Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
628568 | 5xv9 RC | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 -3.885 11.489 1.651
2 H2 MET 1 HT2 MET 1 -4.364 12.284 0.228
3 H3 MET 1 HT3 MET 1 -5.099 10.819 0.675
4 HA MET 1 HA MET 1 -5.251 13.275 2.326
5 HB2 MET 1 HB2 MET 1 -6.973 12.275 0.059
6 HB3 MET 1 HB3 MET 1 -7.686 13.218 1.365
7 HG2 MET 1 HG2 MET 1 -5.291 14.127 -0.255
8 HG3 MET 1 HG3 MET 1 -6.952 14.602 -0.607
9 HE1 MET 1 HE1 MET 1 -4.659 16.509 -0.222
10 HE2 MET 1 HE2 MET 1 -5.179 17.742 0.924
11 HE3 MET 1 HE3 MET 1 -6.274 17.219 -0.353
12 H SER 2 H SER 2 -6.968 10.306 1.321
13 HA SER 2 HA SER 2 -8.331 9.977 3.802
14 HB2 SER 2 HB2 SER 2 -7.796 8.013 1.564
15 HB3 SER 2 HB3 SER 2 -8.892 7.726 2.913
16 HG SER 2 HG SER 2 -10.210 8.598 1.459
17 H LYS 3 H LYS 3 -7.997 8.425 5.425
18 HA LYS 3 HA LYS 3 -5.572 6.836 5.469
19 HB2 LYS 3 HB2 LYS 3 -4.646 7.874 7.492
20 HB3 LYS 3 HB3 LYS 3 -4.718 9.033 6.169
21 HG2 LYS 3 HG2 LYS 3 -6.819 9.958 7.091
22 HG3 LYS 3 HG3 LYS 3 -6.732 8.804 8.423
23 HD2 LYS 3 HD2 LYS 3 -4.573 9.768 9.126
24 HD3 LYS 3 HD3 LYS 3 -4.655 10.924 7.796
25 HE2 LYS 3 HE2 LYS 3 -6.744 11.852 8.723
26 HE3 LYS 3 HE3 LYS 3 -6.671 10.694 10.052
27 HZ1 LYS 3 HZ1 LYS 3 -5.759 12.961 10.537
28 HZ2 LYS 3 HZ2 LYS 3 -4.490 12.612 9.463
29 HZ3 LYS 3 HZ3 LYS 3 -4.703 11.674 10.863
30 H GLY 4 H GLY 4 -5.670 5.164 6.914
31 HA2 GLY 4 HA2 GLY 4 -7.985 5.038 8.739
32 HA3 GLY 4 HA3 GLY 4 -7.713 3.741 7.580
33 H ILE 5 H ILE 5 -7.639 2.409 9.543
34 HA ILE 5 HA ILE 5 -4.940 2.457 10.770
35 HB ILE 5 HB ILE 5 -6.034 1.237 12.713
36 HG12 ILE 5 HG12 ILE 5 -8.617 2.426 11.665
37 HG13 ILE 5 HG13 ILE 5 -8.165 0.767 11.288
38 HG21 ILE 5 HG21 ILE 5 -5.385 3.599 12.838
39 HG22 ILE 5 HG22 ILE 5 -6.897 3.337 13.707
40 HG23 ILE 5 HG23 ILE 5 -6.917 4.075 12.105
41 HD11 ILE 5 HD11 ILE 5 -8.142 0.159 13.615
42 HD12 ILE 5 HD12 ILE 5 -9.636 1.053 13.346
43 HD13 ILE 5 HD13 ILE 5 -8.262 1.845 14.117
44 H VAL 6 H VAL 6 -3.724 0.743 10.478
45 HA VAL 6 HA VAL 6 -4.557 -1.333 8.733
46 HB VAL 6 HB VAL 6 -2.055 -1.127 10.427
47 HG11 VAL 6 HG11 VAL 6 -1.160 -2.640 8.542
48 HG12 VAL 6 HG12 VAL 6 -2.850 -2.949 8.146
49 HG13 VAL 6 HG13 VAL 6 -2.220 -3.397 9.731
50 HG21 VAL 6 HG21 VAL 6 -1.018 -0.111 8.525
51 HG22 VAL 6 HG22 VAL 6 -2.551 0.735 8.733
52 HG23 VAL 6 HG23 VAL 6 -2.387 -0.496 7.481
53 H LYS 7 H LYS 7 -5.566 -3.169 9.167
54 HA LYS 7 HA LYS 7 -6.321 -3.937 11.807
55 HB2 LYS 7 HB2 LYS 7 -7.632 -4.535 9.764
56 HB3 LYS 7 HB3 LYS 7 -6.329 -5.623 9.281
57 HG2 LYS 7 HG2 LYS 7 -6.631 -6.919 11.360
58 HG3 LYS 7 HG3 LYS 7 -7.921 -5.825 11.858
59 HD2 LYS 7 HD2 LYS 7 -9.230 -6.446 9.864
60 HD3 LYS 7 HD3 LYS 7 -7.944 -7.541 9.358
61 HE2 LYS 7 HE2 LYS 7 -8.229 -8.846 11.429
62 HE3 LYS 7 HE3 LYS 7 -9.506 -7.748 11.949
63 HZ1 LYS 7 HZ1 LYS 7 -9.611 -9.237 9.390
64 HZ2 LYS 7 HZ2 LYS 7 -10.875 -8.413 10.170
65 HZ3 LYS 7 HZ3 LYS 7 -10.256 -9.850 10.833
66 H TRP 8 H TRP 8 -3.926 -5.142 9.468
67 HA TRP 8 HA TRP 8 -2.056 -5.786 11.502
68 HB2 TRP 8 HB2 TRP 8 -1.971 -8.200 11.301
69 HB3 TRP 8 HB3 TRP 8 -3.566 -7.702 11.843
70 HD1 TRP 8 HD1 TRP 8 -5.591 -7.957 10.122
71 HE1 TRP 8 HE1 TRP 8 -5.883 -9.450 8.042
72 HE3 TRP 8 HE3 TRP 8 -0.724 -9.241 9.271
73 HZ2 TRP 8 HZ2 TRP 8 -4.264 -10.992 6.257
74 HZ3 TRP 8 HZ3 TRP 8 -0.128 -10.724 7.377
75 HH2 TRP 8 HH2 TRP 8 -1.891 -11.600 5.871
76 H PHE 9 H PHE 9 -0.050 -5.801 10.725
77 HA PHE 9 HA PHE 9 0.271 -5.973 7.771
78 HB2 PHE 9 HB2 PHE 9 0.623 -3.678 8.758
79 HB3 PHE 9 HB3 PHE 9 1.989 -4.343 9.654
80 HD1 PHE 9 HD1 PHE 9 0.726 -3.361 6.351
81 HD2 PHE 9 HD2 PHE 9 3.994 -5.162 8.478
82 HE1 PHE 9 HE1 PHE 9 2.167 -3.113 4.348
83 HE2 PHE 9 HE2 PHE 9 5.436 -4.910 6.477
84 HZ PHE 9 HZ PHE 9 4.522 -3.886 4.412
85 H ASN 10 H ASN 10 1.619 -7.502 7.036
86 HA ASN 10 HA ASN 10 3.689 -8.565 8.860
87 HB2 ASN 10 HB2 ASN 10 1.728 -10.156 7.206
88 HB3 ASN 10 HB3 ASN 10 3.237 -10.838 7.807
89 HD21 ASN 10 HD21 ASN 10 0.696 -11.849 8.663
90 HD22 ASN 10 HD22 ASN 10 0.502 -11.488 10.310
91 H SER 11 H SER 11 5.423 -7.642 7.912
92 HA SER 11 HA SER 11 5.817 -7.293 5.144
93 HB2 SER 11 HB2 SER 11 8.128 -6.788 5.744
94 HB3 SER 11 HB3 SER 11 7.024 -6.023 6.883
95 HG SER 11 HG SER 11 8.970 -7.779 7.362
96 H ASP 12 H ASP 12 6.495 -10.002 7.297
97 HA ASP 12 HA ASP 12 8.346 -11.406 5.699
98 HB2 ASP 12 HB2 ASP 12 6.235 -12.384 7.637
99 HB3 ASP 12 HB3 ASP 12 7.402 -13.455 6.867
100 H LYS 13 H LYS 13 4.806 -11.416 5.774
101 HA LYS 13 HA LYS 13 4.519 -13.251 3.575
102 HB2 LYS 13 HB2 LYS 13 2.582 -11.365 4.940
103 HB3 LYS 13 HB3 LYS 13 2.127 -12.478 3.651
104 HG2 LYS 13 HG2 LYS 13 2.925 -14.382 5.001
105 HG3 LYS 13 HG3 LYS 13 3.375 -13.271 6.297
106 HD2 LYS 13 HD2 LYS 13 1.026 -12.549 6.504
107 HD3 LYS 13 HD3 LYS 13 0.571 -13.658 5.207
108 HE2 LYS 13 HE2 LYS 13 1.361 -15.566 6.553
109 HE3 LYS 13 HE3 LYS 13 1.825 -14.463 7.849
110 HZ1 LYS 13 HZ1 LYS 13 -0.932 -14.525 6.790
111 HZ2 LYS 13 HZ2 LYS 13 -0.380 -13.914 8.276
112 HZ3 LYS 13 HZ3 LYS 13 -0.434 -15.592 8.011
113 H GLY 14 H GLY 14 4.888 -9.815 3.995
114 HA2 GLY 14 HA2 GLY 14 5.625 -8.305 2.344
115 HA3 GLY 14 HA3 GLY 14 5.109 -9.438 1.104
116 H PHE 15 H PHE 15 2.672 -9.056 3.449
117 HA PHE 15 HA PHE 15 1.499 -6.663 2.320
118 HB2 PHE 15 HB2 PHE 15 -0.537 -7.750 1.449
119 HB3 PHE 15 HB3 PHE 15 0.909 -8.229 0.558
120 HD1 PHE 15 HD1 PHE 15 -1.654 -9.317 2.987
121 HD2 PHE 15 HD2 PHE 15 1.776 -10.497 0.683
122 HE1 PHE 15 HE1 PHE 15 -2.161 -11.700 3.451
123 HE2 PHE 15 HE2 PHE 15 1.269 -12.879 1.150
124 HZ PHE 15 HZ PHE 15 -0.699 -13.481 2.533
125 H GLY 16 H GLY 16 -0.819 -6.408 3.109
126 HA2 GLY 16 HA2 GLY 16 -1.516 -7.691 5.596
127 HA3 GLY 16 HA3 GLY 16 -0.942 -6.035 5.795
128 H PHE 17 H PHE 17 -3.413 -6.386 6.609
129 HA PHE 17 HA PHE 17 -5.136 -5.341 4.438
130 HB2 PHE 17 HB2 PHE 17 -5.831 -7.119 6.784
131 HB3 PHE 17 HB3 PHE 17 -7.043 -6.275 5.820
132 HD1 PHE 17 HD1 PHE 17 -4.231 -8.698 5.619
133 HD2 PHE 17 HD2 PHE 17 -7.729 -7.123 3.702
134 HE1 PHE 17 HE1 PHE 17 -4.120 -10.516 3.935
135 HE2 PHE 17 HE2 PHE 17 -7.619 -8.933 2.010
136 HZ PHE 17 HZ PHE 17 -5.814 -10.630 2.126
137 H ILE 18 H ILE 18 -6.290 -3.502 4.859
138 HA ILE 18 HA ILE 18 -5.804 -2.255 7.487
139 HB ILE 18 HB ILE 18 -4.575 -1.134 5.682
140 HG12 ILE 18 HG12 ILE 18 -6.888 0.646 6.475
141 HG13 ILE 18 HG13 ILE 18 -5.678 0.121 7.647
142 HG21 ILE 18 HG21 ILE 18 -5.905 0.094 3.935
143 HG22 ILE 18 HG22 ILE 18 -7.338 -0.777 4.481
144 HG23 ILE 18 HG23 ILE 18 -5.982 -1.661 3.779
145 HD11 ILE 18 HD11 ILE 18 -5.077 1.592 5.062
146 HD12 ILE 18 HD12 ILE 18 -3.896 1.106 6.276
147 HD13 ILE 18 HD13 ILE 18 -5.106 2.328 6.664
148 H THR 19 H THR 19 -7.389 -1.133 8.492
149 HA THR 19 HA THR 19 -10.114 -1.797 7.658
150 HB THR 19 HB THR 19 -9.091 -0.781 10.313
151 HG1 THR 19 HG1 THR 19 -8.677 -2.784 10.732
152 HG21 THR 19 HG21 THR 19 -11.774 -1.802 9.366
153 HG22 THR 19 HG22 THR 19 -11.416 -0.252 10.127
154 HG23 THR 19 HG23 THR 19 -11.334 -1.739 11.073
155 HA PRO 20 HA PRO 20 -10.117 2.575 6.202
156 HB2 PRO 20 HB2 PRO 20 -12.989 1.817 5.818
157 HB3 PRO 20 HB3 PRO 20 -11.899 2.683 4.717
158 HG2 PRO 20 HG2 PRO 20 -12.469 0.171 4.258
159 HG3 PRO 20 HG3 PRO 20 -10.797 0.742 4.081
160 HD2 PRO 20 HD2 PRO 20 -12.011 -0.849 6.324
161 HD3 PRO 20 HD3 PRO 20 -10.409 -1.006 5.567
162 H GLU 21 H GLU 21 -10.462 4.348 7.359
163 HA GLU 21 HA GLU 21 -11.495 4.351 9.966
164 HB2 GLU 21 HB2 GLU 21 -9.855 5.993 9.146
165 HB3 GLU 21 HB3 GLU 21 -11.064 6.666 8.054
166 HG2 GLU 21 HG2 GLU 21 -10.942 8.062 10.043
167 HG3 GLU 21 HG3 GLU 21 -12.489 7.213 10.017
168 H ASP 22 H ASP 22 -12.947 5.315 6.876
169 HA ASP 22 HA ASP 22 -15.332 6.419 7.919
170 HB2 ASP 22 HB2 ASP 22 -14.660 5.224 5.229
171 HB3 ASP 22 HB3 ASP 22 -16.216 5.963 5.584
172 H GLY 23 H GLY 23 -14.305 3.153 7.702
173 HA2 GLY 23 HA2 GLY 23 -15.495 1.402 8.824
174 HA3 GLY 23 HA3 GLY 23 -17.002 2.233 8.453
175 H SER 24 H SER 24 -14.880 2.266 5.810
176 HA SER 24 HA SER 24 -16.576 0.578 4.234
177 HB2 SER 24 HB2 SER 24 -13.872 1.795 3.639
178 HB3 SER 24 HB3 SER 24 -14.878 0.966 2.461
179 HG SER 24 HG SER 24 -15.076 3.485 3.477
180 H LYS 25 H LYS 25 -15.637 -1.238 2.906
181 HA LYS 25 HA LYS 25 -14.753 -3.319 4.594
182 HB2 LYS 25 HB2 LYS 25 -14.814 -3.104 1.576
183 HB3 LYS 25 HB3 LYS 25 -14.470 -4.593 2.457
184 HG2 LYS 25 HG2 LYS 25 -16.654 -4.494 3.551
185 HG3 LYS 25 HG3 LYS 25 -16.998 -2.948 2.778
186 HD2 LYS 25 HD2 LYS 25 -18.134 -4.604 1.474
187 HD3 LYS 25 HD3 LYS 25 -16.712 -4.141 0.542
188 HE2 LYS 25 HE2 LYS 25 -15.506 -6.120 1.341
189 HE3 LYS 25 HE3 LYS 25 -16.877 -6.568 2.357
190 HZ1 LYS 25 HZ1 LYS 25 -17.128 -7.833 0.435
191 HZ2 LYS 25 HZ2 LYS 25 -16.703 -6.549 -0.593
192 HZ3 LYS 25 HZ3 LYS 25 -18.201 -6.540 0.206
193 H ASP 26 H ASP 26 -12.774 -4.455 4.662
194 HA ASP 26 HA ASP 26 -10.460 -2.928 4.807
195 HB2 ASP 26 HB2 ASP 26 -10.858 -5.904 4.535
196 HB3 ASP 26 HB3 ASP 26 -9.282 -5.174 4.804
197 H LEU 27 H LEU 27 -8.709 -2.594 3.528
198 HA LEU 27 HA LEU 27 -8.985 -3.335 0.675
199 HB2 LEU 27 HB2 LEU 27 -7.614 -0.926 1.905
200 HB3 LEU 27 HB3 LEU 27 -7.678 -1.296 0.184
201 HG LEU 27 HG LEU 27 -10.146 -0.885 1.905
202 HD11 LEU 27 HD11 LEU 27 -8.698 1.162 1.724
203 HD12 LEU 27 HD12 LEU 27 -10.277 1.348 0.959
204 HD13 LEU 27 HD13 LEU 27 -8.846 1.055 -0.030
205 HD21 LEU 27 HD21 LEU 27 -10.607 -2.180 -0.100
206 HD22 LEU 27 HD22 LEU 27 -9.672 -1.061 -1.091
207 HD23 LEU 27 HD23 LEU 27 -11.194 -0.538 -0.368
208 H PHE 28 H PHE 28 -7.168 -4.024 -0.447
209 HA PHE 28 HA PHE 28 -5.173 -5.419 1.098
210 HB2 PHE 28 HB2 PHE 28 -5.559 -5.006 -1.875
211 HB3 PHE 28 HB3 PHE 28 -4.271 -5.994 -1.184
212 HD1 PHE 28 HD1 PHE 28 -7.925 -5.665 -1.627
213 HD2 PHE 28 HD2 PHE 28 -4.735 -8.140 -0.161
214 HE1 PHE 28 HE1 PHE 28 -9.495 -7.575 -1.437
215 HE2 PHE 28 HE2 PHE 28 -6.306 -10.049 0.032
216 HZ PHE 28 HZ PHE 28 -8.686 -9.767 -0.606
217 H VAL 29 H VAL 29 -3.191 -4.757 1.636
218 HA VAL 29 HA VAL 29 -2.009 -2.436 0.252
219 HB VAL 29 HB VAL 29 -2.135 -2.899 3.247
220 HG11 VAL 29 HG11 VAL 29 0.031 -1.963 2.767
221 HG12 VAL 29 HG12 VAL 29 -0.984 -0.628 3.313
222 HG13 VAL 29 HG13 VAL 29 -0.654 -0.839 1.593
223 HG21 VAL 29 HG21 VAL 29 -4.163 -1.932 2.021
224 HG22 VAL 29 HG22 VAL 29 -3.144 -0.540 1.661
225 HG23 VAL 29 HG23 VAL 29 -3.506 -0.955 3.335
226 H HIS 30 H HIS 30 0.071 -2.749 -0.348
227 HA HIS 30 HA HIS 30 1.438 -5.185 0.628
228 HB2 HIS 30 HB2 HIS 30 1.797 -3.649 -1.957
229 HB3 HIS 30 HB3 HIS 30 2.755 -5.051 -1.473
230 HD2 HIS 30 HD2 HIS 30 -0.518 -4.331 -3.309
231 HE1 HIS 30 HE1 HIS 30 -0.723 -8.380 -2.131
232 HE2 HIS 30 HE2 HIS 30 -1.797 -6.592 -3.580
233 H HIS 31 H HIS 31 3.613 -5.106 1.184
234 HA HIS 31 HA HIS 31 4.494 -2.811 2.575
235 HB2 HIS 31 HB2 HIS 31 5.218 -5.150 3.063
236 HB3 HIS 31 HB3 HIS 31 6.170 -5.133 1.578
237 HD2 HIS 31 HD2 HIS 31 6.365 -3.723 5.223
238 HE1 HIS 31 HE1 HIS 31 9.840 -2.471 3.180
239 HE2 HIS 31 HE2 HIS 31 8.704 -2.587 5.448
240 H SER 32 H SER 32 5.507 -4.170 -0.545
241 HA SER 32 HA SER 32 7.493 -2.267 -1.147
242 HB2 SER 32 HB2 SER 32 7.357 -3.115 -3.427
243 HB3 SER 32 HB3 SER 32 7.285 -4.444 -2.274
244 HG SER 32 HG SER 32 5.679 -4.507 -3.979
245 H GLU 33 H GLU 33 4.051 -1.959 -1.288
246 HA GLU 33 HA GLU 33 4.061 0.132 -3.295
247 HB2 GLU 33 HB2 GLU 33 1.885 -1.013 -1.548
248 HB3 GLU 33 HB3 GLU 33 1.616 0.297 -2.694
249 HG2 GLU 33 HG2 GLU 33 2.713 -2.442 -3.403
250 HG3 GLU 33 HG3 GLU 33 1.055 -1.914 -3.671
251 H ILE 34 H ILE 34 5.022 0.246 -0.124
252 HA ILE 34 HA ILE 34 3.620 2.535 0.825
253 HB ILE 34 HB ILE 34 5.346 2.723 2.538
254 HG12 ILE 34 HG12 ILE 34 6.881 0.540 1.079
255 HG13 ILE 34 HG13 ILE 34 7.280 2.244 0.937
256 HG21 ILE 34 HG21 ILE 34 5.340 0.219 3.278
257 HG22 ILE 34 HG22 ILE 34 4.356 -0.044 1.838
258 HG23 ILE 34 HG23 ILE 34 3.795 1.046 3.102
259 HD11 ILE 34 HD11 ILE 34 7.767 2.410 3.290
260 HD12 ILE 34 HD12 ILE 34 8.625 0.996 2.678
261 HD13 ILE 34 HD13 ILE 34 7.131 0.793 3.591
262 H GLN 35 H GLN 35 4.357 4.709 1.025
263 HA GLN 35 HA GLN 35 6.433 5.510 -0.927
264 HB2 GLN 35 HB2 GLN 35 4.132 5.887 -1.842
265 HB3 GLN 35 HB3 GLN 35 3.801 6.944 -0.472
266 HG2 GLN 35 HG2 GLN 35 5.686 8.399 -1.143
267 HG3 GLN 35 HG3 GLN 35 6.000 7.348 -2.523
268 HE21 GLN 35 HE21 GLN 35 5.126 8.197 -4.409
269 HE22 GLN 35 HE22 GLN 35 3.683 9.085 -4.502
270 H SER 36 H SER 36 8.008 6.009 0.525
271 HA SER 36 HA SER 36 7.651 8.410 2.111
272 HB2 SER 36 HB2 SER 36 6.873 6.700 3.688
273 HB3 SER 36 HB3 SER 36 8.360 5.785 3.446
274 HG SER 36 HG SER 36 9.352 7.111 4.741
275 H GLY 37 H GLY 37 9.562 9.471 2.490
276 HA2 GLY 37 HA2 GLY 37 11.773 8.919 0.828
277 HA3 GLY 37 HA3 GLY 37 11.756 10.075 2.156
278 H GLY 38 H GLY 38 11.194 8.307 4.273
279 HA2 GLY 38 HA2 GLY 38 13.814 7.285 4.820
280 HA3 GLY 38 HA3 GLY 38 12.402 7.145 5.861
281 H GLU 39 H GLU 39 14.498 5.179 5.048
282 HA GLU 39 HA GLU 39 12.878 3.155 3.651
283 HB2 GLU 39 HB2 GLU 39 15.834 3.278 4.277
284 HB3 GLU 39 HB3 GLU 39 15.041 1.903 3.509
285 HG2 GLU 39 HG2 GLU 39 15.835 3.159 1.682
286 HG3 GLU 39 HG3 GLU 39 14.146 3.632 1.793
287 H TYR 40 H TYR 40 13.291 4.078 6.779
288 HA TYR 40 HA TYR 40 13.497 1.351 7.875
289 HB2 TYR 40 HB2 TYR 40 13.579 4.048 9.237
290 HB3 TYR 40 HB3 TYR 40 13.710 2.498 10.064
291 HD1 TYR 40 HD1 TYR 40 15.399 4.903 7.863
292 HD2 TYR 40 HD2 TYR 40 15.680 1.052 9.745
293 HE1 TYR 40 HE1 TYR 40 17.829 4.837 7.367
294 HE2 TYR 40 HE2 TYR 40 18.108 0.986 9.248
295 HH TYR 40 HH TYR 40 19.948 3.139 8.791
296 H ALA 41 H ALA 41 11.027 3.045 6.674
297 HA ALA 41 HA ALA 41 9.125 3.294 8.717
298 HB1 ALA 41 HB1 ALA 41 8.945 2.867 5.749
299 HB2 ALA 41 HB2 ALA 41 8.508 4.289 6.696
300 HB3 ALA 41 HB3 ALA 41 7.484 2.852 6.738
301 H THR 42 H THR 42 7.894 1.897 9.799
302 HA THR 42 HA THR 42 7.836 -0.935 8.928
303 HB THR 42 HB THR 42 7.899 -1.599 11.303
304 HG1 THR 42 HG1 THR 42 8.309 1.177 11.699
305 HG21 THR 42 HG21 THR 42 10.006 -1.251 9.861
306 HG22 THR 42 HG22 THR 42 10.232 -1.321 11.609
307 HG23 THR 42 HG23 THR 42 10.239 0.236 10.781
308 H LEU 43 H LEU 43 5.987 -2.156 9.706
309 HA LEU 43 HA LEU 43 3.671 -0.573 10.578
310 HB2 LEU 43 HB2 LEU 43 3.865 -2.164 8.033
311 HB3 LEU 43 HB3 LEU 43 2.324 -1.987 8.854
312 HG LEU 43 HG LEU 43 3.055 0.612 8.839
313 HD11 LEU 43 HD11 LEU 43 4.168 -0.236 6.167
314 HD12 LEU 43 HD12 LEU 43 5.224 -0.201 7.573
315 HD13 LEU 43 HD13 LEU 43 4.410 1.270 7.051
316 HD21 LEU 43 HD21 LEU 43 1.846 0.749 6.553
317 HD22 LEU 43 HD22 LEU 43 0.974 -0.011 7.883
318 HD23 LEU 43 HD23 LEU 43 1.740 -1.009 6.649
319 H ALA 44 H ALA 44 2.124 -1.783 11.694
320 HA ALA 44 HA ALA 44 2.555 -4.652 12.085
321 HB1 ALA 44 HB1 ALA 44 3.059 -4.558 14.345
322 HB2 ALA 44 HB2 ALA 44 2.287 -2.987 14.560
323 HB3 ALA 44 HB3 ALA 44 3.869 -3.094 13.786
324 H ASP 45 H ASP 45 0.774 -4.693 14.456
325 HA ASP 45 HA ASP 45 -1.760 -4.514 13.051
326 HB2 ASP 45 HB2 ASP 45 -1.173 -6.497 14.432
327 HB3 ASP 45 HB3 ASP 45 -1.133 -5.466 15.856
328 H GLY 46 H GLY 46 -2.774 -2.609 12.997
329 HA2 GLY 46 HA2 GLY 46 -4.155 -1.006 14.120
330 HA3 GLY 46 HA3 GLY 46 -3.096 -1.114 15.517
331 H GLN 47 H GLN 47 -1.046 -0.980 12.941
332 HA GLN 47 HA GLN 47 -0.067 1.589 13.474
333 HB2 GLN 47 HB2 GLN 47 1.179 -0.282 12.394
334 HB3 GLN 47 HB3 GLN 47 0.239 -0.025 10.929
335 HG2 GLN 47 HG2 GLN 47 2.409 1.099 10.762
336 HG3 GLN 47 HG3 GLN 47 1.112 2.281 10.784
337 HE21 GLN 47 HE21 GLN 47 1.704 4.043 12.063
338 HE22 GLN 47 HE22 GLN 47 2.595 3.945 13.504
339 H THR 48 H THR 48 -0.679 3.562 12.837
340 HA THR 48 HA THR 48 -2.995 3.856 11.090
341 HB THR 48 HB THR 48 -1.378 5.954 12.576
342 HG1 THR 48 HG1 THR 48 -2.571 5.477 14.238
343 HG21 THR 48 HG21 THR 48 -3.163 7.457 12.128
344 HG22 THR 48 HG22 THR 48 -4.228 6.159 11.591
345 HG23 THR 48 HG23 THR 48 -2.865 6.654 10.587
346 H VAL 49 H VAL 49 -2.908 4.423 9.001
347 HA VAL 49 HA VAL 49 -0.465 5.693 7.962
348 HB VAL 49 HB VAL 49 -0.417 4.152 6.028
349 HG11 VAL 49 HG11 VAL 49 0.691 2.371 7.172
350 HG12 VAL 49 HG12 VAL 49 -0.288 2.599 8.621
351 HG13 VAL 49 HG13 VAL 49 0.918 3.805 8.172
352 HG21 VAL 49 HG21 VAL 49 -2.682 3.343 5.941
353 HG22 VAL 49 HG22 VAL 49 -2.599 2.751 7.600
354 HG23 VAL 49 HG23 VAL 49 -1.668 1.954 6.332
355 H GLU 50 H GLU 50 -0.703 6.476 5.743
356 HA GLU 50 HA GLU 50 -3.447 7.478 5.240
357 HB2 GLU 50 HB2 GLU 50 -0.783 8.648 4.354
358 HB3 GLU 50 HB3 GLU 50 -2.373 9.338 4.031
359 HG2 GLU 50 HG2 GLU 50 -2.748 9.594 6.465
360 HG3 GLU 50 HG3 GLU 50 -1.149 8.925 6.776
361 H TYR 51 H TYR 51 -4.354 7.014 3.241
362 HA TYR 51 HA TYR 51 -2.674 6.013 1.086
363 HB2 TYR 51 HB2 TYR 51 -3.870 3.874 0.868
364 HB3 TYR 51 HB3 TYR 51 -3.019 3.983 2.403
365 HD1 TYR 51 HD1 TYR 51 -6.318 4.015 0.761
366 HD2 TYR 51 HD2 TYR 51 -4.236 4.197 4.514
367 HE1 TYR 51 HE1 TYR 51 -8.448 3.613 1.963
368 HE2 TYR 51 HE2 TYR 51 -6.367 3.794 5.715
369 HH TYR 51 HH TYR 51 -8.785 4.081 5.311
370 H GLU 52 H GLU 52 -3.892 5.462 -0.852
371 HA GLU 52 HA GLU 52 -6.331 7.115 -1.136
372 HB2 GLU 52 HB2 GLU 52 -4.097 6.532 -3.097
373 HB3 GLU 52 HB3 GLU 52 -5.634 7.264 -3.566
374 HG2 GLU 52 HG2 GLU 52 -5.254 9.153 -2.102
375 HG3 GLU 52 HG3 GLU 52 -3.828 8.390 -1.408
376 H VAL 53 H VAL 53 -8.114 6.116 -1.920
377 HA VAL 53 HA VAL 53 -7.956 3.224 -2.365
378 HB VAL 53 HB VAL 53 -10.370 5.059 -2.141
379 HG11 VAL 53 HG11 VAL 53 -11.704 3.074 -1.981
380 HG12 VAL 53 HG12 VAL 53 -10.277 2.043 -1.889
381 HG13 VAL 53 HG13 VAL 53 -10.678 2.860 -3.399
382 HG21 VAL 53 HG21 VAL 53 -8.998 3.247 -0.132
383 HG22 VAL 53 HG22 VAL 53 -10.588 3.966 0.118
384 HG23 VAL 53 HG23 VAL 53 -9.168 4.999 -0.034
385 H GLY 54 H GLY 54 -7.687 2.483 -4.371
386 HA2 GLY 54 HA2 GLY 54 -8.872 3.993 -6.631
387 HA3 GLY 54 HA3 GLY 54 -7.290 3.224 -6.731
388 H GLN 55 H GLN 55 -10.431 2.883 -7.572
389 HA GLN 55 HA GLN 55 -11.155 0.266 -7.026
390 HB2 GLN 55 HB2 GLN 55 -11.745 2.010 -9.422
391 HB3 GLN 55 HB3 GLN 55 -12.503 0.436 -9.161
392 HG2 GLN 55 HG2 GLN 55 -13.465 1.173 -7.069
393 HG3 GLN 55 HG3 GLN 55 -12.565 2.685 -7.132
394 HE21 GLN 55 HE21 GLN 55 -15.553 2.254 -7.093
395 HE22 GLN 55 HE22 GLN 55 -16.131 3.040 -8.481
396 H GLY 56 H GLY 56 -11.061 -1.641 -8.218
397 HA2 GLY 56 HA2 GLY 56 -9.111 -1.879 -10.386
398 HA3 GLY 56 HA3 GLY 56 -8.822 -2.815 -8.919
399 H GLN 57 H GLN 57 -9.088 -4.335 -11.052
400 HA GLN 57 HA GLN 57 -11.713 -4.988 -11.872
401 HB2 GLN 57 HB2 GLN 57 -9.178 -6.637 -11.882
402 HB3 GLN 57 HB3 GLN 57 -10.674 -7.104 -12.690
403 HG2 GLN 57 HG2 GLN 57 -9.785 -5.990 -14.474
404 HG3 GLN 57 HG3 GLN 57 -10.370 -4.550 -13.638
405 HE21 GLN 57 HE21 GLN 57 -7.950 -4.852 -15.406
406 HE22 GLN 57 HE22 GLN 57 -6.638 -4.350 -14.453
407 H LYS 58 H LYS 58 -9.631 -6.289 -9.313
408 HA LYS 58 HA LYS 58 -11.659 -8.202 -8.468
409 HB2 LYS 58 HB2 LYS 58 -8.970 -7.434 -7.311
410 HB3 LYS 58 HB3 LYS 58 -10.021 -8.674 -6.627
411 HG2 LYS 58 HG2 LYS 58 -9.962 -9.906 -8.766
412 HG3 LYS 58 HG3 LYS 58 -8.899 -8.672 -9.445
413 HD2 LYS 58 HD2 LYS 58 -7.199 -9.172 -7.745
414 HD3 LYS 58 HD3 LYS 58 -8.261 -10.377 -7.019
415 HE2 LYS 58 HE2 LYS 58 -6.645 -11.491 -8.476
416 HE3 LYS 58 HE3 LYS 58 -8.258 -11.634 -9.169
417 HZ1 LYS 58 HZ1 LYS 58 -6.347 -10.918 -10.686
418 HZ2 LYS 58 HZ2 LYS 58 -6.478 -9.406 -9.923
419 HZ3 LYS 58 HZ3 LYS 58 -7.800 -10.048 -10.775
420 H GLY 59 H GLY 59 -10.700 -4.955 -7.749
421 HA2 GLY 59 HA2 GLY 59 -12.808 -3.941 -6.494
422 HA3 GLY 59 HA3 GLY 59 -12.099 -4.877 -5.180
423 HA PRO 60 HA PRO 60 -9.986 -0.642 -5.544
424 HB2 PRO 60 HB2 PRO 60 -10.633 0.381 -3.110
425 HB3 PRO 60 HB3 PRO 60 -11.666 0.575 -4.539
426 HG2 PRO 60 HG2 PRO 60 -11.902 -1.362 -2.285
427 HG3 PRO 60 HG3 PRO 60 -13.160 -0.410 -3.090
428 HD2 PRO 60 HD2 PRO 60 -12.732 -3.041 -3.663
429 HD3 PRO 60 HD3 PRO 60 -13.323 -1.883 -4.876
430 H CYS 61 H CYS 61 -8.035 -0.060 -4.593
431 HA CYS 61 HA CYS 61 -6.981 -1.818 -2.462
432 HB2 CYS 61 HB2 CYS 61 -5.513 -0.890 -4.946
433 HB3 CYS 61 HB3 CYS 61 -4.808 -1.823 -3.625
434 HG CYS 61 HG CYS 61 -6.899 -3.583 -4.324
435 H ALA 62 H ALA 62 -4.865 -0.810 -1.548
436 HA ALA 62 HA ALA 62 -5.263 2.128 -1.328
437 HB1 ALA 62 HB1 ALA 62 -5.634 1.642 0.851
438 HB2 ALA 62 HB2 ALA 62 -3.884 1.453 0.946
439 HB3 ALA 62 HB3 ALA 62 -4.915 0.040 0.717
440 H ASN 63 H ASN 63 -3.620 3.352 -1.994
441 HA ASN 63 HA ASN 63 -0.929 2.127 -2.231
442 HB2 ASN 63 HB2 ASN 63 -2.217 4.129 -4.101
443 HB3 ASN 63 HB3 ASN 63 -0.598 3.449 -4.262
444 HD21 ASN 63 HD21 ASN 63 -3.453 3.156 -5.720
445 HD22 ASN 63 HD22 ASN 63 -3.498 1.488 -6.027
446 H LYS 64 H LYS 64 0.840 3.751 -2.329
447 HA LYS 64 HA LYS 64 2.044 5.451 -1.376
448 HB2 LYS 64 HB2 LYS 64 -0.620 6.873 -1.588
449 HB3 LYS 64 HB3 LYS 64 0.899 7.664 -1.167
450 HG2 LYS 64 HG2 LYS 64 1.878 6.923 -3.312
451 HG3 LYS 64 HG3 LYS 64 0.353 6.142 -3.735
452 HD2 LYS 64 HD2 LYS 64 -0.800 8.320 -3.619
453 HD3 LYS 64 HD3 LYS 64 0.724 9.104 -3.200
454 HE2 LYS 64 HE2 LYS 64 1.697 8.374 -5.344
455 HE3 LYS 64 HE3 LYS 64 0.179 7.580 -5.765
456 HZ1 LYS 64 HZ1 LYS 64 0.656 9.976 -6.588
457 HZ2 LYS 64 HZ2 LYS 64 0.167 10.424 -5.023
458 HZ3 LYS 64 HZ3 LYS 64 -0.896 9.571 -6.038
459 H VAL 65 H VAL 65 1.667 3.645 0.408
460 HA VAL 65 HA VAL 65 0.169 4.463 2.724
461 HB VAL 65 HB VAL 65 2.321 2.348 2.433
462 HG11 VAL 65 HG11 VAL 65 0.231 2.742 4.596
463 HG12 VAL 65 HG12 VAL 65 1.960 3.033 4.782
464 HG13 VAL 65 HG13 VAL 65 1.369 1.397 4.496
465 HG21 VAL 65 HG21 VAL 65 -0.667 1.908 2.548
466 HG22 VAL 65 HG22 VAL 65 0.591 0.782 2.036
467 HG23 VAL 65 HG23 VAL 65 0.175 2.156 1.017
468 H VAL 66 H VAL 66 0.748 5.935 4.105
469 HA VAL 66 HA VAL 66 3.620 6.542 4.539
470 HB VAL 66 HB VAL 66 1.284 8.483 4.635
471 HG11 VAL 66 HG11 VAL 66 3.149 10.187 4.819
472 HG12 VAL 66 HG12 VAL 66 4.256 8.845 5.109
473 HG13 VAL 66 HG13 VAL 66 2.944 9.168 6.244
474 HG21 VAL 66 HG21 VAL 66 3.529 8.077 2.642
475 HG22 VAL 66 HG22 VAL 66 2.532 9.530 2.693
476 HG23 VAL 66 HG23 VAL 66 1.795 7.967 2.337
477 H ALA 67 H ALA 67 4.283 6.117 6.546
478 HA ALA 67 HA ALA 67 2.490 5.260 8.596
479 HB1 ALA 67 HB1 ALA 67 4.639 5.390 10.008
480 HB2 ALA 67 HB2 ALA 67 5.449 5.823 8.502
481 HB3 ALA 67 HB3 ALA 67 4.628 4.268 8.647
482 H VAL 68 H VAL 68 1.651 6.321 10.295
483 HA VAL 68 HA VAL 68 2.582 9.033 10.929
484 HB VAL 68 HB VAL 68 0.247 9.875 11.006
485 HG11 VAL 68 HG11 VAL 68 -0.058 10.003 8.533
486 HG12 VAL 68 HG12 VAL 68 1.180 8.761 8.346
487 HG13 VAL 68 HG13 VAL 68 1.601 10.330 9.034
488 HG21 VAL 68 HG21 VAL 68 -1.569 8.614 10.029
489 HG22 VAL 68 HG22 VAL 68 -0.801 7.576 11.231
490 HG23 VAL 68 HG23 VAL 68 -0.473 7.331 9.515
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 -6.160 14.094 2.609
2 H2 MET 1 HT2 MET 1 -7.585 13.479 1.921
3 H3 MET 1 HT3 MET 1 -6.363 14.110 0.926
4 HA MET 1 HA MET 1 -6.095 11.824 0.722
5 HB2 MET 1 HB2 MET 1 -4.266 12.908 2.881
6 HB3 MET 1 HB3 MET 1 -4.004 11.361 2.076
7 HG2 MET 1 HG2 MET 1 -3.835 12.457 -0.087
8 HG3 MET 1 HG3 MET 1 -4.254 14.013 0.630
9 HE1 MET 1 HE1 MET 1 -0.394 11.596 1.136
10 HE2 MET 1 HE2 MET 1 -1.813 11.198 0.170
11 HE3 MET 1 HE3 MET 1 -1.891 11.081 1.926
12 H SER 2 H SER 2 -7.141 10.043 1.300
13 HA SER 2 HA SER 2 -8.475 9.758 3.805
14 HB2 SER 2 HB2 SER 2 -7.952 7.754 1.600
15 HB3 SER 2 HB3 SER 2 -9.017 7.476 2.974
16 HG SER 2 HG SER 2 -9.579 8.681 0.701
17 H LYS 3 H LYS 3 -8.113 8.209 5.436
18 HA LYS 3 HA LYS 3 -5.676 6.651 5.510
19 HB2 LYS 3 HB2 LYS 3 -4.708 7.772 7.468
20 HB3 LYS 3 HB3 LYS 3 -4.809 8.874 6.099
21 HG2 LYS 3 HG2 LYS 3 -6.889 9.841 7.025
22 HG3 LYS 3 HG3 LYS 3 -6.776 8.743 8.404
23 HD2 LYS 3 HD2 LYS 3 -4.603 9.736 9.021
24 HD3 LYS 3 HD3 LYS 3 -4.712 10.831 7.644
25 HE2 LYS 3 HE2 LYS 3 -6.779 11.803 8.569
26 HE3 LYS 3 HE3 LYS 3 -6.681 10.704 9.946
27 HZ1 LYS 3 HZ1 LYS 3 -4.400 11.688 10.325
28 HZ2 LYS 3 HZ2 LYS 3 -5.724 12.697 10.666
29 HZ3 LYS 3 HZ3 LYS 3 -4.841 12.908 9.229
30 H GLY 4 H GLY 4 -5.692 5.087 7.130
31 HA2 GLY 4 HA2 GLY 4 -7.938 5.060 9.024
32 HA3 GLY 4 HA3 GLY 4 -7.822 3.740 7.866
33 H ILE 5 H ILE 5 -7.693 2.438 9.862
34 HA ILE 5 HA ILE 5 -4.934 2.380 10.945
35 HB ILE 5 HB ILE 5 -5.962 1.139 12.899
36 HG12 ILE 5 HG12 ILE 5 -8.584 2.322 11.942
37 HG13 ILE 5 HG13 ILE 5 -8.136 0.661 11.567
38 HG21 ILE 5 HG21 ILE 5 -6.796 3.996 12.321
39 HG22 ILE 5 HG22 ILE 5 -5.317 3.463 13.122
40 HG23 ILE 5 HG23 ILE 5 -6.877 3.247 13.917
41 HD11 ILE 5 HD11 ILE 5 -8.180 1.778 14.383
42 HD12 ILE 5 HD12 ILE 5 -8.012 0.088 13.909
43 HD13 ILE 5 HD13 ILE 5 -9.543 0.928 13.656
44 H VAL 6 H VAL 6 -3.755 0.672 10.534
45 HA VAL 6 HA VAL 6 -4.650 -1.344 8.766
46 HB VAL 6 HB VAL 6 -2.114 -1.219 10.423
47 HG11 VAL 6 HG11 VAL 6 -1.280 -2.715 8.487
48 HG12 VAL 6 HG12 VAL 6 -2.984 -3.004 8.139
49 HG13 VAL 6 HG13 VAL 6 -2.312 -3.477 9.699
50 HG21 VAL 6 HG21 VAL 6 -1.102 -0.171 8.535
51 HG22 VAL 6 HG22 VAL 6 -2.638 0.669 8.746
52 HG23 VAL 6 HG23 VAL 6 -2.471 -0.554 7.488
53 H LYS 7 H LYS 7 -5.752 -3.088 9.165
54 HA LYS 7 HA LYS 7 -6.478 -3.984 11.768
55 HB2 LYS 7 HB2 LYS 7 -7.877 -4.350 9.736
56 HB3 LYS 7 HB3 LYS 7 -6.660 -5.468 9.123
57 HG2 LYS 7 HG2 LYS 7 -6.989 -6.920 11.088
58 HG3 LYS 7 HG3 LYS 7 -8.191 -5.796 11.725
59 HD2 LYS 7 HD2 LYS 7 -9.593 -6.150 9.727
60 HD3 LYS 7 HD3 LYS 7 -8.396 -7.276 9.087
61 HE2 LYS 7 HE2 LYS 7 -8.713 -8.739 11.044
62 HE3 LYS 7 HE3 LYS 7 -9.902 -7.612 11.697
63 HZ1 LYS 7 HZ1 LYS 7 -10.219 -8.733 8.987
64 HZ2 LYS 7 HZ2 LYS 7 -11.402 -8.095 10.025
65 HZ3 LYS 7 HZ3 LYS 7 -10.719 -9.617 10.346
66 H TRP 8 H TRP 8 -4.216 -5.166 9.302
67 HA TRP 8 HA TRP 8 -2.456 -6.291 11.297
68 HB2 TRP 8 HB2 TRP 8 -4.349 -8.011 10.844
69 HB3 TRP 8 HB3 TRP 8 -3.587 -8.221 9.270
70 HD1 TRP 8 HD1 TRP 8 -1.272 -9.457 9.172
71 HE1 TRP 8 HE1 TRP 8 0.054 -10.839 10.899
72 HE3 TRP 8 HE3 TRP 8 -3.802 -8.212 13.428
73 HZ2 TRP 8 HZ2 TRP 8 0.042 -11.351 13.712
74 HZ3 TRP 8 HZ3 TRP 8 -3.129 -9.164 15.615
75 HH2 TRP 8 HH2 TRP 8 -1.212 -10.731 15.763
76 H PHE 9 H PHE 9 -0.431 -5.952 10.549
77 HA PHE 9 HA PHE 9 -0.065 -5.679 7.612
78 HB2 PHE 9 HB2 PHE 9 0.466 -3.677 9.096
79 HB3 PHE 9 HB3 PHE 9 1.802 -4.629 9.748
80 HD1 PHE 9 HD1 PHE 9 0.583 -2.707 6.903
81 HD2 PHE 9 HD2 PHE 9 3.623 -5.440 8.225
82 HE1 PHE 9 HE1 PHE 9 1.962 -2.128 4.926
83 HE2 PHE 9 HE2 PHE 9 5.006 -4.855 6.250
84 HZ PHE 9 HZ PHE 9 4.173 -3.200 4.601
85 H ASN 10 H ASN 10 0.989 -7.305 6.629
86 HA ASN 10 HA ASN 10 2.951 -8.864 8.215
87 HB2 ASN 10 HB2 ASN 10 0.922 -9.823 6.197
88 HB3 ASN 10 HB3 ASN 10 2.302 -10.797 6.695
89 HD21 ASN 10 HD21 ASN 10 -0.514 -11.461 7.211
90 HD22 ASN 10 HD22 ASN 10 -0.707 -11.492 8.897
91 H SER 11 H SER 11 4.747 -7.706 7.488
92 HA SER 11 HA SER 11 5.296 -7.043 4.812
93 HB2 SER 11 HB2 SER 11 7.591 -6.704 5.581
94 HB3 SER 11 HB3 SER 11 6.453 -6.048 6.755
95 HG SER 11 HG SER 11 7.828 -7.259 7.939
96 H ASP 12 H ASP 12 5.802 -10.004 6.648
97 HA ASP 12 HA ASP 12 7.680 -11.286 4.987
98 HB2 ASP 12 HB2 ASP 12 6.971 -12.138 7.209
99 HB3 ASP 12 HB3 ASP 12 5.398 -12.555 6.527
100 H LYS 13 H LYS 13 4.136 -11.270 4.929
101 HA LYS 13 HA LYS 13 3.937 -12.802 2.499
102 HB2 LYS 13 HB2 LYS 13 1.898 -11.083 3.943
103 HB3 LYS 13 HB3 LYS 13 1.542 -12.165 2.602
104 HG2 LYS 13 HG2 LYS 13 2.808 -13.098 5.192
105 HG3 LYS 13 HG3 LYS 13 1.069 -13.134 4.895
106 HD2 LYS 13 HD2 LYS 13 1.468 -14.571 2.897
107 HD3 LYS 13 HD3 LYS 13 3.192 -14.586 3.278
108 HE2 LYS 13 HE2 LYS 13 2.702 -15.604 5.471
109 HE3 LYS 13 HE3 LYS 13 0.981 -15.594 5.092
110 HZ1 LYS 13 HZ1 LYS 13 3.024 -16.974 3.442
111 HZ2 LYS 13 HZ2 LYS 13 1.337 -17.081 3.290
112 HZ3 LYS 13 HZ3 LYS 13 2.114 -17.742 4.650
113 H GLY 14 H GLY 14 4.449 -9.482 3.307
114 HA2 GLY 14 HA2 GLY 14 5.158 -7.785 1.856
115 HA3 GLY 14 HA3 GLY 14 4.626 -8.756 0.491
116 H PHE 15 H PHE 15 2.188 -8.620 2.846
117 HA PHE 15 HA PHE 15 1.051 -6.091 2.028
118 HB2 PHE 15 HB2 PHE 15 -1.003 -7.039 1.047
119 HB3 PHE 15 HB3 PHE 15 0.429 -7.423 0.093
120 HD1 PHE 15 HD1 PHE 15 -2.122 -8.768 2.406
121 HD2 PHE 15 HD2 PHE 15 1.249 -9.697 -0.089
122 HE1 PHE 15 HE1 PHE 15 -2.665 -11.183 2.571
123 HE2 PHE 15 HE2 PHE 15 0.709 -12.110 0.080
124 HZ PHE 15 HZ PHE 15 -1.248 -12.853 1.409
125 H GLY 16 H GLY 16 -1.289 -5.934 2.868
126 HA2 GLY 16 HA2 GLY 16 -1.920 -7.500 5.211
127 HA3 GLY 16 HA3 GLY 16 -1.365 -5.868 5.579
128 H PHE 17 H PHE 17 -3.798 -6.329 6.419
129 HA PHE 17 HA PHE 17 -5.636 -5.186 4.396
130 HB2 PHE 17 HB2 PHE 17 -6.236 -6.920 6.811
131 HB3 PHE 17 HB3 PHE 17 -7.459 -6.168 5.788
132 HD1 PHE 17 HD1 PHE 17 -4.841 -8.753 5.976
133 HD2 PHE 17 HD2 PHE 17 -7.869 -6.956 3.518
134 HE1 PHE 17 HE1 PHE 17 -4.695 -10.662 4.400
135 HE2 PHE 17 HE2 PHE 17 -7.723 -8.864 1.943
136 HZ PHE 17 HZ PHE 17 -6.136 -10.717 2.381
137 H ILE 18 H ILE 18 -6.596 -3.250 4.875
138 HA ILE 18 HA ILE 18 -6.038 -2.140 7.547
139 HB ILE 18 HB ILE 18 -4.820 -0.987 5.755
140 HG12 ILE 18 HG12 ILE 18 -7.048 0.835 6.694
141 HG13 ILE 18 HG13 ILE 18 -5.831 0.209 7.811
142 HG21 ILE 18 HG21 ILE 18 -6.170 -1.290 3.828
143 HG22 ILE 18 HG22 ILE 18 -6.282 0.434 4.175
144 HG23 ILE 18 HG23 ILE 18 -7.603 -0.644 4.627
145 HD11 ILE 18 HD11 ILE 18 -5.117 1.659 5.251
146 HD12 ILE 18 HD12 ILE 18 -4.053 1.256 6.598
147 HD13 ILE 18 HD13 ILE 18 -5.304 2.482 6.801
148 H THR 19 H THR 19 -7.569 -1.048 8.658
149 HA THR 19 HA THR 19 -10.331 -1.582 7.851
150 HB THR 19 HB THR 19 -9.204 -0.760 10.534
151 HG1 THR 19 HG1 THR 19 -8.816 -2.792 10.782
152 HG21 THR 19 HG21 THR 19 -11.392 -1.406 11.411
153 HG22 THR 19 HG22 THR 19 -11.930 -1.877 9.798
154 HG23 THR 19 HG23 THR 19 -11.607 -0.180 10.160
155 HA PRO 20 HA PRO 20 -10.306 2.897 6.725
156 HB2 PRO 20 HB2 PRO 20 -13.197 2.202 6.343
157 HB3 PRO 20 HB3 PRO 20 -12.117 3.127 5.282
158 HG2 PRO 20 HG2 PRO 20 -12.742 0.663 4.658
159 HG3 PRO 20 HG3 PRO 20 -11.066 1.219 4.479
160 HD2 PRO 20 HD2 PRO 20 -12.255 -0.507 6.634
161 HD3 PRO 20 HD3 PRO 20 -10.675 -0.645 5.823
162 H GLU 21 H GLU 21 -10.573 4.548 8.142
163 HA GLU 21 HA GLU 21 -11.713 4.171 10.709
164 HB2 GLU 21 HB2 GLU 21 -11.297 6.577 11.029
165 HB3 GLU 21 HB3 GLU 21 -9.902 5.776 10.309
166 HG2 GLU 21 HG2 GLU 21 -10.649 6.543 8.061
167 HG3 GLU 21 HG3 GLU 21 -11.995 7.388 8.813
168 H ASP 22 H ASP 22 -13.023 5.363 7.700
169 HA ASP 22 HA ASP 22 -15.338 6.648 8.774
170 HB2 ASP 22 HB2 ASP 22 -14.666 5.588 6.028
171 HB3 ASP 22 HB3 ASP 22 -16.181 6.404 6.394
172 H GLY 23 H GLY 23 -14.511 3.338 8.240
173 HA2 GLY 23 HA2 GLY 23 -15.829 1.595 9.267
174 HA3 GLY 23 HA3 GLY 23 -17.273 2.530 8.901
175 H SER 24 H SER 24 -15.102 2.608 6.304
176 HA SER 24 HA SER 24 -16.820 1.062 4.615
177 HB2 SER 24 HB2 SER 24 -14.087 2.264 4.124
178 HB3 SER 24 HB3 SER 24 -15.102 1.536 2.886
179 HG SER 24 HG SER 24 -16.538 3.150 3.095
180 H LYS 25 H LYS 25 -15.875 -0.662 3.177
181 HA LYS 25 HA LYS 25 -15.015 -2.859 4.741
182 HB2 LYS 25 HB2 LYS 25 -15.027 -2.517 1.730
183 HB3 LYS 25 HB3 LYS 25 -14.826 -4.048 2.576
184 HG2 LYS 25 HG2 LYS 25 -17.250 -2.263 2.935
185 HG3 LYS 25 HG3 LYS 25 -17.186 -3.581 1.768
186 HD2 LYS 25 HD2 LYS 25 -16.675 -5.160 3.642
187 HD3 LYS 25 HD3 LYS 25 -16.881 -3.826 4.778
188 HE2 LYS 25 HE2 LYS 25 -19.008 -4.756 2.829
189 HE3 LYS 25 HE3 LYS 25 -18.945 -5.215 4.530
190 HZ1 LYS 25 HZ1 LYS 25 -20.396 -3.368 4.335
191 HZ2 LYS 25 HZ2 LYS 25 -19.276 -2.489 3.410
192 HZ3 LYS 25 HZ3 LYS 25 -18.968 -2.796 5.052
193 H ASP 26 H ASP 26 -13.055 -4.026 4.695
194 HA ASP 26 HA ASP 26 -10.727 -2.516 4.892
195 HB2 ASP 26 HB2 ASP 26 -11.104 -5.481 4.461
196 HB3 ASP 26 HB3 ASP 26 -9.559 -4.731 4.867
197 H LEU 27 H LEU 27 -8.970 -2.192 3.620
198 HA LEU 27 HA LEU 27 -9.271 -2.805 0.737
199 HB2 LEU 27 HB2 LEU 27 -7.920 -0.434 2.061
200 HB3 LEU 27 HB3 LEU 27 -7.965 -0.741 0.327
201 HG LEU 27 HG LEU 27 -10.463 -0.444 2.022
202 HD11 LEU 27 HD11 LEU 27 -10.572 1.838 0.898
203 HD12 LEU 27 HD12 LEU 27 -8.886 1.597 0.436
204 HD13 LEU 27 HD13 LEU 27 -9.331 1.667 2.141
205 HD21 LEU 27 HD21 LEU 27 -9.907 -0.449 -0.963
206 HD22 LEU 27 HD22 LEU 27 -11.447 0.050 -0.265
207 HD23 LEU 27 HD23 LEU 27 -10.884 -1.608 -0.059
208 H PHE 28 H PHE 28 -7.386 -3.365 -0.429
209 HA PHE 28 HA PHE 28 -5.404 -4.805 1.117
210 HB2 PHE 28 HB2 PHE 28 -5.812 -4.390 -1.851
211 HB3 PHE 28 HB3 PHE 28 -4.479 -5.332 -1.181
212 HD1 PHE 28 HD1 PHE 28 -8.146 -5.146 -1.597
213 HD2 PHE 28 HD2 PHE 28 -4.854 -7.488 -0.139
214 HE1 PHE 28 HE1 PHE 28 -9.639 -7.116 -1.389
215 HE2 PHE 28 HE2 PHE 28 -6.347 -9.457 0.071
216 HZ PHE 28 HZ PHE 28 -8.739 -9.270 -0.555
217 H VAL 29 H VAL 29 -3.381 -4.165 1.601
218 HA VAL 29 HA VAL 29 -2.278 -1.772 0.267
219 HB VAL 29 HB VAL 29 -2.271 -2.304 3.251
220 HG11 VAL 29 HG11 VAL 29 -0.188 -1.243 2.684
221 HG12 VAL 29 HG12 VAL 29 -1.241 0.022 3.315
222 HG13 VAL 29 HG13 VAL 29 -0.990 -0.130 1.575
223 HG21 VAL 29 HG21 VAL 29 -3.740 -0.439 3.459
224 HG22 VAL 29 HG22 VAL 29 -4.413 -1.426 2.161
225 HG23 VAL 29 HG23 VAL 29 -3.498 0.031 1.778
226 H HIS 30 H HIS 30 -0.167 -1.963 -0.307
227 HA HIS 30 HA HIS 30 1.236 -4.438 0.498
228 HB2 HIS 30 HB2 HIS 30 1.497 -2.707 -1.963
229 HB3 HIS 30 HB3 HIS 30 2.590 -4.038 -1.581
230 HD2 HIS 30 HD2 HIS 30 1.564 -6.587 -2.146
231 HE1 HIS 30 HE1 HIS 30 -2.300 -5.341 -3.306
232 HE2 HIS 30 HE2 HIS 30 -0.719 -7.325 -3.176
233 H HIS 31 H HIS 31 3.384 -4.373 1.090
234 HA HIS 31 HA HIS 31 4.234 -2.169 2.652
235 HB2 HIS 31 HB2 HIS 31 4.923 -4.548 3.016
236 HB3 HIS 31 HB3 HIS 31 5.937 -4.433 1.579
237 HD2 HIS 31 HD2 HIS 31 6.035 -3.374 5.331
238 HE1 HIS 31 HE1 HIS 31 9.497 -1.816 3.490
239 HE2 HIS 31 HE2 HIS 31 8.335 -2.206 5.712
240 H SER 32 H SER 32 5.260 -3.332 -0.534
241 HA SER 32 HA SER 32 7.344 -1.530 -1.003
242 HB2 SER 32 HB2 SER 32 5.504 -2.934 -2.937
243 HB3 SER 32 HB3 SER 32 6.952 -2.054 -3.418
244 HG SER 32 HG SER 32 6.670 -4.480 -2.101
245 H GLU 33 H GLU 33 3.939 -0.908 -1.053
246 HA GLU 33 HA GLU 33 3.926 1.235 -2.927
247 HB2 GLU 33 HB2 GLU 33 2.039 0.457 -0.707
248 HB3 GLU 33 HB3 GLU 33 1.739 1.818 -1.789
249 HG2 GLU 33 HG2 GLU 33 1.737 0.380 -3.722
250 HG3 GLU 33 HG3 GLU 33 2.303 -0.988 -2.775
251 H ILE 34 H ILE 34 4.812 1.090 0.455
252 HA ILE 34 HA ILE 34 4.405 3.787 1.147
253 HB ILE 34 HB ILE 34 4.865 2.006 2.789
254 HG12 ILE 34 HG12 ILE 34 7.039 4.101 3.010
255 HG13 ILE 34 HG13 ILE 34 5.338 4.510 3.197
256 HG21 ILE 34 HG21 ILE 34 6.831 0.810 2.907
257 HG22 ILE 34 HG22 ILE 34 7.821 2.146 2.323
258 HG23 ILE 34 HG23 ILE 34 6.892 1.177 1.184
259 HD11 ILE 34 HD11 ILE 34 6.670 3.931 5.339
260 HD12 ILE 34 HD12 ILE 34 6.580 2.260 4.781
261 HD13 ILE 34 HD13 ILE 34 5.100 3.158 5.122
262 H GLN 35 H GLN 35 5.548 5.615 0.876
263 HA GLN 35 HA GLN 35 8.139 5.476 -0.539
264 HB2 GLN 35 HB2 GLN 35 5.814 7.312 -1.167
265 HB3 GLN 35 HB3 GLN 35 7.431 7.479 -1.847
266 HG2 GLN 35 HG2 GLN 35 7.263 5.213 -2.811
267 HG3 GLN 35 HG3 GLN 35 5.645 5.045 -2.134
268 HE21 GLN 35 HE21 GLN 35 4.349 5.091 -4.015
269 HE22 GLN 35 HE22 GLN 35 4.363 6.363 -5.140
270 H SER 36 H SER 36 9.540 7.267 -0.173
271 HA SER 36 HA SER 36 10.613 8.807 1.147
272 HB2 SER 36 HB2 SER 36 8.672 10.202 0.370
273 HB3 SER 36 HB3 SER 36 7.815 9.748 1.840
274 HG SER 36 HG SER 36 8.878 11.310 2.746
275 H GLY 37 H GLY 37 10.096 9.899 3.635
276 HA2 GLY 37 HA2 GLY 37 9.863 9.439 5.907
277 HA3 GLY 37 HA3 GLY 37 9.238 7.845 5.495
278 H GLY 38 H GLY 38 10.613 7.031 7.210
279 HA2 GLY 38 HA2 GLY 38 13.450 7.264 7.164
280 HA3 GLY 38 HA3 GLY 38 12.524 6.060 8.058
281 H GLU 39 H GLU 39 14.956 5.472 6.788
282 HA GLU 39 HA GLU 39 14.733 4.394 4.198
283 HB2 GLU 39 HB2 GLU 39 16.884 4.815 5.368
284 HB3 GLU 39 HB3 GLU 39 16.532 3.476 6.459
285 HG2 GLU 39 HG2 GLU 39 16.511 1.909 4.575
286 HG3 GLU 39 HG3 GLU 39 16.773 3.235 3.444
287 H TYR 40 H TYR 40 14.216 2.938 7.401
288 HA TYR 40 HA TYR 40 12.963 0.603 6.072
289 HB2 TYR 40 HB2 TYR 40 14.338 0.765 8.764
290 HB3 TYR 40 HB3 TYR 40 13.480 -0.650 8.158
291 HD1 TYR 40 HD1 TYR 40 16.509 1.388 7.901
292 HD2 TYR 40 HD2 TYR 40 14.328 -1.889 6.184
293 HE1 TYR 40 HE1 TYR 40 18.541 0.681 6.666
294 HE2 TYR 40 HE2 TYR 40 16.358 -2.596 4.950
295 HH TYR 40 HH TYR 40 18.692 -0.983 4.175
296 H ALA 41 H ALA 41 10.825 0.740 6.155
297 HA ALA 41 HA ALA 41 9.524 2.149 8.382
298 HB1 ALA 41 HB1 ALA 41 8.035 1.021 6.043
299 HB2 ALA 41 HB2 ALA 41 9.018 2.468 5.822
300 HB3 ALA 41 HB3 ALA 41 7.699 2.468 6.992
301 H THR 42 H THR 42 8.465 1.107 9.956
302 HA THR 42 HA THR 42 8.052 -1.808 9.671
303 HB THR 42 HB THR 42 8.392 -0.149 12.192
304 HG1 THR 42 HG1 THR 42 10.418 -1.074 12.239
305 HG21 THR 42 HG21 THR 42 7.026 -2.124 12.615
306 HG22 THR 42 HG22 THR 42 8.643 -2.401 13.263
307 HG23 THR 42 HG23 THR 42 8.168 -3.140 11.735
308 H LEU 43 H LEU 43 6.054 -2.601 9.801
309 HA LEU 43 HA LEU 43 3.891 -0.964 10.934
310 HB2 LEU 43 HB2 LEU 43 3.821 -2.288 8.212
311 HB3 LEU 43 HB3 LEU 43 2.409 -1.642 9.040
312 HG LEU 43 HG LEU 43 3.985 0.552 9.188
313 HD11 LEU 43 HD11 LEU 43 4.812 -0.643 6.530
314 HD12 LEU 43 HD12 LEU 43 5.837 -0.729 7.961
315 HD13 LEU 43 HD13 LEU 43 5.399 0.838 7.286
316 HD21 LEU 43 HD21 LEU 43 2.904 1.331 7.061
317 HD22 LEU 43 HD22 LEU 43 1.776 0.558 8.173
318 HD23 LEU 43 HD23 LEU 43 2.373 -0.327 6.770
319 H ALA 44 H ALA 44 2.223 -2.163 11.862
320 HA ALA 44 HA ALA 44 2.354 -5.088 11.755
321 HB1 ALA 44 HB1 ALA 44 2.364 -3.706 14.438
322 HB2 ALA 44 HB2 ALA 44 3.866 -4.134 13.621
323 HB3 ALA 44 HB3 ALA 44 2.716 -5.394 14.070
324 H ASP 45 H ASP 45 0.579 -5.174 14.228
325 HA ASP 45 HA ASP 45 -1.932 -4.714 12.844
326 HB2 ASP 45 HB2 ASP 45 -1.546 -6.793 14.123
327 HB3 ASP 45 HB3 ASP 45 -1.354 -5.850 15.593
328 H GLY 46 H GLY 46 -2.758 -2.707 12.890
329 HA2 GLY 46 HA2 GLY 46 -4.038 -1.103 14.156
330 HA3 GLY 46 HA3 GLY 46 -2.914 -1.314 15.488
331 H GLN 47 H GLN 47 -1.090 -1.166 12.693
332 HA GLN 47 HA GLN 47 0.053 1.348 13.302
333 HB2 GLN 47 HB2 GLN 47 1.186 -0.527 12.081
334 HB3 GLN 47 HB3 GLN 47 0.183 -0.160 10.678
335 HG2 GLN 47 HG2 GLN 47 2.354 0.931 10.435
336 HG3 GLN 47 HG3 GLN 47 1.103 2.147 10.655
337 HE21 GLN 47 HE21 GLN 47 1.890 3.784 11.985
338 HE22 GLN 47 HE22 GLN 47 2.857 3.543 13.358
339 H THR 48 H THR 48 -0.511 3.361 12.733
340 HA THR 48 HA THR 48 -2.895 3.771 11.094
341 HB THR 48 HB THR 48 -1.168 5.776 12.587
342 HG1 THR 48 HG1 THR 48 -2.359 5.323 14.266
343 HG21 THR 48 HG21 THR 48 -3.997 6.031 11.520
344 HG22 THR 48 HG22 THR 48 -2.575 6.719 10.738
345 HG23 THR 48 HG23 THR 48 -3.062 7.286 12.335
346 H VAL 49 H VAL 49 -2.845 4.312 8.997
347 HA VAL 49 HA VAL 49 -0.450 5.638 7.917
348 HB VAL 49 HB VAL 49 -0.391 4.108 5.974
349 HG11 VAL 49 HG11 VAL 49 0.758 2.325 7.096
350 HG12 VAL 49 HG12 VAL 49 -0.178 2.570 8.572
351 HG13 VAL 49 HG13 VAL 49 1.005 3.777 8.066
352 HG21 VAL 49 HG21 VAL 49 -2.481 2.607 7.579
353 HG22 VAL 49 HG22 VAL 49 -1.582 1.895 6.240
354 HG23 VAL 49 HG23 VAL 49 -2.657 3.261 5.951
355 H GLU 50 H GLU 50 -0.774 6.347 5.638
356 HA GLU 50 HA GLU 50 -3.548 7.307 5.232
357 HB2 GLU 50 HB2 GLU 50 -0.949 8.547 4.262
358 HB3 GLU 50 HB3 GLU 50 -2.565 9.196 4.003
359 HG2 GLU 50 HG2 GLU 50 -2.853 9.439 6.449
360 HG3 GLU 50 HG3 GLU 50 -1.231 8.806 6.700
361 H TYR 51 H TYR 51 -4.486 6.873 3.245
362 HA TYR 51 HA TYR 51 -2.861 5.870 1.046
363 HB2 TYR 51 HB2 TYR 51 -4.112 3.754 0.850
364 HB3 TYR 51 HB3 TYR 51 -3.215 3.836 2.359
365 HD1 TYR 51 HD1 TYR 51 -6.551 3.894 0.812
366 HD2 TYR 51 HD2 TYR 51 -4.375 4.132 4.508
367 HE1 TYR 51 HE1 TYR 51 -8.659 3.558 2.075
368 HE2 TYR 51 HE2 TYR 51 -6.482 3.793 5.771
369 HH TYR 51 HH TYR 51 -8.901 4.104 5.424
370 H GLU 52 H GLU 52 -4.110 5.420 -0.895
371 HA GLU 52 HA GLU 52 -6.636 6.958 -1.027
372 HB2 GLU 52 HB2 GLU 52 -4.381 6.851 -3.044
373 HB3 GLU 52 HB3 GLU 52 -5.966 7.550 -3.370
374 HG2 GLU 52 HG2 GLU 52 -5.661 9.136 -1.508
375 HG3 GLU 52 HG3 GLU 52 -4.085 8.433 -1.161
376 H VAL 53 H VAL 53 -8.308 5.906 -1.906
377 HA VAL 53 HA VAL 53 -8.251 3.133 -2.354
378 HB VAL 53 HB VAL 53 -10.279 4.396 -1.715
379 HG11 VAL 53 HG11 VAL 53 -11.498 5.742 -3.314
380 HG12 VAL 53 HG12 VAL 53 -10.341 5.355 -4.588
381 HG13 VAL 53 HG13 VAL 53 -9.848 6.357 -3.223
382 HG21 VAL 53 HG21 VAL 53 -10.611 2.956 -4.364
383 HG22 VAL 53 HG22 VAL 53 -11.855 3.183 -3.135
384 HG23 VAL 53 HG23 VAL 53 -10.460 2.157 -2.799
385 H GLY 54 H GLY 54 -8.488 1.914 -4.236
386 HA2 GLY 54 HA2 GLY 54 -7.947 3.178 -6.828
387 HA3 GLY 54 HA3 GLY 54 -6.809 1.958 -6.254
388 H GLN 55 H GLN 55 -8.206 1.569 -8.624
389 HA GLN 55 HA GLN 55 -10.399 -0.279 -7.974
390 HB2 GLN 55 HB2 GLN 55 -9.474 0.953 -10.575
391 HB3 GLN 55 HB3 GLN 55 -10.744 -0.271 -10.471
392 HG2 GLN 55 HG2 GLN 55 -12.102 1.160 -9.075
393 HG3 GLN 55 HG3 GLN 55 -10.802 2.339 -8.932
394 HE21 GLN 55 HE21 GLN 55 -13.570 2.680 -10.101
395 HE22 GLN 55 HE22 GLN 55 -13.314 3.236 -11.683
396 H GLY 56 H GLY 56 -10.328 -2.424 -8.379
397 HA2 GLY 56 HA2 GLY 56 -8.024 -3.585 -9.783
398 HA3 GLY 56 HA3 GLY 56 -8.309 -4.085 -8.118
399 H GLN 57 H GLN 57 -8.382 -5.761 -10.475
400 HA GLN 57 HA GLN 57 -11.011 -6.300 -11.358
401 HB2 GLN 57 HB2 GLN 57 -8.536 -8.027 -11.230
402 HB3 GLN 57 HB3 GLN 57 -10.040 -8.540 -11.996
403 HG2 GLN 57 HG2 GLN 57 -9.954 -6.579 -13.489
404 HG3 GLN 57 HG3 GLN 57 -8.453 -6.063 -12.721
405 HE21 GLN 57 HE21 GLN 57 -6.953 -6.403 -14.418
406 HE22 GLN 57 HE22 GLN 57 -6.707 -7.906 -15.169
407 H LYS 58 H LYS 58 -9.094 -7.648 -8.689
408 HA LYS 58 HA LYS 58 -11.255 -9.427 -7.888
409 HB2 LYS 58 HB2 LYS 58 -8.540 -8.854 -6.689
410 HB3 LYS 58 HB3 LYS 58 -9.684 -10.025 -6.031
411 HG2 LYS 58 HG2 LYS 58 -9.681 -11.237 -8.185
412 HG3 LYS 58 HG3 LYS 58 -8.527 -10.074 -8.834
413 HD2 LYS 58 HD2 LYS 58 -6.891 -10.711 -7.112
414 HD3 LYS 58 HD3 LYS 58 -8.047 -11.850 -6.421
415 HE2 LYS 58 HE2 LYS 58 -6.485 -13.052 -7.869
416 HE3 LYS 58 HE3 LYS 58 -8.094 -13.072 -8.591
417 HZ1 LYS 58 HZ1 LYS 58 -6.235 -10.908 -9.291
418 HZ2 LYS 58 HZ2 LYS 58 -7.492 -11.590 -10.210
419 HZ3 LYS 58 HZ3 LYS 58 -6.029 -12.432 -10.009
420 H GLY 59 H GLY 59 -10.139 -6.243 -7.128
421 HA2 GLY 59 HA2 GLY 59 -12.323 -5.349 -5.746
422 HA3 GLY 59 HA3 GLY 59 -11.309 -6.067 -4.498
423 HA PRO 60 HA PRO 60 -9.825 -1.684 -5.566
424 HB2 PRO 60 HB2 PRO 60 -10.392 -0.392 -3.251
425 HB3 PRO 60 HB3 PRO 60 -11.576 -0.553 -4.566
426 HG2 PRO 60 HG2 PRO 60 -11.303 -2.160 -2.065
427 HG3 PRO 60 HG3 PRO 60 -12.758 -1.473 -2.809
428 HD2 PRO 60 HD2 PRO 60 -12.067 -4.092 -3.116
429 HD3 PRO 60 HD3 PRO 60 -12.918 -3.182 -4.385
430 H CYS 61 H CYS 61 -7.936 -0.700 -4.821
431 HA CYS 61 HA CYS 61 -6.469 -2.098 -2.665
432 HB2 CYS 61 HB2 CYS 61 -5.352 -1.073 -5.289
433 HB3 CYS 61 HB3 CYS 61 -4.410 -1.793 -3.984
434 HG CYS 61 HG CYS 61 -5.410 -3.473 -6.030
435 H ALA 62 H ALA 62 -4.529 -0.686 -1.942
436 HA ALA 62 HA ALA 62 -5.300 2.166 -1.953
437 HB1 ALA 62 HB1 ALA 62 -5.072 0.339 0.299
438 HB2 ALA 62 HB2 ALA 62 -5.687 1.990 0.257
439 HB3 ALA 62 HB3 ALA 62 -3.962 1.700 0.471
440 H ASN 63 H ASN 63 -3.629 3.616 -2.206
441 HA ASN 63 HA ASN 63 -0.885 2.517 -2.350
442 HB2 ASN 63 HB2 ASN 63 -0.486 3.943 -4.334
443 HB3 ASN 63 HB3 ASN 63 -1.723 2.724 -4.631
444 HD21 ASN 63 HD21 ASN 63 -3.255 3.702 -5.972
445 HD22 ASN 63 HD22 ASN 63 -3.925 5.239 -5.708
446 H LYS 64 H LYS 64 0.677 4.545 -2.675
447 HA LYS 64 HA LYS 64 1.683 6.310 -1.612
448 HB2 LYS 64 HB2 LYS 64 -1.189 7.272 -1.507
449 HB3 LYS 64 HB3 LYS 64 0.209 8.269 -1.100
450 HG2 LYS 64 HG2 LYS 64 1.124 7.909 -3.365
451 HG3 LYS 64 HG3 LYS 64 -0.275 6.915 -3.773
452 HD2 LYS 64 HD2 LYS 64 -1.763 8.840 -3.366
453 HD3 LYS 64 HD3 LYS 64 -0.365 9.837 -2.963
454 HE2 LYS 64 HE2 LYS 64 0.548 9.483 -5.224
455 HE3 LYS 64 HE3 LYS 64 -0.841 8.476 -5.631
456 HZ1 LYS 64 HZ1 LYS 64 -1.011 10.834 -6.365
457 HZ2 LYS 64 HZ2 LYS 64 -1.063 11.293 -4.731
458 HZ3 LYS 64 HZ3 LYS 64 -2.292 10.317 -5.382
459 H VAL 65 H VAL 65 1.523 4.172 -0.049
460 HA VAL 65 HA VAL 65 0.167 4.575 2.434
461 HB VAL 65 HB VAL 65 2.491 2.747 1.742
462 HG11 VAL 65 HG11 VAL 65 0.564 2.691 4.090
463 HG12 VAL 65 HG12 VAL 65 2.276 3.101 4.177
464 HG13 VAL 65 HG13 VAL 65 1.781 1.466 3.737
465 HG21 VAL 65 HG21 VAL 65 0.374 2.406 0.424
466 HG22 VAL 65 HG22 VAL 65 -0.474 2.136 1.946
467 HG23 VAL 65 HG23 VAL 65 0.801 1.028 1.440
468 H VAL 66 H VAL 66 0.683 5.950 3.947
469 HA VAL 66 HA VAL 66 3.520 6.719 4.349
470 HB VAL 66 HB VAL 66 1.107 8.551 4.563
471 HG11 VAL 66 HG11 VAL 66 4.067 9.100 4.942
472 HG12 VAL 66 HG12 VAL 66 2.840 9.118 6.210
473 HG13 VAL 66 HG13 VAL 66 2.800 10.327 4.926
474 HG21 VAL 66 HG21 VAL 66 3.404 8.481 2.579
475 HG22 VAL 66 HG22 VAL 66 2.157 9.726 2.647
476 HG23 VAL 66 HG23 VAL 66 1.725 8.069 2.230
477 H ALA 67 H ALA 67 4.237 6.248 6.323
478 HA ALA 67 HA ALA 67 2.478 5.245 8.360
479 HB1 ALA 67 HB1 ALA 67 4.773 4.374 8.028
480 HB2 ALA 67 HB2 ALA 67 4.513 4.951 9.674
481 HB3 ALA 67 HB3 ALA 67 5.420 5.937 8.528
482 H VAL 68 H VAL 68 1.667 6.242 10.107
483 HA VAL 68 HA VAL 68 2.737 8.780 11.037
484 HB VAL 68 HB VAL 68 1.204 9.452 9.217
485 HG11 VAL 68 HG11 VAL 68 -0.315 7.473 9.388
486 HG12 VAL 68 HG12 VAL 68 -1.182 9.009 9.352
487 HG13 VAL 68 HG13 VAL 68 -0.973 8.150 10.879
488 HG21 VAL 68 HG21 VAL 68 -0.064 10.091 11.891
489 HG22 VAL 68 HG22 VAL 68 0.008 11.113 10.456
490 HG23 VAL 68 HG23 VAL 68 1.475 10.785 11.379
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 -8.454 13.514 0.746
2 H2 MET 1 HT2 MET 1 -7.084 14.252 0.064
3 H3 MET 1 HT3 MET 1 -7.458 14.496 1.703
4 HA MET 1 HA MET 1 -6.333 12.120 0.382
5 HB2 MET 1 HB2 MET 1 -5.731 13.749 2.862
6 HB3 MET 1 HB3 MET 1 -4.936 12.214 2.508
7 HG2 MET 1 HG2 MET 1 -4.120 13.111 0.368
8 HG3 MET 1 HG3 MET 1 -4.944 14.638 0.683
9 HE1 MET 1 HE1 MET 1 -1.190 15.526 1.053
10 HE2 MET 1 HE2 MET 1 -2.666 15.666 0.100
11 HE3 MET 1 HE3 MET 1 -1.743 14.165 0.066
12 H SER 2 H SER 2 -6.011 10.309 2.091
13 HA SER 2 HA SER 2 -8.279 9.975 3.902
14 HB2 SER 2 HB2 SER 2 -9.155 9.135 1.774
15 HB3 SER 2 HB3 SER 2 -7.754 8.083 1.597
16 HG SER 2 HG SER 2 -10.015 7.751 3.064
17 H LYS 3 H LYS 3 -7.923 8.454 5.508
18 HA LYS 3 HA LYS 3 -5.570 6.757 5.471
19 HB2 LYS 3 HB2 LYS 3 -4.575 7.731 7.506
20 HB3 LYS 3 HB3 LYS 3 -4.583 8.888 6.179
21 HG2 LYS 3 HG2 LYS 3 -6.639 9.921 7.113
22 HG3 LYS 3 HG3 LYS 3 -6.584 8.778 8.458
23 HD2 LYS 3 HD2 LYS 3 -4.408 9.652 9.157
24 HD3 LYS 3 HD3 LYS 3 -4.380 10.744 7.772
25 HE2 LYS 3 HE2 LYS 3 -5.107 11.968 9.758
26 HE3 LYS 3 HE3 LYS 3 -6.450 11.834 8.626
27 HZ1 LYS 3 HZ1 LYS 3 -6.054 9.840 10.767
28 HZ2 LYS 3 HZ2 LYS 3 -7.471 10.207 9.903
29 HZ3 LYS 3 HZ3 LYS 3 -6.879 11.292 11.069
30 H GLY 4 H GLY 4 -5.707 5.066 6.890
31 HA2 GLY 4 HA2 GLY 4 -7.992 5.004 8.761
32 HA3 GLY 4 HA3 GLY 4 -7.742 3.690 7.615
33 H ILE 5 H ILE 5 -7.646 2.360 9.591
34 HA ILE 5 HA ILE 5 -4.928 2.430 10.777
35 HB ILE 5 HB ILE 5 -5.956 1.256 12.762
36 HG12 ILE 5 HG12 ILE 5 -8.595 2.312 11.708
37 HG13 ILE 5 HG13 ILE 5 -8.087 0.651 11.422
38 HG21 ILE 5 HG21 ILE 5 -6.912 4.050 12.070
39 HG22 ILE 5 HG22 ILE 5 -5.386 3.626 12.847
40 HG23 ILE 5 HG23 ILE 5 -6.912 3.365 13.694
41 HD11 ILE 5 HD11 ILE 5 -9.535 0.921 13.458
42 HD12 ILE 5 HD12 ILE 5 -8.264 1.915 14.172
43 HD13 ILE 5 HD13 ILE 5 -7.957 0.218 13.808
44 H VAL 6 H VAL 6 -3.720 0.707 10.521
45 HA VAL 6 HA VAL 6 -4.551 -1.381 8.785
46 HB VAL 6 HB VAL 6 -2.045 -1.148 10.480
47 HG11 VAL 6 HG11 VAL 6 -1.143 -2.705 8.644
48 HG12 VAL 6 HG12 VAL 6 -2.828 -3.014 8.226
49 HG13 VAL 6 HG13 VAL 6 -2.226 -3.439 9.827
50 HG21 VAL 6 HG21 VAL 6 -2.383 -0.587 7.521
51 HG22 VAL 6 HG22 VAL 6 -1.012 -0.177 8.552
52 HG23 VAL 6 HG23 VAL 6 -2.547 0.673 8.743
53 H LYS 7 H LYS 7 -5.622 -3.140 9.245
54 HA LYS 7 HA LYS 7 -6.370 -3.924 11.880
55 HB2 LYS 7 HB2 LYS 7 -7.722 -4.447 9.852
56 HB3 LYS 7 HB3 LYS 7 -6.454 -5.545 9.311
57 HG2 LYS 7 HG2 LYS 7 -6.760 -6.916 11.335
58 HG3 LYS 7 HG3 LYS 7 -8.008 -5.810 11.905
59 HD2 LYS 7 HD2 LYS 7 -9.392 -6.317 9.943
60 HD3 LYS 7 HD3 LYS 7 -8.133 -7.380 9.314
61 HE2 LYS 7 HE2 LYS 7 -9.847 -8.718 10.435
62 HE3 LYS 7 HE3 LYS 7 -8.341 -8.793 11.352
63 HZ1 LYS 7 HZ1 LYS 7 -10.370 -6.748 11.981
64 HZ2 LYS 7 HZ2 LYS 7 -9.163 -7.404 12.982
65 HZ3 LYS 7 HZ3 LYS 7 -10.535 -8.324 12.585
66 H TRP 8 H TRP 8 -4.046 -5.157 9.509
67 HA TRP 8 HA TRP 8 -2.248 -6.095 11.560
68 HB2 TRP 8 HB2 TRP 8 -4.067 -7.908 11.252
69 HB3 TRP 8 HB3 TRP 8 -3.339 -8.189 9.672
70 HD1 TRP 8 HD1 TRP 8 -0.589 -8.720 9.770
71 HE1 TRP 8 HE1 TRP 8 0.680 -10.171 11.482
72 HE3 TRP 8 HE3 TRP 8 -3.996 -8.785 13.573
73 HZ2 TRP 8 HZ2 TRP 8 0.298 -11.228 14.114
74 HZ3 TRP 8 HZ3 TRP 8 -3.521 -10.022 15.666
75 HH2 TRP 8 HH2 TRP 8 -1.380 -11.244 15.941
76 H PHE 9 H PHE 9 -0.232 -5.754 10.775
77 HA PHE 9 HA PHE 9 0.082 -5.573 7.826
78 HB2 PHE 9 HB2 PHE 9 0.651 -3.554 9.286
79 HB3 PHE 9 HB3 PHE 9 2.010 -4.505 9.897
80 HD1 PHE 9 HD1 PHE 9 0.628 -2.701 7.028
81 HD2 PHE 9 HD2 PHE 9 3.834 -5.222 8.375
82 HE1 PHE 9 HE1 PHE 9 1.933 -2.123 5.000
83 HE2 PHE 9 HE2 PHE 9 5.138 -4.640 6.348
84 HZ PHE 9 HZ PHE 9 4.190 -3.093 4.661
85 H ASN 10 H ASN 10 1.019 -7.288 6.885
86 HA ASN 10 HA ASN 10 2.934 -8.897 8.480
87 HB2 ASN 10 HB2 ASN 10 1.232 -9.776 6.134
88 HB3 ASN 10 HB3 ASN 10 2.333 -10.796 7.055
89 HD21 ASN 10 HD21 ASN 10 1.748 -11.252 9.335
90 HD22 ASN 10 HD22 ASN 10 0.131 -11.118 9.834
91 H SER 11 H SER 11 4.716 -7.513 7.879
92 HA SER 11 HA SER 11 5.436 -6.883 5.241
93 HB2 SER 11 HB2 SER 11 7.651 -6.421 6.167
94 HB3 SER 11 HB3 SER 11 6.401 -5.795 7.235
95 HG SER 11 HG SER 11 8.305 -7.607 7.739
96 H ASP 12 H ASP 12 6.042 -9.753 7.205
97 HA ASP 12 HA ASP 12 8.056 -10.947 5.638
98 HB2 ASP 12 HB2 ASP 12 5.881 -12.155 7.361
99 HB3 ASP 12 HB3 ASP 12 7.144 -13.115 6.595
100 H LYS 13 H LYS 13 4.522 -11.105 5.447
101 HA LYS 13 HA LYS 13 4.494 -12.830 3.138
102 HB2 LYS 13 HB2 LYS 13 2.311 -11.124 4.369
103 HB3 LYS 13 HB3 LYS 13 2.071 -12.330 3.110
104 HG2 LYS 13 HG2 LYS 13 3.296 -12.984 5.801
105 HG3 LYS 13 HG3 LYS 13 1.568 -13.126 5.470
106 HD2 LYS 13 HD2 LYS 13 2.071 -14.702 3.615
107 HD3 LYS 13 HD3 LYS 13 3.790 -14.590 4.003
108 HE2 LYS 13 HE2 LYS 13 2.857 -16.587 5.054
109 HE3 LYS 13 HE3 LYS 13 3.289 -15.418 6.302
110 HZ1 LYS 13 HZ1 LYS 13 0.571 -15.421 5.179
111 HZ2 LYS 13 HZ2 LYS 13 1.103 -14.897 6.705
112 HZ3 LYS 13 HZ3 LYS 13 0.987 -16.559 6.366
113 H GLY 14 H GLY 14 4.729 -9.427 3.715
114 HA2 GLY 14 HA2 GLY 14 5.442 -7.820 2.148
115 HA3 GLY 14 HA3 GLY 14 4.965 -8.902 0.847
116 H PHE 15 H PHE 15 2.489 -8.720 3.155
117 HA PHE 15 HA PHE 15 1.264 -6.292 2.169
118 HB2 PHE 15 HB2 PHE 15 -0.740 -7.386 1.248
119 HB3 PHE 15 HB3 PHE 15 0.707 -7.790 0.330
120 HD1 PHE 15 HD1 PHE 15 -1.804 -9.045 2.735
121 HD2 PHE 15 HD2 PHE 15 1.607 -10.041 0.322
122 HE1 PHE 15 HE1 PHE 15 -2.261 -11.458 3.085
123 HE2 PHE 15 HE2 PHE 15 1.153 -12.453 0.675
124 HZ PHE 15 HZ PHE 15 -0.780 -13.162 2.056
125 H GLY 16 H GLY 16 -1.064 -6.137 3.034
126 HA2 GLY 16 HA2 GLY 16 -1.628 -7.602 5.461
127 HA3 GLY 16 HA3 GLY 16 -1.123 -5.937 5.738
128 H PHE 17 H PHE 17 -3.538 -6.461 6.625
129 HA PHE 17 HA PHE 17 -5.426 -5.467 4.569
130 HB2 PHE 17 HB2 PHE 17 -5.958 -7.106 7.066
131 HB3 PHE 17 HB3 PHE 17 -7.208 -6.448 6.011
132 HD1 PHE 17 HD1 PHE 17 -4.546 -8.960 6.351
133 HD2 PHE 17 HD2 PHE 17 -7.540 -7.322 3.744
134 HE1 PHE 17 HE1 PHE 17 -4.330 -10.932 4.863
135 HE2 PHE 17 HE2 PHE 17 -7.324 -9.294 2.256
136 HZ PHE 17 HZ PHE 17 -5.716 -11.099 2.815
137 H ILE 18 H ILE 18 -6.413 -3.541 4.947
138 HA ILE 18 HA ILE 18 -5.896 -2.278 7.560
139 HB ILE 18 HB ILE 18 -4.711 -1.191 5.706
140 HG12 ILE 18 HG12 ILE 18 -6.995 0.614 6.534
141 HG13 ILE 18 HG13 ILE 18 -5.756 0.097 7.681
142 HG21 ILE 18 HG21 ILE 18 -6.197 0.081 4.035
143 HG22 ILE 18 HG22 ILE 18 -7.501 -0.986 4.556
144 HG23 ILE 18 HG23 ILE 18 -6.058 -1.661 3.802
145 HD11 ILE 18 HD11 ILE 18 -5.147 2.265 6.692
146 HD12 ILE 18 HD12 ILE 18 -5.259 1.571 5.075
147 HD13 ILE 18 HD13 ILE 18 -4.006 1.018 6.184
148 H THR 19 H THR 19 -7.469 -1.181 8.611
149 HA THR 19 HA THR 19 -10.207 -1.838 7.828
150 HB THR 19 HB THR 19 -9.130 -0.818 10.460
151 HG1 THR 19 HG1 THR 19 -9.178 -2.923 11.082
152 HG21 THR 19 HG21 THR 19 -11.832 -1.896 9.612
153 HG22 THR 19 HG22 THR 19 -11.479 -0.297 10.266
154 HG23 THR 19 HG23 THR 19 -11.341 -1.722 11.298
155 HA PRO 20 HA PRO 20 -10.314 2.565 6.450
156 HB2 PRO 20 HB2 PRO 20 -13.175 1.768 6.063
157 HB3 PRO 20 HB3 PRO 20 -12.098 2.647 4.959
158 HG2 PRO 20 HG2 PRO 20 -12.657 0.133 4.490
159 HG3 PRO 20 HG3 PRO 20 -10.995 0.717 4.296
160 HD2 PRO 20 HD2 PRO 20 -12.172 -0.888 6.547
161 HD3 PRO 20 HD3 PRO 20 -10.584 -1.051 5.761
162 H GLU 21 H GLU 21 -10.633 4.272 7.797
163 HA GLU 21 HA GLU 21 -11.837 3.981 10.348
164 HB2 GLU 21 HB2 GLU 21 -11.448 6.387 10.597
165 HB3 GLU 21 HB3 GLU 21 -10.035 5.599 9.900
166 HG2 GLU 21 HG2 GLU 21 -10.780 6.299 7.635
167 HG3 GLU 21 HG3 GLU 21 -12.159 7.120 8.353
168 H ASP 22 H ASP 22 -13.085 5.006 7.257
169 HA ASP 22 HA ASP 22 -15.441 6.319 8.194
170 HB2 ASP 22 HB2 ASP 22 -14.691 5.101 5.534
171 HB3 ASP 22 HB3 ASP 22 -16.221 5.924 5.813
172 H GLY 23 H GLY 23 -14.566 2.992 7.884
173 HA2 GLY 23 HA2 GLY 23 -15.893 1.302 8.986
174 HA3 GLY 23 HA3 GLY 23 -17.338 2.193 8.522
175 H SER 24 H SER 24 -15.096 2.134 5.984
176 HA SER 24 HA SER 24 -16.747 0.446 4.362
177 HB2 SER 24 HB2 SER 24 -14.041 1.694 3.844
178 HB3 SER 24 HB3 SER 24 -15.002 0.849 2.638
179 HG SER 24 HG SER 24 -15.998 2.670 2.380
180 H LYS 25 H LYS 25 -15.752 -1.350 3.073
181 HA LYS 25 HA LYS 25 -14.855 -3.405 4.797
182 HB2 LYS 25 HB2 LYS 25 -14.648 -4.764 2.753
183 HB3 LYS 25 HB3 LYS 25 -16.172 -3.879 2.786
184 HG2 LYS 25 HG2 LYS 25 -15.195 -2.150 1.305
185 HG3 LYS 25 HG3 LYS 25 -13.678 -3.050 1.263
186 HD2 LYS 25 HD2 LYS 25 -14.849 -4.982 0.269
187 HD3 LYS 25 HD3 LYS 25 -16.366 -4.083 0.308
188 HE2 LYS 25 HE2 LYS 25 -15.399 -2.371 -1.179
189 HE3 LYS 25 HE3 LYS 25 -13.878 -3.261 -1.216
190 HZ1 LYS 25 HZ1 LYS 25 -15.223 -3.767 -3.148
191 HZ2 LYS 25 HZ2 LYS 25 -16.506 -4.273 -2.156
192 HZ3 LYS 25 HZ3 LYS 25 -15.050 -5.146 -2.176
193 H ASP 26 H ASP 26 -12.870 -4.591 4.756
194 HA ASP 26 HA ASP 26 -10.567 -3.017 4.940
195 HB2 ASP 26 HB2 ASP 26 -10.944 -5.999 4.669
196 HB3 ASP 26 HB3 ASP 26 -9.370 -5.258 4.929
197 H LEU 27 H LEU 27 -8.808 -2.707 3.646
198 HA LEU 27 HA LEU 27 -9.093 -3.482 0.801
199 HB2 LEU 27 HB2 LEU 27 -7.856 -0.972 1.960
200 HB3 LEU 27 HB3 LEU 27 -7.905 -1.388 0.250
201 HG LEU 27 HG LEU 27 -10.386 -1.085 1.974
202 HD11 LEU 27 HD11 LEU 27 -10.652 1.096 0.786
203 HD12 LEU 27 HD12 LEU 27 -9.044 0.881 0.094
204 HD13 LEU 27 HD13 LEU 27 -9.236 1.066 1.837
205 HD21 LEU 27 HD21 LEU 27 -9.931 -1.260 -1.025
206 HD22 LEU 27 HD22 LEU 27 -11.482 -0.878 -0.280
207 HD23 LEU 27 HD23 LEU 27 -10.742 -2.458 -0.018
208 H PHE 28 H PHE 28 -7.180 -3.973 -0.353
209 HA PHE 28 HA PHE 28 -5.144 -5.271 1.243
210 HB2 PHE 28 HB2 PHE 28 -5.543 -4.963 -1.738
211 HB3 PHE 28 HB3 PHE 28 -4.187 -5.837 -1.025
212 HD1 PHE 28 HD1 PHE 28 -7.829 -5.815 -1.563
213 HD2 PHE 28 HD2 PHE 28 -4.522 -7.943 0.167
214 HE1 PHE 28 HE1 PHE 28 -9.259 -7.824 -1.300
215 HE2 PHE 28 HE2 PHE 28 -5.954 -9.951 0.432
216 HZ PHE 28 HZ PHE 28 -8.321 -9.893 -0.303
217 H VAL 29 H VAL 29 -3.163 -4.549 1.716
218 HA VAL 29 HA VAL 29 -2.148 -2.122 0.363
219 HB VAL 29 HB VAL 29 -2.107 -2.689 3.339
220 HG11 VAL 29 HG11 VAL 29 -1.087 -0.252 1.855
221 HG12 VAL 29 HG12 VAL 29 -0.048 -1.536 2.472
222 HG13 VAL 29 HG13 VAL 29 -0.985 -0.548 3.591
223 HG21 VAL 29 HG21 VAL 29 -3.394 -0.331 1.976
224 HG22 VAL 29 HG22 VAL 29 -3.675 -0.947 3.602
225 HG23 VAL 29 HG23 VAL 29 -4.275 -1.839 2.205
226 H HIS 30 H HIS 30 -0.038 -2.250 -0.251
227 HA HIS 30 HA HIS 30 1.482 -4.645 0.576
228 HB2 HIS 30 HB2 HIS 30 1.639 -2.954 -1.923
229 HB3 HIS 30 HB3 HIS 30 2.797 -4.225 -1.524
230 HD2 HIS 30 HD2 HIS 30 -0.817 -3.888 -2.933
231 HE1 HIS 30 HE1 HIS 30 -0.040 -8.007 -2.438
232 HE2 HIS 30 HE2 HIS 30 -1.659 -6.312 -3.414
233 H HIS 31 H HIS 31 3.583 -4.475 1.233
234 HA HIS 31 HA HIS 31 4.330 -2.170 2.699
235 HB2 HIS 31 HB2 HIS 31 5.068 -4.491 3.227
236 HB3 HIS 31 HB3 HIS 31 6.109 -4.453 1.802
237 HD2 HIS 31 HD2 HIS 31 6.075 -3.080 5.461
238 HE1 HIS 31 HE1 HIS 31 9.598 -1.677 3.611
239 HE2 HIS 31 HE2 HIS 31 8.358 -1.870 5.818
240 H SER 32 H SER 32 5.554 -3.459 -0.385
241 HA SER 32 HA SER 32 7.574 -1.557 -0.810
242 HB2 SER 32 HB2 SER 32 7.555 -2.325 -3.125
243 HB3 SER 32 HB3 SER 32 7.413 -3.689 -2.020
244 HG SER 32 HG SER 32 5.304 -3.886 -2.524
245 H GLU 33 H GLU 33 4.144 -1.226 -1.233
246 HA GLU 33 HA GLU 33 4.206 0.819 -3.222
247 HB2 GLU 33 HB2 GLU 33 2.087 -0.073 -1.273
248 HB3 GLU 33 HB3 GLU 33 1.829 1.231 -2.430
249 HG2 GLU 33 HG2 GLU 33 2.386 -0.289 -4.288
250 HG3 GLU 33 HG3 GLU 33 2.667 -1.596 -3.142
251 H ILE 34 H ILE 34 5.000 0.968 0.112
252 HA ILE 34 HA ILE 34 3.985 3.462 0.852
253 HB ILE 34 HB ILE 34 5.774 3.587 2.514
254 HG12 ILE 34 HG12 ILE 34 6.974 1.125 1.200
255 HG13 ILE 34 HG13 ILE 34 7.587 2.745 0.923
256 HG21 ILE 34 HG21 ILE 34 3.977 2.159 3.131
257 HG22 ILE 34 HG22 ILE 34 5.436 1.235 3.487
258 HG23 ILE 34 HG23 ILE 34 4.506 0.885 2.031
259 HD11 ILE 34 HD11 ILE 34 8.840 1.534 2.715
260 HD12 ILE 34 HD12 ILE 34 7.349 1.458 3.657
261 HD13 ILE 34 HD13 ILE 34 8.084 3.020 3.292
262 H GLN 35 H GLN 35 4.542 5.545 0.537
263 HA GLN 35 HA GLN 35 6.022 6.248 -1.780
264 HB2 GLN 35 HB2 GLN 35 4.910 7.892 0.496
265 HB3 GLN 35 HB3 GLN 35 5.711 8.602 -0.908
266 HG2 GLN 35 HG2 GLN 35 3.343 6.724 -1.090
267 HG3 GLN 35 HG3 GLN 35 3.200 8.481 -1.111
268 HE21 GLN 35 HE21 GLN 35 3.337 5.868 -3.175
269 HE22 GLN 35 HE22 GLN 35 3.982 6.634 -4.545
270 H SER 36 H SER 36 6.788 6.374 1.683
271 HA SER 36 HA SER 36 9.194 7.822 1.495
272 HB2 SER 36 HB2 SER 36 8.305 5.740 3.500
273 HB3 SER 36 HB3 SER 36 9.736 6.748 3.691
274 HG SER 36 HG SER 36 7.987 7.722 4.714
275 H GLY 37 H GLY 37 8.581 4.323 1.409
276 HA2 GLY 37 HA2 GLY 37 9.855 2.560 0.657
277 HA3 GLY 37 HA3 GLY 37 10.669 3.731 -0.373
278 H GLY 38 H GLY 38 10.614 3.941 3.141
279 HA2 GLY 38 HA2 GLY 38 13.546 3.707 3.161
280 HA3 GLY 38 HA3 GLY 38 12.562 4.456 4.413
281 H GLU 39 H GLU 39 14.628 2.203 4.288
282 HA GLU 39 HA GLU 39 13.396 -0.241 4.993
283 HB2 GLU 39 HB2 GLU 39 16.137 0.892 5.575
284 HB3 GLU 39 HB3 GLU 39 15.655 -0.745 6.022
285 HG2 GLU 39 HG2 GLU 39 15.227 -1.323 3.714
286 HG3 GLU 39 HG3 GLU 39 15.463 0.344 3.202
287 H TYR 40 H TYR 40 14.437 2.549 6.890
288 HA TYR 40 HA TYR 40 14.184 1.471 9.471
289 HB2 TYR 40 HB2 TYR 40 13.751 4.304 8.508
290 HB3 TYR 40 HB3 TYR 40 13.893 3.831 10.199
291 HD1 TYR 40 HD1 TYR 40 15.684 4.285 7.025
292 HD2 TYR 40 HD2 TYR 40 16.026 2.998 11.110
293 HE1 TYR 40 HE1 TYR 40 18.155 4.362 6.843
294 HE2 TYR 40 HE2 TYR 40 18.498 3.077 10.927
295 HH TYR 40 HH TYR 40 20.094 4.524 8.228
296 H ALA 41 H ALA 41 11.796 2.978 7.332
297 HA ALA 41 HA ALA 41 9.683 3.225 9.162
298 HB1 ALA 41 HB1 ALA 41 9.639 4.263 6.942
299 HB2 ALA 41 HB2 ALA 41 8.221 3.242 7.175
300 HB3 ALA 41 HB3 ALA 41 9.567 2.671 6.188
301 H THR 42 H THR 42 8.393 1.817 10.110
302 HA THR 42 HA THR 42 8.165 -0.923 9.023
303 HB THR 42 HB THR 42 8.223 -1.811 11.328
304 HG1 THR 42 HG1 THR 42 8.971 -0.382 12.958
305 HG21 THR 42 HG21 THR 42 10.579 -0.279 10.248
306 HG22 THR 42 HG22 THR 42 10.303 -2.018 10.267
307 HG23 THR 42 HG23 THR 42 10.710 -1.174 11.760
308 H LEU 43 H LEU 43 6.288 -2.107 9.855
309 HA LEU 43 HA LEU 43 4.106 -0.471 10.913
310 HB2 LEU 43 HB2 LEU 43 3.843 -2.070 8.354
311 HB3 LEU 43 HB3 LEU 43 2.531 -1.261 9.200
312 HG LEU 43 HG LEU 43 4.192 0.859 8.937
313 HD11 LEU 43 HD11 LEU 43 5.873 -0.656 7.724
314 HD12 LEU 43 HD12 LEU 43 5.443 0.841 6.905
315 HD13 LEU 43 HD13 LEU 43 4.728 -0.685 6.387
316 HD21 LEU 43 HD21 LEU 43 2.951 1.418 6.825
317 HD22 LEU 43 HD22 LEU 43 1.903 0.850 8.124
318 HD23 LEU 43 HD23 LEU 43 2.334 -0.234 6.802
319 H ALA 44 H ALA 44 2.414 -1.730 11.845
320 HA ALA 44 HA ALA 44 2.843 -4.618 12.087
321 HB1 ALA 44 HB1 ALA 44 2.584 -2.909 14.568
322 HB2 ALA 44 HB2 ALA 44 4.154 -3.357 13.898
323 HB3 ALA 44 HB3 ALA 44 3.045 -4.608 14.459
324 H ASP 45 H ASP 45 0.960 -4.769 14.390
325 HA ASP 45 HA ASP 45 -1.500 -4.589 12.865
326 HB2 ASP 45 HB2 ASP 45 -1.001 -5.553 15.694
327 HB3 ASP 45 HB3 ASP 45 -2.463 -5.809 14.748
328 H GLY 46 H GLY 46 -2.546 -2.685 12.822
329 HA2 GLY 46 HA2 GLY 46 -4.000 -1.145 13.954
330 HA3 GLY 46 HA3 GLY 46 -2.955 -1.241 15.363
331 H GLN 47 H GLN 47 -0.947 -1.002 12.710
332 HA GLN 47 HA GLN 47 -0.006 1.574 13.326
333 HB2 GLN 47 HB2 GLN 47 1.298 -0.186 12.142
334 HB3 GLN 47 HB3 GLN 47 0.297 0.067 10.715
335 HG2 GLN 47 HG2 GLN 47 2.375 1.337 10.480
336 HG3 GLN 47 HG3 GLN 47 1.026 2.444 10.661
337 HE21 GLN 47 HE21 GLN 47 1.814 4.190 11.861
338 HE22 GLN 47 HE22 GLN 47 2.707 4.045 13.298
339 H THR 48 H THR 48 -0.591 3.560 12.697
340 HA THR 48 HA THR 48 -2.975 3.882 11.046
341 HB THR 48 HB THR 48 -1.265 5.962 12.453
342 HG1 THR 48 HG1 THR 48 -2.153 4.884 14.066
343 HG21 THR 48 HG21 THR 48 -3.294 7.376 12.217
344 HG22 THR 48 HG22 THR 48 -4.058 6.094 11.276
345 HG23 THR 48 HG23 THR 48 -2.629 6.916 10.650
346 H VAL 49 H VAL 49 -2.893 4.277 8.920
347 HA VAL 49 HA VAL 49 -0.480 5.555 7.799
348 HB VAL 49 HB VAL 49 -0.487 3.962 5.905
349 HG11 VAL 49 HG11 VAL 49 0.973 3.629 7.899
350 HG12 VAL 49 HG12 VAL 49 0.532 2.107 7.120
351 HG13 VAL 49 HG13 VAL 49 -0.276 2.603 8.608
352 HG21 VAL 49 HG21 VAL 49 -2.863 3.256 6.072
353 HG22 VAL 49 HG22 VAL 49 -2.503 2.438 7.592
354 HG23 VAL 49 HG23 VAL 49 -1.773 1.869 6.092
355 H GLU 50 H GLU 50 -0.769 6.318 5.593
356 HA GLU 50 HA GLU 50 -3.514 7.316 5.138
357 HB2 GLU 50 HB2 GLU 50 -1.665 9.000 5.598
358 HB3 GLU 50 HB3 GLU 50 -0.926 8.480 4.080
359 HG2 GLU 50 HG2 GLU 50 -3.016 9.057 2.884
360 HG3 GLU 50 HG3 GLU 50 -3.713 9.615 4.402
361 H TYR 51 H TYR 51 -4.500 6.736 3.239
362 HA TYR 51 HA TYR 51 -2.874 5.741 1.020
363 HB2 TYR 51 HB2 TYR 51 -4.136 3.639 0.846
364 HB3 TYR 51 HB3 TYR 51 -3.275 3.740 2.375
365 HD1 TYR 51 HD1 TYR 51 -6.575 3.841 0.748
366 HD2 TYR 51 HD2 TYR 51 -4.479 4.047 4.490
367 HE1 TYR 51 HE1 TYR 51 -8.716 3.537 1.963
368 HE2 TYR 51 HE2 TYR 51 -6.620 3.741 5.704
369 HH TYR 51 HH TYR 51 -9.380 2.616 4.310
370 H GLU 52 H GLU 52 -4.101 5.277 -0.912
371 HA GLU 52 HA GLU 52 -6.562 6.915 -1.134
372 HB2 GLU 52 HB2 GLU 52 -4.227 6.568 -3.018
373 HB3 GLU 52 HB3 GLU 52 -5.808 7.084 -3.607
374 HG2 GLU 52 HG2 GLU 52 -4.498 9.069 -3.133
375 HG3 GLU 52 HG3 GLU 52 -5.764 8.944 -1.919
376 H VAL 53 H VAL 53 -8.317 5.922 -1.949
377 HA VAL 53 HA VAL 53 -8.142 3.053 -2.480
378 HB VAL 53 HB VAL 53 -10.540 4.901 -2.224
379 HG11 VAL 53 HG11 VAL 53 -10.440 1.869 -2.191
380 HG12 VAL 53 HG12 VAL 53 -10.968 2.830 -3.574
381 HG13 VAL 53 HG13 VAL 53 -11.881 2.878 -2.065
382 HG21 VAL 53 HG21 VAL 53 -9.285 4.692 -0.128
383 HG22 VAL 53 HG22 VAL 53 -9.277 2.936 -0.289
384 HG23 VAL 53 HG23 VAL 53 -10.796 3.787 -0.012
385 H GLY 54 H GLY 54 -7.864 2.317 -4.468
386 HA2 GLY 54 HA2 GLY 54 -9.038 3.816 -6.744
387 HA3 GLY 54 HA3 GLY 54 -7.457 3.045 -6.835
388 H GLN 55 H GLN 55 -10.687 2.679 -7.533
389 HA GLN 55 HA GLN 55 -11.207 -0.030 -7.041
390 HB2 GLN 55 HB2 GLN 55 -12.248 1.857 -9.159
391 HB3 GLN 55 HB3 GLN 55 -12.873 0.222 -8.925
392 HG2 GLN 55 HG2 GLN 55 -13.546 0.731 -6.660
393 HG3 GLN 55 HG3 GLN 55 -12.744 2.298 -6.722
394 HE21 GLN 55 HE21 GLN 55 -15.666 1.672 -6.286
395 HE22 GLN 55 HE22 GLN 55 -16.486 2.527 -7.500
396 H GLY 56 H GLY 56 -11.130 -1.842 -8.364
397 HA2 GLY 56 HA2 GLY 56 -9.828 -1.830 -10.935
398 HA3 GLY 56 HA3 GLY 56 -8.821 -2.494 -9.652
399 H GLN 57 H GLN 57 -9.192 -4.308 -11.388
400 HA GLN 57 HA GLN 57 -11.617 -5.746 -11.474
401 HB2 GLN 57 HB2 GLN 57 -8.753 -6.583 -11.949
402 HB3 GLN 57 HB3 GLN 57 -10.134 -7.644 -12.236
403 HG2 GLN 57 HG2 GLN 57 -11.059 -6.118 -13.861
404 HG3 GLN 57 HG3 GLN 57 -9.857 -4.890 -13.465
405 HE21 GLN 57 HE21 GLN 57 -10.370 -6.274 -16.103
406 HE22 GLN 57 HE22 GLN 57 -8.886 -6.973 -16.531
407 H LYS 58 H LYS 58 -8.815 -5.971 -9.333
408 HA LYS 58 HA LYS 58 -9.939 -8.230 -7.873
409 HB2 LYS 58 HB2 LYS 58 -7.412 -6.615 -7.464
410 HB3 LYS 58 HB3 LYS 58 -7.873 -8.014 -6.495
411 HG2 LYS 58 HG2 LYS 58 -7.960 -9.380 -8.593
412 HG3 LYS 58 HG3 LYS 58 -7.361 -7.983 -9.486
413 HD2 LYS 58 HD2 LYS 58 -5.888 -9.175 -7.124
414 HD3 LYS 58 HD3 LYS 58 -5.587 -9.674 -8.787
415 HE2 LYS 58 HE2 LYS 58 -5.053 -7.313 -9.372
416 HE3 LYS 58 HE3 LYS 58 -5.282 -6.863 -7.682
417 HZ1 LYS 58 HZ1 LYS 58 -2.944 -7.267 -8.247
418 HZ2 LYS 58 HZ2 LYS 58 -3.323 -8.874 -8.651
419 HZ3 LYS 58 HZ3 LYS 58 -3.505 -8.332 -7.052
420 H GLY 59 H GLY 59 -11.099 -5.353 -7.909
421 HA2 GLY 59 HA2 GLY 59 -12.517 -4.336 -6.348
422 HA3 GLY 59 HA3 GLY 59 -11.758 -5.283 -5.071
423 HA PRO 60 HA PRO 60 -10.126 -0.736 -5.340
424 HB2 PRO 60 HB2 PRO 60 -11.227 -0.652 -2.568
425 HB3 PRO 60 HB3 PRO 60 -11.245 0.590 -3.832
426 HG2 PRO 60 HG2 PRO 60 -13.444 -0.733 -3.239
427 HG3 PRO 60 HG3 PRO 60 -13.038 -0.350 -4.923
428 HD2 PRO 60 HD2 PRO 60 -12.751 -2.971 -3.469
429 HD3 PRO 60 HD3 PRO 60 -13.311 -2.664 -5.130
430 H CYS 61 H CYS 61 -8.123 -0.297 -4.638
431 HA CYS 61 HA CYS 61 -6.963 -1.951 -2.473
432 HB2 CYS 61 HB2 CYS 61 -5.615 -1.000 -5.017
433 HB3 CYS 61 HB3 CYS 61 -4.833 -1.898 -3.716
434 HG CYS 61 HG CYS 61 -6.429 -3.928 -4.261
435 H ALA 62 H ALA 62 -4.865 -0.862 -1.634
436 HA ALA 62 HA ALA 62 -5.325 2.064 -1.481
437 HB1 ALA 62 HB1 ALA 62 -3.972 1.499 0.823
438 HB2 ALA 62 HB2 ALA 62 -4.942 0.038 0.630
439 HB3 ALA 62 HB3 ALA 62 -5.727 1.613 0.705
440 H ASN 63 H ASN 63 -3.720 3.219 -2.310
441 HA ASN 63 HA ASN 63 -1.000 2.034 -2.375
442 HB2 ASN 63 HB2 ASN 63 -0.658 3.282 -4.498
443 HB3 ASN 63 HB3 ASN 63 -1.919 2.057 -4.622
444 HD21 ASN 63 HD21 ASN 63 -3.420 2.972 -6.059
445 HD22 ASN 63 HD22 ASN 63 -4.099 4.517 -5.873
446 H LYS 64 H LYS 64 0.672 3.841 -2.843
447 HA LYS 64 HA LYS 64 1.818 5.631 -1.992
448 HB2 LYS 64 HB2 LYS 64 -0.947 6.861 -2.075
449 HB3 LYS 64 HB3 LYS 64 0.540 7.767 -1.803
450 HG2 LYS 64 HG2 LYS 64 1.402 6.912 -3.994
451 HG3 LYS 64 HG3 LYS 64 -0.157 6.138 -4.270
452 HD2 LYS 64 HD2 LYS 64 0.128 9.107 -3.742
453 HD3 LYS 64 HD3 LYS 64 0.143 8.420 -5.366
454 HE2 LYS 64 HE2 LYS 64 -2.090 7.403 -4.922
455 HE3 LYS 64 HE3 LYS 64 -2.106 8.182 -3.341
456 HZ1 LYS 64 HZ1 LYS 64 -1.863 9.613 -5.930
457 HZ2 LYS 64 HZ2 LYS 64 -1.998 10.322 -4.392
458 HZ3 LYS 64 HZ3 LYS 64 -3.302 9.454 -5.048
459 H VAL 65 H VAL 65 1.535 3.783 -0.168
460 HA VAL 65 HA VAL 65 0.127 4.561 2.192
461 HB VAL 65 HB VAL 65 2.362 2.542 1.821
462 HG11 VAL 65 HG11 VAL 65 2.040 3.237 4.190
463 HG12 VAL 65 HG12 VAL 65 1.566 1.560 3.922
464 HG13 VAL 65 HG13 VAL 65 0.333 2.816 4.063
465 HG21 VAL 65 HG21 VAL 65 -0.617 2.040 2.028
466 HG22 VAL 65 HG22 VAL 65 0.644 0.899 1.559
467 HG23 VAL 65 HG23 VAL 65 0.209 2.226 0.482
468 H VAL 66 H VAL 66 0.651 6.096 3.509
469 HA VAL 66 HA VAL 66 3.497 6.764 3.989
470 HB VAL 66 HB VAL 66 1.151 8.697 3.908
471 HG11 VAL 66 HG11 VAL 66 4.112 9.197 4.355
472 HG12 VAL 66 HG12 VAL 66 2.857 9.320 5.588
473 HG13 VAL 66 HG13 VAL 66 2.869 10.439 4.226
474 HG21 VAL 66 HG21 VAL 66 2.138 9.580 1.899
475 HG22 VAL 66 HG22 VAL 66 2.029 7.832 1.682
476 HG23 VAL 66 HG23 VAL 66 3.574 8.577 2.093
477 H ALA 67 H ALA 67 4.083 6.478 6.055
478 HA ALA 67 HA ALA 67 2.340 5.494 8.025
479 HB1 ALA 67 HB1 ALA 67 5.094 6.717 8.181
480 HB2 ALA 67 HB2 ALA 67 4.654 5.011 8.267
481 HB3 ALA 67 HB3 ALA 67 4.259 6.092 9.602
482 H VAL 68 H VAL 68 0.877 6.469 9.231
483 HA VAL 68 HA VAL 68 -0.346 8.084 10.314
484 HB VAL 68 HB VAL 68 2.321 9.522 10.561
485 HG11 VAL 68 HG11 VAL 68 0.508 10.999 11.148
486 HG12 VAL 68 HG12 VAL 68 1.204 10.414 12.658
487 HG13 VAL 68 HG13 VAL 68 -0.307 9.729 12.062
488 HG21 VAL 68 HG21 VAL 68 2.369 8.409 12.824
489 HG22 VAL 68 HG22 VAL 68 2.543 7.283 11.479
490 HG23 VAL 68 HG23 VAL 68 0.997 7.426 12.314
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 -5.689 9.628 0.413
2 H2 MET 1 HT2 MET 1 -4.236 10.071 1.175
3 H3 MET 1 HT3 MET 1 -4.644 10.733 -0.336
4 HA MET 1 HA MET 1 -4.998 12.279 1.545
5 HB2 MET 1 HB2 MET 1 -6.267 12.357 -0.645
6 HB3 MET 1 HB3 MET 1 -7.553 11.449 0.145
7 HG2 MET 1 HG2 MET 1 -8.099 13.812 0.267
8 HG3 MET 1 HG3 MET 1 -7.681 13.252 1.886
9 HE1 MET 1 HE1 MET 1 -5.296 15.950 -0.934
10 HE2 MET 1 HE2 MET 1 -6.927 15.312 -1.132
11 HE3 MET 1 HE3 MET 1 -5.540 14.242 -1.328
12 H SER 2 H SER 2 -7.139 9.444 1.471
13 HA SER 2 HA SER 2 -8.421 10.014 3.965
14 HB2 SER 2 HB2 SER 2 -9.415 7.830 3.740
15 HB3 SER 2 HB3 SER 2 -9.383 8.575 2.144
16 HG SER 2 HG SER 2 -8.133 6.338 3.062
17 H LYS 3 H LYS 3 -8.293 8.580 5.862
18 HA LYS 3 HA LYS 3 -5.654 7.341 6.277
19 HB2 LYS 3 HB2 LYS 3 -5.588 9.675 7.156
20 HB3 LYS 3 HB3 LYS 3 -6.926 9.279 8.231
21 HG2 LYS 3 HG2 LYS 3 -5.524 7.454 9.221
22 HG3 LYS 3 HG3 LYS 3 -4.179 7.987 8.213
23 HD2 LYS 3 HD2 LYS 3 -5.615 9.845 10.124
24 HD3 LYS 3 HD3 LYS 3 -4.215 8.894 10.607
25 HE2 LYS 3 HE2 LYS 3 -4.196 10.786 8.239
26 HE3 LYS 3 HE3 LYS 3 -3.690 11.259 9.858
27 HZ1 LYS 3 HZ1 LYS 3 -1.920 10.436 8.239
28 HZ2 LYS 3 HZ2 LYS 3 -2.538 8.884 8.534
29 HZ3 LYS 3 HZ3 LYS 3 -1.903 9.803 9.812
30 H GLY 4 H GLY 4 -5.886 5.373 7.076
31 HA2 GLY 4 HA2 GLY 4 -8.232 4.756 8.778
32 HA3 GLY 4 HA3 GLY 4 -7.729 3.679 7.476
33 H ILE 5 H ILE 5 -7.787 2.340 9.654
34 HA ILE 5 HA ILE 5 -5.051 2.404 10.800
35 HB ILE 5 HB ILE 5 -6.074 1.154 12.750
36 HG12 ILE 5 HG12 ILE 5 -8.716 2.216 11.714
37 HG13 ILE 5 HG13 ILE 5 -8.194 0.570 11.376
38 HG21 ILE 5 HG21 ILE 5 -5.532 3.560 12.830
39 HG22 ILE 5 HG22 ILE 5 -6.984 3.209 13.766
40 HG23 ILE 5 HG23 ILE 5 -7.120 3.942 12.168
41 HD11 ILE 5 HD11 ILE 5 -7.909 0.228 13.859
42 HD12 ILE 5 HD12 ILE 5 -9.576 0.523 13.367
43 HD13 ILE 5 HD13 ILE 5 -8.632 1.819 14.103
44 H VAL 6 H VAL 6 -3.794 0.741 10.469
45 HA VAL 6 HA VAL 6 -4.541 -1.333 8.701
46 HB VAL 6 HB VAL 6 -2.096 -1.102 10.478
47 HG11 VAL 6 HG11 VAL 6 -2.802 -2.943 8.183
48 HG12 VAL 6 HG12 VAL 6 -2.181 -3.371 9.776
49 HG13 VAL 6 HG13 VAL 6 -1.124 -2.594 8.600
50 HG21 VAL 6 HG21 VAL 6 -2.341 -0.475 7.524
51 HG22 VAL 6 HG22 VAL 6 -1.019 -0.062 8.615
52 HG23 VAL 6 HG23 VAL 6 -2.576 0.752 8.768
53 H LYS 7 H LYS 7 -5.599 -3.125 9.091
54 HA LYS 7 HA LYS 7 -6.415 -3.955 11.690
55 HB2 LYS 7 HB2 LYS 7 -7.684 -4.448 9.586
56 HB3 LYS 7 HB3 LYS 7 -6.405 -5.570 9.121
57 HG2 LYS 7 HG2 LYS 7 -6.833 -6.949 11.086
58 HG3 LYS 7 HG3 LYS 7 -8.011 -5.786 11.688
59 HD2 LYS 7 HD2 LYS 7 -9.283 -7.529 10.655
60 HD3 LYS 7 HD3 LYS 7 -9.314 -6.176 9.526
61 HE2 LYS 7 HE2 LYS 7 -7.513 -7.195 8.214
62 HE3 LYS 7 HE3 LYS 7 -7.396 -8.524 9.365
63 HZ1 LYS 7 HZ1 LYS 7 -8.732 -9.062 7.383
64 HZ2 LYS 7 HZ2 LYS 7 -9.838 -7.847 7.817
65 HZ3 LYS 7 HZ3 LYS 7 -9.614 -9.197 8.825
66 H TRP 8 H TRP 8 -4.006 -5.145 9.371
67 HA TRP 8 HA TRP 8 -2.277 -6.094 11.474
68 HB2 TRP 8 HB2 TRP 8 -4.110 -7.900 11.067
69 HB3 TRP 8 HB3 TRP 8 -3.268 -8.196 9.550
70 HD1 TRP 8 HD1 TRP 8 -0.857 -9.277 9.658
71 HE1 TRP 8 HE1 TRP 8 0.405 -10.515 11.535
72 HE3 TRP 8 HE3 TRP 8 -3.758 -8.004 13.663
73 HZ2 TRP 8 HZ2 TRP 8 0.205 -10.919 14.360
74 HZ3 TRP 8 HZ3 TRP 8 -3.204 -8.833 15.932
75 HH2 TRP 8 HH2 TRP 8 -1.228 -10.288 16.285
76 H PHE 9 H PHE 9 -0.252 -5.709 10.762
77 HA PHE 9 HA PHE 9 0.204 -5.617 7.825
78 HB2 PHE 9 HB2 PHE 9 0.646 -3.519 9.186
79 HB3 PHE 9 HB3 PHE 9 1.966 -4.399 9.957
80 HD1 PHE 9 HD1 PHE 9 0.781 -2.826 6.866
81 HD2 PHE 9 HD2 PHE 9 3.931 -5.134 8.656
82 HE1 PHE 9 HE1 PHE 9 2.242 -2.339 4.923
83 HE2 PHE 9 HE2 PHE 9 5.391 -4.643 6.712
84 HZ PHE 9 HZ PHE 9 4.548 -3.247 4.847
85 H ASN 10 H ASN 10 1.343 -7.255 6.961
86 HA ASN 10 HA ASN 10 3.285 -8.678 8.693
87 HB2 ASN 10 HB2 ASN 10 1.322 -9.819 6.703
88 HB3 ASN 10 HB3 ASN 10 2.705 -10.725 7.308
89 HD21 ASN 10 HD21 ASN 10 -0.089 -11.438 7.798
90 HD22 ASN 10 HD22 ASN 10 -0.340 -11.341 9.474
91 H SER 11 H SER 11 5.088 -7.570 7.927
92 HA SER 11 HA SER 11 5.664 -7.053 5.221
93 HB2 SER 11 HB2 SER 11 7.946 -6.647 6.000
94 HB3 SER 11 HB3 SER 11 6.785 -5.927 7.110
95 HG SER 11 HG SER 11 8.386 -7.112 8.221
96 H ASP 12 H ASP 12 6.247 -9.881 7.256
97 HA ASP 12 HA ASP 12 8.136 -11.215 5.645
98 HB2 ASP 12 HB2 ASP 12 5.971 -12.275 7.480
99 HB3 ASP 12 HB3 ASP 12 7.157 -13.312 6.694
100 H LYS 13 H LYS 13 4.596 -11.205 5.606
101 HA LYS 13 HA LYS 13 4.363 -12.964 3.341
102 HB2 LYS 13 HB2 LYS 13 2.405 -11.102 4.706
103 HB3 LYS 13 HB3 LYS 13 1.978 -12.160 3.363
104 HG2 LYS 13 HG2 LYS 13 2.709 -14.123 4.667
105 HG3 LYS 13 HG3 LYS 13 3.129 -13.066 6.016
106 HD2 LYS 13 HD2 LYS 13 0.792 -12.336 6.201
107 HD3 LYS 13 HD3 LYS 13 0.356 -13.340 4.815
108 HE2 LYS 13 HE2 LYS 13 -0.207 -14.516 6.887
109 HE3 LYS 13 HE3 LYS 13 1.115 -15.353 6.074
110 HZ1 LYS 13 HZ1 LYS 13 2.622 -14.686 7.627
111 HZ2 LYS 13 HZ2 LYS 13 1.239 -14.781 8.608
112 HZ3 LYS 13 HZ3 LYS 13 1.773 -13.274 8.032
113 H GLY 14 H GLY 14 4.767 -9.553 3.869
114 HA2 GLY 14 HA2 GLY 14 5.568 -8.005 2.280
115 HA3 GLY 14 HA3 GLY 14 5.051 -9.086 0.995
116 H PHE 15 H PHE 15 2.582 -8.761 3.297
117 HA PHE 15 HA PHE 15 1.457 -6.305 2.268
118 HB2 PHE 15 HB2 PHE 15 -0.580 -7.335 1.334
119 HB3 PHE 15 HB3 PHE 15 0.865 -7.790 0.435
120 HD1 PHE 15 HD1 PHE 15 -1.714 -8.952 2.814
121 HD2 PHE 15 HD2 PHE 15 1.694 -10.069 0.448
122 HE1 PHE 15 HE1 PHE 15 -2.251 -11.347 3.171
123 HE2 PHE 15 HE2 PHE 15 1.160 -12.463 0.810
124 HZ PHE 15 HZ PHE 15 -0.812 -13.103 2.170
125 H GLY 16 H GLY 16 -0.870 -6.060 3.073
126 HA2 GLY 16 HA2 GLY 16 -1.524 -7.453 5.525
127 HA3 GLY 16 HA3 GLY 16 -1.007 -5.783 5.755
128 H PHE 17 H PHE 17 -3.468 -6.314 6.575
129 HA PHE 17 HA PHE 17 -5.274 -5.316 4.449
130 HB2 PHE 17 HB2 PHE 17 -5.895 -6.972 6.910
131 HB3 PHE 17 HB3 PHE 17 -7.107 -6.303 5.822
132 HD1 PHE 17 HD1 PHE 17 -4.450 -8.813 6.221
133 HD2 PHE 17 HD2 PHE 17 -7.380 -7.170 3.547
134 HE1 PHE 17 HE1 PHE 17 -4.189 -10.776 4.731
135 HE2 PHE 17 HE2 PHE 17 -7.120 -9.133 2.056
136 HZ PHE 17 HZ PHE 17 -5.524 -10.937 2.645
137 H ILE 18 H ILE 18 -6.338 -3.414 4.826
138 HA ILE 18 HA ILE 18 -5.880 -2.154 7.451
139 HB ILE 18 HB ILE 18 -4.687 -1.032 5.621
140 HG12 ILE 18 HG12 ILE 18 -7.020 0.719 6.423
141 HG13 ILE 18 HG13 ILE 18 -5.784 0.227 7.583
142 HG21 ILE 18 HG21 ILE 18 -7.466 -0.810 4.438
143 HG22 ILE 18 HG22 ILE 18 -6.043 -1.560 3.713
144 HG23 ILE 18 HG23 ILE 18 -6.115 0.192 3.906
145 HD11 ILE 18 HD11 ILE 18 -5.280 2.439 6.548
146 HD12 ILE 18 HD12 ILE 18 -5.226 1.659 4.967
147 HD13 ILE 18 HD13 ILE 18 -4.040 1.236 6.199
148 H THR 19 H THR 19 -7.489 -1.179 8.525
149 HA THR 19 HA THR 19 -10.204 -1.838 7.665
150 HB THR 19 HB THR 19 -9.180 -0.905 10.350
151 HG1 THR 19 HG1 THR 19 -9.067 -2.994 10.860
152 HG21 THR 19 HG21 THR 19 -11.373 -1.780 11.158
153 HG22 THR 19 HG22 THR 19 -11.847 -2.063 9.483
154 HG23 THR 19 HG23 THR 19 -11.559 -0.418 10.052
155 HA PRO 20 HA PRO 20 -10.380 2.614 6.448
156 HB2 PRO 20 HB2 PRO 20 -13.224 1.788 6.003
157 HB3 PRO 20 HB3 PRO 20 -12.146 2.713 4.940
158 HG2 PRO 20 HG2 PRO 20 -12.678 0.203 4.392
159 HG3 PRO 20 HG3 PRO 20 -11.023 0.818 4.219
160 HD2 PRO 20 HD2 PRO 20 -12.178 -0.880 6.413
161 HD3 PRO 20 HD3 PRO 20 -10.584 -0.982 5.631
162 H GLU 21 H GLU 21 -10.764 4.280 7.834
163 HA GLU 21 HA GLU 21 -11.940 3.906 10.375
164 HB2 GLU 21 HB2 GLU 21 -11.710 6.340 10.636
165 HB3 GLU 21 HB3 GLU 21 -10.251 5.640 9.940
166 HG2 GLU 21 HG2 GLU 21 -10.957 6.335 7.694
167 HG3 GLU 21 HG3 GLU 21 -12.466 6.970 8.344
168 H ASP 22 H ASP 22 -13.265 4.977 7.317
169 HA ASP 22 HA ASP 22 -15.686 6.106 8.306
170 HB2 ASP 22 HB2 ASP 22 -14.890 5.016 5.605
171 HB3 ASP 22 HB3 ASP 22 -16.462 5.737 5.918
172 H GLY 23 H GLY 23 -14.636 2.845 7.893
173 HA2 GLY 23 HA2 GLY 23 -15.855 1.045 8.940
174 HA3 GLY 23 HA3 GLY 23 -17.349 1.878 8.538
175 H SER 24 H SER 24 -15.169 2.043 5.957
176 HA SER 24 HA SER 24 -16.765 0.365 4.285
177 HB2 SER 24 HB2 SER 24 -14.093 1.698 3.808
178 HB3 SER 24 HB3 SER 24 -15.040 0.881 2.572
179 HG SER 24 HG SER 24 -15.258 3.362 3.342
180 H LYS 25 H LYS 25 -15.678 -1.318 2.884
181 HA LYS 25 HA LYS 25 -14.774 -3.455 4.504
182 HB2 LYS 25 HB2 LYS 25 -14.691 -3.145 1.489
183 HB3 LYS 25 HB3 LYS 25 -14.451 -4.655 2.363
184 HG2 LYS 25 HG2 LYS 25 -16.963 -2.980 2.621
185 HG3 LYS 25 HG3 LYS 25 -16.800 -4.291 1.456
186 HD2 LYS 25 HD2 LYS 25 -16.323 -5.865 3.319
187 HD3 LYS 25 HD3 LYS 25 -16.550 -4.549 4.472
188 HE2 LYS 25 HE2 LYS 25 -18.616 -5.837 4.303
189 HE3 LYS 25 HE3 LYS 25 -18.867 -4.237 3.608
190 HZ1 LYS 25 HZ1 LYS 25 -17.971 -6.404 1.851
191 HZ2 LYS 25 HZ2 LYS 25 -18.942 -5.056 1.498
192 HZ3 LYS 25 HZ3 LYS 25 -19.598 -6.381 2.335
193 H ASP 26 H ASP 26 -12.770 -4.522 4.557
194 HA ASP 26 HA ASP 26 -10.514 -2.903 4.790
195 HB2 ASP 26 HB2 ASP 26 -10.809 -5.893 4.491
196 HB3 ASP 26 HB3 ASP 26 -9.261 -5.113 4.797
197 H LEU 27 H LEU 27 -8.723 -2.554 3.540
198 HA LEU 27 HA LEU 27 -8.969 -3.258 0.673
199 HB2 LEU 27 HB2 LEU 27 -7.678 -0.823 1.932
200 HB3 LEU 27 HB3 LEU 27 -7.734 -1.174 0.207
201 HG LEU 27 HG LEU 27 -10.212 -0.872 1.936
202 HD11 LEU 27 HD11 LEU 27 -8.765 1.122 0.172
203 HD12 LEU 27 HD12 LEU 27 -9.067 1.259 1.904
204 HD13 LEU 27 HD13 LEU 27 -10.410 1.350 0.766
205 HD21 LEU 27 HD21 LEU 27 -11.276 -0.528 -0.331
206 HD22 LEU 27 HD22 LEU 27 -10.636 -2.153 -0.084
207 HD23 LEU 27 HD23 LEU 27 -9.739 -0.991 -1.062
208 H PHE 28 H PHE 28 -7.075 -3.768 -0.476
209 HA PHE 28 HA PHE 28 -5.070 -5.154 1.088
210 HB2 PHE 28 HB2 PHE 28 -5.482 -4.779 -1.883
211 HB3 PHE 28 HB3 PHE 28 -4.139 -5.699 -1.200
212 HD1 PHE 28 HD1 PHE 28 -7.809 -5.550 -1.616
213 HD2 PHE 28 HD2 PHE 28 -4.495 -7.849 -0.139
214 HE1 PHE 28 HE1 PHE 28 -9.285 -7.529 -1.385
215 HE2 PHE 28 HE2 PHE 28 -5.971 -9.828 0.093
216 HZ PHE 28 HZ PHE 28 -8.367 -9.669 -0.531
217 H VAL 29 H VAL 29 -3.110 -4.446 1.629
218 HA VAL 29 HA VAL 29 -1.970 -2.107 0.234
219 HB VAL 29 HB VAL 29 -2.082 -2.526 3.235
220 HG11 VAL 29 HG11 VAL 29 -1.010 -0.219 3.261
221 HG12 VAL 29 HG12 VAL 29 -0.689 -0.437 1.541
222 HG13 VAL 29 HG13 VAL 29 0.046 -1.523 2.720
223 HG21 VAL 29 HG21 VAL 29 -3.526 -0.633 3.304
224 HG22 VAL 29 HG22 VAL 29 -4.152 -1.649 2.006
225 HG23 VAL 29 HG23 VAL 29 -3.187 -0.226 1.623
226 H HIS 30 H HIS 30 0.152 -2.334 -0.283
227 HA HIS 30 HA HIS 30 1.528 -4.771 0.670
228 HB2 HIS 30 HB2 HIS 30 1.922 -3.162 -1.864
229 HB3 HIS 30 HB3 HIS 30 2.909 -4.544 -1.391
230 HD2 HIS 30 HD2 HIS 30 -0.346 -3.878 -3.281
231 HE1 HIS 30 HE1 HIS 30 -0.447 -7.961 -2.211
232 HE2 HIS 30 HE2 HIS 30 -1.546 -6.169 -3.636
233 H HIS 31 H HIS 31 3.711 -4.687 1.228
234 HA HIS 31 HA HIS 31 4.545 -2.434 2.731
235 HB2 HIS 31 HB2 HIS 31 5.288 -4.808 3.111
236 HB3 HIS 31 HB3 HIS 31 6.293 -4.670 1.669
237 HD2 HIS 31 HD2 HIS 31 6.362 -3.598 5.408
238 HE1 HIS 31 HE1 HIS 31 9.759 -1.909 3.561
239 HE2 HIS 31 HE2 HIS 31 8.616 -2.339 5.787
240 H SER 32 H SER 32 5.510 -3.671 -0.437
241 HA SER 32 HA SER 32 7.442 -1.643 -0.980
242 HB2 SER 32 HB2 SER 32 7.494 -2.578 -3.223
243 HB3 SER 32 HB3 SER 32 7.468 -3.878 -2.034
244 HG SER 32 HG SER 32 5.213 -4.034 -2.387
245 H GLU 33 H GLU 33 4.083 -1.429 -0.904
246 HA GLU 33 HA GLU 33 3.551 0.152 -3.199
247 HB2 GLU 33 HB2 GLU 33 1.888 -1.081 -1.697
248 HB3 GLU 33 HB3 GLU 33 2.026 0.291 -0.603
249 HG2 GLU 33 HG2 GLU 33 0.119 0.636 -2.072
250 HG3 GLU 33 HG3 GLU 33 1.373 1.805 -2.474
251 H ILE 34 H ILE 34 4.859 0.957 -0.038
252 HA ILE 34 HA ILE 34 4.311 3.766 -0.178
253 HB ILE 34 HB ILE 34 4.732 2.620 1.964
254 HG12 ILE 34 HG12 ILE 34 6.966 4.610 1.505
255 HG13 ILE 34 HG13 ILE 34 5.276 5.106 1.535
256 HG21 ILE 34 HG21 ILE 34 7.663 2.479 1.237
257 HG22 ILE 34 HG22 ILE 34 6.577 1.133 0.898
258 HG23 ILE 34 HG23 ILE 34 6.812 1.676 2.558
259 HD11 ILE 34 HD11 ILE 34 6.872 3.823 3.763
260 HD12 ILE 34 HD12 ILE 34 5.110 3.925 3.796
261 HD13 ILE 34 HD13 ILE 34 6.080 5.399 3.769
262 H GLN 35 H GLN 35 5.298 5.276 -1.322
263 HA GLN 35 HA GLN 35 7.286 4.702 -3.240
264 HB2 GLN 35 HB2 GLN 35 6.234 7.310 -2.145
265 HB3 GLN 35 HB3 GLN 35 7.392 7.216 -3.471
266 HG2 GLN 35 HG2 GLN 35 5.841 5.947 -4.824
267 HG3 GLN 35 HG3 GLN 35 4.716 5.795 -3.477
268 HE21 GLN 35 HE21 GLN 35 4.285 7.100 -6.162
269 HE22 GLN 35 HE22 GLN 35 3.824 8.695 -5.811
270 H SER 36 H SER 36 7.491 6.210 -0.027
271 HA SER 36 HA SER 36 10.154 7.099 -0.178
272 HB2 SER 36 HB2 SER 36 8.529 6.181 2.200
273 HB3 SER 36 HB3 SER 36 10.096 6.976 2.322
274 HG SER 36 HG SER 36 9.139 8.707 1.078
275 H GLY 37 H GLY 37 8.825 4.003 0.971
276 HA2 GLY 37 HA2 GLY 37 9.796 1.941 1.289
277 HA3 GLY 37 HA3 GLY 37 10.950 2.425 0.052
278 H GLY 38 H GLY 38 10.529 4.139 3.107
279 HA2 GLY 38 HA2 GLY 38 13.287 4.157 3.706
280 HA3 GLY 38 HA3 GLY 38 11.997 4.582 4.825
281 H GLU 39 H GLU 39 14.572 2.816 4.816
282 HA GLU 39 HA GLU 39 13.790 0.154 5.390
283 HB2 GLU 39 HB2 GLU 39 16.108 0.825 4.814
284 HB3 GLU 39 HB3 GLU 39 16.232 1.673 6.353
285 HG2 GLU 39 HG2 GLU 39 17.267 -0.531 6.557
286 HG3 GLU 39 HG3 GLU 39 15.811 -0.474 7.542
287 H TYR 40 H TYR 40 14.308 3.009 7.427
288 HA TYR 40 HA TYR 40 13.951 1.754 9.940
289 HB2 TYR 40 HB2 TYR 40 13.479 4.616 9.086
290 HB3 TYR 40 HB3 TYR 40 13.477 4.061 10.758
291 HD1 TYR 40 HD1 TYR 40 15.547 4.736 7.798
292 HD2 TYR 40 HD2 TYR 40 15.541 3.271 11.835
293 HE1 TYR 40 HE1 TYR 40 18.018 4.915 7.864
294 HE2 TYR 40 HE2 TYR 40 18.015 3.449 11.902
295 HH TYR 40 HH TYR 40 19.893 3.511 10.366
296 H ALA 41 H ALA 41 11.691 3.277 7.683
297 HA ALA 41 HA ALA 41 9.415 3.363 9.297
298 HB1 ALA 41 HB1 ALA 41 9.503 2.791 6.326
299 HB2 ALA 41 HB2 ALA 41 9.616 4.400 7.040
300 HB3 ALA 41 HB3 ALA 41 8.142 3.451 7.232
301 H THR 42 H THR 42 8.105 1.889 10.096
302 HA THR 42 HA THR 42 8.003 -0.800 8.912
303 HB THR 42 HB THR 42 9.634 -0.934 10.738
304 HG1 THR 42 HG1 THR 42 8.671 -2.792 10.803
305 HG21 THR 42 HG21 THR 42 7.394 -0.082 12.590
306 HG22 THR 42 HG22 THR 42 8.672 1.006 12.047
307 HG23 THR 42 HG23 THR 42 9.073 -0.408 13.020
308 H LEU 43 H LEU 43 6.138 -2.062 9.643
309 HA LEU 43 HA LEU 43 3.936 -0.474 10.766
310 HB2 LEU 43 HB2 LEU 43 3.873 -1.959 8.136
311 HB3 LEU 43 HB3 LEU 43 2.418 -1.522 9.019
312 HG LEU 43 HG LEU 43 3.612 0.901 9.015
313 HD11 LEU 43 HD11 LEU 43 5.567 -0.214 7.698
314 HD12 LEU 43 HD12 LEU 43 4.962 1.344 7.143
315 HD13 LEU 43 HD13 LEU 43 4.478 -0.137 6.315
316 HD21 LEU 43 HD21 LEU 43 2.356 1.355 6.841
317 HD22 LEU 43 HD22 LEU 43 1.404 0.606 8.123
318 HD23 LEU 43 HD23 LEU 43 2.003 -0.373 6.785
319 H ALA 44 H ALA 44 2.293 -1.734 11.735
320 HA ALA 44 HA ALA 44 2.704 -4.625 11.961
321 HB1 ALA 44 HB1 ALA 44 3.058 -4.656 14.270
322 HB2 ALA 44 HB2 ALA 44 2.378 -3.045 14.497
323 HB3 ALA 44 HB3 ALA 44 3.982 -3.234 13.788
324 H ASP 45 H ASP 45 0.835 -4.843 14.229
325 HA ASP 45 HA ASP 45 -1.632 -4.543 12.731
326 HB2 ASP 45 HB2 ASP 45 -2.628 -5.804 14.608
327 HB3 ASP 45 HB3 ASP 45 -1.228 -6.625 13.932
328 H GLY 46 H GLY 46 -2.691 -2.678 12.785
329 HA2 GLY 46 HA2 GLY 46 -4.117 -1.155 13.968
330 HA3 GLY 46 HA3 GLY 46 -3.068 -1.307 15.369
331 H GLN 47 H GLN 47 -1.086 -1.009 12.703
332 HA GLN 47 HA GLN 47 -0.107 1.539 13.392
333 HB2 GLN 47 HB2 GLN 47 1.156 -0.253 12.199
334 HB3 GLN 47 HB3 GLN 47 0.197 0.073 10.759
335 HG2 GLN 47 HG2 GLN 47 2.341 1.248 10.629
336 HG3 GLN 47 HG3 GLN 47 1.027 2.405 10.755
337 HE21 GLN 47 HE21 GLN 47 1.677 4.099 12.093
338 HE22 GLN 47 HE22 GLN 47 2.571 3.917 13.525
339 H THR 48 H THR 48 -0.660 3.546 12.795
340 HA THR 48 HA THR 48 -3.030 3.934 11.143
341 HB THR 48 HB THR 48 -1.309 5.958 12.612
342 HG1 THR 48 HG1 THR 48 -2.373 5.358 14.302
343 HG21 THR 48 HG21 THR 48 -2.667 6.966 10.822
344 HG22 THR 48 HG22 THR 48 -3.310 7.405 12.404
345 HG23 THR 48 HG23 THR 48 -4.104 6.156 11.445
346 H VAL 49 H VAL 49 -3.001 4.489 9.058
347 HA VAL 49 HA VAL 49 -0.619 5.798 7.936
348 HB VAL 49 HB VAL 49 -0.573 4.240 6.013
349 HG11 VAL 49 HG11 VAL 49 -0.323 2.722 8.618
350 HG12 VAL 49 HG12 VAL 49 0.832 3.959 8.120
351 HG13 VAL 49 HG13 VAL 49 0.619 2.507 7.142
352 HG21 VAL 49 HG21 VAL 49 -1.751 2.034 6.300
353 HG22 VAL 49 HG22 VAL 49 -2.851 3.390 6.055
354 HG23 VAL 49 HG23 VAL 49 -2.616 2.725 7.671
355 H GLU 50 H GLU 50 -0.961 6.409 5.617
356 HA GLU 50 HA GLU 50 -3.740 7.340 5.185
357 HB2 GLU 50 HB2 GLU 50 -1.140 8.644 4.314
358 HB3 GLU 50 HB3 GLU 50 -2.758 9.231 3.924
359 HG2 GLU 50 HG2 GLU 50 -3.236 9.493 6.339
360 HG3 GLU 50 HG3 GLU 50 -1.608 8.933 6.716
361 H TYR 51 H TYR 51 -4.623 6.967 3.153
362 HA TYR 51 HA TYR 51 -2.961 5.938 1.004
363 HB2 TYR 51 HB2 TYR 51 -4.184 3.807 0.802
364 HB3 TYR 51 HB3 TYR 51 -3.314 3.914 2.326
365 HD1 TYR 51 HD1 TYR 51 -6.633 3.950 0.728
366 HD2 TYR 51 HD2 TYR 51 -4.506 4.183 4.451
367 HE1 TYR 51 HE1 TYR 51 -8.754 3.590 1.961
368 HE2 TYR 51 HE2 TYR 51 -6.627 3.822 5.684
369 HH TYR 51 HH TYR 51 -9.341 2.612 4.357
370 H GLU 52 H GLU 52 -4.184 5.421 -0.945
371 HA GLU 52 HA GLU 52 -6.654 7.040 -1.188
372 HB2 GLU 52 HB2 GLU 52 -4.634 7.962 -2.397
373 HB3 GLU 52 HB3 GLU 52 -4.628 6.494 -3.373
374 HG2 GLU 52 HG2 GLU 52 -6.931 6.978 -4.122
375 HG3 GLU 52 HG3 GLU 52 -6.937 8.447 -3.151
376 H VAL 53 H VAL 53 -8.410 5.968 -1.895
377 HA VAL 53 HA VAL 53 -8.171 3.113 -2.461
378 HB VAL 53 HB VAL 53 -10.630 4.876 -2.183
379 HG11 VAL 53 HG11 VAL 53 -11.846 2.743 -1.909
380 HG12 VAL 53 HG12 VAL 53 -10.352 1.851 -2.200
381 HG13 VAL 53 HG13 VAL 53 -11.065 2.822 -3.488
382 HG21 VAL 53 HG21 VAL 53 -9.070 3.167 -0.237
383 HG22 VAL 53 HG22 VAL 53 -10.768 3.556 0.043
384 HG23 VAL 53 HG23 VAL 53 -9.570 4.847 -0.060
385 H GLY 54 H GLY 54 -7.956 2.365 -4.450
386 HA2 GLY 54 HA2 GLY 54 -9.142 3.886 -6.705
387 HA3 GLY 54 HA3 GLY 54 -7.582 3.076 -6.820
388 H GLN 55 H GLN 55 -10.867 2.788 -7.385
389 HA GLN 55 HA GLN 55 -11.448 0.099 -6.921
390 HB2 GLN 55 HB2 GLN 55 -13.105 1.852 -7.575
391 HB3 GLN 55 HB3 GLN 55 -12.454 1.807 -9.215
392 HG2 GLN 55 HG2 GLN 55 -13.026 -0.597 -9.368
393 HG3 GLN 55 HG3 GLN 55 -13.698 -0.538 -7.739
394 HE21 GLN 55 HE21 GLN 55 -15.936 -0.385 -7.807
395 HE22 GLN 55 HE22 GLN 55 -16.820 0.482 -8.967
396 H GLY 56 H GLY 56 -11.127 -1.757 -8.028
397 HA2 GLY 56 HA2 GLY 56 -9.880 -1.754 -10.667
398 HA3 GLY 56 HA3 GLY 56 -8.930 -2.448 -9.355
399 H GLN 57 H GLN 57 -9.384 -4.175 -11.240
400 HA GLN 57 HA GLN 57 -11.838 -5.565 -11.283
401 HB2 GLN 57 HB2 GLN 57 -9.014 -6.420 -11.936
402 HB3 GLN 57 HB3 GLN 57 -10.427 -7.444 -12.212
403 HG2 GLN 57 HG2 GLN 57 -11.399 -5.820 -13.710
404 HG3 GLN 57 HG3 GLN 57 -10.163 -4.632 -13.305
405 HE21 GLN 57 HE21 GLN 57 -10.817 -5.862 -15.988
406 HE22 GLN 57 HE22 GLN 57 -9.364 -6.558 -16.522
407 H LYS 58 H LYS 58 -8.942 -5.949 -9.294
408 HA LYS 58 HA LYS 58 -10.073 -8.242 -7.882
409 HB2 LYS 58 HB2 LYS 58 -7.455 -6.772 -7.478
410 HB3 LYS 58 HB3 LYS 58 -7.926 -8.262 -6.666
411 HG2 LYS 58 HG2 LYS 58 -7.754 -8.006 -9.681
412 HG3 LYS 58 HG3 LYS 58 -6.413 -8.570 -8.686
413 HD2 LYS 58 HD2 LYS 58 -7.851 -10.398 -7.814
414 HD3 LYS 58 HD3 LYS 58 -9.160 -9.851 -8.859
415 HE2 LYS 58 HE2 LYS 58 -7.982 -11.696 -9.942
416 HE3 LYS 58 HE3 LYS 58 -7.687 -10.206 -10.837
417 HZ1 LYS 58 HZ1 LYS 58 -5.670 -11.566 -10.418
418 HZ2 LYS 58 HZ2 LYS 58 -5.860 -11.271 -8.755
419 HZ3 LYS 58 HZ3 LYS 58 -5.564 -9.981 -9.821
420 H GLY 59 H GLY 59 -11.155 -5.379 -7.719
421 HA2 GLY 59 HA2 GLY 59 -12.454 -4.439 -5.996
422 HA3 GLY 59 HA3 GLY 59 -11.521 -5.360 -4.819
423 HA PRO 60 HA PRO 60 -10.026 -0.766 -5.416
424 HB2 PRO 60 HB2 PRO 60 -11.085 -0.500 -2.638
425 HB3 PRO 60 HB3 PRO 60 -11.125 0.660 -3.979
426 HG2 PRO 60 HG2 PRO 60 -13.311 -0.625 -3.275
427 HG3 PRO 60 HG3 PRO 60 -12.928 -0.362 -4.986
428 HD2 PRO 60 HD2 PRO 60 -12.614 -2.872 -3.351
429 HD3 PRO 60 HD3 PRO 60 -13.195 -2.686 -5.024
430 H CYS 61 H CYS 61 -8.011 -0.264 -4.777
431 HA CYS 61 HA CYS 61 -6.782 -1.841 -2.591
432 HB2 CYS 61 HB2 CYS 61 -5.495 -0.764 -5.116
433 HB3 CYS 61 HB3 CYS 61 -4.659 -1.638 -3.833
434 HG CYS 61 HG CYS 61 -6.992 -3.013 -5.396
435 H ALA 62 H ALA 62 -4.775 -0.672 -1.686
436 HA ALA 62 HA ALA 62 -5.354 2.231 -1.505
437 HB1 ALA 62 HB1 ALA 62 -4.957 0.188 0.595
438 HB2 ALA 62 HB2 ALA 62 -5.849 1.706 0.650
439 HB3 ALA 62 HB3 ALA 62 -4.098 1.707 0.850
440 H ASN 63 H ASN 63 -3.740 3.502 -2.151
441 HA ASN 63 HA ASN 63 -0.982 2.406 -2.145
442 HB2 ASN 63 HB2 ASN 63 -0.567 3.738 -4.186
443 HB3 ASN 63 HB3 ASN 63 -1.821 2.527 -4.439
444 HD21 ASN 63 HD21 ASN 63 -3.380 3.452 -5.778
445 HD22 ASN 63 HD22 ASN 63 -4.011 5.016 -5.593
446 H LYS 64 H LYS 64 0.590 4.433 -2.548
447 HA LYS 64 HA LYS 64 1.571 6.260 -1.548
448 HB2 LYS 64 HB2 LYS 64 -1.301 7.228 -1.315
449 HB3 LYS 64 HB3 LYS 64 0.140 8.230 -1.164
450 HG2 LYS 64 HG2 LYS 64 -0.464 6.617 -3.655
451 HG3 LYS 64 HG3 LYS 64 -1.027 8.271 -3.444
452 HD2 LYS 64 HD2 LYS 64 1.889 7.512 -3.163
453 HD3 LYS 64 HD3 LYS 64 1.181 7.985 -4.705
454 HE2 LYS 64 HE2 LYS 64 0.409 10.118 -3.631
455 HE3 LYS 64 HE3 LYS 64 1.286 9.653 -2.174
456 HZ1 LYS 64 HZ1 LYS 64 3.296 9.946 -3.170
457 HZ2 LYS 64 HZ2 LYS 64 2.401 11.123 -4.008
458 HZ3 LYS 64 HZ3 LYS 64 2.715 9.617 -4.730
459 H VAL 65 H VAL 65 1.427 4.138 0.060
460 HA VAL 65 HA VAL 65 0.063 4.584 2.534
461 HB VAL 65 HB VAL 65 2.403 2.758 1.893
462 HG11 VAL 65 HG11 VAL 65 0.430 2.669 4.199
463 HG12 VAL 65 HG12 VAL 65 2.112 3.184 4.329
464 HG13 VAL 65 HG13 VAL 65 1.732 1.516 3.899
465 HG21 VAL 65 HG21 VAL 65 0.788 1.046 1.487
466 HG22 VAL 65 HG22 VAL 65 0.224 2.451 0.584
467 HG23 VAL 65 HG23 VAL 65 -0.527 2.034 2.123
468 H VAL 66 H VAL 66 0.543 6.084 3.928
469 HA VAL 66 HA VAL 66 3.379 6.837 4.377
470 HB VAL 66 HB VAL 66 0.949 8.659 4.504
471 HG11 VAL 66 HG11 VAL 66 2.669 10.454 4.803
472 HG12 VAL 66 HG12 VAL 66 3.901 9.202 4.960
473 HG13 VAL 66 HG13 VAL 66 2.612 9.326 6.158
474 HG21 VAL 66 HG21 VAL 66 1.872 9.736 2.537
475 HG22 VAL 66 HG22 VAL 66 1.737 8.011 2.197
476 HG23 VAL 66 HG23 VAL 66 3.306 8.711 2.594
477 H ALA 67 H ALA 67 4.062 6.389 6.363
478 HA ALA 67 HA ALA 67 2.265 5.470 8.408
479 HB1 ALA 67 HB1 ALA 67 5.243 5.996 8.391
480 HB2 ALA 67 HB2 ALA 67 4.433 4.436 8.254
481 HB3 ALA 67 HB3 ALA 67 4.375 5.329 9.773
482 H VAL 68 H VAL 68 1.486 6.529 10.137
483 HA VAL 68 HA VAL 68 2.568 9.167 10.848
484 HB VAL 68 HB VAL 68 -0.391 8.694 10.340
485 HG11 VAL 68 HG11 VAL 68 -0.514 11.172 10.675
486 HG12 VAL 68 HG12 VAL 68 1.185 11.161 11.147
487 HG13 VAL 68 HG13 VAL 68 -0.010 10.310 12.128
488 HG21 VAL 68 HG21 VAL 68 1.736 10.165 8.753
489 HG22 VAL 68 HG22 VAL 68 0.007 10.432 8.518
490 HG23 VAL 68 HG23 VAL 68 0.705 8.845 8.201
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 -8.884 14.173 1.622
2 H2 MET 1 HT2 MET 1 -7.542 14.814 0.803
3 H3 MET 1 HT3 MET 1 -7.513 14.653 2.495
4 HA MET 1 HA MET 1 -7.436 12.507 0.457
5 HB2 MET 1 HB2 MET 1 -5.606 13.411 2.696
6 HB3 MET 1 HB3 MET 1 -5.393 11.893 1.823
7 HG2 MET 1 HG2 MET 1 -5.149 13.083 -0.285
8 HG3 MET 1 HG3 MET 1 -5.504 14.620 0.505
9 HE1 MET 1 HE1 MET 1 -3.183 11.540 1.739
10 HE2 MET 1 HE2 MET 1 -1.771 12.011 0.797
11 HE3 MET 1 HE3 MET 1 -3.299 11.690 -0.020
12 H SER 2 H SER 2 -6.886 10.374 1.773
13 HA SER 2 HA SER 2 -8.834 10.113 3.987
14 HB2 SER 2 HB2 SER 2 -8.338 8.165 1.724
15 HB3 SER 2 HB3 SER 2 -9.377 7.863 3.113
16 HG SER 2 HG SER 2 -9.774 9.447 0.886
17 H LYS 3 H LYS 3 -8.372 8.520 5.549
18 HA LYS 3 HA LYS 3 -5.857 7.068 5.463
19 HB2 LYS 3 HB2 LYS 3 -4.929 8.099 7.487
20 HB3 LYS 3 HB3 LYS 3 -5.119 9.290 6.206
21 HG2 LYS 3 HG2 LYS 3 -7.235 10.058 7.226
22 HG3 LYS 3 HG3 LYS 3 -7.036 8.869 8.516
23 HD2 LYS 3 HD2 LYS 3 -4.913 9.940 9.179
24 HD3 LYS 3 HD3 LYS 3 -5.110 11.129 7.892
25 HE2 LYS 3 HE2 LYS 3 -7.213 11.903 8.919
26 HE3 LYS 3 HE3 LYS 3 -7.027 10.709 10.205
27 HZ1 LYS 3 HZ1 LYS 3 -6.184 12.735 11.031
28 HZ2 LYS 3 HZ2 LYS 3 -5.288 13.037 9.621
29 HZ3 LYS 3 HZ3 LYS 3 -4.828 11.785 10.671
30 H GLY 4 H GLY 4 -5.867 5.301 6.755
31 HA2 GLY 4 HA2 GLY 4 -8.096 4.982 8.677
32 HA3 GLY 4 HA3 GLY 4 -7.771 3.747 7.464
33 H ILE 5 H ILE 5 -7.641 2.459 9.533
34 HA ILE 5 HA ILE 5 -4.878 2.568 10.606
35 HB ILE 5 HB ILE 5 -5.821 1.364 12.614
36 HG12 ILE 5 HG12 ILE 5 -8.511 2.367 11.643
37 HG13 ILE 5 HG13 ILE 5 -7.979 0.717 11.336
38 HG21 ILE 5 HG21 ILE 5 -5.335 3.836 12.477
39 HG22 ILE 5 HG22 ILE 5 -6.569 3.405 13.659
40 HG23 ILE 5 HG23 ILE 5 -7.040 4.091 12.103
41 HD11 ILE 5 HD11 ILE 5 -7.694 0.349 13.759
42 HD12 ILE 5 HD12 ILE 5 -9.345 0.854 13.397
43 HD13 ILE 5 HD13 ILE 5 -8.197 2.011 14.074
44 H VAL 6 H VAL 6 -3.639 0.887 10.286
45 HA VAL 6 HA VAL 6 -4.462 -1.225 8.583
46 HB VAL 6 HB VAL 6 -1.921 -0.950 10.218
47 HG11 VAL 6 HG11 VAL 6 -2.034 -3.224 9.547
48 HG12 VAL 6 HG12 VAL 6 -1.051 -2.455 8.301
49 HG13 VAL 6 HG13 VAL 6 -2.748 -2.817 7.986
50 HG21 VAL 6 HG21 VAL 6 -0.957 0.073 8.282
51 HG22 VAL 6 HG22 VAL 6 -2.502 0.886 8.520
52 HG23 VAL 6 HG23 VAL 6 -2.339 -0.352 7.275
53 H LYS 7 H LYS 7 -5.494 -3.001 9.071
54 HA LYS 7 HA LYS 7 -6.119 -3.804 11.736
55 HB2 LYS 7 HB2 LYS 7 -7.559 -4.317 9.751
56 HB3 LYS 7 HB3 LYS 7 -6.331 -5.460 9.203
57 HG2 LYS 7 HG2 LYS 7 -6.572 -6.732 11.313
58 HG3 LYS 7 HG3 LYS 7 -7.806 -5.597 11.856
59 HD2 LYS 7 HD2 LYS 7 -8.066 -7.151 9.273
60 HD3 LYS 7 HD3 LYS 7 -8.662 -7.770 10.812
61 HE2 LYS 7 HE2 LYS 7 -10.026 -5.680 11.064
62 HE3 LYS 7 HE3 LYS 7 -9.509 -5.197 9.449
63 HZ1 LYS 7 HZ1 LYS 7 -10.431 -7.339 8.639
64 HZ2 LYS 7 HZ2 LYS 7 -11.602 -6.279 9.264
65 HZ3 LYS 7 HZ3 LYS 7 -11.075 -7.605 10.184
66 H TRP 8 H TRP 8 -3.865 -4.994 9.266
67 HA TRP 8 HA TRP 8 -2.024 -5.962 11.262
68 HB2 TRP 8 HB2 TRP 8 -3.868 -7.765 10.968
69 HB3 TRP 8 HB3 TRP 8 -3.145 -8.043 9.386
70 HD1 TRP 8 HD1 TRP 8 -0.708 -9.084 9.302
71 HE1 TRP 8 HE1 TRP 8 0.683 -10.363 11.055
72 HE3 TRP 8 HE3 TRP 8 -3.357 -7.962 13.519
73 HZ2 TRP 8 HZ2 TRP 8 0.671 -10.851 13.873
74 HZ3 TRP 8 HZ3 TRP 8 -2.649 -8.849 15.722
75 HH2 TRP 8 HH2 TRP 8 -0.639 -10.291 15.905
76 H PHE 9 H PHE 9 -0.025 -5.641 10.449
77 HA PHE 9 HA PHE 9 0.274 -5.579 7.488
78 HB2 PHE 9 HB2 PHE 9 0.718 -3.421 8.795
79 HB3 PHE 9 HB3 PHE 9 2.138 -4.239 9.454
80 HD1 PHE 9 HD1 PHE 9 0.707 -2.579 6.557
81 HD2 PHE 9 HD2 PHE 9 3.907 -5.122 7.879
82 HE1 PHE 9 HE1 PHE 9 1.955 -2.088 4.473
83 HE2 PHE 9 HE2 PHE 9 5.157 -4.625 5.795
84 HZ PHE 9 HZ PHE 9 4.183 -3.111 4.093
85 H ASN 10 H ASN 10 1.518 -7.129 6.597
86 HA ASN 10 HA ASN 10 3.564 -8.435 8.296
87 HB2 ASN 10 HB2 ASN 10 1.540 -9.745 6.483
88 HB3 ASN 10 HB3 ASN 10 2.998 -10.566 7.031
89 HD21 ASN 10 HD21 ASN 10 0.290 -11.395 7.741
90 HD22 ASN 10 HD22 ASN 10 0.139 -11.227 9.422
91 H SER 11 H SER 11 5.341 -7.453 7.418
92 HA SER 11 HA SER 11 5.769 -6.924 4.691
93 HB2 SER 11 HB2 SER 11 7.737 -7.335 6.952
94 HB3 SER 11 HB3 SER 11 8.162 -6.718 5.358
95 HG SER 11 HG SER 11 7.763 -4.955 6.609
96 H ASP 12 H ASP 12 6.562 -9.732 6.710
97 HA ASP 12 HA ASP 12 8.247 -11.099 4.931
98 HB2 ASP 12 HB2 ASP 12 6.296 -12.125 7.006
99 HB3 ASP 12 HB3 ASP 12 7.401 -13.175 6.123
100 H LYS 13 H LYS 13 4.713 -11.106 5.242
101 HA LYS 13 HA LYS 13 4.286 -12.935 3.059
102 HB2 LYS 13 HB2 LYS 13 2.433 -11.027 4.509
103 HB3 LYS 13 HB3 LYS 13 1.905 -12.170 3.271
104 HG2 LYS 13 HG2 LYS 13 2.726 -14.048 4.603
105 HG3 LYS 13 HG3 LYS 13 3.369 -12.941 5.816
106 HD2 LYS 13 HD2 LYS 13 1.290 -13.669 6.708
107 HD3 LYS 13 HD3 LYS 13 0.960 -12.064 6.051
108 HE2 LYS 13 HE2 LYS 13 -0.827 -13.492 5.317
109 HE3 LYS 13 HE3 LYS 13 0.207 -13.212 3.918
110 HZ1 LYS 13 HZ1 LYS 13 -0.240 -15.649 5.436
111 HZ2 LYS 13 HZ2 LYS 13 1.357 -15.376 4.927
112 HZ3 LYS 13 HZ3 LYS 13 0.100 -15.444 3.787
113 H GLY 14 H GLY 14 4.668 -9.505 3.478
114 HA2 GLY 14 HA2 GLY 14 5.373 -7.995 1.810
115 HA3 GLY 14 HA3 GLY 14 4.785 -9.104 0.582
116 H PHE 15 H PHE 15 2.438 -8.732 3.003
117 HA PHE 15 HA PHE 15 1.276 -6.285 2.005
118 HB2 PHE 15 HB2 PHE 15 -0.780 -7.302 1.119
119 HB3 PHE 15 HB3 PHE 15 0.638 -7.782 0.194
120 HD1 PHE 15 HD1 PHE 15 -1.959 -8.894 2.552
121 HD2 PHE 15 HD2 PHE 15 1.502 -10.068 0.294
122 HE1 PHE 15 HE1 PHE 15 -2.512 -11.279 2.944
123 HE2 PHE 15 HE2 PHE 15 0.949 -12.453 0.687
124 HZ PHE 15 HZ PHE 15 -1.059 -13.058 2.011
125 H GLY 16 H GLY 16 -1.025 -6.032 2.885
126 HA2 GLY 16 HA2 GLY 16 -1.603 -7.423 5.358
127 HA3 GLY 16 HA3 GLY 16 -1.074 -5.756 5.571
128 H PHE 17 H PHE 17 -3.514 -6.303 6.469
129 HA PHE 17 HA PHE 17 -5.392 -5.297 4.408
130 HB2 PHE 17 HB2 PHE 17 -5.938 -6.913 6.916
131 HB3 PHE 17 HB3 PHE 17 -7.178 -6.265 5.846
132 HD1 PHE 17 HD1 PHE 17 -4.514 -8.771 6.223
133 HD2 PHE 17 HD2 PHE 17 -7.521 -7.182 3.601
134 HE1 PHE 17 HE1 PHE 17 -4.301 -10.769 4.770
135 HE2 PHE 17 HE2 PHE 17 -7.311 -9.180 2.149
136 HZ PHE 17 HZ PHE 17 -5.699 -10.973 2.732
137 H ILE 18 H ILE 18 -6.389 -3.366 4.796
138 HA ILE 18 HA ILE 18 -5.849 -2.108 7.408
139 HB ILE 18 HB ILE 18 -4.679 -1.018 5.543
140 HG12 ILE 18 HG12 ILE 18 -6.947 0.791 6.406
141 HG13 ILE 18 HG13 ILE 18 -5.704 0.261 7.540
142 HG21 ILE 18 HG21 ILE 18 -7.481 -0.806 4.426
143 HG22 ILE 18 HG22 ILE 18 -6.040 -1.466 3.650
144 HG23 ILE 18 HG23 ILE 18 -6.188 0.273 3.900
145 HD11 ILE 18 HD11 ILE 18 -3.961 1.203 6.077
146 HD12 ILE 18 HD12 ILE 18 -5.123 2.447 6.535
147 HD13 ILE 18 HD13 ILE 18 -5.192 1.721 4.928
148 H THR 19 H THR 19 -7.415 -1.113 8.522
149 HA THR 19 HA THR 19 -10.160 -1.745 7.749
150 HB THR 19 HB THR 19 -9.035 -0.761 10.377
151 HG1 THR 19 HG1 THR 19 -9.219 -2.926 10.969
152 HG21 THR 19 HG21 THR 19 -11.416 -0.256 10.166
153 HG22 THR 19 HG22 THR 19 -11.212 -1.613 11.274
154 HG23 THR 19 HG23 THR 19 -11.745 -1.900 9.617
155 HA PRO 20 HA PRO 20 -10.341 2.687 6.472
156 HB2 PRO 20 HB2 PRO 20 -13.198 1.880 6.077
157 HB3 PRO 20 HB3 PRO 20 -12.125 2.775 4.985
158 HG2 PRO 20 HG2 PRO 20 -12.691 0.263 4.484
159 HG3 PRO 20 HG3 PRO 20 -11.030 0.855 4.280
160 HD2 PRO 20 HD2 PRO 20 -12.178 -0.783 6.525
161 HD3 PRO 20 HD3 PRO 20 -10.599 -0.934 5.714
162 H GLU 21 H GLU 21 -10.683 4.358 7.859
163 HA GLU 21 HA GLU 21 -11.841 3.998 10.414
164 HB2 GLU 21 HB2 GLU 21 -11.558 6.428 10.675
165 HB3 GLU 21 HB3 GLU 21 -10.116 5.688 9.986
166 HG2 GLU 21 HG2 GLU 21 -10.838 6.379 7.725
167 HG3 GLU 21 HG3 GLU 21 -12.285 7.113 8.411
168 H ASP 22 H ASP 22 -13.159 5.112 7.368
169 HA ASP 22 HA ASP 22 -15.546 6.297 8.357
170 HB2 ASP 22 HB2 ASP 22 -14.572 6.623 6.061
171 HB3 ASP 22 HB3 ASP 22 -15.139 5.003 5.657
172 H GLY 23 H GLY 23 -14.573 3.004 7.953
173 HA2 GLY 23 HA2 GLY 23 -15.816 1.248 9.057
174 HA3 GLY 23 HA3 GLY 23 -17.299 2.106 8.655
175 H SER 24 H SER 24 -15.134 2.178 6.053
176 HA SER 24 HA SER 24 -16.784 0.501 4.426
177 HB2 SER 24 HB2 SER 24 -14.104 1.797 3.892
178 HB3 SER 24 HB3 SER 24 -15.073 0.972 2.681
179 HG SER 24 HG SER 24 -16.087 2.793 2.487
180 H LYS 25 H LYS 25 -15.727 -1.205 3.024
181 HA LYS 25 HA LYS 25 -14.811 -3.333 4.658
182 HB2 LYS 25 HB2 LYS 25 -14.788 -3.076 1.639
183 HB3 LYS 25 HB3 LYS 25 -14.562 -4.572 2.538
184 HG2 LYS 25 HG2 LYS 25 -17.044 -2.844 2.756
185 HG3 LYS 25 HG3 LYS 25 -16.912 -4.223 1.671
186 HD2 LYS 25 HD2 LYS 25 -16.441 -5.689 3.629
187 HD3 LYS 25 HD3 LYS 25 -16.662 -4.301 4.695
188 HE2 LYS 25 HE2 LYS 25 -18.973 -4.030 3.866
189 HE3 LYS 25 HE3 LYS 25 -18.755 -5.422 2.806
190 HZ1 LYS 25 HZ1 LYS 25 -18.095 -6.606 4.987
191 HZ2 LYS 25 HZ2 LYS 25 -19.739 -6.351 4.648
192 HZ3 LYS 25 HZ3 LYS 25 -18.928 -5.336 5.743
193 H ASP 26 H ASP 26 -12.811 -4.440 4.629
194 HA ASP 26 HA ASP 26 -10.538 -2.848 4.843
195 HB2 ASP 26 HB2 ASP 26 -10.861 -5.823 4.450
196 HB3 ASP 26 HB3 ASP 26 -9.302 -5.062 4.744
197 H LEU 27 H LEU 27 -8.780 -2.458 3.568
198 HA LEU 27 HA LEU 27 -9.082 -3.072 0.686
199 HB2 LEU 27 HB2 LEU 27 -7.718 -0.702 1.998
200 HB3 LEU 27 HB3 LEU 27 -7.822 -0.994 0.265
201 HG LEU 27 HG LEU 27 -10.245 -0.680 2.073
202 HD11 LEU 27 HD11 LEU 27 -8.762 1.311 0.335
203 HD12 LEU 27 HD12 LEU 27 -9.097 1.430 2.062
204 HD13 LEU 27 HD13 LEU 27 -10.415 1.569 0.899
205 HD21 LEU 27 HD21 LEU 27 -10.806 -1.895 0.063
206 HD22 LEU 27 HD22 LEU 27 -9.852 -0.797 -0.935
207 HD23 LEU 27 HD23 LEU 27 -11.343 -0.233 -0.183
208 H PHE 28 H PHE 28 -7.220 -3.622 -0.496
209 HA PHE 28 HA PHE 28 -5.202 -5.032 1.035
210 HB2 PHE 28 HB2 PHE 28 -5.690 -4.705 -1.930
211 HB3 PHE 28 HB3 PHE 28 -4.348 -5.639 -1.264
212 HD1 PHE 28 HD1 PHE 28 -8.011 -5.446 -1.644
213 HD2 PHE 28 HD2 PHE 28 -4.728 -7.739 -0.089
214 HE1 PHE 28 HE1 PHE 28 -9.517 -7.391 -1.330
215 HE2 PHE 28 HE2 PHE 28 -6.235 -9.682 0.227
216 HZ PHE 28 HZ PHE 28 -8.629 -9.509 -0.393
217 H VAL 29 H VAL 29 -3.210 -4.356 1.501
218 HA VAL 29 HA VAL 29 -2.076 -2.056 0.036
219 HB VAL 29 HB VAL 29 -2.110 -2.420 3.045
220 HG11 VAL 29 HG11 VAL 29 -1.022 -0.077 2.930
221 HG12 VAL 29 HG12 VAL 29 -0.663 -0.468 1.248
222 HG13 VAL 29 HG13 VAL 29 0.008 -1.455 2.543
223 HG21 VAL 29 HG21 VAL 29 -3.217 -0.130 1.414
224 HG22 VAL 29 HG22 VAL 29 -3.520 -0.500 3.112
225 HG23 VAL 29 HG23 VAL 29 -4.196 -1.530 1.851
226 H HIS 30 H HIS 30 0.034 -2.298 -0.521
227 HA HIS 30 HA HIS 30 1.422 -4.736 0.428
228 HB2 HIS 30 HB2 HIS 30 1.753 -3.217 -2.173
229 HB3 HIS 30 HB3 HIS 30 2.676 -4.642 -1.700
230 HD2 HIS 30 HD2 HIS 30 -0.591 -3.830 -3.500
231 HE1 HIS 30 HE1 HIS 30 -0.894 -7.877 -2.344
232 HE2 HIS 30 HE2 HIS 30 -1.931 -6.053 -3.773
233 H HIS 31 H HIS 31 3.727 -4.628 0.676
234 HA HIS 31 HA HIS 31 4.648 -2.369 2.126
235 HB2 HIS 31 HB2 HIS 31 5.516 -4.716 2.394
236 HB3 HIS 31 HB3 HIS 31 6.350 -4.527 0.849
237 HD2 HIS 31 HD2 HIS 31 6.741 -3.381 4.573
238 HE1 HIS 31 HE1 HIS 31 9.927 -1.693 2.371
239 HE2 HIS 31 HE2 HIS 31 8.998 -2.078 4.704
240 H SER 32 H SER 32 5.151 -3.476 -1.181
241 HA SER 32 HA SER 32 7.065 -1.600 -2.013
242 HB2 SER 32 HB2 SER 32 4.907 -3.022 -3.580
243 HB3 SER 32 HB3 SER 32 6.203 -2.085 -4.314
244 HG SER 32 HG SER 32 6.452 -4.493 -3.918
245 H GLU 33 H GLU 33 3.543 -1.387 -1.840
246 HA GLU 33 HA GLU 33 3.269 1.026 -3.315
247 HB2 GLU 33 HB2 GLU 33 1.473 -0.321 -1.296
248 HB3 GLU 33 HB3 GLU 33 1.010 1.115 -2.205
249 HG2 GLU 33 HG2 GLU 33 1.846 -1.533 -3.427
250 HG3 GLU 33 HG3 GLU 33 0.188 -0.960 -3.288
251 H ILE 34 H ILE 34 4.115 0.416 0.038
252 HA ILE 34 HA ILE 34 3.619 3.217 0.748
253 HB ILE 34 HB ILE 34 2.933 1.527 2.388
254 HG12 ILE 34 HG12 ILE 34 5.376 2.958 3.474
255 HG13 ILE 34 HG13 ILE 34 3.876 3.796 3.098
256 HG21 ILE 34 HG21 ILE 34 5.833 0.702 2.211
257 HG22 ILE 34 HG22 ILE 34 4.392 -0.296 2.021
258 HG23 ILE 34 HG23 ILE 34 4.841 0.306 3.615
259 HD11 ILE 34 HD11 ILE 34 4.436 1.797 5.262
260 HD12 ILE 34 HD12 ILE 34 2.798 1.906 4.617
261 HD13 ILE 34 HD13 ILE 34 3.554 3.321 5.354
262 H GLN 35 H GLN 35 5.135 4.706 1.112
263 HA GLN 35 HA GLN 35 7.936 3.987 0.487
264 HB2 GLN 35 HB2 GLN 35 6.772 5.493 -1.150
265 HB3 GLN 35 HB3 GLN 35 6.584 6.676 0.143
266 HG2 GLN 35 HG2 GLN 35 9.026 6.781 0.423
267 HG3 GLN 35 HG3 GLN 35 9.233 5.569 -0.840
268 HE21 GLN 35 HE21 GLN 35 9.973 8.583 -0.658
269 HE22 GLN 35 HE22 GLN 35 9.360 9.224 -2.106
270 H SER 36 H SER 36 9.535 4.635 1.854
271 HA SER 36 HA SER 36 8.840 6.332 4.156
272 HB2 SER 36 HB2 SER 36 9.933 4.788 5.695
273 HB3 SER 36 HB3 SER 36 8.605 3.978 4.870
274 HG SER 36 HG SER 36 11.323 3.542 4.742
275 H GLY 37 H GLY 37 10.741 7.117 5.319
276 HA2 GLY 37 HA2 GLY 37 12.659 8.266 3.619
277 HA3 GLY 37 HA3 GLY 37 12.753 8.221 5.375
278 H GLY 38 H GLY 38 12.803 5.398 5.696
279 HA2 GLY 38 HA2 GLY 38 15.049 4.363 4.166
280 HA3 GLY 38 HA3 GLY 38 15.398 4.716 5.854
281 H GLU 39 H GLU 39 15.800 2.223 5.285
282 HA GLU 39 HA GLU 39 13.604 0.448 5.284
283 HB2 GLU 39 HB2 GLU 39 15.245 -1.277 5.856
284 HB3 GLU 39 HB3 GLU 39 15.864 -0.216 4.593
285 HG2 GLU 39 HG2 GLU 39 17.108 1.074 6.326
286 HG3 GLU 39 HG3 GLU 39 16.537 -0.052 7.550
287 H TYR 40 H TYR 40 14.840 2.391 7.812
288 HA TYR 40 HA TYR 40 14.387 0.784 10.080
289 HB2 TYR 40 HB2 TYR 40 14.175 3.781 9.736
290 HB3 TYR 40 HB3 TYR 40 14.154 2.953 11.291
291 HD1 TYR 40 HD1 TYR 40 16.221 3.942 8.422
292 HD2 TYR 40 HD2 TYR 40 16.149 1.784 12.134
293 HE1 TYR 40 HE1 TYR 40 18.700 3.871 8.428
294 HE2 TYR 40 HE2 TYR 40 18.628 1.713 12.141
295 HH TYR 40 HH TYR 40 20.477 1.876 9.994
296 H ALA 41 H ALA 41 12.221 2.859 8.201
297 HA ALA 41 HA ALA 41 10.009 2.840 9.925
298 HB1 ALA 41 HB1 ALA 41 10.471 4.122 7.670
299 HB2 ALA 41 HB2 ALA 41 8.819 3.764 8.172
300 HB3 ALA 41 HB3 ALA 41 9.610 2.755 6.963
301 H THR 42 H THR 42 8.584 1.363 10.467
302 HA THR 42 HA THR 42 8.247 -1.054 8.804
303 HB THR 42 HB THR 42 8.163 -2.434 10.853
304 HG1 THR 42 HG1 THR 42 8.046 -1.465 12.684
305 HG21 THR 42 HG21 THR 42 10.267 -2.525 9.806
306 HG22 THR 42 HG22 THR 42 10.660 -2.106 11.472
307 HG23 THR 42 HG23 THR 42 10.654 -0.858 10.228
308 H LEU 43 H LEU 43 6.279 -2.307 9.491
309 HA LEU 43 HA LEU 43 4.160 -0.619 10.629
310 HB2 LEU 43 HB2 LEU 43 3.998 -2.053 7.970
311 HB3 LEU 43 HB3 LEU 43 2.603 -1.415 8.829
312 HG LEU 43 HG LEU 43 4.131 0.818 8.845
313 HD11 LEU 43 HD11 LEU 43 4.873 -0.395 6.177
314 HD12 LEU 43 HD12 LEU 43 5.943 -0.502 7.570
315 HD13 LEU 43 HD13 LEU 43 5.497 1.074 6.926
316 HD21 LEU 43 HD21 LEU 43 1.810 0.377 7.820
317 HD22 LEU 43 HD22 LEU 43 2.663 0.061 6.308
318 HD23 LEU 43 HD23 LEU 43 2.780 1.646 7.072
319 H ALA 44 H ALA 44 2.481 -1.787 11.619
320 HA ALA 44 HA ALA 44 2.671 -4.711 11.687
321 HB1 ALA 44 HB1 ALA 44 2.583 -3.273 14.319
322 HB2 ALA 44 HB2 ALA 44 4.135 -3.489 13.509
323 HB3 ALA 44 HB3 ALA 44 3.168 -4.897 13.952
324 H ASP 45 H ASP 45 0.910 -4.739 14.144
325 HA ASP 45 HA ASP 45 -1.614 -4.369 12.764
326 HB2 ASP 45 HB2 ASP 45 -1.170 -6.388 14.119
327 HB3 ASP 45 HB3 ASP 45 -1.001 -5.383 15.550
328 H GLY 46 H GLY 46 -2.486 -2.387 12.740
329 HA2 GLY 46 HA2 GLY 46 -3.787 -0.754 13.950
330 HA3 GLY 46 HA3 GLY 46 -2.642 -0.883 15.276
331 H GLN 47 H GLN 47 -0.908 -0.824 12.402
332 HA GLN 47 HA GLN 47 0.280 1.681 12.890
333 HB2 GLN 47 HB2 GLN 47 1.296 -0.216 11.596
334 HB3 GLN 47 HB3 GLN 47 0.201 0.166 10.267
335 HG2 GLN 47 HG2 GLN 47 2.366 1.223 9.872
336 HG3 GLN 47 HG3 GLN 47 1.151 2.457 10.175
337 HE21 GLN 47 HE21 GLN 47 2.034 4.084 11.456
338 HE22 GLN 47 HE22 GLN 47 3.100 3.831 12.753
339 H THR 48 H THR 48 -0.307 3.691 12.373
340 HA THR 48 HA THR 48 -2.801 4.143 10.926
341 HB THR 48 HB THR 48 -0.921 6.114 12.267
342 HG1 THR 48 HG1 THR 48 -1.827 4.640 13.721
343 HG21 THR 48 HG21 THR 48 -3.005 7.546 12.282
344 HG22 THR 48 HG22 THR 48 -3.751 6.363 11.209
345 HG23 THR 48 HG23 THR 48 -2.333 7.264 10.676
346 H VAL 49 H VAL 49 -2.925 4.692 8.831
347 HA VAL 49 HA VAL 49 -0.604 5.969 7.548
348 HB VAL 49 HB VAL 49 -0.767 4.450 5.602
349 HG11 VAL 49 HG11 VAL 49 0.805 4.071 7.561
350 HG12 VAL 49 HG12 VAL 49 0.434 2.633 6.609
351 HG13 VAL 49 HG13 VAL 49 -0.357 2.890 8.163
352 HG21 VAL 49 HG21 VAL 49 -3.129 3.736 5.965
353 HG22 VAL 49 HG22 VAL 49 -2.615 2.834 7.391
354 HG23 VAL 49 HG23 VAL 49 -2.039 2.360 5.793
355 H GLU 50 H GLU 50 -1.075 6.791 5.383
356 HA GLU 50 HA GLU 50 -3.876 7.737 5.137
357 HB2 GLU 50 HB2 GLU 50 -1.325 9.068 4.143
358 HB3 GLU 50 HB3 GLU 50 -2.960 9.710 3.987
359 HG2 GLU 50 HG2 GLU 50 -3.144 9.800 6.461
360 HG3 GLU 50 HG3 GLU 50 -1.497 9.195 6.596
361 H TYR 51 H TYR 51 -4.902 7.023 3.299
362 HA TYR 51 HA TYR 51 -3.276 6.301 0.964
363 HB2 TYR 51 HB2 TYR 51 -4.352 4.102 0.752
364 HB3 TYR 51 HB3 TYR 51 -3.442 4.230 2.251
365 HD1 TYR 51 HD1 TYR 51 -6.806 4.087 0.755
366 HD2 TYR 51 HD2 TYR 51 -4.577 4.347 4.419
367 HE1 TYR 51 HE1 TYR 51 -8.854 3.546 2.043
368 HE2 TYR 51 HE2 TYR 51 -6.626 3.804 5.704
369 HH TYR 51 HH TYR 51 -9.194 4.073 5.265
370 H GLU 52 H GLU 52 -4.525 5.763 -0.939
371 HA GLU 52 HA GLU 52 -7.091 7.233 -1.060
372 HB2 GLU 52 HB2 GLU 52 -5.147 8.280 -2.305
373 HB3 GLU 52 HB3 GLU 52 -5.133 6.848 -3.336
374 HG2 GLU 52 HG2 GLU 52 -6.458 8.562 -4.429
375 HG3 GLU 52 HG3 GLU 52 -7.540 7.285 -3.882
376 H VAL 53 H VAL 53 -8.806 6.106 -1.761
377 HA VAL 53 HA VAL 53 -8.536 3.275 -2.263
378 HB VAL 53 HB VAL 53 -10.386 4.192 -0.915
379 HG11 VAL 53 HG11 VAL 53 -11.599 5.258 -3.467
380 HG12 VAL 53 HG12 VAL 53 -10.623 6.275 -2.406
381 HG13 VAL 53 HG13 VAL 53 -12.110 5.547 -1.804
382 HG21 VAL 53 HG21 VAL 53 -11.329 2.880 -3.483
383 HG22 VAL 53 HG22 VAL 53 -12.192 2.884 -1.945
384 HG23 VAL 53 HG23 VAL 53 -10.655 2.028 -2.093
385 H GLY 54 H GLY 54 -8.000 2.478 -4.136
386 HA2 GLY 54 HA2 GLY 54 -8.814 3.828 -6.633
387 HA3 GLY 54 HA3 GLY 54 -7.407 2.771 -6.471
388 H GLN 55 H GLN 55 -8.611 1.742 -8.396
389 HA GLN 55 HA GLN 55 -10.543 -0.239 -7.347
390 HB2 GLN 55 HB2 GLN 55 -11.566 -0.298 -9.592
391 HB3 GLN 55 HB3 GLN 55 -11.665 1.307 -8.871
392 HG2 GLN 55 HG2 GLN 55 -9.268 0.757 -10.577
393 HG3 GLN 55 HG3 GLN 55 -10.817 0.891 -11.403
394 HE21 GLN 55 HE21 GLN 55 -10.404 2.968 -12.359
395 HE22 GLN 55 HE22 GLN 55 -10.247 4.379 -11.431
396 H GLY 56 H GLY 56 -10.543 -2.317 -8.366
397 HA2 GLY 56 HA2 GLY 56 -8.302 -3.107 -10.029
398 HA3 GLY 56 HA3 GLY 56 -8.258 -3.738 -8.383
399 H GLN 57 H GLN 57 -8.383 -5.540 -10.394
400 HA GLN 57 HA GLN 57 -10.954 -6.276 -11.292
401 HB2 GLN 57 HB2 GLN 57 -8.425 -7.879 -10.890
402 HB3 GLN 57 HB3 GLN 57 -9.878 -8.528 -11.654
403 HG2 GLN 57 HG2 GLN 57 -9.800 -6.744 -13.344
404 HG3 GLN 57 HG3 GLN 57 -8.364 -6.069 -12.574
405 HE21 GLN 57 HE21 GLN 57 -6.767 -6.508 -14.153
406 HE22 GLN 57 HE22 GLN 57 -6.413 -8.066 -14.726
407 H LYS 58 H LYS 58 -9.091 -7.237 -8.426
408 HA LYS 58 HA LYS 58 -11.162 -9.047 -7.503
409 HB2 LYS 58 HB2 LYS 58 -8.604 -8.060 -6.229
410 HB3 LYS 58 HB3 LYS 58 -9.691 -9.232 -5.482
411 HG2 LYS 58 HG2 LYS 58 -9.428 -10.725 -7.430
412 HG3 LYS 58 HG3 LYS 58 -8.335 -9.559 -8.177
413 HD2 LYS 58 HD2 LYS 58 -6.785 -9.783 -6.270
414 HD3 LYS 58 HD3 LYS 58 -7.876 -10.950 -5.521
415 HE2 LYS 58 HE2 LYS 58 -7.617 -12.449 -7.462
416 HE3 LYS 58 HE3 LYS 58 -6.534 -11.282 -8.221
417 HZ1 LYS 58 HZ1 LYS 58 -4.926 -11.603 -6.571
418 HZ2 LYS 58 HZ2 LYS 58 -5.471 -13.169 -6.942
419 HZ3 LYS 58 HZ3 LYS 58 -6.008 -12.391 -5.530
420 H GLY 59 H GLY 59 -10.395 -5.693 -7.120
421 HA2 GLY 59 HA2 GLY 59 -12.646 -4.668 -6.156
422 HA3 GLY 59 HA3 GLY 59 -11.998 -5.393 -4.687
423 HA PRO 60 HA PRO 60 -10.300 -0.984 -5.400
424 HB2 PRO 60 HB2 PRO 60 -11.168 -0.699 -2.569
425 HB3 PRO 60 HB3 PRO 60 -11.323 0.443 -3.915
426 HG2 PRO 60 HG2 PRO 60 -13.425 -0.871 -3.024
427 HG3 PRO 60 HG3 PRO 60 -13.180 -0.605 -4.761
428 HD2 PRO 60 HD2 PRO 60 -12.698 -3.108 -3.155
429 HD3 PRO 60 HD3 PRO 60 -13.419 -2.937 -4.772
430 H CYS 61 H CYS 61 -8.364 -0.209 -4.680
431 HA CYS 61 HA CYS 61 -6.913 -1.809 -2.646
432 HB2 CYS 61 HB2 CYS 61 -5.811 -0.683 -5.234
433 HB3 CYS 61 HB3 CYS 61 -4.869 -1.511 -3.994
434 HG CYS 61 HG CYS 61 -6.527 -3.626 -4.475
435 H ALA 62 H ALA 62 -4.962 -0.567 -1.779
436 HA ALA 62 HA ALA 62 -5.630 2.317 -1.577
437 HB1 ALA 62 HB1 ALA 62 -5.934 1.799 0.613
438 HB2 ALA 62 HB2 ALA 62 -4.171 1.804 0.680
439 HB3 ALA 62 HB3 ALA 62 -5.043 0.285 0.481
440 H ASN 63 H ASN 63 -4.091 3.674 -2.301
441 HA ASN 63 HA ASN 63 -1.309 2.667 -2.482
442 HB2 ASN 63 HB2 ASN 63 -1.084 4.014 -4.558
443 HB3 ASN 63 HB3 ASN 63 -2.264 2.714 -4.718
444 HD21 ASN 63 HD21 ASN 63 -3.857 3.575 -6.085
445 HD22 ASN 63 HD22 ASN 63 -4.627 5.065 -5.835
446 H LYS 64 H LYS 64 0.179 4.702 -2.974
447 HA LYS 64 HA LYS 64 1.185 6.542 -2.028
448 HB2 LYS 64 HB2 LYS 64 -1.700 7.474 -1.960
449 HB3 LYS 64 HB3 LYS 64 -0.306 8.514 -1.667
450 HG2 LYS 64 HG2 LYS 64 0.558 8.046 -3.911
451 HG3 LYS 64 HG3 LYS 64 -0.764 6.916 -4.208
452 HD2 LYS 64 HD2 LYS 64 -1.396 8.966 -5.273
453 HD3 LYS 64 HD3 LYS 64 -2.359 8.864 -3.801
454 HE2 LYS 64 HE2 LYS 64 -0.800 10.365 -2.645
455 HE3 LYS 64 HE3 LYS 64 0.231 10.424 -4.075
456 HZ1 LYS 64 HZ1 LYS 64 -1.377 11.581 -5.276
457 HZ2 LYS 64 HZ2 LYS 64 -1.415 12.310 -3.741
458 HZ3 LYS 64 HZ3 LYS 64 -2.618 11.196 -4.187
459 H VAL 65 H VAL 65 0.930 4.462 -0.321
460 HA VAL 65 HA VAL 65 -0.385 5.155 2.125
461 HB VAL 65 HB VAL 65 1.731 3.056 1.582
462 HG11 VAL 65 HG11 VAL 65 0.918 2.008 3.653
463 HG12 VAL 65 HG12 VAL 65 -0.220 3.334 3.892
464 HG13 VAL 65 HG13 VAL 65 1.516 3.632 3.987
465 HG21 VAL 65 HG21 VAL 65 -1.258 2.672 1.857
466 HG22 VAL 65 HG22 VAL 65 -0.064 1.522 1.258
467 HG23 VAL 65 HG23 VAL 65 -0.482 2.936 0.295
468 H VAL 66 H VAL 66 0.256 6.533 3.554
469 HA VAL 66 HA VAL 66 3.144 7.151 3.857
470 HB VAL 66 HB VAL 66 0.793 9.050 4.204
471 HG11 VAL 66 HG11 VAL 66 2.593 10.773 4.452
472 HG12 VAL 66 HG12 VAL 66 3.786 9.474 4.477
473 HG13 VAL 66 HG13 VAL 66 2.590 9.595 5.765
474 HG21 VAL 66 HG21 VAL 66 1.364 8.491 1.832
475 HG22 VAL 66 HG22 VAL 66 3.013 9.039 2.133
476 HG23 VAL 66 HG23 VAL 66 1.673 10.182 2.226
477 H ALA 67 H ALA 67 3.920 6.556 5.781
478 HA ALA 67 HA ALA 67 2.225 5.600 7.877
479 HB1 ALA 67 HB1 ALA 67 4.394 5.402 9.137
480 HB2 ALA 67 HB2 ALA 67 5.199 6.129 7.747
481 HB3 ALA 67 HB3 ALA 67 4.379 4.577 7.580
482 H VAL 68 H VAL 68 1.580 6.542 9.726
483 HA VAL 68 HA VAL 68 1.056 8.194 11.233
484 HB VAL 68 HB VAL 68 3.818 9.269 10.567
485 HG11 VAL 68 HG11 VAL 68 3.689 10.205 12.862
486 HG12 VAL 68 HG12 VAL 68 2.039 9.600 13.004
487 HG13 VAL 68 HG13 VAL 68 2.419 10.854 11.824
488 HG21 VAL 68 HG21 VAL 68 3.981 6.929 11.256
489 HG22 VAL 68 HG22 VAL 68 2.915 7.230 12.629
490 HG23 VAL 68 HG23 VAL 68 4.520 7.958 12.584
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 -6.274 13.360 0.274
2 H2 MET 1 HT2 MET 1 -7.612 13.116 1.291
3 H3 MET 1 HT3 MET 1 -6.938 11.810 0.440
4 HA MET 1 HA MET 1 -4.870 12.053 1.698
5 HB2 MET 1 HB2 MET 1 -6.495 14.126 3.211
6 HB3 MET 1 HB3 MET 1 -4.905 13.536 3.689
7 HG2 MET 1 HG2 MET 1 -5.521 14.954 1.077
8 HG3 MET 1 HG3 MET 1 -4.767 15.704 2.481
9 HE1 MET 1 HE1 MET 1 -2.732 13.483 3.613
10 HE2 MET 1 HE2 MET 1 -2.693 15.237 3.458
11 HE3 MET 1 HE3 MET 1 -1.359 14.276 2.826
12 H SER 2 H SER 2 -7.058 10.323 1.407
13 HA SER 2 HA SER 2 -8.404 9.698 3.813
14 HB2 SER 2 HB2 SER 2 -9.194 8.837 1.686
15 HB3 SER 2 HB3 SER 2 -7.693 7.953 1.445
16 HG SER 2 HG SER 2 -9.834 7.452 3.167
17 H LYS 3 H LYS 3 -7.949 8.309 5.459
18 HA LYS 3 HA LYS 3 -5.562 6.661 5.472
19 HB2 LYS 3 HB2 LYS 3 -4.530 7.752 7.415
20 HB3 LYS 3 HB3 LYS 3 -4.620 8.857 6.046
21 HG2 LYS 3 HG2 LYS 3 -6.655 9.885 7.007
22 HG3 LYS 3 HG3 LYS 3 -6.551 8.785 8.385
23 HD2 LYS 3 HD2 LYS 3 -4.338 9.708 8.964
24 HD3 LYS 3 HD3 LYS 3 -4.437 10.809 7.588
25 HE2 LYS 3 HE2 LYS 3 -6.458 11.843 8.552
26 HE3 LYS 3 HE3 LYS 3 -6.369 10.741 9.926
27 HZ1 LYS 3 HZ1 LYS 3 -4.251 11.660 10.529
28 HZ2 LYS 3 HZ2 LYS 3 -5.378 12.924 10.387
29 HZ3 LYS 3 HZ3 LYS 3 -4.236 12.656 9.156
30 H GLY 4 H GLY 4 -5.599 5.089 7.076
31 HA2 GLY 4 HA2 GLY 4 -7.809 5.122 9.012
32 HA3 GLY 4 HA3 GLY 4 -7.739 3.796 7.856
33 H ILE 5 H ILE 5 -7.575 2.437 9.777
34 HA ILE 5 HA ILE 5 -4.817 2.362 10.856
35 HB ILE 5 HB ILE 5 -5.838 1.096 12.796
36 HG12 ILE 5 HG12 ILE 5 -8.460 2.306 11.870
37 HG13 ILE 5 HG13 ILE 5 -8.021 0.649 11.467
38 HG21 ILE 5 HG21 ILE 5 -6.535 3.128 13.934
39 HG22 ILE 5 HG22 ILE 5 -6.854 3.925 12.394
40 HG23 ILE 5 HG23 ILE 5 -5.200 3.515 12.847
41 HD11 ILE 5 HD11 ILE 5 -9.331 0.559 13.487
42 HD12 ILE 5 HD12 ILE 5 -8.372 1.838 14.231
43 HD13 ILE 5 HD13 ILE 5 -7.657 0.250 13.948
44 H VAL 6 H VAL 6 -3.645 0.648 10.445
45 HA VAL 6 HA VAL 6 -4.558 -1.333 8.639
46 HB VAL 6 HB VAL 6 -2.024 -1.257 10.301
47 HG11 VAL 6 HG11 VAL 6 -1.206 -2.716 8.322
48 HG12 VAL 6 HG12 VAL 6 -2.915 -2.991 7.990
49 HG13 VAL 6 HG13 VAL 6 -2.224 -3.493 9.532
50 HG21 VAL 6 HG21 VAL 6 -2.521 0.673 8.668
51 HG22 VAL 6 HG22 VAL 6 -2.365 -0.523 7.381
52 HG23 VAL 6 HG23 VAL 6 -0.994 -0.180 8.438
53 H LYS 7 H LYS 7 -5.647 -3.102 9.017
54 HA LYS 7 HA LYS 7 -6.379 -4.000 11.620
55 HB2 LYS 7 HB2 LYS 7 -7.770 -4.389 9.585
56 HB3 LYS 7 HB3 LYS 7 -6.537 -5.498 8.983
57 HG2 LYS 7 HG2 LYS 7 -6.854 -6.944 10.949
58 HG3 LYS 7 HG3 LYS 7 -8.061 -5.825 11.589
59 HD2 LYS 7 HD2 LYS 7 -9.488 -6.209 9.628
60 HD3 LYS 7 HD3 LYS 7 -8.274 -7.289 8.941
61 HE2 LYS 7 HE2 LYS 7 -10.018 -8.608 10.040
62 HE3 LYS 7 HE3 LYS 7 -8.504 -8.769 10.928
63 HZ1 LYS 7 HZ1 LYS 7 -10.381 -8.370 12.406
64 HZ2 LYS 7 HZ2 LYS 7 -10.713 -6.903 11.614
65 HZ3 LYS 7 HZ3 LYS 7 -9.264 -7.095 12.482
66 H TRP 8 H TRP 8 -4.081 -5.139 9.169
67 HA TRP 8 HA TRP 8 -2.287 -6.191 11.152
68 HB2 TRP 8 HB2 TRP 8 -4.168 -7.959 10.809
69 HB3 TRP 8 HB3 TRP 8 -3.415 -8.235 9.241
70 HD1 TRP 8 HD1 TRP 8 -0.790 -8.998 9.287
71 HE1 TRP 8 HE1 TRP 8 0.478 -10.420 11.023
72 HE3 TRP 8 HE3 TRP 8 -3.985 -8.605 13.248
73 HZ2 TRP 8 HZ2 TRP 8 0.173 -11.284 13.733
74 HZ3 TRP 8 HZ3 TRP 8 -3.476 -9.738 15.391
75 HH2 TRP 8 HH2 TRP 8 -1.403 -11.078 15.639
76 H PHE 9 H PHE 9 -0.268 -5.957 10.351
77 HA PHE 9 HA PHE 9 0.031 -5.777 7.396
78 HB2 PHE 9 HB2 PHE 9 0.580 -3.698 8.732
79 HB3 PHE 9 HB3 PHE 9 1.910 -4.604 9.455
80 HD1 PHE 9 HD1 PHE 9 0.558 -3.226 6.296
81 HD2 PHE 9 HD2 PHE 9 3.898 -5.153 8.190
82 HE1 PHE 9 HE1 PHE 9 1.957 -2.755 4.305
83 HE2 PHE 9 HE2 PHE 9 5.296 -4.680 6.196
84 HZ PHE 9 HZ PHE 9 4.327 -3.483 4.256
85 H ASN 10 H ASN 10 1.117 -7.383 6.438
86 HA ASN 10 HA ASN 10 3.072 -8.926 8.050
87 HB2 ASN 10 HB2 ASN 10 1.207 -9.956 5.900
88 HB3 ASN 10 HB3 ASN 10 2.457 -10.906 6.700
89 HD21 ASN 10 HD21 ASN 10 -0.748 -10.700 6.769
90 HD22 ASN 10 HD22 ASN 10 -1.058 -10.868 8.430
91 H SER 11 H SER 11 4.876 -7.768 7.335
92 HA SER 11 HA SER 11 5.431 -7.088 4.665
93 HB2 SER 11 HB2 SER 11 7.724 -6.746 5.445
94 HB3 SER 11 HB3 SER 11 6.577 -6.089 6.607
95 HG SER 11 HG SER 11 7.824 -8.642 6.729
96 H ASP 12 H ASP 12 6.038 -10.039 6.516
97 HA ASP 12 HA ASP 12 7.885 -11.275 4.782
98 HB2 ASP 12 HB2 ASP 12 5.769 -12.439 6.609
99 HB3 ASP 12 HB3 ASP 12 6.930 -13.431 5.732
100 H LYS 13 H LYS 13 4.344 -11.263 4.833
101 HA LYS 13 HA LYS 13 4.045 -12.896 2.484
102 HB2 LYS 13 HB2 LYS 13 2.131 -11.092 3.983
103 HB3 LYS 13 HB3 LYS 13 1.667 -12.090 2.608
104 HG2 LYS 13 HG2 LYS 13 2.411 -14.110 3.809
105 HG3 LYS 13 HG3 LYS 13 2.880 -13.115 5.191
106 HD2 LYS 13 HD2 LYS 13 0.546 -12.356 5.443
107 HD3 LYS 13 HD3 LYS 13 0.072 -13.349 4.061
108 HE2 LYS 13 HE2 LYS 13 0.808 -15.374 5.259
109 HE3 LYS 13 HE3 LYS 13 1.292 -14.388 6.640
110 HZ1 LYS 13 HZ1 LYS 13 -0.892 -15.315 6.994
111 HZ2 LYS 13 HZ2 LYS 13 -1.456 -14.640 5.539
112 HZ3 LYS 13 HZ3 LYS 13 -1.009 -13.630 6.830
113 H GLY 14 H GLY 14 4.423 -9.508 3.191
114 HA2 GLY 14 HA2 GLY 14 5.192 -7.869 1.673
115 HA3 GLY 14 HA3 GLY 14 4.657 -8.883 0.340
116 H PHE 15 H PHE 15 2.236 -8.714 2.708
117 HA PHE 15 HA PHE 15 1.058 -6.220 1.844
118 HB2 PHE 15 HB2 PHE 15 -0.987 -7.225 0.894
119 HB3 PHE 15 HB3 PHE 15 0.446 -7.603 -0.059
120 HD1 PHE 15 HD1 PHE 15 -2.061 -8.946 2.303
121 HD2 PHE 15 HD2 PHE 15 1.306 -9.864 -0.202
122 HE1 PHE 15 HE1 PHE 15 -2.553 -11.366 2.531
123 HE2 PHE 15 HE2 PHE 15 0.816 -12.284 0.030
124 HZ PHE 15 HZ PHE 15 -1.112 -13.035 1.395
125 H GLY 16 H GLY 16 -1.262 -6.059 2.711
126 HA2 GLY 16 HA2 GLY 16 -1.889 -7.608 5.061
127 HA3 GLY 16 HA3 GLY 16 -1.312 -5.984 5.429
128 H PHE 17 H PHE 17 -3.744 -6.389 6.290
129 HA PHE 17 HA PHE 17 -5.571 -5.226 4.266
130 HB2 PHE 17 HB2 PHE 17 -6.202 -6.959 6.671
131 HB3 PHE 17 HB3 PHE 17 -7.410 -6.186 5.647
132 HD1 PHE 17 HD1 PHE 17 -4.877 -8.840 5.865
133 HD2 PHE 17 HD2 PHE 17 -7.769 -6.922 3.336
134 HE1 PHE 17 HE1 PHE 17 -4.748 -10.740 4.276
135 HE2 PHE 17 HE2 PHE 17 -7.642 -8.822 1.748
136 HZ PHE 17 HZ PHE 17 -6.130 -10.731 2.218
137 H ILE 18 H ILE 18 -6.516 -3.294 4.740
138 HA ILE 18 HA ILE 18 -5.929 -2.161 7.398
139 HB ILE 18 HB ILE 18 -4.756 -1.010 5.584
140 HG12 ILE 18 HG12 ILE 18 -7.005 0.791 6.509
141 HG13 ILE 18 HG13 ILE 18 -5.761 0.212 7.620
142 HG21 ILE 18 HG21 ILE 18 -7.555 -0.736 4.469
143 HG22 ILE 18 HG22 ILE 18 -6.117 -1.374 3.672
144 HG23 ILE 18 HG23 ILE 18 -6.254 0.356 3.986
145 HD11 ILE 18 HD11 ILE 18 -4.017 1.235 6.295
146 HD12 ILE 18 HD12 ILE 18 -5.248 2.458 6.604
147 HD13 ILE 18 HD13 ILE 18 -5.165 1.668 5.031
148 H THR 19 H THR 19 -7.447 -1.011 8.502
149 HA THR 19 HA THR 19 -10.226 -1.559 7.739
150 HB THR 19 HB THR 19 -9.075 -0.775 10.422
151 HG1 THR 19 HG1 THR 19 -8.692 -2.811 10.656
152 HG21 THR 19 HG21 THR 19 -11.322 -1.720 11.193
153 HG22 THR 19 HG22 THR 19 -11.826 -1.645 9.505
154 HG23 THR 19 HG23 THR 19 -11.389 -0.166 10.362
155 HA PRO 20 HA PRO 20 -10.152 2.928 6.622
156 HB2 PRO 20 HB2 PRO 20 -13.056 2.229 6.342
157 HB3 PRO 20 HB3 PRO 20 -12.033 3.200 5.268
158 HG2 PRO 20 HG2 PRO 20 -12.640 0.747 4.597
159 HG3 PRO 20 HG3 PRO 20 -10.977 1.328 4.382
160 HD2 PRO 20 HD2 PRO 20 -12.073 -0.492 6.501
161 HD3 PRO 20 HD3 PRO 20 -10.501 -0.544 5.670
162 H GLU 21 H GLU 21 -10.361 4.584 8.018
163 HA GLU 21 HA GLU 21 -11.437 4.263 10.620
164 HB2 GLU 21 HB2 GLU 21 -10.988 6.675 10.880
165 HB3 GLU 21 HB3 GLU 21 -9.616 5.832 10.164
166 HG2 GLU 21 HG2 GLU 21 -9.800 7.725 8.796
167 HG3 GLU 21 HG3 GLU 21 -10.704 6.524 7.881
168 H ASP 22 H ASP 22 -12.880 5.214 7.613
169 HA ASP 22 HA ASP 22 -15.140 6.577 8.811
170 HB2 ASP 22 HB2 ASP 22 -15.970 6.769 6.532
171 HB3 ASP 22 HB3 ASP 22 -14.274 7.230 6.600
172 H GLY 23 H GLY 23 -14.337 3.336 8.582
173 HA2 GLY 23 HA2 GLY 23 -15.691 1.566 9.352
174 HA3 GLY 23 HA3 GLY 23 -17.119 2.539 9.027
175 H SER 24 H SER 24 -14.970 2.647 6.421
176 HA SER 24 HA SER 24 -16.735 1.161 4.723
177 HB2 SER 24 HB2 SER 24 -14.052 2.455 4.237
178 HB3 SER 24 HB3 SER 24 -15.006 1.682 2.990
179 HG SER 24 HG SER 24 -15.605 3.786 2.952
180 H LYS 25 H LYS 25 -15.866 -0.537 3.242
181 HA LYS 25 HA LYS 25 -14.962 -2.771 4.711
182 HB2 LYS 25 HB2 LYS 25 -15.018 -2.343 1.711
183 HB3 LYS 25 HB3 LYS 25 -14.808 -3.897 2.513
184 HG2 LYS 25 HG2 LYS 25 -17.221 -2.120 2.965
185 HG3 LYS 25 HG3 LYS 25 -17.178 -3.389 1.744
186 HD2 LYS 25 HD2 LYS 25 -16.678 -5.055 3.522
187 HD3 LYS 25 HD3 LYS 25 -16.797 -3.776 4.731
188 HE2 LYS 25 HE2 LYS 25 -18.922 -4.968 4.615
189 HE3 LYS 25 HE3 LYS 25 -19.137 -3.336 3.985
190 HZ1 LYS 25 HZ1 LYS 25 -19.340 -4.081 1.854
191 HZ2 LYS 25 HZ2 LYS 25 -20.009 -5.408 2.678
192 HZ3 LYS 25 HZ3 LYS 25 -18.407 -5.473 2.117
193 H ASP 26 H ASP 26 -12.997 -3.920 4.629
194 HA ASP 26 HA ASP 26 -10.672 -2.382 4.775
195 HB2 ASP 26 HB2 ASP 26 -9.477 -4.502 4.920
196 HB3 ASP 26 HB3 ASP 26 -10.947 -4.560 5.884
197 H LEU 27 H LEU 27 -8.780 -2.392 3.498
198 HA LEU 27 HA LEU 27 -9.218 -2.941 0.622
199 HB2 LEU 27 HB2 LEU 27 -7.790 -0.568 1.861
200 HB3 LEU 27 HB3 LEU 27 -7.866 -0.919 0.137
201 HG LEU 27 HG LEU 27 -10.329 -0.514 1.862
202 HD11 LEU 27 HD11 LEU 27 -9.008 1.552 1.821
203 HD12 LEU 27 HD12 LEU 27 -10.434 1.734 0.800
204 HD13 LEU 27 HD13 LEU 27 -8.858 1.442 0.068
205 HD21 LEU 27 HD21 LEU 27 -10.793 -1.756 -0.176
206 HD22 LEU 27 HD22 LEU 27 -9.841 -0.621 -1.135
207 HD23 LEU 27 HD23 LEU 27 -11.364 -0.103 -0.408
208 H PHE 28 H PHE 28 -7.382 -3.553 -0.579
209 HA PHE 28 HA PHE 28 -5.400 -5.036 0.916
210 HB2 PHE 28 HB2 PHE 28 -5.815 -4.545 -2.042
211 HB3 PHE 28 HB3 PHE 28 -4.498 -5.529 -1.399
212 HD1 PHE 28 HD1 PHE 28 -8.159 -5.264 -1.814
213 HD2 PHE 28 HD2 PHE 28 -4.918 -7.698 -0.394
214 HE1 PHE 28 HE1 PHE 28 -9.691 -7.206 -1.649
215 HE2 PHE 28 HE2 PHE 28 -6.450 -9.642 -0.228
216 HZ PHE 28 HZ PHE 28 -8.837 -9.396 -0.855
217 H VAL 29 H VAL 29 -3.363 -4.410 1.402
218 HA VAL 29 HA VAL 29 -2.276 -1.987 0.111
219 HB VAL 29 HB VAL 29 -2.282 -2.567 3.085
220 HG11 VAL 29 HG11 VAL 29 -0.970 -0.404 1.431
221 HG12 VAL 29 HG12 VAL 29 -0.202 -1.489 2.589
222 HG13 VAL 29 HG13 VAL 29 -1.275 -0.209 3.158
223 HG21 VAL 29 HG21 VAL 29 -3.766 -0.717 3.305
224 HG22 VAL 29 HG22 VAL 29 -4.417 -1.676 1.976
225 HG23 VAL 29 HG23 VAL 29 -3.498 -0.210 1.638
226 H HIS 30 H HIS 30 -0.166 -2.116 -0.449
227 HA HIS 30 HA HIS 30 1.300 -4.567 0.323
228 HB2 HIS 30 HB2 HIS 30 1.463 -2.859 -2.168
229 HB3 HIS 30 HB3 HIS 30 2.600 -4.158 -1.790
230 HD2 HIS 30 HD2 HIS 30 -1.023 -3.732 -3.153
231 HE1 HIS 30 HE1 HIS 30 -0.332 -7.871 -2.704
232 HE2 HIS 30 HE2 HIS 30 -1.922 -6.132 -3.647
233 H HIS 31 H HIS 31 3.461 -4.448 0.843
234 HA HIS 31 HA HIS 31 4.292 -2.213 2.380
235 HB2 HIS 31 HB2 HIS 31 5.026 -4.566 2.776
236 HB3 HIS 31 HB3 HIS 31 6.010 -4.470 1.317
237 HD2 HIS 31 HD2 HIS 31 6.138 -3.262 5.035
238 HE1 HIS 31 HE1 HIS 31 9.595 -1.805 3.102
239 HE2 HIS 31 HE2 HIS 31 8.445 -2.085 5.348
240 H SER 32 H SER 32 5.311 -3.384 -0.813
241 HA SER 32 HA SER 32 7.359 -1.521 -1.277
242 HB2 SER 32 HB2 SER 32 5.615 -3.047 -3.209
243 HB3 SER 32 HB3 SER 32 7.038 -2.121 -3.683
244 HG SER 32 HG SER 32 6.856 -4.401 -2.019
245 H GLU 33 H GLU 33 3.913 -1.101 -1.525
246 HA GLU 33 HA GLU 33 3.929 1.050 -3.395
247 HB2 GLU 33 HB2 GLU 33 1.889 0.117 -1.382
248 HB3 GLU 33 HB3 GLU 33 1.604 1.470 -2.477
249 HG2 GLU 33 HG2 GLU 33 2.036 0.006 -4.411
250 HG3 GLU 33 HG3 GLU 33 2.338 -1.348 -3.326
251 H ILE 34 H ILE 34 4.780 0.981 -0.057
252 HA ILE 34 HA ILE 34 3.921 3.437 0.900
253 HB ILE 34 HB ILE 34 5.825 3.421 2.427
254 HG12 ILE 34 HG12 ILE 34 6.936 1.091 0.816
255 HG13 ILE 34 HG13 ILE 34 7.520 2.738 0.653
256 HG21 ILE 34 HG21 ILE 34 4.453 0.797 1.846
257 HG22 ILE 34 HG22 ILE 34 4.141 1.945 3.146
258 HG23 ILE 34 HG23 ILE 34 5.590 0.942 3.186
259 HD11 ILE 34 HD11 ILE 34 8.226 2.793 2.966
260 HD12 ILE 34 HD12 ILE 34 8.884 1.330 2.233
261 HD13 ILE 34 HD13 ILE 34 7.469 1.231 3.281
262 H GLN 35 H GLN 35 5.293 5.398 1.312
263 HA GLN 35 HA GLN 35 6.232 6.461 -1.219
264 HB2 GLN 35 HB2 GLN 35 5.894 7.660 1.536
265 HB3 GLN 35 HB3 GLN 35 6.564 8.558 0.175
266 HG2 GLN 35 HG2 GLN 35 3.866 7.179 0.110
267 HG3 GLN 35 HG3 GLN 35 4.084 8.884 0.503
268 HE21 GLN 35 HE21 GLN 35 3.336 6.893 -2.058
269 HE22 GLN 35 HE22 GLN 35 3.873 7.870 -3.334
270 H SER 36 H SER 36 8.314 7.742 -1.248
271 HA SER 36 HA SER 36 10.495 6.041 -0.620
272 HB2 SER 36 HB2 SER 36 11.896 7.810 -1.476
273 HB3 SER 36 HB3 SER 36 10.447 7.737 -2.475
274 HG SER 36 HG SER 36 11.367 9.723 -0.845
275 H GLY 37 H GLY 37 12.265 6.454 0.817
276 HA2 GLY 37 HA2 GLY 37 13.268 7.136 2.793
277 HA3 GLY 37 HA3 GLY 37 12.069 8.422 2.915
278 H GLY 38 H GLY 38 12.367 7.552 5.267
279 HA2 GLY 38 HA2 GLY 38 11.328 6.590 7.086
280 HA3 GLY 38 HA3 GLY 38 9.965 6.263 6.022
281 H GLU 39 H GLU 39 13.264 5.065 5.584
282 HA GLU 39 HA GLU 39 12.480 2.413 5.067
283 HB2 GLU 39 HB2 GLU 39 15.134 3.598 5.896
284 HB3 GLU 39 HB3 GLU 39 14.931 1.901 5.458
285 HG2 GLU 39 HG2 GLU 39 14.166 2.493 3.243
286 HG3 GLU 39 HG3 GLU 39 14.111 4.199 3.664
287 H TYR 40 H TYR 40 13.582 3.992 8.040
288 HA TYR 40 HA TYR 40 13.770 1.668 9.655
289 HB2 TYR 40 HB2 TYR 40 13.203 4.545 10.392
290 HB3 TYR 40 HB3 TYR 40 13.538 3.267 11.558
291 HD1 TYR 40 HD1 TYR 40 14.959 5.427 8.950
292 HD2 TYR 40 HD2 TYR 40 15.758 2.205 11.675
293 HE1 TYR 40 HE1 TYR 40 17.393 5.733 8.596
294 HE2 TYR 40 HE2 TYR 40 18.194 2.511 11.322
295 HH TYR 40 HH TYR 40 19.486 4.195 8.804
296 H ALA 41 H ALA 41 11.122 3.880 8.907
297 HA ALA 41 HA ALA 41 9.247 3.092 10.797
298 HB1 ALA 41 HB1 ALA 41 8.512 3.731 7.945
299 HB2 ALA 41 HB2 ALA 41 9.099 4.969 9.053
300 HB3 ALA 41 HB3 ALA 41 7.613 4.094 9.418
301 H THR 42 H THR 42 7.942 1.430 11.064
302 HA THR 42 HA THR 42 7.836 -0.686 8.993
303 HB THR 42 HB THR 42 7.811 -2.360 10.799
304 HG1 THR 42 HG1 THR 42 6.997 -1.176 12.477
305 HG21 THR 42 HG21 THR 42 9.973 -1.484 9.737
306 HG22 THR 42 HG22 THR 42 10.137 -2.311 11.286
307 HG23 THR 42 HG23 THR 42 10.191 -0.549 11.216
308 H LEU 43 H LEU 43 5.946 -2.221 9.440
309 HA LEU 43 HA LEU 43 3.619 -0.773 10.538
310 HB2 LEU 43 HB2 LEU 43 3.892 -2.076 7.839
311 HB3 LEU 43 HB3 LEU 43 2.325 -1.975 8.631
312 HG LEU 43 HG LEU 43 2.734 0.524 8.864
313 HD11 LEU 43 HD11 LEU 43 4.388 1.199 6.820
314 HD12 LEU 43 HD12 LEU 43 5.190 -0.273 7.361
315 HD13 LEU 43 HD13 LEU 43 4.934 1.059 8.485
316 HD21 LEU 43 HD21 LEU 43 1.175 -0.221 7.217
317 HD22 LEU 43 HD22 LEU 43 2.458 -0.828 6.170
318 HD23 LEU 43 HD23 LEU 43 2.239 0.909 6.379
319 H ALA 44 H ALA 44 2.127 -2.052 11.589
320 HA ALA 44 HA ALA 44 2.455 -4.963 11.592
321 HB1 ALA 44 HB1 ALA 44 2.411 -3.477 14.218
322 HB2 ALA 44 HB2 ALA 44 3.929 -3.835 13.396
323 HB3 ALA 44 HB3 ALA 44 2.873 -5.152 13.911
324 H ASP 45 H ASP 45 0.724 -5.155 14.046
325 HA ASP 45 HA ASP 45 -1.827 -4.797 12.708
326 HB2 ASP 45 HB2 ASP 45 -1.332 -6.875 13.940
327 HB3 ASP 45 HB3 ASP 45 -1.137 -5.952 15.423
328 H GLY 46 H GLY 46 -2.744 -2.830 12.790
329 HA2 GLY 46 HA2 GLY 46 -4.069 -1.274 14.036
330 HA3 GLY 46 HA3 GLY 46 -3.003 -1.510 15.412
331 H GLN 47 H GLN 47 -1.074 -1.216 12.695
332 HA GLN 47 HA GLN 47 -0.062 1.331 13.457
333 HB2 GLN 47 HB2 GLN 47 1.258 -0.492 12.368
334 HB3 GLN 47 HB3 GLN 47 0.389 -0.175 10.869
335 HG2 GLN 47 HG2 GLN 47 2.550 0.988 10.868
336 HG3 GLN 47 HG3 GLN 47 1.231 2.146 10.875
337 HE21 GLN 47 HE21 GLN 47 1.792 3.869 12.217
338 HE22 GLN 47 HE22 GLN 47 2.582 3.721 13.712
339 H THR 48 H THR 48 -0.657 3.316 12.855
340 HA THR 48 HA THR 48 -2.909 3.673 11.056
341 HB THR 48 HB THR 48 -1.266 5.736 12.559
342 HG1 THR 48 HG1 THR 48 -2.346 4.169 13.871
343 HG21 THR 48 HG21 THR 48 -3.983 5.858 11.213
344 HG22 THR 48 HG22 THR 48 -2.535 6.744 10.739
345 HG23 THR 48 HG23 THR 48 -3.336 7.119 12.264
346 H VAL 49 H VAL 49 -2.802 4.249 8.976
347 HA VAL 49 HA VAL 49 -0.354 5.510 7.947
348 HB VAL 49 HB VAL 49 -0.295 3.980 6.004
349 HG11 VAL 49 HG11 VAL 49 -0.143 2.546 8.671
350 HG12 VAL 49 HG12 VAL 49 1.119 3.589 8.014
351 HG13 VAL 49 HG13 VAL 49 0.696 2.089 7.189
352 HG21 VAL 49 HG21 VAL 49 -2.587 3.193 5.947
353 HG22 VAL 49 HG22 VAL 49 -2.444 2.520 7.571
354 HG23 VAL 49 HG23 VAL 49 -1.545 1.799 6.237
355 H GLU 50 H GLU 50 -0.620 6.231 5.663
356 HA GLU 50 HA GLU 50 -3.361 7.270 5.225
357 HB2 GLU 50 HB2 GLU 50 -0.706 8.431 4.308
358 HB3 GLU 50 HB3 GLU 50 -2.296 9.126 3.998
359 HG2 GLU 50 HG2 GLU 50 -2.653 9.382 6.435
360 HG3 GLU 50 HG3 GLU 50 -1.056 8.703 6.735
361 H TYR 51 H TYR 51 -4.308 6.847 3.249
362 HA TYR 51 HA TYR 51 -2.691 5.806 1.059
363 HB2 TYR 51 HB2 TYR 51 -3.994 3.733 0.838
364 HB3 TYR 51 HB3 TYR 51 -3.145 3.787 2.376
365 HD1 TYR 51 HD1 TYR 51 -6.421 3.921 0.720
366 HD2 TYR 51 HD2 TYR 51 -4.369 4.151 4.486
367 HE1 TYR 51 HE1 TYR 51 -8.578 3.644 1.910
368 HE2 TYR 51 HE2 TYR 51 -6.526 3.872 5.678
369 HH TYR 51 HH TYR 51 -9.168 4.447 4.852
370 H GLU 52 H GLU 52 -3.927 5.414 -0.900
371 HA GLU 52 HA GLU 52 -6.385 7.050 -1.065
372 HB2 GLU 52 HB2 GLU 52 -4.075 6.857 -3.011
373 HB3 GLU 52 HB3 GLU 52 -5.642 7.553 -3.432
374 HG2 GLU 52 HG2 GLU 52 -5.412 9.191 -1.605
375 HG3 GLU 52 HG3 GLU 52 -3.856 8.491 -1.167
376 H VAL 53 H VAL 53 -8.088 6.079 -1.966
377 HA VAL 53 HA VAL 53 -8.140 3.299 -2.404
378 HB VAL 53 HB VAL 53 -10.108 4.642 -1.741
379 HG11 VAL 53 HG11 VAL 53 -9.582 6.569 -3.302
380 HG12 VAL 53 HG12 VAL 53 -11.273 6.066 -3.285
381 HG13 VAL 53 HG13 VAL 53 -10.222 5.582 -4.617
382 HG21 VAL 53 HG21 VAL 53 -10.562 3.241 -4.393
383 HG22 VAL 53 HG22 VAL 53 -11.742 3.467 -3.100
384 HG23 VAL 53 HG23 VAL 53 -10.355 2.404 -2.854
385 H GLY 54 H GLY 54 -8.430 2.090 -4.279
386 HA2 GLY 54 HA2 GLY 54 -7.938 3.314 -6.891
387 HA3 GLY 54 HA3 GLY 54 -6.756 2.133 -6.328
388 H GLN 55 H GLN 55 -8.146 1.593 -8.639
389 HA GLN 55 HA GLN 55 -10.337 -0.214 -7.897
390 HB2 GLN 55 HB2 GLN 55 -10.816 -0.333 -10.304
391 HB3 GLN 55 HB3 GLN 55 -10.780 1.337 -9.742
392 HG2 GLN 55 HG2 GLN 55 -9.520 1.453 -11.710
393 HG3 GLN 55 HG3 GLN 55 -8.264 1.261 -10.494
394 HE21 GLN 55 HE21 GLN 55 -6.772 0.168 -11.917
395 HE22 GLN 55 HE22 GLN 55 -7.072 -1.393 -12.511
396 H GLY 56 H GLY 56 -10.408 -2.375 -8.566
397 HA2 GLY 56 HA2 GLY 56 -8.123 -3.672 -9.766
398 HA3 GLY 56 HA3 GLY 56 -8.297 -4.014 -8.047
399 H GLN 57 H GLN 57 -8.498 -5.948 -10.142
400 HA GLN 57 HA GLN 57 -11.169 -6.564 -10.848
401 HB2 GLN 57 HB2 GLN 57 -8.691 -8.277 -10.620
402 HB3 GLN 57 HB3 GLN 57 -10.232 -8.882 -11.230
403 HG2 GLN 57 HG2 GLN 57 -10.226 -7.274 -13.034
404 HG3 GLN 57 HG3 GLN 57 -8.816 -6.457 -12.365
405 HE21 GLN 57 HE21 GLN 57 -9.123 -7.807 -15.043
406 HE22 GLN 57 HE22 GLN 57 -7.892 -8.975 -15.098
407 H LYS 58 H LYS 58 -9.140 -7.521 -8.117
408 HA LYS 58 HA LYS 58 -11.276 -9.144 -6.963
409 HB2 LYS 58 HB2 LYS 58 -9.620 -9.712 -5.231
410 HB3 LYS 58 HB3 LYS 58 -8.980 -9.994 -6.849
411 HG2 LYS 58 HG2 LYS 58 -7.798 -7.820 -6.757
412 HG3 LYS 58 HG3 LYS 58 -8.425 -7.551 -5.131
413 HD2 LYS 58 HD2 LYS 58 -7.280 -9.591 -4.348
414 HD3 LYS 58 HD3 LYS 58 -6.652 -9.863 -5.974
415 HE2 LYS 58 HE2 LYS 58 -5.462 -7.705 -5.880
416 HE3 LYS 58 HE3 LYS 58 -6.091 -7.427 -4.256
417 HZ1 LYS 58 HZ1 LYS 58 -4.570 -9.872 -4.903
418 HZ2 LYS 58 HZ2 LYS 58 -4.841 -9.158 -3.385
419 HZ3 LYS 58 HZ3 LYS 58 -3.772 -8.434 -4.490
420 H GLY 59 H GLY 59 -11.395 -6.121 -7.227
421 HA2 GLY 59 HA2 GLY 59 -12.881 -4.829 -5.798
422 HA3 GLY 59 HA3 GLY 59 -12.076 -5.549 -4.403
423 HA PRO 60 HA PRO 60 -10.006 -1.465 -5.701
424 HB2 PRO 60 HB2 PRO 60 -10.628 0.097 -3.560
425 HB3 PRO 60 HB3 PRO 60 -11.668 -0.030 -4.992
426 HG2 PRO 60 HG2 PRO 60 -11.901 -1.414 -2.361
427 HG3 PRO 60 HG3 PRO 60 -13.155 -0.639 -3.342
428 HD2 PRO 60 HD2 PRO 60 -12.784 -3.338 -3.337
429 HD3 PRO 60 HD3 PRO 60 -13.349 -2.461 -4.779
430 H CYS 61 H CYS 61 -8.061 -0.679 -4.895
431 HA CYS 61 HA CYS 61 -6.957 -2.088 -2.537
432 HB2 CYS 61 HB2 CYS 61 -5.530 -1.206 -5.062
433 HB3 CYS 61 HB3 CYS 61 -4.768 -1.977 -3.673
434 HG CYS 61 HG CYS 61 -6.631 -3.986 -4.235
435 H ALA 62 H ALA 62 -4.768 -0.786 -1.932
436 HA ALA 62 HA ALA 62 -5.397 2.095 -1.858
437 HB1 ALA 62 HB1 ALA 62 -5.139 0.209 0.390
438 HB2 ALA 62 HB2 ALA 62 -5.897 1.799 0.335
439 HB3 ALA 62 HB3 ALA 62 -4.155 1.663 0.557
440 H ASN 63 H ASN 63 -3.611 3.447 -1.965
441 HA ASN 63 HA ASN 63 -0.947 2.182 -2.120
442 HB2 ASN 63 HB2 ASN 63 -0.448 3.522 -4.145
443 HB3 ASN 63 HB3 ASN 63 -1.740 2.357 -4.418
444 HD21 ASN 63 HD21 ASN 63 -3.216 3.359 -5.801
445 HD22 ASN 63 HD22 ASN 63 -3.812 4.935 -5.597
446 H LYS 64 H LYS 64 0.731 4.105 -2.490
447 HA LYS 64 HA LYS 64 1.816 5.855 -1.487
448 HB2 LYS 64 HB2 LYS 64 -1.000 6.973 -1.407
449 HB3 LYS 64 HB3 LYS 64 0.457 7.905 -1.053
450 HG2 LYS 64 HG2 LYS 64 1.324 7.412 -3.311
451 HG3 LYS 64 HG3 LYS 64 -0.135 6.485 -3.668
452 HD2 LYS 64 HD2 LYS 64 -1.509 8.503 -3.313
453 HD3 LYS 64 HD3 LYS 64 -0.051 9.434 -2.960
454 HE2 LYS 64 HE2 LYS 64 0.811 8.950 -5.218
455 HE3 LYS 64 HE3 LYS 64 -0.642 8.015 -5.575
456 HZ1 LYS 64 HZ1 LYS 64 -0.748 10.847 -4.722
457 HZ2 LYS 64 HZ2 LYS 64 -1.977 9.921 -5.444
458 HZ3 LYS 64 HZ3 LYS 64 -0.623 10.397 -6.352
459 H VAL 65 H VAL 65 1.600 3.801 0.142
460 HA VAL 65 HA VAL 65 0.245 4.334 2.610
461 HB VAL 65 HB VAL 65 2.473 2.375 1.976
462 HG11 VAL 65 HG11 VAL 65 0.543 2.501 4.318
463 HG12 VAL 65 HG12 VAL 65 2.284 2.777 4.395
464 HG13 VAL 65 HG13 VAL 65 1.664 1.176 3.996
465 HG21 VAL 65 HG21 VAL 65 -0.487 1.817 2.239
466 HG22 VAL 65 HG22 VAL 65 0.766 0.758 1.595
467 HG23 VAL 65 HG23 VAL 65 0.269 2.187 0.689
468 H VAL 66 H VAL 66 0.813 5.781 4.028
469 HA VAL 66 HA VAL 66 3.686 6.388 4.459
470 HB VAL 66 HB VAL 66 1.377 8.360 4.546
471 HG11 VAL 66 HG11 VAL 66 3.030 8.993 6.193
472 HG12 VAL 66 HG12 VAL 66 3.251 10.039 4.790
473 HG13 VAL 66 HG13 VAL 66 4.347 8.685 5.061
474 HG21 VAL 66 HG21 VAL 66 3.721 8.139 2.630
475 HG22 VAL 66 HG22 VAL 66 2.467 9.380 2.594
476 HG23 VAL 66 HG23 VAL 66 2.055 7.700 2.250
477 H ALA 67 H ALA 67 4.333 5.958 6.467
478 HA ALA 67 HA ALA 67 2.508 5.111 8.502
479 HB1 ALA 67 HB1 ALA 67 5.346 5.847 9.104
480 HB2 ALA 67 HB2 ALA 67 5.022 4.459 8.064
481 HB3 ALA 67 HB3 ALA 67 4.388 4.497 9.710
482 H VAL 68 H VAL 68 1.651 6.207 10.165
483 HA VAL 68 HA VAL 68 2.396 9.059 10.476
484 HB VAL 68 HB VAL 68 -0.248 7.735 11.174
485 HG11 VAL 68 HG11 VAL 68 0.514 10.668 10.998
486 HG12 VAL 68 HG12 VAL 68 0.370 9.766 12.507
487 HG13 VAL 68 HG13 VAL 68 -1.050 10.016 11.490
488 HG21 VAL 68 HG21 VAL 68 -1.149 8.862 9.202
489 HG22 VAL 68 HG22 VAL 68 0.200 7.838 8.708
490 HG23 VAL 68 HG23 VAL 68 0.423 9.581 8.857
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 -6.417 13.823 2.710
2 H2 MET 1 HT2 MET 1 -5.368 14.164 1.417
3 H3 MET 1 HT3 MET 1 -4.738 13.723 2.932
4 HA MET 1 HA MET 1 -6.078 12.040 0.916
5 HB2 MET 1 HB2 MET 1 -3.541 11.858 2.566
6 HB3 MET 1 HB3 MET 1 -4.129 10.557 1.529
7 HG2 MET 1 HG2 MET 1 -4.026 12.043 -0.425
8 HG3 MET 1 HG3 MET 1 -3.487 13.374 0.600
9 HE1 MET 1 HE1 MET 1 -1.832 13.618 -1.186
10 HE2 MET 1 HE2 MET 1 -1.751 12.097 -2.072
11 HE3 MET 1 HE3 MET 1 -0.299 12.745 -1.312
12 H SER 2 H SER 2 -6.806 9.957 1.563
13 HA SER 2 HA SER 2 -8.282 9.915 3.996
14 HB2 SER 2 HB2 SER 2 -7.636 7.694 2.045
15 HB3 SER 2 HB3 SER 2 -8.800 7.569 3.359
16 HG SER 2 HG SER 2 -8.861 9.189 1.047
17 H LYS 3 H LYS 3 -8.021 8.577 5.816
18 HA LYS 3 HA LYS 3 -5.436 7.228 6.163
19 HB2 LYS 3 HB2 LYS 3 -5.183 9.567 6.999
20 HB3 LYS 3 HB3 LYS 3 -6.492 9.267 8.140
21 HG2 LYS 3 HG2 LYS 3 -5.157 7.372 9.094
22 HG3 LYS 3 HG3 LYS 3 -3.832 7.808 8.013
23 HD2 LYS 3 HD2 LYS 3 -5.054 9.773 9.964
24 HD3 LYS 3 HD3 LYS 3 -3.683 8.749 10.383
25 HE2 LYS 3 HE2 LYS 3 -2.421 9.693 8.457
26 HE3 LYS 3 HE3 LYS 3 -3.780 10.762 8.113
27 HZ1 LYS 3 HZ1 LYS 3 -1.996 10.754 10.467
28 HZ2 LYS 3 HZ2 LYS 3 -3.521 11.502 10.516
29 HZ3 LYS 3 HZ3 LYS 3 -2.346 12.033 9.410
30 H GLY 4 H GLY 4 -5.722 5.309 7.053
31 HA2 GLY 4 HA2 GLY 4 -8.041 4.850 8.833
32 HA3 GLY 4 HA3 GLY 4 -7.636 3.716 7.546
33 H ILE 5 H ILE 5 -7.636 2.349 9.654
34 HA ILE 5 HA ILE 5 -4.881 2.363 10.755
35 HB ILE 5 HB ILE 5 -5.876 1.150 12.735
36 HG12 ILE 5 HG12 ILE 5 -8.530 2.231 11.748
37 HG13 ILE 5 HG13 ILE 5 -8.035 0.574 11.426
38 HG21 ILE 5 HG21 ILE 5 -6.812 3.243 13.726
39 HG22 ILE 5 HG22 ILE 5 -6.836 3.960 12.115
40 HG23 ILE 5 HG23 ILE 5 -5.301 3.517 12.861
41 HD11 ILE 5 HD11 ILE 5 -9.360 0.550 13.443
42 HD12 ILE 5 HD12 ILE 5 -8.425 1.875 14.134
43 HD13 ILE 5 HD13 ILE 5 -7.681 0.291 13.918
44 H VAL 6 H VAL 6 -3.670 0.658 10.413
45 HA VAL 6 HA VAL 6 -4.527 -1.389 8.658
46 HB VAL 6 HB VAL 6 -2.034 -1.253 10.375
47 HG11 VAL 6 HG11 VAL 6 -2.203 -3.507 9.659
48 HG12 VAL 6 HG12 VAL 6 -1.169 -2.757 8.444
49 HG13 VAL 6 HG13 VAL 6 -2.872 -3.050 8.094
50 HG21 VAL 6 HG21 VAL 6 -2.415 -0.531 7.451
51 HG22 VAL 6 HG22 VAL 6 -0.958 -0.305 8.419
52 HG23 VAL 6 HG23 VAL 6 -2.399 0.654 8.757
53 H LYS 7 H LYS 7 -5.591 -3.185 9.073
54 HA LYS 7 HA LYS 7 -6.397 -3.958 11.693
55 HB2 LYS 7 HB2 LYS 7 -7.689 -4.468 9.605
56 HB3 LYS 7 HB3 LYS 7 -6.436 -5.625 9.158
57 HG2 LYS 7 HG2 LYS 7 -6.854 -6.875 11.260
58 HG3 LYS 7 HG3 LYS 7 -8.133 -5.733 11.674
59 HD2 LYS 7 HD2 LYS 7 -8.140 -7.325 9.098
60 HD3 LYS 7 HD3 LYS 7 -8.901 -7.910 10.577
61 HE2 LYS 7 HE2 LYS 7 -10.285 -5.835 10.647
62 HE3 LYS 7 HE3 LYS 7 -9.573 -5.338 9.112
63 HZ1 LYS 7 HZ1 LYS 7 -11.524 -6.399 8.497
64 HZ2 LYS 7 HZ2 LYS 7 -11.364 -7.618 9.669
65 HZ3 LYS 7 HZ3 LYS 7 -10.361 -7.616 8.297
66 H TRP 8 H TRP 8 -4.038 -5.227 9.366
67 HA TRP 8 HA TRP 8 -2.289 -6.152 11.458
68 HB2 TRP 8 HB2 TRP 8 -4.144 -7.946 11.128
69 HB3 TRP 8 HB3 TRP 8 -3.334 -8.285 9.601
70 HD1 TRP 8 HD1 TRP 8 -0.955 -9.417 9.688
71 HE1 TRP 8 HE1 TRP 8 0.338 -10.615 11.571
72 HE3 TRP 8 HE3 TRP 8 -3.718 -7.953 13.724
73 HZ2 TRP 8 HZ2 TRP 8 0.213 -10.916 14.413
74 HZ3 TRP 8 HZ3 TRP 8 -3.113 -8.712 16.004
75 HH2 TRP 8 HH2 TRP 8 -1.154 -10.191 16.354
76 H PHE 9 H PHE 9 -0.280 -5.760 10.703
77 HA PHE 9 HA PHE 9 0.127 -5.763 7.758
78 HB2 PHE 9 HB2 PHE 9 0.608 -3.633 9.054
79 HB3 PHE 9 HB3 PHE 9 1.935 -4.501 9.823
80 HD1 PHE 9 HD1 PHE 9 0.678 -3.068 6.678
81 HD2 PHE 9 HD2 PHE 9 3.897 -5.219 8.543
82 HE1 PHE 9 HE1 PHE 9 2.108 -2.643 4.698
83 HE2 PHE 9 HE2 PHE 9 5.327 -4.788 6.562
84 HZ PHE 9 HZ PHE 9 4.433 -3.502 4.641
85 H ASN 10 H ASN 10 1.236 -7.432 6.920
86 HA ASN 10 HA ASN 10 3.199 -8.824 8.652
87 HB2 ASN 10 HB2 ASN 10 1.188 -10.000 6.729
88 HB3 ASN 10 HB3 ASN 10 2.580 -10.901 7.324
89 HD21 ASN 10 HD21 ASN 10 -0.192 -11.605 7.895
90 HD22 ASN 10 HD22 ASN 10 -0.412 -11.461 9.572
91 H SER 11 H SER 11 4.990 -7.745 7.822
92 HA SER 11 HA SER 11 5.522 -7.309 5.092
93 HB2 SER 11 HB2 SER 11 7.818 -6.887 5.818
94 HB3 SER 11 HB3 SER 11 6.679 -6.132 6.928
95 HG SER 11 HG SER 11 8.433 -8.228 7.310
96 H ASP 12 H ASP 12 6.122 -10.078 7.200
97 HA ASP 12 HA ASP 12 7.979 -11.470 5.604
98 HB2 ASP 12 HB2 ASP 12 5.837 -12.461 7.499
99 HB3 ASP 12 HB3 ASP 12 7.004 -13.530 6.727
100 H LYS 13 H LYS 13 4.437 -11.447 5.616
101 HA LYS 13 HA LYS 13 4.168 -13.269 3.404
102 HB2 LYS 13 HB2 LYS 13 2.229 -11.364 4.735
103 HB3 LYS 13 HB3 LYS 13 1.785 -12.470 3.438
104 HG2 LYS 13 HG2 LYS 13 2.534 -14.384 4.800
105 HG3 LYS 13 HG3 LYS 13 2.978 -13.280 6.105
106 HD2 LYS 13 HD2 LYS 13 0.635 -12.527 6.272
107 HD3 LYS 13 HD3 LYS 13 0.188 -13.630 4.967
108 HE2 LYS 13 HE2 LYS 13 0.930 -15.549 6.326
109 HE3 LYS 13 HE3 LYS 13 1.386 -14.454 7.629
110 HZ1 LYS 13 HZ1 LYS 13 -1.032 -13.656 7.448
111 HZ2 LYS 13 HZ2 LYS 13 -0.724 -15.136 8.223
112 HZ3 LYS 13 HZ3 LYS 13 -1.307 -15.114 6.627
113 H GLY 14 H GLY 14 4.580 -9.845 3.834
114 HA2 GLY 14 HA2 GLY 14 5.369 -8.348 2.190
115 HA3 GLY 14 HA3 GLY 14 4.820 -9.457 0.943
116 H PHE 15 H PHE 15 2.394 -9.053 3.280
117 HA PHE 15 HA PHE 15 1.271 -6.616 2.202
118 HB2 PHE 15 HB2 PHE 15 -0.790 -7.652 1.333
119 HB3 PHE 15 HB3 PHE 15 0.636 -8.150 0.425
120 HD1 PHE 15 HD1 PHE 15 -1.919 -9.213 2.874
121 HD2 PHE 15 HD2 PHE 15 1.446 -10.436 0.499
122 HE1 PHE 15 HE1 PHE 15 -2.475 -11.588 3.312
123 HE2 PHE 15 HE2 PHE 15 0.890 -12.812 0.940
124 HZ PHE 15 HZ PHE 15 -1.069 -13.389 2.345
125 H GLY 16 H GLY 16 -1.035 -6.320 3.048
126 HA2 GLY 16 HA2 GLY 16 -1.666 -7.640 5.545
127 HA3 GLY 16 HA3 GLY 16 -1.115 -5.976 5.728
128 H PHE 17 H PHE 17 -3.571 -6.430 6.607
129 HA PHE 17 HA PHE 17 -5.392 -5.439 4.485
130 HB2 PHE 17 HB2 PHE 17 -6.022 -7.040 6.983
131 HB3 PHE 17 HB3 PHE 17 -7.229 -6.373 5.884
132 HD1 PHE 17 HD1 PHE 17 -4.631 -8.933 6.336
133 HD2 PHE 17 HD2 PHE 17 -7.507 -7.265 3.614
134 HE1 PHE 17 HE1 PHE 17 -4.407 -10.927 4.878
135 HE2 PHE 17 HE2 PHE 17 -7.283 -9.258 2.157
136 HZ PHE 17 HZ PHE 17 -5.734 -11.090 2.788
137 H ILE 18 H ILE 18 -6.434 -3.521 4.853
138 HA ILE 18 HA ILE 18 -5.893 -2.218 7.442
139 HB ILE 18 HB ILE 18 -4.751 -1.130 5.566
140 HG12 ILE 18 HG12 ILE 18 -7.062 0.637 6.391
141 HG13 ILE 18 HG13 ILE 18 -5.793 0.170 7.528
142 HG21 ILE 18 HG21 ILE 18 -6.277 0.089 3.890
143 HG22 ILE 18 HG22 ILE 18 -7.555 -0.994 4.439
144 HG23 ILE 18 HG23 ILE 18 -6.106 -1.654 3.682
145 HD11 ILE 18 HD11 ILE 18 -5.347 1.581 4.880
146 HD12 ILE 18 HD12 ILE 18 -4.091 1.132 6.030
147 HD13 ILE 18 HD13 ILE 18 -5.288 2.350 6.466
148 H THR 19 H THR 19 -7.449 -1.061 8.476
149 HA THR 19 HA THR 19 -10.207 -1.737 7.733
150 HB THR 19 HB THR 19 -9.085 -0.862 10.399
151 HG1 THR 19 HG1 THR 19 -8.633 -2.879 10.670
152 HG21 THR 19 HG21 THR 19 -11.300 -1.862 11.191
153 HG22 THR 19 HG22 THR 19 -11.806 -1.842 9.502
154 HG23 THR 19 HG23 THR 19 -11.419 -0.330 10.325
155 HA PRO 20 HA PRO 20 -10.306 2.743 6.568
156 HB2 PRO 20 HB2 PRO 20 -13.177 1.949 6.209
157 HB3 PRO 20 HB3 PRO 20 -12.139 2.906 5.136
158 HG2 PRO 20 HG2 PRO 20 -12.684 0.416 4.529
159 HG3 PRO 20 HG3 PRO 20 -11.033 1.035 4.326
160 HD2 PRO 20 HD2 PRO 20 -12.123 -0.739 6.487
161 HD3 PRO 20 HD3 PRO 20 -10.541 -0.795 5.672
162 H GLU 21 H GLU 21 -10.588 4.378 8.014
163 HA GLU 21 HA GLU 21 -11.716 3.981 10.573
164 HB2 GLU 21 HB2 GLU 21 -11.399 6.399 10.888
165 HB3 GLU 21 HB3 GLU 21 -9.979 5.662 10.151
166 HG2 GLU 21 HG2 GLU 21 -10.719 6.425 7.928
167 HG3 GLU 21 HG3 GLU 21 -12.168 7.126 8.638
168 H ASP 22 H ASP 22 -13.078 5.161 7.576
169 HA ASP 22 HA ASP 22 -15.430 6.356 8.642
170 HB2 ASP 22 HB2 ASP 22 -14.750 5.262 5.911
171 HB3 ASP 22 HB3 ASP 22 -16.288 6.037 6.275
172 H GLY 23 H GLY 23 -14.500 3.066 8.167
173 HA2 GLY 23 HA2 GLY 23 -15.747 1.298 9.238
174 HA3 GLY 23 HA3 GLY 23 -17.226 2.183 8.883
175 H SER 24 H SER 24 -15.099 2.284 6.248
176 HA SER 24 HA SER 24 -16.802 0.661 4.620
177 HB2 SER 24 HB2 SER 24 -14.122 1.943 4.048
178 HB3 SER 24 HB3 SER 24 -15.133 1.155 2.846
179 HG SER 24 HG SER 24 -15.279 3.598 3.381
180 H LYS 25 H LYS 25 -15.846 -1.055 3.199
181 HA LYS 25 HA LYS 25 -14.913 -3.211 4.764
182 HB2 LYS 25 HB2 LYS 25 -15.035 -2.839 1.765
183 HB3 LYS 25 HB3 LYS 25 -14.633 -4.364 2.555
184 HG2 LYS 25 HG2 LYS 25 -16.814 -4.236 3.789
185 HG3 LYS 25 HG3 LYS 25 -17.221 -2.809 2.840
186 HD2 LYS 25 HD2 LYS 25 -16.500 -5.467 1.580
187 HD3 LYS 25 HD3 LYS 25 -18.157 -5.006 1.958
188 HE2 LYS 25 HE2 LYS 25 -17.893 -2.981 0.533
189 HE3 LYS 25 HE3 LYS 25 -16.265 -3.514 0.112
190 HZ1 LYS 25 HZ1 LYS 25 -18.771 -5.026 -0.405
191 HZ2 LYS 25 HZ2 LYS 25 -17.201 -5.540 -0.809
192 HZ3 LYS 25 HZ3 LYS 25 -17.872 -4.174 -1.565
193 H ASP 26 H ASP 26 -12.924 -4.299 4.770
194 HA ASP 26 HA ASP 26 -10.642 -2.713 4.902
195 HB2 ASP 26 HB2 ASP 26 -9.390 -4.795 5.099
196 HB3 ASP 26 HB3 ASP 26 -10.873 -4.885 6.041
197 H LEU 27 H LEU 27 -8.745 -2.655 3.636
198 HA LEU 27 HA LEU 27 -9.160 -3.233 0.762
199 HB2 LEU 27 HB2 LEU 27 -7.718 -0.876 2.005
200 HB3 LEU 27 HB3 LEU 27 -7.832 -1.209 0.280
201 HG LEU 27 HG LEU 27 -10.252 -0.804 2.064
202 HD11 LEU 27 HD11 LEU 27 -8.867 1.162 0.215
203 HD12 LEU 27 HD12 LEU 27 -8.861 1.240 1.978
204 HD13 LEU 27 HD13 LEU 27 -10.370 1.455 1.090
205 HD21 LEU 27 HD21 LEU 27 -9.835 -0.904 -0.942
206 HD22 LEU 27 HD22 LEU 27 -11.332 -0.361 -0.183
207 HD23 LEU 27 HD23 LEU 27 -10.785 -2.023 0.036
208 H PHE 28 H PHE 28 -7.343 -3.877 -0.431
209 HA PHE 28 HA PHE 28 -5.361 -5.339 1.079
210 HB2 PHE 28 HB2 PHE 28 -5.812 -4.929 -1.884
211 HB3 PHE 28 HB3 PHE 28 -4.503 -5.915 -1.230
212 HD1 PHE 28 HD1 PHE 28 -8.166 -5.596 -1.579
213 HD2 PHE 28 HD2 PHE 28 -4.938 -8.045 -0.156
214 HE1 PHE 28 HE1 PHE 28 -9.730 -7.503 -1.318
215 HE2 PHE 28 HE2 PHE 28 -6.501 -9.952 0.107
216 HZ PHE 28 HZ PHE 28 -8.896 -9.682 -0.474
217 H VAL 29 H VAL 29 -3.376 -4.698 1.613
218 HA VAL 29 HA VAL 29 -2.176 -2.383 0.226
219 HB VAL 29 HB VAL 29 -2.251 -2.880 3.216
220 HG11 VAL 29 HG11 VAL 29 -1.085 -0.620 3.289
221 HG12 VAL 29 HG12 VAL 29 -0.801 -0.801 1.558
222 HG13 VAL 29 HG13 VAL 29 -0.088 -1.948 2.692
223 HG21 VAL 29 HG21 VAL 29 -4.296 -1.878 2.018
224 HG22 VAL 29 HG22 VAL 29 -3.272 -0.475 1.716
225 HG23 VAL 29 HG23 VAL 29 -3.631 -0.963 3.371
226 H HIS 30 H HIS 30 -0.103 -2.692 -0.385
227 HA HIS 30 HA HIS 30 1.248 -5.165 0.514
228 HB2 HIS 30 HB2 HIS 30 1.590 -3.552 -2.027
229 HB3 HIS 30 HB3 HIS 30 2.558 -4.962 -1.595
230 HD2 HIS 30 HD2 HIS 30 -0.742 -4.197 -3.367
231 HE1 HIS 30 HE1 HIS 30 -0.912 -8.284 -2.324
232 HE2 HIS 30 HE2 HIS 30 -2.013 -6.454 -3.696
233 H HIS 31 H HIS 31 3.433 -5.116 1.065
234 HA HIS 31 HA HIS 31 4.337 -2.857 2.509
235 HB2 HIS 31 HB2 HIS 31 5.065 -5.215 2.927
236 HB3 HIS 31 HB3 HIS 31 6.013 -5.148 1.440
237 HD2 HIS 31 HD2 HIS 31 6.240 -3.900 5.132
238 HE1 HIS 31 HE1 HIS 31 9.648 -2.466 3.098
239 HE2 HIS 31 HE2 HIS 31 8.558 -2.724 5.375
240 H SER 32 H SER 32 5.304 -4.162 -0.650
241 HA SER 32 HA SER 32 7.200 -2.117 -1.238
242 HB2 SER 32 HB2 SER 32 7.212 -4.364 -2.287
243 HB3 SER 32 HB3 SER 32 5.743 -3.941 -3.158
244 HG SER 32 HG SER 32 8.348 -2.897 -3.399
245 H GLU 33 H GLU 33 3.888 -1.835 -1.015
246 HA GLU 33 HA GLU 33 3.266 -0.299 -3.330
247 HB2 GLU 33 HB2 GLU 33 1.611 -1.477 -1.845
248 HB3 GLU 33 HB3 GLU 33 1.881 -0.218 -0.643
249 HG2 GLU 33 HG2 GLU 33 -0.089 0.342 -1.967
250 HG3 GLU 33 HG3 GLU 33 1.196 1.491 -2.317
251 H ILE 34 H ILE 34 4.696 0.507 -0.229
252 HA ILE 34 HA ILE 34 4.208 3.322 -0.357
253 HB ILE 34 HB ILE 34 4.684 2.152 1.765
254 HG12 ILE 34 HG12 ILE 34 6.921 4.123 1.238
255 HG13 ILE 34 HG13 ILE 34 5.237 4.636 1.331
256 HG21 ILE 34 HG21 ILE 34 7.586 1.988 0.936
257 HG22 ILE 34 HG22 ILE 34 6.477 0.653 0.631
258 HG23 ILE 34 HG23 ILE 34 6.777 1.188 2.283
259 HD11 ILE 34 HD11 ILE 34 6.915 3.353 3.494
260 HD12 ILE 34 HD12 ILE 34 5.155 3.417 3.591
261 HD13 ILE 34 HD13 ILE 34 6.090 4.911 3.537
262 H GLN 35 H GLN 35 5.689 4.993 -0.830
263 HA GLN 35 HA GLN 35 7.975 4.225 -2.546
264 HB2 GLN 35 HB2 GLN 35 5.959 6.431 -3.028
265 HB3 GLN 35 HB3 GLN 35 7.443 6.211 -3.955
266 HG2 GLN 35 HG2 GLN 35 6.699 3.950 -4.612
267 HG3 GLN 35 HG3 GLN 35 5.209 4.176 -3.695
268 HE21 GLN 35 HE21 GLN 35 3.661 4.311 -5.372
269 HE22 GLN 35 HE22 GLN 35 3.728 5.456 -6.625
270 H SER 36 H SER 36 9.764 5.598 -2.496
271 HA SER 36 HA SER 36 11.328 6.928 -1.470
272 HB2 SER 36 HB2 SER 36 8.890 8.659 -0.980
273 HB3 SER 36 HB3 SER 36 10.564 9.191 -0.838
274 HG SER 36 HG SER 36 9.021 8.925 -3.036
275 H GLY 37 H GLY 37 10.285 4.814 0.097
276 HA2 GLY 37 HA2 GLY 37 9.628 5.672 2.749
277 HA3 GLY 37 HA3 GLY 37 10.107 4.046 2.268
278 H GLY 38 H GLY 38 10.970 5.310 4.651
279 HA2 GLY 38 HA2 GLY 38 13.707 4.766 4.664
280 HA3 GLY 38 HA3 GLY 38 13.534 6.504 4.441
281 H GLU 39 H GLU 39 14.752 6.324 6.573
282 HA GLU 39 HA GLU 39 14.823 6.618 8.847
283 HB2 GLU 39 HB2 GLU 39 11.910 7.353 8.425
284 HB3 GLU 39 HB3 GLU 39 12.848 7.696 9.879
285 HG2 GLU 39 HG2 GLU 39 14.430 9.043 8.533
286 HG3 GLU 39 HG3 GLU 39 13.466 8.720 7.092
287 H TYR 40 H TYR 40 14.399 3.969 7.924
288 HA TYR 40 HA TYR 40 13.809 1.874 8.659
289 HB2 TYR 40 HB2 TYR 40 13.704 3.365 11.293
290 HB3 TYR 40 HB3 TYR 40 13.678 1.610 11.137
291 HD1 TYR 40 HD1 TYR 40 15.727 4.645 10.853
292 HD2 TYR 40 HD2 TYR 40 15.652 0.382 10.326
293 HE1 TYR 40 HE1 TYR 40 18.204 4.618 10.709
294 HE2 TYR 40 HE2 TYR 40 18.128 0.356 10.183
295 HH TYR 40 HH TYR 40 20.038 1.996 11.123
296 H ALA 41 H ALA 41 11.700 3.455 7.580
297 HA ALA 41 HA ALA 41 9.349 3.515 9.104
298 HB1 ALA 41 HB1 ALA 41 9.450 4.663 6.984
299 HB2 ALA 41 HB2 ALA 41 8.183 3.442 6.882
300 HB3 ALA 41 HB3 ALA 41 9.750 3.150 6.127
301 H THR 42 H THR 42 8.000 2.006 9.801
302 HA THR 42 HA THR 42 7.942 -0.639 8.536
303 HB THR 42 HB THR 42 9.572 -0.836 10.362
304 HG1 THR 42 HG1 THR 42 7.120 -2.024 11.118
305 HG21 THR 42 HG21 THR 42 7.298 -0.021 12.198
306 HG22 THR 42 HG22 THR 42 8.657 1.021 11.768
307 HG23 THR 42 HG23 THR 42 8.938 -0.463 12.683
308 H LEU 43 H LEU 43 6.106 -1.973 9.368
309 HA LEU 43 HA LEU 43 3.876 -0.391 10.441
310 HB2 LEU 43 HB2 LEU 43 3.718 -2.069 7.931
311 HB3 LEU 43 HB3 LEU 43 2.349 -1.313 8.726
312 HG LEU 43 HG LEU 43 4.741 0.220 7.656
313 HD11 LEU 43 HD11 LEU 43 3.097 0.884 5.838
314 HD12 LEU 43 HD12 LEU 43 2.050 -0.412 6.416
315 HD13 LEU 43 HD13 LEU 43 3.644 -0.791 5.767
316 HD21 LEU 43 HD21 LEU 43 2.955 2.097 7.755
317 HD22 LEU 43 HD22 LEU 43 3.631 1.551 9.288
318 HD23 LEU 43 HD23 LEU 43 2.037 0.993 8.782
319 H ALA 44 H ALA 44 2.268 -1.670 11.477
320 HA ALA 44 HA ALA 44 2.764 -4.546 11.766
321 HB1 ALA 44 HB1 ALA 44 2.452 -2.894 14.261
322 HB2 ALA 44 HB2 ALA 44 4.045 -3.109 13.532
323 HB3 ALA 44 HB3 ALA 44 3.129 -4.512 14.080
324 H ASP 45 H ASP 45 0.962 -4.851 14.035
325 HA ASP 45 HA ASP 45 -1.551 -4.598 12.607
326 HB2 ASP 45 HB2 ASP 45 -2.460 -5.929 14.479
327 HB3 ASP 45 HB3 ASP 45 -1.055 -6.697 13.750
328 H GLY 46 H GLY 46 -2.714 -2.818 12.753
329 HA2 GLY 46 HA2 GLY 46 -4.118 -1.321 13.968
330 HA3 GLY 46 HA3 GLY 46 -3.062 -1.496 15.361
331 H GLN 47 H GLN 47 -0.978 -1.137 12.862
332 HA GLN 47 HA GLN 47 -0.115 1.441 13.555
333 HB2 GLN 47 HB2 GLN 47 1.240 -0.364 12.480
334 HB3 GLN 47 HB3 GLN 47 0.385 -0.056 10.972
335 HG2 GLN 47 HG2 GLN 47 2.535 1.120 11.003
336 HG3 GLN 47 HG3 GLN 47 1.207 2.267 10.980
337 HE21 GLN 47 HE21 GLN 47 1.728 4.004 12.325
338 HE22 GLN 47 HE22 GLN 47 2.499 3.870 13.831
339 H THR 48 H THR 48 -0.655 3.427 12.881
340 HA THR 48 HA THR 48 -2.945 3.764 11.124
341 HB THR 48 HB THR 48 -1.230 5.848 12.513
342 HG1 THR 48 HG1 THR 48 -3.646 4.561 13.253
343 HG21 THR 48 HG21 THR 48 -2.970 7.393 12.050
344 HG22 THR 48 HG22 THR 48 -4.096 6.114 11.598
345 HG23 THR 48 HG23 THR 48 -2.750 6.520 10.533
346 H VAL 49 H VAL 49 -2.876 4.274 9.029
347 HA VAL 49 HA VAL 49 -0.429 5.442 7.892
348 HB VAL 49 HB VAL 49 -0.457 3.835 6.008
349 HG11 VAL 49 HG11 VAL 49 0.954 3.524 8.086
350 HG12 VAL 49 HG12 VAL 49 0.609 2.037 7.200
351 HG13 VAL 49 HG13 VAL 49 -0.283 2.411 8.674
352 HG21 VAL 49 HG21 VAL 49 -1.747 1.698 6.352
353 HG22 VAL 49 HG22 VAL 49 -2.773 3.100 6.058
354 HG23 VAL 49 HG23 VAL 49 -2.583 2.476 7.696
355 H GLU 50 H GLU 50 -0.735 6.109 5.600
356 HA GLU 50 HA GLU 50 -3.484 7.131 5.165
357 HB2 GLU 50 HB2 GLU 50 -0.839 8.316 4.260
358 HB3 GLU 50 HB3 GLU 50 -2.433 8.971 3.888
359 HG2 GLU 50 HG2 GLU 50 -2.872 9.259 6.306
360 HG3 GLU 50 HG3 GLU 50 -1.264 8.633 6.666
361 H TYR 51 H TYR 51 -4.405 6.797 3.147
362 HA TYR 51 HA TYR 51 -2.812 5.649 0.996
363 HB2 TYR 51 HB2 TYR 51 -4.188 3.615 0.813
364 HB3 TYR 51 HB3 TYR 51 -3.325 3.673 2.346
365 HD1 TYR 51 HD1 TYR 51 -6.615 3.914 0.712
366 HD2 TYR 51 HD2 TYR 51 -4.514 4.081 4.454
367 HE1 TYR 51 HE1 TYR 51 -8.768 3.733 1.928
368 HE2 TYR 51 HE2 TYR 51 -6.668 3.897 5.671
369 HH TYR 51 HH TYR 51 -9.242 2.770 4.690
370 H GLU 52 H GLU 52 -4.070 5.216 -0.949
371 HA GLU 52 HA GLU 52 -6.413 7.010 -1.203
372 HB2 GLU 52 HB2 GLU 52 -4.300 6.331 -3.274
373 HB3 GLU 52 HB3 GLU 52 -5.724 7.328 -3.563
374 HG2 GLU 52 HG2 GLU 52 -3.549 7.950 -1.541
375 HG3 GLU 52 HG3 GLU 52 -3.696 8.700 -3.127
376 H VAL 53 H VAL 53 -8.244 6.095 -1.987
377 HA VAL 53 HA VAL 53 -8.224 3.217 -2.473
378 HB VAL 53 HB VAL 53 -10.526 5.198 -2.320
379 HG11 VAL 53 HG11 VAL 53 -10.588 2.164 -2.221
380 HG12 VAL 53 HG12 VAL 53 -11.021 3.118 -3.641
381 HG13 VAL 53 HG13 VAL 53 -11.977 3.251 -2.165
382 HG21 VAL 53 HG21 VAL 53 -10.852 4.400 -0.080
383 HG22 VAL 53 HG22 VAL 53 -9.143 4.803 -0.219
384 HG23 VAL 53 HG23 VAL 53 -9.660 3.119 -0.295
385 H GLY 54 H GLY 54 -7.832 2.486 -4.446
386 HA2 GLY 54 HA2 GLY 54 -8.962 3.941 -6.770
387 HA3 GLY 54 HA3 GLY 54 -7.351 3.228 -6.806
388 H GLN 55 H GLN 55 -10.501 2.745 -7.678
389 HA GLN 55 HA GLN 55 -11.059 0.077 -7.135
390 HB2 GLN 55 HB2 GLN 55 -11.796 1.781 -9.522
391 HB3 GLN 55 HB3 GLN 55 -12.482 0.185 -9.200
392 HG2 GLN 55 HG2 GLN 55 -13.293 0.977 -7.007
393 HG3 GLN 55 HG3 GLN 55 -12.616 2.571 -7.333
394 HE21 GLN 55 HE21 GLN 55 -14.497 3.832 -7.610
395 HE22 GLN 55 HE22 GLN 55 -15.707 3.484 -8.749
396 H GLY 56 H GLY 56 -10.675 -1.828 -8.159
397 HA2 GLY 56 HA2 GLY 56 -8.812 -1.885 -10.433
398 HA3 GLY 56 HA3 GLY 56 -8.421 -2.794 -8.974
399 H GLN 57 H GLN 57 -8.498 -4.437 -10.896
400 HA GLN 57 HA GLN 57 -10.971 -5.333 -11.915
401 HB2 GLN 57 HB2 GLN 57 -8.319 -6.725 -11.511
402 HB3 GLN 57 HB3 GLN 57 -9.684 -7.460 -12.355
403 HG2 GLN 57 HG2 GLN 57 -9.703 -5.704 -14.007
404 HG3 GLN 57 HG3 GLN 57 -8.518 -4.768 -13.098
405 HE21 GLN 57 HE21 GLN 57 -8.319 -5.885 -15.900
406 HE22 GLN 57 HE22 GLN 57 -6.925 -6.852 -15.893
407 H LYS 58 H LYS 58 -9.122 -6.285 -9.034
408 HA LYS 58 HA LYS 58 -11.116 -8.271 -8.277
409 HB2 LYS 58 HB2 LYS 58 -8.598 -7.298 -6.915
410 HB3 LYS 58 HB3 LYS 58 -9.643 -8.567 -6.275
411 HG2 LYS 58 HG2 LYS 58 -9.306 -9.886 -8.333
412 HG3 LYS 58 HG3 LYS 58 -8.258 -8.621 -8.975
413 HD2 LYS 58 HD2 LYS 58 -6.713 -8.933 -7.077
414 HD3 LYS 58 HD3 LYS 58 -7.758 -10.202 -6.436
415 HE2 LYS 58 HE2 LYS 58 -7.424 -11.525 -8.489
416 HE3 LYS 58 HE3 LYS 58 -6.385 -10.255 -9.139
417 HZ1 LYS 58 HZ1 LYS 58 -5.013 -11.926 -8.172
418 HZ2 LYS 58 HZ2 LYS 58 -5.897 -11.906 -6.722
419 HZ3 LYS 58 HZ3 LYS 58 -4.950 -10.566 -7.162
420 H GLY 59 H GLY 59 -10.418 -4.939 -7.628
421 HA2 GLY 59 HA2 GLY 59 -12.651 -3.959 -6.648
422 HA3 GLY 59 HA3 GLY 59 -12.128 -4.878 -5.240
423 HA PRO 60 HA PRO 60 -10.248 -0.474 -5.292
424 HB2 PRO 60 HB2 PRO 60 -11.294 -0.514 -2.503
425 HB3 PRO 60 HB3 PRO 60 -11.335 0.786 -3.710
426 HG2 PRO 60 HG2 PRO 60 -13.529 -0.554 -3.122
427 HG3 PRO 60 HG3 PRO 60 -13.166 -0.096 -4.797
428 HD2 PRO 60 HD2 PRO 60 -12.841 -2.780 -3.470
429 HD3 PRO 60 HD3 PRO 60 -13.462 -2.398 -5.094
430 H CYS 61 H CYS 61 -8.257 -0.026 -4.529
431 HA CYS 61 HA CYS 61 -7.071 -1.798 -2.481
432 HB2 CYS 61 HB2 CYS 61 -5.748 -0.804 -5.020
433 HB3 CYS 61 HB3 CYS 61 -4.962 -1.746 -3.755
434 HG CYS 61 HG CYS 61 -6.969 -3.581 -4.344
435 H ALA 62 H ALA 62 -4.966 -0.769 -1.609
436 HA ALA 62 HA ALA 62 -5.386 2.160 -1.367
437 HB1 ALA 62 HB1 ALA 62 -5.692 1.669 0.818
438 HB2 ALA 62 HB2 ALA 62 -3.941 1.471 0.868
439 HB3 ALA 62 HB3 ALA 62 -4.985 0.066 0.655
440 H ASN 63 H ASN 63 -3.796 3.377 -2.142
441 HA ASN 63 HA ASN 63 -1.104 2.180 -2.463
442 HB2 ASN 63 HB2 ASN 63 -2.476 4.246 -4.200
443 HB3 ASN 63 HB3 ASN 63 -0.844 3.623 -4.436
444 HD21 ASN 63 HD21 ASN 63 -3.587 3.339 -5.974
445 HD22 ASN 63 HD22 ASN 63 -3.653 1.674 -6.297
446 H LYS 64 H LYS 64 0.660 3.834 -2.568
447 HA LYS 64 HA LYS 64 1.889 5.490 -1.568
448 HB2 LYS 64 HB2 LYS 64 -0.793 6.895 -1.589
449 HB3 LYS 64 HB3 LYS 64 0.740 7.677 -1.206
450 HG2 LYS 64 HG2 LYS 64 1.612 7.048 -3.432
451 HG3 LYS 64 HG3 LYS 64 0.071 6.283 -3.817
452 HD2 LYS 64 HD2 LYS 64 -1.082 8.444 -3.549
453 HD3 LYS 64 HD3 LYS 64 0.449 9.215 -3.136
454 HE2 LYS 64 HE2 LYS 64 -0.051 9.616 -5.495
455 HE3 LYS 64 HE3 LYS 64 1.349 8.554 -5.365
456 HZ1 LYS 64 HZ1 LYS 64 -0.393 7.858 -7.006
457 HZ2 LYS 64 HZ2 LYS 64 -1.417 7.540 -5.688
458 HZ3 LYS 64 HZ3 LYS 64 0.037 6.679 -5.866
459 H VAL 65 H VAL 65 1.599 3.580 0.114
460 HA VAL 65 HA VAL 65 0.153 4.178 2.518
461 HB VAL 65 HB VAL 65 2.423 2.218 2.036
462 HG11 VAL 65 HG11 VAL 65 1.447 1.057 4.041
463 HG12 VAL 65 HG12 VAL 65 0.412 2.462 4.296
464 HG13 VAL 65 HG13 VAL 65 2.164 2.624 4.416
465 HG21 VAL 65 HG21 VAL 65 0.268 1.977 0.655
466 HG22 VAL 65 HG22 VAL 65 -0.540 1.613 2.179
467 HG23 VAL 65 HG23 VAL 65 0.763 0.573 1.598
468 H VAL 66 H VAL 66 0.683 5.675 3.922
469 HA VAL 66 HA VAL 66 3.548 6.281 4.415
470 HB VAL 66 HB VAL 66 1.252 8.273 4.366
471 HG11 VAL 66 HG11 VAL 66 3.099 9.951 4.639
472 HG12 VAL 66 HG12 VAL 66 4.215 8.616 4.926
473 HG13 VAL 66 HG13 VAL 66 2.888 8.915 6.050
474 HG21 VAL 66 HG21 VAL 66 3.657 7.979 2.536
475 HG22 VAL 66 HG22 VAL 66 2.401 9.212 2.412
476 HG23 VAL 66 HG23 VAL 66 2.005 7.519 2.116
477 H ALA 67 H ALA 67 4.125 5.856 6.437
478 HA ALA 67 HA ALA 67 2.212 5.168 8.461
479 HB1 ALA 67 HB1 ALA 67 4.084 4.621 9.813
480 HB2 ALA 67 HB2 ALA 67 5.154 5.680 8.893
481 HB3 ALA 67 HB3 ALA 67 4.552 4.189 8.169
482 H VAL 68 H VAL 68 1.515 6.325 10.184
483 HA VAL 68 HA VAL 68 2.644 9.009 10.644
484 HB VAL 68 HB VAL 68 0.356 9.934 10.905
485 HG11 VAL 68 HG11 VAL 68 1.633 10.101 8.758
486 HG12 VAL 68 HG12 VAL 68 -0.115 10.119 8.529
487 HG13 VAL 68 HG13 VAL 68 0.802 8.651 8.196
488 HG21 VAL 68 HG21 VAL 68 -0.615 7.388 9.578
489 HG22 VAL 68 HG22 VAL 68 -1.589 8.703 10.234
490 HG23 VAL 68 HG23 VAL 68 -0.700 7.637 11.322
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 -7.636 12.894 -0.056
2 H2 MET 1 HT2 MET 1 -7.918 11.254 -0.395
3 H3 MET 1 HT3 MET 1 -6.588 12.049 -1.088
4 HA MET 1 HA MET 1 -5.668 10.799 0.637
5 HB2 MET 1 HB2 MET 1 -6.207 13.645 1.527
6 HB3 MET 1 HB3 MET 1 -5.062 12.573 2.337
7 HG2 MET 1 HG2 MET 1 -3.758 12.339 0.296
8 HG3 MET 1 HG3 MET 1 -4.949 13.273 -0.611
9 HE1 MET 1 HE1 MET 1 -3.443 13.783 3.041
10 HE2 MET 1 HE2 MET 1 -2.031 14.741 2.602
11 HE3 MET 1 HE3 MET 1 -2.215 13.113 1.958
12 H SER 2 H SER 2 -5.929 9.652 2.508
13 HA SER 2 HA SER 2 -8.088 10.255 4.363
14 HB2 SER 2 HB2 SER 2 -9.213 8.123 4.109
15 HB3 SER 2 HB3 SER 2 -9.181 8.939 2.548
16 HG SER 2 HG SER 2 -7.814 7.487 1.808
17 H LYS 3 H LYS 3 -8.065 8.784 6.242
18 HA LYS 3 HA LYS 3 -5.463 7.437 6.640
19 HB2 LYS 3 HB2 LYS 3 -6.845 9.320 8.558
20 HB3 LYS 3 HB3 LYS 3 -5.490 8.285 8.994
21 HG2 LYS 3 HG2 LYS 3 -4.101 9.355 7.283
22 HG3 LYS 3 HG3 LYS 3 -5.450 10.394 6.815
23 HD2 LYS 3 HD2 LYS 3 -5.497 11.348 9.094
24 HD3 LYS 3 HD3 LYS 3 -4.142 10.316 9.552
25 HE2 LYS 3 HE2 LYS 3 -2.738 11.383 7.828
26 HE3 LYS 3 HE3 LYS 3 -4.091 12.413 7.361
27 HZ1 LYS 3 HZ1 LYS 3 -2.901 13.723 8.826
28 HZ2 LYS 3 HZ2 LYS 3 -2.529 12.430 9.862
29 HZ3 LYS 3 HZ3 LYS 3 -4.103 13.067 9.825
30 H GLY 4 H GLY 4 -5.700 5.416 7.249
31 HA2 GLY 4 HA2 GLY 4 -8.100 4.637 8.807
32 HA3 GLY 4 HA3 GLY 4 -7.530 3.670 7.447
33 H ILE 5 H ILE 5 -7.748 2.402 9.828
34 HA ILE 5 HA ILE 5 -4.990 2.322 10.902
35 HB ILE 5 HB ILE 5 -6.043 1.076 12.841
36 HG12 ILE 5 HG12 ILE 5 -8.652 2.240 11.827
37 HG13 ILE 5 HG13 ILE 5 -8.192 0.578 11.481
38 HG21 ILE 5 HG21 ILE 5 -5.420 3.478 12.907
39 HG22 ILE 5 HG22 ILE 5 -6.837 3.138 13.901
40 HG23 ILE 5 HG23 ILE 5 -7.030 3.898 12.322
41 HD11 ILE 5 HD11 ILE 5 -8.501 1.811 14.235
42 HD12 ILE 5 HD12 ILE 5 -7.950 0.163 13.927
43 HD13 ILE 5 HD13 ILE 5 -9.591 0.642 13.490
44 H VAL 6 H VAL 6 -3.763 0.695 10.394
45 HA VAL 6 HA VAL 6 -4.588 -1.343 8.653
46 HB VAL 6 HB VAL 6 -2.106 -1.206 10.382
47 HG11 VAL 6 HG11 VAL 6 -1.207 -2.664 8.441
48 HG12 VAL 6 HG12 VAL 6 -2.899 -2.971 8.059
49 HG13 VAL 6 HG13 VAL 6 -2.247 -3.452 9.625
50 HG21 VAL 6 HG21 VAL 6 -2.501 0.721 8.791
51 HG22 VAL 6 HG22 VAL 6 -2.482 -0.446 7.468
52 HG23 VAL 6 HG23 VAL 6 -1.039 -0.205 8.452
53 H LYS 7 H LYS 7 -5.593 -3.210 9.008
54 HA LYS 7 HA LYS 7 -6.408 -4.047 11.611
55 HB2 LYS 7 HB2 LYS 7 -7.630 -4.611 9.482
56 HB3 LYS 7 HB3 LYS 7 -6.312 -5.716 9.076
57 HG2 LYS 7 HG2 LYS 7 -6.724 -6.933 11.220
58 HG3 LYS 7 HG3 LYS 7 -8.098 -5.874 11.528
59 HD2 LYS 7 HD2 LYS 7 -7.862 -7.533 9.008
60 HD3 LYS 7 HD3 LYS 7 -8.654 -8.130 10.464
61 HE2 LYS 7 HE2 LYS 7 -10.186 -6.166 10.403
62 HE3 LYS 7 HE3 LYS 7 -9.428 -5.648 8.898
63 HZ1 LYS 7 HZ1 LYS 7 -10.881 -8.195 9.363
64 HZ2 LYS 7 HZ2 LYS 7 -10.052 -7.807 7.932
65 HZ3 LYS 7 HZ3 LYS 7 -11.402 -6.892 8.411
66 H TRP 8 H TRP 8 -3.969 -5.157 9.288
67 HA TRP 8 HA TRP 8 -2.104 -5.806 11.320
68 HB2 TRP 8 HB2 TRP 8 -1.955 -8.229 11.003
69 HB3 TRP 8 HB3 TRP 8 -3.524 -7.767 11.645
70 HD1 TRP 8 HD1 TRP 8 -5.634 -8.006 10.047
71 HE1 TRP 8 HE1 TRP 8 -6.021 -9.403 7.917
72 HE3 TRP 8 HE3 TRP 8 -0.801 -9.123 8.837
73 HZ2 TRP 8 HZ2 TRP 8 -4.482 -10.811 5.959
74 HZ3 TRP 8 HZ3 TRP 8 -0.292 -10.494 6.836
75 HH2 TRP 8 HH2 TRP 8 -2.125 -11.338 5.397
76 H PHE 9 H PHE 9 -0.097 -5.775 10.551
77 HA PHE 9 HA PHE 9 0.234 -5.811 7.594
78 HB2 PHE 9 HB2 PHE 9 0.628 -3.589 8.734
79 HB3 PHE 9 HB3 PHE 9 1.986 -4.341 9.574
80 HD1 PHE 9 HD1 PHE 9 0.699 -3.198 6.317
81 HD2 PHE 9 HD2 PHE 9 3.997 -5.033 8.371
82 HE1 PHE 9 HE1 PHE 9 2.136 -2.841 4.327
83 HE2 PHE 9 HE2 PHE 9 5.433 -4.674 6.383
84 HZ PHE 9 HZ PHE 9 4.504 -3.579 4.362
85 H ASN 10 H ASN 10 1.534 -7.343 6.775
86 HA ASN 10 HA ASN 10 3.581 -8.548 8.536
87 HB2 ASN 10 HB2 ASN 10 1.591 -9.994 6.788
88 HB3 ASN 10 HB3 ASN 10 3.075 -10.746 7.362
89 HD21 ASN 10 HD21 ASN 10 0.498 -11.732 8.141
90 HD22 ASN 10 HD22 ASN 10 0.303 -11.460 9.804
91 H SER 11 H SER 11 5.318 -7.547 7.615
92 HA SER 11 HA SER 11 5.712 -7.110 4.861
93 HB2 SER 11 HB2 SER 11 8.030 -6.644 5.479
94 HB3 SER 11 HB3 SER 11 6.929 -5.901 6.634
95 HG SER 11 HG SER 11 8.419 -8.299 6.902
96 H ASP 12 H ASP 12 6.458 -9.856 6.949
97 HA ASP 12 HA ASP 12 8.261 -11.226 5.274
98 HB2 ASP 12 HB2 ASP 12 6.215 -12.247 7.261
99 HB3 ASP 12 HB3 ASP 12 7.368 -13.299 6.442
100 H LYS 13 H LYS 13 4.724 -11.245 5.437
101 HA LYS 13 HA LYS 13 4.388 -13.067 3.232
102 HB2 LYS 13 HB2 LYS 13 2.474 -11.199 4.656
103 HB3 LYS 13 HB3 LYS 13 1.991 -12.322 3.382
104 HG2 LYS 13 HG2 LYS 13 2.802 -14.220 4.700
105 HG3 LYS 13 HG3 LYS 13 3.391 -13.128 5.954
106 HD2 LYS 13 HD2 LYS 13 1.292 -13.946 6.747
107 HD3 LYS 13 HD3 LYS 13 0.975 -12.306 6.174
108 HE2 LYS 13 HE2 LYS 13 0.114 -13.179 4.059
109 HE3 LYS 13 HE3 LYS 13 0.505 -14.826 4.549
110 HZ1 LYS 13 HZ1 LYS 13 -1.793 -14.448 4.973
111 HZ2 LYS 13 HZ2 LYS 13 -1.471 -13.002 5.805
112 HZ3 LYS 13 HZ3 LYS 13 -1.001 -14.492 6.473
113 H GLY 14 H GLY 14 4.734 -9.634 3.687
114 HA2 GLY 14 HA2 GLY 14 5.472 -8.113 2.042
115 HA3 GLY 14 HA3 GLY 14 4.920 -9.221 0.795
116 H PHE 15 H PHE 15 2.519 -8.849 3.172
117 HA PHE 15 HA PHE 15 1.381 -6.403 2.149
118 HB2 PHE 15 HB2 PHE 15 -0.655 -7.405 1.191
119 HB3 PHE 15 HB3 PHE 15 0.794 -7.859 0.296
120 HD1 PHE 15 HD1 PHE 15 -1.866 -9.034 2.550
121 HD2 PHE 15 HD2 PHE 15 1.671 -10.141 0.378
122 HE1 PHE 15 HE1 PHE 15 -2.417 -11.430 2.875
123 HE2 PHE 15 HE2 PHE 15 1.122 -12.536 0.705
124 HZ PHE 15 HZ PHE 15 -0.923 -13.181 1.951
125 H GLY 16 H GLY 16 -0.982 -6.203 2.916
126 HA2 GLY 16 HA2 GLY 16 -1.686 -7.593 5.338
127 HA3 GLY 16 HA3 GLY 16 -1.106 -5.953 5.624
128 H PHE 17 H PHE 17 -3.558 -6.273 6.430
129 HA PHE 17 HA PHE 17 -5.285 -5.145 4.297
130 HB2 PHE 17 HB2 PHE 17 -5.982 -7.011 6.572
131 HB3 PHE 17 HB3 PHE 17 -7.197 -6.109 5.665
132 HD1 PHE 17 HD1 PHE 17 -4.392 -8.527 5.286
133 HD2 PHE 17 HD2 PHE 17 -7.946 -6.878 3.544
134 HE1 PHE 17 HE1 PHE 17 -4.327 -10.266 3.519
135 HE2 PHE 17 HE2 PHE 17 -7.880 -8.607 1.769
136 HZ PHE 17 HZ PHE 17 -6.072 -10.302 1.757
137 H ILE 18 H ILE 18 -6.444 -3.322 4.787
138 HA ILE 18 HA ILE 18 -5.913 -2.147 7.439
139 HB ILE 18 HB ILE 18 -4.745 -0.979 5.625
140 HG12 ILE 18 HG12 ILE 18 -7.040 0.764 6.540
141 HG13 ILE 18 HG13 ILE 18 -5.783 0.223 7.655
142 HG21 ILE 18 HG21 ILE 18 -5.988 0.166 3.863
143 HG22 ILE 18 HG22 ILE 18 -7.517 -0.400 4.533
144 HG23 ILE 18 HG23 ILE 18 -6.383 -1.552 3.828
145 HD11 ILE 18 HD11 ILE 18 -5.051 2.351 6.863
146 HD12 ILE 18 HD12 ILE 18 -5.471 1.952 5.198
147 HD13 ILE 18 HD13 ILE 18 -4.098 1.165 5.972
148 H THR 19 H THR 19 -7.479 -1.036 8.512
149 HA THR 19 HA THR 19 -10.227 -1.674 7.704
150 HB THR 19 HB THR 19 -9.146 -0.881 10.411
151 HG1 THR 19 HG1 THR 19 -8.537 -2.874 10.470
152 HG21 THR 19 HG21 THR 19 -11.534 -0.378 10.148
153 HG22 THR 19 HG22 THR 19 -11.328 -1.768 11.213
154 HG23 THR 19 HG23 THR 19 -11.825 -2.007 9.540
155 HA PRO 20 HA PRO 20 -10.311 2.832 6.637
156 HB2 PRO 20 HB2 PRO 20 -13.177 2.011 6.296
157 HB3 PRO 20 HB3 PRO 20 -12.178 3.035 5.249
158 HG2 PRO 20 HG2 PRO 20 -12.660 0.569 4.540
159 HG3 PRO 20 HG3 PRO 20 -11.018 1.219 4.374
160 HD2 PRO 20 HD2 PRO 20 -12.095 -0.658 6.454
161 HD3 PRO 20 HD3 PRO 20 -10.506 -0.653 5.651
162 H GLU 21 H GLU 21 -10.604 4.463 8.066
163 HA GLU 21 HA GLU 21 -11.710 4.075 10.636
164 HB2 GLU 21 HB2 GLU 21 -11.377 6.484 10.944
165 HB3 GLU 21 HB3 GLU 21 -9.974 5.753 10.171
166 HG2 GLU 21 HG2 GLU 21 -10.732 6.538 7.977
167 HG3 GLU 21 HG3 GLU 21 -12.200 7.194 8.694
168 H ASP 22 H ASP 22 -13.192 4.910 7.631
169 HA ASP 22 HA ASP 22 -15.546 6.130 8.827
170 HB2 ASP 22 HB2 ASP 22 -14.939 5.353 5.969
171 HB3 ASP 22 HB3 ASP 22 -16.355 6.260 6.498
172 H GLY 23 H GLY 23 -14.526 2.968 8.539
173 HA2 GLY 23 HA2 GLY 23 -15.767 1.081 9.192
174 HA3 GLY 23 HA3 GLY 23 -17.250 1.967 8.871
175 H SER 24 H SER 24 -15.111 2.339 6.279
176 HA SER 24 HA SER 24 -16.744 0.794 4.513
177 HB2 SER 24 HB2 SER 24 -15.637 2.806 3.700
178 HB3 SER 24 HB3 SER 24 -14.061 2.124 4.070
179 HG SER 24 HG SER 24 -15.948 0.947 2.311
180 H LYS 25 H LYS 25 -15.814 -0.866 3.053
181 HA LYS 25 HA LYS 25 -14.878 -3.086 4.507
182 HB2 LYS 25 HB2 LYS 25 -14.942 -2.559 1.528
183 HB3 LYS 25 HB3 LYS 25 -14.550 -4.122 2.245
184 HG2 LYS 25 HG2 LYS 25 -16.741 -4.157 3.379
185 HG3 LYS 25 HG3 LYS 25 -17.137 -2.595 2.661
186 HD2 LYS 25 HD2 LYS 25 -16.927 -3.574 0.405
187 HD3 LYS 25 HD3 LYS 25 -16.532 -5.137 1.121
188 HE2 LYS 25 HE2 LYS 25 -18.724 -5.182 2.249
189 HE3 LYS 25 HE3 LYS 25 -19.122 -3.615 1.545
190 HZ1 LYS 25 HZ1 LYS 25 -19.189 -4.505 -0.589
191 HZ2 LYS 25 HZ2 LYS 25 -19.957 -5.687 0.359
192 HZ3 LYS 25 HZ3 LYS 25 -18.352 -5.911 -0.147
193 H ASP 26 H ASP 26 -12.878 -4.127 4.569
194 HA ASP 26 HA ASP 26 -10.608 -2.524 4.760
195 HB2 ASP 26 HB2 ASP 26 -9.349 -4.606 4.951
196 HB3 ASP 26 HB3 ASP 26 -10.838 -4.702 5.879
197 H LEU 27 H LEU 27 -8.691 -2.447 3.523
198 HA LEU 27 HA LEU 27 -9.073 -2.984 0.635
199 HB2 LEU 27 HB2 LEU 27 -7.597 -0.675 1.931
200 HB3 LEU 27 HB3 LEU 27 -7.708 -0.976 0.200
201 HG LEU 27 HG LEU 27 -10.123 -0.532 1.988
202 HD11 LEU 27 HD11 LEU 27 -8.690 1.402 0.140
203 HD12 LEU 27 HD12 LEU 27 -8.694 1.484 1.901
204 HD13 LEU 27 HD13 LEU 27 -10.191 1.730 1.002
205 HD21 LEU 27 HD21 LEU 27 -11.220 -0.083 -0.234
206 HD22 LEU 27 HD22 LEU 27 -10.665 -1.747 -0.055
207 HD23 LEU 27 HD23 LEU 27 -9.732 -0.606 -1.025
208 H PHE 28 H PHE 28 -7.282 -3.667 -0.543
209 HA PHE 28 HA PHE 28 -5.307 -5.175 0.933
210 HB2 PHE 28 HB2 PHE 28 -5.735 -4.669 -2.023
211 HB3 PHE 28 HB3 PHE 28 -4.445 -5.690 -1.386
212 HD1 PHE 28 HD1 PHE 28 -8.107 -5.307 -1.730
213 HD2 PHE 28 HD2 PHE 28 -4.909 -7.865 -0.435
214 HE1 PHE 28 HE1 PHE 28 -9.692 -7.207 -1.565
215 HE2 PHE 28 HE2 PHE 28 -6.495 -9.764 -0.267
216 HZ PHE 28 HZ PHE 28 -8.886 -9.435 -0.833
217 H VAL 29 H VAL 29 -3.338 -4.504 1.519
218 HA VAL 29 HA VAL 29 -2.143 -2.178 0.151
219 HB VAL 29 HB VAL 29 -2.276 -2.653 3.144
220 HG11 VAL 29 HG11 VAL 29 -1.151 -0.373 3.219
221 HG12 VAL 29 HG12 VAL 29 -0.827 -0.569 1.497
222 HG13 VAL 29 HG13 VAL 29 -0.120 -1.690 2.658
223 HG21 VAL 29 HG21 VAL 29 -3.665 -0.717 3.231
224 HG22 VAL 29 HG22 VAL 29 -4.317 -1.713 1.930
225 HG23 VAL 29 HG23 VAL 29 -3.319 -0.309 1.553
226 H HIS 30 H HIS 30 -0.056 -2.448 -0.417
227 HA HIS 30 HA HIS 30 1.318 -4.901 0.499
228 HB2 HIS 30 HB2 HIS 30 1.669 -3.277 -2.031
229 HB3 HIS 30 HB3 HIS 30 2.663 -4.662 -1.586
230 HD2 HIS 30 HD2 HIS 30 -0.614 -3.982 -3.424
231 HE1 HIS 30 HE1 HIS 30 -0.718 -8.066 -2.361
232 HE2 HIS 30 HE2 HIS 30 -1.827 -6.267 -3.769
233 H HIS 31 H HIS 31 3.529 -4.824 1.006
234 HA HIS 31 HA HIS 31 4.381 -2.594 2.522
235 HB2 HIS 31 HB2 HIS 31 5.168 -4.932 2.876
236 HB3 HIS 31 HB3 HIS 31 6.081 -4.827 1.372
237 HD2 HIS 31 HD2 HIS 31 6.337 -3.560 5.071
238 HE1 HIS 31 HE1 HIS 31 9.758 -2.205 3.009
239 HE2 HIS 31 HE2 HIS 31 8.668 -2.410 5.291
240 H SER 32 H SER 32 5.368 -3.754 -0.688
241 HA SER 32 HA SER 32 7.282 -1.757 -1.230
242 HB2 SER 32 HB2 SER 32 5.615 -3.450 -3.092
243 HB3 SER 32 HB3 SER 32 6.952 -2.430 -3.618
244 HG SER 32 HG SER 32 8.346 -3.661 -2.430
245 H GLU 33 H GLU 33 3.838 -1.589 -1.260
246 HA GLU 33 HA GLU 33 3.590 0.543 -3.169
247 HB2 GLU 33 HB2 GLU 33 1.833 -1.227 -2.392
248 HB3 GLU 33 HB3 GLU 33 1.518 -0.087 -1.085
249 HG2 GLU 33 HG2 GLU 33 -0.021 0.369 -2.914
250 HG3 GLU 33 HG3 GLU 33 1.125 1.696 -2.795
251 H ILE 34 H ILE 34 5.293 0.885 -0.533
252 HA ILE 34 HA ILE 34 3.917 3.195 0.622
253 HB ILE 34 HB ILE 34 5.677 3.200 2.318
254 HG12 ILE 34 HG12 ILE 34 6.872 0.796 0.889
255 HG13 ILE 34 HG13 ILE 34 7.506 2.424 0.712
256 HG21 ILE 34 HG21 ILE 34 4.328 0.571 1.687
257 HG22 ILE 34 HG22 ILE 34 3.898 1.768 2.909
258 HG23 ILE 34 HG23 ILE 34 5.324 0.757 3.130
259 HD11 ILE 34 HD11 ILE 34 7.953 2.557 3.110
260 HD12 ILE 34 HD12 ILE 34 8.729 1.120 2.445
261 HD13 ILE 34 HD13 ILE 34 7.229 0.969 3.359
262 H GLN 35 H GLN 35 5.221 5.166 1.062
263 HA GLN 35 HA GLN 35 6.183 6.297 -1.353
264 HB2 GLN 35 HB2 GLN 35 5.141 7.563 0.563
265 HB3 GLN 35 HB3 GLN 35 6.641 7.326 1.458
266 HG2 GLN 35 HG2 GLN 35 6.679 9.518 0.378
267 HG3 GLN 35 HG3 GLN 35 7.885 8.476 -0.370
268 HE21 GLN 35 HE21 GLN 35 7.888 8.816 -2.593
269 HE22 GLN 35 HE22 GLN 35 6.503 9.056 -3.544
270 H SER 36 H SER 36 8.273 6.845 -1.998
271 HA SER 36 HA SER 36 10.328 5.019 -1.517
272 HB2 SER 36 HB2 SER 36 10.316 6.445 -3.492
273 HB3 SER 36 HB3 SER 36 10.503 7.882 -2.492
274 HG SER 36 HG SER 36 12.352 6.006 -3.291
275 H GLY 37 H GLY 37 12.050 4.937 -0.151
276 HA2 GLY 37 HA2 GLY 37 13.521 5.583 1.546
277 HA3 GLY 37 HA3 GLY 37 12.687 7.132 1.648
278 H GLY 38 H GLY 38 12.966 6.602 4.029
279 HA2 GLY 38 HA2 GLY 38 11.916 6.161 6.038
280 HA3 GLY 38 HA3 GLY 38 10.462 5.783 5.118
281 H GLU 39 H GLU 39 13.642 4.238 4.874
282 HA GLU 39 HA GLU 39 12.645 1.611 4.807
283 HB2 GLU 39 HB2 GLU 39 15.384 2.699 5.473
284 HB3 GLU 39 HB3 GLU 39 15.040 0.974 5.329
285 HG2 GLU 39 HG2 GLU 39 14.341 1.238 3.030
286 HG3 GLU 39 HG3 GLU 39 14.427 2.991 3.152
287 H TYR 40 H TYR 40 13.838 3.586 7.495
288 HA TYR 40 HA TYR 40 13.876 1.581 9.487
289 HB2 TYR 40 HB2 TYR 40 13.373 4.555 9.707
290 HB3 TYR 40 HB3 TYR 40 13.645 3.485 11.081
291 HD1 TYR 40 HD1 TYR 40 15.184 5.121 8.171
292 HD2 TYR 40 HD2 TYR 40 15.835 2.434 11.458
293 HE1 TYR 40 HE1 TYR 40 17.637 5.313 7.845
294 HE2 TYR 40 HE2 TYR 40 18.285 2.625 11.131
295 HH TYR 40 HH TYR 40 19.745 4.979 9.520
296 H ALA 41 H ALA 41 11.332 3.737 8.317
297 HA ALA 41 HA ALA 41 9.381 3.275 10.251
298 HB1 ALA 41 HB1 ALA 41 8.595 3.514 7.374
299 HB2 ALA 41 HB2 ALA 41 9.436 4.860 8.142
300 HB3 ALA 41 HB3 ALA 41 7.898 4.294 8.795
301 H THR 42 H THR 42 8.003 1.700 10.673
302 HA THR 42 HA THR 42 7.811 -0.598 8.825
303 HB THR 42 HB THR 42 9.389 -1.179 10.617
304 HG1 THR 42 HG1 THR 42 6.949 -2.483 11.160
305 HG21 THR 42 HG21 THR 42 8.430 0.397 12.328
306 HG22 THR 42 HG22 THR 42 8.729 -1.227 12.946
307 HG23 THR 42 HG23 THR 42 7.088 -0.727 12.538
308 H LEU 43 H LEU 43 5.962 -2.108 9.612
309 HA LEU 43 HA LEU 43 3.695 -0.540 10.656
310 HB2 LEU 43 HB2 LEU 43 3.859 -2.015 8.046
311 HB3 LEU 43 HB3 LEU 43 2.326 -1.944 8.902
312 HG LEU 43 HG LEU 43 2.769 0.627 9.001
313 HD11 LEU 43 HD11 LEU 43 4.039 1.208 6.729
314 HD12 LEU 43 HD12 LEU 43 4.860 -0.316 7.061
315 HD13 LEU 43 HD13 LEU 43 4.926 0.999 8.233
316 HD21 LEU 43 HD21 LEU 43 2.026 -0.917 6.508
317 HD22 LEU 43 HD22 LEU 43 1.864 0.837 6.608
318 HD23 LEU 43 HD23 LEU 43 0.946 -0.196 7.701
319 H ALA 44 H ALA 44 2.128 -1.777 11.734
320 HA ALA 44 HA ALA 44 2.568 -4.655 12.063
321 HB1 ALA 44 HB1 ALA 44 2.849 -4.571 14.420
322 HB2 ALA 44 HB2 ALA 44 2.362 -2.879 14.499
323 HB3 ALA 44 HB3 ALA 44 3.921 -3.315 13.800
324 H ASP 45 H ASP 45 0.728 -4.721 14.422
325 HA ASP 45 HA ASP 45 -1.755 -4.571 12.936
326 HB2 ASP 45 HB2 ASP 45 -1.204 -5.465 15.775
327 HB3 ASP 45 HB3 ASP 45 -2.706 -5.705 14.887
328 H GLY 46 H GLY 46 -2.827 -2.696 12.841
329 HA2 GLY 46 HA2 GLY 46 -4.250 -1.074 13.830
330 HA3 GLY 46 HA3 GLY 46 -3.339 -1.214 15.325
331 H GLN 47 H GLN 47 -1.181 -0.986 12.760
332 HA GLN 47 HA GLN 47 -0.176 1.534 13.526
333 HB2 GLN 47 HB2 GLN 47 1.112 -0.301 12.438
334 HB3 GLN 47 HB3 GLN 47 0.271 0.043 10.930
335 HG2 GLN 47 HG2 GLN 47 2.466 1.137 10.968
336 HG3 GLN 47 HG3 GLN 47 1.181 2.334 10.945
337 HE21 GLN 47 HE21 GLN 47 1.787 4.047 12.283
338 HE22 GLN 47 HE22 GLN 47 2.538 3.878 13.797
339 H THR 48 H THR 48 -0.665 3.552 12.925
340 HA THR 48 HA THR 48 -2.939 4.064 11.224
341 HB THR 48 HB THR 48 -0.991 6.009 12.501
342 HG1 THR 48 HG1 THR 48 -2.592 6.103 14.116
343 HG21 THR 48 HG21 THR 48 -2.971 7.561 12.317
344 HG22 THR 48 HG22 THR 48 -3.769 6.337 11.329
345 HG23 THR 48 HG23 THR 48 -2.281 7.096 10.761
346 H VAL 49 H VAL 49 -2.942 4.633 9.118
347 HA VAL 49 HA VAL 49 -0.455 5.576 7.875
348 HB VAL 49 HB VAL 49 -0.646 3.955 6.014
349 HG11 VAL 49 HG11 VAL 49 -0.439 2.650 8.743
350 HG12 VAL 49 HG12 VAL 49 0.857 3.552 7.958
351 HG13 VAL 49 HG13 VAL 49 0.268 2.051 7.243
352 HG21 VAL 49 HG21 VAL 49 -2.800 2.761 7.789
353 HG22 VAL 49 HG22 VAL 49 -2.051 1.902 6.445
354 HG23 VAL 49 HG23 VAL 49 -2.994 3.360 6.141
355 H GLU 50 H GLU 50 -0.768 6.185 5.581
356 HA GLU 50 HA GLU 50 -3.433 7.405 5.142
357 HB2 GLU 50 HB2 GLU 50 -0.639 8.360 4.490
358 HB3 GLU 50 HB3 GLU 50 -2.037 8.973 3.608
359 HG2 GLU 50 HG2 GLU 50 -3.025 9.837 5.616
360 HG3 GLU 50 HG3 GLU 50 -1.830 9.029 6.629
361 H TYR 51 H TYR 51 -4.423 6.963 3.186
362 HA TYR 51 HA TYR 51 -2.882 5.742 1.033
363 HB2 TYR 51 HB2 TYR 51 -4.255 3.714 0.929
364 HB3 TYR 51 HB3 TYR 51 -3.400 3.818 2.464
365 HD1 TYR 51 HD1 TYR 51 -6.670 3.920 0.809
366 HD2 TYR 51 HD2 TYR 51 -4.609 4.399 4.547
367 HE1 TYR 51 HE1 TYR 51 -8.831 3.787 2.017
368 HE2 TYR 51 HE2 TYR 51 -6.769 4.264 5.754
369 HH TYR 51 HH TYR 51 -9.575 4.796 4.570
370 H GLU 52 H GLU 52 -4.129 5.339 -0.899
371 HA GLU 52 HA GLU 52 -6.487 7.114 -1.144
372 HB2 GLU 52 HB2 GLU 52 -4.456 7.964 -2.327
373 HB3 GLU 52 HB3 GLU 52 -4.413 6.472 -3.268
374 HG2 GLU 52 HG2 GLU 52 -6.647 6.963 -4.175
375 HG3 GLU 52 HG3 GLU 52 -6.725 8.436 -3.212
376 H VAL 53 H VAL 53 -8.305 6.125 -1.779
377 HA VAL 53 HA VAL 53 -8.317 3.283 -2.284
378 HB VAL 53 HB VAL 53 -10.067 4.369 -0.938
379 HG11 VAL 53 HG11 VAL 53 -10.085 6.472 -2.443
380 HG12 VAL 53 HG12 VAL 53 -11.623 5.915 -1.792
381 HG13 VAL 53 HG13 VAL 53 -11.198 5.566 -3.466
382 HG21 VAL 53 HG21 VAL 53 -11.980 3.231 -1.940
383 HG22 VAL 53 HG22 VAL 53 -10.530 2.251 -2.175
384 HG23 VAL 53 HG23 VAL 53 -11.177 3.205 -3.510
385 H GLY 54 H GLY 54 -7.688 2.526 -4.155
386 HA2 GLY 54 HA2 GLY 54 -8.430 3.917 -6.651
387 HA3 GLY 54 HA3 GLY 54 -7.100 2.768 -6.481
388 H GLN 55 H GLN 55 -8.416 1.913 -8.454
389 HA GLN 55 HA GLN 55 -10.366 -0.061 -7.419
390 HB2 GLN 55 HB2 GLN 55 -10.450 1.502 -10.010
391 HB3 GLN 55 HB3 GLN 55 -11.463 0.091 -9.687
392 HG2 GLN 55 HG2 GLN 55 -12.492 1.181 -7.790
393 HG3 GLN 55 HG3 GLN 55 -11.367 2.532 -7.894
394 HE21 GLN 55 HE21 GLN 55 -14.381 2.529 -8.144
395 HE22 GLN 55 HE22 GLN 55 -14.700 3.241 -9.651
396 H GLY 56 H GLY 56 -10.378 -2.094 -8.412
397 HA2 GLY 56 HA2 GLY 56 -8.322 -2.746 -10.383
398 HA3 GLY 56 HA3 GLY 56 -8.183 -3.521 -8.805
399 H GLN 57 H GLN 57 -8.476 -5.169 -10.908
400 HA GLN 57 HA GLN 57 -11.107 -5.769 -11.727
401 HB2 GLN 57 HB2 GLN 57 -8.619 -7.474 -11.521
402 HB3 GLN 57 HB3 GLN 57 -10.127 -8.042 -12.243
403 HG2 GLN 57 HG2 GLN 57 -10.064 -6.303 -13.914
404 HG3 GLN 57 HG3 GLN 57 -8.698 -5.522 -13.121
405 HE21 GLN 57 HE21 GLN 57 -8.878 -6.675 -15.909
406 HE22 GLN 57 HE22 GLN 57 -7.620 -7.812 -15.999
407 H LYS 58 H LYS 58 -9.149 -6.978 -9.018
408 HA LYS 58 HA LYS 58 -11.188 -8.788 -8.083
409 HB2 LYS 58 HB2 LYS 58 -8.736 -9.116 -7.685
410 HB3 LYS 58 HB3 LYS 58 -8.774 -7.735 -6.591
411 HG2 LYS 58 HG2 LYS 58 -10.431 -8.875 -5.176
412 HG3 LYS 58 HG3 LYS 58 -10.445 -10.249 -6.283
413 HD2 LYS 58 HD2 LYS 58 -8.043 -10.629 -5.842
414 HD3 LYS 58 HD3 LYS 58 -8.035 -9.264 -4.726
415 HE2 LYS 58 HE2 LYS 58 -9.713 -10.392 -3.316
416 HE3 LYS 58 HE3 LYS 58 -9.739 -11.756 -4.434
417 HZ1 LYS 58 HZ1 LYS 58 -8.268 -12.386 -2.758
418 HZ2 LYS 58 HZ2 LYS 58 -7.535 -10.855 -2.683
419 HZ3 LYS 58 HZ3 LYS 58 -7.253 -11.872 -4.014
420 H GLY 59 H GLY 59 -10.415 -5.430 -7.593
421 HA2 GLY 59 HA2 GLY 59 -12.651 -4.366 -6.689
422 HA3 GLY 59 HA3 GLY 59 -12.131 -5.200 -5.227
423 HA PRO 60 HA PRO 60 -10.236 -0.837 -5.482
424 HB2 PRO 60 HB2 PRO 60 -11.111 -0.818 -2.643
425 HB3 PRO 60 HB3 PRO 60 -11.224 0.458 -3.865
426 HG2 PRO 60 HG2 PRO 60 -13.367 -0.885 -3.111
427 HG3 PRO 60 HG3 PRO 60 -13.114 -0.429 -4.805
428 HD2 PRO 60 HD2 PRO 60 -12.727 -3.116 -3.500
429 HD3 PRO 60 HD3 PRO 60 -13.416 -2.733 -5.094
430 H CYS 61 H CYS 61 -8.402 -0.028 -4.370
431 HA CYS 61 HA CYS 61 -7.018 -1.825 -2.509
432 HB2 CYS 61 HB2 CYS 61 -4.952 -1.754 -3.827
433 HB3 CYS 61 HB3 CYS 61 -6.251 -2.479 -4.773
434 HG CYS 61 HG CYS 61 -5.934 -0.682 -6.438
435 H ALA 62 H ALA 62 -4.897 -0.673 -1.765
436 HA ALA 62 HA ALA 62 -5.412 2.241 -1.580
437 HB1 ALA 62 HB1 ALA 62 -4.040 1.641 0.732
438 HB2 ALA 62 HB2 ALA 62 -5.078 0.230 0.535
439 HB3 ALA 62 HB3 ALA 62 -5.787 1.842 0.612
440 H ASN 63 H ASN 63 -3.778 3.501 -2.196
441 HA ASN 63 HA ASN 63 -1.064 2.318 -2.366
442 HB2 ASN 63 HB2 ASN 63 -0.708 3.771 -4.359
443 HB3 ASN 63 HB3 ASN 63 -1.953 2.550 -4.611
444 HD21 ASN 63 HD21 ASN 63 -1.352 5.746 -5.215
445 HD22 ASN 63 HD22 ASN 63 -2.943 6.341 -5.210
446 H LYS 64 H LYS 64 0.567 4.283 -2.739
447 HA LYS 64 HA LYS 64 1.675 6.001 -1.692
448 HB2 LYS 64 HB2 LYS 64 -1.150 7.098 -1.558
449 HB3 LYS 64 HB3 LYS 64 0.300 8.034 -1.197
450 HG2 LYS 64 HG2 LYS 64 1.152 7.586 -3.476
451 HG3 LYS 64 HG3 LYS 64 -0.312 6.671 -3.838
452 HD2 LYS 64 HD2 LYS 64 -1.682 8.677 -3.448
453 HD3 LYS 64 HD3 LYS 64 -0.234 9.598 -3.045
454 HE2 LYS 64 HE2 LYS 64 -0.855 10.036 -5.369
455 HE3 LYS 64 HE3 LYS 64 0.659 9.136 -5.326
456 HZ1 LYS 64 HZ1 LYS 64 -0.446 7.148 -5.878
457 HZ2 LYS 64 HZ2 LYS 64 -1.056 8.322 -6.946
458 HZ3 LYS 64 HZ3 LYS 64 -1.980 7.820 -5.611
459 H VAL 65 H VAL 65 1.457 3.898 -0.105
460 HA VAL 65 HA VAL 65 0.127 4.385 2.385
461 HB VAL 65 HB VAL 65 2.324 2.412 1.700
462 HG11 VAL 65 HG11 VAL 65 1.447 1.161 3.676
463 HG12 VAL 65 HG12 VAL 65 0.401 2.533 4.042
464 HG13 VAL 65 HG13 VAL 65 2.152 2.718 4.115
465 HG21 VAL 65 HG21 VAL 65 0.643 0.843 1.188
466 HG22 VAL 65 HG22 VAL 65 0.076 2.320 0.412
467 HG23 VAL 65 HG23 VAL 65 -0.625 1.806 1.947
468 H VAL 66 H VAL 66 0.725 5.800 3.822
469 HA VAL 66 HA VAL 66 3.607 6.273 4.325
470 HB VAL 66 HB VAL 66 1.431 8.393 4.293
471 HG11 VAL 66 HG11 VAL 66 4.411 8.595 4.835
472 HG12 VAL 66 HG12 VAL 66 3.123 8.848 6.013
473 HG13 VAL 66 HG13 VAL 66 3.318 9.967 4.664
474 HG21 VAL 66 HG21 VAL 66 2.623 9.297 2.362
475 HG22 VAL 66 HG22 VAL 66 2.188 7.619 2.037
476 HG23 VAL 66 HG23 VAL 66 3.843 8.029 2.486
477 H ALA 67 H ALA 67 4.158 5.868 6.363
478 HA ALA 67 HA ALA 67 2.221 5.135 8.337
479 HB1 ALA 67 HB1 ALA 67 4.517 4.152 8.167
480 HB2 ALA 67 HB2 ALA 67 4.116 4.741 9.780
481 HB3 ALA 67 HB3 ALA 67 5.167 5.692 8.730
482 H VAL 68 H VAL 68 1.444 6.247 10.052
483 HA VAL 68 HA VAL 68 2.452 8.982 10.542
484 HB VAL 68 HB VAL 68 -0.490 8.232 10.414
485 HG11 VAL 68 HG11 VAL 68 -0.868 10.637 10.674
486 HG12 VAL 68 HG12 VAL 68 0.872 10.930 10.710
487 HG13 VAL 68 HG13 VAL 68 0.099 10.043 12.025
488 HG21 VAL 68 HG21 VAL 68 0.638 8.307 8.169
489 HG22 VAL 68 HG22 VAL 68 1.127 9.964 8.515
490 HG23 VAL 68 HG23 VAL 68 -0.583 9.563 8.374
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 -7.676 12.923 -0.986
2 H2 MET 1 HT2 MET 1 -8.793 12.828 0.289
3 H3 MET 1 HT3 MET 1 -8.928 11.779 -1.041
4 HA MET 1 HA MET 1 -7.133 10.501 -0.420
5 HB2 MET 1 HB2 MET 1 -5.476 11.260 1.266
6 HB3 MET 1 HB3 MET 1 -5.556 12.353 -0.113
7 HG2 MET 1 HG2 MET 1 -7.043 13.860 1.180
8 HG3 MET 1 HG3 MET 1 -6.927 12.773 2.564
9 HE1 MET 1 HE1 MET 1 -6.088 14.708 4.117
10 HE2 MET 1 HE2 MET 1 -6.352 15.762 2.731
11 HE3 MET 1 HE3 MET 1 -4.844 15.868 3.636
12 H SER 2 H SER 2 -6.597 9.458 1.842
13 HA SER 2 HA SER 2 -8.658 9.780 3.854
14 HB2 SER 2 HB2 SER 2 -9.617 7.584 3.652
15 HB3 SER 2 HB3 SER 2 -9.723 8.356 2.076
16 HG SER 2 HG SER 2 -8.020 7.152 1.371
17 H LYS 3 H LYS 3 -8.378 8.054 5.588
18 HA LYS 3 HA LYS 3 -5.852 6.688 5.757
19 HB2 LYS 3 HB2 LYS 3 -4.963 7.963 7.676
20 HB3 LYS 3 HB3 LYS 3 -5.059 8.954 6.223
21 HG2 LYS 3 HG2 LYS 3 -7.194 9.921 7.023
22 HG3 LYS 3 HG3 LYS 3 -7.079 8.941 8.484
23 HD2 LYS 3 HD2 LYS 3 -4.889 10.862 7.672
24 HD3 LYS 3 HD3 LYS 3 -6.254 11.366 8.668
25 HE2 LYS 3 HE2 LYS 3 -4.373 9.083 9.344
26 HE3 LYS 3 HE3 LYS 3 -4.280 10.702 10.035
27 HZ1 LYS 3 HZ1 LYS 3 -6.721 10.298 10.648
28 HZ2 LYS 3 HZ2 LYS 3 -5.521 9.531 11.574
29 HZ3 LYS 3 HZ3 LYS 3 -6.373 8.657 10.393
30 H GLY 4 H GLY 4 -5.857 5.138 7.333
31 HA2 GLY 4 HA2 GLY 4 -7.998 5.137 9.341
32 HA3 GLY 4 HA3 GLY 4 -7.934 3.797 8.200
33 H ILE 5 H ILE 5 -7.642 2.420 10.055
34 HA ILE 5 HA ILE 5 -4.848 2.443 11.049
35 HB ILE 5 HB ILE 5 -5.756 1.182 13.048
36 HG12 ILE 5 HG12 ILE 5 -8.443 2.315 12.220
37 HG13 ILE 5 HG13 ILE 5 -7.981 0.664 11.821
38 HG21 ILE 5 HG21 ILE 5 -5.149 3.490 13.307
39 HG22 ILE 5 HG22 ILE 5 -6.720 3.293 14.083
40 HG23 ILE 5 HG23 ILE 5 -6.613 4.032 12.485
41 HD11 ILE 5 HD11 ILE 5 -7.841 1.737 14.646
42 HD12 ILE 5 HD12 ILE 5 -7.803 0.052 14.123
43 HD13 ILE 5 HD13 ILE 5 -9.297 0.981 13.999
44 H VAL 6 H VAL 6 -3.657 0.743 10.618
45 HA VAL 6 HA VAL 6 -4.585 -1.273 8.868
46 HB VAL 6 HB VAL 6 -2.017 -1.133 10.471
47 HG11 VAL 6 HG11 VAL 6 -1.205 -2.630 8.535
48 HG12 VAL 6 HG12 VAL 6 -2.910 -2.922 8.199
49 HG13 VAL 6 HG13 VAL 6 -2.225 -3.395 9.752
50 HG21 VAL 6 HG21 VAL 6 -2.576 0.749 8.813
51 HG22 VAL 6 HG22 VAL 6 -2.451 -0.472 7.547
52 HG23 VAL 6 HG23 VAL 6 -1.050 -0.095 8.548
53 H LYS 7 H LYS 7 -5.634 -3.065 9.277
54 HA LYS 7 HA LYS 7 -6.327 -3.941 11.893
55 HB2 LYS 7 HB2 LYS 7 -7.703 -4.381 9.844
56 HB3 LYS 7 HB3 LYS 7 -6.459 -5.500 9.291
57 HG2 LYS 7 HG2 LYS 7 -6.800 -6.920 11.246
58 HG3 LYS 7 HG3 LYS 7 -7.943 -5.764 11.926
59 HD2 LYS 7 HD2 LYS 7 -9.268 -7.481 10.914
60 HD3 LYS 7 HD3 LYS 7 -9.344 -6.102 9.819
61 HE2 LYS 7 HE2 LYS 7 -7.607 -7.099 8.400
62 HE3 LYS 7 HE3 LYS 7 -7.452 -8.456 9.516
63 HZ1 LYS 7 HZ1 LYS 7 -10.034 -7.762 8.257
64 HZ2 LYS 7 HZ2 LYS 7 -9.579 -9.221 8.997
65 HZ3 LYS 7 HZ3 LYS 7 -8.918 -8.784 7.493
66 H TRP 8 H TRP 8 -4.049 -5.098 9.431
67 HA TRP 8 HA TRP 8 -2.211 -6.084 11.410
68 HB2 TRP 8 HB2 TRP 8 -4.072 -7.885 11.121
69 HB3 TRP 8 HB3 TRP 8 -3.331 -8.179 9.551
70 HD1 TRP 8 HD1 TRP 8 -0.641 -8.806 9.619
71 HE1 TRP 8 HE1 TRP 8 0.649 -10.207 11.359
72 HE3 TRP 8 HE3 TRP 8 -3.926 -8.610 13.522
73 HZ2 TRP 8 HZ2 TRP 8 0.326 -11.127 14.047
74 HZ3 TRP 8 HZ3 TRP 8 -3.413 -9.759 15.656
75 HH2 TRP 8 HH2 TRP 8 -1.295 -11.017 15.924
76 H PHE 9 H PHE 9 -0.208 -5.837 10.579
77 HA PHE 9 HA PHE 9 0.050 -5.689 7.621
78 HB2 PHE 9 HB2 PHE 9 0.593 -3.599 8.946
79 HB3 PHE 9 HB3 PHE 9 1.946 -4.488 9.649
80 HD1 PHE 9 HD1 PHE 9 0.575 -2.994 6.576
81 HD2 PHE 9 HD2 PHE 9 3.866 -5.160 8.289
82 HE1 PHE 9 HE1 PHE 9 1.933 -2.523 4.556
83 HE2 PHE 9 HE2 PHE 9 5.225 -4.685 6.269
84 HZ PHE 9 HZ PHE 9 4.260 -3.368 4.404
85 H ASN 10 H ASN 10 1.090 -7.342 6.686
86 HA ASN 10 HA ASN 10 3.090 -8.837 8.286
87 HB2 ASN 10 HB2 ASN 10 1.204 -9.899 6.170
88 HB3 ASN 10 HB3 ASN 10 2.468 -10.835 6.965
89 HD21 ASN 10 HD21 ASN 10 -0.755 -10.570 7.077
90 HD22 ASN 10 HD22 ASN 10 -1.034 -10.754 8.741
91 H SER 11 H SER 11 4.869 -7.657 7.543
92 HA SER 11 HA SER 11 5.410 -7.024 4.860
93 HB2 SER 11 HB2 SER 11 7.703 -6.649 5.626
94 HB3 SER 11 HB3 SER 11 6.558 -5.990 6.789
95 HG SER 11 HG SER 11 7.269 -7.362 8.205
96 H ASP 12 H ASP 12 6.058 -9.932 6.765
97 HA ASP 12 HA ASP 12 7.904 -11.186 5.045
98 HB2 ASP 12 HB2 ASP 12 5.812 -12.335 6.908
99 HB3 ASP 12 HB3 ASP 12 7.001 -13.324 6.056
100 H LYS 13 H LYS 13 4.362 -11.215 5.125
101 HA LYS 13 HA LYS 13 4.068 -12.912 2.821
102 HB2 LYS 13 HB2 LYS 13 2.140 -11.095 4.288
103 HB3 LYS 13 HB3 LYS 13 1.679 -12.138 2.945
104 HG2 LYS 13 HG2 LYS 13 2.473 -14.112 4.193
105 HG3 LYS 13 HG3 LYS 13 2.933 -13.070 5.544
106 HD2 LYS 13 HD2 LYS 13 0.585 -12.351 5.793
107 HD3 LYS 13 HD3 LYS 13 0.122 -13.390 4.441
108 HE2 LYS 13 HE2 LYS 13 0.909 -15.367 5.688
109 HE3 LYS 13 HE3 LYS 13 1.380 -14.334 7.037
110 HZ1 LYS 13 HZ1 LYS 13 -1.002 -13.570 7.062
111 HZ2 LYS 13 HZ2 LYS 13 -0.737 -15.174 7.557
112 HZ3 LYS 13 HZ3 LYS 13 -1.348 -14.851 6.004
113 H GLY 14 H GLY 14 4.427 -9.504 3.423
114 HA2 GLY 14 HA2 GLY 14 5.170 -7.912 1.846
115 HA3 GLY 14 HA3 GLY 14 4.625 -8.969 0.552
116 H PHE 15 H PHE 15 2.224 -8.717 2.939
117 HA PHE 15 HA PHE 15 1.045 -6.254 1.978
118 HB2 PHE 15 HB2 PHE 15 -1.017 -7.282 1.108
119 HB3 PHE 15 HB3 PHE 15 0.396 -7.730 0.157
120 HD1 PHE 15 HD1 PHE 15 -2.097 -8.909 2.619
121 HD2 PHE 15 HD2 PHE 15 1.223 -10.009 0.125
122 HE1 PHE 15 HE1 PHE 15 -2.625 -11.307 2.974
123 HE2 PHE 15 HE2 PHE 15 0.699 -12.407 0.483
124 HZ PHE 15 HZ PHE 15 -1.225 -13.055 1.908
125 H GLY 16 H GLY 16 -1.248 -6.016 2.880
126 HA2 GLY 16 HA2 GLY 16 -1.820 -7.439 5.330
127 HA3 GLY 16 HA3 GLY 16 -1.257 -5.790 5.581
128 H PHE 17 H PHE 17 -3.671 -6.252 6.513
129 HA PHE 17 HA PHE 17 -5.564 -5.158 4.508
130 HB2 PHE 17 HB2 PHE 17 -6.106 -6.888 6.941
131 HB3 PHE 17 HB3 PHE 17 -7.353 -6.158 5.930
132 HD1 PHE 17 HD1 PHE 17 -4.671 -8.690 6.075
133 HD2 PHE 17 HD2 PHE 17 -7.816 -6.989 3.697
134 HE1 PHE 17 HE1 PHE 17 -4.530 -10.612 4.515
135 HE2 PHE 17 HE2 PHE 17 -7.676 -8.910 2.137
136 HZ PHE 17 HZ PHE 17 -6.032 -10.721 2.544
137 H ILE 18 H ILE 18 -6.615 -3.262 5.031
138 HA ILE 18 HA ILE 18 -5.961 -2.121 7.673
139 HB ILE 18 HB ILE 18 -4.885 -0.939 5.800
140 HG12 ILE 18 HG12 ILE 18 -7.078 0.817 6.916
141 HG13 ILE 18 HG13 ILE 18 -5.768 0.214 7.933
142 HG21 ILE 18 HG21 ILE 18 -7.638 -0.064 4.913
143 HG22 ILE 18 HG22 ILE 18 -6.856 -1.478 4.211
144 HG23 ILE 18 HG23 ILE 18 -6.103 0.109 4.063
145 HD11 ILE 18 HD11 ILE 18 -5.534 1.974 5.481
146 HD12 ILE 18 HD12 ILE 18 -4.152 1.181 6.232
147 HD13 ILE 18 HD13 ILE 18 -5.082 2.375 7.137
148 H THR 19 H THR 19 -7.468 -1.039 8.847
149 HA THR 19 HA THR 19 -10.251 -1.681 8.197
150 HB THR 19 HB THR 19 -9.035 -0.781 10.812
151 HG1 THR 19 HG1 THR 19 -9.390 -3.023 11.328
152 HG21 THR 19 HG21 THR 19 -11.742 -1.997 10.191
153 HG22 THR 19 HG22 THR 19 -11.462 -0.297 10.564
154 HG23 THR 19 HG23 THR 19 -11.155 -1.530 11.788
155 HA PRO 20 HA PRO 20 -10.377 2.770 6.977
156 HB2 PRO 20 HB2 PRO 20 -13.256 1.974 6.735
157 HB3 PRO 20 HB3 PRO 20 -12.261 2.930 5.619
158 HG2 PRO 20 HG2 PRO 20 -12.800 0.439 5.035
159 HG3 PRO 20 HG3 PRO 20 -11.154 1.054 4.805
160 HD2 PRO 20 HD2 PRO 20 -12.224 -0.685 7.006
161 HD3 PRO 20 HD3 PRO 20 -10.666 -0.779 6.151
162 H GLU 21 H GLU 21 -10.593 4.432 8.380
163 HA GLU 21 HA GLU 21 -11.610 4.118 10.995
164 HB2 GLU 21 HB2 GLU 21 -11.271 6.541 11.218
165 HB3 GLU 21 HB3 GLU 21 -9.889 5.780 10.430
166 HG2 GLU 21 HG2 GLU 21 -10.793 6.459 8.219
167 HG3 GLU 21 HG3 GLU 21 -12.146 7.245 9.021
168 H ASP 22 H ASP 22 -13.123 5.077 8.011
169 HA ASP 22 HA ASP 22 -15.457 6.280 9.186
170 HB2 ASP 22 HB2 ASP 22 -14.826 5.306 6.398
171 HB3 ASP 22 HB3 ASP 22 -16.363 6.045 6.835
172 H GLY 23 H GLY 23 -14.431 3.053 8.873
173 HA2 GLY 23 HA2 GLY 23 -15.591 1.206 9.771
174 HA3 GLY 23 HA3 GLY 23 -17.102 2.083 9.577
175 H SER 24 H SER 24 -15.221 2.328 6.758
176 HA SER 24 HA SER 24 -17.044 0.647 5.295
177 HB2 SER 24 HB2 SER 24 -15.902 1.399 3.315
178 HB3 SER 24 HB3 SER 24 -16.122 2.782 4.378
179 HG SER 24 HG SER 24 -13.960 2.374 3.383
180 H LYS 25 H LYS 25 -16.082 -0.885 3.628
181 HA LYS 25 HA LYS 25 -14.985 -3.092 4.954
182 HB2 LYS 25 HB2 LYS 25 -14.803 -4.119 2.721
183 HB3 LYS 25 HB3 LYS 25 -16.361 -3.330 2.955
184 HG2 LYS 25 HG2 LYS 25 -15.523 -1.340 1.727
185 HG3 LYS 25 HG3 LYS 25 -13.986 -2.167 1.461
186 HD2 LYS 25 HD2 LYS 25 -15.105 -3.927 0.193
187 HD3 LYS 25 HD3 LYS 25 -16.680 -3.209 0.534
188 HE2 LYS 25 HE2 LYS 25 -15.960 -2.560 -1.710
189 HE3 LYS 25 HE3 LYS 25 -15.963 -1.143 -0.661
190 HZ1 LYS 25 HZ1 LYS 25 -13.573 -1.487 -0.310
191 HZ2 LYS 25 HZ2 LYS 25 -13.950 -1.200 -1.941
192 HZ3 LYS 25 HZ3 LYS 25 -13.599 -2.776 -1.410
193 H ASP 26 H ASP 26 -12.994 -4.124 4.870
194 HA ASP 26 HA ASP 26 -10.709 -2.520 5.049
195 HB2 ASP 26 HB2 ASP 26 -11.066 -5.496 4.701
196 HB3 ASP 26 HB3 ASP 26 -9.497 -4.744 4.962
197 H LEU 27 H LEU 27 -8.963 -2.199 3.738
198 HA LEU 27 HA LEU 27 -9.311 -2.884 0.877
199 HB2 LEU 27 HB2 LEU 27 -7.994 -0.446 2.106
200 HB3 LEU 27 HB3 LEU 27 -8.036 -0.815 0.385
201 HG LEU 27 HG LEU 27 -10.534 -0.507 2.080
202 HD11 LEU 27 HD11 LEU 27 -10.704 1.720 0.871
203 HD12 LEU 27 HD12 LEU 27 -9.027 1.496 0.378
204 HD13 LEU 27 HD13 LEU 27 -9.431 1.633 2.089
205 HD21 LEU 27 HD21 LEU 27 -9.995 -0.648 -0.905
206 HD22 LEU 27 HD22 LEU 27 -11.537 -0.127 -0.229
207 HD23 LEU 27 HD23 LEU 27 -10.956 -1.768 0.059
208 H PHE 28 H PHE 28 -7.456 -3.436 -0.314
209 HA PHE 28 HA PHE 28 -5.425 -4.828 1.206
210 HB2 PHE 28 HB2 PHE 28 -5.912 -4.469 -1.756
211 HB3 PHE 28 HB3 PHE 28 -4.558 -5.393 -1.104
212 HD1 PHE 28 HD1 PHE 28 -8.242 -5.218 -1.388
213 HD2 PHE 28 HD2 PHE 28 -4.886 -7.546 -0.058
214 HE1 PHE 28 HE1 PHE 28 -9.720 -7.190 -1.115
215 HE2 PHE 28 HE2 PHE 28 -6.365 -9.517 0.219
216 HZ PHE 28 HZ PHE 28 -8.780 -9.340 -0.309
217 H VAL 29 H VAL 29 -3.413 -4.151 1.657
218 HA VAL 29 HA VAL 29 -2.307 -1.842 0.192
219 HB VAL 29 HB VAL 29 -2.315 -2.180 3.208
220 HG11 VAL 29 HG11 VAL 29 -1.032 -0.091 1.422
221 HG12 VAL 29 HG12 VAL 29 -0.200 -1.203 2.510
222 HG13 VAL 29 HG13 VAL 29 -1.214 0.083 3.167
223 HG21 VAL 29 HG21 VAL 29 -4.439 -1.346 2.079
224 HG22 VAL 29 HG22 VAL 29 -3.502 0.047 1.540
225 HG23 VAL 29 HG23 VAL 29 -3.731 -0.246 3.263
226 H HIS 30 H HIS 30 -0.207 -2.109 -0.391
227 HA HIS 30 HA HIS 30 1.152 -4.562 0.542
228 HB2 HIS 30 HB2 HIS 30 1.540 -2.947 -1.988
229 HB3 HIS 30 HB3 HIS 30 2.497 -4.358 -1.540
230 HD2 HIS 30 HD2 HIS 30 -0.764 -3.594 -3.375
231 HE1 HIS 30 HE1 HIS 30 -0.962 -7.677 -2.322
232 HE2 HIS 30 HE2 HIS 30 -2.033 -5.850 -3.724
233 H HIS 31 H HIS 31 3.314 -4.537 1.111
234 HA HIS 31 HA HIS 31 4.238 -2.311 2.590
235 HB2 HIS 31 HB2 HIS 31 4.915 -4.668 3.023
236 HB3 HIS 31 HB3 HIS 31 5.849 -4.652 1.525
237 HD2 HIS 31 HD2 HIS 31 6.115 -3.257 5.183
238 HE1 HIS 31 HE1 HIS 31 9.642 -2.186 3.128
239 HE2 HIS 31 HE2 HIS 31 8.506 -2.234 5.398
240 H SER 32 H SER 32 5.216 -3.597 -0.570
241 HA SER 32 HA SER 32 7.171 -1.585 -1.096
242 HB2 SER 32 HB2 SER 32 5.748 -3.514 -2.935
243 HB3 SER 32 HB3 SER 32 7.093 -2.486 -3.422
244 HG SER 32 HG SER 32 8.070 -4.308 -2.777
245 H GLU 33 H GLU 33 3.849 -1.266 -0.986
246 HA GLU 33 HA GLU 33 3.334 0.302 -3.306
247 HB2 GLU 33 HB2 GLU 33 1.622 -0.869 -1.859
248 HB3 GLU 33 HB3 GLU 33 1.853 0.418 -0.678
249 HG2 GLU 33 HG2 GLU 33 -0.058 0.949 -2.082
250 HG3 GLU 33 HG3 GLU 33 1.241 2.090 -2.407
251 H ILE 34 H ILE 34 4.661 1.054 -0.145
252 HA ILE 34 HA ILE 34 4.238 3.892 -0.311
253 HB ILE 34 HB ILE 34 4.493 2.705 1.851
254 HG12 ILE 34 HG12 ILE 34 6.782 4.657 1.501
255 HG13 ILE 34 HG13 ILE 34 5.097 5.176 1.476
256 HG21 ILE 34 HG21 ILE 34 7.458 2.509 1.328
257 HG22 ILE 34 HG22 ILE 34 6.385 1.196 0.854
258 HG23 ILE 34 HG23 ILE 34 6.490 1.679 2.545
259 HD11 ILE 34 HD11 ILE 34 5.881 5.437 3.740
260 HD12 ILE 34 HD12 ILE 34 6.564 3.810 3.749
261 HD13 ILE 34 HD13 ILE 34 4.814 4.032 3.722
262 H GLN 35 H GLN 35 5.657 5.498 -0.903
263 HA GLN 35 HA GLN 35 7.942 4.636 -2.559
264 HB2 GLN 35 HB2 GLN 35 6.141 6.043 -3.604
265 HB3 GLN 35 HB3 GLN 35 6.572 7.338 -2.488
266 HG2 GLN 35 HG2 GLN 35 8.854 7.385 -3.381
267 HG3 GLN 35 HG3 GLN 35 8.482 6.040 -4.455
268 HE21 GLN 35 HE21 GLN 35 9.192 9.008 -4.989
269 HE22 GLN 35 HE22 GLN 35 7.972 9.524 -6.049
270 H SER 36 H SER 36 9.924 4.896 -1.781
271 HA SER 36 HA SER 36 11.675 5.538 -0.444
272 HB2 SER 36 HB2 SER 36 10.224 8.194 -0.583
273 HB3 SER 36 HB3 SER 36 11.893 7.971 -0.069
274 HG SER 36 HG SER 36 11.405 8.510 -2.387
275 H GLY 37 H GLY 37 9.544 4.274 0.893
276 HA2 GLY 37 HA2 GLY 37 8.628 5.567 3.220
277 HA3 GLY 37 HA3 GLY 37 8.776 3.824 3.016
278 H GLY 38 H GLY 38 11.555 3.674 2.583
279 HA2 GLY 38 HA2 GLY 38 13.646 4.025 3.617
280 HA3 GLY 38 HA3 GLY 38 12.835 4.867 4.933
281 H GLU 39 H GLU 39 14.808 2.828 5.201
282 HA GLU 39 HA GLU 39 13.736 0.275 5.780
283 HB2 GLU 39 HB2 GLU 39 16.155 0.759 5.438
284 HB3 GLU 39 HB3 GLU 39 16.178 1.607 6.983
285 HG2 GLU 39 HG2 GLU 39 15.505 -0.458 8.142
286 HG3 GLU 39 HG3 GLU 39 15.441 -1.312 6.600
287 H TYR 40 H TYR 40 14.210 3.174 7.753
288 HA TYR 40 HA TYR 40 13.627 2.090 10.276
289 HB2 TYR 40 HB2 TYR 40 13.175 4.884 9.210
290 HB3 TYR 40 HB3 TYR 40 13.059 4.433 10.911
291 HD1 TYR 40 HD1 TYR 40 15.328 4.964 8.070
292 HD2 TYR 40 HD2 TYR 40 15.052 3.752 12.180
293 HE1 TYR 40 HE1 TYR 40 17.785 5.198 8.303
294 HE2 TYR 40 HE2 TYR 40 17.511 3.985 12.415
295 HH TYR 40 HH TYR 40 19.346 5.431 11.143
296 H ALA 41 H ALA 41 11.498 3.425 7.774
297 HA ALA 41 HA ALA 41 9.116 3.475 9.275
298 HB1 ALA 41 HB1 ALA 41 9.360 4.588 7.090
299 HB2 ALA 41 HB2 ALA 41 7.971 3.502 7.103
300 HB3 ALA 41 HB3 ALA 41 9.465 3.013 6.302
301 H THR 42 H THR 42 7.934 1.903 10.089
302 HA THR 42 HA THR 42 7.937 -0.755 8.804
303 HB THR 42 HB THR 42 7.972 -1.820 11.029
304 HG1 THR 42 HG1 THR 42 7.426 -0.505 12.563
305 HG21 THR 42 HG21 THR 42 10.377 -1.117 11.628
306 HG22 THR 42 HG22 THR 42 10.259 -0.004 10.265
307 HG23 THR 42 HG23 THR 42 10.102 -1.741 10.002
308 H LEU 43 H LEU 43 6.080 -2.096 9.445
309 HA LEU 43 HA LEU 43 3.769 -0.598 10.471
310 HB2 LEU 43 HB2 LEU 43 3.895 -2.040 7.823
311 HB3 LEU 43 HB3 LEU 43 2.378 -1.739 8.655
312 HG LEU 43 HG LEU 43 3.365 0.768 8.751
313 HD11 LEU 43 HD11 LEU 43 4.433 -0.120 6.072
314 HD12 LEU 43 HD12 LEU 43 5.463 -0.158 7.497
315 HD13 LEU 43 HD13 LEU 43 4.764 1.367 6.961
316 HD21 LEU 43 HD21 LEU 43 2.175 1.172 6.531
317 HD22 LEU 43 HD22 LEU 43 1.233 0.316 7.750
318 HD23 LEU 43 HD23 LEU 43 1.973 -0.576 6.421
319 H ALA 44 H ALA 44 2.276 -1.868 11.555
320 HA ALA 44 HA ALA 44 2.645 -4.771 11.648
321 HB1 ALA 44 HB1 ALA 44 3.244 -4.903 13.886
322 HB2 ALA 44 HB2 ALA 44 2.542 -3.334 14.277
323 HB3 ALA 44 HB3 ALA 44 4.080 -3.422 13.419
324 H ASP 45 H ASP 45 0.970 -4.936 14.126
325 HA ASP 45 HA ASP 45 -1.622 -4.658 12.844
326 HB2 ASP 45 HB2 ASP 45 -1.046 -6.699 14.109
327 HB3 ASP 45 HB3 ASP 45 -0.838 -5.738 15.565
328 H GLY 46 H GLY 46 -2.584 -2.704 12.913
329 HA2 GLY 46 HA2 GLY 46 -3.905 -1.155 14.188
330 HA3 GLY 46 HA3 GLY 46 -2.771 -1.330 15.518
331 H GLN 47 H GLN 47 -0.889 -1.078 12.806
332 HA GLN 47 HA GLN 47 0.107 1.483 13.418
333 HB2 GLN 47 HB2 GLN 47 1.340 -0.339 12.236
334 HB3 GLN 47 HB3 GLN 47 0.348 -0.039 10.810
335 HG2 GLN 47 HG2 GLN 47 2.497 1.121 10.611
336 HG3 GLN 47 HG3 GLN 47 1.188 2.285 10.731
337 HE21 GLN 47 HE21 GLN 47 1.811 4.001 12.056
338 HE22 GLN 47 HE22 GLN 47 2.756 3.855 13.459
339 H THR 48 H THR 48 -0.557 3.467 12.873
340 HA THR 48 HA THR 48 -2.936 3.806 11.240
341 HB THR 48 HB THR 48 -1.213 5.879 12.633
342 HG1 THR 48 HG1 THR 48 -2.051 4.647 14.205
343 HG21 THR 48 HG21 THR 48 -2.659 6.808 10.856
344 HG22 THR 48 HG22 THR 48 -3.227 7.294 12.455
345 HG23 THR 48 HG23 THR 48 -4.056 6.007 11.577
346 H VAL 49 H VAL 49 -2.974 4.375 9.152
347 HA VAL 49 HA VAL 49 -0.612 5.663 7.968
348 HB VAL 49 HB VAL 49 -0.663 4.129 6.028
349 HG11 VAL 49 HG11 VAL 49 -0.353 2.567 8.599
350 HG12 VAL 49 HG12 VAL 49 0.806 3.792 8.085
351 HG13 VAL 49 HG13 VAL 49 0.536 2.362 7.091
352 HG21 VAL 49 HG21 VAL 49 -1.875 1.941 6.333
353 HG22 VAL 49 HG22 VAL 49 -2.955 3.321 6.139
354 HG23 VAL 49 HG23 VAL 49 -2.681 2.637 7.739
355 H GLU 50 H GLU 50 -1.017 6.365 5.705
356 HA GLU 50 HA GLU 50 -3.801 7.339 5.380
357 HB2 GLU 50 HB2 GLU 50 -1.224 8.602 4.377
358 HB3 GLU 50 HB3 GLU 50 -2.848 9.248 4.158
359 HG2 GLU 50 HG2 GLU 50 -3.088 9.440 6.621
360 HG3 GLU 50 HG3 GLU 50 -1.446 8.835 6.816
361 H TYR 51 H TYR 51 -4.758 6.987 3.353
362 HA TYR 51 HA TYR 51 -3.131 5.935 1.175
363 HB2 TYR 51 HB2 TYR 51 -4.456 3.878 0.948
364 HB3 TYR 51 HB3 TYR 51 -3.605 3.923 2.484
365 HD1 TYR 51 HD1 TYR 51 -6.886 4.110 0.835
366 HD2 TYR 51 HD2 TYR 51 -4.820 4.268 4.598
367 HE1 TYR 51 HE1 TYR 51 -9.043 3.851 2.030
368 HE2 TYR 51 HE2 TYR 51 -6.979 4.008 5.793
369 HH TYR 51 HH TYR 51 -9.506 2.830 4.785
370 H GLU 52 H GLU 52 -4.359 5.537 -0.785
371 HA GLU 52 HA GLU 52 -6.825 7.157 -0.983
372 HB2 GLU 52 HB2 GLU 52 -4.554 6.992 -2.989
373 HB3 GLU 52 HB3 GLU 52 -6.084 7.829 -3.253
374 HG2 GLU 52 HG2 GLU 52 -5.607 9.290 -1.311
375 HG3 GLU 52 HG3 GLU 52 -4.067 8.466 -1.077
376 H VAL 53 H VAL 53 -8.492 6.131 -1.940
377 HA VAL 53 HA VAL 53 -8.412 3.351 -2.427
378 HB VAL 53 HB VAL 53 -10.463 4.593 -1.802
379 HG11 VAL 53 HG11 VAL 53 -10.030 6.590 -3.249
380 HG12 VAL 53 HG12 VAL 53 -11.662 5.947 -3.423
381 HG13 VAL 53 HG13 VAL 53 -10.447 5.616 -4.657
382 HG21 VAL 53 HG21 VAL 53 -11.986 3.348 -3.196
383 HG22 VAL 53 HG22 VAL 53 -10.534 2.367 -3.004
384 HG23 VAL 53 HG23 VAL 53 -10.805 3.257 -4.501
385 H GLY 54 H GLY 54 -8.550 2.171 -4.325
386 HA2 GLY 54 HA2 GLY 54 -8.003 3.496 -6.885
387 HA3 GLY 54 HA3 GLY 54 -6.834 2.307 -6.309
388 H GLN 55 H GLN 55 -8.184 1.901 -8.711
389 HA GLN 55 HA GLN 55 -10.261 -0.099 -8.073
390 HB2 GLN 55 HB2 GLN 55 -9.578 1.225 -10.710
391 HB3 GLN 55 HB3 GLN 55 -10.867 0.049 -10.462
392 HG2 GLN 55 HG2 GLN 55 -10.665 2.736 -9.066
393 HG3 GLN 55 HG3 GLN 55 -11.721 2.380 -10.428
394 HE21 GLN 55 HE21 GLN 55 -11.815 2.690 -7.137
395 HE22 GLN 55 HE22 GLN 55 -13.090 1.629 -6.784
396 H GLY 56 H GLY 56 -10.128 -2.182 -8.753
397 HA2 GLY 56 HA2 GLY 56 -7.785 -3.083 -10.269
398 HA3 GLY 56 HA3 GLY 56 -8.014 -3.745 -8.652
399 H GLN 57 H GLN 57 -8.032 -5.256 -11.092
400 HA GLN 57 HA GLN 57 -10.628 -5.831 -12.039
401 HB2 GLN 57 HB2 GLN 57 -8.103 -7.491 -11.957
402 HB3 GLN 57 HB3 GLN 57 -9.581 -8.005 -12.776
403 HG2 GLN 57 HG2 GLN 57 -9.526 -5.973 -14.167
404 HG3 GLN 57 HG3 GLN 57 -8.055 -5.449 -13.346
405 HE21 GLN 57 HE21 GLN 57 -6.506 -5.661 -15.017
406 HE22 GLN 57 HE22 GLN 57 -6.204 -7.115 -15.840
407 H LYS 58 H LYS 58 -8.700 -7.227 -9.414
408 HA LYS 58 HA LYS 58 -10.780 -9.130 -8.707
409 HB2 LYS 58 HB2 LYS 58 -8.353 -9.664 -8.488
410 HB3 LYS 58 HB3 LYS 58 -8.228 -8.436 -7.232
411 HG2 LYS 58 HG2 LYS 58 -9.881 -9.643 -5.864
412 HG3 LYS 58 HG3 LYS 58 -10.050 -10.862 -7.126
413 HD2 LYS 58 HD2 LYS 58 -7.660 -11.438 -6.893
414 HD3 LYS 58 HD3 LYS 58 -7.492 -10.226 -5.624
415 HE2 LYS 58 HE2 LYS 58 -9.155 -11.421 -4.253
416 HE3 LYS 58 HE3 LYS 58 -9.338 -12.631 -5.522
417 HZ1 LYS 58 HZ1 LYS 58 -6.671 -12.044 -4.427
418 HZ2 LYS 58 HZ2 LYS 58 -7.244 -13.469 -5.155
419 HZ3 LYS 58 HZ3 LYS 58 -7.721 -13.066 -3.574
420 H GLY 59 H GLY 59 -9.819 -5.911 -7.812
421 HA2 GLY 59 HA2 GLY 59 -12.075 -5.108 -6.520
422 HA3 GLY 59 HA3 GLY 59 -11.139 -5.876 -5.241
423 HA PRO 60 HA PRO 60 -9.598 -1.463 -5.987
424 HB2 PRO 60 HB2 PRO 60 -10.380 -0.230 -3.718
425 HB3 PRO 60 HB3 PRO 60 -11.465 -0.403 -5.114
426 HG2 PRO 60 HG2 PRO 60 -11.325 -2.035 -2.618
427 HG3 PRO 60 HG3 PRO 60 -12.741 -1.372 -3.457
428 HD2 PRO 60 HD2 PRO 60 -11.938 -3.976 -3.749
429 HD3 PRO 60 HD3 PRO 60 -12.768 -3.077 -5.039
430 H CYS 61 H CYS 61 -7.880 -0.371 -4.897
431 HA CYS 61 HA CYS 61 -6.585 -1.868 -2.706
432 HB2 CYS 61 HB2 CYS 61 -4.409 -1.546 -3.790
433 HB3 CYS 61 HB3 CYS 61 -5.490 -2.456 -4.846
434 HG CYS 61 HG CYS 61 -5.222 0.624 -5.269
435 H ALA 62 H ALA 62 -4.660 -0.433 -1.856
436 HA ALA 62 HA ALA 62 -5.535 2.389 -1.775
437 HB1 ALA 62 HB1 ALA 62 -4.317 1.802 0.709
438 HB2 ALA 62 HB2 ALA 62 -5.434 0.474 0.395
439 HB3 ALA 62 HB3 ALA 62 -6.021 2.134 0.405
440 H ASN 63 H ASN 63 -3.966 3.497 -2.795
441 HA ASN 63 HA ASN 63 -1.178 2.620 -2.539
442 HB2 ASN 63 HB2 ASN 63 -0.737 4.127 -4.421
443 HB3 ASN 63 HB3 ASN 63 -2.030 2.995 -4.811
444 HD21 ASN 63 HD21 ASN 63 -1.403 5.915 -5.705
445 HD22 ASN 63 HD22 ASN 63 -2.887 6.711 -5.492
446 H LYS 64 H LYS 64 0.403 4.597 -2.649
447 HA LYS 64 HA LYS 64 1.406 6.281 -1.461
448 HB2 LYS 64 HB2 LYS 64 -0.396 7.548 -2.670
449 HB3 LYS 64 HB3 LYS 64 -1.381 7.424 -1.213
450 HG2 LYS 64 HG2 LYS 64 0.342 8.588 0.082
451 HG3 LYS 64 HG3 LYS 64 1.382 8.670 -1.340
452 HD2 LYS 64 HD2 LYS 64 -0.381 9.987 -2.513
453 HD3 LYS 64 HD3 LYS 64 -1.335 9.979 -1.027
454 HE2 LYS 64 HE2 LYS 64 1.473 11.100 -1.266
455 HE3 LYS 64 HE3 LYS 64 -0.001 12.069 -1.287
456 HZ1 LYS 64 HZ1 LYS 64 -0.543 11.172 0.910
457 HZ2 LYS 64 HZ2 LYS 64 0.927 12.020 0.919
458 HZ3 LYS 64 HZ3 LYS 64 0.923 10.321 0.929
459 H VAL 65 H VAL 65 1.553 4.411 0.101
460 HA VAL 65 HA VAL 65 -0.035 4.660 2.527
461 HB VAL 65 HB VAL 65 2.317 2.849 1.887
462 HG11 VAL 65 HG11 VAL 65 1.999 3.179 4.318
463 HG12 VAL 65 HG12 VAL 65 1.550 1.543 3.838
464 HG13 VAL 65 HG13 VAL 65 0.298 2.743 4.153
465 HG21 VAL 65 HG21 VAL 65 -0.636 2.176 1.998
466 HG22 VAL 65 HG22 VAL 65 0.677 1.134 1.455
467 HG23 VAL 65 HG23 VAL 65 0.216 2.543 0.500
468 H VAL 66 H VAL 66 0.421 6.181 3.928
469 HA VAL 66 HA VAL 66 3.260 6.898 4.438
470 HB VAL 66 HB VAL 66 0.843 8.733 4.576
471 HG11 VAL 66 HG11 VAL 66 2.507 10.511 4.985
472 HG12 VAL 66 HG12 VAL 66 3.793 9.305 4.997
473 HG13 VAL 66 HG13 VAL 66 2.561 9.292 6.258
474 HG21 VAL 66 HG21 VAL 66 3.199 8.704 2.663
475 HG22 VAL 66 HG22 VAL 66 1.878 9.873 2.661
476 HG23 VAL 66 HG23 VAL 66 1.562 8.184 2.262
477 H ALA 67 H ALA 67 3.914 6.383 6.413
478 HA ALA 67 HA ALA 67 2.130 5.392 8.415
479 HB1 ALA 67 HB1 ALA 67 4.272 4.414 8.420
480 HB2 ALA 67 HB2 ALA 67 4.282 5.471 9.830
481 HB3 ALA 67 HB3 ALA 67 5.083 5.979 8.344
482 H VAL 68 H VAL 68 1.308 6.348 10.191
483 HA VAL 68 HA VAL 68 1.764 9.250 10.502
484 HB VAL 68 HB VAL 68 -0.525 7.560 11.568
485 HG11 VAL 68 HG11 VAL 68 -1.588 9.828 11.868
486 HG12 VAL 68 HG12 VAL 68 -0.027 10.551 11.480
487 HG13 VAL 68 HG13 VAL 68 -0.198 9.546 12.918
488 HG21 VAL 68 HG21 VAL 68 -0.517 9.513 9.243
489 HG22 VAL 68 HG22 VAL 68 -1.868 8.514 9.782
490 HG23 VAL 68 HG23 VAL 68 -0.448 7.760 9.055
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 -8.808 11.815 -0.103
2 H2 MET 1 HT2 MET 1 -7.385 11.056 -0.636
3 H3 MET 1 HT3 MET 1 -7.543 12.744 -0.747
4 HA MET 1 HA MET 1 -6.163 11.706 1.170
5 HB2 MET 1 HB2 MET 1 -6.769 14.126 0.829
6 HB3 MET 1 HB3 MET 1 -8.255 13.831 1.732
7 HG2 MET 1 HG2 MET 1 -6.929 13.118 3.688
8 HG3 MET 1 HG3 MET 1 -5.441 13.404 2.787
9 HE1 MET 1 HE1 MET 1 -5.024 17.045 2.388
10 HE2 MET 1 HE2 MET 1 -5.957 16.174 1.173
11 HE3 MET 1 HE3 MET 1 -4.594 15.383 1.961
12 H SER 2 H SER 2 -6.408 10.009 2.467
13 HA SER 2 HA SER 2 -8.741 9.826 4.214
14 HB2 SER 2 HB2 SER 2 -9.425 8.520 2.257
15 HB3 SER 2 HB3 SER 2 -7.940 7.579 2.347
16 HG SER 2 HG SER 2 -8.636 6.998 4.509
17 H LYS 3 H LYS 3 -8.370 8.630 6.086
18 HA LYS 3 HA LYS 3 -5.690 7.465 6.455
19 HB2 LYS 3 HB2 LYS 3 -5.695 9.838 7.278
20 HB3 LYS 3 HB3 LYS 3 -6.955 9.387 8.426
21 HG2 LYS 3 HG2 LYS 3 -5.476 7.756 9.477
22 HG3 LYS 3 HG3 LYS 3 -4.229 8.059 8.267
23 HD2 LYS 3 HD2 LYS 3 -3.589 9.330 10.188
24 HD3 LYS 3 HD3 LYS 3 -4.256 10.494 9.046
25 HE2 LYS 3 HE2 LYS 3 -6.408 10.456 10.223
26 HE3 LYS 3 HE3 LYS 3 -5.795 9.234 11.338
27 HZ1 LYS 3 HZ1 LYS 3 -5.724 11.655 12.077
28 HZ2 LYS 3 HZ2 LYS 3 -4.424 11.826 10.998
29 HZ3 LYS 3 HZ3 LYS 3 -4.317 10.732 12.292
30 H GLY 4 H GLY 4 -5.877 5.489 7.273
31 HA2 GLY 4 HA2 GLY 4 -8.154 4.870 9.066
32 HA3 GLY 4 HA3 GLY 4 -7.710 3.792 7.746
33 H ILE 5 H ILE 5 -7.658 2.367 9.794
34 HA ILE 5 HA ILE 5 -4.902 2.420 10.888
35 HB ILE 5 HB ILE 5 -5.868 1.151 12.853
36 HG12 ILE 5 HG12 ILE 5 -8.537 2.243 11.920
37 HG13 ILE 5 HG13 ILE 5 -8.037 0.598 11.545
38 HG21 ILE 5 HG21 ILE 5 -6.677 3.997 12.232
39 HG22 ILE 5 HG22 ILE 5 -5.312 3.433 13.197
40 HG23 ILE 5 HG23 ILE 5 -6.955 3.268 13.815
41 HD11 ILE 5 HD11 ILE 5 -9.402 0.672 13.607
42 HD12 ILE 5 HD12 ILE 5 -8.236 1.779 14.333
43 HD13 ILE 5 HD13 ILE 5 -7.761 0.123 13.951
44 H VAL 6 H VAL 6 -3.673 0.731 10.537
45 HA VAL 6 HA VAL 6 -4.506 -1.317 8.765
46 HB VAL 6 HB VAL 6 -2.001 -1.128 10.462
47 HG11 VAL 6 HG11 VAL 6 -2.784 -2.934 8.162
48 HG12 VAL 6 HG12 VAL 6 -2.174 -3.400 9.749
49 HG13 VAL 6 HG13 VAL 6 -1.098 -2.633 8.583
50 HG21 VAL 6 HG21 VAL 6 -2.513 0.736 8.770
51 HG22 VAL 6 HG22 VAL 6 -2.329 -0.491 7.518
52 HG23 VAL 6 HG23 VAL 6 -0.971 -0.094 8.571
53 H LYS 7 H LYS 7 -5.558 -3.111 9.178
54 HA LYS 7 HA LYS 7 -6.325 -3.933 11.793
55 HB2 LYS 7 HB2 LYS 7 -7.630 -4.421 9.702
56 HB3 LYS 7 HB3 LYS 7 -6.377 -5.573 9.242
57 HG2 LYS 7 HG2 LYS 7 -6.804 -6.918 11.223
58 HG3 LYS 7 HG3 LYS 7 -7.937 -5.718 11.841
59 HD2 LYS 7 HD2 LYS 7 -9.280 -7.435 10.863
60 HD3 LYS 7 HD3 LYS 7 -9.300 -6.098 9.715
61 HE2 LYS 7 HE2 LYS 7 -7.553 -7.186 8.379
62 HE3 LYS 7 HE3 LYS 7 -7.462 -8.506 9.546
63 HZ1 LYS 7 HZ1 LYS 7 -8.844 -9.190 7.751
64 HZ2 LYS 7 HZ2 LYS 7 -9.780 -7.776 7.846
65 HZ3 LYS 7 HZ3 LYS 7 -9.846 -8.928 9.094
66 H TRP 8 H TRP 8 -3.953 -5.118 9.438
67 HA TRP 8 HA TRP 8 -2.192 -6.065 11.506
68 HB2 TRP 8 HB2 TRP 8 -4.035 -7.880 11.169
69 HB3 TRP 8 HB3 TRP 8 -3.222 -8.199 9.639
70 HD1 TRP 8 HD1 TRP 8 -0.634 -8.987 9.774
71 HE1 TRP 8 HE1 TRP 8 0.617 -10.287 11.617
72 HE3 TRP 8 HE3 TRP 8 -3.861 -8.320 13.671
73 HZ2 TRP 8 HZ2 TRP 8 0.289 -10.961 14.377
74 HZ3 TRP 8 HZ3 TRP 8 -3.373 -9.305 15.893
75 HH2 TRP 8 HH2 TRP 8 -1.304 -10.622 16.250
76 H PHE 9 H PHE 9 -0.176 -5.753 10.753
77 HA PHE 9 HA PHE 9 0.210 -5.679 7.806
78 HB2 PHE 9 HB2 PHE 9 0.688 -3.566 9.119
79 HB3 PHE 9 HB3 PHE 9 2.016 -4.434 9.888
80 HD1 PHE 9 HD1 PHE 9 0.763 -2.979 6.751
81 HD2 PHE 9 HD2 PHE 9 3.988 -5.131 8.603
82 HE1 PHE 9 HE1 PHE 9 2.196 -2.526 4.779
83 HE2 PHE 9 HE2 PHE 9 5.421 -4.674 6.632
84 HZ PHE 9 HZ PHE 9 4.526 -3.374 4.719
85 H ASN 10 H ASN 10 1.327 -7.317 6.927
86 HA ASN 10 HA ASN 10 3.301 -8.747 8.618
87 HB2 ASN 10 HB2 ASN 10 1.389 -9.913 6.583
88 HB3 ASN 10 HB3 ASN 10 2.715 -10.804 7.327
89 HD21 ASN 10 HD21 ASN 10 -0.375 -11.007 7.578
90 HD22 ASN 10 HD22 ASN 10 -0.628 -11.025 9.256
91 H SER 11 H SER 11 5.103 -7.642 7.821
92 HA SER 11 HA SER 11 5.616 -7.109 5.105
93 HB2 SER 11 HB2 SER 11 7.918 -6.716 5.827
94 HB3 SER 11 HB3 SER 11 6.790 -6.002 6.976
95 HG SER 11 HG SER 11 8.107 -8.512 7.196
96 H ASP 12 H ASP 12 6.273 -9.932 7.130
97 HA ASP 12 HA ASP 12 8.093 -11.289 5.480
98 HB2 ASP 12 HB2 ASP 12 7.260 -13.360 6.563
99 HB3 ASP 12 HB3 ASP 12 7.590 -12.082 7.733
100 H LYS 13 H LYS 13 4.552 -11.296 5.516
101 HA LYS 13 HA LYS 13 4.285 -13.032 3.237
102 HB2 LYS 13 HB2 LYS 13 2.340 -11.199 4.655
103 HB3 LYS 13 HB3 LYS 13 1.893 -12.254 3.315
104 HG2 LYS 13 HG2 LYS 13 2.667 -14.217 4.594
105 HG3 LYS 13 HG3 LYS 13 3.107 -13.163 5.940
106 HD2 LYS 13 HD2 LYS 13 0.769 -12.451 6.174
107 HD3 LYS 13 HD3 LYS 13 0.311 -13.456 4.798
108 HE2 LYS 13 HE2 LYS 13 -0.198 -14.638 6.878
109 HE3 LYS 13 HE3 LYS 13 1.112 -15.464 6.035
110 HZ1 LYS 13 HZ1 LYS 13 2.680 -14.671 7.516
111 HZ2 LYS 13 HZ2 LYS 13 1.356 -14.994 8.531
112 HZ3 LYS 13 HZ3 LYS 13 1.697 -13.399 8.055
113 H GLY 14 H GLY 14 4.687 -9.624 3.781
114 HA2 GLY 14 HA2 GLY 14 5.436 -8.060 2.187
115 HA3 GLY 14 HA3 GLY 14 4.897 -9.135 0.907
116 H PHE 15 H PHE 15 2.470 -8.836 3.260
117 HA PHE 15 HA PHE 15 1.324 -6.376 2.258
118 HB2 PHE 15 HB2 PHE 15 -0.726 -7.399 1.355
119 HB3 PHE 15 HB3 PHE 15 0.704 -7.868 0.439
120 HD1 PHE 15 HD1 PHE 15 -1.846 -8.999 2.859
121 HD2 PHE 15 HD2 PHE 15 1.515 -10.155 0.448
122 HE1 PHE 15 HE1 PHE 15 -2.398 -11.388 3.234
123 HE2 PHE 15 HE2 PHE 15 0.966 -12.544 0.826
124 HZ PHE 15 HZ PHE 15 -0.992 -13.159 2.219
125 H GLY 16 H GLY 16 -0.974 -6.112 3.110
126 HA2 GLY 16 HA2 GLY 16 -1.604 -7.508 5.568
127 HA3 GLY 16 HA3 GLY 16 -1.069 -5.845 5.794
128 H PHE 17 H PHE 17 -3.527 -6.353 6.650
129 HA PHE 17 HA PHE 17 -5.352 -5.337 4.546
130 HB2 PHE 17 HB2 PHE 17 -5.960 -6.983 7.020
131 HB3 PHE 17 HB3 PHE 17 -7.178 -6.309 5.939
132 HD1 PHE 17 HD1 PHE 17 -4.492 -8.808 6.292
133 HD2 PHE 17 HD2 PHE 17 -7.519 -7.208 3.698
134 HE1 PHE 17 HE1 PHE 17 -4.256 -10.776 4.803
135 HE2 PHE 17 HE2 PHE 17 -7.283 -9.177 2.210
136 HZ PHE 17 HZ PHE 17 -5.651 -10.961 2.761
137 H ILE 18 H ILE 18 -6.410 -3.430 4.937
138 HA ILE 18 HA ILE 18 -5.878 -2.161 7.545
139 HB ILE 18 HB ILE 18 -4.739 -1.053 5.681
140 HG12 ILE 18 HG12 ILE 18 -7.037 0.719 6.531
141 HG13 ILE 18 HG13 ILE 18 -5.786 0.218 7.670
142 HG21 ILE 18 HG21 ILE 18 -6.276 0.199 4.032
143 HG22 ILE 18 HG22 ILE 18 -7.543 -0.905 4.564
144 HG23 ILE 18 HG23 ILE 18 -6.091 -1.538 3.791
145 HD11 ILE 18 HD11 ILE 18 -5.160 2.370 6.719
146 HD12 ILE 18 HD12 ILE 18 -5.370 1.745 5.083
147 HD13 ILE 18 HD13 ILE 18 -4.067 1.133 6.098
148 H THR 19 H THR 19 -7.438 -1.078 8.621
149 HA THR 19 HA THR 19 -10.190 -1.747 7.872
150 HB THR 19 HB THR 19 -9.064 -0.863 10.533
151 HG1 THR 19 HG1 THR 19 -9.117 -3.009 11.040
152 HG21 THR 19 HG21 THR 19 -11.248 -1.798 11.376
153 HG22 THR 19 HG22 THR 19 -11.774 -1.938 9.700
154 HG23 THR 19 HG23 THR 19 -11.430 -0.350 10.385
155 HA PRO 20 HA PRO 20 -10.361 2.729 6.733
156 HB2 PRO 20 HB2 PRO 20 -13.218 1.909 6.356
157 HB3 PRO 20 HB3 PRO 20 -12.178 2.867 5.285
158 HG2 PRO 20 HG2 PRO 20 -12.715 0.372 4.686
159 HG3 PRO 20 HG3 PRO 20 -11.066 0.996 4.486
160 HD2 PRO 20 HD2 PRO 20 -12.157 -0.765 6.659
161 HD3 PRO 20 HD3 PRO 20 -10.581 -0.836 5.837
162 H GLU 21 H GLU 21 -10.703 4.366 8.181
163 HA GLU 21 HA GLU 21 -11.814 3.916 10.741
164 HB2 GLU 21 HB2 GLU 21 -11.565 6.335 11.078
165 HB3 GLU 21 HB3 GLU 21 -10.128 5.656 10.317
166 HG2 GLU 21 HG2 GLU 21 -10.893 6.432 8.118
167 HG3 GLU 21 HG3 GLU 21 -12.383 7.043 8.829
168 H ASP 22 H ASP 22 -13.209 5.108 7.757
169 HA ASP 22 HA ASP 22 -15.598 6.207 8.842
170 HB2 ASP 22 HB2 ASP 22 -14.880 5.192 6.090
171 HB3 ASP 22 HB3 ASP 22 -16.444 5.905 6.465
172 H GLY 23 H GLY 23 -14.572 2.956 8.303
173 HA2 GLY 23 HA2 GLY 23 -15.765 1.132 9.336
174 HA3 GLY 23 HA3 GLY 23 -17.268 1.979 9.001
175 H SER 24 H SER 24 -15.152 2.199 6.366
176 HA SER 24 HA SER 24 -16.806 0.574 4.698
177 HB2 SER 24 HB2 SER 24 -14.137 1.894 4.172
178 HB3 SER 24 HB3 SER 24 -15.130 1.118 2.948
179 HG SER 24 HG SER 24 -16.047 3.193 4.650
180 H LYS 25 H LYS 25 -15.811 -1.099 3.253
181 HA LYS 25 HA LYS 25 -14.863 -3.269 4.797
182 HB2 LYS 25 HB2 LYS 25 -14.982 -2.865 1.802
183 HB3 LYS 25 HB3 LYS 25 -14.585 -4.397 2.580
184 HG2 LYS 25 HG2 LYS 25 -16.771 -4.280 3.804
185 HG3 LYS 25 HG3 LYS 25 -17.172 -2.840 2.871
186 HD2 LYS 25 HD2 LYS 25 -16.450 -5.484 1.579
187 HD3 LYS 25 HD3 LYS 25 -18.108 -5.027 1.958
188 HE2 LYS 25 HE2 LYS 25 -17.849 -2.989 0.557
189 HE3 LYS 25 HE3 LYS 25 -16.212 -3.498 0.146
190 HZ1 LYS 25 HZ1 LYS 25 -17.085 -5.483 -0.860
191 HZ2 LYS 25 HZ2 LYS 25 -17.857 -4.131 -1.541
192 HZ3 LYS 25 HZ3 LYS 25 -18.665 -5.085 -0.389
193 H ASP 26 H ASP 26 -12.867 -4.344 4.774
194 HA ASP 26 HA ASP 26 -10.585 -2.740 4.917
195 HB2 ASP 26 HB2 ASP 26 -10.924 -5.730 4.654
196 HB3 ASP 26 HB3 ASP 26 -9.361 -4.962 4.911
197 H LEU 27 H LEU 27 -8.825 -2.447 3.611
198 HA LEU 27 HA LEU 27 -9.137 -3.213 0.765
199 HB2 LEU 27 HB2 LEU 27 -8.303 -0.665 2.099
200 HB3 LEU 27 HB3 LEU 27 -7.489 -1.094 0.598
201 HG LEU 27 HG LEU 27 -9.793 -1.394 -0.440
202 HD11 LEU 27 HD11 LEU 27 -10.570 -0.181 2.221
203 HD12 LEU 27 HD12 LEU 27 -11.204 -1.642 1.465
204 HD13 LEU 27 HD13 LEU 27 -11.602 -0.060 0.795
205 HD21 LEU 27 HD21 LEU 27 -8.582 0.591 -0.987
206 HD22 LEU 27 HD22 LEU 27 -8.848 1.282 0.614
207 HD23 LEU 27 HD23 LEU 27 -10.192 1.139 -0.519
208 H PHE 28 H PHE 28 -7.238 -3.748 -0.393
209 HA PHE 28 HA PHE 28 -5.260 -5.147 1.186
210 HB2 PHE 28 HB2 PHE 28 -5.631 -4.769 -1.792
211 HB3 PHE 28 HB3 PHE 28 -4.315 -5.711 -1.088
212 HD1 PHE 28 HD1 PHE 28 -7.952 -5.531 -1.640
213 HD2 PHE 28 HD2 PHE 28 -4.740 -7.824 0.058
214 HE1 PHE 28 HE1 PHE 28 -9.462 -7.486 -1.423
215 HE2 PHE 28 HE2 PHE 28 -6.252 -9.779 0.275
216 HZ PHE 28 HZ PHE 28 -8.614 -9.609 -0.466
217 H VAL 29 H VAL 29 -3.260 -4.502 1.693
218 HA VAL 29 HA VAL 29 -2.124 -2.123 0.362
219 HB VAL 29 HB VAL 29 -2.172 -2.676 3.342
220 HG11 VAL 29 HG11 VAL 29 -0.057 -1.656 2.844
221 HG12 VAL 29 HG12 VAL 29 -1.098 -0.360 3.432
222 HG13 VAL 29 HG13 VAL 29 -0.800 -0.537 1.703
223 HG21 VAL 29 HG21 VAL 29 -3.306 -0.294 1.885
224 HG22 VAL 29 HG22 VAL 29 -3.615 -0.804 3.542
225 HG23 VAL 29 HG23 VAL 29 -4.268 -1.737 2.195
226 H HIS 30 H HIS 30 -0.019 -2.357 -0.226
227 HA HIS 30 HA HIS 30 1.369 -4.825 0.629
228 HB2 HIS 30 HB2 HIS 30 1.623 -3.165 -1.886
229 HB3 HIS 30 HB3 HIS 30 2.709 -4.493 -1.471
230 HD2 HIS 30 HD2 HIS 30 1.656 -7.054 -1.928
231 HE1 HIS 30 HE1 HIS 30 -2.204 -5.822 -3.111
232 HE2 HIS 30 HE2 HIS 30 -0.641 -7.812 -2.913
233 H HIS 31 H HIS 31 3.551 -4.756 1.169
234 HA HIS 31 HA HIS 31 4.431 -2.535 2.682
235 HB2 HIS 31 HB2 HIS 31 5.173 -4.901 3.029
236 HB3 HIS 31 HB3 HIS 31 6.116 -4.785 1.544
237 HD2 HIS 31 HD2 HIS 31 6.346 -3.642 5.274
238 HE1 HIS 31 HE1 HIS 31 9.756 -2.160 3.276
239 HE2 HIS 31 HE2 HIS 31 8.665 -2.479 5.547
240 H SER 32 H SER 32 5.368 -3.714 -0.529
241 HA SER 32 HA SER 32 7.254 -1.616 -1.024
242 HB2 SER 32 HB2 SER 32 5.943 -3.608 -2.877
243 HB3 SER 32 HB3 SER 32 7.241 -2.514 -3.349
244 HG SER 32 HG SER 32 7.873 -4.681 -2.615
245 H GLU 33 H GLU 33 3.949 -1.404 -0.864
246 HA GLU 33 HA GLU 33 3.325 0.101 -3.204
247 HB2 GLU 33 HB2 GLU 33 1.665 -1.079 -1.722
248 HB3 GLU 33 HB3 GLU 33 1.912 0.196 -0.531
249 HG2 GLU 33 HG2 GLU 33 -0.049 0.731 -1.875
250 HG3 GLU 33 HG3 GLU 33 1.232 1.880 -2.239
251 H ILE 34 H ILE 34 4.725 0.946 -0.101
252 HA ILE 34 HA ILE 34 4.221 3.765 -0.304
253 HB ILE 34 HB ILE 34 4.548 2.638 1.867
254 HG12 ILE 34 HG12 ILE 34 6.820 4.594 1.451
255 HG13 ILE 34 HG13 ILE 34 5.135 5.111 1.422
256 HG21 ILE 34 HG21 ILE 34 6.385 1.098 0.913
257 HG22 ILE 34 HG22 ILE 34 6.609 1.702 2.553
258 HG23 ILE 34 HG23 ILE 34 7.490 2.438 1.215
259 HD11 ILE 34 HD11 ILE 34 5.859 5.428 3.675
260 HD12 ILE 34 HD12 ILE 34 6.654 3.854 3.717
261 HD13 ILE 34 HD13 ILE 34 4.894 3.951 3.694
262 H GLN 35 H GLN 35 5.218 5.174 -1.545
263 HA GLN 35 HA GLN 35 7.327 4.529 -3.310
264 HB2 GLN 35 HB2 GLN 35 5.616 6.334 -3.649
265 HB3 GLN 35 HB3 GLN 35 6.455 7.291 -2.430
266 HG2 GLN 35 HG2 GLN 35 7.206 7.968 -4.654
267 HG3 GLN 35 HG3 GLN 35 8.529 7.174 -3.804
268 HE21 GLN 35 HE21 GLN 35 9.652 5.855 -5.236
269 HE22 GLN 35 HE22 GLN 35 8.942 4.900 -6.446
270 H SER 36 H SER 36 7.272 6.188 -0.184
271 HA SER 36 HA SER 36 9.916 7.128 -0.140
272 HB2 SER 36 HB2 SER 36 8.096 6.281 2.120
273 HB3 SER 36 HB3 SER 36 9.633 7.110 2.348
274 HG SER 36 HG SER 36 7.260 8.017 1.122
275 H GLY 37 H GLY 37 8.544 4.010 0.799
276 HA2 GLY 37 HA2 GLY 37 9.805 1.974 0.521
277 HA3 GLY 37 HA3 GLY 37 11.271 2.882 0.879
278 H GLY 38 H GLY 38 10.645 0.510 2.187
279 HA2 GLY 38 HA2 GLY 38 9.744 1.336 4.874
280 HA3 GLY 38 HA3 GLY 38 9.768 -0.316 4.274
281 H GLU 39 H GLU 39 12.438 1.944 3.823
282 HA GLU 39 HA GLU 39 14.390 0.156 4.797
283 HB2 GLU 39 HB2 GLU 39 14.445 3.154 4.389
284 HB3 GLU 39 HB3 GLU 39 15.864 2.213 4.843
285 HG2 GLU 39 HG2 GLU 39 14.191 1.761 2.351
286 HG3 GLU 39 HG3 GLU 39 15.753 2.576 2.392
287 H TYR 40 H TYR 40 12.695 2.864 6.325
288 HA TYR 40 HA TYR 40 13.748 1.982 8.955
289 HB2 TYR 40 HB2 TYR 40 12.956 4.766 8.073
290 HB3 TYR 40 HB3 TYR 40 13.405 4.314 9.716
291 HD1 TYR 40 HD1 TYR 40 14.623 4.914 6.304
292 HD2 TYR 40 HD2 TYR 40 15.716 3.651 10.261
293 HE1 TYR 40 HE1 TYR 40 17.018 5.200 5.733
294 HE2 TYR 40 HE2 TYR 40 18.114 3.937 9.690
295 HH TYR 40 HH TYR 40 19.428 3.876 7.203
296 H ALA 41 H ALA 41 11.014 3.329 7.167
297 HA ALA 41 HA ALA 41 9.152 3.408 9.270
298 HB1 ALA 41 HB1 ALA 41 8.950 4.444 6.946
299 HB2 ALA 41 HB2 ALA 41 7.494 3.688 7.595
300 HB3 ALA 41 HB3 ALA 41 8.463 2.843 6.389
301 H THR 42 H THR 42 7.987 1.926 10.246
302 HA THR 42 HA THR 42 7.895 -0.821 9.132
303 HB THR 42 HB THR 42 7.979 -1.679 11.444
304 HG1 THR 42 HG1 THR 42 8.076 -0.353 13.111
305 HG21 THR 42 HG21 THR 42 10.075 -1.286 10.057
306 HG22 THR 42 HG22 THR 42 10.325 -1.356 11.803
307 HG23 THR 42 HG23 THR 42 10.302 0.203 10.978
308 H LEU 43 H LEU 43 6.023 -2.074 9.768
309 HA LEU 43 HA LEU 43 3.744 -0.537 10.801
310 HB2 LEU 43 HB2 LEU 43 3.831 -1.993 8.157
311 HB3 LEU 43 HB3 LEU 43 2.324 -1.644 8.991
312 HG LEU 43 HG LEU 43 3.397 0.836 9.073
313 HD11 LEU 43 HD11 LEU 43 4.386 -0.094 6.378
314 HD12 LEU 43 HD12 LEU 43 5.439 -0.172 7.787
315 HD13 LEU 43 HD13 LEU 43 4.788 1.379 7.260
316 HD21 LEU 43 HD21 LEU 43 1.931 -0.454 6.753
317 HD22 LEU 43 HD22 LEU 43 2.175 1.287 6.892
318 HD23 LEU 43 HD23 LEU 43 1.229 0.429 8.109
319 H ALA 44 H ALA 44 2.186 -1.791 11.836
320 HA ALA 44 HA ALA 44 2.545 -4.694 11.971
321 HB1 ALA 44 HB1 ALA 44 2.954 -4.793 14.286
322 HB2 ALA 44 HB2 ALA 44 2.415 -3.132 14.546
323 HB3 ALA 44 HB3 ALA 44 3.963 -3.445 13.759
324 H ASP 45 H ASP 45 0.774 -4.828 14.388
325 HA ASP 45 HA ASP 45 -1.759 -4.557 13.004
326 HB2 ASP 45 HB2 ASP 45 -1.254 -6.575 14.327
327 HB3 ASP 45 HB3 ASP 45 -1.090 -5.590 15.774
328 H GLY 46 H GLY 46 -2.730 -2.620 13.003
329 HA2 GLY 46 HA2 GLY 46 -4.095 -1.034 14.166
330 HA3 GLY 46 HA3 GLY 46 -3.038 -1.193 15.561
331 H GLN 47 H GLN 47 -1.058 -0.981 12.889
332 HA GLN 47 HA GLN 47 -0.097 1.608 13.537
333 HB2 GLN 47 HB2 GLN 47 1.241 -0.235 12.504
334 HB3 GLN 47 HB3 GLN 47 0.356 0.011 11.003
335 HG2 GLN 47 HG2 GLN 47 2.494 1.201 10.920
336 HG3 GLN 47 HG3 GLN 47 1.163 2.349 10.923
337 HE21 GLN 47 HE21 GLN 47 1.721 4.111 12.210
338 HE22 GLN 47 HE22 GLN 47 2.546 4.013 13.690
339 H THR 48 H THR 48 -0.731 3.572 12.858
340 HA THR 48 HA THR 48 -3.006 3.817 11.081
341 HB THR 48 HB THR 48 -2.753 6.257 11.534
342 HG1 THR 48 HG1 THR 48 -1.179 6.760 13.175
343 HG21 THR 48 HG21 THR 48 -4.184 5.176 13.045
344 HG22 THR 48 HG22 THR 48 -3.034 5.997 14.097
345 HG23 THR 48 HG23 THR 48 -2.871 4.267 13.796
346 H VAL 49 H VAL 49 -3.051 4.739 9.063
347 HA VAL 49 HA VAL 49 -0.596 5.727 7.855
348 HB VAL 49 HB VAL 49 -0.712 4.166 5.932
349 HG11 VAL 49 HG11 VAL 49 0.776 3.773 7.923
350 HG12 VAL 49 HG12 VAL 49 0.334 2.300 7.057
351 HG13 VAL 49 HG13 VAL 49 -0.468 2.705 8.574
352 HG21 VAL 49 HG21 VAL 49 -2.836 2.846 7.647
353 HG22 VAL 49 HG22 VAL 49 -2.020 2.024 6.316
354 HG23 VAL 49 HG23 VAL 49 -3.013 3.448 5.999
355 H GLU 50 H GLU 50 -0.974 6.384 5.547
356 HA GLU 50 HA GLU 50 -3.720 7.441 5.189
357 HB2 GLU 50 HB2 GLU 50 -1.092 8.677 4.302
358 HB3 GLU 50 HB3 GLU 50 -2.696 9.327 3.957
359 HG2 GLU 50 HG2 GLU 50 -3.121 9.550 6.384
360 HG3 GLU 50 HG3 GLU 50 -1.506 8.927 6.719
361 H TYR 51 H TYR 51 -4.668 7.050 3.199
362 HA TYR 51 HA TYR 51 -3.056 6.042 0.993
363 HB2 TYR 51 HB2 TYR 51 -4.274 3.910 0.823
364 HB3 TYR 51 HB3 TYR 51 -3.379 4.020 2.334
365 HD1 TYR 51 HD1 TYR 51 -6.722 4.025 0.786
366 HD2 TYR 51 HD2 TYR 51 -4.543 4.316 4.478
367 HE1 TYR 51 HE1 TYR 51 -8.823 3.677 2.054
368 HE2 TYR 51 HE2 TYR 51 -6.647 3.965 5.745
369 HH TYR 51 HH TYR 51 -9.325 2.696 4.544
370 H GLU 52 H GLU 52 -4.309 5.533 -0.924
371 HA GLU 52 HA GLU 52 -6.834 7.082 -1.087
372 HB2 GLU 52 HB2 GLU 52 -4.559 6.836 -3.064
373 HB3 GLU 52 HB3 GLU 52 -6.168 7.386 -3.539
374 HG2 GLU 52 HG2 GLU 52 -4.875 9.354 -3.052
375 HG3 GLU 52 HG3 GLU 52 -6.005 9.138 -1.721
376 H VAL 53 H VAL 53 -8.558 5.989 -1.815
377 HA VAL 53 HA VAL 53 -8.282 3.158 -2.393
378 HB VAL 53 HB VAL 53 -10.081 3.972 -0.918
379 HG11 VAL 53 HG11 VAL 53 -10.416 6.136 -2.255
380 HG12 VAL 53 HG12 VAL 53 -11.876 5.336 -1.670
381 HG13 VAL 53 HG13 VAL 53 -11.396 5.171 -3.360
382 HG21 VAL 53 HG21 VAL 53 -11.780 2.549 -1.756
383 HG22 VAL 53 HG22 VAL 53 -10.296 1.906 -2.459
384 HG23 VAL 53 HG23 VAL 53 -11.372 2.905 -3.434
385 H GLY 54 H GLY 54 -7.889 2.413 -4.339
386 HA2 GLY 54 HA2 GLY 54 -9.107 3.756 -6.680
387 HA3 GLY 54 HA3 GLY 54 -7.424 3.239 -6.702
388 H GLN 55 H GLN 55 -10.419 2.398 -7.704
389 HA GLN 55 HA GLN 55 -10.620 -0.353 -7.138
390 HB2 GLN 55 HB2 GLN 55 -11.710 1.329 -9.401
391 HB3 GLN 55 HB3 GLN 55 -12.120 -0.373 -9.171
392 HG2 GLN 55 HG2 GLN 55 -13.067 0.080 -6.992
393 HG3 GLN 55 HG3 GLN 55 -12.492 1.745 -7.037
394 HE21 GLN 55 HE21 GLN 55 -15.323 0.713 -6.843
395 HE22 GLN 55 HE22 GLN 55 -16.142 1.416 -8.155
396 H GLY 56 H GLY 56 -10.055 -2.151 -8.296
397 HA2 GLY 56 HA2 GLY 56 -8.274 -1.839 -10.615
398 HA3 GLY 56 HA3 GLY 56 -7.731 -2.781 -9.228
399 H GLN 57 H GLN 57 -7.628 -4.410 -11.068
400 HA GLN 57 HA GLN 57 -9.963 -5.506 -12.214
401 HB2 GLN 57 HB2 GLN 57 -7.226 -6.671 -11.678
402 HB3 GLN 57 HB3 GLN 57 -8.479 -7.517 -12.588
403 HG2 GLN 57 HG2 GLN 57 -8.565 -5.765 -14.240
404 HG3 GLN 57 HG3 GLN 57 -7.511 -4.734 -13.274
405 HE21 GLN 57 HE21 GLN 57 -7.082 -5.821 -16.062
406 HE22 GLN 57 HE22 GLN 57 -5.612 -6.665 -15.986
407 H LYS 58 H LYS 58 -8.186 -6.283 -9.240
408 HA LYS 58 HA LYS 58 -10.024 -8.437 -8.559
409 HB2 LYS 58 HB2 LYS 58 -7.690 -7.211 -7.079
410 HB3 LYS 58 HB3 LYS 58 -8.643 -8.567 -6.476
411 HG2 LYS 58 HG2 LYS 58 -8.069 -9.872 -8.489
412 HG3 LYS 58 HG3 LYS 58 -7.113 -8.520 -9.094
413 HD2 LYS 58 HD2 LYS 58 -5.652 -8.661 -7.111
414 HD3 LYS 58 HD3 LYS 58 -6.606 -10.015 -6.504
415 HE2 LYS 58 HE2 LYS 58 -6.034 -11.326 -8.512
416 HE3 LYS 58 HE3 LYS 58 -5.086 -9.974 -9.130
417 HZ1 LYS 58 HZ1 LYS 58 -3.683 -10.122 -7.156
418 HZ2 LYS 58 HZ2 LYS 58 -3.671 -11.578 -8.031
419 HZ3 LYS 58 HZ3 LYS 58 -4.580 -11.450 -6.601
420 H GLY 59 H GLY 59 -9.695 -5.040 -7.935
421 HA2 GLY 59 HA2 GLY 59 -12.014 -4.205 -7.120
422 HA3 GLY 59 HA3 GLY 59 -11.608 -5.155 -5.695
423 HA PRO 60 HA PRO 60 -10.094 -0.682 -5.160
424 HB2 PRO 60 HB2 PRO 60 -11.030 -1.303 -2.398
425 HB3 PRO 60 HB3 PRO 60 -11.232 0.178 -3.354
426 HG2 PRO 60 HG2 PRO 60 -13.267 -1.449 -2.998
427 HG3 PRO 60 HG3 PRO 60 -12.977 -0.697 -4.580
428 HD2 PRO 60 HD2 PRO 60 -12.373 -3.514 -3.694
429 HD3 PRO 60 HD3 PRO 60 -13.052 -2.943 -5.238
430 H CYS 61 H CYS 61 -8.245 0.010 -4.157
431 HA CYS 61 HA CYS 61 -6.793 -1.765 -2.338
432 HB2 CYS 61 HB2 CYS 61 -4.752 -1.677 -3.691
433 HB3 CYS 61 HB3 CYS 61 -6.054 -2.426 -4.612
434 HG CYS 61 HG CYS 61 -5.756 -0.644 -6.299
435 H ALA 62 H ALA 62 -4.705 -0.569 -1.593
436 HA ALA 62 HA ALA 62 -5.332 2.326 -1.388
437 HB1 ALA 62 HB1 ALA 62 -4.878 0.334 0.662
438 HB2 ALA 62 HB2 ALA 62 -5.381 2.012 0.832
439 HB3 ALA 62 HB3 ALA 62 -3.667 1.611 0.778
440 H ASN 63 H ASN 63 -3.851 3.671 -2.193
441 HA ASN 63 HA ASN 63 -1.114 2.642 -2.657
442 HB2 ASN 63 HB2 ASN 63 -2.700 4.642 -4.284
443 HB3 ASN 63 HB3 ASN 63 -1.028 4.173 -4.591
444 HD21 ASN 63 HD21 ASN 63 -3.736 3.693 -6.097
445 HD22 ASN 63 HD22 ASN 63 -3.686 2.032 -6.442
446 H LYS 64 H LYS 64 0.584 4.272 -2.646
447 HA LYS 64 HA LYS 64 1.780 5.938 -1.633
448 HB2 LYS 64 HB2 LYS 64 -0.897 7.348 -1.689
449 HB3 LYS 64 HB3 LYS 64 0.639 8.124 -1.311
450 HG2 LYS 64 HG2 LYS 64 1.513 7.542 -3.524
451 HG3 LYS 64 HG3 LYS 64 0.030 6.670 -3.906
452 HD2 LYS 64 HD2 LYS 64 -0.208 8.802 -4.946
453 HD3 LYS 64 HD3 LYS 64 -1.205 8.877 -3.494
454 HE2 LYS 64 HE2 LYS 64 0.100 10.924 -3.649
455 HE3 LYS 64 HE3 LYS 64 0.710 9.970 -2.299
456 HZ1 LYS 64 HZ1 LYS 64 1.888 9.679 -4.984
457 HZ2 LYS 64 HZ2 LYS 64 2.582 9.344 -3.471
458 HZ3 LYS 64 HZ3 LYS 64 2.372 10.953 -3.975
459 H VAL 65 H VAL 65 1.417 4.014 0.037
460 HA VAL 65 HA VAL 65 -0.049 4.632 2.418
461 HB VAL 65 HB VAL 65 2.212 2.652 1.970
462 HG11 VAL 65 HG11 VAL 65 1.220 1.502 3.963
463 HG12 VAL 65 HG12 VAL 65 0.164 2.897 4.198
464 HG13 VAL 65 HG13 VAL 65 1.912 3.077 4.349
465 HG21 VAL 65 HG21 VAL 65 0.061 2.438 0.562
466 HG22 VAL 65 HG22 VAL 65 -0.753 2.057 2.078
467 HG23 VAL 65 HG23 VAL 65 0.552 1.024 1.495
468 H VAL 66 H VAL 66 0.475 6.106 3.850
469 HA VAL 66 HA VAL 66 3.337 6.729 4.343
470 HB VAL 66 HB VAL 66 0.997 8.668 4.414
471 HG11 VAL 66 HG11 VAL 66 3.966 9.097 4.882
472 HG12 VAL 66 HG12 VAL 66 2.694 9.228 6.098
473 HG13 VAL 66 HG13 VAL 66 2.764 10.382 4.767
474 HG21 VAL 66 HG21 VAL 66 1.622 8.135 2.120
475 HG22 VAL 66 HG22 VAL 66 3.331 8.361 2.498
476 HG23 VAL 66 HG23 VAL 66 2.234 9.742 2.513
477 H ALA 67 H ALA 67 3.949 6.222 6.339
478 HA ALA 67 HA ALA 67 2.106 5.354 8.340
479 HB1 ALA 67 HB1 ALA 67 4.289 5.474 9.772
480 HB2 ALA 67 HB2 ALA 67 5.075 5.775 8.223
481 HB3 ALA 67 HB3 ALA 67 4.170 4.282 8.478
482 H VAL 68 H VAL 68 1.303 6.377 10.088
483 HA VAL 68 HA VAL 68 2.014 9.231 10.457
484 HB VAL 68 HB VAL 68 -0.649 7.895 11.060
485 HG11 VAL 68 HG11 VAL 68 -0.095 9.857 12.487
486 HG12 VAL 68 HG12 VAL 68 -1.444 10.193 11.402
487 HG13 VAL 68 HG13 VAL 68 0.162 10.822 11.034
488 HG21 VAL 68 HG21 VAL 68 -1.487 9.199 9.124
489 HG22 VAL 68 HG22 VAL 68 -0.245 8.049 8.628
490 HG23 VAL 68 HG23 VAL 68 0.153 9.758 8.797
Start of MODEL 11
1 H1 MET 1 HT1 MET 1 -5.591 14.216 1.686
2 H2 MET 1 HT2 MET 1 -6.280 13.843 3.192
3 H3 MET 1 HT3 MET 1 -7.276 14.242 1.875
4 HA MET 1 HA MET 1 -7.095 12.225 0.904
5 HB2 MET 1 HB2 MET 1 -5.104 10.768 1.173
6 HB3 MET 1 HB3 MET 1 -4.663 12.372 0.593
7 HG2 MET 1 HG2 MET 1 -4.090 13.029 2.928
8 HG3 MET 1 HG3 MET 1 -4.457 11.389 3.457
9 HE1 MET 1 HE1 MET 1 -2.366 12.680 0.103
10 HE2 MET 1 HE2 MET 1 -0.977 13.053 1.120
11 HE3 MET 1 HE3 MET 1 -2.544 13.765 1.490
12 H SER 2 H SER 2 -7.636 10.084 1.640
13 HA SER 2 HA SER 2 -8.940 10.063 4.174
14 HB2 SER 2 HB2 SER 2 -8.375 7.820 2.226
15 HB3 SER 2 HB3 SER 2 -9.439 7.693 3.624
16 HG SER 2 HG SER 2 -10.826 8.328 2.130
17 H LYS 3 H LYS 3 -8.521 8.770 5.990
18 HA LYS 3 HA LYS 3 -5.831 7.584 6.198
19 HB2 LYS 3 HB2 LYS 3 -5.790 9.893 7.151
20 HB3 LYS 3 HB3 LYS 3 -7.046 9.411 8.289
21 HG2 LYS 3 HG2 LYS 3 -5.526 7.614 9.137
22 HG3 LYS 3 HG3 LYS 3 -4.266 8.216 8.060
23 HD2 LYS 3 HD2 LYS 3 -5.626 9.977 10.113
24 HD3 LYS 3 HD3 LYS 3 -4.162 9.061 10.469
25 HE2 LYS 3 HE2 LYS 3 -3.018 10.195 8.574
26 HE3 LYS 3 HE3 LYS 3 -4.472 11.152 8.292
27 HZ1 LYS 3 HZ1 LYS 3 -4.184 12.330 10.217
28 HZ2 LYS 3 HZ2 LYS 3 -2.563 12.065 9.780
29 HZ3 LYS 3 HZ3 LYS 3 -3.291 11.106 10.979
30 H GLY 4 H GLY 4 -5.933 5.593 6.962
31 HA2 GLY 4 HA2 GLY 4 -8.181 4.827 8.737
32 HA3 GLY 4 HA3 GLY 4 -7.678 3.809 7.388
33 H ILE 5 H ILE 5 -7.677 2.525 9.665
34 HA ILE 5 HA ILE 5 -4.892 2.597 10.674
35 HB ILE 5 HB ILE 5 -5.833 1.343 12.664
36 HG12 ILE 5 HG12 ILE 5 -8.520 2.379 11.717
37 HG13 ILE 5 HG13 ILE 5 -7.998 0.735 11.368
38 HG21 ILE 5 HG21 ILE 5 -6.731 4.156 12.000
39 HG22 ILE 5 HG22 ILE 5 -5.308 3.663 12.917
40 HG23 ILE 5 HG23 ILE 5 -6.917 3.450 13.606
41 HD11 ILE 5 HD11 ILE 5 -9.306 0.687 13.408
42 HD12 ILE 5 HD12 ILE 5 -8.348 1.995 14.104
43 HD13 ILE 5 HD13 ILE 5 -7.619 0.410 13.841
44 H VAL 6 H VAL 6 -3.627 0.962 10.275
45 HA VAL 6 HA VAL 6 -4.402 -1.149 8.568
46 HB VAL 6 HB VAL 6 -1.894 -0.866 10.249
47 HG11 VAL 6 HG11 VAL 6 -2.652 -2.720 7.980
48 HG12 VAL 6 HG12 VAL 6 -1.982 -3.140 9.556
49 HG13 VAL 6 HG13 VAL 6 -0.968 -2.350 8.350
50 HG21 VAL 6 HG21 VAL 6 -0.907 0.182 8.339
51 HG22 VAL 6 HG22 VAL 6 -2.468 0.974 8.555
52 HG23 VAL 6 HG23 VAL 6 -2.269 -0.253 7.305
53 H LYS 7 H LYS 7 -5.433 -2.933 9.019
54 HA LYS 7 HA LYS 7 -6.110 -3.779 11.654
55 HB2 LYS 7 HB2 LYS 7 -7.513 -4.260 9.652
56 HB3 LYS 7 HB3 LYS 7 -6.255 -5.341 9.053
57 HG2 LYS 7 HG2 LYS 7 -6.501 -6.757 11.054
58 HG3 LYS 7 HG3 LYS 7 -7.732 -5.665 11.686
59 HD2 LYS 7 HD2 LYS 7 -9.169 -6.131 9.749
60 HD3 LYS 7 HD3 LYS 7 -7.933 -7.190 9.071
61 HE2 LYS 7 HE2 LYS 7 -9.620 -8.538 10.216
62 HE3 LYS 7 HE3 LYS 7 -8.093 -8.631 11.095
63 HZ1 LYS 7 HZ1 LYS 7 -10.335 -8.121 12.321
64 HZ2 LYS 7 HZ2 LYS 7 -9.995 -6.529 11.832
65 HZ3 LYS 7 HZ3 LYS 7 -8.887 -7.377 12.802
66 H TRP 8 H TRP 8 -3.825 -4.946 9.200
67 HA TRP 8 HA TRP 8 -1.984 -5.904 11.204
68 HB2 TRP 8 HB2 TRP 8 -3.825 -7.716 10.883
69 HB3 TRP 8 HB3 TRP 8 -3.070 -7.993 9.317
70 HD1 TRP 8 HD1 TRP 8 -0.660 -9.068 9.271
71 HE1 TRP 8 HE1 TRP 8 0.717 -10.320 11.055
72 HE3 TRP 8 HE3 TRP 8 -3.310 -7.838 13.457
73 HZ2 TRP 8 HZ2 TRP 8 0.697 -10.746 13.884
74 HZ3 TRP 8 HZ3 TRP 8 -2.613 -8.682 15.680
75 HH2 TRP 8 HH2 TRP 8 -0.615 -10.133 15.899
76 H PHE 9 H PHE 9 0.002 -5.530 10.398
77 HA PHE 9 HA PHE 9 0.313 -5.409 7.442
78 HB2 PHE 9 HB2 PHE 9 0.821 -3.319 8.786
79 HB3 PHE 9 HB3 PHE 9 2.176 -4.200 9.494
80 HD1 PHE 9 HD1 PHE 9 0.856 -2.603 6.471
81 HD2 PHE 9 HD2 PHE 9 4.074 -4.943 8.091
82 HE1 PHE 9 HE1 PHE 9 2.225 -2.106 4.466
83 HE2 PHE 9 HE2 PHE 9 5.445 -4.442 6.086
84 HZ PHE 9 HZ PHE 9 4.522 -3.024 4.274
85 H ASN 10 H ASN 10 1.455 -7.007 6.491
86 HA ASN 10 HA ASN 10 3.484 -8.432 8.115
87 HB2 ASN 10 HB2 ASN 10 1.395 -9.605 6.277
88 HB3 ASN 10 HB3 ASN 10 2.824 -10.497 6.790
89 HD21 ASN 10 HD21 ASN 10 0.106 -11.260 7.481
90 HD22 ASN 10 HD22 ASN 10 -0.043 -11.138 9.167
91 H SER 11 H SER 11 5.250 -7.369 7.216
92 HA SER 11 HA SER 11 5.634 -6.909 4.454
93 HB2 SER 11 HB2 SER 11 7.959 -6.476 5.061
94 HB3 SER 11 HB3 SER 11 6.881 -5.728 6.233
95 HG SER 11 HG SER 11 7.644 -7.011 7.713
96 H ASP 12 H ASP 12 6.234 -9.693 6.507
97 HA ASP 12 HA ASP 12 8.064 -11.113 4.908
98 HB2 ASP 12 HB2 ASP 12 7.381 -11.752 7.227
99 HB3 ASP 12 HB3 ASP 12 5.822 -12.268 6.591
100 H LYS 13 H LYS 13 4.522 -11.100 4.952
101 HA LYS 13 HA LYS 13 4.244 -12.830 2.670
102 HB2 LYS 13 HB2 LYS 13 2.301 -11.001 4.101
103 HB3 LYS 13 HB3 LYS 13 1.853 -12.066 2.771
104 HG2 LYS 13 HG2 LYS 13 2.643 -14.018 4.052
105 HG3 LYS 13 HG3 LYS 13 3.090 -12.957 5.390
106 HD2 LYS 13 HD2 LYS 13 0.741 -12.238 5.615
107 HD3 LYS 13 HD3 LYS 13 0.288 -13.297 4.276
108 HE2 LYS 13 HE2 LYS 13 1.071 -15.255 5.554
109 HE3 LYS 13 HE3 LYS 13 1.532 -14.200 6.891
110 HZ1 LYS 13 HZ1 LYS 13 -1.220 -14.441 5.801
111 HZ2 LYS 13 HZ2 LYS 13 -0.745 -13.536 7.158
112 HZ3 LYS 13 HZ3 LYS 13 -0.662 -15.232 7.195
113 H GLY 14 H GLY 14 4.676 -9.432 3.225
114 HA2 GLY 14 HA2 GLY 14 5.423 -7.873 1.620
115 HA3 GLY 14 HA3 GLY 14 4.830 -8.928 0.346
116 H PHE 15 H PHE 15 2.475 -8.597 2.768
117 HA PHE 15 HA PHE 15 1.345 -6.113 1.811
118 HB2 PHE 15 HB2 PHE 15 -0.753 -7.099 0.972
119 HB3 PHE 15 HB3 PHE 15 0.638 -7.581 0.006
120 HD1 PHE 15 HD1 PHE 15 -1.841 -8.697 2.511
121 HD2 PHE 15 HD2 PHE 15 1.406 -9.877 -0.041
122 HE1 PHE 15 HE1 PHE 15 -2.416 -11.081 2.882
123 HE2 PHE 15 HE2 PHE 15 0.835 -12.260 0.333
124 HZ PHE 15 HZ PHE 15 -1.077 -12.862 1.793
125 H GLY 16 H GLY 16 -0.954 -5.850 2.724
126 HA2 GLY 16 HA2 GLY 16 -1.479 -7.231 5.217
127 HA3 GLY 16 HA3 GLY 16 -0.958 -5.559 5.404
128 H PHE 17 H PHE 17 -3.389 -6.156 6.344
129 HA PHE 17 HA PHE 17 -5.299 -5.136 4.319
130 HB2 PHE 17 HB2 PHE 17 -5.800 -6.830 6.784
131 HB3 PHE 17 HB3 PHE 17 -7.062 -6.163 5.748
132 HD1 PHE 17 HD1 PHE 17 -4.360 -8.645 6.012
133 HD2 PHE 17 HD2 PHE 17 -7.418 -7.009 3.479
134 HE1 PHE 17 HE1 PHE 17 -4.136 -10.589 4.488
135 HE2 PHE 17 HE2 PHE 17 -7.194 -8.953 1.955
136 HZ PHE 17 HZ PHE 17 -5.553 -10.741 2.458
137 H ILE 18 H ILE 18 -6.325 -3.233 4.764
138 HA ILE 18 HA ILE 18 -5.806 -2.043 7.410
139 HB ILE 18 HB ILE 18 -4.579 -0.923 5.610
140 HG12 ILE 18 HG12 ILE 18 -6.837 0.907 6.451
141 HG13 ILE 18 HG13 ILE 18 -5.655 0.312 7.620
142 HG21 ILE 18 HG21 ILE 18 -5.905 -1.303 3.678
143 HG22 ILE 18 HG22 ILE 18 -6.014 0.432 3.966
144 HG23 ILE 18 HG23 ILE 18 -7.347 -0.625 4.433
145 HD11 ILE 18 HD11 ILE 18 -5.066 2.546 6.604
146 HD12 ILE 18 HD12 ILE 18 -4.897 1.725 5.050
147 HD13 ILE 18 HD13 ILE 18 -3.838 1.298 6.392
148 H THR 19 H THR 19 -7.378 -1.075 8.527
149 HA THR 19 HA THR 19 -10.110 -1.668 7.700
150 HB THR 19 HB THR 19 -9.024 -0.729 10.357
151 HG1 THR 19 HG1 THR 19 -9.736 -3.298 9.390
152 HG21 THR 19 HG21 THR 19 -11.412 -0.232 10.096
153 HG22 THR 19 HG22 THR 19 -11.204 -1.578 11.215
154 HG23 THR 19 HG23 THR 19 -11.716 -1.883 9.555
155 HA PRO 20 HA PRO 20 -10.337 2.781 6.478
156 HB2 PRO 20 HB2 PRO 20 -13.191 1.943 6.127
157 HB3 PRO 20 HB3 PRO 20 -12.152 2.872 5.029
158 HG2 PRO 20 HG2 PRO 20 -12.691 0.358 4.503
159 HG3 PRO 20 HG3 PRO 20 -11.044 0.982 4.271
160 HD2 PRO 20 HD2 PRO 20 -12.113 -0.725 6.502
161 HD3 PRO 20 HD3 PRO 20 -10.541 -0.809 5.670
162 H GLU 21 H GLU 21 -10.665 4.438 7.895
163 HA GLU 21 HA GLU 21 -11.747 4.070 10.467
164 HB2 GLU 21 HB2 GLU 21 -11.561 6.507 10.706
165 HB3 GLU 21 HB3 GLU 21 -10.117 5.838 9.948
166 HG2 GLU 21 HG2 GLU 21 -10.916 6.517 7.739
167 HG3 GLU 21 HG3 GLU 21 -12.431 7.087 8.431
168 H ASP 22 H ASP 22 -13.230 5.080 7.462
169 HA ASP 22 HA ASP 22 -15.631 6.159 8.554
170 HB2 ASP 22 HB2 ASP 22 -14.927 5.084 5.822
171 HB3 ASP 22 HB3 ASP 22 -16.500 5.774 6.203
172 H GLY 23 H GLY 23 -14.518 2.925 8.093
173 HA2 GLY 23 HA2 GLY 23 -15.639 1.085 9.168
174 HA3 GLY 23 HA3 GLY 23 -17.172 1.889 8.863
175 H SER 24 H SER 24 -15.137 2.130 6.171
176 HA SER 24 HA SER 24 -16.785 0.456 4.553
177 HB2 SER 24 HB2 SER 24 -14.154 1.830 3.979
178 HB3 SER 24 HB3 SER 24 -15.143 1.023 2.772
179 HG SER 24 HG SER 24 -15.957 2.992 2.668
180 H LYS 25 H LYS 25 -15.712 -1.165 3.052
181 HA LYS 25 HA LYS 25 -14.744 -3.347 4.565
182 HB2 LYS 25 HB2 LYS 25 -14.800 -2.864 1.580
183 HB3 LYS 25 HB3 LYS 25 -14.358 -4.403 2.322
184 HG2 LYS 25 HG2 LYS 25 -16.555 -4.496 3.441
185 HG3 LYS 25 HG3 LYS 25 -17.002 -2.963 2.693
186 HD2 LYS 25 HD2 LYS 25 -16.721 -3.981 0.454
187 HD3 LYS 25 HD3 LYS 25 -16.306 -5.519 1.212
188 HE2 LYS 25 HE2 LYS 25 -18.930 -4.050 1.612
189 HE3 LYS 25 HE3 LYS 25 -18.700 -5.419 0.523
190 HZ1 LYS 25 HZ1 LYS 25 -17.861 -6.652 2.535
191 HZ2 LYS 25 HZ2 LYS 25 -19.523 -6.307 2.518
192 HZ3 LYS 25 HZ3 LYS 25 -18.471 -5.378 3.475
193 H ASP 26 H ASP 26 -12.712 -4.365 4.566
194 HA ASP 26 HA ASP 26 -10.497 -2.735 4.885
195 HB2 ASP 26 HB2 ASP 26 -9.166 -4.788 4.880
196 HB3 ASP 26 HB3 ASP 26 -10.649 -5.006 5.799
197 H LEU 27 H LEU 27 -8.601 -2.406 3.670
198 HA LEU 27 HA LEU 27 -8.950 -2.686 0.743
199 HB2 LEU 27 HB2 LEU 27 -8.078 -0.418 2.469
200 HB3 LEU 27 HB3 LEU 27 -7.194 -0.628 0.968
201 HG LEU 27 HG LEU 27 -9.073 0.957 0.715
202 HD11 LEU 27 HD11 LEU 27 -8.312 -0.641 -1.139
203 HD12 LEU 27 HD12 LEU 27 -9.883 0.130 -1.342
204 HD13 LEU 27 HD13 LEU 27 -9.787 -1.546 -0.806
205 HD21 LEU 27 HD21 LEU 27 -10.922 -1.392 1.220
206 HD22 LEU 27 HD22 LEU 27 -11.378 0.288 0.938
207 HD23 LEU 27 HD23 LEU 27 -10.559 -0.163 2.432
208 H PHE 28 H PHE 28 -7.191 -3.307 -0.482
209 HA PHE 28 HA PHE 28 -5.155 -4.836 0.904
210 HB2 PHE 28 HB2 PHE 28 -5.734 -4.355 -2.026
211 HB3 PHE 28 HB3 PHE 28 -4.416 -5.377 -1.444
212 HD1 PHE 28 HD1 PHE 28 -8.072 -5.009 -1.717
213 HD2 PHE 28 HD2 PHE 28 -4.861 -7.504 -0.336
214 HE1 PHE 28 HE1 PHE 28 -9.658 -6.896 -1.443
215 HE2 PHE 28 HE2 PHE 28 -6.446 -9.392 -0.062
216 HZ PHE 28 HZ PHE 28 -8.844 -9.087 -0.615
217 H VAL 29 H VAL 29 -3.176 -4.160 1.404
218 HA VAL 29 HA VAL 29 -2.012 -1.874 -0.058
219 HB VAL 29 HB VAL 29 -2.050 -2.276 2.943
220 HG11 VAL 29 HG11 VAL 29 0.107 -1.379 2.480
221 HG12 VAL 29 HG12 VAL 29 -0.877 0.032 2.868
222 HG13 VAL 29 HG13 VAL 29 -0.513 -0.356 1.186
223 HG21 VAL 29 HG21 VAL 29 -4.090 -1.289 1.733
224 HG22 VAL 29 HG22 VAL 29 -3.053 0.088 1.358
225 HG23 VAL 29 HG23 VAL 29 -3.397 -0.324 3.036
226 H HIS 30 H HIS 30 0.062 -2.154 -0.668
227 HA HIS 30 HA HIS 30 1.444 -4.612 0.230
228 HB2 HIS 30 HB2 HIS 30 1.736 -3.041 -2.345
229 HB3 HIS 30 HB3 HIS 30 2.688 -4.462 -1.913
230 HD2 HIS 30 HD2 HIS 30 -0.651 -3.656 -3.607
231 HE1 HIS 30 HE1 HIS 30 -0.832 -7.742 -2.562
232 HE2 HIS 30 HE2 HIS 30 -1.954 -5.899 -3.902
233 H HIS 31 H HIS 31 3.757 -4.517 0.466
234 HA HIS 31 HA HIS 31 4.687 -2.305 1.970
235 HB2 HIS 31 HB2 HIS 31 5.581 -4.639 2.152
236 HB3 HIS 31 HB3 HIS 31 6.369 -4.414 0.588
237 HD2 HIS 31 HD2 HIS 31 6.827 -3.275 4.320
238 HE1 HIS 31 HE1 HIS 31 10.024 -1.675 2.070
239 HE2 HIS 31 HE2 HIS 31 9.113 -2.018 4.415
240 H SER 32 H SER 32 5.225 -3.320 -1.372
241 HA SER 32 HA SER 32 7.062 -1.341 -2.146
242 HB2 SER 32 HB2 SER 32 5.013 -2.862 -3.764
243 HB3 SER 32 HB3 SER 32 6.269 -1.846 -4.467
244 HG SER 32 HG SER 32 7.365 -3.653 -4.342
245 H GLU 33 H GLU 33 3.524 -1.336 -2.090
246 HA GLU 33 HA GLU 33 3.177 1.112 -3.503
247 HB2 GLU 33 HB2 GLU 33 1.380 -0.405 -1.606
248 HB3 GLU 33 HB3 GLU 33 0.874 1.045 -2.471
249 HG2 GLU 33 HG2 GLU 33 1.886 -1.503 -3.771
250 HG3 GLU 33 HG3 GLU 33 0.197 -1.016 -3.668
251 H ILE 34 H ILE 34 3.933 0.391 -0.172
252 HA ILE 34 HA ILE 34 3.365 3.165 0.633
253 HB ILE 34 HB ILE 34 2.489 1.420 2.119
254 HG12 ILE 34 HG12 ILE 34 4.869 2.729 3.474
255 HG13 ILE 34 HG13 ILE 34 3.417 3.618 3.030
256 HG21 ILE 34 HG21 ILE 34 4.064 -0.368 1.646
257 HG22 ILE 34 HG22 ILE 34 4.080 -0.036 3.377
258 HG23 ILE 34 HG23 ILE 34 5.388 0.556 2.354
259 HD11 ILE 34 HD11 ILE 34 2.179 1.709 4.363
260 HD12 ILE 34 HD12 ILE 34 2.947 3.029 5.240
261 HD13 ILE 34 HD13 ILE 34 3.760 1.472 5.103
262 H GLN 35 H GLN 35 4.915 4.608 1.046
263 HA GLN 35 HA GLN 35 7.663 3.940 0.353
264 HB2 GLN 35 HB2 GLN 35 6.529 6.045 -0.435
265 HB3 GLN 35 HB3 GLN 35 6.517 6.603 1.236
266 HG2 GLN 35 HG2 GLN 35 8.457 7.538 0.080
267 HG3 GLN 35 HG3 GLN 35 8.998 6.388 1.298
268 HE21 GLN 35 HE21 GLN 35 10.706 5.175 0.480
269 HE22 GLN 35 HE22 GLN 35 10.817 4.598 -1.112
270 H SER 36 H SER 36 9.262 3.584 1.771
271 HA SER 36 HA SER 36 8.694 3.994 4.645
272 HB2 SER 36 HB2 SER 36 10.595 2.081 3.274
273 HB3 SER 36 HB3 SER 36 10.441 2.268 5.018
274 HG SER 36 HG SER 36 8.360 1.524 4.899
275 H GLY 37 H GLY 37 10.009 5.207 5.875
276 HA2 GLY 37 HA2 GLY 37 11.713 7.133 4.723
277 HA3 GLY 37 HA3 GLY 37 11.608 6.759 6.441
278 H GLY 38 H GLY 38 12.384 4.038 6.310
279 HA2 GLY 38 HA2 GLY 38 14.834 3.627 4.933
280 HA3 GLY 38 HA3 GLY 38 15.152 4.191 6.570
281 H GLU 39 H GLU 39 16.192 2.021 6.690
282 HA GLU 39 HA GLU 39 14.748 -0.396 6.599
283 HB2 GLU 39 HB2 GLU 39 17.238 0.393 8.122
284 HB3 GLU 39 HB3 GLU 39 16.602 -1.251 8.095
285 HG2 GLU 39 HG2 GLU 39 18.177 -1.257 6.347
286 HG3 GLU 39 HG3 GLU 39 16.649 -1.010 5.510
287 H TYR 40 H TYR 40 15.309 1.916 9.220
288 HA TYR 40 HA TYR 40 14.216 0.398 11.336
289 HB2 TYR 40 HB2 TYR 40 14.358 3.393 10.941
290 HB3 TYR 40 HB3 TYR 40 13.905 2.607 12.452
291 HD1 TYR 40 HD1 TYR 40 16.657 3.331 10.128
292 HD2 TYR 40 HD2 TYR 40 15.541 1.311 13.750
293 HE1 TYR 40 HE1 TYR 40 19.052 3.055 10.710
294 HE2 TYR 40 HE2 TYR 40 17.936 1.035 14.334
295 HH TYR 40 HH TYR 40 20.245 2.629 13.416
296 H ALA 41 H ALA 41 12.753 2.631 9.008
297 HA ALA 41 HA ALA 41 10.197 2.823 10.144
298 HB1 ALA 41 HB1 ALA 41 10.802 2.800 7.182
299 HB2 ALA 41 HB2 ALA 41 11.110 4.190 8.223
300 HB3 ALA 41 HB3 ALA 41 9.460 3.602 8.000
301 H THR 42 H THR 42 8.596 1.442 10.354
302 HA THR 42 HA THR 42 8.238 -0.781 8.498
303 HB THR 42 HB THR 42 9.787 -1.697 10.179
304 HG1 THR 42 HG1 THR 42 8.392 -3.432 10.823
305 HG21 THR 42 HG21 THR 42 7.602 -1.004 12.166
306 HG22 THR 42 HG22 THR 42 9.197 -0.256 12.080
307 HG23 THR 42 HG23 THR 42 9.043 -1.955 12.524
308 H LEU 43 H LEU 43 6.288 -2.167 9.393
309 HA LEU 43 HA LEU 43 4.248 -0.448 10.619
310 HB2 LEU 43 HB2 LEU 43 3.974 -1.825 7.942
311 HB3 LEU 43 HB3 LEU 43 2.606 -1.226 8.874
312 HG LEU 43 HG LEU 43 4.139 1.018 8.889
313 HD11 LEU 43 HD11 LEU 43 5.856 -0.290 7.462
314 HD12 LEU 43 HD12 LEU 43 5.407 1.325 6.919
315 HD13 LEU 43 HD13 LEU 43 4.711 -0.094 6.138
316 HD21 LEU 43 HD21 LEU 43 2.700 1.891 7.196
317 HD22 LEU 43 HD22 LEU 43 1.763 0.639 8.010
318 HD23 LEU 43 HD23 LEU 43 2.502 0.308 6.444
319 H ALA 44 H ALA 44 2.528 -1.629 11.590
320 HA ALA 44 HA ALA 44 2.747 -4.553 11.651
321 HB1 ALA 44 HB1 ALA 44 4.213 -3.389 13.466
322 HB2 ALA 44 HB2 ALA 44 3.173 -4.727 13.951
323 HB3 ALA 44 HB3 ALA 44 2.677 -3.065 14.267
324 H ASP 45 H ASP 45 0.975 -4.608 14.104
325 HA ASP 45 HA ASP 45 -1.545 -4.259 12.712
326 HB2 ASP 45 HB2 ASP 45 -1.097 -6.282 14.056
327 HB3 ASP 45 HB3 ASP 45 -0.928 -5.286 15.494
328 H GLY 46 H GLY 46 -2.437 -2.285 12.694
329 HA2 GLY 46 HA2 GLY 46 -3.766 -0.678 13.905
330 HA3 GLY 46 HA3 GLY 46 -2.632 -0.804 15.240
331 H GLN 47 H GLN 47 -0.878 -0.688 12.377
332 HA GLN 47 HA GLN 47 0.261 1.834 12.911
333 HB2 GLN 47 HB2 GLN 47 1.349 -0.016 11.623
334 HB3 GLN 47 HB3 GLN 47 0.263 0.336 10.278
335 HG2 GLN 47 HG2 GLN 47 2.396 1.468 9.917
336 HG3 GLN 47 HG3 GLN 47 1.141 2.657 10.210
337 HE21 GLN 47 HE21 GLN 47 2.010 4.315 11.460
338 HE22 GLN 47 HE22 GLN 47 3.042 4.089 12.788
339 H THR 48 H THR 48 -0.280 3.839 12.340
340 HA THR 48 HA THR 48 -2.782 4.281 10.895
341 HB THR 48 HB THR 48 -0.929 6.266 12.252
342 HG1 THR 48 HG1 THR 48 -2.642 6.144 13.852
343 HG21 THR 48 HG21 THR 48 -2.779 7.812 12.123
344 HG22 THR 48 HG22 THR 48 -3.846 6.563 11.483
345 HG23 THR 48 HG23 THR 48 -2.517 7.176 10.499
346 H VAL 49 H VAL 49 -2.891 4.786 8.811
347 HA VAL 49 HA VAL 49 -0.623 6.152 7.516
348 HB VAL 49 HB VAL 49 -0.679 4.602 5.597
349 HG11 VAL 49 HG11 VAL 49 0.596 2.871 6.612
350 HG12 VAL 49 HG12 VAL 49 -0.288 2.999 8.132
351 HG13 VAL 49 HG13 VAL 49 0.824 4.275 7.650
352 HG21 VAL 49 HG21 VAL 49 -2.979 3.782 5.808
353 HG22 VAL 49 HG22 VAL 49 -2.586 3.015 7.346
354 HG23 VAL 49 HG23 VAL 49 -1.858 2.423 5.853
355 H GLU 50 H GLU 50 -1.200 6.858 5.256
356 HA GLU 50 HA GLU 50 -4.067 7.573 5.060
357 HB2 GLU 50 HB2 GLU 50 -1.668 9.229 4.217
358 HB3 GLU 50 HB3 GLU 50 -3.356 9.667 3.948
359 HG2 GLU 50 HG2 GLU 50 -3.746 9.661 6.388
360 HG3 GLU 50 HG3 GLU 50 -2.058 9.229 6.655
361 H TYR 51 H TYR 51 -5.029 7.050 3.152
362 HA TYR 51 HA TYR 51 -3.395 6.469 0.791
363 HB2 TYR 51 HB2 TYR 51 -4.348 4.210 0.521
364 HB3 TYR 51 HB3 TYR 51 -3.396 4.339 1.994
365 HD1 TYR 51 HD1 TYR 51 -6.799 4.055 0.605
366 HD2 TYR 51 HD2 TYR 51 -4.461 4.301 4.200
367 HE1 TYR 51 HE1 TYR 51 -8.770 3.352 1.935
368 HE2 TYR 51 HE2 TYR 51 -6.431 3.596 5.529
369 HH TYR 51 HH TYR 51 -9.594 3.496 4.215
370 H GLU 52 H GLU 52 -4.726 5.822 -1.096
371 HA GLU 52 HA GLU 52 -7.373 7.160 -1.055
372 HB2 GLU 52 HB2 GLU 52 -5.338 7.002 -3.295
373 HB3 GLU 52 HB3 GLU 52 -6.981 7.623 -3.481
374 HG2 GLU 52 HG2 GLU 52 -6.521 9.328 -1.744
375 HG3 GLU 52 HG3 GLU 52 -4.876 8.723 -1.592
376 H VAL 53 H VAL 53 -9.070 6.013 -1.799
377 HA VAL 53 HA VAL 53 -8.721 3.176 -2.250
378 HB VAL 53 HB VAL 53 -10.564 4.059 -0.865
379 HG11 VAL 53 HG11 VAL 53 -12.367 5.325 -1.750
380 HG12 VAL 53 HG12 VAL 53 -11.852 5.049 -3.414
381 HG13 VAL 53 HG13 VAL 53 -10.913 6.111 -2.364
382 HG21 VAL 53 HG21 VAL 53 -11.303 2.549 -3.382
383 HG22 VAL 53 HG22 VAL 53 -12.433 2.783 -2.047
384 HG23 VAL 53 HG23 VAL 53 -10.936 1.886 -1.789
385 H GLY 54 H GLY 54 -8.303 2.314 -4.126
386 HA2 GLY 54 HA2 GLY 54 -9.184 3.640 -6.615
387 HA3 GLY 54 HA3 GLY 54 -7.763 2.600 -6.482
388 H GLN 55 H GLN 55 -9.021 1.572 -8.367
389 HA GLN 55 HA GLN 55 -10.788 -0.527 -7.254
390 HB2 GLN 55 HB2 GLN 55 -11.107 0.996 -9.850
391 HB3 GLN 55 HB3 GLN 55 -11.982 -0.491 -9.475
392 HG2 GLN 55 HG2 GLN 55 -13.024 0.534 -7.548
393 HG3 GLN 55 HG3 GLN 55 -12.024 1.974 -7.712
394 HE21 GLN 55 HE21 GLN 55 -15.035 1.710 -7.845
395 HE22 GLN 55 HE22 GLN 55 -15.468 2.373 -9.346
396 H GLY 56 H GLY 56 -10.690 -2.567 -8.303
397 HA2 GLY 56 HA2 GLY 56 -8.823 -3.087 -10.431
398 HA3 GLY 56 HA3 GLY 56 -8.232 -3.622 -8.861
399 H GLN 57 H GLN 57 -8.471 -5.577 -10.572
400 HA GLN 57 HA GLN 57 -10.992 -6.803 -10.912
401 HB2 GLN 57 HB2 GLN 57 -8.186 -7.923 -10.881
402 HB3 GLN 57 HB3 GLN 57 -9.608 -8.887 -11.280
403 HG2 GLN 57 HG2 GLN 57 -10.140 -7.455 -13.150
404 HG3 GLN 57 HG3 GLN 57 -8.889 -6.304 -12.688
405 HE21 GLN 57 HE21 GLN 57 -9.160 -7.893 -15.242
406 HE22 GLN 57 HE22 GLN 57 -7.707 -8.760 -15.381
407 H LYS 58 H LYS 58 -8.559 -7.051 -8.360
408 HA LYS 58 HA LYS 58 -10.091 -9.062 -6.907
409 HB2 LYS 58 HB2 LYS 58 -7.501 -7.637 -6.261
410 HB3 LYS 58 HB3 LYS 58 -8.226 -8.892 -5.258
411 HG2 LYS 58 HG2 LYS 58 -8.158 -10.437 -7.231
412 HG3 LYS 58 HG3 LYS 58 -7.296 -9.191 -8.131
413 HD2 LYS 58 HD2 LYS 58 -6.306 -10.286 -5.485
414 HD3 LYS 58 HD3 LYS 58 -5.825 -10.960 -7.039
415 HE2 LYS 58 HE2 LYS 58 -4.974 -8.720 -7.719
416 HE3 LYS 58 HE3 LYS 58 -5.393 -8.100 -6.122
417 HZ1 LYS 58 HZ1 LYS 58 -3.181 -8.671 -5.900
418 HZ2 LYS 58 HZ2 LYS 58 -3.326 -10.066 -6.859
419 HZ3 LYS 58 HZ3 LYS 58 -3.965 -10.044 -5.286
420 H GLY 59 H GLY 59 -11.011 -6.159 -7.353
421 HA2 GLY 59 HA2 GLY 59 -12.604 -4.999 -6.046
422 HA3 GLY 59 HA3 GLY 59 -11.904 -5.713 -4.596
423 HA PRO 60 HA PRO 60 -10.448 -1.203 -5.294
424 HB2 PRO 60 HB2 PRO 60 -11.251 -1.067 -2.426
425 HB3 PRO 60 HB3 PRO 60 -11.459 0.136 -3.712
426 HG2 PRO 60 HG2 PRO 60 -13.509 -1.275 -2.864
427 HG3 PRO 60 HG3 PRO 60 -13.287 -0.937 -4.592
428 HD2 PRO 60 HD2 PRO 60 -12.732 -3.487 -3.083
429 HD3 PRO 60 HD3 PRO 60 -13.448 -3.272 -4.699
430 H CYS 61 H CYS 61 -8.579 -0.267 -4.499
431 HA CYS 61 HA CYS 61 -6.992 -1.813 -2.541
432 HB2 CYS 61 HB2 CYS 61 -5.008 -1.625 -3.965
433 HB3 CYS 61 HB3 CYS 61 -6.285 -2.492 -4.814
434 HG CYS 61 HG CYS 61 -5.010 -0.070 -5.887
435 H ALA 62 H ALA 62 -4.944 -0.483 -1.939
436 HA ALA 62 HA ALA 62 -5.708 2.375 -1.750
437 HB1 ALA 62 HB1 ALA 62 -5.831 1.827 0.459
438 HB2 ALA 62 HB2 ALA 62 -4.082 2.036 0.386
439 HB3 ALA 62 HB3 ALA 62 -4.788 0.423 0.278
440 H ASN 63 H ASN 63 -4.242 3.825 -2.511
441 HA ASN 63 HA ASN 63 -1.484 2.863 -3.001
442 HB2 ASN 63 HB2 ASN 63 -1.472 4.285 -5.032
443 HB3 ASN 63 HB3 ASN 63 -2.666 2.991 -5.130
444 HD21 ASN 63 HD21 ASN 63 -4.455 3.851 -6.206
445 HD22 ASN 63 HD22 ASN 63 -5.162 5.354 -5.855
446 H LYS 64 H LYS 64 0.037 4.775 -3.353
447 HA LYS 64 HA LYS 64 1.133 6.546 -2.388
448 HB2 LYS 64 HB2 LYS 64 -1.689 7.643 -2.425
449 HB3 LYS 64 HB3 LYS 64 -0.266 8.602 -2.013
450 HG2 LYS 64 HG2 LYS 64 0.725 7.955 -4.238
451 HG3 LYS 64 HG3 LYS 64 -0.804 7.180 -4.642
452 HD2 LYS 64 HD2 LYS 64 -0.602 10.093 -3.834
453 HD3 LYS 64 HD3 LYS 64 -0.522 9.559 -5.511
454 HE2 LYS 64 HE2 LYS 64 -2.745 8.470 -5.242
455 HE3 LYS 64 HE3 LYS 64 -2.827 9.088 -3.593
456 HZ1 LYS 64 HZ1 LYS 64 -2.286 10.972 -5.771
457 HZ2 LYS 64 HZ2 LYS 64 -3.103 11.221 -4.301
458 HZ3 LYS 64 HZ3 LYS 64 -3.872 10.405 -5.577
459 H VAL 65 H VAL 65 0.803 4.528 -0.683
460 HA VAL 65 HA VAL 65 -0.489 5.354 1.758
461 HB VAL 65 HB VAL 65 1.343 3.002 1.211
462 HG11 VAL 65 HG11 VAL 65 1.179 3.631 3.619
463 HG12 VAL 65 HG12 VAL 65 0.430 2.069 3.282
464 HG13 VAL 65 HG13 VAL 65 -0.575 3.499 3.509
465 HG21 VAL 65 HG21 VAL 65 -1.675 3.027 1.470
466 HG22 VAL 65 HG22 VAL 65 -0.651 1.705 0.914
467 HG23 VAL 65 HG23 VAL 65 -0.853 3.142 -0.086
468 H VAL 66 H VAL 66 0.329 6.592 3.233
469 HA VAL 66 HA VAL 66 3.269 6.785 3.551
470 HB VAL 66 HB VAL 66 2.429 8.787 2.376
471 HG11 VAL 66 HG11 VAL 66 0.928 10.356 3.572
472 HG12 VAL 66 HG12 VAL 66 0.723 9.163 4.854
473 HG13 VAL 66 HG13 VAL 66 0.138 8.819 3.226
474 HG21 VAL 66 HG21 VAL 66 3.328 10.482 3.960
475 HG22 VAL 66 HG22 VAL 66 4.344 9.044 3.879
476 HG23 VAL 66 HG23 VAL 66 3.264 9.284 5.251
477 H ALA 67 H ALA 67 4.019 6.603 5.576
478 HA ALA 67 HA ALA 67 2.292 5.719 7.660
479 HB1 ALA 67 HB1 ALA 67 5.222 6.448 7.619
480 HB2 ALA 67 HB2 ALA 67 4.514 4.833 7.563
481 HB3 ALA 67 HB3 ALA 67 4.401 5.795 9.037
482 H VAL 68 H VAL 68 1.372 6.761 9.282
483 HA VAL 68 HA VAL 68 0.423 8.560 10.371
484 HB VAL 68 HB VAL 68 2.043 9.772 11.792
485 HG11 VAL 68 HG11 VAL 68 2.794 7.849 13.015
486 HG12 VAL 68 HG12 VAL 68 2.781 6.846 11.563
487 HG13 VAL 68 HG13 VAL 68 1.261 7.408 12.261
488 HG21 VAL 68 HG21 VAL 68 3.827 9.908 9.983
489 HG22 VAL 68 HG22 VAL 68 4.187 8.215 10.323
490 HG23 VAL 68 HG23 VAL 68 4.414 9.433 11.577
Start of MODEL 12
1 H1 MET 1 HT1 MET 1 -10.143 13.412 4.334
2 H2 MET 1 HT2 MET 1 -10.495 11.749 4.367
3 H3 MET 1 HT3 MET 1 -9.386 12.363 3.236
4 HA MET 1 HA MET 1 -8.148 13.183 5.373
5 HB2 MET 1 HB2 MET 1 -10.030 12.322 6.816
6 HB3 MET 1 HB3 MET 1 -9.585 10.688 6.324
7 HG2 MET 1 HG2 MET 1 -7.318 11.025 7.237
8 HG3 MET 1 HG3 MET 1 -7.754 12.662 7.725
9 HE1 MET 1 HE1 MET 1 -10.806 12.346 8.978
10 HE2 MET 1 HE2 MET 1 -9.372 13.348 9.184
11 HE3 MET 1 HE3 MET 1 -10.035 12.478 10.565
12 H SER 2 H SER 2 -9.113 10.146 3.813
13 HA SER 2 HA SER 2 -7.908 8.429 2.884
14 HB2 SER 2 HB2 SER 2 -5.872 10.644 2.535
15 HB3 SER 2 HB3 SER 2 -5.831 9.087 1.715
16 HG SER 2 HG SER 2 -6.845 10.804 0.503
17 H LYS 3 H LYS 3 -7.856 8.502 5.646
18 HA LYS 3 HA LYS 3 -5.299 7.175 6.191
19 HB2 LYS 3 HB2 LYS 3 -5.088 9.558 6.946
20 HB3 LYS 3 HB3 LYS 3 -6.436 9.283 8.047
21 HG2 LYS 3 HG2 LYS 3 -5.127 7.414 9.091
22 HG3 LYS 3 HG3 LYS 3 -3.763 7.843 8.058
23 HD2 LYS 3 HD2 LYS 3 -5.083 9.835 9.916
24 HD3 LYS 3 HD3 LYS 3 -3.724 8.830 10.414
25 HE2 LYS 3 HE2 LYS 3 -2.385 9.746 8.529
26 HE3 LYS 3 HE3 LYS 3 -3.738 10.793 8.100
27 HZ1 LYS 3 HZ1 LYS 3 -1.905 11.734 9.591
28 HZ2 LYS 3 HZ2 LYS 3 -2.612 10.806 10.828
29 HZ3 LYS 3 HZ3 LYS 3 -3.516 12.012 10.043
30 H GLY 4 H GLY 4 -5.697 5.267 7.083
31 HA2 GLY 4 HA2 GLY 4 -8.075 4.929 8.810
32 HA3 GLY 4 HA3 GLY 4 -7.677 3.753 7.557
33 H ILE 5 H ILE 5 -7.748 2.388 9.643
34 HA ILE 5 HA ILE 5 -5.041 2.378 10.857
35 HB ILE 5 HB ILE 5 -6.135 1.165 12.792
36 HG12 ILE 5 HG12 ILE 5 -8.726 2.309 11.709
37 HG13 ILE 5 HG13 ILE 5 -8.251 0.645 11.385
38 HG21 ILE 5 HG21 ILE 5 -7.160 3.303 13.700
39 HG22 ILE 5 HG22 ILE 5 -6.907 4.011 12.104
40 HG23 ILE 5 HG23 ILE 5 -5.526 3.470 13.058
41 HD11 ILE 5 HD11 ILE 5 -8.489 1.851 14.158
42 HD12 ILE 5 HD12 ILE 5 -8.155 0.162 13.777
43 HD13 ILE 5 HD13 ILE 5 -9.730 0.858 13.391
44 H VAL 6 H VAL 6 -3.830 0.666 10.553
45 HA VAL 6 HA VAL 6 -4.655 -1.380 8.775
46 HB VAL 6 HB VAL 6 -2.188 -1.238 10.527
47 HG11 VAL 6 HG11 VAL 6 -1.296 -2.738 8.601
48 HG12 VAL 6 HG12 VAL 6 -2.994 -3.042 8.239
49 HG13 VAL 6 HG13 VAL 6 -2.335 -3.491 9.811
50 HG21 VAL 6 HG21 VAL 6 -1.093 -0.225 8.653
51 HG22 VAL 6 HG22 VAL 6 -2.610 0.652 8.848
52 HG23 VAL 6 HG23 VAL 6 -2.454 -0.566 7.583
53 H LYS 7 H LYS 7 -5.724 -3.166 9.163
54 HA LYS 7 HA LYS 7 -6.566 -3.972 11.762
55 HB2 LYS 7 HB2 LYS 7 -7.832 -4.443 9.648
56 HB3 LYS 7 HB3 LYS 7 -6.580 -5.605 9.205
57 HG2 LYS 7 HG2 LYS 7 -7.037 -6.872 11.294
58 HG3 LYS 7 HG3 LYS 7 -8.322 -5.733 11.689
59 HD2 LYS 7 HD2 LYS 7 -8.276 -7.305 9.102
60 HD3 LYS 7 HD3 LYS 7 -9.070 -7.898 10.558
61 HE2 LYS 7 HE2 LYS 7 -10.457 -5.825 10.610
62 HE3 LYS 7 HE3 LYS 7 -9.704 -5.313 9.100
63 HZ1 LYS 7 HZ1 LYS 7 -11.373 -7.723 9.548
64 HZ2 LYS 7 HZ2 LYS 7 -10.498 -7.436 8.120
65 HZ3 LYS 7 HZ3 LYS 7 -11.748 -6.381 8.580
66 H TRP 8 H TRP 8 -4.162 -5.190 9.459
67 HA TRP 8 HA TRP 8 -2.453 -6.166 11.559
68 HB2 TRP 8 HB2 TRP 8 -4.298 -7.951 11.180
69 HB3 TRP 8 HB3 TRP 8 -3.484 -8.261 9.650
70 HD1 TRP 8 HD1 TRP 8 -1.072 -9.355 9.730
71 HE1 TRP 8 HE1 TRP 8 0.199 -10.610 11.589
72 HE3 TRP 8 HE3 TRP 8 -3.926 -8.076 13.769
73 HZ2 TRP 8 HZ2 TRP 8 0.026 -11.021 14.414
74 HZ3 TRP 8 HZ3 TRP 8 -3.353 -8.916 16.028
75 HH2 TRP 8 HH2 TRP 8 -1.382 -10.385 16.356
76 H PHE 9 H PHE 9 -0.434 -5.765 10.842
77 HA PHE 9 HA PHE 9 0.015 -5.717 7.904
78 HB2 PHE 9 HB2 PHE 9 0.470 -3.603 9.243
79 HB3 PHE 9 HB3 PHE 9 1.797 -4.478 10.008
80 HD1 PHE 9 HD1 PHE 9 0.576 -2.944 6.908
81 HD2 PHE 9 HD2 PHE 9 3.748 -5.222 8.698
82 HE1 PHE 9 HE1 PHE 9 2.016 -2.483 4.943
83 HE2 PHE 9 HE2 PHE 9 5.187 -4.758 6.734
84 HZ PHE 9 HZ PHE 9 4.324 -3.389 4.856
85 H ASN 10 H ASN 10 1.188 -7.332 7.041
86 HA ASN 10 HA ASN 10 3.106 -8.761 8.791
87 HB2 ASN 10 HB2 ASN 10 1.179 -9.892 6.760
88 HB3 ASN 10 HB3 ASN 10 2.555 -10.801 7.384
89 HD21 ASN 10 HD21 ASN 10 -0.237 -11.537 7.821
90 HD22 ASN 10 HD22 ASN 10 -0.526 -11.444 9.492
91 H SER 11 H SER 11 4.911 -7.631 8.058
92 HA SER 11 HA SER 11 5.522 -7.092 5.366
93 HB2 SER 11 HB2 SER 11 7.792 -6.672 6.182
94 HB3 SER 11 HB3 SER 11 6.604 -5.962 7.269
95 HG SER 11 HG SER 11 7.343 -7.213 8.776
96 H ASP 12 H ASP 12 6.104 -9.929 7.389
97 HA ASP 12 HA ASP 12 8.032 -11.228 5.796
98 HB2 ASP 12 HB2 ASP 12 5.854 -12.328 7.588
99 HB3 ASP 12 HB3 ASP 12 7.064 -13.346 6.810
100 H LYS 13 H LYS 13 4.494 -11.256 5.701
101 HA LYS 13 HA LYS 13 4.320 -12.999 3.416
102 HB2 LYS 13 HB2 LYS 13 2.310 -11.178 4.763
103 HB3 LYS 13 HB3 LYS 13 1.922 -12.245 3.415
104 HG2 LYS 13 HG2 LYS 13 2.670 -14.194 4.728
105 HG3 LYS 13 HG3 LYS 13 3.055 -13.130 6.083
106 HD2 LYS 13 HD2 LYS 13 0.686 -12.419 6.190
107 HD3 LYS 13 HD3 LYS 13 0.306 -13.509 4.854
108 HE2 LYS 13 HE2 LYS 13 1.482 -14.379 7.513
109 HE3 LYS 13 HE3 LYS 13 -0.220 -14.515 7.073
110 HZ1 LYS 13 HZ1 LYS 13 0.705 -15.758 5.029
111 HZ2 LYS 13 HZ2 LYS 13 0.609 -16.574 6.516
112 HZ3 LYS 13 HZ3 LYS 13 2.099 -15.961 5.976
113 H GLY 14 H GLY 14 4.661 -9.587 3.987
114 HA2 GLY 14 HA2 GLY 14 5.458 -8.008 2.427
115 HA3 GLY 14 HA3 GLY 14 4.971 -9.081 1.121
116 H PHE 15 H PHE 15 2.473 -8.828 3.398
117 HA PHE 15 HA PHE 15 1.321 -6.373 2.395
118 HB2 PHE 15 HB2 PHE 15 -0.686 -7.417 1.414
119 HB3 PHE 15 HB3 PHE 15 0.779 -7.842 0.531
120 HD1 PHE 15 HD1 PHE 15 -1.828 -9.069 2.842
121 HD2 PHE 15 HD2 PHE 15 1.645 -10.110 0.540
122 HE1 PHE 15 HE1 PHE 15 -2.339 -11.474 3.159
123 HE2 PHE 15 HE2 PHE 15 1.136 -12.516 0.861
124 HZ PHE 15 HZ PHE 15 -0.857 -13.198 2.170
125 H GLY 16 H GLY 16 -1.018 -6.175 3.180
126 HA2 GLY 16 HA2 GLY 16 -1.704 -7.627 5.584
127 HA3 GLY 16 HA3 GLY 16 -1.177 -5.972 5.877
128 H PHE 17 H PHE 17 -3.647 -6.463 6.656
129 HA PHE 17 HA PHE 17 -5.415 -5.413 4.521
130 HB2 PHE 17 HB2 PHE 17 -6.104 -7.066 6.967
131 HB3 PHE 17 HB3 PHE 17 -7.286 -6.375 5.858
132 HD1 PHE 17 HD1 PHE 17 -4.716 -8.956 6.322
133 HD2 PHE 17 HD2 PHE 17 -7.489 -7.203 3.550
134 HE1 PHE 17 HE1 PHE 17 -4.458 -10.916 4.823
135 HE2 PHE 17 HE2 PHE 17 -7.232 -9.162 2.052
136 HZ PHE 17 HZ PHE 17 -5.716 -11.018 2.687
137 H ILE 18 H ILE 18 -6.413 -3.482 4.885
138 HA ILE 18 HA ILE 18 -5.963 -2.251 7.522
139 HB ILE 18 HB ILE 18 -4.700 -1.170 5.722
140 HG12 ILE 18 HG12 ILE 18 -6.972 0.671 6.492
141 HG13 ILE 18 HG13 ILE 18 -5.786 0.119 7.676
142 HG21 ILE 18 HG21 ILE 18 -6.102 0.146 4.016
143 HG22 ILE 18 HG22 ILE 18 -7.446 -0.895 4.486
144 HG23 ILE 18 HG23 ILE 18 -5.995 -1.597 3.772
145 HD11 ILE 18 HD11 ILE 18 -5.200 1.638 5.118
146 HD12 ILE 18 HD12 ILE 18 -3.973 0.995 6.204
147 HD13 ILE 18 HD13 ILE 18 -5.064 2.264 6.761
148 H THR 19 H THR 19 -7.540 -1.162 8.547
149 HA THR 19 HA THR 19 -10.268 -1.752 7.673
150 HB THR 19 HB THR 19 -9.242 -0.826 10.359
151 HG1 THR 19 HG1 THR 19 -9.989 -3.391 9.408
152 HG21 THR 19 HG21 THR 19 -11.591 -0.281 10.090
153 HG22 THR 19 HG22 THR 19 -11.474 -1.703 11.127
154 HG23 THR 19 HG23 THR 19 -11.931 -1.881 9.431
155 HA PRO 20 HA PRO 20 -10.303 2.693 6.411
156 HB2 PRO 20 HB2 PRO 20 -13.172 1.933 5.997
157 HB3 PRO 20 HB3 PRO 20 -12.088 2.838 4.923
158 HG2 PRO 20 HG2 PRO 20 -12.671 0.340 4.380
159 HG3 PRO 20 HG3 PRO 20 -11.005 0.924 4.194
160 HD2 PRO 20 HD2 PRO 20 -12.172 -0.765 6.385
161 HD3 PRO 20 HD3 PRO 20 -10.576 -0.873 5.604
162 H GLU 21 H GLU 21 -10.646 4.391 7.770
163 HA GLU 21 HA GLU 21 -11.803 4.077 10.330
164 HB2 GLU 21 HB2 GLU 21 -11.509 6.509 10.554
165 HB3 GLU 21 HB3 GLU 21 -10.073 5.758 9.860
166 HG2 GLU 21 HG2 GLU 21 -10.811 6.420 7.598
167 HG3 GLU 21 HG3 GLU 21 -12.258 7.155 8.280
168 H ASP 22 H ASP 22 -13.128 5.133 7.268
169 HA ASP 22 HA ASP 22 -15.511 6.338 8.265
170 HB2 ASP 22 HB2 ASP 22 -14.761 5.205 5.570
171 HB3 ASP 22 HB3 ASP 22 -16.314 5.969 5.888
172 H GLY 23 H GLY 23 -14.543 3.048 7.869
173 HA2 GLY 23 HA2 GLY 23 -15.797 1.285 8.935
174 HA3 GLY 23 HA3 GLY 23 -17.276 2.152 8.539
175 H SER 24 H SER 24 -15.101 2.243 5.946
176 HA SER 24 HA SER 24 -16.752 0.602 4.289
177 HB2 SER 24 HB2 SER 24 -14.043 1.853 3.790
178 HB3 SER 24 HB3 SER 24 -15.023 1.063 2.564
179 HG SER 24 HG SER 24 -16.459 2.666 2.656
180 H LYS 25 H LYS 25 -15.739 -1.124 2.902
181 HA LYS 25 HA LYS 25 -14.880 -3.279 4.520
182 HB2 LYS 25 HB2 LYS 25 -14.898 -2.923 1.515
183 HB3 LYS 25 HB3 LYS 25 -14.527 -4.446 2.326
184 HG2 LYS 25 HG2 LYS 25 -16.733 -4.393 3.436
185 HG3 LYS 25 HG3 LYS 25 -17.108 -2.879 2.612
186 HD2 LYS 25 HD2 LYS 25 -16.904 -3.992 0.431
187 HD3 LYS 25 HD3 LYS 25 -16.482 -5.506 1.231
188 HE2 LYS 25 HE2 LYS 25 -18.854 -5.534 0.642
189 HE3 LYS 25 HE3 LYS 25 -18.683 -5.469 2.397
190 HZ1 LYS 25 HZ1 LYS 25 -18.855 -2.941 0.932
191 HZ2 LYS 25 HZ2 LYS 25 -19.413 -3.333 2.489
192 HZ3 LYS 25 HZ3 LYS 25 -20.279 -3.846 1.120
193 H ASP 26 H ASP 26 -12.886 -4.372 4.602
194 HA ASP 26 HA ASP 26 -10.613 -2.809 4.838
195 HB2 ASP 26 HB2 ASP 26 -9.367 -4.905 4.988
196 HB3 ASP 26 HB3 ASP 26 -10.872 -5.016 5.889
197 H LEU 27 H LEU 27 -8.691 -2.662 3.635
198 HA LEU 27 HA LEU 27 -8.992 -3.152 0.728
199 HB2 LEU 27 HB2 LEU 27 -7.603 -0.832 2.103
200 HB3 LEU 27 HB3 LEU 27 -7.667 -1.102 0.364
201 HG LEU 27 HG LEU 27 -10.140 -0.767 2.090
202 HD11 LEU 27 HD11 LEU 27 -10.204 1.525 0.992
203 HD12 LEU 27 HD12 LEU 27 -8.539 1.240 0.483
204 HD13 LEU 27 HD13 LEU 27 -8.936 1.312 2.200
205 HD21 LEU 27 HD21 LEU 27 -10.575 -1.920 -0.013
206 HD22 LEU 27 HD22 LEU 27 -9.640 -0.720 -0.907
207 HD23 LEU 27 HD23 LEU 27 -11.169 -0.265 -0.153
208 H PHE 28 H PHE 28 -7.130 -3.772 -0.410
209 HA PHE 28 HA PHE 28 -5.179 -5.239 1.136
210 HB2 PHE 28 HB2 PHE 28 -5.511 -4.751 -1.832
211 HB3 PHE 28 HB3 PHE 28 -4.216 -5.736 -1.147
212 HD1 PHE 28 HD1 PHE 28 -7.838 -5.489 -1.754
213 HD2 PHE 28 HD2 PHE 28 -4.695 -7.873 -0.053
214 HE1 PHE 28 HE1 PHE 28 -9.381 -7.425 -1.615
215 HE2 PHE 28 HE2 PHE 28 -6.240 -9.809 0.086
216 HZ PHE 28 HZ PHE 28 -8.582 -9.584 -0.695
217 H VAL 29 H VAL 29 -3.190 -4.595 1.720
218 HA VAL 29 HA VAL 29 -2.061 -2.149 0.499
219 HB VAL 29 HB VAL 29 -2.118 -2.872 3.440
220 HG11 VAL 29 HG11 VAL 29 -0.777 -0.614 1.945
221 HG12 VAL 29 HG12 VAL 29 -0.019 -1.790 3.016
222 HG13 VAL 29 HG13 VAL 29 -1.085 -0.553 3.680
223 HG21 VAL 29 HG21 VAL 29 -3.266 -0.370 2.229
224 HG22 VAL 29 HG22 VAL 29 -3.659 -1.139 3.762
225 HG23 VAL 29 HG23 VAL 29 -4.213 -1.856 2.250
226 H HIS 30 H HIS 30 0.043 -2.326 -0.100
227 HA HIS 30 HA HIS 30 1.489 -4.788 0.676
228 HB2 HIS 30 HB2 HIS 30 1.768 -3.054 -1.786
229 HB3 HIS 30 HB3 HIS 30 2.800 -4.435 -1.410
230 HD2 HIS 30 HD2 HIS 30 -0.526 -3.752 -3.166
231 HE1 HIS 30 HE1 HIS 30 -0.517 -7.879 -2.278
232 HE2 HIS 30 HE2 HIS 30 -1.696 -6.050 -3.584
233 H HIS 31 H HIS 31 3.610 -4.686 1.308
234 HA HIS 31 HA HIS 31 4.420 -2.443 2.833
235 HB2 HIS 31 HB2 HIS 31 5.119 -4.805 3.257
236 HB3 HIS 31 HB3 HIS 31 6.154 -4.718 1.831
237 HD2 HIS 31 HD2 HIS 31 6.160 -3.537 5.548
238 HE1 HIS 31 HE1 HIS 31 9.688 -2.071 3.751
239 HE2 HIS 31 HE2 HIS 31 8.460 -2.369 5.954
240 H SER 32 H SER 32 5.581 -3.656 -0.301
241 HA SER 32 HA SER 32 7.623 -1.769 -0.703
242 HB2 SER 32 HB2 SER 32 6.013 -3.379 -2.679
243 HB3 SER 32 HB3 SER 32 7.430 -2.428 -3.111
244 HG SER 32 HG SER 32 7.359 -4.455 -1.121
245 H GLU 33 H GLU 33 4.189 -1.411 -1.136
246 HA GLU 33 HA GLU 33 4.270 0.688 -3.061
247 HB2 GLU 33 HB2 GLU 33 2.138 -0.230 -1.140
248 HB3 GLU 33 HB3 GLU 33 1.890 1.079 -2.293
249 HG2 GLU 33 HG2 GLU 33 2.753 -1.733 -3.033
250 HG3 GLU 33 HG3 GLU 33 1.107 -1.122 -3.170
251 H ILE 34 H ILE 34 5.051 0.748 0.270
252 HA ILE 34 HA ILE 34 4.067 3.217 1.117
253 HB ILE 34 HB ILE 34 5.920 3.286 2.718
254 HG12 ILE 34 HG12 ILE 34 7.065 0.878 1.259
255 HG13 ILE 34 HG13 ILE 34 7.667 2.512 1.028
256 HG21 ILE 34 HG21 ILE 34 4.167 1.841 3.385
257 HG22 ILE 34 HG22 ILE 34 5.626 0.876 3.600
258 HG23 ILE 34 HG23 ILE 34 4.600 0.618 2.191
259 HD11 ILE 34 HD11 ILE 34 8.979 1.196 2.718
260 HD12 ILE 34 HD12 ILE 34 7.530 1.129 3.722
261 HD13 ILE 34 HD13 ILE 34 8.285 2.682 3.368
262 H GLN 35 H GLN 35 5.356 5.231 1.488
263 HA GLN 35 HA GLN 35 6.349 6.198 -1.052
264 HB2 GLN 35 HB2 GLN 35 6.027 7.547 1.642
265 HB3 GLN 35 HB3 GLN 35 6.535 8.371 0.168
266 HG2 GLN 35 HG2 GLN 35 3.929 6.845 0.465
267 HG3 GLN 35 HG3 GLN 35 4.083 8.595 0.619
268 HE21 GLN 35 HE21 GLN 35 5.285 9.624 -1.413
269 HE22 GLN 35 HE22 GLN 35 4.795 9.022 -2.923
270 H SER 36 H SER 36 8.395 6.984 -1.497
271 HA SER 36 HA SER 36 10.587 5.610 -0.346
272 HB2 SER 36 HB2 SER 36 10.655 6.384 -2.653
273 HB3 SER 36 HB3 SER 36 10.512 8.058 -2.126
274 HG SER 36 HG SER 36 12.674 6.300 -1.995
275 H GLY 37 H GLY 37 12.111 6.213 1.121
276 HA2 GLY 37 HA2 GLY 37 12.765 8.724 2.068
277 HA3 GLY 37 HA3 GLY 37 11.422 8.185 3.074
278 H GLY 38 H GLY 38 14.111 6.365 1.623
279 HA2 GLY 38 HA2 GLY 38 15.989 5.430 2.690
280 HA3 GLY 38 HA3 GLY 38 15.306 5.879 4.247
281 H GLU 39 H GLU 39 12.730 4.534 2.832
282 HA GLU 39 HA GLU 39 11.630 2.539 3.047
283 HB2 GLU 39 HB2 GLU 39 14.399 1.422 2.535
284 HB3 GLU 39 HB3 GLU 39 12.899 0.500 2.443
285 HG2 GLU 39 HG2 GLU 39 12.082 2.028 0.672
286 HG3 GLU 39 HG3 GLU 39 13.602 2.917 0.748
287 H TYR 40 H TYR 40 12.619 3.812 5.461
288 HA TYR 40 HA TYR 40 13.276 1.525 7.203
289 HB2 TYR 40 HB2 TYR 40 13.258 4.494 7.769
290 HB3 TYR 40 HB3 TYR 40 13.669 3.246 8.942
291 HD1 TYR 40 HD1 TYR 40 14.803 5.136 6.029
292 HD2 TYR 40 HD2 TYR 40 15.688 1.824 8.616
293 HE1 TYR 40 HE1 TYR 40 17.136 5.100 5.185
294 HE2 TYR 40 HE2 TYR 40 18.018 1.787 7.772
295 HH TYR 40 HH TYR 40 18.994 3.403 4.997
296 H ALA 41 H ALA 41 10.535 3.136 6.116
297 HA ALA 41 HA ALA 41 9.008 3.470 8.454
298 HB1 ALA 41 HB1 ALA 41 8.261 2.941 5.580
299 HB2 ALA 41 HB2 ALA 41 8.177 4.463 6.469
300 HB3 ALA 41 HB3 ALA 41 7.046 3.161 6.841
301 H THR 42 H THR 42 7.971 2.106 9.735
302 HA THR 42 HA THR 42 7.824 -0.751 8.951
303 HB THR 42 HB THR 42 7.990 -1.284 11.358
304 HG1 THR 42 HG1 THR 42 8.380 0.337 12.810
305 HG21 THR 42 HG21 THR 42 10.026 -1.053 9.844
306 HG22 THR 42 HG22 THR 42 10.343 -0.901 11.572
307 HG23 THR 42 HG23 THR 42 10.267 0.541 10.560
308 H LEU 43 H LEU 43 5.982 -1.928 9.648
309 HA LEU 43 HA LEU 43 3.709 -0.379 10.676
310 HB2 LEU 43 HB2 LEU 43 3.635 -2.050 8.157
311 HB3 LEU 43 HB3 LEU 43 2.228 -1.339 8.932
312 HG LEU 43 HG LEU 43 4.596 0.271 7.922
313 HD11 LEU 43 HD11 LEU 43 3.593 -0.747 5.995
314 HD12 LEU 43 HD12 LEU 43 2.952 0.894 6.073
315 HD13 LEU 43 HD13 LEU 43 1.965 -0.464 6.611
316 HD21 LEU 43 HD21 LEU 43 2.715 2.079 7.976
317 HD22 LEU 43 HD22 LEU 43 3.426 1.587 9.508
318 HD23 LEU 43 HD23 LEU 43 1.857 0.945 9.023
319 H ALA 44 H ALA 44 2.103 -1.676 11.692
320 HA ALA 44 HA ALA 44 2.622 -4.550 11.973
321 HB1 ALA 44 HB1 ALA 44 3.894 -3.195 13.758
322 HB2 ALA 44 HB2 ALA 44 2.864 -4.508 14.329
323 HB3 ALA 44 HB3 ALA 44 2.306 -2.838 14.439
324 H ASP 45 H ASP 45 0.774 -4.881 14.203
325 HA ASP 45 HA ASP 45 -1.711 -4.631 12.730
326 HB2 ASP 45 HB2 ASP 45 -2.638 -5.898 14.712
327 HB3 ASP 45 HB3 ASP 45 -1.366 -6.733 13.823
328 H GLY 46 H GLY 46 -2.850 -2.828 12.844
329 HA2 GLY 46 HA2 GLY 46 -4.296 -1.345 14.023
330 HA3 GLY 46 HA3 GLY 46 -3.296 -1.543 15.454
331 H GLN 47 H GLN 47 -1.231 -1.133 12.878
332 HA GLN 47 HA GLN 47 -0.354 1.433 13.694
333 HB2 GLN 47 HB2 GLN 47 1.056 -0.353 12.667
334 HB3 GLN 47 HB3 GLN 47 0.255 -0.052 11.129
335 HG2 GLN 47 HG2 GLN 47 2.395 1.140 11.245
336 HG3 GLN 47 HG3 GLN 47 1.060 2.275 11.158
337 HE21 GLN 47 HE21 GLN 47 1.571 4.031 12.482
338 HE22 GLN 47 HE22 GLN 47 2.255 3.910 14.032
339 H THR 48 H THR 48 -0.862 3.423 13.012
340 HA THR 48 HA THR 48 -3.086 3.781 11.180
341 HB THR 48 HB THR 48 -1.402 5.844 12.637
342 HG1 THR 48 HG1 THR 48 -2.565 4.301 13.951
343 HG21 THR 48 HG21 THR 48 -2.800 6.580 10.619
344 HG22 THR 48 HG22 THR 48 -3.143 7.400 12.142
345 HG23 THR 48 HG23 THR 48 -4.216 6.125 11.566
346 H VAL 49 H VAL 49 -2.940 4.287 9.088
347 HA VAL 49 HA VAL 49 -0.450 5.448 8.039
348 HB VAL 49 HB VAL 49 -0.415 3.851 6.150
349 HG11 VAL 49 HG11 VAL 49 0.619 2.063 7.359
350 HG12 VAL 49 HG12 VAL 49 -0.367 2.370 8.788
351 HG13 VAL 49 HG13 VAL 49 0.885 3.519 8.317
352 HG21 VAL 49 HG21 VAL 49 -1.734 1.722 6.432
353 HG22 VAL 49 HG22 VAL 49 -2.733 3.137 6.098
354 HG23 VAL 49 HG23 VAL 49 -2.620 2.505 7.741
355 H GLU 50 H GLU 50 -0.673 6.116 5.736
356 HA GLU 50 HA GLU 50 -3.392 7.165 5.205
357 HB2 GLU 50 HB2 GLU 50 -0.703 8.319 4.398
358 HB3 GLU 50 HB3 GLU 50 -2.275 8.990 3.959
359 HG2 GLU 50 HG2 GLU 50 -2.808 9.289 6.359
360 HG3 GLU 50 HG3 GLU 50 -1.221 8.651 6.783
361 H TYR 51 H TYR 51 -4.277 6.748 3.202
362 HA TYR 51 HA TYR 51 -2.615 5.647 1.078
363 HB2 TYR 51 HB2 TYR 51 -3.897 3.562 0.894
364 HB3 TYR 51 HB3 TYR 51 -3.088 3.672 2.453
365 HD1 TYR 51 HD1 TYR 51 -6.325 3.716 0.713
366 HD2 TYR 51 HD2 TYR 51 -4.369 4.116 4.517
367 HE1 TYR 51 HE1 TYR 51 -8.508 3.476 1.861
368 HE2 TYR 51 HE2 TYR 51 -6.554 3.873 5.665
369 HH TYR 51 HH TYR 51 -9.082 4.354 4.923
370 H GLU 52 H GLU 52 -3.804 5.192 -0.894
371 HA GLU 52 HA GLU 52 -6.175 6.936 -1.210
372 HB2 GLU 52 HB2 GLU 52 -3.938 6.243 -3.130
373 HB3 GLU 52 HB3 GLU 52 -5.434 7.030 -3.637
374 HG2 GLU 52 HG2 GLU 52 -5.013 8.917 -2.177
375 HG3 GLU 52 HG3 GLU 52 -3.628 8.105 -1.455
376 H VAL 53 H VAL 53 -8.015 5.938 -1.791
377 HA VAL 53 HA VAL 53 -7.971 3.068 -2.317
378 HB VAL 53 HB VAL 53 -10.314 4.988 -2.069
379 HG11 VAL 53 HG11 VAL 53 -10.261 1.957 -1.891
380 HG12 VAL 53 HG12 VAL 53 -10.785 2.857 -3.315
381 HG13 VAL 53 HG13 VAL 53 -11.686 2.996 -1.805
382 HG21 VAL 53 HG21 VAL 53 -8.861 3.236 -0.076
383 HG22 VAL 53 HG22 VAL 53 -10.518 3.777 0.199
384 HG23 VAL 53 HG23 VAL 53 -9.216 4.957 0.044
385 H GLY 54 H GLY 54 -7.715 2.337 -4.317
386 HA2 GLY 54 HA2 GLY 54 -8.979 3.811 -6.559
387 HA3 GLY 54 HA3 GLY 54 -7.362 3.127 -6.693
388 H GLN 55 H GLN 55 -10.575 2.601 -7.339
389 HA GLN 55 HA GLN 55 -11.037 -0.095 -6.845
390 HB2 GLN 55 HB2 GLN 55 -12.704 1.578 -7.706
391 HB3 GLN 55 HB3 GLN 55 -11.950 1.428 -9.296
392 HG2 GLN 55 HG2 GLN 55 -12.454 -0.971 -9.336
393 HG3 GLN 55 HG3 GLN 55 -13.146 -0.873 -7.718
394 HE21 GLN 55 HE21 GLN 55 -14.380 -1.482 -10.502
395 HE22 GLN 55 HE22 GLN 55 -15.723 -0.446 -10.572
396 H GLY 56 H GLY 56 -10.343 -1.944 -7.701
397 HA2 GLY 56 HA2 GLY 56 -8.578 -1.847 -10.070
398 HA3 GLY 56 HA3 GLY 56 -8.341 -2.950 -8.717
399 H GLN 57 H GLN 57 -8.387 -4.297 -10.874
400 HA GLN 57 HA GLN 57 -10.864 -4.914 -12.087
401 HB2 GLN 57 HB2 GLN 57 -8.277 -6.458 -11.843
402 HB3 GLN 57 HB3 GLN 57 -9.643 -6.994 -12.826
403 HG2 GLN 57 HG2 GLN 57 -9.550 -5.000 -14.178
404 HG3 GLN 57 HG3 GLN 57 -8.357 -4.268 -13.101
405 HE21 GLN 57 HE21 GLN 57 -8.122 -4.937 -16.043
406 HE22 GLN 57 HE22 GLN 57 -6.764 -5.947 -16.160
407 H LYS 58 H LYS 58 -9.139 -6.345 -9.334
408 HA LYS 58 HA LYS 58 -11.317 -8.265 -8.906
409 HB2 LYS 58 HB2 LYS 58 -8.646 -7.898 -7.535
410 HB3 LYS 58 HB3 LYS 58 -9.829 -9.130 -7.094
411 HG2 LYS 58 HG2 LYS 58 -9.733 -10.043 -9.388
412 HG3 LYS 58 HG3 LYS 58 -8.541 -8.817 -9.823
413 HD2 LYS 58 HD2 LYS 58 -6.994 -9.696 -8.126
414 HD3 LYS 58 HD3 LYS 58 -8.187 -10.907 -7.654
415 HE2 LYS 58 HE2 LYS 58 -6.561 -11.917 -9.176
416 HE3 LYS 58 HE3 LYS 58 -8.132 -11.822 -9.970
417 HZ1 LYS 58 HZ1 LYS 58 -6.018 -9.767 -10.280
418 HZ2 LYS 58 HZ2 LYS 58 -7.450 -9.921 -11.180
419 HZ3 LYS 58 HZ3 LYS 58 -6.212 -11.072 -11.346
420 H GLY 59 H GLY 59 -10.171 -5.227 -7.696
421 HA2 GLY 59 HA2 GLY 59 -12.377 -4.437 -6.313
422 HA3 GLY 59 HA3 GLY 59 -11.479 -5.378 -5.125
423 HA PRO 60 HA PRO 60 -9.764 -0.951 -5.431
424 HB2 PRO 60 HB2 PRO 60 -10.404 -0.037 -2.953
425 HB3 PRO 60 HB3 PRO 60 -11.505 0.097 -4.338
426 HG2 PRO 60 HG2 PRO 60 -11.485 -1.908 -2.131
427 HG3 PRO 60 HG3 PRO 60 -12.849 -1.039 -2.852
428 HD2 PRO 60 HD2 PRO 60 -12.242 -3.608 -3.522
429 HD3 PRO 60 HD3 PRO 60 -12.969 -2.469 -4.678
430 H CYS 61 H CYS 61 -7.833 -0.266 -4.567
431 HA CYS 61 HA CYS 61 -6.569 -1.953 -2.493
432 HB2 CYS 61 HB2 CYS 61 -5.272 -0.897 -5.022
433 HB3 CYS 61 HB3 CYS 61 -4.449 -1.784 -3.740
434 HG CYS 61 HG CYS 61 -5.277 -3.892 -4.729
435 H ALA 62 H ALA 62 -4.510 -0.794 -1.641
436 HA ALA 62 HA ALA 62 -5.134 2.090 -1.345
437 HB1 ALA 62 HB1 ALA 62 -5.266 1.569 0.848
438 HB2 ALA 62 HB2 ALA 62 -3.509 1.433 0.797
439 HB3 ALA 62 HB3 ALA 62 -4.511 -0.005 0.607
440 H ASN 63 H ASN 63 -3.590 3.516 -1.931
441 HA ASN 63 HA ASN 63 -0.897 2.469 -2.578
442 HB2 ASN 63 HB2 ASN 63 -2.361 3.060 -4.545
443 HB3 ASN 63 HB3 ASN 63 -2.334 4.727 -3.977
444 HD21 ASN 63 HD21 ASN 63 -1.046 5.646 -5.635
445 HD22 ASN 63 HD22 ASN 63 0.558 5.180 -5.931
446 H LYS 64 H LYS 64 0.834 4.062 -2.505
447 HA LYS 64 HA LYS 64 2.096 5.621 -1.403
448 HB2 LYS 64 HB2 LYS 64 -0.546 7.101 -1.397
449 HB3 LYS 64 HB3 LYS 64 1.003 7.824 -0.965
450 HG2 LYS 64 HG2 LYS 64 1.886 7.252 -3.208
451 HG3 LYS 64 HG3 LYS 64 0.322 6.562 -3.639
452 HD2 LYS 64 HD2 LYS 64 -0.753 8.744 -3.293
453 HD3 LYS 64 HD3 LYS 64 0.795 9.445 -2.828
454 HE2 LYS 64 HE2 LYS 64 0.341 9.965 -5.173
455 HE3 LYS 64 HE3 LYS 64 1.704 8.851 -5.071
456 HZ1 LYS 64 HZ1 LYS 64 -0.985 7.720 -5.309
457 HZ2 LYS 64 HZ2 LYS 64 0.492 7.139 -5.912
458 HZ3 LYS 64 HZ3 LYS 64 -0.300 8.423 -6.691
459 H VAL 65 H VAL 65 1.752 3.663 0.211
460 HA VAL 65 HA VAL 65 0.293 4.208 2.617
461 HB VAL 65 HB VAL 65 2.538 2.228 2.110
462 HG11 VAL 65 HG11 VAL 65 1.537 1.030 4.068
463 HG12 VAL 65 HG12 VAL 65 0.490 2.423 4.340
464 HG13 VAL 65 HG13 VAL 65 2.239 2.590 4.500
465 HG21 VAL 65 HG21 VAL 65 0.864 0.624 1.595
466 HG22 VAL 65 HG22 VAL 65 0.402 2.064 0.689
467 HG23 VAL 65 HG23 VAL 65 -0.433 1.664 2.190
468 H VAL 66 H VAL 66 0.821 5.633 4.082
469 HA VAL 66 HA VAL 66 3.677 6.214 4.626
470 HB VAL 66 HB VAL 66 1.394 8.218 4.590
471 HG11 VAL 66 HG11 VAL 66 2.983 8.840 6.308
472 HG12 VAL 66 HG12 VAL 66 3.274 9.875 4.910
473 HG13 VAL 66 HG13 VAL 66 4.343 8.510 5.236
474 HG21 VAL 66 HG21 VAL 66 2.644 9.216 2.696
475 HG22 VAL 66 HG22 VAL 66 2.135 7.567 2.333
476 HG23 VAL 66 HG23 VAL 66 3.809 7.894 2.779
477 H ALA 67 H ALA 67 4.238 5.804 6.663
478 HA ALA 67 HA ALA 67 2.312 5.016 8.632
479 HB1 ALA 67 HB1 ALA 67 4.740 4.187 8.347
480 HB2 ALA 67 HB2 ALA 67 4.155 4.466 9.987
481 HB3 ALA 67 HB3 ALA 67 5.196 5.657 9.205
482 H VAL 68 H VAL 68 1.500 6.121 10.331
483 HA VAL 68 HA VAL 68 1.967 9.015 10.402
484 HB VAL 68 HB VAL 68 -0.082 7.359 11.919
485 HG11 VAL 68 HG11 VAL 68 -0.071 10.332 11.330
486 HG12 VAL 68 HG12 VAL 68 0.550 9.650 12.832
487 HG13 VAL 68 HG13 VAL 68 -1.152 9.453 12.414
488 HG21 VAL 68 HG21 VAL 68 -0.275 8.897 9.308
489 HG22 VAL 68 HG22 VAL 68 -1.675 8.323 10.214
490 HG23 VAL 68 HG23 VAL 68 -0.525 7.167 9.539
Start of MODEL 13
1 H1 MET 1 HT1 MET 1 -7.530 14.310 2.567
2 H2 MET 1 HT2 MET 1 -5.869 14.611 2.370
3 H3 MET 1 HT3 MET 1 -6.456 14.000 3.843
4 HA MET 1 HA MET 1 -6.870 12.484 1.355
5 HB2 MET 1 HB2 MET 1 -4.437 13.097 1.543
6 HB3 MET 1 HB3 MET 1 -4.410 12.309 3.120
7 HG2 MET 1 HG2 MET 1 -5.107 10.185 2.075
8 HG3 MET 1 HG3 MET 1 -5.139 10.970 0.497
9 HE1 MET 1 HE1 MET 1 -2.537 12.870 0.447
10 HE2 MET 1 HE2 MET 1 -3.379 11.865 -0.729
11 HE3 MET 1 HE3 MET 1 -1.645 11.666 -0.495
12 H SER 2 H SER 2 -7.575 10.416 1.810
13 HA SER 2 HA SER 2 -8.942 9.975 4.246
14 HB2 SER 2 HB2 SER 2 -9.658 8.901 2.180
15 HB3 SER 2 HB3 SER 2 -8.132 8.029 2.071
16 HG SER 2 HG SER 2 -8.677 6.883 3.888
17 H LYS 3 H LYS 3 -8.450 8.793 6.044
18 HA LYS 3 HA LYS 3 -5.775 7.538 6.191
19 HB2 LYS 3 HB2 LYS 3 -7.004 9.316 8.317
20 HB3 LYS 3 HB3 LYS 3 -5.487 8.433 8.466
21 HG2 LYS 3 HG2 LYS 3 -4.644 9.681 6.448
22 HG3 LYS 3 HG3 LYS 3 -6.106 10.661 6.506
23 HD2 LYS 3 HD2 LYS 3 -4.220 10.394 8.860
24 HD3 LYS 3 HD3 LYS 3 -4.075 11.675 7.660
25 HE2 LYS 3 HE2 LYS 3 -6.415 12.373 8.163
26 HE3 LYS 3 HE3 LYS 3 -6.489 11.137 9.418
27 HZ1 LYS 3 HZ1 LYS 3 -4.905 12.224 10.696
28 HZ2 LYS 3 HZ2 LYS 3 -5.854 13.499 10.096
29 HZ3 LYS 3 HZ3 LYS 3 -4.341 13.161 9.400
30 H GLY 4 H GLY 4 -5.806 5.547 7.026
31 HA2 GLY 4 HA2 GLY 4 -8.152 4.714 8.639
32 HA3 GLY 4 HA3 GLY 4 -7.569 3.728 7.304
33 H ILE 5 H ILE 5 -7.665 2.346 9.464
34 HA ILE 5 HA ILE 5 -4.936 2.373 10.620
35 HB ILE 5 HB ILE 5 -5.974 1.105 12.554
36 HG12 ILE 5 HG12 ILE 5 -8.601 2.233 11.546
37 HG13 ILE 5 HG13 ILE 5 -8.108 0.583 11.180
38 HG21 ILE 5 HG21 ILE 5 -7.062 3.232 13.491
39 HG22 ILE 5 HG22 ILE 5 -6.728 3.962 11.920
40 HG23 ILE 5 HG23 ILE 5 -5.402 3.377 12.922
41 HD11 ILE 5 HD11 ILE 5 -9.474 0.506 13.170
42 HD12 ILE 5 HD12 ILE 5 -8.541 1.802 13.921
43 HD13 ILE 5 HD13 ILE 5 -7.809 0.218 13.667
44 H VAL 6 H VAL 6 -3.709 0.673 10.269
45 HA VAL 6 HA VAL 6 -4.514 -1.340 8.456
46 HB VAL 6 HB VAL 6 -2.071 -1.231 10.249
47 HG11 VAL 6 HG11 VAL 6 -2.232 -3.481 9.491
48 HG12 VAL 6 HG12 VAL 6 -1.137 -2.709 8.343
49 HG13 VAL 6 HG13 VAL 6 -2.821 -2.989 7.903
50 HG21 VAL 6 HG21 VAL 6 -2.286 -0.525 7.310
51 HG22 VAL 6 HG22 VAL 6 -0.953 -0.180 8.414
52 HG23 VAL 6 HG23 VAL 6 -2.484 0.679 8.584
53 H LYS 7 H LYS 7 -5.603 -3.125 8.788
54 HA LYS 7 HA LYS 7 -6.477 -3.999 11.355
55 HB2 LYS 7 HB2 LYS 7 -7.713 -4.433 9.213
56 HB3 LYS 7 HB3 LYS 7 -6.449 -5.573 8.760
57 HG2 LYS 7 HG2 LYS 7 -6.942 -6.970 10.691
58 HG3 LYS 7 HG3 LYS 7 -8.097 -5.787 11.300
59 HD2 LYS 7 HD2 LYS 7 -9.401 -7.483 10.231
60 HD3 LYS 7 HD3 LYS 7 -9.386 -6.114 9.121
61 HE2 LYS 7 HE2 LYS 7 -7.601 -7.161 7.808
62 HE3 LYS 7 HE3 LYS 7 -7.527 -8.506 8.945
63 HZ1 LYS 7 HZ1 LYS 7 -9.803 -7.762 7.195
64 HZ2 LYS 7 HZ2 LYS 7 -9.899 -8.934 8.422
65 HZ3 LYS 7 HZ3 LYS 7 -8.854 -9.165 7.102
66 H TRP 8 H TRP 8 -4.042 -5.145 9.049
67 HA TRP 8 HA TRP 8 -2.337 -6.135 11.137
68 HB2 TRP 8 HB2 TRP 8 -4.171 -7.943 10.735
69 HB3 TRP 8 HB3 TRP 8 -3.334 -8.236 9.213
70 HD1 TRP 8 HD1 TRP 8 -0.676 -8.892 9.427
71 HE1 TRP 8 HE1 TRP 8 0.521 -10.273 11.245
72 HE3 TRP 8 HE3 TRP 8 -4.136 -8.605 13.166
73 HZ2 TRP 8 HZ2 TRP 8 0.067 -11.144 13.933
74 HZ3 TRP 8 HZ3 TRP 8 -3.733 -9.719 15.343
75 HH2 TRP 8 HH2 TRP 8 -1.636 -10.986 15.731
76 H PHE 9 H PHE 9 -0.293 -5.877 10.435
77 HA PHE 9 HA PHE 9 0.152 -5.692 7.501
78 HB2 PHE 9 HB2 PHE 9 0.636 -3.642 8.903
79 HB3 PHE 9 HB3 PHE 9 1.930 -4.564 9.671
80 HD1 PHE 9 HD1 PHE 9 0.747 -3.077 6.502
81 HD2 PHE 9 HD2 PHE 9 3.961 -5.135 8.474
82 HE1 PHE 9 HE1 PHE 9 2.242 -2.571 4.590
83 HE2 PHE 9 HE2 PHE 9 5.456 -4.626 6.561
84 HZ PHE 9 HZ PHE 9 4.597 -3.345 4.621
85 H ASN 10 H ASN 10 1.231 -7.335 6.587
86 HA ASN 10 HA ASN 10 3.144 -8.866 8.255
87 HB2 ASN 10 HB2 ASN 10 1.285 -9.912 6.111
88 HB3 ASN 10 HB3 ASN 10 2.535 -10.862 6.911
89 HD21 ASN 10 HD21 ASN 10 -0.660 -10.675 6.988
90 HD22 ASN 10 HD22 ASN 10 -0.968 -10.828 8.650
91 H SER 11 H SER 11 4.969 -7.747 7.550
92 HA SER 11 HA SER 11 5.577 -7.131 4.871
93 HB2 SER 11 HB2 SER 11 7.853 -6.777 5.684
94 HB3 SER 11 HB3 SER 11 6.690 -6.096 6.819
95 HG SER 11 HG SER 11 8.299 -7.356 7.861
96 H ASP 12 H ASP 12 6.070 -10.051 6.787
97 HA ASP 12 HA ASP 12 7.982 -11.341 5.174
98 HB2 ASP 12 HB2 ASP 12 5.753 -12.447 6.896
99 HB3 ASP 12 HB3 ASP 12 6.947 -13.468 6.098
100 H LYS 13 H LYS 13 4.439 -11.310 5.031
101 HA LYS 13 HA LYS 13 4.299 -12.954 2.668
102 HB2 LYS 13 HB2 LYS 13 2.256 -11.213 4.064
103 HB3 LYS 13 HB3 LYS 13 1.901 -12.202 2.648
104 HG2 LYS 13 HG2 LYS 13 2.770 -14.200 3.922
105 HG3 LYS 13 HG3 LYS 13 2.870 -13.171 5.350
106 HD2 LYS 13 HD2 LYS 13 0.313 -13.548 3.766
107 HD3 LYS 13 HD3 LYS 13 0.740 -14.551 5.152
108 HE2 LYS 13 HE2 LYS 13 0.896 -12.492 6.552
109 HE3 LYS 13 HE3 LYS 13 0.372 -11.540 5.163
110 HZ1 LYS 13 HZ1 LYS 13 -1.731 -12.360 5.266
111 HZ2 LYS 13 HZ2 LYS 13 -1.334 -12.449 6.917
112 HZ3 LYS 13 HZ3 LYS 13 -1.257 -13.841 5.945
113 H GLY 14 H GLY 14 4.673 -9.578 3.377
114 HA2 GLY 14 HA2 GLY 14 5.511 -7.967 1.870
115 HA3 GLY 14 HA3 GLY 14 4.981 -8.972 0.531
116 H PHE 15 H PHE 15 2.513 -8.718 2.847
117 HA PHE 15 HA PHE 15 1.433 -6.195 1.929
118 HB2 PHE 15 HB2 PHE 15 -0.618 -7.136 0.938
119 HB3 PHE 15 HB3 PHE 15 0.822 -7.578 0.026
120 HD1 PHE 15 HD1 PHE 15 -1.793 -8.800 2.334
121 HD2 PHE 15 HD2 PHE 15 1.599 -9.872 -0.071
122 HE1 PHE 15 HE1 PHE 15 -2.385 -11.195 2.567
123 HE2 PHE 15 HE2 PHE 15 1.010 -12.269 0.164
124 HZ PHE 15 HZ PHE 15 -0.982 -12.932 1.483
125 H GLY 16 H GLY 16 -0.913 -5.966 2.718
126 HA2 GLY 16 HA2 GLY 16 -1.596 -7.440 5.113
127 HA3 GLY 16 HA3 GLY 16 -1.065 -5.788 5.409
128 H PHE 17 H PHE 17 -3.535 -6.302 6.202
129 HA PHE 17 HA PHE 17 -5.322 -5.222 4.095
130 HB2 PHE 17 HB2 PHE 17 -5.971 -6.933 6.512
131 HB3 PHE 17 HB3 PHE 17 -7.174 -6.223 5.439
132 HD1 PHE 17 HD1 PHE 17 -4.500 -8.743 5.749
133 HD2 PHE 17 HD2 PHE 17 -7.495 -7.058 3.173
134 HE1 PHE 17 HE1 PHE 17 -4.263 -10.673 4.211
135 HE2 PHE 17 HE2 PHE 17 -7.257 -8.987 1.635
136 HZ PHE 17 HZ PHE 17 -5.639 -10.795 2.152
137 H ILE 18 H ILE 18 -6.357 -3.306 4.520
138 HA ILE 18 HA ILE 18 -5.879 -2.130 7.179
139 HB ILE 18 HB ILE 18 -4.694 -0.973 5.371
140 HG12 ILE 18 HG12 ILE 18 -6.992 0.788 6.251
141 HG13 ILE 18 HG13 ILE 18 -5.756 0.240 7.386
142 HG21 ILE 18 HG21 ILE 18 -7.474 -0.783 4.206
143 HG22 ILE 18 HG22 ILE 18 -5.995 -1.356 3.437
144 HG23 ILE 18 HG23 ILE 18 -6.211 0.363 3.754
145 HD11 ILE 18 HD11 ILE 18 -4.011 1.199 5.880
146 HD12 ILE 18 HD12 ILE 18 -5.111 2.423 6.513
147 HD13 ILE 18 HD13 ILE 18 -5.291 1.844 4.857
148 H THR 19 H THR 19 -7.454 -1.074 8.260
149 HA THR 19 HA THR 19 -10.195 -1.696 7.436
150 HB THR 19 HB THR 19 -9.116 -0.878 10.139
151 HG1 THR 19 HG1 THR 19 -9.405 -3.097 10.590
152 HG21 THR 19 HG21 THR 19 -11.340 -1.882 10.881
153 HG22 THR 19 HG22 THR 19 -11.825 -1.838 9.186
154 HG23 THR 19 HG23 THR 19 -11.450 -0.338 10.035
155 HA PRO 20 HA PRO 20 -10.296 2.802 6.342
156 HB2 PRO 20 HB2 PRO 20 -13.154 1.957 5.975
157 HB3 PRO 20 HB3 PRO 20 -12.151 2.986 4.935
158 HG2 PRO 20 HG2 PRO 20 -12.601 0.518 4.222
159 HG3 PRO 20 HG3 PRO 20 -10.960 1.174 4.086
160 HD2 PRO 20 HD2 PRO 20 -12.067 -0.694 6.166
161 HD3 PRO 20 HD3 PRO 20 -10.474 -0.703 5.376
162 H GLU 21 H GLU 21 -10.620 4.435 7.768
163 HA GLU 21 HA GLU 21 -11.688 4.050 10.340
164 HB2 GLU 21 HB2 GLU 21 -11.477 6.480 10.605
165 HB3 GLU 21 HB3 GLU 21 -10.049 5.808 9.821
166 HG2 GLU 21 HG2 GLU 21 -10.873 6.519 7.630
167 HG3 GLU 21 HG3 GLU 21 -12.370 7.098 8.352
168 H ASP 22 H ASP 22 -13.259 4.786 7.352
169 HA ASP 22 HA ASP 22 -15.666 5.853 8.604
170 HB2 ASP 22 HB2 ASP 22 -15.049 5.199 5.717
171 HB3 ASP 22 HB3 ASP 22 -16.508 6.005 6.289
172 H GLY 23 H GLY 23 -14.465 2.775 8.263
173 HA2 GLY 23 HA2 GLY 23 -15.567 0.788 8.834
174 HA3 GLY 23 HA3 GLY 23 -17.111 1.594 8.588
175 H SER 24 H SER 24 -15.099 2.212 5.951
176 HA SER 24 HA SER 24 -16.683 0.684 4.153
177 HB2 SER 24 HB2 SER 24 -15.619 2.746 3.418
178 HB3 SER 24 HB3 SER 24 -14.026 2.074 3.739
179 HG SER 24 HG SER 24 -15.918 0.942 1.953
180 H LYS 25 H LYS 25 -15.742 -0.877 2.607
181 HA LYS 25 HA LYS 25 -14.800 -3.179 3.891
182 HB2 LYS 25 HB2 LYS 25 -16.029 -3.073 1.689
183 HB3 LYS 25 HB3 LYS 25 -14.512 -2.571 0.944
184 HG2 LYS 25 HG2 LYS 25 -13.430 -4.644 1.775
185 HG3 LYS 25 HG3 LYS 25 -14.965 -5.154 2.473
186 HD2 LYS 25 HD2 LYS 25 -14.651 -4.514 -0.469
187 HD3 LYS 25 HD3 LYS 25 -14.404 -6.134 0.180
188 HE2 LYS 25 HE2 LYS 25 -16.710 -6.071 1.128
189 HE3 LYS 25 HE3 LYS 25 -16.948 -4.494 0.374
190 HZ1 LYS 25 HZ1 LYS 25 -17.736 -6.557 -0.880
191 HZ2 LYS 25 HZ2 LYS 25 -16.093 -6.832 -1.212
192 HZ3 LYS 25 HZ3 LYS 25 -16.841 -5.402 -1.743
193 H ASP 26 H ASP 26 -12.802 -4.144 4.074
194 HA ASP 26 HA ASP 26 -10.534 -2.540 4.373
195 HB2 ASP 26 HB2 ASP 26 -10.841 -5.524 4.014
196 HB3 ASP 26 HB3 ASP 26 -9.300 -4.756 4.376
197 H LEU 27 H LEU 27 -8.730 -2.170 3.156
198 HA LEU 27 HA LEU 27 -8.918 -2.825 0.275
199 HB2 LEU 27 HB2 LEU 27 -8.073 -0.387 1.781
200 HB3 LEU 27 HB3 LEU 27 -7.170 -0.766 0.320
201 HG LEU 27 HG LEU 27 -9.402 -0.929 -0.889
202 HD11 LEU 27 HD11 LEU 27 -10.317 0.160 1.780
203 HD12 LEU 27 HD12 LEU 27 -10.960 -1.214 0.882
204 HD13 LEU 27 HD13 LEU 27 -11.239 0.426 0.299
205 HD21 LEU 27 HD21 LEU 27 -7.825 1.085 -0.847
206 HD22 LEU 27 HD22 LEU 27 -8.899 1.782 0.366
207 HD23 LEU 27 HD23 LEU 27 -9.505 1.434 -1.253
208 H PHE 28 H PHE 28 -7.035 -3.435 -0.831
209 HA PHE 28 HA PHE 28 -5.119 -4.916 0.762
210 HB2 PHE 28 HB2 PHE 28 -5.455 -4.499 -2.217
211 HB3 PHE 28 HB3 PHE 28 -4.162 -5.475 -1.515
212 HD1 PHE 28 HD1 PHE 28 -7.819 -5.184 -1.992
213 HD2 PHE 28 HD2 PHE 28 -4.614 -7.625 -0.500
214 HE1 PHE 28 HE1 PHE 28 -9.369 -7.112 -1.813
215 HE2 PHE 28 HE2 PHE 28 -6.165 -9.552 -0.320
216 HZ PHE 28 HZ PHE 28 -8.541 -9.296 -0.978
217 H VAL 29 H VAL 29 -3.119 -4.280 1.323
218 HA VAL 29 HA VAL 29 -1.929 -1.939 -0.028
219 HB VAL 29 HB VAL 29 -2.065 -2.376 2.971
220 HG11 VAL 29 HG11 VAL 29 -0.673 -0.292 1.275
221 HG12 VAL 29 HG12 VAL 29 0.058 -1.367 2.467
222 HG13 VAL 29 HG13 VAL 29 -1.002 -0.060 2.992
223 HG21 VAL 29 HG21 VAL 29 -3.194 -0.104 1.320
224 HG22 VAL 29 HG22 VAL 29 -3.484 -0.439 3.027
225 HG23 VAL 29 HG23 VAL 29 -4.147 -1.512 1.793
226 H HIS 30 H HIS 30 0.196 -2.163 -0.504
227 HA HIS 30 HA HIS 30 1.534 -4.643 0.391
228 HB2 HIS 30 HB2 HIS 30 1.929 -2.931 -2.072
229 HB3 HIS 30 HB3 HIS 30 2.979 -4.280 -1.632
230 HD2 HIS 30 HD2 HIS 30 1.929 -6.815 -2.215
231 HE1 HIS 30 HE1 HIS 30 -1.856 -5.511 -3.554
232 HE2 HIS 30 HE2 HIS 30 -0.322 -7.523 -3.333
233 H HIS 31 H HIS 31 3.721 -4.597 0.984
234 HA HIS 31 HA HIS 31 4.538 -2.428 2.610
235 HB2 HIS 31 HB2 HIS 31 5.292 -4.798 2.890
236 HB3 HIS 31 HB3 HIS 31 6.277 -4.619 1.438
237 HD2 HIS 31 HD2 HIS 31 6.399 -3.634 5.211
238 HE1 HIS 31 HE1 HIS 31 9.826 -2.004 3.366
239 HE2 HIS 31 HE2 HIS 31 8.691 -2.443 5.593
240 H SER 32 H SER 32 5.619 -3.509 -0.596
241 HA SER 32 HA SER 32 7.482 -1.378 -0.987
242 HB2 SER 32 HB2 SER 32 7.636 -3.562 -2.142
243 HB3 SER 32 HB3 SER 32 6.177 -3.167 -3.047
244 HG SER 32 HG SER 32 7.331 -1.935 -4.293
245 H GLU 33 H GLU 33 4.179 -1.182 -0.847
246 HA GLU 33 HA GLU 33 3.562 0.408 -3.127
247 HB2 GLU 33 HB2 GLU 33 1.911 -0.851 -1.695
248 HB3 GLU 33 HB3 GLU 33 2.128 0.397 -0.469
249 HG2 GLU 33 HG2 GLU 33 0.173 0.931 -1.817
250 HG3 GLU 33 HG3 GLU 33 1.436 2.116 -2.127
251 H ILE 34 H ILE 34 4.923 1.144 0.023
252 HA ILE 34 HA ILE 34 4.397 3.960 -0.063
253 HB ILE 34 HB ILE 34 4.786 2.771 2.061
254 HG12 ILE 34 HG12 ILE 34 7.049 4.739 1.658
255 HG13 ILE 34 HG13 ILE 34 5.366 5.257 1.680
256 HG21 ILE 34 HG21 ILE 34 6.603 1.266 1.009
257 HG22 ILE 34 HG22 ILE 34 6.860 1.811 2.665
258 HG23 ILE 34 HG23 ILE 34 7.712 2.596 1.336
259 HD11 ILE 34 HD11 ILE 34 6.891 3.873 3.902
260 HD12 ILE 34 HD12 ILE 34 5.141 4.087 3.920
261 HD13 ILE 34 HD13 ILE 34 6.200 5.497 3.925
262 H GLN 35 H GLN 35 5.395 5.467 -1.195
263 HA GLN 35 HA GLN 35 7.405 4.902 -3.091
264 HB2 GLN 35 HB2 GLN 35 6.363 7.511 -1.977
265 HB3 GLN 35 HB3 GLN 35 7.520 7.416 -3.304
266 HG2 GLN 35 HG2 GLN 35 4.790 6.095 -3.304
267 HG3 GLN 35 HG3 GLN 35 5.161 7.623 -4.096
268 HE21 GLN 35 HE21 GLN 35 4.554 4.616 -5.009
269 HE22 GLN 35 HE22 GLN 35 5.689 4.401 -6.252
270 H SER 36 H SER 36 7.564 6.375 0.137
271 HA SER 36 HA SER 36 10.241 7.235 0.049
272 HB2 SER 36 HB2 SER 36 8.695 7.933 1.814
273 HB3 SER 36 HB3 SER 36 8.616 6.281 2.419
274 HG SER 36 HG SER 36 10.305 6.812 3.542
275 H GLY 37 H GLY 37 8.857 4.168 1.226
276 HA2 GLY 37 HA2 GLY 37 9.785 2.082 1.515
277 HA3 GLY 37 HA3 GLY 37 10.998 2.568 0.336
278 H GLY 38 H GLY 38 10.471 4.284 3.367
279 HA2 GLY 38 HA2 GLY 38 13.198 4.242 4.094
280 HA3 GLY 38 HA3 GLY 38 11.867 4.703 5.148
281 H GLU 39 H GLU 39 14.399 2.886 5.271
282 HA GLU 39 HA GLU 39 13.527 0.245 5.835
283 HB2 GLU 39 HB2 GLU 39 15.889 0.921 5.333
284 HB3 GLU 39 HB3 GLU 39 15.968 1.666 6.928
285 HG2 GLU 39 HG2 GLU 39 15.463 -0.513 7.976
286 HG3 GLU 39 HG3 GLU 39 15.381 -1.261 6.383
287 H TYR 40 H TYR 40 14.018 3.114 7.851
288 HA TYR 40 HA TYR 40 13.617 1.905 10.370
289 HB2 TYR 40 HB2 TYR 40 13.111 4.744 9.458
290 HB3 TYR 40 HB3 TYR 40 13.098 4.218 11.140
291 HD1 TYR 40 HD1 TYR 40 15.195 4.884 8.200
292 HD2 TYR 40 HD2 TYR 40 15.159 3.474 12.256
293 HE1 TYR 40 HE1 TYR 40 17.663 5.106 8.300
294 HE2 TYR 40 HE2 TYR 40 17.627 3.696 12.357
295 HH TYR 40 HH TYR 40 19.383 5.394 10.773
296 H ALA 41 H ALA 41 11.364 3.353 8.055
297 HA ALA 41 HA ALA 41 9.070 3.358 9.683
298 HB1 ALA 41 HB1 ALA 41 9.175 4.569 7.558
299 HB2 ALA 41 HB2 ALA 41 7.812 3.450 7.561
300 HB3 ALA 41 HB3 ALA 41 9.285 3.043 6.680
301 H THR 42 H THR 42 7.856 1.792 10.447
302 HA THR 42 HA THR 42 7.837 -0.844 9.108
303 HB THR 42 HB THR 42 7.804 -1.932 11.323
304 HG1 THR 42 HG1 THR 42 7.446 -0.741 12.984
305 HG21 THR 42 HG21 THR 42 9.963 -1.875 10.365
306 HG22 THR 42 HG22 THR 42 10.200 -1.249 11.997
307 HG23 THR 42 HG23 THR 42 10.128 -0.141 10.628
308 H LEU 43 H LEU 43 5.942 -2.159 9.655
309 HA LEU 43 HA LEU 43 3.628 -0.643 10.652
310 HB2 LEU 43 HB2 LEU 43 3.846 -1.998 7.966
311 HB3 LEU 43 HB3 LEU 43 2.293 -1.761 8.754
312 HG LEU 43 HG LEU 43 3.237 0.761 8.990
313 HD11 LEU 43 HD11 LEU 43 4.385 -0.002 6.306
314 HD12 LEU 43 HD12 LEU 43 5.378 -0.077 7.756
315 HD13 LEU 43 HD13 LEU 43 4.667 1.455 7.260
316 HD21 LEU 43 HD21 LEU 43 1.915 -0.511 6.579
317 HD22 LEU 43 HD22 LEU 43 2.098 1.235 6.752
318 HD23 LEU 43 HD23 LEU 43 1.138 0.329 7.920
319 H ALA 44 H ALA 44 2.059 -1.920 11.636
320 HA ALA 44 HA ALA 44 2.412 -4.828 11.699
321 HB1 ALA 44 HB1 ALA 44 3.774 -3.572 13.553
322 HB2 ALA 44 HB2 ALA 44 2.822 -4.989 13.996
323 HB3 ALA 44 HB3 ALA 44 2.199 -3.372 14.322
324 H ASP 45 H ASP 45 0.595 -5.028 14.074
325 HA ASP 45 HA ASP 45 -1.913 -4.723 12.649
326 HB2 ASP 45 HB2 ASP 45 -1.422 -6.777 13.922
327 HB3 ASP 45 HB3 ASP 45 -1.291 -5.833 15.399
328 H GLY 46 H GLY 46 -2.878 -2.779 12.678
329 HA2 GLY 46 HA2 GLY 46 -4.272 -1.227 13.846
330 HA3 GLY 46 HA3 GLY 46 -3.269 -1.439 15.272
331 H GLN 47 H GLN 47 -1.206 -1.144 12.666
332 HA GLN 47 HA GLN 47 -0.239 1.407 13.444
333 HB2 GLN 47 HB2 GLN 47 1.108 -0.415 12.383
334 HB3 GLN 47 HB3 GLN 47 0.276 -0.096 10.865
335 HG2 GLN 47 HG2 GLN 47 2.428 1.065 10.898
336 HG3 GLN 47 HG3 GLN 47 1.115 2.233 10.908
337 HE21 GLN 47 HE21 GLN 47 1.628 3.926 12.306
338 HE22 GLN 47 HE22 GLN 47 2.417 3.752 13.799
339 H THR 48 H THR 48 -0.848 3.401 12.836
340 HA THR 48 HA THR 48 -3.060 3.754 11.008
341 HB THR 48 HB THR 48 -2.690 6.196 11.520
342 HG1 THR 48 HG1 THR 48 -1.184 6.674 13.097
343 HG21 THR 48 HG21 THR 48 -3.208 5.861 14.036
344 HG22 THR 48 HG22 THR 48 -3.125 4.136 13.678
345 HG23 THR 48 HG23 THR 48 -4.312 5.155 12.858
346 H VAL 49 H VAL 49 -3.038 4.762 9.017
347 HA VAL 49 HA VAL 49 -0.517 5.686 7.899
348 HB VAL 49 HB VAL 49 -0.657 4.200 5.921
349 HG11 VAL 49 HG11 VAL 49 0.279 2.253 7.002
350 HG12 VAL 49 HG12 VAL 49 -0.535 2.642 8.517
351 HG13 VAL 49 HG13 VAL 49 0.768 3.673 7.927
352 HG21 VAL 49 HG21 VAL 49 -2.988 3.582 5.915
353 HG22 VAL 49 HG22 VAL 49 -2.872 2.914 7.544
354 HG23 VAL 49 HG23 VAL 49 -2.064 2.107 6.200
355 H GLU 50 H GLU 50 -0.777 6.485 5.661
356 HA GLU 50 HA GLU 50 -3.456 7.690 5.251
357 HB2 GLU 50 HB2 GLU 50 -0.755 8.755 4.351
358 HB3 GLU 50 HB3 GLU 50 -2.313 9.540 4.112
359 HG2 GLU 50 HG2 GLU 50 -2.592 9.714 6.566
360 HG3 GLU 50 HG3 GLU 50 -1.023 8.950 6.795
361 H TYR 51 H TYR 51 -4.421 7.245 3.284
362 HA TYR 51 HA TYR 51 -2.796 6.272 1.069
363 HB2 TYR 51 HB2 TYR 51 -4.025 4.159 0.840
364 HB3 TYR 51 HB3 TYR 51 -3.157 4.228 2.366
365 HD1 TYR 51 HD1 TYR 51 -6.466 4.275 0.761
366 HD2 TYR 51 HD2 TYR 51 -4.359 4.503 4.497
367 HE1 TYR 51 HE1 TYR 51 -8.591 3.906 1.982
368 HE2 TYR 51 HE2 TYR 51 -6.486 4.130 5.717
369 HH TYR 51 HH TYR 51 -8.819 4.282 5.431
370 H GLU 52 H GLU 52 -4.026 5.823 -0.870
371 HA GLU 52 HA GLU 52 -6.518 7.413 -1.044
372 HB2 GLU 52 HB2 GLU 52 -4.147 7.243 -2.902
373 HB3 GLU 52 HB3 GLU 52 -5.742 7.677 -3.520
374 HG2 GLU 52 HG2 GLU 52 -4.408 9.091 -1.195
375 HG3 GLU 52 HG3 GLU 52 -4.299 9.647 -2.863
376 H VAL 53 H VAL 53 -8.225 6.399 -1.875
377 HA VAL 53 HA VAL 53 -8.277 3.607 -2.190
378 HB VAL 53 HB VAL 53 -10.241 4.975 -1.564
379 HG11 VAL 53 HG11 VAL 53 -10.425 5.782 -4.472
380 HG12 VAL 53 HG12 VAL 53 -9.710 6.821 -3.238
381 HG13 VAL 53 HG13 VAL 53 -11.408 6.355 -3.125
382 HG21 VAL 53 HG21 VAL 53 -11.877 3.701 -2.763
383 HG22 VAL 53 HG22 VAL 53 -10.445 2.679 -2.657
384 HG23 VAL 53 HG23 VAL 53 -10.815 3.525 -4.159
385 H GLY 54 H GLY 54 -8.620 2.312 -3.990
386 HA2 GLY 54 HA2 GLY 54 -8.085 3.402 -6.660
387 HA3 GLY 54 HA3 GLY 54 -7.000 2.157 -6.044
388 H GLN 55 H GLN 55 -8.495 1.741 -8.361
389 HA GLN 55 HA GLN 55 -10.745 0.026 -7.556
390 HB2 GLN 55 HB2 GLN 55 -9.867 1.107 -10.239
391 HB3 GLN 55 HB3 GLN 55 -11.187 -0.051 -10.037
392 HG2 GLN 55 HG2 GLN 55 -12.422 1.501 -8.655
393 HG3 GLN 55 HG3 GLN 55 -11.065 2.621 -8.612
394 HE21 GLN 55 HE21 GLN 55 -13.854 3.051 -9.687
395 HE22 GLN 55 HE22 GLN 55 -13.637 3.528 -11.302
396 H GLY 56 H GLY 56 -10.831 -2.136 -7.994
397 HA2 GLY 56 HA2 GLY 56 -8.794 -3.500 -9.520
398 HA3 GLY 56 HA3 GLY 56 -8.675 -3.774 -7.783
399 H GLN 57 H GLN 57 -9.293 -5.715 -9.850
400 HA GLN 57 HA GLN 57 -12.065 -6.313 -9.930
401 HB2 GLN 57 HB2 GLN 57 -9.613 -8.017 -10.378
402 HB3 GLN 57 HB3 GLN 57 -11.258 -8.611 -10.610
403 HG2 GLN 57 HG2 GLN 57 -10.599 -7.865 -12.762
404 HG3 GLN 57 HG3 GLN 57 -11.595 -6.553 -12.130
405 HE21 GLN 57 HE21 GLN 57 -10.622 -4.678 -12.946
406 HE22 GLN 57 HE22 GLN 57 -8.972 -4.310 -12.784
407 H LYS 58 H LYS 58 -9.453 -7.318 -7.774
408 HA LYS 58 HA LYS 58 -11.213 -9.051 -6.237
409 HB2 LYS 58 HB2 LYS 58 -9.213 -9.535 -4.892
410 HB3 LYS 58 HB3 LYS 58 -8.893 -9.742 -6.612
411 HG2 LYS 58 HG2 LYS 58 -7.856 -7.494 -6.687
412 HG3 LYS 58 HG3 LYS 58 -8.166 -7.298 -4.962
413 HD2 LYS 58 HD2 LYS 58 -6.763 -9.269 -4.480
414 HD3 LYS 58 HD3 LYS 58 -6.449 -9.465 -6.206
415 HE2 LYS 58 HE2 LYS 58 -5.402 -7.235 -6.277
416 HE3 LYS 58 HE3 LYS 58 -5.719 -7.029 -4.554
417 HZ1 LYS 58 HZ1 LYS 58 -4.109 -9.248 -5.687
418 HZ2 LYS 58 HZ2 LYS 58 -4.299 -8.852 -4.046
419 HZ3 LYS 58 HZ3 LYS 58 -3.442 -7.812 -5.081
420 H GLY 59 H GLY 59 -11.556 -6.018 -6.375
421 HA2 GLY 59 HA2 GLY 59 -12.815 -4.884 -4.622
422 HA3 GLY 59 HA3 GLY 59 -11.675 -5.555 -3.455
423 HA PRO 60 HA PRO 60 -10.259 -1.277 -5.012
424 HB2 PRO 60 HB2 PRO 60 -10.541 0.177 -2.735
425 HB3 PRO 60 HB3 PRO 60 -11.855 -0.020 -3.912
426 HG2 PRO 60 HG2 PRO 60 -11.389 -1.472 -1.348
427 HG3 PRO 60 HG3 PRO 60 -12.889 -0.793 -2.000
428 HD2 PRO 60 HD2 PRO 60 -12.306 -3.444 -2.188
429 HD3 PRO 60 HD3 PRO 60 -13.238 -2.588 -3.438
430 H CYS 61 H CYS 61 -8.254 -0.331 -4.565
431 HA CYS 61 HA CYS 61 -6.575 -1.739 -2.570
432 HB2 CYS 61 HB2 CYS 61 -6.099 -2.146 -5.052
433 HB3 CYS 61 HB3 CYS 61 -5.590 -0.459 -5.125
434 HG CYS 61 HG CYS 61 -3.490 -1.030 -3.922
435 H ALA 62 H ALA 62 -4.678 -0.377 -1.841
436 HA ALA 62 HA ALA 62 -5.354 2.497 -1.762
437 HB1 ALA 62 HB1 ALA 62 -5.838 2.120 0.430
438 HB2 ALA 62 HB2 ALA 62 -4.087 2.082 0.634
439 HB3 ALA 62 HB3 ALA 62 -4.987 0.578 0.454
440 H ASN 63 H ASN 63 -3.620 3.888 -1.997
441 HA ASN 63 HA ASN 63 -0.923 2.682 -2.134
442 HB2 ASN 63 HB2 ASN 63 -0.449 4.048 -4.137
443 HB3 ASN 63 HB3 ASN 63 -1.733 2.876 -4.423
444 HD21 ASN 63 HD21 ASN 63 -3.222 3.885 -5.787
445 HD22 ASN 63 HD22 ASN 63 -3.828 5.454 -5.562
446 H LYS 64 H LYS 64 0.749 4.568 -2.428
447 HA LYS 64 HA LYS 64 1.834 6.305 -1.396
448 HB2 LYS 64 HB2 LYS 64 -0.966 7.469 -1.366
449 HB3 LYS 64 HB3 LYS 64 0.503 8.377 -1.000
450 HG2 LYS 64 HG2 LYS 64 1.385 7.741 -3.267
451 HG3 LYS 64 HG3 LYS 64 -0.176 7.009 -3.622
452 HD2 LYS 64 HD2 LYS 64 0.125 9.904 -2.782
453 HD3 LYS 64 HD3 LYS 64 0.130 9.392 -4.468
454 HE2 LYS 64 HE2 LYS 64 -2.108 8.352 -4.132
455 HE3 LYS 64 HE3 LYS 64 -2.115 8.953 -2.474
456 HZ1 LYS 64 HZ1 LYS 64 -2.319 11.114 -3.158
457 HZ2 LYS 64 HZ2 LYS 64 -3.216 10.326 -4.367
458 HZ3 LYS 64 HZ3 LYS 64 -1.624 10.830 -4.678
459 H VAL 65 H VAL 65 1.576 4.259 0.209
460 HA VAL 65 HA VAL 65 0.152 4.761 2.645
461 HB VAL 65 HB VAL 65 2.407 2.815 2.062
462 HG11 VAL 65 HG11 VAL 65 1.524 1.582 4.026
463 HG12 VAL 65 HG12 VAL 65 0.380 2.891 4.321
464 HG13 VAL 65 HG13 VAL 65 2.111 3.183 4.475
465 HG21 VAL 65 HG21 VAL 65 -0.553 2.203 2.201
466 HG22 VAL 65 HG22 VAL 65 0.747 1.201 1.551
467 HG23 VAL 65 HG23 VAL 65 0.234 2.650 0.687
468 H VAL 66 H VAL 66 0.691 6.206 4.091
469 HA VAL 66 HA VAL 66 3.561 6.752 4.626
470 HB VAL 66 HB VAL 66 1.285 8.763 4.712
471 HG11 VAL 66 HG11 VAL 66 4.256 9.053 5.251
472 HG12 VAL 66 HG12 VAL 66 2.952 9.259 6.422
473 HG13 VAL 66 HG13 VAL 66 3.135 10.405 5.093
474 HG21 VAL 66 HG21 VAL 66 1.918 8.259 2.412
475 HG22 VAL 66 HG22 VAL 66 3.628 8.430 2.812
476 HG23 VAL 66 HG23 VAL 66 2.568 9.840 2.847
477 H ALA 67 H ALA 67 4.125 6.191 6.624
478 HA ALA 67 HA ALA 67 2.252 5.274 8.555
479 HB1 ALA 67 HB1 ALA 67 4.530 4.393 8.460
480 HB2 ALA 67 HB2 ALA 67 4.221 5.104 10.045
481 HB3 ALA 67 HB3 ALA 67 5.181 5.984 8.854
482 H VAL 68 H VAL 68 1.314 6.252 10.250
483 HA VAL 68 HA VAL 68 0.540 7.926 11.617
484 HB VAL 68 HB VAL 68 3.353 9.042 11.334
485 HG11 VAL 68 HG11 VAL 68 1.207 9.420 13.450
486 HG12 VAL 68 HG12 VAL 68 1.784 10.646 12.322
487 HG13 VAL 68 HG13 VAL 68 2.861 10.023 13.573
488 HG21 VAL 68 HG21 VAL 68 3.469 6.740 12.116
489 HG22 VAL 68 HG22 VAL 68 2.175 7.028 13.278
490 HG23 VAL 68 HG23 VAL 68 3.741 7.808 13.492
Start of MODEL 14
1 H1 MET 1 HT1 MET 1 -5.904 13.946 3.910
2 H2 MET 1 HT2 MET 1 -7.308 13.881 2.956
3 H3 MET 1 HT3 MET 1 -5.849 14.442 2.289
4 HA MET 1 HA MET 1 -6.301 12.196 1.544
5 HB2 MET 1 HB2 MET 1 -3.998 12.735 3.414
6 HB3 MET 1 HB3 MET 1 -4.168 11.151 2.658
7 HG2 MET 1 HG2 MET 1 -4.136 13.758 1.111
8 HG3 MET 1 HG3 MET 1 -2.711 12.751 1.365
9 HE1 MET 1 HE1 MET 1 -3.510 13.700 -1.205
10 HE2 MET 1 HE2 MET 1 -3.876 12.430 -2.369
11 HE3 MET 1 HE3 MET 1 -2.384 12.355 -1.437
12 H SER 2 H SER 2 -7.000 10.150 1.988
13 HA SER 2 HA SER 2 -8.532 9.696 4.319
14 HB2 SER 2 HB2 SER 2 -9.062 8.579 2.225
15 HB3 SER 2 HB3 SER 2 -7.508 7.754 2.237
16 HG SER 2 HG SER 2 -8.959 6.346 3.110
17 H LYS 3 H LYS 3 -8.152 8.529 6.153
18 HA LYS 3 HA LYS 3 -5.550 7.223 6.513
19 HB2 LYS 3 HB2 LYS 3 -5.296 9.562 7.318
20 HB3 LYS 3 HB3 LYS 3 -6.631 9.301 8.439
21 HG2 LYS 3 HG2 LYS 3 -5.367 7.531 9.570
22 HG3 LYS 3 HG3 LYS 3 -4.054 7.698 8.405
23 HD2 LYS 3 HD2 LYS 3 -3.372 8.936 10.332
24 HD3 LYS 3 HD3 LYS 3 -3.881 10.136 9.146
25 HE2 LYS 3 HE2 LYS 3 -6.069 10.328 10.238
26 HE3 LYS 3 HE3 LYS 3 -5.623 9.069 11.390
27 HZ1 LYS 3 HZ1 LYS 3 -3.751 10.509 12.081
28 HZ2 LYS 3 HZ2 LYS 3 -5.277 11.184 12.403
29 HZ3 LYS 3 HZ3 LYS 3 -4.361 11.737 11.082
30 H GLY 4 H GLY 4 -5.854 5.289 7.387
31 HA2 GLY 4 HA2 GLY 4 -8.162 4.856 9.188
32 HA3 GLY 4 HA3 GLY 4 -7.793 3.725 7.887
33 H ILE 5 H ILE 5 -7.802 2.332 9.952
34 HA ILE 5 HA ILE 5 -5.056 2.274 11.074
35 HB ILE 5 HB ILE 5 -6.120 1.001 13.002
36 HG12 ILE 5 HG12 ILE 5 -8.707 2.273 12.068
37 HG13 ILE 5 HG13 ILE 5 -8.297 0.621 11.625
38 HG21 ILE 5 HG21 ILE 5 -5.434 3.407 13.079
39 HG22 ILE 5 HG22 ILE 5 -6.799 3.044 14.138
40 HG23 ILE 5 HG23 ILE 5 -7.069 3.852 12.594
41 HD11 ILE 5 HD11 ILE 5 -9.640 0.547 13.643
42 HD12 ILE 5 HD12 ILE 5 -8.601 1.736 14.428
43 HD13 ILE 5 HD13 ILE 5 -7.986 0.121 14.079
44 H VAL 6 H VAL 6 -3.865 0.567 10.659
45 HA VAL 6 HA VAL 6 -4.801 -1.447 8.892
46 HB VAL 6 HB VAL 6 -2.226 -1.325 10.481
47 HG11 VAL 6 HG11 VAL 6 -2.397 -3.565 9.742
48 HG12 VAL 6 HG12 VAL 6 -1.463 -2.788 8.465
49 HG13 VAL 6 HG13 VAL 6 -3.179 -3.103 8.233
50 HG21 VAL 6 HG21 VAL 6 -1.257 -0.272 8.563
51 HG22 VAL 6 HG22 VAL 6 -2.766 0.590 8.864
52 HG23 VAL 6 HG23 VAL 6 -2.679 -0.608 7.573
53 H LYS 7 H LYS 7 -5.843 -3.235 9.313
54 HA LYS 7 HA LYS 7 -6.502 -4.097 11.950
55 HB2 LYS 7 HB2 LYS 7 -7.921 -4.544 9.936
56 HB3 LYS 7 HB3 LYS 7 -6.695 -5.675 9.365
57 HG2 LYS 7 HG2 LYS 7 -6.968 -7.003 11.448
58 HG3 LYS 7 HG3 LYS 7 -8.226 -5.890 11.978
59 HD2 LYS 7 HD2 LYS 7 -8.386 -7.388 9.354
60 HD3 LYS 7 HD3 LYS 7 -9.040 -8.038 10.857
61 HE2 LYS 7 HE2 LYS 7 -10.436 -5.982 11.096
62 HE3 LYS 7 HE3 LYS 7 -9.837 -5.426 9.533
63 HZ1 LYS 7 HZ1 LYS 7 -11.646 -7.650 10.147
64 HZ2 LYS 7 HZ2 LYS 7 -10.637 -7.778 8.786
65 HZ3 LYS 7 HZ3 LYS 7 -11.739 -6.492 8.912
66 H TRP 8 H TRP 8 -4.244 -5.245 9.468
67 HA TRP 8 HA TRP 8 -2.402 -6.245 11.434
68 HB2 TRP 8 HB2 TRP 8 -4.248 -8.048 11.127
69 HB3 TRP 8 HB3 TRP 8 -3.511 -8.320 9.551
70 HD1 TRP 8 HD1 TRP 8 -1.093 -9.371 9.480
71 HE1 TRP 8 HE1 TRP 8 0.312 -10.625 11.241
72 HE3 TRP 8 HE3 TRP 8 -3.719 -8.196 13.695
73 HZ2 TRP 8 HZ2 TRP 8 0.317 -11.071 14.067
74 HZ3 TRP 8 HZ3 TRP 8 -2.996 -9.049 15.907
75 HH2 TRP 8 HH2 TRP 8 -0.982 -10.484 16.098
76 H PHE 9 H PHE 9 -0.410 -5.892 10.610
77 HA PHE 9 HA PHE 9 -0.141 -5.776 7.648
78 HB2 PHE 9 HB2 PHE 9 0.337 -3.651 8.997
79 HB3 PHE 9 HB3 PHE 9 1.752 -4.496 9.627
80 HD1 PHE 9 HD1 PHE 9 0.266 -2.857 6.726
81 HD2 PHE 9 HD2 PHE 9 3.554 -5.266 8.081
82 HE1 PHE 9 HE1 PHE 9 1.505 -2.334 4.643
83 HE2 PHE 9 HE2 PHE 9 4.792 -4.738 5.999
84 HZ PHE 9 HZ PHE 9 3.770 -3.275 4.283
85 H ASN 10 H ASN 10 1.072 -7.319 6.708
86 HA ASN 10 HA ASN 10 3.067 -8.747 8.377
87 HB2 ASN 10 HB2 ASN 10 1.292 -9.892 6.211
88 HB3 ASN 10 HB3 ASN 10 2.587 -10.768 7.021
89 HD21 ASN 10 HD21 ASN 10 -0.514 -11.035 7.054
90 HD22 ASN 10 HD22 ASN 10 -0.878 -11.104 8.711
91 H SER 11 H SER 11 4.863 -7.579 7.692
92 HA SER 11 HA SER 11 5.445 -6.859 5.042
93 HB2 SER 11 HB2 SER 11 7.288 -7.374 7.385
94 HB3 SER 11 HB3 SER 11 7.779 -6.625 5.869
95 HG SER 11 HG SER 11 6.094 -5.668 7.897
96 H ASP 12 H ASP 12 6.208 -9.776 6.910
97 HA ASP 12 HA ASP 12 8.029 -10.970 5.136
98 HB2 ASP 12 HB2 ASP 12 6.019 -12.188 7.042
99 HB3 ASP 12 HB3 ASP 12 7.196 -13.145 6.148
100 H LYS 13 H LYS 13 4.490 -11.083 5.262
101 HA LYS 13 HA LYS 13 4.213 -12.790 2.960
102 HB2 LYS 13 HB2 LYS 13 2.231 -10.979 4.369
103 HB3 LYS 13 HB3 LYS 13 1.816 -12.127 3.104
104 HG2 LYS 13 HG2 LYS 13 3.212 -12.953 5.660
105 HG3 LYS 13 HG3 LYS 13 1.457 -12.938 5.498
106 HD2 LYS 13 HD2 LYS 13 3.260 -14.469 3.599
107 HD3 LYS 13 HD3 LYS 13 2.583 -15.184 5.061
108 HE2 LYS 13 HE2 LYS 13 0.296 -14.587 4.244
109 HE3 LYS 13 HE3 LYS 13 1.018 -14.015 2.740
110 HZ1 LYS 13 HZ1 LYS 13 0.173 -16.373 2.752
111 HZ2 LYS 13 HZ2 LYS 13 1.474 -16.748 3.779
112 HZ3 LYS 13 HZ3 LYS 13 1.766 -16.157 2.212
113 H GLY 14 H GLY 14 4.519 -9.387 3.570
114 HA2 GLY 14 HA2 GLY 14 5.205 -7.758 2.016
115 HA3 GLY 14 HA3 GLY 14 4.718 -8.827 0.708
116 H PHE 15 H PHE 15 2.270 -8.694 3.044
117 HA PHE 15 HA PHE 15 1.006 -6.266 2.109
118 HB2 PHE 15 HB2 PHE 15 -0.982 -7.374 1.163
119 HB3 PHE 15 HB3 PHE 15 0.475 -7.736 0.239
120 HD1 PHE 15 HD1 PHE 15 -2.037 -9.084 2.586
121 HD2 PHE 15 HD2 PHE 15 1.438 -9.969 0.221
122 HE1 PHE 15 HE1 PHE 15 -2.443 -11.511 2.898
123 HE2 PHE 15 HE2 PHE 15 1.034 -12.394 0.535
124 HZ PHE 15 HZ PHE 15 -0.905 -13.166 1.874
125 H GLY 16 H GLY 16 -1.305 -6.143 2.971
126 HA2 GLY 16 HA2 GLY 16 -1.915 -7.673 5.337
127 HA3 GLY 16 HA3 GLY 16 -1.372 -6.035 5.688
128 H PHE 17 H PHE 17 -3.803 -6.499 6.534
129 HA PHE 17 HA PHE 17 -5.639 -5.373 4.497
130 HB2 PHE 17 HB2 PHE 17 -6.256 -7.123 6.896
131 HB3 PHE 17 HB3 PHE 17 -7.470 -6.381 5.855
132 HD1 PHE 17 HD1 PHE 17 -4.878 -8.976 6.112
133 HD2 PHE 17 HD2 PHE 17 -7.782 -7.130 3.540
134 HE1 PHE 17 HE1 PHE 17 -4.683 -10.875 4.528
135 HE2 PHE 17 HE2 PHE 17 -7.587 -9.029 1.958
136 HZ PHE 17 HZ PHE 17 -6.037 -10.902 2.451
137 H ILE 18 H ILE 18 -6.651 -3.465 4.985
138 HA ILE 18 HA ILE 18 -6.104 -2.354 7.662
139 HB ILE 18 HB ILE 18 -4.885 -1.176 5.899
140 HG12 ILE 18 HG12 ILE 18 -7.149 0.627 6.786
141 HG13 ILE 18 HG13 ILE 18 -5.962 0.010 7.936
142 HG21 ILE 18 HG21 ILE 18 -6.359 0.231 4.301
143 HG22 ILE 18 HG22 ILE 18 -7.651 -0.896 4.716
144 HG23 ILE 18 HG23 ILE 18 -6.181 -1.486 3.945
145 HD11 ILE 18 HD11 ILE 18 -5.386 2.271 6.974
146 HD12 ILE 18 HD12 ILE 18 -5.222 1.489 5.400
147 HD13 ILE 18 HD13 ILE 18 -4.152 1.037 6.725
148 H THR 19 H THR 19 -7.625 -1.231 8.754
149 HA THR 19 HA THR 19 -10.389 -1.788 7.972
150 HB THR 19 HB THR 19 -9.267 -0.891 10.630
151 HG1 THR 19 HG1 THR 19 -9.085 -2.954 11.095
152 HG21 THR 19 HG21 THR 19 -11.994 -1.923 9.792
153 HG22 THR 19 HG22 THR 19 -11.620 -0.315 10.411
154 HG23 THR 19 HG23 THR 19 -11.483 -1.721 11.469
155 HA PRO 20 HA PRO 20 -10.329 2.642 6.694
156 HB2 PRO 20 HB2 PRO 20 -13.224 1.955 6.337
157 HB3 PRO 20 HB3 PRO 20 -12.139 2.844 5.250
158 HG2 PRO 20 HG2 PRO 20 -12.764 0.365 4.696
159 HG3 PRO 20 HG3 PRO 20 -11.085 0.908 4.519
160 HD2 PRO 20 HD2 PRO 20 -12.300 -0.741 6.719
161 HD3 PRO 20 HD3 PRO 20 -10.719 -0.912 5.921
162 H GLU 21 H GLU 21 -10.655 4.388 7.918
163 HA GLU 21 HA GLU 21 -11.607 4.275 10.557
164 HB2 GLU 21 HB2 GLU 21 -9.988 5.950 9.773
165 HB3 GLU 21 HB3 GLU 21 -11.216 6.669 8.737
166 HG2 GLU 21 HG2 GLU 21 -11.043 7.982 10.780
167 HG3 GLU 21 HG3 GLU 21 -12.596 7.143 10.750
168 H ASP 22 H ASP 22 -13.134 5.395 7.559
169 HA ASP 22 HA ASP 22 -15.491 6.443 8.717
170 HB2 ASP 22 HB2 ASP 22 -14.881 5.403 5.950
171 HB3 ASP 22 HB3 ASP 22 -16.428 6.121 6.381
172 H GLY 23 H GLY 23 -14.477 3.194 8.307
173 HA2 GLY 23 HA2 GLY 23 -15.646 1.381 9.344
174 HA3 GLY 23 HA3 GLY 23 -17.159 2.239 9.069
175 H SER 24 H SER 24 -15.114 2.424 6.372
176 HA SER 24 HA SER 24 -16.864 0.856 4.737
177 HB2 SER 24 HB2 SER 24 -14.151 2.061 4.163
178 HB3 SER 24 HB3 SER 24 -15.195 1.328 2.957
179 HG SER 24 HG SER 24 -15.447 3.620 3.126
180 H LYS 25 H LYS 25 -15.979 -0.886 3.274
181 HA LYS 25 HA LYS 25 -15.088 -3.084 4.808
182 HB2 LYS 25 HB2 LYS 25 -15.213 -2.668 1.813
183 HB3 LYS 25 HB3 LYS 25 -14.849 -4.214 2.580
184 HG2 LYS 25 HG2 LYS 25 -17.012 -4.136 3.769
185 HG3 LYS 25 HG3 LYS 25 -17.378 -2.592 3.000
186 HD2 LYS 25 HD2 LYS 25 -17.262 -3.664 0.781
187 HD3 LYS 25 HD3 LYS 25 -16.895 -5.210 1.546
188 HE2 LYS 25 HE2 LYS 25 -19.053 -5.143 2.734
189 HE3 LYS 25 HE3 LYS 25 -19.424 -3.593 1.979
190 HZ1 LYS 25 HZ1 LYS 25 -19.034 -6.198 0.612
191 HZ2 LYS 25 HZ2 LYS 25 -19.192 -4.713 -0.199
192 HZ3 LYS 25 HZ3 LYS 25 -20.477 -5.316 0.736
193 H ASP 26 H ASP 26 -13.114 -4.234 4.776
194 HA ASP 26 HA ASP 26 -10.791 -2.734 4.963
195 HB2 ASP 26 HB2 ASP 26 -11.222 -5.684 4.523
196 HB3 ASP 26 HB3 ASP 26 -9.633 -4.985 4.807
197 H LEU 27 H LEU 27 -9.061 -2.350 3.689
198 HA LEU 27 HA LEU 27 -9.357 -2.936 0.800
199 HB2 LEU 27 HB2 LEU 27 -7.966 -0.587 2.129
200 HB3 LEU 27 HB3 LEU 27 -8.081 -0.866 0.396
201 HG LEU 27 HG LEU 27 -10.492 -0.520 2.211
202 HD11 LEU 27 HD11 LEU 27 -10.636 1.749 1.346
203 HD12 LEU 27 HD12 LEU 27 -9.232 1.484 0.313
204 HD13 LEU 27 HD13 LEU 27 -9.043 1.524 2.066
205 HD21 LEU 27 HD21 LEU 27 -11.628 -0.087 0.006
206 HD22 LEU 27 HD22 LEU 27 -11.021 -1.734 0.166
207 HD23 LEU 27 HD23 LEU 27 -10.136 -0.559 -0.806
208 H PHE 28 H PHE 28 -7.476 -3.513 -0.359
209 HA PHE 28 HA PHE 28 -5.519 -4.982 1.169
210 HB2 PHE 28 HB2 PHE 28 -5.845 -4.443 -1.789
211 HB3 PHE 28 HB3 PHE 28 -4.541 -5.429 -1.120
212 HD1 PHE 28 HD1 PHE 28 -8.169 -5.201 -1.708
213 HD2 PHE 28 HD2 PHE 28 -4.994 -7.597 -0.090
214 HE1 PHE 28 HE1 PHE 28 -9.694 -7.156 -1.611
215 HE2 PHE 28 HE2 PHE 28 -6.516 -9.550 0.007
216 HZ PHE 28 HZ PHE 28 -8.864 -9.331 -0.755
217 H VAL 29 H VAL 29 -3.498 -4.379 1.722
218 HA VAL 29 HA VAL 29 -2.380 -1.901 0.563
219 HB VAL 29 HB VAL 29 -2.353 -2.716 3.480
220 HG11 VAL 29 HG11 VAL 29 -0.276 -1.537 2.633
221 HG12 VAL 29 HG12 VAL 29 -1.133 -0.689 3.919
222 HG13 VAL 29 HG13 VAL 29 -1.308 -0.162 2.248
223 HG21 VAL 29 HG21 VAL 29 -3.895 -1.002 3.918
224 HG22 VAL 29 HG22 VAL 29 -4.506 -1.693 2.416
225 HG23 VAL 29 HG23 VAL 29 -3.580 -0.193 2.386
226 H HIS 30 H HIS 30 -0.293 -2.127 -0.110
227 HA HIS 30 HA HIS 30 1.114 -4.628 0.619
228 HB2 HIS 30 HB2 HIS 30 1.369 -2.923 -1.868
229 HB3 HIS 30 HB3 HIS 30 2.356 -4.339 -1.511
230 HD2 HIS 30 HD2 HIS 30 -0.989 -3.542 -3.174
231 HE1 HIS 30 HE1 HIS 30 -1.105 -7.662 -2.261
232 HE2 HIS 30 HE2 HIS 30 -2.253 -5.797 -3.546
233 H HIS 31 H HIS 31 3.213 -4.589 1.234
234 HA HIS 31 HA HIS 31 4.179 -2.326 2.647
235 HB2 HIS 31 HB2 HIS 31 4.782 -4.706 3.166
236 HB3 HIS 31 HB3 HIS 31 5.779 -4.725 1.710
237 HD2 HIS 31 HD2 HIS 31 5.915 -3.341 5.363
238 HE1 HIS 31 HE1 HIS 31 9.476 -2.165 3.422
239 HE2 HIS 31 HE2 HIS 31 8.276 -2.268 5.658
240 H SER 32 H SER 32 5.097 -3.751 -0.460
241 HA SER 32 HA SER 32 7.180 -1.912 -1.052
242 HB2 SER 32 HB2 SER 32 7.132 -2.881 -3.282
243 HB3 SER 32 HB3 SER 32 6.994 -4.151 -2.069
244 HG SER 32 HG SER 32 5.462 -4.230 -3.873
245 H GLU 33 H GLU 33 3.814 -1.439 -1.088
246 HA GLU 33 HA GLU 33 3.558 0.243 -3.374
247 HB2 GLU 33 HB2 GLU 33 1.679 -0.890 -2.101
248 HB3 GLU 33 HB3 GLU 33 1.861 0.365 -0.879
249 HG2 GLU 33 HG2 GLU 33 0.120 1.053 -2.421
250 HG3 GLU 33 HG3 GLU 33 1.526 2.083 -2.676
251 H ILE 34 H ILE 34 4.674 0.820 -0.103
252 HA ILE 34 HA ILE 34 4.301 3.606 0.047
253 HB ILE 34 HB ILE 34 4.892 2.196 1.986
254 HG12 ILE 34 HG12 ILE 34 7.106 4.225 1.598
255 HG13 ILE 34 HG13 ILE 34 5.431 4.724 1.816
256 HG21 ILE 34 HG21 ILE 34 6.962 1.135 2.258
257 HG22 ILE 34 HG22 ILE 34 7.766 2.161 1.069
258 HG23 ILE 34 HG23 ILE 34 6.663 0.897 0.538
259 HD11 ILE 34 HD11 ILE 34 5.327 3.558 3.965
260 HD12 ILE 34 HD12 ILE 34 6.696 4.672 3.966
261 HD13 ILE 34 HD13 ILE 34 6.965 2.945 3.736
262 H GLN 35 H GLN 35 5.417 5.327 -0.693
263 HA GLN 35 HA GLN 35 7.660 4.799 -2.543
264 HB2 GLN 35 HB2 GLN 35 5.607 5.919 -3.462
265 HB3 GLN 35 HB3 GLN 35 5.904 7.262 -2.361
266 HG2 GLN 35 HG2 GLN 35 8.093 7.659 -3.393
267 HG3 GLN 35 HG3 GLN 35 7.859 6.276 -4.460
268 HE21 GLN 35 HE21 GLN 35 8.062 9.334 -4.976
269 HE22 GLN 35 HE22 GLN 35 6.715 9.656 -5.958
270 H SER 36 H SER 36 9.587 5.157 -1.671
271 HA SER 36 HA SER 36 11.306 6.058 -0.449
272 HB2 SER 36 HB2 SER 36 10.665 8.058 -1.839
273 HB3 SER 36 HB3 SER 36 9.669 8.601 -0.493
274 HG SER 36 HG SER 36 12.457 8.386 -0.714
275 H GLY 37 H GLY 37 11.901 7.032 1.656
276 HA2 GLY 37 HA2 GLY 37 11.672 7.319 3.935
277 HA3 GLY 37 HA3 GLY 37 9.934 7.441 3.695
278 H GLY 38 H GLY 38 11.355 4.602 2.378
279 HA2 GLY 38 HA2 GLY 38 10.024 2.962 4.397
280 HA3 GLY 38 HA3 GLY 38 10.674 2.404 2.863
281 H GLU 39 H GLU 39 13.044 4.299 4.230
282 HA GLU 39 HA GLU 39 14.805 2.155 4.729
283 HB2 GLU 39 HB2 GLU 39 14.905 5.071 5.523
284 HB3 GLU 39 HB3 GLU 39 16.229 3.945 5.812
285 HG2 GLU 39 HG2 GLU 39 15.029 4.569 3.095
286 HG3 GLU 39 HG3 GLU 39 16.547 5.217 3.704
287 H TYR 40 H TYR 40 12.846 4.155 6.911
288 HA TYR 40 HA TYR 40 13.488 2.270 9.110
289 HB2 TYR 40 HB2 TYR 40 12.905 5.232 9.290
290 HB3 TYR 40 HB3 TYR 40 13.104 4.155 10.672
291 HD1 TYR 40 HD1 TYR 40 14.809 5.924 7.949
292 HD2 TYR 40 HD2 TYR 40 15.291 3.116 11.163
293 HE1 TYR 40 HE1 TYR 40 17.270 6.197 7.817
294 HE2 TYR 40 HE2 TYR 40 17.752 3.387 11.032
295 HH TYR 40 HH TYR 40 19.383 4.279 8.758
296 H ALA 41 H ALA 41 11.000 3.839 7.273
297 HA ALA 41 HA ALA 41 8.849 3.696 9.079
298 HB1 ALA 41 HB1 ALA 41 8.840 3.477 6.061
299 HB2 ALA 41 HB2 ALA 41 8.710 4.965 6.999
300 HB3 ALA 41 HB3 ALA 41 7.418 3.767 7.063
301 H THR 42 H THR 42 7.737 2.073 9.878
302 HA THR 42 HA THR 42 7.709 -0.527 8.476
303 HB THR 42 HB THR 42 7.898 -1.677 10.651
304 HG1 THR 42 HG1 THR 42 8.204 -0.550 12.478
305 HG21 THR 42 HG21 THR 42 10.314 -0.976 11.129
306 HG22 THR 42 HG22 THR 42 10.099 0.240 9.869
307 HG23 THR 42 HG23 THR 42 9.957 -1.473 9.476
308 H LEU 43 H LEU 43 5.904 -1.926 9.164
309 HA LEU 43 HA LEU 43 3.629 -0.475 10.344
310 HB2 LEU 43 HB2 LEU 43 3.491 -2.085 7.786
311 HB3 LEU 43 HB3 LEU 43 2.119 -1.370 8.613
312 HG LEU 43 HG LEU 43 4.469 0.226 7.542
313 HD11 LEU 43 HD11 LEU 43 1.758 -0.400 6.342
314 HD12 LEU 43 HD12 LEU 43 3.343 -0.757 5.653
315 HD13 LEU 43 HD13 LEU 43 2.789 0.913 5.773
316 HD21 LEU 43 HD21 LEU 43 1.792 0.933 8.767
317 HD22 LEU 43 HD22 LEU 43 2.643 2.071 7.720
318 HD23 LEU 43 HD23 LEU 43 3.392 1.520 9.215
319 H ALA 44 H ALA 44 2.135 -1.805 11.428
320 HA ALA 44 HA ALA 44 2.653 -4.689 11.551
321 HB1 ALA 44 HB1 ALA 44 2.492 -3.115 14.116
322 HB2 ALA 44 HB2 ALA 44 4.038 -3.374 13.307
323 HB3 ALA 44 HB3 ALA 44 3.093 -4.755 13.864
324 H ASP 45 H ASP 45 0.957 -5.056 13.919
325 HA ASP 45 HA ASP 45 -1.615 -4.771 12.610
326 HB2 ASP 45 HB2 ASP 45 -2.445 -6.158 14.477
327 HB3 ASP 45 HB3 ASP 45 -1.070 -6.898 13.666
328 H GLY 46 H GLY 46 -2.725 -2.960 12.816
329 HA2 GLY 46 HA2 GLY 46 -4.111 -1.515 14.119
330 HA3 GLY 46 HA3 GLY 46 -3.019 -1.733 15.478
331 H GLN 47 H GLN 47 -1.125 -1.267 12.778
332 HA GLN 47 HA GLN 47 -0.214 1.292 13.585
333 HB2 GLN 47 HB2 GLN 47 1.147 -0.466 12.442
334 HB3 GLN 47 HB3 GLN 47 0.256 -0.137 10.960
335 HG2 GLN 47 HG2 GLN 47 2.385 1.078 10.975
336 HG3 GLN 47 HG3 GLN 47 1.038 2.201 11.009
337 HE21 GLN 47 HE21 GLN 47 1.502 3.900 12.419
338 HE22 GLN 47 HE22 GLN 47 2.329 3.744 13.893
339 H THR 48 H THR 48 -0.782 3.285 12.969
340 HA THR 48 HA THR 48 -3.089 3.636 11.227
341 HB THR 48 HB THR 48 -1.433 5.700 12.717
342 HG1 THR 48 HG1 THR 48 -2.400 4.273 14.141
343 HG21 THR 48 HG21 THR 48 -2.903 6.462 10.764
344 HG22 THR 48 HG22 THR 48 -3.243 7.210 12.324
345 HG23 THR 48 HG23 THR 48 -4.280 5.920 11.721
346 H VAL 49 H VAL 49 -3.003 4.206 9.150
347 HA VAL 49 HA VAL 49 -0.565 5.469 8.085
348 HB VAL 49 HB VAL 49 -0.548 3.946 6.137
349 HG11 VAL 49 HG11 VAL 49 0.257 1.907 7.395
350 HG12 VAL 49 HG12 VAL 49 -0.306 2.678 8.878
351 HG13 VAL 49 HG13 VAL 49 0.978 3.426 7.926
352 HG21 VAL 49 HG21 VAL 49 -2.700 2.508 7.717
353 HG22 VAL 49 HG22 VAL 49 -1.823 1.780 6.369
354 HG23 VAL 49 HG23 VAL 49 -2.848 3.190 6.098
355 H GLU 50 H GLU 50 -0.857 6.210 5.819
356 HA GLU 50 HA GLU 50 -3.630 7.137 5.330
357 HB2 GLU 50 HB2 GLU 50 -1.037 8.590 4.727
358 HB3 GLU 50 HB3 GLU 50 -2.650 9.156 4.292
359 HG2 GLU 50 HG2 GLU 50 -3.275 9.200 6.683
360 HG3 GLU 50 HG3 GLU 50 -1.656 8.652 7.114
361 H TYR 51 H TYR 51 -4.394 6.906 3.238
362 HA TYR 51 HA TYR 51 -2.593 6.116 1.098
363 HB2 TYR 51 HB2 TYR 51 -3.699 3.957 0.679
364 HB3 TYR 51 HB3 TYR 51 -2.912 3.985 2.254
365 HD1 TYR 51 HD1 TYR 51 -6.143 3.998 0.482
366 HD2 TYR 51 HD2 TYR 51 -4.224 4.037 4.324
367 HE1 TYR 51 HE1 TYR 51 -8.306 3.460 1.567
368 HE2 TYR 51 HE2 TYR 51 -6.386 3.495 5.409
369 HH TYR 51 HH TYR 51 -8.620 2.261 4.538
370 H GLU 52 H GLU 52 -3.721 5.696 -0.939
371 HA GLU 52 HA GLU 52 -6.251 7.215 -1.164
372 HB2 GLU 52 HB2 GLU 52 -4.282 8.388 -2.170
373 HB3 GLU 52 HB3 GLU 52 -4.032 6.995 -3.224
374 HG2 GLU 52 HG2 GLU 52 -6.270 7.311 -4.198
375 HG3 GLU 52 HG3 GLU 52 -6.554 8.679 -3.124
376 H VAL 53 H VAL 53 -7.912 6.072 -1.952
377 HA VAL 53 HA VAL 53 -7.817 3.320 -2.437
378 HB VAL 53 HB VAL 53 -9.869 4.568 -1.840
379 HG11 VAL 53 HG11 VAL 53 -9.863 5.514 -4.722
380 HG12 VAL 53 HG12 VAL 53 -9.441 6.527 -3.341
381 HG13 VAL 53 HG13 VAL 53 -11.073 5.878 -3.491
382 HG21 VAL 53 HG21 VAL 53 -9.886 2.307 -3.042
383 HG22 VAL 53 HG22 VAL 53 -10.273 3.202 -4.510
384 HG23 VAL 53 HG23 VAL 53 -11.377 3.244 -3.135
385 H GLY 54 H GLY 54 -7.937 2.083 -4.305
386 HA2 GLY 54 HA2 GLY 54 -7.271 3.387 -6.868
387 HA3 GLY 54 HA3 GLY 54 -6.272 2.059 -6.279
388 H GLN 55 H GLN 55 -7.847 2.117 -8.726
389 HA GLN 55 HA GLN 55 -10.134 0.379 -8.229
390 HB2 GLN 55 HB2 GLN 55 -10.178 2.209 -9.949
391 HB3 GLN 55 HB3 GLN 55 -8.988 1.297 -10.877
392 HG2 GLN 55 HG2 GLN 55 -11.229 0.814 -11.726
393 HG3 GLN 55 HG3 GLN 55 -10.567 -0.627 -10.962
394 HE21 GLN 55 HE21 GLN 55 -12.184 -1.665 -9.792
395 HE22 GLN 55 HE22 GLN 55 -13.375 -0.883 -8.872
396 H GLY 56 H GLY 56 -10.101 -1.764 -8.325
397 HA2 GLY 56 HA2 GLY 56 -7.924 -3.132 -9.781
398 HA3 GLY 56 HA3 GLY 56 -8.312 -3.598 -8.127
399 H GLN 57 H GLN 57 -8.480 -5.139 -10.665
400 HA GLN 57 HA GLN 57 -11.166 -5.464 -11.485
401 HB2 GLN 57 HB2 GLN 57 -8.782 -7.317 -11.591
402 HB3 GLN 57 HB3 GLN 57 -10.341 -7.700 -12.325
403 HG2 GLN 57 HG2 GLN 57 -10.223 -5.758 -13.757
404 HG3 GLN 57 HG3 GLN 57 -8.785 -5.174 -12.923
405 HE21 GLN 57 HE21 GLN 57 -9.131 -5.936 -15.829
406 HE22 GLN 57 HE22 GLN 57 -7.953 -7.124 -16.116
407 H LYS 58 H LYS 58 -9.238 -7.122 -9.002
408 HA LYS 58 HA LYS 58 -11.479 -8.830 -8.254
409 HB2 LYS 58 HB2 LYS 58 -8.687 -8.536 -7.131
410 HB3 LYS 58 HB3 LYS 58 -9.878 -9.691 -6.536
411 HG2 LYS 58 HG2 LYS 58 -10.044 -10.657 -8.829
412 HG3 LYS 58 HG3 LYS 58 -8.777 -9.555 -9.359
413 HD2 LYS 58 HD2 LYS 58 -8.401 -11.507 -7.074
414 HD3 LYS 58 HD3 LYS 58 -8.000 -11.902 -8.743
415 HE2 LYS 58 HE2 LYS 58 -6.854 -9.554 -7.195
416 HE3 LYS 58 HE3 LYS 58 -6.021 -11.082 -7.473
417 HZ1 LYS 58 HZ1 LYS 58 -5.253 -9.793 -9.193
418 HZ2 LYS 58 HZ2 LYS 58 -6.729 -8.976 -9.400
419 HZ3 LYS 58 HZ3 LYS 58 -6.559 -10.579 -9.935
420 H GLY 59 H GLY 59 -10.125 -5.799 -7.296
421 HA2 GLY 59 HA2 GLY 59 -12.183 -4.892 -5.739
422 HA3 GLY 59 HA3 GLY 59 -11.149 -5.761 -4.605
423 HA PRO 60 HA PRO 60 -9.418 -1.425 -5.636
424 HB2 PRO 60 HB2 PRO 60 -10.128 0.014 -3.450
425 HB3 PRO 60 HB3 PRO 60 -11.175 -0.132 -4.877
426 HG2 PRO 60 HG2 PRO 60 -11.287 -1.623 -2.296
427 HG3 PRO 60 HG3 PRO 60 -12.602 -0.888 -3.227
428 HD2 PRO 60 HD2 PRO 60 -12.058 -3.557 -3.334
429 HD3 PRO 60 HD3 PRO 60 -12.713 -2.664 -4.725
430 H CYS 61 H CYS 61 -7.530 -0.558 -4.765
431 HA CYS 61 HA CYS 61 -6.383 -1.971 -2.428
432 HB2 CYS 61 HB2 CYS 61 -4.956 -1.036 -4.931
433 HB3 CYS 61 HB3 CYS 61 -4.189 -1.787 -3.534
434 HG CYS 61 HG CYS 61 -5.048 -4.026 -4.236
435 H ALA 62 H ALA 62 -4.280 -0.604 -1.742
436 HA ALA 62 HA ALA 62 -5.157 2.215 -1.509
437 HB1 ALA 62 HB1 ALA 62 -4.167 0.244 0.466
438 HB2 ALA 62 HB2 ALA 62 -5.263 1.605 0.688
439 HB3 ALA 62 HB3 ALA 62 -3.522 1.877 0.628
440 H ASN 63 H ASN 63 -3.707 3.776 -2.080
441 HA ASN 63 HA ASN 63 -0.977 2.910 -2.824
442 HB2 ASN 63 HB2 ASN 63 -2.514 3.568 -4.720
443 HB3 ASN 63 HB3 ASN 63 -2.543 5.193 -4.039
444 HD21 ASN 63 HD21 ASN 63 -1.372 6.182 -5.797
445 HD22 ASN 63 HD22 ASN 63 0.263 5.840 -6.100
446 H LYS 64 H LYS 64 0.683 4.589 -2.664
447 HA LYS 64 HA LYS 64 1.880 6.113 -1.438
448 HB2 LYS 64 HB2 LYS 64 -0.829 7.467 -1.335
449 HB3 LYS 64 HB3 LYS 64 0.685 8.220 -0.837
450 HG2 LYS 64 HG2 LYS 64 1.601 7.945 -3.091
451 HG3 LYS 64 HG3 LYS 64 0.145 7.093 -3.603
452 HD2 LYS 64 HD2 LYS 64 -0.126 9.337 -4.372
453 HD3 LYS 64 HD3 LYS 64 -1.151 9.200 -2.945
454 HE2 LYS 64 HE2 LYS 64 0.103 11.283 -2.814
455 HE3 LYS 64 HE3 LYS 64 0.704 10.181 -1.575
456 HZ1 LYS 64 HZ1 LYS 64 1.935 10.438 -4.260
457 HZ2 LYS 64 HZ2 LYS 64 2.567 9.637 -2.900
458 HZ3 LYS 64 HZ3 LYS 64 2.451 11.332 -2.914
459 H VAL 65 H VAL 65 1.394 3.931 -0.020
460 HA VAL 65 HA VAL 65 0.026 4.405 2.463
461 HB VAL 65 HB VAL 65 2.036 2.258 1.701
462 HG11 VAL 65 HG11 VAL 65 0.044 2.371 3.989
463 HG12 VAL 65 HG12 VAL 65 1.794 2.521 4.150
464 HG13 VAL 65 HG13 VAL 65 1.087 1.002 3.599
465 HG21 VAL 65 HG21 VAL 65 -0.131 2.421 0.352
466 HG22 VAL 65 HG22 VAL 65 -0.981 2.038 1.849
467 HG23 VAL 65 HG23 VAL 65 0.157 0.880 1.158
468 H VAL 66 H VAL 66 0.748 5.566 4.083
469 HA VAL 66 HA VAL 66 3.626 5.653 4.676
470 HB VAL 66 HB VAL 66 3.173 7.623 3.266
471 HG11 VAL 66 HG11 VAL 66 0.768 7.870 3.912
472 HG12 VAL 66 HG12 VAL 66 1.671 9.383 3.994
473 HG13 VAL 66 HG13 VAL 66 1.292 8.502 5.474
474 HG21 VAL 66 HG21 VAL 66 4.087 9.325 4.799
475 HG22 VAL 66 HG22 VAL 66 4.879 7.769 5.048
476 HG23 VAL 66 HG23 VAL 66 3.647 8.322 6.182
477 H ALA 67 H ALA 67 4.070 5.487 6.770
478 HA ALA 67 HA ALA 67 1.952 5.108 8.675
479 HB1 ALA 67 HB1 ALA 67 4.950 5.003 8.768
480 HB2 ALA 67 HB2 ALA 67 3.782 3.718 9.074
481 HB3 ALA 67 HB3 ALA 67 4.017 4.998 10.266
482 H VAL 68 H VAL 68 1.381 6.368 10.408
483 HA VAL 68 HA VAL 68 1.737 9.202 10.127
484 HB VAL 68 HB VAL 68 0.545 7.659 12.457
485 HG11 VAL 68 HG11 VAL 68 0.050 10.514 11.563
486 HG12 VAL 68 HG12 VAL 68 1.165 10.078 12.857
487 HG13 VAL 68 HG13 VAL 68 -0.557 9.734 13.024
488 HG21 VAL 68 HG21 VAL 68 -0.682 8.747 9.906
489 HG22 VAL 68 HG22 VAL 68 -1.635 8.290 11.318
490 HG23 VAL 68 HG23 VAL 68 -0.684 7.074 10.466
Start of MODEL 15
1 H1 MET 1 HT1 MET 1 -6.926 13.923 1.140
2 H2 MET 1 HT2 MET 1 -7.003 14.020 2.834
3 H3 MET 1 HT3 MET 1 -8.069 13.004 1.987
4 HA MET 1 HA MET 1 -5.916 11.880 1.138
5 HB2 MET 1 HB2 MET 1 -4.493 13.666 2.205
6 HB3 MET 1 HB3 MET 1 -5.013 13.069 3.779
7 HG2 MET 1 HG2 MET 1 -4.083 10.844 3.247
8 HG3 MET 1 HG3 MET 1 -3.564 11.438 1.671
9 HE1 MET 1 HE1 MET 1 -0.796 13.880 2.277
10 HE2 MET 1 HE2 MET 1 -2.491 14.351 2.159
11 HE3 MET 1 HE3 MET 1 -1.881 13.028 1.169
12 H SER 2 H SER 2 -7.155 10.084 1.360
13 HA SER 2 HA SER 2 -8.605 9.344 3.671
14 HB2 SER 2 HB2 SER 2 -9.184 8.438 1.495
15 HB3 SER 2 HB3 SER 2 -7.609 7.667 1.356
16 HG SER 2 HG SER 2 -8.733 6.069 2.208
17 H LYS 3 H LYS 3 -8.155 7.999 5.347
18 HA LYS 3 HA LYS 3 -5.705 6.480 5.530
19 HB2 LYS 3 HB2 LYS 3 -4.779 7.680 7.459
20 HB3 LYS 3 HB3 LYS 3 -4.865 8.734 6.050
21 HG2 LYS 3 HG2 LYS 3 -6.977 9.705 6.911
22 HG3 LYS 3 HG3 LYS 3 -6.857 8.669 8.337
23 HD2 LYS 3 HD2 LYS 3 -4.666 9.712 8.882
24 HD3 LYS 3 HD3 LYS 3 -4.857 10.790 7.499
25 HE2 LYS 3 HE2 LYS 3 -6.788 10.610 9.832
26 HE3 LYS 3 HE3 LYS 3 -5.565 11.865 9.629
27 HZ1 LYS 3 HZ1 LYS 3 -8.027 11.401 8.099
28 HZ2 LYS 3 HZ2 LYS 3 -6.700 12.121 7.316
29 HZ3 LYS 3 HZ3 LYS 3 -7.380 12.855 8.690
30 H GLY 4 H GLY 4 -5.736 4.988 7.223
31 HA2 GLY 4 HA2 GLY 4 -7.998 5.019 9.088
32 HA3 GLY 4 HA3 GLY 4 -7.907 3.673 7.957
33 H ILE 5 H ILE 5 -7.766 2.332 9.878
34 HA ILE 5 HA ILE 5 -5.027 2.289 11.018
35 HB ILE 5 HB ILE 5 -6.078 1.038 12.951
36 HG12 ILE 5 HG12 ILE 5 -8.693 2.212 11.963
37 HG13 ILE 5 HG13 ILE 5 -8.232 0.556 11.587
38 HG21 ILE 5 HG21 ILE 5 -5.447 3.380 13.162
39 HG22 ILE 5 HG22 ILE 5 -6.989 3.128 13.981
40 HG23 ILE 5 HG23 ILE 5 -6.950 3.889 12.392
41 HD11 ILE 5 HD11 ILE 5 -9.591 0.508 13.587
42 HD12 ILE 5 HD12 ILE 5 -8.611 1.768 14.339
43 HD13 ILE 5 HD13 ILE 5 -7.928 0.165 14.064
44 H VAL 6 H VAL 6 -3.839 0.568 10.641
45 HA VAL 6 HA VAL 6 -4.745 -1.427 8.844
46 HB VAL 6 HB VAL 6 -2.209 -1.341 10.498
47 HG11 VAL 6 HG11 VAL 6 -3.128 -3.098 8.218
48 HG12 VAL 6 HG12 VAL 6 -2.376 -3.574 9.740
49 HG13 VAL 6 HG13 VAL 6 -1.412 -2.798 8.488
50 HG21 VAL 6 HG21 VAL 6 -2.692 0.588 8.880
51 HG22 VAL 6 HG22 VAL 6 -2.581 -0.603 7.583
52 HG23 VAL 6 HG23 VAL 6 -1.184 -0.284 8.611
53 H LYS 7 H LYS 7 -5.803 -3.214 9.228
54 HA LYS 7 HA LYS 7 -6.558 -4.085 11.833
55 HB2 LYS 7 HB2 LYS 7 -7.921 -4.508 9.792
56 HB3 LYS 7 HB3 LYS 7 -6.671 -5.606 9.206
57 HG2 LYS 7 HG2 LYS 7 -6.992 -7.043 11.184
58 HG3 LYS 7 HG3 LYS 7 -8.226 -5.938 11.794
59 HD2 LYS 7 HD2 LYS 7 -9.596 -6.350 9.783
60 HD3 LYS 7 HD3 LYS 7 -8.364 -7.456 9.170
61 HE2 LYS 7 HE2 LYS 7 -8.671 -8.901 11.144
62 HE3 LYS 7 HE3 LYS 7 -9.893 -7.796 11.768
63 HZ1 LYS 7 HZ1 LYS 7 -11.123 -9.407 10.680
64 HZ2 LYS 7 HZ2 LYS 7 -10.018 -9.542 9.396
65 HZ3 LYS 7 HZ3 LYS 7 -11.021 -8.176 9.517
66 H TRP 8 H TRP 8 -4.231 -5.241 9.419
67 HA TRP 8 HA TRP 8 -2.460 -6.275 11.443
68 HB2 TRP 8 HB2 TRP 8 -4.304 -8.057 11.029
69 HB3 TRP 8 HB3 TRP 8 -3.516 -8.299 9.471
70 HD1 TRP 8 HD1 TRP 8 -1.146 -9.442 9.450
71 HE1 TRP 8 HE1 TRP 8 0.188 -10.736 11.237
72 HE3 TRP 8 HE3 TRP 8 -3.815 -8.188 13.619
73 HZ2 TRP 8 HZ2 TRP 8 0.127 -11.184 14.062
74 HZ3 TRP 8 HZ3 TRP 8 -3.159 -9.066 15.842
75 HH2 TRP 8 HH2 TRP 8 -1.194 -10.560 16.069
76 H PHE 9 H PHE 9 -0.452 -5.851 10.697
77 HA PHE 9 HA PHE 9 -0.067 -5.710 7.750
78 HB2 PHE 9 HB2 PHE 9 0.370 -3.611 9.153
79 HB3 PHE 9 HB3 PHE 9 1.757 -4.475 9.818
80 HD1 PHE 9 HD1 PHE 9 0.373 -2.795 6.885
81 HD2 PHE 9 HD2 PHE 9 3.618 -5.210 8.333
82 HE1 PHE 9 HE1 PHE 9 1.686 -2.244 4.856
83 HE2 PHE 9 HE2 PHE 9 4.930 -4.650 6.305
84 HZ PHE 9 HZ PHE 9 3.968 -3.170 4.568
85 H ASN 10 H ASN 10 1.151 -7.272 6.838
86 HA ASN 10 HA ASN 10 3.135 -8.672 8.539
87 HB2 ASN 10 HB2 ASN 10 1.176 -9.855 6.569
88 HB3 ASN 10 HB3 ASN 10 2.590 -10.727 7.154
89 HD21 ASN 10 HD21 ASN 10 -0.159 -11.542 7.678
90 HD22 ASN 10 HD22 ASN 10 -0.400 -11.451 9.355
91 H SER 11 H SER 11 4.958 -7.657 7.774
92 HA SER 11 HA SER 11 5.490 -7.000 5.095
93 HB2 SER 11 HB2 SER 11 7.382 -7.564 7.386
94 HB3 SER 11 HB3 SER 11 7.856 -6.860 5.843
95 HG SER 11 HG SER 11 6.152 -5.814 7.840
96 H ASP 12 H ASP 12 6.161 -9.927 6.983
97 HA ASP 12 HA ASP 12 7.894 -11.246 5.225
98 HB2 ASP 12 HB2 ASP 12 7.327 -12.051 7.504
99 HB3 ASP 12 HB3 ASP 12 5.719 -12.495 6.930
100 H LYS 13 H LYS 13 4.353 -11.233 5.356
101 HA LYS 13 HA LYS 13 4.016 -12.845 2.998
102 HB2 LYS 13 HB2 LYS 13 2.122 -11.071 4.562
103 HB3 LYS 13 HB3 LYS 13 1.630 -12.065 3.189
104 HG2 LYS 13 HG2 LYS 13 2.319 -14.093 4.325
105 HG3 LYS 13 HG3 LYS 13 3.026 -13.164 5.647
106 HD2 LYS 13 HD2 LYS 13 0.901 -13.940 6.438
107 HD3 LYS 13 HD3 LYS 13 0.697 -12.225 6.075
108 HE2 LYS 13 HE2 LYS 13 -0.323 -12.772 3.922
109 HE3 LYS 13 HE3 LYS 13 -0.051 -14.490 4.198
110 HZ1 LYS 13 HZ1 LYS 13 -1.723 -12.725 5.902
111 HZ2 LYS 13 HZ2 LYS 13 -1.492 -14.393 6.116
112 HZ3 LYS 13 HZ3 LYS 13 -2.318 -13.816 4.748
113 H GLY 14 H GLY 14 4.600 -9.510 3.678
114 HA2 GLY 14 HA2 GLY 14 5.283 -7.850 2.184
115 HA3 GLY 14 HA3 GLY 14 4.760 -8.864 0.848
116 H PHE 15 H PHE 15 2.305 -8.677 3.176
117 HA PHE 15 HA PHE 15 1.161 -6.170 2.331
118 HB2 PHE 15 HB2 PHE 15 -0.849 -7.133 1.271
119 HB3 PHE 15 HB3 PHE 15 0.620 -7.483 0.361
120 HD1 PHE 15 HD1 PHE 15 -2.035 -8.895 2.489
121 HD2 PHE 15 HD2 PHE 15 1.538 -9.744 0.263
122 HE1 PHE 15 HE1 PHE 15 -2.534 -11.321 2.612
123 HE2 PHE 15 HE2 PHE 15 1.040 -12.170 0.387
124 HZ PHE 15 HZ PHE 15 -0.996 -12.959 1.561
125 H GLY 16 H GLY 16 -1.226 -6.079 3.091
126 HA2 GLY 16 HA2 GLY 16 -1.897 -7.678 5.394
127 HA3 GLY 16 HA3 GLY 16 -1.374 -6.047 5.807
128 H PHE 17 H PHE 17 -3.810 -6.494 6.581
129 HA PHE 17 HA PHE 17 -5.606 -5.375 4.504
130 HB2 PHE 17 HB2 PHE 17 -6.269 -7.082 6.921
131 HB3 PHE 17 HB3 PHE 17 -7.460 -6.354 5.846
132 HD1 PHE 17 HD1 PHE 17 -4.886 -8.954 6.198
133 HD2 PHE 17 HD2 PHE 17 -7.736 -7.147 3.539
134 HE1 PHE 17 HE1 PHE 17 -4.670 -10.883 4.657
135 HE2 PHE 17 HE2 PHE 17 -7.521 -9.078 1.998
136 HZ PHE 17 HZ PHE 17 -5.988 -10.946 2.556
137 H ILE 18 H ILE 18 -6.582 -3.439 4.944
138 HA ILE 18 HA ILE 18 -6.072 -2.300 7.614
139 HB ILE 18 HB ILE 18 -4.825 -1.161 5.844
140 HG12 ILE 18 HG12 ILE 18 -7.079 0.670 6.693
141 HG13 ILE 18 HG13 ILE 18 -5.901 0.059 7.857
142 HG21 ILE 18 HG21 ILE 18 -6.104 -1.483 3.882
143 HG22 ILE 18 HG22 ILE 18 -6.270 0.239 4.215
144 HG23 ILE 18 HG23 ILE 18 -7.575 -0.870 4.634
145 HD11 ILE 18 HD11 ILE 18 -5.378 2.331 6.777
146 HD12 ILE 18 HD12 ILE 18 -5.049 1.424 5.300
147 HD13 ILE 18 HD13 ILE 18 -4.096 1.121 6.751
148 H THR 19 H THR 19 -7.611 -1.202 8.692
149 HA THR 19 HA THR 19 -10.364 -1.741 7.862
150 HB THR 19 HB THR 19 -9.273 -0.871 10.542
151 HG1 THR 19 HG1 THR 19 -9.694 -3.098 11.037
152 HG21 THR 19 HG21 THR 19 -11.514 -1.785 11.315
153 HG22 THR 19 HG22 THR 19 -11.995 -1.828 9.620
154 HG23 THR 19 HG23 THR 19 -11.602 -0.289 10.386
155 HA PRO 20 HA PRO 20 -10.337 2.719 6.667
156 HB2 PRO 20 HB2 PRO 20 -13.224 2.020 6.267
157 HB3 PRO 20 HB3 PRO 20 -12.131 2.921 5.198
158 HG2 PRO 20 HG2 PRO 20 -12.762 0.446 4.619
159 HG3 PRO 20 HG3 PRO 20 -11.084 0.995 4.440
160 HD2 PRO 20 HD2 PRO 20 -12.285 -0.688 6.618
161 HD3 PRO 20 HD3 PRO 20 -10.701 -0.839 5.820
162 H GLU 21 H GLU 21 -10.610 4.386 8.064
163 HA GLU 21 HA GLU 21 -11.780 4.050 10.620
164 HB2 GLU 21 HB2 GLU 21 -11.366 6.454 10.914
165 HB3 GLU 21 HB3 GLU 21 -9.966 5.655 10.201
166 HG2 GLU 21 HG2 GLU 21 -10.709 6.402 7.948
167 HG3 GLU 21 HG3 GLU 21 -12.070 7.236 8.684
168 H ASP 22 H ASP 22 -13.040 5.237 7.583
169 HA ASP 22 HA ASP 22 -15.370 6.528 8.585
170 HB2 ASP 22 HB2 ASP 22 -14.373 6.845 6.298
171 HB3 ASP 22 HB3 ASP 22 -15.014 5.260 5.866
172 H GLY 23 H GLY 23 -14.547 3.200 8.130
173 HA2 GLY 23 HA2 GLY 23 -15.873 1.486 9.204
174 HA3 GLY 23 HA3 GLY 23 -17.314 2.415 8.810
175 H SER 24 H SER 24 -15.130 2.420 6.222
176 HA SER 24 HA SER 24 -16.846 0.839 4.564
177 HB2 SER 24 HB2 SER 24 -14.116 2.038 4.056
178 HB3 SER 24 HB3 SER 24 -15.116 1.270 2.830
179 HG SER 24 HG SER 24 -15.334 3.738 4.019
180 H LYS 25 H LYS 25 -15.884 -0.902 3.156
181 HA LYS 25 HA LYS 25 -15.044 -3.080 4.755
182 HB2 LYS 25 HB2 LYS 25 -15.102 -2.718 1.751
183 HB3 LYS 25 HB3 LYS 25 -14.762 -4.251 2.556
184 HG2 LYS 25 HG2 LYS 25 -16.951 -4.143 3.692
185 HG3 LYS 25 HG3 LYS 25 -17.294 -2.613 2.882
186 HD2 LYS 25 HD2 LYS 25 -17.125 -3.731 0.689
187 HD3 LYS 25 HD3 LYS 25 -16.784 -5.262 1.495
188 HE2 LYS 25 HE2 LYS 25 -18.973 -5.162 2.624
189 HE3 LYS 25 HE3 LYS 25 -19.317 -3.627 1.827
190 HZ1 LYS 25 HZ1 LYS 25 -20.346 -5.327 0.567
191 HZ2 LYS 25 HZ2 LYS 25 -18.938 -6.277 0.551
192 HZ3 LYS 25 HZ3 LYS 25 -18.994 -4.820 -0.321
193 H ASP 26 H ASP 26 -13.073 -4.244 4.744
194 HA ASP 26 HA ASP 26 -10.758 -2.739 4.977
195 HB2 ASP 26 HB2 ASP 26 -11.168 -5.693 4.526
196 HB3 ASP 26 HB3 ASP 26 -9.587 -4.986 4.842
197 H LEU 27 H LEU 27 -9.008 -2.343 3.721
198 HA LEU 27 HA LEU 27 -9.290 -2.890 0.824
199 HB2 LEU 27 HB2 LEU 27 -7.857 -0.602 2.208
200 HB3 LEU 27 HB3 LEU 27 -7.958 -0.846 0.468
201 HG LEU 27 HG LEU 27 -10.384 -0.489 2.259
202 HD11 LEU 27 HD11 LEU 27 -8.933 1.513 0.501
203 HD12 LEU 27 HD12 LEU 27 -9.018 1.551 2.262
204 HD13 LEU 27 HD13 LEU 27 -10.477 1.801 1.303
205 HD21 LEU 27 HD21 LEU 27 -9.974 -0.490 -0.750
206 HD22 LEU 27 HD22 LEU 27 -11.463 0.038 0.033
207 HD23 LEU 27 HD23 LEU 27 -10.930 -1.635 0.190
208 H PHE 28 H PHE 28 -7.444 -3.508 -0.344
209 HA PHE 28 HA PHE 28 -5.504 -5.033 1.155
210 HB2 PHE 28 HB2 PHE 28 -5.857 -4.478 -1.798
211 HB3 PHE 28 HB3 PHE 28 -4.575 -5.503 -1.146
212 HD1 PHE 28 HD1 PHE 28 -8.200 -5.168 -1.695
213 HD2 PHE 28 HD2 PHE 28 -5.082 -7.658 -0.109
214 HE1 PHE 28 HE1 PHE 28 -9.780 -7.076 -1.584
215 HE2 PHE 28 HE2 PHE 28 -6.662 -9.566 0.004
216 HZ PHE 28 HZ PHE 28 -9.011 -9.275 -0.733
217 H VAL 29 H VAL 29 -3.490 -4.453 1.723
218 HA VAL 29 HA VAL 29 -2.311 -2.013 0.537
219 HB VAL 29 HB VAL 29 -2.310 -2.816 3.458
220 HG11 VAL 29 HG11 VAL 29 -0.189 -1.728 2.693
221 HG12 VAL 29 HG12 VAL 29 -1.073 -0.761 3.874
222 HG13 VAL 29 HG13 VAL 29 -1.141 -0.343 2.162
223 HG21 VAL 29 HG21 VAL 29 -3.812 -1.071 3.880
224 HG22 VAL 29 HG22 VAL 29 -4.423 -1.721 2.361
225 HG23 VAL 29 HG23 VAL 29 -3.448 -0.252 2.364
226 H HIS 30 H HIS 30 -0.232 -2.280 -0.142
227 HA HIS 30 HA HIS 30 1.128 -4.811 0.567
228 HB2 HIS 30 HB2 HIS 30 1.428 -3.061 -1.885
229 HB3 HIS 30 HB3 HIS 30 2.386 -4.504 -1.553
230 HD2 HIS 30 HD2 HIS 30 -0.934 -3.610 -3.217
231 HE1 HIS 30 HE1 HIS 30 -1.141 -7.744 -2.380
232 HE2 HIS 30 HE2 HIS 30 -2.241 -5.832 -3.638
233 H HIS 31 H HIS 31 3.253 -4.816 1.184
234 HA HIS 31 HA HIS 31 4.241 -2.599 2.642
235 HB2 HIS 31 HB2 HIS 31 4.853 -4.987 3.089
236 HB3 HIS 31 HB3 HIS 31 5.815 -4.978 1.611
237 HD2 HIS 31 HD2 HIS 31 6.048 -3.678 5.288
238 HE1 HIS 31 HE1 HIS 31 9.575 -2.501 3.294
239 HE2 HIS 31 HE2 HIS 31 8.428 -2.640 5.553
240 H SER 32 H SER 32 5.176 -3.953 -0.501
241 HA SER 32 HA SER 32 7.259 -2.149 -1.091
242 HB2 SER 32 HB2 SER 32 5.472 -3.766 -2.911
243 HB3 SER 32 HB3 SER 32 6.892 -2.879 -3.458
244 HG SER 32 HG SER 32 8.136 -4.341 -2.573
245 H GLU 33 H GLU 33 3.849 -1.667 -1.151
246 HA GLU 33 HA GLU 33 3.693 0.312 -3.189
247 HB2 GLU 33 HB2 GLU 33 1.774 -1.018 -2.211
248 HB3 GLU 33 HB3 GLU 33 1.854 0.047 -0.809
249 HG2 GLU 33 HG2 GLU 33 0.186 0.919 -2.338
250 HG3 GLU 33 HG3 GLU 33 1.571 2.005 -2.346
251 H ILE 34 H ILE 34 4.638 0.461 0.182
252 HA ILE 34 HA ILE 34 4.125 3.106 0.832
253 HB ILE 34 HB ILE 34 6.032 2.966 2.389
254 HG12 ILE 34 HG12 ILE 34 7.122 0.491 2.308
255 HG13 ILE 34 HG13 ILE 34 6.769 0.660 0.590
256 HG21 ILE 34 HG21 ILE 34 5.283 0.801 3.518
257 HG22 ILE 34 HG22 ILE 34 4.228 0.556 2.126
258 HG23 ILE 34 HG23 ILE 34 4.013 1.970 3.158
259 HD11 ILE 34 HD11 ILE 34 9.081 1.459 1.451
260 HD12 ILE 34 HD12 ILE 34 8.201 2.845 2.090
261 HD13 ILE 34 HD13 ILE 34 8.197 2.521 0.358
262 H GLN 35 H GLN 35 5.417 5.018 0.798
263 HA GLN 35 HA GLN 35 7.270 5.158 -1.509
264 HB2 GLN 35 HB2 GLN 35 5.413 7.291 -0.423
265 HB3 GLN 35 HB3 GLN 35 6.551 7.516 -1.750
266 HG2 GLN 35 HG2 GLN 35 4.292 5.489 -1.725
267 HG3 GLN 35 HG3 GLN 35 4.243 7.040 -2.557
268 HE21 GLN 35 HE21 GLN 35 4.744 3.828 -3.167
269 HE22 GLN 35 HE22 GLN 35 5.788 3.949 -4.499
270 H SER 36 H SER 36 7.886 4.623 1.384
271 HA SER 36 HA SER 36 9.017 6.877 2.631
272 HB2 SER 36 HB2 SER 36 9.791 3.959 2.829
273 HB3 SER 36 HB3 SER 36 10.378 5.225 3.902
274 HG SER 36 HG SER 36 7.673 4.471 3.474
275 H GLY 37 H GLY 37 10.354 4.588 0.282
276 HA2 GLY 37 HA2 GLY 37 12.172 4.759 -1.128
277 HA3 GLY 37 HA3 GLY 37 12.280 6.460 -0.682
278 H GLY 38 H GLY 38 14.149 6.993 0.235
279 HA2 GLY 38 HA2 GLY 38 16.123 5.175 1.058
280 HA3 GLY 38 HA3 GLY 38 16.102 6.892 1.451
281 H GLU 39 H GLU 39 13.689 6.960 2.921
282 HA GLU 39 HA GLU 39 14.614 6.081 5.490
283 HB2 GLU 39 HB2 GLU 39 11.928 7.190 4.629
284 HB3 GLU 39 HB3 GLU 39 12.434 6.949 6.301
285 HG2 GLU 39 HG2 GLU 39 14.338 8.488 5.940
286 HG3 GLU 39 HG3 GLU 39 13.809 8.744 4.279
287 H TYR 40 H TYR 40 13.681 4.502 6.855
288 HA TYR 40 HA TYR 40 12.319 2.329 5.388
289 HB2 TYR 40 HB2 TYR 40 13.861 2.282 7.992
290 HB3 TYR 40 HB3 TYR 40 13.076 0.886 7.258
291 HD1 TYR 40 HD1 TYR 40 15.899 3.224 7.042
292 HD2 TYR 40 HD2 TYR 40 13.904 -0.075 5.148
293 HE1 TYR 40 HE1 TYR 40 17.889 2.841 5.613
294 HE2 TYR 40 HE2 TYR 40 15.893 -0.459 3.719
295 HH TYR 40 HH TYR 40 18.895 0.879 4.351
296 H ALA 41 H ALA 41 10.197 2.305 5.624
297 HA ALA 41 HA ALA 41 8.974 3.317 8.094
298 HB1 ALA 41 HB1 ALA 41 7.849 4.265 6.293
299 HB2 ALA 41 HB2 ALA 41 6.840 2.863 6.644
300 HB3 ALA 41 HB3 ALA 41 7.990 2.810 5.307
301 H THR 42 H THR 42 7.965 2.035 9.526
302 HA THR 42 HA THR 42 7.788 -0.859 8.907
303 HB THR 42 HB THR 42 7.985 -1.232 11.346
304 HG1 THR 42 HG1 THR 42 8.299 0.453 12.691
305 HG21 THR 42 HG21 THR 42 10.012 -1.249 9.935
306 HG22 THR 42 HG22 THR 42 10.363 -0.631 11.549
307 HG23 THR 42 HG23 THR 42 10.203 0.485 10.194
308 H LEU 43 H LEU 43 5.937 -1.976 9.536
309 HA LEU 43 HA LEU 43 3.684 -0.450 10.638
310 HB2 LEU 43 HB2 LEU 43 3.554 -2.031 8.061
311 HB3 LEU 43 HB3 LEU 43 2.172 -1.327 8.883
312 HG LEU 43 HG LEU 43 4.542 0.288 7.888
313 HD11 LEU 43 HD11 LEU 43 3.494 -0.660 5.946
314 HD12 LEU 43 HD12 LEU 43 2.891 0.992 6.085
315 HD13 LEU 43 HD13 LEU 43 1.881 -0.361 6.594
316 HD21 LEU 43 HD21 LEU 43 2.689 2.116 8.032
317 HD22 LEU 43 HD22 LEU 43 3.405 1.558 9.539
318 HD23 LEU 43 HD23 LEU 43 1.825 0.957 9.044
319 H ALA 44 H ALA 44 2.091 -1.786 11.632
320 HA ALA 44 HA ALA 44 2.609 -4.670 11.779
321 HB1 ALA 44 HB1 ALA 44 3.872 -3.264 13.610
322 HB2 ALA 44 HB2 ALA 44 3.035 -4.747 14.067
323 HB3 ALA 44 HB3 ALA 44 2.280 -3.181 14.364
324 H ASP 45 H ASP 45 0.817 -5.077 14.050
325 HA ASP 45 HA ASP 45 -1.702 -4.782 12.650
326 HB2 ASP 45 HB2 ASP 45 -2.591 -6.193 14.472
327 HB3 ASP 45 HB3 ASP 45 -1.185 -6.918 13.704
328 H GLY 46 H GLY 46 -2.821 -2.972 12.842
329 HA2 GLY 46 HA2 GLY 46 -4.253 -1.553 14.133
330 HA3 GLY 46 HA3 GLY 46 -3.179 -1.765 15.508
331 H GLN 47 H GLN 47 -1.158 -1.296 12.953
332 HA GLN 47 HA GLN 47 -0.344 1.294 13.742
333 HB2 GLN 47 HB2 GLN 47 1.090 -0.469 12.692
334 HB3 GLN 47 HB3 GLN 47 0.271 -0.165 11.164
335 HG2 GLN 47 HG2 GLN 47 2.385 1.071 11.270
336 HG3 GLN 47 HG3 GLN 47 1.027 2.182 11.224
337 HE21 GLN 47 HE21 GLN 47 1.510 3.920 12.581
338 HE22 GLN 47 HE22 GLN 47 2.223 3.784 14.117
339 H THR 48 H THR 48 -0.947 3.258 13.094
340 HA THR 48 HA THR 48 -3.152 3.547 11.221
341 HB THR 48 HB THR 48 -1.627 5.653 12.788
342 HG1 THR 48 HG1 THR 48 -3.513 5.487 14.135
343 HG21 THR 48 HG21 THR 48 -2.995 6.380 10.750
344 HG22 THR 48 HG22 THR 48 -3.440 7.127 12.284
345 HG23 THR 48 HG23 THR 48 -4.416 5.814 11.626
346 H VAL 49 H VAL 49 -2.984 4.150 9.148
347 HA VAL 49 HA VAL 49 -0.509 5.444 8.217
348 HB VAL 49 HB VAL 49 -0.389 3.939 6.253
349 HG11 VAL 49 HG11 VAL 49 0.449 1.941 7.510
350 HG12 VAL 49 HG12 VAL 49 -0.266 2.614 8.976
351 HG13 VAL 49 HG13 VAL 49 1.042 3.470 8.159
352 HG21 VAL 49 HG21 VAL 49 -2.672 3.147 6.113
353 HG22 VAL 49 HG22 VAL 49 -2.581 2.458 7.734
354 HG23 VAL 49 HG23 VAL 49 -1.636 1.752 6.423
355 H GLU 50 H GLU 50 -0.704 6.238 5.966
356 HA GLU 50 HA GLU 50 -3.464 7.162 5.400
357 HB2 GLU 50 HB2 GLU 50 -0.857 8.593 4.793
358 HB3 GLU 50 HB3 GLU 50 -2.472 9.184 4.421
359 HG2 GLU 50 HG2 GLU 50 -3.010 9.184 6.847
360 HG3 GLU 50 HG3 GLU 50 -1.368 8.652 7.195
361 H TYR 51 H TYR 51 -4.187 6.923 3.315
362 HA TYR 51 HA TYR 51 -2.383 6.157 1.173
363 HB2 TYR 51 HB2 TYR 51 -3.482 3.997 0.736
364 HB3 TYR 51 HB3 TYR 51 -2.701 4.007 2.311
365 HD1 TYR 51 HD1 TYR 51 -5.920 4.021 0.528
366 HD2 TYR 51 HD2 TYR 51 -4.027 4.055 4.382
367 HE1 TYR 51 HE1 TYR 51 -8.088 3.470 1.595
368 HE2 TYR 51 HE2 TYR 51 -6.197 3.503 5.450
369 HH TYR 51 HH TYR 51 -9.180 3.622 3.722
370 H GLU 52 H GLU 52 -3.566 5.713 -0.861
371 HA GLU 52 HA GLU 52 -6.107 7.224 -1.018
372 HB2 GLU 52 HB2 GLU 52 -3.740 7.197 -2.901
373 HB3 GLU 52 HB3 GLU 52 -5.341 7.737 -3.409
374 HG2 GLU 52 HG2 GLU 52 -4.130 9.696 -2.708
375 HG3 GLU 52 HG3 GLU 52 -5.322 9.346 -1.459
376 H VAL 53 H VAL 53 -7.763 6.183 -1.953
377 HA VAL 53 HA VAL 53 -7.689 3.414 -2.403
378 HB VAL 53 HB VAL 53 -9.735 4.678 -1.824
379 HG11 VAL 53 HG11 VAL 53 -10.918 5.992 -3.494
380 HG12 VAL 53 HG12 VAL 53 -9.678 5.640 -4.698
381 HG13 VAL 53 HG13 VAL 53 -9.290 6.641 -3.300
382 HG21 VAL 53 HG21 VAL 53 -10.082 3.290 -4.494
383 HG22 VAL 53 HG22 VAL 53 -11.256 3.403 -3.182
384 HG23 VAL 53 HG23 VAL 53 -9.802 2.424 -2.984
385 H GLY 54 H GLY 54 -7.831 2.182 -4.279
386 HA2 GLY 54 HA2 GLY 54 -7.100 3.476 -6.828
387 HA3 GLY 54 HA3 GLY 54 -6.159 2.107 -6.236
388 H GLN 55 H GLN 55 -7.676 2.207 -8.704
389 HA GLN 55 HA GLN 55 -10.050 0.580 -8.240
390 HB2 GLN 55 HB2 GLN 55 -9.980 2.402 -9.967
391 HB3 GLN 55 HB3 GLN 55 -8.815 1.433 -10.870
392 HG2 GLN 55 HG2 GLN 55 -11.056 1.048 -11.765
393 HG3 GLN 55 HG3 GLN 55 -10.479 -0.418 -10.979
394 HE21 GLN 55 HE21 GLN 55 -12.172 -1.374 -9.850
395 HE22 GLN 55 HE22 GLN 55 -13.345 -0.532 -8.955
396 H GLY 56 H GLY 56 -10.113 -1.563 -8.321
397 HA2 GLY 56 HA2 GLY 56 -7.997 -3.042 -9.757
398 HA3 GLY 56 HA3 GLY 56 -8.392 -3.469 -8.094
399 H GLN 57 H GLN 57 -8.651 -5.019 -10.629
400 HA GLN 57 HA GLN 57 -11.357 -5.241 -11.409
401 HB2 GLN 57 HB2 GLN 57 -9.050 -7.188 -11.538
402 HB3 GLN 57 HB3 GLN 57 -10.633 -7.513 -12.248
403 HG2 GLN 57 HG2 GLN 57 -10.456 -5.582 -13.691
404 HG3 GLN 57 HG3 GLN 57 -8.986 -5.052 -12.877
405 HE21 GLN 57 HE21 GLN 57 -9.396 -5.810 -15.774
406 HE22 GLN 57 HE22 GLN 57 -8.268 -7.045 -16.071
407 H LYS 58 H LYS 58 -9.462 -6.978 -8.953
408 HA LYS 58 HA LYS 58 -11.736 -8.616 -8.175
409 HB2 LYS 58 HB2 LYS 58 -9.393 -9.477 -8.131
410 HB3 LYS 58 HB3 LYS 58 -9.033 -8.331 -6.842
411 HG2 LYS 58 HG2 LYS 58 -10.748 -9.366 -5.415
412 HG3 LYS 58 HG3 LYS 58 -11.158 -10.495 -6.708
413 HD2 LYS 58 HD2 LYS 58 -8.858 -11.397 -6.650
414 HD3 LYS 58 HD3 LYS 58 -8.453 -10.274 -5.351
415 HE2 LYS 58 HE2 LYS 58 -10.180 -11.294 -3.920
416 HE3 LYS 58 HE3 LYS 58 -10.602 -12.411 -5.217
417 HZ1 LYS 58 HZ1 LYS 58 -8.050 -12.246 -3.723
418 HZ2 LYS 58 HZ2 LYS 58 -8.215 -13.128 -5.165
419 HZ3 LYS 58 HZ3 LYS 58 -9.130 -13.552 -3.798
420 H GLY 59 H GLY 59 -10.280 -5.613 -7.225
421 HA2 GLY 59 HA2 GLY 59 -12.352 -4.595 -5.748
422 HA3 GLY 59 HA3 GLY 59 -11.381 -5.480 -4.572
423 HA PRO 60 HA PRO 60 -9.466 -1.232 -5.616
424 HB2 PRO 60 HB2 PRO 60 -10.122 0.238 -3.434
425 HB3 PRO 60 HB3 PRO 60 -11.175 0.128 -4.859
426 HG2 PRO 60 HG2 PRO 60 -11.343 -1.347 -2.270
427 HG3 PRO 60 HG3 PRO 60 -12.628 -0.572 -3.210
428 HD2 PRO 60 HD2 PRO 60 -12.172 -3.262 -3.299
429 HD3 PRO 60 HD3 PRO 60 -12.806 -2.354 -4.692
430 H CYS 61 H CYS 61 -7.540 -0.442 -4.756
431 HA CYS 61 HA CYS 61 -6.447 -1.891 -2.416
432 HB2 CYS 61 HB2 CYS 61 -4.987 -1.032 -4.928
433 HB3 CYS 61 HB3 CYS 61 -4.250 -1.810 -3.530
434 HG CYS 61 HG CYS 61 -6.146 -3.789 -4.118
435 H ALA 62 H ALA 62 -4.299 -0.625 -1.716
436 HA ALA 62 HA ALA 62 -5.033 2.241 -1.522
437 HB1 ALA 62 HB1 ALA 62 -4.083 0.257 0.481
438 HB2 ALA 62 HB2 ALA 62 -5.223 1.585 0.674
439 HB3 ALA 62 HB3 ALA 62 -3.488 1.908 0.641
440 H ASN 63 H ASN 63 -3.530 3.694 -2.184
441 HA ASN 63 HA ASN 63 -0.833 2.680 -2.867
442 HB2 ASN 63 HB2 ASN 63 -2.418 4.937 -4.117
443 HB3 ASN 63 HB3 ASN 63 -0.782 4.464 -4.572
444 HD21 ASN 63 HD21 ASN 63 -3.594 4.279 -5.968
445 HD22 ASN 63 HD22 ASN 63 -3.615 2.685 -6.552
446 H LYS 64 H LYS 64 0.942 4.165 -2.621
447 HA LYS 64 HA LYS 64 2.236 5.602 -1.389
448 HB2 LYS 64 HB2 LYS 64 0.742 7.251 -2.572
449 HB3 LYS 64 HB3 LYS 64 -0.261 7.274 -1.121
450 HG2 LYS 64 HG2 LYS 64 1.661 8.005 0.220
451 HG3 LYS 64 HG3 LYS 64 2.692 7.953 -1.208
452 HD2 LYS 64 HD2 LYS 64 1.279 9.663 -2.293
453 HD3 LYS 64 HD3 LYS 64 0.255 9.724 -0.858
454 HE2 LYS 64 HE2 LYS 64 2.188 10.439 0.498
455 HE3 LYS 64 HE3 LYS 64 3.216 10.373 -0.931
456 HZ1 LYS 64 HZ1 LYS 64 2.624 12.567 -0.906
457 HZ2 LYS 64 HZ2 LYS 64 1.079 12.270 -0.265
458 HZ3 LYS 64 HZ3 LYS 64 1.402 11.938 -1.901
459 H VAL 65 H VAL 65 1.965 3.693 0.088
460 HA VAL 65 HA VAL 65 0.377 4.125 2.480
461 HB VAL 65 HB VAL 65 2.389 1.958 1.796
462 HG11 VAL 65 HG11 VAL 65 2.088 2.188 4.230
463 HG12 VAL 65 HG12 VAL 65 1.318 0.710 3.653
464 HG13 VAL 65 HG13 VAL 65 0.337 2.127 4.027
465 HG21 VAL 65 HG21 VAL 65 0.288 2.135 0.367
466 HG22 VAL 65 HG22 VAL 65 -0.634 1.799 1.833
467 HG23 VAL 65 HG23 VAL 65 0.500 0.600 1.210
468 H VAL 66 H VAL 66 1.013 5.374 4.041
469 HA VAL 66 HA VAL 66 3.881 5.470 4.773
470 HB VAL 66 HB VAL 66 3.702 7.889 5.250
471 HG11 VAL 66 HG11 VAL 66 2.917 7.206 2.403
472 HG12 VAL 66 HG12 VAL 66 4.545 7.019 3.059
473 HG13 VAL 66 HG13 VAL 66 3.821 8.623 2.937
474 HG21 VAL 66 HG21 VAL 66 1.760 9.118 4.221
475 HG22 VAL 66 HG22 VAL 66 1.316 8.124 5.610
476 HG23 VAL 66 HG23 VAL 66 0.971 7.558 3.975
477 H ALA 67 H ALA 67 4.314 6.063 6.968
478 HA ALA 67 HA ALA 67 2.236 5.084 8.788
479 HB1 ALA 67 HB1 ALA 67 5.190 5.607 9.180
480 HB2 ALA 67 HB2 ALA 67 4.405 4.037 9.010
481 HB3 ALA 67 HB3 ALA 67 4.109 5.021 10.443
482 H VAL 68 H VAL 68 1.274 6.280 10.322
483 HA VAL 68 HA VAL 68 1.648 9.175 10.233
484 HB VAL 68 HB VAL 68 -0.351 7.540 11.834
485 HG11 VAL 68 HG11 VAL 68 -0.059 9.781 12.743
486 HG12 VAL 68 HG12 VAL 68 -1.595 9.716 11.877
487 HG13 VAL 68 HG13 VAL 68 -0.196 10.488 11.132
488 HG21 VAL 68 HG21 VAL 68 -1.956 8.145 10.058
489 HG22 VAL 68 HG22 VAL 68 -0.620 7.208 9.391
490 HG23 VAL 68 HG23 VAL 68 -0.670 8.956 9.164
Start of MODEL 16
1 H1 MET 1 HT1 MET 1 -5.561 13.527 1.697
2 H2 MET 1 HT2 MET 1 -7.114 13.063 1.187
3 H3 MET 1 HT3 MET 1 -5.854 13.216 0.056
4 HA MET 1 HA MET 1 -6.061 10.926 0.383
5 HB2 MET 1 HB2 MET 1 -3.864 12.086 2.117
6 HB3 MET 1 HB3 MET 1 -3.967 10.375 1.698
7 HG2 MET 1 HG2 MET 1 -3.819 10.896 -0.674
8 HG3 MET 1 HG3 MET 1 -3.875 12.626 -0.332
9 HE1 MET 1 HE1 MET 1 -2.041 9.350 -0.237
10 HE2 MET 1 HE2 MET 1 -1.967 9.648 1.498
11 HE3 MET 1 HE3 MET 1 -0.485 9.665 0.545
12 H SER 2 H SER 2 -7.151 9.421 1.475
13 HA SER 2 HA SER 2 -8.412 10.002 3.974
14 HB2 SER 2 HB2 SER 2 -9.396 7.810 3.771
15 HB3 SER 2 HB3 SER 2 -9.384 8.550 2.173
16 HG SER 2 HG SER 2 -8.404 6.747 1.667
17 H LYS 3 H LYS 3 -8.261 8.593 5.885
18 HA LYS 3 HA LYS 3 -5.636 7.332 6.282
19 HB2 LYS 3 HB2 LYS 3 -5.474 9.673 7.092
20 HB3 LYS 3 HB3 LYS 3 -6.820 9.370 8.187
21 HG2 LYS 3 HG2 LYS 3 -5.529 7.690 9.383
22 HG3 LYS 3 HG3 LYS 3 -4.221 7.806 8.205
23 HD2 LYS 3 HD2 LYS 3 -3.512 9.121 10.062
24 HD3 LYS 3 HD3 LYS 3 -4.050 10.277 8.846
25 HE2 LYS 3 HE2 LYS 3 -4.976 10.946 10.982
26 HE3 LYS 3 HE3 LYS 3 -6.292 10.329 9.986
27 HZ1 LYS 3 HZ1 LYS 3 -6.086 9.512 12.394
28 HZ2 LYS 3 HZ2 LYS 3 -4.821 8.540 11.810
29 HZ3 LYS 3 HZ3 LYS 3 -6.389 8.368 11.179
30 H GLY 4 H GLY 4 -5.884 5.390 7.110
31 HA2 GLY 4 HA2 GLY 4 -8.197 4.835 8.877
32 HA3 GLY 4 HA3 GLY 4 -7.741 3.731 7.582
33 H ILE 5 H ILE 5 -7.739 2.352 9.685
34 HA ILE 5 HA ILE 5 -5.005 2.432 10.830
35 HB ILE 5 HB ILE 5 -6.011 1.170 12.780
36 HG12 ILE 5 HG12 ILE 5 -8.665 2.225 11.763
37 HG13 ILE 5 HG13 ILE 5 -8.137 0.583 11.411
38 HG21 ILE 5 HG21 ILE 5 -6.864 3.201 13.833
39 HG22 ILE 5 HG22 ILE 5 -7.127 3.941 12.254
40 HG23 ILE 5 HG23 ILE 5 -5.488 3.604 12.808
41 HD11 ILE 5 HD11 ILE 5 -7.796 0.289 13.923
42 HD12 ILE 5 HD12 ILE 5 -9.473 0.449 13.399
43 HD13 ILE 5 HD13 ILE 5 -8.640 1.823 14.126
44 H VAL 6 H VAL 6 -3.745 0.770 10.522
45 HA VAL 6 HA VAL 6 -4.479 -1.314 8.752
46 HB VAL 6 HB VAL 6 -2.040 -1.079 10.542
47 HG11 VAL 6 HG11 VAL 6 -2.147 -3.351 9.832
48 HG12 VAL 6 HG12 VAL 6 -1.053 -2.573 8.688
49 HG13 VAL 6 HG13 VAL 6 -2.722 -2.904 8.226
50 HG21 VAL 6 HG21 VAL 6 -0.945 -0.092 8.629
51 HG22 VAL 6 HG22 VAL 6 -2.450 0.794 8.880
52 HG23 VAL 6 HG23 VAL 6 -2.340 -0.412 7.597
53 H LYS 7 H LYS 7 -5.522 -3.114 9.153
54 HA LYS 7 HA LYS 7 -6.363 -3.922 11.748
55 HB2 LYS 7 HB2 LYS 7 -7.623 -4.442 9.661
56 HB3 LYS 7 HB3 LYS 7 -6.322 -5.525 9.168
57 HG2 LYS 7 HG2 LYS 7 -6.702 -6.911 11.167
58 HG3 LYS 7 HG3 LYS 7 -7.982 -5.818 11.693
59 HD2 LYS 7 HD2 LYS 7 -9.274 -6.321 9.666
60 HD3 LYS 7 HD3 LYS 7 -7.985 -7.380 9.093
61 HE2 LYS 7 HE2 LYS 7 -9.742 -8.725 10.133
62 HE3 LYS 7 HE3 LYS 7 -8.284 -8.793 11.122
63 HZ1 LYS 7 HZ1 LYS 7 -9.206 -7.083 12.550
64 HZ2 LYS 7 HZ2 LYS 7 -10.259 -8.415 12.464
65 HZ3 LYS 7 HZ3 LYS 7 -10.605 -6.998 11.592
66 H TRP 8 H TRP 8 -3.929 -5.121 9.464
67 HA TRP 8 HA TRP 8 -2.206 -6.034 11.584
68 HB2 TRP 8 HB2 TRP 8 -4.021 -7.862 11.193
69 HB3 TRP 8 HB3 TRP 8 -3.170 -8.167 9.682
70 HD1 TRP 8 HD1 TRP 8 -0.740 -9.206 9.813
71 HE1 TRP 8 HE1 TRP 8 0.529 -10.414 11.703
72 HE3 TRP 8 HE3 TRP 8 -3.687 -7.954 13.791
73 HZ2 TRP 8 HZ2 TRP 8 0.318 -10.802 14.529
74 HZ3 TRP 8 HZ3 TRP 8 -3.133 -8.760 16.068
75 HH2 TRP 8 HH2 TRP 8 -1.136 -10.182 16.442
76 H PHE 9 H PHE 9 -0.181 -5.639 10.877
77 HA PHE 9 HA PHE 9 0.281 -5.558 7.943
78 HB2 PHE 9 HB2 PHE 9 0.726 -3.466 9.301
79 HB3 PHE 9 HB3 PHE 9 2.034 -4.348 10.089
80 HD1 PHE 9 HD1 PHE 9 0.861 -2.852 6.938
81 HD2 PHE 9 HD2 PHE 9 4.040 -5.012 8.856
82 HE1 PHE 9 HE1 PHE 9 2.350 -2.367 5.015
83 HE2 PHE 9 HE2 PHE 9 5.529 -4.523 6.935
84 HZ PHE 9 HZ PHE 9 4.684 -3.203 5.014
85 H ASN 10 H ASN 10 1.428 -7.187 7.069
86 HA ASN 10 HA ASN 10 3.378 -8.609 8.791
87 HB2 ASN 10 HB2 ASN 10 1.369 -9.775 6.860
88 HB3 ASN 10 HB3 ASN 10 2.766 -10.676 7.444
89 HD21 ASN 10 HD21 ASN 10 -0.003 -11.394 8.007
90 HD22 ASN 10 HD22 ASN 10 -0.223 -11.271 9.687
91 H SER 11 H SER 11 5.180 -7.542 7.974
92 HA SER 11 HA SER 11 5.705 -7.075 5.246
93 HB2 SER 11 HB2 SER 11 8.003 -6.669 5.973
94 HB3 SER 11 HB3 SER 11 6.869 -5.924 7.097
95 HG SER 11 HG SER 11 8.681 -7.286 7.955
96 H ASP 12 H ASP 12 6.285 -9.862 7.329
97 HA ASP 12 HA ASP 12 8.131 -11.263 5.728
98 HB2 ASP 12 HB2 ASP 12 5.974 -12.246 7.611
99 HB3 ASP 12 HB3 ASP 12 7.135 -13.320 6.834
100 H LYS 13 H LYS 13 4.593 -11.179 5.718
101 HA LYS 13 HA LYS 13 4.301 -12.996 3.503
102 HB2 LYS 13 HB2 LYS 13 2.394 -11.048 4.823
103 HB3 LYS 13 HB3 LYS 13 1.935 -12.144 3.520
104 HG2 LYS 13 HG2 LYS 13 2.628 -14.076 4.886
105 HG3 LYS 13 HG3 LYS 13 3.088 -12.983 6.195
106 HD2 LYS 13 HD2 LYS 13 0.763 -12.175 6.345
107 HD3 LYS 13 HD3 LYS 13 0.298 -13.266 5.036
108 HE2 LYS 13 HE2 LYS 13 0.984 -15.203 6.398
109 HE3 LYS 13 HE3 LYS 13 1.455 -14.120 7.708
110 HZ1 LYS 13 HZ1 LYS 13 -0.876 -13.286 7.686
111 HZ2 LYS 13 HZ2 LYS 13 -0.716 -14.907 8.172
112 HZ3 LYS 13 HZ3 LYS 13 -1.267 -14.536 6.608
113 H GLY 14 H GLY 14 4.777 -9.581 3.943
114 HA2 GLY 14 HA2 GLY 14 5.619 -8.102 2.306
115 HA3 GLY 14 HA3 GLY 14 5.046 -9.194 1.054
116 H PHE 15 H PHE 15 2.622 -8.736 3.380
117 HA PHE 15 HA PHE 15 1.571 -6.265 2.306
118 HB2 PHE 15 HB2 PHE 15 -0.516 -7.243 1.425
119 HB3 PHE 15 HB3 PHE 15 0.901 -7.777 0.521
120 HD1 PHE 15 HD1 PHE 15 -1.698 -8.776 2.950
121 HD2 PHE 15 HD2 PHE 15 1.652 -10.085 0.601
122 HE1 PHE 15 HE1 PHE 15 -2.321 -11.138 3.377
123 HE2 PHE 15 HE2 PHE 15 1.031 -12.446 1.031
124 HZ PHE 15 HZ PHE 15 -0.956 -12.973 2.419
125 H GLY 16 H GLY 16 -0.721 -5.893 3.152
126 HA2 GLY 16 HA2 GLY 16 -1.305 -7.191 5.696
127 HA3 GLY 16 HA3 GLY 16 -0.849 -5.491 5.783
128 H PHE 17 H PHE 17 -3.306 -6.283 6.669
129 HA PHE 17 HA PHE 17 -5.200 -5.396 4.574
130 HB2 PHE 17 HB2 PHE 17 -5.675 -6.997 7.107
131 HB3 PHE 17 HB3 PHE 17 -6.940 -6.458 6.009
132 HD1 PHE 17 HD1 PHE 17 -4.155 -8.795 6.506
133 HD2 PHE 17 HD2 PHE 17 -7.145 -7.417 3.746
134 HE1 PHE 17 HE1 PHE 17 -3.780 -10.801 5.098
135 HE2 PHE 17 HE2 PHE 17 -6.769 -9.423 2.338
136 HZ PHE 17 HZ PHE 17 -5.086 -11.115 3.013
137 H ILE 18 H ILE 18 -6.263 -3.476 4.904
138 HA ILE 18 HA ILE 18 -5.846 -2.184 7.523
139 HB ILE 18 HB ILE 18 -4.633 -1.089 5.698
140 HG12 ILE 18 HG12 ILE 18 -6.963 0.679 6.472
141 HG13 ILE 18 HG13 ILE 18 -5.740 0.186 7.646
142 HG21 ILE 18 HG21 ILE 18 -5.918 -1.572 3.760
143 HG22 ILE 18 HG22 ILE 18 -6.103 0.165 3.993
144 HG23 ILE 18 HG23 ILE 18 -7.396 -0.932 4.477
145 HD11 ILE 18 HD11 ILE 18 -4.000 1.068 6.010
146 HD12 ILE 18 HD12 ILE 18 -5.011 2.296 6.772
147 HD13 ILE 18 HD13 ILE 18 -5.333 1.787 5.115
148 H THR 19 H THR 19 -7.447 -1.218 8.586
149 HA THR 19 HA THR 19 -10.168 -1.850 7.728
150 HB THR 19 HB THR 19 -9.131 -0.907 10.406
151 HG1 THR 19 HG1 THR 19 -8.787 -2.937 10.823
152 HG21 THR 19 HG21 THR 19 -11.812 -1.990 9.492
153 HG22 THR 19 HG22 THR 19 -11.486 -0.407 10.199
154 HG23 THR 19 HG23 THR 19 -11.343 -1.862 11.186
155 HA PRO 20 HA PRO 20 -10.302 2.600 6.494
156 HB2 PRO 20 HB2 PRO 20 -13.139 1.760 6.028
157 HB3 PRO 20 HB3 PRO 20 -12.067 2.715 4.985
158 HG2 PRO 20 HG2 PRO 20 -12.535 0.220 4.378
159 HG3 PRO 20 HG3 PRO 20 -10.876 0.838 4.287
160 HD2 PRO 20 HD2 PRO 20 -12.127 -0.864 6.431
161 HD3 PRO 20 HD3 PRO 20 -10.514 -0.998 5.686
162 H GLU 21 H GLU 21 -10.698 4.281 7.843
163 HA GLU 21 HA GLU 21 -11.921 3.956 10.372
164 HB2 GLU 21 HB2 GLU 21 -11.636 6.375 10.620
165 HB3 GLU 21 HB3 GLU 21 -10.189 5.653 9.924
166 HG2 GLU 21 HG2 GLU 21 -10.838 6.379 7.691
167 HG3 GLU 21 HG3 GLU 21 -12.384 6.967 8.293
168 H ASP 22 H ASP 22 -13.259 4.702 7.271
169 HA ASP 22 HA ASP 22 -15.694 5.899 8.320
170 HB2 ASP 22 HB2 ASP 22 -14.930 5.073 5.513
171 HB3 ASP 22 HB3 ASP 22 -16.387 5.965 5.952
172 H GLY 23 H GLY 23 -14.608 2.747 8.135
173 HA2 GLY 23 HA2 GLY 23 -15.860 0.859 8.780
174 HA3 GLY 23 HA3 GLY 23 -17.335 1.711 8.346
175 H SER 24 H SER 24 -15.096 2.081 5.855
176 HA SER 24 HA SER 24 -16.582 0.467 4.045
177 HB2 SER 24 HB2 SER 24 -15.410 2.449 3.247
178 HB3 SER 24 HB3 SER 24 -13.866 1.764 3.732
179 HG SER 24 HG SER 24 -15.017 1.483 1.436
180 H LYS 25 H LYS 25 -15.555 -1.235 2.695
181 HA LYS 25 HA LYS 25 -14.730 -3.409 4.290
182 HB2 LYS 25 HB2 LYS 25 -14.678 -3.002 1.295
183 HB3 LYS 25 HB3 LYS 25 -14.326 -4.539 2.087
184 HG2 LYS 25 HG2 LYS 25 -16.546 -4.581 3.095
185 HG3 LYS 25 HG3 LYS 25 -16.904 -2.980 2.448
186 HD2 LYS 25 HD2 LYS 25 -17.956 -4.522 0.959
187 HD3 LYS 25 HD3 LYS 25 -16.500 -3.979 0.127
188 HE2 LYS 25 HE2 LYS 25 -16.655 -6.393 -0.099
189 HE3 LYS 25 HE3 LYS 25 -15.319 -6.023 0.989
190 HZ1 LYS 25 HZ1 LYS 25 -16.479 -6.740 2.810
191 HZ2 LYS 25 HZ2 LYS 25 -17.085 -7.801 1.631
192 HZ3 LYS 25 HZ3 LYS 25 -17.997 -6.451 2.113
193 H ASP 26 H ASP 26 -12.774 -4.484 4.477
194 HA ASP 26 HA ASP 26 -10.451 -3.024 4.791
195 HB2 ASP 26 HB2 ASP 26 -10.928 -5.305 5.709
196 HB3 ASP 26 HB3 ASP 26 -10.607 -5.964 4.106
197 H LEU 27 H LEU 27 -8.723 -2.505 3.559
198 HA LEU 27 HA LEU 27 -8.877 -3.128 0.671
199 HB2 LEU 27 HB2 LEU 27 -7.579 -0.777 2.077
200 HB3 LEU 27 HB3 LEU 27 -7.569 -1.056 0.338
201 HG LEU 27 HG LEU 27 -10.114 -0.780 1.967
202 HD11 LEU 27 HD11 LEU 27 -8.512 1.266 0.411
203 HD12 LEU 27 HD12 LEU 27 -8.975 1.332 2.111
204 HD13 LEU 27 HD13 LEU 27 -10.201 1.503 0.858
205 HD21 LEU 27 HD21 LEU 27 -11.073 -0.321 -0.315
206 HD22 LEU 27 HD22 LEU 27 -10.436 -1.956 -0.146
207 HD23 LEU 27 HD23 LEU 27 -9.506 -0.731 -1.009
208 H PHE 28 H PHE 28 -6.994 -3.692 -0.440
209 HA PHE 28 HA PHE 28 -5.017 -5.102 1.152
210 HB2 PHE 28 HB2 PHE 28 -5.436 -4.814 -1.830
211 HB3 PHE 28 HB3 PHE 28 -4.133 -5.765 -1.110
212 HD1 PHE 28 HD1 PHE 28 -7.774 -5.507 -1.618
213 HD2 PHE 28 HD2 PHE 28 -4.597 -7.832 0.101
214 HE1 PHE 28 HE1 PHE 28 -9.329 -7.414 -1.319
215 HE2 PHE 28 HE2 PHE 28 -6.154 -9.739 0.400
216 HZ PHE 28 HZ PHE 28 -8.521 -9.530 -0.310
217 H VAL 29 H VAL 29 -3.037 -4.412 1.646
218 HA VAL 29 HA VAL 29 -1.869 -2.148 0.151
219 HB VAL 29 HB VAL 29 -1.987 -2.427 3.168
220 HG11 VAL 29 HG11 VAL 29 -0.835 -0.194 3.151
221 HG12 VAL 29 HG12 VAL 29 -0.599 -0.376 1.412
222 HG13 VAL 29 HG13 VAL 29 0.178 -1.497 2.529
223 HG21 VAL 29 HG21 VAL 29 -3.053 -0.206 1.424
224 HG22 VAL 29 HG22 VAL 29 -3.372 -0.481 3.135
225 HG23 VAL 29 HG23 VAL 29 -4.038 -1.579 1.927
226 H HIS 30 H HIS 30 0.268 -2.385 -0.321
227 HA HIS 30 HA HIS 30 1.606 -4.832 0.659
228 HB2 HIS 30 HB2 HIS 30 2.079 -3.183 -1.835
229 HB3 HIS 30 HB3 HIS 30 3.049 -4.573 -1.356
230 HD2 HIS 30 HD2 HIS 30 -0.151 -3.867 -3.323
231 HE1 HIS 30 HE1 HIS 30 -0.279 -7.970 -2.337
232 HE2 HIS 30 HE2 HIS 30 -1.338 -6.151 -3.758
233 H HIS 31 H HIS 31 3.808 -4.759 1.254
234 HA HIS 31 HA HIS 31 4.584 -2.559 2.850
235 HB2 HIS 31 HB2 HIS 31 5.386 -4.917 3.141
236 HB3 HIS 31 HB3 HIS 31 6.378 -4.716 1.696
237 HD2 HIS 31 HD2 HIS 31 6.455 -3.749 5.470
238 HE1 HIS 31 HE1 HIS 31 9.837 -1.997 3.655
239 HE2 HIS 31 HE2 HIS 31 8.701 -2.488 5.872
240 H SER 32 H SER 32 5.708 -3.645 -0.342
241 HA SER 32 HA SER 32 7.520 -1.474 -0.746
242 HB2 SER 32 HB2 SER 32 7.722 -3.660 -1.893
243 HB3 SER 32 HB3 SER 32 6.254 -3.301 -2.797
244 HG SER 32 HG SER 32 7.366 -2.019 -4.039
245 H GLU 33 H GLU 33 4.202 -1.384 -0.629
246 HA GLU 33 HA GLU 33 3.551 0.199 -2.902
247 HB2 GLU 33 HB2 GLU 33 1.938 -1.129 -1.499
248 HB3 GLU 33 HB3 GLU 33 2.104 0.101 -0.249
249 HG2 GLU 33 HG2 GLU 33 0.138 0.591 -1.592
250 HG3 GLU 33 HG3 GLU 33 1.359 1.823 -1.884
251 H ILE 34 H ILE 34 4.857 0.964 0.268
252 HA ILE 34 HA ILE 34 4.189 3.708 0.364
253 HB ILE 34 HB ILE 34 4.993 2.451 2.326
254 HG12 ILE 34 HG12 ILE 34 6.990 4.649 1.737
255 HG13 ILE 34 HG13 ILE 34 5.289 4.998 2.044
256 HG21 ILE 34 HG21 ILE 34 7.725 2.544 1.012
257 HG22 ILE 34 HG22 ILE 34 6.706 1.107 1.069
258 HG23 ILE 34 HG23 ILE 34 7.320 1.812 2.565
259 HD11 ILE 34 HD11 ILE 34 6.663 5.157 4.112
260 HD12 ILE 34 HD12 ILE 34 7.110 3.462 3.924
261 HD13 ILE 34 HD13 ILE 34 5.430 3.901 4.232
262 H GLN 35 H GLN 35 4.901 5.393 -0.745
263 HA GLN 35 HA GLN 35 6.635 5.145 -2.959
264 HB2 GLN 35 HB2 GLN 35 5.581 7.565 -1.487
265 HB3 GLN 35 HB3 GLN 35 6.529 7.668 -2.970
266 HG2 GLN 35 HG2 GLN 35 3.931 6.125 -2.686
267 HG3 GLN 35 HG3 GLN 35 4.071 7.731 -3.396
268 HE21 GLN 35 HE21 GLN 35 3.554 4.751 -4.448
269 HE22 GLN 35 HE22 GLN 35 4.497 4.718 -5.859
270 H SER 36 H SER 36 7.161 6.384 0.326
271 HA SER 36 HA SER 36 9.730 7.466 -0.069
272 HB2 SER 36 HB2 SER 36 8.454 6.286 2.405
273 HB3 SER 36 HB3 SER 36 9.979 7.167 2.404
274 HG SER 36 HG SER 36 7.405 8.093 1.645
275 H GLY 37 H GLY 37 8.703 4.214 0.928
276 HA2 GLY 37 HA2 GLY 37 9.791 2.185 0.884
277 HA3 GLY 37 HA3 GLY 37 10.890 2.901 -0.290
278 H GLY 38 H GLY 38 10.453 4.232 2.938
279 HA2 GLY 38 HA2 GLY 38 13.255 4.159 3.484
280 HA3 GLY 38 HA3 GLY 38 11.991 4.644 4.609
281 H GLU 39 H GLU 39 14.451 2.670 4.456
282 HA GLU 39 HA GLU 39 13.463 0.086 5.086
283 HB2 GLU 39 HB2 GLU 39 15.788 0.543 4.340
284 HB3 GLU 39 HB3 GLU 39 16.101 1.366 5.866
285 HG2 GLU 39 HG2 GLU 39 16.937 -0.928 5.997
286 HG3 GLU 39 HG3 GLU 39 15.567 -0.740 7.084
287 H TYR 40 H TYR 40 14.341 2.892 7.056
288 HA TYR 40 HA TYR 40 14.145 1.701 9.602
289 HB2 TYR 40 HB2 TYR 40 13.675 4.560 8.740
290 HB3 TYR 40 HB3 TYR 40 13.809 4.033 10.416
291 HD1 TYR 40 HD1 TYR 40 15.623 4.590 7.266
292 HD2 TYR 40 HD2 TYR 40 15.938 3.205 11.321
293 HE1 TYR 40 HE1 TYR 40 18.095 4.697 7.112
294 HE2 TYR 40 HE2 TYR 40 18.410 3.311 11.165
295 HH TYR 40 HH TYR 40 20.123 4.408 9.874
296 H ALA 41 H ALA 41 11.716 3.240 7.534
297 HA ALA 41 HA ALA 41 9.616 3.384 9.389
298 HB1 ALA 41 HB1 ALA 41 9.796 4.335 6.977
299 HB2 ALA 41 HB2 ALA 41 8.216 3.811 7.564
300 HB3 ALA 41 HB3 ALA 41 9.146 2.771 6.485
301 H THR 42 H THR 42 8.381 1.918 10.311
302 HA THR 42 HA THR 42 8.155 -0.777 9.116
303 HB THR 42 HB THR 42 8.244 -1.748 11.387
304 HG1 THR 42 HG1 THR 42 8.677 -0.489 13.108
305 HG21 THR 42 HG21 THR 42 10.724 -1.113 11.827
306 HG22 THR 42 HG22 THR 42 10.578 -0.141 10.363
307 HG23 THR 42 HG23 THR 42 10.320 -1.883 10.294
308 H LEU 43 H LEU 43 6.277 -1.994 9.908
309 HA LEU 43 HA LEU 43 4.110 -0.388 11.040
310 HB2 LEU 43 HB2 LEU 43 3.856 -1.865 8.410
311 HB3 LEU 43 HB3 LEU 43 2.528 -1.124 9.294
312 HG LEU 43 HG LEU 43 4.170 1.029 9.154
313 HD11 LEU 43 HD11 LEU 43 5.439 1.137 7.149
314 HD12 LEU 43 HD12 LEU 43 4.709 -0.334 6.506
315 HD13 LEU 43 HD13 LEU 43 5.849 -0.428 7.844
316 HD21 LEU 43 HD21 LEU 43 2.423 0.124 6.840
317 HD22 LEU 43 HD22 LEU 43 2.861 1.785 7.234
318 HD23 LEU 43 HD23 LEU 43 1.821 0.867 8.323
319 H ALA 44 H ALA 44 2.409 -1.652 11.921
320 HA ALA 44 HA ALA 44 2.784 -4.555 12.067
321 HB1 ALA 44 HB1 ALA 44 2.491 -2.991 14.628
322 HB2 ALA 44 HB2 ALA 44 4.083 -3.304 13.938
323 HB3 ALA 44 HB3 ALA 44 3.046 -4.650 14.407
324 H ASP 45 H ASP 45 0.885 -4.771 14.342
325 HA ASP 45 HA ASP 45 -1.555 -4.458 12.806
326 HB2 ASP 45 HB2 ASP 45 -2.591 -5.705 14.663
327 HB3 ASP 45 HB3 ASP 45 -1.175 -6.535 14.032
328 H GLY 46 H GLY 46 -2.639 -2.617 12.845
329 HA2 GLY 46 HA2 GLY 46 -4.065 -1.071 13.980
330 HA3 GLY 46 HA3 GLY 46 -3.053 -1.223 15.407
331 H GLN 47 H GLN 47 -1.021 -0.927 12.768
332 HA GLN 47 HA GLN 47 -0.034 1.605 13.491
333 HB2 GLN 47 HB2 GLN 47 1.225 -0.172 12.260
334 HB3 GLN 47 HB3 GLN 47 0.273 0.200 10.827
335 HG2 GLN 47 HG2 GLN 47 2.412 1.380 10.718
336 HG3 GLN 47 HG3 GLN 47 1.106 2.539 10.911
337 HE21 GLN 47 HE21 GLN 47 1.796 4.171 12.298
338 HE22 GLN 47 HE22 GLN 47 2.691 3.926 13.720
339 H THR 48 H THR 48 -0.549 3.626 12.912
340 HA THR 48 HA THR 48 -2.940 4.097 11.335
341 HB THR 48 HB THR 48 -1.010 6.079 12.593
342 HG1 THR 48 HG1 THR 48 -2.120 4.528 13.998
343 HG21 THR 48 HG21 THR 48 -3.780 6.317 11.405
344 HG22 THR 48 HG22 THR 48 -2.337 7.244 10.993
345 HG23 THR 48 HG23 THR 48 -3.144 7.509 12.539
346 H VAL 49 H VAL 49 -2.971 4.486 9.211
347 HA VAL 49 HA VAL 49 -0.598 5.639 7.909
348 HB VAL 49 HB VAL 49 -0.689 3.957 6.095
349 HG11 VAL 49 HG11 VAL 49 0.460 2.229 7.284
350 HG12 VAL 49 HG12 VAL 49 -0.412 2.581 8.776
351 HG13 VAL 49 HG13 VAL 49 0.784 3.722 8.162
352 HG21 VAL 49 HG21 VAL 49 -2.735 2.643 7.913
353 HG22 VAL 49 HG22 VAL 49 -1.953 1.829 6.558
354 HG23 VAL 49 HG23 VAL 49 -2.998 3.220 6.267
355 H GLU 50 H GLU 50 -1.033 6.270 5.631
356 HA GLU 50 HA GLU 50 -3.859 7.061 5.242
357 HB2 GLU 50 HB2 GLU 50 -2.998 9.042 3.996
358 HB3 GLU 50 HB3 GLU 50 -2.568 9.072 5.706
359 HG2 GLU 50 HG2 GLU 50 -0.330 8.191 5.147
360 HG3 GLU 50 HG3 GLU 50 -0.764 8.170 3.439
361 H TYR 51 H TYR 51 -4.682 6.854 3.149
362 HA TYR 51 HA TYR 51 -2.972 5.840 1.020
363 HB2 TYR 51 HB2 TYR 51 -4.240 3.740 0.757
364 HB3 TYR 51 HB3 TYR 51 -3.418 3.807 2.313
365 HD1 TYR 51 HD1 TYR 51 -6.679 3.905 0.606
366 HD2 TYR 51 HD2 TYR 51 -4.676 4.144 4.397
367 HE1 TYR 51 HE1 TYR 51 -8.850 3.617 1.770
368 HE2 TYR 51 HE2 TYR 51 -6.847 3.851 5.562
369 HH TYR 51 HH TYR 51 -9.253 4.222 5.078
370 H GLU 52 H GLU 52 -4.192 5.351 -0.965
371 HA GLU 52 HA GLU 52 -6.604 7.055 -1.225
372 HB2 GLU 52 HB2 GLU 52 -4.588 7.946 -2.414
373 HB3 GLU 52 HB3 GLU 52 -4.530 6.456 -3.354
374 HG2 GLU 52 HG2 GLU 52 -6.780 6.907 -4.240
375 HG3 GLU 52 HG3 GLU 52 -6.876 8.380 -3.275
376 H VAL 53 H VAL 53 -8.395 6.044 -1.919
377 HA VAL 53 HA VAL 53 -8.309 3.192 -2.443
378 HB VAL 53 HB VAL 53 -10.062 4.178 -1.011
379 HG11 VAL 53 HG11 VAL 53 -11.271 5.380 -3.506
380 HG12 VAL 53 HG12 VAL 53 -10.235 6.312 -2.429
381 HG13 VAL 53 HG13 VAL 53 -11.747 5.637 -1.828
382 HG21 VAL 53 HG21 VAL 53 -11.136 2.975 -3.582
383 HG22 VAL 53 HG22 VAL 53 -11.979 3.013 -2.033
384 HG23 VAL 53 HG23 VAL 53 -10.501 2.065 -2.212
385 H GLY 54 H GLY 54 -7.902 2.400 -4.378
386 HA2 GLY 54 HA2 GLY 54 -8.835 3.880 -6.774
387 HA3 GLY 54 HA3 GLY 54 -7.328 2.971 -6.724
388 H GLN 55 H GLN 55 -10.588 2.867 -7.511
389 HA GLN 55 HA GLN 55 -11.232 0.155 -7.048
390 HB2 GLN 55 HB2 GLN 55 -12.288 2.139 -9.075
391 HB3 GLN 55 HB3 GLN 55 -12.998 0.549 -8.780
392 HG2 GLN 55 HG2 GLN 55 -13.355 1.145 -6.412
393 HG3 GLN 55 HG3 GLN 55 -12.651 2.734 -6.706
394 HE21 GLN 55 HE21 GLN 55 -14.480 4.090 -6.502
395 HE22 GLN 55 HE22 GLN 55 -15.887 3.917 -7.431
396 H GLY 56 H GLY 56 -11.181 -1.618 -8.379
397 HA2 GLY 56 HA2 GLY 56 -10.020 -1.518 -11.030
398 HA3 GLY 56 HA3 GLY 56 -8.995 -2.281 -9.818
399 H GLN 57 H GLN 57 -9.485 -4.002 -11.608
400 HA GLN 57 HA GLN 57 -11.970 -5.335 -11.685
401 HB2 GLN 57 HB2 GLN 57 -9.154 -6.270 -12.262
402 HB3 GLN 57 HB3 GLN 57 -10.584 -7.259 -12.559
403 HG2 GLN 57 HG2 GLN 57 -11.480 -5.631 -14.099
404 HG3 GLN 57 HG3 GLN 57 -10.223 -4.469 -13.678
405 HE21 GLN 57 HE21 GLN 57 -10.843 -5.702 -16.362
406 HE22 GLN 57 HE22 GLN 57 -9.399 -6.446 -16.854
407 H LYS 58 H LYS 58 -9.120 -5.760 -9.629
408 HA LYS 58 HA LYS 58 -10.305 -8.019 -8.222
409 HB2 LYS 58 HB2 LYS 58 -7.796 -7.661 -8.760
410 HB3 LYS 58 HB3 LYS 58 -7.808 -6.548 -7.394
411 HG2 LYS 58 HG2 LYS 58 -8.532 -8.306 -5.887
412 HG3 LYS 58 HG3 LYS 58 -8.755 -9.424 -7.232
413 HD2 LYS 58 HD2 LYS 58 -6.345 -9.334 -7.722
414 HD3 LYS 58 HD3 LYS 58 -6.112 -8.192 -6.399
415 HE2 LYS 58 HE2 LYS 58 -5.535 -10.447 -5.644
416 HE3 LYS 58 HE3 LYS 58 -6.988 -9.896 -4.809
417 HZ1 LYS 58 HZ1 LYS 58 -6.886 -12.242 -5.927
418 HZ2 LYS 58 HZ2 LYS 58 -7.293 -11.367 -7.326
419 HZ3 LYS 58 HZ3 LYS 58 -8.312 -11.323 -5.967
420 H GLY 59 H GLY 59 -11.469 -5.184 -8.144
421 HA2 GLY 59 HA2 GLY 59 -12.811 -4.155 -6.547
422 HA3 GLY 59 HA3 GLY 59 -12.073 -5.170 -5.310
423 HA PRO 60 HA PRO 60 -10.390 -0.643 -5.301
424 HB2 PRO 60 HB2 PRO 60 -11.393 -0.810 -2.494
425 HB3 PRO 60 HB3 PRO 60 -11.444 0.549 -3.633
426 HG2 PRO 60 HG2 PRO 60 -13.631 -0.809 -3.101
427 HG3 PRO 60 HG3 PRO 60 -13.265 -0.295 -4.760
428 HD2 PRO 60 HD2 PRO 60 -12.948 -3.025 -3.524
429 HD3 PRO 60 HD3 PRO 60 -13.564 -2.589 -5.136
430 H CYS 61 H CYS 61 -8.468 -0.049 -4.375
431 HA CYS 61 HA CYS 61 -7.210 -1.852 -2.412
432 HB2 CYS 61 HB2 CYS 61 -5.119 -1.850 -3.699
433 HB3 CYS 61 HB3 CYS 61 -6.425 -2.550 -4.652
434 HG CYS 61 HG CYS 61 -6.620 -0.175 -5.877
435 H ALA 62 H ALA 62 -5.065 -0.784 -1.627
436 HA ALA 62 HA ALA 62 -5.490 2.148 -1.445
437 HB1 ALA 62 HB1 ALA 62 -5.958 1.587 0.724
438 HB2 ALA 62 HB2 ALA 62 -4.199 1.642 0.856
439 HB3 ALA 62 HB3 ALA 62 -5.024 0.095 0.654
440 H ASN 63 H ASN 63 -3.852 3.311 -2.218
441 HA ASN 63 HA ASN 63 -1.161 2.067 -2.296
442 HB2 ASN 63 HB2 ASN 63 -0.751 3.344 -4.370
443 HB3 ASN 63 HB3 ASN 63 -2.081 2.203 -4.551
444 HD21 ASN 63 HD21 ASN 63 -3.633 3.195 -5.851
445 HD22 ASN 63 HD22 ASN 63 -4.167 4.796 -5.667
446 H LYS 64 H LYS 64 0.540 3.886 -2.707
447 HA LYS 64 HA LYS 64 1.713 5.621 -1.768
448 HB2 LYS 64 HB2 LYS 64 -1.046 6.882 -1.774
449 HB3 LYS 64 HB3 LYS 64 0.457 7.757 -1.475
450 HG2 LYS 64 HG2 LYS 64 1.290 7.085 -3.702
451 HG3 LYS 64 HG3 LYS 64 -0.216 6.218 -4.002
452 HD2 LYS 64 HD2 LYS 64 -1.481 8.325 -3.764
453 HD3 LYS 64 HD3 LYS 64 0.026 9.195 -3.473
454 HE2 LYS 64 HE2 LYS 64 0.848 8.530 -5.701
455 HE3 LYS 64 HE3 LYS 64 -0.655 7.653 -5.995
456 HZ1 LYS 64 HZ1 LYS 64 -1.757 9.892 -5.464
457 HZ2 LYS 64 HZ2 LYS 64 -1.028 9.691 -6.984
458 HZ3 LYS 64 HZ3 LYS 64 -0.227 10.561 -5.765
459 H VAL 65 H VAL 65 1.077 3.571 -0.043
460 HA VAL 65 HA VAL 65 -0.155 4.444 2.365
461 HB VAL 65 HB VAL 65 -0.001 2.072 1.723
462 HG11 VAL 65 HG11 VAL 65 2.378 2.333 0.800
463 HG12 VAL 65 HG12 VAL 65 2.038 0.859 1.710
464 HG13 VAL 65 HG13 VAL 65 2.923 2.180 2.471
465 HG21 VAL 65 HG21 VAL 65 -0.240 2.767 4.122
466 HG22 VAL 65 HG22 VAL 65 1.510 2.627 4.295
467 HG23 VAL 65 HG23 VAL 65 0.543 1.198 3.923
468 H VAL 66 H VAL 66 0.583 5.899 3.708
469 HA VAL 66 HA VAL 66 3.506 6.039 4.224
470 HB VAL 66 HB VAL 66 1.623 8.409 4.020
471 HG11 VAL 66 HG11 VAL 66 4.613 8.313 4.524
472 HG12 VAL 66 HG12 VAL 66 3.394 8.698 5.739
473 HG13 VAL 66 HG13 VAL 66 3.635 9.773 4.361
474 HG21 VAL 66 HG21 VAL 66 3.888 7.446 2.251
475 HG22 VAL 66 HG22 VAL 66 3.109 9.020 2.095
476 HG23 VAL 66 HG23 VAL 66 2.181 7.546 1.816
477 H ALA 67 H ALA 67 4.038 5.777 6.281
478 HA ALA 67 HA ALA 67 2.062 5.348 8.297
479 HB1 ALA 67 HB1 ALA 67 4.081 5.173 9.805
480 HB2 ALA 67 HB2 ALA 67 5.074 5.540 8.395
481 HB3 ALA 67 HB3 ALA 67 4.087 4.078 8.422
482 H VAL 68 H VAL 68 1.372 6.622 9.924
483 HA VAL 68 HA VAL 68 0.922 8.523 11.130
484 HB VAL 68 HB VAL 68 3.798 9.274 10.504
485 HG11 VAL 68 HG11 VAL 68 3.552 10.479 12.728
486 HG12 VAL 68 HG12 VAL 68 1.819 10.172 12.616
487 HG13 VAL 68 HG13 VAL 68 2.619 11.169 11.401
488 HG21 VAL 68 HG21 VAL 68 2.590 7.606 12.733
489 HG22 VAL 68 HG22 VAL 68 4.221 8.271 12.792
490 HG23 VAL 68 HG23 VAL 68 3.795 7.092 11.552
Start of MODEL 17
1 H1 MET 1 HT1 MET 1 -7.617 13.489 0.588
2 H2 MET 1 HT2 MET 1 -6.119 14.114 1.088
3 H3 MET 1 HT3 MET 1 -7.312 13.736 2.239
4 HA MET 1 HA MET 1 -6.413 11.595 0.468
5 HB2 MET 1 HB2 MET 1 -4.489 11.119 1.962
6 HB3 MET 1 HB3 MET 1 -4.296 12.654 1.120
7 HG2 MET 1 HG2 MET 1 -5.139 13.842 3.140
8 HG3 MET 1 HG3 MET 1 -5.253 12.296 3.980
9 HE1 MET 1 HE1 MET 1 -2.402 13.742 1.467
10 HE2 MET 1 HE2 MET 1 -1.573 14.662 2.718
11 HE3 MET 1 HE3 MET 1 -3.276 14.970 2.391
12 H SER 2 H SER 2 -6.026 9.659 2.146
13 HA SER 2 HA SER 2 -8.254 9.702 4.095
14 HB2 SER 2 HB2 SER 2 -7.450 7.445 2.246
15 HB3 SER 2 HB3 SER 2 -8.671 7.334 3.510
16 HG SER 2 HG SER 2 -9.910 7.970 1.911
17 H LYS 3 H LYS 3 -7.979 8.487 5.976
18 HA LYS 3 HA LYS 3 -5.363 7.227 6.435
19 HB2 LYS 3 HB2 LYS 3 -5.176 9.584 7.199
20 HB3 LYS 3 HB3 LYS 3 -6.559 9.331 8.263
21 HG2 LYS 3 HG2 LYS 3 -5.319 7.576 9.475
22 HG3 LYS 3 HG3 LYS 3 -3.937 7.805 8.400
23 HD2 LYS 3 HD2 LYS 3 -3.732 10.144 9.151
24 HD3 LYS 3 HD3 LYS 3 -5.115 9.924 10.222
25 HE2 LYS 3 HE2 LYS 3 -3.900 8.165 11.446
26 HE3 LYS 3 HE3 LYS 3 -2.516 8.370 10.373
27 HZ1 LYS 3 HZ1 LYS 3 -3.649 10.399 12.220
28 HZ2 LYS 3 HZ2 LYS 3 -2.416 10.712 11.093
29 HZ3 LYS 3 HZ3 LYS 3 -2.151 9.617 12.365
30 H GLY 4 H GLY 4 -5.695 5.275 7.266
31 HA2 GLY 4 HA2 GLY 4 -8.001 4.840 9.073
32 HA3 GLY 4 HA3 GLY 4 -7.646 3.716 7.763
33 H ILE 5 H ILE 5 -7.706 2.420 9.981
34 HA ILE 5 HA ILE 5 -4.934 2.305 11.031
35 HB ILE 5 HB ILE 5 -5.982 1.077 12.988
36 HG12 ILE 5 HG12 ILE 5 -8.579 2.315 12.031
37 HG13 ILE 5 HG13 ILE 5 -8.169 0.644 11.662
38 HG21 ILE 5 HG21 ILE 5 -5.301 3.336 13.317
39 HG22 ILE 5 HG22 ILE 5 -6.947 3.246 13.945
40 HG23 ILE 5 HG23 ILE 5 -6.647 3.960 12.361
41 HD11 ILE 5 HD11 ILE 5 -7.976 0.128 14.049
42 HD12 ILE 5 HD12 ILE 5 -9.555 0.845 13.724
43 HD13 ILE 5 HD13 ILE 5 -8.277 1.818 14.458
44 H VAL 6 H VAL 6 -3.759 0.629 10.511
45 HA VAL 6 HA VAL 6 -4.705 -1.397 8.796
46 HB VAL 6 HB VAL 6 -2.130 -1.280 10.390
47 HG11 VAL 6 HG11 VAL 6 -1.358 -2.771 8.414
48 HG12 VAL 6 HG12 VAL 6 -3.074 -3.070 8.143
49 HG13 VAL 6 HG13 VAL 6 -2.330 -3.531 9.672
50 HG21 VAL 6 HG21 VAL 6 -2.695 0.610 8.727
51 HG22 VAL 6 HG22 VAL 6 -2.551 -0.613 7.464
52 HG23 VAL 6 HG23 VAL 6 -1.162 -0.227 8.483
53 H LYS 7 H LYS 7 -5.724 -3.223 9.196
54 HA LYS 7 HA LYS 7 -6.415 -4.086 11.825
55 HB2 LYS 7 HB2 LYS 7 -7.806 -4.568 9.810
56 HB3 LYS 7 HB3 LYS 7 -6.542 -5.649 9.224
57 HG2 LYS 7 HG2 LYS 7 -6.793 -7.048 11.241
58 HG3 LYS 7 HG3 LYS 7 -8.043 -5.962 11.845
59 HD2 LYS 7 HD2 LYS 7 -9.434 -6.453 9.868
60 HD3 LYS 7 HD3 LYS 7 -8.186 -7.541 9.260
61 HE2 LYS 7 HE2 LYS 7 -8.421 -8.949 11.270
62 HE3 LYS 7 HE3 LYS 7 -9.663 -7.861 11.890
63 HZ1 LYS 7 HZ1 LYS 7 -10.791 -9.619 10.846
64 HZ2 LYS 7 HZ2 LYS 7 -9.783 -9.575 9.479
65 HZ3 LYS 7 HZ3 LYS 7 -10.889 -8.318 9.761
66 H TRP 8 H TRP 8 -4.142 -5.234 9.350
67 HA TRP 8 HA TRP 8 -2.211 -6.012 11.285
68 HB2 TRP 8 HB2 TRP 8 -2.173 -8.412 10.928
69 HB3 TRP 8 HB3 TRP 8 -3.742 -7.924 11.554
70 HD1 TRP 8 HD1 TRP 8 -5.828 -8.048 9.893
71 HE1 TRP 8 HE1 TRP 8 -6.206 -9.398 7.729
72 HE3 TRP 8 HE3 TRP 8 -1.007 -9.323 8.794
73 HZ2 TRP 8 HZ2 TRP 8 -4.666 -10.836 5.793
74 HZ3 TRP 8 HZ3 TRP 8 -0.493 -10.684 6.788
75 HH2 TRP 8 HH2 TRP 8 -2.314 -11.441 5.288
76 H PHE 9 H PHE 9 -0.228 -6.046 10.434
77 HA PHE 9 HA PHE 9 -0.008 -6.006 7.468
78 HB2 PHE 9 HB2 PHE 9 0.425 -3.798 8.651
79 HB3 PHE 9 HB3 PHE 9 1.834 -4.566 9.384
80 HD1 PHE 9 HD1 PHE 9 0.427 -3.129 6.345
81 HD2 PHE 9 HD2 PHE 9 3.686 -5.432 7.936
82 HE1 PHE 9 HE1 PHE 9 1.736 -2.705 4.281
83 HE2 PHE 9 HE2 PHE 9 4.995 -5.004 5.873
84 HZ PHE 9 HZ PHE 9 4.017 -3.638 4.049
85 H ASN 10 H ASN 10 1.316 -7.494 6.584
86 HA ASN 10 HA ASN 10 3.410 -8.703 8.282
87 HB2 ASN 10 HB2 ASN 10 1.372 -10.169 6.609
88 HB3 ASN 10 HB3 ASN 10 2.882 -10.908 7.131
89 HD21 ASN 10 HD21 ASN 10 0.332 -11.901 8.003
90 HD22 ASN 10 HD22 ASN 10 0.196 -11.629 9.673
91 H SER 11 H SER 11 5.152 -7.787 7.327
92 HA SER 11 HA SER 11 5.455 -7.294 4.567
93 HB2 SER 11 HB2 SER 11 7.808 -6.902 5.114
94 HB3 SER 11 HB3 SER 11 6.766 -6.156 6.323
95 HG SER 11 HG SER 11 8.235 -8.572 6.485
96 H ASP 12 H ASP 12 6.225 -10.090 6.585
97 HA ASP 12 HA ASP 12 7.913 -11.483 4.809
98 HB2 ASP 12 HB2 ASP 12 5.931 -12.480 6.874
99 HB3 ASP 12 HB3 ASP 12 7.017 -13.548 5.989
100 H LYS 13 H LYS 13 4.394 -11.391 5.137
101 HA LYS 13 HA LYS 13 3.872 -13.171 2.936
102 HB2 LYS 13 HB2 LYS 13 2.128 -11.212 4.456
103 HB3 LYS 13 HB3 LYS 13 1.530 -12.275 3.184
104 HG2 LYS 13 HG2 LYS 13 2.305 -14.243 4.451
105 HG3 LYS 13 HG3 LYS 13 2.907 -13.182 5.727
106 HD2 LYS 13 HD2 LYS 13 0.622 -12.332 6.106
107 HD3 LYS 13 HD3 LYS 13 0.018 -13.390 4.828
108 HE2 LYS 13 HE2 LYS 13 0.785 -15.364 6.087
109 HE3 LYS 13 HE3 LYS 13 1.402 -14.315 7.365
110 HZ1 LYS 13 HZ1 LYS 13 -1.408 -14.088 6.528
111 HZ2 LYS 13 HZ2 LYS 13 -0.700 -13.729 8.029
112 HZ3 LYS 13 HZ3 LYS 13 -0.949 -15.345 7.570
113 H GLY 14 H GLY 14 4.273 -9.734 3.436
114 HA2 GLY 14 HA2 GLY 14 4.994 -8.180 1.805
115 HA3 GLY 14 HA3 GLY 14 4.439 -9.277 0.548
116 H PHE 15 H PHE 15 2.074 -8.980 2.972
117 HA PHE 15 HA PHE 15 0.864 -6.555 1.952
118 HB2 PHE 15 HB2 PHE 15 -1.194 -7.631 1.128
119 HB3 PHE 15 HB3 PHE 15 0.220 -8.098 0.183
120 HD1 PHE 15 HD1 PHE 15 -2.256 -9.220 2.685
121 HD2 PHE 15 HD2 PHE 15 1.082 -10.367 0.235
122 HE1 PHE 15 HE1 PHE 15 -2.751 -11.610 3.130
123 HE2 PHE 15 HE2 PHE 15 0.588 -12.756 0.683
124 HZ PHE 15 HZ PHE 15 -1.328 -13.376 2.129
125 H GLY 16 H GLY 16 -1.400 -6.299 2.851
126 HA2 GLY 16 HA2 GLY 16 -2.041 -7.661 5.304
127 HA3 GLY 16 HA3 GLY 16 -1.404 -6.037 5.560
128 H PHE 17 H PHE 17 -3.859 -6.355 6.445
129 HA PHE 17 HA PHE 17 -5.610 -5.131 4.390
130 HB2 PHE 17 HB2 PHE 17 -6.299 -7.028 6.641
131 HB3 PHE 17 HB3 PHE 17 -7.510 -6.072 5.787
132 HD1 PHE 17 HD1 PHE 17 -4.817 -8.590 5.307
133 HD2 PHE 17 HD2 PHE 17 -8.312 -6.741 3.646
134 HE1 PHE 17 HE1 PHE 17 -4.852 -10.289 3.500
135 HE2 PHE 17 HE2 PHE 17 -8.347 -8.431 1.832
136 HZ PHE 17 HZ PHE 17 -6.617 -10.206 1.760
137 H ILE 18 H ILE 18 -6.686 -3.282 4.946
138 HA ILE 18 HA ILE 18 -6.088 -2.211 7.625
139 HB ILE 18 HB ILE 18 -4.837 -1.055 5.865
140 HG12 ILE 18 HG12 ILE 18 -7.023 0.823 6.781
141 HG13 ILE 18 HG13 ILE 18 -5.886 0.124 7.935
142 HG21 ILE 18 HG21 ILE 18 -7.575 -0.340 4.765
143 HG22 ILE 18 HG22 ILE 18 -6.421 -1.439 4.009
144 HG23 ILE 18 HG23 ILE 18 -6.032 0.273 4.168
145 HD11 ILE 18 HD11 ILE 18 -4.038 1.169 6.929
146 HD12 ILE 18 HD12 ILE 18 -5.280 2.416 6.905
147 HD13 ILE 18 HD13 ILE 18 -4.913 1.510 5.438
148 H THR 19 H THR 19 -7.588 -1.121 8.754
149 HA THR 19 HA THR 19 -10.355 -1.616 7.959
150 HB THR 19 HB THR 19 -9.207 -0.789 10.627
151 HG1 THR 19 HG1 THR 19 -9.329 -2.934 11.122
152 HG21 THR 19 HG21 THR 19 -11.402 -1.549 11.495
153 HG22 THR 19 HG22 THR 19 -11.942 -1.843 9.842
154 HG23 THR 19 HG23 THR 19 -11.582 -0.199 10.374
155 HA PRO 20 HA PRO 20 -10.364 2.858 6.800
156 HB2 PRO 20 HB2 PRO 20 -13.256 2.121 6.499
157 HB3 PRO 20 HB3 PRO 20 -12.226 3.068 5.409
158 HG2 PRO 20 HG2 PRO 20 -12.820 0.595 4.798
159 HG3 PRO 20 HG3 PRO 20 -11.160 1.181 4.577
160 HD2 PRO 20 HD2 PRO 20 -12.253 -0.583 6.749
161 HD3 PRO 20 HD3 PRO 20 -10.689 -0.665 5.908
162 H GLU 21 H GLU 21 -10.607 4.516 8.232
163 HA GLU 21 HA GLU 21 -11.628 4.154 10.830
164 HB2 GLU 21 HB2 GLU 21 -11.355 6.588 11.083
165 HB3 GLU 21 HB3 GLU 21 -9.954 5.869 10.298
166 HG2 GLU 21 HG2 GLU 21 -10.835 6.553 8.090
167 HG3 GLU 21 HG3 GLU 21 -12.239 7.276 8.876
168 H ASP 22 H ASP 22 -13.139 5.298 7.884
169 HA ASP 22 HA ASP 22 -15.489 6.406 9.056
170 HB2 ASP 22 HB2 ASP 22 -14.646 6.863 6.731
171 HB3 ASP 22 HB3 ASP 22 -15.200 5.251 6.279
172 H GLY 23 H GLY 23 -14.474 3.157 8.442
173 HA2 GLY 23 HA2 GLY 23 -15.610 1.311 9.501
174 HA3 GLY 23 HA3 GLY 23 -17.131 2.161 9.263
175 H SER 24 H SER 24 -15.163 2.440 6.526
176 HA SER 24 HA SER 24 -16.898 0.881 4.892
177 HB2 SER 24 HB2 SER 24 -14.218 2.156 4.307
178 HB3 SER 24 HB3 SER 24 -15.270 1.434 3.096
179 HG SER 24 HG SER 24 -15.712 3.697 4.730
180 H LYS 25 H LYS 25 -16.017 -0.762 3.363
181 HA LYS 25 HA LYS 25 -15.095 -3.035 4.742
182 HB2 LYS 25 HB2 LYS 25 -16.453 -3.011 2.613
183 HB3 LYS 25 HB3 LYS 25 -14.971 -2.594 1.753
184 HG2 LYS 25 HG2 LYS 25 -13.896 -4.652 2.644
185 HG3 LYS 25 HG3 LYS 25 -15.409 -5.080 3.441
186 HD2 LYS 25 HD2 LYS 25 -15.224 -4.603 0.457
187 HD3 LYS 25 HD3 LYS 25 -14.992 -6.194 1.180
188 HE2 LYS 25 HE2 LYS 25 -17.245 -6.006 2.233
189 HE3 LYS 25 HE3 LYS 25 -17.477 -4.464 1.409
190 HZ1 LYS 25 HZ1 LYS 25 -16.939 -7.054 0.058
191 HZ2 LYS 25 HZ2 LYS 25 -17.250 -5.568 -0.704
192 HZ3 LYS 25 HZ3 LYS 25 -18.468 -6.333 0.201
193 H ASP 26 H ASP 26 -13.116 -4.036 4.877
194 HA ASP 26 HA ASP 26 -10.800 -2.523 4.997
195 HB2 ASP 26 HB2 ASP 26 -11.082 -5.501 4.561
196 HB3 ASP 26 HB3 ASP 26 -9.605 -4.688 5.074
197 H LEU 27 H LEU 27 -9.056 -2.181 3.689
198 HA LEU 27 HA LEU 27 -9.409 -2.848 0.825
199 HB2 LEU 27 HB2 LEU 27 -8.235 -0.432 2.202
200 HB3 LEU 27 HB3 LEU 27 -7.803 -0.836 0.543
201 HG LEU 27 HG LEU 27 -10.450 -1.002 0.234
202 HD11 LEU 27 HD11 LEU 27 -10.320 1.139 2.364
203 HD12 LEU 27 HD12 LEU 27 -10.700 -0.531 2.771
204 HD13 LEU 27 HD13 LEU 27 -11.742 0.360 1.667
205 HD21 LEU 27 HD21 LEU 27 -10.448 1.237 -0.621
206 HD22 LEU 27 HD22 LEU 27 -8.806 0.633 -0.830
207 HD23 LEU 27 HD23 LEU 27 -9.178 1.735 0.496
208 H PHE 28 H PHE 28 -7.577 -3.435 -0.381
209 HA PHE 28 HA PHE 28 -5.603 -4.960 1.078
210 HB2 PHE 28 HB2 PHE 28 -6.010 -4.393 -1.869
211 HB3 PHE 28 HB3 PHE 28 -4.726 -5.430 -1.241
212 HD1 PHE 28 HD1 PHE 28 -8.380 -5.035 -1.633
213 HD2 PHE 28 HD2 PHE 28 -5.210 -7.619 -0.322
214 HE1 PHE 28 HE1 PHE 28 -9.972 -6.934 -1.522
215 HE2 PHE 28 HE2 PHE 28 -6.801 -9.517 -0.212
216 HZ PHE 28 HZ PHE 28 -9.181 -9.174 -0.812
217 H VAL 29 H VAL 29 -3.615 -4.324 1.662
218 HA VAL 29 HA VAL 29 -2.437 -1.934 0.380
219 HB VAL 29 HB VAL 29 -2.352 -2.614 3.335
220 HG11 VAL 29 HG11 VAL 29 -1.238 -0.430 3.572
221 HG12 VAL 29 HG12 VAL 29 -1.296 -0.208 1.823
222 HG13 VAL 29 HG13 VAL 29 -0.309 -1.497 2.517
223 HG21 VAL 29 HG21 VAL 29 -4.522 -1.770 3.007
224 HG22 VAL 29 HG22 VAL 29 -4.004 -0.655 1.750
225 HG23 VAL 29 HG23 VAL 29 -3.606 -0.326 3.436
226 H HIS 30 H HIS 30 -0.383 -2.271 -0.330
227 HA HIS 30 HA HIS 30 0.992 -4.743 0.552
228 HB2 HIS 30 HB2 HIS 30 1.181 -3.261 -2.075
229 HB3 HIS 30 HB3 HIS 30 2.165 -4.656 -1.640
230 HD2 HIS 30 HD2 HIS 30 -1.237 -3.937 -3.229
231 HE1 HIS 30 HE1 HIS 30 -1.359 -7.975 -2.007
232 HE2 HIS 30 HE2 HIS 30 -2.538 -6.196 -3.382
233 H HIS 31 H HIS 31 3.216 -4.700 0.887
234 HA HIS 31 HA HIS 31 4.232 -2.357 2.161
235 HB2 HIS 31 HB2 HIS 31 4.866 -4.738 2.721
236 HB3 HIS 31 HB3 HIS 31 5.831 -4.757 1.246
237 HD2 HIS 31 HD2 HIS 31 6.048 -3.338 4.878
238 HE1 HIS 31 HE1 HIS 31 9.459 -1.991 2.786
239 HE2 HIS 31 HE2 HIS 31 8.364 -2.153 5.071
240 H SER 32 H SER 32 4.891 -3.897 -0.951
241 HA SER 32 HA SER 32 7.027 -2.277 -1.778
242 HB2 SER 32 HB2 SER 32 6.596 -3.156 -4.006
243 HB3 SER 32 HB3 SER 32 6.449 -4.433 -2.803
244 HG SER 32 HG SER 32 4.334 -4.497 -3.112
245 H GLU 33 H GLU 33 3.660 -1.477 -1.652
246 HA GLU 33 HA GLU 33 3.599 0.371 -3.818
247 HB2 GLU 33 HB2 GLU 33 1.848 0.024 -1.389
248 HB3 GLU 33 HB3 GLU 33 1.545 1.262 -2.608
249 HG2 GLU 33 HG2 GLU 33 1.801 -1.697 -3.205
250 HG3 GLU 33 HG3 GLU 33 0.264 -0.854 -3.020
251 H ILE 34 H ILE 34 4.759 0.685 -0.527
252 HA ILE 34 HA ILE 34 4.609 3.550 -0.443
253 HB ILE 34 HB ILE 34 4.705 2.174 1.610
254 HG12 ILE 34 HG12 ILE 34 7.174 3.922 1.492
255 HG13 ILE 34 HG13 ILE 34 5.554 4.609 1.430
256 HG21 ILE 34 HG21 ILE 34 7.638 1.751 1.524
257 HG22 ILE 34 HG22 ILE 34 6.750 0.773 0.362
258 HG23 ILE 34 HG23 ILE 34 6.353 0.676 2.075
259 HD11 ILE 34 HD11 ILE 34 5.019 3.441 3.572
260 HD12 ILE 34 HD12 ILE 34 6.338 4.597 3.743
261 HD13 ILE 34 HD13 ILE 34 6.689 2.872 3.644
262 H GLN 35 H GLN 35 5.766 4.898 -1.627
263 HA GLN 35 HA GLN 35 7.955 4.134 -3.252
264 HB2 GLN 35 HB2 GLN 35 6.978 6.849 -2.343
265 HB3 GLN 35 HB3 GLN 35 8.276 6.627 -3.513
266 HG2 GLN 35 HG2 GLN 35 5.474 5.505 -3.819
267 HG3 GLN 35 HG3 GLN 35 6.049 6.979 -4.593
268 HE21 GLN 35 HE21 GLN 35 5.346 3.984 -5.495
269 HE22 GLN 35 HE22 GLN 35 6.600 3.656 -6.590
270 H SER 36 H SER 36 7.760 5.737 -0.103
271 HA SER 36 HA SER 36 10.226 4.740 0.832
272 HB2 SER 36 HB2 SER 36 11.230 6.314 -0.767
273 HB3 SER 36 HB3 SER 36 10.300 7.637 -0.067
274 HG SER 36 HG SER 36 12.393 6.115 1.065
275 H GLY 37 H GLY 37 8.630 7.927 1.117
276 HA2 GLY 37 HA2 GLY 37 7.221 8.695 2.827
277 HA3 GLY 37 HA3 GLY 37 7.554 7.230 3.737
278 H GLY 38 H GLY 38 10.558 8.010 2.960
279 HA2 GLY 38 HA2 GLY 38 12.265 9.311 3.847
280 HA3 GLY 38 HA3 GLY 38 11.058 10.295 4.662
281 H GLU 39 H GLU 39 10.316 7.144 5.423
282 HA GLU 39 HA GLU 39 12.155 7.000 7.717
283 HB2 GLU 39 HB2 GLU 39 9.139 6.774 7.886
284 HB3 GLU 39 HB3 GLU 39 10.261 6.448 9.208
285 HG2 GLU 39 HG2 GLU 39 11.088 8.777 9.069
286 HG3 GLU 39 HG3 GLU 39 9.942 9.101 7.769
287 H TYR 40 H TYR 40 12.416 4.917 8.602
288 HA TYR 40 HA TYR 40 11.733 2.741 6.730
289 HB2 TYR 40 HB2 TYR 40 13.845 2.910 8.888
290 HB3 TYR 40 HB3 TYR 40 13.543 1.489 7.889
291 HD1 TYR 40 HD1 TYR 40 14.890 4.904 7.962
292 HD2 TYR 40 HD2 TYR 40 14.030 1.510 5.476
293 HE1 TYR 40 HE1 TYR 40 16.323 5.853 6.173
294 HE2 TYR 40 HE2 TYR 40 15.463 2.457 3.686
295 HH TYR 40 HH TYR 40 17.463 4.099 3.612
296 H ALA 41 H ALA 41 10.183 3.983 9.208
297 HA ALA 41 HA ALA 41 9.971 2.062 11.216
298 HB1 ALA 41 HB1 ALA 41 7.825 3.071 11.743
299 HB2 ALA 41 HB2 ALA 41 7.747 3.812 10.145
300 HB3 ALA 41 HB3 ALA 41 8.971 4.339 11.302
301 H THR 42 H THR 42 9.040 0.152 11.389
302 HA THR 42 HA THR 42 7.981 -1.177 9.051
303 HB THR 42 HB THR 42 7.827 -3.144 10.523
304 HG1 THR 42 HG1 THR 42 7.241 -2.175 12.433
305 HG21 THR 42 HG21 THR 42 10.267 -3.209 11.214
306 HG22 THR 42 HG22 THR 42 10.378 -1.528 10.697
307 HG23 THR 42 HG23 THR 42 9.980 -2.786 9.527
308 H LEU 43 H LEU 43 5.981 -2.593 9.411
309 HA LEU 43 HA LEU 43 3.856 -1.044 10.765
310 HB2 LEU 43 HB2 LEU 43 3.636 -2.457 8.096
311 HB3 LEU 43 HB3 LEU 43 2.308 -1.691 8.959
312 HG LEU 43 HG LEU 43 3.894 0.436 8.911
313 HD11 LEU 43 HD11 LEU 43 5.017 -1.362 6.757
314 HD12 LEU 43 HD12 LEU 43 5.888 -0.417 7.962
315 HD13 LEU 43 HD13 LEU 43 5.107 0.393 6.610
316 HD21 LEU 43 HD21 LEU 43 2.551 -0.481 6.348
317 HD22 LEU 43 HD22 LEU 43 2.785 1.179 6.895
318 HD23 LEU 43 HD23 LEU 43 1.667 0.119 7.751
319 H ALA 44 H ALA 44 2.244 -2.237 11.761
320 HA ALA 44 HA ALA 44 2.397 -5.161 11.711
321 HB1 ALA 44 HB1 ALA 44 2.842 -5.419 14.011
322 HB2 ALA 44 HB2 ALA 44 2.439 -3.740 14.370
323 HB3 ALA 44 HB3 ALA 44 3.939 -4.125 13.527
324 H ASP 45 H ASP 45 0.667 -5.187 14.236
325 HA ASP 45 HA ASP 45 -1.858 -4.762 12.870
326 HB2 ASP 45 HB2 ASP 45 -1.361 -5.770 15.678
327 HB3 ASP 45 HB3 ASP 45 -2.844 -5.931 14.741
328 H GLY 46 H GLY 46 -2.746 -2.799 12.882
329 HA2 GLY 46 HA2 GLY 46 -4.006 -1.148 14.074
330 HA3 GLY 46 HA3 GLY 46 -2.917 -1.342 15.437
331 H GLN 47 H GLN 47 -1.056 -1.227 12.648
332 HA GLN 47 HA GLN 47 0.103 1.279 13.266
333 HB2 GLN 47 HB2 GLN 47 1.244 -0.591 12.053
334 HB3 GLN 47 HB3 GLN 47 0.245 -0.236 10.645
335 HG2 GLN 47 HG2 GLN 47 2.415 0.867 10.398
336 HG3 GLN 47 HG3 GLN 47 1.159 2.076 10.614
337 HE21 GLN 47 HE21 GLN 47 2.013 3.731 11.881
338 HE22 GLN 47 HE22 GLN 47 2.946 3.498 13.279
339 H THR 48 H THR 48 -0.447 3.288 12.706
340 HA THR 48 HA THR 48 -2.808 3.727 11.061
341 HB THR 48 HB THR 48 -2.372 6.150 11.678
342 HG1 THR 48 HG1 THR 48 -0.493 4.975 13.438
343 HG21 THR 48 HG21 THR 48 -3.975 4.930 12.963
344 HG22 THR 48 HG22 THR 48 -2.924 5.734 14.130
345 HG23 THR 48 HG23 THR 48 -2.715 4.015 13.792
346 H VAL 49 H VAL 49 -2.818 4.367 9.011
347 HA VAL 49 HA VAL 49 -0.405 5.559 7.829
348 HB VAL 49 HB VAL 49 -0.440 4.017 5.907
349 HG11 VAL 49 HG11 VAL 49 0.678 2.215 6.987
350 HG12 VAL 49 HG12 VAL 49 -0.280 2.398 8.456
351 HG13 VAL 49 HG13 VAL 49 0.928 3.607 8.035
352 HG21 VAL 49 HG21 VAL 49 -1.734 1.863 6.184
353 HG22 VAL 49 HG22 VAL 49 -2.740 3.283 5.898
354 HG23 VAL 49 HG23 VAL 49 -2.589 2.622 7.527
355 H GLU 50 H GLU 50 -0.827 6.156 5.482
356 HA GLU 50 HA GLU 50 -3.622 7.000 5.055
357 HB2 GLU 50 HB2 GLU 50 -2.765 9.142 4.095
358 HB3 GLU 50 HB3 GLU 50 -2.479 9.000 5.830
359 HG2 GLU 50 HG2 GLU 50 -0.159 8.296 5.385
360 HG3 GLU 50 HG3 GLU 50 -0.447 8.417 3.652
361 H TYR 51 H TYR 51 -4.304 6.917 2.923
362 HA TYR 51 HA TYR 51 -2.445 6.437 0.767
363 HB2 TYR 51 HB2 TYR 51 -3.230 4.178 0.212
364 HB3 TYR 51 HB3 TYR 51 -2.484 4.213 1.807
365 HD1 TYR 51 HD1 TYR 51 -5.631 3.849 -0.059
366 HD2 TYR 51 HD2 TYR 51 -3.852 4.013 3.848
367 HE1 TYR 51 HE1 TYR 51 -7.720 2.953 0.929
368 HE2 TYR 51 HE2 TYR 51 -5.942 3.116 4.836
369 HH TYR 51 HH TYR 51 -8.777 3.185 3.512
370 H GLU 52 H GLU 52 -3.619 5.843 -1.286
371 HA GLU 52 HA GLU 52 -6.184 7.311 -1.423
372 HB2 GLU 52 HB2 GLU 52 -4.234 8.265 -2.715
373 HB3 GLU 52 HB3 GLU 52 -4.224 6.785 -3.676
374 HG2 GLU 52 HG2 GLU 52 -6.559 7.207 -4.355
375 HG3 GLU 52 HG3 GLU 52 -6.575 8.683 -3.393
376 H VAL 53 H VAL 53 -7.933 6.129 -1.890
377 HA VAL 53 HA VAL 53 -7.754 3.308 -2.340
378 HB VAL 53 HB VAL 53 -9.602 4.333 -1.076
379 HG11 VAL 53 HG11 VAL 53 -10.710 5.362 -3.690
380 HG12 VAL 53 HG12 VAL 53 -9.723 6.372 -2.636
381 HG13 VAL 53 HG13 VAL 53 -11.253 5.723 -2.052
382 HG21 VAL 53 HG21 VAL 53 -9.835 2.147 -2.412
383 HG22 VAL 53 HG22 VAL 53 -10.759 3.094 -3.580
384 HG23 VAL 53 HG23 VAL 53 -11.332 2.939 -1.918
385 H GLY 54 H GLY 54 -7.221 2.397 -4.183
386 HA2 GLY 54 HA2 GLY 54 -7.864 3.726 -6.735
387 HA3 GLY 54 HA3 GLY 54 -6.582 2.538 -6.501
388 H GLN 55 H GLN 55 -8.059 1.865 -8.524
389 HA GLN 55 HA GLN 55 -10.125 0.007 -7.515
390 HB2 GLN 55 HB2 GLN 55 -10.924 1.741 -9.118
391 HB3 GLN 55 HB3 GLN 55 -9.794 1.114 -10.322
392 HG2 GLN 55 HG2 GLN 55 -10.915 -1.092 -10.214
393 HG3 GLN 55 HG3 GLN 55 -12.050 -0.453 -9.025
394 HE21 GLN 55 HE21 GLN 55 -14.006 0.074 -9.994
395 HE22 GLN 55 HE22 GLN 55 -14.180 0.717 -11.556
396 H GLY 56 H GLY 56 -9.832 -2.107 -7.746
397 HA2 GLY 56 HA2 GLY 56 -7.704 -3.095 -9.547
398 HA3 GLY 56 HA3 GLY 56 -7.867 -3.695 -7.897
399 H GLN 57 H GLN 57 -7.991 -5.356 -10.172
400 HA GLN 57 HA GLN 57 -10.605 -5.913 -11.075
401 HB2 GLN 57 HB2 GLN 57 -8.134 -7.639 -10.851
402 HB3 GLN 57 HB3 GLN 57 -9.627 -8.179 -11.625
403 HG2 GLN 57 HG2 GLN 57 -9.511 -6.397 -13.248
404 HG3 GLN 57 HG3 GLN 57 -8.165 -5.641 -12.399
405 HE21 GLN 57 HE21 GLN 57 -8.265 -6.705 -15.220
406 HE22 GLN 57 HE22 GLN 57 -7.014 -7.849 -15.310
407 H LYS 58 H LYS 58 -8.742 -7.156 -8.323
408 HA LYS 58 HA LYS 58 -10.884 -8.929 -7.485
409 HB2 LYS 58 HB2 LYS 58 -8.255 -8.164 -6.196
410 HB3 LYS 58 HB3 LYS 58 -9.384 -9.343 -5.524
411 HG2 LYS 58 HG2 LYS 58 -9.235 -10.636 -7.663
412 HG3 LYS 58 HG3 LYS 58 -8.005 -9.504 -8.223
413 HD2 LYS 58 HD2 LYS 58 -7.739 -11.067 -5.643
414 HD3 LYS 58 HD3 LYS 58 -7.117 -11.655 -7.185
415 HE2 LYS 58 HE2 LYS 58 -5.754 -9.581 -7.395
416 HE3 LYS 58 HE3 LYS 58 -6.329 -9.068 -5.809
417 HZ1 LYS 58 HZ1 LYS 58 -5.050 -11.700 -6.177
418 HZ2 LYS 58 HZ2 LYS 58 -5.214 -10.783 -4.756
419 HZ3 LYS 58 HZ3 LYS 58 -4.110 -10.306 -5.957
420 H GLY 59 H GLY 59 -9.916 -5.656 -6.889
421 HA2 GLY 59 HA2 GLY 59 -12.162 -4.693 -5.724
422 HA3 GLY 59 HA3 GLY 59 -11.296 -5.386 -4.356
423 HA PRO 60 HA PRO 60 -9.687 -1.031 -5.157
424 HB2 PRO 60 HB2 PRO 60 -10.062 0.006 -2.681
425 HB3 PRO 60 HB3 PRO 60 -11.345 -0.010 -3.909
426 HG2 PRO 60 HG2 PRO 60 -10.902 -1.872 -1.618
427 HG3 PRO 60 HG3 PRO 60 -12.402 -1.113 -2.182
428 HD2 PRO 60 HD2 PRO 60 -11.755 -3.684 -2.806
429 HD3 PRO 60 HD3 PRO 60 -12.690 -2.647 -3.907
430 H CYS 61 H CYS 61 -7.774 -0.024 -4.271
431 HA CYS 61 HA CYS 61 -6.206 -1.664 -2.389
432 HB2 CYS 61 HB2 CYS 61 -4.240 -1.561 -3.844
433 HB3 CYS 61 HB3 CYS 61 -5.572 -2.365 -4.672
434 HG CYS 61 HG CYS 61 -4.270 -0.279 -6.023
435 H ALA 62 H ALA 62 -4.088 -0.479 -1.837
436 HA ALA 62 HA ALA 62 -4.719 2.382 -1.407
437 HB1 ALA 62 HB1 ALA 62 -2.935 2.096 0.431
438 HB2 ALA 62 HB2 ALA 62 -3.141 0.366 0.177
439 HB3 ALA 62 HB3 ALA 62 -4.508 1.349 0.706
440 H ASN 63 H ASN 63 -3.392 3.905 -2.265
441 HA ASN 63 HA ASN 63 -0.812 3.008 -3.411
442 HB2 ASN 63 HB2 ASN 63 -2.666 5.195 -4.389
443 HB3 ASN 63 HB3 ASN 63 -1.109 4.776 -5.100
444 HD21 ASN 63 HD21 ASN 63 -4.136 4.482 -5.976
445 HD22 ASN 63 HD22 ASN 63 -4.184 2.896 -6.579
446 H LYS 64 H LYS 64 0.962 4.432 -3.215
447 HA LYS 64 HA LYS 64 2.321 5.893 -2.075
448 HB2 LYS 64 HB2 LYS 64 -0.206 7.559 -2.194
449 HB3 LYS 64 HB3 LYS 64 1.375 8.177 -1.712
450 HG2 LYS 64 HG2 LYS 64 2.303 7.516 -3.904
451 HG3 LYS 64 HG3 LYS 64 0.721 6.901 -4.386
452 HD2 LYS 64 HD2 LYS 64 -0.243 9.156 -4.112
453 HD3 LYS 64 HD3 LYS 64 1.340 9.775 -3.635
454 HE2 LYS 64 HE2 LYS 64 2.261 9.120 -5.826
455 HE3 LYS 64 HE3 LYS 64 0.684 8.493 -6.306
456 HZ1 LYS 64 HZ1 LYS 64 1.511 11.285 -5.860
457 HZ2 LYS 64 HZ2 LYS 64 -0.123 10.846 -5.702
458 HZ3 LYS 64 HZ3 LYS 64 0.683 10.613 -7.179
459 H VAL 65 H VAL 65 1.551 3.939 -0.461
460 HA VAL 65 HA VAL 65 0.151 4.763 1.892
461 HB VAL 65 HB VAL 65 2.061 2.439 1.460
462 HG11 VAL 65 HG11 VAL 65 0.928 1.448 3.433
463 HG12 VAL 65 HG12 VAL 65 0.016 2.941 3.648
464 HG13 VAL 65 HG13 VAL 65 1.768 2.942 3.852
465 HG21 VAL 65 HG21 VAL 65 -0.035 2.568 0.010
466 HG22 VAL 65 HG22 VAL 65 -0.966 2.417 1.499
467 HG23 VAL 65 HG23 VAL 65 0.115 1.117 1.001
468 H VAL 66 H VAL 66 0.848 6.053 3.419
469 HA VAL 66 HA VAL 66 3.760 6.225 3.975
470 HB VAL 66 HB VAL 66 1.788 8.534 3.973
471 HG11 VAL 66 HG11 VAL 66 4.777 8.509 4.496
472 HG12 VAL 66 HG12 VAL 66 3.536 8.732 5.729
473 HG13 VAL 66 HG13 VAL 66 3.743 9.938 4.459
474 HG21 VAL 66 HG21 VAL 66 2.534 7.701 1.716
475 HG22 VAL 66 HG22 VAL 66 4.196 8.037 2.201
476 HG23 VAL 66 HG23 VAL 66 3.033 9.356 2.063
477 H ALA 67 H ALA 67 4.293 5.796 6.004
478 HA ALA 67 HA ALA 67 2.337 5.124 7.970
479 HB1 ALA 67 HB1 ALA 67 4.418 4.990 9.466
480 HB2 ALA 67 HB2 ALA 67 5.340 5.364 8.010
481 HB3 ALA 67 HB3 ALA 67 4.356 3.902 8.079
482 H VAL 68 H VAL 68 1.651 6.223 9.746
483 HA VAL 68 HA VAL 68 2.851 8.538 10.829
484 HB VAL 68 HB VAL 68 2.143 9.583 8.708
485 HG11 VAL 68 HG11 VAL 68 -0.126 9.693 8.004
486 HG12 VAL 68 HG12 VAL 68 -0.714 9.055 9.539
487 HG13 VAL 68 HG13 VAL 68 0.152 8.003 8.421
488 HG21 VAL 68 HG21 VAL 68 0.813 11.446 9.689
489 HG22 VAL 68 HG22 VAL 68 2.163 10.977 10.721
490 HG23 VAL 68 HG23 VAL 68 0.526 10.460 11.123
Start of MODEL 18
1 H1 MET 1 HT1 MET 1 -7.210 14.191 3.344
2 H2 MET 1 HT2 MET 1 -6.210 14.870 2.149
3 H3 MET 1 HT3 MET 1 -5.593 14.554 3.701
4 HA MET 1 HA MET 1 -6.161 12.697 1.504
5 HB2 MET 1 HB2 MET 1 -3.858 13.565 2.098
6 HB3 MET 1 HB3 MET 1 -4.011 12.722 3.640
7 HG2 MET 1 HG2 MET 1 -2.805 11.286 2.096
8 HG3 MET 1 HG3 MET 1 -4.402 10.592 2.374
9 HE1 MET 1 HE1 MET 1 -3.121 13.622 -0.028
10 HE2 MET 1 HE2 MET 1 -2.665 12.547 -1.346
11 HE3 MET 1 HE3 MET 1 -1.956 12.322 0.251
12 H SER 2 H SER 2 -7.093 10.767 1.828
13 HA SER 2 HA SER 2 -8.474 10.181 4.242
14 HB2 SER 2 HB2 SER 2 -7.859 8.431 1.851
15 HB3 SER 2 HB3 SER 2 -8.979 8.010 3.142
16 HG SER 2 HG SER 2 -9.355 9.590 0.996
17 H LYS 3 H LYS 3 -8.114 8.572 5.776
18 HA LYS 3 HA LYS 3 -5.700 6.964 5.710
19 HB2 LYS 3 HB2 LYS 3 -4.735 7.891 7.765
20 HB3 LYS 3 HB3 LYS 3 -4.827 9.119 6.506
21 HG2 LYS 3 HG2 LYS 3 -6.904 10.001 7.516
22 HG3 LYS 3 HG3 LYS 3 -6.798 8.775 8.781
23 HD2 LYS 3 HD2 LYS 3 -4.623 9.692 9.495
24 HD3 LYS 3 HD3 LYS 3 -4.723 10.919 8.230
25 HE2 LYS 3 HE2 LYS 3 -6.788 11.805 9.244
26 HE3 LYS 3 HE3 LYS 3 -6.697 10.578 10.508
27 HZ1 LYS 3 HZ1 LYS 3 -4.915 11.579 11.487
28 HZ2 LYS 3 HZ2 LYS 3 -5.706 12.951 10.872
29 HZ3 LYS 3 HZ3 LYS 3 -4.369 12.298 10.053
30 H GLY 4 H GLY 4 -5.806 5.211 7.043
31 HA2 GLY 4 HA2 GLY 4 -8.107 5.006 8.886
32 HA3 GLY 4 HA3 GLY 4 -7.830 3.762 7.671
33 H ILE 5 H ILE 5 -7.790 2.399 9.647
34 HA ILE 5 HA ILE 5 -5.089 2.388 10.870
35 HB ILE 5 HB ILE 5 -6.196 1.077 12.744
36 HG12 ILE 5 HG12 ILE 5 -8.777 2.278 11.709
37 HG13 ILE 5 HG13 ILE 5 -8.303 0.638 11.282
38 HG21 ILE 5 HG21 ILE 5 -7.053 3.938 12.222
39 HG22 ILE 5 HG22 ILE 5 -5.575 3.414 13.025
40 HG23 ILE 5 HG23 ILE 5 -7.139 3.139 13.791
41 HD11 ILE 5 HD11 ILE 5 -8.829 1.756 14.047
42 HD12 ILE 5 HD12 ILE 5 -8.037 0.202 13.785
43 HD13 ILE 5 HD13 ILE 5 -9.692 0.452 13.231
44 H VAL 6 H VAL 6 -3.855 0.720 10.488
45 HA VAL 6 HA VAL 6 -4.625 -1.295 8.655
46 HB VAL 6 HB VAL 6 -2.166 -1.122 10.417
47 HG11 VAL 6 HG11 VAL 6 -1.188 -2.580 8.561
48 HG12 VAL 6 HG12 VAL 6 -2.844 -2.861 8.030
49 HG13 VAL 6 HG13 VAL 6 -2.333 -3.383 9.635
50 HG21 VAL 6 HG21 VAL 6 -2.646 0.779 8.762
51 HG22 VAL 6 HG22 VAL 6 -2.434 -0.416 7.483
52 HG23 VAL 6 HG23 VAL 6 -1.096 -0.042 8.570
53 H LYS 7 H LYS 7 -5.626 -3.150 8.989
54 HA LYS 7 HA LYS 7 -6.437 -4.043 11.577
55 HB2 LYS 7 HB2 LYS 7 -7.652 -4.550 9.419
56 HB3 LYS 7 HB3 LYS 7 -6.352 -5.680 9.027
57 HG2 LYS 7 HG2 LYS 7 -6.809 -6.890 11.166
58 HG3 LYS 7 HG3 LYS 7 -8.166 -5.807 11.456
59 HD2 LYS 7 HD2 LYS 7 -7.927 -7.474 8.939
60 HD3 LYS 7 HD3 LYS 7 -8.753 -8.050 10.386
61 HE2 LYS 7 HE2 LYS 7 -10.245 -6.057 10.298
62 HE3 LYS 7 HE3 LYS 7 -9.454 -5.558 8.802
63 HZ1 LYS 7 HZ1 LYS 7 -11.614 -6.986 8.741
64 HZ2 LYS 7 HZ2 LYS 7 -10.541 -8.277 8.997
65 HZ3 LYS 7 HZ3 LYS 7 -10.363 -7.279 7.632
66 H TRP 8 H TRP 8 -3.989 -5.092 9.235
67 HA TRP 8 HA TRP 8 -2.118 -5.798 11.228
68 HB2 TRP 8 HB2 TRP 8 -2.004 -8.221 10.897
69 HB3 TRP 8 HB3 TRP 8 -3.557 -7.742 11.569
70 HD1 TRP 8 HD1 TRP 8 -5.696 -7.936 10.003
71 HE1 TRP 8 HE1 TRP 8 -6.139 -9.309 7.868
72 HE3 TRP 8 HE3 TRP 8 -0.902 -9.126 8.710
73 HZ2 TRP 8 HZ2 TRP 8 -4.658 -10.731 5.880
74 HZ3 TRP 8 HZ3 TRP 8 -0.449 -10.493 6.694
75 HH2 TRP 8 HH2 TRP 8 -2.317 -11.295 5.278
76 H PHE 9 H PHE 9 -0.106 -5.886 10.431
77 HA PHE 9 HA PHE 9 0.168 -5.914 7.466
78 HB2 PHE 9 HB2 PHE 9 0.590 -3.673 8.552
79 HB3 PHE 9 HB3 PHE 9 1.962 -4.411 9.384
80 HD1 PHE 9 HD1 PHE 9 0.627 -3.307 6.138
81 HD2 PHE 9 HD2 PHE 9 3.939 -5.163 8.144
82 HE1 PHE 9 HE1 PHE 9 2.024 -2.999 4.114
83 HE2 PHE 9 HE2 PHE 9 5.340 -4.851 6.122
84 HZ PHE 9 HZ PHE 9 4.382 -3.769 4.106
85 H ASN 10 H ASN 10 1.508 -7.403 6.632
86 HA ASN 10 HA ASN 10 3.516 -8.651 8.406
87 HB2 ASN 10 HB2 ASN 10 1.542 -10.056 6.607
88 HB3 ASN 10 HB3 ASN 10 3.010 -10.829 7.197
89 HD21 ASN 10 HD21 ASN 10 0.393 -11.780 7.914
90 HD22 ASN 10 HD22 ASN 10 0.178 -11.534 9.579
91 H SER 11 H SER 11 5.301 -7.717 7.547
92 HA SER 11 HA SER 11 5.751 -7.217 4.809
93 HB2 SER 11 HB2 SER 11 8.070 -6.829 5.476
94 HB3 SER 11 HB3 SER 11 6.969 -6.090 6.636
95 HG SER 11 HG SER 11 8.828 -7.523 7.370
96 H ASP 12 H ASP 12 6.288 -10.065 6.812
97 HA ASP 12 HA ASP 12 8.122 -11.449 5.173
98 HB2 ASP 12 HB2 ASP 12 5.933 -12.448 7.014
99 HB3 ASP 12 HB3 ASP 12 7.075 -13.520 6.208
100 H LYS 13 H LYS 13 4.584 -11.313 5.179
101 HA LYS 13 HA LYS 13 4.260 -13.019 2.882
102 HB2 LYS 13 HB2 LYS 13 2.383 -11.115 4.305
103 HB3 LYS 13 HB3 LYS 13 1.903 -12.141 2.955
104 HG2 LYS 13 HG2 LYS 13 2.580 -14.144 4.225
105 HG3 LYS 13 HG3 LYS 13 3.061 -13.119 5.582
106 HD2 LYS 13 HD2 LYS 13 0.740 -12.283 5.765
107 HD3 LYS 13 HD3 LYS 13 0.263 -13.333 4.429
108 HE2 LYS 13 HE2 LYS 13 1.465 -14.301 7.039
109 HE3 LYS 13 HE3 LYS 13 -0.255 -14.336 6.651
110 HZ1 LYS 13 HZ1 LYS 13 0.284 -15.719 4.713
111 HZ2 LYS 13 HZ2 LYS 13 0.729 -16.461 6.176
112 HZ3 LYS 13 HZ3 LYS 13 1.912 -15.745 5.188
113 H GLY 14 H GLY 14 4.783 -9.632 3.486
114 HA2 GLY 14 HA2 GLY 14 5.609 -8.070 1.929
115 HA3 GLY 14 HA3 GLY 14 5.058 -9.108 0.623
116 H PHE 15 H PHE 15 2.612 -8.762 2.956
117 HA PHE 15 HA PHE 15 1.545 -6.259 1.983
118 HB2 PHE 15 HB2 PHE 15 -0.516 -7.209 1.012
119 HB3 PHE 15 HB3 PHE 15 0.925 -7.670 0.104
120 HD1 PHE 15 HD1 PHE 15 -1.711 -8.845 2.410
121 HD2 PHE 15 HD2 PHE 15 1.721 -9.968 0.083
122 HE1 PHE 15 HE1 PHE 15 -2.299 -11.237 2.695
123 HE2 PHE 15 HE2 PHE 15 1.135 -12.360 0.371
124 HZ PHE 15 HZ PHE 15 -0.875 -12.995 1.678
125 H GLY 16 H GLY 16 -0.792 -5.997 2.768
126 HA2 GLY 16 HA2 GLY 16 -1.502 -7.434 5.173
127 HA3 GLY 16 HA3 GLY 16 -0.942 -5.787 5.460
128 H PHE 17 H PHE 17 -3.421 -6.255 6.239
129 HA PHE 17 HA PHE 17 -5.147 -5.082 4.137
130 HB2 PHE 17 HB2 PHE 17 -5.811 -7.031 6.351
131 HB3 PHE 17 HB3 PHE 17 -7.045 -6.123 5.476
132 HD1 PHE 17 HD1 PHE 17 -4.189 -8.477 5.011
133 HD2 PHE 17 HD2 PHE 17 -7.782 -6.835 3.334
134 HE1 PHE 17 HE1 PHE 17 -4.097 -10.150 3.183
135 HE2 PHE 17 HE2 PHE 17 -7.688 -8.501 1.501
136 HZ PHE 17 HZ PHE 17 -5.846 -10.158 1.424
137 H ILE 18 H ILE 18 -6.286 -3.272 4.647
138 HA ILE 18 HA ILE 18 -5.853 -2.187 7.354
139 HB ILE 18 HB ILE 18 -4.591 -0.962 5.642
140 HG12 ILE 18 HG12 ILE 18 -6.921 0.768 6.490
141 HG13 ILE 18 HG13 ILE 18 -5.735 0.179 7.654
142 HG21 ILE 18 HG21 ILE 18 -5.962 -1.380 3.685
143 HG22 ILE 18 HG22 ILE 18 -5.881 0.363 3.940
144 HG23 ILE 18 HG23 ILE 18 -7.329 -0.532 4.408
145 HD11 ILE 18 HD11 ILE 18 -5.287 2.013 5.297
146 HD12 ILE 18 HD12 ILE 18 -3.955 1.156 6.069
147 HD13 ILE 18 HD13 ILE 18 -4.916 2.308 6.996
148 H THR 19 H THR 19 -7.457 -1.120 8.392
149 HA THR 19 HA THR 19 -10.168 -1.721 7.467
150 HB THR 19 HB THR 19 -9.201 -0.861 10.199
151 HG1 THR 19 HG1 THR 19 -8.526 -2.848 10.209
152 HG21 THR 19 HG21 THR 19 -11.852 -1.942 9.198
153 HG22 THR 19 HG22 THR 19 -11.553 -0.340 9.872
154 HG23 THR 19 HG23 THR 19 -11.433 -1.766 10.903
155 HA PRO 20 HA PRO 20 -10.111 2.736 6.273
156 HB2 PRO 20 HB2 PRO 20 -12.976 2.000 5.794
157 HB3 PRO 20 HB3 PRO 20 -11.875 2.947 4.772
158 HG2 PRO 20 HG2 PRO 20 -12.416 0.471 4.130
159 HG3 PRO 20 HG3 PRO 20 -10.745 1.061 4.027
160 HD2 PRO 20 HD2 PRO 20 -11.992 -0.695 6.123
161 HD3 PRO 20 HD3 PRO 20 -10.372 -0.777 5.396
162 H GLU 21 H GLU 21 -10.483 4.440 7.531
163 HA GLU 21 HA GLU 21 -11.534 4.280 10.120
164 HB2 GLU 21 HB2 GLU 21 -9.924 5.995 9.404
165 HB3 GLU 21 HB3 GLU 21 -11.136 6.704 8.341
166 HG2 GLU 21 HG2 GLU 21 -11.044 7.994 10.401
167 HG3 GLU 21 HG3 GLU 21 -12.579 7.128 10.319
168 H ASP 22 H ASP 22 -12.989 5.418 7.091
169 HA ASP 22 HA ASP 22 -15.410 6.385 8.201
170 HB2 ASP 22 HB2 ASP 22 -14.689 5.425 5.430
171 HB3 ASP 22 HB3 ASP 22 -16.265 6.093 5.830
172 H GLY 23 H GLY 23 -14.288 3.176 7.768
173 HA2 GLY 23 HA2 GLY 23 -15.430 1.303 8.715
174 HA3 GLY 23 HA3 GLY 23 -16.960 2.125 8.426
175 H SER 24 H SER 24 -14.855 2.438 5.790
176 HA SER 24 HA SER 24 -16.523 0.889 4.064
177 HB2 SER 24 HB2 SER 24 -13.820 2.157 3.600
178 HB3 SER 24 HB3 SER 24 -14.817 1.440 2.345
179 HG SER 24 HG SER 24 -14.931 3.874 3.135
180 H LYS 25 H LYS 25 -15.613 -0.782 2.588
181 HA LYS 25 HA LYS 25 -14.780 -3.053 4.002
182 HB2 LYS 25 HB2 LYS 25 -16.009 -3.078 1.831
183 HB3 LYS 25 HB3 LYS 25 -14.537 -2.546 1.024
184 HG2 LYS 25 HG2 LYS 25 -14.643 -4.936 0.768
185 HG3 LYS 25 HG3 LYS 25 -13.396 -4.610 1.968
186 HD2 LYS 25 HD2 LYS 25 -14.954 -5.119 3.784
187 HD3 LYS 25 HD3 LYS 25 -16.265 -5.346 2.626
188 HE2 LYS 25 HE2 LYS 25 -15.030 -7.221 1.597
189 HE3 LYS 25 HE3 LYS 25 -13.724 -6.996 2.758
190 HZ1 LYS 25 HZ1 LYS 25 -15.220 -8.741 3.471
191 HZ2 LYS 25 HZ2 LYS 25 -16.540 -7.671 3.418
192 HZ3 LYS 25 HZ3 LYS 25 -15.294 -7.432 4.548
193 H ASP 26 H ASP 26 -12.823 -4.098 4.242
194 HA ASP 26 HA ASP 26 -10.497 -2.651 4.568
195 HB2 ASP 26 HB2 ASP 26 -10.790 -5.594 3.942
196 HB3 ASP 26 HB3 ASP 26 -9.340 -4.835 4.596
197 H LEU 27 H LEU 27 -8.707 -2.207 3.374
198 HA LEU 27 HA LEU 27 -8.905 -2.671 0.462
199 HB2 LEU 27 HB2 LEU 27 -7.475 -0.496 2.014
200 HB3 LEU 27 HB3 LEU 27 -7.444 -0.672 0.261
201 HG LEU 27 HG LEU 27 -10.017 -0.367 1.839
202 HD11 LEU 27 HD11 LEU 27 -9.934 2.006 0.939
203 HD12 LEU 27 HD12 LEU 27 -8.248 1.711 0.519
204 HD13 LEU 27 HD13 LEU 27 -8.759 1.654 2.206
205 HD21 LEU 27 HD21 LEU 27 -9.291 -0.072 -1.097
206 HD22 LEU 27 HD22 LEU 27 -10.867 0.329 -0.416
207 HD23 LEU 27 HD23 LEU 27 -10.291 -1.339 -0.387
208 H PHE 28 H PHE 28 -7.146 -3.396 -0.684
209 HA PHE 28 HA PHE 28 -5.195 -4.973 0.757
210 HB2 PHE 28 HB2 PHE 28 -5.617 -4.391 -2.186
211 HB3 PHE 28 HB3 PHE 28 -4.351 -5.458 -1.572
212 HD1 PHE 28 HD1 PHE 28 -8.005 -4.976 -1.903
213 HD2 PHE 28 HD2 PHE 28 -4.868 -7.649 -0.693
214 HE1 PHE 28 HE1 PHE 28 -9.636 -6.841 -1.796
215 HE2 PHE 28 HE2 PHE 28 -6.500 -9.513 -0.584
216 HZ PHE 28 HZ PHE 28 -8.883 -9.110 -1.135
217 H VAL 29 H VAL 29 -3.217 -4.328 1.359
218 HA VAL 29 HA VAL 29 -1.976 -2.029 -0.012
219 HB VAL 29 HB VAL 29 -2.141 -2.442 2.989
220 HG11 VAL 29 HG11 VAL 29 -0.660 -0.411 1.300
221 HG12 VAL 29 HG12 VAL 29 0.023 -1.507 2.502
222 HG13 VAL 29 HG13 VAL 29 -1.000 -0.164 3.014
223 HG21 VAL 29 HG21 VAL 29 -3.357 -0.274 2.924
224 HG22 VAL 29 HG22 VAL 29 -4.204 -1.534 2.027
225 HG23 VAL 29 HG23 VAL 29 -3.280 -0.306 1.162
226 H HIS 30 H HIS 30 0.130 -2.328 -0.517
227 HA HIS 30 HA HIS 30 1.417 -4.816 0.427
228 HB2 HIS 30 HB2 HIS 30 1.777 -3.207 -2.106
229 HB3 HIS 30 HB3 HIS 30 2.830 -4.544 -1.642
230 HD2 HIS 30 HD2 HIS 30 1.756 -7.091 -2.108
231 HE1 HIS 30 HE1 HIS 30 -2.065 -5.820 -3.373
232 HE2 HIS 30 HE2 HIS 30 -0.530 -7.828 -3.129
233 H HIS 31 H HIS 31 3.634 -4.812 0.923
234 HA HIS 31 HA HIS 31 4.551 -2.633 2.480
235 HB2 HIS 31 HB2 HIS 31 5.253 -5.022 2.772
236 HB3 HIS 31 HB3 HIS 31 6.209 -4.878 1.297
237 HD2 HIS 31 HD2 HIS 31 6.426 -3.850 5.053
238 HE1 HIS 31 HE1 HIS 31 9.846 -2.309 3.120
239 HE2 HIS 31 HE2 HIS 31 8.747 -2.698 5.375
240 H SER 32 H SER 32 5.439 -3.773 -0.750
241 HA SER 32 HA SER 32 7.391 -1.750 -1.251
242 HB2 SER 32 HB2 SER 32 7.401 -2.609 -3.525
243 HB3 SER 32 HB3 SER 32 7.372 -3.949 -2.382
244 HG SER 32 HG SER 32 5.716 -4.515 -3.577
245 H GLU 33 H GLU 33 4.026 -1.517 -1.148
246 HA GLU 33 HA GLU 33 3.507 0.169 -3.370
247 HB2 GLU 33 HB2 GLU 33 1.800 -1.112 -2.036
248 HB3 GLU 33 HB3 GLU 33 1.991 0.084 -0.758
249 HG2 GLU 33 HG2 GLU 33 0.082 0.685 -2.145
250 HG3 GLU 33 HG3 GLU 33 1.362 1.872 -2.368
251 H ILE 34 H ILE 34 4.788 0.832 -0.160
252 HA ILE 34 HA ILE 34 4.272 3.665 -0.253
253 HB ILE 34 HB ILE 34 4.503 2.479 1.897
254 HG12 ILE 34 HG12 ILE 34 6.827 4.403 1.625
255 HG13 ILE 34 HG13 ILE 34 5.154 4.948 1.565
256 HG21 ILE 34 HG21 ILE 34 7.482 2.266 1.469
257 HG22 ILE 34 HG22 ILE 34 6.426 0.987 0.882
258 HG23 ILE 34 HG23 ILE 34 6.449 1.384 2.596
259 HD11 ILE 34 HD11 ILE 34 4.808 3.755 3.789
260 HD12 ILE 34 HD12 ILE 34 5.862 5.168 3.851
261 HD13 ILE 34 HD13 ILE 34 6.558 3.548 3.854
262 H GLN 35 H GLN 35 5.272 5.042 -1.547
263 HA GLN 35 HA GLN 35 7.568 4.432 -3.089
264 HB2 GLN 35 HB2 GLN 35 5.843 6.142 -3.691
265 HB3 GLN 35 HB3 GLN 35 6.466 7.171 -2.402
266 HG2 GLN 35 HG2 GLN 35 8.665 7.244 -3.479
267 HG3 GLN 35 HG3 GLN 35 8.108 6.141 -4.735
268 HE21 GLN 35 HE21 GLN 35 8.311 7.639 -6.501
269 HE22 GLN 35 HE22 GLN 35 7.347 9.031 -6.628
270 H SER 36 H SER 36 7.100 6.240 -0.079
271 HA SER 36 HA SER 36 9.855 5.781 0.699
272 HB2 SER 36 HB2 SER 36 10.436 8.118 0.990
273 HB3 SER 36 HB3 SER 36 9.985 7.848 -0.690
274 HG SER 36 HG SER 36 8.933 9.555 1.027
275 H GLY 37 H GLY 37 10.256 6.490 2.933
276 HA2 GLY 37 HA2 GLY 37 8.273 7.505 4.654
277 HA3 GLY 37 HA3 GLY 37 8.197 5.746 4.697
278 H GLY 38 H GLY 38 10.707 8.284 4.715
279 HA2 GLY 38 HA2 GLY 38 12.601 8.566 5.989
280 HA3 GLY 38 HA3 GLY 38 11.721 7.742 7.274
281 H GLU 39 H GLU 39 13.081 6.254 8.069
282 HA GLU 39 HA GLU 39 14.188 4.254 6.206
283 HB2 GLU 39 HB2 GLU 39 15.715 5.574 8.464
284 HB3 GLU 39 HB3 GLU 39 16.291 4.211 7.506
285 HG2 GLU 39 HG2 GLU 39 16.127 5.590 5.458
286 HG3 GLU 39 HG3 GLU 39 15.581 6.955 6.429
287 H TYR 40 H TYR 40 14.390 2.179 7.028
288 HA TYR 40 HA TYR 40 13.756 0.354 8.266
289 HB2 TYR 40 HB2 TYR 40 14.279 2.284 10.541
290 HB3 TYR 40 HB3 TYR 40 14.082 0.543 10.722
291 HD1 TYR 40 HD1 TYR 40 16.291 3.230 9.549
292 HD2 TYR 40 HD2 TYR 40 15.762 -1.023 9.825
293 HE1 TYR 40 HE1 TYR 40 18.686 2.897 9.000
294 HE2 TYR 40 HE2 TYR 40 18.160 -1.356 9.277
295 HH TYR 40 HH TYR 40 20.032 0.766 7.866
296 H ALA 41 H ALA 41 11.640 2.111 7.313
297 HA ALA 41 HA ALA 41 9.651 2.557 9.273
298 HB1 ALA 41 HB1 ALA 41 9.584 2.213 6.283
299 HB2 ALA 41 HB2 ALA 41 9.320 3.676 7.232
300 HB3 ALA 41 HB3 ALA 41 8.096 2.405 7.210
301 H THR 42 H THR 42 8.303 1.212 10.286
302 HA THR 42 HA THR 42 7.920 -1.519 9.211
303 HB THR 42 HB THR 42 7.962 -2.382 11.522
304 HG1 THR 42 HG1 THR 42 8.104 -1.071 13.155
305 HG21 THR 42 HG21 THR 42 10.029 -2.617 10.388
306 HG22 THR 42 HG22 THR 42 10.453 -1.902 11.944
307 HG23 THR 42 HG23 THR 42 10.380 -0.892 10.501
308 H LEU 43 H LEU 43 5.987 -2.594 9.976
309 HA LEU 43 HA LEU 43 3.885 -0.891 11.092
310 HB2 LEU 43 HB2 LEU 43 3.554 -2.374 8.471
311 HB3 LEU 43 HB3 LEU 43 2.284 -1.527 9.342
312 HG LEU 43 HG LEU 43 4.058 0.509 9.164
313 HD11 LEU 43 HD11 LEU 43 5.654 -1.059 7.894
314 HD12 LEU 43 HD12 LEU 43 5.321 0.498 7.145
315 HD13 LEU 43 HD13 LEU 43 4.519 -0.955 6.554
316 HD21 LEU 43 HD21 LEU 43 2.128 -0.411 7.012
317 HD22 LEU 43 HD22 LEU 43 2.864 1.190 7.046
318 HD23 LEU 43 HD23 LEU 43 1.789 0.687 8.350
319 H ALA 44 H ALA 44 2.135 -2.086 11.973
320 HA ALA 44 HA ALA 44 2.377 -5.005 12.076
321 HB1 ALA 44 HB1 ALA 44 3.759 -3.897 13.948
322 HB2 ALA 44 HB2 ALA 44 2.598 -5.132 14.436
323 HB3 ALA 44 HB3 ALA 44 2.208 -3.424 14.647
324 H ASP 45 H ASP 45 0.465 -5.049 14.417
325 HA ASP 45 HA ASP 45 -1.959 -4.641 12.873
326 HB2 ASP 45 HB2 ASP 45 -3.062 -5.787 14.765
327 HB3 ASP 45 HB3 ASP 45 -1.729 -6.725 14.106
328 H GLY 46 H GLY 46 -2.886 -2.713 12.854
329 HA2 GLY 46 HA2 GLY 46 -4.250 -1.100 13.995
330 HA3 GLY 46 HA3 GLY 46 -3.220 -1.274 15.407
331 H GLN 47 H GLN 47 -1.230 -1.128 12.712
332 HA GLN 47 HA GLN 47 -0.107 1.369 13.373
333 HB2 GLN 47 HB2 GLN 47 1.040 -0.479 12.118
334 HB3 GLN 47 HB3 GLN 47 0.060 -0.069 10.710
335 HG2 GLN 47 HG2 GLN 47 2.239 1.022 10.531
336 HG3 GLN 47 HG3 GLN 47 0.989 2.235 10.771
337 HE21 GLN 47 HE21 GLN 47 1.749 3.827 12.169
338 HE22 GLN 47 HE22 GLN 47 2.699 3.541 13.546
339 H THR 48 H THR 48 -0.623 3.401 12.822
340 HA THR 48 HA THR 48 -3.006 3.873 11.204
341 HB THR 48 HB THR 48 -1.227 5.835 12.688
342 HG1 THR 48 HG1 THR 48 -2.279 4.273 14.011
343 HG21 THR 48 HG21 THR 48 -4.094 6.193 11.790
344 HG22 THR 48 HG22 THR 48 -2.725 6.717 10.810
345 HG23 THR 48 HG23 THR 48 -2.990 7.424 12.405
346 H VAL 49 H VAL 49 -2.970 4.420 9.111
347 HA VAL 49 HA VAL 49 -0.564 5.709 8.009
348 HB VAL 49 HB VAL 49 -0.566 4.189 6.056
349 HG11 VAL 49 HG11 VAL 49 0.558 2.370 7.159
350 HG12 VAL 49 HG12 VAL 49 -0.333 2.651 8.654
351 HG13 VAL 49 HG13 VAL 49 0.869 3.822 8.109
352 HG21 VAL 49 HG21 VAL 49 -2.850 3.385 6.072
353 HG22 VAL 49 HG22 VAL 49 -2.654 2.715 7.692
354 HG23 VAL 49 HG23 VAL 49 -1.793 1.997 6.330
355 H GLU 50 H GLU 50 -0.888 6.472 5.768
356 HA GLU 50 HA GLU 50 -3.647 7.487 5.381
357 HB2 GLU 50 HB2 GLU 50 -1.030 8.653 4.361
358 HB3 GLU 50 HB3 GLU 50 -2.633 9.355 4.156
359 HG2 GLU 50 HG2 GLU 50 -2.833 9.584 6.617
360 HG3 GLU 50 HG3 GLU 50 -1.215 8.916 6.804
361 H TYR 51 H TYR 51 -4.588 7.125 3.334
362 HA TYR 51 HA TYR 51 -2.942 6.010 1.202
363 HB2 TYR 51 HB2 TYR 51 -4.272 3.965 0.967
364 HB3 TYR 51 HB3 TYR 51 -3.476 4.024 2.534
365 HD1 TYR 51 HD1 TYR 51 -6.697 4.331 0.760
366 HD2 TYR 51 HD2 TYR 51 -4.758 4.297 4.591
367 HE1 TYR 51 HE1 TYR 51 -8.901 4.100 1.872
368 HE2 TYR 51 HE2 TYR 51 -6.963 4.063 5.702
369 HH TYR 51 HH TYR 51 -9.928 4.493 4.008
370 H GLU 52 H GLU 52 -4.136 5.579 -0.773
371 HA GLU 52 HA GLU 52 -6.518 7.306 -1.081
372 HB2 GLU 52 HB2 GLU 52 -4.460 8.267 -2.136
373 HB3 GLU 52 HB3 GLU 52 -4.338 6.817 -3.132
374 HG2 GLU 52 HG2 GLU 52 -6.550 7.277 -4.105
375 HG3 GLU 52 HG3 GLU 52 -6.707 8.710 -3.089
376 H VAL 53 H VAL 53 -8.252 6.315 -1.900
377 HA VAL 53 HA VAL 53 -8.361 3.519 -2.260
378 HB VAL 53 HB VAL 53 -10.296 4.909 -1.596
379 HG11 VAL 53 HG11 VAL 53 -10.306 5.832 -4.486
380 HG12 VAL 53 HG12 VAL 53 -9.849 6.830 -3.105
381 HG13 VAL 53 HG13 VAL 53 -11.503 6.240 -3.258
382 HG21 VAL 53 HG21 VAL 53 -10.817 3.463 -4.211
383 HG22 VAL 53 HG22 VAL 53 -11.970 3.733 -2.902
384 HG23 VAL 53 HG23 VAL 53 -10.597 2.652 -2.661
385 H GLY 54 H GLY 54 -8.713 2.275 -4.110
386 HA2 GLY 54 HA2 GLY 54 -8.139 3.462 -6.736
387 HA3 GLY 54 HA3 GLY 54 -7.098 2.158 -6.164
388 H GLN 55 H GLN 55 -8.576 1.878 -8.509
389 HA GLN 55 HA GLN 55 -10.880 0.187 -7.794
390 HB2 GLN 55 HB2 GLN 55 -11.094 2.013 -9.536
391 HB3 GLN 55 HB3 GLN 55 -10.018 1.058 -10.557
392 HG2 GLN 55 HG2 GLN 55 -12.492 -0.181 -9.351
393 HG3 GLN 55 HG3 GLN 55 -12.587 0.748 -10.843
394 HE21 GLN 55 HE21 GLN 55 -12.954 -2.219 -10.423
395 HE22 GLN 55 HE22 GLN 55 -11.835 -2.954 -11.466
396 H GLY 56 H GLY 56 -10.800 -1.970 -7.933
397 HA2 GLY 56 HA2 GLY 56 -8.793 -3.270 -9.637
398 HA3 GLY 56 HA3 GLY 56 -8.767 -3.639 -7.917
399 H GLN 57 H GLN 57 -9.245 -5.475 -10.091
400 HA GLN 57 HA GLN 57 -11.986 -6.105 -10.427
401 HB2 GLN 57 HB2 GLN 57 -9.482 -7.781 -10.660
402 HB3 GLN 57 HB3 GLN 57 -11.088 -8.373 -11.083
403 HG2 GLN 57 HG2 GLN 57 -11.348 -6.532 -12.701
404 HG3 GLN 57 HG3 GLN 57 -9.745 -5.932 -12.276
405 HE21 GLN 57 HE21 GLN 57 -8.575 -6.378 -14.190
406 HE22 GLN 57 HE22 GLN 57 -8.434 -7.928 -14.865
407 H LYS 58 H LYS 58 -9.570 -7.135 -8.067
408 HA LYS 58 HA LYS 58 -11.462 -8.903 -6.713
409 HB2 LYS 58 HB2 LYS 58 -8.588 -8.207 -6.042
410 HB3 LYS 58 HB3 LYS 58 -9.555 -9.443 -5.243
411 HG2 LYS 58 HG2 LYS 58 -8.946 -9.450 -8.217
412 HG3 LYS 58 HG3 LYS 58 -7.998 -10.334 -7.023
413 HD2 LYS 58 HD2 LYS 58 -10.046 -11.571 -6.342
414 HD3 LYS 58 HD3 LYS 58 -10.953 -10.725 -7.597
415 HE2 LYS 58 HE2 LYS 58 -9.454 -11.658 -9.318
416 HE3 LYS 58 HE3 LYS 58 -8.547 -12.510 -8.067
417 HZ1 LYS 58 HZ1 LYS 58 -10.855 -13.451 -7.450
418 HZ2 LYS 58 HZ2 LYS 58 -10.027 -14.101 -8.784
419 HZ3 LYS 58 HZ3 LYS 58 -11.291 -12.990 -9.024
420 H GLY 59 H GLY 59 -11.726 -5.878 -6.815
421 HA2 GLY 59 HA2 GLY 59 -13.044 -4.710 -5.141
422 HA3 GLY 59 HA3 GLY 59 -12.030 -5.449 -3.904
423 HA PRO 60 HA PRO 60 -10.347 -1.207 -5.300
424 HB2 PRO 60 HB2 PRO 60 -10.765 0.228 -3.013
425 HB3 PRO 60 HB3 PRO 60 -11.945 0.142 -4.337
426 HG2 PRO 60 HG2 PRO 60 -11.875 -1.369 -1.767
427 HG3 PRO 60 HG3 PRO 60 -13.245 -0.612 -2.594
428 HD2 PRO 60 HD2 PRO 60 -12.770 -3.287 -2.732
429 HD3 PRO 60 HD3 PRO 60 -13.503 -2.384 -4.077
430 H CYS 61 H CYS 61 -8.334 -0.419 -4.763
431 HA CYS 61 HA CYS 61 -6.873 -1.855 -2.623
432 HB2 CYS 61 HB2 CYS 61 -6.250 -2.319 -5.059
433 HB3 CYS 61 HB3 CYS 61 -5.668 -0.657 -5.125
434 HG CYS 61 HG CYS 61 -3.605 -1.425 -4.009
435 H ALA 62 H ALA 62 -4.948 -0.568 -1.795
436 HA ALA 62 HA ALA 62 -5.529 2.329 -1.756
437 HB1 ALA 62 HB1 ALA 62 -4.354 1.895 0.675
438 HB2 ALA 62 HB2 ALA 62 -5.268 0.402 0.473
439 HB3 ALA 62 HB3 ALA 62 -6.098 1.955 0.418
440 H ASN 63 H ASN 63 -3.755 3.663 -1.960
441 HA ASN 63 HA ASN 63 -1.079 2.416 -1.955
442 HB2 ASN 63 HB2 ASN 63 -0.511 3.668 -4.014
443 HB3 ASN 63 HB3 ASN 63 -1.795 2.492 -4.285
444 HD21 ASN 63 HD21 ASN 63 -3.209 3.440 -5.769
445 HD22 ASN 63 HD22 ASN 63 -3.812 5.022 -5.650
446 H LYS 64 H LYS 64 0.588 4.370 -2.377
447 HA LYS 64 HA LYS 64 1.617 6.182 -1.410
448 HB2 LYS 64 HB2 LYS 64 -1.218 7.258 -1.267
449 HB3 LYS 64 HB3 LYS 64 0.248 8.211 -1.063
450 HG2 LYS 64 HG2 LYS 64 -0.357 6.615 -3.570
451 HG3 LYS 64 HG3 LYS 64 -0.788 8.312 -3.383
452 HD2 LYS 64 HD2 LYS 64 1.598 8.864 -2.979
453 HD3 LYS 64 HD3 LYS 64 2.018 7.167 -3.214
454 HE2 LYS 64 HE2 LYS 64 2.401 8.390 -5.294
455 HE3 LYS 64 HE3 LYS 64 1.048 7.277 -5.507
456 HZ1 LYS 64 HZ1 LYS 64 -0.481 8.986 -5.442
457 HZ2 LYS 64 HZ2 LYS 64 0.805 9.700 -6.291
458 HZ3 LYS 64 HZ3 LYS 64 0.569 10.054 -4.647
459 H VAL 65 H VAL 65 1.433 4.133 0.232
460 HA VAL 65 HA VAL 65 0.043 4.635 2.683
461 HB VAL 65 HB VAL 65 2.364 2.765 2.098
462 HG11 VAL 65 HG11 VAL 65 0.348 2.731 4.369
463 HG12 VAL 65 HG12 VAL 65 2.036 3.222 4.521
464 HG13 VAL 65 HG13 VAL 65 1.636 1.554 4.104
465 HG21 VAL 65 HG21 VAL 65 0.173 2.493 0.764
466 HG22 VAL 65 HG22 VAL 65 -0.567 2.036 2.297
467 HG23 VAL 65 HG23 VAL 65 0.761 1.079 1.638
468 H VAL 66 H VAL 66 0.554 6.129 4.086
469 HA VAL 66 HA VAL 66 3.408 6.822 4.530
470 HB VAL 66 HB VAL 66 1.019 8.694 4.704
471 HG11 VAL 66 HG11 VAL 66 2.750 9.264 6.348
472 HG12 VAL 66 HG12 VAL 66 2.748 10.448 5.041
473 HG13 VAL 66 HG13 VAL 66 3.988 9.195 5.094
474 HG21 VAL 66 HG21 VAL 66 3.290 8.463 2.706
475 HG22 VAL 66 HG22 VAL 66 2.196 9.843 2.795
476 HG23 VAL 66 HG23 VAL 66 1.571 8.245 2.384
477 H ALA 67 H ALA 67 4.083 6.282 6.500
478 HA ALA 67 HA ALA 67 2.289 5.351 8.528
479 HB1 ALA 67 HB1 ALA 67 4.488 4.360 8.327
480 HB2 ALA 67 HB2 ALA 67 4.369 5.159 9.895
481 HB3 ALA 67 HB3 ALA 67 5.260 5.926 8.580
482 H VAL 68 H VAL 68 1.489 6.355 10.272
483 HA VAL 68 HA VAL 68 2.580 8.902 11.182
484 HB VAL 68 HB VAL 68 0.380 10.047 11.071
485 HG11 VAL 68 HG11 VAL 68 2.141 10.284 9.290
486 HG12 VAL 68 HG12 VAL 68 0.502 10.590 8.720
487 HG13 VAL 68 HG13 VAL 68 1.288 9.054 8.356
488 HG21 VAL 68 HG21 VAL 68 -1.458 9.133 9.831
489 HG22 VAL 68 HG22 VAL 68 -0.934 7.855 10.926
490 HG23 VAL 68 HG23 VAL 68 -0.474 7.799 9.225
Start of MODEL 19
1 H1 MET 1 HT1 MET 1 -6.184 14.192 5.887
2 H2 MET 1 HT2 MET 1 -4.864 13.268 5.346
3 H3 MET 1 HT3 MET 1 -6.171 12.513 6.131
4 HA MET 1 HA MET 1 -7.614 13.348 4.257
5 HB2 MET 1 HB2 MET 1 -4.835 13.837 3.153
6 HB3 MET 1 HB3 MET 1 -6.272 13.714 2.138
7 HG2 MET 1 HG2 MET 1 -7.308 15.552 3.522
8 HG3 MET 1 HG3 MET 1 -5.747 15.751 4.317
9 HE1 MET 1 HE1 MET 1 -3.714 16.481 3.416
10 HE2 MET 1 HE2 MET 1 -3.363 17.073 1.793
11 HE3 MET 1 HE3 MET 1 -3.557 15.343 2.070
12 H SER 2 H SER 2 -8.418 11.354 4.043
13 HA SER 2 HA SER 2 -8.605 9.112 3.589
14 HB2 SER 2 HB2 SER 2 -7.745 10.178 1.360
15 HB3 SER 2 HB3 SER 2 -6.245 9.345 1.751
16 HG SER 2 HG SER 2 -7.344 7.824 0.696
17 H LYS 3 H LYS 3 -8.008 8.328 5.600
18 HA LYS 3 HA LYS 3 -5.601 6.735 5.657
19 HB2 LYS 3 HB2 LYS 3 -4.639 7.752 7.671
20 HB3 LYS 3 HB3 LYS 3 -4.700 8.913 6.349
21 HG2 LYS 3 HG2 LYS 3 -6.780 9.874 7.294
22 HG3 LYS 3 HG3 LYS 3 -6.690 8.726 8.631
23 HD2 LYS 3 HD2 LYS 3 -4.472 9.655 9.256
24 HD3 LYS 3 HD3 LYS 3 -4.625 10.842 7.960
25 HE2 LYS 3 HE2 LYS 3 -6.570 10.544 10.268
26 HE3 LYS 3 HE3 LYS 3 -5.304 11.768 10.170
27 HZ1 LYS 3 HZ1 LYS 3 -6.322 12.525 8.071
28 HZ2 LYS 3 HZ2 LYS 3 -7.353 12.702 9.409
29 HZ3 LYS 3 HZ3 LYS 3 -7.593 11.429 8.311
30 H GLY 4 H GLY 4 -5.655 5.121 7.228
31 HA2 GLY 4 HA2 GLY 4 -7.950 5.043 9.061
32 HA3 GLY 4 HA3 GLY 4 -7.784 3.747 7.880
33 H ILE 5 H ILE 5 -7.710 2.423 9.872
34 HA ILE 5 HA ILE 5 -4.974 2.345 11.009
35 HB ILE 5 HB ILE 5 -6.038 1.112 12.943
36 HG12 ILE 5 HG12 ILE 5 -8.639 2.301 11.941
37 HG13 ILE 5 HG13 ILE 5 -8.192 0.637 11.581
38 HG21 ILE 5 HG21 ILE 5 -6.896 3.964 12.372
39 HG22 ILE 5 HG22 ILE 5 -5.389 3.454 13.135
40 HG23 ILE 5 HG23 ILE 5 -6.926 3.211 13.967
41 HD11 ILE 5 HD11 ILE 5 -7.959 0.196 14.018
42 HD12 ILE 5 HD12 ILE 5 -9.591 0.709 13.595
43 HD13 ILE 5 HD13 ILE 5 -8.476 1.849 14.348
44 H VAL 6 H VAL 6 -3.802 0.620 10.625
45 HA VAL 6 HA VAL 6 -4.712 -1.371 8.830
46 HB VAL 6 HB VAL 6 -2.180 -1.281 10.490
47 HG11 VAL 6 HG11 VAL 6 -2.366 -3.525 9.754
48 HG12 VAL 6 HG12 VAL 6 -1.369 -2.762 8.516
49 HG13 VAL 6 HG13 VAL 6 -3.081 -3.052 8.214
50 HG21 VAL 6 HG21 VAL 6 -2.523 -0.586 7.563
51 HG22 VAL 6 HG22 VAL 6 -1.152 -0.226 8.613
52 HG23 VAL 6 HG23 VAL 6 -2.679 0.627 8.832
53 H LYS 7 H LYS 7 -5.809 -3.130 9.210
54 HA LYS 7 HA LYS 7 -6.566 -4.019 11.806
55 HB2 LYS 7 HB2 LYS 7 -7.930 -4.414 9.757
56 HB3 LYS 7 HB3 LYS 7 -6.689 -5.518 9.167
57 HG2 LYS 7 HG2 LYS 7 -7.027 -6.968 11.129
58 HG3 LYS 7 HG3 LYS 7 -8.253 -5.859 11.746
59 HD2 LYS 7 HD2 LYS 7 -9.620 -6.241 9.729
60 HD3 LYS 7 HD3 LYS 7 -8.396 -7.350 9.109
61 HE2 LYS 7 HE2 LYS 7 -8.718 -8.810 11.067
62 HE3 LYS 7 HE3 LYS 7 -9.934 -7.702 11.697
63 HZ1 LYS 7 HZ1 LYS 7 -10.177 -8.869 8.997
64 HZ2 LYS 7 HZ2 LYS 7 -11.390 -8.193 9.975
65 HZ3 LYS 7 HZ3 LYS 7 -10.727 -9.707 10.365
66 H TRP 8 H TRP 8 -4.261 -5.193 9.380
67 HA TRP 8 HA TRP 8 -2.472 -6.226 11.380
68 HB2 TRP 8 HB2 TRP 8 -4.351 -7.996 11.065
69 HB3 TRP 8 HB3 TRP 8 -3.613 -8.286 9.492
70 HD1 TRP 8 HD1 TRP 8 -0.971 -9.030 9.533
71 HE1 TRP 8 HE1 TRP 8 0.300 -10.449 11.270
72 HE3 TRP 8 HE3 TRP 8 -4.173 -8.657 13.492
73 HZ2 TRP 8 HZ2 TRP 8 -0.005 -11.319 13.978
74 HZ3 TRP 8 HZ3 TRP 8 -3.662 -9.793 15.634
75 HH2 TRP 8 HH2 TRP 8 -1.584 -11.122 15.883
76 H PHE 9 H PHE 9 -0.438 -6.046 10.567
77 HA PHE 9 HA PHE 9 -0.168 -5.903 7.606
78 HB2 PHE 9 HB2 PHE 9 0.370 -3.797 8.963
79 HB3 PHE 9 HB3 PHE 9 1.769 -4.683 9.576
80 HD1 PHE 9 HD1 PHE 9 0.321 -2.945 6.724
81 HD2 PHE 9 HD2 PHE 9 3.506 -5.542 7.976
82 HE1 PHE 9 HE1 PHE 9 1.547 -2.448 4.629
83 HE2 PHE 9 HE2 PHE 9 4.734 -5.039 5.879
84 HZ PHE 9 HZ PHE 9 3.756 -3.495 4.208
85 H ASN 10 H ASN 10 0.963 -7.492 6.674
86 HA ASN 10 HA ASN 10 2.919 -8.988 8.328
87 HB2 ASN 10 HB2 ASN 10 1.101 -10.055 6.156
88 HB3 ASN 10 HB3 ASN 10 2.353 -10.985 6.977
89 HD21 ASN 10 HD21 ASN 10 -0.822 -10.940 7.002
90 HD22 ASN 10 HD22 ASN 10 -1.163 -11.054 8.661
91 H SER 11 H SER 11 4.727 -7.831 7.645
92 HA SER 11 HA SER 11 5.338 -7.135 4.997
93 HB2 SER 11 HB2 SER 11 7.155 -7.672 7.355
94 HB3 SER 11 HB3 SER 11 7.673 -6.939 5.840
95 HG SER 11 HG SER 11 6.837 -5.131 6.483
96 H ASP 12 H ASP 12 6.042 -10.061 6.879
97 HA ASP 12 HA ASP 12 7.859 -11.285 5.122
98 HB2 ASP 12 HB2 ASP 12 5.811 -12.471 7.009
99 HB3 ASP 12 HB3 ASP 12 6.981 -13.447 6.124
100 H LYS 13 H LYS 13 4.315 -11.355 5.220
101 HA LYS 13 HA LYS 13 4.035 -13.060 2.922
102 HB2 LYS 13 HB2 LYS 13 2.095 -11.246 4.373
103 HB3 LYS 13 HB3 LYS 13 1.640 -12.289 3.027
104 HG2 LYS 13 HG2 LYS 13 2.426 -14.262 4.279
105 HG3 LYS 13 HG3 LYS 13 2.880 -13.222 5.632
106 HD2 LYS 13 HD2 LYS 13 0.524 -12.493 5.852
107 HD3 LYS 13 HD3 LYS 13 0.076 -13.560 4.517
108 HE2 LYS 13 HE2 LYS 13 1.362 -14.480 7.107
109 HE3 LYS 13 HE3 LYS 13 -0.359 -14.592 6.744
110 HZ1 LYS 13 HZ1 LYS 13 0.562 -15.774 4.607
111 HZ2 LYS 13 HZ2 LYS 13 0.325 -16.632 6.056
112 HZ3 LYS 13 HZ3 LYS 13 1.881 -16.102 5.622
113 H GLY 14 H GLY 14 4.354 -9.649 3.522
114 HA2 GLY 14 HA2 GLY 14 5.116 -8.054 1.957
115 HA3 GLY 14 HA3 GLY 14 4.602 -9.114 0.654
116 H PHE 15 H PHE 15 2.151 -8.887 2.986
117 HA PHE 15 HA PHE 15 0.976 -6.428 2.010
118 HB2 PHE 15 HB2 PHE 15 -1.058 -7.475 1.095
119 HB3 PHE 15 HB3 PHE 15 0.378 -7.912 0.174
120 HD1 PHE 15 HD1 PHE 15 -2.171 -9.109 2.564
121 HD2 PHE 15 HD2 PHE 15 1.240 -10.184 0.184
122 HE1 PHE 15 HE1 PHE 15 -2.682 -11.510 2.915
123 HE2 PHE 15 HE2 PHE 15 0.731 -12.585 0.538
124 HZ PHE 15 HZ PHE 15 -1.231 -13.249 1.904
125 H GLY 16 H GLY 16 -1.311 -6.181 2.879
126 HA2 GLY 16 HA2 GLY 16 -1.968 -7.631 5.288
127 HA3 GLY 16 HA3 GLY 16 -1.367 -6.003 5.588
128 H PHE 17 H PHE 17 -3.814 -6.383 6.453
129 HA PHE 17 HA PHE 17 -5.618 -5.225 4.404
130 HB2 PHE 17 HB2 PHE 17 -6.277 -6.948 6.810
131 HB3 PHE 17 HB3 PHE 17 -7.473 -6.173 5.774
132 HD1 PHE 17 HD1 PHE 17 -4.892 -8.800 5.980
133 HD2 PHE 17 HD2 PHE 17 -7.888 -6.963 3.511
134 HE1 PHE 17 HE1 PHE 17 -4.769 -10.714 4.407
135 HE2 PHE 17 HE2 PHE 17 -7.764 -8.875 1.939
136 HZ PHE 17 HZ PHE 17 -6.204 -10.750 2.386
137 H ILE 18 H ILE 18 -6.588 -3.292 4.885
138 HA ILE 18 HA ILE 18 -6.034 -2.188 7.563
139 HB ILE 18 HB ILE 18 -4.787 -1.034 5.786
140 HG12 ILE 18 HG12 ILE 18 -7.008 0.795 6.718
141 HG13 ILE 18 HG13 ILE 18 -5.804 0.158 7.838
142 HG21 ILE 18 HG21 ILE 18 -6.218 0.404 4.199
143 HG22 ILE 18 HG22 ILE 18 -7.556 -0.659 4.635
144 HG23 ILE 18 HG23 ILE 18 -6.126 -1.321 3.847
145 HD11 ILE 18 HD11 ILE 18 -5.048 1.606 5.289
146 HD12 ILE 18 HD12 ILE 18 -4.011 1.223 6.664
147 HD13 ILE 18 HD13 ILE 18 -5.275 2.443 6.824
148 H THR 19 H THR 19 -7.567 -1.006 8.623
149 HA THR 19 HA THR 19 -10.323 -1.553 7.791
150 HB THR 19 HB THR 19 -9.239 -0.770 10.500
151 HG1 THR 19 HG1 THR 19 -9.986 -3.261 9.375
152 HG21 THR 19 HG21 THR 19 -11.628 -0.187 10.122
153 HG22 THR 19 HG22 THR 19 -11.444 -1.467 11.322
154 HG23 THR 19 HG23 THR 19 -11.948 -1.863 9.679
155 HA PRO 20 HA PRO 20 -10.268 2.942 6.701
156 HB2 PRO 20 HB2 PRO 20 -13.146 2.208 6.295
157 HB3 PRO 20 HB3 PRO 20 -12.091 3.188 5.262
158 HG2 PRO 20 HG2 PRO 20 -12.640 0.732 4.564
159 HG3 PRO 20 HG3 PRO 20 -10.977 1.329 4.427
160 HD2 PRO 20 HD2 PRO 20 -12.155 -0.490 6.507
161 HD3 PRO 20 HD3 PRO 20 -10.556 -0.553 5.727
162 H GLU 21 H GLU 21 -10.538 4.568 8.155
163 HA GLU 21 HA GLU 21 -11.684 4.160 10.706
164 HB2 GLU 21 HB2 GLU 21 -11.325 6.570 11.045
165 HB3 GLU 21 HB3 GLU 21 -9.913 5.813 10.310
166 HG2 GLU 21 HG2 GLU 21 -10.690 6.583 8.075
167 HG3 GLU 21 HG3 GLU 21 -12.056 7.384 8.840
168 H ASP 22 H ASP 22 -13.012 5.370 7.711
169 HA ASP 22 HA ASP 22 -15.369 6.567 8.796
170 HB2 ASP 22 HB2 ASP 22 -14.649 5.588 6.031
171 HB3 ASP 22 HB3 ASP 22 -16.188 6.355 6.404
172 H GLY 23 H GLY 23 -14.442 3.297 8.205
173 HA2 GLY 23 HA2 GLY 23 -15.703 1.481 9.160
174 HA3 GLY 23 HA3 GLY 23 -17.177 2.388 8.844
175 H SER 24 H SER 24 -15.032 2.620 6.234
176 HA SER 24 HA SER 24 -16.726 1.123 4.491
177 HB2 SER 24 HB2 SER 24 -14.003 2.363 4.047
178 HB3 SER 24 HB3 SER 24 -15.012 1.679 2.782
179 HG SER 24 HG SER 24 -15.305 4.019 4.257
180 H LYS 25 H LYS 25 -15.877 -0.564 3.041
181 HA LYS 25 HA LYS 25 -15.023 -2.835 4.436
182 HB2 LYS 25 HB2 LYS 25 -16.322 -2.872 2.315
183 HB3 LYS 25 HB3 LYS 25 -14.887 -2.328 1.451
184 HG2 LYS 25 HG2 LYS 25 -14.994 -4.719 1.191
185 HG3 LYS 25 HG3 LYS 25 -13.694 -4.389 2.333
186 HD2 LYS 25 HD2 LYS 25 -15.169 -4.909 4.217
187 HD3 LYS 25 HD3 LYS 25 -16.526 -5.148 3.116
188 HE2 LYS 25 HE2 LYS 25 -15.326 -7.013 2.036
189 HE3 LYS 25 HE3 LYS 25 -13.965 -6.775 3.134
190 HZ1 LYS 25 HZ1 LYS 25 -16.648 -7.153 4.261
191 HZ2 LYS 25 HZ2 LYS 25 -15.134 -7.570 4.910
192 HZ3 LYS 25 HZ3 LYS 25 -15.817 -8.509 3.671
193 H ASP 26 H ASP 26 -13.078 -3.876 4.653
194 HA ASP 26 HA ASP 26 -10.730 -2.426 4.851
195 HB2 ASP 26 HB2 ASP 26 -11.061 -5.396 4.393
196 HB3 ASP 26 HB3 ASP 26 -9.591 -4.615 4.971
197 H LEU 27 H LEU 27 -8.954 -2.107 3.594
198 HA LEU 27 HA LEU 27 -9.227 -2.761 0.719
199 HB2 LEU 27 HB2 LEU 27 -7.779 -0.443 2.028
200 HB3 LEU 27 HB3 LEU 27 -7.857 -0.753 0.297
201 HG LEU 27 HG LEU 27 -10.308 -0.311 2.036
202 HD11 LEU 27 HD11 LEU 27 -8.739 1.613 0.292
203 HD12 LEU 27 HD12 LEU 27 -8.995 1.732 2.034
204 HD13 LEU 27 HD13 LEU 27 -10.352 1.946 0.924
205 HD21 LEU 27 HD21 LEU 27 -9.845 -0.401 -0.965
206 HD22 LEU 27 HD22 LEU 27 -11.347 0.150 -0.221
207 HD23 LEU 27 HD23 LEU 27 -10.819 -1.519 -0.010
208 H PHE 28 H PHE 28 -7.401 -3.447 -0.427
209 HA PHE 28 HA PHE 28 -5.460 -4.934 1.116
210 HB2 PHE 28 HB2 PHE 28 -5.845 -4.487 -1.853
211 HB3 PHE 28 HB3 PHE 28 -4.541 -5.473 -1.185
212 HD1 PHE 28 HD1 PHE 28 -8.204 -5.171 -1.592
213 HD2 PHE 28 HD2 PHE 28 -4.980 -7.633 -0.183
214 HE1 PHE 28 HE1 PHE 28 -9.755 -7.097 -1.410
215 HE2 PHE 28 HE2 PHE 28 -6.530 -9.559 0.000
216 HZ PHE 28 HZ PHE 28 -8.916 -9.292 -0.613
217 H VAL 29 H VAL 29 -3.421 -4.343 1.619
218 HA VAL 29 HA VAL 29 -2.258 -1.969 0.306
219 HB VAL 29 HB VAL 29 -2.294 -2.542 3.282
220 HG11 VAL 29 HG11 VAL 29 -0.176 -1.537 2.772
221 HG12 VAL 29 HG12 VAL 29 -1.203 -0.239 3.380
222 HG13 VAL 29 HG13 VAL 29 -0.921 -0.403 1.649
223 HG21 VAL 29 HG21 VAL 29 -4.393 -1.582 2.165
224 HG22 VAL 29 HG22 VAL 29 -3.427 -0.146 1.829
225 HG23 VAL 29 HG23 VAL 29 -3.717 -0.643 3.496
226 H HIS 30 H HIS 30 -0.162 -2.215 -0.293
227 HA HIS 30 HA HIS 30 1.202 -4.711 0.520
228 HB2 HIS 30 HB2 HIS 30 1.571 -3.009 -1.958
229 HB3 HIS 30 HB3 HIS 30 2.522 -4.441 -1.566
230 HD2 HIS 30 HD2 HIS 30 -0.745 -3.592 -3.353
231 HE1 HIS 30 HE1 HIS 30 -0.972 -7.707 -2.433
232 HE2 HIS 30 HE2 HIS 30 -2.036 -5.826 -3.767
233 H HIS 31 H HIS 31 3.302 -4.682 1.191
234 HA HIS 31 HA HIS 31 4.216 -2.426 2.648
235 HB2 HIS 31 HB2 HIS 31 4.808 -4.811 3.165
236 HB3 HIS 31 HB3 HIS 31 5.853 -4.814 1.745
237 HD2 HIS 31 HD2 HIS 31 5.872 -3.473 5.411
238 HE1 HIS 31 HE1 HIS 31 9.479 -2.249 3.594
239 HE2 HIS 31 HE2 HIS 31 8.215 -2.390 5.792
240 H SER 32 H SER 32 5.309 -3.826 -0.433
241 HA SER 32 HA SER 32 7.399 -1.982 -0.911
242 HB2 SER 32 HB2 SER 32 5.811 -3.712 -2.807
243 HB3 SER 32 HB3 SER 32 7.244 -2.797 -3.272
244 HG SER 32 HG SER 32 7.144 -4.673 -1.140
245 H GLU 33 H GLU 33 4.006 -1.568 -1.188
246 HA GLU 33 HA GLU 33 3.929 0.297 -3.333
247 HB2 GLU 33 HB2 GLU 33 1.979 -1.015 -2.433
248 HB3 GLU 33 HB3 GLU 33 1.965 0.078 -1.052
249 HG2 GLU 33 HG2 GLU 33 0.356 0.845 -2.719
250 HG3 GLU 33 HG3 GLU 33 1.678 2.002 -2.600
251 H ILE 34 H ILE 34 4.705 0.657 0.066
252 HA ILE 34 HA ILE 34 4.067 3.313 0.538
253 HB ILE 34 HB ILE 34 5.818 3.370 2.223
254 HG12 ILE 34 HG12 ILE 34 6.859 0.749 1.093
255 HG13 ILE 34 HG13 ILE 34 7.597 2.301 0.753
256 HG21 ILE 34 HG21 ILE 34 5.306 1.090 3.340
257 HG22 ILE 34 HG22 ILE 34 4.298 0.780 1.929
258 HG23 ILE 34 HG23 ILE 34 3.947 2.154 2.977
259 HD11 ILE 34 HD11 ILE 34 7.375 0.901 3.420
260 HD12 ILE 34 HD12 ILE 34 7.757 2.619 3.292
261 HD13 ILE 34 HD13 ILE 34 8.837 1.420 2.579
262 H GLN 35 H GLN 35 4.930 5.288 0.078
263 HA GLN 35 HA GLN 35 7.247 5.352 -1.769
264 HB2 GLN 35 HB2 GLN 35 4.695 6.965 -1.856
265 HB3 GLN 35 HB3 GLN 35 6.138 7.388 -2.777
266 HG2 GLN 35 HG2 GLN 35 6.087 5.271 -3.952
267 HG3 GLN 35 HG3 GLN 35 4.782 4.682 -2.928
268 HE21 GLN 35 HE21 GLN 35 4.805 5.087 -5.917
269 HE22 GLN 35 HE22 GLN 35 3.510 6.136 -6.234
270 H SER 36 H SER 36 6.830 5.832 1.269
271 HA SER 36 HA SER 36 7.256 8.567 1.823
272 HB2 SER 36 HB2 SER 36 8.035 7.799 4.013
273 HB3 SER 36 HB3 SER 36 6.588 6.920 3.531
274 HG SER 36 HG SER 36 8.770 5.844 4.291
275 H GLY 37 H GLY 37 9.483 5.932 1.059
276 HA2 GLY 37 HA2 GLY 37 11.652 6.007 0.256
277 HA3 GLY 37 HA3 GLY 37 11.537 7.764 0.225
278 H GLY 38 H GLY 38 13.814 7.513 1.012
279 HA2 GLY 38 HA2 GLY 38 15.384 7.722 2.679
280 HA3 GLY 38 HA3 GLY 38 14.047 8.217 3.714
281 H GLU 39 H GLU 39 14.157 7.087 5.537
282 HA GLU 39 HA GLU 39 15.319 4.498 5.779
283 HB2 GLU 39 HB2 GLU 39 13.553 6.089 7.655
284 HB3 GLU 39 HB3 GLU 39 14.329 4.564 8.085
285 HG2 GLU 39 HG2 GLU 39 15.844 6.187 8.874
286 HG3 GLU 39 HG3 GLU 39 16.535 5.701 7.330
287 H TYR 40 H TYR 40 14.291 2.515 6.292
288 HA TYR 40 HA TYR 40 11.980 1.944 4.729
289 HB2 TYR 40 HB2 TYR 40 13.416 0.315 6.835
290 HB3 TYR 40 HB3 TYR 40 12.123 -0.307 5.812
291 HD1 TYR 40 HD1 TYR 40 15.620 0.813 5.915
292 HD2 TYR 40 HD2 TYR 40 12.438 -0.583 3.390
293 HE1 TYR 40 HE1 TYR 40 17.252 0.380 4.099
294 HE2 TYR 40 HE2 TYR 40 14.070 -1.016 1.573
295 HH TYR 40 HH TYR 40 16.390 -1.371 1.234
296 H ALA 41 H ALA 41 9.890 1.527 5.324
297 HA ALA 41 HA ALA 41 9.059 2.609 7.919
298 HB1 ALA 41 HB1 ALA 41 8.055 3.256 5.599
299 HB2 ALA 41 HB2 ALA 41 6.966 3.002 6.964
300 HB3 ALA 41 HB3 ALA 41 7.173 1.737 5.752
301 H THR 42 H THR 42 8.020 1.445 9.449
302 HA THR 42 HA THR 42 7.773 -1.468 8.998
303 HB THR 42 HB THR 42 9.413 -0.923 10.728
304 HG1 THR 42 HG1 THR 42 8.616 -2.324 12.153
305 HG21 THR 42 HG21 THR 42 8.607 1.272 11.424
306 HG22 THR 42 HG22 THR 42 8.660 0.203 12.827
307 HG23 THR 42 HG23 THR 42 7.119 0.559 12.047
308 H LEU 43 H LEU 43 5.892 -2.521 9.561
309 HA LEU 43 HA LEU 43 3.680 -0.944 10.672
310 HB2 LEU 43 HB2 LEU 43 3.590 -2.434 8.048
311 HB3 LEU 43 HB3 LEU 43 2.152 -1.935 8.927
312 HG LEU 43 HG LEU 43 3.433 0.445 8.884
313 HD11 LEU 43 HD11 LEU 43 5.330 -0.784 7.551
314 HD12 LEU 43 HD12 LEU 43 4.804 0.808 7.014
315 HD13 LEU 43 HD13 LEU 43 4.234 -0.638 6.181
316 HD21 LEU 43 HD21 LEU 43 2.186 0.890 6.683
317 HD22 LEU 43 HD22 LEU 43 1.218 0.252 8.013
318 HD23 LEU 43 HD23 LEU 43 1.741 -0.818 6.711
319 H ALA 44 H ALA 44 2.090 -2.179 11.694
320 HA ALA 44 HA ALA 44 2.407 -5.084 11.836
321 HB1 ALA 44 HB1 ALA 44 2.758 -5.162 14.183
322 HB2 ALA 44 HB2 ALA 44 2.351 -3.458 14.383
323 HB3 ALA 44 HB3 ALA 44 3.868 -3.916 13.608
324 H ASP 45 H ASP 45 0.640 -5.187 14.250
325 HA ASP 45 HA ASP 45 -1.896 -4.843 12.874
326 HB2 ASP 45 HB2 ASP 45 -1.427 -6.897 14.158
327 HB3 ASP 45 HB3 ASP 45 -1.238 -5.942 15.621
328 H GLY 46 H GLY 46 -2.802 -2.860 12.905
329 HA2 GLY 46 HA2 GLY 46 -4.126 -1.281 14.141
330 HA3 GLY 46 HA3 GLY 46 -3.030 -1.477 15.500
331 H GLN 47 H GLN 47 -1.101 -1.274 12.801
332 HA GLN 47 HA GLN 47 -0.033 1.251 13.443
333 HB2 GLN 47 HB2 GLN 47 1.160 -0.576 12.222
334 HB3 GLN 47 HB3 GLN 47 0.171 -0.229 10.807
335 HG2 GLN 47 HG2 GLN 47 2.329 0.910 10.607
336 HG3 GLN 47 HG3 GLN 47 1.046 2.092 10.790
337 HE21 GLN 47 HE21 GLN 47 1.736 3.752 12.149
338 HE22 GLN 47 HE22 GLN 47 2.689 3.541 13.537
339 H THR 48 H THR 48 -0.607 3.262 12.904
340 HA THR 48 HA THR 48 -2.956 3.686 11.220
341 HB THR 48 HB THR 48 -1.274 5.670 12.791
342 HG1 THR 48 HG1 THR 48 -2.622 5.296 14.413
343 HG21 THR 48 HG21 THR 48 -2.615 6.686 10.964
344 HG22 THR 48 HG22 THR 48 -3.224 7.148 12.553
345 HG23 THR 48 HG23 THR 48 -4.062 5.913 11.614
346 H VAL 49 H VAL 49 -2.854 4.293 9.139
347 HA VAL 49 HA VAL 49 -0.418 5.621 8.143
348 HB VAL 49 HB VAL 49 -0.341 4.130 6.169
349 HG11 VAL 49 HG11 VAL 49 0.997 3.763 8.311
350 HG12 VAL 49 HG12 VAL 49 0.806 2.354 7.270
351 HG13 VAL 49 HG13 VAL 49 -0.181 2.516 8.722
352 HG21 VAL 49 HG21 VAL 49 -2.694 3.347 6.226
353 HG22 VAL 49 HG22 VAL 49 -2.366 2.481 7.727
354 HG23 VAL 49 HG23 VAL 49 -1.572 1.988 6.232
355 H GLU 50 H GLU 50 -0.679 6.429 5.908
356 HA GLU 50 HA GLU 50 -3.457 7.354 5.431
357 HB2 GLU 50 HB2 GLU 50 -0.883 8.697 4.546
358 HB3 GLU 50 HB3 GLU 50 -2.513 9.321 4.343
359 HG2 GLU 50 HG2 GLU 50 -2.763 9.409 6.817
360 HG3 GLU 50 HG3 GLU 50 -1.102 8.851 6.987
361 H TYR 51 H TYR 51 -4.296 7.016 3.386
362 HA TYR 51 HA TYR 51 -2.592 6.087 1.217
363 HB2 TYR 51 HB2 TYR 51 -3.814 3.964 0.916
364 HB3 TYR 51 HB3 TYR 51 -2.953 4.006 2.448
365 HD1 TYR 51 HD1 TYR 51 -6.261 4.099 0.832
366 HD2 TYR 51 HD2 TYR 51 -4.159 4.191 4.575
367 HE1 TYR 51 HE1 TYR 51 -8.387 3.687 2.036
368 HE2 TYR 51 HE2 TYR 51 -6.286 3.777 5.779
369 HH TYR 51 HH TYR 51 -9.207 4.256 4.570
370 H GLU 52 H GLU 52 -3.804 5.644 -0.770
371 HA GLU 52 HA GLU 52 -6.321 7.194 -0.937
372 HB2 GLU 52 HB2 GLU 52 -4.036 7.055 -2.919
373 HB3 GLU 52 HB3 GLU 52 -5.612 7.763 -3.278
374 HG2 GLU 52 HG2 GLU 52 -5.325 9.363 -1.429
375 HG3 GLU 52 HG3 GLU 52 -3.764 8.651 -1.041
376 H VAL 53 H VAL 53 -7.985 6.206 -1.926
377 HA VAL 53 HA VAL 53 -7.947 3.411 -2.336
378 HB VAL 53 HB VAL 53 -9.966 4.693 -1.696
379 HG11 VAL 53 HG11 VAL 53 -10.110 5.617 -4.574
380 HG12 VAL 53 HG12 VAL 53 -9.457 6.624 -3.281
381 HG13 VAL 53 HG13 VAL 53 -11.140 6.101 -3.226
382 HG21 VAL 53 HG21 VAL 53 -11.535 3.433 -3.011
383 HG22 VAL 53 HG22 VAL 53 -10.082 2.442 -2.869
384 HG23 VAL 53 HG23 VAL 53 -10.408 3.322 -4.363
385 H GLY 54 H GLY 54 -8.197 2.196 -4.214
386 HA2 GLY 54 HA2 GLY 54 -7.668 3.434 -6.818
387 HA3 GLY 54 HA3 GLY 54 -6.518 2.226 -6.241
388 H GLN 55 H GLN 55 -7.831 1.661 -8.575
389 HA GLN 55 HA GLN 55 -9.989 -0.208 -7.801
390 HB2 GLN 55 HB2 GLN 55 -10.703 -0.106 -10.163
391 HB3 GLN 55 HB3 GLN 55 -10.707 1.487 -9.406
392 HG2 GLN 55 HG2 GLN 55 -8.472 1.939 -10.410
393 HG3 GLN 55 HG3 GLN 55 -8.544 0.376 -11.223
394 HE21 GLN 55 HE21 GLN 55 -9.046 3.593 -11.817
395 HE22 GLN 55 HE22 GLN 55 -10.227 3.478 -13.030
396 H GLY 56 H GLY 56 -10.029 -2.306 -8.622
397 HA2 GLY 56 HA2 GLY 56 -7.905 -3.369 -10.251
398 HA3 GLY 56 HA3 GLY 56 -7.758 -3.827 -8.557
399 H GLN 57 H GLN 57 -8.111 -5.742 -10.514
400 HA GLN 57 HA GLN 57 -10.791 -6.516 -10.998
401 HB2 GLN 57 HB2 GLN 57 -8.210 -8.083 -10.959
402 HB3 GLN 57 HB3 GLN 57 -9.756 -8.774 -11.449
403 HG2 GLN 57 HG2 GLN 57 -9.982 -7.048 -13.192
404 HG3 GLN 57 HG3 GLN 57 -8.444 -6.346 -12.699
405 HE21 GLN 57 HE21 GLN 57 -7.125 -6.845 -14.502
406 HE22 GLN 57 HE22 GLN 57 -6.865 -8.423 -15.069
407 H LYS 58 H LYS 58 -8.512 -7.304 -8.414
408 HA LYS 58 HA LYS 58 -10.425 -9.088 -7.117
409 HB2 LYS 58 HB2 LYS 58 -7.611 -8.250 -6.391
410 HB3 LYS 58 HB3 LYS 58 -8.587 -9.376 -5.444
411 HG2 LYS 58 HG2 LYS 58 -8.796 -10.853 -7.413
412 HG3 LYS 58 HG3 LYS 58 -7.811 -9.734 -8.354
413 HD2 LYS 58 HD2 LYS 58 -5.938 -10.058 -6.773
414 HD3 LYS 58 HD3 LYS 58 -6.920 -11.199 -5.853
415 HE2 LYS 58 HE2 LYS 58 -6.171 -11.526 -8.775
416 HE3 LYS 58 HE3 LYS 58 -5.373 -12.345 -7.433
417 HZ1 LYS 58 HZ1 LYS 58 -6.995 -13.814 -8.303
418 HZ2 LYS 58 HZ2 LYS 58 -8.200 -12.616 -8.283
419 HZ3 LYS 58 HZ3 LYS 58 -7.599 -13.245 -6.823
420 H GLY 59 H GLY 59 -10.790 -6.065 -7.373
421 HA2 GLY 59 HA2 GLY 59 -12.262 -4.856 -5.890
422 HA3 GLY 59 HA3 GLY 59 -11.418 -5.584 -4.525
423 HA PRO 60 HA PRO 60 -9.570 -1.353 -5.666
424 HB2 PRO 60 HB2 PRO 60 -10.245 0.074 -3.450
425 HB3 PRO 60 HB3 PRO 60 -11.303 -0.051 -4.870
426 HG2 PRO 60 HG2 PRO 60 -11.402 -1.567 -2.303
427 HG3 PRO 60 HG3 PRO 60 -12.720 -0.816 -3.218
428 HD2 PRO 60 HD2 PRO 60 -12.204 -3.483 -3.357
429 HD3 PRO 60 HD3 PRO 60 -12.838 -2.571 -4.746
430 H CYS 61 H CYS 61 -7.659 -0.512 -4.868
431 HA CYS 61 HA CYS 61 -6.458 -1.896 -2.543
432 HB2 CYS 61 HB2 CYS 61 -5.098 -0.992 -5.094
433 HB3 CYS 61 HB3 CYS 61 -4.293 -1.732 -3.710
434 HG CYS 61 HG CYS 61 -6.043 -3.213 -5.769
435 H ALA 62 H ALA 62 -4.384 -0.555 -1.856
436 HA ALA 62 HA ALA 62 -5.085 2.316 -1.851
437 HB1 ALA 62 HB1 ALA 62 -5.545 2.063 0.343
438 HB2 ALA 62 HB2 ALA 62 -3.806 1.894 0.572
439 HB3 ALA 62 HB3 ALA 62 -4.819 0.461 0.401
440 H ASN 63 H ASN 63 -3.392 3.719 -2.123
441 HA ASN 63 HA ASN 63 -0.667 2.580 -2.238
442 HB2 ASN 63 HB2 ASN 63 -0.221 4.021 -4.203
443 HB3 ASN 63 HB3 ASN 63 -1.468 2.819 -4.527
444 HD21 ASN 63 HD21 ASN 63 -2.966 3.828 -5.882
445 HD22 ASN 63 HD22 ASN 63 -3.625 5.370 -5.610
446 H LYS 64 H LYS 64 0.950 4.565 -2.495
447 HA LYS 64 HA LYS 64 1.960 6.309 -1.376
448 HB2 LYS 64 HB2 LYS 64 -0.897 7.326 -1.315
449 HB3 LYS 64 HB3 LYS 64 0.515 8.285 -0.874
450 HG2 LYS 64 HG2 LYS 64 1.450 7.946 -3.134
451 HG3 LYS 64 HG3 LYS 64 0.037 6.988 -3.576
452 HD2 LYS 64 HD2 LYS 64 -1.417 8.938 -3.151
453 HD3 LYS 64 HD3 LYS 64 -0.002 9.897 -2.718
454 HE2 LYS 64 HE2 LYS 64 0.927 9.556 -4.978
455 HE3 LYS 64 HE3 LYS 64 -0.482 8.591 -5.414
456 HZ1 LYS 64 HZ1 LYS 64 -1.082 10.647 -6.178
457 HZ2 LYS 64 HZ2 LYS 64 -0.285 11.480 -4.929
458 HZ3 LYS 64 HZ3 LYS 64 -1.760 10.689 -4.624
459 H VAL 65 H VAL 65 1.627 4.110 0.096
460 HA VAL 65 HA VAL 65 0.248 4.596 2.577
461 HB VAL 65 HB VAL 65 2.232 2.434 1.805
462 HG11 VAL 65 HG11 VAL 65 0.253 2.550 4.106
463 HG12 VAL 65 HG12 VAL 65 2.003 2.705 4.256
464 HG13 VAL 65 HG13 VAL 65 1.297 1.185 3.709
465 HG21 VAL 65 HG21 VAL 65 -0.017 2.666 0.508
466 HG22 VAL 65 HG22 VAL 65 -0.767 2.111 2.003
467 HG23 VAL 65 HG23 VAL 65 0.407 1.092 1.171
468 H VAL 66 H VAL 66 0.970 5.806 4.136
469 HA VAL 66 HA VAL 66 3.875 5.872 4.709
470 HB VAL 66 HB VAL 66 3.751 8.280 5.249
471 HG11 VAL 66 HG11 VAL 66 3.689 9.074 2.928
472 HG12 VAL 66 HG12 VAL 66 2.837 7.612 2.435
473 HG13 VAL 66 HG13 VAL 66 4.498 7.508 3.015
474 HG21 VAL 66 HG21 VAL 66 1.223 8.230 5.631
475 HG22 VAL 66 HG22 VAL 66 1.054 8.266 3.876
476 HG23 VAL 66 HG23 VAL 66 1.837 9.608 4.714
477 H ALA 67 H ALA 67 4.423 6.374 6.897
478 HA ALA 67 HA ALA 67 2.568 5.200 8.777
479 HB1 ALA 67 HB1 ALA 67 4.987 4.705 8.865
480 HB2 ALA 67 HB2 ALA 67 4.405 5.397 10.377
481 HB3 ALA 67 HB3 ALA 67 5.311 6.398 9.241
482 H VAL 68 H VAL 68 1.215 6.228 10.067
483 HA VAL 68 HA VAL 68 0.090 7.889 11.184
484 HB VAL 68 HB VAL 68 2.784 9.293 11.248
485 HG11 VAL 68 HG11 VAL 68 0.232 9.589 12.859
486 HG12 VAL 68 HG12 VAL 68 1.043 10.822 11.892
487 HG13 VAL 68 HG13 VAL 68 1.784 10.248 13.386
488 HG21 VAL 68 HG21 VAL 68 3.043 7.092 12.223
489 HG22 VAL 68 HG22 VAL 68 1.526 7.250 13.107
490 HG23 VAL 68 HG23 VAL 68 2.912 8.246 13.551
Start of MODEL 20
1 H1 MET 1 HT1 MET 1 -6.286 14.233 3.577
2 H2 MET 1 HT2 MET 1 -7.152 13.850 2.166
3 H3 MET 1 HT3 MET 1 -5.676 14.686 2.061
4 HA MET 1 HA MET 1 -5.519 12.299 1.467
5 HB2 MET 1 HB2 MET 1 -3.661 13.811 2.509
6 HB3 MET 1 HB3 MET 1 -3.942 12.873 3.975
7 HG2 MET 1 HG2 MET 1 -2.146 11.810 2.752
8 HG3 MET 1 HG3 MET 1 -3.571 10.782 2.616
9 HE1 MET 1 HE1 MET 1 -1.121 10.454 0.586
10 HE2 MET 1 HE2 MET 1 -2.137 10.109 -0.812
11 HE3 MET 1 HE3 MET 1 -2.612 9.520 0.778
12 H SER 2 H SER 2 -6.818 10.614 1.828
13 HA SER 2 HA SER 2 -8.133 10.067 4.288
14 HB2 SER 2 HB2 SER 2 -7.665 8.306 1.872
15 HB3 SER 2 HB3 SER 2 -8.757 7.922 3.200
16 HG SER 2 HG SER 2 -10.159 9.233 2.360
17 H LYS 3 H LYS 3 -7.780 8.435 5.803
18 HA LYS 3 HA LYS 3 -5.504 6.682 5.656
19 HB2 LYS 3 HB2 LYS 3 -4.309 7.597 7.610
20 HB3 LYS 3 HB3 LYS 3 -4.347 8.755 6.285
21 HG2 LYS 3 HG2 LYS 3 -6.272 9.896 7.360
22 HG3 LYS 3 HG3 LYS 3 -6.179 8.750 8.699
23 HD2 LYS 3 HD2 LYS 3 -3.913 9.506 9.232
24 HD3 LYS 3 HD3 LYS 3 -3.931 10.598 7.848
25 HE2 LYS 3 HE2 LYS 3 -4.442 11.854 9.883
26 HE3 LYS 3 HE3 LYS 3 -5.873 11.791 8.855
27 HZ1 LYS 3 HZ1 LYS 3 -5.428 9.763 10.951
28 HZ2 LYS 3 HZ2 LYS 3 -6.885 10.231 10.211
29 HZ3 LYS 3 HZ3 LYS 3 -6.129 11.260 11.332
30 H GLY 4 H GLY 4 -5.596 5.022 7.140
31 HA2 GLY 4 HA2 GLY 4 -7.774 5.088 9.126
32 HA3 GLY 4 HA3 GLY 4 -7.677 3.763 7.970
33 H ILE 5 H ILE 5 -7.572 2.473 9.968
34 HA ILE 5 HA ILE 5 -4.811 2.350 11.044
35 HB ILE 5 HB ILE 5 -5.894 1.154 13.016
36 HG12 ILE 5 HG12 ILE 5 -8.441 2.517 12.102
37 HG13 ILE 5 HG13 ILE 5 -8.105 0.844 11.671
38 HG21 ILE 5 HG21 ILE 5 -6.466 4.062 12.406
39 HG22 ILE 5 HG22 ILE 5 -5.109 3.395 13.313
40 HG23 ILE 5 HG23 ILE 5 -6.734 3.349 13.996
41 HD11 ILE 5 HD11 ILE 5 -9.416 0.845 13.710
42 HD12 ILE 5 HD12 ILE 5 -8.319 2.002 14.465
43 HD13 ILE 5 HD13 ILE 5 -7.773 0.360 14.126
44 H VAL 6 H VAL 6 -3.690 0.602 10.648
45 HA VAL 6 HA VAL 6 -4.692 -1.432 8.943
46 HB VAL 6 HB VAL 6 -2.095 -1.302 10.495
47 HG11 VAL 6 HG11 VAL 6 -1.341 -2.871 8.605
48 HG12 VAL 6 HG12 VAL 6 -3.054 -3.125 8.275
49 HG13 VAL 6 HG13 VAL 6 -2.380 -3.581 9.838
50 HG21 VAL 6 HG21 VAL 6 -1.142 -0.337 8.530
51 HG22 VAL 6 HG22 VAL 6 -2.646 0.544 8.795
52 HG23 VAL 6 HG23 VAL 6 -2.568 -0.713 7.561
53 H LYS 7 H LYS 7 -5.775 -3.174 9.411
54 HA LYS 7 HA LYS 7 -6.418 -4.009 12.062
55 HB2 LYS 7 HB2 LYS 7 -7.879 -4.419 10.077
56 HB3 LYS 7 HB3 LYS 7 -6.681 -5.562 9.465
57 HG2 LYS 7 HG2 LYS 7 -6.970 -6.979 11.437
58 HG3 LYS 7 HG3 LYS 7 -8.079 -5.810 12.149
59 HD2 LYS 7 HD2 LYS 7 -9.457 -7.503 11.175
60 HD3 LYS 7 HD3 LYS 7 -9.538 -6.128 10.077
61 HE2 LYS 7 HE2 LYS 7 -7.853 -7.157 8.621
62 HE3 LYS 7 HE3 LYS 7 -7.692 -8.512 9.738
63 HZ1 LYS 7 HZ1 LYS 7 -9.157 -9.196 8.038
64 HZ2 LYS 7 HZ2 LYS 7 -10.062 -7.762 8.127
65 HZ3 LYS 7 HZ3 LYS 7 -10.127 -8.892 9.395
66 H TRP 8 H TRP 8 -4.235 -5.205 9.545
67 HA TRP 8 HA TRP 8 -2.346 -6.219 11.449
68 HB2 TRP 8 HB2 TRP 8 -4.213 -8.016 11.278
69 HB3 TRP 8 HB3 TRP 8 -3.589 -8.310 9.655
70 HD1 TRP 8 HD1 TRP 8 -1.068 -9.215 9.452
71 HE1 TRP 8 HE1 TRP 8 0.405 -10.519 11.119
72 HE3 TRP 8 HE3 TRP 8 -3.668 -8.381 13.764
73 HZ2 TRP 8 HZ2 TRP 8 0.467 -11.133 13.910
74 HZ3 TRP 8 HZ3 TRP 8 -2.883 -9.339 15.911
75 HH2 TRP 8 HH2 TRP 8 -0.820 -10.713 15.990
76 H PHE 9 H PHE 9 -0.362 -6.089 10.519
77 HA PHE 9 HA PHE 9 -0.261 -5.857 7.557
78 HB2 PHE 9 HB2 PHE 9 0.463 -3.857 8.963
79 HB3 PHE 9 HB3 PHE 9 1.827 -4.843 9.491
80 HD1 PHE 9 HD1 PHE 9 0.365 -2.942 6.742
81 HD2 PHE 9 HD2 PHE 9 3.494 -5.682 7.825
82 HE1 PHE 9 HE1 PHE 9 1.562 -2.405 4.639
83 HE2 PHE 9 HE2 PHE 9 4.692 -5.139 5.720
84 HZ PHE 9 HZ PHE 9 3.725 -3.501 4.130
85 H ASN 10 H ASN 10 0.625 -7.542 6.519
86 HA ASN 10 HA ASN 10 2.566 -9.236 7.986
87 HB2 ASN 10 HB2 ASN 10 0.713 -10.009 5.719
88 HB3 ASN 10 HB3 ASN 10 1.849 -11.081 6.532
89 HD21 ASN 10 HD21 ASN 10 1.470 -11.358 8.963
90 HD22 ASN 10 HD22 ASN 10 -0.133 -11.311 9.517
91 H SER 11 H SER 11 4.354 -7.880 7.330
92 HA SER 11 HA SER 11 4.962 -7.229 4.663
93 HB2 SER 11 HB2 SER 11 7.221 -6.803 5.489
94 HB3 SER 11 HB3 SER 11 6.036 -6.188 6.640
95 HG SER 11 HG SER 11 6.295 -8.278 7.716
96 H ASP 12 H ASP 12 5.446 -10.169 6.516
97 HA ASP 12 HA ASP 12 7.420 -11.413 4.934
98 HB2 ASP 12 HB2 ASP 12 5.167 -12.556 6.598
99 HB3 ASP 12 HB3 ASP 12 6.381 -13.559 5.809
100 H LYS 13 H LYS 13 3.894 -11.295 4.673
101 HA LYS 13 HA LYS 13 3.872 -12.915 2.255
102 HB2 LYS 13 HB2 LYS 13 1.672 -11.451 3.732
103 HB3 LYS 13 HB3 LYS 13 1.423 -12.462 2.310
104 HG2 LYS 13 HG2 LYS 13 2.476 -14.374 3.537
105 HG3 LYS 13 HG3 LYS 13 2.558 -13.356 4.976
106 HD2 LYS 13 HD2 LYS 13 -0.034 -13.917 3.509
107 HD3 LYS 13 HD3 LYS 13 0.540 -14.907 4.851
108 HE2 LYS 13 HE2 LYS 13 0.601 -12.877 6.291
109 HE3 LYS 13 HE3 LYS 13 -0.050 -11.931 4.952
110 HZ1 LYS 13 HZ1 LYS 13 -2.041 -13.170 4.982
111 HZ2 LYS 13 HZ2 LYS 13 -1.721 -12.759 6.598
112 HZ3 LYS 13 HZ3 LYS 13 -1.403 -14.331 6.041
113 H GLY 14 H GLY 14 4.277 -9.612 3.056
114 HA2 GLY 14 HA2 GLY 14 4.850 -7.880 1.599
115 HA3 GLY 14 HA3 GLY 14 4.298 -8.858 0.248
116 H PHE 15 H PHE 15 1.933 -8.811 2.677
117 HA PHE 15 HA PHE 15 0.715 -6.298 1.921
118 HB2 PHE 15 HB2 PHE 15 -1.351 -7.279 1.007
119 HB3 PHE 15 HB3 PHE 15 0.052 -7.634 0.002
120 HD1 PHE 15 HD1 PHE 15 -2.380 -9.031 2.411
121 HD2 PHE 15 HD2 PHE 15 0.893 -9.892 -0.232
122 HE1 PHE 15 HE1 PHE 15 -2.878 -11.454 2.585
123 HE2 PHE 15 HE2 PHE 15 0.399 -12.316 -0.055
124 HZ PHE 15 HZ PHE 15 -1.486 -13.096 1.354
125 H GLY 16 H GLY 16 -1.564 -6.148 2.872
126 HA2 GLY 16 HA2 GLY 16 -2.108 -7.762 5.204
127 HA3 GLY 16 HA3 GLY 16 -1.523 -6.144 5.588
128 H PHE 17 H PHE 17 -3.905 -6.551 6.535
129 HA PHE 17 HA PHE 17 -5.829 -5.389 4.603
130 HB2 PHE 17 HB2 PHE 17 -6.340 -7.100 7.054
131 HB3 PHE 17 HB3 PHE 17 -7.597 -6.340 6.078
132 HD1 PHE 17 HD1 PHE 17 -5.066 -8.999 6.220
133 HD2 PHE 17 HD2 PHE 17 -8.050 -7.098 3.784
134 HE1 PHE 17 HE1 PHE 17 -5.009 -10.919 4.653
135 HE2 PHE 17 HE2 PHE 17 -7.991 -9.019 2.216
136 HZ PHE 17 HZ PHE 17 -6.470 -10.929 2.651
137 H ILE 18 H ILE 18 -6.732 -3.448 5.109
138 HA ILE 18 HA ILE 18 -6.068 -2.333 7.755
139 HB ILE 18 HB ILE 18 -4.837 -1.215 5.963
140 HG12 ILE 18 HG12 ILE 18 -7.016 0.688 6.851
141 HG13 ILE 18 HG13 ILE 18 -5.853 0.031 8.001
142 HG21 ILE 18 HG21 ILE 18 -6.168 -1.495 4.030
143 HG22 ILE 18 HG22 ILE 18 -6.279 0.230 4.372
144 HG23 ILE 18 HG23 ILE 18 -7.604 -0.846 4.818
145 HD11 ILE 18 HD11 ILE 18 -5.301 2.299 6.859
146 HD12 ILE 18 HD12 ILE 18 -4.907 1.319 5.445
147 HD13 ILE 18 HD13 ILE 18 -4.034 1.078 6.956
148 H THR 19 H THR 19 -7.530 -1.112 8.847
149 HA THR 19 HA THR 19 -10.323 -1.600 8.131
150 HB THR 19 HB THR 19 -9.123 -0.674 10.746
151 HG1 THR 19 HG1 THR 19 -8.957 -2.721 11.235
152 HG21 THR 19 HG21 THR 19 -11.902 -1.579 9.949
153 HG22 THR 19 HG22 THR 19 -11.438 -0.012 10.612
154 HG23 THR 19 HG23 THR 19 -11.364 -1.454 11.624
155 HA PRO 20 HA PRO 20 -10.145 2.781 6.707
156 HB2 PRO 20 HB2 PRO 20 -13.073 2.188 6.481
157 HB3 PRO 20 HB3 PRO 20 -12.002 3.008 5.328
158 HG2 PRO 20 HG2 PRO 20 -12.732 0.537 4.877
159 HG3 PRO 20 HG3 PRO 20 -11.046 1.018 4.611
160 HD2 PRO 20 HD2 PRO 20 -12.216 -0.539 6.899
161 HD3 PRO 20 HD3 PRO 20 -10.666 -0.764 6.056
162 H GLU 21 H GLU 21 -10.381 4.591 7.857
163 HA GLU 21 HA GLU 21 -11.239 4.621 10.534
164 HB2 GLU 21 HB2 GLU 21 -9.607 6.214 9.606
165 HB3 GLU 21 HB3 GLU 21 -10.861 6.917 8.587
166 HG2 GLU 21 HG2 GLU 21 -10.570 8.316 10.556
167 HG3 GLU 21 HG3 GLU 21 -12.143 7.518 10.632
168 H ASP 22 H ASP 22 -12.820 5.675 7.537
169 HA ASP 22 HA ASP 22 -15.137 6.787 8.724
170 HB2 ASP 22 HB2 ASP 22 -14.314 7.133 6.356
171 HB3 ASP 22 HB3 ASP 22 -14.983 5.545 5.979
172 H GLY 23 H GLY 23 -14.169 3.556 8.650
173 HA2 GLY 23 HA2 GLY 23 -15.354 1.776 9.639
174 HA3 GLY 23 HA3 GLY 23 -16.854 2.667 9.406
175 H SER 24 H SER 24 -14.942 2.717 6.601
176 HA SER 24 HA SER 24 -16.811 1.137 5.113
177 HB2 SER 24 HB2 SER 24 -15.648 2.985 4.039
178 HB3 SER 24 HB3 SER 24 -14.090 2.230 4.356
179 HG SER 24 HG SER 24 -16.172 1.011 2.867
180 H LYS 25 H LYS 25 -16.021 -0.676 3.659
181 HA LYS 25 HA LYS 25 -15.145 -2.848 5.244
182 HB2 LYS 25 HB2 LYS 25 -15.378 -2.542 2.242
183 HB3 LYS 25 HB3 LYS 25 -15.046 -4.070 3.059
184 HG2 LYS 25 HG2 LYS 25 -17.154 -3.857 4.325
185 HG3 LYS 25 HG3 LYS 25 -17.489 -2.330 3.510
186 HD2 LYS 25 HD2 LYS 25 -17.483 -3.502 1.328
187 HD3 LYS 25 HD3 LYS 25 -17.184 -5.030 2.159
188 HE2 LYS 25 HE2 LYS 25 -19.596 -3.250 2.632
189 HE3 LYS 25 HE3 LYS 25 -19.598 -4.698 1.627
190 HZ1 LYS 25 HZ1 LYS 25 -19.395 -4.456 4.539
191 HZ2 LYS 25 HZ2 LYS 25 -18.596 -5.751 3.785
192 HZ3 LYS 25 HZ3 LYS 25 -20.274 -5.565 3.606
193 H ASP 26 H ASP 26 -13.209 -4.067 5.168
194 HA ASP 26 HA ASP 26 -10.838 -2.634 5.211
195 HB2 ASP 26 HB2 ASP 26 -11.372 -5.585 4.896
196 HB3 ASP 26 HB3 ASP 26 -9.753 -4.922 5.094
197 H LEU 27 H LEU 27 -9.171 -2.305 3.855
198 HA LEU 27 HA LEU 27 -9.556 -3.036 1.011
199 HB2 LEU 27 HB2 LEU 27 -8.189 -0.589 2.171
200 HB3 LEU 27 HB3 LEU 27 -8.317 -0.971 0.457
201 HG LEU 27 HG LEU 27 -10.716 -0.587 2.278
202 HD11 LEU 27 HD11 LEU 27 -9.396 1.342 0.343
203 HD12 LEU 27 HD12 LEU 27 -9.445 1.506 2.097
204 HD13 LEU 27 HD13 LEU 27 -10.934 1.620 1.159
205 HD21 LEU 27 HD21 LEU 27 -11.204 -1.923 0.284
206 HD22 LEU 27 HD22 LEU 27 -10.395 -0.739 -0.740
207 HD23 LEU 27 HD23 LEU 27 -11.896 -0.313 0.081
208 H PHE 28 H PHE 28 -7.673 -3.569 -0.191
209 HA PHE 28 HA PHE 28 -5.654 -4.960 1.341
210 HB2 PHE 28 HB2 PHE 28 -6.072 -4.543 -1.627
211 HB3 PHE 28 HB3 PHE 28 -4.732 -5.477 -0.956
212 HD1 PHE 28 HD1 PHE 28 -8.378 -5.340 -1.459
213 HD2 PHE 28 HD2 PHE 28 -5.115 -7.610 0.174
214 HE1 PHE 28 HE1 PHE 28 -9.860 -7.317 -1.247
215 HE2 PHE 28 HE2 PHE 28 -6.599 -9.586 0.385
216 HZ PHE 28 HZ PHE 28 -8.970 -9.440 -0.326
217 H VAL 29 H VAL 29 -3.595 -4.339 1.749
218 HA VAL 29 HA VAL 29 -2.603 -1.834 0.521
219 HB VAL 29 HB VAL 29 -2.314 -2.675 3.420
220 HG11 VAL 29 HG11 VAL 29 -1.110 -0.636 3.779
221 HG12 VAL 29 HG12 VAL 29 -1.481 -0.058 2.154
222 HG13 VAL 29 HG13 VAL 29 -0.367 -1.405 2.378
223 HG21 VAL 29 HG21 VAL 29 -3.736 -0.210 2.415
224 HG22 VAL 29 HG22 VAL 29 -3.845 -0.973 3.999
225 HG23 VAL 29 HG23 VAL 29 -4.587 -1.743 2.598
226 H HIS 30 H HIS 30 -0.571 -2.005 -0.312
227 HA HIS 30 HA HIS 30 0.911 -4.509 0.211
228 HB2 HIS 30 HB2 HIS 30 1.015 -2.626 -2.152
229 HB3 HIS 30 HB3 HIS 30 2.042 -4.047 -1.956
230 HD2 HIS 30 HD2 HIS 30 -1.400 -3.185 -3.376
231 HE1 HIS 30 HE1 HIS 30 -1.419 -7.362 -2.763
232 HE2 HIS 30 HE2 HIS 30 -2.656 -5.426 -3.846
233 H HIS 31 H HIS 31 2.962 -4.491 0.892
234 HA HIS 31 HA HIS 31 3.991 -2.256 2.300
235 HB2 HIS 31 HB2 HIS 31 4.506 -4.665 2.797
236 HB3 HIS 31 HB3 HIS 31 5.527 -4.693 1.361
237 HD2 HIS 31 HD2 HIS 31 5.665 -3.402 5.040
238 HE1 HIS 31 HE1 HIS 31 9.250 -2.224 3.149
239 HE2 HIS 31 HE2 HIS 31 8.043 -2.379 5.377
240 H SER 32 H SER 32 4.920 -3.723 -0.788
241 HA SER 32 HA SER 32 7.134 -2.195 -1.434
242 HB2 SER 32 HB2 SER 32 6.417 -4.176 -2.688
243 HB3 SER 32 HB3 SER 32 5.048 -3.277 -3.333
244 HG SER 32 HG SER 32 6.622 -3.066 -4.834
245 H GLU 33 H GLU 33 3.799 -1.191 -1.498
246 HA GLU 33 HA GLU 33 4.045 0.895 -3.404
247 HB2 GLU 33 HB2 GLU 33 2.058 0.390 -1.194
248 HB3 GLU 33 HB3 GLU 33 1.921 1.746 -2.312
249 HG2 GLU 33 HG2 GLU 33 2.087 -1.166 -3.141
250 HG3 GLU 33 HG3 GLU 33 0.595 -0.234 -3.051
251 H ILE 34 H ILE 34 4.911 0.782 -0.005
252 HA ILE 34 HA ILE 34 4.750 3.537 0.557
253 HB ILE 34 HB ILE 34 5.086 1.794 2.297
254 HG12 ILE 34 HG12 ILE 34 7.359 3.789 2.387
255 HG13 ILE 34 HG13 ILE 34 5.674 4.282 2.569
256 HG21 ILE 34 HG21 ILE 34 6.994 0.696 0.790
257 HG22 ILE 34 HG22 ILE 34 7.035 0.558 2.546
258 HG23 ILE 34 HG23 ILE 34 8.038 1.759 1.731
259 HD11 ILE 34 HD11 ILE 34 5.477 2.584 4.437
260 HD12 ILE 34 HD12 ILE 34 6.561 3.931 4.785
261 HD13 ILE 34 HD13 ILE 34 7.222 2.361 4.331
262 H GLN 35 H GLN 35 5.699 5.160 -0.426
263 HA GLN 35 HA GLN 35 8.299 4.736 -1.763
264 HB2 GLN 35 HB2 GLN 35 6.128 6.791 -2.190
265 HB3 GLN 35 HB3 GLN 35 7.712 6.877 -2.961
266 HG2 GLN 35 HG2 GLN 35 7.366 4.755 -4.063
267 HG3 GLN 35 HG3 GLN 35 5.881 4.473 -3.160
268 HE21 GLN 35 HE21 GLN 35 6.269 4.714 -6.144
269 HE22 GLN 35 HE22 GLN 35 5.229 5.967 -6.626
270 H SER 36 H SER 36 7.442 5.680 1.193
271 HA SER 36 HA SER 36 8.488 8.268 1.557
272 HB2 SER 36 HB2 SER 36 8.378 5.931 3.474
273 HB3 SER 36 HB3 SER 36 8.750 7.589 3.935
274 HG SER 36 HG SER 36 6.709 8.201 3.223
275 H GLY 37 H GLY 37 10.497 9.056 1.884
276 HA2 GLY 37 HA2 GLY 37 12.753 7.270 1.306
277 HA3 GLY 37 HA3 GLY 37 12.774 9.029 1.232
278 H GLY 38 H GLY 38 14.846 8.481 2.443
279 HA2 GLY 38 HA2 GLY 38 16.088 8.602 4.373
280 HA3 GLY 38 HA3 GLY 38 14.663 9.331 5.106
281 H GLU 39 H GLU 39 14.372 8.322 6.994
282 HA GLU 39 HA GLU 39 15.029 5.578 7.469
283 HB2 GLU 39 HB2 GLU 39 13.393 7.549 9.086
284 HB3 GLU 39 HB3 GLU 39 13.889 5.955 9.654
285 HG2 GLU 39 HG2 GLU 39 16.255 6.574 9.349
286 HG3 GLU 39 HG3 GLU 39 15.768 8.166 8.770
287 H TYR 40 H TYR 40 13.680 3.808 7.708
288 HA TYR 40 HA TYR 40 10.970 4.112 6.553
289 HB2 TYR 40 HB2 TYR 40 12.812 1.710 6.578
290 HB3 TYR 40 HB3 TYR 40 11.172 1.716 5.937
291 HD1 TYR 40 HD1 TYR 40 14.627 2.848 5.416
292 HD2 TYR 40 HD2 TYR 40 10.607 2.976 3.904
293 HE1 TYR 40 HE1 TYR 40 15.466 3.728 3.255
294 HE2 TYR 40 HE2 TYR 40 11.448 3.856 1.742
295 HH TYR 40 HH TYR 40 13.756 3.706 0.471
296 H ALA 41 H ALA 41 9.282 3.662 7.791
297 HA ALA 41 HA ALA 41 9.724 2.472 10.443
298 HB1 ALA 41 HB1 ALA 41 7.353 3.940 9.258
299 HB2 ALA 41 HB2 ALA 41 8.503 4.573 10.436
300 HB3 ALA 41 HB3 ALA 41 7.401 3.272 10.891
301 H THR 42 H THR 42 8.860 0.515 11.031
302 HA THR 42 HA THR 42 7.947 -1.234 8.937
303 HB THR 42 HB THR 42 7.846 -2.930 10.719
304 HG1 THR 42 HG1 THR 42 8.471 -0.729 12.391
305 HG21 THR 42 HG21 THR 42 10.026 -2.391 9.662
306 HG22 THR 42 HG22 THR 42 10.218 -2.904 11.339
307 HG23 THR 42 HG23 THR 42 10.325 -1.194 10.922
308 H LEU 43 H LEU 43 5.994 -2.648 9.377
309 HA LEU 43 HA LEU 43 3.772 -1.110 10.556
310 HB2 LEU 43 HB2 LEU 43 3.687 -2.558 7.900
311 HB3 LEU 43 HB3 LEU 43 2.309 -1.818 8.704
312 HG LEU 43 HG LEU 43 3.907 0.341 8.684
313 HD11 LEU 43 HD11 LEU 43 5.869 -0.616 7.690
314 HD12 LEU 43 HD12 LEU 43 5.113 0.350 6.429
315 HD13 LEU 43 HD13 LEU 43 4.927 -1.403 6.427
316 HD21 LEU 43 HD21 LEU 43 2.789 1.074 6.653
317 HD22 LEU 43 HD22 LEU 43 1.664 0.082 7.580
318 HD23 LEU 43 HD23 LEU 43 2.482 -0.596 6.172
319 H ALA 44 H ALA 44 2.276 -2.307 11.641
320 HA ALA 44 HA ALA 44 2.389 -5.230 11.548
321 HB1 ALA 44 HB1 ALA 44 3.997 -4.120 13.335
322 HB2 ALA 44 HB2 ALA 44 3.048 -5.545 13.754
323 HB3 ALA 44 HB3 ALA 44 2.503 -3.945 14.257
324 H ASP 45 H ASP 45 0.786 -5.245 14.160
325 HA ASP 45 HA ASP 45 -1.808 -4.806 12.935
326 HB2 ASP 45 HB2 ASP 45 -1.336 -6.845 14.251
327 HB3 ASP 45 HB3 ASP 45 -1.055 -5.854 15.675
328 H GLY 46 H GLY 46 -2.629 -2.793 12.971
329 HA2 GLY 46 HA2 GLY 46 -3.815 -1.132 14.236
330 HA3 GLY 46 HA3 GLY 46 -2.656 -1.341 15.539
331 H GLN 47 H GLN 47 -0.942 -1.258 12.660
332 HA GLN 47 HA GLN 47 0.278 1.236 13.204
333 HB2 GLN 47 HB2 GLN 47 1.324 -0.667 11.957
334 HB3 GLN 47 HB3 GLN 47 0.270 -0.301 10.592
335 HG2 GLN 47 HG2 GLN 47 2.451 0.746 10.245
336 HG3 GLN 47 HG3 GLN 47 1.233 1.987 10.497
337 HE21 GLN 47 HE21 GLN 47 2.079 3.626 11.788
338 HE22 GLN 47 HE22 GLN 47 3.109 3.385 13.116
339 H THR 48 H THR 48 -0.237 3.259 12.607
340 HA THR 48 HA THR 48 -2.686 3.698 11.071
341 HB THR 48 HB THR 48 -0.849 5.688 12.449
342 HG1 THR 48 HG1 THR 48 -1.963 4.067 13.763
343 HG21 THR 48 HG21 THR 48 -2.267 6.688 10.684
344 HG22 THR 48 HG22 THR 48 -2.790 7.202 12.288
345 HG23 THR 48 HG23 THR 48 -3.693 5.959 11.422
346 H VAL 49 H VAL 49 -2.685 4.137 8.960
347 HA VAL 49 HA VAL 49 -0.306 5.396 7.751
348 HB VAL 49 HB VAL 49 -0.349 3.809 5.861
349 HG11 VAL 49 HG11 VAL 49 -0.138 2.256 8.447
350 HG12 VAL 49 HG12 VAL 49 1.054 3.465 7.975
351 HG13 VAL 49 HG13 VAL 49 0.800 2.044 6.967
352 HG21 VAL 49 HG21 VAL 49 -1.621 1.658 6.178
353 HG22 VAL 49 HG22 VAL 49 -2.658 3.062 5.927
354 HG23 VAL 49 HG23 VAL 49 -2.443 2.403 7.549
355 H GLU 50 H GLU 50 -0.715 6.128 5.512
356 HA GLU 50 HA GLU 50 -3.535 6.954 5.131
357 HB2 GLU 50 HB2 GLU 50 -2.626 8.968 3.957
358 HB3 GLU 50 HB3 GLU 50 -2.247 8.936 5.678
359 HG2 GLU 50 HG2 GLU 50 -0.001 8.064 5.162
360 HG3 GLU 50 HG3 GLU 50 -0.383 8.079 3.442
361 H TYR 51 H TYR 51 -4.380 6.686 3.073
362 HA TYR 51 HA TYR 51 -2.663 5.936 0.859
363 HB2 TYR 51 HB2 TYR 51 -3.669 3.718 0.525
364 HB3 TYR 51 HB3 TYR 51 -2.820 3.808 2.065
365 HD1 TYR 51 HD1 TYR 51 -6.107 3.597 0.426
366 HD2 TYR 51 HD2 TYR 51 -4.059 3.864 4.192
367 HE1 TYR 51 HE1 TYR 51 -8.196 2.969 1.606
368 HE2 TYR 51 HE2 TYR 51 -6.149 3.234 5.371
369 HH TYR 51 HH TYR 51 -9.152 3.335 3.965
370 H GLU 52 H GLU 52 -3.928 5.353 -1.098
371 HA GLU 52 HA GLU 52 -6.488 6.844 -1.198
372 HB2 GLU 52 HB2 GLU 52 -4.402 6.499 -3.376
373 HB3 GLU 52 HB3 GLU 52 -5.953 7.322 -3.568
374 HG2 GLU 52 HG2 GLU 52 -5.301 8.942 -1.813
375 HG3 GLU 52 HG3 GLU 52 -3.746 8.130 -1.647
376 H VAL 53 H VAL 53 -8.220 5.692 -1.813
377 HA VAL 53 HA VAL 53 -7.979 2.875 -2.322
378 HB VAL 53 HB VAL 53 -9.855 3.826 -1.033
379 HG11 VAL 53 HG11 VAL 53 -10.974 4.905 -3.623
380 HG12 VAL 53 HG12 VAL 53 -10.012 5.907 -2.537
381 HG13 VAL 53 HG13 VAL 53 -11.530 5.206 -1.978
382 HG21 VAL 53 HG21 VAL 53 -11.633 2.514 -2.055
383 HG22 VAL 53 HG22 VAL 53 -10.104 1.662 -2.270
384 HG23 VAL 53 HG23 VAL 53 -10.812 2.554 -3.615
385 H GLY 54 H GLY 54 -7.409 2.047 -4.198
386 HA2 GLY 54 HA2 GLY 54 -8.066 3.457 -6.702
387 HA3 GLY 54 HA3 GLY 54 -6.758 2.288 -6.502
388 H GLN 55 H GLN 55 -8.340 1.781 -8.574
389 HA GLN 55 HA GLN 55 -10.300 -0.222 -7.644
390 HB2 GLN 55 HB2 GLN 55 -11.177 1.597 -9.106
391 HB3 GLN 55 HB3 GLN 55 -10.069 1.076 -10.376
392 HG2 GLN 55 HG2 GLN 55 -11.136 -1.154 -10.392
393 HG3 GLN 55 HG3 GLN 55 -12.250 -0.628 -9.130
394 HE21 GLN 55 HE21 GLN 55 -14.241 -0.054 -9.988
395 HE22 GLN 55 HE22 GLN 55 -14.477 0.680 -11.501
396 H GLY 56 H GLY 56 -9.947 -2.309 -8.013
397 HA2 GLY 56 HA2 GLY 56 -7.856 -3.113 -9.943
398 HA3 GLY 56 HA3 GLY 56 -7.934 -3.814 -8.328
399 H GLN 57 H GLN 57 -8.101 -5.312 -10.732
400 HA GLN 57 HA GLN 57 -10.736 -5.923 -11.532
401 HB2 GLN 57 HB2 GLN 57 -8.184 -7.544 -11.578
402 HB3 GLN 57 HB3 GLN 57 -9.697 -8.093 -12.306
403 HG2 GLN 57 HG2 GLN 57 -9.753 -6.194 -13.795
404 HG3 GLN 57 HG3 GLN 57 -8.390 -5.442 -12.967
405 HE21 GLN 57 HE21 GLN 57 -8.625 -6.313 -15.851
406 HE22 GLN 57 HE22 GLN 57 -7.331 -7.386 -16.096
407 H LYS 58 H LYS 58 -8.660 -7.284 -8.998
408 HA LYS 58 HA LYS 58 -10.666 -9.217 -8.183
409 HB2 LYS 58 HB2 LYS 58 -8.001 -8.425 -6.994
410 HB3 LYS 58 HB3 LYS 58 -9.034 -9.699 -6.344
411 HG2 LYS 58 HG2 LYS 58 -8.942 -10.883 -8.507
412 HG3 LYS 58 HG3 LYS 58 -7.905 -9.614 -9.158
413 HD2 LYS 58 HD2 LYS 58 -6.208 -10.113 -7.440
414 HD3 LYS 58 HD3 LYS 58 -7.241 -11.384 -6.786
415 HE2 LYS 58 HE2 LYS 58 -7.152 -12.575 -8.943
416 HE3 LYS 58 HE3 LYS 58 -6.126 -11.304 -9.606
417 HZ1 LYS 58 HZ1 LYS 58 -4.684 -12.998 -8.905
418 HZ2 LYS 58 HZ2 LYS 58 -5.498 -13.208 -7.427
419 HZ3 LYS 58 HZ3 LYS 58 -4.578 -11.806 -7.704
420 H GLY 59 H GLY 59 -9.822 -5.954 -7.386
421 HA2 GLY 59 HA2 GLY 59 -12.035 -5.190 -6.037
422 HA3 GLY 59 HA3 GLY 59 -11.079 -5.956 -4.772
423 HA PRO 60 HA PRO 60 -9.680 -1.474 -5.343
424 HB2 PRO 60 HB2 PRO 60 -10.155 -0.552 -2.841
425 HB3 PRO 60 HB3 PRO 60 -11.410 -0.575 -4.097
426 HG2 PRO 60 HG2 PRO 60 -10.927 -2.511 -1.878
427 HG3 PRO 60 HG3 PRO 60 -12.447 -1.784 -2.426
428 HD2 PRO 60 HD2 PRO 60 -11.704 -4.299 -3.156
429 HD3 PRO 60 HD3 PRO 60 -12.649 -3.244 -4.232
430 H CYS 61 H CYS 61 -7.838 -0.431 -4.369
431 HA CYS 61 HA CYS 61 -6.260 -2.051 -2.483
432 HB2 CYS 61 HB2 CYS 61 -4.258 -1.851 -3.877
433 HB3 CYS 61 HB3 CYS 61 -5.533 -2.690 -4.758
434 HG CYS 61 HG CYS 61 -5.472 -0.893 -6.455
435 H ALA 62 H ALA 62 -4.212 -0.783 -1.838
436 HA ALA 62 HA ALA 62 -4.936 2.070 -1.499
437 HB1 ALA 62 HB1 ALA 62 -4.926 1.331 0.678
438 HB2 ALA 62 HB2 ALA 62 -3.206 1.680 0.506
439 HB3 ALA 62 HB3 ALA 62 -3.790 0.026 0.340
440 H ASN 63 H ASN 63 -3.568 3.530 -2.367
441 HA ASN 63 HA ASN 63 -0.851 2.629 -3.123
442 HB2 ASN 63 HB2 ASN 63 -2.640 4.644 -4.504
443 HB3 ASN 63 HB3 ASN 63 -0.991 4.247 -4.981
444 HD21 ASN 63 HD21 ASN 63 -3.826 3.744 -6.244
445 HD22 ASN 63 HD22 ASN 63 -3.752 2.106 -6.681
446 H LYS 64 H LYS 64 0.793 4.317 -3.132
447 HA LYS 64 HA LYS 64 1.995 5.967 -2.083
448 HB2 LYS 64 HB2 LYS 64 -0.714 7.324 -1.917
449 HB3 LYS 64 HB3 LYS 64 0.841 8.110 -1.674
450 HG2 LYS 64 HG2 LYS 64 0.054 6.693 -4.242
451 HG3 LYS 64 HG3 LYS 64 -0.139 8.425 -3.986
452 HD2 LYS 64 HD2 LYS 64 2.306 8.617 -3.569
453 HD3 LYS 64 HD3 LYS 64 2.479 6.893 -3.901
454 HE2 LYS 64 HE2 LYS 64 1.576 7.234 -6.171
455 HE3 LYS 64 HE3 LYS 64 1.403 8.959 -5.844
456 HZ1 LYS 64 HZ1 LYS 64 3.857 7.372 -6.184
457 HZ2 LYS 64 HZ2 LYS 64 3.897 8.793 -5.253
458 HZ3 LYS 64 HZ3 LYS 64 3.433 8.856 -6.888
459 H VAL 65 H VAL 65 1.425 3.851 -0.500
460 HA VAL 65 HA VAL 65 0.167 4.581 1.960
461 HB VAL 65 HB VAL 65 1.106 2.460 2.831
462 HG11 VAL 65 HG11 VAL 65 -0.017 0.984 1.077
463 HG12 VAL 65 HG12 VAL 65 -0.251 2.452 0.129
464 HG13 VAL 65 HG13 VAL 65 -1.000 2.301 1.718
465 HG21 VAL 65 HG21 VAL 65 2.447 2.364 0.109
466 HG22 VAL 65 HG22 VAL 65 2.300 0.979 1.186
467 HG23 VAL 65 HG23 VAL 65 3.237 2.381 1.681
468 H VAL 66 H VAL 66 0.929 5.822 3.466
469 HA VAL 66 HA VAL 66 3.853 5.960 3.932
470 HB VAL 66 HB VAL 66 1.966 8.338 3.930
471 HG11 VAL 66 HG11 VAL 66 4.930 8.105 4.511
472 HG12 VAL 66 HG12 VAL 66 3.674 8.639 5.625
473 HG13 VAL 66 HG13 VAL 66 4.099 9.634 4.232
474 HG21 VAL 66 HG21 VAL 66 3.251 9.091 1.994
475 HG22 VAL 66 HG22 VAL 66 2.584 7.492 1.666
476 HG23 VAL 66 HG23 VAL 66 4.285 7.665 2.098
477 H ALA 67 H ALA 67 4.415 5.581 5.962
478 HA ALA 67 HA ALA 67 2.489 4.959 7.966
479 HB1 ALA 67 HB1 ALA 67 4.695 3.855 7.830
480 HB2 ALA 67 HB2 ALA 67 4.420 4.580 9.413
481 HB3 ALA 67 HB3 ALA 67 5.471 5.382 8.246
482 H VAL 68 H VAL 68 1.816 6.079 9.728
483 HA VAL 68 HA VAL 68 2.552 8.942 9.839
484 HB VAL 68 HB VAL 68 0.095 7.574 10.989
485 HG11 VAL 68 HG11 VAL 68 -0.722 9.972 11.095
486 HG12 VAL 68 HG12 VAL 68 0.925 10.479 10.718
487 HG13 VAL 68 HG13 VAL 68 0.595 9.596 12.208
488 HG21 VAL 68 HG21 VAL 68 -1.072 8.838 9.119
489 HG22 VAL 68 HG22 VAL 68 -0.066 7.492 8.580
490 HG23 VAL 68 HG23 VAL 68 0.522 9.148 8.429