Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
563727 | 2m0x RC | 18831 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 26.162 24.566 0.847
2 H2 MET 1 HT2 MET 1 26.066 23.094 1.693
3 H3 MET 1 HT3 MET 1 27.300 24.207 2.053
4 HA MET 1 HA MET 1 24.667 25.330 2.289
5 HB2 MET 1 HB2 MET 1 24.293 22.934 2.990
6 HB3 MET 1 HB1 MET 1 25.508 23.174 4.247
7 HG2 MET 1 HG2 MET 1 24.175 25.017 5.193
8 HG3 MET 1 HG1 MET 1 22.961 24.791 3.934
9 HE1 MET 1 HE1 MET 1 23.761 23.741 7.655
10 HE2 MET 1 HE2 MET 1 25.064 23.318 6.548
11 HE3 MET 1 HE3 MET 1 24.148 22.042 7.348
12 H GLN 2 HN GLN 2 25.656 27.265 2.642
13 HA GLN 2 HA GLN 2 27.863 27.477 4.562
14 HB2 GLN 2 HB2 GLN 2 26.542 29.502 2.740
15 HB3 GLN 2 HB1 GLN 2 27.888 29.863 3.820
16 HG2 GLN 2 HG2 GLN 2 29.306 28.254 2.672
17 HG3 GLN 2 HG1 GLN 2 27.958 27.736 1.660
18 HE21 GLN 2 HE21 GLN 2 30.196 28.667 0.317
19 HE22 GLN 2 HE22 GLN 2 29.900 30.209 -0.326
20 H ILE 3 HN ILE 3 27.716 29.526 5.990
21 HA ILE 3 HA ILE 3 25.027 30.041 7.033
22 HB ILE 3 HB ILE 3 25.867 29.633 9.377
23 HG12 ILE 3 HG12 ILE 3 27.977 27.916 8.055
24 HG13 ILE 3 HG11 ILE 3 28.314 29.576 8.537
25 HG21 ILE 3 HG21 ILE 3 25.805 27.193 7.583
26 HG22 ILE 3 HG22 ILE 3 24.371 28.069 8.119
27 HG23 ILE 3 HG23 ILE 3 25.399 27.255 9.298
28 HD11 ILE 3 HD11 ILE 3 27.842 29.108 10.835
29 HD12 ILE 3 HD12 ILE 3 28.893 27.810 10.271
30 HD13 ILE 3 HD13 ILE 3 27.160 27.530 10.439
31 H PHE 4 HN PHE 4 24.885 31.949 8.251
32 HA PHE 4 HA PHE 4 27.209 33.772 7.962
33 HB2 PHE 4 HB2 PHE 4 24.375 34.646 8.491
34 HB3 PHE 4 HB1 PHE 4 25.698 35.560 7.775
35 HD1 PHE 4 HD2 PHE 4 26.652 33.306 5.843
36 HD2 PHE 4 HD1 PHE 4 22.781 34.948 6.738
37 HE1 PHE 4 HE2 PHE 4 25.862 32.662 3.595
38 HE2 PHE 4 HE1 PHE 4 21.998 34.303 4.480
39 HZ PHE 4 HZ PHE 4 23.533 33.158 2.910
40 H VAL 5 HN VAL 5 28.216 34.435 9.703
41 HA VAL 5 HA VAL 5 27.010 33.923 12.363
42 HB VAL 5 HB VAL 5 29.295 33.874 13.185
43 HG11 VAL 5 HG11 VAL 5 29.989 31.838 12.162
44 HG12 VAL 5 HG12 VAL 5 29.250 32.278 10.622
45 HG13 VAL 5 HG13 VAL 5 28.234 31.860 11.999
46 HG21 VAL 5 HG21 VAL 5 31.116 33.953 11.289
47 HG22 VAL 5 HG22 VAL 5 30.501 35.460 11.967
48 HG23 VAL 5 HG23 VAL 5 29.895 34.881 10.419
49 H LYS 6 HN LYS 6 26.473 35.621 13.602
50 HA LYS 6 HA LYS 6 26.842 38.303 12.657
51 HB2 LYS 6 HB2 LYS 6 24.862 37.520 13.993
52 HB3 LYS 6 HB1 LYS 6 25.922 37.417 15.400
53 HG2 LYS 6 HG2 LYS 6 26.418 39.785 15.278
54 HG3 LYS 6 HG1 LYS 6 25.542 39.935 13.755
55 HD2 LYS 6 HD2 LYS 6 23.454 39.234 14.929
56 HD3 LYS 6 HD1 LYS 6 24.351 39.213 16.448
57 HE2 LYS 6 HE2 LYS 6 24.076 41.642 14.653
58 HE3 LYS 6 HE1 LYS 6 23.106 41.351 16.097
59 HZ1 LYS 6 HZ1 LYS 6 24.898 42.730 16.728
60 HZ2 LYS 6 HZ2 LYS 6 26.038 41.751 15.935
61 HZ3 LYS 6 HZ3 LYS 6 25.255 41.186 17.334
62 H GLY 7 HN GLY 7 28.687 39.396 12.816
63 HA2 GLY 7 HA2 GLY 7 30.700 38.659 14.801
64 HA3 GLY 7 HA1 GLY 7 30.900 39.806 13.479
65 H LEU 8 HN LEU 8 31.857 40.492 15.924
66 HA LEU 8 HA LEU 8 30.048 41.900 17.596
67 HB2 LEU 8 HB2 LEU 8 33.025 42.242 17.180
68 HB3 LEU 8 HB1 LEU 8 32.108 42.985 18.485
69 HG LEU 8 HG LEU 8 32.081 39.995 18.023
70 HD11 LEU 8 HD11 LEU 8 33.957 41.550 19.830
71 HD12 LEU 8 HD12 LEU 8 34.427 40.754 18.328
72 HD13 LEU 8 HD13 LEU 8 33.861 39.794 19.695
73 HD21 LEU 8 HD21 LEU 8 30.340 40.658 19.516
74 HD22 LEU 8 HD22 LEU 8 31.374 41.830 20.330
75 HD23 LEU 8 HD23 LEU 8 31.644 40.106 20.563
76 H THR 9 HN THR 9 31.864 42.771 14.726
77 HA THR 9 HA THR 9 31.365 45.594 14.932
78 HB THR 9 HB THR 9 32.336 45.721 12.715
79 HG1 THR 9 HG1 THR 9 31.881 42.933 12.756
80 HG21 THR 9 HG21 THR 9 33.924 45.395 14.521
81 HG22 THR 9 HG22 THR 9 34.462 44.457 13.127
82 HG23 THR 9 HG23 THR 9 33.668 43.651 14.480
83 H GLY 10 HN GLY 10 29.476 42.935 14.047
84 HA2 GLY 10 HA2 GLY 10 27.145 43.109 13.582
85 HA3 GLY 10 HA1 GLY 10 27.420 44.705 12.886
86 H LYS 11 HN LYS 11 29.907 43.321 11.613
87 HA LYS 11 HA LYS 11 28.629 42.757 9.086
88 HB2 LYS 11 HB2 LYS 11 31.515 42.635 9.993
89 HB3 LYS 11 HB1 LYS 11 30.987 42.332 8.338
90 HG2 LYS 11 HG2 LYS 11 30.056 44.576 8.172
91 HG3 LYS 11 HG1 LYS 11 30.423 44.889 9.869
92 HD2 LYS 11 HD2 LYS 11 32.831 44.621 9.402
93 HD3 LYS 11 HD1 LYS 11 32.469 44.307 7.705
94 HE2 LYS 11 HE2 LYS 11 31.633 46.523 7.376
95 HE3 LYS 11 HE1 LYS 11 31.608 46.845 9.110
96 HZ1 LYS 11 HZ1 LYS 11 33.628 47.690 8.829
97 HZ2 LYS 11 HZ2 LYS 11 33.767 47.068 7.253
98 HZ3 LYS 11 HZ3 LYS 11 34.182 46.105 8.590
99 H THR 12 HN THR 12 28.155 40.811 8.242
100 HA THR 12 HA THR 12 28.462 38.452 9.915
101 HB THR 12 HB THR 12 27.129 37.365 8.099
102 HG1 THR 12 HG1 THR 12 28.020 39.185 6.630
103 HG21 THR 12 HG21 THR 12 25.922 38.300 9.948
104 HG22 THR 12 HG22 THR 12 25.081 38.815 8.487
105 HG23 THR 12 HG23 THR 12 26.139 39.940 9.337
106 H THR 13 HN THR 13 29.583 36.580 9.384
107 HA THR 13 HA THR 13 31.521 36.799 7.138
108 HB THR 13 HB THR 13 31.893 36.014 10.008
109 HG1 THR 13 HG1 THR 13 32.627 37.951 8.459
110 HG21 THR 13 HG21 THR 13 32.708 34.005 9.082
111 HG22 THR 13 HG22 THR 13 34.146 35.019 9.196
112 HG23 THR 13 HG23 THR 13 33.331 34.816 7.645
113 H THR 14 HN THR 14 30.889 35.417 5.607
114 HA THR 14 HA THR 14 29.237 33.152 6.078
115 HB THR 14 HB THR 14 29.892 32.590 3.681
116 HG1 THR 14 HG1 THR 14 31.196 33.986 2.643
117 HG21 THR 14 HG21 THR 14 28.822 34.794 2.824
118 HG22 THR 14 HG22 THR 14 28.704 35.231 4.528
119 HG23 THR 14 HG23 THR 14 27.883 33.791 3.925
120 H LEU 15 HN LEU 15 29.716 31.050 6.394
121 HA LEU 15 HA LEU 15 32.555 30.199 6.319
122 HB2 LEU 15 HB2 LEU 15 30.571 30.049 8.556
123 HB3 LEU 15 HB1 LEU 15 31.681 28.696 8.370
124 HG LEU 15 HG LEU 15 32.770 31.512 8.339
125 HD11 LEU 15 HD11 LEU 15 31.466 31.565 10.352
126 HD12 LEU 15 HD12 LEU 15 33.124 31.224 10.842
127 HD13 LEU 15 HD13 LEU 15 31.938 29.921 10.777
128 HD21 LEU 15 HD21 LEU 15 34.231 29.581 7.800
129 HD22 LEU 15 HD22 LEU 15 33.830 28.856 9.356
130 HD23 LEU 15 HD23 LEU 15 34.733 30.368 9.295
131 H GLU 16 HN GLU 16 32.933 28.152 5.591
132 HA GLU 16 HA GLU 16 30.723 26.837 4.195
133 HB2 GLU 16 HB2 GLU 16 32.945 27.259 3.101
134 HB3 GLU 16 HB1 GLU 16 33.661 26.115 4.233
135 HG2 GLU 16 HG2 GLU 16 32.181 24.341 3.419
136 HG3 GLU 16 HG1 GLU 16 31.395 25.478 2.325
137 H VAL 17 HN VAL 17 29.615 25.241 5.129
138 HA VAL 17 HA VAL 17 31.005 23.321 6.874
139 HB VAL 17 HB VAL 17 29.298 23.464 8.594
140 HG11 VAL 17 HG11 VAL 17 31.285 25.030 8.625
141 HG12 VAL 17 HG12 VAL 17 29.886 25.603 9.535
142 HG13 VAL 17 HG13 VAL 17 30.234 26.270 7.940
143 HG21 VAL 17 HG21 VAL 17 28.108 25.593 6.791
144 HG22 VAL 17 HG22 VAL 17 27.620 25.349 8.467
145 HG23 VAL 17 HG23 VAL 17 27.357 24.073 7.280
146 H GLU 18 HN GLU 18 29.582 21.425 7.362
147 HA GLU 18 HA GLU 18 27.472 20.941 5.376
148 HB2 GLU 18 HB2 GLU 18 29.882 19.144 5.749
149 HB3 GLU 18 HB1 GLU 18 28.476 18.772 4.751
150 HG2 GLU 18 HG2 GLU 18 28.934 20.813 3.401
151 HG3 GLU 18 HG1 GLU 18 30.387 21.093 4.360
152 HA PRO 19 HA PRO 19 25.227 19.025 8.697
153 HB2 PRO 19 HB2 PRO 19 25.204 16.595 6.917
154 HB3 PRO 19 HB1 PRO 19 23.872 17.324 7.838
155 HG2 PRO 19 HG2 PRO 19 24.144 17.726 5.202
156 HG3 PRO 19 HG1 PRO 19 23.525 18.987 6.283
157 HD2 PRO 19 HD2 PRO 19 26.138 18.861 4.880
158 HD3 PRO 19 HD1 PRO 19 25.289 20.269 5.559
159 H SER 20 HN SER 20 27.741 17.111 7.089
160 HA SER 20 HA SER 20 28.232 15.393 9.337
161 HB2 SER 20 HB2 SER 20 30.214 14.681 8.037
162 HB3 SER 20 HB1 SER 20 28.742 14.648 7.069
163 HG SER 20 HG SER 20 29.572 16.127 5.833
164 H ASP 21 HN ASP 21 29.650 18.372 8.076
165 HA ASP 21 HA ASP 21 31.987 18.503 9.561
166 HB2 ASP 21 HB2 ASP 21 31.248 20.138 7.801
167 HB3 ASP 21 HB1 ASP 21 30.166 20.850 9.000
168 H THR 22 HN THR 22 32.323 18.355 11.649
169 HA THR 22 HA THR 22 30.188 18.760 13.566
170 HB THR 22 HB THR 22 31.824 18.004 15.214
171 HG1 THR 22 HG1 THR 22 33.537 18.688 13.153
172 HG21 THR 22 HG21 THR 22 30.708 16.278 13.929
173 HG22 THR 22 HG22 THR 22 32.392 15.805 14.149
174 HG23 THR 22 HG23 THR 22 31.856 16.467 12.605
175 H ILE 23 HN ILE 23 30.524 20.098 15.505
176 HA ILE 23 HA ILE 23 30.977 22.795 14.839
177 HB ILE 23 HB ILE 23 31.038 21.598 17.614
178 HG12 ILE 23 HG12 ILE 23 29.061 20.738 16.523
179 HG13 ILE 23 HG11 ILE 23 28.557 22.060 17.569
180 HG21 ILE 23 HG21 ILE 23 31.668 24.015 17.324
181 HG22 ILE 23 HG22 ILE 23 30.225 23.773 18.305
182 HG23 ILE 23 HG23 ILE 23 30.073 24.297 16.628
183 HD11 ILE 23 HD11 ILE 23 28.785 22.015 14.568
184 HD12 ILE 23 HD12 ILE 23 28.839 23.544 15.444
185 HD13 ILE 23 HD13 ILE 23 27.417 22.509 15.564
186 H GLU 24 HN GLU 24 33.010 20.431 16.542
187 HA GLU 24 HA GLU 24 35.086 22.017 17.403
188 HB2 GLU 24 HB2 GLU 24 34.908 19.531 17.695
189 HB3 GLU 24 HB1 GLU 24 35.447 19.346 16.026
190 HG2 GLU 24 HG2 GLU 24 37.541 20.480 16.528
191 HG3 GLU 24 HG1 GLU 24 36.999 20.824 18.169
192 H ASN 25 HN ASN 25 34.530 20.756 14.135
193 HA ASN 25 HA ASN 25 36.892 21.832 12.981
194 HB2 ASN 25 HB2 ASN 25 35.426 20.018 12.001
195 HB3 ASN 25 HB1 ASN 25 34.265 21.280 11.586
196 HD21 ASN 25 HD21 ASN 25 35.439 19.788 9.508
197 HD22 ASN 25 HD22 ASN 25 36.519 20.776 8.648
198 H VAL 26 HN VAL 26 33.549 23.005 13.224
199 HA VAL 26 HA VAL 26 33.789 25.322 11.692
200 HB VAL 26 HB VAL 26 32.110 24.867 14.167
201 HG11 VAL 26 HG11 VAL 26 32.141 27.218 13.765
202 HG12 VAL 26 HG12 VAL 26 30.668 26.637 12.987
203 HG13 VAL 26 HG13 VAL 26 32.095 26.994 12.015
204 HG21 VAL 26 HG21 VAL 26 31.489 24.563 11.211
205 HG22 VAL 26 HG22 VAL 26 30.362 24.281 12.538
206 HG23 VAL 26 HG23 VAL 26 31.762 23.230 12.333
207 H LYS 27 HN LYS 27 34.337 24.904 15.199
208 HA LYS 27 HA LYS 27 35.029 27.577 15.753
209 HB2 LYS 27 HB2 LYS 27 35.870 24.981 17.063
210 HB3 LYS 27 HB1 LYS 27 36.312 26.569 17.693
211 HG2 LYS 27 HG2 LYS 27 33.916 27.172 17.843
212 HG3 LYS 27 HG1 LYS 27 33.481 25.572 17.238
213 HD2 LYS 27 HD2 LYS 27 34.609 24.535 19.182
214 HD3 LYS 27 HD1 LYS 27 35.018 26.139 19.792
215 HE2 LYS 27 HE2 LYS 27 32.613 26.700 19.924
216 HE3 LYS 27 HE1 LYS 27 32.211 25.086 19.340
217 HZ1 LYS 27 HZ1 LYS 27 33.014 24.102 21.271
218 HZ2 LYS 27 HZ2 LYS 27 32.205 25.483 21.843
219 HZ3 LYS 27 HZ3 LYS 27 33.900 25.474 21.731
220 H ALA 28 HN ALA 28 36.857 24.890 14.431
221 HA ALA 28 HA ALA 28 39.435 26.070 14.652
222 HB1 ALA 28 HB1 ALA 28 38.618 24.112 12.507
223 HB2 ALA 28 HB2 ALA 28 38.844 23.613 14.183
224 HB3 ALA 28 HB3 ALA 28 40.192 24.302 13.279
225 H LYS 29 HN LYS 29 36.975 26.041 12.086
226 HA LYS 29 HA LYS 29 38.468 27.402 10.119
227 HB2 LYS 29 HB2 LYS 29 35.481 27.456 10.639
228 HB3 LYS 29 HB1 LYS 29 36.264 28.036 9.170
229 HG2 LYS 29 HG2 LYS 29 37.292 25.672 9.007
230 HG3 LYS 29 HG1 LYS 29 36.085 25.206 10.204
231 HD2 LYS 29 HD2 LYS 29 34.286 26.006 8.727
232 HD3 LYS 29 HD1 LYS 29 35.483 26.503 7.529
233 HE2 LYS 29 HE2 LYS 29 34.725 24.363 6.808
234 HE3 LYS 29 HE1 LYS 29 36.297 24.075 7.553
235 HZ1 LYS 29 HZ1 LYS 29 33.939 22.857 8.214
236 HZ2 LYS 29 HZ2 LYS 29 34.180 23.987 9.460
237 HZ3 LYS 29 HZ3 LYS 29 35.374 22.826 9.118
238 H ILE 30 HN ILE 30 36.394 28.514 12.734
239 HA ILE 30 HA ILE 30 36.490 31.278 12.180
240 HB ILE 30 HB ILE 30 35.989 29.683 14.692
241 HG12 ILE 30 HG12 ILE 30 34.089 31.409 13.097
242 HG13 ILE 30 HG11 ILE 30 34.377 29.719 12.684
243 HG21 ILE 30 HG21 ILE 30 35.990 32.674 14.275
244 HG22 ILE 30 HG22 ILE 30 36.783 31.750 15.550
245 HG23 ILE 30 HG23 ILE 30 35.026 31.909 15.540
246 HD11 ILE 30 HD11 ILE 30 33.645 30.500 15.504
247 HD12 ILE 30 HD12 ILE 30 33.464 28.938 14.703
248 HD13 ILE 30 HD13 ILE 30 32.399 30.272 14.277
249 H GLN 31 HN GLN 31 38.496 29.205 14.259
250 HA GLN 31 HA GLN 31 40.088 31.124 15.467
251 HB2 GLN 31 HB2 GLN 31 40.214 28.787 16.099
252 HB3 GLN 31 HB1 GLN 31 40.833 28.351 14.504
253 HG2 GLN 31 HG2 GLN 31 42.887 29.504 14.881
254 HG3 GLN 31 HG1 GLN 31 42.254 30.319 16.310
255 HE21 GLN 31 HE21 GLN 31 44.586 28.969 16.749
256 HE22 GLN 31 HE22 GLN 31 44.309 27.510 17.570
257 H ASP 32 HN ASP 32 39.863 30.391 12.153
258 HA ASP 32 HA ASP 32 42.555 31.419 11.537
259 HB2 ASP 32 HB2 ASP 32 40.441 30.355 9.657
260 HB3 ASP 32 HB1 ASP 32 42.134 30.671 9.282
261 H LYS 33 HN LYS 33 39.127 32.155 10.942
262 HA LYS 33 HA LYS 33 39.730 34.533 9.427
263 HB2 LYS 33 HB2 LYS 33 37.163 33.448 10.593
264 HB3 LYS 33 HB1 LYS 33 37.252 34.937 9.652
265 HG2 LYS 33 HG2 LYS 33 38.316 33.618 7.793
266 HG3 LYS 33 HG1 LYS 33 38.003 32.153 8.724
267 HD2 LYS 33 HD2 LYS 33 35.575 32.746 8.761
268 HD3 LYS 33 HD1 LYS 33 35.929 34.121 7.714
269 HE2 LYS 33 HE2 LYS 33 36.853 32.570 6.013
270 HE3 LYS 33 HE1 LYS 33 36.440 31.206 7.053
271 HZ1 LYS 33 HZ1 LYS 33 34.266 31.383 6.575
272 HZ2 LYS 33 HZ2 LYS 33 34.817 32.182 5.181
273 HZ3 LYS 33 HZ3 LYS 33 34.288 33.079 6.523
274 H THR 34 HN THR 34 38.953 33.785 12.779
275 HA THR 34 HA THR 34 38.833 36.650 13.463
276 HB THR 34 HB THR 34 38.220 35.736 15.741
277 HG1 THR 34 HG1 THR 34 38.863 33.701 15.806
278 HG21 THR 34 HG21 THR 34 36.546 34.978 13.332
279 HG22 THR 34 HG22 THR 34 36.482 36.496 14.231
280 HG23 THR 34 HG23 THR 34 35.942 34.997 14.990
281 H GLY 35 HN GLY 35 40.898 33.880 13.622
282 HA2 GLY 35 HA2 GLY 35 43.089 33.655 14.295
283 HA3 GLY 35 HA1 GLY 35 43.148 35.409 14.447
284 H LEU 36 HN LEU 36 40.564 34.366 16.237
285 HA LEU 36 HA LEU 36 41.950 34.845 18.717
286 HB2 LEU 36 HB2 LEU 36 39.087 34.148 18.061
287 HB3 LEU 36 HB1 LEU 36 39.656 34.386 19.709
288 HG LEU 36 HG LEU 36 40.000 36.458 17.523
289 HD11 LEU 36 HD11 LEU 36 38.032 37.575 18.355
290 HD12 LEU 36 HD12 LEU 36 37.872 36.423 19.681
291 HD13 LEU 36 HD13 LEU 36 37.574 35.906 18.022
292 HD21 LEU 36 HD21 LEU 36 40.054 37.911 19.733
293 HD22 LEU 36 HD22 LEU 36 41.498 37.035 19.239
294 HD23 LEU 36 HD23 LEU 36 40.464 36.380 20.506
295 HA PRO 37 HA PRO 37 42.766 30.588 19.709
296 HB2 PRO 37 HB2 PRO 37 42.724 30.706 22.468
297 HB3 PRO 37 HB1 PRO 37 44.071 31.310 21.481
298 HG2 PRO 37 HG2 PRO 37 41.831 32.819 22.746
299 HG3 PRO 37 HG1 PRO 37 43.544 33.247 22.622
300 HD2 PRO 37 HD2 PRO 37 41.644 34.319 20.983
301 HD3 PRO 37 HD1 PRO 37 43.319 34.054 20.455
302 HA PRO 38 HA PRO 38 38.914 28.527 20.332
303 HB2 PRO 38 HB2 PRO 38 39.634 26.329 21.863
304 HB3 PRO 38 HB1 PRO 38 39.941 26.475 20.120
305 HG2 PRO 38 HG2 PRO 38 41.792 26.989 22.411
306 HG3 PRO 38 HG1 PRO 38 42.105 26.166 20.872
307 HD2 PRO 38 HD2 PRO 38 42.888 28.719 21.282
308 HD3 PRO 38 HD1 PRO 38 42.320 28.172 19.689
309 H ASP 39 HN ASP 39 40.775 29.213 23.253
310 HA ASP 39 HA ASP 39 38.591 28.748 25.059
311 HB2 ASP 39 HB2 ASP 39 40.053 29.894 26.720
312 HB3 ASP 39 HB1 ASP 39 40.860 28.569 25.885
313 H GLN 40 HN GLN 40 39.180 31.160 22.823
314 HA GLN 40 HA GLN 40 37.614 33.175 24.347
315 HB2 GLN 40 HB2 GLN 40 39.661 33.448 22.144
316 HB3 GLN 40 HB1 GLN 40 38.546 34.754 22.546
317 HG2 GLN 40 HG2 GLN 40 39.344 34.757 24.862
318 HG3 GLN 40 HG1 GLN 40 40.427 33.414 24.509
319 HE21 GLN 40 HE21 GLN 40 42.514 34.287 24.472
320 HE22 GLN 40 HE22 GLN 40 42.953 35.698 23.638
321 H GLN 41 HN GLN 41 36.909 30.758 22.480
322 HA GLN 41 HA GLN 41 35.074 32.262 20.688
323 HB2 GLN 41 HB2 GLN 41 36.419 29.577 20.327
324 HB3 GLN 41 HB1 GLN 41 35.103 30.153 19.304
325 HG2 GLN 41 HG2 GLN 41 36.390 32.045 18.570
326 HG3 GLN 41 HG1 GLN 41 37.650 31.721 19.759
327 HE21 GLN 41 HE21 GLN 41 39.071 31.685 17.725
328 HE22 GLN 41 HE22 GLN 41 39.186 30.222 16.871
329 H ARG 42 HN ARG 42 32.955 31.670 20.600
330 HA ARG 42 HA ARG 42 31.974 29.363 22.079
331 HB2 ARG 42 HB2 ARG 42 32.205 31.344 23.712
332 HB3 ARG 42 HB1 ARG 42 30.889 32.087 22.804
333 HG2 ARG 42 HG2 ARG 42 29.421 30.212 23.281
334 HG3 ARG 42 HG1 ARG 42 30.737 29.323 24.046
335 HD2 ARG 42 HD2 ARG 42 29.542 30.250 25.858
336 HD3 ARG 42 HD1 ARG 42 30.916 31.329 25.655
337 HE ARG 42 HE ARG 42 28.724 32.272 24.119
338 HH11 ARG 42 HH21 ARG 42 29.887 31.900 27.356
339 HH12 ARG 42 HH22 ARG 42 28.962 33.220 27.992
340 HH21 ARG 42 HH11 ARG 42 27.489 34.003 24.953
341 HH22 ARG 42 HH12 ARG 42 27.606 34.408 26.632
342 H LEU 43 HN LEU 43 30.356 28.493 20.932
343 HA LEU 43 HA LEU 43 28.970 30.187 18.928
344 HB2 LEU 43 HB2 LEU 43 29.316 27.183 18.934
345 HB3 LEU 43 HB1 LEU 43 28.634 28.170 17.638
346 HG LEU 43 HG LEU 43 31.484 28.329 18.670
347 HD11 LEU 43 HD11 LEU 43 30.281 27.211 16.121
348 HD12 LEU 43 HD12 LEU 43 31.135 26.310 17.374
349 HD13 LEU 43 HD13 LEU 43 32.009 27.465 16.368
350 HD21 LEU 43 HD21 LEU 43 31.641 29.734 16.454
351 HD22 LEU 43 HD22 LEU 43 31.021 30.503 17.907
352 HD23 LEU 43 HD23 LEU 43 29.903 29.939 16.663
353 H ILE 44 HN ILE 44 26.919 30.564 19.154
354 HA ILE 44 HA ILE 44 25.190 28.677 20.625
355 HB ILE 44 HB ILE 44 25.338 31.673 21.052
356 HG12 ILE 44 HG12 ILE 44 25.452 29.486 23.138
357 HG13 ILE 44 HG11 ILE 44 26.908 30.020 22.302
358 HG21 ILE 44 HG21 ILE 44 23.252 29.627 21.820
359 HG22 ILE 44 HG22 ILE 44 23.017 31.167 20.993
360 HG23 ILE 44 HG23 ILE 44 23.441 31.141 22.705
361 HD11 ILE 44 HD11 ILE 44 26.556 31.229 24.447
362 HD12 ILE 44 HD12 ILE 44 25.032 31.855 23.814
363 HD13 ILE 44 HD13 ILE 44 26.557 32.310 23.053
364 H PHE 45 HN PHE 45 23.408 28.216 19.484
365 HA PHE 45 HA PHE 45 22.611 30.041 17.276
366 HB2 PHE 45 HB2 PHE 45 23.606 27.937 16.463
367 HB3 PHE 45 HB1 PHE 45 22.421 27.022 17.388
368 HD1 PHE 45 HD2 PHE 45 22.554 29.844 14.913
369 HD2 PHE 45 HD1 PHE 45 20.461 26.362 16.299
370 HE1 PHE 45 HE2 PHE 45 20.924 30.086 13.060
371 HE2 PHE 45 HE1 PHE 45 18.830 26.601 14.445
372 HZ PHE 45 HZ PHE 45 19.065 28.464 12.824
373 H ALA 46 HN ALA 46 20.589 30.781 17.344
374 HA ALA 46 HA ALA 46 18.440 31.147 18.070
375 HB1 ALA 46 HB1 ALA 46 18.457 28.125 18.259
376 HB2 ALA 46 HB2 ALA 46 18.045 29.070 16.829
377 HB3 ALA 46 HB3 ALA 46 17.017 29.143 18.260
378 H GLY 47 HN GLY 47 20.693 30.911 20.070
379 HA2 GLY 47 HA2 GLY 47 20.676 31.472 22.347
380 HA3 GLY 47 HA1 GLY 47 18.999 30.946 22.449
381 H LYS 48 HN LYS 48 20.658 28.598 20.806
382 HA LYS 48 HA LYS 48 20.877 26.917 23.224
383 HB2 LYS 48 HB2 LYS 48 20.852 26.163 20.290
384 HB3 LYS 48 HB1 LYS 48 20.877 25.033 21.645
385 HG2 LYS 48 HG2 LYS 48 18.730 26.000 22.456
386 HG3 LYS 48 HG1 LYS 48 18.689 27.045 21.035
387 HD2 LYS 48 HD2 LYS 48 18.669 25.069 19.566
388 HD3 LYS 48 HD1 LYS 48 18.733 24.012 20.977
389 HE2 LYS 48 HE2 LYS 48 16.431 24.108 20.394
390 HE3 LYS 48 HE1 LYS 48 16.596 25.205 21.765
391 HZ1 LYS 48 HZ1 LYS 48 15.335 26.030 19.730
392 HZ2 LYS 48 HZ2 LYS 48 16.856 26.169 18.986
393 HZ3 LYS 48 HZ3 LYS 48 16.509 27.059 20.390
394 H GLN 49 HN GLN 49 22.795 26.194 23.951
395 HA GLN 49 HA GLN 49 25.224 27.182 22.690
396 HB2 GLN 49 HB2 GLN 49 25.023 27.320 25.116
397 HB3 GLN 49 HB1 GLN 49 24.792 25.574 25.218
398 HG2 GLN 49 HG2 GLN 49 27.018 25.146 24.421
399 HG3 GLN 49 HG1 GLN 49 27.251 26.841 23.992
400 HE21 GLN 49 HE21 GLN 49 28.956 25.345 25.849
401 HE22 GLN 49 HE22 GLN 49 28.807 26.091 27.367
402 H LEU 50 HN LEU 50 26.581 26.055 21.465
403 HA LEU 50 HA LEU 50 25.944 23.288 20.798
404 HB2 LEU 50 HB2 LEU 50 28.189 24.990 19.710
405 HB3 LEU 50 HB1 LEU 50 27.460 23.561 18.978
406 HG LEU 50 HG LEU 50 26.140 26.254 19.408
407 HD11 LEU 50 HD11 LEU 50 27.706 26.025 17.471
408 HD12 LEU 50 HD12 LEU 50 26.038 26.308 16.974
409 HD13 LEU 50 HD13 LEU 50 26.724 24.686 16.878
410 HD21 LEU 50 HD21 LEU 50 25.029 23.556 18.619
411 HD22 LEU 50 HD22 LEU 50 24.260 25.044 18.068
412 HD23 LEU 50 HD23 LEU 50 24.392 24.709 19.792
413 H GLU 51 HN GLU 51 27.578 21.636 20.737
414 HA GLU 51 HA GLU 51 29.895 21.997 22.512
415 HB2 GLU 51 HB2 GLU 51 27.667 20.000 22.928
416 HB3 GLU 51 HB1 GLU 51 29.279 19.772 23.607
417 HG2 GLU 51 HG2 GLU 51 29.101 21.930 24.777
418 HG3 GLU 51 HG1 GLU 51 27.499 22.180 24.085
419 H ASP 52 HN ASP 52 31.504 20.367 22.253
420 HA ASP 52 HA ASP 52 31.886 19.529 19.580
421 HB2 ASP 52 HB2 ASP 52 33.778 19.954 21.040
422 HB3 ASP 52 HB1 ASP 52 33.266 18.671 22.133
423 H GLY 53 HN GLY 53 32.058 17.384 18.749
424 HA2 GLY 53 HA2 GLY 53 31.613 15.083 18.675
425 HA3 GLY 53 HA1 GLY 53 30.803 15.202 20.235
426 H ARG 54 HN ARG 54 29.371 17.657 19.031
427 HA ARG 54 HA ARG 54 27.146 16.124 17.864
428 HB2 ARG 54 HB2 ARG 54 27.378 18.891 19.064
429 HB3 ARG 54 HB1 ARG 54 25.950 18.383 18.168
430 HG2 ARG 54 HG2 ARG 54 25.372 17.877 20.387
431 HG3 ARG 54 HG1 ARG 54 25.945 16.327 19.786
432 HD2 ARG 54 HD2 ARG 54 28.137 16.710 20.795
433 HD3 ARG 54 HD1 ARG 54 27.646 18.317 21.313
434 HE ARG 54 HE ARG 54 26.495 17.335 23.079
435 HH11 ARG 54 HH21 ARG 54 27.334 14.999 20.667
436 HH12 ARG 54 HH22 ARG 54 26.860 13.635 21.623
437 HH21 ARG 54 HH11 ARG 54 25.873 15.550 24.342
438 HH22 ARG 54 HH12 ARG 54 26.034 13.947 23.706
439 H THR 55 HN THR 55 25.952 17.136 16.068
440 HA THR 55 HA THR 55 27.739 18.567 14.173
441 HB THR 55 HB THR 55 26.460 17.274 12.387
442 HG1 THR 55 HG1 THR 55 24.905 16.117 13.151
443 HG21 THR 55 HG21 THR 55 28.718 16.661 12.765
444 HG22 THR 55 HG22 THR 55 27.818 15.149 12.863
445 HG23 THR 55 HG23 THR 55 28.348 15.955 14.338
446 H LEU 56 HN LEU 56 26.286 19.408 12.279
447 HA LEU 56 HA LEU 56 24.522 21.346 13.365
448 HB2 LEU 56 HB2 LEU 56 24.748 20.429 10.492
449 HB3 LEU 56 HB1 LEU 56 24.116 21.972 11.058
450 HG LEU 56 HG LEU 56 26.956 21.001 11.495
451 HD11 LEU 56 HD11 LEU 56 27.416 22.965 9.884
452 HD12 LEU 56 HD12 LEU 56 25.711 22.846 9.453
453 HD13 LEU 56 HD13 LEU 56 26.787 21.475 9.182
454 HD21 LEU 56 HD21 LEU 56 25.436 23.495 12.258
455 HD22 LEU 56 HD22 LEU 56 27.179 23.567 12.000
456 HD23 LEU 56 HD23 LEU 56 26.518 22.512 13.245
457 H SER 57 HN SER 57 24.038 18.246 11.777
458 HA SER 57 HA SER 57 21.246 18.384 11.417
459 HB2 SER 57 HB2 SER 57 21.337 16.057 11.010
460 HB3 SER 57 HB1 SER 57 22.909 16.658 10.491
461 HG SER 57 HG SER 57 23.736 15.379 11.922
462 H ASP 58 HN ASP 58 23.176 17.920 14.251
463 HA ASP 58 HA ASP 58 21.062 16.694 15.816
464 HB2 ASP 58 HB2 ASP 58 23.787 17.791 16.520
465 HB3 ASP 58 HB1 ASP 58 22.674 17.145 17.721
466 H TYR 59 HN TYR 59 22.595 19.877 15.546
467 HA TYR 59 HA TYR 59 20.813 21.054 17.515
468 HB2 TYR 59 HB2 TYR 59 22.851 22.295 15.653
469 HB3 TYR 59 HB1 TYR 59 21.993 23.153 16.932
470 HD1 TYR 59 HD1 TYR 59 22.101 21.922 19.321
471 HD2 TYR 59 HD2 TYR 59 24.966 21.445 16.153
472 HE1 TYR 59 HE1 TYR 59 23.804 21.181 20.968
473 HE2 TYR 59 HE2 TYR 59 26.662 20.707 17.799
474 HH TYR 59 HH TYR 59 25.864 20.426 21.265
475 H ASN 60 HN ASN 60 20.319 20.032 14.473
476 HA ASN 60 HA ASN 60 18.797 20.509 12.822
477 HB2 ASN 60 HB2 ASN 60 17.289 20.586 14.846
478 HB3 ASN 60 HB1 ASN 60 17.507 22.336 14.857
479 HD21 ASN 60 HD21 ASN 60 14.918 21.548 14.469
480 HD22 ASN 60 HD22 ASN 60 14.463 21.713 12.842
481 H ILE 61 HN ILE 61 21.196 22.238 13.289
482 HA ILE 61 HA ILE 61 20.496 24.918 12.587
483 HB ILE 61 HB ILE 61 23.069 23.340 12.614
484 HG12 ILE 61 HG12 ILE 61 22.236 25.821 14.127
485 HG13 ILE 61 HG11 ILE 61 21.924 24.194 14.720
486 HG21 ILE 61 HG21 ILE 61 22.555 26.126 11.579
487 HG22 ILE 61 HG22 ILE 61 23.466 24.830 10.811
488 HG23 ILE 61 HG23 ILE 61 24.130 25.661 12.218
489 HD11 ILE 61 HD11 ILE 61 23.999 24.985 15.702
490 HD12 ILE 61 HD12 ILE 61 24.630 25.417 14.114
491 HD13 ILE 61 HD13 ILE 61 24.383 23.722 14.535
492 H GLN 62 HN GLN 62 19.871 25.655 10.698
493 HA GLN 62 HA GLN 62 20.225 24.000 8.277
494 HB2 GLN 62 HB2 GLN 62 18.404 26.356 8.835
495 HB3 GLN 62 HB1 GLN 62 18.449 25.431 7.333
496 HG2 GLN 62 HG2 GLN 62 17.790 23.403 8.509
497 HG3 GLN 62 HG1 GLN 62 17.859 24.242 10.057
498 HE21 GLN 62 HE21 GLN 62 15.453 23.365 9.961
499 HE22 GLN 62 HE22 GLN 62 14.315 24.436 9.303
500 H LYS 63 HN LYS 63 19.860 26.016 6.389
501 HA LYS 63 HA LYS 63 22.531 27.073 6.217
502 HB2 LYS 63 HB2 LYS 63 20.978 26.211 4.308
503 HB3 LYS 63 HB1 LYS 63 20.269 27.823 4.369
504 HG2 LYS 63 HG2 LYS 63 22.480 28.829 3.981
505 HG3 LYS 63 HG1 LYS 63 23.218 27.226 3.973
506 HD2 LYS 63 HD2 LYS 63 21.802 26.599 2.033
507 HD3 LYS 63 HD1 LYS 63 21.126 28.228 2.018
508 HE2 LYS 63 HE2 LYS 63 23.392 29.159 1.658
509 HE3 LYS 63 HE1 LYS 63 24.053 27.523 1.649
510 HZ1 LYS 63 HZ1 LYS 63 23.719 27.746 -0.553
511 HZ2 LYS 63 HZ2 LYS 63 22.491 28.908 -0.377
512 HZ3 LYS 63 HZ3 LYS 63 22.142 27.260 -0.158
513 H GLU 64 HN GLU 64 23.048 29.320 5.916
514 HA GLU 64 HA GLU 64 23.059 31.508 6.619
515 HB2 GLU 64 HB2 GLU 64 20.052 31.456 6.410
516 HB3 GLU 64 HB1 GLU 64 21.161 32.785 6.069
517 HG2 GLU 64 HG2 GLU 64 22.119 31.309 4.207
518 HG3 GLU 64 HG1 GLU 64 20.711 30.276 4.449
519 H SER 65 HN SER 65 22.614 29.284 8.606
520 HA SER 65 HA SER 65 20.861 30.223 10.635
521 HB2 SER 65 HB2 SER 65 22.955 28.150 10.374
522 HB3 SER 65 HB1 SER 65 22.657 28.712 12.014
523 HG SER 65 HG SER 65 20.890 27.516 10.167
524 H THR 66 HN THR 66 21.104 31.841 12.073
525 HA THR 66 HA THR 66 23.545 33.397 12.047
526 HB THR 66 HB THR 66 20.884 33.726 13.443
527 HG1 THR 66 HG1 THR 66 21.068 35.664 12.001
528 HG21 THR 66 HG21 THR 66 23.425 35.345 13.638
529 HG22 THR 66 HG22 THR 66 22.409 34.740 14.947
530 HG23 THR 66 HG23 THR 66 21.844 36.067 13.934
531 H LEU 67 HN LEU 67 25.210 32.783 13.216
532 HA LEU 67 HA LEU 67 24.846 31.326 15.733
533 HB2 LEU 67 HB2 LEU 67 27.306 32.092 14.132
534 HB3 LEU 67 HB1 LEU 67 27.362 31.224 15.661
535 HG LEU 67 HG LEU 67 27.499 29.684 13.728
536 HD11 LEU 67 HD11 LEU 67 26.129 28.060 14.649
537 HD12 LEU 67 HD12 LEU 67 24.781 29.167 14.886
538 HD13 LEU 67 HD13 LEU 67 26.164 29.217 15.978
539 HD21 LEU 67 HD21 LEU 67 24.628 30.306 13.051
540 HD22 LEU 67 HD22 LEU 67 25.864 29.531 12.063
541 HD23 LEU 67 HD23 LEU 67 25.924 31.269 12.337
542 H HIS 68 HN HIS 68 27.136 32.298 17.084
543 HA HIS 68 HA HIS 68 26.865 35.180 17.355
544 HB2 HIS 68 HB2 HIS 68 26.018 33.316 19.579
545 HB3 HIS 68 HB1 HIS 68 26.284 35.048 19.772
546 HD2 HIS 68 HD2 HIS 68 23.337 32.863 19.164
547 HE1 HIS 68 HE1 HIS 68 22.436 36.388 17.025
548 HE2 HIS 68 HE2 HIS 68 21.478 34.219 17.934
549 H ILE 69 HN ILE 69 28.874 35.848 17.500
550 HA ILE 69 HA ILE 69 30.947 34.129 18.677
551 HB ILE 69 HB ILE 69 31.136 36.737 17.143
552 HG12 ILE 69 HG12 ILE 69 31.936 33.965 16.229
553 HG13 ILE 69 HG11 ILE 69 30.314 34.599 15.952
554 HG21 ILE 69 HG21 ILE 69 33.563 36.038 16.970
555 HG22 ILE 69 HG22 ILE 69 33.226 34.810 18.191
556 HG23 ILE 69 HG23 ILE 69 33.052 36.520 18.588
557 HD11 ILE 69 HD11 ILE 69 32.754 36.181 15.147
558 HD12 ILE 69 HD12 ILE 69 31.097 36.337 14.564
559 HD13 ILE 69 HD13 ILE 69 32.073 34.949 14.084
560 H VAL 70 HN VAL 70 31.187 34.333 20.821
561 HA VAL 70 HA VAL 70 30.858 36.993 22.082
562 HB VAL 70 HB VAL 70 31.065 34.320 23.471
563 HG11 VAL 70 HG11 VAL 70 30.002 35.528 25.305
564 HG12 VAL 70 HG12 VAL 70 29.848 36.969 24.300
565 HG13 VAL 70 HG13 VAL 70 31.444 36.403 24.791
566 HG21 VAL 70 HG21 VAL 70 28.566 34.431 23.581
567 HG22 VAL 70 HG22 VAL 70 29.170 34.196 21.943
568 HG23 VAL 70 HG23 VAL 70 28.612 35.788 22.457
569 H TRP 71 HN TRP 71 32.742 38.057 22.193
570 HA TRP 71 HA TRP 71 35.246 36.566 22.609
571 HB2 TRP 71 HB2 TRP 71 35.287 38.181 20.801
572 HB3 TRP 71 HB1 TRP 71 34.701 39.452 21.871
573 HD1 TRP 71 HD1 TRP 71 37.545 36.879 22.431
574 HE1 TRP 71 HE1 TRP 71 39.685 38.175 23.041
575 HE3 TRP 71 HE3 TRP 71 35.836 41.676 21.980
576 HZ2 TRP 71 HZ2 TRP 71 40.561 40.882 23.305
577 HZ3 TRP 71 HZ3 TRP 71 37.348 43.591 22.414
578 HH2 TRP 71 HH2 TRP 71 39.707 43.200 23.076
579 H ARG 72 HN ARG 72 35.896 36.274 24.627
580 HA ARG 72 HA ARG 72 35.928 38.486 26.509
581 HB2 ARG 72 HB2 ARG 72 33.673 37.510 26.835
582 HB3 ARG 72 HB1 ARG 72 34.417 35.946 27.170
583 HG2 ARG 72 HG2 ARG 72 35.550 36.829 29.116
584 HG3 ARG 72 HG1 ARG 72 35.028 38.469 28.732
585 HD2 ARG 72 HD2 ARG 72 32.657 37.727 28.984
586 HD3 ARG 72 HD1 ARG 72 33.239 36.142 29.486
587 HE ARG 72 HE ARG 72 34.502 37.920 31.168
588 HH11 ARG 72 HH21 ARG 72 31.243 37.199 30.257
589 HH12 ARG 72 HH22 ARG 72 30.574 37.622 31.797
590 HH21 ARG 72 HH11 ARG 72 33.631 38.473 33.190
591 HH22 ARG 72 HH12 ARG 72 31.925 38.343 33.457
592 H LEU 73 HN LEU 73 37.633 38.343 27.853
593 HA LEU 73 HA LEU 73 39.460 36.099 27.507
594 HB2 LEU 73 HB2 LEU 73 39.810 38.533 29.263
595 HB3 LEU 73 HB1 LEU 73 41.068 37.472 28.625
596 HG LEU 73 HG LEU 73 39.244 39.253 26.978
597 HD11 LEU 73 HD11 LEU 73 41.084 40.361 28.335
598 HD12 LEU 73 HD12 LEU 73 41.187 40.609 26.591
599 HD13 LEU 73 HD13 LEU 73 42.239 39.433 27.378
600 HD21 LEU 73 HD21 LEU 73 41.348 37.206 26.262
601 HD22 LEU 73 HD22 LEU 73 40.992 38.551 25.177
602 HD23 LEU 73 HD23 LEU 73 39.726 37.400 25.596
603 H ARG 74 HN ARG 74 39.756 34.479 28.912
604 HA ARG 74 HA ARG 74 38.004 34.157 31.143
605 HB2 ARG 74 HB2 ARG 74 39.280 32.089 31.561
606 HB3 ARG 74 HB1 ARG 74 38.823 32.229 29.864
607 HG2 ARG 74 HG2 ARG 74 41.071 33.104 29.328
608 HG3 ARG 74 HG1 ARG 74 41.531 32.967 31.024
609 HD2 ARG 74 HD2 ARG 74 41.108 30.534 30.936
610 HD3 ARG 74 HD1 ARG 74 40.683 30.676 29.233
611 HE ARG 74 HE ARG 74 43.223 31.789 29.513
612 HH11 ARG 74 HH21 ARG 74 41.633 28.758 30.013
613 HH12 ARG 74 HH22 ARG 74 43.040 27.806 29.682
614 HH21 ARG 74 HH11 ARG 74 45.076 30.546 29.074
615 HH22 ARG 74 HH12 ARG 74 44.991 28.818 29.150
616 H GLY 75 HN GLY 75 40.586 36.124 30.819
617 HA2 GLY 75 HA2 GLY 75 41.706 37.391 32.402
618 HA3 GLY 75 HA1 GLY 75 40.895 36.466 33.663
619 H GLY 76 HN GLY 76 43.485 37.046 34.097
620 HA2 GLY 76 HA2 GLY 76 45.407 35.258 33.079
621 HA3 GLY 76 HA1 GLY 76 45.519 36.103 34.620
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 26.691 23.182 3.194
2 H2 MET 1 HT2 MET 1 26.941 23.792 1.628
3 H3 MET 1 HT3 MET 1 25.589 22.819 1.959
4 HA MET 1 HA MET 1 25.153 25.276 1.781
5 HB2 MET 1 HB2 MET 1 23.658 25.229 3.801
6 HB3 MET 1 HB1 MET 1 23.519 23.796 2.785
7 HG2 MET 1 HG2 MET 1 25.107 22.609 4.289
8 HG3 MET 1 HG1 MET 1 25.150 24.032 5.331
9 HE1 MET 1 HE1 MET 1 24.523 22.044 7.150
10 HE2 MET 1 HE2 MET 1 22.961 22.492 7.831
11 HE3 MET 1 HE3 MET 1 24.131 23.746 7.432
12 H GLN 2 HN GLN 2 25.658 27.283 2.507
13 HA GLN 2 HA GLN 2 27.849 27.511 4.457
14 HB2 GLN 2 HB2 GLN 2 26.639 29.531 2.548
15 HB3 GLN 2 HB1 GLN 2 28.015 29.834 3.612
16 HG2 GLN 2 HG2 GLN 2 29.299 28.068 2.508
17 HG3 GLN 2 HG1 GLN 2 27.915 27.671 1.489
18 HE21 GLN 2 HE21 GLN 2 30.785 29.399 1.471
19 HE22 GLN 2 HE22 GLN 2 30.408 30.525 0.258
20 H ILE 3 HN ILE 3 27.722 29.496 5.918
21 HA ILE 3 HA ILE 3 24.980 30.103 6.812
22 HB ILE 3 HB ILE 3 25.762 29.705 9.198
23 HG12 ILE 3 HG12 ILE 3 27.838 27.937 7.874
24 HG13 ILE 3 HG11 ILE 3 28.216 29.567 8.434
25 HG21 ILE 3 HG21 ILE 3 25.308 27.278 9.060
26 HG22 ILE 3 HG22 ILE 3 25.566 27.335 7.316
27 HG23 ILE 3 HG23 ILE 3 24.206 28.199 8.035
28 HD11 ILE 3 HD11 ILE 3 27.763 29.023 10.693
29 HD12 ILE 3 HD12 ILE 3 28.649 27.627 10.081
30 HD13 ILE 3 HD13 ILE 3 26.896 27.551 10.253
31 H PHE 4 HN PHE 4 24.777 31.998 8.005
32 HA PHE 4 HA PHE 4 27.076 33.855 7.802
33 HB2 PHE 4 HB2 PHE 4 24.241 34.694 8.379
34 HB3 PHE 4 HB1 PHE 4 25.544 35.618 7.636
35 HD1 PHE 4 HD1 PHE 4 26.445 33.354 5.675
36 HD2 PHE 4 HD2 PHE 4 22.608 35.033 6.661
37 HE1 PHE 4 HE1 PHE 4 25.597 32.726 3.443
38 HE2 PHE 4 HE2 PHE 4 21.769 34.403 4.418
39 HZ PHE 4 HZ PHE 4 23.258 33.250 2.810
40 H VAL 5 HN VAL 5 28.072 34.475 9.598
41 HA VAL 5 HA VAL 5 26.854 33.816 12.214
42 HB VAL 5 HB VAL 5 29.155 33.869 13.049
43 HG11 VAL 5 HG11 VAL 5 29.895 31.854 12.007
44 HG12 VAL 5 HG12 VAL 5 29.121 32.277 10.481
45 HG13 VAL 5 HG13 VAL 5 28.138 31.824 11.871
46 HG21 VAL 5 HG21 VAL 5 30.240 35.522 11.766
47 HG22 VAL 5 HG22 VAL 5 29.718 34.803 10.244
48 HG23 VAL 5 HG23 VAL 5 30.970 34.019 11.207
49 H LYS 6 HN LYS 6 26.216 35.423 13.521
50 HA LYS 6 HA LYS 6 26.601 38.183 12.731
51 HB2 LYS 6 HB2 LYS 6 24.463 37.316 13.710
52 HB3 LYS 6 HB1 LYS 6 25.308 37.098 15.244
53 HG2 LYS 6 HG2 LYS 6 25.860 39.502 15.288
54 HG3 LYS 6 HG1 LYS 6 25.019 39.725 13.752
55 HD2 LYS 6 HD2 LYS 6 22.917 38.933 14.793
56 HD3 LYS 6 HD1 LYS 6 23.759 38.745 16.332
57 HE2 LYS 6 HE2 LYS 6 22.604 40.883 16.344
58 HE3 LYS 6 HE1 LYS 6 24.339 41.184 16.250
59 HZ1 LYS 6 HZ1 LYS 6 23.853 42.406 14.473
60 HZ2 LYS 6 HZ2 LYS 6 22.278 41.781 14.353
61 HZ3 LYS 6 HZ3 LYS 6 23.581 40.947 13.653
62 H GLY 7 HN GLY 7 28.112 39.547 13.464
63 HA2 GLY 7 HA2 GLY 7 29.945 38.632 15.593
64 HA3 GLY 7 HA1 GLY 7 30.289 39.878 14.396
65 H LEU 8 HN LEU 8 30.946 40.720 16.744
66 HA LEU 8 HA LEU 8 28.933 41.726 18.453
67 HB2 LEU 8 HB2 LEU 8 31.696 42.876 18.014
68 HB3 LEU 8 HB1 LEU 8 30.678 43.087 19.436
69 HG LEU 8 HG LEU 8 31.666 40.392 18.457
70 HD11 LEU 8 HD11 LEU 8 32.731 42.071 20.744
71 HD12 LEU 8 HD12 LEU 8 33.513 41.930 19.170
72 HD13 LEU 8 HD13 LEU 8 33.345 40.510 20.201
73 HD21 LEU 8 HD21 LEU 8 29.756 40.040 19.816
74 HD22 LEU 8 HD22 LEU 8 30.171 41.365 20.903
75 HD23 LEU 8 HD23 LEU 8 31.101 39.868 20.941
76 H THR 9 HN THR 9 30.639 43.165 15.701
77 HA THR 9 HA THR 9 29.126 45.651 15.934
78 HB THR 9 HB THR 9 30.426 46.172 13.782
79 HG1 THR 9 HG1 THR 9 31.540 44.599 12.994
80 HG21 THR 9 HG21 THR 9 31.205 47.141 15.804
81 HG22 THR 9 HG22 THR 9 32.617 46.341 15.113
82 HG23 THR 9 HG23 THR 9 31.735 45.584 16.440
83 H GLY 10 HN GLY 10 28.258 42.716 14.989
84 HA2 GLY 10 HA2 GLY 10 26.408 42.003 13.796
85 HA3 GLY 10 HA1 GLY 10 26.139 43.669 13.291
86 H LYS 11 HN LYS 11 29.241 42.146 12.802
87 HA LYS 11 HA LYS 11 28.944 42.457 9.915
88 HB2 LYS 11 HB2 LYS 11 31.025 43.191 11.002
89 HB3 LYS 11 HB1 LYS 11 31.314 41.543 11.563
90 HG2 LYS 11 HG2 LYS 11 31.516 40.729 9.302
91 HG3 LYS 11 HG1 LYS 11 30.980 42.274 8.642
92 HD2 LYS 11 HD2 LYS 11 32.986 43.354 9.686
93 HD3 LYS 11 HD1 LYS 11 33.545 41.752 10.169
94 HE2 LYS 11 HE2 LYS 11 33.010 42.648 7.320
95 HE3 LYS 11 HE1 LYS 11 34.603 42.448 8.052
96 HZ1 LYS 11 HZ1 LYS 11 34.525 40.267 7.724
97 HZ2 LYS 11 HZ2 LYS 11 33.154 40.524 6.753
98 HZ3 LYS 11 HZ3 LYS 11 32.974 40.134 8.397
99 H THR 12 HN THR 12 28.105 40.875 8.737
100 HA THR 12 HA THR 12 27.982 38.155 9.730
101 HB THR 12 HB THR 12 26.816 37.759 7.513
102 HG1 THR 12 HG1 THR 12 26.427 40.456 7.225
103 HG21 THR 12 HG21 THR 12 24.785 38.921 8.236
104 HG22 THR 12 HG22 THR 12 25.739 39.969 9.284
105 HG23 THR 12 HG23 THR 12 25.624 38.244 9.632
106 H THR 13 HN THR 13 29.244 36.490 9.177
107 HA THR 13 HA THR 13 31.160 36.836 6.931
108 HB THR 13 HB THR 13 31.628 36.025 9.775
109 HG1 THR 13 HG1 THR 13 32.780 37.619 7.795
110 HG21 THR 13 HG21 THR 13 32.393 34.008 8.802
111 HG22 THR 13 HG22 THR 13 33.843 35.007 8.927
112 HG23 THR 13 HG23 THR 13 33.019 34.835 7.377
113 H THR 14 HN THR 14 30.616 35.449 5.378
114 HA THR 14 HA THR 14 28.975 33.163 5.802
115 HB THR 14 HB THR 14 29.673 32.639 3.405
116 HG1 THR 14 HG1 THR 14 30.984 34.049 2.411
117 HG21 THR 14 HG21 THR 14 27.639 33.816 3.707
118 HG22 THR 14 HG22 THR 14 28.545 34.789 2.550
119 HG23 THR 14 HG23 THR 14 28.466 35.279 4.243
120 H LEU 15 HN LEU 15 29.507 31.187 6.430
121 HA LEU 15 HA LEU 15 32.335 30.305 6.231
122 HB2 LEU 15 HB2 LEU 15 30.424 30.295 8.530
123 HB3 LEU 15 HB1 LEU 15 31.498 28.907 8.379
124 HG LEU 15 HG LEU 15 32.664 31.680 8.142
125 HD11 LEU 15 HD11 LEU 15 33.076 31.569 10.644
126 HD12 LEU 15 HD12 LEU 15 31.855 30.299 10.712
127 HD13 LEU 15 HD13 LEU 15 31.413 31.920 10.175
128 HD21 LEU 15 HD21 LEU 15 34.074 29.713 7.701
129 HD22 LEU 15 HD22 LEU 15 33.654 29.042 9.278
130 HD23 LEU 15 HD23 LEU 15 34.603 30.525 9.175
131 H GLU 16 HN GLU 16 32.696 28.344 5.429
132 HA GLU 16 HA GLU 16 30.464 26.911 4.220
133 HB2 GLU 16 HB2 GLU 16 32.611 27.349 3.005
134 HB3 GLU 16 HB1 GLU 16 33.418 26.264 4.136
135 HG2 GLU 16 HG2 GLU 16 31.930 24.428 3.459
136 HG3 GLU 16 HG1 GLU 16 31.092 25.507 2.343
137 H VAL 17 HN VAL 17 29.447 25.291 5.218
138 HA VAL 17 HA VAL 17 30.960 23.476 6.981
139 HB VAL 17 HB VAL 17 29.220 23.563 8.694
140 HG11 VAL 17 HG11 VAL 17 29.848 25.641 9.663
141 HG12 VAL 17 HG12 VAL 17 30.048 26.406 8.086
142 HG13 VAL 17 HG13 VAL 17 31.206 25.193 8.631
143 HG21 VAL 17 HG21 VAL 17 27.293 24.142 7.317
144 HG22 VAL 17 HG22 VAL 17 28.015 25.698 6.901
145 HG23 VAL 17 HG23 VAL 17 27.494 25.381 8.556
146 H GLU 18 HN GLU 18 29.694 21.491 7.485
147 HA GLU 18 HA GLU 18 27.601 20.861 5.512
148 HB2 GLU 18 HB2 GLU 18 30.165 19.314 5.922
149 HB3 GLU 18 HB1 GLU 18 28.764 18.671 5.069
150 HG2 GLU 18 HG2 GLU 18 28.878 20.513 3.452
151 HG3 GLU 18 HG1 GLU 18 30.245 21.209 4.321
152 HA PRO 19 HA PRO 19 25.437 18.873 8.843
153 HB2 PRO 19 HB2 PRO 19 25.511 16.399 7.130
154 HB3 PRO 19 HB1 PRO 19 24.142 17.121 8.002
155 HG2 PRO 19 HG2 PRO 19 24.441 17.430 5.361
156 HG3 PRO 19 HG1 PRO 19 23.780 18.718 6.383
157 HD2 PRO 19 HD2 PRO 19 26.433 18.576 5.044
158 HD3 PRO 19 HD1 PRO 19 25.514 19.997 5.590
159 H SER 20 HN SER 20 27.868 16.806 7.250
160 HA SER 20 HA SER 20 28.455 15.235 9.546
161 HB2 SER 20 HB2 SER 20 30.222 15.755 7.148
162 HB3 SER 20 HB1 SER 20 30.335 14.403 8.270
163 HG SER 20 HG SER 20 28.707 14.764 6.124
164 H ASP 21 HN ASP 21 29.760 18.231 8.242
165 HA ASP 21 HA ASP 21 32.124 18.421 9.710
166 HB2 ASP 21 HB2 ASP 21 31.266 19.986 7.880
167 HB3 ASP 21 HB1 ASP 21 30.315 20.769 9.144
168 H THR 22 HN THR 22 32.461 18.395 11.808
169 HA THR 22 HA THR 22 30.290 18.831 13.689
170 HB THR 22 HB THR 22 31.897 18.147 15.383
171 HG1 THR 22 HG1 THR 22 34.037 17.511 14.343
172 HG21 THR 22 HG21 THR 22 30.845 16.358 14.127
173 HG22 THR 22 HG22 THR 22 32.531 15.925 14.411
174 HG23 THR 22 HG23 THR 22 32.028 16.522 12.829
175 H ILE 23 HN ILE 23 30.530 20.285 15.526
176 HA ILE 23 HA ILE 23 30.982 22.942 14.768
177 HB ILE 23 HB ILE 23 31.084 21.897 17.598
178 HG12 ILE 23 HG12 ILE 23 29.166 20.869 16.552
179 HG13 ILE 23 HG11 ILE 23 28.584 22.206 17.532
180 HG21 ILE 23 HG21 ILE 23 29.889 24.460 16.524
181 HG22 ILE 23 HG22 ILE 23 31.572 24.349 17.033
182 HG23 ILE 23 HG23 ILE 23 30.279 24.061 18.197
183 HD11 ILE 23 HD11 ILE 23 27.419 22.487 15.508
184 HD12 ILE 23 HD12 ILE 23 28.816 22.029 14.535
185 HD13 ILE 23 HD13 ILE 23 28.776 23.600 15.334
186 H GLU 24 HN GLU 24 33.066 20.651 16.497
187 HA GLU 24 HA GLU 24 35.117 22.286 17.335
188 HB2 GLU 24 HB2 GLU 24 35.003 19.819 17.694
189 HB3 GLU 24 HB1 GLU 24 35.476 19.587 16.012
190 HG2 GLU 24 HG2 GLU 24 37.570 20.820 16.419
191 HG3 GLU 24 HG1 GLU 24 37.096 21.075 18.098
192 H ASN 25 HN ASN 25 34.639 20.902 14.093
193 HA ASN 25 HA ASN 25 36.984 21.975 12.942
194 HB2 ASN 25 HB2 ASN 25 35.631 20.164 11.917
195 HB3 ASN 25 HB1 ASN 25 34.353 21.336 11.587
196 HD21 ASN 25 HD21 ASN 25 37.249 22.993 11.294
197 HD22 ASN 25 HD22 ASN 25 37.484 22.821 9.622
198 H VAL 26 HN VAL 26 33.625 23.175 13.012
199 HA VAL 26 HA VAL 26 33.955 25.473 11.483
200 HB VAL 26 HB VAL 26 32.213 25.281 13.952
201 HG11 VAL 26 HG11 VAL 26 30.808 26.862 12.753
202 HG12 VAL 26 HG12 VAL 26 31.852 26.770 11.334
203 HG13 VAL 26 HG13 VAL 26 32.448 27.510 12.820
204 HG21 VAL 26 HG21 VAL 26 31.806 24.258 11.127
205 HG22 VAL 26 HG22 VAL 26 30.498 24.438 12.298
206 HG23 VAL 26 HG23 VAL 26 31.813 23.307 12.611
207 H LYS 27 HN LYS 27 34.447 25.059 14.992
208 HA LYS 27 HA LYS 27 35.176 27.731 15.541
209 HB2 LYS 27 HB2 LYS 27 35.872 25.110 16.881
210 HB3 LYS 27 HB1 LYS 27 36.437 26.663 17.498
211 HG2 LYS 27 HG2 LYS 27 34.129 27.453 17.707
212 HG3 LYS 27 HG1 LYS 27 33.531 25.941 17.023
213 HD2 LYS 27 HD2 LYS 27 34.577 24.702 18.909
214 HD3 LYS 27 HD1 LYS 27 35.082 26.239 19.612
215 HE2 LYS 27 HE2 LYS 27 32.192 25.646 18.950
216 HE3 LYS 27 HE1 LYS 27 32.900 25.244 20.514
217 HZ1 LYS 27 HZ1 LYS 27 32.757 27.939 19.278
218 HZ2 LYS 27 HZ2 LYS 27 33.564 27.586 20.731
219 HZ3 LYS 27 HZ3 LYS 27 31.878 27.397 20.624
220 H ALA 28 HN ALA 28 36.959 24.981 14.276
221 HA ALA 28 HA ALA 28 39.568 26.073 14.542
222 HB1 ALA 28 HB1 ALA 28 38.861 23.637 14.034
223 HB2 ALA 28 HB2 ALA 28 40.294 24.269 13.222
224 HB3 ALA 28 HB3 ALA 28 38.761 24.164 12.355
225 H LYS 29 HN LYS 29 37.143 26.156 11.950
226 HA LYS 29 HA LYS 29 38.731 27.498 10.026
227 HB2 LYS 29 HB2 LYS 29 35.725 27.666 10.405
228 HB3 LYS 29 HB1 LYS 29 36.617 28.058 8.935
229 HG2 LYS 29 HG2 LYS 29 37.505 25.629 9.058
230 HG3 LYS 29 HG1 LYS 29 36.200 25.354 10.209
231 HD2 LYS 29 HD2 LYS 29 34.557 26.133 8.541
232 HD3 LYS 29 HD1 LYS 29 35.862 26.393 7.382
233 HE2 LYS 29 HE2 LYS 29 36.467 23.944 7.677
234 HE3 LYS 29 HE1 LYS 29 34.966 23.763 8.585
235 HZ1 LYS 29 HZ1 LYS 29 34.413 23.211 6.405
236 HZ2 LYS 29 HZ2 LYS 29 35.319 24.487 5.741
237 HZ3 LYS 29 HZ3 LYS 29 33.871 24.808 6.567
238 H ILE 30 HN ILE 30 36.556 28.609 12.567
239 HA ILE 30 HA ILE 30 36.699 31.376 12.036
240 HB ILE 30 HB ILE 30 36.108 29.795 14.541
241 HG12 ILE 30 HG12 ILE 30 34.279 31.452 12.791
242 HG13 ILE 30 HG11 ILE 30 34.555 29.731 12.526
243 HG21 ILE 30 HG21 ILE 30 35.088 32.052 15.290
244 HG22 ILE 30 HG22 ILE 30 36.133 32.777 14.070
245 HG23 ILE 30 HG23 ILE 30 36.838 31.875 15.409
246 HD11 ILE 30 HD11 ILE 30 32.519 30.394 13.976
247 HD12 ILE 30 HD12 ILE 30 33.699 30.782 15.227
248 HD13 ILE 30 HD13 ILE 30 33.582 29.137 14.602
249 H GLN 31 HN GLN 31 38.620 29.264 14.159
250 HA GLN 31 HA GLN 31 40.185 31.122 15.467
251 HB2 GLN 31 HB2 GLN 31 40.285 28.729 15.952
252 HB3 GLN 31 HB1 GLN 31 41.017 28.422 14.375
253 HG2 GLN 31 HG2 GLN 31 43.019 29.563 14.968
254 HG3 GLN 31 HG1 GLN 31 42.271 30.299 16.385
255 HE21 GLN 31 HE21 GLN 31 44.417 29.130 17.253
256 HE22 GLN 31 HE22 GLN 31 44.175 27.556 17.842
257 H ASP 32 HN ASP 32 39.982 30.656 12.139
258 HA ASP 32 HA ASP 32 42.697 31.694 11.609
259 HB2 ASP 32 HB2 ASP 32 40.597 30.693 9.675
260 HB3 ASP 32 HB1 ASP 32 42.264 31.113 9.285
261 H LYS 33 HN LYS 33 39.275 32.456 11.169
262 HA LYS 33 HA LYS 33 39.839 34.928 9.763
263 HB2 LYS 33 HB2 LYS 33 37.293 33.682 10.806
264 HB3 LYS 33 HB1 LYS 33 37.344 35.241 9.980
265 HG2 LYS 33 HG2 LYS 33 38.405 34.161 8.022
266 HG3 LYS 33 HG1 LYS 33 38.318 32.601 8.843
267 HD2 LYS 33 HD2 LYS 33 35.852 32.807 8.954
268 HD3 LYS 33 HD1 LYS 33 35.951 34.346 8.098
269 HE2 LYS 33 HE2 LYS 33 36.976 33.225 6.164
270 HE3 LYS 33 HE1 LYS 33 36.923 31.683 7.019
271 HZ1 LYS 33 HZ1 LYS 33 34.731 33.249 5.864
272 HZ2 LYS 33 HZ2 LYS 33 34.410 32.306 7.240
273 HZ3 LYS 33 HZ3 LYS 33 34.999 31.574 5.824
274 H THR 34 HN THR 34 39.039 33.950 13.058
275 HA THR 34 HA THR 34 38.842 36.770 13.904
276 HB THR 34 HB THR 34 38.212 35.690 16.120
277 HG1 THR 34 HG1 THR 34 38.722 33.646 16.107
278 HG21 THR 34 HG21 THR 34 36.467 36.578 14.757
279 HG22 THR 34 HG22 THR 34 35.948 34.952 15.203
280 HG23 THR 34 HG23 THR 34 36.608 35.259 13.596
281 H GLY 35 HN GLY 35 40.949 34.005 14.058
282 HA2 GLY 35 HA2 GLY 35 43.177 33.909 14.683
283 HA3 GLY 35 HA1 GLY 35 43.091 35.613 15.113
284 H LEU 36 HN LEU 36 40.554 34.565 16.727
285 HA LEU 36 HA LEU 36 41.917 34.488 19.238
286 HB2 LEU 36 HB2 LEU 36 39.026 33.836 18.626
287 HB3 LEU 36 HB1 LEU 36 39.692 34.217 20.211
288 HG LEU 36 HG LEU 36 39.888 36.127 17.867
289 HD11 LEU 36 HD11 LEU 36 37.782 36.075 20.047
290 HD12 LEU 36 HD12 LEU 36 37.507 35.606 18.369
291 HD13 LEU 36 HD13 LEU 36 37.924 37.274 18.762
292 HD21 LEU 36 HD21 LEU 36 40.265 36.347 20.866
293 HD22 LEU 36 HD22 LEU 36 40.028 37.764 19.849
294 HD23 LEU 36 HD23 LEU 36 41.426 36.724 19.594
295 HA PRO 37 HA PRO 37 42.468 30.090 19.381
296 HB2 PRO 37 HB2 PRO 37 42.881 29.649 22.015
297 HB3 PRO 37 HB1 PRO 37 44.038 30.570 21.032
298 HG2 PRO 37 HG2 PRO 37 41.898 31.584 22.864
299 HG3 PRO 37 HG1 PRO 37 43.587 32.111 22.714
300 HD2 PRO 37 HD2 PRO 37 41.501 33.440 21.513
301 HD3 PRO 37 HD1 PRO 37 43.152 33.419 20.848
302 HA PRO 38 HA PRO 38 38.630 27.958 20.149
303 HB2 PRO 38 HB2 PRO 38 40.124 25.945 21.796
304 HB3 PRO 38 HB1 PRO 38 39.036 25.690 20.417
305 HG2 PRO 38 HG2 PRO 38 41.672 25.472 20.145
306 HG3 PRO 38 HG1 PRO 38 40.671 26.185 18.866
307 HD2 PRO 38 HD2 PRO 38 42.494 27.554 20.815
308 HD3 PRO 38 HD1 PRO 38 42.113 27.965 19.129
309 H ASP 39 HN ASP 39 40.711 28.407 22.990
310 HA ASP 39 HA ASP 39 38.726 27.886 24.941
311 HB2 ASP 39 HB2 ASP 39 40.251 28.996 26.518
312 HB3 ASP 39 HB1 ASP 39 41.101 27.844 25.492
313 H GLN 40 HN GLN 40 39.165 30.580 22.866
314 HA GLN 40 HA GLN 40 37.603 32.356 24.640
315 HB2 GLN 40 HB2 GLN 40 39.232 32.847 22.143
316 HB3 GLN 40 HB1 GLN 40 38.098 34.048 22.762
317 HG2 GLN 40 HG2 GLN 40 39.280 33.922 24.981
318 HG3 GLN 40 HG1 GLN 40 40.482 32.879 24.223
319 HE21 GLN 40 HE21 GLN 40 42.314 34.122 23.795
320 HE22 GLN 40 HE22 GLN 40 42.290 35.693 23.154
321 H GLN 41 HN GLN 41 37.630 31.469 21.173
322 HA GLN 41 HA GLN 41 35.268 32.435 20.317
323 HB2 GLN 41 HB2 GLN 41 36.531 29.760 19.736
324 HB3 GLN 41 HB1 GLN 41 35.072 30.295 18.906
325 HG2 GLN 41 HG2 GLN 41 37.626 31.914 19.017
326 HG3 GLN 41 HG1 GLN 41 37.213 30.831 17.690
327 HE21 GLN 41 HE21 GLN 41 34.267 31.558 17.949
328 HE22 GLN 41 HE22 GLN 41 34.146 33.101 17.257
329 H ARG 42 HN ARG 42 33.142 31.846 20.220
330 HA ARG 42 HA ARG 42 32.128 29.606 21.784
331 HB2 ARG 42 HB2 ARG 42 32.407 31.448 23.446
332 HB3 ARG 42 HB1 ARG 42 31.329 32.446 22.471
333 HG2 ARG 42 HG2 ARG 42 29.536 30.765 22.734
334 HG3 ARG 42 HG1 ARG 42 30.613 29.776 23.723
335 HD2 ARG 42 HD2 ARG 42 30.849 31.729 25.291
336 HD3 ARG 42 HD1 ARG 42 29.615 32.566 24.355
337 HE ARG 42 HE ARG 42 27.998 31.142 25.274
338 HH11 ARG 42 HH21 ARG 42 31.216 30.100 26.012
339 HH12 ARG 42 HH22 ARG 42 30.716 28.941 27.199
340 HH21 ARG 42 HH11 ARG 42 27.337 29.628 26.835
341 HH22 ARG 42 HH12 ARG 42 28.522 28.673 27.662
342 H LEU 43 HN LEU 43 30.257 28.841 20.903
343 HA LEU 43 HA LEU 43 28.872 30.533 18.887
344 HB2 LEU 43 HB2 LEU 43 29.317 27.544 18.744
345 HB3 LEU 43 HB1 LEU 43 28.543 28.557 17.523
346 HG LEU 43 HG LEU 43 31.413 28.905 18.450
347 HD11 LEU 43 HD11 LEU 43 30.454 27.701 15.843
348 HD12 LEU 43 HD12 LEU 43 30.903 26.722 17.240
349 HD13 LEU 43 HD13 LEU 43 32.103 27.756 16.464
350 HD21 LEU 43 HD21 LEU 43 29.688 30.184 16.321
351 HD22 LEU 43 HD22 LEU 43 31.443 30.155 16.162
352 HD23 LEU 43 HD23 LEU 43 30.700 30.967 17.535
353 H ILE 44 HN ILE 44 26.743 30.687 19.037
354 HA ILE 44 HA ILE 44 25.196 28.699 20.562
355 HB ILE 44 HB ILE 44 25.186 31.682 21.087
356 HG12 ILE 44 HG12 ILE 44 25.359 29.420 23.082
357 HG13 ILE 44 HG11 ILE 44 26.801 30.067 22.304
358 HG21 ILE 44 HG21 ILE 44 22.885 31.119 21.000
359 HG22 ILE 44 HG22 ILE 44 23.297 31.018 22.711
360 HG23 ILE 44 HG23 ILE 44 23.159 29.546 21.749
361 HD11 ILE 44 HD11 ILE 44 26.249 31.131 24.528
362 HD12 ILE 44 HD12 ILE 44 24.790 31.780 23.780
363 HD13 ILE 44 HD13 ILE 44 26.377 32.269 23.187
364 H PHE 45 HN PHE 45 23.572 28.053 19.305
365 HA PHE 45 HA PHE 45 22.507 29.921 17.250
366 HB2 PHE 45 HB2 PHE 45 23.602 27.855 16.370
367 HB3 PHE 45 HB1 PHE 45 22.422 26.890 17.256
368 HD1 PHE 45 HD1 PHE 45 22.524 29.820 14.912
369 HD2 PHE 45 HD2 PHE 45 20.470 26.257 16.131
370 HE1 PHE 45 HE1 PHE 45 20.887 30.139 13.078
371 HE2 PHE 45 HE2 PHE 45 18.834 26.570 14.295
372 HZ PHE 45 HZ PHE 45 19.044 28.513 12.767
373 H ALA 46 HN ALA 46 20.385 30.409 17.295
374 HA ALA 46 HA ALA 46 18.285 30.660 18.214
375 HB1 ALA 46 HB1 ALA 46 18.625 27.673 17.992
376 HB2 ALA 46 HB2 ALA 46 17.723 28.757 16.931
377 HB3 ALA 46 HB3 ALA 46 17.112 28.394 18.546
378 H GLY 47 HN GLY 47 20.609 30.558 20.078
379 HA2 GLY 47 HA2 GLY 47 20.630 31.040 22.379
380 HA3 GLY 47 HA1 GLY 47 19.065 30.256 22.545
381 H LYS 48 HN LYS 48 20.204 27.936 20.917
382 HA LYS 48 HA LYS 48 21.002 26.351 23.163
383 HB2 LYS 48 HB2 LYS 48 20.922 25.786 20.194
384 HB3 LYS 48 HB1 LYS 48 21.374 24.581 21.400
385 HG2 LYS 48 HG2 LYS 48 19.206 24.821 22.504
386 HG3 LYS 48 HG1 LYS 48 18.748 26.099 21.376
387 HD2 LYS 48 HD2 LYS 48 18.957 24.494 19.497
388 HD3 LYS 48 HD1 LYS 48 19.363 23.218 20.645
389 HE2 LYS 48 HE2 LYS 48 17.168 23.646 21.793
390 HE3 LYS 48 HE1 LYS 48 16.763 24.764 20.491
391 HZ1 LYS 48 HZ1 LYS 48 17.002 22.972 18.904
392 HZ2 LYS 48 HZ2 LYS 48 15.866 22.548 20.095
393 HZ3 LYS 48 HZ3 LYS 48 17.432 21.892 20.141
394 H GLN 49 HN GLN 49 22.963 25.843 23.903
395 HA GLN 49 HA GLN 49 25.283 27.135 22.743
396 HB2 GLN 49 HB2 GLN 49 25.021 27.080 25.176
397 HB3 GLN 49 HB1 GLN 49 25.015 25.316 25.147
398 HG2 GLN 49 HG2 GLN 49 27.288 25.247 24.341
399 HG3 GLN 49 HG1 GLN 49 27.305 26.993 24.089
400 HE21 GLN 49 HE21 GLN 49 29.299 25.982 25.725
401 HE22 GLN 49 HE22 GLN 49 28.980 26.361 27.349
402 H LEU 50 HN LEU 50 26.773 26.234 21.478
403 HA LEU 50 HA LEU 50 26.411 23.455 20.638
404 HB2 LEU 50 HB2 LEU 50 28.432 25.460 19.626
405 HB3 LEU 50 HB1 LEU 50 27.879 23.995 18.827
406 HG LEU 50 HG LEU 50 26.299 26.524 19.334
407 HD11 LEU 50 HD11 LEU 50 27.847 26.324 17.331
408 HD12 LEU 50 HD12 LEU 50 26.155 26.626 16.934
409 HD13 LEU 50 HD13 LEU 50 26.824 25.003 16.768
410 HD21 LEU 50 HD21 LEU 50 24.466 25.183 18.084
411 HD22 LEU 50 HD22 LEU 50 24.716 24.813 19.790
412 HD23 LEU 50 HD23 LEU 50 25.383 23.749 18.550
413 H GLU 51 HN GLU 51 27.842 21.831 20.955
414 HA GLU 51 HA GLU 51 30.347 22.386 22.420
415 HB2 GLU 51 HB2 GLU 51 28.227 20.372 23.207
416 HB3 GLU 51 HB1 GLU 51 29.860 20.410 23.876
417 HG2 GLU 51 HG2 GLU 51 29.503 22.658 24.742
418 HG3 GLU 51 HG1 GLU 51 27.917 22.736 23.977
419 H ASP 52 HN ASP 52 32.000 20.923 22.021
420 HA ASP 52 HA ASP 52 32.013 19.658 19.498
421 HB2 ASP 52 HB2 ASP 52 33.842 19.403 21.890
422 HB3 ASP 52 HB1 ASP 52 34.155 18.610 20.347
423 H GLY 53 HN GLY 53 30.676 17.998 19.058
424 HA2 GLY 53 HA2 GLY 53 30.968 15.425 19.573
425 HA3 GLY 53 HA1 GLY 53 30.182 15.916 21.070
426 H ARG 54 HN ARG 54 28.979 17.993 18.872
427 HA ARG 54 HA ARG 54 26.781 16.193 18.004
428 HB2 ARG 54 HB2 ARG 54 26.595 18.927 19.275
429 HB3 ARG 54 HB1 ARG 54 25.260 18.182 18.397
430 HG2 ARG 54 HG2 ARG 54 25.309 16.258 19.927
431 HG3 ARG 54 HG1 ARG 54 26.674 16.968 20.791
432 HD2 ARG 54 HD2 ARG 54 25.316 18.883 21.446
433 HD3 ARG 54 HD1 ARG 54 23.960 18.286 20.493
434 HE ARG 54 HE ARG 54 24.866 16.398 22.478
435 HH11 ARG 54 HH21 ARG 54 22.917 19.186 21.834
436 HH12 ARG 54 HH22 ARG 54 21.819 18.890 23.141
437 HH21 ARG 54 HH11 ARG 54 23.428 16.006 24.193
438 HH22 ARG 54 HH12 ARG 54 22.107 17.090 24.475
439 H THR 55 HN THR 55 26.089 16.463 15.950
440 HA THR 55 HA THR 55 27.634 18.241 14.224
441 HB THR 55 HB THR 55 26.242 17.078 12.421
442 HG1 THR 55 HG1 THR 55 25.639 14.956 13.868
443 HG21 THR 55 HG21 THR 55 27.856 15.295 14.262
444 HG22 THR 55 HG22 THR 55 28.558 16.413 13.094
445 HG23 THR 55 HG23 THR 55 27.581 15.055 12.537
446 H LEU 56 HN LEU 56 26.101 19.069 12.285
447 HA LEU 56 HA LEU 56 24.547 21.183 13.406
448 HB2 LEU 56 HB2 LEU 56 24.599 20.222 10.543
449 HB3 LEU 56 HB1 LEU 56 24.095 21.809 11.115
450 HG LEU 56 HG LEU 56 26.881 20.645 11.393
451 HD11 LEU 56 HD11 LEU 56 26.590 21.219 9.108
452 HD12 LEU 56 HD12 LEU 56 27.385 22.624 9.817
453 HD13 LEU 56 HD13 LEU 56 25.650 22.657 9.501
454 HD21 LEU 56 HD21 LEU 56 26.663 22.115 13.215
455 HD22 LEU 56 HD22 LEU 56 25.579 23.197 12.342
456 HD23 LEU 56 HD23 LEU 56 27.300 23.179 11.963
457 H SER 57 HN SER 57 23.805 18.081 11.948
458 HA SER 57 HA SER 57 21.024 18.431 11.611
459 HB2 SER 57 HB2 SER 57 22.356 16.568 10.619
460 HB3 SER 57 HB1 SER 57 22.484 15.852 12.223
461 HG SER 57 HG SER 57 20.612 15.372 10.588
462 H ASP 58 HN ASP 58 22.938 18.043 14.423
463 HA ASP 58 HA ASP 58 20.785 16.999 16.084
464 HB2 ASP 58 HB2 ASP 58 23.600 17.923 16.654
465 HB3 ASP 58 HB1 ASP 58 22.479 17.457 17.929
466 H TYR 59 HN TYR 59 22.568 20.038 15.661
467 HA TYR 59 HA TYR 59 20.929 21.450 17.588
468 HB2 TYR 59 HB2 TYR 59 23.002 22.417 15.605
469 HB3 TYR 59 HB1 TYR 59 22.207 23.438 16.801
470 HD1 TYR 59 HD2 TYR 59 22.239 22.432 19.285
471 HD2 TYR 59 HD1 TYR 59 25.068 21.483 16.193
472 HE1 TYR 59 HE2 TYR 59 23.896 21.765 21.005
473 HE2 TYR 59 HE1 TYR 59 26.726 20.820 17.915
474 HH TYR 59 HH TYR 59 26.044 21.229 21.374
475 H ASN 60 HN ASN 60 20.208 20.277 14.686
476 HA ASN 60 HA ASN 60 18.678 20.767 13.039
477 HB2 ASN 60 HB2 ASN 60 17.673 22.538 15.271
478 HB3 ASN 60 HB1 ASN 60 16.828 22.356 13.736
479 HD21 ASN 60 HD21 ASN 60 15.524 21.512 16.066
480 HD22 ASN 60 HD22 ASN 60 15.451 19.817 16.095
481 H ILE 61 HN ILE 61 21.205 22.347 13.312
482 HA ILE 61 HA ILE 61 20.615 25.021 12.450
483 HB ILE 61 HB ILE 61 23.139 23.362 12.565
484 HG12 ILE 61 HG12 ILE 61 22.363 25.916 13.998
485 HG13 ILE 61 HG11 ILE 61 22.024 24.313 14.647
486 HG21 ILE 61 HG21 ILE 61 24.254 25.649 12.089
487 HG22 ILE 61 HG22 ILE 61 22.691 26.123 11.424
488 HG23 ILE 61 HG23 ILE 61 23.579 24.778 10.713
489 HD11 ILE 61 HD11 ILE 61 24.741 25.498 14.023
490 HD12 ILE 61 HD12 ILE 61 24.490 23.800 14.432
491 HD13 ILE 61 HD13 ILE 61 24.109 25.056 15.609
492 H GLN 62 HN GLN 62 20.157 25.719 10.486
493 HA GLN 62 HA GLN 62 20.566 23.911 8.166
494 HB2 GLN 62 HB2 GLN 62 18.586 26.187 8.381
495 HB3 GLN 62 HB1 GLN 62 18.655 24.929 7.147
496 HG2 GLN 62 HG2 GLN 62 18.283 23.240 9.003
497 HG3 GLN 62 HG1 GLN 62 17.942 24.602 10.068
498 HE21 GLN 62 HE21 GLN 62 16.512 26.274 8.239
499 HE22 GLN 62 HE22 GLN 62 15.058 25.497 7.832
500 H LYS 63 HN LYS 63 19.866 26.081 6.343
501 HA LYS 63 HA LYS 63 22.516 27.239 6.082
502 HB2 LYS 63 HB2 LYS 63 20.998 26.296 4.193
503 HB3 LYS 63 HB1 LYS 63 20.173 27.849 4.286
504 HG2 LYS 63 HG2 LYS 63 22.269 29.029 3.837
505 HG3 LYS 63 HG1 LYS 63 23.157 27.509 3.857
506 HD2 LYS 63 HD2 LYS 63 21.880 26.708 1.920
507 HD3 LYS 63 HD1 LYS 63 20.945 28.204 1.907
508 HE2 LYS 63 HE2 LYS 63 22.932 29.508 1.423
509 HE3 LYS 63 HE1 LYS 63 23.959 28.087 1.608
510 HZ1 LYS 63 HZ1 LYS 63 21.936 28.598 -0.497
511 HZ2 LYS 63 HZ2 LYS 63 22.634 27.071 -0.236
512 HZ3 LYS 63 HZ3 LYS 63 23.608 28.387 -0.693
513 H GLU 64 HN GLU 64 22.913 29.496 5.832
514 HA GLU 64 HA GLU 64 22.828 31.667 6.560
515 HB2 GLU 64 HB2 GLU 64 19.825 31.523 6.418
516 HB3 GLU 64 HB1 GLU 64 20.893 32.876 6.039
517 HG2 GLU 64 HG2 GLU 64 21.826 31.415 4.154
518 HG3 GLU 64 HG1 GLU 64 20.446 30.353 4.438
519 H SER 65 HN SER 65 22.443 29.346 8.483
520 HA SER 65 HA SER 65 20.746 30.212 10.594
521 HB2 SER 65 HB2 SER 65 22.891 28.178 10.240
522 HB3 SER 65 HB1 SER 65 22.511 28.646 11.893
523 HG SER 65 HG SER 65 20.204 28.365 10.908
524 H THR 66 HN THR 66 21.027 31.858 11.993
525 HA THR 66 HA THR 66 23.492 33.360 11.963
526 HB THR 66 HB THR 66 20.820 33.706 13.313
527 HG1 THR 66 HG1 THR 66 21.026 34.235 11.110
528 HG21 THR 66 HG21 THR 66 23.383 35.239 13.722
529 HG22 THR 66 HG22 THR 66 22.262 34.630 14.937
530 HG23 THR 66 HG23 THR 66 21.813 36.010 13.937
531 H LEU 67 HN LEU 67 25.171 32.747 13.123
532 HA LEU 67 HA LEU 67 24.819 31.286 15.640
533 HB2 LEU 67 HB2 LEU 67 27.281 32.033 14.030
534 HB3 LEU 67 HB1 LEU 67 27.333 31.162 15.558
535 HG LEU 67 HG LEU 67 27.444 29.625 13.615
536 HD11 LEU 67 HD11 LEU 67 26.129 29.170 15.882
537 HD12 LEU 67 HD12 LEU 67 26.075 28.011 14.554
538 HD13 LEU 67 HD13 LEU 67 24.736 29.124 14.802
539 HD21 LEU 67 HD21 LEU 67 25.786 29.483 11.971
540 HD22 LEU 67 HD22 LEU 67 25.863 31.222 12.241
541 HD23 LEU 67 HD23 LEU 67 24.569 30.268 12.974
542 H HIS 68 HN HIS 68 27.019 32.195 17.074
543 HA HIS 68 HA HIS 68 26.743 35.105 17.359
544 HB2 HIS 68 HB2 HIS 68 26.054 33.131 19.537
545 HB3 HIS 68 HB1 HIS 68 26.336 34.845 19.820
546 HD2 HIS 68 HD2 HIS 68 24.593 36.121 17.361
547 HE1 HIS 68 HE1 HIS 68 21.394 33.819 18.874
548 HE2 HIS 68 HE2 HIS 68 22.002 35.784 17.386
549 H ILE 69 HN ILE 69 28.786 35.773 17.324
550 HA ILE 69 HA ILE 69 30.910 34.122 18.521
551 HB ILE 69 HB ILE 69 31.153 36.690 16.933
552 HG12 ILE 69 HG12 ILE 69 31.518 33.838 15.964
553 HG13 ILE 69 HG11 ILE 69 30.048 34.773 15.690
554 HG21 ILE 69 HG21 ILE 69 33.481 35.772 16.587
555 HG22 ILE 69 HG22 ILE 69 33.102 34.528 17.778
556 HG23 ILE 69 HG23 ILE 69 33.124 36.226 18.254
557 HD11 ILE 69 HD11 ILE 69 32.833 35.573 14.795
558 HD12 ILE 69 HD12 ILE 69 31.360 36.504 14.522
559 HD13 ILE 69 HD13 ILE 69 31.565 34.932 13.751
560 H VAL 70 HN VAL 70 30.965 34.438 20.689
561 HA VAL 70 HA VAL 70 30.706 37.162 21.778
562 HB VAL 70 HB VAL 70 31.042 34.612 23.359
563 HG11 VAL 70 HG11 VAL 70 29.674 37.263 23.921
564 HG12 VAL 70 HG12 VAL 70 31.246 36.769 24.551
565 HG13 VAL 70 HG13 VAL 70 29.788 35.907 25.044
566 HG21 VAL 70 HG21 VAL 70 29.189 34.152 21.897
567 HG22 VAL 70 HG22 VAL 70 28.547 35.782 22.099
568 HG23 VAL 70 HG23 VAL 70 28.498 34.643 23.444
569 H TRP 71 HN TRP 71 32.470 38.327 22.140
570 HA TRP 71 HA TRP 71 34.914 37.044 23.142
571 HB2 TRP 71 HB2 TRP 71 35.296 37.038 20.755
572 HB3 TRP 71 HB1 TRP 71 34.795 38.721 20.626
573 HD1 TRP 71 HD1 TRP 71 37.280 36.994 23.046
574 HE1 TRP 71 HE1 TRP 71 39.501 38.300 22.973
575 HE3 TRP 71 HE3 TRP 71 36.131 40.499 19.512
576 HZ2 TRP 71 HZ2 TRP 71 40.641 40.535 21.600
577 HZ3 TRP 71 HZ3 TRP 71 37.802 42.202 18.840
578 HH2 TRP 71 HH2 TRP 71 40.053 42.225 19.879
579 H ARG 72 HN ARG 72 35.298 38.110 24.956
580 HA ARG 72 HA ARG 72 35.595 41.000 24.918
581 HB2 ARG 72 HB2 ARG 72 33.190 40.699 25.440
582 HB3 ARG 72 HB1 ARG 72 33.634 39.694 26.820
583 HG2 ARG 72 HG2 ARG 72 34.859 41.568 27.825
584 HG3 ARG 72 HG1 ARG 72 34.492 42.578 26.426
585 HD2 ARG 72 HD2 ARG 72 32.371 41.310 28.176
586 HD3 ARG 72 HD1 ARG 72 32.977 42.947 28.412
587 HE ARG 72 HE ARG 72 31.118 42.099 26.401
588 HH11 ARG 72 HH21 ARG 72 33.726 44.250 27.120
589 HH12 ARG 72 HH22 ARG 72 33.211 45.473 26.008
590 HH21 ARG 72 HH11 ARG 72 30.430 43.701 24.938
591 HH22 ARG 72 HH12 ARG 72 31.343 45.163 24.773
592 H LEU 73 HN LEU 73 37.373 41.466 26.027
593 HA LEU 73 HA LEU 73 38.705 39.456 27.595
594 HB2 LEU 73 HB2 LEU 73 39.421 42.384 27.350
595 HB3 LEU 73 HB1 LEU 73 40.488 41.050 27.793
596 HG LEU 73 HG LEU 73 39.097 41.345 25.112
597 HD11 LEU 73 HD11 LEU 73 40.774 43.031 25.214
598 HD12 LEU 73 HD12 LEU 73 41.521 41.687 24.350
599 HD13 LEU 73 HD13 LEU 73 41.904 41.964 26.049
600 HD21 LEU 73 HD21 LEU 73 40.899 39.544 24.556
601 HD22 LEU 73 HD22 LEU 73 39.462 39.029 25.436
602 HD23 LEU 73 HD23 LEU 73 40.977 39.296 26.301
603 H ARG 74 HN ARG 74 39.038 39.385 29.781
604 HA ARG 74 HA ARG 74 37.016 40.452 31.463
605 HB2 ARG 74 HB2 ARG 74 39.668 39.138 32.094
606 HB3 ARG 74 HB1 ARG 74 38.454 39.542 33.308
607 HG2 ARG 74 HG2 ARG 74 36.852 38.054 32.344
608 HG3 ARG 74 HG1 ARG 74 37.820 37.848 30.885
609 HD2 ARG 74 HD2 ARG 74 38.109 35.882 32.274
610 HD3 ARG 74 HD1 ARG 74 39.611 36.800 32.280
611 HE ARG 74 HE ARG 74 39.254 37.315 34.539
612 HH11 ARG 74 HH21 ARG 74 36.498 35.793 33.098
613 HH12 ARG 74 HH22 ARG 74 35.698 35.501 34.605
614 HH21 ARG 74 HH11 ARG 74 38.207 36.937 36.521
615 HH22 ARG 74 HH12 ARG 74 36.666 36.147 36.544
616 H GLY 75 HN GLY 75 40.343 41.400 30.761
617 HA2 GLY 75 HA2 GLY 75 40.000 44.109 31.305
618 HA3 GLY 75 HA1 GLY 75 40.584 43.370 32.793
619 H GLY 76 HN GLY 76 42.201 45.211 31.780
620 HA2 GLY 76 HA2 GLY 76 44.640 43.878 31.355
621 HA3 GLY 76 HA1 GLY 76 44.041 44.439 29.797
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 25.862 22.978 1.819
2 H2 MET 1 HT2 MET 1 26.936 24.285 1.980
3 H3 MET 1 HT3 MET 1 25.555 24.431 1.000
4 HA MET 1 HA MET 1 24.268 25.008 2.696
5 HB2 MET 1 HB2 MET 1 24.282 22.568 3.328
6 HB3 MET 1 HB1 MET 1 25.651 22.907 4.390
7 HG2 MET 1 HG2 MET 1 24.272 24.586 5.596
8 HG3 MET 1 HG1 MET 1 22.901 24.178 4.566
9 HE1 MET 1 HE1 MET 1 24.595 23.698 7.744
10 HE2 MET 1 HE2 MET 1 25.656 22.586 6.886
11 HE3 MET 1 HE3 MET 1 24.586 21.977 8.146
12 H GLN 2 HN GLN 2 25.402 27.008 2.682
13 HA GLN 2 HA GLN 2 27.653 27.372 4.509
14 HB2 GLN 2 HB2 GLN 2 26.185 29.306 2.698
15 HB3 GLN 2 HB1 GLN 2 27.604 29.709 3.668
16 HG2 GLN 2 HG2 GLN 2 28.918 28.002 2.488
17 HG3 GLN 2 HG1 GLN 2 27.503 27.556 1.536
18 HE21 GLN 2 HE21 GLN 2 30.246 29.562 1.552
19 HE22 GLN 2 HE22 GLN 2 29.771 30.630 0.323
20 H ILE 3 HN ILE 3 27.485 29.528 5.832
21 HA ILE 3 HA ILE 3 24.834 29.973 6.986
22 HB ILE 3 HB ILE 3 25.754 29.620 9.305
23 HG12 ILE 3 HG12 ILE 3 27.929 28.087 7.854
24 HG13 ILE 3 HG11 ILE 3 28.162 29.703 8.517
25 HG21 ILE 3 HG21 ILE 3 25.799 27.135 7.572
26 HG22 ILE 3 HG22 ILE 3 24.318 27.957 8.063
27 HG23 ILE 3 HG23 ILE 3 25.371 27.238 9.279
28 HD11 ILE 3 HD11 ILE 3 27.124 27.427 10.208
29 HD12 ILE 3 HD12 ILE 3 27.798 28.966 10.745
30 HD13 ILE 3 HD13 ILE 3 28.848 27.747 10.024
31 H PHE 4 HN PHE 4 24.637 31.944 8.023
32 HA PHE 4 HA PHE 4 26.911 33.810 7.674
33 HB2 PHE 4 HB2 PHE 4 24.063 34.610 8.252
34 HB3 PHE 4 HB1 PHE 4 25.342 35.555 7.499
35 HD1 PHE 4 HD1 PHE 4 26.301 33.242 5.589
36 HD2 PHE 4 HD2 PHE 4 22.444 34.911 6.511
37 HE1 PHE 4 HE1 PHE 4 25.475 32.562 3.365
38 HE2 PHE 4 HE2 PHE 4 21.625 34.223 4.277
39 HZ PHE 4 HZ PHE 4 23.137 33.049 2.705
40 H VAL 5 HN VAL 5 28.068 34.085 9.428
41 HA VAL 5 HA VAL 5 26.891 33.740 12.090
42 HB VAL 5 HB VAL 5 29.197 33.912 12.886
43 HG11 VAL 5 HG11 VAL 5 30.080 31.903 11.799
44 HG12 VAL 5 HG12 VAL 5 28.992 32.143 10.431
45 HG13 VAL 5 HG13 VAL 5 28.339 31.733 12.016
46 HG21 VAL 5 HG21 VAL 5 31.009 34.061 11.124
47 HG22 VAL 5 HG22 VAL 5 30.108 35.552 11.400
48 HG23 VAL 5 HG23 VAL 5 29.749 34.551 9.999
49 H LYS 6 HN LYS 6 26.534 35.348 13.520
50 HA LYS 6 HA LYS 6 26.424 38.048 12.557
51 HB2 LYS 6 HB2 LYS 6 24.804 37.067 14.196
52 HB3 LYS 6 HB1 LYS 6 26.094 37.067 15.400
53 HG2 LYS 6 HG2 LYS 6 26.337 39.498 15.171
54 HG3 LYS 6 HG1 LYS 6 25.090 39.520 13.923
55 HD2 LYS 6 HD2 LYS 6 23.473 38.580 15.577
56 HD3 LYS 6 HD1 LYS 6 24.721 38.695 16.818
57 HE2 LYS 6 HE2 LYS 6 23.663 41.032 15.201
58 HE3 LYS 6 HE1 LYS 6 23.191 40.654 16.857
59 HZ1 LYS 6 HZ1 LYS 6 25.762 40.685 17.218
60 HZ2 LYS 6 HZ2 LYS 6 24.871 42.131 17.218
61 HZ3 LYS 6 HZ3 LYS 6 25.744 41.670 15.838
62 H GLY 7 HN GLY 7 28.313 39.071 12.217
63 HA2 GLY 7 HA2 GLY 7 30.639 38.654 13.854
64 HA3 GLY 7 HA1 GLY 7 30.469 39.840 12.564
65 H LEU 8 HN LEU 8 31.674 40.227 15.166
66 HA LEU 8 HA LEU 8 29.975 41.596 16.957
67 HB2 LEU 8 HB2 LEU 8 32.948 41.846 16.447
68 HB3 LEU 8 HB1 LEU 8 32.117 42.633 17.785
69 HG LEU 8 HG LEU 8 32.002 39.642 17.299
70 HD11 LEU 8 HD11 LEU 8 34.317 40.144 17.672
71 HD12 LEU 8 HD12 LEU 8 33.681 39.563 19.210
72 HD13 LEU 8 HD13 LEU 8 33.928 41.290 18.954
73 HD21 LEU 8 HD21 LEU 8 31.159 41.495 19.536
74 HD22 LEU 8 HD22 LEU 8 31.545 39.811 19.879
75 HD23 LEU 8 HD23 LEU 8 30.241 40.203 18.766
76 H THR 9 HN THR 9 31.827 42.659 14.150
77 HA THR 9 HA THR 9 31.559 45.432 14.460
78 HB THR 9 HB THR 9 31.593 43.896 11.854
79 HG1 THR 9 HG1 THR 9 33.518 44.440 13.789
80 HG21 THR 9 HG21 THR 9 32.695 45.951 11.023
81 HG22 THR 9 HG22 THR 9 32.476 46.695 12.607
82 HG23 THR 9 HG23 THR 9 31.071 46.282 11.626
83 H GLY 10 HN GLY 10 29.526 43.198 12.542
84 HA2 GLY 10 HA2 GLY 10 27.033 43.955 13.182
85 HA3 GLY 10 HA1 GLY 10 27.527 45.279 12.130
86 H LYS 11 HN LYS 11 29.090 43.877 10.285
87 HA LYS 11 HA LYS 11 27.019 42.715 8.644
88 HB2 LYS 11 HB2 LYS 11 29.983 43.125 8.193
89 HB3 LYS 11 HB1 LYS 11 28.882 42.466 6.983
90 HG2 LYS 11 HG2 LYS 11 27.511 44.523 7.117
91 HG3 LYS 11 HG1 LYS 11 28.635 45.186 8.303
92 HD2 LYS 11 HD2 LYS 11 30.466 45.042 6.650
93 HD3 LYS 11 HD1 LYS 11 29.336 44.391 5.462
94 HE2 LYS 11 HE2 LYS 11 28.003 46.451 5.572
95 HE3 LYS 11 HE1 LYS 11 29.092 47.104 6.797
96 HZ1 LYS 11 HZ1 LYS 11 30.078 46.217 4.155
97 HZ2 LYS 11 HZ2 LYS 11 30.835 47.243 5.277
98 HZ3 LYS 11 HZ3 LYS 11 29.487 47.789 4.398
99 H THR 12 HN THR 12 26.677 40.608 8.184
100 HA THR 12 HA THR 12 27.840 38.627 9.898
101 HB THR 12 HB THR 12 26.311 37.116 8.936
102 HG1 THR 12 HG1 THR 12 26.776 38.664 6.710
103 HG21 THR 12 HG21 THR 12 25.046 39.844 8.597
104 HG22 THR 12 HG22 THR 12 25.264 39.031 10.147
105 HG23 THR 12 HG23 THR 12 24.207 38.327 8.922
106 H THR 13 HN THR 13 28.760 36.579 9.022
107 HA THR 13 HA THR 13 30.479 37.061 6.645
108 HB THR 13 HB THR 13 31.210 36.231 9.424
109 HG1 THR 13 HG1 THR 13 33.177 37.351 8.324
110 HG21 THR 13 HG21 THR 13 32.470 35.144 6.904
111 HG22 THR 13 HG22 THR 13 31.980 34.262 8.350
112 HG23 THR 13 HG23 THR 13 33.389 35.321 8.399
113 H THR 14 HN THR 14 30.365 35.531 5.138
114 HA THR 14 HA THR 14 28.689 33.212 5.567
115 HB THR 14 HB THR 14 29.220 32.745 3.171
116 HG1 THR 14 HG1 THR 14 30.333 35.136 2.673
117 HG21 THR 14 HG21 THR 14 28.151 34.859 2.307
118 HG22 THR 14 HG22 THR 14 28.320 35.534 3.927
119 HG23 THR 14 HG23 THR 14 27.300 34.119 3.663
120 H LEU 15 HN LEU 15 29.341 31.192 6.008
121 HA LEU 15 HA LEU 15 32.226 30.528 5.793
122 HB2 LEU 15 HB2 LEU 15 30.358 30.304 8.125
123 HB3 LEU 15 HB1 LEU 15 31.588 29.059 7.933
124 HG LEU 15 HG LEU 15 32.440 31.941 7.712
125 HD11 LEU 15 HD11 LEU 15 31.218 32.156 9.722
126 HD12 LEU 15 HD12 LEU 15 32.859 31.807 10.261
127 HD13 LEU 15 HD13 LEU 15 31.641 30.531 10.259
128 HD21 LEU 15 HD21 LEU 15 34.484 31.013 8.751
129 HD22 LEU 15 HD22 LEU 15 34.041 30.106 7.305
130 HD23 LEU 15 HD23 LEU 15 33.692 29.445 8.903
131 H GLU 16 HN GLU 16 32.712 28.439 5.230
132 HA GLU 16 HA GLU 16 30.555 26.952 3.914
133 HB2 GLU 16 HB2 GLU 16 32.684 27.365 2.710
134 HB3 GLU 16 HB1 GLU 16 33.540 26.431 3.938
135 HG2 GLU 16 HG2 GLU 16 32.262 24.438 3.387
136 HG3 GLU 16 HG1 GLU 16 31.256 25.351 2.264
137 H VAL 17 HN VAL 17 29.534 25.358 4.911
138 HA VAL 17 HA VAL 17 30.991 23.582 6.748
139 HB VAL 17 HB VAL 17 29.172 23.741 8.418
140 HG11 VAL 17 HG11 VAL 17 30.261 26.504 7.850
141 HG12 VAL 17 HG12 VAL 17 31.285 25.198 8.446
142 HG13 VAL 17 HG13 VAL 17 29.928 25.766 9.417
143 HG21 VAL 17 HG21 VAL 17 28.218 25.957 6.581
144 HG22 VAL 17 HG22 VAL 17 27.621 25.713 8.224
145 HG23 VAL 17 HG23 VAL 17 27.351 24.478 6.994
146 H GLU 18 HN GLU 18 29.671 21.637 7.289
147 HA GLU 18 HA GLU 18 27.540 21.037 5.357
148 HB2 GLU 18 HB2 GLU 18 30.025 19.348 5.730
149 HB3 GLU 18 HB1 GLU 18 28.605 18.865 4.807
150 HG2 GLU 18 HG2 GLU 18 30.036 19.732 3.155
151 HG3 GLU 18 HG1 GLU 18 28.963 21.087 3.498
152 HA PRO 19 HA PRO 19 25.428 19.157 8.791
153 HB2 PRO 19 HB2 PRO 19 25.277 16.715 7.040
154 HB3 PRO 19 HB1 PRO 19 23.997 17.496 7.992
155 HG2 PRO 19 HG2 PRO 19 24.181 17.836 5.345
156 HG3 PRO 19 HG1 PRO 19 23.645 19.140 6.420
157 HD2 PRO 19 HD2 PRO 19 26.216 18.877 4.944
158 HD3 PRO 19 HD1 PRO 19 25.408 20.335 5.563
159 H SER 20 HN SER 20 27.630 16.947 7.059
160 HA SER 20 HA SER 20 28.211 15.284 9.273
161 HB2 SER 20 HB2 SER 20 30.076 14.473 7.912
162 HB3 SER 20 HB1 SER 20 28.617 14.620 6.937
163 HG SER 20 HG SER 20 30.629 16.616 7.150
164 H ASP 21 HN ASP 21 29.597 18.288 8.106
165 HA ASP 21 HA ASP 21 32.008 18.277 9.538
166 HB2 ASP 21 HB2 ASP 21 31.265 19.924 7.750
167 HB3 ASP 21 HB1 ASP 21 30.333 20.732 9.014
168 H THR 22 HN THR 22 32.443 18.382 11.640
169 HA THR 22 HA THR 22 30.291 18.737 13.557
170 HB THR 22 HB THR 22 31.928 18.088 15.212
171 HG1 THR 22 HG1 THR 22 33.861 18.165 13.150
172 HG21 THR 22 HG21 THR 22 31.038 16.253 13.895
173 HG22 THR 22 HG22 THR 22 32.748 15.949 14.198
174 HG23 THR 22 HG23 THR 22 32.224 16.542 12.623
175 H ILE 23 HN ILE 23 30.376 20.269 15.300
176 HA ILE 23 HA ILE 23 30.896 22.918 14.503
177 HB ILE 23 HB ILE 23 30.295 21.591 17.142
178 HG12 ILE 23 HG12 ILE 23 28.226 22.781 16.981
179 HG13 ILE 23 HG11 ILE 23 28.849 23.843 15.723
180 HG21 ILE 23 HG21 ILE 23 30.138 23.979 18.073
181 HG22 ILE 23 HG22 ILE 23 31.135 24.463 16.702
182 HG23 ILE 23 HG23 ILE 23 31.762 23.316 17.885
183 HD11 ILE 23 HD11 ILE 23 28.658 20.864 15.291
184 HD12 ILE 23 HD12 ILE 23 28.763 22.139 14.080
185 HD13 ILE 23 HD13 ILE 23 27.279 21.917 15.003
186 H GLU 24 HN GLU 24 32.922 20.478 15.888
187 HA GLU 24 HA GLU 24 34.935 22.084 17.030
188 HB2 GLU 24 HB2 GLU 24 35.077 19.363 15.708
189 HB3 GLU 24 HB1 GLU 24 36.417 20.100 16.588
190 HG2 GLU 24 HG2 GLU 24 35.085 20.203 18.623
191 HG3 GLU 24 HG1 GLU 24 33.669 19.599 17.765
192 H ASN 25 HN ASN 25 34.446 20.874 13.737
193 HA ASN 25 HA ASN 25 36.833 21.989 12.656
194 HB2 ASN 25 HB2 ASN 25 35.438 20.139 11.630
195 HB3 ASN 25 HB1 ASN 25 34.279 21.383 11.156
196 HD21 ASN 25 HD21 ASN 25 34.642 22.231 9.107
197 HD22 ASN 25 HD22 ASN 25 36.142 22.251 8.312
198 H VAL 26 HN VAL 26 33.457 23.080 12.818
199 HA VAL 26 HA VAL 26 33.666 25.414 11.300
200 HB VAL 26 HB VAL 26 31.994 25.127 13.810
201 HG11 VAL 26 HG11 VAL 26 31.387 26.592 11.232
202 HG12 VAL 26 HG12 VAL 26 32.181 27.372 12.598
203 HG13 VAL 26 HG13 VAL 26 30.550 26.730 12.778
204 HG21 VAL 26 HG21 VAL 26 30.282 24.108 12.413
205 HG22 VAL 26 HG22 VAL 26 31.757 23.161 12.262
206 HG23 VAL 26 HG23 VAL 26 31.297 24.276 10.982
207 H LYS 27 HN LYS 27 34.231 24.926 14.783
208 HA LYS 27 HA LYS 27 34.903 27.600 15.399
209 HB2 LYS 27 HB2 LYS 27 35.628 24.956 16.675
210 HB3 LYS 27 HB1 LYS 27 36.177 26.497 17.334
211 HG2 LYS 27 HG2 LYS 27 33.857 27.259 17.553
212 HG3 LYS 27 HG1 LYS 27 33.278 25.758 16.830
213 HD2 LYS 27 HD2 LYS 27 34.191 24.462 18.682
214 HD3 LYS 27 HD1 LYS 27 34.906 25.914 19.383
215 HE2 LYS 27 HE2 LYS 27 32.667 26.887 19.690
216 HE3 LYS 27 HE1 LYS 27 31.937 25.456 18.962
217 HZ1 LYS 27 HZ1 LYS 27 32.052 24.403 20.892
218 HZ2 LYS 27 HZ2 LYS 27 32.598 25.837 21.622
219 HZ3 LYS 27 HZ3 LYS 27 33.716 24.704 21.026
220 H ALA 28 HN ALA 28 36.798 24.881 14.180
221 HA ALA 28 HA ALA 28 39.354 26.096 14.430
222 HB1 ALA 28 HB1 ALA 28 38.502 24.035 12.383
223 HB2 ALA 28 HB2 ALA 28 38.926 23.644 14.050
224 HB3 ALA 28 HB3 ALA 28 40.136 24.342 12.973
225 H LYS 29 HN LYS 29 36.979 25.954 11.798
226 HA LYS 29 HA LYS 29 38.501 27.332 9.858
227 HB2 LYS 29 HB2 LYS 29 35.509 27.102 10.257
228 HB3 LYS 29 HB1 LYS 29 36.252 27.829 8.834
229 HG2 LYS 29 HG2 LYS 29 37.078 25.057 9.691
230 HG3 LYS 29 HG1 LYS 29 35.577 25.279 8.797
231 HD2 LYS 29 HD2 LYS 29 36.854 26.484 7.018
232 HD3 LYS 29 HD1 LYS 29 38.345 26.127 7.888
233 HE2 LYS 29 HE2 LYS 29 37.884 23.711 7.699
234 HE3 LYS 29 HE1 LYS 29 36.396 24.066 6.822
235 HZ1 LYS 29 HZ1 LYS 29 38.800 23.673 5.677
236 HZ2 LYS 29 HZ2 LYS 29 38.736 25.369 5.758
237 HZ3 LYS 29 HZ3 LYS 29 37.512 24.508 4.955
238 H ILE 30 HN ILE 30 36.196 28.406 12.302
239 HA ILE 30 HA ILE 30 36.165 31.147 11.640
240 HB ILE 30 HB ILE 30 35.650 29.677 14.229
241 HG12 ILE 30 HG12 ILE 30 33.689 31.048 12.382
242 HG13 ILE 30 HG11 ILE 30 34.162 29.364 12.157
243 HG21 ILE 30 HG21 ILE 30 34.432 31.855 14.823
244 HG22 ILE 30 HG22 ILE 30 35.370 32.603 13.530
245 HG23 ILE 30 HG23 ILE 30 36.193 31.889 14.916
246 HD11 ILE 30 HD11 ILE 30 33.225 28.699 14.215
247 HD12 ILE 30 HD12 ILE 30 32.050 29.851 13.587
248 HD13 ILE 30 HD13 ILE 30 33.189 30.348 14.837
249 H GLN 31 HN GLN 31 38.181 29.280 13.900
250 HA GLN 31 HA GLN 31 39.584 31.300 15.152
251 HB2 GLN 31 HB2 GLN 31 39.783 28.828 15.589
252 HB3 GLN 31 HB1 GLN 31 40.814 28.718 14.158
253 HG2 GLN 31 HG2 GLN 31 42.449 30.196 15.138
254 HG3 GLN 31 HG1 GLN 31 41.379 30.571 16.487
255 HE21 GLN 31 HE21 GLN 31 43.989 29.485 16.935
256 HE22 GLN 31 HE22 GLN 31 43.813 27.917 17.561
257 H ASP 32 HN ASP 32 39.460 30.663 11.851
258 HA ASP 32 HA ASP 32 42.115 31.694 11.212
259 HB2 ASP 32 HB2 ASP 32 40.964 29.888 9.872
260 HB3 ASP 32 HB1 ASP 32 39.829 31.119 9.321
261 H LYS 33 HN LYS 33 38.746 32.754 11.162
262 HA LYS 33 HA LYS 33 39.477 35.345 10.005
263 HB2 LYS 33 HB2 LYS 33 36.813 34.175 10.829
264 HB3 LYS 33 HB1 LYS 33 37.027 35.772 10.111
265 HG2 LYS 33 HG2 LYS 33 38.121 34.695 8.141
266 HG3 LYS 33 HG1 LYS 33 37.758 33.117 8.845
267 HD2 LYS 33 HD2 LYS 33 35.352 33.651 8.819
268 HD3 LYS 33 HD1 LYS 33 35.709 35.231 8.119
269 HE2 LYS 33 HE2 LYS 33 36.759 34.102 6.169
270 HE3 LYS 33 HE1 LYS 33 36.310 32.541 6.855
271 HZ1 LYS 33 HZ1 LYS 33 34.710 34.412 5.415
272 HZ2 LYS 33 HZ2 LYS 33 34.005 34.012 6.908
273 HZ3 LYS 33 HZ3 LYS 33 34.391 32.789 5.792
274 H THR 34 HN THR 34 39.226 33.956 13.092
275 HA THR 34 HA THR 34 38.788 36.606 14.366
276 HB THR 34 HB THR 34 38.155 35.312 16.383
277 HG1 THR 34 HG1 THR 34 39.200 33.404 16.069
278 HG21 THR 34 HG21 THR 34 36.634 34.582 13.865
279 HG22 THR 34 HG22 THR 34 36.423 36.058 14.806
280 HG23 THR 34 HG23 THR 34 35.993 34.498 15.505
281 H GLY 35 HN GLY 35 40.784 33.692 14.324
282 HA2 GLY 35 HA2 GLY 35 42.915 33.285 15.086
283 HA3 GLY 35 HA1 GLY 35 43.174 35.019 14.933
284 H LEU 36 HN LEU 36 41.733 32.589 17.103
285 HA LEU 36 HA LEU 36 42.967 33.882 19.388
286 HB2 LEU 36 HB2 LEU 36 40.530 33.745 20.517
287 HB3 LEU 36 HB1 LEU 36 41.084 35.191 19.677
288 HG LEU 36 HG LEU 36 39.952 34.472 17.629
289 HD11 LEU 36 HD11 LEU 36 40.025 32.126 17.598
290 HD12 LEU 36 HD12 LEU 36 38.333 32.436 17.969
291 HD13 LEU 36 HD13 LEU 36 39.448 31.983 19.259
292 HD21 LEU 36 HD21 LEU 36 38.584 35.797 19.069
293 HD22 LEU 36 HD22 LEU 36 38.318 34.451 20.176
294 HD23 LEU 36 HD23 LEU 36 37.568 34.440 18.579
295 HA PRO 37 HA PRO 37 43.259 29.726 20.802
296 HB2 PRO 37 HB2 PRO 37 42.747 30.024 23.536
297 HB3 PRO 37 HB1 PRO 37 44.308 30.341 22.757
298 HG2 PRO 37 HG2 PRO 37 42.161 32.266 23.533
299 HG3 PRO 37 HG1 PRO 37 43.923 32.433 23.649
300 HD2 PRO 37 HD2 PRO 37 42.529 33.643 21.682
301 HD3 PRO 37 HD1 PRO 37 44.152 32.980 21.387
302 HA PRO 38 HA PRO 38 39.242 27.937 20.918
303 HB2 PRO 38 HB2 PRO 38 39.593 25.697 22.487
304 HB3 PRO 38 HB1 PRO 38 40.200 25.838 20.825
305 HG2 PRO 38 HG2 PRO 38 41.659 26.214 23.405
306 HG3 PRO 38 HG1 PRO 38 42.187 25.397 21.922
307 HD2 PRO 38 HD2 PRO 38 42.999 27.920 22.546
308 HD3 PRO 38 HD1 PRO 38 42.762 27.394 20.865
309 H ASP 39 HN ASP 39 40.749 28.682 23.982
310 HA ASP 39 HA ASP 39 38.411 28.252 25.587
311 HB2 ASP 39 HB2 ASP 39 39.668 29.484 27.326
312 HB3 ASP 39 HB1 ASP 39 40.630 28.198 26.598
313 H GLN 40 HN GLN 40 39.003 30.416 23.202
314 HA GLN 40 HA GLN 40 37.305 32.527 24.424
315 HB2 GLN 40 HB2 GLN 40 39.501 32.692 22.355
316 HB3 GLN 40 HB1 GLN 40 38.305 33.972 22.557
317 HG2 GLN 40 HG2 GLN 40 38.939 34.227 24.910
318 HG3 GLN 40 HG1 GLN 40 40.101 32.912 24.756
319 HE21 GLN 40 HE21 GLN 40 41.560 34.872 25.504
320 HE22 GLN 40 HE22 GLN 40 42.245 35.794 24.255
321 H GLN 41 HN GLN 41 37.072 29.904 22.612
322 HA GLN 41 HA GLN 41 35.480 31.020 20.412
323 HB2 GLN 41 HB2 GLN 41 36.426 28.234 21.094
324 HB3 GLN 41 HB1 GLN 41 35.268 28.551 19.802
325 HG2 GLN 41 HG2 GLN 41 36.875 30.067 18.719
326 HG3 GLN 41 HG1 GLN 41 38.034 29.776 20.014
327 HE21 GLN 41 HE21 GLN 41 38.023 29.060 16.990
328 HE22 GLN 41 HE22 GLN 41 38.410 27.407 16.976
329 H ARG 42 HN ARG 42 33.389 31.374 20.680
330 HA ARG 42 HA ARG 42 31.779 29.506 22.290
331 HB2 ARG 42 HB2 ARG 42 32.382 31.432 23.764
332 HB3 ARG 42 HB1 ARG 42 31.606 32.514 22.604
333 HG2 ARG 42 HG2 ARG 42 29.471 31.379 22.902
334 HG3 ARG 42 HG1 ARG 42 30.220 30.187 23.965
335 HD2 ARG 42 HD2 ARG 42 30.846 32.041 25.521
336 HD3 ARG 42 HD1 ARG 42 29.953 33.157 24.493
337 HE ARG 42 HE ARG 42 27.977 32.309 25.373
338 HH11 ARG 42 HH21 ARG 42 30.657 30.236 26.079
339 HH12 ARG 42 HH22 ARG 42 29.757 29.205 27.139
340 HH21 ARG 42 HH11 ARG 42 26.789 30.953 26.755
341 HH22 ARG 42 HH12 ARG 42 27.567 29.607 27.519
342 H LEU 43 HN LEU 43 30.136 28.857 21.099
343 HA LEU 43 HA LEU 43 28.954 30.715 19.109
344 HB2 LEU 43 HB2 LEU 43 29.446 27.744 18.790
345 HB3 LEU 43 HB1 LEU 43 28.623 28.781 17.621
346 HG LEU 43 HG LEU 43 31.469 29.224 18.583
347 HD11 LEU 43 HD11 LEU 43 31.365 27.135 17.342
348 HD12 LEU 43 HD12 LEU 43 32.104 28.368 16.319
349 HD13 LEU 43 HD13 LEU 43 30.422 27.902 16.063
350 HD21 LEU 43 HD21 LEU 43 29.666 30.566 16.568
351 HD22 LEU 43 HD22 LEU 43 31.410 30.572 16.317
352 HD23 LEU 43 HD23 LEU 43 30.731 31.297 17.767
353 H ILE 44 HN ILE 44 26.820 30.866 19.099
354 HA ILE 44 HA ILE 44 25.178 28.886 20.546
355 HB ILE 44 HB ILE 44 25.208 31.875 21.027
356 HG12 ILE 44 HG12 ILE 44 25.234 29.615 23.035
357 HG13 ILE 44 HG11 ILE 44 26.720 30.243 22.331
358 HG21 ILE 44 HG21 ILE 44 23.096 29.804 21.655
359 HG22 ILE 44 HG22 ILE 44 22.891 31.350 20.832
360 HG23 ILE 44 HG23 ILE 44 23.229 31.310 22.563
361 HD11 ILE 44 HD11 ILE 44 25.973 31.279 24.558
362 HD12 ILE 44 HD12 ILE 44 24.687 32.055 23.633
363 HD13 ILE 44 HD13 ILE 44 26.376 32.402 23.259
364 H PHE 45 HN PHE 45 23.417 28.346 19.428
365 HA PHE 45 HA PHE 45 22.510 30.124 17.222
366 HB2 PHE 45 HB2 PHE 45 23.654 28.112 16.371
367 HB3 PHE 45 HB1 PHE 45 22.545 27.092 17.277
368 HD1 PHE 45 HD1 PHE 45 22.528 29.904 14.794
369 HD2 PHE 45 HD2 PHE 45 20.560 26.386 16.259
370 HE1 PHE 45 HE1 PHE 45 20.879 30.064 12.954
371 HE2 PHE 45 HE2 PHE 45 18.907 26.540 14.416
372 HZ PHE 45 HZ PHE 45 19.070 28.380 12.759
373 H ALA 46 HN ALA 46 20.395 30.628 17.232
374 HA ALA 46 HA ALA 46 18.234 30.817 18.001
375 HB1 ALA 46 HB1 ALA 46 16.952 28.837 17.891
376 HB2 ALA 46 HB2 ALA 46 18.317 27.826 18.368
377 HB3 ALA 46 HB3 ALA 46 18.284 28.565 16.767
378 H GLY 47 HN GLY 47 20.566 30.587 20.000
379 HA2 GLY 47 HA2 GLY 47 20.437 31.192 22.291
380 HA3 GLY 47 HA1 GLY 47 18.854 30.430 22.391
381 H LYS 48 HN LYS 48 20.222 28.124 20.791
382 HA LYS 48 HA LYS 48 20.888 26.571 23.143
383 HB2 LYS 48 HB2 LYS 48 20.785 25.905 20.195
384 HB3 LYS 48 HB1 LYS 48 21.257 24.740 21.432
385 HG2 LYS 48 HG2 LYS 48 19.099 25.058 22.574
386 HG3 LYS 48 HG1 LYS 48 18.622 26.239 21.354
387 HD2 LYS 48 HD2 LYS 48 18.809 24.505 19.603
388 HD3 LYS 48 HD1 LYS 48 19.273 23.323 20.827
389 HE2 LYS 48 HE2 LYS 48 17.119 23.614 21.962
390 HE3 LYS 48 HE1 LYS 48 16.653 24.851 20.795
391 HZ1 LYS 48 HZ1 LYS 48 17.441 22.156 19.896
392 HZ2 LYS 48 HZ2 LYS 48 16.484 23.311 19.099
393 HZ3 LYS 48 HZ3 LYS 48 15.859 22.456 20.428
394 H GLN 49 HN GLN 49 22.864 26.055 23.874
395 HA GLN 49 HA GLN 49 25.168 27.329 22.639
396 HB2 GLN 49 HB2 GLN 49 24.890 27.407 25.078
397 HB3 GLN 49 HB1 GLN 49 24.956 25.645 25.143
398 HG2 GLN 49 HG2 GLN 49 27.222 25.623 24.334
399 HG3 GLN 49 HG1 GLN 49 27.165 27.345 23.963
400 HE21 GLN 49 HE21 GLN 49 29.101 26.102 25.781
401 HE22 GLN 49 HE22 GLN 49 28.825 26.764 27.320
402 H LEU 50 HN LEU 50 26.655 26.382 21.420
403 HA LEU 50 HA LEU 50 26.331 23.581 20.700
404 HB2 LEU 50 HB2 LEU 50 28.442 25.500 19.711
405 HB3 LEU 50 HB1 LEU 50 27.842 24.043 18.919
406 HG LEU 50 HG LEU 50 26.299 26.607 19.409
407 HD11 LEU 50 HD11 LEU 50 26.967 25.203 16.808
408 HD12 LEU 50 HD12 LEU 50 27.949 26.502 17.485
409 HD13 LEU 50 HD13 LEU 50 26.279 26.813 17.011
410 HD21 LEU 50 HD21 LEU 50 25.431 23.868 18.470
411 HD22 LEU 50 HD22 LEU 50 24.543 25.318 18.000
412 HD23 LEU 50 HD23 LEU 50 24.692 24.891 19.703
413 H GLU 51 HN GLU 51 27.875 21.980 20.952
414 HA GLU 51 HA GLU 51 30.245 22.560 22.605
415 HB2 GLU 51 HB2 GLU 51 28.072 20.562 23.252
416 HB3 GLU 51 HB1 GLU 51 29.698 20.457 23.932
417 HG2 GLU 51 HG2 GLU 51 29.455 22.749 24.839
418 HG3 GLU 51 HG1 GLU 51 27.817 22.823 24.189
419 H ASP 52 HN ASP 52 31.766 20.724 22.631
420 HA ASP 52 HA ASP 52 32.173 19.719 19.991
421 HB2 ASP 52 HB2 ASP 52 33.548 19.119 22.618
422 HB3 ASP 52 HB1 ASP 52 34.087 18.494 21.061
423 H GLY 53 HN GLY 53 31.962 17.653 19.188
424 HA2 GLY 53 HA2 GLY 53 31.511 15.334 19.276
425 HA3 GLY 53 HA1 GLY 53 30.892 15.527 20.912
426 H ARG 54 HN ARG 54 29.757 17.930 18.818
427 HA ARG 54 HA ARG 54 27.278 16.427 18.182
428 HB2 ARG 54 HB2 ARG 54 27.565 19.111 19.533
429 HB3 ARG 54 HB1 ARG 54 26.087 18.654 18.684
430 HG2 ARG 54 HG2 ARG 54 25.864 16.664 20.108
431 HG3 ARG 54 HG1 ARG 54 27.365 17.075 20.938
432 HD2 ARG 54 HD2 ARG 54 26.372 19.181 21.723
433 HD3 ARG 54 HD1 ARG 54 24.881 18.810 20.864
434 HE ARG 54 HE ARG 54 24.320 17.337 22.575
435 HH11 ARG 54 HH21 ARG 54 27.664 18.215 22.712
436 HH12 ARG 54 HH22 ARG 54 27.941 17.466 24.249
437 HH21 ARG 54 HH11 ARG 54 24.675 16.357 24.598
438 HH22 ARG 54 HH12 ARG 54 26.251 16.417 25.316
439 H THR 55 HN THR 55 26.624 16.652 16.137
440 HA THR 55 HA THR 55 28.097 18.460 14.363
441 HB THR 55 HB THR 55 26.665 17.221 12.603
442 HG1 THR 55 HG1 THR 55 26.011 15.131 13.519
443 HG21 THR 55 HG21 THR 55 28.699 15.829 14.358
444 HG22 THR 55 HG22 THR 55 28.987 16.672 12.836
445 HG23 THR 55 HG23 THR 55 28.105 15.145 12.845
446 H LEU 56 HN LEU 56 26.616 19.364 12.514
447 HA LEU 56 HA LEU 56 24.936 21.340 13.670
448 HB2 LEU 56 HB2 LEU 56 25.165 20.427 10.795
449 HB3 LEU 56 HB1 LEU 56 24.399 21.917 11.330
450 HG LEU 56 HG LEU 56 27.267 21.305 12.070
451 HD11 LEU 56 HD11 LEU 56 26.333 22.751 9.573
452 HD12 LEU 56 HD12 LEU 56 27.046 21.140 9.597
453 HD13 LEU 56 HD13 LEU 56 28.005 22.535 10.091
454 HD21 LEU 56 HD21 LEU 56 26.302 23.164 13.270
455 HD22 LEU 56 HD22 LEU 56 25.600 23.829 11.796
456 HD23 LEU 56 HD23 LEU 56 27.346 23.843 12.026
457 H SER 57 HN SER 57 24.361 18.228 12.196
458 HA SER 57 HA SER 57 21.578 18.427 11.787
459 HB2 SER 57 HB2 SER 57 23.415 16.081 12.234
460 HB3 SER 57 HB1 SER 57 21.687 15.878 11.957
461 HG SER 57 HG SER 57 22.804 15.804 9.997
462 H ASP 58 HN ASP 58 23.411 18.156 14.680
463 HA ASP 58 HA ASP 58 21.263 16.981 16.257
464 HB2 ASP 58 HB2 ASP 58 23.971 18.127 16.950
465 HB3 ASP 58 HB1 ASP 58 22.828 17.590 18.175
466 H TYR 59 HN TYR 59 22.778 20.133 15.770
467 HA TYR 59 HA TYR 59 21.011 21.476 17.631
468 HB2 TYR 59 HB2 TYR 59 22.983 22.572 15.614
469 HB3 TYR 59 HB1 TYR 59 22.171 23.510 16.867
470 HD1 TYR 59 HD2 TYR 59 22.458 22.680 19.320
471 HD2 TYR 59 HD1 TYR 59 25.029 21.517 16.081
472 HE1 TYR 59 HE2 TYR 59 24.221 22.047 20.944
473 HE2 TYR 59 HE1 TYR 59 26.792 20.885 17.706
474 HH TYR 59 HH TYR 59 27.430 21.011 19.862
475 H ASN 60 HN ASN 60 20.514 20.209 14.665
476 HA ASN 60 HA ASN 60 18.957 20.528 13.008
477 HB2 ASN 60 HB2 ASN 60 17.668 22.451 14.957
478 HB3 ASN 60 HB1 ASN 60 16.893 21.632 13.604
479 HD21 ASN 60 HD21 ASN 60 16.917 21.470 16.841
480 HD22 ASN 60 HD22 ASN 60 16.791 19.794 17.078
481 H ILE 61 HN ILE 61 21.331 22.320 13.303
482 HA ILE 61 HA ILE 61 20.554 24.922 12.382
483 HB ILE 61 HB ILE 61 23.187 23.453 12.565
484 HG12 ILE 61 HG12 ILE 61 22.241 25.981 13.920
485 HG13 ILE 61 HG11 ILE 61 21.953 24.384 14.604
486 HG21 ILE 61 HG21 ILE 61 23.519 24.867 10.677
487 HG22 ILE 61 HG22 ILE 61 24.165 25.770 12.047
488 HG23 ILE 61 HG23 ILE 61 22.577 26.171 11.396
489 HD11 ILE 61 HD11 ILE 61 24.627 25.684 14.022
490 HD12 ILE 61 HD12 ILE 61 24.451 23.983 14.452
491 HD13 ILE 61 HD13 ILE 61 23.978 25.235 15.599
492 H GLN 62 HN GLN 62 20.158 25.588 10.384
493 HA GLN 62 HA GLN 62 20.674 23.734 8.124
494 HB2 GLN 62 HB2 GLN 62 18.599 25.930 8.350
495 HB3 GLN 62 HB1 GLN 62 18.776 24.782 7.021
496 HG2 GLN 62 HG2 GLN 62 18.302 22.916 8.531
497 HG3 GLN 62 HG1 GLN 62 18.194 24.026 9.898
498 HE21 GLN 62 HE21 GLN 62 15.977 23.950 10.412
499 HE22 GLN 62 HE22 GLN 62 14.735 24.281 9.304
500 H LYS 63 HN LYS 63 20.018 25.790 6.192
501 HA LYS 63 HA LYS 63 22.635 27.030 6.013
502 HB2 LYS 63 HB2 LYS 63 21.232 25.970 4.091
503 HB3 LYS 63 HB1 LYS 63 20.370 27.507 4.082
504 HG2 LYS 63 HG2 LYS 63 22.493 28.708 3.742
505 HG3 LYS 63 HG1 LYS 63 23.371 27.181 3.787
506 HD2 LYS 63 HD2 LYS 63 22.110 26.394 1.815
507 HD3 LYS 63 HD1 LYS 63 21.241 27.927 1.763
508 HE2 LYS 63 HE2 LYS 63 23.434 29.106 1.507
509 HE3 LYS 63 HE1 LYS 63 24.226 27.534 1.416
510 HZ1 LYS 63 HZ1 LYS 63 22.375 27.174 -0.409
511 HZ2 LYS 63 HZ2 LYS 63 23.871 27.891 -0.777
512 HZ3 LYS 63 HZ3 LYS 63 22.499 28.861 -0.527
513 H GLU 64 HN GLU 64 23.036 29.253 5.869
514 HA GLU 64 HA GLU 64 22.811 31.464 6.435
515 HB2 GLU 64 HB2 GLU 64 19.831 31.148 6.129
516 HB3 GLU 64 HB1 GLU 64 20.825 32.571 5.817
517 HG2 GLU 64 HG2 GLU 64 21.988 31.140 4.012
518 HG3 GLU 64 HG1 GLU 64 20.628 30.035 4.193
519 H SER 65 HN SER 65 22.778 29.457 8.510
520 HA SER 65 HA SER 65 20.826 30.271 10.487
521 HB2 SER 65 HB2 SER 65 22.969 28.238 10.267
522 HB3 SER 65 HB1 SER 65 22.646 28.815 11.898
523 HG SER 65 HG SER 65 20.338 28.460 11.221
524 H THR 66 HN THR 66 21.041 31.847 11.982
525 HA THR 66 HA THR 66 23.424 33.500 11.935
526 HB THR 66 HB THR 66 20.763 33.729 13.344
527 HG1 THR 66 HG1 THR 66 20.842 34.175 11.108
528 HG21 THR 66 HG21 THR 66 23.252 35.426 13.545
529 HG22 THR 66 HG22 THR 66 22.250 34.789 14.850
530 HG23 THR 66 HG23 THR 66 21.649 36.102 13.837
531 H LEU 67 HN LEU 67 25.125 32.959 13.103
532 HA LEU 67 HA LEU 67 24.818 31.488 15.628
533 HB2 LEU 67 HB2 LEU 67 27.244 32.275 13.993
534 HB3 LEU 67 HB1 LEU 67 27.327 31.409 15.521
535 HG LEU 67 HG LEU 67 27.458 29.866 13.591
536 HD11 LEU 67 HD11 LEU 67 26.151 29.401 15.858
537 HD12 LEU 67 HD12 LEU 67 26.117 28.234 14.538
538 HD13 LEU 67 HD13 LEU 67 24.762 29.329 14.776
539 HD21 LEU 67 HD21 LEU 67 25.847 31.431 12.212
540 HD22 LEU 67 HD22 LEU 67 24.573 30.452 12.941
541 HD23 LEU 67 HD23 LEU 67 25.808 29.691 11.943
542 H HIS 68 HN HIS 68 27.063 32.425 16.994
543 HA HIS 68 HA HIS 68 26.735 35.327 17.319
544 HB2 HIS 68 HB2 HIS 68 26.286 33.342 19.561
545 HB3 HIS 68 HB1 HIS 68 26.400 35.090 19.757
546 HD2 HIS 68 HD2 HIS 68 24.415 36.180 17.471
547 HE1 HIS 68 HE1 HIS 68 21.570 33.440 18.962
548 HE2 HIS 68 HE2 HIS 68 21.890 35.518 17.537
549 H ILE 69 HN ILE 69 28.794 35.963 17.054
550 HA ILE 69 HA ILE 69 30.998 34.380 18.167
551 HB ILE 69 HB ILE 69 30.942 36.862 16.433
552 HG12 ILE 69 HG12 ILE 69 31.883 34.044 15.817
553 HG13 ILE 69 HG11 ILE 69 30.259 34.623 15.447
554 HG21 ILE 69 HG21 ILE 69 33.220 35.284 17.647
555 HG22 ILE 69 HG22 ILE 69 32.938 37.023 17.725
556 HG23 ILE 69 HG23 ILE 69 33.435 36.279 16.206
557 HD11 ILE 69 HD11 ILE 69 31.167 36.382 14.020
558 HD12 ILE 69 HD12 ILE 69 31.812 34.824 13.504
559 HD13 ILE 69 HD13 ILE 69 32.813 35.921 14.456
560 H VAL 70 HN VAL 70 31.585 34.715 20.190
561 HA VAL 70 HA VAL 70 31.303 37.429 21.370
562 HB VAL 70 HB VAL 70 31.396 34.864 22.953
563 HG11 VAL 70 HG11 VAL 70 31.681 37.209 23.970
564 HG12 VAL 70 HG12 VAL 70 30.432 36.185 24.678
565 HG13 VAL 70 HG13 VAL 70 29.987 37.470 23.556
566 HG21 VAL 70 HG21 VAL 70 29.568 34.558 21.394
567 HG22 VAL 70 HG22 VAL 70 28.998 36.203 21.669
568 HG23 VAL 70 HG23 VAL 70 28.881 35.003 22.956
569 H TRP 71 HN TRP 71 32.994 38.330 22.416
570 HA TRP 71 HA TRP 71 35.507 36.774 22.672
571 HB2 TRP 71 HB2 TRP 71 35.200 38.680 20.768
572 HB3 TRP 71 HB1 TRP 71 35.696 39.710 22.103
573 HD1 TRP 71 HD1 TRP 71 37.660 37.374 23.380
574 HE1 TRP 71 HE1 TRP 71 39.949 37.020 22.262
575 HE3 TRP 71 HE3 TRP 71 36.748 39.488 18.823
576 HZ2 TRP 71 HZ2 TRP 71 41.230 37.564 19.769
577 HZ3 TRP 71 HZ3 TRP 71 38.525 39.558 17.096
578 HH2 TRP 71 HH2 TRP 71 40.764 38.599 17.563
579 H ARG 72 HN ARG 72 36.444 36.928 24.631
580 HA ARG 72 HA ARG 72 35.097 38.059 26.822
581 HB2 ARG 72 HB2 ARG 72 36.789 36.178 26.849
582 HB3 ARG 72 HB1 ARG 72 38.042 37.415 26.717
583 HG2 ARG 72 HG2 ARG 72 37.288 38.466 28.781
584 HG3 ARG 72 HG1 ARG 72 35.931 37.345 28.893
585 HD2 ARG 72 HD2 ARG 72 38.858 36.564 28.969
586 HD3 ARG 72 HD1 ARG 72 37.792 36.658 30.367
587 HE ARG 72 HE ARG 72 36.604 34.952 28.474
588 HH11 ARG 72 HH21 ARG 72 39.369 35.163 30.544
589 HH12 ARG 72 HH22 ARG 72 39.530 33.448 30.736
590 HH21 ARG 72 HH11 ARG 72 36.807 32.703 28.719
591 HH22 ARG 72 HH12 ARG 72 38.080 32.057 29.698
592 H LEU 73 HN LEU 73 38.019 39.185 25.095
593 HA LEU 73 HA LEU 73 38.298 41.535 26.698
594 HB2 LEU 73 HB2 LEU 73 39.971 42.223 25.043
595 HB3 LEU 73 HB1 LEU 73 40.203 40.546 25.521
596 HG LEU 73 HG LEU 73 38.515 40.232 23.356
597 HD11 LEU 73 HD11 LEU 73 40.396 42.508 22.654
598 HD12 LEU 73 HD12 LEU 73 38.651 42.676 22.845
599 HD13 LEU 73 HD13 LEU 73 39.303 41.673 21.549
600 HD21 LEU 73 HD21 LEU 73 40.554 39.613 22.084
601 HD22 LEU 73 HD22 LEU 73 40.598 38.983 23.732
602 HD23 LEU 73 HD23 LEU 73 41.545 40.409 23.307
603 H ARG 74 HN ARG 74 37.561 43.570 26.392
604 HA ARG 74 HA ARG 74 36.181 44.303 23.919
605 HB2 ARG 74 HB2 ARG 74 34.142 45.003 25.157
606 HB3 ARG 74 HB1 ARG 74 34.394 43.259 25.216
607 HG2 ARG 74 HG2 ARG 74 35.547 43.569 27.431
608 HG3 ARG 74 HG1 ARG 74 35.061 45.263 27.386
609 HD2 ARG 74 HD2 ARG 74 33.149 42.916 27.245
610 HD3 ARG 74 HD1 ARG 74 33.485 43.851 28.700
611 HE ARG 74 HE ARG 74 32.614 45.449 26.446
612 HH11 ARG 74 HH21 ARG 74 31.705 43.555 29.196
613 HH12 ARG 74 HH22 ARG 74 30.162 44.321 29.387
614 HH21 ARG 74 HH11 ARG 74 30.589 46.450 26.685
615 HH22 ARG 74 HH12 ARG 74 29.526 45.951 27.960
616 H GLY 75 HN GLY 75 36.080 46.506 23.589
617 HA2 GLY 75 HA2 GLY 75 37.831 48.123 25.274
618 HA3 GLY 75 HA1 GLY 75 37.139 48.592 23.721
619 H GLY 76 HN GLY 76 34.614 47.318 25.300
620 HA2 GLY 76 HA2 GLY 76 32.851 48.130 26.546
621 HA3 GLY 76 HA1 GLY 76 33.936 49.364 27.181
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 26.228 22.901 2.206
2 H2 MET 1 HT2 MET 1 26.944 24.423 1.963
3 H3 MET 1 HT3 MET 1 25.499 24.023 1.164
4 HA MET 1 HA MET 1 24.394 24.986 2.807
5 HB2 MET 1 HB2 MET 1 24.232 22.604 3.503
6 HB3 MET 1 HB1 MET 1 25.668 22.817 4.504
7 HG2 MET 1 HG2 MET 1 24.546 24.446 5.888
8 HG3 MET 1 HG1 MET 1 23.155 24.479 4.807
9 HE1 MET 1 HE1 MET 1 25.462 22.535 6.909
10 HE2 MET 1 HE2 MET 1 24.537 21.258 7.695
11 HE3 MET 1 HE3 MET 1 24.317 22.931 8.200
12 H GLN 2 HN GLN 2 25.419 26.977 2.921
13 HA GLN 2 HA GLN 2 27.730 27.312 4.702
14 HB2 GLN 2 HB2 GLN 2 26.315 29.150 2.766
15 HB3 GLN 2 HB1 GLN 2 27.595 29.699 3.849
16 HG2 GLN 2 HG2 GLN 2 29.154 28.090 2.879
17 HG3 GLN 2 HG1 GLN 2 27.879 27.440 1.848
18 HE21 GLN 2 HE21 GLN 2 29.683 28.197 0.178
19 HE22 GLN 2 HE22 GLN 2 29.506 29.781 -0.408
20 H ILE 3 HN ILE 3 27.642 29.442 5.997
21 HA ILE 3 HA ILE 3 25.023 30.048 7.144
22 HB ILE 3 HB ILE 3 25.928 29.698 9.468
23 HG12 ILE 3 HG12 ILE 3 28.022 28.018 8.060
24 HG13 ILE 3 HG11 ILE 3 28.338 29.635 8.685
25 HG21 ILE 3 HG21 ILE 3 24.399 28.095 8.266
26 HG22 ILE 3 HG22 ILE 3 25.416 27.339 9.491
27 HG23 ILE 3 HG23 ILE 3 25.829 27.183 7.785
28 HD11 ILE 3 HD11 ILE 3 27.174 27.457 10.425
29 HD12 ILE 3 HD12 ILE 3 27.927 28.971 10.929
30 HD13 ILE 3 HD13 ILE 3 28.915 27.681 10.243
31 H PHE 4 HN PHE 4 24.929 32.076 8.072
32 HA PHE 4 HA PHE 4 27.302 33.790 7.635
33 HB2 PHE 4 HB2 PHE 4 24.522 34.769 8.257
34 HB3 PHE 4 HB1 PHE 4 25.831 35.619 7.448
35 HD1 PHE 4 HD1 PHE 4 26.559 33.095 5.623
36 HD2 PHE 4 HD2 PHE 4 22.918 35.216 6.504
37 HE1 PHE 4 HE1 PHE 4 25.629 32.411 3.442
38 HE2 PHE 4 HE2 PHE 4 21.996 34.521 4.315
39 HZ PHE 4 HZ PHE 4 23.348 33.120 2.784
40 H VAL 5 HN VAL 5 28.495 34.302 9.297
41 HA VAL 5 HA VAL 5 27.500 33.975 12.029
42 HB VAL 5 HB VAL 5 30.064 34.905 12.328
43 HG11 VAL 5 HG11 VAL 5 29.015 32.126 11.801
44 HG12 VAL 5 HG12 VAL 5 29.497 32.853 13.333
45 HG13 VAL 5 HG13 VAL 5 30.724 32.399 12.152
46 HG21 VAL 5 HG21 VAL 5 31.462 34.256 10.544
47 HG22 VAL 5 HG22 VAL 5 30.104 35.057 9.751
48 HG23 VAL 5 HG23 VAL 5 30.196 33.295 9.782
49 H LYS 6 HN LYS 6 26.702 35.611 13.182
50 HA LYS 6 HA LYS 6 26.868 38.344 12.132
51 HB2 LYS 6 HB2 LYS 6 24.694 37.341 12.892
52 HB3 LYS 6 HB1 LYS 6 25.339 37.319 14.533
53 HG2 LYS 6 HG2 LYS 6 25.681 39.760 14.437
54 HG3 LYS 6 HG1 LYS 6 25.043 39.786 12.794
55 HD2 LYS 6 HD2 LYS 6 22.891 38.889 13.621
56 HD3 LYS 6 HD1 LYS 6 23.528 38.897 15.266
57 HE2 LYS 6 HE2 LYS 6 23.824 41.326 15.169
58 HE3 LYS 6 HE1 LYS 6 23.269 41.347 13.496
59 HZ1 LYS 6 HZ1 LYS 6 21.271 40.047 14.714
60 HZ2 LYS 6 HZ2 LYS 6 21.284 41.722 14.429
61 HZ3 LYS 6 HZ3 LYS 6 21.749 41.110 15.945
62 H GLY 7 HN GLY 7 28.725 39.350 12.676
63 HA2 GLY 7 HA2 GLY 7 30.171 38.845 15.088
64 HA3 GLY 7 HA1 GLY 7 30.471 40.159 13.954
65 H LEU 8 HN LEU 8 30.754 40.723 16.580
66 HA LEU 8 HA LEU 8 28.438 41.585 17.944
67 HB2 LEU 8 HB2 LEU 8 31.267 42.652 18.126
68 HB3 LEU 8 HB1 LEU 8 29.988 42.947 19.299
69 HG LEU 8 HG LEU 8 30.944 40.170 18.544
70 HD11 LEU 8 HD11 LEU 8 31.764 41.929 20.877
71 HD12 LEU 8 HD12 LEU 8 32.801 41.415 19.546
72 HD13 LEU 8 HD13 LEU 8 32.187 40.227 20.695
73 HD21 LEU 8 HD21 LEU 8 29.911 39.756 20.906
74 HD22 LEU 8 HD22 LEU 8 28.812 39.965 19.548
75 HD23 LEU 8 HD23 LEU 8 29.104 41.303 20.660
76 H THR 9 HN THR 9 30.621 43.262 15.698
77 HA THR 9 HA THR 9 28.508 45.205 15.122
78 HB THR 9 HB THR 9 30.048 47.121 15.453
79 HG1 THR 9 HG1 THR 9 31.720 45.011 16.146
80 HG21 THR 9 HG21 THR 9 28.434 46.227 17.236
81 HG22 THR 9 HG22 THR 9 29.742 47.261 17.808
82 HG23 THR 9 HG23 THR 9 29.853 45.512 18.003
83 H GLY 10 HN GLY 10 31.128 43.299 14.191
84 HA2 GLY 10 HA2 GLY 10 31.907 44.839 11.861
85 HA3 GLY 10 HA1 GLY 10 32.463 43.224 12.285
86 H LYS 11 HN LYS 11 32.004 43.457 9.731
87 HA LYS 11 HA LYS 11 29.289 43.033 8.914
88 HB2 LYS 11 HB2 LYS 11 31.945 42.653 7.526
89 HB3 LYS 11 HB1 LYS 11 30.400 42.316 6.743
90 HG2 LYS 11 HG2 LYS 11 29.674 44.642 7.204
91 HG3 LYS 11 HG1 LYS 11 31.246 44.976 7.933
92 HD2 LYS 11 HD2 LYS 11 32.349 44.401 5.787
93 HD3 LYS 11 HD1 LYS 11 30.766 44.124 5.062
94 HE2 LYS 11 HE2 LYS 11 30.146 46.479 5.582
95 HE3 LYS 11 HE1 LYS 11 31.770 46.743 6.216
96 HZ1 LYS 11 HZ1 LYS 11 31.962 47.447 4.048
97 HZ2 LYS 11 HZ2 LYS 11 30.919 46.251 3.442
98 HZ3 LYS 11 HZ3 LYS 11 32.495 45.841 3.926
99 H THR 12 HN THR 12 28.663 41.021 7.692
100 HA THR 12 HA THR 12 29.070 38.728 9.403
101 HB THR 12 HB THR 12 27.442 37.630 7.907
102 HG1 THR 12 HG1 THR 12 28.301 38.924 6.054
103 HG21 THR 12 HG21 THR 12 26.837 40.426 8.875
104 HG22 THR 12 HG22 THR 12 26.447 38.893 9.655
105 HG23 THR 12 HG23 THR 12 25.590 39.382 8.193
106 H THR 13 HN THR 13 29.547 36.567 8.434
107 HA THR 13 HA THR 13 31.351 36.630 6.117
108 HB THR 13 HB THR 13 32.122 35.772 8.905
109 HG1 THR 13 HG1 THR 13 32.932 37.692 8.679
110 HG21 THR 13 HG21 THR 13 33.271 34.944 6.246
111 HG22 THR 13 HG22 THR 13 32.854 33.926 7.625
112 HG23 THR 13 HG23 THR 13 34.262 34.986 7.705
113 H THR 14 HN THR 14 30.994 34.948 4.809
114 HA THR 14 HA THR 14 29.131 32.871 5.645
115 HB THR 14 HB THR 14 29.250 32.173 3.276
116 HG1 THR 14 HG1 THR 14 30.647 33.102 1.925
117 HG21 THR 14 HG21 THR 14 28.521 34.474 2.318
118 HG22 THR 14 HG22 THR 14 28.768 35.071 3.960
119 HG23 THR 14 HG23 THR 14 27.587 33.797 3.650
120 H LEU 15 HN LEU 15 29.728 30.946 6.406
121 HA LEU 15 HA LEU 15 32.515 30.016 5.964
122 HB2 LEU 15 HB2 LEU 15 30.595 29.341 8.206
123 HB3 LEU 15 HB1 LEU 15 32.240 28.735 8.045
124 HG LEU 15 HG LEU 15 31.713 31.711 8.083
125 HD11 LEU 15 HD11 LEU 15 31.897 29.834 10.450
126 HD12 LEU 15 HD12 LEU 15 30.628 31.007 10.097
127 HD13 LEU 15 HD13 LEU 15 32.234 31.561 10.574
128 HD21 LEU 15 HD21 LEU 15 34.050 29.932 8.859
129 HD22 LEU 15 HD22 LEU 15 34.011 31.675 9.106
130 HD23 LEU 15 HD23 LEU 15 33.963 31.018 7.471
131 H GLU 16 HN GLU 16 32.874 27.985 5.204
132 HA GLU 16 HA GLU 16 30.613 26.617 3.967
133 HB2 GLU 16 HB2 GLU 16 32.737 26.926 2.728
134 HB3 GLU 16 HB1 GLU 16 33.564 25.934 3.930
135 HG2 GLU 16 HG2 GLU 16 32.205 24.012 3.373
136 HG3 GLU 16 HG1 GLU 16 31.191 24.982 2.307
137 H VAL 17 HN VAL 17 29.506 25.096 5.015
138 HA VAL 17 HA VAL 17 30.918 23.263 6.845
139 HB VAL 17 HB VAL 17 29.131 23.490 8.520
140 HG11 VAL 17 HG11 VAL 17 29.853 25.574 9.442
141 HG12 VAL 17 HG12 VAL 17 30.202 26.239 7.846
142 HG13 VAL 17 HG13 VAL 17 31.221 24.963 8.511
143 HG21 VAL 17 HG21 VAL 17 27.525 25.373 8.316
144 HG22 VAL 17 HG22 VAL 17 27.310 24.198 7.020
145 HG23 VAL 17 HG23 VAL 17 28.151 25.717 6.705
146 H GLU 18 HN GLU 18 29.451 21.416 7.482
147 HA GLU 18 HA GLU 18 27.339 20.796 5.556
148 HB2 GLU 18 HB2 GLU 18 29.961 19.327 5.764
149 HB3 GLU 18 HB1 GLU 18 28.504 18.482 5.245
150 HG2 GLU 18 HG2 GLU 18 28.183 20.179 3.456
151 HG3 GLU 18 HG1 GLU 18 29.687 20.955 3.949
152 HA PRO 19 HA PRO 19 25.245 18.895 8.963
153 HB2 PRO 19 HB2 PRO 19 25.289 16.360 7.343
154 HB3 PRO 19 HB1 PRO 19 23.938 17.110 8.218
155 HG2 PRO 19 HG2 PRO 19 24.165 17.334 5.569
156 HG3 PRO 19 HG1 PRO 19 23.553 18.669 6.564
157 HD2 PRO 19 HD2 PRO 19 26.175 18.425 5.170
158 HD3 PRO 19 HD1 PRO 19 25.282 19.883 5.659
159 H SER 20 HN SER 20 27.675 16.764 7.440
160 HA SER 20 HA SER 20 28.262 15.323 9.836
161 HB2 SER 20 HB2 SER 20 30.248 14.517 8.535
162 HB3 SER 20 HB1 SER 20 28.709 14.283 7.710
163 HG SER 20 HG SER 20 29.176 15.918 6.358
164 H ASP 21 HN ASP 21 29.568 18.212 8.317
165 HA ASP 21 HA ASP 21 31.999 18.453 9.645
166 HB2 ASP 21 HB2 ASP 21 31.004 19.962 7.826
167 HB3 ASP 21 HB1 ASP 21 30.169 20.798 9.138
168 H THR 22 HN THR 22 32.256 18.124 11.771
169 HA THR 22 HA THR 22 30.257 18.724 13.718
170 HB THR 22 HB THR 22 31.870 18.001 15.339
171 HG1 THR 22 HG1 THR 22 33.558 19.187 13.722
172 HG21 THR 22 HG21 THR 22 32.491 15.843 14.447
173 HG22 THR 22 HG22 THR 22 32.412 16.454 12.793
174 HG23 THR 22 HG23 THR 22 30.936 16.291 13.745
175 H ILE 23 HN ILE 23 30.724 20.144 15.618
176 HA ILE 23 HA ILE 23 31.023 22.821 14.797
177 HB ILE 23 HB ILE 23 31.390 21.813 17.621
178 HG12 ILE 23 HG12 ILE 23 29.414 20.714 16.772
179 HG13 ILE 23 HG11 ILE 23 28.882 22.070 17.763
180 HG21 ILE 23 HG21 ILE 23 31.783 24.243 17.079
181 HG22 ILE 23 HG22 ILE 23 30.473 23.964 18.226
182 HG23 ILE 23 HG23 ILE 23 30.106 24.336 16.542
183 HD11 ILE 23 HD11 ILE 23 28.837 23.412 15.546
184 HD12 ILE 23 HD12 ILE 23 27.553 22.237 15.818
185 HD13 ILE 23 HD13 ILE 23 28.902 21.836 14.757
186 H GLU 24 HN GLU 24 33.292 20.605 16.397
187 HA GLU 24 HA GLU 24 35.363 22.264 17.062
188 HB2 GLU 24 HB2 GLU 24 35.351 19.800 17.387
189 HB3 GLU 24 HB1 GLU 24 35.673 19.596 15.664
190 HG2 GLU 24 HG2 GLU 24 37.785 20.765 15.859
191 HG3 GLU 24 HG1 GLU 24 37.447 21.188 17.536
192 H ASN 25 HN ASN 25 34.658 20.966 13.832
193 HA ASN 25 HA ASN 25 36.897 22.126 12.533
194 HB2 ASN 25 HB2 ASN 25 35.571 20.283 11.562
195 HB3 ASN 25 HB1 ASN 25 34.201 21.382 11.374
196 HD21 ASN 25 HD21 ASN 25 34.067 22.265 9.316
197 HD22 ASN 25 HD22 ASN 25 35.386 22.550 8.287
198 H VAL 26 HN VAL 26 33.550 23.228 12.977
199 HA VAL 26 HA VAL 26 33.640 25.529 11.401
200 HB VAL 26 HB VAL 26 32.141 25.203 14.009
201 HG11 VAL 26 HG11 VAL 26 32.060 27.479 13.219
202 HG12 VAL 26 HG12 VAL 26 30.524 26.725 12.793
203 HG13 VAL 26 HG13 VAL 26 31.766 26.951 11.562
204 HG21 VAL 26 HG21 VAL 26 31.763 23.298 12.476
205 HG22 VAL 26 HG22 VAL 26 31.367 24.423 11.178
206 HG23 VAL 26 HG23 VAL 26 30.324 24.309 12.596
207 H LYS 27 HN LYS 27 34.372 25.191 14.879
208 HA LYS 27 HA LYS 27 35.036 27.892 15.338
209 HB2 LYS 27 HB2 LYS 27 35.861 25.327 16.704
210 HB3 LYS 27 HB1 LYS 27 36.414 26.905 17.263
211 HG2 LYS 27 HG2 LYS 27 34.063 27.642 17.491
212 HG3 LYS 27 HG1 LYS 27 33.520 26.046 16.969
213 HD2 LYS 27 HD2 LYS 27 34.550 24.995 18.896
214 HD3 LYS 27 HD1 LYS 27 35.299 26.517 19.378
215 HE2 LYS 27 HE2 LYS 27 33.378 26.313 20.766
216 HE3 LYS 27 HE1 LYS 27 32.914 27.464 19.515
217 HZ1 LYS 27 HZ1 LYS 27 31.221 25.757 19.892
218 HZ2 LYS 27 HZ2 LYS 27 32.334 24.552 19.449
219 HZ3 LYS 27 HZ3 LYS 27 31.827 25.705 18.308
220 H ALA 28 HN ALA 28 36.919 25.178 14.102
221 HA ALA 28 HA ALA 28 39.472 26.395 14.267
222 HB1 ALA 28 HB1 ALA 28 38.500 24.327 12.281
223 HB2 ALA 28 HB2 ALA 28 39.122 23.968 13.892
224 HB3 ALA 28 HB3 ALA 28 40.181 24.684 12.679
225 H LYS 29 HN LYS 29 36.972 26.371 11.763
226 HA LYS 29 HA LYS 29 38.474 27.752 9.782
227 HB2 LYS 29 HB2 LYS 29 35.495 27.485 10.246
228 HB3 LYS 29 HB1 LYS 29 36.185 28.279 8.836
229 HG2 LYS 29 HG2 LYS 29 37.021 25.475 9.581
230 HG3 LYS 29 HG1 LYS 29 35.543 25.752 8.665
231 HD2 LYS 29 HD2 LYS 29 36.943 27.087 7.010
232 HD3 LYS 29 HD1 LYS 29 38.370 26.494 7.859
233 HE2 LYS 29 HE2 LYS 29 37.686 24.173 7.419
234 HE3 LYS 29 HE1 LYS 29 36.240 24.751 6.590
235 HZ1 LYS 29 HZ1 LYS 29 38.318 24.173 5.214
236 HZ2 LYS 29 HZ2 LYS 29 38.906 25.676 5.745
237 HZ3 LYS 29 HZ3 LYS 29 37.467 25.593 4.846
238 H ILE 30 HN ILE 30 36.248 28.777 12.314
239 HA ILE 30 HA ILE 30 36.176 31.522 11.700
240 HB ILE 30 HB ILE 30 35.783 30.012 14.285
241 HG12 ILE 30 HG12 ILE 30 33.772 31.405 12.504
242 HG13 ILE 30 HG11 ILE 30 34.207 29.707 12.303
243 HG21 ILE 30 HG21 ILE 30 34.578 32.195 14.950
244 HG22 ILE 30 HG22 ILE 30 35.507 32.952 13.655
245 HG23 ILE 30 HG23 ILE 30 36.339 32.200 15.014
246 HD11 ILE 30 HD11 ILE 30 33.346 30.748 14.997
247 HD12 ILE 30 HD12 ILE 30 33.298 29.096 14.381
248 HD13 ILE 30 HD13 ILE 30 32.146 30.290 13.789
249 H GLN 31 HN GLN 31 38.368 29.627 13.746
250 HA GLN 31 HA GLN 31 39.793 31.653 14.988
251 HB2 GLN 31 HB2 GLN 31 40.079 29.210 15.406
252 HB3 GLN 31 HB1 GLN 31 40.951 29.085 13.875
253 HG2 GLN 31 HG2 GLN 31 42.735 30.444 14.655
254 HG3 GLN 31 HG1 GLN 31 41.798 31.031 16.027
255 HE21 GLN 31 HE21 GLN 31 44.294 29.923 16.572
256 HE22 GLN 31 HE22 GLN 31 44.106 28.402 17.302
257 H ASP 32 HN ASP 32 39.433 31.241 11.700
258 HA ASP 32 HA ASP 32 42.071 32.250 10.935
259 HB2 ASP 32 HB2 ASP 32 39.636 31.673 9.232
260 HB3 ASP 32 HB1 ASP 32 41.260 32.029 8.645
261 H LYS 33 HN LYS 33 38.743 33.357 11.235
262 HA LYS 33 HA LYS 33 39.482 36.035 10.228
263 HB2 LYS 33 HB2 LYS 33 36.727 35.064 10.996
264 HB3 LYS 33 HB1 LYS 33 37.150 36.449 9.991
265 HG2 LYS 33 HG2 LYS 33 37.694 33.548 9.283
266 HG3 LYS 33 HG1 LYS 33 36.384 34.527 8.624
267 HD2 LYS 33 HD2 LYS 33 38.220 36.179 7.887
268 HD3 LYS 33 HD1 LYS 33 39.359 34.874 8.219
269 HE2 LYS 33 HE2 LYS 33 38.044 33.397 6.687
270 HE3 LYS 33 HE1 LYS 33 37.033 34.784 6.278
271 HZ1 LYS 33 HZ1 LYS 33 39.320 34.094 5.016
272 HZ2 LYS 33 HZ2 LYS 33 39.855 35.306 6.079
273 HZ3 LYS 33 HZ3 LYS 33 38.609 35.635 4.972
274 H THR 34 HN THR 34 39.220 34.334 13.114
275 HA THR 34 HA THR 34 38.700 36.806 14.681
276 HB THR 34 HB THR 34 38.168 35.157 16.539
277 HG1 THR 34 HG1 THR 34 37.728 33.062 15.883
278 HG21 THR 34 HG21 THR 34 36.334 36.269 15.518
279 HG22 THR 34 HG22 THR 34 35.913 34.556 15.474
280 HG23 THR 34 HG23 THR 34 36.514 35.353 14.020
281 H GLY 35 HN GLY 35 40.583 33.784 14.621
282 HA2 GLY 35 HA2 GLY 35 42.845 33.493 15.102
283 HA3 GLY 35 HA1 GLY 35 42.937 35.181 15.593
284 H LEU 36 HN LEU 36 40.324 34.275 17.205
285 HA LEU 36 HA LEU 36 41.608 34.130 19.716
286 HB2 LEU 36 HB2 LEU 36 38.784 33.315 18.997
287 HB3 LEU 36 HB1 LEU 36 39.372 33.662 20.618
288 HG LEU 36 HG LEU 36 39.577 35.700 18.394
289 HD11 LEU 36 HD11 LEU 36 37.467 36.665 19.158
290 HD12 LEU 36 HD12 LEU 36 37.299 35.396 20.372
291 HD13 LEU 36 HD13 LEU 36 37.196 34.995 18.658
292 HD21 LEU 36 HD21 LEU 36 39.464 37.245 20.417
293 HD22 LEU 36 HD22 LEU 36 40.915 36.254 20.318
294 HD23 LEU 36 HD23 LEU 36 39.618 35.809 21.427
295 HA PRO 37 HA PRO 37 42.496 29.784 19.862
296 HB2 PRO 37 HB2 PRO 37 42.704 29.352 22.538
297 HB3 PRO 37 HB1 PRO 37 43.895 30.317 21.640
298 HG2 PRO 37 HG2 PRO 37 41.573 31.245 23.285
299 HG3 PRO 37 HG1 PRO 37 43.243 31.844 23.266
300 HD2 PRO 37 HD2 PRO 37 41.236 33.097 21.905
301 HD3 PRO 37 HD1 PRO 37 42.917 33.094 21.331
302 HA PRO 38 HA PRO 38 38.742 27.399 20.231
303 HB2 PRO 38 HB2 PRO 38 40.287 25.450 21.910
304 HB3 PRO 38 HB1 PRO 38 39.281 25.154 20.476
305 HG2 PRO 38 HG2 PRO 38 41.944 25.140 20.333
306 HG3 PRO 38 HG1 PRO 38 40.947 25.777 19.014
307 HD2 PRO 38 HD2 PRO 38 42.610 27.270 21.001
308 HD3 PRO 38 HD1 PRO 38 42.177 27.691 19.329
309 H ASP 39 HN ASP 39 40.620 27.754 23.241
310 HA ASP 39 HA ASP 39 38.524 27.099 25.017
311 HB2 ASP 39 HB2 ASP 39 39.920 28.343 26.710
312 HB3 ASP 39 HB1 ASP 39 40.755 27.054 25.847
313 H GLN 40 HN GLN 40 38.781 29.742 22.976
314 HA GLN 40 HA GLN 40 37.055 31.423 24.718
315 HB2 GLN 40 HB2 GLN 40 39.033 32.115 22.547
316 HB3 GLN 40 HB1 GLN 40 37.754 33.241 23.004
317 HG2 GLN 40 HG2 GLN 40 38.528 33.285 25.299
318 HG3 GLN 40 HG1 GLN 40 39.699 32.010 24.974
319 HE21 GLN 40 HE21 GLN 40 41.767 32.867 24.812
320 HE22 GLN 40 HE22 GLN 40 42.149 34.368 24.117
321 H GLN 41 HN GLN 41 37.619 30.916 21.234
322 HA GLN 41 HA GLN 41 35.432 31.784 20.022
323 HB2 GLN 41 HB2 GLN 41 36.695 29.070 19.641
324 HB3 GLN 41 HB1 GLN 41 35.480 29.728 18.544
325 HG2 GLN 41 HG2 GLN 41 36.881 31.668 18.092
326 HG3 GLN 41 HG1 GLN 41 38.075 31.108 19.263
327 HE21 GLN 41 HE21 GLN 41 37.480 31.176 15.985
328 HE22 GLN 41 HE22 GLN 41 38.375 29.814 15.515
329 H ARG 42 HN ARG 42 33.557 31.923 21.176
330 HA ARG 42 HA ARG 42 32.195 29.409 21.957
331 HB2 ARG 42 HB2 ARG 42 32.386 31.068 23.747
332 HB3 ARG 42 HB1 ARG 42 31.608 32.281 22.729
333 HG2 ARG 42 HG2 ARG 42 29.544 31.045 22.694
334 HG3 ARG 42 HG1 ARG 42 30.301 29.646 23.451
335 HD2 ARG 42 HD2 ARG 42 30.753 31.041 25.472
336 HD3 ARG 42 HD1 ARG 42 29.870 32.364 24.715
337 HE ARG 42 HE ARG 42 28.053 30.376 24.619
338 HH11 ARG 42 HH21 ARG 42 30.143 31.523 27.128
339 HH12 ARG 42 HH22 ARG 42 29.066 31.090 28.413
340 HH21 ARG 42 HH11 ARG 42 26.634 29.808 26.298
341 HH22 ARG 42 HH12 ARG 42 27.075 30.125 27.942
342 H LEU 43 HN LEU 43 30.318 28.794 21.007
343 HA LEU 43 HA LEU 43 29.116 30.596 18.975
344 HB2 LEU 43 HB2 LEU 43 29.553 27.605 18.774
345 HB3 LEU 43 HB1 LEU 43 28.650 28.581 17.612
346 HG LEU 43 HG LEU 43 31.573 28.985 18.326
347 HD11 LEU 43 HD11 LEU 43 30.416 27.945 15.731
348 HD12 LEU 43 HD12 LEU 43 30.943 26.872 17.027
349 HD13 LEU 43 HD13 LEU 43 32.102 27.944 16.242
350 HD21 LEU 43 HD21 LEU 43 31.297 30.331 16.036
351 HD22 LEU 43 HD22 LEU 43 30.905 31.090 17.575
352 HD23 LEU 43 HD23 LEU 43 29.616 30.442 16.561
353 H ILE 44 HN ILE 44 26.982 30.810 19.017
354 HA ILE 44 HA ILE 44 25.326 28.902 20.540
355 HB ILE 44 HB ILE 44 25.359 31.906 20.929
356 HG12 ILE 44 HG12 ILE 44 25.570 29.700 22.987
357 HG13 ILE 44 HG11 ILE 44 26.987 30.418 22.221
358 HG21 ILE 44 HG21 ILE 44 23.336 29.808 21.725
359 HG22 ILE 44 HG22 ILE 44 23.055 31.313 20.853
360 HG23 ILE 44 HG23 ILE 44 23.467 31.351 22.567
361 HD11 ILE 44 HD11 ILE 44 26.259 31.446 24.453
362 HD12 ILE 44 HD12 ILE 44 24.879 32.104 23.574
363 HD13 ILE 44 HD13 ILE 44 26.518 32.568 23.118
364 H PHE 45 HN PHE 45 23.574 28.348 19.422
365 HA PHE 45 HA PHE 45 22.637 30.118 17.220
366 HB2 PHE 45 HB2 PHE 45 23.760 28.070 16.383
367 HB3 PHE 45 HB1 PHE 45 22.626 27.085 17.301
368 HD1 PHE 45 HD2 PHE 45 22.580 29.961 14.889
369 HD2 PHE 45 HD1 PHE 45 20.715 26.322 16.185
370 HE1 PHE 45 HE2 PHE 45 20.946 30.144 13.037
371 HE2 PHE 45 HE1 PHE 45 19.077 26.501 14.331
372 HZ PHE 45 HZ PHE 45 19.197 28.413 12.755
373 H ALA 46 HN ALA 46 20.477 30.532 17.165
374 HA ALA 46 HA ALA 46 18.338 30.743 17.997
375 HB1 ALA 46 HB1 ALA 46 17.093 28.730 18.064
376 HB2 ALA 46 HB2 ALA 46 18.499 27.780 18.541
377 HB3 ALA 46 HB3 ALA 46 18.384 28.420 16.902
378 H GLY 47 HN GLY 47 20.757 30.648 19.907
379 HA2 GLY 47 HA2 GLY 47 20.688 31.420 22.163
380 HA3 GLY 47 HA1 GLY 47 19.159 30.577 22.388
381 H LYS 48 HN LYS 48 20.118 28.135 21.086
382 HA LYS 48 HA LYS 48 21.167 26.813 23.378
383 HB2 LYS 48 HB2 LYS 48 20.936 25.883 20.505
384 HB3 LYS 48 HB1 LYS 48 21.303 24.842 21.883
385 HG2 LYS 48 HG2 LYS 48 19.161 25.466 22.935
386 HG3 LYS 48 HG1 LYS 48 18.792 26.514 21.565
387 HD2 LYS 48 HD2 LYS 48 18.900 24.542 20.056
388 HD3 LYS 48 HD1 LYS 48 19.189 23.509 21.456
389 HE2 LYS 48 HE2 LYS 48 16.743 25.257 21.051
390 HE3 LYS 48 HE1 LYS 48 16.797 23.510 20.813
391 HZ1 LYS 48 HZ1 LYS 48 17.344 24.939 23.358
392 HZ2 LYS 48 HZ2 LYS 48 17.432 23.256 23.136
393 HZ3 LYS 48 HZ3 LYS 48 15.941 24.059 22.995
394 H GLN 49 HN GLN 49 23.203 26.156 23.879
395 HA GLN 49 HA GLN 49 25.398 27.432 22.420
396 HB2 GLN 49 HB2 GLN 49 25.257 27.565 24.907
397 HB3 GLN 49 HB1 GLN 49 25.476 25.817 24.978
398 HG2 GLN 49 HG2 GLN 49 27.643 26.043 23.804
399 HG3 GLN 49 HG1 GLN 49 27.423 27.790 23.750
400 HE21 GLN 49 HE21 GLN 49 29.617 26.416 25.133
401 HE22 GLN 49 HE22 GLN 49 29.464 26.787 26.782
402 H LEU 50 HN LEU 50 26.916 26.395 21.266
403 HA LEU 50 HA LEU 50 26.479 23.575 20.633
404 HB2 LEU 50 HB2 LEU 50 28.587 25.404 19.483
405 HB3 LEU 50 HB1 LEU 50 27.904 23.944 18.768
406 HG LEU 50 HG LEU 50 26.458 26.563 19.257
407 HD11 LEU 50 HD11 LEU 50 28.049 26.284 17.254
408 HD12 LEU 50 HD12 LEU 50 26.397 26.782 16.891
409 HD13 LEU 50 HD13 LEU 50 26.886 25.106 16.644
410 HD21 LEU 50 HD21 LEU 50 25.486 23.823 18.440
411 HD22 LEU 50 HD22 LEU 50 24.612 25.277 17.957
412 HD23 LEU 50 HD23 LEU 50 24.823 24.904 19.666
413 H GLU 51 HN GLU 51 27.988 21.964 20.862
414 HA GLU 51 HA GLU 51 30.445 22.532 22.363
415 HB2 GLU 51 HB2 GLU 51 28.518 22.048 23.967
416 HB3 GLU 51 HB1 GLU 51 28.508 20.413 23.302
417 HG2 GLU 51 HG2 GLU 51 30.909 20.196 23.877
418 HG3 GLU 51 HG1 GLU 51 30.858 21.798 24.609
419 H ASP 52 HN ASP 52 32.029 20.933 22.142
420 HA ASP 52 HA ASP 52 32.183 19.587 19.718
421 HB2 ASP 52 HB2 ASP 52 34.145 20.063 21.110
422 HB3 ASP 52 HB1 ASP 52 33.582 18.905 22.315
423 H GLY 53 HN GLY 53 32.126 17.334 19.200
424 HA2 GLY 53 HA2 GLY 53 31.410 15.128 19.391
425 HA3 GLY 53 HA1 GLY 53 30.870 15.469 21.031
426 H ARG 54 HN ARG 54 29.828 17.668 18.594
427 HA ARG 54 HA ARG 54 27.238 16.288 18.272
428 HB2 ARG 54 HB2 ARG 54 27.719 19.070 19.331
429 HB3 ARG 54 HB1 ARG 54 26.189 18.624 18.580
430 HG2 ARG 54 HG2 ARG 54 27.328 16.896 20.775
431 HG3 ARG 54 HG1 ARG 54 26.475 18.381 21.188
432 HD2 ARG 54 HD2 ARG 54 24.527 17.581 19.827
433 HD3 ARG 54 HD1 ARG 54 25.367 16.053 19.587
434 HE ARG 54 HE ARG 54 24.140 17.001 22.061
435 HH11 ARG 54 HH21 ARG 54 26.228 14.744 20.464
436 HH12 ARG 54 HH22 ARG 54 26.114 13.548 21.711
437 HH21 ARG 54 HH11 ARG 54 23.990 15.439 23.697
438 HH22 ARG 54 HH12 ARG 54 24.849 13.944 23.544
439 H THR 55 HN THR 55 26.202 16.671 16.355
440 HA THR 55 HA THR 55 27.780 18.067 14.280
441 HB THR 55 HB THR 55 26.216 16.793 12.729
442 HG1 THR 55 HG1 THR 55 25.407 15.893 15.248
443 HG21 THR 55 HG21 THR 55 27.368 14.567 13.266
444 HG22 THR 55 HG22 THR 55 28.101 15.402 14.636
445 HG23 THR 55 HG23 THR 55 28.425 15.952 12.991
446 H LEU 56 HN LEU 56 26.385 19.102 12.535
447 HA LEU 56 HA LEU 56 24.851 21.192 13.675
448 HB2 LEU 56 HB2 LEU 56 24.833 20.275 10.797
449 HB3 LEU 56 HB1 LEU 56 24.424 21.875 11.401
450 HG LEU 56 HG LEU 56 27.148 20.570 11.650
451 HD11 LEU 56 HD11 LEU 56 26.297 22.902 9.910
452 HD12 LEU 56 HD12 LEU 56 26.448 21.247 9.317
453 HD13 LEU 56 HD13 LEU 56 27.867 22.100 9.923
454 HD21 LEU 56 HD21 LEU 56 27.722 23.058 12.196
455 HD22 LEU 56 HD22 LEU 56 26.975 22.080 13.456
456 HD23 LEU 56 HD23 LEU 56 25.998 23.221 12.532
457 H SER 57 HN SER 57 24.003 18.143 12.173
458 HA SER 57 HA SER 57 21.243 18.560 11.834
459 HB2 SER 57 HB2 SER 57 21.065 16.196 11.572
460 HB3 SER 57 HB1 SER 57 22.630 16.655 10.908
461 HG SER 57 HG SER 57 22.379 14.809 12.545
462 H ASP 58 HN ASP 58 23.082 18.158 14.703
463 HA ASP 58 HA ASP 58 20.850 17.151 16.293
464 HB2 ASP 58 HB2 ASP 58 23.689 17.945 16.929
465 HB3 ASP 58 HB1 ASP 58 22.521 17.588 18.197
466 H TYR 59 HN TYR 59 22.632 20.155 15.796
467 HA TYR 59 HA TYR 59 21.075 21.611 17.761
468 HB2 TYR 59 HB2 TYR 59 23.073 22.530 15.687
469 HB3 TYR 59 HB1 TYR 59 22.364 23.557 16.932
470 HD1 TYR 59 HD2 TYR 59 22.500 22.515 19.400
471 HD2 TYR 59 HD1 TYR 59 25.143 21.541 16.154
472 HE1 TYR 59 HE2 TYR 59 24.220 21.774 21.021
473 HE2 TYR 59 HE1 TYR 59 26.866 20.801 17.780
474 HH TYR 59 HH TYR 59 26.165 20.616 21.235
475 H ASN 60 HN ASN 60 20.427 20.490 14.744
476 HA ASN 60 HA ASN 60 18.790 20.945 13.190
477 HB2 ASN 60 HB2 ASN 60 17.737 23.065 15.059
478 HB3 ASN 60 HB1 ASN 60 16.846 22.086 13.897
479 HD21 ASN 60 HD21 ASN 60 16.498 22.334 16.905
480 HD22 ASN 60 HD22 ASN 60 16.604 20.740 17.481
481 H ILE 61 HN ILE 61 21.346 22.490 13.400
482 HA ILE 61 HA ILE 61 20.789 25.163 12.511
483 HB ILE 61 HB ILE 61 23.284 23.464 12.631
484 HG12 ILE 61 HG12 ILE 61 22.572 26.051 14.020
485 HG13 ILE 61 HG11 ILE 61 22.222 24.469 14.709
486 HG21 ILE 61 HG21 ILE 61 22.908 26.248 11.512
487 HG22 ILE 61 HG22 ILE 61 23.665 24.864 10.727
488 HG23 ILE 61 HG23 ILE 61 24.469 25.657 12.080
489 HD11 ILE 61 HD11 ILE 61 24.966 25.495 13.924
490 HD12 ILE 61 HD12 ILE 61 24.628 23.899 14.593
491 HD13 ILE 61 HD13 ILE 61 24.358 25.340 15.573
492 H GLN 62 HN GLN 62 20.289 25.812 10.528
493 HA GLN 62 HA GLN 62 20.647 23.936 8.255
494 HB2 GLN 62 HB2 GLN 62 18.748 26.284 8.467
495 HB3 GLN 62 HB1 GLN 62 18.791 25.061 7.198
496 HG2 GLN 62 HG2 GLN 62 18.256 23.319 8.882
497 HG3 GLN 62 HG1 GLN 62 18.154 24.571 10.121
498 HE21 GLN 62 HE21 GLN 62 15.831 23.234 9.881
499 HE22 GLN 62 HE22 GLN 62 14.682 24.099 8.978
500 H LYS 63 HN LYS 63 20.080 25.965 6.312
501 HA LYS 63 HA LYS 63 22.737 27.061 6.014
502 HB2 LYS 63 HB2 LYS 63 21.166 26.139 4.159
503 HB3 LYS 63 HB1 LYS 63 20.388 27.717 4.240
504 HG2 LYS 63 HG2 LYS 63 22.526 28.824 3.767
505 HG3 LYS 63 HG1 LYS 63 23.351 27.267 3.762
506 HD2 LYS 63 HD2 LYS 63 22.001 26.531 1.849
507 HD3 LYS 63 HD1 LYS 63 21.120 28.059 1.865
508 HE2 LYS 63 HE2 LYS 63 22.775 28.358 0.196
509 HE3 LYS 63 HE1 LYS 63 23.433 29.182 1.611
510 HZ1 LYS 63 HZ1 LYS 63 24.315 26.743 0.305
511 HZ2 LYS 63 HZ2 LYS 63 24.350 26.720 2.004
512 HZ3 LYS 63 HZ3 LYS 63 25.212 27.909 1.150
513 H GLU 64 HN GLU 64 23.072 29.367 5.496
514 HA GLU 64 HA GLU 64 23.080 31.537 6.275
515 HB2 GLU 64 HB2 GLU 64 20.074 31.416 6.118
516 HB3 GLU 64 HB1 GLU 64 21.151 32.758 5.731
517 HG2 GLU 64 HG2 GLU 64 22.088 31.269 3.866
518 HG3 GLU 64 HG1 GLU 64 20.702 30.220 4.155
519 H SER 65 HN SER 65 22.556 29.235 8.269
520 HA SER 65 HA SER 65 20.860 30.231 10.308
521 HB2 SER 65 HB2 SER 65 23.061 28.202 10.193
522 HB3 SER 65 HB1 SER 65 22.458 28.709 11.762
523 HG SER 65 HG SER 65 20.339 28.191 10.960
524 H THR 66 HN THR 66 21.125 31.924 11.637
525 HA THR 66 HA THR 66 23.604 33.404 11.601
526 HB THR 66 HB THR 66 20.853 33.819 12.731
527 HG1 THR 66 HG1 THR 66 22.591 35.253 11.017
528 HG21 THR 66 HG21 THR 66 21.850 36.094 13.533
529 HG22 THR 66 HG22 THR 66 23.383 35.224 13.564
530 HG23 THR 66 HG23 THR 66 22.039 34.677 14.565
531 H LEU 67 HN LEU 67 25.236 32.940 12.856
532 HA LEU 67 HA LEU 67 24.839 31.532 15.404
533 HB2 LEU 67 HB2 LEU 67 27.298 32.221 13.772
534 HB3 LEU 67 HB1 LEU 67 27.372 31.455 15.356
535 HG LEU 67 HG LEU 67 27.500 29.796 13.516
536 HD11 LEU 67 HD11 LEU 67 26.175 28.225 14.572
537 HD12 LEU 67 HD12 LEU 67 24.803 29.315 14.727
538 HD13 LEU 67 HD13 LEU 67 26.182 29.476 15.813
539 HD21 LEU 67 HD21 LEU 67 25.829 29.525 11.895
540 HD22 LEU 67 HD22 LEU 67 25.910 31.278 12.043
541 HD23 LEU 67 HD23 LEU 67 24.618 30.382 12.846
542 H HIS 68 HN HIS 68 26.721 32.406 17.043
543 HA HIS 68 HA HIS 68 26.654 35.350 17.137
544 HB2 HIS 68 HB2 HIS 68 25.651 33.564 19.363
545 HB3 HIS 68 HB1 HIS 68 25.898 35.302 19.494
546 HD2 HIS 68 HD2 HIS 68 24.454 36.337 16.762
547 HE1 HIS 68 HE1 HIS 68 21.123 34.060 18.003
548 HE2 HIS 68 HE2 HIS 68 21.894 35.926 16.463
549 H ILE 69 HN ILE 69 28.656 36.011 17.473
550 HA ILE 69 HA ILE 69 30.611 34.236 18.767
551 HB ILE 69 HB ILE 69 31.021 36.895 17.377
552 HG12 ILE 69 HG12 ILE 69 31.482 34.084 16.334
553 HG13 ILE 69 HG11 ILE 69 30.080 35.071 15.919
554 HG21 ILE 69 HG21 ILE 69 33.378 36.124 17.281
555 HG22 ILE 69 HG22 ILE 69 32.934 34.694 18.214
556 HG23 ILE 69 HG23 ILE 69 32.817 36.294 18.945
557 HD11 ILE 69 HD11 ILE 69 31.779 35.300 14.176
558 HD12 ILE 69 HD12 ILE 69 32.980 35.769 15.379
559 HD13 ILE 69 HD13 ILE 69 31.611 36.828 15.042
560 H VAL 70 HN VAL 70 30.788 34.409 20.908
561 HA VAL 70 HA VAL 70 30.191 36.966 22.245
562 HB VAL 70 HB VAL 70 30.839 34.338 23.581
563 HG11 VAL 70 HG11 VAL 70 30.788 36.355 24.992
564 HG12 VAL 70 HG12 VAL 70 29.417 35.308 25.361
565 HG13 VAL 70 HG13 VAL 70 29.183 36.753 24.377
566 HG21 VAL 70 HG21 VAL 70 28.212 35.313 22.425
567 HG22 VAL 70 HG22 VAL 70 28.318 34.039 23.640
568 HG23 VAL 70 HG23 VAL 70 29.055 33.809 22.054
569 H TRP 71 HN TRP 71 31.738 38.231 23.080
570 HA TRP 71 HA TRP 71 34.337 37.148 23.823
571 HB2 TRP 71 HB2 TRP 71 34.625 37.581 21.423
572 HB3 TRP 71 HB1 TRP 71 34.079 39.240 21.653
573 HD1 TRP 71 HD1 TRP 71 36.696 37.025 23.470
574 HE1 TRP 71 HE1 TRP 71 38.856 38.406 23.735
575 HE3 TRP 71 HE3 TRP 71 35.255 41.363 21.192
576 HZ2 TRP 71 HZ2 TRP 71 39.845 41.007 23.069
577 HZ3 TRP 71 HZ3 TRP 71 36.824 43.275 21.022
578 HH2 TRP 71 HH2 TRP 71 39.114 43.103 21.957
579 H ARG 72 HN ARG 72 34.760 38.029 25.732
580 HA ARG 72 HA ARG 72 34.610 40.890 26.123
581 HB2 ARG 72 HB2 ARG 72 32.265 40.087 26.585
582 HB3 ARG 72 HB1 ARG 72 32.922 39.129 27.911
583 HG2 ARG 72 HG2 ARG 72 33.851 41.180 28.932
584 HG3 ARG 72 HG1 ARG 72 33.172 42.137 27.616
585 HD2 ARG 72 HD2 ARG 72 31.652 42.256 29.498
586 HD3 ARG 72 HD1 ARG 72 30.901 41.280 28.240
587 HE ARG 72 HE ARG 72 31.096 39.407 29.624
588 HH11 ARG 72 HH21 ARG 72 32.888 42.104 30.847
589 HH12 ARG 72 HH22 ARG 72 33.193 41.379 32.389
590 HH21 ARG 72 HH11 ARG 72 31.493 38.449 31.645
591 HH22 ARG 72 HH12 ARG 72 32.403 39.309 32.841
592 H LEU 73 HN LEU 73 36.250 41.482 27.385
593 HA LEU 73 HA LEU 73 37.894 39.470 28.653
594 HB2 LEU 73 HB2 LEU 73 38.198 42.469 28.852
595 HB3 LEU 73 HB1 LEU 73 39.446 41.239 29.049
596 HG LEU 73 HG LEU 73 37.973 41.919 26.487
597 HD11 LEU 73 HD11 LEU 73 40.247 42.556 25.720
598 HD12 LEU 73 HD12 LEU 73 40.874 42.203 27.330
599 HD13 LEU 73 HD13 LEU 73 39.727 43.523 27.100
600 HD21 LEU 73 HD21 LEU 73 38.334 39.581 26.365
601 HD22 LEU 73 HD22 LEU 73 39.875 39.684 27.217
602 HD23 LEU 73 HD23 LEU 73 39.745 40.260 25.555
603 H ARG 74 HN ARG 74 38.365 39.300 30.858
604 HA ARG 74 HA ARG 74 36.167 39.979 32.622
605 HB2 ARG 74 HB2 ARG 74 38.762 38.481 33.028
606 HB3 ARG 74 HB1 ARG 74 37.603 38.775 34.326
607 HG2 ARG 74 HG2 ARG 74 35.861 37.593 33.093
608 HG3 ARG 74 HG1 ARG 74 36.943 37.379 31.716
609 HD2 ARG 74 HD2 ARG 74 36.872 35.330 33.070
610 HD3 ARG 74 HD1 ARG 74 38.476 36.054 33.133
611 HE ARG 74 HE ARG 74 36.885 37.005 35.291
612 HH11 ARG 74 HH21 ARG 74 38.568 34.220 34.109
613 HH12 ARG 74 HH22 ARG 74 38.898 33.581 35.685
614 HH21 ARG 74 HH11 ARG 74 37.318 36.174 37.359
615 HH22 ARG 74 HH12 ARG 74 38.190 34.687 37.525
616 H GLY 75 HN GLY 75 36.270 41.319 34.426
617 HA2 GLY 75 HA2 GLY 75 38.619 42.676 35.278
618 HA3 GLY 75 HA1 GLY 75 37.666 43.715 34.224
619 H GLY 76 HN GLY 76 35.601 44.404 34.889
620 HA2 GLY 76 HA2 GLY 76 34.212 43.594 37.170
621 HA3 GLY 76 HA1 GLY 76 35.307 44.879 37.669
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 26.600 23.489 2.868
2 H2 MET 1 HT2 MET 1 26.203 24.125 1.345
3 H3 MET 1 HT3 MET 1 25.230 22.923 2.046
4 HA MET 1 HA MET 1 24.524 25.419 2.132
5 HB2 MET 1 HB2 MET 1 23.551 24.843 4.492
6 HB3 MET 1 HB1 MET 1 23.085 23.844 3.116
7 HG2 MET 1 HG2 MET 1 24.742 22.166 3.699
8 HG3 MET 1 HG1 MET 1 25.378 23.184 4.988
9 HE1 MET 1 HE1 MET 1 22.424 24.275 6.474
10 HE2 MET 1 HE2 MET 1 24.160 24.126 6.732
11 HE3 MET 1 HE3 MET 1 23.046 23.221 7.751
12 H GLN 2 HN GLN 2 25.366 27.309 2.709
13 HA GLN 2 HA GLN 2 27.593 27.427 4.604
14 HB2 GLN 2 HB2 GLN 2 26.340 29.431 2.727
15 HB3 GLN 2 HB1 GLN 2 27.580 29.878 3.900
16 HG2 GLN 2 HG2 GLN 2 29.113 28.216 2.927
17 HG3 GLN 2 HG1 GLN 2 27.873 27.743 1.766
18 HE21 GLN 2 HE21 GLN 2 30.179 28.626 0.603
19 HE22 GLN 2 HE22 GLN 2 30.001 30.205 0.006
20 H ILE 3 HN ILE 3 27.553 29.465 6.060
21 HA ILE 3 HA ILE 3 24.902 30.046 7.175
22 HB ILE 3 HB ILE 3 25.777 29.594 9.487
23 HG12 ILE 3 HG12 ILE 3 27.931 28.043 8.013
24 HG13 ILE 3 HG11 ILE 3 28.201 29.612 8.770
25 HG21 ILE 3 HG21 ILE 3 25.688 27.206 7.620
26 HG22 ILE 3 HG22 ILE 3 24.277 28.021 8.294
27 HG23 ILE 3 HG23 ILE 3 25.400 27.175 9.358
28 HD11 ILE 3 HD11 ILE 3 27.087 27.242 10.285
29 HD12 ILE 3 HD12 ILE 3 27.708 28.753 10.948
30 HD13 ILE 3 HD13 ILE 3 28.812 27.599 10.198
31 H PHE 4 HN PHE 4 24.793 32.041 8.158
32 HA PHE 4 HA PHE 4 27.160 33.768 7.785
33 HB2 PHE 4 HB2 PHE 4 24.374 34.708 8.440
34 HB3 PHE 4 HB1 PHE 4 25.680 35.591 7.655
35 HD1 PHE 4 HD1 PHE 4 26.436 33.123 5.764
36 HD2 PHE 4 HD2 PHE 4 22.769 35.184 6.681
37 HE1 PHE 4 HE1 PHE 4 25.532 32.491 3.563
38 HE2 PHE 4 HE2 PHE 4 21.872 34.540 4.465
39 HZ PHE 4 HZ PHE 4 23.250 33.196 2.907
40 H VAL 5 HN VAL 5 28.400 34.005 9.452
41 HA VAL 5 HA VAL 5 27.436 33.699 12.175
42 HB VAL 5 HB VAL 5 30.053 34.565 12.403
43 HG11 VAL 5 HG11 VAL 5 29.374 32.547 13.445
44 HG12 VAL 5 HG12 VAL 5 30.638 32.081 12.316
45 HG13 VAL 5 HG13 VAL 5 28.945 31.797 11.908
46 HG21 VAL 5 HG21 VAL 5 30.018 34.684 9.827
47 HG22 VAL 5 HG22 VAL 5 30.013 32.921 9.871
48 HG23 VAL 5 HG23 VAL 5 31.358 33.816 10.577
49 H LYS 6 HN LYS 6 26.844 35.318 13.486
50 HA LYS 6 HA LYS 6 26.897 38.052 12.476
51 HB2 LYS 6 HB2 LYS 6 24.890 37.121 13.627
52 HB3 LYS 6 HB1 LYS 6 25.839 36.997 15.109
53 HG2 LYS 6 HG2 LYS 6 26.256 39.429 15.052
54 HG3 LYS 6 HG1 LYS 6 25.314 39.556 13.566
55 HD2 LYS 6 HD2 LYS 6 23.319 38.735 14.741
56 HD3 LYS 6 HD1 LYS 6 24.253 38.560 16.227
57 HE2 LYS 6 HE2 LYS 6 24.771 41.021 16.106
58 HE3 LYS 6 HE1 LYS 6 23.653 41.135 14.746
59 HZ1 LYS 6 HZ1 LYS 6 23.087 41.017 17.526
60 HZ2 LYS 6 HZ2 LYS 6 22.302 39.754 16.706
61 HZ3 LYS 6 HZ3 LYS 6 22.044 41.365 16.234
62 H GLY 7 HN GLY 7 28.993 38.771 12.556
63 HA2 GLY 7 HA2 GLY 7 30.726 38.329 14.793
64 HA3 GLY 7 HA1 GLY 7 31.016 39.434 13.454
65 H LEU 8 HN LEU 8 31.694 40.102 16.052
66 HA LEU 8 HA LEU 8 29.732 41.582 17.451
67 HB2 LEU 8 HB2 LEU 8 32.748 41.793 17.401
68 HB3 LEU 8 HB1 LEU 8 31.726 42.677 18.532
69 HG LEU 8 HG LEU 8 31.402 39.685 18.301
70 HD11 LEU 8 HD11 LEU 8 33.579 41.140 19.826
71 HD12 LEU 8 HD12 LEU 8 33.787 39.894 18.595
72 HD13 LEU 8 HD13 LEU 8 33.092 39.479 20.163
73 HD21 LEU 8 HD21 LEU 8 31.141 41.685 20.577
74 HD22 LEU 8 HD22 LEU 8 30.829 39.955 20.710
75 HD23 LEU 8 HD23 LEU 8 29.809 40.956 19.681
76 H THR 9 HN THR 9 32.125 42.515 14.999
77 HA THR 9 HA THR 9 31.678 45.293 15.079
78 HB THR 9 HB THR 9 32.449 43.644 12.661
79 HG1 THR 9 HG1 THR 9 34.496 44.801 13.887
80 HG21 THR 9 HG21 THR 9 33.586 45.710 11.969
81 HG22 THR 9 HG22 THR 9 33.015 46.520 13.427
82 HG23 THR 9 HG23 THR 9 31.862 46.001 12.198
83 H GLY 10 HN GLY 10 30.257 42.798 12.973
84 HA2 GLY 10 HA2 GLY 10 27.695 43.222 12.819
85 HA3 GLY 10 HA1 GLY 10 28.213 44.724 12.056
86 H LYS 11 HN LYS 11 30.595 43.275 10.928
87 HA LYS 11 HA LYS 11 29.397 42.537 8.427
88 HB2 LYS 11 HB2 LYS 11 31.604 43.657 8.581
89 HB3 LYS 11 HB1 LYS 11 32.256 42.220 9.369
90 HG2 LYS 11 HG2 LYS 11 31.777 40.865 7.403
91 HG3 LYS 11 HG1 LYS 11 30.985 42.233 6.617
92 HD2 LYS 11 HD2 LYS 11 33.269 41.997 5.762
93 HD3 LYS 11 HD1 LYS 11 33.127 43.490 6.688
94 HE2 LYS 11 HE2 LYS 11 34.007 40.997 8.122
95 HE3 LYS 11 HE1 LYS 11 35.169 41.848 7.104
96 HZ1 LYS 11 HZ1 LYS 11 34.230 42.544 9.671
97 HZ2 LYS 11 HZ2 LYS 11 33.839 43.780 8.574
98 HZ3 LYS 11 HZ3 LYS 11 35.452 43.275 8.750
99 H THR 12 HN THR 12 28.585 40.608 7.941
100 HA THR 12 HA THR 12 29.062 38.322 9.667
101 HB THR 12 HB THR 12 27.391 37.209 8.234
102 HG1 THR 12 HG1 THR 12 27.473 37.965 6.263
103 HG21 THR 12 HG21 THR 12 25.505 38.660 8.802
104 HG22 THR 12 HG22 THR 12 26.597 40.030 9.004
105 HG23 THR 12 HG23 THR 12 26.680 38.665 10.117
106 H THR 13 HN THR 13 29.457 36.157 8.585
107 HA THR 13 HA THR 13 31.208 36.300 6.233
108 HB THR 13 HB THR 13 32.056 35.367 8.972
109 HG1 THR 13 HG1 THR 13 33.973 36.557 7.854
110 HG21 THR 13 HG21 THR 13 33.077 34.504 6.271
111 HG22 THR 13 HG22 THR 13 32.708 33.505 7.677
112 HG23 THR 13 HG23 THR 13 34.138 34.538 7.680
113 H THR 14 HN THR 14 30.771 34.708 4.870
114 HA THR 14 HA THR 14 28.908 32.618 5.643
115 HB THR 14 HB THR 14 28.929 32.035 3.270
116 HG1 THR 14 HG1 THR 14 31.294 33.364 3.408
117 HG21 THR 14 HG21 THR 14 28.785 34.979 3.938
118 HG22 THR 14 HG22 THR 14 27.454 33.834 3.782
119 HG23 THR 14 HG23 THR 14 28.343 34.350 2.351
120 H LEU 15 HN LEU 15 29.821 31.048 6.862
121 HA LEU 15 HA LEU 15 32.483 30.015 6.242
122 HB2 LEU 15 HB2 LEU 15 30.473 29.255 8.368
123 HB3 LEU 15 HB1 LEU 15 32.091 28.580 8.233
124 HG LEU 15 HG LEU 15 31.605 31.560 8.472
125 HD11 LEU 15 HD11 LEU 15 30.623 30.673 10.455
126 HD12 LEU 15 HD12 LEU 15 32.253 31.165 10.917
127 HD13 LEU 15 HD13 LEU 15 31.894 29.463 10.630
128 HD21 LEU 15 HD21 LEU 15 33.833 31.116 7.749
129 HD22 LEU 15 HD22 LEU 15 33.990 29.723 8.816
130 HD23 LEU 15 HD23 LEU 15 33.968 31.350 9.488
131 H GLU 16 HN GLU 16 32.900 28.169 5.168
132 HA GLU 16 HA GLU 16 30.755 26.769 3.852
133 HB2 GLU 16 HB2 GLU 16 33.095 27.174 2.918
134 HB3 GLU 16 HB1 GLU 16 33.653 25.924 4.029
135 HG2 GLU 16 HG2 GLU 16 33.223 24.773 2.002
136 HG3 GLU 16 HG1 GLU 16 31.820 24.435 3.013
137 H VAL 17 HN VAL 17 29.553 25.258 4.854
138 HA VAL 17 HA VAL 17 30.881 23.355 6.682
139 HB VAL 17 HB VAL 17 29.083 23.573 8.318
140 HG11 VAL 17 HG11 VAL 17 31.165 25.085 8.318
141 HG12 VAL 17 HG12 VAL 17 29.794 25.622 9.289
142 HG13 VAL 17 HG13 VAL 17 30.099 26.355 7.714
143 HG21 VAL 17 HG21 VAL 17 27.242 24.234 6.895
144 HG22 VAL 17 HG22 VAL 17 28.082 25.704 6.405
145 HG23 VAL 17 HG23 VAL 17 27.501 25.532 8.061
146 H GLU 18 HN GLU 18 29.382 21.549 7.265
147 HA GLU 18 HA GLU 18 27.285 20.969 5.324
148 HB2 GLU 18 HB2 GLU 18 29.853 19.394 5.552
149 HB3 GLU 18 HB1 GLU 18 28.376 18.691 4.894
150 HG2 GLU 18 HG2 GLU 18 28.279 20.579 3.245
151 HG3 GLU 18 HG1 GLU 18 29.845 21.124 3.843
152 HA PRO 19 HA PRO 19 25.163 19.089 8.730
153 HB2 PRO 19 HB2 PRO 19 25.221 16.583 7.058
154 HB3 PRO 19 HB1 PRO 19 23.871 17.294 7.968
155 HG2 PRO 19 HG2 PRO 19 24.086 17.598 5.317
156 HG3 PRO 19 HG1 PRO 19 23.442 18.882 6.355
157 HD2 PRO 19 HD2 PRO 19 26.036 18.784 4.915
158 HD3 PRO 19 HD1 PRO 19 25.146 20.190 5.543
159 H SER 20 HN SER 20 27.556 16.926 7.192
160 HA SER 20 HA SER 20 28.139 15.439 9.535
161 HB2 SER 20 HB2 SER 20 29.793 15.880 7.040
162 HB3 SER 20 HB1 SER 20 30.128 14.670 8.275
163 HG SER 20 HG SER 20 28.519 14.459 6.210
164 H ASP 21 HN ASP 21 29.507 18.378 8.145
165 HA ASP 21 HA ASP 21 31.872 18.620 9.548
166 HB2 ASP 21 HB2 ASP 21 30.895 20.211 7.809
167 HB3 ASP 21 HB1 ASP 21 29.983 20.936 9.137
168 H THR 22 HN THR 22 32.316 18.525 11.633
169 HA THR 22 HA THR 22 30.240 18.843 13.626
170 HB THR 22 HB THR 22 31.970 18.206 15.218
171 HG1 THR 22 HG1 THR 22 33.989 18.521 14.774
172 HG21 THR 22 HG21 THR 22 32.663 16.041 14.170
173 HG22 THR 22 HG22 THR 22 32.058 16.641 12.626
174 HG23 THR 22 HG23 THR 22 30.945 16.391 13.971
175 H ILE 23 HN ILE 23 30.604 20.235 15.530
176 HA ILE 23 HA ILE 23 30.877 22.940 14.791
177 HB ILE 23 HB ILE 23 31.145 21.838 17.591
178 HG12 ILE 23 HG12 ILE 23 29.228 20.756 16.571
179 HG13 ILE 23 HG11 ILE 23 28.642 22.020 17.644
180 HG21 ILE 23 HG21 ILE 23 31.548 24.275 17.223
181 HG22 ILE 23 HG22 ILE 23 30.120 23.967 18.211
182 HG23 ILE 23 HG23 ILE 23 29.939 24.405 16.513
183 HD11 ILE 23 HD11 ILE 23 28.741 22.005 14.633
184 HD12 ILE 23 HD12 ILE 23 28.653 23.528 15.517
185 HD13 ILE 23 HD13 ILE 23 27.368 22.334 15.688
186 H GLU 24 HN GLU 24 33.098 20.692 16.395
187 HA GLU 24 HA GLU 24 35.134 22.368 17.168
188 HB2 GLU 24 HB2 GLU 24 35.007 19.831 17.395
189 HB3 GLU 24 HB1 GLU 24 35.643 19.749 15.753
190 HG2 GLU 24 HG2 GLU 24 37.536 19.613 17.216
191 HG3 GLU 24 HG1 GLU 24 37.545 21.241 16.538
192 H ASN 25 HN ASN 25 34.531 21.050 13.923
193 HA ASN 25 HA ASN 25 36.812 22.200 12.688
194 HB2 ASN 25 HB2 ASN 25 35.500 20.359 11.681
195 HB3 ASN 25 HB1 ASN 25 34.149 21.471 11.443
196 HD21 ASN 25 HD21 ASN 25 34.278 22.973 9.683
197 HD22 ASN 25 HD22 ASN 25 35.563 22.980 8.575
198 H VAL 26 HN VAL 26 33.450 23.290 13.025
199 HA VAL 26 HA VAL 26 33.572 25.599 11.474
200 HB VAL 26 HB VAL 26 32.037 25.214 14.056
201 HG11 VAL 26 HG11 VAL 26 30.463 26.830 12.856
202 HG12 VAL 26 HG12 VAL 26 31.786 27.135 11.731
203 HG13 VAL 26 HG13 VAL 26 31.974 27.524 13.441
204 HG21 VAL 26 HG21 VAL 26 30.242 24.367 12.653
205 HG22 VAL 26 HG22 VAL 26 31.695 23.429 12.312
206 HG23 VAL 26 HG23 VAL 26 31.179 24.686 11.192
207 H LYS 27 HN LYS 27 34.388 25.143 14.905
208 HA LYS 27 HA LYS 27 35.079 27.851 15.418
209 HB2 LYS 27 HB2 LYS 27 35.840 25.246 16.752
210 HB3 LYS 27 HB1 LYS 27 36.419 26.808 17.332
211 HG2 LYS 27 HG2 LYS 27 34.078 27.581 17.563
212 HG3 LYS 27 HG1 LYS 27 33.513 25.999 17.024
213 HD2 LYS 27 HD2 LYS 27 34.651 24.934 18.937
214 HD3 LYS 27 HD1 LYS 27 35.219 26.513 19.478
215 HE2 LYS 27 HE2 LYS 27 32.898 27.270 19.760
216 HE3 LYS 27 HE1 LYS 27 32.311 25.708 19.189
217 HZ1 LYS 27 HZ1 LYS 27 34.200 25.782 21.433
218 HZ2 LYS 27 HZ2 LYS 27 32.977 24.654 21.086
219 HZ3 LYS 27 HZ3 LYS 27 32.576 26.178 21.724
220 H ALA 28 HN ALA 28 36.850 25.092 14.125
221 HA ALA 28 HA ALA 28 39.451 26.219 14.297
222 HB1 ALA 28 HB1 ALA 28 38.908 23.786 13.870
223 HB2 ALA 28 HB2 ALA 28 40.131 24.471 12.801
224 HB3 ALA 28 HB3 ALA 28 38.481 24.245 12.221
225 H LYS 29 HN LYS 29 36.948 26.246 11.796
226 HA LYS 29 HA LYS 29 38.426 27.594 9.803
227 HB2 LYS 29 HB2 LYS 29 35.457 27.505 10.388
228 HB3 LYS 29 HB1 LYS 29 36.140 28.248 8.944
229 HG2 LYS 29 HG2 LYS 29 36.883 25.410 9.651
230 HG3 LYS 29 HG1 LYS 29 35.341 25.735 8.865
231 HD2 LYS 29 HD2 LYS 29 36.555 26.938 7.046
232 HD3 LYS 29 HD1 LYS 29 38.083 26.491 7.804
233 HE2 LYS 29 HE2 LYS 29 37.485 24.099 7.583
234 HE3 LYS 29 HE1 LYS 29 35.979 24.558 6.790
235 HZ1 LYS 29 HZ1 LYS 29 37.294 24.262 4.980
236 HZ2 LYS 29 HZ2 LYS 29 38.724 24.689 5.792
237 HZ3 LYS 29 HZ3 LYS 29 37.642 25.895 5.280
238 H ILE 30 HN ILE 30 36.414 28.695 12.471
239 HA ILE 30 HA ILE 30 36.536 31.469 11.870
240 HB ILE 30 HB ILE 30 35.943 29.941 14.411
241 HG12 ILE 30 HG12 ILE 30 34.072 31.530 12.646
242 HG13 ILE 30 HG11 ILE 30 34.418 29.829 12.338
243 HG21 ILE 30 HG21 ILE 30 36.694 32.104 15.129
244 HG22 ILE 30 HG22 ILE 30 34.932 32.149 15.149
245 HG23 ILE 30 HG23 ILE 30 35.816 32.907 13.825
246 HD11 ILE 30 HD11 ILE 30 32.358 30.409 13.810
247 HD12 ILE 30 HD12 ILE 30 33.541 30.742 15.074
248 HD13 ILE 30 HD13 ILE 30 33.440 29.132 14.359
249 H GLN 31 HN GLN 31 38.411 29.380 14.072
250 HA GLN 31 HA GLN 31 40.004 31.294 15.285
251 HB2 GLN 31 HB2 GLN 31 40.009 28.973 15.997
252 HB3 GLN 31 HB1 GLN 31 40.715 28.469 14.458
253 HG2 GLN 31 HG2 GLN 31 42.778 29.545 14.932
254 HG3 GLN 31 HG1 GLN 31 42.082 30.472 16.259
255 HE21 GLN 31 HE21 GLN 31 44.158 29.290 17.257
256 HE22 GLN 31 HE22 GLN 31 43.839 27.803 18.009
257 H ASP 32 HN ASP 32 39.873 30.551 11.995
258 HA ASP 32 HA ASP 32 42.659 31.328 11.454
259 HB2 ASP 32 HB2 ASP 32 40.417 30.453 9.620
260 HB3 ASP 32 HB1 ASP 32 42.035 30.887 9.079
261 H LYS 33 HN LYS 33 39.353 32.508 11.049
262 HA LYS 33 HA LYS 33 40.260 34.933 9.697
263 HB2 LYS 33 HB2 LYS 33 37.506 34.009 10.541
264 HB3 LYS 33 HB1 LYS 33 37.843 35.478 9.622
265 HG2 LYS 33 HG2 LYS 33 38.909 34.112 7.851
266 HG3 LYS 33 HG1 LYS 33 38.524 32.651 8.760
267 HD2 LYS 33 HD2 LYS 33 36.094 33.332 8.661
268 HD3 LYS 33 HD1 LYS 33 36.567 34.626 7.559
269 HE2 LYS 33 HE2 LYS 33 36.835 31.644 7.128
270 HE3 LYS 33 HE1 LYS 33 35.891 32.790 6.178
271 HZ1 LYS 33 HZ1 LYS 33 37.897 33.840 5.437
272 HZ2 LYS 33 HZ2 LYS 33 38.013 32.173 5.128
273 HZ3 LYS 33 HZ3 LYS 33 38.846 32.857 6.442
274 H THR 34 HN THR 34 39.484 33.901 12.919
275 HA THR 34 HA THR 34 39.333 36.713 13.848
276 HB THR 34 HB THR 34 38.378 35.780 15.916
277 HG1 THR 34 HG1 THR 34 38.198 33.666 16.197
278 HG21 THR 34 HG21 THR 34 36.841 36.419 14.137
279 HG22 THR 34 HG22 THR 34 36.244 34.957 14.923
280 HG23 THR 34 HG23 THR 34 37.049 34.850 13.357
281 H GLY 35 HN GLY 35 41.048 33.663 14.222
282 HA2 GLY 35 HA2 GLY 35 43.194 33.272 15.003
283 HA3 GLY 35 HA1 GLY 35 43.385 35.008 15.209
284 H LEU 36 HN LEU 36 40.574 34.075 16.759
285 HA LEU 36 HA LEU 36 41.775 34.446 19.348
286 HB2 LEU 36 HB2 LEU 36 38.952 33.832 18.474
287 HB3 LEU 36 HB1 LEU 36 39.408 34.060 20.158
288 HG LEU 36 HG LEU 36 40.006 36.116 18.016
289 HD11 LEU 36 HD11 LEU 36 37.988 37.309 18.777
290 HD12 LEU 36 HD12 LEU 36 37.604 35.975 19.864
291 HD13 LEU 36 HD13 LEU 36 37.570 35.727 18.118
292 HD21 LEU 36 HD21 LEU 36 40.092 36.055 21.038
293 HD22 LEU 36 HD22 LEU 36 39.863 37.583 20.192
294 HD23 LEU 36 HD23 LEU 36 41.314 36.631 19.906
295 HA PRO 37 HA PRO 37 42.382 30.132 20.238
296 HB2 PRO 37 HB2 PRO 37 42.374 30.142 22.970
297 HB3 PRO 37 HB1 PRO 37 43.694 30.851 22.018
298 HG2 PRO 37 HG2 PRO 37 41.377 32.204 23.335
299 HG3 PRO 37 HG1 PRO 37 43.084 32.682 23.300
300 HD2 PRO 37 HD2 PRO 37 41.210 33.804 21.650
301 HD3 PRO 37 HD1 PRO 37 42.918 33.626 21.186
302 HA PRO 38 HA PRO 38 38.447 28.194 20.843
303 HB2 PRO 38 HB2 PRO 38 39.129 25.887 22.218
304 HB3 PRO 38 HB1 PRO 38 39.405 26.123 20.480
305 HG2 PRO 38 HG2 PRO 38 41.319 26.438 22.754
306 HG3 PRO 38 HG1 PRO 38 41.571 25.694 21.163
307 HD2 PRO 38 HD2 PRO 38 42.451 28.195 21.705
308 HD3 PRO 38 HD1 PRO 38 41.846 27.752 20.093
309 H ASP 39 HN ASP 39 40.466 28.660 23.687
310 HA ASP 39 HA ASP 39 38.482 28.107 25.647
311 HB2 ASP 39 HB2 ASP 39 41.008 29.765 25.741
312 HB3 ASP 39 HB1 ASP 39 39.990 29.468 27.148
313 H GLN 40 HN GLN 40 38.777 30.614 23.420
314 HA GLN 40 HA GLN 40 37.199 32.505 25.070
315 HB2 GLN 40 HB2 GLN 40 38.948 32.854 22.633
316 HB3 GLN 40 HB1 GLN 40 37.813 34.098 23.154
317 HG2 GLN 40 HG2 GLN 40 39.886 32.893 24.998
318 HG3 GLN 40 HG1 GLN 40 40.177 34.350 24.051
319 HE21 GLN 40 HE21 GLN 40 40.197 34.440 26.899
320 HE22 GLN 40 HE22 GLN 40 38.855 35.341 27.418
321 H GLN 41 HN GLN 41 37.445 31.747 21.600
322 HA GLN 41 HA GLN 41 35.148 32.565 20.558
323 HB2 GLN 41 HB2 GLN 41 36.272 29.787 20.139
324 HB3 GLN 41 HB1 GLN 41 35.140 30.601 19.061
325 HG2 GLN 41 HG2 GLN 41 36.764 32.415 18.703
326 HG3 GLN 41 HG1 GLN 41 37.897 31.622 19.796
327 HE21 GLN 41 HE21 GLN 41 38.208 32.182 16.854
328 HE22 GLN 41 HE22 GLN 41 38.495 30.669 16.142
329 H ARG 42 HN ARG 42 33.006 31.991 20.370
330 HA ARG 42 HA ARG 42 31.940 29.726 21.865
331 HB2 ARG 42 HB2 ARG 42 32.105 31.627 23.512
332 HB3 ARG 42 HB1 ARG 42 30.993 32.535 22.486
333 HG2 ARG 42 HG2 ARG 42 29.361 30.622 22.693
334 HG3 ARG 42 HG1 ARG 42 30.450 29.898 23.876
335 HD2 ARG 42 HD2 ARG 42 29.283 32.681 24.128
336 HD3 ARG 42 HD1 ARG 42 28.599 31.254 24.901
337 HE ARG 42 HE ARG 42 30.971 32.687 25.720
338 HH11 ARG 42 HH21 ARG 42 29.293 29.662 25.676
339 HH12 ARG 42 HH22 ARG 42 30.048 29.064 27.116
340 HH21 ARG 42 HH11 ARG 42 31.962 31.914 27.613
341 HH22 ARG 42 HH12 ARG 42 31.559 30.339 28.214
342 H LEU 43 HN LEU 43 30.337 28.848 20.723
343 HA LEU 43 HA LEU 43 28.963 30.496 18.667
344 HB2 LEU 43 HB2 LEU 43 29.400 27.498 18.703
345 HB3 LEU 43 HB1 LEU 43 28.637 28.431 17.414
346 HG LEU 43 HG LEU 43 31.501 28.794 18.350
347 HD11 LEU 43 HD11 LEU 43 31.246 26.642 17.243
348 HD12 LEU 43 HD12 LEU 43 32.048 27.756 16.136
349 HD13 LEU 43 HD13 LEU 43 30.337 27.387 15.929
350 HD21 LEU 43 HD21 LEU 43 31.531 30.000 16.019
351 HD22 LEU 43 HD22 LEU 43 30.863 30.857 17.403
352 HD23 LEU 43 HD23 LEU 43 29.784 30.098 16.232
353 H ILE 44 HN ILE 44 26.850 30.774 18.872
354 HA ILE 44 HA ILE 44 25.250 28.855 20.449
355 HB ILE 44 HB ILE 44 25.289 31.865 20.814
356 HG12 ILE 44 HG12 ILE 44 25.595 29.658 22.865
357 HG13 ILE 44 HG11 ILE 44 26.974 30.388 22.045
358 HG21 ILE 44 HG21 ILE 44 22.983 31.247 20.836
359 HG22 ILE 44 HG22 ILE 44 23.469 31.314 22.530
360 HG23 ILE 44 HG23 ILE 44 23.318 29.756 21.716
361 HD11 ILE 44 HD11 ILE 44 26.311 31.396 24.315
362 HD12 ILE 44 HD12 ILE 44 24.916 32.070 23.474
363 HD13 ILE 44 HD13 ILE 44 26.547 32.523 22.980
364 H PHE 45 HN PHE 45 23.441 28.295 19.430
365 HA PHE 45 HA PHE 45 22.430 30.027 17.235
366 HB2 PHE 45 HB2 PHE 45 23.493 27.895 16.454
367 HB3 PHE 45 HB1 PHE 45 22.291 27.004 17.380
368 HD1 PHE 45 HD1 PHE 45 22.426 29.845 14.918
369 HD2 PHE 45 HD2 PHE 45 20.367 26.321 16.245
370 HE1 PHE 45 HE1 PHE 45 20.813 30.088 13.054
371 HE2 PHE 45 HE2 PHE 45 18.753 26.561 14.378
372 HZ PHE 45 HZ PHE 45 18.979 28.446 12.781
373 H ALA 46 HN ALA 46 20.450 30.773 17.578
374 HA ALA 46 HA ALA 46 18.339 31.040 18.433
375 HB1 ALA 46 HB1 ALA 46 18.384 28.028 18.718
376 HB2 ALA 46 HB2 ALA 46 18.005 28.880 17.222
377 HB3 ALA 46 HB3 ALA 46 16.959 29.063 18.631
378 H GLY 47 HN GLY 47 20.879 30.395 20.231
379 HA2 GLY 47 HA2 GLY 47 20.908 31.209 22.520
380 HA3 GLY 47 HA1 GLY 47 19.355 30.423 22.781
381 H LYS 48 HN LYS 48 20.394 28.044 21.197
382 HA LYS 48 HA LYS 48 21.354 26.567 23.456
383 HB2 LYS 48 HB2 LYS 48 21.038 25.848 20.537
384 HB3 LYS 48 HB1 LYS 48 21.569 24.703 21.771
385 HG2 LYS 48 HG2 LYS 48 19.492 25.113 23.045
386 HG3 LYS 48 HG1 LYS 48 18.956 26.244 21.802
387 HD2 LYS 48 HD2 LYS 48 18.961 24.453 20.132
388 HD3 LYS 48 HD1 LYS 48 19.569 23.312 21.332
389 HE2 LYS 48 HE2 LYS 48 17.539 23.614 22.678
390 HE3 LYS 48 HE1 LYS 48 16.933 24.800 21.522
391 HZ1 LYS 48 HZ1 LYS 48 17.708 22.364 20.255
392 HZ2 LYS 48 HZ2 LYS 48 16.230 23.198 20.177
393 HZ3 LYS 48 HZ3 LYS 48 16.523 22.098 21.438
394 H GLN 49 HN GLN 49 23.376 25.923 23.977
395 HA GLN 49 HA GLN 49 25.601 27.226 22.611
396 HB2 GLN 49 HB2 GLN 49 25.556 27.240 25.056
397 HB3 GLN 49 HB1 GLN 49 25.532 25.477 25.082
398 HG2 GLN 49 HG2 GLN 49 27.725 25.353 24.097
399 HG3 GLN 49 HG1 GLN 49 27.735 27.084 23.765
400 HE21 GLN 49 HE21 GLN 49 29.794 25.865 25.336
401 HE22 GLN 49 HE22 GLN 49 29.651 26.430 26.931
402 H LEU 50 HN LEU 50 27.003 26.271 21.280
403 HA LEU 50 HA LEU 50 26.559 23.469 20.548
404 HB2 LEU 50 HB2 LEU 50 28.495 25.412 19.289
405 HB3 LEU 50 HB1 LEU 50 27.802 23.956 18.583
406 HG LEU 50 HG LEU 50 26.337 26.514 19.270
407 HD11 LEU 50 HD11 LEU 50 26.054 26.772 16.929
408 HD12 LEU 50 HD12 LEU 50 26.529 25.105 16.605
409 HD13 LEU 50 HD13 LEU 50 27.737 26.282 17.118
410 HD21 LEU 50 HD21 LEU 50 25.338 23.768 18.493
411 HD22 LEU 50 HD22 LEU 50 24.397 25.217 18.139
412 HD23 LEU 50 HD23 LEU 50 24.785 24.805 19.808
413 H GLU 51 HN GLU 51 27.976 21.843 20.907
414 HA GLU 51 HA GLU 51 30.644 22.469 22.023
415 HB2 GLU 51 HB2 GLU 51 28.607 20.565 23.201
416 HB3 GLU 51 HB1 GLU 51 30.305 20.620 23.678
417 HG2 GLU 51 HG2 GLU 51 30.078 22.940 24.381
418 HG3 GLU 51 HG1 GLU 51 28.415 22.986 23.800
419 H ASP 52 HN ASP 52 32.180 20.748 21.806
420 HA ASP 52 HA ASP 52 32.152 19.464 19.321
421 HB2 ASP 52 HB2 ASP 52 34.201 19.939 20.642
422 HB3 ASP 52 HB1 ASP 52 33.739 18.666 21.772
423 H GLY 53 HN GLY 53 32.143 17.165 18.844
424 HA2 GLY 53 HA2 GLY 53 31.431 14.960 19.107
425 HA3 GLY 53 HA1 GLY 53 30.893 15.351 20.736
426 H ARG 54 HN ARG 54 29.789 17.667 18.596
427 HA ARG 54 HA ARG 54 27.203 16.277 18.153
428 HB2 ARG 54 HB2 ARG 54 27.697 19.093 19.139
429 HB3 ARG 54 HB1 ARG 54 26.133 18.525 18.562
430 HG2 ARG 54 HG2 ARG 54 27.598 16.997 20.714
431 HG3 ARG 54 HG1 ARG 54 26.665 18.430 21.133
432 HD2 ARG 54 HD2 ARG 54 24.693 17.368 19.926
433 HD3 ARG 54 HD1 ARG 54 25.646 15.890 19.833
434 HE ARG 54 HE ARG 54 24.450 17.049 22.228
435 HH11 ARG 54 HH21 ARG 54 26.667 14.787 20.829
436 HH12 ARG 54 HH22 ARG 54 26.727 13.773 22.232
437 HH21 ARG 54 HH11 ARG 54 24.519 15.721 24.063
438 HH22 ARG 54 HH12 ARG 54 25.509 14.299 24.061
439 H THR 55 HN THR 55 26.132 16.762 16.250
440 HA THR 55 HA THR 55 27.721 18.219 14.213
441 HB THR 55 HB THR 55 26.227 16.895 12.612
442 HG1 THR 55 HG1 THR 55 25.255 15.083 13.525
443 HG21 THR 55 HG21 THR 55 28.555 16.287 12.976
444 HG22 THR 55 HG22 THR 55 27.579 14.818 12.926
445 HG23 THR 55 HG23 THR 55 28.136 15.456 14.474
446 H LEU 56 HN LEU 56 26.367 19.250 12.477
447 HA LEU 56 HA LEU 56 24.677 21.224 13.580
448 HB2 LEU 56 HB2 LEU 56 24.800 20.346 10.689
449 HB3 LEU 56 HB1 LEU 56 24.280 21.914 11.300
450 HG LEU 56 HG LEU 56 27.065 20.763 11.640
451 HD11 LEU 56 HD11 LEU 56 26.813 21.295 9.329
452 HD12 LEU 56 HD12 LEU 56 27.620 22.692 10.040
453 HD13 LEU 56 HD13 LEU 56 25.893 22.755 9.689
454 HD21 LEU 56 HD21 LEU 56 27.467 23.288 12.189
455 HD22 LEU 56 HD22 LEU 56 26.745 22.266 13.428
456 HD23 LEU 56 HD23 LEU 56 25.727 23.341 12.471
457 H SER 57 HN SER 57 24.019 18.175 11.955
458 HA SER 57 HA SER 57 21.249 18.462 11.586
459 HB2 SER 57 HB2 SER 57 22.738 15.900 12.191
460 HB3 SER 57 HB1 SER 57 21.187 16.053 11.372
461 HG SER 57 HG SER 57 22.573 15.977 9.723
462 H ASP 58 HN ASP 58 23.103 18.006 14.449
463 HA ASP 58 HA ASP 58 20.924 16.884 16.012
464 HB2 ASP 58 HB2 ASP 58 23.383 16.400 16.409
465 HB3 ASP 58 HB1 ASP 58 23.517 18.041 17.040
466 H TYR 59 HN TYR 59 22.570 20.006 15.655
467 HA TYR 59 HA TYR 59 20.886 21.292 17.639
468 HB2 TYR 59 HB2 TYR 59 22.895 22.411 15.672
469 HB3 TYR 59 HB1 TYR 59 22.085 23.349 16.925
470 HD1 TYR 59 HD2 TYR 59 22.275 22.387 19.373
471 HD2 TYR 59 HD1 TYR 59 24.944 21.388 16.157
472 HE1 TYR 59 HE2 TYR 59 23.996 21.683 21.016
473 HE2 TYR 59 HE1 TYR 59 26.662 20.690 17.797
474 HH TYR 59 HH TYR 59 27.236 21.127 20.160
475 H ASN 60 HN ASN 60 20.265 20.211 14.634
476 HA ASN 60 HA ASN 60 18.680 20.681 13.037
477 HB2 ASN 60 HB2 ASN 60 17.547 22.631 15.051
478 HB3 ASN 60 HB1 ASN 60 16.695 21.840 13.727
479 HD21 ASN 60 HD21 ASN 60 18.456 19.333 14.518
480 HD22 ASN 60 HD22 ASN 60 17.569 18.660 15.799
481 H ILE 61 HN ILE 61 21.164 22.318 13.357
482 HA ILE 61 HA ILE 61 20.523 24.996 12.547
483 HB ILE 61 HB ILE 61 23.075 23.381 12.645
484 HG12 ILE 61 HG12 ILE 61 22.259 25.897 14.119
485 HG13 ILE 61 HG11 ILE 61 21.924 24.282 14.735
486 HG21 ILE 61 HG21 ILE 61 22.586 26.156 11.564
487 HG22 ILE 61 HG22 ILE 61 23.494 24.841 10.822
488 HG23 ILE 61 HG23 ILE 61 24.155 25.691 12.219
489 HD11 ILE 61 HD11 ILE 61 23.997 25.010 15.732
490 HD12 ILE 61 HD12 ILE 61 24.638 25.502 14.164
491 HD13 ILE 61 HD13 ILE 61 24.402 23.791 14.524
492 H GLN 62 HN GLN 62 20.043 25.705 10.584
493 HA GLN 62 HA GLN 62 20.500 23.929 8.252
494 HB2 GLN 62 HB2 GLN 62 18.459 26.136 8.641
495 HB3 GLN 62 HB1 GLN 62 18.624 25.119 7.208
496 HG2 GLN 62 HG2 GLN 62 18.190 23.112 8.584
497 HG3 GLN 62 HG1 GLN 62 18.007 24.133 10.009
498 HE21 GLN 62 HE21 GLN 62 15.770 22.771 9.663
499 HE22 GLN 62 HE22 GLN 62 14.563 23.649 8.856
500 H LYS 63 HN LYS 63 20.134 25.732 6.222
501 HA LYS 63 HA LYS 63 22.687 27.005 6.110
502 HB2 LYS 63 HB2 LYS 63 21.264 26.033 4.172
503 HB3 LYS 63 HB1 LYS 63 20.421 27.580 4.203
504 HG2 LYS 63 HG2 LYS 63 22.637 28.732 3.953
505 HG3 LYS 63 HG1 LYS 63 23.396 27.150 3.783
506 HD2 LYS 63 HD2 LYS 63 22.061 26.680 1.793
507 HD3 LYS 63 HD1 LYS 63 21.186 28.199 1.991
508 HE2 LYS 63 HE2 LYS 63 23.346 29.429 1.746
509 HE3 LYS 63 HE1 LYS 63 24.151 27.893 1.431
510 HZ1 LYS 63 HZ1 LYS 63 22.084 29.243 -0.202
511 HZ2 LYS 63 HZ2 LYS 63 22.455 27.597 -0.402
512 HZ3 LYS 63 HZ3 LYS 63 23.648 28.779 -0.663
513 H GLU 64 HN GLU 64 23.078 29.268 5.734
514 HA GLU 64 HA GLU 64 22.988 31.461 6.414
515 HB2 GLU 64 HB2 GLU 64 19.993 31.307 6.147
516 HB3 GLU 64 HB1 GLU 64 21.076 32.643 5.758
517 HG2 GLU 64 HG2 GLU 64 22.090 31.134 3.972
518 HG3 GLU 64 HG1 GLU 64 20.732 30.046 4.252
519 H SER 65 HN SER 65 22.533 29.227 8.418
520 HA SER 65 HA SER 65 20.737 30.214 10.404
521 HB2 SER 65 HB2 SER 65 22.838 28.107 10.254
522 HB3 SER 65 HB1 SER 65 22.365 28.652 11.857
523 HG SER 65 HG SER 65 21.138 26.870 10.654
524 H THR 66 HN THR 66 21.018 31.828 11.841
525 HA THR 66 HA THR 66 23.507 33.305 11.818
526 HB THR 66 HB THR 66 20.813 33.726 13.108
527 HG1 THR 66 HG1 THR 66 21.913 34.328 10.799
528 HG21 THR 66 HG21 THR 66 23.399 35.217 13.542
529 HG22 THR 66 HG22 THR 66 22.241 34.653 14.746
530 HG23 THR 66 HG23 THR 66 21.841 36.024 13.711
531 H LEU 67 HN LEU 67 25.144 32.724 13.022
532 HA LEU 67 HA LEU 67 24.744 31.344 15.585
533 HB2 LEU 67 HB2 LEU 67 27.198 31.967 13.921
534 HB3 LEU 67 HB1 LEU 67 27.271 31.189 15.496
535 HG LEU 67 HG LEU 67 27.341 29.542 13.651
536 HD11 LEU 67 HD11 LEU 67 25.968 28.002 14.693
537 HD12 LEU 67 HD12 LEU 67 24.637 29.138 14.874
538 HD13 LEU 67 HD13 LEU 67 26.030 29.238 15.948
539 HD21 LEU 67 HD21 LEU 67 24.474 30.198 12.990
540 HD22 LEU 67 HD22 LEU 67 25.669 29.336 12.025
541 HD23 LEU 67 HD23 LEU 67 25.780 31.084 12.200
542 H HIS 68 HN HIS 68 27.045 32.292 16.906
543 HA HIS 68 HA HIS 68 26.962 35.185 17.007
544 HB2 HIS 68 HB2 HIS 68 25.884 33.564 19.324
545 HB3 HIS 68 HB1 HIS 68 26.227 35.291 19.369
546 HD2 HIS 68 HD2 HIS 68 23.231 33.137 18.722
547 HE1 HIS 68 HE1 HIS 68 22.564 36.583 16.376
548 HE2 HIS 68 HE2 HIS 68 21.484 34.493 17.334
549 H ILE 69 HN ILE 69 28.973 35.819 17.404
550 HA ILE 69 HA ILE 69 30.827 33.986 18.805
551 HB ILE 69 HB ILE 69 31.468 36.431 17.133
552 HG12 ILE 69 HG12 ILE 69 31.686 33.507 16.351
553 HG13 ILE 69 HG11 ILE 69 30.329 34.530 15.882
554 HG21 ILE 69 HG21 ILE 69 33.219 35.843 18.724
555 HG22 ILE 69 HG22 ILE 69 33.733 35.370 17.106
556 HG23 ILE 69 HG23 ILE 69 33.139 34.151 18.234
557 HD11 ILE 69 HD11 ILE 69 33.243 34.892 15.146
558 HD12 ILE 69 HD12 ILE 69 32.023 36.137 14.880
559 HD13 ILE 69 HD13 ILE 69 31.891 34.583 14.057
560 H VAL 70 HN VAL 70 30.918 34.400 20.931
561 HA VAL 70 HA VAL 70 30.741 37.197 21.884
562 HB VAL 70 HB VAL 70 30.605 34.656 23.520
563 HG11 VAL 70 HG11 VAL 70 29.478 36.204 25.130
564 HG12 VAL 70 HG12 VAL 70 29.832 37.543 24.038
565 HG13 VAL 70 HG13 VAL 70 31.151 36.655 24.801
566 HG21 VAL 70 HG21 VAL 70 28.371 36.321 22.317
567 HG22 VAL 70 HG22 VAL 70 28.147 35.011 23.477
568 HG23 VAL 70 HG23 VAL 70 28.786 34.668 21.869
569 H TRP 71 HN TRP 71 32.460 38.184 22.765
570 HA TRP 71 HA TRP 71 34.796 36.576 23.603
571 HB2 TRP 71 HB2 TRP 71 35.260 37.315 21.317
572 HB3 TRP 71 HB1 TRP 71 34.879 38.978 21.760
573 HD1 TRP 71 HD1 TRP 71 37.117 36.299 23.445
574 HE1 TRP 71 HE1 TRP 71 39.410 37.367 23.936
575 HE3 TRP 71 HE3 TRP 71 36.350 40.956 21.498
576 HZ2 TRP 71 HZ2 TRP 71 40.743 39.870 23.554
577 HZ3 TRP 71 HZ3 TRP 71 38.146 42.661 21.576
578 HH2 TRP 71 HH2 TRP 71 40.337 42.126 22.602
579 H ARG 72 HN ARG 72 35.359 37.116 25.595
580 HA ARG 72 HA ARG 72 35.708 39.796 26.466
581 HB2 ARG 72 HB2 ARG 72 33.213 39.683 26.514
582 HB3 ARG 72 HB1 ARG 72 33.333 38.358 27.671
583 HG2 ARG 72 HG2 ARG 72 34.490 39.782 29.264
584 HG3 ARG 72 HG1 ARG 72 34.548 41.100 28.093
585 HD2 ARG 72 HD2 ARG 72 32.014 41.020 28.038
586 HD3 ARG 72 HD1 ARG 72 32.094 39.916 29.410
587 HE ARG 72 HE ARG 72 32.461 42.755 29.491
588 HH11 ARG 72 HH21 ARG 72 33.474 39.739 30.851
589 HH12 ARG 72 HH22 ARG 72 33.915 40.421 32.382
590 HH21 ARG 72 HH11 ARG 72 33.046 43.657 31.494
591 HH22 ARG 72 HH12 ARG 72 33.677 42.637 32.744
592 H LEU 73 HN LEU 73 37.371 39.634 27.826
593 HA LEU 73 HA LEU 73 37.992 37.101 29.107
594 HB2 LEU 73 HB2 LEU 73 39.382 39.775 28.941
595 HB3 LEU 73 HB1 LEU 73 39.966 38.496 30.002
596 HG LEU 73 HG LEU 73 40.043 36.963 28.012
597 HD11 LEU 73 HD11 LEU 73 40.114 38.253 25.772
598 HD12 LEU 73 HD12 LEU 73 39.250 39.530 26.627
599 HD13 LEU 73 HD13 LEU 73 38.527 37.929 26.465
600 HD21 LEU 73 HD21 LEU 73 41.668 39.513 28.064
601 HD22 LEU 73 HD22 LEU 73 42.028 38.196 26.948
602 HD23 LEU 73 HD23 LEU 73 42.114 37.925 28.689
603 H ARG 74 HN ARG 74 37.043 36.558 30.960
604 HA ARG 74 HA ARG 74 36.034 38.607 32.788
605 HB2 ARG 74 HB2 ARG 74 34.671 36.594 32.236
606 HB3 ARG 74 HB1 ARG 74 35.899 35.590 33.007
607 HG2 ARG 74 HG2 ARG 74 35.564 36.837 35.130
608 HG3 ARG 74 HG1 ARG 74 34.306 37.795 34.351
609 HD2 ARG 74 HD2 ARG 74 32.961 35.803 33.977
610 HD3 ARG 74 HD1 ARG 74 34.248 34.776 34.604
611 HE ARG 74 HE ARG 74 33.620 35.380 36.765
612 HH11 ARG 74 HH21 ARG 74 32.145 37.431 34.399
613 HH12 ARG 74 HH22 ARG 74 31.077 38.196 35.528
614 HH21 ARG 74 HH11 ARG 74 32.221 36.376 38.249
615 HH22 ARG 74 HH12 ARG 74 31.121 37.599 37.707
616 H GLY 75 HN GLY 75 36.880 39.064 34.767
617 HA2 GLY 75 HA2 GLY 75 38.450 37.557 36.425
618 HA3 GLY 75 HA1 GLY 75 39.596 38.266 35.291
619 H GLY 76 HN GLY 76 39.710 38.831 38.003
620 HA2 GLY 76 HA2 GLY 76 38.419 41.400 38.487
621 HA3 GLY 76 HA1 GLY 76 39.462 40.521 39.602
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 26.258 23.470 1.554
2 H2 MET 1 HT2 MET 1 27.300 24.780 1.847
3 H3 MET 1 HT3 MET 1 25.996 24.951 0.770
4 HA MET 1 HA MET 1 24.634 25.546 2.388
5 HB2 MET 1 HB2 MET 1 24.495 23.021 2.759
6 HB3 MET 1 HB1 MET 1 25.644 23.251 4.078
7 HG2 MET 1 HG2 MET 1 24.100 24.883 5.122
8 HG3 MET 1 HG1 MET 1 22.947 24.607 3.819
9 HE1 MET 1 HE1 MET 1 23.884 23.797 7.274
10 HE2 MET 1 HE2 MET 1 25.145 22.846 6.494
11 HE3 MET 1 HE3 MET 1 23.896 22.035 7.435
12 H GLN 2 HN GLN 2 25.941 27.433 2.674
13 HA GLN 2 HA GLN 2 27.965 27.437 4.779
14 HB2 GLN 2 HB2 GLN 2 26.887 29.680 3.054
15 HB3 GLN 2 HB1 GLN 2 28.259 29.803 4.155
16 HG2 GLN 2 HG2 GLN 2 29.163 29.410 1.965
17 HG3 GLN 2 HG1 GLN 2 29.332 27.903 2.864
18 HE21 GLN 2 HE21 GLN 2 28.364 26.055 1.960
19 HE22 GLN 2 HE22 GLN 2 27.303 26.088 0.634
20 H ILE 3 HN ILE 3 27.765 29.647 6.148
21 HA ILE 3 HA ILE 3 25.034 30.054 7.125
22 HB ILE 3 HB ILE 3 25.875 29.722 9.500
23 HG12 ILE 3 HG12 ILE 3 28.033 28.104 8.135
24 HG13 ILE 3 HG11 ILE 3 28.307 29.737 8.744
25 HG21 ILE 3 HG21 ILE 3 25.497 27.313 9.438
26 HG22 ILE 3 HG22 ILE 3 25.853 27.276 7.710
27 HG23 ILE 3 HG23 ILE 3 24.411 28.105 8.297
28 HD11 ILE 3 HD11 ILE 3 28.952 27.969 10.390
29 HD12 ILE 3 HD12 ILE 3 27.271 27.439 10.426
30 HD13 ILE 3 HD13 ILE 3 27.700 29.051 10.997
31 H PHE 4 HN PHE 4 24.736 32.030 8.069
32 HA PHE 4 HA PHE 4 26.948 33.953 7.783
33 HB2 PHE 4 HB2 PHE 4 24.096 34.623 8.487
34 HB3 PHE 4 HB1 PHE 4 25.309 35.646 7.731
35 HD1 PHE 4 HD1 PHE 4 26.208 33.197 5.787
36 HD2 PHE 4 HD2 PHE 4 22.493 35.162 6.716
37 HE1 PHE 4 HE1 PHE 4 25.323 32.572 3.571
38 HE2 PHE 4 HE2 PHE 4 21.617 34.531 4.489
39 HZ PHE 4 HZ PHE 4 23.028 33.237 2.918
40 H VAL 5 HN VAL 5 28.164 34.312 9.484
41 HA VAL 5 HA VAL 5 27.047 33.982 12.201
42 HB VAL 5 HB VAL 5 29.391 33.884 12.915
43 HG11 VAL 5 HG11 VAL 5 28.083 31.866 11.885
44 HG12 VAL 5 HG12 VAL 5 29.820 31.714 12.130
45 HG13 VAL 5 HG13 VAL 5 29.185 32.064 10.522
46 HG21 VAL 5 HG21 VAL 5 29.867 34.570 10.025
47 HG22 VAL 5 HG22 VAL 5 31.091 33.698 10.946
48 HG23 VAL 5 HG23 VAL 5 30.570 35.300 11.467
49 H LYS 6 HN LYS 6 26.690 35.712 13.450
50 HA LYS 6 HA LYS 6 27.406 38.369 12.452
51 HB2 LYS 6 HB2 LYS 6 25.701 37.419 14.762
52 HB3 LYS 6 HB1 LYS 6 26.017 39.121 14.418
53 HG2 LYS 6 HG2 LYS 6 25.066 38.851 12.160
54 HG3 LYS 6 HG1 LYS 6 24.759 37.147 12.489
55 HD2 LYS 6 HD2 LYS 6 23.253 37.765 14.338
56 HD3 LYS 6 HD1 LYS 6 23.566 39.474 14.025
57 HE2 LYS 6 HE2 LYS 6 22.633 39.244 11.760
58 HE3 LYS 6 HE1 LYS 6 22.340 37.529 12.047
59 HZ1 LYS 6 HZ1 LYS 6 20.394 38.097 12.903
60 HZ2 LYS 6 HZ2 LYS 6 20.757 39.753 12.791
61 HZ3 LYS 6 HZ3 LYS 6 21.203 38.874 14.175
62 H GLY 7 HN GLY 7 29.442 38.970 12.874
63 HA2 GLY 7 HA2 GLY 7 30.808 38.147 15.304
64 HA3 GLY 7 HA1 GLY 7 31.489 39.095 13.989
65 H LEU 8 HN LEU 8 32.331 40.150 16.089
66 HA LEU 8 HA LEU 8 30.654 41.770 17.681
67 HB2 LEU 8 HB2 LEU 8 33.552 42.283 16.977
68 HB3 LEU 8 HB1 LEU 8 32.687 42.873 18.394
69 HG LEU 8 HG LEU 8 33.146 39.940 17.766
70 HD11 LEU 8 HD11 LEU 8 34.904 39.962 19.380
71 HD12 LEU 8 HD12 LEU 8 34.490 41.591 19.915
72 HD13 LEU 8 HD13 LEU 8 35.214 41.342 18.327
73 HD21 LEU 8 HD21 LEU 8 31.235 40.073 19.152
74 HD22 LEU 8 HD22 LEU 8 31.872 41.447 20.056
75 HD23 LEU 8 HD23 LEU 8 32.551 39.838 20.300
76 H THR 9 HN THR 9 32.431 42.423 14.689
77 HA THR 9 HA THR 9 31.834 45.194 14.560
78 HB THR 9 HB THR 9 32.351 43.384 12.199
79 HG1 THR 9 HG1 THR 9 34.566 43.867 12.666
80 HG21 THR 9 HG21 THR 9 33.041 46.280 12.773
81 HG22 THR 9 HG22 THR 9 31.721 45.735 11.738
82 HG23 THR 9 HG23 THR 9 33.393 45.408 11.281
83 H GLY 10 HN GLY 10 29.998 42.356 13.850
84 HA2 GLY 10 HA2 GLY 10 27.643 42.352 13.567
85 HA3 GLY 10 HA1 GLY 10 27.721 44.019 13.001
86 H LYS 11 HN LYS 11 30.212 42.417 11.572
87 HA LYS 11 HA LYS 11 28.873 42.327 9.006
88 HB2 LYS 11 HB2 LYS 11 31.198 43.174 9.283
89 HB3 LYS 11 HB1 LYS 11 31.704 41.550 9.743
90 HG2 LYS 11 HG2 LYS 11 30.924 40.693 7.554
91 HG3 LYS 11 HG1 LYS 11 30.449 42.329 7.093
92 HD2 LYS 11 HD2 LYS 11 32.789 43.081 7.368
93 HD3 LYS 11 HD1 LYS 11 33.259 41.436 7.799
94 HE2 LYS 11 HE2 LYS 11 32.523 40.629 5.600
95 HE3 LYS 11 HE1 LYS 11 31.997 42.255 5.166
96 HZ1 LYS 11 HZ1 LYS 11 34.643 42.374 6.087
97 HZ2 LYS 11 HZ2 LYS 11 34.047 42.731 4.536
98 HZ3 LYS 11 HZ3 LYS 11 34.547 41.152 4.916
99 H THR 12 HN THR 12 28.305 40.535 7.858
100 HA THR 12 HA THR 12 28.216 37.998 9.306
101 HB THR 12 HB THR 12 26.890 37.299 7.231
102 HG1 THR 12 HG1 THR 12 27.226 40.074 6.778
103 HG21 THR 12 HG21 THR 12 25.838 37.967 9.354
104 HG22 THR 12 HG22 THR 12 24.894 38.537 7.978
105 HG23 THR 12 HG23 THR 12 25.924 39.659 8.867
106 H THR 13 HN THR 13 29.538 36.341 8.958
107 HA THR 13 HA THR 13 31.324 36.413 6.579
108 HB THR 13 HB THR 13 31.810 35.734 9.459
109 HG1 THR 13 HG1 THR 13 33.882 36.668 8.103
110 HG21 THR 13 HG21 THR 13 33.092 34.391 7.092
111 HG22 THR 13 HG22 THR 13 32.589 33.686 8.628
112 HG23 THR 13 HG23 THR 13 34.031 34.697 8.554
113 H THR 14 HN THR 14 30.621 34.993 5.122
114 HA THR 14 HA THR 14 29.000 32.729 5.783
115 HB THR 14 HB THR 14 29.324 32.148 3.360
116 HG1 THR 14 HG1 THR 14 31.288 34.007 3.709
117 HG21 THR 14 HG21 THR 14 28.278 34.354 2.542
118 HG22 THR 14 HG22 THR 14 28.444 34.909 4.208
119 HG23 THR 14 HG23 THR 14 27.445 33.504 3.842
120 H LEU 15 HN LEU 15 29.812 31.048 6.848
121 HA LEU 15 HA LEU 15 32.577 30.155 6.343
122 HB2 LEU 15 HB2 LEU 15 30.586 29.282 8.448
123 HB3 LEU 15 HB1 LEU 15 32.269 28.779 8.351
124 HG LEU 15 HG LEU 15 31.396 31.668 8.630
125 HD11 LEU 15 HD11 LEU 15 32.435 29.807 10.786
126 HD12 LEU 15 HD12 LEU 15 30.734 30.225 10.583
127 HD13 LEU 15 HD13 LEU 15 31.907 31.477 10.992
128 HD21 LEU 15 HD21 LEU 15 34.047 30.211 8.710
129 HD22 LEU 15 HD22 LEU 15 33.846 31.762 9.521
130 HD23 LEU 15 HD23 LEU 15 33.607 31.644 7.782
131 H GLU 16 HN GLU 16 33.064 28.130 5.591
132 HA GLU 16 HA GLU 16 30.953 26.744 4.137
133 HB2 GLU 16 HB2 GLU 16 33.937 26.282 4.351
134 HB3 GLU 16 HB1 GLU 16 32.854 25.294 3.368
135 HG2 GLU 16 HG2 GLU 16 32.153 27.307 2.121
136 HG3 GLU 16 HG1 GLU 16 33.243 28.288 3.096
137 H VAL 17 HN VAL 17 29.752 25.243 5.098
138 HA VAL 17 HA VAL 17 31.004 23.368 7.001
139 HB VAL 17 HB VAL 17 29.120 23.615 8.560
140 HG11 VAL 17 HG11 VAL 17 31.199 25.011 8.796
141 HG12 VAL 17 HG12 VAL 17 29.762 25.760 9.496
142 HG13 VAL 17 HG13 VAL 17 30.369 26.305 7.932
143 HG21 VAL 17 HG21 VAL 17 27.340 24.329 7.134
144 HG22 VAL 17 HG22 VAL 17 28.265 25.713 6.552
145 HG23 VAL 17 HG23 VAL 17 27.658 25.690 8.208
146 H GLU 18 HN GLU 18 29.636 21.483 7.432
147 HA GLU 18 HA GLU 18 27.536 20.942 5.461
148 HB2 GLU 18 HB2 GLU 18 30.113 19.394 5.720
149 HB3 GLU 18 HB1 GLU 18 28.659 18.678 5.029
150 HG2 GLU 18 HG2 GLU 18 28.558 20.492 3.358
151 HG3 GLU 18 HG1 GLU 18 30.019 21.202 4.043
152 HA PRO 19 HA PRO 19 25.333 18.971 8.762
153 HB2 PRO 19 HB2 PRO 19 25.439 16.513 7.026
154 HB3 PRO 19 HB1 PRO 19 24.065 17.196 7.920
155 HG2 PRO 19 HG2 PRO 19 24.339 17.572 5.288
156 HG3 PRO 19 HG1 PRO 19 23.683 18.835 6.345
157 HD2 PRO 19 HD2 PRO 19 26.315 18.743 4.971
158 HD3 PRO 19 HD1 PRO 19 25.411 20.144 5.587
159 H SER 20 HN SER 20 27.751 16.823 7.235
160 HA SER 20 HA SER 20 28.285 15.311 9.582
161 HB2 SER 20 HB2 SER 20 30.355 14.617 8.305
162 HB3 SER 20 HB1 SER 20 28.832 14.342 7.463
163 HG SER 20 HG SER 20 29.218 16.443 6.469
164 H ASP 21 HN ASP 21 29.582 18.302 8.287
165 HA ASP 21 HA ASP 21 31.978 18.471 9.714
166 HB2 ASP 21 HB2 ASP 21 31.116 20.044 7.907
167 HB3 ASP 21 HB1 ASP 21 30.172 20.825 9.179
168 H THR 22 HN THR 22 32.361 18.442 11.803
169 HA THR 22 HA THR 22 30.240 18.832 13.737
170 HB THR 22 HB THR 22 31.899 18.198 15.387
171 HG1 THR 22 HG1 THR 22 33.603 18.948 13.331
172 HG21 THR 22 HG21 THR 22 30.925 16.392 14.038
173 HG22 THR 22 HG22 THR 22 32.600 16.019 14.448
174 HG23 THR 22 HG23 THR 22 32.195 16.596 12.831
175 H ILE 23 HN ILE 23 30.587 20.251 15.628
176 HA ILE 23 HA ILE 23 30.881 22.944 14.840
177 HB ILE 23 HB ILE 23 31.051 21.851 17.654
178 HG12 ILE 23 HG12 ILE 23 29.119 20.846 16.597
179 HG13 ILE 23 HG11 ILE 23 28.554 22.146 17.637
180 HG21 ILE 23 HG21 ILE 23 30.110 24.486 16.483
181 HG22 ILE 23 HG22 ILE 23 31.551 24.232 17.468
182 HG23 ILE 23 HG23 ILE 23 29.950 24.031 18.180
183 HD11 ILE 23 HD11 ILE 23 27.348 22.497 15.651
184 HD12 ILE 23 HD12 ILE 23 28.723 22.078 14.633
185 HD13 ILE 23 HD13 ILE 23 28.699 23.619 15.487
186 H GLU 24 HN GLU 24 33.049 20.731 16.561
187 HA GLU 24 HA GLU 24 35.074 22.380 17.376
188 HB2 GLU 24 HB2 GLU 24 35.003 19.892 17.646
189 HB3 GLU 24 HB1 GLU 24 35.495 19.737 15.960
190 HG2 GLU 24 HG2 GLU 24 37.544 21.046 16.452
191 HG3 GLU 24 HG1 GLU 24 37.058 21.143 18.144
192 H ASN 25 HN ASN 25 34.566 21.101 14.103
193 HA ASN 25 HA ASN 25 36.872 22.285 12.941
194 HB2 ASN 25 HB2 ASN 25 35.650 20.420 11.889
195 HB3 ASN 25 HB1 ASN 25 34.260 21.479 11.637
196 HD21 ASN 25 HD21 ASN 25 35.652 20.227 9.444
197 HD22 ASN 25 HD22 ASN 25 36.396 21.452 8.533
198 H VAL 26 HN VAL 26 33.471 23.293 13.089
199 HA VAL 26 HA VAL 26 33.595 25.590 11.543
200 HB VAL 26 HB VAL 26 31.979 25.193 14.073
201 HG11 VAL 26 HG11 VAL 26 31.761 27.072 11.713
202 HG12 VAL 26 HG12 VAL 26 31.856 27.488 13.424
203 HG13 VAL 26 HG13 VAL 26 30.399 26.732 12.779
204 HG21 VAL 26 HG21 VAL 26 31.184 24.637 11.203
205 HG22 VAL 26 HG22 VAL 26 30.301 24.204 12.667
206 HG23 VAL 26 HG23 VAL 26 31.815 23.389 12.276
207 H LYS 27 HN LYS 27 34.293 25.218 15.010
208 HA LYS 27 HA LYS 27 34.892 27.952 15.493
209 HB2 LYS 27 HB2 LYS 27 35.720 25.414 16.919
210 HB3 LYS 27 HB1 LYS 27 36.107 27.031 17.508
211 HG2 LYS 27 HG2 LYS 27 33.682 27.588 17.497
212 HG3 LYS 27 HG1 LYS 27 33.324 25.934 17.005
213 HD2 LYS 27 HD2 LYS 27 34.853 26.646 19.525
214 HD3 LYS 27 HD1 LYS 27 33.118 26.345 19.490
215 HE2 LYS 27 HE2 LYS 27 33.776 24.091 18.333
216 HE3 LYS 27 HE1 LYS 27 35.377 24.414 18.999
217 HZ1 LYS 27 HZ1 LYS 27 32.939 24.520 20.667
218 HZ2 LYS 27 HZ2 LYS 27 34.557 24.384 21.169
219 HZ3 LYS 27 HZ3 LYS 27 33.785 23.072 20.415
220 H ALA 28 HN ALA 28 36.782 25.210 14.347
221 HA ALA 28 HA ALA 28 39.346 26.412 14.576
222 HB1 ALA 28 HB1 ALA 28 40.132 24.620 13.228
223 HB2 ALA 28 HB2 ALA 28 38.551 24.383 12.485
224 HB3 ALA 28 HB3 ALA 28 38.808 23.943 14.174
225 H LYS 29 HN LYS 29 36.962 26.250 11.954
226 HA LYS 29 HA LYS 29 38.482 27.620 10.006
227 HB2 LYS 29 HB2 LYS 29 35.505 27.290 10.418
228 HB3 LYS 29 HB1 LYS 29 36.175 28.142 9.030
229 HG2 LYS 29 HG2 LYS 29 37.168 25.370 9.690
230 HG3 LYS 29 HG1 LYS 29 35.633 25.563 8.849
231 HD2 LYS 29 HD2 LYS 29 36.764 26.904 7.098
232 HD3 LYS 29 HD1 LYS 29 38.305 26.672 7.920
233 HE2 LYS 29 HE2 LYS 29 37.845 24.154 7.732
234 HE3 LYS 29 HE1 LYS 29 36.578 24.589 6.584
235 HZ1 LYS 29 HZ1 LYS 29 38.161 25.631 5.179
236 HZ2 LYS 29 HZ2 LYS 29 38.779 24.097 5.567
237 HZ3 LYS 29 HZ3 LYS 29 39.394 25.483 6.333
238 H ILE 30 HN ILE 30 36.234 28.710 12.496
239 HA ILE 30 HA ILE 30 36.201 31.450 11.785
240 HB ILE 30 HB ILE 30 35.688 30.014 14.396
241 HG12 ILE 30 HG12 ILE 30 33.757 31.420 12.542
242 HG13 ILE 30 HG11 ILE 30 34.169 29.715 12.359
243 HG21 ILE 30 HG21 ILE 30 36.295 32.218 15.068
244 HG22 ILE 30 HG22 ILE 30 34.533 32.225 14.998
245 HG23 ILE 30 HG23 ILE 30 35.471 32.946 13.689
246 HD11 ILE 30 HD11 ILE 30 33.247 30.784 15.026
247 HD12 ILE 30 HD12 ILE 30 33.201 29.128 14.419
248 HD13 ILE 30 HD13 ILE 30 32.079 30.329 13.785
249 H GLN 31 HN GLN 31 38.204 29.595 14.067
250 HA GLN 31 HA GLN 31 39.663 31.721 15.151
251 HB2 GLN 31 HB2 GLN 31 39.763 29.478 16.096
252 HB3 GLN 31 HB1 GLN 31 40.532 28.867 14.628
253 HG2 GLN 31 HG2 GLN 31 42.504 30.178 15.011
254 HG3 GLN 31 HG1 GLN 31 41.721 31.091 16.300
255 HE21 GLN 31 HE21 GLN 31 44.153 29.720 16.814
256 HE22 GLN 31 HE22 GLN 31 43.836 28.419 17.857
257 H ASP 32 HN ASP 32 39.697 30.423 11.992
258 HA ASP 32 HA ASP 32 42.400 31.315 11.355
259 HB2 ASP 32 HB2 ASP 32 41.284 29.279 10.323
260 HB3 ASP 32 HB1 ASP 32 40.267 30.403 9.423
261 H LYS 33 HN LYS 33 39.347 32.710 11.612
262 HA LYS 33 HA LYS 33 40.063 34.927 9.768
263 HB2 LYS 33 HB2 LYS 33 37.323 34.060 10.727
264 HB3 LYS 33 HB1 LYS 33 37.667 35.378 9.605
265 HG2 LYS 33 HG2 LYS 33 38.753 33.739 8.069
266 HG3 LYS 33 HG1 LYS 33 38.277 32.442 9.166
267 HD2 LYS 33 HD2 LYS 33 35.906 33.049 8.866
268 HD3 LYS 33 HD1 LYS 33 36.376 34.349 7.771
269 HE2 LYS 33 HE2 LYS 33 36.970 31.407 7.334
270 HE3 LYS 33 HE1 LYS 33 35.685 32.310 6.533
271 HZ1 LYS 33 HZ1 LYS 33 37.416 32.416 5.029
272 HZ2 LYS 33 HZ2 LYS 33 38.605 32.580 6.233
273 HZ3 LYS 33 HZ3 LYS 33 37.581 33.884 5.861
274 H THR 34 HN THR 34 39.510 33.989 13.009
275 HA THR 34 HA THR 34 39.281 36.813 13.892
276 HB THR 34 HB THR 34 38.413 35.853 16.016
277 HG1 THR 34 HG1 THR 34 38.888 33.503 14.564
278 HG21 THR 34 HG21 THR 34 36.887 34.879 13.586
279 HG22 THR 34 HG22 THR 34 36.905 36.555 14.133
280 HG23 THR 34 HG23 THR 34 36.213 35.299 15.161
281 H GLY 35 HN GLY 35 41.028 33.782 14.230
282 HA2 GLY 35 HA2 GLY 35 43.189 33.390 14.953
283 HA3 GLY 35 HA1 GLY 35 43.390 35.128 15.137
284 H LEU 36 HN LEU 36 40.630 34.087 16.755
285 HA LEU 36 HA LEU 36 41.834 34.584 19.317
286 HB2 LEU 36 HB2 LEU 36 39.051 33.743 18.518
287 HB3 LEU 36 HB1 LEU 36 39.526 34.105 20.174
288 HG LEU 36 HG LEU 36 39.885 36.055 17.879
289 HD11 LEU 36 HD11 LEU 36 37.835 37.142 18.641
290 HD12 LEU 36 HD12 LEU 36 37.641 35.940 19.916
291 HD13 LEU 36 HD13 LEU 36 37.487 35.464 18.225
292 HD21 LEU 36 HD21 LEU 36 39.774 37.639 19.991
293 HD22 LEU 36 HD22 LEU 36 41.274 36.798 19.623
294 HD23 LEU 36 HD23 LEU 36 40.207 36.181 20.882
295 HA PRO 37 HA PRO 37 43.184 30.386 20.249
296 HB2 PRO 37 HB2 PRO 37 42.002 31.085 22.929
297 HB3 PRO 37 HB1 PRO 37 43.556 30.312 22.559
298 HG2 PRO 37 HG2 PRO 37 43.405 32.897 23.216
299 HG3 PRO 37 HG1 PRO 37 44.577 32.303 22.025
300 HD2 PRO 37 HD2 PRO 37 42.131 33.934 21.580
301 HD3 PRO 37 HD1 PRO 37 43.580 33.769 20.563
302 HA PRO 38 HA PRO 38 39.464 27.996 19.805
303 HB2 PRO 38 HB2 PRO 38 40.112 25.684 21.215
304 HB3 PRO 38 HB1 PRO 38 40.668 26.041 19.568
305 HG2 PRO 38 HG2 PRO 38 42.101 26.405 22.163
306 HG3 PRO 38 HG1 PRO 38 42.716 25.807 20.611
307 HD2 PRO 38 HD2 PRO 38 43.200 28.332 21.430
308 HD3 PRO 38 HD1 PRO 38 42.931 27.955 19.715
309 H ASP 39 HN ASP 39 40.820 28.310 23.047
310 HA ASP 39 HA ASP 39 38.332 27.698 24.389
311 HB2 ASP 39 HB2 ASP 39 39.574 28.430 26.428
312 HB3 ASP 39 HB1 ASP 39 40.400 27.164 25.520
313 H GLN 40 HN GLN 40 39.327 30.316 22.639
314 HA GLN 40 HA GLN 40 37.883 32.281 24.327
315 HB2 GLN 40 HB2 GLN 40 39.908 32.623 22.109
316 HB3 GLN 40 HB1 GLN 40 38.953 33.959 22.754
317 HG2 GLN 40 HG2 GLN 40 40.628 32.151 24.501
318 HG3 GLN 40 HG1 GLN 40 41.250 33.642 23.798
319 HE21 GLN 40 HE21 GLN 40 38.049 34.300 24.289
320 HE22 GLN 40 HE22 GLN 40 38.126 34.949 25.856
321 H GLN 41 HN GLN 41 37.046 30.131 22.167
322 HA GLN 41 HA GLN 41 35.391 31.950 20.503
323 HB2 GLN 41 HB2 GLN 41 37.043 30.308 19.405
324 HB3 GLN 41 HB1 GLN 41 35.936 29.038 19.924
325 HG2 GLN 41 HG2 GLN 41 35.287 29.630 17.694
326 HG3 GLN 41 HG1 GLN 41 34.084 30.340 18.768
327 HE21 GLN 41 HE21 GLN 41 33.544 32.156 17.423
328 HE22 GLN 41 HE22 GLN 41 34.658 33.384 17.060
329 H ARG 42 HN ARG 42 33.187 31.545 20.301
330 HA ARG 42 HA ARG 42 31.970 29.353 21.798
331 HB2 ARG 42 HB2 ARG 42 32.280 31.182 23.470
332 HB3 ARG 42 HB1 ARG 42 31.298 32.233 22.449
333 HG2 ARG 42 HG2 ARG 42 29.381 30.779 22.681
334 HG3 ARG 42 HG1 ARG 42 30.346 29.563 23.518
335 HD2 ARG 42 HD2 ARG 42 29.946 32.378 24.557
336 HD3 ARG 42 HD1 ARG 42 28.937 31.017 25.036
337 HE ARG 42 HE ARG 42 31.598 30.261 25.456
338 HH11 ARG 42 HH21 ARG 42 29.322 32.626 26.547
339 HH12 ARG 42 HH22 ARG 42 30.001 32.752 28.134
340 HH21 ARG 42 HH11 ARG 42 32.497 30.422 27.541
341 HH22 ARG 42 HH12 ARG 42 31.798 31.504 28.697
342 H LEU 43 HN LEU 43 30.120 28.686 20.866
343 HA LEU 43 HA LEU 43 28.859 30.426 18.814
344 HB2 LEU 43 HB2 LEU 43 29.284 27.428 18.698
345 HB3 LEU 43 HB1 LEU 43 28.418 28.391 17.498
346 HG LEU 43 HG LEU 43 31.325 28.800 18.268
347 HD11 LEU 43 HD11 LEU 43 30.095 27.473 15.832
348 HD12 LEU 43 HD12 LEU 43 30.987 26.655 17.115
349 HD13 LEU 43 HD13 LEU 43 31.814 27.799 16.058
350 HD21 LEU 43 HD21 LEU 43 29.436 30.146 16.339
351 HD22 LEU 43 HD22 LEU 43 31.150 30.048 15.935
352 HD23 LEU 43 HD23 LEU 43 30.640 30.867 17.407
353 H ILE 44 HN ILE 44 26.758 30.727 19.022
354 HA ILE 44 HA ILE 44 25.118 28.806 20.552
355 HB ILE 44 HB ILE 44 25.313 31.787 21.023
356 HG12 ILE 44 HG12 ILE 44 25.314 29.528 23.032
357 HG13 ILE 44 HG11 ILE 44 26.797 30.073 22.249
358 HG21 ILE 44 HG21 ILE 44 23.380 31.322 22.649
359 HG22 ILE 44 HG22 ILE 44 23.122 29.833 21.739
360 HG23 ILE 44 HG23 ILE 44 22.967 31.394 20.936
361 HD11 ILE 44 HD11 ILE 44 24.937 31.997 23.648
362 HD12 ILE 44 HD12 ILE 44 26.617 32.252 23.175
363 HD13 ILE 44 HD13 ILE 44 26.232 31.160 24.504
364 H PHE 45 HN PHE 45 23.436 28.224 19.372
365 HA PHE 45 HA PHE 45 22.412 30.071 17.277
366 HB2 PHE 45 HB2 PHE 45 23.524 28.018 16.411
367 HB3 PHE 45 HB1 PHE 45 22.366 27.040 17.307
368 HD1 PHE 45 HD2 PHE 45 22.489 29.860 14.829
369 HD2 PHE 45 HD1 PHE 45 20.360 26.430 16.279
370 HE1 PHE 45 HE2 PHE 45 20.856 30.088 12.976
371 HE2 PHE 45 HE1 PHE 45 18.724 26.654 14.428
372 HZ PHE 45 HZ PHE 45 18.977 28.482 12.771
373 H ALA 46 HN ALA 46 20.325 30.650 17.453
374 HA ALA 46 HA ALA 46 18.196 30.841 18.300
375 HB1 ALA 46 HB1 ALA 46 18.541 27.837 18.316
376 HB2 ALA 46 HB2 ALA 46 17.728 28.824 17.101
377 HB3 ALA 46 HB3 ALA 46 17.017 28.635 18.704
378 H GLY 47 HN GLY 47 20.572 30.793 20.149
379 HA2 GLY 47 HA2 GLY 47 20.669 31.342 22.423
380 HA3 GLY 47 HA1 GLY 47 19.044 30.697 22.633
381 H LYS 48 HN LYS 48 20.186 28.269 21.008
382 HA LYS 48 HA LYS 48 20.838 26.712 23.358
383 HB2 LYS 48 HB2 LYS 48 20.680 25.983 20.424
384 HB3 LYS 48 HB1 LYS 48 20.974 24.828 21.725
385 HG2 LYS 48 HG2 LYS 48 18.834 25.452 22.774
386 HG3 LYS 48 HG1 LYS 48 18.537 26.618 21.484
387 HD2 LYS 48 HD2 LYS 48 18.585 24.779 19.826
388 HD3 LYS 48 HD1 LYS 48 18.839 23.620 21.132
389 HE2 LYS 48 HE2 LYS 48 16.478 23.631 20.627
390 HE3 LYS 48 HE1 LYS 48 16.695 24.455 22.172
391 HZ1 LYS 48 HZ1 LYS 48 16.972 26.453 20.373
392 HZ2 LYS 48 HZ2 LYS 48 15.548 26.098 21.230
393 HZ3 LYS 48 HZ3 LYS 48 15.768 25.495 19.658
394 H GLN 49 HN GLN 49 22.806 26.081 24.025
395 HA GLN 49 HA GLN 49 25.138 27.196 22.676
396 HB2 GLN 49 HB2 GLN 49 24.928 27.368 25.126
397 HB3 GLN 49 HB1 GLN 49 24.935 25.608 25.243
398 HG2 GLN 49 HG2 GLN 49 27.169 25.495 24.314
399 HG3 GLN 49 HG1 GLN 49 27.162 27.225 23.977
400 HE21 GLN 49 HE21 GLN 49 28.842 25.426 25.890
401 HE22 GLN 49 HE22 GLN 49 28.761 26.253 27.370
402 H LEU 50 HN LEU 50 26.506 26.106 21.433
403 HA LEU 50 HA LEU 50 26.001 23.292 20.871
404 HB2 LEU 50 HB2 LEU 50 28.191 24.981 19.670
405 HB3 LEU 50 HB1 LEU 50 27.362 23.590 18.977
406 HG LEU 50 HG LEU 50 26.149 26.311 19.515
407 HD11 LEU 50 HD11 LEU 50 26.548 24.836 16.897
408 HD12 LEU 50 HD12 LEU 50 27.681 26.040 17.513
409 HD13 LEU 50 HD13 LEU 50 26.027 26.506 17.115
410 HD21 LEU 50 HD21 LEU 50 24.420 24.723 19.912
411 HD22 LEU 50 HD22 LEU 50 24.964 23.685 18.592
412 HD23 LEU 50 HD23 LEU 50 24.192 25.231 18.239
413 H GLU 51 HN GLU 51 27.551 21.642 21.076
414 HA GLU 51 HA GLU 51 29.968 22.231 22.666
415 HB2 GLU 51 HB2 GLU 51 27.878 20.150 23.356
416 HB3 GLU 51 HB1 GLU 51 29.470 20.261 24.106
417 HG2 GLU 51 HG2 GLU 51 28.962 22.538 24.885
418 HG3 GLU 51 HG1 GLU 51 27.379 22.457 24.114
419 H ASP 52 HN ASP 52 31.698 20.954 22.184
420 HA ASP 52 HA ASP 52 31.967 19.744 19.732
421 HB2 ASP 52 HB2 ASP 52 33.399 19.095 22.317
422 HB3 ASP 52 HB1 ASP 52 33.908 18.513 20.733
423 H GLY 53 HN GLY 53 32.047 17.547 19.033
424 HA2 GLY 53 HA2 GLY 53 31.505 15.276 19.076
425 HA3 GLY 53 HA1 GLY 53 30.916 15.466 20.724
426 H ARG 54 HN ARG 54 29.772 17.827 18.558
427 HA ARG 54 HA ARG 54 27.240 16.357 18.091
428 HB2 ARG 54 HB2 ARG 54 27.609 19.202 19.053
429 HB3 ARG 54 HB1 ARG 54 26.080 18.554 18.467
430 HG2 ARG 54 HG2 ARG 54 27.550 17.078 20.643
431 HG3 ARG 54 HG1 ARG 54 26.633 18.523 21.059
432 HD2 ARG 54 HD2 ARG 54 24.616 17.541 20.018
433 HD3 ARG 54 HD1 ARG 54 25.527 16.088 19.628
434 HE ARG 54 HE ARG 54 25.671 16.686 22.422
435 HH11 ARG 54 HH21 ARG 54 23.662 15.408 19.911
436 HH12 ARG 54 HH22 ARG 54 22.765 14.367 20.967
437 HH21 ARG 54 HH11 ARG 54 24.495 15.328 23.815
438 HH22 ARG 54 HH12 ARG 54 23.237 14.324 23.177
439 H THR 55 HN THR 55 26.155 16.859 16.190
440 HA THR 55 HA THR 55 27.757 18.321 14.165
441 HB THR 55 HB THR 55 26.435 16.967 12.524
442 HG1 THR 55 HG1 THR 55 25.650 15.562 14.858
443 HG21 THR 55 HG21 THR 55 27.967 15.388 14.610
444 HG22 THR 55 HG22 THR 55 28.688 16.274 13.266
445 HG23 THR 55 HG23 THR 55 27.659 14.876 12.950
446 H LEU 56 HN LEU 56 26.277 19.193 12.344
447 HA LEU 56 HA LEU 56 24.576 21.177 13.464
448 HB2 LEU 56 HB2 LEU 56 24.678 20.280 10.584
449 HB3 LEU 56 HB1 LEU 56 24.138 21.841 11.193
450 HG LEU 56 HG LEU 56 26.947 20.734 11.417
451 HD11 LEU 56 HD11 LEU 56 27.409 22.760 9.918
452 HD12 LEU 56 HD12 LEU 56 25.667 22.836 9.658
453 HD13 LEU 56 HD13 LEU 56 26.572 21.409 9.156
454 HD21 LEU 56 HD21 LEU 56 25.608 23.222 12.479
455 HD22 LEU 56 HD22 LEU 56 27.333 23.230 12.109
456 HD23 LEU 56 HD23 LEU 56 26.696 22.110 13.310
457 H SER 57 HN SER 57 24.023 18.076 11.926
458 HA SER 57 HA SER 57 21.231 18.268 11.573
459 HB2 SER 57 HB2 SER 57 21.285 15.799 11.462
460 HB3 SER 57 HB1 SER 57 22.549 16.533 10.478
461 HG SER 57 HG SER 57 23.930 16.225 12.370
462 H ASP 58 HN ASP 58 23.108 17.952 14.419
463 HA ASP 58 HA ASP 58 21.008 16.683 15.991
464 HB2 ASP 58 HB2 ASP 58 23.718 17.822 16.682
465 HB3 ASP 58 HB1 ASP 58 22.600 17.219 17.901
466 H TYR 59 HN TYR 59 22.472 19.875 15.597
467 HA TYR 59 HA TYR 59 20.699 21.099 17.549
468 HB2 TYR 59 HB2 TYR 59 22.667 22.314 15.601
469 HB3 TYR 59 HB1 TYR 59 21.830 23.187 16.882
470 HD1 TYR 59 HD2 TYR 59 22.083 22.163 19.306
471 HD2 TYR 59 HD1 TYR 59 24.769 21.387 16.044
472 HE1 TYR 59 HE2 TYR 59 23.855 21.514 20.916
473 HE2 TYR 59 HE1 TYR 59 26.537 20.743 17.652
474 HH TYR 59 HH TYR 59 27.142 20.995 19.918
475 H ASN 60 HN ASN 60 20.372 20.074 14.415
476 HA ASN 60 HA ASN 60 18.779 20.421 12.801
477 HB2 ASN 60 HB2 ASN 60 17.321 20.617 14.929
478 HB3 ASN 60 HB1 ASN 60 17.388 22.356 14.650
479 HD21 ASN 60 HD21 ASN 60 14.903 21.005 14.467
480 HD22 ASN 60 HD22 ASN 60 14.404 20.988 12.846
481 H ILE 61 HN ILE 61 21.146 22.189 13.206
482 HA ILE 61 HA ILE 61 20.392 24.837 12.397
483 HB ILE 61 HB ILE 61 23.010 23.339 12.570
484 HG12 ILE 61 HG12 ILE 61 22.040 25.824 13.999
485 HG13 ILE 61 HG11 ILE 61 21.758 24.198 14.616
486 HG21 ILE 61 HG21 ILE 61 22.458 26.106 11.487
487 HG22 ILE 61 HG22 ILE 61 23.394 24.815 10.737
488 HG23 ILE 61 HG23 ILE 61 24.028 25.656 12.152
489 HD11 ILE 61 HD11 ILE 61 24.470 25.424 14.025
490 HD12 ILE 61 HD12 ILE 61 24.201 23.785 14.616
491 HD13 ILE 61 HD13 ILE 61 23.782 25.167 15.629
492 H GLN 62 HN GLN 62 20.028 25.597 10.418
493 HA GLN 62 HA GLN 62 20.580 23.842 8.087
494 HB2 GLN 62 HB2 GLN 62 18.486 26.012 8.379
495 HB3 GLN 62 HB1 GLN 62 18.703 24.943 6.992
496 HG2 GLN 62 HG2 GLN 62 18.369 22.996 8.605
497 HG3 GLN 62 HG1 GLN 62 17.842 24.190 9.791
498 HE21 GLN 62 HE21 GLN 62 15.815 22.574 9.323
499 HE22 GLN 62 HE22 GLN 62 14.711 23.178 8.184
500 H LYS 63 HN LYS 63 20.090 25.796 6.129
501 HA LYS 63 HA LYS 63 22.654 27.082 6.055
502 HB2 LYS 63 HB2 LYS 63 21.224 26.156 4.080
503 HB3 LYS 63 HB1 LYS 63 20.403 27.713 4.152
504 HG2 LYS 63 HG2 LYS 63 22.551 28.880 3.867
505 HG3 LYS 63 HG1 LYS 63 23.399 27.333 3.841
506 HD2 LYS 63 HD2 LYS 63 22.114 26.671 1.829
507 HD3 LYS 63 HD1 LYS 63 21.301 28.237 1.844
508 HE2 LYS 63 HE2 LYS 63 23.543 29.344 1.655
509 HE3 LYS 63 HE1 LYS 63 24.273 27.747 1.488
510 HZ1 LYS 63 HZ1 LYS 63 22.391 27.572 -0.350
511 HZ2 LYS 63 HZ2 LYS 63 23.934 28.198 -0.686
512 HZ3 LYS 63 HZ3 LYS 63 22.632 29.251 -0.396
513 H GLU 64 HN GLU 64 23.036 29.339 5.831
514 HA GLU 64 HA GLU 64 22.887 31.512 6.546
515 HB2 GLU 64 HB2 GLU 64 19.903 31.255 6.215
516 HB3 GLU 64 HB1 GLU 64 20.917 32.676 5.973
517 HG2 GLU 64 HG2 GLU 64 22.085 31.272 4.125
518 HG3 GLU 64 HG1 GLU 64 20.669 30.228 4.230
519 H SER 65 HN SER 65 22.712 29.390 8.570
520 HA SER 65 HA SER 65 20.783 30.238 10.531
521 HB2 SER 65 HB2 SER 65 22.909 28.192 10.332
522 HB3 SER 65 HB1 SER 65 22.594 28.777 11.961
523 HG SER 65 HG SER 65 20.256 28.450 10.811
524 H THR 66 HN THR 66 20.986 31.807 12.026
525 HA THR 66 HA THR 66 23.370 33.465 11.981
526 HB THR 66 HB THR 66 20.686 33.700 13.349
527 HG1 THR 66 HG1 THR 66 21.703 34.394 10.993
528 HG21 THR 66 HG21 THR 66 22.118 34.747 14.907
529 HG22 THR 66 HG22 THR 66 21.577 36.071 13.875
530 HG23 THR 66 HG23 THR 66 23.179 35.373 13.644
531 H LEU 67 HN LEU 67 25.051 32.947 13.151
532 HA LEU 67 HA LEU 67 24.757 31.463 15.669
533 HB2 LEU 67 HB2 LEU 67 27.155 32.253 13.989
534 HB3 LEU 67 HB1 LEU 67 27.286 31.422 15.535
535 HG LEU 67 HG LEU 67 27.385 29.846 13.624
536 HD11 LEU 67 HD11 LEU 67 26.114 28.213 14.653
537 HD12 LEU 67 HD12 LEU 67 24.736 29.278 14.902
538 HD13 LEU 67 HD13 LEU 67 26.150 29.410 15.944
539 HD21 LEU 67 HD21 LEU 67 25.667 29.610 12.046
540 HD22 LEU 67 HD22 LEU 67 25.727 31.356 12.262
541 HD23 LEU 67 HD23 LEU 67 24.474 30.408 13.067
542 H HIS 68 HN HIS 68 26.998 32.392 17.017
543 HA HIS 68 HA HIS 68 26.818 35.283 17.298
544 HB2 HIS 68 HB2 HIS 68 25.814 33.385 19.421
545 HB3 HIS 68 HB1 HIS 68 26.345 35.022 19.798
546 HD2 HIS 68 HD2 HIS 68 23.182 33.261 18.559
547 HE1 HIS 68 HE1 HIS 68 22.673 37.357 17.668
548 HE2 HIS 68 HE2 HIS 68 21.498 35.109 17.804
549 H ILE 69 HN ILE 69 28.861 35.869 17.403
550 HA ILE 69 HA ILE 69 30.829 34.126 18.772
551 HB ILE 69 HB ILE 69 31.194 36.338 16.734
552 HG12 ILE 69 HG12 ILE 69 31.865 33.395 16.506
553 HG13 ILE 69 HG11 ILE 69 30.308 34.049 15.997
554 HG21 ILE 69 HG21 ILE 69 33.596 35.478 16.786
555 HG22 ILE 69 HG22 ILE 69 33.168 34.645 18.281
556 HG23 ILE 69 HG23 ILE 69 33.087 36.405 18.198
557 HD11 ILE 69 HD11 ILE 69 32.921 35.202 15.009
558 HD12 ILE 69 HD12 ILE 69 31.307 35.424 14.334
559 HD13 ILE 69 HD13 ILE 69 32.119 33.865 14.186
560 H VAL 70 HN VAL 70 31.159 34.718 20.824
561 HA VAL 70 HA VAL 70 31.261 37.615 21.484
562 HB VAL 70 HB VAL 70 30.655 36.874 23.813
563 HG11 VAL 70 HG11 VAL 70 28.228 36.391 23.169
564 HG12 VAL 70 HG12 VAL 70 28.772 36.419 21.491
565 HG13 VAL 70 HG13 VAL 70 28.929 37.862 22.493
566 HG21 VAL 70 HG21 VAL 70 29.691 34.660 24.108
567 HG22 VAL 70 HG22 VAL 70 31.320 34.478 23.463
568 HG23 VAL 70 HG23 VAL 70 29.925 34.289 22.401
569 H TRP 71 HN TRP 71 33.005 38.356 22.593
570 HA TRP 71 HA TRP 71 34.998 36.427 23.580
571 HB2 TRP 71 HB2 TRP 71 35.676 36.934 21.283
572 HB3 TRP 71 HB1 TRP 71 35.598 38.662 21.627
573 HD1 TRP 71 HD1 TRP 71 37.214 35.735 23.590
574 HE1 TRP 71 HE1 TRP 71 39.653 36.380 24.115
575 HE3 TRP 71 HE3 TRP 71 37.445 40.268 21.254
576 HZ2 TRP 71 HZ2 TRP 71 41.465 38.533 23.605
577 HZ3 TRP 71 HZ3 TRP 71 39.540 41.594 21.286
578 HH2 TRP 71 HH2 TRP 71 41.549 40.733 22.458
579 H ARG 72 HN ARG 72 35.360 36.951 25.613
580 HA ARG 72 HA ARG 72 36.081 39.659 26.344
581 HB2 ARG 72 HB2 ARG 72 33.609 39.727 26.488
582 HB3 ARG 72 HB1 ARG 72 33.652 38.368 27.612
583 HG2 ARG 72 HG2 ARG 72 34.946 39.674 29.212
584 HG3 ARG 72 HG1 ARG 72 35.055 41.017 28.072
585 HD2 ARG 72 HD2 ARG 72 32.419 39.921 29.074
586 HD3 ARG 72 HD1 ARG 72 33.263 41.252 29.861
587 HE ARG 72 HE ARG 72 31.835 41.361 27.340
588 HH11 ARG 72 HH21 ARG 72 34.284 42.725 29.366
589 HH12 ARG 72 HH22 ARG 72 34.185 44.305 28.663
590 HH21 ARG 72 HH11 ARG 72 31.697 43.435 26.408
591 HH22 ARG 72 HH12 ARG 72 32.722 44.706 26.988
592 H LEU 73 HN LEU 73 37.843 39.359 27.533
593 HA LEU 73 HA LEU 73 38.400 36.861 28.847
594 HB2 LEU 73 HB2 LEU 73 39.908 39.457 29.182
595 HB3 LEU 73 HB1 LEU 73 40.517 37.815 29.386
596 HG LEU 73 HG LEU 73 39.590 39.061 26.781
597 HD11 LEU 73 HD11 LEU 73 41.805 39.831 27.644
598 HD12 LEU 73 HD12 LEU 73 41.939 38.918 26.142
599 HD13 LEU 73 HD13 LEU 73 42.340 38.152 27.679
600 HD21 LEU 73 HD21 LEU 73 40.653 36.867 25.889
601 HD22 LEU 73 HD22 LEU 73 39.049 36.760 26.610
602 HD23 LEU 73 HD23 LEU 73 40.467 36.268 27.537
603 H ARG 74 HN ARG 74 37.498 36.310 30.714
604 HA ARG 74 HA ARG 74 36.605 38.364 32.605
605 HB2 ARG 74 HB2 ARG 74 35.187 36.360 31.945
606 HB3 ARG 74 HB1 ARG 74 36.317 35.370 32.870
607 HG2 ARG 74 HG2 ARG 74 35.873 36.718 34.881
608 HG3 ARG 74 HG1 ARG 74 34.762 37.734 33.962
609 HD2 ARG 74 HD2 ARG 74 33.390 35.706 33.467
610 HD3 ARG 74 HD1 ARG 74 34.457 34.771 34.512
611 HE ARG 74 HE ARG 74 33.516 36.999 35.958
612 HH11 ARG 74 HH21 ARG 74 32.409 34.059 34.510
613 HH12 ARG 74 HH22 ARG 74 31.112 33.832 35.634
614 HH21 ARG 74 HH11 ARG 74 31.812 36.714 37.432
615 HH22 ARG 74 HH12 ARG 74 30.773 35.336 37.289
616 H GLY 75 HN GLY 75 37.314 38.493 34.735
617 HA2 GLY 75 HA2 GLY 75 38.677 38.088 36.582
618 HA3 GLY 75 HA1 GLY 75 39.416 36.745 35.713
619 H GLY 76 HN GLY 76 41.513 37.420 36.307
620 HA2 GLY 76 HA2 GLY 76 43.531 38.460 35.930
621 HA3 GLY 76 HA1 GLY 76 42.822 39.104 34.452
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 26.745 24.718 1.784
2 H2 MET 1 HT2 MET 1 25.422 25.277 0.876
3 H3 MET 1 HT3 MET 1 25.555 23.628 1.265
4 HA MET 1 HA MET 1 24.105 25.444 2.640
5 HB2 MET 1 HB2 MET 1 24.188 22.842 2.612
6 HB3 MET 1 HB1 MET 1 25.323 23.009 3.949
7 HG2 MET 1 HG2 MET 1 22.574 24.294 3.930
8 HG3 MET 1 HG1 MET 1 22.907 22.719 4.647
9 HE1 MET 1 HE1 MET 1 23.819 22.285 6.843
10 HE2 MET 1 HE2 MET 1 25.022 23.280 7.658
11 HE3 MET 1 HE3 MET 1 25.380 22.597 6.074
12 H GLN 2 HN GLN 2 25.685 27.259 2.836
13 HA GLN 2 HA GLN 2 27.685 27.009 4.959
14 HB2 GLN 2 HB2 GLN 2 28.094 29.454 4.371
15 HB3 GLN 2 HB1 GLN 2 28.428 28.283 3.096
16 HG2 GLN 2 HG2 GLN 2 26.283 28.739 2.047
17 HG3 GLN 2 HG1 GLN 2 25.823 29.810 3.370
18 HE21 GLN 2 HE21 GLN 2 29.160 29.895 2.338
19 HE22 GLN 2 HE22 GLN 2 29.069 31.370 1.503
20 H ILE 3 HN ILE 3 27.708 29.333 6.242
21 HA ILE 3 HA ILE 3 25.031 29.964 7.251
22 HB ILE 3 HB ILE 3 25.855 29.655 9.615
23 HG12 ILE 3 HG12 ILE 3 27.975 27.952 8.270
24 HG13 ILE 3 HG11 ILE 3 28.282 29.553 8.942
25 HG21 ILE 3 HG21 ILE 3 24.330 28.060 8.417
26 HG22 ILE 3 HG22 ILE 3 25.321 27.292 9.655
27 HG23 ILE 3 HG23 ILE 3 25.749 27.125 7.952
28 HD11 ILE 3 HD11 ILE 3 27.098 27.280 10.554
29 HD12 ILE 3 HD12 ILE 3 27.692 28.827 11.156
30 HD13 ILE 3 HD13 ILE 3 28.823 27.641 10.505
31 H PHE 4 HN PHE 4 24.883 31.988 8.149
32 HA PHE 4 HA PHE 4 27.240 33.724 7.796
33 HB2 PHE 4 HB2 PHE 4 24.435 34.644 8.385
34 HB3 PHE 4 HB1 PHE 4 25.742 35.531 7.609
35 HD1 PHE 4 HD1 PHE 4 26.544 32.992 5.793
36 HD2 PHE 4 HD2 PHE 4 22.879 35.113 6.570
37 HE1 PHE 4 HE1 PHE 4 25.686 32.312 3.591
38 HE2 PHE 4 HE2 PHE 4 22.027 34.419 4.351
39 HZ PHE 4 HZ PHE 4 23.425 33.018 2.862
40 H VAL 5 HN VAL 5 28.412 34.237 9.473
41 HA VAL 5 HA VAL 5 27.409 33.843 12.193
42 HB VAL 5 HB VAL 5 29.901 34.716 12.633
43 HG11 VAL 5 HG11 VAL 5 30.670 32.292 12.097
44 HG12 VAL 5 HG12 VAL 5 28.991 32.020 11.631
45 HG13 VAL 5 HG13 VAL 5 29.381 32.512 13.278
46 HG21 VAL 5 HG21 VAL 5 30.036 35.280 10.116
47 HG22 VAL 5 HG22 VAL 5 30.195 33.540 9.870
48 HG23 VAL 5 HG23 VAL 5 31.394 34.409 10.826
49 H LYS 6 HN LYS 6 26.846 35.418 13.566
50 HA LYS 6 HA LYS 6 27.303 38.247 12.779
51 HB2 LYS 6 HB2 LYS 6 24.802 36.931 13.845
52 HB3 LYS 6 HB1 LYS 6 25.065 38.672 13.930
53 HG2 LYS 6 HG2 LYS 6 25.344 38.764 11.489
54 HG3 LYS 6 HG1 LYS 6 25.114 37.018 11.385
55 HD2 LYS 6 HD2 LYS 6 22.847 37.203 12.218
56 HD3 LYS 6 HD1 LYS 6 23.062 38.918 12.557
57 HE2 LYS 6 HE2 LYS 6 21.907 38.911 10.504
58 HE3 LYS 6 HE1 LYS 6 23.585 39.133 10.014
59 HZ1 LYS 6 HZ1 LYS 6 23.768 36.901 9.394
60 HZ2 LYS 6 HZ2 LYS 6 22.252 37.381 8.797
61 HZ3 LYS 6 HZ3 LYS 6 22.354 36.452 10.216
62 H GLY 7 HN GLY 7 29.048 38.513 14.165
63 HA2 GLY 7 HA2 GLY 7 28.935 37.721 16.935
64 HA3 GLY 7 HA1 GLY 7 30.194 38.687 16.174
65 H LEU 8 HN LEU 8 29.949 39.826 18.323
66 HA LEU 8 HA LEU 8 27.793 41.257 19.213
67 HB2 LEU 8 HB2 LEU 8 30.630 42.301 19.080
68 HB3 LEU 8 HB1 LEU 8 29.369 42.852 20.180
69 HG LEU 8 HG LEU 8 30.402 40.001 20.075
70 HD11 LEU 8 HD11 LEU 8 31.020 42.133 22.136
71 HD12 LEU 8 HD12 LEU 8 32.106 41.726 20.807
72 HD13 LEU 8 HD13 LEU 8 31.714 40.517 22.030
73 HD21 LEU 8 HD21 LEU 8 29.310 40.082 22.445
74 HD22 LEU 8 HD22 LEU 8 28.248 39.940 21.050
75 HD23 LEU 8 HD23 LEU 8 28.458 41.502 21.840
76 H THR 9 HN THR 9 30.296 42.787 17.177
77 HA THR 9 HA THR 9 28.171 44.209 15.692
78 HB THR 9 HB THR 9 29.315 46.331 15.952
79 HG1 THR 9 HG1 THR 9 31.093 44.968 17.682
80 HG21 THR 9 HG21 THR 9 27.683 45.638 17.694
81 HG22 THR 9 HG22 THR 9 28.937 46.696 18.342
82 HG23 THR 9 HG23 THR 9 29.009 44.960 18.637
83 H GLY 10 HN GLY 10 30.693 42.191 15.505
84 HA2 GLY 10 HA2 GLY 10 32.356 43.299 13.492
85 HA3 GLY 10 HA1 GLY 10 32.182 41.584 13.853
86 H LYS 11 HN LYS 11 32.438 42.717 11.227
87 HA LYS 11 HA LYS 11 29.918 42.940 9.933
88 HB2 LYS 11 HB2 LYS 11 32.624 42.183 8.802
89 HB3 LYS 11 HB1 LYS 11 31.205 42.602 7.843
90 HG2 LYS 11 HG2 LYS 11 31.170 44.796 9.230
91 HG3 LYS 11 HG1 LYS 11 32.819 44.371 9.681
92 HD2 LYS 11 HD2 LYS 11 31.837 44.610 6.821
93 HD3 LYS 11 HD1 LYS 11 32.716 45.871 7.681
94 HE2 LYS 11 HE2 LYS 11 34.543 44.135 8.091
95 HE3 LYS 11 HE1 LYS 11 33.706 43.118 6.919
96 HZ1 LYS 11 HZ1 LYS 11 35.206 45.580 6.507
97 HZ2 LYS 11 HZ2 LYS 11 33.809 45.379 5.562
98 HZ3 LYS 11 HZ3 LYS 11 35.051 44.222 5.502
99 H THR 12 HN THR 12 28.698 41.446 8.824
100 HA THR 12 HA THR 12 28.672 38.792 9.799
101 HB THR 12 HB THR 12 27.390 39.723 7.226
102 HG1 THR 12 HG1 THR 12 25.758 39.864 9.308
103 HG21 THR 12 HG21 THR 12 25.857 37.977 7.580
104 HG22 THR 12 HG22 THR 12 26.258 37.846 9.291
105 HG23 THR 12 HG23 THR 12 27.387 37.253 8.074
106 H THR 13 HN THR 13 29.470 36.909 8.996
107 HA THR 13 HA THR 13 30.942 36.959 6.430
108 HB THR 13 HB THR 13 31.968 36.157 9.150
109 HG1 THR 13 HG1 THR 13 33.693 37.436 8.437
110 HG21 THR 13 HG21 THR 13 32.793 35.111 6.447
111 HG22 THR 13 HG22 THR 13 32.561 34.222 7.954
112 HG23 THR 13 HG23 THR 13 33.971 35.264 7.752
113 H THR 14 HN THR 14 31.033 34.965 5.354
114 HA THR 14 HA THR 14 29.035 32.989 6.273
115 HB THR 14 HB THR 14 28.811 32.332 3.983
116 HG1 THR 14 HG1 THR 14 31.207 32.723 3.700
117 HG21 THR 14 HG21 THR 14 27.907 34.297 3.055
118 HG22 THR 14 HG22 THR 14 29.141 35.321 3.788
119 HG23 THR 14 HG23 THR 14 27.871 34.621 4.788
120 H LEU 15 HN LEU 15 29.523 30.793 6.360
121 HA LEU 15 HA LEU 15 32.372 30.037 6.035
122 HB2 LEU 15 HB2 LEU 15 30.511 29.340 8.315
123 HB3 LEU 15 HB1 LEU 15 32.085 28.596 8.061
124 HG LEU 15 HG LEU 15 31.880 31.604 8.188
125 HD11 LEU 15 HD11 LEU 15 32.330 31.424 10.656
126 HD12 LEU 15 HD12 LEU 15 31.934 29.708 10.553
127 HD13 LEU 15 HD13 LEU 15 30.705 30.920 10.192
128 HD21 LEU 15 HD21 LEU 15 34.163 31.322 9.144
129 HD22 LEU 15 HD22 LEU 15 34.026 30.591 7.547
130 HD23 LEU 15 HD23 LEU 15 33.995 29.575 8.989
131 H GLU 16 HN GLU 16 32.748 28.123 5.085
132 HA GLU 16 HA GLU 16 30.509 26.726 3.868
133 HB2 GLU 16 HB2 GLU 16 32.643 27.136 2.640
134 HB3 GLU 16 HB1 GLU 16 33.468 26.077 3.780
135 HG2 GLU 16 HG2 GLU 16 31.924 24.226 3.128
136 HG3 GLU 16 HG1 GLU 16 31.198 25.292 1.928
137 H VAL 17 HN VAL 17 29.455 25.128 4.868
138 HA VAL 17 HA VAL 17 30.946 23.254 6.585
139 HB VAL 17 HB VAL 17 29.367 23.408 8.386
140 HG11 VAL 17 HG11 VAL 17 29.729 25.710 9.135
141 HG12 VAL 17 HG12 VAL 17 30.075 26.217 7.482
142 HG13 VAL 17 HG13 VAL 17 31.176 25.120 8.317
143 HG21 VAL 17 HG21 VAL 17 27.520 25.137 8.272
144 HG22 VAL 17 HG22 VAL 17 27.297 23.767 7.187
145 HG23 VAL 17 HG23 VAL 17 27.876 25.308 6.555
146 H GLU 18 HN GLU 18 29.571 21.335 7.148
147 HA GLU 18 HA GLU 18 27.502 20.752 5.128
148 HB2 GLU 18 HB2 GLU 18 29.858 18.960 5.779
149 HB3 GLU 18 HB1 GLU 18 28.503 18.526 4.737
150 HG2 GLU 18 HG2 GLU 18 29.144 20.714 3.431
151 HG3 GLU 18 HG1 GLU 18 30.692 20.539 4.255
152 HA PRO 19 HA PRO 19 25.070 19.155 8.479
153 HB2 PRO 19 HB2 PRO 19 24.984 16.581 6.923
154 HB3 PRO 19 HB1 PRO 19 23.656 17.478 7.687
155 HG2 PRO 19 HG2 PRO 19 24.098 17.577 5.042
156 HG3 PRO 19 HG1 PRO 19 23.484 18.971 5.948
157 HD2 PRO 19 HD2 PRO 19 26.167 18.572 4.739
158 HD3 PRO 19 HD1 PRO 19 25.341 20.080 5.186
159 H SER 20 HN SER 20 27.671 17.150 7.170
160 HA SER 20 HA SER 20 27.929 15.561 9.582
161 HB2 SER 20 HB2 SER 20 29.969 14.675 8.370
162 HB3 SER 20 HB1 SER 20 28.433 14.440 7.543
163 HG SER 20 HG SER 20 29.899 16.782 7.072
164 H ASP 21 HN ASP 21 29.398 18.446 8.244
165 HA ASP 21 HA ASP 21 31.824 18.491 9.609
166 HB2 ASP 21 HB2 ASP 21 29.964 20.727 8.801
167 HB3 ASP 21 HB1 ASP 21 31.531 21.024 9.547
168 H THR 22 HN THR 22 32.325 18.476 11.681
169 HA THR 22 HA THR 22 30.280 18.816 13.702
170 HB THR 22 HB THR 22 32.051 18.193 15.271
171 HG1 THR 22 HG1 THR 22 33.848 19.129 14.490
172 HG21 THR 22 HG21 THR 22 32.666 15.991 14.223
173 HG22 THR 22 HG22 THR 22 31.971 16.578 12.712
174 HG23 THR 22 HG23 THR 22 30.946 16.370 14.132
175 H ILE 23 HN ILE 23 30.675 20.216 15.598
176 HA ILE 23 HA ILE 23 30.984 22.915 14.824
177 HB ILE 23 HB ILE 23 31.179 21.844 17.642
178 HG12 ILE 23 HG12 ILE 23 29.251 20.795 16.639
179 HG13 ILE 23 HG11 ILE 23 28.674 22.118 17.645
180 HG21 ILE 23 HG21 ILE 23 29.878 24.391 16.672
181 HG22 ILE 23 HG22 ILE 23 31.598 24.321 17.049
182 HG23 ILE 23 HG23 ILE 23 30.407 23.981 18.303
183 HD11 ILE 23 HD11 ILE 23 28.774 23.533 15.466
184 HD12 ILE 23 HD12 ILE 23 27.455 22.378 15.644
185 HD13 ILE 23 HD13 ILE 23 28.847 21.976 14.638
186 H GLU 24 HN GLU 24 33.169 20.671 16.514
187 HA GLU 24 HA GLU 24 35.189 22.382 17.272
188 HB2 GLU 24 HB2 GLU 24 35.073 19.847 17.584
189 HB3 GLU 24 HB1 GLU 24 35.753 19.720 15.961
190 HG2 GLU 24 HG2 GLU 24 37.706 21.027 16.638
191 HG3 GLU 24 HG1 GLU 24 37.016 21.273 18.242
192 H ASN 25 HN ASN 25 34.604 20.986 14.060
193 HA ASN 25 HA ASN 25 36.904 22.082 12.811
194 HB2 ASN 25 HB2 ASN 25 35.639 20.242 11.809
195 HB3 ASN 25 HB1 ASN 25 34.223 21.284 11.643
196 HD21 ASN 25 HD21 ASN 25 36.025 19.925 9.546
197 HD22 ASN 25 HD22 ASN 25 36.464 21.192 8.505
198 H VAL 26 HN VAL 26 33.534 23.185 13.055
199 HA VAL 26 HA VAL 26 33.702 25.476 11.490
200 HB VAL 26 HB VAL 26 32.113 25.121 14.045
201 HG11 VAL 26 HG11 VAL 26 30.568 26.729 12.764
202 HG12 VAL 26 HG12 VAL 26 31.953 27.047 11.721
203 HG13 VAL 26 HG13 VAL 26 32.043 27.419 13.442
204 HG21 VAL 26 HG21 VAL 26 31.151 24.661 11.214
205 HG22 VAL 26 HG22 VAL 26 30.398 24.146 12.724
206 HG23 VAL 26 HG23 VAL 26 31.872 23.361 12.161
207 H LYS 27 HN LYS 27 34.440 25.052 14.942
208 HA LYS 27 HA LYS 27 35.118 27.759 15.453
209 HB2 LYS 27 HB2 LYS 27 35.976 25.201 16.830
210 HB3 LYS 27 HB1 LYS 27 36.303 26.821 17.447
211 HG2 LYS 27 HG2 LYS 27 33.832 27.272 17.396
212 HG3 LYS 27 HG1 LYS 27 33.581 25.582 16.959
213 HD2 LYS 27 HD2 LYS 27 34.711 24.870 19.031
214 HD3 LYS 27 HD1 LYS 27 34.970 26.559 19.473
215 HE2 LYS 27 HE2 LYS 27 32.495 26.903 19.422
216 HE3 LYS 27 HE1 LYS 27 32.295 25.177 19.122
217 HZ1 LYS 27 HZ1 LYS 27 32.085 25.695 21.471
218 HZ2 LYS 27 HZ2 LYS 27 33.640 26.377 21.482
219 HZ3 LYS 27 HZ3 LYS 27 33.440 24.715 21.194
220 H ALA 28 HN ALA 28 36.961 24.997 14.245
221 HA ALA 28 HA ALA 28 39.532 26.193 14.464
222 HB1 ALA 28 HB1 ALA 28 40.198 24.471 12.774
223 HB2 ALA 28 HB2 ALA 28 38.502 24.015 12.629
224 HB3 ALA 28 HB3 ALA 28 39.344 23.796 14.162
225 H LYS 29 HN LYS 29 37.089 26.101 11.901
226 HA LYS 29 HA LYS 29 38.611 27.430 9.913
227 HB2 LYS 29 HB2 LYS 29 35.631 27.205 10.381
228 HB3 LYS 29 HB1 LYS 29 36.320 27.997 8.969
229 HG2 LYS 29 HG2 LYS 29 37.158 25.190 9.700
230 HG3 LYS 29 HG1 LYS 29 35.666 25.467 8.808
231 HD2 LYS 29 HD2 LYS 29 37.039 26.807 7.135
232 HD3 LYS 29 HD1 LYS 29 38.477 26.208 7.961
233 HE2 LYS 29 HE2 LYS 29 37.654 23.873 7.579
234 HE3 LYS 29 HE1 LYS 29 36.336 24.542 6.617
235 HZ1 LYS 29 HZ1 LYS 29 37.955 24.065 5.055
236 HZ2 LYS 29 HZ2 LYS 29 39.232 24.564 6.059
237 HZ3 LYS 29 HZ3 LYS 29 38.207 25.716 5.346
238 H ILE 30 HN ILE 30 36.389 28.550 12.411
239 HA ILE 30 HA ILE 30 36.386 31.289 11.734
240 HB ILE 30 HB ILE 30 35.904 29.845 14.348
241 HG12 ILE 30 HG12 ILE 30 33.952 31.241 12.506
242 HG13 ILE 30 HG11 ILE 30 34.358 29.533 12.333
243 HG21 ILE 30 HG21 ILE 30 35.643 32.770 13.632
244 HG22 ILE 30 HG22 ILE 30 36.523 32.061 14.985
245 HG23 ILE 30 HG23 ILE 30 34.760 32.040 14.974
246 HD11 ILE 30 HD11 ILE 30 33.439 30.666 14.979
247 HD12 ILE 30 HD12 ILE 30 33.448 28.986 14.450
248 HD13 ILE 30 HD13 ILE 30 32.286 30.117 13.764
249 H GLN 31 HN GLN 31 38.444 29.384 13.897
250 HA GLN 31 HA GLN 31 39.906 31.407 15.115
251 HB2 GLN 31 HB2 GLN 31 40.061 28.976 15.658
252 HB3 GLN 31 HB1 GLN 31 40.990 28.738 14.176
253 HG2 GLN 31 HG2 GLN 31 42.795 30.071 14.970
254 HG3 GLN 31 HG1 GLN 31 41.825 30.741 16.281
255 HE21 GLN 31 HE21 GLN 31 43.875 29.835 17.496
256 HE22 GLN 31 HE22 GLN 31 43.758 28.234 18.045
257 H ASP 32 HN ASP 32 39.670 30.818 11.835
258 HA ASP 32 HA ASP 32 42.379 31.708 11.154
259 HB2 ASP 32 HB2 ASP 32 40.069 31.128 9.297
260 HB3 ASP 32 HB1 ASP 32 41.780 31.233 8.883
261 H LYS 33 HN LYS 33 39.035 32.861 11.031
262 HA LYS 33 HA LYS 33 39.862 35.386 9.802
263 HB2 LYS 33 HB2 LYS 33 37.135 34.383 10.646
264 HB3 LYS 33 HB1 LYS 33 37.452 35.876 9.759
265 HG2 LYS 33 HG2 LYS 33 38.560 34.525 7.970
266 HG3 LYS 33 HG1 LYS 33 38.090 33.061 8.833
267 HD2 LYS 33 HD2 LYS 33 35.681 33.966 8.709
268 HD3 LYS 33 HD1 LYS 33 36.301 35.108 7.515
269 HE2 LYS 33 HE2 LYS 33 36.303 32.085 7.351
270 HE3 LYS 33 HE1 LYS 33 35.485 33.221 6.279
271 HZ1 LYS 33 HZ1 LYS 33 38.016 34.057 6.107
272 HZ2 LYS 33 HZ2 LYS 33 37.312 32.944 5.033
273 HZ3 LYS 33 HZ3 LYS 33 38.259 32.393 6.331
274 H THR 34 HN THR 34 39.309 34.095 12.940
275 HA THR 34 HA THR 34 39.014 36.804 14.109
276 HB THR 34 HB THR 34 38.412 35.601 16.189
277 HG1 THR 34 HG1 THR 34 38.967 33.414 14.520
278 HG21 THR 34 HG21 THR 34 36.232 34.700 15.363
279 HG22 THR 34 HG22 THR 34 36.838 34.845 13.714
280 HG23 THR 34 HG23 THR 34 36.619 36.290 14.702
281 H GLY 35 HN GLY 35 41.013 33.910 14.062
282 HA2 GLY 35 HA2 GLY 35 43.146 33.495 14.810
283 HA3 GLY 35 HA1 GLY 35 43.411 35.225 14.626
284 H LEU 36 HN LEU 36 41.960 32.850 16.859
285 HA LEU 36 HA LEU 36 43.275 34.135 19.101
286 HB2 LEU 36 HB2 LEU 36 40.841 34.093 20.267
287 HB3 LEU 36 HB1 LEU 36 41.451 35.512 19.420
288 HG LEU 36 HG LEU 36 40.274 34.830 17.381
289 HD11 LEU 36 HD11 LEU 36 39.612 32.406 19.058
290 HD12 LEU 36 HD12 LEU 36 40.247 32.468 17.415
291 HD13 LEU 36 HD13 LEU 36 38.568 32.894 17.722
292 HD21 LEU 36 HD21 LEU 36 38.672 34.928 19.949
293 HD22 LEU 36 HD22 LEU 36 37.901 34.928 18.364
294 HD23 LEU 36 HD23 LEU 36 38.988 36.241 18.813
295 HA PRO 37 HA PRO 37 43.436 30.006 20.615
296 HB2 PRO 37 HB2 PRO 37 42.949 30.383 23.344
297 HB3 PRO 37 HB1 PRO 37 44.513 30.649 22.549
298 HG2 PRO 37 HG2 PRO 37 42.402 32.634 23.276
299 HG3 PRO 37 HG1 PRO 37 44.165 32.767 23.406
300 HD2 PRO 37 HD2 PRO 37 42.831 33.966 21.403
301 HD3 PRO 37 HD1 PRO 37 44.429 33.242 21.129
302 HA PRO 38 HA PRO 38 39.366 28.326 20.804
303 HB2 PRO 38 HB2 PRO 38 39.661 26.151 22.479
304 HB3 PRO 38 HB1 PRO 38 40.259 26.196 20.807
305 HG2 PRO 38 HG2 PRO 38 41.747 26.663 23.356
306 HG3 PRO 38 HG1 PRO 38 42.238 25.749 21.918
307 HD2 PRO 38 HD2 PRO 38 43.143 28.264 22.383
308 HD3 PRO 38 HD1 PRO 38 42.840 27.669 20.736
309 H ASP 39 HN ASP 39 40.907 29.052 23.879
310 HA ASP 39 HA ASP 39 38.555 28.807 25.485
311 HB2 ASP 39 HB2 ASP 39 39.882 30.131 27.150
312 HB3 ASP 39 HB1 ASP 39 40.707 28.691 26.558
313 H GLN 40 HN GLN 40 39.024 30.771 22.980
314 HA GLN 40 HA GLN 40 37.509 33.030 24.180
315 HB2 GLN 40 HB2 GLN 40 39.672 33.027 22.071
316 HB3 GLN 40 HB1 GLN 40 38.536 34.366 22.238
317 HG2 GLN 40 HG2 GLN 40 39.203 34.593 24.627
318 HG3 GLN 40 HG1 GLN 40 40.402 33.326 24.388
319 HE21 GLN 40 HE21 GLN 40 41.717 35.455 25.128
320 HE22 GLN 40 HE22 GLN 40 42.338 36.373 23.844
321 H GLN 41 HN GLN 41 37.146 30.374 22.331
322 HA GLN 41 HA GLN 41 35.369 31.648 20.331
323 HB2 GLN 41 HB2 GLN 41 36.592 28.885 20.473
324 HB3 GLN 41 HB1 GLN 41 35.415 29.382 19.257
325 HG2 GLN 41 HG2 GLN 41 36.916 31.184 18.518
326 HG3 GLN 41 HG1 GLN 41 38.091 30.721 19.749
327 HE21 GLN 41 HE21 GLN 41 37.491 30.374 16.503
328 HE22 GLN 41 HE22 GLN 41 38.265 28.887 16.233
329 H ARG 42 HN ARG 42 33.225 31.379 20.395
330 HA ARG 42 HA ARG 42 32.005 29.198 21.904
331 HB2 ARG 42 HB2 ARG 42 32.390 31.032 23.570
332 HB3 ARG 42 HB1 ARG 42 31.375 32.080 22.581
333 HG2 ARG 42 HG2 ARG 42 29.473 30.592 22.866
334 HG3 ARG 42 HG1 ARG 42 30.474 29.424 23.730
335 HD2 ARG 42 HD2 ARG 42 30.950 31.225 25.432
336 HD3 ARG 42 HD1 ARG 42 29.743 32.221 24.626
337 HE ARG 42 HE ARG 42 28.646 29.677 25.270
338 HH11 ARG 42 HH21 ARG 42 29.680 32.682 26.641
339 HH12 ARG 42 HH22 ARG 42 28.597 32.596 27.991
340 HH21 ARG 42 HH11 ARG 42 27.226 29.559 27.039
341 HH22 ARG 42 HH12 ARG 42 27.209 30.829 28.217
342 H LEU 43 HN LEU 43 30.207 28.521 20.875
343 HA LEU 43 HA LEU 43 28.934 30.344 18.898
344 HB2 LEU 43 HB2 LEU 43 29.327 27.347 18.720
345 HB3 LEU 43 HB1 LEU 43 28.465 28.339 17.542
346 HG LEU 43 HG LEU 43 31.366 28.775 18.315
347 HD11 LEU 43 HD11 LEU 43 31.863 27.730 16.096
348 HD12 LEU 43 HD12 LEU 43 30.162 27.284 15.966
349 HD13 LEU 43 HD13 LEU 43 31.156 26.601 17.251
350 HD21 LEU 43 HD21 LEU 43 31.220 29.945 15.959
351 HD22 LEU 43 HD22 LEU 43 30.613 30.793 17.376
352 HD23 LEU 43 HD23 LEU 43 29.488 29.987 16.284
353 H ILE 44 HN ILE 44 26.819 30.621 19.029
354 HA ILE 44 HA ILE 44 25.155 28.713 20.552
355 HB ILE 44 HB ILE 44 25.266 31.712 20.962
356 HG12 ILE 44 HG12 ILE 44 25.362 29.528 23.052
357 HG13 ILE 44 HG11 ILE 44 26.824 30.075 22.234
358 HG21 ILE 44 HG21 ILE 44 22.943 31.210 20.899
359 HG22 ILE 44 HG22 ILE 44 23.359 31.187 22.613
360 HG23 ILE 44 HG23 ILE 44 23.172 29.671 21.730
361 HD11 ILE 44 HD11 ILE 44 24.907 31.835 23.791
362 HD12 ILE 44 HD12 ILE 44 26.354 32.395 22.951
363 HD13 ILE 44 HD13 ILE 44 26.501 31.312 24.336
364 H PHE 45 HN PHE 45 23.474 28.128 19.356
365 HA PHE 45 HA PHE 45 22.491 29.964 17.231
366 HB2 PHE 45 HB2 PHE 45 23.554 27.882 16.367
367 HB3 PHE 45 HB1 PHE 45 22.379 26.933 17.277
368 HD1 PHE 45 HD1 PHE 45 22.453 29.844 14.909
369 HD2 PHE 45 HD2 PHE 45 20.434 26.270 16.152
370 HE1 PHE 45 HE1 PHE 45 20.807 30.142 13.081
371 HE2 PHE 45 HE2 PHE 45 18.788 26.560 14.317
372 HZ PHE 45 HZ PHE 45 18.977 28.499 12.782
373 H ALA 46 HN ALA 46 20.424 30.588 17.396
374 HA ALA 46 HA ALA 46 18.313 30.845 18.278
375 HB1 ALA 46 HB1 ALA 46 16.984 28.794 18.439
376 HB2 ALA 46 HB2 ALA 46 18.454 27.822 18.387
377 HB3 ALA 46 HB3 ALA 46 17.973 28.771 16.980
378 H GLY 47 HN GLY 47 20.545 30.931 20.133
379 HA2 GLY 47 HA2 GLY 47 20.633 31.359 22.423
380 HA3 GLY 47 HA1 GLY 47 19.047 30.615 22.601
381 H LYS 48 HN LYS 48 20.018 28.216 21.060
382 HA LYS 48 HA LYS 48 20.869 26.684 23.321
383 HB2 LYS 48 HB2 LYS 48 19.446 25.855 21.387
384 HB3 LYS 48 HB1 LYS 48 20.929 25.801 20.434
385 HG2 LYS 48 HG2 LYS 48 21.940 24.241 22.004
386 HG3 LYS 48 HG1 LYS 48 20.549 24.371 23.080
387 HD2 LYS 48 HD2 LYS 48 19.094 23.374 21.406
388 HD3 LYS 48 HD1 LYS 48 20.403 23.362 20.224
389 HE2 LYS 48 HE2 LYS 48 20.355 21.150 21.072
390 HE3 LYS 48 HE1 LYS 48 21.690 21.917 21.931
391 HZ1 LYS 48 HZ1 LYS 48 19.395 22.446 23.388
392 HZ2 LYS 48 HZ2 LYS 48 20.667 21.404 23.811
393 HZ3 LYS 48 HZ3 LYS 48 19.314 20.804 22.976
394 H GLN 49 HN GLN 49 22.841 26.066 23.946
395 HA GLN 49 HA GLN 49 25.146 27.241 22.611
396 HB2 GLN 49 HB2 GLN 49 24.965 27.379 25.048
397 HB3 GLN 49 HB1 GLN 49 24.932 25.619 25.155
398 HG2 GLN 49 HG2 GLN 49 27.165 25.437 24.307
399 HG3 GLN 49 HG1 GLN 49 27.199 27.140 23.856
400 HE21 GLN 49 HE21 GLN 49 28.616 28.168 25.273
401 HE22 GLN 49 HE22 GLN 49 28.632 27.947 26.956
402 H LEU 50 HN LEU 50 26.615 26.202 21.426
403 HA LEU 50 HA LEU 50 26.159 23.394 20.757
404 HB2 LEU 50 HB2 LEU 50 28.280 25.243 19.653
405 HB3 LEU 50 HB1 LEU 50 27.646 23.769 18.927
406 HG LEU 50 HG LEU 50 26.167 26.381 19.341
407 HD11 LEU 50 HD11 LEU 50 26.111 26.497 16.956
408 HD12 LEU 50 HD12 LEU 50 26.661 24.829 16.791
409 HD13 LEU 50 HD13 LEU 50 27.772 26.070 17.372
410 HD21 LEU 50 HD21 LEU 50 24.519 24.736 19.772
411 HD22 LEU 50 HD22 LEU 50 25.200 23.619 18.591
412 HD23 LEU 50 HD23 LEU 50 24.338 25.057 18.048
413 H GLU 51 HN GLU 51 27.756 21.779 20.916
414 HA GLU 51 HA GLU 51 30.150 22.362 22.529
415 HB2 GLU 51 HB2 GLU 51 28.023 20.332 23.240
416 HB3 GLU 51 HB1 GLU 51 29.646 20.328 23.929
417 HG2 GLU 51 HG2 GLU 51 29.299 22.619 24.772
418 HG3 GLU 51 HG1 GLU 51 27.675 22.627 24.086
419 H ASP 52 HN ASP 52 31.871 21.041 22.095
420 HA ASP 52 HA ASP 52 31.988 19.738 19.605
421 HB2 ASP 52 HB2 ASP 52 33.966 20.638 20.762
422 HB3 ASP 52 HB1 ASP 52 33.800 19.402 22.007
423 H GLY 53 HN GLY 53 30.774 18.013 19.137
424 HA2 GLY 53 HA2 GLY 53 31.140 15.460 19.653
425 HA3 GLY 53 HA1 GLY 53 30.318 15.912 21.145
426 H ARG 54 HN ARG 54 29.151 17.932 18.839
427 HA ARG 54 HA ARG 54 26.980 16.105 17.975
428 HB2 ARG 54 HB2 ARG 54 26.747 18.841 19.231
429 HB3 ARG 54 HB1 ARG 54 25.440 18.107 18.304
430 HG2 ARG 54 HG2 ARG 54 25.530 16.128 19.830
431 HG3 ARG 54 HG1 ARG 54 26.744 16.969 20.794
432 HD2 ARG 54 HD2 ARG 54 24.453 17.249 21.722
433 HD3 ARG 54 HD1 ARG 54 25.174 18.786 21.247
434 HE ARG 54 HE ARG 54 23.691 17.716 19.081
435 HH11 ARG 54 HH21 ARG 54 23.332 19.147 22.210
436 HH12 ARG 54 HH22 ARG 54 21.792 19.858 21.859
437 HH21 ARG 54 HH11 ARG 54 21.677 18.644 18.611
438 HH22 ARG 54 HH12 ARG 54 20.854 19.574 19.818
439 H THR 55 HN THR 55 26.073 16.557 15.970
440 HA THR 55 HA THR 55 27.728 18.235 14.211
441 HB THR 55 HB THR 55 26.446 17.080 12.396
442 HG1 THR 55 HG1 THR 55 24.866 15.777 12.898
443 HG21 THR 55 HG21 THR 55 28.623 16.225 13.445
444 HG22 THR 55 HG22 THR 55 27.651 15.035 12.582
445 HG23 THR 55 HG23 THR 55 27.617 15.089 14.344
446 H LEU 56 HN LEU 56 26.332 19.182 12.312
447 HA LEU 56 HA LEU 56 24.750 21.274 13.415
448 HB2 LEU 56 HB2 LEU 56 24.914 20.369 10.531
449 HB3 LEU 56 HB1 LEU 56 24.394 21.951 11.106
450 HG LEU 56 HG LEU 56 27.152 20.801 11.642
451 HD11 LEU 56 HD11 LEU 56 26.426 22.896 9.580
452 HD12 LEU 56 HD12 LEU 56 26.633 21.191 9.184
453 HD13 LEU 56 HD13 LEU 56 27.990 22.117 9.821
454 HD21 LEU 56 HD21 LEU 56 27.581 23.344 11.964
455 HD22 LEU 56 HD22 LEU 56 26.710 22.497 13.237
456 HD23 LEU 56 HD23 LEU 56 25.827 23.487 12.076
457 H SER 57 HN SER 57 23.998 18.250 11.765
458 HA SER 57 HA SER 57 21.219 18.664 11.455
459 HB2 SER 57 HB2 SER 57 21.089 16.273 11.070
460 HB3 SER 57 HB1 SER 57 22.532 16.904 10.282
461 HG SER 57 HG SER 57 22.518 15.819 12.903
462 H ASP 58 HN ASP 58 23.131 17.975 14.231
463 HA ASP 58 HA ASP 58 20.965 16.782 15.764
464 HB2 ASP 58 HB2 ASP 58 23.811 17.568 16.350
465 HB3 ASP 58 HB1 ASP 58 22.706 17.228 17.675
466 H TYR 59 HN TYR 59 22.644 19.896 15.559
467 HA TYR 59 HA TYR 59 21.019 21.102 17.630
468 HB2 TYR 59 HB2 TYR 59 22.996 22.249 15.649
469 HB3 TYR 59 HB1 TYR 59 22.161 23.208 16.870
470 HD1 TYR 59 HD1 TYR 59 22.261 22.173 19.332
471 HD2 TYR 59 HD2 TYR 59 25.096 21.375 16.204
472 HE1 TYR 59 HE1 TYR 59 23.958 21.549 21.028
473 HE2 TYR 59 HE2 TYR 59 26.790 20.749 17.899
474 HH TYR 59 HH TYR 59 27.190 20.401 20.065
475 H ASN 60 HN ASN 60 20.393 20.186 14.551
476 HA ASN 60 HA ASN 60 18.689 20.640 13.078
477 HB2 ASN 60 HB2 ASN 60 17.624 22.695 15.009
478 HB3 ASN 60 HB1 ASN 60 16.738 21.704 13.854
479 HD21 ASN 60 HD21 ASN 60 17.838 21.866 17.116
480 HD22 ASN 60 HD22 ASN 60 17.413 20.284 17.564
481 H ILE 61 HN ILE 61 21.222 22.236 13.281
482 HA ILE 61 HA ILE 61 20.555 24.909 12.436
483 HB ILE 61 HB ILE 61 23.139 23.339 12.495
484 HG12 ILE 61 HG12 ILE 61 22.243 25.772 14.063
485 HG13 ILE 61 HG11 ILE 61 22.026 24.120 14.639
486 HG21 ILE 61 HG21 ILE 61 22.553 26.138 11.518
487 HG22 ILE 61 HG22 ILE 61 23.454 24.864 10.697
488 HG23 ILE 61 HG23 ILE 61 24.150 25.674 12.102
489 HD11 ILE 61 HD11 ILE 61 24.493 23.770 14.409
490 HD12 ILE 61 HD12 ILE 61 24.082 25.021 15.582
491 HD13 ILE 61 HD13 ILE 61 24.656 25.473 13.976
492 H GLN 62 HN GLN 62 20.272 25.669 10.422
493 HA GLN 62 HA GLN 62 20.678 23.806 8.141
494 HB2 GLN 62 HB2 GLN 62 18.617 26.012 8.365
495 HB3 GLN 62 HB1 GLN 62 18.773 24.831 7.065
496 HG2 GLN 62 HG2 GLN 62 18.338 23.008 8.684
497 HG3 GLN 62 HG1 GLN 62 18.119 24.210 9.956
498 HE21 GLN 62 HE21 GLN 62 15.855 23.010 9.901
499 HE22 GLN 62 HE22 GLN 62 14.688 23.696 8.877
500 H LYS 63 HN LYS 63 19.944 25.907 6.269
501 HA LYS 63 HA LYS 63 22.554 27.085 5.930
502 HB2 LYS 63 HB2 LYS 63 20.910 26.156 4.127
503 HB3 LYS 63 HB1 LYS 63 20.147 27.740 4.242
504 HG2 LYS 63 HG2 LYS 63 22.258 28.835 3.672
505 HG3 LYS 63 HG1 LYS 63 23.091 27.282 3.666
506 HD2 LYS 63 HD2 LYS 63 21.862 26.518 1.764
507 HD3 LYS 63 HD1 LYS 63 20.721 27.857 1.882
508 HE2 LYS 63 HE2 LYS 63 22.338 28.271 0.079
509 HE3 LYS 63 HE1 LYS 63 22.547 29.449 1.375
510 HZ1 LYS 63 HZ1 LYS 63 24.583 28.172 0.386
511 HZ2 LYS 63 HZ2 LYS 63 24.095 26.962 1.475
512 HZ3 LYS 63 HZ3 LYS 63 24.497 28.510 2.046
513 H GLU 64 HN GLU 64 22.917 29.360 5.591
514 HA GLU 64 HA GLU 64 22.931 31.499 6.438
515 HB2 GLU 64 HB2 GLU 64 19.933 31.505 6.169
516 HB3 GLU 64 HB1 GLU 64 21.087 32.789 5.816
517 HG2 GLU 64 HG2 GLU 64 21.987 31.254 3.966
518 HG3 GLU 64 HG1 GLU 64 20.534 30.289 4.219
519 H SER 65 HN SER 65 22.515 29.266 8.395
520 HA SER 65 HA SER 65 20.665 30.184 10.374
521 HB2 SER 65 HB2 SER 65 22.833 28.139 10.234
522 HB3 SER 65 HB1 SER 65 22.327 28.663 11.833
523 HG SER 65 HG SER 65 20.804 27.473 9.770
524 H THR 66 HN THR 66 20.908 31.801 11.857
525 HA THR 66 HA THR 66 23.337 33.359 11.796
526 HB THR 66 HB THR 66 20.668 33.644 13.175
527 HG1 THR 66 HG1 THR 66 20.443 34.434 11.228
528 HG21 THR 66 HG21 THR 66 23.196 35.251 13.549
529 HG22 THR 66 HG22 THR 66 22.129 34.589 14.785
530 HG23 THR 66 HG23 THR 66 21.605 35.963 13.811
531 H LEU 67 HN LEU 67 25.037 32.789 12.922
532 HA LEU 67 HA LEU 67 24.761 31.358 15.472
533 HB2 LEU 67 HB2 LEU 67 27.135 32.057 13.719
534 HB3 LEU 67 HB1 LEU 67 27.293 31.273 15.287
535 HG LEU 67 HG LEU 67 27.309 29.634 13.427
536 HD11 LEU 67 HD11 LEU 67 24.676 29.154 14.776
537 HD12 LEU 67 HD12 LEU 67 26.115 29.293 15.786
538 HD13 LEU 67 HD13 LEU 67 26.033 28.060 14.531
539 HD21 LEU 67 HD21 LEU 67 25.540 29.384 11.907
540 HD22 LEU 67 HD22 LEU 67 25.667 31.136 12.055
541 HD23 LEU 67 HD23 LEU 67 24.401 30.262 12.924
542 H HIS 68 HN HIS 68 26.708 32.185 17.035
543 HA HIS 68 HA HIS 68 26.747 35.118 17.155
544 HB2 HIS 68 HB2 HIS 68 25.599 33.350 19.326
545 HB3 HIS 68 HB1 HIS 68 26.077 35.028 19.580
546 HD2 HIS 68 HD2 HIS 68 24.804 36.387 16.876
547 HE1 HIS 68 HE1 HIS 68 21.172 34.617 18.091
548 HE2 HIS 68 HE2 HIS 68 22.210 36.387 16.599
549 H ILE 69 HN ILE 69 28.759 35.710 17.498
550 HA ILE 69 HA ILE 69 30.646 33.852 18.797
551 HB ILE 69 HB ILE 69 31.131 36.410 17.239
552 HG12 ILE 69 HG12 ILE 69 31.715 33.539 16.459
553 HG13 ILE 69 HG11 ILE 69 30.252 34.388 15.965
554 HG21 ILE 69 HG21 ILE 69 32.939 36.139 18.764
555 HG22 ILE 69 HG22 ILE 69 33.508 35.454 17.244
556 HG23 ILE 69 HG23 ILE 69 32.965 34.390 18.540
557 HD11 ILE 69 HD11 ILE 69 31.751 36.195 14.998
558 HD12 ILE 69 HD12 ILE 69 31.840 34.639 14.175
559 HD13 ILE 69 HD13 ILE 69 33.114 35.116 15.296
560 H VAL 70 HN VAL 70 30.763 34.095 20.953
561 HA VAL 70 HA VAL 70 30.239 36.702 22.180
562 HB VAL 70 HB VAL 70 30.965 34.137 23.596
563 HG11 VAL 70 HG11 VAL 70 30.986 36.256 24.886
564 HG12 VAL 70 HG12 VAL 70 29.703 35.172 25.426
565 HG13 VAL 70 HG13 VAL 70 29.317 36.553 24.399
566 HG21 VAL 70 HG21 VAL 70 29.106 33.481 22.269
567 HG22 VAL 70 HG22 VAL 70 28.324 35.051 22.442
568 HG23 VAL 70 HG23 VAL 70 28.395 33.947 23.814
569 H TRP 71 HN TRP 71 31.992 37.990 21.832
570 HA TRP 71 HA TRP 71 34.678 36.972 22.504
571 HB2 TRP 71 HB2 TRP 71 34.427 38.156 20.363
572 HB3 TRP 71 HB1 TRP 71 33.810 39.573 21.214
573 HD1 TRP 71 HD1 TRP 71 36.935 37.297 21.562
574 HE1 TRP 71 HE1 TRP 71 38.974 38.819 21.978
575 HE3 TRP 71 HE3 TRP 71 34.645 41.852 21.531
576 HZ2 TRP 71 HZ2 TRP 71 39.555 41.607 22.261
577 HZ3 TRP 71 HZ3 TRP 71 35.959 43.927 21.876
578 HH2 TRP 71 HH2 TRP 71 38.410 43.809 22.241
579 H ARG 72 HN ARG 72 35.341 37.251 24.532
580 HA ARG 72 HA ARG 72 35.111 39.821 25.828
581 HB2 ARG 72 HB2 ARG 72 32.903 38.803 26.329
582 HB3 ARG 72 HB1 ARG 72 33.728 37.434 27.076
583 HG2 ARG 72 HG2 ARG 72 34.773 38.934 28.718
584 HG3 ARG 72 HG1 ARG 72 34.002 40.325 27.955
585 HD2 ARG 72 HD2 ARG 72 31.786 39.387 28.467
586 HD3 ARG 72 HD1 ARG 72 32.546 37.983 29.212
587 HE ARG 72 HE ARG 72 32.212 40.575 30.404
588 HH11 ARG 72 HH21 ARG 72 34.225 37.768 30.217
589 HH12 ARG 72 HH22 ARG 72 34.875 37.958 31.812
590 HH21 ARG 72 HH11 ARG 72 33.058 40.829 32.497
591 HH22 ARG 72 HH12 ARG 72 34.215 39.690 33.102
592 H LEU 73 HN LEU 73 37.199 40.002 26.379
593 HA LEU 73 HA LEU 73 38.780 37.725 27.196
594 HB2 LEU 73 HB2 LEU 73 39.532 40.644 27.428
595 HB3 LEU 73 HB1 LEU 73 40.610 39.253 27.307
596 HG LEU 73 HG LEU 73 38.734 40.266 25.149
597 HD11 LEU 73 HD11 LEU 73 41.740 40.274 25.495
598 HD12 LEU 73 HD12 LEU 73 40.674 41.661 25.263
599 HD13 LEU 73 HD13 LEU 73 40.959 40.536 23.935
600 HD21 LEU 73 HD21 LEU 73 40.463 37.794 25.367
601 HD22 LEU 73 HD22 LEU 73 40.036 38.477 23.797
602 HD23 LEU 73 HD23 LEU 73 38.770 37.909 24.882
603 H ARG 74 HN ARG 74 39.531 37.251 29.240
604 HA ARG 74 HA ARG 74 37.858 38.021 31.423
605 HB2 ARG 74 HB2 ARG 74 40.469 36.493 31.356
606 HB3 ARG 74 HB1 ARG 74 39.448 36.670 32.783
607 HG2 ARG 74 HG2 ARG 74 37.581 35.589 31.601
608 HG3 ARG 74 HG1 ARG 74 38.579 35.432 30.155
609 HD2 ARG 74 HD2 ARG 74 38.600 33.322 31.374
610 HD3 ARG 74 HD1 ARG 74 40.198 34.060 31.457
611 HE ARG 74 HE ARG 74 39.901 34.330 33.750
612 HH11 ARG 74 HH21 ARG 74 36.915 33.582 32.169
613 HH12 ARG 74 HH22 ARG 74 36.032 33.358 33.644
614 HH21 ARG 74 HH11 ARG 74 38.750 34.038 35.686
615 HH22 ARG 74 HH12 ARG 74 37.071 33.616 35.633
616 H GLY 75 HN GLY 75 38.378 39.229 33.265
617 HA2 GLY 75 HA2 GLY 75 39.844 41.594 32.851
618 HA3 GLY 75 HA1 GLY 75 39.274 41.010 34.413
619 H GLY 76 HN GLY 76 40.734 38.495 34.261
620 HA2 GLY 76 HA2 GLY 76 43.156 39.282 35.491
621 HA3 GLY 76 HA1 GLY 76 42.749 37.647 34.978
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 27.037 23.946 1.603
2 H2 MET 1 HT2 MET 1 25.802 22.841 1.975
3 H3 MET 1 HT3 MET 1 26.937 23.282 3.159
4 HA MET 1 HA MET 1 25.127 25.246 1.889
5 HB2 MET 1 HB2 MET 1 23.598 24.974 3.725
6 HB3 MET 1 HB1 MET 1 23.884 23.368 3.057
7 HG2 MET 1 HG2 MET 1 25.713 23.105 4.822
8 HG3 MET 1 HG1 MET 1 25.068 24.566 5.569
9 HE1 MET 1 HE1 MET 1 23.531 22.325 8.114
10 HE2 MET 1 HE2 MET 1 24.490 23.745 7.704
11 HE3 MET 1 HE3 MET 1 25.148 22.136 7.421
12 H GLN 2 HN GLN 2 25.584 27.274 2.552
13 HA GLN 2 HA GLN 2 27.821 27.649 4.418
14 HB2 GLN 2 HB2 GLN 2 26.378 29.560 2.566
15 HB3 GLN 2 HB1 GLN 2 27.728 30.006 3.610
16 HG2 GLN 2 HG2 GLN 2 29.141 28.309 2.489
17 HG3 GLN 2 HG1 GLN 2 27.797 27.907 1.421
18 HE21 GLN 2 HE21 GLN 2 30.227 28.882 0.321
19 HE22 GLN 2 HE22 GLN 2 29.960 30.439 -0.299
20 H ILE 3 HN ILE 3 27.606 29.677 5.844
21 HA ILE 3 HA ILE 3 24.900 30.152 6.846
22 HB ILE 3 HB ILE 3 25.619 29.685 9.198
23 HG12 ILE 3 HG12 ILE 3 27.904 28.149 7.928
24 HG13 ILE 3 HG11 ILE 3 28.107 29.766 8.599
25 HG21 ILE 3 HG21 ILE 3 25.186 27.335 9.069
26 HG22 ILE 3 HG22 ILE 3 25.843 27.234 7.436
27 HG23 ILE 3 HG23 ILE 3 24.315 28.069 7.723
28 HD11 ILE 3 HD11 ILE 3 28.588 27.723 10.139
29 HD12 ILE 3 HD12 ILE 3 26.833 27.588 10.248
30 HD13 ILE 3 HD13 ILE 3 27.642 29.060 10.788
31 H PHE 4 HN PHE 4 24.670 32.074 7.926
32 HA PHE 4 HA PHE 4 26.961 33.931 7.749
33 HB2 PHE 4 HB2 PHE 4 24.124 34.725 8.378
34 HB3 PHE 4 HB1 PHE 4 25.401 35.677 7.625
35 HD1 PHE 4 HD1 PHE 4 26.307 33.412 5.646
36 HD2 PHE 4 HD2 PHE 4 22.471 35.065 6.670
37 HE1 PHE 4 HE1 PHE 4 25.449 32.792 3.419
38 HE2 PHE 4 HE2 PHE 4 21.619 34.439 4.431
39 HZ PHE 4 HZ PHE 4 23.101 33.303 2.807
40 H VAL 5 HN VAL 5 27.966 34.612 9.511
41 HA VAL 5 HA VAL 5 26.805 33.942 12.158
42 HB VAL 5 HB VAL 5 29.109 33.894 12.958
43 HG11 VAL 5 HG11 VAL 5 29.760 31.864 11.896
44 HG12 VAL 5 HG12 VAL 5 29.003 32.332 10.372
45 HG13 VAL 5 HG13 VAL 5 28.003 31.903 11.758
46 HG21 VAL 5 HG21 VAL 5 30.203 35.544 11.654
47 HG22 VAL 5 HG22 VAL 5 29.690 34.801 10.139
48 HG23 VAL 5 HG23 VAL 5 30.919 34.019 11.132
49 H LYS 6 HN LYS 6 26.422 35.515 13.595
50 HA LYS 6 HA LYS 6 26.852 38.294 12.812
51 HB2 LYS 6 HB2 LYS 6 24.700 37.474 13.832
52 HB3 LYS 6 HB1 LYS 6 25.581 37.207 15.335
53 HG2 LYS 6 HG2 LYS 6 26.251 39.617 15.322
54 HG3 LYS 6 HG1 LYS 6 25.245 39.852 13.891
55 HD2 LYS 6 HD2 LYS 6 23.259 39.128 15.141
56 HD3 LYS 6 HD1 LYS 6 24.248 38.837 16.570
57 HE2 LYS 6 HE2 LYS 6 23.124 41.023 16.723
58 HE3 LYS 6 HE1 LYS 6 24.874 41.228 16.625
59 HZ1 LYS 6 HZ1 LYS 6 22.904 41.541 14.429
60 HZ2 LYS 6 HZ2 LYS 6 24.587 41.535 14.196
61 HZ3 LYS 6 HZ3 LYS 6 23.859 42.754 15.130
62 H GLY 7 HN GLY 7 28.318 39.672 13.728
63 HA2 GLY 7 HA2 GLY 7 29.738 38.906 16.174
64 HA3 GLY 7 HA1 GLY 7 30.708 39.031 14.712
65 H LEU 8 HN LEU 8 31.668 40.648 16.368
66 HA LEU 8 HA LEU 8 30.306 43.189 16.597
67 HB2 LEU 8 HB2 LEU 8 33.158 42.411 17.261
68 HB3 LEU 8 HB1 LEU 8 32.375 43.925 17.702
69 HG LEU 8 HG LEU 8 30.550 42.295 18.775
70 HD11 LEU 8 HD11 LEU 8 31.758 40.332 19.827
71 HD12 LEU 8 HD12 LEU 8 33.071 40.608 18.686
72 HD13 LEU 8 HD13 LEU 8 31.467 40.173 18.098
73 HD21 LEU 8 HD21 LEU 8 31.838 42.386 20.919
74 HD22 LEU 8 HD22 LEU 8 31.822 43.928 20.062
75 HD23 LEU 8 HD23 LEU 8 33.256 42.902 20.005
76 H THR 9 HN THR 9 32.125 41.675 14.195
77 HA THR 9 HA THR 9 33.696 43.763 13.169
78 HB THR 9 HB THR 9 33.684 42.516 11.075
79 HG1 THR 9 HG1 THR 9 31.255 41.867 11.888
80 HG21 THR 9 HG21 THR 9 33.578 40.537 13.360
81 HG22 THR 9 HG22 THR 9 34.918 41.659 13.125
82 HG23 THR 9 HG23 THR 9 34.560 40.446 11.897
83 H GLY 10 HN GLY 10 30.317 43.478 13.345
84 HA2 GLY 10 HA2 GLY 10 28.725 45.082 12.755
85 HA3 GLY 10 HA1 GLY 10 29.961 45.936 11.833
86 H LYS 11 HN LYS 11 30.254 42.806 10.969
87 HA LYS 11 HA LYS 11 28.130 42.763 8.942
88 HB2 LYS 11 HB2 LYS 11 29.723 42.371 7.128
89 HB3 LYS 11 HB1 LYS 11 30.042 43.932 7.884
90 HG2 LYS 11 HG2 LYS 11 31.802 42.834 9.290
91 HG3 LYS 11 HG1 LYS 11 31.545 41.345 8.383
92 HD2 LYS 11 HD2 LYS 11 32.119 42.526 6.287
93 HD3 LYS 11 HD1 LYS 11 32.406 44.003 7.208
94 HE2 LYS 11 HE2 LYS 11 34.192 42.900 8.473
95 HE3 LYS 11 HE1 LYS 11 33.883 41.387 7.619
96 HZ1 LYS 11 HZ1 LYS 11 35.752 42.676 6.692
97 HZ2 LYS 11 HZ2 LYS 11 34.671 43.927 6.297
98 HZ3 LYS 11 HZ3 LYS 11 34.516 42.401 5.564
99 H THR 12 HN THR 12 27.848 40.668 7.984
100 HA THR 12 HA THR 12 28.479 38.526 9.835
101 HB THR 12 HB THR 12 27.052 37.163 8.361
102 HG1 THR 12 HG1 THR 12 27.424 37.966 6.372
103 HG21 THR 12 HG21 THR 12 24.997 38.292 8.847
104 HG22 THR 12 HG22 THR 12 25.785 39.870 8.816
105 HG23 THR 12 HG23 THR 12 26.125 38.740 10.128
106 H THR 13 HN THR 13 29.330 36.447 9.066
107 HA THR 13 HA THR 13 31.291 36.726 6.853
108 HB THR 13 HB THR 13 31.699 35.922 9.705
109 HG1 THR 13 HG1 THR 13 33.845 36.828 8.834
110 HG21 THR 13 HG21 THR 13 32.352 33.854 8.723
111 HG22 THR 13 HG22 THR 13 33.847 34.760 8.946
112 HG23 THR 13 HG23 THR 13 33.107 34.659 7.348
113 H THR 14 HN THR 14 30.611 35.398 5.297
114 HA THR 14 HA THR 14 28.944 33.127 5.758
115 HB THR 14 HB THR 14 29.456 32.669 3.312
116 HG1 THR 14 HG1 THR 14 31.412 34.360 3.881
117 HG21 THR 14 HG21 THR 14 27.487 33.889 3.692
118 HG22 THR 14 HG22 THR 14 28.392 34.940 2.609
119 HG23 THR 14 HG23 THR 14 28.353 35.280 4.338
120 H LEU 15 HN LEU 15 29.542 31.207 6.478
121 HA LEU 15 HA LEU 15 32.344 30.295 6.084
122 HB2 LEU 15 HB2 LEU 15 30.407 30.072 8.360
123 HB3 LEU 15 HB1 LEU 15 31.576 28.774 8.138
124 HG LEU 15 HG LEU 15 32.564 31.620 8.079
125 HD11 LEU 15 HD11 LEU 15 31.225 31.650 10.084
126 HD12 LEU 15 HD12 LEU 15 32.908 31.455 10.572
127 HD13 LEU 15 HD13 LEU 15 31.823 30.064 10.571
128 HD21 LEU 15 HD21 LEU 15 34.013 29.608 7.597
129 HD22 LEU 15 HD22 LEU 15 33.740 29.086 9.259
130 HD23 LEU 15 HD23 LEU 15 34.584 30.601 8.938
131 H GLU 16 HN GLU 16 32.713 28.164 5.500
132 HA GLU 16 HA GLU 16 30.482 26.844 4.110
133 HB2 GLU 16 HB2 GLU 16 33.480 26.454 4.056
134 HB3 GLU 16 HB1 GLU 16 32.357 25.357 3.252
135 HG2 GLU 16 HG2 GLU 16 31.442 27.239 1.948
136 HG3 GLU 16 HG1 GLU 16 32.561 28.341 2.751
137 H VAL 17 HN VAL 17 29.397 25.266 5.102
138 HA VAL 17 HA VAL 17 30.818 23.408 6.888
139 HB VAL 17 HB VAL 17 29.181 23.630 8.647
140 HG11 VAL 17 HG11 VAL 17 31.133 25.274 8.454
141 HG12 VAL 17 HG12 VAL 17 29.792 25.778 9.483
142 HG13 VAL 17 HG13 VAL 17 29.955 26.443 7.857
143 HG21 VAL 17 HG21 VAL 17 27.167 24.102 7.442
144 HG22 VAL 17 HG22 VAL 17 27.862 25.551 6.715
145 HG23 VAL 17 HG23 VAL 17 27.473 25.528 8.434
146 H GLU 18 HN GLU 18 29.495 21.485 7.391
147 HA GLU 18 HA GLU 18 27.301 20.957 5.504
148 HB2 GLU 18 HB2 GLU 18 29.915 19.462 5.665
149 HB3 GLU 18 HB1 GLU 18 28.452 18.676 5.074
150 HG2 GLU 18 HG2 GLU 18 29.479 21.295 3.957
151 HG3 GLU 18 HG1 GLU 18 29.915 19.725 3.284
152 HA PRO 19 HA PRO 19 25.245 18.901 8.859
153 HB2 PRO 19 HB2 PRO 19 25.268 16.461 7.099
154 HB3 PRO 19 HB1 PRO 19 23.928 17.161 8.029
155 HG2 PRO 19 HG2 PRO 19 24.136 17.526 5.390
156 HG3 PRO 19 HG1 PRO 19 23.514 18.795 6.460
157 HD2 PRO 19 HD2 PRO 19 26.118 18.673 5.027
158 HD3 PRO 19 HD1 PRO 19 25.223 20.085 5.634
159 H SER 20 HN SER 20 27.765 17.036 7.189
160 HA SER 20 HA SER 20 28.365 15.350 9.430
161 HB2 SER 20 HB2 SER 20 30.296 14.645 8.076
162 HB3 SER 20 HB1 SER 20 28.811 14.633 7.128
163 HG SER 20 HG SER 20 30.144 15.753 5.860
164 H ASP 21 HN ASP 21 29.531 18.431 8.241
165 HA ASP 21 HA ASP 21 31.967 18.576 9.625
166 HB2 ASP 21 HB2 ASP 21 31.147 20.178 7.858
167 HB3 ASP 21 HB1 ASP 21 30.103 20.895 9.090
168 H THR 22 HN THR 22 32.260 18.317 11.729
169 HA THR 22 HA THR 22 30.162 18.753 13.650
170 HB THR 22 HB THR 22 31.771 18.009 15.291
171 HG1 THR 22 HG1 THR 22 33.945 17.733 14.666
172 HG21 THR 22 HG21 THR 22 30.802 16.330 13.696
173 HG22 THR 22 HG22 THR 22 32.369 15.856 14.355
174 HG23 THR 22 HG23 THR 22 32.258 16.494 12.714
175 H ILE 23 HN ILE 23 30.536 20.132 15.596
176 HA ILE 23 HA ILE 23 30.879 22.827 14.865
177 HB ILE 23 HB ILE 23 31.131 21.715 17.661
178 HG12 ILE 23 HG12 ILE 23 29.174 20.696 16.666
179 HG13 ILE 23 HG11 ILE 23 28.629 21.987 17.727
180 HG21 ILE 23 HG21 ILE 23 30.231 23.860 18.322
181 HG22 ILE 23 HG22 ILE 23 29.930 24.305 16.643
182 HG23 ILE 23 HG23 ILE 23 31.585 24.161 17.233
183 HD11 ILE 23 HD11 ILE 23 28.708 21.924 14.716
184 HD12 ILE 23 HD12 ILE 23 28.698 23.466 15.571
185 HD13 ILE 23 HD13 ILE 23 27.362 22.337 15.776
186 H GLU 24 HN GLU 24 33.063 20.526 16.440
187 HA GLU 24 HA GLU 24 35.137 22.158 17.218
188 HB2 GLU 24 HB2 GLU 24 35.039 19.678 17.519
189 HB3 GLU 24 HB1 GLU 24 35.471 19.497 15.819
190 HG2 GLU 24 HG2 GLU 24 37.561 20.741 16.205
191 HG3 GLU 24 HG1 GLU 24 37.129 20.949 17.901
192 H ASN 25 HN ASN 25 34.543 20.836 13.964
193 HA ASN 25 HA ASN 25 36.838 21.950 12.748
194 HB2 ASN 25 HB2 ASN 25 35.490 20.151 11.726
195 HB3 ASN 25 HB1 ASN 25 34.158 21.287 11.500
196 HD21 ASN 25 HD21 ASN 25 36.101 19.812 9.537
197 HD22 ASN 25 HD22 ASN 25 36.616 21.060 8.506
198 H VAL 26 HN VAL 26 33.511 23.139 13.081
199 HA VAL 26 HA VAL 26 33.716 25.458 11.547
200 HB VAL 26 HB VAL 26 32.147 25.171 14.119
201 HG11 VAL 26 HG11 VAL 26 30.633 26.784 12.948
202 HG12 VAL 26 HG12 VAL 26 31.825 26.907 11.654
203 HG13 VAL 26 HG13 VAL 26 32.229 27.453 13.277
204 HG21 VAL 26 HG21 VAL 26 31.221 24.554 11.301
205 HG22 VAL 26 HG22 VAL 26 30.370 24.228 12.810
206 HG23 VAL 26 HG23 VAL 26 31.818 23.313 12.399
207 H LYS 27 HN LYS 27 34.388 25.015 15.020
208 HA LYS 27 HA LYS 27 35.124 27.677 15.577
209 HB2 LYS 27 HB2 LYS 27 35.897 25.040 16.834
210 HB3 LYS 27 HB1 LYS 27 36.471 26.585 17.463
211 HG2 LYS 27 HG2 LYS 27 34.108 27.343 17.668
212 HG3 LYS 27 HG1 LYS 27 33.573 25.748 17.145
213 HD2 LYS 27 HD2 LYS 27 35.370 26.195 19.545
214 HD3 LYS 27 HD1 LYS 27 33.615 26.090 19.662
215 HE2 LYS 27 HE2 LYS 27 33.879 23.831 18.397
216 HE3 LYS 27 HE1 LYS 27 35.577 23.943 18.857
217 HZ1 LYS 27 HZ1 LYS 27 34.451 22.732 20.533
218 HZ2 LYS 27 HZ2 LYS 27 33.224 23.901 20.659
219 HZ3 LYS 27 HZ3 LYS 27 34.800 24.261 21.181
220 H ALA 28 HN ALA 28 36.929 24.948 14.261
221 HA ALA 28 HA ALA 28 39.515 26.094 14.446
222 HB1 ALA 28 HB1 ALA 28 40.206 24.360 12.931
223 HB2 ALA 28 HB2 ALA 28 38.555 24.126 12.360
224 HB3 ALA 28 HB3 ALA 28 38.992 23.666 14.005
225 H LYS 29 HN LYS 29 37.057 26.108 11.881
226 HA LYS 29 HA LYS 29 38.581 27.521 9.959
227 HB2 LYS 29 HB2 LYS 29 35.586 27.385 10.377
228 HB3 LYS 29 HB1 LYS 29 36.362 28.055 8.946
229 HG2 LYS 29 HG2 LYS 29 37.013 25.255 9.865
230 HG3 LYS 29 HG1 LYS 29 35.574 25.564 8.899
231 HD2 LYS 29 HD2 LYS 29 37.047 26.689 7.190
232 HD3 LYS 29 HD1 LYS 29 38.445 26.152 8.120
233 HE2 LYS 29 HE2 LYS 29 37.536 23.793 7.927
234 HE3 LYS 29 HE1 LYS 29 36.363 24.423 6.770
235 HZ1 LYS 29 HZ1 LYS 29 38.260 23.590 5.600
236 HZ2 LYS 29 HZ2 LYS 29 39.320 24.531 6.536
237 HZ3 LYS 29 HZ3 LYS 29 38.241 25.280 5.458
238 H ILE 30 HN ILE 30 36.354 28.549 12.493
239 HA ILE 30 HA ILE 30 36.364 31.314 11.915
240 HB ILE 30 HB ILE 30 35.880 29.775 14.472
241 HG12 ILE 30 HG12 ILE 30 33.922 31.217 12.672
242 HG13 ILE 30 HG11 ILE 30 34.330 29.513 12.462
243 HG21 ILE 30 HG21 ILE 30 35.601 32.724 13.857
244 HG22 ILE 30 HG22 ILE 30 36.488 31.974 15.184
245 HG23 ILE 30 HG23 ILE 30 34.724 31.941 15.173
246 HD11 ILE 30 HD11 ILE 30 33.412 30.602 15.126
247 HD12 ILE 30 HD12 ILE 30 33.449 28.928 14.586
248 HD13 ILE 30 HD13 ILE 30 32.266 30.043 13.908
249 H GLN 31 HN GLN 31 38.321 29.364 14.165
250 HA GLN 31 HA GLN 31 39.806 31.360 15.369
251 HB2 GLN 31 HB2 GLN 31 39.907 28.969 15.991
252 HB3 GLN 31 HB1 GLN 31 40.797 28.630 14.502
253 HG2 GLN 31 HG2 GLN 31 42.664 29.940 15.209
254 HG3 GLN 31 HG1 GLN 31 41.754 30.647 16.543
255 HE21 GLN 31 HE21 GLN 31 44.173 29.377 17.145
256 HE22 GLN 31 HE22 GLN 31 43.867 27.914 17.948
257 H ASP 32 HN ASP 32 39.700 30.593 12.088
258 HA ASP 32 HA ASP 32 42.414 31.492 11.477
259 HB2 ASP 32 HB2 ASP 32 41.183 29.641 10.218
260 HB3 ASP 32 HB1 ASP 32 40.201 30.920 9.506
261 H LYS 33 HN LYS 33 39.074 32.623 11.158
262 HA LYS 33 HA LYS 33 39.908 35.111 9.885
263 HB2 LYS 33 HB2 LYS 33 37.198 34.104 10.784
264 HB3 LYS 33 HB1 LYS 33 37.474 35.618 9.922
265 HG2 LYS 33 HG2 LYS 33 38.454 34.391 8.034
266 HG3 LYS 33 HG1 LYS 33 38.236 32.867 8.896
267 HD2 LYS 33 HD2 LYS 33 35.792 33.239 8.930
268 HD3 LYS 33 HD1 LYS 33 36.016 34.751 8.049
269 HE2 LYS 33 HE2 LYS 33 36.999 33.531 6.159
270 HE3 LYS 33 HE1 LYS 33 36.846 32.013 7.042
271 HZ1 LYS 33 HZ1 LYS 33 34.359 32.862 7.199
272 HZ2 LYS 33 HZ2 LYS 33 34.921 31.940 5.888
273 HZ3 LYS 33 HZ3 LYS 33 34.792 33.628 5.749
274 H THR 34 HN THR 34 39.464 33.930 13.062
275 HA THR 34 HA THR 34 39.137 36.666 14.160
276 HB THR 34 HB THR 34 38.496 35.533 16.249
277 HG1 THR 34 HG1 THR 34 39.246 33.318 14.723
278 HG21 THR 34 HG21 THR 34 36.391 34.430 15.349
279 HG22 THR 34 HG22 THR 34 37.041 34.697 13.732
280 HG23 THR 34 HG23 THR 34 36.683 36.073 14.776
281 H GLY 35 HN GLY 35 41.154 33.787 14.163
282 HA2 GLY 35 HA2 GLY 35 43.291 33.400 14.914
283 HA3 GLY 35 HA1 GLY 35 43.539 35.130 14.718
284 H LEU 36 HN LEU 36 41.960 32.841 16.969
285 HA LEU 36 HA LEU 36 43.362 34.045 19.198
286 HB2 LEU 36 HB2 LEU 36 40.972 34.228 20.384
287 HB3 LEU 36 HB1 LEU 36 41.645 35.568 19.458
288 HG LEU 36 HG LEU 36 40.381 34.905 17.485
289 HD11 LEU 36 HD11 LEU 36 38.583 33.041 17.932
290 HD12 LEU 36 HD12 LEU 36 39.701 32.512 19.186
291 HD13 LEU 36 HD13 LEU 36 40.224 32.570 17.502
292 HD21 LEU 36 HD21 LEU 36 39.175 36.391 18.901
293 HD22 LEU 36 HD22 LEU 36 38.832 35.122 20.075
294 HD23 LEU 36 HD23 LEU 36 38.027 35.112 18.506
295 HA PRO 37 HA PRO 37 43.402 29.980 20.912
296 HB2 PRO 37 HB2 PRO 37 41.963 31.125 23.294
297 HB3 PRO 37 HB1 PRO 37 43.395 30.075 23.243
298 HG2 PRO 37 HG2 PRO 37 43.598 32.708 23.690
299 HG3 PRO 37 HG1 PRO 37 44.824 31.816 22.771
300 HD2 PRO 37 HD2 PRO 37 42.808 33.770 21.783
301 HD3 PRO 37 HD1 PRO 37 44.358 33.279 21.065
302 HA PRO 38 HA PRO 38 39.333 28.363 20.075
303 HB2 PRO 38 HB2 PRO 38 39.460 25.897 21.249
304 HB3 PRO 38 HB1 PRO 38 40.364 26.302 19.775
305 HG2 PRO 38 HG2 PRO 38 41.314 26.223 22.609
306 HG3 PRO 38 HG1 PRO 38 42.109 25.624 21.141
307 HD2 PRO 38 HD2 PRO 38 42.767 28.017 22.293
308 HD3 PRO 38 HD1 PRO 38 42.889 27.731 20.542
309 H ASP 39 HN ASP 39 40.501 28.446 23.373
310 HA ASP 39 HA ASP 39 37.921 27.988 24.587
311 HB2 ASP 39 HB2 ASP 39 39.945 27.329 25.775
312 HB3 ASP 39 HB1 ASP 39 40.528 28.993 25.752
313 H GLN 40 HN GLN 40 39.070 30.500 22.855
314 HA GLN 40 HA GLN 40 37.772 32.590 24.506
315 HB2 GLN 40 HB2 GLN 40 40.216 32.776 23.557
316 HB3 GLN 40 HB1 GLN 40 39.408 33.158 22.039
317 HG2 GLN 40 HG2 GLN 40 39.771 35.262 23.082
318 HG3 GLN 40 HG1 GLN 40 38.073 34.900 23.383
319 HE21 GLN 40 HE21 GLN 40 41.250 34.188 24.964
320 HE22 GLN 40 HE22 GLN 40 40.686 34.490 26.538
321 H GLN 41 HN GLN 41 36.799 30.435 22.392
322 HA GLN 41 HA GLN 41 35.198 32.297 20.725
323 HB2 GLN 41 HB2 GLN 41 36.070 29.438 20.279
324 HB3 GLN 41 HB1 GLN 41 34.845 30.239 19.294
325 HG2 GLN 41 HG2 GLN 41 36.420 31.941 18.602
326 HG3 GLN 41 HG1 GLN 41 37.637 31.331 19.723
327 HE21 GLN 41 HE21 GLN 41 38.329 31.480 17.017
328 HE22 GLN 41 HE22 GLN 41 38.408 29.916 16.360
329 H ARG 42 HN ARG 42 32.996 32.052 20.602
330 HA ARG 42 HA ARG 42 31.696 29.990 22.261
331 HB2 ARG 42 HB2 ARG 42 31.937 32.051 23.646
332 HB3 ARG 42 HB1 ARG 42 31.019 32.939 22.428
333 HG2 ARG 42 HG2 ARG 42 29.083 31.515 22.764
334 HG3 ARG 42 HG1 ARG 42 29.994 30.469 23.853
335 HD2 ARG 42 HD2 ARG 42 30.330 32.449 25.364
336 HD3 ARG 42 HD1 ARG 42 29.247 33.365 24.322
337 HE ARG 42 HE ARG 42 28.045 30.915 25.187
338 HH11 ARG 42 HH21 ARG 42 28.864 34.146 26.128
339 HH12 ARG 42 HH22 ARG 42 27.602 34.268 27.307
340 HH21 ARG 42 HH11 ARG 42 26.395 31.068 26.741
341 HH22 ARG 42 HH12 ARG 42 26.207 32.525 27.658
342 H LEU 43 HN LEU 43 30.090 29.057 21.166
343 HA LEU 43 HA LEU 43 28.797 30.552 18.946
344 HB2 LEU 43 HB2 LEU 43 29.435 27.594 19.058
345 HB3 LEU 43 HB1 LEU 43 28.631 28.434 17.730
346 HG LEU 43 HG LEU 43 31.407 29.145 18.726
347 HD11 LEU 43 HD11 LEU 43 30.501 27.250 16.554
348 HD12 LEU 43 HD12 LEU 43 31.626 26.937 17.875
349 HD13 LEU 43 HD13 LEU 43 32.101 27.988 16.541
350 HD21 LEU 43 HD21 LEU 43 30.562 30.998 17.525
351 HD22 LEU 43 HD22 LEU 43 29.692 29.981 16.379
352 HD23 LEU 43 HD23 LEU 43 31.448 30.101 16.297
353 H ILE 44 HN ILE 44 26.686 30.760 19.106
354 HA ILE 44 HA ILE 44 25.092 28.747 20.559
355 HB ILE 44 HB ILE 44 25.029 31.734 21.066
356 HG12 ILE 44 HG12 ILE 44 25.274 29.443 23.028
357 HG13 ILE 44 HG11 ILE 44 26.679 30.232 22.316
358 HG21 ILE 44 HG21 ILE 44 23.058 29.546 21.742
359 HG22 ILE 44 HG22 ILE 44 22.743 31.084 20.936
360 HG23 ILE 44 HG23 ILE 44 23.134 31.054 22.654
361 HD11 ILE 44 HD11 ILE 44 24.507 31.613 23.918
362 HD12 ILE 44 HD12 ILE 44 25.907 32.407 23.194
363 HD13 ILE 44 HD13 ILE 44 26.131 31.239 24.495
364 H PHE 45 HN PHE 45 23.444 28.120 19.346
365 HA PHE 45 HA PHE 45 22.435 29.935 17.215
366 HB2 PHE 45 HB2 PHE 45 23.594 27.890 16.376
367 HB3 PHE 45 HB1 PHE 45 22.422 26.903 17.244
368 HD1 PHE 45 HD1 PHE 45 22.552 29.759 14.812
369 HD2 PHE 45 HD2 PHE 45 20.458 26.262 16.146
370 HE1 PHE 45 HE1 PHE 45 20.952 30.005 12.936
371 HE2 PHE 45 HE2 PHE 45 18.854 26.503 14.270
372 HZ PHE 45 HZ PHE 45 19.104 28.377 12.664
373 H ALA 46 HN ALA 46 20.300 30.389 17.230
374 HA ALA 46 HA ALA 46 18.157 30.558 18.057
375 HB1 ALA 46 HB1 ALA 46 18.392 27.556 18.345
376 HB2 ALA 46 HB2 ALA 46 18.091 28.373 16.810
377 HB3 ALA 46 HB3 ALA 46 16.916 28.496 18.120
378 H GLY 47 HN GLY 47 20.567 30.312 19.985
379 HA2 GLY 47 HA2 GLY 47 20.462 30.981 22.277
380 HA3 GLY 47 HA1 GLY 47 18.932 30.124 22.439
381 H LYS 48 HN LYS 48 20.070 27.789 20.935
382 HA LYS 48 HA LYS 48 21.026 26.332 23.204
383 HB2 LYS 48 HB2 LYS 48 20.846 25.629 20.267
384 HB3 LYS 48 HB1 LYS 48 21.354 24.493 21.517
385 HG2 LYS 48 HG2 LYS 48 19.211 24.826 22.695
386 HG3 LYS 48 HG1 LYS 48 18.699 25.955 21.440
387 HD2 LYS 48 HD2 LYS 48 18.846 24.182 19.752
388 HD3 LYS 48 HD1 LYS 48 19.416 23.045 20.975
389 HE2 LYS 48 HE2 LYS 48 17.285 23.423 22.239
390 HE3 LYS 48 HE1 LYS 48 16.713 24.415 20.896
391 HZ1 LYS 48 HZ1 LYS 48 15.991 22.052 20.820
392 HZ2 LYS 48 HZ2 LYS 48 17.615 21.605 20.600
393 HZ3 LYS 48 HZ3 LYS 48 16.831 22.565 19.438
394 H GLN 49 HN GLN 49 23.072 25.800 23.794
395 HA GLN 49 HA GLN 49 25.267 27.177 22.454
396 HB2 GLN 49 HB2 GLN 49 25.149 27.239 24.898
397 HB3 GLN 49 HB1 GLN 49 25.226 25.478 24.958
398 HG2 GLN 49 HG2 GLN 49 27.444 25.460 24.037
399 HG3 GLN 49 HG1 GLN 49 27.360 27.176 23.645
400 HE21 GLN 49 HE21 GLN 49 29.472 26.223 25.278
401 HE22 GLN 49 HE22 GLN 49 29.248 26.797 26.859
402 H LEU 50 HN LEU 50 26.763 26.269 21.202
403 HA LEU 50 HA LEU 50 26.450 23.468 20.448
404 HB2 LEU 50 HB2 LEU 50 28.425 25.480 19.366
405 HB3 LEU 50 HB1 LEU 50 27.876 23.992 18.602
406 HG LEU 50 HG LEU 50 26.233 26.480 19.136
407 HD11 LEU 50 HD11 LEU 50 27.822 26.322 17.122
408 HD12 LEU 50 HD12 LEU 50 26.135 26.690 16.763
409 HD13 LEU 50 HD13 LEU 50 26.754 25.056 16.518
410 HD21 LEU 50 HD21 LEU 50 24.708 24.716 19.541
411 HD22 LEU 50 HD22 LEU 50 25.443 23.681 18.317
412 HD23 LEU 50 HD23 LEU 50 24.473 25.072 17.831
413 H GLU 51 HN GLU 51 28.021 21.903 20.582
414 HA GLU 51 HA GLU 51 30.549 22.473 21.944
415 HB2 GLU 51 HB2 GLU 51 28.432 20.612 23.045
416 HB3 GLU 51 HB1 GLU 51 30.126 20.548 23.532
417 HG2 GLU 51 HG2 GLU 51 29.985 22.941 24.213
418 HG3 GLU 51 HG1 GLU 51 28.267 22.926 23.817
419 H ASP 52 HN ASP 52 32.009 20.591 21.886
420 HA ASP 52 HA ASP 52 31.980 19.345 19.329
421 HB2 ASP 52 HB2 ASP 52 33.975 18.160 20.104
422 HB3 ASP 52 HB1 ASP 52 34.065 19.866 20.537
423 H GLY 53 HN GLY 53 31.824 17.100 18.838
424 HA2 GLY 53 HA2 GLY 53 31.217 14.860 19.249
425 HA3 GLY 53 HA1 GLY 53 30.631 15.323 20.845
426 H ARG 54 HN ARG 54 29.556 17.561 18.635
427 HA ARG 54 HA ARG 54 27.045 16.103 18.040
428 HB2 ARG 54 HB2 ARG 54 27.375 18.839 19.290
429 HB3 ARG 54 HB1 ARG 54 25.886 18.336 18.488
430 HG2 ARG 54 HG2 ARG 54 25.537 16.551 20.030
431 HG3 ARG 54 HG1 ARG 54 27.172 16.693 20.675
432 HD2 ARG 54 HD2 ARG 54 26.668 18.816 21.691
433 HD3 ARG 54 HD1 ARG 54 25.109 18.900 20.874
434 HE ARG 54 HE ARG 54 25.714 17.431 23.281
435 HH11 ARG 54 HH21 ARG 54 23.731 17.623 20.452
436 HH12 ARG 54 HH22 ARG 54 22.403 16.760 21.156
437 HH21 ARG 54 HH11 ARG 54 23.975 16.306 24.212
438 HH22 ARG 54 HH12 ARG 54 22.542 16.015 23.285
439 H THR 55 HN THR 55 26.089 16.618 16.093
440 HA THR 55 HA THR 55 27.740 18.227 14.238
441 HB THR 55 HB THR 55 26.345 17.031 12.489
442 HG1 THR 55 HG1 THR 55 24.647 16.387 13.803
443 HG21 THR 55 HG21 THR 55 28.157 15.556 14.403
444 HG22 THR 55 HG22 THR 55 28.563 16.251 12.834
445 HG23 THR 55 HG23 THR 55 27.551 14.810 12.925
446 H LEU 56 HN LEU 56 26.303 19.191 12.407
447 HA LEU 56 HA LEU 56 24.721 21.246 13.532
448 HB2 LEU 56 HB2 LEU 56 24.701 20.253 10.678
449 HB3 LEU 56 HB1 LEU 56 24.218 21.847 11.239
450 HG LEU 56 HG LEU 56 27.004 20.677 11.481
451 HD11 LEU 56 HD11 LEU 56 25.874 22.827 9.662
452 HD12 LEU 56 HD12 LEU 56 26.424 21.228 9.162
453 HD13 LEU 56 HD13 LEU 56 27.579 22.401 9.790
454 HD21 LEU 56 HD21 LEU 56 26.810 22.201 13.272
455 HD22 LEU 56 HD22 LEU 56 25.745 23.278 12.366
456 HD23 LEU 56 HD23 LEU 56 27.464 23.207 11.983
457 H SER 57 HN SER 57 23.965 18.128 12.158
458 HA SER 57 HA SER 57 21.168 18.444 11.884
459 HB2 SER 57 HB2 SER 57 21.113 15.987 11.805
460 HB3 SER 57 HB1 SER 57 22.405 16.632 10.797
461 HG SER 57 HG SER 57 23.362 16.318 13.246
462 H ASP 58 HN ASP 58 23.121 18.153 14.684
463 HA ASP 58 HA ASP 58 21.025 16.977 16.341
464 HB2 ASP 58 HB2 ASP 58 23.778 18.062 16.956
465 HB3 ASP 58 HB1 ASP 58 22.671 17.493 18.200
466 H TYR 59 HN TYR 59 22.588 20.116 15.854
467 HA TYR 59 HA TYR 59 20.879 21.433 17.801
468 HB2 TYR 59 HB2 TYR 59 22.870 22.557 15.820
469 HB3 TYR 59 HB1 TYR 59 22.084 23.465 17.110
470 HD1 TYR 59 HD2 TYR 59 22.465 22.753 19.520
471 HD2 TYR 59 HD1 TYR 59 24.786 21.221 16.246
472 HE1 TYR 59 HE2 TYR 59 24.223 22.019 21.109
473 HE2 TYR 59 HE1 TYR 59 26.543 20.488 17.834
474 HH TYR 59 HH TYR 59 26.795 21.579 20.921
475 H ASN 60 HN ASN 60 20.363 20.297 14.786
476 HA ASN 60 HA ASN 60 18.761 20.667 13.182
477 HB2 ASN 60 HB2 ASN 60 17.565 22.696 15.072
478 HB3 ASN 60 HB1 ASN 60 16.747 21.775 13.812
479 HD21 ASN 60 HD21 ASN 60 17.029 21.874 17.092
480 HD22 ASN 60 HD22 ASN 60 16.820 20.228 17.451
481 H ILE 61 HN ILE 61 21.216 22.329 13.369
482 HA ILE 61 HA ILE 61 20.540 24.976 12.490
483 HB ILE 61 HB ILE 61 23.093 23.366 12.562
484 HG12 ILE 61 HG12 ILE 61 22.361 25.940 13.958
485 HG13 ILE 61 HG11 ILE 61 21.996 24.360 14.647
486 HG21 ILE 61 HG21 ILE 61 23.412 24.768 10.657
487 HG22 ILE 61 HG22 ILE 61 24.180 25.619 11.998
488 HG23 ILE 61 HG23 ILE 61 22.590 26.119 11.430
489 HD11 ILE 61 HD11 ILE 61 24.745 25.386 13.882
490 HD12 ILE 61 HD12 ILE 61 24.406 23.766 14.489
491 HD13 ILE 61 HD13 ILE 61 24.134 25.169 15.522
492 H GLN 62 HN GLN 62 20.319 25.755 10.459
493 HA GLN 62 HA GLN 62 20.641 23.871 8.185
494 HB2 GLN 62 HB2 GLN 62 18.560 26.055 8.451
495 HB3 GLN 62 HB1 GLN 62 18.692 24.862 7.158
496 HG2 GLN 62 HG2 GLN 62 18.310 23.049 8.786
497 HG3 GLN 62 HG1 GLN 62 18.175 24.239 10.079
498 HE21 GLN 62 HE21 GLN 62 16.101 22.312 8.889
499 HE22 GLN 62 HE22 GLN 62 14.791 23.312 8.490
500 H LYS 63 HN LYS 63 19.993 25.825 6.220
501 HA LYS 63 HA LYS 63 22.561 27.099 5.968
502 HB2 LYS 63 HB2 LYS 63 21.059 26.100 4.097
503 HB3 LYS 63 HB1 LYS 63 20.204 27.640 4.168
504 HG2 LYS 63 HG2 LYS 63 22.343 28.834 3.773
505 HG3 LYS 63 HG1 LYS 63 23.176 27.283 3.670
506 HD2 LYS 63 HD2 LYS 63 21.825 26.643 1.735
507 HD3 LYS 63 HD1 LYS 63 20.895 28.136 1.862
508 HE2 LYS 63 HE2 LYS 63 22.980 29.438 1.491
509 HE3 LYS 63 HE1 LYS 63 23.866 27.927 1.287
510 HZ1 LYS 63 HZ1 LYS 63 21.708 29.019 -0.421
511 HZ2 LYS 63 HZ2 LYS 63 22.206 27.397 -0.510
512 HZ3 LYS 63 HZ3 LYS 63 23.304 28.647 -0.860
513 H GLU 64 HN GLU 64 22.959 29.339 5.747
514 HA GLU 64 HA GLU 64 22.833 31.533 6.407
515 HB2 GLU 64 HB2 GLU 64 19.833 31.310 6.213
516 HB3 GLU 64 HB1 GLU 64 20.863 32.702 5.874
517 HG2 GLU 64 HG2 GLU 64 21.901 31.249 4.008
518 HG3 GLU 64 HG1 GLU 64 20.503 30.196 4.230
519 H SER 65 HN SER 65 22.586 29.329 8.402
520 HA SER 65 HA SER 65 20.798 30.172 10.462
521 HB2 SER 65 HB2 SER 65 22.974 28.177 10.163
522 HB3 SER 65 HB1 SER 65 22.614 28.686 11.806
523 HG SER 65 HG SER 65 20.949 27.427 11.671
524 H THR 66 HN THR 66 21.022 31.762 11.924
525 HA THR 66 HA THR 66 23.423 33.381 11.904
526 HB THR 66 HB THR 66 20.729 33.625 13.236
527 HG1 THR 66 HG1 THR 66 20.370 34.939 11.634
528 HG21 THR 66 HG21 THR 66 21.624 35.961 13.863
529 HG22 THR 66 HG22 THR 66 23.229 35.272 13.619
530 HG23 THR 66 HG23 THR 66 22.160 34.603 14.851
531 H LEU 67 HN LEU 67 25.102 32.853 13.083
532 HA LEU 67 HA LEU 67 24.779 31.355 15.590
533 HB2 LEU 67 HB2 LEU 67 27.203 32.127 13.942
534 HB3 LEU 67 HB1 LEU 67 27.303 31.294 15.488
535 HG LEU 67 HG LEU 67 27.417 29.729 13.556
536 HD11 LEU 67 HD11 LEU 67 24.777 29.163 14.856
537 HD12 LEU 67 HD12 LEU 67 26.211 29.263 15.873
538 HD13 LEU 67 HD13 LEU 67 26.136 28.087 14.564
539 HD21 LEU 67 HD21 LEU 67 25.681 29.484 11.993
540 HD22 LEU 67 HD22 LEU 67 25.761 31.231 12.196
541 HD23 LEU 67 HD23 LEU 67 24.503 30.302 13.016
542 H HIS 68 HN HIS 68 26.863 32.223 17.092
543 HA HIS 68 HA HIS 68 26.719 35.145 17.337
544 HB2 HIS 68 HB2 HIS 68 25.850 33.245 19.522
545 HB3 HIS 68 HB1 HIS 68 26.165 34.960 19.763
546 HD2 HIS 68 HD2 HIS 68 24.562 36.209 17.196
547 HE1 HIS 68 HE1 HIS 68 21.245 34.016 18.610
548 HE2 HIS 68 HE2 HIS 68 21.969 35.926 17.100
549 H ILE 69 HN ILE 69 28.762 35.764 17.490
550 HA ILE 69 HA ILE 69 30.654 34.142 19.110
551 HB ILE 69 HB ILE 69 32.395 35.327 17.555
552 HG12 ILE 69 HG12 ILE 69 30.008 35.319 15.696
553 HG13 ILE 69 HG11 ILE 69 30.542 36.770 16.541
554 HG21 ILE 69 HG21 ILE 69 32.204 33.480 15.923
555 HG22 ILE 69 HG22 ILE 69 30.575 33.136 16.505
556 HG23 ILE 69 HG23 ILE 69 31.960 32.897 17.570
557 HD11 ILE 69 HD11 ILE 69 31.505 36.527 14.222
558 HD12 ILE 69 HD12 ILE 69 32.356 35.090 14.792
559 HD13 ILE 69 HD13 ILE 69 32.719 36.667 15.494
560 H VAL 70 HN VAL 70 30.800 35.173 20.998
561 HA VAL 70 HA VAL 70 30.983 38.130 21.026
562 HB VAL 70 HB VAL 70 30.609 37.746 23.546
563 HG11 VAL 70 HG11 VAL 70 28.459 36.999 21.538
564 HG12 VAL 70 HG12 VAL 70 28.868 38.630 22.066
565 HG13 VAL 70 HG13 VAL 70 28.159 37.487 23.205
566 HG21 VAL 70 HG21 VAL 70 29.698 35.650 24.232
567 HG22 VAL 70 HG22 VAL 70 31.140 35.249 23.302
568 HG23 VAL 70 HG23 VAL 70 29.544 35.088 22.567
569 H TRP 71 HN TRP 71 32.814 39.106 21.591
570 HA TRP 71 HA TRP 71 35.086 37.433 22.503
571 HB2 TRP 71 HB2 TRP 71 35.493 38.483 20.356
572 HB3 TRP 71 HB1 TRP 71 35.006 40.055 20.987
573 HD1 TRP 71 HD1 TRP 71 37.582 37.344 22.037
574 HE1 TRP 71 HE1 TRP 71 39.763 38.552 22.700
575 HE3 TRP 71 HE3 TRP 71 36.159 42.183 21.295
576 HZ2 TRP 71 HZ2 TRP 71 40.768 41.230 22.891
577 HZ3 TRP 71 HZ3 TRP 71 37.740 44.046 21.723
578 HH2 TRP 71 HH2 TRP 71 40.041 43.575 22.519
579 H ARG 72 HN ARG 72 35.296 37.574 24.655
580 HA ARG 72 HA ARG 72 35.675 40.182 25.878
581 HB2 ARG 72 HB2 ARG 72 33.201 39.796 25.993
582 HB3 ARG 72 HB1 ARG 72 33.521 38.347 26.950
583 HG2 ARG 72 HG2 ARG 72 34.714 39.728 28.626
584 HG3 ARG 72 HG1 ARG 72 34.352 41.173 27.680
585 HD2 ARG 72 HD2 ARG 72 31.900 40.565 27.891
586 HD3 ARG 72 HD1 ARG 72 32.383 39.331 29.052
587 HE ARG 72 HE ARG 72 33.418 41.939 29.704
588 HH11 ARG 72 HH21 ARG 72 30.699 39.809 29.858
589 HH12 ARG 72 HH22 ARG 72 30.010 40.565 31.256
590 HH21 ARG 72 HH11 ARG 72 32.524 42.936 31.540
591 HH22 ARG 72 HH12 ARG 72 31.046 42.333 32.211
592 H LEU 73 HN LEU 73 37.214 40.060 27.390
593 HA LEU 73 HA LEU 73 38.268 37.434 28.129
594 HB2 LEU 73 HB2 LEU 73 39.322 40.149 28.934
595 HB3 LEU 73 HB1 LEU 73 40.190 38.614 28.917
596 HG LEU 73 HG LEU 73 39.098 40.044 26.475
597 HD11 LEU 73 HD11 LEU 73 41.961 39.607 27.380
598 HD12 LEU 73 HD12 LEU 73 41.082 41.128 27.542
599 HD13 LEU 73 HD13 LEU 73 41.439 40.481 25.941
600 HD21 LEU 73 HD21 LEU 73 39.064 37.731 25.963
601 HD22 LEU 73 HD22 LEU 73 40.533 37.414 26.888
602 HD23 LEU 73 HD23 LEU 73 40.626 38.269 25.349
603 H ARG 74 HN ARG 74 38.850 36.986 30.380
604 HA ARG 74 HA ARG 74 36.626 37.465 32.140
605 HB2 ARG 74 HB2 ARG 74 39.279 36.062 32.537
606 HB3 ARG 74 HB1 ARG 74 38.020 36.143 33.770
607 HG2 ARG 74 HG2 ARG 74 36.433 35.051 32.219
608 HG3 ARG 74 HG1 ARG 74 37.699 34.957 30.995
609 HD2 ARG 74 HD2 ARG 74 39.072 33.590 32.549
610 HD3 ARG 74 HD1 ARG 74 37.765 33.642 33.726
611 HE ARG 74 HE ARG 74 36.706 32.655 31.323
612 HH11 ARG 74 HH21 ARG 74 39.026 31.822 33.754
613 HH12 ARG 74 HH22 ARG 74 38.841 30.113 33.541
614 HH21 ARG 74 HH11 ARG 74 36.454 30.409 31.046
615 HH22 ARG 74 HH12 ARG 74 37.385 29.314 32.013
616 H GLY 75 HN GLY 75 36.829 38.370 34.307
617 HA2 GLY 75 HA2 GLY 75 38.913 39.741 35.427
618 HA3 GLY 75 HA1 GLY 75 38.229 40.886 34.278
619 H GLY 76 HN GLY 76 36.035 41.566 34.550
620 HA2 GLY 76 HA2 GLY 76 34.659 40.855 37.034
621 HA3 GLY 76 HA1 GLY 76 35.184 42.530 36.875
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 27.013 23.782 1.786
2 H2 MET 1 HT2 MET 1 25.688 22.720 1.834
3 H3 MET 1 HT3 MET 1 26.694 22.887 3.192
4 HA MET 1 HA MET 1 24.941 24.996 2.056
5 HB2 MET 1 HB2 MET 1 23.816 24.709 4.331
6 HB3 MET 1 HB1 MET 1 23.573 23.393 3.182
7 HG2 MET 1 HG2 MET 1 25.432 22.138 4.255
8 HG3 MET 1 HG1 MET 1 25.612 23.440 5.430
9 HE1 MET 1 HE1 MET 1 24.598 22.322 7.978
10 HE2 MET 1 HE2 MET 1 25.662 21.508 6.833
11 HE3 MET 1 HE3 MET 1 24.283 20.647 7.509
12 H GLN 2 HN GLN 2 25.461 27.013 2.657
13 HA GLN 2 HA GLN 2 27.764 27.409 4.444
14 HB2 GLN 2 HB2 GLN 2 26.293 29.382 2.677
15 HB3 GLN 2 HB1 GLN 2 27.806 29.675 3.536
16 HG2 GLN 2 HG2 GLN 2 28.870 27.837 2.249
17 HG3 GLN 2 HG1 GLN 2 27.365 27.611 1.359
18 HE21 GLN 2 HE21 GLN 2 29.101 28.176 -0.460
19 HE22 GLN 2 HE22 GLN 2 29.210 29.822 -0.863
20 H ILE 3 HN ILE 3 27.599 29.474 5.829
21 HA ILE 3 HA ILE 3 24.911 29.976 6.891
22 HB ILE 3 HB ILE 3 25.777 29.599 9.235
23 HG12 ILE 3 HG12 ILE 3 27.905 27.943 7.853
24 HG13 ILE 3 HG11 ILE 3 28.211 29.580 8.431
25 HG21 ILE 3 HG21 ILE 3 25.322 27.219 9.175
26 HG22 ILE 3 HG22 ILE 3 25.724 27.144 7.460
27 HG23 ILE 3 HG23 ILE 3 24.284 28.013 7.991
28 HD11 ILE 3 HD11 ILE 3 27.113 27.375 10.191
29 HD12 ILE 3 HD12 ILE 3 27.695 28.961 10.700
30 HD13 ILE 3 HD13 ILE 3 28.829 27.764 10.075
31 H PHE 4 HN PHE 4 24.723 31.882 8.065
32 HA PHE 4 HA PHE 4 26.980 33.775 7.751
33 HB2 PHE 4 HB2 PHE 4 24.155 34.550 8.455
34 HB3 PHE 4 HB1 PHE 4 25.410 35.518 7.688
35 HD1 PHE 4 HD2 PHE 4 26.274 33.261 5.665
36 HD2 PHE 4 HD1 PHE 4 22.471 34.930 6.788
37 HE1 PHE 4 HE2 PHE 4 25.355 32.655 3.456
38 HE2 PHE 4 HE1 PHE 4 21.560 34.321 4.568
39 HZ PHE 4 HZ PHE 4 22.998 33.182 2.904
40 H VAL 5 HN VAL 5 28.024 34.488 9.478
41 HA VAL 5 HA VAL 5 26.968 33.808 12.162
42 HB VAL 5 HB VAL 5 29.305 33.948 12.890
43 HG11 VAL 5 HG11 VAL 5 29.140 32.266 10.381
44 HG12 VAL 5 HG12 VAL 5 28.285 31.840 11.861
45 HG13 VAL 5 HG13 VAL 5 30.046 31.918 11.855
46 HG21 VAL 5 HG21 VAL 5 30.246 35.592 11.469
47 HG22 VAL 5 HG22 VAL 5 29.723 34.745 10.016
48 HG23 VAL 5 HG23 VAL 5 31.032 34.087 10.995
49 H LYS 6 HN LYS 6 26.608 35.358 13.639
50 HA LYS 6 HA LYS 6 26.708 38.137 12.782
51 HB2 LYS 6 HB2 LYS 6 24.766 37.163 14.035
52 HB3 LYS 6 HB1 LYS 6 25.819 36.997 15.441
53 HG2 LYS 6 HG2 LYS 6 26.238 39.420 15.432
54 HG3 LYS 6 HG1 LYS 6 25.218 39.600 14.005
55 HD2 LYS 6 HD2 LYS 6 23.290 38.715 15.273
56 HD3 LYS 6 HD1 LYS 6 24.310 38.558 16.704
57 HE2 LYS 6 HE2 LYS 6 23.074 40.640 16.871
58 HE3 LYS 6 HE1 LYS 6 24.769 41.021 16.573
59 HZ1 LYS 6 HZ1 LYS 6 23.070 40.670 14.235
60 HZ2 LYS 6 HZ2 LYS 6 24.338 41.769 14.502
61 HZ3 LYS 6 HZ3 LYS 6 22.801 42.065 15.160
62 H GLY 7 HN GLY 7 28.518 39.284 13.014
63 HA2 GLY 7 HA2 GLY 7 30.500 38.555 15.049
64 HA3 GLY 7 HA1 GLY 7 30.724 39.700 13.732
65 H LEU 8 HN LEU 8 31.671 40.627 15.964
66 HA LEU 8 HA LEU 8 29.883 41.852 17.785
67 HB2 LEU 8 HB2 LEU 8 32.710 42.624 17.024
68 HB3 LEU 8 HB1 LEU 8 31.839 43.233 18.428
69 HG LEU 8 HG LEU 8 32.343 40.286 17.924
70 HD11 LEU 8 HD11 LEU 8 34.507 41.241 18.205
71 HD12 LEU 8 HD12 LEU 8 34.064 40.615 19.794
72 HD13 LEU 8 HD13 LEU 8 33.940 42.342 19.461
73 HD21 LEU 8 HD21 LEU 8 30.570 40.438 19.468
74 HD22 LEU 8 HD22 LEU 8 31.203 41.908 20.205
75 HD23 LEU 8 HD23 LEU 8 31.975 40.357 20.523
76 H THR 9 HN THR 9 31.440 43.016 14.829
77 HA THR 9 HA THR 9 30.321 45.661 15.051
78 HB THR 9 HB THR 9 31.188 45.870 12.683
79 HG1 THR 9 HG1 THR 9 31.100 43.299 12.787
80 HG21 THR 9 HG21 THR 9 33.543 45.824 13.380
81 HG22 THR 9 HG22 THR 9 33.122 44.820 14.768
82 HG23 THR 9 HG23 THR 9 32.534 46.480 14.669
83 H GLY 10 HN GLY 10 29.040 42.691 14.225
84 HA2 GLY 10 HA2 GLY 10 26.798 42.296 13.625
85 HA3 GLY 10 HA1 GLY 10 26.681 43.946 13.020
86 H LYS 11 HN LYS 11 29.509 42.990 11.810
87 HA LYS 11 HA LYS 11 28.534 42.655 9.158
88 HB2 LYS 11 HB2 LYS 11 31.269 42.211 10.378
89 HB3 LYS 11 HB1 LYS 11 30.938 42.098 8.649
90 HG2 LYS 11 HG2 LYS 11 30.127 44.423 8.640
91 HG3 LYS 11 HG1 LYS 11 30.431 44.541 10.373
92 HD2 LYS 11 HD2 LYS 11 32.838 44.078 9.965
93 HD3 LYS 11 HD1 LYS 11 32.518 44.035 8.231
94 HE2 LYS 11 HE2 LYS 11 31.745 46.358 8.285
95 HE3 LYS 11 HE1 LYS 11 31.974 46.413 10.032
96 HZ1 LYS 11 HZ1 LYS 11 34.156 46.713 9.803
97 HZ2 LYS 11 HZ2 LYS 11 33.828 47.098 8.180
98 HZ3 LYS 11 HZ3 LYS 11 34.300 45.521 8.606
99 H THR 12 HN THR 12 27.857 40.868 8.153
100 HA THR 12 HA THR 12 27.975 38.305 9.532
101 HB THR 12 HB THR 12 26.618 37.558 7.522
102 HG1 THR 12 HG1 THR 12 27.268 39.115 6.061
103 HG21 THR 12 HG21 THR 12 24.628 39.015 8.217
104 HG22 THR 12 HG22 THR 12 25.746 39.832 9.309
105 HG23 THR 12 HG23 THR 12 25.424 38.109 9.503
106 H THR 13 HN THR 13 29.233 36.602 9.003
107 HA THR 13 HA THR 13 31.008 36.874 6.629
108 HB THR 13 HB THR 13 31.562 36.057 9.455
109 HG1 THR 13 HG1 THR 13 33.488 37.190 8.907
110 HG21 THR 13 HG21 THR 13 33.728 35.007 8.539
111 HG22 THR 13 HG22 THR 13 32.862 34.861 7.010
112 HG23 THR 13 HG23 THR 13 32.260 34.033 8.445
113 H THR 14 HN THR 14 30.401 35.499 5.095
114 HA THR 14 HA THR 14 28.779 33.195 5.622
115 HB THR 14 HB THR 14 29.145 32.739 3.178
116 HG1 THR 14 HG1 THR 14 30.936 33.591 2.489
117 HG21 THR 14 HG21 THR 14 27.244 34.053 3.688
118 HG22 THR 14 HG22 THR 14 28.099 34.985 2.459
119 HG23 THR 14 HG23 THR 14 28.224 35.442 4.157
120 H LEU 15 HN LEU 15 29.472 31.323 6.365
121 HA LEU 15 HA LEU 15 32.277 30.486 5.864
122 HB2 LEU 15 HB2 LEU 15 30.432 30.249 8.210
123 HB3 LEU 15 HB1 LEU 15 31.584 28.943 7.952
124 HG LEU 15 HG LEU 15 32.569 31.792 7.858
125 HD11 LEU 15 HD11 LEU 15 33.064 31.518 10.351
126 HD12 LEU 15 HD12 LEU 15 31.880 30.210 10.344
127 HD13 LEU 15 HD13 LEU 15 31.386 31.852 9.930
128 HD21 LEU 15 HD21 LEU 15 34.633 30.775 8.586
129 HD22 LEU 15 HD22 LEU 15 33.990 29.774 7.284
130 HD23 LEU 15 HD23 LEU 15 33.815 29.259 8.961
131 H GLU 16 HN GLU 16 32.681 28.493 5.044
132 HA GLU 16 HA GLU 16 30.443 27.075 3.813
133 HB2 GLU 16 HB2 GLU 16 32.574 27.569 2.574
134 HB3 GLU 16 HB1 GLU 16 33.404 26.461 3.667
135 HG2 GLU 16 HG2 GLU 16 31.874 24.645 2.979
136 HG3 GLU 16 HG1 GLU 16 31.071 25.752 1.866
137 H VAL 17 HN VAL 17 29.468 25.419 4.803
138 HA VAL 17 HA VAL 17 31.042 23.612 6.520
139 HB VAL 17 HB VAL 17 29.283 23.654 8.247
140 HG11 VAL 17 HG11 VAL 17 30.247 26.468 7.696
141 HG12 VAL 17 HG12 VAL 17 31.318 25.193 8.276
142 HG13 VAL 17 HG13 VAL 17 29.952 25.714 9.263
143 HG21 VAL 17 HG21 VAL 17 27.637 25.557 8.159
144 HG22 VAL 17 HG22 VAL 17 27.378 24.337 6.911
145 HG23 VAL 17 HG23 VAL 17 28.159 25.865 6.503
146 H GLU 18 HN GLU 18 29.906 21.600 6.993
147 HA GLU 18 HA GLU 18 27.833 20.903 4.991
148 HB2 GLU 18 HB2 GLU 18 30.420 19.518 5.673
149 HB3 GLU 18 HB1 GLU 18 29.054 18.568 5.098
150 HG2 GLU 18 HG2 GLU 18 28.915 19.965 3.080
151 HG3 GLU 18 HG1 GLU 18 30.253 20.954 3.662
152 HA PRO 19 HA PRO 19 25.461 19.364 8.370
153 HB2 PRO 19 HB2 PRO 19 24.567 16.906 7.345
154 HB3 PRO 19 HB1 PRO 19 23.820 18.483 7.023
155 HG2 PRO 19 HG2 PRO 19 25.748 16.929 5.356
156 HG3 PRO 19 HG1 PRO 19 24.339 17.885 4.858
157 HD2 PRO 19 HD2 PRO 19 26.830 18.849 4.570
158 HD3 PRO 19 HD1 PRO 19 25.490 19.919 5.036
159 H SER 20 HN SER 20 27.717 17.048 6.912
160 HA SER 20 HA SER 20 27.880 15.423 9.300
161 HB2 SER 20 HB2 SER 20 29.551 15.472 6.778
162 HB3 SER 20 HB1 SER 20 29.730 14.290 8.071
163 HG SER 20 HG SER 20 27.702 14.619 6.188
164 H ASP 21 HN ASP 21 29.006 18.430 8.542
165 HA ASP 21 HA ASP 21 31.669 18.246 9.634
166 HB2 ASP 21 HB2 ASP 21 30.824 19.964 7.929
167 HB3 ASP 21 HB1 ASP 21 30.056 20.775 9.295
168 H THR 22 HN THR 22 32.224 18.277 11.705
169 HA THR 22 HA THR 22 30.204 18.681 13.760
170 HB THR 22 HB THR 22 31.961 17.965 15.302
171 HG1 THR 22 HG1 THR 22 34.017 17.411 14.296
172 HG21 THR 22 HG21 THR 22 31.610 16.392 12.752
173 HG22 THR 22 HG22 THR 22 30.899 16.098 14.340
174 HG23 THR 22 HG23 THR 22 32.610 15.775 14.066
175 H ILE 23 HN ILE 23 30.646 20.094 15.613
176 HA ILE 23 HA ILE 23 31.072 22.761 14.846
177 HB ILE 23 HB ILE 23 31.345 21.642 17.645
178 HG12 ILE 23 HG12 ILE 23 29.306 20.753 16.717
179 HG13 ILE 23 HG11 ILE 23 28.873 22.087 17.773
180 HG21 ILE 23 HG21 ILE 23 31.946 24.052 17.231
181 HG22 ILE 23 HG22 ILE 23 30.589 23.833 18.335
182 HG23 ILE 23 HG23 ILE 23 30.296 24.310 16.663
183 HD11 ILE 23 HD11 ILE 23 28.978 23.532 15.602
184 HD12 ILE 23 HD12 ILE 23 27.579 22.489 15.851
185 HD13 ILE 23 HD13 ILE 23 28.870 21.984 14.763
186 H GLU 24 HN GLU 24 33.248 20.407 16.369
187 HA GLU 24 HA GLU 24 35.397 21.969 17.058
188 HB2 GLU 24 HB2 GLU 24 35.308 19.510 17.357
189 HB3 GLU 24 HB1 GLU 24 35.542 19.304 15.620
190 HG2 GLU 24 HG2 GLU 24 37.714 20.424 15.746
191 HG3 GLU 24 HG1 GLU 24 37.477 20.740 17.464
192 H ASN 25 HN ASN 25 34.637 20.705 13.818
193 HA ASN 25 HA ASN 25 36.878 21.863 12.519
194 HB2 ASN 25 HB2 ASN 25 35.528 20.010 11.564
195 HB3 ASN 25 HB1 ASN 25 34.185 21.133 11.336
196 HD21 ASN 25 HD21 ASN 25 34.113 21.548 9.113
197 HD22 ASN 25 HD22 ASN 25 35.458 21.975 8.169
198 H VAL 26 HN VAL 26 33.529 22.962 12.978
199 HA VAL 26 HA VAL 26 33.633 25.275 11.418
200 HB VAL 26 HB VAL 26 32.120 24.874 14.012
201 HG11 VAL 26 HG11 VAL 26 32.033 27.184 13.449
202 HG12 VAL 26 HG12 VAL 26 30.539 26.504 12.808
203 HG13 VAL 26 HG13 VAL 26 31.891 26.841 11.726
204 HG21 VAL 26 HG21 VAL 26 31.504 24.184 11.127
205 HG22 VAL 26 HG22 VAL 26 30.258 24.287 12.370
206 HG23 VAL 26 HG23 VAL 26 31.546 23.094 12.510
207 H LYS 27 HN LYS 27 34.508 24.809 14.840
208 HA LYS 27 HA LYS 27 35.187 27.505 15.381
209 HB2 LYS 27 HB2 LYS 27 36.079 24.890 16.605
210 HB3 LYS 27 HB1 LYS 27 36.643 26.450 17.199
211 HG2 LYS 27 HG2 LYS 27 34.306 27.145 17.588
212 HG3 LYS 27 HG1 LYS 27 33.746 25.574 17.010
213 HD2 LYS 27 HD2 LYS 27 35.033 24.461 18.808
214 HD3 LYS 27 HD1 LYS 27 35.560 26.037 19.397
215 HE2 LYS 27 HE2 LYS 27 32.673 25.130 19.201
216 HE3 LYS 27 HE1 LYS 27 33.625 25.168 20.685
217 HZ1 LYS 27 HZ1 LYS 27 33.998 27.596 20.167
218 HZ2 LYS 27 HZ2 LYS 27 32.429 27.165 20.651
219 HZ3 LYS 27 HZ3 LYS 27 32.764 27.455 19.012
220 H ALA 28 HN ALA 28 36.963 24.804 13.984
221 HA ALA 28 HA ALA 28 39.537 26.002 14.027
222 HB1 ALA 28 HB1 ALA 28 38.939 23.541 13.623
223 HB2 ALA 28 HB2 ALA 28 40.208 24.225 12.610
224 HB3 ALA 28 HB3 ALA 28 38.580 24.019 11.965
225 H LYS 29 HN LYS 29 36.934 25.909 11.617
226 HA LYS 29 HA LYS 29 38.310 27.324 9.585
227 HB2 LYS 29 HB2 LYS 29 35.372 26.959 10.202
228 HB3 LYS 29 HB1 LYS 29 35.936 27.857 8.796
229 HG2 LYS 29 HG2 LYS 29 37.001 25.080 9.294
230 HG3 LYS 29 HG1 LYS 29 35.400 25.276 8.583
231 HD2 LYS 29 HD2 LYS 29 36.394 26.711 6.805
232 HD3 LYS 29 HD1 LYS 29 37.992 26.410 7.484
233 HE2 LYS 29 HE2 LYS 29 37.694 23.988 7.121
234 HE3 LYS 29 HE1 LYS 29 36.095 24.288 6.439
235 HZ1 LYS 29 HZ1 LYS 29 38.651 24.524 5.206
236 HZ2 LYS 29 HZ2 LYS 29 37.779 25.977 5.086
237 HZ3 LYS 29 HZ3 LYS 29 37.111 24.531 4.496
238 H ILE 30 HN ILE 30 36.160 28.343 12.206
239 HA ILE 30 HA ILE 30 36.070 31.090 11.590
240 HB ILE 30 HB ILE 30 35.787 29.592 14.198
241 HG12 ILE 30 HG12 ILE 30 33.691 30.986 12.532
242 HG13 ILE 30 HG11 ILE 30 34.119 29.294 12.280
243 HG21 ILE 30 HG21 ILE 30 35.458 32.527 13.563
244 HG22 ILE 30 HG22 ILE 30 36.395 31.795 14.865
245 HG23 ILE 30 HG23 ILE 30 34.632 31.769 14.924
246 HD11 ILE 30 HD11 ILE 30 33.442 28.706 14.499
247 HD12 ILE 30 HD12 ILE 30 32.149 29.702 13.840
248 HD13 ILE 30 HD13 ILE 30 33.304 30.394 14.976
249 H GLN 31 HN GLN 31 38.291 29.197 13.609
250 HA GLN 31 HA GLN 31 39.798 31.194 14.775
251 HB2 GLN 31 HB2 GLN 31 40.058 28.720 15.125
252 HB3 GLN 31 HB1 GLN 31 40.931 28.650 13.591
253 HG2 GLN 31 HG2 GLN 31 42.664 30.094 14.422
254 HG3 GLN 31 HG1 GLN 31 41.740 30.467 15.876
255 HE21 GLN 31 HE21 GLN 31 44.296 29.441 16.257
256 HE22 GLN 31 HE22 GLN 31 44.208 27.833 16.793
257 H ASP 32 HN ASP 32 39.364 30.644 11.484
258 HA ASP 32 HA ASP 32 41.937 31.668 10.598
259 HB2 ASP 32 HB2 ASP 32 39.408 31.264 8.986
260 HB3 ASP 32 HB1 ASP 32 41.045 31.454 8.364
261 H LYS 33 HN LYS 33 38.653 32.834 11.083
262 HA LYS 33 HA LYS 33 39.374 35.511 10.083
263 HB2 LYS 33 HB2 LYS 33 36.705 34.341 10.908
264 HB3 LYS 33 HB1 LYS 33 36.945 35.966 10.268
265 HG2 LYS 33 HG2 LYS 33 37.948 33.583 8.710
266 HG3 LYS 33 HG1 LYS 33 36.243 34.022 8.635
267 HD2 LYS 33 HD2 LYS 33 36.869 36.314 7.930
268 HD3 LYS 33 HD1 LYS 33 38.570 35.852 7.963
269 HE2 LYS 33 HE2 LYS 33 38.160 34.136 6.256
270 HE3 LYS 33 HE1 LYS 33 36.446 34.552 6.236
271 HZ1 LYS 33 HZ1 LYS 33 37.915 36.905 5.909
272 HZ2 LYS 33 HZ2 LYS 33 36.889 36.145 4.789
273 HZ3 LYS 33 HZ3 LYS 33 38.543 35.762 4.825
274 H THR 34 HN THR 34 39.430 33.848 12.971
275 HA THR 34 HA THR 34 39.080 36.346 14.549
276 HB THR 34 HB THR 34 38.410 34.913 16.437
277 HG1 THR 34 HG1 THR 34 37.896 32.694 15.846
278 HG21 THR 34 HG21 THR 34 36.848 34.627 13.865
279 HG22 THR 34 HG22 THR 34 36.588 35.789 15.166
280 HG23 THR 34 HG23 THR 34 36.223 34.083 15.422
281 H GLY 35 HN GLY 35 40.749 33.230 14.313
282 HA2 GLY 35 HA2 GLY 35 42.789 32.512 15.090
283 HA3 GLY 35 HA1 GLY 35 43.328 34.125 14.647
284 H LEU 36 HN LEU 36 41.686 32.367 17.280
285 HA LEU 36 HA LEU 36 43.434 33.605 19.216
286 HB2 LEU 36 HB2 LEU 36 41.202 34.229 20.577
287 HB3 LEU 36 HB1 LEU 36 41.979 35.373 19.488
288 HG LEU 36 HG LEU 36 40.463 34.733 17.678
289 HD11 LEU 36 HD11 LEU 36 39.961 32.457 18.003
290 HD12 LEU 36 HD12 LEU 36 38.450 33.249 18.441
291 HD13 LEU 36 HD13 LEU 36 39.549 32.688 19.701
292 HD21 LEU 36 HD21 LEU 36 39.786 36.504 19.279
293 HD22 LEU 36 HD22 LEU 36 38.989 35.286 20.274
294 HD23 LEU 36 HD23 LEU 36 38.387 35.631 18.654
295 HA PRO 37 HA PRO 37 43.205 29.790 21.389
296 HB2 PRO 37 HB2 PRO 37 42.027 31.352 23.677
297 HB3 PRO 37 HB1 PRO 37 43.323 30.138 23.697
298 HG2 PRO 37 HG2 PRO 37 43.849 32.765 23.801
299 HG3 PRO 37 HG1 PRO 37 44.915 31.626 22.960
300 HD2 PRO 37 HD2 PRO 37 43.122 33.690 21.807
301 HD3 PRO 37 HD1 PRO 37 44.528 32.882 21.079
302 HA PRO 38 HA PRO 38 38.970 28.489 20.930
303 HB2 PRO 38 HB2 PRO 38 38.934 26.164 22.363
304 HB3 PRO 38 HB1 PRO 38 39.796 26.321 20.818
305 HG2 PRO 38 HG2 PRO 38 40.877 26.456 23.603
306 HG3 PRO 38 HG1 PRO 38 41.537 25.627 22.180
307 HD2 PRO 38 HD2 PRO 38 42.469 28.057 23.027
308 HD3 PRO 38 HD1 PRO 38 42.477 27.572 21.317
309 H ASP 39 HN ASP 39 40.319 29.047 24.070
310 HA ASP 39 HA ASP 39 37.801 28.857 25.497
311 HB2 ASP 39 HB2 ASP 39 39.158 29.775 27.399
312 HB3 ASP 39 HB1 ASP 39 39.792 28.281 26.712
313 H GLN 40 HN GLN 40 38.913 30.984 23.318
314 HA GLN 40 HA GLN 40 37.719 33.360 24.643
315 HB2 GLN 40 HB2 GLN 40 39.819 33.100 22.481
316 HB3 GLN 40 HB1 GLN 40 38.971 34.613 22.800
317 HG2 GLN 40 HG2 GLN 40 39.711 34.476 25.182
318 HG3 GLN 40 HG1 GLN 40 40.651 33.041 24.773
319 HE21 GLN 40 HE21 GLN 40 42.506 34.551 25.534
320 HE22 GLN 40 HE22 GLN 40 43.192 35.573 24.366
321 H GLN 41 HN GLN 41 36.946 30.920 22.653
322 HA GLN 41 HA GLN 41 35.291 32.578 20.829
323 HB2 GLN 41 HB2 GLN 41 37.001 31.020 19.815
324 HB3 GLN 41 HB1 GLN 41 36.073 29.679 20.485
325 HG2 GLN 41 HG2 GLN 41 34.078 30.442 19.251
326 HG3 GLN 41 HG1 GLN 41 35.009 31.777 18.573
327 HE21 GLN 41 HE21 GLN 41 34.211 30.478 16.512
328 HE22 GLN 41 HE22 GLN 41 35.282 29.293 15.938
329 H ARG 42 HN ARG 42 33.124 32.158 20.633
330 HA ARG 42 HA ARG 42 31.914 30.037 22.289
331 HB2 ARG 42 HB2 ARG 42 31.981 32.254 23.551
332 HB3 ARG 42 HB1 ARG 42 30.896 32.881 22.314
333 HG2 ARG 42 HG2 ARG 42 29.332 32.142 23.871
334 HG3 ARG 42 HG1 ARG 42 29.490 30.688 22.888
335 HD2 ARG 42 HD2 ARG 42 31.123 29.770 24.480
336 HD3 ARG 42 HD1 ARG 42 31.034 31.243 25.442
337 HE ARG 42 HE ARG 42 29.091 29.095 25.389
338 HH11 ARG 42 HH21 ARG 42 29.706 32.441 26.013
339 HH12 ARG 42 HH22 ARG 42 28.407 32.612 27.145
340 HH21 ARG 42 HH11 ARG 42 27.375 29.314 26.863
341 HH22 ARG 42 HH12 ARG 42 27.082 30.844 27.619
342 H LEU 43 HN LEU 43 30.122 29.140 21.377
343 HA LEU 43 HA LEU 43 28.987 30.428 18.956
344 HB2 LEU 43 HB2 LEU 43 29.668 27.497 19.316
345 HB3 LEU 43 HB1 LEU 43 28.776 28.170 17.949
346 HG LEU 43 HG LEU 43 31.598 28.963 18.744
347 HD11 LEU 43 HD11 LEU 43 31.522 26.674 17.883
348 HD12 LEU 43 HD12 LEU 43 32.234 27.736 16.669
349 HD13 LEU 43 HD13 LEU 43 30.563 27.200 16.501
350 HD21 LEU 43 HD21 LEU 43 30.810 30.828 17.582
351 HD22 LEU 43 HD22 LEU 43 29.668 29.887 16.624
352 HD23 LEU 43 HD23 LEU 43 31.388 29.850 16.236
353 H ILE 44 HN ILE 44 26.906 30.775 19.171
354 HA ILE 44 HA ILE 44 25.231 28.843 20.653
355 HB ILE 44 HB ILE 44 25.224 31.848 21.036
356 HG12 ILE 44 HG12 ILE 44 25.541 29.622 23.067
357 HG13 ILE 44 HG11 ILE 44 26.909 30.441 22.315
358 HG21 ILE 44 HG21 ILE 44 23.361 31.229 22.697
359 HG22 ILE 44 HG22 ILE 44 23.265 29.692 21.840
360 HG23 ILE 44 HG23 ILE 44 22.937 31.199 20.986
361 HD11 ILE 44 HD11 ILE 44 26.466 31.544 24.420
362 HD12 ILE 44 HD12 ILE 44 24.753 31.700 24.030
363 HD13 ILE 44 HD13 ILE 44 25.951 32.628 23.128
364 H PHE 45 HN PHE 45 23.559 28.235 19.453
365 HA PHE 45 HA PHE 45 22.631 30.022 17.269
366 HB2 PHE 45 HB2 PHE 45 23.716 27.952 16.455
367 HB3 PHE 45 HB1 PHE 45 22.550 26.997 17.373
368 HD1 PHE 45 HD1 PHE 45 22.604 29.850 14.929
369 HD2 PHE 45 HD2 PHE 45 20.627 26.282 16.254
370 HE1 PHE 45 HE1 PHE 45 20.978 30.062 13.069
371 HE2 PHE 45 HE2 PHE 45 18.999 26.488 14.395
372 HZ PHE 45 HZ PHE 45 19.175 28.380 12.801
373 H ALA 46 HN ALA 46 20.706 30.870 17.698
374 HA ALA 46 HA ALA 46 18.550 31.124 18.432
375 HB1 ALA 46 HB1 ALA 46 18.319 28.986 17.072
376 HB2 ALA 46 HB2 ALA 46 17.098 29.247 18.317
377 HB3 ALA 46 HB3 ALA 46 18.418 28.114 18.601
378 H GLY 47 HN GLY 47 20.753 31.008 20.347
379 HA2 GLY 47 HA2 GLY 47 20.770 31.393 22.648
380 HA3 GLY 47 HA1 GLY 47 19.150 30.718 22.757
381 H LYS 48 HN LYS 48 20.493 28.409 21.042
382 HA LYS 48 HA LYS 48 21.103 26.775 23.385
383 HB2 LYS 48 HB2 LYS 48 19.657 25.968 21.463
384 HB3 LYS 48 HB1 LYS 48 21.124 25.911 20.487
385 HG2 LYS 48 HG2 LYS 48 22.143 24.310 21.984
386 HG3 LYS 48 HG1 LYS 48 20.822 24.477 23.140
387 HD2 LYS 48 HD2 LYS 48 19.247 23.596 21.426
388 HD3 LYS 48 HD1 LYS 48 20.610 23.348 20.333
389 HE2 LYS 48 HE2 LYS 48 21.645 21.807 21.935
390 HE3 LYS 48 HE1 LYS 48 20.331 22.087 23.078
391 HZ1 LYS 48 HZ1 LYS 48 18.778 21.192 21.465
392 HZ2 LYS 48 HZ2 LYS 48 19.993 20.056 21.814
393 HZ3 LYS 48 HZ3 LYS 48 20.036 20.931 20.359
394 H GLN 49 HN GLN 49 23.077 26.198 24.032
395 HA GLN 49 HA GLN 49 25.388 27.280 22.631
396 HB2 GLN 49 HB2 GLN 49 25.265 27.474 25.069
397 HB3 GLN 49 HB1 GLN 49 25.191 25.718 25.215
398 HG2 GLN 49 HG2 GLN 49 27.405 25.475 24.278
399 HG3 GLN 49 HG1 GLN 49 27.470 27.188 23.868
400 HE21 GLN 49 HE21 GLN 49 29.445 25.968 25.553
401 HE22 GLN 49 HE22 GLN 49 29.284 26.612 27.114
402 H LEU 50 HN LEU 50 26.781 26.181 21.415
403 HA LEU 50 HA LEU 50 26.244 23.380 20.817
404 HB2 LEU 50 HB2 LEU 50 28.407 25.142 19.661
405 HB3 LEU 50 HB1 LEU 50 27.705 23.685 18.962
406 HG LEU 50 HG LEU 50 26.300 26.332 19.403
407 HD11 LEU 50 HD11 LEU 50 26.800 24.810 16.834
408 HD12 LEU 50 HD12 LEU 50 27.893 26.058 17.435
409 HD13 LEU 50 HD13 LEU 50 26.231 26.470 17.011
410 HD21 LEU 50 HD21 LEU 50 24.624 24.713 19.807
411 HD22 LEU 50 HD22 LEU 50 25.293 23.594 18.619
412 HD23 LEU 50 HD23 LEU 50 24.453 25.050 18.085
413 H GLU 51 HN GLU 51 27.700 21.700 21.070
414 HA GLU 51 HA GLU 51 30.136 22.210 22.671
415 HB2 GLU 51 HB2 GLU 51 28.040 20.102 23.227
416 HB3 GLU 51 HB1 GLU 51 29.602 20.222 24.041
417 HG2 GLU 51 HG2 GLU 51 27.538 22.437 23.991
418 HG3 GLU 51 HG1 GLU 51 27.726 21.294 25.316
419 H ASP 52 HN ASP 52 31.809 20.696 22.363
420 HA ASP 52 HA ASP 52 31.921 19.530 19.767
421 HB2 ASP 52 HB2 ASP 52 34.077 18.521 20.638
422 HB3 ASP 52 HB1 ASP 52 33.976 20.277 20.716
423 H GLY 53 HN GLY 53 30.811 17.792 19.204
424 HA2 GLY 53 HA2 GLY 53 31.085 15.239 19.701
425 HA3 GLY 53 HA1 GLY 53 30.226 15.679 21.174
426 H ARG 54 HN ARG 54 29.206 17.764 18.854
427 HA ARG 54 HA ARG 54 27.030 16.025 17.850
428 HB2 ARG 54 HB2 ARG 54 26.796 18.675 19.278
429 HB3 ARG 54 HB1 ARG 54 25.519 18.074 18.222
430 HG2 ARG 54 HG2 ARG 54 25.314 16.043 19.568
431 HG3 ARG 54 HG1 ARG 54 26.668 16.546 20.580
432 HD2 ARG 54 HD2 ARG 54 24.567 17.061 21.713
433 HD3 ARG 54 HD1 ARG 54 25.381 18.557 21.264
434 HE ARG 54 HE ARG 54 23.637 17.880 19.175
435 HH11 ARG 54 HH21 ARG 54 23.557 18.730 22.528
436 HH12 ARG 54 HH22 ARG 54 22.028 19.539 22.430
437 HH21 ARG 54 HH11 ARG 54 21.624 18.931 19.040
438 HH22 ARG 54 HH12 ARG 54 20.931 19.647 20.456
439 H THR 55 HN THR 55 26.150 16.675 15.857
440 HA THR 55 HA THR 55 27.908 18.467 14.291
441 HB THR 55 HB THR 55 26.733 17.319 12.339
442 HG1 THR 55 HG1 THR 55 25.674 15.986 14.552
443 HG21 THR 55 HG21 THR 55 28.324 15.594 14.258
444 HG22 THR 55 HG22 THR 55 29.014 16.742 13.112
445 HG23 THR 55 HG23 THR 55 28.147 15.322 12.525
446 H LEU 56 HN LEU 56 26.495 19.314 12.281
447 HA LEU 56 HA LEU 56 24.811 21.329 13.341
448 HB2 LEU 56 HB2 LEU 56 24.952 20.380 10.474
449 HB3 LEU 56 HB1 LEU 56 24.428 21.962 11.043
450 HG LEU 56 HG LEU 56 27.209 20.807 11.392
451 HD11 LEU 56 HD11 LEU 56 27.892 22.448 9.729
452 HD12 LEU 56 HD12 LEU 56 26.249 23.081 9.630
453 HD13 LEU 56 HD13 LEU 56 26.604 21.453 9.050
454 HD21 LEU 56 HD21 LEU 56 25.877 23.356 12.304
455 HD22 LEU 56 HD22 LEU 56 27.611 23.335 11.979
456 HD23 LEU 56 HD23 LEU 56 26.934 22.271 13.208
457 H SER 57 HN SER 57 24.181 18.248 11.750
458 HA SER 57 HA SER 57 21.387 18.524 11.457
459 HB2 SER 57 HB2 SER 57 21.369 16.223 10.943
460 HB3 SER 57 HB1 SER 57 22.959 16.774 10.424
461 HG SER 57 HG SER 57 23.759 16.037 12.453
462 H ASP 58 HN ASP 58 23.344 17.948 14.234
463 HA ASP 58 HA ASP 58 21.228 16.718 15.805
464 HB2 ASP 58 HB2 ASP 58 24.021 17.671 16.436
465 HB3 ASP 58 HB1 ASP 58 22.917 17.125 17.693
466 H TYR 59 HN TYR 59 22.835 19.869 15.560
467 HA TYR 59 HA TYR 59 21.178 21.038 17.637
468 HB2 TYR 59 HB2 TYR 59 23.182 22.224 15.708
469 HB3 TYR 59 HB1 TYR 59 22.333 23.150 16.944
470 HD1 TYR 59 HD2 TYR 59 22.395 22.040 19.379
471 HD2 TYR 59 HD1 TYR 59 25.277 21.333 16.270
472 HE1 TYR 59 HE2 TYR 59 24.067 21.354 21.079
473 HE2 TYR 59 HE1 TYR 59 26.948 20.652 17.973
474 HH TYR 59 HH TYR 59 26.381 21.104 21.377
475 H ASN 60 HN ASN 60 20.608 20.136 14.560
476 HA ASN 60 HA ASN 60 18.916 20.577 13.058
477 HB2 ASN 60 HB2 ASN 60 17.629 20.884 15.280
478 HB3 ASN 60 HB1 ASN 60 17.806 22.612 14.990
479 HD21 ASN 60 HD21 ASN 60 15.507 22.911 14.592
480 HD22 ASN 60 HD22 ASN 60 14.769 22.320 13.182
481 H ILE 61 HN ILE 61 21.421 22.216 13.321
482 HA ILE 61 HA ILE 61 20.733 24.883 12.494
483 HB ILE 61 HB ILE 61 23.331 23.337 12.560
484 HG12 ILE 61 HG12 ILE 61 22.394 25.750 14.130
485 HG13 ILE 61 HG11 ILE 61 22.199 24.093 14.698
486 HG21 ILE 61 HG21 ILE 61 22.728 26.136 11.600
487 HG22 ILE 61 HG22 ILE 61 23.639 24.879 10.771
488 HG23 ILE 61 HG23 ILE 61 24.327 25.679 12.182
489 HD11 ILE 61 HD11 ILE 61 24.851 25.366 13.962
490 HD12 ILE 61 HD12 ILE 61 24.617 23.754 14.638
491 HD13 ILE 61 HD13 ILE 61 24.249 25.179 15.609
492 H GLN 62 HN GLN 62 20.330 25.607 10.501
493 HA GLN 62 HA GLN 62 20.819 23.791 8.198
494 HB2 GLN 62 HB2 GLN 62 18.686 25.925 8.430
495 HB3 GLN 62 HB1 GLN 62 18.856 24.715 7.159
496 HG2 GLN 62 HG2 GLN 62 18.478 22.921 8.803
497 HG3 GLN 62 HG1 GLN 62 18.323 24.121 10.085
498 HE21 GLN 62 HE21 GLN 62 16.078 22.883 10.153
499 HE22 GLN 62 HE22 GLN 62 14.843 23.566 9.208
500 H LYS 63 HN LYS 63 20.035 25.831 6.307
501 HA LYS 63 HA LYS 63 22.596 27.139 6.015
502 HB2 LYS 63 HB2 LYS 63 21.092 26.113 4.156
503 HB3 LYS 63 HB1 LYS 63 20.205 27.632 4.247
504 HG2 LYS 63 HG2 LYS 63 22.248 28.893 3.767
505 HG3 LYS 63 HG1 LYS 63 23.194 27.406 3.770
506 HD2 LYS 63 HD2 LYS 63 21.848 26.556 1.872
507 HD3 LYS 63 HD1 LYS 63 20.944 28.071 1.849
508 HE2 LYS 63 HE2 LYS 63 23.953 27.907 1.534
509 HE3 LYS 63 HE1 LYS 63 22.829 27.978 0.177
510 HZ1 LYS 63 HZ1 LYS 63 23.561 30.048 2.096
511 HZ2 LYS 63 HZ2 LYS 63 21.944 30.022 1.576
512 HZ3 LYS 63 HZ3 LYS 63 23.201 30.180 0.444
513 H GLU 64 HN GLU 64 22.947 29.372 5.838
514 HA GLU 64 HA GLU 64 22.776 31.557 6.501
515 HB2 GLU 64 HB2 GLU 64 19.780 31.265 6.369
516 HB3 GLU 64 HB1 GLU 64 20.762 32.694 6.053
517 HG2 GLU 64 HG2 GLU 64 21.802 31.316 4.125
518 HG3 GLU 64 HG1 GLU 64 20.428 30.233 4.339
519 H SER 65 HN SER 65 22.550 29.284 8.481
520 HA SER 65 HA SER 65 20.814 30.128 10.580
521 HB2 SER 65 HB2 SER 65 23.039 28.172 10.277
522 HB3 SER 65 HB1 SER 65 22.635 28.670 11.914
523 HG SER 65 HG SER 65 21.177 27.151 11.639
524 H THR 66 HN THR 66 21.043 31.814 11.940
525 HA THR 66 HA THR 66 23.457 33.398 11.870
526 HB THR 66 HB THR 66 20.772 33.683 13.214
527 HG1 THR 66 HG1 THR 66 20.790 35.550 11.844
528 HG21 THR 66 HG21 THR 66 21.682 36.014 13.842
529 HG22 THR 66 HG22 THR 66 23.285 35.312 13.612
530 HG23 THR 66 HG23 THR 66 22.201 34.653 14.837
531 H LEU 67 HN LEU 67 25.150 32.879 13.038
532 HA LEU 67 HA LEU 67 24.855 31.439 15.582
533 HB2 LEU 67 HB2 LEU 67 27.266 32.197 13.907
534 HB3 LEU 67 HB1 LEU 67 27.376 31.380 15.461
535 HG LEU 67 HG LEU 67 27.488 29.788 13.559
536 HD11 LEU 67 HD11 LEU 67 26.263 29.358 15.875
537 HD12 LEU 67 HD12 LEU 67 26.199 28.162 14.584
538 HD13 LEU 67 HD13 LEU 67 24.834 29.240 14.848
539 HD21 LEU 67 HD21 LEU 67 25.837 31.289 12.178
540 HD22 LEU 67 HD22 LEU 67 24.580 30.345 12.983
541 HD23 LEU 67 HD23 LEU 67 25.778 29.540 11.975
542 H HIS 68 HN HIS 68 26.870 32.337 17.101
543 HA HIS 68 HA HIS 68 26.743 35.268 17.262
544 HB2 HIS 68 HB2 HIS 68 26.000 33.505 19.603
545 HB3 HIS 68 HB1 HIS 68 26.004 35.267 19.559
546 HD2 HIS 68 HD2 HIS 68 24.184 36.126 17.195
547 HE1 HIS 68 HE1 HIS 68 21.492 33.027 18.177
548 HE2 HIS 68 HE2 HIS 68 21.765 35.193 16.880
549 H ILE 69 HN ILE 69 28.759 35.926 17.452
550 HA ILE 69 HA ILE 69 30.763 34.198 18.769
551 HB ILE 69 HB ILE 69 31.110 36.618 16.980
552 HG12 ILE 69 HG12 ILE 69 31.723 33.708 16.407
553 HG13 ILE 69 HG11 ILE 69 30.203 34.476 15.940
554 HG21 ILE 69 HG21 ILE 69 33.058 34.726 18.313
555 HG22 ILE 69 HG22 ILE 69 32.990 36.483 18.455
556 HG23 ILE 69 HG23 ILE 69 33.502 35.740 16.940
557 HD11 ILE 69 HD11 ILE 69 31.341 36.063 14.537
558 HD12 ILE 69 HD12 ILE 69 31.986 34.471 14.136
559 HD13 ILE 69 HD13 ILE 69 32.916 35.568 15.157
560 H VAL 70 HN VAL 70 30.980 34.620 20.873
561 HA VAL 70 HA VAL 70 30.738 37.415 21.828
562 HB VAL 70 HB VAL 70 30.762 34.901 23.502
563 HG11 VAL 70 HG11 VAL 70 29.626 37.658 24.038
564 HG12 VAL 70 HG12 VAL 70 31.235 37.155 24.549
565 HG13 VAL 70 HG13 VAL 70 29.810 36.338 25.193
566 HG21 VAL 70 HG21 VAL 70 28.885 34.675 22.010
567 HG22 VAL 70 HG22 VAL 70 28.464 36.377 22.189
568 HG23 VAL 70 HG23 VAL 70 28.248 35.268 23.542
569 H TRP 71 HN TRP 71 32.511 38.471 22.372
570 HA TRP 71 HA TRP 71 34.822 37.054 23.492
571 HB2 TRP 71 HB2 TRP 71 35.325 37.092 21.108
572 HB3 TRP 71 HB1 TRP 71 34.965 38.817 21.033
573 HD1 TRP 71 HD1 TRP 71 37.292 36.561 23.175
574 HE1 TRP 71 HE1 TRP 71 39.546 37.787 23.443
575 HE3 TRP 71 HE3 TRP 71 36.273 40.829 20.586
576 HZ2 TRP 71 HZ2 TRP 71 40.756 40.261 22.657
577 HZ3 TRP 71 HZ3 TRP 71 37.988 42.609 20.356
578 HH2 TRP 71 HH2 TRP 71 40.226 42.329 21.389
579 H ARG 72 HN ARG 72 35.029 38.078 25.377
580 HA ARG 72 HA ARG 72 35.474 40.958 25.395
581 HB2 ARG 72 HB2 ARG 72 33.007 40.701 25.667
582 HB3 ARG 72 HB1 ARG 72 33.303 39.734 27.113
583 HG2 ARG 72 HG2 ARG 72 34.326 41.579 28.248
584 HG3 ARG 72 HG1 ARG 72 34.393 42.536 26.767
585 HD2 ARG 72 HD2 ARG 72 32.528 43.295 28.158
586 HD3 ARG 72 HD1 ARG 72 31.916 42.552 26.686
587 HE ARG 72 HE ARG 72 31.045 40.802 27.970
588 HH11 ARG 72 HH21 ARG 72 33.139 42.846 29.813
589 HH12 ARG 72 HH22 ARG 72 32.691 42.163 31.340
590 HH21 ARG 72 HH11 ARG 72 30.448 39.901 29.965
591 HH22 ARG 72 HH12 ARG 72 31.166 40.491 31.427
592 H LEU 73 HN LEU 73 36.583 41.672 27.236
593 HA LEU 73 HA LEU 73 38.154 39.628 28.540
594 HB2 LEU 73 HB2 LEU 73 38.125 42.642 28.658
595 HB3 LEU 73 HB1 LEU 73 39.169 41.677 29.694
596 HG LEU 73 HG LEU 73 40.286 42.458 27.588
597 HD11 LEU 73 HD11 LEU 73 40.120 39.473 27.331
598 HD12 LEU 73 HD12 LEU 73 40.696 40.144 28.857
599 HD13 LEU 73 HD13 LEU 73 41.530 40.527 27.354
600 HD21 LEU 73 HD21 LEU 73 39.605 41.703 25.455
601 HD22 LEU 73 HD22 LEU 73 38.096 42.156 26.244
602 HD23 LEU 73 HD23 LEU 73 38.557 40.457 26.130
603 H ARG 74 HN ARG 74 37.993 38.910 30.599
604 HA ARG 74 HA ARG 74 35.564 39.454 32.048
605 HB2 ARG 74 HB2 ARG 74 36.627 37.207 32.006
606 HB3 ARG 74 HB1 ARG 74 37.996 37.865 32.904
607 HG2 ARG 74 HG2 ARG 74 36.525 38.469 34.766
608 HG3 ARG 74 HG1 ARG 74 35.119 37.903 33.865
609 HD2 ARG 74 HD2 ARG 74 36.057 35.625 33.826
610 HD3 ARG 74 HD1 ARG 74 37.466 36.185 34.720
611 HE ARG 74 HE ARG 74 34.946 36.730 36.038
612 HH11 ARG 74 HH21 ARG 74 37.516 34.480 35.494
613 HH12 ARG 74 HH22 ARG 74 37.265 33.624 36.979
614 HH21 ARG 74 HH11 ARG 74 34.604 35.606 37.983
615 HH22 ARG 74 HH12 ARG 74 35.618 34.260 38.387
616 H GLY 75 HN GLY 75 35.259 40.758 33.765
617 HA2 GLY 75 HA2 GLY 75 35.651 42.432 35.295
618 HA3 GLY 75 HA1 GLY 75 37.177 41.612 35.609
619 H GLY 76 HN GLY 76 38.465 43.411 35.793
620 HA2 GLY 76 HA2 GLY 76 39.577 44.520 33.460
621 HA3 GLY 76 HA1 GLY 76 38.423 45.674 34.123
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 26.091 23.633 1.955
2 H2 MET 1 HT2 MET 1 25.972 25.205 1.323
3 H3 MET 1 HT3 MET 1 24.732 24.079 1.044
4 HA MET 1 HA MET 1 23.890 25.453 2.710
5 HB2 MET 1 HB2 MET 1 23.668 23.015 3.159
6 HB3 MET 1 HB1 MET 1 25.165 23.073 4.091
7 HG2 MET 1 HG2 MET 1 24.153 24.708 5.634
8 HG3 MET 1 HG1 MET 1 22.658 24.671 4.699
9 HE1 MET 1 HE1 MET 1 24.526 21.451 7.320
10 HE2 MET 1 HE2 MET 1 24.367 23.128 7.836
11 HE3 MET 1 HE3 MET 1 25.320 22.741 6.405
12 H GLN 2 HN GLN 2 25.305 27.318 2.702
13 HA GLN 2 HA GLN 2 27.566 27.338 4.552
14 HB2 GLN 2 HB2 GLN 2 26.349 29.510 2.824
15 HB3 GLN 2 HB1 GLN 2 27.814 29.689 3.790
16 HG2 GLN 2 HG2 GLN 2 28.828 27.788 2.530
17 HG3 GLN 2 HG1 GLN 2 27.389 27.732 1.514
18 HE21 GLN 2 HE21 GLN 2 30.481 28.875 1.467
19 HE22 GLN 2 HE22 GLN 2 30.273 30.237 0.475
20 H ILE 3 HN ILE 3 27.640 29.441 5.969
21 HA ILE 3 HA ILE 3 25.039 30.135 7.118
22 HB ILE 3 HB ILE 3 25.876 29.665 9.428
23 HG12 ILE 3 HG12 ILE 3 27.983 27.997 8.013
24 HG13 ILE 3 HG11 ILE 3 28.311 29.575 8.724
25 HG21 ILE 3 HG21 ILE 3 25.354 27.294 9.342
26 HG22 ILE 3 HG22 ILE 3 25.750 27.232 7.624
27 HG23 ILE 3 HG23 ILE 3 24.341 28.140 8.174
28 HD11 ILE 3 HD11 ILE 3 28.782 27.502 10.186
29 HD12 ILE 3 HD12 ILE 3 27.031 27.377 10.347
30 HD13 ILE 3 HD13 ILE 3 27.869 28.821 10.915
31 H PHE 4 HN PHE 4 25.010 32.136 8.043
32 HA PHE 4 HA PHE 4 27.435 33.774 7.661
33 HB2 PHE 4 HB2 PHE 4 24.685 34.801 8.335
34 HB3 PHE 4 HB1 PHE 4 26.009 35.645 7.543
35 HD1 PHE 4 HD1 PHE 4 26.640 33.088 5.670
36 HD2 PHE 4 HD2 PHE 4 23.115 35.393 6.559
37 HE1 PHE 4 HE1 PHE 4 25.701 32.493 3.473
38 HE2 PHE 4 HE2 PHE 4 22.181 34.785 4.349
39 HZ PHE 4 HZ PHE 4 23.467 33.336 2.807
40 H VAL 5 HN VAL 5 28.671 34.175 9.320
41 HA VAL 5 HA VAL 5 27.737 33.778 12.055
42 HB VAL 5 HB VAL 5 30.264 34.671 12.398
43 HG11 VAL 5 HG11 VAL 5 29.732 32.498 13.135
44 HG12 VAL 5 HG12 VAL 5 30.988 32.233 11.932
45 HG13 VAL 5 HG13 VAL 5 29.297 31.954 11.516
46 HG21 VAL 5 HG21 VAL 5 31.671 34.274 10.537
47 HG22 VAL 5 HG22 VAL 5 30.301 35.159 9.868
48 HG23 VAL 5 HG23 VAL 5 30.409 33.411 9.658
49 H LYS 6 HN LYS 6 26.922 35.335 13.281
50 HA LYS 6 HA LYS 6 27.168 38.139 12.398
51 HB2 LYS 6 HB2 LYS 6 24.912 37.192 12.866
52 HB3 LYS 6 HB1 LYS 6 25.395 36.954 14.546
53 HG2 LYS 6 HG2 LYS 6 25.792 39.350 14.807
54 HG3 LYS 6 HG1 LYS 6 25.420 39.621 13.105
55 HD2 LYS 6 HD2 LYS 6 23.128 38.772 13.472
56 HD3 LYS 6 HD1 LYS 6 23.498 38.523 15.179
57 HE2 LYS 6 HE2 LYS 6 22.344 40.653 14.928
58 HE3 LYS 6 HE1 LYS 6 24.021 40.961 15.374
59 HZ1 LYS 6 HZ1 LYS 6 23.944 42.322 13.607
60 HZ2 LYS 6 HZ2 LYS 6 22.630 41.518 12.892
61 HZ3 LYS 6 HZ3 LYS 6 24.204 40.902 12.718
62 H GLY 7 HN GLY 7 28.767 39.290 13.248
63 HA2 GLY 7 HA2 GLY 7 29.981 38.544 15.794
64 HA3 GLY 7 HA1 GLY 7 30.540 39.799 14.691
65 H LEU 8 HN LEU 8 30.581 40.515 17.242
66 HA LEU 8 HA LEU 8 28.194 41.542 18.352
67 HB2 LEU 8 HB2 LEU 8 30.981 42.650 18.751
68 HB3 LEU 8 HB1 LEU 8 29.612 42.784 19.852
69 HG LEU 8 HG LEU 8 30.859 40.145 19.031
70 HD11 LEU 8 HD11 LEU 8 31.746 40.225 21.426
71 HD12 LEU 8 HD12 LEU 8 31.350 41.943 21.412
72 HD13 LEU 8 HD13 LEU 8 32.536 41.302 20.274
73 HD21 LEU 8 HD21 LEU 8 28.631 39.764 19.784
74 HD22 LEU 8 HD22 LEU 8 28.765 40.981 21.052
75 HD23 LEU 8 HD23 LEU 8 29.636 39.456 21.198
76 H THR 9 HN THR 9 30.688 43.031 16.307
77 HA THR 9 HA THR 9 28.738 45.010 15.379
78 HB THR 9 HB THR 9 30.224 46.900 15.823
79 HG1 THR 9 HG1 THR 9 32.022 45.054 16.052
80 HG21 THR 9 HG21 THR 9 29.868 47.068 18.179
81 HG22 THR 9 HG22 THR 9 29.918 45.316 18.380
82 HG23 THR 9 HG23 THR 9 28.553 46.071 17.557
83 H GLY 10 HN GLY 10 31.652 43.190 15.043
84 HA2 GLY 10 HA2 GLY 10 32.867 44.391 12.838
85 HA3 GLY 10 HA1 GLY 10 32.939 42.671 13.208
86 H LYS 11 HN LYS 11 32.985 42.776 10.717
87 HA LYS 11 HA LYS 11 30.349 43.107 9.485
88 HB2 LYS 11 HB2 LYS 11 32.918 42.199 8.179
89 HB3 LYS 11 HB1 LYS 11 31.478 42.846 7.393
90 HG2 LYS 11 HG2 LYS 11 31.824 44.999 8.598
91 HG3 LYS 11 HG1 LYS 11 33.318 44.349 9.276
92 HD2 LYS 11 HD2 LYS 11 34.188 44.001 6.976
93 HD3 LYS 11 HD1 LYS 11 32.713 44.721 6.327
94 HE2 LYS 11 HE2 LYS 11 33.223 46.797 7.649
95 HE3 LYS 11 HE1 LYS 11 34.769 46.074 8.097
96 HZ1 LYS 11 HZ1 LYS 11 35.499 47.025 6.231
97 HZ2 LYS 11 HZ2 LYS 11 33.937 47.239 5.595
98 HZ3 LYS 11 HZ3 LYS 11 34.729 45.745 5.428
99 H THR 12 HN THR 12 29.185 41.464 8.519
100 HA THR 12 HA THR 12 29.276 38.910 9.726
101 HB THR 12 HB THR 12 27.918 39.681 7.132
102 HG1 THR 12 HG1 THR 12 26.186 40.214 8.469
103 HG21 THR 12 HG21 THR 12 27.574 37.436 9.119
104 HG22 THR 12 HG22 THR 12 27.800 37.328 7.374
105 HG23 THR 12 HG23 THR 12 26.273 37.919 8.032
106 H THR 13 HN THR 13 29.497 36.832 8.502
107 HA THR 13 HA THR 13 31.206 36.868 6.152
108 HB THR 13 HB THR 13 32.211 36.026 8.866
109 HG1 THR 13 HG1 THR 13 33.989 37.181 7.295
110 HG21 THR 13 HG21 THR 13 32.762 34.116 7.582
111 HG22 THR 13 HG22 THR 13 34.205 35.126 7.504
112 HG23 THR 13 HG23 THR 13 33.087 35.078 6.140
113 H THR 14 HN THR 14 31.184 34.961 5.013
114 HA THR 14 HA THR 14 29.183 32.981 5.863
115 HB THR 14 HB THR 14 29.242 32.231 3.544
116 HG1 THR 14 HG1 THR 14 31.321 32.486 2.953
117 HG21 THR 14 HG21 THR 14 28.273 34.155 2.536
118 HG22 THR 14 HG22 THR 14 29.267 35.252 3.495
119 HG23 THR 14 HG23 THR 14 27.969 34.342 4.260
120 H LEU 15 HN LEU 15 29.652 30.744 5.893
121 HA LEU 15 HA LEU 15 32.511 29.976 5.823
122 HB2 LEU 15 HB2 LEU 15 30.531 29.548 8.057
123 HB3 LEU 15 HB1 LEU 15 31.970 28.549 7.889
124 HG LEU 15 HG LEU 15 32.289 31.547 7.835
125 HD11 LEU 15 HD11 LEU 15 32.487 31.586 10.285
126 HD12 LEU 15 HD12 LEU 15 31.998 29.892 10.361
127 HD13 LEU 15 HD13 LEU 15 30.856 31.114 9.802
128 HD21 LEU 15 HD21 LEU 15 34.438 30.981 8.875
129 HD22 LEU 15 HD22 LEU 15 34.209 30.015 7.417
130 HD23 LEU 15 HD23 LEU 15 33.951 29.292 9.004
131 H GLU 16 HN GLU 16 32.861 28.107 4.764
132 HA GLU 16 HA GLU 16 30.645 26.679 3.608
133 HB2 GLU 16 HB2 GLU 16 33.632 26.201 3.615
134 HB3 GLU 16 HB1 GLU 16 32.489 25.139 2.793
135 HG2 GLU 16 HG2 GLU 16 31.653 27.083 1.491
136 HG3 GLU 16 HG1 GLU 16 32.860 28.102 2.273
137 H VAL 17 HN VAL 17 29.476 25.233 4.710
138 HA VAL 17 HA VAL 17 30.851 23.356 6.526
139 HB VAL 17 HB VAL 17 29.197 23.687 8.272
140 HG11 VAL 17 HG11 VAL 17 31.255 25.197 8.063
141 HG12 VAL 17 HG12 VAL 17 29.943 25.806 9.069
142 HG13 VAL 17 HG13 VAL 17 30.161 26.428 7.434
143 HG21 VAL 17 HG21 VAL 17 27.240 24.267 7.002
144 HG22 VAL 17 HG22 VAL 17 28.035 25.680 6.309
145 HG23 VAL 17 HG23 VAL 17 27.606 25.659 8.020
146 H GLU 18 HN GLU 18 29.645 21.456 6.988
147 HA GLU 18 HA GLU 18 27.397 20.893 5.145
148 HB2 GLU 18 HB2 GLU 18 29.940 19.335 5.600
149 HB3 GLU 18 HB1 GLU 18 28.472 18.505 5.092
150 HG2 GLU 18 HG2 GLU 18 28.302 19.960 3.123
151 HG3 GLU 18 HG1 GLU 18 29.727 20.857 3.644
152 HA PRO 19 HA PRO 19 25.293 19.494 8.744
153 HB2 PRO 19 HB2 PRO 19 24.085 17.140 7.805
154 HB3 PRO 19 HB1 PRO 19 23.445 18.779 7.579
155 HG2 PRO 19 HG2 PRO 19 25.033 17.095 5.694
156 HG3 PRO 19 HG1 PRO 19 23.671 18.184 5.365
157 HD2 PRO 19 HD2 PRO 19 26.203 18.920 4.820
158 HD3 PRO 19 HD1 PRO 19 25.015 20.099 5.419
159 H SER 20 HN SER 20 27.654 17.525 7.205
160 HA SER 20 HA SER 20 27.763 15.581 9.407
161 HB2 SER 20 HB2 SER 20 29.376 14.404 8.042
162 HB3 SER 20 HB1 SER 20 27.989 14.825 7.040
163 HG SER 20 HG SER 20 30.600 15.791 7.013
164 H ASP 21 HN ASP 21 29.072 18.591 8.612
165 HA ASP 21 HA ASP 21 31.703 18.227 9.713
166 HB2 ASP 21 HB2 ASP 21 30.072 20.667 9.004
167 HB3 ASP 21 HB1 ASP 21 31.679 20.780 9.719
168 H THR 22 HN THR 22 32.249 18.148 11.800
169 HA THR 22 HA THR 22 30.270 18.597 13.852
170 HB THR 22 HB THR 22 32.024 17.880 15.389
171 HG1 THR 22 HG1 THR 22 33.613 18.382 13.131
172 HG21 THR 22 HG21 THR 22 32.493 15.670 14.426
173 HG22 THR 22 HG22 THR 22 32.077 16.270 12.821
174 HG23 THR 22 HG23 THR 22 30.835 16.156 14.068
175 H ILE 23 HN ILE 23 30.755 20.011 15.741
176 HA ILE 23 HA ILE 23 31.149 22.684 14.944
177 HB ILE 23 HB ILE 23 31.484 21.632 17.756
178 HG12 ILE 23 HG12 ILE 23 29.464 20.644 16.885
179 HG13 ILE 23 HG11 ILE 23 29.000 21.987 17.918
180 HG21 ILE 23 HG21 ILE 23 30.678 23.813 18.400
181 HG22 ILE 23 HG22 ILE 23 30.309 24.227 16.725
182 HG23 ILE 23 HG23 ILE 23 31.985 24.051 17.240
183 HD11 ILE 23 HD11 ILE 23 28.972 21.833 14.908
184 HD12 ILE 23 HD12 ILE 23 28.997 23.392 15.733
185 HD13 ILE 23 HD13 ILE 23 27.660 22.276 16.000
186 H GLU 24 HN GLU 24 33.368 20.244 16.125
187 HA GLU 24 HA GLU 24 35.519 21.863 16.898
188 HB2 GLU 24 HB2 GLU 24 35.373 19.374 17.201
189 HB3 GLU 24 HB1 GLU 24 35.724 19.199 15.481
190 HG2 GLU 24 HG2 GLU 24 37.849 20.381 15.764
191 HG3 GLU 24 HG1 GLU 24 37.497 20.643 17.471
192 H ASN 25 HN ASN 25 34.671 20.539 13.706
193 HA ASN 25 HA ASN 25 36.888 21.639 12.324
194 HB2 ASN 25 HB2 ASN 25 35.498 19.811 11.419
195 HB3 ASN 25 HB1 ASN 25 34.134 20.924 11.282
196 HD21 ASN 25 HD21 ASN 25 33.985 20.998 8.980
197 HD22 ASN 25 HD22 ASN 25 35.233 21.589 7.993
198 H VAL 26 HN VAL 26 33.588 22.788 12.912
199 HA VAL 26 HA VAL 26 33.640 25.098 11.335
200 HB VAL 26 HB VAL 26 32.239 24.705 13.990
201 HG11 VAL 26 HG11 VAL 26 31.809 26.613 11.676
202 HG12 VAL 26 HG12 VAL 26 32.209 27.029 13.342
203 HG13 VAL 26 HG13 VAL 26 30.627 26.354 12.958
204 HG21 VAL 26 HG21 VAL 26 31.093 24.274 11.225
205 HG22 VAL 26 HG22 VAL 26 30.424 23.764 12.774
206 HG23 VAL 26 HG23 VAL 26 31.855 22.964 12.127
207 H LYS 27 HN LYS 27 34.584 24.634 14.735
208 HA LYS 27 HA LYS 27 35.276 27.321 15.258
209 HB2 LYS 27 HB2 LYS 27 36.163 24.706 16.493
210 HB3 LYS 27 HB1 LYS 27 36.730 26.269 17.082
211 HG2 LYS 27 HG2 LYS 27 34.419 26.980 17.495
212 HG3 LYS 27 HG1 LYS 27 33.819 25.454 16.845
213 HD2 LYS 27 HD2 LYS 27 34.864 24.202 18.629
214 HD3 LYS 27 HD1 LYS 27 35.691 25.644 19.219
215 HE2 LYS 27 HE2 LYS 27 33.482 26.684 19.698
216 HE3 LYS 27 HE1 LYS 27 32.691 25.195 19.179
217 HZ1 LYS 27 HZ1 LYS 27 32.854 24.799 21.395
218 HZ2 LYS 27 HZ2 LYS 27 34.264 25.727 21.588
219 HZ3 LYS 27 HZ3 LYS 27 34.353 24.170 20.914
220 H ALA 28 HN ALA 28 37.062 24.634 13.839
221 HA ALA 28 HA ALA 28 39.636 25.806 13.902
222 HB1 ALA 28 HB1 ALA 28 38.690 23.952 11.721
223 HB2 ALA 28 HB2 ALA 28 38.977 23.372 13.361
224 HB3 ALA 28 HB3 ALA 28 40.298 24.084 12.435
225 H LYS 29 HN LYS 29 36.979 25.979 11.583
226 HA LYS 29 HA LYS 29 38.390 27.418 9.573
227 HB2 LYS 29 HB2 LYS 29 35.441 27.176 10.198
228 HB3 LYS 29 HB1 LYS 29 36.067 28.013 8.782
229 HG2 LYS 29 HG2 LYS 29 36.905 25.172 9.369
230 HG3 LYS 29 HG1 LYS 29 35.375 25.497 8.562
231 HD2 LYS 29 HD2 LYS 29 36.664 26.869 6.863
232 HD3 LYS 29 HD1 LYS 29 38.147 26.265 7.603
233 HE2 LYS 29 HE2 LYS 29 35.951 24.558 6.403
234 HE3 LYS 29 HE1 LYS 29 37.522 24.882 5.671
235 HZ1 LYS 29 HZ1 LYS 29 38.309 24.003 8.026
236 HZ2 LYS 29 HZ2 LYS 29 38.019 22.958 6.718
237 HZ3 LYS 29 HZ3 LYS 29 36.839 23.162 7.923
238 H ILE 30 HN ILE 30 36.299 28.370 12.245
239 HA ILE 30 HA ILE 30 36.226 31.134 11.760
240 HB ILE 30 HB ILE 30 35.987 29.501 14.281
241 HG12 ILE 30 HG12 ILE 30 33.874 30.994 12.720
242 HG13 ILE 30 HG11 ILE 30 34.276 29.305 12.413
243 HG21 ILE 30 HG21 ILE 30 35.634 32.471 13.845
244 HG22 ILE 30 HG22 ILE 30 36.633 31.667 15.056
245 HG23 ILE 30 HG23 ILE 30 34.876 31.614 15.187
246 HD11 ILE 30 HD11 ILE 30 33.490 28.600 14.505
247 HD12 ILE 30 HD12 ILE 30 32.330 29.852 14.072
248 HD13 ILE 30 HD13 ILE 30 33.625 30.210 15.213
249 H GLN 31 HN GLN 31 38.488 29.161 13.658
250 HA GLN 31 HA GLN 31 39.979 31.187 14.844
251 HB2 GLN 31 HB2 GLN 31 40.231 28.838 15.444
252 HB3 GLN 31 HB1 GLN 31 40.902 28.479 13.852
253 HG2 GLN 31 HG2 GLN 31 42.232 30.635 15.473
254 HG3 GLN 31 HG1 GLN 31 42.486 28.964 15.966
255 HE21 GLN 31 HE21 GLN 31 42.557 27.678 13.432
256 HE22 GLN 31 HE22 GLN 31 43.908 28.244 12.574
257 H ASP 32 HN ASP 32 39.582 30.688 11.566
258 HA ASP 32 HA ASP 32 42.234 31.811 10.865
259 HB2 ASP 32 HB2 ASP 32 40.113 30.515 9.142
260 HB3 ASP 32 HB1 ASP 32 41.623 31.193 8.540
261 H LYS 33 HN LYS 33 39.085 32.784 11.463
262 HA LYS 33 HA LYS 33 39.267 35.102 9.622
263 HB2 LYS 33 HB2 LYS 33 36.828 34.141 11.122
264 HB3 LYS 33 HB1 LYS 33 36.890 35.288 9.785
265 HG2 LYS 33 HG2 LYS 33 37.699 32.369 9.582
266 HG3 LYS 33 HG1 LYS 33 36.140 33.012 9.073
267 HD2 LYS 33 HD2 LYS 33 37.474 34.639 7.595
268 HD3 LYS 33 HD1 LYS 33 38.868 33.605 7.911
269 HE2 LYS 33 HE2 LYS 33 36.241 32.607 6.776
270 HE3 LYS 33 HE1 LYS 33 37.655 33.008 5.802
271 HZ1 LYS 33 HZ1 LYS 33 38.390 30.972 6.191
272 HZ2 LYS 33 HZ2 LYS 33 37.122 30.652 7.276
273 HZ3 LYS 33 HZ3 LYS 33 38.559 31.369 7.831
274 H THR 34 HN THR 34 38.875 34.138 12.990
275 HA THR 34 HA THR 34 38.977 36.993 13.804
276 HB THR 34 HB THR 34 37.839 36.400 15.797
277 HG1 THR 34 HG1 THR 34 39.072 34.409 16.037
278 HG21 THR 34 HG21 THR 34 36.510 36.384 13.618
279 HG22 THR 34 HG22 THR 34 35.769 35.539 14.977
280 HG23 THR 34 HG23 THR 34 36.574 34.624 13.704
281 H GLY 35 HN GLY 35 40.394 33.805 14.225
282 HA2 GLY 35 HA2 GLY 35 42.493 33.199 14.972
283 HA3 GLY 35 HA1 GLY 35 42.898 34.909 15.052
284 H LEU 36 HN LEU 36 40.079 33.818 16.753
285 HA LEU 36 HA LEU 36 41.297 34.562 19.281
286 HB2 LEU 36 HB2 LEU 36 38.518 33.806 18.407
287 HB3 LEU 36 HB1 LEU 36 38.915 33.896 20.121
288 HG LEU 36 HG LEU 36 39.606 36.203 18.297
289 HD11 LEU 36 HD11 LEU 36 37.200 35.677 17.934
290 HD12 LEU 36 HD12 LEU 36 37.422 37.212 18.772
291 HD13 LEU 36 HD13 LEU 36 36.935 35.778 19.674
292 HD21 LEU 36 HD21 LEU 36 39.198 37.465 20.438
293 HD22 LEU 36 HD22 LEU 36 40.503 36.292 20.567
294 HD23 LEU 36 HD23 LEU 36 38.920 35.926 21.248
295 HA PRO 37 HA PRO 37 42.210 30.355 20.448
296 HB2 PRO 37 HB2 PRO 37 42.280 30.574 23.169
297 HB3 PRO 37 HB1 PRO 37 43.537 31.273 22.127
298 HG2 PRO 37 HG2 PRO 37 41.185 32.607 23.408
299 HG3 PRO 37 HG1 PRO 37 42.865 33.163 23.290
300 HD2 PRO 37 HD2 PRO 37 40.905 34.069 21.613
301 HD3 PRO 37 HD1 PRO 37 42.603 33.924 21.108
302 HA PRO 38 HA PRO 38 38.417 28.244 21.246
303 HB2 PRO 38 HB2 PRO 38 39.217 26.240 23.028
304 HB3 PRO 38 HB1 PRO 38 39.413 26.174 21.266
305 HG2 PRO 38 HG2 PRO 38 41.400 26.941 23.361
306 HG3 PRO 38 HG1 PRO 38 41.629 25.987 21.883
307 HD2 PRO 38 HD2 PRO 38 42.405 28.565 22.008
308 HD3 PRO 38 HD1 PRO 38 41.725 27.883 20.514
309 H ASP 39 HN ASP 39 40.291 29.150 24.101
310 HA ASP 39 HA ASP 39 38.163 28.881 25.980
311 HB2 ASP 39 HB2 ASP 39 40.776 30.388 26.042
312 HB3 ASP 39 HB1 ASP 39 39.652 30.371 27.400
313 H GLN 40 HN GLN 40 38.466 30.969 23.442
314 HA GLN 40 HA GLN 40 36.711 32.985 24.731
315 HB2 GLN 40 HB2 GLN 40 39.032 33.441 22.848
316 HB3 GLN 40 HB1 GLN 40 37.788 34.651 23.151
317 HG2 GLN 40 HG2 GLN 40 38.333 34.729 25.497
318 HG3 GLN 40 HG1 GLN 40 39.418 33.348 25.342
319 HE21 GLN 40 HE21 GLN 40 41.386 34.428 25.908
320 HE22 GLN 40 HE22 GLN 40 42.041 35.689 24.979
321 H GLN 41 HN GLN 41 36.822 30.537 22.663
322 HA GLN 41 HA GLN 41 35.240 31.792 20.506
323 HB2 GLN 41 HB2 GLN 41 37.283 30.342 20.032
324 HB3 GLN 41 HB1 GLN 41 36.321 28.979 20.600
325 HG2 GLN 41 HG2 GLN 41 34.619 29.444 18.901
326 HG3 GLN 41 HG1 GLN 41 35.538 30.845 18.348
327 HE21 GLN 41 HE21 GLN 41 35.646 29.666 16.208
328 HE22 GLN 41 HE22 GLN 41 36.820 28.459 16.002
329 H ARG 42 HN ARG 42 33.325 31.967 21.861
330 HA ARG 42 HA ARG 42 32.021 29.401 22.546
331 HB2 ARG 42 HB2 ARG 42 32.150 31.202 24.283
332 HB3 ARG 42 HB1 ARG 42 31.165 32.220 23.234
333 HG2 ARG 42 HG2 ARG 42 29.366 30.532 23.272
334 HG3 ARG 42 HG1 ARG 42 30.348 29.510 24.323
335 HD2 ARG 42 HD2 ARG 42 29.455 32.326 24.999
336 HD3 ARG 42 HD1 ARG 42 28.682 30.860 25.596
337 HE ARG 42 HE ARG 42 31.246 31.950 26.452
338 HH11 ARG 42 HH21 ARG 42 29.093 29.238 26.332
339 HH12 ARG 42 HH22 ARG 42 29.807 28.439 27.693
340 HH21 ARG 42 HH11 ARG 42 32.184 30.905 28.232
341 HH22 ARG 42 HH12 ARG 42 31.556 29.381 28.767
342 H LEU 43 HN LEU 43 30.472 28.615 21.263
343 HA LEU 43 HA LEU 43 29.256 30.403 19.223
344 HB2 LEU 43 HB2 LEU 43 29.533 27.392 19.123
345 HB3 LEU 43 HB1 LEU 43 28.975 28.450 17.826
346 HG LEU 43 HG LEU 43 31.755 28.390 19.043
347 HD11 LEU 43 HD11 LEU 43 30.635 27.597 16.342
348 HD12 LEU 43 HD12 LEU 43 31.402 26.544 17.530
349 HD13 LEU 43 HD13 LEU 43 32.360 27.753 16.675
350 HD21 LEU 43 HD21 LEU 43 30.413 30.284 17.109
351 HD22 LEU 43 HD22 LEU 43 32.152 30.003 17.018
352 HD23 LEU 43 HD23 LEU 43 31.444 30.660 18.489
353 H ILE 44 HN ILE 44 27.138 30.681 19.230
354 HA ILE 44 HA ILE 44 25.398 28.807 20.708
355 HB ILE 44 HB ILE 44 25.521 31.806 21.070
356 HG12 ILE 44 HG12 ILE 44 25.511 29.650 23.184
357 HG13 ILE 44 HG11 ILE 44 27.008 30.208 22.438
358 HG21 ILE 44 HG21 ILE 44 23.534 31.328 22.642
359 HG22 ILE 44 HG22 ILE 44 23.363 29.811 21.759
360 HG23 ILE 44 HG23 ILE 44 23.199 31.348 20.911
361 HD11 ILE 44 HD11 ILE 44 24.998 32.003 23.815
362 HD12 ILE 44 HD12 ILE 44 26.546 32.500 23.130
363 HD13 ILE 44 HD13 ILE 44 26.504 31.434 24.536
364 H PHE 45 HN PHE 45 23.766 28.202 19.453
365 HA PHE 45 HA PHE 45 22.900 29.992 17.241
366 HB2 PHE 45 HB2 PHE 45 23.908 27.902 16.429
367 HB3 PHE 45 HB1 PHE 45 22.773 26.965 17.396
368 HD1 PHE 45 HD1 PHE 45 22.757 29.774 14.911
369 HD2 PHE 45 HD2 PHE 45 20.800 26.244 16.366
370 HE1 PHE 45 HE1 PHE 45 21.065 29.972 13.109
371 HE2 PHE 45 HE2 PHE 45 19.111 26.435 14.560
372 HZ PHE 45 HZ PHE 45 19.243 28.300 12.932
373 H ALA 46 HN ALA 46 20.902 30.780 17.447
374 HA ALA 46 HA ALA 46 18.759 31.108 18.213
375 HB1 ALA 46 HB1 ALA 46 18.392 29.027 16.917
376 HB2 ALA 46 HB2 ALA 46 17.328 29.134 18.319
377 HB3 ALA 46 HB3 ALA 46 18.743 28.084 18.366
378 H GLY 47 HN GLY 47 21.084 30.735 20.142
379 HA2 GLY 47 HA2 GLY 47 21.069 31.294 22.441
380 HA3 GLY 47 HA1 GLY 47 19.441 30.638 22.579
381 H LYS 48 HN LYS 48 20.765 28.331 20.848
382 HA LYS 48 HA LYS 48 21.310 26.643 23.155
383 HB2 LYS 48 HB2 LYS 48 21.295 26.032 20.189
384 HB3 LYS 48 HB1 LYS 48 21.457 24.836 21.475
385 HG2 LYS 48 HG2 LYS 48 19.264 25.438 22.364
386 HG3 LYS 48 HG1 LYS 48 19.100 26.717 21.159
387 HD2 LYS 48 HD2 LYS 48 19.221 25.024 19.357
388 HD3 LYS 48 HD1 LYS 48 19.348 23.752 20.573
389 HE2 LYS 48 HE2 LYS 48 17.151 24.380 21.482
390 HE3 LYS 48 HE1 LYS 48 17.022 25.679 20.296
391 HZ1 LYS 48 HZ1 LYS 48 16.617 24.240 18.621
392 HZ2 LYS 48 HZ2 LYS 48 16.023 23.276 19.888
393 HZ3 LYS 48 HZ3 LYS 48 17.584 23.009 19.274
394 H GLN 49 HN GLN 49 23.274 26.274 23.956
395 HA GLN 49 HA GLN 49 25.619 27.335 22.645
396 HB2 GLN 49 HB2 GLN 49 25.383 27.439 25.093
397 HB3 GLN 49 HB1 GLN 49 25.372 25.676 25.165
398 HG2 GLN 49 HG2 GLN 49 27.623 25.569 24.252
399 HG3 GLN 49 HG1 GLN 49 27.634 27.311 23.986
400 HE21 GLN 49 HE21 GLN 49 29.395 25.585 25.769
401 HE22 GLN 49 HE22 GLN 49 29.252 26.279 27.311
402 H LEU 50 HN LEU 50 27.061 26.281 21.438
403 HA LEU 50 HA LEU 50 26.574 23.478 20.780
404 HB2 LEU 50 HB2 LEU 50 28.700 25.295 19.652
405 HB3 LEU 50 HB1 LEU 50 28.025 23.839 18.930
406 HG LEU 50 HG LEU 50 26.575 26.455 19.409
407 HD11 LEU 50 HD11 LEU 50 28.151 26.279 17.439
408 HD12 LEU 50 HD12 LEU 50 26.471 26.589 17.001
409 HD13 LEU 50 HD13 LEU 50 27.141 24.967 16.829
410 HD21 LEU 50 HD21 LEU 50 24.748 25.153 18.081
411 HD22 LEU 50 HD22 LEU 50 24.930 24.802 19.798
412 HD23 LEU 50 HD23 LEU 50 25.614 23.707 18.597
413 H GLU 51 HN GLU 51 28.123 21.857 20.910
414 HA GLU 51 HA GLU 51 30.606 22.354 22.383
415 HB2 GLU 51 HB2 GLU 51 28.337 20.629 23.379
416 HB3 GLU 51 HB1 GLU 51 30.004 20.341 23.878
417 HG2 GLU 51 HG2 GLU 51 30.165 22.646 24.720
418 HG3 GLU 51 HG1 GLU 51 28.511 22.963 24.198
419 H ASP 52 HN ASP 52 32.110 20.595 22.202
420 HA ASP 52 HA ASP 52 32.101 19.341 19.670
421 HB2 ASP 52 HB2 ASP 52 33.731 18.609 22.115
422 HB3 ASP 52 HB1 ASP 52 34.098 18.172 20.448
423 H GLY 53 HN GLY 53 31.731 17.216 19.055
424 HA2 GLY 53 HA2 GLY 53 31.210 14.919 19.463
425 HA3 GLY 53 HA1 GLY 53 30.592 15.359 21.052
426 H ARG 54 HN ARG 54 29.631 17.549 18.657
427 HA ARG 54 HA ARG 54 27.118 16.118 18.067
428 HB2 ARG 54 HB2 ARG 54 27.422 18.818 19.385
429 HB3 ARG 54 HB1 ARG 54 25.956 18.370 18.510
430 HG2 ARG 54 HG2 ARG 54 25.674 16.400 19.954
431 HG3 ARG 54 HG1 ARG 54 27.162 16.801 20.811
432 HD2 ARG 54 HD2 ARG 54 26.199 18.873 21.626
433 HD3 ARG 54 HD1 ARG 54 24.753 18.631 20.650
434 HE ARG 54 HE ARG 54 24.987 16.388 22.283
435 HH11 ARG 54 HH21 ARG 54 24.624 19.815 22.597
436 HH12 ARG 54 HH22 ARG 54 23.758 19.725 24.093
437 HH21 ARG 54 HH11 ARG 54 23.849 16.263 24.245
438 HH22 ARG 54 HH12 ARG 54 23.318 17.715 25.026
439 H THR 55 HN THR 55 26.225 16.607 16.095
440 HA THR 55 HA THR 55 27.934 18.132 14.249
441 HB THR 55 HB THR 55 26.427 17.110 12.511
442 HG1 THR 55 HG1 THR 55 24.723 16.097 13.158
443 HG21 THR 55 HG21 THR 55 27.658 15.089 14.398
444 HG22 THR 55 HG22 THR 55 28.597 16.092 13.290
445 HG23 THR 55 HG23 THR 55 27.437 14.925 12.656
446 H LEU 56 HN LEU 56 26.594 19.295 12.467
447 HA LEU 56 HA LEU 56 25.196 21.444 13.696
448 HB2 LEU 56 HB2 LEU 56 25.327 20.597 10.796
449 HB3 LEU 56 HB1 LEU 56 24.719 22.145 11.364
450 HG LEU 56 HG LEU 56 27.523 21.133 11.930
451 HD11 LEU 56 HD11 LEU 56 28.323 22.451 10.118
452 HD12 LEU 56 HD12 LEU 56 26.766 23.253 9.911
453 HD13 LEU 56 HD13 LEU 56 26.953 21.559 9.461
454 HD21 LEU 56 HD21 LEU 56 26.033 23.708 12.448
455 HD22 LEU 56 HD22 LEU 56 27.784 23.734 12.242
456 HD23 LEU 56 HD23 LEU 56 27.066 22.784 13.537
457 H SER 57 HN SER 57 24.223 18.496 12.069
458 HA SER 57 HA SER 57 21.468 19.083 11.777
459 HB2 SER 57 HB2 SER 57 22.618 17.250 10.576
460 HB3 SER 57 HB1 SER 57 22.798 16.382 12.098
461 HG SER 57 HG SER 57 20.901 15.623 11.567
462 H ASP 58 HN ASP 58 23.348 18.299 14.551
463 HA ASP 58 HA ASP 58 21.176 17.160 16.086
464 HB2 ASP 58 HB2 ASP 58 23.931 18.151 16.828
465 HB3 ASP 58 HB1 ASP 58 22.785 17.548 18.016
466 H TYR 59 HN TYR 59 22.757 20.287 15.746
467 HA TYR 59 HA TYR 59 21.090 21.544 17.764
468 HB2 TYR 59 HB2 TYR 59 23.075 22.699 15.799
469 HB3 TYR 59 HB1 TYR 59 22.308 23.589 17.113
470 HD1 TYR 59 HD2 TYR 59 22.611 22.655 19.509
471 HD2 TYR 59 HD1 TYR 59 25.061 21.489 16.179
472 HE1 TYR 59 HE2 TYR 59 24.368 21.873 21.073
473 HE2 TYR 59 HE1 TYR 59 26.819 20.709 17.744
474 HH TYR 59 HH TYR 59 26.751 21.451 21.092
475 H ASN 60 HN ASN 60 20.448 20.507 14.743
476 HA ASN 60 HA ASN 60 18.801 20.968 13.213
477 HB2 ASN 60 HB2 ASN 60 17.760 23.081 15.096
478 HB3 ASN 60 HB1 ASN 60 16.861 22.103 13.938
479 HD21 ASN 60 HD21 ASN 60 16.306 22.268 16.825
480 HD22 ASN 60 HD22 ASN 60 16.519 20.702 17.447
481 H ILE 61 HN ILE 61 21.352 22.524 13.366
482 HA ILE 61 HA ILE 61 20.752 25.195 12.486
483 HB ILE 61 HB ILE 61 23.272 23.529 12.543
484 HG12 ILE 61 HG12 ILE 61 22.599 26.084 14.012
485 HG13 ILE 61 HG11 ILE 61 22.172 24.500 14.657
486 HG21 ILE 61 HG21 ILE 61 23.599 24.994 10.680
487 HG22 ILE 61 HG22 ILE 61 24.399 25.771 12.046
488 HG23 ILE 61 HG23 ILE 61 22.816 26.334 11.513
489 HD11 ILE 61 HD11 ILE 61 24.952 25.507 13.988
490 HD12 ILE 61 HD12 ILE 61 24.595 23.841 14.439
491 HD13 ILE 61 HD13 ILE 61 24.316 25.145 15.592
492 H GLN 62 HN GLN 62 20.426 25.927 10.473
493 HA GLN 62 HA GLN 62 20.757 24.040 8.200
494 HB2 GLN 62 HB2 GLN 62 18.732 26.274 8.481
495 HB3 GLN 62 HB1 GLN 62 18.845 25.111 7.159
496 HG2 GLN 62 HG2 GLN 62 18.432 23.268 8.757
497 HG3 GLN 62 HG1 GLN 62 18.274 24.446 10.060
498 HE21 GLN 62 HE21 GLN 62 16.081 24.638 10.535
499 HE22 GLN 62 HE22 GLN 62 14.846 24.773 9.377
500 H LYS 63 HN LYS 63 20.059 26.126 6.301
501 HA LYS 63 HA LYS 63 22.692 27.257 5.962
502 HB2 LYS 63 HB2 LYS 63 21.047 26.385 4.135
503 HB3 LYS 63 HB1 LYS 63 20.302 27.976 4.270
504 HG2 LYS 63 HG2 LYS 63 22.458 29.048 3.768
505 HG3 LYS 63 HG1 LYS 63 23.240 27.472 3.693
506 HD2 LYS 63 HD2 LYS 63 21.663 26.845 1.843
507 HD3 LYS 63 HD1 LYS 63 21.063 28.504 1.857
508 HE2 LYS 63 HE2 LYS 63 23.932 27.664 1.346
509 HE3 LYS 63 HE1 LYS 63 22.792 28.237 0.128
510 HZ1 LYS 63 HZ1 LYS 63 24.275 29.997 0.908
511 HZ2 LYS 63 HZ2 LYS 63 23.695 29.793 2.492
512 HZ3 LYS 63 HZ3 LYS 63 22.654 30.343 1.267
513 H GLU 64 HN GLU 64 23.069 29.531 5.551
514 HA GLU 64 HA GLU 64 23.132 31.685 6.351
515 HB2 GLU 64 HB2 GLU 64 20.124 31.651 6.226
516 HB3 GLU 64 HB1 GLU 64 21.235 32.970 5.856
517 HG2 GLU 64 HG2 GLU 64 22.113 31.484 3.956
518 HG3 GLU 64 HG1 GLU 64 20.690 30.483 4.235
519 H SER 65 HN SER 65 22.577 29.380 8.324
520 HA SER 65 HA SER 65 20.948 30.446 10.398
521 HB2 SER 65 HB2 SER 65 22.916 28.229 10.141
522 HB3 SER 65 HB1 SER 65 22.561 28.785 11.769
523 HG SER 65 HG SER 65 20.718 27.916 9.790
524 H THR 66 HN THR 66 21.381 31.952 11.920
525 HA THR 66 HA THR 66 23.922 33.346 11.795
526 HB THR 66 HB THR 66 21.323 33.826 13.250
527 HG1 THR 66 HG1 THR 66 21.052 35.225 11.703
528 HG21 THR 66 HG21 THR 66 22.492 36.050 13.890
529 HG22 THR 66 HG22 THR 66 23.998 35.174 13.615
530 HG23 THR 66 HG23 THR 66 22.868 34.620 14.849
531 H LEU 67 HN LEU 67 25.599 32.647 12.872
532 HA LEU 67 HA LEU 67 25.269 31.141 15.381
533 HB2 LEU 67 HB2 LEU 67 27.617 31.645 13.533
534 HB3 LEU 67 HB1 LEU 67 27.778 30.817 15.078
535 HG LEU 67 HG LEU 67 27.544 29.220 13.204
536 HD11 LEU 67 HD11 LEU 67 26.392 28.978 15.610
537 HD12 LEU 67 HD12 LEU 67 26.180 27.762 14.355
538 HD13 LEU 67 HD13 LEU 67 24.925 28.966 14.631
539 HD21 LEU 67 HD21 LEU 67 26.011 30.926 11.935
540 HD22 LEU 67 HD22 LEU 67 24.700 30.143 12.822
541 HD23 LEU 67 HD23 LEU 67 25.715 29.200 11.737
542 H HIS 68 HN HIS 68 25.147 32.411 17.158
543 HA HIS 68 HA HIS 68 26.292 35.049 17.228
544 HB2 HIS 68 HB2 HIS 68 25.112 33.370 19.454
545 HB3 HIS 68 HB1 HIS 68 25.527 35.075 19.575
546 HD2 HIS 68 HD2 HIS 68 23.980 36.744 17.662
547 HE1 HIS 68 HE1 HIS 68 20.834 33.938 17.442
548 HE2 HIS 68 HE2 HIS 68 21.518 36.324 16.902
549 H ILE 69 HN ILE 69 28.354 35.493 17.580
550 HA ILE 69 HA ILE 69 30.023 33.540 19.058
551 HB ILE 69 HB ILE 69 31.918 34.968 18.013
552 HG12 ILE 69 HG12 ILE 69 29.710 35.676 16.064
553 HG13 ILE 69 HG11 ILE 69 30.276 36.793 17.301
554 HG21 ILE 69 HG21 ILE 69 30.086 33.300 16.262
555 HG22 ILE 69 HG22 ILE 69 31.380 32.683 17.288
556 HG23 ILE 69 HG23 ILE 69 31.766 33.691 15.894
557 HD11 ILE 69 HD11 ILE 69 31.362 36.882 14.914
558 HD12 ILE 69 HD12 ILE 69 32.267 35.473 15.463
559 HD13 ILE 69 HD13 ILE 69 32.400 37.003 16.333
560 H VAL 70 HN VAL 70 30.261 34.022 21.126
561 HA VAL 70 HA VAL 70 30.010 36.793 22.044
562 HB VAL 70 HB VAL 70 30.520 34.385 23.784
563 HG11 VAL 70 HG11 VAL 70 28.866 36.881 24.235
564 HG12 VAL 70 HG12 VAL 70 30.561 36.737 24.704
565 HG13 VAL 70 HG13 VAL 70 29.351 35.689 25.440
566 HG21 VAL 70 HG21 VAL 70 27.886 35.308 22.591
567 HG22 VAL 70 HG22 VAL 70 28.031 34.144 23.907
568 HG23 VAL 70 HG23 VAL 70 28.675 33.756 22.312
569 H TRP 71 HN TRP 71 31.789 37.991 21.940
570 HA TRP 71 HA TRP 71 34.402 36.773 22.660
571 HB2 TRP 71 HB2 TRP 71 34.255 37.504 20.300
572 HB3 TRP 71 HB1 TRP 71 33.841 39.130 20.842
573 HD1 TRP 71 HD1 TRP 71 36.696 36.563 21.405
574 HE1 TRP 71 HE1 TRP 71 38.902 37.886 21.622
575 HE3 TRP 71 HE3 TRP 71 34.894 41.310 21.060
576 HZ2 TRP 71 HZ2 TRP 71 39.780 40.615 21.645
577 HZ3 TRP 71 HZ3 TRP 71 36.426 43.260 21.180
578 HH2 TRP 71 HH2 TRP 71 38.865 42.917 21.471
579 H ARG 72 HN ARG 72 34.915 37.352 24.674
580 HA ARG 72 HA ARG 72 35.303 40.075 25.381
581 HB2 ARG 72 HB2 ARG 72 32.827 39.966 25.614
582 HB3 ARG 72 HB1 ARG 72 33.024 38.682 26.806
583 HG2 ARG 72 HG2 ARG 72 34.301 40.172 28.258
584 HG3 ARG 72 HG1 ARG 72 34.234 41.452 27.047
585 HD2 ARG 72 HD2 ARG 72 31.785 40.206 28.323
586 HD3 ARG 72 HD1 ARG 72 32.531 41.700 28.883
587 HE ARG 72 HE ARG 72 32.032 41.957 26.129
588 HH11 ARG 72 HH21 ARG 72 30.354 41.620 29.139
589 HH12 ARG 72 HH22 ARG 72 28.943 42.470 28.603
590 HH21 ARG 72 HH11 ARG 72 30.185 43.072 25.423
591 HH22 ARG 72 HH12 ARG 72 28.845 43.290 26.500
592 H LEU 73 HN LEU 73 37.157 39.866 26.452
593 HA LEU 73 HA LEU 73 37.808 37.447 27.897
594 HB2 LEU 73 HB2 LEU 73 39.260 40.022 27.311
595 HB3 LEU 73 HB1 LEU 73 39.913 38.859 28.465
596 HG LEU 73 HG LEU 73 39.800 37.093 26.719
597 HD11 LEU 73 HD11 LEU 73 38.758 39.409 25.081
598 HD12 LEU 73 HD12 LEU 73 38.048 37.809 25.287
599 HD13 LEU 73 HD13 LEU 73 39.510 38.005 24.323
600 HD21 LEU 73 HD21 LEU 73 41.820 38.621 27.084
601 HD22 LEU 73 HD22 LEU 73 41.282 39.512 25.662
602 HD23 LEU 73 HD23 LEU 73 41.738 37.816 25.518
603 H ARG 74 HN ARG 74 38.023 37.183 30.077
604 HA ARG 74 HA ARG 74 36.304 38.631 31.771
605 HB2 ARG 74 HB2 ARG 74 38.565 36.713 32.346
606 HB3 ARG 74 HB1 ARG 74 37.518 37.375 33.603
607 HG2 ARG 74 HG2 ARG 74 35.549 36.423 32.530
608 HG3 ARG 74 HG1 ARG 74 36.524 35.859 31.171
609 HD2 ARG 74 HD2 ARG 74 37.782 34.375 32.648
610 HD3 ARG 74 HD1 ARG 74 36.906 34.983 34.047
611 HE ARG 74 HE ARG 74 35.126 33.933 32.063
612 HH11 ARG 74 HH21 ARG 74 37.352 33.113 34.580
613 HH12 ARG 74 HH22 ARG 74 36.577 31.614 34.969
614 HH21 ARG 74 HH11 ARG 74 34.101 31.965 32.566
615 HH22 ARG 74 HH12 ARG 74 34.737 30.964 33.828
616 H GLY 75 HN GLY 75 39.849 38.707 31.442
617 HA2 GLY 75 HA2 GLY 75 41.404 40.271 32.105
618 HA3 GLY 75 HA1 GLY 75 40.095 41.449 32.026
619 H GLY 76 HN GLY 76 40.502 42.575 33.897
620 HA2 GLY 76 HA2 GLY 76 39.448 41.707 36.312
621 HA3 GLY 76 HA1 GLY 76 41.172 41.359 36.386