 5 HD11 ILE 5 8.094 11.111 5.943
32 HD12 ILE 5 HD12 ILE 5 7.917 9.436 5.381
33 HD13 ILE 5 HD13 ILE 5 6.632 10.633 5.078
34 H PHE 6 H PHE 6 5.502 5.784 8.417
35 HA PHE 6 HA PHE 6 2.762 5.126 7.919
36 HB2 PHE 6 HB2 PHE 6 4.748 3.666 7.459
37 HB3 PHE 6 HB3 PHE 6 4.898 3.369 9.183
38 HD1 PHE 6 HD1 PHE 6 3.030 2.123 10.410
39 HD2 PHE 6 HD2 PHE 6 3.116 2.515 6.122
40 HE1 PHE 6 HE1 PHE 6 1.425 0.256 10.212
41 HE2 PHE 6 HE2 PHE 6 1.502 0.637 5.919
42 HZ PHE 6 HZ PHE 6 0.657 -0.505 7.970
43 H ARG 7 H ARG 7 4.620 5.169 10.973
44 HA ARG 7 HA ARG 7 2.640 4.215 12.709
45 HB2 ARG 7 HB2 ARG 7 5.148 4.624 13.077
46 HB3 ARG 7 HB3 ARG 7 4.732 6.303 13.413
47 HG2 ARG 7 HG2 ARG 7 5.002 5.127 15.482
48 HG3 ARG 7 HG3 ARG 7 3.282 5.500 15.319
49 HD2 ARG 7 HD2 ARG 7 2.786 3.201 14.676
50 HD3 ARG 7 HD3 ARG 7 4.512 2.831 14.515
51 HE ARG 7 HE ARG 7 3.380 3.654 17.147
52 HH11 ARG 7 HH11 ARG 7 4.979 1.110 15.209
53 HH12 ARG 7 HH12 ARG 7 5.349 0.138 16.615
54 HH21 ARG 7 HH21 ARG 7 3.890 2.357 18.927
55 HH22 ARG 7 HH22 ARG 7 4.735 0.840 18.708
56 H THR 8 H THR 8 3.113 7.514 11.520
57 HA THR 8 HA THR 8 0.964 8.616 13.211
58 HB THR 8 HB THR 8 1.496 10.769 11.993
59 HG1 THR 8 HG1 THR 8 3.806 9.427 11.138
60 HG21 THR 8 HG21 THR 8 3.834 9.418 13.392
61 HG22 THR 8 HG22 THR 8 2.452 10.167 14.202
62 HG23 THR 8 HG23 THR 8 3.542 11.168 13.229
63 H ARG 9 H ARG 9 1.361 7.918 9.734
64 HA ARG 9 HA ARG 9 -1.352 9.041 9.252
65 HB2 ARG 9 HB2 ARG 9 0.794 8.293 7.248
66 HB3 ARG 9 HB3 ARG 9 -0.684 9.212 6.946
67 HG2 ARG 9 HG2 ARG 9 0.154 11.011 8.494
68 HG3 ARG 9 HG3 ARG 9 1.665 10.093 8.674
69 HD2 ARG 9 HD2 ARG 9 1.883 10.164 6.139
70 HD3 ARG 9 HD3 ARG 9 0.565 11.352 6.146
71 HE ARG 9 HE ARG 9 2.547 12.161 8.019
72 HH11 ARG 9 HH11 ARG 9 2.150 11.846 4.496
73 HH12 ARG 9 HH12 ARG 9 3.362 13.057 4.142
74 HH21 ARG 9 HH21 ARG 9 4.136 13.726 7.510
75 HH22 ARG 9 HH22 ARG 9 4.482 14.114 5.840
76 H CYS 10 H CYS 10 0.105 5.907 9.414
77 HA CYS 10 HA CYS 10 -2.008 4.738 7.637
78 HB2 CYS 10 HB2 CYS 10 0.868 3.868 7.916
79 HB3 CYS 10 HB3 CYS 10 -0.302 3.270 6.757
80 H SER 11 H SER 11 -0.403 4.268 10.730
81 HA SER 11 HA SER 11 -0.590 1.467 10.880
82 HB2 SER 11 HB2 SER 11 -0.229 3.698 12.852
83 HB3 SER 11 HB3 SER 11 -0.620 2.098 13.474
84 HG SER 11 HG SER 11 1.397 1.764 13.284
85 H SER 12 H SER 12 -3.237 3.738 11.490
86 HA SER 12 HA SER 12 -4.608 2.200 13.401
87 HB2 SER 12 HB2 SER 12 -6.545 3.662 12.928
88 HB3 SER 12 HB3 SER 12 -5.029 4.538 13.172
89 HG SER 12 HG SER 12 -4.872 4.959 11.059
90 H CYS 13 H CYS 13 -4.406 1.265 10.187
91 HA CYS 13 HA CYS 13 -6.818 -0.519 10.442
92 HB2 CYS 13 HB2 CYS 13 -5.837 0.851 7.946
93 HB3 CYS 13 HB3 CYS 13 -7.263 -0.179 8.079
94 H HIS 14 H HIS 14 -3.472 -0.657 10.166
95 HA HIS 14 HA HIS 14 -3.554 -3.420 9.499
96 HB2 HIS 14 2HB HIS 14 -1.812 -3.090 7.484
97 HB3 HIS 14 3HB HIS 14 -3.539 -3.255 7.277
98 HD1 HIS 14 1HD HIS 14 -1.862 0.129 8.159
99 HD2 HIS 14 2HD HIS 14 -3.827 -2.013 5.135
100 HE1 HIS 14 1HE HIS 14 -2.307 1.804 6.343
101 H THR 15 H THR 15 -1.322 -4.296 9.124
102 HA THR 15 HA THR 15 0.668 -3.137 11.022
103 HB THR 15 HB THR 15 -0.896 -4.755 12.141
104 HG1 THR 15 HG1 THR 15 0.653 -5.386 13.322
105 HG21 THR 15 HG21 THR 15 -1.111 -6.368 10.198
106 HG22 THR 15 HG22 THR 15 -0.760 -7.100 11.760
107 HG23 THR 15 HG23 THR 15 0.539 -6.912 10.560
108 H VAL 16 H VAL 16 2.847 -4.137 10.764
109 HA VAL 16 HA VAL 16 3.265 -5.296 8.032
110 HB VAL 16 HB VAL 16 5.153 -3.195 9.131
111 HG11 VAL 16 HG11 VAL 16 4.683 -4.365 6.338
112 HG12 VAL 16 HG12 VAL 16 5.898 -3.146 6.780
113 HG13 VAL 16 HG13 VAL 16 6.022 -4.789 7.417
114 HG21 VAL 16 HG21 VAL 16 3.166 -1.939 8.846
115 HG22 VAL 16 HG22 VAL 16 4.079 -1.697 7.354
116 HG23 VAL 16 HG23 VAL 16 2.695 -2.819 7.392
117 H GLY 17 H GLY 17 3.115 -7.183 9.248
118 HA2 GLY 17 HA2 GLY 17 4.464 -9.064 9.859
119 HA3 GLY 17 HA3 GLY 17 5.671 -8.005 10.591
120 H ASN 18 H ASN 18 2.143 -8.561 10.938
121 HA ASN 18 HA ASN 18 2.522 -9.903 13.464
122 HB2 ASN 18 HB2 ASN 18 2.263 -7.353 14.017
123 HB3 ASN 18 HB3 ASN 18 0.596 -7.555 13.500
124 HD21 ASN 18 HD21 ASN 18 2.827 -7.995 16.110
125 HD22 ASN 18 HD22 ASN 18 1.687 -8.807 17.174
126 H THR 19 H THR 19 0.645 -11.272 13.923
127 HA THR 19 HA THR 19 -1.843 -10.827 12.457
128 HB THR 19 HB THR 19 -0.241 -13.358 11.960
129 HG1 THR 19 HG1 THR 19 -0.428 -11.159 10.716
130 HG21 THR 19 HG21 THR 19 -2.227 -14.136 10.657
131 HG22 THR 19 HG22 THR 19 -3.186 -12.809 11.358
132 HG23 THR 19 HG23 THR 19 -2.541 -14.103 12.393
133 H GLU 20 H GLU 20 -3.085 -10.647 14.137
134 HA GLU 20 HA GLU 20 -3.061 -12.469 16.434
135 HB2 GLU 20 HB2 GLU 20 -4.784 -10.108 15.584
136 HB3 GLU 20 HB3 GLU 20 -5.144 -11.068 17.019
137 HG2 GLU 20 HG2 GLU 20 -2.877 -10.609 17.917
138 HG3 GLU 20 HG3 GLU 20 -2.535 -9.576 16.531
139 HA PRO 21 HA PRO 21 -6.135 -15.429 15.204
140 HB2 PRO 21 HB2 PRO 21 -7.803 -14.622 17.581
141 HB3 PRO 21 HB3 PRO 21 -7.331 -16.258 17.029
142 HG2 PRO 21 HG2 PRO 21 -6.024 -15.101 19.097
143 HG3 PRO 21 HG3 PRO 21 -5.089 -15.956 17.826
144 HD2 PRO 21 HD2 PRO 21 -5.602 -12.984 18.110
145 HD3 PRO 21 HD3 PRO 21 -4.063 -13.831 17.780
146 H GLY 22 H GLY 22 -7.753 -15.402 13.721
147 HA2 GLY 22 HA2 GLY 22 -9.617 -14.699 12.504
148 HA3 GLY 22 HA3 GLY 22 -9.936 -13.432 13.691
149 H GLN 23 H GLN 23 -6.706 -13.397 12.596
150 HA GLN 23 HA GLN 23 -5.426 -12.021 11.413
151 HB2 GLN 23 HB2 GLN 23 -7.723 -11.871 9.427
152 HB3 GLN 23 HB3 GLN 23 -6.046 -11.449 9.114
153 HG2 GLN 23 HG2 GLN 23 -5.372 -13.805 9.684
154 HG3 GLN 23 HG3 GLN 23 -7.083 -14.228 9.784
155 HE21 GLN 23 HE21 GLN 23 -4.406 -13.635 7.610
156 HE22 GLN 23 HE22 GLN 23 -5.330 -13.956 6.150
157 HA PRO 24 HA PRO 24 -5.866 -7.868 12.613
158 HB2 PRO 24 HB2 PRO 24 -5.348 -6.791 9.852
159 HB3 PRO 24 HB3 PRO 24 -4.581 -6.338 11.404
160 HG2 PRO 24 HG2 PRO 24 -3.280 -7.970 9.679
161 HG3 PRO 24 HG3 PRO 24 -3.277 -8.347 11.431
162 HD2 PRO 24 HD2 PRO 24 -5.031 -9.504 9.260
163 HD3 PRO 24 HD3 PRO 24 -4.136 -10.367 10.551
164 H GLY 25 H GLY 25 -7.327 -6.102 12.803
165 HA2 GLY 25 HA2 GLY 25 -9.908 -7.087 12.538
166 HA3 GLY 25 HA3 GLY 25 -9.489 -5.472 13.096
167 H ILE 26 H ILE 26 -8.395 -4.994 10.206
168 HA ILE 26 HA ILE 26 -11.020 -4.550 8.821
169 HB ILE 26 HB ILE 26 -8.810 -2.476 8.887
170 HG12 ILE 26 HG12 ILE 26 -11.269 -2.620 10.679
171 HG13 ILE 26 HG13 ILE 26 -9.581 -2.698 11.197
172 HG21 ILE 26 HG21 ILE 26 -10.485 -2.446 6.972
173 HG22 ILE 26 HG22 ILE 26 -11.774 -2.245 8.161
174 HG23 ILE 26 HG23 ILE 26 -10.532 -0.995 7.955
175 HD11 ILE 26 HD11 ILE 26 -9.249 -0.372 10.323
176 HD12 ILE 26 HD12 ILE 26 -11.015 -0.288 10.075
177 HD13 ILE 26 HD13 ILE 26 -10.358 -0.527 11.701
178 H GLY 27 H GLY 27 -7.466 -4.862 8.499
179 HA2 GLY 27 HA2 GLY 27 -7.800 -5.467 5.572
180 HA3 GLY 27 HA3 GLY 27 -6.629 -4.296 6.169
181 HA PRO 28 HA PRO 28 -4.510 -8.389 5.872
182 HB2 PRO 28 HB2 PRO 28 -2.664 -7.831 3.948
183 HB3 PRO 28 HB3 PRO 28 -4.342 -8.299 3.586
184 HG2 PRO 28 HG2 PRO 28 -3.149 -5.521 3.653
185 HG3 PRO 28 HG3 PRO 28 -4.245 -6.224 2.424
186 HD2 PRO 28 HD2 PRO 28 -5.092 -4.603 4.494
187 HD3 PRO 28 HD3 PRO 28 -6.115 -5.876 3.767
188 H ASP 29 H ASP 29 -2.451 -9.017 6.587
189 HA ASP 29 HA ASP 29 -0.620 -7.079 7.853
190 HB2 ASP 29 HB2 ASP 29 -0.706 -9.301 8.789
191 HB3 ASP 29 HB3 ASP 29 -0.427 -10.040 7.215
192 H LEU 30 H LEU 30 1.018 -6.072 6.870
193 HA LEU 30 HA LEU 30 1.189 -6.281 3.916
194 HB2 LEU 30 HB2 LEU 30 2.453 -4.179 5.667
195 HB3 LEU 30 HB3 LEU 30 2.135 -4.103 3.939
196 HG LEU 30 HG LEU 30 0.090 -4.023 6.194
197 HD11 LEU 30 HD11 LEU 30 1.363 -1.925 5.799
198 HD12 LEU 30 HD12 LEU 30 -0.348 -1.750 5.385
199 HD13 LEU 30 HD13 LEU 30 0.867 -1.948 4.095
200 HD21 LEU 30 HD21 LEU 30 -0.894 -5.197 4.254
201 HD22 LEU 30 HD22 LEU 30 -0.380 -3.878 3.180
202 HD23 LEU 30 HD23 LEU 30 -1.609 -3.600 4.445
203 H LEU 31 H LEU 31 3.023 -7.560 6.534
204 HA LEU 31 HA LEU 31 5.658 -7.250 5.372
205 HB2 LEU 31 HB2 LEU 31 5.314 -7.886 7.633
206 HB3 LEU 31 HB3 LEU 31 4.665 -9.465 7.153
207 HG LEU 31 HG LEU 31 7.329 -8.664 6.007
208 HD11 LEU 31 HD11 LEU 31 8.553 -9.265 8.028
209 HD12 LEU 31 HD12 LEU 31 7.011 -9.417 8.914
210 HD13 LEU 31 HD13 LEU 31 7.525 -7.834 8.264
211 HD21 LEU 31 HD21 LEU 31 6.354 -11.243 7.293
212 HD22 LEU 31 HD22 LEU 31 7.894 -11.012 6.439
213 HD23 LEU 31 HD23 LEU 31 6.364 -10.903 5.554
214 H GLY 32 H GLY 32 6.678 -8.286 3.866
215 HA2 GLY 32 HA2 GLY 32 7.149 -9.744 2.079
216 HA3 GLY 32 HA3 GLY 32 5.899 -10.823 2.685
217 H VAL 33 H VAL 33 4.164 -8.023 2.248
218 HA VAL 33 HA VAL 33 2.833 -9.006 -0.029
219 HB VAL 33 HB VAL 33 1.975 -7.363 1.684
220 HG11 VAL 33 HG11 VAL 33 3.114 -5.230 -0.171
221 HG12 VAL 33 HG12 VAL 33 2.204 -5.005 1.335
222 HG13 VAL 33 HG13 VAL 33 3.849 -5.661 1.371
223 HG21 VAL 33 HG21 VAL 33 0.703 -8.012 -0.325
224 HG22 VAL 33 HG22 VAL 33 0.425 -6.324 0.132
225 HG23 VAL 33 HG23 VAL 33 1.467 -6.695 -1.245
226 H THR 34 H THR 34 5.596 -6.856 0.097
227 HA THR 34 HA THR 34 5.630 -6.051 -2.660
228 HB THR 34 HB THR 34 6.800 -4.924 -0.752
229 HG1 THR 34 HG1 THR 34 7.345 -4.377 -2.816
230 HG21 THR 34 HG21 THR 34 7.846 -6.880 0.344
231 HG22 THR 34 HG22 THR 34 9.034 -5.649 -0.114
232 HG23 THR 34 HG23 THR 34 8.879 -7.125 -1.084
233 H ARG 35 H ARG 35 5.998 -9.146 -1.474
234 HA ARG 35 HA ARG 35 7.344 -10.095 -3.972
235 HB2 ARG 35 HB2 ARG 35 8.726 -10.560 -2.039
236 HB3 ARG 35 HB3 ARG 35 7.362 -11.247 -1.162
237 HG2 ARG 35 HG2 ARG 35 8.831 -13.004 -1.927
238 HG3 ARG 35 HG3 ARG 35 7.262 -13.152 -2.709
239 HD2 ARG 35 HD2 ARG 35 8.230 -12.069 -4.770
240 HD3 ARG 35 HD3 ARG 35 9.792 -11.988 -3.949
241 HE ARG 35 HE ARG 35 10.086 -14.275 -4.194
242 HH11 ARG 35 HH11 ARG 35 6.794 -13.438 -5.300
243 HH12 ARG 35 HH12 ARG 35 6.526 -15.014 -6.011
244 HH21 ARG 35 HH21 ARG 35 9.687 -16.295 -5.130
245 HH22 ARG 35 HH22 ARG 35 8.159 -16.621 -5.918
246 H GLN 36 H GLN 36 4.676 -10.645 -1.662
247 HA GLN 36 HA GLN 36 3.561 -12.800 -3.306
248 HB2 GLN 36 HB2 GLN 36 2.306 -11.571 -0.855
249 HB3 GLN 36 HB3 GLN 36 1.967 -13.138 -1.579
250 HG2 GLN 36 HG2 GLN 36 4.474 -12.309 -0.078
251 HG3 GLN 36 HG3 GLN 36 3.261 -13.445 0.440
252 HE21 GLN 36 HE21 GLN 36 6.017 -13.999 0.430
253 HE22 GLN 36 HE22 GLN 36 6.331 -15.250 -0.770
254 H ARG 37 H ARG 37 3.254 -9.451 -3.403
255 HA ARG 37 HA ARG 37 0.947 -9.589 -5.286
256 HB2 ARG 37 HB2 ARG 37 1.022 -7.935 -3.235
257 HB3 ARG 37 HB3 ARG 37 2.207 -7.061 -4.192
258 HG2 ARG 37 HG2 ARG 37 0.090 -6.034 -4.509
259 HG3 ARG 37 HG3 ARG 37 0.496 -6.834 -6.020
260 HD2 ARG 37 HD2 ARG 37 -1.848 -7.156 -5.565
261 HD3 ARG 37 HD3 ARG 37 -1.048 -8.714 -5.411
262 HE ARG 37 HE ARG 37 -2.059 -6.968 -3.202
263 HH11 ARG 37 HH11 ARG 37 -0.886 -10.190 -4.191
264 HH12 ARG 37 HH12 ARG 37 -1.302 -10.920 -2.657
265 HH21 ARG 37 HH21 ARG 37 -2.557 -7.952 -1.238
266 HH22 ARG 37 HH22 ARG 37 -2.239 -9.654 -0.985
267 H ASP 38 H ASP 38 1.459 -7.942 -7.246
268 HA ASP 38 HA ASP 38 4.244 -8.323 -8.195
269 HB2 ASP 38 HB2 ASP 38 1.790 -7.059 -9.425
270 HB3 ASP 38 HB3 ASP 38 3.410 -6.775 -10.069
271 H ALA 39 H ALA 39 5.849 -6.943 -7.842
272 HA ALA 39 HA ALA 39 5.551 -5.296 -5.625
273 HB1 ALA 39 HB1 ALA 39 7.892 -5.401 -7.561
274 HB2 ALA 39 HB2 ALA 39 7.938 -4.873 -5.867
275 HB3 ALA 39 HB3 ALA 39 7.571 -6.562 -6.258
276 H ASN 40 H ASN 40 6.289 -4.092 -8.961
277 HA ASN 40 HA ASN 40 5.907 -1.247 -8.141
278 HB2 ASN 40 HB2 ASN 40 6.413 -2.613 -10.837
279 HB3 ASN 40 HB3 ASN 40 6.339 -0.881 -10.574
280 HD21 ASN 40 HD21 ASN 40 8.507 -2.357 -11.674
281 HD22 ASN 40 HD22 ASN 40 9.896 -1.978 -10.660
282 H TRP 41 H TRP 41 3.781 -3.828 -9.267
283 HA TRP 41 HA TRP 41 1.624 -2.052 -10.100
284 HB2 TRP 41 HB2 TRP 41 1.401 -4.438 -10.495
285 HB3 TRP 41 HB3 TRP 41 1.579 -4.788 -8.780
286 HD1 TRP 41 HD1 TRP 41 -0.921 -3.588 -11.302
287 HE1 TRP 41 HE1 TRP 41 -3.264 -3.444 -10.307
288 HE3 TRP 41 HE3 TRP 41 0.290 -4.457 -6.424
289 HZ2 TRP 41 HZ2 TRP 41 -4.398 -3.378 -7.616
290 HZ3 TRP 41 HZ3 TRP 41 -1.438 -4.242 -4.634
291 HH2 TRP 41 HH2 TRP 41 -3.780 -3.693 -5.228
292 H LEU 42 H LEU 42 2.666 -3.421 -6.927
293 HA LEU 42 HA LEU 42 0.741 -1.974 -5.418
294 HB2 LEU 42 HB2 LEU 42 1.867 -4.015 -4.714
295 HB3 LEU 42 HB3 LEU 42 3.394 -3.176 -4.539
296 HG LEU 42 HG LEU 42 1.028 -2.077 -3.013
297 HD11 LEU 42 HD11 LEU 42 0.772 -4.454 -2.627
298 HD12 LEU 42 HD12 LEU 42 1.471 -3.726 -1.183
299 HD13 LEU 42 HD13 LEU 42 2.511 -4.634 -2.312
300 HD21 LEU 42 HD21 LEU 42 3.256 -0.978 -2.812
301 HD22 LEU 42 HD22 LEU 42 3.972 -2.519 -2.311
302 HD23 LEU 42 HD23 LEU 42 2.774 -1.713 -1.280
303 H VAL 43 H VAL 43 4.068 -1.039 -6.394
304 HA VAL 43 HA VAL 43 4.020 1.423 -4.918
305 HB VAL 43 HB VAL 43 5.969 1.978 -5.884
306 HG11 VAL 43 HG11 VAL 43 6.055 -0.206 -4.658
307 HG12 VAL 43 HG12 VAL 43 6.468 -0.895 -6.237
308 HG13 VAL 43 HG13 VAL 43 7.466 0.365 -5.562
309 HG21 VAL 43 HG21 VAL 43 7.000 1.114 -7.971
310 HG22 VAL 43 HG22 VAL 43 5.332 0.741 -8.457
311 HG23 VAL 43 HG23 VAL 43 5.775 2.381 -8.051
312 H ARG 44 H ARG 44 2.749 0.701 -8.178
313 HA ARG 44 HA ARG 44 1.967 3.463 -8.703
314 HB2 ARG 44 HB2 ARG 44 2.281 1.915 -10.525
315 HB3 ARG 44 HB3 ARG 44 1.126 0.775 -9.847
316 HG2 ARG 44 HG2 ARG 44 0.145 1.912 -11.734
317 HG3 ARG 44 HG3 ARG 44 -0.728 2.340 -10.264
318 HD2 ARG 44 HD2 ARG 44 0.483 4.512 -10.180
319 HD3 ARG 44 HD3 ARG 44 1.372 4.058 -11.650
320 HE ARG 44 HE ARG 44 -1.478 3.863 -12.027
321 HH11 ARG 44 HH11 ARG 44 1.152 6.269 -11.909
322 HH12 ARG 44 HH12 ARG 44 0.287 7.415 -12.910
323 HH21 ARG 44 HH21 ARG 44 -2.560 5.375 -13.317
324 HH22 ARG 44 HH22 ARG 44 -1.811 6.907 -13.709
325 H TRP 45 H TRP 45 0.208 0.570 -7.520
326 HA TRP 45 HA TRP 45 -2.363 1.591 -7.132
327 HB2 TRP 45 HB2 TRP 45 -1.848 -0.757 -6.850
328 HB3 TRP 45 HB3 TRP 45 -0.723 -0.409 -5.547
329 HD1 TRP 45 HD1 TRP 45 -1.602 -0.859 -3.230
330 HE1 TRP 45 HE1 TRP 45 -3.927 -1.011 -2.089
331 HE3 TRP 45 HE3 TRP 45 -4.556 0.443 -7.187
332 HZ2 TRP 45 HZ2 TRP 45 -6.666 -0.548 -2.780
333 HZ3 TRP 45 HZ3 TRP 45 -7.003 0.664 -6.905
334 HH2 TRP 45 HH2 TRP 45 -8.074 0.163 -4.716
335 H LEU 46 H LEU 46 0.326 1.672 -4.756
336 HA LEU 46 HA LEU 46 -1.140 3.065 -2.766
337 HB2 LEU 46 HB2 LEU 46 0.831 1.667 -2.386
338 HB3 LEU 46 HB3 LEU 46 1.846 2.782 -3.300
339 HG LEU 46 HG LEU 46 1.657 4.480 -1.615
340 HD11 LEU 46 HD11 LEU 46 -0.239 2.570 -0.150
341 HD12 LEU 46 HD12 LEU 46 -0.678 4.152 -0.809
342 HD13 LEU 46 HD13 LEU 46 0.436 4.082 0.534
343 HD21 LEU 46 HD21 LEU 46 2.723 3.331 0.278
344 HD22 LEU 46 HD22 LEU 46 3.317 2.727 -1.271
345 HD23 LEU 46 HD23 LEU 46 2.152 1.757 -0.349
346 H LYS 47 H LYS 47 0.434 4.379 -5.645
347 HA LYS 47 HA LYS 47 0.425 7.094 -4.525
348 HB2 LYS 47 HB2 LYS 47 2.273 6.175 -5.979
349 HB3 LYS 47 HB3 LYS 47 1.170 6.259 -7.360
350 HG2 LYS 47 HG2 LYS 47 1.108 8.620 -7.307
351 HG3 LYS 47 HG3 LYS 47 1.505 8.675 -5.595
352 HD2 LYS 47 HD2 LYS 47 3.348 9.580 -6.617
353 HD3 LYS 47 HD3 LYS 47 3.863 7.966 -6.144
354 HE2 LYS 47 HE2 LYS 47 3.752 7.187 -8.448
355 HE3 LYS 47 HE3 LYS 47 2.921 8.672 -8.952
356 HZ1 LYS 47 HZ1 LYS 47 5.286 8.786 -9.510
357 HZ2 LYS 47 HZ2 LYS 47 5.706 8.578 -7.921
358 HZ3 LYS 47 HZ3 LYS 47 4.921 9.926 -8.373
359 H VAL 48 H VAL 48 -1.823 5.153 -6.365
360 HA VAL 48 HA VAL 48 -3.765 7.357 -6.359
361 HB VAL 48 HB VAL 48 -2.282 7.865 -8.274
362 HG11 VAL 48 HG11 VAL 48 -1.864 5.512 -9.066
363 HG12 VAL 48 HG12 VAL 48 -3.475 5.548 -9.816
364 HG13 VAL 48 HG13 VAL 48 -2.254 6.739 -10.285
365 HG21 VAL 48 HG21 VAL 48 -4.424 8.832 -8.171
366 HG22 VAL 48 HG22 VAL 48 -4.121 8.350 -9.847
367 HG23 VAL 48 HG23 VAL 48 -5.197 7.376 -8.814
368 HA PRO 49 HA PRO 49 -5.383 2.974 -6.203
369 HB2 PRO 49 HB2 PRO 49 -7.006 3.171 -3.975
370 HB3 PRO 49 HB3 PRO 49 -5.265 2.772 -3.940
371 HG2 PRO 49 HG2 PRO 49 -6.556 5.486 -3.536
372 HG3 PRO 49 HG3 PRO 49 -5.303 4.695 -2.525
373 HD2 PRO 49 HD2 PRO 49 -4.620 6.532 -4.394
374 HD3 PRO 49 HD3 PRO 49 -3.622 5.074 -4.159
375 H ASP 50 H ASP 50 -7.312 5.990 -5.784
376 HA ASP 50 HA ASP 50 -9.783 4.857 -6.673
377 HB2 ASP 50 HB2 ASP 50 -9.627 6.956 -5.400
378 HB3 ASP 50 HB3 ASP 50 -8.828 7.744 -6.767
379 H GLN 51 H GLN 51 -7.132 6.380 -8.588
380 HA GLN 51 HA GLN 51 -8.707 6.324 -11.024
381 HB2 GLN 51 HB2 GLN 51 -6.660 7.844 -10.451
382 HB3 GLN 51 HB3 GLN 51 -5.695 6.474 -11.010
383 HG2 GLN 51 HG2 GLN 51 -7.442 6.637 -13.086
384 HG3 GLN 51 HG3 GLN 51 -7.587 8.293 -12.512
385 HE21 GLN 51 HE21 GLN 51 -5.750 9.733 -12.914
386 HE22 GLN 51 HE22 GLN 51 -4.630 9.196 -14.183
387 H MET 52 H MET 52 -6.307 4.098 -9.555
388 HA MET 52 HA MET 52 -6.176 2.254 -11.739
389 HB2 MET 52 HB2 MET 52 -5.730 2.191 -8.723
390 HB3 MET 52 HB3 MET 52 -5.557 0.704 -9.670
391 HG2 MET 52 HG2 MET 52 -4.051 3.290 -10.193
392 HG3 MET 52 HG3 MET 52 -3.461 1.989 -9.163
393 HE1 MET 52 HE1 MET 52 -2.491 -0.866 -11.463
394 HE2 MET 52 HE2 MET 52 -2.351 -0.110 -9.858
395 HE3 MET 52 HE3 MET 52 -3.930 -0.683 -10.433
396 H LEU 53 H LEU 53 -8.531 2.494 -9.003
397 HA LEU 53 HA LEU 53 -10.057 0.181 -9.973
398 HB2 LEU 53 HB2 LEU 53 -10.722 2.418 -8.023
399 HB3 LEU 53 HB3 LEU 53 -11.858 1.139 -8.451
400 HG LEU 53 HG LEU 53 -9.166 0.677 -7.154
401 HD11 LEU 53 HD11 LEU 53 -10.746 1.804 -5.647
402 HD12 LEU 53 HD12 LEU 53 -10.493 0.127 -5.135
403 HD13 LEU 53 HD13 LEU 53 -11.980 0.570 -5.998
404 HD21 LEU 53 HD21 LEU 53 -11.439 -1.287 -7.653
405 HD22 LEU 53 HD22 LEU 53 -9.968 -1.604 -6.706
406 HD23 LEU 53 HD23 LEU 53 -9.845 -1.315 -8.435
407 H ALA 54 H ALA 54 -10.126 3.676 -10.695
408 HA ALA 54 HA ALA 54 -12.603 3.592 -12.155
409 HB1 ALA 54 HB1 ALA 54 -11.502 5.698 -11.362
410 HB2 ALA 54 HB2 ALA 54 -10.234 5.466 -12.584
411 HB3 ALA 54 HB3 ALA 54 -11.910 5.727 -13.085
412 H GLU 55 H GLU 55 -9.196 3.223 -13.233
413 HA GLU 55 HA GLU 55 -9.831 2.736 -15.980
414 HB2 GLU 55 HB2 GLU 55 -7.566 2.628 -16.305
415 HB3 GLU 55 HB3 GLU 55 -7.672 3.613 -14.875
416 HG2 GLU 55 HG2 GLU 55 -6.967 1.662 -13.535
417 HG3 GLU 55 HG3 GLU 55 -6.992 0.634 -14.962
418 H LYS 56 H LYS 56 -10.452 0.727 -13.444
419 HA LYS 56 HA LYS 56 -10.748 -1.484 -13.064
420 HB2 LYS 56 HB2 LYS 56 -11.177 -1.785 -16.054
421 HB3 LYS 56 HB3 LYS 56 -11.754 -2.839 -14.762
422 HG2 LYS 56 HG2 LYS 56 -13.205 -0.973 -13.924
423 HG3 LYS 56 HG3 LYS 56 -12.658 0.016 -15.302
424 HD2 LYS 56 HD2 LYS 56 -13.457 -1.834 -16.837
425 HD3 LYS 56 HD3 LYS 56 -14.202 -2.610 -15.424
426 HE2 LYS 56 HE2 LYS 56 -15.567 -0.552 -15.043
427 HE3 LYS 56 HE3 LYS 56 -14.790 0.209 -16.442
428 HZ1 LYS 56 HZ1 LYS 56 -16.540 -2.178 -16.473
429 HZ2 LYS 56 HZ2 LYS 56 -15.669 -1.666 -17.790
430 HZ3 LYS 56 HZ3 LYS 56 -16.858 -0.718 -17.157
431 H ASP 57 H ASP 57 -8.270 -1.079 -12.738
432 HA ASP 57 HA ASP 57 -6.576 -2.983 -14.259
433 HB2 ASP 57 HB2 ASP 57 -5.616 -0.855 -13.304
434 HB3 ASP 57 HB3 ASP 57 -5.934 -1.491 -11.685
435 HA PRO 58 HA PRO 58 -9.297 -5.568 -12.196
436 HB2 PRO 58 HB2 PRO 58 -8.675 -7.987 -13.273
437 HB3 PRO 58 HB3 PRO 58 -9.287 -6.560 -14.187
438 HG2 PRO 58 HG2 PRO 58 -6.348 -7.281 -13.883
439 HG3 PRO 58 HG3 PRO 58 -7.300 -7.176 -15.421
440 HD2 PRO 58 HD2 PRO 58 -5.912 -5.119 -14.426
441 HD3 PRO 58 HD3 PRO 58 -7.542 -4.855 -15.104
442 H LEU 59 H LEU 59 -5.921 -6.131 -11.727
443 HA LEU 59 HA LEU 59 -6.084 -7.945 -9.475
444 HB2 LEU 59 HB2 LEU 59 -4.040 -7.621 -10.799
445 HB3 LEU 59 HB3 LEU 59 -3.934 -5.945 -10.270
446 HG LEU 59 HG LEU 59 -3.499 -6.652 -7.959
447 HD11 LEU 59 HD11 LEU 59 -4.775 -8.735 -7.790
448 HD12 LEU 59 HD12 LEU 59 -3.076 -9.059 -7.437
449 HD13 LEU 59 HD13 LEU 59 -3.746 -9.501 -9.025
450 HD21 LEU 59 HD21 LEU 59 -1.302 -7.665 -8.301
451 HD22 LEU 59 HD22 LEU 59 -1.613 -6.484 -9.582
452 HD23 LEU 59 HD23 LEU 59 -1.770 -8.213 -9.926
453 H ALA 60 H ALA 60 -6.363 -4.362 -9.717
454 HA ALA 60 HA ALA 60 -6.499 -3.980 -6.818
455 HB1 ALA 60 HB1 ALA 60 -7.582 -2.234 -9.066
456 HB2 ALA 60 HB2 ALA 60 -7.370 -1.799 -7.366
457 HB3 ALA 60 HB3 ALA 60 -5.949 -2.097 -8.386
458 H MET 61 H MET 61 -8.848 -4.467 -9.446
459 HA MET 61 HA MET 61 -11.222 -4.223 -7.880
460 HB2 MET 61 HB2 MET 61 -10.922 -5.995 -10.317
461 HB3 MET 61 HB3 MET 61 -12.368 -5.165 -9.747
462 HG2 MET 61 HG2 MET 61 -9.911 -3.779 -10.878
463 HG3 MET 61 HG3 MET 61 -11.324 -4.208 -11.814
464 HE1 MET 61 HE1 MET 61 -13.845 -3.466 -10.380
465 HE2 MET 61 HE2 MET 61 -14.014 -1.762 -10.863
466 HE3 MET 61 HE3 MET 61 -13.383 -2.965 -12.023
467 H LEU 62 H LEU 62 -9.030 -6.952 -8.228
468 HA LEU 62 HA LEU 62 -10.691 -8.789 -6.632
469 HB2 LEU 62 HB2 LEU 62 -7.728 -8.683 -7.292
470 HB3 LEU 62 HB3 LEU 62 -8.466 -9.947 -6.331
471 HG LEU 62 HG LEU 62 -9.043 -9.404 -9.262
472 HD11 LEU 62 HD11 LEU 62 -6.829 -10.393 -8.802
473 HD12 LEU 62 HD12 LEU 62 -7.900 -11.544 -9.607
474 HD13 LEU 62 HD13 LEU 62 -7.599 -11.688 -7.860
475 HD21 LEU 62 HD21 LEU 62 -10.107 -11.592 -7.432
476 HD22 LEU 62 HD22 LEU 62 -10.297 -11.526 -9.213
477 HD23 LEU 62 HD23 LEU 62 -11.063 -10.304 -8.201
478 H LEU 63 H LEU 63 -7.853 -6.607 -5.999
479 HA LEU 63 HA LEU 63 -7.371 -7.762 -3.457
480 HB2 LEU 63 HB2 LEU 63 -5.714 -6.748 -4.936
481 HB3 LEU 63 HB3 LEU 63 -6.463 -5.170 -4.794
482 HG LEU 63 HG LEU 63 -4.303 -5.548 -3.574
483 HD11 LEU 63 HD11 LEU 63 -4.843 -4.228 -1.675
484 HD12 LEU 63 HD12 LEU 63 -6.539 -4.716 -1.699
485 HD13 LEU 63 HD13 LEU 63 -5.893 -3.706 -3.008
486 HD21 LEU 63 HD21 LEU 63 -6.010 -7.179 -1.669
487 HD22 LEU 63 HD22 LEU 63 -4.325 -6.697 -1.418
488 HD23 LEU 63 HD23 LEU 63 -4.740 -7.816 -2.735
489 H PHE 64 H PHE 64 -9.149 -4.869 -4.433
490 HA PHE 64 HA PHE 64 -9.473 -3.929 -1.700
491 HB2 PHE 64 HB2 PHE 64 -10.358 -2.087 -2.529
492 HB3 PHE 64 HB3 PHE 64 -9.690 -2.647 -4.041
493 HD1 PHE 64 HD2 PHE 64 -12.753 -2.218 -2.025
494 HD2 PHE 64 HD1 PHE 64 -11.207 -3.401 -5.852
495 HE1 PHE 64 HE2 PHE 64 -15.022 -2.043 -2.985
496 HE2 PHE 64 HE1 PHE 64 -13.484 -3.219 -6.832
497 HZ PHE 64 HZ PHE 64 -15.408 -2.568 -5.393
498 H GLU 65 H GLU 65 -11.414 -6.087 -3.743
499 HA GLU 65 HA GLU 65 -13.653 -6.109 -1.917
500 HB2 GLU 65 HB2 GLU 65 -12.927 -8.012 -4.165
501 HB3 GLU 65 HB3 GLU 65 -14.381 -8.133 -3.167
502 HG2 GLU 65 HG2 GLU 65 -14.696 -5.579 -3.838
503 HG3 GLU 65 HG3 GLU 65 -13.688 -6.037 -5.211
504 H GLN 66 H GLN 66 -10.607 -7.818 -1.704
505 HA GLN 66 HA GLN 66 -11.696 -9.960 -0.057
506 HB2 GLN 66 HB2 GLN 66 -8.851 -8.984 -0.589
507 HB3 GLN 66 HB3 GLN 66 -9.181 -10.332 0.488
508 HG2 GLN 66 HG2 GLN 66 -9.923 -10.267 -2.443
509 HG3 GLN 66 HG3 GLN 66 -8.484 -11.026 -1.789
510 HE21 GLN 66 HE21 GLN 66 -11.573 -11.756 -2.821
511 HE22 GLN 66 HE22 GLN 66 -11.858 -13.210 -1.889
512 H TYR 67 H TYR 67 -11.101 -6.734 0.718
513 HA TYR 67 HA TYR 67 -10.951 -7.408 3.631
514 HB2 TYR 67 HB2 TYR 67 -9.428 -5.266 2.144
515 HB3 TYR 67 HB3 TYR 67 -9.360 -5.573 3.880
516 HD1 TYR 67 HD1 TYR 67 -8.803 -8.155 4.499
517 HD2 TYR 67 HD2 TYR 67 -7.699 -6.201 0.807
518 HE1 TYR 67 HE1 TYR 67 -7.125 -9.935 4.048
519 HE2 TYR 67 HE2 TYR 67 -5.953 -7.943 0.417
520 HH TYR 67 HH TYR 67 -5.749 -10.837 2.482
521 H ASN 68 H ASN 68 -13.176 -7.224 3.650
522 HA ASN 68 HA ASN 68 -15.188 -6.303 3.907
523 HB2 ASN 68 HB2 ASN 68 -13.786 -5.355 5.823
524 HB3 ASN 68 HB3 ASN 68 -13.749 -3.833 4.933
525 HD21 ASN 68 HD21 ASN 68 -15.412 -2.398 5.522
526 HD22 ASN 68 HD22 ASN 68 -16.914 -2.922 6.252
527 H ARG 69 H ARG 69 -13.963 -5.762 1.202
528 HA ARG 69 HA ARG 69 -14.232 -4.481 -0.664
529 HB2 ARG 69 HB2 ARG 69 -16.858 -3.390 0.289
530 HB3 ARG 69 HB3 ARG 69 -16.371 -3.855 -1.329
531 HG2 ARG 69 HG2 ARG 69 -17.083 -5.721 0.973
532 HG3 ARG 69 HG3 ARG 69 -18.107 -5.304 -0.395
533 HD2 ARG 69 HD2 ARG 69 -16.643 -6.448 -1.952
534 HD3 ARG 69 HD3 ARG 69 -15.447 -6.734 -0.675
535 HE ARG 69 HE ARG 69 -17.564 -7.908 0.434
536 HH11 ARG 69 HH11 ARG 69 -16.365 -8.276 -2.908
537 HH12 ARG 69 HH12 ARG 69 -16.970 -9.912 -3.044
538 HH21 ARG 69 HH21 ARG 69 -18.320 -10.006 0.213
539 HH22 ARG 69 HH22 ARG 69 -18.079 -10.891 -1.278
540 H LEU 70 H LEU 70 -12.914 -3.092 1.664
541 HA LEU 70 HA LEU 70 -14.113 -0.689 2.286
542 HB2 LEU 70 HB2 LEU 70 -12.443 -1.880 3.594
543 HB3 LEU 70 HB3 LEU 70 -11.164 -1.404 2.485
544 HG LEU 70 HG LEU 70 -12.821 0.773 3.778
545 HD11 LEU 70 HD11 LEU 70 -11.496 0.800 5.788
546 HD12 LEU 70 HD12 LEU 70 -10.618 -0.658 5.278
547 HD13 LEU 70 HD13 LEU 70 -12.355 -0.734 5.646
548 HD21 LEU 70 HD21 LEU 70 -10.985 1.407 2.211
549 HD22 LEU 70 HD22 LEU 70 -9.827 0.502 3.200
550 HD23 LEU 70 HD23 LEU 70 -10.642 1.948 3.852
551 H ALA 71 H ALA 71 -11.744 -1.070 -0.338
552 HA ALA 71 HA ALA 71 -11.190 0.214 -2.089
553 HB1 ALA 71 HB1 ALA 71 -13.781 1.715 -1.602
554 HB2 ALA 71 HB2 ALA 71 -12.853 1.626 -3.111
555 HB3 ALA 71 HB3 ALA 71 -13.630 0.172 -2.456
556 H MET 72 H MET 72 -9.447 0.882 -0.476
557 HA MET 72 HA MET 72 -9.410 3.112 1.083
558 HB2 MET 72 HB2 MET 72 -7.740 1.291 0.959
559 HB3 MET 72 HB3 MET 72 -7.083 1.994 -0.523
560 HG2 MET 72 HG2 MET 72 -6.400 4.002 0.734
561 HG3 MET 72 HG3 MET 72 -7.186 3.374 2.183
562 HE1 MET 72 HE1 MET 72 -3.209 1.858 0.361
563 HE2 MET 72 HE2 MET 72 -4.749 1.520 -0.458
564 HE3 MET 72 HE3 MET 72 -4.199 3.200 -0.241
565 HA PRO 73 HA PRO 73 -9.134 6.650 -1.766
566 HB2 PRO 73 HB2 PRO 73 -8.932 8.691 0.007
567 HB3 PRO 73 HB3 PRO 73 -10.433 7.728 -0.163
568 HG2 PRO 73 HG2 PRO 73 -8.219 7.367 1.872
569 HG3 PRO 73 HG3 PRO 73 -9.980 7.499 2.180
570 HD2 PRO 73 HD2 PRO 73 -8.740 5.077 1.997
571 HD3 PRO 73 HD3 PRO 73 -10.390 5.329 1.368
572 H ASN 74 H ASN 74 -7.596 8.508 -2.195
573 HA ASN 74 HA ASN 74 -4.793 7.618 -1.947
574 HB2 ASN 74 HB2 ASN 74 -5.791 8.442 -4.112
575 HB3 ASN 74 HB3 ASN 74 -6.011 10.021 -3.378
576 HD21 ASN 74 HD21 ASN 74 -4.641 10.335 -5.497
577 HD22 ASN 74 HD22 ASN 74 -2.901 10.411 -5.164
578 H MET 75 H MET 75 -3.488 8.283 -0.325
579 HA MET 75 HA MET 75 -4.635 10.268 1.575
580 HB2 MET 75 HB2 MET 75 -2.847 7.868 1.942
581 HB3 MET 75 HB3 MET 75 -3.246 9.004 3.252
582 HG2 MET 75 HG2 MET 75 -5.638 8.593 2.928
583 HG3 MET 75 HG3 MET 75 -5.284 7.450 1.628
584 HE1 MET 75 HE1 MET 75 -6.843 5.738 2.791
585 HE2 MET 75 HE2 MET 75 -6.708 5.216 4.482
586 HE3 MET 75 HE3 MET 75 -7.156 6.893 4.109
587 H ARG 76 H ARG 76 -3.415 11.589 -0.369
588 HA ARG 76 HA ARG 76 -1.997 13.310 -0.749
589 HB2 ARG 76 HB2 ARG 76 -2.152 13.455 2.277
590 HB3 ARG 76 HB3 ARG 76 -1.606 14.769 1.234
591 HG2 ARG 76 HG2 ARG 76 -3.782 14.865 0.113
592 HG3 ARG 76 HG3 ARG 76 -4.391 13.539 1.128
593 HD2 ARG 76 HD2 ARG 76 -4.068 14.868 3.147
594 HD3 ARG 76 HD3 ARG 76 -3.316 16.171 2.228
595 HE ARG 76 HE ARG 76 -6.185 15.434 2.312
596 HH11 ARG 76 HH11 ARG 76 -3.711 17.633 0.966
597 HH12 ARG 76 HH12 ARG 76 -4.897 18.813 0.456
598 HH21 ARG 76 HH21 ARG 76 -7.675 16.993 1.635
599 HH22 ARG 76 HH22 ARG 76 -7.135 18.451 0.833
600 H LEU 77 H LEU 77 -0.433 10.681 -0.213
601 HA LEU 77 HA LEU 77 2.092 11.471 0.910
602 HB2 LEU 77 HB2 LEU 77 1.428 9.275 -1.087
603 HB3 LEU 77 HB3 LEU 77 2.971 9.446 -0.258
604 HG LEU 77 HG LEU 77 0.310 8.888 1.121
605 HD11 LEU 77 HD11 LEU 77 1.082 7.003 -0.255
606 HD12 LEU 77 HD12 LEU 77 1.244 6.630 1.463
607 HD13 LEU 77 HD13 LEU 77 2.685 7.073 0.522
608 HD21 LEU 77 HD21 LEU 77 3.165 8.903 2.212
609 HD22 LEU 77 HD22 LEU 77 1.717 8.365 3.098
610 HD23 LEU 77 HD23 LEU 77 1.876 10.055 2.628
611 H GLY 78 H GLY 78 3.733 12.656 0.119
612 HA2 GLY 78 HA2 GLY 78 3.819 13.755 -2.572
613 HA3 GLY 78 HA3 GLY 78 5.138 13.739 -1.396
614 H ASP 79 H ASP 79 5.511 13.218 -4.212
615 HA ASP 79 HA ASP 79 5.560 10.427 -4.871
616 HB2 ASP 79 HB2 ASP 79 7.300 12.704 -5.910
617 HB3 ASP 79 HB3 ASP 79 7.124 11.118 -6.660
618 H ALA 80 H ALA 80 7.906 12.481 -3.169
619 HA ALA 80 HA ALA 80 9.973 10.432 -2.947
620 HB1 ALA 80 HB1 ALA 80 9.573 13.043 -1.426
621 HB2 ALA 80 HB2 ALA 80 11.068 12.099 -1.550
622 HB3 ALA 80 HB3 ALA 80 10.407 12.894 -2.989
623 H GLU 81 H GLU 81 7.049 11.245 -1.171
624 HA GLU 81 HA GLU 81 7.823 9.767 1.253
625 HB2 GLU 81 HB2 GLU 81 5.102 10.862 0.472
626 HB3 GLU 81 HB3 GLU 81 5.567 10.183 2.031
627 HG2 GLU 81 HG2 GLU 81 7.326 11.979 2.231
628 HG3 GLU 81 HG3 GLU 81 6.664 12.733 0.780
629 H VAL 82 H VAL 82 5.678 9.163 -1.616
630 HA VAL 82 HA VAL 82 5.002 6.467 -0.864
631 HB VAL 82 HB VAL 82 5.423 7.526 -3.690
632 HG11 VAL 82 HG11 VAL 82 3.872 5.675 -4.312
633 HG12 VAL 82 HG12 VAL 82 5.355 5.048 -3.607
634 HG13 VAL 82 HG13 VAL 82 3.874 5.108 -2.628
635 HG21 VAL 82 HG21 VAL 82 2.877 7.341 -2.020
636 HG22 VAL 82 HG22 VAL 82 3.685 8.843 -2.526
637 HG23 VAL 82 HG23 VAL 82 2.961 7.789 -3.734
638 H SER 83 H SER 83 7.798 7.758 -2.696
639 HA SER 83 HA SER 83 9.220 5.362 -3.088
640 HB2 SER 83 HB2 SER 83 10.429 8.066 -2.376
641 HB3 SER 83 HB3 SER 83 11.245 6.724 -3.182
642 HG SER 83 HG SER 83 9.052 8.263 -4.187
643 H ALA 84 H ALA 84 8.978 7.308 -0.134
644 HA ALA 84 HA ALA 84 10.940 5.789 1.373
645 HB1 ALA 84 HB1 ALA 84 10.599 8.199 1.701
646 HB2 ALA 84 HB2 ALA 84 8.913 7.910 2.188
647 HB3 ALA 84 HB3 ALA 84 10.222 7.279 3.173
648 H LEU 85 H LEU 85 7.371 5.690 1.085
649 HA LEU 85 HA LEU 85 6.999 3.785 3.252
650 HB2 LEU 85 HB2 LEU 85 5.350 4.757 0.907
651 HB3 LEU 85 HB3 LEU 85 4.909 3.244 1.659
652 HG LEU 85 HG LEU 85 3.538 4.922 2.547
653 HD11 LEU 85 HD11 LEU 85 3.796 4.629 4.903
654 HD12 LEU 85 HD12 LEU 85 5.529 4.318 4.761
655 HD13 LEU 85 HD13 LEU 85 4.363 3.139 4.118
656 HD21 LEU 85 HD21 LEU 85 4.296 6.818 3.875
657 HD22 LEU 85 HD22 LEU 85 4.847 6.920 2.205
658 HD23 LEU 85 HD23 LEU 85 5.991 6.440 3.481
659 H ILE 86 H ILE 86 7.894 3.485 -0.128
660 HA ILE 86 HA ILE 86 7.608 0.583 -0.308
661 HB ILE 86 HB ILE 86 8.647 2.803 -2.026
662 HG12 ILE 86 HG12 ILE 86 7.238 1.773 -3.673
663 HG13 ILE 86 HG13 ILE 86 7.049 0.305 -2.697
664 HG21 ILE 86 HG21 ILE 86 10.540 1.273 -2.240
665 HG22 ILE 86 HG22 ILE 86 9.442 -0.110 -2.464
666 HG23 ILE 86 HG23 ILE 86 9.537 1.175 -3.686
667 HD11 ILE 86 HD11 ILE 86 5.841 3.023 -2.080
668 HD12 ILE 86 HD12 ILE 86 5.005 1.616 -2.742
669 HD13 ILE 86 HD13 ILE 86 5.639 1.552 -1.094
670 H SER 87 H SER 87 10.443 2.775 0.338
671 HA SER 87 HA SER 87 12.211 0.538 0.805
672 HB2 SER 87 HB2 SER 87 13.739 2.168 1.776
673 HB3 SER 87 HB3 SER 87 13.101 2.710 0.211
674 HG SER 87 HG SER 87 13.060 4.398 1.715
675 H TYR 88 H TYR 88 10.018 2.385 3.002
676 HA TYR 88 HA TYR 88 10.828 1.054 5.409
677 HB2 TYR 88 HB2 TYR 88 9.412 2.985 5.498
678 HB3 TYR 88 HB3 TYR 88 8.195 2.233 4.484
679 HD1 TYR 88 HD1 TYR 88 9.917 1.729 7.787
680 HD2 TYR 88 HD2 TYR 88 6.307 1.272 5.483
681 HE1 TYR 88 HE1 TYR 88 8.752 0.832 9.795
682 HE2 TYR 88 HE2 TYR 88 5.121 0.441 7.521
683 HH TYR 88 HH TYR 88 6.820 -0.051 10.625
684 H LEU 89 H LEU 89 8.436 0.014 2.896
685 HA LEU 89 HA LEU 89 7.574 -2.300 4.246
686 HB2 LEU 89 HB2 LEU 89 6.414 -0.899 2.505
687 HB3 LEU 89 HB3 LEU 89 7.593 -1.449 1.313
688 HG LEU 89 HG LEU 89 6.821 -3.773 1.749
689 HD11 LEU 89 HD11 LEU 89 5.728 -3.490 3.941
690 HD12 LEU 89 HD12 LEU 89 4.514 -4.001 2.770
691 HD13 LEU 89 HD13 LEU 89 4.608 -2.294 3.249
692 HD21 LEU 89 HD21 LEU 89 4.758 -3.514 0.377
693 HD22 LEU 89 HD22 LEU 89 6.061 -2.471 -0.207
694 HD23 LEU 89 HD23 LEU 89 4.738 -1.778 0.753
695 H GLU 90 H GLU 90 10.050 -1.858 1.670
696 HA GLU 90 HA GLU 90 10.899 -4.590 1.471
697 HB2 GLU 90 HB2 GLU 90 12.305 -1.929 1.009
698 HB3 GLU 90 HB3 GLU 90 13.133 -3.471 0.836
699 HG2 GLU 90 HG2 GLU 90 11.450 -4.178 -0.870
700 HG3 GLU 90 HG3 GLU 90 10.782 -2.537 -0.831
701 H GLU 91 H GLU 91 12.001 -1.985 3.720
702 HA GLU 91 HA GLU 91 14.054 -3.745 4.840
703 HB2 GLU 91 HB2 GLU 91 13.191 -0.920 5.466
704 HB3 GLU 91 HB3 GLU 91 14.464 -1.753 6.350
705 HG2 GLU 91 HG2 GLU 91 14.559 -1.410 3.323
706 HG3 GLU 91 HG3 GLU 91 15.220 -0.236 4.457
707 H GLU 92 H GLU 92 10.742 -2.859 5.952
708 HA GLU 92 HA GLU 92 11.190 -4.269 8.492
709 HB2 GLU 92 HB2 GLU 92 8.665 -3.558 6.966
710 HB3 GLU 92 HB3 GLU 92 8.648 -4.497 8.457
711 HG2 GLU 92 HG2 GLU 92 9.803 -1.689 8.233
712 HG3 GLU 92 HG3 GLU 92 8.177 -2.081 8.794
713 H THR 93 H THR 93 9.949 -5.298 5.283
714 HA THR 93 HA THR 93 9.432 -8.000 5.985
715 HB THR 93 HB THR 93 10.355 -6.864 3.314
716 HG1 THR 93 HG1 THR 93 8.504 -5.917 3.743
717 HG21 THR 93 HG21 THR 93 9.170 -8.783 2.310
718 HG22 THR 93 HG22 THR 93 8.903 -9.473 3.933
719 HG23 THR 93 HG23 THR 93 10.544 -9.319 3.272
720 H ALA 94 H ALA 94 12.515 -6.533 4.913
721 HA ALA 94 HA ALA 94 13.912 -9.079 4.943
722 HB1 ALA 94 HB1 ALA 94 14.910 -6.209 4.710
723 HB2 ALA 94 HB2 ALA 94 15.850 -7.674 4.358
724 HB3 ALA 94 HB3 ALA 94 14.435 -7.276 3.371
725 H ARG 95 H ARG 95 13.205 -6.833 7.510
726 HA ARG 95 HA ARG 95 15.528 -7.853 9.105
727 HB2 ARG 95 HB2 ARG 95 14.582 -4.982 9.119
728 HB3 ARG 95 HB3 ARG 95 15.974 -5.659 9.944
729 HG2 ARG 95 HG2 ARG 95 17.079 -6.164 7.794
730 HG3 ARG 95 HG3 ARG 95 15.684 -5.533 6.912
731 HD2 ARG 95 HD2 ARG 95 17.355 -3.843 6.904
732 HD3 ARG 95 HD3 ARG 95 16.026 -3.301 7.942
733 HE ARG 95 HE ARG 95 17.885 -4.575 9.614
734 HH11 ARG 95 HH11 ARG 95 17.844 -1.702 7.502
735 HH12 ARG 95 HH12 ARG 95 19.044 -0.854 8.453
736 HH21 ARG 95 HH21 ARG 95 19.436 -3.447 10.816
737 HH22 ARG 95 HH22 ARG 95 19.946 -1.845 10.334
738 H LEU 96 H LEU 96 12.224 -7.856 9.204
739 HA LEU 96 HA LEU 96 11.339 -7.005 11.631
740 HB2 LEU 96 HB2 LEU 96 10.243 -8.379 9.640
741 HB3 LEU 96 HB3 LEU 96 10.513 -9.740 10.639
742 HG LEU 96 HG LEU 96 8.273 -9.059 10.814
743 HD11 LEU 96 HD11 LEU 96 8.001 -8.738 13.159
744 HD12 LEU 96 HD12 LEU 96 9.644 -8.060 13.289
745 HD13 LEU 96 HD13 LEU 96 9.420 -9.782 12.872
746 HD21 LEU 96 HD21 LEU 96 8.704 -6.741 10.054
747 HD22 LEU 96 HD22 LEU 96 9.268 -6.327 11.685
748 HD23 LEU 96 HD23 LEU 96 7.584 -6.843 11.431
749 H GLN 97 H GLN 97 12.854 -10.218 11.172
750 HA GLN 97 HA GLN 97 13.951 -11.592 12.482
751 HB2 GLN 97 HB2 GLN 97 15.336 -9.465 12.280
752 HB3 GLN 97 HB3 GLN 97 14.935 -9.144 13.964
753 HG2 GLN 97 HG2 GLN 97 15.850 -11.907 13.582
754 HG3 GLN 97 HG3 GLN 97 16.987 -10.808 12.831
755 HE21 GLN 97 HE21 GLN 97 17.797 -12.428 14.875
756 HE22 GLN 97 HE22 GLN 97 18.154 -11.402 16.283
757 H THR 98 H THR 98 11.294 -11.450 13.417
758 HA THR 98 HA THR 98 11.784 -12.788 15.954
759 HB THR 98 HB THR 98 11.543 -10.765 16.999
760 HG1 THR 98 HG1 THR 98 10.140 -11.423 18.351
761 HG21 THR 98 HG21 THR 98 8.887 -10.236 15.615
762 HG22 THR 98 HG22 THR 98 10.415 -9.402 15.263
763 HG23 THR 98 HG23 THR 98 9.684 -9.243 16.855
764 HA PRO 99 HA PRO 99 8.016 -14.859 14.529
765 HB2 PRO 99 HB2 PRO 99 8.743 -17.399 14.877
766 HB3 PRO 99 HB3 PRO 99 9.535 -16.426 13.609
767 HG2 PRO 99 HG2 PRO 99 10.583 -17.063 16.384
768 HG3 PRO 99 HG3 PRO 99 11.449 -17.155 14.819
769 HD2 PRO 99 HD2 PRO 99 11.459 -14.952 16.592
770 HD3 PRO 99 HD3 PRO 99 11.913 -14.892 14.875
771 H VAL 100 H VAL 100 8.970 -13.671 17.259
772 HA VAL 100 HA VAL 100 7.666 -15.518 19.217
773 HB VAL 100 HB VAL 100 9.956 -13.537 19.444
774 HG11 VAL 100 HG11 VAL 100 10.148 -14.262 21.825
775 HG12 VAL 100 HG12 VAL 100 8.685 -13.324 21.531
776 HG13 VAL 100 HG13 VAL 100 8.584 -15.093 21.681
777 HG21 VAL 100 HG21 VAL 100 10.522 -15.764 18.518
778 HG22 VAL 100 HG22 VAL 100 11.239 -15.518 20.108
779 HG23 VAL 100 HG23 VAL 100 9.794 -16.537 19.935
780 H THR 101 H THR 101 7.763 -12.055 18.197
781 HA THR 101 HA THR 101 6.109 -11.026 20.273
782 HB THR 101 HB THR 101 5.500 -9.233 18.617
783 HG1 THR 101 HG1 THR 101 6.676 -9.288 16.660
784 HG21 THR 101 HG21 THR 101 7.730 -8.280 18.499
785 HG22 THR 101 HG22 THR 101 8.468 -9.879 18.719
786 HG23 THR 101 HG23 THR 101 7.567 -9.132 20.042
787 H ASN 102 H ASN 102 5.136 -12.853 17.396
788 HA ASN 102 HA ASN 102 2.304 -12.325 17.773
789 HB2 ASN 102 HB2 ASN 102 3.873 -14.344 16.133
790 HB3 ASN 102 HB3 ASN 102 2.113 -14.361 16.217
791 HD21 ASN 102 HD21 ASN 102 4.851 -12.696 14.832
792 HD22 ASN 102 HD22 ASN 102 3.856 -11.626 13.859
793 H ARG 103 H ARG 103 4.462 -14.458 19.476
794 HA ARG 103 HA ARG 103 2.157 -16.057 20.539
795 HB2 ARG 103 HB2 ARG 103 5.139 -16.591 20.753
796 HB3 ARG 103 HB3 ARG 103 3.836 -17.654 21.278
797 HG2 ARG 103 HG2 ARG 103 4.525 -16.905 18.403
798 HG3 ARG 103 HG3 ARG 103 4.787 -18.456 19.201
799 HD2 ARG 103 HD2 ARG 103 2.306 -18.709 19.474
800 HD3 ARG 103 HD3 ARG 103 2.085 -17.195 18.573
801 HE ARG 103 HE ARG 103 3.723 -19.114 17.152
802 HH11 ARG 103 HH11 ARG 103 0.335 -18.213 17.815
803 HH12 ARG 103 HH12 ARG 103 -0.263 -18.986 16.363
804 HH21 ARG 103 HH21 ARG 103 2.898 -20.105 15.282
805 HH22 ARG 103 HH22 ARG 103 1.183 -20.057 14.937
806 H GLY 104 H GLY 104 4.840 -13.947 21.585
807 HA2 GLY 104 HA2 GLY 104 4.611 -14.307 24.367
808 HA3 GLY 104 HA3 GLY 104 5.205 -12.844 23.572
809 H ILE 105 H ILE 105 2.587 -12.267 22.274
810 HA ILE 105 HA ILE 105 1.286 -10.972 24.573
811 HB ILE 105 HB ILE 105 0.701 -10.602 21.632
812 HG12 ILE 105 HG12 ILE 105 3.011 -9.945 21.966
813 HG13 ILE 105 HG13 ILE 105 2.005 -8.534 21.739
814 HG21 ILE 105 HG21 ILE 105 -0.295 -8.458 22.437
815 HG22 ILE 105 HG22 ILE 105 -1.143 -9.881 23.047
816 HG23 ILE 105 HG23 ILE 105 -0.045 -8.985 24.113
817 HD11 ILE 105 HD11 ILE 105 2.087 -8.062 24.184
818 HD12 ILE 105 HD12 ILE 105 3.104 -9.506 24.418
819 HD13 ILE 105 HD13 ILE 105 3.696 -8.141 23.457
820 HA PRO 106 HA PRO 106 -1.747 -14.298 24.355
821 HB2 PRO 106 HB2 PRO 106 -2.968 -13.978 26.749
822 HB3 PRO 106 HB3 PRO 106 -1.257 -14.491 26.618
823 HG2 PRO 106 HG2 PRO 106 -2.348 -11.701 27.091
824 HG3 PRO 106 HG3 PRO 106 -1.072 -12.557 28.020
825 HD2 PRO 106 HD2 PRO 106 -0.516 -10.781 26.002
826 HD3 PRO 106 HD3 PRO 106 0.512 -12.207 26.340
827 HHA HEC 107 HHA HEC 107 -4.520 -2.746 1.023
828 HHB HEC 107 HHB HEC 107 0.300 1.403 1.927
829 HHC HEC 107 HHC HEC 107 -3.503 4.925 5.828
830 HHD HEC 107 HHD HEC 107 -7.963 0.232 5.564
831 HMA1 HEC 107 HMA1 HEC 107 1.118 -0.463 0.913
832 HMA2 HEC 107 HMA2 HEC 107 0.579 -1.886 0.036
833 HMA3 HEC 107 HMA3 HEC 107 0.333 -0.279 -0.675
834 HAA1 HEC 107 HAA1 HEC 107 -3.045 -2.972 -0.680
835 HAA2 HEC 107 HAA2 HEC 107 -1.348 -2.747 -1.017
836 HBA1 HEC 107 HBA1 HEC 107 -0.692 -4.114 0.868
837 HBA2 HEC 107 HBA2 HEC 107 -2.345 -4.163 1.486
838 HMB1 HEC 107 HMB1 HEC 107 1.596 3.192 4.187
839 HMB2 HEC 107 HMB2 HEC 107 1.404 3.228 2.426
840 HMB3 HEC 107 HMB3 HEC 107 1.303 4.716 3.351
841 HAB HEC 107 HAB HEC 107 -1.664 5.852 5.699
842 HBB1 HEC 107 HBB1 HEC 107 -0.603 7.647 4.616
843 HBB2 HEC 107 HBB2 HEC 107 0.123 6.575 3.410
844 HBB3 HEC 107 HBB3 HEC 107 -1.635 6.781 3.465
845 HMC1 HEC 107 HMC1 HEC 107 -4.808 5.105 7.618
846 HMC2 HEC 107 HMC2 HEC 107 -6.342 5.620 6.892
847 HMC3 HEC 107 HMC3 HEC 107 -6.321 4.537 8.296
848 HAC HEC 107 HAC HEC 107 -8.667 1.712 6.783
849 HBC1 HEC 107 HBC1 HEC 107 -8.526 4.576 7.677
850 HBC2 HEC 107 HBC2 HEC 107 -9.117 4.041 6.091
851 HBC3 HEC 107 HBC3 HEC 107 -9.930 3.513 7.575
852 HMD1 HEC 107 HMD1 HEC 107 -8.571 -1.983 5.507
853 HMD2 HEC 107 HMD2 HEC 107 -9.371 -1.954 3.910
854 HMD3 HEC 107 HMD3 HEC 107 -8.477 -3.375 4.436
855 HAD1 HEC 107 HAD1 HEC 107 -6.360 -3.770 1.192
856 HAD2 HEC 107 HAD2 HEC 107 -7.462 -4.193 2.470
857 HBD1 HEC 107 HBD1 HEC 107 -8.574 -3.698 0.289
858 HBD2 HEC 107 HBD2 HEC 107 -9.156 -2.675 1.593
Start of MODEL 15
1 H SER 1 H SER 1 13.313 4.608 7.629
2 HA SER 1 HA SER 1 14.408 5.790 5.151
3 HB2 SER 1 HB2 SER 1 14.083 3.769 3.782
4 HB3 SER 1 HB3 SER 1 15.364 3.609 4.986
5 HG SER 1 HG SER 1 14.247 1.769 5.128
6 H GLY 2 H GLY 2 11.608 4.577 6.858
7 HA2 GLY 2 HA2 GLY 2 9.773 6.156 5.209
8 HA3 GLY 2 HA3 GLY 2 9.636 4.476 4.850
9 H GLU 3 H GLU 3 10.293 3.962 7.876
10 HA GLU 3 HA GLU 3 7.724 3.423 8.824
11 HB2 GLU 3 HB2 GLU 3 8.811 2.932 10.891
12 HB3 GLU 3 HB3 GLU 3 9.838 2.394 9.573
13 HG2 GLU 3 HG2 GLU 3 10.266 4.767 11.405
14 HG3 GLU 3 HG3 GLU 3 11.219 3.312 11.278
15 H GLN 4 H GLN 4 9.729 6.359 9.512
16 HA GLN 4 HA GLN 4 7.762 7.520 11.272
17 HB2 GLN 4 HB2 GLN 4 10.236 8.560 9.870
18 HB3 GLN 4 HB3 GLN 4 9.231 9.597 10.892
19 HG2 GLN 4 HG2 GLN 4 9.609 8.292 12.844
20 HG3 GLN 4 HG3 GLN 4 10.277 6.945 11.938
21 HE21 GLN 4 HE21 GLN 4 12.402 7.219 10.889
22 HE22 GLN 4 HE22 GLN 4 13.549 8.345 11.654
23 H ILE 5 H ILE 5 7.684 7.221 7.865
24 HA ILE 5 HA ILE 5 5.630 9.367 7.593
25 HB ILE 5 HB ILE 5 6.866 7.467 5.564
26 HG12 ILE 5 HG12 ILE 5 6.860 10.522 5.796
27 HG13 ILE 5 HG13 ILE 5 8.163 9.499 6.380
28 HG21 ILE 5 HG21 ILE 5 5.458 8.582 3.870
29 HG22 ILE 5 HG22 ILE 5 4.430 7.799 5.054
30 HG23 ILE 5 HG23 ILE 5 4.670 9.557 5.130
31 HD11 ILE 5 HD11 ILE 5 8.789 10.395 4.242
32 HD12 ILE 5 HD12 ILE 5 8.542 8.643 4.083
33 HD13 ILE 5 HD13 ILE 5 7.310 9.784 3.490
34 H PHE 6 H PHE 6 5.909 5.763 7.514
35 HA PHE 6 HA PHE 6 3.140 5.231 7.244
36 HB2 PHE 6 HB2 PHE 6 4.997 3.574 7.060
37 HB3 PHE 6 HB3 PHE 6 5.208 3.624 8.801
38 HD1 PHE 6 HD1 PHE 6 3.021 2.518 6.038
39 HD2 PHE 6 HD2 PHE 6 3.565 2.562 10.317
40 HE1 PHE 6 HE1 PHE 6 1.241 0.809 6.287
41 HE2 PHE 6 HE2 PHE 6 1.792 0.848 10.557
42 HZ PHE 6 HZ PHE 6 0.628 -0.030 8.552
43 H ARG 7 H ARG 7 5.026 5.590 10.240
44 HA ARG 7 HA ARG 7 2.971 5.305 12.163
45 HB2 ARG 7 HB2 ARG 7 5.361 5.088 12.547
46 HB3 ARG 7 HB3 ARG 7 5.630 6.782 12.129
47 HG2 ARG 7 HG2 ARG 7 4.526 7.536 14.151
48 HG3 ARG 7 HG3 ARG 7 4.036 5.872 14.560
49 HD2 ARG 7 HD2 ARG 7 6.347 5.199 14.822
50 HD3 ARG 7 HD3 ARG 7 6.933 6.748 14.187
51 HE ARG 7 HE ARG 7 5.562 7.660 16.262
52 HH11 ARG 7 HH11 ARG 7 7.743 4.846 16.173
53 HH12 ARG 7 HH12 ARG 7 8.298 5.091 17.814
54 HH21 ARG 7 HH21 ARG 7 6.317 7.958 18.373
55 HH22 ARG 7 HH22 ARG 7 7.493 6.858 19.059
56 H THR 8 H THR 8 3.520 7.995 10.036
57 HA THR 8 HA THR 8 1.822 9.765 11.741
58 HB THR 8 HB THR 8 2.826 11.683 10.588
59 HG1 THR 8 HG1 THR 8 4.952 10.135 9.723
60 HG21 THR 8 HG21 THR 8 4.962 9.896 11.833
61 HG22 THR 8 HG22 THR 8 3.766 10.824 12.746
62 HG23 THR 8 HG23 THR 8 4.942 11.673 11.727
63 H ARG 9 H ARG 9 1.811 8.123 8.742
64 HA ARG 9 HA ARG 9 -0.646 9.642 7.939
65 HB2 ARG 9 HB2 ARG 9 1.421 8.452 6.062
66 HB3 ARG 9 HB3 ARG 9 -0.023 9.355 5.628
67 HG2 ARG 9 HG2 ARG 9 1.070 11.257 7.145
68 HG3 ARG 9 HG3 ARG 9 2.553 10.348 6.837
69 HD2 ARG 9 HD2 ARG 9 2.470 12.020 5.168
70 HD3 ARG 9 HD3 ARG 9 1.981 10.535 4.333
71 HE ARG 9 HE ARG 9 -0.403 11.607 5.220
72 HH11 ARG 9 HH11 ARG 9 2.213 12.961 3.228
73 HH12 ARG 9 HH12 ARG 9 1.172 14.159 2.490
74 HH21 ARG 9 HH21 ARG 9 -1.705 13.166 4.279
75 HH22 ARG 9 HH22 ARG 9 -1.059 14.273 3.086
76 H CYS 10 H CYS 10 0.582 6.437 8.518
77 HA CYS 10 HA CYS 10 -1.697 5.216 6.995
78 HB2 CYS 10 HB2 CYS 10 1.111 4.190 7.398
79 HB3 CYS 10 HB3 CYS 10 -0.138 3.408 6.444
80 H SER 11 H SER 11 -0.191 5.235 10.138
81 HA SER 11 HA SER 11 -0.298 2.498 10.784
82 HB2 SER 11 HB2 SER 11 -0.193 3.335 13.162
83 HB3 SER 11 HB3 SER 11 1.050 3.962 12.069
84 HG SER 11 HG SER 11 -0.128 5.487 13.524
85 H SER 12 H SER 12 -2.865 4.931 11.282
86 HA SER 12 HA SER 12 -4.247 3.494 13.230
87 HB2 SER 12 HB2 SER 12 -5.366 5.642 11.414
88 HB3 SER 12 HB3 SER 12 -5.942 5.212 13.036
89 HG SER 12 HG SER 12 -4.563 7.055 12.937
90 H CYS 13 H CYS 13 -4.110 2.201 10.357
91 HA CYS 13 HA CYS 13 -6.816 0.879 10.435
92 HB2 CYS 13 HB2 CYS 13 -5.387 1.899 7.980
93 HB3 CYS 13 HB3 CYS 13 -6.796 0.843 7.990
94 H HIS 14 H HIS 14 -3.457 0.400 10.721
95 HA HIS 14 HA HIS 14 -3.480 -2.209 9.295
96 HB2 HIS 14 2HB HIS 14 -1.888 0.277 8.595
97 HB3 HIS 14 3HB HIS 14 -1.272 -1.315 8.183
98 HD1 HIS 14 1HD HIS 14 -3.811 -2.759 7.103
99 HD2 HIS 14 2HD HIS 14 -2.416 1.085 6.296
100 HE1 HIS 14 1HE HIS 14 -4.747 -2.194 4.814
101 H THR 15 H THR 15 -1.537 -3.249 9.217
102 HA THR 15 HA THR 15 0.395 -2.951 11.447
103 HB THR 15 HB THR 15 0.478 -5.440 11.772
104 HG1 THR 15 HG1 THR 15 -0.474 -6.308 10.112
105 HG21 THR 15 HG21 THR 15 -0.811 -3.950 13.341
106 HG22 THR 15 HG22 THR 15 -1.354 -5.632 13.282
107 HG23 THR 15 HG23 THR 15 -2.282 -4.377 12.432
108 H VAL 16 H VAL 16 2.482 -3.653 10.928
109 HA VAL 16 HA VAL 16 2.850 -4.956 8.263
110 HB VAL 16 HB VAL 16 4.922 -3.039 9.358
111 HG11 VAL 16 HG11 VAL 16 5.646 -4.853 7.768
112 HG12 VAL 16 HG12 VAL 16 4.431 -4.296 6.601
113 HG13 VAL 16 HG13 VAL 16 5.788 -3.243 7.052
114 HG21 VAL 16 HG21 VAL 16 4.179 -1.532 7.463
115 HG22 VAL 16 HG22 VAL 16 2.697 -2.503 7.368
116 HG23 VAL 16 HG23 VAL 16 3.081 -1.602 8.848
117 H GLY 17 H GLY 17 2.584 -6.822 9.310
118 HA2 GLY 17 HA2 GLY 17 3.626 -8.818 10.124
119 HA3 GLY 17 HA3 GLY 17 4.936 -7.872 10.852
120 H ASN 18 H ASN 18 1.413 -7.575 11.027
121 HA ASN 18 HA ASN 18 -0.033 -7.175 12.705
122 HB2 ASN 18 HB2 ASN 18 0.369 -9.656 12.633
123 HB3 ASN 18 HB3 ASN 18 1.308 -9.341 14.099
124 HD21 ASN 18 HD21 ASN 18 -0.439 -10.999 14.848
125 HD22 ASN 18 HD22 ASN 18 -1.943 -10.300 15.441
126 H THR 19 H THR 19 1.802 -5.260 12.917
127 HA THR 19 HA THR 19 3.172 -4.585 15.146
128 HB THR 19 HB THR 19 1.161 -2.715 13.846
129 HG1 THR 19 HG1 THR 19 3.362 -2.374 12.646
130 HG21 THR 19 HG21 THR 19 3.956 -2.228 14.952
131 HG22 THR 19 HG22 THR 19 2.447 -1.831 15.794
132 HG23 THR 19 HG23 THR 19 2.837 -1.012 14.288
133 H GLU 20 H GLU 20 2.738 -4.765 17.224
134 HA GLU 20 HA GLU 20 1.797 -4.727 19.240
135 HB2 GLU 20 HB2 GLU 20 0.410 -2.320 18.028
136 HB3 GLU 20 HB3 GLU 20 0.382 -2.683 19.741
137 HG2 GLU 20 HG2 GLU 20 2.895 -2.674 19.756
138 HG3 GLU 20 HG3 GLU 20 2.864 -2.116 18.074
139 HA PRO 21 HA PRO 21 -1.886 -6.914 19.998
140 HB2 PRO 21 HB2 PRO 21 -2.524 -5.030 22.268
141 HB3 PRO 21 HB3 PRO 21 -2.477 -6.819 22.271
142 HG2 PRO 21 HG2 PRO 21 -0.412 -5.440 23.301
143 HG3 PRO 21 HG3 PRO 21 -0.079 -6.821 22.200
144 HD2 PRO 21 HD2 PRO 21 -0.178 -3.867 21.535
145 HD3 PRO 21 HD3 PRO 21 1.090 -5.069 21.139
146 H GLY 22 H GLY 22 -4.169 -7.043 20.024
147 HA2 GLY 22 HA2 GLY 22 -6.372 -6.339 20.033
148 HA3 GLY 22 HA3 GLY 22 -5.849 -4.665 19.967
149 H GLN 23 H GLN 23 -6.594 -3.663 18.240
150 HA GLN 23 HA GLN 23 -6.282 -4.735 15.530
151 HB2 GLN 23 HB2 GLN 23 -8.477 -5.663 16.214
152 HB3 GLN 23 HB3 GLN 23 -9.040 -4.053 16.631
153 HG2 GLN 23 HG2 GLN 23 -8.794 -3.355 14.233
154 HG3 GLN 23 HG3 GLN 23 -8.198 -4.970 13.841
155 HE21 GLN 23 HE21 GLN 23 -10.097 -4.826 12.273
156 HE22 GLN 23 HE22 GLN 23 -11.630 -5.446 12.886
157 HA PRO 24 HA PRO 24 -5.667 -0.195 15.669
158 HB2 PRO 24 HB2 PRO 24 -4.043 0.098 13.487
159 HB3 PRO 24 HB3 PRO 24 -3.477 -0.480 15.074
160 HG2 PRO 24 HG2 PRO 24 -4.234 -2.127 12.649
161 HG3 PRO 24 HG3 PRO 24 -2.804 -2.307 13.716
162 HD2 PRO 24 HD2 PRO 24 -5.051 -3.845 13.975
163 HD3 PRO 24 HD3 PRO 24 -4.052 -3.372 15.382
164 H GLY 25 H GLY 25 -7.838 0.134 15.351
165 HA2 GLY 25 HA2 GLY 25 -9.710 0.958 14.336
166 HA3 GLY 25 HA3 GLY 25 -8.694 1.446 12.980
167 H ILE 26 H ILE 26 -8.089 -0.306 11.498
168 HA ILE 26 HA ILE 26 -10.521 -1.820 10.669
169 HB ILE 26 HB ILE 26 -8.228 -0.836 8.945
170 HG12 ILE 26 HG12 ILE 26 -9.188 1.169 9.795
171 HG13 ILE 26 HG13 ILE 26 -9.740 0.956 8.146
172 HG21 ILE 26 HG21 ILE 26 -9.471 -2.662 7.927
173 HG22 ILE 26 HG22 ILE 26 -11.005 -1.815 8.202
174 HG23 ILE 26 HG23 ILE 26 -9.803 -1.137 7.089
175 HD11 ILE 26 HD11 ILE 26 -11.519 1.808 9.549
176 HD12 ILE 26 HD12 ILE 26 -11.953 0.176 8.999
177 HD13 ILE 26 HD13 ILE 26 -11.369 0.446 10.663
178 H GLY 27 H GLY 27 -6.931 -2.080 10.339
179 HA2 GLY 27 HA2 GLY 27 -5.771 -3.651 11.658
180 HA3 GLY 27 HA3 GLY 27 -7.099 -4.778 11.548
181 HA PRO 28 HA PRO 28 -5.457 -6.927 8.184
182 HB2 PRO 28 HB2 PRO 28 -5.550 -6.123 5.551
183 HB3 PRO 28 HB3 PRO 28 -6.958 -6.697 6.496
184 HG2 PRO 28 HG2 PRO 28 -6.096 -3.840 5.984
185 HG3 PRO 28 HG3 PRO 28 -7.737 -4.547 5.833
186 HD2 PRO 28 HD2 PRO 28 -6.968 -3.165 8.032
187 HD3 PRO 28 HD3 PRO 28 -8.016 -4.614 8.184
188 H ASP 29 H ASP 29 -3.524 -7.667 7.453
189 HA ASP 29 HA ASP 29 -1.312 -5.906 8.087
190 HB2 ASP 29 HB2 ASP 29 -1.667 -8.163 9.097
191 HB3 ASP 29 HB3 ASP 29 -1.342 -8.896 7.517
192 H LEU 30 H LEU 30 0.642 -5.664 7.039
193 HA LEU 30 HA LEU 30 0.563 -5.913 4.057
194 HB2 LEU 30 HB2 LEU 30 2.060 -3.853 5.679
195 HB3 LEU 30 HB3 LEU 30 1.704 -3.817 3.956
196 HG LEU 30 HG LEU 30 -0.315 -3.525 6.220
197 HD11 LEU 30 HD11 LEU 30 0.766 -1.484 4.220
198 HD12 LEU 30 HD12 LEU 30 1.172 -1.578 5.947
199 HD13 LEU 30 HD13 LEU 30 -0.479 -1.189 5.464
200 HD21 LEU 30 HD21 LEU 30 -0.668 -3.246 3.184
201 HD22 LEU 30 HD22 LEU 30 -1.896 -2.830 4.405
202 HD23 LEU 30 HD23 LEU 30 -1.391 -4.503 4.198
203 H LEU 31 H LEU 31 2.300 -7.414 6.549
204 HA LEU 31 HA LEU 31 5.006 -7.096 5.536
205 HB2 LEU 31 HB2 LEU 31 4.491 -7.740 7.772
206 HB3 LEU 31 HB3 LEU 31 3.858 -9.302 7.240
207 HG LEU 31 HG LEU 31 6.593 -8.573 6.272
208 HD11 LEU 31 HD11 LEU 31 6.120 -9.210 9.195
209 HD12 LEU 31 HD12 LEU 31 6.694 -7.658 8.515
210 HD13 LEU 31 HD13 LEU 31 7.700 -9.113 8.385
211 HD21 LEU 31 HD21 LEU 31 7.093 -10.902 6.800
212 HD22 LEU 31 HD22 LEU 31 5.597 -10.798 5.858
213 HD23 LEU 31 HD23 LEU 31 5.520 -11.084 7.611
214 H GLY 32 H GLY 32 6.178 -8.328 4.147
215 HA2 GLY 32 HA2 GLY 32 6.645 -9.870 2.434
216 HA3 GLY 32 HA3 GLY 32 5.126 -10.687 2.773
217 H VAL 33 H VAL 33 4.047 -7.596 2.265
218 HA VAL 33 HA VAL 33 3.019 -8.084 -0.306
219 HB VAL 33 HB VAL 33 2.225 -6.417 1.402
220 HG11 VAL 33 HG11 VAL 33 4.396 -5.178 1.720
221 HG12 VAL 33 HG12 VAL 33 4.203 -4.500 0.089
222 HG13 VAL 33 HG13 VAL 33 3.010 -4.144 1.353
223 HG21 VAL 33 HG21 VAL 33 1.265 -4.897 -0.238
224 HG22 VAL 33 HG22 VAL 33 2.443 -5.431 -1.458
225 HG23 VAL 33 HG23 VAL 33 1.234 -6.565 -0.800
226 H THR 34 H THR 34 6.063 -6.660 0.579
227 HA THR 34 HA THR 34 7.023 -5.658 -1.907
228 HB THR 34 HB THR 34 7.910 -5.235 0.419
229 HG1 THR 34 HG1 THR 34 9.203 -4.518 -1.109
230 HG21 THR 34 HG21 THR 34 9.363 -7.892 0.054
231 HG22 THR 34 HG22 THR 34 8.001 -7.626 1.169
232 HG23 THR 34 HG23 THR 34 9.519 -6.762 1.400
233 H ARG 35 H ARG 35 6.472 -8.954 -1.048
234 HA ARG 35 HA ARG 35 7.957 -9.763 -3.512
235 HB2 ARG 35 HB2 ARG 35 8.305 -11.964 -2.645
236 HB3 ARG 35 HB3 ARG 35 9.101 -10.754 -1.644
237 HG2 ARG 35 HG2 ARG 35 7.568 -11.019 0.144
238 HG3 ARG 35 HG3 ARG 35 6.377 -11.865 -0.857
239 HD2 ARG 35 HD2 ARG 35 9.127 -13.001 -0.225
240 HD3 ARG 35 HD3 ARG 35 7.684 -13.328 0.742
241 HE ARG 35 HE ARG 35 8.323 -14.348 -1.933
242 HH11 ARG 35 HH11 ARG 35 5.717 -13.977 0.503
243 HH12 ARG 35 HH12 ARG 35 4.709 -15.191 -0.256
244 HH21 ARG 35 HH21 ARG 35 6.971 -15.875 -2.886
245 HH22 ARG 35 HH22 ARG 35 5.420 -16.268 -2.174
246 H GLN 36 H GLN 36 4.899 -10.007 -1.750
247 HA GLN 36 HA GLN 36 3.754 -11.919 -3.590
248 HB2 GLN 36 HB2 GLN 36 2.517 -9.933 -1.656
249 HB3 GLN 36 HB3 GLN 36 1.565 -11.082 -2.587
250 HG2 GLN 36 HG2 GLN 36 3.797 -11.960 -0.691
251 HG3 GLN 36 HG3 GLN 36 2.125 -11.730 -0.210
252 HE21 GLN 36 HE21 GLN 36 2.412 -14.047 0.455
253 HE22 GLN 36 HE22 GLN 36 1.890 -15.215 -0.753
254 H ARG 37 H ARG 37 4.060 -8.376 -3.791
255 HA ARG 37 HA ARG 37 2.221 -8.365 -6.162
256 HB2 ARG 37 HB2 ARG 37 2.925 -6.021 -4.384
257 HB3 ARG 37 HB3 ARG 37 1.680 -6.097 -5.628
258 HG2 ARG 37 HG2 ARG 37 1.694 -7.574 -2.964
259 HG3 ARG 37 HG3 ARG 37 0.697 -6.189 -3.398
260 HD2 ARG 37 HD2 ARG 37 -0.544 -7.507 -5.029
261 HD3 ARG 37 HD3 ARG 37 0.526 -8.895 -4.778
262 HE ARG 37 HE ARG 37 -0.823 -7.866 -2.385
263 HH11 ARG 37 HH11 ARG 37 -0.911 -10.321 -4.962
264 HH12 ARG 37 HH12 ARG 37 -1.982 -11.373 -4.060
265 HH21 ARG 37 HH21 ARG 37 -2.198 -9.251 -1.257
266 HH22 ARG 37 HH22 ARG 37 -2.715 -10.762 -1.971
267 H ASP 38 H ASP 38 2.696 -7.149 -7.983
268 HA ASP 38 HA ASP 38 5.402 -6.894 -8.852
269 HB2 ASP 38 HB2 ASP 38 3.623 -7.221 -10.435
270 HB3 ASP 38 HB3 ASP 38 2.779 -5.785 -9.905
271 H ALA 39 H ALA 39 6.873 -5.313 -8.748
272 HA ALA 39 HA ALA 39 6.620 -3.374 -6.718
273 HB1 ALA 39 HB1 ALA 39 8.718 -3.708 -8.898
274 HB2 ALA 39 HB2 ALA 39 8.924 -2.801 -7.384
275 HB3 ALA 39 HB3 ALA 39 8.684 -4.560 -7.338
276 H ASN 40 H ASN 40 5.742 -2.962 -10.078
277 HA ASN 40 HA ASN 40 5.846 0.006 -9.796
278 HB2 ASN 40 HB2 ASN 40 6.623 -1.361 -11.900
279 HB3 ASN 40 HB3 ASN 40 4.898 -1.457 -12.257
280 HD21 ASN 40 HD21 ASN 40 7.656 0.706 -11.797
281 HD22 ASN 40 HD22 ASN 40 6.900 2.106 -12.559
282 H TRP 41 H TRP 41 3.539 -2.678 -10.397
283 HA TRP 41 HA TRP 41 1.086 -1.268 -10.297
284 HB2 TRP 41 HB2 TRP 41 1.361 -3.674 -10.890
285 HB3 TRP 41 HB3 TRP 41 1.803 -4.010 -9.218
286 HD1 TRP 41 HD1 TRP 41 -1.220 -3.435 -11.406
287 HE1 TRP 41 HE1 TRP 41 -3.359 -3.952 -10.101
288 HE3 TRP 41 HE3 TRP 41 0.810 -4.078 -6.756
289 HZ2 TRP 41 HZ2 TRP 41 -4.129 -4.077 -7.282
290 HZ3 TRP 41 HZ3 TRP 41 -0.657 -4.253 -4.755
291 HH2 TRP 41 HH2 TRP 41 -3.123 -4.170 -5.010
292 H LEU 42 H LEU 42 3.014 -2.617 -7.567
293 HA LEU 42 HA LEU 42 1.160 -1.938 -5.535
294 HB2 LEU 42 HB2 LEU 42 3.012 -3.579 -5.319
295 HB3 LEU 42 HB3 LEU 42 4.191 -2.272 -5.419
296 HG LEU 42 HG LEU 42 3.296 -1.325 -3.282
297 HD11 LEU 42 HD11 LEU 42 1.853 -2.771 -1.864
298 HD12 LEU 42 HD12 LEU 42 1.577 -3.832 -3.261
299 HD13 LEU 42 HD13 LEU 42 1.008 -2.148 -3.290
300 HD21 LEU 42 HD21 LEU 42 5.218 -2.882 -3.302
301 HD22 LEU 42 HD22 LEU 42 4.113 -4.254 -3.105
302 HD23 LEU 42 HD23 LEU 42 4.259 -3.026 -1.821
303 H VAL 43 H VAL 43 3.865 -0.061 -6.880
304 HA VAL 43 HA VAL 43 3.575 2.162 -5.031
305 HB VAL 43 HB VAL 43 5.148 1.733 -7.590
306 HG11 VAL 43 HG11 VAL 43 5.155 4.221 -5.836
307 HG12 VAL 43 HG12 VAL 43 6.394 3.822 -7.039
308 HG13 VAL 43 HG13 VAL 43 4.742 4.130 -7.565
309 HG21 VAL 43 HG21 VAL 43 5.985 2.098 -4.663
310 HG22 VAL 43 HG22 VAL 43 5.875 0.546 -5.513
311 HG23 VAL 43 HG23 VAL 43 7.057 1.747 -6.030
312 H ARG 44 H ARG 44 2.285 1.477 -8.277
313 HA ARG 44 HA ARG 44 0.870 3.973 -8.546
314 HB2 ARG 44 HB2 ARG 44 1.199 2.437 -10.423
315 HB3 ARG 44 HB3 ARG 44 0.204 1.215 -9.640
316 HG2 ARG 44 HG2 ARG 44 -1.070 2.341 -11.372
317 HG3 ARG 44 HG3 ARG 44 -1.777 2.693 -9.794
318 HD2 ARG 44 HD2 ARG 44 -0.680 4.919 -9.789
319 HD3 ARG 44 HD3 ARG 44 0.065 4.553 -11.359
320 HE ARG 44 HE ARG 44 -2.750 4.196 -11.554
321 HH11 ARG 44 HH11 ARG 44 -0.395 6.849 -11.197
322 HH12 ARG 44 HH12 ARG 44 -1.436 8.019 -11.977
323 HH21 ARG 44 HH21 ARG 44 -4.074 5.761 -12.557
324 HH22 ARG 44 HH22 ARG 44 -3.508 7.406 -12.734
325 H TRP 45 H TRP 45 -0.191 0.806 -7.238
326 HA TRP 45 HA TRP 45 -2.807 1.541 -6.476
327 HB2 TRP 45 HB2 TRP 45 -2.130 -0.772 -6.654
328 HB3 TRP 45 HB3 TRP 45 -0.882 -0.566 -5.439
329 HD1 TRP 45 HD1 TRP 45 -1.466 -1.615 -3.267
330 HE1 TRP 45 HE1 TRP 45 -3.592 -2.125 -1.903
331 HE3 TRP 45 HE3 TRP 45 -4.961 0.472 -6.367
332 HZ2 TRP 45 HZ2 TRP 45 -6.432 -1.635 -2.101
333 HZ3 TRP 45 HZ3 TRP 45 -7.373 0.448 -5.744
334 HH2 TRP 45 HH2 TRP 45 -8.104 -0.605 -3.616
335 H LEU 46 H LEU 46 0.119 1.494 -4.336
336 HA LEU 46 HA LEU 46 -1.530 2.450 -2.176
337 HB2 LEU 46 HB2 LEU 46 -0.042 1.649 -0.842
338 HB3 LEU 46 HB3 LEU 46 0.691 0.928 -2.268
339 HG LEU 46 HG LEU 46 1.627 3.526 -0.980
340 HD11 LEU 46 HD11 LEU 46 2.783 0.696 -0.889
341 HD12 LEU 46 HD12 LEU 46 1.954 1.496 0.453
342 HD13 LEU 46 HD13 LEU 46 3.488 2.149 -0.147
343 HD21 LEU 46 HD21 LEU 46 2.214 3.282 -3.411
344 HD22 LEU 46 HD22 LEU 46 2.900 1.683 -3.043
345 HD23 LEU 46 HD23 LEU 46 3.640 3.134 -2.356
346 H LYS 47 H LYS 47 0.080 4.223 -4.625
347 HA LYS 47 HA LYS 47 -0.012 6.782 -3.190
348 HB2 LYS 47 HB2 LYS 47 1.498 6.413 -5.160
349 HB3 LYS 47 HB3 LYS 47 0.079 6.239 -6.193
350 HG2 LYS 47 HG2 LYS 47 -0.660 8.553 -5.512
351 HG3 LYS 47 HG3 LYS 47 0.772 8.689 -4.502
352 HD2 LYS 47 HD2 LYS 47 1.116 9.922 -6.520
353 HD3 LYS 47 HD3 LYS 47 2.188 8.516 -6.566
354 HE2 LYS 47 HE2 LYS 47 0.682 7.358 -8.113
355 HE3 LYS 47 HE3 LYS 47 -0.549 8.627 -7.920
356 HZ1 LYS 47 HZ1 LYS 47 0.959 10.189 -8.948
357 HZ2 LYS 47 HZ2 LYS 47 0.716 8.932 -9.964
358 HZ3 LYS 47 HZ3 LYS 47 2.133 9.046 -9.106
359 H VAL 48 H VAL 48 -2.052 5.237 -5.723
360 HA VAL 48 HA VAL 48 -4.242 7.174 -5.067
361 HB VAL 48 HB VAL 48 -2.690 8.041 -6.729
362 HG11 VAL 48 HG11 VAL 48 -2.000 6.019 -7.928
363 HG12 VAL 48 HG12 VAL 48 -3.612 5.902 -8.666
364 HG13 VAL 48 HG13 VAL 48 -2.580 7.298 -8.996
365 HG21 VAL 48 HG21 VAL 48 -4.449 8.652 -8.440
366 HG22 VAL 48 HG22 VAL 48 -5.545 7.604 -7.521
367 HG23 VAL 48 HG23 VAL 48 -4.798 9.007 -6.755
368 HA PRO 49 HA PRO 49 -5.885 2.833 -5.536
369 HB2 PRO 49 HB2 PRO 49 -7.179 2.593 -3.146
370 HB3 PRO 49 HB3 PRO 49 -5.412 2.356 -3.302
371 HG2 PRO 49 HG2 PRO 49 -6.872 4.896 -2.480
372 HG3 PRO 49 HG3 PRO 49 -5.538 4.066 -1.615
373 HD2 PRO 49 HD2 PRO 49 -5.038 6.141 -3.277
374 HD3 PRO 49 HD3 PRO 49 -3.949 4.726 -3.231
375 H ASP 50 H ASP 50 -7.205 5.972 -5.192
376 HA ASP 50 HA ASP 50 -10.016 5.253 -5.648
377 HB2 ASP 50 HB2 ASP 50 -10.340 7.661 -5.698
378 HB3 ASP 50 HB3 ASP 50 -9.491 7.148 -4.245
379 H GLN 51 H GLN 51 -7.267 6.647 -7.540
380 HA GLN 51 HA GLN 51 -8.830 6.745 -9.967
381 HB2 GLN 51 HB2 GLN 51 -6.881 8.242 -9.454
382 HB3 GLN 51 HB3 GLN 51 -5.818 6.829 -9.599
383 HG2 GLN 51 HG2 GLN 51 -5.758 8.118 -11.626
384 HG3 GLN 51 HG3 GLN 51 -6.439 6.523 -11.928
385 HE21 GLN 51 HE21 GLN 51 -7.427 7.390 -13.949
386 HE22 GLN 51 HE22 GLN 51 -8.887 8.381 -13.783
387 H MET 52 H MET 52 -6.441 4.332 -8.644
388 HA MET 52 HA MET 52 -6.363 2.707 -10.977
389 HB2 MET 52 HB2 MET 52 -4.925 2.451 -8.898
390 HB3 MET 52 HB3 MET 52 -6.340 1.859 -8.029
391 HG2 MET 52 HG2 MET 52 -5.341 -0.133 -8.573
392 HG3 MET 52 HG3 MET 52 -6.429 0.030 -9.934
393 HE1 MET 52 HE1 MET 52 -2.783 0.681 -8.654
394 HE2 MET 52 HE2 MET 52 -3.105 -1.052 -8.895
395 HE3 MET 52 HE3 MET 52 -1.898 -0.230 -9.906
396 H LEU 53 H LEU 53 -8.778 2.666 -8.281
397 HA LEU 53 HA LEU 53 -10.227 0.458 -9.402
398 HB2 LEU 53 HB2 LEU 53 -10.148 1.050 -7.003
399 HB3 LEU 53 HB3 LEU 53 -11.109 2.492 -7.334
400 HG LEU 53 HG LEU 53 -13.022 1.128 -7.995
401 HD11 LEU 53 HD11 LEU 53 -11.993 -0.830 -9.043
402 HD12 LEU 53 HD12 LEU 53 -12.989 -1.365 -7.701
403 HD13 LEU 53 HD13 LEU 53 -11.227 -1.299 -7.504
404 HD21 LEU 53 HD21 LEU 53 -12.655 1.586 -5.582
405 HD22 LEU 53 HD22 LEU 53 -11.787 0.042 -5.426
406 HD23 LEU 53 HD23 LEU 53 -13.512 0.062 -5.848
407 H ALA 54 H ALA 54 -10.278 3.892 -10.089
408 HA ALA 54 HA ALA 54 -12.789 3.842 -11.590
409 HB1 ALA 54 HB1 ALA 54 -12.169 6.136 -12.162
410 HB2 ALA 54 HB2 ALA 54 -11.913 5.883 -10.428
411 HB3 ALA 54 HB3 ALA 54 -10.533 5.902 -11.537
412 H GLU 55 H GLU 55 -9.305 3.871 -12.393
413 HA GLU 55 HA GLU 55 -9.688 4.017 -15.200
414 HB2 GLU 55 HB2 GLU 55 -7.463 4.285 -15.319
415 HB3 GLU 55 HB3 GLU 55 -7.672 4.686 -13.646
416 HG2 GLU 55 HG2 GLU 55 -6.889 2.216 -13.185
417 HG3 GLU 55 HG3 GLU 55 -6.520 2.171 -14.896
418 H LYS 56 H LYS 56 -9.604 1.374 -13.101
419 HA LYS 56 HA LYS 56 -9.821 -0.840 -13.191
420 HB2 LYS 56 HB2 LYS 56 -10.450 -0.784 -16.140
421 HB3 LYS 56 HB3 LYS 56 -10.895 -1.995 -14.949
422 HG2 LYS 56 HG2 LYS 56 -12.009 0.830 -15.209
423 HG3 LYS 56 HG3 LYS 56 -12.831 -0.670 -15.609
424 HD2 LYS 56 HD2 LYS 56 -12.933 -1.323 -13.254
425 HD3 LYS 56 HD3 LYS 56 -11.960 0.087 -12.788
426 HE2 LYS 56 HE2 LYS 56 -13.717 1.595 -13.710
427 HE3 LYS 56 HE3 LYS 56 -14.728 0.185 -14.075
428 HZ1 LYS 56 HZ1 LYS 56 -13.771 0.934 -11.368
429 HZ2 LYS 56 HZ2 LYS 56 -14.782 -0.321 -11.707
430 HZ3 LYS 56 HZ3 LYS 56 -15.290 1.222 -11.923
431 H ASP 57 H ASP 57 -8.202 -2.202 -12.949
432 HA ASP 57 HA ASP 57 -6.249 -2.688 -15.012
433 HB2 ASP 57 HB2 ASP 57 -5.387 -0.639 -13.681
434 HB3 ASP 57 HB3 ASP 57 -5.150 -1.767 -12.350
435 HA PRO 58 HA PRO 58 -7.176 -6.446 -12.832
436 HB2 PRO 58 HB2 PRO 58 -5.339 -8.156 -13.948
437 HB3 PRO 58 HB3 PRO 58 -6.843 -7.560 -14.738
438 HG2 PRO 58 HG2 PRO 58 -4.057 -6.367 -15.002
439 HG3 PRO 58 HG3 PRO 58 -5.162 -6.902 -16.324
440 HD2 PRO 58 HD2 PRO 58 -5.010 -4.347 -15.536
441 HD3 PRO 58 HD3 PRO 58 -6.619 -5.067 -15.857
442 H LEU 59 H LEU 59 -5.827 -8.262 -11.610
443 HA LEU 59 HA LEU 59 -5.399 -8.623 -9.556
444 HB2 LEU 59 HB2 LEU 59 -3.122 -8.361 -10.407
445 HB3 LEU 59 HB3 LEU 59 -3.102 -6.680 -9.874
446 HG LEU 59 HG LEU 59 -3.220 -7.320 -7.552
447 HD11 LEU 59 HD11 LEU 59 -3.051 -9.740 -6.878
448 HD12 LEU 59 HD12 LEU 59 -3.442 -10.200 -8.546
449 HD13 LEU 59 HD13 LEU 59 -4.627 -9.320 -7.551
450 HD21 LEU 59 HD21 LEU 59 -1.070 -7.312 -8.765
451 HD22 LEU 59 HD22 LEU 59 -1.308 -9.019 -9.196
452 HD23 LEU 59 HD23 LEU 59 -1.050 -8.560 -7.489
453 H ALA 60 H ALA 60 -5.813 -5.058 -10.091
454 HA ALA 60 HA ALA 60 -6.277 -4.652 -7.250
455 HB1 ALA 60 HB1 ALA 60 -7.152 -2.454 -7.934
456 HB2 ALA 60 HB2 ALA 60 -5.534 -2.806 -8.595
457 HB3 ALA 60 HB3 ALA 60 -6.967 -2.927 -9.634
458 H MET 61 H MET 61 -8.609 -5.094 -9.976
459 HA MET 61 HA MET 61 -10.919 -4.585 -8.301
460 HB2 MET 61 HB2 MET 61 -11.090 -6.359 -10.732
461 HB3 MET 61 HB3 MET 61 -12.237 -5.162 -10.152
462 HG2 MET 61 HG2 MET 61 -9.605 -4.529 -11.559
463 HG3 MET 61 HG3 MET 61 -11.161 -4.683 -12.327
464 HE1 MET 61 HE1 MET 61 -8.662 -2.538 -10.923
465 HE2 MET 61 HE2 MET 61 -9.409 -1.002 -10.518
466 HE3 MET 61 HE3 MET 61 -9.502 -2.353 -9.360
467 H LEU 62 H LEU 62 -9.059 -7.445 -8.965
468 HA LEU 62 HA LEU 62 -10.637 -9.383 -7.546
469 HB2 LEU 62 HB2 LEU 62 -8.901 -9.827 -9.268
470 HB3 LEU 62 HB3 LEU 62 -7.706 -9.059 -8.210
471 HG LEU 62 HG LEU 62 -7.946 -10.842 -6.564
472 HD11 LEU 62 HD11 LEU 62 -9.208 -12.913 -7.113
473 HD12 LEU 62 HD12 LEU 62 -9.868 -12.122 -8.563
474 HD13 LEU 62 HD13 LEU 62 -10.281 -11.523 -6.943
475 HD21 LEU 62 HD21 LEU 62 -7.497 -11.904 -9.375
476 HD22 LEU 62 HD22 LEU 62 -6.914 -12.649 -7.869
477 HD23 LEU 62 HD23 LEU 62 -6.289 -11.069 -8.373
478 H LEU 63 H LEU 63 -7.740 -7.329 -6.623
479 HA LEU 63 HA LEU 63 -7.363 -8.829 -4.209
480 HB2 LEU 63 HB2 LEU 63 -5.588 -7.876 -5.450
481 HB3 LEU 63 HB3 LEU 63 -6.202 -6.232 -5.271
482 HG LEU 63 HG LEU 63 -5.372 -7.848 -2.831
483 HD11 LEU 63 HD11 LEU 63 -3.644 -6.334 -4.821
484 HD12 LEU 63 HD12 LEU 63 -3.521 -8.030 -4.361
485 HD13 LEU 63 HD13 LEU 63 -3.105 -6.765 -3.180
486 HD21 LEU 63 HD21 LEU 63 -5.315 -4.859 -3.498
487 HD22 LEU 63 HD22 LEU 63 -4.734 -5.595 -1.984
488 HD23 LEU 63 HD23 LEU 63 -6.448 -5.645 -2.381
489 H PHE 64 H PHE 64 -8.974 -5.772 -4.901
490 HA PHE 64 HA PHE 64 -9.206 -5.108 -2.049
491 HB2 PHE 64 HB2 PHE 64 -10.080 -3.151 -2.607
492 HB3 PHE 64 HB3 PHE 64 -9.344 -3.508 -4.151
493 HD1 PHE 64 HD2 PHE 64 -10.875 -4.543 -5.988
494 HD2 PHE 64 HD1 PHE 64 -12.384 -2.743 -2.383
495 HE1 PHE 64 HE2 PHE 64 -13.081 -4.250 -7.071
496 HE2 PHE 64 HE1 PHE 64 -14.607 -2.470 -3.461
497 HZ PHE 64 HZ PHE 64 -14.955 -3.237 -5.799
498 H GLU 65 H GLU 65 -11.323 -6.826 -4.346
499 HA GLU 65 HA GLU 65 -13.482 -7.272 -2.527
500 HB2 GLU 65 HB2 GLU 65 -12.466 -8.955 -4.842
501 HB3 GLU 65 HB3 GLU 65 -13.893 -9.356 -3.880
502 HG2 GLU 65 HG2 GLU 65 -14.849 -7.102 -4.417
503 HG3 GLU 65 HG3 GLU 65 -13.519 -6.856 -5.551
504 H GLN 66 H GLN 66 -10.272 -8.539 -2.229
505 HA GLN 66 HA GLN 66 -11.145 -10.882 -0.692
506 HB2 GLN 66 HB2 GLN 66 -8.327 -9.746 -0.896
507 HB3 GLN 66 HB3 GLN 66 -8.800 -11.354 -0.392
508 HG2 GLN 66 HG2 GLN 66 -8.804 -10.198 -3.171
509 HG3 GLN 66 HG3 GLN 66 -7.898 -11.572 -2.568
510 HE21 GLN 66 HE21 GLN 66 -10.400 -10.796 -4.525
511 HE22 GLN 66 HE22 GLN 66 -11.279 -12.319 -4.464
512 H TYR 67 H TYR 67 -10.851 -7.637 0.053
513 HA TYR 67 HA TYR 67 -10.513 -8.185 2.976
514 HB2 TYR 67 HB2 TYR 67 -9.807 -5.744 1.320
515 HB3 TYR 67 HB3 TYR 67 -9.737 -5.813 3.078
516 HD1 TYR 67 HD2 TYR 67 -8.310 -7.622 4.195
517 HD2 TYR 67 HD1 TYR 67 -7.888 -6.510 0.049
518 HE1 TYR 67 HE2 TYR 67 -5.995 -8.486 4.201
519 HE2 TYR 67 HE1 TYR 67 -5.528 -7.291 0.076
520 HH TYR 67 HH TYR 67 -3.806 -8.014 1.393
521 H ASN 68 H ASN 68 -12.962 -8.707 2.035
522 HA ASN 68 HA ASN 68 -15.131 -8.179 1.858
523 HB2 ASN 68 HB2 ASN 68 -14.659 -8.121 4.329
524 HB3 ASN 68 HB3 ASN 68 -14.611 -6.360 4.222
525 HD21 ASN 68 HD21 ASN 68 -16.338 -6.258 5.706
526 HD22 ASN 68 HD22 ASN 68 -17.981 -6.722 5.280
527 H ARG 69 H ARG 69 -13.577 -6.693 0.073
528 HA ARG 69 HA ARG 69 -13.613 -4.960 -1.386
529 HB2 ARG 69 HB2 ARG 69 -15.671 -4.692 -2.567
530 HB3 ARG 69 HB3 ARG 69 -15.420 -6.372 -2.117
531 HG2 ARG 69 HG2 ARG 69 -17.090 -6.221 -0.339
532 HG3 ARG 69 HG3 ARG 69 -17.309 -4.484 -0.647
533 HD2 ARG 69 HD2 ARG 69 -18.066 -5.013 -2.955
534 HD3 ARG 69 HD3 ARG 69 -17.863 -6.744 -2.614
535 HE ARG 69 HE ARG 69 -19.552 -5.522 -0.648
536 HH11 ARG 69 HH11 ARG 69 -19.630 -6.634 -4.038
537 HH12 ARG 69 HH12 ARG 69 -21.363 -6.887 -4.023
538 HH21 ARG 69 HH21 ARG 69 -21.796 -5.886 -0.670
539 HH22 ARG 69 HH22 ARG 69 -22.581 -6.484 -2.116
540 H LEU 70 H LEU 70 -13.272 -3.880 1.183
541 HA LEU 70 HA LEU 70 -15.029 -1.707 1.727
542 HB2 LEU 70 HB2 LEU 70 -13.745 -2.953 3.386
543 HB3 LEU 70 HB3 LEU 70 -12.229 -2.369 2.707
544 HG LEU 70 HG LEU 70 -12.659 -0.117 3.480
545 HD11 LEU 70 HD11 LEU 70 -14.638 0.448 4.864
546 HD12 LEU 70 HD12 LEU 70 -15.345 -1.146 4.519
547 HD13 LEU 70 HD13 LEU 70 -15.125 0.048 3.222
548 HD21 LEU 70 HD21 LEU 70 -13.404 -2.042 5.716
549 HD22 LEU 70 HD22 LEU 70 -12.597 -0.462 5.867
550 HD23 LEU 70 HD23 LEU 70 -11.763 -1.824 5.098
551 H ALA 71 H ALA 71 -11.995 -1.767 -0.107
552 HA ALA 71 HA ALA 71 -11.106 -0.404 -1.618
553 HB1 ALA 71 HB1 ALA 71 -12.445 1.207 -2.856
554 HB2 ALA 71 HB2 ALA 71 -13.319 -0.322 -2.652
555 HB3 ALA 71 HB3 ALA 71 -13.749 1.088 -1.661
556 H MET 72 H MET 72 -9.533 0.189 -0.228
557 HA MET 72 HA MET 72 -9.388 2.065 1.739
558 HB2 MET 72 HB2 MET 72 -7.569 0.609 1.258
559 HB3 MET 72 HB3 MET 72 -7.380 1.232 -0.382
560 HG2 MET 72 HG2 MET 72 -6.534 3.323 0.395
561 HG3 MET 72 HG3 MET 72 -6.876 2.927 2.085
562 HE1 MET 72 HE1 MET 72 -4.234 3.927 0.259
563 HE2 MET 72 HE2 MET 72 -4.249 4.066 2.029
564 HE3 MET 72 HE3 MET 72 -2.909 3.232 1.203
565 HA PRO 73 HA PRO 73 -9.782 6.067 -0.365
566 HB2 PRO 73 HB2 PRO 73 -9.290 7.740 1.715
567 HB3 PRO 73 HB3 PRO 73 -10.801 6.779 1.606
568 HG2 PRO 73 HG2 PRO 73 -8.279 6.115 3.168
569 HG3 PRO 73 HG3 PRO 73 -9.977 6.098 3.748
570 HD2 PRO 73 HD2 PRO 73 -8.713 3.841 2.893
571 HD3 PRO 73 HD3 PRO 73 -10.454 4.117 2.613
572 H ASN 74 H ASN 74 -8.397 7.661 -1.141
573 HA ASN 74 HA ASN 74 -5.523 7.149 -1.104
574 HB2 ASN 74 HB2 ASN 74 -6.710 7.840 -3.089
575 HB3 ASN 74 HB3 ASN 74 -7.278 9.317 -2.342
576 HD21 ASN 74 HD21 ASN 74 -5.815 9.010 -4.800
577 HD22 ASN 74 HD22 ASN 74 -4.324 9.959 -4.569
578 H MET 75 H MET 75 -3.962 8.152 0.045
579 HA MET 75 HA MET 75 -4.862 9.874 2.302
580 HB2 MET 75 HB2 MET 75 -2.443 8.076 2.027
581 HB3 MET 75 HB3 MET 75 -2.841 9.030 3.455
582 HG2 MET 75 HG2 MET 75 -4.428 6.730 2.267
583 HG3 MET 75 HG3 MET 75 -3.543 6.747 3.785
584 HE1 MET 75 HE1 MET 75 -5.801 9.072 6.047
585 HE2 MET 75 HE2 MET 75 -4.279 8.162 5.934
586 HE3 MET 75 HE3 MET 75 -4.486 9.668 5.014
587 H ARG 76 H ARG 76 -3.776 10.680 -0.557
588 HA ARG 76 HA ARG 76 -2.769 12.472 -1.470
589 HB2 ARG 76 HB2 ARG 76 -3.801 13.680 1.109
590 HB3 ARG 76 HB3 ARG 76 -3.060 14.637 -0.168
591 HG2 ARG 76 HG2 ARG 76 -5.345 14.818 -0.532
592 HG3 ARG 76 HG3 ARG 76 -4.725 13.772 -1.806
593 HD2 ARG 76 HD2 ARG 76 -5.667 11.797 -0.680
594 HD3 ARG 76 HD3 ARG 76 -6.164 12.803 0.700
595 HE ARG 76 HE ARG 76 -7.190 13.662 -1.903
596 HH11 ARG 76 HH11 ARG 76 -7.891 11.605 0.934
597 HH12 ARG 76 HH12 ARG 76 -9.615 11.596 0.617
598 HH21 ARG 76 HH21 ARG 76 -9.437 13.616 -2.252
599 HH22 ARG 76 HH22 ARG 76 -10.479 12.732 -1.154
600 H LEU 77 H LEU 77 -0.772 11.123 -1.178
601 HA LEU 77 HA LEU 77 1.382 12.769 0.044
602 HB2 LEU 77 HB2 LEU 77 2.597 10.816 0.703
603 HB3 LEU 77 HB3 LEU 77 1.059 10.886 1.535
604 HG LEU 77 HG LEU 77 1.278 9.185 -0.974
605 HD11 LEU 77 HD11 LEU 77 2.010 7.297 0.413
606 HD12 LEU 77 HD12 LEU 77 2.206 8.388 1.810
607 HD13 LEU 77 HD13 LEU 77 3.233 8.575 0.366
608 HD21 LEU 77 HD21 LEU 77 -0.303 7.745 0.292
609 HD22 LEU 77 HD22 LEU 77 -0.941 9.370 0.099
610 HD23 LEU 77 HD23 LEU 77 -0.243 8.892 1.657
611 H GLY 78 H GLY 78 3.458 12.643 -0.916
612 HA2 GLY 78 HA2 GLY 78 3.165 12.481 -3.870
613 HA3 GLY 78 HA3 GLY 78 4.254 13.534 -2.996
614 H ASP 79 H ASP 79 5.311 12.470 -5.047
615 HA ASP 79 HA ASP 79 6.126 9.987 -5.488
616 HB2 ASP 79 HB2 ASP 79 6.668 11.913 -6.894
617 HB3 ASP 79 HB3 ASP 79 7.890 12.453 -5.746
618 H ALA 80 H ALA 80 8.271 12.046 -3.400
619 HA ALA 80 HA ALA 80 9.999 9.820 -2.802
620 HB1 ALA 80 HB1 ALA 80 10.791 12.144 -2.857
621 HB2 ALA 80 HB2 ALA 80 9.762 12.539 -1.459
622 HB3 ALA 80 HB3 ALA 80 11.108 11.400 -1.283
623 H GLU 81 H GLU 81 7.079 11.003 -1.202
624 HA GLU 81 HA GLU 81 7.534 9.597 1.328
625 HB2 GLU 81 HB2 GLU 81 4.975 10.677 0.064
626 HB3 GLU 81 HB3 GLU 81 5.090 9.994 1.680
627 HG2 GLU 81 HG2 GLU 81 6.569 11.790 2.405
628 HG3 GLU 81 HG3 GLU 81 6.613 12.468 0.776
629 H VAL 82 H VAL 82 5.744 8.949 -1.693
630 HA VAL 82 HA VAL 82 4.740 6.355 -0.927
631 HB VAL 82 HB VAL 82 5.285 7.537 -3.687
632 HG11 VAL 82 HG11 VAL 82 4.980 5.024 -3.690
633 HG12 VAL 82 HG12 VAL 82 3.414 5.280 -2.888
634 HG13 VAL 82 HG13 VAL 82 3.695 5.895 -4.531
635 HG21 VAL 82 HG21 VAL 82 3.612 8.847 -2.308
636 HG22 VAL 82 HG22 VAL 82 2.908 8.081 -3.725
637 HG23 VAL 82 HG23 VAL 82 2.666 7.367 -2.114
638 H SER 83 H SER 83 7.695 7.323 -2.766
639 HA SER 83 HA SER 83 8.646 4.599 -3.002
640 HB2 SER 83 HB2 SER 83 9.862 7.328 -3.441
641 HB3 SER 83 HB3 SER 83 10.906 5.900 -3.348
642 HG SER 83 HG SER 83 8.719 6.276 -5.143
643 H ALA 84 H ALA 84 9.020 6.985 -0.378
644 HA ALA 84 HA ALA 84 10.971 5.469 1.123
645 HB1 ALA 84 HB1 ALA 84 10.073 6.867 3.023
646 HB2 ALA 84 HB2 ALA 84 10.563 7.827 1.623
647 HB3 ALA 84 HB3 ALA 84 8.848 7.512 1.932
648 H LEU 85 H LEU 85 7.373 5.518 1.150
649 HA LEU 85 HA LEU 85 7.051 3.567 3.210
650 HB2 LEU 85 HB2 LEU 85 5.342 4.586 0.912
651 HB3 LEU 85 HB3 LEU 85 4.747 3.312 1.963
652 HG LEU 85 HG LEU 85 5.739 5.984 3.062
653 HD11 LEU 85 HD11 LEU 85 2.920 5.103 2.320
654 HD12 LEU 85 HD12 LEU 85 3.894 6.367 1.540
655 HD13 LEU 85 HD13 LEU 85 3.340 6.584 3.208
656 HD21 LEU 85 HD21 LEU 85 4.038 3.744 4.238
657 HD22 LEU 85 HD22 LEU 85 4.295 5.328 4.994
658 HD23 LEU 85 HD23 LEU 85 5.665 4.240 4.764
659 H ILE 86 H ILE 86 7.721 3.129 -0.207
660 HA ILE 86 HA ILE 86 7.105 0.303 -0.294
661 HB ILE 86 HB ILE 86 7.735 2.239 -2.204
662 HG12 ILE 86 HG12 ILE 86 7.308 0.280 -3.747
663 HG13 ILE 86 HG13 ILE 86 7.301 -0.781 -2.351
664 HG21 ILE 86 HG21 ILE 86 10.161 1.739 -2.068
665 HG22 ILE 86 HG22 ILE 86 9.811 0.031 -2.433
666 HG23 ILE 86 HG23 ILE 86 9.448 1.296 -3.616
667 HD11 ILE 86 HD11 ILE 86 5.514 1.678 -2.443
668 HD12 ILE 86 HD12 ILE 86 5.019 0.145 -3.198
669 HD13 ILE 86 HD13 ILE 86 5.313 0.223 -1.454
670 H SER 87 H SER 87 10.002 2.223 0.384
671 HA SER 87 HA SER 87 11.796 0.016 0.814
672 HB2 SER 87 HB2 SER 87 11.959 2.898 1.770
673 HB3 SER 87 HB3 SER 87 13.298 1.735 1.680
674 HG SER 87 HG SER 87 12.861 3.299 -0.171
675 H TYR 88 H TYR 88 9.675 1.930 3.063
676 HA TYR 88 HA TYR 88 10.608 0.483 5.401
677 HB2 TYR 88 HB2 TYR 88 9.337 2.451 5.730
678 HB3 TYR 88 HB3 TYR 88 7.968 1.840 4.802
679 HD1 TYR 88 HD1 TYR 88 10.050 0.512 7.687
680 HD2 TYR 88 HD2 TYR 88 6.112 1.431 6.179
681 HE1 TYR 88 HE1 TYR 88 9.034 -0.489 9.721
682 HE2 TYR 88 HE2 TYR 88 5.109 0.450 8.241
683 HH TYR 88 HH TYR 88 7.069 -1.282 10.664
684 H LEU 89 H LEU 89 7.965 -0.290 3.098
685 HA LEU 89 HA LEU 89 7.135 -2.719 4.371
686 HB2 LEU 89 HB2 LEU 89 6.999 -1.733 1.492
687 HB3 LEU 89 HB3 LEU 89 6.221 -3.216 2.028
688 HG LEU 89 HG LEU 89 5.592 -0.503 3.278
689 HD11 LEU 89 HD11 LEU 89 4.144 -1.967 1.031
690 HD12 LEU 89 HD12 LEU 89 5.033 -0.436 0.893
691 HD13 LEU 89 HD13 LEU 89 3.567 -0.505 1.874
692 HD21 LEU 89 HD21 LEU 89 4.965 -2.390 4.676
693 HD22 LEU 89 HD22 LEU 89 4.135 -3.165 3.310
694 HD23 LEU 89 HD23 LEU 89 3.525 -1.634 3.987
695 H GLU 90 H GLU 90 9.840 -2.109 2.170
696 HA GLU 90 HA GLU 90 10.498 -4.917 1.788
697 HB2 GLU 90 HB2 GLU 90 11.161 -3.156 0.205
698 HB3 GLU 90 HB3 GLU 90 12.211 -2.426 1.424
699 HG2 GLU 90 HG2 GLU 90 13.634 -4.392 1.473
700 HG3 GLU 90 HG3 GLU 90 12.498 -5.303 0.468
701 H GLU 91 H GLU 91 11.877 -2.361 3.966
702 HA GLU 91 HA GLU 91 13.721 -4.229 5.160
703 HB2 GLU 91 HB2 GLU 91 12.768 -1.469 6.021
704 HB3 GLU 91 HB3 GLU 91 13.956 -2.422 6.928
705 HG2 GLU 91 HG2 GLU 91 15.383 -2.586 4.896
706 HG3 GLU 91 HG3 GLU 91 14.240 -1.561 4.023
707 H GLU 92 H GLU 92 10.476 -3.101 6.314
708 HA GLU 92 HA GLU 92 10.709 -4.438 8.856
709 HB2 GLU 92 HB2 GLU 92 8.993 -2.648 8.096
710 HB3 GLU 92 HB3 GLU 92 8.117 -3.985 7.359
711 HG2 GLU 92 HG2 GLU 92 7.090 -3.791 9.427
712 HG3 GLU 92 HG3 GLU 92 8.229 -5.082 9.756
713 H THR 93 H THR 93 9.742 -5.609 5.666
714 HA THR 93 HA THR 93 8.657 -8.132 6.474
715 HB THR 93 HB THR 93 9.949 -7.234 3.880
716 HG1 THR 93 HG1 THR 93 8.106 -6.235 3.949
717 HG21 THR 93 HG21 THR 93 10.052 -9.667 3.945
718 HG22 THR 93 HG22 THR 93 8.810 -9.139 2.821
719 HG23 THR 93 HG23 THR 93 8.344 -9.763 4.427
720 H ALA 94 H ALA 94 12.037 -7.134 5.992
721 HA ALA 94 HA ALA 94 13.027 -9.862 6.535
722 HB1 ALA 94 HB1 ALA 94 14.456 -7.191 6.199
723 HB2 ALA 94 HB2 ALA 94 15.245 -8.774 6.376
724 HB3 ALA 94 HB3 ALA 94 14.234 -8.448 4.959
725 H ARG 95 H ARG 95 12.697 -6.771 8.308
726 HA ARG 95 HA ARG 95 14.235 -7.613 10.580
727 HB2 ARG 95 HB2 ARG 95 12.273 -5.339 10.172
728 HB3 ARG 95 HB3 ARG 95 13.202 -5.565 11.664
729 HG2 ARG 95 HG2 ARG 95 15.315 -5.393 10.472
730 HG3 ARG 95 HG3 ARG 95 14.496 -5.287 8.913
731 HD2 ARG 95 HD2 ARG 95 13.380 -3.180 9.656
732 HD3 ARG 95 HD3 ARG 95 14.288 -3.260 11.177
733 HE ARG 95 HE ARG 95 15.236 -2.439 8.554
734 HH11 ARG 95 HH11 ARG 95 16.367 -3.706 11.694
735 HH12 ARG 95 HH12 ARG 95 17.998 -3.101 11.453
736 HH21 ARG 95 HH21 ARG 95 17.326 -1.678 8.297
737 HH22 ARG 95 HH22 ARG 95 18.535 -1.947 9.537
738 H LEU 96 H LEU 96 10.730 -7.834 9.980
739 HA LEU 96 HA LEU 96 10.246 -8.664 12.742
740 HB2 LEU 96 HB2 LEU 96 8.732 -7.321 10.803
741 HB3 LEU 96 HB3 LEU 96 7.949 -8.842 10.941
742 HG LEU 96 HG LEU 96 6.903 -7.171 12.277
743 HD11 LEU 96 HD11 LEU 96 8.355 -9.201 13.991
744 HD12 LEU 96 HD12 LEU 96 6.884 -9.475 13.037
745 HD13 LEU 96 HD13 LEU 96 6.851 -8.345 14.415
746 HD21 LEU 96 HD21 LEU 96 8.018 -6.072 14.109
747 HD22 LEU 96 HD22 LEU 96 8.929 -5.818 12.601
748 HD23 LEU 96 HD23 LEU 96 9.512 -6.987 13.810
749 H GLN 97 H GLN 97 11.746 -10.446 10.727
750 HA GLN 97 HA GLN 97 10.237 -12.951 10.831
751 HB2 GLN 97 HB2 GLN 97 13.135 -12.347 10.151
752 HB3 GLN 97 HB3 GLN 97 12.355 -13.917 9.946
753 HG2 GLN 97 HG2 GLN 97 11.560 -11.342 8.518
754 HG3 GLN 97 HG3 GLN 97 12.517 -12.629 7.822
755 HE21 GLN 97 HE21 GLN 97 9.866 -11.509 6.988
756 HE22 GLN 97 HE22 GLN 97 8.772 -12.906 6.986
757 H THR 98 H THR 98 9.882 -12.328 13.196
758 HA THR 98 HA THR 98 11.586 -13.792 15.142
759 HB THR 98 HB THR 98 12.845 -11.942 15.329
760 HG1 THR 98 HG1 THR 98 12.131 -10.878 17.192
761 HG21 THR 98 HG21 THR 98 11.883 -10.365 13.827
762 HG22 THR 98 HG22 THR 98 11.989 -9.581 15.399
763 HG23 THR 98 HG23 THR 98 10.420 -10.189 14.820
764 HA PRO 99 HA PRO 99 7.452 -13.690 17.068
765 HB2 PRO 99 HB2 PRO 99 7.493 -16.093 18.306
766 HB3 PRO 99 HB3 PRO 99 7.239 -15.937 16.546
767 HG2 PRO 99 HG2 PRO 99 9.804 -16.607 18.008
768 HG3 PRO 99 HG3 PRO 99 9.099 -17.415 16.577
769 HD2 PRO 99 HD2 PRO 99 11.059 -15.450 16.455
770 HD3 PRO 99 HD3 PRO 99 9.897 -15.770 15.137
771 H VAL 100 H VAL 100 10.145 -12.540 17.930
772 HA VAL 100 HA VAL 100 10.096 -12.912 20.891
773 HB VAL 100 HB VAL 100 12.482 -12.896 18.986
774 HG11 VAL 100 HG11 VAL 100 13.744 -13.780 21.013
775 HG12 VAL 100 HG12 VAL 100 13.264 -12.120 21.205
776 HG13 VAL 100 HG13 VAL 100 12.329 -13.392 22.017
777 HG21 VAL 100 HG21 VAL 100 11.296 -14.984 18.755
778 HG22 VAL 100 HG22 VAL 100 12.736 -15.279 19.698
779 HG23 VAL 100 HG23 VAL 100 11.162 -15.173 20.522
780 H THR 101 H THR 101 9.119 -10.654 18.962
781 HA THR 101 HA THR 101 10.914 -8.450 19.357
782 HB THR 101 HB THR 101 9.101 -7.011 18.498
783 HG1 THR 101 HG1 THR 101 7.624 -9.391 18.178
784 HG21 THR 101 HG21 THR 101 8.920 -7.990 16.269
785 HG22 THR 101 HG22 THR 101 9.512 -9.550 16.886
786 HG23 THR 101 HG23 THR 101 10.570 -8.124 16.905
787 H ASN 102 H ASN 102 10.524 -6.417 20.334
788 HA ASN 102 HA ASN 102 9.330 -6.511 23.039
789 HB2 ASN 102 HB2 ASN 102 11.627 -5.620 22.633
790 HB3 ASN 102 HB3 ASN 102 10.958 -4.378 21.582
791 HD21 ASN 102 HD21 ASN 102 12.341 -3.154 23.285
792 HD22 ASN 102 HD22 ASN 102 11.435 -2.580 24.695
793 H ARG 103 H ARG 103 7.607 -5.276 23.711
794 HA ARG 103 HA ARG 103 5.682 -4.192 21.807
795 HB2 ARG 103 HB2 ARG 103 5.021 -5.336 23.877
796 HB3 ARG 103 HB3 ARG 103 5.917 -4.170 24.843
797 HG2 ARG 103 HG2 ARG 103 3.587 -3.672 25.024
798 HG3 ARG 103 HG3 ARG 103 4.353 -2.370 24.128
799 HD2 ARG 103 HD2 ARG 103 3.564 -3.564 21.987
800 HD3 ARG 103 HD3 ARG 103 2.604 -4.617 23.035
801 HE ARG 103 HE ARG 103 2.061 -1.902 22.232
802 HH11 ARG 103 HH11 ARG 103 1.462 -4.134 24.956
803 HH12 ARG 103 HH12 ARG 103 0.027 -3.266 25.465
804 HH21 ARG 103 HH21 ARG 103 0.212 -0.828 22.935
805 HH22 ARG 103 HH22 ARG 103 -0.677 -1.411 24.329
806 H GLY 104 H GLY 104 8.219 -2.862 23.883
807 HA2 GLY 104 HA2 GLY 104 7.395 -0.244 24.237
808 HA3 GLY 104 HA3 GLY 104 9.079 -0.759 24.209
809 H ILE 105 H ILE 105 7.726 1.724 23.295
810 HA ILE 105 HA ILE 105 7.526 1.742 20.453
811 HB ILE 105 HB ILE 105 7.673 4.063 22.401
812 HG12 ILE 105 HG12 ILE 105 5.305 2.561 21.183
813 HG13 ILE 105 HG13 ILE 105 5.804 2.521 22.872
814 HG21 ILE 105 HG21 ILE 105 6.672 4.018 19.511
815 HG22 ILE 105 HG22 ILE 105 6.662 5.412 20.606
816 HG23 ILE 105 HG23 ILE 105 8.193 4.768 20.056
817 HD11 ILE 105 HD11 ILE 105 3.916 3.948 22.738
818 HD12 ILE 105 HD12 ILE 105 5.325 4.987 23.030
819 HD13 ILE 105 HD13 ILE 105 4.600 4.883 21.403
820 HA PRO 106 HA PRO 106 11.912 2.496 19.617
821 HB2 PRO 106 HB2 PRO 106 11.849 2.751 16.912
822 HB3 PRO 106 HB3 PRO 106 11.681 1.187 17.764
823 HG2 PRO 106 HG2 PRO 106 9.496 2.969 16.684
824 HG3 PRO 106 HG3 PRO 106 9.668 1.198 16.485
825 HD2 PRO 106 HD2 PRO 106 8.045 2.330 18.376
826 HD3 PRO 106 HD3 PRO 106 8.915 0.796 18.679
827 HHA HEC 107 HHA HEC 107 -5.124 -3.207 1.172
828 HHB HEC 107 HHB HEC 107 0.151 0.482 1.698
829 HHC HEC 107 HHC HEC 107 -3.169 4.714 5.299
830 HHD HEC 107 HHD HEC 107 -8.284 0.804 5.113
831 HMA1 HEC 107 HMA1 HEC 107 0.737 -1.794 1.043
832 HMA2 HEC 107 HMA2 HEC 107 0.003 -2.883 -0.130
833 HMA3 HEC 107 HMA3 HEC 107 0.141 -1.158 -0.511
834 HAA1 HEC 107 HAA1 HEC 107 -3.650 -3.842 -0.391
835 HAA2 HEC 107 HAA2 HEC 107 -2.008 -3.596 -0.928
836 HBA1 HEC 107 HBA1 HEC 107 -1.181 -4.776 1.135
837 HBA2 HEC 107 HBA2 HEC 107 -2.861 -5.088 1.591
838 HMB1 HEC 107 HMB1 HEC 107 1.698 3.439 3.505
839 HMB2 HEC 107 HMB2 HEC 107 1.619 1.842 2.800
840 HMB3 HEC 107 HMB3 HEC 107 1.229 3.278 1.811
841 HAB HEC 107 HAB HEC 107 -1.399 5.615 4.719
842 HBB1 HEC 107 HBB1 HEC 107 0.482 5.576 2.365
843 HBB2 HEC 107 HBB2 HEC 107 -1.261 5.902 2.292
844 HBB3 HEC 107 HBB3 HEC 107 -0.183 6.985 3.201
845 HMC1 HEC 107 HMC1 HEC 107 -6.374 5.369 7.174
846 HMC2 HEC 107 HMC2 HEC 107 -4.718 4.860 7.470
847 HMC3 HEC 107 HMC3 HEC 107 -5.108 5.870 6.063
848 HAC HEC 107 HAC HEC 107 -8.485 2.105 6.691
849 HBC1 HEC 107 HBC1 HEC 107 -8.436 5.113 6.509
850 HBC2 HEC 107 HBC2 HEC 107 -9.251 3.997 5.404
851 HBC3 HEC 107 HBC3 HEC 107 -9.762 4.102 7.097
852 HMD1 HEC 107 HMD1 HEC 107 -9.105 -2.249 5.026
853 HMD2 HEC 107 HMD2 HEC 107 -9.709 -0.702 4.397
854 HMD3 HEC 107 HMD3 HEC 107 -9.867 -2.142 3.418
855 HAD1 HEC 107 HAD1 HEC 107 -7.070 -4.280 2.161
856 HAD2 HEC 107 HAD2 HEC 107 -8.701 -3.729 2.447
857 HBD1 HEC 107 HBD1 HEC 107 -7.082 -3.078 -0.053
858 HBD2 HEC 107 HBD2 HEC 107 -8.334 -4.303 0.080
Start of MODEL 16
1 H SER 1 H SER 1 13.769 7.090 8.308
2 HA SER 1 HA SER 1 12.272 8.310 6.073
3 HB2 SER 1 HB2 SER 1 14.497 6.270 5.885
4 HB3 SER 1 HB3 SER 1 13.878 7.341 4.618
5 HG SER 1 HG SER 1 15.263 7.998 7.008
6 H GLY 2 H GLY 2 10.410 7.191 7.302
7 HA2 GLY 2 HA2 GLY 2 8.749 6.168 5.709
8 HA3 GLY 2 HA3 GLY 2 9.709 4.736 5.740
9 H GLU 3 H GLU 3 10.133 4.336 8.595
10 HA GLU 3 HA GLU 3 7.497 3.367 9.266
11 HB2 GLU 3 HB2 GLU 3 9.594 2.246 10.047
12 HB3 GLU 3 HB3 GLU 3 9.839 3.568 11.185
13 HG2 GLU 3 HG2 GLU 3 7.727 3.074 12.314
14 HG3 GLU 3 HG3 GLU 3 7.261 1.961 11.044
15 H GLN 4 H GLN 4 9.311 6.228 10.371
16 HA GLN 4 HA GLN 4 7.467 7.322 12.206
17 HB2 GLN 4 HB2 GLN 4 9.811 8.047 11.504
18 HB3 GLN 4 HB3 GLN 4 9.090 8.886 10.142
19 HG2 GLN 4 HG2 GLN 4 8.532 9.432 13.095
20 HG3 GLN 4 HG3 GLN 4 9.714 10.296 12.117
21 HE21 GLN 4 HE21 GLN 4 8.538 11.242 9.891
22 HE22 GLN 4 HE22 GLN 4 7.075 12.108 10.323
23 H ILE 5 H ILE 5 7.449 7.446 8.649
24 HA ILE 5 HA ILE 5 5.135 9.203 8.405
25 HB ILE 5 HB ILE 5 6.535 7.337 6.400
26 HG12 ILE 5 HG12 ILE 5 6.792 10.357 6.766
27 HG13 ILE 5 HG13 ILE 5 7.976 9.169 7.304
28 HG21 ILE 5 HG21 ILE 5 4.500 9.565 5.888
29 HG22 ILE 5 HG22 ILE 5 5.340 8.619 4.644
30 HG23 ILE 5 HG23 ILE 5 4.189 7.828 5.702
31 HD11 ILE 5 HD11 ILE 5 8.783 10.053 5.257
32 HD12 ILE 5 HD12 ILE 5 8.247 8.397 4.928
33 HD13 ILE 5 HD13 ILE 5 7.249 9.783 4.425
34 H PHE 6 H PHE 6 5.636 5.644 8.138
35 HA PHE 6 HA PHE 6 2.928 5.003 7.603
36 HB2 PHE 6 HB2 PHE 6 4.854 3.474 7.291
37 HB3 PHE 6 HB3 PHE 6 5.047 3.352 9.033
38 HD1 PHE 6 HD1 PHE 6 2.817 2.534 6.167
39 HD2 PHE 6 HD2 PHE 6 3.584 1.929 10.367
40 HE1 PHE 6 HE1 PHE 6 1.138 0.709 6.213
41 HE2 PHE 6 HE2 PHE 6 1.917 0.089 10.400
42 HZ PHE 6 HZ PHE 6 0.692 -0.523 8.331
43 H ARG 7 H ARG 7 4.643 5.280 10.720
44 HA ARG 7 HA ARG 7 2.505 4.584 12.454
45 HB2 ARG 7 HB2 ARG 7 4.887 4.643 13.044
46 HB3 ARG 7 HB3 ARG 7 4.897 6.407 12.908
47 HG2 ARG 7 HG2 ARG 7 3.312 6.582 14.794
48 HG3 ARG 7 HG3 ARG 7 3.193 4.810 14.870
49 HD2 ARG 7 HD2 ARG 7 5.649 4.705 15.361
50 HD3 ARG 7 HD3 ARG 7 5.715 6.471 15.306
51 HE ARG 7 HE ARG 7 4.851 6.584 17.420
52 HH11 ARG 7 HH11 ARG 7 4.235 3.287 16.212
53 HH12 ARG 7 HH12 ARG 7 3.725 2.697 17.777
54 HH21 ARG 7 HH21 ARG 7 4.194 5.762 19.441
55 HH22 ARG 7 HH22 ARG 7 3.700 4.091 19.595
56 H THR 8 H THR 8 3.404 7.724 11.033
57 HA THR 8 HA THR 8 1.345 9.111 12.621
58 HB THR 8 HB THR 8 2.351 11.187 11.704
59 HG1 THR 8 HG1 THR 8 4.470 9.615 10.809
60 HG21 THR 8 HG21 THR 8 4.314 11.122 13.075
61 HG22 THR 8 HG22 THR 8 4.353 9.342 13.054
62 HG23 THR 8 HG23 THR 8 3.038 10.209 13.874
63 H ARG 9 H ARG 9 1.516 8.143 9.209
64 HA ARG 9 HA ARG 9 -1.273 9.076 9.232
65 HB2 ARG 9 HB2 ARG 9 -1.288 10.324 7.215
66 HB3 ARG 9 HB3 ARG 9 -0.148 10.983 8.371
67 HG2 ARG 9 HG2 ARG 9 1.694 9.725 7.043
68 HG3 ARG 9 HG3 ARG 9 0.444 9.497 5.800
69 HD2 ARG 9 HD2 ARG 9 0.241 12.235 6.568
70 HD3 ARG 9 HD3 ARG 9 1.969 11.906 6.571
71 HE ARG 9 HE ARG 9 1.934 11.537 4.276
72 HH11 ARG 9 HH11 ARG 9 -1.413 12.100 5.393
73 HH12 ARG 9 HH12 ARG 9 -1.972 12.519 3.789
74 HH21 ARG 9 HH21 ARG 9 1.179 12.118 2.259
75 HH22 ARG 9 HH22 ARG 9 -0.500 12.537 2.014
76 H CYS 10 H CYS 10 0.198 6.392 9.010
77 HA CYS 10 HA CYS 10 -1.670 5.310 6.954
78 HB2 CYS 10 HB2 CYS 10 0.830 5.623 6.247
79 HB3 CYS 10 HB3 CYS 10 1.055 4.160 7.194
80 H SER 11 H SER 11 -1.071 5.246 10.146
81 HA SER 11 HA SER 11 -1.482 2.313 10.503
82 HB2 SER 11 HB2 SER 11 -0.465 4.441 12.408
83 HB3 SER 11 HB3 SER 11 -0.812 2.762 12.853
84 HG SER 11 HG SER 11 0.989 3.602 10.818
85 H SER 12 H SER 12 -3.759 3.217 9.611
86 HA SER 12 HA SER 12 -5.453 3.168 12.077
87 HB2 SER 12 HB2 SER 12 -7.160 4.516 10.953
88 HB3 SER 12 HB3 SER 12 -5.635 5.381 11.194
89 HG SER 12 HG SER 12 -5.877 5.800 9.169
90 H CYS 13 H CYS 13 -4.796 1.677 9.046
91 HA CYS 13 HA CYS 13 -7.230 -0.027 9.329
92 HB2 CYS 13 HB2 CYS 13 -6.163 1.190 6.786
93 HB3 CYS 13 HB3 CYS 13 -7.604 0.185 6.945
94 H HIS 14 H HIS 14 -4.126 -0.587 9.712
95 HA HIS 14 HA HIS 14 -4.095 -3.058 8.042
96 HB2 HIS 14 2HB HIS 14 -1.665 -1.302 8.281
97 HB3 HIS 14 3HB HIS 14 -1.975 -2.603 7.140
98 HD1 HIS 14 1HD HIS 14 -2.145 1.043 7.524
99 HD2 HIS 14 2HD HIS 14 -3.808 -1.964 5.102
100 HE1 HIS 14 1HE HIS 14 -2.989 2.229 5.482
101 H THR 15 H THR 15 -1.954 -4.202 8.462
102 HA THR 15 HA THR 15 -0.570 -3.807 11.006
103 HB THR 15 HB THR 15 -0.341 -6.458 11.157
104 HG1 THR 15 HG1 THR 15 -2.870 -6.049 9.935
105 HG21 THR 15 HG21 THR 15 -2.198 -6.571 12.762
106 HG22 THR 15 HG22 THR 15 -2.716 -4.945 12.255
107 HG23 THR 15 HG23 THR 15 -1.118 -5.200 13.018
108 H VAL 16 H VAL 16 1.707 -4.265 10.716
109 HA VAL 16 HA VAL 16 2.425 -5.720 8.155
110 HB VAL 16 HB VAL 16 4.409 -4.024 9.695
111 HG11 VAL 16 HG11 VAL 16 5.538 -4.073 7.470
112 HG12 VAL 16 HG12 VAL 16 5.301 -5.689 8.125
113 HG13 VAL 16 HG13 VAL 16 4.241 -5.098 6.829
114 HG21 VAL 16 HG21 VAL 16 4.080 -2.272 7.961
115 HG22 VAL 16 HG22 VAL 16 2.610 -3.116 7.421
116 HG23 VAL 16 HG23 VAL 16 2.707 -2.423 9.052
117 H GLY 17 H GLY 17 2.430 -7.765 8.613
118 HA2 GLY 17 HA2 GLY 17 3.095 -9.765 9.579
119 HA3 GLY 17 HA3 GLY 17 4.370 -8.908 10.459
120 H ASN 18 H ASN 18 0.835 -8.523 10.509
121 HA ASN 18 HA ASN 18 -0.630 -8.093 12.197
122 HB2 ASN 18 HB2 ASN 18 0.021 -10.606 12.203
123 HB3 ASN 18 HB3 ASN 18 0.689 -10.153 13.766
124 HD21 ASN 18 HD21 ASN 18 -0.773 -10.023 15.506
125 HD22 ASN 18 HD22 ASN 18 -2.489 -10.369 15.290
126 H THR 19 H THR 19 2.320 -6.787 12.627
127 HA THR 19 HA THR 19 2.271 -6.435 15.522
128 HB THR 19 HB THR 19 4.294 -5.146 15.316
129 HG1 THR 19 HG1 THR 19 4.142 -5.467 12.508
130 HG21 THR 19 HG21 THR 19 4.500 -7.641 15.157
131 HG22 THR 19 HG22 THR 19 5.821 -6.741 14.391
132 HG23 THR 19 HG23 THR 19 4.561 -7.478 13.387
133 H GLU 20 H GLU 20 2.399 -4.457 16.658
134 HA GLU 20 HA GLU 20 1.005 -2.891 17.521
135 HB2 GLU 20 HB2 GLU 20 1.960 -1.407 15.064
136 HB3 GLU 20 HB3 GLU 20 1.243 -0.674 16.496
137 HG2 GLU 20 HG2 GLU 20 3.111 -2.000 17.810
138 HG3 GLU 20 HG3 GLU 20 3.909 -2.110 16.245
139 HA PRO 21 HA PRO 21 -2.715 -3.752 14.864
140 HB2 PRO 21 HB2 PRO 21 -3.904 -5.810 16.134
141 HB3 PRO 21 HB3 PRO 21 -2.444 -6.075 15.135
142 HG2 PRO 21 HG2 PRO 21 -2.582 -5.715 18.149
143 HG3 PRO 21 HG3 PRO 21 -1.747 -7.006 17.226
144 HD2 PRO 21 HD2 PRO 21 -0.473 -4.736 18.120
145 HD3 PRO 21 HD3 PRO 21 -0.022 -5.595 16.619
146 H GLY 22 H GLY 22 -4.883 -3.184 15.222
147 HA2 GLY 22 HA2 GLY 22 -6.306 -2.880 17.619
148 HA3 GLY 22 HA3 GLY 22 -5.496 -1.336 17.307
149 H GLN 23 H GLN 23 -7.687 -0.483 17.055
150 HA GLN 23 HA GLN 23 -9.376 0.383 15.741
151 HB2 GLN 23 HB2 GLN 23 -6.958 0.370 13.918
152 HB3 GLN 23 HB3 GLN 23 -8.386 1.385 13.687
153 HG2 GLN 23 HG2 GLN 23 -7.972 2.565 15.774
154 HG3 GLN 23 HG3 GLN 23 -6.667 1.456 16.210
155 HE21 GLN 23 HE21 GLN 23 -4.656 1.448 14.877
156 HE22 GLN 23 HE22 GLN 23 -4.250 2.902 13.997
157 HA PRO 24 HA PRO 24 -10.201 -3.637 13.563
158 HB2 PRO 24 HB2 PRO 24 -12.401 -4.538 14.910
159 HB3 PRO 24 HB3 PRO 24 -10.770 -4.558 15.638
160 HG2 PRO 24 HG2 PRO 24 -12.914 -2.424 15.969
161 HG3 PRO 24 HG3 PRO 24 -12.038 -3.314 17.260
162 HD2 PRO 24 HD2 PRO 24 -11.203 -0.875 16.412
163 HD3 PRO 24 HD3 PRO 24 -10.031 -2.161 16.827
164 H GLY 25 H GLY 25 -12.566 -4.616 12.767
165 HA2 GLY 25 HA2 GLY 25 -14.100 -4.375 11.041
166 HA3 GLY 25 HA3 GLY 25 -14.004 -2.614 11.178
167 H ILE 26 H ILE 26 -11.122 -2.527 11.014
168 HA ILE 26 HA ILE 26 -10.271 -3.650 8.416
169 HB ILE 26 HB ILE 26 -8.946 -1.551 8.094
170 HG12 ILE 26 HG12 ILE 26 -9.521 -0.657 10.470
171 HG13 ILE 26 HG13 ILE 26 -9.361 0.398 9.087
172 HG21 ILE 26 HG21 ILE 26 -10.760 -2.175 6.642
173 HG22 ILE 26 HG22 ILE 26 -11.953 -1.450 7.723
174 HG23 ILE 26 HG23 ILE 26 -10.765 -0.420 6.894
175 HD11 ILE 26 HD11 ILE 26 -12.060 -0.445 10.171
176 HD12 ILE 26 HD12 ILE 26 -11.212 1.059 10.568
177 HD13 ILE 26 HD13 ILE 26 -11.731 0.758 8.906
178 H GLY 27 H GLY 27 -7.740 -3.329 8.319
179 HA2 GLY 27 HA2 GLY 27 -5.865 -3.397 10.152
180 HA3 GLY 27 HA3 GLY 27 -6.749 -4.806 10.682
181 HA PRO 28 HA PRO 28 -5.405 -7.301 7.116
182 HB2 PRO 28 HB2 PRO 28 -5.183 -5.320 4.829
183 HB3 PRO 28 HB3 PRO 28 -5.538 -7.079 4.748
184 HG2 PRO 28 HG2 PRO 28 -7.579 -5.322 4.724
185 HG3 PRO 28 HG3 PRO 28 -7.675 -6.771 5.770
186 HD2 PRO 28 HD2 PRO 28 -7.024 -3.926 6.532
187 HD3 PRO 28 HD3 PRO 28 -8.004 -5.167 7.387
188 H ASP 29 H ASP 29 -3.514 -8.193 6.389
189 HA ASP 29 HA ASP 29 -1.204 -6.905 7.541
190 HB2 ASP 29 HB2 ASP 29 -2.022 -9.284 7.883
191 HB3 ASP 29 HB3 ASP 29 -1.272 -9.667 6.337
192 H LEU 30 H LEU 30 0.548 -6.043 6.571
193 HA LEU 30 HA LEU 30 0.737 -6.042 3.602
194 HB2 LEU 30 HB2 LEU 30 2.160 -4.168 5.485
195 HB3 LEU 30 HB3 LEU 30 1.819 -3.946 3.775
196 HG LEU 30 HG LEU 30 -0.185 -3.870 6.060
197 HD11 LEU 30 HD11 LEU 30 1.284 -1.892 5.888
198 HD12 LEU 30 HD12 LEU 30 -0.378 -1.484 5.452
199 HD13 LEU 30 HD13 LEU 30 0.846 -1.697 4.177
200 HD21 LEU 30 HD21 LEU 30 -0.633 -3.389 3.074
201 HD22 LEU 30 HD22 LEU 30 -1.828 -3.109 4.365
202 HD23 LEU 30 HD23 LEU 30 -1.289 -4.746 4.019
203 H LEU 31 H LEU 31 2.223 -7.884 5.878
204 HA LEU 31 HA LEU 31 5.013 -7.454 5.216
205 HB2 LEU 31 HB2 LEU 31 3.962 -8.341 7.313
206 HB3 LEU 31 HB3 LEU 31 3.708 -9.849 6.506
207 HG LEU 31 HG LEU 31 5.523 -10.049 8.002
208 HD11 LEU 31 HD11 LEU 31 5.931 -11.079 5.702
209 HD12 LEU 31 HD12 LEU 31 7.333 -10.833 6.754
210 HD13 LEU 31 HD13 LEU 31 7.045 -9.712 5.428
211 HD21 LEU 31 HD21 LEU 31 6.664 -7.537 6.725
212 HD22 LEU 31 HD22 LEU 31 7.544 -8.579 7.862
213 HD23 LEU 31 HD23 LEU 31 6.071 -7.768 8.386
214 H GLY 32 H GLY 32 6.310 -8.527 3.884
215 HA2 GLY 32 HA2 GLY 32 7.062 -9.837 2.081
216 HA3 GLY 32 HA3 GLY 32 5.660 -10.875 2.329
217 H VAL 33 H VAL 33 4.283 -7.921 1.796
218 HA VAL 33 HA VAL 33 3.280 -8.563 -0.770
219 HB VAL 33 HB VAL 33 3.350 -5.928 0.742
220 HG11 VAL 33 HG11 VAL 33 1.573 -6.716 -1.594
221 HG12 VAL 33 HG12 VAL 33 1.446 -5.234 -0.641
222 HG13 VAL 33 HG13 VAL 33 2.869 -5.494 -1.658
223 HG21 VAL 33 HG21 VAL 33 1.030 -6.541 1.343
224 HG22 VAL 33 HG22 VAL 33 1.169 -8.052 0.429
225 HG23 VAL 33 HG23 VAL 33 2.135 -7.802 1.888
226 H THR 34 H THR 34 6.102 -6.465 0.081
227 HA THR 34 HA THR 34 6.513 -5.573 -2.626
228 HB THR 34 HB THR 34 8.679 -4.759 -1.958
229 HG1 THR 34 HG1 THR 34 9.766 -5.481 -0.470
230 HG21 THR 34 HG21 THR 34 6.749 -3.463 -1.191
231 HG22 THR 34 HG22 THR 34 8.141 -3.349 -0.098
232 HG23 THR 34 HG23 THR 34 6.754 -4.370 0.337
233 H ARG 35 H ARG 35 7.054 -8.682 -1.355
234 HA ARG 35 HA ARG 35 8.619 -9.434 -3.783
235 HB2 ARG 35 HB2 ARG 35 9.553 -11.315 -2.557
236 HB3 ARG 35 HB3 ARG 35 9.952 -9.778 -1.790
237 HG2 ARG 35 HG2 ARG 35 8.255 -10.126 -0.072
238 HG3 ARG 35 HG3 ARG 35 7.691 -11.608 -0.879
239 HD2 ARG 35 HD2 ARG 35 9.929 -12.627 -0.450
240 HD3 ARG 35 HD3 ARG 35 10.393 -11.156 0.431
241 HE ARG 35 HE ARG 35 7.955 -12.693 1.203
242 HH11 ARG 35 HH11 ARG 35 11.204 -11.566 2.166
243 HH12 ARG 35 HH12 ARG 35 10.951 -11.987 3.845
244 HH21 ARG 35 HH21 ARG 35 7.679 -13.204 3.368
245 HH22 ARG 35 HH22 ARG 35 8.960 -12.915 4.523
246 H GLN 36 H GLN 36 5.525 -9.395 -2.853
247 HA GLN 36 HA GLN 36 4.898 -11.940 -4.295
248 HB2 GLN 36 HB2 GLN 36 3.522 -10.727 -1.872
249 HB3 GLN 36 HB3 GLN 36 2.805 -12.004 -2.839
250 HG2 GLN 36 HG2 GLN 36 5.430 -12.225 -1.315
251 HG3 GLN 36 HG3 GLN 36 3.886 -12.890 -0.819
252 HE21 GLN 36 HE21 GLN 36 5.930 -14.620 -0.898
253 HE22 GLN 36 HE22 GLN 36 5.785 -15.675 -2.315
254 H ARG 37 H ARG 37 4.587 -8.616 -4.533
255 HA ARG 37 HA ARG 37 2.473 -8.909 -6.646
256 HB2 ARG 37 HB2 ARG 37 3.313 -6.406 -5.140
257 HB3 ARG 37 HB3 ARG 37 2.059 -6.500 -6.381
258 HG2 ARG 37 HG2 ARG 37 1.962 -7.848 -3.647
259 HG3 ARG 37 HG3 ARG 37 1.173 -6.331 -4.072
260 HD2 ARG 37 HD2 ARG 37 -0.292 -7.439 -5.655
261 HD3 ARG 37 HD3 ARG 37 0.557 -8.978 -5.444
262 HE ARG 37 HE ARG 37 -1.160 -7.592 -3.437
263 HH11 ARG 37 HH11 ARG 37 0.553 -10.579 -4.392
264 HH12 ARG 37 HH12 ARG 37 -0.044 -11.472 -3.010
265 HH21 ARG 37 HH21 ARG 37 -1.862 -8.780 -1.659
266 HH22 ARG 37 HH22 ARG 37 -1.404 -10.458 -1.473
267 H ASP 38 H ASP 38 2.996 -7.832 -8.694
268 HA ASP 38 HA ASP 38 5.807 -7.517 -9.330
269 HB2 ASP 38 HB2 ASP 38 3.715 -7.880 -10.950
270 HB3 ASP 38 HB3 ASP 38 3.620 -6.132 -10.899
271 H ALA 39 H ALA 39 7.132 -5.815 -9.090
272 HA ALA 39 HA ALA 39 6.503 -3.991 -7.065
273 HB1 ALA 39 HB1 ALA 39 8.739 -3.083 -7.559
274 HB2 ALA 39 HB2 ALA 39 8.743 -4.860 -7.638
275 HB3 ALA 39 HB3 ALA 39 8.744 -3.913 -9.135
276 H ASN 40 H ASN 40 6.712 -3.354 -10.605
277 HA ASN 40 HA ASN 40 6.020 -0.578 -10.303
278 HB2 ASN 40 HB2 ASN 40 6.210 -2.493 -12.664
279 HB3 ASN 40 HB3 ASN 40 5.620 -0.860 -12.875
280 HD21 ASN 40 HD21 ASN 40 8.463 -2.782 -12.304
281 HD22 ASN 40 HD22 ASN 40 9.583 -1.413 -12.308
282 H TRP 41 H TRP 41 3.924 -3.384 -10.345
283 HA TRP 41 HA TRP 41 1.479 -1.777 -10.748
284 HB2 TRP 41 HB2 TRP 41 1.521 -4.250 -11.248
285 HB3 TRP 41 HB3 TRP 41 1.850 -4.562 -9.564
286 HD1 TRP 41 HD1 TRP 41 -0.990 -3.529 -11.877
287 HE1 TRP 41 HE1 TRP 41 -3.250 -3.667 -10.631
288 HE3 TRP 41 HE3 TRP 41 0.734 -4.496 -7.152
289 HZ2 TRP 41 HZ2 TRP 41 -4.145 -3.913 -7.924
290 HZ3 TRP 41 HZ3 TRP 41 -0.862 -4.642 -5.240
291 HH2 TRP 41 HH2 TRP 41 -3.294 -4.335 -5.618
292 H LEU 42 H LEU 42 3.246 -3.244 -7.983
293 HA LEU 42 HA LEU 42 1.393 -2.414 -6.016
294 HB2 LEU 42 HB2 LEU 42 3.003 -4.241 -5.841
295 HB3 LEU 42 HB3 LEU 42 4.350 -3.133 -5.795
296 HG LEU 42 HG LEU 42 3.608 -4.239 -3.635
297 HD11 LEU 42 HD11 LEU 42 5.124 -2.274 -3.683
298 HD12 LEU 42 HD12 LEU 42 4.139 -2.389 -2.216
299 HD13 LEU 42 HD13 LEU 42 3.720 -1.212 -3.467
300 HD21 LEU 42 HD21 LEU 42 1.153 -3.865 -3.894
301 HD22 LEU 42 HD22 LEU 42 1.415 -2.132 -3.612
302 HD23 LEU 42 HD23 LEU 42 1.799 -3.303 -2.343
303 H VAL 43 H VAL 43 4.475 -0.829 -6.979
304 HA VAL 43 HA VAL 43 4.145 1.303 -5.062
305 HB VAL 43 HB VAL 43 5.927 1.251 -7.520
306 HG11 VAL 43 HG11 VAL 43 5.698 3.513 -6.585
307 HG12 VAL 43 HG12 VAL 43 6.062 2.903 -4.953
308 HG13 VAL 43 HG13 VAL 43 7.298 2.870 -6.229
309 HG21 VAL 43 HG21 VAL 43 7.717 0.566 -5.931
310 HG22 VAL 43 HG22 VAL 43 6.523 0.411 -4.630
311 HG23 VAL 43 HG23 VAL 43 6.460 -0.657 -6.044
312 H ARG 44 H ARG 44 2.959 0.872 -8.329
313 HA ARG 44 HA ARG 44 1.891 3.581 -8.569
314 HB2 ARG 44 HB2 ARG 44 1.341 1.015 -10.073
315 HB3 ARG 44 HB3 ARG 44 0.345 2.462 -10.278
316 HG2 ARG 44 HG2 ARG 44 2.300 3.802 -10.893
317 HG3 ARG 44 HG3 ARG 44 3.354 2.387 -10.714
318 HD2 ARG 44 HD2 ARG 44 2.154 1.228 -12.528
319 HD3 ARG 44 HD3 ARG 44 0.964 2.532 -12.609
320 HE ARG 44 HE ARG 44 2.365 3.773 -13.893
321 HH11 ARG 44 HH11 ARG 44 4.371 1.230 -12.394
322 HH12 ARG 44 HH12 ARG 44 5.762 1.609 -13.383
323 HH21 ARG 44 HH21 ARG 44 4.182 4.215 -15.152
324 HH22 ARG 44 HH22 ARG 44 5.656 3.297 -14.941
325 H TRP 45 H TRP 45 0.456 0.451 -7.606
326 HA TRP 45 HA TRP 45 -2.175 1.261 -7.088
327 HB2 TRP 45 HB2 TRP 45 -1.652 -1.060 -7.172
328 HB3 TRP 45 HB3 TRP 45 -0.415 -0.922 -5.943
329 HD1 TRP 45 HD1 TRP 45 -1.097 -2.107 -3.842
330 HE1 TRP 45 HE1 TRP 45 -3.289 -2.551 -2.527
331 HE3 TRP 45 HE3 TRP 45 -4.363 0.513 -6.751
332 HZ2 TRP 45 HZ2 TRP 45 -6.052 -1.872 -2.730
333 HZ3 TRP 45 HZ3 TRP 45 -6.784 0.595 -6.188
334 HH2 TRP 45 HH2 TRP 45 -7.637 -0.595 -4.177
335 H LEU 46 H LEU 46 0.442 0.965 -4.619
336 HA LEU 46 HA LEU 46 -1.295 2.062 -2.617
337 HB2 LEU 46 HB2 LEU 46 0.130 1.257 -1.175
338 HB3 LEU 46 HB3 LEU 46 0.906 0.477 -2.549
339 HG LEU 46 HG LEU 46 1.855 3.121 -1.349
340 HD11 LEU 46 HD11 LEU 46 2.107 1.290 0.272
341 HD12 LEU 46 HD12 LEU 46 3.673 1.749 -0.404
342 HD13 LEU 46 HD13 LEU 46 2.865 0.270 -0.974
343 HD21 LEU 46 HD21 LEU 46 2.467 2.689 -3.752
344 HD22 LEU 46 HD22 LEU 46 3.140 1.125 -3.238
345 HD23 LEU 46 HD23 LEU 46 3.858 2.641 -2.668
346 H LYS 47 H LYS 47 0.291 3.697 -5.025
347 HA LYS 47 HA LYS 47 0.656 6.243 -3.549
348 HB2 LYS 47 HB2 LYS 47 2.419 5.350 -4.995
349 HB3 LYS 47 HB3 LYS 47 1.341 5.347 -6.383
350 HG2 LYS 47 HG2 LYS 47 1.400 7.680 -6.609
351 HG3 LYS 47 HG3 LYS 47 1.919 7.938 -4.938
352 HD2 LYS 47 HD2 LYS 47 3.749 8.350 -6.572
353 HD3 LYS 47 HD3 LYS 47 4.126 7.103 -5.381
354 HE2 LYS 47 HE2 LYS 47 3.466 5.364 -7.120
355 HE3 LYS 47 HE3 LYS 47 3.369 6.679 -8.305
356 HZ1 LYS 47 HZ1 LYS 47 5.715 7.136 -7.894
357 HZ2 LYS 47 HZ2 LYS 47 5.564 5.514 -8.231
358 HZ3 LYS 47 HZ3 LYS 47 5.790 6.059 -6.692
359 H VAL 48 H VAL 48 -1.601 4.790 -5.849
360 HA VAL 48 HA VAL 48 -3.282 7.206 -5.634
361 HB VAL 48 HB VAL 48 -1.640 7.475 -7.540
362 HG11 VAL 48 HG11 VAL 48 -1.936 5.166 -8.533
363 HG12 VAL 48 HG12 VAL 48 -3.461 5.743 -9.214
364 HG13 VAL 48 HG13 VAL 48 -1.968 6.553 -9.646
365 HG21 VAL 48 HG21 VAL 48 -3.348 9.017 -7.353
366 HG22 VAL 48 HG22 VAL 48 -3.406 8.488 -9.032
367 HG23 VAL 48 HG23 VAL 48 -4.598 7.875 -7.856
368 HA PRO 49 HA PRO 49 -5.008 2.809 -5.751
369 HB2 PRO 49 HB2 PRO 49 -6.457 2.746 -3.392
370 HB3 PRO 49 HB3 PRO 49 -4.717 2.369 -3.534
371 HG2 PRO 49 HG2 PRO 49 -5.988 5.019 -2.759
372 HG3 PRO 49 HG3 PRO 49 -4.667 4.144 -1.919
373 HD2 PRO 49 HD2 PRO 49 -4.094 6.151 -3.619
374 HD3 PRO 49 HD3 PRO 49 -3.112 4.655 -3.635
375 H ASP 50 H ASP 50 -6.907 5.687 -4.777
376 HA ASP 50 HA ASP 50 -9.452 4.718 -5.605
377 HB2 ASP 50 HB2 ASP 50 -9.035 6.612 -4.080
378 HB3 ASP 50 HB3 ASP 50 -8.379 7.561 -5.420
379 H GLN 51 H GLN 51 -6.945 6.506 -7.465
380 HA GLN 51 HA GLN 51 -8.499 6.679 -9.909
381 HB2 GLN 51 HB2 GLN 51 -6.490 8.120 -9.282
382 HB3 GLN 51 HB3 GLN 51 -5.491 6.686 -9.558
383 HG2 GLN 51 HG2 GLN 51 -6.638 6.685 -11.945
384 HG3 GLN 51 HG3 GLN 51 -7.019 8.358 -11.549
385 HE21 GLN 51 HE21 GLN 51 -4.269 5.994 -11.816
386 HE22 GLN 51 HE22 GLN 51 -3.170 7.209 -12.427
387 H MET 52 H MET 52 -6.186 4.283 -8.534
388 HA MET 52 HA MET 52 -5.992 2.709 -10.921
389 HB2 MET 52 HB2 MET 52 -4.440 2.626 -8.910
390 HB3 MET 52 HB3 MET 52 -5.716 1.767 -8.042
391 HG2 MET 52 HG2 MET 52 -4.202 0.101 -8.895
392 HG3 MET 52 HG3 MET 52 -5.671 -0.001 -9.843
393 HE1 MET 52 HE1 MET 52 -1.478 1.299 -11.184
394 HE2 MET 52 HE2 MET 52 -2.268 2.048 -9.777
395 HE3 MET 52 HE3 MET 52 -1.908 0.303 -9.777
396 H LEU 53 H LEU 53 -8.319 2.531 -8.173
397 HA LEU 53 HA LEU 53 -9.709 0.274 -9.326
398 HB2 LEU 53 HB2 LEU 53 -9.665 1.113 -6.879
399 HB3 LEU 53 HB3 LEU 53 -10.844 2.321 -7.393
400 HG LEU 53 HG LEU 53 -12.338 0.446 -8.144
401 HD11 LEU 53 HD11 LEU 53 -10.741 -1.400 -8.491
402 HD12 LEU 53 HD12 LEU 53 -11.877 -1.849 -7.232
403 HD13 LEU 53 HD13 LEU 53 -10.249 -1.322 -6.782
404 HD21 LEU 53 HD21 LEU 53 -12.593 1.488 -5.915
405 HD22 LEU 53 HD22 LEU 53 -11.457 0.305 -5.227
406 HD23 LEU 53 HD23 LEU 53 -13.022 -0.227 -5.872
407 H ALA 54 H ALA 54 -9.997 3.799 -9.725
408 HA ALA 54 HA ALA 54 -12.332 3.692 -11.410
409 HB1 ALA 54 HB1 ALA 54 -10.231 5.870 -11.144
410 HB2 ALA 54 HB2 ALA 54 -11.859 6.039 -11.822
411 HB3 ALA 54 HB3 ALA 54 -11.658 5.683 -10.099
412 H GLU 55 H GLU 55 -8.883 3.201 -12.197
413 HA GLU 55 HA GLU 55 -9.404 3.454 -15.053
414 HB2 GLU 55 HB2 GLU 55 -7.200 3.039 -15.472
415 HB3 GLU 55 HB3 GLU 55 -7.168 3.913 -13.958
416 HG2 GLU 55 HG2 GLU 55 -6.580 1.924 -12.757
417 HG3 GLU 55 HG3 GLU 55 -6.979 0.869 -14.105
418 H LYS 56 H LYS 56 -10.435 1.147 -13.009
419 HA LYS 56 HA LYS 56 -11.123 -1.009 -13.077
420 HB2 LYS 56 HB2 LYS 56 -11.176 -0.730 -16.096
421 HB3 LYS 56 HB3 LYS 56 -11.979 -1.971 -15.132
422 HG2 LYS 56 HG2 LYS 56 -13.379 -0.227 -14.038
423 HG3 LYS 56 HG3 LYS 56 -12.565 1.020 -15.003
424 HD2 LYS 56 HD2 LYS 56 -13.333 -0.240 -17.078
425 HD3 LYS 56 HD3 LYS 56 -14.378 -1.205 -16.018
426 HE2 LYS 56 HE2 LYS 56 -15.632 0.741 -15.331
427 HE3 LYS 56 HE3 LYS 56 -14.403 1.837 -15.988
428 HZ1 LYS 56 HZ1 LYS 56 -16.212 1.787 -17.515
429 HZ2 LYS 56 HZ2 LYS 56 -16.231 0.152 -17.614
430 HZ3 LYS 56 HZ3 LYS 56 -14.951 1.023 -18.210
431 H ASP 57 H ASP 57 -9.103 -1.394 -12.134
432 HA ASP 57 HA ASP 57 -7.090 -2.939 -13.670
433 HB2 ASP 57 HB2 ASP 57 -6.230 -1.028 -12.335
434 HB3 ASP 57 HB3 ASP 57 -6.895 -1.767 -10.873
435 HA PRO 58 HA PRO 58 -9.753 -6.045 -12.014
436 HB2 PRO 58 HB2 PRO 58 -8.779 -8.225 -13.266
437 HB3 PRO 58 HB3 PRO 58 -9.518 -6.805 -14.102
438 HG2 PRO 58 HG2 PRO 58 -6.531 -7.190 -13.681
439 HG3 PRO 58 HG3 PRO 58 -7.397 -7.076 -15.261
440 HD2 PRO 58 HD2 PRO 58 -6.371 -4.922 -14.030
441 HD3 PRO 58 HD3 PRO 58 -7.989 -4.818 -14.795
442 H LEU 59 H LEU 59 -6.270 -6.173 -11.528
443 HA LEU 59 HA LEU 59 -6.391 -8.133 -9.381
444 HB2 LEU 59 HB2 LEU 59 -4.305 -7.730 -10.597
445 HB3 LEU 59 HB3 LEU 59 -4.258 -6.062 -10.011
446 HG LEU 59 HG LEU 59 -3.924 -6.801 -7.722
447 HD11 LEU 59 HD11 LEU 59 -4.155 -9.621 -8.848
448 HD12 LEU 59 HD12 LEU 59 -5.215 -8.866 -7.633
449 HD13 LEU 59 HD13 LEU 59 -3.538 -9.226 -7.224
450 HD21 LEU 59 HD21 LEU 59 -1.721 -7.800 -7.953
451 HD22 LEU 59 HD22 LEU 59 -1.963 -6.653 -9.281
452 HD23 LEU 59 HD23 LEU 59 -2.118 -8.391 -9.582
453 H ALA 60 H ALA 60 -6.380 -4.472 -9.413
454 HA ALA 60 HA ALA 60 -6.575 -4.302 -6.558
455 HB1 ALA 60 HB1 ALA 60 -7.660 -2.385 -8.629
456 HB2 ALA 60 HB2 ALA 60 -7.422 -2.082 -6.889
457 HB3 ALA 60 HB3 ALA 60 -6.011 -2.387 -7.929
458 H MET 61 H MET 61 -9.136 -4.599 -9.020
459 HA MET 61 HA MET 61 -11.460 -4.564 -7.397
460 HB2 MET 61 HB2 MET 61 -10.702 -5.943 -9.980
461 HB3 MET 61 HB3 MET 61 -12.324 -5.997 -9.326
462 HG2 MET 61 HG2 MET 61 -10.856 -3.394 -9.918
463 HG3 MET 61 HG3 MET 61 -11.830 -4.238 -11.111
464 HE1 MET 61 HE1 MET 61 -14.187 -4.823 -10.904
465 HE2 MET 61 HE2 MET 61 -14.376 -5.264 -9.195
466 HE3 MET 61 HE3 MET 61 -15.417 -4.002 -9.900
467 H LEU 62 H LEU 62 -8.952 -7.018 -7.602
468 HA LEU 62 HA LEU 62 -10.521 -9.125 -6.320
469 HB2 LEU 62 HB2 LEU 62 -8.342 -9.189 -7.867
470 HB3 LEU 62 HB3 LEU 62 -7.522 -8.956 -6.326
471 HG LEU 62 HG LEU 62 -9.353 -11.255 -7.090
472 HD11 LEU 62 HD11 LEU 62 -6.352 -11.168 -6.542
473 HD12 LEU 62 HD12 LEU 62 -7.103 -11.247 -8.150
474 HD13 LEU 62 HD13 LEU 62 -7.303 -12.594 -7.019
475 HD21 LEU 62 HD21 LEU 62 -7.840 -10.740 -4.491
476 HD22 LEU 62 HD22 LEU 62 -8.506 -12.318 -4.961
477 HD23 LEU 62 HD23 LEU 62 -9.598 -10.959 -4.707
478 H LEU 63 H LEU 63 -7.895 -6.774 -5.272
479 HA LEU 63 HA LEU 63 -7.750 -8.109 -2.666
480 HB2 LEU 63 HB2 LEU 63 -6.799 -5.292 -3.445
481 HB3 LEU 63 HB3 LEU 63 -6.514 -6.061 -1.903
482 HG LEU 63 HG LEU 63 -5.096 -7.798 -3.026
483 HD11 LEU 63 HD11 LEU 63 -5.669 -5.979 -5.372
484 HD12 LEU 63 HD12 LEU 63 -5.865 -7.740 -5.279
485 HD13 LEU 63 HD13 LEU 63 -4.237 -7.054 -5.322
486 HD21 LEU 63 HD21 LEU 63 -3.209 -6.206 -3.370
487 HD22 LEU 63 HD22 LEU 63 -4.160 -5.769 -1.940
488 HD23 LEU 63 HD23 LEU 63 -4.380 -4.859 -3.438
489 H PHE 64 H PHE 64 -9.118 -5.121 -3.824
490 HA PHE 64 HA PHE 64 -9.879 -4.179 -1.216
491 HB2 PHE 64 HB2 PHE 64 -10.332 -2.277 -2.212
492 HB3 PHE 64 HB3 PHE 64 -9.803 -3.003 -3.711
493 HD1 PHE 64 HD1 PHE 64 -11.478 -3.775 -5.378
494 HD2 PHE 64 HD2 PHE 64 -12.686 -1.945 -1.686
495 HE1 PHE 64 HE1 PHE 64 -13.789 -3.531 -6.260
496 HE2 PHE 64 HE2 PHE 64 -14.982 -1.648 -2.566
497 HZ PHE 64 HZ PHE 64 -15.556 -2.483 -4.842
498 H GLU 65 H GLU 65 -11.725 -6.112 -3.535
499 HA GLU 65 HA GLU 65 -14.165 -6.290 -1.968
500 HB2 GLU 65 HB2 GLU 65 -12.959 -8.032 -4.145
501 HB3 GLU 65 HB3 GLU 65 -14.514 -8.372 -3.413
502 HG2 GLU 65 HG2 GLU 65 -13.879 -5.766 -4.850
503 HG3 GLU 65 HG3 GLU 65 -14.517 -7.187 -5.658
504 H GLN 66 H GLN 66 -11.353 -8.531 -2.393
505 HA GLN 66 HA GLN 66 -12.667 -10.371 -0.541
506 HB2 GLN 66 HB2 GLN 66 -10.334 -10.666 -2.461
507 HB3 GLN 66 HB3 GLN 66 -10.922 -11.983 -1.449
508 HG2 GLN 66 HG2 GLN 66 -12.584 -10.516 -3.541
509 HG3 GLN 66 HG3 GLN 66 -11.916 -12.136 -3.689
510 HE21 GLN 66 HE21 GLN 66 -14.791 -11.335 -3.804
511 HE22 GLN 66 HE22 GLN 66 -15.539 -12.284 -2.526
512 H TYR 67 H TYR 67 -10.244 -8.099 0.057
513 HA TYR 67 HA TYR 67 -9.384 -9.645 2.471
514 HB2 TYR 67 HB2 TYR 67 -8.488 -6.953 1.423
515 HB3 TYR 67 HB3 TYR 67 -7.840 -7.780 2.833
516 HD1 TYR 67 HD2 TYR 67 -7.990 -10.642 1.188
517 HD2 TYR 67 HD1 TYR 67 -6.157 -6.771 0.603
518 HE1 TYR 67 HE2 TYR 67 -6.242 -11.679 -0.203
519 HE2 TYR 67 HE1 TYR 67 -4.352 -7.839 -0.713
520 HH TYR 67 HH TYR 67 -3.577 -9.784 -1.626
521 H ASN 68 H ASN 68 -11.526 -6.952 1.645
522 HA ASN 68 HA ASN 68 -12.556 -6.978 4.408
523 HB2 ASN 68 HB2 ASN 68 -10.415 -5.566 4.378
524 HB3 ASN 68 HB3 ASN 68 -11.276 -4.424 3.339
525 HD21 ASN 68 HD21 ASN 68 -11.232 -5.958 6.586
526 HD22 ASN 68 HD22 ASN 68 -12.146 -4.643 7.332
527 H ARG 69 H ARG 69 -12.957 -5.867 1.076
528 HA ARG 69 HA ARG 69 -14.547 -4.827 -0.037
529 HB2 ARG 69 HB2 ARG 69 -15.920 -6.672 1.330
530 HB3 ARG 69 HB3 ARG 69 -16.758 -5.248 1.927
531 HG2 ARG 69 HG2 ARG 69 -16.338 -6.089 -0.967
532 HG3 ARG 69 HG3 ARG 69 -17.845 -6.217 -0.063
533 HD2 ARG 69 HD2 ARG 69 -18.028 -3.771 0.056
534 HD3 ARG 69 HD3 ARG 69 -16.472 -3.591 -0.784
535 HE ARG 69 HE ARG 69 -18.009 -5.167 -2.461
536 HH11 ARG 69 HH11 ARG 69 -18.295 -1.867 -1.127
537 HH12 ARG 69 HH12 ARG 69 -19.121 -1.260 -2.544
538 HH21 ARG 69 HH21 ARG 69 -19.071 -4.335 -4.269
539 HH22 ARG 69 HH22 ARG 69 -19.559 -2.655 -4.322
540 H LEU 70 H LEU 70 -12.916 -3.188 1.076
541 HA LEU 70 HA LEU 70 -14.502 -0.743 1.443
542 HB2 LEU 70 HB2 LEU 70 -14.141 -1.569 3.720
543 HB3 LEU 70 HB3 LEU 70 -12.410 -1.637 3.468
544 HG LEU 70 HG LEU 70 -13.426 0.262 4.851
545 HD11 LEU 70 HD11 LEU 70 -11.529 1.102 2.640
546 HD12 LEU 70 HD12 LEU 70 -11.082 0.245 4.128
547 HD13 LEU 70 HD13 LEU 70 -11.761 1.879 4.212
548 HD21 LEU 70 HD21 LEU 70 -14.173 2.263 3.734
549 HD22 LEU 70 HD22 LEU 70 -15.215 0.915 3.255
550 HD23 LEU 70 HD23 LEU 70 -13.970 1.530 2.140
551 H ALA 71 H ALA 71 -13.799 0.397 -0.252
552 HA ALA 71 HA ALA 71 -11.110 0.246 -1.322
553 HB1 ALA 71 HB1 ALA 71 -13.071 0.689 -2.739
554 HB2 ALA 71 HB2 ALA 71 -13.384 2.200 -1.857
555 HB3 ALA 71 HB3 ALA 71 -11.911 2.029 -2.832
556 H MET 72 H MET 72 -9.371 1.637 -0.994
557 HA MET 72 HA MET 72 -9.649 3.587 1.217
558 HB2 MET 72 HB2 MET 72 -7.294 3.387 1.596
559 HB3 MET 72 HB3 MET 72 -8.084 1.810 1.616
560 HG2 MET 72 HG2 MET 72 -7.242 1.369 -0.682
561 HG3 MET 72 HG3 MET 72 -6.435 2.946 -0.669
562 HE1 MET 72 HE1 MET 72 -4.957 0.382 -1.430
563 HE2 MET 72 HE2 MET 72 -4.077 1.918 -1.254
564 HE3 MET 72 HE3 MET 72 -3.448 0.445 -0.497
565 HA PRO 73 HA PRO 73 -9.038 6.939 -1.596
566 HB2 PRO 73 HB2 PRO 73 -8.756 9.036 0.083
567 HB3 PRO 73 HB3 PRO 73 -10.250 8.048 0.065
568 HG2 PRO 73 HG2 PRO 73 -7.874 7.796 1.949
569 HG3 PRO 73 HG3 PRO 73 -9.613 7.913 2.376
570 HD2 PRO 73 HD2 PRO 73 -8.297 5.511 2.156
571 HD3 PRO 73 HD3 PRO 73 -10.025 5.705 1.726
572 H ASN 74 H ASN 74 -7.561 8.581 -2.374
573 HA ASN 74 HA ASN 74 -4.686 8.169 -1.746
574 HB2 ASN 74 HB2 ASN 74 -5.399 8.464 -4.094
575 HB3 ASN 74 HB3 ASN 74 -6.049 10.054 -3.703
576 HD21 ASN 74 HD21 ASN 74 -4.341 10.055 -5.667
577 HD22 ASN 74 HD22 ASN 74 -2.695 10.524 -5.187
578 H MET 75 H MET 75 -4.115 8.985 0.152
579 HA MET 75 HA MET 75 -5.270 11.377 1.339
580 HB2 MET 75 HB2 MET 75 -2.911 9.681 2.230
581 HB3 MET 75 HB3 MET 75 -3.758 10.897 3.197
582 HG2 MET 75 HG2 MET 75 -5.813 9.566 3.149
583 HG3 MET 75 HG3 MET 75 -5.056 8.379 2.088
584 HE1 MET 75 HE1 MET 75 -5.396 9.791 5.678
585 HE2 MET 75 HE2 MET 75 -4.129 8.944 6.589
586 HE3 MET 75 HE3 MET 75 -3.682 10.201 5.422
587 H ARG 76 H ARG 76 -4.261 12.176 -1.085
588 HA ARG 76 HA ARG 76 -2.734 13.361 -2.282
589 HB2 ARG 76 HB2 ARG 76 -2.460 14.881 0.330
590 HB3 ARG 76 HB3 ARG 76 -1.916 15.471 -1.235
591 HG2 ARG 76 HG2 ARG 76 -4.836 14.803 -0.629
592 HG3 ARG 76 HG3 ARG 76 -4.106 16.381 -0.380
593 HD2 ARG 76 HD2 ARG 76 -5.239 16.497 -2.457
594 HD3 ARG 76 HD3 ARG 76 -3.512 16.502 -2.800
595 HE ARG 76 HE ARG 76 -3.706 14.497 -3.909
596 HH11 ARG 76 HH11 ARG 76 -6.766 15.034 -2.150
597 HH12 ARG 76 HH12 ARG 76 -7.573 13.705 -2.953
598 HH21 ARG 76 HH21 ARG 76 -4.788 12.797 -4.912
599 HH22 ARG 76 HH22 ARG 76 -6.452 12.439 -4.513
600 H LEU 77 H LEU 77 -1.629 11.203 -2.104
601 HA LEU 77 HA LEU 77 0.815 11.059 -0.511
602 HB2 LEU 77 HB2 LEU 77 -0.374 9.228 -2.624
603 HB3 LEU 77 HB3 LEU 77 1.018 8.831 -1.624
604 HG LEU 77 HG LEU 77 -1.774 9.415 -0.523
605 HD11 LEU 77 HD11 LEU 77 -0.349 6.762 -0.922
606 HD12 LEU 77 HD12 LEU 77 -1.724 7.354 -1.876
607 HD13 LEU 77 HD13 LEU 77 -1.933 6.998 -0.151
608 HD21 LEU 77 HD21 LEU 77 -0.904 8.395 1.549
609 HD22 LEU 77 HD22 LEU 77 -0.009 9.854 1.139
610 HD23 LEU 77 HD23 LEU 77 0.712 8.264 0.816
611 H GLY 78 H GLY 78 2.659 11.942 -1.008
612 HA2 GLY 78 HA2 GLY 78 3.312 12.902 -3.712
613 HA3 GLY 78 HA3 GLY 78 4.274 13.100 -2.247
614 H ASP 79 H ASP 79 5.025 12.147 -5.014
615 HA ASP 79 HA ASP 79 5.400 9.339 -5.096
616 HB2 ASP 79 HB2 ASP 79 5.604 10.957 -6.987
617 HB3 ASP 79 HB3 ASP 79 7.151 11.500 -6.330
618 H ALA 80 H ALA 80 7.629 11.846 -3.834
619 HA ALA 80 HA ALA 80 9.729 9.945 -3.180
620 HB1 ALA 80 HB1 ALA 80 10.113 12.323 -3.813
621 HB2 ALA 80 HB2 ALA 80 9.319 12.837 -2.306
622 HB3 ALA 80 HB3 ALA 80 10.829 11.912 -2.250
623 H GLU 81 H GLU 81 6.971 11.311 -1.360
624 HA GLU 81 HA GLU 81 7.725 10.323 1.250
625 HB2 GLU 81 HB2 GLU 81 6.193 12.086 1.196
626 HB3 GLU 81 HB3 GLU 81 5.291 11.426 -0.168
627 HG2 GLU 81 HG2 GLU 81 4.328 9.699 1.209
628 HG3 GLU 81 HG3 GLU 81 5.262 10.251 2.617
629 H VAL 82 H VAL 82 5.766 9.018 -1.485
630 HA VAL 82 HA VAL 82 5.261 6.486 -0.192
631 HB VAL 82 HB VAL 82 5.174 7.298 -3.115
632 HG11 VAL 82 HG11 VAL 82 3.858 5.158 -3.389
633 HG12 VAL 82 HG12 VAL 82 5.562 4.883 -3.063
634 HG13 VAL 82 HG13 VAL 82 4.368 4.689 -1.757
635 HG21 VAL 82 HG21 VAL 82 2.743 7.193 -2.760
636 HG22 VAL 82 HG22 VAL 82 2.977 6.680 -1.075
637 HG23 VAL 82 HG23 VAL 82 3.451 8.309 -1.590
638 H SER 83 H SER 83 7.971 7.563 -2.343
639 HA SER 83 HA SER 83 9.250 5.030 -2.459
640 HB2 SER 83 HB2 SER 83 10.453 7.828 -2.464
641 HB3 SER 83 HB3 SER 83 11.343 6.348 -2.869
642 HG SER 83 HG SER 83 10.150 7.709 -4.590
643 H ALA 84 H ALA 84 9.367 7.468 0.180
644 HA ALA 84 HA ALA 84 11.252 5.972 1.794
645 HB1 ALA 84 HB1 ALA 84 10.476 7.445 3.599
646 HB2 ALA 84 HB2 ALA 84 10.826 8.367 2.126
647 HB3 ALA 84 HB3 ALA 84 9.143 8.024 2.578
648 H LEU 85 H LEU 85 7.686 5.869 1.450
649 HA LEU 85 HA LEU 85 7.233 3.915 3.505
650 HB2 LEU 85 HB2 LEU 85 5.667 5.533 1.966
651 HB3 LEU 85 HB3 LEU 85 5.463 4.041 1.080
652 HG LEU 85 HG LEU 85 3.649 4.394 2.605
653 HD11 LEU 85 HD11 LEU 85 3.577 2.330 3.834
654 HD12 LEU 85 HD12 LEU 85 5.346 2.197 3.817
655 HD13 LEU 85 HD13 LEU 85 4.428 2.039 2.304
656 HD21 LEU 85 HD21 LEU 85 4.841 5.822 4.256
657 HD22 LEU 85 HD22 LEU 85 5.611 4.375 4.937
658 HD23 LEU 85 HD23 LEU 85 3.847 4.563 5.005
659 H ILE 86 H ILE 86 8.160 3.570 0.087
660 HA ILE 86 HA ILE 86 8.058 0.671 -0.056
661 HB ILE 86 HB ILE 86 9.825 2.558 -1.631
662 HG12 ILE 86 HG12 ILE 86 7.668 3.203 -2.265
663 HG13 ILE 86 HG13 ILE 86 8.107 2.027 -3.462
664 HG21 ILE 86 HG21 ILE 86 9.087 -0.365 -2.080
665 HG22 ILE 86 HG22 ILE 86 9.941 0.673 -3.244
666 HG23 ILE 86 HG23 ILE 86 10.701 0.285 -1.706
667 HD11 ILE 86 HD11 ILE 86 5.829 1.649 -2.837
668 HD12 ILE 86 HD12 ILE 86 6.752 0.300 -2.150
669 HD13 ILE 86 HD13 ILE 86 6.200 1.638 -1.111
670 H SER 87 H SER 87 10.634 3.008 0.806
671 HA SER 87 HA SER 87 12.667 1.127 1.498
672 HB2 SER 87 HB2 SER 87 13.107 3.494 1.027
673 HB3 SER 87 HB3 SER 87 12.220 3.970 2.486
674 HG SER 87 HG SER 87 14.520 3.859 2.761
675 H TYR 88 H TYR 88 9.874 2.266 3.368
676 HA TYR 88 HA TYR 88 10.737 0.956 5.833
677 HB2 TYR 88 HB2 TYR 88 9.241 2.750 6.056
678 HB3 TYR 88 HB3 TYR 88 8.092 2.089 4.899
679 HD1 TYR 88 HD1 TYR 88 9.862 0.865 8.001
680 HD2 TYR 88 HD2 TYR 88 6.106 1.350 5.933
681 HE1 TYR 88 HE1 TYR 88 8.691 -0.264 9.852
682 HE2 TYR 88 HE2 TYR 88 4.939 0.167 7.796
683 HH TYR 88 HH TYR 88 6.750 -1.321 10.482
684 H LEU 89 H LEU 89 8.130 0.052 3.453
685 HA LEU 89 HA LEU 89 7.575 -2.397 4.701
686 HB2 LEU 89 HB2 LEU 89 6.896 -1.016 2.178
687 HB3 LEU 89 HB3 LEU 89 7.001 -2.752 1.970
688 HG LEU 89 HG LEU 89 5.411 -3.150 3.755
689 HD11 LEU 89 HD11 LEU 89 4.060 -1.292 4.712
690 HD12 LEU 89 HD12 LEU 89 5.195 -0.132 3.977
691 HD13 LEU 89 HD13 LEU 89 5.737 -1.254 5.245
692 HD21 LEU 89 HD21 LEU 89 3.415 -2.243 2.593
693 HD22 LEU 89 HD22 LEU 89 4.615 -2.852 1.441
694 HD23 LEU 89 HD23 LEU 89 4.456 -1.100 1.703
695 H GLU 90 H GLU 90 9.954 -1.857 2.060
696 HA GLU 90 HA GLU 90 10.716 -4.557 1.770
697 HB2 GLU 90 HB2 GLU 90 11.231 -2.559 0.290
698 HB3 GLU 90 HB3 GLU 90 12.453 -2.071 1.459
699 HG2 GLU 90 HG2 GLU 90 13.453 -3.248 -0.419
700 HG3 GLU 90 HG3 GLU 90 13.697 -4.170 1.065
701 H GLU 91 H GLU 91 11.846 -2.210 4.260
702 HA GLU 91 HA GLU 91 13.902 -4.150 5.160
703 HB2 GLU 91 HB2 GLU 91 14.820 -2.555 6.517
704 HB3 GLU 91 HB3 GLU 91 14.409 -1.710 5.030
705 HG2 GLU 91 HG2 GLU 91 12.373 -0.795 6.174
706 HG3 GLU 91 HG3 GLU 91 12.869 -1.606 7.663
707 H GLU 92 H GLU 92 10.747 -2.904 6.298
708 HA GLU 92 HA GLU 92 10.776 -4.304 8.796
709 HB2 GLU 92 HB2 GLU 92 9.210 -2.403 7.932
710 HB3 GLU 92 HB3 GLU 92 8.292 -3.702 7.177
711 HG2 GLU 92 HG2 GLU 92 7.179 -3.536 9.170
712 HG3 GLU 92 HG3 GLU 92 8.351 -4.762 9.631
713 H THR 93 H THR 93 9.785 -5.270 5.515
714 HA THR 93 HA THR 93 8.775 -7.889 6.115
715 HB THR 93 HB THR 93 10.071 -6.742 3.630
716 HG1 THR 93 HG1 THR 93 8.259 -5.776 3.938
717 HG21 THR 93 HG21 THR 93 8.903 -8.579 2.414
718 HG22 THR 93 HG22 THR 93 8.624 -9.391 3.974
719 HG23 THR 93 HG23 THR 93 10.270 -9.110 3.398
720 H ALA 94 H ALA 94 12.100 -6.735 5.784
721 HA ALA 94 HA ALA 94 13.214 -9.443 6.140
722 HB1 ALA 94 HB1 ALA 94 14.559 -6.714 5.987
723 HB2 ALA 94 HB2 ALA 94 15.364 -8.295 5.950
724 HB3 ALA 94 HB3 ALA 94 14.285 -7.827 4.624
725 H ARG 95 H ARG 95 12.033 -6.983 8.233
726 HA ARG 95 HA ARG 95 13.899 -7.439 10.425
727 HB2 ARG 95 HB2 ARG 95 12.819 -5.240 9.898
728 HB3 ARG 95 HB3 ARG 95 11.273 -5.915 10.439
729 HG2 ARG 95 HG2 ARG 95 12.269 -6.293 12.706
730 HG3 ARG 95 HG3 ARG 95 13.788 -5.569 12.132
731 HD2 ARG 95 HD2 ARG 95 12.549 -3.455 11.651
732 HD3 ARG 95 HD3 ARG 95 11.057 -4.223 12.235
733 HE ARG 95 HE ARG 95 13.197 -4.326 14.185
734 HH11 ARG 95 HH11 ARG 95 10.622 -2.227 12.899
735 HH12 ARG 95 HH12 ARG 95 10.512 -1.278 14.366
736 HH21 ARG 95 HH21 ARG 95 13.023 -3.080 16.072
737 HH22 ARG 95 HH22 ARG 95 11.866 -1.768 16.169
738 H LEU 96 H LEU 96 10.692 -8.631 9.587
739 HA LEU 96 HA LEU 96 9.721 -9.091 12.130
740 HB2 LEU 96 HB2 LEU 96 8.874 -9.577 9.425
741 HB3 LEU 96 HB3 LEU 96 8.518 -10.993 10.321
742 HG LEU 96 HG LEU 96 6.631 -9.534 10.162
743 HD11 LEU 96 HD11 LEU 96 6.909 -10.994 12.080
744 HD12 LEU 96 HD12 LEU 96 6.010 -9.520 12.512
745 HD13 LEU 96 HD13 LEU 96 7.725 -9.697 12.974
746 HD21 LEU 96 HD21 LEU 96 8.221 -7.568 11.833
747 HD22 LEU 96 HD22 LEU 96 6.571 -7.365 11.196
748 HD23 LEU 96 HD23 LEU 96 7.965 -7.445 10.086
749 H GLN 97 H GLN 97 12.097 -11.150 10.757
750 HA GLN 97 HA GLN 97 11.789 -13.405 12.486
751 HB2 GLN 97 HB2 GLN 97 14.176 -13.738 12.130
752 HB3 GLN 97 HB3 GLN 97 13.351 -13.337 10.632
753 HG2 GLN 97 HG2 GLN 97 14.173 -10.881 11.075
754 HG3 GLN 97 HG3 GLN 97 15.252 -11.619 12.257
755 HE21 GLN 97 HE21 GLN 97 14.695 -10.974 8.878
756 HE22 GLN 97 HE22 GLN 97 15.978 -11.990 8.234
757 H THR 98 H THR 98 12.417 -10.122 13.306
758 HA THR 98 HA THR 98 12.239 -10.872 16.192
759 HB THR 98 HB THR 98 14.426 -10.145 16.061
760 HG1 THR 98 HG1 THR 98 13.814 -7.871 17.067
761 HG21 THR 98 HG21 THR 98 15.195 -7.965 15.356
762 HG22 THR 98 HG22 THR 98 13.589 -7.550 14.721
763 HG23 THR 98 HG23 THR 98 14.539 -8.855 13.984
764 HA PRO 99 HA PRO 99 8.548 -8.395 15.014
765 HB2 PRO 99 HB2 PRO 99 6.750 -9.551 16.695
766 HB3 PRO 99 HB3 PRO 99 7.292 -10.361 15.199
767 HG2 PRO 99 HG2 PRO 99 8.337 -10.780 18.017
768 HG3 PRO 99 HG3 PRO 99 7.812 -12.022 16.835
769 HD2 PRO 99 HD2 PRO 99 10.425 -11.313 17.174
770 HD3 PRO 99 HD3 PRO 99 9.783 -11.787 15.571
771 H VAL 100 H VAL 100 10.625 -8.464 17.534
772 HA VAL 100 HA VAL 100 9.273 -6.897 19.574
773 HB VAL 100 HB VAL 100 12.015 -8.118 19.157
774 HG11 VAL 100 HG11 VAL 100 12.562 -7.433 21.504
775 HG12 VAL 100 HG12 VAL 100 12.468 -6.042 20.423
776 HG13 VAL 100 HG13 VAL 100 11.116 -6.409 21.529
777 HG21 VAL 100 HG21 VAL 100 9.793 -8.578 21.197
778 HG22 VAL 100 HG22 VAL 100 10.193 -9.627 19.818
779 HG23 VAL 100 HG23 VAL 100 11.348 -9.429 21.139
780 H THR 101 H THR 101 9.554 -4.835 20.083
781 HA THR 101 HA THR 101 10.327 -3.064 17.821
782 HB THR 101 HB THR 101 8.634 -1.539 18.687
783 HG1 THR 101 HG1 THR 101 8.323 -3.480 20.732
784 HG21 THR 101 HG21 THR 101 7.866 -3.352 17.184
785 HG22 THR 101 HG22 THR 101 6.618 -2.825 18.324
786 HG23 THR 101 HG23 THR 101 7.474 -4.355 18.598
787 H ASN 102 H ASN 102 10.922 -0.867 18.227
788 HA ASN 102 HA ASN 102 12.447 -0.335 20.748
789 HB2 ASN 102 HB2 ASN 102 13.985 -0.155 18.954
790 HB3 ASN 102 HB3 ASN 102 12.805 0.613 17.890
791 HD21 ASN 102 HD21 ASN 102 14.882 1.251 20.779
792 HD22 ASN 102 HD22 ASN 102 14.823 2.992 20.531
793 H ARG 103 H ARG 103 12.018 1.498 21.898
794 HA ARG 103 HA ARG 103 11.022 3.287 22.762
795 HB2 ARG 103 HB2 ARG 103 11.833 4.356 20.766
796 HB3 ARG 103 HB3 ARG 103 10.335 4.007 19.901
797 HG2 ARG 103 HG2 ARG 103 9.078 5.491 21.362
798 HG3 ARG 103 HG3 ARG 103 10.511 5.745 22.395
799 HD2 ARG 103 HD2 ARG 103 11.708 6.783 20.529
800 HD3 ARG 103 HD3 ARG 103 10.346 6.464 19.436
801 HE ARG 103 HE ARG 103 9.114 7.898 21.338
802 HH11 ARG 103 HH11 ARG 103 12.190 8.580 19.660
803 HH12 ARG 103 HH12 ARG 103 11.989 10.314 19.789
804 HH21 ARG 103 HH21 ARG 103 8.890 10.133 21.464
805 HH22 ARG 103 HH22 ARG 103 10.117 11.193 20.803
806 H GLY 104 H GLY 104 8.529 2.820 20.278
807 HA2 GLY 104 HA2 GLY 104 6.421 2.015 20.284
808 HA3 GLY 104 HA3 GLY 104 6.861 1.121 21.735
809 H ILE 105 H ILE 105 7.169 3.571 23.379
810 HA ILE 105 HA ILE 105 4.304 4.289 23.783
811 HB ILE 105 HB ILE 105 6.424 3.445 25.750
812 HG12 ILE 105 HG12 ILE 105 3.588 2.462 25.319
813 HG13 ILE 105 HG13 ILE 105 5.020 1.732 24.593
814 HG21 ILE 105 HG21 ILE 105 4.868 4.002 27.593
815 HG22 ILE 105 HG22 ILE 105 5.437 5.428 26.761
816 HG23 ILE 105 HG23 ILE 105 3.793 4.811 26.436
817 HD11 ILE 105 HD11 ILE 105 4.494 0.416 26.474
818 HD12 ILE 105 HD12 ILE 105 5.926 1.352 26.930
819 HD13 ILE 105 HD13 ILE 105 4.320 1.818 27.540
820 HA PRO 106 HA PRO 106 6.615 8.354 24.734
821 HB2 PRO 106 HB2 PRO 106 9.335 7.964 23.561
822 HB3 PRO 106 HB3 PRO 106 8.868 8.746 25.099
823 HG2 PRO 106 HG2 PRO 106 10.021 6.275 25.063
824 HG3 PRO 106 HG3 PRO 106 8.683 6.649 26.200
825 HD2 PRO 106 HD2 PRO 106 8.504 5.256 23.510
826 HD3 PRO 106 HD3 PRO 106 7.822 4.766 25.071
827 HHA HEC 107 HHA HEC 107 -4.519 -3.793 1.574
828 HHB HEC 107 HHB HEC 107 -0.170 0.925 1.070
829 HHC HEC 107 HHC HEC 107 -4.113 4.939 4.227
830 HHD HEC 107 HHD HEC 107 -8.568 0.247 4.525
831 HMA1 HEC 107 HMA1 HEC 107 0.411 -2.755 0.079
832 HMA2 HEC 107 HMA2 HEC 107 0.039 -1.344 -0.928
833 HMA3 HEC 107 HMA3 HEC 107 0.851 -1.144 0.647
834 HAA1 HEC 107 HAA1 HEC 107 -3.224 -4.112 -0.300
835 HAA2 HEC 107 HAA2 HEC 107 -1.631 -3.729 -0.895
836 HBA1 HEC 107 HBA1 HEC 107 -0.607 -4.873 1.062
837 HBA2 HEC 107 HBA2 HEC 107 -2.219 -5.252 1.674
838 HMB1 HEC 107 HMB1 HEC 107 0.353 3.131 0.595
839 HMB2 HEC 107 HMB2 HEC 107 0.158 4.728 1.284
840 HMB3 HEC 107 HMB3 HEC 107 1.049 3.489 2.201
841 HAB HEC 107 HAB HEC 107 -2.051 5.131 4.852
842 HBB1 HEC 107 HBB1 HEC 107 -0.385 6.779 4.592
843 HBB2 HEC 107 HBB2 HEC 107 0.379 5.921 3.242
844 HBB3 HEC 107 HBB3 HEC 107 -1.239 6.644 3.048
845 HMC1 HEC 107 HMC1 HEC 107 -5.838 5.779 5.190
846 HMC2 HEC 107 HMC2 HEC 107 -7.556 5.637 4.847
847 HMC3 HEC 107 HMC3 HEC 107 -6.909 5.128 6.423
848 HAC HEC 107 HAC HEC 107 -9.212 1.785 5.700
849 HBC1 HEC 107 HBC1 HEC 107 -9.871 4.002 4.773
850 HBC2 HEC 107 HBC2 HEC 107 -10.540 3.569 6.359
851 HBC3 HEC 107 HBC3 HEC 107 -9.223 4.732 6.263
852 HMD1 HEC 107 HMD1 HEC 107 -9.135 -3.439 4.197
853 HMD2 HEC 107 HMD2 HEC 107 -9.382 -1.789 4.743
854 HMD3 HEC 107 HMD3 HEC 107 -9.741 -2.216 3.055
855 HAD1 HEC 107 HAD1 HEC 107 -6.422 -4.870 1.978
856 HAD2 HEC 107 HAD2 HEC 107 -8.071 -4.643 2.522
857 HBD1 HEC 107 HBD1 HEC 107 -7.929 -4.732 0.054
858 HBD2 HEC 107 HBD2 HEC 107 -8.578 -3.189 0.624
Start of MODEL 17
1 H SER 1 H SER 1 13.520 3.889 6.958
2 HA SER 1 HA SER 1 12.765 6.227 8.480
3 HB2 SER 1 HB2 SER 1 14.382 6.297 6.647
4 HB3 SER 1 HB3 SER 1 13.162 5.709 5.505
5 HG SER 1 HG SER 1 13.365 7.911 5.317
6 H GLY 2 H GLY 2 11.131 4.353 5.908
7 HA2 GLY 2 HA2 GLY 2 8.686 5.827 5.849
8 HA3 GLY 2 HA3 GLY 2 8.921 4.183 5.296
9 H GLU 3 H GLU 3 9.824 3.738 8.416
10 HA GLU 3 HA GLU 3 7.239 2.620 9.101
11 HB2 GLU 3 HB2 GLU 3 9.364 1.567 9.799
12 HB3 GLU 3 HB3 GLU 3 9.672 2.932 10.899
13 HG2 GLU 3 HG2 GLU 3 7.659 2.450 12.167
14 HG3 GLU 3 HG3 GLU 3 7.143 1.255 10.981
15 H GLN 4 H GLN 4 9.009 5.555 10.211
16 HA GLN 4 HA GLN 4 7.022 6.438 12.055
17 HB2 GLN 4 HB2 GLN 4 9.355 7.374 11.733
18 HB3 GLN 4 HB3 GLN 4 8.780 8.148 10.249
19 HG2 GLN 4 HG2 GLN 4 7.040 9.361 11.682
20 HG3 GLN 4 HG3 GLN 4 7.813 8.654 13.102
21 HE21 GLN 4 HE21 GLN 4 7.851 11.207 13.445
22 HE22 GLN 4 HE22 GLN 4 9.355 11.964 12.864
23 H ILE 5 H ILE 5 7.220 6.768 8.497
24 HA ILE 5 HA ILE 5 4.939 8.554 8.283
25 HB ILE 5 HB ILE 5 6.157 6.787 6.128
26 HG12 ILE 5 HG12 ILE 5 6.853 9.614 7.053
27 HG13 ILE 5 HG13 ILE 5 7.900 8.192 7.094
28 HG21 ILE 5 HG21 ILE 5 4.478 9.331 5.911
29 HG22 ILE 5 HG22 ILE 5 5.112 8.360 4.561
30 HG23 ILE 5 HG23 ILE 5 3.872 7.690 5.605
31 HD11 ILE 5 HD11 ILE 5 6.998 9.733 4.662
32 HD12 ILE 5 HD12 ILE 5 8.642 9.482 5.268
33 HD13 ILE 5 HD13 ILE 5 7.741 8.115 4.564
34 H PHE 6 H PHE 6 5.315 4.975 7.941
35 HA PHE 6 HA PHE 6 2.533 4.475 7.480
36 HB2 PHE 6 HB2 PHE 6 4.257 2.774 7.082
37 HB3 PHE 6 HB3 PHE 6 4.650 2.737 8.799
38 HD1 PHE 6 HD1 PHE 6 1.842 2.159 6.374
39 HD2 PHE 6 HD2 PHE 6 3.430 1.310 10.294
40 HE1 PHE 6 HE1 PHE 6 -0.056 0.616 6.813
41 HE2 PHE 6 HE2 PHE 6 1.542 -0.232 10.724
42 HZ PHE 6 HZ PHE 6 -0.225 -0.556 8.992
43 H ARG 7 H ARG 7 4.388 4.721 10.546
44 HA ARG 7 HA ARG 7 2.227 4.067 12.275
45 HB2 ARG 7 HB2 ARG 7 4.751 4.046 12.690
46 HB3 ARG 7 HB3 ARG 7 4.616 5.777 12.987
47 HG2 ARG 7 HG2 ARG 7 4.615 4.570 15.074
48 HG3 ARG 7 HG3 ARG 7 3.001 5.258 14.862
49 HD2 ARG 7 HD2 ARG 7 2.088 3.103 14.227
50 HD3 ARG 7 HD3 ARG 7 3.709 2.402 14.059
51 HE ARG 7 HE ARG 7 3.394 3.337 16.718
52 HH11 ARG 7 HH11 ARG 7 2.170 0.732 14.608
53 HH12 ARG 7 HH12 ARG 7 1.955 -0.385 15.936
54 HH21 ARG 7 HH21 ARG 7 3.101 1.846 18.410
55 HH22 ARG 7 HH22 ARG 7 2.461 0.251 18.085
56 H THR 8 H THR 8 3.224 7.170 10.895
57 HA THR 8 HA THR 8 1.269 8.639 12.547
58 HB THR 8 HB THR 8 2.181 10.673 11.473
59 HG1 THR 8 HG1 THR 8 4.196 8.969 10.502
60 HG21 THR 8 HG21 THR 8 4.363 10.641 12.587
61 HG22 THR 8 HG22 THR 8 4.268 8.875 12.760
62 HG23 THR 8 HG23 THR 8 3.114 9.910 13.607
63 H ARG 9 H ARG 9 1.562 7.856 9.056
64 HA ARG 9 HA ARG 9 -1.001 9.343 8.614
65 HB2 ARG 9 HB2 ARG 9 1.148 8.465 6.655
66 HB3 ARG 9 HB3 ARG 9 -0.359 9.282 6.230
67 HG2 ARG 9 HG2 ARG 9 0.302 11.193 7.741
68 HG3 ARG 9 HG3 ARG 9 1.891 10.419 7.934
69 HD2 ARG 9 HD2 ARG 9 2.213 10.482 5.475
70 HD3 ARG 9 HD3 ARG 9 0.636 11.248 5.274
71 HE ARG 9 HE ARG 9 3.123 12.462 6.232
72 HH11 ARG 9 HH11 ARG 9 -0.411 12.925 5.990
73 HH12 ARG 9 HH12 ARG 9 -0.285 14.664 6.098
74 HH21 ARG 9 HH21 ARG 9 3.232 14.701 6.364
75 HH22 ARG 9 HH22 ARG 9 1.777 15.670 6.326
76 H CYS 10 H CYS 10 0.103 6.030 8.672
77 HA CYS 10 HA CYS 10 -2.301 5.192 7.090
78 HB2 CYS 10 HB2 CYS 10 0.508 4.152 6.729
79 HB3 CYS 10 HB3 CYS 10 -0.909 3.621 5.838
80 H SER 11 H SER 11 -1.311 4.842 10.135
81 HA SER 11 HA SER 11 -1.367 1.878 10.257
82 HB2 SER 11 HB2 SER 11 -0.796 4.100 12.207
83 HB3 SER 11 HB3 SER 11 -1.125 2.452 12.778
84 HG SER 11 HG SER 11 0.776 3.215 10.815
85 H SER 12 H SER 12 -3.665 4.483 10.797
86 HA SER 12 HA SER 12 -5.274 3.123 12.671
87 HB2 SER 12 HB2 SER 12 -6.139 5.343 10.810
88 HB3 SER 12 HB3 SER 12 -6.843 4.916 12.380
89 HG SER 12 HG SER 12 -5.253 6.699 12.271
90 H CYS 13 H CYS 13 -4.922 2.027 9.614
91 HA CYS 13 HA CYS 13 -7.390 0.410 9.866
92 HB2 CYS 13 HB2 CYS 13 -6.467 1.551 7.217
93 HB3 CYS 13 HB3 CYS 13 -7.886 0.563 7.494
94 H HIS 14 H HIS 14 -4.102 0.023 9.837
95 HA HIS 14 HA HIS 14 -4.320 -2.731 8.932
96 HB2 HIS 14 2HB HIS 14 -1.980 -1.714 7.536
97 HB3 HIS 14 3HB HIS 14 -3.282 -2.730 6.962
98 HD1 HIS 14 1HD HIS 14 -2.791 1.064 7.615
99 HD2 HIS 14 2HD HIS 14 -4.277 -1.695 4.834
100 HE1 HIS 14 1HE HIS 14 -3.547 2.441 5.699
101 H THR 15 H THR 15 -2.102 -3.882 9.070
102 HA THR 15 HA THR 15 -0.009 -2.398 10.587
103 HB THR 15 HB THR 15 0.610 -4.577 11.790
104 HG1 THR 15 HG1 THR 15 -0.718 -6.110 11.101
105 HG21 THR 15 HG21 THR 15 -0.183 -2.638 13.025
106 HG22 THR 15 HG22 THR 15 -0.883 -4.114 13.688
107 HG23 THR 15 HG23 THR 15 -1.881 -3.068 12.666
108 H VAL 16 H VAL 16 1.964 -2.557 9.625
109 HA VAL 16 HA VAL 16 2.569 -5.015 8.014
110 HB VAL 16 HB VAL 16 3.030 -3.473 6.457
111 HG11 VAL 16 HG11 VAL 16 3.883 -1.467 8.531
112 HG12 VAL 16 HG12 VAL 16 4.000 -1.244 6.767
113 HG13 VAL 16 HG13 VAL 16 2.415 -1.475 7.501
114 HG21 VAL 16 HG21 VAL 16 5.105 -4.730 6.915
115 HG22 VAL 16 HG22 VAL 16 5.368 -3.151 6.182
116 HG23 VAL 16 HG23 VAL 16 5.684 -3.364 7.910
117 H GLY 17 H GLY 17 3.254 -6.432 9.228
118 HA2 GLY 17 HA2 GLY 17 4.717 -7.687 10.483
119 HA3 GLY 17 HA3 GLY 17 5.753 -6.276 10.708
120 H ASN 18 H ASN 18 3.892 -4.586 11.911
121 HA ASN 18 HA ASN 18 4.249 -5.379 14.633
122 HB2 ASN 18 HB2 ASN 18 4.336 -3.027 13.116
123 HB3 ASN 18 HB3 ASN 18 2.914 -2.781 14.113
124 HD21 ASN 18 HD21 ASN 18 3.253 -2.386 16.356
125 HD22 ASN 18 HD22 ASN 18 4.902 -2.288 16.993
126 H THR 19 H THR 19 2.554 -7.180 13.890
127 HA THR 19 HA THR 19 -0.215 -6.697 13.973
128 HB THR 19 HB THR 19 0.826 -8.617 12.956
129 HG1 THR 19 HG1 THR 19 -1.119 -9.177 13.119
130 HG21 THR 19 HG21 THR 19 2.408 -9.119 14.831
131 HG22 THR 19 HG22 THR 19 1.523 -10.518 14.198
132 HG23 THR 19 HG23 THR 19 1.032 -9.771 15.742
133 H GLU 20 H GLU 20 -1.750 -6.573 15.480
134 HA GLU 20 HA GLU 20 -1.372 -7.443 18.259
135 HB2 GLU 20 HB2 GLU 20 -1.896 -4.532 17.502
136 HB3 GLU 20 HB3 GLU 20 -2.229 -5.199 19.093
137 HG2 GLU 20 HG2 GLU 20 0.216 -5.795 19.298
138 HG3 GLU 20 HG3 GLU 20 0.496 -4.892 17.798
139 HA PRO 21 HA PRO 21 -5.840 -7.892 17.581
140 HB2 PRO 21 HB2 PRO 21 -6.794 -8.360 20.073
141 HB3 PRO 21 HB3 PRO 21 -5.655 -9.486 19.277
142 HG2 PRO 21 HG2 PRO 21 -4.996 -7.276 21.259
143 HG3 PRO 21 HG3 PRO 21 -4.509 -9.000 21.326
144 HD2 PRO 21 HD2 PRO 21 -2.882 -7.055 20.291
145 HD3 PRO 21 HD3 PRO 21 -2.910 -8.716 19.630
146 H GLY 22 H GLY 22 -4.548 -5.058 18.584
147 HA2 GLY 22 HA2 GLY 22 -6.564 -3.904 20.240
148 HA3 GLY 22 HA3 GLY 22 -5.172 -3.095 19.543
149 H GLN 23 H GLN 23 -6.679 -4.083 16.781
150 HA GLN 23 HA GLN 23 -8.248 -1.541 16.643
151 HB2 GLN 23 HB2 GLN 23 -5.859 -1.560 15.760
152 HB3 GLN 23 HB3 GLN 23 -6.487 -2.514 14.408
153 HG2 GLN 23 HG2 GLN 23 -8.047 -0.699 13.839
154 HG3 GLN 23 HG3 GLN 23 -7.574 0.197 15.289
155 HE21 GLN 23 HE21 GLN 23 -6.504 -0.775 12.060
156 HE22 GLN 23 HE22 GLN 23 -5.041 0.257 12.081
157 HA PRO 24 HA PRO 24 -11.045 -4.809 15.090
158 HB2 PRO 24 HB2 PRO 24 -13.402 -3.851 16.052
159 HB3 PRO 24 HB3 PRO 24 -12.186 -4.640 17.110
160 HG2 PRO 24 HG2 PRO 24 -12.568 -1.662 16.634
161 HG3 PRO 24 HG3 PRO 24 -12.476 -2.520 18.202
162 HD2 PRO 24 HD2 PRO 24 -10.310 -1.325 17.089
163 HD3 PRO 24 HD3 PRO 24 -10.158 -2.866 17.993
164 H GLY 25 H GLY 25 -12.614 -4.851 13.423
165 HA2 GLY 25 HA2 GLY 25 -13.854 -4.143 11.621
166 HA3 GLY 25 HA3 GLY 25 -13.767 -2.495 12.237
167 H ILE 26 H ILE 26 -10.794 -2.364 12.065
168 HA ILE 26 HA ILE 26 -10.015 -3.211 9.406
169 HB ILE 26 HB ILE 26 -9.072 -0.636 9.168
170 HG12 ILE 26 HG12 ILE 26 -11.027 0.809 8.991
171 HG13 ILE 26 HG13 ILE 26 -12.023 -0.360 9.844
172 HG21 ILE 26 HG21 ILE 26 -10.393 -0.558 7.181
173 HG22 ILE 26 HG22 ILE 26 -9.713 -2.173 7.406
174 HG23 ILE 26 HG23 ILE 26 -11.431 -1.879 7.764
175 HD11 ILE 26 HD11 ILE 26 -10.595 -0.053 11.879
176 HD12 ILE 26 HD12 ILE 26 -9.574 1.069 10.963
177 HD13 ILE 26 HD13 ILE 26 -11.262 1.487 11.309
178 H GLY 27 H GLY 27 -8.386 -4.317 9.997
179 HA2 GLY 27 HA2 GLY 27 -5.879 -3.062 10.687
180 HA3 GLY 27 HA3 GLY 27 -6.509 -4.010 12.033
181 HA PRO 28 HA PRO 28 -5.651 -7.528 8.855
182 HB2 PRO 28 HB2 PRO 28 -5.205 -7.022 6.217
183 HB3 PRO 28 HB3 PRO 28 -6.855 -7.190 6.892
184 HG2 PRO 28 HG2 PRO 28 -5.315 -4.612 6.413
185 HG3 PRO 28 HG3 PRO 28 -6.977 -5.027 5.867
186 HD2 PRO 28 HD2 PRO 28 -6.576 -3.628 8.136
187 HD3 PRO 28 HD3 PRO 28 -7.834 -4.893 8.069
188 H ASP 29 H ASP 29 -3.662 -8.447 8.348
189 HA ASP 29 HA ASP 29 -1.313 -6.744 8.735
190 HB2 ASP 29 HB2 ASP 29 -1.885 -9.673 8.944
191 HB3 ASP 29 HB3 ASP 29 -0.252 -9.203 8.511
192 H LEU 30 H LEU 30 0.473 -6.665 7.430
193 HA LEU 30 HA LEU 30 -0.144 -6.814 4.487
194 HB2 LEU 30 HB2 LEU 30 1.426 -4.830 6.131
195 HB3 LEU 30 HB3 LEU 30 1.214 -4.728 4.400
196 HG LEU 30 HG LEU 30 -0.869 -4.338 6.577
197 HD11 LEU 30 HD11 LEU 30 0.286 -2.552 4.390
198 HD12 LEU 30 HD12 LEU 30 0.601 -2.439 6.134
199 HD13 LEU 30 HD13 LEU 30 -1.014 -2.082 5.498
200 HD21 LEU 30 HD21 LEU 30 -2.474 -3.796 4.730
201 HD22 LEU 30 HD22 LEU 30 -2.032 -5.501 4.765
202 HD23 LEU 30 HD23 LEU 30 -1.286 -4.435 3.560
203 H LEU 31 H LEU 31 2.346 -7.655 6.859
204 HA LEU 31 HA LEU 31 4.552 -6.871 5.441
205 HB2 LEU 31 HB2 LEU 31 4.493 -7.408 7.747
206 HB3 LEU 31 HB3 LEU 31 4.509 -9.133 7.406
207 HG LEU 31 HG LEU 31 6.652 -7.421 6.147
208 HD11 LEU 31 HD11 LEU 31 6.701 -8.111 9.089
209 HD12 LEU 31 HD12 LEU 31 6.564 -6.484 8.354
210 HD13 LEU 31 HD13 LEU 31 8.046 -7.435 8.128
211 HD21 LEU 31 HD21 LEU 31 6.573 -9.905 5.836
212 HD22 LEU 31 HD22 LEU 31 6.836 -10.091 7.583
213 HD23 LEU 31 HD23 LEU 31 8.068 -9.302 6.552
214 H GLY 32 H GLY 32 5.966 -7.532 4.025
215 HA2 GLY 32 HA2 GLY 32 7.026 -8.814 2.413
216 HA3 GLY 32 HA3 GLY 32 5.910 -10.147 2.625
217 H VAL 33 H VAL 33 4.489 -6.983 2.246
218 HA VAL 33 HA VAL 33 2.851 -7.822 0.139
219 HB VAL 33 HB VAL 33 2.164 -6.093 1.612
220 HG11 VAL 33 HG11 VAL 33 4.233 -4.239 0.378
221 HG12 VAL 33 HG12 VAL 33 2.962 -3.795 1.539
222 HG13 VAL 33 HG13 VAL 33 4.250 -4.885 2.036
223 HG21 VAL 33 HG21 VAL 33 1.130 -6.174 -0.599
224 HG22 VAL 33 HG22 VAL 33 1.122 -4.554 0.105
225 HG23 VAL 33 HG23 VAL 33 2.279 -4.952 -1.185
226 H THR 34 H THR 34 5.945 -6.042 -0.225
227 HA THR 34 HA THR 34 5.682 -5.515 -3.025
228 HB THR 34 HB THR 34 7.456 -4.484 -1.639
229 HG1 THR 34 HG1 THR 34 8.857 -4.505 -3.287
230 HG21 THR 34 HG21 THR 34 8.895 -7.175 -1.785
231 HG22 THR 34 HG22 THR 34 8.125 -6.517 -0.321
232 HG23 THR 34 HG23 THR 34 9.467 -5.664 -1.071
233 H ARG 35 H ARG 35 6.542 -8.523 -1.368
234 HA ARG 35 HA ARG 35 7.281 -9.896 -3.878
235 HB2 ARG 35 HB2 ARG 35 6.856 -11.015 -1.081
236 HB3 ARG 35 HB3 ARG 35 7.509 -11.889 -2.462
237 HG2 ARG 35 HG2 ARG 35 8.797 -9.497 -1.091
238 HG3 ARG 35 HG3 ARG 35 9.272 -11.189 -0.922
239 HD2 ARG 35 HD2 ARG 35 9.784 -11.247 -3.381
240 HD3 ARG 35 HD3 ARG 35 9.449 -9.512 -3.464
241 HE ARG 35 HE ARG 35 11.661 -10.842 -1.959
242 HH11 ARG 35 HH11 ARG 35 10.376 -7.824 -3.389
243 HH12 ARG 35 HH12 ARG 35 11.863 -6.951 -3.096
244 HH21 ARG 35 HH21 ARG 35 13.537 -9.662 -1.604
245 HH22 ARG 35 HH22 ARG 35 13.639 -7.982 -2.081
246 H GLN 36 H GLN 36 4.544 -9.808 -1.600
247 HA GLN 36 HA GLN 36 3.075 -11.879 -2.990
248 HB2 GLN 36 HB2 GLN 36 2.298 -9.942 -0.775
249 HB3 GLN 36 HB3 GLN 36 1.222 -11.172 -1.432
250 HG2 GLN 36 HG2 GLN 36 3.156 -12.860 -0.932
251 HG3 GLN 36 HG3 GLN 36 3.802 -11.587 0.109
252 HE21 GLN 36 HE21 GLN 36 0.865 -13.564 -0.530
253 HE22 GLN 36 HE22 GLN 36 0.313 -13.532 1.150
254 H ARG 37 H ARG 37 3.148 -8.408 -3.542
255 HA ARG 37 HA ARG 37 0.858 -8.737 -5.429
256 HB2 ARG 37 HB2 ARG 37 0.987 -7.205 -3.076
257 HB3 ARG 37 HB3 ARG 37 1.266 -6.029 -4.342
258 HG2 ARG 37 HG2 ARG 37 -1.092 -6.123 -3.890
259 HG3 ARG 37 HG3 ARG 37 -0.827 -6.817 -5.493
260 HD2 ARG 37 HD2 ARG 37 -2.479 -8.116 -4.272
261 HD3 ARG 37 HD3 ARG 37 -1.034 -9.104 -4.500
262 HE ARG 37 HE ARG 37 -1.088 -7.626 -1.986
263 HH11 ARG 37 HH11 ARG 37 -2.090 -10.685 -3.527
264 HH12 ARG 37 HH12 ARG 37 -2.201 -11.529 -1.999
265 HH21 ARG 37 HH21 ARG 37 -1.266 -8.750 -0.043
266 HH22 ARG 37 HH22 ARG 37 -1.742 -10.433 -0.028
267 H ASP 38 H ASP 38 4.037 -8.283 -5.656
268 HA ASP 38 HA ASP 38 5.480 -7.630 -7.248
269 HB2 ASP 38 HB2 ASP 38 3.943 -8.035 -9.082
270 HB3 ASP 38 HB3 ASP 38 3.209 -6.456 -8.866
271 H ALA 39 H ALA 39 6.953 -6.107 -7.318
272 HA ALA 39 HA ALA 39 6.746 -3.894 -5.548
273 HB1 ALA 39 HB1 ALA 39 8.836 -4.524 -7.686
274 HB2 ALA 39 HB2 ALA 39 9.053 -3.462 -6.282
275 HB3 ALA 39 HB3 ALA 39 8.815 -5.197 -6.044
276 H ASN 40 H ASN 40 6.425 -4.011 -9.139
277 HA ASN 40 HA ASN 40 6.583 -1.063 -9.313
278 HB2 ASN 40 HB2 ASN 40 7.566 -2.709 -10.999
279 HB3 ASN 40 HB3 ASN 40 5.918 -3.077 -11.498
280 HD21 ASN 40 HD21 ASN 40 4.615 -1.219 -12.463
281 HD22 ASN 40 HD22 ASN 40 5.519 0.122 -13.139
282 H TRP 41 H TRP 41 4.112 -3.621 -9.485
283 HA TRP 41 HA TRP 41 1.837 -1.930 -9.924
284 HB2 TRP 41 HB2 TRP 41 1.911 -4.455 -10.126
285 HB3 TRP 41 HB3 TRP 41 1.991 -4.533 -8.378
286 HD1 TRP 41 HD1 TRP 41 -0.459 -3.846 -11.211
287 HE1 TRP 41 HE1 TRP 41 -2.873 -3.791 -10.304
288 HE3 TRP 41 HE3 TRP 41 0.570 -4.020 -6.199
289 HZ2 TRP 41 HZ2 TRP 41 -4.150 -3.801 -7.734
290 HZ3 TRP 41 HZ3 TRP 41 -1.277 -3.889 -4.534
291 HH2 TRP 41 HH2 TRP 41 -3.639 -3.800 -5.289
292 H LEU 42 H LEU 42 3.375 -3.044 -6.843
293 HA LEU 42 HA LEU 42 1.551 -1.994 -5.055
294 HB2 LEU 42 HB2 LEU 42 3.343 -3.488 -4.452
295 HB3 LEU 42 HB3 LEU 42 4.570 -2.292 -4.873
296 HG LEU 42 HG LEU 42 3.929 -0.900 -2.952
297 HD11 LEU 42 HD11 LEU 42 1.847 -3.068 -2.439
298 HD12 LEU 42 HD12 LEU 42 1.548 -1.343 -2.726
299 HD13 LEU 42 HD13 LEU 42 2.353 -1.857 -1.237
300 HD21 LEU 42 HD21 LEU 42 4.291 -3.828 -2.206
301 HD22 LEU 42 HD22 LEU 42 4.715 -2.422 -1.205
302 HD23 LEU 42 HD23 LEU 42 5.595 -2.722 -2.707
303 H VAL 43 H VAL 43 4.302 -0.145 -6.444
304 HA VAL 43 HA VAL 43 3.744 2.347 -5.040
305 HB VAL 43 HB VAL 43 5.102 1.982 -7.732
306 HG11 VAL 43 HG11 VAL 43 6.251 4.099 -7.076
307 HG12 VAL 43 HG12 VAL 43 4.509 4.338 -7.208
308 HG13 VAL 43 HG13 VAL 43 5.265 4.178 -5.606
309 HG21 VAL 43 HG21 VAL 43 6.198 1.798 -4.918
310 HG22 VAL 43 HG22 VAL 43 6.297 0.585 -6.190
311 HG23 VAL 43 HG23 VAL 43 7.225 2.076 -6.345
312 H ARG 44 H ARG 44 2.829 1.107 -8.261
313 HA ARG 44 HA ARG 44 1.411 3.376 -9.185
314 HB2 ARG 44 HB2 ARG 44 2.370 1.425 -10.466
315 HB3 ARG 44 HB3 ARG 44 0.990 0.456 -9.941
316 HG2 ARG 44 HG2 ARG 44 -0.542 2.025 -11.127
317 HG3 ARG 44 HG3 ARG 44 0.863 3.009 -11.608
318 HD2 ARG 44 HD2 ARG 44 1.823 0.991 -12.750
319 HD3 ARG 44 HD3 ARG 44 0.352 0.089 -12.343
320 HE ARG 44 HE ARG 44 -0.477 2.411 -13.676
321 HH11 ARG 44 HH11 ARG 44 1.487 -0.463 -14.455
322 HH12 ARG 44 HH12 ARG 44 1.113 -0.389 -16.162
323 HH21 ARG 44 HH21 ARG 44 -0.942 2.462 -15.906
324 HH22 ARG 44 HH22 ARG 44 -0.262 1.259 -16.979
325 H TRP 45 H TRP 45 0.341 0.595 -7.313
326 HA TRP 45 HA TRP 45 -2.456 1.303 -7.085
327 HB2 TRP 45 HB2 TRP 45 -1.804 -0.970 -6.738
328 HB3 TRP 45 HB3 TRP 45 -0.567 -0.528 -5.583
329 HD1 TRP 45 HD1 TRP 45 -1.160 -1.188 -3.271
330 HE1 TRP 45 HE1 TRP 45 -3.285 -1.488 -1.852
331 HE3 TRP 45 HE3 TRP 45 -4.641 0.354 -6.673
332 HZ2 TRP 45 HZ2 TRP 45 -6.144 -1.234 -2.212
333 HZ3 TRP 45 HZ3 TRP 45 -7.054 0.236 -6.160
334 HH2 TRP 45 HH2 TRP 45 -7.824 -0.556 -3.923
335 H LEU 46 H LEU 46 0.188 1.484 -4.584
336 HA LEU 46 HA LEU 46 -1.651 2.799 -2.872
337 HB2 LEU 46 HB2 LEU 46 -0.325 2.180 -1.271
338 HB3 LEU 46 HB3 LEU 46 0.626 1.345 -2.484
339 HG LEU 46 HG LEU 46 1.238 4.118 -1.362
340 HD11 LEU 46 HD11 LEU 46 1.512 2.283 0.291
341 HD12 LEU 46 HD12 LEU 46 3.068 2.978 -0.185
342 HD13 LEU 46 HD13 LEU 46 2.555 1.413 -0.849
343 HD21 LEU 46 HD21 LEU 46 2.989 2.267 -3.025
344 HD22 LEU 46 HD22 LEU 46 3.411 3.886 -2.421
345 HD23 LEU 46 HD23 LEU 46 2.189 3.705 -3.681
346 H LYS 47 H LYS 47 0.435 4.228 -5.195
347 HA LYS 47 HA LYS 47 0.478 6.926 -4.154
348 HB2 LYS 47 HB2 LYS 47 1.998 5.959 -5.897
349 HB3 LYS 47 HB3 LYS 47 0.646 5.891 -7.024
350 HG2 LYS 47 HG2 LYS 47 0.476 8.334 -7.040
351 HG3 LYS 47 HG3 LYS 47 1.685 8.462 -5.743
352 HD2 LYS 47 HD2 LYS 47 3.394 7.447 -7.209
353 HD3 LYS 47 HD3 LYS 47 2.205 7.272 -8.510
354 HE2 LYS 47 HE2 LYS 47 1.922 9.738 -8.589
355 HE3 LYS 47 HE3 LYS 47 3.079 9.913 -7.261
356 HZ1 LYS 47 HZ1 LYS 47 4.745 8.833 -8.728
357 HZ2 LYS 47 HZ2 LYS 47 4.240 10.273 -9.324
358 HZ3 LYS 47 HZ3 LYS 47 3.705 8.860 -9.974
359 H VAL 48 H VAL 48 -1.892 5.116 -6.114
360 HA VAL 48 HA VAL 48 -3.903 7.219 -5.856
361 HB VAL 48 HB VAL 48 -2.384 8.147 -7.498
362 HG11 VAL 48 HG11 VAL 48 -2.234 7.342 -9.780
363 HG12 VAL 48 HG12 VAL 48 -1.495 6.221 -8.634
364 HG13 VAL 48 HG13 VAL 48 -3.064 5.845 -9.349
365 HG21 VAL 48 HG21 VAL 48 -4.075 8.807 -9.132
366 HG22 VAL 48 HG22 VAL 48 -5.174 7.582 -8.470
367 HG23 VAL 48 HG23 VAL 48 -4.611 8.909 -7.448
368 HA PRO 49 HA PRO 49 -5.710 2.861 -6.474
369 HB2 PRO 49 HB2 PRO 49 -7.473 3.049 -4.337
370 HB3 PRO 49 HB3 PRO 49 -5.809 2.404 -4.205
371 HG2 PRO 49 HG2 PRO 49 -6.719 5.251 -3.643
372 HG3 PRO 49 HG3 PRO 49 -5.768 4.159 -2.577
373 HD2 PRO 49 HD2 PRO 49 -4.440 5.904 -4.087
374 HD3 PRO 49 HD3 PRO 49 -3.892 4.230 -4.032
375 H ASP 50 H ASP 50 -7.038 6.083 -5.805
376 HA ASP 50 HA ASP 50 -9.650 5.887 -6.844
377 HB2 ASP 50 HB2 ASP 50 -7.631 8.176 -6.900
378 HB3 ASP 50 HB3 ASP 50 -9.343 8.359 -7.259
379 H GLN 51 H GLN 51 -6.616 5.953 -8.612
380 HA GLN 51 HA GLN 51 -7.933 6.376 -11.249
381 HB2 GLN 51 HB2 GLN 51 -5.889 7.652 -10.666
382 HB3 GLN 51 HB3 GLN 51 -5.016 6.125 -10.437
383 HG2 GLN 51 HG2 GLN 51 -5.398 5.581 -12.833
384 HG3 GLN 51 HG3 GLN 51 -6.219 7.132 -13.028
385 HE21 GLN 51 HE21 GLN 51 -3.141 5.534 -13.034
386 HE22 GLN 51 HE22 GLN 51 -2.170 6.996 -13.176
387 H MET 52 H MET 52 -6.236 3.925 -9.295
388 HA MET 52 HA MET 52 -6.008 2.016 -11.415
389 HB2 MET 52 HB2 MET 52 -4.533 2.060 -9.459
390 HB3 MET 52 HB3 MET 52 -5.882 1.575 -8.407
391 HG2 MET 52 HG2 MET 52 -6.136 -0.520 -9.555
392 HG3 MET 52 HG3 MET 52 -5.054 -0.012 -10.848
393 HE1 MET 52 HE1 MET 52 -1.525 -0.536 -9.471
394 HE2 MET 52 HE2 MET 52 -2.536 -0.387 -10.927
395 HE3 MET 52 HE3 MET 52 -2.435 0.966 -9.772
396 H LEU 53 H LEU 53 -8.528 2.201 -8.744
397 HA LEU 53 HA LEU 53 -9.865 -0.090 -9.939
398 HB2 LEU 53 HB2 LEU 53 -9.865 0.491 -7.504
399 HB3 LEU 53 HB3 LEU 53 -10.923 1.855 -7.867
400 HG LEU 53 HG LEU 53 -12.655 0.304 -8.679
401 HD11 LEU 53 HD11 LEU 53 -11.373 -1.628 -9.497
402 HD12 LEU 53 HD12 LEU 53 -12.450 -2.172 -8.213
403 HD13 LEU 53 HD13 LEU 53 -10.728 -1.930 -7.875
404 HD21 LEU 53 HD21 LEU 53 -12.578 0.949 -6.293
405 HD22 LEU 53 HD22 LEU 53 -11.581 -0.478 -5.937
406 HD23 LEU 53 HD23 LEU 53 -13.249 -0.676 -6.503
407 H ALA 54 H ALA 54 -9.902 3.292 -10.667
408 HA ALA 54 HA ALA 54 -12.299 3.218 -12.346
409 HB1 ALA 54 HB1 ALA 54 -9.928 5.131 -12.347
410 HB2 ALA 54 HB2 ALA 54 -11.467 5.349 -13.198
411 HB3 ALA 54 HB3 ALA 54 -11.436 5.331 -11.426
412 H GLU 55 H GLU 55 -8.800 2.560 -12.820
413 HA GLU 55 HA GLU 55 -8.997 1.791 -15.598
414 HB2 GLU 55 HB2 GLU 55 -6.918 2.432 -14.086
415 HB3 GLU 55 HB3 GLU 55 -6.966 0.755 -13.577
416 HG2 GLU 55 HG2 GLU 55 -5.336 1.103 -15.317
417 HG3 GLU 55 HG3 GLU 55 -6.592 0.001 -15.873
418 H LYS 56 H LYS 56 -10.472 0.489 -13.003
419 HA LYS 56 HA LYS 56 -11.333 -1.430 -12.245
420 HB2 LYS 56 HB2 LYS 56 -10.601 -2.718 -14.887
421 HB3 LYS 56 HB3 LYS 56 -11.637 -3.394 -13.649
422 HG2 LYS 56 HG2 LYS 56 -13.313 -1.680 -13.942
423 HG3 LYS 56 HG3 LYS 56 -12.292 -0.774 -15.064
424 HD2 LYS 56 HD2 LYS 56 -13.283 -3.604 -15.575
425 HD3 LYS 56 HD3 LYS 56 -14.100 -2.160 -16.167
426 HE2 LYS 56 HE2 LYS 56 -11.170 -2.729 -16.806
427 HE3 LYS 56 HE3 LYS 56 -12.489 -3.402 -17.767
428 HZ1 LYS 56 HZ1 LYS 56 -12.156 -0.474 -17.352
429 HZ2 LYS 56 HZ2 LYS 56 -13.234 -1.258 -18.322
430 HZ3 LYS 56 HZ3 LYS 56 -11.649 -1.337 -18.680
431 H ASP 57 H ASP 57 -8.469 -2.359 -14.053
432 HA ASP 57 HA ASP 57 -6.652 -3.576 -13.647
433 HB2 ASP 57 HB2 ASP 57 -6.332 -1.386 -12.322
434 HB3 ASP 57 HB3 ASP 57 -6.424 -2.412 -10.888
435 HA PRO 58 HA PRO 58 -9.085 -6.901 -12.031
436 HB2 PRO 58 HB2 PRO 58 -7.589 -9.061 -12.926
437 HB3 PRO 58 HB3 PRO 58 -8.704 -8.064 -13.902
438 HG2 PRO 58 HG2 PRO 58 -5.707 -7.720 -13.680
439 HG3 PRO 58 HG3 PRO 58 -6.701 -7.848 -15.174
440 HD2 PRO 58 HD2 PRO 58 -5.982 -5.468 -14.206
441 HD3 PRO 58 HD3 PRO 58 -7.671 -5.693 -14.766
442 H LEU 59 H LEU 59 -5.583 -6.913 -11.376
443 HA LEU 59 HA LEU 59 -5.677 -8.562 -9.031
444 HB2 LEU 59 HB2 LEU 59 -3.633 -8.002 -10.271
445 HB3 LEU 59 HB3 LEU 59 -3.774 -6.310 -9.778
446 HG LEU 59 HG LEU 59 -3.346 -6.902 -7.442
447 HD11 LEU 59 HD11 LEU 59 -2.666 -9.229 -6.848
448 HD12 LEU 59 HD12 LEU 59 -3.184 -9.775 -8.457
449 HD13 LEU 59 HD13 LEU 59 -4.370 -9.136 -7.298
450 HD21 LEU 59 HD21 LEU 59 -1.403 -8.262 -9.357
451 HD22 LEU 59 HD22 LEU 59 -1.024 -7.686 -7.718
452 HD23 LEU 59 HD23 LEU 59 -1.435 -6.531 -8.988
453 H ALA 60 H ALA 60 -6.328 -5.051 -9.419
454 HA ALA 60 HA ALA 60 -6.535 -4.563 -6.554
455 HB1 ALA 60 HB1 ALA 60 -7.655 -2.933 -8.857
456 HB2 ALA 60 HB2 ALA 60 -7.431 -2.427 -7.170
457 HB3 ALA 60 HB3 ALA 60 -6.017 -2.755 -8.189
458 H MET 61 H MET 61 -8.891 -5.185 -9.244
459 HA MET 61 HA MET 61 -11.274 -5.128 -7.728
460 HB2 MET 61 HB2 MET 61 -10.756 -7.192 -9.879
461 HB3 MET 61 HB3 MET 61 -12.279 -6.469 -9.345
462 HG2 MET 61 HG2 MET 61 -11.518 -4.277 -10.275
463 HG3 MET 61 HG3 MET 61 -10.068 -5.083 -10.868
464 HE1 MET 61 HE1 MET 61 -13.752 -4.418 -11.220
465 HE2 MET 61 HE2 MET 61 -14.352 -5.578 -12.436
466 HE3 MET 61 HE3 MET 61 -13.903 -6.137 -10.804
467 H LEU 62 H LEU 62 -8.933 -7.808 -8.129
468 HA LEU 62 HA LEU 62 -10.252 -9.728 -6.421
469 HB2 LEU 62 HB2 LEU 62 -7.608 -9.318 -7.731
470 HB3 LEU 62 HB3 LEU 62 -7.540 -10.205 -6.237
471 HG LEU 62 HG LEU 62 -9.185 -11.854 -7.051
472 HD11 LEU 62 HD11 LEU 62 -10.407 -10.455 -8.706
473 HD12 LEU 62 HD12 LEU 62 -9.812 -11.964 -9.412
474 HD13 LEU 62 HD13 LEU 62 -8.967 -10.438 -9.740
475 HD21 LEU 62 HD21 LEU 62 -6.786 -11.420 -8.883
476 HD22 LEU 62 HD22 LEU 62 -7.688 -12.946 -8.700
477 HD23 LEU 62 HD23 LEU 62 -6.788 -12.277 -7.332
478 H LEU 63 H LEU 63 -7.686 -7.253 -5.732
479 HA LEU 63 HA LEU 63 -7.170 -8.258 -3.104
480 HB2 LEU 63 HB2 LEU 63 -5.608 -6.974 -4.546
481 HB3 LEU 63 HB3 LEU 63 -6.643 -5.568 -4.471
482 HG LEU 63 HG LEU 63 -4.563 -5.455 -3.138
483 HD11 LEU 63 HD11 LEU 63 -6.962 -5.282 -1.293
484 HD12 LEU 63 HD12 LEU 63 -6.616 -4.105 -2.582
485 HD13 LEU 63 HD13 LEU 63 -5.466 -4.351 -1.252
486 HD21 LEU 63 HD21 LEU 63 -4.337 -6.673 -1.044
487 HD22 LEU 63 HD22 LEU 63 -4.512 -7.816 -2.392
488 HD23 LEU 63 HD23 LEU 63 -5.885 -7.492 -1.318
489 H PHE 64 H PHE 64 -9.222 -5.670 -4.345
490 HA PHE 64 HA PHE 64 -9.809 -4.772 -1.620
491 HB2 PHE 64 HB2 PHE 64 -10.320 -2.863 -2.519
492 HB3 PHE 64 HB3 PHE 64 -9.856 -3.498 -4.071
493 HD1 PHE 64 HD1 PHE 64 -11.642 -4.377 -5.640
494 HD2 PHE 64 HD2 PHE 64 -12.575 -2.326 -1.975
495 HE1 PHE 64 HE1 PHE 64 -13.928 -3.887 -6.497
496 HE2 PHE 64 HE2 PHE 64 -14.850 -1.812 -2.834
497 HZ PHE 64 HZ PHE 64 -15.526 -2.583 -5.098
498 H GLU 65 H GLU 65 -11.749 -6.608 -4.019
499 HA GLU 65 HA GLU 65 -14.001 -6.860 -2.251
500 HB2 GLU 65 HB2 GLU 65 -13.146 -8.627 -4.573
501 HB3 GLU 65 HB3 GLU 65 -14.685 -8.719 -3.712
502 HG2 GLU 65 HG2 GLU 65 -15.004 -6.233 -4.300
503 HG3 GLU 65 HG3 GLU 65 -13.706 -6.443 -5.461
504 H GLN 66 H GLN 66 -10.901 -8.394 -2.017
505 HA GLN 66 HA GLN 66 -12.068 -10.391 -0.135
506 HB2 GLN 66 HB2 GLN 66 -9.500 -10.438 -1.758
507 HB3 GLN 66 HB3 GLN 66 -9.905 -11.647 -0.557
508 HG2 GLN 66 HG2 GLN 66 -11.743 -11.118 -2.932
509 HG3 GLN 66 HG3 GLN 66 -10.378 -12.212 -3.016
510 HE21 GLN 66 HE21 GLN 66 -10.763 -14.379 -2.464
511 HE22 GLN 66 HE22 GLN 66 -12.054 -14.863 -1.381
512 H TYR 67 H TYR 67 -10.490 -7.471 0.103
513 HA TYR 67 HA TYR 67 -9.647 -8.190 2.893
514 HB2 TYR 67 HB2 TYR 67 -8.467 -6.205 0.960
515 HB3 TYR 67 HB3 TYR 67 -8.310 -5.985 2.691
516 HD1 TYR 67 HD2 TYR 67 -7.649 -8.636 0.088
517 HD2 TYR 67 HD1 TYR 67 -6.502 -6.851 3.838
518 HE1 TYR 67 HE2 TYR 67 -5.569 -10.001 0.107
519 HE2 TYR 67 HE1 TYR 67 -4.413 -8.204 3.850
520 HH TYR 67 HH TYR 67 -3.115 -9.735 2.712
521 H ASN 68 H ASN 68 -12.205 -8.032 2.688
522 HA ASN 68 HA ASN 68 -14.125 -7.088 3.277
523 HB2 ASN 68 HB2 ASN 68 -12.738 -7.162 5.398
524 HB3 ASN 68 HB3 ASN 68 -12.528 -5.419 5.222
525 HD21 ASN 68 HD21 ASN 68 -13.597 -5.356 7.360
526 HD22 ASN 68 HD22 ASN 68 -15.365 -5.356 7.386
527 H ARG 69 H ARG 69 -12.793 -5.670 1.058
528 HA ARG 69 HA ARG 69 -13.459 -4.066 -0.415
529 HB2 ARG 69 HB2 ARG 69 -15.093 -6.014 -0.076
530 HB3 ARG 69 HB3 ARG 69 -16.184 -4.831 0.646
531 HG2 ARG 69 HG2 ARG 69 -16.060 -3.511 -1.505
532 HG3 ARG 69 HG3 ARG 69 -14.991 -4.764 -2.163
533 HD2 ARG 69 HD2 ARG 69 -16.819 -6.449 -1.738
534 HD3 ARG 69 HD3 ARG 69 -17.889 -5.118 -1.278
535 HE ARG 69 HE ARG 69 -17.096 -5.948 -3.938
536 HH11 ARG 69 HH11 ARG 69 -18.192 -3.077 -2.115
537 HH12 ARG 69 HH12 ARG 69 -18.801 -2.283 -3.549
538 HH21 ARG 69 HH21 ARG 69 -17.909 -4.889 -5.748
539 HH22 ARG 69 HH22 ARG 69 -18.654 -3.312 -5.601
540 H LEU 70 H LEU 70 -12.493 -2.256 1.198
541 HA LEU 70 HA LEU 70 -14.674 -0.271 1.762
542 HB2 LEU 70 HB2 LEU 70 -11.747 -0.158 2.534
543 HB3 LEU 70 HB3 LEU 70 -12.978 1.036 2.910
544 HG LEU 70 HG LEU 70 -12.721 -1.758 4.048
545 HD11 LEU 70 HD11 LEU 70 -11.385 0.064 5.051
546 HD12 LEU 70 HD12 LEU 70 -12.648 -0.508 6.167
547 HD13 LEU 70 HD13 LEU 70 -12.860 1.019 5.294
548 HD21 LEU 70 HD21 LEU 70 -14.766 -1.303 5.374
549 HD22 LEU 70 HD22 LEU 70 -15.138 -1.423 3.655
550 HD23 LEU 70 HD23 LEU 70 -15.051 0.175 4.430
551 H ALA 71 H ALA 71 -11.917 -0.708 -0.385
552 HA ALA 71 HA ALA 71 -11.073 0.473 -2.091
553 HB1 ALA 71 HB1 ALA 71 -13.241 0.168 -3.142
554 HB2 ALA 71 HB2 ALA 71 -13.866 1.639 -2.365
555 HB3 ALA 71 HB3 ALA 71 -12.567 1.748 -3.567
556 H MET 72 H MET 72 -9.767 1.396 -0.358
557 HA MET 72 HA MET 72 -10.245 3.801 0.933
558 HB2 MET 72 HB2 MET 72 -7.901 3.761 1.540
559 HB3 MET 72 HB3 MET 72 -8.541 2.118 1.534
560 HG2 MET 72 HG2 MET 72 -7.565 1.837 -0.794
561 HG3 MET 72 HG3 MET 72 -6.831 3.432 -0.609
562 HE1 MET 72 HE1 MET 72 -4.428 2.789 -1.052
563 HE2 MET 72 HE2 MET 72 -3.704 1.263 -0.513
564 HE3 MET 72 HE3 MET 72 -5.142 1.243 -1.553
565 HA PRO 73 HA PRO 73 -9.152 7.119 -1.980
566 HB2 PRO 73 HB2 PRO 73 -8.632 9.164 -0.279
567 HB3 PRO 73 HB3 PRO 73 -10.284 8.497 -0.454
568 HG2 PRO 73 HG2 PRO 73 -8.222 7.808 1.670
569 HG3 PRO 73 HG3 PRO 73 -9.931 8.292 1.906
570 HD2 PRO 73 HD2 PRO 73 -9.154 5.680 1.859
571 HD3 PRO 73 HD3 PRO 73 -10.723 6.203 1.182
572 H ASN 74 H ASN 74 -7.218 8.349 -2.658
573 HA ASN 74 HA ASN 74 -4.795 6.902 -2.045
574 HB2 ASN 74 HB2 ASN 74 -3.803 8.033 -3.795
575 HB3 ASN 74 HB3 ASN 74 -5.483 7.835 -4.302
576 HD21 ASN 74 HD21 ASN 74 -6.709 9.691 -4.680
577 HD22 ASN 74 HD22 ASN 74 -5.909 11.278 -4.764
578 H MET 75 H MET 75 -6.030 9.868 -0.736
579 HA MET 75 HA MET 75 -5.393 11.204 0.903
580 HB2 MET 75 HB2 MET 75 -3.427 9.072 1.767
581 HB3 MET 75 HB3 MET 75 -4.085 10.380 2.753
582 HG2 MET 75 HG2 MET 75 -6.400 9.432 2.333
583 HG3 MET 75 HG3 MET 75 -5.621 8.056 1.551
584 HE1 MET 75 HE1 MET 75 -6.785 9.665 4.842
585 HE2 MET 75 HE2 MET 75 -5.686 8.989 6.065
586 HE3 MET 75 HE3 MET 75 -5.079 10.169 4.885
587 H ARG 76 H ARG 76 -3.595 11.069 -1.663
588 HA ARG 76 HA ARG 76 -1.976 12.310 -2.603
589 HB2 ARG 76 HB2 ARG 76 -3.059 14.383 -0.668
590 HB3 ARG 76 HB3 ARG 76 -2.177 14.709 -2.166
591 HG2 ARG 76 HG2 ARG 76 -3.991 13.568 -3.460
592 HG3 ARG 76 HG3 ARG 76 -4.899 13.345 -1.949
593 HD2 ARG 76 HD2 ARG 76 -4.868 15.825 -1.607
594 HD3 ARG 76 HD3 ARG 76 -4.069 16.001 -3.182
595 HE ARG 76 HE ARG 76 -6.511 14.456 -3.343
596 HH11 ARG 76 HH11 ARG 76 -5.303 17.812 -3.236
597 HH12 ARG 76 HH12 ARG 76 -6.740 18.461 -3.995
598 HH21 ARG 76 HH21 ARG 76 -8.341 15.339 -4.337
599 HH22 ARG 76 HH22 ARG 76 -8.455 17.062 -4.622
600 H LEU 77 H LEU 77 -0.386 10.796 -1.459
601 HA LEU 77 HA LEU 77 1.323 11.881 0.630
602 HB2 LEU 77 HB2 LEU 77 1.630 9.608 -1.363
603 HB3 LEU 77 HB3 LEU 77 2.840 9.982 -0.143
604 HG LEU 77 HG LEU 77 -0.027 9.209 0.541
605 HD11 LEU 77 HD11 LEU 77 0.955 6.999 1.083
606 HD12 LEU 77 HD12 LEU 77 2.527 7.539 0.459
607 HD13 LEU 77 HD13 LEU 77 1.127 7.386 -0.635
608 HD21 LEU 77 HD21 LEU 77 2.533 9.368 2.212
609 HD22 LEU 77 HD22 LEU 77 0.963 8.752 2.778
610 HD23 LEU 77 HD23 LEU 77 1.133 10.453 2.340
611 H GLY 78 H GLY 78 3.143 13.058 0.512
612 HA2 GLY 78 HA2 GLY 78 4.070 14.326 -1.910
613 HA3 GLY 78 HA3 GLY 78 4.905 14.297 -0.355
614 H ASP 79 H ASP 79 5.946 13.922 -3.126
615 HA ASP 79 HA ASP 79 6.281 11.182 -3.704
616 HB2 ASP 79 HB2 ASP 79 7.639 11.832 -5.491
617 HB3 ASP 79 HB3 ASP 79 6.495 13.155 -5.286
618 H ALA 80 H ALA 80 8.223 13.135 -1.513
619 HA ALA 80 HA ALA 80 10.369 11.110 -1.353
620 HB1 ALA 80 HB1 ALA 80 9.911 13.557 0.391
621 HB2 ALA 80 HB2 ALA 80 11.375 12.590 0.250
622 HB3 ALA 80 HB3 ALA 80 10.835 13.556 -1.132
623 H GLU 81 H GLU 81 7.313 11.843 0.238
624 HA GLU 81 HA GLU 81 7.764 10.066 2.516
625 HB2 GLU 81 HB2 GLU 81 5.136 11.106 1.370
626 HB3 GLU 81 HB3 GLU 81 5.360 10.257 2.895
627 HG2 GLU 81 HG2 GLU 81 6.913 12.112 3.634
628 HG3 GLU 81 HG3 GLU 81 6.462 13.000 2.170
629 H VAL 82 H VAL 82 6.181 9.760 -0.710
630 HA VAL 82 HA VAL 82 5.573 6.959 -0.474
631 HB VAL 82 HB VAL 82 6.347 8.476 -3.004
632 HG11 VAL 82 HG11 VAL 82 6.509 6.013 -3.348
633 HG12 VAL 82 HG12 VAL 82 4.884 5.799 -2.670
634 HG13 VAL 82 HG13 VAL 82 5.114 6.660 -4.195
635 HG21 VAL 82 HG21 VAL 82 3.621 7.829 -1.794
636 HG22 VAL 82 HG22 VAL 82 4.346 9.446 -1.963
637 HG23 VAL 82 HG23 VAL 82 3.889 8.536 -3.399
638 H SER 83 H SER 83 8.653 8.561 -1.705
639 HA SER 83 HA SER 83 10.018 6.134 -2.209
640 HB2 SER 83 HB2 SER 83 11.152 8.806 -1.285
641 HB3 SER 83 HB3 SER 83 12.122 7.413 -1.798
642 HG SER 83 HG SER 83 11.938 8.527 -3.579
643 H ALA 84 H ALA 84 9.890 7.943 0.921
644 HA ALA 84 HA ALA 84 11.620 6.085 2.299
645 HB1 ALA 84 HB1 ALA 84 10.651 7.216 4.328
646 HB2 ALA 84 HB2 ALA 84 11.330 8.321 3.122
647 HB3 ALA 84 HB3 ALA 84 9.570 8.120 3.238
648 H LEU 85 H LEU 85 8.035 6.224 1.902
649 HA LEU 85 HA LEU 85 7.530 3.935 3.558
650 HB2 LEU 85 HB2 LEU 85 5.959 5.792 2.968
651 HB3 LEU 85 HB3 LEU 85 5.854 5.154 1.330
652 HG LEU 85 HG LEU 85 4.773 3.105 2.181
653 HD11 LEU 85 HD11 LEU 85 5.045 4.408 4.931
654 HD12 LEU 85 HD12 LEU 85 5.796 2.884 4.402
655 HD13 LEU 85 HD13 LEU 85 4.045 2.984 4.562
656 HD21 LEU 85 HD21 LEU 85 3.560 5.697 3.266
657 HD22 LEU 85 HD22 LEU 85 2.686 4.182 3.043
658 HD23 LEU 85 HD23 LEU 85 3.343 5.034 1.634
659 H ILE 86 H ILE 86 8.341 4.242 0.163
660 HA ILE 86 HA ILE 86 7.969 1.450 -0.623
661 HB ILE 86 HB ILE 86 8.940 3.985 -1.828
662 HG12 ILE 86 HG12 ILE 86 7.720 3.212 -3.747
663 HG13 ILE 86 HG13 ILE 86 7.618 1.569 -3.096
664 HG21 ILE 86 HG21 ILE 86 10.132 1.420 -2.904
665 HG22 ILE 86 HG22 ILE 86 10.101 2.989 -3.723
666 HG23 ILE 86 HG23 ILE 86 11.011 2.814 -2.231
667 HD11 ILE 86 HD11 ILE 86 6.038 2.293 -1.375
668 HD12 ILE 86 HD12 ILE 86 6.259 3.992 -1.845
669 HD13 ILE 86 HD13 ILE 86 5.487 2.853 -2.958
670 H SER 87 H SER 87 10.632 3.394 0.660
671 HA SER 87 HA SER 87 12.577 1.279 0.633
672 HB2 SER 87 HB2 SER 87 12.416 3.693 2.463
673 HB3 SER 87 HB3 SER 87 13.799 2.616 2.239
674 HG SER 87 HG SER 87 12.566 4.328 0.322
675 H TYR 88 H TYR 88 10.153 2.317 3.100
676 HA TYR 88 HA TYR 88 10.895 0.216 4.919
677 HB2 TYR 88 HB2 TYR 88 9.691 2.150 5.664
678 HB3 TYR 88 HB3 TYR 88 8.301 1.756 4.651
679 HD1 TYR 88 HD2 TYR 88 10.204 -0.720 6.768
680 HD2 TYR 88 HD1 TYR 88 6.644 1.695 6.380
681 HE1 TYR 88 HE2 TYR 88 9.209 -1.860 8.722
682 HE2 TYR 88 HE1 TYR 88 5.665 0.545 8.361
683 HH TYR 88 HH TYR 88 6.096 -0.901 10.161
684 H LEU 89 H LEU 89 8.307 0.269 2.408
685 HA LEU 89 HA LEU 89 7.408 -2.379 2.993
686 HB2 LEU 89 HB2 LEU 89 6.803 -0.304 0.942
687 HB3 LEU 89 HB3 LEU 89 6.363 -1.956 0.563
688 HG LEU 89 HG LEU 89 4.972 -2.193 2.490
689 HD11 LEU 89 HD11 LEU 89 6.141 -0.877 4.206
690 HD12 LEU 89 HD12 LEU 89 4.462 -0.370 4.062
691 HD13 LEU 89 HD13 LEU 89 5.747 0.623 3.339
692 HD21 LEU 89 HD21 LEU 89 4.456 0.503 1.172
693 HD22 LEU 89 HD22 LEU 89 3.250 -0.510 2.005
694 HD23 LEU 89 HD23 LEU 89 4.003 -1.083 0.511
695 H GLU 90 H GLU 90 10.308 -1.689 1.539
696 HA GLU 90 HA GLU 90 10.453 -4.516 0.585
697 HB2 GLU 90 HB2 GLU 90 11.048 -2.498 -0.992
698 HB3 GLU 90 HB3 GLU 90 12.527 -2.396 -0.024
699 HG2 GLU 90 HG2 GLU 90 12.933 -4.824 -0.537
700 HG3 GLU 90 HG3 GLU 90 11.506 -4.822 -1.565
701 H GLU 91 H GLU 91 11.802 -2.169 2.905
702 HA GLU 91 HA GLU 91 13.895 -3.953 3.867
703 HB2 GLU 91 HB2 GLU 91 12.732 -1.334 4.846
704 HB3 GLU 91 HB3 GLU 91 13.959 -2.222 5.757
705 HG2 GLU 91 HG2 GLU 91 15.579 -2.066 4.034
706 HG3 GLU 91 HG3 GLU 91 14.402 -1.604 2.818
707 H GLU 92 H GLU 92 10.495 -3.423 4.789
708 HA GLU 92 HA GLU 92 10.456 -5.083 7.109
709 HB2 GLU 92 HB2 GLU 92 8.043 -5.321 6.650
710 HB3 GLU 92 HB3 GLU 92 8.621 -3.674 6.586
711 HG2 GLU 92 HG2 GLU 92 7.327 -3.540 4.784
712 HG3 GLU 92 HG3 GLU 92 8.731 -4.186 3.935
713 H THR 93 H THR 93 10.371 -5.956 3.684
714 HA THR 93 HA THR 93 9.924 -8.775 4.101
715 HB THR 93 HB THR 93 11.130 -7.300 1.736
716 HG1 THR 93 HG1 THR 93 8.662 -7.183 2.668
717 HG21 THR 93 HG21 THR 93 9.682 -9.972 1.751
718 HG22 THR 93 HG22 THR 93 11.463 -9.804 1.694
719 HG23 THR 93 HG23 THR 93 10.488 -9.141 0.388
720 H ALA 94 H ALA 94 12.860 -6.784 3.672
721 HA ALA 94 HA ALA 94 14.761 -8.929 3.782
722 HB1 ALA 94 HB1 ALA 94 15.290 -6.658 2.983
723 HB2 ALA 94 HB2 ALA 94 15.063 -6.017 4.630
724 HB3 ALA 94 HB3 ALA 94 16.373 -7.160 4.293
725 H ARG 95 H ARG 95 13.035 -7.174 6.351
726 HA ARG 95 HA ARG 95 14.484 -8.440 8.509
727 HB2 ARG 95 HB2 ARG 95 13.386 -6.206 8.624
728 HB3 ARG 95 HB3 ARG 95 11.819 -6.992 8.528
729 HG2 ARG 95 HG2 ARG 95 12.147 -6.442 10.778
730 HG3 ARG 95 HG3 ARG 95 12.357 -8.181 10.703
731 HD2 ARG 95 HD2 ARG 95 14.661 -6.178 10.697
732 HD3 ARG 95 HD3 ARG 95 13.975 -6.860 12.166
733 HE ARG 95 HE ARG 95 14.633 -9.099 11.408
734 HH11 ARG 95 HH11 ARG 95 16.362 -6.348 9.915
735 HH12 ARG 95 HH12 ARG 95 17.763 -7.319 9.526
736 HH21 ARG 95 HH21 ARG 95 16.478 -10.293 10.897
737 HH22 ARG 95 HH22 ARG 95 17.832 -9.537 10.089
738 H LEU 96 H LEU 96 11.168 -8.959 7.229
739 HA LEU 96 HA LEU 96 9.608 -10.512 7.562
740 HB2 LEU 96 HB2 LEU 96 11.770 -11.705 6.375
741 HB3 LEU 96 HB3 LEU 96 11.468 -12.814 7.650
742 HG LEU 96 HG LEU 96 10.446 -13.673 5.756
743 HD11 LEU 96 HD11 LEU 96 8.050 -13.645 6.178
744 HD12 LEU 96 HD12 LEU 96 8.245 -12.211 7.217
745 HD13 LEU 96 HD13 LEU 96 8.979 -13.767 7.679
746 HD21 LEU 96 HD21 LEU 96 9.305 -10.911 5.285
747 HD22 LEU 96 HD22 LEU 96 8.936 -12.360 4.302
748 HD23 LEU 96 HD23 LEU 96 10.592 -11.731 4.381
749 H GLN 97 H GLN 97 10.833 -9.484 10.042
750 HA GLN 97 HA GLN 97 9.897 -11.375 12.143
751 HB2 GLN 97 HB2 GLN 97 12.654 -10.071 11.888
752 HB3 GLN 97 HB3 GLN 97 12.071 -10.812 13.362
753 HG2 GLN 97 HG2 GLN 97 11.990 -13.005 12.336
754 HG3 GLN 97 HG3 GLN 97 12.532 -12.342 10.793
755 HE21 GLN 97 HE21 GLN 97 13.685 -13.827 13.623
756 HE22 GLN 97 HE22 GLN 97 15.336 -13.203 13.564
757 H THR 98 H THR 98 10.455 -10.019 14.353
758 HA THR 98 HA THR 98 10.224 -8.192 15.706
759 HB THR 98 HB THR 98 11.279 -6.540 13.419
760 HG1 THR 98 HG1 THR 98 12.475 -8.592 14.916
761 HG21 THR 98 HG21 THR 98 10.792 -5.387 15.617
762 HG22 THR 98 HG22 THR 98 12.496 -5.401 15.174
763 HG23 THR 98 HG23 THR 98 11.901 -6.527 16.411
764 HA PRO 99 HA PRO 99 6.391 -6.000 15.141
765 HB2 PRO 99 HB2 PRO 99 5.058 -7.444 17.035
766 HB3 PRO 99 HB3 PRO 99 4.915 -7.843 15.300
767 HG2 PRO 99 HG2 PRO 99 6.634 -9.147 17.406
768 HG3 PRO 99 HG3 PRO 99 5.663 -9.924 16.127
769 HD2 PRO 99 HD2 PRO 99 8.377 -9.479 15.953
770 HD3 PRO 99 HD3 PRO 99 7.316 -9.572 14.526
771 H VAL 100 H VAL 100 6.726 -4.313 16.618
772 HA VAL 100 HA VAL 100 7.542 -4.903 19.361
773 HB VAL 100 HB VAL 100 9.684 -4.976 18.080
774 HG11 VAL 100 HG11 VAL 100 9.238 -3.213 16.410
775 HG12 VAL 100 HG12 VAL 100 9.325 -1.978 17.682
776 HG13 VAL 100 HG13 VAL 100 10.751 -2.961 17.288
777 HG21 VAL 100 HG21 VAL 100 9.520 -2.702 20.099
778 HG22 VAL 100 HG22 VAL 100 9.581 -4.438 20.495
779 HG23 VAL 100 HG23 VAL 100 10.945 -3.675 19.662
780 H THR 101 H THR 101 6.905 -3.331 20.823
781 HA THR 101 HA THR 101 5.631 -0.869 19.700
782 HB THR 101 HB THR 101 3.693 -1.281 21.211
783 HG1 THR 101 HG1 THR 101 3.499 -3.683 21.599
784 HG21 THR 101 HG21 THR 101 4.119 -3.486 19.153
785 HG22 THR 101 HG22 THR 101 3.573 -1.823 18.806
786 HG23 THR 101 HG23 THR 101 2.574 -2.889 19.792
787 H ASN 102 H ASN 102 5.209 0.802 21.073
788 HA ASN 102 HA ASN 102 5.772 2.437 22.447
789 HB2 ASN 102 HB2 ASN 102 4.322 1.164 23.910
790 HB3 ASN 102 HB3 ASN 102 5.686 0.238 24.527
791 HD21 ASN 102 HD21 ASN 102 4.972 0.973 26.640
792 HD22 ASN 102 HD22 ASN 102 5.406 2.585 27.184
793 H ARG 103 H ARG 103 7.823 -0.014 23.991
794 HA ARG 103 HA ARG 103 10.253 1.696 23.637
795 HB2 ARG 103 HB2 ARG 103 9.067 0.628 26.224
796 HB3 ARG 103 HB3 ARG 103 10.740 1.184 26.110
797 HG2 ARG 103 HG2 ARG 103 10.085 3.429 25.551
798 HG3 ARG 103 HG3 ARG 103 8.384 2.963 25.406
799 HD2 ARG 103 HD2 ARG 103 8.347 2.310 27.792
800 HD3 ARG 103 HD3 ARG 103 10.030 2.852 27.961
801 HE ARG 103 HE ARG 103 8.931 5.085 26.994
802 HH11 ARG 103 HH11 ARG 103 7.667 2.960 29.572
803 HH12 ARG 103 HH12 ARG 103 6.840 4.273 30.384
804 HH21 ARG 103 HH21 ARG 103 7.856 6.746 28.089
805 HH22 ARG 103 HH22 ARG 103 6.940 6.406 29.540
806 H GLY 104 H GLY 104 9.057 -1.300 23.019
807 HA2 GLY 104 HA2 GLY 104 10.936 -3.027 24.270
808 HA3 GLY 104 HA3 GLY 104 9.857 -3.438 22.940
809 H ILE 105 H ILE 105 11.928 -0.920 21.927
810 HA ILE 105 HA ILE 105 13.224 -2.866 20.167
811 HB ILE 105 HB ILE 105 11.720 -1.162 19.265
812 HG12 ILE 105 HG12 ILE 105 14.546 -0.868 18.175
813 HG13 ILE 105 HG13 ILE 105 13.485 -2.250 17.883
814 HG21 ILE 105 HG21 ILE 105 12.334 0.712 20.780
815 HG22 ILE 105 HG22 ILE 105 13.889 0.875 19.934
816 HG23 ILE 105 HG23 ILE 105 12.358 1.180 19.094
817 HD11 ILE 105 HD11 ILE 105 13.400 -0.760 15.982
818 HD12 ILE 105 HD12 ILE 105 11.829 -0.695 16.809
819 HD13 ILE 105 HD13 ILE 105 13.005 0.627 16.997
820 HA PRO 106 HA PRO 106 17.092 -0.285 21.077
821 HB2 PRO 106 HB2 PRO 106 17.640 0.695 23.542
822 HB3 PRO 106 HB3 PRO 106 16.583 1.552 22.377
823 HG2 PRO 106 HG2 PRO 106 15.775 -0.233 24.662
824 HG3 PRO 106 HG3 PRO 106 15.106 1.372 24.232
825 HD2 PRO 106 HD2 PRO 106 13.949 -1.029 23.491
826 HD3 PRO 106 HD3 PRO 106 13.810 0.452 22.494
827 HHA HEC 107 HHA HEC 107 -5.129 -2.947 0.919
828 HHB HEC 107 HHB HEC 107 -0.500 1.550 1.258
829 HHC HEC 107 HHC HEC 107 -4.432 5.375 4.665
830 HHD HEC 107 HHD HEC 107 -8.860 0.616 4.740
831 HMA1 HEC 107 HMA1 HEC 107 0.465 -0.466 0.686
832 HMA2 HEC 107 HMA2 HEC 107 0.025 -1.987 -0.074
833 HMA3 HEC 107 HMA3 HEC 107 -0.263 -0.467 -0.937
834 HAA1 HEC 107 HAA1 HEC 107 -3.461 -3.473 -0.575
835 HAA2 HEC 107 HAA2 HEC 107 -1.816 -3.062 -0.984
836 HBA1 HEC 107 HBA1 HEC 107 -1.086 -3.878 1.283
837 HBA2 HEC 107 HBA2 HEC 107 -2.743 -4.420 1.574
838 HMB1 HEC 107 HMB1 HEC 107 0.433 5.049 2.425
839 HMB2 HEC 107 HMB2 HEC 107 0.748 3.337 2.211
840 HMB3 HEC 107 HMB3 HEC 107 -0.073 4.272 0.936
841 HAB HEC 107 HAB HEC 107 -2.430 6.056 4.897
842 HBB1 HEC 107 HBB1 HEC 107 -0.843 6.887 2.472
843 HBB2 HEC 107 HBB2 HEC 107 -2.607 7.030 2.625
844 HBB3 HEC 107 HBB3 HEC 107 -1.535 7.928 3.730
845 HMC1 HEC 107 HMC1 HEC 107 -6.004 5.935 6.096
846 HMC2 HEC 107 HMC2 HEC 107 -7.557 6.114 5.264
847 HMC3 HEC 107 HMC3 HEC 107 -7.473 5.379 6.874
848 HAC HEC 107 HAC HEC 107 -9.366 1.984 6.143
849 HBC1 HEC 107 HBC1 HEC 107 -10.236 3.991 5.012
850 HBC2 HEC 107 HBC2 HEC 107 -10.889 3.678 6.619
851 HBC3 HEC 107 HBC3 HEC 107 -9.686 4.961 6.396
852 HMD1 HEC 107 HMD1 HEC 107 -9.357 -3.075 4.010
853 HMD2 HEC 107 HMD2 HEC 107 -9.560 -1.547 4.854
854 HMD3 HEC 107 HMD3 HEC 107 -10.188 -1.746 3.194
855 HAD1 HEC 107 HAD1 HEC 107 -7.203 -3.989 1.158
856 HAD2 HEC 107 HAD2 HEC 107 -8.816 -3.666 1.778
857 HBD1 HEC 107 HBD1 HEC 107 -7.472 -2.000 -0.390
858 HBD2 HEC 107 HBD2 HEC 107 -8.622 -3.296 -0.679
Start of MODEL 18
1 H SER 1 H SER 1 13.399 4.654 8.090
2 HA SER 1 HA SER 1 13.077 3.146 5.552
3 HB2 SER 1 HB2 SER 1 12.924 2.249 8.448
4 HB3 SER 1 HB3 SER 1 12.781 1.192 7.032
5 HG SER 1 HG SER 1 14.880 1.604 6.473
6 H GLY 2 H GLY 2 11.225 5.339 6.131
7 HA2 GLY 2 HA2 GLY 2 8.976 5.753 5.830
8 HA3 GLY 2 HA3 GLY 2 8.737 4.060 5.532
9 H GLU 3 H GLU 3 10.064 4.161 8.543
10 HA GLU 3 HA GLU 3 7.784 3.068 9.722
11 HB2 GLU 3 HB2 GLU 3 9.054 2.863 11.707
12 HB3 GLU 3 HB3 GLU 3 10.114 2.574 10.340
13 HG2 GLU 3 HG2 GLU 3 10.035 5.057 12.098
14 HG3 GLU 3 HG3 GLU 3 11.241 3.816 12.124
15 H GLN 4 H GLN 4 9.105 6.354 10.435
16 HA GLN 4 HA GLN 4 6.976 7.033 12.260
17 HB2 GLN 4 HB2 GLN 4 8.919 8.808 10.733
18 HB3 GLN 4 HB3 GLN 4 7.867 9.343 12.038
19 HG2 GLN 4 HG2 GLN 4 10.135 7.322 12.296
20 HG3 GLN 4 HG3 GLN 4 10.175 8.991 12.814
21 HE21 GLN 4 HE21 GLN 4 10.509 6.431 14.410
22 HE22 GLN 4 HE22 GLN 4 9.343 6.612 15.703
23 H ILE 5 H ILE 5 7.366 7.420 8.741
24 HA ILE 5 HA ILE 5 5.016 9.129 8.430
25 HB ILE 5 HB ILE 5 6.530 7.400 6.426
26 HG12 ILE 5 HG12 ILE 5 6.634 10.436 6.776
27 HG13 ILE 5 HG13 ILE 5 7.771 9.375 7.581
28 HG21 ILE 5 HG21 ILE 5 5.407 8.723 4.670
29 HG22 ILE 5 HG22 ILE 5 4.191 7.925 5.655
30 HG23 ILE 5 HG23 ILE 5 4.519 9.650 5.898
31 HD11 ILE 5 HD11 ILE 5 8.810 10.204 5.586
32 HD12 ILE 5 HD12 ILE 5 8.516 8.467 5.394
33 HD13 ILE 5 HD13 ILE 5 7.466 9.650 4.577
34 H PHE 6 H PHE 6 5.539 5.537 8.139
35 HA PHE 6 HA PHE 6 2.764 5.017 7.587
36 HB2 PHE 6 HB2 PHE 6 4.717 3.433 7.248
37 HB3 PHE 6 HB3 PHE 6 4.712 3.145 8.982
38 HD1 PHE 6 HD2 PHE 6 2.608 2.154 10.054
39 HD2 PHE 6 HD1 PHE 6 3.113 2.393 5.786
40 HE1 PHE 6 HE2 PHE 6 0.698 0.625 9.749
41 HE2 PHE 6 HE1 PHE 6 1.217 0.820 5.477
42 HZ PHE 6 HZ PHE 6 0.001 -0.069 7.463
43 H ARG 7 H ARG 7 4.591 5.103 10.663
44 HA ARG 7 HA ARG 7 2.626 4.461 12.539
45 HB2 ARG 7 HB2 ARG 7 5.014 4.780 12.990
46 HB3 ARG 7 HB3 ARG 7 4.854 6.514 12.710
47 HG2 ARG 7 HG2 ARG 7 3.417 6.721 14.710
48 HG3 ARG 7 HG3 ARG 7 3.531 4.972 14.976
49 HD2 ARG 7 HD2 ARG 7 6.029 5.210 15.141
50 HD3 ARG 7 HD3 ARG 7 5.827 6.965 14.966
51 HE ARG 7 HE ARG 7 4.448 5.506 17.158
52 HH11 ARG 7 HH11 ARG 7 6.921 7.935 16.288
53 HH12 ARG 7 HH12 ARG 7 7.024 8.545 17.923
54 HH21 ARG 7 HH21 ARG 7 4.616 6.345 19.236
55 HH22 ARG 7 HH22 ARG 7 5.730 7.649 19.582
56 H THR 8 H THR 8 3.115 7.580 10.898
57 HA THR 8 HA THR 8 0.934 8.823 12.478
58 HB THR 8 HB THR 8 1.603 10.907 11.213
59 HG1 THR 8 HG1 THR 8 3.955 9.502 10.592
60 HG21 THR 8 HG21 THR 8 2.388 10.415 13.511
61 HG22 THR 8 HG22 THR 8 3.579 11.303 12.557
62 HG23 THR 8 HG23 THR 8 3.799 9.560 12.844
63 H ARG 9 H ARG 9 1.542 8.056 9.026
64 HA ARG 9 HA ARG 9 -1.022 9.332 8.356
65 HB2 ARG 9 HB2 ARG 9 1.163 8.264 6.548
66 HB3 ARG 9 HB3 ARG 9 -0.324 9.045 6.025
67 HG2 ARG 9 HG2 ARG 9 0.432 11.000 7.655
68 HG3 ARG 9 HG3 ARG 9 2.024 10.251 7.497
69 HD2 ARG 9 HD2 ARG 9 1.857 12.008 5.869
70 HD3 ARG 9 HD3 ARG 9 1.793 10.471 4.981
71 HE ARG 9 HE ARG 9 -0.851 11.053 5.449
72 HH11 ARG 9 HH11 ARG 9 1.751 12.955 3.912
73 HH12 ARG 9 HH12 ARG 9 0.637 13.838 2.894
74 HH21 ARG 9 HH21 ARG 9 -2.243 12.224 4.121
75 HH22 ARG 9 HH22 ARG 9 -1.619 13.426 3.014
76 H CYS 10 H CYS 10 0.098 6.036 8.625
77 HA CYS 10 HA CYS 10 -2.288 5.066 7.097
78 HB2 CYS 10 HB2 CYS 10 0.596 4.206 6.752
79 HB3 CYS 10 HB3 CYS 10 -0.779 3.577 5.850
80 H SER 11 H SER 11 -1.413 4.855 10.099
81 HA SER 11 HA SER 11 -1.134 1.904 10.377
82 HB2 SER 11 HB2 SER 11 -0.899 4.174 12.366
83 HB3 SER 11 HB3 SER 11 -0.783 2.456 12.796
84 HG SER 11 HG SER 11 0.848 3.795 10.900
85 H SER 12 H SER 12 -3.735 4.103 10.308
86 HA SER 12 HA SER 12 -5.339 3.178 12.419
87 HB2 SER 12 HB2 SER 12 -7.200 4.283 11.186
88 HB3 SER 12 HB3 SER 12 -5.746 5.278 11.350
89 HG SER 12 HG SER 12 -6.634 5.353 9.254
90 H CYS 13 H CYS 13 -5.178 1.828 9.136
91 HA CYS 13 HA CYS 13 -7.337 -0.139 9.802
92 HB2 CYS 13 HB2 CYS 13 -6.261 0.714 7.106
93 HB3 CYS 13 HB3 CYS 13 -7.646 -0.328 7.404
94 H HIS 14 H HIS 14 -3.952 -0.049 9.413
95 HA HIS 14 HA HIS 14 -3.654 -2.922 9.331
96 HB2 HIS 14 2HB HIS 14 -2.000 -2.677 7.280
97 HB3 HIS 14 3HB HIS 14 -3.714 -2.978 7.057
98 HD1 HIS 14 1HD HIS 14 -2.467 0.651 7.673
99 HD2 HIS 14 2HD HIS 14 -3.750 -2.044 4.729
100 HE1 HIS 14 1HE HIS 14 -3.032 2.073 5.697
101 H THR 15 H THR 15 -1.332 -3.504 9.190
102 HA THR 15 HA THR 15 0.608 -1.535 10.110
103 HB THR 15 HB THR 15 -0.680 -2.250 12.191
104 HG1 THR 15 HG1 THR 15 0.991 -1.780 13.246
105 HG21 THR 15 HG21 THR 15 0.016 -4.211 13.363
106 HG22 THR 15 HG22 THR 15 1.118 -4.687 12.049
107 HG23 THR 15 HG23 THR 15 -0.642 -4.728 11.805
108 H VAL 16 H VAL 16 2.781 -2.520 10.500
109 HA VAL 16 HA VAL 16 3.247 -4.602 8.368
110 HB VAL 16 HB VAL 16 4.989 -2.177 8.847
111 HG11 VAL 16 HG11 VAL 16 4.667 -4.021 6.444
112 HG12 VAL 16 HG12 VAL 16 5.833 -2.687 6.625
113 HG13 VAL 16 HG13 VAL 16 5.977 -4.119 7.645
114 HG21 VAL 16 HG21 VAL 16 2.496 -2.385 7.148
115 HG22 VAL 16 HG22 VAL 16 3.026 -1.096 8.217
116 HG23 VAL 16 HG23 VAL 16 3.850 -1.317 6.674
117 H GLY 17 H GLY 17 3.623 -6.279 9.589
118 HA2 GLY 17 HA2 GLY 17 4.861 -7.761 10.853
119 HA3 GLY 17 HA3 GLY 17 6.118 -6.539 11.060
120 H ASN 18 H ASN 18 3.645 -4.819 12.197
121 HA ASN 18 HA ASN 18 4.353 -5.366 14.954
122 HB2 ASN 18 HB2 ASN 18 3.577 -3.099 13.442
123 HB3 ASN 18 HB3 ASN 18 2.199 -3.396 14.491
124 HD21 ASN 18 HD21 ASN 18 3.044 -4.128 16.861
125 HD22 ASN 18 HD22 ASN 18 4.257 -3.007 17.493
126 H THR 19 H THR 19 2.335 -7.076 13.219
127 HA THR 19 HA THR 19 -0.229 -6.503 14.168
128 HB THR 19 HB THR 19 0.548 -9.058 12.747
129 HG1 THR 19 HG1 THR 19 1.341 -7.862 11.263
130 HG21 THR 19 HG21 THR 19 -1.533 -8.696 11.517
131 HG22 THR 19 HG22 THR 19 -1.828 -7.188 12.397
132 HG23 THR 19 HG23 THR 19 -1.874 -8.740 13.263
133 H GLU 20 H GLU 20 -1.632 -7.413 15.546
134 HA GLU 20 HA GLU 20 -0.634 -9.159 17.656
135 HB2 GLU 20 HB2 GLU 20 -2.713 -8.691 18.744
136 HB3 GLU 20 HB3 GLU 20 -2.101 -7.215 18.036
137 HG2 GLU 20 HG2 GLU 20 -3.712 -7.556 16.097
138 HG3 GLU 20 HG3 GLU 20 -4.366 -8.942 16.958
139 HA PRO 21 HA PRO 21 -2.356 -13.143 16.463
140 HB2 PRO 21 HB2 PRO 21 -4.002 -13.054 18.997
141 HB3 PRO 21 HB3 PRO 21 -3.046 -14.410 18.319
142 HG2 PRO 21 HG2 PRO 21 -2.005 -12.939 20.327
143 HG3 PRO 21 HG3 PRO 21 -0.983 -13.331 18.909
144 HD2 PRO 21 HD2 PRO 21 -2.508 -10.774 19.476
145 HD3 PRO 21 HD3 PRO 21 -0.809 -10.974 18.944
146 H GLY 22 H GLY 22 -3.877 -13.556 14.977
147 HA2 GLY 22 HA2 GLY 22 -5.925 -13.440 13.802
148 HA3 GLY 22 HA3 GLY 22 -6.555 -12.270 14.967
149 H GLN 23 H GLN 23 -4.190 -12.718 12.341
150 HA GLN 23 HA GLN 23 -3.264 -10.105 12.187
151 HB2 GLN 23 HB2 GLN 23 -3.421 -12.204 10.009
152 HB3 GLN 23 HB3 GLN 23 -2.575 -10.665 9.827
153 HG2 GLN 23 HG2 GLN 23 -1.073 -11.232 11.703
154 HG3 GLN 23 HG3 GLN 23 -1.924 -12.767 11.931
155 HE21 GLN 23 HE21 GLN 23 -2.032 -14.227 9.933
156 HE22 GLN 23 HE22 GLN 23 -0.653 -14.222 8.847
157 HA PRO 24 HA PRO 24 -6.248 -8.690 8.827
158 HB2 PRO 24 HB2 PRO 24 -8.531 -9.984 8.121
159 HB3 PRO 24 HB3 PRO 24 -6.922 -10.418 7.475
160 HG2 PRO 24 HG2 PRO 24 -8.420 -11.730 9.767
161 HG3 PRO 24 HG3 PRO 24 -7.610 -12.516 8.377
162 HD2 PRO 24 HD2 PRO 24 -6.418 -12.249 10.818
163 HD3 PRO 24 HD3 PRO 24 -5.488 -12.166 9.291
164 H GLY 25 H GLY 25 -6.743 -6.967 10.106
165 HA2 GLY 25 HA2 GLY 25 -9.070 -7.019 11.978
166 HA3 GLY 25 HA3 GLY 25 -7.949 -5.684 11.728
167 H ILE 26 H ILE 26 -8.158 -4.383 9.876
168 HA ILE 26 HA ILE 26 -10.630 -4.654 8.178
169 HB ILE 26 HB ILE 26 -8.733 -2.337 8.659
170 HG12 ILE 26 HG12 ILE 26 -11.768 -2.605 8.835
171 HG13 ILE 26 HG13 ILE 26 -10.663 -2.675 10.208
172 HG21 ILE 26 HG21 ILE 26 -9.031 -2.455 6.219
173 HG22 ILE 26 HG22 ILE 26 -10.796 -2.575 6.427
174 HG23 ILE 26 HG23 ILE 26 -9.916 -1.095 6.866
175 HD11 ILE 26 HD11 ILE 26 -9.936 -0.331 9.734
176 HD12 ILE 26 HD12 ILE 26 -11.167 -0.241 8.446
177 HD13 ILE 26 HD13 ILE 26 -11.665 -0.486 10.114
178 H GLY 27 H GLY 27 -7.079 -4.398 8.106
179 HA2 GLY 27 HA2 GLY 27 -7.038 -6.099 5.661
180 HA3 GLY 27 HA3 GLY 27 -5.898 -4.779 5.902
181 HA PRO 28 HA PRO 28 -4.233 -8.787 7.927
182 HB2 PRO 28 HB2 PRO 28 -2.581 -8.917 5.409
183 HB3 PRO 28 HB3 PRO 28 -3.257 -10.254 6.391
184 HG2 PRO 28 HG2 PRO 28 -4.420 -9.563 4.056
185 HG3 PRO 28 HG3 PRO 28 -5.458 -9.868 5.491
186 HD2 PRO 28 HD2 PRO 28 -4.407 -7.216 4.457
187 HD3 PRO 28 HD3 PRO 28 -6.097 -7.683 4.814
188 H ASP 29 H ASP 29 -1.496 -9.217 7.519
189 HA ASP 29 HA ASP 29 -0.144 -6.799 8.591
190 HB2 ASP 29 HB2 ASP 29 0.136 -9.146 9.549
191 HB3 ASP 29 HB3 ASP 29 0.911 -9.608 8.039
192 H LEU 30 H LEU 30 1.210 -5.550 7.247
193 HA LEU 30 HA LEU 30 1.182 -6.233 4.359
194 HB2 LEU 30 HB2 LEU 30 2.468 -3.780 5.488
195 HB3 LEU 30 HB3 LEU 30 1.852 -4.067 3.873
196 HG LEU 30 HG LEU 30 0.223 -3.669 6.407
197 HD11 LEU 30 HD11 LEU 30 1.223 -1.633 5.360
198 HD12 LEU 30 HD12 LEU 30 -0.547 -1.632 5.285
199 HD13 LEU 30 HD13 LEU 30 0.405 -2.031 3.834
200 HD21 LEU 30 HD21 LEU 30 -1.787 -3.707 4.911
201 HD22 LEU 30 HD22 LEU 30 -0.996 -5.271 4.955
202 HD23 LEU 30 HD23 LEU 30 -0.762 -4.213 3.553
203 H LEU 31 H LEU 31 3.311 -7.005 6.864
204 HA LEU 31 HA LEU 31 5.868 -6.653 5.625
205 HB2 LEU 31 HB2 LEU 31 5.399 -7.077 7.944
206 HB3 LEU 31 HB3 LEU 31 5.041 -8.762 7.575
207 HG LEU 31 HG LEU 31 7.691 -7.440 6.830
208 HD11 LEU 31 HD11 LEU 31 8.580 -8.279 8.979
209 HD12 LEU 31 HD12 LEU 31 6.932 -8.775 9.444
210 HD13 LEU 31 HD13 LEU 31 7.311 -7.057 9.181
211 HD21 LEU 31 HD21 LEU 31 6.981 -10.339 7.457
212 HD22 LEU 31 HD22 LEU 31 8.607 -9.740 7.112
213 HD23 LEU 31 HD23 LEU 31 7.377 -9.696 5.855
214 H GLY 32 H GLY 32 6.876 -7.670 4.174
215 HA2 GLY 32 HA2 GLY 32 7.502 -9.155 2.489
216 HA3 GLY 32 HA3 GLY 32 6.354 -10.325 3.134
217 H VAL 33 H VAL 33 4.512 -7.527 2.437
218 HA VAL 33 HA VAL 33 3.180 -8.763 0.296
219 HB VAL 33 HB VAL 33 2.294 -6.925 1.715
220 HG11 VAL 33 HG11 VAL 33 3.618 -5.024 -0.266
221 HG12 VAL 33 HG12 VAL 33 2.576 -4.620 1.111
222 HG13 VAL 33 HG13 VAL 33 4.186 -5.290 1.401
223 HG21 VAL 33 HG21 VAL 33 1.102 -7.754 -0.273
224 HG22 VAL 33 HG22 VAL 33 0.812 -6.034 0.003
225 HG23 VAL 33 HG23 VAL 33 1.926 -6.543 -1.284
226 H THR 34 H THR 34 5.919 -6.569 0.141
227 HA THR 34 HA THR 34 6.068 -6.219 -2.694
228 HB THR 34 HB THR 34 7.071 -4.831 -0.837
229 HG1 THR 34 HG1 THR 34 8.541 -4.030 -2.096
230 HG21 THR 34 HG21 THR 34 9.360 -6.840 -0.985
231 HG22 THR 34 HG22 THR 34 8.273 -6.610 0.403
232 HG23 THR 34 HG23 THR 34 9.340 -5.300 -0.111
233 H ARG 35 H ARG 35 6.514 -9.101 -1.027
234 HA ARG 35 HA ARG 35 7.723 -10.258 -3.473
235 HB2 ARG 35 HB2 ARG 35 8.991 -11.885 -2.290
236 HB3 ARG 35 HB3 ARG 35 9.468 -10.269 -1.773
237 HG2 ARG 35 HG2 ARG 35 8.258 -10.519 0.336
238 HG3 ARG 35 HG3 ARG 35 7.572 -12.074 -0.195
239 HD2 ARG 35 HD2 ARG 35 9.891 -12.988 -0.375
240 HD3 ARG 35 HD3 ARG 35 10.522 -11.461 0.271
241 HE ARG 35 HE ARG 35 8.631 -12.284 2.120
242 HH11 ARG 35 HH11 ARG 35 11.601 -13.735 0.780
243 HH12 ARG 35 HH12 ARG 35 11.914 -14.679 2.220
244 HH21 ARG 35 HH21 ARG 35 9.076 -13.533 3.966
245 HH22 ARG 35 HH22 ARG 35 10.489 -14.562 4.018
246 H GLN 36 H GLN 36 4.885 -9.989 -2.070
247 HA GLN 36 HA GLN 36 4.021 -12.773 -2.641
248 HB2 GLN 36 HB2 GLN 36 4.120 -12.204 -0.234
249 HB3 GLN 36 HB3 GLN 36 3.060 -10.808 -0.513
250 HG2 GLN 36 HG2 GLN 36 1.298 -12.252 -1.294
251 HG3 GLN 36 HG3 GLN 36 2.345 -13.674 -1.166
252 HE21 GLN 36 HE21 GLN 36 0.185 -14.236 0.007
253 HE22 GLN 36 HE22 GLN 36 0.097 -13.858 1.726
254 H ARG 37 H ARG 37 3.270 -9.300 -3.094
255 HA ARG 37 HA ARG 37 1.313 -10.055 -5.176
256 HB2 ARG 37 HB2 ARG 37 0.085 -9.746 -3.051
257 HB3 ARG 37 HB3 ARG 37 0.603 -8.052 -2.999
258 HG2 ARG 37 HG2 ARG 37 -0.766 -7.463 -4.822
259 HG3 ARG 37 HG3 ARG 37 -0.727 -9.083 -5.521
260 HD2 ARG 37 HD2 ARG 37 -2.953 -8.548 -4.642
261 HD3 ARG 37 HD3 ARG 37 -2.228 -9.948 -3.846
262 HE ARG 37 HE ARG 37 -2.081 -7.229 -2.634
263 HH11 ARG 37 HH11 ARG 37 -3.171 -10.607 -2.327
264 HH12 ARG 37 HH12 ARG 37 -3.646 -10.406 -0.657
265 HH21 ARG 37 HH21 ARG 37 -2.715 -7.005 -0.495
266 HH22 ARG 37 HH22 ARG 37 -3.392 -8.357 0.383
267 H ASP 38 H ASP 38 3.267 -9.599 -6.287
268 HA ASP 38 HA ASP 38 4.716 -8.465 -7.536
269 HB2 ASP 38 HB2 ASP 38 2.440 -7.698 -8.488
270 HB3 ASP 38 HB3 ASP 38 2.802 -6.153 -7.715
271 H ALA 39 H ALA 39 5.427 -5.796 -7.833
272 HA ALA 39 HA ALA 39 6.234 -4.700 -5.220
273 HB1 ALA 39 HB1 ALA 39 8.297 -5.581 -7.286
274 HB2 ALA 39 HB2 ALA 39 8.621 -4.775 -5.741
275 HB3 ALA 39 HB3 ALA 39 7.961 -6.420 -5.750
276 H ASN 40 H ASN 40 5.731 -4.290 -8.689
277 HA ASN 40 HA ASN 40 6.480 -1.406 -8.540
278 HB2 ASN 40 HB2 ASN 40 6.529 -3.462 -10.780
279 HB3 ASN 40 HB3 ASN 40 6.530 -1.726 -11.095
280 HD21 ASN 40 HD21 ASN 40 8.350 -0.499 -10.669
281 HD22 ASN 40 HD22 ASN 40 9.819 -1.133 -9.949
282 H TRP 41 H TRP 41 3.926 -3.683 -9.655
283 HA TRP 41 HA TRP 41 1.846 -1.816 -10.250
284 HB2 TRP 41 HB2 TRP 41 1.512 -4.177 -10.649
285 HB3 TRP 41 HB3 TRP 41 1.936 -4.579 -9.003
286 HD1 TRP 41 HD1 TRP 41 -1.011 -3.270 -11.044
287 HE1 TRP 41 HE1 TRP 41 -3.156 -3.537 -9.695
288 HE3 TRP 41 HE3 TRP 41 1.026 -4.714 -6.539
289 HZ2 TRP 41 HZ2 TRP 41 -3.861 -3.824 -6.868
290 HZ3 TRP 41 HZ3 TRP 41 -0.403 -4.829 -4.511
291 HH2 TRP 41 HH2 TRP 41 -2.810 -4.360 -4.660
292 H LEU 42 H LEU 42 2.983 -3.159 -7.200
293 HA LEU 42 HA LEU 42 1.238 -2.208 -5.301
294 HB2 LEU 42 HB2 LEU 42 3.140 -3.767 -4.996
295 HB3 LEU 42 HB3 LEU 42 4.283 -2.452 -5.264
296 HG LEU 42 HG LEU 42 3.557 -1.367 -3.159
297 HD11 LEU 42 HD11 LEU 42 1.244 -2.170 -2.977
298 HD12 LEU 42 HD12 LEU 42 2.167 -2.698 -1.562
299 HD13 LEU 42 HD13 LEU 42 1.809 -3.852 -2.864
300 HD21 LEU 42 HD21 LEU 42 5.442 -2.975 -3.197
301 HD22 LEU 42 HD22 LEU 42 4.314 -4.310 -2.876
302 HD23 LEU 42 HD23 LEU 42 4.571 -3.038 -1.659
303 H VAL 43 H VAL 43 3.910 -0.387 -6.804
304 HA VAL 43 HA VAL 43 3.588 1.909 -5.058
305 HB VAL 43 HB VAL 43 5.254 1.929 -7.584
306 HG11 VAL 43 HG11 VAL 43 5.586 3.173 -4.812
307 HG12 VAL 43 HG12 VAL 43 6.752 3.320 -6.147
308 HG13 VAL 43 HG13 VAL 43 5.145 4.028 -6.286
309 HG21 VAL 43 HG21 VAL 43 5.940 0.514 -4.976
310 HG22 VAL 43 HG22 VAL 43 5.926 -0.153 -6.621
311 HG23 VAL 43 HG23 VAL 43 7.155 1.024 -6.174
312 H ARG 44 H ARG 44 2.292 0.999 -8.150
313 HA ARG 44 HA ARG 44 1.256 3.677 -8.805
314 HB2 ARG 44 HB2 ARG 44 1.749 1.900 -10.509
315 HB3 ARG 44 HB3 ARG 44 0.400 0.956 -9.865
316 HG2 ARG 44 HG2 ARG 44 -1.138 2.874 -10.415
317 HG3 ARG 44 HG3 ARG 44 0.247 3.733 -11.122
318 HD2 ARG 44 HD2 ARG 44 0.588 1.799 -12.693
319 HD3 ARG 44 HD3 ARG 44 -0.835 1.019 -12.008
320 HE ARG 44 HE ARG 44 -2.244 2.545 -13.070
321 HH11 ARG 44 HH11 ARG 44 1.152 3.432 -13.718
322 HH12 ARG 44 HH12 ARG 44 0.728 4.479 -15.053
323 HH21 ARG 44 HH21 ARG 44 -2.740 3.897 -14.800
324 HH22 ARG 44 HH22 ARG 44 -1.476 4.743 -15.665
325 H TRP 45 H TRP 45 -0.061 0.589 -7.580
326 HA TRP 45 HA TRP 45 -2.708 1.311 -7.099
327 HB2 TRP 45 HB2 TRP 45 -2.034 -0.971 -6.996
328 HB3 TRP 45 HB3 TRP 45 -0.837 -0.650 -5.752
329 HD1 TRP 45 HD1 TRP 45 -1.496 -1.608 -3.557
330 HE1 TRP 45 HE1 TRP 45 -3.668 -2.223 -2.346
331 HE3 TRP 45 HE3 TRP 45 -4.886 0.471 -6.802
332 HZ2 TRP 45 HZ2 TRP 45 -6.465 -1.529 -2.527
333 HZ3 TRP 45 HZ3 TRP 45 -7.296 0.561 -6.201
334 HH2 TRP 45 HH2 TRP 45 -8.098 -0.440 -4.085
335 H LEU 46 H LEU 46 -0.132 1.400 -4.547
336 HA LEU 46 HA LEU 46 -1.988 2.486 -2.685
337 HB2 LEU 46 HB2 LEU 46 -0.454 2.038 -1.158
338 HB3 LEU 46 HB3 LEU 46 0.378 1.198 -2.469
339 HG LEU 46 HG LEU 46 1.042 4.030 -1.516
340 HD11 LEU 46 HD11 LEU 46 1.618 2.287 0.127
341 HD12 LEU 46 HD12 LEU 46 3.072 2.917 -0.643
342 HD13 LEU 46 HD13 LEU 46 2.418 1.333 -1.136
343 HD21 LEU 46 HD21 LEU 46 1.606 3.553 -3.950
344 HD22 LEU 46 HD22 LEU 46 2.443 2.102 -3.388
345 HD23 LEU 46 HD23 LEU 46 3.041 3.712 -2.933
346 H LYS 47 H LYS 47 -0.474 4.108 -5.177
347 HA LYS 47 HA LYS 47 -0.428 6.782 -3.884
348 HB2 LYS 47 HB2 LYS 47 1.525 5.868 -5.193
349 HB3 LYS 47 HB3 LYS 47 0.500 5.833 -6.629
350 HG2 LYS 47 HG2 LYS 47 0.254 8.279 -6.540
351 HG3 LYS 47 HG3 LYS 47 1.148 8.338 -5.014
352 HD2 LYS 47 HD2 LYS 47 2.530 9.041 -6.900
353 HD3 LYS 47 HD3 LYS 47 3.190 7.569 -6.168
354 HE2 LYS 47 HE2 LYS 47 2.261 6.199 -7.968
355 HE3 LYS 47 HE3 LYS 47 1.391 7.589 -8.631
356 HZ1 LYS 47 HZ1 LYS 47 3.471 8.619 -9.179
357 HZ2 LYS 47 HZ2 LYS 47 3.451 7.123 -9.830
358 HZ3 LYS 47 HZ3 LYS 47 4.347 7.412 -8.471
359 H VAL 48 H VAL 48 -2.398 4.882 -6.060
360 HA VAL 48 HA VAL 48 -4.261 7.163 -6.355
361 HB VAL 48 HB VAL 48 -2.423 7.070 -8.174
362 HG11 VAL 48 HG11 VAL 48 -4.206 5.216 -9.702
363 HG12 VAL 48 HG12 VAL 48 -2.556 5.752 -10.039
364 HG13 VAL 48 HG13 VAL 48 -2.853 4.577 -8.742
365 HG21 VAL 48 HG21 VAL 48 -4.248 8.582 -8.254
366 HG22 VAL 48 HG22 VAL 48 -3.937 7.936 -9.874
367 HG23 VAL 48 HG23 VAL 48 -5.308 7.329 -8.920
368 HA PRO 49 HA PRO 49 -5.994 2.848 -5.728
369 HB2 PRO 49 HB2 PRO 49 -7.010 2.964 -3.189
370 HB3 PRO 49 HB3 PRO 49 -5.276 2.715 -3.541
371 HG2 PRO 49 HG2 PRO 49 -6.680 5.364 -2.977
372 HG3 PRO 49 HG3 PRO 49 -5.257 4.672 -2.118
373 HD2 PRO 49 HD2 PRO 49 -4.859 6.410 -4.123
374 HD3 PRO 49 HD3 PRO 49 -3.873 4.931 -4.011
375 H ASP 50 H ASP 50 -7.522 5.780 -6.259
376 HA ASP 50 HA ASP 50 -10.214 4.432 -6.334
377 HB2 ASP 50 HB2 ASP 50 -10.304 6.531 -5.122
378 HB3 ASP 50 HB3 ASP 50 -9.505 7.377 -6.446
379 H GLN 51 H GLN 51 -7.913 6.384 -8.277
380 HA GLN 51 HA GLN 51 -9.377 6.143 -10.701
381 HB2 GLN 51 HB2 GLN 51 -7.451 7.723 -9.920
382 HB3 GLN 51 HB3 GLN 51 -6.379 6.476 -10.592
383 HG2 GLN 51 HG2 GLN 51 -7.311 6.803 -12.806
384 HG3 GLN 51 HG3 GLN 51 -8.598 7.844 -12.165
385 HE21 GLN 51 HE21 GLN 51 -5.150 7.706 -12.991
386 HE22 GLN 51 HE22 GLN 51 -4.860 9.427 -12.682
387 H MET 52 H MET 52 -6.909 3.956 -9.295
388 HA MET 52 HA MET 52 -6.514 2.239 -11.521
389 HB2 MET 52 HB2 MET 52 -6.614 1.808 -8.500
390 HB3 MET 52 HB3 MET 52 -6.171 0.502 -9.610
391 HG2 MET 52 HG2 MET 52 -4.777 3.184 -9.647
392 HG3 MET 52 HG3 MET 52 -4.280 1.916 -8.544
393 HE1 MET 52 HE1 MET 52 -2.623 -0.744 -10.650
394 HE2 MET 52 HE2 MET 52 -2.664 0.091 -9.085
395 HE3 MET 52 HE3 MET 52 -4.130 -0.703 -9.700
396 H LEU 53 H LEU 53 -9.233 2.348 -9.203
397 HA LEU 53 HA LEU 53 -10.472 -0.083 -10.252
398 HB2 LEU 53 HB2 LEU 53 -11.513 2.052 -8.352
399 HB3 LEU 53 HB3 LEU 53 -12.326 0.531 -8.700
400 HG LEU 53 HG LEU 53 -9.558 0.733 -7.443
401 HD11 LEU 53 HD11 LEU 53 -10.678 0.158 -5.328
402 HD12 LEU 53 HD12 LEU 53 -12.259 0.236 -6.138
403 HD13 LEU 53 HD13 LEU 53 -11.265 1.700 -5.967
404 HD21 LEU 53 HD21 LEU 53 -11.463 -1.614 -7.729
405 HD22 LEU 53 HD22 LEU 53 -9.961 -1.621 -6.780
406 HD23 LEU 53 HD23 LEU 53 -9.892 -1.426 -8.537
407 H ALA 54 H ALA 54 -10.549 3.293 -11.068
408 HA ALA 54 HA ALA 54 -12.908 3.054 -12.804
409 HB1 ALA 54 HB1 ALA 54 -10.751 5.198 -12.672
410 HB2 ALA 54 HB2 ALA 54 -12.279 5.275 -13.564
411 HB3 ALA 54 HB3 ALA 54 -12.296 5.219 -11.792
412 H GLU 55 H GLU 55 -9.311 3.145 -13.271
413 HA GLU 55 HA GLU 55 -9.486 3.063 -16.046
414 HB2 GLU 55 HB2 GLU 55 -7.206 3.010 -16.139
415 HB3 GLU 55 HB3 GLU 55 -7.542 3.783 -14.608
416 HG2 GLU 55 HG2 GLU 55 -6.950 1.604 -13.490
417 HG3 GLU 55 HG3 GLU 55 -6.601 0.917 -15.070
418 H LYS 56 H LYS 56 -8.851 0.269 -13.964
419 HA LYS 56 HA LYS 56 -10.577 -1.524 -14.968
420 HB2 LYS 56 HB2 LYS 56 -9.398 -3.099 -16.458
421 HB3 LYS 56 HB3 LYS 56 -9.661 -1.571 -17.229
422 HG2 LYS 56 HG2 LYS 56 -7.232 -0.968 -16.709
423 HG3 LYS 56 HG3 LYS 56 -7.021 -2.612 -16.084
424 HD2 LYS 56 HD2 LYS 56 -7.671 -3.571 -18.243
425 HD3 LYS 56 HD3 LYS 56 -8.003 -1.972 -18.906
426 HE2 LYS 56 HE2 LYS 56 -5.264 -2.982 -18.009
427 HE3 LYS 56 HE3 LYS 56 -5.870 -2.926 -19.667
428 HZ1 LYS 56 HZ1 LYS 56 -6.188 -0.426 -19.197
429 HZ2 LYS 56 HZ2 LYS 56 -4.674 -0.988 -19.505
430 HZ3 LYS 56 HZ3 LYS 56 -5.143 -0.658 -17.950
431 H ASP 57 H ASP 57 -7.547 -0.996 -13.548
432 HA ASP 57 HA ASP 57 -6.142 -3.158 -13.623
433 HB2 ASP 57 HB2 ASP 57 -5.594 -0.959 -12.482
434 HB3 ASP 57 HB3 ASP 57 -6.179 -1.691 -10.980
435 HA PRO 58 HA PRO 58 -9.242 -5.704 -12.119
436 HB2 PRO 58 HB2 PRO 58 -8.621 -8.048 -13.323
437 HB3 PRO 58 HB3 PRO 58 -8.967 -6.505 -14.206
438 HG2 PRO 58 HG2 PRO 58 -6.170 -7.457 -13.470
439 HG3 PRO 58 HG3 PRO 58 -6.829 -7.229 -15.134
440 HD2 PRO 58 HD2 PRO 58 -5.569 -5.257 -13.861
441 HD3 PRO 58 HD3 PRO 58 -7.105 -4.896 -14.713
442 H LEU 59 H LEU 59 -5.956 -6.460 -11.329
443 HA LEU 59 HA LEU 59 -6.328 -8.339 -9.162
444 HB2 LEU 59 HB2 LEU 59 -4.154 -7.906 -10.224
445 HB3 LEU 59 HB3 LEU 59 -4.212 -6.215 -9.715
446 HG LEU 59 HG LEU 59 -4.000 -6.865 -7.356
447 HD11 LEU 59 HD11 LEU 59 -3.437 -9.220 -6.769
448 HD12 LEU 59 HD12 LEU 59 -3.818 -9.712 -8.425
449 HD13 LEU 59 HD13 LEU 59 -5.095 -9.075 -7.361
450 HD21 LEU 59 HD21 LEU 59 -1.699 -7.652 -7.441
451 HD22 LEU 59 HD22 LEU 59 -1.977 -6.519 -8.765
452 HD23 LEU 59 HD23 LEU 59 -1.924 -8.264 -9.099
453 H ALA 60 H ALA 60 -6.427 -4.724 -9.319
454 HA ALA 60 HA ALA 60 -6.967 -4.500 -6.462
455 HB1 ALA 60 HB1 ALA 60 -5.845 -2.705 -7.672
456 HB2 ALA 60 HB2 ALA 60 -7.309 -2.457 -8.667
457 HB3 ALA 60 HB3 ALA 60 -7.365 -2.186 -6.911
458 H MET 61 H MET 61 -8.973 -4.403 -9.453
459 HA MET 61 HA MET 61 -11.501 -3.952 -8.307
460 HB2 MET 61 HB2 MET 61 -10.820 -5.855 -10.581
461 HB3 MET 61 HB3 MET 61 -12.414 -5.200 -10.236
462 HG2 MET 61 HG2 MET 61 -9.980 -3.542 -10.992
463 HG3 MET 61 HG3 MET 61 -11.242 -4.043 -12.096
464 HE1 MET 61 HE1 MET 61 -13.305 -3.013 -12.471
465 HE2 MET 61 HE2 MET 61 -13.932 -3.589 -10.911
466 HE3 MET 61 HE3 MET 61 -14.192 -1.888 -11.391
467 H LEU 62 H LEU 62 -9.650 -6.990 -8.407
468 HA LEU 62 HA LEU 62 -11.624 -8.627 -7.097
469 HB2 LEU 62 HB2 LEU 62 -9.808 -9.413 -8.631
470 HB3 LEU 62 HB3 LEU 62 -8.624 -8.832 -7.454
471 HG LEU 62 HG LEU 62 -9.516 -10.432 -5.788
472 HD11 LEU 62 HD11 LEU 62 -11.798 -10.805 -6.624
473 HD12 LEU 62 HD12 LEU 62 -10.926 -12.341 -6.592
474 HD13 LEU 62 HD13 LEU 62 -11.165 -11.479 -8.138
475 HD21 LEU 62 HD21 LEU 62 -8.532 -12.452 -6.854
476 HD22 LEU 62 HD22 LEU 62 -7.567 -10.994 -7.125
477 HD23 LEU 62 HD23 LEU 62 -8.587 -11.611 -8.433
478 H LEU 63 H LEU 63 -8.515 -7.021 -5.972
479 HA LEU 63 HA LEU 63 -8.821 -8.267 -3.385
480 HB2 LEU 63 HB2 LEU 63 -6.770 -7.535 -2.885
481 HB3 LEU 63 HB3 LEU 63 -6.702 -7.586 -4.622
482 HG LEU 63 HG LEU 63 -7.366 -4.991 -4.404
483 HD11 LEU 63 HD11 LEU 63 -5.989 -5.607 -1.752
484 HD12 LEU 63 HD12 LEU 63 -7.650 -5.013 -1.939
485 HD13 LEU 63 HD13 LEU 63 -6.286 -3.988 -2.406
486 HD21 LEU 63 HD21 LEU 63 -4.584 -6.014 -3.722
487 HD22 LEU 63 HD22 LEU 63 -5.010 -4.422 -4.393
488 HD23 LEU 63 HD23 LEU 63 -5.259 -5.889 -5.361
489 H PHE 64 H PHE 64 -9.768 -5.111 -4.620
490 HA PHE 64 HA PHE 64 -10.215 -4.028 -1.961
491 HB2 PHE 64 HB2 PHE 64 -10.536 -2.092 -2.944
492 HB3 PHE 64 HB3 PHE 64 -9.992 -2.849 -4.409
493 HD1 PHE 64 HD2 PHE 64 -11.891 -3.884 -5.965
494 HD2 PHE 64 HD1 PHE 64 -12.629 -1.056 -2.810
495 HE1 PHE 64 HE2 PHE 64 -14.035 -3.239 -7.039
496 HE2 PHE 64 HE1 PHE 64 -14.729 -0.363 -3.898
497 HZ PHE 64 HZ PHE 64 -15.453 -1.466 -6.021
498 H GLU 65 H GLU 65 -12.331 -5.731 -4.266
499 HA GLU 65 HA GLU 65 -14.770 -5.565 -2.756
500 HB2 GLU 65 HB2 GLU 65 -14.723 -5.924 -5.146
501 HB3 GLU 65 HB3 GLU 65 -13.573 -7.242 -4.984
502 HG2 GLU 65 HG2 GLU 65 -15.489 -8.313 -5.492
503 HG3 GLU 65 HG3 GLU 65 -15.365 -8.544 -3.760
504 H GLN 66 H GLN 66 -12.154 -8.048 -3.064
505 HA GLN 66 HA GLN 66 -13.501 -9.846 -1.268
506 HB2 GLN 66 HB2 GLN 66 -10.723 -9.856 -2.484
507 HB3 GLN 66 HB3 GLN 66 -11.371 -11.198 -1.540
508 HG2 GLN 66 HG2 GLN 66 -12.755 -10.147 -4.056
509 HG3 GLN 66 HG3 GLN 66 -11.523 -11.395 -4.072
510 HE21 GLN 66 HE21 GLN 66 -12.139 -13.512 -3.681
511 HE22 GLN 66 HE22 GLN 66 -13.753 -13.952 -3.100
512 H TYR 67 H TYR 67 -11.171 -7.308 -0.591
513 HA TYR 67 HA TYR 67 -11.214 -8.113 2.273
514 HB2 TYR 67 HB2 TYR 67 -9.768 -5.828 0.930
515 HB3 TYR 67 HB3 TYR 67 -9.717 -6.205 2.644
516 HD1 TYR 67 HD1 TYR 67 -9.016 -8.768 3.220
517 HD2 TYR 67 HD2 TYR 67 -7.939 -6.581 -0.327
518 HE1 TYR 67 HE1 TYR 67 -7.016 -10.218 2.928
519 HE2 TYR 67 HE2 TYR 67 -5.958 -8.046 -0.638
520 HH TYR 67 HH TYR 67 -5.170 -10.716 1.606
521 H ASN 68 H ASN 68 -13.675 -7.594 1.029
522 HA ASN 68 HA ASN 68 -15.655 -6.881 1.597
523 HB2 ASN 68 HB2 ASN 68 -14.676 -7.413 3.859
524 HB3 ASN 68 HB3 ASN 68 -14.497 -5.674 4.103
525 HD21 ASN 68 HD21 ASN 68 -15.882 -6.305 5.969
526 HD22 ASN 68 HD22 ASN 68 -17.637 -6.268 5.698
527 H ARG 69 H ARG 69 -14.291 -5.166 -0.147
528 HA ARG 69 HA ARG 69 -14.560 -3.261 -1.296
529 HB2 ARG 69 HB2 ARG 69 -16.689 -4.718 -1.409
530 HB3 ARG 69 HB3 ARG 69 -17.476 -3.348 -0.616
531 HG2 ARG 69 HG2 ARG 69 -16.802 -1.875 -2.496
532 HG3 ARG 69 HG3 ARG 69 -15.798 -3.166 -3.169
533 HD2 ARG 69 HD2 ARG 69 -17.836 -2.958 -4.447
534 HD3 ARG 69 HD3 ARG 69 -17.778 -4.517 -3.632
535 HE ARG 69 HE ARG 69 -19.279 -2.250 -2.404
536 HH11 ARG 69 HH11 ARG 69 -19.408 -5.477 -3.915
537 HH12 ARG 69 HH12 ARG 69 -21.090 -5.715 -3.497
538 HH21 ARG 69 HH21 ARG 69 -21.434 -2.589 -1.899
539 HH22 ARG 69 HH22 ARG 69 -22.241 -4.072 -2.352
540 H LEU 70 H LEU 70 -13.883 -2.595 1.470
541 HA LEU 70 HA LEU 70 -15.001 0.003 2.041
542 HB2 LEU 70 HB2 LEU 70 -13.840 -1.487 3.673
543 HB3 LEU 70 HB3 LEU 70 -12.330 -1.270 2.792
544 HG LEU 70 HG LEU 70 -12.273 1.117 3.399
545 HD11 LEU 70 HD11 LEU 70 -14.656 1.677 3.535
546 HD12 LEU 70 HD12 LEU 70 -13.882 2.003 5.088
547 HD13 LEU 70 HD13 LEU 70 -14.873 0.541 4.885
548 HD21 LEU 70 HD21 LEU 70 -12.799 -0.744 5.747
549 HD22 LEU 70 HD22 LEU 70 -11.945 0.806 5.829
550 HD23 LEU 70 HD23 LEU 70 -11.257 -0.526 4.881
551 H ALA 71 H ALA 71 -12.610 -1.096 -0.197
552 HA ALA 71 HA ALA 71 -10.980 -0.191 -1.461
553 HB1 ALA 71 HB1 ALA 71 -12.357 2.506 -1.280
554 HB2 ALA 71 HB2 ALA 71 -11.296 1.879 -2.559
555 HB3 ALA 71 HB3 ALA 71 -12.913 1.204 -2.344
556 H MET 72 H MET 72 -9.704 2.389 -1.272
557 HA MET 72 HA MET 72 -9.424 3.112 1.460
558 HB2 MET 72 HB2 MET 72 -7.041 2.952 1.759
559 HB3 MET 72 HB3 MET 72 -7.707 1.358 1.452
560 HG2 MET 72 HG2 MET 72 -6.859 1.444 -0.867
561 HG3 MET 72 HG3 MET 72 -6.213 3.066 -0.562
562 HE1 MET 72 HE1 MET 72 -2.922 0.991 -0.694
563 HE2 MET 72 HE2 MET 72 -4.377 0.860 -1.709
564 HE3 MET 72 HE3 MET 72 -3.769 2.461 -1.230
565 HA PRO 73 HA PRO 73 -9.138 6.914 -0.616
566 HB2 PRO 73 HB2 PRO 73 -8.229 8.680 1.252
567 HB3 PRO 73 HB3 PRO 73 -9.797 7.834 1.397
568 HG2 PRO 73 HG2 PRO 73 -7.147 7.068 2.658
569 HG3 PRO 73 HG3 PRO 73 -8.754 7.188 3.447
570 HD2 PRO 73 HD2 PRO 73 -7.734 4.820 2.584
571 HD3 PRO 73 HD3 PRO 73 -9.484 5.176 2.476
572 H ASN 74 H ASN 74 -7.941 8.070 -1.979
573 HA ASN 74 HA ASN 74 -4.998 8.485 -1.673
574 HB2 ASN 74 HB2 ASN 74 -6.072 8.155 -3.943
575 HB3 ASN 74 HB3 ASN 74 -7.107 9.522 -3.630
576 HD21 ASN 74 HD21 ASN 74 -6.222 10.165 -5.678
577 HD22 ASN 74 HD22 ASN 74 -4.654 10.949 -5.775
578 H MET 75 H MET 75 -4.181 10.260 -0.889
579 HA MET 75 HA MET 75 -5.954 12.402 0.208
580 HB2 MET 75 HB2 MET 75 -3.560 11.156 1.615
581 HB3 MET 75 HB3 MET 75 -4.430 12.599 2.147
582 HG2 MET 75 HG2 MET 75 -5.597 9.796 1.923
583 HG3 MET 75 HG3 MET 75 -5.056 10.597 3.395
584 HE1 MET 75 HE1 MET 75 -7.655 9.364 3.724
585 HE2 MET 75 HE2 MET 75 -7.085 10.569 4.892
586 HE3 MET 75 HE3 MET 75 -8.748 10.656 4.270
587 H ARG 76 H ARG 76 -2.496 12.367 0.523
588 HA ARG 76 HA ARG 76 -2.020 14.282 -1.635
589 HB2 ARG 76 HB2 ARG 76 -3.259 15.382 0.420
590 HB3 ARG 76 HB3 ARG 76 -1.720 15.250 1.234
591 HG2 ARG 76 HG2 ARG 76 -1.945 17.475 0.347
592 HG3 ARG 76 HG3 ARG 76 -0.693 16.673 -0.591
593 HD2 ARG 76 HD2 ARG 76 -2.095 17.960 -2.072
594 HD3 ARG 76 HD3 ARG 76 -2.345 16.247 -2.411
595 HE ARG 76 HE ARG 76 -4.204 17.627 -0.547
596 HH11 ARG 76 HH11 ARG 76 -3.744 16.211 -3.794
597 HH12 ARG 76 HH12 ARG 76 -5.458 16.189 -4.133
598 HH21 ARG 76 HH21 ARG 76 -6.406 17.578 -1.037
599 HH22 ARG 76 HH22 ARG 76 -6.961 16.958 -2.577
600 H LEU 77 H LEU 77 -0.680 11.819 -1.130
601 HA LEU 77 HA LEU 77 1.592 12.162 0.659
602 HB2 LEU 77 HB2 LEU 77 0.903 10.052 -1.424
603 HB3 LEU 77 HB3 LEU 77 2.373 10.006 -0.478
604 HG LEU 77 HG LEU 77 0.685 8.472 0.347
605 HD11 LEU 77 HD11 LEU 77 0.844 8.991 2.719
606 HD12 LEU 77 HD12 LEU 77 1.276 10.676 2.358
607 HD13 LEU 77 HD13 LEU 77 2.370 9.351 1.899
608 HD21 LEU 77 HD21 LEU 77 -0.961 10.852 1.264
609 HD22 LEU 77 HD22 LEU 77 -1.313 9.135 1.489
610 HD23 LEU 77 HD23 LEU 77 -1.359 9.814 -0.143
611 H GLY 78 H GLY 78 3.590 13.020 0.294
612 HA2 GLY 78 HA2 GLY 78 4.441 14.035 -2.297
613 HA3 GLY 78 HA3 GLY 78 5.411 13.912 -0.835
614 H ASP 79 H ASP 79 6.386 13.312 -3.473
615 HA ASP 79 HA ASP 79 6.370 10.464 -4.039
616 HB2 ASP 79 HB2 ASP 79 6.833 12.168 -5.732
617 HB3 ASP 79 HB3 ASP 79 8.244 12.718 -4.829
618 H ALA 80 H ALA 80 8.432 12.553 -2.046
619 HA ALA 80 HA ALA 80 10.341 10.509 -1.297
620 HB1 ALA 80 HB1 ALA 80 10.973 12.128 0.436
621 HB2 ALA 80 HB2 ALA 80 10.793 12.931 -1.133
622 HB3 ALA 80 HB3 ALA 80 9.518 13.089 0.099
623 H GLU 81 H GLU 81 7.090 11.365 -0.071
624 HA GLU 81 HA GLU 81 7.327 9.714 2.345
625 HB2 GLU 81 HB2 GLU 81 4.882 10.879 0.948
626 HB3 GLU 81 HB3 GLU 81 4.843 9.956 2.446
627 HG2 GLU 81 HG2 GLU 81 6.209 11.624 3.588
628 HG3 GLU 81 HG3 GLU 81 6.393 12.551 2.093
629 H VAL 82 H VAL 82 5.845 9.317 -0.909
630 HA VAL 82 HA VAL 82 5.045 6.592 -0.601
631 HB VAL 82 HB VAL 82 5.918 8.106 -3.098
632 HG11 VAL 82 HG11 VAL 82 6.064 5.689 -3.560
633 HG12 VAL 82 HG12 VAL 82 4.459 5.443 -2.847
634 HG13 VAL 82 HG13 VAL 82 4.645 6.366 -4.354
635 HG21 VAL 82 HG21 VAL 82 3.148 7.440 -1.991
636 HG22 VAL 82 HG22 VAL 82 3.903 9.047 -2.002
637 HG23 VAL 82 HG23 VAL 82 3.487 8.270 -3.527
638 H SER 83 H SER 83 8.187 7.930 -1.740
639 HA SER 83 HA SER 83 9.382 5.392 -2.302
640 HB2 SER 83 HB2 SER 83 10.794 7.947 -1.443
641 HB3 SER 83 HB3 SER 83 11.512 6.564 -2.286
642 HG SER 83 HG SER 83 9.532 8.387 -3.234
643 H ALA 84 H ALA 84 9.391 7.309 0.752
644 HA ALA 84 HA ALA 84 11.023 5.428 2.197
645 HB1 ALA 84 HB1 ALA 84 10.773 7.769 2.844
646 HB2 ALA 84 HB2 ALA 84 9.037 7.528 3.160
647 HB3 ALA 84 HB3 ALA 84 10.263 6.705 4.158
648 H LEU 85 H LEU 85 7.436 5.776 1.893
649 HA LEU 85 HA LEU 85 6.754 3.613 3.646
650 HB2 LEU 85 HB2 LEU 85 5.362 4.948 1.291
651 HB3 LEU 85 HB3 LEU 85 4.587 3.680 2.227
652 HG LEU 85 HG LEU 85 5.634 6.222 3.551
653 HD11 LEU 85 HD11 LEU 85 2.841 5.635 2.475
654 HD12 LEU 85 HD12 LEU 85 3.972 6.852 1.846
655 HD13 LEU 85 HD13 LEU 85 3.295 7.032 3.471
656 HD21 LEU 85 HD21 LEU 85 3.563 4.148 4.379
657 HD22 LEU 85 HD22 LEU 85 3.995 5.602 5.292
658 HD23 LEU 85 HD23 LEU 85 5.196 4.330 5.070
659 H ILE 86 H ILE 86 7.644 3.593 0.233
660 HA ILE 86 HA ILE 86 7.079 0.757 -0.242
661 HB ILE 86 HB ILE 86 8.216 3.053 -1.745
662 HG12 ILE 86 HG12 ILE 86 7.027 1.976 -3.583
663 HG13 ILE 86 HG13 ILE 86 6.726 0.536 -2.608
664 HG21 ILE 86 HG21 ILE 86 10.206 1.644 -1.935
665 HG22 ILE 86 HG22 ILE 86 9.193 0.267 -2.442
666 HG23 ILE 86 HG23 ILE 86 9.331 1.713 -3.460
667 HD11 ILE 86 HD11 ILE 86 4.732 1.924 -2.782
668 HD12 ILE 86 HD12 ILE 86 5.266 1.870 -1.098
669 HD13 ILE 86 HD13 ILE 86 5.592 3.315 -2.090
670 H SER 87 H SER 87 9.891 2.673 0.744
671 HA SER 87 HA SER 87 11.713 0.450 0.882
672 HB2 SER 87 HB2 SER 87 11.852 3.121 2.331
673 HB3 SER 87 HB3 SER 87 13.169 1.957 2.117
674 HG SER 87 HG SER 87 11.804 3.478 0.135
675 H TYR 88 H TYR 88 9.363 1.790 3.301
676 HA TYR 88 HA TYR 88 10.272 0.225 5.466
677 HB2 TYR 88 HB2 TYR 88 8.406 1.960 5.507
678 HB3 TYR 88 HB3 TYR 88 7.348 0.763 4.813
679 HD1 TYR 88 HD2 TYR 88 9.787 -0.388 7.399
680 HD2 TYR 88 HD1 TYR 88 5.818 1.167 6.715
681 HE1 TYR 88 HE2 TYR 88 9.109 -1.148 9.637
682 HE2 TYR 88 HE1 TYR 88 5.151 0.423 8.996
683 HH TYR 88 HH TYR 88 5.794 -0.684 10.919
684 H LEU 89 H LEU 89 8.027 -0.725 2.877
685 HA LEU 89 HA LEU 89 7.370 -3.305 3.917
686 HB2 LEU 89 HB2 LEU 89 7.277 -2.240 1.064
687 HB3 LEU 89 HB3 LEU 89 6.465 -3.698 1.622
688 HG LEU 89 HG LEU 89 5.858 -0.898 2.664
689 HD11 LEU 89 HD11 LEU 89 5.252 -1.172 0.285
690 HD12 LEU 89 HD12 LEU 89 3.834 -1.009 1.331
691 HD13 LEU 89 HD13 LEU 89 4.294 -2.612 0.706
692 HD21 LEU 89 HD21 LEU 89 3.810 -1.938 3.576
693 HD22 LEU 89 HD22 LEU 89 5.271 -2.603 4.307
694 HD23 LEU 89 HD23 LEU 89 4.403 -3.539 3.074
695 H GLU 90 H GLU 90 10.204 -2.290 2.178
696 HA GLU 90 HA GLU 90 11.027 -5.123 1.729
697 HB2 GLU 90 HB2 GLU 90 11.276 -3.594 -0.170
698 HB3 GLU 90 HB3 GLU 90 12.335 -2.545 0.786
699 HG2 GLU 90 HG2 GLU 90 14.003 -4.329 0.970
700 HG3 GLU 90 HG3 GLU 90 12.892 -5.495 0.242
701 H GLU 91 H GLU 91 12.268 -2.121 3.363
702 HA GLU 91 HA GLU 91 14.609 -3.428 4.316
703 HB2 GLU 91 HB2 GLU 91 13.292 -0.842 5.216
704 HB3 GLU 91 HB3 GLU 91 14.853 -1.434 5.794
705 HG2 GLU 91 HG2 GLU 91 15.701 -1.502 3.449
706 HG3 GLU 91 HG3 GLU 91 14.187 -0.813 2.881
707 H GLU 92 H GLU 92 11.394 -3.178 5.874
708 HA GLU 92 HA GLU 92 12.109 -4.161 8.449
709 HB2 GLU 92 HB2 GLU 92 9.894 -3.291 7.783
710 HB3 GLU 92 HB3 GLU 92 9.668 -4.669 6.707
711 HG2 GLU 92 HG2 GLU 92 8.366 -5.039 8.648
712 HG3 GLU 92 HG3 GLU 92 9.686 -6.194 8.679
713 H THR 93 H THR 93 12.006 -5.806 5.376
714 HA THR 93 HA THR 93 12.168 -8.528 6.577
715 HB THR 93 HB THR 93 11.518 -9.390 4.510
716 HG1 THR 93 HG1 THR 93 12.148 -6.846 3.397
717 HG21 THR 93 HG21 THR 93 10.075 -6.718 4.541
718 HG22 THR 93 HG22 THR 93 9.726 -8.033 5.691
719 HG23 THR 93 HG23 THR 93 9.462 -8.280 3.951
720 H ALA 94 H ALA 94 13.962 -6.323 4.547
721 HA ALA 94 HA ALA 94 16.225 -8.102 4.115
722 HB1 ALA 94 HB1 ALA 94 15.480 -6.366 2.507
723 HB2 ALA 94 HB2 ALA 94 15.997 -5.107 3.651
724 HB3 ALA 94 HB3 ALA 94 17.188 -6.222 2.945
725 H ARG 95 H ARG 95 15.515 -5.581 6.542
726 HA ARG 95 HA ARG 95 18.145 -5.940 7.837
727 HB2 ARG 95 HB2 ARG 95 15.649 -4.557 8.847
728 HB3 ARG 95 HB3 ARG 95 17.217 -4.569 9.641
729 HG2 ARG 95 HG2 ARG 95 16.555 -3.241 6.977
730 HG3 ARG 95 HG3 ARG 95 16.827 -2.462 8.522
731 HD2 ARG 95 HD2 ARG 95 18.826 -2.111 7.382
732 HD3 ARG 95 HD3 ARG 95 19.200 -3.452 8.465
733 HE ARG 95 HE ARG 95 19.562 -4.807 6.641
734 HH11 ARG 95 HH11 ARG 95 17.781 -1.944 5.462
735 HH12 ARG 95 HH12 ARG 95 17.982 -2.390 3.783
736 HH21 ARG 95 HH21 ARG 95 19.796 -5.333 4.461
737 HH22 ARG 95 HH22 ARG 95 19.121 -4.305 3.219
738 H LEU 96 H LEU 96 14.770 -6.821 8.597
739 HA LEU 96 HA LEU 96 13.775 -8.344 9.874
740 HB2 LEU 96 HB2 LEU 96 15.398 -9.806 8.388
741 HB3 LEU 96 HB3 LEU 96 16.169 -10.164 9.885
742 HG LEU 96 HG LEU 96 14.779 -11.944 9.356
743 HD11 LEU 96 HD11 LEU 96 13.248 -12.083 11.177
744 HD12 LEU 96 HD12 LEU 96 13.132 -10.310 11.283
745 HD13 LEU 96 HD13 LEU 96 14.663 -11.127 11.698
746 HD21 LEU 96 HD21 LEU 96 12.406 -11.706 8.795
747 HD22 LEU 96 HD22 LEU 96 13.459 -10.808 7.678
748 HD23 LEU 96 HD23 LEU 96 12.547 -9.934 8.931
749 H GLN 97 H GLN 97 17.116 -7.905 11.082
750 HA GLN 97 HA GLN 97 16.264 -7.962 13.895
751 HB2 GLN 97 HB2 GLN 97 18.908 -6.967 12.783
752 HB3 GLN 97 HB3 GLN 97 18.544 -7.548 14.405
753 HG2 GLN 97 HG2 GLN 97 18.831 -9.158 11.839
754 HG3 GLN 97 HG3 GLN 97 19.837 -9.216 13.282
755 HE21 GLN 97 HE21 GLN 97 18.454 -9.869 15.408
756 HE22 GLN 97 HE22 GLN 97 17.475 -11.284 15.110
757 H THR 98 H THR 98 14.556 -6.418 13.774
758 HA THR 98 HA THR 98 15.272 -3.566 13.204
759 HB THR 98 HB THR 98 12.906 -3.313 12.612
760 HG1 THR 98 HG1 THR 98 11.789 -5.257 12.054
761 HG21 THR 98 HG21 THR 98 14.633 -3.634 10.893
762 HG22 THR 98 HG22 THR 98 13.083 -4.353 10.422
763 HG23 THR 98 HG23 THR 98 14.400 -5.398 10.985
764 HA PRO 99 HA PRO 99 14.135 -2.955 17.576
765 HB2 PRO 99 HB2 PRO 99 15.639 -0.416 16.956
766 HB3 PRO 99 HB3 PRO 99 15.712 -1.445 18.416
767 HG2 PRO 99 HG2 PRO 99 17.681 -1.567 16.578
768 HG3 PRO 99 HG3 PRO 99 17.023 -3.091 17.266
769 HD2 PRO 99 HD2 PRO 99 16.278 -1.741 14.642
770 HD3 PRO 99 HD3 PRO 99 16.736 -3.445 14.945
771 H VAL 100 H VAL 100 12.312 -2.469 15.361
772 HA VAL 100 HA VAL 100 11.517 0.382 15.519
773 HB VAL 100 HB VAL 100 12.430 -0.738 13.397
774 HG11 VAL 100 HG11 VAL 100 10.939 -2.783 13.538
775 HG12 VAL 100 HG12 VAL 100 9.571 -1.745 13.105
776 HG13 VAL 100 HG13 VAL 100 10.922 -1.937 11.978
777 HG21 VAL 100 HG21 VAL 100 9.743 0.688 13.136
778 HG22 VAL 100 HG22 VAL 100 11.289 1.497 13.454
779 HG23 VAL 100 HG23 VAL 100 11.048 0.607 11.943
780 H THR 101 H THR 101 9.372 1.030 15.481
781 HA THR 101 HA THR 101 7.226 -0.957 15.544
782 HB THR 101 HB THR 101 7.604 -0.572 17.928
783 HG1 THR 101 HG1 THR 101 5.595 -0.879 17.805
784 HG21 THR 101 HG21 THR 101 8.509 1.745 17.906
785 HG22 THR 101 HG22 THR 101 7.117 1.573 18.984
786 HG23 THR 101 HG23 THR 101 6.915 2.357 17.405
787 H ASN 102 H ASN 102 5.200 -0.048 14.882
788 HA ASN 102 HA ASN 102 5.261 2.830 14.191
789 HB2 ASN 102 HB2 ASN 102 4.039 2.603 12.153
790 HB3 ASN 102 HB3 ASN 102 5.516 1.658 12.060
791 HD21 ASN 102 HD21 ASN 102 1.998 1.361 12.748
792 HD22 ASN 102 HD22 ASN 102 1.919 -0.313 12.174
793 H ARG 103 H ARG 103 4.290 1.127 16.488
794 HA ARG 103 HA ARG 103 1.403 1.649 16.614
795 HB2 ARG 103 HB2 ARG 103 3.469 0.726 18.641
796 HB3 ARG 103 HB3 ARG 103 1.791 1.001 19.063
797 HG2 ARG 103 HG2 ARG 103 2.515 -0.862 16.782
798 HG3 ARG 103 HG3 ARG 103 2.568 -1.415 18.458
799 HD2 ARG 103 HD2 ARG 103 0.091 -0.187 17.179
800 HD3 ARG 103 HD3 ARG 103 0.430 -1.926 17.231
801 HE ARG 103 HE ARG 103 0.678 -0.899 19.858
802 HH11 ARG 103 HH11 ARG 103 -1.897 -1.530 17.473
803 HH12 ARG 103 HH12 ARG 103 -3.112 -1.793 18.705
804 HH21 ARG 103 HH21 ARG 103 -0.922 -1.249 21.414
805 HH22 ARG 103 HH22 ARG 103 -2.560 -1.634 20.935
806 H GLY 104 H GLY 104 0.391 3.179 17.715
807 HA2 GLY 104 HA2 GLY 104 -0.129 4.884 19.078
808 HA3 GLY 104 HA3 GLY 104 1.479 4.796 19.794
809 H ILE 105 H ILE 105 -0.553 6.917 18.694
810 HA ILE 105 HA ILE 105 0.992 8.502 16.827
811 HB ILE 105 HB ILE 105 -1.354 9.270 18.594
812 HG12 ILE 105 HG12 ILE 105 -2.097 7.475 17.205
813 HG13 ILE 105 HG13 ILE 105 -2.758 8.967 16.576
814 HG21 ILE 105 HG21 ILE 105 -0.325 10.681 16.101
815 HG22 ILE 105 HG22 ILE 105 -1.766 11.102 17.038
816 HG23 ILE 105 HG23 ILE 105 -0.172 11.258 17.775
817 HD11 ILE 105 HD11 ILE 105 -0.401 7.420 15.395
818 HD12 ILE 105 HD12 ILE 105 -2.045 7.509 14.760
819 HD13 ILE 105 HD13 ILE 105 -1.034 8.959 14.755
820 HA PRO 106 HA PRO 106 3.896 9.961 19.785
821 HB2 PRO 106 HB2 PRO 106 4.992 12.146 18.512
822 HB3 PRO 106 HB3 PRO 106 5.271 10.452 18.022
823 HG2 PRO 106 HG2 PRO 106 3.250 12.398 16.894
824 HG3 PRO 106 HG3 PRO 106 4.417 11.363 16.001
825 HD2 PRO 106 HD2 PRO 106 1.864 10.591 16.321
826 HD3 PRO 106 HD3 PRO 106 3.182 9.399 16.497
827 HHA HEC 107 HHA HEC 107 -3.809 -3.401 1.042
828 HHB HEC 107 HHB HEC 107 0.174 1.618 1.596
829 HHC HEC 107 HHC HEC 107 -4.433 4.988 4.570
830 HHD HEC 107 HHD HEC 107 -8.335 -0.188 4.285
831 HMA1 HEC 107 HMA1 HEC 107 1.293 -1.864 0.611
832 HMA2 HEC 107 HMA2 HEC 107 0.824 -0.599 -0.537
833 HMA3 HEC 107 HMA3 HEC 107 1.416 -0.180 1.089
834 HAA1 HEC 107 HAA1 HEC 107 -0.079 -3.642 0.688
835 HAA2 HEC 107 HAA2 HEC 107 -1.737 -4.155 0.784
836 HBA1 HEC 107 HBA1 HEC 107 -1.140 -2.487 -1.592
837 HBA2 HEC 107 HBA2 HEC 107 -0.270 -4.025 -1.514
838 HMB1 HEC 107 HMB1 HEC 107 0.347 5.355 2.317
839 HMB2 HEC 107 HMB2 HEC 107 1.089 3.802 2.718
840 HMB3 HEC 107 HMB3 HEC 107 0.354 4.078 1.111
841 HAB HEC 107 HAB HEC 107 -2.483 5.817 4.998
842 HBB1 HEC 107 HBB1 HEC 107 -1.807 7.866 3.943
843 HBB2 HEC 107 HBB2 HEC 107 -1.219 6.976 2.522
844 HBB3 HEC 107 HBB3 HEC 107 -2.950 6.963 2.931
845 HMC1 HEC 107 HMC1 HEC 107 -7.517 4.569 6.696
846 HMC2 HEC 107 HMC2 HEC 107 -6.028 5.246 6.076
847 HMC3 HEC 107 HMC3 HEC 107 -7.509 5.364 5.114
848 HAC HEC 107 HAC HEC 107 -9.036 1.050 5.770
849 HBC1 HEC 107 HBC1 HEC 107 -10.092 2.929 4.656
850 HBC2 HEC 107 HBC2 HEC 107 -10.669 2.706 6.320
851 HBC3 HEC 107 HBC3 HEC 107 -9.555 4.017 5.952
852 HMD1 HEC 107 HMD1 HEC 107 -9.339 -1.894 3.270
853 HMD2 HEC 107 HMD2 HEC 107 -9.022 -3.286 2.250
854 HMD3 HEC 107 HMD3 HEC 107 -8.593 -3.354 3.966
855 HAD1 HEC 107 HAD1 HEC 107 -7.372 -4.559 1.329
856 HAD2 HEC 107 HAD2 HEC 107 -5.739 -4.446 0.716
857 HBD1 HEC 107 HBD1 HEC 107 -6.555 -5.224 3.544
858 HBD2 HEC 107 HBD2 HEC 107 -5.914 -6.306 2.305
Start of MODEL 19
1 H SER 1 H SER 1 14.189 2.403 6.900
2 HA SER 1 HA SER 1 13.416 5.056 7.480
3 HB2 SER 1 HB2 SER 1 14.197 3.981 4.767
4 HB3 SER 1 HB3 SER 1 14.311 5.654 5.346
5 HG SER 1 HG SER 1 15.739 3.353 6.137
6 H GLY 2 H GLY 2 11.262 5.521 7.695
7 HA2 GLY 2 HA2 GLY 2 9.494 6.458 6.053
8 HA3 GLY 2 HA3 GLY 2 9.351 4.865 5.476
9 H GLU 3 H GLU 3 9.943 4.222 8.628
10 HA GLU 3 HA GLU 3 7.377 3.354 9.312
11 HB2 GLU 3 HB2 GLU 3 9.568 2.662 10.340
12 HB3 GLU 3 HB3 GLU 3 9.580 4.170 11.247
13 HG2 GLU 3 HG2 GLU 3 7.306 3.421 12.222
14 HG3 GLU 3 HG3 GLU 3 7.609 1.852 11.496
15 H GLN 4 H GLN 4 8.777 6.597 9.970
16 HA GLN 4 HA GLN 4 6.692 7.428 11.787
17 HB2 GLN 4 HB2 GLN 4 8.934 8.521 11.588
18 HB3 GLN 4 HB3 GLN 4 8.483 9.100 9.982
19 HG2 GLN 4 HG2 GLN 4 8.218 10.899 11.549
20 HG3 GLN 4 HG3 GLN 4 6.637 10.432 10.953
21 HE21 GLN 4 HE21 GLN 4 5.932 11.654 12.927
22 HE22 GLN 4 HE22 GLN 4 5.928 10.770 14.477
23 H ILE 5 H ILE 5 7.023 7.517 8.237
24 HA ILE 5 HA ILE 5 4.599 9.080 7.820
25 HB ILE 5 HB ILE 5 6.052 7.309 5.821
26 HG12 ILE 5 HG12 ILE 5 6.431 10.274 6.483
27 HG13 ILE 5 HG13 ILE 5 7.609 8.986 6.751
28 HG21 ILE 5 HG21 ILE 5 4.207 9.720 5.430
29 HG22 ILE 5 HG22 ILE 5 4.875 8.687 4.151
30 HG23 ILE 5 HG23 ILE 5 3.669 8.040 5.253
31 HD11 ILE 5 HD11 ILE 5 6.694 10.051 4.055
32 HD12 ILE 5 HD12 ILE 5 8.299 10.139 4.793
33 HD13 ILE 5 HD13 ILE 5 7.648 8.568 4.285
34 H PHE 6 H PHE 6 5.353 5.555 7.955
35 HA PHE 6 HA PHE 6 2.667 4.693 7.437
36 HB2 PHE 6 HB2 PHE 6 4.553 3.146 7.397
37 HB3 PHE 6 HB3 PHE 6 4.839 3.386 9.115
38 HD1 PHE 6 HD1 PHE 6 2.503 1.934 6.615
39 HD2 PHE 6 HD2 PHE 6 3.459 2.292 10.803
40 HE1 PHE 6 HE1 PHE 6 0.782 0.228 7.160
41 HE2 PHE 6 HE2 PHE 6 1.752 0.569 11.338
42 HZ PHE 6 HZ PHE 6 0.402 -0.457 9.520
43 H ARG 7 H ARG 7 4.265 5.382 10.580
44 HA ARG 7 HA ARG 7 2.035 4.901 12.254
45 HB2 ARG 7 HB2 ARG 7 4.420 4.971 12.897
46 HB3 ARG 7 HB3 ARG 7 4.443 6.714 12.660
47 HG2 ARG 7 HG2 ARG 7 4.361 6.076 15.011
48 HG3 ARG 7 HG3 ARG 7 2.968 7.043 14.578
49 HD2 ARG 7 HD2 ARG 7 2.582 4.077 14.386
50 HD3 ARG 7 HD3 ARG 7 2.913 4.695 16.009
51 HE ARG 7 HE ARG 7 0.991 6.405 15.146
52 HH11 ARG 7 HH11 ARG 7 1.079 2.843 15.323
53 HH12 ARG 7 HH12 ARG 7 -0.644 2.719 15.596
54 HH21 ARG 7 HH21 ARG 7 -1.222 6.192 15.491
55 HH22 ARG 7 HH22 ARG 7 -1.943 4.613 15.708
56 H THR 8 H THR 8 2.710 7.707 10.297
57 HA THR 8 HA THR 8 0.570 9.248 11.691
58 HB THR 8 HB THR 8 1.410 11.217 10.439
59 HG1 THR 8 HG1 THR 8 3.666 9.585 9.938
60 HG21 THR 8 HG21 THR 8 3.492 9.793 12.167
61 HG22 THR 8 HG22 THR 8 2.120 10.746 12.763
62 HG23 THR 8 HG23 THR 8 3.397 11.535 11.827
63 H ARG 9 H ARG 9 1.199 7.845 8.481
64 HA ARG 9 HA ARG 9 -1.408 8.990 7.567
65 HB2 ARG 9 HB2 ARG 9 0.821 7.769 5.912
66 HB3 ARG 9 HB3 ARG 9 -0.655 8.532 5.322
67 HG2 ARG 9 HG2 ARG 9 0.080 10.655 6.547
68 HG3 ARG 9 HG3 ARG 9 1.655 9.872 6.777
69 HD2 ARG 9 HD2 ARG 9 1.801 9.536 4.295
70 HD3 ARG 9 HD3 ARG 9 0.285 10.429 4.105
71 HE ARG 9 HE ARG 9 2.928 11.492 4.504
72 HH11 ARG 9 HH11 ARG 9 -0.486 12.238 5.225
73 HH12 ARG 9 HH12 ARG 9 -0.197 13.961 5.289
74 HH21 ARG 9 HH21 ARG 9 3.246 13.730 4.598
75 HH22 ARG 9 HH22 ARG 9 1.905 14.801 4.941
76 H CYS 10 H CYS 10 0.040 5.842 8.253
77 HA CYS 10 HA CYS 10 -2.127 4.482 6.693
78 HB2 CYS 10 HB2 CYS 10 0.713 3.635 7.260
79 HB3 CYS 10 HB3 CYS 10 -0.437 2.749 6.264
80 H SER 11 H SER 11 -0.753 4.556 9.892
81 HA SER 11 HA SER 11 -1.508 1.933 10.756
82 HB2 SER 11 HB2 SER 11 -1.295 3.053 13.041
83 HB3 SER 11 HB3 SER 11 0.111 3.129 11.975
84 HG SER 11 HG SER 11 -1.793 5.209 12.419
85 H SER 12 H SER 12 -3.033 1.844 12.777
86 HA SER 12 HA SER 12 -5.097 1.587 13.561
87 HB2 SER 12 HB2 SER 12 -5.958 4.167 12.251
88 HB3 SER 12 HB3 SER 12 -6.667 3.350 13.647
89 HG SER 12 HG SER 12 -4.288 4.842 13.436
90 H CYS 13 H CYS 13 -5.094 2.120 10.041
91 HA CYS 13 HA CYS 13 -7.270 0.094 9.781
92 HB2 CYS 13 HB2 CYS 13 -5.549 1.478 7.710
93 HB3 CYS 13 HB3 CYS 13 -6.540 0.066 7.366
94 H HIS 14 H HIS 14 -3.722 0.316 9.046
95 HA HIS 14 HA HIS 14 -3.660 -2.622 8.711
96 HB2 HIS 14 2HB HIS 14 -1.848 -0.369 7.830
97 HB3 HIS 14 3HB HIS 14 -1.321 -2.028 7.749
98 HD1 HIS 14 1HD HIS 14 -3.033 -3.734 6.158
99 HD2 HIS 14 2HD HIS 14 -2.832 0.419 5.761
100 HE1 HIS 14 1HE HIS 14 -3.902 -3.239 3.832
101 H THR 15 H THR 15 -1.684 -3.600 9.033
102 HA THR 15 HA THR 15 -0.041 -3.051 11.438
103 HB THR 15 HB THR 15 -0.017 -5.625 11.782
104 HG1 THR 15 HG1 THR 15 -1.567 -6.754 11.044
105 HG21 THR 15 HG21 THR 15 -2.438 -4.021 12.672
106 HG22 THR 15 HG22 THR 15 -0.862 -4.112 13.489
107 HG23 THR 15 HG23 THR 15 -1.882 -5.558 13.380
108 H VAL 16 H VAL 16 2.042 -4.119 11.304
109 HA VAL 16 HA VAL 16 2.657 -5.453 8.741
110 HB VAL 16 HB VAL 16 3.814 -3.782 7.953
111 HG11 VAL 16 HG11 VAL 16 2.914 -2.078 9.334
112 HG12 VAL 16 HG12 VAL 16 4.091 -2.458 10.635
113 HG13 VAL 16 HG13 VAL 16 4.638 -1.809 9.072
114 HG21 VAL 16 HG21 VAL 16 5.640 -5.306 8.610
115 HG22 VAL 16 HG22 VAL 16 6.118 -3.625 8.416
116 HG23 VAL 16 HG23 VAL 16 5.917 -4.294 10.045
117 H GLY 17 H GLY 17 2.881 -7.335 9.257
118 HA2 GLY 17 HA2 GLY 17 4.085 -9.225 9.945
119 HA3 GLY 17 HA3 GLY 17 5.052 -8.251 11.057
120 H ASN 18 H ASN 18 1.539 -7.947 11.148
121 HA ASN 18 HA ASN 18 1.371 -9.599 13.603
122 HB2 ASN 18 HB2 ASN 18 2.230 -7.380 14.331
123 HB3 ASN 18 HB3 ASN 18 0.831 -6.601 13.605
124 HD21 ASN 18 HD21 ASN 18 0.718 -5.780 15.946
125 HD22 ASN 18 HD22 ASN 18 -0.177 -6.796 17.069
126 H THR 19 H THR 19 -0.569 -10.404 14.027
127 HA THR 19 HA THR 19 -2.961 -9.593 12.445
128 HB THR 19 HB THR 19 -3.469 -12.109 12.270
129 HG1 THR 19 HG1 THR 19 -1.629 -12.622 13.765
130 HG21 THR 19 HG21 THR 19 -1.077 -11.019 10.739
131 HG22 THR 19 HG22 THR 19 -2.787 -10.758 10.340
132 HG23 THR 19 HG23 THR 19 -2.102 -12.389 10.268
133 H GLU 20 H GLU 20 -2.065 -9.291 15.393
134 HA GLU 20 HA GLU 20 -3.502 -10.921 17.076
135 HB2 GLU 20 HB2 GLU 20 -3.340 -9.150 18.752
136 HB3 GLU 20 HB3 GLU 20 -1.851 -9.279 17.823
137 HG2 GLU 20 HG2 GLU 20 -2.521 -7.296 16.477
138 HG3 GLU 20 HG3 GLU 20 -4.040 -7.208 17.372
139 HA PRO 21 HA PRO 21 -7.855 -9.873 16.770
140 HB2 PRO 21 HB2 PRO 21 -8.802 -10.486 19.243
141 HB3 PRO 21 HB3 PRO 21 -8.267 -11.733 18.079
142 HG2 PRO 21 HG2 PRO 21 -6.665 -10.519 20.357
143 HG3 PRO 21 HG3 PRO 21 -6.891 -12.254 19.969
144 HD2 PRO 21 HD2 PRO 21 -4.695 -10.880 19.154
145 HD3 PRO 21 HD3 PRO 21 -5.448 -12.120 18.110
146 H GLY 22 H GLY 22 -9.236 -8.167 17.234
147 HA2 GLY 22 HA2 GLY 22 -9.529 -6.052 18.772
148 HA3 GLY 22 HA3 GLY 22 -7.840 -5.787 18.365
149 H GLN 23 H GLN 23 -8.636 -3.742 17.400
150 HA GLN 23 HA GLN 23 -10.143 -3.780 14.990
151 HB2 GLN 23 HB2 GLN 23 -9.521 -1.558 14.619
152 HB3 GLN 23 HB3 GLN 23 -9.748 -1.781 16.350
153 HG2 GLN 23 HG2 GLN 23 -7.261 -1.864 16.644
154 HG3 GLN 23 HG3 GLN 23 -7.065 -1.585 14.902
155 HE21 GLN 23 HE21 GLN 23 -7.691 0.579 14.024
156 HE22 GLN 23 HE22 GLN 23 -8.074 1.881 15.157
157 HA PRO 24 HA PRO 24 -6.077 -4.480 12.490
158 HB2 PRO 24 HB2 PRO 24 -5.392 -7.011 13.993
159 HB3 PRO 24 HB3 PRO 24 -4.321 -5.994 12.983
160 HG2 PRO 24 HG2 PRO 24 -4.241 -5.677 15.642
161 HG3 PRO 24 HG3 PRO 24 -4.369 -4.212 14.618
162 HD2 PRO 24 HD2 PRO 24 -6.586 -5.709 16.044
163 HD3 PRO 24 HD3 PRO 24 -6.244 -3.949 16.057
164 H GLY 25 H GLY 25 -6.266 -5.668 10.635
165 HA2 GLY 25 HA2 GLY 25 -7.279 -7.314 9.209
166 HA3 GLY 25 HA3 GLY 25 -8.452 -7.700 10.465
167 H ILE 26 H ILE 26 -8.482 -4.356 10.440
168 HA ILE 26 HA ILE 26 -10.655 -4.014 8.498
169 HB ILE 26 HB ILE 26 -8.862 -2.044 9.967
170 HG12 ILE 26 HG12 ILE 26 -11.845 -2.662 10.256
171 HG13 ILE 26 HG13 ILE 26 -10.594 -3.362 11.273
172 HG21 ILE 26 HG21 ILE 26 -10.367 -0.249 9.133
173 HG22 ILE 26 HG22 ILE 26 -9.532 -1.021 7.801
174 HG23 ILE 26 HG23 ILE 26 -11.230 -1.436 8.132
175 HD11 ILE 26 HD11 ILE 26 -11.563 -1.549 12.480
176 HD12 ILE 26 HD12 ILE 26 -9.932 -1.042 12.001
177 HD13 ILE 26 HD13 ILE 26 -11.363 -0.428 11.131
178 H GLY 27 H GLY 27 -7.193 -3.103 8.533
179 HA2 GLY 27 HA2 GLY 27 -7.031 -3.758 5.617
180 HA3 GLY 27 HA3 GLY 27 -5.865 -2.777 6.497
181 HA PRO 28 HA PRO 28 -5.164 -7.678 7.213
182 HB2 PRO 28 HB2 PRO 28 -4.374 -7.478 4.293
183 HB3 PRO 28 HB3 PRO 28 -4.781 -8.942 5.243
184 HG2 PRO 28 HG2 PRO 28 -6.650 -7.776 3.668
185 HG3 PRO 28 HG3 PRO 28 -7.085 -8.375 5.298
186 HD2 PRO 28 HD2 PRO 28 -6.680 -5.548 4.392
187 HD3 PRO 28 HD3 PRO 28 -7.752 -6.192 5.652
188 H ASP 29 H ASP 29 -3.027 -8.638 7.172
189 HA ASP 29 HA ASP 29 -1.013 -6.826 8.079
190 HB2 ASP 29 HB2 ASP 29 -1.407 -9.086 8.957
191 HB3 ASP 29 HB3 ASP 29 -0.925 -9.795 7.408
192 H LEU 30 H LEU 30 0.989 -6.387 7.403
193 HA LEU 30 HA LEU 30 1.427 -6.238 4.450
194 HB2 LEU 30 HB2 LEU 30 2.246 -4.461 6.757
195 HB3 LEU 30 HB3 LEU 30 2.807 -4.174 5.119
196 HG LEU 30 HG LEU 30 -0.080 -4.190 6.050
197 HD11 LEU 30 HD11 LEU 30 1.171 -2.344 7.077
198 HD12 LEU 30 HD12 LEU 30 0.098 -1.704 5.822
199 HD13 LEU 30 HD13 LEU 30 1.842 -1.868 5.502
200 HD21 LEU 30 HD21 LEU 30 1.237 -3.152 3.465
201 HD22 LEU 30 HD22 LEU 30 -0.488 -2.988 3.882
202 HD23 LEU 30 HD23 LEU 30 0.202 -4.583 3.591
203 H LEU 31 H LEU 31 3.859 -5.474 6.765
204 HA LEU 31 HA LEU 31 6.089 -5.691 6.529
205 HB2 LEU 31 HB2 LEU 31 5.334 -7.379 8.209
206 HB3 LEU 31 HB3 LEU 31 5.473 -8.627 7.027
207 HG LEU 31 HG LEU 31 7.794 -8.660 7.141
208 HD11 LEU 31 HD11 LEU 31 9.273 -6.843 7.915
209 HD12 LEU 31 HD12 LEU 31 7.886 -5.762 8.071
210 HD13 LEU 31 HD13 LEU 31 8.377 -6.379 6.471
211 HD21 LEU 31 HD21 LEU 31 7.078 -7.370 9.802
212 HD22 LEU 31 HD22 LEU 31 8.472 -8.421 9.484
213 HD23 LEU 31 HD23 LEU 31 6.835 -9.084 9.387
214 H GLY 32 H GLY 32 6.707 -8.658 5.500
215 HA2 GLY 32 HA2 GLY 32 8.006 -8.001 3.067
216 HA3 GLY 32 HA3 GLY 32 7.657 -9.631 3.631
217 H VAL 33 H VAL 33 4.819 -7.651 3.028
218 HA VAL 33 HA VAL 33 3.803 -9.272 0.938
219 HB VAL 33 HB VAL 33 2.424 -7.819 2.312
220 HG11 VAL 33 HG11 VAL 33 3.516 -5.454 0.731
221 HG12 VAL 33 HG12 VAL 33 2.188 -5.427 1.907
222 HG13 VAL 33 HG13 VAL 33 3.829 -5.788 2.450
223 HG21 VAL 33 HG21 VAL 33 1.574 -8.612 0.153
224 HG22 VAL 33 HG22 VAL 33 0.882 -7.049 0.613
225 HG23 VAL 33 HG23 VAL 33 2.142 -7.111 -0.627
226 H THR 34 H THR 34 5.961 -6.478 0.736
227 HA THR 34 HA THR 34 6.043 -6.132 -2.099
228 HB THR 34 HB THR 34 8.449 -5.183 -1.305
229 HG1 THR 34 HG1 THR 34 8.508 -5.868 0.744
230 HG21 THR 34 HG21 THR 34 7.307 -3.097 -0.645
231 HG22 THR 34 HG22 THR 34 5.757 -3.965 -0.557
232 HG23 THR 34 HG23 THR 34 6.601 -3.785 -2.114
233 H ARG 35 H ARG 35 7.200 -8.789 -0.303
234 HA ARG 35 HA ARG 35 8.567 -9.740 -2.760
235 HB2 ARG 35 HB2 ARG 35 10.081 -11.145 -1.413
236 HB3 ARG 35 HB3 ARG 35 10.316 -9.419 -1.299
237 HG2 ARG 35 HG2 ARG 35 10.680 -10.142 0.861
238 HG3 ARG 35 HG3 ARG 35 9.083 -9.449 0.919
239 HD2 ARG 35 HD2 ARG 35 8.698 -11.368 2.109
240 HD3 ARG 35 HD3 ARG 35 8.337 -12.019 0.516
241 HE ARG 35 HE ARG 35 10.781 -12.411 2.169
242 HH11 ARG 35 HH11 ARG 35 9.048 -13.377 -0.803
243 HH12 ARG 35 HH12 ARG 35 10.114 -14.735 -1.085
244 HH21 ARG 35 HH21 ARG 35 12.110 -14.168 1.753
245 HH22 ARG 35 HH22 ARG 35 11.835 -15.181 0.355
246 H GLN 36 H GLN 36 5.732 -9.930 -1.613
247 HA GLN 36 HA GLN 36 5.385 -12.822 -2.302
248 HB2 GLN 36 HB2 GLN 36 3.640 -11.122 -0.490
249 HB3 GLN 36 HB3 GLN 36 3.356 -12.797 -0.926
250 HG2 GLN 36 HG2 GLN 36 5.690 -11.769 0.737
251 HG3 GLN 36 HG3 GLN 36 4.261 -12.569 1.352
252 HE21 GLN 36 HE21 GLN 36 6.633 -13.602 2.116
253 HE22 GLN 36 HE22 GLN 36 7.038 -15.052 1.196
254 H ARG 37 H ARG 37 4.244 -9.525 -2.850
255 HA ARG 37 HA ARG 37 2.288 -10.377 -4.940
256 HB2 ARG 37 HB2 ARG 37 2.659 -7.862 -3.283
257 HB3 ARG 37 HB3 ARG 37 1.527 -7.943 -4.626
258 HG2 ARG 37 HG2 ARG 37 1.362 -10.047 -2.436
259 HG3 ARG 37 HG3 ARG 37 0.715 -8.436 -2.172
260 HD2 ARG 37 HD2 ARG 37 -0.770 -8.622 -4.091
261 HD3 ARG 37 HD3 ARG 37 -0.051 -10.173 -4.540
262 HE ARG 37 HE ARG 37 -1.451 -11.215 -3.108
263 HH11 ARG 37 HH11 ARG 37 -1.225 -7.860 -1.881
264 HH12 ARG 37 HH12 ARG 37 -2.493 -8.117 -0.704
265 HH21 ARG 37 HH21 ARG 37 -3.080 -11.461 -1.567
266 HH22 ARG 37 HH22 ARG 37 -3.525 -10.127 -0.526
267 H ASP 38 H ASP 38 2.146 -8.247 -6.630
268 HA ASP 38 HA ASP 38 4.701 -8.362 -8.065
269 HB2 ASP 38 HB2 ASP 38 2.522 -8.414 -9.271
270 HB3 ASP 38 HB3 ASP 38 2.241 -6.761 -8.781
271 H ALA 39 H ALA 39 6.328 -7.174 -7.573
272 HA ALA 39 HA ALA 39 6.359 -5.136 -5.647
273 HB1 ALA 39 HB1 ALA 39 8.386 -6.046 -7.721
274 HB2 ALA 39 HB2 ALA 39 8.773 -4.968 -6.384
275 HB3 ALA 39 HB3 ALA 39 8.220 -6.628 -6.050
276 H ASN 40 H ASN 40 5.701 -4.680 -9.040
277 HA ASN 40 HA ASN 40 6.321 -1.751 -8.806
278 HB2 ASN 40 HB2 ASN 40 6.126 -3.581 -11.213
279 HB3 ASN 40 HB3 ASN 40 5.925 -1.836 -11.339
280 HD21 ASN 40 HD21 ASN 40 7.782 -1.838 -12.750
281 HD22 ASN 40 HD22 ASN 40 9.386 -1.859 -12.026
282 H TRP 41 H TRP 41 3.709 -4.067 -9.689
283 HA TRP 41 HA TRP 41 1.691 -2.103 -10.199
284 HB2 TRP 41 HB2 TRP 41 1.435 -4.555 -10.673
285 HB3 TRP 41 HB3 TRP 41 1.398 -4.838 -8.941
286 HD1 TRP 41 HD1 TRP 41 -0.826 -3.382 -11.707
287 HE1 TRP 41 HE1 TRP 41 -3.239 -3.174 -10.838
288 HE3 TRP 41 HE3 TRP 41 0.003 -4.571 -6.794
289 HZ2 TRP 41 HZ2 TRP 41 -4.564 -3.287 -8.270
290 HZ3 TRP 41 HZ3 TRP 41 -1.812 -4.325 -5.134
291 HH2 TRP 41 HH2 TRP 41 -4.095 -3.708 -5.833
292 H LEU 42 H LEU 42 2.698 -3.655 -7.117
293 HA LEU 42 HA LEU 42 0.831 -2.555 -5.357
294 HB2 LEU 42 HB2 LEU 42 2.412 -4.324 -4.887
295 HB3 LEU 42 HB3 LEU 42 3.790 -3.243 -5.015
296 HG LEU 42 HG LEU 42 1.656 -2.787 -2.901
297 HD11 LEU 42 HD11 LEU 42 3.012 -4.182 -1.359
298 HD12 LEU 42 HD12 LEU 42 4.064 -4.650 -2.718
299 HD13 LEU 42 HD13 LEU 42 2.357 -5.135 -2.692
300 HD21 LEU 42 HD21 LEU 42 3.364 -0.997 -3.075
301 HD22 LEU 42 HD22 LEU 42 4.659 -2.204 -3.007
302 HD23 LEU 42 HD23 LEU 42 3.619 -1.919 -1.600
303 H VAL 43 H VAL 43 3.678 -0.976 -6.732
304 HA VAL 43 HA VAL 43 3.521 1.369 -4.982
305 HB VAL 43 HB VAL 43 5.196 1.002 -7.486
306 HG11 VAL 43 HG11 VAL 43 5.576 2.738 -5.012
307 HG12 VAL 43 HG12 VAL 43 6.688 2.635 -6.390
308 HG13 VAL 43 HG13 VAL 43 5.081 3.330 -6.619
309 HG21 VAL 43 HG21 VAL 43 5.746 -0.855 -6.028
310 HG22 VAL 43 HG22 VAL 43 7.027 0.344 -5.852
311 HG23 VAL 43 HG23 VAL 43 5.777 0.185 -4.601
312 H ARG 44 H ARG 44 2.743 0.636 -8.410
313 HA ARG 44 HA ARG 44 1.707 3.218 -9.129
314 HB2 ARG 44 HB2 ARG 44 1.269 0.397 -10.143
315 HB3 ARG 44 HB3 ARG 44 0.167 1.673 -10.625
316 HG2 ARG 44 HG2 ARG 44 1.671 1.610 -12.352
317 HG3 ARG 44 HG3 ARG 44 2.154 3.028 -11.439
318 HD2 ARG 44 HD2 ARG 44 3.496 0.292 -11.230
319 HD3 ARG 44 HD3 ARG 44 4.007 1.546 -12.351
320 HE ARG 44 HE ARG 44 4.457 1.453 -9.469
321 HH11 ARG 44 HH11 ARG 44 4.458 3.590 -12.329
322 HH12 ARG 44 HH12 ARG 44 5.535 4.750 -11.583
323 HH21 ARG 44 HH21 ARG 44 5.845 2.983 -8.554
324 HH22 ARG 44 HH22 ARG 44 6.316 4.407 -9.454
325 H TRP 45 H TRP 45 0.104 0.354 -7.725
326 HA TRP 45 HA TRP 45 -2.506 1.374 -7.314
327 HB2 TRP 45 HB2 TRP 45 -2.214 -0.921 -7.010
328 HB3 TRP 45 HB3 TRP 45 -0.775 -0.726 -6.035
329 HD1 TRP 45 HD1 TRP 45 -0.982 -1.117 -3.611
330 HE1 TRP 45 HE1 TRP 45 -2.875 -1.411 -1.916
331 HE3 TRP 45 HE3 TRP 45 -4.925 0.280 -6.559
332 HZ2 TRP 45 HZ2 TRP 45 -5.742 -0.954 -1.801
333 HZ3 TRP 45 HZ3 TRP 45 -7.228 0.359 -5.623
334 HH2 TRP 45 HH2 TRP 45 -7.645 -0.264 -3.262
335 H LEU 46 H LEU 46 0.197 1.380 -4.895
336 HA LEU 46 HA LEU 46 -1.205 2.788 -2.929
337 HB2 LEU 46 HB2 LEU 46 0.887 1.548 -2.582
338 HB3 LEU 46 HB3 LEU 46 1.776 2.728 -3.545
339 HG LEU 46 HG LEU 46 1.364 4.476 -1.845
340 HD11 LEU 46 HD11 LEU 46 -0.792 3.745 -0.916
341 HD12 LEU 46 HD12 LEU 46 0.414 3.862 0.358
342 HD13 LEU 46 HD13 LEU 46 -0.038 2.262 -0.286
343 HD21 LEU 46 HD21 LEU 46 3.354 3.057 -1.668
344 HD22 LEU 46 HD22 LEU 46 2.457 1.885 -0.685
345 HD23 LEU 46 HD23 LEU 46 2.769 3.529 -0.066
346 H LYS 47 H LYS 47 0.545 4.149 -5.692
347 HA LYS 47 HA LYS 47 0.541 6.882 -4.733
348 HB2 LYS 47 HB2 LYS 47 2.174 5.821 -6.317
349 HB3 LYS 47 HB3 LYS 47 0.914 5.819 -7.557
350 HG2 LYS 47 HG2 LYS 47 0.858 8.265 -7.566
351 HG3 LYS 47 HG3 LYS 47 1.879 8.340 -6.122
352 HD2 LYS 47 HD2 LYS 47 3.198 8.879 -8.102
353 HD3 LYS 47 HD3 LYS 47 3.769 7.368 -7.379
354 HE2 LYS 47 HE2 LYS 47 2.378 6.103 -9.068
355 HE3 LYS 47 HE3 LYS 47 1.952 7.644 -9.824
356 HZ1 LYS 47 HZ1 LYS 47 4.716 6.595 -9.535
357 HZ2 LYS 47 HZ2 LYS 47 4.295 7.984 -10.314
358 HZ3 LYS 47 HZ3 LYS 47 3.800 6.542 -10.913
359 H VAL 48 H VAL 48 -1.895 4.983 -6.356
360 HA VAL 48 HA VAL 48 -3.784 7.217 -6.183
361 HB VAL 48 HB VAL 48 -4.538 6.770 -8.614
362 HG11 VAL 48 HG11 VAL 48 -3.597 8.909 -7.824
363 HG12 VAL 48 HG12 VAL 48 -1.995 8.360 -8.367
364 HG13 VAL 48 HG13 VAL 48 -3.310 8.539 -9.534
365 HG21 VAL 48 HG21 VAL 48 -2.955 6.078 -10.233
366 HG22 VAL 48 HG22 VAL 48 -1.611 6.094 -9.064
367 HG23 VAL 48 HG23 VAL 48 -2.860 4.853 -8.947
368 HA PRO 49 HA PRO 49 -5.377 2.866 -5.545
369 HB2 PRO 49 HB2 PRO 49 -6.357 3.814 -2.898
370 HB3 PRO 49 HB3 PRO 49 -5.435 2.337 -3.292
371 HG2 PRO 49 HG2 PRO 49 -4.281 4.458 -2.024
372 HG3 PRO 49 HG3 PRO 49 -3.383 3.529 -3.262
373 HD2 PRO 49 HD2 PRO 49 -4.992 6.062 -3.600
374 HD3 PRO 49 HD3 PRO 49 -3.297 5.781 -4.111
375 H ASP 50 H ASP 50 -7.024 5.996 -5.169
376 HA ASP 50 HA ASP 50 -9.691 4.726 -5.559
377 HB2 ASP 50 HB2 ASP 50 -9.451 6.613 -3.977
378 HB3 ASP 50 HB3 ASP 50 -8.950 7.656 -5.316
379 H GLN 51 H GLN 51 -7.313 6.673 -7.420
380 HA GLN 51 HA GLN 51 -9.099 6.898 -9.687
381 HB2 GLN 51 HB2 GLN 51 -7.062 8.423 -9.064
382 HB3 GLN 51 HB3 GLN 51 -6.123 7.223 -9.977
383 HG2 GLN 51 HG2 GLN 51 -7.698 7.551 -11.914
384 HG3 GLN 51 HG3 GLN 51 -8.500 8.824 -11.002
385 HE21 GLN 51 HE21 GLN 51 -7.782 9.728 -13.292
386 HE22 GLN 51 HE22 GLN 51 -6.204 10.510 -13.328
387 H MET 52 H MET 52 -6.462 4.543 -8.891
388 HA MET 52 HA MET 52 -6.531 3.042 -11.309
389 HB2 MET 52 HB2 MET 52 -6.017 2.339 -8.394
390 HB3 MET 52 HB3 MET 52 -5.873 1.136 -9.681
391 HG2 MET 52 HG2 MET 52 -4.444 3.780 -9.898
392 HG3 MET 52 HG3 MET 52 -3.769 2.504 -8.888
393 HE1 MET 52 HE1 MET 52 -4.101 -0.170 -10.243
394 HE2 MET 52 HE2 MET 52 -2.684 -0.246 -11.314
395 HE3 MET 52 HE3 MET 52 -2.536 0.457 -9.685
396 H LEU 53 H LEU 53 -8.727 2.962 -8.498
397 HA LEU 53 HA LEU 53 -10.238 0.701 -9.503
398 HB2 LEU 53 HB2 LEU 53 -9.838 1.368 -7.075
399 HB3 LEU 53 HB3 LEU 53 -10.950 2.703 -7.326
400 HG LEU 53 HG LEU 53 -12.755 1.021 -7.866
401 HD11 LEU 53 HD11 LEU 53 -10.700 -1.015 -6.868
402 HD12 LEU 53 HD12 LEU 53 -11.276 -0.896 -8.540
403 HD13 LEU 53 HD13 LEU 53 -12.405 -1.329 -7.270
404 HD21 LEU 53 HD21 LEU 53 -11.373 0.653 -5.158
405 HD22 LEU 53 HD22 LEU 53 -13.070 0.286 -5.531
406 HD23 LEU 53 HD23 LEU 53 -12.498 1.959 -5.585
407 H ALA 54 H ALA 54 -10.466 4.201 -9.922
408 HA ALA 54 HA ALA 54 -13.073 4.125 -11.232
409 HB1 ALA 54 HB1 ALA 54 -12.276 6.094 -9.982
410 HB2 ALA 54 HB2 ALA 54 -10.940 6.297 -11.143
411 HB3 ALA 54 HB3 ALA 54 -12.621 6.488 -11.677
412 H GLU 55 H GLU 55 -9.682 4.137 -12.343
413 HA GLU 55 HA GLU 55 -10.203 3.996 -15.193
414 HB2 GLU 55 HB2 GLU 55 -8.089 4.759 -14.112
415 HB3 GLU 55 HB3 GLU 55 -7.830 3.141 -13.487
416 HG2 GLU 55 HG2 GLU 55 -6.673 2.609 -15.308
417 HG3 GLU 55 HG3 GLU 55 -8.084 2.835 -16.320
418 H LYS 56 H LYS 56 -10.584 1.761 -12.629
419 HA LYS 56 HA LYS 56 -11.038 -0.417 -12.396
420 HB2 LYS 56 HB2 LYS 56 -11.919 -0.409 -15.295
421 HB3 LYS 56 HB3 LYS 56 -12.314 -1.623 -14.076
422 HG2 LYS 56 HG2 LYS 56 -13.511 0.130 -12.751
423 HG3 LYS 56 HG3 LYS 56 -13.205 1.285 -14.048
424 HD2 LYS 56 HD2 LYS 56 -14.840 -1.283 -14.271
425 HD3 LYS 56 HD3 LYS 56 -15.466 0.374 -14.211
426 HE2 LYS 56 HE2 LYS 56 -14.063 0.834 -16.308
427 HE3 LYS 56 HE3 LYS 56 -13.799 -0.908 -16.422
428 HZ1 LYS 56 HZ1 LYS 56 -16.486 0.366 -16.402
429 HZ2 LYS 56 HZ2 LYS 56 -16.183 -1.212 -16.705
430 HZ3 LYS 56 HZ3 LYS 56 -15.668 -0.098 -17.766
431 H ASP 57 H ASP 57 -8.478 -0.018 -12.541
432 HA ASP 57 HA ASP 57 -7.000 -1.855 -14.264
433 HB2 ASP 57 HB2 ASP 57 -5.897 -0.001 -12.988
434 HB3 ASP 57 HB3 ASP 57 -6.297 -0.834 -11.481
435 HA PRO 58 HA PRO 58 -9.678 -4.674 -12.598
436 HB2 PRO 58 HB2 PRO 58 -9.234 -6.853 -14.121
437 HB3 PRO 58 HB3 PRO 58 -9.713 -5.212 -14.712
438 HG2 PRO 58 HG2 PRO 58 -6.842 -6.173 -14.589
439 HG3 PRO 58 HG3 PRO 58 -7.767 -5.759 -16.084
440 HD2 PRO 58 HD2 PRO 58 -6.290 -3.962 -14.765
441 HD3 PRO 58 HD3 PRO 58 -7.926 -3.514 -15.330
442 H LEU 59 H LEU 59 -6.342 -5.461 -12.193
443 HA LEU 59 HA LEU 59 -6.732 -7.448 -10.093
444 HB2 LEU 59 HB2 LEU 59 -4.594 -7.171 -11.277
445 HB3 LEU 59 HB3 LEU 59 -4.406 -5.557 -10.587
446 HG LEU 59 HG LEU 59 -4.166 -6.485 -8.339
447 HD11 LEU 59 HD11 LEU 59 -5.615 -8.459 -8.419
448 HD12 LEU 59 HD12 LEU 59 -3.974 -8.946 -8.002
449 HD13 LEU 59 HD13 LEU 59 -4.575 -9.208 -9.655
450 HD21 LEU 59 HD21 LEU 59 -2.473 -8.000 -10.365
451 HD22 LEU 59 HD22 LEU 59 -2.047 -7.681 -8.667
452 HD23 LEU 59 HD23 LEU 59 -2.180 -6.337 -9.810
453 H ALA 60 H ALA 60 -6.756 -3.839 -10.085
454 HA ALA 60 HA ALA 60 -6.991 -3.707 -7.173
455 HB1 ALA 60 HB1 ALA 60 -7.547 -1.413 -7.474
456 HB2 ALA 60 HB2 ALA 60 -6.159 -1.788 -8.514
457 HB3 ALA 60 HB3 ALA 60 -7.784 -1.615 -9.219
458 H MET 61 H MET 61 -9.329 -3.738 -9.916
459 HA MET 61 HA MET 61 -11.726 -3.536 -8.443
460 HB2 MET 61 HB2 MET 61 -11.150 -5.275 -10.879
461 HB3 MET 61 HB3 MET 61 -12.741 -4.800 -10.312
462 HG2 MET 61 HG2 MET 61 -10.603 -2.819 -11.201
463 HG3 MET 61 HG3 MET 61 -11.839 -3.473 -12.263
464 HE1 MET 61 HE1 MET 61 -14.502 -3.516 -10.730
465 HE2 MET 61 HE2 MET 61 -15.097 -1.906 -11.208
466 HE3 MET 61 HE3 MET 61 -14.165 -2.901 -12.362
467 H LEU 62 H LEU 62 -9.591 -6.373 -8.773
468 HA LEU 62 HA LEU 62 -11.289 -8.176 -7.262
469 HB2 LEU 62 HB2 LEU 62 -9.510 -8.640 -9.049
470 HB3 LEU 62 HB3 LEU 62 -8.303 -8.282 -7.817
471 HG LEU 62 HG LEU 62 -10.443 -10.392 -7.449
472 HD11 LEU 62 HD11 LEU 62 -7.660 -10.775 -8.638
473 HD12 LEU 62 HD12 LEU 62 -9.202 -10.923 -9.513
474 HD13 LEU 62 HD13 LEU 62 -8.806 -12.072 -8.232
475 HD21 LEU 62 HD21 LEU 62 -9.243 -9.871 -5.366
476 HD22 LEU 62 HD22 LEU 62 -7.677 -10.021 -6.196
477 HD23 LEU 62 HD23 LEU 62 -8.717 -11.438 -5.946
478 H LEU 63 H LEU 63 -8.270 -6.303 -6.536
479 HA LEU 63 HA LEU 63 -7.983 -7.400 -3.930
480 HB2 LEU 63 HB2 LEU 63 -6.206 -6.695 -5.442
481 HB3 LEU 63 HB3 LEU 63 -6.774 -5.041 -5.452
482 HG LEU 63 HG LEU 63 -4.653 -5.573 -4.234
483 HD11 LEU 63 HD11 LEU 63 -5.011 -3.956 -2.478
484 HD12 LEU 63 HD12 LEU 63 -6.777 -4.106 -2.644
485 HD13 LEU 63 HD13 LEU 63 -5.814 -3.448 -3.971
486 HD21 LEU 63 HD21 LEU 63 -4.707 -6.442 -1.996
487 HD22 LEU 63 HD22 LEU 63 -5.451 -7.615 -3.099
488 HD23 LEU 63 HD23 LEU 63 -6.474 -6.616 -2.043
489 H PHE 64 H PHE 64 -9.699 -4.541 -5.049
490 HA PHE 64 HA PHE 64 -10.121 -3.532 -2.304
491 HB2 PHE 64 HB2 PHE 64 -10.752 -1.698 -3.347
492 HB3 PHE 64 HB3 PHE 64 -10.542 -2.461 -4.900
493 HD1 PHE 64 HD1 PHE 64 -12.510 -3.608 -6.017
494 HD2 PHE 64 HD2 PHE 64 -12.949 -1.314 -2.401
495 HE1 PHE 64 HE1 PHE 64 -14.968 -3.614 -6.309
496 HE2 PHE 64 HE2 PHE 64 -15.392 -1.272 -2.709
497 HZ PHE 64 HZ PHE 64 -16.425 -2.415 -4.672
498 H GLU 65 H GLU 65 -11.841 -5.740 -4.511
499 HA GLU 65 HA GLU 65 -14.328 -5.697 -3.108
500 HB2 GLU 65 HB2 GLU 65 -14.274 -5.927 -5.461
501 HB3 GLU 65 HB3 GLU 65 -13.064 -7.215 -5.414
502 HG2 GLU 65 HG2 GLU 65 -14.582 -8.794 -4.596
503 HG3 GLU 65 HG3 GLU 65 -15.808 -7.556 -4.264
504 H GLN 66 H GLN 66 -11.705 -8.122 -3.412
505 HA GLN 66 HA GLN 66 -13.169 -10.075 -1.890
506 HB2 GLN 66 HB2 GLN 66 -10.360 -10.003 -3.047
507 HB3 GLN 66 HB3 GLN 66 -11.045 -11.429 -2.256
508 HG2 GLN 66 HG2 GLN 66 -12.190 -10.063 -4.733
509 HG3 GLN 66 HG3 GLN 66 -11.262 -11.548 -4.711
510 HE21 GLN 66 HE21 GLN 66 -13.624 -11.664 -5.972
511 HE22 GLN 66 HE22 GLN 66 -14.693 -12.701 -5.031
512 H TYR 67 H TYR 67 -11.739 -7.547 -0.614
513 HA TYR 67 HA TYR 67 -11.319 -8.919 2.001
514 HB2 TYR 67 HB2 TYR 67 -9.789 -6.527 0.954
515 HB3 TYR 67 HB3 TYR 67 -9.666 -7.205 2.577
516 HD1 TYR 67 HD2 TYR 67 -8.686 -9.482 2.945
517 HD2 TYR 67 HD1 TYR 67 -8.757 -7.666 -0.960
518 HE1 TYR 67 HE2 TYR 67 -7.030 -11.153 2.126
519 HE2 TYR 67 HE1 TYR 67 -7.066 -9.310 -1.769
520 HH TYR 67 HH TYR 67 -5.807 -11.102 -1.256
521 H ASN 68 H ASN 68 -13.691 -8.571 1.441
522 HA ASN 68 HA ASN 68 -15.682 -7.830 1.969
523 HB2 ASN 68 HB2 ASN 68 -14.457 -8.051 4.234
524 HB3 ASN 68 HB3 ASN 68 -14.502 -6.288 4.278
525 HD21 ASN 68 HD21 ASN 68 -15.785 -6.680 6.267
526 HD22 ASN 68 HD22 ASN 68 -17.489 -7.132 6.108
527 H ARG 69 H ARG 69 -14.446 -6.223 -0.015
528 HA ARG 69 HA ARG 69 -14.691 -4.346 -1.226
529 HB2 ARG 69 HB2 ARG 69 -17.370 -4.043 0.131
530 HB3 ARG 69 HB3 ARG 69 -16.876 -3.385 -1.429
531 HG2 ARG 69 HG2 ARG 69 -16.584 -5.723 -2.302
532 HG3 ARG 69 HG3 ARG 69 -17.167 -6.342 -0.748
533 HD2 ARG 69 HD2 ARG 69 -19.046 -6.374 -2.189
534 HD3 ARG 69 HD3 ARG 69 -19.293 -5.021 -1.085
535 HE ARG 69 HE ARG 69 -18.967 -3.492 -2.828
536 HH11 ARG 69 HH11 ARG 69 -18.487 -6.811 -4.046
537 HH12 ARG 69 HH12 ARG 69 -18.568 -6.315 -5.722
538 HH21 ARG 69 HH21 ARG 69 -19.057 -2.901 -5.016
539 HH22 ARG 69 HH22 ARG 69 -18.874 -4.109 -6.267
540 H LEU 70 H LEU 70 -13.549 -3.910 1.593
541 HA LEU 70 HA LEU 70 -14.613 -1.591 2.694
542 HB2 LEU 70 HB2 LEU 70 -13.274 -3.395 3.733
543 HB3 LEU 70 HB3 LEU 70 -11.814 -2.737 3.041
544 HG LEU 70 HG LEU 70 -12.300 -2.373 5.494
545 HD11 LEU 70 HD11 LEU 70 -11.753 0.198 3.991
546 HD12 LEU 70 HD12 LEU 70 -10.573 -1.081 4.332
547 HD13 LEU 70 HD13 LEU 70 -11.329 -0.201 5.664
548 HD21 LEU 70 HD21 LEU 70 -13.731 -0.587 6.230
549 HD22 LEU 70 HD22 LEU 70 -14.689 -1.731 5.284
550 HD23 LEU 70 HD23 LEU 70 -14.188 -0.181 4.566
551 H ALA 71 H ALA 71 -12.290 -1.728 0.134
552 HA ALA 71 HA ALA 71 -11.304 -0.209 -1.223
553 HB1 ALA 71 HB1 ALA 71 -12.256 1.924 -1.611
554 HB2 ALA 71 HB2 ALA 71 -13.574 0.789 -1.291
555 HB3 ALA 71 HB3 ALA 71 -13.065 1.938 -0.036
556 H MET 72 H MET 72 -10.088 2.109 -1.172
557 HA MET 72 HA MET 72 -8.753 2.632 1.381
558 HB2 MET 72 HB2 MET 72 -7.475 0.736 0.738
559 HB3 MET 72 HB3 MET 72 -7.336 1.277 -0.938
560 HG2 MET 72 HG2 MET 72 -5.801 2.996 -0.379
561 HG3 MET 72 HG3 MET 72 -6.121 2.846 1.358
562 HE1 MET 72 HE1 MET 72 -2.365 1.593 0.057
563 HE2 MET 72 HE2 MET 72 -3.476 2.465 -1.009
564 HE3 MET 72 HE3 MET 72 -3.211 3.044 0.655
565 HA PRO 73 HA PRO 73 -8.160 6.527 -0.950
566 HB2 PRO 73 HB2 PRO 73 -7.499 8.163 1.097
567 HB3 PRO 73 HB3 PRO 73 -9.149 7.478 0.955
568 HG2 PRO 73 HG2 PRO 73 -6.841 6.459 2.649
569 HG3 PRO 73 HG3 PRO 73 -8.529 6.779 3.165
570 HD2 PRO 73 HD2 PRO 73 -7.605 4.292 2.429
571 HD3 PRO 73 HD3 PRO 73 -9.296 4.813 2.158
572 H ASN 74 H ASN 74 -6.369 7.910 -1.569
573 HA ASN 74 HA ASN 74 -3.652 6.859 -1.266
574 HB2 ASN 74 HB2 ASN 74 -4.451 7.986 -3.365
575 HB3 ASN 74 HB3 ASN 74 -4.750 9.443 -2.473
576 HD21 ASN 74 HD21 ASN 74 -1.950 7.112 -3.032
577 HD22 ASN 74 HD22 ASN 74 -0.855 8.445 -3.315
578 H MET 75 H MET 75 -5.597 9.231 0.460
579 HA MET 75 HA MET 75 -5.216 10.759 2.026
580 HB2 MET 75 HB2 MET 75 -2.635 9.340 2.764
581 HB3 MET 75 HB3 MET 75 -3.534 10.514 3.722
582 HG2 MET 75 HG2 MET 75 -4.457 7.733 2.908
583 HG3 MET 75 HG3 MET 75 -3.899 8.220 4.501
584 HE1 MET 75 HE1 MET 75 -5.352 10.992 5.090
585 HE2 MET 75 HE2 MET 75 -6.804 10.376 5.908
586 HE3 MET 75 HE3 MET 75 -5.225 9.612 6.207
587 H ARG 76 H ARG 76 -1.748 10.555 1.505
588 HA ARG 76 HA ARG 76 -1.720 12.826 -0.381
589 HB2 ARG 76 HB2 ARG 76 -0.326 12.921 2.325
590 HB3 ARG 76 HB3 ARG 76 0.017 14.024 0.991
591 HG2 ARG 76 HG2 ARG 76 -2.331 14.824 1.015
592 HG3 ARG 76 HG3 ARG 76 -2.663 13.773 2.402
593 HD2 ARG 76 HD2 ARG 76 -2.279 16.033 3.181
594 HD3 ARG 76 HD3 ARG 76 -0.998 14.972 3.753
595 HE ARG 76 HE ARG 76 0.562 16.019 2.372
596 HH11 ARG 76 HH11 ARG 76 -2.655 17.469 1.823
597 HH12 ARG 76 HH12 ARG 76 -1.995 18.843 0.965
598 HH21 ARG 76 HH21 ARG 76 1.363 17.831 1.297
599 HH22 ARG 76 HH22 ARG 76 0.278 19.062 0.695
600 H LEU 77 H LEU 77 -1.025 9.923 -0.485
601 HA LEU 77 HA LEU 77 1.890 9.745 -0.567
602 HB2 LEU 77 HB2 LEU 77 -0.416 7.869 -0.918
603 HB3 LEU 77 HB3 LEU 77 1.088 7.411 -1.657
604 HG LEU 77 HG LEU 77 0.592 6.476 0.595
605 HD11 LEU 77 HD11 LEU 77 2.802 6.321 -0.313
606 HD12 LEU 77 HD12 LEU 77 2.921 6.678 1.415
607 HD13 LEU 77 HD13 LEU 77 3.198 7.964 0.225
608 HD21 LEU 77 HD21 LEU 77 -0.221 8.522 1.733
609 HD22 LEU 77 HD22 LEU 77 1.419 9.213 1.648
610 HD23 LEU 77 HD23 LEU 77 1.117 7.749 2.601
611 H GLY 78 H GLY 78 2.162 11.549 -1.990
612 HA2 GLY 78 HA2 GLY 78 2.203 10.884 -4.889
613 HA3 GLY 78 HA3 GLY 78 2.833 12.349 -4.131
614 H ASP 79 H ASP 79 4.507 11.338 -5.866
615 HA ASP 79 HA ASP 79 6.070 9.106 -5.548
616 HB2 ASP 79 HB2 ASP 79 6.699 11.896 -6.568
617 HB3 ASP 79 HB3 ASP 79 7.933 10.644 -6.552
618 H ALA 80 H ALA 80 6.705 12.175 -3.770
619 HA ALA 80 HA ALA 80 9.199 11.230 -2.656
620 HB1 ALA 80 HB1 ALA 80 8.753 13.588 -3.148
621 HB2 ALA 80 HB2 ALA 80 7.458 13.618 -1.930
622 HB3 ALA 80 HB3 ALA 80 9.140 13.365 -1.431
623 H GLU 81 H GLU 81 5.908 10.855 -1.553
624 HA GLU 81 HA GLU 81 6.803 9.916 1.154
625 HB2 GLU 81 HB2 GLU 81 4.012 10.134 -0.009
626 HB3 GLU 81 HB3 GLU 81 4.409 9.627 1.632
627 HG2 GLU 81 HG2 GLU 81 4.876 12.390 0.466
628 HG3 GLU 81 HG3 GLU 81 3.517 11.925 1.477
629 H VAL 82 H VAL 82 5.431 8.781 -1.950
630 HA VAL 82 HA VAL 82 4.955 6.059 -1.204
631 HB VAL 82 HB VAL 82 5.494 7.393 -3.879
632 HG11 VAL 82 HG11 VAL 82 6.161 5.063 -4.192
633 HG12 VAL 82 HG12 VAL 82 4.689 4.498 -3.367
634 HG13 VAL 82 HG13 VAL 82 4.586 5.323 -4.938
635 HG21 VAL 82 HG21 VAL 82 2.952 6.148 -2.741
636 HG22 VAL 82 HG22 VAL 82 3.331 7.876 -2.647
637 HG23 VAL 82 HG23 VAL 82 3.113 7.112 -4.222
638 H SER 83 H SER 83 7.848 7.524 -2.776
639 HA SER 83 HA SER 83 9.434 5.158 -2.801
640 HB2 SER 83 HB2 SER 83 11.373 6.803 -2.794
641 HB3 SER 83 HB3 SER 83 10.175 6.986 -4.087
642 HG SER 83 HG SER 83 9.403 8.778 -3.208
643 H ALA 84 H ALA 84 8.744 7.356 -0.107
644 HA ALA 84 HA ALA 84 10.724 6.151 1.659
645 HB1 ALA 84 HB1 ALA 84 8.387 8.001 2.220
646 HB2 ALA 84 HB2 ALA 84 9.632 7.511 3.393
647 HB3 ALA 84 HB3 ALA 84 10.079 8.470 1.976
648 H LEU 85 H LEU 85 7.167 5.640 1.174
649 HA LEU 85 HA LEU 85 6.997 3.599 3.225
650 HB2 LEU 85 HB2 LEU 85 5.299 4.590 0.959
651 HB3 LEU 85 HB3 LEU 85 5.024 2.931 1.430
652 HG LEU 85 HG LEU 85 3.480 4.460 2.515
653 HD11 LEU 85 HD11 LEU 85 3.593 3.581 4.746
654 HD12 LEU 85 HD12 LEU 85 5.323 3.233 4.602
655 HD13 LEU 85 HD13 LEU 85 4.155 2.316 3.631
656 HD21 LEU 85 HD21 LEU 85 4.140 5.961 4.289
657 HD22 LEU 85 HD22 LEU 85 4.960 6.428 2.785
658 HD23 LEU 85 HD23 LEU 85 5.857 5.573 4.055
659 H ILE 86 H ILE 86 7.980 3.496 -0.116
660 HA ILE 86 HA ILE 86 8.100 0.571 -0.353
661 HB ILE 86 HB ILE 86 8.692 2.942 -2.069
662 HG12 ILE 86 HG12 ILE 86 7.383 1.724 -3.678
663 HG13 ILE 86 HG13 ILE 86 7.452 0.239 -2.729
664 HG21 ILE 86 HG21 ILE 86 9.751 1.523 -3.802
665 HG22 ILE 86 HG22 ILE 86 10.788 1.782 -2.400
666 HG23 ILE 86 HG23 ILE 86 9.939 0.226 -2.608
667 HD11 ILE 86 HD11 ILE 86 5.936 2.755 -1.923
668 HD12 ILE 86 HD12 ILE 86 5.230 1.303 -2.637
669 HD13 ILE 86 HD13 ILE 86 5.955 1.213 -1.030
670 H SER 87 H SER 87 10.306 3.163 0.605
671 HA SER 87 HA SER 87 12.596 1.412 1.054
672 HB2 SER 87 HB2 SER 87 11.944 4.140 2.208
673 HB3 SER 87 HB3 SER 87 13.493 3.284 2.346
674 HG SER 87 HG SER 87 12.229 4.353 0.041
675 H TYR 88 H TYR 88 9.951 2.664 3.216
676 HA TYR 88 HA TYR 88 10.849 1.453 5.524
677 HB2 TYR 88 HB2 TYR 88 8.891 2.937 5.436
678 HB3 TYR 88 HB3 TYR 88 7.961 1.723 4.597
679 HD1 TYR 88 HD1 TYR 88 10.230 1.188 7.555
680 HD2 TYR 88 HD2 TYR 88 6.165 1.375 6.112
681 HE1 TYR 88 HE1 TYR 88 9.453 0.078 9.601
682 HE2 TYR 88 HE2 TYR 88 5.386 0.293 8.226
683 HH TYR 88 HH TYR 88 7.730 -1.037 10.573
684 H LEU 89 H LEU 89 8.632 -0.158 3.161
685 HA LEU 89 HA LEU 89 8.442 -2.535 4.725
686 HB2 LEU 89 HB2 LEU 89 7.694 -1.763 1.914
687 HB3 LEU 89 HB3 LEU 89 7.785 -3.471 2.323
688 HG LEU 89 HG LEU 89 6.196 -3.209 4.162
689 HD11 LEU 89 HD11 LEU 89 6.524 -0.850 4.768
690 HD12 LEU 89 HD12 LEU 89 4.832 -1.168 4.373
691 HD13 LEU 89 HD13 LEU 89 5.876 -0.340 3.191
692 HD21 LEU 89 HD21 LEU 89 5.429 -3.817 1.911
693 HD22 LEU 89 HD22 LEU 89 5.206 -2.101 1.501
694 HD23 LEU 89 HD23 LEU 89 4.201 -2.869 2.763
695 H GLU 90 H GLU 90 10.637 -1.920 1.905
696 HA GLU 90 HA GLU 90 11.837 -4.535 2.084
697 HB2 GLU 90 HB2 GLU 90 12.507 -1.948 0.704
698 HB3 GLU 90 HB3 GLU 90 13.761 -3.175 0.812
699 HG2 GLU 90 HG2 GLU 90 11.001 -3.804 -0.303
700 HG3 GLU 90 HG3 GLU 90 12.332 -3.200 -1.294
701 H GLU 91 H GLU 91 12.570 -1.546 3.877
702 HA GLU 91 HA GLU 91 15.041 -2.713 4.980
703 HB2 GLU 91 HB2 GLU 91 13.518 -0.178 5.656
704 HB3 GLU 91 HB3 GLU 91 15.007 -0.720 6.449
705 HG2 GLU 91 HG2 GLU 91 16.195 -0.743 4.283
706 HG3 GLU 91 HG3 GLU 91 14.755 -0.176 3.457
707 H GLU 92 H GLU 92 11.660 -2.310 6.177
708 HA GLU 92 HA GLU 92 12.209 -3.500 8.751
709 HB2 GLU 92 HB2 GLU 92 10.170 -2.095 8.002
710 HB3 GLU 92 HB3 GLU 92 9.573 -3.570 7.245
711 HG2 GLU 92 HG2 GLU 92 8.486 -3.578 9.291
712 HG3 GLU 92 HG3 GLU 92 9.850 -4.633 9.638
713 H THR 93 H THR 93 11.246 -4.880 5.592
714 HA THR 93 HA THR 93 10.909 -7.606 6.330
715 HB THR 93 HB THR 93 12.123 -6.519 3.753
716 HG1 THR 93 HG1 THR 93 10.064 -5.713 4.073
717 HG21 THR 93 HG21 THR 93 11.232 -8.597 2.737
718 HG22 THR 93 HG22 THR 93 10.746 -9.176 4.351
719 HG23 THR 93 HG23 THR 93 12.462 -8.944 3.951
720 H ALA 94 H ALA 94 13.934 -5.821 5.659
721 HA ALA 94 HA ALA 94 15.645 -8.131 5.810
722 HB1 ALA 94 HB1 ALA 94 16.224 -5.160 6.061
723 HB2 ALA 94 HB2 ALA 94 17.452 -6.433 5.890
724 HB3 ALA 94 HB3 ALA 94 16.285 -6.147 4.588
725 H ARG 95 H ARG 95 14.069 -6.414 8.377
726 HA ARG 95 HA ARG 95 15.878 -7.735 10.376
727 HB2 ARG 95 HB2 ARG 95 13.871 -5.488 10.681
728 HB3 ARG 95 HB3 ARG 95 14.457 -6.457 12.039
729 HG2 ARG 95 HG2 ARG 95 15.907 -4.633 12.061
730 HG3 ARG 95 HG3 ARG 95 16.832 -5.913 11.290
731 HD2 ARG 95 HD2 ARG 95 15.835 -4.722 9.058
732 HD3 ARG 95 HD3 ARG 95 15.736 -3.355 10.161
733 HE ARG 95 HE ARG 95 18.278 -4.297 10.554
734 HH11 ARG 95 HH11 ARG 95 16.513 -3.337 7.602
735 HH12 ARG 95 HH12 ARG 95 17.977 -2.899 6.751
736 HH21 ARG 95 HH21 ARG 95 20.145 -3.726 9.396
737 HH22 ARG 95 HH22 ARG 95 20.020 -3.113 7.763
738 H LEU 96 H LEU 96 12.478 -7.513 9.399
739 HA LEU 96 HA LEU 96 10.716 -8.860 9.509
740 HB2 LEU 96 HB2 LEU 96 12.643 -10.479 8.693
741 HB3 LEU 96 HB3 LEU 96 12.384 -11.268 10.199
742 HG LEU 96 HG LEU 96 11.301 -12.464 8.523
743 HD11 LEU 96 HD11 LEU 96 10.089 -12.095 10.671
744 HD12 LEU 96 HD12 LEU 96 9.061 -12.559 9.292
745 HD13 LEU 96 HD13 LEU 96 9.108 -10.862 9.825
746 HD21 LEU 96 HD21 LEU 96 11.243 -10.680 6.878
747 HD22 LEU 96 HD22 LEU 96 9.909 -9.887 7.739
748 HD23 LEU 96 HD23 LEU 96 9.663 -11.491 6.997
749 H GLN 97 H GLN 97 12.850 -9.472 12.275
750 HA GLN 97 HA GLN 97 10.702 -10.115 14.136
751 HB2 GLN 97 HB2 GLN 97 13.683 -9.633 14.498
752 HB3 GLN 97 HB3 GLN 97 12.599 -10.203 15.772
753 HG2 GLN 97 HG2 GLN 97 12.132 -12.268 14.577
754 HG3 GLN 97 HG3 GLN 97 13.001 -11.709 13.151
755 HE21 GLN 97 HE21 GLN 97 15.075 -12.485 12.938
756 HE22 GLN 97 HE22 GLN 97 16.076 -12.954 14.311
757 H THR 98 H THR 98 10.667 -7.402 12.814
758 HA THR 98 HA THR 98 10.542 -5.648 15.242
759 HB THR 98 HB THR 98 11.194 -3.778 13.681
760 HG1 THR 98 HG1 THR 98 11.489 -4.209 11.693
761 HG21 THR 98 HG21 THR 98 12.853 -4.762 15.196
762 HG22 THR 98 HG22 THR 98 13.581 -4.293 13.650
763 HG23 THR 98 HG23 THR 98 13.245 -6.004 13.992
764 HA PRO 99 HA PRO 99 6.501 -5.533 12.731
765 HB2 PRO 99 HB2 PRO 99 4.766 -7.077 14.122
766 HB3 PRO 99 HB3 PRO 99 6.043 -7.824 13.117
767 HG2 PRO 99 HG2 PRO 99 6.217 -7.196 16.103
768 HG3 PRO 99 HG3 PRO 99 6.415 -8.792 15.316
769 HD2 PRO 99 HD2 PRO 99 8.569 -7.251 15.825
770 HD3 PRO 99 HD3 PRO 99 8.430 -8.166 14.290
771 H VAL 100 H VAL 100 7.707 -3.896 14.996
772 HA VAL 100 HA VAL 100 5.554 -3.428 16.936
773 HB VAL 100 HB VAL 100 8.460 -2.588 16.770
774 HG11 VAL 100 HG11 VAL 100 6.489 -2.094 19.056
775 HG12 VAL 100 HG12 VAL 100 8.238 -1.794 19.091
776 HG13 VAL 100 HG13 VAL 100 7.214 -0.831 18.033
777 HG21 VAL 100 HG21 VAL 100 6.986 -4.538 18.587
778 HG22 VAL 100 HG22 VAL 100 8.097 -4.971 17.271
779 HG23 VAL 100 HG23 VAL 100 8.707 -4.121 18.690
780 H THR 101 H THR 101 4.157 -1.896 16.824
781 HA THR 101 HA THR 101 4.584 0.577 15.192
782 HB THR 101 HB THR 101 2.281 0.214 14.248
783 HG1 THR 101 HG1 THR 101 1.216 -1.301 15.160
784 HG21 THR 101 HG21 THR 101 2.940 -1.352 12.528
785 HG22 THR 101 HG22 THR 101 4.261 -1.984 13.532
786 HG23 THR 101 HG23 THR 101 4.320 -0.315 12.930
787 H ASN 102 H ASN 102 3.135 -0.803 18.032
788 HA ASN 102 HA ASN 102 2.027 0.000 19.772
789 HB2 ASN 102 HB2 ASN 102 4.052 1.562 19.502
790 HB3 ASN 102 HB3 ASN 102 2.910 2.786 18.968
791 HD21 ASN 102 HD21 ASN 102 4.113 3.769 20.919
792 HD22 ASN 102 HD22 ASN 102 3.411 3.449 22.512
793 H ARG 103 H ARG 103 0.480 1.799 20.635
794 HA ARG 103 HA ARG 103 -1.704 2.513 18.739
795 HB2 ARG 103 HB2 ARG 103 -2.235 0.382 19.926
796 HB3 ARG 103 HB3 ARG 103 -2.098 1.227 21.474
797 HG2 ARG 103 HG2 ARG 103 -3.971 2.720 20.827
798 HG3 ARG 103 HG3 ARG 103 -4.091 1.911 19.258
799 HD2 ARG 103 HD2 ARG 103 -4.478 0.566 21.970
800 HD3 ARG 103 HD3 ARG 103 -5.790 1.152 20.933
801 HE ARG 103 HE ARG 103 -4.292 -0.545 19.318
802 HH11 ARG 103 HH11 ARG 103 -6.125 -0.907 22.356
803 HH12 ARG 103 HH12 ARG 103 -6.498 -2.590 22.050
804 HH21 ARG 103 HH21 ARG 103 -4.808 -2.726 18.962
805 HH22 ARG 103 HH22 ARG 103 -5.759 -3.614 20.131
806 H GLY 104 H GLY 104 -2.735 4.509 19.258
807 HA2 GLY 104 HA2 GLY 104 -3.245 6.265 20.862
808 HA3 GLY 104 HA3 GLY 104 -1.682 6.029 21.623
809 H ILE 105 H ILE 105 -1.628 8.375 21.405
810 HA ILE 105 HA ILE 105 -1.351 10.415 20.467
811 HB ILE 105 HB ILE 105 0.259 9.078 18.280
812 HG12 ILE 105 HG12 ILE 105 1.199 8.443 20.452
813 HG13 ILE 105 HG13 ILE 105 2.246 9.548 19.586
814 HG21 ILE 105 HG21 ILE 105 -0.252 11.359 17.656
815 HG22 ILE 105 HG22 ILE 105 0.133 11.961 19.274
816 HG23 ILE 105 HG23 ILE 105 1.412 11.319 18.218
817 HD11 ILE 105 HD11 ILE 105 2.176 10.070 21.973
818 HD12 ILE 105 HD12 ILE 105 1.539 11.425 21.037
819 HD13 ILE 105 HD13 ILE 105 0.425 10.337 21.900
820 HA PRO 106 HA PRO 106 -4.879 9.598 17.598
821 HB2 PRO 106 HB2 PRO 106 -6.888 10.804 18.975
822 HB3 PRO 106 HB3 PRO 106 -6.282 9.158 19.319
823 HG2 PRO 106 HG2 PRO 106 -5.574 11.733 20.727
824 HG3 PRO 106 HG3 PRO 106 -6.023 10.165 21.451
825 HD2 PRO 106 HD2 PRO 106 -3.416 10.966 21.143
826 HD3 PRO 106 HD3 PRO 106 -3.918 9.253 21.038
827 HHA HEC 107 HHA HEC 107 -4.524 -3.721 -0.145
828 HHB HEC 107 HHB HEC 107 0.464 0.017 1.507
829 HHC HEC 107 HHC HEC 107 -3.662 3.892 4.672
830 HHD HEC 107 HHD HEC 107 -8.252 -0.588 4.080
831 HMA1 HEC 107 HMA1 HEC 107 0.829 -1.457 -0.891
832 HMA2 HEC 107 HMA2 HEC 107 1.237 -2.107 0.719
833 HMA3 HEC 107 HMA3 HEC 107 0.734 -3.195 -0.564
834 HAA1 HEC 107 HAA1 HEC 107 -1.039 -4.722 -0.279
835 HAA2 HEC 107 HAA2 HEC 107 -2.732 -4.755 -0.662
836 HBA1 HEC 107 HBA1 HEC 107 -2.364 -3.714 -2.826
837 HBA2 HEC 107 HBA2 HEC 107 -0.639 -3.498 -2.472
838 HMB1 HEC 107 HMB1 HEC 107 1.482 1.970 1.866
839 HMB2 HEC 107 HMB2 HEC 107 1.332 3.491 2.724
840 HMB3 HEC 107 HMB3 HEC 107 1.628 2.006 3.637
841 HAB HEC 107 HAB HEC 107 -1.841 4.817 4.644
842 HBB1 HEC 107 HBB1 HEC 107 -1.823 5.373 2.255
843 HBB2 HEC 107 HBB2 HEC 107 -0.920 6.498 3.288
844 HBB3 HEC 107 HBB3 HEC 107 -0.045 5.299 2.311
845 HMC1 HEC 107 HMC1 HEC 107 -5.561 4.063 6.596
846 HMC2 HEC 107 HMC2 HEC 107 -5.853 4.836 5.018
847 HMC3 HEC 107 HMC3 HEC 107 -7.207 4.245 5.969
848 HAC HEC 107 HAC HEC 107 -8.505 0.528 5.924
849 HBC1 HEC 107 HBC1 HEC 107 -9.185 3.412 5.277
850 HBC2 HEC 107 HBC2 HEC 107 -9.620 1.983 4.321
851 HBC3 HEC 107 HBC3 HEC 107 -10.276 2.199 5.951
852 HMD1 HEC 107 HMD1 HEC 107 -9.036 -2.890 3.725
853 HMD2 HEC 107 HMD2 HEC 107 -9.638 -2.121 2.233
854 HMD3 HEC 107 HMD3 HEC 107 -9.227 -3.846 2.262
855 HAD1 HEC 107 HAD1 HEC 107 -8.160 -4.476 0.363
856 HAD2 HEC 107 HAD2 HEC 107 -6.593 -4.446 -0.389
857 HBD1 HEC 107 HBD1 HEC 107 -7.299 -5.754 2.256
858 HBD2 HEC 107 HBD2 HEC 107 -6.816 -6.541 0.753
Start of MODEL 20
1 H SER 1 H SER 1 14.564 4.640 7.887
2 HA SER 1 HA SER 1 13.141 5.254 5.815
3 HB2 SER 1 HB2 SER 1 12.934 2.734 5.312
4 HB3 SER 1 HB3 SER 1 14.528 3.443 5.600
5 HG SER 1 HG SER 1 14.397 1.544 6.776
6 H GLY 2 H GLY 2 11.233 6.230 5.856
7 HA2 GLY 2 HA2 GLY 2 9.007 6.434 5.451
8 HA3 GLY 2 HA3 GLY 2 8.858 4.724 5.420
9 H GLU 3 H GLU 3 9.994 5.242 8.484
10 HA GLU 3 HA GLU 3 7.616 4.137 9.470
11 HB2 GLU 3 HB2 GLU 3 9.833 3.675 10.341
12 HB3 GLU 3 HB3 GLU 3 9.978 5.318 10.981
13 HG2 GLU 3 HG2 GLU 3 8.233 4.920 12.608
14 HG3 GLU 3 HG3 GLU 3 7.769 3.403 11.823
15 H GLN 4 H GLN 4 8.781 7.500 10.103
16 HA GLN 4 HA GLN 4 6.582 8.272 11.752
17 HB2 GLN 4 HB2 GLN 4 8.686 9.530 11.597
18 HB3 GLN 4 HB3 GLN 4 8.395 9.858 9.890
19 HG2 GLN 4 HG2 GLN 4 7.923 11.829 11.169
20 HG3 GLN 4 HG3 GLN 4 6.425 11.249 10.469
21 HE21 GLN 4 HE21 GLN 4 5.425 12.667 12.120
22 HE22 GLN 4 HE22 GLN 4 5.286 12.104 13.781
23 H ILE 5 H ILE 5 6.905 8.129 8.212
24 HA ILE 5 HA ILE 5 4.452 9.580 7.632
25 HB ILE 5 HB ILE 5 5.892 7.563 5.848
26 HG12 ILE 5 HG12 ILE 5 6.386 10.570 6.090
27 HG13 ILE 5 HG13 ILE 5 7.494 9.296 6.604
28 HG21 ILE 5 HG21 ILE 5 3.554 8.237 5.172
29 HG22 ILE 5 HG22 ILE 5 4.064 9.932 5.181
30 HG23 ILE 5 HG23 ILE 5 4.765 8.776 4.023
31 HD11 ILE 5 HD11 ILE 5 6.723 9.980 3.765
32 HD12 ILE 5 HD12 ILE 5 8.319 10.015 4.531
33 HD13 ILE 5 HD13 ILE 5 7.529 8.457 4.219
34 H PHE 6 H PHE 6 5.302 6.072 7.916
35 HA PHE 6 HA PHE 6 2.656 5.152 7.393
36 HB2 PHE 6 HB2 PHE 6 4.726 3.735 7.406
37 HB3 PHE 6 HB3 PHE 6 4.724 3.802 9.165
38 HD1 PHE 6 HD1 PHE 6 2.901 2.605 6.157
39 HD2 PHE 6 HD2 PHE 6 3.085 2.491 10.463
40 HE1 PHE 6 HE1 PHE 6 1.243 0.756 6.182
41 HE2 PHE 6 HE2 PHE 6 1.417 0.650 10.482
42 HZ PHE 6 HZ PHE 6 0.495 -0.219 8.347
43 H ARG 7 H ARG 7 4.210 5.925 10.583
44 HA ARG 7 HA ARG 7 1.866 5.306 12.102
45 HB2 ARG 7 HB2 ARG 7 4.146 5.389 12.964
46 HB3 ARG 7 HB3 ARG 7 4.172 7.151 12.801
47 HG2 ARG 7 HG2 ARG 7 2.528 7.445 14.501
48 HG3 ARG 7 HG3 ARG 7 2.019 5.756 14.441
49 HD2 ARG 7 HD2 ARG 7 4.769 6.670 15.379
50 HD3 ARG 7 HD3 ARG 7 3.401 6.396 16.463
51 HE ARG 7 HE ARG 7 5.081 4.395 15.191
52 HH11 ARG 7 HH11 ARG 7 1.852 4.892 16.643
53 HH12 ARG 7 HH12 ARG 7 1.633 3.188 16.970
54 HH21 ARG 7 HH21 ARG 7 4.734 2.200 15.640
55 HH22 ARG 7 HH22 ARG 7 3.252 1.677 16.407
56 H THR 8 H THR 8 2.654 8.255 10.316
57 HA THR 8 HA THR 8 0.384 9.664 11.613
58 HB THR 8 HB THR 8 1.101 11.640 10.248
59 HG1 THR 8 HG1 THR 8 3.449 10.132 9.831
60 HG21 THR 8 HG21 THR 8 3.049 12.158 11.633
61 HG22 THR 8 HG22 THR 8 3.214 10.446 12.094
62 HG23 THR 8 HG23 THR 8 1.788 11.377 12.598
63 H ARG 9 H ARG 9 0.940 8.101 8.528
64 HA ARG 9 HA ARG 9 -1.684 9.219 7.577
65 HB2 ARG 9 HB2 ARG 9 0.591 8.030 5.961
66 HB3 ARG 9 HB3 ARG 9 -0.865 8.784 5.327
67 HG2 ARG 9 HG2 ARG 9 1.364 10.188 6.860
68 HG3 ARG 9 HG3 ARG 9 1.061 10.257 5.126
69 HD2 ARG 9 HD2 ARG 9 -1.143 11.338 5.554
70 HD3 ARG 9 HD3 ARG 9 -0.800 11.306 7.295
71 HE ARG 9 HE ARG 9 1.159 12.620 5.509
72 HH11 ARG 9 HH11 ARG 9 -1.444 13.082 7.912
73 HH12 ARG 9 HH12 ARG 9 -0.996 14.745 8.216
74 HH21 ARG 9 HH21 ARG 9 1.696 14.764 5.943
75 HH22 ARG 9 HH22 ARG 9 0.774 15.695 7.103
76 H CYS 10 H CYS 10 -0.069 6.141 8.228
77 HA CYS 10 HA CYS 10 -2.275 4.673 6.830
78 HB2 CYS 10 HB2 CYS 10 0.682 4.096 6.677
79 HB3 CYS 10 HB3 CYS 10 -0.595 3.237 5.823
80 H SER 11 H SER 11 -1.232 5.022 9.863
81 HA SER 11 HA SER 11 -0.730 2.210 10.578
82 HB2 SER 11 HB2 SER 11 0.565 3.816 11.648
83 HB3 SER 11 HB3 SER 11 -0.820 4.852 12.041
84 HG SER 11 HG SER 11 -0.247 2.293 13.162
85 H SER 12 H SER 12 -3.539 4.334 10.587
86 HA SER 12 HA SER 12 -4.951 3.258 12.717
87 HB2 SER 12 HB2 SER 12 -6.270 4.309 10.211
88 HB3 SER 12 HB3 SER 12 -6.845 4.424 11.884
89 HG SER 12 HG SER 12 -5.744 6.276 10.744
90 H CYS 13 H CYS 13 -4.580 1.624 9.665
91 HA CYS 13 HA CYS 13 -6.846 -0.220 10.355
92 HB2 CYS 13 HB2 CYS 13 -6.018 0.589 7.570
93 HB3 CYS 13 HB3 CYS 13 -7.426 -0.354 8.039
94 H HIS 14 H HIS 14 -3.510 -0.254 9.980
95 HA HIS 14 HA HIS 14 -3.351 -3.111 9.779
96 HB2 HIS 14 2HB HIS 14 -1.651 -2.774 7.661
97 HB3 HIS 14 3HB HIS 14 -3.326 -3.283 7.552
98 HD1 HIS 14 1HD HIS 14 -2.198 0.444 7.879
99 HD2 HIS 14 2HD HIS 14 -3.884 -2.419 5.317
100 HE1 HIS 14 1HE HIS 14 -2.998 1.739 5.902
101 H THR 15 H THR 15 -1.121 -3.859 9.572
102 HA THR 15 HA THR 15 1.014 -1.954 10.352
103 HB THR 15 HB THR 15 2.024 -3.331 11.952
104 HG1 THR 15 HG1 THR 15 0.042 -5.253 11.320
105 HG21 THR 15 HG21 THR 15 0.079 -1.960 12.761
106 HG22 THR 15 HG22 THR 15 0.567 -3.302 13.792
107 HG23 THR 15 HG23 THR 15 -0.887 -3.454 12.774
108 H VAL 16 H VAL 16 3.216 -3.144 10.084
109 HA VAL 16 HA VAL 16 3.130 -4.869 7.623
110 HB VAL 16 HB VAL 16 5.346 -2.961 8.403
111 HG11 VAL 16 HG11 VAL 16 5.939 -4.836 6.843
112 HG12 VAL 16 HG12 VAL 16 4.606 -4.338 5.771
113 HG13 VAL 16 HG13 VAL 16 5.984 -3.257 6.054
114 HG21 VAL 16 HG21 VAL 16 3.424 -1.565 8.011
115 HG22 VAL 16 HG22 VAL 16 4.295 -1.589 6.473
116 HG23 VAL 16 HG23 VAL 16 2.823 -2.576 6.713
117 H GLY 17 H GLY 17 2.620 -6.440 9.202
118 HA2 GLY 17 HA2 GLY 17 3.149 -8.395 10.334
119 HA3 GLY 17 HA3 GLY 17 4.857 -8.102 10.013
120 H ASN 18 H ASN 18 3.216 -5.518 11.706
121 HA ASN 18 HA ASN 18 5.110 -6.069 13.917
122 HB2 ASN 18 HB2 ASN 18 5.055 -3.971 12.355
123 HB3 ASN 18 HB3 ASN 18 3.742 -3.429 13.387
124 HD21 ASN 18 HD21 ASN 18 4.387 -2.258 15.199
125 HD22 ASN 18 HD22 ASN 18 6.022 -2.320 15.865
126 H THR 19 H THR 19 1.625 -5.609 13.513
127 HA THR 19 HA THR 19 -0.133 -5.519 14.911
128 HB THR 19 HB THR 19 1.590 -7.151 16.794
129 HG1 THR 19 HG1 THR 19 1.307 -8.244 14.960
130 HG21 THR 19 HG21 THR 19 -0.341 -6.337 18.067
131 HG22 THR 19 HG22 THR 19 -0.563 -8.030 17.645
132 HG23 THR 19 HG23 THR 19 -1.438 -6.785 16.730
133 H GLU 20 H GLU 20 -1.137 -4.490 16.861
134 HA GLU 20 HA GLU 20 0.508 -2.235 17.883
135 HB2 GLU 20 HB2 GLU 20 -0.692 -1.747 15.628
136 HB3 GLU 20 HB3 GLU 20 -2.185 -1.864 16.541
137 HG2 GLU 20 HG2 GLU 20 -1.702 0.433 16.377
138 HG3 GLU 20 HG3 GLU 20 -1.363 -0.009 18.047
139 HA PRO 21 HA PRO 21 -2.427 -2.779 21.357
140 HB2 PRO 21 HB2 PRO 21 -1.641 -0.696 22.929
141 HB3 PRO 21 HB3 PRO 21 -0.714 -2.221 22.784
142 HG2 PRO 21 HG2 PRO 21 -0.215 0.395 21.343
143 HG3 PRO 21 HG3 PRO 21 0.971 -0.657 22.180
144 HD2 PRO 21 HD2 PRO 21 0.559 -0.730 19.476
145 HD3 PRO 21 HD3 PRO 21 1.013 -2.182 20.407
146 H GLY 22 H GLY 22 -4.145 -2.401 20.017
147 HA2 GLY 22 HA2 GLY 22 -5.738 -0.023 20.270
148 HA3 GLY 22 HA3 GLY 22 -4.905 -0.037 18.709
149 H GLN 23 H GLN 23 -6.087 -0.945 17.116
150 HA GLN 23 HA GLN 23 -6.929 -3.680 17.488
151 HB2 GLN 23 HB2 GLN 23 -9.009 -2.430 18.198
152 HB3 GLN 23 HB3 GLN 23 -9.139 -1.830 16.549
153 HG2 GLN 23 HG2 GLN 23 -9.215 -4.223 15.751
154 HG3 GLN 23 HG3 GLN 23 -9.120 -4.749 17.435
155 HE21 GLN 23 HE21 GLN 23 -11.162 -5.902 16.736
156 HE22 GLN 23 HE22 GLN 23 -12.676 -5.005 16.899
157 HA PRO 24 HA PRO 24 -5.237 -3.265 13.217
158 HB2 PRO 24 HB2 PRO 24 -4.249 -5.907 14.263
159 HB3 PRO 24 HB3 PRO 24 -3.420 -4.742 13.176
160 HG2 PRO 24 HG2 PRO 24 -2.723 -4.896 15.769
161 HG3 PRO 24 HG3 PRO 24 -2.962 -3.284 15.005
162 HD2 PRO 24 HD2 PRO 24 -4.927 -4.872 16.704
163 HD3 PRO 24 HD3 PRO 24 -4.438 -3.157 16.866
164 H GLY 25 H GLY 25 -5.520 -5.136 11.538
165 HA2 GLY 25 HA2 GLY 25 -6.687 -6.914 10.642
166 HA3 GLY 25 HA3 GLY 25 -7.650 -7.069 12.106
167 H ILE 26 H ILE 26 -7.719 -3.863 10.860
168 HA ILE 26 HA ILE 26 -10.396 -4.099 9.668
169 HB ILE 26 HB ILE 26 -8.385 -1.827 9.675
170 HG12 ILE 26 HG12 ILE 26 -10.979 -2.222 11.237
171 HG13 ILE 26 HG13 ILE 26 -9.360 -2.426 11.899
172 HG21 ILE 26 HG21 ILE 26 -11.287 -1.800 8.708
173 HG22 ILE 26 HG22 ILE 26 -10.215 -0.392 8.809
174 HG23 ILE 26 HG23 ILE 26 -9.859 -1.667 7.667
175 HD11 ILE 26 HD11 ILE 26 -8.876 -0.017 11.416
176 HD12 ILE 26 HD12 ILE 26 -10.580 0.189 10.946
177 HD13 ILE 26 HD13 ILE 26 -10.170 -0.289 12.597
178 H GLY 27 H GLY 27 -7.030 -3.784 8.520
179 HA2 GLY 27 HA2 GLY 27 -7.782 -5.305 6.075
180 HA3 GLY 27 HA3 GLY 27 -6.628 -3.968 5.991
181 HA PRO 28 HA PRO 28 -4.548 -8.116 7.071
182 HB2 PRO 28 HB2 PRO 28 -3.156 -8.557 4.762
183 HB3 PRO 28 HB3 PRO 28 -4.873 -9.031 4.943
184 HG2 PRO 28 HG2 PRO 28 -3.776 -6.470 3.714
185 HG3 PRO 28 HG3 PRO 28 -4.943 -7.612 2.985
186 HD2 PRO 28 HD2 PRO 28 -5.789 -5.391 4.276
187 HD3 PRO 28 HD3 PRO 28 -6.673 -6.930 4.480
188 H ASP 29 H ASP 29 -2.243 -8.374 7.516
189 HA ASP 29 HA ASP 29 -0.858 -5.802 7.780
190 HB2 ASP 29 HB2 ASP 29 -0.038 -8.602 8.598
191 HB3 ASP 29 HB3 ASP 29 0.973 -7.173 8.797
192 H LEU 30 H LEU 30 0.713 -5.040 6.586
193 HA LEU 30 HA LEU 30 0.697 -5.990 3.861
194 HB2 LEU 30 HB2 LEU 30 2.159 -3.555 4.896
195 HB3 LEU 30 HB3 LEU 30 1.520 -3.820 3.287
196 HG LEU 30 HG LEU 30 -0.159 -3.424 5.809
197 HD11 LEU 30 HD11 LEU 30 -0.689 -1.233 4.841
198 HD12 LEU 30 HD12 LEU 30 0.390 -1.559 3.457
199 HD13 LEU 30 HD13 LEU 30 1.053 -1.399 5.096
200 HD21 LEU 30 HD21 LEU 30 -0.938 -3.602 2.853
201 HD22 LEU 30 HD22 LEU 30 -2.043 -3.189 4.184
202 HD23 LEU 30 HD23 LEU 30 -1.333 -4.796 4.105
203 H LEU 31 H LEU 31 2.455 -7.521 5.747
204 HA LEU 31 HA LEU 31 5.180 -6.982 4.812
205 HB2 LEU 31 HB2 LEU 31 6.021 -8.225 6.421
206 HB3 LEU 31 HB3 LEU 31 4.629 -7.529 7.155
207 HG LEU 31 HG LEU 31 4.824 -9.765 7.899
208 HD11 LEU 31 HD11 LEU 31 2.647 -10.682 7.288
209 HD12 LEU 31 HD12 LEU 31 2.595 -9.637 5.845
210 HD13 LEU 31 HD13 LEU 31 2.548 -8.914 7.462
211 HD21 LEU 31 HD21 LEU 31 4.510 -10.890 5.112
212 HD22 LEU 31 HD22 LEU 31 5.098 -11.673 6.579
213 HD23 LEU 31 HD23 LEU 31 6.106 -10.456 5.744
214 H GLY 32 H GLY 32 6.457 -8.255 3.483
215 HA2 GLY 32 HA2 GLY 32 6.936 -9.801 1.814
216 HA3 GLY 32 HA3 GLY 32 5.526 -10.721 2.329
217 H VAL 33 H VAL 33 3.934 -7.967 1.518
218 HA VAL 33 HA VAL 33 3.077 -8.847 -0.998
219 HB VAL 33 HB VAL 33 1.963 -6.757 -1.212
220 HG11 VAL 33 HG11 VAL 33 1.941 -7.519 1.731
221 HG12 VAL 33 HG12 VAL 33 0.651 -6.734 0.807
222 HG13 VAL 33 HG13 VAL 33 1.096 -8.403 0.439
223 HG21 VAL 33 HG21 VAL 33 2.249 -4.910 0.454
224 HG22 VAL 33 HG22 VAL 33 3.728 -5.710 1.024
225 HG23 VAL 33 HG23 VAL 33 3.622 -5.112 -0.639
226 H THR 34 H THR 34 5.880 -6.994 -0.218
227 HA THR 34 HA THR 34 6.709 -5.826 -2.662
228 HB THR 34 HB THR 34 8.988 -6.010 -1.528
229 HG1 THR 34 HG1 THR 34 9.179 -7.283 0.163
230 HG21 THR 34 HG21 THR 34 7.456 -4.148 -0.967
231 HG22 THR 34 HG22 THR 34 8.497 -4.652 0.374
232 HG23 THR 34 HG23 THR 34 6.788 -5.125 0.366
233 H ARG 35 H ARG 35 6.862 -9.173 -1.544
234 HA ARG 35 HA ARG 35 8.199 -9.997 -4.086
235 HB2 ARG 35 HB2 ARG 35 8.787 -12.095 -2.928
236 HB3 ARG 35 HB3 ARG 35 9.537 -10.640 -2.275
237 HG2 ARG 35 HG2 ARG 35 7.990 -10.615 -0.388
238 HG3 ARG 35 HG3 ARG 35 7.116 -12.021 -1.043
239 HD2 ARG 35 HD2 ARG 35 9.096 -13.425 -0.739
240 HD3 ARG 35 HD3 ARG 35 10.058 -12.016 -0.266
241 HE ARG 35 HE ARG 35 9.134 -12.017 1.835
242 HH11 ARG 35 HH11 ARG 35 7.294 -14.356 -0.139
243 HH12 ARG 35 HH12 ARG 35 6.441 -14.997 1.248
244 HH21 ARG 35 HH21 ARG 35 8.006 -12.868 3.579
245 HH22 ARG 35 HH22 ARG 35 6.843 -14.153 3.352
246 H GLN 36 H GLN 36 5.229 -10.354 -2.291
247 HA GLN 36 HA GLN 36 4.306 -12.609 -3.926
248 HB2 GLN 36 HB2 GLN 36 2.914 -10.954 -1.792
249 HB3 GLN 36 HB3 GLN 36 2.240 -12.368 -2.576
250 HG2 GLN 36 HG2 GLN 36 4.672 -12.318 -0.753
251 HG3 GLN 36 HG3 GLN 36 3.090 -12.994 -0.404
252 HE21 GLN 36 HE21 GLN 36 2.370 -14.824 -2.001
253 HE22 GLN 36 HE22 GLN 36 3.659 -15.940 -2.456
254 H ARG 37 H ARG 37 4.088 -9.160 -4.330
255 HA ARG 37 HA ARG 37 2.141 -9.554 -6.587
256 HB2 ARG 37 HB2 ARG 37 2.526 -7.155 -4.753
257 HB3 ARG 37 HB3 ARG 37 1.739 -7.056 -6.315
258 HG2 ARG 37 HG2 ARG 37 0.025 -7.187 -4.737
259 HG3 ARG 37 HG3 ARG 37 0.039 -8.720 -5.600
260 HD2 ARG 37 HD2 ARG 37 1.016 -9.852 -3.670
261 HD3 ARG 37 HD3 ARG 37 1.331 -8.305 -2.870
262 HE ARG 37 HE ARG 37 -0.837 -8.218 -2.153
263 HH11 ARG 37 HH11 ARG 37 -0.670 -10.767 -4.643
264 HH12 ARG 37 HH12 ARG 37 -2.311 -11.298 -4.349
265 HH21 ARG 37 HH21 ARG 37 -2.939 -8.925 -1.813
266 HH22 ARG 37 HH22 ARG 37 -3.596 -10.255 -2.739
267 H ASP 38 H ASP 38 2.523 -7.766 -8.327
268 HA ASP 38 HA ASP 38 5.268 -7.978 -9.263
269 HB2 ASP 38 HB2 ASP 38 2.941 -7.759 -10.575
270 HB3 ASP 38 HB3 ASP 38 3.291 -6.049 -10.470
271 H ALA 39 H ALA 39 6.933 -6.626 -8.954
272 HA ALA 39 HA ALA 39 6.803 -5.046 -6.679
273 HB1 ALA 39 HB1 ALA 39 8.770 -6.229 -7.499
274 HB2 ALA 39 HB2 ALA 39 8.920 -5.102 -8.868
275 HB3 ALA 39 HB3 ALA 39 9.160 -4.525 -7.202
276 H ASN 40 H ASN 40 6.783 -3.859 -10.058
277 HA ASN 40 HA ASN 40 6.778 -1.052 -9.179
278 HB2 ASN 40 HB2 ASN 40 6.572 -2.390 -11.905
279 HB3 ASN 40 HB3 ASN 40 6.466 -0.649 -11.657
280 HD21 ASN 40 HD21 ASN 40 8.677 -3.436 -11.379
281 HD22 ASN 40 HD22 ASN 40 10.119 -2.440 -11.337
282 H TRP 41 H TRP 41 4.254 -3.395 -10.199
283 HA TRP 41 HA TRP 41 2.077 -1.549 -10.402
284 HB2 TRP 41 HB2 TRP 41 1.867 -3.860 -11.138
285 HB3 TRP 41 HB3 TRP 41 2.235 -4.442 -9.514
286 HD1 TRP 41 HD1 TRP 41 -0.650 -3.022 -11.538
287 HE1 TRP 41 HE1 TRP 41 -2.835 -3.263 -10.216
288 HE3 TRP 41 HE3 TRP 41 1.285 -4.708 -7.108
289 HZ2 TRP 41 HZ2 TRP 41 -3.574 -3.695 -7.438
290 HZ3 TRP 41 HZ3 TRP 41 -0.166 -4.864 -5.086
291 HH2 TRP 41 HH2 TRP 41 -2.568 -4.323 -5.242
292 H LEU 42 H LEU 42 3.451 -3.269 -7.580
293 HA LEU 42 HA LEU 42 1.607 -2.533 -5.614
294 HB2 LEU 42 HB2 LEU 42 3.401 -4.177 -5.318
295 HB3 LEU 42 HB3 LEU 42 4.625 -2.923 -5.498
296 HG LEU 42 HG LEU 42 3.888 -1.871 -3.370
297 HD11 LEU 42 HD11 LEU 42 1.537 -2.612 -3.289
298 HD12 LEU 42 HD12 LEU 42 2.408 -3.138 -1.844
299 HD13 LEU 42 HD13 LEU 42 2.062 -4.306 -3.139
300 HD21 LEU 42 HD21 LEU 42 4.833 -3.572 -1.910
301 HD22 LEU 42 HD22 LEU 42 5.709 -3.537 -3.444
302 HD23 LEU 42 HD23 LEU 42 4.530 -4.832 -3.140
303 H VAL 43 H VAL 43 4.346 -0.628 -6.837
304 HA VAL 43 HA VAL 43 4.038 1.523 -4.935
305 HB VAL 43 HB VAL 43 5.455 1.667 -7.608
306 HG11 VAL 43 HG11 VAL 43 5.923 3.128 -4.975
307 HG12 VAL 43 HG12 VAL 43 6.858 3.341 -6.469
308 HG13 VAL 43 HG13 VAL 43 5.167 3.837 -6.423
309 HG21 VAL 43 HG21 VAL 43 6.467 0.560 -4.953
310 HG22 VAL 43 HG22 VAL 43 6.419 -0.244 -6.527
311 HG23 VAL 43 HG23 VAL 43 7.533 1.090 -6.268
312 H ARG 44 H ARG 44 2.800 1.033 -8.287
313 HA ARG 44 HA ARG 44 1.559 3.644 -8.426
314 HB2 ARG 44 HB2 ARG 44 2.105 2.119 -10.359
315 HB3 ARG 44 HB3 ARG 44 0.709 1.125 -9.902
316 HG2 ARG 44 HG2 ARG 44 -0.772 3.118 -10.173
317 HG3 ARG 44 HG3 ARG 44 0.640 4.105 -10.594
318 HD2 ARG 44 HD2 ARG 44 1.067 2.655 -12.559
319 HD3 ARG 44 HD3 ARG 44 -0.341 1.668 -12.127
320 HE ARG 44 HE ARG 44 -0.707 4.579 -12.569
321 HH11 ARG 44 HH11 ARG 44 -1.238 1.279 -13.824
322 HH12 ARG 44 HH12 ARG 44 -2.430 1.810 -14.988
323 HH21 ARG 44 HH21 ARG 44 -2.251 5.211 -14.091
324 HH22 ARG 44 HH22 ARG 44 -3.001 4.028 -15.138
325 H TRP 45 H TRP 45 0.368 0.430 -7.386
326 HA TRP 45 HA TRP 45 -2.317 1.139 -6.804
327 HB2 TRP 45 HB2 TRP 45 -1.731 -1.156 -6.869
328 HB3 TRP 45 HB3 TRP 45 -0.433 -0.953 -5.702
329 HD1 TRP 45 HD1 TRP 45 -0.970 -1.989 -3.517
330 HE1 TRP 45 HE1 TRP 45 -3.031 -2.313 -2.009
331 HE3 TRP 45 HE3 TRP 45 -4.498 0.342 -6.412
332 HZ2 TRP 45 HZ2 TRP 45 -5.839 -1.655 -2.054
333 HZ3 TRP 45 HZ3 TRP 45 -6.844 0.524 -5.624
334 HH2 TRP 45 HH2 TRP 45 -7.526 -0.483 -3.461
335 H LEU 46 H LEU 46 0.446 1.089 -4.450
336 HA LEU 46 HA LEU 46 -1.291 2.339 -2.496
337 HB2 LEU 46 HB2 LEU 46 0.030 1.502 -1.023
338 HB3 LEU 46 HB3 LEU 46 0.912 0.719 -2.320
339 HG LEU 46 HG LEU 46 1.702 3.378 -1.049
340 HD11 LEU 46 HD11 LEU 46 3.492 2.039 -0.003
341 HD12 LEU 46 HD12 LEU 46 2.809 0.558 -0.705
342 HD13 LEU 46 HD13 LEU 46 1.899 1.477 0.515
343 HD21 LEU 46 HD21 LEU 46 3.850 2.952 -2.183
344 HD22 LEU 46 HD22 LEU 46 2.557 3.116 -3.374
345 HD23 LEU 46 HD23 LEU 46 3.165 1.503 -2.951
346 H LYS 47 H LYS 47 0.466 3.717 -5.021
347 HA LYS 47 HA LYS 47 0.677 6.406 -3.878
348 HB2 LYS 47 HB2 LYS 47 2.235 5.635 -5.576
349 HB3 LYS 47 HB3 LYS 47 0.913 5.290 -6.697
350 HG2 LYS 47 HG2 LYS 47 0.393 7.773 -6.713
351 HG3 LYS 47 HG3 LYS 47 1.875 8.028 -5.783
352 HD2 LYS 47 HD2 LYS 47 1.642 6.709 -8.529
353 HD3 LYS 47 HD3 LYS 47 2.146 8.376 -8.238
354 HE2 LYS 47 HE2 LYS 47 4.154 7.640 -7.070
355 HE3 LYS 47 HE3 LYS 47 3.645 5.946 -7.152
356 HZ1 LYS 47 HZ1 LYS 47 5.258 6.582 -8.894
357 HZ2 LYS 47 HZ2 LYS 47 4.155 7.613 -9.553
358 HZ3 LYS 47 HZ3 LYS 47 3.878 5.997 -9.527
359 H VAL 48 H VAL 48 -1.789 4.691 -5.900
360 HA VAL 48 HA VAL 48 -3.568 7.023 -5.461
361 HB VAL 48 HB VAL 48 -2.042 7.519 -7.357
362 HG11 VAL 48 HG11 VAL 48 -2.043 5.276 -8.482
363 HG12 VAL 48 HG12 VAL 48 -3.653 5.661 -9.110
364 HG13 VAL 48 HG13 VAL 48 -2.280 6.687 -9.526
365 HG21 VAL 48 HG21 VAL 48 -5.018 7.605 -7.717
366 HG22 VAL 48 HG22 VAL 48 -3.956 8.822 -7.012
367 HG23 VAL 48 HG23 VAL 48 -3.864 8.492 -8.750
368 HA PRO 49 HA PRO 49 -5.485 2.743 -5.620
369 HB2 PRO 49 HB2 PRO 49 -6.994 2.836 -3.304
370 HB3 PRO 49 HB3 PRO 49 -5.274 2.352 -3.390
371 HG2 PRO 49 HG2 PRO 49 -6.397 5.096 -2.747
372 HG3 PRO 49 HG3 PRO 49 -5.169 4.162 -1.826
373 HD2 PRO 49 HD2 PRO 49 -4.399 6.061 -3.564
374 HD3 PRO 49 HD3 PRO 49 -3.524 4.501 -3.521
375 H ASP 50 H ASP 50 -7.232 5.857 -5.031
376 HA ASP 50 HA ASP 50 -9.792 4.735 -5.883
377 HB2 ASP 50 HB2 ASP 50 -9.625 6.686 -4.355
378 HB3 ASP 50 HB3 ASP 50 -8.953 7.647 -5.671
379 H GLN 51 H GLN 51 -7.187 6.614 -7.530
380 HA GLN 51 HA GLN 51 -8.623 6.765 -10.040
381 HB2 GLN 51 HB2 GLN 51 -6.603 8.166 -9.297
382 HB3 GLN 51 HB3 GLN 51 -5.610 6.772 -9.775
383 HG2 GLN 51 HG2 GLN 51 -6.681 6.942 -12.071
384 HG3 GLN 51 HG3 GLN 51 -7.445 8.442 -11.535
385 HE21 GLN 51 HE21 GLN 51 -5.792 10.223 -10.726
386 HE22 GLN 51 HE22 GLN 51 -4.317 10.292 -11.672
387 H MET 52 H MET 52 -6.345 4.343 -8.685
388 HA MET 52 HA MET 52 -6.195 2.573 -10.911
389 HB2 MET 52 HB2 MET 52 -5.930 2.310 -7.899
390 HB3 MET 52 HB3 MET 52 -5.728 0.908 -8.954
391 HG2 MET 52 HG2 MET 52 -4.155 3.479 -9.279
392 HG3 MET 52 HG3 MET 52 -3.639 2.167 -8.228
393 HE1 MET 52 HE1 MET 52 -3.950 -0.472 -9.449
394 HE2 MET 52 HE2 MET 52 -2.504 -0.642 -10.480
395 HE3 MET 52 HE3 MET 52 -2.380 0.150 -8.897
396 H LEU 53 H LEU 53 -8.578 2.588 -8.158
397 HA LEU 53 HA LEU 53 -10.075 0.364 -9.303
398 HB2 LEU 53 HB2 LEU 53 -10.717 2.400 -7.151
399 HB3 LEU 53 HB3 LEU 53 -11.837 1.127 -7.625
400 HG LEU 53 HG LEU 53 -9.026 0.549 -6.648
401 HD11 LEU 53 HD11 LEU 53 -10.056 -0.001 -4.469
402 HD12 LEU 53 HD12 LEU 53 -11.640 0.527 -5.078
403 HD13 LEU 53 HD13 LEU 53 -10.316 1.700 -4.882
404 HD21 LEU 53 HD21 LEU 53 -9.906 -1.343 -7.845
405 HD22 LEU 53 HD22 LEU 53 -11.431 -1.272 -6.933
406 HD23 LEU 53 HD23 LEU 53 -9.914 -1.700 -6.125
407 H ALA 54 H ALA 54 -10.271 3.887 -9.771
408 HA ALA 54 HA ALA 54 -12.734 3.807 -11.293
409 HB1 ALA 54 HB1 ALA 54 -11.898 5.871 -10.256
410 HB2 ALA 54 HB2 ALA 54 -10.447 5.823 -11.278
411 HB3 ALA 54 HB3 ALA 54 -12.043 6.063 -12.004
412 H GLU 55 H GLU 55 -9.308 3.483 -12.181
413 HA GLU 55 HA GLU 55 -9.683 3.126 -15.037
414 HB2 GLU 55 HB2 GLU 55 -7.582 3.842 -14.083
415 HB3 GLU 55 HB3 GLU 55 -7.459 2.404 -13.076
416 HG2 GLU 55 HG2 GLU 55 -7.043 0.981 -14.938
417 HG3 GLU 55 HG3 GLU 55 -7.517 2.214 -16.100
418 H LYS 56 H LYS 56 -10.302 1.126 -12.316
419 HA LYS 56 HA LYS 56 -10.590 -1.050 -11.900
420 HB2 LYS 56 HB2 LYS 56 -11.662 -1.209 -14.741
421 HB3 LYS 56 HB3 LYS 56 -11.845 -2.442 -13.484
422 HG2 LYS 56 HG2 LYS 56 -12.911 -0.654 -12.019
423 HG3 LYS 56 HG3 LYS 56 -12.955 0.398 -13.438
424 HD2 LYS 56 HD2 LYS 56 -14.446 -1.182 -14.593
425 HD3 LYS 56 HD3 LYS 56 -14.281 -2.346 -13.256
426 HE2 LYS 56 HE2 LYS 56 -15.162 -0.540 -11.705
427 HE3 LYS 56 HE3 LYS 56 -15.539 0.435 -13.131
428 HZ1 LYS 56 HZ1 LYS 56 -16.615 -2.266 -12.540
429 HZ2 LYS 56 HZ2 LYS 56 -17.071 -1.325 -13.838
430 HZ3 LYS 56 HZ3 LYS 56 -17.410 -0.895 -12.260
431 H ASP 57 H ASP 57 -8.179 -0.606 -11.942
432 HA ASP 57 HA ASP 57 -6.518 -2.305 -13.630
433 HB2 ASP 57 HB2 ASP 57 -5.582 -0.304 -12.505
434 HB3 ASP 57 HB3 ASP 57 -5.873 -1.062 -10.932
435 HA PRO 58 HA PRO 58 -8.898 -5.265 -11.887
436 HB2 PRO 58 HB2 PRO 58 -8.137 -7.493 -13.261
437 HB3 PRO 58 HB3 PRO 58 -8.818 -5.971 -13.968
438 HG2 PRO 58 HG2 PRO 58 -5.853 -6.579 -13.739
439 HG3 PRO 58 HG3 PRO 58 -6.790 -6.337 -15.267
440 HD2 PRO 58 HD2 PRO 58 -5.555 -4.325 -14.025
441 HD3 PRO 58 HD3 PRO 58 -7.231 -4.098 -14.611
442 H LEU 59 H LEU 59 -5.489 -5.899 -11.419
443 HA LEU 59 HA LEU 59 -5.647 -7.945 -9.392
444 HB2 LEU 59 HB2 LEU 59 -3.593 -6.953 -10.644
445 HB3 LEU 59 HB3 LEU 59 -3.624 -5.679 -9.454
446 HG LEU 59 HG LEU 59 -1.942 -7.184 -8.851
447 HD11 LEU 59 HD11 LEU 59 -2.417 -8.058 -6.694
448 HD12 LEU 59 HD12 LEU 59 -4.150 -8.158 -7.028
449 HD13 LEU 59 HD13 LEU 59 -3.360 -6.572 -6.879
450 HD21 LEU 59 HD21 LEU 59 -3.901 -9.487 -9.126
451 HD22 LEU 59 HD22 LEU 59 -2.211 -9.613 -8.596
452 HD23 LEU 59 HD23 LEU 59 -2.583 -9.064 -10.243
453 H ALA 60 H ALA 60 -5.894 -4.333 -9.150
454 HA ALA 60 HA ALA 60 -6.167 -4.395 -6.250
455 HB1 ALA 60 HB1 ALA 60 -6.935 -2.111 -6.494
456 HB2 ALA 60 HB2 ALA 60 -5.403 -2.365 -7.357
457 HB3 ALA 60 HB3 ALA 60 -6.937 -2.260 -8.262
458 H MET 61 H MET 61 -8.431 -4.236 -9.004
459 HA MET 61 HA MET 61 -10.890 -4.137 -7.597
460 HB2 MET 61 HB2 MET 61 -10.244 -5.569 -10.194
461 HB3 MET 61 HB3 MET 61 -11.848 -5.153 -9.636
462 HG2 MET 61 HG2 MET 61 -9.672 -3.106 -10.213
463 HG3 MET 61 HG3 MET 61 -10.876 -3.624 -11.379
464 HE1 MET 61 HE1 MET 61 -14.151 -2.207 -10.162
465 HE2 MET 61 HE2 MET 61 -13.255 -3.388 -11.179
466 HE3 MET 61 HE3 MET 61 -13.590 -3.749 -9.468
467 H LEU 62 H LEU 62 -8.759 -6.943 -8.205
468 HA LEU 62 HA LEU 62 -10.564 -8.937 -7.165
469 HB2 LEU 62 HB2 LEU 62 -8.736 -9.283 -8.849
470 HB3 LEU 62 HB3 LEU 62 -7.578 -8.830 -7.588
471 HG LEU 62 HG LEU 62 -8.242 -10.774 -6.259
472 HD11 LEU 62 HD11 LEU 62 -9.880 -11.608 -8.695
473 HD12 LEU 62 HD12 LEU 62 -10.560 -11.145 -7.127
474 HD13 LEU 62 HD13 LEU 62 -9.569 -12.604 -7.265
475 HD21 LEU 62 HD21 LEU 62 -6.342 -10.909 -7.809
476 HD22 LEU 62 HD22 LEU 62 -7.426 -11.431 -9.117
477 HD23 LEU 62 HD23 LEU 62 -7.165 -12.474 -7.699
478 H LEU 63 H LEU 63 -7.744 -7.048 -5.820
479 HA LEU 63 HA LEU 63 -7.752 -8.735 -3.423
480 HB2 LEU 63 HB2 LEU 63 -5.808 -7.811 -2.847
481 HB3 LEU 63 HB3 LEU 63 -5.773 -7.597 -4.579
482 HG LEU 63 HG LEU 63 -6.728 -5.168 -4.010
483 HD11 LEU 63 HD11 LEU 63 -7.010 -5.604 -1.549
484 HD12 LEU 63 HD12 LEU 63 -5.853 -4.309 -1.869
485 HD13 LEU 63 HD13 LEU 63 -5.283 -5.943 -1.428
486 HD21 LEU 63 HD21 LEU 63 -3.858 -5.985 -3.411
487 HD22 LEU 63 HD22 LEU 63 -4.433 -4.349 -3.835
488 HD23 LEU 63 HD23 LEU 63 -4.545 -5.664 -5.017
489 H PHE 64 H PHE 64 -9.153 -5.641 -4.291
490 HA PHE 64 HA PHE 64 -9.543 -4.896 -1.522
491 HB2 PHE 64 HB2 PHE 64 -10.103 -2.902 -2.219
492 HB3 PHE 64 HB3 PHE 64 -9.531 -3.424 -3.774
493 HD1 PHE 64 HD1 PHE 64 -11.385 -4.463 -5.387
494 HD2 PHE 64 HD2 PHE 64 -12.221 -1.989 -1.971
495 HE1 PHE 64 HE1 PHE 64 -13.594 -3.874 -6.365
496 HE2 PHE 64 HE2 PHE 64 -14.417 -1.374 -2.945
497 HZ PHE 64 HZ PHE 64 -15.114 -2.304 -5.140
498 H GLU 65 H GLU 65 -11.799 -6.431 -3.840
499 HA GLU 65 HA GLU 65 -13.955 -6.488 -1.948
500 HB2 GLU 65 HB2 GLU 65 -15.134 -7.824 -3.494
501 HB3 GLU 65 HB3 GLU 65 -14.241 -6.601 -4.381
502 HG2 GLU 65 HG2 GLU 65 -13.591 -8.281 -5.722
503 HG3 GLU 65 HG3 GLU 65 -12.440 -8.691 -4.458
504 H GLN 66 H GLN 66 -11.119 -8.464 -2.092
505 HA GLN 66 HA GLN 66 -12.286 -10.605 -0.474
506 HB2 GLN 66 HB2 GLN 66 -10.356 -10.992 -2.051
507 HB3 GLN 66 HB3 GLN 66 -9.391 -9.850 -1.133
508 HG2 GLN 66 HG2 GLN 66 -8.646 -11.995 -0.522
509 HG3 GLN 66 HG3 GLN 66 -9.523 -11.383 0.866
510 HE21 GLN 66 HE21 GLN 66 -9.197 -13.967 1.056
511 HE22 GLN 66 HE22 GLN 66 -10.591 -14.889 0.488
512 H TYR 67 H TYR 67 -10.310 -7.732 0.082
513 HA TYR 67 HA TYR 67 -10.400 -8.119 3.014
514 HB2 TYR 67 HB2 TYR 67 -8.887 -6.229 1.227
515 HB3 TYR 67 HB3 TYR 67 -8.764 -6.257 2.996
516 HD1 TYR 67 HD1 TYR 67 -8.420 -8.822 3.945
517 HD2 TYR 67 HD2 TYR 67 -7.148 -7.341 0.101
518 HE1 TYR 67 HE1 TYR 67 -6.740 -10.639 3.801
519 HE2 TYR 67 HE2 TYR 67 -5.450 -9.155 -0.035
520 HH TYR 67 HH TYR 67 -5.059 -11.570 2.596
521 H ASN 68 H ASN 68 -12.748 -7.970 2.528
522 HA ASN 68 HA ASN 68 -14.724 -7.041 2.953
523 HB2 ASN 68 HB2 ASN 68 -13.258 -6.736 5.068
524 HB3 ASN 68 HB3 ASN 68 -13.256 -5.027 4.663
525 HD21 ASN 68 HD21 ASN 68 -14.303 -4.872 6.811
526 HD22 ASN 68 HD22 ASN 68 -16.059 -5.032 6.834
527 H ARG 69 H ARG 69 -13.496 -5.919 0.549
528 HA ARG 69 HA ARG 69 -13.569 -4.188 -0.916
529 HB2 ARG 69 HB2 ARG 69 -15.741 -3.677 -1.706
530 HB3 ARG 69 HB3 ARG 69 -15.660 -5.362 -1.223
531 HG2 ARG 69 HG2 ARG 69 -16.942 -4.928 0.802
532 HG3 ARG 69 HG3 ARG 69 -16.923 -3.180 0.491
533 HD2 ARG 69 HD2 ARG 69 -18.150 -3.561 -1.636
534 HD3 ARG 69 HD3 ARG 69 -18.209 -5.300 -1.282
535 HE ARG 69 HE ARG 69 -19.285 -4.044 0.958
536 HH11 ARG 69 HH11 ARG 69 -20.112 -4.188 -2.509
537 HH12 ARG 69 HH12 ARG 69 -21.821 -3.946 -2.219
538 HH21 ARG 69 HH21 ARG 69 -21.508 -3.732 1.287
539 HH22 ARG 69 HH22 ARG 69 -22.609 -3.689 -0.071
540 H LEU 70 H LEU 70 -12.679 -3.090 1.601
541 HA LEU 70 HA LEU 70 -14.205 -0.915 2.475
542 HB2 LEU 70 HB2 LEU 70 -12.425 -2.166 3.669
543 HB3 LEU 70 HB3 LEU 70 -11.201 -1.317 2.728
544 HG LEU 70 HG LEU 70 -13.193 0.271 4.385
545 HD11 LEU 70 HD11 LEU 70 -10.683 -1.021 5.472
546 HD12 LEU 70 HD12 LEU 70 -12.351 -1.448 5.903
547 HD13 LEU 70 HD13 LEU 70 -11.719 0.150 6.317
548 HD21 LEU 70 HD21 LEU 70 -11.582 1.538 2.936
549 HD22 LEU 70 HD22 LEU 70 -10.235 0.695 3.712
550 HD23 LEU 70 HD23 LEU 70 -11.273 1.804 4.642
551 H ALA 71 H ALA 71 -11.529 -0.848 0.145
552 HA ALA 71 HA ALA 71 -10.765 0.615 -1.338
553 HB1 ALA 71 HB1 ALA 71 -12.815 0.421 -2.463
554 HB2 ALA 71 HB2 ALA 71 -13.635 1.528 -1.358
555 HB3 ALA 71 HB3 ALA 71 -12.397 2.137 -2.484
556 H MET 72 H MET 72 -9.403 1.232 0.393
557 HA MET 72 HA MET 72 -9.613 3.642 1.862
558 HB2 MET 72 HB2 MET 72 -7.260 3.326 2.303
559 HB3 MET 72 HB3 MET 72 -8.026 1.740 2.265
560 HG2 MET 72 HG2 MET 72 -7.255 1.556 -0.172
561 HG3 MET 72 HG3 MET 72 -6.358 3.053 0.079
562 HE1 MET 72 HE1 MET 72 -3.476 0.564 -0.219
563 HE2 MET 72 HE2 MET 72 -4.980 0.748 -1.143
564 HE3 MET 72 HE3 MET 72 -4.074 2.186 -0.625
565 HA PRO 73 HA PRO 73 -8.258 6.654 -1.251
566 HB2 PRO 73 HB2 PRO 73 -7.838 8.826 0.267
567 HB3 PRO 73 HB3 PRO 73 -9.451 8.054 0.222
568 HG2 PRO 73 HG2 PRO 73 -7.268 7.690 2.305
569 HG3 PRO 73 HG3 PRO 73 -9.001 8.068 2.575
570 HD2 PRO 73 HD2 PRO 73 -7.958 5.505 2.651
571 HD3 PRO 73 HD3 PRO 73 -9.641 5.868 2.166
572 H ASN 74 H ASN 74 -6.459 7.996 -1.946
573 HA ASN 74 HA ASN 74 -3.716 7.268 -1.414
574 HB2 ASN 74 HB2 ASN 74 -4.192 8.358 -3.495
575 HB3 ASN 74 HB3 ASN 74 -5.189 9.580 -2.746
576 HD21 ASN 74 HD21 ASN 74 -1.877 8.747 -3.561
577 HD22 ASN 74 HD22 ASN 74 -1.209 10.283 -3.064
578 H MET 75 H MET 75 -5.935 9.454 0.158
579 HA MET 75 HA MET 75 -5.897 10.775 1.940
580 HB2 MET 75 HB2 MET 75 -5.087 8.893 3.207
581 HB3 MET 75 HB3 MET 75 -3.416 9.244 2.788
582 HG2 MET 75 HG2 MET 75 -3.996 9.955 5.072
583 HG3 MET 75 HG3 MET 75 -3.410 11.265 4.066
584 HE1 MET 75 HE1 MET 75 -7.777 10.739 5.545
585 HE2 MET 75 HE2 MET 75 -7.067 9.605 4.380
586 HE3 MET 75 HE3 MET 75 -6.406 9.725 6.030
587 H ARG 76 H ARG 76 -2.351 10.773 1.514
588 HA ARG 76 HA ARG 76 -2.430 13.595 0.580
589 HB2 ARG 76 HB2 ARG 76 -1.287 12.733 3.271
590 HB3 ARG 76 HB3 ARG 76 -0.866 14.257 2.491
591 HG2 ARG 76 HG2 ARG 76 -3.233 14.968 2.493
592 HG3 ARG 76 HG3 ARG 76 -3.678 13.468 3.318
593 HD2 ARG 76 HD2 ARG 76 -3.551 15.212 4.943
594 HD3 ARG 76 HD3 ARG 76 -2.231 14.070 5.231
595 HE ARG 76 HE ARG 76 -1.037 15.942 3.658
596 HH11 ARG 76 HH11 ARG 76 -2.969 16.289 6.639
597 HH12 ARG 76 HH12 ARG 76 -2.125 17.738 7.138
598 HH21 ARG 76 HH21 ARG 76 0.030 17.817 4.349
599 HH22 ARG 76 HH22 ARG 76 -0.432 18.601 5.843
600 H LEU 77 H LEU 77 -1.222 10.800 -0.288
601 HA LEU 77 HA LEU 77 1.660 11.330 0.028
602 HB2 LEU 77 HB2 LEU 77 0.196 8.972 -1.197
603 HB3 LEU 77 HB3 LEU 77 1.929 9.085 -0.921
604 HG LEU 77 HG LEU 77 -0.205 9.027 1.250
605 HD11 LEU 77 HD11 LEU 77 0.130 6.874 0.136
606 HD12 LEU 77 HD12 LEU 77 0.869 6.831 1.753
607 HD13 LEU 77 HD13 LEU 77 1.889 7.015 0.312
608 HD21 LEU 77 HD21 LEU 77 1.688 8.796 2.825
609 HD22 LEU 77 HD22 LEU 77 1.726 10.366 2.017
610 HD23 LEU 77 HD23 LEU 77 2.834 9.071 1.497
611 H GLY 78 H GLY 78 3.073 12.014 -1.366
612 HA2 GLY 78 HA2 GLY 78 2.588 11.865 -4.322
613 HA3 GLY 78 HA3 GLY 78 3.593 13.076 -3.526
614 H ASP 79 H ASP 79 4.943 11.897 -5.432
615 HA ASP 79 HA ASP 79 5.855 9.248 -5.165
616 HB2 ASP 79 HB2 ASP 79 7.066 11.678 -6.520
617 HB3 ASP 79 HB3 ASP 79 7.883 10.128 -6.523
618 H ALA 80 H ALA 80 7.229 12.112 -3.475
619 HA ALA 80 HA ALA 80 9.702 10.716 -2.772
620 HB1 ALA 80 HB1 ALA 80 8.453 13.218 -1.559
621 HB2 ALA 80 HB2 ALA 80 10.117 12.653 -1.338
622 HB3 ALA 80 HB3 ALA 80 9.576 13.194 -2.931
623 H GLU 81 H GLU 81 6.620 11.340 -1.084
624 HA GLU 81 HA GLU 81 7.368 9.981 1.371
625 HB2 GLU 81 HB2 GLU 81 4.555 10.485 0.315
626 HB3 GLU 81 HB3 GLU 81 5.049 10.140 1.967
627 HG2 GLU 81 HG2 GLU 81 4.831 12.386 2.172
628 HG3 GLU 81 HG3 GLU 81 6.515 12.365 1.652
629 H VAL 82 H VAL 82 5.561 8.995 -1.555
630 HA VAL 82 HA VAL 82 5.021 6.273 -0.866
631 HB VAL 82 HB VAL 82 5.541 7.689 -3.505
632 HG11 VAL 82 HG11 VAL 82 4.603 5.701 -4.656
633 HG12 VAL 82 HG12 VAL 82 6.179 5.386 -3.947
634 HG13 VAL 82 HG13 VAL 82 4.711 4.790 -3.136
635 HG21 VAL 82 HG21 VAL 82 3.129 7.375 -3.815
636 HG22 VAL 82 HG22 VAL 82 3.014 6.487 -2.277
637 HG23 VAL 82 HG23 VAL 82 3.435 8.212 -2.297
638 H SER 83 H SER 83 7.956 7.738 -2.365
639 HA SER 83 HA SER 83 9.338 5.257 -2.644
640 HB2 SER 83 HB2 SER 83 10.492 8.056 -2.363
641 HB3 SER 83 HB3 SER 83 11.363 6.613 -2.920
642 HG SER 83 HG SER 83 9.124 7.899 -4.110
643 H ALA 84 H ALA 84 9.189 7.458 0.178
644 HA ALA 84 HA ALA 84 11.135 5.961 1.735
645 HB1 ALA 84 HB1 ALA 84 8.939 7.915 2.521
646 HB2 ALA 84 HB2 ALA 84 10.229 7.322 3.596
647 HB3 ALA 84 HB3 ALA 84 10.634 8.310 2.186
648 H LEU 85 H LEU 85 7.545 5.818 1.456
649 HA LEU 85 HA LEU 85 7.202 3.732 3.422
650 HB2 LEU 85 HB2 LEU 85 5.522 4.700 1.083
651 HB3 LEU 85 HB3 LEU 85 4.982 3.429 2.172
652 HG LEU 85 HG LEU 85 5.718 6.235 3.132
653 HD11 LEU 85 HD11 LEU 85 2.988 5.021 2.505
654 HD12 LEU 85 HD12 LEU 85 3.804 6.321 1.603
655 HD13 LEU 85 HD13 LEU 85 3.275 6.599 3.267
656 HD21 LEU 85 HD21 LEU 85 5.825 4.572 4.934
657 HD22 LEU 85 HD22 LEU 85 4.237 3.922 4.462
658 HD23 LEU 85 HD23 LEU 85 4.380 5.563 5.122
659 H ILE 86 H ILE 86 8.183 3.602 0.073
660 HA ILE 86 HA ILE 86 7.849 0.745 -0.339
661 HB ILE 86 HB ILE 86 9.003 3.020 -1.792
662 HG12 ILE 86 HG12 ILE 86 8.130 1.758 -3.705
663 HG13 ILE 86 HG13 ILE 86 7.839 0.351 -2.682
664 HG21 ILE 86 HG21 ILE 86 11.133 1.819 -1.657
665 HG22 ILE 86 HG22 ILE 86 10.337 0.309 -2.175
666 HG23 ILE 86 HG23 ILE 86 10.457 1.694 -3.276
667 HD11 ILE 86 HD11 ILE 86 5.743 1.520 -3.084
668 HD12 ILE 86 HD12 ILE 86 6.142 1.710 -1.382
669 HD13 ILE 86 HD13 ILE 86 6.432 3.046 -2.521
670 H SER 87 H SER 87 10.564 2.759 0.884
671 HA SER 87 HA SER 87 12.279 0.531 1.521
672 HB2 SER 87 HB2 SER 87 12.162 3.297 2.787
673 HB3 SER 87 HB3 SER 87 13.457 2.106 2.987
674 HG SER 87 HG SER 87 13.980 3.631 1.468
675 H TYR 88 H TYR 88 9.689 2.209 3.441
676 HA TYR 88 HA TYR 88 10.144 0.688 5.826
677 HB2 TYR 88 HB2 TYR 88 8.715 2.687 5.643
678 HB3 TYR 88 HB3 TYR 88 7.516 1.770 4.751
679 HD1 TYR 88 HD1 TYR 88 9.412 1.665 8.012
680 HD2 TYR 88 HD2 TYR 88 5.696 0.911 5.972
681 HE1 TYR 88 HE1 TYR 88 8.334 1.161 10.188
682 HE2 TYR 88 HE2 TYR 88 4.628 0.362 8.159
683 HH TYR 88 HH TYR 88 6.433 0.510 11.243
684 H LEU 89 H LEU 89 8.024 -0.117 3.009
685 HA LEU 89 HA LEU 89 7.100 -2.578 4.162
686 HB2 LEU 89 HB2 LEU 89 6.894 -1.209 1.516
687 HB3 LEU 89 HB3 LEU 89 6.769 -2.961 1.483
688 HG LEU 89 HG LEU 89 4.956 -2.941 3.137
689 HD11 LEU 89 HD11 LEU 89 3.794 -0.843 3.712
690 HD12 LEU 89 HD12 LEU 89 5.067 0.096 2.889
691 HD13 LEU 89 HD13 LEU 89 5.446 -0.850 4.345
692 HD21 LEU 89 HD21 LEU 89 3.223 -2.030 1.663
693 HD22 LEU 89 HD22 LEU 89 4.456 -2.883 0.723
694 HD23 LEU 89 HD23 LEU 89 4.452 -1.106 0.758
695 H GLU 90 H GLU 90 9.740 -2.104 1.712
696 HA GLU 90 HA GLU 90 10.732 -4.736 1.685
697 HB2 GLU 90 HB2 GLU 90 12.023 -2.001 1.499
698 HB3 GLU 90 HB3 GLU 90 13.035 -3.433 1.493
699 HG2 GLU 90 HG2 GLU 90 10.720 -3.228 -0.453
700 HG3 GLU 90 HG3 GLU 90 12.238 -2.381 -0.749
701 H GLU 91 H GLU 91 11.677 -2.160 4.090
702 HA GLU 91 HA GLU 91 13.550 -4.025 5.291
703 HB2 GLU 91 HB2 GLU 91 12.712 -1.222 6.094
704 HB3 GLU 91 HB3 GLU 91 13.965 -2.188 6.890
705 HG2 GLU 91 HG2 GLU 91 15.277 -2.322 4.838
706 HG3 GLU 91 HG3 GLU 91 14.059 -1.400 3.960
707 H GLU 92 H GLU 92 10.283 -2.867 6.395
708 HA GLU 92 HA GLU 92 10.552 -4.357 8.905
709 HB2 GLU 92 HB2 GLU 92 8.047 -3.356 7.522
710 HB3 GLU 92 HB3 GLU 92 8.140 -4.016 9.154
711 HG2 GLU 92 HG2 GLU 92 9.389 -1.423 8.177
712 HG3 GLU 92 HG3 GLU 92 8.011 -1.623 9.254
713 H THR 93 H THR 93 9.697 -5.239 5.634
714 HA THR 93 HA THR 93 8.800 -7.943 6.340
715 HB THR 93 HB THR 93 9.788 -6.832 3.688
716 HG1 THR 93 HG1 THR 93 7.949 -5.897 3.995
717 HG21 THR 93 HG21 THR 93 9.957 -9.289 3.814
718 HG22 THR 93 HG22 THR 93 8.705 -8.765 2.692
719 HG23 THR 93 HG23 THR 93 8.258 -9.394 4.311
720 H ALA 94 H ALA 94 11.979 -6.458 5.410
721 HA ALA 94 HA ALA 94 13.460 -8.876 5.450
722 HB1 ALA 94 HB1 ALA 94 14.431 -6.118 6.306
723 HB2 ALA 94 HB2 ALA 94 15.422 -7.481 5.765
724 HB3 ALA 94 HB3 ALA 94 14.321 -6.691 4.630
725 H ARG 95 H ARG 95 12.649 -6.691 8.166
726 HA ARG 95 HA ARG 95 13.811 -8.314 10.245
727 HB2 ARG 95 HB2 ARG 95 11.712 -6.127 10.197
728 HB3 ARG 95 HB3 ARG 95 12.093 -7.001 11.685
729 HG2 ARG 95 HG2 ARG 95 14.484 -6.421 11.449
730 HG3 ARG 95 HG3 ARG 95 14.114 -5.458 10.002
731 HD2 ARG 95 HD2 ARG 95 12.774 -3.907 11.292
732 HD3 ARG 95 HD3 ARG 95 12.785 -4.977 12.700
733 HE ARG 95 HE ARG 95 14.875 -4.280 13.300
734 HH11 ARG 95 HH11 ARG 95 14.207 -2.936 10.059
735 HH12 ARG 95 HH12 ARG 95 15.606 -1.887 10.103
736 HH21 ARG 95 HH21 ARG 95 16.661 -2.919 13.306
737 HH22 ARG 95 HH22 ARG 95 16.999 -1.881 11.939
738 H LEU 96 H LEU 96 11.064 -8.988 8.333
739 HA LEU 96 HA LEU 96 9.957 -10.936 10.271
740 HB2 LEU 96 HB2 LEU 96 8.565 -9.335 8.789
741 HB3 LEU 96 HB3 LEU 96 8.902 -10.412 7.484
742 HG LEU 96 HG LEU 96 6.826 -11.044 8.183
743 HD11 LEU 96 HD11 LEU 96 6.965 -13.179 9.315
744 HD12 LEU 96 HD12 LEU 96 8.588 -12.782 9.906
745 HD13 LEU 96 HD13 LEU 96 8.305 -13.000 8.159
746 HD21 LEU 96 HD21 LEU 96 6.808 -9.588 10.153
747 HD22 LEU 96 HD22 LEU 96 7.726 -10.808 11.061
748 HD23 LEU 96 HD23 LEU 96 6.082 -11.172 10.492
749 H GLN 97 H GLN 97 12.022 -12.013 10.294
750 HA GLN 97 HA GLN 97 13.502 -13.586 9.832
751 HB2 GLN 97 HB2 GLN 97 11.214 -15.065 8.535
752 HB3 GLN 97 HB3 GLN 97 12.610 -15.719 9.389
753 HG2 GLN 97 HG2 GLN 97 10.317 -14.182 10.655
754 HG3 GLN 97 HG3 GLN 97 10.558 -15.915 10.707
755 HE21 GLN 97 HE21 GLN 97 10.224 -14.324 13.008
756 HE22 GLN 97 HE22 GLN 97 11.719 -14.434 13.936
757 H THR 98 H THR 98 13.479 -11.602 7.649
758 HA THR 98 HA THR 98 14.841 -13.260 5.549
759 HB THR 98 HB THR 98 13.186 -10.883 4.718
760 HG1 THR 98 HG1 THR 98 11.829 -12.324 5.883
761 HG21 THR 98 HG21 THR 98 13.923 -13.520 3.361
762 HG22 THR 98 HG22 THR 98 14.749 -11.972 3.096
763 HG23 THR 98 HG23 THR 98 13.058 -12.163 2.611
764 HA PRO 99 HA PRO 99 17.227 -9.520 7.108
765 HB2 PRO 99 HB2 PRO 99 19.206 -10.624 8.591
766 HB3 PRO 99 HB3 PRO 99 17.537 -10.503 9.213
767 HG2 PRO 99 HG2 PRO 99 18.824 -12.901 7.851
768 HG3 PRO 99 HG3 PRO 99 17.991 -12.854 9.437
769 HD2 PRO 99 HD2 PRO 99 16.692 -13.575 7.148
770 HD3 PRO 99 HD3 PRO 99 15.899 -12.643 8.449
771 H VAL 100 H VAL 100 17.573 -11.649 4.755
772 HA VAL 100 HA VAL 100 20.263 -12.043 4.167
773 HB VAL 100 HB VAL 100 18.144 -13.092 3.239
774 HG11 VAL 100 HG11 VAL 100 17.169 -12.272 1.213
775 HG12 VAL 100 HG12 VAL 100 17.030 -11.013 2.447
776 HG13 VAL 100 HG13 VAL 100 18.258 -10.877 1.162
777 HG21 VAL 100 HG21 VAL 100 19.193 -13.736 1.120
778 HG22 VAL 100 HG22 VAL 100 20.319 -12.365 1.224
779 HG23 VAL 100 HG23 VAL 100 20.393 -13.681 2.418
780 H THR 101 H THR 101 18.400 -9.136 3.667
781 HA THR 101 HA THR 101 20.273 -7.807 1.857
782 HB THR 101 HB THR 101 18.677 -5.879 2.232
783 HG1 THR 101 HG1 THR 101 16.917 -6.212 3.434
784 HG21 THR 101 HG21 THR 101 18.331 -7.509 0.367
785 HG22 THR 101 HG22 THR 101 16.817 -6.836 0.995
786 HG23 THR 101 HG23 THR 101 17.300 -8.486 1.438
787 H ASN 102 H ASN 102 20.261 -8.226 5.278
788 HA ASN 102 HA ASN 102 21.200 -5.615 6.044
789 HB2 ASN 102 HB2 ASN 102 21.496 -8.365 7.310
790 HB3 ASN 102 HB3 ASN 102 22.144 -6.900 8.041
791 HD21 ASN 102 HD21 ASN 102 20.193 -8.556 9.291
792 HD22 ASN 102 HD22 ASN 102 18.763 -7.524 9.473
793 H ARG 103 H ARG 103 23.237 -4.826 6.378
794 HA ARG 103 HA ARG 103 25.135 -4.092 5.616
795 HB2 ARG 103 HB2 ARG 103 25.994 -6.163 6.722
796 HB3 ARG 103 HB3 ARG 103 26.061 -6.933 5.141
797 HG2 ARG 103 HG2 ARG 103 28.241 -6.181 5.873
798 HG3 ARG 103 HG3 ARG 103 27.791 -5.343 4.401
799 HD2 ARG 103 HD2 ARG 103 27.379 -4.102 7.154
800 HD3 ARG 103 HD3 ARG 103 28.935 -4.020 6.315
801 HE ARG 103 HE ARG 103 27.276 -3.094 4.401
802 HH11 ARG 103 HH11 ARG 103 27.657 -2.115 7.811
803 HH12 ARG 103 HH12 ARG 103 27.140 -0.473 7.499
804 HH21 ARG 103 HH21 ARG 103 26.610 -0.969 4.049
805 HH22 ARG 103 HH22 ARG 103 26.547 0.175 5.371
806 H GLY 104 H GLY 104 23.148 -5.755 3.410
807 HA2 GLY 104 HA2 GLY 104 24.365 -4.574 0.999
808 HA3 GLY 104 HA3 GLY 104 22.727 -5.218 1.182
809 H ILE 105 H ILE 105 21.636 -3.839 3.192
810 HA ILE 105 HA ILE 105 20.747 -1.380 2.332
811 HB ILE 105 HB ILE 105 21.041 -2.459 5.138
812 HG12 ILE 105 HG12 ILE 105 18.579 -2.253 3.334
813 HG13 ILE 105 HG13 ILE 105 19.593 -3.686 3.410
814 HG21 ILE 105 HG21 ILE 105 19.318 -0.810 5.841
815 HG22 ILE 105 HG22 ILE 105 20.786 -0.004 5.331
816 HG23 ILE 105 HG23 ILE 105 19.385 -0.055 4.238
817 HD11 ILE 105 HD11 ILE 105 17.735 -4.086 4.832
818 HD12 ILE 105 HD12 ILE 105 19.148 -3.844 5.877
819 HD13 ILE 105 HD13 ILE 105 17.938 -2.548 5.680
820 HA PRO 106 HA PRO 106 24.241 1.438 3.012
821 HB2 PRO 106 HB2 PRO 106 22.107 3.561 2.970
822 HB3 PRO 106 HB3 PRO 106 23.657 3.489 2.078
823 HG2 PRO 106 HG2 PRO 106 21.325 2.914 0.819
824 HG3 PRO 106 HG3 PRO 106 22.777 1.900 0.528
825 HD2 PRO 106 HD2 PRO 106 20.448 1.347 2.391
826 HD3 PRO 106 HD3 PRO 106 21.239 0.270 1.200
827 HHA HEC 107 HHA HEC 107 -4.846 -3.711 1.147
828 HHB HEC 107 HHB HEC 107 -0.242 0.808 1.440
829 HHC HEC 107 HHC HEC 107 -4.354 4.649 4.632
830 HHD HEC 107 HHD HEC 107 -8.398 -0.371 5.328
831 HMA1 HEC 107 HMA1 HEC 107 -0.100 -1.240 -0.860
832 HMA2 HEC 107 HMA2 HEC 107 0.718 -1.173 0.720
833 HMA3 HEC 107 HMA3 HEC 107 0.270 -2.729 0.033
834 HAA1 HEC 107 HAA1 HEC 107 -3.357 -3.889 -0.703
835 HAA2 HEC 107 HAA2 HEC 107 -1.644 -3.678 -0.980
836 HBA1 HEC 107 HBA1 HEC 107 -1.113 -5.059 0.985
837 HBA2 HEC 107 HBA2 HEC 107 -2.834 -5.238 1.352
838 HMB1 HEC 107 HMB1 HEC 107 0.099 3.261 0.965
839 HMB2 HEC 107 HMB2 HEC 107 0.334 4.519 2.162
840 HMB3 HEC 107 HMB3 HEC 107 0.960 2.902 2.488
841 HAB HEC 107 HAB HEC 107 -2.423 5.458 4.757
842 HBB1 HEC 107 HBB1 HEC 107 -1.319 6.112 2.030
843 HBB2 HEC 107 HBB2 HEC 107 -2.966 6.352 2.614
844 HBB3 HEC 107 HBB3 HEC 107 -1.632 7.293 3.314
845 HMC1 HEC 107 HMC1 HEC 107 -6.107 5.403 5.629
846 HMC2 HEC 107 HMC2 HEC 107 -7.823 5.061 5.418
847 HMC3 HEC 107 HMC3 HEC 107 -7.028 4.720 6.964
848 HAC HEC 107 HAC HEC 107 -9.014 1.134 6.602
849 HBC1 HEC 107 HBC1 HEC 107 -9.849 3.338 5.641
850 HBC2 HEC 107 HBC2 HEC 107 -10.462 2.809 7.221
851 HBC3 HEC 107 HBC3 HEC 107 -9.247 4.075 7.141
852 HMD1 HEC 107 HMD1 HEC 107 -9.009 -2.649 5.386
853 HMD2 HEC 107 HMD2 HEC 107 -9.754 -2.607 3.767
854 HMD3 HEC 107 HMD3 HEC 107 -8.926 -4.054 4.320
855 HAD1 HEC 107 HAD1 HEC 107 -7.083 -4.644 1.286
856 HAD2 HEC 107 HAD2 HEC 107 -8.653 -4.059 1.860
857 HBD1 HEC 107 HBD1 HEC 107 -6.861 -2.481 -0.030
858 HBD2 HEC 107 HBD2 HEC 107 -8.239 -3.459 -0.510
Contact the webmaster for help, if required. Saturday, June 1, 2024 6:01:57 PM GMT (wattos1)