Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
640839 | 5zcz RC | 27354 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 10.089 -2.456 10.674
2 HA MET 1 HA MET 1 9.474 -2.723 8.340
3 HB2 MET 1 HB2 MET 1 9.406 -4.649 10.013
4 HB3 MET 1 HB3 MET 1 7.643 -4.463 10.020
5 HG2 MET 1 HG2 MET 1 7.608 -4.830 7.583
6 HG3 MET 1 HG3 MET 1 9.372 -4.934 7.550
7 HE1 MET 1 HE1 MET 1 10.765 -6.679 8.343
8 HE2 MET 1 HE2 MET 1 10.272 -8.398 8.334
9 HE3 MET 1 HE3 MET 1 10.116 -7.407 6.865
10 H LEU 2 H LEU 2 7.343 -3.326 6.964
11 HA LEU 2 HA LEU 2 5.399 -1.155 7.589
12 HB2 LEU 2 HB2 LEU 2 6.373 -2.159 4.893
13 HB3 LEU 2 HB3 LEU 2 5.181 -0.868 5.148
14 HG LEU 2 HG LEU 2 8.046 -0.806 6.197
15 HD11 LEU 2 HD11 LEU 2 6.817 0.643 3.824
16 HD12 LEU 2 HD12 LEU 2 8.493 0.782 4.396
17 HD13 LEU 2 HD13 LEU 2 7.919 -0.753 3.710
18 HD21 LEU 2 HD21 LEU 2 5.892 1.341 5.998
19 HD22 LEU 2 HD22 LEU 2 6.459 0.574 7.502
20 HD23 LEU 2 HD23 LEU 2 7.561 1.596 6.555
21 H LYS 3 H LYS 3 3.221 -1.467 7.050
22 HA LYS 3 HA LYS 3 2.186 -4.003 6.085
23 HB2 LYS 3 HB2 LYS 3 2.773 -3.673 8.903
24 HB3 LYS 3 HB3 LYS 3 1.010 -3.677 8.680
25 HG2 LYS 3 HG2 LYS 3 1.109 -5.790 7.472
26 HG3 LYS 3 HG3 LYS 3 2.888 -5.765 7.516
27 HD2 LYS 3 HD2 LYS 3 2.801 -5.809 10.007
28 HD3 LYS 3 HD3 LYS 3 1.028 -5.945 9.924
29 HE2 LYS 3 HE2 LYS 3 1.237 -8.031 8.644
30 HE3 LYS 3 HE3 LYS 3 3.008 -7.897 8.659
31 HZ1 LYS 3 HZ1 LYS 3 1.407 -8.016 11.111
32 HZ2 LYS 3 HZ2 LYS 3 2.010 -9.369 10.368
33 HZ3 LYS 3 HZ3 LYS 3 3.026 -8.210 10.952
34 H LEU 4 H LEU 4 1.232 -2.397 4.587
35 HA LEU 4 HA LEU 4 0.171 0.042 5.794
36 HB2 LEU 4 HB2 LEU 4 0.710 -1.028 3.040
37 HB3 LEU 4 HB3 LEU 4 -0.525 0.232 3.212
38 HG LEU 4 HG LEU 4 1.090 1.654 4.457
39 HD11 LEU 4 HD11 LEU 4 3.072 -0.521 3.665
40 HD12 LEU 4 HD12 LEU 4 3.491 1.052 4.384
41 HD13 LEU 4 HD13 LEU 4 2.560 -0.134 5.323
42 HD21 LEU 4 HD21 LEU 4 0.778 1.886 2.009
43 HD22 LEU 4 HD22 LEU 4 2.453 2.247 2.485
44 HD23 LEU 4 HD23 LEU 4 2.059 0.682 1.736
45 H LYS 5 H LYS 5 -1.682 -0.034 6.829
46 HA LYS 5 HA LYS 5 -3.971 -1.631 5.964
47 HB2 LYS 5 HB2 LYS 5 -3.523 -1.091 8.363
48 HB3 LYS 5 HB3 LYS 5 -3.637 0.635 7.973
49 HG2 LYS 5 HG2 LYS 5 -6.003 0.103 7.080
50 HG3 LYS 5 HG3 LYS 5 -5.856 -1.441 7.952
51 HD2 LYS 5 HD2 LYS 5 -5.494 -0.244 10.059
52 HD3 LYS 5 HD3 LYS 5 -5.372 1.303 9.192
53 HE2 LYS 5 HE2 LYS 5 -7.746 0.987 8.398
54 HE3 LYS 5 HE3 LYS 5 -7.835 -0.445 9.444
55 HZ1 LYS 5 HZ1 LYS 5 -6.988 1.283 11.177
56 HZ2 LYS 5 HZ2 LYS 5 -7.686 2.353 10.166
57 HZ3 LYS 5 HZ3 LYS 5 -8.609 1.155 10.821
58 H VAL 6 H VAL 6 -4.266 -0.841 3.753
59 HA VAL 6 HA VAL 6 -4.386 1.929 3.129
60 HB VAL 6 HB VAL 6 -5.743 -0.399 1.710
61 HG11 VAL 6 HG11 VAL 6 -4.779 2.338 0.758
62 HG12 VAL 6 HG12 VAL 6 -5.485 1.071 -0.272
63 HG13 VAL 6 HG13 VAL 6 -6.478 1.857 0.975
64 HG21 VAL 6 HG21 VAL 6 -3.335 -0.829 2.061
65 HG22 VAL 6 HG22 VAL 6 -3.665 -0.459 0.355
66 HG23 VAL 6 HG23 VAL 6 -2.946 0.781 1.408
67 H GLU 7 H GLU 7 -5.749 3.324 4.049
68 HA GLU 7 HA GLU 7 -8.252 2.538 5.226
69 HB2 GLU 7 HB2 GLU 7 -6.769 4.413 6.002
70 HB3 GLU 7 HB3 GLU 7 -7.182 5.305 4.526
71 HG2 GLU 7 HG2 GLU 7 -8.577 6.040 6.412
72 HG3 GLU 7 HG3 GLU 7 -9.577 5.254 5.179
73 H GLY 8 H GLY 8 -10.370 3.043 4.540
74 HA2 GLY 8 HA2 GLY 8 -10.686 3.333 1.618
75 HA3 GLY 8 HA3 GLY 8 -11.938 2.876 2.796
76 H MET 9 H MET 9 -9.741 5.641 2.041
77 HA MET 9 HA MET 9 -11.314 7.565 3.439
78 HB2 MET 9 HB2 MET 9 -9.268 7.859 1.202
79 HB3 MET 9 HB3 MET 9 -9.885 9.192 2.202
80 HG2 MET 9 HG2 MET 9 -9.019 8.109 4.227
81 HG3 MET 9 HG3 MET 9 -8.476 6.723 3.273
82 HE1 MET 9 HE1 MET 9 -6.623 10.961 3.139
83 HE2 MET 9 HE2 MET 9 -8.232 10.608 2.471
84 HE3 MET 9 HE3 MET 9 -7.941 10.449 4.220
85 H THR 10 H THR 10 -11.293 6.467 0.020
86 HA THR 10 HA THR 10 -13.828 7.952 -0.347
87 HB THR 10 HB THR 10 -13.049 8.660 -2.616
88 HG1 THR 10 HG1 THR 10 -11.350 7.374 -3.048
89 HG21 THR 10 HG21 THR 10 -12.979 10.211 -0.682
90 HG22 THR 10 HG22 THR 10 -11.330 9.656 -0.305
91 HG23 THR 10 HG23 THR 10 -11.652 10.519 -1.825
92 H CYS 11 H CYS 11 -14.995 7.191 -2.327
93 HA CYS 11 HA CYS 11 -16.020 5.469 -3.399
94 HB2 CYS 11 HB2 CYS 11 -13.129 4.708 -3.947
95 HB3 CYS 11 HB3 CYS 11 -14.543 4.108 -4.843
96 HG CYS 11 HG CYS 11 -14.803 7.206 -4.463
97 H ASN 12 H ASN 12 -15.667 5.061 -0.553
98 HA ASN 12 HA ASN 12 -14.696 2.437 -0.008
99 HB2 ASN 12 HB2 ASN 12 -15.823 2.720 2.131
100 HB3 ASN 12 HB3 ASN 12 -15.013 4.232 1.683
101 HD21 ASN 12 HD21 ASN 12 -18.935 4.270 2.530
102 HD22 ASN 12 HD22 ASN 12 -17.814 3.001 2.973
103 H HIS 13 H HIS 13 -17.487 3.468 -1.719
104 HA HIS 13 HA HIS 13 -19.141 1.162 -0.977
105 HB2 HIS 13 HB2 HIS 13 -19.377 3.255 -3.174
106 HB3 HIS 13 HB3 HIS 13 -20.589 2.018 -2.816
107 HD1 HIS 13 HD1 HIS 13 -22.203 2.490 -0.785
108 HD2 HIS 13 HD2 HIS 13 -19.062 5.249 -1.297
109 HE1 HIS 13 HE1 HIS 13 -22.701 4.470 0.759
110 H CYS 14 H CYS 14 -16.409 1.715 -2.887
111 HA CYS 14 HA CYS 14 -16.972 -0.679 -4.550
112 HB2 CYS 14 HB2 CYS 14 -15.583 1.892 -5.409
113 HB3 CYS 14 HB3 CYS 14 -15.749 0.422 -6.398
114 HG CYS 14 HG CYS 14 -17.419 2.289 -7.191
115 H VAL 15 H VAL 15 -14.501 -0.952 -5.722
116 HA VAL 15 HA VAL 15 -12.516 -0.808 -3.544
117 HB VAL 15 HB VAL 15 -13.627 -3.011 -3.365
118 HG11 VAL 15 HG11 VAL 15 -12.578 -3.454 -6.193
119 HG12 VAL 15 HG12 VAL 15 -13.373 -4.669 -5.165
120 HG13 VAL 15 HG13 VAL 15 -14.289 -3.259 -5.743
121 HG21 VAL 15 HG21 VAL 15 -10.824 -3.290 -4.510
122 HG22 VAL 15 HG22 VAL 15 -11.178 -2.691 -2.866
123 HG23 VAL 15 HG23 VAL 15 -11.624 -4.347 -3.333
124 H MET 16 H MET 16 -10.328 -0.952 -4.329
125 HA MET 16 HA MET 16 -9.970 -0.785 -7.266
126 HB2 MET 16 HB2 MET 16 -9.070 1.260 -5.206
127 HB3 MET 16 HB3 MET 16 -8.439 1.196 -6.859
128 HG2 MET 16 HG2 MET 16 -11.408 1.255 -6.612
129 HG3 MET 16 HG3 MET 16 -10.559 2.697 -6.055
130 HE1 MET 16 HE1 MET 16 -11.531 4.498 -8.410
131 HE2 MET 16 HE2 MET 16 -12.272 3.300 -9.480
132 HE3 MET 16 HE3 MET 16 -12.502 3.163 -7.721
133 H ALA 17 H ALA 17 -7.641 -1.020 -7.843
134 HA ALA 17 HA ALA 17 -6.353 -2.943 -6.011
135 HB1 ALA 17 HB1 ALA 17 -6.570 -3.484 -8.418
136 HB2 ALA 17 HB2 ALA 17 -5.650 -2.016 -8.829
137 HB3 ALA 17 HB3 ALA 17 -4.864 -3.340 -7.935
138 H VAL 18 H VAL 18 -4.712 -2.353 -4.679
139 HA VAL 18 HA VAL 18 -3.616 0.378 -4.949
140 HB VAL 18 HB VAL 18 -3.261 -1.690 -2.767
141 HG11 VAL 18 HG11 VAL 18 -1.824 0.611 -3.094
142 HG12 VAL 18 HG12 VAL 18 -3.183 1.220 -2.157
143 HG13 VAL 18 HG13 VAL 18 -2.204 -0.108 -1.500
144 HG21 VAL 18 HG21 VAL 18 -5.694 -0.967 -3.242
145 HG22 VAL 18 HG22 VAL 18 -5.093 -0.772 -1.571
146 HG23 VAL 18 HG23 VAL 18 -5.204 0.627 -2.664
147 H THR 19 H THR 19 -2.854 -2.892 -5.709
148 HA THR 19 HA THR 19 -0.202 -3.165 -5.111
149 HB THR 19 HB THR 19 -1.553 -4.090 -7.669
150 HG1 THR 19 HG1 THR 19 -2.042 -5.915 -6.267
151 HG21 THR 19 HG21 THR 19 0.630 -5.369 -5.971
152 HG22 THR 19 HG22 THR 19 -0.032 -5.991 -7.494
153 HG23 THR 19 HG23 THR 19 0.918 -4.489 -7.495
154 H LYS 20 H LYS 20 -1.532 -1.432 -7.987
155 HA LYS 20 HA LYS 20 1.018 -1.131 -9.249
156 HB2 LYS 20 HB2 LYS 20 -1.565 0.459 -9.493
157 HB3 LYS 20 HB3 LYS 20 -0.166 0.633 -10.571
158 HG2 LYS 20 HG2 LYS 20 -0.348 -1.723 -11.240
159 HG3 LYS 20 HG3 LYS 20 -1.719 -1.953 -10.127
160 HD2 LYS 20 HD2 LYS 20 -3.034 -0.286 -11.363
161 HD3 LYS 20 HD3 LYS 20 -1.658 0.025 -12.447
162 HE2 LYS 20 HE2 LYS 20 -1.720 -2.293 -13.243
163 HE3 LYS 20 HE3 LYS 20 -3.034 -2.673 -12.111
164 HZ1 LYS 20 HZ1 LYS 20 -3.811 -2.221 -14.343
165 HZ2 LYS 20 HZ2 LYS 20 -4.424 -1.144 -13.258
166 HZ3 LYS 20 HZ3 LYS 20 -3.205 -0.689 -14.272
167 H ALA 21 H ALA 21 -0.494 0.588 -6.569
168 HA ALA 21 HA ALA 21 1.007 3.036 -6.952
169 HB1 ALA 21 HB1 ALA 21 -0.380 1.907 -4.494
170 HB2 ALA 21 HB2 ALA 21 0.158 3.585 -4.727
171 HB3 ALA 21 HB3 ALA 21 -1.143 2.921 -5.740
172 H LEU 22 H LEU 22 1.487 -0.005 -5.110
173 HA LEU 22 HA LEU 22 3.595 1.060 -3.500
174 HB2 LEU 22 HB2 LEU 22 2.657 -1.744 -4.188
175 HB3 LEU 22 HB3 LEU 22 4.064 -1.448 -3.162
176 HG LEU 22 HG LEU 22 2.197 -1.826 -1.736
177 HD11 LEU 22 HD11 LEU 22 3.826 0.018 -1.147
178 HD12 LEU 22 HD12 LEU 22 2.621 1.178 -1.747
179 HD13 LEU 22 HD13 LEU 22 2.230 0.137 -0.364
180 HD21 LEU 22 HD21 LEU 22 0.768 0.465 -3.136
181 HD22 LEU 22 HD22 LEU 22 0.389 -1.268 -3.320
182 HD23 LEU 22 HD23 LEU 22 0.171 -0.468 -1.749
183 H LYS 23 H LYS 23 3.602 -0.778 -6.589
184 HA LYS 23 HA LYS 23 6.348 -1.422 -6.477
185 HB2 LYS 23 HB2 LYS 23 4.540 -2.446 -7.921
186 HB3 LYS 23 HB3 LYS 23 4.721 -1.051 -9.011
187 HG2 LYS 23 HG2 LYS 23 7.115 -1.593 -9.306
188 HG3 LYS 23 HG3 LYS 23 6.969 -2.928 -8.141
189 HD2 LYS 23 HD2 LYS 23 5.331 -4.041 -9.626
190 HD3 LYS 23 HD3 LYS 23 5.491 -2.711 -10.799
191 HE2 LYS 23 HE2 LYS 23 7.886 -3.208 -11.058
192 HE3 LYS 23 HE3 LYS 23 7.771 -4.490 -9.836
193 HZ1 LYS 23 HZ1 LYS 23 6.333 -4.450 -12.396
194 HZ2 LYS 23 HZ2 LYS 23 7.675 -5.349 -12.062
195 HZ3 LYS 23 HZ3 LYS 23 6.264 -5.649 -11.264
196 H LYS 24 H LYS 24 4.814 1.624 -7.325
197 HA LYS 24 HA LYS 24 6.819 2.538 -9.119
198 HB2 LYS 24 HB2 LYS 24 4.984 4.108 -7.269
199 HB3 LYS 24 HB3 LYS 24 5.883 4.777 -8.652
200 HG2 LYS 24 HG2 LYS 24 4.692 3.234 -10.180
201 HG3 LYS 24 HG3 LYS 24 3.803 2.554 -8.798
202 HD2 LYS 24 HD2 LYS 24 2.880 4.817 -8.310
203 HD3 LYS 24 HD3 LYS 24 3.699 5.441 -9.762
204 HE2 LYS 24 HE2 LYS 24 2.437 3.843 -11.164
205 HE3 LYS 24 HE3 LYS 24 1.645 3.190 -9.715
206 HZ1 LYS 24 HZ1 LYS 24 1.411 5.942 -10.716
207 HZ2 LYS 24 HZ2 LYS 24 0.255 4.772 -10.803
208 HZ3 LYS 24 HZ3 LYS 24 0.714 5.368 -9.336
209 H VAL 25 H VAL 25 6.922 2.136 -5.642
210 HA VAL 25 HA VAL 25 8.953 4.191 -5.261
211 HB VAL 25 HB VAL 25 7.841 1.956 -3.544
212 HG11 VAL 25 HG11 VAL 25 9.083 2.981 -1.665
213 HG12 VAL 25 HG12 VAL 25 10.187 2.334 -2.901
214 HG13 VAL 25 HG13 VAL 25 9.889 4.086 -2.804
215 HG21 VAL 25 HG21 VAL 25 7.675 4.968 -3.190
216 HG22 VAL 25 HG22 VAL 25 6.457 4.035 -4.113
217 HG23 VAL 25 HG23 VAL 25 6.724 3.723 -2.381
218 HA PRO 26 HA PRO 26 12.334 1.801 -6.843
219 HB2 PRO 26 HB2 PRO 26 13.790 3.446 -4.773
220 HB3 PRO 26 HB3 PRO 26 14.255 3.131 -6.478
221 HG2 PRO 26 HG2 PRO 26 13.133 5.498 -5.805
222 HG3 PRO 26 HG3 PRO 26 12.571 4.635 -7.280
223 HD2 PRO 26 HD2 PRO 26 11.280 4.721 -4.547
224 HD3 PRO 26 HD3 PRO 26 10.520 4.860 -6.166
225 H GLY 27 H GLY 27 13.359 -0.096 -6.226
226 HA2 GLY 27 HA2 GLY 27 14.445 -1.552 -4.746
227 HA3 GLY 27 HA3 GLY 27 13.801 -0.643 -3.366
228 H VAL 28 H VAL 28 11.032 -0.722 -4.795
229 HA VAL 28 HA VAL 28 10.170 -3.220 -3.550
230 HB VAL 28 HB VAL 28 8.736 -1.074 -5.168
231 HG11 VAL 28 HG11 VAL 28 7.597 -3.232 -5.453
232 HG12 VAL 28 HG12 VAL 28 7.616 -3.489 -3.691
233 HG13 VAL 28 HG13 VAL 28 6.652 -2.167 -4.388
234 HG21 VAL 28 HG21 VAL 28 8.730 -1.772 -2.198
235 HG22 VAL 28 HG22 VAL 28 9.529 -0.362 -2.936
236 HG23 VAL 28 HG23 VAL 28 7.757 -0.496 -2.967
237 H GLU 29 H GLU 29 10.027 -5.163 -4.565
238 HA GLU 29 HA GLU 29 9.944 -5.118 -7.531
239 HB2 GLU 29 HB2 GLU 29 11.857 -6.207 -7.697
240 HB3 GLU 29 HB3 GLU 29 12.111 -5.947 -5.963
241 HG2 GLU 29 HG2 GLU 29 10.982 -8.076 -5.469
242 HG3 GLU 29 HG3 GLU 29 10.659 -8.324 -7.201
243 H LYS 30 H LYS 30 8.798 -6.485 -4.508
244 HA LYS 30 HA LYS 30 6.787 -8.015 -6.093
245 HB2 LYS 30 HB2 LYS 30 8.186 -8.792 -3.506
246 HB3 LYS 30 HB3 LYS 30 6.745 -9.613 -4.139
247 HG2 LYS 30 HG2 LYS 30 7.941 -10.259 -6.166
248 HG3 LYS 30 HG3 LYS 30 9.372 -9.338 -5.653
249 HD2 LYS 30 HD2 LYS 30 9.589 -10.787 -3.654
250 HD3 LYS 30 HD3 LYS 30 8.177 -11.726 -4.188
251 HE2 LYS 30 HE2 LYS 30 9.366 -12.318 -6.280
252 HE3 LYS 30 HE3 LYS 30 10.776 -11.381 -5.741
253 HZ1 LYS 30 HZ1 LYS 30 9.652 -13.732 -4.380
254 HZ2 LYS 30 HZ2 LYS 30 11.039 -13.700 -5.272
255 HZ3 LYS 30 HZ3 LYS 30 10.945 -12.857 -3.861
256 H VAL 31 H VAL 31 4.663 -7.929 -5.263
257 HA VAL 31 HA VAL 31 4.173 -6.274 -2.871
258 HB VAL 31 HB VAL 31 3.053 -5.669 -5.643
259 HG11 VAL 31 HG11 VAL 31 1.427 -5.307 -3.785
260 HG12 VAL 31 HG12 VAL 31 2.612 -4.251 -2.987
261 HG13 VAL 31 HG13 VAL 31 1.924 -3.784 -4.559
262 HG21 VAL 31 HG21 VAL 31 4.217 -3.490 -5.370
263 HG22 VAL 31 HG22 VAL 31 4.939 -4.078 -3.855
264 HG23 VAL 31 HG23 VAL 31 5.359 -4.849 -5.403
265 H GLU 32 H GLU 32 2.155 -6.771 -1.900
266 HA GLU 32 HA GLU 32 0.318 -8.535 -3.349
267 HB2 GLU 32 HB2 GLU 32 1.993 -10.062 -2.253
268 HB3 GLU 32 HB3 GLU 32 1.526 -9.359 -0.690
269 HG2 GLU 32 HG2 GLU 32 -0.038 -10.987 -0.629
270 HG3 GLU 32 HG3 GLU 32 -0.942 -9.979 -1.770
271 H VAL 33 H VAL 33 -1.774 -8.033 -2.832
272 HA VAL 33 HA VAL 33 -2.194 -6.462 -0.338
273 HB VAL 33 HB VAL 33 -3.843 -5.107 -1.571
274 HG11 VAL 33 HG11 VAL 33 -1.094 -5.150 -2.885
275 HG12 VAL 33 HG12 VAL 33 -2.249 -3.799 -2.927
276 HG13 VAL 33 HG13 VAL 33 -1.527 -4.296 -1.382
277 HG21 VAL 33 HG21 VAL 33 -2.817 -6.609 -4.016
278 HG22 VAL 33 HG22 VAL 33 -4.441 -6.756 -3.304
279 HG23 VAL 33 HG23 VAL 33 -3.930 -5.221 -4.037
280 H SER 34 H SER 34 -4.332 -6.607 0.558
281 HA SER 34 HA SER 34 -5.932 -8.908 -0.435
282 HB2 SER 34 HB2 SER 34 -4.643 -9.629 1.536
283 HB3 SER 34 HB3 SER 34 -5.281 -8.251 2.465
284 HG SER 34 HG SER 34 -6.451 -10.250 2.744
285 H LEU 35 H LEU 35 -7.576 -7.794 -1.364
286 HA LEU 35 HA LEU 35 -8.432 -5.225 -0.500
287 HB2 LEU 35 HB2 LEU 35 -9.892 -7.317 -2.157
288 HB3 LEU 35 HB3 LEU 35 -10.275 -5.586 -2.092
289 HG LEU 35 HG LEU 35 -7.618 -6.752 -3.064
290 HD11 LEU 35 HD11 LEU 35 -9.136 -7.285 -4.772
291 HD12 LEU 35 HD12 LEU 35 -10.153 -5.842 -4.459
292 HD13 LEU 35 HD13 LEU 35 -8.568 -5.687 -5.253
293 HD21 LEU 35 HD21 LEU 35 -7.248 -4.426 -3.857
294 HD22 LEU 35 HD22 LEU 35 -8.775 -3.930 -3.092
295 HD23 LEU 35 HD23 LEU 35 -7.413 -4.489 -2.091
296 H GLU 36 H GLU 36 -9.262 -8.456 0.610
297 HA GLU 36 HA GLU 36 -11.787 -7.573 1.795
298 HB2 GLU 36 HB2 GLU 36 -10.207 -10.169 1.970
299 HB3 GLU 36 HB3 GLU 36 -11.802 -9.896 2.710
300 HG2 GLU 36 HG2 GLU 36 -12.739 -9.348 0.478
301 HG3 GLU 36 HG3 GLU 36 -11.159 -9.677 -0.260
302 H LYS 37 H LYS 37 -8.397 -7.967 2.780
303 HA LYS 37 HA LYS 37 -9.206 -7.641 5.607
304 HB2 LYS 37 HB2 LYS 37 -6.543 -8.338 4.322
305 HB3 LYS 37 HB3 LYS 37 -6.814 -8.150 6.070
306 HG2 LYS 37 HG2 LYS 37 -8.573 -9.898 5.985
307 HG3 LYS 37 HG3 LYS 37 -8.260 -10.126 4.251
308 HD2 LYS 37 HD2 LYS 37 -5.942 -10.808 4.745
309 HD3 LYS 37 HD3 LYS 37 -6.220 -10.528 6.482
310 HE2 LYS 37 HE2 LYS 37 -8.009 -12.230 6.479
311 HE3 LYS 37 HE3 LYS 37 -7.758 -12.505 4.745
312 HZ1 LYS 37 HZ1 LYS 37 -6.635 -14.130 6.078
313 HZ2 LYS 37 HZ2 LYS 37 -5.543 -13.232 5.236
314 HZ3 LYS 37 HZ3 LYS 37 -5.762 -12.969 6.853
315 H GLY 38 H GLY 38 -8.274 -5.688 2.967
316 HA2 GLY 38 HA2 GLY 38 -7.962 -3.409 2.919
317 HA3 GLY 38 HA3 GLY 38 -8.229 -3.371 4.668
318 H GLU 39 H GLU 39 -5.712 -5.492 3.380
319 HA GLU 39 HA GLU 39 -3.706 -3.587 4.510
320 HB2 GLU 39 HB2 GLU 39 -3.699 -6.627 4.440
321 HB3 GLU 39 HB3 GLU 39 -2.379 -5.598 5.039
322 HG2 GLU 39 HG2 GLU 39 -4.003 -4.564 6.660
323 HG3 GLU 39 HG3 GLU 39 -5.216 -5.748 6.138
324 H ALA 40 H ALA 40 -1.599 -3.614 3.596
325 HA ALA 40 HA ALA 40 -1.345 -4.641 0.838
326 HB1 ALA 40 HB1 ALA 40 -2.219 -2.356 0.618
327 HB2 ALA 40 HB2 ALA 40 -0.946 -1.747 1.700
328 HB3 ALA 40 HB3 ALA 40 -0.517 -2.413 0.108
329 H LEU 41 H LEU 41 0.389 -5.900 0.980
330 HA LEU 41 HA LEU 41 2.646 -5.075 2.737
331 HB2 LEU 41 HB2 LEU 41 1.913 -7.802 1.584
332 HB3 LEU 41 HB3 LEU 41 3.290 -7.449 2.625
333 HG LEU 41 HG LEU 41 1.679 -8.449 4.021
334 HD11 LEU 41 HD11 LEU 41 1.575 -5.424 4.341
335 HD12 LEU 41 HD12 LEU 41 0.911 -6.571 5.537
336 HD13 LEU 41 HD13 LEU 41 2.649 -6.570 5.157
337 HD21 LEU 41 HD21 LEU 41 -0.643 -7.829 4.165
338 HD22 LEU 41 HD22 LEU 41 -0.419 -6.483 3.037
339 HD23 LEU 41 HD23 LEU 41 -0.249 -8.161 2.464
340 H VAL 42 H VAL 42 4.770 -5.212 1.930
341 HA VAL 42 HA VAL 42 5.076 -5.716 -0.972
342 HB VAL 42 HB VAL 42 6.564 -3.787 -1.162
343 HG11 VAL 42 HG11 VAL 42 4.901 -2.108 -1.292
344 HG12 VAL 42 HG12 VAL 42 4.040 -3.633 -1.528
345 HG13 VAL 42 HG13 VAL 42 3.954 -2.817 0.051
346 HG21 VAL 42 HG21 VAL 42 5.701 -3.114 1.683
347 HG22 VAL 42 HG22 VAL 42 7.317 -3.680 1.199
348 HG23 VAL 42 HG23 VAL 42 6.721 -2.110 0.624
349 H GLU 43 H GLU 43 7.411 -6.122 -1.522
350 HA GLU 43 HA GLU 43 9.061 -6.831 0.820
351 HB2 GLU 43 HB2 GLU 43 7.842 -8.886 0.091
352 HB3 GLU 43 HB3 GLU 43 8.609 -8.737 -1.506
353 HG2 GLU 43 HG2 GLU 43 10.839 -8.872 -0.452
354 HG3 GLU 43 HG3 GLU 43 10.086 -8.947 1.153
355 H GLY 44 H GLY 44 10.311 -5.023 0.393
356 HA2 GLY 44 HA2 GLY 44 12.152 -5.256 -1.877
357 HA3 GLY 44 HA3 GLY 44 11.113 -3.815 -1.859
358 H THR 45 H THR 45 13.495 -2.967 -1.761
359 HA THR 45 HA THR 45 14.363 -2.781 1.079
360 HB THR 45 HB THR 45 16.573 -2.240 0.104
361 HG1 THR 45 HG1 THR 45 16.822 -2.622 -2.144
362 HG21 THR 45 HG21 THR 45 15.597 -4.645 0.561
363 HG22 THR 45 HG22 THR 45 15.634 -4.793 -1.197
364 HG23 THR 45 HG23 THR 45 17.149 -4.472 -0.320
365 H ALA 46 H ALA 46 12.205 -1.164 -0.225
366 HA ALA 46 HA ALA 46 13.325 1.435 -0.817
367 HB1 ALA 46 HB1 ALA 46 10.967 2.141 -0.776
368 HB2 ALA 46 HB2 ALA 46 11.151 0.632 -1.705
369 HB3 ALA 46 HB3 ALA 46 10.500 0.586 -0.050
370 H ASP 47 H ASP 47 12.531 3.414 0.508
371 HA ASP 47 HA ASP 47 13.308 2.999 3.292
372 HB2 ASP 47 HB2 ASP 47 12.356 5.442 1.745
373 HB3 ASP 47 HB3 ASP 47 12.898 5.471 3.434
374 HA PRO 48 HA PRO 48 9.361 2.469 5.093
375 HB2 PRO 48 HB2 PRO 48 10.157 4.655 7.006
376 HB3 PRO 48 HB3 PRO 48 9.507 3.024 7.378
377 HG2 PRO 48 HG2 PRO 48 12.151 3.529 7.662
378 HG3 PRO 48 HG3 PRO 48 11.610 2.001 6.883
379 HD2 PRO 48 HD2 PRO 48 12.589 4.539 5.560
380 HD3 PRO 48 HD3 PRO 48 12.990 2.834 5.176
381 H LYS 49 H LYS 49 10.374 5.931 4.917
382 HA LYS 49 HA LYS 49 7.661 6.923 4.996
383 HB2 LYS 49 HB2 LYS 49 8.948 9.030 4.073
384 HB3 LYS 49 HB3 LYS 49 9.246 8.478 5.733
385 HG2 LYS 49 HG2 LYS 49 11.281 7.323 5.075
386 HG3 LYS 49 HG3 LYS 49 10.957 7.666 3.359
387 HD2 LYS 49 HD2 LYS 49 11.054 10.115 3.877
388 HD3 LYS 49 HD3 LYS 49 11.552 9.707 5.537
389 HE2 LYS 49 HE2 LYS 49 13.516 8.494 4.646
390 HE3 LYS 49 HE3 LYS 49 12.996 8.860 2.989
391 HZ1 LYS 49 HZ1 LYS 49 13.755 10.832 5.026
392 HZ2 LYS 49 HZ2 LYS 49 14.660 10.380 3.724
393 HZ3 LYS 49 HZ3 LYS 49 13.236 11.183 3.498
394 H ALA 50 H ALA 50 9.905 5.927 2.420
395 HA ALA 50 HA ALA 50 8.650 7.396 0.328
396 HB1 ALA 50 HB1 ALA 50 10.922 6.448 0.176
397 HB2 ALA 50 HB2 ALA 50 10.246 4.802 0.240
398 HB3 ALA 50 HB3 ALA 50 9.894 5.858 -1.149
399 H LEU 51 H LEU 51 8.011 4.197 1.779
400 HA LEU 51 HA LEU 51 6.258 3.356 -0.329
401 HB2 LEU 51 HB2 LEU 51 7.516 1.978 1.521
402 HB3 LEU 51 HB3 LEU 51 6.101 2.372 2.524
403 HG LEU 51 HG LEU 51 4.715 1.530 0.468
404 HD11 LEU 51 HD11 LEU 51 5.917 -0.154 -0.903
405 HD12 LEU 51 HD12 LEU 51 6.678 1.443 -1.080
406 HD13 LEU 51 HD13 LEU 51 7.426 0.213 -0.039
407 HD21 LEU 51 HD21 LEU 51 4.963 0.362 2.679
408 HD22 LEU 51 HD22 LEU 51 4.769 -0.751 1.300
409 HD23 LEU 51 HD23 LEU 51 6.374 -0.490 2.021
410 H VAL 52 H VAL 52 5.676 4.617 3.006
411 HA VAL 52 HA VAL 52 2.837 4.559 2.753
412 HB VAL 52 HB VAL 52 4.603 6.195 4.617
413 HG11 VAL 52 HG11 VAL 52 2.238 6.915 4.622
414 HG12 VAL 52 HG12 VAL 52 1.718 5.228 4.850
415 HG13 VAL 52 HG13 VAL 52 2.634 6.059 6.128
416 HG21 VAL 52 HG21 VAL 52 4.308 4.292 6.171
417 HG22 VAL 52 HG22 VAL 52 3.426 3.398 4.911
418 HG23 VAL 52 HG23 VAL 52 5.149 3.784 4.691
419 H GLN 53 H GLN 53 5.265 6.904 1.702
420 HA GLN 53 HA GLN 53 3.333 9.085 1.540
421 HB2 GLN 53 HB2 GLN 53 5.745 9.485 1.904
422 HB3 GLN 53 HB3 GLN 53 6.112 8.730 0.336
423 HG2 GLN 53 HG2 GLN 53 4.786 10.464 -0.818
424 HG3 GLN 53 HG3 GLN 53 4.364 11.192 0.744
425 HE21 GLN 53 HE21 GLN 53 8.235 11.571 -0.734
426 HE22 GLN 53 HE22 GLN 53 7.246 10.200 -1.197
427 H ALA 54 H ALA 54 4.667 6.556 -0.575
428 HA ALA 54 HA ALA 54 3.791 7.612 -3.045
429 HB1 ALA 54 HB1 ALA 54 4.054 5.281 -3.836
430 HB2 ALA 54 HB2 ALA 54 5.427 5.814 -2.838
431 HB3 ALA 54 HB3 ALA 54 4.191 4.741 -2.143
432 H VAL 55 H VAL 55 2.090 5.422 -0.692
433 HA VAL 55 HA VAL 55 -0.180 5.154 -2.478
434 HB VAL 55 HB VAL 55 -1.306 4.214 -0.464
435 HG11 VAL 55 HG11 VAL 55 0.148 2.269 -0.190
436 HG12 VAL 55 HG12 VAL 55 0.143 2.791 -1.888
437 HG13 VAL 55 HG13 VAL 55 1.530 3.178 -0.838
438 HG21 VAL 55 HG21 VAL 55 -0.257 5.676 1.242
439 HG22 VAL 55 HG22 VAL 55 -0.044 3.957 1.633
440 HG23 VAL 55 HG23 VAL 55 1.311 4.883 0.950
441 H GLU 56 H GLU 56 0.865 7.500 -0.047
442 HA GLU 56 HA GLU 56 -1.740 8.695 0.290
443 HB2 GLU 56 HB2 GLU 56 0.093 8.893 1.943
444 HB3 GLU 56 HB3 GLU 56 1.060 9.804 0.764
445 HG2 GLU 56 HG2 GLU 56 -0.679 11.555 0.680
446 HG3 GLU 56 HG3 GLU 56 -1.671 10.637 1.829
447 H GLU 57 H GLU 57 0.781 8.812 -2.119
448 HA GLU 57 HA GLU 57 0.139 11.361 -3.265
449 HB2 GLU 57 HB2 GLU 57 2.261 10.075 -3.612
450 HB3 GLU 57 HB3 GLU 57 1.343 8.874 -4.542
451 HG2 GLU 57 HG2 GLU 57 0.686 10.631 -6.160
452 HG3 GLU 57 HG3 GLU 57 1.634 11.819 -5.237
453 H GLU 58 H GLU 58 -1.299 8.163 -3.362
454 HA GLU 58 HA GLU 58 -2.968 8.813 -5.705
455 HB2 GLU 58 HB2 GLU 58 -2.822 6.393 -3.865
456 HB3 GLU 58 HB3 GLU 58 -3.897 6.530 -5.273
457 HG2 GLU 58 HG2 GLU 58 -0.856 6.715 -5.361
458 HG3 GLU 58 HG3 GLU 58 -1.816 5.292 -5.813
459 H GLY 59 H GLY 59 -2.917 9.436 -2.380
460 HA2 GLY 59 HA2 GLY 59 -4.569 10.785 -1.352
461 HA3 GLY 59 HA3 GLY 59 -5.784 10.167 -2.484
462 H TYR 60 H TYR 60 -3.818 7.623 -1.270
463 HA TYR 60 HA TYR 60 -5.881 7.017 0.799
464 HB2 TYR 60 HB2 TYR 60 -4.570 5.208 -1.247
465 HB3 TYR 60 HB3 TYR 60 -5.445 4.613 0.165
466 HD1 TYR 60 HD1 TYR 60 -5.761 5.924 -3.205
467 HD2 TYR 60 HD2 TYR 60 -7.871 5.104 0.445
468 HE1 TYR 60 HE1 TYR 60 -7.906 5.930 -4.450
469 HE2 TYR 60 HE2 TYR 60 -10.022 5.095 -0.786
470 HH TYR 60 HH TYR 60 -11.039 5.256 -2.829
471 H LYS 61 H LYS 61 -4.719 7.650 2.589
472 HA LYS 61 HA LYS 61 -1.954 6.964 3.019
473 HB2 LYS 61 HB2 LYS 61 -4.229 7.767 4.881
474 HB3 LYS 61 HB3 LYS 61 -2.535 7.595 5.393
475 HG2 LYS 61 HG2 LYS 61 -1.834 9.284 3.758
476 HG3 LYS 61 HG3 LYS 61 -3.503 9.444 3.169
477 HD2 LYS 61 HD2 LYS 61 -4.237 10.268 5.354
478 HD3 LYS 61 HD3 LYS 61 -2.603 10.021 6.021
479 HE2 LYS 61 HE2 LYS 61 -1.678 11.637 4.421
480 HE3 LYS 61 HE3 LYS 61 -3.278 11.857 3.684
481 HZ1 LYS 61 HZ1 LYS 61 -2.723 13.582 5.252
482 HZ2 LYS 61 HZ2 LYS 61 -4.060 12.746 5.728
483 HZ3 LYS 61 HZ3 LYS 61 -2.609 12.484 6.475
484 H ALA 62 H ALA 62 -1.315 5.508 4.958
485 HA ALA 62 HA ALA 62 -3.163 3.281 5.412
486 HB1 ALA 62 HB1 ALA 62 -2.160 2.709 3.240
487 HB2 ALA 62 HB2 ALA 62 -0.533 2.928 3.923
488 HB3 ALA 62 HB3 ALA 62 -1.577 1.609 4.511
489 H GLU 63 H GLU 63 -3.006 2.907 7.527
490 HA GLU 63 HA GLU 63 -0.795 3.748 9.136
491 HB2 GLU 63 HB2 GLU 63 -3.123 1.853 9.650
492 HB3 GLU 63 HB3 GLU 63 -2.000 2.411 10.902
493 HG2 GLU 63 HG2 GLU 63 -2.688 4.715 10.587
494 HG3 GLU 63 HG3 GLU 63 -3.684 4.271 9.188
495 H VAL 64 H VAL 64 1.193 2.816 8.894
496 HA VAL 64 HA VAL 64 1.669 0.090 8.248
497 HB VAL 64 HB VAL 64 3.943 0.570 9.178
498 HG11 VAL 64 HG11 VAL 64 3.353 1.097 6.849
499 HG12 VAL 64 HG12 VAL 64 2.747 2.694 7.349
500 HG13 VAL 64 HG13 VAL 64 4.477 2.309 7.503
501 HG21 VAL 64 HG21 VAL 64 2.725 3.299 9.802
502 HG22 VAL 64 HG22 VAL 64 3.370 2.141 10.991
503 HG23 VAL 64 HG23 VAL 64 4.459 2.915 9.827
504 H LEU 65 H LEU 65 0.889 -1.593 9.429
505 HA LEU 65 HA LEU 65 0.365 -1.245 12.284
506 HB2 LEU 65 HB2 LEU 65 0.164 -3.696 10.484
507 HB3 LEU 65 HB3 LEU 65 -0.434 -3.582 12.146
508 HG LEU 65 HG LEU 65 -1.386 -1.871 9.810
509 HD11 LEU 65 HD11 LEU 65 -2.712 -4.166 11.313
510 HD12 LEU 65 HD12 LEU 65 -3.462 -3.189 10.028
511 HD13 LEU 65 HD13 LEU 65 -2.077 -4.239 9.652
512 HD21 LEU 65 HD21 LEU 65 -1.556 -0.681 11.963
513 HD22 LEU 65 HD22 LEU 65 -3.165 -1.173 11.399
514 HD23 LEU 65 HD23 LEU 65 -2.360 -2.094 12.692
515 H ALA 66 H ALA 66 2.678 -0.707 12.749
516 HA ALA 66 HA ALA 66 4.159 -3.193 13.372
517 HB1 ALA 66 HB1 ALA 66 5.089 -2.340 11.252
518 HB2 ALA 66 HB2 ALA 66 5.333 -0.742 11.995
519 HB3 ALA 66 HB3 ALA 66 6.255 -2.146 12.582
Start of MODEL 2
1 H1 MET 1 H MET 1 8.753 -4.817 10.159
2 HA MET 1 HA MET 1 9.465 -4.668 7.287
3 HB2 MET 1 HB2 MET 1 9.240 -6.995 8.069
4 HB3 MET 1 HB3 MET 1 7.614 -6.632 8.691
5 HG2 MET 1 HG2 MET 1 6.880 -6.018 6.417
6 HG3 MET 1 HG3 MET 1 8.503 -6.348 5.796
7 HE1 MET 1 HE1 MET 1 7.496 -7.851 3.920
8 HE2 MET 1 HE2 MET 1 6.365 -9.193 4.208
9 HE3 MET 1 HE3 MET 1 5.859 -7.519 4.534
10 H LEU 2 H LEU 2 8.357 -3.151 6.221
11 HA LEU 2 HA LEU 2 6.282 -1.634 7.407
12 HB2 LEU 2 HB2 LEU 2 7.052 -2.065 4.493
13 HB3 LEU 2 HB3 LEU 2 5.934 -0.806 5.060
14 HG LEU 2 HG LEU 2 8.812 -1.098 6.028
15 HD11 LEU 2 HD11 LEU 2 8.706 -0.512 3.622
16 HD12 LEU 2 HD12 LEU 2 7.616 0.842 4.008
17 HD13 LEU 2 HD13 LEU 2 9.291 0.848 4.605
18 HD21 LEU 2 HD21 LEU 2 6.715 1.099 6.334
19 HD22 LEU 2 HD22 LEU 2 7.321 0.038 7.629
20 HD23 LEU 2 HD23 LEU 2 8.406 1.217 6.867
21 H LYS 3 H LYS 3 4.121 -1.799 7.442
22 HA LYS 3 HA LYS 3 2.735 -3.817 5.801
23 HB2 LYS 3 HB2 LYS 3 3.498 -4.923 7.921
24 HB3 LYS 3 HB3 LYS 3 2.578 -3.720 8.845
25 HG2 LYS 3 HG2 LYS 3 0.491 -4.484 7.737
26 HG3 LYS 3 HG3 LYS 3 1.430 -5.667 6.796
27 HD2 LYS 3 HD2 LYS 3 2.211 -6.713 8.910
28 HD3 LYS 3 HD3 LYS 3 1.225 -5.559 9.836
29 HE2 LYS 3 HE2 LYS 3 -0.815 -6.419 8.737
30 HE3 LYS 3 HE3 LYS 3 0.170 -7.551 7.787
31 HZ1 LYS 3 HZ1 LYS 3 -0.063 -7.513 10.714
32 HZ2 LYS 3 HZ2 LYS 3 -0.768 -8.608 9.699
33 HZ3 LYS 3 HZ3 LYS 3 0.873 -8.554 9.842
34 H LEU 4 H LEU 4 1.914 -1.927 4.769
35 HA LEU 4 HA LEU 4 0.874 0.302 6.206
36 HB2 LEU 4 HB2 LEU 4 0.342 -0.625 3.360
37 HB3 LEU 4 HB3 LEU 4 0.051 1.004 3.998
38 HG LEU 4 HG LEU 4 2.766 -0.371 3.819
39 HD11 LEU 4 HD11 LEU 4 3.188 1.329 2.071
40 HD12 LEU 4 HD12 LEU 4 1.828 0.272 1.631
41 HD13 LEU 4 HD13 LEU 4 1.519 1.917 2.239
42 HD21 LEU 4 HD21 LEU 4 1.987 2.458 4.645
43 HD22 LEU 4 HD22 LEU 4 2.636 1.200 5.724
44 HD23 LEU 4 HD23 LEU 4 3.649 1.864 4.424
45 H LYS 5 H LYS 5 -1.333 1.156 5.820
46 HA LYS 5 HA LYS 5 -3.521 -0.780 5.571
47 HB2 LYS 5 HB2 LYS 5 -2.948 -0.816 7.996
48 HB3 LYS 5 HB3 LYS 5 -3.120 0.953 8.049
49 HG2 LYS 5 HG2 LYS 5 -5.489 0.706 7.271
50 HG3 LYS 5 HG3 LYS 5 -5.299 -1.061 7.338
51 HD2 LYS 5 HD2 LYS 5 -4.786 -0.907 9.757
52 HD3 LYS 5 HD3 LYS 5 -4.946 0.863 9.676
53 HE2 LYS 5 HE2 LYS 5 -7.304 0.558 8.872
54 HE3 LYS 5 HE3 LYS 5 -7.122 -1.191 9.114
55 HZ1 LYS 5 HZ1 LYS 5 -8.153 -0.171 10.988
56 HZ2 LYS 5 HZ2 LYS 5 -6.667 -0.737 11.429
57 HZ3 LYS 5 HZ3 LYS 5 -6.895 0.879 11.183
58 H VAL 6 H VAL 6 -4.243 0.326 3.746
59 HA VAL 6 HA VAL 6 -4.170 3.136 3.421
60 HB VAL 6 HB VAL 6 -6.031 1.086 2.149
61 HG11 VAL 6 HG11 VAL 6 -6.739 3.370 1.616
62 HG12 VAL 6 HG12 VAL 6 -5.061 3.829 1.231
63 HG13 VAL 6 HG13 VAL 6 -5.932 2.665 0.206
64 HG21 VAL 6 HG21 VAL 6 -4.280 0.980 0.389
65 HG22 VAL 6 HG22 VAL 6 -3.249 2.053 1.359
66 HG23 VAL 6 HG23 VAL 6 -3.659 0.429 1.959
67 H GLU 7 H GLU 7 -6.287 4.457 3.062
68 HA GLU 7 HA GLU 7 -8.148 3.902 5.323
69 HB2 GLU 7 HB2 GLU 7 -6.561 5.696 5.880
70 HB3 GLU 7 HB3 GLU 7 -6.957 6.535 4.370
71 HG2 GLU 7 HG2 GLU 7 -8.127 7.586 6.215
72 HG3 GLU 7 HG3 GLU 7 -9.303 6.805 5.146
73 H GLY 8 H GLY 8 -10.304 4.574 5.018
74 HA2 GLY 8 HA2 GLY 8 -12.243 4.918 3.883
75 HA3 GLY 8 HA3 GLY 8 -11.321 5.933 2.763
76 H MET 9 H MET 9 -9.772 2.978 2.655
77 HA MET 9 HA MET 9 -10.814 2.401 0.054
78 HB2 MET 9 HB2 MET 9 -8.492 1.927 0.828
79 HB3 MET 9 HB3 MET 9 -9.132 0.691 1.923
80 HG2 MET 9 HG2 MET 9 -8.284 -0.385 -0.031
81 HG3 MET 9 HG3 MET 9 -10.035 -0.547 -0.052
82 HE1 MET 9 HE1 MET 9 -11.487 1.596 -1.479
83 HE2 MET 9 HE2 MET 9 -11.172 1.247 -3.191
84 HE3 MET 9 HE3 MET 9 -11.437 -0.089 -2.047
85 H THR 10 H THR 10 -11.916 1.642 3.242
86 HA THR 10 HA THR 10 -13.301 -0.818 2.435
87 HB THR 10 HB THR 10 -14.162 -0.666 4.803
88 HG1 THR 10 HG1 THR 10 -13.977 1.615 5.000
89 HG21 THR 10 HG21 THR 10 -12.089 -1.900 4.220
90 HG22 THR 10 HG22 THR 10 -11.142 -0.411 4.451
91 HG23 THR 10 HG23 THR 10 -11.978 -1.158 5.832
92 H CYS 11 H CYS 11 -15.704 -0.883 3.171
93 HA CYS 11 HA CYS 11 -17.825 -0.329 2.644
94 HB2 CYS 11 HB2 CYS 11 -16.899 2.392 3.619
95 HB3 CYS 11 HB3 CYS 11 -18.586 1.826 3.527
96 HG CYS 11 HG CYS 11 -17.686 1.785 6.003
97 H ASN 12 H ASN 12 -15.495 0.534 0.574
98 HA ASN 12 HA ASN 12 -16.578 2.653 -0.950
99 HB2 ASN 12 HB2 ASN 12 -15.089 1.898 -2.693
100 HB3 ASN 12 HB3 ASN 12 -14.265 1.692 -1.137
101 HD21 ASN 12 HD21 ASN 12 -13.916 -1.810 -1.451
102 HD22 ASN 12 HD22 ASN 12 -13.586 -0.365 -0.524
103 H HIS 13 H HIS 13 -17.241 2.224 -3.367
104 HA HIS 13 HA HIS 13 -19.201 -0.016 -3.489
105 HB2 HIS 13 HB2 HIS 13 -19.630 2.773 -4.598
106 HB3 HIS 13 HB3 HIS 13 -20.793 1.442 -4.556
107 HD1 HIS 13 HD1 HIS 13 -20.772 0.623 -1.551
108 HD2 HIS 13 HD2 HIS 13 -20.492 4.570 -2.985
109 HE1 HIS 13 HE1 HIS 13 -21.531 2.155 0.352
110 H CYS 14 H CYS 14 -16.494 1.541 -4.737
111 HA CYS 14 HA CYS 14 -16.648 -0.008 -7.241
112 HB2 CYS 14 HB2 CYS 14 -15.990 2.967 -7.084
113 HB3 CYS 14 HB3 CYS 14 -15.776 1.938 -8.519
114 HG CYS 14 HG CYS 14 -18.284 1.143 -8.611
115 H VAL 15 H VAL 15 -15.193 -1.385 -6.080
116 HA VAL 15 HA VAL 15 -12.922 -0.525 -4.690
117 HB VAL 15 HB VAL 15 -13.978 -2.777 -4.642
118 HG11 VAL 15 HG11 VAL 15 -14.304 -3.072 -7.074
119 HG12 VAL 15 HG12 VAL 15 -12.541 -3.153 -7.302
120 HG13 VAL 15 HG13 VAL 15 -13.377 -4.420 -6.376
121 HG21 VAL 15 HG21 VAL 15 -11.676 -2.390 -3.771
122 HG22 VAL 15 HG22 VAL 15 -11.927 -4.043 -4.376
123 HG23 VAL 15 HG23 VAL 15 -11.025 -2.872 -5.358
124 H MET 16 H MET 16 -10.609 -0.917 -5.338
125 HA MET 16 HA MET 16 -10.078 -0.413 -8.207
126 HB2 MET 16 HB2 MET 16 -9.094 1.276 -5.872
127 HB3 MET 16 HB3 MET 16 -8.480 1.390 -7.537
128 HG2 MET 16 HG2 MET 16 -10.763 1.905 -8.335
129 HG3 MET 16 HG3 MET 16 -11.360 1.850 -6.672
130 HE1 MET 16 HE1 MET 16 -9.714 4.942 -4.998
131 HE2 MET 16 HE2 MET 16 -10.870 3.600 -4.832
132 HE3 MET 16 HE3 MET 16 -9.129 3.263 -4.979
133 H ALA 17 H ALA 17 -7.395 -0.213 -8.219
134 HA ALA 17 HA ALA 17 -6.496 -2.623 -6.719
135 HB1 ALA 17 HB1 ALA 17 -5.144 -3.205 -8.693
136 HB2 ALA 17 HB2 ALA 17 -6.877 -3.137 -9.090
137 HB3 ALA 17 HB3 ALA 17 -5.802 -1.798 -9.562
138 H VAL 18 H VAL 18 -5.441 -1.581 -5.071
139 HA VAL 18 HA VAL 18 -3.779 0.710 -5.403
140 HB VAL 18 HB VAL 18 -3.661 -1.402 -3.216
141 HG11 VAL 18 HG11 VAL 18 -3.074 1.592 -3.246
142 HG12 VAL 18 HG12 VAL 18 -3.018 0.541 -1.812
143 HG13 VAL 18 HG13 VAL 18 -1.863 0.295 -3.136
144 HG21 VAL 18 HG21 VAL 18 -5.467 1.043 -3.448
145 HG22 VAL 18 HG22 VAL 18 -6.007 -0.648 -3.580
146 HG23 VAL 18 HG23 VAL 18 -5.351 -0.039 -2.045
147 H THR 19 H THR 19 -3.366 -2.359 -6.637
148 HA THR 19 HA THR 19 -0.649 -2.941 -6.090
149 HB THR 19 HB THR 19 -2.202 -3.620 -8.610
150 HG1 THR 19 HG1 THR 19 -2.908 -5.409 -7.356
151 HG21 THR 19 HG21 THR 19 -0.035 -5.068 -7.018
152 HG22 THR 19 HG22 THR 19 -0.877 -5.726 -8.438
153 HG23 THR 19 HG23 THR 19 0.176 -4.310 -8.613
154 H LYS 20 H LYS 20 -1.709 -0.130 -7.329
155 HA LYS 20 HA LYS 20 0.582 0.128 -9.219
156 HB2 LYS 20 HB2 LYS 20 -2.166 1.423 -9.240
157 HB3 LYS 20 HB3 LYS 20 -0.811 1.959 -10.253
158 HG2 LYS 20 HG2 LYS 20 -0.655 -0.293 -11.258
159 HG3 LYS 20 HG3 LYS 20 -2.041 -0.830 -10.276
160 HD2 LYS 20 HD2 LYS 20 -3.481 0.845 -11.338
161 HD3 LYS 20 HD3 LYS 20 -2.097 1.502 -12.241
162 HE2 LYS 20 HE2 LYS 20 -1.803 -0.654 -13.393
163 HE3 LYS 20 HE3 LYS 20 -3.164 -1.340 -12.485
164 HZ1 LYS 20 HZ1 LYS 20 -3.344 0.959 -14.304
165 HZ2 LYS 20 HZ2 LYS 20 -3.782 -0.584 -14.683
166 HZ3 LYS 20 HZ3 LYS 20 -4.598 0.241 -13.511
167 H ALA 21 H ALA 21 -0.205 0.760 -6.108
168 HA ALA 21 HA ALA 21 0.966 3.496 -6.215
169 HB1 ALA 21 HB1 ALA 21 -0.927 2.295 -4.165
170 HB2 ALA 21 HB2 ALA 21 -0.266 3.947 -4.145
171 HB3 ALA 21 HB3 ALA 21 -1.369 3.447 -5.447
172 H LEU 22 H LEU 22 1.769 0.322 -5.488
173 HA LEU 22 HA LEU 22 3.773 1.265 -3.484
174 HB2 LEU 22 HB2 LEU 22 2.542 -1.513 -3.725
175 HB3 LEU 22 HB3 LEU 22 3.843 -1.043 -2.641
176 HG LEU 22 HG LEU 22 1.900 -1.174 -1.335
177 HD11 LEU 22 HD11 LEU 22 3.350 0.790 -0.887
178 HD12 LEU 22 HD12 LEU 22 2.304 1.772 -1.943
179 HD13 LEU 22 HD13 LEU 22 1.651 1.078 -0.448
180 HD21 LEU 22 HD21 LEU 22 0.235 -1.045 -3.165
181 HD22 LEU 22 HD22 LEU 22 -0.179 -0.026 -1.770
182 HD23 LEU 22 HD23 LEU 22 0.480 0.717 -3.239
183 H LYS 23 H LYS 23 3.318 0.397 -6.670
184 HA LYS 23 HA LYS 23 5.694 -1.343 -6.791
185 HB2 LYS 23 HB2 LYS 23 3.552 -1.957 -7.900
186 HB3 LYS 23 HB3 LYS 23 3.723 -0.547 -8.966
187 HG2 LYS 23 HG2 LYS 23 5.827 -1.451 -9.862
188 HG3 LYS 23 HG3 LYS 23 5.756 -2.805 -8.709
189 HD2 LYS 23 HD2 LYS 23 3.631 -3.561 -9.733
190 HD3 LYS 23 HD3 LYS 23 3.713 -2.212 -10.891
191 HE2 LYS 23 HE2 LYS 23 5.874 -3.079 -11.739
192 HE3 LYS 23 HE3 LYS 23 5.785 -4.424 -10.584
193 HZ1 LYS 23 HZ1 LYS 23 5.012 -5.081 -12.729
194 HZ2 LYS 23 HZ2 LYS 23 3.762 -5.120 -11.660
195 HZ3 LYS 23 HZ3 LYS 23 3.873 -3.887 -12.750
196 H LYS 24 H LYS 24 4.977 2.037 -7.197
197 HA LYS 24 HA LYS 24 7.085 2.384 -9.219
198 HB2 LYS 24 HB2 LYS 24 5.496 4.409 -7.588
199 HB3 LYS 24 HB3 LYS 24 6.617 4.793 -8.908
200 HG2 LYS 24 HG2 LYS 24 5.240 3.435 -10.467
201 HG3 LYS 24 HG3 LYS 24 4.083 3.115 -9.153
202 HD2 LYS 24 HD2 LYS 24 3.639 5.529 -8.933
203 HD3 LYS 24 HD3 LYS 24 4.847 5.879 -10.193
204 HE2 LYS 24 HE2 LYS 24 3.535 4.535 -11.812
205 HE3 LYS 24 HE3 LYS 24 2.318 4.222 -10.558
206 HZ1 LYS 24 HZ1 LYS 24 3.058 6.874 -11.585
207 HZ2 LYS 24 HZ2 LYS 24 1.711 6.027 -12.008
208 HZ3 LYS 24 HZ3 LYS 24 1.893 6.564 -10.461
209 H VAL 25 H VAL 25 6.923 1.919 -5.844
210 HA VAL 25 HA VAL 25 9.082 3.690 -5.092
211 HB VAL 25 HB VAL 25 7.852 1.280 -3.694
212 HG11 VAL 25 HG11 VAL 25 8.807 2.328 -1.655
213 HG12 VAL 25 HG12 VAL 25 10.079 1.861 -2.804
214 HG13 VAL 25 HG13 VAL 25 9.591 3.566 -2.666
215 HG21 VAL 25 HG21 VAL 25 6.627 3.055 -2.429
216 HG22 VAL 25 HG22 VAL 25 7.294 4.272 -3.536
217 HG23 VAL 25 HG23 VAL 25 6.192 3.019 -4.153
218 HA PRO 26 HA PRO 26 12.300 1.104 -6.786
219 HB2 PRO 26 HB2 PRO 26 13.882 2.660 -4.750
220 HB3 PRO 26 HB3 PRO 26 14.276 2.350 -6.474
221 HG2 PRO 26 HG2 PRO 26 13.317 4.766 -5.714
222 HG3 PRO 26 HG3 PRO 26 12.685 3.977 -7.200
223 HD2 PRO 26 HD2 PRO 26 11.435 4.058 -4.447
224 HD3 PRO 26 HD3 PRO 26 10.666 4.299 -6.049
225 H GLY 27 H GLY 27 13.966 -0.420 -5.902
226 HA2 GLY 27 HA2 GLY 27 14.755 -1.995 -4.451
227 HA3 GLY 27 HA3 GLY 27 14.093 -1.046 -3.111
228 H VAL 28 H VAL 28 11.342 -1.323 -4.765
229 HA VAL 28 HA VAL 28 10.505 -3.695 -3.280
230 HB VAL 28 HB VAL 28 9.045 -1.878 -5.250
231 HG11 VAL 28 HG11 VAL 28 7.917 -4.052 -5.091
232 HG12 VAL 28 HG12 VAL 28 8.007 -3.991 -3.312
233 HG13 VAL 28 HG13 VAL 28 6.993 -2.829 -4.198
234 HG21 VAL 28 HG21 VAL 28 9.068 -1.995 -2.201
235 HG22 VAL 28 HG22 VAL 28 9.805 -0.719 -3.198
236 HG23 VAL 28 HG23 VAL 28 8.041 -0.930 -3.188
237 H GLU 29 H GLU 29 9.437 -5.551 -4.363
238 HA GLU 29 HA GLU 29 10.113 -5.899 -7.206
239 HB2 GLU 29 HB2 GLU 29 12.105 -6.671 -5.927
240 HB3 GLU 29 HB3 GLU 29 11.082 -7.798 -5.022
241 HG2 GLU 29 HG2 GLU 29 10.495 -8.989 -7.087
242 HG3 GLU 29 HG3 GLU 29 11.381 -7.799 -8.056
243 H LYS 30 H LYS 30 8.252 -6.584 -4.346
244 HA LYS 30 HA LYS 30 6.236 -7.921 -6.041
245 HB2 LYS 30 HB2 LYS 30 7.317 -9.049 -3.422
246 HB3 LYS 30 HB3 LYS 30 5.872 -9.632 -4.269
247 HG2 LYS 30 HG2 LYS 30 7.262 -10.173 -6.256
248 HG3 LYS 30 HG3 LYS 30 8.715 -9.658 -5.362
249 HD2 LYS 30 HD2 LYS 30 8.280 -11.365 -3.639
250 HD3 LYS 30 HD3 LYS 30 6.794 -11.858 -4.486
251 HE2 LYS 30 HE2 LYS 30 8.122 -12.485 -6.470
252 HE3 LYS 30 HE3 LYS 30 9.610 -11.983 -5.642
253 HZ1 LYS 30 HZ1 LYS 30 9.238 -14.343 -5.507
254 HZ2 LYS 30 HZ2 LYS 30 9.202 -13.660 -4.005
255 HZ3 LYS 30 HZ3 LYS 30 7.799 -14.112 -4.734
256 H VAL 31 H VAL 31 4.115 -8.004 -4.890
257 HA VAL 31 HA VAL 31 3.813 -6.248 -2.554
258 HB VAL 31 HB VAL 31 2.490 -5.688 -5.249
259 HG11 VAL 31 HG11 VAL 31 1.492 -3.738 -4.080
260 HG12 VAL 31 HG12 VAL 31 0.946 -5.277 -3.386
261 HG13 VAL 31 HG13 VAL 31 2.186 -4.314 -2.547
262 HG21 VAL 31 HG21 VAL 31 4.795 -4.845 -5.191
263 HG22 VAL 31 HG22 VAL 31 3.647 -3.497 -5.092
264 HG23 VAL 31 HG23 VAL 31 4.487 -4.055 -3.627
265 H GLU 32 H GLU 32 1.755 -6.592 -1.530
266 HA GLU 32 HA GLU 32 -0.099 -8.509 -2.782
267 HB2 GLU 32 HB2 GLU 32 1.203 -8.917 -0.055
268 HB3 GLU 32 HB3 GLU 32 -0.217 -9.810 -0.646
269 HG2 GLU 32 HG2 GLU 32 1.109 -10.608 -2.591
270 HG3 GLU 32 HG3 GLU 32 2.536 -9.767 -1.946
271 H VAL 33 H VAL 33 -2.230 -8.349 -1.843
272 HA VAL 33 HA VAL 33 -2.678 -6.255 0.171
273 HB VAL 33 HB VAL 33 -4.223 -5.038 -1.364
274 HG11 VAL 33 HG11 VAL 33 -1.896 -4.231 -1.017
275 HG12 VAL 33 HG12 VAL 33 -1.382 -5.167 -2.443
276 HG13 VAL 33 HG13 VAL 33 -2.532 -3.828 -2.627
277 HG21 VAL 33 HG21 VAL 33 -4.069 -5.437 -3.787
278 HG22 VAL 33 HG22 VAL 33 -2.906 -6.753 -3.518
279 HG23 VAL 33 HG23 VAL 33 -4.586 -6.924 -2.958
280 H SER 34 H SER 34 -5.233 -5.963 0.299
281 HA SER 34 HA SER 34 -6.675 -8.461 -0.284
282 HB2 SER 34 HB2 SER 34 -5.630 -8.818 1.934
283 HB3 SER 34 HB3 SER 34 -6.370 -7.312 2.521
284 HG SER 34 HG SER 34 -7.580 -9.212 3.023
285 H LEU 35 H LEU 35 -8.212 -7.491 -1.558
286 HA LEU 35 HA LEU 35 -9.166 -4.830 -1.161
287 HB2 LEU 35 HB2 LEU 35 -10.287 -7.186 -2.721
288 HB3 LEU 35 HB3 LEU 35 -10.917 -5.532 -2.822
289 HG LEU 35 HG LEU 35 -8.063 -6.351 -3.493
290 HD11 LEU 35 HD11 LEU 35 -8.749 -5.938 -5.828
291 HD12 LEU 35 HD12 LEU 35 -9.719 -7.237 -5.098
292 HD13 LEU 35 HD13 LEU 35 -10.412 -5.608 -5.285
293 HD21 LEU 35 HD21 LEU 35 -8.282 -3.993 -2.711
294 HD22 LEU 35 HD22 LEU 35 -7.918 -4.074 -4.449
295 HD23 LEU 35 HD23 LEU 35 -9.574 -3.732 -3.900
296 H GLU 36 H GLU 36 -9.742 -7.501 0.794
297 HA GLU 36 HA GLU 36 -12.468 -6.494 1.428
298 HB2 GLU 36 HB2 GLU 36 -12.298 -8.829 0.531
299 HB3 GLU 36 HB3 GLU 36 -11.347 -9.264 1.970
300 HG2 GLU 36 HG2 GLU 36 -13.246 -8.645 3.408
301 HG3 GLU 36 HG3 GLU 36 -14.154 -8.062 1.995
302 H LYS 37 H LYS 37 -9.337 -6.227 2.427
303 HA LYS 37 HA LYS 37 -10.226 -5.847 5.243
304 HB2 LYS 37 HB2 LYS 37 -7.581 -7.035 4.328
305 HB3 LYS 37 HB3 LYS 37 -8.031 -6.683 6.007
306 HG2 LYS 37 HG2 LYS 37 -9.523 -8.621 4.190
307 HG3 LYS 37 HG3 LYS 37 -8.292 -9.094 5.377
308 HD2 LYS 37 HD2 LYS 37 -9.632 -8.160 7.205
309 HD3 LYS 37 HD3 LYS 37 -10.874 -7.625 6.053
310 HE2 LYS 37 HE2 LYS 37 -10.006 -10.510 6.502
311 HE3 LYS 37 HE3 LYS 37 -11.485 -9.764 7.139
312 HZ1 LYS 37 HZ1 LYS 37 -11.941 -10.965 5.156
313 HZ2 LYS 37 HZ2 LYS 37 -12.164 -9.358 4.875
314 HZ3 LYS 37 HZ3 LYS 37 -10.814 -10.115 4.303
315 H GLY 38 H GLY 38 -8.813 -4.610 2.399
316 HA2 GLY 38 HA2 GLY 38 -8.022 -2.529 1.902
317 HA3 GLY 38 HA3 GLY 38 -8.419 -2.018 3.551
318 H GLU 39 H GLU 39 -6.510 -4.690 4.023
319 HA GLU 39 HA GLU 39 -4.226 -3.089 4.775
320 HB2 GLU 39 HB2 GLU 39 -4.609 -6.105 4.569
321 HB3 GLU 39 HB3 GLU 39 -3.248 -5.290 5.370
322 HG2 GLU 39 HG2 GLU 39 -4.819 -4.200 6.939
323 HG3 GLU 39 HG3 GLU 39 -6.182 -5.015 6.146
324 H ALA 40 H ALA 40 -1.971 -3.681 4.031
325 HA ALA 40 HA ALA 40 -1.727 -4.880 1.382
326 HB1 ALA 40 HB1 ALA 40 -2.355 -2.554 0.814
327 HB2 ALA 40 HB2 ALA 40 -1.055 -1.944 1.866
328 HB3 ALA 40 HB3 ALA 40 -0.652 -2.869 0.401
329 H LEU 41 H LEU 41 0.505 -5.336 0.873
330 HA LEU 41 HA LEU 41 2.517 -4.626 2.908
331 HB2 LEU 41 HB2 LEU 41 1.908 -7.506 2.093
332 HB3 LEU 41 HB3 LEU 41 3.291 -6.958 3.048
333 HG LEU 41 HG LEU 41 1.426 -5.931 4.626
334 HD11 LEU 41 HD11 LEU 41 -0.552 -7.416 4.746
335 HD12 LEU 41 HD12 LEU 41 -0.498 -6.616 3.163
336 HD13 LEU 41 HD13 LEU 41 0.017 -8.307 3.317
337 HD21 LEU 41 HD21 LEU 41 1.521 -8.042 5.914
338 HD22 LEU 41 HD22 LEU 41 2.111 -8.894 4.466
339 HD23 LEU 41 HD23 LEU 41 3.108 -7.631 5.226
340 H VAL 42 H VAL 42 4.723 -5.426 2.142
341 HA VAL 42 HA VAL 42 4.947 -5.919 -0.737
342 HB VAL 42 HB VAL 42 6.498 -4.065 -1.101
343 HG11 VAL 42 HG11 VAL 42 4.939 -2.186 -1.042
344 HG12 VAL 42 HG12 VAL 42 4.079 -3.667 -1.517
345 HG13 VAL 42 HG13 VAL 42 3.914 -3.031 0.137
346 HG21 VAL 42 HG21 VAL 42 5.810 -3.219 1.743
347 HG22 VAL 42 HG22 VAL 42 7.373 -3.874 1.200
348 HG23 VAL 42 HG23 VAL 42 6.811 -2.305 0.589
349 H GLU 43 H GLU 43 7.389 -6.198 -1.247
350 HA GLU 43 HA GLU 43 8.972 -7.014 1.106
351 HB2 GLU 43 HB2 GLU 43 8.336 -8.841 -1.249
352 HB3 GLU 43 HB3 GLU 43 9.557 -9.159 0.004
353 HG2 GLU 43 HG2 GLU 43 7.752 -8.979 1.738
354 HG3 GLU 43 HG3 GLU 43 6.559 -8.836 0.433
355 H GLY 44 H GLY 44 10.470 -5.410 0.794
356 HA2 GLY 44 HA2 GLY 44 12.362 -5.735 -1.328
357 HA3 GLY 44 HA3 GLY 44 11.332 -4.317 -1.616
358 H THR 45 H THR 45 13.908 -3.769 -1.332
359 HA THR 45 HA THR 45 14.721 -3.347 1.415
360 HB THR 45 HB THR 45 16.701 -2.331 0.339
361 HG1 THR 45 HG1 THR 45 15.643 -1.359 -1.409
362 HG21 THR 45 HG21 THR 45 17.442 -4.335 -0.878
363 HG22 THR 45 HG22 THR 45 16.507 -4.803 0.560
364 HG23 THR 45 HG23 THR 45 15.759 -4.877 -1.053
365 H ALA 46 H ALA 46 12.341 -1.812 -0.190
366 HA ALA 46 HA ALA 46 13.010 0.911 -0.267
367 HB1 ALA 46 HB1 ALA 46 10.343 -0.393 0.405
368 HB2 ALA 46 HB2 ALA 46 10.575 1.285 -0.139
369 HB3 ALA 46 HB3 ALA 46 10.961 -0.065 -1.232
370 H ASP 47 H ASP 47 11.869 2.600 1.218
371 HA ASP 47 HA ASP 47 12.386 1.835 4.054
372 HB2 ASP 47 HB2 ASP 47 12.942 4.446 2.592
373 HB3 ASP 47 HB3 ASP 47 13.141 4.199 4.335
374 HA PRO 48 HA PRO 48 8.426 3.210 5.214
375 HB2 PRO 48 HB2 PRO 48 9.704 5.105 7.163
376 HB3 PRO 48 HB3 PRO 48 8.466 3.844 7.475
377 HG2 PRO 48 HG2 PRO 48 11.060 3.449 8.182
378 HG3 PRO 48 HG3 PRO 48 10.112 2.120 7.434
379 HD2 PRO 48 HD2 PRO 48 12.111 3.966 6.126
380 HD3 PRO 48 HD3 PRO 48 11.905 2.197 5.923
381 H LYS 49 H LYS 49 10.857 5.732 4.616
382 HA LYS 49 HA LYS 49 8.828 7.822 4.323
383 HB2 LYS 49 HB2 LYS 49 11.851 7.790 3.978
384 HB3 LYS 49 HB3 LYS 49 10.826 9.238 3.832
385 HG2 LYS 49 HG2 LYS 49 10.003 8.901 6.137
386 HG3 LYS 49 HG3 LYS 49 11.031 7.460 6.302
387 HD2 LYS 49 HD2 LYS 49 13.045 8.827 5.975
388 HD3 LYS 49 HD3 LYS 49 12.041 10.274 5.715
389 HE2 LYS 49 HE2 LYS 49 11.105 10.048 7.984
390 HE3 LYS 49 HE3 LYS 49 12.081 8.590 8.253
391 HZ1 LYS 49 HZ1 LYS 49 14.040 9.916 8.012
392 HZ2 LYS 49 HZ2 LYS 49 13.153 11.271 7.708
393 HZ3 LYS 49 HZ3 LYS 49 13.082 10.551 9.191
394 H ALA 50 H ALA 50 9.676 5.297 2.383
395 HA ALA 50 HA ALA 50 9.239 6.937 -0.066
396 HB1 ALA 50 HB1 ALA 50 11.571 6.149 0.048
397 HB2 ALA 50 HB2 ALA 50 10.999 4.475 0.251
398 HB3 ALA 50 HB3 ALA 50 10.684 5.346 -1.269
399 H LEU 51 H LEU 51 7.913 4.712 2.027
400 HA LEU 51 HA LEU 51 6.375 3.423 -0.175
401 HB2 LEU 51 HB2 LEU 51 7.894 1.971 1.326
402 HB3 LEU 51 HB3 LEU 51 6.743 2.336 2.626
403 HG LEU 51 HG LEU 51 4.912 1.480 1.009
404 HD11 LEU 51 HD11 LEU 51 7.391 0.349 -0.358
405 HD12 LEU 51 HD12 LEU 51 5.707 -0.095 -0.723
406 HD13 LEU 51 HD13 LEU 51 6.279 1.552 -1.050
407 HD21 LEU 51 HD21 LEU 51 5.714 0.213 2.965
408 HD22 LEU 51 HD22 LEU 51 5.357 -0.862 1.597
409 HD23 LEU 51 HD23 LEU 51 7.046 -0.454 1.989
410 H VAL 52 H VAL 52 6.256 5.832 2.117
411 HA VAL 52 HA VAL 52 3.314 5.462 2.455
412 HB VAL 52 HB VAL 52 5.298 6.754 4.369
413 HG11 VAL 52 HG11 VAL 52 3.345 6.878 5.889
414 HG12 VAL 52 HG12 VAL 52 3.072 7.825 4.412
415 HG13 VAL 52 HG13 VAL 52 2.302 6.231 4.600
416 HG21 VAL 52 HG21 VAL 52 4.761 4.844 5.835
417 HG22 VAL 52 HG22 VAL 52 3.714 4.158 4.567
418 HG23 VAL 52 HG23 VAL 52 5.470 4.283 4.307
419 H GLN 53 H GLN 53 6.050 7.503 1.602
420 HA GLN 53 HA GLN 53 4.514 9.951 1.377
421 HB2 GLN 53 HB2 GLN 53 6.958 9.880 1.772
422 HB3 GLN 53 HB3 GLN 53 7.194 9.074 0.212
423 HG2 GLN 53 HG2 GLN 53 6.297 11.051 -0.960
424 HG3 GLN 53 HG3 GLN 53 5.996 11.847 0.601
425 HE21 GLN 53 HE21 GLN 53 9.629 12.119 -1.142
426 HE22 GLN 53 HE22 GLN 53 8.205 11.502 -1.950
427 H ALA 54 H ALA 54 4.756 7.031 -0.394
428 HA ALA 54 HA ALA 54 4.234 8.193 -3.023
429 HB1 ALA 54 HB1 ALA 54 4.081 5.805 -3.685
430 HB2 ALA 54 HB2 ALA 54 5.573 6.142 -2.773
431 HB3 ALA 54 HB3 ALA 54 4.203 5.341 -1.969
432 H VAL 55 H VAL 55 2.430 5.966 -0.787
433 HA VAL 55 HA VAL 55 0.027 6.142 -2.298
434 HB VAL 55 HB VAL 55 -1.009 5.109 -0.299
435 HG11 VAL 55 HG11 VAL 55 0.232 3.727 -1.931
436 HG12 VAL 55 HG12 VAL 55 1.731 3.977 -1.005
437 HG13 VAL 55 HG13 VAL 55 0.376 3.077 -0.284
438 HG21 VAL 55 HG21 VAL 55 0.238 6.351 1.445
439 HG22 VAL 55 HG22 VAL 55 0.399 4.595 1.663
440 HG23 VAL 55 HG23 VAL 55 1.738 5.527 0.959
441 H GLU 56 H GLU 56 1.463 8.249 0.130
442 HA GLU 56 HA GLU 56 -1.045 9.590 0.738
443 HB2 GLU 56 HB2 GLU 56 0.833 9.425 2.337
444 HB3 GLU 56 HB3 GLU 56 1.856 10.380 1.243
445 HG2 GLU 56 HG2 GLU 56 0.389 12.311 1.485
446 HG3 GLU 56 HG3 GLU 56 -0.789 11.347 2.399
447 H GLU 57 H GLU 57 1.329 9.691 -1.796
448 HA GLU 57 HA GLU 57 0.691 12.438 -2.608
449 HB2 GLU 57 HB2 GLU 57 2.953 11.436 -2.883
450 HB3 GLU 57 HB3 GLU 57 2.267 10.205 -3.958
451 HG2 GLU 57 HG2 GLU 57 1.586 11.972 -5.549
452 HG3 GLU 57 HG3 GLU 57 2.245 13.205 -4.454
453 H GLU 58 H GLU 58 -0.456 9.182 -3.063
454 HA GLU 58 HA GLU 58 -1.860 9.736 -5.567
455 HB2 GLU 58 HB2 GLU 58 -1.918 7.407 -3.604
456 HB3 GLU 58 HB3 GLU 58 -2.788 7.443 -5.149
457 HG2 GLU 58 HG2 GLU 58 0.228 7.719 -4.845
458 HG3 GLU 58 HG3 GLU 58 -0.623 6.235 -5.309
459 H GLY 59 H GLY 59 -2.343 10.664 -2.379
460 HA2 GLY 59 HA2 GLY 59 -4.176 11.909 -1.641
461 HA3 GLY 59 HA3 GLY 59 -5.171 11.225 -2.941
462 H TYR 60 H TYR 60 -3.519 8.657 -1.531
463 HA TYR 60 HA TYR 60 -5.637 8.225 0.515
464 HB2 TYR 60 HB2 TYR 60 -4.708 6.225 -1.573
465 HB3 TYR 60 HB3 TYR 60 -5.855 5.905 -0.268
466 HD1 TYR 60 HD1 TYR 60 -5.332 7.608 -3.497
467 HD2 TYR 60 HD2 TYR 60 -8.146 6.696 -0.384
468 HE1 TYR 60 HE1 TYR 60 -7.188 8.333 -4.975
469 HE2 TYR 60 HE2 TYR 60 -10.015 7.404 -1.857
470 HH TYR 60 HH TYR 60 -9.449 8.645 -5.175
471 H LYS 61 H LYS 61 -3.950 8.839 2.034
472 HA LYS 61 HA LYS 61 -1.425 7.563 2.146
473 HB2 LYS 61 HB2 LYS 61 -1.347 8.387 4.453
474 HB3 LYS 61 HB3 LYS 61 -2.004 9.634 3.372
475 HG2 LYS 61 HG2 LYS 61 -4.300 9.036 4.057
476 HG3 LYS 61 HG3 LYS 61 -3.663 7.752 5.110
477 HD2 LYS 61 HD2 LYS 61 -2.438 9.425 6.439
478 HD3 LYS 61 HD3 LYS 61 -3.025 10.719 5.370
479 HE2 LYS 61 HE2 LYS 61 -5.362 10.148 5.980
480 HE3 LYS 61 HE3 LYS 61 -4.763 8.881 7.070
481 HZ1 LYS 61 HZ1 LYS 61 -5.240 10.900 8.239
482 HZ2 LYS 61 HZ2 LYS 61 -3.625 10.583 8.309
483 HZ3 LYS 61 HZ3 LYS 61 -4.193 11.755 7.297
484 H ALA 62 H ALA 62 -0.727 6.136 4.029
485 HA ALA 62 HA ALA 62 -2.756 4.261 5.006
486 HB1 ALA 62 HB1 ALA 62 -2.143 3.389 2.748
487 HB2 ALA 62 HB2 ALA 62 -0.436 3.357 3.245
488 HB3 ALA 62 HB3 ALA 62 -1.618 2.305 4.057
489 H GLU 63 H GLU 63 -2.222 4.491 7.158
490 HA GLU 63 HA GLU 63 0.460 5.024 8.048
491 HB2 GLU 63 HB2 GLU 63 -2.034 4.052 9.495
492 HB3 GLU 63 HB3 GLU 63 -0.513 4.503 10.300
493 HG2 GLU 63 HG2 GLU 63 -0.640 6.752 9.240
494 HG3 GLU 63 HG3 GLU 63 -2.200 6.310 8.521
495 H VAL 64 H VAL 64 1.491 3.505 9.756
496 HA VAL 64 HA VAL 64 1.866 0.909 8.438
497 HB VAL 64 HB VAL 64 3.721 0.668 10.050
498 HG11 VAL 64 HG11 VAL 64 3.670 3.423 8.759
499 HG12 VAL 64 HG12 VAL 64 5.114 2.495 9.218
500 HG13 VAL 64 HG13 VAL 64 4.057 1.902 7.915
501 HG21 VAL 64 HG21 VAL 64 4.285 2.523 11.574
502 HG22 VAL 64 HG22 VAL 64 2.812 3.389 11.083
503 HG23 VAL 64 HG23 VAL 64 2.688 1.850 11.966
504 H LEU 65 H LEU 65 2.379 -0.891 10.215
505 HA LEU 65 HA LEU 65 0.280 -0.947 12.301
506 HB2 LEU 65 HB2 LEU 65 0.804 -3.072 10.185
507 HB3 LEU 65 HB3 LEU 65 -0.148 -3.349 11.655
508 HG LEU 65 HG LEU 65 -0.798 -1.234 9.559
509 HD11 LEU 65 HD11 LEU 65 -2.664 -2.767 8.975
510 HD12 LEU 65 HD12 LEU 65 -1.080 -3.513 8.676
511 HD13 LEU 65 HD13 LEU 65 -2.019 -3.972 10.116
512 HD21 LEU 65 HD21 LEU 65 -1.614 -0.688 11.836
513 HD22 LEU 65 HD22 LEU 65 -2.961 -1.137 10.775
514 HD23 LEU 65 HD23 LEU 65 -2.343 -2.307 11.964
515 H ALA 66 H ALA 66 3.437 -0.883 11.608
516 HA ALA 66 HA ALA 66 4.153 -2.460 13.983
517 HB1 ALA 66 HB1 ALA 66 4.432 -4.031 12.077
518 HB2 ALA 66 HB2 ALA 66 5.465 -2.839 11.256
519 HB3 ALA 66 HB3 ALA 66 6.000 -3.575 12.784
Start of MODEL 3
1 H1 MET 1 H MET 1 7.986 -5.652 10.571
2 HA MET 1 HA MET 1 9.184 -4.704 8.037
3 HB2 MET 1 HB2 MET 1 8.869 -7.169 8.182
4 HB3 MET 1 HB3 MET 1 7.129 -6.912 8.416
5 HG2 MET 1 HG2 MET 1 6.952 -5.850 6.237
6 HG3 MET 1 HG3 MET 1 8.707 -5.892 6.022
7 HE1 MET 1 HE1 MET 1 10.080 -7.686 5.423
8 HE2 MET 1 HE2 MET 1 9.523 -9.082 4.454
9 HE3 MET 1 HE3 MET 1 9.231 -7.419 3.891
10 H LEU 2 H LEU 2 7.443 -4.011 6.415
11 HA LEU 2 HA LEU 2 5.698 -2.118 7.819
12 HB2 LEU 2 HB2 LEU 2 6.241 -2.583 4.857
13 HB3 LEU 2 HB3 LEU 2 5.384 -1.190 5.552
14 HG LEU 2 HG LEU 2 8.274 -1.956 6.174
15 HD11 LEU 2 HD11 LEU 2 7.974 -1.177 3.842
16 HD12 LEU 2 HD12 LEU 2 7.167 0.292 4.448
17 HD13 LEU 2 HD13 LEU 2 8.880 -0.001 4.821
18 HD21 LEU 2 HD21 LEU 2 6.628 0.517 6.860
19 HD22 LEU 2 HD22 LEU 2 7.166 -0.730 8.013
20 HD23 LEU 2 HD23 LEU 2 8.359 0.303 7.197
21 H LYS 3 H LYS 3 3.407 -1.940 7.370
22 HA LYS 3 HA LYS 3 2.062 -4.256 6.179
23 HB2 LYS 3 HB2 LYS 3 2.806 -4.871 8.532
24 HB3 LYS 3 HB3 LYS 3 1.705 -3.621 9.141
25 HG2 LYS 3 HG2 LYS 3 -0.208 -4.787 8.182
26 HG3 LYS 3 HG3 LYS 3 0.867 -5.878 7.278
27 HD2 LYS 3 HD2 LYS 3 1.785 -6.722 9.450
28 HD3 LYS 3 HD3 LYS 3 0.565 -5.750 10.305
29 HE2 LYS 3 HE2 LYS 3 -1.228 -6.957 9.089
30 HE3 LYS 3 HE3 LYS 3 -0.002 -7.911 8.231
31 HZ1 LYS 3 HZ1 LYS 3 0.715 -8.769 10.348
32 HZ2 LYS 3 HZ2 LYS 3 -0.442 -7.896 11.135
33 HZ3 LYS 3 HZ3 LYS 3 -0.880 -9.096 10.094
34 H LEU 4 H LEU 4 1.263 -2.571 4.768
35 HA LEU 4 HA LEU 4 0.488 -0.036 5.940
36 HB2 LEU 4 HB2 LEU 4 0.900 -1.231 3.232
37 HB3 LEU 4 HB3 LEU 4 -0.240 0.119 3.335
38 HG LEU 4 HG LEU 4 1.464 1.487 4.503
39 HD11 LEU 4 HD11 LEU 4 3.799 0.707 4.575
40 HD12 LEU 4 HD12 LEU 4 2.752 -0.367 5.525
41 HD13 LEU 4 HD13 LEU 4 3.304 -0.869 3.909
42 HD21 LEU 4 HD21 LEU 4 1.236 1.581 2.035
43 HD22 LEU 4 HD22 LEU 4 2.921 1.839 2.541
44 HD23 LEU 4 HD23 LEU 4 2.421 0.264 1.879
45 H LYS 5 H LYS 5 -1.369 0.006 7.090
46 HA LYS 5 HA LYS 5 -3.801 -1.272 6.038
47 HB2 LYS 5 HB2 LYS 5 -3.405 -1.095 8.512
48 HB3 LYS 5 HB3 LYS 5 -3.414 0.677 8.347
49 HG2 LYS 5 HG2 LYS 5 -5.711 0.396 7.214
50 HG3 LYS 5 HG3 LYS 5 -5.698 -1.270 7.830
51 HD2 LYS 5 HD2 LYS 5 -5.474 -0.411 10.137
52 HD3 LYS 5 HD3 LYS 5 -5.371 1.252 9.510
53 HE2 LYS 5 HE2 LYS 5 -7.633 0.978 8.493
54 HE3 LYS 5 HE3 LYS 5 -7.747 -0.635 9.225
55 HZ1 LYS 5 HZ1 LYS 5 -7.429 1.896 10.684
56 HZ2 LYS 5 HZ2 LYS 5 -8.827 1.041 10.542
57 HZ3 LYS 5 HZ3 LYS 5 -7.550 0.403 11.371
58 H VAL 6 H VAL 6 -4.359 -0.342 4.147
59 HA VAL 6 HA VAL 6 -3.826 2.286 3.349
60 HB VAL 6 HB VAL 6 -5.992 0.384 2.369
61 HG11 VAL 6 HG11 VAL 6 -4.540 2.725 1.058
62 HG12 VAL 6 HG12 VAL 6 -5.629 1.599 0.214
63 HG13 VAL 6 HG13 VAL 6 -6.266 2.662 1.485
64 HG21 VAL 6 HG21 VAL 6 -3.742 -0.666 2.391
65 HG22 VAL 6 HG22 VAL 6 -4.272 -0.320 0.731
66 HG23 VAL 6 HG23 VAL 6 -3.082 0.739 1.523
67 H GLU 7 H GLU 7 -5.051 4.086 3.098
68 HA GLU 7 HA GLU 7 -6.771 4.891 5.175
69 HB2 GLU 7 HB2 GLU 7 -5.361 6.364 3.730
70 HB3 GLU 7 HB3 GLU 7 -6.440 6.024 2.364
71 HG2 GLU 7 HG2 GLU 7 -6.965 8.186 3.423
72 HG3 GLU 7 HG3 GLU 7 -8.319 7.058 3.588
73 H GLY 8 H GLY 8 -9.077 5.664 4.810
74 HA2 GLY 8 HA2 GLY 8 -10.567 3.325 4.285
75 HA3 GLY 8 HA3 GLY 8 -11.217 4.919 4.682
76 H MET 9 H MET 9 -9.274 4.085 1.769
77 HA MET 9 HA MET 9 -11.139 4.979 -0.150
78 HB2 MET 9 HB2 MET 9 -9.203 2.621 -0.249
79 HB3 MET 9 HB3 MET 9 -9.972 3.359 -1.658
80 HG2 MET 9 HG2 MET 9 -8.769 5.426 -1.291
81 HG3 MET 9 HG3 MET 9 -8.075 4.788 0.217
82 HE1 MET 9 HE1 MET 9 -7.107 3.269 -4.057
83 HE2 MET 9 HE2 MET 9 -8.688 3.005 -3.290
84 HE3 MET 9 HE3 MET 9 -8.150 4.658 -3.671
85 H THR 10 H THR 10 -10.956 2.002 1.760
86 HA THR 10 HA THR 10 -12.214 0.376 -0.249
87 HB THR 10 HB THR 10 -11.974 -1.386 1.466
88 HG1 THR 10 HG1 THR 10 -12.426 -0.375 3.343
89 HG21 THR 10 HG21 THR 10 -9.982 -0.670 0.137
90 HG22 THR 10 HG22 THR 10 -9.581 0.504 1.410
91 HG23 THR 10 HG23 THR 10 -9.543 -1.237 1.764
92 H CYS 11 H CYS 11 -14.033 -0.813 -0.126
93 HA CYS 11 HA CYS 11 -16.221 -1.231 0.078
94 HB2 CYS 11 HB2 CYS 11 -15.569 -0.857 3.026
95 HB3 CYS 11 HB3 CYS 11 -16.929 -1.779 2.348
96 HG CYS 11 HG CYS 11 -15.448 -3.646 2.929
97 H ASN 12 H ASN 12 -15.598 1.831 -0.150
98 HA ASN 12 HA ASN 12 -17.918 2.731 1.452
99 HB2 ASN 12 HB2 ASN 12 -17.319 4.957 0.711
100 HB3 ASN 12 HB3 ASN 12 -15.860 4.128 1.276
101 HD21 ASN 12 HD21 ASN 12 -15.812 5.789 -2.336
102 HD22 ASN 12 HD22 ASN 12 -16.892 6.210 -1.024
103 H HIS 13 H HIS 13 -16.915 2.936 -1.994
104 HA HIS 13 HA HIS 13 -19.642 2.050 -2.717
105 HB2 HIS 13 HB2 HIS 13 -18.093 4.297 -4.037
106 HB3 HIS 13 HB3 HIS 13 -19.454 3.458 -4.795
107 HD1 HIS 13 HD1 HIS 13 -21.873 4.142 -4.008
108 HD2 HIS 13 HD2 HIS 13 -18.704 5.792 -1.778
109 HE1 HIS 13 HE1 HIS 13 -22.894 5.911 -2.475
110 H CYS 14 H CYS 14 -16.203 2.243 -3.322
111 HA CYS 14 HA CYS 14 -16.439 0.122 -5.400
112 HB2 CYS 14 HB2 CYS 14 -14.796 2.674 -5.572
113 HB3 CYS 14 HB3 CYS 14 -14.888 1.402 -6.812
114 HG CYS 14 HG CYS 14 -16.251 3.586 -7.463
115 H VAL 15 H VAL 15 -13.946 -0.091 -6.233
116 HA VAL 15 HA VAL 15 -12.074 -0.411 -3.991
117 HB VAL 15 HB VAL 15 -13.283 -2.565 -4.196
118 HG11 VAL 15 HG11 VAL 15 -13.077 -3.887 -6.276
119 HG12 VAL 15 HG12 VAL 15 -13.938 -2.362 -6.578
120 HG13 VAL 15 HG13 VAL 15 -12.235 -2.533 -7.062
121 HG21 VAL 15 HG21 VAL 15 -11.343 -4.015 -4.510
122 HG22 VAL 15 HG22 VAL 15 -10.467 -2.720 -5.353
123 HG23 VAL 15 HG23 VAL 15 -10.856 -2.552 -3.623
124 H MET 16 H MET 16 -9.821 -0.597 -4.839
125 HA MET 16 HA MET 16 -9.547 0.097 -7.707
126 HB2 MET 16 HB2 MET 16 -8.364 1.688 -5.396
127 HB3 MET 16 HB3 MET 16 -8.003 1.941 -7.117
128 HG2 MET 16 HG2 MET 16 -10.382 2.438 -7.546
129 HG3 MET 16 HG3 MET 16 -10.747 2.192 -5.832
130 HE1 MET 16 HE1 MET 16 -11.236 6.041 -6.359
131 HE2 MET 16 HE2 MET 16 -11.566 4.745 -7.532
132 HE3 MET 16 HE3 MET 16 -11.983 4.518 -5.816
133 H ALA 17 H ALA 17 -7.290 -0.151 -8.469
134 HA ALA 17 HA ALA 17 -6.000 -2.405 -7.085
135 HB1 ALA 17 HB1 ALA 17 -6.341 -2.489 -9.528
136 HB2 ALA 17 HB2 ALA 17 -5.385 -1.001 -9.718
137 HB3 ALA 17 HB3 ALA 17 -4.608 -2.489 -9.127
138 H VAL 18 H VAL 18 -5.200 -1.318 -5.209
139 HA VAL 18 HA VAL 18 -3.561 1.020 -5.359
140 HB VAL 18 HB VAL 18 -3.706 -1.151 -3.223
141 HG11 VAL 18 HG11 VAL 18 -2.859 1.776 -3.118
142 HG12 VAL 18 HG12 VAL 18 -3.045 0.710 -1.706
143 HG13 VAL 18 HG13 VAL 18 -1.791 0.367 -2.915
144 HG21 VAL 18 HG21 VAL 18 -5.315 1.411 -3.592
145 HG22 VAL 18 HG22 VAL 18 -5.939 -0.247 -3.754
146 HG23 VAL 18 HG23 VAL 18 -5.387 0.344 -2.172
147 H THR 19 H THR 19 -2.979 -2.297 -6.153
148 HA THR 19 HA THR 19 -0.323 -2.640 -5.400
149 HB THR 19 HB THR 19 -1.644 -3.599 -7.965
150 HG1 THR 19 HG1 THR 19 -2.195 -5.386 -6.598
151 HG21 THR 19 HG21 THR 19 0.539 -4.840 -6.236
152 HG22 THR 19 HG22 THR 19 -0.109 -5.492 -7.753
153 HG23 THR 19 HG23 THR 19 0.828 -3.982 -7.773
154 H LYS 20 H LYS 20 -1.656 -0.926 -8.263
155 HA LYS 20 HA LYS 20 0.845 -0.607 -9.585
156 HB2 LYS 20 HB2 LYS 20 -1.708 1.048 -9.702
157 HB3 LYS 20 HB3 LYS 20 -0.349 1.182 -10.838
158 HG2 LYS 20 HG2 LYS 20 -0.627 -1.222 -11.431
159 HG3 LYS 20 HG3 LYS 20 -2.043 -1.306 -10.357
160 HD2 LYS 20 HD2 LYS 20 -3.154 0.462 -11.690
161 HD3 LYS 20 HD3 LYS 20 -1.733 0.553 -12.756
162 HE2 LYS 20 HE2 LYS 20 -2.054 -1.833 -13.364
163 HE3 LYS 20 HE3 LYS 20 -3.491 -1.897 -12.323
164 HZ1 LYS 20 HZ1 LYS 20 -4.064 -1.529 -14.608
165 HZ2 LYS 20 HZ2 LYS 20 -4.485 -0.215 -13.706
166 HZ3 LYS 20 HZ3 LYS 20 -3.149 -0.160 -14.668
167 H ALA 21 H ALA 21 -0.522 1.033 -6.791
168 HA ALA 21 HA ALA 21 1.003 3.481 -7.135
169 HB1 ALA 21 HB1 ALA 21 -0.324 2.281 -4.675
170 HB2 ALA 21 HB2 ALA 21 0.224 3.962 -4.874
171 HB3 ALA 21 HB3 ALA 21 -1.119 3.344 -5.861
172 H LEU 22 H LEU 22 1.387 0.414 -5.299
173 HA LEU 22 HA LEU 22 3.772 1.305 -3.933
174 HB2 LEU 22 HB2 LEU 22 2.416 -1.385 -4.373
175 HB3 LEU 22 HB3 LEU 22 3.969 -1.239 -3.540
176 HG LEU 22 HG LEU 22 2.242 -1.338 -1.892
177 HD11 LEU 22 HD11 LEU 22 4.191 0.249 -1.589
178 HD12 LEU 22 HD12 LEU 22 3.108 1.569 -2.073
179 HD13 LEU 22 HD13 LEU 22 2.750 0.629 -0.610
180 HD21 LEU 22 HD21 LEU 22 0.357 -0.538 -3.286
181 HD22 LEU 22 HD22 LEU 22 0.439 0.293 -1.717
182 HD23 LEU 22 HD23 LEU 22 1.001 1.121 -3.184
183 H LYS 23 H LYS 23 3.080 -0.410 -6.965
184 HA LYS 23 HA LYS 23 5.565 -1.633 -7.321
185 HB2 LYS 23 HB2 LYS 23 3.373 -1.963 -8.568
186 HB3 LYS 23 HB3 LYS 23 3.821 -0.555 -9.557
187 HG2 LYS 23 HG2 LYS 23 5.907 -1.704 -10.237
188 HG3 LYS 23 HG3 LYS 23 5.508 -3.071 -9.171
189 HD2 LYS 23 HD2 LYS 23 3.408 -3.433 -10.474
190 HD3 LYS 23 HD3 LYS 23 3.902 -2.131 -11.583
191 HE2 LYS 23 HE2 LYS 23 5.979 -3.389 -12.106
192 HE3 LYS 23 HE3 LYS 23 5.462 -4.686 -11.009
193 HZ1 LYS 23 HZ1 LYS 23 4.060 -3.811 -13.436
194 HZ2 LYS 23 HZ2 LYS 23 4.918 -5.206 -13.256
195 HZ3 LYS 23 HZ3 LYS 23 3.525 -4.979 -12.403
196 H LYS 24 H LYS 24 4.789 1.784 -7.612
197 HA LYS 24 HA LYS 24 6.957 2.332 -9.482
198 HB2 LYS 24 HB2 LYS 24 5.349 4.164 -7.656
199 HB3 LYS 24 HB3 LYS 24 6.436 4.689 -8.955
200 HG2 LYS 24 HG2 LYS 24 5.013 3.498 -10.613
201 HG3 LYS 24 HG3 LYS 24 3.898 3.038 -9.299
202 HD2 LYS 24 HD2 LYS 24 3.571 5.441 -8.756
203 HD3 LYS 24 HD3 LYS 24 4.664 5.882 -10.086
204 HE2 LYS 24 HE2 LYS 24 3.131 4.775 -11.694
205 HE3 LYS 24 HE3 LYS 24 2.028 4.381 -10.358
206 HZ1 LYS 24 HZ1 LYS 24 2.822 7.087 -11.185
207 HZ2 LYS 24 HZ2 LYS 24 1.372 6.372 -11.504
208 HZ3 LYS 24 HZ3 LYS 24 1.791 6.726 -9.950
209 H VAL 25 H VAL 25 6.724 1.837 -6.028
210 HA VAL 25 HA VAL 25 8.737 3.701 -5.240
211 HB VAL 25 HB VAL 25 7.594 1.195 -3.979
212 HG11 VAL 25 HG11 VAL 25 8.573 1.992 -1.858
213 HG12 VAL 25 HG12 VAL 25 9.836 1.622 -3.052
214 HG13 VAL 25 HG13 VAL 25 9.388 3.313 -2.729
215 HG21 VAL 25 HG21 VAL 25 7.166 4.101 -3.227
216 HG22 VAL 25 HG22 VAL 25 6.127 3.254 -4.413
217 HG23 VAL 25 HG23 VAL 25 6.218 2.692 -2.730
218 HA PRO 26 HA PRO 26 12.334 1.528 -6.727
219 HB2 PRO 26 HB2 PRO 26 13.607 3.196 -4.567
220 HB3 PRO 26 HB3 PRO 26 14.126 2.991 -6.273
221 HG2 PRO 26 HG2 PRO 26 12.860 5.257 -5.500
222 HG3 PRO 26 HG3 PRO 26 12.403 4.455 -7.043
223 HD2 PRO 26 HD2 PRO 26 11.009 4.287 -4.362
224 HD3 PRO 26 HD3 PRO 26 10.302 4.515 -5.994
225 H GLY 27 H GLY 27 13.322 -0.360 -6.045
226 HA2 GLY 27 HA2 GLY 27 14.364 -1.802 -4.541
227 HA3 GLY 27 HA3 GLY 27 13.756 -0.836 -3.183
228 H VAL 28 H VAL 28 10.952 -0.890 -4.406
229 HA VAL 28 HA VAL 28 10.070 -3.332 -3.115
230 HB VAL 28 HB VAL 28 8.660 -1.231 -4.805
231 HG11 VAL 28 HG11 VAL 28 7.486 -3.381 -5.038
232 HG12 VAL 28 HG12 VAL 28 7.491 -3.586 -3.269
233 HG13 VAL 28 HG13 VAL 28 6.556 -2.267 -4.012
234 HG21 VAL 28 HG21 VAL 28 8.637 -1.875 -1.823
235 HG22 VAL 28 HG22 VAL 28 9.474 -0.500 -2.579
236 HG23 VAL 28 HG23 VAL 28 7.697 -0.589 -2.614
237 H GLU 29 H GLU 29 9.822 -5.311 -3.990
238 HA GLU 29 HA GLU 29 9.824 -5.487 -6.966
239 HB2 GLU 29 HB2 GLU 29 12.003 -6.137 -5.996
240 HB3 GLU 29 HB3 GLU 29 11.186 -7.361 -4.997
241 HG2 GLU 29 HG2 GLU 29 10.355 -8.475 -7.048
242 HG3 GLU 29 HG3 GLU 29 11.154 -7.241 -8.043
243 H LYS 30 H LYS 30 8.490 -6.588 -3.874
244 HA LYS 30 HA LYS 30 6.485 -8.137 -5.448
245 HB2 LYS 30 HB2 LYS 30 7.727 -8.861 -2.766
246 HB3 LYS 30 HB3 LYS 30 6.405 -9.741 -3.559
247 HG2 LYS 30 HG2 LYS 30 7.867 -10.246 -5.478
248 HG3 LYS 30 HG3 LYS 30 9.193 -9.329 -4.726
249 HD2 LYS 30 HD2 LYS 30 9.187 -10.867 -2.799
250 HD3 LYS 30 HD3 LYS 30 7.846 -11.786 -3.524
251 HE2 LYS 30 HE2 LYS 30 9.248 -12.330 -5.471
252 HE3 LYS 30 HE3 LYS 30 10.579 -11.362 -4.804
253 HZ1 LYS 30 HZ1 LYS 30 10.676 -12.851 -2.957
254 HZ2 LYS 30 HZ2 LYS 30 9.421 -13.751 -3.543
255 HZ3 LYS 30 HZ3 LYS 30 10.848 -13.690 -4.365
256 H VAL 31 H VAL 31 4.364 -8.091 -4.655
257 HA VAL 31 HA VAL 31 3.764 -6.424 -2.303
258 HB VAL 31 HB VAL 31 2.704 -5.869 -5.107
259 HG11 VAL 31 HG11 VAL 31 0.986 -5.578 -3.334
260 HG12 VAL 31 HG12 VAL 31 2.083 -4.485 -2.467
261 HG13 VAL 31 HG13 VAL 31 1.459 -4.028 -4.068
262 HG21 VAL 31 HG21 VAL 31 3.758 -3.638 -4.782
263 HG22 VAL 31 HG22 VAL 31 4.459 -4.208 -3.251
264 HG23 VAL 31 HG23 VAL 31 4.957 -4.949 -4.790
265 H GLU 32 H GLU 32 1.754 -6.950 -1.386
266 HA GLU 32 HA GLU 32 -0.024 -8.803 -2.813
267 HB2 GLU 32 HB2 GLU 32 1.593 -10.239 -1.553
268 HB3 GLU 32 HB3 GLU 32 1.085 -9.435 -0.046
269 HG2 GLU 32 HG2 GLU 32 -1.251 -10.142 -0.466
270 HG3 GLU 32 HG3 GLU 32 -0.749 -10.918 -1.980
271 H VAL 33 H VAL 33 -2.130 -8.186 -2.427
272 HA VAL 33 HA VAL 33 -2.551 -6.340 -0.126
273 HB VAL 33 HB VAL 33 -3.959 -4.963 -1.629
274 HG11 VAL 33 HG11 VAL 33 -1.124 -5.397 -2.662
275 HG12 VAL 33 HG12 VAL 33 -2.116 -3.941 -2.902
276 HG13 VAL 33 HG13 VAL 33 -1.574 -4.386 -1.268
277 HG21 VAL 33 HG21 VAL 33 -2.852 -6.800 -3.800
278 HG22 VAL 33 HG22 VAL 33 -4.548 -6.724 -3.264
279 HG23 VAL 33 HG23 VAL 33 -3.806 -5.328 -4.074
280 H SER 34 H SER 34 -4.754 -6.075 0.540
281 HA SER 34 HA SER 34 -6.558 -8.312 -0.216
282 HB2 SER 34 HB2 SER 34 -5.529 -8.797 1.973
283 HB3 SER 34 HB3 SER 34 -6.058 -7.211 2.580
284 HG SER 34 HG SER 34 -7.476 -9.021 3.066
285 H LEU 35 H LEU 35 -7.984 -7.224 -1.464
286 HA LEU 35 HA LEU 35 -8.479 -4.450 -1.260
287 HB2 LEU 35 HB2 LEU 35 -10.195 -6.635 -2.501
288 HB3 LEU 35 HB3 LEU 35 -10.277 -4.904 -2.875
289 HG LEU 35 HG LEU 35 -7.849 -6.697 -3.323
290 HD11 LEU 35 HD11 LEU 35 -8.404 -6.432 -5.713
291 HD12 LEU 35 HD12 LEU 35 -9.738 -7.210 -4.832
292 HD13 LEU 35 HD13 LEU 35 -9.850 -5.492 -5.280
293 HD21 LEU 35 HD21 LEU 35 -6.991 -4.753 -4.607
294 HD22 LEU 35 HD22 LEU 35 -8.405 -3.801 -4.102
295 HD23 LEU 35 HD23 LEU 35 -7.220 -4.351 -2.892
296 H GLU 36 H GLU 36 -9.981 -7.179 0.433
297 HA GLU 36 HA GLU 36 -12.334 -5.581 1.131
298 HB2 GLU 36 HB2 GLU 36 -11.372 -8.334 2.002
299 HB3 GLU 36 HB3 GLU 36 -12.893 -7.574 2.524
300 HG2 GLU 36 HG2 GLU 36 -13.555 -7.336 0.122
301 HG3 GLU 36 HG3 GLU 36 -12.105 -8.255 -0.332
302 H LYS 37 H LYS 37 -9.194 -6.416 2.567
303 HA LYS 37 HA LYS 37 -10.128 -5.364 5.173
304 HB2 LYS 37 HB2 LYS 37 -7.582 -6.811 4.360
305 HB3 LYS 37 HB3 LYS 37 -7.992 -6.296 6.011
306 HG2 LYS 37 HG2 LYS 37 -10.022 -7.701 5.962
307 HG3 LYS 37 HG3 LYS 37 -9.628 -8.226 4.306
308 HD2 LYS 37 HD2 LYS 37 -7.506 -9.184 5.095
309 HD3 LYS 37 HD3 LYS 37 -7.847 -8.618 6.746
310 HE2 LYS 37 HE2 LYS 37 -9.887 -10.027 6.796
311 HE3 LYS 37 HE3 LYS 37 -9.517 -10.611 5.161
312 HZ1 LYS 37 HZ1 LYS 37 -8.756 -12.125 6.841
313 HZ2 LYS 37 HZ2 LYS 37 -7.471 -11.505 6.015
314 HZ3 LYS 37 HZ3 LYS 37 -7.817 -10.960 7.532
315 H GLY 38 H GLY 38 -8.487 -4.256 2.360
316 HA2 GLY 38 HA2 GLY 38 -7.520 -2.199 1.977
317 HA3 GLY 38 HA3 GLY 38 -7.946 -1.728 3.635
318 H GLU 39 H GLU 39 -6.054 -4.672 3.053
319 HA GLU 39 HA GLU 39 -3.764 -3.348 4.442
320 HB2 GLU 39 HB2 GLU 39 -4.456 -6.276 3.937
321 HB3 GLU 39 HB3 GLU 39 -3.031 -5.689 4.820
322 HG2 GLU 39 HG2 GLU 39 -4.529 -4.552 6.450
323 HG3 GLU 39 HG3 GLU 39 -5.939 -5.201 5.589
324 H ALA 40 H ALA 40 -1.638 -3.651 3.671
325 HA ALA 40 HA ALA 40 -1.293 -4.668 0.931
326 HB1 ALA 40 HB1 ALA 40 -1.899 -2.301 0.622
327 HB2 ALA 40 HB2 ALA 40 -0.639 -1.817 1.781
328 HB3 ALA 40 HB3 ALA 40 -0.183 -2.565 0.232
329 H LEU 41 H LEU 41 0.250 -6.115 1.264
330 HA LEU 41 HA LEU 41 2.473 -5.528 3.153
331 HB2 LEU 41 HB2 LEU 41 1.579 -8.075 1.717
332 HB3 LEU 41 HB3 LEU 41 2.985 -7.944 2.776
333 HG LEU 41 HG LEU 41 1.286 -8.931 4.074
334 HD11 LEU 41 HD11 LEU 41 2.558 -7.108 5.203
335 HD12 LEU 41 HD12 LEU 41 1.254 -5.969 4.782
336 HD13 LEU 41 HD13 LEU 41 0.927 -7.337 5.871
337 HD21 LEU 41 HD21 LEU 41 -0.956 -8.078 4.351
338 HD22 LEU 41 HD22 LEU 41 -0.600 -6.654 3.358
339 HD23 LEU 41 HD23 LEU 41 -0.634 -8.271 2.614
340 H VAL 42 H VAL 42 4.577 -5.329 2.371
341 HA VAL 42 HA VAL 42 4.987 -5.868 -0.512
342 HB VAL 42 HB VAL 42 6.234 -3.786 -0.776
343 HG11 VAL 42 HG11 VAL 42 4.376 -2.332 -0.998
344 HG12 VAL 42 HG12 VAL 42 3.712 -3.963 -1.162
345 HG13 VAL 42 HG13 VAL 42 3.511 -3.088 0.373
346 HG21 VAL 42 HG21 VAL 42 5.255 -3.091 2.025
347 HG22 VAL 42 HG22 VAL 42 6.934 -3.487 1.587
348 HG23 VAL 42 HG23 VAL 42 6.168 -2.026 0.929
349 H GLU 43 H GLU 43 7.306 -6.054 -1.065
350 HA GLU 43 HA GLU 43 9.077 -6.434 1.271
351 HB2 GLU 43 HB2 GLU 43 8.119 -8.661 0.657
352 HB3 GLU 43 HB3 GLU 43 8.825 -8.478 -0.967
353 HG2 GLU 43 HG2 GLU 43 11.073 -8.246 0.043
354 HG3 GLU 43 HG3 GLU 43 10.368 -8.387 1.663
355 H GLY 44 H GLY 44 10.429 -4.751 0.865
356 HA2 GLY 44 HA2 GLY 44 12.005 -4.832 -1.593
357 HA3 GLY 44 HA3 GLY 44 10.951 -3.411 -1.422
358 H THR 45 H THR 45 13.342 -2.587 -1.559
359 HA THR 45 HA THR 45 14.426 -2.352 1.208
360 HB THR 45 HB THR 45 16.570 -1.836 0.052
361 HG1 THR 45 HG1 THR 45 16.592 -2.318 -2.219
362 HG21 THR 45 HG21 THR 45 15.246 -4.431 -0.853
363 HG22 THR 45 HG22 THR 45 16.995 -4.124 -0.759
364 HG23 THR 45 HG23 THR 45 16.018 -4.159 0.727
365 H ALA 46 H ALA 46 12.179 -0.808 -0.111
366 HA ALA 46 HA ALA 46 13.254 1.788 -0.753
367 HB1 ALA 46 HB1 ALA 46 10.414 1.266 0.124
368 HB2 ALA 46 HB2 ALA 46 11.024 2.405 -1.081
369 HB3 ALA 46 HB3 ALA 46 11.006 0.664 -1.455
370 H ASP 47 H ASP 47 12.493 3.782 0.498
371 HA ASP 47 HA ASP 47 13.204 3.521 3.293
372 HB2 ASP 47 HB2 ASP 47 13.708 5.463 1.700
373 HB3 ASP 47 HB3 ASP 47 12.007 5.933 1.885
374 HA PRO 48 HA PRO 48 9.180 2.776 4.942
375 HB2 PRO 48 HB2 PRO 48 10.027 4.762 7.048
376 HB3 PRO 48 HB3 PRO 48 9.286 3.142 7.272
377 HG2 PRO 48 HG2 PRO 48 11.945 3.469 7.645
378 HG3 PRO 48 HG3 PRO 48 11.343 2.052 6.718
379 HD2 PRO 48 HD2 PRO 48 12.485 4.642 5.653
380 HD3 PRO 48 HD3 PRO 48 12.805 2.961 5.119
381 H LYS 49 H LYS 49 10.377 6.173 4.815
382 HA LYS 49 HA LYS 49 7.714 7.308 4.942
383 HB2 LYS 49 HB2 LYS 49 10.376 8.464 4.018
384 HB3 LYS 49 HB3 LYS 49 8.899 9.401 4.326
385 HG2 LYS 49 HG2 LYS 49 8.913 8.725 6.674
386 HG3 LYS 49 HG3 LYS 49 10.342 7.699 6.408
387 HD2 LYS 49 HD2 LYS 49 10.713 10.456 5.431
388 HD3 LYS 49 HD3 LYS 49 10.374 10.381 7.176
389 HE2 LYS 49 HE2 LYS 49 12.174 8.779 7.521
390 HE3 LYS 49 HE3 LYS 49 12.473 8.688 5.775
391 HZ1 LYS 49 HZ1 LYS 49 13.058 11.005 5.819
392 HZ2 LYS 49 HZ2 LYS 49 12.821 11.076 7.448
393 HZ3 LYS 49 HZ3 LYS 49 14.026 10.133 6.828
394 H ALA 50 H ALA 50 9.977 6.314 2.358
395 HA ALA 50 HA ALA 50 8.617 7.656 0.245
396 HB1 ALA 50 HB1 ALA 50 10.927 6.809 0.066
397 HB2 ALA 50 HB2 ALA 50 10.329 5.137 0.200
398 HB3 ALA 50 HB3 ALA 50 9.897 6.129 -1.213
399 H LEU 51 H LEU 51 8.149 4.490 1.824
400 HA LEU 51 HA LEU 51 6.374 3.476 -0.181
401 HB2 LEU 51 HB2 LEU 51 7.673 2.220 1.683
402 HB3 LEU 51 HB3 LEU 51 6.343 2.718 2.753
403 HG LEU 51 HG LEU 51 4.765 1.705 0.976
404 HD11 LEU 51 HD11 LEU 51 5.837 -0.083 -0.422
405 HD12 LEU 51 HD12 LEU 51 6.388 1.546 -0.875
406 HD13 LEU 51 HD13 LEU 51 7.432 0.493 0.108
407 HD21 LEU 51 HD21 LEU 51 5.393 0.663 3.181
408 HD22 LEU 51 HD22 LEU 51 4.997 -0.517 1.908
409 HD23 LEU 51 HD23 LEU 51 6.697 -0.205 2.339
410 H VAL 52 H VAL 52 5.815 5.006 3.045
411 HA VAL 52 HA VAL 52 2.962 4.952 2.797
412 HB VAL 52 HB VAL 52 4.799 6.664 4.522
413 HG11 VAL 52 HG11 VAL 52 2.516 7.595 4.415
414 HG12 VAL 52 HG12 VAL 52 1.837 5.991 4.784
415 HG13 VAL 52 HG13 VAL 52 2.811 6.850 6.000
416 HG21 VAL 52 HG21 VAL 52 4.320 4.951 6.245
417 HG22 VAL 52 HG22 VAL 52 3.365 4.028 5.061
418 HG23 VAL 52 HG23 VAL 52 5.119 4.226 4.833
419 H GLN 53 H GLN 53 5.457 7.098 1.546
420 HA GLN 53 HA GLN 53 3.601 9.306 1.104
421 HB2 GLN 53 HB2 GLN 53 6.021 9.654 1.533
422 HB3 GLN 53 HB3 GLN 53 6.404 8.779 0.032
423 HG2 GLN 53 HG2 GLN 53 5.124 10.464 -1.262
424 HG3 GLN 53 HG3 GLN 53 4.741 11.325 0.243
425 HE21 GLN 53 HE21 GLN 53 8.410 11.715 -1.572
426 HE22 GLN 53 HE22 GLN 53 7.218 10.568 -2.144
427 H ALA 54 H ALA 54 4.900 6.514 -0.682
428 HA ALA 54 HA ALA 54 4.176 7.344 -3.283
429 HB1 ALA 54 HB1 ALA 54 4.292 4.944 -3.823
430 HB2 ALA 54 HB2 ALA 54 5.646 5.438 -2.782
431 HB3 ALA 54 HB3 ALA 54 4.273 4.546 -2.087
432 H VAL 55 H VAL 55 2.298 5.549 -0.764
433 HA VAL 55 HA VAL 55 -0.013 5.349 -2.512
434 HB VAL 55 HB VAL 55 -1.157 4.599 -0.416
435 HG11 VAL 55 HG11 VAL 55 0.164 2.554 -0.100
436 HG12 VAL 55 HG12 VAL 55 0.098 2.994 -1.821
437 HG13 VAL 55 HG13 VAL 55 1.569 3.322 -0.871
438 HG21 VAL 55 HG21 VAL 55 0.161 4.323 1.643
439 HG22 VAL 55 HG22 VAL 55 1.563 5.092 0.869
440 HG23 VAL 55 HG23 VAL 55 0.087 6.037 1.181
441 H GLU 56 H GLU 56 1.303 7.727 -0.303
442 HA GLU 56 HA GLU 56 -1.125 9.189 0.157
443 HB2 GLU 56 HB2 GLU 56 0.884 9.327 1.589
444 HB3 GLU 56 HB3 GLU 56 1.802 10.030 0.244
445 HG2 GLU 56 HG2 GLU 56 0.316 11.985 0.223
446 HG3 GLU 56 HG3 GLU 56 -0.668 11.269 1.516
447 H GLU 57 H GLU 57 1.077 8.841 -2.511
448 HA GLU 57 HA GLU 57 0.593 11.336 -3.822
449 HB2 GLU 57 HB2 GLU 57 2.464 9.716 -4.294
450 HB3 GLU 57 HB3 GLU 57 1.268 8.608 -4.995
451 HG2 GLU 57 HG2 GLU 57 0.663 10.301 -6.680
452 HG3 GLU 57 HG3 GLU 57 1.854 11.424 -5.990
453 H GLU 58 H GLU 58 -1.226 8.367 -3.416
454 HA GLU 58 HA GLU 58 -3.090 9.024 -5.605
455 HB2 GLU 58 HB2 GLU 58 -3.009 6.785 -3.540
456 HB3 GLU 58 HB3 GLU 58 -4.189 6.911 -4.859
457 HG2 GLU 58 HG2 GLU 58 -1.174 6.741 -5.250
458 HG3 GLU 58 HG3 GLU 58 -2.289 5.369 -5.372
459 H GLY 59 H GLY 59 -2.617 9.705 -2.258
460 HA2 GLY 59 HA2 GLY 59 -3.933 11.297 -1.100
461 HA3 GLY 59 HA3 GLY 59 -5.313 10.934 -2.155
462 H TYR 60 H TYR 60 -3.693 8.114 -1.116
463 HA TYR 60 HA TYR 60 -5.651 7.633 1.110
464 HB2 TYR 60 HB2 TYR 60 -4.927 5.830 -1.201
465 HB3 TYR 60 HB3 TYR 60 -5.987 5.430 0.163
466 HD1 TYR 60 HD1 TYR 60 -6.081 6.297 -3.169
467 HD2 TYR 60 HD2 TYR 60 -7.767 7.541 0.585
468 HE1 TYR 60 HE1 TYR 60 -8.015 7.278 -4.367
469 HE2 TYR 60 HE2 TYR 60 -9.698 8.537 -0.602
470 HH TYR 60 HH TYR 60 -10.684 8.931 -2.628
471 H LYS 61 H LYS 61 -3.964 8.068 2.585
472 HA LYS 61 HA LYS 61 -1.343 6.999 2.418
473 HB2 LYS 61 HB2 LYS 61 -2.908 7.868 4.880
474 HB3 LYS 61 HB3 LYS 61 -1.137 7.796 4.706
475 HG2 LYS 61 HG2 LYS 61 -1.281 9.459 2.849
476 HG3 LYS 61 HG3 LYS 61 -3.038 9.554 3.091
477 HD2 LYS 61 HD2 LYS 61 -2.634 10.304 5.446
478 HD3 LYS 61 HD3 LYS 61 -0.886 10.330 5.096
479 HE2 LYS 61 HE2 LYS 61 -1.346 11.912 3.193
480 HE3 LYS 61 HE3 LYS 61 -3.056 11.909 3.659
481 HZ1 LYS 61 HZ1 LYS 61 -0.782 12.999 5.123
482 HZ2 LYS 61 HZ2 LYS 61 -2.153 13.752 4.644
483 HZ3 LYS 61 HZ3 LYS 61 -2.223 12.667 5.884
484 H ALA 62 H ALA 62 -0.562 5.616 4.532
485 HA ALA 62 HA ALA 62 -2.471 3.488 5.115
486 HB1 ALA 62 HB1 ALA 62 -1.605 2.811 2.907
487 HB2 ALA 62 HB2 ALA 62 0.059 2.909 3.533
488 HB3 ALA 62 HB3 ALA 62 -1.075 1.702 4.192
489 H GLU 63 H GLU 63 -2.230 3.685 7.283
490 HA GLU 63 HA GLU 63 0.281 4.149 8.592
491 HB2 GLU 63 HB2 GLU 63 -1.978 4.734 9.500
492 HB3 GLU 63 HB3 GLU 63 -2.313 2.998 9.698
493 HG2 GLU 63 HG2 GLU 63 -0.300 2.817 11.168
494 HG3 GLU 63 HG3 GLU 63 -0.047 4.566 11.003
495 H VAL 64 H VAL 64 1.923 2.693 8.880
496 HA VAL 64 HA VAL 64 1.706 -0.064 8.321
497 HB VAL 64 HB VAL 64 3.891 -0.212 9.490
498 HG11 VAL 64 HG11 VAL 64 3.771 0.558 7.158
499 HG12 VAL 64 HG12 VAL 64 3.548 2.236 7.709
500 HG13 VAL 64 HG13 VAL 64 5.078 1.392 8.032
501 HG21 VAL 64 HG21 VAL 64 4.864 2.032 10.271
502 HG22 VAL 64 HG22 VAL 64 3.203 2.635 10.306
503 HG23 VAL 64 HG23 VAL 64 3.665 1.276 11.358
504 H LEU 65 H LEU 65 0.943 -1.745 9.488
505 HA LEU 65 HA LEU 65 -0.214 -1.241 12.129
506 HB2 LEU 65 HB2 LEU 65 -0.070 -3.733 10.387
507 HB3 LEU 65 HB3 LEU 65 -0.984 -3.597 11.903
508 HG LEU 65 HG LEU 65 -1.435 -1.896 9.407
509 HD11 LEU 65 HD11 LEU 65 -3.078 -4.125 10.677
510 HD12 LEU 65 HD12 LEU 65 -3.524 -3.187 9.232
511 HD13 LEU 65 HD13 LEU 65 -2.120 -4.276 9.186
512 HD21 LEU 65 HD21 LEU 65 -2.287 -1.655 12.220
513 HD22 LEU 65 HD22 LEU 65 -2.400 -0.487 10.901
514 HD23 LEU 65 HD23 LEU 65 -3.663 -1.725 11.080
515 H ALA 66 H ALA 66 2.665 -0.938 11.928
516 HA ALA 66 HA ALA 66 3.525 -3.183 13.679
517 HB1 ALA 66 HB1 ALA 66 4.550 -3.411 11.444
518 HB2 ALA 66 HB2 ALA 66 5.164 -1.744 11.552
519 HB3 ALA 66 HB3 ALA 66 5.768 -2.988 12.672
Start of MODEL 4
1 H1 MET 1 H MET 1 10.613 -3.992 9.608
2 HA MET 1 HA MET 1 9.629 -3.838 7.376
3 HB2 MET 1 HB2 MET 1 9.658 -6.024 8.590
4 HB3 MET 1 HB3 MET 1 8.019 -5.681 9.182
5 HG2 MET 1 HG2 MET 1 7.210 -5.540 6.855
6 HG3 MET 1 HG3 MET 1 8.853 -5.814 6.258
7 HE1 MET 1 HE1 MET 1 6.359 -7.427 5.246
8 HE2 MET 1 HE2 MET 1 8.021 -7.720 4.681
9 HE3 MET 1 HE3 MET 1 7.009 -9.083 5.213
10 H LEU 2 H LEU 2 7.801 -3.388 6.068
11 HA LEU 2 HA LEU 2 5.944 -1.515 7.363
12 HB2 LEU 2 HB2 LEU 2 6.392 -2.269 4.448
13 HB3 LEU 2 HB3 LEU 2 5.373 -0.931 5.027
14 HG LEU 2 HG LEU 2 8.363 -1.218 5.580
15 HD11 LEU 2 HD11 LEU 2 6.893 0.625 3.658
16 HD12 LEU 2 HD12 LEU 2 8.641 0.628 3.986
17 HD13 LEU 2 HD13 LEU 2 7.892 -0.776 3.193
18 HD21 LEU 2 HD21 LEU 2 7.131 0.056 7.315
19 HD22 LEU 2 HD22 LEU 2 8.180 1.113 6.354
20 HD23 LEU 2 HD23 LEU 2 6.430 1.091 6.044
21 H LYS 3 H LYS 3 3.664 -1.645 7.104
22 HA LYS 3 HA LYS 3 2.427 -4.150 6.280
23 HB2 LYS 3 HB2 LYS 3 3.524 -4.538 8.549
24 HB3 LYS 3 HB3 LYS 3 2.403 -3.345 9.227
25 HG2 LYS 3 HG2 LYS 3 0.493 -4.746 8.606
26 HG3 LYS 3 HG3 LYS 3 1.565 -5.851 7.705
27 HD2 LYS 3 HD2 LYS 3 2.820 -6.308 9.814
28 HD3 LYS 3 HD3 LYS 3 1.644 -5.314 10.703
29 HE2 LYS 3 HE2 LYS 3 -0.170 -6.831 10.005
30 HE3 LYS 3 HE3 LYS 3 0.982 -7.791 9.055
31 HZ1 LYS 3 HZ1 LYS 3 2.144 -8.295 11.075
32 HZ2 LYS 3 HZ2 LYS 3 1.082 -7.403 11.964
33 HZ3 LYS 3 HZ3 LYS 3 0.567 -8.765 11.191
34 H LEU 4 H LEU 4 1.326 -2.538 4.925
35 HA LEU 4 HA LEU 4 0.306 -0.117 6.193
36 HB2 LEU 4 HB2 LEU 4 0.659 -1.250 3.432
37 HB3 LEU 4 HB3 LEU 4 -0.573 0.004 3.666
38 HG LEU 4 HG LEU 4 1.119 1.466 4.742
39 HD11 LEU 4 HD11 LEU 4 3.515 0.904 4.490
40 HD12 LEU 4 HD12 LEU 4 2.679 -0.251 5.549
41 HD13 LEU 4 HD13 LEU 4 3.065 -0.703 3.871
42 HD21 LEU 4 HD21 LEU 4 0.620 1.639 2.319
43 HD22 LEU 4 HD22 LEU 4 2.319 2.034 2.664
44 HD23 LEU 4 HD23 LEU 4 1.895 0.448 1.977
45 H LYS 5 H LYS 5 -1.671 0.213 6.947
46 HA LYS 5 HA LYS 5 -3.822 -1.729 6.307
47 HB2 LYS 5 HB2 LYS 5 -3.267 -1.251 8.718
48 HB3 LYS 5 HB3 LYS 5 -3.714 0.445 8.431
49 HG2 LYS 5 HG2 LYS 5 -5.964 -0.453 7.566
50 HG3 LYS 5 HG3 LYS 5 -5.494 -2.018 8.266
51 HD2 LYS 5 HD2 LYS 5 -5.238 -0.910 10.487
52 HD3 LYS 5 HD3 LYS 5 -5.716 0.640 9.752
53 HE2 LYS 5 HE2 LYS 5 -7.857 -0.399 9.039
54 HE3 LYS 5 HE3 LYS 5 -7.424 -1.892 9.892
55 HZ1 LYS 5 HZ1 LYS 5 -8.836 -0.052 10.998
56 HZ2 LYS 5 HZ2 LYS 5 -7.697 -0.862 11.897
57 HZ3 LYS 5 HZ3 LYS 5 -7.395 0.649 11.308
58 H VAL 6 H VAL 6 -4.566 -1.048 4.322
59 HA VAL 6 HA VAL 6 -4.674 1.672 3.509
60 HB VAL 6 HB VAL 6 -6.194 -0.739 2.428
61 HG11 VAL 6 HG11 VAL 6 -5.251 1.832 1.087
62 HG12 VAL 6 HG12 VAL 6 -6.111 0.492 0.297
63 HG13 VAL 6 HG13 VAL 6 -6.934 1.466 1.536
64 HG21 VAL 6 HG21 VAL 6 -3.783 -1.223 2.604
65 HG22 VAL 6 HG22 VAL 6 -4.248 -0.989 0.905
66 HG23 VAL 6 HG23 VAL 6 -3.407 0.310 1.782
67 H GLU 7 H GLU 7 -5.919 3.150 4.510
68 HA GLU 7 HA GLU 7 -8.589 2.533 5.517
69 HB2 GLU 7 HB2 GLU 7 -7.071 4.182 6.604
70 HB3 GLU 7 HB3 GLU 7 -7.116 5.178 5.136
71 HG2 GLU 7 HG2 GLU 7 -8.686 6.001 6.864
72 HG3 GLU 7 HG3 GLU 7 -9.537 5.494 5.395
73 H GLY 8 H GLY 8 -10.554 3.335 4.603
74 HA2 GLY 8 HA2 GLY 8 -10.404 3.723 1.675
75 HA3 GLY 8 HA3 GLY 8 -11.838 3.283 2.624
76 H MET 9 H MET 9 -9.474 6.006 2.260
77 HA MET 9 HA MET 9 -11.304 7.953 3.350
78 HB2 MET 9 HB2 MET 9 -8.764 8.166 1.706
79 HB3 MET 9 HB3 MET 9 -9.624 9.576 2.357
80 HG2 MET 9 HG2 MET 9 -9.039 7.371 4.284
81 HG3 MET 9 HG3 MET 9 -7.647 8.272 3.672
82 HE1 MET 9 HE1 MET 9 -7.058 8.909 6.165
83 HE2 MET 9 HE2 MET 9 -8.188 9.728 7.267
84 HE3 MET 9 HE3 MET 9 -8.516 8.062 6.738
85 H THR 10 H THR 10 -10.565 6.760 0.048
86 HA THR 10 HA THR 10 -12.894 8.350 -0.889
87 HB THR 10 HB THR 10 -11.628 8.876 -2.970
88 HG1 THR 10 HG1 THR 10 -10.021 7.416 -3.039
89 HG21 THR 10 HG21 THR 10 -11.750 10.508 -1.103
90 HG22 THR 10 HG22 THR 10 -10.260 9.817 -0.414
91 HG23 THR 10 HG23 THR 10 -10.216 10.632 -1.994
92 H CYS 11 H CYS 11 -13.759 7.544 -2.965
93 HA CYS 11 HA CYS 11 -14.779 5.809 -4.038
94 HB2 CYS 11 HB2 CYS 11 -11.863 4.973 -4.302
95 HB3 CYS 11 HB3 CYS 11 -13.213 4.391 -5.308
96 HG CYS 11 HG CYS 11 -12.282 6.050 -6.860
97 H ASN 12 H ASN 12 -14.638 5.494 -1.157
98 HA ASN 12 HA ASN 12 -13.816 2.874 -0.417
99 HB2 ASN 12 HB2 ASN 12 -15.119 3.366 1.625
100 HB3 ASN 12 HB3 ASN 12 -14.095 4.737 1.156
101 HD21 ASN 12 HD21 ASN 12 -18.177 5.094 1.257
102 HD22 ASN 12 HD22 ASN 12 -17.349 3.615 1.692
103 H HIS 13 H HIS 13 -16.553 3.937 -2.254
104 HA HIS 13 HA HIS 13 -18.252 1.698 -1.410
105 HB2 HIS 13 HB2 HIS 13 -18.521 3.693 -3.688
106 HB3 HIS 13 HB3 HIS 13 -19.772 2.567 -3.139
107 HD1 HIS 13 HD1 HIS 13 -19.452 6.009 -2.933
108 HD2 HIS 13 HD2 HIS 13 -19.671 2.983 -0.012
109 HE1 HIS 13 HE1 HIS 13 -20.263 7.122 -0.778
110 H CYS 14 H CYS 14 -15.556 2.108 -3.411
111 HA CYS 14 HA CYS 14 -16.269 -0.320 -4.967
112 HB2 CYS 14 HB2 CYS 14 -14.802 2.152 -5.976
113 HB3 CYS 14 HB3 CYS 14 -15.046 0.645 -6.890
114 HG CYS 14 HG CYS 14 -16.680 2.458 -7.777
115 H VAL 15 H VAL 15 -13.952 -0.919 -6.146
116 HA VAL 15 HA VAL 15 -11.793 -0.680 -4.146
117 HB VAL 15 HB VAL 15 -13.052 -2.748 -3.622
118 HG11 VAL 15 HG11 VAL 15 -13.061 -4.611 -5.242
119 HG12 VAL 15 HG12 VAL 15 -13.940 -3.207 -5.885
120 HG13 VAL 15 HG13 VAL 15 -12.293 -3.566 -6.460
121 HG21 VAL 15 HG21 VAL 15 -10.386 -3.390 -4.938
122 HG22 VAL 15 HG22 VAL 15 -10.551 -2.585 -3.352
123 HG23 VAL 15 HG23 VAL 15 -11.159 -4.239 -3.587
124 H MET 16 H MET 16 -9.677 -1.138 -5.085
125 HA MET 16 HA MET 16 -9.588 -1.367 -8.027
126 HB2 MET 16 HB2 MET 16 -8.288 0.898 -6.457
127 HB3 MET 16 HB3 MET 16 -8.122 0.600 -8.199
128 HG2 MET 16 HG2 MET 16 -10.565 0.928 -8.470
129 HG3 MET 16 HG3 MET 16 -10.707 1.250 -6.735
130 HE1 MET 16 HE1 MET 16 -11.694 4.196 -7.097
131 HE2 MET 16 HE2 MET 16 -11.491 4.389 -8.847
132 HE3 MET 16 HE3 MET 16 -12.090 2.845 -8.197
133 H ALA 17 H ALA 17 -7.320 -1.760 -8.763
134 HA ALA 17 HA ALA 17 -5.952 -3.584 -6.994
135 HB1 ALA 17 HB1 ALA 17 -5.941 -3.861 -9.443
136 HB2 ALA 17 HB2 ALA 17 -5.107 -2.299 -9.626
137 HB3 ALA 17 HB3 ALA 17 -4.285 -3.659 -8.825
138 H VAL 18 H VAL 18 -5.321 -2.485 -5.106
139 HA VAL 18 HA VAL 18 -4.093 0.094 -5.127
140 HB VAL 18 HB VAL 18 -3.909 -2.137 -3.068
141 HG11 VAL 18 HG11 VAL 18 -3.573 0.884 -2.815
142 HG12 VAL 18 HG12 VAL 18 -3.596 -0.266 -1.458
143 HG13 VAL 18 HG13 VAL 18 -2.284 -0.333 -2.651
144 HG21 VAL 18 HG21 VAL 18 -6.265 -1.342 -3.816
145 HG22 VAL 18 HG22 VAL 18 -5.892 -1.300 -2.069
146 HG23 VAL 18 HG23 VAL 18 -5.848 0.187 -3.042
147 H THR 19 H THR 19 -2.960 -3.024 -6.027
148 HA THR 19 HA THR 19 -0.296 -3.027 -5.264
149 HB THR 19 HB THR 19 -1.484 -3.930 -7.915
150 HG1 THR 19 HG1 THR 19 -1.683 -5.914 -6.736
151 HG21 THR 19 HG21 THR 19 0.928 -4.960 -6.367
152 HG22 THR 19 HG22 THR 19 0.339 -5.552 -7.933
153 HG23 THR 19 HG23 THR 19 1.020 -3.915 -7.810
154 H LYS 20 H LYS 20 -1.854 -1.244 -7.962
155 HA LYS 20 HA LYS 20 0.562 -0.508 -9.263
156 HB2 LYS 20 HB2 LYS 20 -2.159 0.852 -9.188
157 HB3 LYS 20 HB3 LYS 20 -0.854 1.234 -10.331
158 HG2 LYS 20 HG2 LYS 20 -0.893 -1.096 -11.164
159 HG3 LYS 20 HG3 LYS 20 -2.217 -1.478 -10.038
160 HD2 LYS 20 HD2 LYS 20 -3.651 0.202 -11.123
161 HD3 LYS 20 HD3 LYS 20 -2.318 0.662 -12.208
162 HE2 LYS 20 HE2 LYS 20 -2.268 -1.633 -13.124
163 HE3 LYS 20 HE3 LYS 20 -3.603 -2.096 -12.050
164 HZ1 LYS 20 HZ1 LYS 20 -4.344 -1.532 -14.263
165 HZ2 LYS 20 HZ2 LYS 20 -4.976 -0.496 -13.146
166 HZ3 LYS 20 HZ3 LYS 20 -3.732 -0.009 -14.114
167 H ALA 21 H ALA 21 -0.987 0.753 -6.355
168 HA ALA 21 HA ALA 21 0.376 3.310 -6.496
169 HB1 ALA 21 HB1 ALA 21 -1.043 1.897 -4.200
170 HB2 ALA 21 HB2 ALA 21 -0.538 3.602 -4.223
171 HB3 ALA 21 HB3 ALA 21 -1.790 3.033 -5.349
172 H LEU 22 H LEU 22 1.197 0.091 -5.377
173 HA LEU 22 HA LEU 22 3.295 1.108 -3.559
174 HB2 LEU 22 HB2 LEU 22 2.251 -1.653 -4.303
175 HB3 LEU 22 HB3 LEU 22 3.727 -1.412 -3.361
176 HG LEU 22 HG LEU 22 1.968 -1.837 -1.826
177 HD11 LEU 22 HD11 LEU 22 3.632 -0.016 -1.282
178 HD12 LEU 22 HD12 LEU 22 2.402 1.169 -1.762
179 HD13 LEU 22 HD13 LEU 22 2.094 0.083 -0.389
180 HD21 LEU 22 HD21 LEU 22 0.439 0.501 -3.029
181 HD22 LEU 22 HD22 LEU 22 0.060 -1.224 -3.272
182 HD23 LEU 22 HD23 LEU 22 -0.061 -0.503 -1.653
183 H LYS 23 H LYS 23 2.904 -0.363 -6.769
184 HA LYS 23 HA LYS 23 5.481 -1.415 -7.007
185 HB2 LYS 23 HB2 LYS 23 3.412 -1.913 -8.356
186 HB3 LYS 23 HB3 LYS 23 3.729 -0.428 -9.278
187 HG2 LYS 23 HG2 LYS 23 5.950 -1.318 -9.929
188 HG3 LYS 23 HG3 LYS 23 5.646 -2.788 -8.972
189 HD2 LYS 23 HD2 LYS 23 3.706 -3.326 -10.389
190 HD3 LYS 23 HD3 LYS 23 3.948 -1.826 -11.315
191 HE2 LYS 23 HE2 LYS 23 6.175 -2.607 -12.006
192 HE3 LYS 23 HE3 LYS 23 5.952 -4.122 -11.107
193 HZ1 LYS 23 HZ1 LYS 23 5.388 -3.918 -13.623
194 HZ2 LYS 23 HZ2 LYS 23 4.442 -4.849 -12.624
195 HZ3 LYS 23 HZ3 LYS 23 3.966 -3.336 -13.074
196 H LYS 24 H LYS 24 4.516 1.998 -7.542
197 HA LYS 24 HA LYS 24 6.861 2.423 -9.227
198 HB2 LYS 24 HB2 LYS 24 4.915 4.396 -7.975
199 HB3 LYS 24 HB3 LYS 24 6.204 4.805 -9.119
200 HG2 LYS 24 HG2 LYS 24 5.202 3.287 -10.798
201 HG3 LYS 24 HG3 LYS 24 3.877 2.915 -9.667
202 HD2 LYS 24 HD2 LYS 24 3.217 5.285 -9.629
203 HD3 LYS 24 HD3 LYS 24 4.592 5.702 -10.678
204 HE2 LYS 24 HE2 LYS 24 3.676 4.242 -12.456
205 HE3 LYS 24 HE3 LYS 24 2.285 3.857 -11.421
206 HZ1 LYS 24 HZ1 LYS 24 3.012 6.547 -12.358
207 HZ2 LYS 24 HZ2 LYS 24 1.814 5.610 -12.991
208 HZ3 LYS 24 HZ3 LYS 24 1.697 6.163 -11.444
209 H VAL 25 H VAL 25 6.421 2.124 -5.836
210 HA VAL 25 HA VAL 25 8.343 4.130 -5.046
211 HB VAL 25 HB VAL 25 7.176 1.679 -3.683
212 HG11 VAL 25 HG11 VAL 25 8.162 2.583 -1.596
213 HG12 VAL 25 HG12 VAL 25 9.418 2.113 -2.760
214 HG13 VAL 25 HG13 VAL 25 9.006 3.830 -2.540
215 HG21 VAL 25 HG21 VAL 25 5.964 3.406 -2.381
216 HG22 VAL 25 HG22 VAL 25 6.773 4.681 -3.321
217 HG23 VAL 25 HG23 VAL 25 5.635 3.569 -4.116
218 HA PRO 26 HA PRO 26 11.998 2.080 -6.455
219 HB2 PRO 26 HB2 PRO 26 13.137 3.517 -4.059
220 HB3 PRO 26 HB3 PRO 26 13.794 3.432 -5.728
221 HG2 PRO 26 HG2 PRO 26 12.487 5.652 -4.903
222 HG3 PRO 26 HG3 PRO 26 12.134 4.961 -6.525
223 HD2 PRO 26 HD2 PRO 26 10.549 4.656 -3.969
224 HD3 PRO 26 HD3 PRO 26 9.965 4.958 -5.637
225 H GLY 27 H GLY 27 13.059 0.176 -5.970
226 HA2 GLY 27 HA2 GLY 27 14.121 -1.377 -4.600
227 HA3 GLY 27 HA3 GLY 27 13.367 -0.648 -3.172
228 H VAL 28 H VAL 28 10.666 -0.768 -4.727
229 HA VAL 28 HA VAL 28 9.805 -3.249 -3.574
230 HB VAL 28 HB VAL 28 8.515 -1.286 -5.506
231 HG11 VAL 28 HG11 VAL 28 7.497 -3.505 -5.806
232 HG12 VAL 28 HG12 VAL 28 7.286 -3.659 -4.045
233 HG13 VAL 28 HG13 VAL 28 6.383 -2.420 -4.946
234 HG21 VAL 28 HG21 VAL 28 8.151 -1.830 -2.526
235 HG22 VAL 28 HG22 VAL 28 8.987 -0.427 -3.234
236 HG23 VAL 28 HG23 VAL 28 7.239 -0.638 -3.481
237 H GLU 29 H GLU 29 9.754 -5.271 -4.413
238 HA GLU 29 HA GLU 29 10.212 -5.543 -7.352
239 HB2 GLU 29 HB2 GLU 29 12.166 -6.280 -6.036
240 HB3 GLU 29 HB3 GLU 29 11.118 -7.342 -5.068
241 HG2 GLU 29 HG2 GLU 29 10.463 -8.538 -7.169
242 HG3 GLU 29 HG3 GLU 29 11.622 -7.540 -8.065
243 H LYS 30 H LYS 30 8.583 -6.764 -4.409
244 HA LYS 30 HA LYS 30 6.482 -7.893 -6.175
245 HB2 LYS 30 HB2 LYS 30 7.676 -9.239 -3.722
246 HB3 LYS 30 HB3 LYS 30 6.248 -9.795 -4.611
247 HG2 LYS 30 HG2 LYS 30 7.625 -10.048 -6.660
248 HG3 LYS 30 HG3 LYS 30 9.063 -9.526 -5.747
249 HD2 LYS 30 HD2 LYS 30 8.781 -11.426 -4.196
250 HD3 LYS 30 HD3 LYS 30 7.325 -11.941 -5.079
251 HE2 LYS 30 HE2 LYS 30 8.669 -12.251 -7.126
252 HE3 LYS 30 HE3 LYS 30 10.126 -11.722 -6.259
253 HZ1 LYS 30 HZ1 LYS 30 8.499 -14.068 -5.566
254 HZ2 LYS 30 HZ2 LYS 30 9.938 -14.108 -6.369
255 HZ3 LYS 30 HZ3 LYS 30 9.879 -13.591 -4.807
256 H VAL 31 H VAL 31 4.381 -8.016 -5.147
257 HA VAL 31 HA VAL 31 4.108 -6.367 -2.699
258 HB VAL 31 HB VAL 31 2.567 -6.012 -5.304
259 HG11 VAL 31 HG11 VAL 31 2.294 -4.631 -2.601
260 HG12 VAL 31 HG12 VAL 31 1.458 -4.142 -4.094
261 HG13 VAL 31 HG13 VAL 31 1.106 -5.720 -3.359
262 HG21 VAL 31 HG21 VAL 31 3.545 -3.733 -5.253
263 HG22 VAL 31 HG22 VAL 31 4.478 -4.171 -3.803
264 HG23 VAL 31 HG23 VAL 31 4.807 -4.979 -5.354
265 H GLU 32 H GLU 32 2.285 -6.914 -1.446
266 HA GLU 32 HA GLU 32 0.620 -9.187 -2.345
267 HB2 GLU 32 HB2 GLU 32 2.558 -10.186 -1.189
268 HB3 GLU 32 HB3 GLU 32 2.294 -9.111 0.201
269 HG2 GLU 32 HG2 GLU 32 0.037 -10.110 0.522
270 HG3 GLU 32 HG3 GLU 32 0.340 -11.201 -0.843
271 H VAL 33 H VAL 33 -1.337 -8.122 -2.259
272 HA VAL 33 HA VAL 33 -1.933 -6.748 0.316
273 HB VAL 33 HB VAL 33 -3.259 -5.113 -0.913
274 HG11 VAL 33 HG11 VAL 33 -0.480 -5.413 -2.122
275 HG12 VAL 33 HG12 VAL 33 -1.438 -3.917 -2.052
276 HG13 VAL 33 HG13 VAL 33 -0.837 -4.662 -0.554
277 HG21 VAL 33 HG21 VAL 33 -2.273 -6.556 -3.410
278 HG22 VAL 33 HG22 VAL 33 -3.952 -6.518 -2.815
279 HG23 VAL 33 HG23 VAL 33 -3.174 -5.023 -3.382
280 H SER 34 H SER 34 -4.165 -6.780 0.968
281 HA SER 34 HA SER 34 -5.767 -8.930 -0.322
282 HB2 SER 34 HB2 SER 34 -4.691 -9.807 1.714
283 HB3 SER 34 HB3 SER 34 -5.366 -8.460 2.659
284 HG SER 34 HG SER 34 -6.619 -10.413 2.730
285 H LEU 35 H LEU 35 -7.262 -7.701 -1.332
286 HA LEU 35 HA LEU 35 -8.174 -5.170 -0.408
287 HB2 LEU 35 HB2 LEU 35 -9.451 -7.182 -2.304
288 HB3 LEU 35 HB3 LEU 35 -9.900 -5.469 -2.167
289 HG LEU 35 HG LEU 35 -7.113 -6.479 -2.919
290 HD11 LEU 35 HD11 LEU 35 -7.716 -5.725 -5.192
291 HD12 LEU 35 HD12 LEU 35 -8.793 -7.025 -4.632
292 HD13 LEU 35 HD13 LEU 35 -9.359 -5.338 -4.628
293 HD21 LEU 35 HD21 LEU 35 -6.570 -4.346 -2.335
294 HD22 LEU 35 HD22 LEU 35 -7.410 -3.884 -3.817
295 HD23 LEU 35 HD23 LEU 35 -8.284 -3.828 -2.270
296 H GLU 36 H GLU 36 -8.959 -8.409 0.555
297 HA GLU 36 HA GLU 36 -11.636 -7.741 1.538
298 HB2 GLU 36 HB2 GLU 36 -9.836 -10.174 1.865
299 HB3 GLU 36 HB3 GLU 36 -11.515 -10.069 2.440
300 HG2 GLU 36 HG2 GLU 36 -12.328 -9.733 0.166
301 HG3 GLU 36 HG3 GLU 36 -10.667 -9.670 -0.458
302 H LYS 37 H LYS 37 -8.301 -7.910 2.761
303 HA LYS 37 HA LYS 37 -9.324 -7.574 5.525
304 HB2 LYS 37 HB2 LYS 37 -6.566 -8.327 4.495
305 HB3 LYS 37 HB3 LYS 37 -7.043 -8.212 6.206
306 HG2 LYS 37 HG2 LYS 37 -8.792 -9.933 5.829
307 HG3 LYS 37 HG3 LYS 37 -8.288 -10.071 4.132
308 HD2 LYS 37 HD2 LYS 37 -6.026 -10.775 4.861
309 HD3 LYS 37 HD3 LYS 37 -6.543 -10.651 6.562
310 HE2 LYS 37 HE2 LYS 37 -8.331 -12.340 6.117
311 HE3 LYS 37 HE3 LYS 37 -7.774 -12.442 4.436
312 HZ1 LYS 37 HZ1 LYS 37 -6.582 -13.521 6.815
313 HZ2 LYS 37 HZ2 LYS 37 -6.629 -14.115 5.296
314 HZ3 LYS 37 HZ3 LYS 37 -5.532 -12.942 5.663
315 H GLY 38 H GLY 38 -8.110 -5.697 2.943
316 HA2 GLY 38 HA2 GLY 38 -7.570 -3.471 2.860
317 HA3 GLY 38 HA3 GLY 38 -8.028 -3.338 4.569
318 H GLU 39 H GLU 39 -5.637 -5.749 3.718
319 HA GLU 39 HA GLU 39 -3.526 -4.094 5.042
320 HB2 GLU 39 HB2 GLU 39 -3.784 -7.085 4.517
321 HB3 GLU 39 HB3 GLU 39 -2.405 -6.303 5.321
322 HG2 GLU 39 HG2 GLU 39 -3.863 -5.505 7.121
323 HG3 GLU 39 HG3 GLU 39 -5.285 -6.170 6.295
324 H ALA 40 H ALA 40 -1.428 -4.041 4.133
325 HA ALA 40 HA ALA 40 -1.114 -5.033 1.377
326 HB1 ALA 40 HB1 ALA 40 -2.033 -2.772 1.106
327 HB2 ALA 40 HB2 ALA 40 -0.808 -2.118 2.214
328 HB3 ALA 40 HB3 ALA 40 -0.316 -2.790 0.641
329 H LEU 41 H LEU 41 0.765 -6.039 1.283
330 HA LEU 41 HA LEU 41 2.983 -5.171 3.073
331 HB2 LEU 41 HB2 LEU 41 2.296 -7.960 2.036
332 HB3 LEU 41 HB3 LEU 41 3.752 -7.528 2.934
333 HG LEU 41 HG LEU 41 2.339 -8.532 4.489
334 HD11 LEU 41 HD11 LEU 41 2.455 -6.986 6.138
335 HD12 LEU 41 HD12 LEU 41 3.275 -6.040 4.904
336 HD13 LEU 41 HD13 LEU 41 1.544 -5.750 5.205
337 HD21 LEU 41 HD21 LEU 41 0.019 -7.988 4.901
338 HD22 LEU 41 HD22 LEU 41 0.055 -6.697 3.684
339 HD23 LEU 41 HD23 LEU 41 0.233 -8.396 3.184
340 H VAL 42 H VAL 42 5.109 -5.334 2.132
341 HA VAL 42 HA VAL 42 5.139 -5.764 -0.803
342 HB VAL 42 HB VAL 42 6.624 -3.853 -1.111
343 HG11 VAL 42 HG11 VAL 42 4.951 -2.176 -1.085
344 HG12 VAL 42 HG12 VAL 42 4.080 -3.705 -1.253
345 HG13 VAL 42 HG13 VAL 42 4.131 -2.899 0.331
346 HG21 VAL 42 HG21 VAL 42 6.036 -3.209 1.808
347 HG22 VAL 42 HG22 VAL 42 7.600 -3.754 1.160
348 HG23 VAL 42 HG23 VAL 42 6.936 -2.182 0.667
349 H GLU 43 H GLU 43 7.404 -6.049 -1.618
350 HA GLU 43 HA GLU 43 9.260 -7.086 0.450
351 HB2 GLU 43 HB2 GLU 43 7.962 -8.986 -0.544
352 HB3 GLU 43 HB3 GLU 43 8.550 -8.495 -2.147
353 HG2 GLU 43 HG2 GLU 43 10.902 -8.768 -1.298
354 HG3 GLU 43 HG3 GLU 43 10.238 -9.398 0.221
355 H GLY 44 H GLY 44 10.521 -5.209 0.206
356 HA2 GLY 44 HA2 GLY 44 12.210 -5.147 -2.139
357 HA3 GLY 44 HA3 GLY 44 11.082 -3.777 -2.070
358 H THR 45 H THR 45 13.587 -3.017 -2.021
359 HA THR 45 HA THR 45 14.528 -2.777 0.766
360 HB THR 45 HB THR 45 16.498 -1.740 -0.362
361 HG1 THR 45 HG1 THR 45 16.552 -1.944 -2.656
362 HG21 THR 45 HG21 THR 45 16.022 -4.306 -0.006
363 HG22 THR 45 HG22 THR 45 15.884 -4.338 -1.764
364 HG23 THR 45 HG23 THR 45 17.409 -3.799 -1.023
365 H ALA 46 H ALA 46 12.014 -1.426 -0.268
366 HA ALA 46 HA ALA 46 12.684 1.360 -0.596
367 HB1 ALA 46 HB1 ALA 46 9.988 0.329 0.298
368 HB2 ALA 46 HB2 ALA 46 10.370 1.698 -0.748
369 HB3 ALA 46 HB3 ALA 46 10.570 0.045 -1.375
370 H ASP 47 H ASP 47 11.651 3.038 0.947
371 HA ASP 47 HA ASP 47 12.255 2.213 3.739
372 HB2 ASP 47 HB2 ASP 47 12.417 4.913 2.361
373 HB3 ASP 47 HB3 ASP 47 12.657 4.657 4.101
374 HA PRO 48 HA PRO 48 8.219 2.816 5.155
375 HB2 PRO 48 HB2 PRO 48 9.357 4.773 7.149
376 HB3 PRO 48 HB3 PRO 48 8.259 3.383 7.443
377 HG2 PRO 48 HG2 PRO 48 10.898 3.161 8.001
378 HG3 PRO 48 HG3 PRO 48 10.048 1.823 7.156
379 HD2 PRO 48 HD2 PRO 48 11.808 3.973 5.969
380 HD3 PRO 48 HD3 PRO 48 11.761 2.219 5.605
381 H LYS 49 H LYS 49 10.023 5.967 5.095
382 HA LYS 49 HA LYS 49 7.582 7.486 4.848
383 HB2 LYS 49 HB2 LYS 49 10.498 8.223 4.366
384 HB3 LYS 49 HB3 LYS 49 9.142 9.370 4.381
385 HG2 LYS 49 HG2 LYS 49 8.587 8.634 6.707
386 HG3 LYS 49 HG3 LYS 49 10.051 7.622 6.705
387 HD2 LYS 49 HD2 LYS 49 11.446 9.621 6.315
388 HD3 LYS 49 HD3 LYS 49 9.985 10.632 6.223
389 HE2 LYS 49 HE2 LYS 49 9.405 9.940 8.555
390 HE3 LYS 49 HE3 LYS 49 10.945 9.062 8.648
391 HZ1 LYS 49 HZ1 LYS 49 10.619 11.947 8.193
392 HZ2 LYS 49 HZ2 LYS 49 11.107 11.239 9.596
393 HZ3 LYS 49 HZ3 LYS 49 12.065 11.150 8.257
394 H ALA 50 H ALA 50 9.439 5.654 2.563
395 HA ALA 50 HA ALA 50 8.640 7.392 0.321
396 HB1 ALA 50 HB1 ALA 50 10.873 6.334 0.335
397 HB2 ALA 50 HB2 ALA 50 10.113 4.726 0.410
398 HB3 ALA 50 HB3 ALA 50 9.893 5.747 -1.029
399 H LEU 51 H LEU 51 7.821 4.244 1.809
400 HA LEU 51 HA LEU 51 6.089 3.470 -0.356
401 HB2 LEU 51 HB2 LEU 51 7.316 2.011 1.428
402 HB3 LEU 51 HB3 LEU 51 5.937 2.414 2.474
403 HG LEU 51 HG LEU 51 4.451 1.622 0.505
404 HD11 LEU 51 HD11 LEU 51 5.606 -0.039 -0.997
405 HD12 LEU 51 HD12 LEU 51 6.181 1.622 -1.244
406 HD13 LEU 51 HD13 LEU 51 7.161 0.469 -0.309
407 HD21 LEU 51 HD21 LEU 51 4.893 0.337 2.621
408 HD22 LEU 51 HD22 LEU 51 4.595 -0.698 1.200
409 HD23 LEU 51 HD23 LEU 51 6.253 -0.457 1.799
410 H VAL 52 H VAL 52 5.534 4.748 2.971
411 HA VAL 52 HA VAL 52 2.694 4.638 2.776
412 HB VAL 52 HB VAL 52 4.539 6.255 4.578
413 HG11 VAL 52 HG11 VAL 52 1.581 5.560 4.843
414 HG12 VAL 52 HG12 VAL 52 2.579 6.306 6.113
415 HG13 VAL 52 HG13 VAL 52 2.263 7.188 4.605
416 HG21 VAL 52 HG21 VAL 52 4.100 4.414 6.177
417 HG22 VAL 52 HG22 VAL 52 3.125 3.578 4.947
418 HG23 VAL 52 HG23 VAL 52 4.872 3.802 4.697
419 H GLN 53 H GLN 53 5.042 7.025 1.612
420 HA GLN 53 HA GLN 53 3.088 9.168 1.534
421 HB2 GLN 53 HB2 GLN 53 5.556 9.560 1.614
422 HB3 GLN 53 HB3 GLN 53 5.698 8.828 -0.005
423 HG2 GLN 53 HG2 GLN 53 4.042 10.540 -0.840
424 HG3 GLN 53 HG3 GLN 53 4.103 11.313 0.753
425 HE21 GLN 53 HE21 GLN 53 6.583 12.630 -1.971
426 HE22 GLN 53 HE22 GLN 53 4.980 11.963 -2.172
427 H ALA 54 H ALA 54 4.310 6.685 -0.735
428 HA ALA 54 HA ALA 54 3.252 7.754 -3.101
429 HB1 ALA 54 HB1 ALA 54 3.450 5.449 -3.961
430 HB2 ALA 54 HB2 ALA 54 4.875 5.908 -3.000
431 HB3 ALA 54 HB3 ALA 54 3.634 4.841 -2.299
432 H VAL 55 H VAL 55 1.756 5.395 -0.801
433 HA VAL 55 HA VAL 55 -0.652 5.219 -2.371
434 HB VAL 55 HB VAL 55 -1.524 4.032 -0.343
435 HG11 VAL 55 HG11 VAL 55 -0.525 2.355 -1.485
436 HG12 VAL 55 HG12 VAL 55 0.896 3.358 -1.893
437 HG13 VAL 55 HG13 VAL 55 0.805 2.516 -0.331
438 HG21 VAL 55 HG21 VAL 55 -0.344 5.378 1.368
439 HG22 VAL 55 HG22 VAL 55 0.023 3.650 1.543
440 HG23 VAL 55 HG23 VAL 55 1.216 4.736 0.800
441 H GLU 56 H GLU 56 0.477 7.423 0.181
442 HA GLU 56 HA GLU 56 -2.199 8.362 0.767
443 HB2 GLU 56 HB2 GLU 56 -0.318 8.517 2.367
444 HB3 GLU 56 HB3 GLU 56 0.518 9.647 1.276
445 HG2 GLU 56 HG2 GLU 56 -1.361 11.228 1.447
446 HG3 GLU 56 HG3 GLU 56 -2.251 10.087 2.471
447 H GLU 57 H GLU 57 0.340 9.129 -1.580
448 HA GLU 57 HA GLU 57 -0.759 11.665 -2.403
449 HB2 GLU 57 HB2 GLU 57 1.352 9.760 -3.257
450 HB3 GLU 57 HB3 GLU 57 0.578 10.651 -4.589
451 HG2 GLU 57 HG2 GLU 57 0.981 12.785 -3.436
452 HG3 GLU 57 HG3 GLU 57 1.754 11.926 -2.094
453 H GLU 58 H GLU 58 -1.536 8.300 -2.954
454 HA GLU 58 HA GLU 58 -3.172 8.833 -5.330
455 HB2 GLU 58 HB2 GLU 58 -2.737 6.387 -3.570
456 HB3 GLU 58 HB3 GLU 58 -3.788 6.405 -5.000
457 HG2 GLU 58 HG2 GLU 58 -0.833 7.141 -5.041
458 HG3 GLU 58 HG3 GLU 58 -1.474 5.540 -5.454
459 H GLY 59 H GLY 59 -3.464 9.422 -2.032
460 HA2 GLY 59 HA2 GLY 59 -5.384 10.431 -1.101
461 HA3 GLY 59 HA3 GLY 59 -6.404 9.610 -2.298
462 H TYR 60 H TYR 60 -4.096 7.442 -1.046
463 HA TYR 60 HA TYR 60 -6.134 6.327 0.819
464 HB2 TYR 60 HB2 TYR 60 -4.134 5.040 -1.059
465 HB3 TYR 60 HB3 TYR 60 -4.951 4.146 0.220
466 HD1 TYR 60 HD1 TYR 60 -5.338 5.722 -3.064
467 HD2 TYR 60 HD2 TYR 60 -7.363 3.738 0.167
468 HE1 TYR 60 HE1 TYR 60 -7.292 5.317 -4.540
469 HE2 TYR 60 HE2 TYR 60 -9.315 3.323 -1.298
470 HH TYR 60 HH TYR 60 -10.219 3.600 -3.383
471 H LYS 61 H LYS 61 -5.371 7.354 2.711
472 HA LYS 61 HA LYS 61 -2.628 7.173 3.575
473 HB2 LYS 61 HB2 LYS 61 -5.258 7.596 5.048
474 HB3 LYS 61 HB3 LYS 61 -3.686 7.513 5.864
475 HG2 LYS 61 HG2 LYS 61 -2.866 9.364 4.389
476 HG3 LYS 61 HG3 LYS 61 -4.533 9.567 3.785
477 HD2 LYS 61 HD2 LYS 61 -5.330 10.020 6.052
478 HD3 LYS 61 HD3 LYS 61 -3.746 9.587 6.732
479 HE2 LYS 61 HE2 LYS 61 -2.717 11.485 5.497
480 HE3 LYS 61 HE3 LYS 61 -4.330 11.961 4.924
481 HZ1 LYS 61 HZ1 LYS 61 -3.666 13.170 6.877
482 HZ2 LYS 61 HZ2 LYS 61 -4.987 12.239 7.199
483 HZ3 LYS 61 HZ3 LYS 61 -3.498 11.775 7.738
484 H ALA 62 H ALA 62 -1.603 5.294 3.897
485 HA ALA 62 HA ALA 62 -3.068 3.188 5.400
486 HB1 ALA 62 HB1 ALA 62 -2.885 2.583 2.996
487 HB2 ALA 62 HB2 ALA 62 -1.119 2.753 3.106
488 HB3 ALA 62 HB3 ALA 62 -1.952 1.492 4.046
489 H GLU 63 H GLU 63 -2.164 3.868 7.343
490 HA GLU 63 HA GLU 63 0.719 4.304 7.548
491 HB2 GLU 63 HB2 GLU 63 -1.490 4.215 9.640
492 HB3 GLU 63 HB3 GLU 63 0.210 4.650 9.949
493 HG2 GLU 63 HG2 GLU 63 0.034 6.456 8.238
494 HG3 GLU 63 HG3 GLU 63 -1.685 6.075 8.034
495 H VAL 64 H VAL 64 2.212 2.993 8.514
496 HA VAL 64 HA VAL 64 1.909 0.197 8.252
497 HB VAL 64 HB VAL 64 4.101 0.130 9.446
498 HG11 VAL 64 HG11 VAL 64 3.698 2.219 7.269
499 HG12 VAL 64 HG12 VAL 64 5.299 1.640 7.802
500 HG13 VAL 64 HG13 VAL 64 4.135 0.512 7.069
501 HG21 VAL 64 HG21 VAL 64 3.661 3.137 9.711
502 HG22 VAL 64 HG22 VAL 64 3.700 1.969 11.054
503 HG23 VAL 64 HG23 VAL 64 5.161 2.264 10.092
504 H LEU 65 H LEU 65 1.455 -1.441 9.672
505 HA LEU 65 HA LEU 65 0.378 -0.653 12.323
506 HB2 LEU 65 HB2 LEU 65 0.345 -3.292 10.796
507 HB3 LEU 65 HB3 LEU 65 -0.434 -3.004 12.362
508 HG LEU 65 HG LEU 65 -1.119 -1.586 9.752
509 HD11 LEU 65 HD11 LEU 65 -2.571 -3.694 11.411
510 HD12 LEU 65 HD12 LEU 65 -3.231 -2.888 9.971
511 HD13 LEU 65 HD13 LEU 65 -1.813 -3.952 9.823
512 HD21 LEU 65 HD21 LEU 65 -1.483 -0.126 11.701
513 HD22 LEU 65 HD22 LEU 65 -3.040 -0.698 11.069
514 HD23 LEU 65 HD23 LEU 65 -2.354 -1.433 12.538
515 H ALA 66 H ALA 66 3.308 -0.609 11.632
516 HA ALA 66 HA ALA 66 4.215 -2.246 13.883
517 HB1 ALA 66 HB1 ALA 66 4.358 -3.824 11.987
518 HB2 ALA 66 HB2 ALA 66 5.303 -2.633 11.061
519 HB3 ALA 66 HB3 ALA 66 5.979 -3.349 12.544
Start of MODEL 5
1 H1 MET 1 H MET 1 9.508 -3.763 10.227
2 HA MET 1 HA MET 1 9.723 -3.554 7.286
3 HB2 MET 1 HB2 MET 1 9.922 -5.873 8.153
4 HB3 MET 1 HB3 MET 1 8.315 -5.718 8.893
5 HG2 MET 1 HG2 MET 1 7.308 -5.347 6.705
6 HG3 MET 1 HG3 MET 1 8.898 -5.309 5.933
7 HE1 MET 1 HE1 MET 1 10.313 -7.069 5.378
8 HE2 MET 1 HE2 MET 1 9.743 -8.724 5.015
9 HE3 MET 1 HE3 MET 1 9.017 -7.321 4.197
10 H LEU 2 H LEU 2 7.575 -3.459 6.175
11 HA LEU 2 HA LEU 2 5.801 -1.654 7.721
12 HB2 LEU 2 HB2 LEU 2 6.155 -1.984 4.720
13 HB3 LEU 2 HB3 LEU 2 5.191 -0.736 5.539
14 HG LEU 2 HG LEU 2 8.207 -1.123 5.839
15 HD11 LEU 2 HD11 LEU 2 7.601 -0.284 3.614
16 HD12 LEU 2 HD12 LEU 2 6.599 0.992 4.355
17 HD13 LEU 2 HD13 LEU 2 8.362 0.997 4.579
18 HD21 LEU 2 HD21 LEU 2 6.356 1.082 6.832
19 HD22 LEU 2 HD22 LEU 2 7.140 -0.146 7.856
20 HD23 LEU 2 HD23 LEU 2 8.123 1.058 6.997
21 H LYS 3 H LYS 3 3.488 -1.755 7.286
22 HA LYS 3 HA LYS 3 2.389 -4.259 6.264
23 HB2 LYS 3 HB2 LYS 3 3.195 -4.718 8.621
24 HB3 LYS 3 HB3 LYS 3 2.003 -3.539 9.202
25 HG2 LYS 3 HG2 LYS 3 0.178 -4.887 8.315
26 HG3 LYS 3 HG3 LYS 3 1.320 -5.928 7.434
27 HD2 LYS 3 HD2 LYS 3 2.322 -6.643 9.597
28 HD3 LYS 3 HD3 LYS 3 1.104 -5.682 10.464
29 HE2 LYS 3 HE2 LYS 3 -0.698 -7.025 9.398
30 HE3 LYS 3 HE3 LYS 3 0.537 -7.953 8.521
31 HZ1 LYS 3 HZ1 LYS 3 0.485 -9.279 10.246
32 HZ2 LYS 3 HZ2 LYS 3 1.319 -8.129 11.070
33 HZ3 LYS 3 HZ3 LYS 3 -0.321 -8.201 11.214
34 H LEU 4 H LEU 4 1.410 -2.776 4.797
35 HA LEU 4 HA LEU 4 0.350 -0.268 5.788
36 HB2 LEU 4 HB2 LEU 4 0.922 -1.614 3.190
37 HB3 LEU 4 HB3 LEU 4 -0.383 -0.415 3.173
38 HG LEU 4 HG LEU 4 1.120 1.252 4.222
39 HD11 LEU 4 HD11 LEU 4 3.248 -0.897 3.861
40 HD12 LEU 4 HD12 LEU 4 3.537 0.786 4.365
41 HD13 LEU 4 HD13 LEU 4 2.619 -0.309 5.419
42 HD21 LEU 4 HD21 LEU 4 0.918 1.101 1.761
43 HD22 LEU 4 HD22 LEU 4 2.555 1.605 2.243
44 HD23 LEU 4 HD23 LEU 4 2.255 -0.072 1.725
45 H LYS 5 H LYS 5 -1.507 -0.250 6.873
46 HA LYS 5 HA LYS 5 -3.809 -1.847 5.923
47 HB2 LYS 5 HB2 LYS 5 -3.285 -1.792 8.327
48 HB3 LYS 5 HB3 LYS 5 -3.435 -0.027 8.352
49 HG2 LYS 5 HG2 LYS 5 -5.769 -1.533 7.229
50 HG3 LYS 5 HG3 LYS 5 -5.448 -1.755 8.962
51 HD2 LYS 5 HD2 LYS 5 -5.396 0.713 9.268
52 HD3 LYS 5 HD3 LYS 5 -5.863 0.915 7.565
53 HE2 LYS 5 HE2 LYS 5 -7.927 -0.373 7.971
54 HE3 LYS 5 HE3 LYS 5 -7.459 -0.595 9.669
55 HZ1 LYS 5 HZ1 LYS 5 -8.001 1.978 8.354
56 HZ2 LYS 5 HZ2 LYS 5 -8.980 1.207 9.430
57 HZ3 LYS 5 HZ3 LYS 5 -7.518 1.788 9.919
58 H VAL 6 H VAL 6 -4.495 -0.845 4.031
59 HA VAL 6 HA VAL 6 -4.421 1.974 3.603
60 HB VAL 6 HB VAL 6 -6.167 -0.132 2.262
61 HG11 VAL 6 HG11 VAL 6 -5.098 2.568 1.319
62 HG12 VAL 6 HG12 VAL 6 -6.054 1.430 0.341
63 HG13 VAL 6 HG13 VAL 6 -6.787 2.219 1.755
64 HG21 VAL 6 HG21 VAL 6 -4.321 -0.284 0.618
65 HG22 VAL 6 HG22 VAL 6 -3.346 0.826 1.611
66 HG23 VAL 6 HG23 VAL 6 -3.779 -0.784 2.235
67 H GLU 7 H GLU 7 -5.868 3.564 4.047
68 HA GLU 7 HA GLU 7 -8.072 2.907 5.852
69 HB2 GLU 7 HB2 GLU 7 -6.439 4.824 6.163
70 HB3 GLU 7 HB3 GLU 7 -7.192 5.608 4.762
71 HG2 GLU 7 HG2 GLU 7 -8.175 6.451 6.839
72 HG3 GLU 7 HG3 GLU 7 -9.399 5.519 5.957
73 H GLY 8 H GLY 8 -10.266 3.428 5.463
74 HA2 GLY 8 HA2 GLY 8 -11.022 3.405 2.607
75 HA3 GLY 8 HA3 GLY 8 -12.067 3.051 4.000
76 H MET 9 H MET 9 -10.054 5.804 2.784
77 HA MET 9 HA MET 9 -11.611 7.773 4.129
78 HB2 MET 9 HB2 MET 9 -9.716 7.946 1.753
79 HB3 MET 9 HB3 MET 9 -10.389 9.349 2.611
80 HG2 MET 9 HG2 MET 9 -9.416 8.509 4.726
81 HG3 MET 9 HG3 MET 9 -8.685 7.157 3.850
82 HE1 MET 9 HE1 MET 9 -5.725 9.560 4.930
83 HE2 MET 9 HE2 MET 9 -7.256 9.288 5.793
84 HE3 MET 9 HE3 MET 9 -6.393 7.914 5.059
85 H THR 10 H THR 10 -11.420 7.108 0.556
86 HA THR 10 HA THR 10 -14.256 7.988 0.385
87 HB THR 10 HB THR 10 -13.579 9.246 -1.700
88 HG1 THR 10 HG1 THR 10 -11.595 8.477 -2.176
89 HG21 THR 10 HG21 THR 10 -13.986 10.379 0.464
90 HG22 THR 10 HG22 THR 10 -12.282 10.126 0.914
91 HG23 THR 10 HG23 THR 10 -12.692 11.179 -0.458
92 H CYS 11 H CYS 11 -15.208 7.469 -1.785
93 HA CYS 11 HA CYS 11 -15.951 5.785 -3.120
94 HB2 CYS 11 HB2 CYS 11 -12.984 5.737 -3.796
95 HB3 CYS 11 HB3 CYS 11 -14.286 5.018 -4.775
96 HG CYS 11 HG CYS 11 -13.961 7.089 -6.044
97 H ASN 12 H ASN 12 -15.330 4.957 -0.374
98 HA ASN 12 HA ASN 12 -14.012 2.413 -0.421
99 HB2 ASN 12 HB2 ASN 12 -15.027 2.151 1.809
100 HB3 ASN 12 HB3 ASN 12 -14.268 3.743 1.621
101 HD21 ASN 12 HD21 ASN 12 -18.057 3.563 2.836
102 HD22 ASN 12 HD22 ASN 12 -16.920 2.232 2.886
103 H HIS 13 H HIS 13 -16.992 3.439 -1.708
104 HA HIS 13 HA HIS 13 -18.462 0.963 -1.303
105 HB2 HIS 13 HB2 HIS 13 -18.840 3.221 -3.305
106 HB3 HIS 13 HB3 HIS 13 -20.028 1.970 -2.903
107 HD1 HIS 13 HD1 HIS 13 -19.195 5.420 -1.976
108 HD2 HIS 13 HD2 HIS 13 -20.616 1.962 -0.037
109 HE1 HIS 13 HE1 HIS 13 -20.279 6.192 0.205
110 H CYS 14 H CYS 14 -15.774 1.853 -3.148
111 HA CYS 14 HA CYS 14 -16.273 -0.342 -5.088
112 HB2 CYS 14 HB2 CYS 14 -14.928 2.338 -5.629
113 HB3 CYS 14 HB3 CYS 14 -15.095 0.998 -6.789
114 HG CYS 14 HG CYS 14 -16.795 2.897 -7.363
115 H VAL 15 H VAL 15 -13.886 -0.611 -6.246
116 HA VAL 15 HA VAL 15 -11.820 -0.559 -4.130
117 HB VAL 15 HB VAL 15 -12.920 -2.774 -4.052
118 HG11 VAL 15 HG11 VAL 15 -12.703 -4.317 -5.961
119 HG12 VAL 15 HG12 VAL 15 -13.666 -2.892 -6.407
120 HG13 VAL 15 HG13 VAL 15 -11.972 -3.023 -6.937
121 HG21 VAL 15 HG21 VAL 15 -10.897 -4.129 -4.261
122 HG22 VAL 15 HG22 VAL 15 -10.129 -2.881 -5.266
123 HG23 VAL 15 HG23 VAL 15 -10.498 -2.547 -3.556
124 H MET 16 H MET 16 -9.625 -0.699 -5.030
125 HA MET 16 HA MET 16 -9.479 -0.143 -7.941
126 HB2 MET 16 HB2 MET 16 -8.225 1.568 -5.755
127 HB3 MET 16 HB3 MET 16 -8.055 1.808 -7.507
128 HG2 MET 16 HG2 MET 16 -10.509 2.150 -7.676
129 HG3 MET 16 HG3 MET 16 -10.650 1.941 -5.925
130 HE1 MET 16 HE1 MET 16 -11.447 5.710 -6.296
131 HE2 MET 16 HE2 MET 16 -11.919 4.370 -7.368
132 HE3 MET 16 HE3 MET 16 -11.941 4.147 -5.602
133 H ALA 17 H ALA 17 -7.211 -0.271 -8.743
134 HA ALA 17 HA ALA 17 -5.847 -2.539 -7.542
135 HB1 ALA 17 HB1 ALA 17 -5.967 -2.216 -9.990
136 HB2 ALA 17 HB2 ALA 17 -5.079 -0.683 -9.835
137 HB3 ALA 17 HB3 ALA 17 -4.279 -2.219 -9.428
138 H VAL 18 H VAL 18 -5.212 -1.786 -5.439
139 HA VAL 18 HA VAL 18 -3.717 0.662 -5.143
140 HB VAL 18 HB VAL 18 -3.973 -1.738 -3.272
141 HG11 VAL 18 HG11 VAL 18 -3.283 1.196 -2.799
142 HG12 VAL 18 HG12 VAL 18 -3.509 -0.031 -1.530
143 HG13 VAL 18 HG13 VAL 18 -2.156 -0.176 -2.671
144 HG21 VAL 18 HG21 VAL 18 -5.630 0.274 -2.342
145 HG22 VAL 18 HG22 VAL 18 -5.829 0.431 -4.087
146 HG23 VAL 18 HG23 VAL 18 -6.182 -1.130 -3.309
147 H THR 19 H THR 19 -2.912 -2.659 -5.985
148 HA THR 19 HA THR 19 -0.262 -2.787 -5.113
149 HB THR 19 HB THR 19 -1.500 -3.902 -7.662
150 HG1 THR 19 HG1 THR 19 -1.823 -5.710 -6.327
151 HG21 THR 19 HG21 THR 19 0.274 -5.626 -7.456
152 HG22 THR 19 HG22 THR 19 0.968 -4.008 -7.694
153 HG23 THR 19 HG23 THR 19 0.964 -4.744 -6.073
154 H LYS 20 H LYS 20 -1.636 -1.236 -8.033
155 HA LYS 20 HA LYS 20 0.838 -0.775 -9.344
156 HB2 LYS 20 HB2 LYS 20 -1.789 0.761 -9.471
157 HB3 LYS 20 HB3 LYS 20 -0.462 0.887 -10.645
158 HG2 LYS 20 HG2 LYS 20 -0.686 -1.527 -11.161
159 HG3 LYS 20 HG3 LYS 20 -2.031 -1.647 -10.002
160 HD2 LYS 20 HD2 LYS 20 -3.304 0.031 -11.309
161 HD3 LYS 20 HD3 LYS 20 -1.962 0.138 -12.474
162 HE2 LYS 20 HE2 LYS 20 -2.213 -2.271 -12.980
163 HE3 LYS 20 HE3 LYS 20 -3.548 -2.380 -11.816
164 HZ1 LYS 20 HZ1 LYS 20 -4.757 -0.811 -13.151
165 HZ2 LYS 20 HZ2 LYS 20 -3.515 -0.712 -14.235
166 HZ3 LYS 20 HZ3 LYS 20 -4.336 -2.130 -14.047
167 H ALA 21 H ALA 21 -0.652 0.858 -6.591
168 HA ALA 21 HA ALA 21 0.782 3.348 -7.036
169 HB1 ALA 21 HB1 ALA 21 -0.614 2.237 -4.569
170 HB2 ALA 21 HB2 ALA 21 -0.075 3.917 -4.801
171 HB3 ALA 21 HB3 ALA 21 -1.367 3.248 -5.825
172 H LEU 22 H LEU 22 1.223 0.400 -5.029
173 HA LEU 22 HA LEU 22 3.473 1.472 -3.596
174 HB2 LEU 22 HB2 LEU 22 2.403 -1.345 -4.057
175 HB3 LEU 22 HB3 LEU 22 3.856 -1.011 -3.107
176 HG LEU 22 HG LEU 22 2.105 -1.209 -1.546
177 HD11 LEU 22 HD11 LEU 22 3.688 0.757 -1.283
178 HD12 LEU 22 HD12 LEU 22 2.407 1.788 -1.950
179 HD13 LEU 22 HD13 LEU 22 2.133 0.918 -0.427
180 HD21 LEU 22 HD21 LEU 22 0.207 -0.905 -3.105
181 HD22 LEU 22 HD22 LEU 22 0.022 0.056 -1.622
182 HD23 LEU 22 HD23 LEU 22 0.520 0.849 -3.130
183 H LYS 23 H LYS 23 3.097 -0.307 -6.650
184 HA LYS 23 HA LYS 23 5.738 -1.259 -6.817
185 HB2 LYS 23 HB2 LYS 23 3.701 -1.939 -8.159
186 HB3 LYS 23 HB3 LYS 23 3.982 -0.506 -9.177
187 HG2 LYS 23 HG2 LYS 23 6.232 -1.333 -9.741
188 HG3 LYS 23 HG3 LYS 23 6.042 -2.685 -8.602
189 HD2 LYS 23 HD2 LYS 23 4.122 -3.525 -9.928
190 HD3 LYS 23 HD3 LYS 23 4.360 -2.206 -11.098
191 HE2 LYS 23 HE2 LYS 23 6.635 -3.023 -11.577
192 HE3 LYS 23 HE3 LYS 23 6.451 -4.296 -10.355
193 HZ1 LYS 23 HZ1 LYS 23 4.853 -4.026 -12.803
194 HZ2 LYS 23 HZ2 LYS 23 6.044 -5.134 -12.533
195 HZ3 LYS 23 HZ3 LYS 23 4.653 -5.191 -11.652
196 H LYS 24 H LYS 24 4.538 2.016 -7.313
197 HA LYS 24 HA LYS 24 6.640 2.836 -9.104
198 HB2 LYS 24 HB2 LYS 24 4.906 4.403 -7.150
199 HB3 LYS 24 HB3 LYS 24 5.996 5.129 -8.344
200 HG2 LYS 24 HG2 LYS 24 4.736 4.001 -10.169
201 HG3 LYS 24 HG3 LYS 24 3.589 3.370 -8.959
202 HD2 LYS 24 HD2 LYS 24 3.059 5.676 -8.252
203 HD3 LYS 24 HD3 LYS 24 4.234 6.317 -9.420
204 HE2 LYS 24 HE2 LYS 24 2.931 5.338 -11.277
205 HE3 LYS 24 HE3 LYS 24 1.760 4.687 -10.113
206 HZ1 LYS 24 HZ1 LYS 24 2.361 7.535 -10.522
207 HZ2 LYS 24 HZ2 LYS 24 1.014 6.746 -11.053
208 HZ3 LYS 24 HZ3 LYS 24 1.278 6.933 -9.439
209 H VAL 25 H VAL 25 6.633 2.046 -5.722
210 HA VAL 25 HA VAL 25 8.638 3.981 -4.952
211 HB VAL 25 HB VAL 25 7.509 1.470 -3.673
212 HG11 VAL 25 HG11 VAL 25 8.572 2.262 -1.585
213 HG12 VAL 25 HG12 VAL 25 9.783 1.855 -2.820
214 HG13 VAL 25 HG13 VAL 25 9.384 3.558 -2.494
215 HG21 VAL 25 HG21 VAL 25 6.339 3.129 -2.257
216 HG22 VAL 25 HG22 VAL 25 7.108 4.449 -3.167
217 HG23 VAL 25 HG23 VAL 25 5.951 3.363 -3.973
218 HA PRO 26 HA PRO 26 12.124 1.791 -6.653
219 HB2 PRO 26 HB2 PRO 26 13.534 3.391 -4.535
220 HB3 PRO 26 HB3 PRO 26 13.947 3.232 -6.273
221 HG2 PRO 26 HG2 PRO 26 12.757 5.486 -5.346
222 HG3 PRO 26 HG3 PRO 26 12.217 4.751 -6.893
223 HD2 PRO 26 HD2 PRO 26 10.940 4.514 -4.164
224 HD3 PRO 26 HD3 PRO 26 10.169 4.787 -5.760
225 H GLY 27 H GLY 27 13.215 -0.086 -6.041
226 HA2 GLY 27 HA2 GLY 27 14.371 -1.487 -4.571
227 HA3 GLY 27 HA3 GLY 27 13.724 -0.586 -3.189
228 H VAL 28 H VAL 28 10.918 -0.839 -4.556
229 HA VAL 28 HA VAL 28 10.163 -3.260 -3.148
230 HB VAL 28 HB VAL 28 8.695 -1.365 -5.026
231 HG11 VAL 28 HG11 VAL 28 7.672 -3.598 -5.158
232 HG12 VAL 28 HG12 VAL 28 7.607 -3.686 -3.381
233 HG13 VAL 28 HG13 VAL 28 6.628 -2.482 -4.252
234 HG21 VAL 28 HG21 VAL 28 8.590 -1.802 -2.009
235 HG22 VAL 28 HG22 VAL 28 9.352 -0.423 -2.837
236 HG23 VAL 28 HG23 VAL 28 7.590 -0.650 -2.926
237 H GLU 29 H GLU 29 10.143 -5.322 -3.953
238 HA GLU 29 HA GLU 29 10.544 -5.584 -6.894
239 HB2 GLU 29 HB2 GLU 29 12.368 -6.416 -5.423
240 HB3 GLU 29 HB3 GLU 29 11.211 -7.517 -4.642
241 HG2 GLU 29 HG2 GLU 29 10.760 -8.576 -6.846
242 HG3 GLU 29 HG3 GLU 29 11.953 -7.497 -7.598
243 H LYS 30 H LYS 30 8.778 -6.902 -4.044
244 HA LYS 30 HA LYS 30 6.620 -7.689 -5.914
245 HB2 LYS 30 HB2 LYS 30 7.842 -9.442 -3.752
246 HB3 LYS 30 HB3 LYS 30 6.265 -9.747 -4.516
247 HG2 LYS 30 HG2 LYS 30 7.382 -9.712 -6.755
248 HG3 LYS 30 HG3 LYS 30 8.955 -9.583 -5.937
249 HD2 LYS 30 HD2 LYS 30 8.569 -11.732 -4.811
250 HD3 LYS 30 HD3 LYS 30 6.939 -11.833 -5.521
251 HE2 LYS 30 HE2 LYS 30 7.921 -11.826 -7.791
252 HE3 LYS 30 HE3 LYS 30 9.548 -11.737 -7.088
253 HZ1 LYS 30 HZ1 LYS 30 9.154 -13.845 -6.050
254 HZ2 LYS 30 HZ2 LYS 30 7.631 -13.926 -6.674
255 HZ3 LYS 30 HZ3 LYS 30 8.939 -13.971 -7.679
256 H VAL 31 H VAL 31 4.526 -7.824 -4.930
257 HA VAL 31 HA VAL 31 4.258 -6.550 -2.280
258 HB VAL 31 HB VAL 31 2.927 -5.567 -4.841
259 HG11 VAL 31 HG11 VAL 31 2.623 -4.650 -1.951
260 HG12 VAL 31 HG12 VAL 31 1.924 -3.836 -3.370
261 HG13 VAL 31 HG13 VAL 31 1.384 -5.469 -2.929
262 HG21 VAL 31 HG21 VAL 31 4.113 -3.448 -4.332
263 HG22 VAL 31 HG22 VAL 31 4.913 -4.235 -2.952
264 HG23 VAL 31 HG23 VAL 31 5.251 -4.783 -4.611
265 H GLU 32 H GLU 32 2.294 -7.126 -1.247
266 HA GLU 32 HA GLU 32 0.500 -8.976 -2.714
267 HB2 GLU 32 HB2 GLU 32 2.140 -10.364 -1.498
268 HB3 GLU 32 HB3 GLU 32 1.746 -9.506 0.011
269 HG2 GLU 32 HG2 GLU 32 -0.617 -10.247 -0.203
270 HG3 GLU 32 HG3 GLU 32 -0.204 -11.117 -1.691
271 H VAL 33 H VAL 33 -1.244 -7.592 -2.750
272 HA VAL 33 HA VAL 33 -1.965 -6.220 -0.228
273 HB VAL 33 HB VAL 33 -3.535 -4.965 -1.612
274 HG11 VAL 33 HG11 VAL 33 -1.175 -4.212 -1.517
275 HG12 VAL 33 HG12 VAL 33 -0.811 -5.191 -2.959
276 HG13 VAL 33 HG13 VAL 33 -1.932 -3.815 -3.076
277 HG21 VAL 33 HG21 VAL 33 -2.562 -6.725 -3.902
278 HG22 VAL 33 HG22 VAL 33 -4.189 -6.746 -3.182
279 HG23 VAL 33 HG23 VAL 33 -3.624 -5.308 -4.057
280 H SER 34 H SER 34 -4.112 -6.360 0.602
281 HA SER 34 HA SER 34 -5.683 -8.730 -0.281
282 HB2 SER 34 HB2 SER 34 -4.471 -9.231 1.820
283 HB3 SER 34 HB3 SER 34 -5.169 -7.777 2.568
284 HG SER 34 HG SER 34 -6.324 -9.705 3.046
285 H LEU 35 H LEU 35 -7.215 -7.616 -1.433
286 HA LEU 35 HA LEU 35 -8.022 -4.968 -0.816
287 HB2 LEU 35 HB2 LEU 35 -9.428 -7.100 -2.468
288 HB3 LEU 35 HB3 LEU 35 -9.725 -5.354 -2.552
289 HG LEU 35 HG LEU 35 -7.072 -6.723 -3.186
290 HD11 LEU 35 HD11 LEU 35 -7.604 -6.135 -5.523
291 HD12 LEU 35 HD12 LEU 35 -8.838 -7.219 -4.841
292 HD13 LEU 35 HD13 LEU 35 -9.176 -5.479 -5.005
293 HD21 LEU 35 HD21 LEU 35 -6.455 -4.495 -4.096
294 HD22 LEU 35 HD22 LEU 35 -7.998 -3.834 -3.508
295 HD23 LEU 35 HD23 LEU 35 -6.778 -4.419 -2.352
296 H GLU 36 H GLU 36 -9.099 -8.040 0.506
297 HA GLU 36 HA GLU 36 -11.729 -6.978 1.191
298 HB2 GLU 36 HB2 GLU 36 -10.316 -9.559 1.963
299 HB3 GLU 36 HB3 GLU 36 -12.021 -9.167 2.304
300 HG2 GLU 36 HG2 GLU 36 -12.393 -8.820 -0.144
301 HG3 GLU 36 HG3 GLU 36 -10.723 -9.327 -0.451
302 H LYS 37 H LYS 37 -8.575 -7.371 2.814
303 HA LYS 37 HA LYS 37 -9.827 -6.281 5.282
304 HB2 LYS 37 HB2 LYS 37 -7.182 -7.725 4.868
305 HB3 LYS 37 HB3 LYS 37 -7.683 -6.925 6.371
306 HG2 LYS 37 HG2 LYS 37 -8.495 -8.974 6.876
307 HG3 LYS 37 HG3 LYS 37 -9.902 -8.390 5.972
308 HD2 LYS 37 HD2 LYS 37 -9.026 -9.536 3.937
309 HD3 LYS 37 HD3 LYS 37 -7.616 -10.092 4.875
310 HE2 LYS 37 HE2 LYS 37 -9.164 -11.259 6.459
311 HE3 LYS 37 HE3 LYS 37 -10.532 -10.712 5.471
312 HZ1 LYS 37 HZ1 LYS 37 -8.635 -12.800 4.950
313 HZ2 LYS 37 HZ2 LYS 37 -10.219 -12.679 4.555
314 HZ3 LYS 37 HZ3 LYS 37 -9.104 -11.892 3.636
315 H GLY 38 H GLY 38 -8.097 -5.315 2.520
316 HA2 GLY 38 HA2 GLY 38 -7.224 -3.266 1.974
317 HA3 GLY 38 HA3 GLY 38 -7.787 -2.648 3.539
318 H GLU 39 H GLU 39 -5.727 -5.502 3.523
319 HA GLU 39 HA GLU 39 -3.560 -3.871 4.765
320 HB2 GLU 39 HB2 GLU 39 -4.121 -6.866 4.686
321 HB3 GLU 39 HB3 GLU 39 -2.759 -6.104 5.537
322 HG2 GLU 39 HG2 GLU 39 -4.314 -4.855 6.967
323 HG3 GLU 39 HG3 GLU 39 -5.698 -5.510 6.074
324 H ALA 40 H ALA 40 -1.352 -4.220 4.088
325 HA ALA 40 HA ALA 40 -0.979 -5.636 1.541
326 HB1 ALA 40 HB1 ALA 40 -0.222 -3.737 0.332
327 HB2 ALA 40 HB2 ALA 40 -1.749 -3.252 1.078
328 HB3 ALA 40 HB3 ALA 40 -0.215 -2.708 1.795
329 H LEU 41 H LEU 41 0.848 -6.699 1.595
330 HA LEU 41 HA LEU 41 3.048 -5.811 3.407
331 HB2 LEU 41 HB2 LEU 41 2.326 -8.538 2.241
332 HB3 LEU 41 HB3 LEU 41 3.858 -8.179 3.042
333 HG LEU 41 HG LEU 41 2.500 -9.236 4.659
334 HD11 LEU 41 HD11 LEU 41 3.757 -7.231 5.453
335 HD12 LEU 41 HD12 LEU 41 2.295 -6.244 5.201
336 HD13 LEU 41 HD13 LEU 41 2.292 -7.551 6.404
337 HD21 LEU 41 HD21 LEU 41 0.261 -8.527 5.273
338 HD22 LEU 41 HD22 LEU 41 0.316 -7.190 4.110
339 HD23 LEU 41 HD23 LEU 41 0.314 -8.873 3.529
340 H VAL 42 H VAL 42 5.210 -5.866 2.524
341 HA VAL 42 HA VAL 42 5.318 -6.018 -0.437
342 HB VAL 42 HB VAL 42 6.744 -4.038 -0.491
343 HG11 VAL 42 HG11 VAL 42 5.023 -2.420 -0.300
344 HG12 VAL 42 HG12 VAL 42 4.195 -3.942 -0.655
345 HG13 VAL 42 HG13 VAL 42 4.205 -3.320 1.012
346 HG21 VAL 42 HG21 VAL 42 6.086 -3.755 2.471
347 HG22 VAL 42 HG22 VAL 42 7.678 -4.174 1.795
348 HG23 VAL 42 HG23 VAL 42 6.971 -2.575 1.478
349 H GLU 43 H GLU 43 7.572 -6.240 -1.231
350 HA GLU 43 HA GLU 43 9.431 -7.382 0.773
351 HB2 GLU 43 HB2 GLU 43 8.120 -9.214 -0.312
352 HB3 GLU 43 HB3 GLU 43 8.720 -8.669 -1.891
353 HG2 GLU 43 HG2 GLU 43 11.049 -9.061 -1.128
354 HG3 GLU 43 HG3 GLU 43 10.442 -9.585 0.455
355 H GLY 44 H GLY 44 10.683 -5.504 0.648
356 HA2 GLY 44 HA2 GLY 44 12.422 -5.286 -1.639
357 HA3 GLY 44 HA3 GLY 44 11.277 -3.931 -1.536
358 H THR 45 H THR 45 13.651 -3.000 -1.334
359 HA THR 45 HA THR 45 14.323 -2.791 1.560
360 HB THR 45 HB THR 45 16.607 -2.220 0.746
361 HG1 THR 45 HG1 THR 45 17.006 -2.661 -1.478
362 HG21 THR 45 HG21 THR 45 15.506 -4.843 -0.352
363 HG22 THR 45 HG22 THR 45 17.209 -4.493 0.017
364 HG23 THR 45 HG23 THR 45 16.012 -4.559 1.330
365 H ALA 46 H ALA 46 12.237 -1.277 0.058
366 HA ALA 46 HA ALA 46 13.308 1.290 -0.644
367 HB1 ALA 46 HB1 ALA 46 10.938 1.931 -0.773
368 HB2 ALA 46 HB2 ALA 46 11.184 0.335 -1.525
369 HB3 ALA 46 HB3 ALA 46 10.473 0.452 0.101
370 H ASP 47 H ASP 47 12.526 3.337 0.411
371 HA ASP 47 HA ASP 47 13.246 3.337 3.207
372 HB2 ASP 47 HB2 ASP 47 13.749 5.097 1.422
373 HB3 ASP 47 HB3 ASP 47 12.055 5.603 1.570
374 HA PRO 48 HA PRO 48 9.309 2.868 5.087
375 HB2 PRO 48 HB2 PRO 48 10.146 5.231 6.769
376 HB3 PRO 48 HB3 PRO 48 9.442 3.668 7.305
377 HG2 PRO 48 HG2 PRO 48 12.101 4.087 7.536
378 HG3 PRO 48 HG3 PRO 48 11.503 2.523 6.880
379 HD2 PRO 48 HD2 PRO 48 12.557 4.915 5.364
380 HD3 PRO 48 HD3 PRO 48 12.907 3.174 5.111
381 H LYS 49 H LYS 49 10.234 6.361 4.679
382 HA LYS 49 HA LYS 49 7.472 7.184 4.534
383 HB2 LYS 49 HB2 LYS 49 10.088 8.574 3.835
384 HB3 LYS 49 HB3 LYS 49 8.494 9.356 3.791
385 HG2 LYS 49 HG2 LYS 49 8.164 8.765 6.196
386 HG3 LYS 49 HG3 LYS 49 9.823 8.120 6.234
387 HD2 LYS 49 HD2 LYS 49 10.627 10.208 6.554
388 HD3 LYS 49 HD3 LYS 49 9.900 10.724 5.014
389 HE2 LYS 49 HE2 LYS 49 7.731 11.078 6.185
390 HE3 LYS 49 HE3 LYS 49 8.504 10.641 7.721
391 HZ1 LYS 49 HZ1 LYS 49 9.274 12.893 5.996
392 HZ2 LYS 49 HZ2 LYS 49 8.406 13.002 7.393
393 HZ3 LYS 49 HZ3 LYS 49 9.973 12.497 7.440
394 H ALA 50 H ALA 50 9.721 5.893 2.158
395 HA ALA 50 HA ALA 50 8.560 7.260 -0.097
396 HB1 ALA 50 HB1 ALA 50 10.810 6.246 -0.152
397 HB2 ALA 50 HB2 ALA 50 10.091 4.630 0.061
398 HB3 ALA 50 HB3 ALA 50 9.767 5.564 -1.419
399 H LEU 51 H LEU 51 7.874 4.219 1.642
400 HA LEU 51 HA LEU 51 5.991 3.296 -0.333
401 HB2 LEU 51 HB2 LEU 51 7.345 1.963 1.462
402 HB3 LEU 51 HB3 LEU 51 6.038 2.443 2.565
403 HG LEU 51 HG LEU 51 4.419 1.505 0.787
404 HD11 LEU 51 HD11 LEU 51 5.446 -0.225 -0.712
405 HD12 LEU 51 HD12 LEU 51 6.017 1.412 -1.100
406 HD13 LEU 51 HD13 LEU 51 7.057 0.301 -0.180
407 HD21 LEU 51 HD21 LEU 51 5.081 0.339 2.924
408 HD22 LEU 51 HD22 LEU 51 4.661 -0.770 1.595
409 HD23 LEU 51 HD23 LEU 51 6.365 -0.484 2.012
410 H VAL 52 H VAL 52 5.771 4.982 2.814
411 HA VAL 52 HA VAL 52 2.940 4.948 3.027
412 HB VAL 52 HB VAL 52 5.093 6.769 4.169
413 HG11 VAL 52 HG11 VAL 52 2.914 7.909 4.302
414 HG12 VAL 52 HG12 VAL 52 2.184 6.454 5.021
415 HG13 VAL 52 HG13 VAL 52 3.433 7.355 5.907
416 HG21 VAL 52 HG21 VAL 52 4.802 5.353 6.172
417 HG22 VAL 52 HG22 VAL 52 3.575 4.389 5.320
418 HG23 VAL 52 HG23 VAL 52 5.265 4.367 4.766
419 H GLN 53 H GLN 53 5.122 7.025 1.151
420 HA GLN 53 HA GLN 53 3.060 9.078 0.875
421 HB2 GLN 53 HB2 GLN 53 5.509 9.573 1.029
422 HB3 GLN 53 HB3 GLN 53 5.728 8.800 -0.559
423 HG2 GLN 53 HG2 GLN 53 4.149 10.415 -1.561
424 HG3 GLN 53 HG3 GLN 53 3.869 11.146 0.030
425 HE21 GLN 53 HE21 GLN 53 6.259 13.402 -1.592
426 HE22 GLN 53 HE22 GLN 53 4.570 12.958 -1.682
427 H ALA 54 H ALA 54 4.223 6.265 -0.914
428 HA ALA 54 HA ALA 54 3.371 6.986 -3.499
429 HB1 ALA 54 HB1 ALA 54 3.453 4.569 -3.937
430 HB2 ALA 54 HB2 ALA 54 4.853 5.093 -2.976
431 HB3 ALA 54 HB3 ALA 54 3.503 4.242 -2.188
432 H VAL 55 H VAL 55 1.613 5.226 -0.871
433 HA VAL 55 HA VAL 55 -0.765 4.918 -2.470
434 HB VAL 55 HB VAL 55 -1.800 4.294 -0.287
435 HG11 VAL 55 HG11 VAL 55 -0.387 2.320 0.112
436 HG12 VAL 55 HG12 VAL 55 -0.543 2.638 -1.630
437 HG13 VAL 55 HG13 VAL 55 0.953 3.084 -0.774
438 HG21 VAL 55 HG21 VAL 55 -0.390 4.213 1.732
439 HG22 VAL 55 HG22 VAL 55 0.950 4.975 0.846
440 HG23 VAL 55 HG23 VAL 55 -0.548 5.885 1.153
441 H GLU 56 H GLU 56 0.583 7.546 -0.576
442 HA GLU 56 HA GLU 56 -1.893 8.872 -0.037
443 HB2 GLU 56 HB2 GLU 56 0.313 9.315 1.078
444 HB3 GLU 56 HB3 GLU 56 0.881 10.068 -0.428
445 HG2 GLU 56 HG2 GLU 56 -0.957 11.715 -0.298
446 HG3 GLU 56 HG3 GLU 56 -1.528 10.961 1.206
447 H GLU 57 H GLU 57 0.078 8.448 -2.909
448 HA GLU 57 HA GLU 57 -0.862 10.758 -4.334
449 HB2 GLU 57 HB2 GLU 57 1.126 9.388 -4.975
450 HB3 GLU 57 HB3 GLU 57 0.036 8.053 -5.408
451 HG2 GLU 57 HG2 GLU 57 -1.078 9.510 -7.075
452 HG3 GLU 57 HG3 GLU 57 0.008 10.843 -6.634
453 H GLU 58 H GLU 58 -2.207 7.538 -3.682
454 HA GLU 58 HA GLU 58 -4.305 7.862 -5.696
455 HB2 GLU 58 HB2 GLU 58 -3.855 5.808 -3.489
456 HB3 GLU 58 HB3 GLU 58 -5.150 5.731 -4.702
457 HG2 GLU 58 HG2 GLU 58 -2.160 5.743 -5.279
458 HG3 GLU 58 HG3 GLU 58 -3.241 4.341 -5.383
459 H GLY 59 H GLY 59 -3.730 9.042 -2.548
460 HA2 GLY 59 HA2 GLY 59 -5.213 10.655 -1.612
461 HA3 GLY 59 HA3 GLY 59 -6.580 9.859 -2.408
462 H TYR 60 H TYR 60 -4.416 7.592 -0.946
463 HA TYR 60 HA TYR 60 -6.147 7.507 1.486
464 HB2 TYR 60 HB2 TYR 60 -5.110 5.150 -0.127
465 HB3 TYR 60 HB3 TYR 60 -6.097 5.065 1.330
466 HD1 TYR 60 HD1 TYR 60 -6.071 5.422 -2.269
467 HD2 TYR 60 HD2 TYR 60 -8.478 5.842 1.264
468 HE1 TYR 60 HE1 TYR 60 -8.120 5.309 -3.664
469 HE2 TYR 60 HE2 TYR 60 -10.535 5.723 -0.113
470 HH TYR 60 HH TYR 60 -11.399 5.543 -2.226
471 H LYS 61 H LYS 61 -5.090 7.012 3.406
472 HA LYS 61 HA LYS 61 -2.137 6.838 3.313
473 HB2 LYS 61 HB2 LYS 61 -4.187 6.893 5.574
474 HB3 LYS 61 HB3 LYS 61 -2.453 6.634 5.828
475 HG2 LYS 61 HG2 LYS 61 -1.974 8.813 4.720
476 HG3 LYS 61 HG3 LYS 61 -3.729 9.115 4.617
477 HD2 LYS 61 HD2 LYS 61 -3.913 8.908 7.072
478 HD3 LYS 61 HD3 LYS 61 -2.188 8.507 7.182
479 HE2 LYS 61 HE2 LYS 61 -1.624 10.732 6.246
480 HE3 LYS 61 HE3 LYS 61 -3.351 11.141 6.198
481 HZ1 LYS 61 HZ1 LYS 61 -2.276 11.973 8.164
482 HZ2 LYS 61 HZ2 LYS 61 -3.420 10.861 8.567
483 HZ3 LYS 61 HZ3 LYS 61 -1.821 10.456 8.616
484 H ALA 62 H ALA 62 -1.204 5.071 4.787
485 HA ALA 62 HA ALA 62 -2.871 2.684 5.030
486 HB1 ALA 62 HB1 ALA 62 -1.929 2.436 2.767
487 HB2 ALA 62 HB2 ALA 62 -0.289 2.674 3.410
488 HB3 ALA 62 HB3 ALA 62 -1.236 1.244 3.887
489 H GLU 63 H GLU 63 -2.592 3.445 7.246
490 HA GLU 63 HA GLU 63 -0.122 3.971 8.448
491 HB2 GLU 63 HB2 GLU 63 -2.381 4.517 9.351
492 HB3 GLU 63 HB3 GLU 63 -2.605 2.801 9.755
493 HG2 GLU 63 HG2 GLU 63 -0.620 2.874 11.213
494 HG3 GLU 63 HG3 GLU 63 -0.333 4.568 10.772
495 H VAL 64 H VAL 64 1.595 2.732 8.739
496 HA VAL 64 HA VAL 64 1.691 -0.050 8.338
497 HB VAL 64 HB VAL 64 3.931 0.146 9.406
498 HG11 VAL 64 HG11 VAL 64 3.619 0.774 7.053
499 HG12 VAL 64 HG12 VAL 64 3.138 2.419 7.534
500 HG13 VAL 64 HG13 VAL 64 4.797 1.863 7.828
501 HG21 VAL 64 HG21 VAL 64 4.623 2.543 10.016
502 HG22 VAL 64 HG22 VAL 64 2.899 2.923 10.114
503 HG23 VAL 64 HG23 VAL 64 3.594 1.702 11.207
504 H LEU 65 H LEU 65 1.074 -1.728 9.555
505 HA LEU 65 HA LEU 65 0.027 -1.267 12.253
506 HB2 LEU 65 HB2 LEU 65 0.295 -3.774 10.543
507 HB3 LEU 65 HB3 LEU 65 -0.585 -3.671 12.078
508 HG LEU 65 HG LEU 65 -1.224 -2.102 9.554
509 HD11 LEU 65 HD11 LEU 65 -1.721 -4.773 10.101
510 HD12 LEU 65 HD12 LEU 65 -3.201 -3.990 10.662
511 HD13 LEU 65 HD13 LEU 65 -2.673 -3.754 8.980
512 HD21 LEU 65 HD21 LEU 65 -3.305 -1.478 10.765
513 HD22 LEU 65 HD22 LEU 65 -2.684 -2.284 12.224
514 HD23 LEU 65 HD23 LEU 65 -1.856 -0.848 11.576
515 H ALA 66 H ALA 66 2.944 -0.852 11.834
516 HA ALA 66 HA ALA 66 3.882 -2.831 13.815
517 HB1 ALA 66 HB1 ALA 66 4.502 -3.766 11.616
518 HB2 ALA 66 HB2 ALA 66 5.308 -2.238 11.188
519 HB3 ALA 66 HB3 ALA 66 5.940 -3.235 12.520
Start of MODEL 6
1 H1 MET 1 H MET 1 8.448 -6.095 8.463
2 HA MET 1 HA MET 1 9.550 -3.401 8.019
3 HB2 MET 1 HB2 MET 1 9.976 -5.294 6.286
4 HB3 MET 1 HB3 MET 1 8.294 -4.985 5.790
5 HG2 MET 1 HG2 MET 1 8.845 -2.593 5.470
6 HG3 MET 1 HG3 MET 1 10.468 -2.872 6.103
7 HE1 MET 1 HE1 MET 1 11.338 -1.533 4.320
8 HE2 MET 1 HE2 MET 1 11.497 -1.987 2.600
9 HE3 MET 1 HE3 MET 1 9.963 -1.335 3.222
10 H LEU 2 H LEU 2 7.562 -2.624 6.097
11 HA LEU 2 HA LEU 2 5.584 -1.730 8.028
12 HB2 LEU 2 HB2 LEU 2 5.863 -1.205 5.040
13 HB3 LEU 2 HB3 LEU 2 4.822 -0.319 6.174
14 HG LEU 2 HG LEU 2 7.868 -0.450 6.225
15 HD11 LEU 2 HD11 LEU 2 6.969 1.045 4.510
16 HD12 LEU 2 HD12 LEU 2 5.885 1.803 5.702
17 HD13 LEU 2 HD13 LEU 2 7.644 2.002 5.846
18 HD21 LEU 2 HD21 LEU 2 7.023 -0.409 8.524
19 HD22 LEU 2 HD22 LEU 2 7.671 1.186 8.095
20 HD23 LEU 2 HD23 LEU 2 5.915 0.921 8.120
21 H LYS 3 H LYS 3 3.282 -1.692 7.502
22 HA LYS 3 HA LYS 3 2.240 -4.152 6.217
23 HB2 LYS 3 HB2 LYS 3 2.838 -3.751 9.044
24 HB3 LYS 3 HB3 LYS 3 1.086 -3.926 8.817
25 HG2 LYS 3 HG2 LYS 3 1.333 -6.045 7.731
26 HG3 LYS 3 HG3 LYS 3 3.090 -5.809 7.545
27 HD2 LYS 3 HD2 LYS 3 3.308 -5.777 10.036
28 HD3 LYS 3 HD3 LYS 3 1.591 -6.229 10.163
29 HE2 LYS 3 HE2 LYS 3 2.015 -8.309 8.932
30 HE3 LYS 3 HE3 LYS 3 3.671 -7.780 8.577
31 HZ1 LYS 3 HZ1 LYS 3 4.208 -8.884 10.359
32 HZ2 LYS 3 HZ2 LYS 3 3.579 -7.646 11.226
33 HZ3 LYS 3 HZ3 LYS 3 2.654 -8.979 10.940
34 H LEU 4 H LEU 4 1.364 -2.565 4.777
35 HA LEU 4 HA LEU 4 0.236 -0.103 5.788
36 HB2 LEU 4 HB2 LEU 4 0.906 -1.399 3.171
37 HB3 LEU 4 HB3 LEU 4 -0.355 -0.158 3.147
38 HG LEU 4 HG LEU 4 1.179 1.404 4.351
39 HD11 LEU 4 HD11 LEU 4 3.227 -0.798 3.873
40 HD12 LEU 4 HD12 LEU 4 3.578 0.842 4.473
41 HD13 LEU 4 HD13 LEU 4 2.608 -0.274 5.457
42 HD21 LEU 4 HD21 LEU 4 0.997 1.407 1.877
43 HD22 LEU 4 HD22 LEU 4 2.631 1.852 2.416
44 HD23 LEU 4 HD23 LEU 4 2.315 0.217 1.785
45 H LYS 5 H LYS 5 -1.695 0.041 6.628
46 HA LYS 5 HA LYS 5 -3.939 -1.639 5.683
47 HB2 LYS 5 HB2 LYS 5 -3.510 -1.403 8.130
48 HB3 LYS 5 HB3 LYS 5 -3.661 0.358 7.965
49 HG2 LYS 5 HG2 LYS 5 -5.996 -0.077 6.990
50 HG3 LYS 5 HG3 LYS 5 -5.829 -1.742 7.593
51 HD2 LYS 5 HD2 LYS 5 -5.501 -0.898 9.877
52 HD3 LYS 5 HD3 LYS 5 -5.480 0.779 9.281
53 HE2 LYS 5 HE2 LYS 5 -7.799 0.514 8.457
54 HE3 LYS 5 HE3 LYS 5 -7.835 -1.143 9.093
55 HZ1 LYS 5 HZ1 LYS 5 -7.406 1.278 10.703
56 HZ2 LYS 5 HZ2 LYS 5 -8.832 0.459 10.579
57 HZ3 LYS 5 HZ3 LYS 5 -7.525 -0.266 11.273
58 H VAL 6 H VAL 6 -4.590 -0.730 3.711
59 HA VAL 6 HA VAL 6 -4.504 2.029 3.122
60 HB VAL 6 HB VAL 6 -6.342 -0.104 1.959
61 HG11 VAL 6 HG11 VAL 6 -5.244 2.513 0.836
62 HG12 VAL 6 HG12 VAL 6 -6.241 1.339 -0.056
63 HG13 VAL 6 HG13 VAL 6 -6.929 2.221 1.326
64 HG21 VAL 6 HG21 VAL 6 -4.543 -0.395 0.281
65 HG22 VAL 6 HG22 VAL 6 -3.521 0.755 1.175
66 HG23 VAL 6 HG23 VAL 6 -3.964 -0.804 1.910
67 H GLU 7 H GLU 7 -5.580 3.623 4.045
68 HA GLU 7 HA GLU 7 -7.874 3.233 5.713
69 HB2 GLU 7 HB2 GLU 7 -6.089 5.006 5.950
70 HB3 GLU 7 HB3 GLU 7 -6.770 5.809 4.519
71 HG2 GLU 7 HG2 GLU 7 -7.659 6.811 6.582
72 HG3 GLU 7 HG3 GLU 7 -8.959 5.996 5.695
73 H GLY 8 H GLY 8 -10.027 4.061 5.381
74 HA2 GLY 8 HA2 GLY 8 -10.876 3.913 2.550
75 HA3 GLY 8 HA3 GLY 8 -11.906 3.750 3.984
76 H MET 9 H MET 9 -9.559 6.285 2.853
77 HA MET 9 HA MET 9 -11.161 8.382 3.958
78 HB2 MET 9 HB2 MET 9 -8.887 8.384 1.936
79 HB3 MET 9 HB3 MET 9 -9.607 9.851 2.638
80 HG2 MET 9 HG2 MET 9 -9.088 9.009 4.906
81 HG3 MET 9 HG3 MET 9 -8.300 7.592 4.199
82 HE1 MET 9 HE1 MET 9 -5.493 9.915 5.814
83 HE2 MET 9 HE2 MET 9 -7.179 9.729 6.341
84 HE3 MET 9 HE3 MET 9 -6.237 8.299 5.857
85 H THR 10 H THR 10 -10.895 7.047 0.605
86 HA THR 10 HA THR 10 -13.383 8.554 0.003
87 HB THR 10 HB THR 10 -12.441 9.128 -2.230
88 HG1 THR 10 HG1 THR 10 -10.193 8.888 -2.483
89 HG21 THR 10 HG21 THR 10 -12.355 10.773 -0.373
90 HG22 THR 10 HG22 THR 10 -10.760 10.139 0.103
91 HG23 THR 10 HG23 THR 10 -10.966 10.940 -1.470
92 H CYS 11 H CYS 11 -14.485 7.752 -1.942
93 HA CYS 11 HA CYS 11 -15.544 6.013 -2.969
94 HB2 CYS 11 HB2 CYS 11 -12.655 5.571 -3.798
95 HB3 CYS 11 HB3 CYS 11 -14.095 5.012 -4.684
96 HG CYS 11 HG CYS 11 -15.174 7.365 -4.966
97 H ASN 12 H ASN 12 -14.903 5.220 -0.205
98 HA ASN 12 HA ASN 12 -13.753 2.595 -0.258
99 HB2 ASN 12 HB2 ASN 12 -14.514 2.439 2.025
100 HB3 ASN 12 HB3 ASN 12 -13.888 4.073 1.753
101 HD21 ASN 12 HD21 ASN 12 -17.500 3.696 3.333
102 HD22 ASN 12 HD22 ASN 12 -16.241 2.479 3.347
103 H HIS 13 H HIS 13 -16.703 3.724 -1.493
104 HA HIS 13 HA HIS 13 -18.348 1.441 -0.792
105 HB2 HIS 13 HB2 HIS 13 -18.626 3.474 -3.036
106 HB3 HIS 13 HB3 HIS 13 -19.897 2.404 -2.428
107 HD1 HIS 13 HD1 HIS 13 -19.462 5.819 -2.282
108 HD2 HIS 13 HD2 HIS 13 -19.618 2.852 0.700
109 HE1 HIS 13 HE1 HIS 13 -20.123 6.995 -0.105
110 H CYS 14 H CYS 14 -15.745 1.956 -2.964
111 HA CYS 14 HA CYS 14 -16.492 -0.486 -4.476
112 HB2 CYS 14 HB2 CYS 14 -15.260 2.055 -5.612
113 HB3 CYS 14 HB3 CYS 14 -15.537 0.540 -6.507
114 HG CYS 14 HG CYS 14 -17.338 2.293 -7.189
115 H VAL 15 H VAL 15 -14.272 -0.988 -5.870
116 HA VAL 15 HA VAL 15 -12.004 -0.781 -3.960
117 HB VAL 15 HB VAL 15 -13.136 -2.958 -3.687
118 HG11 VAL 15 HG11 VAL 15 -13.141 -4.579 -5.550
119 HG12 VAL 15 HG12 VAL 15 -14.104 -3.140 -5.955
120 HG13 VAL 15 HG13 VAL 15 -12.473 -3.341 -6.637
121 HG21 VAL 15 HG21 VAL 15 -11.185 -4.387 -4.021
122 HG22 VAL 15 HG22 VAL 15 -10.487 -3.226 -5.170
123 HG23 VAL 15 HG23 VAL 15 -10.659 -2.787 -3.453
124 H MET 16 H MET 16 -9.901 -0.992 -4.957
125 HA MET 16 HA MET 16 -9.807 -0.873 -7.905
126 HB2 MET 16 HB2 MET 16 -8.657 1.269 -6.064
127 HB3 MET 16 HB3 MET 16 -8.376 1.151 -7.813
128 HG2 MET 16 HG2 MET 16 -10.815 1.361 -8.206
129 HG3 MET 16 HG3 MET 16 -11.072 1.535 -6.464
130 HE1 MET 16 HE1 MET 16 -9.335 4.947 -5.666
131 HE2 MET 16 HE2 MET 16 -10.220 3.546 -5.018
132 HE3 MET 16 HE3 MET 16 -8.559 3.349 -5.624
133 H ALA 17 H ALA 17 -7.549 -1.132 -8.681
134 HA ALA 17 HA ALA 17 -6.104 -3.035 -7.012
135 HB1 ALA 17 HB1 ALA 17 -6.297 -3.329 -9.461
136 HB2 ALA 17 HB2 ALA 17 -5.450 -1.786 -9.716
137 HB3 ALA 17 HB3 ALA 17 -4.596 -3.155 -8.968
138 H VAL 18 H VAL 18 -5.435 -1.807 -5.186
139 HA VAL 18 HA VAL 18 -4.050 0.683 -5.424
140 HB VAL 18 HB VAL 18 -4.008 -1.388 -3.188
141 HG11 VAL 18 HG11 VAL 18 -3.444 1.611 -3.222
142 HG12 VAL 18 HG12 VAL 18 -3.543 0.601 -1.760
143 HG13 VAL 18 HG13 VAL 18 -2.247 0.324 -2.942
144 HG21 VAL 18 HG21 VAL 18 -5.837 0.994 -3.688
145 HG22 VAL 18 HG22 VAL 18 -6.305 -0.718 -3.789
146 HG23 VAL 18 HG23 VAL 18 -5.835 -0.018 -2.225
147 H THR 19 H THR 19 -3.137 -2.565 -6.078
148 HA THR 19 HA THR 19 -0.486 -2.730 -5.352
149 HB THR 19 HB THR 19 -1.745 -3.658 -7.960
150 HG1 THR 19 HG1 THR 19 -2.229 -5.513 -6.714
151 HG21 THR 19 HG21 THR 19 0.529 -4.839 -6.312
152 HG22 THR 19 HG22 THR 19 -0.101 -5.460 -7.851
153 HG23 THR 19 HG23 THR 19 0.742 -3.897 -7.813
154 H LYS 20 H LYS 20 -1.911 -0.973 -8.119
155 HA LYS 20 HA LYS 20 0.512 -0.466 -9.507
156 HB2 LYS 20 HB2 LYS 20 -2.069 1.148 -9.379
157 HB3 LYS 20 HB3 LYS 20 -0.810 1.305 -10.622
158 HG2 LYS 20 HG2 LYS 20 -1.181 -1.043 -11.304
159 HG3 LYS 20 HG3 LYS 20 -2.443 -1.208 -10.058
160 HD2 LYS 20 HD2 LYS 20 -3.740 0.606 -11.128
161 HD3 LYS 20 HD3 LYS 20 -2.474 0.784 -12.364
162 HE2 LYS 20 HE2 LYS 20 -2.841 -1.575 -13.057
163 HE3 LYS 20 HE3 LYS 20 -4.132 -1.720 -11.846
164 HZ1 LYS 20 HZ1 LYS 20 -5.304 0.027 -12.992
165 HZ2 LYS 20 HZ2 LYS 20 -4.105 0.140 -14.119
166 HZ3 LYS 20 HZ3 LYS 20 -5.003 -1.236 -14.008
167 H ALA 21 H ALA 21 -0.808 0.986 -6.580
168 HA ALA 21 HA ALA 21 0.683 3.469 -6.921
169 HB1 ALA 21 HB1 ALA 21 -0.757 2.286 -4.514
170 HB2 ALA 21 HB2 ALA 21 -0.165 3.956 -4.664
171 HB3 ALA 21 HB3 ALA 21 -1.473 3.379 -5.722
172 H LEU 22 H LEU 22 1.240 0.280 -5.503
173 HA LEU 22 HA LEU 22 3.409 1.237 -3.795
174 HB2 LEU 22 HB2 LEU 22 2.259 -1.485 -4.511
175 HB3 LEU 22 HB3 LEU 22 3.749 -1.312 -3.573
176 HG LEU 22 HG LEU 22 1.931 -1.615 -2.046
177 HD11 LEU 22 HD11 LEU 22 3.764 0.051 -1.514
178 HD12 LEU 22 HD12 LEU 22 2.637 1.341 -1.984
179 HD13 LEU 22 HD13 LEU 22 2.245 0.285 -0.611
180 HD21 LEU 22 HD21 LEU 22 0.097 -0.805 -3.514
181 HD22 LEU 22 HD22 LEU 22 0.032 -0.101 -1.883
182 HD23 LEU 22 HD23 LEU 22 0.639 0.869 -3.239
183 H LYS 23 H LYS 23 3.071 -0.289 -7.007
184 HA LYS 23 HA LYS 23 5.748 -1.167 -7.214
185 HB2 LYS 23 HB2 LYS 23 3.765 -1.802 -8.658
186 HB3 LYS 23 HB3 LYS 23 3.985 -0.258 -9.514
187 HG2 LYS 23 HG2 LYS 23 6.323 -0.916 -10.051
188 HG3 LYS 23 HG3 LYS 23 6.089 -2.452 -9.187
189 HD2 LYS 23 HD2 LYS 23 4.323 -3.097 -10.772
190 HD3 LYS 23 HD3 LYS 23 4.472 -1.527 -11.599
191 HE2 LYS 23 HE2 LYS 23 6.846 -2.040 -12.118
192 HE3 LYS 23 HE3 LYS 23 6.666 -3.626 -11.341
193 HZ1 LYS 23 HZ1 LYS 23 5.150 -2.683 -13.676
194 HZ2 LYS 23 HZ2 LYS 23 6.407 -3.749 -13.712
195 HZ3 LYS 23 HZ3 LYS 23 5.000 -4.162 -12.963
196 H LYS 24 H LYS 24 4.408 2.074 -7.475
197 HA LYS 24 HA LYS 24 6.480 3.119 -9.166
198 HB2 LYS 24 HB2 LYS 24 4.722 4.544 -7.126
199 HB3 LYS 24 HB3 LYS 24 5.656 5.307 -8.428
200 HG2 LYS 24 HG2 LYS 24 4.335 3.937 -10.088
201 HG3 LYS 24 HG3 LYS 24 3.312 3.389 -8.736
202 HD2 LYS 24 HD2 LYS 24 2.797 5.777 -8.205
203 HD3 LYS 24 HD3 LYS 24 3.784 6.276 -9.595
204 HE2 LYS 24 HE2 LYS 24 2.289 4.913 -11.079
205 HE3 LYS 24 HE3 LYS 24 1.260 4.578 -9.670
206 HZ1 LYS 24 HZ1 LYS 24 0.947 6.953 -9.445
207 HZ2 LYS 24 HZ2 LYS 24 1.863 7.231 -10.786
208 HZ3 LYS 24 HZ3 LYS 24 0.431 6.420 -10.917
209 H VAL 25 H VAL 25 6.491 2.156 -5.823
210 HA VAL 25 HA VAL 25 8.463 4.119 -4.980
211 HB VAL 25 HB VAL 25 7.346 1.571 -3.763
212 HG11 VAL 25 HG11 VAL 25 8.417 2.308 -1.663
213 HG12 VAL 25 HG12 VAL 25 9.625 1.958 -2.920
214 HG13 VAL 25 HG13 VAL 25 9.206 3.644 -2.535
215 HG21 VAL 25 HG21 VAL 25 6.171 3.162 -2.288
216 HG22 VAL 25 HG22 VAL 25 6.923 4.526 -3.147
217 HG23 VAL 25 HG23 VAL 25 5.772 3.464 -3.993
218 HA PRO 26 HA PRO 26 11.941 1.951 -6.749
219 HB2 PRO 26 HB2 PRO 26 13.356 3.528 -4.610
220 HB3 PRO 26 HB3 PRO 26 13.778 3.373 -6.348
221 HG2 PRO 26 HG2 PRO 26 12.587 5.627 -5.438
222 HG3 PRO 26 HG3 PRO 26 12.030 4.875 -6.974
223 HD2 PRO 26 HD2 PRO 26 10.798 4.639 -4.218
224 HD3 PRO 26 HD3 PRO 26 9.995 4.933 -5.794
225 H GLY 27 H GLY 27 13.067 0.080 -6.184
226 HA2 GLY 27 HA2 GLY 27 14.229 -1.351 -4.746
227 HA3 GLY 27 HA3 GLY 27 13.567 -0.494 -3.345
228 H VAL 28 H VAL 28 10.785 -0.740 -4.782
229 HA VAL 28 HA VAL 28 10.021 -3.146 -3.363
230 HB VAL 28 HB VAL 28 8.562 -1.247 -5.245
231 HG11 VAL 28 HG11 VAL 28 7.520 -3.471 -5.354
232 HG12 VAL 28 HG12 VAL 28 7.476 -3.544 -3.574
233 HG13 VAL 28 HG13 VAL 28 6.492 -2.342 -4.445
234 HG21 VAL 28 HG21 VAL 28 8.499 -1.654 -2.223
235 HG22 VAL 28 HG22 VAL 28 9.214 -0.271 -3.085
236 HG23 VAL 28 HG23 VAL 28 7.457 -0.533 -3.132
237 H GLU 29 H GLU 29 10.140 -5.192 -4.132
238 HA GLU 29 HA GLU 29 9.782 -5.552 -7.057
239 HB2 GLU 29 HB2 GLU 29 12.189 -5.795 -6.427
240 HB3 GLU 29 HB3 GLU 29 11.734 -7.136 -5.350
241 HG2 GLU 29 HG2 GLU 29 10.732 -8.325 -7.288
242 HG3 GLU 29 HG3 GLU 29 11.198 -6.981 -8.350
243 H LYS 30 H LYS 30 9.258 -6.610 -3.737
244 HA LYS 30 HA LYS 30 7.125 -8.400 -4.775
245 HB2 LYS 30 HB2 LYS 30 9.175 -8.986 -2.622
246 HB3 LYS 30 HB3 LYS 30 7.574 -9.754 -2.638
247 HG2 LYS 30 HG2 LYS 30 8.002 -10.433 -5.036
248 HG3 LYS 30 HG3 LYS 30 9.696 -9.935 -4.808
249 HD2 LYS 30 HD2 LYS 30 9.952 -11.546 -2.982
250 HD3 LYS 30 HD3 LYS 30 8.212 -11.907 -3.014
251 HE2 LYS 30 HE2 LYS 30 8.443 -12.743 -5.346
252 HE3 LYS 30 HE3 LYS 30 10.197 -12.480 -5.248
253 HZ1 LYS 30 HZ1 LYS 30 10.268 -14.036 -3.443
254 HZ2 LYS 30 HZ2 LYS 30 8.637 -14.255 -3.499
255 HZ3 LYS 30 HZ3 LYS 30 9.580 -14.742 -4.762
256 H VAL 31 H VAL 31 5.222 -8.112 -3.980
257 HA VAL 31 HA VAL 31 4.786 -6.786 -1.389
258 HB VAL 31 HB VAL 31 3.605 -5.866 -4.042
259 HG11 VAL 31 HG11 VAL 31 3.093 -4.798 -1.240
260 HG12 VAL 31 HG12 VAL 31 2.418 -4.156 -2.752
261 HG13 VAL 31 HG13 VAL 31 1.956 -5.778 -2.195
262 HG21 VAL 31 HG21 VAL 31 5.212 -4.177 -2.110
263 HG22 VAL 31 HG22 VAL 31 5.976 -5.072 -3.459
264 HG23 VAL 31 HG23 VAL 31 4.759 -3.819 -3.778
265 H GLU 32 H GLU 32 2.781 -7.486 -0.494
266 HA GLU 32 HA GLU 32 1.178 -9.360 -2.150
267 HB2 GLU 32 HB2 GLU 32 2.790 -10.659 -0.786
268 HB3 GLU 32 HB3 GLU 32 2.178 -9.872 0.683
269 HG2 GLU 32 HG2 GLU 32 -0.051 -10.814 0.299
270 HG3 GLU 32 HG3 GLU 32 0.480 -11.504 -1.248
271 H VAL 33 H VAL 33 -0.929 -8.734 -2.088
272 HA VAL 33 HA VAL 33 -1.744 -7.124 0.280
273 HB VAL 33 HB VAL 33 -2.835 -5.542 -1.168
274 HG11 VAL 33 HG11 VAL 33 -0.369 -5.287 -0.791
275 HG12 VAL 33 HG12 VAL 33 -0.079 -6.167 -2.307
276 HG13 VAL 33 HG13 VAL 33 -0.904 -4.597 -2.342
277 HG21 VAL 33 HG21 VAL 33 -1.917 -7.312 -3.476
278 HG22 VAL 33 HG22 VAL 33 -3.598 -7.087 -2.935
279 HG23 VAL 33 HG23 VAL 33 -2.700 -5.723 -3.636
280 H SER 34 H SER 34 -3.986 -7.053 0.725
281 HA SER 34 HA SER 34 -5.578 -9.208 -0.572
282 HB2 SER 34 HB2 SER 34 -4.775 -9.925 1.663
283 HB3 SER 34 HB3 SER 34 -5.565 -8.506 2.390
284 HG SER 34 HG SER 34 -6.789 -10.542 2.340
285 H LEU 35 H LEU 35 -6.887 -8.033 -1.837
286 HA LEU 35 HA LEU 35 -7.607 -5.348 -1.386
287 HB2 LEU 35 HB2 LEU 35 -9.096 -7.421 -3.034
288 HB3 LEU 35 HB3 LEU 35 -9.108 -5.665 -3.271
289 HG LEU 35 HG LEU 35 -6.667 -7.475 -3.557
290 HD11 LEU 35 HD11 LEU 35 -6.923 -7.034 -5.966
291 HD12 LEU 35 HD12 LEU 35 -8.375 -7.826 -5.314
292 HD13 LEU 35 HD13 LEU 35 -8.390 -6.078 -5.645
293 HD21 LEU 35 HD21 LEU 35 -5.605 -5.476 -4.545
294 HD22 LEU 35 HD22 LEU 35 -7.073 -4.527 -4.219
295 HD23 LEU 35 HD23 LEU 35 -6.100 -5.157 -2.868
296 H GLU 36 H GLU 36 -8.910 -8.257 0.020
297 HA GLU 36 HA GLU 36 -11.562 -7.091 0.460
298 HB2 GLU 36 HB2 GLU 36 -10.250 -9.656 1.439
299 HB3 GLU 36 HB3 GLU 36 -11.956 -9.216 1.682
300 HG2 GLU 36 HG2 GLU 36 -12.285 -9.094 -0.761
301 HG3 GLU 36 HG3 GLU 36 -10.577 -9.496 -1.023
302 H LYS 37 H LYS 37 -8.499 -7.486 2.235
303 HA LYS 37 HA LYS 37 -9.824 -6.386 4.654
304 HB2 LYS 37 HB2 LYS 37 -7.166 -7.827 4.303
305 HB3 LYS 37 HB3 LYS 37 -7.718 -7.051 5.801
306 HG2 LYS 37 HG2 LYS 37 -8.540 -9.117 6.237
307 HG3 LYS 37 HG3 LYS 37 -9.923 -8.506 5.313
308 HD2 LYS 37 HD2 LYS 37 -9.005 -9.604 3.274
309 HD3 LYS 37 HD3 LYS 37 -7.610 -10.178 4.222
310 HE2 LYS 37 HE2 LYS 37 -9.169 -11.410 5.736
311 HE3 LYS 37 HE3 LYS 37 -10.529 -10.830 4.756
312 HZ1 LYS 37 HZ1 LYS 37 -8.613 -12.886 4.168
313 HZ2 LYS 37 HZ2 LYS 37 -10.196 -12.778 3.789
314 HZ3 LYS 37 HZ3 LYS 37 -9.101 -11.943 2.887
315 H GLY 38 H GLY 38 -7.980 -5.389 1.963
316 HA2 GLY 38 HA2 GLY 38 -7.139 -3.315 1.473
317 HA3 GLY 38 HA3 GLY 38 -7.786 -2.730 3.015
318 H GLU 39 H GLU 39 -5.610 -5.503 3.072
319 HA GLU 39 HA GLU 39 -3.567 -3.743 4.346
320 HB2 GLU 39 HB2 GLU 39 -3.985 -6.760 4.419
321 HB3 GLU 39 HB3 GLU 39 -2.682 -5.874 5.245
322 HG2 GLU 39 HG2 GLU 39 -4.399 -4.554 6.482
323 HG3 GLU 39 HG3 GLU 39 -5.673 -5.515 5.706
324 H ALA 40 H ALA 40 -1.346 -4.040 3.820
325 HA ALA 40 HA ALA 40 -0.742 -5.443 1.306
326 HB1 ALA 40 HB1 ALA 40 0.037 -3.490 0.182
327 HB2 ALA 40 HB2 ALA 40 -1.554 -3.076 0.824
328 HB3 ALA 40 HB3 ALA 40 -0.103 -2.491 1.664
329 H LEU 41 H LEU 41 0.961 -6.648 1.795
330 HA LEU 41 HA LEU 41 2.939 -5.719 3.806
331 HB2 LEU 41 HB2 LEU 41 2.582 -8.380 2.345
332 HB3 LEU 41 HB3 LEU 41 3.790 -8.039 3.586
333 HG LEU 41 HG LEU 41 2.092 -9.250 4.666
334 HD11 LEU 41 HD11 LEU 41 2.894 -7.259 5.908
335 HD12 LEU 41 HD12 LEU 41 1.532 -6.315 5.253
336 HD13 LEU 41 HD13 LEU 41 1.222 -7.692 6.334
337 HD21 LEU 41 HD21 LEU 41 -0.271 -8.755 4.599
338 HD22 LEU 41 HD22 LEU 41 0.000 -7.311 3.609
339 HD23 LEU 41 HD23 LEU 41 0.324 -8.926 2.933
340 H VAL 42 H VAL 42 5.221 -5.688 3.258
341 HA VAL 42 HA VAL 42 5.804 -5.838 0.351
342 HB VAL 42 HB VAL 42 7.168 -3.808 0.524
343 HG11 VAL 42 HG11 VAL 42 5.390 -2.248 0.414
344 HG12 VAL 42 HG12 VAL 42 4.672 -3.794 -0.056
345 HG13 VAL 42 HG13 VAL 42 4.400 -3.170 1.588
346 HG21 VAL 42 HG21 VAL 42 5.997 -3.550 3.328
347 HG22 VAL 42 HG22 VAL 42 7.696 -3.907 2.944
348 HG23 VAL 42 HG23 VAL 42 6.997 -2.336 2.498
349 H GLU 43 H GLU 43 7.968 -6.470 -0.148
350 HA GLU 43 HA GLU 43 9.712 -7.010 2.173
351 HB2 GLU 43 HB2 GLU 43 8.339 -9.059 1.657
352 HB3 GLU 43 HB3 GLU 43 9.118 -9.122 0.065
353 HG2 GLU 43 HG2 GLU 43 11.325 -9.329 1.145
354 HG3 GLU 43 HG3 GLU 43 10.588 -9.111 2.739
355 H GLY 44 H GLY 44 10.346 -4.888 0.923
356 HA2 GLY 44 HA2 GLY 44 12.410 -5.651 -1.077
357 HA3 GLY 44 HA3 GLY 44 11.283 -4.317 -1.394
358 H THR 45 H THR 45 13.634 -3.399 -1.585
359 HA THR 45 HA THR 45 14.765 -2.591 1.025
360 HB THR 45 HB THR 45 16.647 -1.822 -0.451
361 HG1 THR 45 HG1 THR 45 16.493 -2.525 -2.649
362 HG21 THR 45 HG21 THR 45 15.728 -4.693 -0.910
363 HG22 THR 45 HG22 THR 45 17.388 -4.081 -1.101
364 HG23 THR 45 HG23 THR 45 16.629 -4.104 0.508
365 H ALA 46 H ALA 46 12.176 -1.426 -0.140
366 HA ALA 46 HA ALA 46 12.897 1.182 -1.149
367 HB1 ALA 46 HB1 ALA 46 10.472 1.611 -0.924
368 HB2 ALA 46 HB2 ALA 46 10.784 0.049 -1.719
369 HB3 ALA 46 HB3 ALA 46 10.288 0.095 -0.010
370 H ASP 47 H ASP 47 12.151 3.222 -0.100
371 HA ASP 47 HA ASP 47 13.052 3.332 2.671
372 HB2 ASP 47 HB2 ASP 47 13.532 5.036 0.823
373 HB3 ASP 47 HB3 ASP 47 11.848 5.564 0.995
374 HA PRO 48 HA PRO 48 9.027 2.756 4.421
375 HB2 PRO 48 HB2 PRO 48 10.142 4.657 6.485
376 HB3 PRO 48 HB3 PRO 48 9.273 3.109 6.750
377 HG2 PRO 48 HG2 PRO 48 11.964 3.194 6.988
378 HG3 PRO 48 HG3 PRO 48 11.195 1.843 6.085
379 HD2 PRO 48 HD2 PRO 48 12.509 4.332 4.977
380 HD3 PRO 48 HD3 PRO 48 12.647 2.633 4.421
381 H LYS 49 H LYS 49 10.485 6.016 4.163
382 HA LYS 49 HA LYS 49 8.018 7.425 4.641
383 HB2 LYS 49 HB2 LYS 49 10.616 8.322 3.329
384 HB3 LYS 49 HB3 LYS 49 9.354 9.387 3.988
385 HG2 LYS 49 HG2 LYS 49 9.730 8.498 6.242
386 HG3 LYS 49 HG3 LYS 49 10.891 7.309 5.610
387 HD2 LYS 49 HD2 LYS 49 12.342 9.159 4.812
388 HD3 LYS 49 HD3 LYS 49 11.219 10.336 5.539
389 HE2 LYS 49 HE2 LYS 49 11.578 9.332 7.757
390 HE3 LYS 49 HE3 LYS 49 12.624 8.087 7.043
391 HZ1 LYS 49 HZ1 LYS 49 14.125 9.818 6.373
392 HZ2 LYS 49 HZ2 LYS 49 13.166 10.973 7.053
393 HZ3 LYS 49 HZ3 LYS 49 13.899 9.840 8.004
394 H ALA 50 H ALA 50 9.637 6.109 1.763
395 HA ALA 50 HA ALA 50 8.046 7.691 -0.085
396 HB1 ALA 50 HB1 ALA 50 10.297 6.849 -0.661
397 HB2 ALA 50 HB2 ALA 50 9.721 5.174 -0.482
398 HB3 ALA 50 HB3 ALA 50 9.069 6.206 -1.777
399 H LEU 51 H LEU 51 7.870 4.477 1.440
400 HA LEU 51 HA LEU 51 5.876 3.403 -0.259
401 HB2 LEU 51 HB2 LEU 51 7.409 2.271 1.517
402 HB3 LEU 51 HB3 LEU 51 6.152 2.745 2.679
403 HG LEU 51 HG LEU 51 4.479 1.594 1.089
404 HD11 LEU 51 HD11 LEU 51 5.496 -0.169 -0.366
405 HD12 LEU 51 HD12 LEU 51 5.938 1.467 -0.901
406 HD13 LEU 51 HD13 LEU 51 7.108 0.479 0.004
407 HD21 LEU 51 HD21 LEU 51 5.342 0.643 3.246
408 HD22 LEU 51 HD22 LEU 51 4.942 -0.602 2.035
409 HD23 LEU 51 HD23 LEU 51 6.639 -0.152 2.333
410 H VAL 52 H VAL 52 5.673 5.201 2.839
411 HA VAL 52 HA VAL 52 2.834 5.035 3.095
412 HB VAL 52 HB VAL 52 4.919 6.974 4.188
413 HG11 VAL 52 HG11 VAL 52 2.753 6.777 5.977
414 HG12 VAL 52 HG12 VAL 52 3.186 8.190 4.974
415 HG13 VAL 52 HG13 VAL 52 2.001 6.999 4.395
416 HG21 VAL 52 HG21 VAL 52 4.747 5.565 6.202
417 HG22 VAL 52 HG22 VAL 52 3.547 4.532 5.391
418 HG23 VAL 52 HG23 VAL 52 5.222 4.585 4.797
419 H GLN 53 H GLN 53 4.957 7.083 1.154
420 HA GLN 53 HA GLN 53 2.874 9.102 0.798
421 HB2 GLN 53 HB2 GLN 53 5.324 9.620 0.946
422 HB3 GLN 53 HB3 GLN 53 5.546 8.813 -0.626
423 HG2 GLN 53 HG2 GLN 53 3.964 10.387 -1.665
424 HG3 GLN 53 HG3 GLN 53 3.642 11.136 -0.088
425 HE21 GLN 53 HE21 GLN 53 5.995 13.466 -1.588
426 HE22 GLN 53 HE22 GLN 53 4.312 12.995 -1.698
427 H ALA 54 H ALA 54 4.106 6.241 -0.881
428 HA ALA 54 HA ALA 54 3.229 6.828 -3.474
429 HB1 ALA 54 HB1 ALA 54 2.883 4.017 -2.677
430 HB2 ALA 54 HB2 ALA 54 3.944 4.737 -3.893
431 HB3 ALA 54 HB3 ALA 54 4.459 4.711 -2.191
432 H VAL 55 H VAL 55 1.463 5.209 -0.777
433 HA VAL 55 HA VAL 55 -0.950 4.892 -2.337
434 HB VAL 55 HB VAL 55 -1.940 4.340 -0.090
435 HG11 VAL 55 HG11 VAL 55 -1.167 2.329 -0.784
436 HG12 VAL 55 HG12 VAL 55 0.360 3.028 -1.399
437 HG13 VAL 55 HG13 VAL 55 0.187 2.603 0.318
438 HG21 VAL 55 HG21 VAL 55 -0.435 4.264 1.856
439 HG22 VAL 55 HG22 VAL 55 0.889 4.942 0.886
440 HG23 VAL 55 HG23 VAL 55 -0.554 5.923 1.237
441 H GLU 56 H GLU 56 0.504 7.523 -0.542
442 HA GLU 56 HA GLU 56 -1.936 8.906 0.056
443 HB2 GLU 56 HB2 GLU 56 0.294 9.301 1.135
444 HB3 GLU 56 HB3 GLU 56 0.861 10.029 -0.383
445 HG2 GLU 56 HG2 GLU 56 -0.921 11.735 -0.232
446 HG3 GLU 56 HG3 GLU 56 -1.498 10.999 1.279
447 H GLU 57 H GLU 57 -0.034 8.419 -2.854
448 HA GLU 57 HA GLU 57 -1.004 10.723 -4.281
449 HB2 GLU 57 HB2 GLU 57 0.995 9.386 -4.947
450 HB3 GLU 57 HB3 GLU 57 -0.076 8.024 -5.349
451 HG2 GLU 57 HG2 GLU 57 -1.252 9.432 -7.005
452 HG3 GLU 57 HG3 GLU 57 -0.217 10.809 -6.581
453 H GLU 58 H GLU 58 -2.343 7.577 -3.442
454 HA GLU 58 HA GLU 58 -4.498 7.782 -5.425
455 HB2 GLU 58 HB2 GLU 58 -3.950 5.874 -3.114
456 HB3 GLU 58 HB3 GLU 58 -5.344 5.747 -4.207
457 HG2 GLU 58 HG2 GLU 58 -2.430 5.688 -5.081
458 HG3 GLU 58 HG3 GLU 58 -3.475 4.267 -4.896
459 H GLY 59 H GLY 59 -3.745 9.128 -2.384
460 HA2 GLY 59 HA2 GLY 59 -5.124 10.814 -1.429
461 HA3 GLY 59 HA3 GLY 59 -6.558 10.038 -2.130
462 H TYR 60 H TYR 60 -4.286 7.842 -0.655
463 HA TYR 60 HA TYR 60 -6.006 7.770 1.786
464 HB2 TYR 60 HB2 TYR 60 -4.895 5.407 0.238
465 HB3 TYR 60 HB3 TYR 60 -5.946 5.340 1.651
466 HD1 TYR 60 HD1 TYR 60 -5.757 5.759 -1.964
467 HD2 TYR 60 HD2 TYR 60 -8.333 5.959 1.461
468 HE1 TYR 60 HE1 TYR 60 -7.732 5.563 -3.453
469 HE2 TYR 60 HE2 TYR 60 -10.310 5.724 -0.001
470 HH TYR 60 HH TYR 60 -11.078 5.578 -2.162
471 H LYS 61 H LYS 61 -4.980 7.264 3.713
472 HA LYS 61 HA LYS 61 -2.032 7.111 3.716
473 HB2 LYS 61 HB2 LYS 61 -4.173 6.945 5.883
474 HB3 LYS 61 HB3 LYS 61 -2.455 6.645 6.191
475 HG2 LYS 61 HG2 LYS 61 -1.908 8.920 5.361
476 HG3 LYS 61 HG3 LYS 61 -3.652 9.258 5.197
477 HD2 LYS 61 HD2 LYS 61 -3.993 8.833 7.585
478 HD3 LYS 61 HD3 LYS 61 -2.316 8.272 7.758
479 HE2 LYS 61 HE2 LYS 61 -1.506 10.531 7.130
480 HE3 LYS 61 HE3 LYS 61 -3.189 11.098 7.055
481 HZ1 LYS 61 HZ1 LYS 61 -2.173 11.581 9.158
482 HZ2 LYS 61 HZ2 LYS 61 -3.411 10.517 9.364
483 HZ3 LYS 61 HZ3 LYS 61 -1.850 9.987 9.426
484 H ALA 62 H ALA 62 -1.176 5.224 5.152
485 HA ALA 62 HA ALA 62 -2.784 2.782 4.995
486 HB1 ALA 62 HB1 ALA 62 -1.601 2.773 2.850
487 HB2 ALA 62 HB2 ALA 62 -0.048 3.012 3.687
488 HB3 ALA 62 HB3 ALA 62 -0.978 1.511 3.931
489 H GLU 63 H GLU 63 -2.799 3.317 7.269
490 HA GLU 63 HA GLU 63 -0.589 3.842 8.854
491 HB2 GLU 63 HB2 GLU 63 -2.993 4.066 9.468
492 HB3 GLU 63 HB3 GLU 63 -3.083 2.302 9.664
493 HG2 GLU 63 HG2 GLU 63 -1.343 2.395 11.403
494 HG3 GLU 63 HG3 GLU 63 -1.148 4.141 11.141
495 H VAL 64 H VAL 64 1.235 2.734 8.935
496 HA VAL 64 HA VAL 64 1.572 0.005 8.355
497 HB VAL 64 HB VAL 64 3.834 0.367 9.347
498 HG11 VAL 64 HG11 VAL 64 2.658 2.517 7.537
499 HG12 VAL 64 HG12 VAL 64 4.406 2.308 7.811
500 HG13 VAL 64 HG13 VAL 64 3.450 1.012 7.053
501 HG21 VAL 64 HG21 VAL 64 4.319 2.796 10.022
502 HG22 VAL 64 HG22 VAL 64 2.572 3.004 10.205
503 HG23 VAL 64 HG23 VAL 64 3.431 1.822 11.220
504 H LEU 65 H LEU 65 0.701 -1.641 9.437
505 HA LEU 65 HA LEU 65 0.056 -1.395 12.292
506 HB2 LEU 65 HB2 LEU 65 -0.300 -3.689 10.318
507 HB3 LEU 65 HB3 LEU 65 -0.924 -3.647 11.975
508 HG LEU 65 HG LEU 65 -1.688 -1.742 9.735
509 HD11 LEU 65 HD11 LEU 65 -2.499 -4.354 10.160
510 HD12 LEU 65 HD12 LEU 65 -3.727 -3.434 11.034
511 HD13 LEU 65 HD13 LEU 65 -3.457 -3.107 9.307
512 HD21 LEU 65 HD21 LEU 65 -3.424 -0.944 11.331
513 HD22 LEU 65 HD22 LEU 65 -2.712 -1.968 12.600
514 HD23 LEU 65 HD23 LEU 65 -1.784 -0.610 11.920
515 H ALA 66 H ALA 66 2.870 -1.224 11.661
516 HA ALA 66 HA ALA 66 3.849 -3.857 12.655
517 HB1 ALA 66 HB1 ALA 66 4.677 -3.296 10.406
518 HB2 ALA 66 HB2 ALA 66 5.284 -1.736 11.012
519 HB3 ALA 66 HB3 ALA 66 5.997 -3.257 11.599
Start of MODEL 7
1 H1 MET 1 H MET 1 8.477 -3.532 11.024
2 HA MET 1 HA MET 1 9.624 -3.435 8.297
3 HB2 MET 1 HB2 MET 1 9.432 -5.707 9.394
4 HB3 MET 1 HB3 MET 1 7.669 -5.492 9.377
5 HG2 MET 1 HG2 MET 1 7.711 -5.263 6.939
6 HG3 MET 1 HG3 MET 1 9.478 -5.348 6.932
7 HE1 MET 1 HE1 MET 1 10.123 -8.567 5.880
8 HE2 MET 1 HE2 MET 1 10.595 -6.912 6.292
9 HE3 MET 1 HE3 MET 1 10.776 -8.200 7.504
10 H LEU 2 H LEU 2 7.885 -3.373 6.542
11 HA LEU 2 HA LEU 2 5.911 -1.354 7.394
12 HB2 LEU 2 HB2 LEU 2 6.521 -2.382 4.598
13 HB3 LEU 2 HB3 LEU 2 5.693 -0.876 5.046
14 HG LEU 2 HG LEU 2 8.615 -1.591 5.563
15 HD11 LEU 2 HD11 LEU 2 8.078 -0.933 3.242
16 HD12 LEU 2 HD12 LEU 2 7.331 0.568 3.845
17 HD13 LEU 2 HD13 LEU 2 9.076 0.291 4.057
18 HD21 LEU 2 HD21 LEU 2 7.733 -0.296 7.453
19 HD22 LEU 2 HD22 LEU 2 8.825 0.698 6.466
20 HD23 LEU 2 HD23 LEU 2 7.065 0.912 6.335
21 H LYS 3 H LYS 3 3.632 -1.579 6.994
22 HA LYS 3 HA LYS 3 2.531 -4.101 6.068
23 HB2 LYS 3 HB2 LYS 3 3.569 -4.550 8.364
24 HB3 LYS 3 HB3 LYS 3 2.337 -3.479 9.048
25 HG2 LYS 3 HG2 LYS 3 0.565 -4.965 8.286
26 HG3 LYS 3 HG3 LYS 3 1.722 -5.887 7.294
27 HD2 LYS 3 HD2 LYS 3 2.970 -6.482 9.384
28 HD3 LYS 3 HD3 LYS 3 1.663 -5.739 10.333
29 HE2 LYS 3 HE2 LYS 3 0.040 -7.302 9.333
30 HE3 LYS 3 HE3 LYS 3 1.318 -7.996 8.314
31 HZ1 LYS 3 HZ1 LYS 3 2.449 -8.666 10.321
32 HZ2 LYS 3 HZ2 LYS 3 1.216 -8.072 11.246
33 HZ3 LYS 3 HZ3 LYS 3 0.945 -9.337 10.225
34 H LEU 4 H LEU 4 1.381 -2.467 4.732
35 HA LEU 4 HA LEU 4 0.295 -0.148 6.103
36 HB2 LEU 4 HB2 LEU 4 0.571 -1.171 3.303
37 HB3 LEU 4 HB3 LEU 4 -0.741 -0.021 3.615
38 HG LEU 4 HG LEU 4 0.846 1.576 4.612
39 HD11 LEU 4 HD11 LEU 4 2.941 -0.484 3.800
40 HD12 LEU 4 HD12 LEU 4 3.281 1.162 4.387
41 HD13 LEU 4 HD13 LEU 4 2.514 -0.022 5.465
42 HD21 LEU 4 HD21 LEU 4 0.352 1.649 2.180
43 HD22 LEU 4 HD22 LEU 4 2.017 2.175 2.521
44 HD23 LEU 4 HD23 LEU 4 1.712 0.544 1.876
45 H LYS 5 H LYS 5 -1.592 0.061 7.027
46 HA LYS 5 HA LYS 5 -3.823 -1.773 6.340
47 HB2 LYS 5 HB2 LYS 5 -3.108 -1.604 8.707
48 HB3 LYS 5 HB3 LYS 5 -3.445 0.135 8.698
49 HG2 LYS 5 HG2 LYS 5 -5.667 -1.647 7.768
50 HG3 LYS 5 HG3 LYS 5 -5.216 -1.782 9.480
51 HD2 LYS 5 HD2 LYS 5 -5.429 0.685 9.730
52 HD3 LYS 5 HD3 LYS 5 -6.019 0.779 8.053
53 HE2 LYS 5 HE2 LYS 5 -7.884 -0.736 8.621
54 HE3 LYS 5 HE3 LYS 5 -7.291 -0.845 10.291
55 HZ1 LYS 5 HZ1 LYS 5 -8.196 1.608 8.951
56 HZ2 LYS 5 HZ2 LYS 5 -9.043 0.757 10.074
57 HZ3 LYS 5 HZ3 LYS 5 -7.641 1.511 10.501
58 H VAL 6 H VAL 6 -4.510 -0.805 4.394
59 HA VAL 6 HA VAL 6 -4.618 2.028 4.030
60 HB VAL 6 HB VAL 6 -6.057 -0.177 2.503
61 HG11 VAL 6 HG11 VAL 6 -5.169 2.642 1.755
62 HG12 VAL 6 HG12 VAL 6 -5.895 1.462 0.638
63 HG13 VAL 6 HG13 VAL 6 -6.847 2.099 1.993
64 HG21 VAL 6 HG21 VAL 6 -4.082 -0.148 1.022
65 HG22 VAL 6 HG22 VAL 6 -3.285 1.028 2.091
66 HG23 VAL 6 HG23 VAL 6 -3.620 -0.622 2.669
67 H GLU 7 H GLU 7 -6.191 3.484 4.378
68 HA GLU 7 HA GLU 7 -8.707 2.607 5.646
69 HB2 GLU 7 HB2 GLU 7 -7.429 4.517 6.579
70 HB3 GLU 7 HB3 GLU 7 -7.590 5.378 5.037
71 HG2 GLU 7 HG2 GLU 7 -9.265 6.136 6.702
72 HG3 GLU 7 HG3 GLU 7 -10.032 5.416 5.280
73 H GLY 8 H GLY 8 -10.786 3.131 4.739
74 HA2 GLY 8 HA2 GLY 8 -10.799 3.144 1.801
75 HA3 GLY 8 HA3 GLY 8 -12.187 2.914 2.886
76 H MET 9 H MET 9 -9.715 5.504 2.275
77 HA MET 9 HA MET 9 -11.492 7.592 3.085
78 HB2 MET 9 HB2 MET 9 -8.961 7.641 1.412
79 HB3 MET 9 HB3 MET 9 -9.745 9.080 2.085
80 HG2 MET 9 HG2 MET 9 -9.107 6.848 3.983
81 HG3 MET 9 HG3 MET 9 -7.752 7.758 3.309
82 HE1 MET 9 HE1 MET 9 -6.834 8.642 5.514
83 HE2 MET 9 HE2 MET 9 -7.838 9.341 6.806
84 HE3 MET 9 HE3 MET 9 -8.048 7.638 6.337
85 H THR 10 H THR 10 -10.762 6.120 -0.107
86 HA THR 10 HA THR 10 -12.942 7.804 -1.223
87 HB THR 10 HB THR 10 -11.586 8.136 -3.272
88 HG1 THR 10 HG1 THR 10 -10.109 6.551 -3.242
89 HG21 THR 10 HG21 THR 10 -11.617 9.854 -1.483
90 HG22 THR 10 HG22 THR 10 -10.203 9.080 -0.725
91 HG23 THR 10 HG23 THR 10 -10.057 9.814 -2.338
92 H CYS 11 H CYS 11 -13.659 6.988 -3.392
93 HA CYS 11 HA CYS 11 -14.724 5.331 -4.523
94 HB2 CYS 11 HB2 CYS 11 -11.989 4.035 -4.243
95 HB3 CYS 11 HB3 CYS 11 -13.226 3.615 -5.452
96 HG CYS 11 HG CYS 11 -13.416 6.018 -6.471
97 H ASN 12 H ASN 12 -15.168 5.194 -1.654
98 HA ASN 12 HA ASN 12 -14.833 2.521 -0.712
99 HB2 ASN 12 HB2 ASN 12 -16.367 3.186 1.044
100 HB3 ASN 12 HB3 ASN 12 -15.250 4.523 0.716
101 HD21 ASN 12 HD21 ASN 12 -19.230 5.114 0.475
102 HD22 ASN 12 HD22 ASN 12 -18.455 3.750 1.254
103 H HIS 13 H HIS 13 -17.005 3.888 -3.046
104 HA HIS 13 HA HIS 13 -19.092 1.873 -2.625
105 HB2 HIS 13 HB2 HIS 13 -18.643 3.917 -4.833
106 HB3 HIS 13 HB3 HIS 13 -20.099 2.935 -4.616
107 HD1 HIS 13 HD1 HIS 13 -18.725 6.234 -3.631
108 HD2 HIS 13 HD2 HIS 13 -21.356 3.341 -2.061
109 HE1 HIS 13 HE1 HIS 13 -20.118 7.402 -1.840
110 H CYS 14 H CYS 14 -16.015 1.939 -4.002
111 HA CYS 14 HA CYS 14 -16.661 -0.371 -5.748
112 HB2 CYS 14 HB2 CYS 14 -14.752 1.917 -6.367
113 HB3 CYS 14 HB3 CYS 14 -14.986 0.464 -7.367
114 HG CYS 14 HG CYS 14 -16.927 1.114 -8.529
115 H VAL 15 H VAL 15 -14.162 -1.108 -6.482
116 HA VAL 15 HA VAL 15 -12.972 -2.019 -3.965
117 HB VAL 15 HB VAL 15 -13.274 -3.512 -5.942
118 HG11 VAL 15 HG11 VAL 15 -11.819 -3.198 -7.917
119 HG12 VAL 15 HG12 VAL 15 -12.919 -1.818 -7.709
120 HG13 VAL 15 HG13 VAL 15 -11.210 -1.677 -7.233
121 HG21 VAL 15 HG21 VAL 15 -11.033 -4.488 -5.930
122 HG22 VAL 15 HG22 VAL 15 -10.346 -2.982 -5.290
123 HG23 VAL 15 HG23 VAL 15 -11.465 -3.944 -4.293
124 H MET 16 H MET 16 -10.605 -1.673 -3.562
125 HA MET 16 HA MET 16 -9.857 1.078 -4.415
126 HB2 MET 16 HB2 MET 16 -8.779 -0.705 -2.193
127 HB3 MET 16 HB3 MET 16 -8.341 0.991 -2.477
128 HG2 MET 16 HG2 MET 16 -10.686 1.660 -2.082
129 HG3 MET 16 HG3 MET 16 -11.125 -0.031 -1.805
130 HE1 MET 16 HE1 MET 16 -9.186 -0.906 1.479
131 HE2 MET 16 HE2 MET 16 -10.298 -1.488 0.218
132 HE3 MET 16 HE3 MET 16 -8.605 -1.113 -0.187
133 H ALA 17 H ALA 17 -8.328 1.267 -5.991
134 HA ALA 17 HA ALA 17 -6.680 -1.103 -6.629
135 HB1 ALA 17 HB1 ALA 17 -7.765 0.166 -8.456
136 HB2 ALA 17 HB2 ALA 17 -6.919 1.641 -7.936
137 HB3 ALA 17 HB3 ALA 17 -5.993 0.265 -8.577
138 H VAL 18 H VAL 18 -5.469 -1.037 -4.586
139 HA VAL 18 HA VAL 18 -3.596 1.255 -4.387
140 HB VAL 18 HB VAL 18 -4.112 -1.020 -2.434
141 HG11 VAL 18 HG11 VAL 18 -2.786 1.711 -2.130
142 HG12 VAL 18 HG12 VAL 18 -3.069 0.546 -0.816
143 HG13 VAL 18 HG13 VAL 18 -1.949 0.141 -2.132
144 HG21 VAL 18 HG21 VAL 18 -5.263 1.801 -2.514
145 HG22 VAL 18 HG22 VAL 18 -6.169 0.296 -2.801
146 HG23 VAL 18 HG23 VAL 18 -5.482 0.624 -1.198
147 H THR 19 H THR 19 -3.837 -2.049 -5.409
148 HA THR 19 HA THR 19 -1.390 -3.120 -4.788
149 HB THR 19 HB THR 19 -2.796 -3.449 -7.462
150 HG1 THR 19 HG1 THR 19 -4.068 -4.962 -6.340
151 HG21 THR 19 HG21 THR 19 -1.990 -5.779 -7.230
152 HG22 THR 19 HG22 THR 19 -0.636 -4.627 -7.203
153 HG23 THR 19 HG23 THR 19 -1.213 -5.358 -5.686
154 H LYS 20 H LYS 20 -2.156 -1.188 -7.744
155 HA LYS 20 HA LYS 20 0.487 -1.378 -8.780
156 HB2 LYS 20 HB2 LYS 20 -1.718 0.652 -9.296
157 HB3 LYS 20 HB3 LYS 20 -0.258 0.452 -10.289
158 HG2 LYS 20 HG2 LYS 20 -1.479 -2.138 -9.907
159 HG3 LYS 20 HG3 LYS 20 -2.721 -0.995 -10.463
160 HD2 LYS 20 HD2 LYS 20 -1.304 -0.338 -12.362
161 HD3 LYS 20 HD3 LYS 20 -0.009 -1.416 -11.787
162 HE2 LYS 20 HE2 LYS 20 -1.525 -3.360 -12.023
163 HE3 LYS 20 HE3 LYS 20 -2.809 -2.287 -12.615
164 HZ1 LYS 20 HZ1 LYS 20 -1.409 -1.718 -14.457
165 HZ2 LYS 20 HZ2 LYS 20 -0.200 -2.694 -13.905
166 HZ3 LYS 20 HZ3 LYS 20 -1.631 -3.348 -14.400
167 H ALA 21 H ALA 21 -0.861 0.668 -6.258
168 HA ALA 21 HA ALA 21 0.982 2.842 -6.658
169 HB1 ALA 21 HB1 ALA 21 -0.609 2.035 -4.192
170 HB2 ALA 21 HB2 ALA 21 0.142 3.617 -4.493
171 HB3 ALA 21 HB3 ALA 21 -1.207 3.066 -5.513
172 H LEU 22 H LEU 22 1.186 -0.265 -4.959
173 HA LEU 22 HA LEU 22 3.352 0.564 -3.217
174 HB2 LEU 22 HB2 LEU 22 2.236 -2.120 -4.121
175 HB3 LEU 22 HB3 LEU 22 3.665 -1.988 -3.093
176 HG LEU 22 HG LEU 22 1.788 -2.414 -1.692
177 HD11 LEU 22 HD11 LEU 22 3.521 -0.731 -0.940
178 HD12 LEU 22 HD12 LEU 22 2.383 0.548 -1.410
179 HD13 LEU 22 HD13 LEU 22 1.939 -0.600 -0.130
180 HD21 LEU 22 HD21 LEU 22 0.008 -1.602 -3.194
181 HD22 LEU 22 HD22 LEU 22 -0.158 -0.953 -1.547
182 HD23 LEU 22 HD23 LEU 22 0.484 0.080 -2.841
183 H LYS 23 H LYS 23 3.115 -1.327 -6.259
184 HA LYS 23 HA LYS 23 5.853 -1.958 -6.385
185 HB2 LYS 23 HB2 LYS 23 3.867 -3.048 -7.521
186 HB3 LYS 23 HB3 LYS 23 3.960 -1.767 -8.747
187 HG2 LYS 23 HG2 LYS 23 6.220 -2.458 -9.354
188 HG3 LYS 23 HG3 LYS 23 6.293 -3.568 -7.963
189 HD2 LYS 23 HD2 LYS 23 4.403 -4.869 -8.908
190 HD3 LYS 23 HD3 LYS 23 4.394 -3.805 -10.335
191 HE2 LYS 23 HE2 LYS 23 6.707 -4.483 -10.874
192 HE3 LYS 23 HE3 LYS 23 6.770 -5.442 -9.382
193 HZ1 LYS 23 HZ1 LYS 23 4.729 -6.571 -10.400
194 HZ2 LYS 23 HZ2 LYS 23 5.288 -5.981 -11.817
195 HZ3 LYS 23 HZ3 LYS 23 6.247 -6.988 -10.927
196 H LYS 24 H LYS 24 4.265 1.058 -7.234
197 HA LYS 24 HA LYS 24 6.186 1.839 -9.246
198 HB2 LYS 24 HB2 LYS 24 4.213 3.376 -7.520
199 HB3 LYS 24 HB3 LYS 24 5.242 4.145 -8.746
200 HG2 LYS 24 HG2 LYS 24 4.269 2.767 -10.509
201 HG3 LYS 24 HG3 LYS 24 3.287 1.884 -9.320
202 HD2 LYS 24 HD2 LYS 24 2.155 3.992 -8.683
203 HD3 LYS 24 HD3 LYS 24 3.149 4.884 -9.856
204 HE2 LYS 24 HE2 LYS 24 2.199 3.537 -11.695
205 HE3 LYS 24 HE3 LYS 24 1.212 2.631 -10.527
206 HZ1 LYS 24 HZ1 LYS 24 0.125 4.672 -9.948
207 HZ2 LYS 24 HZ2 LYS 24 1.056 5.527 -11.004
208 HZ3 LYS 24 HZ3 LYS 24 -0.014 4.408 -11.570
209 H VAL 25 H VAL 25 6.380 1.609 -5.784
210 HA VAL 25 HA VAL 25 8.075 3.897 -5.387
211 HB VAL 25 HB VAL 25 7.472 1.397 -3.787
212 HG11 VAL 25 HG11 VAL 25 8.518 2.537 -1.864
213 HG12 VAL 25 HG12 VAL 25 9.707 2.193 -3.138
214 HG13 VAL 25 HG13 VAL 25 9.070 3.844 -2.934
215 HG21 VAL 25 HG21 VAL 25 6.710 4.286 -3.253
216 HG22 VAL 25 HG22 VAL 25 5.689 3.184 -4.225
217 HG23 VAL 25 HG23 VAL 25 6.037 2.826 -2.520
218 HA PRO 26 HA PRO 26 11.873 2.307 -7.024
219 HB2 PRO 26 HB2 PRO 26 13.008 4.044 -4.839
220 HB3 PRO 26 HB3 PRO 26 13.484 3.966 -6.568
221 HG2 PRO 26 HG2 PRO 26 11.954 6.011 -5.672
222 HG3 PRO 26 HG3 PRO 26 11.550 5.201 -7.226
223 HD2 PRO 26 HD2 PRO 26 10.292 4.780 -4.508
224 HD3 PRO 26 HD3 PRO 26 9.503 4.931 -6.111
225 H GLY 27 H GLY 27 12.942 0.437 -6.532
226 HA2 GLY 27 HA2 GLY 27 14.309 -0.929 -5.209
227 HA3 GLY 27 HA3 GLY 27 13.734 -0.106 -3.748
228 H VAL 28 H VAL 28 10.848 -0.425 -4.833
229 HA VAL 28 HA VAL 28 10.356 -3.042 -3.629
230 HB VAL 28 HB VAL 28 8.561 -0.969 -4.958
231 HG11 VAL 28 HG11 VAL 28 7.600 -3.212 -5.246
232 HG12 VAL 28 HG12 VAL 28 7.827 -3.544 -3.512
233 HG13 VAL 28 HG13 VAL 28 6.681 -2.290 -4.037
234 HG21 VAL 28 HG21 VAL 28 8.964 -1.806 -2.053
235 HG22 VAL 28 HG22 VAL 28 9.530 -0.289 -2.790
236 HG23 VAL 28 HG23 VAL 28 7.788 -0.603 -2.629
237 H GLU 29 H GLU 29 10.173 -4.962 -4.710
238 HA GLU 29 HA GLU 29 9.846 -4.792 -7.665
239 HB2 GLU 29 HB2 GLU 29 12.182 -5.297 -7.057
240 HB3 GLU 29 HB3 GLU 29 11.628 -6.719 -6.138
241 HG2 GLU 29 HG2 GLU 29 10.666 -7.688 -8.185
242 HG3 GLU 29 HG3 GLU 29 11.122 -6.239 -9.103
243 H LYS 30 H LYS 30 8.997 -6.347 -4.616
244 HA LYS 30 HA LYS 30 6.956 -7.897 -6.135
245 HB2 LYS 30 HB2 LYS 30 8.537 -8.760 -3.684
246 HB3 LYS 30 HB3 LYS 30 7.151 -9.639 -4.366
247 HG2 LYS 30 HG2 LYS 30 8.367 -9.874 -6.518
248 HG3 LYS 30 HG3 LYS 30 9.769 -9.039 -5.809
249 HD2 LYS 30 HD2 LYS 30 9.960 -10.813 -4.086
250 HD3 LYS 30 HD3 LYS 30 8.532 -11.620 -4.772
251 HE2 LYS 30 HE2 LYS 30 9.940 -12.762 -6.094
252 HE3 LYS 30 HE3 LYS 30 10.178 -11.250 -6.991
253 HZ1 LYS 30 HZ1 LYS 30 12.015 -10.772 -5.511
254 HZ2 LYS 30 HZ2 LYS 30 11.784 -12.195 -4.712
255 HZ3 LYS 30 HZ3 LYS 30 12.247 -12.204 -6.295
256 H VAL 31 H VAL 31 4.911 -8.079 -5.128
257 HA VAL 31 HA VAL 31 4.452 -6.485 -2.683
258 HB VAL 31 HB VAL 31 3.104 -6.028 -5.371
259 HG11 VAL 31 HG11 VAL 31 2.577 -4.731 -2.667
260 HG12 VAL 31 HG12 VAL 31 1.843 -4.241 -4.213
261 HG13 VAL 31 HG13 VAL 31 1.487 -5.840 -3.534
262 HG21 VAL 31 HG21 VAL 31 4.621 -3.981 -3.731
263 HG22 VAL 31 HG22 VAL 31 5.412 -4.965 -5.005
264 HG23 VAL 31 HG23 VAL 31 4.076 -3.871 -5.403
265 H GLU 32 H GLU 32 2.525 -7.058 -1.610
266 HA GLU 32 HA GLU 32 0.779 -9.092 -2.826
267 HB2 GLU 32 HB2 GLU 32 2.513 -10.390 -1.613
268 HB3 GLU 32 HB3 GLU 32 2.185 -9.443 -0.143
269 HG2 GLU 32 HG2 GLU 32 -0.177 -10.225 -0.190
270 HG3 GLU 32 HG3 GLU 32 0.183 -11.198 -1.629
271 H VAL 33 H VAL 33 -1.311 -8.454 -2.419
272 HA VAL 33 HA VAL 33 -1.741 -6.782 0.004
273 HB VAL 33 HB VAL 33 -3.209 -5.318 -1.282
274 HG11 VAL 33 HG11 VAL 33 -0.781 -4.774 -1.141
275 HG12 VAL 33 HG12 VAL 33 -0.514 -5.650 -2.665
276 HG13 VAL 33 HG13 VAL 33 -1.518 -4.183 -2.648
277 HG21 VAL 33 HG21 VAL 33 -2.342 -6.967 -3.695
278 HG22 VAL 33 HG22 VAL 33 -3.968 -6.958 -2.972
279 HG23 VAL 33 HG23 VAL 33 -3.330 -5.489 -3.738
280 H SER 34 H SER 34 -3.921 -6.790 0.814
281 HA SER 34 HA SER 34 -5.592 -9.038 -0.183
282 HB2 SER 34 HB2 SER 34 -4.342 -9.713 1.860
283 HB3 SER 34 HB3 SER 34 -5.051 -8.336 2.731
284 HG SER 34 HG SER 34 -6.187 -10.342 2.989
285 H LEU 35 H LEU 35 -7.082 -7.799 -1.227
286 HA LEU 35 HA LEU 35 -7.863 -5.201 -0.407
287 HB2 LEU 35 HB2 LEU 35 -9.310 -7.198 -2.187
288 HB3 LEU 35 HB3 LEU 35 -9.604 -5.449 -2.130
289 HG LEU 35 HG LEU 35 -6.969 -6.769 -2.917
290 HD11 LEU 35 HD11 LEU 35 -7.545 -6.001 -5.189
291 HD12 LEU 35 HD12 LEU 35 -8.779 -7.120 -4.566
292 HD13 LEU 35 HD13 LEU 35 -9.097 -5.370 -4.588
293 HD21 LEU 35 HD21 LEU 35 -6.354 -4.478 -3.653
294 HD22 LEU 35 HD22 LEU 35 -7.886 -3.860 -2.993
295 HD23 LEU 35 HD23 LEU 35 -6.651 -4.537 -1.904
296 H GLU 36 H GLU 36 -8.876 -8.323 0.786
297 HA GLU 36 HA GLU 36 -11.513 -7.377 1.593
298 HB2 GLU 36 HB2 GLU 36 -9.915 -9.870 2.283
299 HB3 GLU 36 HB3 GLU 36 -11.600 -9.570 2.774
300 HG2 GLU 36 HG2 GLU 36 -12.233 -9.317 0.378
301 HG3 GLU 36 HG3 GLU 36 -10.565 -9.685 -0.092
302 H LYS 37 H LYS 37 -8.257 -7.553 2.995
303 HA LYS 37 HA LYS 37 -9.369 -6.602 5.580
304 HB2 LYS 37 HB2 LYS 37 -6.604 -7.656 4.867
305 HB3 LYS 37 HB3 LYS 37 -7.067 -6.957 6.430
306 HG2 LYS 37 HG2 LYS 37 -7.515 -9.101 6.973
307 HG3 LYS 37 HG3 LYS 37 -9.069 -8.755 6.192
308 HD2 LYS 37 HD2 LYS 37 -8.206 -9.739 4.082
309 HD3 LYS 37 HD3 LYS 37 -6.626 -10.014 4.860
310 HE2 LYS 37 HE2 LYS 37 -7.742 -11.447 6.565
311 HE3 LYS 37 HE3 LYS 37 -9.288 -11.217 5.724
312 HZ1 LYS 37 HZ1 LYS 37 -8.257 -13.256 5.091
313 HZ2 LYS 37 HZ2 LYS 37 -8.308 -12.245 3.796
314 HZ3 LYS 37 HZ3 LYS 37 -6.885 -12.482 4.597
315 H GLY 38 H GLY 38 -8.093 -5.442 2.646
316 HA2 GLY 38 HA2 GLY 38 -7.564 -3.289 2.029
317 HA3 GLY 38 HA3 GLY 38 -7.974 -2.751 3.672
318 H GLU 39 H GLU 39 -5.636 -5.362 3.262
319 HA GLU 39 HA GLU 39 -3.574 -3.526 4.350
320 HB2 GLU 39 HB2 GLU 39 -3.818 -6.557 4.271
321 HB3 GLU 39 HB3 GLU 39 -2.410 -5.677 4.901
322 HG2 GLU 39 HG2 GLU 39 -3.936 -4.458 6.478
323 HG3 GLU 39 HG3 GLU 39 -5.273 -5.485 5.920
324 H ALA 40 H ALA 40 -1.403 -3.619 3.576
325 HA ALA 40 HA ALA 40 -1.015 -4.786 0.903
326 HB1 ALA 40 HB1 ALA 40 -0.356 -2.740 -0.101
327 HB2 ALA 40 HB2 ALA 40 -1.876 -2.390 0.731
328 HB3 ALA 40 HB3 ALA 40 -0.340 -1.880 1.469
329 H LEU 41 H LEU 41 0.653 -6.076 1.217
330 HA LEU 41 HA LEU 41 2.891 -5.234 2.979
331 HB2 LEU 41 HB2 LEU 41 2.245 -7.926 1.688
332 HB3 LEU 41 HB3 LEU 41 3.564 -7.592 2.810
333 HG LEU 41 HG LEU 41 1.923 -8.667 4.090
334 HD11 LEU 41 HD11 LEU 41 2.854 -6.650 5.179
335 HD12 LEU 41 HD12 LEU 41 1.495 -5.687 4.545
336 HD13 LEU 41 HD13 LEU 41 1.190 -6.991 5.711
337 HD21 LEU 41 HD21 LEU 41 -0.424 -8.114 4.162
338 HD22 LEU 41 HD22 LEU 41 -0.195 -6.738 3.071
339 HD23 LEU 41 HD23 LEU 41 0.045 -8.398 2.471
340 H VAL 42 H VAL 42 5.062 -5.351 2.145
341 HA VAL 42 HA VAL 42 5.297 -5.780 -0.774
342 HB VAL 42 HB VAL 42 6.837 -3.839 -0.913
343 HG11 VAL 42 HG11 VAL 42 5.121 -2.241 -1.220
344 HG12 VAL 42 HG12 VAL 42 4.341 -3.808 -1.470
345 HG13 VAL 42 HG13 VAL 42 4.106 -2.952 0.072
346 HG21 VAL 42 HG21 VAL 42 5.722 -3.136 1.838
347 HG22 VAL 42 HG22 VAL 42 7.392 -3.644 1.501
348 HG23 VAL 42 HG23 VAL 42 6.779 -2.113 0.838
349 H GLU 43 H GLU 43 7.599 -6.189 -1.413
350 HA GLU 43 HA GLU 43 9.284 -7.010 0.875
351 HB2 GLU 43 HB2 GLU 43 7.953 -8.973 0.075
352 HB3 GLU 43 HB3 GLU 43 8.725 -8.804 -1.515
353 HG2 GLU 43 HG2 GLU 43 10.934 -9.140 -0.515
354 HG3 GLU 43 HG3 GLU 43 10.230 -9.160 1.113
355 H GLY 44 H GLY 44 10.358 -5.031 0.356
356 HA2 GLY 44 HA2 GLY 44 12.306 -5.327 -1.831
357 HA3 GLY 44 HA3 GLY 44 11.266 -3.885 -1.840
358 H THR 45 H THR 45 13.603 -2.984 -1.664
359 HA THR 45 HA THR 45 14.361 -2.784 1.209
360 HB THR 45 HB THR 45 16.642 -2.271 0.320
361 HG1 THR 45 HG1 THR 45 17.003 -2.711 -1.866
362 HG21 THR 45 HG21 THR 45 15.442 -4.912 -0.621
363 HG22 THR 45 HG22 THR 45 17.168 -4.588 -0.336
364 HG23 THR 45 HG23 THR 45 16.022 -4.562 1.024
365 H ALA 46 H ALA 46 12.310 -1.200 -0.286
366 HA ALA 46 HA ALA 46 13.485 1.371 -0.877
367 HB1 ALA 46 HB1 ALA 46 11.132 2.066 -1.091
368 HB2 ALA 46 HB2 ALA 46 11.424 0.528 -1.936
369 HB3 ALA 46 HB3 ALA 46 10.609 0.525 -0.359
370 H ASP 47 H ASP 47 12.533 3.392 0.297
371 HA ASP 47 HA ASP 47 13.197 3.146 3.110
372 HB2 ASP 47 HB2 ASP 47 13.782 5.078 1.569
373 HB3 ASP 47 HB3 ASP 47 12.078 5.568 1.662
374 HA PRO 48 HA PRO 48 9.188 2.411 4.756
375 HB2 PRO 48 HB2 PRO 48 10.160 4.344 6.867
376 HB3 PRO 48 HB3 PRO 48 9.321 2.773 7.094
377 HG2 PRO 48 HG2 PRO 48 11.998 2.908 7.404
378 HG3 PRO 48 HG3 PRO 48 11.287 1.561 6.447
379 HD2 PRO 48 HD2 PRO 48 12.579 4.101 5.440
380 HD3 PRO 48 HD3 PRO 48 12.761 2.422 4.840
381 H LYS 49 H LYS 49 10.366 5.827 4.630
382 HA LYS 49 HA LYS 49 7.718 6.932 5.000
383 HB2 LYS 49 HB2 LYS 49 10.198 8.176 3.743
384 HB3 LYS 49 HB3 LYS 49 8.772 9.040 4.339
385 HG2 LYS 49 HG2 LYS 49 9.253 8.231 6.631
386 HG3 LYS 49 HG3 LYS 49 10.729 7.424 6.040
387 HD2 LYS 49 HD2 LYS 49 10.450 10.247 5.167
388 HD3 LYS 49 HD3 LYS 49 10.572 10.054 6.929
389 HE2 LYS 49 HE2 LYS 49 12.641 8.822 6.738
390 HE3 LYS 49 HE3 LYS 49 12.494 8.757 4.969
391 HZ1 LYS 49 HZ1 LYS 49 12.693 11.127 4.911
392 HZ2 LYS 49 HZ2 LYS 49 12.826 11.210 6.551
393 HZ3 LYS 49 HZ3 LYS 49 14.000 10.466 5.666
394 H ALA 50 H ALA 50 9.750 6.026 2.214
395 HA ALA 50 HA ALA 50 8.299 7.443 0.245
396 HB1 ALA 50 HB1 ALA 50 10.559 6.510 -0.087
397 HB2 ALA 50 HB2 ALA 50 9.898 4.860 0.016
398 HB3 ALA 50 HB3 ALA 50 9.433 5.922 -1.333
399 H LEU 51 H LEU 51 7.765 4.243 1.744
400 HA LEU 51 HA LEU 51 5.951 3.326 -0.239
401 HB2 LEU 51 HB2 LEU 51 7.179 2.044 1.691
402 HB3 LEU 51 HB3 LEU 51 5.790 2.541 2.674
403 HG LEU 51 HG LEU 51 4.313 1.551 0.811
404 HD11 LEU 51 HD11 LEU 51 5.448 -0.176 -0.597
405 HD12 LEU 51 HD12 LEU 51 6.061 1.452 -0.947
406 HD13 LEU 51 HD13 LEU 51 7.017 0.340 0.057
407 HD21 LEU 51 HD21 LEU 51 4.839 0.442 3.016
408 HD22 LEU 51 HD22 LEU 51 4.516 -0.703 1.689
409 HD23 LEU 51 HD23 LEU 51 6.185 -0.392 2.216
410 H VAL 52 H VAL 52 5.373 4.851 2.987
411 HA VAL 52 HA VAL 52 2.535 4.821 2.724
412 HB VAL 52 HB VAL 52 4.268 6.687 4.394
413 HG11 VAL 52 HG11 VAL 52 1.435 5.619 4.762
414 HG12 VAL 52 HG12 VAL 52 2.309 6.663 5.907
415 HG13 VAL 52 HG13 VAL 52 1.866 7.283 4.302
416 HG21 VAL 52 HG21 VAL 52 4.035 4.965 6.167
417 HG22 VAL 52 HG22 VAL 52 3.249 3.880 4.995
418 HG23 VAL 52 HG23 VAL 52 4.949 4.367 4.768
419 H GLN 53 H GLN 53 5.057 7.109 1.682
420 HA GLN 53 HA GLN 53 3.202 9.273 1.263
421 HB2 GLN 53 HB2 GLN 53 5.670 9.474 1.698
422 HB3 GLN 53 HB3 GLN 53 5.966 8.843 0.063
423 HG2 GLN 53 HG2 GLN 53 4.667 10.740 -0.882
424 HG3 GLN 53 HG3 GLN 53 4.357 11.339 0.756
425 HE21 GLN 53 HE21 GLN 53 7.190 13.370 -0.383
426 HE22 GLN 53 HE22 GLN 53 5.469 13.221 -0.661
427 H ALA 54 H ALA 54 4.481 6.598 -0.727
428 HA ALA 54 HA ALA 54 3.648 7.618 -3.242
429 HB1 ALA 54 HB1 ALA 54 3.477 4.704 -2.971
430 HB2 ALA 54 HB2 ALA 54 4.503 5.693 -4.016
431 HB3 ALA 54 HB3 ALA 54 5.008 5.378 -2.340
432 H VAL 55 H VAL 55 1.998 5.429 -0.886
433 HA VAL 55 HA VAL 55 -0.360 5.213 -2.541
434 HB VAL 55 HB VAL 55 -1.339 4.173 -0.527
435 HG11 VAL 55 HG11 VAL 55 1.352 2.924 -0.593
436 HG12 VAL 55 HG12 VAL 55 -0.239 2.227 -0.898
437 HG13 VAL 55 HG13 VAL 55 0.560 3.159 -2.184
438 HG21 VAL 55 HG21 VAL 55 -0.222 5.561 1.204
439 HG22 VAL 55 HG22 VAL 55 0.032 3.826 1.488
440 HG23 VAL 55 HG23 VAL 55 1.336 4.811 0.788
441 H GLU 56 H GLU 56 0.813 7.526 -0.141
442 HA GLU 56 HA GLU 56 -1.777 8.611 0.466
443 HB2 GLU 56 HB2 GLU 56 0.245 8.857 1.889
444 HB3 GLU 56 HB3 GLU 56 0.991 9.873 0.637
445 HG2 GLU 56 HG2 GLU 56 -0.840 11.514 0.878
446 HG3 GLU 56 HG3 GLU 56 -1.618 10.478 2.092
447 H GLU 57 H GLU 57 0.537 9.009 -2.168
448 HA GLU 57 HA GLU 57 -0.508 11.512 -3.161
449 HB2 GLU 57 HB2 GLU 57 1.385 9.378 -3.994
450 HB3 GLU 57 HB3 GLU 57 0.515 10.152 -5.334
451 HG2 GLU 57 HG2 GLU 57 1.191 12.385 -4.456
452 HG3 GLU 57 HG3 GLU 57 2.165 11.572 -3.213
453 H GLU 58 H GLU 58 -1.465 8.129 -3.343
454 HA GLU 58 HA GLU 58 -3.253 8.591 -5.630
455 HB2 GLU 58 HB2 GLU 58 -2.673 6.187 -3.864
456 HB3 GLU 58 HB3 GLU 58 -3.779 6.163 -5.257
457 HG2 GLU 58 HG2 GLU 58 -0.833 6.936 -5.416
458 HG3 GLU 58 HG3 GLU 58 -1.477 5.331 -5.784
459 H GLY 59 H GLY 59 -3.356 9.225 -2.325
460 HA2 GLY 59 HA2 GLY 59 -5.256 10.137 -1.262
461 HA3 GLY 59 HA3 GLY 59 -6.309 9.289 -2.411
462 H TYR 60 H TYR 60 -3.899 7.151 -1.373
463 HA TYR 60 HA TYR 60 -5.815 5.950 0.557
464 HB2 TYR 60 HB2 TYR 60 -3.635 4.739 -1.175
465 HB3 TYR 60 HB3 TYR 60 -4.565 3.847 0.031
466 HD1 TYR 60 HD1 TYR 60 -4.440 4.910 -3.378
467 HD2 TYR 60 HD2 TYR 60 -7.135 3.829 -0.210
468 HE1 TYR 60 HE1 TYR 60 -6.207 4.441 -5.052
469 HE2 TYR 60 HE2 TYR 60 -8.912 3.364 -1.868
470 HH TYR 60 HH TYR 60 -9.487 3.348 -4.086
471 H LYS 61 H LYS 61 -5.111 7.062 2.453
472 HA LYS 61 HA LYS 61 -2.317 6.897 3.277
473 HB2 LYS 61 HB2 LYS 61 -4.903 7.467 4.794
474 HB3 LYS 61 HB3 LYS 61 -3.273 7.577 5.500
475 HG2 LYS 61 HG2 LYS 61 -2.637 9.252 3.796
476 HG3 LYS 61 HG3 LYS 61 -4.260 9.147 3.081
477 HD2 LYS 61 HD2 LYS 61 -5.254 9.951 5.192
478 HD3 LYS 61 HD3 LYS 61 -3.635 10.050 5.926
479 HE2 LYS 61 HE2 LYS 61 -2.946 11.700 4.241
480 HE3 LYS 61 HE3 LYS 61 -4.510 11.543 3.417
481 HZ1 LYS 61 HZ1 LYS 61 -4.461 13.460 4.817
482 HZ2 LYS 61 HZ2 LYS 61 -5.568 12.383 5.381
483 HZ3 LYS 61 HZ3 LYS 61 -4.116 12.549 6.149
484 H ALA 62 H ALA 62 -1.569 5.491 5.046
485 HA ALA 62 HA ALA 62 -3.196 3.203 5.791
486 HB1 ALA 62 HB1 ALA 62 -2.548 2.584 3.489
487 HB2 ALA 62 HB2 ALA 62 -0.837 2.840 3.896
488 HB3 ALA 62 HB3 ALA 62 -1.755 1.532 4.683
489 H GLU 63 H GLU 63 -2.671 3.135 7.911
490 HA GLU 63 HA GLU 63 -0.099 3.966 8.921
491 HB2 GLU 63 HB2 GLU 63 -2.306 4.157 10.104
492 HB3 GLU 63 HB3 GLU 63 -2.339 2.385 10.243
493 HG2 GLU 63 HG2 GLU 63 -0.096 2.549 11.436
494 HG3 GLU 63 HG3 GLU 63 -0.295 4.314 11.418
495 H VAL 64 H VAL 64 1.754 2.715 8.984
496 HA VAL 64 HA VAL 64 1.799 -0.027 8.277
497 HB VAL 64 HB VAL 64 4.094 0.040 9.287
498 HG11 VAL 64 HG11 VAL 64 3.236 2.303 7.443
499 HG12 VAL 64 HG12 VAL 64 4.940 1.881 7.766
500 HG13 VAL 64 HG13 VAL 64 3.857 0.706 6.988
501 HG21 VAL 64 HG21 VAL 64 3.310 2.904 9.988
502 HG22 VAL 64 HG22 VAL 64 3.634 1.597 11.151
503 HG23 VAL 64 HG23 VAL 64 4.941 2.209 10.118
504 H LEU 65 H LEU 65 1.525 -1.878 9.458
505 HA LEU 65 HA LEU 65 0.621 -1.549 12.253
506 HB2 LEU 65 HB2 LEU 65 0.573 -3.925 10.352
507 HB3 LEU 65 HB3 LEU 65 -0.118 -3.904 11.986
508 HG LEU 65 HG LEU 65 -0.978 -2.124 9.663
509 HD11 LEU 65 HD11 LEU 65 -2.315 -4.496 11.032
510 HD12 LEU 65 HD12 LEU 65 -3.044 -3.492 9.757
511 HD13 LEU 65 HD13 LEU 65 -1.618 -4.492 9.394
512 HD21 LEU 65 HD21 LEU 65 -2.845 -1.496 11.173
513 HD22 LEU 65 HD22 LEU 65 -2.102 -2.450 12.478
514 HD23 LEU 65 HD23 LEU 65 -1.276 -1.005 11.843
515 H ALA 66 H ALA 66 2.874 -1.000 12.909
516 HA ALA 66 HA ALA 66 4.351 -3.483 13.538
517 HB1 ALA 66 HB1 ALA 66 5.413 -2.604 11.500
518 HB2 ALA 66 HB2 ALA 66 5.595 -1.009 12.268
519 HB3 ALA 66 HB3 ALA 66 6.488 -2.411 12.905
Start of MODEL 8
1 H1 MET 1 H MET 1 8.532 -2.907 10.800
2 HA MET 1 HA MET 1 9.506 -3.376 8.044
3 HB2 MET 1 HB2 MET 1 9.282 -5.409 9.523
4 HB3 MET 1 HB3 MET 1 7.539 -5.080 9.612
5 HG2 MET 1 HG2 MET 1 7.368 -5.276 7.167
6 HG3 MET 1 HG3 MET 1 9.122 -5.487 7.051
7 HE1 MET 1 HE1 MET 1 7.325 -8.685 5.897
8 HE2 MET 1 HE2 MET 1 7.872 -7.054 5.482
9 HE3 MET 1 HE3 MET 1 9.075 -8.318 5.830
10 H LEU 2 H LEU 2 7.856 -3.234 6.347
11 HA LEU 2 HA LEU 2 5.826 -1.215 7.074
12 HB2 LEU 2 HB2 LEU 2 6.699 -2.341 4.380
13 HB3 LEU 2 HB3 LEU 2 5.617 -0.953 4.628
14 HG LEU 2 HG LEU 2 8.505 -1.130 5.605
15 HD11 LEU 2 HD11 LEU 2 8.286 -0.987 3.123
16 HD12 LEU 2 HD12 LEU 2 7.323 0.499 3.326
17 HD13 LEU 2 HD13 LEU 2 9.024 0.463 3.837
18 HD21 LEU 2 HD21 LEU 2 7.081 0.322 7.011
19 HD22 LEU 2 HD22 LEU 2 8.215 1.291 6.051
20 HD23 LEU 2 HD23 LEU 2 6.510 1.177 5.557
21 H LYS 3 H LYS 3 3.631 -1.554 6.968
22 HA LYS 3 HA LYS 3 2.560 -4.095 5.980
23 HB2 LYS 3 HB2 LYS 3 3.589 -4.468 8.278
24 HB3 LYS 3 HB3 LYS 3 2.363 -3.375 8.938
25 HG2 LYS 3 HG2 LYS 3 0.584 -4.886 8.264
26 HG3 LYS 3 HG3 LYS 3 1.718 -5.839 7.272
27 HD2 LYS 3 HD2 LYS 3 3.022 -6.394 9.317
28 HD3 LYS 3 HD3 LYS 3 1.801 -5.566 10.307
29 HE2 LYS 3 HE2 LYS 3 0.082 -7.126 9.552
30 HE3 LYS 3 HE3 LYS 3 1.218 -7.880 8.414
31 HZ1 LYS 3 HZ1 LYS 3 2.536 -8.582 10.261
32 HZ2 LYS 3 HZ2 LYS 3 1.509 -7.867 11.336
33 HZ3 LYS 3 HZ3 LYS 3 0.995 -9.143 10.430
34 H LEU 4 H LEU 4 1.472 -2.515 4.584
35 HA LEU 4 HA LEU 4 0.277 -0.172 5.842
36 HB2 LEU 4 HB2 LEU 4 0.768 -1.231 3.076
37 HB3 LEU 4 HB3 LEU 4 -0.546 -0.060 3.290
38 HG LEU 4 HG LEU 4 1.026 1.492 4.437
39 HD11 LEU 4 HD11 LEU 4 3.112 -0.551 3.561
40 HD12 LEU 4 HD12 LEU 4 3.458 1.059 4.240
41 HD13 LEU 4 HD13 LEU 4 2.662 -0.175 5.240
42 HD21 LEU 4 HD21 LEU 4 0.567 1.661 2.002
43 HD22 LEU 4 HD22 LEU 4 2.231 2.156 2.387
44 HD23 LEU 4 HD23 LEU 4 1.919 0.554 1.676
45 H LYS 5 H LYS 5 -1.616 -0.300 6.883
46 HA LYS 5 HA LYS 5 -3.737 -2.054 5.783
47 HB2 LYS 5 HB2 LYS 5 -3.084 -2.163 8.212
48 HB3 LYS 5 HB3 LYS 5 -3.704 -0.514 8.418
49 HG2 LYS 5 HG2 LYS 5 -5.514 -2.490 7.057
50 HG3 LYS 5 HG3 LYS 5 -5.179 -2.771 8.776
51 HD2 LYS 5 HD2 LYS 5 -5.875 -0.459 9.312
52 HD3 LYS 5 HD3 LYS 5 -6.298 -0.201 7.601
53 HE2 LYS 5 HE2 LYS 5 -7.903 -2.075 7.713
54 HE3 LYS 5 HE3 LYS 5 -7.466 -2.357 9.409
55 HZ1 LYS 5 HZ1 LYS 5 -8.694 0.087 8.337
56 HZ2 LYS 5 HZ2 LYS 5 -9.454 -1.073 9.224
57 HZ3 LYS 5 HZ3 LYS 5 -8.269 -0.159 9.912
58 H VAL 6 H VAL 6 -4.343 -0.857 3.988
59 HA VAL 6 HA VAL 6 -4.559 1.976 3.942
60 HB VAL 6 HB VAL 6 -5.850 -0.108 2.136
61 HG11 VAL 6 HG11 VAL 6 -5.052 2.803 1.695
62 HG12 VAL 6 HG12 VAL 6 -5.692 1.709 0.447
63 HG13 VAL 6 HG13 VAL 6 -6.716 2.182 1.817
64 HG21 VAL 6 HG21 VAL 6 -3.832 0.134 0.753
65 HG22 VAL 6 HG22 VAL 6 -3.128 1.250 1.937
66 HG23 VAL 6 HG23 VAL 6 -3.396 -0.456 2.371
67 H GLU 7 H GLU 7 -6.165 3.345 4.401
68 HA GLU 7 HA GLU 7 -8.778 2.281 5.295
69 HB2 GLU 7 HB2 GLU 7 -7.624 3.978 6.684
70 HB3 GLU 7 HB3 GLU 7 -7.628 5.103 5.314
71 HG2 GLU 7 HG2 GLU 7 -9.474 5.581 6.883
72 HG3 GLU 7 HG3 GLU 7 -10.090 5.101 5.295
73 H GLY 8 H GLY 8 -10.739 2.899 4.238
74 HA2 GLY 8 HA2 GLY 8 -10.372 3.513 1.378
75 HA3 GLY 8 HA3 GLY 8 -11.847 2.921 2.173
76 H MET 9 H MET 9 -9.722 5.790 1.800
77 HA MET 9 HA MET 9 -11.551 7.592 3.098
78 HB2 MET 9 HB2 MET 9 -9.275 8.114 1.158
79 HB3 MET 9 HB3 MET 9 -10.050 9.340 2.178
80 HG2 MET 9 HG2 MET 9 -8.995 6.882 3.537
81 HG3 MET 9 HG3 MET 9 -7.813 8.012 2.871
82 HE1 MET 9 HE1 MET 9 -6.711 8.347 5.173
83 HE2 MET 9 HE2 MET 9 -7.598 8.777 6.652
84 HE3 MET 9 HE3 MET 9 -7.879 7.201 5.875
85 H THR 10 H THR 10 -11.016 6.587 -0.307
86 HA THR 10 HA THR 10 -13.451 8.135 -1.016
87 HB THR 10 HB THR 10 -12.363 8.824 -3.108
88 HG1 THR 10 HG1 THR 10 -10.157 8.460 -3.353
89 HG21 THR 10 HG21 THR 10 -12.253 10.302 -1.110
90 HG22 THR 10 HG22 THR 10 -10.706 9.548 -0.655
91 HG23 THR 10 HG23 THR 10 -10.830 10.487 -2.160
92 H CYS 11 H CYS 11 -14.271 7.489 -3.239
93 HA CYS 11 HA CYS 11 -15.303 5.858 -4.439
94 HB2 CYS 11 HB2 CYS 11 -12.478 4.732 -4.444
95 HB3 CYS 11 HB3 CYS 11 -13.769 4.314 -5.594
96 HG CYS 11 HG CYS 11 -14.184 6.757 -6.422
97 H ASN 12 H ASN 12 -15.524 5.511 -1.586
98 HA ASN 12 HA ASN 12 -14.963 2.842 -0.788
99 HB2 ASN 12 HB2 ASN 12 -16.427 3.336 1.082
100 HB3 ASN 12 HB3 ASN 12 -15.430 4.760 0.736
101 HD21 ASN 12 HD21 ASN 12 -19.435 5.097 0.793
102 HD22 ASN 12 HD22 ASN 12 -18.527 3.756 1.458
103 H HIS 13 H HIS 13 -17.158 3.936 -3.127
104 HA HIS 13 HA HIS 13 -19.212 1.908 -2.590
105 HB2 HIS 13 HB2 HIS 13 -18.749 3.828 -4.903
106 HB3 HIS 13 HB3 HIS 13 -20.142 2.744 -4.741
107 HD1 HIS 13 HD1 HIS 13 -18.738 5.986 -3.257
108 HD2 HIS 13 HD2 HIS 13 -21.984 3.330 -2.863
109 HE1 HIS 13 HE1 HIS 13 -20.467 7.153 -1.789
110 H CYS 14 H CYS 14 -16.084 1.937 -3.828
111 HA CYS 14 HA CYS 14 -16.608 -0.536 -5.387
112 HB2 CYS 14 HB2 CYS 14 -14.704 1.729 -6.112
113 HB3 CYS 14 HB3 CYS 14 -14.829 0.172 -6.960
114 HG CYS 14 HG CYS 14 -15.992 2.012 -8.370
115 H VAL 15 H VAL 15 -14.169 -1.417 -5.877
116 HA VAL 15 HA VAL 15 -13.050 -1.994 -3.234
117 HB VAL 15 HB VAL 15 -13.440 -3.748 -4.958
118 HG11 VAL 15 HG11 VAL 15 -11.974 -3.854 -6.934
119 HG12 VAL 15 HG12 VAL 15 -12.964 -2.378 -6.962
120 HG13 VAL 15 HG13 VAL 15 -11.248 -2.292 -6.496
121 HG21 VAL 15 HG21 VAL 15 -11.267 -4.845 -4.766
122 HG22 VAL 15 HG22 VAL 15 -10.493 -3.301 -4.350
123 HG23 VAL 15 HG23 VAL 15 -11.677 -4.032 -3.238
124 H MET 16 H MET 16 -10.621 -1.754 -2.892
125 HA MET 16 HA MET 16 -9.798 0.857 -4.048
126 HB2 MET 16 HB2 MET 16 -8.697 -0.770 -1.716
127 HB3 MET 16 HB3 MET 16 -8.173 0.858 -2.189
128 HG2 MET 16 HG2 MET 16 -10.470 1.694 -1.783
129 HG3 MET 16 HG3 MET 16 -10.958 0.079 -1.251
130 HE1 MET 16 HE1 MET 16 -8.855 -0.412 2.020
131 HE2 MET 16 HE2 MET 16 -10.056 -1.118 0.914
132 HE3 MET 16 HE3 MET 16 -8.374 -0.888 0.375
133 H ALA 17 H ALA 17 -8.428 0.808 -5.735
134 HA ALA 17 HA ALA 17 -6.765 -1.588 -6.184
135 HB1 ALA 17 HB1 ALA 17 -8.036 -0.643 -8.076
136 HB2 ALA 17 HB2 ALA 17 -7.249 0.933 -7.832
137 HB3 ALA 17 HB3 ALA 17 -6.288 -0.468 -8.357
138 H VAL 18 H VAL 18 -5.267 -1.320 -4.420
139 HA VAL 18 HA VAL 18 -3.671 1.168 -4.475
140 HB VAL 18 HB VAL 18 -3.662 -1.089 -2.442
141 HG11 VAL 18 HG11 VAL 18 -2.742 1.819 -2.331
142 HG12 VAL 18 HG12 VAL 18 -2.726 0.678 -0.967
143 HG13 VAL 18 HG13 VAL 18 -1.681 0.392 -2.371
144 HG21 VAL 18 HG21 VAL 18 -5.227 1.528 -2.460
145 HG22 VAL 18 HG22 VAL 18 -5.922 -0.103 -2.626
146 HG23 VAL 18 HG23 VAL 18 -5.139 0.375 -1.107
147 H THR 19 H THR 19 -3.533 -2.078 -5.612
148 HA THR 19 HA THR 19 -0.996 -2.919 -5.095
149 HB THR 19 HB THR 19 -2.408 -3.168 -7.774
150 HG1 THR 19 HG1 THR 19 -3.274 -5.050 -6.741
151 HG21 THR 19 HG21 THR 19 -1.239 -5.350 -7.849
152 HG22 THR 19 HG22 THR 19 -0.078 -4.007 -7.751
153 HG23 THR 19 HG23 THR 19 -0.442 -4.977 -6.303
154 H LYS 20 H LYS 20 -1.880 -0.687 -7.817
155 HA LYS 20 HA LYS 20 0.771 -0.669 -8.873
156 HB2 LYS 20 HB2 LYS 20 -1.478 1.359 -9.147
157 HB3 LYS 20 HB3 LYS 20 -0.021 1.294 -10.157
158 HG2 LYS 20 HG2 LYS 20 -1.222 -1.335 -10.075
159 HG3 LYS 20 HG3 LYS 20 -2.466 -0.139 -10.500
160 HD2 LYS 20 HD2 LYS 20 -1.012 0.748 -12.292
161 HD3 LYS 20 HD3 LYS 20 0.242 -0.442 -11.863
162 HE2 LYS 20 HE2 LYS 20 -1.364 -2.278 -12.329
163 HE3 LYS 20 HE3 LYS 20 -2.590 -1.081 -12.791
164 HZ1 LYS 20 HZ1 LYS 20 -1.125 -0.359 -14.540
165 HZ2 LYS 20 HZ2 LYS 20 0.002 -1.486 -14.113
166 HZ3 LYS 20 HZ3 LYS 20 -1.470 -1.964 -14.689
167 H ALA 21 H ALA 21 -0.672 1.060 -6.158
168 HA ALA 21 HA ALA 21 1.142 3.287 -6.263
169 HB1 ALA 21 HB1 ALA 21 -0.428 2.141 -3.917
170 HB2 ALA 21 HB2 ALA 21 0.285 3.768 -4.021
171 HB3 ALA 21 HB3 ALA 21 -1.054 3.314 -5.100
172 H LEU 22 H LEU 22 1.362 -0.002 -4.986
173 HA LEU 22 HA LEU 22 3.623 0.615 -3.229
174 HB2 LEU 22 HB2 LEU 22 2.304 -1.937 -4.253
175 HB3 LEU 22 HB3 LEU 22 3.767 -1.949 -3.266
176 HG LEU 22 HG LEU 22 1.894 -2.371 -1.849
177 HD11 LEU 22 HD11 LEU 22 3.759 -0.888 -1.020
178 HD12 LEU 22 HD12 LEU 22 2.716 0.507 -1.361
179 HD13 LEU 22 HD13 LEU 22 2.212 -0.699 -0.158
180 HD21 LEU 22 HD21 LEU 22 0.138 -1.316 -3.229
181 HD22 LEU 22 HD22 LEU 22 0.057 -0.804 -1.528
182 HD23 LEU 22 HD23 LEU 22 0.737 0.293 -2.748
183 H LYS 23 H LYS 23 3.029 -0.785 -6.453
184 HA LYS 23 HA LYS 23 5.626 -1.788 -6.879
185 HB2 LYS 23 HB2 LYS 23 3.437 -2.363 -8.019
186 HB3 LYS 23 HB3 LYS 23 3.640 -0.894 -8.997
187 HG2 LYS 23 HG2 LYS 23 5.783 -1.761 -9.862
188 HG3 LYS 23 HG3 LYS 23 5.651 -3.183 -8.799
189 HD2 LYS 23 HD2 LYS 23 3.532 -3.816 -9.927
190 HD3 LYS 23 HD3 LYS 23 3.704 -2.422 -11.020
191 HE2 LYS 23 HE2 LYS 23 5.858 -3.342 -11.848
192 HE3 LYS 23 HE3 LYS 23 5.694 -4.698 -10.714
193 HZ1 LYS 23 HZ1 LYS 23 3.467 -5.004 -11.915
194 HZ2 LYS 23 HZ2 LYS 23 4.169 -4.147 -13.118
195 HZ3 LYS 23 HZ3 LYS 23 4.866 -5.555 -12.626
196 H LYS 24 H LYS 24 4.402 1.523 -7.275
197 HA LYS 24 HA LYS 24 6.498 2.204 -9.182
198 HB2 LYS 24 HB2 LYS 24 4.486 3.867 -7.622
199 HB3 LYS 24 HB3 LYS 24 5.635 4.533 -8.807
200 HG2 LYS 24 HG2 LYS 24 4.724 3.023 -10.546
201 HG3 LYS 24 HG3 LYS 24 3.538 2.396 -9.380
202 HD2 LYS 24 HD2 LYS 24 2.607 4.675 -9.104
203 HD3 LYS 24 HD3 LYS 24 3.809 5.303 -10.258
204 HE2 LYS 24 HE2 LYS 24 2.905 3.790 -12.004
205 HE3 LYS 24 HE3 LYS 24 1.683 3.205 -10.858
206 HZ1 LYS 24 HZ1 LYS 24 0.840 5.437 -10.721
207 HZ2 LYS 24 HZ2 LYS 24 1.975 5.981 -11.782
208 HZ3 LYS 24 HZ3 LYS 24 0.826 4.918 -12.287
209 H VAL 25 H VAL 25 6.430 1.857 -5.736
210 HA VAL 25 HA VAL 25 8.263 4.030 -5.197
211 HB VAL 25 HB VAL 25 7.338 1.598 -3.647
212 HG11 VAL 25 HG11 VAL 25 8.387 2.646 -1.661
213 HG12 VAL 25 HG12 VAL 25 9.601 2.188 -2.874
214 HG13 VAL 25 HG13 VAL 25 9.111 3.891 -2.705
215 HG21 VAL 25 HG21 VAL 25 6.823 4.553 -3.163
216 HG22 VAL 25 HG22 VAL 25 5.769 3.550 -4.203
217 HG23 VAL 25 HG23 VAL 25 5.961 3.171 -2.480
218 HA PRO 26 HA PRO 26 11.897 2.065 -6.811
219 HB2 PRO 26 HB2 PRO 26 13.172 3.837 -4.731
220 HB3 PRO 26 HB3 PRO 26 13.631 3.625 -6.454
221 HG2 PRO 26 HG2 PRO 26 12.262 5.826 -5.678
222 HG3 PRO 26 HG3 PRO 26 11.790 4.959 -7.180
223 HD2 PRO 26 HD2 PRO 26 10.520 4.794 -4.440
224 HD3 PRO 26 HD3 PRO 26 9.736 4.908 -6.049
225 H GLY 27 H GLY 27 13.093 0.266 -6.189
226 HA2 GLY 27 HA2 GLY 27 14.332 -1.058 -4.704
227 HA3 GLY 27 HA3 GLY 27 13.612 -0.204 -3.328
228 H VAL 28 H VAL 28 10.861 -0.598 -4.777
229 HA VAL 28 HA VAL 28 10.222 -3.092 -3.414
230 HB VAL 28 HB VAL 28 8.627 -1.184 -5.170
231 HG11 VAL 28 HG11 VAL 28 7.704 -3.453 -5.373
232 HG12 VAL 28 HG12 VAL 28 7.697 -3.622 -3.601
233 HG13 VAL 28 HG13 VAL 28 6.635 -2.432 -4.388
234 HG21 VAL 28 HG21 VAL 28 8.632 -1.746 -2.172
235 HG22 VAL 28 HG22 VAL 28 9.302 -0.300 -2.963
236 HG23 VAL 28 HG23 VAL 28 7.551 -0.608 -3.009
237 H GLU 29 H GLU 29 10.119 -5.103 -4.314
238 HA GLU 29 HA GLU 29 10.320 -5.263 -7.285
239 HB2 GLU 29 HB2 GLU 29 12.442 -5.861 -6.281
240 HB3 GLU 29 HB3 GLU 29 11.646 -6.989 -5.168
241 HG2 GLU 29 HG2 GLU 29 10.909 -8.381 -7.051
242 HG3 GLU 29 HG3 GLU 29 11.579 -7.210 -8.209
243 H LYS 30 H LYS 30 8.864 -6.469 -4.279
244 HA LYS 30 HA LYS 30 6.902 -7.915 -5.982
245 HB2 LYS 30 HB2 LYS 30 8.064 -8.905 -3.352
246 HB3 LYS 30 HB3 LYS 30 6.775 -9.689 -4.288
247 HG2 LYS 30 HG2 LYS 30 8.354 -9.939 -6.206
248 HG3 LYS 30 HG3 LYS 30 9.644 -9.230 -5.205
249 HD2 LYS 30 HD2 LYS 30 9.270 -11.056 -3.518
250 HD3 LYS 30 HD3 LYS 30 8.080 -11.777 -4.623
251 HE2 LYS 30 HE2 LYS 30 9.779 -12.888 -5.586
252 HE3 LYS 30 HE3 LYS 30 10.335 -11.331 -6.231
253 HZ1 LYS 30 HZ1 LYS 30 11.624 -11.063 -4.215
254 HZ2 LYS 30 HZ2 LYS 30 11.119 -12.530 -3.662
255 HZ3 LYS 30 HZ3 LYS 30 12.057 -12.438 -5.017
256 H VAL 31 H VAL 31 4.765 -7.999 -5.101
257 HA VAL 31 HA VAL 31 4.250 -6.335 -2.713
258 HB VAL 31 HB VAL 31 2.979 -5.916 -5.445
259 HG11 VAL 31 HG11 VAL 31 2.470 -4.519 -2.787
260 HG12 VAL 31 HG12 VAL 31 1.769 -4.051 -4.355
261 HG13 VAL 31 HG13 VAL 31 1.349 -5.615 -3.630
262 HG21 VAL 31 HG21 VAL 31 4.550 -3.878 -3.847
263 HG22 VAL 31 HG22 VAL 31 5.324 -4.935 -5.071
264 HG23 VAL 31 HG23 VAL 31 4.042 -3.802 -5.534
265 H GLU 32 H GLU 32 2.307 -6.904 -1.666
266 HA GLU 32 HA GLU 32 0.597 -8.969 -2.897
267 HB2 GLU 32 HB2 GLU 32 2.305 -10.237 -1.658
268 HB3 GLU 32 HB3 GLU 32 2.002 -9.253 -0.207
269 HG2 GLU 32 HG2 GLU 32 -0.338 -10.042 -0.152
270 HG3 GLU 32 HG3 GLU 32 -0.057 -10.995 -1.620
271 H VAL 33 H VAL 33 -1.507 -8.424 -2.527
272 HA VAL 33 HA VAL 33 -2.064 -6.676 -0.184
273 HB VAL 33 HB VAL 33 -3.649 -5.430 -1.692
274 HG11 VAL 33 HG11 VAL 33 -1.432 -4.525 -1.103
275 HG12 VAL 33 HG12 VAL 33 -0.708 -5.378 -2.487
276 HG13 VAL 33 HG13 VAL 33 -1.888 -4.075 -2.761
277 HG21 VAL 33 HG21 VAL 33 -2.075 -6.822 -3.906
278 HG22 VAL 33 HG22 VAL 33 -3.754 -7.214 -3.474
279 HG23 VAL 33 HG23 VAL 33 -3.351 -5.603 -4.109
280 H SER 34 H SER 34 -4.233 -6.750 0.589
281 HA SER 34 HA SER 34 -5.809 -9.105 -0.328
282 HB2 SER 34 HB2 SER 34 -4.619 -9.678 1.743
283 HB3 SER 34 HB3 SER 34 -5.274 -8.227 2.537
284 HG SER 34 HG SER 34 -6.457 -10.225 2.904
285 H LEU 35 H LEU 35 -7.639 -8.316 -1.202
286 HA LEU 35 HA LEU 35 -8.485 -5.632 -0.834
287 HB2 LEU 35 HB2 LEU 35 -9.985 -8.060 -1.893
288 HB3 LEU 35 HB3 LEU 35 -10.485 -6.375 -2.118
289 HG LEU 35 HG LEU 35 -7.850 -7.544 -3.106
290 HD11 LEU 35 HD11 LEU 35 -8.904 -7.411 -5.340
291 HD12 LEU 35 HD12 LEU 35 -9.788 -8.523 -4.272
292 HD13 LEU 35 HD13 LEU 35 -10.431 -6.894 -4.589
293 HD21 LEU 35 HD21 LEU 35 -7.740 -5.436 -4.408
294 HD22 LEU 35 HD22 LEU 35 -9.258 -4.894 -3.660
295 HD23 LEU 35 HD23 LEU 35 -7.804 -5.093 -2.665
296 H GLU 36 H GLU 36 -9.299 -8.581 0.983
297 HA GLU 36 HA GLU 36 -11.783 -7.409 1.958
298 HB2 GLU 36 HB2 GLU 36 -10.247 -9.899 2.791
299 HB3 GLU 36 HB3 GLU 36 -11.879 -9.456 3.343
300 HG2 GLU 36 HG2 GLU 36 -12.657 -9.444 0.978
301 HG3 GLU 36 HG3 GLU 36 -11.043 -9.970 0.459
302 H LYS 37 H LYS 37 -8.422 -7.687 3.109
303 HA LYS 37 HA LYS 37 -9.282 -6.484 5.683
304 HB2 LYS 37 HB2 LYS 37 -6.682 -7.848 4.873
305 HB3 LYS 37 HB3 LYS 37 -6.982 -7.039 6.427
306 HG2 LYS 37 HG2 LYS 37 -7.624 -9.121 7.065
307 HG3 LYS 37 HG3 LYS 37 -9.175 -8.589 6.392
308 HD2 LYS 37 HD2 LYS 37 -8.547 -9.695 4.226
309 HD3 LYS 37 HD3 LYS 37 -7.034 -10.252 4.984
310 HE2 LYS 37 HE2 LYS 37 -8.348 -11.450 6.710
311 HE3 LYS 37 HE3 LYS 37 -9.853 -10.887 5.958
312 HZ1 LYS 37 HZ1 LYS 37 -9.319 -13.094 5.275
313 HZ2 LYS 37 HZ2 LYS 37 -9.228 -12.084 3.979
314 HZ3 LYS 37 HZ3 LYS 37 -7.848 -12.626 4.702
315 H GLY 38 H GLY 38 -8.070 -5.583 2.630
316 HA2 GLY 38 HA2 GLY 38 -7.386 -3.529 1.872
317 HA3 GLY 38 HA3 GLY 38 -7.786 -2.859 3.467
318 H GLU 39 H GLU 39 -5.539 -5.575 3.282
319 HA GLU 39 HA GLU 39 -3.440 -3.765 4.319
320 HB2 GLU 39 HB2 GLU 39 -3.644 -6.798 4.139
321 HB3 GLU 39 HB3 GLU 39 -2.294 -5.906 4.868
322 HG2 GLU 39 HG2 GLU 39 -3.869 -4.855 6.476
323 HG3 GLU 39 HG3 GLU 39 -5.198 -5.803 5.777
324 H ALA 40 H ALA 40 -1.277 -3.878 3.537
325 HA ALA 40 HA ALA 40 -0.862 -5.015 0.858
326 HB1 ALA 40 HB1 ALA 40 -0.198 -2.957 -0.124
327 HB2 ALA 40 HB2 ALA 40 -1.731 -2.619 0.689
328 HB3 ALA 40 HB3 ALA 40 -0.208 -2.109 1.452
329 H LEU 41 H LEU 41 0.772 -6.301 1.238
330 HA LEU 41 HA LEU 41 3.013 -5.480 3.009
331 HB2 LEU 41 HB2 LEU 41 2.293 -8.164 1.743
332 HB3 LEU 41 HB3 LEU 41 3.646 -7.863 2.832
333 HG LEU 41 HG LEU 41 1.999 -8.880 4.154
334 HD11 LEU 41 HD11 LEU 41 3.027 -6.879 5.200
335 HD12 LEU 41 HD12 LEU 41 1.669 -5.887 4.610
336 HD13 LEU 41 HD13 LEU 41 1.376 -7.183 5.791
337 HD21 LEU 41 HD21 LEU 41 -0.327 -8.246 4.274
338 HD22 LEU 41 HD22 LEU 41 -0.073 -6.881 3.173
339 HD23 LEU 41 HD23 LEU 41 0.096 -8.551 2.575
340 H VAL 42 H VAL 42 5.188 -5.580 2.195
341 HA VAL 42 HA VAL 42 5.460 -6.071 -0.712
342 HB VAL 42 HB VAL 42 6.953 -4.117 -0.901
343 HG11 VAL 42 HG11 VAL 42 5.228 -2.524 -1.185
344 HG12 VAL 42 HG12 VAL 42 4.447 -4.095 -1.406
345 HG13 VAL 42 HG13 VAL 42 4.242 -3.225 0.134
346 HG21 VAL 42 HG21 VAL 42 5.899 -3.378 1.863
347 HG22 VAL 42 HG22 VAL 42 7.560 -3.903 1.501
348 HG23 VAL 42 HG23 VAL 42 6.945 -2.378 0.829
349 H GLU 43 H GLU 43 7.756 -6.409 -1.338
350 HA GLU 43 HA GLU 43 9.517 -7.176 0.917
351 HB2 GLU 43 HB2 GLU 43 8.355 -9.221 0.157
352 HB3 GLU 43 HB3 GLU 43 8.929 -8.931 -1.499
353 HG2 GLU 43 HG2 GLU 43 11.260 -9.114 -0.756
354 HG3 GLU 43 HG3 GLU 43 10.734 -9.273 0.931
355 H GLY 44 H GLY 44 10.796 -5.377 0.579
356 HA2 GLY 44 HA2 GLY 44 12.592 -5.454 -1.694
357 HA3 GLY 44 HA3 GLY 44 11.468 -4.077 -1.729
358 H THR 45 H THR 45 13.755 -3.046 -1.590
359 HA THR 45 HA THR 45 14.527 -2.716 1.268
360 HB THR 45 HB THR 45 16.776 -2.138 0.334
361 HG1 THR 45 HG1 THR 45 17.049 -2.853 -1.893
362 HG21 THR 45 HG21 THR 45 15.676 -4.853 -0.515
363 HG22 THR 45 HG22 THR 45 17.388 -4.453 -0.249
364 HG23 THR 45 HG23 THR 45 16.248 -4.432 1.116
365 H ALA 46 H ALA 46 12.374 -1.284 -0.196
366 HA ALA 46 HA ALA 46 13.380 1.297 -0.993
367 HB1 ALA 46 HB1 ALA 46 10.990 1.875 -1.082
368 HB2 ALA 46 HB2 ALA 46 11.261 0.277 -1.819
369 HB3 ALA 46 HB3 ALA 46 10.583 0.396 -0.180
370 H ASP 47 H ASP 47 12.427 3.339 0.082
371 HA ASP 47 HA ASP 47 13.264 3.365 2.853
372 HB2 ASP 47 HB2 ASP 47 13.573 5.210 1.118
373 HB3 ASP 47 HB3 ASP 47 11.848 5.572 1.325
374 HA PRO 48 HA PRO 48 9.399 2.344 4.700
375 HB2 PRO 48 HB2 PRO 48 10.348 4.348 6.753
376 HB3 PRO 48 HB3 PRO 48 9.644 2.719 7.026
377 HG2 PRO 48 HG2 PRO 48 12.316 3.059 7.191
378 HG3 PRO 48 HG3 PRO 48 11.657 1.655 6.281
379 HD2 PRO 48 HD2 PRO 48 12.697 4.275 5.188
380 HD3 PRO 48 HD3 PRO 48 12.975 2.606 4.595
381 H LYS 49 H LYS 49 10.360 5.842 4.685
382 HA LYS 49 HA LYS 49 7.617 6.706 5.017
383 HB2 LYS 49 HB2 LYS 49 10.034 8.264 4.014
384 HB3 LYS 49 HB3 LYS 49 8.511 8.934 4.627
385 HG2 LYS 49 HG2 LYS 49 8.982 7.784 6.820
386 HG3 LYS 49 HG3 LYS 49 10.604 7.373 6.211
387 HD2 LYS 49 HD2 LYS 49 9.789 10.212 5.828
388 HD3 LYS 49 HD3 LYS 49 9.927 9.709 7.525
389 HE2 LYS 49 HE2 LYS 49 12.209 8.904 7.153
390 HE3 LYS 49 HE3 LYS 49 12.091 9.318 5.430
391 HZ1 LYS 49 HZ1 LYS 49 11.763 11.606 6.089
392 HZ2 LYS 49 HZ2 LYS 49 11.963 11.207 7.675
393 HZ3 LYS 49 HZ3 LYS 49 13.212 11.026 6.614
394 H ALA 50 H ALA 50 9.731 5.975 2.264
395 HA ALA 50 HA ALA 50 8.301 7.508 0.337
396 HB1 ALA 50 HB1 ALA 50 10.589 6.657 -0.014
397 HB2 ALA 50 HB2 ALA 50 9.975 4.985 0.001
398 HB3 ALA 50 HB3 ALA 50 9.498 6.097 -1.301
399 H LEU 51 H LEU 51 7.858 4.210 1.637
400 HA LEU 51 HA LEU 51 6.010 3.412 -0.403
401 HB2 LEU 51 HB2 LEU 51 7.378 1.988 1.314
402 HB3 LEU 51 HB3 LEU 51 6.038 2.337 2.426
403 HG LEU 51 HG LEU 51 4.490 1.494 0.526
404 HD11 LEU 51 HD11 LEU 51 5.602 -0.089 -1.057
405 HD12 LEU 51 HD12 LEU 51 6.189 1.570 -1.281
406 HD13 LEU 51 HD13 LEU 51 7.184 0.387 -0.404
407 HD21 LEU 51 HD21 LEU 51 5.081 0.226 2.618
408 HD22 LEU 51 HD22 LEU 51 4.749 -0.819 1.213
409 HD23 LEU 51 HD23 LEU 51 6.424 -0.521 1.728
410 H VAL 52 H VAL 52 5.619 4.635 2.957
411 HA VAL 52 HA VAL 52 2.773 4.537 2.922
412 HB VAL 52 HB VAL 52 4.674 6.182 4.640
413 HG11 VAL 52 HG11 VAL 52 1.800 5.261 5.077
414 HG12 VAL 52 HG12 VAL 52 2.819 6.048 6.301
415 HG13 VAL 52 HG13 VAL 52 2.340 6.941 4.841
416 HG21 VAL 52 HG21 VAL 52 4.472 4.282 6.216
417 HG22 VAL 52 HG22 VAL 52 3.490 3.400 5.022
418 HG23 VAL 52 HG23 VAL 52 5.197 3.765 4.678
419 H GLN 53 H GLN 53 5.064 6.920 1.651
420 HA GLN 53 HA GLN 53 3.012 9.014 1.661
421 HB2 GLN 53 HB2 GLN 53 5.449 9.501 1.975
422 HB3 GLN 53 HB3 GLN 53 5.739 8.962 0.304
423 HG2 GLN 53 HG2 GLN 53 4.132 10.688 -0.501
424 HG3 GLN 53 HG3 GLN 53 3.884 11.225 1.170
425 HE21 GLN 53 HE21 GLN 53 6.539 13.241 -0.787
426 HE22 GLN 53 HE22 GLN 53 4.992 12.602 -1.295
427 H ALA 54 H ALA 54 4.441 6.652 -0.610
428 HA ALA 54 HA ALA 54 3.432 7.779 -2.984
429 HB1 ALA 54 HB1 ALA 54 3.421 4.844 -2.939
430 HB2 ALA 54 HB2 ALA 54 4.354 5.965 -3.936
431 HB3 ALA 54 HB3 ALA 54 4.934 5.557 -2.305
432 H VAL 55 H VAL 55 1.920 5.442 -0.685
433 HA VAL 55 HA VAL 55 -0.401 5.073 -2.338
434 HB VAL 55 HB VAL 55 -1.349 4.030 -0.322
435 HG11 VAL 55 HG11 VAL 55 1.423 2.976 -0.268
436 HG12 VAL 55 HG12 VAL 55 -0.107 2.159 -0.585
437 HG13 VAL 55 HG13 VAL 55 0.659 3.097 -1.886
438 HG21 VAL 55 HG21 VAL 55 -0.406 5.547 1.396
439 HG22 VAL 55 HG22 VAL 55 -0.012 3.851 1.743
440 HG23 VAL 55 HG23 VAL 55 1.224 4.923 1.048
441 H GLU 56 H GLU 56 0.539 7.486 0.103
442 HA GLU 56 HA GLU 56 -2.164 8.488 0.419
443 HB2 GLU 56 HB2 GLU 56 -0.465 8.774 2.161
444 HB3 GLU 56 HB3 GLU 56 0.562 9.699 1.046
445 HG2 GLU 56 HG2 GLU 56 -1.165 11.444 0.865
446 HG3 GLU 56 HG3 GLU 56 -2.252 10.500 1.900
447 H GLU 57 H GLU 57 0.506 8.959 -1.833
448 HA GLU 57 HA GLU 57 -0.389 11.465 -2.895
449 HB2 GLU 57 HB2 GLU 57 1.911 10.451 -3.092
450 HB3 GLU 57 HB3 GLU 57 1.245 9.290 -4.261
451 HG2 GLU 57 HG2 GLU 57 0.569 11.115 -5.737
452 HG3 GLU 57 HG3 GLU 57 1.074 12.326 -4.544
453 H GLU 58 H GLU 58 -1.423 8.150 -3.209
454 HA GLU 58 HA GLU 58 -2.959 8.690 -5.670
455 HB2 GLU 58 HB2 GLU 58 -2.634 6.227 -3.906
456 HB3 GLU 58 HB3 GLU 58 -3.607 6.284 -5.389
457 HG2 GLU 58 HG2 GLU 58 -0.617 6.864 -5.230
458 HG3 GLU 58 HG3 GLU 58 -1.341 5.346 -5.785
459 H GLY 59 H GLY 59 -3.301 9.184 -2.331
460 HA2 GLY 59 HA2 GLY 59 -5.239 10.186 -1.415
461 HA3 GLY 59 HA3 GLY 59 -6.229 9.429 -2.676
462 H TYR 60 H TYR 60 -3.952 7.221 -1.336
463 HA TYR 60 HA TYR 60 -6.040 6.163 0.514
464 HB2 TYR 60 HB2 TYR 60 -4.263 4.707 -1.469
465 HB3 TYR 60 HB3 TYR 60 -5.168 3.904 -0.184
466 HD1 TYR 60 HD1 TYR 60 -5.393 5.542 -3.452
467 HD2 TYR 60 HD2 TYR 60 -7.619 3.818 -0.203
468 HE1 TYR 60 HE1 TYR 60 -7.394 5.397 -4.908
469 HE2 TYR 60 HE2 TYR 60 -9.624 3.665 -1.648
470 HH TYR 60 HH TYR 60 -10.517 4.093 -3.710
471 H LYS 61 H LYS 61 -5.029 7.095 2.349
472 HA LYS 61 HA LYS 61 -2.245 6.672 2.948
473 HB2 LYS 61 HB2 LYS 61 -4.649 7.282 4.721
474 HB3 LYS 61 HB3 LYS 61 -2.951 7.361 5.245
475 HG2 LYS 61 HG2 LYS 61 -2.472 9.076 3.568
476 HG3 LYS 61 HG3 LYS 61 -4.128 8.959 2.931
477 HD2 LYS 61 HD2 LYS 61 -5.029 9.712 5.100
478 HD3 LYS 61 HD3 LYS 61 -3.375 9.840 5.751
479 HE2 LYS 61 HE2 LYS 61 -2.811 11.519 4.055
480 HE3 LYS 61 HE3 LYS 61 -4.405 11.332 3.301
481 HZ1 LYS 61 HZ1 LYS 61 -4.310 13.239 4.719
482 HZ2 LYS 61 HZ2 LYS 61 -5.395 12.147 5.306
483 HZ3 LYS 61 HZ3 LYS 61 -3.919 12.315 6.026
484 H ALA 62 H ALA 62 -1.493 5.291 4.814
485 HA ALA 62 HA ALA 62 -3.165 2.970 5.470
486 HB1 ALA 62 HB1 ALA 62 -2.254 2.431 3.232
487 HB2 ALA 62 HB2 ALA 62 -0.609 2.709 3.838
488 HB3 ALA 62 HB3 ALA 62 -1.582 1.366 4.491
489 H GLU 63 H GLU 63 -2.818 2.786 7.613
490 HA GLU 63 HA GLU 63 -0.444 3.780 8.897
491 HB2 GLU 63 HB2 GLU 63 -2.740 3.671 9.920
492 HB3 GLU 63 HB3 GLU 63 -2.587 1.901 9.967
493 HG2 GLU 63 HG2 GLU 63 -0.479 2.180 11.307
494 HG3 GLU 63 HG3 GLU 63 -0.768 3.929 11.342
495 H VAL 64 H VAL 64 1.522 2.757 8.678
496 HA VAL 64 HA VAL 64 1.879 0.002 8.136
497 HB VAL 64 HB VAL 64 4.196 0.434 9.038
498 HG11 VAL 64 HG11 VAL 64 2.965 2.355 7.029
499 HG12 VAL 64 HG12 VAL 64 4.724 2.189 7.290
500 HG13 VAL 64 HG13 VAL 64 3.771 0.809 6.705
501 HG21 VAL 64 HG21 VAL 64 3.079 3.238 9.487
502 HG22 VAL 64 HG22 VAL 64 3.645 2.124 10.755
503 HG23 VAL 64 HG23 VAL 64 4.793 2.777 9.572
504 H LEU 65 H LEU 65 1.351 -1.698 9.388
505 HA LEU 65 HA LEU 65 0.772 -1.281 12.236
506 HB2 LEU 65 HB2 LEU 65 0.722 -3.764 10.471
507 HB3 LEU 65 HB3 LEU 65 0.167 -3.696 12.155
508 HG LEU 65 HG LEU 65 -0.985 -2.075 9.842
509 HD11 LEU 65 HD11 LEU 65 -2.066 -4.468 11.392
510 HD12 LEU 65 HD12 LEU 65 -2.946 -3.559 10.140
511 HD13 LEU 65 HD13 LEU 65 -1.493 -4.489 9.708
512 HD21 LEU 65 HD21 LEU 65 -2.771 -1.524 11.492
513 HD22 LEU 65 HD22 LEU 65 -1.839 -2.357 12.758
514 HD23 LEU 65 HD23 LEU 65 -1.191 -0.888 11.991
515 H ALA 66 H ALA 66 3.080 -0.540 12.571
516 HA ALA 66 HA ALA 66 4.696 -2.834 13.431
517 HB1 ALA 66 HB1 ALA 66 5.453 -2.434 11.121
518 HB2 ALA 66 HB2 ALA 66 5.718 -0.713 11.497
519 HB3 ALA 66 HB3 ALA 66 6.711 -1.961 12.287
Start of MODEL 9
1 H1 MET 1 H MET 1 8.693 -3.851 10.803
2 HA MET 1 HA MET 1 9.274 -4.098 7.908
3 HB2 MET 1 HB2 MET 1 8.998 -6.265 9.123
4 HB3 MET 1 HB3 MET 1 7.364 -5.760 9.598
5 HG2 MET 1 HG2 MET 1 6.746 -5.548 7.215
6 HG3 MET 1 HG3 MET 1 8.384 -6.024 6.744
7 HE1 MET 1 HE1 MET 1 5.570 -8.615 5.820
8 HE2 MET 1 HE2 MET 1 6.298 -7.051 5.424
9 HE3 MET 1 HE3 MET 1 7.249 -8.539 5.208
10 H LEU 2 H LEU 2 7.635 -3.429 6.450
11 HA LEU 2 HA LEU 2 5.739 -1.518 7.651
12 HB2 LEU 2 HB2 LEU 2 6.430 -2.158 4.757
13 HB3 LEU 2 HB3 LEU 2 5.406 -0.811 5.307
14 HG LEU 2 HG LEU 2 8.324 -1.231 6.102
15 HD11 LEU 2 HD11 LEU 2 8.045 -0.680 3.701
16 HD12 LEU 2 HD12 LEU 2 7.107 0.765 4.157
17 HD13 LEU 2 HD13 LEU 2 8.822 0.631 4.611
18 HD21 LEU 2 HD21 LEU 2 7.016 0.011 7.790
19 HD22 LEU 2 HD22 LEU 2 8.142 1.094 6.947
20 HD23 LEU 2 HD23 LEU 2 6.415 1.108 6.523
21 H LYS 3 H LYS 3 3.442 -1.594 7.131
22 HA LYS 3 HA LYS 3 2.346 -4.102 6.103
23 HB2 LYS 3 HB2 LYS 3 3.228 -4.390 8.521
24 HB3 LYS 3 HB3 LYS 3 1.883 -3.355 9.020
25 HG2 LYS 3 HG2 LYS 3 0.273 -4.979 8.198
26 HG3 LYS 3 HG3 LYS 3 1.561 -5.883 7.357
27 HD2 LYS 3 HD2 LYS 3 2.676 -6.248 9.574
28 HD3 LYS 3 HD3 LYS 3 1.247 -5.561 10.370
29 HE2 LYS 3 HE2 LYS 3 -0.158 -7.333 9.417
30 HE3 LYS 3 HE3 LYS 3 1.225 -7.961 8.497
31 HZ1 LYS 3 HZ1 LYS 3 2.322 -8.401 10.580
32 HZ2 LYS 3 HZ2 LYS 3 1.013 -7.867 11.424
33 HZ3 LYS 3 HZ3 LYS 3 0.890 -9.214 10.480
34 H LEU 4 H LEU 4 1.349 -2.524 4.637
35 HA LEU 4 HA LEU 4 0.201 -0.095 5.790
36 HB2 LEU 4 HB2 LEU 4 0.761 -1.229 3.065
37 HB3 LEU 4 HB3 LEU 4 -0.516 -0.008 3.206
38 HG LEU 4 HG LEU 4 1.075 1.508 4.386
39 HD11 LEU 4 HD11 LEU 4 3.118 -0.603 3.573
40 HD12 LEU 4 HD12 LEU 4 3.488 0.988 4.278
41 HD13 LEU 4 HD13 LEU 4 2.623 -0.233 5.240
42 HD21 LEU 4 HD21 LEU 4 0.682 1.670 1.941
43 HD22 LEU 4 HD22 LEU 4 2.358 2.098 2.358
44 HD23 LEU 4 HD23 LEU 4 1.995 0.503 1.659
45 H LYS 5 H LYS 5 -1.623 -0.414 6.948
46 HA LYS 5 HA LYS 5 -3.786 -2.023 5.759
47 HB2 LYS 5 HB2 LYS 5 -3.096 -2.142 8.203
48 HB3 LYS 5 HB3 LYS 5 -3.783 -0.519 8.411
49 HG2 LYS 5 HG2 LYS 5 -5.500 -2.542 7.010
50 HG3 LYS 5 HG3 LYS 5 -5.168 -2.849 8.725
51 HD2 LYS 5 HD2 LYS 5 -5.972 -0.596 9.318
52 HD3 LYS 5 HD3 LYS 5 -6.360 -0.284 7.607
53 HE2 LYS 5 HE2 LYS 5 -7.911 -2.191 7.592
54 HE3 LYS 5 HE3 LYS 5 -7.476 -2.584 9.266
55 HZ1 LYS 5 HZ1 LYS 5 -8.772 -0.101 8.379
56 HZ2 LYS 5 HZ2 LYS 5 -9.508 -1.358 9.149
57 HZ3 LYS 5 HZ3 LYS 5 -8.362 -0.472 9.932
58 H VAL 6 H VAL 6 -4.505 -0.830 4.036
59 HA VAL 6 HA VAL 6 -4.620 1.999 3.921
60 HB VAL 6 HB VAL 6 -6.097 -0.083 2.264
61 HG11 VAL 6 HG11 VAL 6 -5.176 2.763 1.667
62 HG12 VAL 6 HG12 VAL 6 -5.921 1.654 0.493
63 HG13 VAL 6 HG13 VAL 6 -6.863 2.237 1.882
64 HG21 VAL 6 HG21 VAL 6 -4.131 0.009 0.790
65 HG22 VAL 6 HG22 VAL 6 -3.325 1.129 1.909
66 HG23 VAL 6 HG23 VAL 6 -3.659 -0.547 2.408
67 H GLU 7 H GLU 7 -6.183 3.466 4.296
68 HA GLU 7 HA GLU 7 -8.673 2.596 5.615
69 HB2 GLU 7 HB2 GLU 7 -7.309 4.453 6.572
70 HB3 GLU 7 HB3 GLU 7 -7.526 5.370 5.068
71 HG2 GLU 7 HG2 GLU 7 -9.117 6.137 6.752
72 HG3 GLU 7 HG3 GLU 7 -9.990 5.342 5.432
73 H GLY 8 H GLY 8 -10.764 3.162 4.765
74 HA2 GLY 8 HA2 GLY 8 -10.814 3.286 1.830
75 HA3 GLY 8 HA3 GLY 8 -12.185 2.997 2.918
76 H MET 9 H MET 9 -9.826 5.596 2.046
77 HA MET 9 HA MET 9 -11.457 7.700 3.094
78 HB2 MET 9 HB2 MET 9 -9.192 7.696 1.072
79 HB3 MET 9 HB3 MET 9 -9.834 9.154 1.855
80 HG2 MET 9 HG2 MET 9 -8.990 6.892 3.637
81 HG3 MET 9 HG3 MET 9 -7.721 7.773 2.781
82 HE1 MET 9 HE1 MET 9 -6.538 8.485 4.952
83 HE2 MET 9 HE2 MET 9 -7.362 9.240 6.336
84 HE3 MET 9 HE3 MET 9 -7.755 7.568 5.871
85 H THR 10 H THR 10 -11.131 6.285 -0.207
86 HA THR 10 HA THR 10 -13.448 7.956 -1.025
87 HB THR 10 HB THR 10 -12.271 8.370 -3.192
88 HG1 THR 10 HG1 THR 10 -9.949 8.046 -3.053
89 HG21 THR 10 HG21 THR 10 -12.270 10.076 -1.393
90 HG22 THR 10 HG22 THR 10 -10.787 9.357 -0.720
91 HG23 THR 10 HG23 THR 10 -10.759 10.108 -2.331
92 H CYS 11 H CYS 11 -14.304 7.237 -3.182
93 HA CYS 11 HA CYS 11 -15.409 5.604 -4.315
94 HB2 CYS 11 HB2 CYS 11 -12.606 4.426 -4.347
95 HB3 CYS 11 HB3 CYS 11 -13.917 4.040 -5.487
96 HG CYS 11 HG CYS 11 -14.282 6.490 -6.314
97 H ASN 12 H ASN 12 -15.633 5.292 -1.467
98 HA ASN 12 HA ASN 12 -15.106 2.597 -0.681
99 HB2 ASN 12 HB2 ASN 12 -16.540 3.116 1.219
100 HB3 ASN 12 HB3 ASN 12 -15.417 4.447 0.902
101 HD21 ASN 12 HD21 ASN 12 -19.308 5.252 1.174
102 HD22 ASN 12 HD22 ASN 12 -18.525 3.803 1.767
103 H HIS 13 H HIS 13 -17.230 3.742 -3.022
104 HA HIS 13 HA HIS 13 -19.345 1.759 -2.504
105 HB2 HIS 13 HB2 HIS 13 -18.817 3.695 -4.792
106 HB3 HIS 13 HB3 HIS 13 -20.234 2.643 -4.661
107 HD1 HIS 13 HD1 HIS 13 -18.859 5.914 -3.281
108 HD2 HIS 13 HD2 HIS 13 -22.051 3.223 -2.723
109 HE1 HIS 13 HE1 HIS 13 -20.597 7.121 -1.856
110 H CYS 14 H CYS 14 -16.213 1.833 -3.807
111 HA CYS 14 HA CYS 14 -16.738 -0.617 -5.401
112 HB2 CYS 14 HB2 CYS 14 -14.881 1.687 -6.120
113 HB3 CYS 14 HB3 CYS 14 -15.049 0.165 -7.025
114 HG CYS 14 HG CYS 14 -16.269 2.114 -8.269
115 H VAL 15 H VAL 15 -14.251 -1.385 -6.020
116 HA VAL 15 HA VAL 15 -13.049 -2.010 -3.414
117 HB VAL 15 HB VAL 15 -13.410 -3.754 -5.149
118 HG11 VAL 15 HG11 VAL 15 -12.012 -3.764 -7.172
119 HG12 VAL 15 HG12 VAL 15 -13.053 -2.324 -7.139
120 HG13 VAL 15 HG13 VAL 15 -11.328 -2.184 -6.726
121 HG21 VAL 15 HG21 VAL 15 -11.197 -4.769 -5.026
122 HG22 VAL 15 HG22 VAL 15 -10.459 -3.202 -4.636
123 HG23 VAL 15 HG23 VAL 15 -11.576 -3.974 -3.482
124 H MET 16 H MET 16 -10.651 -1.694 -3.134
125 HA MET 16 HA MET 16 -9.884 0.946 -4.271
126 HB2 MET 16 HB2 MET 16 -9.013 -0.613 -1.806
127 HB3 MET 16 HB3 MET 16 -8.301 0.938 -2.304
128 HG2 MET 16 HG2 MET 16 -10.401 2.074 -2.077
129 HG3 MET 16 HG3 MET 16 -11.275 0.552 -1.872
130 HE1 MET 16 HE1 MET 16 -10.658 -0.594 1.671
131 HE2 MET 16 HE2 MET 16 -11.603 -0.737 0.173
132 HE3 MET 16 HE3 MET 16 -9.879 -1.180 0.181
133 H ALA 17 H ALA 17 -8.367 1.003 -5.795
134 HA ALA 17 HA ALA 17 -6.731 -1.392 -6.330
135 HB1 ALA 17 HB1 ALA 17 -7.896 -0.240 -8.197
136 HB2 ALA 17 HB2 ALA 17 -7.034 1.263 -7.803
137 HB3 ALA 17 HB3 ALA 17 -6.130 -0.151 -8.390
138 H VAL 18 H VAL 18 -5.266 -1.332 -4.545
139 HA VAL 18 HA VAL 18 -3.654 1.135 -4.249
140 HB VAL 18 HB VAL 18 -3.782 -1.376 -2.536
141 HG11 VAL 18 HG11 VAL 18 -2.692 1.418 -1.985
142 HG12 VAL 18 HG12 VAL 18 -2.769 0.081 -0.814
143 HG13 VAL 18 HG13 VAL 18 -1.718 -0.050 -2.235
144 HG21 VAL 18 HG21 VAL 18 -5.176 1.314 -2.204
145 HG22 VAL 18 HG22 VAL 18 -5.971 -0.220 -2.633
146 HG23 VAL 18 HG23 VAL 18 -5.213 -0.032 -1.041
147 H THR 19 H THR 19 -3.510 -2.018 -5.684
148 HA THR 19 HA THR 19 -0.951 -2.843 -5.189
149 HB THR 19 HB THR 19 -2.430 -3.059 -7.834
150 HG1 THR 19 HG1 THR 19 -3.200 -4.988 -6.835
151 HG21 THR 19 HG21 THR 19 -1.180 -5.188 -8.032
152 HG22 THR 19 HG22 THR 19 -0.071 -3.801 -7.941
153 HG23 THR 19 HG23 THR 19 -0.327 -4.828 -6.512
154 H LYS 20 H LYS 20 -1.875 -0.561 -7.869
155 HA LYS 20 HA LYS 20 0.763 -0.516 -8.943
156 HB2 LYS 20 HB2 LYS 20 -1.490 1.517 -9.116
157 HB3 LYS 20 HB3 LYS 20 -0.019 1.548 -10.105
158 HG2 LYS 20 HG2 LYS 20 -1.170 -1.103 -10.220
159 HG3 LYS 20 HG3 LYS 20 -2.425 0.103 -10.588
160 HD2 LYS 20 HD2 LYS 20 -0.951 1.143 -12.272
161 HD3 LYS 20 HD3 LYS 20 0.320 -0.048 -11.904
162 HE2 LYS 20 HE2 LYS 20 -1.197 -1.879 -12.579
163 HE3 LYS 20 HE3 LYS 20 -2.472 -0.695 -12.936
164 HZ1 LYS 20 HZ1 LYS 20 -1.024 0.262 -14.585
165 HZ2 LYS 20 HZ2 LYS 20 0.142 -0.860 -14.265
166 HZ3 LYS 20 HZ3 LYS 20 -1.302 -1.331 -14.905
167 H ALA 21 H ALA 21 -0.627 1.163 -6.164
168 HA ALA 21 HA ALA 21 1.216 3.367 -6.252
169 HB1 ALA 21 HB1 ALA 21 -0.373 2.214 -3.926
170 HB2 ALA 21 HB2 ALA 21 0.385 3.824 -3.996
171 HB3 ALA 21 HB3 ALA 21 -0.965 3.428 -5.084
172 H LEU 22 H LEU 22 1.437 0.049 -5.059
173 HA LEU 22 HA LEU 22 3.706 0.645 -3.294
174 HB2 LEU 22 HB2 LEU 22 2.336 -1.890 -4.287
175 HB3 LEU 22 HB3 LEU 22 3.825 -1.925 -3.339
176 HG LEU 22 HG LEU 22 1.994 -2.313 -1.864
177 HD11 LEU 22 HD11 LEU 22 3.900 -0.835 -1.109
178 HD12 LEU 22 HD12 LEU 22 2.849 0.562 -1.418
179 HD13 LEU 22 HD13 LEU 22 2.383 -0.636 -0.196
180 HD21 LEU 22 HD21 LEU 22 0.204 -1.254 -3.189
181 HD22 LEU 22 HD22 LEU 22 0.190 -0.718 -1.494
182 HD23 LEU 22 HD23 LEU 22 0.838 0.355 -2.753
183 H LYS 23 H LYS 23 3.090 -0.778 -6.518
184 HA LYS 23 HA LYS 23 5.688 -1.799 -6.887
185 HB2 LYS 23 HB2 LYS 23 3.528 -2.405 -8.060
186 HB3 LYS 23 HB3 LYS 23 3.754 -0.962 -9.073
187 HG2 LYS 23 HG2 LYS 23 5.930 -1.838 -9.840
188 HG3 LYS 23 HG3 LYS 23 5.769 -3.234 -8.748
189 HD2 LYS 23 HD2 LYS 23 3.720 -3.937 -9.950
190 HD3 LYS 23 HD3 LYS 23 3.892 -2.549 -11.050
191 HE2 LYS 23 HE2 LYS 23 6.106 -3.411 -11.785
192 HE3 LYS 23 HE3 LYS 23 5.931 -4.767 -10.655
193 HZ1 LYS 23 HZ1 LYS 23 3.770 -5.145 -11.944
194 HZ2 LYS 23 HZ2 LYS 23 4.481 -4.257 -13.116
195 HZ3 LYS 23 HZ3 LYS 23 5.213 -5.641 -12.608
196 H LYS 24 H LYS 24 4.512 1.509 -7.324
197 HA LYS 24 HA LYS 24 6.636 2.171 -9.210
198 HB2 LYS 24 HB2 LYS 24 4.652 3.850 -7.629
199 HB3 LYS 24 HB3 LYS 24 5.848 4.523 -8.756
200 HG2 LYS 24 HG2 LYS 24 4.920 3.131 -10.584
201 HG3 LYS 24 HG3 LYS 24 3.669 2.519 -9.474
202 HD2 LYS 24 HD2 LYS 24 2.858 4.821 -9.107
203 HD3 LYS 24 HD3 LYS 24 4.142 5.453 -10.162
204 HE2 LYS 24 HE2 LYS 24 3.218 4.168 -12.062
205 HE3 LYS 24 HE3 LYS 24 1.925 3.548 -11.012
206 HZ1 LYS 24 HZ1 LYS 24 1.198 5.799 -10.685
207 HZ2 LYS 24 HZ2 LYS 24 2.397 6.378 -11.653
208 HZ3 LYS 24 HZ3 LYS 24 1.206 5.435 -12.290
209 H VAL 25 H VAL 25 6.528 1.777 -5.771
210 HA VAL 25 HA VAL 25 8.322 3.926 -5.116
211 HB VAL 25 HB VAL 25 7.476 1.379 -3.715
212 HG11 VAL 25 HG11 VAL 25 8.467 2.348 -1.665
213 HG12 VAL 25 HG12 VAL 25 9.708 2.025 -2.896
214 HG13 VAL 25 HG13 VAL 25 9.136 3.688 -2.625
215 HG21 VAL 25 HG21 VAL 25 6.829 4.272 -3.061
216 HG22 VAL 25 HG22 VAL 25 5.829 3.292 -4.173
217 HG23 VAL 25 HG23 VAL 25 6.024 2.811 -2.476
218 HA PRO 26 HA PRO 26 12.066 2.185 -6.759
219 HB2 PRO 26 HB2 PRO 26 13.204 3.877 -4.536
220 HB3 PRO 26 HB3 PRO 26 13.741 3.769 -6.245
221 HG2 PRO 26 HG2 PRO 26 12.262 5.881 -5.425
222 HG3 PRO 26 HG3 PRO 26 11.869 5.068 -6.980
223 HD2 PRO 26 HD2 PRO 26 10.522 4.728 -4.292
224 HD3 PRO 26 HD3 PRO 26 9.783 4.892 -5.918
225 H GLY 27 H GLY 27 13.054 0.261 -6.247
226 HA2 GLY 27 HA2 GLY 27 14.346 -1.133 -4.862
227 HA3 GLY 27 HA3 GLY 27 13.731 -0.294 -3.428
228 H VAL 28 H VAL 28 10.879 -0.584 -4.753
229 HA VAL 28 HA VAL 28 10.264 -3.102 -3.418
230 HB VAL 28 HB VAL 28 8.627 -1.148 -5.087
231 HG11 VAL 28 HG11 VAL 28 7.695 -3.411 -5.326
232 HG12 VAL 28 HG12 VAL 28 7.733 -3.627 -3.559
233 HG13 VAL 28 HG13 VAL 28 6.654 -2.415 -4.287
234 HG21 VAL 28 HG21 VAL 28 8.705 -1.797 -2.106
235 HG22 VAL 28 HG22 VAL 28 9.342 -0.321 -2.871
236 HG23 VAL 28 HG23 VAL 28 7.593 -0.646 -2.883
237 H GLU 29 H GLU 29 10.211 -5.098 -4.358
238 HA GLU 29 HA GLU 29 10.415 -5.167 -7.336
239 HB2 GLU 29 HB2 GLU 29 12.474 -5.854 -6.139
240 HB3 GLU 29 HB3 GLU 29 11.543 -7.084 -5.258
241 HG2 GLU 29 HG2 GLU 29 10.939 -8.147 -7.432
242 HG3 GLU 29 HG3 GLU 29 11.930 -6.941 -8.278
243 H LYS 30 H LYS 30 8.902 -6.486 -4.401
244 HA LYS 30 HA LYS 30 6.891 -7.783 -6.155
245 HB2 LYS 30 HB2 LYS 30 8.149 -8.992 -3.662
246 HB3 LYS 30 HB3 LYS 30 6.814 -9.696 -4.605
247 HG2 LYS 30 HG2 LYS 30 8.281 -9.777 -6.608
248 HG3 LYS 30 HG3 LYS 30 9.614 -9.090 -5.652
249 HD2 LYS 30 HD2 LYS 30 9.484 -11.055 -4.110
250 HD3 LYS 30 HD3 LYS 30 8.213 -11.741 -5.151
251 HE2 LYS 30 HE2 LYS 30 9.869 -12.689 -6.346
252 HE3 LYS 30 HE3 LYS 30 10.223 -11.063 -6.961
253 HZ1 LYS 30 HZ1 LYS 30 11.752 -10.805 -5.117
254 HZ2 LYS 30 HZ2 LYS 30 11.426 -12.336 -4.596
255 HZ3 LYS 30 HZ3 LYS 30 12.161 -12.096 -6.054
256 H VAL 31 H VAL 31 4.781 -7.937 -5.207
257 HA VAL 31 HA VAL 31 4.340 -6.391 -2.726
258 HB VAL 31 HB VAL 31 3.013 -5.835 -5.405
259 HG11 VAL 31 HG11 VAL 31 2.578 -4.547 -2.680
260 HG12 VAL 31 HG12 VAL 31 1.852 -4.003 -4.213
261 HG13 VAL 31 HG13 VAL 31 1.425 -5.591 -3.547
262 HG21 VAL 31 HG21 VAL 31 4.646 -3.885 -3.762
263 HG22 VAL 31 HG22 VAL 31 5.376 -4.898 -5.048
264 HG23 VAL 31 HG23 VAL 31 4.096 -3.733 -5.431
265 H GLU 32 H GLU 32 2.385 -6.943 -1.680
266 HA GLU 32 HA GLU 32 0.616 -8.906 -2.976
267 HB2 GLU 32 HB2 GLU 32 2.309 -10.279 -1.821
268 HB3 GLU 32 HB3 GLU 32 1.992 -9.405 -0.301
269 HG2 GLU 32 HG2 GLU 32 -0.346 -10.171 -0.322
270 HG3 GLU 32 HG3 GLU 32 -0.102 -10.930 -1.905
271 H VAL 33 H VAL 33 -1.480 -8.411 -2.517
272 HA VAL 33 HA VAL 33 -1.966 -6.721 -0.119
273 HB VAL 33 HB VAL 33 -3.558 -5.392 -1.449
274 HG11 VAL 33 HG11 VAL 33 -1.203 -4.644 -1.211
275 HG12 VAL 33 HG12 VAL 33 -0.783 -5.512 -2.706
276 HG13 VAL 33 HG13 VAL 33 -1.906 -4.135 -2.763
277 HG21 VAL 33 HG21 VAL 33 -2.466 -6.979 -3.814
278 HG22 VAL 33 HG22 VAL 33 -4.115 -7.096 -3.155
279 HG23 VAL 33 HG23 VAL 33 -3.565 -5.586 -3.912
280 H SER 34 H SER 34 -4.124 -6.812 0.705
281 HA SER 34 HA SER 34 -5.683 -9.196 -0.166
282 HB2 SER 34 HB2 SER 34 -4.451 -9.695 1.912
283 HB3 SER 34 HB3 SER 34 -5.147 -8.247 2.679
284 HG SER 34 HG SER 34 -6.263 -10.251 3.115
285 H LEU 35 H LEU 35 -7.302 -8.203 -1.254
286 HA LEU 35 HA LEU 35 -8.192 -5.572 -0.736
287 HB2 LEU 35 HB2 LEU 35 -9.572 -7.881 -2.157
288 HB3 LEU 35 HB3 LEU 35 -10.031 -6.174 -2.297
289 HG LEU 35 HG LEU 35 -7.301 -7.297 -3.065
290 HD11 LEU 35 HD11 LEU 35 -8.083 -6.982 -5.388
291 HD12 LEU 35 HD12 LEU 35 -9.103 -8.152 -4.521
292 HD13 LEU 35 HD13 LEU 35 -9.684 -6.492 -4.784
293 HD21 LEU 35 HD21 LEU 35 -7.047 -5.100 -4.193
294 HD22 LEU 35 HD22 LEU 35 -8.619 -4.588 -3.538
295 HD23 LEU 35 HD23 LEU 35 -7.256 -4.911 -2.440
296 H GLU 36 H GLU 36 -9.079 -8.593 0.843
297 HA GLU 36 HA GLU 36 -11.683 -7.548 1.655
298 HB2 GLU 36 HB2 GLU 36 -10.131 -10.033 2.468
299 HB3 GLU 36 HB3 GLU 36 -11.795 -9.648 2.970
300 HG2 GLU 36 HG2 GLU 36 -12.473 -9.520 0.583
301 HG3 GLU 36 HG3 GLU 36 -10.833 -10.002 0.101
302 H LYS 37 H LYS 37 -8.404 -7.738 3.023
303 HA LYS 37 HA LYS 37 -9.474 -6.633 5.563
304 HB2 LYS 37 HB2 LYS 37 -6.797 -7.914 4.895
305 HB3 LYS 37 HB3 LYS 37 -7.194 -7.118 6.434
306 HG2 LYS 37 HG2 LYS 37 -7.816 -9.224 7.022
307 HG3 LYS 37 HG3 LYS 37 -9.347 -8.699 6.301
308 HD2 LYS 37 HD2 LYS 37 -8.633 -9.777 4.147
309 HD3 LYS 37 HD3 LYS 37 -7.145 -10.335 4.955
310 HE2 LYS 37 HE2 LYS 37 -8.498 -11.566 6.610
311 HE3 LYS 37 HE3 LYS 37 -9.989 -10.972 5.853
312 HZ1 LYS 37 HZ1 LYS 37 -9.454 -13.174 5.143
313 HZ2 LYS 37 HZ2 LYS 37 -9.380 -12.140 3.866
314 HZ3 LYS 37 HZ3 LYS 37 -7.989 -12.693 4.564
315 H GLY 38 H GLY 38 -8.077 -5.618 2.623
316 HA2 GLY 38 HA2 GLY 38 -7.431 -3.506 1.966
317 HA3 GLY 38 HA3 GLY 38 -7.903 -2.908 3.573
318 H GLU 39 H GLU 39 -5.647 -5.592 3.428
319 HA GLU 39 HA GLU 39 -3.565 -3.795 4.532
320 HB2 GLU 39 HB2 GLU 39 -3.868 -6.827 4.389
321 HB3 GLU 39 HB3 GLU 39 -2.494 -5.978 5.145
322 HG2 GLU 39 HG2 GLU 39 -4.078 -4.846 6.691
323 HG3 GLU 39 HG3 GLU 39 -5.430 -5.695 5.931
324 H ALA 40 H ALA 40 -1.347 -3.989 3.769
325 HA ALA 40 HA ALA 40 -0.974 -5.150 1.094
326 HB1 ALA 40 HB1 ALA 40 -0.277 -3.120 0.076
327 HB2 ALA 40 HB2 ALA 40 -1.813 -2.746 0.856
328 HB3 ALA 40 HB3 ALA 40 -0.297 -2.234 1.629
329 H LEU 41 H LEU 41 0.893 -6.154 1.080
330 HA LEU 41 HA LEU 41 3.053 -5.353 2.979
331 HB2 LEU 41 HB2 LEU 41 2.417 -8.082 1.768
332 HB3 LEU 41 HB3 LEU 41 3.762 -7.711 2.846
333 HG LEU 41 HG LEU 41 2.170 -8.795 4.177
334 HD11 LEU 41 HD11 LEU 41 3.131 -6.756 5.210
335 HD12 LEU 41 HD12 LEU 41 1.729 -5.818 4.635
336 HD13 LEU 41 HD13 LEU 41 1.500 -7.126 5.818
337 HD21 LEU 41 HD21 LEU 41 -0.179 -8.243 4.323
338 HD22 LEU 41 HD22 LEU 41 0.014 -6.886 3.200
339 HD23 LEU 41 HD23 LEU 41 0.241 -8.555 2.624
340 H VAL 42 H VAL 42 5.218 -5.476 2.145
341 HA VAL 42 HA VAL 42 5.457 -6.011 -0.760
342 HB VAL 42 HB VAL 42 6.996 -4.102 -1.000
343 HG11 VAL 42 HG11 VAL 42 5.306 -2.488 -1.328
344 HG12 VAL 42 HG12 VAL 42 4.494 -4.049 -1.497
345 HG13 VAL 42 HG13 VAL 42 4.310 -3.127 0.012
346 HG21 VAL 42 HG21 VAL 42 5.988 -3.269 1.753
347 HG22 VAL 42 HG22 VAL 42 7.637 -3.825 1.378
348 HG23 VAL 42 HG23 VAL 42 7.029 -2.311 0.676
349 H GLU 43 H GLU 43 7.742 -6.358 -1.413
350 HA GLU 43 HA GLU 43 9.512 -7.200 0.808
351 HB2 GLU 43 HB2 GLU 43 8.308 -9.206 -0.016
352 HB3 GLU 43 HB3 GLU 43 8.878 -8.861 -1.665
353 HG2 GLU 43 HG2 GLU 43 11.229 -9.030 -0.866
354 HG3 GLU 43 HG3 GLU 43 10.638 -9.389 0.767
355 H GLY 44 H GLY 44 10.667 -5.270 0.434
356 HA2 GLY 44 HA2 GLY 44 12.496 -5.370 -1.838
357 HA3 GLY 44 HA3 GLY 44 11.376 -3.990 -1.834
358 H THR 45 H THR 45 13.652 -2.957 -1.707
359 HA THR 45 HA THR 45 14.487 -2.699 1.142
360 HB THR 45 HB THR 45 16.713 -2.109 0.184
361 HG1 THR 45 HG1 THR 45 16.999 -2.629 -2.039
362 HG21 THR 45 HG21 THR 45 15.595 -4.787 -0.750
363 HG22 THR 45 HG22 THR 45 17.312 -4.398 -0.494
364 HG23 THR 45 HG23 THR 45 16.194 -4.428 0.888
365 H ALA 46 H ALA 46 12.309 -1.205 -0.281
366 HA ALA 46 HA ALA 46 13.366 1.384 -0.997
367 HB1 ALA 46 HB1 ALA 46 10.993 2.002 -1.113
368 HB2 ALA 46 HB2 ALA 46 11.244 0.414 -1.881
369 HB3 ALA 46 HB3 ALA 46 10.540 0.513 -0.254
370 H ASP 47 H ASP 47 12.491 3.413 0.116
371 HA ASP 47 HA ASP 47 13.239 3.359 2.903
372 HB2 ASP 47 HB2 ASP 47 13.628 5.225 1.218
373 HB3 ASP 47 HB3 ASP 47 11.903 5.614 1.366
374 HA PRO 48 HA PRO 48 9.316 2.558 4.733
375 HB2 PRO 48 HB2 PRO 48 10.213 4.659 6.700
376 HB3 PRO 48 HB3 PRO 48 9.524 3.036 7.039
377 HG2 PRO 48 HG2 PRO 48 12.187 3.439 7.261
378 HG3 PRO 48 HG3 PRO 48 11.580 1.970 6.420
379 HD2 PRO 48 HD2 PRO 48 12.591 4.545 5.201
380 HD3 PRO 48 HD3 PRO 48 12.933 2.852 4.719
381 H LYS 49 H LYS 49 10.362 6.011 4.430
382 HA LYS 49 HA LYS 49 7.645 6.992 4.688
383 HB2 LYS 49 HB2 LYS 49 10.117 8.338 3.516
384 HB3 LYS 49 HB3 LYS 49 8.605 9.133 3.988
385 HG2 LYS 49 HG2 LYS 49 8.978 8.325 6.333
386 HG3 LYS 49 HG3 LYS 49 10.587 7.737 5.840
387 HD2 LYS 49 HD2 LYS 49 9.964 10.523 4.999
388 HD3 LYS 49 HD3 LYS 49 10.018 10.284 6.758
389 HE2 LYS 49 HE2 LYS 49 12.243 9.278 6.605
390 HE3 LYS 49 HE3 LYS 49 12.208 9.431 4.835
391 HZ1 LYS 49 HZ1 LYS 49 12.045 11.804 5.115
392 HZ2 LYS 49 HZ2 LYS 49 12.124 11.651 6.755
393 HZ3 LYS 49 HZ3 LYS 49 13.413 11.217 5.823
394 H ALA 50 H ALA 50 9.855 6.175 1.986
395 HA ALA 50 HA ALA 50 8.360 7.401 -0.060
396 HB1 ALA 50 HB1 ALA 50 10.661 6.552 -0.333
397 HB2 ALA 50 HB2 ALA 50 10.069 4.882 -0.159
398 HB3 ALA 50 HB3 ALA 50 9.574 5.860 -1.560
399 H LEU 51 H LEU 51 7.989 4.236 1.545
400 HA LEU 51 HA LEU 51 6.134 3.210 -0.376
401 HB2 LEU 51 HB2 LEU 51 7.565 1.981 1.429
402 HB3 LEU 51 HB3 LEU 51 6.239 2.391 2.536
403 HG LEU 51 HG LEU 51 4.675 1.350 0.752
404 HD11 LEU 51 HD11 LEU 51 5.814 -0.353 -0.698
405 HD12 LEU 51 HD12 LEU 51 6.300 1.304 -1.109
406 HD13 LEU 51 HD13 LEU 51 7.386 0.268 -0.155
407 HD21 LEU 51 HD21 LEU 51 5.347 0.280 2.927
408 HD22 LEU 51 HD22 LEU 51 5.023 -0.890 1.623
409 HD23 LEU 51 HD23 LEU 51 6.697 -0.496 2.074
410 H VAL 52 H VAL 52 5.640 4.481 2.976
411 HA VAL 52 HA VAL 52 2.809 4.351 2.817
412 HB VAL 52 HB VAL 52 4.607 6.027 4.614
413 HG11 VAL 52 HG11 VAL 52 1.748 5.016 4.940
414 HG12 VAL 52 HG12 VAL 52 2.702 5.821 6.208
415 HG13 VAL 52 HG13 VAL 52 2.248 6.713 4.741
416 HG21 VAL 52 HG21 VAL 52 4.411 4.116 6.171
417 HG22 VAL 52 HG22 VAL 52 3.496 3.208 4.945
418 HG23 VAL 52 HG23 VAL 52 5.202 3.625 4.658
419 H GLN 53 H GLN 53 5.093 6.759 1.628
420 HA GLN 53 HA GLN 53 3.036 8.843 1.608
421 HB2 GLN 53 HB2 GLN 53 5.438 9.331 2.044
422 HB3 GLN 53 HB3 GLN 53 5.823 8.813 0.387
423 HG2 GLN 53 HG2 GLN 53 4.296 10.562 -0.495
424 HG3 GLN 53 HG3 GLN 53 3.909 11.058 1.164
425 HE21 GLN 53 HE21 GLN 53 6.666 13.191 -0.451
426 HE22 GLN 53 HE22 GLN 53 5.138 12.608 -1.072
427 H ALA 54 H ALA 54 4.491 6.488 -0.655
428 HA ALA 54 HA ALA 54 3.569 7.693 -3.040
429 HB1 ALA 54 HB1 ALA 54 3.481 4.766 -3.069
430 HB2 ALA 54 HB2 ALA 54 4.475 5.883 -4.012
431 HB3 ALA 54 HB3 ALA 54 4.999 5.408 -2.381
432 H VAL 55 H VAL 55 1.982 5.351 -0.802
433 HA VAL 55 HA VAL 55 -0.345 5.051 -2.470
434 HB VAL 55 HB VAL 55 -1.352 4.057 -0.460
435 HG11 VAL 55 HG11 VAL 55 1.382 2.911 -0.352
436 HG12 VAL 55 HG12 VAL 55 -0.169 2.139 -0.683
437 HG13 VAL 55 HG13 VAL 55 0.647 3.038 -1.983
438 HG21 VAL 55 HG21 VAL 55 -0.370 5.546 1.263
439 HG22 VAL 55 HG22 VAL 55 -0.046 3.837 1.621
440 HG23 VAL 55 HG23 VAL 55 1.239 4.857 0.933
441 H GLU 56 H GLU 56 0.686 7.401 -0.034
442 HA GLU 56 HA GLU 56 -1.956 8.553 0.273
443 HB2 GLU 56 HB2 GLU 56 -0.198 8.686 2.003
444 HB3 GLU 56 HB3 GLU 56 0.810 9.652 0.908
445 HG2 GLU 56 HG2 GLU 56 -0.905 11.424 0.872
446 HG3 GLU 56 HG3 GLU 56 -1.967 10.432 1.895
447 H GLU 57 H GLU 57 0.672 8.832 -2.049
448 HA GLU 57 HA GLU 57 -0.027 11.435 -3.041
449 HB2 GLU 57 HB2 GLU 57 2.146 10.220 -3.368
450 HB3 GLU 57 HB3 GLU 57 1.300 9.087 -4.444
451 HG2 GLU 57 HG2 GLU 57 0.674 10.960 -5.931
452 HG3 GLU 57 HG3 GLU 57 1.506 12.097 -4.847
453 H GLU 58 H GLU 58 -1.290 8.189 -3.387
454 HA GLU 58 HA GLU 58 -2.997 8.898 -5.687
455 HB2 GLU 58 HB2 GLU 58 -2.677 6.382 -4.004
456 HB3 GLU 58 HB3 GLU 58 -3.794 6.530 -5.375
457 HG2 GLU 58 HG2 GLU 58 -0.785 6.960 -5.510
458 HG3 GLU 58 HG3 GLU 58 -1.606 5.461 -5.983
459 H GLY 59 H GLY 59 -2.984 9.310 -2.320
460 HA2 GLY 59 HA2 GLY 59 -4.687 10.455 -1.177
461 HA3 GLY 59 HA3 GLY 59 -5.885 9.861 -2.342
462 H TYR 60 H TYR 60 -3.985 7.208 -1.575
463 HA TYR 60 HA TYR 60 -5.961 6.408 0.495
464 HB2 TYR 60 HB2 TYR 60 -4.261 4.758 -1.398
465 HB3 TYR 60 HB3 TYR 60 -5.390 4.108 -0.200
466 HD1 TYR 60 HD1 TYR 60 -5.016 5.440 -3.537
467 HD2 TYR 60 HD2 TYR 60 -7.850 4.621 -0.413
468 HE1 TYR 60 HE1 TYR 60 -6.862 5.579 -5.186
469 HE2 TYR 60 HE2 TYR 60 -9.708 4.769 -2.047
470 HH TYR 60 HH TYR 60 -10.298 5.205 -4.238
471 H LYS 61 H LYS 61 -4.939 7.225 2.321
472 HA LYS 61 HA LYS 61 -2.181 6.689 2.935
473 HB2 LYS 61 HB2 LYS 61 -4.560 7.338 4.731
474 HB3 LYS 61 HB3 LYS 61 -2.851 7.382 5.224
475 HG2 LYS 61 HG2 LYS 61 -2.381 9.093 3.519
476 HG3 LYS 61 HG3 LYS 61 -4.072 9.046 2.975
477 HD2 LYS 61 HD2 LYS 61 -4.822 9.822 5.194
478 HD3 LYS 61 HD3 LYS 61 -3.135 9.844 5.762
479 HE2 LYS 61 HE2 LYS 61 -2.569 11.485 3.990
480 HE3 LYS 61 HE3 LYS 61 -4.259 11.474 3.444
481 HZ1 LYS 61 HZ1 LYS 61 -3.801 13.310 4.893
482 HZ2 LYS 61 HZ2 LYS 61 -4.893 12.293 5.595
483 HZ3 LYS 61 HZ3 LYS 61 -3.322 12.298 6.103
484 H ALA 62 H ALA 62 -1.485 5.288 4.790
485 HA ALA 62 HA ALA 62 -3.204 2.989 5.395
486 HB1 ALA 62 HB1 ALA 62 -2.273 2.417 3.191
487 HB2 ALA 62 HB2 ALA 62 -0.626 2.674 3.804
488 HB3 ALA 62 HB3 ALA 62 -1.628 1.354 4.461
489 H GLU 63 H GLU 63 -2.955 2.848 7.569
490 HA GLU 63 HA GLU 63 -0.604 3.821 8.888
491 HB2 GLU 63 HB2 GLU 63 -2.906 3.808 9.845
492 HB3 GLU 63 HB3 GLU 63 -2.835 2.031 9.918
493 HG2 GLU 63 HG2 GLU 63 -0.860 2.169 11.391
494 HG3 GLU 63 HG3 GLU 63 -0.914 3.944 11.323
495 H VAL 64 H VAL 64 1.343 2.786 8.662
496 HA VAL 64 HA VAL 64 1.687 0.009 8.246
497 HB VAL 64 HB VAL 64 4.018 0.481 9.092
498 HG11 VAL 64 HG11 VAL 64 2.765 2.302 7.003
499 HG12 VAL 64 HG12 VAL 64 4.526 2.146 7.255
500 HG13 VAL 64 HG13 VAL 64 3.566 0.740 6.752
501 HG21 VAL 64 HG21 VAL 64 2.913 3.307 9.421
502 HG22 VAL 64 HG22 VAL 64 3.502 2.254 10.730
503 HG23 VAL 64 HG23 VAL 64 4.627 2.845 9.494
504 H LEU 65 H LEU 65 1.199 -1.639 9.595
505 HA LEU 65 HA LEU 65 0.637 -1.073 12.411
506 HB2 LEU 65 HB2 LEU 65 0.685 -3.656 10.802
507 HB3 LEU 65 HB3 LEU 65 0.111 -3.508 12.474
508 HG LEU 65 HG LEU 65 -1.068 -2.046 10.070
509 HD11 LEU 65 HD11 LEU 65 -2.092 -4.411 11.698
510 HD12 LEU 65 HD12 LEU 65 -2.974 -3.588 10.390
511 HD13 LEU 65 HD13 LEU 65 -1.481 -4.483 10.028
512 HD21 LEU 65 HD21 LEU 65 -2.894 -1.488 11.663
513 HD22 LEU 65 HD22 LEU 65 -1.970 -2.252 12.978
514 HD23 LEU 65 HD23 LEU 65 -1.345 -0.789 12.176
515 H ALA 66 H ALA 66 2.903 -0.236 12.716
516 HA ALA 66 HA ALA 66 4.599 -2.419 13.723
517 HB1 ALA 66 HB1 ALA 66 5.395 -2.058 11.414
518 HB2 ALA 66 HB2 ALA 66 5.568 -0.318 11.739
519 HB3 ALA 66 HB3 ALA 66 6.597 -1.490 12.596
Start of MODEL 10
1 H1 MET 1 H MET 1 9.182 -4.274 9.764
2 HA MET 1 HA MET 1 9.547 -3.966 6.843
3 HB2 MET 1 HB2 MET 1 9.558 -6.334 7.668
4 HB3 MET 1 HB3 MET 1 7.908 -6.086 8.280
5 HG2 MET 1 HG2 MET 1 7.154 -5.524 5.984
6 HG3 MET 1 HG3 MET 1 8.816 -5.702 5.406
7 HE1 MET 1 HE1 MET 1 6.126 -8.930 7.125
8 HE2 MET 1 HE2 MET 1 5.989 -7.168 7.240
9 HE3 MET 1 HE3 MET 1 5.402 -7.999 5.780
10 H LEU 2 H LEU 2 7.687 -3.333 5.632
11 HA LEU 2 HA LEU 2 5.890 -1.627 7.206
12 HB2 LEU 2 HB2 LEU 2 6.240 -2.013 4.205
13 HB3 LEU 2 HB3 LEU 2 5.283 -0.734 4.983
14 HG LEU 2 HG LEU 2 8.279 -1.161 5.394
15 HD11 LEU 2 HD11 LEU 2 7.759 -0.437 3.096
16 HD12 LEU 2 HD12 LEU 2 6.785 0.910 3.739
17 HD13 LEU 2 HD13 LEU 2 8.543 0.864 4.016
18 HD21 LEU 2 HD21 LEU 2 6.409 1.108 6.199
19 HD22 LEU 2 HD22 LEU 2 7.144 -0.075 7.309
20 HD23 LEU 2 HD23 LEU 2 8.172 1.079 6.437
21 H LYS 3 H LYS 3 3.572 -1.656 6.925
22 HA LYS 3 HA LYS 3 2.350 -4.103 5.848
23 HB2 LYS 3 HB2 LYS 3 3.181 -3.896 8.580
24 HB3 LYS 3 HB3 LYS 3 1.410 -3.736 8.556
25 HG2 LYS 3 HG2 LYS 3 1.191 -5.801 7.280
26 HG3 LYS 3 HG3 LYS 3 2.961 -5.927 7.132
27 HD2 LYS 3 HD2 LYS 3 3.148 -6.103 9.599
28 HD3 LYS 3 HD3 LYS 3 1.371 -6.065 9.727
29 HE2 LYS 3 HE2 LYS 3 1.209 -8.102 8.364
30 HE3 LYS 3 HE3 LYS 3 2.965 -8.100 8.111
31 HZ1 LYS 3 HZ1 LYS 3 3.246 -8.399 10.460
32 HZ2 LYS 3 HZ2 LYS 3 1.615 -8.424 10.699
33 HZ3 LYS 3 HZ3 LYS 3 2.341 -9.615 9.820
34 H LEU 4 H LEU 4 1.434 -2.443 4.440
35 HA LEU 4 HA LEU 4 0.331 -0.051 5.672
36 HB2 LEU 4 HB2 LEU 4 0.834 -1.123 2.919
37 HB3 LEU 4 HB3 LEU 4 -0.444 0.094 3.098
38 HG LEU 4 HG LEU 4 1.136 1.594 4.287
39 HD11 LEU 4 HD11 LEU 4 3.162 -0.564 3.568
40 HD12 LEU 4 HD12 LEU 4 3.556 1.045 4.224
41 HD13 LEU 4 HD13 LEU 4 2.642 -0.118 5.209
42 HD21 LEU 4 HD21 LEU 4 0.829 1.771 1.836
43 HD22 LEU 4 HD22 LEU 4 2.495 2.177 2.307
44 HD23 LEU 4 HD23 LEU 4 2.135 0.589 1.588
45 H LYS 5 H LYS 5 -1.428 -0.406 6.889
46 HA LYS 5 HA LYS 5 -3.726 -1.914 5.826
47 HB2 LYS 5 HB2 LYS 5 -3.062 -2.084 8.229
48 HB3 LYS 5 HB3 LYS 5 -3.318 -0.334 8.395
49 HG2 LYS 5 HG2 LYS 5 -5.715 -0.746 7.579
50 HG3 LYS 5 HG3 LYS 5 -5.398 -2.480 7.826
51 HD2 LYS 5 HD2 LYS 5 -4.811 -2.024 10.189
52 HD3 LYS 5 HD3 LYS 5 -5.063 -0.285 9.923
53 HE2 LYS 5 HE2 LYS 5 -7.432 -0.715 9.359
54 HE3 LYS 5 HE3 LYS 5 -7.185 -2.451 9.637
55 HZ1 LYS 5 HZ1 LYS 5 -6.808 -0.339 11.643
56 HZ2 LYS 5 HZ2 LYS 5 -8.121 -1.327 11.542
57 HZ3 LYS 5 HZ3 LYS 5 -6.638 -1.959 11.899
58 H VAL 6 H VAL 6 -4.575 -0.762 4.128
59 HA VAL 6 HA VAL 6 -4.512 2.057 3.905
60 HB VAL 6 HB VAL 6 -6.383 0.066 2.559
61 HG11 VAL 6 HG11 VAL 6 -5.343 2.816 1.741
62 HG12 VAL 6 HG12 VAL 6 -6.361 1.754 0.741
63 HG13 VAL 6 HG13 VAL 6 -7.010 2.444 2.245
64 HG21 VAL 6 HG21 VAL 6 -4.651 0.021 0.783
65 HG22 VAL 6 HG22 VAL 6 -3.606 1.055 1.784
66 HG23 VAL 6 HG23 VAL 6 -4.004 -0.594 2.320
67 H GLU 7 H GLU 7 -5.823 3.639 4.553
68 HA GLU 7 HA GLU 7 -7.991 3.028 6.410
69 HB2 GLU 7 HB2 GLU 7 -6.303 4.826 6.785
70 HB3 GLU 7 HB3 GLU 7 -6.893 5.664 5.339
71 HG2 GLU 7 HG2 GLU 7 -7.880 6.631 7.359
72 HG3 GLU 7 HG3 GLU 7 -9.133 5.864 6.367
73 H GLY 8 H GLY 8 -10.196 3.642 6.097
74 HA2 GLY 8 HA2 GLY 8 -11.009 3.708 3.261
75 HA3 GLY 8 HA3 GLY 8 -12.049 3.396 4.667
76 H MET 9 H MET 9 -10.161 5.971 3.011
77 HA MET 9 HA MET 9 -11.265 8.112 4.550
78 HB2 MET 9 HB2 MET 9 -9.973 8.051 1.804
79 HB3 MET 9 HB3 MET 9 -10.277 9.531 2.738
80 HG2 MET 9 HG2 MET 9 -8.793 7.314 4.111
81 HG3 MET 9 HG3 MET 9 -7.955 8.160 2.807
82 HE1 MET 9 HE1 MET 9 -6.022 8.880 4.388
83 HE2 MET 9 HE2 MET 9 -6.270 9.683 5.956
84 HE3 MET 9 HE3 MET 9 -6.830 8.011 5.714
85 H THR 10 H THR 10 -11.725 7.679 0.995
86 HA THR 10 HA THR 10 -14.614 8.244 1.355
87 HB THR 10 HB THR 10 -14.476 9.896 -0.500
88 HG1 THR 10 HG1 THR 10 -12.619 9.418 -1.535
89 HG21 THR 10 HG21 THR 10 -14.417 10.631 1.874
90 HG22 THR 10 HG22 THR 10 -12.640 10.526 1.850
91 HG23 THR 10 HG23 THR 10 -13.474 11.707 0.817
92 H CYS 11 H CYS 11 -15.783 7.974 -0.824
93 HA CYS 11 HA CYS 11 -16.460 6.456 -2.381
94 HB2 CYS 11 HB2 CYS 11 -13.547 6.751 -3.194
95 HB3 CYS 11 HB3 CYS 11 -14.838 6.072 -4.214
96 HG CYS 11 HG CYS 11 -16.399 8.135 -4.116
97 H ASN 12 H ASN 12 -15.787 5.315 0.136
98 HA ASN 12 HA ASN 12 -14.152 3.001 -0.079
99 HB2 ASN 12 HB2 ASN 12 -15.289 2.353 2.006
100 HB3 ASN 12 HB3 ASN 12 -14.820 4.064 2.044
101 HD21 ASN 12 HD21 ASN 12 -18.653 3.057 2.687
102 HD22 ASN 12 HD22 ASN 12 -17.300 1.951 2.767
103 H HIS 13 H HIS 13 -17.022 3.699 -1.688
104 HA HIS 13 HA HIS 13 -18.164 1.001 -1.570
105 HB2 HIS 13 HB2 HIS 13 -18.846 3.443 -3.246
106 HB3 HIS 13 HB3 HIS 13 -19.784 1.943 -3.184
107 HD1 HIS 13 HD1 HIS 13 -19.209 5.140 -1.218
108 HD2 HIS 13 HD2 HIS 13 -21.053 1.375 -0.806
109 HE1 HIS 13 HE1 HIS 13 -20.753 5.297 0.806
110 H CYS 14 H CYS 14 -15.538 2.447 -3.145
111 HA CYS 14 HA CYS 14 -15.865 0.653 -5.507
112 HB2 CYS 14 HB2 CYS 14 -14.227 3.206 -5.222
113 HB3 CYS 14 HB3 CYS 14 -14.407 2.229 -6.696
114 HG CYS 14 HG CYS 14 -15.805 4.426 -6.878
115 H VAL 15 H VAL 15 -13.631 0.025 -6.440
116 HA VAL 15 HA VAL 15 -11.476 -0.155 -4.486
117 HB VAL 15 HB VAL 15 -12.943 -2.056 -3.870
118 HG11 VAL 15 HG11 VAL 15 -13.253 -3.923 -5.450
119 HG12 VAL 15 HG12 VAL 15 -13.994 -2.433 -6.075
120 HG13 VAL 15 HG13 VAL 15 -12.433 -2.995 -6.724
121 HG21 VAL 15 HG21 VAL 15 -11.245 -3.811 -3.994
122 HG22 VAL 15 HG22 VAL 15 -10.396 -2.937 -5.288
123 HG23 VAL 15 HG23 VAL 15 -10.480 -2.244 -3.650
124 H MET 16 H MET 16 -9.480 -0.721 -5.493
125 HA MET 16 HA MET 16 -9.453 -1.262 -8.384
126 HB2 MET 16 HB2 MET 16 -8.227 1.227 -7.122
127 HB3 MET 16 HB3 MET 16 -7.913 0.661 -8.777
128 HG2 MET 16 HG2 MET 16 -10.353 0.818 -9.256
129 HG3 MET 16 HG3 MET 16 -10.607 1.498 -7.643
130 HE1 MET 16 HE1 MET 16 -8.712 4.915 -7.840
131 HE2 MET 16 HE2 MET 16 -9.699 3.826 -6.838
132 HE3 MET 16 HE3 MET 16 -8.043 3.361 -7.293
133 H ALA 17 H ALA 17 -7.189 -1.715 -9.115
134 HA ALA 17 HA ALA 17 -5.818 -3.378 -7.202
135 HB1 ALA 17 HB1 ALA 17 -5.875 -3.885 -9.613
136 HB2 ALA 17 HB2 ALA 17 -5.007 -2.371 -9.961
137 HB3 ALA 17 HB3 ALA 17 -4.199 -3.672 -9.054
138 H VAL 18 H VAL 18 -5.218 -2.049 -5.448
139 HA VAL 18 HA VAL 18 -3.854 0.432 -5.756
140 HB VAL 18 HB VAL 18 -3.724 -1.474 -3.392
141 HG11 VAL 18 HG11 VAL 18 -2.512 0.953 -3.740
142 HG12 VAL 18 HG12 VAL 18 -4.066 1.470 -3.101
143 HG13 VAL 18 HG13 VAL 18 -3.073 0.341 -2.152
144 HG21 VAL 18 HG21 VAL 18 -5.792 0.275 -2.846
145 HG22 VAL 18 HG22 VAL 18 -6.026 -0.026 -4.565
146 HG23 VAL 18 HG23 VAL 18 -6.005 -1.403 -3.439
147 H THR 19 H THR 19 -2.829 -2.839 -6.146
148 HA THR 19 HA THR 19 -0.255 -2.903 -5.192
149 HB THR 19 HB THR 19 -1.248 -4.042 -7.831
150 HG1 THR 19 HG1 THR 19 -1.736 -5.836 -6.440
151 HG21 THR 19 HG21 THR 19 0.406 -5.822 -7.357
152 HG22 THR 19 HG22 THR 19 1.199 -4.238 -7.500
153 HG23 THR 19 HG23 THR 19 0.922 -4.954 -5.894
154 H LYS 20 H LYS 20 -1.417 -1.347 -8.197
155 HA LYS 20 HA LYS 20 1.119 -0.972 -9.393
156 HB2 LYS 20 HB2 LYS 20 -1.413 0.703 -9.611
157 HB3 LYS 20 HB3 LYS 20 -0.048 0.726 -10.749
158 HG2 LYS 20 HG2 LYS 20 -0.419 -1.671 -11.247
159 HG3 LYS 20 HG3 LYS 20 -1.794 -1.693 -10.116
160 HD2 LYS 20 HD2 LYS 20 -2.930 0.046 -11.466
161 HD3 LYS 20 HD3 LYS 20 -1.562 0.053 -12.604
162 HE2 LYS 20 HE2 LYS 20 -1.955 -2.350 -13.075
163 HE3 LYS 20 HE3 LYS 20 -3.328 -2.343 -11.952
164 HZ1 LYS 20 HZ1 LYS 20 -4.032 -2.084 -14.209
165 HZ2 LYS 20 HZ2 LYS 20 -4.385 -0.723 -13.352
166 HZ3 LYS 20 HZ3 LYS 20 -3.108 -0.731 -14.399
167 H ALA 21 H ALA 21 -0.379 0.707 -6.683
168 HA ALA 21 HA ALA 21 1.266 3.096 -7.060
169 HB1 ALA 21 HB1 ALA 21 -0.480 2.178 -4.739
170 HB2 ALA 21 HB2 ALA 21 0.227 3.798 -4.939
171 HB3 ALA 21 HB3 ALA 21 -1.000 3.215 -6.089
172 H LEU 22 H LEU 22 1.473 0.008 -5.344
173 HA LEU 22 HA LEU 22 3.454 0.932 -3.433
174 HB2 LEU 22 HB2 LEU 22 2.470 -1.797 -4.367
175 HB3 LEU 22 HB3 LEU 22 3.776 -1.607 -3.193
176 HG LEU 22 HG LEU 22 1.751 -2.011 -1.997
177 HD11 LEU 22 HD11 LEU 22 3.379 -0.309 -1.099
178 HD12 LEU 22 HD12 LEU 22 2.324 0.961 -1.749
179 HD13 LEU 22 HD13 LEU 22 1.711 -0.137 -0.493
180 HD21 LEU 22 HD21 LEU 22 0.148 -1.249 -3.722
181 HD22 LEU 22 HD22 LEU 22 -0.213 -0.579 -2.116
182 HD23 LEU 22 HD23 LEU 22 0.561 0.443 -3.344
183 H LYS 23 H LYS 23 3.474 -0.639 -6.630
184 HA LYS 23 HA LYS 23 6.180 -1.458 -6.576
185 HB2 LYS 23 HB2 LYS 23 4.300 -2.259 -8.062
186 HB3 LYS 23 HB3 LYS 23 4.522 -0.786 -9.032
187 HG2 LYS 23 HG2 LYS 23 6.857 -1.424 -9.485
188 HG3 LYS 23 HG3 LYS 23 6.701 -2.835 -8.413
189 HD2 LYS 23 HD2 LYS 23 4.953 -3.771 -9.878
190 HD3 LYS 23 HD3 LYS 23 5.078 -2.354 -10.949
191 HE2 LYS 23 HE2 LYS 23 7.445 -2.908 -11.419
192 HE3 LYS 23 HE3 LYS 23 7.340 -4.272 -10.290
193 HZ1 LYS 23 HZ1 LYS 23 5.413 -4.956 -11.807
194 HZ2 LYS 23 HZ2 LYS 23 6.132 -3.988 -12.911
195 HZ3 LYS 23 HZ3 LYS 23 6.975 -5.260 -12.280
196 H LYS 24 H LYS 24 4.800 1.735 -7.192
197 HA LYS 24 HA LYS 24 6.890 2.657 -8.906
198 HB2 LYS 24 HB2 LYS 24 5.023 4.148 -7.020
199 HB3 LYS 24 HB3 LYS 24 6.083 4.922 -8.216
200 HG2 LYS 24 HG2 LYS 24 4.967 3.649 -10.030
201 HG3 LYS 24 HG3 LYS 24 3.859 2.935 -8.832
202 HD2 LYS 24 HD2 LYS 24 3.070 5.183 -8.204
203 HD3 LYS 24 HD3 LYS 24 4.213 5.920 -9.348
204 HE2 LYS 24 HE2 LYS 24 3.093 4.770 -11.222
205 HE3 LYS 24 HE3 LYS 24 1.960 4.011 -10.085
206 HZ1 LYS 24 HZ1 LYS 24 2.258 6.900 -10.530
207 HZ2 LYS 24 HZ2 LYS 24 1.025 5.961 -11.095
208 HZ3 LYS 24 HZ3 LYS 24 1.208 6.199 -9.475
209 H VAL 25 H VAL 25 6.887 2.037 -5.461
210 HA VAL 25 HA VAL 25 8.854 4.082 -4.854
211 HB VAL 25 HB VAL 25 7.728 1.701 -3.347
212 HG11 VAL 25 HG11 VAL 25 8.819 2.670 -1.349
213 HG12 VAL 25 HG12 VAL 25 10.016 2.141 -2.553
214 HG13 VAL 25 HG13 VAL 25 9.634 3.870 -2.379
215 HG21 VAL 25 HG21 VAL 25 6.618 3.519 -2.063
216 HG22 VAL 25 HG22 VAL 25 7.367 4.722 -3.134
217 HG23 VAL 25 HG23 VAL 25 6.180 3.565 -3.785
218 HA PRO 26 HA PRO 26 12.386 1.863 -6.376
219 HB2 PRO 26 HB2 PRO 26 13.718 3.506 -4.227
220 HB3 PRO 26 HB3 PRO 26 14.219 3.274 -5.934
221 HG2 PRO 26 HG2 PRO 26 12.992 5.569 -5.175
222 HG3 PRO 26 HG3 PRO 26 12.521 4.760 -6.708
223 HD2 PRO 26 HD2 PRO 26 11.122 4.666 -4.030
224 HD3 PRO 26 HD3 PRO 26 10.422 4.848 -5.671
225 H GLY 27 H GLY 27 13.390 -0.032 -5.758
226 HA2 GLY 27 HA2 GLY 27 14.522 -1.452 -4.264
227 HA3 GLY 27 HA3 GLY 27 13.830 -0.566 -2.892
228 H VAL 28 H VAL 28 11.095 -0.718 -4.368
229 HA VAL 28 HA VAL 28 10.230 -3.180 -3.077
230 HB VAL 28 HB VAL 28 8.830 -1.157 -4.876
231 HG11 VAL 28 HG11 VAL 28 7.772 -3.360 -5.135
232 HG12 VAL 28 HG12 VAL 28 7.677 -3.535 -3.366
233 HG13 VAL 28 HG13 VAL 28 6.730 -2.276 -4.190
234 HG21 VAL 28 HG21 VAL 28 8.685 -1.733 -1.886
235 HG22 VAL 28 HG22 VAL 28 9.482 -0.332 -2.641
236 HG23 VAL 28 HG23 VAL 28 7.717 -0.518 -2.753
237 H GLU 29 H GLU 29 10.187 -5.214 -4.033
238 HA GLU 29 HA GLU 29 10.306 -5.261 -7.013
239 HB2 GLU 29 HB2 GLU 29 12.459 -5.839 -5.990
240 HB3 GLU 29 HB3 GLU 29 11.676 -7.121 -5.034
241 HG2 GLU 29 HG2 GLU 29 11.013 -8.279 -7.099
242 HG3 GLU 29 HG3 GLU 29 11.634 -6.940 -8.073
243 H LYS 30 H LYS 30 8.880 -6.556 -4.041
244 HA LYS 30 HA LYS 30 6.912 -7.948 -5.776
245 HB2 LYS 30 HB2 LYS 30 8.207 -9.052 -3.253
246 HB3 LYS 30 HB3 LYS 30 6.805 -9.770 -4.073
247 HG2 LYS 30 HG2 LYS 30 8.136 -10.041 -6.139
248 HG3 LYS 30 HG3 LYS 30 9.553 -9.341 -5.325
249 HD2 LYS 30 HD2 LYS 30 9.538 -11.181 -3.685
250 HD3 LYS 30 HD3 LYS 30 8.080 -11.862 -4.449
251 HE2 LYS 30 HE2 LYS 30 9.311 -12.145 -6.568
252 HE3 LYS 30 HE3 LYS 30 10.767 -11.454 -5.825
253 HZ1 LYS 30 HZ1 LYS 30 10.771 -13.267 -4.281
254 HZ2 LYS 30 HZ2 LYS 30 9.409 -13.910 -4.948
255 HZ3 LYS 30 HZ3 LYS 30 10.804 -13.842 -5.825
256 H VAL 31 H VAL 31 4.784 -8.016 -4.944
257 HA VAL 31 HA VAL 31 4.260 -6.487 -2.476
258 HB VAL 31 HB VAL 31 3.090 -5.822 -5.213
259 HG11 VAL 31 HG11 VAL 31 2.611 -4.587 -2.468
260 HG12 VAL 31 HG12 VAL 31 1.979 -3.963 -4.010
261 HG13 VAL 31 HG13 VAL 31 1.443 -5.545 -3.409
262 HG21 VAL 31 HG21 VAL 31 4.193 -3.628 -4.890
263 HG22 VAL 31 HG22 VAL 31 4.946 -4.229 -3.395
264 HG23 VAL 31 HG23 VAL 31 5.377 -4.947 -4.965
265 H GLU 32 H GLU 32 2.237 -7.003 -1.539
266 HA GLU 32 HA GLU 32 0.475 -8.904 -2.939
267 HB2 GLU 32 HB2 GLU 32 2.196 -10.277 -1.737
268 HB3 GLU 32 HB3 GLU 32 1.737 -9.460 -0.229
269 HG2 GLU 32 HG2 GLU 32 0.218 -11.098 0.038
270 HG3 GLU 32 HG3 GLU 32 -0.718 -10.299 -1.238
271 H VAL 33 H VAL 33 -1.637 -8.292 -2.521
272 HA VAL 33 HA VAL 33 -2.078 -6.697 -0.047
273 HB VAL 33 HB VAL 33 -3.487 -5.160 -1.293
274 HG11 VAL 33 HG11 VAL 33 -0.823 -5.541 -2.725
275 HG12 VAL 33 HG12 VAL 33 -1.778 -4.044 -2.646
276 HG13 VAL 33 HG13 VAL 33 -1.038 -4.705 -1.171
277 HG21 VAL 33 HG21 VAL 33 -2.714 -6.796 -3.746
278 HG22 VAL 33 HG22 VAL 33 -4.333 -6.710 -3.008
279 HG23 VAL 33 HG23 VAL 33 -3.623 -5.267 -3.762
280 H SER 34 H SER 34 -4.225 -6.714 0.771
281 HA SER 34 HA SER 34 -5.986 -8.870 -0.275
282 HB2 SER 34 HB2 SER 34 -4.760 -9.675 1.717
283 HB3 SER 34 HB3 SER 34 -5.339 -8.270 2.641
284 HG SER 34 HG SER 34 -6.591 -10.238 2.872
285 H LEU 35 H LEU 35 -7.490 -7.591 -1.234
286 HA LEU 35 HA LEU 35 -8.155 -4.975 -0.388
287 HB2 LEU 35 HB2 LEU 35 -9.699 -6.947 -2.116
288 HB3 LEU 35 HB3 LEU 35 -9.985 -5.198 -2.045
289 HG LEU 35 HG LEU 35 -7.351 -6.490 -2.885
290 HD11 LEU 35 HD11 LEU 35 -7.998 -5.791 -5.165
291 HD12 LEU 35 HD12 LEU 35 -9.162 -6.956 -4.492
292 HD13 LEU 35 HD13 LEU 35 -9.568 -5.224 -4.546
293 HD21 LEU 35 HD21 LEU 35 -6.840 -4.195 -3.703
294 HD22 LEU 35 HD22 LEU 35 -8.375 -3.619 -3.012
295 HD23 LEU 35 HD23 LEU 35 -7.086 -4.223 -1.944
296 H GLU 36 H GLU 36 -9.264 -8.069 0.831
297 HA GLU 36 HA GLU 36 -11.811 -6.981 1.717
298 HB2 GLU 36 HB2 GLU 36 -10.363 -9.579 2.340
299 HB3 GLU 36 HB3 GLU 36 -12.020 -9.180 2.855
300 HG2 GLU 36 HG2 GLU 36 -12.672 -8.833 0.490
301 HG3 GLU 36 HG3 GLU 36 -11.048 -9.308 -0.036
302 H LYS 37 H LYS 37 -8.550 -7.335 3.065
303 HA LYS 37 HA LYS 37 -9.580 -6.276 5.644
304 HB2 LYS 37 HB2 LYS 37 -6.990 -7.736 5.008
305 HB3 LYS 37 HB3 LYS 37 -7.335 -6.898 6.536
306 HG2 LYS 37 HG2 LYS 37 -8.133 -8.930 7.151
307 HG3 LYS 37 HG3 LYS 37 -9.605 -8.313 6.384
308 HD2 LYS 37 HD2 LYS 37 -8.934 -9.490 4.272
309 HD3 LYS 37 HD3 LYS 37 -7.499 -10.124 5.119
310 HE2 LYS 37 HE2 LYS 37 -8.991 -11.181 6.808
311 HE3 LYS 37 HE3 LYS 37 -10.405 -10.575 5.924
312 HZ1 LYS 37 HZ1 LYS 37 -9.942 -12.825 5.361
313 HZ2 LYS 37 HZ2 LYS 37 -9.684 -11.877 4.039
314 HZ3 LYS 37 HZ3 LYS 37 -8.403 -12.463 4.900
315 H GLY 38 H GLY 38 -8.195 -5.272 2.730
316 HA2 GLY 38 HA2 GLY 38 -7.431 -3.201 2.109
317 HA3 GLY 38 HA3 GLY 38 -7.799 -2.619 3.745
318 H GLU 39 H GLU 39 -5.668 -5.413 3.347
319 HA GLU 39 HA GLU 39 -3.479 -3.746 4.468
320 HB2 GLU 39 HB2 GLU 39 -3.864 -6.756 4.202
321 HB3 GLU 39 HB3 GLU 39 -2.469 -5.966 4.972
322 HG2 GLU 39 HG2 GLU 39 -3.960 -4.903 6.622
323 HG3 GLU 39 HG3 GLU 39 -5.371 -5.642 5.842
324 H ALA 40 H ALA 40 -1.341 -3.912 3.637
325 HA ALA 40 HA ALA 40 -1.017 -5.035 0.941
326 HB1 ALA 40 HB1 ALA 40 -0.381 -2.975 -0.065
327 HB2 ALA 40 HB2 ALA 40 -1.890 -2.643 0.793
328 HB3 ALA 40 HB3 ALA 40 -0.347 -2.126 1.510
329 H LEU 41 H LEU 41 0.704 -6.295 1.196
330 HA LEU 41 HA LEU 41 2.922 -5.453 2.991
331 HB2 LEU 41 HB2 LEU 41 2.257 -8.112 1.641
332 HB3 LEU 41 HB3 LEU 41 3.672 -7.804 2.650
333 HG LEU 41 HG LEU 41 2.136 -8.925 4.027
334 HD11 LEU 41 HD11 LEU 41 3.232 -6.938 5.060
335 HD12 LEU 41 HD12 LEU 41 1.793 -5.966 4.661
336 HD13 LEU 41 HD13 LEU 41 1.662 -7.329 5.797
337 HD21 LEU 41 HD21 LEU 41 -0.179 -8.341 4.340
338 HD22 LEU 41 HD22 LEU 41 -0.018 -6.898 3.321
339 HD23 LEU 41 HD23 LEU 41 0.121 -8.519 2.599
340 H VAL 42 H VAL 42 5.078 -5.456 2.196
341 HA VAL 42 HA VAL 42 5.407 -5.863 -0.715
342 HB VAL 42 HB VAL 42 6.826 -3.891 -0.885
343 HG11 VAL 42 HG11 VAL 42 5.107 -2.263 -0.990
344 HG12 VAL 42 HG12 VAL 42 4.296 -3.814 -1.238
345 HG13 VAL 42 HG13 VAL 42 4.192 -3.019 0.350
346 HG21 VAL 42 HG21 VAL 42 5.961 -3.279 1.972
347 HG22 VAL 42 HG22 VAL 42 7.593 -3.781 1.468
348 HG23 VAL 42 HG23 VAL 42 6.936 -2.226 0.918
349 H GLU 43 H GLU 43 7.743 -6.185 -1.268
350 HA GLU 43 HA GLU 43 9.394 -6.941 1.067
351 HB2 GLU 43 HB2 GLU 43 8.248 -8.993 0.225
352 HB3 GLU 43 HB3 GLU 43 9.008 -8.735 -1.358
353 HG2 GLU 43 HG2 GLU 43 11.243 -8.894 -0.341
354 HG3 GLU 43 HG3 GLU 43 10.513 -9.036 1.270
355 H GLY 44 H GLY 44 10.717 -5.178 0.800
356 HA2 GLY 44 HA2 GLY 44 12.543 -5.200 -1.460
357 HA3 GLY 44 HA3 GLY 44 11.424 -3.820 -1.451
358 H THR 45 H THR 45 13.673 -2.778 -1.265
359 HA THR 45 HA THR 45 14.472 -2.588 1.603
360 HB THR 45 HB THR 45 16.664 -1.828 0.678
361 HG1 THR 45 HG1 THR 45 16.941 -2.239 -1.588
362 HG21 THR 45 HG21 THR 45 15.678 -4.500 -0.412
363 HG22 THR 45 HG22 THR 45 17.374 -4.039 -0.142
364 HG23 THR 45 HG23 THR 45 16.270 -4.214 1.242
365 H ALA 46 H ALA 46 12.217 -1.162 0.238
366 HA ALA 46 HA ALA 46 13.103 1.532 -0.299
367 HB1 ALA 46 HB1 ALA 46 10.674 1.986 -0.383
368 HB2 ALA 46 HB2 ALA 46 11.081 0.522 -1.311
369 HB3 ALA 46 HB3 ALA 46 10.346 0.378 0.302
370 H ASP 47 H ASP 47 12.052 3.408 0.908
371 HA ASP 47 HA ASP 47 12.570 3.091 3.779
372 HB2 ASP 47 HB2 ASP 47 13.464 4.969 2.309
373 HB3 ASP 47 HB3 ASP 47 11.809 5.604 2.249
374 HA PRO 48 HA PRO 48 8.375 2.772 5.028
375 HB2 PRO 48 HB2 PRO 48 9.154 4.792 7.131
376 HB3 PRO 48 HB3 PRO 48 8.271 3.243 7.340
377 HG2 PRO 48 HG2 PRO 48 10.895 3.387 7.959
378 HG3 PRO 48 HG3 PRO 48 10.282 1.981 7.021
379 HD2 PRO 48 HD2 PRO 48 11.708 4.442 6.004
380 HD3 PRO 48 HD3 PRO 48 11.957 2.725 5.554
381 H LYS 49 H LYS 49 9.723 6.134 4.930
382 HA LYS 49 HA LYS 49 7.078 7.315 4.854
383 HB2 LYS 49 HB2 LYS 49 9.837 8.424 4.204
384 HB3 LYS 49 HB3 LYS 49 8.342 9.380 4.232
385 HG2 LYS 49 HG2 LYS 49 7.977 8.673 6.606
386 HG3 LYS 49 HG3 LYS 49 9.582 7.897 6.585
387 HD2 LYS 49 HD2 LYS 49 10.641 10.049 6.050
388 HD3 LYS 49 HD3 LYS 49 9.047 10.823 5.910
389 HE2 LYS 49 HE2 LYS 49 8.597 10.314 8.298
390 HE3 LYS 49 HE3 LYS 49 10.220 9.605 8.441
391 HZ1 LYS 49 HZ1 LYS 49 11.133 11.729 7.860
392 HZ2 LYS 49 HZ2 LYS 49 9.632 12.389 7.699
393 HZ3 LYS 49 HZ3 LYS 49 10.158 11.882 9.178
394 H ALA 50 H ALA 50 9.256 5.960 2.432
395 HA ALA 50 HA ALA 50 8.163 7.503 0.242
396 HB1 ALA 50 HB1 ALA 50 10.429 6.501 0.209
397 HB2 ALA 50 HB2 ALA 50 9.711 4.875 0.278
398 HB3 ALA 50 HB3 ALA 50 9.438 5.909 -1.143
399 H LEU 51 H LEU 51 7.484 4.335 1.753
400 HA LEU 51 HA LEU 51 5.742 3.496 -0.372
401 HB2 LEU 51 HB2 LEU 51 7.057 2.089 1.377
402 HB3 LEU 51 HB3 LEU 51 5.681 2.425 2.451
403 HG LEU 51 HG LEU 51 4.181 1.562 0.544
404 HD11 LEU 51 HD11 LEU 51 5.368 0.011 -1.054
405 HD12 LEU 51 HD12 LEU 51 5.815 1.711 -1.298
406 HD13 LEU 51 HD13 LEU 51 6.919 0.614 -0.434
407 HD21 LEU 51 HD21 LEU 51 4.854 0.263 2.600
408 HD22 LEU 51 HD22 LEU 51 4.534 -0.760 1.176
409 HD23 LEU 51 HD23 LEU 51 6.206 -0.408 1.669
410 H VAL 52 H VAL 52 5.179 4.863 2.919
411 HA VAL 52 HA VAL 52 2.334 4.697 2.729
412 HB VAL 52 HB VAL 52 4.131 6.496 4.405
413 HG11 VAL 52 HG11 VAL 52 1.199 5.718 4.728
414 HG12 VAL 52 HG12 VAL 52 2.166 6.613 5.924
415 HG13 VAL 52 HG13 VAL 52 1.816 7.343 4.344
416 HG21 VAL 52 HG21 VAL 52 3.750 4.774 6.144
417 HG22 VAL 52 HG22 VAL 52 2.805 3.812 4.984
418 HG23 VAL 52 HG23 VAL 52 4.544 4.072 4.718
419 H GLN 53 H GLN 53 4.683 6.958 1.392
420 HA GLN 53 HA GLN 53 2.628 9.007 0.973
421 HB2 GLN 53 HB2 GLN 53 5.010 9.561 1.502
422 HB3 GLN 53 HB3 GLN 53 5.485 8.879 -0.074
423 HG2 GLN 53 HG2 GLN 53 4.021 10.501 -1.219
424 HG3 GLN 53 HG3 GLN 53 3.462 11.124 0.345
425 HE21 GLN 53 HE21 GLN 53 5.943 13.588 -0.688
426 HE22 GLN 53 HE22 GLN 53 4.309 13.086 -1.064
427 H ALA 54 H ALA 54 4.172 6.339 -0.778
428 HA ALA 54 HA ALA 54 3.488 7.149 -3.413
429 HB1 ALA 54 HB1 ALA 54 3.775 4.760 -3.948
430 HB2 ALA 54 HB2 ALA 54 5.076 5.347 -2.886
431 HB3 ALA 54 HB3 ALA 54 3.754 4.363 -2.212
432 H VAL 55 H VAL 55 1.747 5.168 -0.961
433 HA VAL 55 HA VAL 55 -0.533 4.702 -2.638
434 HB VAL 55 HB VAL 55 -1.597 3.971 -0.513
435 HG11 VAL 55 HG11 VAL 55 -0.052 2.104 -0.108
436 HG12 VAL 55 HG12 VAL 55 -0.156 2.461 -1.844
437 HG13 VAL 55 HG13 VAL 55 1.262 2.995 -0.910
438 HG21 VAL 55 HG21 VAL 55 -0.277 3.968 1.563
439 HG22 VAL 55 HG22 VAL 55 1.035 4.847 0.748
440 HG23 VAL 55 HG23 VAL 55 -0.542 5.632 0.999
441 H GLU 56 H GLU 56 0.530 7.448 -0.757
442 HA GLU 56 HA GLU 56 -2.071 8.600 -0.341
443 HB2 GLU 56 HB2 GLU 56 -0.007 9.262 0.901
444 HB3 GLU 56 HB3 GLU 56 0.654 9.939 -0.602
445 HG2 GLU 56 HG2 GLU 56 -1.246 11.515 -0.733
446 HG3 GLU 56 HG3 GLU 56 -1.904 10.843 0.773
447 H GLU 57 H GLU 57 0.054 8.210 -3.100
448 HA GLU 57 HA GLU 57 -0.962 10.408 -4.643
449 HB2 GLU 57 HB2 GLU 57 1.143 9.137 -5.131
450 HB3 GLU 57 HB3 GLU 57 0.145 7.743 -5.610
451 HG2 GLU 57 HG2 GLU 57 -0.944 9.142 -7.353
452 HG3 GLU 57 HG3 GLU 57 0.057 10.520 -6.865
453 H GLU 58 H GLU 58 -2.171 7.176 -3.861
454 HA GLU 58 HA GLU 58 -4.198 7.236 -5.979
455 HB2 GLU 58 HB2 GLU 58 -3.776 5.439 -3.554
456 HB3 GLU 58 HB3 GLU 58 -5.012 5.184 -4.801
457 HG2 GLU 58 HG2 GLU 58 -2.006 5.253 -5.283
458 HG3 GLU 58 HG3 GLU 58 -3.003 3.790 -5.191
459 H GLY 59 H GLY 59 -3.701 8.650 -2.904
460 HA2 GLY 59 HA2 GLY 59 -5.179 10.249 -1.986
461 HA3 GLY 59 HA3 GLY 59 -6.543 9.471 -2.818
462 H TYR 60 H TYR 60 -4.476 7.128 -1.432
463 HA TYR 60 HA TYR 60 -6.165 7.012 1.015
464 HB2 TYR 60 HB2 TYR 60 -5.539 4.772 -0.932
465 HB3 TYR 60 HB3 TYR 60 -6.340 4.564 0.631
466 HD1 TYR 60 HD1 TYR 60 -6.726 5.641 -2.839
467 HD2 TYR 60 HD2 TYR 60 -8.601 5.469 1.026
468 HE1 TYR 60 HE1 TYR 60 -8.922 6.107 -3.892
469 HE2 TYR 60 HE2 TYR 60 -10.803 5.914 -0.014
470 HH TYR 60 HH TYR 60 -11.933 6.322 -1.947
471 H LYS 61 H LYS 61 -4.674 7.474 2.548
472 HA LYS 61 HA LYS 61 -1.961 6.510 2.516
473 HB2 LYS 61 HB2 LYS 61 -3.726 7.513 4.791
474 HB3 LYS 61 HB3 LYS 61 -1.962 7.297 4.870
475 HG2 LYS 61 HG2 LYS 61 -1.653 8.932 3.060
476 HG3 LYS 61 HG3 LYS 61 -3.415 9.122 2.907
477 HD2 LYS 61 HD2 LYS 61 -3.540 9.954 5.229
478 HD3 LYS 61 HD3 LYS 61 -1.777 9.762 5.396
479 HE2 LYS 61 HE2 LYS 61 -1.425 11.344 3.534
480 HE3 LYS 61 HE3 LYS 61 -3.179 11.524 3.341
481 HZ1 LYS 61 HZ1 LYS 61 -2.241 13.300 4.612
482 HZ2 LYS 61 HZ2 LYS 61 -3.267 12.417 5.554
483 HZ3 LYS 61 HZ3 LYS 61 -1.635 12.254 5.732
484 H ALA 62 H ALA 62 -1.177 5.115 4.480
485 HA ALA 62 HA ALA 62 -3.109 3.050 5.271
486 HB1 ALA 62 HB1 ALA 62 -2.336 2.302 3.056
487 HB2 ALA 62 HB2 ALA 62 -0.647 2.448 3.588
488 HB3 ALA 62 HB3 ALA 62 -1.718 1.239 4.342
489 H GLU 63 H GLU 63 -2.764 2.708 7.359
490 HA GLU 63 HA GLU 63 -0.459 3.681 8.740
491 HB2 GLU 63 HB2 GLU 63 -2.797 3.482 9.665
492 HB3 GLU 63 HB3 GLU 63 -2.578 1.719 9.701
493 HG2 GLU 63 HG2 GLU 63 -0.525 2.079 11.131
494 HG3 GLU 63 HG3 GLU 63 -0.929 3.804 11.190
495 H VAL 64 H VAL 64 1.535 2.736 8.503
496 HA VAL 64 HA VAL 64 2.012 0.005 7.939
497 HB VAL 64 HB VAL 64 4.322 0.533 8.775
498 HG11 VAL 64 HG11 VAL 64 2.934 2.480 6.895
499 HG12 VAL 64 HG12 VAL 64 4.704 2.398 7.099
500 HG13 VAL 64 HG13 VAL 64 3.811 0.995 6.478
501 HG21 VAL 64 HG21 VAL 64 4.712 3.024 9.250
502 HG22 VAL 64 HG22 VAL 64 2.972 3.155 9.525
503 HG23 VAL 64 HG23 VAL 64 3.951 2.096 10.568
504 H LEU 65 H LEU 65 1.242 -1.633 9.193
505 HA LEU 65 HA LEU 65 1.001 -1.277 12.095
506 HB2 LEU 65 HB2 LEU 65 0.606 -3.734 10.332
507 HB3 LEU 65 HB3 LEU 65 0.209 -3.621 12.052
508 HG LEU 65 HG LEU 65 -1.037 -1.935 9.839
509 HD11 LEU 65 HD11 LEU 65 -2.131 -4.237 11.510
510 HD12 LEU 65 HD12 LEU 65 -3.052 -3.284 10.323
511 HD13 LEU 65 HD13 LEU 65 -1.707 -4.314 9.783
512 HD21 LEU 65 HD21 LEU 65 -2.621 -1.250 11.630
513 HD22 LEU 65 HD22 LEU 65 -1.651 -2.149 12.821
514 HD23 LEU 65 HD23 LEU 65 -0.963 -0.731 11.991
515 H ALA 66 H ALA 66 3.304 -0.751 12.394
516 HA ALA 66 HA ALA 66 4.935 -3.212 12.624
517 HB1 ALA 66 HB1 ALA 66 5.551 -2.116 10.485
518 HB2 ALA 66 HB2 ALA 66 5.862 -0.599 11.358
519 HB3 ALA 66 HB3 ALA 66 6.874 -2.029 11.670
Start of MODEL 11
1 H1 MET 1 H MET 1 7.929 -5.246 10.552
2 HA MET 1 HA MET 1 9.060 -4.259 8.001
3 HB2 MET 1 HB2 MET 1 8.798 -6.755 8.211
4 HB3 MET 1 HB3 MET 1 7.047 -6.507 8.367
5 HG2 MET 1 HG2 MET 1 7.006 -5.424 6.144
6 HG3 MET 1 HG3 MET 1 8.767 -5.568 6.048
7 HE1 MET 1 HE1 MET 1 5.676 -7.893 6.917
8 HE2 MET 1 HE2 MET 1 5.387 -7.112 5.343
9 HE3 MET 1 HE3 MET 1 5.638 -8.872 5.430
10 H LEU 2 H LEU 2 7.305 -3.564 6.419
11 HA LEU 2 HA LEU 2 5.419 -1.851 7.894
12 HB2 LEU 2 HB2 LEU 2 6.153 -2.044 4.945
13 HB3 LEU 2 HB3 LEU 2 5.109 -0.798 5.664
14 HG LEU 2 HG LEU 2 8.006 -1.314 6.478
15 HD11 LEU 2 HD11 LEU 2 7.836 -0.466 4.163
16 HD12 LEU 2 HD12 LEU 2 6.825 0.886 4.736
17 HD13 LEU 2 HD13 LEU 2 8.521 0.753 5.259
18 HD21 LEU 2 HD21 LEU 2 6.627 -0.291 8.258
19 HD22 LEU 2 HD22 LEU 2 7.792 0.877 7.603
20 HD23 LEU 2 HD23 LEU 2 6.084 0.962 7.116
21 H LYS 3 H LYS 3 3.146 -1.761 7.346
22 HA LYS 3 HA LYS 3 1.987 -4.053 5.936
23 HB2 LYS 3 HB2 LYS 3 2.544 -4.818 8.265
24 HB3 LYS 3 HB3 LYS 3 1.433 -3.588 8.897
25 HG2 LYS 3 HG2 LYS 3 -0.451 -4.648 7.789
26 HG3 LYS 3 HG3 LYS 3 0.628 -5.701 6.850
27 HD2 LYS 3 HD2 LYS 3 1.419 -6.762 8.952
28 HD3 LYS 3 HD3 LYS 3 0.278 -5.761 9.878
29 HE2 LYS 3 HE2 LYS 3 -1.616 -6.763 8.631
30 HE3 LYS 3 HE3 LYS 3 -0.466 -7.707 7.663
31 HZ1 LYS 3 HZ1 LYS 3 -0.720 -9.227 9.195
32 HZ2 LYS 3 HZ2 LYS 3 0.220 -8.304 10.171
33 HZ3 LYS 3 HZ3 LYS 3 -1.423 -8.201 10.290
34 H LEU 4 H LEU 4 1.209 -2.392 4.548
35 HA LEU 4 HA LEU 4 0.101 0.041 5.647
36 HB2 LEU 4 HB2 LEU 4 0.615 -1.184 2.951
37 HB3 LEU 4 HB3 LEU 4 -0.587 0.113 3.051
38 HG LEU 4 HG LEU 4 1.075 1.565 4.209
39 HD11 LEU 4 HD11 LEU 4 3.003 -0.692 3.514
40 HD12 LEU 4 HD12 LEU 4 3.454 0.904 4.162
41 HD13 LEU 4 HD13 LEU 4 2.504 -0.221 5.156
42 HD21 LEU 4 HD21 LEU 4 0.742 1.671 1.753
43 HD22 LEU 4 HD22 LEU 4 2.430 2.017 2.196
44 HD23 LEU 4 HD23 LEU 4 1.991 0.424 1.534
45 H LYS 5 H LYS 5 -1.770 -0.142 6.773
46 HA LYS 5 HA LYS 5 -4.031 -1.680 5.673
47 HB2 LYS 5 HB2 LYS 5 -3.520 -1.678 8.132
48 HB3 LYS 5 HB3 LYS 5 -3.812 0.076 8.149
49 HG2 LYS 5 HG2 LYS 5 -6.115 -0.464 7.121
50 HG3 LYS 5 HG3 LYS 5 -5.793 -2.155 7.564
51 HD2 LYS 5 HD2 LYS 5 -5.462 -1.424 9.934
52 HD3 LYS 5 HD3 LYS 5 -5.825 0.249 9.446
53 HE2 LYS 5 HE2 LYS 5 -8.047 -0.542 8.590
54 HE3 LYS 5 HE3 LYS 5 -7.683 -2.156 9.233
55 HZ1 LYS 5 HZ1 LYS 5 -7.904 0.329 10.786
56 HZ2 LYS 5 HZ2 LYS 5 -8.992 -0.908 10.760
57 HZ3 LYS 5 HZ3 LYS 5 -7.500 -1.143 11.414
58 H VAL 6 H VAL 6 -4.986 -0.678 3.964
59 HA VAL 6 HA VAL 6 -4.860 2.112 3.460
60 HB VAL 6 HB VAL 6 -6.818 0.031 2.402
61 HG11 VAL 6 HG11 VAL 6 -5.793 2.666 1.254
62 HG12 VAL 6 HG12 VAL 6 -6.856 1.513 0.412
63 HG13 VAL 6 HG13 VAL 6 -7.437 2.361 1.861
64 HG21 VAL 6 HG21 VAL 6 -4.470 -0.705 2.144
65 HG22 VAL 6 HG22 VAL 6 -5.169 -0.248 0.577
66 HG23 VAL 6 HG23 VAL 6 -4.056 0.862 1.409
67 H GLU 7 H GLU 7 -6.160 3.787 3.974
68 HA GLU 7 HA GLU 7 -8.334 3.357 5.899
69 HB2 GLU 7 HB2 GLU 7 -6.646 5.186 6.153
70 HB3 GLU 7 HB3 GLU 7 -7.207 5.888 4.624
71 HG2 GLU 7 HG2 GLU 7 -8.246 7.051 6.499
72 HG3 GLU 7 HG3 GLU 7 -9.483 6.152 5.606
73 H GLY 8 H GLY 8 -10.517 3.861 5.487
74 HA2 GLY 8 HA2 GLY 8 -11.312 3.734 2.661
75 HA3 GLY 8 HA3 GLY 8 -12.360 3.570 4.085
76 H MET 9 H MET 9 -10.162 6.067 2.673
77 HA MET 9 HA MET 9 -11.581 8.238 3.859
78 HB2 MET 9 HB2 MET 9 -9.658 8.176 1.500
79 HB3 MET 9 HB3 MET 9 -10.166 9.629 2.389
80 HG2 MET 9 HG2 MET 9 -9.260 8.639 4.482
81 HG3 MET 9 HG3 MET 9 -8.724 7.226 3.565
82 HE1 MET 9 HE1 MET 9 -6.974 11.497 3.244
83 HE2 MET 9 HE2 MET 9 -8.611 11.095 2.675
84 HE3 MET 9 HE3 MET 9 -8.215 10.972 4.406
85 H THR 10 H THR 10 -11.313 7.427 0.321
86 HA THR 10 HA THR 10 -14.100 8.415 0.022
87 HB THR 10 HB THR 10 -13.339 9.640 -2.028
88 HG1 THR 10 HG1 THR 10 -11.133 9.984 -2.253
89 HG21 THR 10 HG21 THR 10 -13.690 10.807 0.139
90 HG22 THR 10 HG22 THR 10 -11.987 10.511 0.563
91 HG23 THR 10 HG23 THR 10 -12.393 11.556 -0.818
92 H CYS 11 H CYS 11 -14.995 7.894 -2.165
93 HA CYS 11 HA CYS 11 -15.697 6.232 -3.551
94 HB2 CYS 11 HB2 CYS 11 -12.713 6.154 -4.120
95 HB3 CYS 11 HB3 CYS 11 -13.987 5.487 -5.171
96 HG CYS 11 HG CYS 11 -15.333 7.721 -5.386
97 H ASN 12 H ASN 12 -15.238 5.421 -0.825
98 HA ASN 12 HA ASN 12 -13.921 2.898 -0.664
99 HB2 ASN 12 HB2 ASN 12 -15.148 2.742 1.476
100 HB3 ASN 12 HB3 ASN 12 -14.402 4.339 1.271
101 HD21 ASN 12 HD21 ASN 12 -18.363 4.068 1.930
102 HD22 ASN 12 HD22 ASN 12 -17.216 2.774 2.201
103 H HIS 13 H HIS 13 -16.673 3.759 -2.398
104 HA HIS 13 HA HIS 13 -18.377 1.512 -1.810
105 HB2 HIS 13 HB2 HIS 13 -18.234 3.389 -4.198
106 HB3 HIS 13 HB3 HIS 13 -19.554 2.259 -3.859
107 HD1 HIS 13 HD1 HIS 13 -18.122 5.591 -2.606
108 HD2 HIS 13 HD2 HIS 13 -21.258 2.878 -1.878
109 HE1 HIS 13 HE1 HIS 13 -19.758 6.764 -1.033
110 H CYS 14 H CYS 14 -15.372 1.714 -3.395
111 HA CYS 14 HA CYS 14 -15.958 -0.807 -4.863
112 HB2 CYS 14 HB2 CYS 14 -14.221 1.513 -5.797
113 HB3 CYS 14 HB3 CYS 14 -14.445 -0.034 -6.648
114 HG CYS 14 HG CYS 14 -15.809 1.897 -7.804
115 H VAL 15 H VAL 15 -13.630 -1.713 -5.601
116 HA VAL 15 HA VAL 15 -11.542 -1.213 -3.639
117 HB VAL 15 HB VAL 15 -13.017 -2.809 -2.453
118 HG11 VAL 15 HG11 VAL 15 -13.292 -5.099 -3.285
119 HG12 VAL 15 HG12 VAL 15 -13.985 -3.941 -4.441
120 HG13 VAL 15 HG13 VAL 15 -12.405 -4.693 -4.769
121 HG21 VAL 15 HG21 VAL 15 -11.290 -4.454 -1.921
122 HG22 VAL 15 HG22 VAL 15 -10.419 -4.065 -3.424
123 HG23 VAL 15 HG23 VAL 15 -10.557 -2.850 -2.131
124 H MET 16 H MET 16 -9.536 -1.673 -4.525
125 HA MET 16 HA MET 16 -9.380 -3.365 -6.934
126 HB2 MET 16 HB2 MET 16 -8.668 -0.398 -6.867
127 HB3 MET 16 HB3 MET 16 -8.048 -1.545 -8.068
128 HG2 MET 16 HG2 MET 16 -9.857 -0.742 -9.196
129 HG3 MET 16 HG3 MET 16 -10.555 -2.171 -8.435
130 HE1 MET 16 HE1 MET 16 -13.542 0.313 -8.569
131 HE2 MET 16 HE2 MET 16 -12.247 0.091 -9.768
132 HE3 MET 16 HE3 MET 16 -12.947 -1.321 -8.943
133 H ALA 17 H ALA 17 -7.124 -3.784 -7.552
134 HA ALA 17 HA ALA 17 -5.523 -4.462 -5.301
135 HB1 ALA 17 HB1 ALA 17 -5.492 -5.693 -7.434
136 HB2 ALA 17 HB2 ALA 17 -4.819 -4.266 -8.256
137 HB3 ALA 17 HB3 ALA 17 -3.865 -5.108 -7.013
138 H VAL 18 H VAL 18 -4.419 -3.123 -4.061
139 HA VAL 18 HA VAL 18 -3.788 -0.425 -4.728
140 HB VAL 18 HB VAL 18 -2.756 -2.241 -2.497
141 HG11 VAL 18 HG11 VAL 18 -2.616 -0.039 -1.271
142 HG12 VAL 18 HG12 VAL 18 -1.459 -0.186 -2.616
143 HG13 VAL 18 HG13 VAL 18 -2.939 0.782 -2.809
144 HG21 VAL 18 HG21 VAL 18 -4.742 -0.607 -1.474
145 HG22 VAL 18 HG22 VAL 18 -5.367 -0.966 -3.083
146 HG23 VAL 18 HG23 VAL 18 -4.982 -2.308 -1.982
147 H THR 19 H THR 19 -2.247 -3.383 -5.531
148 HA THR 19 HA THR 19 0.419 -3.018 -5.203
149 HB THR 19 HB THR 19 -0.981 -4.154 -7.648
150 HG1 THR 19 HG1 THR 19 -0.739 -6.096 -6.404
151 HG21 THR 19 HG21 THR 19 1.755 -4.790 -6.470
152 HG22 THR 19 HG22 THR 19 1.019 -5.535 -7.902
153 HG23 THR 19 HG23 THR 19 1.479 -3.821 -7.941
154 H LYS 20 H LYS 20 -1.516 -1.519 -7.858
155 HA LYS 20 HA LYS 20 0.741 -0.744 -9.378
156 HB2 LYS 20 HB2 LYS 20 -1.988 0.590 -9.192
157 HB3 LYS 20 HB3 LYS 20 -0.808 0.791 -10.504
158 HG2 LYS 20 HG2 LYS 20 -0.959 -1.636 -11.006
159 HG3 LYS 20 HG3 LYS 20 -2.173 -1.818 -9.715
160 HD2 LYS 20 HD2 LYS 20 -3.626 -0.167 -10.873
161 HD3 LYS 20 HD3 LYS 20 -2.426 -0.036 -12.177
162 HE2 LYS 20 HE2 LYS 20 -2.693 -2.447 -12.661
163 HE3 LYS 20 HE3 LYS 20 -3.883 -2.580 -11.349
164 HZ1 LYS 20 HZ1 LYS 20 -5.259 -1.022 -12.524
165 HZ2 LYS 20 HZ2 LYS 20 -4.155 -0.895 -13.740
166 HZ3 LYS 20 HZ3 LYS 20 -4.931 -2.327 -13.478
167 H ALA 21 H ALA 21 -0.601 0.708 -6.452
168 HA ALA 21 HA ALA 21 0.680 3.279 -6.975
169 HB1 ALA 21 HB1 ALA 21 -0.590 2.107 -4.466
170 HB2 ALA 21 HB2 ALA 21 -0.093 3.802 -4.685
171 HB3 ALA 21 HB3 ALA 21 -1.405 3.126 -5.678
172 H LEU 22 H LEU 22 1.531 0.218 -5.434
173 HA LEU 22 HA LEU 22 3.734 1.415 -3.920
174 HB2 LEU 22 HB2 LEU 22 2.719 -1.414 -4.378
175 HB3 LEU 22 HB3 LEU 22 4.260 -1.086 -3.572
176 HG LEU 22 HG LEU 22 2.597 -1.381 -1.882
177 HD11 LEU 22 HD11 LEU 22 4.330 0.457 -1.641
178 HD12 LEU 22 HD12 LEU 22 3.061 1.614 -2.093
179 HD13 LEU 22 HD13 LEU 22 2.879 0.637 -0.622
180 HD21 LEU 22 HD21 LEU 22 0.601 -0.826 -3.256
181 HD22 LEU 22 HD22 LEU 22 0.604 0.002 -1.682
182 HD23 LEU 22 HD23 LEU 22 1.032 0.900 -3.153
183 H LYS 23 H LYS 23 3.245 -0.251 -7.029
184 HA LYS 23 HA LYS 23 5.911 -1.027 -7.459
185 HB2 LYS 23 HB2 LYS 23 3.841 -1.640 -8.793
186 HB3 LYS 23 HB3 LYS 23 3.985 -0.061 -9.601
187 HG2 LYS 23 HG2 LYS 23 6.305 -0.672 -10.297
188 HG3 LYS 23 HG3 LYS 23 6.112 -2.253 -9.506
189 HD2 LYS 23 HD2 LYS 23 4.225 -2.779 -11.014
190 HD3 LYS 23 HD3 LYS 23 4.393 -1.184 -11.786
191 HE2 LYS 23 HE2 LYS 23 6.707 -1.756 -12.458
192 HE3 LYS 23 HE3 LYS 23 6.535 -3.350 -11.696
193 HZ1 LYS 23 HZ1 LYS 23 4.915 -2.342 -13.930
194 HZ2 LYS 23 HZ2 LYS 23 6.142 -3.435 -14.047
195 HZ3 LYS 23 HZ3 LYS 23 4.768 -3.825 -13.223
196 H LYS 24 H LYS 24 4.465 2.174 -7.529
197 HA LYS 24 HA LYS 24 6.449 3.360 -9.243
198 HB2 LYS 24 HB2 LYS 24 4.641 4.599 -7.128
199 HB3 LYS 24 HB3 LYS 24 5.571 5.495 -8.347
200 HG2 LYS 24 HG2 LYS 24 4.343 4.296 -10.149
201 HG3 LYS 24 HG3 LYS 24 3.374 3.459 -8.912
202 HD2 LYS 24 HD2 LYS 24 2.593 5.661 -8.059
203 HD3 LYS 24 HD3 LYS 24 3.533 6.477 -9.328
204 HE2 LYS 24 HE2 LYS 24 2.222 5.285 -11.060
205 HE3 LYS 24 HE3 LYS 24 1.286 4.472 -9.787
206 HZ1 LYS 24 HZ1 LYS 24 1.384 7.372 -10.260
207 HZ2 LYS 24 HZ2 LYS 24 0.131 6.369 -10.634
208 HZ3 LYS 24 HZ3 LYS 24 0.537 6.630 -9.060
209 H VAL 25 H VAL 25 6.524 2.312 -5.917
210 HA VAL 25 HA VAL 25 8.485 4.267 -5.048
211 HB VAL 25 HB VAL 25 7.442 1.653 -3.904
212 HG11 VAL 25 HG11 VAL 25 8.542 2.330 -1.798
213 HG12 VAL 25 HG12 VAL 25 9.732 2.049 -3.088
214 HG13 VAL 25 HG13 VAL 25 9.289 3.711 -2.633
215 HG21 VAL 25 HG21 VAL 25 6.267 3.158 -2.343
216 HG22 VAL 25 HG22 VAL 25 6.989 4.567 -3.154
217 HG23 VAL 25 HG23 VAL 25 5.831 3.533 -4.025
218 HA PRO 26 HA PRO 26 11.970 2.237 -6.948
219 HB2 PRO 26 HB2 PRO 26 13.371 3.715 -4.726
220 HB3 PRO 26 HB3 PRO 26 13.804 3.641 -6.466
221 HG2 PRO 26 HG2 PRO 26 12.589 5.844 -5.461
222 HG3 PRO 26 HG3 PRO 26 12.047 5.160 -7.033
223 HD2 PRO 26 HD2 PRO 26 10.796 4.803 -4.301
224 HD3 PRO 26 HD3 PRO 26 10.004 5.138 -5.875
225 H GLY 27 H GLY 27 13.032 0.305 -6.503
226 HA2 GLY 27 HA2 GLY 27 14.199 -1.223 -5.181
227 HA3 GLY 27 HA3 GLY 27 13.619 -0.412 -3.716
228 H VAL 28 H VAL 28 10.765 -0.503 -4.989
229 HA VAL 28 HA VAL 28 9.997 -2.986 -3.721
230 HB VAL 28 HB VAL 28 8.510 -0.959 -5.436
231 HG11 VAL 28 HG11 VAL 28 7.442 -3.162 -5.684
232 HG12 VAL 28 HG12 VAL 28 7.433 -3.370 -3.916
233 HG13 VAL 28 HG13 VAL 28 6.446 -2.096 -4.671
234 HG21 VAL 28 HG21 VAL 28 8.492 -1.603 -2.453
235 HG22 VAL 28 HG22 VAL 28 9.238 -0.175 -3.208
236 HG23 VAL 28 HG23 VAL 28 7.472 -0.385 -3.252
237 H GLU 29 H GLU 29 9.860 -4.979 -4.596
238 HA GLU 29 HA GLU 29 9.867 -5.186 -7.571
239 HB2 GLU 29 HB2 GLU 29 12.102 -5.687 -6.674
240 HB3 GLU 29 HB3 GLU 29 11.395 -6.868 -5.548
241 HG2 GLU 29 HG2 GLU 29 10.532 -8.173 -7.484
242 HG3 GLU 29 HG3 GLU 29 11.295 -7.013 -8.590
243 H LYS 30 H LYS 30 8.735 -6.355 -4.425
244 HA LYS 30 HA LYS 30 6.774 -8.069 -5.875
245 HB2 LYS 30 HB2 LYS 30 8.225 -8.672 -3.274
246 HB3 LYS 30 HB3 LYS 30 6.976 -9.688 -4.017
247 HG2 LYS 30 HG2 LYS 30 8.416 -10.066 -5.977
248 HG3 LYS 30 HG3 LYS 30 9.640 -8.957 -5.312
249 HD2 LYS 30 HD2 LYS 30 9.861 -10.419 -3.315
250 HD3 LYS 30 HD3 LYS 30 8.714 -11.567 -4.044
251 HE2 LYS 30 HE2 LYS 30 10.225 -11.902 -5.949
252 HE3 LYS 30 HE3 LYS 30 11.337 -10.673 -5.312
253 HZ1 LYS 30 HZ1 LYS 30 11.671 -12.054 -3.396
254 HZ2 LYS 30 HZ2 LYS 30 10.649 -13.204 -3.990
255 HZ3 LYS 30 HZ3 LYS 30 12.063 -12.873 -4.771
256 H VAL 31 H VAL 31 4.704 -8.228 -4.872
257 HA VAL 31 HA VAL 31 4.191 -6.497 -2.543
258 HB VAL 31 HB VAL 31 2.799 -6.169 -5.231
259 HG11 VAL 31 HG11 VAL 31 1.307 -5.847 -3.267
260 HG12 VAL 31 HG12 VAL 31 2.453 -4.663 -2.609
261 HG13 VAL 31 HG13 VAL 31 1.603 -4.322 -4.133
262 HG21 VAL 31 HG21 VAL 31 3.758 -3.875 -5.180
263 HG22 VAL 31 HG22 VAL 31 4.672 -4.302 -3.715
264 HG23 VAL 31 HG23 VAL 31 5.021 -5.119 -5.258
265 H GLU 32 H GLU 32 2.228 -7.023 -1.477
266 HA GLU 32 HA GLU 32 0.586 -9.215 -2.571
267 HB2 GLU 32 HB2 GLU 32 2.365 -10.311 -1.217
268 HB3 GLU 32 HB3 GLU 32 1.926 -9.282 0.166
269 HG2 GLU 32 HG2 GLU 32 -0.407 -10.206 0.039
270 HG3 GLU 32 HG3 GLU 32 0.138 -11.314 -1.233
271 H VAL 33 H VAL 33 -1.561 -8.705 -2.209
272 HA VAL 33 HA VAL 33 -2.111 -6.824 0.028
273 HB VAL 33 HB VAL 33 -3.677 -5.605 -1.423
274 HG11 VAL 33 HG11 VAL 33 -0.884 -5.820 -2.623
275 HG12 VAL 33 HG12 VAL 33 -2.002 -4.449 -2.798
276 HG13 VAL 33 HG13 VAL 33 -1.325 -4.844 -1.202
277 HG21 VAL 33 HG21 VAL 33 -2.550 -7.362 -3.647
278 HG22 VAL 33 HG22 VAL 33 -4.211 -7.426 -3.011
279 HG23 VAL 33 HG23 VAL 33 -3.642 -5.976 -3.866
280 H SER 34 H SER 34 -4.263 -6.854 0.840
281 HA SER 34 HA SER 34 -5.875 -9.243 0.088
282 HB2 SER 34 HB2 SER 34 -4.684 -9.701 2.192
283 HB3 SER 34 HB3 SER 34 -5.311 -8.188 2.888
284 HG SER 34 HG SER 34 -6.538 -10.103 3.413
285 H LEU 35 H LEU 35 -7.465 -8.243 -1.051
286 HA LEU 35 HA LEU 35 -8.249 -5.558 -0.632
287 HB2 LEU 35 HB2 LEU 35 -9.746 -7.821 -2.008
288 HB3 LEU 35 HB3 LEU 35 -10.017 -6.090 -2.260
289 HG LEU 35 HG LEU 35 -7.442 -7.588 -2.873
290 HD11 LEU 35 HD11 LEU 35 -8.062 -7.207 -5.236
291 HD12 LEU 35 HD12 LEU 35 -9.293 -8.180 -4.396
292 HD13 LEU 35 HD13 LEU 35 -9.587 -6.455 -4.716
293 HD21 LEU 35 HD21 LEU 35 -8.161 -4.790 -3.782
294 HD22 LEU 35 HD22 LEU 35 -7.292 -5.077 -2.241
295 HD23 LEU 35 HD23 LEU 35 -6.587 -5.587 -3.786
296 H GLU 36 H GLU 36 -9.360 -8.500 0.980
297 HA GLU 36 HA GLU 36 -11.916 -7.269 1.700
298 HB2 GLU 36 HB2 GLU 36 -10.536 -9.865 2.467
299 HB3 GLU 36 HB3 GLU 36 -12.095 -9.343 3.149
300 HG2 GLU 36 HG2 GLU 36 -13.020 -9.125 0.855
301 HG3 GLU 36 HG3 GLU 36 -11.494 -9.742 0.193
302 H LYS 37 H LYS 37 -8.693 -7.659 3.163
303 HA LYS 37 HA LYS 37 -9.793 -6.532 5.677
304 HB2 LYS 37 HB2 LYS 37 -7.188 -7.984 5.103
305 HB3 LYS 37 HB3 LYS 37 -7.644 -7.276 6.676
306 HG2 LYS 37 HG2 LYS 37 -9.747 -8.614 6.641
307 HG3 LYS 37 HG3 LYS 37 -9.215 -9.393 5.137
308 HD2 LYS 37 HD2 LYS 37 -7.264 -10.341 6.295
309 HD3 LYS 37 HD3 LYS 37 -7.723 -9.489 7.793
310 HE2 LYS 37 HE2 LYS 37 -9.889 -10.697 7.806
311 HE3 LYS 37 HE3 LYS 37 -9.410 -11.572 6.338
312 HZ1 LYS 37 HZ1 LYS 37 -9.017 -12.832 8.340
313 HZ2 LYS 37 HZ2 LYS 37 -7.599 -12.518 7.557
314 HZ3 LYS 37 HZ3 LYS 37 -8.000 -11.671 8.914
315 H GLY 38 H GLY 38 -8.274 -5.535 2.832
316 HA2 GLY 38 HA2 GLY 38 -7.493 -3.477 2.225
317 HA3 GLY 38 HA3 GLY 38 -8.013 -2.868 3.808
318 H GLU 39 H GLU 39 -5.788 -5.592 3.782
319 HA GLU 39 HA GLU 39 -3.670 -3.751 4.778
320 HB2 GLU 39 HB2 GLU 39 -3.983 -6.779 4.926
321 HB3 GLU 39 HB3 GLU 39 -2.623 -5.854 5.603
322 HG2 GLU 39 HG2 GLU 39 -4.200 -4.595 7.041
323 HG3 GLU 39 HG3 GLU 39 -5.550 -5.540 6.387
324 H ALA 40 H ALA 40 -1.505 -3.951 3.946
325 HA ALA 40 HA ALA 40 -1.185 -5.444 1.419
326 HB1 ALA 40 HB1 ALA 40 -2.148 -3.274 0.769
327 HB2 ALA 40 HB2 ALA 40 -0.889 -2.424 1.696
328 HB3 ALA 40 HB3 ALA 40 -0.447 -3.384 0.264
329 H LEU 41 H LEU 41 0.758 -6.306 1.318
330 HA LEU 41 HA LEU 41 2.953 -5.238 3.035
331 HB2 LEU 41 HB2 LEU 41 2.436 -8.054 1.976
332 HB3 LEU 41 HB3 LEU 41 3.881 -7.541 2.847
333 HG LEU 41 HG LEU 41 2.561 -8.648 4.433
334 HD11 LEU 41 HD11 LEU 41 3.512 -6.449 5.163
335 HD12 LEU 41 HD12 LEU 41 1.936 -5.699 4.818
336 HD13 LEU 41 HD13 LEU 41 2.076 -6.943 6.083
337 HD21 LEU 41 HD21 LEU 41 0.217 -8.213 4.878
338 HD22 LEU 41 HD22 LEU 41 0.177 -6.920 3.666
339 HD23 LEU 41 HD23 LEU 41 0.423 -8.608 3.156
340 H VAL 42 H VAL 42 5.082 -5.239 2.125
341 HA VAL 42 HA VAL 42 5.274 -5.747 -0.783
342 HB VAL 42 HB VAL 42 6.641 -3.708 -1.050
343 HG11 VAL 42 HG11 VAL 42 4.825 -2.207 -1.283
344 HG12 VAL 42 HG12 VAL 42 4.120 -3.818 -1.462
345 HG13 VAL 42 HG13 VAL 42 3.928 -2.947 0.077
346 HG21 VAL 42 HG21 VAL 42 5.643 -2.990 1.739
347 HG22 VAL 42 HG22 VAL 42 7.308 -3.468 1.342
348 HG23 VAL 42 HG23 VAL 42 6.634 -1.969 0.671
349 H GLU 43 H GLU 43 7.583 -5.993 -1.462
350 HA GLU 43 HA GLU 43 9.437 -6.526 0.772
351 HB2 GLU 43 HB2 GLU 43 8.269 -8.649 0.261
352 HB3 GLU 43 HB3 GLU 43 8.828 -8.544 -1.419
353 HG2 GLU 43 HG2 GLU 43 11.165 -8.620 -0.670
354 HG3 GLU 43 HG3 GLU 43 10.638 -8.619 1.027
355 H GLY 44 H GLY 44 10.746 -4.793 0.220
356 HA2 GLY 44 HA2 GLY 44 12.420 -5.131 -2.131
357 HA3 GLY 44 HA3 GLY 44 11.347 -3.716 -2.211
358 H THR 45 H THR 45 13.827 -2.928 -2.275
359 HA THR 45 HA THR 45 14.883 -2.574 0.458
360 HB THR 45 HB THR 45 16.839 -1.602 -0.787
361 HG1 THR 45 HG1 THR 45 16.232 -0.876 -2.667
362 HG21 THR 45 HG21 THR 45 17.164 -3.825 -2.242
363 HG22 THR 45 HG22 THR 45 17.207 -3.879 -0.450
364 HG23 THR 45 HG23 THR 45 15.744 -4.352 -1.343
365 H ALA 46 H ALA 46 12.344 -1.215 -0.507
366 HA ALA 46 HA ALA 46 13.047 1.559 -0.954
367 HB1 ALA 46 HB1 ALA 46 10.619 1.908 -0.699
368 HB2 ALA 46 HB2 ALA 46 10.950 0.528 -1.774
369 HB3 ALA 46 HB3 ALA 46 10.437 0.244 -0.094
370 H ASP 47 H ASP 47 11.971 3.254 0.606
371 HA ASP 47 HA ASP 47 12.718 2.514 3.394
372 HB2 ASP 47 HB2 ASP 47 12.570 5.201 1.978
373 HB3 ASP 47 HB3 ASP 47 12.882 4.996 3.712
374 HA PRO 48 HA PRO 48 8.581 2.809 4.732
375 HB2 PRO 48 HB2 PRO 48 9.605 4.644 6.895
376 HB3 PRO 48 HB3 PRO 48 8.564 3.190 7.061
377 HG2 PRO 48 HG2 PRO 48 11.196 3.034 7.664
378 HG3 PRO 48 HG3 PRO 48 10.428 1.735 6.688
379 HD2 PRO 48 HD2 PRO 48 12.092 4.071 5.717
380 HD3 PRO 48 HD3 PRO 48 12.173 2.347 5.233
381 H LYS 49 H LYS 49 10.399 5.915 4.702
382 HA LYS 49 HA LYS 49 8.020 7.542 4.682
383 HB2 LYS 49 HB2 LYS 49 10.907 8.142 3.910
384 HB3 LYS 49 HB3 LYS 49 9.618 9.353 4.078
385 HG2 LYS 49 HG2 LYS 49 9.283 8.636 6.443
386 HG3 LYS 49 HG3 LYS 49 10.664 7.526 6.281
387 HD2 LYS 49 HD2 LYS 49 12.153 9.406 5.766
388 HD3 LYS 49 HD3 LYS 49 10.776 10.533 5.784
389 HE2 LYS 49 HE2 LYS 49 10.361 10.003 8.159
390 HE3 LYS 49 HE3 LYS 49 11.735 8.878 8.154
391 HZ1 LYS 49 HZ1 LYS 49 13.162 10.717 7.637
392 HZ2 LYS 49 HZ2 LYS 49 11.890 11.765 7.623
393 HZ3 LYS 49 HZ3 LYS 49 12.328 11.023 9.026
394 H ALA 50 H ALA 50 9.652 5.688 2.233
395 HA ALA 50 HA ALA 50 8.610 7.408 0.067
396 HB1 ALA 50 HB1 ALA 50 10.874 6.427 -0.132
397 HB2 ALA 50 HB2 ALA 50 10.180 4.795 0.020
398 HB3 ALA 50 HB3 ALA 50 9.786 5.800 -1.392
399 H LEU 51 H LEU 51 8.056 4.303 1.701
400 HA LEU 51 HA LEU 51 6.262 3.257 -0.245
401 HB2 LEU 51 HB2 LEU 51 7.600 2.071 1.638
402 HB3 LEU 51 HB3 LEU 51 6.261 2.553 2.700
403 HG LEU 51 HG LEU 51 4.707 1.473 0.940
404 HD11 LEU 51 HD11 LEU 51 5.820 -0.290 -0.445
405 HD12 LEU 51 HD12 LEU 51 6.357 1.342 -0.900
406 HD13 LEU 51 HD13 LEU 51 7.403 0.306 0.097
407 HD21 LEU 51 HD21 LEU 51 5.346 0.472 3.159
408 HD22 LEU 51 HD22 LEU 51 5.003 -0.737 1.896
409 HD23 LEU 51 HD23 LEU 51 6.685 -0.362 2.344
410 H VAL 52 H VAL 52 5.588 4.575 3.059
411 HA VAL 52 HA VAL 52 2.758 4.486 2.705
412 HB VAL 52 HB VAL 52 4.446 6.128 4.635
413 HG11 VAL 52 HG11 VAL 52 1.565 5.132 4.768
414 HG12 VAL 52 HG12 VAL 52 2.432 5.957 6.084
415 HG13 VAL 52 HG13 VAL 52 2.077 6.826 4.576
416 HG21 VAL 52 HG21 VAL 52 4.129 4.210 6.164
417 HG22 VAL 52 HG22 VAL 52 3.288 3.318 4.874
418 HG23 VAL 52 HG23 VAL 52 5.014 3.720 4.704
419 H GLN 53 H GLN 53 5.199 6.839 1.739
420 HA GLN 53 HA GLN 53 3.291 9.033 1.590
421 HB2 GLN 53 HB2 GLN 53 5.704 9.339 2.056
422 HB3 GLN 53 HB3 GLN 53 6.092 8.713 0.438
423 HG2 GLN 53 HG2 GLN 53 4.867 10.577 -0.596
424 HG3 GLN 53 HG3 GLN 53 4.373 11.164 1.007
425 HE21 GLN 53 HE21 GLN 53 8.331 11.589 -0.205
426 HE22 GLN 53 HE22 GLN 53 7.320 10.342 -0.909
427 H ALA 54 H ALA 54 4.668 6.590 -0.624
428 HA ALA 54 HA ALA 54 3.874 7.782 -3.051
429 HB1 ALA 54 HB1 ALA 54 4.055 5.488 -3.957
430 HB2 ALA 54 HB2 ALA 54 5.422 5.894 -2.894
431 HB3 ALA 54 HB3 ALA 54 4.113 4.843 -2.298
432 H VAL 55 H VAL 55 2.100 5.487 -0.893
433 HA VAL 55 HA VAL 55 -0.185 5.404 -2.671
434 HB VAL 55 HB VAL 55 -1.274 4.262 -0.747
435 HG11 VAL 55 HG11 VAL 55 0.241 2.317 -0.711
436 HG12 VAL 55 HG12 VAL 55 0.129 3.006 -2.347
437 HG13 VAL 55 HG13 VAL 55 1.564 3.326 -1.343
438 HG21 VAL 55 HG21 VAL 55 0.044 3.791 1.280
439 HG22 VAL 55 HG22 VAL 55 1.370 4.805 0.669
440 HG23 VAL 55 HG23 VAL 55 -0.199 5.540 1.078
441 H GLU 56 H GLU 56 0.935 7.596 -0.145
442 HA GLU 56 HA GLU 56 -1.718 8.697 0.311
443 HB2 GLU 56 HB2 GLU 56 0.170 8.778 1.962
444 HB3 GLU 56 HB3 GLU 56 1.008 9.924 0.895
445 HG2 GLU 56 HG2 GLU 56 -0.921 11.475 1.055
446 HG3 GLU 56 HG3 GLU 56 -1.771 10.308 2.075
447 H GLU 57 H GLU 57 0.860 9.072 -2.034
448 HA GLU 57 HA GLU 57 0.114 11.679 -2.985
449 HB2 GLU 57 HB2 GLU 57 2.316 10.555 -3.350
450 HB3 GLU 57 HB3 GLU 57 1.514 9.391 -4.426
451 HG2 GLU 57 HG2 GLU 57 0.837 11.216 -5.927
452 HG3 GLU 57 HG3 GLU 57 1.541 12.412 -4.818
453 H GLU 58 H GLU 58 -1.144 8.428 -3.383
454 HA GLU 58 HA GLU 58 -2.731 9.095 -5.760
455 HB2 GLU 58 HB2 GLU 58 -2.672 6.704 -3.880
456 HB3 GLU 58 HB3 GLU 58 -3.693 6.808 -5.326
457 HG2 GLU 58 HG2 GLU 58 -0.653 7.008 -5.318
458 HG3 GLU 58 HG3 GLU 58 -1.572 5.546 -5.704
459 H GLY 59 H GLY 59 -2.871 9.707 -2.414
460 HA2 GLY 59 HA2 GLY 59 -4.567 11.181 -1.619
461 HA3 GLY 59 HA3 GLY 59 -5.727 10.442 -2.731
462 H TYR 60 H TYR 60 -3.812 8.046 -1.100
463 HA TYR 60 HA TYR 60 -5.953 7.795 0.961
464 HB2 TYR 60 HB2 TYR 60 -4.879 5.657 -0.901
465 HB3 TYR 60 HB3 TYR 60 -5.869 5.329 0.527
466 HD1 TYR 60 HD1 TYR 60 -5.877 6.557 -2.924
467 HD2 TYR 60 HD2 TYR 60 -8.212 6.052 0.650
468 HE1 TYR 60 HE1 TYR 60 -7.953 6.890 -4.241
469 HE2 TYR 60 HE2 TYR 60 -10.290 6.377 -0.655
470 HH TYR 60 HH TYR 60 -11.199 6.756 -2.724
471 H LYS 61 H LYS 61 -5.214 7.596 2.945
472 HA LYS 61 HA LYS 61 -2.415 7.350 3.537
473 HB2 LYS 61 HB2 LYS 61 -4.896 7.103 5.286
474 HB3 LYS 61 HB3 LYS 61 -3.231 7.284 5.885
475 HG2 LYS 61 HG2 LYS 61 -3.031 9.465 4.785
476 HG3 LYS 61 HG3 LYS 61 -4.640 9.275 4.054
477 HD2 LYS 61 HD2 LYS 61 -5.656 9.193 6.314
478 HD3 LYS 61 HD3 LYS 61 -4.049 9.445 7.039
479 HE2 LYS 61 HE2 LYS 61 -3.849 11.612 5.855
480 HE3 LYS 61 HE3 LYS 61 -5.414 11.321 5.071
481 HZ1 LYS 61 HZ1 LYS 61 -4.892 11.877 7.888
482 HZ2 LYS 61 HZ2 LYS 61 -5.865 12.676 6.845
483 HZ3 LYS 61 HZ3 LYS 61 -6.317 11.187 7.385
484 H ALA 62 H ALA 62 -1.582 5.611 5.073
485 HA ALA 62 HA ALA 62 -2.947 3.021 4.913
486 HB1 ALA 62 HB1 ALA 62 -1.696 3.149 2.787
487 HB2 ALA 62 HB2 ALA 62 -0.199 3.488 3.690
488 HB3 ALA 62 HB3 ALA 62 -1.020 1.918 3.876
489 H GLU 63 H GLU 63 -3.025 2.952 7.143
490 HA GLU 63 HA GLU 63 -0.877 3.707 8.858
491 HB2 GLU 63 HB2 GLU 63 -3.299 3.601 9.471
492 HB3 GLU 63 HB3 GLU 63 -3.209 1.827 9.401
493 HG2 GLU 63 HG2 GLU 63 -1.366 1.917 11.113
494 HG3 GLU 63 HG3 GLU 63 -1.612 3.671 11.230
495 H VAL 64 H VAL 64 1.090 2.692 8.707
496 HA VAL 64 HA VAL 64 1.494 -0.045 8.094
497 HB VAL 64 HB VAL 64 3.756 0.366 9.064
498 HG11 VAL 64 HG11 VAL 64 3.206 0.977 6.742
499 HG12 VAL 64 HG12 VAL 64 2.639 2.573 7.285
500 HG13 VAL 64 HG13 VAL 64 4.354 2.140 7.445
501 HG21 VAL 64 HG21 VAL 64 4.224 2.819 9.669
502 HG22 VAL 64 HG22 VAL 64 2.479 3.011 9.870
503 HG23 VAL 64 HG23 VAL 64 3.364 1.867 10.906
504 H LEU 65 H LEU 65 0.580 -1.669 9.239
505 HA LEU 65 HA LEU 65 -0.042 -1.344 12.069
506 HB2 LEU 65 HB2 LEU 65 -0.227 -3.745 10.201
507 HB3 LEU 65 HB3 LEU 65 -0.917 -3.654 11.831
508 HG LEU 65 HG LEU 65 -1.687 -1.844 9.493
509 HD11 LEU 65 HD11 LEU 65 -3.920 -3.210 10.077
510 HD12 LEU 65 HD12 LEU 65 -2.695 -3.881 8.951
511 HD13 LEU 65 HD13 LEU 65 -2.760 -4.408 10.648
512 HD21 LEU 65 HD21 LEU 65 -1.922 -0.749 11.693
513 HD22 LEU 65 HD22 LEU 65 -3.515 -1.159 11.030
514 HD23 LEU 65 HD23 LEU 65 -2.804 -2.166 12.313
515 H ALA 66 H ALA 66 2.308 -0.926 12.646
516 HA ALA 66 HA ALA 66 3.592 -3.517 13.329
517 HB1 ALA 66 HB1 ALA 66 4.775 -1.196 11.787
518 HB2 ALA 66 HB2 ALA 66 5.809 -2.259 12.793
519 HB3 ALA 66 HB3 ALA 66 4.868 -2.925 11.439
Start of MODEL 12
1 H1 MET 1 H MET 1 7.869 -4.022 11.167
2 HA MET 1 HA MET 1 9.135 -3.445 8.557
3 HB2 MET 1 HB2 MET 1 9.075 -5.854 9.146
4 HB3 MET 1 HB3 MET 1 7.309 -5.767 9.278
5 HG2 MET 1 HG2 MET 1 7.139 -5.149 6.909
6 HG3 MET 1 HG3 MET 1 8.901 -5.033 6.798
7 HE1 MET 1 HE1 MET 1 6.198 -7.628 8.116
8 HE2 MET 1 HE2 MET 1 5.794 -7.160 6.447
9 HE3 MET 1 HE3 MET 1 6.309 -8.825 6.805
10 H LEU 2 H LEU 2 7.434 -3.295 6.743
11 HA LEU 2 HA LEU 2 5.391 -1.402 7.697
12 HB2 LEU 2 HB2 LEU 2 6.261 -2.215 4.896
13 HB3 LEU 2 HB3 LEU 2 5.202 -0.848 5.301
14 HG LEU 2 HG LEU 2 8.071 -1.168 6.293
15 HD11 LEU 2 HD11 LEU 2 7.948 -0.861 3.832
16 HD12 LEU 2 HD12 LEU 2 6.986 0.619 4.085
17 HD13 LEU 2 HD13 LEU 2 8.668 0.537 4.655
18 HD21 LEU 2 HD21 LEU 2 6.641 0.223 7.754
19 HD22 LEU 2 HD22 LEU 2 7.832 1.222 6.895
20 HD23 LEU 2 HD23 LEU 2 6.140 1.190 6.346
21 H LYS 3 H LYS 3 3.178 -1.586 7.156
22 HA LYS 3 HA LYS 3 2.113 -4.040 6.006
23 HB2 LYS 3 HB2 LYS 3 2.786 -4.569 8.402
24 HB3 LYS 3 HB3 LYS 3 1.577 -3.394 8.942
25 HG2 LYS 3 HG2 LYS 3 -0.215 -4.725 7.977
26 HG3 LYS 3 HG3 LYS 3 0.956 -5.758 7.118
27 HD2 LYS 3 HD2 LYS 3 1.908 -6.479 9.297
28 HD3 LYS 3 HD3 LYS 3 0.676 -5.521 10.144
29 HE2 LYS 3 HE2 LYS 3 -1.104 -6.881 9.143
30 HE3 LYS 3 HE3 LYS 3 0.096 -7.784 8.192
31 HZ1 LYS 3 HZ1 LYS 3 1.056 -8.554 10.230
32 HZ2 LYS 3 HZ2 LYS 3 -0.044 -7.716 11.126
33 HZ3 LYS 3 HZ3 LYS 3 -0.539 -8.964 10.165
34 H LEU 4 H LEU 4 1.275 -2.398 4.560
35 HA LEU 4 HA LEU 4 0.192 0.040 5.690
36 HB2 LEU 4 HB2 LEU 4 0.798 -1.105 2.988
37 HB3 LEU 4 HB3 LEU 4 -0.424 0.180 3.077
38 HG LEU 4 HG LEU 4 1.182 1.610 4.338
39 HD11 LEU 4 HD11 LEU 4 3.146 -0.621 3.666
40 HD12 LEU 4 HD12 LEU 4 3.561 0.955 4.386
41 HD13 LEU 4 HD13 LEU 4 2.568 -0.205 5.295
42 HD21 LEU 4 HD21 LEU 4 0.958 1.790 1.875
43 HD22 LEU 4 HD22 LEU 4 2.626 2.118 2.398
44 HD23 LEU 4 HD23 LEU 4 2.214 0.546 1.672
45 H LYS 5 H LYS 5 -1.670 -0.153 6.778
46 HA LYS 5 HA LYS 5 -3.963 -1.625 5.711
47 HB2 LYS 5 HB2 LYS 5 -3.558 -1.395 8.160
48 HB3 LYS 5 HB3 LYS 5 -3.651 0.370 7.987
49 HG2 LYS 5 HG2 LYS 5 -5.990 0.026 7.011
50 HG3 LYS 5 HG3 LYS 5 -5.883 -1.656 7.580
51 HD2 LYS 5 HD2 LYS 5 -5.500 -0.857 9.879
52 HD3 LYS 5 HD3 LYS 5 -5.487 0.829 9.309
53 HE2 LYS 5 HE2 LYS 5 -7.816 0.585 8.523
54 HE3 LYS 5 HE3 LYS 5 -7.839 -1.095 9.097
55 HZ1 LYS 5 HZ1 LYS 5 -7.433 1.278 10.781
56 HZ2 LYS 5 HZ2 LYS 5 -8.829 0.412 10.663
57 HZ3 LYS 5 HZ3 LYS 5 -7.481 -0.286 11.307
58 H VAL 6 H VAL 6 -4.536 -0.702 3.715
59 HA VAL 6 HA VAL 6 -4.282 2.097 3.209
60 HB VAL 6 HB VAL 6 -6.020 0.050 1.780
61 HG11 VAL 6 HG11 VAL 6 -4.789 2.707 0.907
62 HG12 VAL 6 HG12 VAL 6 -5.683 1.588 -0.147
63 HG13 VAL 6 HG13 VAL 6 -6.519 2.403 1.192
64 HG21 VAL 6 HG21 VAL 6 -3.670 -0.698 1.936
65 HG22 VAL 6 HG22 VAL 6 -4.062 -0.193 0.278
66 HG23 VAL 6 HG23 VAL 6 -3.119 0.884 1.334
67 H GLU 7 H GLU 7 -5.561 3.764 3.646
68 HA GLU 7 HA GLU 7 -7.906 3.427 5.303
69 HB2 GLU 7 HB2 GLU 7 -6.197 5.271 5.468
70 HB3 GLU 7 HB3 GLU 7 -6.776 5.886 3.907
71 HG2 GLU 7 HG2 GLU 7 -7.845 7.129 5.703
72 HG3 GLU 7 HG3 GLU 7 -9.065 6.121 4.900
73 H GLY 8 H GLY 8 -10.066 3.858 4.762
74 HA2 GLY 8 HA2 GLY 8 -10.689 3.765 1.868
75 HA3 GLY 8 HA3 GLY 8 -11.798 3.404 3.212
76 H MET 9 H MET 9 -9.718 6.182 2.150
77 HA MET 9 HA MET 9 -11.333 8.094 3.496
78 HB2 MET 9 HB2 MET 9 -9.379 8.429 1.185
79 HB3 MET 9 HB3 MET 9 -9.965 9.726 2.252
80 HG2 MET 9 HG2 MET 9 -9.028 8.460 4.206
81 HG3 MET 9 HG3 MET 9 -8.366 7.275 3.073
82 HE1 MET 9 HE1 MET 9 -6.988 11.664 3.540
83 HE2 MET 9 HE2 MET 9 -8.595 11.237 2.907
84 HE3 MET 9 HE3 MET 9 -8.164 10.834 4.586
85 H THR 10 H THR 10 -11.209 7.107 0.016
86 HA THR 10 HA THR 10 -13.901 8.308 -0.272
87 HB THR 10 HB THR 10 -13.217 9.278 -2.461
88 HG1 THR 10 HG1 THR 10 -10.908 9.534 -2.711
89 HG21 THR 10 HG21 THR 10 -13.290 10.661 -0.394
90 HG22 THR 10 HG22 THR 10 -11.574 10.282 -0.102
91 HG23 THR 10 HG23 THR 10 -12.049 11.218 -1.538
92 H CYS 11 H CYS 11 -14.934 7.620 -2.356
93 HA CYS 11 HA CYS 11 -15.808 5.863 -3.515
94 HB2 CYS 11 HB2 CYS 11 -12.856 5.496 -4.138
95 HB3 CYS 11 HB3 CYS 11 -14.203 4.810 -5.079
96 HG CYS 11 HG CYS 11 -15.365 7.065 -5.613
97 H ASN 12 H ASN 12 -15.275 5.304 -0.698
98 HA ASN 12 HA ASN 12 -14.109 2.720 -0.392
99 HB2 ASN 12 HB2 ASN 12 -15.203 2.785 1.813
100 HB3 ASN 12 HB3 ASN 12 -14.403 4.326 1.452
101 HD21 ASN 12 HD21 ASN 12 -18.288 4.331 2.424
102 HD22 ASN 12 HD22 ASN 12 -17.192 3.002 2.718
103 H HIS 13 H HIS 13 -16.894 3.621 -2.059
104 HA HIS 13 HA HIS 13 -18.617 1.432 -1.260
105 HB2 HIS 13 HB2 HIS 13 -18.638 3.183 -3.745
106 HB3 HIS 13 HB3 HIS 13 -19.973 2.180 -3.156
107 HD1 HIS 13 HD1 HIS 13 -19.227 5.646 -3.224
108 HD2 HIS 13 HD2 HIS 13 -20.262 2.931 -0.176
109 HE1 HIS 13 HE1 HIS 13 -20.175 7.031 -1.294
110 H CYS 14 H CYS 14 -15.751 1.620 -3.110
111 HA CYS 14 HA CYS 14 -16.388 -0.985 -4.387
112 HB2 CYS 14 HB2 CYS 14 -14.895 1.346 -5.651
113 HB3 CYS 14 HB3 CYS 14 -15.095 -0.272 -6.366
114 HG CYS 14 HG CYS 14 -16.710 1.386 -7.546
115 H VAL 15 H VAL 15 -14.070 -1.842 -5.302
116 HA VAL 15 HA VAL 15 -11.920 -1.189 -3.414
117 HB VAL 15 HB VAL 15 -13.285 -2.879 -2.237
118 HG11 VAL 15 HG11 VAL 15 -13.488 -5.157 -3.112
119 HG12 VAL 15 HG12 VAL 15 -14.246 -4.004 -4.231
120 HG13 VAL 15 HG13 VAL 15 -12.645 -4.687 -4.604
121 HG21 VAL 15 HG21 VAL 15 -11.482 -4.492 -1.801
122 HG22 VAL 15 HG22 VAL 15 -10.643 -3.978 -3.283
123 HG23 VAL 15 HG23 VAL 15 -10.836 -2.842 -1.926
124 H MET 16 H MET 16 -9.919 -1.503 -4.291
125 HA MET 16 HA MET 16 -9.566 -3.257 -6.619
126 HB2 MET 16 HB2 MET 16 -9.049 -0.247 -6.699
127 HB3 MET 16 HB3 MET 16 -8.377 -1.421 -7.845
128 HG2 MET 16 HG2 MET 16 -10.222 -0.753 -9.005
129 HG3 MET 16 HG3 MET 16 -10.866 -2.167 -8.169
130 HE1 MET 16 HE1 MET 16 -13.939 0.208 -8.392
131 HE2 MET 16 HE2 MET 16 -12.649 -0.054 -9.592
132 HE3 MET 16 HE3 MET 16 -13.302 -1.430 -8.673
133 H ALA 17 H ALA 17 -7.238 -3.531 -7.104
134 HA ALA 17 HA ALA 17 -5.694 -3.684 -4.658
135 HB1 ALA 17 HB1 ALA 17 -5.585 -5.423 -6.400
136 HB2 ALA 17 HB2 ALA 17 -4.948 -4.233 -7.561
137 HB3 ALA 17 HB3 ALA 17 -3.988 -4.686 -6.133
138 H VAL 18 H VAL 18 -4.773 -1.910 -3.808
139 HA VAL 18 HA VAL 18 -4.129 0.442 -5.301
140 HB VAL 18 HB VAL 18 -3.128 -0.421 -2.549
141 HG11 VAL 18 HG11 VAL 18 -3.169 2.081 -2.202
142 HG12 VAL 18 HG12 VAL 18 -1.953 1.538 -3.381
143 HG13 VAL 18 HG13 VAL 18 -3.480 2.265 -3.939
144 HG21 VAL 18 HG21 VAL 18 -5.236 1.332 -2.200
145 HG22 VAL 18 HG22 VAL 18 -5.790 0.387 -3.580
146 HG23 VAL 18 HG23 VAL 18 -5.366 -0.449 -2.068
147 H THR 19 H THR 19 -2.641 -2.581 -5.145
148 HA THR 19 HA THR 19 0.008 -2.360 -4.837
149 HB THR 19 HB THR 19 -1.391 -3.778 -7.129
150 HG1 THR 19 HG1 THR 19 -1.502 -5.466 -5.603
151 HG21 THR 19 HG21 THR 19 1.200 -4.445 -5.677
152 HG22 THR 19 HG22 THR 19 0.467 -5.362 -7.004
153 HG23 THR 19 HG23 THR 19 1.102 -3.730 -7.308
154 H LYS 20 H LYS 20 -1.734 -1.135 -7.746
155 HA LYS 20 HA LYS 20 0.588 -0.772 -9.332
156 HB2 LYS 20 HB2 LYS 20 -2.063 0.726 -9.330
157 HB3 LYS 20 HB3 LYS 20 -0.857 0.767 -10.638
158 HG2 LYS 20 HG2 LYS 20 -1.054 -1.679 -10.913
159 HG3 LYS 20 HG3 LYS 20 -2.251 -1.741 -9.600
160 HD2 LYS 20 HD2 LYS 20 -3.775 -0.303 -10.887
161 HD3 LYS 20 HD3 LYS 20 -2.568 -0.166 -12.188
162 HE2 LYS 20 HE2 LYS 20 -2.636 -2.624 -12.502
163 HE3 LYS 20 HE3 LYS 20 -3.858 -2.751 -11.221
164 HZ1 LYS 20 HZ1 LYS 20 -5.300 -1.387 -12.555
165 HZ2 LYS 20 HZ2 LYS 20 -4.164 -1.285 -13.748
166 HZ3 LYS 20 HZ3 LYS 20 -4.849 -2.739 -13.378
167 H ALA 21 H ALA 21 -0.659 1.122 -6.635
168 HA ALA 21 HA ALA 21 0.924 3.484 -7.313
169 HB1 ALA 21 HB1 ALA 21 -0.542 2.662 -4.776
170 HB2 ALA 21 HB2 ALA 21 0.132 4.273 -5.119
171 HB3 ALA 21 HB3 ALA 21 -1.217 3.645 -6.096
172 H LEU 22 H LEU 22 1.323 0.458 -5.561
173 HA LEU 22 HA LEU 22 3.547 1.420 -3.940
174 HB2 LEU 22 HB2 LEU 22 2.289 -1.299 -4.499
175 HB3 LEU 22 HB3 LEU 22 3.756 -1.115 -3.533
176 HG LEU 22 HG LEU 22 1.871 -1.280 -2.062
177 HD11 LEU 22 HD11 LEU 22 3.742 0.305 -1.490
178 HD12 LEU 22 HD12 LEU 22 2.734 1.631 -2.098
179 HD13 LEU 22 HD13 LEU 22 2.188 0.680 -0.700
180 HD21 LEU 22 HD21 LEU 22 0.133 -0.464 -3.634
181 HD22 LEU 22 HD22 LEU 22 0.034 0.317 -2.040
182 HD23 LEU 22 HD23 LEU 22 0.736 1.196 -3.413
183 H LYS 23 H LYS 23 3.075 -0.377 -6.996
184 HA LYS 23 HA LYS 23 5.676 -1.414 -7.196
185 HB2 LYS 23 HB2 LYS 23 3.599 -1.982 -8.557
186 HB3 LYS 23 HB3 LYS 23 3.954 -0.544 -9.541
187 HG2 LYS 23 HG2 LYS 23 6.214 -1.472 -10.032
188 HG3 LYS 23 HG3 LYS 23 5.829 -2.901 -9.047
189 HD2 LYS 23 HD2 LYS 23 3.973 -3.464 -10.570
190 HD3 LYS 23 HD3 LYS 23 4.343 -2.027 -11.559
191 HE2 LYS 23 HE2 LYS 23 6.608 -2.902 -11.998
192 HE3 LYS 23 HE3 LYS 23 6.275 -4.315 -10.980
193 HZ1 LYS 23 HZ1 LYS 23 4.852 -3.619 -13.455
194 HZ2 LYS 23 HZ2 LYS 23 5.990 -4.798 -13.294
195 HZ3 LYS 23 HZ3 LYS 23 4.552 -4.937 -12.504
196 H LYS 24 H LYS 24 4.565 1.881 -7.654
197 HA LYS 24 HA LYS 24 6.659 2.642 -9.478
198 HB2 LYS 24 HB2 LYS 24 4.953 4.334 -7.616
199 HB3 LYS 24 HB3 LYS 24 5.874 4.919 -9.018
200 HG2 LYS 24 HG2 LYS 24 4.486 3.514 -10.516
201 HG3 LYS 24 HG3 LYS 24 3.578 2.914 -9.107
202 HD2 LYS 24 HD2 LYS 24 2.936 5.266 -8.564
203 HD3 LYS 24 HD3 LYS 24 3.744 5.804 -10.054
204 HE2 LYS 24 HE2 LYS 24 2.235 4.357 -11.386
205 HE3 LYS 24 HE3 LYS 24 1.443 3.813 -9.894
206 HZ1 LYS 24 HZ1 LYS 24 1.497 6.568 -10.912
207 HZ2 LYS 24 HZ2 LYS 24 0.202 5.550 -10.918
208 HZ3 LYS 24 HZ3 LYS 24 0.814 6.096 -9.489
209 H VAL 25 H VAL 25 6.653 2.105 -6.022
210 HA VAL 25 HA VAL 25 8.624 4.140 -5.431
211 HB VAL 25 HB VAL 25 7.577 1.719 -3.932
212 HG11 VAL 25 HG11 VAL 25 8.696 2.673 -1.940
213 HG12 VAL 25 HG12 VAL 25 9.870 2.178 -3.177
214 HG13 VAL 25 HG13 VAL 25 9.471 3.900 -2.968
215 HG21 VAL 25 HG21 VAL 25 6.477 3.489 -2.564
216 HG22 VAL 25 HG22 VAL 25 7.172 4.727 -3.633
217 HG23 VAL 25 HG23 VAL 25 5.979 3.572 -4.271
218 HA PRO 26 HA PRO 26 12.164 1.959 -7.006
219 HB2 PRO 26 HB2 PRO 26 13.507 3.650 -4.905
220 HB3 PRO 26 HB3 PRO 26 13.978 3.415 -6.621
221 HG2 PRO 26 HG2 PRO 26 12.731 5.694 -5.848
222 HG3 PRO 26 HG3 PRO 26 12.238 4.870 -7.367
223 HD2 PRO 26 HD2 PRO 26 10.903 4.763 -4.656
224 HD3 PRO 26 HD3 PRO 26 10.161 4.931 -6.280
225 H GLY 27 H GLY 27 13.260 0.114 -6.355
226 HA2 GLY 27 HA2 GLY 27 14.387 -1.282 -4.858
227 HA3 GLY 27 HA3 GLY 27 13.703 -0.385 -3.491
228 H VAL 28 H VAL 28 10.943 -0.608 -4.916
229 HA VAL 28 HA VAL 28 10.186 -3.134 -3.646
230 HB VAL 28 HB VAL 28 8.652 -1.011 -5.200
231 HG11 VAL 28 HG11 VAL 28 7.573 -3.204 -5.489
232 HG12 VAL 28 HG12 VAL 28 7.621 -3.470 -3.730
233 HG13 VAL 28 HG13 VAL 28 6.615 -2.169 -4.409
234 HG21 VAL 28 HG21 VAL 28 8.745 -1.752 -2.243
235 HG22 VAL 28 HG22 VAL 28 9.470 -0.304 -2.981
236 HG23 VAL 28 HG23 VAL 28 7.704 -0.503 -2.964
237 H GLU 29 H GLU 29 9.873 -5.073 -4.710
238 HA GLU 29 HA GLU 29 9.873 -4.938 -7.688
239 HB2 GLU 29 HB2 GLU 29 12.094 -5.644 -6.857
240 HB3 GLU 29 HB3 GLU 29 11.327 -6.970 -5.953
241 HG2 GLU 29 HG2 GLU 29 10.447 -7.903 -8.072
242 HG3 GLU 29 HG3 GLU 29 11.208 -6.577 -8.973
243 H LYS 30 H LYS 30 8.755 -6.497 -4.691
244 HA LYS 30 HA LYS 30 6.596 -7.735 -6.309
245 HB2 LYS 30 HB2 LYS 30 8.211 -9.066 -4.103
246 HB3 LYS 30 HB3 LYS 30 6.730 -9.736 -4.833
247 HG2 LYS 30 HG2 LYS 30 7.786 -9.686 -7.061
248 HG3 LYS 30 HG3 LYS 30 9.262 -8.990 -6.361
249 HD2 LYS 30 HD2 LYS 30 9.589 -11.027 -4.991
250 HD3 LYS 30 HD3 LYS 30 8.094 -11.709 -5.679
251 HE2 LYS 30 HE2 LYS 30 9.395 -12.568 -7.307
252 HE3 LYS 30 HE3 LYS 30 9.480 -10.915 -7.945
253 HZ1 LYS 30 HZ1 LYS 30 11.469 -10.612 -6.619
254 HZ2 LYS 30 HZ2 LYS 30 11.373 -12.166 -6.073
255 HZ3 LYS 30 HZ3 LYS 30 11.641 -11.867 -7.674
256 H VAL 31 H VAL 31 4.594 -8.020 -5.189
257 HA VAL 31 HA VAL 31 4.337 -6.643 -2.590
258 HB VAL 31 HB VAL 31 2.799 -5.888 -5.111
259 HG11 VAL 31 HG11 VAL 31 1.446 -5.768 -3.025
260 HG12 VAL 31 HG12 VAL 31 2.698 -4.745 -2.297
261 HG13 VAL 31 HG13 VAL 31 1.775 -4.149 -3.691
262 HG21 VAL 31 HG21 VAL 31 3.885 -3.673 -4.822
263 HG22 VAL 31 HG22 VAL 31 4.854 -4.333 -3.483
264 HG23 VAL 31 HG23 VAL 31 5.074 -4.954 -5.137
265 H GLU 32 H GLU 32 2.436 -7.252 -1.451
266 HA GLU 32 HA GLU 32 0.674 -9.259 -2.721
267 HB2 GLU 32 HB2 GLU 32 2.525 -10.469 -1.589
268 HB3 GLU 32 HB3 GLU 32 2.113 -9.652 -0.066
269 HG2 GLU 32 HG2 GLU 32 -0.114 -10.678 -0.087
270 HG3 GLU 32 HG3 GLU 32 0.201 -11.390 -1.682
271 H VAL 33 H VAL 33 -1.423 -8.768 -2.275
272 HA VAL 33 HA VAL 33 -1.961 -7.102 0.127
273 HB VAL 33 HB VAL 33 -3.424 -5.677 -1.207
274 HG11 VAL 33 HG11 VAL 33 -0.679 -5.987 -2.498
275 HG12 VAL 33 HG12 VAL 33 -1.715 -4.549 -2.579
276 HG13 VAL 33 HG13 VAL 33 -1.029 -5.060 -1.020
277 HG21 VAL 33 HG21 VAL 33 -2.476 -7.340 -3.581
278 HG22 VAL 33 HG22 VAL 33 -4.122 -7.335 -2.902
279 HG23 VAL 33 HG23 VAL 33 -3.474 -5.870 -3.671
280 H SER 34 H SER 34 -4.186 -7.120 0.846
281 HA SER 34 HA SER 34 -5.775 -9.434 -0.149
282 HB2 SER 34 HB2 SER 34 -4.729 -10.030 1.988
283 HB3 SER 34 HB3 SER 34 -5.381 -8.555 2.739
284 HG SER 34 HG SER 34 -6.631 -10.545 3.022
285 H LEU 35 H LEU 35 -7.355 -8.448 -1.275
286 HA LEU 35 HA LEU 35 -8.133 -5.762 -0.894
287 HB2 LEU 35 HB2 LEU 35 -9.713 -8.002 -2.207
288 HB3 LEU 35 HB3 LEU 35 -9.884 -6.265 -2.511
289 HG LEU 35 HG LEU 35 -7.424 -7.953 -3.107
290 HD11 LEU 35 HD11 LEU 35 -8.018 -7.555 -5.467
291 HD12 LEU 35 HD12 LEU 35 -9.334 -8.396 -4.619
292 HD13 LEU 35 HD13 LEU 35 -9.466 -6.654 -4.960
293 HD21 LEU 35 HD21 LEU 35 -7.925 -5.113 -4.033
294 HD22 LEU 35 HD22 LEU 35 -7.079 -5.463 -2.493
295 HD23 LEU 35 HD23 LEU 35 -6.417 -6.031 -4.037
296 H GLU 36 H GLU 36 -9.222 -8.664 0.786
297 HA GLU 36 HA GLU 36 -11.792 -7.458 1.478
298 HB2 GLU 36 HB2 GLU 36 -10.351 -9.966 2.424
299 HB3 GLU 36 HB3 GLU 36 -11.995 -9.495 2.916
300 HG2 GLU 36 HG2 GLU 36 -12.705 -9.482 0.548
301 HG3 GLU 36 HG3 GLU 36 -11.074 -9.978 0.055
302 H LYS 37 H LYS 37 -8.568 -7.807 2.978
303 HA LYS 37 HA LYS 37 -9.709 -6.723 5.478
304 HB2 LYS 37 HB2 LYS 37 -7.030 -8.036 4.909
305 HB3 LYS 37 HB3 LYS 37 -7.587 -7.443 6.496
306 HG2 LYS 37 HG2 LYS 37 -9.653 -8.883 6.206
307 HG3 LYS 37 HG3 LYS 37 -8.870 -9.619 4.791
308 HD2 LYS 37 HD2 LYS 37 -7.005 -10.386 6.208
309 HD3 LYS 37 HD3 LYS 37 -7.718 -9.550 7.610
310 HE2 LYS 37 HE2 LYS 37 -9.791 -10.937 7.315
311 HE3 LYS 37 HE3 LYS 37 -8.955 -11.852 6.044
312 HZ1 LYS 37 HZ1 LYS 37 -8.831 -12.935 8.164
313 HZ2 LYS 37 HZ2 LYS 37 -7.324 -12.485 7.678
314 HZ3 LYS 37 HZ3 LYS 37 -8.104 -11.622 8.848
315 H GLY 38 H GLY 38 -8.080 -5.527 2.712
316 HA2 GLY 38 HA2 GLY 38 -7.412 -3.339 2.347
317 HA3 GLY 38 HA3 GLY 38 -7.846 -2.954 4.022
318 H GLU 39 H GLU 39 -5.668 -5.640 3.343
319 HA GLU 39 HA GLU 39 -3.489 -4.173 4.750
320 HB2 GLU 39 HB2 GLU 39 -3.868 -7.102 3.983
321 HB3 GLU 39 HB3 GLU 39 -2.482 -6.451 4.880
322 HG2 GLU 39 HG2 GLU 39 -3.977 -5.734 6.700
323 HG3 GLU 39 HG3 GLU 39 -5.381 -6.362 5.810
324 H ALA 40 H ALA 40 -1.367 -4.175 3.870
325 HA ALA 40 HA ALA 40 -1.030 -4.988 1.062
326 HB1 ALA 40 HB1 ALA 40 -1.950 -2.707 0.924
327 HB2 ALA 40 HB2 ALA 40 -0.719 -2.128 2.065
328 HB3 ALA 40 HB3 ALA 40 -0.236 -2.706 0.459
329 H LEU 41 H LEU 41 0.694 -6.256 1.291
330 HA LEU 41 HA LEU 41 2.952 -5.371 3.025
331 HB2 LEU 41 HB2 LEU 41 2.165 -8.087 1.870
332 HB3 LEU 41 HB3 LEU 41 3.703 -7.756 2.669
333 HG LEU 41 HG LEU 41 2.327 -8.787 4.287
334 HD11 LEU 41 HD11 LEU 41 3.632 -6.795 5.054
335 HD12 LEU 41 HD12 LEU 41 2.176 -5.794 4.830
336 HD13 LEU 41 HD13 LEU 41 2.182 -7.103 6.033
337 HD21 LEU 41 HD21 LEU 41 0.103 -8.039 4.908
338 HD22 LEU 41 HD22 LEU 41 0.181 -6.698 3.749
339 HD23 LEU 41 HD23 LEU 41 0.143 -8.380 3.164
340 H VAL 42 H VAL 42 5.080 -5.426 2.122
341 HA VAL 42 HA VAL 42 5.187 -5.737 -0.832
342 HB VAL 42 HB VAL 42 6.679 -3.793 -0.980
343 HG11 VAL 42 HG11 VAL 42 4.984 -2.134 -0.933
344 HG12 VAL 42 HG12 VAL 42 4.144 -3.658 -1.228
345 HG13 VAL 42 HG13 VAL 42 4.113 -2.946 0.404
346 HG21 VAL 42 HG21 VAL 42 5.926 -3.301 1.932
347 HG22 VAL 42 HG22 VAL 42 7.526 -3.819 1.353
348 HG23 VAL 42 HG23 VAL 42 6.892 -2.223 0.897
349 H GLU 43 H GLU 43 7.450 -6.089 -1.609
350 HA GLU 43 HA GLU 43 9.263 -7.058 0.516
351 HB2 GLU 43 HB2 GLU 43 7.890 -8.961 -0.440
352 HB3 GLU 43 HB3 GLU 43 8.689 -8.662 -2.000
353 HG2 GLU 43 HG2 GLU 43 10.891 -9.022 -0.944
354 HG3 GLU 43 HG3 GLU 43 10.116 -9.219 0.640
355 H GLY 44 H GLY 44 10.538 -5.242 0.211
356 HA2 GLY 44 HA2 GLY 44 12.269 -5.277 -2.132
357 HA3 GLY 44 HA3 GLY 44 11.203 -3.858 -2.023
358 H THR 45 H THR 45 13.444 -2.839 -1.906
359 HA THR 45 HA THR 45 14.393 -2.773 0.918
360 HB THR 45 HB THR 45 16.611 -2.106 -0.106
361 HG1 THR 45 HG1 THR 45 16.356 -1.555 -2.123
362 HG21 THR 45 HG21 THR 45 16.849 -4.519 -1.248
363 HG22 THR 45 HG22 THR 45 16.640 -4.350 0.526
364 HG23 THR 45 HG23 THR 45 15.265 -4.768 -0.519
365 H ALA 46 H ALA 46 12.191 -1.207 -0.387
366 HA ALA 46 HA ALA 46 13.229 1.440 -0.903
367 HB1 ALA 46 HB1 ALA 46 10.843 2.062 -0.897
368 HB2 ALA 46 HB2 ALA 46 11.104 0.581 -1.850
369 HB3 ALA 46 HB3 ALA 46 10.421 0.475 -0.212
370 H ASP 47 H ASP 47 12.373 3.358 0.426
371 HA ASP 47 HA ASP 47 13.262 2.977 3.161
372 HB2 ASP 47 HB2 ASP 47 12.080 5.372 1.694
373 HB3 ASP 47 HB3 ASP 47 12.793 5.420 3.318
374 HA PRO 48 HA PRO 48 9.449 2.285 5.196
375 HB2 PRO 48 HB2 PRO 48 10.336 4.458 7.088
376 HB3 PRO 48 HB3 PRO 48 9.729 2.813 7.477
377 HG2 PRO 48 HG2 PRO 48 12.379 3.327 7.592
378 HG3 PRO 48 HG3 PRO 48 11.799 1.821 6.801
379 HD2 PRO 48 HD2 PRO 48 12.650 4.415 5.493
380 HD3 PRO 48 HD3 PRO 48 13.064 2.730 5.041
381 H LYS 49 H LYS 49 10.352 5.784 5.049
382 HA LYS 49 HA LYS 49 7.605 6.663 5.256
383 HB2 LYS 49 HB2 LYS 49 10.130 8.116 4.367
384 HB3 LYS 49 HB3 LYS 49 8.585 8.882 4.786
385 HG2 LYS 49 HG2 LYS 49 8.756 7.964 7.084
386 HG3 LYS 49 HG3 LYS 49 10.312 7.210 6.664
387 HD2 LYS 49 HD2 LYS 49 11.249 9.438 6.133
388 HD3 LYS 49 HD3 LYS 49 9.699 10.196 6.563
389 HE2 LYS 49 HE2 LYS 49 9.899 9.344 8.863
390 HE3 LYS 49 HE3 LYS 49 11.416 8.522 8.443
391 HZ1 LYS 49 HZ1 LYS 49 12.375 10.649 7.966
392 HZ2 LYS 49 HZ2 LYS 49 10.968 11.423 8.337
393 HZ3 LYS 49 HZ3 LYS 49 11.799 10.624 9.513
394 H ALA 50 H ALA 50 9.877 5.994 2.584
395 HA ALA 50 HA ALA 50 8.469 7.412 0.583
396 HB1 ALA 50 HB1 ALA 50 10.781 6.603 0.333
397 HB2 ALA 50 HB2 ALA 50 10.202 4.919 0.356
398 HB3 ALA 50 HB3 ALA 50 9.751 5.999 -0.984
399 H LEU 51 H LEU 51 7.987 4.166 1.971
400 HA LEU 51 HA LEU 51 6.314 3.219 -0.139
401 HB2 LEU 51 HB2 LEU 51 7.537 1.938 1.796
402 HB3 LEU 51 HB3 LEU 51 6.087 2.336 2.746
403 HG LEU 51 HG LEU 51 4.763 1.381 0.715
404 HD11 LEU 51 HD11 LEU 51 6.011 -0.250 -0.645
405 HD12 LEU 51 HD12 LEU 51 6.771 1.352 -0.797
406 HD13 LEU 51 HD13 LEU 51 7.505 0.118 0.247
407 HD21 LEU 51 HD21 LEU 51 5.062 0.256 2.952
408 HD22 LEU 51 HD22 LEU 51 4.888 -0.877 1.588
409 HD23 LEU 51 HD23 LEU 51 6.491 -0.564 2.289
410 H VAL 52 H VAL 52 5.579 4.604 3.106
411 HA VAL 52 HA VAL 52 2.740 4.476 2.768
412 HB VAL 52 HB VAL 52 4.489 6.152 4.617
413 HG11 VAL 52 HG11 VAL 52 1.546 5.374 4.785
414 HG12 VAL 52 HG12 VAL 52 2.470 6.200 6.063
415 HG13 VAL 52 HG13 VAL 52 2.187 7.012 4.509
416 HG21 VAL 52 HG21 VAL 52 4.041 4.343 6.245
417 HG22 VAL 52 HG22 VAL 52 3.149 3.441 4.997
418 HG23 VAL 52 HG23 VAL 52 4.897 3.721 4.817
419 H GLN 53 H GLN 53 5.206 6.873 1.897
420 HA GLN 53 HA GLN 53 3.356 9.056 1.601
421 HB2 GLN 53 HB2 GLN 53 5.777 9.314 2.033
422 HB3 GLN 53 HB3 GLN 53 6.139 8.595 0.450
423 HG2 GLN 53 HG2 GLN 53 4.956 10.442 -0.673
424 HG3 GLN 53 HG3 GLN 53 4.519 11.134 0.903
425 HE21 GLN 53 HE21 GLN 53 8.388 11.468 -0.542
426 HE22 GLN 53 HE22 GLN 53 7.273 10.312 -1.237
427 H ALA 54 H ALA 54 4.568 6.470 -0.509
428 HA ALA 54 HA ALA 54 3.936 7.584 -3.002
429 HB1 ALA 54 HB1 ALA 54 3.938 5.238 -3.780
430 HB2 ALA 54 HB2 ALA 54 5.290 5.563 -2.669
431 HB3 ALA 54 HB3 ALA 54 3.856 4.680 -2.093
432 H VAL 55 H VAL 55 1.909 5.354 -0.985
433 HA VAL 55 HA VAL 55 -0.300 5.544 -2.832
434 HB VAL 55 HB VAL 55 -1.520 4.333 -1.020
435 HG11 VAL 55 HG11 VAL 55 -0.103 2.319 -1.071
436 HG12 VAL 55 HG12 VAL 55 -0.129 3.120 -2.659
437 HG13 VAL 55 HG13 VAL 55 1.287 3.298 -1.596
438 HG21 VAL 55 HG21 VAL 55 -0.261 3.640 0.994
439 HG22 VAL 55 HG22 VAL 55 1.107 4.659 0.501
440 HG23 VAL 55 HG23 VAL 55 -0.450 5.406 0.935
441 H GLU 56 H GLU 56 0.775 7.466 -0.060
442 HA GLU 56 HA GLU 56 -1.830 8.591 0.446
443 HB2 GLU 56 HB2 GLU 56 -0.003 8.546 2.107
444 HB3 GLU 56 HB3 GLU 56 0.952 9.648 1.093
445 HG2 GLU 56 HG2 GLU 56 -0.775 11.381 1.307
446 HG3 GLU 56 HG3 GLU 56 -1.804 10.269 2.234
447 H GLU 57 H GLU 57 0.700 9.130 -1.921
448 HA GLU 57 HA GLU 57 -0.123 11.780 -2.688
449 HB2 GLU 57 HB2 GLU 57 2.097 10.770 -3.195
450 HB3 GLU 57 HB3 GLU 57 1.304 9.621 -4.292
451 HG2 GLU 57 HG2 GLU 57 0.496 11.476 -5.687
452 HG3 GLU 57 HG3 GLU 57 1.184 12.654 -4.550
453 H GLU 58 H GLU 58 -1.295 8.512 -3.294
454 HA GLU 58 HA GLU 58 -2.893 9.285 -5.611
455 HB2 GLU 58 HB2 GLU 58 -2.894 6.811 -3.833
456 HB3 GLU 58 HB3 GLU 58 -3.873 7.004 -5.301
457 HG2 GLU 58 HG2 GLU 58 -0.832 7.152 -5.186
458 HG3 GLU 58 HG3 GLU 58 -1.774 5.756 -5.739
459 H GLY 59 H GLY 59 -3.089 9.747 -2.240
460 HA2 GLY 59 HA2 GLY 59 -4.810 11.197 -1.402
461 HA3 GLY 59 HA3 GLY 59 -5.947 10.498 -2.568
462 H TYR 60 H TYR 60 -3.968 8.085 -1.086
463 HA TYR 60 HA TYR 60 -6.113 7.564 0.915
464 HB2 TYR 60 HB2 TYR 60 -4.774 5.548 -0.915
465 HB3 TYR 60 HB3 TYR 60 -5.996 5.194 0.314
466 HD1 TYR 60 HD1 TYR 60 -5.371 6.380 -3.068
467 HD2 TYR 60 HD2 TYR 60 -8.329 6.079 0.033
468 HE1 TYR 60 HE1 TYR 60 -7.148 6.863 -4.728
469 HE2 TYR 60 HE2 TYR 60 -10.117 6.564 -1.615
470 HH TYR 60 HH TYR 60 -10.600 7.115 -3.785
471 H LYS 61 H LYS 61 -5.251 7.626 2.892
472 HA LYS 61 HA LYS 61 -2.451 7.463 3.418
473 HB2 LYS 61 HB2 LYS 61 -4.861 7.059 5.237
474 HB3 LYS 61 HB3 LYS 61 -3.194 7.309 5.793
475 HG2 LYS 61 HG2 LYS 61 -3.142 9.534 4.782
476 HG3 LYS 61 HG3 LYS 61 -4.753 9.281 4.072
477 HD2 LYS 61 HD2 LYS 61 -5.705 9.005 6.351
478 HD3 LYS 61 HD3 LYS 61 -4.101 9.329 7.050
479 HE2 LYS 61 HE2 LYS 61 -4.091 11.569 5.986
480 HE3 LYS 61 HE3 LYS 61 -5.664 11.212 5.245
481 HZ1 LYS 61 HZ1 LYS 61 -5.062 11.638 8.069
482 HZ2 LYS 61 HZ2 LYS 61 -6.139 12.421 7.115
483 HZ3 LYS 61 HZ3 LYS 61 -6.454 10.875 7.583
484 H ALA 62 H ALA 62 -1.532 5.780 5.003
485 HA ALA 62 HA ALA 62 -2.767 3.126 4.795
486 HB1 ALA 62 HB1 ALA 62 -1.475 3.327 2.710
487 HB2 ALA 62 HB2 ALA 62 -0.013 3.722 3.646
488 HB3 ALA 62 HB3 ALA 62 -0.769 2.116 3.800
489 H GLU 63 H GLU 63 -2.931 3.123 7.033
490 HA GLU 63 HA GLU 63 -0.814 3.904 8.786
491 HB2 GLU 63 HB2 GLU 63 -3.249 3.863 9.340
492 HB3 GLU 63 HB3 GLU 63 -3.198 2.087 9.313
493 HG2 GLU 63 HG2 GLU 63 -1.444 2.149 11.091
494 HG3 GLU 63 HG3 GLU 63 -1.568 3.920 11.127
495 H VAL 64 H VAL 64 1.148 2.828 8.666
496 HA VAL 64 HA VAL 64 1.467 0.065 8.130
497 HB VAL 64 HB VAL 64 3.714 0.390 9.152
498 HG11 VAL 64 HG11 VAL 64 3.274 1.013 6.814
499 HG12 VAL 64 HG12 VAL 64 2.764 2.637 7.330
500 HG13 VAL 64 HG13 VAL 64 4.452 2.121 7.552
501 HG21 VAL 64 HG21 VAL 64 4.271 2.821 9.761
502 HG22 VAL 64 HG22 VAL 64 2.529 3.083 9.923
503 HG23 VAL 64 HG23 VAL 64 3.344 1.903 10.977
504 H LEU 65 H LEU 65 0.607 -1.563 9.289
505 HA LEU 65 HA LEU 65 -0.167 -1.169 12.074
506 HB2 LEU 65 HB2 LEU 65 -0.199 -3.616 10.259
507 HB3 LEU 65 HB3 LEU 65 -0.949 -3.523 11.866
508 HG LEU 65 HG LEU 65 -1.684 -1.751 9.484
509 HD11 LEU 65 HD11 LEU 65 -3.897 -3.182 9.974
510 HD12 LEU 65 HD12 LEU 65 -2.611 -3.812 8.895
511 HD13 LEU 65 HD13 LEU 65 -2.728 -4.348 10.589
512 HD21 LEU 65 HD21 LEU 65 -2.054 -0.672 11.682
513 HD22 LEU 65 HD22 LEU 65 -3.597 -1.123 10.933
514 HD23 LEU 65 HD23 LEU 65 -2.928 -2.119 12.245
515 H ALA 66 H ALA 66 2.036 -0.637 12.809
516 HA ALA 66 HA ALA 66 3.618 -3.088 13.406
517 HB1 ALA 66 HB1 ALA 66 4.499 -0.478 12.144
518 HB2 ALA 66 HB2 ALA 66 5.646 -1.468 13.099
519 HB3 ALA 66 HB3 ALA 66 4.867 -2.130 11.646
Start of MODEL 13
1 H1 MET 1 H MET 1 8.145 -4.272 10.903
2 HA MET 1 HA MET 1 9.014 -4.090 8.641
3 HB2 MET 1 HB2 MET 1 8.787 -6.623 8.384
4 HB3 MET 1 HB3 MET 1 7.099 -6.332 7.925
5 HG2 MET 1 HG2 MET 1 7.836 -4.944 6.044
6 HG3 MET 1 HG3 MET 1 9.513 -5.031 6.601
7 HE1 MET 1 HE1 MET 1 8.664 -5.550 3.636
8 HE2 MET 1 HE2 MET 1 10.339 -5.683 4.223
9 HE3 MET 1 HE3 MET 1 9.633 -6.991 3.245
10 H LEU 2 H LEU 2 7.205 -3.785 6.546
11 HA LEU 2 HA LEU 2 5.350 -1.842 7.772
12 HB2 LEU 2 HB2 LEU 2 6.019 -2.477 4.866
13 HB3 LEU 2 HB3 LEU 2 5.030 -1.114 5.431
14 HG LEU 2 HG LEU 2 7.955 -1.587 6.151
15 HD11 LEU 2 HD11 LEU 2 6.667 0.438 4.279
16 HD12 LEU 2 HD12 LEU 2 8.395 0.341 4.684
17 HD13 LEU 2 HD13 LEU 2 7.623 -0.979 3.776
18 HD21 LEU 2 HD21 LEU 2 6.739 -0.361 7.909
19 HD22 LEU 2 HD22 LEU 2 7.823 0.738 7.031
20 HD23 LEU 2 HD23 LEU 2 6.079 0.757 6.688
21 H LYS 3 H LYS 3 3.131 -1.835 7.317
22 HA LYS 3 HA LYS 3 1.855 -4.184 6.160
23 HB2 LYS 3 HB2 LYS 3 2.596 -4.768 8.529
24 HB3 LYS 3 HB3 LYS 3 1.466 -3.540 9.120
25 HG2 LYS 3 HG2 LYS 3 -0.421 -4.773 8.194
26 HG3 LYS 3 HG3 LYS 3 0.675 -5.868 7.317
27 HD2 LYS 3 HD2 LYS 3 1.633 -6.631 9.482
28 HD3 LYS 3 HD3 LYS 3 0.456 -5.617 10.347
29 HE2 LYS 3 HE2 LYS 3 -1.396 -6.876 9.334
30 HE3 LYS 3 HE3 LYS 3 -0.249 -7.832 8.377
31 HZ1 LYS 3 HZ1 LYS 3 0.658 -8.679 10.416
32 HZ2 LYS 3 HZ2 LYS 3 -0.415 -7.803 11.311
33 HZ3 LYS 3 HZ3 LYS 3 -0.954 -9.004 10.316
34 H LEU 4 H LEU 4 1.207 -2.401 4.783
35 HA LEU 4 HA LEU 4 0.209 0.054 5.894
36 HB2 LEU 4 HB2 LEU 4 0.780 -1.166 3.227
37 HB3 LEU 4 HB3 LEU 4 -0.404 0.144 3.249
38 HG LEU 4 HG LEU 4 1.189 1.625 4.388
39 HD11 LEU 4 HD11 LEU 4 3.548 0.927 4.671
40 HD12 LEU 4 HD12 LEU 4 2.455 -0.058 5.667
41 HD13 LEU 4 HD13 LEU 4 3.118 -0.719 4.152
42 HD21 LEU 4 HD21 LEU 4 1.162 1.528 1.915
43 HD22 LEU 4 HD22 LEU 4 2.795 1.872 2.530
44 HD23 LEU 4 HD23 LEU 4 2.387 0.238 1.955
45 H LYS 5 H LYS 5 -1.711 0.182 6.858
46 HA LYS 5 HA LYS 5 -4.086 -1.244 5.898
47 HB2 LYS 5 HB2 LYS 5 -3.742 -0.767 8.329
48 HB3 LYS 5 HB3 LYS 5 -3.708 0.971 7.958
49 HG2 LYS 5 HG2 LYS 5 -6.022 0.525 6.815
50 HG3 LYS 5 HG3 LYS 5 -6.046 -0.957 7.793
51 HD2 LYS 5 HD2 LYS 5 -5.860 0.371 9.845
52 HD3 LYS 5 HD3 LYS 5 -5.565 1.848 8.891
53 HE2 LYS 5 HE2 LYS 5 -7.831 1.507 7.808
54 HE3 LYS 5 HE3 LYS 5 -8.113 0.207 8.982
55 HZ1 LYS 5 HZ1 LYS 5 -7.430 2.114 10.606
56 HZ2 LYS 5 HZ2 LYS 5 -7.965 3.061 9.385
57 HZ3 LYS 5 HZ3 LYS 5 -8.996 1.967 10.052
58 H VAL 6 H VAL 6 -4.620 -0.461 3.812
59 HA VAL 6 HA VAL 6 -4.412 2.335 3.174
60 HB VAL 6 HB VAL 6 -6.051 0.137 1.823
61 HG11 VAL 6 HG11 VAL 6 -4.896 2.770 0.804
62 HG12 VAL 6 HG12 VAL 6 -5.737 1.557 -0.190
63 HG13 VAL 6 HG13 VAL 6 -6.617 2.426 1.086
64 HG21 VAL 6 HG21 VAL 6 -4.055 -0.140 0.377
65 HG22 VAL 6 HG22 VAL 6 -3.169 1.022 1.395
66 HG23 VAL 6 HG23 VAL 6 -3.694 -0.538 2.070
67 H GLU 7 H GLU 7 -5.634 3.821 4.220
68 HA GLU 7 HA GLU 7 -8.267 3.223 5.257
69 HB2 GLU 7 HB2 GLU 7 -6.601 4.887 6.206
70 HB3 GLU 7 HB3 GLU 7 -6.945 5.928 4.811
71 HG2 GLU 7 HG2 GLU 7 -8.331 6.637 6.676
72 HG3 GLU 7 HG3 GLU 7 -9.378 5.885 5.458
73 H GLY 8 H GLY 8 -10.086 3.110 4.050
74 HA2 GLY 8 HA2 GLY 8 -10.095 4.286 1.344
75 HA3 GLY 8 HA3 GLY 8 -11.253 3.117 2.010
76 H MET 9 H MET 9 -10.255 6.521 1.961
77 HA MET 9 HA MET 9 -12.275 7.495 3.725
78 HB2 MET 9 HB2 MET 9 -10.791 8.925 1.482
79 HB3 MET 9 HB3 MET 9 -11.634 9.690 2.843
80 HG2 MET 9 HG2 MET 9 -10.099 8.556 4.423
81 HG3 MET 9 HG3 MET 9 -9.263 7.800 3.059
82 HE1 MET 9 HE1 MET 9 -6.907 8.574 3.650
83 HE2 MET 9 HE2 MET 9 -6.510 10.213 4.219
84 HE3 MET 9 HE3 MET 9 -7.604 9.179 5.171
85 H THR 10 H THR 10 -12.214 6.867 0.201
86 HA THR 10 HA THR 10 -15.078 7.647 0.114
87 HB THR 10 HB THR 10 -14.668 8.756 -2.056
88 HG1 THR 10 HG1 THR 10 -12.492 9.199 -2.592
89 HG21 THR 10 HG21 THR 10 -14.690 10.073 0.052
90 HG22 THR 10 HG22 THR 10 -12.931 9.843 0.201
91 HG23 THR 10 HG23 THR 10 -13.594 10.774 -1.159
92 H CYS 11 H CYS 11 -16.085 6.955 -2.021
93 HA CYS 11 HA CYS 11 -16.784 5.262 -3.341
94 HB2 CYS 11 HB2 CYS 11 -13.793 4.874 -3.736
95 HB3 CYS 11 HB3 CYS 11 -15.088 4.282 -4.805
96 HG CYS 11 HG CYS 11 -14.393 6.237 -6.099
97 H ASN 12 H ASN 12 -16.699 4.574 -0.579
98 HA ASN 12 HA ASN 12 -15.421 2.084 -0.115
99 HB2 ASN 12 HB2 ASN 12 -16.804 1.992 1.862
100 HB3 ASN 12 HB3 ASN 12 -16.294 3.673 1.616
101 HD21 ASN 12 HD21 ASN 12 -20.194 2.834 1.975
102 HD22 ASN 12 HD22 ASN 12 -18.885 1.774 2.449
103 H HIS 13 H HIS 13 -17.999 2.758 -2.242
104 HA HIS 13 HA HIS 13 -19.429 0.237 -1.769
105 HB2 HIS 13 HB2 HIS 13 -19.638 2.378 -3.919
106 HB3 HIS 13 HB3 HIS 13 -20.688 0.959 -3.809
107 HD1 HIS 13 HD1 HIS 13 -20.698 4.456 -2.768
108 HD2 HIS 13 HD2 HIS 13 -21.953 0.757 -1.196
109 HE1 HIS 13 HE1 HIS 13 -22.436 4.973 -0.965
110 H CYS 14 H CYS 14 -16.553 1.183 -3.367
111 HA CYS 14 HA CYS 14 -16.686 -1.267 -5.051
112 HB2 CYS 14 HB2 CYS 14 -15.542 1.447 -5.815
113 HB3 CYS 14 HB3 CYS 14 -15.420 -0.033 -6.794
114 HG CYS 14 HG CYS 14 -17.536 -0.006 -7.798
115 H VAL 15 H VAL 15 -14.264 -1.580 -5.949
116 HA VAL 15 HA VAL 15 -12.302 -1.019 -3.816
117 HB VAL 15 HB VAL 15 -13.327 -3.219 -3.314
118 HG11 VAL 15 HG11 VAL 15 -12.972 -5.114 -4.847
119 HG12 VAL 15 HG12 VAL 15 -13.957 -3.855 -5.625
120 HG13 VAL 15 HG13 VAL 15 -12.236 -4.025 -6.044
121 HG21 VAL 15 HG21 VAL 15 -10.500 -3.530 -4.387
122 HG22 VAL 15 HG22 VAL 15 -10.907 -2.715 -2.852
123 HG23 VAL 15 HG23 VAL 15 -11.267 -4.442 -3.073
124 H MET 16 H MET 16 -10.070 -1.226 -4.614
125 HA MET 16 HA MET 16 -9.833 -1.416 -7.561
126 HB2 MET 16 HB2 MET 16 -8.974 0.954 -5.856
127 HB3 MET 16 HB3 MET 16 -8.513 0.707 -7.555
128 HG2 MET 16 HG2 MET 16 -10.879 0.693 -8.210
129 HG3 MET 16 HG3 MET 16 -11.369 0.915 -6.527
130 HE1 MET 16 HE1 MET 16 -10.350 4.511 -5.661
131 HE2 MET 16 HE2 MET 16 -11.209 3.035 -5.167
132 HE3 MET 16 HE3 MET 16 -9.437 3.021 -5.327
133 H ALA 17 H ALA 17 -7.575 -1.580 -8.269
134 HA ALA 17 HA ALA 17 -6.072 -3.295 -6.468
135 HB1 ALA 17 HB1 ALA 17 -6.263 -3.778 -8.875
136 HB2 ALA 17 HB2 ALA 17 -5.463 -2.235 -9.258
137 HB3 ALA 17 HB3 ALA 17 -4.564 -3.519 -8.414
138 H VAL 18 H VAL 18 -5.383 -1.965 -4.740
139 HA VAL 18 HA VAL 18 -3.984 0.509 -5.165
140 HB VAL 18 HB VAL 18 -3.938 -1.402 -2.797
141 HG11 VAL 18 HG11 VAL 18 -3.524 0.758 -1.529
142 HG12 VAL 18 HG12 VAL 18 -2.177 0.258 -2.581
143 HG13 VAL 18 HG13 VAL 18 -3.280 1.559 -3.092
144 HG21 VAL 18 HG21 VAL 18 -6.238 -0.545 -3.649
145 HG22 VAL 18 HG22 VAL 18 -5.834 -0.270 -1.929
146 HG23 VAL 18 HG23 VAL 18 -5.687 1.044 -3.116
147 H THR 19 H THR 19 -3.129 -2.785 -5.628
148 HA THR 19 HA THR 19 -0.557 -3.018 -4.727
149 HB THR 19 HB THR 19 -1.554 -4.027 -7.413
150 HG1 THR 19 HG1 THR 19 -2.347 -5.764 -6.153
151 HG21 THR 19 HG21 THR 19 -0.115 -5.965 -6.865
152 HG22 THR 19 HG22 THR 19 0.833 -4.461 -6.913
153 HG23 THR 19 HG23 THR 19 0.374 -5.175 -5.349
154 H LYS 20 H LYS 20 -1.578 -1.456 -7.824
155 HA LYS 20 HA LYS 20 1.071 -1.214 -8.817
156 HB2 LYS 20 HB2 LYS 20 -1.417 0.429 -9.426
157 HB3 LYS 20 HB3 LYS 20 0.089 0.443 -10.369
158 HG2 LYS 20 HG2 LYS 20 -0.162 -2.048 -10.680
159 HG3 LYS 20 HG3 LYS 20 -1.774 -1.927 -9.934
160 HD2 LYS 20 HD2 LYS 20 -2.454 -0.313 -11.693
161 HD3 LYS 20 HD3 LYS 20 -0.824 -0.406 -12.401
162 HE2 LYS 20 HE2 LYS 20 -1.163 -2.886 -12.683
163 HE3 LYS 20 HE3 LYS 20 -2.847 -2.669 -12.164
164 HZ1 LYS 20 HZ1 LYS 20 -2.648 -2.643 -14.541
165 HZ2 LYS 20 HZ2 LYS 20 -3.118 -1.149 -14.017
166 HZ3 LYS 20 HZ3 LYS 20 -1.561 -1.409 -14.486
167 H ALA 21 H ALA 21 -0.636 0.682 -6.385
168 HA ALA 21 HA ALA 21 0.886 3.090 -6.793
169 HB1 ALA 21 HB1 ALA 21 -0.563 2.050 -4.324
170 HB2 ALA 21 HB2 ALA 21 -0.016 3.721 -4.593
171 HB3 ALA 21 HB3 ALA 21 -1.291 3.028 -5.620
172 H LEU 22 H LEU 22 1.506 0.028 -5.160
173 HA LEU 22 HA LEU 22 3.671 1.124 -3.522
174 HB2 LEU 22 HB2 LEU 22 2.613 -1.670 -4.126
175 HB3 LEU 22 HB3 LEU 22 4.068 -1.388 -3.163
176 HG LEU 22 HG LEU 22 2.236 -1.714 -1.666
177 HD11 LEU 22 HD11 LEU 22 3.955 0.068 -1.152
178 HD12 LEU 22 HD12 LEU 22 2.786 1.273 -1.726
179 HD13 LEU 22 HD13 LEU 22 2.393 0.270 -0.315
180 HD21 LEU 22 HD21 LEU 22 0.403 -1.078 -3.224
181 HD22 LEU 22 HD22 LEU 22 0.245 -0.326 -1.621
182 HD23 LEU 22 HD23 LEU 22 0.832 0.636 -2.991
183 H LYS 23 H LYS 23 3.260 -0.624 -6.600
184 HA LYS 23 HA LYS 23 5.951 -1.430 -6.897
185 HB2 LYS 23 HB2 LYS 23 3.899 -2.271 -8.109
186 HB3 LYS 23 HB3 LYS 23 3.978 -0.814 -9.124
187 HG2 LYS 23 HG2 LYS 23 6.258 -1.440 -9.844
188 HG3 LYS 23 HG3 LYS 23 6.220 -2.860 -8.772
189 HD2 LYS 23 HD2 LYS 23 4.335 -3.796 -10.040
190 HD3 LYS 23 HD3 LYS 23 4.289 -2.350 -11.076
191 HE2 LYS 23 HE2 LYS 23 6.602 -2.830 -11.847
192 HE3 LYS 23 HE3 LYS 23 6.642 -4.249 -10.782
193 HZ1 LYS 23 HZ1 LYS 23 4.549 -4.879 -12.094
194 HZ2 LYS 23 HZ2 LYS 23 5.138 -3.855 -13.228
195 HZ3 LYS 23 HZ3 LYS 23 6.049 -5.146 -12.755
196 H LYS 24 H LYS 24 4.472 1.732 -7.378
197 HA LYS 24 HA LYS 24 6.420 2.627 -9.309
198 HB2 LYS 24 HB2 LYS 24 4.516 4.124 -7.470
199 HB3 LYS 24 HB3 LYS 24 5.494 4.881 -8.749
200 HG2 LYS 24 HG2 LYS 24 4.427 3.436 -10.441
201 HG3 LYS 24 HG3 LYS 24 3.446 2.665 -9.176
202 HD2 LYS 24 HD2 LYS 24 2.421 4.850 -8.635
203 HD3 LYS 24 HD3 LYS 24 3.403 5.627 -9.900
204 HE2 LYS 24 HE2 LYS 24 2.357 4.180 -11.607
205 HE3 LYS 24 HE3 LYS 24 1.394 3.379 -10.349
206 HZ1 LYS 24 HZ1 LYS 24 1.258 6.232 -11.040
207 HZ2 LYS 24 HZ2 LYS 24 0.156 5.084 -11.471
208 HZ3 LYS 24 HZ3 LYS 24 0.362 5.477 -9.883
209 H VAL 25 H VAL 25 6.570 2.103 -5.883
210 HA VAL 25 HA VAL 25 8.465 4.225 -5.332
211 HB VAL 25 HB VAL 25 7.581 1.721 -3.866
212 HG11 VAL 25 HG11 VAL 25 8.707 2.667 -1.877
213 HG12 VAL 25 HG12 VAL 25 9.871 2.288 -3.165
214 HG13 VAL 25 HG13 VAL 25 9.376 3.974 -2.881
215 HG21 VAL 25 HG21 VAL 25 7.064 4.630 -3.186
216 HG22 VAL 25 HG22 VAL 25 5.978 3.689 -4.251
217 HG23 VAL 25 HG23 VAL 25 6.234 3.194 -2.566
218 HA PRO 26 HA PRO 26 11.982 2.192 -7.156
219 HB2 PRO 26 HB2 PRO 26 13.388 3.873 -5.086
220 HB3 PRO 26 HB3 PRO 26 13.779 3.685 -6.827
221 HG2 PRO 26 HG2 PRO 26 12.508 5.912 -5.947
222 HG3 PRO 26 HG3 PRO 26 11.965 5.103 -7.457
223 HD2 PRO 26 HD2 PRO 26 10.762 4.915 -4.689
224 HD3 PRO 26 HD3 PRO 26 9.941 5.076 -6.275
225 H GLY 27 H GLY 27 13.108 0.322 -6.616
226 HA2 GLY 27 HA2 GLY 27 14.384 -1.053 -5.205
227 HA3 GLY 27 HA3 GLY 27 13.763 -0.190 -3.787
228 H VAL 28 H VAL 28 10.929 -0.489 -5.134
229 HA VAL 28 HA VAL 28 10.275 -2.952 -3.725
230 HB VAL 28 HB VAL 28 8.674 -1.020 -5.451
231 HG11 VAL 28 HG11 VAL 28 7.684 -3.265 -5.599
232 HG12 VAL 28 HG12 VAL 28 7.727 -3.414 -3.826
233 HG13 VAL 28 HG13 VAL 28 6.676 -2.203 -4.594
234 HG21 VAL 28 HG21 VAL 28 8.768 -1.552 -2.449
235 HG22 VAL 28 HG22 VAL 28 9.423 -0.121 -3.281
236 HG23 VAL 28 HG23 VAL 28 7.669 -0.412 -3.260
237 H GLU 29 H GLU 29 10.183 -4.969 -4.586
238 HA GLU 29 HA GLU 29 10.183 -5.170 -7.562
239 HB2 GLU 29 HB2 GLU 29 12.378 -5.764 -6.601
240 HB3 GLU 29 HB3 GLU 29 11.592 -6.956 -5.541
241 HG2 GLU 29 HG2 GLU 29 10.744 -8.160 -7.539
242 HG3 GLU 29 HG3 GLU 29 11.543 -6.972 -8.588
243 H LYS 30 H LYS 30 8.942 -6.314 -4.442
244 HA LYS 30 HA LYS 30 6.882 -7.830 -5.960
245 HB2 LYS 30 HB2 LYS 30 8.326 -8.693 -3.430
246 HB3 LYS 30 HB3 LYS 30 6.933 -9.525 -4.149
247 HG2 LYS 30 HG2 LYS 30 8.239 -9.898 -6.228
248 HG3 LYS 30 HG3 LYS 30 9.640 -9.087 -5.485
249 HD2 LYS 30 HD2 LYS 30 9.653 -10.770 -3.672
250 HD3 LYS 30 HD3 LYS 30 8.252 -11.579 -4.411
251 HE2 LYS 30 HE2 LYS 30 9.594 -11.967 -6.471
252 HE3 LYS 30 HE3 LYS 30 10.996 -11.213 -5.683
253 HZ1 LYS 30 HZ1 LYS 30 10.880 -12.924 -4.008
254 HZ2 LYS 30 HZ2 LYS 30 9.585 -13.618 -4.751
255 HZ3 LYS 30 HZ3 LYS 30 11.051 -13.594 -5.503
256 H VAL 31 H VAL 31 4.813 -7.890 -4.982
257 HA VAL 31 HA VAL 31 4.389 -6.307 -2.534
258 HB VAL 31 HB VAL 31 3.019 -5.721 -5.196
259 HG11 VAL 31 HG11 VAL 31 2.694 -4.470 -2.435
260 HG12 VAL 31 HG12 VAL 31 1.927 -3.886 -3.930
261 HG13 VAL 31 HG13 VAL 31 1.494 -5.479 -3.276
262 HG21 VAL 31 HG21 VAL 31 4.070 -3.486 -4.967
263 HG22 VAL 31 HG22 VAL 31 4.937 -4.049 -3.519
264 HG23 VAL 31 HG23 VAL 31 5.289 -4.768 -5.109
265 H GLU 32 H GLU 32 2.416 -6.881 -1.488
266 HA GLU 32 HA GLU 32 0.701 -8.897 -2.781
267 HB2 GLU 32 HB2 GLU 32 2.456 -10.206 -1.630
268 HB3 GLU 32 HB3 GLU 32 2.124 -9.330 -0.118
269 HG2 GLU 32 HG2 GLU 32 -0.200 -10.178 -0.136
270 HG3 GLU 32 HG3 GLU 32 0.120 -11.036 -1.657
271 H VAL 33 H VAL 33 -1.406 -8.345 -2.354
272 HA VAL 33 HA VAL 33 -1.889 -6.780 0.128
273 HB VAL 33 HB VAL 33 -3.359 -5.280 -1.081
274 HG11 VAL 33 HG11 VAL 33 -0.711 -5.555 -2.567
275 HG12 VAL 33 HG12 VAL 33 -1.720 -4.095 -2.467
276 HG13 VAL 33 HG13 VAL 33 -0.926 -4.729 -1.008
277 HG21 VAL 33 HG21 VAL 33 -2.569 -6.848 -3.572
278 HG22 VAL 33 HG22 VAL 33 -4.173 -6.860 -2.797
279 HG23 VAL 33 HG23 VAL 33 -3.554 -5.367 -3.535
280 H SER 34 H SER 34 -4.077 -6.883 0.926
281 HA SER 34 HA SER 34 -5.676 -9.130 -0.181
282 HB2 SER 34 HB2 SER 34 -4.474 -9.940 1.808
283 HB3 SER 34 HB3 SER 34 -5.123 -8.584 2.762
284 HG SER 34 HG SER 34 -6.327 -10.599 2.894
285 H LEU 35 H LEU 35 -7.308 -8.003 -1.105
286 HA LEU 35 HA LEU 35 -8.172 -5.446 -0.230
287 HB2 LEU 35 HB2 LEU 35 -9.616 -7.544 -1.895
288 HB3 LEU 35 HB3 LEU 35 -10.042 -5.824 -1.804
289 HG LEU 35 HG LEU 35 -7.370 -6.918 -2.793
290 HD11 LEU 35 HD11 LEU 35 -8.179 -6.223 -5.020
291 HD12 LEU 35 HD12 LEU 35 -9.238 -7.462 -4.309
292 HD13 LEU 35 HD13 LEU 35 -9.743 -5.756 -4.309
293 HD21 LEU 35 HD21 LEU 35 -7.037 -4.585 -3.591
294 HD22 LEU 35 HD22 LEU 35 -8.558 -4.108 -2.805
295 HD23 LEU 35 HD23 LEU 35 -7.180 -4.658 -1.822
296 H GLU 36 H GLU 36 -8.899 -8.636 0.987
297 HA GLU 36 HA GLU 36 -11.481 -7.897 2.126
298 HB2 GLU 36 HB2 GLU 36 -9.566 -10.222 2.582
299 HB3 GLU 36 HB3 GLU 36 -11.150 -10.061 3.373
300 HG2 GLU 36 HG2 GLU 36 -12.254 -9.989 1.163
301 HG3 GLU 36 HG3 GLU 36 -10.678 -10.178 0.368
302 H LYS 37 H LYS 37 -8.067 -7.790 3.072
303 HA LYS 37 HA LYS 37 -8.853 -7.135 5.856
304 HB2 LYS 37 HB2 LYS 37 -6.122 -7.700 4.638
305 HB3 LYS 37 HB3 LYS 37 -6.488 -7.505 6.367
306 HG2 LYS 37 HG2 LYS 37 -8.010 -9.466 6.257
307 HG3 LYS 37 HG3 LYS 37 -7.620 -9.665 4.535
308 HD2 LYS 37 HD2 LYS 37 -5.219 -9.974 5.136
309 HD3 LYS 37 HD3 LYS 37 -5.659 -9.860 6.859
310 HE2 LYS 37 HE2 LYS 37 -7.211 -11.799 6.560
311 HE3 LYS 37 HE3 LYS 37 -6.721 -11.891 4.859
312 HZ1 LYS 37 HZ1 LYS 37 -5.295 -12.713 7.207
313 HZ2 LYS 37 HZ2 LYS 37 -5.310 -13.349 5.705
314 HZ3 LYS 37 HZ3 LYS 37 -4.378 -12.023 6.005
315 H GLY 38 H GLY 38 -8.052 -5.621 2.892
316 HA2 GLY 38 HA2 GLY 38 -7.654 -3.424 2.366
317 HA3 GLY 38 HA3 GLY 38 -8.058 -2.998 4.045
318 H GLU 39 H GLU 39 -5.583 -5.411 3.508
319 HA GLU 39 HA GLU 39 -3.568 -3.485 4.528
320 HB2 GLU 39 HB2 GLU 39 -3.634 -6.529 4.478
321 HB3 GLU 39 HB3 GLU 39 -2.298 -5.544 5.110
322 HG2 GLU 39 HG2 GLU 39 -3.873 -4.485 6.724
323 HG3 GLU 39 HG3 GLU 39 -5.162 -5.556 6.137
324 H ALA 40 H ALA 40 -1.409 -3.574 3.684
325 HA ALA 40 HA ALA 40 -1.067 -4.789 1.005
326 HB1 ALA 40 HB1 ALA 40 -1.282 -1.898 1.664
327 HB2 ALA 40 HB2 ALA 40 0.140 -2.350 0.668
328 HB3 ALA 40 HB3 ALA 40 -1.511 -2.730 0.128
329 H LEU 41 H LEU 41 0.631 -6.083 1.329
330 HA LEU 41 HA LEU 41 2.825 -5.202 3.136
331 HB2 LEU 41 HB2 LEU 41 2.151 -7.914 1.897
332 HB3 LEU 41 HB3 LEU 41 3.546 -7.575 2.925
333 HG LEU 41 HG LEU 41 1.976 -8.602 4.316
334 HD11 LEU 41 HD11 LEU 41 2.022 -7.133 6.044
335 HD12 LEU 41 HD12 LEU 41 2.980 -6.179 4.923
336 HD13 LEU 41 HD13 LEU 41 1.245 -5.818 5.097
337 HD21 LEU 41 HD21 LEU 41 -0.344 -7.955 4.591
338 HD22 LEU 41 HD22 LEU 41 -0.162 -6.627 3.430
339 HD23 LEU 41 HD23 LEU 41 -0.027 -8.315 2.878
340 H VAL 42 H VAL 42 5.013 -5.312 2.347
341 HA VAL 42 HA VAL 42 5.248 -5.682 -0.592
342 HB VAL 42 HB VAL 42 6.760 -3.783 -0.751
343 HG11 VAL 42 HG11 VAL 42 5.118 -2.075 -0.754
344 HG12 VAL 42 HG12 VAL 42 4.231 -3.580 -1.021
345 HG13 VAL 42 HG13 VAL 42 4.209 -2.828 0.590
346 HG21 VAL 42 HG21 VAL 42 6.028 -3.210 2.151
347 HG22 VAL 42 HG22 VAL 42 7.607 -3.795 1.579
348 HG23 VAL 42 HG23 VAL 42 7.031 -2.191 1.090
349 H GLU 43 H GLU 43 7.501 -6.103 -1.276
350 HA GLU 43 HA GLU 43 9.284 -7.030 0.878
351 HB2 GLU 43 HB2 GLU 43 7.850 -8.947 0.236
352 HB3 GLU 43 HB3 GLU 43 8.399 -8.790 -1.440
353 HG2 GLU 43 HG2 GLU 43 10.710 -9.252 -0.753
354 HG3 GLU 43 HG3 GLU 43 10.216 -9.279 0.954
355 H GLY 44 H GLY 44 10.559 -5.216 0.329
356 HA2 GLY 44 HA2 GLY 44 12.258 -5.594 -2.013
357 HA3 GLY 44 HA3 GLY 44 11.230 -4.145 -2.067
358 H THR 45 H THR 45 13.613 -3.289 -2.124
359 HA THR 45 HA THR 45 14.608 -2.934 0.659
360 HB THR 45 HB THR 45 16.783 -2.452 -0.441
361 HG1 THR 45 HG1 THR 45 16.519 -1.863 -2.446
362 HG21 THR 45 HG21 THR 45 15.493 -5.066 -1.338
363 HG22 THR 45 HG22 THR 45 17.237 -4.755 -1.179
364 HG23 THR 45 HG23 THR 45 16.200 -4.760 0.267
365 H ALA 46 H ALA 46 12.383 -1.402 -0.652
366 HA ALA 46 HA ALA 46 13.490 1.180 -1.385
367 HB1 ALA 46 HB1 ALA 46 11.121 1.867 -1.366
368 HB2 ALA 46 HB2 ALA 46 11.316 0.326 -2.236
369 HB3 ALA 46 HB3 ALA 46 10.671 0.337 -0.578
370 H ASP 47 H ASP 47 12.758 3.198 -0.148
371 HA ASP 47 HA ASP 47 13.538 2.901 2.633
372 HB2 ASP 47 HB2 ASP 47 14.117 4.842 1.080
373 HB3 ASP 47 HB3 ASP 47 12.439 5.387 1.284
374 HA PRO 48 HA PRO 48 9.516 2.223 4.306
375 HB2 PRO 48 HB2 PRO 48 10.579 3.959 6.531
376 HB3 PRO 48 HB3 PRO 48 9.732 2.380 6.651
377 HG2 PRO 48 HG2 PRO 48 12.421 2.494 6.936
378 HG3 PRO 48 HG3 PRO 48 11.683 1.203 5.926
379 HD2 PRO 48 HD2 PRO 48 12.981 3.777 5.022
380 HD3 PRO 48 HD3 PRO 48 13.135 2.126 4.341
381 H LYS 49 H LYS 49 10.936 5.531 4.347
382 HA LYS 49 HA LYS 49 8.372 6.813 4.797
383 HB2 LYS 49 HB2 LYS 49 11.038 7.905 3.802
384 HB3 LYS 49 HB3 LYS 49 9.645 8.878 4.320
385 HG2 LYS 49 HG2 LYS 49 9.771 7.830 6.576
386 HG3 LYS 49 HG3 LYS 49 11.212 6.923 6.056
387 HD2 LYS 49 HD2 LYS 49 12.381 9.058 5.583
388 HD3 LYS 49 HD3 LYS 49 10.936 9.958 6.100
389 HE2 LYS 49 HE2 LYS 49 11.107 8.888 8.346
390 HE3 LYS 49 HE3 LYS 49 12.593 8.069 7.823
391 HZ1 LYS 49 HZ1 LYS 49 13.566 10.226 7.464
392 HZ2 LYS 49 HZ2 LYS 49 12.186 10.975 7.968
393 HZ3 LYS 49 HZ3 LYS 49 13.066 10.064 9.027
394 H ALA 50 H ALA 50 10.351 5.903 1.973
395 HA ALA 50 HA ALA 50 8.929 7.551 0.107
396 HB1 ALA 50 HB1 ALA 50 11.188 6.652 -0.317
397 HB2 ALA 50 HB2 ALA 50 10.537 4.994 -0.303
398 HB3 ALA 50 HB3 ALA 50 10.047 6.132 -1.579
399 H LEU 51 H LEU 51 8.453 4.262 1.397
400 HA LEU 51 HA LEU 51 6.614 3.412 -0.585
401 HB2 LEU 51 HB2 LEU 51 7.865 2.059 1.253
402 HB3 LEU 51 HB3 LEU 51 6.520 2.539 2.311
403 HG LEU 51 HG LEU 51 4.983 1.662 0.408
404 HD11 LEU 51 HD11 LEU 51 6.036 -0.101 -1.005
405 HD12 LEU 51 HD12 LEU 51 6.740 1.495 -1.330
406 HD13 LEU 51 HD13 LEU 51 7.625 0.321 -0.331
407 HD21 LEU 51 HD21 LEU 51 5.378 0.551 2.609
408 HD22 LEU 51 HD22 LEU 51 5.087 -0.609 1.285
409 HD23 LEU 51 HD23 LEU 51 6.740 -0.325 1.887
410 H VAL 52 H VAL 52 6.022 4.677 2.746
411 HA VAL 52 HA VAL 52 3.183 4.702 2.432
412 HB VAL 52 HB VAL 52 4.985 6.222 4.360
413 HG11 VAL 52 HG11 VAL 52 2.033 5.468 4.506
414 HG12 VAL 52 HG12 VAL 52 2.975 6.202 5.825
415 HG13 VAL 52 HG13 VAL 52 2.687 7.114 4.327
416 HG21 VAL 52 HG21 VAL 52 4.518 4.323 5.882
417 HG22 VAL 52 HG22 VAL 52 3.612 3.508 4.585
418 HG23 VAL 52 HG23 VAL 52 5.364 3.780 4.417
419 H GLN 53 H GLN 53 5.721 6.965 1.481
420 HA GLN 53 HA GLN 53 3.974 9.263 1.389
421 HB2 GLN 53 HB2 GLN 53 6.436 9.399 1.622
422 HB3 GLN 53 HB3 GLN 53 6.627 8.704 -0.003
423 HG2 GLN 53 HG2 GLN 53 5.418 10.622 -0.971
424 HG3 GLN 53 HG3 GLN 53 5.164 11.296 0.651
425 HE21 GLN 53 HE21 GLN 53 8.184 12.863 -1.069
426 HE22 GLN 53 HE22 GLN 53 6.527 12.595 -1.567
427 H ALA 54 H ALA 54 5.024 6.747 -0.942
428 HA ALA 54 HA ALA 54 4.000 7.993 -3.266
429 HB1 ALA 54 HB1 ALA 54 4.066 5.711 -4.216
430 HB2 ALA 54 HB2 ALA 54 5.543 6.090 -3.300
431 HB3 ALA 54 HB3 ALA 54 4.294 5.043 -2.582
432 H VAL 55 H VAL 55 2.463 5.639 -0.986
433 HA VAL 55 HA VAL 55 0.002 5.622 -2.505
434 HB VAL 55 HB VAL 55 -0.863 4.400 -0.516
435 HG11 VAL 55 HG11 VAL 55 0.659 2.466 -0.736
436 HG12 VAL 55 HG12 VAL 55 0.351 3.220 -2.317
437 HG13 VAL 55 HG13 VAL 55 1.891 3.514 -1.475
438 HG21 VAL 55 HG21 VAL 55 0.691 3.839 1.319
439 HG22 VAL 55 HG22 VAL 55 1.921 4.908 0.613
440 HG23 VAL 55 HG23 VAL 55 0.402 5.590 1.242
441 H GLU 56 H GLU 56 1.329 7.660 0.053
442 HA GLU 56 HA GLU 56 -1.243 8.764 0.796
443 HB2 GLU 56 HB2 GLU 56 0.731 8.749 2.293
444 HB3 GLU 56 HB3 GLU 56 1.592 9.821 1.167
445 HG2 GLU 56 HG2 GLU 56 -0.112 11.566 1.504
446 HG3 GLU 56 HG3 GLU 56 -1.035 10.480 2.562
447 H GLU 57 H GLU 57 1.126 9.256 -1.741
448 HA GLU 57 HA GLU 57 0.306 11.901 -2.514
449 HB2 GLU 57 HB2 GLU 57 2.475 10.819 -3.107
450 HB3 GLU 57 HB3 GLU 57 1.596 9.673 -4.138
451 HG2 GLU 57 HG2 GLU 57 0.766 11.531 -5.524
452 HG3 GLU 57 HG3 GLU 57 1.597 12.698 -4.471
453 H GLU 58 H GLU 58 -0.950 8.650 -2.984
454 HA GLU 58 HA GLU 58 -2.681 9.383 -5.223
455 HB2 GLU 58 HB2 GLU 58 -2.643 6.982 -3.342
456 HB3 GLU 58 HB3 GLU 58 -3.673 7.132 -4.777
457 HG2 GLU 58 HG2 GLU 58 -0.621 7.181 -4.778
458 HG3 GLU 58 HG3 GLU 58 -1.618 5.798 -5.201
459 H GLY 59 H GLY 59 -2.635 9.925 -1.856
460 HA2 GLY 59 HA2 GLY 59 -4.240 11.282 -0.759
461 HA3 GLY 59 HA3 GLY 59 -5.470 10.784 -1.937
462 H TYR 60 H TYR 60 -3.620 8.103 -0.957
463 HA TYR 60 HA TYR 60 -5.743 7.299 0.979
464 HB2 TYR 60 HB2 TYR 60 -4.133 5.736 -1.068
465 HB3 TYR 60 HB3 TYR 60 -5.090 4.977 0.206
466 HD1 TYR 60 HD1 TYR 60 -5.233 6.846 -2.960
467 HD2 TYR 60 HD2 TYR 60 -7.506 4.968 0.167
468 HE1 TYR 60 HE1 TYR 60 -7.250 6.907 -4.398
469 HE2 TYR 60 HE2 TYR 60 -9.522 4.991 -1.274
470 HH TYR 60 HH TYR 60 -10.412 5.623 -3.290
471 H LYS 61 H LYS 61 -4.752 7.813 2.942
472 HA LYS 61 HA LYS 61 -1.965 7.405 3.449
473 HB2 LYS 61 HB2 LYS 61 -4.401 7.482 5.280
474 HB3 LYS 61 HB3 LYS 61 -2.731 7.362 5.867
475 HG2 LYS 61 HG2 LYS 61 -2.170 9.483 4.709
476 HG3 LYS 61 HG3 LYS 61 -3.871 9.643 4.199
477 HD2 LYS 61 HD2 LYS 61 -4.603 9.683 6.535
478 HD3 LYS 61 HD3 LYS 61 -2.947 9.351 7.089
479 HE2 LYS 61 HE2 LYS 61 -2.183 11.489 6.117
480 HE3 LYS 61 HE3 LYS 61 -3.837 11.834 5.570
481 HZ1 LYS 61 HZ1 LYS 61 -3.328 12.907 7.647
482 HZ2 LYS 61 HZ2 LYS 61 -4.535 11.805 7.848
483 HZ3 LYS 61 HZ3 LYS 61 -3.009 11.456 8.364
484 H ALA 62 H ALA 62 -1.012 5.736 4.801
485 HA ALA 62 HA ALA 62 -2.506 3.256 5.170
486 HB1 ALA 62 HB1 ALA 62 -1.748 3.119 2.810
487 HB2 ALA 62 HB2 ALA 62 -0.070 3.378 3.346
488 HB3 ALA 62 HB3 ALA 62 -0.954 1.914 3.845
489 H GLU 63 H GLU 63 -2.040 3.965 7.369
490 HA GLU 63 HA GLU 63 0.761 4.152 8.189
491 HB2 GLU 63 HB2 GLU 63 -1.857 4.092 9.742
492 HB3 GLU 63 HB3 GLU 63 -0.247 4.287 10.483
493 HG2 GLU 63 HG2 GLU 63 0.170 6.267 9.052
494 HG3 GLU 63 HG3 GLU 63 -1.446 6.098 8.343
495 H VAL 64 H VAL 64 1.978 2.609 9.212
496 HA VAL 64 HA VAL 64 1.492 -0.087 8.565
497 HB VAL 64 HB VAL 64 3.397 -0.547 10.091
498 HG11 VAL 64 HG11 VAL 64 3.764 0.218 7.772
499 HG12 VAL 64 HG12 VAL 64 3.727 1.911 8.320
500 HG13 VAL 64 HG13 VAL 64 5.030 0.831 8.862
501 HG21 VAL 64 HG21 VAL 64 3.190 2.431 10.723
502 HG22 VAL 64 HG22 VAL 64 2.889 1.097 11.863
503 HG23 VAL 64 HG23 VAL 64 4.520 1.355 11.208
504 H LEU 65 H LEU 65 0.613 -1.799 9.611
505 HA LEU 65 HA LEU 65 -1.110 -1.210 11.917
506 HB2 LEU 65 HB2 LEU 65 -0.673 -3.685 10.203
507 HB3 LEU 65 HB3 LEU 65 -1.792 -3.620 11.581
508 HG LEU 65 HG LEU 65 -1.924 -1.781 9.148
509 HD11 LEU 65 HD11 LEU 65 -3.616 -4.174 9.990
510 HD12 LEU 65 HD12 LEU 65 -3.941 -3.110 8.600
511 HD13 LEU 65 HD13 LEU 65 -2.484 -4.128 8.619
512 HD21 LEU 65 HD21 LEU 65 -3.193 -1.785 11.811
513 HD22 LEU 65 HD22 LEU 65 -3.151 -0.519 10.581
514 HD23 LEU 65 HD23 LEU 65 -4.380 -1.798 10.471
515 H ALA 66 H ALA 66 0.744 -0.698 13.341
516 HA ALA 66 HA ALA 66 1.710 -3.178 14.635
517 HB1 ALA 66 HB1 ALA 66 3.535 -2.406 13.156
518 HB2 ALA 66 HB2 ALA 66 3.460 -0.793 13.905
519 HB3 ALA 66 HB3 ALA 66 3.965 -2.200 14.870
Start of MODEL 14
1 H1 MET 1 H MET 1 10.664 -3.029 9.627
2 HA MET 1 HA MET 1 9.561 -3.552 7.507
3 HB2 MET 1 HB2 MET 1 9.483 -5.177 9.403
4 HB3 MET 1 HB3 MET 1 7.919 -4.488 9.892
5 HG2 MET 1 HG2 MET 1 6.971 -5.073 7.705
6 HG3 MET 1 HG3 MET 1 8.536 -5.690 7.160
7 HE1 MET 1 HE1 MET 1 8.534 -8.051 6.702
8 HE2 MET 1 HE2 MET 1 9.684 -7.858 8.045
9 HE3 MET 1 HE3 MET 1 8.559 -9.237 8.029
10 H LEU 2 H LEU 2 7.647 -3.421 6.189
11 HA LEU 2 HA LEU 2 5.819 -1.247 7.095
12 HB2 LEU 2 HB2 LEU 2 6.529 -2.019 4.245
13 HB3 LEU 2 HB3 LEU 2 5.654 -0.574 4.787
14 HG LEU 2 HG LEU 2 8.561 -1.268 5.415
15 HD11 LEU 2 HD11 LEU 2 7.365 0.887 3.636
16 HD12 LEU 2 HD12 LEU 2 9.094 0.656 3.983
17 HD13 LEU 2 HD13 LEU 2 8.199 -0.586 3.080
18 HD21 LEU 2 HD21 LEU 2 6.958 1.231 6.095
19 HD22 LEU 2 HD22 LEU 2 7.524 0.014 7.256
20 HD23 LEU 2 HD23 LEU 2 8.698 1.001 6.365
21 H LYS 3 H LYS 3 3.583 -1.510 6.784
22 HA LYS 3 HA LYS 3 2.532 -4.023 5.713
23 HB2 LYS 3 HB2 LYS 3 3.595 -4.442 8.014
24 HB3 LYS 3 HB3 LYS 3 2.305 -3.443 8.697
25 HG2 LYS 3 HG2 LYS 3 0.617 -5.024 7.899
26 HG3 LYS 3 HG3 LYS 3 1.852 -5.898 6.954
27 HD2 LYS 3 HD2 LYS 3 3.087 -6.368 9.084
28 HD3 LYS 3 HD3 LYS 3 1.721 -5.678 9.988
29 HE2 LYS 3 HE2 LYS 3 0.216 -7.351 9.007
30 HE3 LYS 3 HE3 LYS 3 1.542 -8.015 8.031
31 HZ1 LYS 3 HZ1 LYS 3 1.634 -7.886 10.956
32 HZ2 LYS 3 HZ2 LYS 3 1.042 -9.199 10.136
33 HZ3 LYS 3 HZ3 LYS 3 2.616 -8.732 9.952
34 H LEU 4 H LEU 4 1.263 -2.451 4.395
35 HA LEU 4 HA LEU 4 0.200 -0.132 5.812
36 HB2 LEU 4 HB2 LEU 4 0.487 -1.112 2.984
37 HB3 LEU 4 HB3 LEU 4 -0.794 0.065 3.330
38 HG LEU 4 HG LEU 4 0.878 1.565 4.407
39 HD11 LEU 4 HD11 LEU 4 2.853 -0.502 3.347
40 HD12 LEU 4 HD12 LEU 4 3.282 1.103 3.981
41 HD13 LEU 4 HD13 LEU 4 2.556 -0.108 5.058
42 HD21 LEU 4 HD21 LEU 4 0.247 1.820 2.026
43 HD22 LEU 4 HD22 LEU 4 1.948 2.266 2.292
44 HD23 LEU 4 HD23 LEU 4 1.544 0.694 1.561
45 H LYS 5 H LYS 5 -1.727 0.033 6.700
46 HA LYS 5 HA LYS 5 -3.891 -1.811 5.839
47 HB2 LYS 5 HB2 LYS 5 -3.333 -1.712 8.294
48 HB3 LYS 5 HB3 LYS 5 -3.744 0.018 8.264
49 HG2 LYS 5 HG2 LYS 5 -6.009 -0.696 7.279
50 HG3 LYS 5 HG3 LYS 5 -5.571 -2.358 7.735
51 HD2 LYS 5 HD2 LYS 5 -5.286 -1.609 10.091
52 HD3 LYS 5 HD3 LYS 5 -5.719 0.049 9.608
53 HE2 LYS 5 HE2 LYS 5 -7.937 -0.790 8.809
54 HE3 LYS 5 HE3 LYS 5 -7.474 -2.417 9.343
55 HZ1 LYS 5 HZ1 LYS 5 -7.077 -1.151 11.557
56 HZ2 LYS 5 HZ2 LYS 5 -8.152 -0.098 10.929
57 HZ3 LYS 5 HZ3 LYS 5 -8.603 -1.667 11.132
58 H VAL 6 H VAL 6 -4.408 -0.778 3.895
59 HA VAL 6 HA VAL 6 -4.509 2.037 3.564
60 HB VAL 6 HB VAL 6 -5.936 -0.133 1.978
61 HG11 VAL 6 HG11 VAL 6 -4.950 2.660 1.247
62 HG12 VAL 6 HG12 VAL 6 -5.709 1.503 0.130
63 HG13 VAL 6 HG13 VAL 6 -6.651 2.191 1.473
64 HG21 VAL 6 HG21 VAL 6 -3.528 -0.635 2.210
65 HG22 VAL 6 HG22 VAL 6 -3.902 -0.100 0.558
66 HG23 VAL 6 HG23 VAL 6 -3.129 1.024 1.699
67 H GLU 7 H GLU 7 -5.863 3.414 4.471
68 HA GLU 7 HA GLU 7 -8.314 2.622 5.743
69 HB2 GLU 7 HB2 GLU 7 -6.792 4.509 6.432
70 HB3 GLU 7 HB3 GLU 7 -7.303 5.396 4.986
71 HG2 GLU 7 HG2 GLU 7 -8.597 6.128 6.925
72 HG3 GLU 7 HG3 GLU 7 -9.660 5.292 5.781
73 H GLY 8 H GLY 8 -10.466 3.132 5.129
74 HA2 GLY 8 HA2 GLY 8 -10.879 3.304 2.216
75 HA3 GLY 8 HA3 GLY 8 -12.092 2.916 3.456
76 H MET 9 H MET 9 -9.860 5.666 2.688
77 HA MET 9 HA MET 9 -11.564 7.609 3.905
78 HB2 MET 9 HB2 MET 9 -9.340 7.902 1.845
79 HB3 MET 9 HB3 MET 9 -10.050 9.227 2.793
80 HG2 MET 9 HG2 MET 9 -9.355 8.098 4.884
81 HG3 MET 9 HG3 MET 9 -8.655 6.782 3.936
82 HE1 MET 9 HE1 MET 9 -7.026 11.107 4.170
83 HE2 MET 9 HE2 MET 9 -8.558 10.713 3.357
84 HE3 MET 9 HE3 MET 9 -8.392 10.467 5.112
85 H THR 10 H THR 10 -11.255 6.390 0.542
86 HA THR 10 HA THR 10 -13.751 7.860 -0.084
87 HB THR 10 HB THR 10 -12.784 8.432 -2.322
88 HG1 THR 10 HG1 THR 10 -10.463 8.386 -2.397
89 HG21 THR 10 HG21 THR 10 -12.866 10.096 -0.477
90 HG22 THR 10 HG22 THR 10 -11.249 9.569 0.052
91 HG23 THR 10 HG23 THR 10 -11.459 10.339 -1.537
92 H CYS 11 H CYS 11 -14.736 7.029 -2.144
93 HA CYS 11 HA CYS 11 -15.742 5.255 -3.161
94 HB2 CYS 11 HB2 CYS 11 -12.834 4.444 -3.514
95 HB3 CYS 11 HB3 CYS 11 -14.205 3.902 -4.512
96 HG CYS 11 HG CYS 11 -14.956 6.276 -5.265
97 H ASN 12 H ASN 12 -15.512 4.938 -0.279
98 HA ASN 12 HA ASN 12 -14.521 2.366 0.399
99 HB2 ASN 12 HB2 ASN 12 -15.714 2.719 2.498
100 HB3 ASN 12 HB3 ASN 12 -14.893 4.210 2.001
101 HD21 ASN 12 HD21 ASN 12 -18.834 4.288 2.748
102 HD22 ASN 12 HD22 ASN 12 -17.735 3.026 3.261
103 H HIS 13 H HIS 13 -17.371 3.226 -1.370
104 HA HIS 13 HA HIS 13 -18.780 0.761 -0.536
105 HB2 HIS 13 HB2 HIS 13 -19.487 3.010 -2.447
106 HB3 HIS 13 HB3 HIS 13 -20.473 1.558 -2.223
107 HD1 HIS 13 HD1 HIS 13 -22.034 1.491 -0.106
108 HD2 HIS 13 HD2 HIS 13 -19.310 4.700 -0.246
109 HE1 HIS 13 HE1 HIS 13 -22.686 3.094 1.773
110 H CYS 14 H CYS 14 -16.315 1.660 -2.655
111 HA CYS 14 HA CYS 14 -16.854 -0.712 -4.361
112 HB2 CYS 14 HB2 CYS 14 -15.702 1.969 -5.225
113 HB3 CYS 14 HB3 CYS 14 -15.867 0.530 -6.260
114 HG CYS 14 HG CYS 14 -18.140 0.737 -6.838
115 H VAL 15 H VAL 15 -14.464 -0.836 -5.717
116 HA VAL 15 HA VAL 15 -12.356 -0.691 -3.641
117 HB VAL 15 HB VAL 15 -13.343 -2.953 -3.571
118 HG11 VAL 15 HG11 VAL 15 -12.446 -3.136 -6.479
119 HG12 VAL 15 HG12 VAL 15 -13.105 -4.466 -5.499
120 HG13 VAL 15 HG13 VAL 15 -14.133 -3.079 -5.917
121 HG21 VAL 15 HG21 VAL 15 -10.601 -2.995 -4.886
122 HG22 VAL 15 HG22 VAL 15 -10.889 -2.542 -3.183
123 HG23 VAL 15 HG23 VAL 15 -11.278 -4.180 -3.755
124 H MET 16 H MET 16 -10.202 -0.604 -4.525
125 HA MET 16 HA MET 16 -10.012 -0.242 -7.458
126 HB2 MET 16 HB2 MET 16 -9.230 1.762 -5.321
127 HB3 MET 16 HB3 MET 16 -8.628 1.844 -6.988
128 HG2 MET 16 HG2 MET 16 -11.577 1.561 -6.689
129 HG3 MET 16 HG3 MET 16 -10.896 3.068 -6.082
130 HE1 MET 16 HE1 MET 16 -9.342 4.805 -9.119
131 HE2 MET 16 HE2 MET 16 -9.913 4.964 -7.441
132 HE3 MET 16 HE3 MET 16 -8.562 3.870 -7.820
133 H ALA 17 H ALA 17 -7.756 -0.263 -8.200
134 HA ALA 17 HA ALA 17 -6.262 -2.318 -6.793
135 HB1 ALA 17 HB1 ALA 17 -6.528 -2.299 -9.251
136 HB2 ALA 17 HB2 ALA 17 -5.665 -0.744 -9.331
137 HB3 ALA 17 HB3 ALA 17 -4.812 -2.208 -8.784
138 H VAL 18 H VAL 18 -5.022 -1.761 -5.058
139 HA VAL 18 HA VAL 18 -3.622 0.838 -5.053
140 HB VAL 18 HB VAL 18 -3.621 -1.423 -3.037
141 HG11 VAL 18 HG11 VAL 18 -1.923 0.709 -3.088
142 HG12 VAL 18 HG12 VAL 18 -3.261 1.398 -2.176
143 HG13 VAL 18 HG13 VAL 18 -2.482 -0.084 -1.583
144 HG21 VAL 18 HG21 VAL 18 -5.930 -0.390 -3.564
145 HG22 VAL 18 HG22 VAL 18 -5.407 -0.405 -1.855
146 HG23 VAL 18 HG23 VAL 18 -5.297 1.082 -2.821
147 H THR 19 H THR 19 -3.106 -2.507 -5.890
148 HA THR 19 HA THR 19 -0.490 -2.937 -5.186
149 HB THR 19 HB THR 19 -1.828 -3.806 -7.776
150 HG1 THR 19 HG1 THR 19 -2.392 -5.613 -6.379
151 HG21 THR 19 HG21 THR 19 -0.386 -5.800 -7.509
152 HG22 THR 19 HG22 THR 19 0.589 -4.321 -7.650
153 HG23 THR 19 HG23 THR 19 0.346 -5.079 -6.057
154 H LYS 20 H LYS 20 -1.620 -1.247 -8.178
155 HA LYS 20 HA LYS 20 1.003 -1.012 -9.292
156 HB2 LYS 20 HB2 LYS 20 -1.539 0.617 -9.691
157 HB3 LYS 20 HB3 LYS 20 -0.072 0.788 -10.678
158 HG2 LYS 20 HG2 LYS 20 -0.215 -1.579 -11.343
159 HG3 LYS 20 HG3 LYS 20 -1.687 -1.778 -10.362
160 HD2 LYS 20 HD2 LYS 20 -2.856 -0.105 -11.717
161 HD3 LYS 20 HD3 LYS 20 -1.373 0.218 -12.645
162 HE2 LYS 20 HE2 LYS 20 -1.356 -2.087 -13.481
163 HE3 LYS 20 HE3 LYS 20 -2.795 -2.472 -12.515
164 HZ1 LYS 20 HZ1 LYS 20 -3.291 -1.964 -14.821
165 HZ2 LYS 20 HZ2 LYS 20 -4.033 -0.919 -13.786
166 HZ3 LYS 20 HZ3 LYS 20 -2.702 -0.437 -14.631
167 H ALA 21 H ALA 21 -0.600 0.735 -6.703
168 HA ALA 21 HA ALA 21 0.924 3.162 -7.058
169 HB1 ALA 21 HB1 ALA 21 -0.500 2.080 -4.595
170 HB2 ALA 21 HB2 ALA 21 0.006 3.759 -4.878
171 HB3 ALA 21 HB3 ALA 21 -1.269 3.032 -5.886
172 H LEU 22 H LEU 22 1.473 0.061 -5.418
173 HA LEU 22 HA LEU 22 3.621 1.120 -3.755
174 HB2 LEU 22 HB2 LEU 22 2.425 -1.616 -4.286
175 HB3 LEU 22 HB3 LEU 22 3.921 -1.425 -3.367
176 HG LEU 22 HG LEU 22 2.083 -1.594 -1.831
177 HD11 LEU 22 HD11 LEU 22 3.986 0.002 -1.363
178 HD12 LEU 22 HD12 LEU 22 2.924 1.321 -1.896
179 HD13 LEU 22 HD13 LEU 22 2.477 0.347 -0.481
180 HD21 LEU 22 HD21 LEU 22 0.914 0.891 -3.146
181 HD22 LEU 22 HD22 LEU 22 0.283 -0.765 -3.328
182 HD23 LEU 22 HD23 LEU 22 0.262 0.027 -1.737
183 H LYS 23 H LYS 23 3.340 -0.639 -6.837
184 HA LYS 23 HA LYS 23 5.935 -1.701 -6.893
185 HB2 LYS 23 HB2 LYS 23 3.911 -2.244 -8.332
186 HB3 LYS 23 HB3 LYS 23 4.323 -0.819 -9.310
187 HG2 LYS 23 HG2 LYS 23 6.574 -1.796 -9.740
188 HG3 LYS 23 HG3 LYS 23 6.143 -3.207 -8.751
189 HD2 LYS 23 HD2 LYS 23 4.267 -3.704 -10.311
190 HD3 LYS 23 HD3 LYS 23 4.741 -2.303 -11.304
191 HE2 LYS 23 HE2 LYS 23 6.986 -3.323 -11.630
192 HE3 LYS 23 HE3 LYS 23 6.471 -4.735 -10.685
193 HZ1 LYS 23 HZ1 LYS 23 5.262 -3.817 -13.202
194 HZ2 LYS 23 HZ2 LYS 23 6.265 -5.112 -13.028
195 HZ3 LYS 23 HZ3 LYS 23 4.774 -5.127 -12.325
196 H LYS 24 H LYS 24 4.928 1.616 -7.428
197 HA LYS 24 HA LYS 24 7.080 2.229 -9.248
198 HB2 LYS 24 HB2 LYS 24 5.245 4.038 -7.639
199 HB3 LYS 24 HB3 LYS 24 6.275 4.546 -8.997
200 HG2 LYS 24 HG2 LYS 24 5.071 3.045 -10.515
201 HG3 LYS 24 HG3 LYS 24 4.113 2.400 -9.165
202 HD2 LYS 24 HD2 LYS 24 3.173 4.662 -8.760
203 HD3 LYS 24 HD3 LYS 24 4.070 5.274 -10.171
204 HE2 LYS 24 HE2 LYS 24 2.890 3.670 -11.628
205 HE3 LYS 24 HE3 LYS 24 2.041 2.998 -10.220
206 HZ1 LYS 24 HZ1 LYS 24 1.801 5.753 -11.212
207 HZ2 LYS 24 HZ2 LYS 24 0.678 4.556 -11.379
208 HZ3 LYS 24 HZ3 LYS 24 1.040 5.145 -9.885
209 H VAL 25 H VAL 25 6.958 2.070 -5.728
210 HA VAL 25 HA VAL 25 9.095 3.999 -5.378
211 HB VAL 25 HB VAL 25 7.630 2.044 -3.625
212 HG11 VAL 25 HG11 VAL 25 9.035 2.772 -1.714
213 HG12 VAL 25 HG12 VAL 25 9.972 1.835 -2.895
214 HG13 VAL 25 HG13 VAL 25 10.128 3.608 -2.841
215 HG21 VAL 25 HG21 VAL 25 8.250 4.991 -3.223
216 HG22 VAL 25 HG22 VAL 25 6.875 4.453 -4.218
217 HG23 VAL 25 HG23 VAL 25 6.955 4.037 -2.490
218 HA PRO 26 HA PRO 26 12.480 1.413 -6.581
219 HB2 PRO 26 HB2 PRO 26 13.877 3.193 -4.589
220 HB3 PRO 26 HB3 PRO 26 14.392 2.757 -6.252
221 HG2 PRO 26 HG2 PRO 26 13.293 5.183 -5.763
222 HG3 PRO 26 HG3 PRO 26 12.781 4.245 -7.209
223 HD2 PRO 26 HD2 PRO 26 11.377 4.506 -4.543
224 HD3 PRO 26 HD3 PRO 26 10.691 4.576 -6.198
225 H GLY 27 H GLY 27 13.473 -0.418 -5.734
226 HA2 GLY 27 HA2 GLY 27 14.491 -1.712 -4.064
227 HA3 GLY 27 HA3 GLY 27 13.752 -0.693 -2.814
228 H VAL 28 H VAL 28 11.071 -0.933 -4.355
229 HA VAL 28 HA VAL 28 10.104 -3.267 -2.937
230 HB VAL 28 HB VAL 28 8.885 -1.444 -5.051
231 HG11 VAL 28 HG11 VAL 28 7.803 -3.654 -5.132
232 HG12 VAL 28 HG12 VAL 28 7.567 -3.613 -3.369
233 HG13 VAL 28 HG13 VAL 28 6.718 -2.447 -4.410
234 HG21 VAL 28 HG21 VAL 28 8.473 -1.674 -2.038
235 HG22 VAL 28 HG22 VAL 28 9.375 -0.383 -2.867
236 HG23 VAL 28 HG23 VAL 28 7.624 -0.547 -3.122
237 H GLU 29 H GLU 29 10.144 -5.361 -3.643
238 HA GLU 29 HA GLU 29 10.603 -5.754 -6.552
239 HB2 GLU 29 HB2 GLU 29 12.470 -6.849 -6.141
240 HB3 GLU 29 HB3 GLU 29 12.369 -6.275 -4.469
241 HG2 GLU 29 HG2 GLU 29 11.109 -8.331 -3.868
242 HG3 GLU 29 HG3 GLU 29 11.220 -8.891 -5.552
243 H LYS 30 H LYS 30 8.855 -6.796 -3.664
244 HA LYS 30 HA LYS 30 7.074 -8.323 -5.483
245 HB2 LYS 30 HB2 LYS 30 8.125 -9.243 -2.787
246 HB3 LYS 30 HB3 LYS 30 6.660 -9.898 -3.542
247 HG2 LYS 30 HG2 LYS 30 7.985 -10.524 -5.550
248 HG3 LYS 30 HG3 LYS 30 9.464 -9.974 -4.724
249 HD2 LYS 30 HD2 LYS 30 9.071 -11.598 -2.911
250 HD3 LYS 30 HD3 LYS 30 7.550 -12.107 -3.677
251 HE2 LYS 30 HE2 LYS 30 8.796 -12.860 -5.673
252 HE3 LYS 30 HE3 LYS 30 10.320 -12.353 -4.917
253 HZ1 LYS 30 HZ1 LYS 30 8.490 -14.403 -3.875
254 HZ2 LYS 30 HZ2 LYS 30 9.920 -14.689 -4.639
255 HZ3 LYS 30 HZ3 LYS 30 9.904 -13.936 -3.172
256 H VAL 31 H VAL 31 4.862 -8.338 -4.805
257 HA VAL 31 HA VAL 31 4.157 -6.538 -2.575
258 HB VAL 31 HB VAL 31 3.158 -6.193 -5.435
259 HG11 VAL 31 HG11 VAL 31 1.447 -5.726 -3.684
260 HG12 VAL 31 HG12 VAL 31 2.574 -4.588 -2.915
261 HG13 VAL 31 HG13 VAL 31 1.948 -4.251 -4.546
262 HG21 VAL 31 HG21 VAL 31 4.262 -3.972 -5.300
263 HG22 VAL 31 HG22 VAL 31 4.928 -4.410 -3.709
264 HG23 VAL 31 HG23 VAL 31 5.435 -5.298 -5.167
265 H GLU 32 H GLU 32 2.118 -7.007 -1.700
266 HA GLU 32 HA GLU 32 0.428 -9.047 -2.983
267 HB2 GLU 32 HB2 GLU 32 2.071 -10.323 -1.609
268 HB3 GLU 32 HB3 GLU 32 1.614 -9.347 -0.198
269 HG2 GLU 32 HG2 GLU 32 0.044 -10.895 0.224
270 HG3 GLU 32 HG3 GLU 32 -0.844 -10.263 -1.174
271 H VAL 33 H VAL 33 -1.721 -8.471 -2.668
272 HA VAL 33 HA VAL 33 -2.264 -6.672 -0.358
273 HB VAL 33 HB VAL 33 -3.743 -5.333 -1.770
274 HG11 VAL 33 HG11 VAL 33 -0.969 -5.620 -2.994
275 HG12 VAL 33 HG12 VAL 33 -2.037 -4.203 -3.124
276 HG13 VAL 33 HG13 VAL 33 -1.369 -4.669 -1.542
277 HG21 VAL 33 HG21 VAL 33 -2.707 -7.050 -4.061
278 HG22 VAL 33 HG22 VAL 33 -4.358 -7.090 -3.396
279 HG23 VAL 33 HG23 VAL 33 -3.766 -5.627 -4.212
280 H SER 34 H SER 34 -4.453 -6.672 0.381
281 HA SER 34 HA SER 34 -6.098 -8.960 -0.558
282 HB2 SER 34 HB2 SER 34 -4.971 -9.621 1.535
283 HB3 SER 34 HB3 SER 34 -5.589 -8.156 2.335
284 HG SER 34 HG SER 34 -6.888 -10.059 2.664
285 H LEU 35 H LEU 35 -7.630 -7.804 -1.650
286 HA LEU 35 HA LEU 35 -8.418 -5.158 -0.966
287 HB2 LEU 35 HB2 LEU 35 -9.864 -7.305 -2.565
288 HB3 LEU 35 HB3 LEU 35 -10.253 -5.576 -2.579
289 HG LEU 35 HG LEU 35 -7.573 -6.769 -3.445
290 HD11 LEU 35 HD11 LEU 35 -9.058 -7.372 -5.161
291 HD12 LEU 35 HD12 LEU 35 -10.082 -5.919 -4.924
292 HD13 LEU 35 HD13 LEU 35 -8.484 -5.793 -5.693
293 HD21 LEU 35 HD21 LEU 35 -7.213 -4.471 -4.334
294 HD22 LEU 35 HD22 LEU 35 -8.736 -3.951 -3.581
295 HD23 LEU 35 HD23 LEU 35 -7.373 -4.479 -2.565
296 H GLU 36 H GLU 36 -9.376 -8.267 0.332
297 HA GLU 36 HA GLU 36 -11.965 -7.318 1.282
298 HB2 GLU 36 HB2 GLU 36 -10.292 -9.779 1.927
299 HB3 GLU 36 HB3 GLU 36 -11.968 -9.516 2.459
300 HG2 GLU 36 HG2 GLU 36 -12.726 -9.429 0.128
301 HG3 GLU 36 HG3 GLU 36 -11.056 -9.595 -0.448
302 H LYS 37 H LYS 37 -8.637 -7.578 2.511
303 HA LYS 37 HA LYS 37 -9.601 -6.833 5.210
304 HB2 LYS 37 HB2 LYS 37 -6.898 -7.862 4.272
305 HB3 LYS 37 HB3 LYS 37 -7.374 -7.544 5.958
306 HG2 LYS 37 HG2 LYS 37 -9.263 -9.164 5.694
307 HG3 LYS 37 HG3 LYS 37 -8.690 -9.534 4.054
308 HD2 LYS 37 HD2 LYS 37 -6.521 -10.296 4.995
309 HD3 LYS 37 HD3 LYS 37 -7.125 -9.941 6.633
310 HE2 LYS 37 HE2 LYS 37 -9.001 -11.527 6.272
311 HE3 LYS 37 HE3 LYS 37 -8.370 -11.899 4.657
312 HZ1 LYS 37 HZ1 LYS 37 -7.699 -13.517 6.260
313 HZ2 LYS 37 HZ2 LYS 37 -6.375 -12.714 5.699
314 HZ3 LYS 37 HZ3 LYS 37 -6.970 -12.372 7.198
315 H GLY 38 H GLY 38 -8.332 -5.361 2.407
316 HA2 GLY 38 HA2 GLY 38 -7.752 -3.168 2.057
317 HA3 GLY 38 HA3 GLY 38 -8.127 -2.832 3.759
318 H GLU 39 H GLU 39 -5.825 -5.397 3.038
319 HA GLU 39 HA GLU 39 -3.679 -3.692 4.215
320 HB2 GLU 39 HB2 GLU 39 -3.928 -6.703 3.808
321 HB3 GLU 39 HB3 GLU 39 -2.540 -5.872 4.541
322 HG2 GLU 39 HG2 GLU 39 -4.093 -4.898 6.258
323 HG3 GLU 39 HG3 GLU 39 -5.405 -5.881 5.575
324 H ALA 40 H ALA 40 -1.596 -3.701 3.328
325 HA ALA 40 HA ALA 40 -1.258 -4.654 0.564
326 HB1 ALA 40 HB1 ALA 40 -2.100 -2.351 0.320
327 HB2 ALA 40 HB2 ALA 40 -0.863 -1.767 1.457
328 HB3 ALA 40 HB3 ALA 40 -0.379 -2.433 -0.120
329 H LEU 41 H LEU 41 0.418 -5.970 0.838
330 HA LEU 41 HA LEU 41 2.563 -5.194 2.743
331 HB2 LEU 41 HB2 LEU 41 1.898 -7.858 1.409
332 HB3 LEU 41 HB3 LEU 41 3.210 -7.572 2.549
333 HG LEU 41 HG LEU 41 1.506 -8.637 3.784
334 HD11 LEU 41 HD11 LEU 41 1.424 -5.633 4.265
335 HD12 LEU 41 HD12 LEU 41 0.683 -6.832 5.362
336 HD13 LEU 41 HD13 LEU 41 2.439 -6.839 5.071
337 HD21 LEU 41 HD21 LEU 41 -0.813 -7.975 3.832
338 HD22 LEU 41 HD22 LEU 41 -0.495 -6.576 2.793
339 HD23 LEU 41 HD23 LEU 41 -0.327 -8.225 2.140
340 H VAL 42 H VAL 42 4.738 -5.306 2.094
341 HA VAL 42 HA VAL 42 5.263 -5.791 -0.771
342 HB VAL 42 HB VAL 42 6.778 -3.863 -0.858
343 HG11 VAL 42 HG11 VAL 42 5.123 -2.206 -1.219
344 HG12 VAL 42 HG12 VAL 42 4.308 -3.751 -1.499
345 HG13 VAL 42 HG13 VAL 42 4.044 -2.889 0.036
346 HG21 VAL 42 HG21 VAL 42 5.616 -3.127 1.862
347 HG22 VAL 42 HG22 VAL 42 7.284 -3.666 1.556
348 HG23 VAL 42 HG23 VAL 42 6.713 -2.125 0.883
349 H GLU 43 H GLU 43 7.614 -6.253 -1.113
350 HA GLU 43 HA GLU 43 9.051 -6.948 1.376
351 HB2 GLU 43 HB2 GLU 43 7.829 -8.981 0.563
352 HB3 GLU 43 HB3 GLU 43 8.736 -8.874 -0.958
353 HG2 GLU 43 HG2 GLU 43 10.853 -9.093 0.282
354 HG3 GLU 43 HG3 GLU 43 9.969 -9.137 1.815
355 H GLY 44 H GLY 44 10.322 -5.117 0.963
356 HA2 GLY 44 HA2 GLY 44 12.346 -5.446 -1.129
357 HA3 GLY 44 HA3 GLY 44 11.290 -4.027 -1.285
358 H THR 45 H THR 45 13.565 -3.044 -1.031
359 HA THR 45 HA THR 45 14.217 -2.713 1.857
360 HB THR 45 HB THR 45 16.490 -2.176 1.047
361 HG1 THR 45 HG1 THR 45 16.906 -2.754 -1.179
362 HG21 THR 45 HG21 THR 45 15.508 -4.577 1.523
363 HG22 THR 45 HG22 THR 45 15.707 -4.799 -0.216
364 HG23 THR 45 HG23 THR 45 17.131 -4.414 0.779
365 H ALA 46 H ALA 46 12.138 -1.249 0.257
366 HA ALA 46 HA ALA 46 13.233 1.354 -0.369
367 HB1 ALA 46 HB1 ALA 46 10.859 1.987 -0.573
368 HB2 ALA 46 HB2 ALA 46 11.169 0.445 -1.407
369 HB3 ALA 46 HB3 ALA 46 10.373 0.452 0.184
370 H ASP 47 H ASP 47 12.664 3.364 0.821
371 HA ASP 47 HA ASP 47 12.899 2.957 3.705
372 HB2 ASP 47 HB2 ASP 47 12.768 5.435 1.945
373 HB3 ASP 47 HB3 ASP 47 12.965 5.476 3.709
374 HA PRO 48 HA PRO 48 8.684 3.255 4.798
375 HB2 PRO 48 HB2 PRO 48 9.584 5.237 6.880
376 HB3 PRO 48 HB3 PRO 48 8.576 3.768 7.096
377 HG2 PRO 48 HG2 PRO 48 11.187 3.746 7.814
378 HG3 PRO 48 HG3 PRO 48 10.492 2.349 6.920
379 HD2 PRO 48 HD2 PRO 48 12.142 4.639 5.833
380 HD3 PRO 48 HD3 PRO 48 12.268 2.887 5.482
381 H LYS 49 H LYS 49 10.486 6.360 4.646
382 HA LYS 49 HA LYS 49 8.165 8.026 4.587
383 HB2 LYS 49 HB2 LYS 49 9.945 9.617 3.436
384 HB3 LYS 49 HB3 LYS 49 10.067 9.201 5.153
385 HG2 LYS 49 HG2 LYS 49 11.727 7.480 4.701
386 HG3 LYS 49 HG3 LYS 49 11.568 7.746 2.948
387 HD2 LYS 49 HD2 LYS 49 12.350 10.069 3.219
388 HD3 LYS 49 HD3 LYS 49 12.484 9.829 4.976
389 HE2 LYS 49 HE2 LYS 49 14.148 8.040 4.610
390 HE3 LYS 49 HE3 LYS 49 14.005 8.256 2.854
391 HZ1 LYS 49 HZ1 LYS 49 14.923 10.306 4.749
392 HZ2 LYS 49 HZ2 LYS 49 15.888 9.413 3.752
393 HZ3 LYS 49 HZ3 LYS 49 14.809 10.480 3.114
394 H ALA 50 H ALA 50 9.687 6.037 2.130
395 HA ALA 50 HA ALA 50 8.579 7.676 -0.043
396 HB1 ALA 50 HB1 ALA 50 10.810 6.631 -0.249
397 HB2 ALA 50 HB2 ALA 50 10.077 5.023 -0.050
398 HB3 ALA 50 HB3 ALA 50 9.688 6.006 -1.480
399 H LEU 51 H LEU 51 7.941 4.569 1.623
400 HA LEU 51 HA LEU 51 6.108 3.674 -0.385
401 HB2 LEU 51 HB2 LEU 51 7.461 2.372 1.477
402 HB3 LEU 51 HB3 LEU 51 6.021 2.705 2.463
403 HG LEU 51 HG LEU 51 4.688 1.793 0.409
404 HD11 LEU 51 HD11 LEU 51 5.985 0.175 -0.969
405 HD12 LEU 51 HD12 LEU 51 6.635 1.820 -1.150
406 HD13 LEU 51 HD13 LEU 51 7.471 0.643 -0.116
407 HD21 LEU 51 HD21 LEU 51 5.011 0.614 2.613
408 HD22 LEU 51 HD22 LEU 51 4.856 -0.485 1.219
409 HD23 LEU 51 HD23 LEU 51 6.454 -0.163 1.926
410 H VAL 52 H VAL 52 5.596 5.070 2.926
411 HA VAL 52 HA VAL 52 2.756 4.869 2.755
412 HB VAL 52 HB VAL 52 4.468 6.745 4.438
413 HG11 VAL 52 HG11 VAL 52 2.073 7.334 4.433
414 HG12 VAL 52 HG12 VAL 52 1.648 5.647 4.810
415 HG13 VAL 52 HG13 VAL 52 2.539 6.628 5.997
416 HG21 VAL 52 HG21 VAL 52 4.279 4.970 6.165
417 HG22 VAL 52 HG22 VAL 52 3.475 3.916 4.977
418 HG23 VAL 52 HG23 VAL 52 5.170 4.414 4.732
419 H GLN 53 H GLN 53 5.063 7.266 1.562
420 HA GLN 53 HA GLN 53 3.038 9.335 1.272
421 HB2 GLN 53 HB2 GLN 53 5.451 9.780 1.678
422 HB3 GLN 53 HB3 GLN 53 5.838 9.089 0.087
423 HG2 GLN 53 HG2 GLN 53 4.519 10.827 -1.022
424 HG3 GLN 53 HG3 GLN 53 3.959 11.441 0.548
425 HE21 GLN 53 HE21 GLN 53 7.284 12.991 -1.008
426 HE22 GLN 53 HE22 GLN 53 6.007 12.182 -1.895
427 H ALA 54 H ALA 54 4.469 6.748 -0.684
428 HA ALA 54 HA ALA 54 3.611 7.633 -3.231
429 HB1 ALA 54 HB1 ALA 54 3.934 5.259 -3.869
430 HB2 ALA 54 HB2 ALA 54 5.290 5.890 -2.908
431 HB3 ALA 54 HB3 ALA 54 4.081 4.834 -2.144
432 H VAL 55 H VAL 55 1.957 5.529 -0.775
433 HA VAL 55 HA VAL 55 -0.308 5.094 -2.534
434 HB VAL 55 HB VAL 55 -1.399 4.233 -0.470
435 HG11 VAL 55 HG11 VAL 55 0.076 2.333 -0.121
436 HG12 VAL 55 HG12 VAL 55 0.092 2.785 -1.838
437 HG13 VAL 55 HG13 VAL 55 1.456 3.235 -0.781
438 HG21 VAL 55 HG21 VAL 55 -0.123 4.110 1.628
439 HG22 VAL 55 HG22 VAL 55 1.213 5.022 0.890
440 HG23 VAL 55 HG23 VAL 55 -0.365 5.803 1.154
441 H GLU 56 H GLU 56 0.688 7.624 -0.295
442 HA GLU 56 HA GLU 56 -1.965 8.693 0.059
443 HB2 GLU 56 HB2 GLU 56 -0.062 9.029 1.627
444 HB3 GLU 56 HB3 GLU 56 0.761 10.010 0.397
445 HG2 GLU 56 HG2 GLU 56 -1.135 11.597 0.393
446 HG3 GLU 56 HG3 GLU 56 -1.986 10.591 1.584
447 H GLU 57 H GLU 57 0.457 8.835 -2.457
448 HA GLU 57 HA GLU 57 -0.403 11.308 -3.670
449 HB2 GLU 57 HB2 GLU 57 1.441 9.082 -4.241
450 HB3 GLU 57 HB3 GLU 57 0.615 9.689 -5.692
451 HG2 GLU 57 HG2 GLU 57 1.299 11.987 -5.154
452 HG3 GLU 57 HG3 GLU 57 2.112 11.412 -3.682
453 H GLU 58 H GLU 58 -1.619 8.027 -3.556
454 HA GLU 58 HA GLU 58 -3.401 8.458 -5.872
455 HB2 GLU 58 HB2 GLU 58 -3.067 6.156 -3.907
456 HB3 GLU 58 HB3 GLU 58 -4.203 6.158 -5.270
457 HG2 GLU 58 HG2 GLU 58 -1.194 6.520 -5.564
458 HG3 GLU 58 HG3 GLU 58 -2.033 4.969 -5.717
459 H GLY 59 H GLY 59 -3.226 9.244 -2.584
460 HA2 GLY 59 HA2 GLY 59 -4.868 10.595 -1.551
461 HA3 GLY 59 HA3 GLY 59 -6.117 9.873 -2.580
462 H TYR 60 H TYR 60 -3.936 7.521 -1.250
463 HA TYR 60 HA TYR 60 -5.933 6.957 0.886
464 HB2 TYR 60 HB2 TYR 60 -4.593 4.981 -0.983
465 HB3 TYR 60 HB3 TYR 60 -5.708 4.580 0.329
466 HD1 TYR 60 HD1 TYR 60 -5.385 5.771 -3.097
467 HD2 TYR 60 HD2 TYR 60 -8.105 5.239 0.186
468 HE1 TYR 60 HE1 TYR 60 -7.296 6.005 -4.656
469 HE2 TYR 60 HE2 TYR 60 -10.027 5.469 -1.361
470 HH TYR 60 HH TYR 60 -10.696 5.847 -3.522
471 H LYS 61 H LYS 61 -4.809 7.507 2.694
472 HA LYS 61 HA LYS 61 -2.012 6.842 3.084
473 HB2 LYS 61 HB2 LYS 61 -4.265 7.723 4.935
474 HB3 LYS 61 HB3 LYS 61 -2.588 7.481 5.472
475 HG2 LYS 61 HG2 LYS 61 -1.793 9.137 3.841
476 HG3 LYS 61 HG3 LYS 61 -3.448 9.369 3.236
477 HD2 LYS 61 HD2 LYS 61 -4.166 10.232 5.409
478 HD3 LYS 61 HD3 LYS 61 -2.558 9.902 6.101
479 HE2 LYS 61 HE2 LYS 61 -1.526 11.473 4.524
480 HE3 LYS 61 HE3 LYS 61 -3.098 11.776 3.759
481 HZ1 LYS 61 HZ1 LYS 61 -2.477 13.465 5.348
482 HZ2 LYS 61 HZ2 LYS 61 -3.870 12.703 5.789
483 HZ3 LYS 61 HZ3 LYS 61 -2.454 12.357 6.565
484 H ALA 62 H ALA 62 -1.364 5.396 5.002
485 HA ALA 62 HA ALA 62 -3.198 3.214 5.646
486 HB1 ALA 62 HB1 ALA 62 -2.456 2.576 3.385
487 HB2 ALA 62 HB2 ALA 62 -0.761 2.766 3.878
488 HB3 ALA 62 HB3 ALA 62 -1.762 1.486 4.608
489 H GLU 63 H GLU 63 -2.777 2.908 7.766
490 HA GLU 63 HA GLU 63 -0.320 3.734 9.012
491 HB2 GLU 63 HB2 GLU 63 -2.618 1.980 9.976
492 HB3 GLU 63 HB3 GLU 63 -1.310 2.599 11.002
493 HG2 GLU 63 HG2 GLU 63 -1.974 4.923 10.435
494 HG3 GLU 63 HG3 GLU 63 -3.314 4.290 9.455
495 H VAL 64 H VAL 64 1.597 2.647 8.950
496 HA VAL 64 HA VAL 64 1.898 -0.050 8.128
497 HB VAL 64 HB VAL 64 4.171 0.195 9.138
498 HG11 VAL 64 HG11 VAL 64 3.661 0.945 6.840
499 HG12 VAL 64 HG12 VAL 64 3.199 2.547 7.462
500 HG13 VAL 64 HG13 VAL 64 4.882 1.989 7.604
501 HG21 VAL 64 HG21 VAL 64 3.139 2.955 9.940
502 HG22 VAL 64 HG22 VAL 64 3.631 1.658 11.055
503 HG23 VAL 64 HG23 VAL 64 4.834 2.424 10.002
504 H LEU 65 H LEU 65 1.223 -1.829 9.153
505 HA LEU 65 HA LEU 65 0.429 -1.720 11.964
506 HB2 LEU 65 HB2 LEU 65 0.461 -3.972 9.915
507 HB3 LEU 65 HB3 LEU 65 -0.273 -4.068 11.526
508 HG LEU 65 HG LEU 65 -1.102 -2.091 9.347
509 HD11 LEU 65 HD11 LEU 65 -3.250 -3.659 9.704
510 HD12 LEU 65 HD12 LEU 65 -1.949 -4.119 8.557
511 HD13 LEU 65 HD13 LEU 65 -2.024 -4.830 10.186
512 HD21 LEU 65 HD21 LEU 65 -1.488 -1.251 11.637
513 HD22 LEU 65 HD22 LEU 65 -3.025 -1.704 10.875
514 HD23 LEU 65 HD23 LEU 65 -2.279 -2.785 12.076
515 H ALA 66 H ALA 66 3.290 -1.306 11.366
516 HA ALA 66 HA ALA 66 4.343 -3.475 13.070
517 HB1 ALA 66 HB1 ALA 66 4.842 -4.178 10.760
518 HB2 ALA 66 HB2 ALA 66 5.588 -2.596 10.433
519 HB3 ALA 66 HB3 ALA 66 6.330 -3.703 11.613
Start of MODEL 15
1 H1 MET 1 H MET 1 10.535 -3.298 9.915
2 HA MET 1 HA MET 1 9.572 -3.548 7.685
3 HB2 MET 1 HB2 MET 1 9.422 -5.402 9.359
4 HB3 MET 1 HB3 MET 1 7.799 -4.828 9.800
5 HG2 MET 1 HG2 MET 1 7.028 -5.192 7.511
6 HG3 MET 1 HG3 MET 1 8.661 -5.624 6.987
7 HE1 MET 1 HE1 MET 1 8.852 -7.909 6.211
8 HE2 MET 1 HE2 MET 1 9.913 -7.807 7.636
9 HE3 MET 1 HE3 MET 1 8.903 -9.250 7.381
10 H LEU 2 H LEU 2 7.469 -3.591 6.433
11 HA LEU 2 HA LEU 2 5.742 -1.344 7.358
12 HB2 LEU 2 HB2 LEU 2 6.448 -2.112 4.504
13 HB3 LEU 2 HB3 LEU 2 5.541 -0.678 5.031
14 HG LEU 2 HG LEU 2 8.443 -1.313 5.749
15 HD11 LEU 2 HD11 LEU 2 7.311 0.766 3.842
16 HD12 LEU 2 HD12 LEU 2 9.024 0.538 4.257
17 HD13 LEU 2 HD13 LEU 2 8.156 -0.731 3.367
18 HD21 LEU 2 HD21 LEU 2 6.782 1.195 6.232
19 HD22 LEU 2 HD22 LEU 2 7.284 0.036 7.480
20 HD23 LEU 2 HD23 LEU 2 8.504 0.991 6.613
21 H LYS 3 H LYS 3 3.492 -1.486 6.888
22 HA LYS 3 HA LYS 3 2.355 -3.982 5.878
23 HB2 LYS 3 HB2 LYS 3 3.128 -3.730 8.628
24 HB3 LYS 3 HB3 LYS 3 1.355 -3.643 8.564
25 HG2 LYS 3 HG2 LYS 3 1.241 -5.731 7.321
26 HG3 LYS 3 HG3 LYS 3 3.014 -5.774 7.171
27 HD2 LYS 3 HD2 LYS 3 3.201 -5.900 9.652
28 HD3 LYS 3 HD3 LYS 3 1.424 -5.983 9.760
29 HE2 LYS 3 HE2 LYS 3 1.427 -8.016 8.380
30 HE3 LYS 3 HE3 LYS 3 3.190 -7.928 8.199
31 HZ1 LYS 3 HZ1 LYS 3 1.874 -8.132 10.810
32 HZ2 LYS 3 HZ2 LYS 3 2.350 -9.458 9.933
33 HZ3 LYS 3 HZ3 LYS 3 3.460 -8.359 10.454
34 H LEU 4 H LEU 4 1.268 -2.422 4.444
35 HA LEU 4 HA LEU 4 0.185 -0.000 5.658
36 HB2 LEU 4 HB2 LEU 4 0.606 -1.140 2.910
37 HB3 LEU 4 HB3 LEU 4 -0.666 0.077 3.117
38 HG LEU 4 HG LEU 4 0.960 1.619 4.179
39 HD11 LEU 4 HD11 LEU 4 2.969 -0.539 3.407
40 HD12 LEU 4 HD12 LEU 4 3.377 1.102 3.957
41 HD13 LEU 4 HD13 LEU 4 2.562 -0.024 5.063
42 HD21 LEU 4 HD21 LEU 4 0.504 1.692 1.738
43 HD22 LEU 4 HD22 LEU 4 2.184 2.150 2.101
44 HD23 LEU 4 HD23 LEU 4 1.821 0.528 1.465
45 H LYS 5 H LYS 5 -1.672 -0.124 6.780
46 HA LYS 5 HA LYS 5 -3.883 -1.838 5.843
47 HB2 LYS 5 HB2 LYS 5 -3.475 -1.502 8.297
48 HB3 LYS 5 HB3 LYS 5 -3.748 0.241 8.067
49 HG2 LYS 5 HG2 LYS 5 -6.010 -0.417 7.020
50 HG3 LYS 5 HG3 LYS 5 -5.734 -2.035 7.698
51 HD2 LYS 5 HD2 LYS 5 -5.566 -1.044 9.963
52 HD3 LYS 5 HD3 LYS 5 -5.762 0.584 9.267
53 HE2 LYS 5 HE2 LYS 5 -7.992 -0.119 8.348
54 HE3 LYS 5 HE3 LYS 5 -7.775 -1.689 9.144
55 HZ1 LYS 5 HZ1 LYS 5 -7.410 -0.136 11.185
56 HZ2 LYS 5 HZ2 LYS 5 -8.327 0.894 10.309
57 HZ3 LYS 5 HZ3 LYS 5 -8.937 -0.584 10.702
58 H VAL 6 H VAL 6 -4.309 -0.945 3.764
59 HA VAL 6 HA VAL 6 -4.401 1.836 3.224
60 HB VAL 6 HB VAL 6 -5.869 -0.423 1.806
61 HG11 VAL 6 HG11 VAL 6 -4.857 2.301 0.868
62 HG12 VAL 6 HG12 VAL 6 -5.644 1.077 -0.156
63 HG13 VAL 6 HG13 VAL 6 -6.561 1.871 1.143
64 HG21 VAL 6 HG21 VAL 6 -3.466 -0.934 2.054
65 HG22 VAL 6 HG22 VAL 6 -3.848 -0.512 0.370
66 HG23 VAL 6 HG23 VAL 6 -3.052 0.679 1.425
67 H GLU 7 H GLU 7 -5.690 3.237 4.212
68 HA GLU 7 HA GLU 7 -8.146 2.505 5.505
69 HB2 GLU 7 HB2 GLU 7 -6.535 4.345 6.162
70 HB3 GLU 7 HB3 GLU 7 -7.086 5.259 4.747
71 HG2 GLU 7 HG2 GLU 7 -8.294 6.000 6.736
72 HG3 GLU 7 HG3 GLU 7 -9.418 5.172 5.643
73 H GLY 8 H GLY 8 -10.283 2.979 4.910
74 HA2 GLY 8 HA2 GLY 8 -10.745 3.297 2.023
75 HA3 GLY 8 HA3 GLY 8 -11.940 2.862 3.265
76 H MET 9 H MET 9 -9.720 5.611 2.501
77 HA MET 9 HA MET 9 -11.341 7.538 3.857
78 HB2 MET 9 HB2 MET 9 -9.209 7.881 1.709
79 HB3 MET 9 HB3 MET 9 -9.853 9.171 2.749
80 HG2 MET 9 HG2 MET 9 -9.089 7.920 4.751
81 HG3 MET 9 HG3 MET 9 -8.435 6.657 3.702
82 HE1 MET 9 HE1 MET 9 -6.787 10.960 4.118
83 HE2 MET 9 HE2 MET 9 -8.352 10.613 3.347
84 HE3 MET 9 HE3 MET 9 -8.114 10.265 5.076
85 H THR 10 H THR 10 -11.215 6.384 0.470
86 HA THR 10 HA THR 10 -13.693 7.928 -0.033
87 HB THR 10 HB THR 10 -12.796 8.502 -2.305
88 HG1 THR 10 HG1 THR 10 -10.486 8.405 -2.470
89 HG21 THR 10 HG21 THR 10 -12.783 10.148 -0.446
90 HG22 THR 10 HG22 THR 10 -11.163 9.581 0.031
91 HG23 THR 10 HG23 THR 10 -11.402 10.372 -1.543
92 H CYS 11 H CYS 11 -14.812 7.134 -2.031
93 HA CYS 11 HA CYS 11 -15.883 5.381 -3.026
94 HB2 CYS 11 HB2 CYS 11 -12.992 4.639 -3.602
95 HB3 CYS 11 HB3 CYS 11 -14.415 4.061 -4.503
96 HG CYS 11 HG CYS 11 -15.300 6.414 -5.170
97 H ASN 12 H ASN 12 -15.528 4.966 -0.192
98 HA ASN 12 HA ASN 12 -14.450 2.403 0.373
99 HB2 ASN 12 HB2 ASN 12 -15.623 2.650 2.511
100 HB3 ASN 12 HB3 ASN 12 -14.822 4.164 2.052
101 HD21 ASN 12 HD21 ASN 12 -18.759 4.173 2.845
102 HD22 ASN 12 HD22 ASN 12 -17.654 2.890 3.288
103 H HIS 13 H HIS 13 -17.348 3.235 -1.301
104 HA HIS 13 HA HIS 13 -18.663 0.687 -0.573
105 HB2 HIS 13 HB2 HIS 13 -19.497 3.040 -2.296
106 HB3 HIS 13 HB3 HIS 13 -20.424 1.536 -2.171
107 HD1 HIS 13 HD1 HIS 13 -21.962 1.266 -0.068
108 HD2 HIS 13 HD2 HIS 13 -19.224 4.459 0.127
109 HE1 HIS 13 HE1 HIS 13 -22.540 2.605 2.030
110 H CYS 14 H CYS 14 -16.245 1.750 -2.612
111 HA CYS 14 HA CYS 14 -16.722 -0.487 -4.505
112 HB2 CYS 14 HB2 CYS 14 -15.573 2.264 -5.136
113 HB3 CYS 14 HB3 CYS 14 -15.681 0.896 -6.270
114 HG CYS 14 HG CYS 14 -17.537 2.619 -6.844
115 H VAL 15 H VAL 15 -14.252 -0.400 -5.796
116 HA VAL 15 HA VAL 15 -12.233 -0.410 -3.644
117 HB VAL 15 HB VAL 15 -13.228 -2.673 -3.709
118 HG11 VAL 15 HG11 VAL 15 -12.215 -2.725 -6.584
119 HG12 VAL 15 HG12 VAL 15 -12.917 -4.097 -5.693
120 HG13 VAL 15 HG13 VAL 15 -13.923 -2.684 -6.087
121 HG21 VAL 15 HG21 VAL 15 -10.435 -2.669 -4.908
122 HG22 VAL 15 HG22 VAL 15 -10.794 -2.271 -3.205
123 HG23 VAL 15 HG23 VAL 15 -11.161 -3.889 -3.843
124 H MET 16 H MET 16 -10.023 -0.374 -4.491
125 HA MET 16 HA MET 16 -9.838 0.273 -7.383
126 HB2 MET 16 HB2 MET 16 -8.758 1.927 -5.078
127 HB3 MET 16 HB3 MET 16 -8.378 2.214 -6.786
128 HG2 MET 16 HG2 MET 16 -11.277 2.035 -6.106
129 HG3 MET 16 HG3 MET 16 -10.416 3.408 -5.416
130 HE1 MET 16 HE1 MET 16 -9.149 5.437 -8.420
131 HE2 MET 16 HE2 MET 16 -9.378 5.359 -6.658
132 HE3 MET 16 HE3 MET 16 -8.256 4.235 -7.460
133 H ALA 17 H ALA 17 -7.598 0.228 -8.174
134 HA ALA 17 HA ALA 17 -6.153 -2.045 -7.053
135 HB1 ALA 17 HB1 ALA 17 -6.448 -1.749 -9.487
136 HB2 ALA 17 HB2 ALA 17 -5.571 -0.202 -9.410
137 HB3 ALA 17 HB3 ALA 17 -4.723 -1.722 -9.046
138 H VAL 18 H VAL 18 -4.860 -1.703 -5.293
139 HA VAL 18 HA VAL 18 -3.496 0.910 -5.041
140 HB VAL 18 HB VAL 18 -3.569 -1.450 -3.151
141 HG11 VAL 18 HG11 VAL 18 -1.913 0.712 -3.030
142 HG12 VAL 18 HG12 VAL 18 -3.303 1.338 -2.150
143 HG13 VAL 18 HG13 VAL 18 -2.521 -0.154 -1.586
144 HG21 VAL 18 HG21 VAL 18 -5.870 -0.443 -3.746
145 HG22 VAL 18 HG22 VAL 18 -5.433 -0.514 -2.013
146 HG23 VAL 18 HG23 VAL 18 -5.313 1.010 -2.919
147 H THR 19 H THR 19 -2.884 -2.441 -5.920
148 HA THR 19 HA THR 19 -0.246 -2.742 -5.167
149 HB THR 19 HB THR 19 -1.505 -3.727 -7.754
150 HG1 THR 19 HG1 THR 19 -2.014 -5.530 -6.329
151 HG21 THR 19 HG21 THR 19 0.021 -5.640 -7.432
152 HG22 THR 19 HG22 THR 19 0.941 -4.123 -7.546
153 HG23 THR 19 HG23 THR 19 0.673 -4.885 -5.961
154 H LYS 20 H LYS 20 -1.497 -1.099 -8.111
155 HA LYS 20 HA LYS 20 1.034 -0.824 -9.363
156 HB2 LYS 20 HB2 LYS 20 -1.532 0.793 -9.584
157 HB3 LYS 20 HB3 LYS 20 -0.126 0.995 -10.655
158 HG2 LYS 20 HG2 LYS 20 -0.260 -1.380 -11.310
159 HG3 LYS 20 HG3 LYS 20 -1.676 -1.601 -10.256
160 HD2 LYS 20 HD2 LYS 20 -2.954 0.020 -11.566
161 HD3 LYS 20 HD3 LYS 20 -1.524 0.390 -12.558
162 HE2 LYS 20 HE2 LYS 20 -1.460 -1.925 -13.376
163 HE3 LYS 20 HE3 LYS 20 -2.850 -2.345 -12.356
164 HZ1 LYS 20 HZ1 LYS 20 -3.451 -1.877 -14.640
165 HZ2 LYS 20 HZ2 LYS 20 -4.178 -0.836 -13.591
166 HZ3 LYS 20 HZ3 LYS 20 -2.893 -0.333 -14.496
167 H ALA 21 H ALA 21 -0.363 0.916 -6.639
168 HA ALA 21 HA ALA 21 1.284 3.281 -7.063
169 HB1 ALA 21 HB1 ALA 21 -0.260 2.309 -4.627
170 HB2 ALA 21 HB2 ALA 21 0.423 3.935 -4.856
171 HB3 ALA 21 HB3 ALA 21 -0.897 3.368 -5.906
172 H LEU 22 H LEU 22 1.599 0.158 -5.400
173 HA LEU 22 HA LEU 22 3.854 1.108 -3.793
174 HB2 LEU 22 HB2 LEU 22 2.511 -1.594 -4.217
175 HB3 LEU 22 HB3 LEU 22 3.992 -1.394 -3.271
176 HG LEU 22 HG LEU 22 2.235 -1.378 -1.705
177 HD11 LEU 22 HD11 LEU 22 4.000 0.427 -1.483
178 HD12 LEU 22 HD12 LEU 22 2.823 1.566 -2.167
179 HD13 LEU 22 HD13 LEU 22 2.470 0.752 -0.629
180 HD21 LEU 22 HD21 LEU 22 0.858 0.795 -3.330
181 HD22 LEU 22 HD22 LEU 22 0.378 -0.920 -3.284
182 HD23 LEU 22 HD23 LEU 22 0.281 0.072 -1.814
183 H LYS 23 H LYS 23 3.342 -0.746 -6.804
184 HA LYS 23 HA LYS 23 5.943 -1.826 -6.974
185 HB2 LYS 23 HB2 LYS 23 3.862 -2.409 -8.331
186 HB3 LYS 23 HB3 LYS 23 4.224 -0.983 -9.331
187 HG2 LYS 23 HG2 LYS 23 6.509 -1.940 -9.761
188 HG3 LYS 23 HG3 LYS 23 6.046 -3.382 -8.831
189 HD2 LYS 23 HD2 LYS 23 4.202 -3.809 -10.442
190 HD3 LYS 23 HD3 LYS 23 4.685 -2.362 -11.362
191 HE2 LYS 23 HE2 LYS 23 6.943 -3.356 -11.689
192 HE3 LYS 23 HE3 LYS 23 6.415 -4.814 -10.829
193 HZ1 LYS 23 HZ1 LYS 23 5.253 -3.778 -13.322
194 HZ2 LYS 23 HZ2 LYS 23 6.270 -5.065 -13.195
195 HZ3 LYS 23 HZ3 LYS 23 4.765 -5.140 -12.528
196 H LYS 24 H LYS 24 4.819 1.452 -7.469
197 HA LYS 24 HA LYS 24 6.978 2.187 -9.264
198 HB2 LYS 24 HB2 LYS 24 4.956 3.805 -7.671
199 HB3 LYS 24 HB3 LYS 24 6.063 4.484 -8.889
200 HG2 LYS 24 HG2 LYS 24 5.096 3.093 -10.634
201 HG3 LYS 24 HG3 LYS 24 4.104 2.219 -9.448
202 HD2 LYS 24 HD2 LYS 24 2.903 4.310 -8.899
203 HD3 LYS 24 HD3 LYS 24 3.864 5.181 -10.121
204 HE2 LYS 24 HE2 LYS 24 2.992 3.719 -11.887
205 HE3 LYS 24 HE3 LYS 24 2.119 2.746 -10.685
206 HZ1 LYS 24 HZ1 LYS 24 1.627 5.586 -11.246
207 HZ2 LYS 24 HZ2 LYS 24 0.693 4.329 -11.762
208 HZ3 LYS 24 HZ3 LYS 24 0.816 4.662 -10.152
209 H VAL 25 H VAL 25 6.743 1.740 -5.830
210 HA VAL 25 HA VAL 25 8.664 3.809 -5.151
211 HB VAL 25 HB VAL 25 7.494 1.426 -3.687
212 HG11 VAL 25 HG11 VAL 25 8.456 2.412 -1.627
213 HG12 VAL 25 HG12 VAL 25 9.721 1.887 -2.759
214 HG13 VAL 25 HG13 VAL 25 9.318 3.615 -2.614
215 HG21 VAL 25 HG21 VAL 25 7.081 4.392 -3.196
216 HG22 VAL 25 HG22 VAL 25 6.054 3.451 -4.315
217 HG23 VAL 25 HG23 VAL 25 6.118 3.038 -2.590
218 HA PRO 26 HA PRO 26 12.224 1.514 -6.530
219 HB2 PRO 26 HB2 PRO 26 13.516 3.331 -4.501
220 HB3 PRO 26 HB3 PRO 26 14.042 2.977 -6.181
221 HG2 PRO 26 HG2 PRO 26 12.782 5.306 -5.622
222 HG3 PRO 26 HG3 PRO 26 12.312 4.366 -7.081
223 HD2 PRO 26 HD2 PRO 26 10.938 4.458 -4.386
224 HD3 PRO 26 HD3 PRO 26 10.219 4.530 -6.027
225 H GLY 27 H GLY 27 13.319 -0.285 -5.756
226 HA2 GLY 27 HA2 GLY 27 14.449 -1.563 -4.152
227 HA3 GLY 27 HA3 GLY 27 13.701 -0.615 -2.855
228 H VAL 28 H VAL 28 10.988 -0.980 -4.324
229 HA VAL 28 HA VAL 28 10.189 -3.368 -2.894
230 HB VAL 28 HB VAL 28 8.812 -1.568 -4.928
231 HG11 VAL 28 HG11 VAL 28 7.831 -3.821 -5.027
232 HG12 VAL 28 HG12 VAL 28 7.657 -3.835 -3.256
233 HG13 VAL 28 HG13 VAL 28 6.717 -2.685 -4.237
234 HG21 VAL 28 HG21 VAL 28 8.531 -1.877 -1.907
235 HG22 VAL 28 HG22 VAL 28 9.325 -0.524 -2.747
236 HG23 VAL 28 HG23 VAL 28 7.576 -0.780 -2.931
237 H GLU 29 H GLU 29 10.212 -5.462 -3.635
238 HA GLU 29 HA GLU 29 10.607 -5.799 -6.563
239 HB2 GLU 29 HB2 GLU 29 12.473 -6.914 -6.187
240 HB3 GLU 29 HB3 GLU 29 12.361 -6.464 -4.478
241 HG2 GLU 29 HG2 GLU 29 11.062 -8.515 -4.020
242 HG3 GLU 29 HG3 GLU 29 11.140 -8.952 -5.743
243 H LYS 30 H LYS 30 8.880 -6.848 -3.664
244 HA LYS 30 HA LYS 30 7.046 -8.325 -5.475
245 HB2 LYS 30 HB2 LYS 30 8.040 -9.253 -2.756
246 HB3 LYS 30 HB3 LYS 30 6.630 -9.926 -3.589
247 HG2 LYS 30 HG2 LYS 30 8.070 -10.541 -5.520
248 HG3 LYS 30 HG3 LYS 30 9.492 -9.951 -4.624
249 HD2 LYS 30 HD2 LYS 30 9.023 -11.562 -2.809
250 HD3 LYS 30 HD3 LYS 30 7.579 -12.127 -3.677
251 HE2 LYS 30 HE2 LYS 30 9.009 -12.838 -5.576
252 HE3 LYS 30 HE3 LYS 30 10.448 -12.309 -4.679
253 HZ1 LYS 30 HZ1 LYS 30 8.555 -14.383 -3.810
254 HZ2 LYS 30 HZ2 LYS 30 10.053 -14.653 -4.442
255 HZ3 LYS 30 HZ3 LYS 30 9.895 -13.901 -2.984
256 H VAL 31 H VAL 31 4.839 -8.313 -4.768
257 HA VAL 31 HA VAL 31 4.190 -6.522 -2.516
258 HB VAL 31 HB VAL 31 3.126 -6.149 -5.348
259 HG11 VAL 31 HG11 VAL 31 1.490 -5.645 -3.537
260 HG12 VAL 31 HG12 VAL 31 2.672 -4.545 -2.801
261 HG13 VAL 31 HG13 VAL 31 1.999 -4.175 -4.405
262 HG21 VAL 31 HG21 VAL 31 4.289 -3.957 -5.251
263 HG22 VAL 31 HG22 VAL 31 5.004 -4.416 -3.688
264 HG23 VAL 31 HG23 VAL 31 5.431 -5.313 -5.164
265 H GLU 32 H GLU 32 2.146 -6.975 -1.615
266 HA GLU 32 HA GLU 32 0.464 -9.033 -2.892
267 HB2 GLU 32 HB2 GLU 32 2.110 -10.275 -1.487
268 HB3 GLU 32 HB3 GLU 32 1.640 -9.276 -0.097
269 HG2 GLU 32 HG2 GLU 32 0.098 -10.849 0.343
270 HG3 GLU 32 HG3 GLU 32 -0.811 -10.210 -1.037
271 H VAL 33 H VAL 33 -1.676 -8.456 -2.618
272 HA VAL 33 HA VAL 33 -2.269 -6.633 -0.341
273 HB VAL 33 HB VAL 33 -3.739 -5.334 -1.845
274 HG11 VAL 33 HG11 VAL 33 -0.864 -5.537 -2.834
275 HG12 VAL 33 HG12 VAL 33 -1.960 -4.156 -3.069
276 HG13 VAL 33 HG13 VAL 33 -1.419 -4.589 -1.431
277 HG21 VAL 33 HG21 VAL 33 -2.468 -7.023 -4.043
278 HG22 VAL 33 HG22 VAL 33 -4.170 -7.097 -3.526
279 HG23 VAL 33 HG23 VAL 33 -3.535 -5.623 -4.288
280 H SER 34 H SER 34 -4.430 -6.654 0.395
281 HA SER 34 HA SER 34 -6.143 -8.850 -0.624
282 HB2 SER 34 HB2 SER 34 -5.013 -9.669 1.410
283 HB3 SER 34 HB3 SER 34 -5.567 -8.233 2.303
284 HG SER 34 HG SER 34 -6.924 -10.114 2.537
285 H LEU 35 H LEU 35 -7.647 -7.567 -1.630
286 HA LEU 35 HA LEU 35 -8.374 -4.963 -0.719
287 HB2 LEU 35 HB2 LEU 35 -9.832 -6.940 -2.516
288 HB3 LEU 35 HB3 LEU 35 -10.235 -5.219 -2.356
289 HG LEU 35 HG LEU 35 -7.514 -6.263 -3.280
290 HD11 LEU 35 HD11 LEU 35 -8.915 -6.810 -5.079
291 HD12 LEU 35 HD12 LEU 35 -10.022 -5.437 -4.769
292 HD13 LEU 35 HD13 LEU 35 -8.412 -5.166 -5.477
293 HD21 LEU 35 HD21 LEU 35 -7.267 -3.881 -4.009
294 HD22 LEU 35 HD22 LEU 35 -8.810 -3.502 -3.218
295 HD23 LEU 35 HD23 LEU 35 -7.423 -4.042 -2.245
296 H GLU 36 H GLU 36 -9.328 -8.145 0.336
297 HA GLU 36 HA GLU 36 -11.928 -7.299 1.352
298 HB2 GLU 36 HB2 GLU 36 -10.233 -9.785 1.820
299 HB3 GLU 36 HB3 GLU 36 -11.920 -9.580 2.342
300 HG2 GLU 36 HG2 GLU 36 -12.638 -9.320 0.008
301 HG3 GLU 36 HG3 GLU 36 -10.956 -9.427 -0.545
302 H LYS 37 H LYS 37 -8.594 -7.600 2.544
303 HA LYS 37 HA LYS 37 -9.563 -7.028 5.288
304 HB2 LYS 37 HB2 LYS 37 -6.882 -8.053 4.287
305 HB3 LYS 37 HB3 LYS 37 -7.312 -7.762 5.992
306 HG2 LYS 37 HG2 LYS 37 -9.204 -9.345 5.790
307 HG3 LYS 37 HG3 LYS 37 -8.772 -9.655 4.095
308 HD2 LYS 37 HD2 LYS 37 -6.585 -10.549 4.798
309 HD3 LYS 37 HD3 LYS 37 -6.989 -10.208 6.500
310 HE2 LYS 37 HE2 LYS 37 -8.930 -11.719 6.358
311 HE3 LYS 37 HE3 LYS 37 -8.572 -12.041 4.651
312 HZ1 LYS 37 HZ1 LYS 37 -7.750 -13.753 6.087
313 HZ2 LYS 37 HZ2 LYS 37 -6.506 -13.005 5.311
314 HZ3 LYS 37 HZ3 LYS 37 -6.799 -12.681 6.905
315 H GLY 38 H GLY 38 -8.276 -5.424 2.565
316 HA2 GLY 38 HA2 GLY 38 -7.674 -3.212 2.346
317 HA3 GLY 38 HA3 GLY 38 -8.014 -2.980 4.073
318 H GLU 39 H GLU 39 -5.791 -5.548 3.136
319 HA GLU 39 HA GLU 39 -3.582 -3.995 4.403
320 HB2 GLU 39 HB2 GLU 39 -3.915 -6.945 3.708
321 HB3 GLU 39 HB3 GLU 39 -2.505 -6.233 4.523
322 HG2 GLU 39 HG2 GLU 39 -3.948 -5.481 6.382
323 HG3 GLU 39 HG3 GLU 39 -5.367 -6.167 5.568
324 H ALA 40 H ALA 40 -1.524 -3.952 3.476
325 HA ALA 40 HA ALA 40 -1.190 -4.766 0.676
326 HB1 ALA 40 HB1 ALA 40 -2.131 -2.507 0.484
327 HB2 ALA 40 HB2 ALA 40 -0.947 -1.888 1.655
328 HB3 ALA 40 HB3 ALA 40 -0.402 -2.474 0.066
329 H LEU 41 H LEU 41 0.549 -6.024 0.933
330 HA LEU 41 HA LEU 41 2.685 -5.143 2.811
331 HB2 LEU 41 HB2 LEU 41 2.097 -7.889 1.620
332 HB3 LEU 41 HB3 LEU 41 3.375 -7.497 2.769
333 HG LEU 41 HG LEU 41 1.688 -8.538 4.034
334 HD11 LEU 41 HD11 LEU 41 1.474 -5.517 4.331
335 HD12 LEU 41 HD12 LEU 41 0.754 -6.680 5.479
336 HD13 LEU 41 HD13 LEU 41 2.514 -6.632 5.227
337 HD21 LEU 41 HD21 LEU 41 -0.657 -7.984 3.985
338 HD22 LEU 41 HD22 LEU 41 -0.378 -6.641 2.864
339 HD23 LEU 41 HD23 LEU 41 -0.114 -8.318 2.326
340 H VAL 42 H VAL 42 4.864 -5.271 2.125
341 HA VAL 42 HA VAL 42 5.331 -5.811 -0.739
342 HB VAL 42 HB VAL 42 6.809 -3.846 -0.895
343 HG11 VAL 42 HG11 VAL 42 5.103 -2.255 -1.307
344 HG12 VAL 42 HG12 VAL 42 4.338 -3.830 -1.541
345 HG13 VAL 42 HG13 VAL 42 4.043 -2.932 -0.034
346 HG21 VAL 42 HG21 VAL 42 5.606 -3.034 1.785
347 HG22 VAL 42 HG22 VAL 42 7.279 -3.577 1.532
348 HG23 VAL 42 HG23 VAL 42 6.715 -2.066 0.786
349 H GLU 43 H GLU 43 7.674 -6.216 -1.147
350 HA GLU 43 HA GLU 43 9.200 -6.877 1.307
351 HB2 GLU 43 HB2 GLU 43 7.992 -8.916 0.454
352 HB3 GLU 43 HB3 GLU 43 8.906 -8.757 -1.061
353 HG2 GLU 43 HG2 GLU 43 11.027 -8.928 0.220
354 HG3 GLU 43 HG3 GLU 43 10.096 -9.107 1.720
355 H GLY 44 H GLY 44 10.595 -5.150 0.991
356 HA2 GLY 44 HA2 GLY 44 12.560 -5.434 -1.129
357 HA3 GLY 44 HA3 GLY 44 11.507 -4.015 -1.313
358 H THR 45 H THR 45 13.821 -3.090 -1.072
359 HA THR 45 HA THR 45 14.458 -2.693 1.807
360 HB THR 45 HB THR 45 16.704 -2.081 0.971
361 HG1 THR 45 HG1 THR 45 17.122 -2.663 -1.249
362 HG21 THR 45 HG21 THR 45 15.819 -4.507 1.488
363 HG22 THR 45 HG22 THR 45 15.993 -4.744 -0.252
364 HG23 THR 45 HG23 THR 45 17.421 -4.298 0.709
365 H ALA 46 H ALA 46 12.318 -1.309 0.234
366 HA ALA 46 HA ALA 46 13.281 1.325 -0.428
367 HB1 ALA 46 HB1 ALA 46 10.882 1.856 -0.571
368 HB2 ALA 46 HB2 ALA 46 11.211 0.295 -1.362
369 HB3 ALA 46 HB3 ALA 46 10.480 0.334 0.258
370 H ASP 47 H ASP 47 12.178 3.298 0.762
371 HA ASP 47 HA ASP 47 12.608 2.873 3.673
372 HB2 ASP 47 HB2 ASP 47 12.644 5.383 1.955
373 HB3 ASP 47 HB3 ASP 47 12.834 5.364 3.719
374 HA PRO 48 HA PRO 48 8.398 3.335 4.650
375 HB2 PRO 48 HB2 PRO 48 9.291 5.359 6.695
376 HB3 PRO 48 HB3 PRO 48 8.228 3.931 6.924
377 HG2 PRO 48 HG2 PRO 48 10.813 3.840 7.723
378 HG3 PRO 48 HG3 PRO 48 10.098 2.445 6.846
379 HD2 PRO 48 HD2 PRO 48 11.867 4.638 5.750
380 HD3 PRO 48 HD3 PRO 48 11.927 2.873 5.445
381 H LYS 49 H LYS 49 10.263 6.403 4.455
382 HA LYS 49 HA LYS 49 7.984 8.111 4.247
383 HB2 LYS 49 HB2 LYS 49 9.826 9.608 3.069
384 HB3 LYS 49 HB3 LYS 49 9.913 9.261 4.805
385 HG2 LYS 49 HG2 LYS 49 11.524 7.463 4.436
386 HG3 LYS 49 HG3 LYS 49 11.408 7.690 2.675
387 HD2 LYS 49 HD2 LYS 49 12.257 10.000 2.915
388 HD3 LYS 49 HD3 LYS 49 12.364 9.780 4.677
389 HE2 LYS 49 HE2 LYS 49 13.947 7.897 4.331
390 HE3 LYS 49 HE3 LYS 49 13.857 8.152 2.576
391 HZ1 LYS 49 HZ1 LYS 49 14.829 10.106 4.545
392 HZ2 LYS 49 HZ2 LYS 49 15.765 9.206 3.526
393 HZ3 LYS 49 HZ3 LYS 49 14.745 10.342 2.913
394 H ALA 50 H ALA 50 9.556 5.995 1.929
395 HA ALA 50 HA ALA 50 8.457 7.505 -0.348
396 HB1 ALA 50 HB1 ALA 50 10.721 6.511 -0.470
397 HB2 ALA 50 HB2 ALA 50 10.023 4.896 -0.200
398 HB3 ALA 50 HB3 ALA 50 9.630 5.799 -1.682
399 H LEU 51 H LEU 51 7.885 4.504 1.506
400 HA LEU 51 HA LEU 51 6.073 3.424 -0.436
401 HB2 LEU 51 HB2 LEU 51 7.453 2.238 1.434
402 HB3 LEU 51 HB3 LEU 51 6.102 2.692 2.496
403 HG LEU 51 HG LEU 51 4.571 1.612 0.709
404 HD11 LEU 51 HD11 LEU 51 5.746 -0.150 -0.660
405 HD12 LEU 51 HD12 LEU 51 6.209 1.502 -1.127
406 HD13 LEU 51 HD13 LEU 51 7.300 0.519 -0.125
407 HD21 LEU 51 HD21 LEU 51 5.209 0.572 2.918
408 HD22 LEU 51 HD22 LEU 51 4.871 -0.607 1.626
409 HD23 LEU 51 HD23 LEU 51 6.549 -0.241 2.082
410 H VAL 52 H VAL 52 5.580 5.113 2.735
411 HA VAL 52 HA VAL 52 2.729 4.879 2.622
412 HB VAL 52 HB VAL 52 4.463 6.917 4.081
413 HG11 VAL 52 HG11 VAL 52 2.072 7.535 3.991
414 HG12 VAL 52 HG12 VAL 52 1.625 5.918 4.582
415 HG13 VAL 52 HG13 VAL 52 2.530 7.031 5.632
416 HG21 VAL 52 HG21 VAL 52 4.256 5.357 5.999
417 HG22 VAL 52 HG22 VAL 52 3.422 4.187 4.948
418 HG23 VAL 52 HG23 VAL 52 5.124 4.619 4.637
419 H GLN 53 H GLN 53 5.056 7.334 1.463
420 HA GLN 53 HA GLN 53 3.090 9.324 0.894
421 HB2 GLN 53 HB2 GLN 53 5.495 9.776 1.186
422 HB3 GLN 53 HB3 GLN 53 5.859 8.850 -0.286
423 HG2 GLN 53 HG2 GLN 53 4.558 10.439 -1.634
424 HG3 GLN 53 HG3 GLN 53 4.074 11.316 -0.169
425 HE21 GLN 53 HE21 GLN 53 8.063 11.545 -1.331
426 HE22 GLN 53 HE22 GLN 53 7.174 10.053 -1.567
427 H ALA 54 H ALA 54 4.346 6.524 -0.902
428 HA ALA 54 HA ALA 54 3.497 7.277 -3.479
429 HB1 ALA 54 HB1 ALA 54 3.619 4.869 -3.972
430 HB2 ALA 54 HB2 ALA 54 5.012 5.399 -3.002
431 HB3 ALA 54 HB3 ALA 54 3.679 4.507 -2.231
432 H VAL 55 H VAL 55 1.775 5.203 -1.043
433 HA VAL 55 HA VAL 55 -0.585 5.078 -2.704
434 HB VAL 55 HB VAL 55 -1.600 4.040 -0.683
435 HG11 VAL 55 HG11 VAL 55 -0.106 2.086 -0.610
436 HG12 VAL 55 HG12 VAL 55 -0.270 2.696 -2.272
437 HG13 VAL 55 HG13 VAL 55 1.204 3.045 -1.337
438 HG21 VAL 55 HG21 VAL 55 -0.224 3.669 1.319
439 HG22 VAL 55 HG22 VAL 55 1.103 4.614 0.609
440 HG23 VAL 55 HG23 VAL 55 -0.434 5.407 1.032
441 H GLU 56 H GLU 56 0.627 7.339 -0.276
442 HA GLU 56 HA GLU 56 -1.960 8.447 0.343
443 HB2 GLU 56 HB2 GLU 56 0.001 8.637 1.826
444 HB3 GLU 56 HB3 GLU 56 0.843 9.610 0.601
445 HG2 GLU 56 HG2 GLU 56 -0.892 11.342 0.752
446 HG3 GLU 56 HG3 GLU 56 -1.806 10.355 1.909
447 H GLU 57 H GLU 57 0.362 8.804 -2.262
448 HA GLU 57 HA GLU 57 -0.579 11.352 -3.218
449 HB2 GLU 57 HB2 GLU 57 1.637 10.348 -3.771
450 HB3 GLU 57 HB3 GLU 57 0.809 9.080 -4.701
451 HG2 GLU 57 HG2 GLU 57 -0.132 10.761 -6.215
452 HG3 GLU 57 HG3 GLU 57 0.567 12.067 -5.237
453 H GLU 58 H GLU 58 -1.693 8.035 -3.405
454 HA GLU 58 HA GLU 58 -3.534 8.548 -5.633
455 HB2 GLU 58 HB2 GLU 58 -3.043 6.208 -3.753
456 HB3 GLU 58 HB3 GLU 58 -4.333 6.213 -4.972
457 HG2 GLU 58 HG2 GLU 58 -1.411 6.725 -5.656
458 HG3 GLU 58 HG3 GLU 58 -2.163 5.118 -5.693
459 H GLY 59 H GLY 59 -3.409 9.273 -2.319
460 HA2 GLY 59 HA2 GLY 59 -5.098 10.555 -1.273
461 HA3 GLY 59 HA3 GLY 59 -6.313 9.841 -2.346
462 H TYR 60 H TYR 60 -4.192 7.419 -1.157
463 HA TYR 60 HA TYR 60 -6.139 6.783 1.012
464 HB2 TYR 60 HB2 TYR 60 -4.799 4.900 -0.954
465 HB3 TYR 60 HB3 TYR 60 -5.847 4.420 0.383
466 HD1 TYR 60 HD1 TYR 60 -5.707 5.780 -3.006
467 HD2 TYR 60 HD2 TYR 60 -8.266 4.904 0.334
468 HE1 TYR 60 HE1 TYR 60 -7.687 5.939 -4.491
469 HE2 TYR 60 HE2 TYR 60 -10.252 5.056 -1.140
470 HH TYR 60 HH TYR 60 -11.022 5.479 -3.258
471 H LYS 61 H LYS 61 -4.872 7.469 2.752
472 HA LYS 61 HA LYS 61 -2.082 6.775 3.017
473 HB2 LYS 61 HB2 LYS 61 -4.226 7.598 5.020
474 HB3 LYS 61 HB3 LYS 61 -2.502 7.411 5.421
475 HG2 LYS 61 HG2 LYS 61 -1.894 9.105 3.760
476 HG3 LYS 61 HG3 LYS 61 -3.595 9.275 3.272
477 HD2 LYS 61 HD2 LYS 61 -4.193 10.080 5.509
478 HD3 LYS 61 HD3 LYS 61 -2.518 9.836 6.066
479 HE2 LYS 61 HE2 LYS 61 -1.708 11.469 4.418
480 HE3 LYS 61 HE3 LYS 61 -3.356 11.688 3.795
481 HZ1 LYS 61 HZ1 LYS 61 -2.697 13.402 5.336
482 HZ2 LYS 61 HZ2 LYS 61 -3.999 12.560 5.894
483 HZ3 LYS 61 HZ3 LYS 61 -2.501 12.295 6.539
484 H ALA 62 H ALA 62 -1.343 5.336 4.918
485 HA ALA 62 HA ALA 62 -3.161 3.149 5.587
486 HB1 ALA 62 HB1 ALA 62 -2.415 2.507 3.329
487 HB2 ALA 62 HB2 ALA 62 -0.721 2.730 3.814
488 HB3 ALA 62 HB3 ALA 62 -1.695 1.431 4.549
489 H GLU 63 H GLU 63 -2.765 2.947 7.719
490 HA GLU 63 HA GLU 63 -0.330 3.785 8.978
491 HB2 GLU 63 HB2 GLU 63 -2.605 1.995 9.931
492 HB3 GLU 63 HB3 GLU 63 -1.321 2.645 10.966
493 HG2 GLU 63 HG2 GLU 63 -2.035 4.950 10.404
494 HG3 GLU 63 HG3 GLU 63 -3.333 4.292 9.386
495 H VAL 64 H VAL 64 1.594 2.728 9.003
496 HA VAL 64 HA VAL 64 1.945 0.013 8.199
497 HB VAL 64 HB VAL 64 4.187 0.311 9.331
498 HG11 VAL 64 HG11 VAL 64 3.790 0.824 6.953
499 HG12 VAL 64 HG12 VAL 64 3.283 2.473 7.388
500 HG13 VAL 64 HG13 VAL 64 4.962 1.957 7.668
501 HG21 VAL 64 HG21 VAL 64 3.132 3.138 9.797
502 HG22 VAL 64 HG22 VAL 64 3.530 1.960 11.068
503 HG23 VAL 64 HG23 VAL 64 4.810 2.602 10.021
504 H LEU 65 H LEU 65 1.052 -1.684 9.249
505 HA LEU 65 HA LEU 65 0.364 -1.464 12.078
506 HB2 LEU 65 HB2 LEU 65 0.202 -3.814 10.143
507 HB3 LEU 65 HB3 LEU 65 -0.503 -3.761 11.766
508 HG LEU 65 HG LEU 65 -1.246 -1.878 9.476
509 HD11 LEU 65 HD11 LEU 65 -3.496 -3.233 10.012
510 HD12 LEU 65 HD12 LEU 65 -2.275 -3.882 8.869
511 HD13 LEU 65 HD13 LEU 65 -2.353 -4.461 10.549
512 HD21 LEU 65 HD21 LEU 65 -1.493 -0.835 11.699
513 HD22 LEU 65 HD22 LEU 65 -3.084 -1.226 11.018
514 HD23 LEU 65 HD23 LEU 65 -2.382 -2.265 12.281
515 H ALA 66 H ALA 66 3.185 -1.189 11.451
516 HA ALA 66 HA ALA 66 4.224 -3.475 13.028
517 HB1 ALA 66 HB1 ALA 66 4.790 -3.919 10.675
518 HB2 ALA 66 HB2 ALA 66 5.482 -2.287 10.523
519 HB3 ALA 66 HB3 ALA 66 6.250 -3.481 11.595
Start of MODEL 16
1 H1 MET 1 H MET 1 10.588 -3.003 9.669
2 HA MET 1 HA MET 1 9.568 -3.294 7.470
3 HB2 MET 1 HB2 MET 1 9.655 -5.166 9.139
4 HB3 MET 1 HB3 MET 1 7.988 -4.770 9.606
5 HG2 MET 1 HG2 MET 1 7.222 -5.210 7.334
6 HG3 MET 1 HG3 MET 1 8.884 -5.434 6.771
7 HE1 MET 1 HE1 MET 1 9.310 -7.700 5.946
8 HE2 MET 1 HE2 MET 1 10.401 -7.442 7.328
9 HE3 MET 1 HE3 MET 1 9.586 -9.009 7.121
10 H LEU 2 H LEU 2 7.375 -3.560 6.327
11 HA LEU 2 HA LEU 2 5.584 -1.384 7.298
12 HB2 LEU 2 HB2 LEU 2 6.203 -2.275 4.460
13 HB3 LEU 2 HB3 LEU 2 5.117 -0.947 4.920
14 HG LEU 2 HG LEU 2 8.086 -1.092 5.618
15 HD11 LEU 2 HD11 LEU 2 6.656 0.586 3.523
16 HD12 LEU 2 HD12 LEU 2 8.392 0.625 3.904
17 HD13 LEU 2 HD13 LEU 2 7.677 -0.834 3.183
18 HD21 LEU 2 HD21 LEU 2 6.040 1.157 5.859
19 HD22 LEU 2 HD22 LEU 2 6.752 0.247 7.214
20 HD23 LEU 2 HD23 LEU 2 7.777 1.292 6.212
21 H LYS 3 H LYS 3 3.351 -1.600 7.033
22 HA LYS 3 HA LYS 3 2.133 -4.097 6.138
23 HB2 LYS 3 HB2 LYS 3 2.996 -3.775 8.879
24 HB3 LYS 3 HB3 LYS 3 1.218 -3.717 8.830
25 HG2 LYS 3 HG2 LYS 3 1.107 -5.830 7.656
26 HG3 LYS 3 HG3 LYS 3 2.871 -5.838 7.423
27 HD2 LYS 3 HD2 LYS 3 3.175 -5.906 9.895
28 HD3 LYS 3 HD3 LYS 3 1.410 -6.049 10.086
29 HE2 LYS 3 HE2 LYS 3 1.408 -8.126 8.806
30 HE3 LYS 3 HE3 LYS 3 3.140 -7.964 8.455
31 HZ1 LYS 3 HZ1 LYS 3 2.099 -8.123 11.188
32 HZ2 LYS 3 HZ2 LYS 3 2.542 -9.464 10.315
33 HZ3 LYS 3 HZ3 LYS 3 3.648 -8.297 10.675
34 H LEU 4 H LEU 4 1.184 -2.457 4.725
35 HA LEU 4 HA LEU 4 0.245 0.011 5.945
36 HB2 LEU 4 HB2 LEU 4 0.638 -1.105 3.200
37 HB3 LEU 4 HB3 LEU 4 -0.602 0.149 3.387
38 HG LEU 4 HG LEU 4 1.044 1.621 4.521
39 HD11 LEU 4 HD11 LEU 4 3.017 -0.572 3.768
40 HD12 LEU 4 HD12 LEU 4 3.444 1.031 4.416
41 HD13 LEU 4 HD13 LEU 4 2.538 -0.120 5.420
42 HD21 LEU 4 HD21 LEU 4 0.672 1.772 2.074
43 HD22 LEU 4 HD22 LEU 4 2.355 2.156 2.500
44 HD23 LEU 4 HD23 LEU 4 1.953 0.566 1.810
45 H LYS 5 H LYS 5 -1.566 0.145 6.990
46 HA LYS 5 HA LYS 5 -3.941 -1.457 6.406
47 HB2 LYS 5 HB2 LYS 5 -3.322 -0.716 8.723
48 HB3 LYS 5 HB3 LYS 5 -3.431 0.969 8.182
49 HG2 LYS 5 HG2 LYS 5 -5.855 0.422 7.492
50 HG3 LYS 5 HG3 LYS 5 -5.684 -1.048 8.476
51 HD2 LYS 5 HD2 LYS 5 -5.179 0.303 10.455
52 HD3 LYS 5 HD3 LYS 5 -5.112 1.781 9.464
53 HE2 LYS 5 HE2 LYS 5 -7.515 1.421 8.829
54 HE3 LYS 5 HE3 LYS 5 -7.548 0.032 9.934
55 HZ1 LYS 5 HZ1 LYS 5 -6.659 1.841 11.565
56 HZ2 LYS 5 HZ2 LYS 5 -7.418 2.855 10.535
57 HZ3 LYS 5 HZ3 LYS 5 -8.289 1.670 11.269
58 H VAL 6 H VAL 6 -4.273 -0.837 4.133
59 HA VAL 6 HA VAL 6 -4.396 1.863 3.279
60 HB VAL 6 HB VAL 6 -5.874 -0.547 2.143
61 HG11 VAL 6 HG11 VAL 6 -4.844 2.029 0.874
62 HG12 VAL 6 HG12 VAL 6 -5.667 0.702 0.020
63 HG13 VAL 6 HG13 VAL 6 -6.549 1.665 1.228
64 HG21 VAL 6 HG21 VAL 6 -3.474 -1.048 2.440
65 HG22 VAL 6 HG22 VAL 6 -3.863 -0.829 0.721
66 HG23 VAL 6 HG23 VAL 6 -3.048 0.473 1.619
67 H GLU 7 H GLU 7 -5.708 3.354 4.133
68 HA GLU 7 HA GLU 7 -8.146 2.697 5.504
69 HB2 GLU 7 HB2 GLU 7 -6.515 4.631 5.937
70 HB3 GLU 7 HB3 GLU 7 -7.234 5.423 4.523
71 HG2 GLU 7 HG2 GLU 7 -8.341 6.212 6.550
72 HG3 GLU 7 HG3 GLU 7 -9.481 5.228 5.616
73 H GLY 8 H GLY 8 -10.300 3.218 4.893
74 HA2 GLY 8 HA2 GLY 8 -10.748 3.232 1.972
75 HA3 GLY 8 HA3 GLY 8 -11.920 2.801 3.234
76 H MET 9 H MET 9 -9.806 5.712 2.806
77 HA MET 9 HA MET 9 -11.903 7.460 3.695
78 HB2 MET 9 HB2 MET 9 -9.326 8.096 2.201
79 HB3 MET 9 HB3 MET 9 -10.368 9.261 3.044
80 HG2 MET 9 HG2 MET 9 -10.021 7.982 5.161
81 HG3 MET 9 HG3 MET 9 -8.915 6.908 4.296
82 HE1 MET 9 HE1 MET 9 -8.169 11.367 5.279
83 HE2 MET 9 HE2 MET 9 -9.392 10.848 4.096
84 HE3 MET 9 HE3 MET 9 -9.570 10.408 5.812
85 H THR 10 H THR 10 -10.881 6.233 0.523
86 HA THR 10 HA THR 10 -13.164 7.732 -0.650
87 HB THR 10 HB THR 10 -11.802 8.114 -2.686
88 HG1 THR 10 HG1 THR 10 -10.239 6.610 -2.603
89 HG21 THR 10 HG21 THR 10 -11.933 9.873 -0.941
90 HG22 THR 10 HG22 THR 10 -10.502 9.177 -0.141
91 HG23 THR 10 HG23 THR 10 -10.358 9.881 -1.767
92 H CYS 11 H CYS 11 -13.911 6.752 -2.710
93 HA CYS 11 HA CYS 11 -14.850 4.936 -3.719
94 HB2 CYS 11 HB2 CYS 11 -11.972 3.965 -3.597
95 HB3 CYS 11 HB3 CYS 11 -13.224 3.400 -4.725
96 HG CYS 11 HG CYS 11 -13.713 5.738 -5.781
97 H ASN 12 H ASN 12 -14.978 4.848 -0.767
98 HA ASN 12 HA ASN 12 -14.197 2.261 0.137
99 HB2 ASN 12 HB2 ASN 12 -15.486 2.789 2.112
100 HB3 ASN 12 HB3 ASN 12 -14.625 4.246 1.585
101 HD21 ASN 12 HD21 ASN 12 -18.619 4.337 2.039
102 HD22 ASN 12 HD22 ASN 12 -17.564 3.095 2.681
103 H HIS 13 H HIS 13 -16.938 3.309 -1.771
104 HA HIS 13 HA HIS 13 -18.456 0.871 -1.080
105 HB2 HIS 13 HB2 HIS 13 -19.062 3.157 -2.982
106 HB3 HIS 13 HB3 HIS 13 -20.137 1.791 -2.651
107 HD1 HIS 13 HD1 HIS 13 -21.473 1.853 -0.336
108 HD2 HIS 13 HD2 HIS 13 -18.790 5.024 -1.032
109 HE1 HIS 13 HE1 HIS 13 -21.980 3.644 1.413
110 H CYS 14 H CYS 14 -15.887 1.703 -3.043
111 HA CYS 14 HA CYS 14 -16.517 -0.464 -4.978
112 HB2 CYS 14 HB2 CYS 14 -15.076 2.165 -5.524
113 HB3 CYS 14 HB3 CYS 14 -15.324 0.847 -6.694
114 HG CYS 14 HG CYS 14 -16.950 2.828 -7.206
115 H VAL 15 H VAL 15 -14.021 -0.552 -6.225
116 HA VAL 15 HA VAL 15 -12.035 -0.747 -4.063
117 HB VAL 15 HB VAL 15 -13.200 -2.940 -4.155
118 HG11 VAL 15 HG11 VAL 15 -12.106 -3.056 -6.998
119 HG12 VAL 15 HG12 VAL 15 -12.912 -4.382 -6.131
120 HG13 VAL 15 HG13 VAL 15 -13.822 -2.913 -6.552
121 HG21 VAL 15 HG21 VAL 15 -10.375 -3.104 -5.262
122 HG22 VAL 15 HG22 VAL 15 -10.767 -2.703 -3.567
123 HG23 VAL 15 HG23 VAL 15 -11.207 -4.289 -4.237
124 H MET 16 H MET 16 -9.838 -0.868 -4.909
125 HA MET 16 HA MET 16 -9.552 -0.300 -7.804
126 HB2 MET 16 HB2 MET 16 -8.531 1.413 -5.511
127 HB3 MET 16 HB3 MET 16 -7.991 1.589 -7.189
128 HG2 MET 16 HG2 MET 16 -10.941 1.632 -6.767
129 HG3 MET 16 HG3 MET 16 -10.043 2.976 -6.065
130 HE1 MET 16 HE1 MET 16 -11.265 5.018 -8.112
131 HE2 MET 16 HE2 MET 16 -11.985 3.941 -9.318
132 HE3 MET 16 HE3 MET 16 -12.137 3.546 -7.589
133 H ALA 17 H ALA 17 -7.275 -0.547 -8.509
134 HA ALA 17 HA ALA 17 -5.990 -2.748 -7.085
135 HB1 ALA 17 HB1 ALA 17 -6.089 -2.693 -9.552
136 HB2 ALA 17 HB2 ALA 17 -5.177 -1.164 -9.561
137 HB3 ALA 17 HB3 ALA 17 -4.403 -2.659 -8.984
138 H VAL 18 H VAL 18 -5.346 -1.816 -5.075
139 HA VAL 18 HA VAL 18 -3.896 0.643 -4.920
140 HB VAL 18 HB VAL 18 -3.905 -1.717 -3.019
141 HG11 VAL 18 HG11 VAL 18 -2.355 0.518 -2.818
142 HG12 VAL 18 HG12 VAL 18 -3.813 1.083 -2.011
143 HG13 VAL 18 HG13 VAL 18 -2.996 -0.374 -1.404
144 HG21 VAL 18 HG21 VAL 18 -6.219 -0.796 -3.721
145 HG22 VAL 18 HG22 VAL 18 -5.860 -0.883 -1.972
146 HG23 VAL 18 HG23 VAL 18 -5.761 0.664 -2.840
147 H THR 19 H THR 19 -3.000 -2.651 -5.715
148 HA THR 19 HA THR 19 -0.373 -2.755 -4.890
149 HB THR 19 HB THR 19 -1.481 -3.852 -7.498
150 HG1 THR 19 HG1 THR 19 -1.901 -5.673 -6.066
151 HG21 THR 19 HG21 THR 19 0.685 -4.898 -5.624
152 HG22 THR 19 HG22 THR 19 0.182 -5.613 -7.168
153 HG23 THR 19 HG23 THR 19 1.005 -4.038 -7.152
154 H LYS 20 H LYS 20 -1.695 -1.097 -7.777
155 HA LYS 20 HA LYS 20 0.798 -0.695 -9.072
156 HB2 LYS 20 HB2 LYS 20 -1.776 0.929 -9.142
157 HB3 LYS 20 HB3 LYS 20 -0.416 1.120 -10.272
158 HG2 LYS 20 HG2 LYS 20 -0.633 -1.266 -10.922
159 HG3 LYS 20 HG3 LYS 20 -2.041 -1.425 -9.848
160 HD2 LYS 20 HD2 LYS 20 -3.241 0.295 -11.147
161 HD3 LYS 20 HD3 LYS 20 -1.818 0.509 -12.195
162 HE2 LYS 20 HE2 LYS 20 -1.967 -1.869 -12.876
163 HE3 LYS 20 HE3 LYS 20 -3.399 -2.073 -11.846
164 HZ1 LYS 20 HZ1 LYS 20 -3.987 -1.684 -14.121
165 HZ2 LYS 20 HZ2 LYS 20 -4.518 -0.444 -13.180
166 HZ3 LYS 20 HZ3 LYS 20 -3.187 -0.240 -14.133
167 H ALA 21 H ALA 21 -0.608 0.880 -6.247
168 HA ALA 21 HA ALA 21 1.074 3.251 -6.540
169 HB1 ALA 21 HB1 ALA 21 -0.592 2.231 -4.202
170 HB2 ALA 21 HB2 ALA 21 0.123 3.853 -4.354
171 HB3 ALA 21 HB3 ALA 21 -1.162 3.339 -5.473
172 H LEU 22 H LEU 22 1.307 0.055 -5.083
173 HA LEU 22 HA LEU 22 3.397 0.802 -3.188
174 HB2 LEU 22 HB2 LEU 22 2.217 -1.817 -4.196
175 HB3 LEU 22 HB3 LEU 22 3.610 -1.762 -3.112
176 HG LEU 22 HG LEU 22 1.654 -2.154 -1.804
177 HD11 LEU 22 HD11 LEU 22 3.433 -0.600 -0.923
178 HD12 LEU 22 HD12 LEU 22 2.393 0.760 -1.396
179 HD13 LEU 22 HD13 LEU 22 1.827 -0.400 -0.176
180 HD21 LEU 22 HD21 LEU 22 0.513 0.436 -2.915
181 HD22 LEU 22 HD22 LEU 22 -0.031 -1.211 -3.327
182 HD23 LEU 22 HD23 LEU 22 -0.223 -0.596 -1.671
183 H LYS 23 H LYS 23 3.206 -1.001 -6.291
184 HA LYS 23 HA LYS 23 5.910 -1.772 -6.296
185 HB2 LYS 23 HB2 LYS 23 3.919 -2.740 -7.531
186 HB3 LYS 23 HB3 LYS 23 4.147 -1.461 -8.743
187 HG2 LYS 23 HG2 LYS 23 6.417 -2.271 -9.205
188 HG3 LYS 23 HG3 LYS 23 6.310 -3.417 -7.847
189 HD2 LYS 23 HD2 LYS 23 4.377 -4.528 -8.978
190 HD3 LYS 23 HD3 LYS 23 4.622 -3.462 -10.384
191 HE2 LYS 23 HE2 LYS 23 6.905 -4.338 -10.663
192 HE3 LYS 23 HE3 LYS 23 6.719 -5.335 -9.206
193 HZ1 LYS 23 HZ1 LYS 23 5.164 -5.599 -11.685
194 HZ2 LYS 23 HZ2 LYS 23 6.344 -6.620 -11.153
195 HZ3 LYS 23 HZ3 LYS 23 4.933 -6.490 -10.316
196 H LYS 24 H LYS 24 4.500 1.311 -7.281
197 HA LYS 24 HA LYS 24 6.578 1.950 -9.169
198 HB2 LYS 24 HB2 LYS 24 4.560 3.634 -7.645
199 HB3 LYS 24 HB3 LYS 24 5.653 4.285 -8.888
200 HG2 LYS 24 HG2 LYS 24 4.729 2.792 -10.573
201 HG3 LYS 24 HG3 LYS 24 3.722 1.977 -9.357
202 HD2 LYS 24 HD2 LYS 24 2.518 4.091 -8.921
203 HD3 LYS 24 HD3 LYS 24 3.525 4.920 -10.131
204 HE2 LYS 24 HE2 LYS 24 2.681 3.431 -11.890
205 HE3 LYS 24 HE3 LYS 24 1.733 2.522 -10.695
206 HZ1 LYS 24 HZ1 LYS 24 1.369 5.370 -11.319
207 HZ2 LYS 24 HZ2 LYS 24 0.417 4.144 -11.877
208 HZ3 LYS 24 HZ3 LYS 24 0.471 4.480 -10.264
209 H VAL 25 H VAL 25 6.539 1.898 -5.688
210 HA VAL 25 HA VAL 25 8.411 4.081 -5.350
211 HB VAL 25 HB VAL 25 7.437 1.818 -3.583
212 HG11 VAL 25 HG11 VAL 25 8.498 3.038 -1.701
213 HG12 VAL 25 HG12 VAL 25 9.703 2.418 -2.851
214 HG13 VAL 25 HG13 VAL 25 9.266 4.144 -2.863
215 HG21 VAL 25 HG21 VAL 25 6.981 4.811 -3.350
216 HG22 VAL 25 HG22 VAL 25 5.897 3.742 -4.291
217 HG23 VAL 25 HG23 VAL 25 6.105 3.507 -2.542
218 HA PRO 26 HA PRO 26 12.027 1.936 -6.747
219 HB2 PRO 26 HB2 PRO 26 13.283 3.767 -4.701
220 HB3 PRO 26 HB3 PRO 26 13.824 3.424 -6.379
221 HG2 PRO 26 HG2 PRO 26 12.496 5.717 -5.841
222 HG3 PRO 26 HG3 PRO 26 12.050 4.750 -7.290
223 HD2 PRO 26 HD2 PRO 26 10.670 4.843 -4.601
224 HD3 PRO 26 HD3 PRO 26 9.953 4.849 -6.244
225 H GLY 27 H GLY 27 13.182 0.148 -6.047
226 HA2 GLY 27 HA2 GLY 27 14.327 -1.186 -4.491
227 HA3 GLY 27 HA3 GLY 27 13.555 -0.305 -3.158
228 H VAL 28 H VAL 28 10.885 -0.614 -4.723
229 HA VAL 28 HA VAL 28 10.113 -3.112 -3.428
230 HB VAL 28 HB VAL 28 8.638 -1.083 -5.155
231 HG11 VAL 28 HG11 VAL 28 7.617 -3.301 -5.410
232 HG12 VAL 28 HG12 VAL 28 7.563 -3.489 -3.640
233 HG13 VAL 28 HG13 VAL 28 6.580 -2.239 -4.427
234 HG21 VAL 28 HG21 VAL 28 8.563 -1.684 -2.165
235 HG22 VAL 28 HG22 VAL 28 9.297 -0.251 -2.924
236 HG23 VAL 28 HG23 VAL 28 7.539 -0.500 -3.007
237 H GLU 29 H GLU 29 9.962 -5.074 -4.406
238 HA GLU 29 HA GLU 29 10.218 -5.155 -7.380
239 HB2 GLU 29 HB2 GLU 29 12.336 -5.792 -6.278
240 HB3 GLU 29 HB3 GLU 29 11.465 -6.988 -5.294
241 HG2 GLU 29 HG2 GLU 29 10.736 -8.128 -7.403
242 HG3 GLU 29 HG3 GLU 29 11.729 -6.985 -8.329
243 H LYS 30 H LYS 30 8.836 -6.445 -4.379
244 HA LYS 30 HA LYS 30 6.777 -7.792 -6.034
245 HB2 LYS 30 HB2 LYS 30 8.210 -8.975 -3.625
246 HB3 LYS 30 HB3 LYS 30 6.769 -9.674 -4.402
247 HG2 LYS 30 HG2 LYS 30 7.989 -9.852 -6.538
248 HG3 LYS 30 HG3 LYS 30 9.433 -9.138 -5.786
249 HD2 LYS 30 HD2 LYS 30 9.565 -11.038 -4.204
250 HD3 LYS 30 HD3 LYS 30 8.094 -11.727 -4.932
251 HE2 LYS 30 HE2 LYS 30 9.471 -12.824 -6.330
252 HE3 LYS 30 HE3 LYS 30 9.673 -11.267 -7.155
253 HZ1 LYS 30 HZ1 LYS 30 11.368 -12.314 -4.986
254 HZ2 LYS 30 HZ2 LYS 30 11.766 -12.276 -6.586
255 HZ3 LYS 30 HZ3 LYS 30 11.579 -10.870 -5.751
256 H VAL 31 H VAL 31 4.710 -7.882 -5.100
257 HA VAL 31 HA VAL 31 4.289 -6.487 -2.536
258 HB VAL 31 HB VAL 31 3.005 -5.656 -5.173
259 HG11 VAL 31 HG11 VAL 31 1.462 -5.523 -3.226
260 HG12 VAL 31 HG12 VAL 31 2.649 -4.518 -2.370
261 HG13 VAL 31 HG13 VAL 31 1.884 -3.917 -3.859
262 HG21 VAL 31 HG21 VAL 31 4.128 -3.484 -4.764
263 HG22 VAL 31 HG22 VAL 31 4.939 -4.180 -3.341
264 HG23 VAL 31 HG23 VAL 31 5.299 -4.802 -4.970
265 H GLU 32 H GLU 32 2.335 -7.084 -1.550
266 HA GLU 32 HA GLU 32 0.481 -8.823 -3.023
267 HB2 GLU 32 HB2 GLU 32 2.159 -10.381 -2.047
268 HB3 GLU 32 HB3 GLU 32 1.865 -9.657 -0.453
269 HG2 GLU 32 HG2 GLU 32 0.328 -11.288 -0.208
270 HG3 GLU 32 HG3 GLU 32 -0.705 -10.264 -1.217
271 H VAL 33 H VAL 33 -1.495 -8.023 -2.636
272 HA VAL 33 HA VAL 33 -2.000 -6.846 0.047
273 HB VAL 33 HB VAL 33 -3.163 -4.991 -0.949
274 HG11 VAL 33 HG11 VAL 33 -0.574 -5.404 -2.503
275 HG12 VAL 33 HG12 VAL 33 -1.354 -3.851 -2.132
276 HG13 VAL 33 HG13 VAL 33 -0.656 -4.834 -0.822
277 HG21 VAL 33 HG21 VAL 33 -2.565 -6.307 -3.633
278 HG22 VAL 33 HG22 VAL 33 -4.168 -6.148 -2.875
279 HG23 VAL 33 HG23 VAL 33 -3.292 -4.699 -3.409
280 H SER 34 H SER 34 -4.252 -6.859 0.685
281 HA SER 34 HA SER 34 -5.951 -8.701 -0.921
282 HB2 SER 34 HB2 SER 34 -5.099 -10.044 0.881
283 HB3 SER 34 HB3 SER 34 -5.441 -8.776 2.070
284 HG SER 34 HG SER 34 -7.046 -10.448 1.970
285 H LEU 35 H LEU 35 -7.323 -7.275 -1.763
286 HA LEU 35 HA LEU 35 -7.977 -4.778 -0.616
287 HB2 LEU 35 HB2 LEU 35 -9.363 -6.445 -2.744
288 HB3 LEU 35 HB3 LEU 35 -9.663 -4.718 -2.454
289 HG LEU 35 HG LEU 35 -6.907 -5.863 -3.120
290 HD11 LEU 35 HD11 LEU 35 -8.077 -6.267 -5.104
291 HD12 LEU 35 HD12 LEU 35 -9.157 -4.855 -4.877
292 HD13 LEU 35 HD13 LEU 35 -7.457 -4.635 -5.355
293 HD21 LEU 35 HD21 LEU 35 -6.411 -3.499 -3.654
294 HD22 LEU 35 HD22 LEU 35 -8.055 -3.038 -3.158
295 HD23 LEU 35 HD23 LEU 35 -6.906 -3.677 -1.958
296 H GLU 36 H GLU 36 -9.240 -7.939 0.139
297 HA GLU 36 HA GLU 36 -11.901 -7.027 0.822
298 HB2 GLU 36 HB2 GLU 36 -10.325 -9.521 1.568
299 HB3 GLU 36 HB3 GLU 36 -12.044 -9.256 1.936
300 HG2 GLU 36 HG2 GLU 36 -12.513 -8.977 -0.485
301 HG3 GLU 36 HG3 GLU 36 -10.804 -9.302 -0.845
302 H LYS 37 H LYS 37 -8.825 -7.447 2.625
303 HA LYS 37 HA LYS 37 -10.249 -6.529 5.060
304 HB2 LYS 37 HB2 LYS 37 -7.634 -8.024 4.745
305 HB3 LYS 37 HB3 LYS 37 -8.273 -7.415 6.287
306 HG2 LYS 37 HG2 LYS 37 -10.306 -8.759 6.001
307 HG3 LYS 37 HG3 LYS 37 -9.742 -9.315 4.408
308 HD2 LYS 37 HD2 LYS 37 -7.795 -10.398 5.450
309 HD3 LYS 37 HD3 LYS 37 -8.312 -9.819 7.052
310 HE2 LYS 37 HE2 LYS 37 -10.407 -11.093 6.856
311 HE3 LYS 37 HE3 LYS 37 -9.945 -11.637 5.230
312 HZ1 LYS 37 HZ1 LYS 37 -9.475 -13.266 6.922
313 HZ2 LYS 37 HZ2 LYS 37 -8.094 -12.769 6.175
314 HZ3 LYS 37 HZ3 LYS 37 -8.453 -12.224 7.691
315 H GLY 38 H GLY 38 -8.316 -5.333 2.559
316 HA2 GLY 38 HA2 GLY 38 -7.616 -3.167 2.268
317 HA3 GLY 38 HA3 GLY 38 -8.120 -2.797 3.921
318 H GLU 39 H GLU 39 -5.848 -5.473 3.436
319 HA GLU 39 HA GLU 39 -3.727 -3.785 4.676
320 HB2 GLU 39 HB2 GLU 39 -3.906 -6.804 4.260
321 HB3 GLU 39 HB3 GLU 39 -2.620 -5.938 5.107
322 HG2 GLU 39 HG2 GLU 39 -4.269 -5.086 6.751
323 HG3 GLU 39 HG3 GLU 39 -5.550 -6.003 5.936
324 H ALA 40 H ALA 40 -1.587 -3.857 3.803
325 HA ALA 40 HA ALA 40 -1.277 -4.866 1.054
326 HB1 ALA 40 HB1 ALA 40 -2.125 -2.578 0.757
327 HB2 ALA 40 HB2 ALA 40 -0.881 -1.955 1.864
328 HB3 ALA 40 HB3 ALA 40 -0.408 -2.660 0.301
329 H LEU 41 H LEU 41 0.445 -6.139 1.285
330 HA LEU 41 HA LEU 41 2.656 -5.312 3.092
331 HB2 LEU 41 HB2 LEU 41 1.982 -8.009 1.832
332 HB3 LEU 41 HB3 LEU 41 3.322 -7.679 2.928
333 HG LEU 41 HG LEU 41 1.675 -8.730 4.241
334 HD11 LEU 41 HD11 LEU 41 1.544 -5.717 4.650
335 HD12 LEU 41 HD12 LEU 41 0.850 -6.901 5.791
336 HD13 LEU 41 HD13 LEU 41 2.598 -6.885 5.460
337 HD21 LEU 41 HD21 LEU 41 -0.654 -8.134 4.330
338 HD22 LEU 41 HD22 LEU 41 -0.408 -6.749 3.254
339 HD23 LEU 41 HD23 LEU 41 -0.207 -8.407 2.633
340 H VAL 42 H VAL 42 4.838 -5.495 2.325
341 HA VAL 42 HA VAL 42 5.129 -5.816 -0.608
342 HB VAL 42 HB VAL 42 6.731 -3.963 -0.656
343 HG11 VAL 42 HG11 VAL 42 5.135 -2.213 -0.729
344 HG12 VAL 42 HG12 VAL 42 4.227 -3.692 -1.066
345 HG13 VAL 42 HG13 VAL 42 4.132 -2.960 0.552
346 HG21 VAL 42 HG21 VAL 42 5.852 -3.443 2.216
347 HG22 VAL 42 HG22 VAL 42 7.458 -4.010 1.703
348 HG23 VAL 42 HG23 VAL 42 6.900 -2.389 1.237
349 H GLU 43 H GLU 43 7.382 -6.404 -1.199
350 HA GLU 43 HA GLU 43 8.986 -7.410 1.083
351 HB2 GLU 43 HB2 GLU 43 7.558 -9.250 0.184
352 HB3 GLU 43 HB3 GLU 43 8.316 -9.025 -1.407
353 HG2 GLU 43 HG2 GLU 43 10.529 -9.524 -0.411
354 HG3 GLU 43 HG3 GLU 43 9.771 -9.721 1.181
355 H GLY 44 H GLY 44 10.220 -5.459 0.621
356 HA2 GLY 44 HA2 GLY 44 12.196 -5.866 -1.508
357 HA3 GLY 44 HA3 GLY 44 11.182 -4.416 -1.654
358 H THR 45 H THR 45 13.483 -3.486 -1.473
359 HA THR 45 HA THR 45 14.249 -3.181 1.390
360 HB THR 45 HB THR 45 16.502 -2.690 0.514
361 HG1 THR 45 HG1 THR 45 16.470 -2.085 -1.502
362 HG21 THR 45 HG21 THR 45 15.476 -5.069 0.990
363 HG22 THR 45 HG22 THR 45 15.616 -5.276 -0.757
364 HG23 THR 45 HG23 THR 45 17.078 -4.939 0.198
365 H ALA 46 H ALA 46 12.147 -1.634 -0.111
366 HA ALA 46 HA ALA 46 13.335 0.947 -0.698
367 HB1 ALA 46 HB1 ALA 46 11.002 1.658 -0.938
368 HB2 ALA 46 HB2 ALA 46 11.249 0.100 -1.759
369 HB3 ALA 46 HB3 ALA 46 10.442 0.146 -0.175
370 H ASP 47 H ASP 47 12.378 2.956 0.532
371 HA ASP 47 HA ASP 47 12.844 2.397 3.393
372 HB2 ASP 47 HB2 ASP 47 14.208 4.036 1.948
373 HB3 ASP 47 HB3 ASP 47 12.806 5.116 2.069
374 HA PRO 48 HA PRO 48 8.693 2.764 4.558
375 HB2 PRO 48 HB2 PRO 48 9.840 4.463 6.782
376 HB3 PRO 48 HB3 PRO 48 8.592 3.176 6.895
377 HG2 PRO 48 HG2 PRO 48 11.148 2.591 7.515
378 HG3 PRO 48 HG3 PRO 48 10.228 1.472 6.450
379 HD2 PRO 48 HD2 PRO 48 12.274 3.548 5.674
380 HD3 PRO 48 HD3 PRO 48 12.042 1.890 5.038
381 H LYS 49 H LYS 49 10.482 5.922 4.567
382 HA LYS 49 HA LYS 49 8.080 7.475 4.811
383 HB2 LYS 49 HB2 LYS 49 9.648 9.257 3.662
384 HB3 LYS 49 HB3 LYS 49 9.999 8.703 5.312
385 HG2 LYS 49 HG2 LYS 49 11.691 7.183 4.556
386 HG3 LYS 49 HG3 LYS 49 11.248 7.444 2.852
387 HD2 LYS 49 HD2 LYS 49 11.875 9.844 3.093
388 HD3 LYS 49 HD3 LYS 49 12.449 9.508 4.745
389 HE2 LYS 49 HE2 LYS 49 14.074 7.888 3.877
390 HE3 LYS 49 HE3 LYS 49 13.426 8.081 2.236
391 HZ1 LYS 49 HZ1 LYS 49 14.749 10.178 3.808
392 HZ2 LYS 49 HZ2 LYS 49 15.401 9.359 2.533
393 HZ3 LYS 49 HZ3 LYS 49 14.116 10.368 2.298
394 H ALA 50 H ALA 50 9.459 5.730 2.110
395 HA ALA 50 HA ALA 50 8.221 7.532 0.156
396 HB1 ALA 50 HB1 ALA 50 10.435 6.519 -0.261
397 HB2 ALA 50 HB2 ALA 50 9.707 4.897 -0.177
398 HB3 ALA 50 HB3 ALA 50 9.247 6.012 -1.484
399 H LEU 51 H LEU 51 7.632 4.286 1.576
400 HA LEU 51 HA LEU 51 5.715 3.562 -0.406
401 HB2 LEU 51 HB2 LEU 51 7.014 2.117 1.382
402 HB3 LEU 51 HB3 LEU 51 5.626 2.504 2.417
403 HG LEU 51 HG LEU 51 4.158 1.705 0.445
404 HD11 LEU 51 HD11 LEU 51 5.309 0.131 -1.119
405 HD12 LEU 51 HD12 LEU 51 5.954 1.776 -1.278
406 HD13 LEU 51 HD13 LEU 51 6.868 0.549 -0.377
407 HD21 LEU 51 HD21 LEU 51 4.639 0.393 2.542
408 HD22 LEU 51 HD22 LEU 51 4.341 -0.622 1.109
409 HD23 LEU 51 HD23 LEU 51 6.001 -0.368 1.693
410 H VAL 52 H VAL 52 5.340 4.821 2.952
411 HA VAL 52 HA VAL 52 2.493 4.826 2.862
412 HB VAL 52 HB VAL 52 4.409 6.433 4.601
413 HG11 VAL 52 HG11 VAL 52 2.082 7.250 4.738
414 HG12 VAL 52 HG12 VAL 52 1.507 5.588 5.009
415 HG13 VAL 52 HG13 VAL 52 2.528 6.387 6.226
416 HG21 VAL 52 HG21 VAL 52 4.125 4.557 6.195
417 HG22 VAL 52 HG22 VAL 52 3.148 3.685 4.992
418 HG23 VAL 52 HG23 VAL 52 4.871 4.007 4.679
419 H GLN 53 H GLN 53 4.897 7.103 1.632
420 HA GLN 53 HA GLN 53 2.934 9.282 1.544
421 HB2 GLN 53 HB2 GLN 53 5.371 9.652 1.974
422 HB3 GLN 53 HB3 GLN 53 5.718 9.078 0.326
423 HG2 GLN 53 HG2 GLN 53 4.287 10.887 -0.591
424 HG3 GLN 53 HG3 GLN 53 3.940 11.444 1.059
425 HE21 GLN 53 HE21 GLN 53 6.878 13.275 -0.688
426 HE22 GLN 53 HE22 GLN 53 5.347 12.726 -1.331
427 H ALA 54 H ALA 54 4.386 6.848 -0.621
428 HA ALA 54 HA ALA 54 3.485 7.940 -3.070
429 HB1 ALA 54 HB1 ALA 54 3.780 5.619 -3.909
430 HB2 ALA 54 HB2 ALA 54 5.160 6.169 -2.931
431 HB3 ALA 54 HB3 ALA 54 3.961 5.059 -2.229
432 H VAL 55 H VAL 55 1.898 5.624 -0.782
433 HA VAL 55 HA VAL 55 -0.382 5.270 -2.503
434 HB VAL 55 HB VAL 55 -1.398 4.227 -0.491
435 HG11 VAL 55 HG11 VAL 55 0.223 2.396 -0.298
436 HG12 VAL 55 HG12 VAL 55 0.099 2.948 -1.983
437 HG13 VAL 55 HG13 VAL 55 1.495 3.429 -0.988
438 HG21 VAL 55 HG21 VAL 55 -0.422 5.716 1.236
439 HG22 VAL 55 HG22 VAL 55 -0.063 4.009 1.570
440 HG23 VAL 55 HG23 VAL 55 1.194 5.062 0.883
441 H GLU 56 H GLU 56 0.555 7.704 -0.141
442 HA GLU 56 HA GLU 56 -2.120 8.688 0.309
443 HB2 GLU 56 HB2 GLU 56 -0.207 9.024 1.854
444 HB3 GLU 56 HB3 GLU 56 0.608 10.012 0.621
445 HG2 GLU 56 HG2 GLU 56 -1.257 11.620 0.670
446 HG3 GLU 56 HG3 GLU 56 -2.104 10.623 1.868
447 H GLU 57 H GLU 57 0.287 9.009 -2.215
448 HA GLU 57 HA GLU 57 -0.653 11.498 -3.300
449 HB2 GLU 57 HB2 GLU 57 1.575 10.395 -3.753
450 HB3 GLU 57 HB3 GLU 57 0.716 9.186 -4.734
451 HG2 GLU 57 HG2 GLU 57 -0.129 10.972 -6.210
452 HG3 GLU 57 HG3 GLU 57 0.666 12.197 -5.201
453 H GLU 58 H GLU 58 -1.770 8.177 -3.346
454 HA GLU 58 HA GLU 58 -3.580 8.688 -5.620
455 HB2 GLU 58 HB2 GLU 58 -3.035 6.235 -3.898
456 HB3 GLU 58 HB3 GLU 58 -4.177 6.281 -5.259
457 HG2 GLU 58 HG2 GLU 58 -1.197 6.887 -5.435
458 HG3 GLU 58 HG3 GLU 58 -1.966 5.369 -5.930
459 H GLY 59 H GLY 59 -3.491 9.247 -2.300
460 HA2 GLY 59 HA2 GLY 59 -5.255 10.315 -1.162
461 HA3 GLY 59 HA3 GLY 59 -6.428 9.562 -2.258
462 H TYR 60 H TYR 60 -4.142 7.226 -1.277
463 HA TYR 60 HA TYR 60 -6.039 6.284 0.821
464 HB2 TYR 60 HB2 TYR 60 -4.276 4.703 -1.079
465 HB3 TYR 60 HB3 TYR 60 -5.382 4.025 0.122
466 HD1 TYR 60 HD1 TYR 60 -5.061 5.551 -3.177
467 HD2 TYR 60 HD2 TYR 60 -7.839 4.220 -0.184
468 HE1 TYR 60 HE1 TYR 60 -6.880 5.591 -4.862
469 HE2 TYR 60 HE2 TYR 60 -9.666 4.239 -1.857
470 HH TYR 60 HH TYR 60 -10.244 4.646 -4.051
471 H LYS 61 H LYS 61 -4.934 7.247 2.597
472 HA LYS 61 HA LYS 61 -2.109 6.833 3.036
473 HB2 LYS 61 HB2 LYS 61 -4.415 7.525 4.906
474 HB3 LYS 61 HB3 LYS 61 -2.696 7.563 5.366
475 HG2 LYS 61 HG2 LYS 61 -2.231 9.243 3.652
476 HG3 LYS 61 HG3 LYS 61 -3.907 9.158 3.069
477 HD2 LYS 61 HD2 LYS 61 -4.725 9.967 5.249
478 HD3 LYS 61 HD3 LYS 61 -3.052 10.052 5.856
479 HE2 LYS 61 HE2 LYS 61 -2.477 11.698 4.136
480 HE3 LYS 61 HE3 LYS 61 -4.089 11.546 3.411
481 HZ1 LYS 61 HZ1 LYS 61 -3.925 13.467 4.801
482 HZ2 LYS 61 HZ2 LYS 61 -5.019 12.407 5.425
483 HZ3 LYS 61 HZ3 LYS 61 -3.527 12.552 6.113
484 H ALA 62 H ALA 62 -1.311 5.508 4.983
485 HA ALA 62 HA ALA 62 -3.000 3.240 5.686
486 HB1 ALA 62 HB1 ALA 62 -2.191 2.565 3.468
487 HB2 ALA 62 HB2 ALA 62 -0.515 2.887 3.966
488 HB3 ALA 62 HB3 ALA 62 -1.437 1.569 4.734
489 H GLU 63 H GLU 63 -2.651 3.007 7.787
490 HA GLU 63 HA GLU 63 -0.258 3.925 9.111
491 HB2 GLU 63 HB2 GLU 63 -2.562 2.164 10.053
492 HB3 GLU 63 HB3 GLU 63 -1.326 2.889 11.098
493 HG2 GLU 63 HG2 GLU 63 -2.057 5.146 10.410
494 HG3 GLU 63 HG3 GLU 63 -3.297 4.428 9.361
495 H VAL 64 H VAL 64 1.675 2.826 8.902
496 HA VAL 64 HA VAL 64 1.929 0.051 8.345
497 HB VAL 64 HB VAL 64 4.250 0.391 9.188
498 HG11 VAL 64 HG11 VAL 64 3.660 1.016 6.882
499 HG12 VAL 64 HG12 VAL 64 3.175 2.637 7.433
500 HG13 VAL 64 HG13 VAL 64 4.876 2.132 7.546
501 HG21 VAL 64 HG21 VAL 64 3.246 3.182 9.896
502 HG22 VAL 64 HG22 VAL 64 3.768 1.935 11.054
503 HG23 VAL 64 HG23 VAL 64 4.941 2.646 9.928
504 H LEU 65 H LEU 65 1.905 -1.746 9.700
505 HA LEU 65 HA LEU 65 0.931 -1.214 12.438
506 HB2 LEU 65 HB2 LEU 65 1.148 -3.796 10.848
507 HB3 LEU 65 HB3 LEU 65 0.408 -3.627 12.448
508 HG LEU 65 HG LEU 65 -0.530 -2.216 9.915
509 HD11 LEU 65 HD11 LEU 65 -1.705 -4.503 11.550
510 HD12 LEU 65 HD12 LEU 65 -2.495 -3.704 10.171
511 HD13 LEU 65 HD13 LEU 65 -0.996 -4.631 9.922
512 HD21 LEU 65 HD21 LEU 65 -0.959 -0.857 11.927
513 HD22 LEU 65 HD22 LEU 65 -2.470 -1.554 11.313
514 HD23 LEU 65 HD23 LEU 65 -1.678 -2.269 12.739
515 H ALA 66 H ALA 66 3.755 -0.663 11.835
516 HA ALA 66 HA ALA 66 4.876 -2.346 13.963
517 HB1 ALA 66 HB1 ALA 66 5.491 -3.544 11.870
518 HB2 ALA 66 HB2 ALA 66 6.251 -2.051 11.261
519 HB3 ALA 66 HB3 ALA 66 6.909 -2.861 12.698
Start of MODEL 17
1 H1 MET 1 H MET 1 10.582 -3.772 9.708
2 HA MET 1 HA MET 1 9.765 -3.232 7.477
3 HB2 MET 1 HB2 MET 1 9.851 -5.630 8.378
4 HB3 MET 1 HB3 MET 1 8.089 -5.509 8.570
5 HG2 MET 1 HG2 MET 1 7.874 -4.993 6.163
6 HG3 MET 1 HG3 MET 1 9.636 -5.023 5.996
7 HE1 MET 1 HE1 MET 1 9.713 -6.463 4.137
8 HE2 MET 1 HE2 MET 1 9.215 -8.177 4.033
9 HE3 MET 1 HE3 MET 1 8.004 -6.876 3.935
10 H LEU 2 H LEU 2 7.800 -2.960 6.087
11 HA LEU 2 HA LEU 2 5.871 -1.264 7.536
12 HB2 LEU 2 HB2 LEU 2 6.383 -1.742 4.575
13 HB3 LEU 2 HB3 LEU 2 5.307 -0.495 5.249
14 HG LEU 2 HG LEU 2 8.279 -0.715 5.916
15 HD11 LEU 2 HD11 LEU 2 6.901 1.133 3.941
16 HD12 LEU 2 HD12 LEU 2 8.618 1.179 4.400
17 HD13 LEU 2 HD13 LEU 2 7.978 -0.222 3.517
18 HD21 LEU 2 HD21 LEU 2 6.868 0.473 7.582
19 HD22 LEU 2 HD22 LEU 2 7.966 1.587 6.741
20 HD23 LEU 2 HD23 LEU 2 6.247 1.526 6.289
21 H LYS 3 H LYS 3 3.588 -1.447 7.213
22 HA LYS 3 HA LYS 3 2.478 -3.977 6.212
23 HB2 LYS 3 HB2 LYS 3 3.308 -3.552 8.972
24 HB3 LYS 3 HB3 LYS 3 1.541 -3.712 8.892
25 HG2 LYS 3 HG2 LYS 3 1.681 -5.852 7.812
26 HG3 LYS 3 HG3 LYS 3 3.421 -5.641 7.503
27 HD2 LYS 3 HD2 LYS 3 3.809 -5.572 9.976
28 HD3 LYS 3 HD3 LYS 3 2.096 -5.991 10.221
29 HE2 LYS 3 HE2 LYS 3 2.403 -8.071 8.975
30 HE3 LYS 3 HE3 LYS 3 4.078 -7.639 8.582
31 HZ1 LYS 3 HZ1 LYS 3 3.129 -7.923 11.340
32 HZ2 LYS 3 HZ2 LYS 3 3.767 -9.186 10.476
33 HZ3 LYS 3 HZ3 LYS 3 4.676 -7.853 10.806
34 H LEU 4 H LEU 4 1.378 -2.382 4.808
35 HA LEU 4 HA LEU 4 0.403 0.049 6.084
36 HB2 LEU 4 HB2 LEU 4 0.781 -1.031 3.315
37 HB3 LEU 4 HB3 LEU 4 -0.443 0.231 3.543
38 HG LEU 4 HG LEU 4 1.227 1.676 4.663
39 HD11 LEU 4 HD11 LEU 4 3.165 -0.547 3.906
40 HD12 LEU 4 HD12 LEU 4 3.623 1.061 4.523
41 HD13 LEU 4 HD13 LEU 4 2.715 -0.059 5.558
42 HD21 LEU 4 HD21 LEU 4 0.844 1.838 2.219
43 HD22 LEU 4 HD22 LEU 4 2.536 2.196 2.632
44 HD23 LEU 4 HD23 LEU 4 2.104 0.614 1.941
45 H LYS 5 H LYS 5 -1.369 -0.083 7.269
46 HA LYS 5 HA LYS 5 -3.759 -1.569 6.446
47 HB2 LYS 5 HB2 LYS 5 -3.128 -1.246 8.848
48 HB3 LYS 5 HB3 LYS 5 -3.226 0.508 8.613
49 HG2 LYS 5 HG2 LYS 5 -5.653 0.120 7.858
50 HG3 LYS 5 HG3 LYS 5 -5.492 -1.515 8.543
51 HD2 LYS 5 HD2 LYS 5 -4.923 -0.556 10.733
52 HD3 LYS 5 HD3 LYS 5 -4.888 1.080 10.035
53 HE2 LYS 5 HE2 LYS 5 -7.286 0.858 9.433
54 HE3 LYS 5 HE3 LYS 5 -7.325 -0.733 10.219
55 HZ1 LYS 5 HZ1 LYS 5 -6.682 1.818 11.533
56 HZ2 LYS 5 HZ2 LYS 5 -8.109 0.998 11.657
57 HZ3 LYS 5 HZ3 LYS 5 -6.728 0.343 12.269
58 H VAL 6 H VAL 6 -4.100 -0.576 4.319
59 HA VAL 6 HA VAL 6 -4.111 2.257 3.951
60 HB VAL 6 HB VAL 6 -5.527 0.110 2.326
61 HG11 VAL 6 HG11 VAL 6 -4.423 2.859 1.603
62 HG12 VAL 6 HG12 VAL 6 -5.178 1.713 0.470
63 HG13 VAL 6 HG13 VAL 6 -6.145 2.444 1.771
64 HG21 VAL 6 HG21 VAL 6 -3.148 -0.474 2.652
65 HG22 VAL 6 HG22 VAL 6 -3.444 0.054 0.982
66 HG23 VAL 6 HG23 VAL 6 -2.672 1.163 2.138
67 H GLU 7 H GLU 7 -5.682 3.780 4.269
68 HA GLU 7 HA GLU 7 -8.232 2.870 5.431
69 HB2 GLU 7 HB2 GLU 7 -6.889 4.787 6.377
70 HB3 GLU 7 HB3 GLU 7 -7.215 5.687 4.881
71 HG2 GLU 7 HG2 GLU 7 -8.819 6.346 6.592
72 HG3 GLU 7 HG3 GLU 7 -9.671 5.444 5.326
73 H GLY 8 H GLY 8 -10.257 3.166 4.440
74 HA2 GLY 8 HA2 GLY 8 -10.158 3.612 1.516
75 HA3 GLY 8 HA3 GLY 8 -11.424 2.771 2.424
76 H MET 9 H MET 9 -9.918 6.095 2.338
77 HA MET 9 HA MET 9 -12.331 7.316 3.310
78 HB2 MET 9 HB2 MET 9 -9.857 8.407 1.934
79 HB3 MET 9 HB3 MET 9 -11.199 9.432 2.491
80 HG2 MET 9 HG2 MET 9 -10.941 8.511 4.774
81 HG3 MET 9 HG3 MET 9 -9.553 7.559 4.227
82 HE1 MET 9 HE1 MET 9 -8.051 10.358 6.567
83 HE2 MET 9 HE2 MET 9 -9.680 9.658 6.717
84 HE3 MET 9 HE3 MET 9 -8.297 8.612 6.323
85 H THR 10 H THR 10 -10.815 7.918 0.060
86 HA THR 10 HA THR 10 -13.488 8.598 -0.940
87 HB THR 10 HB THR 10 -12.209 9.226 -2.996
88 HG1 THR 10 HG1 THR 10 -9.987 9.095 -2.927
89 HG21 THR 10 HG21 THR 10 -12.594 10.885 -1.226
90 HG22 THR 10 HG22 THR 10 -11.130 10.342 -0.373
91 HG23 THR 10 HG23 THR 10 -10.995 11.125 -1.965
92 H CYS 11 H CYS 11 -14.130 7.826 -3.118
93 HA CYS 11 HA CYS 11 -14.934 6.118 -4.368
94 HB2 CYS 11 HB2 CYS 11 -12.005 5.311 -4.314
95 HB3 CYS 11 HB3 CYS 11 -13.208 4.827 -5.532
96 HG CYS 11 HG CYS 11 -13.824 7.221 -6.306
97 H ASN 12 H ASN 12 -15.035 5.685 -1.471
98 HA ASN 12 HA ASN 12 -14.343 2.992 -0.842
99 HB2 ASN 12 HB2 ASN 12 -15.756 3.378 1.131
100 HB3 ASN 12 HB3 ASN 12 -14.685 4.761 0.831
101 HD21 ASN 12 HD21 ASN 12 -18.624 5.388 1.142
102 HD22 ASN 12 HD22 ASN 12 -17.793 3.938 1.667
103 H HIS 13 H HIS 13 -16.598 4.034 -3.100
104 HA HIS 13 HA HIS 13 -18.856 2.401 -2.364
105 HB2 HIS 13 HB2 HIS 13 -17.958 3.533 -5.040
106 HB3 HIS 13 HB3 HIS 13 -19.521 2.767 -4.737
107 HD1 HIS 13 HD1 HIS 13 -21.194 4.739 -4.817
108 HD2 HIS 13 HD2 HIS 13 -17.701 5.515 -2.594
109 HE1 HIS 13 HE1 HIS 13 -21.483 7.050 -3.765
110 H CYS 14 H CYS 14 -15.901 1.882 -4.327
111 HA CYS 14 HA CYS 14 -16.606 -0.998 -4.400
112 HB2 CYS 14 HB2 CYS 14 -15.505 0.606 -6.738
113 HB3 CYS 14 HB3 CYS 14 -15.783 -1.151 -6.709
114 HG CYS 14 HG CYS 14 -17.658 -0.047 -8.102
115 H VAL 15 H VAL 15 -14.544 -2.238 -5.238
116 HA VAL 15 HA VAL 15 -12.328 -1.418 -3.481
117 HB VAL 15 HB VAL 15 -13.288 -3.689 -3.361
118 HG11 VAL 15 HG11 VAL 15 -12.247 -3.995 -6.209
119 HG12 VAL 15 HG12 VAL 15 -12.933 -5.289 -5.200
120 HG13 VAL 15 HG13 VAL 15 -13.960 -3.940 -5.729
121 HG21 VAL 15 HG21 VAL 15 -10.484 -3.775 -4.531
122 HG22 VAL 15 HG22 VAL 15 -10.860 -3.253 -2.866
123 HG23 VAL 15 HG23 VAL 15 -11.219 -4.914 -3.388
124 H MET 16 H MET 16 -10.103 -1.426 -4.258
125 HA MET 16 HA MET 16 -9.788 -1.193 -7.203
126 HB2 MET 16 HB2 MET 16 -8.797 0.776 -5.100
127 HB3 MET 16 HB3 MET 16 -8.223 0.724 -6.777
128 HG2 MET 16 HG2 MET 16 -10.570 1.051 -7.552
129 HG3 MET 16 HG3 MET 16 -11.065 1.259 -5.864
130 HE1 MET 16 HE1 MET 16 -11.326 4.857 -7.444
131 HE2 MET 16 HE2 MET 16 -11.607 3.308 -8.276
132 HE3 MET 16 HE3 MET 16 -12.190 3.541 -6.613
133 H ALA 17 H ALA 17 -7.537 -1.432 -7.884
134 HA ALA 17 HA ALA 17 -6.088 -3.337 -6.160
135 HB1 ALA 17 HB1 ALA 17 -6.444 -3.894 -8.540
136 HB2 ALA 17 HB2 ALA 17 -5.602 -2.403 -9.021
137 HB3 ALA 17 HB3 ALA 17 -4.713 -3.695 -8.181
138 H VAL 18 H VAL 18 -5.236 -2.005 -4.528
139 HA VAL 18 HA VAL 18 -3.971 0.492 -5.023
140 HB VAL 18 HB VAL 18 -3.472 -1.442 -2.739
141 HG11 VAL 18 HG11 VAL 18 -2.280 0.981 -3.204
142 HG12 VAL 18 HG12 VAL 18 -3.705 1.490 -2.307
143 HG13 VAL 18 HG13 VAL 18 -2.591 0.319 -1.569
144 HG21 VAL 18 HG21 VAL 18 -5.725 0.581 -3.062
145 HG22 VAL 18 HG22 VAL 18 -5.902 -1.190 -3.040
146 HG23 VAL 18 HG23 VAL 18 -5.362 -0.334 -1.581
147 H THR 19 H THR 19 -2.984 -2.727 -5.688
148 HA THR 19 HA THR 19 -0.302 -2.844 -5.157
149 HB THR 19 HB THR 19 -1.692 -3.752 -7.704
150 HG1 THR 19 HG1 THR 19 -2.002 -5.661 -6.452
151 HG21 THR 19 HG21 THR 19 0.714 -4.901 -6.231
152 HG22 THR 19 HG22 THR 19 0.005 -5.505 -7.743
153 HG23 THR 19 HG23 THR 19 0.806 -3.920 -7.719
154 H LYS 20 H LYS 20 -1.863 -1.090 -7.878
155 HA LYS 20 HA LYS 20 0.515 -0.605 -9.334
156 HB2 LYS 20 HB2 LYS 20 -2.044 1.035 -9.160
157 HB3 LYS 20 HB3 LYS 20 -0.809 1.170 -10.430
158 HG2 LYS 20 HG2 LYS 20 -1.187 -1.209 -11.039
159 HG3 LYS 20 HG3 LYS 20 -2.455 -1.316 -9.795
160 HD2 LYS 20 HD2 LYS 20 -3.722 0.484 -10.938
161 HD3 LYS 20 HD3 LYS 20 -2.453 0.581 -12.182
162 HE2 LYS 20 HE2 LYS 20 -2.855 -1.805 -12.752
163 HE3 LYS 20 HE3 LYS 20 -4.152 -1.866 -11.541
164 HZ1 LYS 20 HZ1 LYS 20 -5.004 -1.485 -13.730
165 HZ2 LYS 20 HZ2 LYS 20 -5.298 -0.172 -12.779
166 HZ3 LYS 20 HZ3 LYS 20 -4.093 -0.121 -13.904
167 H ALA 21 H ALA 21 -0.686 0.906 -6.384
168 HA ALA 21 HA ALA 21 0.896 3.330 -6.792
169 HB1 ALA 21 HB1 ALA 21 -0.540 2.233 -4.340
170 HB2 ALA 21 HB2 ALA 21 0.121 3.874 -4.520
171 HB3 ALA 21 HB3 ALA 21 -1.237 3.345 -5.541
172 H LEU 22 H LEU 22 1.314 0.134 -5.343
173 HA LEU 22 HA LEU 22 3.554 0.984 -3.680
174 HB2 LEU 22 HB2 LEU 22 2.340 -1.709 -4.432
175 HB3 LEU 22 HB3 LEU 22 3.807 -1.554 -3.459
176 HG LEU 22 HG LEU 22 2.025 -1.835 -1.934
177 HD11 LEU 22 HD11 LEU 22 3.735 -0.033 -1.435
178 HD12 LEU 22 HD12 LEU 22 2.533 1.160 -1.967
179 HD13 LEU 22 HD13 LEU 22 2.190 0.128 -0.562
180 HD21 LEU 22 HD21 LEU 22 0.593 0.503 -3.250
181 HD22 LEU 22 HD22 LEU 22 0.161 -1.216 -3.438
182 HD23 LEU 22 HD23 LEU 22 0.034 -0.431 -1.848
183 H LYS 23 H LYS 23 3.092 -0.463 -6.901
184 HA LYS 23 HA LYS 23 5.712 -1.477 -7.193
185 HB2 LYS 23 HB2 LYS 23 3.639 -1.984 -8.562
186 HB3 LYS 23 HB3 LYS 23 3.922 -0.455 -9.426
187 HG2 LYS 23 HG2 LYS 23 6.165 -1.254 -10.100
188 HG3 LYS 23 HG3 LYS 23 5.925 -2.742 -9.158
189 HD2 LYS 23 HD2 LYS 23 3.976 -3.318 -10.581
190 HD3 LYS 23 HD3 LYS 23 4.265 -1.855 -11.554
191 HE2 LYS 23 HE2 LYS 23 6.523 -2.681 -12.130
192 HE3 LYS 23 HE3 LYS 23 6.257 -4.125 -11.131
193 HZ1 LYS 23 HZ1 LYS 23 4.711 -3.377 -13.515
194 HZ2 LYS 23 HZ2 LYS 23 5.843 -4.572 -13.428
195 HZ3 LYS 23 HZ3 LYS 23 4.442 -4.708 -12.573
196 H LYS 24 H LYS 24 4.529 1.834 -7.418
197 HA LYS 24 HA LYS 24 6.682 2.738 -9.133
198 HB2 LYS 24 HB2 LYS 24 4.801 4.258 -7.282
199 HB3 LYS 24 HB3 LYS 24 5.853 4.985 -8.515
200 HG2 LYS 24 HG2 LYS 24 4.676 3.668 -10.271
201 HG3 LYS 24 HG3 LYS 24 3.588 3.010 -9.024
202 HD2 LYS 24 HD2 LYS 24 2.871 5.318 -8.448
203 HD3 LYS 24 HD3 LYS 24 3.945 5.958 -9.711
204 HE2 LYS 24 HE2 LYS 24 2.698 4.627 -11.409
205 HE3 LYS 24 HE3 LYS 24 1.594 4.071 -10.134
206 HZ1 LYS 24 HZ1 LYS 24 1.005 6.362 -9.751
207 HZ2 LYS 24 HZ2 LYS 24 2.013 6.862 -10.955
208 HZ3 LYS 24 HZ3 LYS 24 0.697 5.932 -11.310
209 H VAL 25 H VAL 25 6.556 1.866 -5.799
210 HA VAL 25 HA VAL 25 8.386 3.896 -4.850
211 HB VAL 25 HB VAL 25 7.342 1.275 -3.727
212 HG11 VAL 25 HG11 VAL 25 8.266 2.026 -1.561
213 HG12 VAL 25 HG12 VAL 25 9.554 1.743 -2.753
214 HG13 VAL 25 HG13 VAL 25 9.045 3.404 -2.372
215 HG21 VAL 25 HG21 VAL 25 6.028 2.815 -2.297
216 HG22 VAL 25 HG22 VAL 25 6.776 4.205 -3.115
217 HG23 VAL 25 HG23 VAL 25 5.706 3.108 -4.019
218 HA PRO 26 HA PRO 26 12.120 2.047 -6.409
219 HB2 PRO 26 HB2 PRO 26 13.241 3.465 -3.999
220 HB3 PRO 26 HB3 PRO 26 13.848 3.483 -5.688
221 HG2 PRO 26 HG2 PRO 26 12.464 5.598 -4.710
222 HG3 PRO 26 HG3 PRO 26 12.124 4.985 -6.363
223 HD2 PRO 26 HD2 PRO 26 10.577 4.475 -3.817
224 HD3 PRO 26 HD3 PRO 26 9.965 4.838 -5.463
225 H GLY 27 H GLY 27 13.119 0.094 -5.955
226 HA2 GLY 27 HA2 GLY 27 14.200 -1.470 -4.602
227 HA3 GLY 27 HA3 GLY 27 13.518 -0.705 -3.156
228 H VAL 28 H VAL 28 10.758 -0.761 -4.642
229 HA VAL 28 HA VAL 28 9.983 -3.347 -3.539
230 HB VAL 28 HB VAL 28 8.490 -1.152 -5.027
231 HG11 VAL 28 HG11 VAL 28 7.411 -3.313 -5.474
232 HG12 VAL 28 HG12 VAL 28 7.416 -3.690 -3.734
233 HG13 VAL 28 HG13 VAL 28 6.430 -2.344 -4.354
234 HG21 VAL 28 HG21 VAL 28 8.494 -2.073 -2.120
235 HG22 VAL 28 HG22 VAL 28 9.249 -0.587 -2.744
236 HG23 VAL 28 HG23 VAL 28 7.480 -0.775 -2.793
237 H GLU 29 H GLU 29 9.885 -5.242 -4.643
238 HA GLU 29 HA GLU 29 9.807 -5.071 -7.618
239 HB2 GLU 29 HB2 GLU 29 12.036 -5.723 -6.756
240 HB3 GLU 29 HB3 GLU 29 11.293 -7.104 -5.917
241 HG2 GLU 29 HG2 GLU 29 10.498 -8.009 -8.057
242 HG3 GLU 29 HG3 GLU 29 11.142 -6.596 -8.918
243 H LYS 30 H LYS 30 8.639 -6.563 -4.644
244 HA LYS 30 HA LYS 30 6.541 -7.895 -6.276
245 HB2 LYS 30 HB2 LYS 30 7.965 -9.052 -3.848
246 HB3 LYS 30 HB3 LYS 30 6.550 -9.764 -4.650
247 HG2 LYS 30 HG2 LYS 30 7.849 -9.956 -6.756
248 HG3 LYS 30 HG3 LYS 30 9.271 -9.271 -5.934
249 HD2 LYS 30 HD2 LYS 30 9.221 -11.145 -4.305
250 HD3 LYS 30 HD3 LYS 30 7.816 -11.834 -5.151
251 HE2 LYS 30 HE2 LYS 30 9.161 -12.019 -7.223
252 HE3 LYS 30 HE3 LYS 30 10.564 -11.340 -6.373
253 HZ1 LYS 30 HZ1 LYS 30 9.193 -13.850 -5.691
254 HZ2 LYS 30 HZ2 LYS 30 10.647 -13.716 -6.454
255 HZ3 LYS 30 HZ3 LYS 30 10.494 -13.215 -4.895
256 H VAL 31 H VAL 31 4.476 -8.036 -5.209
257 HA VAL 31 HA VAL 31 4.193 -6.464 -2.720
258 HB VAL 31 HB VAL 31 2.731 -5.954 -5.333
259 HG11 VAL 31 HG11 VAL 31 1.203 -5.804 -3.390
260 HG12 VAL 31 HG12 VAL 31 2.308 -4.649 -2.617
261 HG13 VAL 31 HG13 VAL 31 1.487 -4.210 -4.133
262 HG21 VAL 31 HG21 VAL 31 4.312 -3.950 -3.702
263 HG22 VAL 31 HG22 VAL 31 5.066 -4.930 -4.996
264 HG23 VAL 31 HG23 VAL 31 3.739 -3.812 -5.364
265 H GLU 32 H GLU 32 2.347 -7.066 -1.503
266 HA GLU 32 HA GLU 32 0.607 -9.168 -2.634
267 HB2 GLU 32 HB2 GLU 32 2.527 -10.306 -1.533
268 HB3 GLU 32 HB3 GLU 32 2.143 -9.448 -0.024
269 HG2 GLU 32 HG2 GLU 32 -0.128 -10.477 -0.046
270 HG3 GLU 32 HG3 GLU 32 0.295 -11.342 -1.537
271 H VAL 33 H VAL 33 -1.032 -7.550 -2.626
272 HA VAL 33 HA VAL 33 -1.755 -6.454 0.034
273 HB VAL 33 HB VAL 33 -3.304 -5.033 -1.233
274 HG11 VAL 33 HG11 VAL 33 -0.544 -5.097 -2.521
275 HG12 VAL 33 HG12 VAL 33 -1.659 -3.714 -2.488
276 HG13 VAL 33 HG13 VAL 33 -0.939 -4.311 -0.977
277 HG21 VAL 33 HG21 VAL 33 -2.246 -6.493 -3.693
278 HG22 VAL 33 HG22 VAL 33 -3.892 -6.625 -3.029
279 HG23 VAL 33 HG23 VAL 33 -3.327 -5.081 -3.700
280 H SER 34 H SER 34 -3.945 -6.683 0.810
281 HA SER 34 HA SER 34 -5.475 -8.899 -0.445
282 HB2 SER 34 HB2 SER 34 -4.314 -9.760 1.565
283 HB3 SER 34 HB3 SER 34 -5.058 -8.466 2.536
284 HG SER 34 HG SER 34 -6.099 -10.819 1.717
285 H LEU 35 H LEU 35 -7.022 -7.718 -1.399
286 HA LEU 35 HA LEU 35 -7.874 -5.171 -0.491
287 HB2 LEU 35 HB2 LEU 35 -9.325 -7.128 -2.312
288 HB3 LEU 35 HB3 LEU 35 -9.525 -5.363 -2.264
289 HG LEU 35 HG LEU 35 -6.934 -6.828 -3.014
290 HD11 LEU 35 HD11 LEU 35 -8.363 -7.160 -4.839
291 HD12 LEU 35 HD12 LEU 35 -9.212 -5.601 -4.592
292 HD13 LEU 35 HD13 LEU 35 -7.560 -5.649 -5.253
293 HD21 LEU 35 HD21 LEU 35 -6.048 -4.813 -2.431
294 HD22 LEU 35 HD22 LEU 35 -6.785 -4.237 -3.922
295 HD23 LEU 35 HD23 LEU 35 -7.650 -4.007 -2.388
296 H GLU 36 H GLU 36 -8.787 -8.392 0.490
297 HA GLU 36 HA GLU 36 -11.410 -7.582 1.496
298 HB2 GLU 36 HB2 GLU 36 -9.748 -10.109 1.848
299 HB3 GLU 36 HB3 GLU 36 -11.422 -9.893 2.412
300 HG2 GLU 36 HG2 GLU 36 -12.134 -9.423 0.076
301 HG3 GLU 36 HG3 GLU 36 -10.472 -9.704 -0.476
302 H LYS 37 H LYS 37 -8.079 -7.776 2.643
303 HA LYS 37 HA LYS 37 -8.978 -7.543 5.454
304 HB2 LYS 37 HB2 LYS 37 -6.224 -7.934 4.221
305 HB3 LYS 37 HB3 LYS 37 -6.584 -7.933 5.961
306 HG2 LYS 37 HG2 LYS 37 -8.049 -9.884 5.695
307 HG3 LYS 37 HG3 LYS 37 -7.810 -9.855 3.934
308 HD2 LYS 37 HD2 LYS 37 -5.381 -10.231 4.257
309 HD3 LYS 37 HD3 LYS 37 -5.633 -10.306 6.016
310 HE2 LYS 37 HE2 LYS 37 -7.137 -12.234 5.733
311 HE3 LYS 37 HE3 LYS 37 -6.958 -12.136 3.970
312 HZ1 LYS 37 HZ1 LYS 37 -5.536 -13.796 4.938
313 HZ2 LYS 37 HZ2 LYS 37 -4.641 -12.611 4.226
314 HZ3 LYS 37 HZ3 LYS 37 -4.780 -12.666 5.869
315 H GLY 38 H GLY 38 -8.049 -5.534 2.821
316 HA2 GLY 38 HA2 GLY 38 -7.745 -3.262 2.730
317 HA3 GLY 38 HA3 GLY 38 -8.150 -3.171 4.455
318 H GLU 39 H GLU 39 -5.591 -5.356 3.514
319 HA GLU 39 HA GLU 39 -3.589 -3.483 4.701
320 HB2 GLU 39 HB2 GLU 39 -3.659 -6.524 4.521
321 HB3 GLU 39 HB3 GLU 39 -2.336 -5.562 5.216
322 HG2 GLU 39 HG2 GLU 39 -3.886 -4.604 6.879
323 HG3 GLU 39 HG3 GLU 39 -5.219 -5.555 6.195
324 H ALA 40 H ALA 40 -1.475 -3.443 3.772
325 HA ALA 40 HA ALA 40 -1.236 -4.550 1.039
326 HB1 ALA 40 HB1 ALA 40 -2.073 -2.253 0.784
327 HB2 ALA 40 HB2 ALA 40 -0.770 -1.647 1.832
328 HB3 ALA 40 HB3 ALA 40 -0.379 -2.359 0.250
329 H LEU 41 H LEU 41 0.466 -5.862 1.204
330 HA LEU 41 HA LEU 41 2.776 -4.953 2.852
331 HB2 LEU 41 HB2 LEU 41 1.990 -7.750 1.923
332 HB3 LEU 41 HB3 LEU 41 3.410 -7.334 2.880
333 HG LEU 41 HG LEU 41 1.857 -8.215 4.414
334 HD11 LEU 41 HD11 LEU 41 1.766 -5.174 4.501
335 HD12 LEU 41 HD12 LEU 41 1.154 -6.220 5.810
336 HD13 LEU 41 HD13 LEU 41 2.874 -6.256 5.356
337 HD21 LEU 41 HD21 LEU 41 -0.456 -7.573 4.602
338 HD22 LEU 41 HD22 LEU 41 -0.274 -6.324 3.357
339 HD23 LEU 41 HD23 LEU 41 -0.127 -8.045 2.920
340 H VAL 42 H VAL 42 4.885 -5.192 1.957
341 HA VAL 42 HA VAL 42 4.977 -5.796 -0.939
342 HB VAL 42 HB VAL 42 6.497 -3.911 -1.302
343 HG11 VAL 42 HG11 VAL 42 4.828 -2.238 -1.437
344 HG12 VAL 42 HG12 VAL 42 3.951 -3.770 -1.525
345 HG13 VAL 42 HG13 VAL 42 3.965 -2.859 0.002
346 HG21 VAL 42 HG21 VAL 42 5.794 -3.098 1.550
347 HG22 VAL 42 HG22 VAL 42 7.382 -3.685 1.001
348 HG23 VAL 42 HG23 VAL 42 6.748 -2.143 0.393
349 H GLU 43 H GLU 43 7.276 -6.215 -1.639
350 HA GLU 43 HA GLU 43 8.965 -7.169 0.608
351 HB2 GLU 43 HB2 GLU 43 7.597 -9.014 -0.411
352 HB3 GLU 43 HB3 GLU 43 8.424 -8.710 -1.952
353 HG2 GLU 43 HG2 GLU 43 10.604 -9.185 -0.844
354 HG3 GLU 43 HG3 GLU 43 9.754 -9.439 0.694
355 H GLY 44 H GLY 44 10.170 -5.264 0.330
356 HA2 GLY 44 HA2 GLY 44 12.098 -5.335 -1.861
357 HA3 GLY 44 HA3 GLY 44 11.002 -3.935 -1.857
358 H THR 45 H THR 45 13.275 -2.965 -1.632
359 HA THR 45 HA THR 45 14.127 -2.853 1.219
360 HB THR 45 HB THR 45 16.307 -2.069 0.193
361 HG1 THR 45 HG1 THR 45 16.451 -2.495 -2.077
362 HG21 THR 45 HG21 THR 45 16.624 -4.427 -1.044
363 HG22 THR 45 HG22 THR 45 16.438 -4.331 0.737
364 HG23 THR 45 HG23 THR 45 15.063 -4.765 -0.301
365 H ALA 46 H ALA 46 11.869 -1.316 0.007
366 HA ALA 46 HA ALA 46 12.803 1.359 -0.520
367 HB1 ALA 46 HB1 ALA 46 10.403 1.904 -0.454
368 HB2 ALA 46 HB2 ALA 46 10.679 0.421 -1.399
369 HB3 ALA 46 HB3 ALA 46 10.047 0.314 0.260
370 H ASP 47 H ASP 47 11.817 3.234 0.814
371 HA ASP 47 HA ASP 47 12.388 2.749 3.688
372 HB2 ASP 47 HB2 ASP 47 12.408 5.212 1.911
373 HB3 ASP 47 HB3 ASP 47 12.449 5.314 3.679
374 HA PRO 48 HA PRO 48 8.269 3.259 4.976
375 HB2 PRO 48 HB2 PRO 48 9.285 5.413 6.822
376 HB3 PRO 48 HB3 PRO 48 8.256 3.996 7.216
377 HG2 PRO 48 HG2 PRO 48 10.892 3.971 7.823
378 HG3 PRO 48 HG3 PRO 48 10.133 2.518 7.085
379 HD2 PRO 48 HD2 PRO 48 11.787 4.661 5.739
380 HD3 PRO 48 HD3 PRO 48 11.851 2.882 5.530
381 H LYS 49 H LYS 49 10.038 6.381 4.527
382 HA LYS 49 HA LYS 49 7.622 7.928 4.284
383 HB2 LYS 49 HB2 LYS 49 9.321 9.530 3.072
384 HB3 LYS 49 HB3 LYS 49 9.476 9.239 4.813
385 HG2 LYS 49 HG2 LYS 49 11.272 7.659 4.495
386 HG3 LYS 49 HG3 LYS 49 11.026 7.667 2.730
387 HD2 LYS 49 HD2 LYS 49 11.567 10.093 2.683
388 HD3 LYS 49 HD3 LYS 49 11.917 10.037 4.426
389 HE2 LYS 49 HE2 LYS 49 13.712 8.417 4.044
390 HE3 LYS 49 HE3 LYS 49 13.298 8.320 2.320
391 HZ1 LYS 49 HZ1 LYS 49 14.254 10.733 3.698
392 HZ2 LYS 49 HZ2 LYS 49 15.155 9.766 2.714
393 HZ3 LYS 49 HZ3 LYS 49 13.885 10.614 2.097
394 H ALA 50 H ALA 50 9.274 5.762 2.109
395 HA ALA 50 HA ALA 50 8.238 7.173 -0.264
396 HB1 ALA 50 HB1 ALA 50 10.505 6.159 -0.275
397 HB2 ALA 50 HB2 ALA 50 9.782 4.561 0.022
398 HB3 ALA 50 HB3 ALA 50 9.442 5.424 -1.497
399 H LEU 51 H LEU 51 7.693 4.179 1.642
400 HA LEU 51 HA LEU 51 5.804 3.139 -0.262
401 HB2 LEU 51 HB2 LEU 51 7.255 1.921 1.544
402 HB3 LEU 51 HB3 LEU 51 5.932 2.362 2.649
403 HG LEU 51 HG LEU 51 4.349 1.299 0.908
404 HD11 LEU 51 HD11 LEU 51 5.480 -0.434 -0.530
405 HD12 LEU 51 HD12 LEU 51 5.913 1.227 -0.990
406 HD13 LEU 51 HD13 LEU 51 7.050 0.236 -0.047
407 HD21 LEU 51 HD21 LEU 51 5.075 0.229 3.073
408 HD22 LEU 51 HD22 LEU 51 4.698 -0.935 1.779
409 HD23 LEU 51 HD23 LEU 51 6.390 -0.564 2.180
410 H VAL 52 H VAL 52 5.468 4.692 2.990
411 HA VAL 52 HA VAL 52 2.613 4.521 2.979
412 HB VAL 52 HB VAL 52 4.496 6.342 4.533
413 HG11 VAL 52 HG11 VAL 52 2.158 7.127 4.611
414 HG12 VAL 52 HG12 VAL 52 1.612 5.490 5.051
415 HG13 VAL 52 HG13 VAL 52 2.630 6.424 6.172
416 HG21 VAL 52 HG21 VAL 52 4.270 4.619 6.299
417 HG22 VAL 52 HG22 VAL 52 3.282 3.624 5.204
418 HG23 VAL 52 HG23 VAL 52 4.994 3.933 4.829
419 H GLN 53 H GLN 53 4.906 6.820 1.579
420 HA GLN 53 HA GLN 53 2.864 8.879 1.257
421 HB2 GLN 53 HB2 GLN 53 5.264 9.409 1.599
422 HB3 GLN 53 HB3 GLN 53 5.644 8.630 0.044
423 HG2 GLN 53 HG2 GLN 53 4.196 10.249 -1.126
424 HG3 GLN 53 HG3 GLN 53 3.743 10.982 0.426
425 HE21 GLN 53 HE21 GLN 53 7.697 11.443 -0.794
426 HE22 GLN 53 HE22 GLN 53 6.874 9.921 -1.049
427 H ALA 54 H ALA 54 4.218 6.168 -0.592
428 HA ALA 54 HA ALA 54 3.392 6.983 -3.173
429 HB1 ALA 54 HB1 ALA 54 3.529 4.587 -3.716
430 HB2 ALA 54 HB2 ALA 54 4.916 5.107 -2.737
431 HB3 ALA 54 HB3 ALA 54 3.591 4.187 -1.983
432 H VAL 55 H VAL 55 1.676 5.099 -0.611
433 HA VAL 55 HA VAL 55 -0.715 4.863 -2.239
434 HB VAL 55 HB VAL 55 -1.731 4.042 -0.117
435 HG11 VAL 55 HG11 VAL 55 -0.316 2.036 0.067
436 HG12 VAL 55 HG12 VAL 55 -0.496 2.528 -1.633
437 HG13 VAL 55 HG13 VAL 55 1.013 2.885 -0.758
438 HG21 VAL 55 HG21 VAL 55 -0.441 5.486 1.453
439 HG22 VAL 55 HG22 VAL 55 -0.311 3.765 1.872
440 HG23 VAL 55 HG23 VAL 55 1.036 4.581 1.048
441 H GLU 56 H GLU 56 0.644 7.266 -0.048
442 HA GLU 56 HA GLU 56 -1.857 8.628 0.431
443 HB2 GLU 56 HB2 GLU 56 0.160 8.824 1.884
444 HB3 GLU 56 HB3 GLU 56 1.013 9.648 0.561
445 HG2 GLU 56 HG2 GLU 56 -0.684 11.449 0.590
446 HG3 GLU 56 HG3 GLU 56 -1.557 10.612 1.888
447 H GLU 57 H GLU 57 0.437 8.438 -2.193
448 HA GLU 57 HA GLU 57 -0.160 10.948 -3.446
449 HB2 GLU 57 HB2 GLU 57 1.837 9.468 -3.855
450 HB3 GLU 57 HB3 GLU 57 0.768 8.352 -4.734
451 HG2 GLU 57 HG2 GLU 57 0.194 10.143 -6.319
452 HG3 GLU 57 HG3 GLU 57 1.193 11.292 -5.403
453 H GLU 58 H GLU 58 -1.783 7.861 -3.172
454 HA GLU 58 HA GLU 58 -3.668 8.501 -5.357
455 HB2 GLU 58 HB2 GLU 58 -3.402 6.133 -3.457
456 HB3 GLU 58 HB3 GLU 58 -4.647 6.280 -4.710
457 HG2 GLU 58 HG2 GLU 58 -1.640 6.262 -5.198
458 HG3 GLU 58 HG3 GLU 58 -2.743 4.901 -5.468
459 H GLY 59 H GLY 59 -3.182 9.277 -2.113
460 HA2 GLY 59 HA2 GLY 59 -4.635 10.708 -0.935
461 HA3 GLY 59 HA3 GLY 59 -6.011 10.092 -1.865
462 H TYR 60 H TYR 60 -3.976 7.522 -0.823
463 HA TYR 60 HA TYR 60 -5.818 7.016 1.467
464 HB2 TYR 60 HB2 TYR 60 -4.559 5.006 -0.424
465 HB3 TYR 60 HB3 TYR 60 -5.715 4.667 0.866
466 HD1 TYR 60 HD1 TYR 60 -5.383 5.013 -2.571
467 HD2 TYR 60 HD2 TYR 60 -7.967 6.200 0.654
468 HE1 TYR 60 HE1 TYR 60 -7.249 5.295 -4.180
469 HE2 TYR 60 HE2 TYR 60 -9.839 6.476 -0.944
470 HH TYR 60 HH TYR 60 -10.510 6.351 -3.121
471 H LYS 61 H LYS 61 -4.429 7.754 3.122
472 HA LYS 61 HA LYS 61 -1.687 6.904 3.334
473 HB2 LYS 61 HB2 LYS 61 -3.731 7.811 5.404
474 HB3 LYS 61 HB3 LYS 61 -2.020 7.502 5.765
475 HG2 LYS 61 HG2 LYS 61 -1.337 9.209 4.135
476 HG3 LYS 61 HG3 LYS 61 -3.042 9.528 3.729
477 HD2 LYS 61 HD2 LYS 61 -3.497 10.242 6.021
478 HD3 LYS 61 HD3 LYS 61 -1.845 9.807 6.520
479 HE2 LYS 61 HE2 LYS 61 -0.913 11.491 4.977
480 HE3 LYS 61 HE3 LYS 61 -2.549 11.878 4.412
481 HZ1 LYS 61 HZ1 LYS 61 -1.376 12.410 7.031
482 HZ2 LYS 61 HZ2 LYS 61 -2.049 13.461 5.969
483 HZ3 LYS 61 HZ3 LYS 61 -3.022 12.417 6.793
484 H ALA 62 H ALA 62 -0.985 5.457 5.228
485 HA ALA 62 HA ALA 62 -2.868 3.292 5.834
486 HB1 ALA 62 HB1 ALA 62 -1.994 2.656 3.631
487 HB2 ALA 62 HB2 ALA 62 -0.331 2.867 4.215
488 HB3 ALA 62 HB3 ALA 62 -1.357 1.574 4.891
489 H GLU 63 H GLU 63 -2.614 2.934 7.923
490 HA GLU 63 HA GLU 63 -0.313 3.816 9.409
491 HB2 GLU 63 HB2 GLU 63 -2.695 2.058 10.145
492 HB3 GLU 63 HB3 GLU 63 -1.531 2.725 11.307
493 HG2 GLU 63 HG2 GLU 63 -2.170 4.992 10.762
494 HG3 GLU 63 HG3 GLU 63 -3.145 4.444 9.388
495 H VAL 64 H VAL 64 1.625 2.768 9.271
496 HA VAL 64 HA VAL 64 1.979 0.042 8.578
497 HB VAL 64 HB VAL 64 4.262 0.376 9.506
498 HG11 VAL 64 HG11 VAL 64 3.693 1.075 7.211
499 HG12 VAL 64 HG12 VAL 64 3.175 2.666 7.817
500 HG13 VAL 64 HG13 VAL 64 4.881 2.184 7.936
501 HG21 VAL 64 HG21 VAL 64 3.170 3.111 10.298
502 HG22 VAL 64 HG22 VAL 64 3.761 1.852 11.411
503 HG23 VAL 64 HG23 VAL 64 4.886 2.650 10.297
504 H LEU 65 H LEU 65 1.266 -1.671 9.651
505 HA LEU 65 HA LEU 65 0.537 -1.451 12.480
506 HB2 LEU 65 HB2 LEU 65 0.417 -3.809 10.554
507 HB3 LEU 65 HB3 LEU 65 -0.297 -3.750 12.173
508 HG LEU 65 HG LEU 65 -1.048 -1.919 9.858
509 HD11 LEU 65 HD11 LEU 65 -2.500 -4.251 11.178
510 HD12 LEU 65 HD12 LEU 65 -3.164 -3.204 9.901
511 HD13 LEU 65 HD13 LEU 65 -1.775 -4.259 9.553
512 HD21 LEU 65 HD21 LEU 65 -1.336 -0.815 12.046
513 HD22 LEU 65 HD22 LEU 65 -2.913 -1.253 11.360
514 HD23 LEU 65 HD23 LEU 65 -2.208 -2.241 12.662
515 H ALA 66 H ALA 66 3.391 -1.150 11.927
516 HA ALA 66 HA ALA 66 4.361 -3.477 13.510
517 HB1 ALA 66 HB1 ALA 66 5.397 -2.415 10.872
518 HB2 ALA 66 HB2 ALA 66 6.496 -3.228 12.032
519 HB3 ALA 66 HB3 ALA 66 5.091 -4.085 11.352
Start of MODEL 18
1 H1 MET 1 H MET 1 8.135 -4.009 11.175
2 HA MET 1 HA MET 1 8.855 -4.104 8.305
3 HB2 MET 1 HB2 MET 1 8.499 -6.334 9.411
4 HB3 MET 1 HB3 MET 1 6.828 -5.837 9.758
5 HG2 MET 1 HG2 MET 1 6.437 -5.518 7.324
6 HG3 MET 1 HG3 MET 1 8.115 -5.974 7.007
7 HE1 MET 1 HE1 MET 1 5.028 -7.304 9.102
8 HE2 MET 1 HE2 MET 1 4.526 -7.026 7.417
9 HE3 MET 1 HE3 MET 1 4.571 -8.680 8.070
10 H LEU 2 H LEU 2 6.953 -3.764 6.832
11 HA LEU 2 HA LEU 2 5.185 -1.691 8.028
12 HB2 LEU 2 HB2 LEU 2 6.114 -2.065 5.158
13 HB3 LEU 2 HB3 LEU 2 5.129 -0.720 5.774
14 HG LEU 2 HG LEU 2 7.931 -1.424 6.760
15 HD11 LEU 2 HD11 LEU 2 7.040 0.836 4.931
16 HD12 LEU 2 HD12 LEU 2 8.686 0.545 5.538
17 HD13 LEU 2 HD13 LEU 2 7.940 -0.616 4.421
18 HD21 LEU 2 HD21 LEU 2 6.154 1.003 7.252
19 HD22 LEU 2 HD22 LEU 2 6.546 -0.259 8.445
20 HD23 LEU 2 HD23 LEU 2 7.825 0.806 7.828
21 H LYS 3 H LYS 3 2.964 -1.637 7.383
22 HA LYS 3 HA LYS 3 1.843 -3.889 5.899
23 HB2 LYS 3 HB2 LYS 3 2.288 -4.739 8.231
24 HB3 LYS 3 HB3 LYS 3 1.166 -3.508 8.847
25 HG2 LYS 3 HG2 LYS 3 -0.661 -4.472 7.538
26 HG3 LYS 3 HG3 LYS 3 0.461 -5.579 6.717
27 HD2 LYS 3 HD2 LYS 3 0.970 -6.683 8.871
28 HD3 LYS 3 HD3 LYS 3 -0.152 -5.579 9.703
29 HE2 LYS 3 HE2 LYS 3 -2.009 -6.400 8.311
30 HE3 LYS 3 HE3 LYS 3 -0.903 -7.484 7.445
31 HZ1 LYS 3 HZ1 LYS 3 -0.494 -8.614 9.502
32 HZ2 LYS 3 HZ2 LYS 3 -1.519 -7.601 10.313
33 HZ3 LYS 3 HZ3 LYS 3 -2.102 -8.617 9.155
34 H LEU 4 H LEU 4 1.150 -2.161 4.547
35 HA LEU 4 HA LEU 4 0.043 0.245 5.706
36 HB2 LEU 4 HB2 LEU 4 0.693 -0.873 3.003
37 HB3 LEU 4 HB3 LEU 4 -0.516 0.414 3.066
38 HG LEU 4 HG LEU 4 1.064 1.823 4.396
39 HD11 LEU 4 HD11 LEU 4 3.027 -0.416 3.749
40 HD12 LEU 4 HD12 LEU 4 3.440 1.151 4.489
41 HD13 LEU 4 HD13 LEU 4 2.414 -0.006 5.366
42 HD21 LEU 4 HD21 LEU 4 0.904 2.016 1.921
43 HD22 LEU 4 HD22 LEU 4 2.544 2.374 2.512
44 HD23 LEU 4 HD23 LEU 4 2.192 0.802 1.756
45 H LYS 5 H LYS 5 -1.884 0.021 6.752
46 HA LYS 5 HA LYS 5 -4.119 -1.382 5.453
47 HB2 LYS 5 HB2 LYS 5 -3.772 -1.471 7.912
48 HB3 LYS 5 HB3 LYS 5 -4.038 0.281 8.014
49 HG2 LYS 5 HG2 LYS 5 -6.111 -1.322 6.549
50 HG3 LYS 5 HG3 LYS 5 -6.006 -1.575 8.302
51 HD2 LYS 5 HD2 LYS 5 -6.239 0.837 8.710
52 HD3 LYS 5 HD3 LYS 5 -6.345 1.131 6.959
53 HE2 LYS 5 HE2 LYS 5 -8.346 -0.272 6.821
54 HE3 LYS 5 HE3 LYS 5 -8.284 -0.588 8.568
55 HZ1 LYS 5 HZ1 LYS 5 -9.715 1.315 7.571
56 HZ2 LYS 5 HZ2 LYS 5 -8.924 1.533 9.018
57 HZ3 LYS 5 HZ3 LYS 5 -8.317 2.156 7.618
58 H VAL 6 H VAL 6 -4.850 -0.308 3.681
59 HA VAL 6 HA VAL 6 -4.658 2.504 3.297
60 HB VAL 6 HB VAL 6 -6.479 0.471 1.947
61 HG11 VAL 6 HG11 VAL 6 -5.329 3.148 1.046
62 HG12 VAL 6 HG12 VAL 6 -6.266 2.035 0.021
63 HG13 VAL 6 HG13 VAL 6 -7.033 2.812 1.424
64 HG21 VAL 6 HG21 VAL 6 -4.121 -0.277 1.929
65 HG22 VAL 6 HG22 VAL 6 -4.646 0.238 0.314
66 HG23 VAL 6 HG23 VAL 6 -3.619 1.310 1.296
67 H GLU 7 H GLU 7 -6.064 4.159 3.680
68 HA GLU 7 HA GLU 7 -8.298 3.666 5.483
69 HB2 GLU 7 HB2 GLU 7 -6.797 5.652 5.647
70 HB3 GLU 7 HB3 GLU 7 -7.394 6.212 4.070
71 HG2 GLU 7 HG2 GLU 7 -8.564 7.319 5.956
72 HG3 GLU 7 HG3 GLU 7 -9.682 6.338 4.985
73 H GLY 8 H GLY 8 -10.514 3.977 4.991
74 HA2 GLY 8 HA2 GLY 8 -11.188 3.621 2.141
75 HA3 GLY 8 HA3 GLY 8 -12.259 3.366 3.535
76 H MET 9 H MET 9 -10.428 6.000 1.856
77 HA MET 9 HA MET 9 -11.985 8.094 3.029
78 HB2 MET 9 HB2 MET 9 -10.245 7.978 0.535
79 HB3 MET 9 HB3 MET 9 -10.927 9.471 1.219
80 HG2 MET 9 HG2 MET 9 -9.772 9.066 3.343
81 HG3 MET 9 HG3 MET 9 -9.142 7.532 2.728
82 HE1 MET 9 HE1 MET 9 -7.865 11.729 1.253
83 HE2 MET 9 HE2 MET 9 -9.475 11.049 0.926
84 HE3 MET 9 HE3 MET 9 -8.989 11.421 2.598
85 H THR 10 H THR 10 -12.095 6.602 -0.296
86 HA THR 10 HA THR 10 -14.924 7.491 -0.407
87 HB THR 10 HB THR 10 -14.558 8.223 -2.758
88 HG1 THR 10 HG1 THR 10 -12.415 8.528 -3.420
89 HG21 THR 10 HG21 THR 10 -14.551 9.869 -0.900
90 HG22 THR 10 HG22 THR 10 -12.792 9.654 -0.726
91 HG23 THR 10 HG23 THR 10 -13.459 10.353 -2.218
92 H CYS 11 H CYS 11 -16.125 6.442 -2.189
93 HA CYS 11 HA CYS 11 -16.919 4.520 -3.103
94 HB2 CYS 11 HB2 CYS 11 -14.062 4.421 -4.129
95 HB3 CYS 11 HB3 CYS 11 -15.464 3.590 -4.847
96 HG CYS 11 HG CYS 11 -16.886 5.726 -5.246
97 H ASN 12 H ASN 12 -16.562 3.908 -0.489
98 HA ASN 12 HA ASN 12 -14.717 1.771 -0.029
99 HB2 ASN 12 HB2 ASN 12 -16.005 1.389 2.008
100 HB3 ASN 12 HB3 ASN 12 -15.748 3.123 1.773
101 HD21 ASN 12 HD21 ASN 12 -19.487 1.683 2.178
102 HD22 ASN 12 HD22 ASN 12 -18.031 0.785 2.545
103 H HIS 13 H HIS 13 -17.565 1.876 -1.929
104 HA HIS 13 HA HIS 13 -18.157 -0.990 -1.511
105 HB2 HIS 13 HB2 HIS 13 -19.491 1.186 -3.151
106 HB3 HIS 13 HB3 HIS 13 -19.968 -0.519 -3.198
107 HD1 HIS 13 HD1 HIS 13 -21.405 -1.420 -1.193
108 HD2 HIS 13 HD2 HIS 13 -19.905 2.486 -0.735
109 HE1 HIS 13 HE1 HIS 13 -22.550 -0.430 0.871
110 H CYS 14 H CYS 14 -15.986 0.877 -3.297
111 HA CYS 14 HA CYS 14 -15.870 -1.233 -5.400
112 HB2 CYS 14 HB2 CYS 14 -15.194 1.725 -5.631
113 HB3 CYS 14 HB3 CYS 14 -14.975 0.506 -6.907
114 HG CYS 14 HG CYS 14 -17.049 1.953 -7.454
115 H VAL 15 H VAL 15 -14.003 -2.338 -5.469
116 HA VAL 15 HA VAL 15 -11.811 -1.429 -3.711
117 HB VAL 15 HB VAL 15 -12.718 -3.724 -3.498
118 HG11 VAL 15 HG11 VAL 15 -11.642 -4.102 -6.325
119 HG12 VAL 15 HG12 VAL 15 -12.297 -5.377 -5.275
120 HG13 VAL 15 HG13 VAL 15 -13.361 -4.080 -5.860
121 HG21 VAL 15 HG21 VAL 15 -10.581 -4.904 -3.540
122 HG22 VAL 15 HG22 VAL 15 -9.883 -3.667 -4.607
123 HG23 VAL 15 HG23 VAL 15 -10.350 -3.247 -2.940
124 H MET 16 H MET 16 -9.597 -1.380 -4.499
125 HA MET 16 HA MET 16 -9.312 -1.292 -7.451
126 HB2 MET 16 HB2 MET 16 -8.333 0.844 -5.502
127 HB3 MET 16 HB3 MET 16 -7.942 0.744 -7.228
128 HG2 MET 16 HG2 MET 16 -9.672 2.238 -7.283
129 HG3 MET 16 HG3 MET 16 -10.544 0.728 -7.563
130 HE1 MET 16 HE1 MET 16 -13.173 2.080 -6.385
131 HE2 MET 16 HE2 MET 16 -12.525 3.534 -5.610
132 HE3 MET 16 HE3 MET 16 -11.891 3.031 -7.194
133 H ALA 17 H ALA 17 -7.050 -1.497 -8.128
134 HA ALA 17 HA ALA 17 -5.591 -3.358 -6.421
135 HB1 ALA 17 HB1 ALA 17 -5.685 -3.652 -8.872
136 HB2 ALA 17 HB2 ALA 17 -4.903 -2.069 -9.095
137 HB3 ALA 17 HB3 ALA 17 -4.011 -3.402 -8.324
138 H VAL 18 H VAL 18 -4.943 -2.180 -4.567
139 HA VAL 18 HA VAL 18 -3.834 0.442 -4.717
140 HB VAL 18 HB VAL 18 -3.426 -1.714 -2.597
141 HG11 VAL 18 HG11 VAL 18 -3.205 0.331 -1.118
142 HG12 VAL 18 HG12 VAL 18 -1.884 0.147 -2.295
143 HG13 VAL 18 HG13 VAL 18 -3.186 1.325 -2.586
144 HG21 VAL 18 HG21 VAL 18 -5.577 0.430 -2.881
145 HG22 VAL 18 HG22 VAL 18 -5.824 -1.322 -3.072
146 HG23 VAL 18 HG23 VAL 18 -5.372 -0.660 -1.490
147 H THR 19 H THR 19 -2.589 -2.679 -5.494
148 HA THR 19 HA THR 19 0.104 -2.504 -4.931
149 HB THR 19 HB THR 19 -1.235 -3.652 -7.411
150 HG1 THR 19 HG1 THR 19 -1.321 -5.514 -6.105
151 HG21 THR 19 HG21 THR 19 0.690 -5.235 -7.363
152 HG22 THR 19 HG22 THR 19 1.219 -3.556 -7.625
153 HG23 THR 19 HG23 THR 19 1.399 -4.304 -6.021
154 H LYS 20 H LYS 20 -1.723 -0.913 -7.561
155 HA LYS 20 HA LYS 20 0.448 -0.207 -9.203
156 HB2 LYS 20 HB2 LYS 20 -2.125 1.313 -8.633
157 HB3 LYS 20 HB3 LYS 20 -1.057 1.574 -10.027
158 HG2 LYS 20 HG2 LYS 20 -1.455 -0.741 -10.783
159 HG3 LYS 20 HG3 LYS 20 -2.500 -1.031 -9.372
160 HD2 LYS 20 HD2 LYS 20 -4.001 0.797 -10.116
161 HD3 LYS 20 HD3 LYS 20 -2.968 1.059 -11.541
162 HE2 LYS 20 HE2 LYS 20 -3.401 -1.253 -12.288
163 HE3 LYS 20 HE3 LYS 20 -4.407 -1.537 -10.855
164 HZ1 LYS 20 HZ1 LYS 20 -5.729 -0.993 -12.751
165 HZ2 LYS 20 HZ2 LYS 20 -5.869 0.196 -11.620
166 HZ3 LYS 20 HZ3 LYS 20 -4.939 0.440 -12.960
167 H ALA 21 H ALA 21 -0.581 1.143 -6.087
168 HA ALA 21 HA ALA 21 0.981 3.589 -6.482
169 HB1 ALA 21 HB1 ALA 21 -0.451 2.416 -4.063
170 HB2 ALA 21 HB2 ALA 21 0.301 4.026 -4.129
171 HB3 ALA 21 HB3 ALA 21 -1.091 3.654 -5.172
172 H LEU 22 H LEU 22 1.409 0.349 -5.120
173 HA LEU 22 HA LEU 22 3.718 1.146 -3.515
174 HB2 LEU 22 HB2 LEU 22 2.401 -1.506 -4.236
175 HB3 LEU 22 HB3 LEU 22 3.917 -1.408 -3.335
176 HG LEU 22 HG LEU 22 2.224 -1.649 -1.718
177 HD11 LEU 22 HD11 LEU 22 3.971 0.137 -1.291
178 HD12 LEU 22 HD12 LEU 22 2.759 1.341 -1.771
179 HD13 LEU 22 HD13 LEU 22 2.466 0.310 -0.354
180 HD21 LEU 22 HD21 LEU 22 0.753 0.699 -2.971
181 HD22 LEU 22 HD22 LEU 22 0.292 -1.017 -3.114
182 HD23 LEU 22 HD23 LEU 22 0.261 -0.214 -1.529
183 H LYS 23 H LYS 23 3.087 -0.352 -6.699
184 HA LYS 23 HA LYS 23 5.695 -1.329 -7.122
185 HB2 LYS 23 HB2 LYS 23 3.559 -1.844 -8.386
186 HB3 LYS 23 HB3 LYS 23 3.798 -0.319 -9.270
187 HG2 LYS 23 HG2 LYS 23 5.988 -1.119 -10.073
188 HG3 LYS 23 HG3 LYS 23 5.831 -2.592 -9.088
189 HD2 LYS 23 HD2 LYS 23 3.801 -3.225 -10.361
190 HD3 LYS 23 HD3 LYS 23 3.984 -1.766 -11.365
191 HE2 LYS 23 HE2 LYS 23 6.197 -2.543 -12.100
192 HE3 LYS 23 HE3 LYS 23 6.049 -4.005 -11.104
193 HZ1 LYS 23 HZ1 LYS 23 5.396 -3.982 -13.598
194 HZ2 LYS 23 HZ2 LYS 23 4.495 -4.857 -12.506
195 HZ3 LYS 23 HZ3 LYS 23 3.979 -3.386 -13.044
196 H LYS 24 H LYS 24 4.485 1.956 -7.230
197 HA LYS 24 HA LYS 24 6.483 2.984 -9.034
198 HB2 LYS 24 HB2 LYS 24 4.788 4.340 -6.898
199 HB3 LYS 24 HB3 LYS 24 5.708 5.176 -8.168
200 HG2 LYS 24 HG2 LYS 24 4.357 4.090 -9.905
201 HG3 LYS 24 HG3 LYS 24 3.472 3.166 -8.668
202 HD2 LYS 24 HD2 LYS 24 2.645 5.260 -7.667
203 HD3 LYS 24 HD3 LYS 24 3.555 6.206 -8.868
204 HE2 LYS 24 HE2 LYS 24 2.254 5.174 -10.687
205 HE3 LYS 24 HE3 LYS 24 1.355 4.197 -9.508
206 HZ1 LYS 24 HZ1 LYS 24 0.482 6.194 -8.574
207 HZ2 LYS 24 HZ2 LYS 24 1.384 7.134 -9.580
208 HZ3 LYS 24 HZ3 LYS 24 0.183 6.188 -10.196
209 H VAL 25 H VAL 25 6.657 1.860 -5.783
210 HA VAL 25 HA VAL 25 8.590 3.807 -4.852
211 HB VAL 25 HB VAL 25 7.632 1.111 -3.836
212 HG11 VAL 25 HG11 VAL 25 8.761 1.688 -1.724
213 HG12 VAL 25 HG12 VAL 25 9.926 1.531 -3.061
214 HG13 VAL 25 HG13 VAL 25 9.444 3.145 -2.485
215 HG21 VAL 25 HG21 VAL 25 6.466 2.521 -2.161
216 HG22 VAL 25 HG22 VAL 25 7.108 3.981 -2.949
217 HG23 VAL 25 HG23 VAL 25 5.959 2.934 -3.814
218 HA PRO 26 HA PRO 26 12.121 2.090 -6.919
219 HB2 PRO 26 HB2 PRO 26 13.507 3.260 -4.513
220 HB3 PRO 26 HB3 PRO 26 13.932 3.434 -6.249
221 HG2 PRO 26 HG2 PRO 26 12.683 5.454 -4.947
222 HG3 PRO 26 HG3 PRO 26 12.152 4.985 -6.598
223 HD2 PRO 26 HD2 PRO 26 10.906 4.238 -3.946
224 HD3 PRO 26 HD3 PRO 26 10.112 4.766 -5.465
225 H GLY 27 H GLY 27 12.940 0.053 -6.835
226 HA2 GLY 27 HA2 GLY 27 14.180 -1.683 -5.921
227 HA3 GLY 27 HA3 GLY 27 13.910 -1.030 -4.296
228 H VAL 28 H VAL 28 10.919 -0.841 -4.824
229 HA VAL 28 HA VAL 28 10.270 -3.504 -3.898
230 HB VAL 28 HB VAL 28 8.583 -1.119 -4.740
231 HG11 VAL 28 HG11 VAL 28 7.312 -3.198 -5.103
232 HG12 VAL 28 HG12 VAL 28 7.736 -3.757 -3.468
233 HG13 VAL 28 HG13 VAL 28 6.693 -2.333 -3.683
234 HG21 VAL 28 HG21 VAL 28 9.250 -2.361 -2.033
235 HG22 VAL 28 HG22 VAL 28 9.968 -0.874 -2.693
236 HG23 VAL 28 HG23 VAL 28 8.237 -0.924 -2.299
237 H GLU 29 H GLU 29 9.762 -5.266 -5.020
238 HA GLU 29 HA GLU 29 9.048 -4.888 -7.897
239 HB2 GLU 29 HB2 GLU 29 11.172 -6.542 -6.606
240 HB3 GLU 29 HB3 GLU 29 10.263 -7.280 -7.949
241 HG2 GLU 29 HG2 GLU 29 10.695 -5.292 -9.355
242 HG3 GLU 29 HG3 GLU 29 11.651 -4.576 -8.044
243 H LYS 30 H LYS 30 8.392 -6.507 -4.840
244 HA LYS 30 HA LYS 30 6.072 -7.773 -6.206
245 HB2 LYS 30 HB2 LYS 30 7.825 -8.995 -4.044
246 HB3 LYS 30 HB3 LYS 30 6.252 -9.638 -4.563
247 HG2 LYS 30 HG2 LYS 30 7.141 -9.759 -6.915
248 HG3 LYS 30 HG3 LYS 30 8.746 -9.324 -6.279
249 HD2 LYS 30 HD2 LYS 30 8.691 -11.311 -4.798
250 HD3 LYS 30 HD3 LYS 30 7.072 -11.722 -5.410
251 HE2 LYS 30 HE2 LYS 30 8.009 -11.899 -7.709
252 HE3 LYS 30 HE3 LYS 30 9.629 -11.572 -7.057
253 HZ1 LYS 30 HZ1 LYS 30 9.411 -13.545 -5.721
254 HZ2 LYS 30 HZ2 LYS 30 7.909 -13.844 -6.334
255 HZ3 LYS 30 HZ3 LYS 30 9.230 -13.907 -7.318
256 H VAL 31 H VAL 31 4.185 -7.973 -4.963
257 HA VAL 31 HA VAL 31 4.041 -6.465 -2.434
258 HB VAL 31 HB VAL 31 2.401 -5.841 -4.927
259 HG11 VAL 31 HG11 VAL 31 2.314 -4.651 -2.123
260 HG12 VAL 31 HG12 VAL 31 1.408 -4.046 -3.529
261 HG13 VAL 31 HG13 VAL 31 1.058 -5.661 -2.876
262 HG21 VAL 31 HG21 VAL 31 3.447 -3.595 -4.749
263 HG22 VAL 31 HG22 VAL 31 4.459 -4.185 -3.409
264 HG23 VAL 31 HG23 VAL 31 4.652 -4.865 -5.042
265 H GLU 32 H GLU 32 2.149 -7.052 -1.216
266 HA GLU 32 HA GLU 32 0.474 -9.198 -2.375
267 HB2 GLU 32 HB2 GLU 32 2.359 -10.270 -1.170
268 HB3 GLU 32 HB3 GLU 32 1.904 -9.387 0.306
269 HG2 GLU 32 HG2 GLU 32 -0.324 -10.464 0.260
270 HG3 GLU 32 HG3 GLU 32 0.112 -11.311 -1.238
271 H VAL 33 H VAL 33 -1.345 -7.911 -2.430
272 HA VAL 33 HA VAL 33 -2.061 -6.408 0.014
273 HB VAL 33 HB VAL 33 -3.731 -5.329 -1.412
274 HG11 VAL 33 HG11 VAL 33 -1.379 -4.493 -1.403
275 HG12 VAL 33 HG12 VAL 33 -1.036 -5.513 -2.820
276 HG13 VAL 33 HG13 VAL 33 -2.208 -4.183 -2.947
277 HG21 VAL 33 HG21 VAL 33 -2.690 -7.174 -3.607
278 HG22 VAL 33 HG22 VAL 33 -4.303 -7.253 -2.856
279 HG23 VAL 33 HG23 VAL 33 -3.843 -5.839 -3.828
280 H SER 34 H SER 34 -4.191 -6.574 0.913
281 HA SER 34 HA SER 34 -5.641 -9.086 0.254
282 HB2 SER 34 HB2 SER 34 -4.357 -9.381 2.348
283 HB3 SER 34 HB3 SER 34 -5.138 -7.932 3.024
284 HG SER 34 HG SER 34 -6.063 -10.461 2.843
285 H LEU 35 H LEU 35 -7.329 -8.267 -0.849
286 HA LEU 35 HA LEU 35 -8.305 -5.631 -0.520
287 HB2 LEU 35 HB2 LEU 35 -9.709 -8.043 -1.718
288 HB3 LEU 35 HB3 LEU 35 -10.069 -6.341 -2.051
289 HG LEU 35 HG LEU 35 -7.458 -7.774 -2.674
290 HD11 LEU 35 HD11 LEU 35 -8.151 -7.536 -5.032
291 HD12 LEU 35 HD12 LEU 35 -9.329 -8.499 -4.108
292 HD13 LEU 35 HD13 LEU 35 -9.685 -6.803 -4.510
293 HD21 LEU 35 HD21 LEU 35 -8.274 -5.045 -3.699
294 HD22 LEU 35 HD22 LEU 35 -7.357 -5.235 -2.173
295 HD23 LEU 35 HD23 LEU 35 -6.683 -5.806 -3.711
296 H GLU 36 H GLU 36 -8.974 -8.524 1.327
297 HA GLU 36 HA GLU 36 -11.604 -7.575 2.212
298 HB2 GLU 36 HB2 GLU 36 -9.799 -9.856 3.113
299 HB3 GLU 36 HB3 GLU 36 -11.428 -9.537 3.754
300 HG2 GLU 36 HG2 GLU 36 -12.381 -9.780 1.493
301 HG3 GLU 36 HG3 GLU 36 -10.762 -10.090 0.835
302 H LYS 37 H LYS 37 -8.219 -7.453 3.279
303 HA LYS 37 HA LYS 37 -9.070 -6.436 5.924
304 HB2 LYS 37 HB2 LYS 37 -6.308 -7.080 4.828
305 HB3 LYS 37 HB3 LYS 37 -6.715 -6.739 6.523
306 HG2 LYS 37 HG2 LYS 37 -8.096 -8.765 6.632
307 HG3 LYS 37 HG3 LYS 37 -7.832 -9.066 4.898
308 HD2 LYS 37 HD2 LYS 37 -5.372 -9.203 5.331
309 HD3 LYS 37 HD3 LYS 37 -5.703 -9.068 7.075
310 HE2 LYS 37 HE2 LYS 37 -7.073 -11.111 6.987
311 HE3 LYS 37 HE3 LYS 37 -6.848 -11.207 5.229
312 HZ1 LYS 37 HZ1 LYS 37 -5.356 -12.657 6.354
313 HZ2 LYS 37 HZ2 LYS 37 -4.498 -11.467 5.611
314 HZ3 LYS 37 HZ3 LYS 37 -4.721 -11.421 7.244
315 H GLY 38 H GLY 38 -8.075 -5.295 2.822
316 HA2 GLY 38 HA2 GLY 38 -7.589 -3.177 2.066
317 HA3 GLY 38 HA3 GLY 38 -8.092 -2.538 3.650
318 H GLU 39 H GLU 39 -5.720 -5.087 3.646
319 HA GLU 39 HA GLU 39 -3.660 -3.135 4.511
320 HB2 GLU 39 HB2 GLU 39 -4.005 -6.123 4.949
321 HB3 GLU 39 HB3 GLU 39 -2.598 -5.185 5.505
322 HG2 GLU 39 HG2 GLU 39 -4.017 -3.765 6.887
323 HG3 GLU 39 HG3 GLU 39 -5.477 -4.548 6.262
324 H ALA 40 H ALA 40 -1.436 -3.466 3.793
325 HA ALA 40 HA ALA 40 -1.133 -5.051 1.300
326 HB1 ALA 40 HB1 ALA 40 -1.246 -2.092 1.572
327 HB2 ALA 40 HB2 ALA 40 0.134 -2.727 0.617
328 HB3 ALA 40 HB3 ALA 40 -1.542 -3.113 0.171
329 H LEU 41 H LEU 41 0.606 -6.250 1.563
330 HA LEU 41 HA LEU 41 2.901 -5.279 3.194
331 HB2 LEU 41 HB2 LEU 41 2.092 -8.030 2.135
332 HB3 LEU 41 HB3 LEU 41 3.640 -7.680 2.908
333 HG LEU 41 HG LEU 41 2.281 -8.669 4.566
334 HD11 LEU 41 HD11 LEU 41 3.597 -6.665 5.268
335 HD12 LEU 41 HD12 LEU 41 2.147 -5.662 5.021
336 HD13 LEU 41 HD13 LEU 41 2.152 -6.931 6.268
337 HD21 LEU 41 HD21 LEU 41 0.063 -7.914 5.182
338 HD22 LEU 41 HD22 LEU 41 0.137 -6.582 4.011
339 HD23 LEU 41 HD23 LEU 41 0.090 -8.269 3.439
340 H VAL 42 H VAL 42 5.029 -5.395 2.243
341 HA VAL 42 HA VAL 42 5.048 -5.787 -0.705
342 HB VAL 42 HB VAL 42 6.540 -3.828 -0.931
343 HG11 VAL 42 HG11 VAL 42 4.790 -2.226 -0.984
344 HG12 VAL 42 HG12 VAL 42 4.009 -3.789 -1.225
345 HG13 VAL 42 HG13 VAL 42 3.925 -3.016 0.371
346 HG21 VAL 42 HG21 VAL 42 5.737 -3.254 1.954
347 HG22 VAL 42 HG22 VAL 42 7.361 -3.738 1.409
348 HG23 VAL 42 HG23 VAL 42 6.680 -2.179 0.895
349 H GLU 43 H GLU 43 7.253 -6.067 -1.591
350 HA GLU 43 HA GLU 43 9.273 -6.884 0.399
351 HB2 GLU 43 HB2 GLU 43 8.058 -8.935 -0.292
352 HB3 GLU 43 HB3 GLU 43 8.457 -8.585 -1.989
353 HG2 GLU 43 HG2 GLU 43 10.867 -8.678 -1.445
354 HG3 GLU 43 HG3 GLU 43 10.480 -8.961 0.262
355 H GLY 44 H GLY 44 10.641 -5.219 -0.015
356 HA2 GLY 44 HA2 GLY 44 12.008 -5.135 -2.577
357 HA3 GLY 44 HA3 GLY 44 11.015 -3.698 -2.234
358 H THR 45 H THR 45 13.434 -2.909 -2.440
359 HA THR 45 HA THR 45 14.684 -2.987 0.263
360 HB THR 45 HB THR 45 16.750 -2.339 -0.967
361 HG1 THR 45 HG1 THR 45 16.643 -2.482 -3.253
362 HG21 THR 45 HG21 THR 45 15.349 -4.806 -2.092
363 HG22 THR 45 HG22 THR 45 17.103 -4.509 -2.081
364 HG23 THR 45 HG23 THR 45 16.229 -4.728 -0.547
365 H ALA 46 H ALA 46 12.379 -1.245 -0.706
366 HA ALA 46 HA ALA 46 13.511 1.389 -1.060
367 HB1 ALA 46 HB1 ALA 46 10.687 0.826 -0.158
368 HB2 ALA 46 HB2 ALA 46 11.295 2.113 -1.205
369 HB3 ALA 46 HB3 ALA 46 11.218 0.448 -1.829
370 H ASP 47 H ASP 47 12.787 3.224 0.482
371 HA ASP 47 HA ASP 47 13.476 2.459 3.236
372 HB2 ASP 47 HB2 ASP 47 12.930 5.129 1.878
373 HB3 ASP 47 HB3 ASP 47 13.377 4.946 3.585
374 HA PRO 48 HA PRO 48 9.439 2.312 4.885
375 HB2 PRO 48 HB2 PRO 48 10.416 4.312 6.921
376 HB3 PRO 48 HB3 PRO 48 9.524 2.778 7.200
377 HG2 PRO 48 HG2 PRO 48 12.196 2.875 7.606
378 HG3 PRO 48 HG3 PRO 48 11.480 1.483 6.721
379 HD2 PRO 48 HD2 PRO 48 12.870 3.915 5.583
380 HD3 PRO 48 HD3 PRO 48 13.039 2.194 5.114
381 H LYS 49 H LYS 49 10.837 5.632 4.598
382 HA LYS 49 HA LYS 49 8.267 6.945 4.703
383 HB2 LYS 49 HB2 LYS 49 11.034 7.735 3.732
384 HB3 LYS 49 HB3 LYS 49 9.618 8.768 3.459
385 HG2 LYS 49 HG2 LYS 49 9.150 8.738 5.919
386 HG3 LYS 49 HG3 LYS 49 10.699 7.888 6.150
387 HD2 LYS 49 HD2 LYS 49 11.773 9.882 6.060
388 HD3 LYS 49 HD3 LYS 49 11.194 10.093 4.392
389 HE2 LYS 49 HE2 LYS 49 9.035 10.983 5.323
390 HE3 LYS 49 HE3 LYS 49 9.748 10.917 6.947
391 HZ1 LYS 49 HZ1 LYS 49 10.808 12.461 4.678
392 HZ2 LYS 49 HZ2 LYS 49 9.922 13.083 5.914
393 HZ3 LYS 49 HZ3 LYS 49 11.418 12.453 6.209
394 H ALA 50 H ALA 50 10.376 5.755 2.036
395 HA ALA 50 HA ALA 50 8.957 6.915 -0.068
396 HB1 ALA 50 HB1 ALA 50 11.148 5.798 -0.290
397 HB2 ALA 50 HB2 ALA 50 10.374 4.221 -0.003
398 HB3 ALA 50 HB3 ALA 50 9.973 5.158 -1.461
399 H LEU 51 H LEU 51 8.209 4.045 1.872
400 HA LEU 51 HA LEU 51 6.255 3.011 0.047
401 HB2 LEU 51 HB2 LEU 51 7.578 1.818 1.930
402 HB3 LEU 51 HB3 LEU 51 6.360 2.495 3.031
403 HG LEU 51 HG LEU 51 4.593 1.454 1.485
404 HD11 LEU 51 HD11 LEU 51 5.423 -0.454 0.100
405 HD12 LEU 51 HD12 LEU 51 6.039 1.108 -0.484
406 HD13 LEU 51 HD13 LEU 51 7.096 0.032 0.460
407 HD21 LEU 51 HD21 LEU 51 5.356 0.479 3.678
408 HD22 LEU 51 HD22 LEU 51 4.812 -0.745 2.502
409 HD23 LEU 51 HD23 LEU 51 6.547 -0.485 2.782
410 H VAL 52 H VAL 52 5.860 4.573 3.293
411 HA VAL 52 HA VAL 52 3.020 4.777 3.006
412 HB VAL 52 HB VAL 52 4.898 6.285 4.866
413 HG11 VAL 52 HG11 VAL 52 1.953 5.513 5.089
414 HG12 VAL 52 HG12 VAL 52 2.914 6.306 6.359
415 HG13 VAL 52 HG13 VAL 52 2.582 7.158 4.836
416 HG21 VAL 52 HG21 VAL 52 4.440 4.422 6.443
417 HG22 VAL 52 HG22 VAL 52 3.542 3.571 5.164
418 HG23 VAL 52 HG23 VAL 52 5.291 3.854 4.991
419 H GLN 53 H GLN 53 5.683 6.843 1.943
420 HA GLN 53 HA GLN 53 4.046 9.237 1.811
421 HB2 GLN 53 HB2 GLN 53 6.535 9.218 2.094
422 HB3 GLN 53 HB3 GLN 53 6.685 8.568 0.446
423 HG2 GLN 53 HG2 GLN 53 5.494 10.586 -0.416
424 HG3 GLN 53 HG3 GLN 53 5.425 11.228 1.237
425 HE21 GLN 53 HE21 GLN 53 8.333 12.922 -0.192
426 HE22 GLN 53 HE22 GLN 53 6.583 12.969 -0.249
427 H ALA 54 H ALA 54 4.999 6.600 -0.401
428 HA ALA 54 HA ALA 54 4.222 7.822 -2.814
429 HB1 ALA 54 HB1 ALA 54 4.082 5.500 -3.668
430 HB2 ALA 54 HB2 ALA 54 5.543 5.757 -2.690
431 HB3 ALA 54 HB3 ALA 54 4.152 4.888 -1.999
432 H VAL 55 H VAL 55 2.326 5.554 -0.725
433 HA VAL 55 HA VAL 55 0.005 5.746 -2.361
434 HB VAL 55 HB VAL 55 -1.100 4.625 -0.418
435 HG11 VAL 55 HG11 VAL 55 -0.228 2.869 -1.540
436 HG12 VAL 55 HG12 VAL 55 1.315 3.717 -1.850
437 HG13 VAL 55 HG13 VAL 55 1.044 2.863 -0.315
438 HG21 VAL 55 HG21 VAL 55 0.272 4.050 1.542
439 HG22 VAL 55 HG22 VAL 55 1.628 4.999 0.895
440 HG23 VAL 55 HG23 VAL 55 0.121 5.811 1.382
441 H GLU 56 H GLU 56 1.209 7.802 0.267
442 HA GLU 56 HA GLU 56 -1.369 8.924 0.888
443 HB2 GLU 56 HB2 GLU 56 0.547 9.014 2.436
444 HB3 GLU 56 HB3 GLU 56 1.452 10.012 1.276
445 HG2 GLU 56 HG2 GLU 56 -0.281 11.769 1.430
446 HG3 GLU 56 HG3 GLU 56 -1.206 10.767 2.566
447 H GLU 57 H GLU 57 1.261 9.699 -1.398
448 HA GLU 57 HA GLU 57 0.073 12.199 -2.267
449 HB2 GLU 57 HB2 GLU 57 2.449 10.547 -2.871
450 HB3 GLU 57 HB3 GLU 57 1.748 11.347 -4.299
451 HG2 GLU 57 HG2 GLU 57 1.800 13.511 -3.197
452 HG3 GLU 57 HG3 GLU 57 2.360 12.766 -1.685
453 H GLU 58 H GLU 58 -0.373 8.800 -2.951
454 HA GLU 58 HA GLU 58 -1.725 9.192 -5.492
455 HB2 GLU 58 HB2 GLU 58 -1.568 6.883 -3.523
456 HB3 GLU 58 HB3 GLU 58 -2.445 6.799 -5.066
457 HG2 GLU 58 HG2 GLU 58 0.473 7.627 -4.920
458 HG3 GLU 58 HG3 GLU 58 -0.032 5.932 -5.060
459 H GLY 59 H GLY 59 -2.506 10.041 -2.337
460 HA2 GLY 59 HA2 GLY 59 -4.481 11.231 -1.871
461 HA3 GLY 59 HA3 GLY 59 -5.329 10.329 -3.135
462 H TYR 60 H TYR 60 -3.550 8.099 -1.248
463 HA TYR 60 HA TYR 60 -5.842 7.763 0.621
464 HB2 TYR 60 HB2 TYR 60 -4.694 5.668 -1.243
465 HB3 TYR 60 HB3 TYR 60 -5.739 5.304 0.136
466 HD1 TYR 60 HD1 TYR 60 -5.603 6.582 -3.283
467 HD2 TYR 60 HD2 TYR 60 -8.091 6.061 0.181
468 HE1 TYR 60 HE1 TYR 60 -7.616 6.972 -4.679
469 HE2 TYR 60 HE2 TYR 60 -10.112 6.450 -1.203
470 HH TYR 60 HH TYR 60 -10.923 6.954 -3.288
471 H LYS 61 H LYS 61 -5.020 7.885 2.601
472 HA LYS 61 HA LYS 61 -2.292 7.493 3.272
473 HB2 LYS 61 HB2 LYS 61 -4.824 7.351 4.963
474 HB3 LYS 61 HB3 LYS 61 -3.177 7.428 5.617
475 HG2 LYS 61 HG2 LYS 61 -2.818 9.606 4.522
476 HG3 LYS 61 HG3 LYS 61 -4.457 9.535 3.828
477 HD2 LYS 61 HD2 LYS 61 -5.437 9.469 6.079
478 HD3 LYS 61 HD3 LYS 61 -3.813 9.476 6.809
479 HE2 LYS 61 HE2 LYS 61 -3.355 11.690 5.856
480 HE3 LYS 61 HE3 LYS 61 -4.904 11.650 4.992
481 HZ1 LYS 61 HZ1 LYS 61 -4.461 11.891 7.866
482 HZ2 LYS 61 HZ2 LYS 61 -5.272 12.896 6.863
483 HZ3 LYS 61 HZ3 LYS 61 -5.931 11.433 7.240
484 H ALA 62 H ALA 62 -1.547 5.821 4.945
485 HA ALA 62 HA ALA 62 -2.940 3.253 4.850
486 HB1 ALA 62 HB1 ALA 62 -1.653 3.276 2.740
487 HB2 ALA 62 HB2 ALA 62 -0.164 3.609 3.663
488 HB3 ALA 62 HB3 ALA 62 -1.035 2.071 3.892
489 H GLU 63 H GLU 63 -3.033 3.142 7.059
490 HA GLU 63 HA GLU 63 -0.900 3.937 8.798
491 HB2 GLU 63 HB2 GLU 63 -3.329 2.153 9.223
492 HB3 GLU 63 HB3 GLU 63 -2.281 2.763 10.519
493 HG2 GLU 63 HG2 GLU 63 -2.835 5.080 9.917
494 HG3 GLU 63 HG3 GLU 63 -3.823 4.510 8.561
495 H VAL 64 H VAL 64 1.058 2.903 8.692
496 HA VAL 64 HA VAL 64 1.468 0.161 8.139
497 HB VAL 64 HB VAL 64 3.692 0.602 9.246
498 HG11 VAL 64 HG11 VAL 64 3.349 1.010 6.862
499 HG12 VAL 64 HG12 VAL 64 2.690 2.628 7.206
500 HG13 VAL 64 HG13 VAL 64 4.399 2.270 7.545
501 HG21 VAL 64 HG21 VAL 64 2.525 3.399 9.607
502 HG22 VAL 64 HG22 VAL 64 2.997 2.292 10.918
503 HG23 VAL 64 HG23 VAL 64 4.229 2.950 9.827
504 H LEU 65 H LEU 65 0.446 -1.404 9.269
505 HA LEU 65 HA LEU 65 -0.083 -1.086 12.131
506 HB2 LEU 65 HB2 LEU 65 -0.475 -3.448 10.241
507 HB3 LEU 65 HB3 LEU 65 -1.054 -3.359 11.914
508 HG LEU 65 HG LEU 65 -1.882 -1.492 9.651
509 HD11 LEU 65 HD11 LEU 65 -3.373 -3.722 11.100
510 HD12 LEU 65 HD12 LEU 65 -4.059 -2.645 9.861
511 HD13 LEU 65 HD13 LEU 65 -2.767 -3.787 9.427
512 HD21 LEU 65 HD21 LEU 65 -1.935 -0.361 11.841
513 HD22 LEU 65 HD22 LEU 65 -3.583 -0.707 11.285
514 HD23 LEU 65 HD23 LEU 65 -2.841 -1.726 12.539
515 H ALA 66 H ALA 66 2.201 -0.771 12.724
516 HA ALA 66 HA ALA 66 3.776 -3.311 12.703
517 HB1 ALA 66 HB1 ALA 66 4.511 -0.377 12.672
518 HB2 ALA 66 HB2 ALA 66 5.664 -1.614 13.273
519 HB3 ALA 66 HB3 ALA 66 5.066 -1.668 11.598
Start of MODEL 19
1 H1 MET 1 H MET 1 8.828 -4.143 10.773
2 HA MET 1 HA MET 1 9.746 -3.877 7.971
3 HB2 MET 1 HB2 MET 1 9.645 -6.217 8.866
4 HB3 MET 1 HB3 MET 1 7.902 -6.003 9.121
5 HG2 MET 1 HG2 MET 1 7.583 -5.599 6.725
6 HG3 MET 1 HG3 MET 1 9.332 -5.654 6.459
7 HE1 MET 1 HE1 MET 1 7.287 -7.266 4.719
8 HE2 MET 1 HE2 MET 1 9.052 -7.329 4.499
9 HE3 MET 1 HE3 MET 1 8.114 -8.837 4.595
10 H LEU 2 H LEU 2 7.896 -3.626 6.380
11 HA LEU 2 HA LEU 2 6.024 -1.672 7.549
12 HB2 LEU 2 HB2 LEU 2 6.536 -2.485 4.659
13 HB3 LEU 2 HB3 LEU 2 5.582 -1.089 5.204
14 HG LEU 2 HG LEU 2 8.555 -1.531 5.748
15 HD11 LEU 2 HD11 LEU 2 7.143 0.431 3.897
16 HD12 LEU 2 HD12 LEU 2 8.896 0.326 4.180
17 HD13 LEU 2 HD13 LEU 2 8.048 -1.015 3.379
18 HD21 LEU 2 HD21 LEU 2 7.445 -0.238 7.539
19 HD22 LEU 2 HD22 LEU 2 8.495 0.808 6.562
20 HD23 LEU 2 HD23 LEU 2 6.733 0.847 6.318
21 H LYS 3 H LYS 3 3.755 -1.774 7.213
22 HA LYS 3 HA LYS 3 2.521 -4.232 6.259
23 HB2 LYS 3 HB2 LYS 3 3.453 -4.718 8.582
24 HB3 LYS 3 HB3 LYS 3 2.297 -3.535 9.221
25 HG2 LYS 3 HG2 LYS 3 0.424 -4.872 8.416
26 HG3 LYS 3 HG3 LYS 3 1.524 -5.911 7.480
27 HD2 LYS 3 HD2 LYS 3 2.650 -6.574 9.619
28 HD3 LYS 3 HD3 LYS 3 1.397 -5.680 10.510
29 HE2 LYS 3 HE2 LYS 3 -0.343 -7.118 9.540
30 HE3 LYS 3 HE3 LYS 3 0.873 -7.950 8.550
31 HZ1 LYS 3 HZ1 LYS 3 1.915 -8.707 10.544
32 HZ2 LYS 3 HZ2 LYS 3 0.805 -7.929 11.485
33 HZ3 LYS 3 HZ3 LYS 3 0.339 -9.184 10.517
34 H LEU 4 H LEU 4 1.598 -2.523 4.871
35 HA LEU 4 HA LEU 4 0.558 -0.129 6.151
36 HB2 LEU 4 HB2 LEU 4 0.979 -1.194 3.379
37 HB3 LEU 4 HB3 LEU 4 -0.276 0.038 3.594
38 HG LEU 4 HG LEU 4 1.336 1.538 4.701
39 HD11 LEU 4 HD11 LEU 4 3.745 0.991 4.661
40 HD12 LEU 4 HD12 LEU 4 2.839 -0.166 5.660
41 HD13 LEU 4 HD13 LEU 4 3.366 -0.628 4.024
42 HD21 LEU 4 HD21 LEU 4 1.017 1.649 2.247
43 HD22 LEU 4 HD22 LEU 4 2.689 2.053 2.699
44 HD23 LEU 4 HD23 LEU 4 2.312 0.449 2.026
45 H LYS 5 H LYS 5 -1.403 0.137 6.977
46 HA LYS 5 HA LYS 5 -3.590 -1.649 6.064
47 HB2 LYS 5 HB2 LYS 5 -3.077 -1.452 8.506
48 HB3 LYS 5 HB3 LYS 5 -3.530 0.261 8.444
49 HG2 LYS 5 HG2 LYS 5 -5.479 -1.723 7.292
50 HG3 LYS 5 HG3 LYS 5 -5.256 -1.739 9.052
51 HD2 LYS 5 HD2 LYS 5 -5.695 0.696 9.147
52 HD3 LYS 5 HD3 LYS 5 -6.019 0.689 7.396
53 HE2 LYS 5 HE2 LYS 5 -7.820 -0.957 7.742
54 HE3 LYS 5 HE3 LYS 5 -7.546 -0.919 9.495
55 HZ1 LYS 5 HZ1 LYS 5 -9.310 0.583 8.356
56 HZ2 LYS 5 HZ2 LYS 5 -8.414 1.172 9.624
57 HZ3 LYS 5 HZ3 LYS 5 -8.037 1.564 8.070
58 H VAL 6 H VAL 6 -4.099 -0.686 4.088
59 HA VAL 6 HA VAL 6 -4.053 2.121 3.643
60 HB VAL 6 HB VAL 6 -5.571 -0.037 2.126
61 HG11 VAL 6 HG11 VAL 6 -4.398 2.650 1.280
62 HG12 VAL 6 HG12 VAL 6 -5.228 1.493 0.213
63 HG13 VAL 6 HG13 VAL 6 -6.129 2.310 1.512
64 HG21 VAL 6 HG21 VAL 6 -3.201 -0.670 2.412
65 HG22 VAL 6 HG22 VAL 6 -3.517 -0.173 0.736
66 HG23 VAL 6 HG23 VAL 6 -2.695 0.943 1.852
67 H GLU 7 H GLU 7 -5.521 3.676 4.011
68 HA GLU 7 HA GLU 7 -7.971 3.029 5.440
69 HB2 GLU 7 HB2 GLU 7 -6.535 5.020 5.939
70 HB3 GLU 7 HB3 GLU 7 -6.926 5.671 4.336
71 HG2 GLU 7 HG2 GLU 7 -8.364 6.681 6.051
72 HG3 GLU 7 HG3 GLU 7 -9.327 5.697 4.932
73 H GLY 8 H GLY 8 -10.106 3.357 4.702
74 HA2 GLY 8 HA2 GLY 8 -10.439 3.267 1.762
75 HA3 GLY 8 HA3 GLY 8 -11.632 2.798 2.990
76 H MET 9 H MET 9 -9.691 5.784 2.294
77 HA MET 9 HA MET 9 -11.724 7.516 3.303
78 HB2 MET 9 HB2 MET 9 -9.414 8.078 1.398
79 HB3 MET 9 HB3 MET 9 -10.368 9.302 2.261
80 HG2 MET 9 HG2 MET 9 -9.666 8.300 4.423
81 HG3 MET 9 HG3 MET 9 -8.688 7.120 3.538
82 HE1 MET 9 HE1 MET 9 -7.847 11.664 3.796
83 HE2 MET 9 HE2 MET 9 -9.244 10.998 2.921
84 HE3 MET 9 HE3 MET 9 -9.126 10.807 4.687
85 H THR 10 H THR 10 -11.013 6.250 0.027
86 HA THR 10 HA THR 10 -13.565 7.473 -0.856
87 HB THR 10 HB THR 10 -12.500 8.134 -2.980
88 HG1 THR 10 HG1 THR 10 -10.199 8.067 -3.043
89 HG21 THR 10 HG21 THR 10 -12.621 9.776 -1.108
90 HG22 THR 10 HG22 THR 10 -11.016 9.241 -0.555
91 HG23 THR 10 HG23 THR 10 -11.194 10.033 -2.136
92 H CYS 11 H CYS 11 -14.200 6.527 -3.063
93 HA CYS 11 HA CYS 11 -14.898 4.684 -4.189
94 HB2 CYS 11 HB2 CYS 11 -11.985 3.883 -3.854
95 HB3 CYS 11 HB3 CYS 11 -13.100 3.344 -5.131
96 HG CYS 11 HG CYS 11 -13.630 5.731 -6.043
97 H ASN 12 H ASN 12 -15.400 4.493 -1.350
98 HA ASN 12 HA ASN 12 -14.523 1.960 -0.356
99 HB2 ASN 12 HB2 ASN 12 -16.203 2.312 1.373
100 HB3 ASN 12 HB3 ASN 12 -15.325 3.822 1.063
101 HD21 ASN 12 HD21 ASN 12 -19.347 3.700 0.735
102 HD22 ASN 12 HD22 ASN 12 -18.365 2.484 1.520
103 H HIS 13 H HIS 13 -16.891 2.750 -2.783
104 HA HIS 13 HA HIS 13 -18.309 0.184 -2.305
105 HB2 HIS 13 HB2 HIS 13 -18.831 2.500 -4.191
106 HB3 HIS 13 HB3 HIS 13 -19.734 0.977 -4.222
107 HD1 HIS 13 HD1 HIS 13 -21.593 0.653 -2.386
108 HD2 HIS 13 HD2 HIS 13 -19.141 4.040 -1.909
109 HE1 HIS 13 HE1 HIS 13 -22.650 2.074 -0.540
110 H CYS 14 H CYS 14 -16.513 1.917 -4.932
111 HA CYS 14 HA CYS 14 -16.192 -0.707 -6.294
112 HB2 CYS 14 HB2 CYS 14 -15.652 2.159 -7.188
113 HB3 CYS 14 HB3 CYS 14 -15.396 0.708 -8.186
114 HG CYS 14 HG CYS 14 -17.600 1.915 -8.925
115 H VAL 15 H VAL 15 -14.277 -1.780 -6.080
116 HA VAL 15 HA VAL 15 -12.124 -0.359 -4.665
117 HB VAL 15 HB VAL 15 -12.982 -2.552 -3.886
118 HG11 VAL 15 HG11 VAL 15 -11.735 -3.615 -6.457
119 HG12 VAL 15 HG12 VAL 15 -12.421 -4.593 -5.140
120 HG13 VAL 15 HG13 VAL 15 -13.477 -3.539 -6.106
121 HG21 VAL 15 HG21 VAL 15 -10.819 -3.560 -3.472
122 HG22 VAL 15 HG22 VAL 15 -10.097 -2.690 -4.846
123 HG23 VAL 15 HG23 VAL 15 -10.652 -1.794 -3.410
124 H MET 16 H MET 16 -9.892 -0.501 -5.366
125 HA MET 16 HA MET 16 -9.511 -1.079 -8.249
126 HB2 MET 16 HB2 MET 16 -8.583 1.448 -6.805
127 HB3 MET 16 HB3 MET 16 -8.127 0.952 -8.445
128 HG2 MET 16 HG2 MET 16 -9.855 2.377 -8.916
129 HG3 MET 16 HG3 MET 16 -10.717 0.836 -8.858
130 HE1 MET 16 HE1 MET 16 -13.317 3.425 -7.480
131 HE2 MET 16 HE2 MET 16 -12.110 3.671 -8.764
132 HE3 MET 16 HE3 MET 16 -13.000 2.133 -8.661
133 H ALA 17 H ALA 17 -7.220 -1.405 -8.785
134 HA ALA 17 HA ALA 17 -5.911 -3.007 -6.772
135 HB1 ALA 17 HB1 ALA 17 -5.837 -3.550 -9.180
136 HB2 ALA 17 HB2 ALA 17 -4.976 -2.026 -9.501
137 HB3 ALA 17 HB3 ALA 17 -4.199 -3.299 -8.530
138 H VAL 18 H VAL 18 -5.285 -1.727 -4.997
139 HA VAL 18 HA VAL 18 -3.966 0.802 -5.311
140 HB VAL 18 HB VAL 18 -3.899 -1.158 -2.975
141 HG11 VAL 18 HG11 VAL 18 -3.590 0.995 -1.675
142 HG12 VAL 18 HG12 VAL 18 -2.208 0.575 -2.717
143 HG13 VAL 18 HG13 VAL 18 -3.362 1.833 -3.221
144 HG21 VAL 18 HG21 VAL 18 -5.799 1.137 -3.627
145 HG22 VAL 18 HG22 VAL 18 -6.211 -0.596 -3.633
146 HG23 VAL 18 HG23 VAL 18 -5.784 0.210 -2.109
147 H THR 19 H THR 19 -2.973 -2.464 -5.791
148 HA THR 19 HA THR 19 -0.303 -2.474 -5.052
149 HB THR 19 HB THR 19 -1.561 -3.668 -7.553
150 HG1 THR 19 HG1 THR 19 -1.744 -5.484 -6.098
151 HG21 THR 19 HG21 THR 19 0.237 -5.355 -7.321
152 HG22 THR 19 HG22 THR 19 0.915 -3.731 -7.564
153 HG23 THR 19 HG23 THR 19 0.904 -4.455 -5.939
154 H LYS 20 H LYS 20 -1.840 -0.938 -7.896
155 HA LYS 20 HA LYS 20 0.502 -0.442 -9.385
156 HB2 LYS 20 HB2 LYS 20 -2.022 1.242 -9.134
157 HB3 LYS 20 HB3 LYS 20 -0.814 1.369 -10.428
158 HG2 LYS 20 HG2 LYS 20 -1.267 -0.984 -11.077
159 HG3 LYS 20 HG3 LYS 20 -2.508 -1.086 -9.802
160 HD2 LYS 20 HD2 LYS 20 -3.732 0.801 -10.864
161 HD3 LYS 20 HD3 LYS 20 -2.504 0.858 -12.152
162 HE2 LYS 20 HE2 LYS 20 -3.038 -1.495 -12.740
163 HE3 LYS 20 HE3 LYS 20 -4.279 -1.521 -11.473
164 HZ1 LYS 20 HZ1 LYS 20 -5.220 -1.076 -13.608
165 HZ2 LYS 20 HZ2 LYS 20 -5.408 0.242 -12.638
166 HZ3 LYS 20 HZ3 LYS 20 -4.255 0.244 -13.820
167 H ALA 21 H ALA 21 -0.664 1.057 -6.410
168 HA ALA 21 HA ALA 21 0.970 3.456 -6.771
169 HB1 ALA 21 HB1 ALA 21 -0.499 2.362 -4.339
170 HB2 ALA 21 HB2 ALA 21 0.171 4.000 -4.522
171 HB3 ALA 21 HB3 ALA 21 -1.187 3.474 -5.545
172 H LEU 22 H LEU 22 1.173 0.286 -5.141
173 HA LEU 22 HA LEU 22 3.477 0.979 -3.534
174 HB2 LEU 22 HB2 LEU 22 2.151 -1.629 -4.387
175 HB3 LEU 22 HB3 LEU 22 3.625 -1.586 -3.416
176 HG LEU 22 HG LEU 22 1.768 -1.899 -1.951
177 HD11 LEU 22 HD11 LEU 22 3.657 -0.363 -1.257
178 HD12 LEU 22 HD12 LEU 22 2.600 1.003 -1.666
179 HD13 LEU 22 HD13 LEU 22 2.124 -0.123 -0.380
180 HD21 LEU 22 HD21 LEU 22 0.612 0.705 -3.017
181 HD22 LEU 22 HD22 LEU 22 -0.005 -0.929 -3.373
182 HD23 LEU 22 HD23 LEU 22 -0.057 -0.297 -1.713
183 H LYS 23 H LYS 23 2.912 -0.506 -6.713
184 HA LYS 23 HA LYS 23 5.495 -1.576 -7.060
185 HB2 LYS 23 HB2 LYS 23 3.313 -2.113 -8.248
186 HB3 LYS 23 HB3 LYS 23 3.610 -0.689 -9.269
187 HG2 LYS 23 HG2 LYS 23 5.738 -1.662 -10.030
188 HG3 LYS 23 HG3 LYS 23 5.554 -3.006 -8.878
189 HD2 LYS 23 HD2 LYS 23 3.450 -3.678 -10.022
190 HD3 LYS 23 HD3 LYS 23 3.720 -2.405 -11.236
191 HE2 LYS 23 HE2 LYS 23 5.818 -3.431 -11.906
192 HE3 LYS 23 HE3 LYS 23 5.708 -4.640 -10.611
193 HZ1 LYS 23 HZ1 LYS 23 4.922 -5.140 -13.020
194 HZ2 LYS 23 HZ2 LYS 23 4.104 -5.760 -11.714
195 HZ3 LYS 23 HZ3 LYS 23 3.532 -4.439 -12.515
196 H LYS 24 H LYS 24 4.414 1.756 -7.372
197 HA LYS 24 HA LYS 24 6.417 2.458 -9.350
198 HB2 LYS 24 HB2 LYS 24 4.714 4.148 -7.480
199 HB3 LYS 24 HB3 LYS 24 5.719 4.783 -8.799
200 HG2 LYS 24 HG2 LYS 24 4.425 3.465 -10.439
201 HG3 LYS 24 HG3 LYS 24 3.424 2.810 -9.124
202 HD2 LYS 24 HD2 LYS 24 2.720 5.120 -8.529
203 HD3 LYS 24 HD3 LYS 24 3.690 5.753 -9.879
204 HE2 LYS 24 HE2 LYS 24 2.340 4.416 -11.469
205 HE3 LYS 24 HE3 LYS 24 1.373 3.789 -10.117
206 HZ1 LYS 24 HZ1 LYS 24 0.714 6.047 -9.642
207 HZ2 LYS 24 HZ2 LYS 24 1.582 6.608 -10.925
208 HZ3 LYS 24 HZ3 LYS 24 0.290 5.617 -11.178
209 H VAL 25 H VAL 25 6.510 2.011 -5.873
210 HA VAL 25 HA VAL 25 8.569 4.006 -5.451
211 HB VAL 25 HB VAL 25 7.449 1.731 -3.784
212 HG11 VAL 25 HG11 VAL 25 8.702 2.725 -1.893
213 HG12 VAL 25 HG12 VAL 25 9.798 2.088 -3.138
214 HG13 VAL 25 HG13 VAL 25 9.510 3.841 -3.018
215 HG21 VAL 25 HG21 VAL 25 6.540 3.663 -2.484
216 HG22 VAL 25 HG22 VAL 25 7.242 4.773 -3.679
217 HG23 VAL 25 HG23 VAL 25 5.954 3.645 -4.165
218 HA PRO 26 HA PRO 26 11.948 1.624 -7.065
219 HB2 PRO 26 HB2 PRO 26 13.429 3.383 -5.116
220 HB3 PRO 26 HB3 PRO 26 13.829 3.025 -6.830
221 HG2 PRO 26 HG2 PRO 26 12.684 5.387 -6.179
222 HG3 PRO 26 HG3 PRO 26 12.087 4.468 -7.606
223 HD2 PRO 26 HD2 PRO 26 10.899 4.589 -4.824
224 HD3 PRO 26 HD3 PRO 26 10.076 4.687 -6.415
225 H GLY 27 H GLY 27 13.078 -0.189 -6.389
226 HA2 GLY 27 HA2 GLY 27 14.229 -1.559 -4.893
227 HA3 GLY 27 HA3 GLY 27 13.608 -0.608 -3.530
228 H VAL 28 H VAL 28 10.794 -0.802 -4.784
229 HA VAL 28 HA VAL 28 10.020 -3.265 -3.439
230 HB VAL 28 HB VAL 28 8.507 -1.227 -5.123
231 HG11 VAL 28 HG11 VAL 28 7.406 -3.418 -5.269
232 HG12 VAL 28 HG12 VAL 28 7.458 -3.575 -3.496
233 HG13 VAL 28 HG13 VAL 28 6.460 -2.310 -4.252
234 HG21 VAL 28 HG21 VAL 28 8.600 -1.763 -2.123
235 HG22 VAL 28 HG22 VAL 28 9.336 -0.376 -2.963
236 HG23 VAL 28 HG23 VAL 28 7.569 -0.556 -2.929
237 H GLU 29 H GLU 29 9.806 -5.263 -4.365
238 HA GLU 29 HA GLU 29 9.726 -5.367 -7.351
239 HB2 GLU 29 HB2 GLU 29 11.494 -6.767 -5.384
240 HB3 GLU 29 HB3 GLU 29 10.850 -7.727 -6.733
241 HG2 GLU 29 HG2 GLU 29 11.613 -5.988 -8.335
242 HG3 GLU 29 HG3 GLU 29 12.376 -5.111 -6.998
243 H LYS 30 H LYS 30 8.513 -6.554 -4.234
244 HA LYS 30 HA LYS 30 6.390 -7.947 -5.781
245 HB2 LYS 30 HB2 LYS 30 7.834 -8.987 -3.312
246 HB3 LYS 30 HB3 LYS 30 6.372 -9.707 -4.023
247 HG2 LYS 30 HG2 LYS 30 7.584 -10.025 -6.171
248 HG3 LYS 30 HG3 LYS 30 9.062 -9.375 -5.420
249 HD2 LYS 30 HD2 LYS 30 9.012 -11.185 -3.742
250 HD3 LYS 30 HD3 LYS 30 7.515 -11.821 -4.464
251 HE2 LYS 30 HE2 LYS 30 8.693 -12.197 -6.600
252 HE3 LYS 30 HE3 LYS 30 10.187 -11.546 -5.898
253 HZ1 LYS 30 HZ1 LYS 30 10.147 -13.326 -4.309
254 HZ2 LYS 30 HZ2 LYS 30 8.759 -13.936 -4.954
255 HZ3 LYS 30 HZ3 LYS 30 10.147 -13.928 -5.842
256 H VAL 31 H VAL 31 4.344 -7.951 -4.815
257 HA VAL 31 HA VAL 31 3.961 -6.396 -2.341
258 HB VAL 31 HB VAL 31 2.681 -5.711 -5.025
259 HG11 VAL 31 HG11 VAL 31 2.332 -4.490 -2.254
260 HG12 VAL 31 HG12 VAL 31 1.648 -3.837 -3.761
261 HG13 VAL 31 HG13 VAL 31 1.113 -5.418 -3.159
262 HG21 VAL 31 HG21 VAL 31 3.829 -3.531 -4.744
263 HG22 VAL 31 HG22 VAL 31 4.638 -4.152 -3.286
264 HG23 VAL 31 HG23 VAL 31 4.987 -4.869 -4.877
265 H GLU 32 H GLU 32 1.950 -6.883 -1.338
266 HA GLU 32 HA GLU 32 0.115 -8.721 -2.717
267 HB2 GLU 32 HB2 GLU 32 1.741 -10.203 -1.562
268 HB3 GLU 32 HB3 GLU 32 1.388 -9.374 -0.026
269 HG2 GLU 32 HG2 GLU 32 -0.986 -10.033 -0.208
270 HG3 GLU 32 HG3 GLU 32 -0.661 -10.812 -1.768
271 H VAL 33 H VAL 33 -1.951 -8.016 -2.308
272 HA VAL 33 HA VAL 33 -2.326 -6.431 0.183
273 HB VAL 33 HB VAL 33 -3.738 -4.874 -1.061
274 HG11 VAL 33 HG11 VAL 33 -1.298 -4.427 -0.860
275 HG12 VAL 33 HG12 VAL 33 -1.032 -5.257 -2.411
276 HG13 VAL 33 HG13 VAL 33 -1.983 -3.755 -2.358
277 HG21 VAL 33 HG21 VAL 33 -2.894 -6.464 -3.522
278 HG22 VAL 33 HG22 VAL 33 -4.533 -6.409 -2.829
279 HG23 VAL 33 HG23 VAL 33 -3.815 -4.943 -3.530
280 H SER 34 H SER 34 -4.445 -6.403 1.030
281 HA SER 34 HA SER 34 -6.262 -8.529 0.013
282 HB2 SER 34 HB2 SER 34 -5.025 -9.332 1.997
283 HB3 SER 34 HB3 SER 34 -5.572 -7.910 2.912
284 HG SER 34 HG SER 34 -6.877 -9.809 3.206
285 H LEU 35 H LEU 35 -7.874 -7.353 -0.862
286 HA LEU 35 HA LEU 35 -8.408 -4.662 -0.179
287 HB2 LEU 35 HB2 LEU 35 -10.191 -6.689 -1.578
288 HB3 LEU 35 HB3 LEU 35 -10.325 -4.924 -1.694
289 HG LEU 35 HG LEU 35 -7.887 -6.540 -2.537
290 HD11 LEU 35 HD11 LEU 35 -8.607 -6.126 -4.851
291 HD12 LEU 35 HD12 LEU 35 -9.824 -7.067 -3.961
292 HD13 LEU 35 HD13 LEU 35 -10.087 -5.334 -4.261
293 HD21 LEU 35 HD21 LEU 35 -8.555 -3.705 -3.360
294 HD22 LEU 35 HD22 LEU 35 -7.627 -4.054 -1.872
295 HD23 LEU 35 HD23 LEU 35 -7.013 -4.558 -3.458
296 H GLU 36 H GLU 36 -9.605 -7.668 1.260
297 HA GLU 36 HA GLU 36 -11.899 -6.294 2.480
298 HB2 GLU 36 HB2 GLU 36 -10.691 -9.067 2.847
299 HB3 GLU 36 HB3 GLU 36 -12.126 -8.473 3.712
300 HG2 GLU 36 HG2 GLU 36 -13.237 -8.036 1.527
301 HG3 GLU 36 HG3 GLU 36 -11.839 -8.754 0.697
302 H LYS 37 H LYS 37 -8.670 -7.520 3.442
303 HA LYS 37 HA LYS 37 -9.095 -6.748 6.219
304 HB2 LYS 37 HB2 LYS 37 -6.619 -7.717 4.738
305 HB3 LYS 37 HB3 LYS 37 -6.794 -7.592 6.504
306 HG2 LYS 37 HG2 LYS 37 -8.641 -9.210 6.470
307 HG3 LYS 37 HG3 LYS 37 -8.580 -9.280 4.696
308 HD2 LYS 37 HD2 LYS 37 -6.262 -10.160 4.814
309 HD3 LYS 37 HD3 LYS 37 -6.363 -10.153 6.591
310 HE2 LYS 37 HE2 LYS 37 -8.262 -11.703 6.518
311 HE3 LYS 37 HE3 LYS 37 -8.281 -11.641 4.746
312 HZ1 LYS 37 HZ1 LYS 37 -7.179 -13.587 5.557
313 HZ2 LYS 37 HZ2 LYS 37 -6.118 -12.631 4.736
314 HZ3 LYS 37 HZ3 LYS 37 -6.077 -12.678 6.385
315 H GLY 38 H GLY 38 -8.180 -5.111 3.359
316 HA2 GLY 38 HA2 GLY 38 -7.434 -2.978 3.008
317 HA3 GLY 38 HA3 GLY 38 -7.712 -2.656 4.731
318 H GLU 39 H GLU 39 -5.600 -5.335 3.869
319 HA GLU 39 HA GLU 39 -3.327 -3.782 4.988
320 HB2 GLU 39 HB2 GLU 39 -3.752 -6.762 4.525
321 HB3 GLU 39 HB3 GLU 39 -2.292 -6.031 5.229
322 HG2 GLU 39 HG2 GLU 39 -3.655 -5.059 7.052
323 HG3 GLU 39 HG3 GLU 39 -5.108 -5.808 6.364
324 H ALA 40 H ALA 40 -1.244 -3.925 4.026
325 HA ALA 40 HA ALA 40 -1.050 -4.853 1.233
326 HB1 ALA 40 HB1 ALA 40 -1.204 -2.016 2.127
327 HB2 ALA 40 HB2 ALA 40 0.156 -2.407 1.023
328 HB3 ALA 40 HB3 ALA 40 -1.529 -2.722 0.546
329 H LEU 41 H LEU 41 0.601 -6.210 1.500
330 HA LEU 41 HA LEU 41 2.906 -5.432 3.215
331 HB2 LEU 41 HB2 LEU 41 2.141 -8.066 1.868
332 HB3 LEU 41 HB3 LEU 41 3.593 -7.794 2.831
333 HG LEU 41 HG LEU 41 2.091 -8.907 4.251
334 HD11 LEU 41 HD11 LEU 41 3.243 -6.951 5.274
335 HD12 LEU 41 HD12 LEU 41 1.811 -5.950 4.923
336 HD13 LEU 41 HD13 LEU 41 1.686 -7.323 6.047
337 HD21 LEU 41 HD21 LEU 41 -0.208 -8.262 4.655
338 HD22 LEU 41 HD22 LEU 41 -0.054 -6.853 3.589
339 HD23 LEU 41 HD23 LEU 41 0.039 -8.500 2.912
340 H VAL 42 H VAL 42 5.030 -5.426 2.329
341 HA VAL 42 HA VAL 42 5.230 -5.841 -0.589
342 HB VAL 42 HB VAL 42 6.598 -3.841 -0.854
343 HG11 VAL 42 HG11 VAL 42 4.843 -2.254 -0.915
344 HG12 VAL 42 HG12 VAL 42 4.056 -3.824 -1.098
345 HG13 VAL 42 HG13 VAL 42 4.001 -3.000 0.477
346 HG21 VAL 42 HG21 VAL 42 5.854 -3.203 2.032
347 HG22 VAL 42 HG22 VAL 42 7.467 -3.682 1.458
348 HG23 VAL 42 HG23 VAL 42 6.756 -2.147 0.918
349 H GLU 43 H GLU 43 7.501 -6.185 -1.267
350 HA GLU 43 HA GLU 43 9.338 -6.793 0.965
351 HB2 GLU 43 HB2 GLU 43 8.153 -8.894 0.360
352 HB3 GLU 43 HB3 GLU 43 8.765 -8.739 -1.303
353 HG2 GLU 43 HG2 GLU 43 11.076 -8.833 -0.488
354 HG3 GLU 43 HG3 GLU 43 10.513 -8.828 1.195
355 H GLY 44 H GLY 44 10.673 -5.103 0.514
356 HA2 GLY 44 HA2 GLY 44 12.319 -5.273 -1.855
357 HA3 GLY 44 HA3 GLY 44 11.218 -3.879 -1.883
358 H THR 45 H THR 45 13.597 -2.968 -1.921
359 HA THR 45 HA THR 45 14.587 -2.614 0.857
360 HB THR 45 HB THR 45 16.656 -1.828 -0.297
361 HG1 THR 45 HG1 THR 45 16.744 -2.190 -2.552
362 HG21 THR 45 HG21 THR 45 15.630 -4.548 -1.216
363 HG22 THR 45 HG22 THR 45 17.333 -4.043 -1.140
364 HG23 THR 45 HG23 THR 45 16.385 -4.199 0.357
365 H ALA 46 H ALA 46 12.188 -1.216 -0.362
366 HA ALA 46 HA ALA 46 13.066 1.493 -0.868
367 HB1 ALA 46 HB1 ALA 46 10.272 0.704 -0.032
368 HB2 ALA 46 HB2 ALA 46 10.793 1.978 -1.136
369 HB3 ALA 46 HB3 ALA 46 10.905 0.281 -1.657
370 H ASP 47 H ASP 47 12.067 3.336 0.537
371 HA ASP 47 HA ASP 47 12.791 2.767 3.340
372 HB2 ASP 47 HB2 ASP 47 12.170 5.342 1.842
373 HB3 ASP 47 HB3 ASP 47 12.612 5.259 3.556
374 HA PRO 48 HA PRO 48 8.759 2.567 4.997
375 HB2 PRO 48 HB2 PRO 48 9.660 4.756 6.872
376 HB3 PRO 48 HB3 PRO 48 8.827 3.216 7.269
377 HG2 PRO 48 HG2 PRO 48 11.493 3.440 7.656
378 HG3 PRO 48 HG3 PRO 48 10.827 1.960 6.882
379 HD2 PRO 48 HD2 PRO 48 12.137 4.341 5.557
380 HD3 PRO 48 HD3 PRO 48 12.352 2.594 5.221
381 H LYS 49 H LYS 49 9.931 6.007 4.910
382 HA LYS 49 HA LYS 49 7.266 7.065 4.686
383 HB2 LYS 49 HB2 LYS 49 9.998 8.256 4.055
384 HB3 LYS 49 HB3 LYS 49 8.474 9.166 4.058
385 HG2 LYS 49 HG2 LYS 49 8.116 8.528 6.439
386 HG3 LYS 49 HG3 LYS 49 9.704 7.720 6.440
387 HD2 LYS 49 HD2 LYS 49 10.808 9.845 5.875
388 HD3 LYS 49 HD3 LYS 49 9.230 10.656 5.761
389 HE2 LYS 49 HE2 LYS 49 8.800 10.151 8.147
390 HE3 LYS 49 HE3 LYS 49 10.392 9.371 8.265
391 HZ1 LYS 49 HZ1 LYS 49 9.917 12.189 7.575
392 HZ2 LYS 49 HZ2 LYS 49 10.430 11.630 9.038
393 HZ3 LYS 49 HZ3 LYS 49 11.391 11.465 7.708
394 H ALA 50 H ALA 50 9.712 5.987 2.317
395 HA ALA 50 HA ALA 50 8.562 7.315 0.082
396 HB1 ALA 50 HB1 ALA 50 10.831 6.338 0.093
397 HB2 ALA 50 HB2 ALA 50 10.131 4.706 0.220
398 HB3 ALA 50 HB3 ALA 50 9.857 5.681 -1.242
399 H LEU 51 H LEU 51 7.830 4.235 1.718
400 HA LEU 51 HA LEU 51 6.149 3.262 -0.392
401 HB2 LEU 51 HB2 LEU 51 7.349 1.994 1.556
402 HB3 LEU 51 HB3 LEU 51 5.926 2.456 2.514
403 HG LEU 51 HG LEU 51 4.536 1.476 0.553
404 HD11 LEU 51 HD11 LEU 51 5.724 -0.238 -0.791
405 HD12 LEU 51 HD12 LEU 51 6.444 1.363 -1.062
406 HD13 LEU 51 HD13 LEU 51 7.256 0.195 0.000
407 HD21 LEU 51 HD21 LEU 51 4.896 0.408 2.801
408 HD22 LEU 51 HD22 LEU 51 4.668 -0.765 1.478
409 HD23 LEU 51 HD23 LEU 51 6.295 -0.445 2.121
410 H VAL 52 H VAL 52 5.444 4.700 2.849
411 HA VAL 52 HA VAL 52 2.616 4.666 2.474
412 HB VAL 52 HB VAL 52 4.346 6.350 4.335
413 HG11 VAL 52 HG11 VAL 52 1.892 5.654 5.540
414 HG12 VAL 52 HG12 VAL 52 2.360 7.271 4.940
415 HG13 VAL 52 HG13 VAL 52 1.455 6.144 3.902
416 HG21 VAL 52 HG21 VAL 52 3.883 4.538 5.958
417 HG22 VAL 52 HG22 VAL 52 3.018 3.630 4.697
418 HG23 VAL 52 HG23 VAL 52 4.767 3.920 4.546
419 H GLN 53 H GLN 53 5.133 6.974 1.495
420 HA GLN 53 HA GLN 53 3.345 9.205 1.214
421 HB2 GLN 53 HB2 GLN 53 5.782 9.439 1.427
422 HB3 GLN 53 HB3 GLN 53 6.018 8.576 -0.109
423 HG2 GLN 53 HG2 GLN 53 4.830 10.352 -1.316
424 HG3 GLN 53 HG3 GLN 53 4.480 11.182 0.213
425 HE21 GLN 53 HE21 GLN 53 7.806 12.163 -1.717
426 HE22 GLN 53 HE22 GLN 53 6.370 11.461 -2.422
427 H ALA 54 H ALA 54 4.305 6.486 -0.865
428 HA ALA 54 HA ALA 54 3.373 7.545 -3.320
429 HB1 ALA 54 HB1 ALA 54 3.354 5.158 -4.025
430 HB2 ALA 54 HB2 ALA 54 4.853 5.626 -3.189
431 HB3 ALA 54 HB3 ALA 54 3.617 4.690 -2.323
432 H VAL 55 H VAL 55 1.685 5.449 -0.880
433 HA VAL 55 HA VAL 55 -0.759 5.444 -2.429
434 HB VAL 55 HB VAL 55 -1.732 4.559 -0.284
435 HG11 VAL 55 HG11 VAL 55 0.667 2.873 -0.728
436 HG12 VAL 55 HG12 VAL 55 -1.044 2.466 -0.774
437 HG13 VAL 55 HG13 VAL 55 -0.319 3.271 -2.180
438 HG21 VAL 55 HG21 VAL 55 -0.178 3.896 1.513
439 HG22 VAL 55 HG22 VAL 55 1.156 4.717 0.676
440 HG23 VAL 55 HG23 VAL 55 -0.211 5.662 1.316
441 H GLU 56 H GLU 56 0.685 7.625 -0.047
442 HA GLU 56 HA GLU 56 -1.758 8.802 0.837
443 HB2 GLU 56 HB2 GLU 56 0.356 9.030 2.049
444 HB3 GLU 56 HB3 GLU 56 1.085 9.885 0.674
445 HG2 GLU 56 HG2 GLU 56 -0.553 11.714 0.922
446 HG3 GLU 56 HG3 GLU 56 -1.315 10.855 2.276
447 H GLU 57 H GLU 57 0.391 9.402 -1.955
448 HA GLU 57 HA GLU 57 -0.912 11.853 -2.738
449 HB2 GLU 57 HB2 GLU 57 1.193 10.047 -3.731
450 HB3 GLU 57 HB3 GLU 57 0.200 10.747 -5.032
451 HG2 GLU 57 HG2 GLU 57 0.565 13.002 -4.176
452 HG3 GLU 57 HG3 GLU 57 1.452 12.360 -2.780
453 H GLU 58 H GLU 58 -1.657 8.451 -3.048
454 HA GLU 58 HA GLU 58 -3.529 8.829 -5.264
455 HB2 GLU 58 HB2 GLU 58 -2.955 6.526 -3.360
456 HB3 GLU 58 HB3 GLU 58 -4.128 6.438 -4.696
457 HG2 GLU 58 HG2 GLU 58 -1.194 7.136 -5.076
458 HG3 GLU 58 HG3 GLU 58 -1.871 5.500 -5.246
459 H GLY 59 H GLY 59 -3.530 9.550 -1.937
460 HA2 GLY 59 HA2 GLY 59 -5.343 10.679 -0.923
461 HA3 GLY 59 HA3 GLY 59 -6.467 9.878 -2.032
462 H TYR 60 H TYR 60 -4.104 7.716 -0.703
463 HA TYR 60 HA TYR 60 -6.125 6.806 1.291
464 HB2 TYR 60 HB2 TYR 60 -4.335 5.086 -0.450
465 HB3 TYR 60 HB3 TYR 60 -5.565 4.523 0.687
466 HD1 TYR 60 HD1 TYR 60 -4.865 5.413 -2.689
467 HD2 TYR 60 HD2 TYR 60 -8.018 5.286 0.226
468 HE1 TYR 60 HE1 TYR 60 -6.545 5.462 -4.516
469 HE2 TYR 60 HE2 TYR 60 -9.706 5.325 -1.588
470 HH TYR 60 HH TYR 60 -10.068 5.445 -3.853
471 H LYS 61 H LYS 61 -5.306 7.151 3.281
472 HA LYS 61 HA LYS 61 -2.507 7.321 3.874
473 HB2 LYS 61 HB2 LYS 61 -4.883 6.646 5.664
474 HB3 LYS 61 HB3 LYS 61 -3.281 7.156 6.229
475 HG2 LYS 61 HG2 LYS 61 -3.554 9.343 5.172
476 HG3 LYS 61 HG3 LYS 61 -5.094 8.830 4.440
477 HD2 LYS 61 HD2 LYS 61 -6.045 8.460 6.696
478 HD3 LYS 61 HD3 LYS 61 -4.522 9.018 7.429
479 HE2 LYS 61 HE2 LYS 61 -4.809 11.229 6.351
480 HE3 LYS 61 HE3 LYS 61 -6.285 10.643 5.560
481 HZ1 LYS 61 HZ1 LYS 61 -5.854 11.162 8.399
482 HZ2 LYS 61 HZ2 LYS 61 -6.988 11.787 7.400
483 HZ3 LYS 61 HZ3 LYS 61 -7.107 10.210 7.866
484 H ALA 62 H ALA 62 -1.369 5.717 5.386
485 HA ALA 62 HA ALA 62 -2.422 3.010 5.438
486 HB1 ALA 62 HB1 ALA 62 -1.591 3.151 3.110
487 HB2 ALA 62 HB2 ALA 62 0.012 3.632 3.718
488 HB3 ALA 62 HB3 ALA 62 -0.637 2.015 4.085
489 H GLU 63 H GLU 63 -2.080 3.617 7.737
490 HA GLU 63 HA GLU 63 0.594 4.123 8.705
491 HB2 GLU 63 HB2 GLU 63 -1.940 3.125 10.072
492 HB3 GLU 63 HB3 GLU 63 -0.454 3.612 10.917
493 HG2 GLU 63 HG2 GLU 63 -0.626 5.872 9.953
494 HG3 GLU 63 HG3 GLU 63 -2.116 5.405 9.103
495 H VAL 64 H VAL 64 2.214 2.689 9.092
496 HA VAL 64 HA VAL 64 1.990 -0.081 8.486
497 HB VAL 64 HB VAL 64 4.213 -0.216 9.602
498 HG11 VAL 64 HG11 VAL 64 4.036 0.492 7.254
499 HG12 VAL 64 HG12 VAL 64 3.831 2.184 7.765
500 HG13 VAL 64 HG13 VAL 64 5.367 1.342 8.070
501 HG21 VAL 64 HG21 VAL 64 3.719 2.727 10.233
502 HG22 VAL 64 HG22 VAL 64 3.848 1.411 11.424
503 HG23 VAL 64 HG23 VAL 64 5.258 1.864 10.445
504 H LEU 65 H LEU 65 1.454 -1.827 9.732
505 HA LEU 65 HA LEU 65 0.733 -1.273 12.570
506 HB2 LEU 65 HB2 LEU 65 -0.277 -3.422 10.672
507 HB3 LEU 65 HB3 LEU 65 -0.707 -3.285 12.388
508 HG LEU 65 HG LEU 65 -1.275 -1.199 10.240
509 HD11 LEU 65 HD11 LEU 65 -3.083 -3.085 11.810
510 HD12 LEU 65 HD12 LEU 65 -3.633 -1.836 10.671
511 HD13 LEU 65 HD13 LEU 65 -2.684 -3.222 10.082
512 HD21 LEU 65 HD21 LEU 65 -0.881 -0.135 12.426
513 HD22 LEU 65 HD22 LEU 65 -2.613 -0.110 12.041
514 HD23 LEU 65 HD23 LEU 65 -1.981 -1.298 13.206
515 H ALA 66 H ALA 66 3.297 -1.444 12.523
516 HA ALA 66 HA ALA 66 3.919 -4.260 13.268
517 HB1 ALA 66 HB1 ALA 66 5.393 -2.410 11.378
518 HB2 ALA 66 HB2 ALA 66 6.261 -3.688 12.289
519 HB3 ALA 66 HB3 ALA 66 4.952 -4.105 11.158
Start of MODEL 20
1 H1 MET 1 H MET 1 9.297 -3.543 10.851
2 HA MET 1 HA MET 1 9.757 -4.106 7.982
3 HB2 MET 1 HB2 MET 1 9.496 -6.098 9.525
4 HB3 MET 1 HB3 MET 1 7.827 -5.561 9.818
5 HG2 MET 1 HG2 MET 1 7.346 -5.753 7.410
6 HG3 MET 1 HG3 MET 1 9.039 -6.159 7.092
7 HE1 MET 1 HE1 MET 1 6.855 -7.842 5.857
8 HE2 MET 1 HE2 MET 1 8.570 -8.302 5.759
9 HE3 MET 1 HE3 MET 1 7.351 -9.511 6.228
10 H LEU 2 H LEU 2 7.655 -4.000 6.663
11 HA LEU 2 HA LEU 2 6.088 -1.685 7.684
12 HB2 LEU 2 HB2 LEU 2 6.531 -2.606 4.821
13 HB3 LEU 2 HB3 LEU 2 5.727 -1.113 5.347
14 HG LEU 2 HG LEU 2 8.654 -1.853 5.800
15 HD11 LEU 2 HD11 LEU 2 7.350 0.294 4.079
16 HD12 LEU 2 HD12 LEU 2 9.098 0.025 4.274
17 HD13 LEU 2 HD13 LEU 2 8.094 -1.208 3.477
18 HD21 LEU 2 HD21 LEU 2 7.799 -0.526 7.687
19 HD22 LEU 2 HD22 LEU 2 8.860 0.468 6.669
20 HD23 LEU 2 HD23 LEU 2 7.095 0.654 6.558
21 H LYS 3 H LYS 3 3.766 -1.652 7.251
22 HA LYS 3 HA LYS 3 2.487 -4.116 6.396
23 HB2 LYS 3 HB2 LYS 3 3.424 -4.250 8.903
24 HB3 LYS 3 HB3 LYS 3 1.918 -3.390 9.267
25 HG2 LYS 3 HG2 LYS 3 0.631 -5.197 8.168
26 HG3 LYS 3 HG3 LYS 3 2.155 -5.981 7.683
27 HD2 LYS 3 HD2 LYS 3 2.790 -6.128 10.109
28 HD3 LYS 3 HD3 LYS 3 1.154 -5.567 10.524
29 HE2 LYS 3 HE2 LYS 3 0.182 -7.496 9.339
30 HE3 LYS 3 HE3 LYS 3 1.800 -8.008 8.816
31 HZ1 LYS 3 HZ1 LYS 3 2.375 -8.279 11.132
32 HZ2 LYS 3 HZ2 LYS 3 0.839 -7.879 11.585
33 HZ3 LYS 3 HZ3 LYS 3 1.110 -9.245 10.702
34 H LEU 4 H LEU 4 1.548 -2.428 4.932
35 HA LEU 4 HA LEU 4 0.507 -0.015 6.194
36 HB2 LEU 4 HB2 LEU 4 0.931 -1.070 3.421
37 HB3 LEU 4 HB3 LEU 4 -0.333 0.151 3.645
38 HG LEU 4 HG LEU 4 1.274 1.643 4.791
39 HD11 LEU 4 HD11 LEU 4 3.688 1.111 4.696
40 HD12 LEU 4 HD12 LEU 4 2.806 -0.081 5.674
41 HD13 LEU 4 HD13 LEU 4 3.308 -0.491 4.018
42 HD21 LEU 4 HD21 LEU 4 0.921 1.824 2.348
43 HD22 LEU 4 HD22 LEU 4 2.595 2.228 2.788
44 HD23 LEU 4 HD23 LEU 4 2.222 0.642 2.073
45 H LYS 5 H LYS 5 -1.437 0.265 7.014
46 HA LYS 5 HA LYS 5 -3.641 -1.539 6.182
47 HB2 LYS 5 HB2 LYS 5 -3.067 -1.360 8.592
48 HB3 LYS 5 HB3 LYS 5 -3.464 0.367 8.560
49 HG2 LYS 5 HG2 LYS 5 -5.543 -1.477 7.448
50 HG3 LYS 5 HG3 LYS 5 -5.223 -1.636 9.185
51 HD2 LYS 5 HD2 LYS 5 -5.564 0.804 9.481
52 HD3 LYS 5 HD3 LYS 5 -5.989 0.937 7.756
53 HE2 LYS 5 HE2 LYS 5 -7.841 -0.620 8.061
54 HE3 LYS 5 HE3 LYS 5 -7.422 -0.861 9.768
55 HZ1 LYS 5 HZ1 LYS 5 -9.208 0.847 9.029
56 HZ2 LYS 5 HZ2 LYS 5 -8.193 1.197 10.295
57 HZ3 LYS 5 HZ3 LYS 5 -7.925 1.829 8.798
58 H VAL 6 H VAL 6 -4.273 -0.619 4.235
59 HA VAL 6 HA VAL 6 -4.219 2.179 3.722
60 HB VAL 6 HB VAL 6 -5.768 -0.031 2.312
61 HG11 VAL 6 HG11 VAL 6 -4.716 2.679 1.384
62 HG12 VAL 6 HG12 VAL 6 -5.510 1.469 0.347
63 HG13 VAL 6 HG13 VAL 6 -6.427 2.264 1.645
64 HG21 VAL 6 HG21 VAL 6 -3.368 -0.583 2.533
65 HG22 VAL 6 HG22 VAL 6 -3.755 -0.141 0.855
66 HG23 VAL 6 HG23 VAL 6 -2.937 1.031 1.917
67 H GLU 7 H GLU 7 -5.650 3.755 4.024
68 HA GLU 7 HA GLU 7 -8.129 3.266 5.478
69 HB2 GLU 7 HB2 GLU 7 -6.641 5.231 5.893
70 HB3 GLU 7 HB3 GLU 7 -6.953 5.792 4.238
71 HG2 GLU 7 HG2 GLU 7 -8.400 6.989 5.794
72 HG3 GLU 7 HG3 GLU 7 -9.387 5.933 4.772
73 H GLY 8 H GLY 8 -10.226 3.517 4.676
74 HA2 GLY 8 HA2 GLY 8 -10.506 3.432 1.730
75 HA3 GLY 8 HA3 GLY 8 -11.719 2.950 2.934
76 H MET 9 H MET 9 -9.822 5.905 2.025
77 HA MET 9 HA MET 9 -11.727 7.697 3.172
78 HB2 MET 9 HB2 MET 9 -9.589 8.124 1.047
79 HB3 MET 9 HB3 MET 9 -10.450 9.416 1.910
80 HG2 MET 9 HG2 MET 9 -9.592 8.545 4.062
81 HG3 MET 9 HG3 MET 9 -8.735 7.263 3.194
82 HE1 MET 9 HE1 MET 9 -7.712 11.773 3.009
83 HE2 MET 9 HE2 MET 9 -9.188 11.099 2.284
84 HE3 MET 9 HE3 MET 9 -8.962 11.050 4.049
85 H THR 10 H THR 10 -11.339 6.370 -0.145
86 HA THR 10 HA THR 10 -13.929 7.652 -0.836
87 HB THR 10 HB THR 10 -12.970 8.217 -3.063
88 HG1 THR 10 HG1 THR 10 -10.653 8.158 -3.176
89 HG21 THR 10 HG21 THR 10 -13.020 9.922 -1.255
90 HG22 THR 10 HG22 THR 10 -11.404 9.394 -0.726
91 HG23 THR 10 HG23 THR 10 -11.617 10.134 -2.327
92 H CYS 11 H CYS 11 -14.816 6.724 -2.909
93 HA CYS 11 HA CYS 11 -15.713 4.888 -3.909
94 HB2 CYS 11 HB2 CYS 11 -12.767 4.189 -4.163
95 HB3 CYS 11 HB3 CYS 11 -14.087 3.610 -5.207
96 HG CYS 11 HG CYS 11 -14.893 5.987 -5.945
97 H ASN 12 H ASN 12 -16.044 4.520 -1.235
98 HA ASN 12 HA ASN 12 -14.745 2.195 -0.214
99 HB2 ASN 12 HB2 ASN 12 -16.410 2.317 1.557
100 HB3 ASN 12 HB3 ASN 12 -15.819 3.943 1.174
101 HD21 ASN 12 HD21 ASN 12 -19.761 3.143 1.022
102 HD22 ASN 12 HD22 ASN 12 -18.562 2.122 1.783
103 H HIS 13 H HIS 13 -17.241 2.492 -2.617
104 HA HIS 13 HA HIS 13 -18.205 -0.251 -2.019
105 HB2 HIS 13 HB2 HIS 13 -19.125 1.827 -4.031
106 HB3 HIS 13 HB3 HIS 13 -19.796 0.198 -3.886
107 HD1 HIS 13 HD1 HIS 13 -21.558 -0.188 -1.962
108 HD2 HIS 13 HD2 HIS 13 -19.565 3.518 -1.888
109 HE1 HIS 13 HE1 HIS 13 -22.743 1.248 -0.209
110 H CYS 14 H CYS 14 -16.756 1.671 -4.708
111 HA CYS 14 HA CYS 14 -16.097 -0.855 -6.105
112 HB2 CYS 14 HB2 CYS 14 -15.828 2.066 -6.932
113 HB3 CYS 14 HB3 CYS 14 -15.520 0.653 -7.972
114 HG CYS 14 HG CYS 14 -17.801 1.738 -8.583
115 H VAL 15 H VAL 15 -14.062 -1.699 -6.040
116 HA VAL 15 HA VAL 15 -12.003 -0.015 -4.735
117 HB VAL 15 HB VAL 15 -12.691 -2.111 -3.619
118 HG11 VAL 15 HG11 VAL 15 -11.505 -3.459 -6.081
119 HG12 VAL 15 HG12 VAL 15 -12.050 -4.280 -4.600
120 HG13 VAL 15 HG13 VAL 15 -13.227 -3.438 -5.631
121 HG21 VAL 15 HG21 VAL 15 -10.454 -2.952 -3.182
122 HG22 VAL 15 HG22 VAL 15 -9.842 -2.223 -4.684
123 HG23 VAL 15 HG23 VAL 15 -10.397 -1.187 -3.346
124 H MET 16 H MET 16 -9.790 -0.139 -5.480
125 HA MET 16 HA MET 16 -9.524 -0.850 -8.357
126 HB2 MET 16 HB2 MET 16 -8.457 1.648 -6.960
127 HB3 MET 16 HB3 MET 16 -8.159 1.168 -8.643
128 HG2 MET 16 HG2 MET 16 -9.907 2.632 -8.924
129 HG3 MET 16 HG3 MET 16 -10.775 1.097 -8.820
130 HE1 MET 16 HE1 MET 16 -13.386 2.507 -7.747
131 HE2 MET 16 HE2 MET 16 -12.786 4.145 -7.445
132 HE3 MET 16 HE3 MET 16 -12.238 3.266 -8.890
133 H ALA 17 H ALA 17 -7.215 -1.159 -8.992
134 HA ALA 17 HA ALA 17 -5.887 -2.863 -7.102
135 HB1 ALA 17 HB1 ALA 17 -5.783 -3.199 -9.543
136 HB2 ALA 17 HB2 ALA 17 -4.940 -1.642 -9.728
137 HB3 ALA 17 HB3 ALA 17 -4.152 -2.982 -8.863
138 H VAL 18 H VAL 18 -5.441 -1.608 -5.222
139 HA VAL 18 HA VAL 18 -3.992 0.864 -5.349
140 HB VAL 18 HB VAL 18 -4.191 -1.162 -3.078
141 HG11 VAL 18 HG11 VAL 18 -3.906 0.936 -1.686
142 HG12 VAL 18 HG12 VAL 18 -2.461 0.490 -2.627
143 HG13 VAL 18 HG13 VAL 18 -3.520 1.810 -3.180
144 HG21 VAL 18 HG21 VAL 18 -5.951 1.220 -3.803
145 HG22 VAL 18 HG22 VAL 18 -6.420 -0.496 -3.878
146 HG23 VAL 18 HG23 VAL 18 -6.077 0.262 -2.310
147 H THR 19 H THR 19 -3.110 -2.427 -5.836
148 HA THR 19 HA THR 19 -0.521 -2.598 -4.867
149 HB THR 19 HB THR 19 -1.614 -3.664 -7.499
150 HG1 THR 19 HG1 THR 19 -2.094 -5.478 -6.129
151 HG21 THR 19 HG21 THR 19 0.017 -5.487 -7.128
152 HG22 THR 19 HG22 THR 19 0.838 -3.915 -7.257
153 HG23 THR 19 HG23 THR 19 0.602 -4.669 -5.662
154 H LYS 20 H LYS 20 -1.712 -0.945 -7.817
155 HA LYS 20 HA LYS 20 0.790 -0.543 -9.062
156 HB2 LYS 20 HB2 LYS 20 -1.719 1.182 -9.013
157 HB3 LYS 20 HB3 LYS 20 -0.355 1.416 -10.124
158 HG2 LYS 20 HG2 LYS 20 -0.688 -0.855 -11.034
159 HG3 LYS 20 HG3 LYS 20 -2.074 -1.095 -9.938
160 HD2 LYS 20 HD2 LYS 20 -3.245 0.803 -10.960
161 HD3 LYS 20 HD3 LYS 20 -1.836 1.152 -11.987
162 HE2 LYS 20 HE2 LYS 20 -2.067 -1.048 -13.074
163 HE3 LYS 20 HE3 LYS 20 -3.469 -1.417 -12.048
164 HZ1 LYS 20 HZ1 LYS 20 -4.101 -0.596 -14.208
165 HZ2 LYS 20 HZ2 LYS 20 -4.608 0.420 -13.018
166 HZ3 LYS 20 HZ3 LYS 20 -3.302 0.826 -13.941
167 H ALA 21 H ALA 21 -0.723 1.126 -6.297
168 HA ALA 21 HA ALA 21 1.034 3.416 -6.484
169 HB1 ALA 21 HB1 ALA 21 -0.666 2.395 -4.172
170 HB2 ALA 21 HB2 ALA 21 0.028 4.027 -4.339
171 HB3 ALA 21 HB3 ALA 21 -1.233 3.476 -5.466
172 H LEU 22 H LEU 22 1.233 0.205 -5.036
173 HA LEU 22 HA LEU 22 3.386 0.966 -3.193
174 HB2 LEU 22 HB2 LEU 22 2.131 -1.663 -4.095
175 HB3 LEU 22 HB3 LEU 22 3.548 -1.594 -3.044
176 HG LEU 22 HG LEU 22 1.624 -1.917 -1.675
177 HD11 LEU 22 HD11 LEU 22 3.436 -0.325 -0.903
178 HD12 LEU 22 HD12 LEU 22 2.375 1.010 -1.402
179 HD13 LEU 22 HD13 LEU 22 1.849 -0.100 -0.121
180 HD21 LEU 22 HD21 LEU 22 0.470 0.641 -2.848
181 HD22 LEU 22 HD22 LEU 22 -0.075 -1.011 -3.231
182 HD23 LEU 22 HD23 LEU 22 -0.257 -0.372 -1.584
183 H LYS 23 H LYS 23 2.945 -0.627 -6.343
184 HA LYS 23 HA LYS 23 5.569 -1.626 -6.558
185 HB2 LYS 23 HB2 LYS 23 3.404 -2.297 -7.734
186 HB3 LYS 23 HB3 LYS 23 3.746 -0.993 -8.893
187 HG2 LYS 23 HG2 LYS 23 5.870 -2.046 -9.496
188 HG3 LYS 23 HG3 LYS 23 5.708 -3.208 -8.155
189 HD2 LYS 23 HD2 LYS 23 3.601 -4.062 -9.200
190 HD3 LYS 23 HD3 LYS 23 3.911 -3.019 -10.607
191 HE2 LYS 23 HE2 LYS 23 6.018 -4.157 -11.032
192 HE3 LYS 23 HE3 LYS 23 5.860 -5.122 -9.551
193 HZ1 LYS 23 HZ1 LYS 23 5.124 -6.024 -11.859
194 HZ2 LYS 23 HZ2 LYS 23 4.263 -6.401 -10.487
195 HZ3 LYS 23 HZ3 LYS 23 3.739 -5.230 -11.522
196 H LYS 24 H LYS 24 4.394 1.644 -7.171
197 HA LYS 24 HA LYS 24 6.425 2.288 -9.126
198 HB2 LYS 24 HB2 LYS 24 4.682 3.984 -7.299
199 HB3 LYS 24 HB3 LYS 24 5.809 4.660 -8.490
200 HG2 LYS 24 HG2 LYS 24 4.633 3.487 -10.310
201 HG3 LYS 24 HG3 LYS 24 3.485 2.806 -9.132
202 HD2 LYS 24 HD2 LYS 24 2.837 5.105 -8.452
203 HD3 LYS 24 HD3 LYS 24 3.970 5.774 -9.648
204 HE2 LYS 24 HE2 LYS 24 2.719 4.636 -11.460
205 HE3 LYS 24 HE3 LYS 24 1.588 3.978 -10.258
206 HZ1 LYS 24 HZ1 LYS 24 1.009 6.233 -9.680
207 HZ2 LYS 24 HZ2 LYS 24 2.029 6.827 -10.830
208 HZ3 LYS 24 HZ3 LYS 24 0.714 5.936 -11.274
209 H VAL 25 H VAL 25 6.493 1.921 -5.647
210 HA VAL 25 HA VAL 25 8.559 3.888 -5.208
211 HB VAL 25 HB VAL 25 7.461 1.572 -3.580
212 HG11 VAL 25 HG11 VAL 25 8.663 2.571 -1.664
213 HG12 VAL 25 HG12 VAL 25 9.794 1.995 -2.910
214 HG13 VAL 25 HG13 VAL 25 9.445 3.734 -2.761
215 HG21 VAL 25 HG21 VAL 25 6.432 3.430 -2.298
216 HG22 VAL 25 HG22 VAL 25 7.166 4.603 -3.414
217 HG23 VAL 25 HG23 VAL 25 5.930 3.465 -4.002
218 HA PRO 26 HA PRO 26 11.955 1.601 -6.891
219 HB2 PRO 26 HB2 PRO 26 13.390 3.197 -4.768
220 HB3 PRO 26 HB3 PRO 26 13.865 2.934 -6.480
221 HG2 PRO 26 HG2 PRO 26 12.713 5.267 -5.756
222 HG3 PRO 26 HG3 PRO 26 12.157 4.430 -7.248
223 HD2 PRO 26 HD2 PRO 26 10.873 4.433 -4.509
224 HD3 PRO 26 HD3 PRO 26 10.105 4.600 -6.121
225 H GLY 27 H GLY 27 13.000 -0.297 -6.367
226 HA2 GLY 27 HA2 GLY 27 14.085 -1.834 -4.986
227 HA3 GLY 27 HA3 GLY 27 13.501 -0.970 -3.551
228 H VAL 28 H VAL 28 10.683 -0.950 -4.880
229 HA VAL 28 HA VAL 28 9.828 -3.445 -3.648
230 HB VAL 28 HB VAL 28 8.370 -1.262 -5.191
231 HG11 VAL 28 HG11 VAL 28 7.183 -3.397 -5.443
232 HG12 VAL 28 HG12 VAL 28 7.260 -3.661 -3.685
233 HG13 VAL 28 HG13 VAL 28 6.299 -2.316 -4.344
234 HG21 VAL 28 HG21 VAL 28 8.493 -1.982 -2.230
235 HG22 VAL 28 HG22 VAL 28 9.260 -0.570 -2.998
236 HG23 VAL 28 HG23 VAL 28 7.488 -0.696 -2.940
237 H GLU 29 H GLU 29 9.994 -5.358 -4.693
238 HA GLU 29 HA GLU 29 9.598 -5.325 -7.645
239 HB2 GLU 29 HB2 GLU 29 11.906 -5.923 -6.918
240 HB3 GLU 29 HB3 GLU 29 11.234 -7.310 -6.031
241 HG2 GLU 29 HG2 GLU 29 10.301 -8.217 -8.114
242 HG3 GLU 29 HG3 GLU 29 10.866 -6.796 -9.013
243 H LYS 30 H LYS 30 8.628 -6.618 -4.530
244 HA LYS 30 HA LYS 30 6.472 -8.112 -5.942
245 HB2 LYS 30 HB2 LYS 30 8.030 -8.928 -3.458
246 HB3 LYS 30 HB3 LYS 30 6.529 -9.702 -4.002
247 HG2 LYS 30 HG2 LYS 30 7.609 -10.258 -6.170
248 HG3 LYS 30 HG3 LYS 30 9.133 -9.553 -5.577
249 HD2 LYS 30 HD2 LYS 30 9.177 -11.164 -3.717
250 HD3 LYS 30 HD3 LYS 30 7.614 -11.834 -4.238
251 HE2 LYS 30 HE2 LYS 30 8.633 -12.497 -6.412
252 HE3 LYS 30 HE3 LYS 30 10.182 -11.826 -5.861
253 HZ1 LYS 30 HZ1 LYS 30 10.536 -13.842 -5.108
254 HZ2 LYS 30 HZ2 LYS 30 9.527 -13.461 -3.878
255 HZ3 LYS 30 HZ3 LYS 30 8.937 -14.297 -5.169
256 H VAL 31 H VAL 31 4.443 -8.050 -4.916
257 HA VAL 31 HA VAL 31 4.138 -6.400 -2.496
258 HB VAL 31 HB VAL 31 2.745 -5.808 -5.147
259 HG11 VAL 31 HG11 VAL 31 2.505 -4.508 -2.401
260 HG12 VAL 31 HG12 VAL 31 1.752 -3.903 -3.894
261 HG13 VAL 31 HG13 VAL 31 1.257 -5.471 -3.226
262 HG21 VAL 31 HG21 VAL 31 3.884 -3.608 -4.976
263 HG22 VAL 31 HG22 VAL 31 4.767 -4.189 -3.544
264 HG23 VAL 31 HG23 VAL 31 5.043 -4.944 -5.132
265 H GLU 32 H GLU 32 2.193 -6.922 -1.384
266 HA GLU 32 HA GLU 32 0.342 -8.806 -2.682
267 HB2 GLU 32 HB2 GLU 32 2.115 -10.199 -1.575
268 HB3 GLU 32 HB3 GLU 32 1.707 -9.421 -0.027
269 HG2 GLU 32 HG2 GLU 32 -0.651 -10.197 -0.304
270 HG3 GLU 32 HG3 GLU 32 -0.183 -11.039 -1.792
271 H VAL 33 H VAL 33 -1.673 -7.995 -2.284
272 HA VAL 33 HA VAL 33 -2.066 -6.610 0.319
273 HB VAL 33 HB VAL 33 -3.324 -4.864 -0.791
274 HG11 VAL 33 HG11 VAL 33 -0.846 -4.596 -0.621
275 HG12 VAL 33 HG12 VAL 33 -0.678 -5.302 -2.242
276 HG13 VAL 33 HG13 VAL 33 -1.527 -3.755 -2.032
277 HG21 VAL 33 HG21 VAL 33 -2.639 -6.312 -3.386
278 HG22 VAL 33 HG22 VAL 33 -4.255 -6.189 -2.653
279 HG23 VAL 33 HG23 VAL 33 -3.439 -4.729 -3.254
280 H SER 34 H SER 34 -4.280 -6.531 1.065
281 HA SER 34 HA SER 34 -6.068 -8.495 -0.260
282 HB2 SER 34 HB2 SER 34 -5.000 -9.584 1.680
283 HB3 SER 34 HB3 SER 34 -5.567 -8.266 2.733
284 HG SER 34 HG SER 34 -6.968 -10.139 2.657
285 H LEU 35 H LEU 35 -7.581 -7.169 -1.091
286 HA LEU 35 HA LEU 35 -8.209 -4.603 -0.043
287 HB2 LEU 35 HB2 LEU 35 -9.843 -6.417 -1.858
288 HB3 LEU 35 HB3 LEU 35 -10.028 -4.660 -1.698
289 HG LEU 35 HG LEU 35 -7.504 -6.064 -2.659
290 HD11 LEU 35 HD11 LEU 35 -8.128 -5.253 -4.904
291 HD12 LEU 35 HD12 LEU 35 -9.351 -6.369 -4.257
292 HD13 LEU 35 HD13 LEU 35 -9.658 -4.619 -4.253
293 HD21 LEU 35 HD21 LEU 35 -8.218 -3.143 -3.018
294 HD22 LEU 35 HD22 LEU 35 -7.350 -3.722 -1.565
295 HD23 LEU 35 HD23 LEU 35 -6.647 -3.929 -3.184
296 H GLU 36 H GLU 36 -9.243 -7.789 0.914
297 HA GLU 36 HA GLU 36 -11.764 -6.859 2.086
298 HB2 GLU 36 HB2 GLU 36 -10.229 -9.482 2.228
299 HB3 GLU 36 HB3 GLU 36 -11.815 -9.197 2.980
300 HG2 GLU 36 HG2 GLU 36 -12.764 -8.634 0.762
301 HG3 GLU 36 HG3 GLU 36 -11.190 -8.956 0.009
302 H LYS 37 H LYS 37 -8.397 -7.385 3.073
303 HA LYS 37 HA LYS 37 -9.182 -7.103 5.919
304 HB2 LYS 37 HB2 LYS 37 -6.544 -7.905 4.632
305 HB3 LYS 37 HB3 LYS 37 -6.889 -7.881 6.377
306 HG2 LYS 37 HG2 LYS 37 -8.712 -9.523 6.044
307 HG3 LYS 37 HG3 LYS 37 -8.375 -9.550 4.299
308 HD2 LYS 37 HD2 LYS 37 -6.078 -10.363 4.758
309 HD3 LYS 37 HD3 LYS 37 -6.435 -10.359 6.503
310 HE2 LYS 37 HE2 LYS 37 -8.300 -11.951 6.109
311 HE3 LYS 37 HE3 LYS 37 -7.911 -11.972 4.378
312 HZ1 LYS 37 HZ1 LYS 37 -6.954 -13.822 5.537
313 HZ2 LYS 37 HZ2 LYS 37 -5.769 -12.858 4.926
314 HZ3 LYS 37 HZ3 LYS 37 -6.112 -12.818 6.540
315 H GLY 38 H GLY 38 -8.098 -5.220 3.292
316 HA2 GLY 38 HA2 GLY 38 -7.434 -3.033 3.183
317 HA3 GLY 38 HA3 GLY 38 -7.801 -2.886 4.914
318 H GLU 39 H GLU 39 -5.572 -5.428 3.996
319 HA GLU 39 HA GLU 39 -3.343 -3.816 5.146
320 HB2 GLU 39 HB2 GLU 39 -3.676 -6.807 4.666
321 HB3 GLU 39 HB3 GLU 39 -2.239 -6.034 5.369
322 HG2 GLU 39 HG2 GLU 39 -3.663 -5.137 7.216
323 HG3 GLU 39 HG3 GLU 39 -5.052 -6.009 6.537
324 H ALA 40 H ALA 40 -1.306 -3.830 4.118
325 HA ALA 40 HA ALA 40 -1.134 -4.789 1.335
326 HB1 ALA 40 HB1 ALA 40 -1.414 -1.954 2.208
327 HB2 ALA 40 HB2 ALA 40 -0.064 -2.283 1.072
328 HB3 ALA 40 HB3 ALA 40 -1.741 -2.692 0.641
329 H LEU 41 H LEU 41 0.708 -5.859 1.261
330 HA LEU 41 HA LEU 41 2.945 -5.007 3.039
331 HB2 LEU 41 HB2 LEU 41 2.284 -7.768 1.923
332 HB3 LEU 41 HB3 LEU 41 3.656 -7.356 2.950
333 HG LEU 41 HG LEU 41 2.109 -8.388 4.373
334 HD11 LEU 41 HD11 LEU 41 3.051 -6.304 5.316
335 HD12 LEU 41 HD12 LEU 41 1.645 -5.398 4.706
336 HD13 LEU 41 HD13 LEU 41 1.422 -6.648 5.946
337 HD21 LEU 41 HD21 LEU 41 -0.241 -7.883 4.539
338 HD22 LEU 41 HD22 LEU 41 -0.099 -6.555 3.373
339 HD23 LEU 41 HD23 LEU 41 0.153 -8.235 2.842
340 H VAL 42 H VAL 42 5.071 -5.130 2.155
341 HA VAL 42 HA VAL 42 5.248 -5.704 -0.743
342 HB VAL 42 HB VAL 42 6.783 -3.791 -1.027
343 HG11 VAL 42 HG11 VAL 42 5.092 -2.161 -1.314
344 HG12 VAL 42 HG12 VAL 42 4.269 -3.718 -1.465
345 HG13 VAL 42 HG13 VAL 42 4.126 -2.800 0.050
346 HG21 VAL 42 HG21 VAL 42 5.839 -2.965 1.752
347 HG22 VAL 42 HG22 VAL 42 7.481 -3.510 1.332
348 HG23 VAL 42 HG23 VAL 42 6.848 -1.994 0.656
349 H GLU 43 H GLU 43 7.540 -6.211 -1.383
350 HA GLU 43 HA GLU 43 9.241 -6.864 0.944
351 HB2 GLU 43 HB2 GLU 43 7.813 -8.840 0.239
352 HB3 GLU 43 HB3 GLU 43 8.738 -8.869 -1.279
353 HG2 GLU 43 HG2 GLU 43 10.829 -9.141 0.012
354 HG3 GLU 43 HG3 GLU 43 9.927 -8.986 1.532
355 H GLY 44 H GLY 44 10.480 -5.047 0.334
356 HA2 GLY 44 HA2 GLY 44 12.377 -5.577 -1.816
357 HA3 GLY 44 HA3 GLY 44 11.327 -4.166 -2.073
358 H THR 45 H THR 45 13.765 -3.360 -2.000
359 HA THR 45 HA THR 45 14.702 -2.885 0.750
360 HB THR 45 HB THR 45 16.677 -1.940 -0.449
361 HG1 THR 45 HG1 THR 45 16.697 -2.193 -2.717
362 HG21 THR 45 HG21 THR 45 15.781 -4.677 -1.449
363 HG22 THR 45 HG22 THR 45 17.454 -4.076 -1.396
364 HG23 THR 45 HG23 THR 45 16.562 -4.351 0.116
365 H ALA 46 H ALA 46 12.184 -1.601 -0.306
366 HA ALA 46 HA ALA 46 12.848 1.153 -0.835
367 HB1 ALA 46 HB1 ALA 46 10.174 0.185 0.193
368 HB2 ALA 46 HB2 ALA 46 10.533 1.489 -0.940
369 HB3 ALA 46 HB3 ALA 46 10.721 -0.199 -1.472
370 H ASP 47 H ASP 47 11.713 2.909 0.614
371 HA ASP 47 HA ASP 47 12.590 2.389 3.407
372 HB2 ASP 47 HB2 ASP 47 12.257 4.961 1.818
373 HB3 ASP 47 HB3 ASP 47 12.710 4.886 3.531
374 HA PRO 48 HA PRO 48 8.620 2.603 5.094
375 HB2 PRO 48 HB2 PRO 48 9.695 4.751 6.919
376 HB3 PRO 48 HB3 PRO 48 8.768 3.275 7.351
377 HG2 PRO 48 HG2 PRO 48 11.448 3.337 7.702
378 HG3 PRO 48 HG3 PRO 48 10.679 1.887 6.968
379 HD2 PRO 48 HD2 PRO 48 12.117 4.154 5.579
380 HD3 PRO 48 HD3 PRO 48 12.219 2.391 5.275
381 H LYS 49 H LYS 49 9.998 5.977 5.010
382 HA LYS 49 HA LYS 49 7.387 7.163 4.813
383 HB2 LYS 49 HB2 LYS 49 10.168 8.246 4.204
384 HB3 LYS 49 HB3 LYS 49 8.689 9.226 4.275
385 HG2 LYS 49 HG2 LYS 49 8.338 8.555 6.625
386 HG3 LYS 49 HG3 LYS 49 9.820 7.572 6.573
387 HD2 LYS 49 HD2 LYS 49 11.160 9.578 6.089
388 HD3 LYS 49 HD3 LYS 49 9.687 10.575 6.056
389 HE2 LYS 49 HE2 LYS 49 9.238 10.016 8.413
390 HE3 LYS 49 HE3 LYS 49 10.687 8.991 8.458
391 HZ1 LYS 49 HZ1 LYS 49 10.676 11.879 7.918
392 HZ2 LYS 49 HZ2 LYS 49 11.066 11.183 9.360
393 HZ3 LYS 49 HZ3 LYS 49 12.009 10.916 8.033
394 H ALA 50 H ALA 50 9.820 6.099 2.418
395 HA ALA 50 HA ALA 50 8.690 7.490 0.211
396 HB1 ALA 50 HB1 ALA 50 10.951 6.496 0.209
397 HB2 ALA 50 HB2 ALA 50 10.238 4.867 0.300
398 HB3 ALA 50 HB3 ALA 50 9.977 5.873 -1.143
399 H LEU 51 H LEU 51 7.927 4.390 1.780
400 HA LEU 51 HA LEU 51 6.268 3.433 -0.341
401 HB2 LEU 51 HB2 LEU 51 7.418 2.149 1.595
402 HB3 LEU 51 HB3 LEU 51 6.028 2.663 2.575
403 HG LEU 51 HG LEU 51 4.549 1.667 0.719
404 HD11 LEU 51 HD11 LEU 51 5.646 -0.070 -0.684
405 HD12 LEU 51 HD12 LEU 51 6.317 1.536 -1.034
406 HD13 LEU 51 HD13 LEU 51 7.229 0.394 -0.022
407 HD21 LEU 51 HD21 LEU 51 5.061 0.585 2.936
408 HD22 LEU 51 HD22 LEU 51 4.751 -0.582 1.623
409 HD23 LEU 51 HD23 LEU 51 6.415 -0.258 2.158
410 H VAL 52 H VAL 52 5.495 4.960 2.855
411 HA VAL 52 HA VAL 52 2.675 4.924 2.375
412 HB VAL 52 HB VAL 52 4.335 6.666 4.247
413 HG11 VAL 52 HG11 VAL 52 1.815 6.035 5.354
414 HG12 VAL 52 HG12 VAL 52 2.329 7.622 4.709
415 HG13 VAL 52 HG13 VAL 52 1.467 6.459 3.677
416 HG21 VAL 52 HG21 VAL 52 3.811 4.915 5.909
417 HG22 VAL 52 HG22 VAL 52 2.970 3.969 4.657
418 HG23 VAL 52 HG23 VAL 52 4.725 4.241 4.544
419 H GLN 53 H GLN 53 5.264 7.213 1.523
420 HA GLN 53 HA GLN 53 3.571 9.458 1.082
421 HB2 GLN 53 HB2 GLN 53 6.020 9.568 1.347
422 HB3 GLN 53 HB3 GLN 53 6.235 8.688 -0.180
423 HG2 GLN 53 HG2 GLN 53 5.152 10.525 -1.408
424 HG3 GLN 53 HG3 GLN 53 4.840 11.379 0.117
425 HE21 GLN 53 HE21 GLN 53 8.797 11.035 -1.137
426 HE22 GLN 53 HE22 GLN 53 7.658 9.756 -1.493
427 H ALA 54 H ALA 54 4.467 6.650 -0.905
428 HA ALA 54 HA ALA 54 3.551 7.647 -3.403
429 HB1 ALA 54 HB1 ALA 54 3.526 5.286 -4.061
430 HB2 ALA 54 HB2 ALA 54 4.994 5.669 -3.131
431 HB3 ALA 54 HB3 ALA 54 3.647 4.801 -2.354
432 H VAL 55 H VAL 55 1.908 5.484 -1.011
433 HA VAL 55 HA VAL 55 -0.538 5.480 -2.521
434 HB VAL 55 HB VAL 55 -1.421 4.294 -0.555
435 HG11 VAL 55 HG11 VAL 55 1.255 3.041 -0.810
436 HG12 VAL 55 HG12 VAL 55 -0.352 2.378 -1.115
437 HG13 VAL 55 HG13 VAL 55 0.418 3.399 -2.351
438 HG21 VAL 55 HG21 VAL 55 -0.254 5.527 1.238
439 HG22 VAL 55 HG22 VAL 55 0.052 3.781 1.359
440 HG23 VAL 55 HG23 VAL 55 1.303 4.856 0.694
441 H GLU 56 H GLU 56 0.754 7.633 -0.024
442 HA GLU 56 HA GLU 56 -1.816 8.515 0.896
443 HB2 GLU 56 HB2 GLU 56 0.308 8.721 2.167
444 HB3 GLU 56 HB3 GLU 56 0.885 9.921 0.989
445 HG2 GLU 56 HG2 GLU 56 -1.032 11.387 1.556
446 HG3 GLU 56 HG3 GLU 56 -1.641 10.156 2.679
447 H GLU 57 H GLU 57 0.405 9.539 -1.724
448 HA GLU 57 HA GLU 57 -1.087 11.942 -2.306
449 HB2 GLU 57 HB2 GLU 57 1.198 10.436 -3.437
450 HB3 GLU 57 HB3 GLU 57 0.167 11.237 -4.654
451 HG2 GLU 57 HG2 GLU 57 0.303 13.358 -3.393
452 HG3 GLU 57 HG3 GLU 57 1.358 12.578 -2.198
453 H GLU 58 H GLU 58 -1.492 8.533 -3.016
454 HA GLU 58 HA GLU 58 -3.237 8.928 -5.306
455 HB2 GLU 58 HB2 GLU 58 -2.743 6.578 -3.441
456 HB3 GLU 58 HB3 GLU 58 -3.802 6.509 -4.862
457 HG2 GLU 58 HG2 GLU 58 -0.865 7.304 -4.962
458 HG3 GLU 58 HG3 GLU 58 -1.463 5.667 -5.271
459 H GLY 59 H GLY 59 -3.550 9.505 -1.956
460 HA2 GLY 59 HA2 GLY 59 -5.494 10.530 -1.069
461 HA3 GLY 59 HA3 GLY 59 -6.484 9.731 -2.306
462 H TYR 60 H TYR 60 -4.141 7.649 -0.870
463 HA TYR 60 HA TYR 60 -6.209 6.590 0.990
464 HB2 TYR 60 HB2 TYR 60 -4.414 4.976 -0.850
465 HB3 TYR 60 HB3 TYR 60 -5.586 4.331 0.309
466 HD1 TYR 60 HD1 TYR 60 -5.074 5.063 -3.064
467 HD2 TYR 60 HD2 TYR 60 -8.055 5.399 0.014
468 HE1 TYR 60 HE1 TYR 60 -6.842 5.188 -4.800
469 HE2 TYR 60 HE2 TYR 60 -9.831 5.528 -1.710
470 HH TYR 60 HH TYR 60 -10.308 5.556 -3.950
471 H LYS 61 H LYS 61 -5.323 7.281 2.876
472 HA LYS 61 HA LYS 61 -2.545 7.339 3.484
473 HB2 LYS 61 HB2 LYS 61 -4.964 7.044 5.313
474 HB3 LYS 61 HB3 LYS 61 -3.349 7.593 5.815
475 HG2 LYS 61 HG2 LYS 61 -3.535 9.592 4.454
476 HG3 LYS 61 HG3 LYS 61 -5.013 8.985 3.677
477 HD2 LYS 61 HD2 LYS 61 -6.182 9.015 5.858
478 HD3 LYS 61 HD3 LYS 61 -4.731 9.714 6.620
479 HE2 LYS 61 HE2 LYS 61 -4.881 11.686 5.162
480 HE3 LYS 61 HE3 LYS 61 -6.202 10.931 4.254
481 HZ1 LYS 61 HZ1 LYS 61 -6.269 11.963 6.981
482 HZ2 LYS 61 HZ2 LYS 61 -7.205 12.370 5.703
483 HZ3 LYS 61 HZ3 LYS 61 -7.417 10.901 6.418
484 H ALA 62 H ALA 62 -1.423 5.880 5.128
485 HA ALA 62 HA ALA 62 -2.584 3.233 5.504
486 HB1 ALA 62 HB1 ALA 62 -1.818 3.105 3.155
487 HB2 ALA 62 HB2 ALA 62 -0.187 3.603 3.663
488 HB3 ALA 62 HB3 ALA 62 -0.860 2.050 4.215
489 H GLU 63 H GLU 63 -2.169 3.572 7.718
490 HA GLU 63 HA GLU 63 0.522 4.252 8.631
491 HB2 GLU 63 HB2 GLU 63 -1.948 3.221 10.084
492 HB3 GLU 63 HB3 GLU 63 -0.447 3.762 10.870
493 HG2 GLU 63 HG2 GLU 63 -0.707 5.990 9.805
494 HG3 GLU 63 HG3 GLU 63 -2.235 5.455 9.079
495 H VAL 64 H VAL 64 2.180 2.843 9.036
496 HA VAL 64 HA VAL 64 2.005 0.075 8.426
497 HB VAL 64 HB VAL 64 4.232 -0.022 9.534
498 HG11 VAL 64 HG11 VAL 64 4.027 0.687 7.187
499 HG12 VAL 64 HG12 VAL 64 3.806 2.376 7.704
500 HG13 VAL 64 HG13 VAL 64 5.354 1.549 7.994
501 HG21 VAL 64 HG21 VAL 64 3.686 2.910 10.173
502 HG22 VAL 64 HG22 VAL 64 3.848 1.593 11.358
503 HG23 VAL 64 HG23 VAL 64 5.243 2.076 10.375
504 H LEU 65 H LEU 65 1.493 -1.681 9.671
505 HA LEU 65 HA LEU 65 0.784 -1.154 12.516
506 HB2 LEU 65 HB2 LEU 65 -0.214 -3.270 10.574
507 HB3 LEU 65 HB3 LEU 65 -0.626 -3.204 12.297
508 HG LEU 65 HG LEU 65 -1.255 -1.049 10.238
509 HD11 LEU 65 HD11 LEU 65 -2.981 -3.049 11.757
510 HD12 LEU 65 HD12 LEU 65 -3.598 -1.756 10.704
511 HD13 LEU 65 HD13 LEU 65 -2.629 -3.081 10.014
512 HD21 LEU 65 HD21 LEU 65 -0.855 -0.055 12.454
513 HD22 LEU 65 HD22 LEU 65 -2.592 -0.055 12.094
514 HD23 LEU 65 HD23 LEU 65 -1.918 -1.267 13.208
515 H ALA 66 H ALA 66 3.521 -1.627 11.520
516 HA ALA 66 HA ALA 66 4.025 -4.244 12.870
517 HB1 ALA 66 HB1 ALA 66 5.196 -3.030 10.363
518 HB2 ALA 66 HB2 ALA 66 6.140 -4.190 11.350
519 HB3 ALA 66 HB3 ALA 66 4.585 -4.668 10.635