Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
524012 | 2l6r RC | 17322 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 59.150 6.560 9.033
2 H2 MET 1 HT2 MET 1 58.132 5.893 10.219
3 H3 MET 1 HT3 MET 1 59.147 7.200 10.604
4 HA MET 1 HA MET 1 57.415 8.515 10.203
5 HB2 MET 1 HB2 MET 1 57.740 7.552 7.347
6 HB3 MET 1 HB1 MET 1 57.090 9.105 7.874
7 HG2 MET 1 HG2 MET 1 59.302 9.611 8.934
8 HG3 MET 1 HG1 MET 1 59.932 8.115 8.246
9 HE1 MET 1 HE1 MET 1 60.375 8.629 4.619
10 HE2 MET 1 HE2 MET 1 59.316 7.590 5.568
11 HE3 MET 1 HE3 MET 1 60.961 7.892 6.117
12 H VAL 2 HN VAL 2 55.111 8.675 9.464
13 HA VAL 2 HA VAL 2 53.638 6.320 10.157
14 HB VAL 2 HB VAL 2 52.633 8.724 8.605
15 HG11 VAL 2 HG11 VAL 2 51.307 6.604 10.315
16 HG12 VAL 2 HG12 VAL 2 51.009 6.952 8.612
17 HG13 VAL 2 HG13 VAL 2 50.505 8.104 9.849
18 HG21 VAL 2 HG21 VAL 2 52.049 9.630 10.847
19 HG22 VAL 2 HG22 VAL 2 53.792 9.442 10.650
20 HG23 VAL 2 HG23 VAL 2 52.879 8.267 11.597
21 H ARG 3 HN ARG 3 54.221 7.881 6.992
22 HA ARG 3 HA ARG 3 52.750 6.140 5.362
23 HB2 ARG 3 HB2 ARG 3 55.444 7.426 4.823
24 HB3 ARG 3 HB1 ARG 3 54.445 6.660 3.587
25 HG2 ARG 3 HG2 ARG 3 52.603 8.229 4.118
26 HG3 ARG 3 HG1 ARG 3 53.628 9.012 5.321
27 HD2 ARG 3 HD2 ARG 3 55.226 9.660 3.598
28 HD3 ARG 3 HD1 ARG 3 54.309 8.780 2.375
29 HE ARG 3 HE ARG 3 52.469 10.566 3.422
30 HH11 ARG 3 HH21 ARG 3 55.644 10.738 2.090
31 HH12 ARG 3 HH22 ARG 3 55.428 12.327 1.436
32 HH21 ARG 3 HH11 ARG 3 52.168 12.641 2.576
33 HH22 ARG 3 HH12 ARG 3 53.461 13.404 1.712
34 H GLN 4 HN GLN 4 55.974 5.677 6.767
35 HA GLN 4 HA GLN 4 56.727 3.321 5.408
36 HB2 GLN 4 HB2 GLN 4 58.072 4.688 7.123
37 HB3 GLN 4 HB1 GLN 4 57.223 3.759 8.359
38 HG2 GLN 4 HG2 GLN 4 58.014 1.657 7.245
39 HG3 GLN 4 HG1 GLN 4 58.970 2.649 6.143
40 HE21 GLN 4 HE21 GLN 4 58.957 1.167 9.257
41 HE22 GLN 4 HE22 GLN 4 60.378 1.883 9.847
42 H GLU 5 HN GLU 5 54.672 3.729 8.281
43 HA GLU 5 HA GLU 5 54.263 0.890 8.674
44 HB2 GLU 5 HB2 GLU 5 53.945 2.698 10.425
45 HB3 GLU 5 HB1 GLU 5 52.457 3.142 9.589
46 HG2 GLU 5 HG2 GLU 5 51.828 1.625 11.339
47 HG3 GLU 5 HG1 GLU 5 51.728 0.720 9.829
48 H GLU 6 HN GLU 6 52.236 3.471 7.233
49 HA GLU 6 HA GLU 6 50.050 1.830 6.540
50 HB2 GLU 6 HB2 GLU 6 50.814 4.517 6.084
51 HB3 GLU 6 HB1 GLU 6 50.567 3.856 4.470
52 HG2 GLU 6 HG2 GLU 6 48.454 4.722 5.203
53 HG3 GLU 6 HG1 GLU 6 48.338 2.965 5.295
54 H LEU 7 HN LEU 7 53.255 1.892 5.216
55 HA LEU 7 HA LEU 7 52.511 0.698 2.658
56 HB2 LEU 7 HB2 LEU 7 54.688 2.046 3.368
57 HB3 LEU 7 HB1 LEU 7 55.275 0.454 3.839
58 HG LEU 7 HG LEU 7 54.184 1.149 1.091
59 HD11 LEU 7 HD11 LEU 7 57.050 0.673 1.960
60 HD12 LEU 7 HD12 LEU 7 56.352 2.268 1.673
61 HD13 LEU 7 HD13 LEU 7 56.495 1.116 0.345
62 HD21 LEU 7 HD21 LEU 7 55.442 -1.080 0.600
63 HD22 LEU 7 HD22 LEU 7 53.872 -1.176 1.392
64 HD23 LEU 7 HD23 LEU 7 55.348 -1.346 2.341
65 H ALA 8 HN ALA 8 54.041 -0.503 5.658
66 HA ALA 8 HA ALA 8 54.231 -3.222 4.909
67 HB1 ALA 8 HB1 ALA 8 53.671 -2.067 7.660
68 HB2 ALA 8 HB2 ALA 8 55.267 -2.340 6.959
69 HB3 ALA 8 HB3 ALA 8 54.224 -3.711 7.338
70 H ALA 9 HN ALA 9 51.459 -1.319 5.804
71 HA ALA 9 HA ALA 9 49.734 -3.574 6.435
72 HB1 ALA 9 HB1 ALA 9 49.124 -1.474 7.403
73 HB2 ALA 9 HB2 ALA 9 47.910 -1.804 6.166
74 HB3 ALA 9 HB3 ALA 9 49.208 -0.654 5.844
75 H ALA 10 HN ALA 10 49.864 -1.299 3.653
76 HA ALA 10 HA ALA 10 47.991 -2.731 2.060
77 HB1 ALA 10 HB1 ALA 10 50.212 -0.803 1.435
78 HB2 ALA 10 HB2 ALA 10 48.473 -0.590 1.238
79 HB3 ALA 10 HB3 ALA 10 49.368 -1.619 0.118
80 H ARG 11 HN ARG 11 51.389 -3.202 2.702
81 HA ARG 11 HA ARG 11 51.888 -5.087 0.568
82 HB2 ARG 11 HB2 ARG 11 53.510 -3.762 2.240
83 HB3 ARG 11 HB1 ARG 11 53.342 -5.216 3.216
84 HG2 ARG 11 HG2 ARG 11 55.110 -5.955 1.945
85 HG3 ARG 11 HG1 ARG 11 53.848 -6.352 0.780
86 HD2 ARG 11 HD2 ARG 11 54.147 -4.053 -0.203
87 HD3 ARG 11 HD1 ARG 11 55.531 -3.835 0.867
88 HE ARG 11 HE ARG 11 56.079 -6.216 -0.446
89 HH11 ARG 11 HH21 ARG 11 55.236 -2.998 -1.352
90 HH12 ARG 11 HH22 ARG 11 56.112 -3.048 -2.846
91 HH21 ARG 11 HH11 ARG 11 57.229 -6.299 -2.390
92 HH22 ARG 11 HH12 ARG 11 57.240 -4.915 -3.433
93 H ALA 12 HN ALA 12 51.147 -5.462 4.098
94 HA ALA 12 HA ALA 12 51.066 -8.271 4.157
95 HB1 ALA 12 HB1 ALA 12 49.528 -8.033 6.082
96 HB2 ALA 12 HB2 ALA 12 49.271 -6.342 5.653
97 HB3 ALA 12 HB3 ALA 12 50.861 -6.884 6.190
98 H ALA 13 HN ALA 13 49.058 -6.070 2.602
99 HA ALA 13 HA ALA 13 46.711 -7.771 2.394
100 HB1 ALA 13 HB1 ALA 13 47.303 -5.551 0.446
101 HB2 ALA 13 HB2 ALA 13 46.907 -5.161 2.119
102 HB3 ALA 13 HB3 ALA 13 45.756 -6.054 1.127
103 H LEU 14 HN LEU 14 49.526 -7.027 0.300
104 HA LEU 14 HA LEU 14 48.601 -8.510 -1.929
105 HB2 LEU 14 HB2 LEU 14 51.098 -7.279 -1.201
106 HB3 LEU 14 HB1 LEU 14 51.444 -8.877 -1.829
107 HG LEU 14 HG LEU 14 49.636 -6.916 -3.275
108 HD11 LEU 14 HD11 LEU 14 51.941 -5.985 -2.953
109 HD12 LEU 14 HD12 LEU 14 51.529 -6.287 -4.637
110 HD13 LEU 14 HD13 LEU 14 52.581 -7.408 -3.773
111 HD21 LEU 14 HD21 LEU 14 49.703 -9.503 -3.709
112 HD22 LEU 14 HD22 LEU 14 51.253 -9.161 -4.474
113 HD23 LEU 14 HD23 LEU 14 49.779 -8.400 -5.081
114 H HIS 15 HN HIS 15 50.044 -9.558 1.085
115 HA HIS 15 HA HIS 15 50.453 -12.303 0.175
116 HB2 HIS 15 HB2 HIS 15 51.760 -11.287 2.048
117 HB3 HIS 15 HB1 HIS 15 50.281 -11.220 3.005
118 HD1 HIS 15 HD1 HIS 15 52.298 -13.844 1.097
119 HD2 HIS 15 HD2 HIS 15 49.856 -13.527 4.461
120 HE1 HIS 15 HE1 HIS 15 52.309 -16.120 2.207
121 H ASP 16 HN ASP 16 47.915 -10.487 1.798
122 HA ASP 16 HA ASP 16 46.339 -12.825 2.503
123 HB2 ASP 16 HB2 ASP 16 45.350 -9.983 2.220
124 HB3 ASP 16 HB1 ASP 16 44.688 -11.260 3.237
125 H LEU 17 HN LEU 17 46.770 -10.999 -0.399
126 HA LEU 17 HA LEU 17 44.153 -11.851 -1.508
127 HB2 LEU 17 HB2 LEU 17 46.391 -10.179 -2.688
128 HB3 LEU 17 HB1 LEU 17 44.877 -10.529 -3.501
129 HG LEU 17 HG LEU 17 44.990 -9.244 -0.764
130 HD11 LEU 17 HD11 LEU 17 46.210 -7.861 -2.452
131 HD12 LEU 17 HD12 LEU 17 44.750 -7.079 -1.849
132 HD13 LEU 17 HD13 LEU 17 44.750 -7.838 -3.439
133 HD21 LEU 17 HD21 LEU 17 42.797 -10.022 -1.121
134 HD22 LEU 17 HD22 LEU 17 42.855 -9.706 -2.852
135 HD23 LEU 17 HD23 LEU 17 42.704 -8.369 -1.719
136 H MET 18 HN MET 18 47.505 -12.805 -1.602
137 HA MET 18 HA MET 18 47.085 -14.486 -4.003
138 HB2 MET 18 HB2 MET 18 49.382 -13.395 -2.532
139 HB3 MET 18 HB1 MET 18 49.612 -15.102 -2.895
140 HG2 MET 18 HG2 MET 18 50.508 -13.810 -4.736
141 HG3 MET 18 HG1 MET 18 49.035 -14.601 -5.294
142 HE1 MET 18 HE1 MET 18 50.335 -12.548 -6.809
143 HE2 MET 18 HE2 MET 18 49.298 -11.159 -7.124
144 HE3 MET 18 HE3 MET 18 48.681 -12.788 -7.388
145 H THR 19 HN THR 19 46.546 -14.757 -0.678
146 HA THR 19 HA THR 19 47.173 -17.650 -0.551
147 HB THR 19 HB THR 19 46.083 -17.310 1.806
148 HG1 THR 19 HG1 THR 19 46.482 -14.969 2.319
149 HG21 THR 19 HG21 THR 19 48.201 -16.417 2.675
150 HG22 THR 19 HG22 THR 19 48.641 -15.859 1.060
151 HG23 THR 19 HG23 THR 19 48.506 -17.585 1.390
152 H GLY 20 HN GLY 20 44.614 -15.787 -1.674
153 HA2 GLY 20 HA2 GLY 20 42.797 -17.232 -2.708
154 HA3 GLY 20 HA1 GLY 20 42.636 -17.990 -1.128
155 H LYS 21 HN LYS 21 42.666 -15.806 0.584
156 HA LYS 21 HA LYS 21 40.024 -14.887 0.527
157 HB2 LYS 21 HB2 LYS 21 42.389 -13.350 1.644
158 HB3 LYS 21 HB1 LYS 21 40.702 -13.178 2.128
159 HG2 LYS 21 HG2 LYS 21 40.881 -15.776 2.615
160 HG3 LYS 21 HG1 LYS 21 42.609 -15.444 2.669
161 HD2 LYS 21 HD2 LYS 21 42.033 -15.118 4.905
162 HD3 LYS 21 HD1 LYS 21 41.887 -13.475 4.285
163 HE2 LYS 21 HE2 LYS 21 39.468 -13.757 4.018
164 HE3 LYS 21 HE1 LYS 21 39.586 -15.438 4.532
165 HZ1 LYS 21 HZ1 LYS 21 39.885 -14.862 6.681
166 HZ2 LYS 21 HZ2 LYS 21 39.023 -13.479 6.199
167 HZ3 LYS 21 HZ3 LYS 21 40.718 -13.431 6.314
168 H ARG 22 HN ARG 22 39.087 -13.802 -1.109
169 HA ARG 22 HA ARG 22 40.642 -12.144 -2.911
170 HB2 ARG 22 HB2 ARG 22 38.588 -13.719 -3.377
171 HB3 ARG 22 HB1 ARG 22 37.636 -12.308 -2.931
172 HG2 ARG 22 HG2 ARG 22 38.854 -10.982 -4.641
173 HG3 ARG 22 HG1 ARG 22 39.728 -12.435 -5.118
174 HD2 ARG 22 HD2 ARG 22 36.781 -11.846 -5.398
175 HD3 ARG 22 HD1 ARG 22 37.929 -12.306 -6.655
176 HE ARG 22 HE ARG 22 37.933 -14.471 -4.920
177 HH11 ARG 22 HH21 ARG 22 35.581 -12.642 -6.655
178 HH12 ARG 22 HH22 ARG 22 34.488 -13.975 -6.839
179 HH21 ARG 22 HH11 ARG 22 36.521 -16.218 -5.149
180 HH22 ARG 22 HH12 ARG 22 35.020 -15.999 -5.985
181 H VAL 23 HN VAL 23 38.076 -11.574 -0.490
182 HA VAL 23 HA VAL 23 38.162 -8.661 -0.987
183 HB VAL 23 HB VAL 23 36.800 -10.159 1.270
184 HG11 VAL 23 HG11 VAL 23 37.029 -7.712 1.564
185 HG12 VAL 23 HG12 VAL 23 35.344 -8.167 1.304
186 HG13 VAL 23 HG13 VAL 23 36.280 -7.459 -0.013
187 HG21 VAL 23 HG21 VAL 23 35.931 -9.567 -1.568
188 HG22 VAL 23 HG22 VAL 23 34.765 -9.871 -0.281
189 HG23 VAL 23 HG23 VAL 23 35.926 -11.120 -0.732
190 H ALA 24 HN ALA 24 39.308 -7.186 0.161
191 HA ALA 24 HA ALA 24 40.598 -8.000 2.733
192 HB1 ALA 24 HB1 ALA 24 42.703 -6.846 1.952
193 HB2 ALA 24 HB2 ALA 24 42.006 -6.799 0.333
194 HB3 ALA 24 HB3 ALA 24 42.345 -8.349 1.103
195 H THR 25 HN THR 25 41.095 -6.186 4.100
196 HA THR 25 HA THR 25 39.525 -3.714 3.409
197 HB THR 25 HB THR 25 40.578 -4.547 6.126
198 HG1 THR 25 HG1 THR 25 38.185 -5.114 6.256
199 HG21 THR 25 HG21 THR 25 38.251 -2.784 5.337
200 HG22 THR 25 HG22 THR 25 39.860 -2.169 5.717
201 HG23 THR 25 HG23 THR 25 38.919 -3.004 6.954
202 H VAL 26 HN VAL 26 40.521 -1.635 3.703
203 HA VAL 26 HA VAL 26 43.395 -1.575 4.415
204 HB VAL 26 HB VAL 26 43.110 -1.921 1.877
205 HG11 VAL 26 HG11 VAL 26 42.398 -0.083 0.551
206 HG12 VAL 26 HG12 VAL 26 42.408 1.020 1.923
207 HG13 VAL 26 HG13 VAL 26 41.172 -0.234 1.808
208 HG21 VAL 26 HG21 VAL 26 45.193 -1.103 2.900
209 HG22 VAL 26 HG22 VAL 26 44.553 0.540 2.916
210 HG23 VAL 26 HG23 VAL 26 44.888 -0.262 1.381
211 H GLN 27 HN GLN 27 43.792 0.151 5.656
212 HA GLN 27 HA GLN 27 41.715 2.209 6.017
213 HB2 GLN 27 HB2 GLN 27 44.446 1.909 7.318
214 HB3 GLN 27 HB1 GLN 27 43.181 3.024 7.831
215 HG2 GLN 27 HG2 GLN 27 42.660 0.053 7.653
216 HG3 GLN 27 HG1 GLN 27 43.385 0.767 9.093
217 HE21 GLN 27 HE21 GLN 27 41.300 0.050 10.181
218 HE22 GLN 27 HE22 GLN 27 39.939 1.056 10.058
219 H LYS 28 HN LYS 28 41.707 3.940 4.648
220 HA LYS 28 HA LYS 28 44.339 5.047 3.715
221 HB2 LYS 28 HB2 LYS 28 43.095 3.727 1.950
222 HB3 LYS 28 HB1 LYS 28 41.811 4.932 2.058
223 HG2 LYS 28 HG2 LYS 28 43.338 6.703 1.409
224 HG3 LYS 28 HG1 LYS 28 44.708 5.593 1.459
225 HD2 LYS 28 HD2 LYS 28 43.653 4.246 -0.345
226 HD3 LYS 28 HD1 LYS 28 42.341 5.422 -0.427
227 HE2 LYS 28 HE2 LYS 28 43.927 5.989 -2.156
228 HE3 LYS 28 HE1 LYS 28 44.075 7.199 -0.881
229 HZ1 LYS 28 HZ1 LYS 28 46.000 6.133 -0.041
230 HZ2 LYS 28 HZ2 LYS 28 46.220 6.285 -1.719
231 HZ3 LYS 28 HZ3 LYS 28 45.788 4.785 -1.049
232 H ASP 29 HN ASP 29 44.451 7.147 4.656
233 HA ASP 29 HA ASP 29 43.719 9.305 5.331
234 HB2 ASP 29 HB2 ASP 29 41.359 8.959 3.477
235 HB3 ASP 29 HB1 ASP 29 42.271 10.420 3.854
236 H GLY 30 HN GLY 30 42.819 6.977 6.816
237 HA2 GLY 30 HA2 GLY 30 41.386 6.606 8.639
238 HA3 GLY 30 HA1 GLY 30 40.766 8.239 8.401
239 H ARG 31 HN ARG 31 40.589 6.498 5.522
240 HA ARG 31 HA ARG 31 37.723 5.765 6.044
241 HB2 ARG 31 HB2 ARG 31 37.946 7.699 4.513
242 HB3 ARG 31 HB1 ARG 31 38.983 6.740 3.459
243 HG2 ARG 31 HG2 ARG 31 36.641 6.794 2.643
244 HG3 ARG 31 HG1 ARG 31 37.151 5.161 3.053
245 HD2 ARG 31 HD2 ARG 31 35.789 5.059 4.941
246 HD3 ARG 31 HD1 ARG 31 35.786 6.813 5.160
247 HE ARG 31 HE ARG 31 34.457 6.444 2.757
248 HH11 ARG 31 HH21 ARG 31 34.204 5.221 5.971
249 HH12 ARG 31 HH22 ARG 31 32.487 5.002 5.894
250 HH21 ARG 31 HH11 ARG 31 32.218 6.165 2.638
251 HH22 ARG 31 HH12 ARG 31 31.364 5.537 4.008
252 H ARG 32 HN ARG 32 37.187 3.723 5.648
253 HA ARG 32 HA ARG 32 39.266 1.824 4.789
254 HB2 ARG 32 HB2 ARG 32 36.473 1.555 5.909
255 HB3 ARG 32 HB1 ARG 32 37.411 0.160 5.378
256 HG2 ARG 32 HG2 ARG 32 39.201 0.734 6.952
257 HG3 ARG 32 HG1 ARG 32 38.318 2.175 7.455
258 HD2 ARG 32 HD2 ARG 32 36.388 0.555 8.040
259 HD3 ARG 32 HD1 ARG 32 37.601 -0.720 7.923
260 HE ARG 32 HE ARG 32 38.758 1.152 9.612
261 HH11 ARG 32 HH21 ARG 32 35.781 -0.580 9.447
262 HH12 ARG 32 HH22 ARG 32 35.562 -0.631 11.164
263 HH21 ARG 32 HH11 ARG 32 38.489 1.095 11.855
264 HH22 ARG 32 HH12 ARG 32 37.095 0.318 12.528
265 H VAL 33 HN VAL 33 39.114 0.457 3.008
266 HA VAL 33 HA VAL 33 36.775 0.669 1.185
267 HB VAL 33 HB VAL 33 39.630 1.202 0.280
268 HG11 VAL 33 HG11 VAL 33 37.043 0.753 -1.236
269 HG12 VAL 33 HG12 VAL 33 38.534 -0.177 -1.371
270 HG13 VAL 33 HG13 VAL 33 38.473 1.482 -1.965
271 HG21 VAL 33 HG21 VAL 33 37.126 2.891 0.476
272 HG22 VAL 33 HG22 VAL 33 38.433 3.311 -0.631
273 HG23 VAL 33 HG23 VAL 33 38.734 3.251 1.103
274 H GLU 34 HN GLU 34 36.496 -1.194 -0.035
275 HA GLU 34 HA GLU 34 38.250 -3.505 0.749
276 HB2 GLU 34 HB2 GLU 34 35.291 -3.233 0.224
277 HB3 GLU 34 HB1 GLU 34 36.070 -4.808 0.083
278 HG2 GLU 34 HG2 GLU 34 36.850 -4.690 2.379
279 HG3 GLU 34 HG1 GLU 34 36.256 -3.036 2.535
280 H PHE 35 HN PHE 35 39.709 -3.711 -0.986
281 HA PHE 35 HA PHE 35 38.614 -3.652 -3.758
282 HB2 PHE 35 HB2 PHE 35 41.378 -3.579 -2.558
283 HB3 PHE 35 HB1 PHE 35 41.199 -4.161 -4.207
284 HD1 PHE 35 HD2 PHE 35 39.361 -2.534 -5.590
285 HD2 PHE 35 HD1 PHE 35 42.043 -1.360 -2.442
286 HE1 PHE 35 HE2 PHE 35 39.302 -0.197 -6.403
287 HE2 PHE 35 HE1 PHE 35 41.992 0.971 -3.265
288 HZ PHE 35 HZ PHE 35 40.617 1.557 -5.245
289 H THR 36 HN THR 36 38.629 -5.535 -5.062
290 HA THR 36 HA THR 36 39.128 -8.108 -3.595
291 HB THR 36 HB THR 36 37.581 -9.129 -5.210
292 HG1 THR 36 HG1 THR 36 36.514 -7.050 -6.374
293 HG21 THR 36 HG21 THR 36 36.673 -8.015 -3.164
294 HG22 THR 36 HG22 THR 36 35.530 -8.051 -4.505
295 HG23 THR 36 HG23 THR 36 36.395 -6.563 -4.124
296 H ALA 37 HN ALA 37 40.143 -9.878 -5.041
297 HA ALA 37 HA ALA 37 42.528 -9.004 -6.251
298 HB1 ALA 37 HB1 ALA 37 40.934 -11.504 -6.883
299 HB2 ALA 37 HB2 ALA 37 42.198 -11.351 -5.664
300 HB3 ALA 37 HB3 ALA 37 42.604 -11.228 -7.372
301 H THR 38 HN THR 38 39.379 -8.648 -7.478
302 HA THR 38 HA THR 38 39.797 -8.921 -10.276
303 HB THR 38 HB THR 38 37.873 -7.364 -10.521
304 HG1 THR 38 HG1 THR 38 38.701 -6.219 -8.502
305 HG21 THR 38 HG21 THR 38 37.209 -9.130 -8.181
306 HG22 THR 38 HG22 THR 38 37.720 -9.866 -9.702
307 HG23 THR 38 HG23 THR 38 36.287 -8.840 -9.655
308 H SER 39 HN SER 39 40.761 -6.407 -8.044
309 HA SER 39 HA SER 39 41.961 -4.883 -10.344
310 HB2 SER 39 HB2 SER 39 41.388 -2.818 -9.326
311 HB3 SER 39 HB1 SER 39 39.928 -3.794 -9.203
312 HG SER 39 HG SER 39 41.799 -3.980 -7.143
313 H VAL 40 HN VAL 40 43.527 -6.766 -9.234
314 HA VAL 40 HA VAL 40 44.994 -5.723 -6.922
315 HB VAL 40 HB VAL 40 44.850 -8.124 -7.147
316 HG11 VAL 40 HG11 VAL 40 45.761 -9.332 -9.076
317 HG12 VAL 40 HG12 VAL 40 46.327 -7.829 -9.800
318 HG13 VAL 40 HG13 VAL 40 44.596 -8.144 -9.664
319 HG21 VAL 40 HG21 VAL 40 47.681 -7.388 -7.951
320 HG22 VAL 40 HG22 VAL 40 47.167 -8.680 -6.868
321 HG23 VAL 40 HG23 VAL 40 47.031 -6.994 -6.361
322 H SER 41 HN SER 41 45.060 -5.038 -10.265
323 HA SER 41 HA SER 41 47.902 -4.547 -10.534
324 HB2 SER 41 HB2 SER 41 47.228 -3.294 -12.577
325 HB3 SER 41 HB1 SER 41 46.516 -4.904 -12.513
326 HG SER 41 HG SER 41 45.331 -2.388 -12.043
327 H ASP 42 HN ASP 42 45.080 -2.440 -9.919
328 HA ASP 42 HA ASP 42 46.465 0.026 -9.806
329 HB2 ASP 42 HB2 ASP 42 44.594 0.853 -8.500
330 HB3 ASP 42 HB1 ASP 42 43.965 -0.267 -9.709
331 H LEU 43 HN LEU 43 46.097 -2.524 -7.301
332 HA LEU 43 HA LEU 43 47.219 -0.997 -5.165
333 HB2 LEU 43 HB2 LEU 43 46.008 -3.294 -5.102
334 HB3 LEU 43 HB1 LEU 43 47.582 -3.980 -5.485
335 HG LEU 43 HG LEU 43 48.538 -2.930 -3.445
336 HD11 LEU 43 HD11 LEU 43 45.794 -1.712 -3.323
337 HD12 LEU 43 HD12 LEU 43 47.348 -1.027 -2.853
338 HD13 LEU 43 HD13 LEU 43 46.541 -2.172 -1.792
339 HD21 LEU 43 HD21 LEU 43 47.545 -4.465 -1.902
340 HD22 LEU 43 HD22 LEU 43 47.406 -5.218 -3.492
341 HD23 LEU 43 HD23 LEU 43 46.004 -4.440 -2.760
342 H LYS 44 HN LYS 44 48.663 -2.927 -7.754
343 HA LYS 44 HA LYS 44 51.357 -2.836 -6.726
344 HB2 LYS 44 HB2 LYS 44 50.066 -3.483 -9.347
345 HB3 LYS 44 HB1 LYS 44 51.782 -3.086 -9.391
346 HG2 LYS 44 HG2 LYS 44 52.337 -4.876 -7.917
347 HG3 LYS 44 HG1 LYS 44 50.652 -5.133 -7.471
348 HD2 LYS 44 HD2 LYS 44 50.114 -6.021 -9.617
349 HD3 LYS 44 HD1 LYS 44 51.630 -5.449 -10.313
350 HE2 LYS 44 HE2 LYS 44 51.502 -7.481 -8.076
351 HE3 LYS 44 HE1 LYS 44 51.579 -7.926 -9.781
352 HZ1 LYS 44 HZ1 LYS 44 53.727 -7.546 -8.263
353 HZ2 LYS 44 HZ2 LYS 44 53.536 -5.978 -8.889
354 HZ3 LYS 44 HZ3 LYS 44 53.717 -7.300 -9.941
355 H LYS 45 HN LYS 45 49.541 -0.700 -8.935
356 HA LYS 45 HA LYS 45 51.797 1.016 -9.482
357 HB2 LYS 45 HB2 LYS 45 49.847 0.888 -10.963
358 HB3 LYS 45 HB1 LYS 45 48.814 1.516 -9.684
359 HG2 LYS 45 HG2 LYS 45 51.201 3.199 -10.315
360 HG3 LYS 45 HG1 LYS 45 50.009 3.093 -11.604
361 HD2 LYS 45 HD2 LYS 45 49.102 3.677 -8.788
362 HD3 LYS 45 HD1 LYS 45 49.771 4.971 -9.779
363 HE2 LYS 45 HE2 LYS 45 48.080 4.657 -11.467
364 HE3 LYS 45 HE1 LYS 45 47.508 3.178 -10.696
365 HZ1 LYS 45 HZ1 LYS 45 46.285 5.412 -10.286
366 HZ2 LYS 45 HZ2 LYS 45 47.533 5.685 -9.165
367 HZ3 LYS 45 HZ3 LYS 45 46.520 4.331 -9.000
368 H TYR 46 HN TYR 46 49.155 1.098 -7.122
369 HA TYR 46 HA TYR 46 49.658 3.686 -6.049
370 HB2 TYR 46 HB2 TYR 46 47.638 2.382 -5.541
371 HB3 TYR 46 HB1 TYR 46 48.611 1.184 -4.700
372 HD1 TYR 46 HD1 TYR 46 48.247 4.934 -4.682
373 HD2 TYR 46 HD2 TYR 46 48.538 1.319 -2.372
374 HE1 TYR 46 HE1 TYR 46 48.027 6.248 -2.593
375 HE2 TYR 46 HE2 TYR 46 48.316 2.634 -0.285
376 HH TYR 46 HH TYR 46 47.183 5.056 0.248
377 H ILE 47 HN ILE 47 50.841 0.490 -4.956
378 HA ILE 47 HA ILE 47 52.490 1.346 -2.844
379 HB ILE 47 HB ILE 47 52.988 -0.860 -4.864
380 HG12 ILE 47 HG12 ILE 47 51.957 -1.195 -2.042
381 HG13 ILE 47 HG11 ILE 47 50.847 -0.828 -3.360
382 HG21 ILE 47 HG21 ILE 47 55.068 -0.433 -3.777
383 HG22 ILE 47 HG22 ILE 47 54.364 -1.807 -2.927
384 HG23 ILE 47 HG23 ILE 47 54.285 -0.196 -2.214
385 HD11 ILE 47 HD11 ILE 47 52.816 -3.056 -3.765
386 HD12 ILE 47 HD12 ILE 47 51.186 -2.866 -4.402
387 HD13 ILE 47 HD13 ILE 47 51.420 -3.348 -2.724
388 H ALA 48 HN ALA 48 53.384 0.903 -6.274
389 HA ALA 48 HA ALA 48 56.038 1.774 -6.144
390 HB1 ALA 48 HB1 ALA 48 55.798 2.385 -8.522
391 HB2 ALA 48 HB2 ALA 48 54.044 2.313 -8.363
392 HB3 ALA 48 HB3 ALA 48 55.007 0.846 -8.184
393 H GLU 49 HN GLU 49 53.090 3.749 -6.441
394 HA GLU 49 HA GLU 49 54.338 6.256 -6.817
395 HB2 GLU 49 HB2 GLU 49 51.826 5.616 -6.896
396 HB3 GLU 49 HB1 GLU 49 51.840 5.903 -5.156
397 HG2 GLU 49 HG2 GLU 49 52.834 8.174 -5.630
398 HG3 GLU 49 HG1 GLU 49 52.541 7.872 -7.343
399 H LEU 50 HN LEU 50 54.013 4.297 -3.930
400 HA LEU 50 HA LEU 50 54.662 6.506 -2.117
401 HB2 LEU 50 HB2 LEU 50 54.828 3.542 -1.523
402 HB3 LEU 50 HB1 LEU 50 54.653 4.861 -0.367
403 HG LEU 50 HG LEU 50 52.614 3.966 -2.425
404 HD11 LEU 50 HD11 LEU 50 52.355 4.135 0.582
405 HD12 LEU 50 HD12 LEU 50 52.928 2.680 -0.232
406 HD13 LEU 50 HD13 LEU 50 51.307 3.289 -0.554
407 HD21 LEU 50 HD21 LEU 50 52.352 6.315 -2.369
408 HD22 LEU 50 HD22 LEU 50 52.770 6.414 -0.658
409 HD23 LEU 50 HD23 LEU 50 51.210 5.756 -1.149
410 H GLU 51 HN GLU 51 56.464 3.966 -3.794
411 HA GLU 51 HA GLU 51 58.895 4.313 -2.278
412 HB2 GLU 51 HB2 GLU 51 58.229 3.111 -4.964
413 HB3 GLU 51 HB1 GLU 51 59.914 3.318 -4.486
414 HG2 GLU 51 HG2 GLU 51 57.871 1.908 -2.748
415 HG3 GLU 51 HG1 GLU 51 58.904 1.062 -3.901
416 H VAL 52 HN VAL 52 57.426 6.026 -4.946
417 HA VAL 52 HA VAL 52 59.881 7.511 -5.584
418 HB VAL 52 HB VAL 52 57.031 8.055 -6.473
419 HG11 VAL 52 HG11 VAL 52 59.758 8.956 -7.431
420 HG12 VAL 52 HG12 VAL 52 58.411 9.965 -6.905
421 HG13 VAL 52 HG13 VAL 52 58.312 9.086 -8.431
422 HG21 VAL 52 HG21 VAL 52 57.692 6.808 -8.527
423 HG22 VAL 52 HG22 VAL 52 57.701 5.775 -7.097
424 HG23 VAL 52 HG23 VAL 52 59.220 6.384 -7.754
425 H GLN 53 HN GLN 53 57.021 7.910 -3.579
426 HA GLN 53 HA GLN 53 57.428 10.755 -3.143
427 HB2 GLN 53 HB2 GLN 53 55.196 9.800 -2.919
428 HB3 GLN 53 HB1 GLN 53 55.767 8.682 -1.679
429 HG2 GLN 53 HG2 GLN 53 56.194 10.461 -0.144
430 HG3 GLN 53 HG1 GLN 53 55.975 11.682 -1.396
431 HE21 GLN 53 HE21 GLN 53 53.928 8.808 -0.709
432 HE22 GLN 53 HE22 GLN 53 52.518 9.698 -0.391
433 H THR 54 HN THR 54 58.458 7.760 -1.612
434 HA THR 54 HA THR 54 59.513 9.162 0.757
435 HB THR 54 HB THR 54 60.567 6.746 1.075
436 HG1 THR 54 HG1 THR 54 60.180 5.749 -0.771
437 HG21 THR 54 HG21 THR 54 57.563 7.159 1.178
438 HG22 THR 54 HG22 THR 54 58.698 7.711 2.409
439 HG23 THR 54 HG23 THR 54 58.492 5.986 2.111
440 H GLY 55 HN GLY 55 60.450 9.460 -2.213
441 HA2 GLY 55 HA2 GLY 55 63.307 8.737 -1.952
442 HA3 GLY 55 HA1 GLY 55 62.540 9.436 -3.378
443 H MET 56 HN MET 56 61.579 11.752 -2.846
444 HA MET 56 HA MET 56 63.851 13.381 -2.033
445 HB2 MET 56 HB2 MET 56 61.010 14.075 -2.826
446 HB3 MET 56 HB1 MET 56 62.236 15.283 -2.448
447 HG2 MET 56 HG2 MET 56 62.215 14.971 -4.850
448 HG3 MET 56 HG1 MET 56 63.698 14.260 -4.218
449 HE1 MET 56 HE1 MET 56 60.166 13.898 -5.121
450 HE2 MET 56 HE2 MET 56 59.913 12.463 -4.131
451 HE3 MET 56 HE3 MET 56 59.966 12.316 -5.885
452 H THR 57 HN THR 57 63.793 14.943 -0.270
453 HA THR 57 HA THR 57 62.667 13.829 2.154
454 HB THR 57 HB THR 57 64.828 15.266 1.839
455 HG1 THR 57 HG1 THR 57 64.591 14.853 3.873
456 HG21 THR 57 HG21 THR 57 63.231 17.212 0.931
457 HG22 THR 57 HG22 THR 57 64.672 17.583 1.876
458 HG23 THR 57 HG23 THR 57 63.090 17.566 2.653
459 H GLN 58 HN GLN 58 60.790 14.744 -0.032
460 HA GLN 58 HA GLN 58 58.621 15.616 -0.066
461 HB2 GLN 58 HB2 GLN 58 58.788 14.831 2.460
462 HB3 GLN 58 HB1 GLN 58 58.866 16.561 2.786
463 HG2 GLN 58 HG2 GLN 58 56.767 16.874 1.482
464 HG3 GLN 58 HG1 GLN 58 56.673 15.127 1.259
465 HE21 GLN 58 HE21 GLN 58 54.696 16.738 2.721
466 HE22 GLN 58 HE22 GLN 58 54.708 16.191 4.327
467 H ARG 59 HN ARG 59 60.767 17.675 1.932
468 HA ARG 59 HA ARG 59 61.345 19.925 1.654
469 HB2 ARG 59 HB2 ARG 59 61.407 18.967 -0.842
470 HB3 ARG 59 HB1 ARG 59 60.010 20.022 -1.042
471 HG2 ARG 59 HG2 ARG 59 61.356 21.918 -0.136
472 HG3 ARG 59 HG1 ARG 59 62.755 20.850 -0.056
473 HD2 ARG 59 HD2 ARG 59 61.856 20.514 -2.683
474 HD3 ARG 59 HD1 ARG 59 61.604 22.232 -2.393
475 HE ARG 59 HE ARG 59 64.089 21.078 -2.981
476 HH11 ARG 59 HH21 ARG 59 62.729 22.947 -0.412
477 HH12 ARG 59 HH22 ARG 59 64.253 23.599 0.084
478 HH21 ARG 59 HH11 ARG 59 66.067 21.928 -2.346
479 HH22 ARG 59 HH12 ARG 59 66.137 23.027 -1.010
480 H ARG 60 HN ARG 60 58.293 19.701 -0.206
481 HA ARG 60 HA ARG 60 56.687 20.834 1.903
482 HB2 ARG 60 HB2 ARG 60 56.296 23.050 0.890
483 HB3 ARG 60 HB1 ARG 60 57.992 22.852 1.329
484 HG2 ARG 60 HG2 ARG 60 58.422 22.097 -1.044
485 HG3 ARG 60 HG1 ARG 60 56.772 22.580 -1.429
486 HD2 ARG 60 HD2 ARG 60 57.742 24.836 -0.136
487 HD3 ARG 60 HD1 ARG 60 59.166 24.272 -1.006
488 HE ARG 60 HE ARG 60 57.044 25.681 -2.183
489 HH11 ARG 60 HH21 ARG 60 58.644 22.654 -2.646
490 HH12 ARG 60 HH22 ARG 60 58.176 22.520 -4.305
491 HH21 ARG 60 HH11 ARG 60 56.446 25.518 -4.342
492 HH22 ARG 60 HH12 ARG 60 56.941 24.138 -5.265
493 H ARG 61 HN ARG 61 54.879 22.243 0.099
494 HA ARG 61 HA ARG 61 53.203 20.156 -0.743
495 HB2 ARG 61 HB2 ARG 61 53.433 22.873 -2.072
496 HB3 ARG 61 HB1 ARG 61 52.022 21.815 -2.074
497 HG2 ARG 61 HG2 ARG 61 51.942 21.995 0.420
498 HG3 ARG 61 HG1 ARG 61 53.262 23.162 0.342
499 HD2 ARG 61 HD2 ARG 61 51.829 24.555 -1.199
500 HD3 ARG 61 HD1 ARG 61 50.497 23.447 -0.864
501 HE ARG 61 HE ARG 61 51.362 24.224 1.652
502 HH11 ARG 61 HH21 ARG 61 50.396 25.798 -1.260
503 HH12 ARG 61 HH22 ARG 61 49.747 27.185 -0.451
504 HH21 ARG 61 HH11 ARG 61 50.521 26.027 2.724
505 HH22 ARG 61 HH12 ARG 61 49.818 27.316 1.804
506 H GLY 62 HN GLY 62 52.568 19.981 -3.248
507 HA2 GLY 62 HA2 GLY 62 54.807 18.704 -4.538
508 HA3 GLY 62 HA1 GLY 62 53.230 18.994 -5.276
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 56.386 10.857 11.288
2 H2 MET 1 HT2 MET 1 56.392 9.245 11.827
3 H3 MET 1 HT3 MET 1 54.943 10.130 11.806
4 HA MET 1 HA MET 1 55.336 10.349 9.303
5 HB2 MET 1 HB2 MET 1 57.156 8.049 10.073
6 HB3 MET 1 HB1 MET 1 56.597 8.349 8.427
7 HG2 MET 1 HG2 MET 1 57.654 10.540 8.414
8 HG3 MET 1 HG1 MET 1 58.111 10.366 10.107
9 HE1 MET 1 HE1 MET 1 59.043 10.029 6.563
10 HE2 MET 1 HE2 MET 1 58.260 8.456 6.683
11 HE3 MET 1 HE3 MET 1 59.994 8.548 6.389
12 H VAL 2 HN VAL 2 54.297 8.527 7.949
13 HA VAL 2 HA VAL 2 52.795 6.543 9.562
14 HB VAL 2 HB VAL 2 51.405 8.581 7.796
15 HG11 VAL 2 HG11 VAL 2 50.468 6.222 9.437
16 HG12 VAL 2 HG12 VAL 2 50.173 6.548 7.730
17 HG13 VAL 2 HG13 VAL 2 49.373 7.521 8.964
18 HG21 VAL 2 HG21 VAL 2 51.621 8.309 10.806
19 HG22 VAL 2 HG22 VAL 2 50.380 9.282 10.016
20 HG23 VAL 2 HG23 VAL 2 52.083 9.694 9.817
21 H ARG 3 HN ARG 3 53.499 7.943 6.372
22 HA ARG 3 HA ARG 3 52.442 5.936 4.717
23 HB2 ARG 3 HB2 ARG 3 55.079 7.396 4.356
24 HB3 ARG 3 HB1 ARG 3 54.169 6.579 3.084
25 HG2 ARG 3 HG2 ARG 3 52.285 8.105 3.403
26 HG3 ARG 3 HG1 ARG 3 53.119 8.889 4.745
27 HD2 ARG 3 HD2 ARG 3 54.937 9.571 3.209
28 HD3 ARG 3 HD1 ARG 3 54.077 8.812 1.868
29 HE ARG 3 HE ARG 3 52.220 10.572 2.929
30 HH11 ARG 3 HH21 ARG 3 55.481 10.747 1.821
31 HH12 ARG 3 HH22 ARG 3 55.348 12.388 1.280
32 HH21 ARG 3 HH11 ARG 3 52.029 12.712 2.229
33 HH22 ARG 3 HH12 ARG 3 53.394 13.499 1.511
34 H GLN 4 HN GLN 4 55.379 5.910 6.670
35 HA GLN 4 HA GLN 4 56.609 3.599 5.559
36 HB2 GLN 4 HB2 GLN 4 57.558 5.220 7.307
37 HB3 GLN 4 HB1 GLN 4 56.645 4.296 8.501
38 HG2 GLN 4 HG2 GLN 4 58.848 3.344 8.441
39 HG3 GLN 4 HG1 GLN 4 57.788 2.214 7.599
40 HE21 GLN 4 HE21 GLN 4 59.783 1.463 6.426
41 HE22 GLN 4 HE22 GLN 4 60.360 2.368 5.111
42 H GLU 5 HN GLU 5 54.349 3.884 8.316
43 HA GLU 5 HA GLU 5 54.124 1.037 8.709
44 HB2 GLU 5 HB2 GLU 5 52.380 3.366 9.549
45 HB3 GLU 5 HB1 GLU 5 52.056 1.698 10.027
46 HG2 GLU 5 HG2 GLU 5 53.338 2.763 11.793
47 HG3 GLU 5 HG1 GLU 5 54.376 1.589 10.984
48 H GLU 6 HN GLU 6 51.998 3.423 7.100
49 HA GLU 6 HA GLU 6 50.002 1.578 6.292
50 HB2 GLU 6 HB2 GLU 6 50.888 4.283 5.321
51 HB3 GLU 6 HB1 GLU 6 49.803 3.354 4.289
52 HG2 GLU 6 HG2 GLU 6 48.636 4.901 5.906
53 HG3 GLU 6 HG1 GLU 6 48.147 3.212 6.036
54 H LEU 7 HN LEU 7 53.263 1.940 5.158
55 HA LEU 7 HA LEU 7 52.772 0.774 2.533
56 HB2 LEU 7 HB2 LEU 7 54.751 2.149 2.829
57 HB3 LEU 7 HB1 LEU 7 55.296 1.147 4.168
58 HG LEU 7 HG LEU 7 55.718 -0.723 2.710
59 HD11 LEU 7 HD11 LEU 7 55.333 -0.319 0.169
60 HD12 LEU 7 HD12 LEU 7 54.221 0.947 0.688
61 HD13 LEU 7 HD13 LEU 7 53.936 -0.727 1.161
62 HD21 LEU 7 HD21 LEU 7 56.681 1.890 1.508
63 HD22 LEU 7 HD22 LEU 7 57.346 0.309 1.100
64 HD23 LEU 7 HD23 LEU 7 57.496 0.930 2.743
65 H ALA 8 HN ALA 8 54.181 -0.436 5.589
66 HA ALA 8 HA ALA 8 54.484 -3.135 4.696
67 HB1 ALA 8 HB1 ALA 8 54.641 -3.708 7.087
68 HB2 ALA 8 HB2 ALA 8 54.004 -2.120 7.517
69 HB3 ALA 8 HB3 ALA 8 55.579 -2.256 6.737
70 H ALA 9 HN ALA 9 51.708 -1.338 5.778
71 HA ALA 9 HA ALA 9 50.075 -3.657 6.417
72 HB1 ALA 9 HB1 ALA 9 49.439 -0.738 5.936
73 HB2 ALA 9 HB2 ALA 9 49.458 -1.601 7.474
74 HB3 ALA 9 HB3 ALA 9 48.194 -1.936 6.291
75 H ALA 10 HN ALA 10 50.011 -1.299 3.701
76 HA ALA 10 HA ALA 10 48.106 -2.723 2.152
77 HB1 ALA 10 HB1 ALA 10 49.463 -1.564 0.181
78 HB2 ALA 10 HB2 ALA 10 50.240 -0.719 1.519
79 HB3 ALA 10 HB3 ALA 10 48.499 -0.596 1.296
80 H ARG 11 HN ARG 11 51.514 -3.205 2.686
81 HA ARG 11 HA ARG 11 51.945 -5.042 0.493
82 HB2 ARG 11 HB2 ARG 11 53.609 -3.761 2.203
83 HB3 ARG 11 HB1 ARG 11 53.517 -5.297 3.053
84 HG2 ARG 11 HG2 ARG 11 55.269 -5.798 1.642
85 HG3 ARG 11 HG1 ARG 11 53.953 -6.251 0.566
86 HD2 ARG 11 HD2 ARG 11 54.090 -3.647 -0.072
87 HD3 ARG 11 HD1 ARG 11 55.754 -3.858 0.464
88 HE ARG 11 HE ARG 11 54.729 -4.674 -2.049
89 HH11 ARG 11 HH21 ARG 11 56.555 -5.992 0.571
90 HH12 ARG 11 HH22 ARG 11 57.171 -7.310 -0.361
91 HH21 ARG 11 HH11 ARG 11 55.547 -6.371 -3.270
92 HH22 ARG 11 HH12 ARG 11 56.612 -7.520 -2.531
93 H ALA 12 HN ALA 12 51.312 -5.482 4.034
94 HA ALA 12 HA ALA 12 51.218 -8.295 4.037
95 HB1 ALA 12 HB1 ALA 12 49.735 -8.086 6.011
96 HB2 ALA 12 HB2 ALA 12 49.488 -6.382 5.629
97 HB3 ALA 12 HB3 ALA 12 51.086 -6.957 6.106
98 H ALA 13 HN ALA 13 49.177 -6.051 2.593
99 HA ALA 13 HA ALA 13 46.815 -7.733 2.419
100 HB1 ALA 13 HB1 ALA 13 47.021 -5.118 2.209
101 HB2 ALA 13 HB2 ALA 13 45.829 -5.976 1.234
102 HB3 ALA 13 HB3 ALA 13 47.356 -5.466 0.513
103 H LEU 14 HN LEU 14 49.569 -6.965 0.262
104 HA LEU 14 HA LEU 14 48.553 -8.375 -1.978
105 HB2 LEU 14 HB2 LEU 14 51.072 -7.159 -1.309
106 HB3 LEU 14 HB1 LEU 14 51.402 -8.740 -1.990
107 HG LEU 14 HG LEU 14 49.540 -6.752 -3.324
108 HD11 LEU 14 HD11 LEU 14 51.390 -6.084 -4.731
109 HD12 LEU 14 HD12 LEU 14 52.473 -7.212 -3.919
110 HD13 LEU 14 HD13 LEU 14 51.845 -5.811 -3.052
111 HD21 LEU 14 HD21 LEU 14 49.665 -8.185 -5.183
112 HD22 LEU 14 HD22 LEU 14 49.588 -9.312 -3.832
113 HD23 LEU 14 HD23 LEU 14 51.135 -8.970 -4.602
114 H HIS 15 HN HIS 15 50.149 -9.519 0.934
115 HA HIS 15 HA HIS 15 50.499 -12.232 -0.082
116 HB2 HIS 15 HB2 HIS 15 51.905 -11.274 1.748
117 HB3 HIS 15 HB1 HIS 15 50.479 -11.242 2.786
118 HD1 HIS 15 HD1 HIS 15 50.324 -13.242 4.252
119 HD2 HIS 15 HD2 HIS 15 52.196 -14.149 0.638
120 HE1 HIS 15 HE1 HIS 15 50.936 -15.697 4.357
121 H ASP 16 HN ASP 16 48.053 -10.478 1.746
122 HA ASP 16 HA ASP 16 46.526 -12.849 2.445
123 HB2 ASP 16 HB2 ASP 16 45.533 -9.995 2.335
124 HB3 ASP 16 HB1 ASP 16 44.896 -11.317 3.309
125 H LEU 17 HN LEU 17 46.851 -11.023 -0.444
126 HA LEU 17 HA LEU 17 44.143 -11.770 -1.410
127 HB2 LEU 17 HB2 LEU 17 46.349 -10.086 -2.616
128 HB3 LEU 17 HB1 LEU 17 44.864 -10.477 -3.466
129 HG LEU 17 HG LEU 17 44.789 -9.251 -0.704
130 HD11 LEU 17 HD11 LEU 17 45.208 -7.870 -3.355
131 HD12 LEU 17 HD12 LEU 17 46.099 -7.650 -1.851
132 HD13 LEU 17 HD13 LEU 17 44.450 -7.044 -1.995
133 HD21 LEU 17 HD21 LEU 17 42.642 -10.014 -1.376
134 HD22 LEU 17 HD22 LEU 17 42.876 -9.488 -3.040
135 HD23 LEU 17 HD23 LEU 17 42.625 -8.298 -1.772
136 H MET 18 HN MET 18 47.494 -12.767 -1.792
137 HA MET 18 HA MET 18 46.791 -14.458 -4.128
138 HB2 MET 18 HB2 MET 18 49.337 -13.611 -2.780
139 HB3 MET 18 HB1 MET 18 49.351 -15.120 -3.689
140 HG2 MET 18 HG2 MET 18 48.864 -14.051 -5.722
141 HG3 MET 18 HG1 MET 18 48.199 -12.624 -4.929
142 HE1 MET 18 HE1 MET 18 49.605 -11.759 -7.003
143 HE2 MET 18 HE2 MET 18 50.717 -13.089 -7.314
144 HE3 MET 18 HE3 MET 18 51.352 -11.481 -6.973
145 H THR 19 HN THR 19 46.625 -14.719 -0.774
146 HA THR 19 HA THR 19 47.344 -17.589 -0.695
147 HB THR 19 HB THR 19 46.470 -17.266 1.752
148 HG1 THR 19 HG1 THR 19 45.570 -15.379 1.934
149 HG21 THR 19 HG21 THR 19 48.892 -15.725 0.771
150 HG22 THR 19 HG22 THR 19 48.854 -17.458 1.100
151 HG23 THR 19 HG23 THR 19 48.627 -16.306 2.416
152 H GLY 20 HN GLY 20 44.626 -15.815 -1.581
153 HA2 GLY 20 HA2 GLY 20 42.810 -17.435 -2.421
154 HA3 GLY 20 HA1 GLY 20 42.761 -18.028 -0.763
155 H LYS 21 HN LYS 21 42.803 -15.708 0.732
156 HA LYS 21 HA LYS 21 40.125 -14.833 0.626
157 HB2 LYS 21 HB2 LYS 21 42.485 -13.281 1.735
158 HB3 LYS 21 HB1 LYS 21 40.791 -13.057 2.168
159 HG2 LYS 21 HG2 LYS 21 40.909 -15.639 2.762
160 HG3 LYS 21 HG1 LYS 21 42.641 -15.332 2.853
161 HD2 LYS 21 HD2 LYS 21 42.017 -14.896 5.056
162 HD3 LYS 21 HD1 LYS 21 41.889 -13.281 4.364
163 HE2 LYS 21 HE2 LYS 21 39.887 -13.762 5.677
164 HE3 LYS 21 HE1 LYS 21 39.455 -13.685 3.969
165 HZ1 LYS 21 HZ1 LYS 21 40.260 -16.304 4.827
166 HZ2 LYS 21 HZ2 LYS 21 38.889 -15.824 3.945
167 HZ3 LYS 21 HZ3 LYS 21 38.886 -15.735 5.642
168 H ARG 22 HN ARG 22 39.186 -13.718 -0.998
169 HA ARG 22 HA ARG 22 40.780 -12.167 -2.867
170 HB2 ARG 22 HB2 ARG 22 38.756 -13.667 -3.385
171 HB3 ARG 22 HB1 ARG 22 37.769 -12.340 -2.774
172 HG2 ARG 22 HG2 ARG 22 38.745 -10.824 -4.418
173 HG3 ARG 22 HG1 ARG 22 39.801 -12.105 -5.006
174 HD2 ARG 22 HD2 ARG 22 37.951 -12.042 -6.521
175 HD3 ARG 22 HD1 ARG 22 37.681 -13.445 -5.488
176 HE ARG 22 HE ARG 22 36.338 -11.399 -4.189
177 HH11 ARG 22 HH21 ARG 22 36.399 -12.732 -7.367
178 HH12 ARG 22 HH22 ARG 22 34.739 -12.369 -7.697
179 HH21 ARG 22 HH11 ARG 22 34.168 -10.916 -4.599
180 HH22 ARG 22 HH12 ARG 22 33.475 -11.340 -6.129
181 H VAL 23 HN VAL 23 38.276 -11.471 -0.416
182 HA VAL 23 HA VAL 23 38.454 -8.567 -0.975
183 HB VAL 23 HB VAL 23 36.925 -8.530 1.146
184 HG11 VAL 23 HG11 VAL 23 35.897 -8.143 -0.951
185 HG12 VAL 23 HG12 VAL 23 34.996 -9.503 -0.282
186 HG13 VAL 23 HG13 VAL 23 36.225 -9.782 -1.515
187 HG21 VAL 23 HG21 VAL 23 36.673 -11.464 0.426
188 HG22 VAL 23 HG22 VAL 23 35.939 -10.618 1.789
189 HG23 VAL 23 HG23 VAL 23 37.681 -10.901 1.760
190 H ALA 24 HN ALA 24 39.679 -7.139 0.142
191 HA ALA 24 HA ALA 24 40.995 -8.015 2.696
192 HB1 ALA 24 HB1 ALA 24 43.031 -6.732 1.920
193 HB2 ALA 24 HB2 ALA 24 42.293 -6.649 0.321
194 HB3 ALA 24 HB3 ALA 24 42.719 -8.214 1.016
195 H THR 25 HN THR 25 41.428 -6.260 4.154
196 HA THR 25 HA THR 25 39.763 -3.816 3.596
197 HB THR 25 HB THR 25 40.862 -4.711 6.270
198 HG1 THR 25 HG1 THR 25 38.486 -5.444 4.921
199 HG21 THR 25 HG21 THR 25 38.487 -3.014 5.470
200 HG22 THR 25 HG22 THR 25 40.029 -2.396 6.062
201 HG23 THR 25 HG23 THR 25 39.002 -3.362 7.121
202 H VAL 26 HN VAL 26 40.705 -1.760 3.718
203 HA VAL 26 HA VAL 26 43.507 -1.523 4.652
204 HB VAL 26 HB VAL 26 43.416 -2.030 2.109
205 HG11 VAL 26 HG11 VAL 26 42.819 -0.254 0.640
206 HG12 VAL 26 HG12 VAL 26 42.662 0.895 1.962
207 HG13 VAL 26 HG13 VAL 26 41.476 -0.396 1.771
208 HG21 VAL 26 HG21 VAL 26 44.747 0.490 3.151
209 HG22 VAL 26 HG22 VAL 26 45.197 -0.348 1.666
210 HG23 VAL 26 HG23 VAL 26 45.409 -1.142 3.227
211 H GLN 27 HN GLN 27 43.732 0.322 5.785
212 HA GLN 27 HA GLN 27 41.509 2.250 5.864
213 HB2 GLN 27 HB2 GLN 27 43.937 1.666 7.501
214 HB3 GLN 27 HB1 GLN 27 43.431 3.354 7.480
215 HG2 GLN 27 HG2 GLN 27 41.497 1.099 8.050
216 HG3 GLN 27 HG1 GLN 27 42.419 1.900 9.324
217 HE21 GLN 27 HE21 GLN 27 42.144 4.366 9.416
218 HE22 GLN 27 HE22 GLN 27 40.633 5.009 8.988
219 H LYS 28 HN LYS 28 41.448 4.006 4.556
220 HA LYS 28 HA LYS 28 44.021 5.151 3.541
221 HB2 LYS 28 HB2 LYS 28 43.015 3.704 1.794
222 HB3 LYS 28 HB1 LYS 28 41.516 4.630 1.905
223 HG2 LYS 28 HG2 LYS 28 42.635 6.646 1.160
224 HG3 LYS 28 HG1 LYS 28 44.207 5.847 1.218
225 HD2 LYS 28 HD2 LYS 28 43.535 4.311 -0.556
226 HD3 LYS 28 HD1 LYS 28 41.911 4.999 -0.573
227 HE2 LYS 28 HE2 LYS 28 44.446 6.553 -1.172
228 HE3 LYS 28 HE1 LYS 28 43.352 5.908 -2.396
229 HZ1 LYS 28 HZ1 LYS 28 42.620 8.068 -2.112
230 HZ2 LYS 28 HZ2 LYS 28 42.873 8.055 -0.432
231 HZ3 LYS 28 HZ3 LYS 28 41.569 7.197 -1.105
232 H ASP 29 HN ASP 29 43.957 7.484 3.484
233 HA ASP 29 HA ASP 29 43.135 9.591 4.248
234 HB2 ASP 29 HB2 ASP 29 41.295 10.377 2.934
235 HB3 ASP 29 HB1 ASP 29 42.188 9.253 1.913
236 H GLY 30 HN GLY 30 42.447 7.195 5.964
237 HA2 GLY 30 HA2 GLY 30 41.416 7.239 8.126
238 HA3 GLY 30 HA1 GLY 30 40.413 8.590 7.602
239 H ARG 31 HN ARG 31 39.534 7.273 5.137
240 HA ARG 31 HA ARG 31 37.444 5.558 6.333
241 HB2 ARG 31 HB2 ARG 31 36.774 7.324 4.744
242 HB3 ARG 31 HB1 ARG 31 37.785 6.593 3.499
243 HG2 ARG 31 HG2 ARG 31 35.404 5.945 3.243
244 HG3 ARG 31 HG1 ARG 31 36.425 4.547 3.559
245 HD2 ARG 31 HD2 ARG 31 35.597 4.261 5.724
246 HD3 ARG 31 HD1 ARG 31 35.136 5.958 5.881
247 HE ARG 31 HE ARG 31 33.488 5.010 3.867
248 HH11 ARG 31 HH21 ARG 31 34.294 4.082 7.087
249 HH12 ARG 31 HH22 ARG 31 32.740 3.394 7.420
250 HH21 ARG 31 HH11 ARG 31 31.454 4.118 4.282
251 HH22 ARG 31 HH12 ARG 31 31.132 3.414 5.831
252 H ARG 32 HN ARG 32 37.171 3.440 5.856
253 HA ARG 32 HA ARG 32 39.495 2.011 4.714
254 HB2 ARG 32 HB2 ARG 32 38.964 0.382 6.226
255 HB3 ARG 32 HB1 ARG 32 37.890 1.582 6.929
256 HG2 ARG 32 HG2 ARG 32 36.063 0.734 5.413
257 HG3 ARG 32 HG1 ARG 32 37.149 -0.565 4.920
258 HD2 ARG 32 HD2 ARG 32 35.753 -1.413 6.703
259 HD3 ARG 32 HD1 ARG 32 37.379 -1.192 7.350
260 HE ARG 32 HE ARG 32 36.109 1.204 7.919
261 HH11 ARG 32 HH21 ARG 32 35.482 -2.147 8.430
262 HH12 ARG 32 HH22 ARG 32 34.614 -1.896 9.908
263 HH21 ARG 32 HH11 ARG 32 34.978 1.552 9.846
264 HH22 ARG 32 HH12 ARG 32 34.328 0.198 10.709
265 H VAL 33 HN VAL 33 39.308 0.533 2.979
266 HA VAL 33 HA VAL 33 36.697 0.427 1.524
267 HB VAL 33 HB VAL 33 39.348 1.241 0.277
268 HG11 VAL 33 HG11 VAL 33 37.933 1.335 -1.832
269 HG12 VAL 33 HG12 VAL 33 36.692 0.447 -0.952
270 HG13 VAL 33 HG13 VAL 33 38.267 -0.291 -1.240
271 HG21 VAL 33 HG21 VAL 33 37.816 3.173 -0.518
272 HG22 VAL 33 HG22 VAL 33 38.301 3.189 1.175
273 HG23 VAL 33 HG23 VAL 33 36.692 2.625 0.725
274 H GLU 34 HN GLU 34 36.427 -1.448 0.333
275 HA GLU 34 HA GLU 34 38.410 -3.621 0.914
276 HB2 GLU 34 HB2 GLU 34 35.408 -3.553 0.625
277 HB3 GLU 34 HB1 GLU 34 36.276 -5.069 0.380
278 HG2 GLU 34 HG2 GLU 34 37.183 -5.003 2.606
279 HG3 GLU 34 HG1 GLU 34 36.616 -3.352 2.853
280 H PHE 35 HN PHE 35 39.745 -3.747 -0.918
281 HA PHE 35 HA PHE 35 38.469 -3.661 -3.610
282 HB2 PHE 35 HB2 PHE 35 41.322 -3.632 -2.614
283 HB3 PHE 35 HB1 PHE 35 40.984 -4.040 -4.290
284 HD1 PHE 35 HD1 PHE 35 39.086 -2.320 -5.368
285 HD2 PHE 35 HD2 PHE 35 41.918 -1.418 -2.266
286 HE1 PHE 35 HE1 PHE 35 38.943 0.088 -5.931
287 HE2 PHE 35 HE2 PHE 35 41.774 0.986 -2.824
288 HZ PHE 35 HZ PHE 35 40.284 1.743 -4.660
289 H THR 36 HN THR 36 38.415 -5.504 -4.953
290 HA THR 36 HA THR 36 39.004 -8.105 -3.586
291 HB THR 36 HB THR 36 37.469 -9.089 -5.242
292 HG1 THR 36 HG1 THR 36 37.355 -6.438 -6.231
293 HG21 THR 36 HG21 THR 36 36.644 -7.796 -3.136
294 HG22 THR 36 HG22 THR 36 35.468 -8.242 -4.372
295 HG23 THR 36 HG23 THR 36 36.085 -6.592 -4.298
296 H ALA 37 HN ALA 37 40.038 -9.831 -5.077
297 HA ALA 37 HA ALA 37 42.417 -8.876 -6.270
298 HB1 ALA 37 HB1 ALA 37 42.130 -11.235 -5.679
299 HB2 ALA 37 HB2 ALA 37 42.580 -11.088 -7.375
300 HB3 ALA 37 HB3 ALA 37 40.905 -11.418 -6.936
301 H THR 38 HN THR 38 39.265 -8.600 -7.500
302 HA THR 38 HA THR 38 39.639 -8.882 -10.288
303 HB THR 38 HB THR 38 37.759 -7.250 -10.513
304 HG1 THR 38 HG1 THR 38 37.124 -6.102 -8.831
305 HG21 THR 38 HG21 THR 38 37.540 -9.756 -9.748
306 HG22 THR 38 HG22 THR 38 36.139 -8.691 -9.636
307 HG23 THR 38 HG23 THR 38 37.090 -9.048 -8.196
308 H SER 39 HN SER 39 40.640 -6.308 -8.119
309 HA SER 39 HA SER 39 41.926 -4.915 -10.452
310 HB2 SER 39 HB2 SER 39 41.312 -2.795 -9.615
311 HB3 SER 39 HB1 SER 39 39.850 -3.756 -9.430
312 HG SER 39 HG SER 39 40.262 -2.692 -7.505
313 H VAL 40 HN VAL 40 43.448 -6.724 -9.196
314 HA VAL 40 HA VAL 40 44.792 -5.614 -6.855
315 HB VAL 40 HB VAL 40 44.731 -8.018 -7.054
316 HG11 VAL 40 HG11 VAL 40 45.738 -9.225 -8.933
317 HG12 VAL 40 HG12 VAL 40 46.301 -7.719 -9.651
318 HG13 VAL 40 HG13 VAL 40 44.573 -8.069 -9.580
319 HG21 VAL 40 HG21 VAL 40 46.851 -6.833 -6.197
320 HG22 VAL 40 HG22 VAL 40 47.569 -7.214 -7.762
321 HG23 VAL 40 HG23 VAL 40 47.053 -8.517 -6.693
322 H SER 41 HN SER 41 45.001 -4.960 -10.195
323 HA SER 41 HA SER 41 47.838 -4.393 -10.322
324 HB2 SER 41 HB2 SER 41 47.263 -3.215 -12.421
325 HB3 SER 41 HB1 SER 41 46.550 -4.824 -12.357
326 HG SER 41 HG SER 41 44.591 -3.940 -11.926
327 H ASP 42 HN ASP 42 44.933 -2.385 -9.785
328 HA ASP 42 HA ASP 42 46.227 0.135 -9.694
329 HB2 ASP 42 HB2 ASP 42 44.345 0.780 -8.117
330 HB3 ASP 42 HB1 ASP 42 43.824 0.062 -9.641
331 H LEU 43 HN LEU 43 46.119 -2.484 -7.273
332 HA LEU 43 HA LEU 43 47.132 -0.863 -5.115
333 HB2 LEU 43 HB2 LEU 43 45.984 -3.207 -5.034
334 HB3 LEU 43 HB1 LEU 43 47.590 -3.838 -5.372
335 HG LEU 43 HG LEU 43 48.467 -2.719 -3.336
336 HD11 LEU 43 HD11 LEU 43 45.686 -1.579 -3.297
337 HD12 LEU 43 HD12 LEU 43 47.207 -0.843 -2.801
338 HD13 LEU 43 HD13 LEU 43 46.405 -1.989 -1.740
339 HD21 LEU 43 HD21 LEU 43 45.963 -4.284 -2.657
340 HD22 LEU 43 HD22 LEU 43 47.492 -4.250 -1.778
341 HD23 LEU 43 HD23 LEU 43 47.396 -5.040 -3.352
342 H LYS 44 HN LYS 44 48.590 -2.795 -7.690
343 HA LYS 44 HA LYS 44 51.299 -2.646 -6.732
344 HB2 LYS 44 HB2 LYS 44 49.982 -3.198 -9.373
345 HB3 LYS 44 HB1 LYS 44 51.702 -2.816 -9.388
346 HG2 LYS 44 HG2 LYS 44 52.215 -4.666 -7.948
347 HG3 LYS 44 HG1 LYS 44 50.511 -4.950 -7.601
348 HD2 LYS 44 HD2 LYS 44 50.092 -5.626 -9.887
349 HD3 LYS 44 HD1 LYS 44 51.722 -5.157 -10.370
350 HE2 LYS 44 HE2 LYS 44 52.695 -6.895 -9.005
351 HE3 LYS 44 HE1 LYS 44 51.128 -7.279 -8.298
352 HZ1 LYS 44 HZ1 LYS 44 52.038 -7.724 -11.077
353 HZ2 LYS 44 HZ2 LYS 44 50.393 -7.752 -10.652
354 HZ3 LYS 44 HZ3 LYS 44 51.469 -8.869 -9.962
355 H LYS 45 HN LYS 45 49.479 -0.589 -9.028
356 HA LYS 45 HA LYS 45 51.599 1.246 -9.548
357 HB2 LYS 45 HB2 LYS 45 49.461 1.021 -10.841
358 HB3 LYS 45 HB1 LYS 45 48.630 1.823 -9.512
359 HG2 LYS 45 HG2 LYS 45 49.963 3.827 -9.796
360 HG3 LYS 45 HG1 LYS 45 50.990 3.029 -10.984
361 HD2 LYS 45 HD2 LYS 45 49.510 4.283 -12.319
362 HD3 LYS 45 HD1 LYS 45 48.794 2.674 -12.336
363 HE2 LYS 45 HE2 LYS 45 47.106 4.455 -11.923
364 HE3 LYS 45 HE1 LYS 45 47.216 3.323 -10.577
365 HZ1 LYS 45 HZ1 LYS 45 48.255 4.852 -9.254
366 HZ2 LYS 45 HZ2 LYS 45 47.252 5.878 -10.162
367 HZ3 LYS 45 HZ3 LYS 45 48.898 5.729 -10.556
368 H TYR 46 HN TYR 46 49.024 1.268 -7.100
369 HA TYR 46 HA TYR 46 49.562 3.822 -5.978
370 HB2 TYR 46 HB2 TYR 46 47.562 2.495 -5.446
371 HB3 TYR 46 HB1 TYR 46 48.566 1.286 -4.659
372 HD1 TYR 46 HD2 TYR 46 48.170 5.030 -4.550
373 HD2 TYR 46 HD1 TYR 46 48.561 1.370 -2.327
374 HE1 TYR 46 HE2 TYR 46 47.994 6.296 -2.429
375 HE2 TYR 46 HE1 TYR 46 48.375 2.635 -0.207
376 HH TYR 46 HH TYR 46 48.313 6.168 -0.178
377 H ILE 47 HN ILE 47 50.771 0.608 -4.981
378 HA ILE 47 HA ILE 47 52.486 1.435 -2.905
379 HB ILE 47 HB ILE 47 52.859 -0.779 -4.942
380 HG12 ILE 47 HG12 ILE 47 51.963 -1.074 -2.070
381 HG13 ILE 47 HG11 ILE 47 50.800 -0.712 -3.345
382 HG21 ILE 47 HG21 ILE 47 55.002 -0.401 -3.967
383 HG22 ILE 47 HG22 ILE 47 54.310 -1.754 -3.073
384 HG23 ILE 47 HG23 ILE 47 54.309 -0.139 -2.367
385 HD11 ILE 47 HD11 ILE 47 51.329 -3.223 -2.721
386 HD12 ILE 47 HD12 ILE 47 52.737 -2.975 -3.754
387 HD13 ILE 47 HD13 ILE 47 51.116 -2.758 -4.407
388 H ALA 48 HN ALA 48 53.233 1.035 -6.371
389 HA ALA 48 HA ALA 48 55.918 1.795 -6.346
390 HB1 ALA 48 HB1 ALA 48 55.594 2.479 -8.692
391 HB2 ALA 48 HB2 ALA 48 53.848 2.474 -8.451
392 HB3 ALA 48 HB3 ALA 48 54.754 0.965 -8.353
393 H GLU 49 HN GLU 49 53.065 3.928 -6.544
394 HA GLU 49 HA GLU 49 54.452 6.363 -6.887
395 HB2 GLU 49 HB2 GLU 49 51.909 5.863 -6.973
396 HB3 GLU 49 HB1 GLU 49 51.935 6.145 -5.233
397 HG2 GLU 49 HG2 GLU 49 53.060 8.357 -5.699
398 HG3 GLU 49 HG1 GLU 49 52.754 8.075 -7.412
399 H LEU 50 HN LEU 50 53.966 4.439 -3.967
400 HA LEU 50 HA LEU 50 54.816 6.642 -2.216
401 HB2 LEU 50 HB2 LEU 50 54.625 3.712 -1.491
402 HB3 LEU 50 HB1 LEU 50 54.561 5.099 -0.406
403 HG LEU 50 HG LEU 50 52.498 4.326 -2.490
404 HD11 LEU 50 HD11 LEU 50 51.041 4.316 -0.401
405 HD12 LEU 50 HD12 LEU 50 52.530 4.419 0.534
406 HD13 LEU 50 HD13 LEU 50 52.235 3.022 -0.502
407 HD21 LEU 50 HD21 LEU 50 52.511 6.689 -2.572
408 HD22 LEU 50 HD22 LEU 50 52.871 6.839 -0.852
409 HD23 LEU 50 HD23 LEU 50 51.266 6.334 -1.376
410 H GLU 51 HN GLU 51 56.350 3.826 -3.730
411 HA GLU 51 HA GLU 51 58.747 3.895 -2.164
412 HB2 GLU 51 HB2 GLU 51 58.081 2.875 -4.923
413 HB3 GLU 51 HB1 GLU 51 59.753 2.875 -4.364
414 HG2 GLU 51 HG2 GLU 51 57.491 1.641 -2.772
415 HG3 GLU 51 HG1 GLU 51 58.472 0.725 -3.919
416 H VAL 52 HN VAL 52 57.630 5.820 -4.879
417 HA VAL 52 HA VAL 52 60.265 7.057 -5.292
418 HB VAL 52 HB VAL 52 57.570 7.936 -6.371
419 HG11 VAL 52 HG11 VAL 52 60.447 8.483 -7.146
420 HG12 VAL 52 HG12 VAL 52 59.225 9.657 -6.654
421 HG13 VAL 52 HG13 VAL 52 59.084 8.836 -8.208
422 HG21 VAL 52 HG21 VAL 52 58.255 6.645 -8.409
423 HG22 VAL 52 HG22 VAL 52 57.962 5.611 -7.010
424 HG23 VAL 52 HG23 VAL 52 59.614 5.993 -7.494
425 H GLN 53 HN GLN 53 57.283 7.754 -3.535
426 HA GLN 53 HA GLN 53 58.058 10.519 -2.965
427 HB2 GLN 53 HB2 GLN 53 55.871 8.712 -1.911
428 HB3 GLN 53 HB1 GLN 53 56.122 10.350 -1.311
429 HG2 GLN 53 HG2 GLN 53 55.868 11.226 -3.611
430 HG3 GLN 53 HG1 GLN 53 55.587 9.586 -4.197
431 HE21 GLN 53 HE21 GLN 53 54.341 11.398 -1.327
432 HE22 GLN 53 HE22 GLN 53 52.705 11.092 -1.665
433 H THR 54 HN THR 54 58.199 7.394 -1.293
434 HA THR 54 HA THR 54 59.393 8.672 1.101
435 HB THR 54 HB THR 54 59.077 5.695 0.689
436 HG1 THR 54 HG1 THR 54 57.105 7.647 1.163
437 HG21 THR 54 HG21 THR 54 58.712 5.745 3.117
438 HG22 THR 54 HG22 THR 54 58.805 7.506 3.106
439 HG23 THR 54 HG23 THR 54 60.230 6.546 2.713
440 H GLY 55 HN GLY 55 60.813 8.675 -1.503
441 HA2 GLY 55 HA2 GLY 55 62.934 6.697 -1.356
442 HA3 GLY 55 HA1 GLY 55 62.927 8.127 -2.391
443 H MET 56 HN MET 56 62.464 8.309 1.091
444 HA MET 56 HA MET 56 64.631 10.215 1.344
445 HB2 MET 56 HB2 MET 56 62.854 8.794 3.336
446 HB3 MET 56 HB1 MET 56 64.148 9.878 3.850
447 HG2 MET 56 HG2 MET 56 62.015 11.096 3.693
448 HG3 MET 56 HG1 MET 56 63.160 11.694 2.492
449 HE1 MET 56 HE1 MET 56 60.493 12.536 2.262
450 HE2 MET 56 HE2 MET 56 59.760 12.059 0.733
451 HE3 MET 56 HE3 MET 56 61.385 12.739 0.748
452 H THR 57 HN THR 57 66.684 9.890 2.250
453 HA THR 57 HA THR 57 67.517 7.467 3.541
454 HB THR 57 HB THR 57 67.311 6.390 1.400
455 HG1 THR 57 HG1 THR 57 69.764 6.404 0.870
456 HG21 THR 57 HG21 THR 57 68.724 8.855 0.369
457 HG22 THR 57 HG22 THR 57 67.139 8.241 -0.096
458 HG23 THR 57 HG23 THR 57 68.597 7.373 -0.577
459 H GLN 58 HN GLN 58 67.958 9.966 4.361
460 HA GLN 58 HA GLN 58 70.497 11.021 3.335
461 HB2 GLN 58 HB2 GLN 58 68.673 11.801 5.618
462 HB3 GLN 58 HB1 GLN 58 70.224 12.593 5.339
463 HG2 GLN 58 HG2 GLN 58 68.108 12.334 3.190
464 HG3 GLN 58 HG1 GLN 58 68.214 13.728 4.266
465 HE21 GLN 58 HE21 GLN 58 68.582 14.421 1.684
466 HE22 GLN 58 HE22 GLN 58 70.221 14.654 1.310
467 H ARG 59 HN ARG 59 71.921 11.730 5.543
468 HA ARG 59 HA ARG 59 72.215 9.570 7.455
469 HB2 ARG 59 HB2 ARG 59 73.187 8.561 5.355
470 HB3 ARG 59 HB1 ARG 59 74.403 9.838 5.375
471 HG2 ARG 59 HG2 ARG 59 75.205 9.111 7.553
472 HG3 ARG 59 HG1 ARG 59 73.913 7.915 7.667
473 HD2 ARG 59 HD2 ARG 59 74.810 6.737 5.704
474 HD3 ARG 59 HD1 ARG 59 76.087 7.944 5.552
475 HE ARG 59 HE ARG 59 76.375 6.999 8.141
476 HH11 ARG 59 HH21 ARG 59 76.171 5.628 4.984
477 HH12 ARG 59 HH22 ARG 59 77.182 4.273 5.362
478 HH21 ARG 59 HH11 ARG 59 77.697 5.238 8.653
479 HH22 ARG 59 HH12 ARG 59 78.045 4.052 7.439
480 H ARG 60 HN ARG 60 72.071 11.569 8.738
481 HA ARG 60 HA ARG 60 73.985 13.687 8.538
482 HB2 ARG 60 HB2 ARG 60 73.323 14.120 10.956
483 HB3 ARG 60 HB1 ARG 60 71.984 14.073 9.808
484 HG2 ARG 60 HG2 ARG 60 71.383 11.847 10.458
485 HG3 ARG 60 HG1 ARG 60 72.873 11.648 11.382
486 HD2 ARG 60 HD2 ARG 60 70.810 13.761 12.039
487 HD3 ARG 60 HD1 ARG 60 70.799 12.154 12.766
488 HE ARG 60 HE ARG 60 73.381 13.061 13.205
489 HH11 ARG 60 HH21 ARG 60 70.186 14.228 13.770
490 HH12 ARG 60 HH22 ARG 60 70.620 15.118 15.191
491 HH21 ARG 60 HH11 ARG 60 73.965 14.217 15.057
492 HH22 ARG 60 HH12 ARG 60 72.759 15.112 15.920
493 H ARG 61 HN ARG 61 75.788 14.108 10.034
494 HA ARG 61 HA ARG 61 77.808 13.462 11.036
495 HB2 ARG 61 HB2 ARG 61 76.017 12.656 12.733
496 HB3 ARG 61 HB1 ARG 61 76.337 11.044 12.095
497 HG2 ARG 61 HG2 ARG 61 77.830 11.175 13.892
498 HG3 ARG 61 HG1 ARG 61 78.848 11.625 12.526
499 HD2 ARG 61 HD2 ARG 61 77.792 14.077 13.290
500 HD3 ARG 61 HD1 ARG 61 77.985 13.262 14.838
501 HE ARG 61 HE ARG 61 80.080 14.448 13.395
502 HH11 ARG 61 HH21 ARG 61 79.335 11.335 14.697
503 HH12 ARG 61 HH22 ARG 61 80.989 10.839 14.781
504 HH21 ARG 61 HH11 ARG 61 82.229 13.813 13.517
505 HH22 ARG 61 HH12 ARG 61 82.625 12.238 14.121
506 H GLY 62 HN GLY 62 79.073 12.889 9.261
507 HA2 GLY 62 HA2 GLY 62 79.873 10.178 8.965
508 HA3 GLY 62 HA1 GLY 62 78.732 10.550 7.671
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 56.866 10.817 7.813
2 H2 MET 1 HT2 MET 1 55.815 10.786 9.148
3 H3 MET 1 HT3 MET 1 55.318 10.144 7.656
4 HA MET 1 HA MET 1 57.390 8.615 7.963
5 HB2 MET 1 HB2 MET 1 58.084 9.817 10.041
6 HB3 MET 1 HB1 MET 1 56.586 9.290 10.809
7 HG2 MET 1 HG2 MET 1 57.214 6.955 10.537
8 HG3 MET 1 HG1 MET 1 58.655 7.414 9.631
9 HE1 MET 1 HE1 MET 1 59.007 5.508 11.619
10 HE2 MET 1 HE2 MET 1 60.096 6.021 12.906
11 HE3 MET 1 HE3 MET 1 60.540 6.296 11.223
12 H VAL 2 HN VAL 2 54.159 9.362 8.943
13 HA VAL 2 HA VAL 2 53.291 6.773 9.782
14 HB VAL 2 HB VAL 2 51.678 8.880 8.311
15 HG11 VAL 2 HG11 VAL 2 50.905 6.625 10.189
16 HG12 VAL 2 HG12 VAL 2 50.550 6.715 8.464
17 HG13 VAL 2 HG13 VAL 2 49.795 7.853 9.580
18 HG21 VAL 2 HG21 VAL 2 51.073 9.632 10.621
19 HG22 VAL 2 HG22 VAL 2 52.782 9.869 10.254
20 HG23 VAL 2 HG23 VAL 2 52.277 8.515 11.266
21 H ARG 3 HN ARG 3 54.121 8.024 6.666
22 HA ARG 3 HA ARG 3 52.546 6.252 5.044
23 HB2 ARG 3 HB2 ARG 3 55.260 7.458 4.422
24 HB3 ARG 3 HB1 ARG 3 54.104 6.826 3.248
25 HG2 ARG 3 HG2 ARG 3 52.449 8.520 4.000
26 HG3 ARG 3 HG1 ARG 3 53.655 9.185 5.100
27 HD2 ARG 3 HD2 ARG 3 55.028 9.145 2.685
28 HD3 ARG 3 HD1 ARG 3 53.391 9.548 2.175
29 HE ARG 3 HE ARG 3 55.187 11.371 3.325
30 HH11 ARG 3 HH21 ARG 3 52.013 10.180 3.993
31 HH12 ARG 3 HH22 ARG 3 51.548 11.572 4.905
32 HH21 ARG 3 HH11 ARG 3 54.582 13.188 4.498
33 HH22 ARG 3 HH12 ARG 3 52.996 13.274 5.186
34 H GLN 4 HN GLN 4 55.568 5.868 6.781
35 HA GLN 4 HA GLN 4 56.522 3.531 5.446
36 HB2 GLN 4 HB2 GLN 4 57.716 5.017 7.198
37 HB3 GLN 4 HB1 GLN 4 56.877 4.044 8.405
38 HG2 GLN 4 HG2 GLN 4 58.628 2.889 6.212
39 HG3 GLN 4 HG1 GLN 4 59.177 3.196 7.859
40 HE21 GLN 4 HE21 GLN 4 57.156 2.301 9.465
41 HE22 GLN 4 HE22 GLN 4 56.815 0.663 9.173
42 H GLU 5 HN GLU 5 54.318 3.952 8.207
43 HA GLU 5 HA GLU 5 53.987 1.099 8.636
44 HB2 GLU 5 HB2 GLU 5 52.512 3.557 9.591
45 HB3 GLU 5 HB1 GLU 5 51.930 1.936 9.967
46 HG2 GLU 5 HG2 GLU 5 54.131 1.396 10.978
47 HG3 GLU 5 HG1 GLU 5 54.673 3.040 10.646
48 H GLU 6 HN GLU 6 51.941 3.616 7.110
49 HA GLU 6 HA GLU 6 49.817 1.907 6.366
50 HB2 GLU 6 HB2 GLU 6 50.738 4.596 5.643
51 HB3 GLU 6 HB1 GLU 6 50.050 3.777 4.243
52 HG2 GLU 6 HG2 GLU 6 48.321 5.025 5.476
53 HG3 GLU 6 HG1 GLU 6 48.002 3.291 5.536
54 H LEU 7 HN LEU 7 53.065 2.042 5.148
55 HA LEU 7 HA LEU 7 52.431 0.785 2.591
56 HB2 LEU 7 HB2 LEU 7 54.556 2.196 3.343
57 HB3 LEU 7 HB1 LEU 7 55.164 0.625 3.852
58 HG LEU 7 HG LEU 7 54.161 1.302 1.067
59 HD11 LEU 7 HD11 LEU 7 56.309 2.377 1.585
60 HD12 LEU 7 HD12 LEU 7 56.546 1.061 0.437
61 HD13 LEU 7 HD13 LEU 7 56.962 0.835 2.136
62 HD21 LEU 7 HD21 LEU 7 55.179 -1.228 2.367
63 HD22 LEU 7 HD22 LEU 7 55.368 -0.973 0.633
64 HD23 LEU 7 HD23 LEU 7 53.759 -1.006 1.346
65 H ALA 8 HN ALA 8 53.896 -0.324 5.658
66 HA ALA 8 HA ALA 8 54.149 -3.058 4.950
67 HB1 ALA 8 HB1 ALA 8 54.143 -3.502 7.385
68 HB2 ALA 8 HB2 ALA 8 53.554 -1.866 7.679
69 HB3 ALA 8 HB3 ALA 8 55.159 -2.116 6.991
70 H ALA 9 HN ALA 9 51.349 -1.178 5.818
71 HA ALA 9 HA ALA 9 49.652 -3.449 6.468
72 HB1 ALA 9 HB1 ALA 9 49.025 -1.345 7.421
73 HB2 ALA 9 HB2 ALA 9 47.807 -1.708 6.198
74 HB3 ALA 9 HB3 ALA 9 49.085 -0.542 5.852
75 H ALA 10 HN ALA 10 49.753 -1.192 3.669
76 HA ALA 10 HA ALA 10 47.895 -2.656 2.089
77 HB1 ALA 10 HB1 ALA 10 50.097 -0.710 1.447
78 HB2 ALA 10 HB2 ALA 10 48.357 -0.522 1.240
79 HB3 ALA 10 HB3 ALA 10 49.269 -1.551 0.135
80 H ARG 11 HN ARG 11 51.295 -3.083 2.733
81 HA ARG 11 HA ARG 11 51.828 -4.982 0.623
82 HB2 ARG 11 HB2 ARG 11 53.427 -3.631 2.282
83 HB3 ARG 11 HB1 ARG 11 53.256 -5.064 3.286
84 HG2 ARG 11 HG2 ARG 11 55.039 -5.820 2.045
85 HG3 ARG 11 HG1 ARG 11 53.789 -6.248 0.880
86 HD2 ARG 11 HD2 ARG 11 54.085 -3.987 -0.165
87 HD3 ARG 11 HD1 ARG 11 55.442 -3.709 0.925
88 HE ARG 11 HE ARG 11 56.062 -6.118 -0.300
89 HH11 ARG 11 HH21 ARG 11 55.178 -2.948 -1.327
90 HH12 ARG 11 HH22 ARG 11 56.084 -3.028 -2.801
91 HH21 ARG 11 HH11 ARG 11 57.252 -6.241 -2.217
92 HH22 ARG 11 HH12 ARG 11 57.259 -4.892 -3.304
93 H ALA 12 HN ALA 12 51.062 -5.351 4.148
94 HA ALA 12 HA ALA 12 51.018 -8.164 4.204
95 HB1 ALA 12 HB1 ALA 12 50.808 -6.772 6.235
96 HB2 ALA 12 HB2 ALA 12 49.499 -7.950 6.140
97 HB3 ALA 12 HB3 ALA 12 49.203 -6.264 5.711
98 H ALA 13 HN ALA 13 48.972 -6.001 2.644
99 HA ALA 13 HA ALA 13 46.658 -7.770 2.461
100 HB1 ALA 13 HB1 ALA 13 47.174 -5.441 0.614
101 HB2 ALA 13 HB2 ALA 13 46.702 -5.171 2.291
102 HB3 ALA 13 HB3 ALA 13 45.633 -6.062 1.210
103 H LEU 14 HN LEU 14 49.454 -6.947 0.403
104 HA LEU 14 HA LEU 14 48.488 -8.371 -1.874
105 HB2 LEU 14 HB2 LEU 14 50.810 -6.893 -1.307
106 HB3 LEU 14 HB1 LEU 14 51.405 -8.486 -1.730
107 HG LEU 14 HG LEU 14 49.431 -6.914 -3.423
108 HD11 LEU 14 HD11 LEU 14 51.692 -5.818 -3.175
109 HD12 LEU 14 HD12 LEU 14 51.271 -6.280 -4.821
110 HD13 LEU 14 HD13 LEU 14 52.397 -7.267 -3.890
111 HD21 LEU 14 HD21 LEU 14 49.646 -9.503 -3.551
112 HD22 LEU 14 HD22 LEU 14 51.219 -9.189 -4.281
113 HD23 LEU 14 HD23 LEU 14 49.751 -8.586 -5.052
114 H HIS 15 HN HIS 15 50.056 -9.420 1.061
115 HA HIS 15 HA HIS 15 50.658 -12.093 0.057
116 HB2 HIS 15 HB2 HIS 15 51.896 -11.046 1.962
117 HB3 HIS 15 HB1 HIS 15 50.419 -11.124 2.924
118 HD1 HIS 15 HD1 HIS 15 53.112 -13.279 1.444
119 HD2 HIS 15 HD2 HIS 15 49.690 -13.745 3.779
120 HE1 HIS 15 HE1 HIS 15 53.171 -15.648 2.337
121 H ASP 16 HN ASP 16 47.994 -10.507 1.713
122 HA ASP 16 HA ASP 16 46.594 -12.968 2.361
123 HB2 ASP 16 HB2 ASP 16 46.293 -10.746 3.541
124 HB3 ASP 16 HB1 ASP 16 45.411 -10.195 2.117
125 H LEU 17 HN LEU 17 46.525 -10.666 -0.326
126 HA LEU 17 HA LEU 17 44.158 -11.823 -1.542
127 HB2 LEU 17 HB2 LEU 17 46.301 -10.021 -2.706
128 HB3 LEU 17 HB1 LEU 17 44.788 -10.417 -3.498
129 HG LEU 17 HG LEU 17 44.859 -9.212 -0.727
130 HD11 LEU 17 HD11 LEU 17 46.076 -7.725 -2.317
131 HD12 LEU 17 HD12 LEU 17 44.574 -7.009 -1.738
132 HD13 LEU 17 HD13 LEU 17 44.650 -7.710 -3.352
133 HD21 LEU 17 HD21 LEU 17 42.699 -10.061 -1.202
134 HD22 LEU 17 HD22 LEU 17 42.773 -9.567 -2.890
135 HD23 LEU 17 HD23 LEU 17 42.576 -8.358 -1.628
136 H MET 18 HN MET 18 47.559 -12.596 -1.645
137 HA MET 18 HA MET 18 47.233 -14.228 -4.092
138 HB2 MET 18 HB2 MET 18 49.449 -13.015 -2.640
139 HB3 MET 18 HB1 MET 18 49.783 -14.723 -2.900
140 HG2 MET 18 HG2 MET 18 50.648 -13.513 -4.800
141 HG3 MET 18 HG1 MET 18 49.211 -14.378 -5.339
142 HE1 MET 18 HE1 MET 18 48.853 -12.727 -7.510
143 HE2 MET 18 HE2 MET 18 50.467 -12.311 -6.943
144 HE3 MET 18 HE3 MET 18 49.328 -11.031 -7.351
145 H THR 19 HN THR 19 46.713 -14.619 -0.770
146 HA THR 19 HA THR 19 47.393 -17.516 -0.788
147 HB THR 19 HB THR 19 46.435 -17.257 1.650
148 HG1 THR 19 HG1 THR 19 45.818 -15.322 2.097
149 HG21 THR 19 HG21 THR 19 48.993 -15.860 0.807
150 HG22 THR 19 HG22 THR 19 48.819 -17.592 1.087
151 HG23 THR 19 HG23 THR 19 48.629 -16.460 2.425
152 H GLY 20 HN GLY 20 44.773 -15.588 -1.649
153 HA2 GLY 20 HA2 GLY 20 42.906 -17.047 -2.628
154 HA3 GLY 20 HA1 GLY 20 42.808 -17.778 -1.029
155 H LYS 21 HN LYS 21 42.999 -15.515 0.608
156 HA LYS 21 HA LYS 21 40.373 -14.596 0.775
157 HB2 LYS 21 HB2 LYS 21 42.973 -13.332 1.637
158 HB3 LYS 21 HB1 LYS 21 41.441 -12.513 1.916
159 HG2 LYS 21 HG2 LYS 21 42.164 -13.874 3.852
160 HG3 LYS 21 HG1 LYS 21 40.624 -14.415 3.190
161 HD2 LYS 21 HD2 LYS 21 41.636 -16.287 2.108
162 HD3 LYS 21 HD1 LYS 21 43.260 -15.646 2.370
163 HE2 LYS 21 HE2 LYS 21 42.911 -15.876 4.830
164 HE3 LYS 21 HE1 LYS 21 41.349 -16.628 4.508
165 HZ1 LYS 21 HZ1 LYS 21 42.750 -18.178 3.008
166 HZ2 LYS 21 HZ2 LYS 21 42.730 -18.436 4.686
167 HZ3 LYS 21 HZ3 LYS 21 44.051 -17.652 3.959
168 H ARG 22 HN ARG 22 39.400 -13.905 -1.120
169 HA ARG 22 HA ARG 22 40.698 -12.172 -3.006
170 HB2 ARG 22 HB2 ARG 22 38.795 -13.803 -3.468
171 HB3 ARG 22 HB1 ARG 22 37.723 -12.618 -2.722
172 HG2 ARG 22 HG2 ARG 22 38.756 -10.922 -4.370
173 HG3 ARG 22 HG1 ARG 22 39.367 -12.325 -5.234
174 HD2 ARG 22 HD2 ARG 22 36.498 -11.566 -4.705
175 HD3 ARG 22 HD1 ARG 22 37.274 -11.809 -6.265
176 HE ARG 22 HE ARG 22 35.965 -13.812 -4.677
177 HH11 ARG 22 HH21 ARG 22 38.837 -13.342 -6.539
178 HH12 ARG 22 HH22 ARG 22 39.160 -15.035 -6.690
179 HH21 ARG 22 HH11 ARG 22 36.369 -16.006 -4.888
180 HH22 ARG 22 HH12 ARG 22 37.764 -16.540 -5.766
181 H VAL 23 HN VAL 23 38.107 -11.630 -0.598
182 HA VAL 23 HA VAL 23 38.205 -8.715 -1.093
183 HB VAL 23 HB VAL 23 36.066 -9.852 -0.572
184 HG11 VAL 23 HG11 VAL 23 37.166 -10.241 2.223
185 HG12 VAL 23 HG12 VAL 23 37.212 -11.519 1.008
186 HG13 VAL 23 HG13 VAL 23 35.663 -10.875 1.551
187 HG21 VAL 23 HG21 VAL 23 36.510 -7.446 0.062
188 HG22 VAL 23 HG22 VAL 23 36.916 -8.007 1.684
189 HG23 VAL 23 HG23 VAL 23 35.283 -8.233 1.055
190 H ALA 24 HN ALA 24 39.316 -7.258 0.115
191 HA ALA 24 HA ALA 24 40.406 -8.063 2.773
192 HB1 ALA 24 HB1 ALA 24 42.233 -8.527 1.215
193 HB2 ALA 24 HB2 ALA 24 42.624 -7.094 2.166
194 HB3 ALA 24 HB3 ALA 24 42.066 -6.922 0.503
195 H THR 25 HN THR 25 40.887 -6.227 4.124
196 HA THR 25 HA THR 25 39.442 -3.734 3.264
197 HB THR 25 HB THR 25 40.221 -4.759 6.014
198 HG1 THR 25 HG1 THR 25 38.389 -5.733 5.840
199 HG21 THR 25 HG21 THR 25 40.258 -2.391 6.148
200 HG22 THR 25 HG22 THR 25 38.651 -2.854 6.710
201 HG23 THR 25 HG23 THR 25 38.869 -2.233 5.073
202 H VAL 26 HN VAL 26 40.438 -1.658 3.716
203 HA VAL 26 HA VAL 26 43.299 -1.661 4.467
204 HB VAL 26 HB VAL 26 43.080 -1.927 1.927
205 HG11 VAL 26 HG11 VAL 26 42.369 -0.059 0.633
206 HG12 VAL 26 HG12 VAL 26 42.308 0.994 2.042
207 HG13 VAL 26 HG13 VAL 26 41.114 -0.290 1.849
208 HG21 VAL 26 HG21 VAL 26 44.438 0.586 2.952
209 HG22 VAL 26 HG22 VAL 26 44.874 -0.324 1.505
210 HG23 VAL 26 HG23 VAL 26 45.101 -1.041 3.100
211 H GLN 27 HN GLN 27 43.744 0.054 5.706
212 HA GLN 27 HA GLN 27 41.665 2.096 6.154
213 HB2 GLN 27 HB2 GLN 27 44.375 2.204 7.470
214 HB3 GLN 27 HB1 GLN 27 42.791 2.598 8.138
215 HG2 GLN 27 HG2 GLN 27 43.290 0.566 9.195
216 HG3 GLN 27 HG1 GLN 27 42.294 0.046 7.838
217 HE21 GLN 27 HE21 GLN 27 43.187 -1.670 6.696
218 HE22 GLN 27 HE22 GLN 27 44.847 -2.002 6.566
219 H LYS 28 HN LYS 28 41.652 3.901 4.877
220 HA LYS 28 HA LYS 28 44.274 5.024 3.949
221 HB2 LYS 28 HB2 LYS 28 43.104 3.757 2.131
222 HB3 LYS 28 HB1 LYS 28 41.745 4.871 2.292
223 HG2 LYS 28 HG2 LYS 28 43.130 6.756 1.684
224 HG3 LYS 28 HG1 LYS 28 44.585 5.760 1.723
225 HD2 LYS 28 HD2 LYS 28 43.706 4.398 -0.138
226 HD3 LYS 28 HD1 LYS 28 42.253 5.395 -0.181
227 HE2 LYS 28 HE2 LYS 28 45.088 6.339 -0.692
228 HE3 LYS 28 HE1 LYS 28 43.812 6.164 -1.897
229 HZ1 LYS 28 HZ1 LYS 28 43.614 8.364 -1.400
230 HZ2 LYS 28 HZ2 LYS 28 44.124 8.176 0.210
231 HZ3 LYS 28 HZ3 LYS 28 42.549 7.728 -0.244
232 H ASP 29 HN ASP 29 44.370 7.103 4.943
233 HA ASP 29 HA ASP 29 43.603 9.215 5.725
234 HB2 ASP 29 HB2 ASP 29 41.415 8.924 3.655
235 HB3 ASP 29 HB1 ASP 29 42.194 10.400 4.226
236 H GLY 30 HN GLY 30 42.685 7.032 7.220
237 HA2 GLY 30 HA2 GLY 30 41.051 6.497 8.813
238 HA3 GLY 30 HA1 GLY 30 40.513 8.169 8.651
239 H ARG 31 HN ARG 31 40.568 5.993 5.902
240 HA ARG 31 HA ARG 31 37.606 5.645 6.084
241 HB2 ARG 31 HB2 ARG 31 38.069 7.579 4.589
242 HB3 ARG 31 HB1 ARG 31 39.117 6.557 3.613
243 HG2 ARG 31 HG2 ARG 31 36.839 6.786 2.636
244 HG3 ARG 31 HG1 ARG 31 37.247 5.120 3.019
245 HD2 ARG 31 HD2 ARG 31 34.894 6.085 3.713
246 HD3 ARG 31 HD1 ARG 31 35.762 5.016 4.814
247 HE ARG 31 HE ARG 31 36.616 7.536 5.563
248 HH11 ARG 31 HH21 ARG 31 33.580 5.995 5.035
249 HH12 ARG 31 HH22 ARG 31 32.744 6.941 6.223
250 HH21 ARG 31 HH11 ARG 31 35.545 8.779 7.116
251 HH22 ARG 31 HH12 ARG 31 33.858 8.517 7.400
252 H ARG 32 HN ARG 32 36.993 3.633 5.617
253 HA ARG 32 HA ARG 32 39.057 1.646 4.880
254 HB2 ARG 32 HB2 ARG 32 36.224 1.517 5.924
255 HB3 ARG 32 HB1 ARG 32 37.072 0.069 5.383
256 HG2 ARG 32 HG2 ARG 32 38.885 0.524 6.988
257 HG3 ARG 32 HG1 ARG 32 38.051 1.981 7.524
258 HD2 ARG 32 HD2 ARG 32 37.017 -0.862 7.744
259 HD3 ARG 32 HD1 ARG 32 37.572 0.153 9.075
260 HE ARG 32 HE ARG 32 35.555 1.648 7.907
261 HH11 ARG 32 HH21 ARG 32 35.911 -1.562 9.114
262 HH12 ARG 32 HH22 ARG 32 34.258 -1.702 9.609
263 HH21 ARG 32 HH11 ARG 32 33.393 1.484 8.548
264 HH22 ARG 32 HH12 ARG 32 32.831 0.022 9.289
265 H VAL 33 HN VAL 33 38.954 0.306 3.085
266 HA VAL 33 HA VAL 33 36.675 0.559 1.189
267 HB VAL 33 HB VAL 33 39.558 1.012 0.330
268 HG11 VAL 33 HG11 VAL 33 38.397 -0.305 -1.332
269 HG12 VAL 33 HG12 VAL 33 38.443 1.358 -1.918
270 HG13 VAL 33 HG13 VAL 33 36.963 0.714 -1.210
271 HG21 VAL 33 HG21 VAL 33 38.442 3.181 -0.563
272 HG22 VAL 33 HG22 VAL 33 38.766 3.091 1.164
273 HG23 VAL 33 HG23 VAL 33 37.133 2.807 0.558
274 H GLU 34 HN GLU 34 36.387 -1.296 -0.025
275 HA GLU 34 HA GLU 34 38.066 -3.646 0.808
276 HB2 GLU 34 HB2 GLU 34 35.141 -3.326 0.109
277 HB3 GLU 34 HB1 GLU 34 35.910 -4.913 0.099
278 HG2 GLU 34 HG2 GLU 34 34.903 -4.543 2.288
279 HG3 GLU 34 HG1 GLU 34 36.659 -4.503 2.464
280 H PHE 35 HN PHE 35 39.586 -3.877 -0.878
281 HA PHE 35 HA PHE 35 38.595 -3.762 -3.687
282 HB2 PHE 35 HB2 PHE 35 41.288 -3.673 -2.361
283 HB3 PHE 35 HB1 PHE 35 41.224 -4.342 -3.985
284 HD1 PHE 35 HD2 PHE 35 39.475 -2.815 -5.568
285 HD2 PHE 35 HD1 PHE 35 41.925 -1.439 -2.316
286 HE1 PHE 35 HE2 PHE 35 39.446 -0.525 -6.508
287 HE2 PHE 35 HE1 PHE 35 41.903 0.846 -3.262
288 HZ PHE 35 HZ PHE 35 40.661 1.307 -5.360
289 H THR 36 HN THR 36 38.676 -5.604 -5.043
290 HA THR 36 HA THR 36 39.066 -8.227 -3.633
291 HB THR 36 HB THR 36 37.520 -9.171 -5.275
292 HG1 THR 36 HG1 THR 36 37.766 -6.600 -6.394
293 HG21 THR 36 HG21 THR 36 35.521 -8.168 -4.518
294 HG22 THR 36 HG22 THR 36 36.269 -6.577 -4.382
295 HG23 THR 36 HG23 THR 36 36.681 -7.847 -3.229
296 H ALA 37 HN ALA 37 40.087 -9.975 -5.114
297 HA ALA 37 HA ALA 37 42.501 -9.072 -6.269
298 HB1 ALA 37 HB1 ALA 37 42.490 -11.290 -7.520
299 HB2 ALA 37 HB2 ALA 37 40.900 -11.579 -6.819
300 HB3 ALA 37 HB3 ALA 37 42.309 -11.406 -5.772
301 H THR 38 HN THR 38 39.366 -8.709 -7.529
302 HA THR 38 HA THR 38 39.833 -8.940 -10.328
303 HB THR 38 HB THR 38 37.888 -7.432 -10.595
304 HG1 THR 38 HG1 THR 38 38.669 -6.737 -8.082
305 HG21 THR 38 HG21 THR 38 36.315 -8.927 -9.744
306 HG22 THR 38 HG22 THR 38 37.202 -9.170 -8.242
307 HG23 THR 38 HG23 THR 38 37.765 -9.929 -9.733
308 H SER 39 HN SER 39 40.741 -6.452 -8.047
309 HA SER 39 HA SER 39 41.953 -4.881 -10.307
310 HB2 SER 39 HB2 SER 39 41.310 -2.837 -9.302
311 HB3 SER 39 HB1 SER 39 39.870 -3.845 -9.198
312 HG SER 39 HG SER 39 40.218 -4.138 -7.075
313 H VAL 40 HN VAL 40 43.544 -6.730 -9.181
314 HA VAL 40 HA VAL 40 44.924 -5.668 -6.822
315 HB VAL 40 HB VAL 40 44.840 -8.069 -7.055
316 HG11 VAL 40 HG11 VAL 40 45.812 -9.255 -8.966
317 HG12 VAL 40 HG12 VAL 40 46.366 -7.742 -9.675
318 HG13 VAL 40 HG13 VAL 40 44.638 -8.089 -9.578
319 HG21 VAL 40 HG21 VAL 40 47.667 -7.263 -7.799
320 HG22 VAL 40 HG22 VAL 40 47.168 -8.584 -6.745
321 HG23 VAL 40 HG23 VAL 40 46.979 -6.909 -6.215
322 H SER 41 HN SER 41 45.077 -4.982 -10.171
323 HA SER 41 HA SER 41 47.916 -4.418 -10.322
324 HB2 SER 41 HB2 SER 41 47.322 -3.249 -12.423
325 HB3 SER 41 HB1 SER 41 46.632 -4.868 -12.348
326 HG SER 41 HG SER 41 44.718 -4.006 -12.386
327 H ASP 42 HN ASP 42 45.013 -2.379 -9.845
328 HA ASP 42 HA ASP 42 46.332 0.125 -9.751
329 HB2 ASP 42 HB2 ASP 42 44.434 0.818 -8.228
330 HB3 ASP 42 HB1 ASP 42 43.921 0.054 -9.732
331 H LEU 43 HN LEU 43 46.198 -2.487 -7.334
332 HA LEU 43 HA LEU 43 47.172 -0.865 -5.154
333 HB2 LEU 43 HB2 LEU 43 46.020 -3.209 -5.102
334 HB3 LEU 43 HB1 LEU 43 47.632 -3.840 -5.414
335 HG LEU 43 HG LEU 43 48.473 -2.728 -3.361
336 HD11 LEU 43 HD11 LEU 43 47.207 -0.855 -2.837
337 HD12 LEU 43 HD12 LEU 43 46.380 -2.006 -1.800
338 HD13 LEU 43 HD13 LEU 43 45.695 -1.585 -3.369
339 HD21 LEU 43 HD21 LEU 43 45.959 -4.303 -2.743
340 HD22 LEU 43 HD22 LEU 43 47.464 -4.264 -1.824
341 HD23 LEU 43 HD23 LEU 43 47.413 -5.049 -3.402
342 H LYS 44 HN LYS 44 48.673 -2.830 -7.687
343 HA LYS 44 HA LYS 44 51.363 -2.670 -6.698
344 HB2 LYS 44 HB2 LYS 44 50.094 -3.207 -9.366
345 HB3 LYS 44 HB1 LYS 44 51.819 -2.848 -9.338
346 HG2 LYS 44 HG2 LYS 44 52.284 -4.710 -7.920
347 HG3 LYS 44 HG1 LYS 44 50.576 -4.954 -7.559
348 HD2 LYS 44 HD2 LYS 44 50.117 -5.696 -9.790
349 HD3 LYS 44 HD1 LYS 44 51.703 -5.174 -10.357
350 HE2 LYS 44 HE2 LYS 44 52.787 -6.856 -8.950
351 HE3 LYS 44 HE1 LYS 44 51.223 -7.349 -8.304
352 HZ1 LYS 44 HZ1 LYS 44 52.032 -7.501 -11.157
353 HZ2 LYS 44 HZ2 LYS 44 50.539 -7.997 -10.518
354 HZ3 LYS 44 HZ3 LYS 44 51.964 -8.813 -10.084
355 H LYS 45 HN LYS 45 49.593 -0.621 -9.039
356 HA LYS 45 HA LYS 45 51.709 1.216 -9.526
357 HB2 LYS 45 HB2 LYS 45 49.550 0.990 -10.810
358 HB3 LYS 45 HB1 LYS 45 48.750 1.838 -9.488
359 HG2 LYS 45 HG2 LYS 45 50.121 3.803 -9.822
360 HG3 LYS 45 HG1 LYS 45 51.132 2.958 -10.990
361 HD2 LYS 45 HD2 LYS 45 49.678 4.225 -12.346
362 HD3 LYS 45 HD1 LYS 45 48.942 2.625 -12.346
363 HE2 LYS 45 HE2 LYS 45 47.278 4.442 -11.965
364 HE3 LYS 45 HE1 LYS 45 47.358 3.314 -10.614
365 HZ1 LYS 45 HZ1 LYS 45 48.893 5.848 -10.710
366 HZ2 LYS 45 HZ2 LYS 45 48.661 4.827 -9.373
367 HZ3 LYS 45 HZ3 LYS 45 47.359 5.721 -9.999
368 H TYR 46 HN TYR 46 49.116 1.249 -7.090
369 HA TYR 46 HA TYR 46 49.683 3.796 -5.964
370 HB2 TYR 46 HB2 TYR 46 47.658 2.498 -5.441
371 HB3 TYR 46 HB1 TYR 46 48.641 1.282 -4.634
372 HD1 TYR 46 HD2 TYR 46 48.277 5.029 -4.576
373 HD2 TYR 46 HD1 TYR 46 48.659 1.401 -2.302
374 HE1 TYR 46 HE2 TYR 46 48.125 6.329 -2.472
375 HE2 TYR 46 HE1 TYR 46 48.498 2.701 -0.200
376 HH TYR 46 HH TYR 46 48.814 6.074 -0.099
377 H ILE 47 HN ILE 47 50.830 0.564 -4.937
378 HA ILE 47 HA ILE 47 52.547 1.390 -2.859
379 HB ILE 47 HB ILE 47 52.934 -0.849 -4.867
380 HG12 ILE 47 HG12 ILE 47 51.935 -1.121 -2.028
381 HG13 ILE 47 HG11 ILE 47 50.819 -0.745 -3.339
382 HG21 ILE 47 HG21 ILE 47 55.042 -0.474 -3.817
383 HG22 ILE 47 HG22 ILE 47 54.311 -1.823 -2.948
384 HG23 ILE 47 HG23 ILE 47 54.292 -0.207 -2.243
385 HD11 ILE 47 HD11 ILE 47 52.732 -3.033 -3.705
386 HD12 ILE 47 HD12 ILE 47 51.121 -2.801 -4.376
387 HD13 ILE 47 HD13 ILE 47 51.310 -3.265 -2.686
388 H ALA 48 HN ALA 48 53.326 0.901 -6.310
389 HA ALA 48 HA ALA 48 56.015 1.668 -6.260
390 HB1 ALA 48 HB1 ALA 48 53.981 2.265 -8.427
391 HB2 ALA 48 HB2 ALA 48 54.891 0.763 -8.260
392 HB3 ALA 48 HB3 ALA 48 55.733 2.268 -8.635
393 H GLU 49 HN GLU 49 53.138 3.757 -6.502
394 HA GLU 49 HA GLU 49 54.479 6.205 -6.937
395 HB2 GLU 49 HB2 GLU 49 51.942 5.674 -6.952
396 HB3 GLU 49 HB1 GLU 49 52.006 5.979 -5.216
397 HG2 GLU 49 HG2 GLU 49 53.087 8.199 -5.738
398 HG3 GLU 49 HG1 GLU 49 52.744 7.892 -7.441
399 H LEU 50 HN LEU 50 54.108 4.316 -3.996
400 HA LEU 50 HA LEU 50 54.964 6.541 -2.273
401 HB2 LEU 50 HB2 LEU 50 54.839 3.608 -1.545
402 HB3 LEU 50 HB1 LEU 50 54.781 4.993 -0.456
403 HG LEU 50 HG LEU 50 52.677 4.184 -2.484
404 HD11 LEU 50 HD11 LEU 50 52.503 2.875 -0.484
405 HD12 LEU 50 HD12 LEU 50 51.276 4.136 -0.362
406 HD13 LEU 50 HD13 LEU 50 52.783 4.284 0.538
407 HD21 LEU 50 HD21 LEU 50 53.045 6.701 -0.850
408 HD22 LEU 50 HD22 LEU 50 51.438 6.167 -1.340
409 HD23 LEU 50 HD23 LEU 50 52.649 6.549 -2.562
410 H GLU 51 HN GLU 51 56.476 3.784 -3.874
411 HA GLU 51 HA GLU 51 58.925 3.867 -2.367
412 HB2 GLU 51 HB2 GLU 51 58.298 2.847 -5.148
413 HB3 GLU 51 HB1 GLU 51 59.878 2.667 -4.387
414 HG2 GLU 51 HG2 GLU 51 58.998 1.310 -2.639
415 HG3 GLU 51 HG1 GLU 51 57.336 1.737 -3.044
416 H VAL 52 HN VAL 52 57.748 5.658 -5.162
417 HA VAL 52 HA VAL 52 60.377 6.865 -5.680
418 HB VAL 52 HB VAL 52 57.672 7.658 -6.796
419 HG11 VAL 52 HG11 VAL 52 59.314 9.364 -7.208
420 HG12 VAL 52 HG12 VAL 52 59.170 8.437 -8.701
421 HG13 VAL 52 HG13 VAL 52 60.541 8.168 -7.625
422 HG21 VAL 52 HG21 VAL 52 58.360 6.235 -8.745
423 HG22 VAL 52 HG22 VAL 52 58.068 5.300 -7.279
424 HG23 VAL 52 HG23 VAL 52 59.720 5.648 -7.787
425 H GLN 53 HN GLN 53 57.442 7.664 -3.910
426 HA GLN 53 HA GLN 53 58.137 10.479 -3.598
427 HB2 GLN 53 HB2 GLN 53 56.098 8.662 -2.301
428 HB3 GLN 53 HB1 GLN 53 56.319 10.333 -1.782
429 HG2 GLN 53 HG2 GLN 53 55.807 9.558 -4.665
430 HG3 GLN 53 HG1 GLN 53 54.517 9.985 -3.540
431 HE21 GLN 53 HE21 GLN 53 54.514 12.226 -2.677
432 HE22 GLN 53 HE22 GLN 53 55.332 13.460 -3.505
433 H THR 54 HN THR 54 58.535 7.528 -1.663
434 HA THR 54 HA THR 54 59.711 9.050 0.568
435 HB THR 54 HB THR 54 59.811 6.045 0.301
436 HG1 THR 54 HG1 THR 54 57.719 5.898 0.756
437 HG21 THR 54 HG21 THR 54 60.878 7.084 2.250
438 HG22 THR 54 HG22 THR 54 59.437 6.198 2.749
439 HG23 THR 54 HG23 THR 54 59.389 7.956 2.618
440 H GLY 55 HN GLY 55 60.933 8.761 -2.276
441 HA2 GLY 55 HA2 GLY 55 63.070 8.415 -3.205
442 HA3 GLY 55 HA1 GLY 55 63.633 9.020 -1.646
443 H MET 56 HN MET 56 62.445 6.020 -3.175
444 HA MET 56 HA MET 56 64.658 4.486 -2.154
445 HB2 MET 56 HB2 MET 56 63.635 3.229 -0.432
446 HB3 MET 56 HB1 MET 56 63.129 4.886 -0.111
447 HG2 MET 56 HG2 MET 56 61.018 4.362 -1.455
448 HG3 MET 56 HG1 MET 56 61.506 2.670 -1.381
449 HE1 MET 56 HE1 MET 56 58.645 2.688 1.115
450 HE2 MET 56 HE2 MET 56 59.187 2.417 -0.539
451 HE3 MET 56 HE3 MET 56 58.679 4.029 -0.039
452 H THR 57 HN THR 57 64.882 2.701 -3.448
453 HA THR 57 HA THR 57 62.519 1.437 -4.678
454 HB THR 57 HB THR 57 63.482 1.691 -6.985
455 HG1 THR 57 HG1 THR 57 65.469 2.750 -5.554
456 HG21 THR 57 HG21 THR 57 62.558 3.851 -7.356
457 HG22 THR 57 HG22 THR 57 62.971 4.390 -5.728
458 HG23 THR 57 HG23 THR 57 61.686 3.205 -5.967
459 H GLN 58 HN GLN 58 65.708 1.386 -3.534
460 HA GLN 58 HA GLN 58 66.500 -1.079 -4.924
461 HB2 GLN 58 HB2 GLN 58 67.744 0.569 -2.712
462 HB3 GLN 58 HB1 GLN 58 68.436 -0.960 -3.256
463 HG2 GLN 58 HG2 GLN 58 68.625 -0.089 -5.542
464 HG3 GLN 58 HG1 GLN 58 67.879 1.428 -5.040
465 HE21 GLN 58 HE21 GLN 58 69.124 2.266 -2.835
466 HE22 GLN 58 HE22 GLN 58 70.811 2.325 -3.011
467 H ARG 59 HN ARG 59 65.238 -0.140 -1.754
468 HA ARG 59 HA ARG 59 64.497 -1.475 0.035
469 HB2 ARG 59 HB2 ARG 59 63.796 -3.038 -2.446
470 HB3 ARG 59 HB1 ARG 59 63.427 -3.700 -0.854
471 HG2 ARG 59 HG2 ARG 59 62.601 -0.872 -1.499
472 HG3 ARG 59 HG1 ARG 59 61.638 -2.212 -2.113
473 HD2 ARG 59 HD2 ARG 59 61.428 -3.094 0.207
474 HD3 ARG 59 HD1 ARG 59 62.315 -1.690 0.799
475 HE ARG 59 HE ARG 59 60.228 -0.585 -0.646
476 HH11 ARG 59 HH21 ARG 59 60.567 -2.903 1.885
477 HH12 ARG 59 HH22 ARG 59 59.040 -2.529 2.613
478 HH21 ARG 59 HH11 ARG 59 58.233 -0.083 0.292
479 HH22 ARG 59 HH12 ARG 59 57.720 -0.933 1.711
480 H ARG 60 HN ARG 60 67.083 -1.591 0.217
481 HA ARG 60 HA ARG 60 68.978 -2.897 0.702
482 HB2 ARG 60 HB2 ARG 60 66.901 -4.954 1.487
483 HB3 ARG 60 HB1 ARG 60 68.523 -4.762 2.150
484 HG2 ARG 60 HG2 ARG 60 66.258 -2.760 2.396
485 HG3 ARG 60 HG1 ARG 60 66.853 -3.808 3.683
486 HD2 ARG 60 HD2 ARG 60 69.167 -2.708 3.200
487 HD3 ARG 60 HD1 ARG 60 68.224 -1.461 2.382
488 HE ARG 60 HE ARG 60 66.984 -1.711 4.844
489 HH11 ARG 60 HH21 ARG 60 70.198 -1.203 3.703
490 HH12 ARG 60 HH22 ARG 60 70.677 -0.261 5.074
491 HH21 ARG 60 HH11 ARG 60 67.594 -0.484 6.642
492 HH22 ARG 60 HH12 ARG 60 69.204 0.147 6.738
493 H ARG 61 HN ARG 61 68.214 -6.023 0.568
494 HA ARG 61 HA ARG 61 69.459 -6.375 -2.053
495 HB2 ARG 61 HB2 ARG 61 68.245 -8.518 -0.282
496 HB3 ARG 61 HB1 ARG 61 69.438 -8.735 -1.559
497 HG2 ARG 61 HG2 ARG 61 70.981 -8.629 0.136
498 HG3 ARG 61 HG1 ARG 61 70.725 -6.889 0.053
499 HD2 ARG 61 HD2 ARG 61 70.495 -7.585 2.363
500 HD3 ARG 61 HD1 ARG 61 68.893 -7.153 1.766
501 HE ARG 61 HE ARG 61 69.062 -9.876 1.286
502 HH11 ARG 61 HH21 ARG 61 69.516 -7.775 3.983
503 HH12 ARG 61 HH22 ARG 61 69.015 -8.951 5.153
504 HH21 ARG 61 HH11 ARG 61 68.407 -11.422 2.797
505 HH22 ARG 61 HH12 ARG 61 68.388 -11.016 4.480
506 H GLY 62 HN GLY 62 67.175 -5.008 -2.548
507 HA2 GLY 62 HA2 GLY 62 64.857 -6.653 -3.015
508 HA3 GLY 62 HA1 GLY 62 65.152 -5.071 -3.740
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 55.645 9.259 9.498
2 H2 MET 1 HT2 MET 1 57.317 9.562 9.504
3 H3 MET 1 HT3 MET 1 56.509 9.209 10.956
4 HA MET 1 HA MET 1 57.477 7.424 8.886
5 HB2 MET 1 HB2 MET 1 56.846 7.170 11.843
6 HB3 MET 1 HB1 MET 1 57.591 5.904 10.866
7 HG2 MET 1 HG2 MET 1 59.513 7.294 10.409
8 HG3 MET 1 HG1 MET 1 58.744 8.690 11.164
9 HE1 MET 1 HE1 MET 1 58.612 4.891 12.722
10 HE2 MET 1 HE2 MET 1 60.337 4.878 13.080
11 HE3 MET 1 HE3 MET 1 59.788 5.163 11.430
12 H VAL 2 HN VAL 2 54.441 8.483 9.747
13 HA VAL 2 HA VAL 2 52.923 6.101 10.015
14 HB VAL 2 HB VAL 2 52.096 8.664 8.619
15 HG11 VAL 2 HG11 VAL 2 50.480 6.953 8.185
16 HG12 VAL 2 HG12 VAL 2 49.827 7.909 9.515
17 HG13 VAL 2 HG13 VAL 2 50.578 6.346 9.838
18 HG21 VAL 2 HG21 VAL 2 52.979 9.090 10.880
19 HG22 VAL 2 HG22 VAL 2 51.928 7.834 11.536
20 HG23 VAL 2 HG23 VAL 2 51.228 9.303 10.855
21 H ARG 3 HN ARG 3 54.316 7.644 7.179
22 HA ARG 3 HA ARG 3 52.814 6.133 5.229
23 HB2 ARG 3 HB2 ARG 3 55.526 7.476 5.030
24 HB3 ARG 3 HB1 ARG 3 54.615 6.841 3.659
25 HG2 ARG 3 HG2 ARG 3 52.758 8.372 4.164
26 HG3 ARG 3 HG1 ARG 3 53.638 8.994 5.561
27 HD2 ARG 3 HD2 ARG 3 54.507 9.185 2.661
28 HD3 ARG 3 HD1 ARG 3 53.944 10.514 3.674
29 HE ARG 3 HE ARG 3 56.096 9.481 5.079
30 HH11 ARG 3 HH21 ARG 3 55.504 10.593 1.870
31 HH12 ARG 3 HH22 ARG 3 57.121 11.162 1.626
32 HH21 ARG 3 HH11 ARG 3 58.212 10.218 4.779
33 HH22 ARG 3 HH12 ARG 3 58.655 10.950 3.274
34 H GLN 4 HN GLN 4 55.666 5.486 7.149
35 HA GLN 4 HA GLN 4 56.588 3.241 5.556
36 HB2 GLN 4 HB2 GLN 4 57.179 4.263 8.333
37 HB3 GLN 4 HB1 GLN 4 57.800 2.697 7.812
38 HG2 GLN 4 HG2 GLN 4 58.964 3.719 5.941
39 HG3 GLN 4 HG1 GLN 4 58.240 5.287 6.296
40 HE21 GLN 4 HE21 GLN 4 60.548 6.067 6.539
41 HE22 GLN 4 HE22 GLN 4 61.353 5.792 8.007
42 H GLU 5 HN GLU 5 54.428 3.641 8.328
43 HA GLU 5 HA GLU 5 54.123 0.795 8.807
44 HB2 GLU 5 HB2 GLU 5 53.699 2.630 10.501
45 HB3 GLU 5 HB1 GLU 5 52.225 3.011 9.611
46 HG2 GLU 5 HG2 GLU 5 51.597 1.521 11.390
47 HG3 GLU 5 HG1 GLU 5 51.546 0.585 9.896
48 H GLU 6 HN GLU 6 52.041 3.261 7.243
49 HA GLU 6 HA GLU 6 49.960 1.465 6.526
50 HB2 GLU 6 HB2 GLU 6 50.857 4.159 5.550
51 HB3 GLU 6 HB1 GLU 6 49.745 3.258 4.521
52 HG2 GLU 6 HG2 GLU 6 48.561 4.757 6.116
53 HG3 GLU 6 HG1 GLU 6 48.151 3.059 6.363
54 H LEU 7 HN LEU 7 53.173 1.770 5.240
55 HA LEU 7 HA LEU 7 52.518 0.577 2.657
56 HB2 LEU 7 HB2 LEU 7 54.606 2.042 3.403
57 HB3 LEU 7 HB1 LEU 7 55.287 0.478 3.841
58 HG LEU 7 HG LEU 7 54.165 1.177 1.107
59 HD11 LEU 7 HD11 LEU 7 57.052 0.778 1.936
60 HD12 LEU 7 HD12 LEU 7 56.297 2.363 1.762
61 HD13 LEU 7 HD13 LEU 7 56.456 1.303 0.361
62 HD21 LEU 7 HD21 LEU 7 53.951 -1.162 1.344
63 HD22 LEU 7 HD22 LEU 7 55.422 -1.296 2.307
64 HD23 LEU 7 HD23 LEU 7 55.525 -0.987 0.574
65 H ALA 8 HN ALA 8 54.114 -0.586 5.640
66 HA ALA 8 HA ALA 8 54.442 -3.281 4.819
67 HB1 ALA 8 HB1 ALA 8 53.886 -2.218 7.609
68 HB2 ALA 8 HB2 ALA 8 55.479 -2.381 6.867
69 HB3 ALA 8 HB3 ALA 8 54.525 -3.818 7.234
70 H ALA 9 HN ALA 9 51.611 -1.544 5.899
71 HA ALA 9 HA ALA 9 50.016 -3.911 6.456
72 HB1 ALA 9 HB1 ALA 9 49.347 -1.895 7.561
73 HB2 ALA 9 HB2 ALA 9 48.104 -2.222 6.353
74 HB3 ALA 9 HB3 ALA 9 49.329 -0.993 6.045
75 H ALA 10 HN ALA 10 49.954 -1.481 3.808
76 HA ALA 10 HA ALA 10 48.092 -2.862 2.180
77 HB1 ALA 10 HB1 ALA 10 49.465 -1.682 0.262
78 HB2 ALA 10 HB2 ALA 10 50.299 -0.904 1.607
79 HB3 ALA 10 HB3 ALA 10 48.560 -0.700 1.415
80 H ARG 11 HN ARG 11 51.476 -3.374 2.795
81 HA ARG 11 HA ARG 11 51.955 -5.183 0.583
82 HB2 ARG 11 HB2 ARG 11 53.578 -3.901 2.336
83 HB3 ARG 11 HB1 ARG 11 53.488 -5.451 3.164
84 HG2 ARG 11 HG2 ARG 11 55.273 -5.902 1.776
85 HG3 ARG 11 HG1 ARG 11 53.976 -6.378 0.685
86 HD2 ARG 11 HD2 ARG 11 54.089 -3.748 0.077
87 HD3 ARG 11 HD1 ARG 11 55.760 -3.979 0.583
88 HE ARG 11 HE ARG 11 54.701 -4.750 -1.923
89 HH11 ARG 11 HH21 ARG 11 56.512 -6.147 0.665
90 HH12 ARG 11 HH22 ARG 11 57.098 -7.462 -0.290
91 HH21 ARG 11 HH11 ARG 11 55.479 -6.442 -3.174
92 HH22 ARG 11 HH12 ARG 11 56.524 -7.625 -2.460
93 H ALA 12 HN ALA 12 51.265 -5.661 4.111
94 HA ALA 12 HA ALA 12 51.196 -8.473 4.094
95 HB1 ALA 12 HB1 ALA 12 49.669 -8.294 6.036
96 HB2 ALA 12 HB2 ALA 12 49.412 -6.590 5.659
97 HB3 ALA 12 HB3 ALA 12 51.006 -7.150 6.167
98 H ALA 13 HN ALA 13 49.166 -6.242 2.619
99 HA ALA 13 HA ALA 13 46.823 -7.941 2.382
100 HB1 ALA 13 HB1 ALA 13 47.013 -5.324 2.187
101 HB2 ALA 13 HB2 ALA 13 45.858 -6.186 1.171
102 HB3 ALA 13 HB3 ALA 13 47.402 -5.660 0.500
103 H LEU 14 HN LEU 14 49.576 -7.081 0.244
104 HA LEU 14 HA LEU 14 48.655 -8.519 -2.006
105 HB2 LEU 14 HB2 LEU 14 51.155 -7.303 -1.252
106 HB3 LEU 14 HB1 LEU 14 51.500 -8.877 -1.942
107 HG LEU 14 HG LEU 14 49.674 -6.873 -3.301
108 HD11 LEU 14 HD11 LEU 14 51.967 -5.929 -2.961
109 HD12 LEU 14 HD12 LEU 14 51.562 -6.189 -4.654
110 HD13 LEU 14 HD13 LEU 14 52.624 -7.322 -3.817
111 HD21 LEU 14 HD21 LEU 14 49.836 -8.285 -5.167
112 HD22 LEU 14 HD22 LEU 14 49.747 -9.432 -3.834
113 HD23 LEU 14 HD23 LEU 14 51.304 -9.066 -4.574
114 H HIS 15 HN HIS 15 50.126 -9.659 0.961
115 HA HIS 15 HA HIS 15 50.554 -12.363 -0.042
116 HB2 HIS 15 HB2 HIS 15 51.834 -11.385 1.877
117 HB3 HIS 15 HB1 HIS 15 50.350 -11.405 2.828
118 HD1 HIS 15 HD1 HIS 15 51.375 -14.147 0.434
119 HD2 HIS 15 HD2 HIS 15 51.057 -13.521 4.543
120 HE1 HIS 15 HE1 HIS 15 51.725 -16.402 1.532
121 H ASP 16 HN ASP 16 47.986 -10.643 1.655
122 HA ASP 16 HA ASP 16 46.458 -13.046 2.227
123 HB2 ASP 16 HB2 ASP 16 46.367 -10.745 3.428
124 HB3 ASP 16 HB1 ASP 16 45.292 -10.267 2.114
125 H LEU 17 HN LEU 17 46.690 -10.855 -0.496
126 HA LEU 17 HA LEU 17 44.128 -11.708 -1.636
127 HB2 LEU 17 HB2 LEU 17 46.401 -10.112 -2.860
128 HB3 LEU 17 HB1 LEU 17 44.834 -10.368 -3.609
129 HG LEU 17 HG LEU 17 45.146 -9.132 -0.862
130 HD11 LEU 17 HD11 LEU 17 46.333 -7.792 -2.626
131 HD12 LEU 17 HD12 LEU 17 44.968 -6.946 -1.901
132 HD13 LEU 17 HD13 LEU 17 44.806 -7.674 -3.496
133 HD21 LEU 17 HD21 LEU 17 42.906 -9.818 -1.126
134 HD22 LEU 17 HD22 LEU 17 42.890 -9.446 -2.847
135 HD23 LEU 17 HD23 LEU 17 42.861 -8.144 -1.665
136 H MET 18 HN MET 18 47.478 -12.764 -1.876
137 HA MET 18 HA MET 18 46.835 -14.431 -4.251
138 HB2 MET 18 HB2 MET 18 49.337 -13.608 -2.818
139 HB3 MET 18 HB1 MET 18 49.372 -15.144 -3.682
140 HG2 MET 18 HG2 MET 18 48.996 -14.130 -5.764
141 HG3 MET 18 HG1 MET 18 48.303 -12.677 -5.047
142 HE1 MET 18 HE1 MET 18 50.877 -13.179 -7.309
143 HE2 MET 18 HE2 MET 18 51.548 -11.589 -6.963
144 HE3 MET 18 HE3 MET 18 49.801 -11.801 -7.039
145 H THR 19 HN THR 19 46.596 -14.692 -0.887
146 HA THR 19 HA THR 19 47.149 -17.610 -0.853
147 HB THR 19 HB THR 19 46.386 -17.259 1.625
148 HG1 THR 19 HG1 THR 19 46.386 -14.705 0.535
149 HG21 THR 19 HG21 THR 19 48.880 -15.882 0.581
150 HG22 THR 19 HG22 THR 19 48.727 -17.611 0.887
151 HG23 THR 19 HG23 THR 19 48.628 -16.467 2.226
152 H GLY 20 HN GLY 20 44.550 -15.616 -1.616
153 HA2 GLY 20 HA2 GLY 20 42.574 -17.039 -2.424
154 HA3 GLY 20 HA1 GLY 20 42.548 -17.706 -0.795
155 H LYS 21 HN LYS 21 42.820 -15.488 0.808
156 HA LYS 21 HA LYS 21 40.250 -14.411 0.938
157 HB2 LYS 21 HB2 LYS 21 42.740 -12.919 1.804
158 HB3 LYS 21 HB1 LYS 21 41.112 -12.756 2.460
159 HG2 LYS 21 HG2 LYS 21 41.414 -15.384 2.907
160 HG3 LYS 21 HG1 LYS 21 43.123 -14.946 2.884
161 HD2 LYS 21 HD2 LYS 21 42.475 -13.077 4.546
162 HD3 LYS 21 HD1 LYS 21 40.957 -13.951 4.741
163 HE2 LYS 21 HE2 LYS 21 42.276 -16.007 5.305
164 HE3 LYS 21 HE1 LYS 21 43.744 -15.030 5.255
165 HZ1 LYS 21 HZ1 LYS 21 42.570 -15.378 7.494
166 HZ2 LYS 21 HZ2 LYS 21 41.459 -14.221 6.934
167 HZ3 LYS 21 HZ3 LYS 21 43.102 -13.817 7.097
168 H ARG 22 HN ARG 22 39.523 -13.743 -1.079
169 HA ARG 22 HA ARG 22 40.965 -11.978 -2.806
170 HB2 ARG 22 HB2 ARG 22 38.188 -13.052 -2.584
171 HB3 ARG 22 HB1 ARG 22 38.428 -11.657 -3.639
172 HG2 ARG 22 HG2 ARG 22 40.137 -12.879 -4.900
173 HG3 ARG 22 HG1 ARG 22 39.994 -14.253 -3.805
174 HD2 ARG 22 HD2 ARG 22 37.706 -13.166 -5.469
175 HD3 ARG 22 HD1 ARG 22 38.702 -14.544 -5.937
176 HE ARG 22 HE ARG 22 37.810 -15.214 -3.404
177 HH11 ARG 22 HH21 ARG 22 36.377 -14.173 -6.362
178 HH12 ARG 22 HH22 ARG 22 34.898 -15.039 -6.105
179 HH21 ARG 22 HH11 ARG 22 35.887 -16.350 -3.052
180 HH22 ARG 22 HH12 ARG 22 34.621 -16.271 -4.231
181 H VAL 23 HN VAL 23 38.220 -11.374 -0.569
182 HA VAL 23 HA VAL 23 38.424 -8.469 -0.984
183 HB VAL 23 HB VAL 23 36.841 -8.522 1.109
184 HG11 VAL 23 HG11 VAL 23 36.230 -9.664 -1.621
185 HG12 VAL 23 HG12 VAL 23 35.849 -8.064 -0.986
186 HG13 VAL 23 HG13 VAL 23 34.963 -9.474 -0.409
187 HG21 VAL 23 HG21 VAL 23 37.623 -10.918 1.631
188 HG22 VAL 23 HG22 VAL 23 36.618 -11.424 0.272
189 HG23 VAL 23 HG23 VAL 23 35.882 -10.636 1.668
190 H ALA 24 HN ALA 24 39.601 -7.053 0.197
191 HA ALA 24 HA ALA 24 40.806 -7.938 2.794
192 HB1 ALA 24 HB1 ALA 24 42.606 -8.242 1.221
193 HB2 ALA 24 HB2 ALA 24 42.923 -6.736 2.082
194 HB3 ALA 24 HB3 ALA 24 42.266 -6.693 0.448
195 H THR 25 HN THR 25 41.251 -6.152 4.228
196 HA THR 25 HA THR 25 39.659 -3.693 3.554
197 HB THR 25 HB THR 25 40.700 -4.501 6.278
198 HG1 THR 25 HG1 THR 25 38.297 -5.237 4.969
199 HG21 THR 25 HG21 THR 25 38.893 -3.090 7.066
200 HG22 THR 25 HG22 THR 25 38.298 -2.876 5.419
201 HG23 THR 25 HG23 THR 25 39.850 -2.184 5.894
202 H VAL 26 HN VAL 26 40.614 -1.630 3.728
203 HA VAL 26 HA VAL 26 43.442 -1.452 4.597
204 HB VAL 26 HB VAL 26 43.295 -1.914 2.062
205 HG11 VAL 26 HG11 VAL 26 42.623 -0.144 0.624
206 HG12 VAL 26 HG12 VAL 26 42.519 1.006 1.952
207 HG13 VAL 26 HG13 VAL 26 41.327 -0.288 1.811
208 HG21 VAL 26 HG21 VAL 26 45.309 -1.018 3.132
209 HG22 VAL 26 HG22 VAL 26 44.630 0.609 3.089
210 HG23 VAL 26 HG23 VAL 26 45.047 -0.211 1.585
211 H GLN 27 HN GLN 27 43.723 0.343 5.773
212 HA GLN 27 HA GLN 27 41.558 2.323 5.962
213 HB2 GLN 27 HB2 GLN 27 44.237 2.060 7.367
214 HB3 GLN 27 HB1 GLN 27 43.078 3.346 7.704
215 HG2 GLN 27 HG2 GLN 27 41.388 1.694 8.347
216 HG3 GLN 27 HG1 GLN 27 42.496 0.381 7.949
217 HE21 GLN 27 HE21 GLN 27 43.683 3.338 9.476
218 HE22 GLN 27 HE22 GLN 27 44.020 2.638 10.985
219 H LYS 28 HN LYS 28 41.500 3.976 4.505
220 HA LYS 28 HA LYS 28 44.093 5.179 3.595
221 HB2 LYS 28 HB2 LYS 28 43.020 3.635 1.891
222 HB3 LYS 28 HB1 LYS 28 41.667 4.767 1.833
223 HG2 LYS 28 HG2 LYS 28 43.407 6.588 1.352
224 HG3 LYS 28 HG1 LYS 28 44.550 5.273 1.070
225 HD2 LYS 28 HD2 LYS 28 41.898 5.598 -0.367
226 HD3 LYS 28 HD1 LYS 28 43.466 6.049 -1.035
227 HE2 LYS 28 HE2 LYS 28 43.125 3.894 -1.911
228 HE3 LYS 28 HE1 LYS 28 44.142 3.583 -0.504
229 HZ1 LYS 28 HZ1 LYS 28 42.506 2.496 0.521
230 HZ2 LYS 28 HZ2 LYS 28 41.752 2.419 -0.999
231 HZ3 LYS 28 HZ3 LYS 28 41.333 3.646 0.098
232 H ASP 29 HN ASP 29 44.049 7.473 3.880
233 HA ASP 29 HA ASP 29 43.117 9.597 4.428
234 HB2 ASP 29 HB2 ASP 29 40.785 8.624 2.754
235 HB3 ASP 29 HB1 ASP 29 41.301 10.290 3.017
236 H GLY 30 HN GLY 30 42.503 7.286 6.191
237 HA2 GLY 30 HA2 GLY 30 41.277 7.137 8.208
238 HA3 GLY 30 HA1 GLY 30 40.370 8.569 7.721
239 H ARG 31 HN ARG 31 39.723 7.318 5.072
240 HA ARG 31 HA ARG 31 37.392 5.764 6.022
241 HB2 ARG 31 HB2 ARG 31 37.786 7.629 3.950
242 HB3 ARG 31 HB1 ARG 31 37.604 6.097 3.105
243 HG2 ARG 31 HG2 ARG 31 35.663 7.338 5.084
244 HG3 ARG 31 HG1 ARG 31 35.407 7.091 3.359
245 HD2 ARG 31 HD2 ARG 31 35.945 4.527 4.107
246 HD3 ARG 31 HD1 ARG 31 35.213 5.127 5.593
247 HE ARG 31 HE ARG 31 33.479 5.983 3.611
248 HH11 ARG 31 HH21 ARG 31 34.927 3.002 4.560
249 HH12 ARG 31 HH22 ARG 31 33.594 2.032 4.028
250 HH21 ARG 31 HH11 ARG 31 31.731 4.734 2.911
251 HH22 ARG 31 HH12 ARG 31 31.785 3.012 3.094
252 H ARG 32 HN ARG 32 37.041 3.660 5.538
253 HA ARG 32 HA ARG 32 39.388 2.081 4.640
254 HB2 ARG 32 HB2 ARG 32 38.672 0.575 6.198
255 HB3 ARG 32 HB1 ARG 32 37.514 1.795 6.705
256 HG2 ARG 32 HG2 ARG 32 35.878 0.866 5.050
257 HG3 ARG 32 HG1 ARG 32 37.030 -0.421 4.688
258 HD2 ARG 32 HD2 ARG 32 37.005 -1.086 7.082
259 HD3 ARG 32 HD1 ARG 32 35.792 0.156 7.395
260 HE ARG 32 HE ARG 32 34.679 -1.347 5.353
261 HH11 ARG 32 HH21 ARG 32 36.045 -1.970 8.457
262 HH12 ARG 32 HH22 ARG 32 35.045 -3.350 8.767
263 HH21 ARG 32 HH11 ARG 32 33.365 -3.145 5.740
264 HH22 ARG 32 HH12 ARG 32 33.528 -4.015 7.229
265 H VAL 33 HN VAL 33 39.249 0.578 2.918
266 HA VAL 33 HA VAL 33 36.745 0.549 1.289
267 HB VAL 33 HB VAL 33 39.493 1.244 0.190
268 HG11 VAL 33 HG11 VAL 33 38.417 -0.262 -1.362
269 HG12 VAL 33 HG12 VAL 33 38.199 1.369 -1.993
270 HG13 VAL 33 HG13 VAL 33 36.870 0.560 -1.169
271 HG21 VAL 33 HG21 VAL 33 36.878 2.746 0.474
272 HG22 VAL 33 HG22 VAL 33 38.097 3.233 -0.703
273 HG23 VAL 33 HG23 VAL 33 38.481 3.245 1.016
274 H GLU 34 HN GLU 34 36.489 -1.339 0.114
275 HA GLU 34 HA GLU 34 38.376 -3.556 0.838
276 HB2 GLU 34 HB2 GLU 34 35.394 -3.420 0.405
277 HB3 GLU 34 HB1 GLU 34 36.236 -4.961 0.245
278 HG2 GLU 34 HG2 GLU 34 37.006 -4.881 2.507
279 HG3 GLU 34 HG1 GLU 34 36.533 -3.191 2.682
280 H PHE 35 HN PHE 35 39.789 -3.733 -0.937
281 HA PHE 35 HA PHE 35 38.620 -3.705 -3.679
282 HB2 PHE 35 HB2 PHE 35 41.425 -3.632 -2.565
283 HB3 PHE 35 HB1 PHE 35 41.173 -4.133 -4.230
284 HD1 PHE 35 HD2 PHE 35 39.309 -2.476 -5.479
285 HD2 PHE 35 HD1 PHE 35 42.027 -1.405 -2.328
286 HE1 PHE 35 HE2 PHE 35 39.190 -0.102 -6.176
287 HE2 PHE 35 HE1 PHE 35 41.917 0.964 -3.031
288 HZ PHE 35 HZ PHE 35 40.493 1.619 -4.956
289 H THR 36 HN THR 36 38.613 -5.588 -4.975
290 HA THR 36 HA THR 36 39.187 -8.150 -3.521
291 HB THR 36 HB THR 36 37.651 -9.209 -5.088
292 HG1 THR 36 HG1 THR 36 36.943 -6.790 -6.247
293 HG21 THR 36 HG21 THR 36 35.643 -8.306 -4.291
294 HG22 THR 36 HG22 THR 36 36.248 -6.653 -4.349
295 HG23 THR 36 HG23 THR 36 36.807 -7.753 -3.090
296 H ALA 37 HN ALA 37 40.008 -9.943 -5.133
297 HA ALA 37 HA ALA 37 42.473 -9.124 -6.274
298 HB1 ALA 37 HB1 ALA 37 42.278 -11.344 -7.575
299 HB2 ALA 37 HB2 ALA 37 40.744 -11.557 -6.735
300 HB3 ALA 37 HB3 ALA 37 42.244 -11.440 -5.816
301 H THR 38 HN THR 38 39.333 -8.616 -7.457
302 HA THR 38 HA THR 38 39.756 -8.818 -10.276
303 HB THR 38 HB THR 38 37.804 -7.301 -10.474
304 HG1 THR 38 HG1 THR 38 37.212 -6.102 -8.853
305 HG21 THR 38 HG21 THR 38 37.697 -9.824 -9.715
306 HG22 THR 38 HG22 THR 38 36.245 -8.826 -9.637
307 HG23 THR 38 HG23 THR 38 37.178 -9.134 -8.175
308 H SER 39 HN SER 39 40.743 -6.411 -7.952
309 HA SER 39 HA SER 39 41.878 -4.762 -10.198
310 HB2 SER 39 HB2 SER 39 41.294 -2.753 -9.089
311 HB3 SER 39 HB1 SER 39 39.850 -3.754 -8.966
312 HG SER 39 HG SER 39 41.873 -3.377 -7.005
313 H VAL 40 HN VAL 40 43.492 -6.672 -9.204
314 HA VAL 40 HA VAL 40 44.980 -5.703 -6.871
315 HB VAL 40 HB VAL 40 44.850 -8.097 -7.184
316 HG11 VAL 40 HG11 VAL 40 45.746 -9.226 -9.163
317 HG12 VAL 40 HG12 VAL 40 46.301 -7.696 -9.835
318 HG13 VAL 40 HG13 VAL 40 44.572 -8.022 -9.698
319 HG21 VAL 40 HG21 VAL 40 47.179 -8.645 -6.955
320 HG22 VAL 40 HG22 VAL 40 47.027 -6.984 -6.372
321 HG23 VAL 40 HG23 VAL 40 47.665 -7.299 -7.985
322 H SER 41 HN SER 41 45.000 -4.908 -10.194
323 HA SER 41 HA SER 41 47.835 -4.383 -10.475
324 HB2 SER 41 HB2 SER 41 47.115 -3.066 -12.471
325 HB3 SER 41 HB1 SER 41 46.454 -4.697 -12.454
326 HG SER 41 HG SER 41 45.132 -2.443 -12.611
327 H ASP 42 HN ASP 42 44.999 -2.325 -9.772
328 HA ASP 42 HA ASP 42 46.355 0.153 -9.613
329 HB2 ASP 42 HB2 ASP 42 44.488 0.927 -8.276
330 HB3 ASP 42 HB1 ASP 42 43.858 -0.187 -9.491
331 H LEU 43 HN LEU 43 46.047 -2.454 -7.156
332 HA LEU 43 HA LEU 43 47.184 -0.953 -5.009
333 HB2 LEU 43 HB2 LEU 43 45.989 -3.258 -4.964
334 HB3 LEU 43 HB1 LEU 43 47.561 -3.928 -5.379
335 HG LEU 43 HG LEU 43 48.540 -2.897 -3.338
336 HD11 LEU 43 HD11 LEU 43 46.555 -2.189 -1.643
337 HD12 LEU 43 HD12 LEU 43 45.784 -1.713 -3.155
338 HD13 LEU 43 HD13 LEU 43 47.336 -1.018 -2.698
339 HD21 LEU 43 HD21 LEU 43 46.033 -4.444 -2.635
340 HD22 LEU 43 HD22 LEU 43 47.588 -4.469 -1.806
341 HD23 LEU 43 HD23 LEU 43 47.428 -5.197 -3.406
342 H LYS 44 HN LYS 44 48.607 -2.840 -7.643
343 HA LYS 44 HA LYS 44 51.313 -2.740 -6.656
344 HB2 LYS 44 HB2 LYS 44 49.992 -3.333 -9.276
345 HB3 LYS 44 HB1 LYS 44 51.702 -2.913 -9.333
346 HG2 LYS 44 HG2 LYS 44 52.299 -4.735 -7.911
347 HG3 LYS 44 HG1 LYS 44 50.621 -5.030 -7.461
348 HD2 LYS 44 HD2 LYS 44 50.079 -5.856 -9.632
349 HD3 LYS 44 HD1 LYS 44 51.586 -5.247 -10.317
350 HE2 LYS 44 HE2 LYS 44 51.508 -7.334 -8.130
351 HE3 LYS 44 HE1 LYS 44 51.541 -7.747 -9.846
352 HZ1 LYS 44 HZ1 LYS 44 53.704 -7.344 -9.922
353 HZ2 LYS 44 HZ2 LYS 44 53.698 -7.156 -8.233
354 HZ3 LYS 44 HZ3 LYS 44 53.511 -5.802 -9.241
355 H LYS 45 HN LYS 45 49.469 -0.608 -8.851
356 HA LYS 45 HA LYS 45 51.664 1.168 -9.383
357 HB2 LYS 45 HB2 LYS 45 49.423 0.925 -10.632
358 HB3 LYS 45 HB1 LYS 45 48.751 1.964 -9.379
359 HG2 LYS 45 HG2 LYS 45 50.379 3.718 -9.912
360 HG3 LYS 45 HG1 LYS 45 51.142 2.672 -11.106
361 HD2 LYS 45 HD2 LYS 45 49.696 4.126 -12.339
362 HD3 LYS 45 HD1 LYS 45 48.891 2.559 -12.287
363 HE2 LYS 45 HE2 LYS 45 47.327 3.284 -10.666
364 HE3 LYS 45 HE1 LYS 45 48.305 4.679 -10.216
365 HZ1 LYS 45 HZ1 LYS 45 46.320 4.486 -12.202
366 HZ2 LYS 45 HZ2 LYS 45 47.800 4.886 -12.935
367 HZ3 LYS 45 HZ3 LYS 45 47.176 5.856 -11.686
368 H TYR 46 HN TYR 46 49.076 1.190 -6.951
369 HA TYR 46 HA TYR 46 49.612 3.741 -5.822
370 HB2 TYR 46 HB2 TYR 46 47.610 2.424 -5.286
371 HB3 TYR 46 HB1 TYR 46 48.609 1.206 -4.507
372 HD1 TYR 46 HD1 TYR 46 48.248 4.954 -4.385
373 HD2 TYR 46 HD2 TYR 46 48.608 1.283 -2.174
374 HE1 TYR 46 HE1 TYR 46 48.094 6.216 -2.258
375 HE2 TYR 46 HE2 TYR 46 48.453 2.547 -0.049
376 HH TYR 46 HH TYR 46 48.533 4.614 0.868
377 H ILE 47 HN ILE 47 50.826 0.523 -4.831
378 HA ILE 47 HA ILE 47 52.541 1.352 -2.754
379 HB ILE 47 HB ILE 47 52.960 -0.844 -4.804
380 HG12 ILE 47 HG12 ILE 47 51.996 -1.176 -1.957
381 HG13 ILE 47 HG11 ILE 47 50.861 -0.817 -3.258
382 HG21 ILE 47 HG21 ILE 47 55.072 -0.440 -3.771
383 HG22 ILE 47 HG22 ILE 47 54.381 -1.820 -2.918
384 HG23 ILE 47 HG23 ILE 47 54.335 -0.216 -2.185
385 HD11 ILE 47 HD11 ILE 47 52.833 -3.053 -3.645
386 HD12 ILE 47 HD12 ILE 47 51.219 -2.852 -4.323
387 HD13 ILE 47 HD13 ILE 47 51.410 -3.329 -2.637
388 H ALA 48 HN ALA 48 53.349 0.899 -6.206
389 HA ALA 48 HA ALA 48 56.008 1.774 -6.118
390 HB1 ALA 48 HB1 ALA 48 55.741 2.334 -8.507
391 HB2 ALA 48 HB2 ALA 48 53.988 2.246 -8.329
392 HB3 ALA 48 HB3 ALA 48 54.968 0.795 -8.126
393 H GLU 49 HN GLU 49 53.042 3.725 -6.393
394 HA GLU 49 HA GLU 49 54.261 6.230 -6.867
395 HB2 GLU 49 HB2 GLU 49 51.752 5.574 -6.851
396 HB3 GLU 49 HB1 GLU 49 51.817 5.902 -5.120
397 HG2 GLU 49 HG2 GLU 49 52.776 8.168 -5.673
398 HG3 GLU 49 HG1 GLU 49 52.444 7.823 -7.370
399 H LEU 50 HN LEU 50 54.019 4.344 -3.919
400 HA LEU 50 HA LEU 50 54.749 6.605 -2.195
401 HB2 LEU 50 HB2 LEU 50 54.841 3.651 -1.523
402 HB3 LEU 50 HB1 LEU 50 54.765 5.003 -0.393
403 HG LEU 50 HG LEU 50 52.613 4.218 -2.381
404 HD11 LEU 50 HD11 LEU 50 52.487 4.252 0.639
405 HD12 LEU 50 HD12 LEU 50 52.953 2.815 -0.271
406 HD13 LEU 50 HD13 LEU 50 51.350 3.513 -0.487
407 HD21 LEU 50 HD21 LEU 50 52.955 6.587 -0.539
408 HD22 LEU 50 HD22 LEU 50 51.342 6.004 -0.946
409 HD23 LEU 50 HD23 LEU 50 52.422 6.560 -2.220
410 H GLU 51 HN GLU 51 56.435 3.988 -3.854
411 HA GLU 51 HA GLU 51 58.913 4.229 -2.426
412 HB2 GLU 51 HB2 GLU 51 58.223 3.234 -5.196
413 HB3 GLU 51 HB1 GLU 51 59.879 3.239 -4.591
414 HG2 GLU 51 HG2 GLU 51 59.353 1.737 -2.823
415 HG3 GLU 51 HG1 GLU 51 57.617 1.967 -3.040
416 H VAL 52 HN VAL 52 57.484 6.031 -5.082
417 HA VAL 52 HA VAL 52 59.971 7.473 -5.667
418 HB VAL 52 HB VAL 52 57.146 8.127 -6.559
419 HG11 VAL 52 HG11 VAL 52 58.456 9.127 -8.501
420 HG12 VAL 52 HG12 VAL 52 59.910 8.898 -7.531
421 HG13 VAL 52 HG13 VAL 52 58.632 9.973 -6.964
422 HG21 VAL 52 HG21 VAL 52 57.691 5.832 -7.209
423 HG22 VAL 52 HG22 VAL 52 59.262 6.350 -7.819
424 HG23 VAL 52 HG23 VAL 52 57.787 6.873 -8.630
425 H GLN 53 HN GLN 53 57.093 7.934 -3.688
426 HA GLN 53 HA GLN 53 57.664 10.758 -3.180
427 HB2 GLN 53 HB2 GLN 53 55.739 8.764 -1.968
428 HB3 GLN 53 HB1 GLN 53 55.903 10.409 -1.354
429 HG2 GLN 53 HG2 GLN 53 55.337 11.319 -3.554
430 HG3 GLN 53 HG1 GLN 53 55.244 9.690 -4.225
431 HE21 GLN 53 HE21 GLN 53 54.027 10.696 -1.013
432 HE22 GLN 53 HE22 GLN 53 52.395 10.376 -1.355
433 H THR 54 HN THR 54 58.227 7.665 -1.539
434 HA THR 54 HA THR 54 59.605 9.081 0.690
435 HB THR 54 HB THR 54 59.255 6.087 0.474
436 HG1 THR 54 HG1 THR 54 57.339 7.616 1.780
437 HG21 THR 54 HG21 THR 54 59.342 8.055 2.780
438 HG22 THR 54 HG22 THR 54 60.623 6.937 2.314
439 HG23 THR 54 HG23 THR 54 59.100 6.317 2.949
440 H GLY 55 HN GLY 55 60.504 8.464 -2.253
441 HA2 GLY 55 HA2 GLY 55 63.054 7.033 -1.641
442 HA3 GLY 55 HA1 GLY 55 62.411 7.335 -3.256
443 H MET 56 HN MET 56 64.267 8.677 -0.632
444 HA MET 56 HA MET 56 64.441 11.349 -1.796
445 HB2 MET 56 HB2 MET 56 65.915 9.935 0.434
446 HB3 MET 56 HB1 MET 56 66.347 11.563 -0.089
447 HG2 MET 56 HG2 MET 56 64.781 11.683 1.793
448 HG3 MET 56 HG1 MET 56 64.012 12.297 0.329
449 HE1 MET 56 HE1 MET 56 61.464 11.835 0.408
450 HE2 MET 56 HE2 MET 56 62.060 12.057 2.052
451 HE3 MET 56 HE3 MET 56 60.895 10.781 1.709
452 H THR 57 HN THR 57 66.582 12.246 -2.515
453 HA THR 57 HA THR 57 67.811 10.426 -4.445
454 HB THR 57 HB THR 57 69.291 12.501 -4.863
455 HG1 THR 57 HG1 THR 57 68.976 14.153 -3.621
456 HG21 THR 57 HG21 THR 57 67.304 13.752 -5.879
457 HG22 THR 57 HG22 THR 57 66.285 12.501 -5.167
458 HG23 THR 57 HG23 THR 57 67.499 12.070 -6.371
459 H GLN 58 HN GLN 58 69.771 9.403 -4.236
460 HA GLN 58 HA GLN 58 71.021 9.375 -1.587
461 HB2 GLN 58 HB2 GLN 58 70.762 7.313 -2.982
462 HB3 GLN 58 HB1 GLN 58 71.904 7.997 -4.139
463 HG2 GLN 58 HG2 GLN 58 73.654 8.062 -2.455
464 HG3 GLN 58 HG1 GLN 58 72.522 7.541 -1.206
465 HE21 GLN 58 HE21 GLN 58 71.561 5.302 -1.504
466 HE22 GLN 58 HE22 GLN 58 72.478 4.126 -2.314
467 H ARG 59 HN ARG 59 72.445 10.932 -1.037
468 HA ARG 59 HA ARG 59 74.172 12.508 -1.214
469 HB2 ARG 59 HB2 ARG 59 75.300 10.314 -1.941
470 HB3 ARG 59 HB1 ARG 59 75.112 10.899 -3.591
471 HG2 ARG 59 HG2 ARG 59 77.287 11.618 -2.913
472 HG3 ARG 59 HG1 ARG 59 76.263 13.041 -2.855
473 HD2 ARG 59 HD2 ARG 59 76.680 13.320 -0.641
474 HD3 ARG 59 HD1 ARG 59 76.155 11.684 -0.274
475 HE ARG 59 HE ARG 59 78.839 12.619 -0.243
476 HH11 ARG 59 HH21 ARG 59 77.020 10.024 -1.617
477 HH12 ARG 59 HH22 ARG 59 78.391 8.976 -1.756
478 HH21 ARG 59 HH11 ARG 59 80.617 11.264 -0.417
479 HH22 ARG 59 HH12 ARG 59 80.422 9.676 -1.078
480 H ARG 60 HN ARG 60 73.326 14.440 -1.898
481 HA ARG 60 HA ARG 60 73.700 15.257 -4.636
482 HB2 ARG 60 HB2 ARG 60 71.551 13.822 -4.687
483 HB3 ARG 60 HB1 ARG 60 70.797 15.147 -3.800
484 HG2 ARG 60 HG2 ARG 60 71.481 16.717 -5.597
485 HG3 ARG 60 HG1 ARG 60 72.172 15.365 -6.494
486 HD2 ARG 60 HD2 ARG 60 69.995 14.303 -6.678
487 HD3 ARG 60 HD1 ARG 60 69.268 15.536 -5.647
488 HE ARG 60 HE ARG 60 70.363 16.987 -7.737
489 HH11 ARG 60 HH21 ARG 60 68.242 14.290 -7.404
490 HH12 ARG 60 HH22 ARG 60 67.348 14.644 -8.844
491 HH21 ARG 60 HH11 ARG 60 69.209 17.466 -9.620
492 HH22 ARG 60 HH12 ARG 60 67.896 16.444 -10.099
493 H ARG 61 HN ARG 61 74.614 16.352 -2.290
494 HA ARG 61 HA ARG 61 72.843 18.474 -1.353
495 HB2 ARG 61 HB2 ARG 61 75.845 18.279 -0.978
496 HB3 ARG 61 HB1 ARG 61 74.696 19.174 0.017
497 HG2 ARG 61 HG2 ARG 61 74.713 16.158 -0.315
498 HG3 ARG 61 HG1 ARG 61 75.373 17.023 1.072
499 HD2 ARG 61 HD2 ARG 61 73.009 18.103 1.245
500 HD3 ARG 61 HD1 ARG 61 72.496 16.769 0.211
501 HE ARG 61 HE ARG 61 73.906 15.522 2.243
502 HH11 ARG 61 HH21 ARG 61 71.308 17.778 2.015
503 HH12 ARG 61 HH22 ARG 61 70.542 17.246 3.474
504 HH21 ARG 61 HH11 ARG 61 72.920 14.815 4.151
505 HH22 ARG 61 HH12 ARG 61 71.454 15.568 4.684
506 H GLY 62 HN GLY 62 75.618 18.245 -3.561
507 HA2 GLY 62 HA2 GLY 62 74.729 20.409 -5.195
508 HA3 GLY 62 HA1 GLY 62 75.950 21.015 -4.074
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 55.458 9.615 12.269
2 H2 MET 1 HT2 MET 1 55.738 11.065 11.429
3 H3 MET 1 HT3 MET 1 57.046 10.100 11.921
4 HA MET 1 HA MET 1 55.911 10.057 9.466
5 HB2 MET 1 HB2 MET 1 57.465 7.936 10.977
6 HB3 MET 1 HB1 MET 1 57.193 7.897 9.234
7 HG2 MET 1 HG2 MET 1 58.458 10.255 10.649
8 HG3 MET 1 HG1 MET 1 59.397 8.934 9.952
9 HE1 MET 1 HE1 MET 1 60.205 8.841 7.730
10 HE2 MET 1 HE2 MET 1 59.280 9.253 6.289
11 HE3 MET 1 HE3 MET 1 58.662 8.040 7.407
12 H VAL 2 HN VAL 2 54.599 8.542 8.311
13 HA VAL 2 HA VAL 2 53.094 6.525 9.882
14 HB VAL 2 HB VAL 2 51.695 8.675 8.264
15 HG11 VAL 2 HG11 VAL 2 50.451 6.611 8.252
16 HG12 VAL 2 HG12 VAL 2 49.681 7.676 9.429
17 HG13 VAL 2 HG13 VAL 2 50.732 6.369 9.976
18 HG21 VAL 2 HG21 VAL 2 52.062 8.315 11.251
19 HG22 VAL 2 HG22 VAL 2 50.830 9.364 10.549
20 HG23 VAL 2 HG23 VAL 2 52.538 9.705 10.274
21 H ARG 3 HN ARG 3 53.711 8.058 6.731
22 HA ARG 3 HA ARG 3 52.517 6.144 5.048
23 HB2 ARG 3 HB2 ARG 3 55.084 7.713 4.672
24 HB3 ARG 3 HB1 ARG 3 54.303 6.784 3.390
25 HG2 ARG 3 HG2 ARG 3 52.336 8.155 3.477
26 HG3 ARG 3 HG1 ARG 3 52.870 8.936 4.966
27 HD2 ARG 3 HD2 ARG 3 54.405 9.109 2.361
28 HD3 ARG 3 HD1 ARG 3 53.215 10.311 2.864
29 HE ARG 3 HE ARG 3 54.927 10.128 5.035
30 HH11 ARG 3 HH21 ARG 3 55.234 10.660 1.643
31 HH12 ARG 3 HH22 ARG 3 56.641 11.658 1.791
32 HH21 ARG 3 HH11 ARG 3 56.763 11.429 5.250
33 HH22 ARG 3 HH12 ARG 3 57.507 12.093 3.834
34 H GLN 4 HN GLN 4 55.287 5.846 7.101
35 HA GLN 4 HA GLN 4 56.516 3.617 5.715
36 HB2 GLN 4 HB2 GLN 4 56.764 4.806 8.474
37 HB3 GLN 4 HB1 GLN 4 57.541 3.267 8.103
38 HG2 GLN 4 HG2 GLN 4 58.747 4.311 6.231
39 HG3 GLN 4 HG1 GLN 4 57.957 5.851 6.567
40 HE21 GLN 4 HE21 GLN 4 60.528 6.275 6.756
41 HE22 GLN 4 HE22 GLN 4 61.136 6.181 8.337
42 H GLU 5 HN GLU 5 54.429 3.860 8.607
43 HA GLU 5 HA GLU 5 54.129 1.012 8.916
44 HB2 GLU 5 HB2 GLU 5 53.691 2.524 10.782
45 HB3 GLU 5 HB1 GLU 5 52.398 3.310 9.876
46 HG2 GLU 5 HG2 GLU 5 51.043 1.336 9.918
47 HG3 GLU 5 HG1 GLU 5 52.381 0.351 10.512
48 H GLU 6 HN GLU 6 52.169 3.511 7.306
49 HA GLU 6 HA GLU 6 50.019 1.768 6.582
50 HB2 GLU 6 HB2 GLU 6 51.002 4.393 5.432
51 HB3 GLU 6 HB1 GLU 6 49.632 3.528 4.736
52 HG2 GLU 6 HG2 GLU 6 48.462 3.593 6.883
53 HG3 GLU 6 HG1 GLU 6 49.851 4.374 7.640
54 H LEU 7 HN LEU 7 53.251 2.027 5.373
55 HA LEU 7 HA LEU 7 52.664 0.977 2.720
56 HB2 LEU 7 HB2 LEU 7 54.707 2.272 3.074
57 HB3 LEU 7 HB1 LEU 7 55.237 1.147 4.318
58 HG LEU 7 HG LEU 7 55.524 -0.624 2.711
59 HD11 LEU 7 HD11 LEU 7 53.734 -0.432 1.197
60 HD12 LEU 7 HD12 LEU 7 55.125 0.014 0.213
61 HD13 LEU 7 HD13 LEU 7 54.070 1.268 0.864
62 HD21 LEU 7 HD21 LEU 7 56.610 2.032 1.730
63 HD22 LEU 7 HD22 LEU 7 57.165 0.468 1.132
64 HD23 LEU 7 HD23 LEU 7 57.400 0.898 2.826
65 H ALA 8 HN ALA 8 53.961 -0.368 5.754
66 HA ALA 8 HA ALA 8 54.243 -3.047 4.797
67 HB1 ALA 8 HB1 ALA 8 53.692 -2.093 7.625
68 HB2 ALA 8 HB2 ALA 8 55.289 -2.250 6.892
69 HB3 ALA 8 HB3 ALA 8 54.303 -3.684 7.177
70 H ALA 9 HN ALA 9 51.455 -1.221 5.803
71 HA ALA 9 HA ALA 9 49.767 -3.514 6.381
72 HB1 ALA 9 HB1 ALA 9 49.116 -1.455 7.394
73 HB2 ALA 9 HB2 ALA 9 47.912 -1.763 6.142
74 HB3 ALA 9 HB3 ALA 9 49.198 -0.591 5.859
75 H ALA 10 HN ALA 10 49.808 -1.182 3.636
76 HA ALA 10 HA ALA 10 47.948 -2.617 2.047
77 HB1 ALA 10 HB1 ALA 10 49.423 -1.498 0.107
78 HB2 ALA 10 HB2 ALA 10 50.091 -0.613 1.477
79 HB3 ALA 10 HB3 ALA 10 48.368 -0.524 1.133
80 H ARG 11 HN ARG 11 51.322 -3.111 2.709
81 HA ARG 11 HA ARG 11 51.812 -4.989 0.556
82 HB2 ARG 11 HB2 ARG 11 53.422 -3.641 2.283
83 HB3 ARG 11 HB1 ARG 11 53.354 -5.179 3.133
84 HG2 ARG 11 HG2 ARG 11 55.135 -5.648 1.750
85 HG3 ARG 11 HG1 ARG 11 53.847 -6.122 0.649
86 HD2 ARG 11 HD2 ARG 11 53.956 -3.506 0.026
87 HD3 ARG 11 HD1 ARG 11 55.615 -3.705 0.580
88 HE ARG 11 HE ARG 11 54.627 -4.512 -1.950
89 HH11 ARG 11 HH21 ARG 11 56.424 -5.841 0.685
90 HH12 ARG 11 HH22 ARG 11 57.069 -7.143 -0.251
91 HH21 ARG 11 HH11 ARG 11 55.484 -6.186 -3.174
92 HH22 ARG 11 HH12 ARG 11 56.549 -7.333 -2.432
93 H ALA 12 HN ALA 12 51.136 -5.371 4.100
94 HA ALA 12 HA ALA 12 51.083 -8.186 4.134
95 HB1 ALA 12 HB1 ALA 12 49.613 -7.981 6.111
96 HB2 ALA 12 HB2 ALA 12 49.324 -6.289 5.708
97 HB3 ALA 12 HB3 ALA 12 50.937 -6.818 6.184
98 H ALA 13 HN ALA 13 49.001 -5.998 2.656
99 HA ALA 13 HA ALA 13 46.676 -7.759 2.516
100 HB1 ALA 13 HB1 ALA 13 47.195 -5.384 0.721
101 HB2 ALA 13 HB2 ALA 13 46.663 -5.183 2.390
102 HB3 ALA 13 HB3 ALA 13 45.645 -6.048 1.238
103 H LEU 14 HN LEU 14 49.422 -6.919 0.401
104 HA LEU 14 HA LEU 14 48.391 -8.326 -1.864
105 HB2 LEU 14 HB2 LEU 14 50.629 -6.759 -1.430
106 HB3 LEU 14 HB1 LEU 14 51.336 -8.340 -1.714
107 HG LEU 14 HG LEU 14 49.310 -7.010 -3.549
108 HD11 LEU 14 HD11 LEU 14 51.113 -6.394 -4.963
109 HD12 LEU 14 HD12 LEU 14 52.271 -7.343 -4.031
110 HD13 LEU 14 HD13 LEU 14 51.584 -5.869 -3.350
111 HD21 LEU 14 HD21 LEU 14 49.363 -9.484 -3.640
112 HD22 LEU 14 HD22 LEU 14 51.104 -9.430 -3.909
113 HD23 LEU 14 HD23 LEU 14 50.003 -8.771 -5.118
114 H HIS 15 HN HIS 15 50.031 -9.383 1.020
115 HA HIS 15 HA HIS 15 50.668 -12.033 -0.023
116 HB2 HIS 15 HB2 HIS 15 51.926 -11.019 1.869
117 HB3 HIS 15 HB1 HIS 15 50.461 -11.070 2.849
118 HD1 HIS 15 HD1 HIS 15 49.786 -13.310 3.861
119 HD2 HIS 15 HD2 HIS 15 53.012 -13.635 1.240
120 HE1 HIS 15 HE1 HIS 15 50.689 -15.662 4.124
121 H ASP 16 HN ASP 16 48.005 -10.512 1.699
122 HA ASP 16 HA ASP 16 46.651 -13.003 2.324
123 HB2 ASP 16 HB2 ASP 16 46.306 -10.869 3.586
124 HB3 ASP 16 HB1 ASP 16 45.488 -10.211 2.169
125 H LEU 17 HN LEU 17 46.507 -10.662 -0.327
126 HA LEU 17 HA LEU 17 44.133 -11.832 -1.517
127 HB2 LEU 17 HB2 LEU 17 46.240 -10.008 -2.716
128 HB3 LEU 17 HB1 LEU 17 44.707 -10.404 -3.471
129 HG LEU 17 HG LEU 17 44.852 -9.209 -0.696
130 HD11 LEU 17 HD11 LEU 17 46.007 -7.716 -2.347
131 HD12 LEU 17 HD12 LEU 17 44.542 -7.005 -1.676
132 HD13 LEU 17 HD13 LEU 17 44.525 -7.689 -3.300
133 HD21 LEU 17 HD21 LEU 17 42.686 -10.074 -1.113
134 HD22 LEU 17 HD22 LEU 17 42.707 -9.564 -2.800
135 HD23 LEU 17 HD23 LEU 17 42.538 -8.369 -1.522
136 H MET 18 HN MET 18 47.539 -12.574 -1.681
137 HA MET 18 HA MET 18 47.203 -14.168 -4.146
138 HB2 MET 18 HB2 MET 18 49.415 -12.977 -2.691
139 HB3 MET 18 HB1 MET 18 49.751 -14.687 -2.935
140 HG2 MET 18 HG2 MET 18 50.629 -13.500 -4.840
141 HG3 MET 18 HG1 MET 18 49.186 -14.357 -5.381
142 HE1 MET 18 HE1 MET 18 50.453 -12.232 -7.015
143 HE2 MET 18 HE2 MET 18 49.196 -11.082 -7.465
144 HE3 MET 18 HE3 MET 18 48.863 -12.811 -7.528
145 H THR 19 HN THR 19 46.683 -14.641 -0.832
146 HA THR 19 HA THR 19 47.356 -17.537 -0.922
147 HB THR 19 HB THR 19 46.383 -17.338 1.518
148 HG1 THR 19 HG1 THR 19 45.682 -15.086 0.803
149 HG21 THR 19 HG21 THR 19 48.767 -17.673 0.971
150 HG22 THR 19 HG22 THR 19 48.576 -16.558 2.324
151 HG23 THR 19 HG23 THR 19 48.951 -15.938 0.716
152 H GLY 20 HN GLY 20 44.749 -15.593 -1.758
153 HA2 GLY 20 HA2 GLY 20 42.870 -16.989 -2.780
154 HA3 GLY 20 HA1 GLY 20 42.777 -17.802 -1.220
155 H LYS 21 HN LYS 21 43.007 -15.617 0.517
156 HA LYS 21 HA LYS 21 40.392 -14.693 0.781
157 HB2 LYS 21 HB2 LYS 21 43.024 -13.496 1.640
158 HB3 LYS 21 HB1 LYS 21 41.513 -12.658 1.977
159 HG2 LYS 21 HG2 LYS 21 42.290 -14.128 3.836
160 HG3 LYS 21 HG1 LYS 21 40.688 -14.547 3.232
161 HD2 LYS 21 HD2 LYS 21 41.552 -16.413 1.992
162 HD3 LYS 21 HD1 LYS 21 43.218 -15.899 2.266
163 HE2 LYS 21 HE2 LYS 21 42.885 -16.248 4.712
164 HE3 LYS 21 HE1 LYS 21 41.267 -16.863 4.377
165 HZ1 LYS 21 HZ1 LYS 21 42.698 -18.340 2.704
166 HZ2 LYS 21 HZ2 LYS 21 42.361 -18.812 4.300
167 HZ3 LYS 21 HZ3 LYS 21 43.857 -18.101 3.920
168 H ARG 22 HN ARG 22 39.408 -13.932 -1.107
169 HA ARG 22 HA ARG 22 40.740 -12.092 -2.878
170 HB2 ARG 22 HB2 ARG 22 38.681 -12.061 -4.118
171 HB3 ARG 22 HB1 ARG 22 38.941 -13.711 -3.553
172 HG2 ARG 22 HG2 ARG 22 37.487 -13.096 -1.540
173 HG3 ARG 22 HG1 ARG 22 37.038 -11.645 -2.437
174 HD2 ARG 22 HD2 ARG 22 35.383 -13.396 -2.847
175 HD3 ARG 22 HD1 ARG 22 36.289 -13.084 -4.327
176 HE ARG 22 HE ARG 22 37.682 -15.154 -3.119
177 HH11 ARG 22 HH21 ARG 22 34.418 -14.528 -4.035
178 HH12 ARG 22 HH22 ARG 22 34.046 -16.191 -4.343
179 HH21 ARG 22 HH11 ARG 22 37.215 -17.329 -3.516
180 HH22 ARG 22 HH12 ARG 22 35.629 -17.777 -4.049
181 H VAL 23 HN VAL 23 38.142 -11.686 -0.444
182 HA VAL 23 HA VAL 23 38.150 -8.762 -0.883
183 HB VAL 23 HB VAL 23 36.083 -10.082 -0.274
184 HG11 VAL 23 HG11 VAL 23 35.786 -10.912 1.944
185 HG12 VAL 23 HG12 VAL 23 37.235 -10.093 2.527
186 HG13 VAL 23 HG13 VAL 23 37.381 -11.484 1.453
187 HG21 VAL 23 HG21 VAL 23 36.154 -7.658 0.044
188 HG22 VAL 23 HG22 VAL 23 36.964 -7.858 1.599
189 HG23 VAL 23 HG23 VAL 23 35.296 -8.395 1.397
190 H ALA 24 HN ALA 24 39.292 -7.304 0.285
191 HA ALA 24 HA ALA 24 40.456 -8.084 2.917
192 HB1 ALA 24 HB1 ALA 24 42.668 -7.170 2.267
193 HB2 ALA 24 HB2 ALA 24 42.082 -6.948 0.620
194 HB3 ALA 24 HB3 ALA 24 42.236 -8.573 1.291
195 H THR 25 HN THR 25 40.978 -6.219 4.232
196 HA THR 25 HA THR 25 39.504 -3.748 3.361
197 HB THR 25 HB THR 25 40.407 -4.668 6.110
198 HG1 THR 25 HG1 THR 25 37.835 -4.458 5.991
199 HG21 THR 25 HG21 THR 25 38.928 -2.233 5.121
200 HG22 THR 25 HG22 THR 25 40.356 -2.299 6.154
201 HG23 THR 25 HG23 THR 25 38.787 -2.796 6.788
202 H VAL 26 HN VAL 26 40.511 -1.658 3.715
203 HA VAL 26 HA VAL 26 43.390 -1.630 4.367
204 HB VAL 26 HB VAL 26 43.105 -2.010 1.856
205 HG11 VAL 26 HG11 VAL 26 42.323 -0.218 0.495
206 HG12 VAL 26 HG12 VAL 26 42.286 0.901 1.851
207 HG13 VAL 26 HG13 VAL 26 41.108 -0.410 1.756
208 HG21 VAL 26 HG21 VAL 26 44.870 -0.434 1.298
209 HG22 VAL 26 HG22 VAL 26 45.143 -1.019 2.939
210 HG23 VAL 26 HG23 VAL 26 44.449 0.582 2.676
211 H GLN 27 HN GLN 27 43.901 0.167 5.483
212 HA GLN 27 HA GLN 27 41.829 2.206 5.946
213 HB2 GLN 27 HB2 GLN 27 44.653 2.377 7.006
214 HB3 GLN 27 HB1 GLN 27 43.152 2.920 7.759
215 HG2 GLN 27 HG2 GLN 27 42.468 0.485 7.912
216 HG3 GLN 27 HG1 GLN 27 44.106 0.069 7.411
217 HE21 GLN 27 HE21 GLN 27 45.657 1.918 8.814
218 HE22 GLN 27 HE22 GLN 27 45.446 1.703 10.483
219 H LYS 28 HN LYS 28 41.671 3.917 4.550
220 HA LYS 28 HA LYS 28 44.182 4.968 3.271
221 HB2 LYS 28 HB2 LYS 28 42.662 3.620 1.737
222 HB3 LYS 28 HB1 LYS 28 41.455 4.879 1.968
223 HG2 LYS 28 HG2 LYS 28 42.446 5.837 0.132
224 HG3 LYS 28 HG1 LYS 28 43.621 6.424 1.304
225 HD2 LYS 28 HD2 LYS 28 45.091 4.532 0.842
226 HD3 LYS 28 HD1 LYS 28 43.888 3.816 -0.228
227 HE2 LYS 28 HE2 LYS 28 45.357 4.903 -1.713
228 HE3 LYS 28 HE1 LYS 28 44.035 6.053 -1.544
229 HZ1 LYS 28 HZ1 LYS 28 45.381 7.529 -0.610
230 HZ2 LYS 28 HZ2 LYS 28 46.684 6.538 -1.063
231 HZ3 LYS 28 HZ3 LYS 28 46.004 6.397 0.488
232 H ASP 29 HN ASP 29 44.448 7.112 4.084
233 HA ASP 29 HA ASP 29 43.825 9.277 4.855
234 HB2 ASP 29 HB2 ASP 29 42.991 9.239 2.435
235 HB3 ASP 29 HB1 ASP 29 41.393 8.889 3.096
236 H GLY 30 HN GLY 30 42.888 6.962 6.401
237 HA2 GLY 30 HA2 GLY 30 41.551 6.691 8.316
238 HA3 GLY 30 HA1 GLY 30 40.999 8.351 8.092
239 H ARG 31 HN ARG 31 40.702 5.903 5.581
240 HA ARG 31 HA ARG 31 37.803 5.584 6.180
241 HB2 ARG 31 HB2 ARG 31 38.059 7.472 4.541
242 HB3 ARG 31 HB1 ARG 31 38.878 6.363 3.450
243 HG2 ARG 31 HG2 ARG 31 36.478 6.608 2.878
244 HG3 ARG 31 HG1 ARG 31 36.885 4.955 3.317
245 HD2 ARG 31 HD2 ARG 31 34.731 6.134 4.334
246 HD3 ARG 31 HD1 ARG 31 35.706 5.042 5.318
247 HE ARG 31 HE ARG 31 36.853 7.509 5.788
248 HH11 ARG 31 HH21 ARG 31 33.666 6.204 5.855
249 HH12 ARG 31 HH22 ARG 31 33.121 7.251 7.122
250 HH21 ARG 31 HH11 ARG 31 36.163 8.885 7.441
251 HH22 ARG 31 HH12 ARG 31 34.534 8.769 8.020
252 H ARG 32 HN ARG 32 37.098 3.572 5.784
253 HA ARG 32 HA ARG 32 39.078 1.547 4.963
254 HB2 ARG 32 HB2 ARG 32 36.296 1.491 6.136
255 HB3 ARG 32 HB1 ARG 32 37.067 0.016 5.557
256 HG2 ARG 32 HG2 ARG 32 39.001 0.467 7.054
257 HG3 ARG 32 HG1 ARG 32 38.168 1.896 7.668
258 HD2 ARG 32 HD2 ARG 32 37.202 -0.972 7.869
259 HD3 ARG 32 HD1 ARG 32 37.788 0.033 9.196
260 HE ARG 32 HE ARG 32 35.690 1.498 8.136
261 HH11 ARG 32 HH21 ARG 32 36.168 -1.722 9.274
262 HH12 ARG 32 HH22 ARG 32 34.537 -1.908 9.830
263 HH21 ARG 32 HH11 ARG 32 33.560 1.273 8.855
264 HH22 ARG 32 HH12 ARG 32 33.062 -0.212 9.593
265 H VAL 33 HN VAL 33 38.970 0.286 3.140
266 HA VAL 33 HA VAL 33 36.602 0.447 1.348
267 HB VAL 33 HB VAL 33 39.425 1.142 0.453
268 HG11 VAL 33 HG11 VAL 33 38.272 1.351 -1.811
269 HG12 VAL 33 HG12 VAL 33 36.904 0.495 -1.103
270 HG13 VAL 33 HG13 VAL 33 38.472 -0.301 -1.225
271 HG21 VAL 33 HG21 VAL 33 38.328 3.100 1.289
272 HG22 VAL 33 HG22 VAL 33 36.793 2.642 0.554
273 HG23 VAL 33 HG23 VAL 33 38.136 3.168 -0.460
274 H GLU 34 HN GLU 34 36.361 -1.408 0.114
275 HA GLU 34 HA GLU 34 38.214 -3.665 0.824
276 HB2 GLU 34 HB2 GLU 34 35.234 -3.462 0.441
277 HB3 GLU 34 HB1 GLU 34 36.026 -5.013 0.169
278 HG2 GLU 34 HG2 GLU 34 36.831 -5.111 2.409
279 HG3 GLU 34 HG1 GLU 34 36.461 -3.411 2.697
280 H PHE 35 HN PHE 35 39.625 -3.824 -0.960
281 HA PHE 35 HA PHE 35 38.436 -3.789 -3.697
282 HB2 PHE 35 HB2 PHE 35 41.249 -3.675 -2.607
283 HB3 PHE 35 HB1 PHE 35 41.001 -4.220 -4.259
284 HD1 PHE 35 HD1 PHE 35 39.056 -2.578 -5.498
285 HD2 PHE 35 HD2 PHE 35 41.914 -1.458 -2.488
286 HE1 PHE 35 HE1 PHE 35 38.936 -0.224 -6.249
287 HE2 PHE 35 HE2 PHE 35 41.790 0.894 -3.239
288 HZ PHE 35 HZ PHE 35 40.299 1.514 -5.123
289 H THR 36 HN THR 36 38.427 -5.683 -4.984
290 HA THR 36 HA THR 36 39.018 -8.229 -3.510
291 HB THR 36 HB THR 36 37.519 -9.311 -5.113
292 HG1 THR 36 HG1 THR 36 36.851 -6.832 -6.218
293 HG21 THR 36 HG21 THR 36 36.640 -7.952 -3.087
294 HG22 THR 36 HG22 THR 36 35.484 -8.432 -4.329
295 HG23 THR 36 HG23 THR 36 36.102 -6.782 -4.292
296 H ALA 37 HN ALA 37 39.947 -10.020 -5.050
297 HA ALA 37 HA ALA 37 42.390 -9.159 -6.185
298 HB1 ALA 37 HB1 ALA 37 42.199 -11.400 -7.518
299 HB2 ALA 37 HB2 ALA 37 40.727 -11.641 -6.579
300 HB3 ALA 37 HB3 ALA 37 42.279 -11.468 -5.760
301 H THR 38 HN THR 38 39.262 -8.713 -7.417
302 HA THR 38 HA THR 38 39.734 -8.915 -10.228
303 HB THR 38 HB THR 38 37.757 -7.441 -10.465
304 HG1 THR 38 HG1 THR 38 36.849 -6.997 -8.196
305 HG21 THR 38 HG21 THR 38 37.683 -9.958 -9.673
306 HG22 THR 38 HG22 THR 38 36.213 -8.985 -9.640
307 HG23 THR 38 HG23 THR 38 37.121 -9.255 -8.154
308 H SER 39 HN SER 39 40.664 -6.502 -7.895
309 HA SER 39 HA SER 39 41.792 -4.831 -10.125
310 HB2 SER 39 HB2 SER 39 41.177 -2.833 -9.008
311 HB3 SER 39 HB1 SER 39 39.742 -3.851 -8.923
312 HG SER 39 HG SER 39 41.630 -3.217 -6.929
313 H VAL 40 HN VAL 40 43.436 -6.715 -9.110
314 HA VAL 40 HA VAL 40 44.890 -5.678 -6.773
315 HB VAL 40 HB VAL 40 44.774 -8.077 -7.010
316 HG11 VAL 40 HG11 VAL 40 46.240 -7.759 -9.664
317 HG12 VAL 40 HG12 VAL 40 44.511 -8.089 -9.529
318 HG13 VAL 40 HG13 VAL 40 45.685 -9.268 -8.945
319 HG21 VAL 40 HG21 VAL 40 47.586 -7.290 -7.822
320 HG22 VAL 40 HG22 VAL 40 47.104 -8.608 -6.758
321 HG23 VAL 40 HG23 VAL 40 46.939 -6.933 -6.222
322 H SER 41 HN SER 41 44.950 -4.997 -10.133
323 HA SER 41 HA SER 41 47.787 -4.439 -10.349
324 HB2 SER 41 HB2 SER 41 47.122 -3.259 -12.443
325 HB3 SER 41 HB1 SER 41 46.508 -4.907 -12.355
326 HG SER 41 HG SER 41 45.138 -2.678 -12.674
327 H ASP 42 HN ASP 42 44.890 -2.400 -9.852
328 HA ASP 42 HA ASP 42 46.200 0.108 -9.806
329 HB2 ASP 42 HB2 ASP 42 44.325 0.826 -8.286
330 HB3 ASP 42 HB1 ASP 42 43.781 0.001 -9.744
331 H LEU 43 HN LEU 43 46.152 -2.488 -7.383
332 HA LEU 43 HA LEU 43 47.149 -0.828 -5.231
333 HB2 LEU 43 HB2 LEU 43 45.963 -3.144 -5.111
334 HB3 LEU 43 HB1 LEU 43 47.552 -3.815 -5.458
335 HG LEU 43 HG LEU 43 48.471 -2.696 -3.444
336 HD11 LEU 43 HD11 LEU 43 45.714 -1.500 -3.388
337 HD12 LEU 43 HD12 LEU 43 47.255 -0.789 -2.916
338 HD13 LEU 43 HD13 LEU 43 46.442 -1.909 -1.835
339 HD21 LEU 43 HD21 LEU 43 47.470 -4.193 -1.862
340 HD22 LEU 43 HD22 LEU 43 47.363 -4.995 -3.429
341 HD23 LEU 43 HD23 LEU 43 45.942 -4.211 -2.742
342 H LYS 44 HN LYS 44 48.583 -2.815 -7.777
343 HA LYS 44 HA LYS 44 51.286 -2.726 -6.809
344 HB2 LYS 44 HB2 LYS 44 49.963 -3.268 -9.445
345 HB3 LYS 44 HB1 LYS 44 51.688 -2.911 -9.474
346 HG2 LYS 44 HG2 LYS 44 52.201 -4.762 -8.067
347 HG3 LYS 44 HG1 LYS 44 50.512 -4.990 -7.623
348 HD2 LYS 44 HD2 LYS 44 49.944 -5.791 -9.798
349 HD3 LYS 44 HD1 LYS 44 51.477 -5.243 -10.477
350 HE2 LYS 44 HE2 LYS 44 52.674 -6.872 -9.050
351 HE3 LYS 44 HE1 LYS 44 51.130 -7.437 -8.418
352 HZ1 LYS 44 HZ1 LYS 44 52.413 -8.070 -10.884
353 HZ2 LYS 44 HZ2 LYS 44 50.831 -7.503 -11.133
354 HZ3 LYS 44 HZ3 LYS 44 51.108 -8.839 -10.121
355 H LYS 45 HN LYS 45 49.527 -0.592 -9.090
356 HA LYS 45 HA LYS 45 51.748 1.145 -9.585
357 HB2 LYS 45 HB2 LYS 45 49.830 1.109 -11.062
358 HB3 LYS 45 HB1 LYS 45 48.758 1.596 -9.755
359 HG2 LYS 45 HG2 LYS 45 51.067 3.429 -10.237
360 HG3 LYS 45 HG1 LYS 45 49.892 3.361 -11.544
361 HD2 LYS 45 HD2 LYS 45 48.932 3.698 -8.704
362 HD3 LYS 45 HD1 LYS 45 49.552 5.090 -9.590
363 HE2 LYS 45 HE2 LYS 45 47.925 4.648 -11.404
364 HE3 LYS 45 HE1 LYS 45 47.290 3.281 -10.490
365 HZ1 LYS 45 HZ1 LYS 45 47.113 5.130 -8.640
366 HZ2 LYS 45 HZ2 LYS 45 45.880 4.886 -9.783
367 HZ3 LYS 45 HZ3 LYS 45 47.002 6.144 -9.995
368 H TYR 46 HN TYR 46 49.134 1.246 -7.183
369 HA TYR 46 HA TYR 46 49.755 3.812 -6.098
370 HB2 TYR 46 HB2 TYR 46 47.658 2.648 -5.609
371 HB3 TYR 46 HB1 TYR 46 48.541 1.362 -4.798
372 HD1 TYR 46 HD1 TYR 46 48.474 5.128 -4.680
373 HD2 TYR 46 HD2 TYR 46 48.436 1.441 -2.468
374 HE1 TYR 46 HE1 TYR 46 48.343 6.400 -2.558
375 HE2 TYR 46 HE2 TYR 46 48.301 2.713 -0.347
376 HH TYR 46 HH TYR 46 48.901 6.046 -0.166
377 H ILE 47 HN ILE 47 50.848 0.545 -5.170
378 HA ILE 47 HA ILE 47 52.477 1.267 -2.970
379 HB ILE 47 HB ILE 47 52.789 -0.915 -5.047
380 HG12 ILE 47 HG12 ILE 47 51.975 -1.183 -2.149
381 HG13 ILE 47 HG11 ILE 47 50.793 -0.846 -3.414
382 HG21 ILE 47 HG21 ILE 47 54.265 -1.966 -3.216
383 HG22 ILE 47 HG22 ILE 47 54.377 -0.339 -2.542
384 HG23 ILE 47 HG23 ILE 47 54.978 -0.665 -4.168
385 HD11 ILE 47 HD11 ILE 47 51.284 -3.340 -2.772
386 HD12 ILE 47 HD12 ILE 47 52.737 -3.125 -3.750
387 HD13 ILE 47 HD13 ILE 47 51.145 -2.905 -4.476
388 H ALA 48 HN ALA 48 53.434 0.844 -6.388
389 HA ALA 48 HA ALA 48 56.110 1.634 -6.147
390 HB1 ALA 48 HB1 ALA 48 54.236 2.180 -8.466
391 HB2 ALA 48 HB2 ALA 48 55.147 0.691 -8.211
392 HB3 ALA 48 HB3 ALA 48 55.998 2.200 -8.543
393 H GLU 49 HN GLU 49 53.231 3.686 -6.575
394 HA GLU 49 HA GLU 49 54.567 6.142 -6.982
395 HB2 GLU 49 HB2 GLU 49 52.031 5.574 -7.088
396 HB3 GLU 49 HB1 GLU 49 52.026 5.938 -5.363
397 HG2 GLU 49 HG2 GLU 49 53.121 8.147 -5.927
398 HG3 GLU 49 HG1 GLU 49 52.819 7.779 -7.625
399 H LEU 50 HN LEU 50 54.057 4.301 -4.023
400 HA LEU 50 HA LEU 50 54.791 6.544 -2.291
401 HB2 LEU 50 HB2 LEU 50 54.756 3.589 -1.605
402 HB3 LEU 50 HB1 LEU 50 54.725 4.942 -0.475
403 HG LEU 50 HG LEU 50 52.586 4.365 -2.545
404 HD11 LEU 50 HD11 LEU 50 51.251 3.504 -0.790
405 HD12 LEU 50 HD12 LEU 50 52.329 4.133 0.453
406 HD13 LEU 50 HD13 LEU 50 52.830 2.763 -0.539
407 HD21 LEU 50 HD21 LEU 50 52.477 6.681 -2.169
408 HD22 LEU 50 HD22 LEU 50 53.003 6.536 -0.491
409 HD23 LEU 50 HD23 LEU 50 51.368 6.064 -0.947
410 H GLU 51 HN GLU 51 56.498 3.838 -3.808
411 HA GLU 51 HA GLU 51 58.923 4.072 -2.307
412 HB2 GLU 51 HB2 GLU 51 58.290 3.064 -5.084
413 HB3 GLU 51 HB1 GLU 51 59.950 3.116 -4.495
414 HG2 GLU 51 HG2 GLU 51 58.820 0.907 -4.104
415 HG3 GLU 51 HG1 GLU 51 59.394 1.676 -2.624
416 H VAL 52 HN VAL 52 57.582 5.932 -4.956
417 HA VAL 52 HA VAL 52 60.095 7.345 -5.490
418 HB VAL 52 HB VAL 52 57.284 8.076 -6.369
419 HG11 VAL 52 HG11 VAL 52 58.793 9.913 -6.715
420 HG12 VAL 52 HG12 VAL 52 58.621 9.113 -8.277
421 HG13 VAL 52 HG13 VAL 52 60.064 8.838 -7.301
422 HG21 VAL 52 HG21 VAL 52 58.016 6.911 -8.513
423 HG22 VAL 52 HG22 VAL 52 57.701 5.837 -7.149
424 HG23 VAL 52 HG23 VAL 52 59.361 6.237 -7.591
425 H GLN 53 HN GLN 53 57.225 7.798 -3.500
426 HA GLN 53 HA GLN 53 57.828 10.591 -2.909
427 HB2 GLN 53 HB2 GLN 53 55.521 9.904 -2.793
428 HB3 GLN 53 HB1 GLN 53 55.913 8.575 -1.704
429 HG2 GLN 53 HG2 GLN 53 56.425 10.052 0.083
430 HG3 GLN 53 HG1 GLN 53 56.470 11.453 -0.987
431 HE21 GLN 53 HE21 GLN 53 54.522 12.593 -1.277
432 HE22 GLN 53 HE22 GLN 53 53.010 12.057 -0.724
433 H THR 54 HN THR 54 58.373 7.438 -1.376
434 HA THR 54 HA THR 54 59.745 8.751 0.916
435 HB THR 54 HB THR 54 60.005 6.233 1.595
436 HG1 THR 54 HG1 THR 54 58.623 6.133 -0.756
437 HG21 THR 54 HG21 THR 54 58.430 7.858 2.641
438 HG22 THR 54 HG22 THR 54 57.768 6.226 2.567
439 HG23 THR 54 HG23 THR 54 57.232 7.447 1.413
440 H GLY 55 HN GLY 55 60.716 8.475 -2.022
441 HA2 GLY 55 HA2 GLY 55 63.486 8.243 -1.447
442 HA3 GLY 55 HA1 GLY 55 62.926 6.711 -2.112
443 H MET 56 HN MET 56 63.714 10.002 -2.839
444 HA MET 56 HA MET 56 62.625 9.847 -5.584
445 HB2 MET 56 HB2 MET 56 64.080 11.972 -4.001
446 HB3 MET 56 HB1 MET 56 63.820 12.137 -5.738
447 HG2 MET 56 HG2 MET 56 61.458 12.136 -5.496
448 HG3 MET 56 HG1 MET 56 61.546 11.526 -3.844
449 HE1 MET 56 HE1 MET 56 60.212 13.264 -2.543
450 HE2 MET 56 HE2 MET 56 59.683 13.639 -4.181
451 HE3 MET 56 HE3 MET 56 60.105 14.947 -3.077
452 H THR 57 HN THR 57 64.046 7.911 -6.039
453 HA THR 57 HA THR 57 65.980 6.962 -6.980
454 HB THR 57 HB THR 57 66.528 9.804 -7.878
455 HG1 THR 57 HG1 THR 57 64.444 8.193 -8.382
456 HG21 THR 57 HG21 THR 57 67.212 7.080 -9.019
457 HG22 THR 57 HG22 THR 57 68.343 8.244 -8.329
458 HG23 THR 57 HG23 THR 57 67.510 8.612 -9.840
459 H GLN 58 HN GLN 58 66.745 6.753 -4.671
460 HA GLN 58 HA GLN 58 68.475 6.901 -3.097
461 HB2 GLN 58 HB2 GLN 58 69.794 6.674 -5.320
462 HB3 GLN 58 HB1 GLN 58 70.076 8.408 -5.173
463 HG2 GLN 58 HG2 GLN 58 71.097 8.080 -2.967
464 HG3 GLN 58 HG1 GLN 58 70.772 6.349 -3.058
465 HE21 GLN 58 HE21 GLN 58 71.438 6.124 -5.931
466 HE22 GLN 58 HE22 GLN 58 73.123 6.295 -6.048
467 H ARG 59 HN ARG 59 68.833 8.263 -1.444
468 HA ARG 59 HA ARG 59 67.914 11.059 -1.746
469 HB2 ARG 59 HB2 ARG 59 67.685 11.047 0.618
470 HB3 ARG 59 HB1 ARG 59 67.185 9.436 0.097
471 HG2 ARG 59 HG2 ARG 59 69.597 8.700 0.527
472 HG3 ARG 59 HG1 ARG 59 69.812 10.240 1.360
473 HD2 ARG 59 HD2 ARG 59 67.906 9.683 2.848
474 HD3 ARG 59 HD1 ARG 59 67.751 8.121 2.041
475 HE ARG 59 HE ARG 59 70.393 8.175 2.870
476 HH11 ARG 59 HH21 ARG 59 67.304 8.656 4.324
477 HH12 ARG 59 HH22 ARG 59 67.795 8.064 5.876
478 HH21 ARG 59 HH11 ARG 59 71.052 7.398 4.889
479 HH22 ARG 59 HH12 ARG 59 69.916 7.351 6.196
480 H ARG 60 HN ARG 60 69.329 12.741 -1.863
481 HA ARG 60 HA ARG 60 71.889 12.724 -0.507
482 HB2 ARG 60 HB2 ARG 60 72.287 11.246 -2.537
483 HB3 ARG 60 HB1 ARG 60 72.003 12.670 -3.535
484 HG2 ARG 60 HG2 ARG 60 73.823 13.844 -2.238
485 HG3 ARG 60 HG1 ARG 60 74.168 12.308 -1.444
486 HD2 ARG 60 HD2 ARG 60 74.646 11.265 -3.609
487 HD3 ARG 60 HD1 ARG 60 74.237 12.765 -4.441
488 HE ARG 60 HE ARG 60 76.231 13.517 -2.673
489 HH11 ARG 60 HH21 ARG 60 75.815 11.094 -5.090
490 HH12 ARG 60 HH22 ARG 60 77.493 11.044 -5.517
491 HH21 ARG 60 HH11 ARG 60 78.424 13.466 -3.217
492 HH22 ARG 60 HH12 ARG 60 78.970 12.387 -4.456
493 H ARG 61 HN ARG 61 72.232 14.398 -3.411
494 HA ARG 61 HA ARG 61 72.180 16.696 -3.875
495 HB2 ARG 61 HB2 ARG 61 69.720 16.098 -3.938
496 HB3 ARG 61 HB1 ARG 61 69.615 16.643 -2.263
497 HG2 ARG 61 HG2 ARG 61 70.432 18.871 -2.926
498 HG3 ARG 61 HG1 ARG 61 70.550 18.332 -4.601
499 HD2 ARG 61 HD2 ARG 61 68.456 19.516 -4.354
500 HD3 ARG 61 HD1 ARG 61 68.089 17.800 -4.525
501 HE ARG 61 HE ARG 61 68.262 18.167 -1.785
502 HH11 ARG 61 HH21 ARG 61 66.564 19.634 -4.402
503 HH12 ARG 61 HH22 ARG 61 65.190 20.067 -3.444
504 HH21 ARG 61 HH11 ARG 61 66.475 18.724 -0.516
505 HH22 ARG 61 HH12 ARG 61 65.138 19.551 -1.243
506 H GLY 62 HN GLY 62 74.044 16.770 -2.268
507 HA2 GLY 62 HA2 GLY 62 75.126 17.937 -0.544
508 HA3 GLY 62 HA1 GLY 62 73.701 18.977 -0.475
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 56.861 8.091 10.649
2 H2 MET 1 HT2 MET 1 57.675 9.540 10.293
3 H3 MET 1 HT3 MET 1 58.022 8.127 9.414
4 HA MET 1 HA MET 1 55.770 9.969 9.175
5 HB2 MET 1 HB2 MET 1 57.310 8.194 7.254
6 HB3 MET 1 HB1 MET 1 56.054 9.341 6.786
7 HG2 MET 1 HG2 MET 1 57.389 11.182 7.781
8 HG3 MET 1 HG1 MET 1 58.658 10.025 8.181
9 HE1 MET 1 HE1 MET 1 60.509 9.476 6.809
10 HE2 MET 1 HE2 MET 1 60.437 9.159 5.078
11 HE3 MET 1 HE3 MET 1 59.427 8.226 6.179
12 H VAL 2 HN VAL 2 53.673 9.282 8.883
13 HA VAL 2 HA VAL 2 52.935 6.629 9.712
14 HB VAL 2 HB VAL 2 51.250 8.627 8.173
15 HG11 VAL 2 HG11 VAL 2 50.251 6.407 8.299
16 HG12 VAL 2 HG12 VAL 2 49.399 7.485 9.406
17 HG13 VAL 2 HG13 VAL 2 50.574 6.327 10.032
18 HG21 VAL 2 HG21 VAL 2 51.722 8.324 11.157
19 HG22 VAL 2 HG22 VAL 2 50.520 9.388 10.426
20 HG23 VAL 2 HG23 VAL 2 52.236 9.684 10.159
21 H ARG 3 HN ARG 3 53.723 8.032 6.625
22 HA ARG 3 HA ARG 3 52.391 6.188 4.908
23 HB2 ARG 3 HB2 ARG 3 55.043 7.611 4.517
24 HB3 ARG 3 HB1 ARG 3 54.120 6.817 3.240
25 HG2 ARG 3 HG2 ARG 3 52.202 8.318 3.720
26 HG3 ARG 3 HG1 ARG 3 53.172 9.144 4.938
27 HD2 ARG 3 HD2 ARG 3 54.836 9.224 2.715
28 HD3 ARG 3 HD1 ARG 3 53.242 9.416 1.993
29 HE ARG 3 HE ARG 3 54.651 11.464 3.292
30 HH11 ARG 3 HH21 ARG 3 51.578 9.913 3.602
31 HH12 ARG 3 HH22 ARG 3 50.842 11.257 4.401
32 HH21 ARG 3 HH11 ARG 3 53.694 13.217 4.315
33 HH22 ARG 3 HH12 ARG 3 52.033 13.126 4.799
34 H GLN 4 HN GLN 4 55.427 5.961 6.696
35 HA GLN 4 HA GLN 4 56.469 3.634 5.415
36 HB2 GLN 4 HB2 GLN 4 57.635 5.165 7.109
37 HB3 GLN 4 HB1 GLN 4 56.780 4.258 8.356
38 HG2 GLN 4 HG2 GLN 4 57.748 2.147 7.364
39 HG3 GLN 4 HG1 GLN 4 58.741 3.167 6.321
40 HE21 GLN 4 HE21 GLN 4 58.791 5.191 8.709
41 HE22 GLN 4 HE22 GLN 4 60.003 4.563 9.718
42 H GLU 5 HN GLU 5 54.472 3.938 8.368
43 HA GLU 5 HA GLU 5 54.162 1.097 8.715
44 HB2 GLU 5 HB2 GLU 5 53.808 2.709 10.553
45 HB3 GLU 5 HB1 GLU 5 52.410 3.368 9.703
46 HG2 GLU 5 HG2 GLU 5 51.226 1.271 9.876
47 HG3 GLU 5 HG1 GLU 5 52.657 0.459 10.512
48 H GLU 6 HN GLU 6 52.128 3.594 7.180
49 HA GLU 6 HA GLU 6 49.937 1.887 6.572
50 HB2 GLU 6 HB2 GLU 6 50.286 4.525 6.281
51 HB3 GLU 6 HB1 GLU 6 50.685 4.066 4.628
52 HG2 GLU 6 HG2 GLU 6 48.134 3.290 6.080
53 HG3 GLU 6 HG1 GLU 6 48.273 4.589 4.896
54 H LEU 7 HN LEU 7 53.137 1.998 5.244
55 HA LEU 7 HA LEU 7 52.417 0.777 2.692
56 HB2 LEU 7 HB2 LEU 7 54.577 2.157 3.401
57 HB3 LEU 7 HB1 LEU 7 55.181 0.575 3.878
58 HG LEU 7 HG LEU 7 54.089 1.249 1.126
59 HD11 LEU 7 HD11 LEU 7 56.377 1.275 0.373
60 HD12 LEU 7 HD12 LEU 7 56.960 0.755 1.956
61 HD13 LEU 7 HD13 LEU 7 56.270 2.365 1.756
62 HD21 LEU 7 HD21 LEU 7 55.361 -0.977 0.649
63 HD22 LEU 7 HD22 LEU 7 53.787 -1.074 1.431
64 HD23 LEU 7 HD23 LEU 7 55.257 -1.235 2.390
65 H ALA 8 HN ALA 8 53.952 -0.381 5.706
66 HA ALA 8 HA ALA 8 54.174 -3.106 4.973
67 HB1 ALA 8 HB1 ALA 8 53.602 -1.937 7.716
68 HB2 ALA 8 HB2 ALA 8 55.201 -2.198 7.019
69 HB3 ALA 8 HB3 ALA 8 54.172 -3.577 7.406
70 H ALA 9 HN ALA 9 51.389 -1.221 5.870
71 HA ALA 9 HA ALA 9 49.682 -3.489 6.505
72 HB1 ALA 9 HB1 ALA 9 47.846 -1.734 6.254
73 HB2 ALA 9 HB2 ALA 9 49.130 -0.573 5.917
74 HB3 ALA 9 HB3 ALA 9 49.068 -1.391 7.478
75 H ALA 10 HN ALA 10 49.784 -1.207 3.725
76 HA ALA 10 HA ALA 10 47.911 -2.645 2.141
77 HB1 ALA 10 HB1 ALA 10 49.279 -1.535 0.190
78 HB2 ALA 10 HB2 ALA 10 50.130 -0.718 1.501
79 HB3 ALA 10 HB3 ALA 10 48.391 -0.504 1.314
80 H ARG 11 HN ARG 11 51.311 -3.108 2.769
81 HA ARG 11 HA ARG 11 51.811 -4.991 0.637
82 HB2 ARG 11 HB2 ARG 11 53.433 -3.668 2.300
83 HB3 ARG 11 HB1 ARG 11 53.261 -5.112 3.288
84 HG2 ARG 11 HG2 ARG 11 55.025 -5.871 2.025
85 HG3 ARG 11 HG1 ARG 11 53.765 -6.268 0.860
86 HD2 ARG 11 HD2 ARG 11 54.077 -3.982 -0.140
87 HD3 ARG 11 HD1 ARG 11 55.455 -3.756 0.936
88 HE ARG 11 HE ARG 11 56.013 -6.146 -0.351
89 HH11 ARG 11 HH21 ARG 11 55.162 -2.942 -1.298
90 HH12 ARG 11 HH22 ARG 11 56.047 -3.004 -2.786
91 HH21 ARG 11 HH11 ARG 11 57.174 -6.245 -2.288
92 HH22 ARG 11 HH12 ARG 11 57.186 -4.874 -3.346
93 H ALA 12 HN ALA 12 51.077 -5.375 4.166
94 HA ALA 12 HA ALA 12 51.004 -8.185 4.220
95 HB1 ALA 12 HB1 ALA 12 50.809 -6.798 6.254
96 HB2 ALA 12 HB2 ALA 12 49.482 -7.955 6.156
97 HB3 ALA 12 HB3 ALA 12 49.211 -6.266 5.731
98 H ALA 13 HN ALA 13 48.978 -5.991 2.675
99 HA ALA 13 HA ALA 13 46.643 -7.718 2.483
100 HB1 ALA 13 HB1 ALA 13 47.190 -5.443 0.585
101 HB2 ALA 13 HB2 ALA 13 46.776 -5.109 2.265
102 HB3 ALA 13 HB3 ALA 13 45.649 -5.998 1.242
103 H LEU 14 HN LEU 14 49.444 -6.939 0.394
104 HA LEU 14 HA LEU 14 48.492 -8.377 -1.864
105 HB2 LEU 14 HB2 LEU 14 50.965 -7.107 -1.164
106 HB3 LEU 14 HB1 LEU 14 51.352 -8.700 -1.782
107 HG LEU 14 HG LEU 14 49.494 -6.792 -3.235
108 HD11 LEU 14 HD11 LEU 14 52.451 -7.222 -3.725
109 HD12 LEU 14 HD12 LEU 14 51.773 -5.803 -2.927
110 HD13 LEU 14 HD13 LEU 14 51.376 -6.140 -4.609
111 HD21 LEU 14 HD21 LEU 14 49.693 -8.283 -5.041
112 HD22 LEU 14 HD22 LEU 14 49.596 -9.368 -3.658
113 HD23 LEU 14 HD23 LEU 14 51.159 -9.025 -4.397
114 H HIS 15 HN HIS 15 49.997 -9.466 1.108
115 HA HIS 15 HA HIS 15 50.430 -12.187 0.138
116 HB2 HIS 15 HB2 HIS 15 51.745 -11.172 2.013
117 HB3 HIS 15 HB1 HIS 15 50.278 -11.177 2.995
118 HD1 HIS 15 HD1 HIS 15 50.095 -13.183 4.447
119 HD2 HIS 15 HD2 HIS 15 52.182 -14.033 0.940
120 HE1 HIS 15 HE1 HIS 15 50.773 -15.619 4.589
121 H ASP 16 HN ASP 16 47.893 -10.441 1.835
122 HA ASP 16 HA ASP 16 46.362 -12.812 2.522
123 HB2 ASP 16 HB2 ASP 16 45.345 -9.974 2.303
124 HB3 ASP 16 HB1 ASP 16 44.693 -11.276 3.296
125 H LEU 17 HN LEU 17 46.721 -10.930 -0.357
126 HA LEU 17 HA LEU 17 44.102 -11.810 -1.439
127 HB2 LEU 17 HB2 LEU 17 46.302 -10.084 -2.615
128 HB3 LEU 17 HB1 LEU 17 44.804 -10.473 -3.445
129 HG LEU 17 HG LEU 17 44.767 -9.248 -0.682
130 HD11 LEU 17 HD11 LEU 17 46.060 -7.646 -1.855
131 HD12 LEU 17 HD12 LEU 17 44.410 -7.040 -1.967
132 HD13 LEU 17 HD13 LEU 17 45.142 -7.866 -3.341
133 HD21 LEU 17 HD21 LEU 17 42.619 -10.034 -1.356
134 HD22 LEU 17 HD22 LEU 17 42.828 -9.444 -3.003
135 HD23 LEU 17 HD23 LEU 17 42.590 -8.306 -1.686
136 H MET 18 HN MET 18 47.472 -12.709 -1.599
137 HA MET 18 HA MET 18 47.032 -14.377 -4.007
138 HB2 MET 18 HB2 MET 18 49.332 -13.220 -2.611
139 HB3 MET 18 HB1 MET 18 49.604 -14.928 -2.934
140 HG2 MET 18 HG2 MET 18 50.428 -13.676 -4.828
141 HG3 MET 18 HG1 MET 18 48.954 -14.498 -5.335
142 HE1 MET 18 HE1 MET 18 50.366 -12.293 -6.779
143 HE2 MET 18 HE2 MET 18 49.228 -11.006 -7.171
144 HE3 MET 18 HE3 MET 18 48.784 -12.685 -7.467
145 H THR 19 HN THR 19 46.586 -14.698 -0.670
146 HA THR 19 HA THR 19 47.291 -17.575 -0.596
147 HB THR 19 HB THR 19 46.268 -17.299 1.793
148 HG1 THR 19 HG1 THR 19 45.576 -15.040 0.812
149 HG21 THR 19 HG21 THR 19 48.743 -15.739 0.992
150 HG22 THR 19 HG22 THR 19 48.686 -17.474 1.303
151 HG23 THR 19 HG23 THR 19 48.374 -16.333 2.611
152 H GLY 20 HN GLY 20 44.661 -15.770 -1.633
153 HA2 GLY 20 HA2 GLY 20 42.865 -17.288 -2.630
154 HA3 GLY 20 HA1 GLY 20 42.735 -18.002 -1.025
155 H LYS 21 HN LYS 21 42.732 -15.811 0.643
156 HA LYS 21 HA LYS 21 40.083 -14.889 0.545
157 HB2 LYS 21 HB2 LYS 21 42.432 -13.360 1.697
158 HB3 LYS 21 HB1 LYS 21 40.739 -13.201 2.164
159 HG2 LYS 21 HG2 LYS 21 40.785 -15.662 2.780
160 HG3 LYS 21 HG1 LYS 21 42.530 -15.618 2.541
161 HD2 LYS 21 HD2 LYS 21 41.180 -13.644 4.388
162 HD3 LYS 21 HD1 LYS 21 41.606 -15.258 4.949
163 HE2 LYS 21 HE2 LYS 21 43.955 -14.864 4.248
164 HE3 LYS 21 HE1 LYS 21 43.517 -13.228 3.762
165 HZ1 LYS 21 HZ1 LYS 21 44.335 -13.993 6.242
166 HZ2 LYS 21 HZ2 LYS 21 42.651 -13.856 6.414
167 HZ3 LYS 21 HZ3 LYS 21 43.561 -12.533 5.857
168 H ARG 22 HN ARG 22 39.240 -13.884 -1.214
169 HA ARG 22 HA ARG 22 40.841 -12.170 -2.911
170 HB2 ARG 22 HB2 ARG 22 39.010 -13.681 -3.723
171 HB3 ARG 22 HB1 ARG 22 37.848 -12.609 -2.941
172 HG2 ARG 22 HG2 ARG 22 38.757 -10.720 -4.294
173 HG3 ARG 22 HG1 ARG 22 39.787 -11.868 -5.144
174 HD2 ARG 22 HD2 ARG 22 37.744 -11.463 -6.439
175 HD3 ARG 22 HD1 ARG 22 37.767 -13.127 -5.853
176 HE ARG 22 HE ARG 22 36.383 -11.757 -3.884
177 HH11 ARG 22 HH21 ARG 22 36.183 -12.083 -7.311
178 HH12 ARG 22 HH22 ARG 22 34.464 -11.884 -7.362
179 HH21 ARG 22 HH11 ARG 22 34.138 -11.495 -3.933
180 HH22 ARG 22 HH12 ARG 22 33.306 -11.550 -5.451
181 H VAL 23 HN VAL 23 38.105 -11.644 -0.668
182 HA VAL 23 HA VAL 23 38.201 -8.733 -1.121
183 HB VAL 23 HB VAL 23 36.759 -10.246 1.078
184 HG11 VAL 23 HG11 VAL 23 36.918 -7.791 1.348
185 HG12 VAL 23 HG12 VAL 23 35.260 -8.286 1.008
186 HG13 VAL 23 HG13 VAL 23 36.246 -7.574 -0.269
187 HG21 VAL 23 HG21 VAL 23 35.998 -9.685 -1.800
188 HG22 VAL 23 HG22 VAL 23 34.800 -10.054 -0.560
189 HG23 VAL 23 HG23 VAL 23 36.033 -11.244 -0.978
190 H ALA 24 HN ALA 24 39.305 -7.262 0.073
191 HA ALA 24 HA ALA 24 40.438 -8.056 2.719
192 HB1 ALA 24 HB1 ALA 24 42.222 -8.479 1.067
193 HB2 ALA 24 HB2 ALA 24 42.638 -7.115 2.104
194 HB3 ALA 24 HB3 ALA 24 42.057 -6.830 0.464
195 H THR 25 HN THR 25 40.890 -6.228 4.075
196 HA THR 25 HA THR 25 39.453 -3.727 3.220
197 HB THR 25 HB THR 25 40.183 -4.795 5.969
198 HG1 THR 25 HG1 THR 25 37.599 -4.250 5.060
199 HG21 THR 25 HG21 THR 25 38.940 -2.206 5.052
200 HG22 THR 25 HG22 THR 25 40.284 -2.441 6.169
201 HG23 THR 25 HG23 THR 25 38.643 -2.853 6.665
202 H VAL 26 HN VAL 26 40.469 -1.668 3.630
203 HA VAL 26 HA VAL 26 43.311 -1.687 4.458
204 HB VAL 26 HB VAL 26 43.111 -1.996 1.899
205 HG11 VAL 26 HG11 VAL 26 42.511 0.968 1.974
206 HG12 VAL 26 HG12 VAL 26 41.244 -0.242 1.764
207 HG13 VAL 26 HG13 VAL 26 42.537 -0.101 0.576
208 HG21 VAL 26 HG21 VAL 26 45.188 -1.295 2.977
209 HG22 VAL 26 HG22 VAL 26 44.607 0.367 3.074
210 HG23 VAL 26 HG23 VAL 26 44.952 -0.356 1.504
211 H GLN 27 HN GLN 27 43.697 0.032 5.724
212 HA GLN 27 HA GLN 27 41.630 2.112 6.018
213 HB2 GLN 27 HB2 GLN 27 44.310 1.866 7.421
214 HB3 GLN 27 HB1 GLN 27 42.947 2.871 7.915
215 HG2 GLN 27 HG2 GLN 27 41.571 0.847 8.241
216 HG3 GLN 27 HG1 GLN 27 42.938 -0.158 7.761
217 HE21 GLN 27 HE21 GLN 27 44.107 -0.946 9.509
218 HE22 GLN 27 HE22 GLN 27 44.251 -0.179 11.016
219 H LYS 28 HN LYS 28 41.726 3.444 4.226
220 HA LYS 28 HA LYS 28 44.377 4.613 3.459
221 HB2 LYS 28 HB2 LYS 28 42.905 3.475 1.708
222 HB3 LYS 28 HB1 LYS 28 41.788 4.830 1.904
223 HG2 LYS 28 HG2 LYS 28 43.544 6.411 1.289
224 HG3 LYS 28 HG1 LYS 28 44.722 5.101 1.184
225 HD2 LYS 28 HD2 LYS 28 43.515 4.090 -0.664
226 HD3 LYS 28 HD1 LYS 28 42.209 5.265 -0.504
227 HE2 LYS 28 HE2 LYS 28 43.667 5.953 -2.331
228 HE3 LYS 28 HE1 LYS 28 43.851 7.087 -0.993
229 HZ1 LYS 28 HZ1 LYS 28 45.634 4.858 -0.800
230 HZ2 LYS 28 HZ2 LYS 28 45.970 6.522 -0.733
231 HZ3 LYS 28 HZ3 LYS 28 45.862 5.733 -2.234
232 H ASP 29 HN ASP 29 44.706 6.671 4.448
233 HA ASP 29 HA ASP 29 44.163 8.825 5.296
234 HB2 ASP 29 HB2 ASP 29 41.761 8.735 3.460
235 HB3 ASP 29 HB1 ASP 29 42.729 10.129 3.939
236 H GLY 30 HN GLY 30 42.957 6.366 6.515
237 HA2 GLY 30 HA2 GLY 30 41.651 6.177 8.495
238 HA3 GLY 30 HA1 GLY 30 40.978 7.776 8.179
239 H ARG 31 HN ARG 31 40.399 6.857 5.312
240 HA ARG 31 HA ARG 31 37.749 5.736 5.946
241 HB2 ARG 31 HB2 ARG 31 38.765 7.450 3.937
242 HB3 ARG 31 HB1 ARG 31 38.328 5.979 3.076
243 HG2 ARG 31 HG2 ARG 31 36.535 7.700 4.820
244 HG3 ARG 31 HG1 ARG 31 36.391 7.415 3.090
245 HD2 ARG 31 HD2 ARG 31 36.285 4.835 4.047
246 HD3 ARG 31 HD1 ARG 31 35.493 5.718 5.350
247 HE ARG 31 HE ARG 31 34.300 6.713 3.056
248 HH11 ARG 31 HH21 ARG 31 34.897 3.609 4.431
249 HH12 ARG 31 HH22 ARG 31 33.476 2.887 3.755
250 HH21 ARG 31 HH11 ARG 31 32.439 5.790 2.164
251 HH22 ARG 31 HH12 ARG 31 32.083 4.122 2.470
252 H ARG 32 HN ARG 32 37.083 3.710 5.459
253 HA ARG 32 HA ARG 32 39.190 1.734 4.765
254 HB2 ARG 32 HB2 ARG 32 38.136 0.542 6.396
255 HB3 ARG 32 HB1 ARG 32 36.939 1.819 6.553
256 HG2 ARG 32 HG2 ARG 32 35.573 0.781 4.785
257 HG3 ARG 32 HG1 ARG 32 36.780 -0.488 4.581
258 HD2 ARG 32 HD2 ARG 32 36.462 -1.117 6.978
259 HD3 ARG 32 HD1 ARG 32 35.164 0.073 7.082
260 HE ARG 32 HE ARG 32 34.431 -1.510 4.931
261 HH11 ARG 32 HH21 ARG 32 35.355 -2.025 8.212
262 HH12 ARG 32 HH22 ARG 32 34.380 -3.444 8.404
263 HH21 ARG 32 HH11 ARG 32 33.152 -3.360 5.162
264 HH22 ARG 32 HH12 ARG 32 33.134 -4.200 6.677
265 H VAL 33 HN VAL 33 39.013 0.323 3.015
266 HA VAL 33 HA VAL 33 36.651 0.529 1.216
267 HB VAL 33 HB VAL 33 39.497 1.048 0.274
268 HG11 VAL 33 HG11 VAL 33 38.316 1.329 -1.957
269 HG12 VAL 33 HG12 VAL 33 36.886 0.618 -1.210
270 HG13 VAL 33 HG13 VAL 33 38.365 -0.329 -1.359
271 HG21 VAL 33 HG21 VAL 33 38.604 3.099 1.121
272 HG22 VAL 33 HG22 VAL 33 36.999 2.750 0.483
273 HG23 VAL 33 HG23 VAL 33 38.313 3.165 -0.616
274 H GLU 34 HN GLU 34 36.334 -1.333 0.020
275 HA GLU 34 HA GLU 34 38.057 -3.663 0.803
276 HB2 GLU 34 HB2 GLU 34 35.116 -3.339 0.213
277 HB3 GLU 34 HB1 GLU 34 35.868 -4.925 0.044
278 HG2 GLU 34 HG2 GLU 34 36.623 -4.857 2.364
279 HG3 GLU 34 HG1 GLU 34 36.002 -3.217 2.548
280 H PHE 35 HN PHE 35 39.561 -3.881 -0.897
281 HA PHE 35 HA PHE 35 38.542 -3.753 -3.696
282 HB2 PHE 35 HB2 PHE 35 41.254 -3.668 -2.404
283 HB3 PHE 35 HB1 PHE 35 41.163 -4.305 -4.040
284 HD1 PHE 35 HD2 PHE 35 39.374 -2.745 -5.557
285 HD2 PHE 35 HD1 PHE 35 41.900 -1.441 -2.335
286 HE1 PHE 35 HE2 PHE 35 39.326 -0.435 -6.447
287 HE2 PHE 35 HE1 PHE 35 41.860 0.864 -3.230
288 HZ PHE 35 HZ PHE 35 40.570 1.370 -5.289
289 H THR 36 HN THR 36 38.599 -5.578 -5.057
290 HA THR 36 HA THR 36 39.019 -8.214 -3.680
291 HB THR 36 HB THR 36 37.495 -9.134 -5.389
292 HG1 THR 36 HG1 THR 36 38.124 -6.837 -6.607
293 HG21 THR 36 HG21 THR 36 35.480 -8.180 -4.583
294 HG22 THR 36 HG22 THR 36 36.237 -6.610 -4.318
295 HG23 THR 36 HG23 THR 36 36.642 -7.972 -3.273
296 H ALA 37 HN ALA 37 40.100 -9.926 -5.154
297 HA ALA 37 HA ALA 37 42.495 -8.956 -6.292
298 HB1 ALA 37 HB1 ALA 37 42.158 -11.335 -5.725
299 HB2 ALA 37 HB2 ALA 37 42.730 -11.149 -7.378
300 HB3 ALA 37 HB3 ALA 37 41.029 -11.494 -7.072
301 H THR 38 HN THR 38 39.370 -8.667 -7.577
302 HA THR 38 HA THR 38 39.834 -8.900 -10.368
303 HB THR 38 HB THR 38 37.893 -7.375 -10.631
304 HG1 THR 38 HG1 THR 38 37.012 -6.906 -8.338
305 HG21 THR 38 HG21 THR 38 36.317 -8.876 -9.795
306 HG22 THR 38 HG22 THR 38 37.206 -9.137 -8.296
307 HG23 THR 38 HG23 THR 38 37.765 -9.882 -9.796
308 H SER 39 HN SER 39 40.719 -6.387 -8.101
309 HA SER 39 HA SER 39 41.962 -4.840 -10.362
310 HB2 SER 39 HB2 SER 39 41.310 -2.785 -9.376
311 HB3 SER 39 HB1 SER 39 39.867 -3.789 -9.294
312 HG SER 39 HG SER 39 41.265 -4.311 -7.137
313 H VAL 40 HN VAL 40 43.532 -6.684 -9.198
314 HA VAL 40 HA VAL 40 44.879 -5.606 -6.827
315 HB VAL 40 HB VAL 40 44.785 -8.009 -7.047
316 HG11 VAL 40 HG11 VAL 40 46.377 -7.708 -9.629
317 HG12 VAL 40 HG12 VAL 40 44.645 -8.042 -9.575
318 HG13 VAL 40 HG13 VAL 40 45.792 -9.213 -8.926
319 HG21 VAL 40 HG21 VAL 40 47.094 -8.527 -6.660
320 HG22 VAL 40 HG22 VAL 40 46.910 -6.840 -6.172
321 HG23 VAL 40 HG23 VAL 40 47.635 -7.233 -7.729
322 H SER 41 HN SER 41 45.093 -4.945 -10.178
323 HA SER 41 HA SER 41 47.937 -4.397 -10.282
324 HB2 SER 41 HB2 SER 41 47.338 -3.165 -12.382
325 HB3 SER 41 HB1 SER 41 46.764 -4.829 -12.346
326 HG SER 41 HG SER 41 45.047 -2.965 -11.255
327 H ASP 42 HN ASP 42 45.033 -2.378 -9.792
328 HA ASP 42 HA ASP 42 46.326 0.143 -9.707
329 HB2 ASP 42 HB2 ASP 42 44.425 0.904 -8.374
330 HB3 ASP 42 HB1 ASP 42 43.849 -0.191 -9.630
331 H LEU 43 HN LEU 43 46.124 -2.439 -7.243
332 HA LEU 43 HA LEU 43 47.164 -0.838 -5.092
333 HB2 LEU 43 HB2 LEU 43 45.984 -3.164 -5.024
334 HB3 LEU 43 HB1 LEU 43 47.583 -3.819 -5.352
335 HG LEU 43 HG LEU 43 48.459 -2.707 -3.309
336 HD11 LEU 43 HD11 LEU 43 47.209 -0.825 -2.776
337 HD12 LEU 43 HD12 LEU 43 46.389 -1.971 -1.726
338 HD13 LEU 43 HD13 LEU 43 45.687 -1.549 -3.287
339 HD21 LEU 43 HD21 LEU 43 47.461 -4.238 -1.762
340 HD22 LEU 43 HD22 LEU 43 47.382 -5.022 -3.340
341 HD23 LEU 43 HD23 LEU 43 45.943 -4.265 -2.660
342 H LYS 44 HN LYS 44 48.627 -2.773 -7.662
343 HA LYS 44 HA LYS 44 51.323 -2.671 -6.657
344 HB2 LYS 44 HB2 LYS 44 50.031 -3.250 -9.297
345 HB3 LYS 44 HB1 LYS 44 51.747 -2.855 -9.322
346 HG2 LYS 44 HG2 LYS 44 52.280 -4.681 -7.865
347 HG3 LYS 44 HG1 LYS 44 50.579 -4.971 -7.500
348 HD2 LYS 44 HD2 LYS 44 50.148 -5.670 -9.783
349 HD3 LYS 44 HD1 LYS 44 51.781 -5.217 -10.272
350 HE2 LYS 44 HE2 LYS 44 52.751 -6.951 -8.924
351 HE3 LYS 44 HE1 LYS 44 51.205 -7.289 -8.147
352 HZ1 LYS 44 HZ1 LYS 44 50.922 -8.809 -9.724
353 HZ2 LYS 44 HZ2 LYS 44 52.225 -8.227 -10.646
354 HZ3 LYS 44 HZ3 LYS 44 50.685 -7.529 -10.812
355 H LYS 45 HN LYS 45 49.529 -0.549 -8.911
356 HA LYS 45 HA LYS 45 51.739 1.210 -9.416
357 HB2 LYS 45 HB2 LYS 45 49.792 1.122 -10.878
358 HB3 LYS 45 HB1 LYS 45 48.749 1.667 -9.570
359 HG2 LYS 45 HG2 LYS 45 51.082 3.443 -10.138
360 HG3 LYS 45 HG1 LYS 45 49.887 3.356 -11.428
361 HD2 LYS 45 HD2 LYS 45 48.980 3.798 -8.585
362 HD3 LYS 45 HD1 LYS 45 49.601 5.150 -9.530
363 HE2 LYS 45 HE2 LYS 45 47.427 3.326 -10.574
364 HE3 LYS 45 HE1 LYS 45 47.069 4.768 -9.625
365 HZ1 LYS 45 HZ1 LYS 45 48.720 4.780 -12.089
366 HZ2 LYS 45 HZ2 LYS 45 48.142 6.128 -11.232
367 HZ3 LYS 45 HZ3 LYS 45 47.058 5.121 -12.066
368 H TYR 46 HN TYR 46 49.117 1.272 -7.024
369 HA TYR 46 HA TYR 46 49.655 3.836 -5.920
370 HB2 TYR 46 HB2 TYR 46 47.635 2.541 -5.390
371 HB3 TYR 46 HB1 TYR 46 48.615 1.322 -4.587
372 HD1 TYR 46 HD2 TYR 46 48.277 5.072 -4.512
373 HD2 TYR 46 HD1 TYR 46 48.601 1.427 -2.255
374 HE1 TYR 46 HE2 TYR 46 48.117 6.361 -2.401
375 HE2 TYR 46 HE1 TYR 46 48.431 2.717 -0.146
376 HH TYR 46 HH TYR 46 48.976 5.188 0.542
377 H ILE 47 HN ILE 47 50.825 0.622 -4.867
378 HA ILE 47 HA ILE 47 52.529 1.472 -2.788
379 HB ILE 47 HB ILE 47 52.957 -0.771 -4.784
380 HG12 ILE 47 HG12 ILE 47 51.914 -1.061 -1.962
381 HG13 ILE 47 HG11 ILE 47 50.813 -0.671 -3.282
382 HG21 ILE 47 HG21 ILE 47 54.312 -1.731 -2.850
383 HG22 ILE 47 HG22 ILE 47 54.256 -0.122 -2.131
384 HG23 ILE 47 HG23 ILE 47 55.042 -0.364 -3.691
385 HD11 ILE 47 HD11 ILE 47 52.725 -2.954 -3.665
386 HD12 ILE 47 HD12 ILE 47 51.109 -2.719 -4.326
387 HD13 ILE 47 HD13 ILE 47 51.309 -3.200 -2.642
388 H ALA 48 HN ALA 48 53.317 0.982 -6.236
389 HA ALA 48 HA ALA 48 56.002 1.770 -6.180
390 HB1 ALA 48 HB1 ALA 48 54.896 0.843 -8.179
391 HB2 ALA 48 HB2 ALA 48 55.723 2.354 -8.559
392 HB3 ALA 48 HB3 ALA 48 53.971 2.333 -8.358
393 H GLU 49 HN GLU 49 53.108 3.829 -6.459
394 HA GLU 49 HA GLU 49 54.427 6.288 -6.896
395 HB2 GLU 49 HB2 GLU 49 51.894 5.723 -6.923
396 HB3 GLU 49 HB1 GLU 49 51.944 6.048 -5.190
397 HG2 GLU 49 HG2 GLU 49 52.993 8.277 -5.725
398 HG3 GLU 49 HG1 GLU 49 52.680 7.946 -7.428
399 H LEU 50 HN LEU 50 54.069 4.402 -3.955
400 HA LEU 50 HA LEU 50 54.830 6.629 -2.210
401 HB2 LEU 50 HB2 LEU 50 54.883 3.675 -1.543
402 HB3 LEU 50 HB1 LEU 50 54.786 5.028 -0.418
403 HG LEU 50 HG LEU 50 52.674 4.202 -2.431
404 HD11 LEU 50 HD11 LEU 50 52.488 4.372 0.581
405 HD12 LEU 50 HD12 LEU 50 52.959 2.893 -0.258
406 HD13 LEU 50 HD13 LEU 50 51.366 3.593 -0.534
407 HD21 LEU 50 HD21 LEU 50 52.508 6.557 -2.374
408 HD22 LEU 50 HD22 LEU 50 52.972 6.643 -0.675
409 HD23 LEU 50 HD23 LEU 50 51.374 6.052 -1.125
410 H GLU 51 HN GLU 51 56.507 3.974 -3.840
411 HA GLU 51 HA GLU 51 58.975 4.277 -2.373
412 HB2 GLU 51 HB2 GLU 51 58.235 3.029 -5.019
413 HB3 GLU 51 HB1 GLU 51 59.927 3.169 -4.546
414 HG2 GLU 51 HG2 GLU 51 57.823 1.907 -2.770
415 HG3 GLU 51 HG1 GLU 51 58.809 0.980 -3.900
416 H VAL 52 HN VAL 52 57.530 5.956 -5.079
417 HA VAL 52 HA VAL 52 60.020 7.305 -5.831
418 HB VAL 52 HB VAL 52 57.166 7.994 -6.599
419 HG11 VAL 52 HG11 VAL 52 59.892 8.741 -7.682
420 HG12 VAL 52 HG12 VAL 52 58.614 9.824 -7.131
421 HG13 VAL 52 HG13 VAL 52 58.419 8.921 -8.633
422 HG21 VAL 52 HG21 VAL 52 57.826 5.636 -7.161
423 HG22 VAL 52 HG22 VAL 52 59.192 6.279 -8.073
424 HG23 VAL 52 HG23 VAL 52 57.543 6.634 -8.588
425 H GLN 53 HN GLN 53 57.275 7.908 -3.714
426 HA GLN 53 HA GLN 53 57.930 10.732 -3.332
427 HB2 GLN 53 HB2 GLN 53 56.078 8.818 -1.887
428 HB3 GLN 53 HB1 GLN 53 56.271 10.508 -1.419
429 HG2 GLN 53 HG2 GLN 53 55.541 11.247 -3.626
430 HG3 GLN 53 HG1 GLN 53 55.453 9.576 -4.186
431 HE21 GLN 53 HE21 GLN 53 53.278 11.733 -3.764
432 HE22 GLN 53 HE22 GLN 53 52.107 10.946 -2.819
433 H THR 54 HN THR 54 58.616 7.676 -1.698
434 HA THR 54 HA THR 54 60.007 9.081 0.512
435 HB THR 54 HB THR 54 60.513 6.576 1.138
436 HG1 THR 54 HG1 THR 54 58.707 5.303 0.214
437 HG21 THR 54 HG21 THR 54 58.336 6.386 2.226
438 HG22 THR 54 HG22 THR 54 57.655 7.592 1.135
439 HG23 THR 54 HG23 THR 54 58.890 8.059 2.304
440 H GLY 55 HN GLY 55 60.854 8.869 -2.479
441 HA2 GLY 55 HA2 GLY 55 63.443 7.477 -2.260
442 HA3 GLY 55 HA1 GLY 55 62.828 8.310 -3.689
443 H MET 56 HN MET 56 63.060 10.619 -3.811
444 HA MET 56 HA MET 56 65.492 11.705 -3.050
445 HB2 MET 56 HB2 MET 56 64.659 13.820 -3.672
446 HB3 MET 56 HB1 MET 56 63.645 12.701 -4.577
447 HG2 MET 56 HG2 MET 56 62.063 12.854 -2.484
448 HG3 MET 56 HG1 MET 56 62.952 14.337 -2.148
449 HE1 MET 56 HE1 MET 56 61.239 12.328 -5.030
450 HE2 MET 56 HE2 MET 56 59.927 13.441 -5.410
451 HE3 MET 56 HE3 MET 56 60.066 12.777 -3.784
452 H THR 57 HN THR 57 66.342 12.673 -1.226
453 HA THR 57 HA THR 57 64.881 12.271 1.292
454 HB THR 57 HB THR 57 67.035 13.285 2.255
455 HG1 THR 57 HG1 THR 57 68.174 14.233 0.777
456 HG21 THR 57 HG21 THR 57 68.283 11.224 1.908
457 HG22 THR 57 HG22 THR 57 67.322 10.848 0.478
458 HG23 THR 57 HG23 THR 57 66.570 10.839 2.074
459 H GLN 58 HN GLN 58 63.951 13.898 2.517
460 HA GLN 58 HA GLN 58 63.360 16.411 1.228
461 HB2 GLN 58 HB2 GLN 58 61.874 15.280 2.918
462 HB3 GLN 58 HB1 GLN 58 63.045 15.717 4.164
463 HG2 GLN 58 HG2 GLN 58 62.749 18.090 3.663
464 HG3 GLN 58 HG1 GLN 58 61.651 17.697 2.339
465 HE21 GLN 58 HE21 GLN 58 59.458 17.237 2.860
466 HE22 GLN 58 HE22 GLN 58 58.856 17.245 4.447
467 H ARG 59 HN ARG 59 64.475 18.270 1.270
468 HA ARG 59 HA ARG 59 66.371 18.848 3.465
469 HB2 ARG 59 HB2 ARG 59 67.128 18.249 0.614
470 HB3 ARG 59 HB1 ARG 59 68.084 19.420 1.525
471 HG2 ARG 59 HG2 ARG 59 68.382 17.681 3.318
472 HG3 ARG 59 HG1 ARG 59 67.570 16.524 2.264
473 HD2 ARG 59 HD2 ARG 59 69.287 16.698 0.601
474 HD3 ARG 59 HD1 ARG 59 70.013 18.089 1.407
475 HE ARG 59 HE ARG 59 70.133 16.087 3.316
476 HH11 ARG 59 HH21 ARG 59 71.072 16.460 0.020
477 HH12 ARG 59 HH22 ARG 59 72.429 15.391 0.146
478 HH21 ARG 59 HH11 ARG 59 71.900 14.688 3.500
479 HH22 ARG 59 HH12 ARG 59 72.898 14.387 2.116
480 H ARG 60 HN ARG 60 65.736 20.021 0.134
481 HA ARG 60 HA ARG 60 65.970 22.775 0.780
482 HB2 ARG 60 HB2 ARG 60 65.943 21.790 -1.542
483 HB3 ARG 60 HB1 ARG 60 64.203 21.580 -1.373
484 HG2 ARG 60 HG2 ARG 60 64.591 23.665 -2.541
485 HG3 ARG 60 HG1 ARG 60 64.002 24.043 -0.926
486 HD2 ARG 60 HD2 ARG 60 66.973 23.856 -1.280
487 HD3 ARG 60 HD1 ARG 60 66.159 25.266 -1.954
488 HE ARG 60 HE ARG 60 65.144 25.105 0.613
489 HH11 ARG 60 HH21 ARG 60 68.271 25.142 -0.840
490 HH12 ARG 60 HH22 ARG 60 69.029 25.940 0.497
491 HH21 ARG 60 HH11 ARG 60 66.117 26.147 2.368
492 HH22 ARG 60 HH12 ARG 60 67.810 26.509 2.313
493 H ARG 61 HN ARG 61 64.639 24.066 1.961
494 HA ARG 61 HA ARG 61 61.740 23.748 1.865
495 HB2 ARG 61 HB2 ARG 61 62.611 22.021 3.568
496 HB3 ARG 61 HB1 ARG 61 63.058 23.402 4.564
497 HG2 ARG 61 HG2 ARG 61 60.923 23.133 5.394
498 HG3 ARG 61 HG1 ARG 61 60.489 24.103 3.990
499 HD2 ARG 61 HD2 ARG 61 60.537 21.066 4.042
500 HD3 ARG 61 HD1 ARG 61 59.086 22.050 4.227
501 HE ARG 61 HE ARG 61 60.154 22.943 1.844
502 HH11 ARG 61 HH21 ARG 61 59.343 19.887 3.215
503 HH12 ARG 61 HH22 ARG 61 58.953 19.157 1.693
504 HH21 ARG 61 HH11 ARG 61 59.651 22.009 -0.153
505 HH22 ARG 61 HH12 ARG 61 59.128 20.358 -0.213
506 H GLY 62 HN GLY 62 63.507 25.877 1.209
507 HA2 GLY 62 HA2 GLY 62 63.956 27.805 3.204
508 HA3 GLY 62 HA1 GLY 62 63.605 28.203 1.521
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 55.287 8.727 13.111
2 H2 MET 1 HT2 MET 1 55.111 10.361 12.681
3 H3 MET 1 HT3 MET 1 56.636 9.618 12.599
4 HA MET 1 HA MET 1 55.018 9.940 10.496
5 HB2 MET 1 HB2 MET 1 56.381 8.038 9.492
6 HB3 MET 1 HB1 MET 1 57.324 9.312 10.266
7 HG2 MET 1 HG2 MET 1 57.680 7.989 12.226
8 HG3 MET 1 HG1 MET 1 56.473 6.804 11.727
9 HE1 MET 1 HE1 MET 1 60.597 7.618 9.967
10 HE2 MET 1 HE2 MET 1 59.530 8.692 10.870
11 HE3 MET 1 HE3 MET 1 59.232 8.400 9.158
12 H VAL 2 HN VAL 2 53.959 8.246 9.082
13 HA VAL 2 HA VAL 2 52.735 5.979 10.553
14 HB VAL 2 HB VAL 2 51.060 8.076 9.139
15 HG11 VAL 2 HG11 VAL 2 50.361 5.602 10.747
16 HG12 VAL 2 HG12 VAL 2 50.099 5.839 9.019
17 HG13 VAL 2 HG13 VAL 2 49.188 6.794 10.188
18 HG21 VAL 2 HG21 VAL 2 51.853 9.038 11.200
19 HG22 VAL 2 HG22 VAL 2 51.565 7.536 12.079
20 HG23 VAL 2 HG23 VAL 2 50.203 8.490 11.494
21 H ARG 3 HN ARG 3 53.606 7.614 7.615
22 HA ARG 3 HA ARG 3 52.337 5.880 5.730
23 HB2 ARG 3 HB2 ARG 3 54.941 7.424 5.511
24 HB3 ARG 3 HB1 ARG 3 54.093 6.681 4.155
25 HG2 ARG 3 HG2 ARG 3 52.085 8.063 4.710
26 HG3 ARG 3 HG1 ARG 3 53.031 8.872 5.960
27 HD2 ARG 3 HD2 ARG 3 53.556 8.878 2.978
28 HD3 ARG 3 HD1 ARG 3 53.119 10.256 3.988
29 HE ARG 3 HE ARG 3 55.468 9.324 5.123
30 HH11 ARG 3 HH21 ARG 3 54.402 10.253 1.979
31 HH12 ARG 3 HH22 ARG 3 55.958 10.825 1.476
32 HH21 ARG 3 HH11 ARG 3 57.505 10.067 4.484
33 HH22 ARG 3 HH12 ARG 3 57.715 10.720 2.894
34 H GLN 4 HN GLN 4 55.324 5.595 7.585
35 HA GLN 4 HA GLN 4 56.514 3.441 6.163
36 HB2 GLN 4 HB2 GLN 4 57.494 4.813 8.105
37 HB3 GLN 4 HB1 GLN 4 56.600 3.730 9.171
38 HG2 GLN 4 HG2 GLN 4 57.735 1.788 8.088
39 HG3 GLN 4 HG1 GLN 4 58.690 2.919 7.129
40 HE21 GLN 4 HE21 GLN 4 59.192 0.982 9.631
41 HE22 GLN 4 HE22 GLN 4 60.176 1.948 10.622
42 H GLU 5 HN GLU 5 54.308 3.366 8.977
43 HA GLU 5 HA GLU 5 54.066 0.507 9.036
44 HB2 GLU 5 HB2 GLU 5 52.238 2.705 10.049
45 HB3 GLU 5 HB1 GLU 5 51.980 0.989 10.373
46 HG2 GLU 5 HG2 GLU 5 53.182 1.938 12.252
47 HG3 GLU 5 HG1 GLU 5 54.291 0.895 11.359
48 H GLU 6 HN GLU 6 52.050 3.048 7.533
49 HA GLU 6 HA GLU 6 50.034 1.344 6.528
50 HB2 GLU 6 HB2 GLU 6 49.897 3.829 6.498
51 HB3 GLU 6 HB1 GLU 6 51.102 3.870 5.211
52 HG2 GLU 6 HG2 GLU 6 49.643 2.582 3.749
53 HG3 GLU 6 HG1 GLU 6 48.460 2.401 5.045
54 H LEU 7 HN LEU 7 53.359 1.617 5.593
55 HA LEU 7 HA LEU 7 52.979 0.604 2.883
56 HB2 LEU 7 HB2 LEU 7 54.985 1.960 3.878
57 HB3 LEU 7 HB1 LEU 7 55.546 0.402 4.469
58 HG LEU 7 HG LEU 7 56.600 0.872 2.334
59 HD11 LEU 7 HD11 LEU 7 54.463 -1.146 1.682
60 HD12 LEU 7 HD12 LEU 7 55.694 -1.477 2.903
61 HD13 LEU 7 HD13 LEU 7 56.168 -1.158 1.237
62 HD21 LEU 7 HD21 LEU 7 55.531 1.604 0.428
63 HD22 LEU 7 HD22 LEU 7 54.471 2.329 1.634
64 HD23 LEU 7 HD23 LEU 7 54.003 0.828 0.833
65 H ALA 8 HN ALA 8 54.242 -0.779 5.930
66 HA ALA 8 HA ALA 8 54.450 -3.452 4.929
67 HB1 ALA 8 HB1 ALA 8 54.008 -2.533 7.788
68 HB2 ALA 8 HB2 ALA 8 55.577 -2.691 6.998
69 HB3 ALA 8 HB3 ALA 8 54.589 -4.123 7.293
70 H ALA 9 HN ALA 9 51.731 -1.600 6.063
71 HA ALA 9 HA ALA 9 50.028 -3.879 6.650
72 HB1 ALA 9 HB1 ALA 9 49.469 -0.939 6.198
73 HB2 ALA 9 HB2 ALA 9 49.474 -1.813 7.730
74 HB3 ALA 9 HB3 ALA 9 48.197 -2.109 6.549
75 H ALA 10 HN ALA 10 50.048 -1.488 3.964
76 HA ALA 10 HA ALA 10 48.107 -2.852 2.392
77 HB1 ALA 10 HB1 ALA 10 50.307 -0.904 1.751
78 HB2 ALA 10 HB2 ALA 10 48.562 -0.680 1.642
79 HB3 ALA 10 HB3 ALA 10 49.400 -1.662 0.441
80 H ARG 11 HN ARG 11 51.515 -3.381 2.905
81 HA ARG 11 HA ARG 11 51.907 -5.159 0.653
82 HB2 ARG 11 HB2 ARG 11 53.597 -3.924 2.382
83 HB3 ARG 11 HB1 ARG 11 53.541 -5.499 3.158
84 HG2 ARG 11 HG2 ARG 11 55.259 -5.922 1.686
85 HG3 ARG 11 HG1 ARG 11 53.927 -6.313 0.605
86 HD2 ARG 11 HD2 ARG 11 54.027 -3.704 0.088
87 HD3 ARG 11 HD1 ARG 11 55.686 -3.878 0.651
88 HE ARG 11 HE ARG 11 54.731 -4.620 -1.919
89 HH11 ARG 11 HH21 ARG 11 56.599 -5.949 0.664
90 HH12 ARG 11 HH22 ARG 11 57.289 -7.196 -0.312
91 HH21 ARG 11 HH11 ARG 11 55.644 -6.223 -3.199
92 HH22 ARG 11 HH12 ARG 11 56.759 -7.346 -2.496
93 H ALA 12 HN ALA 12 51.340 -5.689 4.194
94 HA ALA 12 HA ALA 12 51.265 -8.498 4.141
95 HB1 ALA 12 HB1 ALA 12 51.146 -7.208 6.237
96 HB2 ALA 12 HB2 ALA 12 49.801 -8.344 6.134
97 HB3 ALA 12 HB3 ALA 12 49.540 -6.635 5.791
98 H ALA 13 HN ALA 13 49.178 -6.250 2.767
99 HA ALA 13 HA ALA 13 46.840 -7.970 2.585
100 HB1 ALA 13 HB1 ALA 13 46.945 -5.364 2.470
101 HB2 ALA 13 HB2 ALA 13 45.815 -6.210 1.413
102 HB3 ALA 13 HB3 ALA 13 47.347 -5.615 0.771
103 H LEU 14 HN LEU 14 49.528 -7.059 0.391
104 HA LEU 14 HA LEU 14 48.516 -8.415 -1.875
105 HB2 LEU 14 HB2 LEU 14 51.035 -7.219 -1.187
106 HB3 LEU 14 HB1 LEU 14 51.369 -8.783 -1.899
107 HG LEU 14 HG LEU 14 49.506 -6.767 -3.188
108 HD11 LEU 14 HD11 LEU 14 51.351 -6.076 -4.586
109 HD12 LEU 14 HD12 LEU 14 52.432 -7.232 -3.810
110 HD13 LEU 14 HD13 LEU 14 51.822 -5.848 -2.905
111 HD21 LEU 14 HD21 LEU 14 49.599 -8.167 -5.068
112 HD22 LEU 14 HD22 LEU 14 49.545 -9.323 -3.741
113 HD23 LEU 14 HD23 LEU 14 51.080 -8.961 -4.528
114 H HIS 15 HN HIS 15 50.111 -9.652 0.997
115 HA HIS 15 HA HIS 15 50.464 -12.332 -0.106
116 HB2 HIS 15 HB2 HIS 15 51.848 -11.403 1.775
117 HB3 HIS 15 HB1 HIS 15 50.416 -11.471 2.801
118 HD1 HIS 15 HD1 HIS 15 50.127 -13.604 4.054
119 HD2 HIS 15 HD2 HIS 15 52.414 -14.151 0.612
120 HE1 HIS 15 HE1 HIS 15 50.856 -16.029 4.056
121 H ASP 16 HN ASP 16 48.016 -10.638 1.773
122 HA ASP 16 HA ASP 16 46.478 -13.029 2.380
123 HB2 ASP 16 HB2 ASP 16 45.457 -10.185 2.378
124 HB3 ASP 16 HB1 ASP 16 44.889 -11.542 3.349
125 H LEU 17 HN LEU 17 46.835 -11.130 -0.451
126 HA LEU 17 HA LEU 17 44.121 -11.833 -1.451
127 HB2 LEU 17 HB2 LEU 17 46.317 -10.090 -2.590
128 HB3 LEU 17 HB1 LEU 17 44.830 -10.454 -3.448
129 HG LEU 17 HG LEU 17 44.763 -9.332 -0.642
130 HD11 LEU 17 HD11 LEU 17 46.062 -7.686 -1.746
131 HD12 LEU 17 HD12 LEU 17 44.410 -7.080 -1.841
132 HD13 LEU 17 HD13 LEU 17 45.149 -7.850 -3.245
133 HD21 LEU 17 HD21 LEU 17 42.839 -9.475 -2.979
134 HD22 LEU 17 HD22 LEU 17 42.588 -8.355 -1.648
135 HD23 LEU 17 HD23 LEU 17 42.617 -10.087 -1.343
136 H MET 18 HN MET 18 47.476 -12.795 -1.844
137 HA MET 18 HA MET 18 46.798 -14.408 -4.243
138 HB2 MET 18 HB2 MET 18 49.326 -13.561 -2.867
139 HB3 MET 18 HB1 MET 18 49.369 -15.061 -3.792
140 HG2 MET 18 HG2 MET 18 48.897 -13.981 -5.818
141 HG3 MET 18 HG1 MET 18 48.187 -12.577 -5.022
142 HE1 MET 18 HE1 MET 18 51.360 -11.372 -7.017
143 HE2 MET 18 HE2 MET 18 49.625 -11.672 -7.079
144 HE3 MET 18 HE3 MET 18 50.751 -12.996 -7.365
145 H THR 19 HN THR 19 46.648 -14.769 -0.895
146 HA THR 19 HA THR 19 47.362 -17.642 -0.905
147 HB THR 19 HB THR 19 46.513 -17.400 1.551
148 HG1 THR 19 HG1 THR 19 46.546 -14.754 0.583
149 HG21 THR 19 HG21 THR 19 48.910 -15.809 0.588
150 HG22 THR 19 HG22 THR 19 48.891 -17.545 0.898
151 HG23 THR 19 HG23 THR 19 48.662 -16.409 2.229
152 H GLY 20 HN GLY 20 44.646 -15.827 -1.711
153 HA2 GLY 20 HA2 GLY 20 42.812 -17.399 -2.594
154 HA3 GLY 20 HA1 GLY 20 42.776 -18.059 -0.962
155 H LYS 21 HN LYS 21 42.858 -15.793 0.617
156 HA LYS 21 HA LYS 21 40.191 -14.918 0.624
157 HB2 LYS 21 HB2 LYS 21 42.326 -13.037 1.602
158 HB3 LYS 21 HB1 LYS 21 40.777 -13.436 2.334
159 HG2 LYS 21 HG2 LYS 21 43.234 -15.214 2.220
160 HG3 LYS 21 HG1 LYS 21 42.567 -14.433 3.648
161 HD2 LYS 21 HD2 LYS 21 41.193 -16.573 1.991
162 HD3 LYS 21 HD1 LYS 21 41.890 -16.784 3.592
163 HE2 LYS 21 HE2 LYS 21 40.278 -14.827 4.272
164 HE3 LYS 21 HE1 LYS 21 39.413 -15.275 2.802
165 HZ1 LYS 21 HZ1 LYS 21 39.820 -16.813 5.262
166 HZ2 LYS 21 HZ2 LYS 21 39.689 -17.658 3.793
167 HZ3 LYS 21 HZ3 LYS 21 38.426 -16.645 4.310
168 H ARG 22 HN ARG 22 39.211 -13.891 -1.055
169 HA ARG 22 HA ARG 22 40.714 -12.248 -2.910
170 HB2 ARG 22 HB2 ARG 22 38.943 -13.670 -3.752
171 HB3 ARG 22 HB1 ARG 22 37.774 -12.930 -2.660
172 HG2 ARG 22 HG2 ARG 22 37.925 -10.821 -3.812
173 HG3 ARG 22 HG1 ARG 22 39.273 -11.395 -4.791
174 HD2 ARG 22 HD2 ARG 22 36.432 -12.446 -4.853
175 HD3 ARG 22 HD1 ARG 22 37.223 -11.496 -6.110
176 HE ARG 22 HE ARG 22 38.872 -13.703 -5.814
177 HH11 ARG 22 HH21 ARG 22 35.517 -13.136 -6.365
178 HH12 ARG 22 HH22 ARG 22 35.287 -14.586 -7.285
179 HH21 ARG 22 HH11 ARG 22 38.591 -15.601 -7.012
180 HH22 ARG 22 HH12 ARG 22 37.027 -15.981 -7.652
181 H VAL 23 HN VAL 23 38.184 -11.684 -0.455
182 HA VAL 23 HA VAL 23 38.281 -8.764 -0.938
183 HB VAL 23 HB VAL 23 36.151 -9.883 -0.356
184 HG11 VAL 23 HG11 VAL 23 37.348 -10.321 2.391
185 HG12 VAL 23 HG12 VAL 23 37.321 -11.585 1.161
186 HG13 VAL 23 HG13 VAL 23 35.808 -10.919 1.776
187 HG21 VAL 23 HG21 VAL 23 36.631 -7.492 0.290
188 HG22 VAL 23 HG22 VAL 23 37.097 -8.072 1.889
189 HG23 VAL 23 HG23 VAL 23 35.440 -8.282 1.323
190 H ALA 24 HN ALA 24 39.425 -7.318 0.257
191 HA ALA 24 HA ALA 24 40.606 -8.152 2.866
192 HB1 ALA 24 HB1 ALA 24 42.204 -6.935 0.591
193 HB2 ALA 24 HB2 ALA 24 42.347 -8.595 1.167
194 HB3 ALA 24 HB3 ALA 24 42.810 -7.255 2.215
195 H THR 25 HN THR 25 41.098 -6.334 4.228
196 HA THR 25 HA THR 25 39.747 -3.782 3.360
197 HB THR 25 HB THR 25 40.363 -4.576 6.212
198 HG1 THR 25 HG1 THR 25 39.120 -6.230 5.666
199 HG21 THR 25 HG21 THR 25 39.606 -2.234 5.465
200 HG22 THR 25 HG22 THR 25 38.693 -3.001 6.764
201 HG23 THR 25 HG23 THR 25 38.049 -2.987 5.123
202 H VAL 26 HN VAL 26 40.902 -1.843 3.496
203 HA VAL 26 HA VAL 26 43.520 -1.805 4.855
204 HB VAL 26 HB VAL 26 44.249 -0.555 2.513
205 HG11 VAL 26 HG11 VAL 26 44.475 -3.541 2.999
206 HG12 VAL 26 HG12 VAL 26 45.512 -2.324 3.742
207 HG13 VAL 26 HG13 VAL 26 45.539 -2.554 1.994
208 HG21 VAL 26 HG21 VAL 26 43.497 -1.905 0.639
209 HG22 VAL 26 HG22 VAL 26 42.093 -1.216 1.456
210 HG23 VAL 26 HG23 VAL 26 42.519 -2.910 1.707
211 H GLN 27 HN GLN 27 44.089 0.211 5.518
212 HA GLN 27 HA GLN 27 41.987 2.255 5.534
213 HB2 GLN 27 HB2 GLN 27 44.717 2.020 6.821
214 HB3 GLN 27 HB1 GLN 27 43.751 3.490 6.947
215 HG2 GLN 27 HG2 GLN 27 41.912 2.226 7.961
216 HG3 GLN 27 HG1 GLN 27 42.822 0.726 7.781
217 HE21 GLN 27 HE21 GLN 27 42.085 1.371 10.366
218 HE22 GLN 27 HE22 GLN 27 43.425 1.919 11.251
219 H LYS 28 HN LYS 28 41.874 3.819 3.953
220 HA LYS 28 HA LYS 28 44.426 4.730 2.676
221 HB2 LYS 28 HB2 LYS 28 43.308 3.072 1.203
222 HB3 LYS 28 HB1 LYS 28 41.849 4.063 1.223
223 HG2 LYS 28 HG2 LYS 28 43.035 5.914 0.174
224 HG3 LYS 28 HG1 LYS 28 44.557 5.027 0.258
225 HD2 LYS 28 HD2 LYS 28 43.661 3.302 -1.239
226 HD3 LYS 28 HD1 LYS 28 42.108 4.136 -1.293
227 HE2 LYS 28 HE2 LYS 28 43.300 6.151 -2.216
228 HE3 LYS 28 HE1 LYS 28 44.765 5.173 -2.316
229 HZ1 LYS 28 HZ1 LYS 28 42.187 4.521 -3.639
230 HZ2 LYS 28 HZ2 LYS 28 43.637 3.647 -3.777
231 HZ3 LYS 28 HZ3 LYS 28 43.526 5.219 -4.411
232 H ASP 29 HN ASP 29 44.444 7.036 2.363
233 HA ASP 29 HA ASP 29 43.661 9.265 2.693
234 HB2 ASP 29 HB2 ASP 29 42.432 8.525 0.608
235 HB3 ASP 29 HB1 ASP 29 41.069 8.093 1.641
236 H GLY 30 HN GLY 30 43.327 7.319 4.925
237 HA2 GLY 30 HA2 GLY 30 42.486 7.599 7.121
238 HA3 GLY 30 HA1 GLY 30 41.527 8.962 6.542
239 H ARG 31 HN ARG 31 40.366 7.336 4.333
240 HA ARG 31 HA ARG 31 38.303 5.938 5.964
241 HB2 ARG 31 HB2 ARG 31 37.514 7.649 4.359
242 HB3 ARG 31 HB1 ARG 31 38.292 6.774 3.047
243 HG2 ARG 31 HG2 ARG 31 35.852 6.293 3.193
244 HG3 ARG 31 HG1 ARG 31 36.839 4.851 3.397
245 HD2 ARG 31 HD2 ARG 31 34.840 5.310 5.051
246 HD3 ARG 31 HD1 ARG 31 36.362 4.677 5.676
247 HE ARG 31 HE ARG 31 36.683 7.413 5.876
248 HH11 ARG 31 HH21 ARG 31 34.293 5.119 6.823
249 HH12 ARG 31 HH22 ARG 31 33.804 6.009 8.226
250 HH21 ARG 31 HH11 ARG 31 36.059 8.589 7.700
251 HH22 ARG 31 HH12 ARG 31 34.804 7.974 8.723
252 H ARG 32 HN ARG 32 37.909 3.803 5.738
253 HA ARG 32 HA ARG 32 39.965 2.177 4.412
254 HB2 ARG 32 HB2 ARG 32 39.430 0.593 5.977
255 HB3 ARG 32 HB1 ARG 32 38.655 1.946 6.787
256 HG2 ARG 32 HG2 ARG 32 36.506 1.344 5.637
257 HG3 ARG 32 HG1 ARG 32 37.300 -0.090 4.987
258 HD2 ARG 32 HD2 ARG 32 36.607 0.548 7.843
259 HD3 ARG 32 HD1 ARG 32 36.297 -0.928 6.927
260 HE ARG 32 HE ARG 32 39.058 -0.804 7.041
261 HH11 ARG 32 HH21 ARG 32 36.456 -0.648 9.296
262 HH12 ARG 32 HH22 ARG 32 37.358 -1.363 10.590
263 HH21 ARG 32 HH11 ARG 32 40.252 -1.740 8.718
264 HH22 ARG 32 HH12 ARG 32 39.508 -1.981 10.262
265 H VAL 33 HN VAL 33 39.571 0.659 2.781
266 HA VAL 33 HA VAL 33 36.846 0.532 1.581
267 HB VAL 33 HB VAL 33 39.341 1.339 0.041
268 HG11 VAL 33 HG11 VAL 33 36.581 0.486 -0.877
269 HG12 VAL 33 HG12 VAL 33 38.126 -0.243 -1.315
270 HG13 VAL 33 HG13 VAL 33 37.708 1.363 -1.907
271 HG21 VAL 33 HG21 VAL 33 38.363 3.293 1.005
272 HG22 VAL 33 HG22 VAL 33 36.725 2.706 0.721
273 HG23 VAL 33 HG23 VAL 33 37.719 3.235 -0.634
274 H GLU 34 HN GLU 34 36.488 -1.371 0.459
275 HA GLU 34 HA GLU 34 38.512 -3.520 0.947
276 HB2 GLU 34 HB2 GLU 34 35.512 -3.398 0.857
277 HB3 GLU 34 HB1 GLU 34 36.277 -4.919 0.402
278 HG2 GLU 34 HG2 GLU 34 37.358 -5.116 2.532
279 HG3 GLU 34 HG1 GLU 34 36.939 -3.459 2.971
280 H PHE 35 HN PHE 35 39.788 -3.664 -0.917
281 HA PHE 35 HA PHE 35 38.447 -3.589 -3.580
282 HB2 PHE 35 HB2 PHE 35 41.330 -3.584 -2.663
283 HB3 PHE 35 HB1 PHE 35 40.923 -3.944 -4.336
284 HD1 PHE 35 HD1 PHE 35 39.063 -2.199 -5.345
285 HD2 PHE 35 HD2 PHE 35 41.882 -1.372 -2.222
286 HE1 PHE 35 HE1 PHE 35 38.920 0.226 -5.848
287 HE2 PHE 35 HE2 PHE 35 41.743 1.041 -2.705
288 HZ PHE 35 HZ PHE 35 40.258 1.850 -4.531
289 H THR 36 HN THR 36 38.333 -5.455 -4.886
290 HA THR 36 HA THR 36 38.958 -8.038 -3.507
291 HB THR 36 HB THR 36 37.417 -9.034 -5.171
292 HG1 THR 36 HG1 THR 36 36.314 -7.589 -6.568
293 HG21 THR 36 HG21 THR 36 36.058 -6.576 -4.088
294 HG22 THR 36 HG22 THR 36 36.623 -7.854 -3.010
295 HG23 THR 36 HG23 THR 36 35.418 -8.211 -4.248
296 H ALA 37 HN ALA 37 39.971 -9.789 -4.965
297 HA ALA 37 HA ALA 37 42.347 -8.909 -6.188
298 HB1 ALA 37 HB1 ALA 37 42.201 -11.227 -5.712
299 HB2 ALA 37 HB2 ALA 37 42.239 -11.139 -7.470
300 HB3 ALA 37 HB3 ALA 37 40.709 -11.406 -6.636
301 H THR 38 HN THR 38 39.204 -8.492 -7.385
302 HA THR 38 HA THR 38 39.607 -8.715 -10.193
303 HB THR 38 HB THR 38 37.674 -7.166 -10.392
304 HG1 THR 38 HG1 THR 38 38.200 -5.804 -8.670
305 HG21 THR 38 HG21 THR 38 36.101 -8.667 -9.541
306 HG22 THR 38 HG22 THR 38 37.034 -8.977 -8.080
307 HG23 THR 38 HG23 THR 38 37.540 -9.685 -9.616
308 H SER 39 HN SER 39 40.555 -6.240 -7.905
309 HA SER 39 HA SER 39 41.763 -4.670 -10.170
310 HB2 SER 39 HB2 SER 39 41.173 -2.624 -9.113
311 HB3 SER 39 HB1 SER 39 39.715 -3.609 -9.048
312 HG SER 39 HG SER 39 39.888 -3.070 -6.993
313 H VAL 40 HN VAL 40 43.339 -6.557 -9.062
314 HA VAL 40 HA VAL 40 44.764 -5.527 -6.723
315 HB VAL 40 HB VAL 40 44.681 -7.923 -6.981
316 HG11 VAL 40 HG11 VAL 40 46.147 -7.558 -9.632
317 HG12 VAL 40 HG12 VAL 40 44.424 -7.917 -9.496
318 HG13 VAL 40 HG13 VAL 40 45.619 -9.084 -8.929
319 HG21 VAL 40 HG21 VAL 40 47.011 -8.440 -6.714
320 HG22 VAL 40 HG22 VAL 40 46.842 -6.766 -6.179
321 HG23 VAL 40 HG23 VAL 40 47.497 -7.120 -7.777
322 H SER 41 HN SER 41 44.841 -4.768 -10.042
323 HA SER 41 HA SER 41 47.673 -4.225 -10.296
324 HB2 SER 41 HB2 SER 41 46.978 -2.928 -12.303
325 HB3 SER 41 HB1 SER 41 46.285 -4.547 -12.281
326 HG SER 41 HG SER 41 44.756 -2.711 -10.963
327 H ASP 42 HN ASP 42 44.824 -2.176 -9.609
328 HA ASP 42 HA ASP 42 46.174 0.307 -9.439
329 HB2 ASP 42 HB2 ASP 42 44.304 1.062 -8.076
330 HB3 ASP 42 HB1 ASP 42 43.687 -0.002 -9.339
331 H LEU 43 HN LEU 43 45.886 -2.325 -7.011
332 HA LEU 43 HA LEU 43 47.000 -0.824 -4.845
333 HB2 LEU 43 HB2 LEU 43 45.822 -3.135 -4.800
334 HB3 LEU 43 HB1 LEU 43 47.392 -3.797 -5.236
335 HG LEU 43 HG LEU 43 48.390 -2.797 -3.194
336 HD11 LEU 43 HD11 LEU 43 45.652 -1.579 -2.980
337 HD12 LEU 43 HD12 LEU 43 47.217 -0.903 -2.539
338 HD13 LEU 43 HD13 LEU 43 46.438 -2.067 -1.478
339 HD21 LEU 43 HD21 LEU 43 47.423 -4.358 -1.657
340 HD22 LEU 43 HD22 LEU 43 47.255 -5.080 -3.258
341 HD23 LEU 43 HD23 LEU 43 45.868 -4.317 -2.485
342 H LYS 44 HN LYS 44 48.428 -2.678 -7.494
343 HA LYS 44 HA LYS 44 51.139 -2.566 -6.517
344 HB2 LYS 44 HB2 LYS 44 49.796 -3.192 -9.112
345 HB3 LYS 44 HB1 LYS 44 51.484 -2.703 -9.222
346 HG2 LYS 44 HG2 LYS 44 52.168 -4.483 -7.739
347 HG3 LYS 44 HG1 LYS 44 50.493 -4.896 -7.381
348 HD2 LYS 44 HD2 LYS 44 50.117 -5.596 -9.675
349 HD3 LYS 44 HD1 LYS 44 51.722 -5.036 -10.147
350 HE2 LYS 44 HE2 LYS 44 51.253 -7.165 -8.048
351 HE3 LYS 44 HE1 LYS 44 51.559 -7.528 -9.747
352 HZ1 LYS 44 HZ1 LYS 44 53.447 -5.662 -8.728
353 HZ2 LYS 44 HZ2 LYS 44 53.714 -7.168 -9.470
354 HZ3 LYS 44 HZ3 LYS 44 53.439 -7.078 -7.795
355 H LYS 45 HN LYS 45 49.286 -0.461 -8.736
356 HA LYS 45 HA LYS 45 51.442 1.347 -9.265
357 HB2 LYS 45 HB2 LYS 45 49.184 1.103 -10.477
358 HB3 LYS 45 HB1 LYS 45 48.521 2.113 -9.194
359 HG2 LYS 45 HG2 LYS 45 50.088 3.906 -9.732
360 HG3 LYS 45 HG1 LYS 45 50.884 2.890 -10.930
361 HD2 LYS 45 HD2 LYS 45 49.418 4.277 -12.188
362 HD3 LYS 45 HD1 LYS 45 48.608 2.716 -12.092
363 HE2 LYS 45 HE2 LYS 45 47.095 3.487 -10.418
364 HE3 LYS 45 HE1 LYS 45 48.057 4.932 -10.104
365 HZ1 LYS 45 HZ1 LYS 45 46.987 4.464 -12.800
366 HZ2 LYS 45 HZ2 LYS 45 47.359 5.930 -12.027
367 HZ3 LYS 45 HZ3 LYS 45 45.959 5.069 -11.595
368 H TYR 46 HN TYR 46 48.877 1.354 -6.806
369 HA TYR 46 HA TYR 46 49.451 3.886 -5.650
370 HB2 TYR 46 HB2 TYR 46 47.433 2.617 -5.103
371 HB3 TYR 46 HB1 TYR 46 48.408 1.343 -4.381
372 HD1 TYR 46 HD1 TYR 46 48.156 5.090 -4.129
373 HD2 TYR 46 HD2 TYR 46 48.459 1.341 -2.047
374 HE1 TYR 46 HE1 TYR 46 48.077 6.286 -1.959
375 HE2 TYR 46 HE2 TYR 46 48.381 2.536 0.121
376 HH TYR 46 HH TYR 46 47.699 4.611 1.051
377 H ILE 47 HN ILE 47 50.663 0.641 -4.763
378 HA ILE 47 HA ILE 47 52.387 1.414 -2.662
379 HB ILE 47 HB ILE 47 52.713 -0.761 -4.748
380 HG12 ILE 47 HG12 ILE 47 51.893 -1.089 -1.857
381 HG13 ILE 47 HG11 ILE 47 50.701 -0.732 -3.107
382 HG21 ILE 47 HG21 ILE 47 54.196 -1.772 -2.890
383 HG22 ILE 47 HG22 ILE 47 54.271 -0.134 -2.239
384 HG23 ILE 47 HG23 ILE 47 54.884 -0.469 -3.858
385 HD11 ILE 47 HD11 ILE 47 51.255 -3.242 -2.510
386 HD12 ILE 47 HD12 ILE 47 52.654 -2.978 -3.553
387 HD13 ILE 47 HD13 ILE 47 51.027 -2.769 -4.193
388 H ALA 48 HN ALA 48 53.173 1.008 -6.124
389 HA ALA 48 HA ALA 48 55.843 1.862 -6.014
390 HB1 ALA 48 HB1 ALA 48 53.858 2.340 -8.254
391 HB2 ALA 48 HB2 ALA 48 54.795 0.865 -8.019
392 HB3 ALA 48 HB3 ALA 48 55.614 2.378 -8.407
393 H GLU 49 HN GLU 49 52.890 3.826 -6.325
394 HA GLU 49 HA GLU 49 54.133 6.321 -6.827
395 HB2 GLU 49 HB2 GLU 49 51.563 5.591 -5.414
396 HB3 GLU 49 HB1 GLU 49 52.054 7.268 -5.647
397 HG2 GLU 49 HG2 GLU 49 52.061 7.019 -8.039
398 HG3 GLU 49 HG1 GLU 49 51.856 5.272 -7.915
399 H LEU 50 HN LEU 50 53.842 4.492 -3.838
400 HA LEU 50 HA LEU 50 54.604 6.764 -2.157
401 HB2 LEU 50 HB2 LEU 50 54.714 3.819 -1.465
402 HB3 LEU 50 HB1 LEU 50 54.694 5.174 -0.339
403 HG LEU 50 HG LEU 50 52.459 4.461 -2.262
404 HD11 LEU 50 HD11 LEU 50 52.449 4.295 0.759
405 HD12 LEU 50 HD12 LEU 50 52.891 2.921 -0.255
406 HD13 LEU 50 HD13 LEU 50 51.277 3.619 -0.371
407 HD21 LEU 50 HD21 LEU 50 51.258 6.147 -0.659
408 HD22 LEU 50 HD22 LEU 50 52.293 6.790 -1.929
409 HD23 LEU 50 HD23 LEU 50 52.889 6.695 -0.271
410 H GLU 51 HN GLU 51 56.298 4.124 -3.789
411 HA GLU 51 HA GLU 51 58.774 4.374 -2.383
412 HB2 GLU 51 HB2 GLU 51 58.023 3.370 -5.124
413 HB3 GLU 51 HB1 GLU 51 59.720 3.494 -4.662
414 HG2 GLU 51 HG2 GLU 51 58.733 1.235 -4.202
415 HG3 GLU 51 HG1 GLU 51 59.366 2.028 -2.759
416 H VAL 52 HN VAL 52 57.368 6.204 -5.053
417 HA VAL 52 HA VAL 52 59.851 7.698 -5.526
418 HB VAL 52 HB VAL 52 57.051 8.343 -6.498
419 HG11 VAL 52 HG11 VAL 52 59.840 9.140 -7.376
420 HG12 VAL 52 HG12 VAL 52 58.546 10.202 -6.820
421 HG13 VAL 52 HG13 VAL 52 58.410 9.386 -8.377
422 HG21 VAL 52 HG21 VAL 52 59.193 6.510 -7.610
423 HG22 VAL 52 HG22 VAL 52 57.894 7.167 -8.607
424 HG23 VAL 52 HG23 VAL 52 57.514 6.110 -7.248
425 H GLN 53 HN GLN 53 56.853 8.136 -3.694
426 HA GLN 53 HA GLN 53 57.447 10.939 -3.090
427 HB2 GLN 53 HB2 GLN 53 55.396 8.984 -2.018
428 HB3 GLN 53 HB1 GLN 53 55.532 10.648 -1.450
429 HG2 GLN 53 HG2 GLN 53 55.191 11.464 -3.757
430 HG3 GLN 53 HG1 GLN 53 55.037 9.798 -4.318
431 HE21 GLN 53 HE21 GLN 53 53.220 12.445 -3.286
432 HE22 GLN 53 HE22 GLN 53 51.801 11.625 -2.844
433 H THR 54 HN THR 54 57.811 7.806 -1.477
434 HA THR 54 HA THR 54 58.935 9.119 0.932
435 HB THR 54 HB THR 54 58.783 6.136 0.487
436 HG1 THR 54 HG1 THR 54 56.747 7.843 0.365
437 HG21 THR 54 HG21 THR 54 59.885 6.934 2.520
438 HG22 THR 54 HG22 THR 54 58.345 6.178 2.932
439 HG23 THR 54 HG23 THR 54 58.486 7.936 2.907
440 H GLY 55 HN GLY 55 60.199 8.818 -1.910
441 HA2 GLY 55 HA2 GLY 55 62.562 7.182 -1.451
442 HA3 GLY 55 HA1 GLY 55 62.323 8.295 -2.799
443 H MET 56 HN MET 56 62.785 8.437 0.749
444 HA MET 56 HA MET 56 64.262 11.005 0.406
445 HB2 MET 56 HB2 MET 56 63.119 9.570 2.816
446 HB3 MET 56 HB1 MET 56 64.169 10.980 2.959
447 HG2 MET 56 HG2 MET 56 61.627 10.957 1.307
448 HG3 MET 56 HG1 MET 56 61.694 11.511 2.979
449 HE1 MET 56 HE1 MET 56 60.506 13.452 1.232
450 HE2 MET 56 HE2 MET 56 61.216 12.785 -0.237
451 HE3 MET 56 HE3 MET 56 61.491 14.475 0.177
452 H THR 57 HN THR 57 66.431 11.203 1.030
453 HA THR 57 HA THR 57 67.834 8.896 2.219
454 HB THR 57 HB THR 57 69.507 8.847 0.346
455 HG1 THR 57 HG1 THR 57 68.475 11.006 -0.376
456 HG21 THR 57 HG21 THR 57 67.497 7.274 0.564
457 HG22 THR 57 HG22 THR 57 68.225 7.398 -1.038
458 HG23 THR 57 HG23 THR 57 66.728 8.259 -0.681
459 H GLN 58 HN GLN 58 68.119 10.574 3.876
460 HA GLN 58 HA GLN 58 70.579 12.094 3.448
461 HB2 GLN 58 HB2 GLN 58 68.797 13.596 2.512
462 HB3 GLN 58 HB1 GLN 58 68.038 13.608 4.106
463 HG2 GLN 58 HG2 GLN 58 70.037 14.585 5.099
464 HG3 GLN 58 HG1 GLN 58 70.894 14.469 3.562
465 HE21 GLN 58 HE21 GLN 58 67.616 15.686 4.492
466 HE22 GLN 58 HE22 GLN 58 67.790 17.177 3.699
467 H ARG 59 HN ARG 59 71.205 10.680 5.198
468 HA ARG 59 HA ARG 59 71.457 10.108 7.467
469 HB2 ARG 59 HB2 ARG 59 70.795 13.054 7.533
470 HB3 ARG 59 HB1 ARG 59 71.225 12.162 8.992
471 HG2 ARG 59 HG2 ARG 59 72.929 12.269 6.488
472 HG3 ARG 59 HG1 ARG 59 73.174 13.313 7.885
473 HD2 ARG 59 HD2 ARG 59 73.119 10.821 9.076
474 HD3 ARG 59 HD1 ARG 59 73.883 10.455 7.533
475 HE ARG 59 HE ARG 59 75.189 11.653 9.713
476 HH11 ARG 59 HH21 ARG 59 74.627 12.349 6.376
477 HH12 ARG 59 HH22 ARG 59 75.970 13.427 6.247
478 HH21 ARG 59 HH11 ARG 59 76.947 13.040 9.544
479 HH22 ARG 59 HH12 ARG 59 77.286 13.813 8.032
480 H ARG 60 HN ARG 60 70.152 10.629 9.756
481 HA ARG 60 HA ARG 60 67.260 10.758 9.395
482 HB2 ARG 60 HB2 ARG 60 66.844 8.447 10.250
483 HB3 ARG 60 HB1 ARG 60 67.614 8.457 8.663
484 HG2 ARG 60 HG2 ARG 60 69.829 8.178 9.779
485 HG3 ARG 60 HG1 ARG 60 68.998 8.048 11.330
486 HD2 ARG 60 HD2 ARG 60 67.698 6.113 10.405
487 HD3 ARG 60 HD1 ARG 60 68.691 6.196 8.950
488 HE ARG 60 HE ARG 60 70.543 6.020 11.004
489 HH11 ARG 60 HH21 ARG 60 67.757 4.262 9.987
490 HH12 ARG 60 HH22 ARG 60 68.339 2.740 10.574
491 HH21 ARG 60 HH11 ARG 60 71.320 4.043 11.776
492 HH22 ARG 60 HH12 ARG 60 70.356 2.615 11.586
493 H ARG 61 HN ARG 61 70.097 10.409 11.373
494 HA ARG 61 HA ARG 61 70.446 10.811 13.663
495 HB2 ARG 61 HB2 ARG 61 67.902 12.441 13.437
496 HB3 ARG 61 HB1 ARG 61 69.201 12.658 14.604
497 HG2 ARG 61 HG2 ARG 61 69.577 12.946 11.607
498 HG3 ARG 61 HG1 ARG 61 69.235 14.300 12.678
499 HD2 ARG 61 HD2 ARG 61 71.676 12.512 12.687
500 HD3 ARG 61 HD1 ARG 61 71.610 14.249 12.415
501 HE ARG 61 HE ARG 61 70.573 13.959 14.960
502 HH11 ARG 61 HH21 ARG 61 73.413 12.937 13.294
503 HH12 ARG 61 HH22 ARG 61 74.412 12.961 14.709
504 HH21 ARG 61 HH11 ARG 61 71.860 13.995 16.816
505 HH22 ARG 61 HH12 ARG 61 73.533 13.560 16.703
506 H GLY 62 HN GLY 62 68.248 11.346 15.583
507 HA2 GLY 62 HA2 GLY 62 67.733 8.679 16.425
508 HA3 GLY 62 HA1 GLY 62 66.865 10.099 17.010
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 55.307 9.686 9.477
2 H2 MET 1 HT2 MET 1 56.794 10.178 10.137
3 H3 MET 1 HT3 MET 1 55.606 9.483 11.134
4 HA MET 1 HA MET 1 57.193 8.146 9.016
5 HB2 MET 1 HB2 MET 1 56.915 7.743 12.011
6 HB3 MET 1 HB1 MET 1 57.830 6.680 10.940
7 HG2 MET 1 HG2 MET 1 59.191 8.672 10.233
8 HG3 MET 1 HG1 MET 1 58.359 9.618 11.466
9 HE1 MET 1 HE1 MET 1 60.124 6.141 10.963
10 HE2 MET 1 HE2 MET 1 61.574 6.434 11.921
11 HE3 MET 1 HE3 MET 1 61.210 7.475 10.547
12 H VAL 2 HN VAL 2 54.089 8.477 10.175
13 HA VAL 2 HA VAL 2 53.158 5.834 10.538
14 HB VAL 2 HB VAL 2 51.685 8.105 9.170
15 HG11 VAL 2 HG11 VAL 2 49.701 6.921 10.199
16 HG12 VAL 2 HG12 VAL 2 50.784 5.589 10.600
17 HG13 VAL 2 HG13 VAL 2 50.500 6.018 8.913
18 HG21 VAL 2 HG21 VAL 2 52.009 7.384 12.100
19 HG22 VAL 2 HG22 VAL 2 50.830 8.547 11.492
20 HG23 VAL 2 HG23 VAL 2 52.556 8.863 11.310
21 H ARG 3 HN ARG 3 53.958 7.584 7.590
22 HA ARG 3 HA ARG 3 52.679 5.895 5.701
23 HB2 ARG 3 HB2 ARG 3 55.347 7.316 5.425
24 HB3 ARG 3 HB1 ARG 3 54.353 6.714 4.096
25 HG2 ARG 3 HG2 ARG 3 52.545 8.238 4.707
26 HG3 ARG 3 HG1 ARG 3 53.454 8.792 6.114
27 HD2 ARG 3 HD2 ARG 3 54.378 9.072 3.240
28 HD3 ARG 3 HD1 ARG 3 53.651 10.363 4.194
29 HE ARG 3 HE ARG 3 55.776 9.512 5.752
30 HH11 ARG 3 HH21 ARG 3 55.318 10.539 2.494
31 HH12 ARG 3 HH22 ARG 3 56.900 11.228 2.347
32 HH21 ARG 3 HH11 ARG 3 57.845 10.405 5.581
33 HH22 ARG 3 HH12 ARG 3 58.332 11.152 4.095
34 H GLN 4 HN GLN 4 55.698 5.511 7.488
35 HA GLN 4 HA GLN 4 56.772 3.351 5.979
36 HB2 GLN 4 HB2 GLN 4 57.689 4.785 8.067
37 HB3 GLN 4 HB1 GLN 4 57.147 3.366 8.957
38 HG2 GLN 4 HG2 GLN 4 59.405 2.891 8.395
39 HG3 GLN 4 HG1 GLN 4 58.459 1.989 7.209
40 HE21 GLN 4 HE21 GLN 4 60.600 2.223 5.925
41 HE22 GLN 4 HE22 GLN 4 60.792 3.630 4.994
42 H GLU 5 HN GLU 5 54.712 3.312 8.903
43 HA GLU 5 HA GLU 5 54.409 0.462 8.985
44 HB2 GLU 5 HB2 GLU 5 53.886 1.868 10.925
45 HB3 GLU 5 HB1 GLU 5 52.585 2.652 10.027
46 HG2 GLU 5 HG2 GLU 5 51.325 0.606 9.905
47 HG3 GLU 5 HG1 GLU 5 52.682 -0.332 10.532
48 H GLU 6 HN GLU 6 52.326 3.027 7.606
49 HA GLU 6 HA GLU 6 50.259 1.353 6.670
50 HB2 GLU 6 HB2 GLU 6 51.355 3.965 5.590
51 HB3 GLU 6 HB1 GLU 6 49.986 3.145 4.839
52 HG2 GLU 6 HG2 GLU 6 48.720 3.248 6.906
53 HG3 GLU 6 HG1 GLU 6 50.111 3.905 7.770
54 H LEU 7 HN LEU 7 53.546 1.555 5.616
55 HA LEU 7 HA LEU 7 53.065 0.534 2.928
56 HB2 LEU 7 HB2 LEU 7 55.126 1.848 3.869
57 HB3 LEU 7 HB1 LEU 7 55.671 0.277 4.437
58 HG LEU 7 HG LEU 7 56.670 0.736 2.275
59 HD11 LEU 7 HD11 LEU 7 54.473 -1.236 1.682
60 HD12 LEU 7 HD12 LEU 7 55.733 -1.597 2.864
61 HD13 LEU 7 HD13 LEU 7 56.161 -1.282 1.185
62 HD21 LEU 7 HD21 LEU 7 55.559 1.507 0.410
63 HD22 LEU 7 HD22 LEU 7 54.543 2.236 1.649
64 HD23 LEU 7 HD23 LEU 7 54.031 0.749 0.849
65 H ALA 8 HN ALA 8 54.380 -0.864 5.945
66 HA ALA 8 HA ALA 8 54.526 -3.542 4.961
67 HB1 ALA 8 HB1 ALA 8 54.113 -2.600 7.816
68 HB2 ALA 8 HB2 ALA 8 55.675 -2.801 7.020
69 HB3 ALA 8 HB3 ALA 8 54.655 -4.206 7.330
70 H ALA 9 HN ALA 9 51.835 -1.649 6.098
71 HA ALA 9 HA ALA 9 50.107 -3.908 6.695
72 HB1 ALA 9 HB1 ALA 9 49.595 -0.957 6.267
73 HB2 ALA 9 HB2 ALA 9 49.577 -1.850 7.788
74 HB3 ALA 9 HB3 ALA 9 48.299 -2.106 6.600
75 H ALA 10 HN ALA 10 50.117 -1.506 4.015
76 HA ALA 10 HA ALA 10 48.147 -2.864 2.468
77 HB1 ALA 10 HB1 ALA 10 50.333 -0.907 1.801
78 HB2 ALA 10 HB2 ALA 10 48.587 -0.684 1.724
79 HB3 ALA 10 HB3 ALA 10 49.405 -1.659 0.504
80 H ARG 11 HN ARG 11 51.584 -3.360 2.879
81 HA ARG 11 HA ARG 11 51.951 -5.126 0.630
82 HB2 ARG 11 HB2 ARG 11 53.671 -3.933 2.319
83 HB3 ARG 11 HB1 ARG 11 53.548 -5.466 3.171
84 HG2 ARG 11 HG2 ARG 11 55.256 -6.050 1.736
85 HG3 ARG 11 HG1 ARG 11 53.916 -6.404 0.647
86 HD2 ARG 11 HD2 ARG 11 54.087 -4.082 -0.247
87 HD3 ARG 11 HD1 ARG 11 55.496 -3.823 0.781
88 HE ARG 11 HE ARG 11 56.138 -6.104 -0.659
89 HH11 ARG 11 HH21 ARG 11 55.063 -2.910 -1.384
90 HH12 ARG 11 HH22 ARG 11 55.879 -2.839 -2.910
91 HH21 ARG 11 HH11 ARG 11 57.211 -6.029 -2.647
92 HH22 ARG 11 HH12 ARG 11 57.095 -4.605 -3.625
93 H ALA 12 HN ALA 12 51.361 -5.700 4.160
94 HA ALA 12 HA ALA 12 51.266 -8.506 4.071
95 HB1 ALA 12 HB1 ALA 12 51.146 -7.235 6.181
96 HB2 ALA 12 HB2 ALA 12 49.800 -8.368 6.061
97 HB3 ALA 12 HB3 ALA 12 49.542 -6.653 5.735
98 H ALA 13 HN ALA 13 49.196 -6.227 2.713
99 HA ALA 13 HA ALA 13 46.853 -7.940 2.507
100 HB1 ALA 13 HB1 ALA 13 45.822 -6.159 1.386
101 HB2 ALA 13 HB2 ALA 13 47.343 -5.572 0.709
102 HB3 ALA 13 HB3 ALA 13 46.984 -5.325 2.417
103 H LEU 14 HN LEU 14 49.581 -7.055 0.363
104 HA LEU 14 HA LEU 14 48.547 -8.378 -1.928
105 HB2 LEU 14 HB2 LEU 14 51.060 -7.157 -1.243
106 HB3 LEU 14 HB1 LEU 14 51.396 -8.699 -2.005
107 HG LEU 14 HG LEU 14 49.484 -6.677 -3.210
108 HD11 LEU 14 HD11 LEU 14 51.292 -5.903 -4.610
109 HD12 LEU 14 HD12 LEU 14 52.411 -7.053 -3.879
110 HD13 LEU 14 HD13 LEU 14 51.777 -5.711 -2.929
111 HD21 LEU 14 HD21 LEU 14 49.599 -8.014 -5.138
112 HD22 LEU 14 HD22 LEU 14 49.562 -9.207 -3.843
113 HD23 LEU 14 HD23 LEU 14 51.091 -8.801 -4.620
114 H HIS 15 HN HIS 15 50.207 -9.623 0.906
115 HA HIS 15 HA HIS 15 50.576 -12.285 -0.227
116 HB2 HIS 15 HB2 HIS 15 51.988 -11.389 1.631
117 HB3 HIS 15 HB1 HIS 15 50.571 -11.417 2.680
118 HD1 HIS 15 HD1 HIS 15 52.718 -13.789 0.625
119 HD2 HIS 15 HD2 HIS 15 50.046 -13.902 3.821
120 HE1 HIS 15 HE1 HIS 15 52.771 -16.158 1.518
121 H ASP 16 HN ASP 16 48.149 -10.649 1.740
122 HA ASP 16 HA ASP 16 46.633 -13.069 2.299
123 HB2 ASP 16 HB2 ASP 16 45.620 -10.225 2.405
124 HB3 ASP 16 HB1 ASP 16 45.022 -11.618 3.304
125 H LEU 17 HN LEU 17 46.975 -11.181 -0.524
126 HA LEU 17 HA LEU 17 44.211 -11.835 -1.447
127 HB2 LEU 17 HB2 LEU 17 46.377 -10.079 -2.624
128 HB3 LEU 17 HB1 LEU 17 44.874 -10.444 -3.457
129 HG LEU 17 HG LEU 17 44.873 -9.336 -0.643
130 HD11 LEU 17 HD11 LEU 17 44.442 -7.089 -1.840
131 HD12 LEU 17 HD12 LEU 17 45.167 -7.852 -3.254
132 HD13 LEU 17 HD13 LEU 17 46.106 -7.666 -1.776
133 HD21 LEU 17 HD21 LEU 17 42.654 -8.379 -1.606
134 HD22 LEU 17 HD22 LEU 17 42.712 -10.100 -1.245
135 HD23 LEU 17 HD23 LEU 17 42.874 -9.543 -2.905
136 H MET 18 HN MET 18 47.555 -12.805 -1.950
137 HA MET 18 HA MET 18 46.801 -14.378 -4.354
138 HB2 MET 18 HB2 MET 18 49.378 -13.621 -3.006
139 HB3 MET 18 HB1 MET 18 49.362 -15.065 -4.015
140 HG2 MET 18 HG2 MET 18 48.829 -13.859 -5.959
141 HG3 MET 18 HG1 MET 18 48.206 -12.481 -5.054
142 HE1 MET 18 HE1 MET 18 50.674 -12.825 -7.529
143 HE2 MET 18 HE2 MET 18 51.311 -11.239 -7.103
144 HE3 MET 18 HE3 MET 18 49.570 -11.509 -7.108
145 H THR 19 HN THR 19 46.711 -14.815 -1.015
146 HA THR 19 HA THR 19 47.419 -17.687 -1.095
147 HB THR 19 HB THR 19 46.616 -17.505 1.374
148 HG1 THR 19 HG1 THR 19 45.526 -15.487 0.948
149 HG21 THR 19 HG21 THR 19 48.967 -15.841 0.426
150 HG22 THR 19 HG22 THR 19 48.987 -17.588 0.660
151 HG23 THR 19 HG23 THR 19 48.760 -16.517 2.042
152 H GLY 20 HN GLY 20 44.853 -16.167 -2.270
153 HA2 GLY 20 HA2 GLY 20 42.944 -17.561 -3.003
154 HA3 GLY 20 HA1 GLY 20 42.941 -18.319 -1.413
155 H LYS 21 HN LYS 21 43.135 -16.079 0.234
156 HA LYS 21 HA LYS 21 40.469 -15.212 0.477
157 HB2 LYS 21 HB2 LYS 21 43.104 -14.156 1.442
158 HB3 LYS 21 HB1 LYS 21 41.665 -13.176 1.699
159 HG2 LYS 21 HG2 LYS 21 42.272 -14.693 3.594
160 HG3 LYS 21 HG1 LYS 21 40.640 -14.939 2.970
161 HD2 LYS 21 HD2 LYS 21 41.264 -16.932 1.828
162 HD3 LYS 21 HD1 LYS 21 42.984 -16.570 1.976
163 HE2 LYS 21 HE2 LYS 21 42.343 -18.312 3.583
164 HE3 LYS 21 HE1 LYS 21 42.814 -16.841 4.434
165 HZ1 LYS 21 HZ1 LYS 21 40.774 -17.764 5.335
166 HZ2 LYS 21 HZ2 LYS 21 40.030 -17.668 3.812
167 HZ3 LYS 21 HZ3 LYS 21 40.482 -16.250 4.631
168 H ARG 22 HN ARG 22 39.319 -14.013 -0.979
169 HA ARG 22 HA ARG 22 40.739 -12.353 -2.936
170 HB2 ARG 22 HB2 ARG 22 38.694 -13.994 -3.288
171 HB3 ARG 22 HB1 ARG 22 37.740 -12.596 -2.796
172 HG2 ARG 22 HG2 ARG 22 38.840 -11.252 -4.572
173 HG3 ARG 22 HG1 ARG 22 39.730 -12.686 -5.080
174 HD2 ARG 22 HD2 ARG 22 37.464 -13.828 -5.361
175 HD3 ARG 22 HD1 ARG 22 36.744 -12.227 -5.182
176 HE ARG 22 HE ARG 22 38.645 -11.871 -7.162
177 HH11 ARG 22 HH21 ARG 22 36.028 -14.037 -6.576
178 HH12 ARG 22 HH22 ARG 22 35.666 -14.266 -8.255
179 HH21 ARG 22 HH11 ARG 22 38.189 -12.156 -9.357
180 HH22 ARG 22 HH12 ARG 22 36.889 -13.200 -9.829
181 H VAL 23 HN VAL 23 38.397 -11.926 -0.285
182 HA VAL 23 HA VAL 23 38.320 -8.995 -0.754
183 HB VAL 23 HB VAL 23 36.270 -10.222 -0.101
184 HG11 VAL 23 HG11 VAL 23 37.568 -11.868 1.366
185 HG12 VAL 23 HG12 VAL 23 36.057 -11.265 2.047
186 HG13 VAL 23 HG13 VAL 23 37.599 -10.603 2.595
187 HG21 VAL 23 HG21 VAL 23 35.553 -8.656 1.614
188 HG22 VAL 23 HG22 VAL 23 36.651 -7.811 0.523
189 HG23 VAL 23 HG23 VAL 23 37.223 -8.360 2.098
190 H ALA 24 HN ALA 24 39.418 -7.509 0.422
191 HA ALA 24 HA ALA 24 40.675 -8.242 3.004
192 HB1 ALA 24 HB1 ALA 24 42.891 -7.477 2.322
193 HB2 ALA 24 HB2 ALA 24 42.296 -7.104 0.705
194 HB3 ALA 24 HB3 ALA 24 42.377 -8.779 1.251
195 H THR 25 HN THR 25 40.991 -6.397 4.325
196 HA THR 25 HA THR 25 39.743 -3.874 3.265
197 HB THR 25 HB THR 25 40.254 -4.736 6.130
198 HG1 THR 25 HG1 THR 25 38.305 -5.563 6.090
199 HG21 THR 25 HG21 THR 25 40.126 -2.371 6.063
200 HG22 THR 25 HG22 THR 25 38.503 -2.902 6.506
201 HG23 THR 25 HG23 THR 25 38.844 -2.395 4.851
202 H VAL 26 HN VAL 26 40.834 -1.881 3.500
203 HA VAL 26 HA VAL 26 43.516 -1.856 4.733
204 HB VAL 26 HB VAL 26 44.092 -0.511 2.388
205 HG11 VAL 26 HG11 VAL 26 44.435 -3.501 2.784
206 HG12 VAL 26 HG12 VAL 26 45.469 -2.271 3.512
207 HG13 VAL 26 HG13 VAL 26 45.417 -2.452 1.760
208 HG21 VAL 26 HG21 VAL 26 41.908 -1.213 1.427
209 HG22 VAL 26 HG22 VAL 26 42.391 -2.900 1.620
210 HG23 VAL 26 HG23 VAL 26 43.285 -1.846 0.525
211 H GLN 27 HN GLN 27 43.935 0.055 5.655
212 HA GLN 27 HA GLN 27 41.865 2.131 5.607
213 HB2 GLN 27 HB2 GLN 27 44.464 1.779 7.112
214 HB3 GLN 27 HB1 GLN 27 43.524 3.270 7.212
215 HG2 GLN 27 HG2 GLN 27 41.583 2.038 8.030
216 HG3 GLN 27 HG1 GLN 27 42.438 0.508 7.834
217 HE21 GLN 27 HE21 GLN 27 43.413 3.675 9.280
218 HE22 GLN 27 HE22 GLN 27 43.914 3.008 10.758
219 H LYS 28 HN LYS 28 41.893 3.629 3.990
220 HA LYS 28 HA LYS 28 44.512 4.346 2.744
221 HB2 LYS 28 HB2 LYS 28 42.662 3.426 1.268
222 HB3 LYS 28 HB1 LYS 28 41.730 4.875 1.641
223 HG2 LYS 28 HG2 LYS 28 43.257 6.295 0.548
224 HG3 LYS 28 HG1 LYS 28 44.541 5.091 0.560
225 HD2 LYS 28 HD2 LYS 28 42.014 4.381 -0.903
226 HD3 LYS 28 HD1 LYS 28 43.067 5.580 -1.647
227 HE2 LYS 28 HE2 LYS 28 43.674 3.368 -2.464
228 HE3 LYS 28 HE1 LYS 28 44.975 3.981 -1.447
229 HZ1 LYS 28 HZ1 LYS 28 44.102 1.589 -1.101
230 HZ2 LYS 28 HZ2 LYS 28 42.835 2.347 -0.260
231 HZ3 LYS 28 HZ3 LYS 28 44.441 2.552 0.253
232 H ASP 29 HN ASP 29 45.074 6.610 2.640
233 HA ASP 29 HA ASP 29 44.303 8.297 4.728
234 HB2 ASP 29 HB2 ASP 29 45.215 9.118 1.952
235 HB3 ASP 29 HB1 ASP 29 45.253 10.143 3.388
236 H GLY 30 HN GLY 30 42.001 8.227 4.944
237 HA2 GLY 30 HA2 GLY 30 40.375 10.214 4.300
238 HA3 GLY 30 HA1 GLY 30 40.389 9.404 2.731
239 H ARG 31 HN ARG 31 40.291 6.744 3.370
240 HA ARG 31 HA ARG 31 38.437 6.096 5.465
241 HB2 ARG 31 HB2 ARG 31 37.243 7.313 3.218
242 HB3 ARG 31 HB1 ARG 31 36.918 5.600 2.995
243 HG2 ARG 31 HG2 ARG 31 36.340 7.122 5.559
244 HG3 ARG 31 HG1 ARG 31 35.144 6.803 4.305
245 HD2 ARG 31 HD2 ARG 31 35.745 4.325 4.574
246 HD3 ARG 31 HD1 ARG 31 36.586 4.799 6.049
247 HE ARG 31 HE ARG 31 34.071 5.920 6.337
248 HH11 ARG 31 HH21 ARG 31 35.349 2.798 5.624
249 HH12 ARG 31 HH22 ARG 31 34.042 1.945 6.376
250 HH21 ARG 31 HH11 ARG 31 32.357 4.824 7.321
251 HH22 ARG 31 HH12 ARG 31 32.348 3.092 7.336
252 H ARG 32 HN ARG 32 38.078 3.884 5.602
253 HA ARG 32 HA ARG 32 40.045 2.237 4.192
254 HB2 ARG 32 HB2 ARG 32 39.600 0.623 5.813
255 HB3 ARG 32 HB1 ARG 32 39.181 2.091 6.680
256 HG2 ARG 32 HG2 ARG 32 36.781 1.717 5.849
257 HG3 ARG 32 HG1 ARG 32 37.309 0.098 5.391
258 HD2 ARG 32 HD2 ARG 32 38.157 -0.159 7.785
259 HD3 ARG 32 HD1 ARG 32 37.271 1.320 8.159
260 HE ARG 32 HE ARG 32 35.381 -0.279 6.919
261 HH11 ARG 32 HH21 ARG 32 37.596 -0.604 9.541
262 HH12 ARG 32 HH22 ARG 32 36.592 -1.703 10.426
263 HH21 ARG 32 HH11 ARG 32 34.057 -1.710 8.060
264 HH22 ARG 32 HH12 ARG 32 34.588 -2.328 9.588
265 H VAL 33 HN VAL 33 39.590 0.615 2.661
266 HA VAL 33 HA VAL 33 36.755 0.246 1.811
267 HB VAL 33 HB VAL 33 38.977 1.162 -0.049
268 HG11 VAL 33 HG11 VAL 33 37.696 -0.516 -1.206
269 HG12 VAL 33 HG12 VAL 33 37.100 1.048 -1.762
270 HG13 VAL 33 HG13 VAL 33 36.178 0.128 -0.578
271 HG21 VAL 33 HG21 VAL 33 37.157 2.946 -0.534
272 HG22 VAL 33 HG22 VAL 33 38.035 3.092 0.986
273 HG23 VAL 33 HG23 VAL 33 36.410 2.406 0.969
274 H GLU 34 HN GLU 34 36.388 -1.698 0.773
275 HA GLU 34 HA GLU 34 38.572 -3.709 1.082
276 HB2 GLU 34 HB2 GLU 34 35.581 -3.753 1.254
277 HB3 GLU 34 HB1 GLU 34 36.362 -5.229 0.692
278 HG2 GLU 34 HG2 GLU 34 37.628 -5.442 2.705
279 HG3 GLU 34 HG1 GLU 34 37.233 -3.799 3.214
280 H PHE 35 HN PHE 35 39.714 -3.783 -0.871
281 HA PHE 35 HA PHE 35 38.175 -3.835 -3.426
282 HB2 PHE 35 HB2 PHE 35 41.124 -3.656 -2.751
283 HB3 PHE 35 HB1 PHE 35 40.580 -4.003 -4.387
284 HD1 PHE 35 HD1 PHE 35 38.532 -2.331 -5.159
285 HD2 PHE 35 HD2 PHE 35 41.629 -1.428 -2.329
286 HE1 PHE 35 HE1 PHE 35 38.229 0.092 -5.589
287 HE2 PHE 35 HE2 PHE 35 41.327 0.984 -2.739
288 HZ PHE 35 HZ PHE 35 39.625 1.754 -4.383
289 H THR 36 HN THR 36 38.077 -5.731 -4.692
290 HA THR 36 HA THR 36 38.979 -8.235 -3.334
291 HB THR 36 HB THR 36 37.485 -9.385 -4.928
292 HG1 THR 36 HG1 THR 36 36.117 -7.770 -6.152
293 HG21 THR 36 HG21 THR 36 35.913 -7.035 -3.897
294 HG22 THR 36 HG22 THR 36 36.645 -8.181 -2.773
295 HG23 THR 36 HG23 THR 36 35.456 -8.736 -3.952
296 H ALA 37 HN ALA 37 40.011 -9.940 -4.881
297 HA ALA 37 HA ALA 37 42.321 -8.921 -6.110
298 HB1 ALA 37 HB1 ALA 37 42.341 -11.074 -7.453
299 HB2 ALA 37 HB2 ALA 37 40.773 -11.441 -6.742
300 HB3 ALA 37 HB3 ALA 37 42.195 -11.281 -5.709
301 H THR 38 HN THR 38 39.138 -8.582 -7.220
302 HA THR 38 HA THR 38 39.475 -8.653 -10.044
303 HB THR 38 HB THR 38 37.494 -7.140 -10.111
304 HG1 THR 38 HG1 THR 38 37.331 -5.856 -8.479
305 HG21 THR 38 HG21 THR 38 36.984 -9.134 -7.918
306 HG22 THR 38 HG22 THR 38 37.444 -9.702 -9.524
307 HG23 THR 38 HG23 THR 38 35.984 -8.737 -9.313
308 H SER 39 HN SER 39 40.404 -6.255 -7.669
309 HA SER 39 HA SER 39 41.501 -4.542 -9.885
310 HB2 SER 39 HB2 SER 39 40.891 -2.570 -8.703
311 HB3 SER 39 HB1 SER 39 39.461 -3.596 -8.653
312 HG SER 39 HG SER 39 40.354 -2.563 -6.612
313 H VAL 40 HN VAL 40 43.157 -6.438 -8.928
314 HA VAL 40 HA VAL 40 44.629 -5.478 -6.580
315 HB VAL 40 HB VAL 40 44.537 -7.870 -6.940
316 HG11 VAL 40 HG11 VAL 40 44.281 -7.747 -9.457
317 HG12 VAL 40 HG12 VAL 40 45.470 -8.942 -8.935
318 HG13 VAL 40 HG13 VAL 40 46.007 -7.389 -9.568
319 HG21 VAL 40 HG21 VAL 40 47.340 -6.999 -7.698
320 HG22 VAL 40 HG22 VAL 40 46.875 -8.382 -6.711
321 HG23 VAL 40 HG23 VAL 40 46.684 -6.742 -6.082
322 H SER 41 HN SER 41 44.621 -4.620 -9.885
323 HA SER 41 HA SER 41 47.443 -4.031 -10.167
324 HB2 SER 41 HB2 SER 41 46.713 -2.726 -12.147
325 HB3 SER 41 HB1 SER 41 46.018 -4.344 -12.134
326 HG SER 41 HG SER 41 44.699 -2.104 -11.012
327 H ASP 42 HN ASP 42 44.570 -2.056 -9.379
328 HA ASP 42 HA ASP 42 45.866 0.454 -9.195
329 HB2 ASP 42 HB2 ASP 42 44.017 1.142 -7.775
330 HB3 ASP 42 HB1 ASP 42 43.387 0.071 -9.025
331 H LEU 43 HN LEU 43 45.706 -2.233 -6.820
332 HA LEU 43 HA LEU 43 46.851 -0.764 -4.650
333 HB2 LEU 43 HB2 LEU 43 45.727 -3.119 -4.676
334 HB3 LEU 43 HB1 LEU 43 47.323 -3.713 -5.113
335 HG LEU 43 HG LEU 43 48.269 -2.722 -3.042
336 HD11 LEU 43 HD11 LEU 43 45.480 -1.616 -2.822
337 HD12 LEU 43 HD12 LEU 43 47.015 -0.890 -2.349
338 HD13 LEU 43 HD13 LEU 43 46.272 -2.110 -1.325
339 HD21 LEU 43 HD21 LEU 43 45.802 -4.347 -2.378
340 HD22 LEU 43 HD22 LEU 43 47.362 -4.358 -1.554
341 HD23 LEU 43 HD23 LEU 43 47.213 -5.044 -3.172
342 H LYS 44 HN LYS 44 48.262 -2.568 -7.358
343 HA LYS 44 HA LYS 44 50.991 -2.393 -6.463
344 HB2 LYS 44 HB2 LYS 44 49.618 -2.905 -9.079
345 HB3 LYS 44 HB1 LYS 44 51.325 -2.473 -9.137
346 HG2 LYS 44 HG2 LYS 44 51.898 -4.325 -7.669
347 HG3 LYS 44 HG1 LYS 44 50.197 -4.717 -7.440
348 HD2 LYS 44 HD2 LYS 44 50.125 -4.964 -10.032
349 HD3 LYS 44 HD1 LYS 44 51.883 -5.038 -9.922
350 HE2 LYS 44 HE2 LYS 44 51.327 -7.298 -9.764
351 HE3 LYS 44 HE1 LYS 44 51.384 -6.853 -8.058
352 HZ1 LYS 44 HZ1 LYS 44 49.017 -7.208 -9.790
353 HZ2 LYS 44 HZ2 LYS 44 48.930 -6.332 -8.338
354 HZ3 LYS 44 HZ3 LYS 44 49.375 -7.970 -8.319
355 H LYS 45 HN LYS 45 49.032 -0.282 -8.582
356 HA LYS 45 HA LYS 45 51.107 1.602 -9.130
357 HB2 LYS 45 HB2 LYS 45 48.811 1.341 -10.255
358 HB3 LYS 45 HB1 LYS 45 48.172 2.279 -8.909
359 HG2 LYS 45 HG2 LYS 45 49.667 4.137 -9.436
360 HG3 LYS 45 HG1 LYS 45 50.435 3.194 -10.709
361 HD2 LYS 45 HD2 LYS 45 48.883 4.568 -11.858
362 HD3 LYS 45 HD1 LYS 45 48.091 2.998 -11.754
363 HE2 LYS 45 HE2 LYS 45 46.680 3.723 -9.961
364 HE3 LYS 45 HE1 LYS 45 47.631 5.187 -9.710
365 HZ1 LYS 45 HZ1 LYS 45 46.654 6.223 -11.426
366 HZ2 LYS 45 HZ2 LYS 45 45.407 5.099 -11.165
367 HZ3 LYS 45 HZ3 LYS 45 46.562 4.824 -12.380
368 H TYR 46 HN TYR 46 48.643 1.481 -6.566
369 HA TYR 46 HA TYR 46 49.208 3.988 -5.363
370 HB2 TYR 46 HB2 TYR 46 47.258 2.619 -4.763
371 HB3 TYR 46 HB1 TYR 46 48.318 1.390 -4.085
372 HD1 TYR 46 HD2 TYR 46 47.873 5.119 -3.823
373 HD2 TYR 46 HD1 TYR 46 48.509 1.404 -1.757
374 HE1 TYR 46 HE2 TYR 46 47.846 6.318 -1.654
375 HE2 TYR 46 HE1 TYR 46 48.474 2.603 0.412
376 HH TYR 46 HH TYR 46 47.476 4.796 1.282
377 H ILE 47 HN ILE 47 50.519 0.755 -4.554
378 HA ILE 47 HA ILE 47 52.340 1.576 -2.555
379 HB ILE 47 HB ILE 47 52.690 -0.605 -4.632
380 HG12 ILE 47 HG12 ILE 47 51.762 -0.995 -1.782
381 HG13 ILE 47 HG11 ILE 47 50.604 -0.578 -3.043
382 HG21 ILE 47 HG21 ILE 47 54.092 0.008 -2.026
383 HG22 ILE 47 HG22 ILE 47 54.810 -0.227 -3.619
384 HG23 ILE 47 HG23 ILE 47 54.119 -1.598 -2.752
385 HD11 ILE 47 HD11 ILE 47 52.519 -2.815 -3.605
386 HD12 ILE 47 HD12 ILE 47 50.857 -2.595 -4.141
387 HD13 ILE 47 HD13 ILE 47 51.184 -3.123 -2.491
388 H ALA 48 HN ALA 48 52.765 1.359 -6.078
389 HA ALA 48 HA ALA 48 55.484 2.090 -6.207
390 HB1 ALA 48 HB1 ALA 48 54.398 1.295 -8.190
391 HB2 ALA 48 HB2 ALA 48 54.883 2.959 -8.515
392 HB3 ALA 48 HB3 ALA 48 53.203 2.590 -8.128
393 H GLU 49 HN GLU 49 52.587 4.166 -6.151
394 HA GLU 49 HA GLU 49 53.890 6.647 -6.556
395 HB2 GLU 49 HB2 GLU 49 51.379 5.920 -5.034
396 HB3 GLU 49 HB1 GLU 49 51.913 7.589 -5.238
397 HG2 GLU 49 HG2 GLU 49 51.817 7.382 -7.655
398 HG3 GLU 49 HG1 GLU 49 51.455 5.660 -7.530
399 H LEU 50 HN LEU 50 53.667 4.652 -3.655
400 HA LEU 50 HA LEU 50 54.630 6.803 -1.912
401 HB2 LEU 50 HB2 LEU 50 54.623 3.839 -1.317
402 HB3 LEU 50 HB1 LEU 50 54.640 5.167 -0.161
403 HG LEU 50 HG LEU 50 52.375 4.429 -2.037
404 HD11 LEU 50 HD11 LEU 50 51.186 4.231 0.225
405 HD12 LEU 50 HD12 LEU 50 52.789 4.282 0.955
406 HD13 LEU 50 HD13 LEU 50 52.364 2.975 -0.149
407 HD21 LEU 50 HD21 LEU 50 52.300 6.791 -1.943
408 HD22 LEU 50 HD22 LEU 50 52.848 6.833 -0.266
409 HD23 LEU 50 HD23 LEU 50 51.212 6.296 -0.648
410 H GLU 51 HN GLU 51 56.067 4.127 -3.722
411 HA GLU 51 HA GLU 51 58.613 4.126 -2.437
412 HB2 GLU 51 HB2 GLU 51 57.739 3.416 -5.240
413 HB3 GLU 51 HB1 GLU 51 59.422 3.286 -4.735
414 HG2 GLU 51 HG2 GLU 51 58.903 1.678 -3.051
415 HG3 GLU 51 HG1 GLU 51 57.173 1.993 -3.181
416 H VAL 52 HN VAL 52 57.207 6.237 -4.874
417 HA VAL 52 HA VAL 52 59.764 7.577 -5.418
418 HB VAL 52 HB VAL 52 56.962 8.475 -6.158
419 HG11 VAL 52 HG11 VAL 52 59.739 9.142 -7.166
420 HG12 VAL 52 HG12 VAL 52 58.560 10.248 -6.460
421 HG13 VAL 52 HG13 VAL 52 58.271 9.551 -8.054
422 HG21 VAL 52 HG21 VAL 52 57.243 6.257 -7.057
423 HG22 VAL 52 HG22 VAL 52 58.901 6.605 -7.549
424 HG23 VAL 52 HG23 VAL 52 57.553 7.383 -8.379
425 H GLN 53 HN GLN 53 56.961 8.037 -3.326
426 HA GLN 53 HA GLN 53 57.693 10.761 -2.606
427 HB2 GLN 53 HB2 GLN 53 55.347 9.630 -2.531
428 HB3 GLN 53 HB1 GLN 53 55.882 8.960 -0.990
429 HG2 GLN 53 HG2 GLN 53 56.447 11.296 -0.257
430 HG3 GLN 53 HG1 GLN 53 55.698 11.883 -1.740
431 HE21 GLN 53 HE21 GLN 53 54.228 12.961 0.030
432 HE22 GLN 53 HE22 GLN 53 52.880 12.061 0.534
433 H THR 54 HN THR 54 58.192 7.522 -1.256
434 HA THR 54 HA THR 54 59.425 8.593 1.184
435 HB THR 54 HB THR 54 59.707 5.717 0.330
436 HG1 THR 54 HG1 THR 54 57.375 6.383 1.623
437 HG21 THR 54 HG21 THR 54 60.631 6.448 2.489
438 HG22 THR 54 HG22 THR 54 59.270 5.353 2.741
439 HG23 THR 54 HG23 THR 54 59.055 7.091 2.955
440 H GLY 55 HN GLY 55 60.600 9.307 -1.442
441 HA2 GLY 55 HA2 GLY 55 63.386 8.449 -0.854
442 HA3 GLY 55 HA1 GLY 55 62.763 8.197 -2.485
443 H MET 56 HN MET 56 62.333 10.916 -0.212
444 HA MET 56 HA MET 56 64.031 12.688 -1.765
445 HB2 MET 56 HB2 MET 56 62.048 12.554 -3.256
446 HB3 MET 56 HB1 MET 56 61.029 13.104 -1.924
447 HG2 MET 56 HG2 MET 56 62.144 15.228 -1.836
448 HG3 MET 56 HG1 MET 56 63.410 14.677 -2.933
449 HE1 MET 56 HE1 MET 56 59.050 15.651 -3.792
450 HE2 MET 56 HE2 MET 56 59.822 15.191 -2.276
451 HE3 MET 56 HE3 MET 56 59.399 13.950 -3.453
452 H THR 57 HN THR 57 64.737 14.223 -0.354
453 HA THR 57 HA THR 57 62.936 15.206 1.791
454 HB THR 57 HB THR 57 64.539 14.723 3.556
455 HG1 THR 57 HG1 THR 57 66.498 14.745 2.719
456 HG21 THR 57 HG21 THR 57 64.221 12.212 1.899
457 HG22 THR 57 HG22 THR 57 62.902 12.938 2.816
458 HG23 THR 57 HG23 THR 57 64.329 12.331 3.655
459 H GLN 58 HN GLN 58 63.448 17.319 2.406
460 HA GLN 58 HA GLN 58 65.118 18.836 0.606
461 HB2 GLN 58 HB2 GLN 58 63.117 19.776 1.766
462 HB3 GLN 58 HB1 GLN 58 63.986 19.673 3.296
463 HG2 GLN 58 HG2 GLN 58 65.162 21.156 0.941
464 HG3 GLN 58 HG1 GLN 58 64.016 21.941 2.024
465 HE21 GLN 58 HE21 GLN 58 64.651 21.510 4.507
466 HE22 GLN 58 HE22 GLN 58 66.297 21.728 4.865
467 H ARG 59 HN ARG 59 67.229 19.435 0.820
468 HA ARG 59 HA ARG 59 68.591 19.228 3.431
469 HB2 ARG 59 HB2 ARG 59 68.921 17.293 1.196
470 HB3 ARG 59 HB1 ARG 59 70.435 17.898 1.863
471 HG2 ARG 59 HG2 ARG 59 68.193 16.686 3.508
472 HG3 ARG 59 HG1 ARG 59 69.630 15.813 2.986
473 HD2 ARG 59 HD2 ARG 59 70.719 18.080 4.174
474 HD3 ARG 59 HD1 ARG 59 69.323 17.755 5.197
475 HE ARG 59 HE ARG 59 71.749 16.354 5.335
476 HH11 ARG 59 HH21 ARG 59 68.415 15.605 4.824
477 HH12 ARG 59 HH22 ARG 59 68.573 13.968 5.357
478 HH21 ARG 59 HH11 ARG 59 71.956 14.233 6.043
479 HH22 ARG 59 HH12 ARG 59 70.571 13.193 6.051
480 H ARG 60 HN ARG 60 69.978 20.921 3.589
481 HA ARG 60 HA ARG 60 71.356 21.956 1.185
482 HB2 ARG 60 HB2 ARG 60 69.381 23.569 2.821
483 HB3 ARG 60 HB1 ARG 60 70.606 24.315 1.796
484 HG2 ARG 60 HG2 ARG 60 69.709 22.980 -0.137
485 HG3 ARG 60 HG1 ARG 60 68.400 22.436 0.911
486 HD2 ARG 60 HD2 ARG 60 67.771 24.815 1.308
487 HD3 ARG 60 HD1 ARG 60 69.022 25.309 0.169
488 HE ARG 60 HE ARG 60 67.490 23.508 -1.275
489 HH11 ARG 60 HH21 ARG 60 66.918 26.354 0.587
490 HH12 ARG 60 HH22 ARG 60 65.549 26.852 -0.348
491 HH21 ARG 60 HH11 ARG 60 65.704 24.143 -2.508
492 HH22 ARG 60 HH12 ARG 60 64.861 25.600 -2.101
493 H ARG 61 HN ARG 61 73.163 23.329 1.764
494 HA ARG 61 HA ARG 61 75.021 23.822 3.114
495 HB2 ARG 61 HB2 ARG 61 72.932 24.126 5.290
496 HB3 ARG 61 HB1 ARG 61 74.519 24.892 5.224
497 HG2 ARG 61 HG2 ARG 61 73.836 26.094 3.163
498 HG3 ARG 61 HG1 ARG 61 72.234 25.366 3.287
499 HD2 ARG 61 HD2 ARG 61 71.866 26.446 5.444
500 HD3 ARG 61 HD1 ARG 61 73.504 27.101 5.425
501 HE ARG 61 HE ARG 61 72.381 28.064 3.082
502 HH11 ARG 61 HH21 ARG 61 71.547 28.036 6.428
503 HH12 ARG 61 HH22 ARG 61 70.698 29.545 6.365
504 HH21 ARG 61 HH11 ARG 61 71.276 30.033 2.982
505 HH22 ARG 61 HH12 ARG 61 70.544 30.675 4.414
506 H GLY 62 HN GLY 62 75.910 21.681 3.093
507 HA2 GLY 62 HA2 GLY 62 76.256 20.478 5.665
508 HA3 GLY 62 HA1 GLY 62 75.093 19.528 4.737
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 55.903 10.148 9.006
2 H2 MET 1 HT2 MET 1 57.423 10.457 9.698
3 H3 MET 1 HT3 MET 1 56.162 9.833 10.652
4 HA MET 1 HA MET 1 57.537 8.438 8.420
5 HB2 MET 1 HB2 MET 1 57.541 8.080 11.429
6 HB3 MET 1 HB1 MET 1 58.173 6.875 10.306
7 HG2 MET 1 HG2 MET 1 59.107 9.755 10.343
8 HG3 MET 1 HG1 MET 1 59.910 8.467 11.240
9 HE1 MET 1 HE1 MET 1 60.416 6.118 10.034
10 HE2 MET 1 HE2 MET 1 61.778 7.187 10.362
11 HE3 MET 1 HE3 MET 1 61.690 6.331 8.826
12 H VAL 2 HN VAL 2 54.590 8.980 9.884
13 HA VAL 2 HA VAL 2 53.455 6.464 10.356
14 HB VAL 2 HB VAL 2 52.102 8.757 8.902
15 HG11 VAL 2 HG11 VAL 2 50.096 7.811 10.138
16 HG12 VAL 2 HG12 VAL 2 51.097 6.417 10.541
17 HG13 VAL 2 HG13 VAL 2 50.731 6.783 8.854
18 HG21 VAL 2 HG21 VAL 2 51.382 9.364 11.269
19 HG22 VAL 2 HG22 VAL 2 53.083 9.654 10.904
20 HG23 VAL 2 HG23 VAL 2 52.611 8.237 11.843
21 H ARG 3 HN ARG 3 54.051 8.076 7.251
22 HA ARG 3 HA ARG 3 52.658 6.372 5.516
23 HB2 ARG 3 HB2 ARG 3 55.409 7.589 5.118
24 HB3 ARG 3 HB1 ARG 3 54.400 6.928 3.831
25 HG2 ARG 3 HG2 ARG 3 52.636 8.567 4.361
26 HG3 ARG 3 HG1 ARG 3 53.636 9.228 5.655
27 HD2 ARG 3 HD2 ARG 3 54.419 9.148 2.726
28 HD3 ARG 3 HD1 ARG 3 53.813 10.571 3.572
29 HE ARG 3 HE ARG 3 55.980 9.764 5.099
30 HH11 ARG 3 HH21 ARG 3 55.381 10.490 1.783
31 HH12 ARG 3 HH22 ARG 3 56.985 11.069 1.483
32 HH21 ARG 3 HH11 ARG 3 58.079 10.518 4.726
33 HH22 ARG 3 HH12 ARG 3 58.513 11.086 3.149
34 H GLN 4 HN GLN 4 55.543 5.742 7.384
35 HA GLN 4 HA GLN 4 56.532 3.483 5.956
36 HB2 GLN 4 HB2 GLN 4 57.621 4.736 7.920
37 HB3 GLN 4 HB1 GLN 4 56.600 3.749 8.967
38 HG2 GLN 4 HG2 GLN 4 57.540 1.702 7.916
39 HG3 GLN 4 HG1 GLN 4 58.603 2.715 6.938
40 HE21 GLN 4 HE21 GLN 4 57.758 2.161 10.405
41 HE22 GLN 4 HE22 GLN 4 59.329 2.444 10.982
42 H GLU 5 HN GLU 5 54.236 3.679 8.682
43 HA GLU 5 HA GLU 5 53.703 0.878 8.839
44 HB2 GLU 5 HB2 GLU 5 53.084 2.770 10.498
45 HB3 GLU 5 HB1 GLU 5 51.667 3.017 9.482
46 HG2 GLU 5 HG2 GLU 5 52.430 0.359 10.728
47 HG3 GLU 5 HG1 GLU 5 51.243 1.473 11.407
48 H GLU 6 HN GLU 6 51.960 3.494 7.119
49 HA GLU 6 HA GLU 6 49.896 1.906 6.039
50 HB2 GLU 6 HB2 GLU 6 51.272 4.387 4.970
51 HB3 GLU 6 HB1 GLU 6 49.936 3.617 4.114
52 HG2 GLU 6 HG2 GLU 6 48.494 3.874 6.071
53 HG3 GLU 6 HG1 GLU 6 49.831 4.561 6.993
54 H LEU 7 HN LEU 7 53.282 1.852 5.309
55 HA LEU 7 HA LEU 7 52.978 0.708 2.642
56 HB2 LEU 7 HB2 LEU 7 55.028 1.961 3.746
57 HB3 LEU 7 HB1 LEU 7 55.443 0.363 4.344
58 HG LEU 7 HG LEU 7 56.620 0.678 2.276
59 HD11 LEU 7 HD11 LEU 7 55.907 -1.214 1.044
60 HD12 LEU 7 HD12 LEU 7 54.223 -0.987 1.511
61 HD13 LEU 7 HD13 LEU 7 55.405 -1.531 2.704
62 HD21 LEU 7 HD21 LEU 7 54.107 1.075 0.671
63 HD22 LEU 7 HD22 LEU 7 55.756 1.582 0.324
64 HD23 LEU 7 HD23 LEU 7 54.800 2.463 1.510
65 H ALA 8 HN ALA 8 53.890 -0.568 5.850
66 HA ALA 8 HA ALA 8 54.008 -3.305 5.033
67 HB1 ALA 8 HB1 ALA 8 53.886 -3.828 7.435
68 HB2 ALA 8 HB2 ALA 8 53.373 -2.176 7.777
69 HB3 ALA 8 HB3 ALA 8 54.992 -2.484 7.148
70 H ALA 9 HN ALA 9 51.307 -1.238 5.785
71 HA ALA 9 HA ALA 9 49.425 -3.363 6.382
72 HB1 ALA 9 HB1 ALA 9 47.717 -1.507 5.879
73 HB2 ALA 9 HB2 ALA 9 49.107 -0.449 5.635
74 HB3 ALA 9 HB3 ALA 9 48.841 -1.205 7.206
75 H ALA 10 HN ALA 10 49.835 -1.247 3.510
76 HA ALA 10 HA ALA 10 47.980 -2.700 1.905
77 HB1 ALA 10 HB1 ALA 10 49.382 -1.665 -0.026
78 HB2 ALA 10 HB2 ALA 10 50.271 -0.855 1.263
79 HB3 ALA 10 HB3 ALA 10 48.542 -0.572 1.072
80 H ARG 11 HN ARG 11 51.359 -3.201 2.672
81 HA ARG 11 HA ARG 11 51.882 -5.139 0.598
82 HB2 ARG 11 HB2 ARG 11 53.467 -3.830 2.353
83 HB3 ARG 11 HB1 ARG 11 53.273 -5.316 3.270
84 HG2 ARG 11 HG2 ARG 11 55.081 -5.986 2.013
85 HG3 ARG 11 HG1 ARG 11 53.840 -6.376 0.825
86 HD2 ARG 11 HD2 ARG 11 54.116 -4.068 -0.119
87 HD3 ARG 11 HD1 ARG 11 55.463 -3.825 0.991
88 HE ARG 11 HE ARG 11 56.118 -6.167 -0.341
89 HH11 ARG 11 HH21 ARG 11 55.202 -2.964 -1.226
90 HH12 ARG 11 HH22 ARG 11 56.119 -2.965 -2.695
91 HH21 ARG 11 HH11 ARG 11 57.320 -6.188 -2.254
92 HH22 ARG 11 HH12 ARG 11 57.317 -4.791 -3.278
93 H ALA 12 HN ALA 12 51.021 -5.435 4.109
94 HA ALA 12 HA ALA 12 50.869 -8.244 4.206
95 HB1 ALA 12 HB1 ALA 12 50.639 -6.819 6.211
96 HB2 ALA 12 HB2 ALA 12 49.284 -7.940 6.081
97 HB3 ALA 12 HB3 ALA 12 49.078 -6.251 5.619
98 H ALA 13 HN ALA 13 48.971 -6.017 2.560
99 HA ALA 13 HA ALA 13 46.590 -7.666 2.301
100 HB1 ALA 13 HB1 ALA 13 47.256 -5.454 0.373
101 HB2 ALA 13 HB2 ALA 13 46.869 -5.055 2.045
102 HB3 ALA 13 HB3 ALA 13 45.694 -5.912 1.051
103 H LEU 14 HN LEU 14 49.506 -7.046 0.321
104 HA LEU 14 HA LEU 14 48.558 -8.478 -1.955
105 HB2 LEU 14 HB2 LEU 14 51.065 -7.278 -1.198
106 HB3 LEU 14 HB1 LEU 14 51.396 -8.872 -1.846
107 HG LEU 14 HG LEU 14 49.620 -6.874 -3.278
108 HD11 LEU 14 HD11 LEU 14 52.564 -7.387 -3.758
109 HD12 LEU 14 HD12 LEU 14 51.932 -5.969 -2.923
110 HD13 LEU 14 HD13 LEU 14 51.530 -6.244 -4.614
111 HD21 LEU 14 HD21 LEU 14 49.783 -8.332 -5.109
112 HD22 LEU 14 HD22 LEU 14 49.653 -9.446 -3.750
113 HD23 LEU 14 HD23 LEU 14 51.226 -9.125 -4.475
114 H HIS 15 HN HIS 15 50.034 -9.573 1.045
115 HA HIS 15 HA HIS 15 50.397 -12.307 0.095
116 HB2 HIS 15 HB2 HIS 15 51.753 -11.350 1.947
117 HB3 HIS 15 HB1 HIS 15 50.294 -11.238 2.933
118 HD1 HIS 15 HD1 HIS 15 52.642 -13.754 1.392
119 HD2 HIS 15 HD2 HIS 15 49.395 -13.695 4.006
120 HE1 HIS 15 HE1 HIS 15 52.495 -16.072 2.405
121 H ASP 16 HN ASP 16 47.905 -10.510 1.814
122 HA ASP 16 HA ASP 16 46.338 -12.861 2.490
123 HB2 ASP 16 HB2 ASP 16 45.415 -9.985 2.334
124 HB3 ASP 16 HB1 ASP 16 44.679 -11.290 3.260
125 H LEU 17 HN LEU 17 46.772 -11.090 -0.413
126 HA LEU 17 HA LEU 17 44.082 -11.828 -1.450
127 HB2 LEU 17 HB2 LEU 17 46.328 -10.173 -2.638
128 HB3 LEU 17 HB1 LEU 17 44.825 -10.528 -3.474
129 HG LEU 17 HG LEU 17 44.843 -9.274 -0.722
130 HD11 LEU 17 HD11 LEU 17 45.141 -7.949 -3.420
131 HD12 LEU 17 HD12 LEU 17 46.127 -7.721 -1.978
132 HD13 LEU 17 HD13 LEU 17 44.482 -7.090 -2.029
133 HD21 LEU 17 HD21 LEU 17 42.839 -9.551 -2.971
134 HD22 LEU 17 HD22 LEU 17 42.648 -8.319 -1.731
135 HD23 LEU 17 HD23 LEU 17 42.664 -10.021 -1.283
136 H MET 18 HN MET 18 47.437 -12.837 -1.708
137 HA MET 18 HA MET 18 46.826 -14.516 -4.078
138 HB2 MET 18 HB2 MET 18 49.308 -13.670 -2.623
139 HB3 MET 18 HB1 MET 18 49.365 -15.209 -3.481
140 HG2 MET 18 HG2 MET 18 48.998 -14.206 -5.571
141 HG3 MET 18 HG1 MET 18 48.290 -12.755 -4.864
142 HE1 MET 18 HE1 MET 18 49.828 -11.940 -6.883
143 HE2 MET 18 HE2 MET 18 50.912 -13.313 -7.084
144 HE3 MET 18 HE3 MET 18 51.579 -11.713 -6.771
145 H THR 19 HN THR 19 46.501 -14.783 -0.740
146 HA THR 19 HA THR 19 47.164 -17.666 -0.631
147 HB THR 19 HB THR 19 46.169 -17.335 1.765
148 HG1 THR 19 HG1 THR 19 45.181 -15.335 1.259
149 HG21 THR 19 HG21 THR 19 48.581 -17.555 1.242
150 HG22 THR 19 HG22 THR 19 48.298 -16.404 2.548
151 HG23 THR 19 HG23 THR 19 48.659 -15.823 0.922
152 H GLY 20 HN GLY 20 44.546 -15.839 -1.664
153 HA2 GLY 20 HA2 GLY 20 42.718 -17.336 -2.623
154 HA3 GLY 20 HA1 GLY 20 42.601 -18.041 -1.014
155 H LYS 21 HN LYS 21 42.656 -15.817 0.628
156 HA LYS 21 HA LYS 21 40.002 -14.892 0.548
157 HB2 LYS 21 HB2 LYS 21 42.358 -13.388 1.726
158 HB3 LYS 21 HB1 LYS 21 40.664 -13.236 2.197
159 HG2 LYS 21 HG2 LYS 21 40.821 -15.819 2.649
160 HG3 LYS 21 HG1 LYS 21 42.561 -15.529 2.678
161 HD2 LYS 21 HD2 LYS 21 42.211 -13.787 4.423
162 HD3 LYS 21 HD1 LYS 21 40.490 -14.169 4.427
163 HE2 LYS 21 HE2 LYS 21 40.976 -16.475 5.102
164 HE3 LYS 21 HE1 LYS 21 42.708 -16.144 5.037
165 HZ1 LYS 21 HZ1 LYS 21 41.807 -15.999 7.295
166 HZ2 LYS 21 HZ2 LYS 21 40.773 -14.744 6.802
167 HZ3 LYS 21 HZ3 LYS 21 42.456 -14.520 6.777
168 H ARG 22 HN ARG 22 39.133 -13.814 -1.143
169 HA ARG 22 HA ARG 22 40.729 -12.110 -2.854
170 HB2 ARG 22 HB2 ARG 22 38.842 -13.587 -3.626
171 HB3 ARG 22 HB1 ARG 22 37.726 -12.489 -2.818
172 HG2 ARG 22 HG2 ARG 22 38.791 -10.622 -4.188
173 HG3 ARG 22 HG1 ARG 22 39.554 -11.884 -5.144
174 HD2 ARG 22 HD2 ARG 22 36.609 -11.333 -4.798
175 HD3 ARG 22 HD1 ARG 22 37.530 -11.326 -6.296
176 HE ARG 22 HE ARG 22 36.219 -13.586 -5.104
177 HH11 ARG 22 HH21 ARG 22 39.200 -12.728 -6.625
178 HH12 ARG 22 HH22 ARG 22 39.634 -14.366 -6.969
179 HH21 ARG 22 HH11 ARG 22 36.769 -15.708 -5.567
180 HH22 ARG 22 HH12 ARG 22 38.260 -16.048 -6.379
181 H VAL 23 HN VAL 23 38.059 -11.588 -0.530
182 HA VAL 23 HA VAL 23 38.176 -8.673 -0.922
183 HB VAL 23 HB VAL 23 36.082 -9.904 -0.283
184 HG11 VAL 23 HG11 VAL 23 37.325 -10.081 2.472
185 HG12 VAL 23 HG12 VAL 23 37.353 -11.432 1.339
186 HG13 VAL 23 HG13 VAL 23 35.811 -10.799 1.917
187 HG21 VAL 23 HG21 VAL 23 36.326 -7.483 0.139
188 HG22 VAL 23 HG22 VAL 23 37.062 -7.827 1.705
189 HG23 VAL 23 HG23 VAL 23 35.374 -8.245 1.413
190 H ALA 24 HN ALA 24 39.360 -7.240 0.237
191 HA ALA 24 HA ALA 24 40.660 -8.126 2.786
192 HB1 ALA 24 HB1 ALA 24 42.774 -7.027 2.038
193 HB2 ALA 24 HB2 ALA 24 42.060 -6.809 0.440
194 HB3 ALA 24 HB3 ALA 24 42.355 -8.433 1.062
195 H THR 25 HN THR 25 41.204 -6.351 4.195
196 HA THR 25 HA THR 25 39.632 -3.856 3.604
197 HB THR 25 HB THR 25 40.781 -4.676 6.284
198 HG1 THR 25 HG1 THR 25 39.262 -6.098 6.487
199 HG21 THR 25 HG21 THR 25 39.964 -2.382 6.079
200 HG22 THR 25 HG22 THR 25 38.864 -3.317 7.091
201 HG23 THR 25 HG23 THR 25 38.437 -2.965 5.416
202 H VAL 26 HN VAL 26 40.669 -1.793 3.822
203 HA VAL 26 HA VAL 26 43.577 -1.780 4.425
204 HB VAL 26 HB VAL 26 42.612 -0.315 1.979
205 HG11 VAL 26 HG11 VAL 26 44.924 -0.055 3.057
206 HG12 VAL 26 HG12 VAL 26 44.890 -0.409 1.330
207 HG13 VAL 26 HG13 VAL 26 45.251 -1.692 2.488
208 HG21 VAL 26 HG21 VAL 26 41.820 -2.547 1.555
209 HG22 VAL 26 HG22 VAL 26 43.327 -3.251 2.151
210 HG23 VAL 26 HG23 VAL 26 43.319 -2.334 0.650
211 H GLN 27 HN GLN 27 44.092 -0.054 5.626
212 HA GLN 27 HA GLN 27 42.077 2.026 6.158
213 HB2 GLN 27 HB2 GLN 27 44.891 2.155 7.234
214 HB3 GLN 27 HB1 GLN 27 43.374 2.587 8.025
215 HG2 GLN 27 HG2 GLN 27 42.795 0.103 7.971
216 HG3 GLN 27 HG1 GLN 27 44.472 -0.181 7.506
217 HE21 GLN 27 HE21 GLN 27 42.496 1.350 10.091
218 HE22 GLN 27 HE22 GLN 27 43.658 1.138 11.312
219 H LYS 28 HN LYS 28 41.984 3.820 4.839
220 HA LYS 28 HA LYS 28 44.539 4.918 3.746
221 HB2 LYS 28 HB2 LYS 28 43.483 3.440 2.039
222 HB3 LYS 28 HB1 LYS 28 42.035 4.445 2.111
223 HG2 LYS 28 HG2 LYS 28 43.207 6.358 1.276
224 HG3 LYS 28 HG1 LYS 28 44.773 5.574 1.489
225 HD2 LYS 28 HD2 LYS 28 44.232 3.936 -0.239
226 HD3 LYS 28 HD1 LYS 28 42.613 4.615 -0.411
227 HE2 LYS 28 HE2 LYS 28 43.608 6.779 -1.102
228 HE3 LYS 28 HE1 LYS 28 45.216 6.064 -0.977
229 HZ1 LYS 28 HZ1 LYS 28 43.931 6.104 -3.239
230 HZ2 LYS 28 HZ2 LYS 28 43.205 4.701 -2.614
231 HZ3 LYS 28 HZ3 LYS 28 44.892 4.776 -2.810
232 H ASP 29 HN ASP 29 44.553 7.182 4.171
233 HA ASP 29 HA ASP 29 43.674 9.311 4.788
234 HB2 ASP 29 HB2 ASP 29 41.421 8.501 2.927
235 HB3 ASP 29 HB1 ASP 29 41.969 10.134 3.304
236 H GLY 30 HN GLY 30 43.139 7.584 6.784
237 HA2 GLY 30 HA2 GLY 30 41.615 7.026 8.493
238 HA3 GLY 30 HA1 GLY 30 41.006 8.657 8.206
239 H ARG 31 HN ARG 31 40.904 6.054 5.824
240 HA ARG 31 HA ARG 31 38.019 5.622 6.321
241 HB2 ARG 31 HB2 ARG 31 38.151 7.562 4.747
242 HB3 ARG 31 HB1 ARG 31 39.080 6.564 3.636
243 HG2 ARG 31 HG2 ARG 31 36.679 6.646 3.017
244 HG3 ARG 31 HG1 ARG 31 37.210 5.012 3.398
245 HD2 ARG 31 HD2 ARG 31 34.949 5.957 4.412
246 HD3 ARG 31 HD1 ARG 31 35.999 4.927 5.383
247 HE ARG 31 HE ARG 31 36.908 7.471 5.953
248 HH11 ARG 31 HH21 ARG 31 33.854 5.877 5.913
249 HH12 ARG 31 HH22 ARG 31 33.191 6.830 7.198
250 HH21 ARG 31 HH11 ARG 31 36.062 8.726 7.630
251 HH22 ARG 31 HH12 ARG 31 34.440 8.444 8.169
252 H ARG 32 HN ARG 32 37.440 3.593 5.850
253 HA ARG 32 HA ARG 32 39.516 1.699 4.960
254 HB2 ARG 32 HB2 ARG 32 36.724 1.387 6.086
255 HB3 ARG 32 HB1 ARG 32 37.722 0.021 5.593
256 HG2 ARG 32 HG2 ARG 32 39.445 0.644 7.192
257 HG3 ARG 32 HG1 ARG 32 38.560 2.107 7.624
258 HD2 ARG 32 HD2 ARG 32 36.645 0.638 8.349
259 HD3 ARG 32 HD1 ARG 32 37.693 -0.758 8.094
260 HE ARG 32 HE ARG 32 39.170 0.880 9.771
261 HH11 ARG 32 HH21 ARG 32 35.998 -0.472 9.750
262 HH12 ARG 32 HH22 ARG 32 35.889 -0.581 11.475
263 HH21 ARG 32 HH11 ARG 32 39.046 0.744 12.024
264 HH22 ARG 32 HH12 ARG 32 37.615 0.107 12.762
265 H VAL 33 HN VAL 33 39.339 0.365 3.151
266 HA VAL 33 HA VAL 33 36.939 0.563 1.420
267 HB VAL 33 HB VAL 33 39.732 1.194 0.404
268 HG11 VAL 33 HG11 VAL 33 38.588 -0.170 -1.230
269 HG12 VAL 33 HG12 VAL 33 38.456 1.502 -1.776
270 HG13 VAL 33 HG13 VAL 33 37.084 0.719 -0.997
271 HG21 VAL 33 HG21 VAL 33 38.798 3.187 1.343
272 HG22 VAL 33 HG22 VAL 33 37.188 2.807 0.735
273 HG23 VAL 33 HG23 VAL 33 38.460 3.298 -0.382
274 H GLU 34 HN GLU 34 36.630 -1.262 0.182
275 HA GLU 34 HA GLU 34 38.446 -3.560 0.831
276 HB2 GLU 34 HB2 GLU 34 35.469 -3.294 0.455
277 HB3 GLU 34 HB1 GLU 34 36.233 -4.856 0.166
278 HG2 GLU 34 HG2 GLU 34 37.057 -4.973 2.408
279 HG3 GLU 34 HG1 GLU 34 36.666 -3.279 2.714
280 H PHE 35 HN PHE 35 39.846 -3.711 -0.953
281 HA PHE 35 HA PHE 35 38.667 -3.580 -3.691
282 HB2 PHE 35 HB2 PHE 35 41.486 -3.629 -2.601
283 HB3 PHE 35 HB1 PHE 35 41.187 -4.038 -4.286
284 HD1 PHE 35 HD2 PHE 35 39.401 -2.270 -5.448
285 HD2 PHE 35 HD1 PHE 35 42.117 -1.425 -2.235
286 HE1 PHE 35 HE2 PHE 35 39.356 0.140 -6.030
287 HE2 PHE 35 HE1 PHE 35 42.089 0.968 -2.813
288 HZ PHE 35 HZ PHE 35 40.698 1.762 -4.716
289 H THR 36 HN THR 36 38.559 -5.444 -4.996
290 HA THR 36 HA THR 36 39.081 -8.042 -3.593
291 HB THR 36 HB THR 36 37.524 -9.009 -5.247
292 HG1 THR 36 HG1 THR 36 36.546 -7.645 -6.749
293 HG21 THR 36 HG21 THR 36 35.540 -8.103 -4.376
294 HG22 THR 36 HG22 THR 36 36.221 -6.482 -4.259
295 HG23 THR 36 HG23 THR 36 36.735 -7.738 -3.131
296 H ALA 37 HN ALA 37 40.065 -9.816 -5.084
297 HA ALA 37 HA ALA 37 42.469 -8.921 -6.277
298 HB1 ALA 37 HB1 ALA 37 42.615 -11.136 -7.341
299 HB2 ALA 37 HB2 ALA 37 40.917 -11.430 -6.976
300 HB3 ALA 37 HB3 ALA 37 42.088 -11.279 -5.666
301 H THR 38 HN THR 38 39.323 -8.588 -7.505
302 HA THR 38 HA THR 38 39.682 -8.889 -10.292
303 HB THR 38 HB THR 38 37.834 -7.222 -10.519
304 HG1 THR 38 HG1 THR 38 37.241 -6.041 -8.848
305 HG21 THR 38 HG21 THR 38 36.190 -8.625 -9.628
306 HG22 THR 38 HG22 THR 38 37.133 -8.986 -8.186
307 HG23 THR 38 HG23 THR 38 37.568 -9.719 -9.731
308 H SER 39 HN SER 39 40.749 -6.337 -8.134
309 HA SER 39 HA SER 39 42.048 -4.970 -10.477
310 HB2 SER 39 HB2 SER 39 41.490 -2.840 -9.631
311 HB3 SER 39 HB1 SER 39 40.008 -3.768 -9.433
312 HG SER 39 HG SER 39 40.381 -2.803 -7.493
313 H VAL 40 HN VAL 40 43.535 -6.818 -9.236
314 HA VAL 40 HA VAL 40 44.937 -5.743 -6.909
315 HB VAL 40 HB VAL 40 44.808 -8.145 -7.111
316 HG11 VAL 40 HG11 VAL 40 45.760 -9.376 -9.003
317 HG12 VAL 40 HG12 VAL 40 46.353 -7.884 -9.728
318 HG13 VAL 40 HG13 VAL 40 44.616 -8.190 -9.636
319 HG21 VAL 40 HG21 VAL 40 47.652 -7.389 -7.846
320 HG22 VAL 40 HG22 VAL 40 47.131 -8.715 -6.811
321 HG23 VAL 40 HG23 VAL 40 46.961 -7.045 -6.263
322 H SER 41 HN SER 41 45.116 -5.103 -10.254
323 HA SER 41 HA SER 41 47.961 -4.590 -10.430
324 HB2 SER 41 HB2 SER 41 47.358 -3.401 -12.525
325 HB3 SER 41 HB1 SER 41 46.640 -5.008 -12.445
326 HG SER 41 HG SER 41 45.412 -2.508 -11.889
327 H ASP 42 HN ASP 42 45.101 -2.495 -9.933
328 HA ASP 42 HA ASP 42 46.467 -0.017 -9.847
329 HB2 ASP 42 HB2 ASP 42 44.582 0.721 -8.333
330 HB3 ASP 42 HB1 ASP 42 44.054 -0.043 -9.830
331 H LEU 43 HN LEU 43 46.274 -2.612 -7.414
332 HA LEU 43 HA LEU 43 47.251 -1.002 -5.238
333 HB2 LEU 43 HB2 LEU 43 46.095 -3.338 -5.189
334 HB3 LEU 43 HB1 LEU 43 47.704 -3.977 -5.503
335 HG LEU 43 HG LEU 43 48.554 -2.897 -3.445
336 HD11 LEU 43 HD11 LEU 43 47.354 -0.995 -2.912
337 HD12 LEU 43 HD12 LEU 43 46.464 -2.120 -1.897
338 HD13 LEU 43 HD13 LEU 43 45.824 -1.662 -3.474
339 HD21 LEU 43 HD21 LEU 43 45.999 -4.398 -2.821
340 HD22 LEU 43 HD22 LEU 43 47.508 -4.404 -1.910
341 HD23 LEU 43 HD23 LEU 43 47.427 -5.188 -3.487
342 H LYS 44 HN LYS 44 48.803 -3.038 -7.701
343 HA LYS 44 HA LYS 44 51.469 -2.827 -6.667
344 HB2 LYS 44 HB2 LYS 44 50.279 -3.413 -9.364
345 HB3 LYS 44 HB1 LYS 44 52.010 -3.101 -9.261
346 HG2 LYS 44 HG2 LYS 44 52.316 -4.916 -7.696
347 HG3 LYS 44 HG1 LYS 44 50.578 -5.151 -7.551
348 HD2 LYS 44 HD2 LYS 44 50.576 -5.607 -10.074
349 HD3 LYS 44 HD1 LYS 44 52.332 -5.699 -9.952
350 HE2 LYS 44 HE2 LYS 44 51.726 -7.937 -9.660
351 HE3 LYS 44 HE1 LYS 44 51.820 -7.386 -7.987
352 HZ1 LYS 44 HZ1 LYS 44 49.765 -8.653 -8.626
353 HZ2 LYS 44 HZ2 LYS 44 49.312 -7.307 -9.558
354 HZ3 LYS 44 HZ3 LYS 44 49.502 -7.156 -7.876
355 H LYS 45 HN LYS 45 49.719 -0.815 -9.049
356 HA LYS 45 HA LYS 45 51.871 1.000 -9.538
357 HB2 LYS 45 HB2 LYS 45 49.774 0.713 -10.906
358 HB3 LYS 45 HB1 LYS 45 48.912 1.600 -9.652
359 HG2 LYS 45 HG2 LYS 45 50.311 3.558 -9.987
360 HG3 LYS 45 HG1 LYS 45 51.338 2.678 -11.114
361 HD2 LYS 45 HD2 LYS 45 49.923 3.893 -12.545
362 HD3 LYS 45 HD1 LYS 45 49.149 2.312 -12.484
363 HE2 LYS 45 HE2 LYS 45 47.518 4.168 -12.199
364 HE3 LYS 45 HE1 LYS 45 47.571 3.116 -10.788
365 HZ1 LYS 45 HZ1 LYS 45 48.037 5.864 -10.905
366 HZ2 LYS 45 HZ2 LYS 45 49.510 5.122 -10.495
367 HZ3 LYS 45 HZ3 LYS 45 48.125 4.847 -9.551
368 H TYR 46 HN TYR 46 49.208 1.063 -7.183
369 HA TYR 46 HA TYR 46 49.677 3.669 -6.149
370 HB2 TYR 46 HB2 TYR 46 47.660 2.385 -5.634
371 HB3 TYR 46 HB1 TYR 46 48.623 1.188 -4.778
372 HD1 TYR 46 HD1 TYR 46 48.271 4.937 -4.797
373 HD2 TYR 46 HD2 TYR 46 48.554 1.345 -2.450
374 HE1 TYR 46 HE1 TYR 46 48.056 6.273 -2.721
375 HE2 TYR 46 HE2 TYR 46 48.339 2.683 -0.376
376 HH TYR 46 HH TYR 46 47.144 5.554 -0.156
377 H ILE 47 HN ILE 47 50.920 0.512 -5.027
378 HA ILE 47 HA ILE 47 52.493 1.451 -2.873
379 HB ILE 47 HB ILE 47 53.065 -0.825 -4.795
380 HG12 ILE 47 HG12 ILE 47 51.884 -1.060 -2.020
381 HG13 ILE 47 HG11 ILE 47 50.848 -0.744 -3.410
382 HG21 ILE 47 HG21 ILE 47 55.089 -0.427 -3.637
383 HG22 ILE 47 HG22 ILE 47 54.307 -1.703 -2.708
384 HG23 ILE 47 HG23 ILE 47 54.256 -0.036 -2.132
385 HD11 ILE 47 HD11 ILE 47 51.401 -3.240 -2.641
386 HD12 ILE 47 HD12 ILE 47 52.831 -2.979 -3.643
387 HD13 ILE 47 HD13 ILE 47 51.223 -2.823 -4.344
388 H ALA 48 HN ALA 48 53.508 0.871 -6.252
389 HA ALA 48 HA ALA 48 56.154 1.758 -6.043
390 HB1 ALA 48 HB1 ALA 48 55.226 0.701 -8.066
391 HB2 ALA 48 HB2 ALA 48 56.031 2.219 -8.461
392 HB3 ALA 48 HB3 ALA 48 54.271 2.149 -8.385
393 H GLU 49 HN GLU 49 53.232 3.725 -6.635
394 HA GLU 49 HA GLU 49 54.547 6.190 -7.101
395 HB2 GLU 49 HB2 GLU 49 51.835 5.452 -6.015
396 HB3 GLU 49 HB1 GLU 49 52.342 7.142 -6.001
397 HG2 GLU 49 HG2 GLU 49 52.449 5.412 -8.485
398 HG3 GLU 49 HG1 GLU 49 51.064 6.423 -8.076
399 H LEU 50 HN LEU 50 53.922 4.488 -4.072
400 HA LEU 50 HA LEU 50 54.579 6.773 -2.396
401 HB2 LEU 50 HB2 LEU 50 54.743 3.833 -1.674
402 HB3 LEU 50 HB1 LEU 50 54.650 5.191 -0.556
403 HG LEU 50 HG LEU 50 52.506 4.357 -2.533
404 HD11 LEU 50 HD11 LEU 50 52.882 2.963 -0.423
405 HD12 LEU 50 HD12 LEU 50 51.266 3.638 -0.621
406 HD13 LEU 50 HD13 LEU 50 52.404 4.394 0.492
407 HD21 LEU 50 HD21 LEU 50 52.815 6.741 -0.703
408 HD22 LEU 50 HD22 LEU 50 51.208 6.122 -1.082
409 HD23 LEU 50 HD23 LEU 50 52.258 6.694 -2.376
410 H GLU 51 HN GLU 51 56.430 4.184 -3.919
411 HA GLU 51 HA GLU 51 58.841 4.525 -2.420
412 HB2 GLU 51 HB2 GLU 51 58.217 3.472 -5.176
413 HB3 GLU 51 HB1 GLU 51 59.893 3.662 -4.665
414 HG2 GLU 51 HG2 GLU 51 59.074 1.382 -4.187
415 HG3 GLU 51 HG1 GLU 51 59.461 2.241 -2.697
416 H VAL 52 HN VAL 52 57.461 6.290 -5.139
417 HA VAL 52 HA VAL 52 59.893 7.820 -5.633
418 HB VAL 52 HB VAL 52 57.057 8.500 -6.467
419 HG11 VAL 52 HG11 VAL 52 58.337 9.574 -8.384
420 HG12 VAL 52 HG12 VAL 52 59.810 9.296 -7.455
421 HG13 VAL 52 HG13 VAL 52 58.553 10.356 -6.818
422 HG21 VAL 52 HG21 VAL 52 57.521 6.257 -7.246
423 HG22 VAL 52 HG22 VAL 52 59.148 6.713 -7.750
424 HG23 VAL 52 HG23 VAL 52 57.746 7.343 -8.617
425 H GLN 53 HN GLN 53 56.967 8.257 -3.675
426 HA GLN 53 HA GLN 53 57.665 11.027 -3.008
427 HB2 GLN 53 HB2 GLN 53 55.516 9.098 -2.128
428 HB3 GLN 53 HB1 GLN 53 55.785 10.596 -1.237
429 HG2 GLN 53 HG2 GLN 53 54.040 10.800 -3.031
430 HG3 GLN 53 HG1 GLN 53 55.388 11.919 -3.232
431 HE21 GLN 53 HE21 GLN 53 57.124 11.217 -4.825
432 HE22 GLN 53 HE22 GLN 53 56.669 10.245 -6.141
433 H THR 54 HN THR 54 57.880 7.838 -1.444
434 HA THR 54 HA THR 54 59.260 9.069 0.890
435 HB THR 54 HB THR 54 58.688 6.121 0.555
436 HG1 THR 54 HG1 THR 54 56.637 6.472 1.286
437 HG21 THR 54 HG21 THR 54 58.417 6.287 3.022
438 HG22 THR 54 HG22 THR 54 58.798 8.007 2.927
439 HG23 THR 54 HG23 THR 54 60.016 6.808 2.491
440 H GLY 55 HN GLY 55 60.334 8.591 -1.984
441 HA2 GLY 55 HA2 GLY 55 62.320 6.582 -1.967
442 HA3 GLY 55 HA1 GLY 55 62.444 8.086 -2.882
443 H MET 56 HN MET 56 62.056 9.295 0.043
444 HA MET 56 HA MET 56 64.891 9.816 0.418
445 HB2 MET 56 HB2 MET 56 62.490 10.481 2.150
446 HB3 MET 56 HB1 MET 56 64.123 11.094 2.417
447 HG2 MET 56 HG2 MET 56 62.982 12.796 1.186
448 HG3 MET 56 HG1 MET 56 64.036 11.986 0.026
449 HE1 MET 56 HE1 MET 56 62.431 13.067 -1.985
450 HE2 MET 56 HE2 MET 56 61.723 13.841 -0.570
451 HE3 MET 56 HE3 MET 56 60.676 13.082 -1.765
452 H THR 57 HN THR 57 65.997 9.378 2.525
453 HA THR 57 HA THR 57 65.018 7.464 4.406
454 HB THR 57 HB THR 57 65.106 5.771 2.743
455 HG1 THR 57 HG1 THR 57 66.236 4.598 4.037
456 HG21 THR 57 HG21 THR 57 66.227 6.916 0.963
457 HG22 THR 57 HG22 THR 57 67.202 5.493 1.330
458 HG23 THR 57 HG23 THR 57 67.704 7.080 1.913
459 H GLN 58 HN GLN 58 66.159 9.507 5.309
460 HA GLN 58 HA GLN 58 68.974 9.833 5.182
461 HB2 GLN 58 HB2 GLN 58 67.037 10.440 7.436
462 HB3 GLN 58 HB1 GLN 58 68.714 10.987 7.399
463 HG2 GLN 58 HG2 GLN 58 67.343 12.781 6.540
464 HG3 GLN 58 HG1 GLN 58 68.225 12.083 5.181
465 HE21 GLN 58 HE21 GLN 58 65.260 10.907 6.860
466 HE22 GLN 58 HE22 GLN 58 64.298 10.885 5.462
467 H ARG 59 HN ARG 59 70.635 8.705 6.079
468 HA ARG 59 HA ARG 59 70.396 7.180 8.516
469 HB2 ARG 59 HB2 ARG 59 69.131 5.711 6.923
470 HB3 ARG 59 HB1 ARG 59 70.598 5.573 5.954
471 HG2 ARG 59 HG2 ARG 59 71.787 4.521 7.775
472 HG3 ARG 59 HG1 ARG 59 70.455 4.833 8.888
473 HD2 ARG 59 HD2 ARG 59 68.998 3.336 7.637
474 HD3 ARG 59 HD1 ARG 59 70.244 3.097 6.412
475 HE ARG 59 HE ARG 59 71.477 2.315 8.767
476 HH11 ARG 59 HH21 ARG 59 68.547 1.570 7.108
477 HH12 ARG 59 HH22 ARG 59 68.480 -0.062 7.685
478 HH21 ARG 59 HH11 ARG 59 71.405 0.189 9.530
479 HH22 ARG 59 HH12 ARG 59 70.097 -0.844 9.057
480 H ARG 60 HN ARG 60 72.113 8.317 5.767
481 HA ARG 60 HA ARG 60 74.629 6.993 6.278
482 HB2 ARG 60 HB2 ARG 60 73.809 8.254 4.135
483 HB3 ARG 60 HB1 ARG 60 74.392 9.698 4.957
484 HG2 ARG 60 HG2 ARG 60 76.314 9.075 3.796
485 HG3 ARG 60 HG1 ARG 60 76.582 8.233 5.320
486 HD2 ARG 60 HD2 ARG 60 75.626 6.170 4.346
487 HD3 ARG 60 HD1 ARG 60 75.351 7.016 2.825
488 HE ARG 60 HE ARG 60 78.059 7.365 3.300
489 HH11 ARG 60 HH21 ARG 60 75.859 4.716 3.143
490 HH12 ARG 60 HH22 ARG 60 77.045 3.591 2.569
491 HH21 ARG 60 HH11 ARG 60 79.622 5.912 2.552
492 HH22 ARG 60 HH12 ARG 60 79.175 4.268 2.234
493 H ARG 61 HN ARG 61 73.029 8.827 8.345
494 HA ARG 61 HA ARG 61 75.443 9.655 9.760
495 HB2 ARG 61 HB2 ARG 61 75.086 11.539 8.150
496 HB3 ARG 61 HB1 ARG 61 73.490 11.796 8.859
497 HG2 ARG 61 HG2 ARG 61 74.513 12.203 11.055
498 HG3 ARG 61 HG1 ARG 61 76.114 11.919 10.376
499 HD2 ARG 61 HD2 ARG 61 75.097 13.858 8.668
500 HD3 ARG 61 HD1 ARG 61 74.419 14.341 10.219
501 HE ARG 61 HE ARG 61 77.065 14.829 9.426
502 HH11 ARG 61 HH21 ARG 61 75.453 13.244 12.039
503 HH12 ARG 61 HH22 ARG 61 76.791 13.402 13.122
504 HH21 ARG 61 HH11 ARG 61 78.799 15.049 10.835
505 HH22 ARG 61 HH12 ARG 61 78.678 14.426 12.446
506 H GLY 62 HN GLY 62 72.124 10.968 9.828
507 HA2 GLY 62 HA2 GLY 62 71.025 9.312 11.810
508 HA3 GLY 62 HA1 GLY 62 71.894 10.582 12.673
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 56.234 9.226 9.210
2 H2 MET 1 HT2 MET 1 57.655 9.471 8.311
3 H3 MET 1 HT3 MET 1 57.557 10.017 9.917
4 HA MET 1 HA MET 1 58.567 7.610 9.055
5 HB2 MET 1 HB2 MET 1 59.054 8.984 11.142
6 HB3 MET 1 HB1 MET 1 57.602 8.275 11.847
7 HG2 MET 1 HG2 MET 1 59.447 6.909 12.554
8 HG3 MET 1 HG1 MET 1 58.586 5.997 11.315
9 HE1 MET 1 HE1 MET 1 61.328 5.131 12.121
10 HE2 MET 1 HE2 MET 1 62.189 4.918 10.599
11 HE3 MET 1 HE3 MET 1 60.505 4.415 10.728
12 H VAL 2 HN VAL 2 55.342 8.319 10.315
13 HA VAL 2 HA VAL 2 54.543 5.648 10.902
14 HB VAL 2 HB VAL 2 52.784 7.867 9.818
15 HG11 VAL 2 HG11 VAL 2 51.076 6.702 11.242
16 HG12 VAL 2 HG12 VAL 2 52.256 5.426 11.536
17 HG13 VAL 2 HG13 VAL 2 51.659 5.716 9.902
18 HG21 VAL 2 HG21 VAL 2 52.422 8.371 12.264
19 HG22 VAL 2 HG22 VAL 2 54.046 8.747 11.690
20 HG23 VAL 2 HG23 VAL 2 53.760 7.282 12.630
21 H ARG 3 HN ARG 3 54.702 7.436 7.867
22 HA ARG 3 HA ARG 3 53.131 5.780 6.217
23 HB2 ARG 3 HB2 ARG 3 55.735 7.200 5.582
24 HB3 ARG 3 HB1 ARG 3 54.663 6.501 4.369
25 HG2 ARG 3 HG2 ARG 3 52.821 7.946 5.190
26 HG3 ARG 3 HG1 ARG 3 53.931 8.683 6.342
27 HD2 ARG 3 HD2 ARG 3 55.319 8.947 3.952
28 HD3 ARG 3 HD1 ARG 3 53.652 9.180 3.438
29 HE ARG 3 HE ARG 3 55.205 11.135 4.716
30 HH11 ARG 3 HH21 ARG 3 52.190 9.539 5.269
31 HH12 ARG 3 HH22 ARG 3 51.554 10.814 6.247
32 HH21 ARG 3 HH11 ARG 3 54.376 12.800 5.972
33 HH22 ARG 3 HH12 ARG 3 52.783 12.658 6.640
34 H GLN 4 HN GLN 4 56.140 5.100 7.788
35 HA GLN 4 HA GLN 4 57.092 3.025 6.051
36 HB2 GLN 4 HB2 GLN 4 58.356 4.173 7.960
37 HB3 GLN 4 HB1 GLN 4 57.478 3.099 9.049
38 HG2 GLN 4 HG2 GLN 4 58.353 1.140 7.821
39 HG3 GLN 4 HG1 GLN 4 59.242 2.217 6.743
40 HE21 GLN 4 HE21 GLN 4 61.342 2.725 7.393
41 HE22 GLN 4 HE22 GLN 4 61.942 2.538 8.970
42 H GLU 5 HN GLU 5 55.151 2.887 9.049
43 HA GLU 5 HA GLU 5 54.735 0.059 8.988
44 HB2 GLU 5 HB2 GLU 5 54.311 1.630 10.944
45 HB3 GLU 5 HB1 GLU 5 52.817 2.102 10.132
46 HG2 GLU 5 HG2 GLU 5 52.230 0.351 11.662
47 HG3 GLU 5 HG1 GLU 5 52.217 -0.367 10.051
48 H GLU 6 HN GLU 6 52.704 2.752 7.783
49 HA GLU 6 HA GLU 6 50.555 1.191 6.847
50 HB2 GLU 6 HB2 GLU 6 50.327 3.583 6.856
51 HB3 GLU 6 HB1 GLU 6 51.705 3.791 5.777
52 HG2 GLU 6 HG2 GLU 6 50.526 2.831 3.934
53 HG3 GLU 6 HG1 GLU 6 49.236 2.240 4.981
54 H LEU 7 HN LEU 7 53.812 1.351 5.670
55 HA LEU 7 HA LEU 7 53.187 0.449 2.969
56 HB2 LEU 7 HB2 LEU 7 55.322 1.680 3.876
57 HB3 LEU 7 HB1 LEU 7 55.857 0.068 4.328
58 HG LEU 7 HG LEU 7 56.752 0.613 2.142
59 HD11 LEU 7 HD11 LEU 7 56.119 -1.324 0.971
60 HD12 LEU 7 HD12 LEU 7 54.463 -1.257 1.566
61 HD13 LEU 7 HD13 LEU 7 55.775 -1.720 2.652
62 HD21 LEU 7 HD21 LEU 7 55.571 1.522 0.385
63 HD22 LEU 7 HD22 LEU 7 54.642 2.207 1.714
64 HD23 LEU 7 HD23 LEU 7 54.045 0.783 0.860
65 H ALA 8 HN ALA 8 54.589 -1.093 5.870
66 HA ALA 8 HA ALA 8 54.657 -3.729 4.782
67 HB1 ALA 8 HB1 ALA 8 54.358 -2.888 7.684
68 HB2 ALA 8 HB2 ALA 8 55.887 -3.088 6.826
69 HB3 ALA 8 HB3 ALA 8 54.852 -4.485 7.121
70 H ALA 9 HN ALA 9 52.027 -1.843 6.064
71 HA ALA 9 HA ALA 9 50.294 -4.093 6.670
72 HB1 ALA 9 HB1 ALA 9 48.501 -2.275 6.653
73 HB2 ALA 9 HB2 ALA 9 49.797 -1.133 6.295
74 HB3 ALA 9 HB3 ALA 9 49.817 -2.045 7.804
75 H ALA 10 HN ALA 10 50.232 -1.656 4.019
76 HA ALA 10 HA ALA 10 48.209 -2.990 2.520
77 HB1 ALA 10 HB1 ALA 10 49.403 -1.765 0.530
78 HB2 ALA 10 HB2 ALA 10 50.377 -1.031 1.804
79 HB3 ALA 10 HB3 ALA 10 48.629 -0.802 1.790
80 H ARG 11 HN ARG 11 51.645 -3.503 2.835
81 HA ARG 11 HA ARG 11 51.946 -5.240 0.550
82 HB2 ARG 11 HB2 ARG 11 53.703 -4.055 2.235
83 HB3 ARG 11 HB1 ARG 11 53.644 -5.631 3.008
84 HG2 ARG 11 HG2 ARG 11 55.310 -6.091 1.492
85 HG3 ARG 11 HG1 ARG 11 53.945 -6.441 0.438
86 HD2 ARG 11 HD2 ARG 11 54.108 -3.818 -0.047
87 HD3 ARG 11 HD1 ARG 11 55.778 -4.064 0.453
88 HE ARG 11 HE ARG 11 54.708 -4.729 -2.091
89 HH11 ARG 11 HH21 ARG 11 56.596 -6.183 0.410
90 HH12 ARG 11 HH22 ARG 11 57.198 -7.442 -0.607
91 HH21 ARG 11 HH11 ARG 11 55.509 -6.349 -3.422
92 HH22 ARG 11 HH12 ARG 11 56.595 -7.533 -2.773
93 H ALA 12 HN ALA 12 51.477 -5.848 4.091
94 HA ALA 12 HA ALA 12 51.396 -8.651 3.987
95 HB1 ALA 12 HB1 ALA 12 51.326 -7.403 6.109
96 HB2 ALA 12 HB2 ALA 12 49.975 -8.532 6.015
97 HB3 ALA 12 HB3 ALA 12 49.712 -6.815 5.709
98 H ALA 13 HN ALA 13 49.266 -6.379 2.710
99 HA ALA 13 HA ALA 13 46.933 -8.110 2.549
100 HB1 ALA 13 HB1 ALA 13 47.380 -5.739 0.741
101 HB2 ALA 13 HB2 ALA 13 47.029 -5.497 2.452
102 HB3 ALA 13 HB3 ALA 13 45.871 -6.343 1.427
103 H LEU 14 HN LEU 14 49.581 -7.163 0.320
104 HA LEU 14 HA LEU 14 48.538 -8.510 -1.937
105 HB2 LEU 14 HB2 LEU 14 51.066 -7.309 -1.285
106 HB3 LEU 14 HB1 LEU 14 51.387 -8.867 -2.018
107 HG LEU 14 HG LEU 14 49.490 -6.848 -3.252
108 HD11 LEU 14 HD11 LEU 14 51.302 -6.136 -4.685
109 HD12 LEU 14 HD12 LEU 14 52.409 -7.279 -3.923
110 HD13 LEU 14 HD13 LEU 14 51.791 -5.903 -3.010
111 HD21 LEU 14 HD21 LEU 14 51.054 -9.014 -4.649
112 HD22 LEU 14 HD22 LEU 14 49.555 -8.226 -5.148
113 HD23 LEU 14 HD23 LEU 14 49.538 -9.398 -3.834
114 H HIS 15 HN HIS 15 50.132 -9.744 0.918
115 HA HIS 15 HA HIS 15 50.498 -12.427 -0.185
116 HB2 HIS 15 HB2 HIS 15 51.906 -11.524 1.670
117 HB3 HIS 15 HB1 HIS 15 50.482 -11.523 2.711
118 HD1 HIS 15 HD1 HIS 15 50.737 -13.472 4.252
119 HD2 HIS 15 HD2 HIS 15 51.795 -14.456 0.341
120 HE1 HIS 15 HE1 HIS 15 51.246 -15.953 4.250
121 H ASP 16 HN ASP 16 48.060 -10.736 1.713
122 HA ASP 16 HA ASP 16 46.523 -13.122 2.339
123 HB2 ASP 16 HB2 ASP 16 45.482 -10.286 2.310
124 HB3 ASP 16 HB1 ASP 16 44.953 -11.631 3.319
125 H LEU 17 HN LEU 17 46.862 -11.210 -0.484
126 HA LEU 17 HA LEU 17 44.172 -11.973 -1.512
127 HB2 LEU 17 HB2 LEU 17 46.327 -10.162 -2.628
128 HB3 LEU 17 HB1 LEU 17 44.827 -10.526 -3.462
129 HG LEU 17 HG LEU 17 44.852 -9.438 -0.640
130 HD11 LEU 17 HD11 LEU 17 44.587 -7.192 -1.557
131 HD12 LEU 17 HD12 LEU 17 44.694 -7.820 -3.199
132 HD13 LEU 17 HD13 LEU 17 46.099 -7.886 -2.138
133 HD21 LEU 17 HD21 LEU 17 42.584 -8.529 -1.567
134 HD22 LEU 17 HD22 LEU 17 42.692 -10.239 -1.165
135 HD23 LEU 17 HD23 LEU 17 42.801 -9.721 -2.844
136 H MET 18 HN MET 18 47.535 -12.852 -1.818
137 HA MET 18 HA MET 18 47.010 -14.406 -4.287
138 HB2 MET 18 HB2 MET 18 49.358 -13.293 -2.939
139 HB3 MET 18 HB1 MET 18 49.624 -14.988 -3.332
140 HG2 MET 18 HG2 MET 18 50.375 -13.675 -5.212
141 HG3 MET 18 HG1 MET 18 48.877 -14.470 -5.692
142 HE1 MET 18 HE1 MET 18 50.276 -12.196 -7.078
143 HE2 MET 18 HE2 MET 18 49.127 -10.897 -7.389
144 HE3 MET 18 HE3 MET 18 48.681 -12.563 -7.748
145 H THR 19 HN THR 19 46.716 -14.841 -0.947
146 HA THR 19 HA THR 19 47.395 -17.724 -1.003
147 HB THR 19 HB THR 19 46.511 -17.534 1.436
148 HG1 THR 19 HG1 THR 19 45.561 -15.675 1.692
149 HG21 THR 19 HG21 THR 19 48.645 -16.563 2.179
150 HG22 THR 19 HG22 THR 19 48.921 -15.915 0.562
151 HG23 THR 19 HG23 THR 19 48.900 -17.659 0.822
152 H GLY 20 HN GLY 20 44.717 -15.838 -1.802
153 HA2 GLY 20 HA2 GLY 20 42.865 -17.328 -2.768
154 HA3 GLY 20 HA1 GLY 20 42.810 -18.079 -1.176
155 H LYS 21 HN LYS 21 42.935 -15.876 0.512
156 HA LYS 21 HA LYS 21 40.284 -15.003 0.635
157 HB2 LYS 21 HB2 LYS 21 42.361 -13.041 1.547
158 HB3 LYS 21 HB1 LYS 21 40.919 -13.609 2.378
159 HG2 LYS 21 HG2 LYS 21 43.485 -15.180 1.983
160 HG3 LYS 21 HG1 LYS 21 42.925 -14.460 3.488
161 HD2 LYS 21 HD2 LYS 21 40.829 -15.877 3.262
162 HD3 LYS 21 HD1 LYS 21 41.649 -16.737 1.961
163 HE2 LYS 21 HE2 LYS 21 42.776 -16.424 4.756
164 HE3 LYS 21 HE1 LYS 21 41.899 -17.849 4.196
165 HZ1 LYS 21 HZ1 LYS 21 44.120 -18.370 3.840
166 HZ2 LYS 21 HZ2 LYS 21 44.509 -16.813 3.280
167 HZ3 LYS 21 HZ3 LYS 21 43.592 -17.863 2.310
168 H ARG 22 HN ARG 22 39.193 -13.926 -0.939
169 HA ARG 22 HA ARG 22 40.618 -12.268 -2.859
170 HB2 ARG 22 HB2 ARG 22 38.572 -13.891 -3.207
171 HB3 ARG 22 HB1 ARG 22 37.618 -12.493 -2.718
172 HG2 ARG 22 HG2 ARG 22 38.763 -11.157 -4.497
173 HG3 ARG 22 HG1 ARG 22 39.576 -12.628 -5.026
174 HD2 ARG 22 HD2 ARG 22 37.273 -13.671 -5.283
175 HD3 ARG 22 HD1 ARG 22 36.605 -12.057 -5.041
176 HE ARG 22 HE ARG 22 38.455 -11.702 -7.069
177 HH11 ARG 22 HH21 ARG 22 35.794 -13.807 -6.458
178 HH12 ARG 22 HH22 ARG 22 35.375 -13.980 -8.129
179 HH21 ARG 22 HH11 ARG 22 37.924 -11.916 -9.255
180 HH22 ARG 22 HH12 ARG 22 36.581 -12.909 -9.713
181 H VAL 23 HN VAL 23 38.219 -11.757 -0.273
182 HA VAL 23 HA VAL 23 38.217 -8.834 -0.778
183 HB VAL 23 HB VAL 23 36.140 -10.037 -0.117
184 HG11 VAL 23 HG11 VAL 23 37.431 -11.630 1.429
185 HG12 VAL 23 HG12 VAL 23 35.898 -11.015 2.049
186 HG13 VAL 23 HG13 VAL 23 37.419 -10.322 2.613
187 HG21 VAL 23 HG21 VAL 23 36.495 -7.615 0.410
188 HG22 VAL 23 HG22 VAL 23 37.114 -8.082 1.994
189 HG23 VAL 23 HG23 VAL 23 35.435 -8.415 1.570
190 H ALA 24 HN ALA 24 39.368 -7.366 0.364
191 HA ALA 24 HA ALA 24 40.587 -8.093 2.972
192 HB1 ALA 24 HB1 ALA 24 42.311 -8.691 1.299
193 HB2 ALA 24 HB2 ALA 24 42.816 -7.304 2.263
194 HB3 ALA 24 HB3 ALA 24 42.213 -7.064 0.624
195 H THR 25 HN THR 25 40.848 -6.260 4.294
196 HA THR 25 HA THR 25 39.699 -3.714 3.179
197 HB THR 25 HB THR 25 40.083 -4.567 6.066
198 HG1 THR 25 HG1 THR 25 37.956 -5.117 5.998
199 HG21 THR 25 HG21 THR 25 39.990 -2.199 5.970
200 HG22 THR 25 HG22 THR 25 38.348 -2.708 6.366
201 HG23 THR 25 HG23 THR 25 38.747 -2.220 4.717
202 H VAL 26 HN VAL 26 40.810 -1.744 3.454
203 HA VAL 26 HA VAL 26 43.438 -1.750 4.794
204 HB VAL 26 HB VAL 26 44.125 -0.429 2.463
205 HG11 VAL 26 HG11 VAL 26 45.443 -2.180 3.664
206 HG12 VAL 26 HG12 VAL 26 45.459 -2.392 1.913
207 HG13 VAL 26 HG13 VAL 26 44.429 -3.415 2.916
208 HG21 VAL 26 HG21 VAL 26 42.446 -2.820 1.652
209 HG22 VAL 26 HG22 VAL 26 43.389 -1.783 0.583
210 HG23 VAL 26 HG23 VAL 26 41.977 -1.134 1.419
211 H GLN 27 HN GLN 27 43.847 0.143 5.725
212 HA GLN 27 HA GLN 27 41.799 2.233 5.610
213 HB2 GLN 27 HB2 GLN 27 43.156 1.364 7.686
214 HB3 GLN 27 HB1 GLN 27 44.401 2.475 7.119
215 HG2 GLN 27 HG2 GLN 27 41.536 3.190 7.812
216 HG3 GLN 27 HG1 GLN 27 42.973 3.608 8.744
217 HE21 GLN 27 HE21 GLN 27 44.397 5.283 7.886
218 HE22 GLN 27 HE22 GLN 27 43.905 6.299 6.618
219 H LYS 28 HN LYS 28 41.906 3.785 4.055
220 HA LYS 28 HA LYS 28 44.567 4.503 2.906
221 HB2 LYS 28 HB2 LYS 28 42.693 3.691 1.365
222 HB3 LYS 28 HB1 LYS 28 41.850 5.195 1.748
223 HG2 LYS 28 HG2 LYS 28 43.785 6.491 0.942
224 HG3 LYS 28 HG1 LYS 28 44.630 4.992 0.556
225 HD2 LYS 28 HD2 LYS 28 43.069 4.423 -1.147
226 HD3 LYS 28 HD1 LYS 28 41.912 5.635 -0.596
227 HE2 LYS 28 HE2 LYS 28 44.650 6.257 -1.744
228 HE3 LYS 28 HE1 LYS 28 43.134 6.361 -2.640
229 HZ1 LYS 28 HZ1 LYS 28 43.390 8.500 -1.899
230 HZ2 LYS 28 HZ2 LYS 28 44.106 8.036 -0.430
231 HZ3 LYS 28 HZ3 LYS 28 42.432 7.851 -0.657
232 H ASP 29 HN ASP 29 45.166 6.766 2.909
233 HA ASP 29 HA ASP 29 44.322 8.366 5.056
234 HB2 ASP 29 HB2 ASP 29 46.393 8.737 3.694
235 HB3 ASP 29 HB1 ASP 29 45.379 9.375 2.399
236 H GLY 30 HN GLY 30 41.997 8.294 5.082
237 HA2 GLY 30 HA2 GLY 30 40.463 10.366 4.443
238 HA3 GLY 30 HA1 GLY 30 40.570 9.632 2.841
239 H ARG 31 HN ARG 31 40.411 6.935 3.390
240 HA ARG 31 HA ARG 31 38.345 6.270 5.286
241 HB2 ARG 31 HB2 ARG 31 36.958 7.548 3.681
242 HB3 ARG 31 HB1 ARG 31 37.501 6.491 2.380
243 HG2 ARG 31 HG2 ARG 31 35.284 5.800 3.215
244 HG3 ARG 31 HG1 ARG 31 36.484 4.549 3.518
245 HD2 ARG 31 HD2 ARG 31 36.500 4.936 5.820
246 HD3 ARG 31 HD1 ARG 31 35.973 6.611 5.649
247 HE ARG 31 HE ARG 31 33.811 5.139 4.734
248 HH11 ARG 31 HH21 ARG 31 35.786 5.206 7.559
249 HH12 ARG 31 HH22 ARG 31 34.520 4.680 8.618
250 HH21 ARG 31 HH11 ARG 31 32.147 4.452 6.101
251 HH22 ARG 31 HH12 ARG 31 32.461 4.253 7.793
252 H ARG 32 HN ARG 32 38.003 4.075 5.397
253 HA ARG 32 HA ARG 32 40.035 2.397 4.118
254 HB2 ARG 32 HB2 ARG 32 39.468 0.812 5.728
255 HB3 ARG 32 HB1 ARG 32 38.978 2.289 6.548
256 HG2 ARG 32 HG2 ARG 32 36.651 1.902 5.534
257 HG3 ARG 32 HG1 ARG 32 37.217 0.280 5.132
258 HD2 ARG 32 HD2 ARG 32 37.851 0.005 7.570
259 HD3 ARG 32 HD1 ARG 32 37.004 1.520 7.885
260 HE ARG 32 HE ARG 32 35.137 -0.005 6.520
261 HH11 ARG 32 HH21 ARG 32 37.155 -0.407 9.288
262 HH12 ARG 32 HH22 ARG 32 36.050 -1.461 10.105
263 HH21 ARG 32 HH11 ARG 32 33.684 -1.379 7.571
264 HH22 ARG 32 HH12 ARG 32 34.084 -2.011 9.134
265 H VAL 33 HN VAL 33 39.631 0.768 2.565
266 HA VAL 33 HA VAL 33 36.843 0.461 1.554
267 HB VAL 33 HB VAL 33 39.184 1.318 -0.182
268 HG11 VAL 33 HG11 VAL 33 36.397 0.338 -0.862
269 HG12 VAL 33 HG12 VAL 33 37.933 -0.342 -1.399
270 HG13 VAL 33 HG13 VAL 33 37.405 1.229 -1.998
271 HG21 VAL 33 HG21 VAL 33 38.225 3.273 0.788
272 HG22 VAL 33 HG22 VAL 33 36.591 2.620 0.685
273 HG23 VAL 33 HG23 VAL 33 37.428 3.134 -0.778
274 H GLU 34 HN GLU 34 36.486 -1.483 0.526
275 HA GLU 34 HA GLU 34 38.611 -3.539 0.950
276 HB2 GLU 34 HB2 GLU 34 35.616 -3.512 1.025
277 HB3 GLU 34 HB1 GLU 34 36.381 -5.014 0.512
278 HG2 GLU 34 HG2 GLU 34 37.581 -5.215 2.569
279 HG3 GLU 34 HG1 GLU 34 37.195 -3.559 3.038
280 H PHE 35 HN PHE 35 39.811 -3.699 -0.956
281 HA PHE 35 HA PHE 35 38.367 -3.729 -3.565
282 HB2 PHE 35 HB2 PHE 35 41.288 -3.645 -2.775
283 HB3 PHE 35 HB1 PHE 35 40.802 -4.006 -4.426
284 HD1 PHE 35 HD1 PHE 35 38.868 -2.294 -5.335
285 HD2 PHE 35 HD2 PHE 35 41.817 -1.423 -2.344
286 HE1 PHE 35 HE1 PHE 35 38.655 0.129 -5.821
287 HE2 PHE 35 HE2 PHE 35 41.606 0.990 -2.810
288 HZ PHE 35 HZ PHE 35 40.024 1.774 -4.562
289 H THR 36 HN THR 36 38.251 -5.637 -4.818
290 HA THR 36 HA THR 36 39.013 -8.157 -3.396
291 HB THR 36 HB THR 36 37.480 -9.269 -4.968
292 HG1 THR 36 HG1 THR 36 36.231 -7.395 -6.163
293 HG21 THR 36 HG21 THR 36 36.666 -7.955 -2.870
294 HG22 THR 36 HG22 THR 36 35.471 -8.489 -4.051
295 HG23 THR 36 HG23 THR 36 36.011 -6.813 -4.043
296 H ALA 37 HN ALA 37 39.983 -9.930 -4.908
297 HA ALA 37 HA ALA 37 42.342 -9.002 -6.145
298 HB1 ALA 37 HB1 ALA 37 42.143 -11.347 -5.628
299 HB2 ALA 37 HB2 ALA 37 42.350 -11.211 -7.371
300 HB3 ALA 37 HB3 ALA 37 40.752 -11.518 -6.699
301 H THR 38 HN THR 38 39.165 -8.675 -7.297
302 HA THR 38 HA THR 38 39.501 -8.899 -10.105
303 HB THR 38 HB THR 38 37.577 -7.317 -10.261
304 HG1 THR 38 HG1 THR 38 37.070 -6.113 -8.617
305 HG21 THR 38 HG21 THR 38 37.433 -9.841 -9.536
306 HG22 THR 38 HG22 THR 38 36.009 -8.813 -9.383
307 HG23 THR 38 HG23 THR 38 36.991 -9.169 -7.965
308 H SER 39 HN SER 39 40.468 -6.366 -7.877
309 HA SER 39 HA SER 39 41.696 -4.879 -10.184
310 HB2 SER 39 HB2 SER 39 41.047 -2.799 -9.280
311 HB3 SER 39 HB1 SER 39 39.608 -3.795 -9.099
312 HG SER 39 HG SER 39 40.061 -2.743 -7.158
313 H VAL 40 HN VAL 40 43.265 -6.695 -8.999
314 HA VAL 40 HA VAL 40 44.620 -5.639 -6.641
315 HB VAL 40 HB VAL 40 44.619 -8.032 -6.925
316 HG11 VAL 40 HG11 VAL 40 46.116 -7.601 -9.547
317 HG12 VAL 40 HG12 VAL 40 44.401 -8.001 -9.447
318 HG13 VAL 40 HG13 VAL 40 45.611 -9.146 -8.868
319 HG21 VAL 40 HG21 VAL 40 46.732 -6.825 -6.077
320 HG22 VAL 40 HG22 VAL 40 47.420 -7.134 -7.670
321 HG23 VAL 40 HG23 VAL 40 46.961 -8.485 -6.636
322 H SER 41 HN SER 41 44.759 -4.852 -9.955
323 HA SER 41 HA SER 41 47.579 -4.213 -10.105
324 HB2 SER 41 HB2 SER 41 46.931 -2.954 -12.143
325 HB3 SER 41 HB1 SER 41 46.288 -4.593 -12.138
326 HG SER 41 HG SER 41 44.304 -3.772 -11.499
327 H ASP 42 HN ASP 42 44.640 -2.306 -9.412
328 HA ASP 42 HA ASP 42 45.877 0.240 -9.260
329 HB2 ASP 42 HB2 ASP 42 44.027 0.770 -7.594
330 HB3 ASP 42 HB1 ASP 42 43.486 0.134 -9.147
331 H LEU 43 HN LEU 43 45.834 -2.452 -6.903
332 HA LEU 43 HA LEU 43 46.894 -0.903 -4.726
333 HB2 LEU 43 HB2 LEU 43 45.803 -3.262 -4.685
334 HB3 LEU 43 HB1 LEU 43 47.396 -3.855 -5.137
335 HG LEU 43 HG LEU 43 48.371 -2.837 -3.100
336 HD11 LEU 43 HD11 LEU 43 46.406 -2.178 -1.365
337 HD12 LEU 43 HD12 LEU 43 45.597 -1.704 -2.858
338 HD13 LEU 43 HD13 LEU 43 47.146 -0.984 -2.424
339 HD21 LEU 43 HD21 LEU 43 47.299 -5.153 -3.163
340 HD22 LEU 43 HD22 LEU 43 45.904 -4.431 -2.364
341 HD23 LEU 43 HD23 LEU 43 47.474 -4.434 -1.563
342 H LYS 44 HN LYS 44 48.330 -2.711 -7.405
343 HA LYS 44 HA LYS 44 51.059 -2.512 -6.516
344 HB2 LYS 44 HB2 LYS 44 49.691 -3.021 -9.141
345 HB3 LYS 44 HB1 LYS 44 51.401 -2.599 -9.180
346 HG2 LYS 44 HG2 LYS 44 51.991 -4.480 -7.822
347 HG3 LYS 44 HG1 LYS 44 50.305 -4.806 -7.424
348 HD2 LYS 44 HD2 LYS 44 49.815 -5.474 -9.680
349 HD3 LYS 44 HD1 LYS 44 51.376 -4.889 -10.254
350 HE2 LYS 44 HE2 LYS 44 52.525 -6.586 -8.902
351 HE3 LYS 44 HE1 LYS 44 50.973 -7.156 -8.287
352 HZ1 LYS 44 HZ1 LYS 44 51.915 -8.443 -10.199
353 HZ2 LYS 44 HZ2 LYS 44 51.636 -7.079 -11.174
354 HZ3 LYS 44 HZ3 LYS 44 50.334 -7.874 -10.425
355 H LYS 45 HN LYS 45 49.105 -0.449 -8.685
356 HA LYS 45 HA LYS 45 51.154 1.462 -9.215
357 HB2 LYS 45 HB2 LYS 45 48.888 1.134 -10.381
358 HB3 LYS 45 HB1 LYS 45 48.206 2.092 -9.068
359 HG2 LYS 45 HG2 LYS 45 49.686 3.959 -9.606
360 HG3 LYS 45 HG1 LYS 45 50.484 3.002 -10.850
361 HD2 LYS 45 HD2 LYS 45 48.924 4.348 -12.034
362 HD3 LYS 45 HD1 LYS 45 48.176 2.756 -11.939
363 HE2 LYS 45 HE2 LYS 45 46.687 3.443 -10.210
364 HE3 LYS 45 HE1 LYS 45 47.607 4.912 -9.891
365 HZ1 LYS 45 HZ1 LYS 45 46.982 5.774 -12.020
366 HZ2 LYS 45 HZ2 LYS 45 45.576 5.299 -11.194
367 HZ3 LYS 45 HZ3 LYS 45 46.203 4.328 -12.438
368 H TYR 46 HN TYR 46 48.657 1.334 -6.685
369 HA TYR 46 HA TYR 46 49.153 3.890 -5.538
370 HB2 TYR 46 HB2 TYR 46 47.201 2.578 -4.922
371 HB3 TYR 46 HB1 TYR 46 48.225 1.303 -4.273
372 HD1 TYR 46 HD1 TYR 46 47.902 5.034 -3.923
373 HD2 TYR 46 HD2 TYR 46 48.398 1.250 -1.943
374 HE1 TYR 46 HE1 TYR 46 47.908 6.181 -1.725
375 HE2 TYR 46 HE2 TYR 46 48.404 2.398 0.252
376 HH TYR 46 HH TYR 46 47.410 4.685 1.132
377 H ILE 47 HN ILE 47 50.488 0.697 -4.603
378 HA ILE 47 HA ILE 47 52.228 1.570 -2.565
379 HB ILE 47 HB ILE 47 52.701 -0.590 -4.640
380 HG12 ILE 47 HG12 ILE 47 51.769 -1.014 -1.795
381 HG13 ILE 47 HG11 ILE 47 50.607 -0.653 -3.069
382 HG21 ILE 47 HG21 ILE 47 54.162 -1.531 -2.764
383 HG22 ILE 47 HG22 ILE 47 54.059 0.065 -2.020
384 HG23 ILE 47 HG23 ILE 47 54.798 -0.121 -3.611
385 HD11 ILE 47 HD11 ILE 47 51.253 -3.167 -2.520
386 HD12 ILE 47 HD12 ILE 47 52.632 -2.815 -3.564
387 HD13 ILE 47 HD13 ILE 47 50.993 -2.652 -4.185
388 H ALA 48 HN ALA 48 52.795 1.374 -6.071
389 HA ALA 48 HA ALA 48 55.485 2.201 -6.100
390 HB1 ALA 48 HB1 ALA 48 54.304 1.349 -8.087
391 HB2 ALA 48 HB2 ALA 48 55.067 2.903 -8.426
392 HB3 ALA 48 HB3 ALA 48 53.329 2.817 -8.138
393 H GLU 49 HN GLU 49 52.527 4.190 -6.099
394 HA GLU 49 HA GLU 49 53.778 6.708 -6.481
395 HB2 GLU 49 HB2 GLU 49 51.181 5.746 -5.390
396 HB3 GLU 49 HB1 GLU 49 51.659 7.354 -4.852
397 HG2 GLU 49 HG2 GLU 49 50.314 7.511 -6.897
398 HG3 GLU 49 HG1 GLU 49 51.966 8.039 -7.217
399 H LEU 50 HN LEU 50 53.453 4.743 -3.552
400 HA LEU 50 HA LEU 50 54.370 6.869 -1.791
401 HB2 LEU 50 HB2 LEU 50 54.469 3.883 -1.294
402 HB3 LEU 50 HB1 LEU 50 54.531 5.159 -0.083
403 HG LEU 50 HG LEU 50 52.186 4.520 -1.898
404 HD11 LEU 50 HD11 LEU 50 51.112 4.133 0.405
405 HD12 LEU 50 HD12 LEU 50 52.753 4.127 1.047
406 HD13 LEU 50 HD13 LEU 50 52.266 2.917 -0.140
407 HD21 LEU 50 HD21 LEU 50 52.746 6.795 0.009
408 HD22 LEU 50 HD22 LEU 50 51.090 6.255 -0.265
409 HD23 LEU 50 HD23 LEU 50 52.053 6.855 -1.611
410 H GLU 51 HN GLU 51 55.957 4.341 -3.673
411 HA GLU 51 HA GLU 51 58.502 4.479 -2.368
412 HB2 GLU 51 HB2 GLU 51 57.661 3.700 -5.163
413 HB3 GLU 51 HB1 GLU 51 59.355 3.693 -4.677
414 HG2 GLU 51 HG2 GLU 51 58.969 2.061 -2.981
415 HG3 GLU 51 HG1 GLU 51 57.219 2.250 -3.094
416 H VAL 52 HN VAL 52 56.984 6.489 -4.838
417 HA VAL 52 HA VAL 52 59.459 7.977 -5.363
418 HB VAL 52 HB VAL 52 56.617 8.718 -6.124
419 HG11 VAL 52 HG11 VAL 52 59.362 9.528 -7.121
420 HG12 VAL 52 HG12 VAL 52 58.123 10.572 -6.423
421 HG13 VAL 52 HG13 VAL 52 57.879 9.856 -8.016
422 HG21 VAL 52 HG21 VAL 52 57.016 6.518 -7.020
423 HG22 VAL 52 HG22 VAL 52 58.660 6.947 -7.494
424 HG23 VAL 52 HG23 VAL 52 57.285 7.656 -8.340
425 H GLN 53 HN GLN 53 56.588 8.322 -3.327
426 HA GLN 53 HA GLN 53 57.249 11.074 -2.579
427 HB2 GLN 53 HB2 GLN 53 55.245 9.061 -1.527
428 HB3 GLN 53 HB1 GLN 53 55.443 10.669 -0.830
429 HG2 GLN 53 HG2 GLN 53 54.941 11.695 -3.003
430 HG3 GLN 53 HG1 GLN 53 54.784 10.098 -3.734
431 HE21 GLN 53 HE21 GLN 53 53.587 11.162 -0.520
432 HE22 GLN 53 HE22 GLN 53 51.950 10.867 -0.861
433 H THR 54 HN THR 54 57.682 7.834 -1.222
434 HA THR 54 HA THR 54 59.062 8.985 1.155
435 HB THR 54 HB THR 54 58.617 6.041 0.639
436 HG1 THR 54 HG1 THR 54 56.687 7.108 2.137
437 HG21 THR 54 HG21 THR 54 58.719 7.768 3.129
438 HG22 THR 54 HG22 THR 54 59.972 6.657 2.579
439 HG23 THR 54 HG23 THR 54 58.415 6.031 3.120
440 H GLY 55 HN GLY 55 60.050 8.718 -1.785
441 HA2 GLY 55 HA2 GLY 55 62.244 6.836 -1.695
442 HA3 GLY 55 HA1 GLY 55 62.054 8.136 -2.873
443 H MET 56 HN MET 56 63.597 9.659 -2.767
444 HA MET 56 HA MET 56 65.330 10.999 -1.978
445 HB2 MET 56 HB2 MET 56 63.453 10.853 0.372
446 HB3 MET 56 HB1 MET 56 64.968 11.744 0.493
447 HG2 MET 56 HG2 MET 56 63.107 13.220 -0.198
448 HG3 MET 56 HG1 MET 56 64.331 13.100 -1.463
449 HE1 MET 56 HE1 MET 56 60.873 13.678 -1.262
450 HE2 MET 56 HE2 MET 56 60.620 13.373 -2.978
451 HE3 MET 56 HE3 MET 56 62.026 14.295 -2.453
452 H THR 57 HN THR 57 67.382 10.716 -1.140
453 HA THR 57 HA THR 57 67.948 8.064 0.042
454 HB THR 57 HB THR 57 70.354 8.842 -0.253
455 HG1 THR 57 HG1 THR 57 69.615 10.767 -2.022
456 HG21 THR 57 HG21 THR 57 68.625 8.951 -2.738
457 HG22 THR 57 HG22 THR 57 69.093 7.461 -1.921
458 HG23 THR 57 HG23 THR 57 70.324 8.488 -2.654
459 H GLN 58 HN GLN 58 69.894 10.868 0.811
460 HA GLN 58 HA GLN 58 69.503 10.319 3.696
461 HB2 GLN 58 HB2 GLN 58 71.400 12.132 2.173
462 HB3 GLN 58 HB1 GLN 58 71.350 12.034 3.933
463 HG2 GLN 58 HG2 GLN 58 71.748 9.611 2.163
464 HG3 GLN 58 HG1 GLN 58 73.085 10.549 2.831
465 HE21 GLN 58 HE21 GLN 58 73.126 10.736 5.288
466 HE22 GLN 58 HE22 GLN 58 72.498 9.451 6.202
467 H ARG 59 HN ARG 59 70.080 13.077 4.501
468 HA ARG 59 HA ARG 59 67.698 14.577 3.544
469 HB2 ARG 59 HB2 ARG 59 66.841 14.881 5.792
470 HB3 ARG 59 HB1 ARG 59 67.020 13.148 5.498
471 HG2 ARG 59 HG2 ARG 59 69.326 13.340 6.569
472 HG3 ARG 59 HG1 ARG 59 68.849 14.950 7.101
473 HD2 ARG 59 HD2 ARG 59 66.676 13.446 7.904
474 HD3 ARG 59 HD1 ARG 59 67.996 12.304 8.135
475 HE ARG 59 HE ARG 59 67.391 14.413 9.888
476 HH11 ARG 59 HH21 ARG 59 70.117 13.305 8.077
477 HH12 ARG 59 HH22 ARG 59 71.269 14.111 9.082
478 HH21 ARG 59 HH11 ARG 59 68.887 15.448 11.207
479 HH22 ARG 59 HH12 ARG 59 70.577 15.315 10.853
480 H ARG 60 HN ARG 60 67.713 16.738 5.076
481 HA ARG 60 HA ARG 60 70.417 17.654 5.716
482 HB2 ARG 60 HB2 ARG 60 70.116 17.817 3.150
483 HB3 ARG 60 HB1 ARG 60 68.984 19.124 3.497
484 HG2 ARG 60 HG2 ARG 60 70.739 20.329 4.736
485 HG3 ARG 60 HG1 ARG 60 71.873 19.016 4.419
486 HD2 ARG 60 HD2 ARG 60 71.587 19.394 1.977
487 HD3 ARG 60 HD1 ARG 60 70.528 20.759 2.334
488 HE ARG 60 HE ARG 60 72.848 21.341 3.732
489 HH11 ARG 60 HH21 ARG 60 72.021 20.492 0.494
490 HH12 ARG 60 HH22 ARG 60 73.322 21.389 -0.215
491 HH21 ARG 60 HH11 ARG 60 74.550 22.519 2.824
492 HH22 ARG 60 HH12 ARG 60 74.754 22.537 1.105
493 H ARG 61 HN ARG 61 68.140 17.467 7.315
494 HA ARG 61 HA ARG 61 66.709 18.739 8.682
495 HB2 ARG 61 HB2 ARG 61 68.776 20.882 8.107
496 HB3 ARG 61 HB1 ARG 61 67.686 20.819 9.493
497 HG2 ARG 61 HG2 ARG 61 68.736 18.742 10.259
498 HG3 ARG 61 HG1 ARG 61 69.791 18.734 8.846
499 HD2 ARG 61 HD2 ARG 61 70.701 20.950 9.579
500 HD3 ARG 61 HD1 ARG 61 69.739 20.813 11.051
501 HE ARG 61 HE ARG 61 71.189 18.454 10.989
502 HH11 ARG 61 HH21 ARG 61 71.884 21.823 10.777
503 HH12 ARG 61 HH22 ARG 61 73.446 21.684 11.513
504 HH21 ARG 61 HH11 ARG 61 73.225 18.251 11.950
505 HH22 ARG 61 HH12 ARG 61 74.205 19.661 12.176
506 H GLY 62 HN GLY 62 65.551 18.608 6.280
507 HA2 GLY 62 HA2 GLY 62 65.202 21.020 4.817
508 HA3 GLY 62 HA1 GLY 62 64.024 19.708 4.878
Start of MODEL 11
1 H1 MET 1 HT1 MET 1 57.688 9.783 9.861
2 H2 MET 1 HT2 MET 1 56.242 9.354 10.642
3 H3 MET 1 HT3 MET 1 56.261 9.604 8.962
4 HA MET 1 HA MET 1 57.698 7.689 8.661
5 HB2 MET 1 HB2 MET 1 57.374 7.473 11.669
6 HB3 MET 1 HB1 MET 1 58.067 6.213 10.648
7 HG2 MET 1 HG2 MET 1 59.789 7.840 9.869
8 HG3 MET 1 HG1 MET 1 59.130 9.032 10.988
9 HE1 MET 1 HE1 MET 1 60.220 5.260 10.843
10 HE2 MET 1 HE2 MET 1 61.683 5.363 11.821
11 HE3 MET 1 HE3 MET 1 61.544 6.325 10.352
12 H VAL 2 HN VAL 2 54.710 8.620 9.806
13 HA VAL 2 HA VAL 2 53.326 6.196 10.267
14 HB VAL 2 HB VAL 2 52.258 8.639 8.819
15 HG11 VAL 2 HG11 VAL 2 50.122 7.872 9.948
16 HG12 VAL 2 HG12 VAL 2 50.965 6.383 10.375
17 HG13 VAL 2 HG13 VAL 2 50.711 6.798 8.679
18 HG21 VAL 2 HG21 VAL 2 51.538 9.319 11.138
19 HG22 VAL 2 HG22 VAL 2 53.286 9.345 10.899
20 HG23 VAL 2 HG23 VAL 2 52.535 8.011 11.774
21 H ARG 3 HN ARG 3 54.029 7.868 7.197
22 HA ARG 3 HA ARG 3 52.592 6.178 5.456
23 HB2 ARG 3 HB2 ARG 3 55.275 7.523 5.008
24 HB3 ARG 3 HB1 ARG 3 54.265 6.841 3.733
25 HG2 ARG 3 HG2 ARG 3 52.457 8.388 4.289
26 HG3 ARG 3 HG1 ARG 3 53.392 9.032 5.639
27 HD2 ARG 3 HD2 ARG 3 55.115 9.841 4.096
28 HD3 ARG 3 HD1 ARG 3 54.244 9.142 2.731
29 HE ARG 3 HE ARG 3 52.383 10.823 3.906
30 HH11 ARG 3 HH21 ARG 3 55.624 11.090 2.760
31 HH12 ARG 3 HH22 ARG 3 55.466 12.754 2.303
32 HH21 ARG 3 HH11 ARG 3 52.158 12.993 3.315
33 HH22 ARG 3 HH12 ARG 3 53.504 13.831 2.617
34 H GLN 4 HN GLN 4 55.781 5.732 6.937
35 HA GLN 4 HA GLN 4 56.573 3.424 5.470
36 HB2 GLN 4 HB2 GLN 4 58.026 4.757 7.046
37 HB3 GLN 4 HB1 GLN 4 57.175 3.985 8.386
38 HG2 GLN 4 HG2 GLN 4 57.871 1.772 7.582
39 HG3 GLN 4 HG1 GLN 4 58.684 2.515 6.204
40 HE21 GLN 4 HE21 GLN 4 59.349 4.809 8.306
41 HE22 GLN 4 HE22 GLN 4 60.739 4.201 9.069
42 H GLU 5 HN GLU 5 54.696 3.741 8.481
43 HA GLU 5 HA GLU 5 54.372 0.897 8.855
44 HB2 GLU 5 HB2 GLU 5 54.085 2.690 10.631
45 HB3 GLU 5 HB1 GLU 5 52.537 3.077 9.878
46 HG2 GLU 5 HG2 GLU 5 52.058 1.530 11.646
47 HG3 GLU 5 HG1 GLU 5 51.930 0.621 10.139
48 H GLU 6 HN GLU 6 52.196 3.419 7.528
49 HA GLU 6 HA GLU 6 50.035 1.704 6.935
50 HB2 GLU 6 HB2 GLU 6 49.922 4.188 6.812
51 HB3 GLU 6 HB1 GLU 6 50.891 4.148 5.341
52 HG2 GLU 6 HG2 GLU 6 49.194 2.816 4.211
53 HG3 GLU 6 HG1 GLU 6 48.245 2.723 5.694
54 H LEU 7 HN LEU 7 53.161 1.884 5.440
55 HA LEU 7 HA LEU 7 52.299 0.742 2.894
56 HB2 LEU 7 HB2 LEU 7 54.459 2.142 3.474
57 HB3 LEU 7 HB1 LEU 7 55.128 0.580 3.933
58 HG LEU 7 HG LEU 7 53.873 1.178 1.233
59 HD11 LEU 7 HD11 LEU 7 55.980 2.455 1.681
60 HD12 LEU 7 HD12 LEU 7 56.140 1.288 0.368
61 HD13 LEU 7 HD13 LEU 7 56.804 0.921 1.961
62 HD21 LEU 7 HD21 LEU 7 55.278 -0.968 0.712
63 HD22 LEU 7 HD22 LEU 7 53.740 -1.156 1.547
64 HD23 LEU 7 HD23 LEU 7 55.247 -1.219 2.457
65 H ALA 8 HN ALA 8 54.034 -0.486 5.768
66 HA ALA 8 HA ALA 8 54.277 -3.176 4.957
67 HB1 ALA 8 HB1 ALA 8 54.354 -3.719 7.378
68 HB2 ALA 8 HB2 ALA 8 53.774 -2.096 7.749
69 HB3 ALA 8 HB3 ALA 8 55.352 -2.318 6.991
70 H ALA 9 HN ALA 9 51.472 -1.398 5.983
71 HA ALA 9 HA ALA 9 49.846 -3.722 6.621
72 HB1 ALA 9 HB1 ALA 9 49.187 -0.815 6.101
73 HB2 ALA 9 HB2 ALA 9 49.220 -1.650 7.653
74 HB3 ALA 9 HB3 ALA 9 47.958 -2.021 6.479
75 H ALA 10 HN ALA 10 49.808 -1.388 3.884
76 HA ALA 10 HA ALA 10 47.920 -2.840 2.329
77 HB1 ALA 10 HB1 ALA 10 50.075 -0.850 1.665
78 HB2 ALA 10 HB2 ALA 10 48.328 -0.684 1.509
79 HB3 ALA 10 HB3 ALA 10 49.225 -1.676 0.358
80 H ARG 11 HN ARG 11 51.338 -3.243 2.871
81 HA ARG 11 HA ARG 11 51.852 -5.077 0.709
82 HB2 ARG 11 HB2 ARG 11 53.467 -3.782 2.387
83 HB3 ARG 11 HB1 ARG 11 53.294 -5.236 3.364
84 HG2 ARG 11 HG2 ARG 11 55.113 -5.882 2.086
85 HG3 ARG 11 HG1 ARG 11 53.825 -6.430 1.013
86 HD2 ARG 11 HD2 ARG 11 53.937 -4.237 -0.166
87 HD3 ARG 11 HD1 ARG 11 55.305 -3.792 0.853
88 HE ARG 11 HE ARG 11 56.074 -6.210 -0.261
89 HH11 ARG 11 HH21 ARG 11 54.893 -3.188 -1.428
90 HH12 ARG 11 HH22 ARG 11 55.751 -3.282 -2.930
91 HH21 ARG 11 HH11 ARG 11 57.200 -6.349 -2.216
92 HH22 ARG 11 HH12 ARG 11 57.057 -5.071 -3.376
93 H ALA 12 HN ALA 12 51.104 -5.542 4.223
94 HA ALA 12 HA ALA 12 51.065 -8.353 4.229
95 HB1 ALA 12 HB1 ALA 12 50.824 -7.003 6.283
96 HB2 ALA 12 HB2 ALA 12 49.514 -8.177 6.147
97 HB3 ALA 12 HB3 ALA 12 49.226 -6.484 5.746
98 H ALA 13 HN ALA 13 49.025 -6.165 2.693
99 HA ALA 13 HA ALA 13 46.725 -7.931 2.441
100 HB1 ALA 13 HB1 ALA 13 47.235 -5.618 0.581
101 HB2 ALA 13 HB2 ALA 13 46.818 -5.311 2.266
102 HB3 ALA 13 HB3 ALA 13 45.705 -6.208 1.233
103 H LEU 14 HN LEU 14 49.534 -7.055 0.393
104 HA LEU 14 HA LEU 14 48.646 -8.463 -1.901
105 HB2 LEU 14 HB2 LEU 14 51.121 -7.228 -1.111
106 HB3 LEU 14 HB1 LEU 14 51.491 -8.798 -1.796
107 HG LEU 14 HG LEU 14 49.669 -6.803 -3.177
108 HD11 LEU 14 HD11 LEU 14 51.962 -5.863 -2.814
109 HD12 LEU 14 HD12 LEU 14 51.562 -6.110 -4.510
110 HD13 LEU 14 HD13 LEU 14 52.621 -7.250 -3.680
111 HD21 LEU 14 HD21 LEU 14 49.818 -8.222 -5.030
112 HD22 LEU 14 HD22 LEU 14 49.771 -9.377 -3.702
113 HD23 LEU 14 HD23 LEU 14 51.308 -8.978 -4.464
114 H HIS 15 HN HIS 15 50.081 -9.600 1.081
115 HA HIS 15 HA HIS 15 50.525 -12.307 0.082
116 HB2 HIS 15 HB2 HIS 15 51.800 -11.386 2.005
117 HB3 HIS 15 HB1 HIS 15 50.304 -11.293 2.935
118 HD1 HIS 15 HD1 HIS 15 52.528 -13.862 1.233
119 HD2 HIS 15 HD2 HIS 15 49.557 -13.686 4.153
120 HE1 HIS 15 HE1 HIS 15 52.400 -16.172 2.264
121 H ASP 16 HN ASP 16 47.939 -10.561 1.698
122 HA ASP 16 HA ASP 16 46.358 -12.931 2.281
123 HB2 ASP 16 HB2 ASP 16 45.339 -10.101 2.088
124 HB3 ASP 16 HB1 ASP 16 44.702 -11.419 3.068
125 H LEU 17 HN LEU 17 46.703 -10.807 -0.484
126 HA LEU 17 HA LEU 17 44.154 -11.656 -1.667
127 HB2 LEU 17 HB2 LEU 17 46.451 -10.061 -2.842
128 HB3 LEU 17 HB1 LEU 17 44.909 -10.333 -3.636
129 HG LEU 17 HG LEU 17 45.076 -9.101 -0.877
130 HD11 LEU 17 HD11 LEU 17 46.348 -7.559 -2.134
131 HD12 LEU 17 HD12 LEU 17 44.717 -6.901 -2.206
132 HD13 LEU 17 HD13 LEU 17 45.372 -7.790 -3.580
133 HD21 LEU 17 HD21 LEU 17 42.979 -9.275 -3.051
134 HD22 LEU 17 HD22 LEU 17 42.885 -8.061 -1.782
135 HD23 LEU 17 HD23 LEU 17 42.855 -9.770 -1.366
136 H MET 18 HN MET 18 47.488 -12.732 -1.786
137 HA MET 18 HA MET 18 46.946 -14.395 -4.187
138 HB2 MET 18 HB2 MET 18 49.383 -13.573 -2.650
139 HB3 MET 18 HB1 MET 18 49.457 -15.111 -3.506
140 HG2 MET 18 HG2 MET 18 49.180 -14.107 -5.606
141 HG3 MET 18 HG1 MET 18 48.442 -12.656 -4.930
142 HE1 MET 18 HE1 MET 18 51.105 -13.194 -7.053
143 HE2 MET 18 HE2 MET 18 51.810 -11.618 -6.706
144 HE3 MET 18 HE3 MET 18 50.063 -11.777 -6.864
145 H THR 19 HN THR 19 46.520 -14.698 -0.851
146 HA THR 19 HA THR 19 47.166 -17.587 -0.766
147 HB THR 19 HB THR 19 46.058 -17.247 1.614
148 HG1 THR 19 HG1 THR 19 46.613 -14.610 0.730
149 HG21 THR 19 HG21 THR 19 48.673 -15.901 0.873
150 HG22 THR 19 HG22 THR 19 48.468 -17.623 1.186
151 HG23 THR 19 HG23 THR 19 48.212 -16.457 2.482
152 H GLY 20 HN GLY 20 44.997 -16.527 -2.549
153 HA2 GLY 20 HA2 GLY 20 43.010 -17.609 -3.290
154 HA3 GLY 20 HA1 GLY 20 42.961 -18.507 -1.772
155 H LYS 21 HN LYS 21 43.226 -16.146 -0.090
156 HA LYS 21 HA LYS 21 40.433 -15.410 0.056
157 HB2 LYS 21 HB2 LYS 21 41.584 -15.449 2.128
158 HB3 LYS 21 HB1 LYS 21 42.932 -14.506 1.500
159 HG2 LYS 21 HG2 LYS 21 41.751 -12.490 1.605
160 HG3 LYS 21 HG1 LYS 21 40.179 -13.286 1.551
161 HD2 LYS 21 HD2 LYS 21 40.783 -12.334 3.810
162 HD3 LYS 21 HD1 LYS 21 40.408 -14.055 3.826
163 HE2 LYS 21 HE2 LYS 21 43.269 -13.222 3.443
164 HE3 LYS 21 HE1 LYS 21 42.574 -13.143 5.060
165 HZ1 LYS 21 HZ1 LYS 21 43.398 -15.416 3.576
166 HZ2 LYS 21 HZ2 LYS 21 41.765 -15.560 4.022
167 HZ3 LYS 21 HZ3 LYS 21 42.954 -15.304 5.209
168 H ARG 22 HN ARG 22 39.596 -14.086 -1.525
169 HA ARG 22 HA ARG 22 41.341 -12.112 -2.837
170 HB2 ARG 22 HB2 ARG 22 39.328 -11.730 -4.296
171 HB3 ARG 22 HB1 ARG 22 39.937 -13.383 -4.299
172 HG2 ARG 22 HG2 ARG 22 38.183 -14.142 -2.875
173 HG3 ARG 22 HG1 ARG 22 37.707 -12.496 -2.460
174 HD2 ARG 22 HD2 ARG 22 36.977 -12.092 -4.765
175 HD3 ARG 22 HD1 ARG 22 37.510 -13.705 -5.236
176 HE ARG 22 HE ARG 22 35.729 -14.169 -3.159
177 HH11 ARG 22 HH21 ARG 22 35.716 -12.451 -6.149
178 HH12 ARG 22 HH22 ARG 22 34.023 -12.682 -6.427
179 HH21 ARG 22 HH11 ARG 22 33.516 -14.479 -3.505
180 HH22 ARG 22 HH12 ARG 22 32.777 -13.830 -4.929
181 H VAL 23 HN VAL 23 38.544 -12.054 -0.641
182 HA VAL 23 HA VAL 23 38.196 -9.156 -0.935
183 HB VAL 23 HB VAL 23 36.373 -10.767 -0.260
184 HG11 VAL 23 HG11 VAL 23 37.914 -12.020 1.354
185 HG12 VAL 23 HG12 VAL 23 36.305 -11.638 1.972
186 HG13 VAL 23 HG13 VAL 23 37.693 -10.668 2.465
187 HG21 VAL 23 HG21 VAL 23 35.425 -9.234 1.459
188 HG22 VAL 23 HG22 VAL 23 36.144 -8.350 0.111
189 HG23 VAL 23 HG23 VAL 23 37.012 -8.486 1.641
190 H ALA 24 HN ALA 24 39.153 -7.560 0.239
191 HA ALA 24 HA ALA 24 40.506 -8.169 2.797
192 HB1 ALA 24 HB1 ALA 24 42.202 -8.604 0.997
193 HB2 ALA 24 HB2 ALA 24 42.660 -7.301 2.093
194 HB3 ALA 24 HB3 ALA 24 42.028 -6.925 0.491
195 H THR 25 HN THR 25 40.926 -6.258 4.029
196 HA THR 25 HA THR 25 39.548 -3.781 2.995
197 HB THR 25 HB THR 25 39.915 -4.635 5.883
198 HG1 THR 25 HG1 THR 25 37.470 -4.656 4.518
199 HG21 THR 25 HG21 THR 25 38.336 -2.458 4.503
200 HG22 THR 25 HG22 THR 25 39.636 -2.264 5.678
201 HG23 THR 25 HG23 THR 25 38.081 -2.923 6.185
202 H VAL 26 HN VAL 26 40.565 -1.750 3.512
203 HA VAL 26 HA VAL 26 43.268 -1.861 4.727
204 HB VAL 26 HB VAL 26 43.361 -2.122 2.143
205 HG11 VAL 26 HG11 VAL 26 41.622 -0.257 1.842
206 HG12 VAL 26 HG12 VAL 26 43.054 -0.175 0.816
207 HG13 VAL 26 HG13 VAL 26 42.924 0.868 2.228
208 HG21 VAL 26 HG21 VAL 26 44.825 0.156 3.515
209 HG22 VAL 26 HG22 VAL 26 45.337 -0.634 2.023
210 HG23 VAL 26 HG23 VAL 26 45.307 -1.540 3.536
211 H GLN 27 HN GLN 27 43.442 -0.237 6.137
212 HA GLN 27 HA GLN 27 41.442 1.927 6.133
213 HB2 GLN 27 HB2 GLN 27 43.665 1.111 8.017
214 HB3 GLN 27 HB1 GLN 27 42.762 2.611 8.235
215 HG2 GLN 27 HG2 GLN 27 40.671 1.394 8.412
216 HG3 GLN 27 HG1 GLN 27 41.475 -0.124 8.014
217 HE21 GLN 27 HE21 GLN 27 42.685 -1.192 9.688
218 HE22 GLN 27 HE22 GLN 27 42.696 -0.647 11.296
219 H LYS 28 HN LYS 28 41.836 3.691 4.883
220 HA LYS 28 HA LYS 28 44.669 4.509 4.390
221 HB2 LYS 28 HB2 LYS 28 43.115 4.009 2.407
222 HB3 LYS 28 HB1 LYS 28 42.236 5.473 2.861
223 HG2 LYS 28 HG2 LYS 28 44.344 6.771 2.687
224 HG3 LYS 28 HG1 LYS 28 45.183 5.308 2.168
225 HD2 LYS 28 HD2 LYS 28 43.864 5.158 0.168
226 HD3 LYS 28 HD1 LYS 28 42.759 6.412 0.731
227 HE2 LYS 28 HE2 LYS 28 44.554 8.076 0.635
228 HE3 LYS 28 HE1 LYS 28 45.704 6.832 0.145
229 HZ1 LYS 28 HZ1 LYS 28 43.812 6.478 -1.676
230 HZ2 LYS 28 HZ2 LYS 28 45.122 7.538 -1.896
231 HZ3 LYS 28 HZ3 LYS 28 43.614 8.139 -1.395
232 H ASP 29 HN ASP 29 45.238 6.727 4.883
233 HA ASP 29 HA ASP 29 43.969 7.967 7.063
234 HB2 ASP 29 HB2 ASP 29 46.280 8.481 6.196
235 HB3 ASP 29 HB1 ASP 29 45.526 9.402 4.895
236 H GLY 30 HN GLY 30 41.687 7.936 6.576
237 HA2 GLY 30 HA2 GLY 30 40.336 10.170 5.981
238 HA3 GLY 30 HA1 GLY 30 40.737 9.642 4.345
239 H ARG 31 HN ARG 31 40.440 6.901 4.498
240 HA ARG 31 HA ARG 31 38.038 6.087 5.868
241 HB2 ARG 31 HB2 ARG 31 37.012 7.613 4.197
242 HB3 ARG 31 HB1 ARG 31 37.774 6.693 2.907
243 HG2 ARG 31 HG2 ARG 31 35.410 6.024 3.239
244 HG3 ARG 31 HG1 ARG 31 36.518 4.689 3.536
245 HD2 ARG 31 HD2 ARG 31 34.557 5.196 5.242
246 HD3 ARG 31 HD1 ARG 31 36.141 4.710 5.839
247 HE ARG 31 HE ARG 31 36.312 7.464 5.769
248 HH11 ARG 31 HH21 ARG 31 34.104 5.146 7.041
249 HH12 ARG 31 HH22 ARG 31 33.632 6.135 8.382
250 HH21 ARG 31 HH11 ARG 31 35.712 8.770 7.512
251 HH22 ARG 31 HH12 ARG 31 34.542 8.187 8.649
252 H ARG 32 HN ARG 32 37.678 3.910 5.655
253 HA ARG 32 HA ARG 32 39.859 2.347 4.458
254 HB2 ARG 32 HB2 ARG 32 39.182 0.644 5.882
255 HB3 ARG 32 HB1 ARG 32 38.571 2.033 6.764
256 HG2 ARG 32 HG2 ARG 32 36.360 1.701 5.579
257 HG3 ARG 32 HG1 ARG 32 36.989 0.173 4.965
258 HD2 ARG 32 HD2 ARG 32 37.564 -0.092 7.630
259 HD3 ARG 32 HD1 ARG 32 36.084 0.862 7.711
260 HE ARG 32 HE ARG 32 36.177 -1.906 7.221
261 HH11 ARG 32 HH21 ARG 32 34.870 0.919 5.718
262 HH12 ARG 32 HH22 ARG 32 33.706 0.039 4.793
263 HH21 ARG 32 HH11 ARG 32 34.651 -3.050 6.035
264 HH22 ARG 32 HH12 ARG 32 33.575 -2.200 4.977
265 H VAL 33 HN VAL 33 39.555 0.793 2.764
266 HA VAL 33 HA VAL 33 36.873 0.725 1.446
267 HB VAL 33 HB VAL 33 39.453 1.487 0.035
268 HG11 VAL 33 HG11 VAL 33 37.882 1.612 -1.975
269 HG12 VAL 33 HG12 VAL 33 36.715 0.715 -1.008
270 HG13 VAL 33 HG13 VAL 33 38.266 -0.016 -1.415
271 HG21 VAL 33 HG21 VAL 33 38.517 3.462 0.984
272 HG22 VAL 33 HG22 VAL 33 36.867 2.930 0.665
273 HG23 VAL 33 HG23 VAL 33 37.901 3.446 -0.667
274 H GLU 34 HN GLU 34 36.459 -1.148 0.364
275 HA GLU 34 HA GLU 34 38.337 -3.383 0.894
276 HB2 GLU 34 HB2 GLU 34 35.797 -3.250 1.548
277 HB3 GLU 34 HB1 GLU 34 35.515 -3.671 -0.141
278 HG2 GLU 34 HG2 GLU 34 37.269 -5.252 1.760
279 HG3 GLU 34 HG1 GLU 34 35.605 -5.667 1.350
280 H PHE 35 HN PHE 35 39.574 -4.138 -0.756
281 HA PHE 35 HA PHE 35 38.620 -3.759 -3.585
282 HB2 PHE 35 HB2 PHE 35 41.353 -3.690 -2.313
283 HB3 PHE 35 HB1 PHE 35 41.213 -4.215 -3.987
284 HD1 PHE 35 HD1 PHE 35 39.483 -2.616 -5.409
285 HD2 PHE 35 HD2 PHE 35 41.843 -1.434 -2.021
286 HE1 PHE 35 HE1 PHE 35 39.384 -0.255 -6.158
287 HE2 PHE 35 HE2 PHE 35 41.748 0.922 -2.767
288 HZ PHE 35 HZ PHE 35 40.513 1.516 -4.838
289 H THR 36 HN THR 36 38.661 -5.596 -4.928
290 HA THR 36 HA THR 36 39.173 -8.212 -3.543
291 HB THR 36 HB THR 36 37.628 -9.205 -5.142
292 HG1 THR 36 HG1 THR 36 36.566 -7.751 -6.624
293 HG21 THR 36 HG21 THR 36 36.306 -6.647 -4.245
294 HG22 THR 36 HG22 THR 36 36.787 -7.889 -3.088
295 HG23 THR 36 HG23 THR 36 35.614 -8.264 -4.350
296 H ALA 37 HN ALA 37 40.000 -9.956 -5.196
297 HA ALA 37 HA ALA 37 42.460 -9.078 -6.320
298 HB1 ALA 37 HB1 ALA 37 42.381 -11.383 -5.909
299 HB2 ALA 37 HB2 ALA 37 42.228 -11.322 -7.663
300 HB3 ALA 37 HB3 ALA 37 40.796 -11.562 -6.663
301 H THR 38 HN THR 38 39.309 -8.638 -7.492
302 HA THR 38 HA THR 38 39.740 -8.798 -10.314
303 HB THR 38 HB THR 38 37.751 -7.339 -10.501
304 HG1 THR 38 HG1 THR 38 36.907 -6.398 -8.697
305 HG21 THR 38 HG21 THR 38 37.700 -9.860 -9.701
306 HG22 THR 38 HG22 THR 38 36.228 -8.892 -9.664
307 HG23 THR 38 HG23 THR 38 37.146 -9.151 -8.183
308 H SER 39 HN SER 39 40.725 -6.475 -7.941
309 HA SER 39 HA SER 39 41.802 -4.714 -10.127
310 HB2 SER 39 HB2 SER 39 41.229 -2.764 -8.900
311 HB3 SER 39 HB1 SER 39 39.793 -3.778 -8.818
312 HG SER 39 HG SER 39 41.078 -4.583 -6.807
313 H VAL 40 HN VAL 40 43.449 -6.662 -9.250
314 HA VAL 40 HA VAL 40 44.973 -5.764 -6.903
315 HB VAL 40 HB VAL 40 44.806 -8.147 -7.250
316 HG11 VAL 40 HG11 VAL 40 46.222 -7.732 -9.918
317 HG12 VAL 40 HG12 VAL 40 44.490 -8.033 -9.761
318 HG13 VAL 40 HG13 VAL 40 45.650 -9.263 -9.258
319 HG21 VAL 40 HG21 VAL 40 47.135 -8.736 -7.088
320 HG22 VAL 40 HG22 VAL 40 47.007 -7.093 -6.450
321 HG23 VAL 40 HG23 VAL 40 47.617 -7.362 -8.083
322 H SER 41 HN SER 41 44.979 -4.928 -10.231
323 HA SER 41 HA SER 41 47.824 -4.413 -10.482
324 HB2 SER 41 HB2 SER 41 47.107 -3.073 -12.484
325 HB3 SER 41 HB1 SER 41 46.516 -4.732 -12.492
326 HG SER 41 HG SER 41 45.057 -2.680 -12.805
327 H ASP 42 HN ASP 42 44.978 -2.321 -9.921
328 HA ASP 42 HA ASP 42 46.356 0.140 -9.685
329 HB2 ASP 42 HB2 ASP 42 44.400 0.687 -8.044
330 HB3 ASP 42 HB1 ASP 42 44.004 0.289 -9.715
331 H LEU 43 HN LEU 43 46.009 -2.534 -7.321
332 HA LEU 43 HA LEU 43 46.975 -1.025 -5.077
333 HB2 LEU 43 HB2 LEU 43 45.808 -3.343 -5.106
334 HB3 LEU 43 HB1 LEU 43 47.401 -3.994 -5.469
335 HG LEU 43 HG LEU 43 48.294 -3.026 -3.371
336 HD11 LEU 43 HD11 LEU 43 45.558 -1.782 -3.282
337 HD12 LEU 43 HD12 LEU 43 47.108 -1.120 -2.769
338 HD13 LEU 43 HD13 LEU 43 46.271 -2.281 -1.749
339 HD21 LEU 43 HD21 LEU 43 47.139 -5.296 -3.504
340 HD22 LEU 43 HD22 LEU 43 45.722 -4.520 -2.799
341 HD23 LEU 43 HD23 LEU 43 47.233 -4.582 -1.893
342 H LYS 44 HN LYS 44 48.550 -2.892 -7.639
343 HA LYS 44 HA LYS 44 51.210 -2.741 -6.539
344 HB2 LYS 44 HB2 LYS 44 50.024 -3.324 -9.231
345 HB3 LYS 44 HB1 LYS 44 51.739 -2.920 -9.174
346 HG2 LYS 44 HG2 LYS 44 52.230 -4.760 -7.742
347 HG3 LYS 44 HG1 LYS 44 50.526 -5.034 -7.383
348 HD2 LYS 44 HD2 LYS 44 50.088 -5.857 -9.574
349 HD3 LYS 44 HD1 LYS 44 51.624 -5.248 -10.190
350 HE2 LYS 44 HE2 LYS 44 51.466 -7.335 -8.011
351 HE3 LYS 44 HE1 LYS 44 51.534 -7.755 -9.724
352 HZ1 LYS 44 HZ1 LYS 44 53.585 -6.407 -9.868
353 HZ2 LYS 44 HZ2 LYS 44 53.739 -7.758 -8.849
354 HZ3 LYS 44 HZ3 LYS 44 53.543 -6.205 -8.185
355 H LYS 45 HN LYS 45 49.474 -0.702 -8.910
356 HA LYS 45 HA LYS 45 51.599 1.147 -9.346
357 HB2 LYS 45 HB2 LYS 45 49.424 0.867 -10.658
358 HB3 LYS 45 HB1 LYS 45 48.656 1.820 -9.392
359 HG2 LYS 45 HG2 LYS 45 50.143 3.698 -9.818
360 HG3 LYS 45 HG1 LYS 45 51.076 2.745 -10.969
361 HD2 LYS 45 HD2 LYS 45 49.667 4.007 -12.363
362 HD3 LYS 45 HD1 LYS 45 48.819 2.468 -12.242
363 HE2 LYS 45 HE2 LYS 45 47.299 4.416 -11.931
364 HE3 LYS 45 HE1 LYS 45 47.348 3.378 -10.509
365 HZ1 LYS 45 HZ1 LYS 45 48.773 4.875 -9.404
366 HZ2 LYS 45 HZ2 LYS 45 47.539 5.827 -10.081
367 HZ3 LYS 45 HZ3 LYS 45 49.071 5.769 -10.815
368 H TYR 46 HN TYR 46 48.932 1.148 -6.991
369 HA TYR 46 HA TYR 46 49.408 3.695 -5.842
370 HB2 TYR 46 HB2 TYR 46 47.422 2.350 -5.329
371 HB3 TYR 46 HB1 TYR 46 48.428 1.139 -4.542
372 HD1 TYR 46 HD2 TYR 46 47.982 4.875 -4.420
373 HD2 TYR 46 HD1 TYR 46 48.453 1.219 -2.208
374 HE1 TYR 46 HE2 TYR 46 47.809 6.136 -2.294
375 HE2 TYR 46 HE1 TYR 46 48.274 2.480 -0.084
376 HH TYR 46 HH TYR 46 48.652 5.731 0.159
377 H ILE 47 HN ILE 47 50.665 0.505 -4.812
378 HA ILE 47 HA ILE 47 52.337 1.420 -2.721
379 HB ILE 47 HB ILE 47 52.823 -0.855 -4.666
380 HG12 ILE 47 HG12 ILE 47 51.702 -1.123 -1.873
381 HG13 ILE 47 HG11 ILE 47 50.632 -0.747 -3.223
382 HG21 ILE 47 HG21 ILE 47 54.867 -0.379 -3.504
383 HG22 ILE 47 HG22 ILE 47 54.144 -1.773 -2.702
384 HG23 ILE 47 HG23 ILE 47 54.019 -0.172 -1.971
385 HD11 ILE 47 HD11 ILE 47 51.152 -3.272 -2.540
386 HD12 ILE 47 HD12 ILE 47 52.558 -3.016 -3.575
387 HD13 ILE 47 HD13 ILE 47 50.936 -2.805 -4.225
388 H ALA 48 HN ALA 48 53.072 0.957 -6.178
389 HA ALA 48 HA ALA 48 55.775 1.749 -6.114
390 HB1 ALA 48 HB1 ALA 48 55.449 2.345 -8.519
391 HB2 ALA 48 HB2 ALA 48 53.710 2.150 -8.296
392 HB3 ALA 48 HB3 ALA 48 54.785 0.763 -8.109
393 H GLU 49 HN GLU 49 52.838 3.737 -6.331
394 HA GLU 49 HA GLU 49 54.124 6.222 -6.860
395 HB2 GLU 49 HB2 GLU 49 51.532 5.537 -5.460
396 HB3 GLU 49 HB1 GLU 49 52.049 7.202 -5.722
397 HG2 GLU 49 HG2 GLU 49 52.104 6.873 -8.121
398 HG3 GLU 49 HG1 GLU 49 51.786 5.148 -7.933
399 H LEU 50 HN LEU 50 53.792 4.377 -3.893
400 HA LEU 50 HA LEU 50 54.559 6.626 -2.180
401 HB2 LEU 50 HB2 LEU 50 54.649 3.680 -1.486
402 HB3 LEU 50 HB1 LEU 50 54.537 5.042 -0.374
403 HG LEU 50 HG LEU 50 52.425 4.122 -2.343
404 HD11 LEU 50 HD11 LEU 50 51.096 3.830 -0.266
405 HD12 LEU 50 HD12 LEU 50 52.501 4.309 0.684
406 HD13 LEU 50 HD13 LEU 50 52.543 2.823 -0.266
407 HD21 LEU 50 HD21 LEU 50 52.240 6.481 -2.397
408 HD22 LEU 50 HD22 LEU 50 52.685 6.645 -0.699
409 HD23 LEU 50 HD23 LEU 50 51.100 6.011 -1.139
410 H GLU 51 HN GLU 51 56.213 4.007 -3.850
411 HA GLU 51 HA GLU 51 58.693 4.209 -2.409
412 HB2 GLU 51 HB2 GLU 51 57.995 3.198 -5.173
413 HB3 GLU 51 HB1 GLU 51 59.645 3.170 -4.552
414 HG2 GLU 51 HG2 GLU 51 59.067 1.701 -2.773
415 HG3 GLU 51 HG1 GLU 51 57.340 1.971 -3.009
416 H VAL 52 HN VAL 52 57.331 5.997 -5.126
417 HA VAL 52 HA VAL 52 59.864 7.391 -5.660
418 HB VAL 52 HB VAL 52 57.089 8.042 -6.699
419 HG11 VAL 52 HG11 VAL 52 58.488 8.962 -8.610
420 HG12 VAL 52 HG12 VAL 52 59.904 8.733 -7.584
421 HG13 VAL 52 HG13 VAL 52 58.630 9.850 -7.093
422 HG21 VAL 52 HG21 VAL 52 59.214 6.126 -7.701
423 HG22 VAL 52 HG22 VAL 52 57.914 6.733 -8.725
424 HG23 VAL 52 HG23 VAL 52 57.536 5.756 -7.307
425 H GLN 53 HN GLN 53 56.914 7.945 -3.815
426 HA GLN 53 HA GLN 53 57.468 10.786 -3.407
427 HB2 GLN 53 HB2 GLN 53 55.522 8.840 -2.146
428 HB3 GLN 53 HB1 GLN 53 55.653 10.521 -1.629
429 HG2 GLN 53 HG2 GLN 53 55.176 9.713 -4.507
430 HG3 GLN 53 HG1 GLN 53 53.870 10.081 -3.380
431 HE21 GLN 53 HE21 GLN 53 54.835 12.280 -1.986
432 HE22 GLN 53 HE22 GLN 53 55.136 13.567 -3.052
433 H THR 54 HN THR 54 58.018 7.773 -1.630
434 HA THR 54 HA THR 54 59.033 9.187 0.724
435 HB THR 54 HB THR 54 59.503 6.257 0.171
436 HG1 THR 54 HG1 THR 54 57.248 7.129 -0.269
437 HG21 THR 54 HG21 THR 54 60.385 7.335 2.239
438 HG22 THR 54 HG22 THR 54 59.186 6.090 2.586
439 HG23 THR 54 HG23 THR 54 58.738 7.794 2.670
440 H GLY 55 HN GLY 55 60.341 9.681 -1.896
441 HA2 GLY 55 HA2 GLY 55 63.039 8.473 -1.490
442 HA3 GLY 55 HA1 GLY 55 62.500 9.321 -2.939
443 H MET 56 HN MET 56 61.998 10.539 0.339
444 HA MET 56 HA MET 56 63.013 13.127 -0.279
445 HB2 MET 56 HB2 MET 56 62.645 11.692 2.366
446 HB3 MET 56 HB1 MET 56 63.161 13.373 2.258
447 HG2 MET 56 HG2 MET 56 60.793 13.449 2.529
448 HG3 MET 56 HG1 MET 56 61.077 13.771 0.820
449 HE1 MET 56 HE1 MET 56 60.645 10.811 3.369
450 HE2 MET 56 HE2 MET 56 59.074 10.229 2.824
451 HE3 MET 56 HE3 MET 56 59.246 11.894 3.370
452 H THR 57 HN THR 57 64.992 14.128 0.701
453 HA THR 57 HA THR 57 67.208 12.252 1.296
454 HB THR 57 HB THR 57 67.429 14.305 -0.926
455 HG1 THR 57 HG1 THR 57 66.446 11.773 -0.898
456 HG21 THR 57 HG21 THR 57 69.510 12.930 -1.406
457 HG22 THR 57 HG22 THR 57 69.249 12.141 0.149
458 HG23 THR 57 HG23 THR 57 69.561 13.875 0.081
459 H GLN 58 HN GLN 58 65.597 15.185 1.711
460 HA GLN 58 HA GLN 58 67.612 16.076 3.657
461 HB2 GLN 58 HB2 GLN 58 68.329 17.087 1.459
462 HB3 GLN 58 HB1 GLN 58 66.783 17.935 1.410
463 HG2 GLN 58 HG2 GLN 58 67.290 19.087 3.491
464 HG3 GLN 58 HG1 GLN 58 68.777 18.158 3.681
465 HE21 GLN 58 HE21 GLN 58 69.651 18.266 0.919
466 HE22 GLN 58 HE22 GLN 58 70.074 19.873 0.575
467 H ARG 59 HN ARG 59 64.535 16.680 2.000
468 HA ARG 59 HA ARG 59 62.505 17.500 2.845
469 HB2 ARG 59 HB2 ARG 59 63.140 15.581 4.492
470 HB3 ARG 59 HB1 ARG 59 63.560 16.879 5.607
471 HG2 ARG 59 HG2 ARG 59 61.319 16.468 6.143
472 HG3 ARG 59 HG1 ARG 59 61.191 17.825 5.026
473 HD2 ARG 59 HD2 ARG 59 61.124 15.668 3.292
474 HD3 ARG 59 HD1 ARG 59 60.270 15.026 4.692
475 HE ARG 59 HE ARG 59 59.144 16.779 2.807
476 HH11 ARG 59 HH21 ARG 59 59.627 16.685 6.228
477 HH12 ARG 59 HH22 ARG 59 58.352 17.803 6.562
478 HH21 ARG 59 HH11 ARG 59 57.476 18.218 3.240
479 HH22 ARG 59 HH12 ARG 59 57.132 18.664 4.878
480 H ARG 60 HN ARG 60 64.547 19.421 2.400
481 HA ARG 60 HA ARG 60 64.997 21.155 4.627
482 HB2 ARG 60 HB2 ARG 60 66.219 21.258 2.431
483 HB3 ARG 60 HB1 ARG 60 64.767 21.960 1.714
484 HG2 ARG 60 HG2 ARG 60 64.866 23.842 3.273
485 HG3 ARG 60 HG1 ARG 60 66.265 23.128 4.078
486 HD2 ARG 60 HD2 ARG 60 66.181 23.954 1.161
487 HD3 ARG 60 HD1 ARG 60 66.922 24.895 2.456
488 HE ARG 60 HE ARG 60 68.145 22.416 2.657
489 HH11 ARG 60 HH21 ARG 60 67.594 24.741 0.172
490 HH12 ARG 60 HH22 ARG 60 69.046 24.360 -0.691
491 HH21 ARG 60 HH11 ARG 60 70.045 21.905 1.544
492 HH22 ARG 60 HH12 ARG 60 70.433 22.754 0.086
493 H ARG 61 HN ARG 61 62.904 21.228 5.684
494 HA ARG 61 HA ARG 61 61.032 23.204 4.425
495 HB2 ARG 61 HB2 ARG 61 60.215 20.759 6.028
496 HB3 ARG 61 HB1 ARG 61 59.129 21.944 5.308
497 HG2 ARG 61 HG2 ARG 61 61.093 20.298 3.689
498 HG3 ARG 61 HG1 ARG 61 59.429 19.801 3.972
499 HD2 ARG 61 HD2 ARG 61 58.780 22.130 3.034
500 HD3 ARG 61 HD1 ARG 61 60.432 22.185 2.420
501 HE ARG 61 HE ARG 61 59.487 19.728 1.559
502 HH11 ARG 61 HH21 ARG 61 58.458 23.014 1.381
503 HH12 ARG 61 HH22 ARG 61 57.657 22.819 -0.142
504 HH21 ARG 61 HH11 ARG 61 58.447 19.454 -0.429
505 HH22 ARG 61 HH12 ARG 61 57.651 20.804 -1.168
506 H GLY 62 HN GLY 62 61.208 24.973 5.712
507 HA2 GLY 62 HA2 GLY 62 62.153 24.939 8.407
508 HA3 GLY 62 HA1 GLY 62 61.295 26.286 7.655
Start of MODEL 12
1 H1 MET 1 HT1 MET 1 54.554 10.363 8.901
2 H2 MET 1 HT2 MET 1 55.086 9.426 7.586
3 H3 MET 1 HT3 MET 1 56.140 10.535 8.325
4 HA MET 1 HA MET 1 56.804 8.457 9.137
5 HB2 MET 1 HB2 MET 1 56.499 10.254 10.858
6 HB3 MET 1 HB1 MET 1 54.884 9.625 11.176
7 HG2 MET 1 HG2 MET 1 57.289 7.810 11.329
8 HG3 MET 1 HG1 MET 1 56.839 8.826 12.696
9 HE1 MET 1 HE1 MET 1 56.947 5.505 12.292
10 HE2 MET 1 HE2 MET 1 55.697 5.123 13.473
11 HE3 MET 1 HE3 MET 1 56.867 6.393 13.820
12 H VAL 2 HN VAL 2 53.271 8.842 9.448
13 HA VAL 2 HA VAL 2 52.811 6.081 10.129
14 HB VAL 2 HB VAL 2 51.287 8.263 10.290
15 HG11 VAL 2 HG11 VAL 2 49.561 8.406 8.624
16 HG12 VAL 2 HG12 VAL 2 50.170 6.980 7.789
17 HG13 VAL 2 HG13 VAL 2 51.109 8.473 7.785
18 HG21 VAL 2 HG21 VAL 2 50.239 5.465 9.783
19 HG22 VAL 2 HG22 VAL 2 49.293 6.766 10.509
20 HG23 VAL 2 HG23 VAL 2 50.717 6.142 11.340
21 H ARG 3 HN ARG 3 53.837 7.535 7.315
22 HA ARG 3 HA ARG 3 52.472 5.878 5.363
23 HB2 ARG 3 HB2 ARG 3 55.045 7.472 5.214
24 HB3 ARG 3 HB1 ARG 3 54.322 6.646 3.834
25 HG2 ARG 3 HG2 ARG 3 52.357 8.009 3.927
26 HG3 ARG 3 HG1 ARG 3 52.798 8.653 5.509
27 HD2 ARG 3 HD2 ARG 3 54.837 9.676 4.453
28 HD3 ARG 3 HD1 ARG 3 54.225 9.157 2.883
29 HE ARG 3 HE ARG 3 52.117 10.586 3.974
30 HH11 ARG 3 HH21 ARG 3 55.473 11.120 3.395
31 HH12 ARG 3 HH22 ARG 3 55.297 12.826 3.156
32 HH21 ARG 3 HH11 ARG 3 51.867 12.812 3.665
33 HH22 ARG 3 HH12 ARG 3 53.255 13.784 3.309
34 H GLN 4 HN GLN 4 55.500 5.621 7.177
35 HA GLN 4 HA GLN 4 56.622 3.428 5.760
36 HB2 GLN 4 HB2 GLN 4 57.620 4.903 7.676
37 HB3 GLN 4 HB1 GLN 4 56.898 3.709 8.753
38 HG2 GLN 4 HG2 GLN 4 58.104 1.915 7.476
39 HG3 GLN 4 HG1 GLN 4 58.916 3.179 6.551
40 HE21 GLN 4 HE21 GLN 4 61.048 2.930 7.388
41 HE22 GLN 4 HE22 GLN 4 61.437 3.156 9.025
42 H GLU 5 HN GLU 5 54.550 3.442 8.675
43 HA GLU 5 HA GLU 5 54.311 0.588 8.839
44 HB2 GLU 5 HB2 GLU 5 53.754 2.270 10.664
45 HB3 GLU 5 HB1 GLU 5 52.261 2.605 9.787
46 HG2 GLU 5 HG2 GLU 5 51.724 0.941 11.429
47 HG3 GLU 5 HG1 GLU 5 51.785 0.109 9.874
48 H GLU 6 HN GLU 6 52.172 3.071 7.399
49 HA GLU 6 HA GLU 6 50.136 1.334 6.522
50 HB2 GLU 6 HB2 GLU 6 49.762 3.692 6.344
51 HB3 GLU 6 HB1 GLU 6 51.182 3.921 5.329
52 HG2 GLU 6 HG2 GLU 6 50.164 2.791 3.488
53 HG3 GLU 6 HG1 GLU 6 48.856 2.180 4.500
54 H LEU 7 HN LEU 7 53.413 1.585 5.442
55 HA LEU 7 HA LEU 7 52.946 0.474 2.790
56 HB2 LEU 7 HB2 LEU 7 54.981 1.858 3.682
57 HB3 LEU 7 HB1 LEU 7 55.562 0.317 4.297
58 HG LEU 7 HG LEU 7 56.546 0.736 2.116
59 HD11 LEU 7 HD11 LEU 7 55.665 -1.600 2.789
60 HD12 LEU 7 HD12 LEU 7 56.097 -1.331 1.101
61 HD13 LEU 7 HD13 LEU 7 54.404 -1.313 1.588
62 HD21 LEU 7 HD21 LEU 7 55.408 1.417 0.232
63 HD22 LEU 7 HD22 LEU 7 54.377 2.158 1.452
64 HD23 LEU 7 HD23 LEU 7 53.902 0.634 0.701
65 H ALA 8 HN ALA 8 54.280 -0.806 5.850
66 HA ALA 8 HA ALA 8 54.477 -3.511 4.940
67 HB1 ALA 8 HB1 ALA 8 55.621 -2.685 6.973
68 HB2 ALA 8 HB2 ALA 8 54.632 -4.100 7.326
69 HB3 ALA 8 HB3 ALA 8 54.059 -2.493 7.770
70 H ALA 9 HN ALA 9 51.769 -1.626 6.049
71 HA ALA 9 HA ALA 9 50.071 -3.895 6.701
72 HB1 ALA 9 HB1 ALA 9 49.523 -1.831 7.771
73 HB2 ALA 9 HB2 ALA 9 48.243 -2.111 6.590
74 HB3 ALA 9 HB3 ALA 9 49.529 -0.955 6.240
75 H ALA 10 HN ALA 10 50.036 -1.528 3.991
76 HA ALA 10 HA ALA 10 48.069 -2.905 2.467
77 HB1 ALA 10 HB1 ALA 10 50.274 -0.985 1.758
78 HB2 ALA 10 HB2 ALA 10 48.531 -0.741 1.688
79 HB3 ALA 10 HB3 ALA 10 49.329 -1.748 0.480
80 H ARG 11 HN ARG 11 51.501 -3.417 2.892
81 HA ARG 11 HA ARG 11 51.870 -5.232 0.684
82 HB2 ARG 11 HB2 ARG 11 53.596 -4.024 2.329
83 HB3 ARG 11 HB1 ARG 11 53.425 -5.503 3.265
84 HG2 ARG 11 HG2 ARG 11 55.139 -6.203 1.889
85 HG3 ARG 11 HG1 ARG 11 53.802 -6.595 0.809
86 HD2 ARG 11 HD2 ARG 11 54.032 -4.349 -0.231
87 HD3 ARG 11 HD1 ARG 11 55.425 -4.037 0.803
88 HE ARG 11 HE ARG 11 56.065 -6.416 -0.469
89 HH11 ARG 11 HH21 ARG 11 55.039 -3.266 -1.427
90 HH12 ARG 11 HH22 ARG 11 55.882 -3.306 -2.940
91 HH21 ARG 11 HH11 ARG 11 57.172 -6.486 -2.439
92 HH22 ARG 11 HH12 ARG 11 57.090 -5.129 -3.513
93 H ALA 12 HN ALA 12 51.231 -5.722 4.217
94 HA ALA 12 HA ALA 12 51.114 -8.530 4.196
95 HB1 ALA 12 HB1 ALA 12 49.618 -8.331 6.158
96 HB2 ALA 12 HB2 ALA 12 49.374 -6.625 5.784
97 HB3 ALA 12 HB3 ALA 12 50.969 -7.202 6.270
98 H ALA 13 HN ALA 13 49.085 -6.273 2.748
99 HA ALA 13 HA ALA 13 46.727 -7.965 2.545
100 HB1 ALA 13 HB1 ALA 13 47.281 -5.672 0.671
101 HB2 ALA 13 HB2 ALA 13 46.902 -5.352 2.362
102 HB3 ALA 13 HB3 ALA 13 45.744 -6.210 1.347
103 H LEU 14 HN LEU 14 49.490 -7.150 0.418
104 HA LEU 14 HA LEU 14 48.512 -8.545 -1.847
105 HB2 LEU 14 HB2 LEU 14 51.015 -7.326 -1.136
106 HB3 LEU 14 HB1 LEU 14 51.363 -8.899 -1.824
107 HG LEU 14 HG LEU 14 49.512 -6.907 -3.167
108 HD11 LEU 14 HD11 LEU 14 51.378 -6.229 -4.547
109 HD12 LEU 14 HD12 LEU 14 52.452 -7.359 -3.723
110 HD13 LEU 14 HD13 LEU 14 51.809 -5.964 -2.861
111 HD21 LEU 14 HD21 LEU 14 49.649 -8.327 -5.030
112 HD22 LEU 14 HD22 LEU 14 49.571 -9.466 -3.689
113 HD23 LEU 14 HD23 LEU 14 51.121 -9.109 -4.450
114 H HIS 15 HN HIS 15 50.049 -9.722 1.078
115 HA HIS 15 HA HIS 15 50.443 -12.418 0.033
116 HB2 HIS 15 HB2 HIS 15 51.792 -11.506 1.918
117 HB3 HIS 15 HB1 HIS 15 50.333 -11.453 2.908
118 HD1 HIS 15 HD1 HIS 15 51.868 -14.141 0.659
119 HD2 HIS 15 HD2 HIS 15 50.312 -13.697 4.500
120 HE1 HIS 15 HE1 HIS 15 51.976 -16.427 1.745
121 H ASP 16 HN ASP 16 47.915 -10.675 1.719
122 HA ASP 16 HA ASP 16 46.360 -13.033 2.400
123 HB2 ASP 16 HB2 ASP 16 45.390 -10.177 2.166
124 HB3 ASP 16 HB1 ASP 16 44.679 -11.473 3.124
125 H LEU 17 HN LEU 17 46.858 -11.306 -0.510
126 HA LEU 17 HA LEU 17 44.204 -12.081 -1.614
127 HB2 LEU 17 HB2 LEU 17 46.448 -10.365 -2.709
128 HB3 LEU 17 HB1 LEU 17 44.986 -10.744 -3.605
129 HG LEU 17 HG LEU 17 44.951 -9.491 -0.847
130 HD11 LEU 17 HD11 LEU 17 44.623 -8.032 -3.477
131 HD12 LEU 17 HD12 LEU 17 46.143 -8.076 -2.587
132 HD13 LEU 17 HD13 LEU 17 44.720 -7.332 -1.863
133 HD21 LEU 17 HD21 LEU 17 42.892 -10.140 -2.942
134 HD22 LEU 17 HD22 LEU 17 42.645 -8.718 -1.940
135 HD23 LEU 17 HD23 LEU 17 42.799 -10.301 -1.191
136 H MET 18 HN MET 18 47.593 -13.000 -1.835
137 HA MET 18 HA MET 18 47.039 -14.713 -4.192
138 HB2 MET 18 HB2 MET 18 49.504 -13.805 -2.734
139 HB3 MET 18 HB1 MET 18 49.590 -15.307 -3.652
140 HG2 MET 18 HG2 MET 18 49.159 -14.236 -5.696
141 HG3 MET 18 HG1 MET 18 48.434 -12.829 -4.921
142 HE1 MET 18 HE1 MET 18 49.879 -11.891 -6.911
143 HE2 MET 18 HE2 MET 18 51.038 -13.182 -7.218
144 HE3 MET 18 HE3 MET 18 51.616 -11.567 -6.819
145 H THR 19 HN THR 19 46.734 -14.957 -0.853
146 HA THR 19 HA THR 19 47.519 -17.805 -0.707
147 HB THR 19 HB THR 19 46.531 -17.501 1.682
148 HG1 THR 19 HG1 THR 19 45.674 -15.332 0.675
149 HG21 THR 19 HG21 THR 19 48.921 -15.886 0.746
150 HG22 THR 19 HG22 THR 19 48.934 -17.583 1.227
151 HG23 THR 19 HG23 THR 19 48.594 -16.332 2.422
152 H GLY 20 HN GLY 20 44.807 -16.112 -1.751
153 HA2 GLY 20 HA2 GLY 20 43.061 -17.733 -2.682
154 HA3 GLY 20 HA1 GLY 20 42.973 -18.392 -1.052
155 H LYS 21 HN LYS 21 42.922 -16.098 0.509
156 HA LYS 21 HA LYS 21 40.217 -15.319 0.378
157 HB2 LYS 21 HB2 LYS 21 42.469 -13.674 1.567
158 HB3 LYS 21 HB1 LYS 21 40.766 -13.623 2.018
159 HG2 LYS 21 HG2 LYS 21 41.085 -16.191 2.496
160 HG3 LYS 21 HG1 LYS 21 42.797 -15.781 2.548
161 HD2 LYS 21 HD2 LYS 21 41.944 -15.656 4.802
162 HD3 LYS 21 HD1 LYS 21 42.259 -14.014 4.255
163 HE2 LYS 21 HE2 LYS 21 39.502 -15.032 3.735
164 HE3 LYS 21 HE1 LYS 21 39.919 -14.749 5.423
165 HZ1 LYS 21 HZ1 LYS 21 39.213 -12.862 3.531
166 HZ2 LYS 21 HZ2 LYS 21 40.870 -12.625 3.824
167 HZ3 LYS 21 HZ3 LYS 21 39.763 -12.583 5.112
168 H ARG 22 HN ARG 22 39.220 -14.096 -1.127
169 HA ARG 22 HA ARG 22 40.796 -12.464 -2.969
170 HB2 ARG 22 HB2 ARG 22 38.872 -14.075 -3.563
171 HB3 ARG 22 HB1 ARG 22 37.797 -12.812 -2.967
172 HG2 ARG 22 HG2 ARG 22 38.899 -11.218 -4.547
173 HG3 ARG 22 HG1 ARG 22 39.810 -12.568 -5.214
174 HD2 ARG 22 HD2 ARG 22 36.850 -12.040 -5.346
175 HD3 ARG 22 HD1 ARG 22 37.962 -12.434 -6.657
176 HE ARG 22 HE ARG 22 38.024 -14.685 -5.047
177 HH11 ARG 22 HH21 ARG 22 35.596 -12.765 -6.564
178 HH12 ARG 22 HH22 ARG 22 34.501 -14.088 -6.791
179 HH21 ARG 22 HH11 ARG 22 36.608 -16.426 -5.335
180 HH22 ARG 22 HH12 ARG 22 35.076 -16.161 -6.094
181 H VAL 23 HN VAL 23 38.269 -11.985 -0.506
182 HA VAL 23 HA VAL 23 38.104 -9.093 -1.048
183 HB VAL 23 HB VAL 23 36.176 -10.468 -0.216
184 HG11 VAL 23 HG11 VAL 23 36.125 -11.246 2.053
185 HG12 VAL 23 HG12 VAL 23 37.620 -10.401 2.447
186 HG13 VAL 23 HG13 VAL 23 37.657 -11.805 1.380
187 HG21 VAL 23 HG21 VAL 23 36.211 -8.019 0.079
188 HG22 VAL 23 HG22 VAL 23 37.086 -8.208 1.598
189 HG23 VAL 23 HG23 VAL 23 35.430 -8.795 1.457
190 H ALA 24 HN ALA 24 39.125 -7.469 0.061
191 HA ALA 24 HA ALA 24 40.602 -8.058 2.563
192 HB1 ALA 24 HB1 ALA 24 42.313 -8.522 0.929
193 HB2 ALA 24 HB2 ALA 24 42.656 -6.930 1.605
194 HB3 ALA 24 HB3 ALA 24 41.906 -7.069 0.014
195 H THR 25 HN THR 25 41.084 -6.122 3.757
196 HA THR 25 HA THR 25 39.731 -3.629 2.724
197 HB THR 25 HB THR 25 39.858 -4.681 5.567
198 HG1 THR 25 HG1 THR 25 38.147 -5.675 4.888
199 HG21 THR 25 HG21 THR 25 38.809 -2.125 4.356
200 HG22 THR 25 HG22 THR 25 39.945 -2.314 5.693
201 HG23 THR 25 HG23 THR 25 38.244 -2.725 5.915
202 H VAL 26 HN VAL 26 40.725 -1.626 3.353
203 HA VAL 26 HA VAL 26 43.347 -1.764 4.723
204 HB VAL 26 HB VAL 26 43.782 -2.063 2.267
205 HG11 VAL 26 HG11 VAL 26 42.911 0.813 1.967
206 HG12 VAL 26 HG12 VAL 26 41.788 -0.514 1.677
207 HG13 VAL 26 HG13 VAL 26 43.250 -0.369 0.707
208 HG21 VAL 26 HG21 VAL 26 45.546 -0.379 2.175
209 HG22 VAL 26 HG22 VAL 26 45.416 -0.988 3.826
210 HG23 VAL 26 HG23 VAL 26 44.730 0.582 3.409
211 H GLN 27 HN GLN 27 43.477 -0.121 6.110
212 HA GLN 27 HA GLN 27 41.493 2.046 6.007
213 HB2 GLN 27 HB2 GLN 27 43.670 1.267 7.955
214 HB3 GLN 27 HB1 GLN 27 42.776 2.778 8.120
215 HG2 GLN 27 HG2 GLN 27 40.658 1.540 8.211
216 HG3 GLN 27 HG1 GLN 27 41.524 0.018 7.992
217 HE21 GLN 27 HE21 GLN 27 41.039 2.718 10.276
218 HE22 GLN 27 HE22 GLN 27 41.618 1.886 11.637
219 H LYS 28 HN LYS 28 41.912 3.790 4.730
220 HA LYS 28 HA LYS 28 44.754 4.583 4.262
221 HB2 LYS 28 HB2 LYS 28 43.196 4.093 2.277
222 HB3 LYS 28 HB1 LYS 28 42.343 5.576 2.716
223 HG2 LYS 28 HG2 LYS 28 44.618 6.737 2.642
224 HG3 LYS 28 HG1 LYS 28 45.226 5.278 1.861
225 HD2 LYS 28 HD2 LYS 28 42.876 6.912 0.857
226 HD3 LYS 28 HD1 LYS 28 44.516 7.020 0.218
227 HE2 LYS 28 HE2 LYS 28 44.342 4.468 -0.152
228 HE3 LYS 28 HE1 LYS 28 42.607 4.684 0.090
229 HZ1 LYS 28 HZ1 LYS 28 42.619 6.337 -1.687
230 HZ2 LYS 28 HZ2 LYS 28 43.161 4.825 -2.241
231 HZ3 LYS 28 HZ3 LYS 28 44.275 6.072 -1.937
232 H ASP 29 HN ASP 29 45.348 6.793 4.752
233 HA ASP 29 HA ASP 29 44.073 8.058 6.919
234 HB2 ASP 29 HB2 ASP 29 45.741 9.373 4.751
235 HB3 ASP 29 HB1 ASP 29 45.427 10.029 6.358
236 H GLY 30 HN GLY 30 41.793 8.048 6.379
237 HA2 GLY 30 HA2 GLY 30 40.475 10.295 5.784
238 HA3 GLY 30 HA1 GLY 30 40.921 9.802 4.150
239 H ARG 31 HN ARG 31 40.613 7.038 4.293
240 HA ARG 31 HA ARG 31 38.122 6.257 5.525
241 HB2 ARG 31 HB2 ARG 31 37.183 7.766 3.826
242 HB3 ARG 31 HB1 ARG 31 38.057 6.907 2.561
243 HG2 ARG 31 HG2 ARG 31 35.692 6.183 2.686
244 HG3 ARG 31 HG1 ARG 31 36.787 4.854 3.050
245 HD2 ARG 31 HD2 ARG 31 36.251 4.866 5.330
246 HD3 ARG 31 HD1 ARG 31 35.717 6.547 5.299
247 HE ARG 31 HE ARG 31 33.909 5.252 3.652
248 HH11 ARG 31 HH21 ARG 31 35.124 4.832 6.850
249 HH12 ARG 31 HH22 ARG 31 33.659 4.136 7.458
250 HH21 ARG 31 HH11 ARG 31 31.989 4.344 4.426
251 HH22 ARG 31 HH12 ARG 31 31.885 3.860 6.086
252 H ARG 32 HN ARG 32 37.805 4.083 5.369
253 HA ARG 32 HA ARG 32 40.011 2.490 4.274
254 HB2 ARG 32 HB2 ARG 32 39.237 0.801 5.668
255 HB3 ARG 32 HB1 ARG 32 38.567 2.196 6.503
256 HG2 ARG 32 HG2 ARG 32 36.459 1.842 5.077
257 HG3 ARG 32 HG1 ARG 32 37.140 0.269 4.661
258 HD2 ARG 32 HD2 ARG 32 37.314 -0.258 7.093
259 HD3 ARG 32 HD1 ARG 32 36.520 1.276 7.453
260 HE ARG 32 HE ARG 32 34.776 0.031 5.701
261 HH11 ARG 32 HH21 ARG 32 36.365 -0.789 8.649
262 HH12 ARG 32 HH22 ARG 32 35.098 -1.837 9.195
263 HH21 ARG 32 HH11 ARG 32 33.114 -1.333 6.396
264 HH22 ARG 32 HH12 ARG 32 33.258 -2.145 7.919
265 H VAL 33 HN VAL 33 39.787 0.961 2.558
266 HA VAL 33 HA VAL 33 37.190 0.978 1.062
267 HB VAL 33 HB VAL 33 39.925 1.591 -0.114
268 HG11 VAL 33 HG11 VAL 33 37.307 0.823 -1.429
269 HG12 VAL 33 HG12 VAL 33 38.885 0.065 -1.640
270 HG13 VAL 33 HG13 VAL 33 38.588 1.677 -2.291
271 HG21 VAL 33 HG21 VAL 33 38.557 3.561 -1.047
272 HG22 VAL 33 HG22 VAL 33 38.898 3.608 0.680
273 HG23 VAL 33 HG23 VAL 33 37.307 3.107 0.110
274 H GLU 34 HN GLU 34 36.699 -0.935 0.132
275 HA GLU 34 HA GLU 34 38.594 -3.203 0.595
276 HB2 GLU 34 HB2 GLU 34 36.233 -2.979 1.744
277 HB3 GLU 34 HB1 GLU 34 35.617 -3.511 0.180
278 HG2 GLU 34 HG2 GLU 34 37.361 -5.414 0.375
279 HG3 GLU 34 HG1 GLU 34 37.450 -4.967 2.078
280 H PHE 35 HN PHE 35 39.405 -4.167 -1.214
281 HA PHE 35 HA PHE 35 37.798 -4.046 -3.743
282 HB2 PHE 35 HB2 PHE 35 40.295 -4.129 -4.786
283 HB3 PHE 35 HB1 PHE 35 39.458 -2.621 -4.463
284 HD1 PHE 35 HD2 PHE 35 40.893 -4.801 -1.786
285 HD2 PHE 35 HD1 PHE 35 41.393 -1.270 -4.167
286 HE1 PHE 35 HE2 PHE 35 42.756 -4.109 -0.345
287 HE2 PHE 35 HE1 PHE 35 43.272 -0.569 -2.715
288 HZ PHE 35 HZ PHE 35 43.958 -1.990 -0.803
289 H THR 36 HN THR 36 37.911 -5.916 -5.079
290 HA THR 36 HA THR 36 38.849 -8.357 -3.642
291 HB THR 36 HB THR 36 37.471 -9.569 -5.315
292 HG1 THR 36 HG1 THR 36 36.498 -7.122 -6.245
293 HG21 THR 36 HG21 THR 36 35.779 -7.288 -4.326
294 HG22 THR 36 HG22 THR 36 36.510 -8.415 -3.183
295 HG23 THR 36 HG23 THR 36 35.388 -9.005 -4.409
296 H ALA 37 HN ALA 37 40.055 -10.037 -5.059
297 HA ALA 37 HA ALA 37 42.374 -8.977 -6.208
298 HB1 ALA 37 HB1 ALA 37 42.605 -11.143 -7.432
299 HB2 ALA 37 HB2 ALA 37 40.953 -11.544 -6.969
300 HB3 ALA 37 HB3 ALA 37 42.197 -11.359 -5.732
301 H THR 38 HN THR 38 39.243 -8.758 -7.489
302 HA THR 38 HA THR 38 39.730 -8.854 -10.290
303 HB THR 38 HB THR 38 37.716 -7.392 -10.479
304 HG1 THR 38 HG1 THR 38 36.806 -7.151 -8.155
305 HG21 THR 38 HG21 THR 38 36.205 -9.016 -9.736
306 HG22 THR 38 HG22 THR 38 37.144 -9.373 -8.287
307 HG23 THR 38 HG23 THR 38 37.698 -9.947 -9.862
308 H SER 39 HN SER 39 40.613 -6.508 -7.897
309 HA SER 39 HA SER 39 41.693 -4.724 -10.065
310 HB2 SER 39 HB2 SER 39 40.817 -3.592 -7.414
311 HB3 SER 39 HB1 SER 39 40.955 -2.794 -8.978
312 HG SER 39 HG SER 39 38.773 -3.507 -8.049
313 H VAL 40 HN VAL 40 43.355 -6.631 -9.176
314 HA VAL 40 HA VAL 40 44.832 -5.725 -6.801
315 HB VAL 40 HB VAL 40 44.690 -8.112 -7.182
316 HG11 VAL 40 HG11 VAL 40 44.448 -7.969 -9.696
317 HG12 VAL 40 HG12 VAL 40 45.614 -9.187 -9.178
318 HG13 VAL 40 HG13 VAL 40 46.179 -7.640 -9.800
319 HG21 VAL 40 HG21 VAL 40 46.854 -7.025 -6.307
320 HG22 VAL 40 HG22 VAL 40 47.516 -7.294 -7.920
321 HG23 VAL 40 HG23 VAL 40 47.016 -8.668 -6.937
322 H SER 41 HN SER 41 44.858 -4.850 -10.111
323 HA SER 41 HA SER 41 47.697 -4.317 -10.354
324 HB2 SER 41 HB2 SER 41 46.976 -2.952 -12.333
325 HB3 SER 41 HB1 SER 41 46.381 -4.609 -12.363
326 HG SER 41 HG SER 41 44.940 -2.506 -12.606
327 H ASP 42 HN ASP 42 44.845 -2.258 -9.711
328 HA ASP 42 HA ASP 42 46.199 0.215 -9.472
329 HB2 ASP 42 HB2 ASP 42 44.287 0.732 -7.787
330 HB3 ASP 42 HB1 ASP 42 43.836 0.312 -9.440
331 H LEU 43 HN LEU 43 45.943 -2.493 -7.139
332 HA LEU 43 HA LEU 43 46.963 -0.996 -4.906
333 HB2 LEU 43 HB2 LEU 43 45.789 -3.309 -4.920
334 HB3 LEU 43 HB1 LEU 43 47.372 -3.962 -5.323
335 HG LEU 43 HG LEU 43 48.314 -2.980 -3.245
336 HD11 LEU 43 HD11 LEU 43 46.314 -2.285 -1.569
337 HD12 LEU 43 HD12 LEU 43 45.555 -1.790 -3.081
338 HD13 LEU 43 HD13 LEU 43 47.105 -1.100 -2.603
339 HD21 LEU 43 HD21 LEU 43 47.319 -4.568 -1.755
340 HD22 LEU 43 HD22 LEU 43 47.196 -5.270 -3.369
341 HD23 LEU 43 HD23 LEU 43 45.784 -4.525 -2.621
342 H LYS 44 HN LYS 44 48.471 -2.876 -7.504
343 HA LYS 44 HA LYS 44 51.154 -2.750 -6.471
344 HB2 LYS 44 HB2 LYS 44 49.893 -3.303 -9.134
345 HB3 LYS 44 HB1 LYS 44 51.608 -2.898 -9.132
346 HG2 LYS 44 HG2 LYS 44 52.148 -4.748 -7.728
347 HG3 LYS 44 HG1 LYS 44 50.457 -5.027 -7.319
348 HD2 LYS 44 HD2 LYS 44 49.953 -5.828 -9.507
349 HD3 LYS 44 HD1 LYS 44 51.475 -5.219 -10.157
350 HE2 LYS 44 HE2 LYS 44 51.338 -7.340 -8.006
351 HE3 LYS 44 HE1 LYS 44 51.416 -7.720 -9.726
352 HZ1 LYS 44 HZ1 LYS 44 53.503 -6.957 -7.977
353 HZ2 LYS 44 HZ2 LYS 44 53.385 -5.841 -9.252
354 HZ3 LYS 44 HZ3 LYS 44 53.600 -7.492 -9.583
355 H LYS 45 HN LYS 45 49.382 -0.646 -8.763
356 HA LYS 45 HA LYS 45 51.553 1.163 -9.202
357 HB2 LYS 45 HB2 LYS 45 49.531 0.972 -10.633
358 HB3 LYS 45 HB1 LYS 45 48.571 1.688 -9.345
359 HG2 LYS 45 HG2 LYS 45 51.000 3.244 -10.126
360 HG3 LYS 45 HG1 LYS 45 49.747 3.148 -11.359
361 HD2 LYS 45 HD2 LYS 45 48.979 3.854 -8.531
362 HD3 LYS 45 HD1 LYS 45 49.675 5.090 -9.577
363 HE2 LYS 45 HE2 LYS 45 47.241 3.409 -10.249
364 HE3 LYS 45 HE1 LYS 45 47.196 5.079 -9.688
365 HZ1 LYS 45 HZ1 LYS 45 47.648 5.804 -11.719
366 HZ2 LYS 45 HZ2 LYS 45 47.440 4.217 -12.287
367 HZ3 LYS 45 HZ3 LYS 45 48.989 4.777 -11.870
368 H TYR 46 HN TYR 46 48.901 1.156 -6.837
369 HA TYR 46 HA TYR 46 49.352 3.718 -5.709
370 HB2 TYR 46 HB2 TYR 46 47.390 2.371 -5.157
371 HB3 TYR 46 HB1 TYR 46 48.412 1.154 -4.403
372 HD1 TYR 46 HD1 TYR 46 47.986 4.889 -4.226
373 HD2 TYR 46 HD2 TYR 46 48.454 1.201 -2.069
374 HE1 TYR 46 HE1 TYR 46 47.842 6.123 -2.082
375 HE2 TYR 46 HE2 TYR 46 48.309 2.434 0.074
376 HH TYR 46 HH TYR 46 48.714 5.674 0.359
377 H ILE 47 HN ILE 47 50.663 0.553 -4.671
378 HA ILE 47 HA ILE 47 52.346 1.503 -2.605
379 HB ILE 47 HB ILE 47 52.887 -0.771 -4.537
380 HG12 ILE 47 HG12 ILE 47 51.684 -1.071 -1.781
381 HG13 ILE 47 HG11 ILE 47 50.647 -0.688 -3.153
382 HG21 ILE 47 HG21 ILE 47 54.000 -0.041 -1.821
383 HG22 ILE 47 HG22 ILE 47 54.886 -0.305 -3.323
384 HG23 ILE 47 HG23 ILE 47 54.133 -1.667 -2.491
385 HD11 ILE 47 HD11 ILE 47 51.203 -3.222 -2.468
386 HD12 ILE 47 HD12 ILE 47 52.592 -2.931 -3.518
387 HD13 ILE 47 HD13 ILE 47 50.958 -2.741 -4.145
388 H ALA 48 HN ALA 48 52.983 1.133 -6.084
389 HA ALA 48 HA ALA 48 55.702 1.910 -6.054
390 HB1 ALA 48 HB1 ALA 48 55.354 2.497 -8.444
391 HB2 ALA 48 HB2 ALA 48 53.613 2.351 -8.205
392 HB3 ALA 48 HB3 ALA 48 54.648 0.934 -8.036
393 H GLU 49 HN GLU 49 52.752 3.883 -6.310
394 HA GLU 49 HA GLU 49 53.994 6.382 -6.800
395 HB2 GLU 49 HB2 GLU 49 51.425 5.643 -5.387
396 HB3 GLU 49 HB1 GLU 49 51.910 7.321 -5.637
397 HG2 GLU 49 HG2 GLU 49 51.999 6.974 -8.053
398 HG3 GLU 49 HG1 GLU 49 51.621 5.263 -7.846
399 H LEU 50 HN LEU 50 53.713 4.533 -3.823
400 HA LEU 50 HA LEU 50 54.417 6.795 -2.116
401 HB2 LEU 50 HB2 LEU 50 54.639 3.848 -1.457
402 HB3 LEU 50 HB1 LEU 50 54.548 5.188 -0.319
403 HG LEU 50 HG LEU 50 52.369 4.315 -2.240
404 HD11 LEU 50 HD11 LEU 50 52.334 4.369 0.785
405 HD12 LEU 50 HD12 LEU 50 52.831 2.944 -0.128
406 HD13 LEU 50 HD13 LEU 50 51.193 3.574 -0.299
407 HD21 LEU 50 HD21 LEU 50 52.667 6.707 -0.417
408 HD22 LEU 50 HD22 LEU 50 51.069 6.060 -0.785
409 HD23 LEU 50 HD23 LEU 50 52.097 6.653 -2.086
410 H GLU 51 HN GLU 51 56.211 4.212 -3.754
411 HA GLU 51 HA GLU 51 58.673 4.603 -2.350
412 HB2 GLU 51 HB2 GLU 51 57.748 2.965 -4.467
413 HB3 GLU 51 HB1 GLU 51 59.086 3.869 -5.162
414 HG2 GLU 51 HG2 GLU 51 59.199 2.285 -2.577
415 HG3 GLU 51 HG1 GLU 51 59.839 1.745 -4.129
416 H VAL 52 HN VAL 52 57.159 6.301 -5.029
417 HA VAL 52 HA VAL 52 59.552 7.874 -5.632
418 HB VAL 52 HB VAL 52 56.679 8.428 -6.434
419 HG11 VAL 52 HG11 VAL 52 58.075 10.341 -6.845
420 HG12 VAL 52 HG12 VAL 52 57.895 9.515 -8.392
421 HG13 VAL 52 HG13 VAL 52 59.382 9.331 -7.463
422 HG21 VAL 52 HG21 VAL 52 57.167 6.219 -7.220
423 HG22 VAL 52 HG22 VAL 52 58.813 6.668 -7.668
424 HG23 VAL 52 HG23 VAL 52 57.448 7.287 -8.596
425 H GLN 53 HN GLN 53 56.735 8.158 -3.553
426 HA GLN 53 HA GLN 53 57.142 10.992 -3.016
427 HB2 GLN 53 HB2 GLN 53 54.904 10.095 -2.808
428 HB3 GLN 53 HB1 GLN 53 55.457 8.854 -1.682
429 HG2 GLN 53 HG2 GLN 53 55.905 10.450 0.017
430 HG3 GLN 53 HG1 GLN 53 55.775 11.799 -1.110
431 HE21 GLN 53 HE21 GLN 53 53.982 12.867 -0.091
432 HE22 GLN 53 HE22 GLN 53 52.439 12.167 0.017
433 H THR 54 HN THR 54 58.159 7.931 -1.606
434 HA THR 54 HA THR 54 59.226 9.220 0.814
435 HB THR 54 HB THR 54 60.312 6.795 0.988
436 HG1 THR 54 HG1 THR 54 59.556 6.497 -1.297
437 HG21 THR 54 HG21 THR 54 58.463 7.679 2.406
438 HG22 THR 54 HG22 THR 54 58.265 5.969 2.026
439 HG23 THR 54 HG23 THR 54 57.308 7.180 1.170
440 H GLY 55 HN GLY 55 60.173 9.945 -1.979
441 HA2 GLY 55 HA2 GLY 55 62.862 10.486 -1.421
442 HA3 GLY 55 HA1 GLY 55 62.843 8.962 -2.306
443 H MET 56 HN MET 56 61.088 12.077 -2.575
444 HA MET 56 HA MET 56 61.057 11.865 -5.485
445 HB2 MET 56 HB2 MET 56 59.245 12.974 -4.130
446 HB3 MET 56 HB1 MET 56 60.384 14.273 -3.773
447 HG2 MET 56 HG2 MET 56 60.610 14.793 -6.137
448 HG3 MET 56 HG1 MET 56 59.607 13.410 -6.573
449 HE1 MET 56 HE1 MET 56 57.153 13.115 -5.308
450 HE2 MET 56 HE2 MET 56 57.297 13.497 -7.022
451 HE3 MET 56 HE3 MET 56 56.095 14.328 -6.039
452 H THR 57 HN THR 57 62.840 13.780 -3.079
453 HA THR 57 HA THR 57 64.864 14.408 -5.186
454 HB THR 57 HB THR 57 64.981 16.723 -4.500
455 HG1 THR 57 HG1 THR 57 63.229 17.333 -2.918
456 HG21 THR 57 HG21 THR 57 62.046 16.024 -4.743
457 HG22 THR 57 HG22 THR 57 63.162 16.024 -6.108
458 HG23 THR 57 HG23 THR 57 62.832 17.522 -5.239
459 H GLN 58 HN GLN 58 64.109 14.617 -1.693
460 HA GLN 58 HA GLN 58 66.449 13.119 -0.959
461 HB2 GLN 58 HB2 GLN 58 67.683 14.974 0.163
462 HB3 GLN 58 HB1 GLN 58 67.640 15.154 -1.590
463 HG2 GLN 58 HG2 GLN 58 65.767 16.734 -1.401
464 HG3 GLN 58 HG1 GLN 58 65.767 16.540 0.352
465 HE21 GLN 58 HE21 GLN 58 67.796 17.698 -2.368
466 HE22 GLN 58 HE22 GLN 58 68.737 18.748 -1.424
467 H ARG 59 HN ARG 59 66.875 14.041 1.612
468 HA ARG 59 HA ARG 59 64.421 14.681 2.992
469 HB2 ARG 59 HB2 ARG 59 63.955 12.528 4.007
470 HB3 ARG 59 HB1 ARG 59 63.970 12.317 2.255
471 HG2 ARG 59 HG2 ARG 59 66.424 11.655 2.487
472 HG3 ARG 59 HG1 ARG 59 66.143 11.576 4.226
473 HD2 ARG 59 HD2 ARG 59 64.337 9.933 3.862
474 HD3 ARG 59 HD1 ARG 59 64.622 10.007 2.123
475 HE ARG 59 HE ARG 59 67.099 9.344 3.162
476 HH11 ARG 59 HH21 ARG 59 63.878 8.147 3.433
477 HH12 ARG 59 HH22 ARG 59 64.367 6.503 3.675
478 HH21 ARG 59 HH11 ARG 59 67.757 7.205 3.478
479 HH22 ARG 59 HH12 ARG 59 66.563 5.970 3.701
480 H ARG 60 HN ARG 60 64.775 14.129 5.467
481 HA ARG 60 HA ARG 60 67.500 13.815 6.375
482 HB2 ARG 60 HB2 ARG 60 67.424 16.195 5.388
483 HB3 ARG 60 HB1 ARG 60 66.364 16.594 6.736
484 HG2 ARG 60 HG2 ARG 60 68.431 17.138 7.661
485 HG3 ARG 60 HG1 ARG 60 68.283 15.462 8.185
486 HD2 ARG 60 HD2 ARG 60 69.628 14.736 6.237
487 HD3 ARG 60 HD1 ARG 60 69.767 16.413 5.711
488 HE ARG 60 HE ARG 60 70.738 16.447 8.308
489 HH11 ARG 60 HH21 ARG 60 71.344 14.654 5.426
490 HH12 ARG 60 HH22 ARG 60 73.016 14.386 5.786
491 HH21 ARG 60 HH11 ARG 60 72.919 16.107 8.795
492 HH22 ARG 60 HH12 ARG 60 73.908 15.208 7.693
493 H ARG 61 HN ARG 61 64.387 15.368 7.196
494 HA ARG 61 HA ARG 61 64.559 14.954 10.009
495 HB2 ARG 61 HB2 ARG 61 62.026 14.932 8.342
496 HB3 ARG 61 HB1 ARG 61 62.164 15.338 10.050
497 HG2 ARG 61 HG2 ARG 61 63.556 16.881 7.840
498 HG3 ARG 61 HG1 ARG 61 61.996 17.340 8.518
499 HD2 ARG 61 HD2 ARG 61 63.183 17.279 10.814
500 HD3 ARG 61 HD1 ARG 61 64.685 17.276 9.890
501 HE ARG 61 HE ARG 61 63.271 19.396 8.818
502 HH11 ARG 61 HH21 ARG 61 64.203 18.362 11.973
503 HH12 ARG 61 HH22 ARG 61 64.330 19.969 12.607
504 HH21 ARG 61 HH11 ARG 61 63.434 21.500 9.628
505 HH22 ARG 61 HH12 ARG 61 63.895 21.746 11.279
506 H GLY 62 HN GLY 62 64.687 13.036 11.055
507 HA2 GLY 62 HA2 GLY 62 64.272 10.506 9.792
508 HA3 GLY 62 HA1 GLY 62 64.409 10.754 11.533
Start of MODEL 13
1 H1 MET 1 HT1 MET 1 59.687 9.015 11.334
2 H2 MET 1 HT2 MET 1 58.586 10.177 10.763
3 H3 MET 1 HT3 MET 1 60.170 10.130 10.149
4 HA MET 1 HA MET 1 58.783 9.156 8.514
5 HB2 MET 1 HB2 MET 1 60.196 7.031 10.154
6 HB3 MET 1 HB1 MET 1 59.667 6.832 8.484
7 HG2 MET 1 HG2 MET 1 61.532 9.048 9.361
8 HG3 MET 1 HG1 MET 1 62.108 7.488 8.775
9 HE1 MET 1 HE1 MET 1 60.986 6.409 6.576
10 HE2 MET 1 HE2 MET 1 62.630 7.029 6.442
11 HE3 MET 1 HE3 MET 1 61.475 7.328 5.146
12 H VAL 2 HN VAL 2 56.853 8.144 8.036
13 HA VAL 2 HA VAL 2 55.525 6.471 10.095
14 HB VAL 2 HB VAL 2 54.168 8.890 8.865
15 HG11 VAL 2 HG11 VAL 2 52.471 8.313 10.678
16 HG12 VAL 2 HG12 VAL 2 53.333 6.786 10.875
17 HG13 VAL 2 HG13 VAL 2 52.564 7.174 9.336
18 HG21 VAL 2 HG21 VAL 2 55.357 8.421 11.614
19 HG22 VAL 2 HG22 VAL 2 54.211 9.715 11.267
20 HG23 VAL 2 HG23 VAL 2 55.781 9.692 10.467
21 H ARG 3 HN ARG 3 55.316 7.943 6.851
22 HA ARG 3 HA ARG 3 53.349 6.317 5.704
23 HB2 ARG 3 HB2 ARG 3 55.937 7.297 4.458
24 HB3 ARG 3 HB1 ARG 3 54.573 6.642 3.548
25 HG2 ARG 3 HG2 ARG 3 53.115 8.418 4.464
26 HG3 ARG 3 HG1 ARG 3 54.490 9.083 5.347
27 HD2 ARG 3 HD2 ARG 3 55.663 9.558 3.273
28 HD3 ARG 3 HD1 ARG 3 54.407 8.749 2.335
29 HE ARG 3 HE ARG 3 53.033 10.722 3.711
30 HH11 ARG 3 HH21 ARG 3 55.809 10.565 1.672
31 HH12 ARG 3 HH22 ARG 3 55.587 12.156 1.023
32 HH21 ARG 3 HH11 ARG 3 52.728 12.800 2.876
33 HH22 ARG 3 HH12 ARG 3 53.843 13.421 1.706
34 H GLN 4 HN GLN 4 56.740 5.558 6.359
35 HA GLN 4 HA GLN 4 57.010 3.163 4.931
36 HB2 GLN 4 HB2 GLN 4 58.827 2.646 6.340
37 HB3 GLN 4 HB1 GLN 4 58.733 4.402 6.411
38 HG2 GLN 4 HG2 GLN 4 58.924 3.860 8.678
39 HG3 GLN 4 HG1 GLN 4 57.176 3.966 8.495
40 HE21 GLN 4 HE21 GLN 4 57.942 2.408 10.589
41 HE22 GLN 4 HE22 GLN 4 57.797 0.757 10.228
42 H GLU 5 HN GLU 5 55.291 3.763 7.947
43 HA GLU 5 HA GLU 5 54.826 0.960 8.538
44 HB2 GLU 5 HB2 GLU 5 54.762 2.930 10.182
45 HB3 GLU 5 HB1 GLU 5 53.170 3.293 9.518
46 HG2 GLU 5 HG2 GLU 5 53.910 0.575 10.635
47 HG3 GLU 5 HG1 GLU 5 53.158 1.842 11.600
48 H GLU 6 HN GLU 6 52.752 3.561 7.190
49 HA GLU 6 HA GLU 6 50.463 1.949 6.794
50 HB2 GLU 6 HB2 GLU 6 50.328 4.369 6.590
51 HB3 GLU 6 HB1 GLU 6 51.415 4.359 5.202
52 HG2 GLU 6 HG2 GLU 6 49.814 3.156 3.864
53 HG3 GLU 6 HG1 GLU 6 48.775 2.886 5.262
54 H LEU 7 HN LEU 7 53.499 1.921 5.122
55 HA LEU 7 HA LEU 7 52.449 0.737 2.671
56 HB2 LEU 7 HB2 LEU 7 54.722 2.036 3.141
57 HB3 LEU 7 HB1 LEU 7 55.318 0.429 3.539
58 HG LEU 7 HG LEU 7 53.939 1.150 0.931
59 HD11 LEU 7 HD11 LEU 7 56.077 2.305 1.078
60 HD12 LEU 7 HD12 LEU 7 56.242 0.939 -0.026
61 HD13 LEU 7 HD13 LEU 7 56.875 0.827 1.615
62 HD21 LEU 7 HD21 LEU 7 55.264 -1.341 2.020
63 HD22 LEU 7 HD22 LEU 7 55.117 -1.070 0.285
64 HD23 LEU 7 HD23 LEU 7 53.672 -1.179 1.283
65 H ALA 8 HN ALA 8 54.240 -0.468 5.514
66 HA ALA 8 HA ALA 8 54.355 -3.188 4.796
67 HB1 ALA 8 HB1 ALA 8 54.466 -3.650 7.236
68 HB2 ALA 8 HB2 ALA 8 53.967 -1.990 7.558
69 HB3 ALA 8 HB3 ALA 8 55.513 -2.311 6.771
70 H ALA 9 HN ALA 9 51.630 -1.282 5.860
71 HA ALA 9 HA ALA 9 49.964 -3.552 6.595
72 HB1 ALA 9 HB1 ALA 9 49.394 -1.479 7.621
73 HB2 ALA 9 HB2 ALA 9 48.116 -1.781 6.445
74 HB3 ALA 9 HB3 ALA 9 49.398 -0.628 6.076
75 H ALA 10 HN ALA 10 49.839 -1.251 3.824
76 HA ALA 10 HA ALA 10 47.879 -2.709 2.370
77 HB1 ALA 10 HB1 ALA 10 48.274 -0.578 1.487
78 HB2 ALA 10 HB2 ALA 10 49.127 -1.597 0.327
79 HB3 ALA 10 HB3 ALA 10 50.024 -0.753 1.590
80 H ARG 11 HN ARG 11 51.312 -3.139 2.781
81 HA ARG 11 HA ARG 11 51.731 -5.011 0.637
82 HB2 ARG 11 HB2 ARG 11 53.399 -3.720 2.294
83 HB3 ARG 11 HB1 ARG 11 53.265 -5.204 3.230
84 HG2 ARG 11 HG2 ARG 11 55.028 -5.814 1.873
85 HG3 ARG 11 HG1 ARG 11 53.712 -6.319 0.820
86 HD2 ARG 11 HD2 ARG 11 53.887 -3.770 0.011
87 HD3 ARG 11 HD1 ARG 11 55.543 -3.959 0.576
88 HE ARG 11 HE ARG 11 54.531 -4.934 -1.886
89 HH11 ARG 11 HH21 ARG 11 56.328 -6.079 0.832
90 HH12 ARG 11 HH22 ARG 11 56.945 -7.461 -0.001
91 HH21 ARG 11 HH11 ARG 11 55.350 -6.714 -2.980
92 HH22 ARG 11 HH12 ARG 11 56.403 -7.816 -2.157
93 H ALA 12 HN ALA 12 51.064 -5.425 4.173
94 HA ALA 12 HA ALA 12 51.004 -8.231 4.223
95 HB1 ALA 12 HB1 ALA 12 49.486 -8.016 6.165
96 HB2 ALA 12 HB2 ALA 12 49.209 -6.325 5.745
97 HB3 ALA 12 HB3 ALA 12 50.811 -6.856 6.260
98 H ALA 13 HN ALA 13 48.930 -6.058 2.698
99 HA ALA 13 HA ALA 13 46.628 -7.836 2.520
100 HB1 ALA 13 HB1 ALA 13 45.583 -6.141 1.280
101 HB2 ALA 13 HB2 ALA 13 47.109 -5.533 0.636
102 HB3 ALA 13 HB3 ALA 13 46.680 -5.229 2.319
103 H LEU 14 HN LEU 14 49.391 -6.979 0.412
104 HA LEU 14 HA LEU 14 48.455 -8.419 -1.851
105 HB2 LEU 14 HB2 LEU 14 50.897 -7.099 -1.164
106 HB3 LEU 14 HB1 LEU 14 51.326 -8.682 -1.775
107 HG LEU 14 HG LEU 14 49.423 -6.820 -3.232
108 HD11 LEU 14 HD11 LEU 14 51.278 -6.126 -4.608
109 HD12 LEU 14 HD12 LEU 14 52.379 -7.206 -3.752
110 HD13 LEU 14 HD13 LEU 14 51.697 -5.804 -2.929
111 HD21 LEU 14 HD21 LEU 14 51.117 -9.024 -4.400
112 HD22 LEU 14 HD22 LEU 14 49.627 -8.317 -5.028
113 HD23 LEU 14 HD23 LEU 14 49.570 -9.399 -3.639
114 H HIS 15 HN HIS 15 49.957 -9.505 1.113
115 HA HIS 15 HA HIS 15 50.482 -12.199 0.118
116 HB2 HIS 15 HB2 HIS 15 51.749 -11.215 2.020
117 HB3 HIS 15 HB1 HIS 15 50.264 -11.191 2.972
118 HD1 HIS 15 HD1 HIS 15 51.643 -13.944 0.721
119 HD2 HIS 15 HD2 HIS 15 50.569 -13.331 4.702
120 HE1 HIS 15 HE1 HIS 15 51.873 -16.185 1.879
121 H ASP 16 HN ASP 16 47.860 -10.538 1.761
122 HA ASP 16 HA ASP 16 46.375 -12.955 2.396
123 HB2 ASP 16 HB2 ASP 16 45.381 -10.101 2.204
124 HB3 ASP 16 HB1 ASP 16 44.598 -11.432 3.053
125 H LEU 17 HN LEU 17 46.784 -11.074 -0.462
126 HA LEU 17 HA LEU 17 44.211 -12.005 -1.626
127 HB2 LEU 17 HB2 LEU 17 46.379 -10.197 -2.741
128 HB3 LEU 17 HB1 LEU 17 44.881 -10.586 -3.567
129 HG LEU 17 HG LEU 17 44.934 -9.374 -0.792
130 HD11 LEU 17 HD11 LEU 17 44.588 -7.879 -3.404
131 HD12 LEU 17 HD12 LEU 17 46.091 -7.903 -2.486
132 HD13 LEU 17 HD13 LEU 17 44.641 -7.191 -1.784
133 HD21 LEU 17 HD21 LEU 17 42.618 -8.575 -1.716
134 HD22 LEU 17 HD22 LEU 17 42.784 -10.245 -1.189
135 HD23 LEU 17 HD23 LEU 17 42.832 -9.854 -2.905
136 H MET 18 HN MET 18 47.608 -12.782 -1.698
137 HA MET 18 HA MET 18 47.306 -14.426 -4.143
138 HB2 MET 18 HB2 MET 18 49.524 -13.215 -2.649
139 HB3 MET 18 HB1 MET 18 49.865 -14.898 -3.033
140 HG2 MET 18 HG2 MET 18 50.681 -13.523 -4.853
141 HG3 MET 18 HG1 MET 18 49.267 -14.406 -5.427
142 HE1 MET 18 HE1 MET 18 48.776 -12.641 -7.488
143 HE2 MET 18 HE2 MET 18 50.402 -12.246 -6.936
144 HE3 MET 18 HE3 MET 18 49.242 -10.953 -7.236
145 H THR 19 HN THR 19 46.786 -14.802 -0.823
146 HA THR 19 HA THR 19 47.603 -17.648 -0.756
147 HB THR 19 HB THR 19 46.493 -17.443 1.599
148 HG1 THR 19 HG1 THR 19 46.686 -14.746 0.751
149 HG21 THR 19 HG21 THR 19 48.525 -16.393 2.497
150 HG22 THR 19 HG22 THR 19 48.919 -15.762 0.897
151 HG23 THR 19 HG23 THR 19 48.932 -17.502 1.188
152 H GLY 20 HN GLY 20 44.944 -15.943 -1.869
153 HA2 GLY 20 HA2 GLY 20 43.226 -17.465 -2.948
154 HA3 GLY 20 HA1 GLY 20 43.105 -18.278 -1.391
155 H LYS 21 HN LYS 21 42.989 -16.159 0.386
156 HA LYS 21 HA LYS 21 40.293 -15.384 0.306
157 HB2 LYS 21 HB2 LYS 21 42.509 -13.740 1.559
158 HB3 LYS 21 HB1 LYS 21 40.815 -13.800 2.048
159 HG2 LYS 21 HG2 LYS 21 41.234 -16.351 2.390
160 HG3 LYS 21 HG1 LYS 21 42.944 -15.915 2.370
161 HD2 LYS 21 HD2 LYS 21 42.414 -14.201 4.168
162 HD3 LYS 21 HD1 LYS 21 40.817 -14.937 4.288
163 HE2 LYS 21 HE2 LYS 21 42.293 -15.921 5.969
164 HE3 LYS 21 HE1 LYS 21 41.896 -17.133 4.750
165 HZ1 LYS 21 HZ1 LYS 21 43.988 -17.116 3.911
166 HZ2 LYS 21 HZ2 LYS 21 44.362 -16.683 5.511
167 HZ3 LYS 21 HZ3 LYS 21 44.271 -15.490 4.305
168 H ARG 22 HN ARG 22 39.318 -14.181 -1.243
169 HA ARG 22 HA ARG 22 40.878 -12.360 -2.903
170 HB2 ARG 22 HB2 ARG 22 39.114 -13.922 -3.786
171 HB3 ARG 22 HB1 ARG 22 37.909 -12.927 -2.971
172 HG2 ARG 22 HG2 ARG 22 38.826 -10.946 -4.241
173 HG3 ARG 22 HG1 ARG 22 39.796 -12.080 -5.177
174 HD2 ARG 22 HD2 ARG 22 36.796 -11.809 -5.079
175 HD3 ARG 22 HD1 ARG 22 37.855 -11.810 -6.489
176 HE ARG 22 HE ARG 22 38.225 -14.323 -5.389
177 HH11 ARG 22 HH21 ARG 22 35.541 -12.394 -6.371
178 HH12 ARG 22 HH22 ARG 22 34.561 -13.750 -6.819
179 HH21 ARG 22 HH11 ARG 22 36.960 -16.105 -5.968
180 HH22 ARG 22 HH12 ARG 22 35.364 -15.851 -6.591
181 H VAL 23 HN VAL 23 38.243 -12.111 -0.520
182 HA VAL 23 HA VAL 23 38.002 -9.208 -0.902
183 HB VAL 23 HB VAL 23 36.139 -10.761 -0.160
184 HG11 VAL 23 HG11 VAL 23 36.056 -11.518 2.110
185 HG12 VAL 23 HG12 VAL 23 37.463 -10.553 2.557
186 HG13 VAL 23 HG13 VAL 23 37.656 -11.964 1.515
187 HG21 VAL 23 HG21 VAL 23 36.875 -8.357 1.534
188 HG22 VAL 23 HG22 VAL 23 35.287 -9.124 1.565
189 HG23 VAL 23 HG23 VAL 23 35.875 -8.369 0.081
190 H ALA 24 HN ALA 24 39.048 -7.625 0.202
191 HA ALA 24 HA ALA 24 40.421 -8.221 2.761
192 HB1 ALA 24 HB1 ALA 24 41.875 -7.130 0.335
193 HB2 ALA 24 HB2 ALA 24 42.139 -8.710 1.072
194 HB3 ALA 24 HB3 ALA 24 42.553 -7.243 1.958
195 H THR 25 HN THR 25 40.899 -6.290 3.957
196 HA THR 25 HA THR 25 39.523 -3.813 2.917
197 HB THR 25 HB THR 25 39.863 -4.685 5.802
198 HG1 THR 25 HG1 THR 25 37.342 -4.629 4.952
199 HG21 THR 25 HG21 THR 25 38.055 -2.932 6.099
200 HG22 THR 25 HG22 THR 25 38.363 -2.448 4.431
201 HG23 THR 25 HG23 THR 25 39.639 -2.309 5.639
202 H VAL 26 HN VAL 26 40.537 -1.783 3.454
203 HA VAL 26 HA VAL 26 43.226 -1.890 4.690
204 HB VAL 26 HB VAL 26 43.367 -2.193 2.118
205 HG11 VAL 26 HG11 VAL 26 42.923 0.798 2.140
206 HG12 VAL 26 HG12 VAL 26 41.631 -0.337 1.750
207 HG13 VAL 26 HG13 VAL 26 43.081 -0.271 0.749
208 HG21 VAL 26 HG21 VAL 26 45.328 -0.657 2.004
209 HG22 VAL 26 HG22 VAL 26 45.303 -1.605 3.491
210 HG23 VAL 26 HG23 VAL 26 44.803 0.086 3.515
211 H GLN 27 HN GLN 27 43.401 -0.243 6.071
212 HA GLN 27 HA GLN 27 41.404 1.917 6.036
213 HB2 GLN 27 HB2 GLN 27 43.649 1.145 7.910
214 HB3 GLN 27 HB1 GLN 27 42.753 2.651 8.107
215 HG2 GLN 27 HG2 GLN 27 40.661 1.439 8.332
216 HG3 GLN 27 HG1 GLN 27 41.462 -0.089 7.965
217 HE21 GLN 27 HE21 GLN 27 42.137 2.651 10.234
218 HE22 GLN 27 HE22 GLN 27 42.397 1.653 11.582
219 H LYS 28 HN LYS 28 41.771 3.666 4.758
220 HA LYS 28 HA LYS 28 44.592 4.478 4.195
221 HB2 LYS 28 HB2 LYS 28 43.018 3.956 2.248
222 HB3 LYS 28 HB1 LYS 28 42.113 5.401 2.710
223 HG2 LYS 28 HG2 LYS 28 44.236 6.721 2.521
224 HG3 LYS 28 HG1 LYS 28 45.031 5.274 1.902
225 HD2 LYS 28 HD2 LYS 28 43.626 5.214 -0.033
226 HD3 LYS 28 HD1 LYS 28 42.529 6.419 0.643
227 HE2 LYS 28 HE2 LYS 28 45.439 6.950 -0.017
228 HE3 LYS 28 HE1 LYS 28 44.092 7.359 -1.079
229 HZ1 LYS 28 HZ1 LYS 28 43.830 9.220 0.061
230 HZ2 LYS 28 HZ2 LYS 28 45.082 8.792 1.126
231 HZ3 LYS 28 HZ3 LYS 28 43.482 8.325 1.459
232 H ASP 29 HN ASP 29 45.173 6.703 4.644
233 HA ASP 29 HA ASP 29 43.945 7.973 6.835
234 HB2 ASP 29 HB2 ASP 29 46.248 8.454 5.873
235 HB3 ASP 29 HB1 ASP 29 45.443 9.418 4.635
236 H GLY 30 HN GLY 30 41.654 7.932 6.373
237 HA2 GLY 30 HA2 GLY 30 40.293 10.160 5.779
238 HA3 GLY 30 HA1 GLY 30 40.676 9.622 4.142
239 H ARG 31 HN ARG 31 40.390 6.878 4.327
240 HA ARG 31 HA ARG 31 37.998 6.077 5.722
241 HB2 ARG 31 HB2 ARG 31 36.943 7.570 4.061
242 HB3 ARG 31 HB1 ARG 31 37.713 6.668 2.759
243 HG2 ARG 31 HG2 ARG 31 35.370 5.953 3.079
244 HG3 ARG 31 HG1 ARG 31 36.485 4.634 3.423
245 HD2 ARG 31 HD2 ARG 31 36.089 4.724 5.724
246 HD3 ARG 31 HD1 ARG 31 35.596 6.418 5.678
247 HE ARG 31 HE ARG 31 33.643 5.124 4.203
248 HH11 ARG 31 HH21 ARG 31 35.072 4.770 7.321
249 HH12 ARG 31 HH22 ARG 31 33.637 4.134 8.053
250 HH21 ARG 31 HH11 ARG 31 31.762 4.295 5.140
251 HH22 ARG 31 HH12 ARG 31 31.762 3.864 6.818
252 H ARG 32 HN ARG 32 37.633 3.904 5.540
253 HA ARG 32 HA ARG 32 39.809 2.311 4.368
254 HB2 ARG 32 HB2 ARG 32 39.103 0.631 5.809
255 HB3 ARG 32 HB1 ARG 32 38.492 2.037 6.669
256 HG2 ARG 32 HG2 ARG 32 36.299 1.697 5.398
257 HG3 ARG 32 HG1 ARG 32 36.939 0.127 4.913
258 HD2 ARG 32 HD2 ARG 32 35.596 -0.165 6.921
259 HD3 ARG 32 HD1 ARG 32 37.292 -0.421 7.331
260 HE ARG 32 HE ARG 32 36.887 2.270 7.848
261 HH11 ARG 32 HH21 ARG 32 35.373 -0.700 8.725
262 HH12 ARG 32 HH22 ARG 32 34.847 -0.129 10.274
263 HH21 ARG 32 HH11 ARG 32 36.210 3.033 9.866
264 HH22 ARG 32 HH12 ARG 32 35.321 1.984 10.919
265 H VAL 33 HN VAL 33 39.501 0.753 2.678
266 HA VAL 33 HA VAL 33 36.820 0.694 1.355
267 HB VAL 33 HB VAL 33 39.414 1.416 -0.053
268 HG11 VAL 33 HG11 VAL 33 36.674 0.658 -1.104
269 HG12 VAL 33 HG12 VAL 33 38.219 -0.099 -1.489
270 HG13 VAL 33 HG13 VAL 33 37.862 1.525 -2.076
271 HG21 VAL 33 HG21 VAL 33 38.480 3.406 0.872
272 HG22 VAL 33 HG22 VAL 33 36.830 2.884 0.535
273 HG23 VAL 33 HG23 VAL 33 37.886 3.378 -0.786
274 H GLU 34 HN GLU 34 36.396 -1.181 0.278
275 HA GLU 34 HA GLU 34 38.231 -3.439 0.858
276 HB2 GLU 34 HB2 GLU 34 35.677 -3.245 1.462
277 HB3 GLU 34 HB1 GLU 34 35.423 -3.702 -0.221
278 HG2 GLU 34 HG2 GLU 34 37.122 -5.266 1.743
279 HG3 GLU 34 HG1 GLU 34 35.453 -5.656 1.334
280 H PHE 35 HN PHE 35 39.436 -4.319 -0.766
281 HA PHE 35 HA PHE 35 38.550 -3.909 -3.612
282 HB2 PHE 35 HB2 PHE 35 41.259 -3.843 -2.298
283 HB3 PHE 35 HB1 PHE 35 41.150 -4.392 -3.966
284 HD1 PHE 35 HD2 PHE 35 39.448 -2.804 -5.440
285 HD2 PHE 35 HD1 PHE 35 41.765 -1.587 -2.036
286 HE1 PHE 35 HE2 PHE 35 39.374 -0.455 -6.227
287 HE2 PHE 35 HE1 PHE 35 41.705 0.757 -2.826
288 HZ PHE 35 HZ PHE 35 40.503 1.327 -4.921
289 H THR 36 HN THR 36 38.606 -5.738 -4.955
290 HA THR 36 HA THR 36 39.078 -8.368 -3.580
291 HB THR 36 HB THR 36 37.524 -9.316 -5.228
292 HG1 THR 36 HG1 THR 36 38.150 -7.760 -6.878
293 HG21 THR 36 HG21 THR 36 35.521 -8.371 -4.404
294 HG22 THR 36 HG22 THR 36 36.248 -6.775 -4.223
295 HG23 THR 36 HG23 THR 36 36.702 -8.081 -3.126
296 H ALA 37 HN ALA 37 40.118 -10.083 -5.098
297 HA ALA 37 HA ALA 37 42.487 -9.089 -6.282
298 HB1 ALA 37 HB1 ALA 37 42.748 -11.270 -7.343
299 HB2 ALA 37 HB2 ALA 37 41.042 -11.629 -7.085
300 HB3 ALA 37 HB3 ALA 37 42.134 -11.484 -5.708
301 H THR 38 HN THR 38 39.326 -8.831 -7.487
302 HA THR 38 HA THR 38 39.771 -9.021 -10.298
303 HB THR 38 HB THR 38 37.745 -7.629 -10.532
304 HG1 THR 38 HG1 THR 38 38.482 -6.956 -7.965
305 HG21 THR 38 HG21 THR 38 37.160 -9.359 -8.150
306 HG22 THR 38 HG22 THR 38 37.765 -10.124 -9.622
307 HG23 THR 38 HG23 THR 38 36.265 -9.199 -9.659
308 H SER 39 HN SER 39 40.607 -6.561 -7.979
309 HA SER 39 HA SER 39 41.707 -4.868 -10.205
310 HB2 SER 39 HB2 SER 39 41.135 -2.878 -8.914
311 HB3 SER 39 HB1 SER 39 39.681 -3.836 -9.181
312 HG SER 39 HG SER 39 40.871 -3.126 -6.871
313 H VAL 40 HN VAL 40 43.388 -6.702 -9.191
314 HA VAL 40 HA VAL 40 44.788 -5.666 -6.824
315 HB VAL 40 HB VAL 40 44.728 -8.067 -7.120
316 HG11 VAL 40 HG11 VAL 40 46.250 -7.638 -9.727
317 HG12 VAL 40 HG12 VAL 40 44.530 -8.022 -9.642
318 HG13 VAL 40 HG13 VAL 40 45.725 -9.182 -9.061
319 HG21 VAL 40 HG21 VAL 40 47.058 -8.539 -6.799
320 HG22 VAL 40 HG22 VAL 40 46.844 -6.872 -6.253
321 HG23 VAL 40 HG23 VAL 40 47.544 -7.201 -7.837
322 H SER 41 HN SER 41 44.849 -4.892 -10.150
323 HA SER 41 HA SER 41 47.672 -4.306 -10.393
324 HB2 SER 41 HB2 SER 41 46.968 -3.034 -12.411
325 HB3 SER 41 HB1 SER 41 46.305 -4.666 -12.380
326 HG SER 41 HG SER 41 44.348 -3.877 -12.003
327 H ASP 42 HN ASP 42 44.794 -2.269 -9.761
328 HA ASP 42 HA ASP 42 46.134 0.218 -9.602
329 HB2 ASP 42 HB2 ASP 42 44.238 1.010 -8.336
330 HB3 ASP 42 HB1 ASP 42 43.632 -0.150 -9.517
331 H LEU 43 HN LEU 43 45.860 -2.392 -7.159
332 HA LEU 43 HA LEU 43 46.931 -0.856 -4.992
333 HB2 LEU 43 HB2 LEU 43 45.764 -3.175 -4.946
334 HB3 LEU 43 HB1 LEU 43 47.347 -3.829 -5.344
335 HG LEU 43 HG LEU 43 48.296 -2.784 -3.299
336 HD11 LEU 43 HD11 LEU 43 45.527 -1.624 -3.143
337 HD12 LEU 43 HD12 LEU 43 47.070 -0.908 -2.686
338 HD13 LEU 43 HD13 LEU 43 46.301 -2.079 -1.624
339 HD21 LEU 43 HD21 LEU 43 47.332 -4.352 -1.764
340 HD22 LEU 43 HD22 LEU 43 47.213 -5.093 -3.361
341 HD23 LEU 43 HD23 LEU 43 45.793 -4.353 -2.625
342 H LYS 44 HN LYS 44 48.402 -2.738 -7.600
343 HA LYS 44 HA LYS 44 51.099 -2.601 -6.590
344 HB2 LYS 44 HB2 LYS 44 49.802 -3.244 -9.208
345 HB3 LYS 44 HB1 LYS 44 51.503 -2.788 -9.270
346 HG2 LYS 44 HG2 LYS 44 52.137 -4.579 -7.826
347 HG3 LYS 44 HG1 LYS 44 50.465 -4.902 -7.372
348 HD2 LYS 44 HD2 LYS 44 49.941 -5.762 -9.538
349 HD3 LYS 44 HD1 LYS 44 51.443 -5.142 -10.223
350 HE2 LYS 44 HE2 LYS 44 51.346 -7.222 -8.025
351 HE3 LYS 44 HE1 LYS 44 51.468 -7.622 -9.739
352 HZ1 LYS 44 HZ1 LYS 44 53.552 -7.086 -8.077
353 HZ2 LYS 44 HZ2 LYS 44 53.354 -5.626 -8.924
354 HZ3 LYS 44 HZ3 LYS 44 53.610 -7.075 -9.773
355 H LYS 45 HN LYS 45 49.257 -0.518 -8.839
356 HA LYS 45 HA LYS 45 51.431 1.278 -9.368
357 HB2 LYS 45 HB2 LYS 45 49.409 1.101 -10.773
358 HB3 LYS 45 HB1 LYS 45 48.439 1.758 -9.461
359 HG2 LYS 45 HG2 LYS 45 50.810 3.408 -10.221
360 HG3 LYS 45 HG1 LYS 45 49.558 3.297 -11.453
361 HD2 LYS 45 HD2 LYS 45 48.790 3.927 -8.605
362 HD3 LYS 45 HD1 LYS 45 49.422 5.201 -9.646
363 HE2 LYS 45 HE2 LYS 45 47.135 3.415 -10.494
364 HE3 LYS 45 HE1 LYS 45 46.879 4.925 -9.623
365 HZ1 LYS 45 HZ1 LYS 45 48.457 5.838 -11.475
366 HZ2 LYS 45 HZ2 LYS 45 46.793 5.654 -11.765
367 HZ3 LYS 45 HZ3 LYS 45 47.892 4.491 -12.338
368 H TYR 46 HN TYR 46 48.828 1.295 -6.948
369 HA TYR 46 HA TYR 46 49.341 3.867 -5.848
370 HB2 TYR 46 HB2 TYR 46 47.339 2.587 -5.285
371 HB3 TYR 46 HB1 TYR 46 48.321 1.333 -4.538
372 HD1 TYR 46 HD2 TYR 46 48.030 5.082 -4.350
373 HD2 TYR 46 HD1 TYR 46 48.361 1.372 -2.204
374 HE1 TYR 46 HE2 TYR 46 47.935 6.314 -2.203
375 HE2 TYR 46 HE1 TYR 46 48.259 2.604 -0.057
376 HH TYR 46 HH TYR 46 47.646 6.086 0.036
377 H ILE 47 HN ILE 47 50.559 0.668 -4.796
378 HA ILE 47 HA ILE 47 52.262 1.542 -2.728
379 HB ILE 47 HB ILE 47 52.718 -0.687 -4.731
380 HG12 ILE 47 HG12 ILE 47 51.709 -0.997 -1.900
381 HG13 ILE 47 HG11 ILE 47 50.589 -0.642 -3.213
382 HG21 ILE 47 HG21 ILE 47 54.109 -1.621 -2.802
383 HG22 ILE 47 HG22 ILE 47 54.038 -0.005 -2.099
384 HG23 ILE 47 HG23 ILE 47 54.806 -0.251 -3.666
385 HD11 ILE 47 HD11 ILE 47 51.144 -3.153 -2.575
386 HD12 ILE 47 HD12 ILE 47 52.563 -2.877 -3.585
387 HD13 ILE 47 HD13 ILE 47 50.950 -2.682 -4.262
388 H ALA 48 HN ALA 48 52.946 1.191 -6.204
389 HA ALA 48 HA ALA 48 55.648 1.948 -6.194
390 HB1 ALA 48 HB1 ALA 48 53.500 2.464 -8.263
391 HB2 ALA 48 HB2 ALA 48 54.623 1.106 -8.211
392 HB3 ALA 48 HB3 ALA 48 55.219 2.731 -8.549
393 H GLU 49 HN GLU 49 52.757 4.025 -6.318
394 HA GLU 49 HA GLU 49 54.084 6.497 -6.708
395 HB2 GLU 49 HB2 GLU 49 51.500 5.793 -5.303
396 HB3 GLU 49 HB1 GLU 49 52.047 7.461 -5.485
397 HG2 GLU 49 HG2 GLU 49 52.052 7.265 -7.895
398 HG3 GLU 49 HG1 GLU 49 51.727 5.534 -7.802
399 H LEU 50 HN LEU 50 53.718 4.547 -3.796
400 HA LEU 50 HA LEU 50 54.605 6.714 -2.031
401 HB2 LEU 50 HB2 LEU 50 54.557 3.749 -1.415
402 HB3 LEU 50 HB1 LEU 50 54.531 5.085 -0.266
403 HG LEU 50 HG LEU 50 52.350 4.351 -2.240
404 HD11 LEU 50 HD11 LEU 50 52.554 4.322 0.780
405 HD12 LEU 50 HD12 LEU 50 52.321 2.936 -0.287
406 HD13 LEU 50 HD13 LEU 50 51.037 4.130 -0.096
407 HD21 LEU 50 HD21 LEU 50 51.144 6.253 -0.923
408 HD22 LEU 50 HD22 LEU 50 52.280 6.714 -2.189
409 HD23 LEU 50 HD23 LEU 50 52.771 6.784 -0.496
410 H GLU 51 HN GLU 51 56.132 4.058 -3.777
411 HA GLU 51 HA GLU 51 58.622 4.082 -2.364
412 HB2 GLU 51 HB2 GLU 51 57.873 3.309 -5.190
413 HB3 GLU 51 HB1 GLU 51 59.532 3.194 -4.604
414 HG2 GLU 51 HG2 GLU 51 58.955 1.599 -2.943
415 HG3 GLU 51 HG1 GLU 51 57.232 1.937 -3.102
416 H VAL 52 HN VAL 52 57.309 6.132 -4.906
417 HA VAL 52 HA VAL 52 59.880 7.460 -5.388
418 HB VAL 52 HB VAL 52 57.109 8.351 -6.240
419 HG11 VAL 52 HG11 VAL 52 58.745 10.101 -6.527
420 HG12 VAL 52 HG12 VAL 52 58.477 9.380 -8.114
421 HG13 VAL 52 HG13 VAL 52 59.921 8.966 -7.189
422 HG21 VAL 52 HG21 VAL 52 57.746 7.195 -8.408
423 HG22 VAL 52 HG22 VAL 52 57.419 6.100 -7.064
424 HG23 VAL 52 HG23 VAL 52 59.083 6.447 -7.535
425 H GLN 53 HN GLN 53 57.006 7.994 -3.403
426 HA GLN 53 HA GLN 53 57.790 10.731 -2.711
427 HB2 GLN 53 HB2 GLN 53 55.674 8.836 -1.670
428 HB3 GLN 53 HB1 GLN 53 55.958 10.421 -0.950
429 HG2 GLN 53 HG2 GLN 53 55.421 10.022 -3.903
430 HG3 GLN 53 HG1 GLN 53 54.149 10.365 -2.731
431 HE21 GLN 53 HE21 GLN 53 55.135 12.113 -4.975
432 HE22 GLN 53 HE22 GLN 53 55.629 13.559 -4.237
433 H THR 54 HN THR 54 58.050 7.509 -1.241
434 HA THR 54 HA THR 54 59.388 8.657 1.143
435 HB THR 54 HB THR 54 59.059 5.705 0.590
436 HG1 THR 54 HG1 THR 54 56.986 5.829 0.902
437 HG21 THR 54 HG21 THR 54 60.322 6.376 2.582
438 HG22 THR 54 HG22 THR 54 58.781 5.665 3.059
439 HG23 THR 54 HG23 THR 54 58.992 7.415 3.094
440 H GLY 55 HN GLY 55 60.467 8.433 -1.772
441 HA2 GLY 55 HA2 GLY 55 63.203 7.810 -0.969
442 HA3 GLY 55 HA1 GLY 55 62.526 6.681 -2.144
443 H MET 56 HN MET 56 64.380 9.378 -1.957
444 HA MET 56 HA MET 56 64.011 9.976 -4.792
445 HB2 MET 56 HB2 MET 56 62.225 11.321 -3.526
446 HB3 MET 56 HB1 MET 56 63.563 12.252 -2.853
447 HG2 MET 56 HG2 MET 56 64.337 12.729 -5.187
448 HG3 MET 56 HG1 MET 56 62.892 11.920 -5.790
449 HE1 MET 56 HE1 MET 56 60.454 12.609 -4.357
450 HE2 MET 56 HE2 MET 56 60.750 12.837 -6.079
451 HE3 MET 56 HE3 MET 56 60.000 14.127 -5.144
452 H THR 57 HN THR 57 66.104 10.094 -5.436
453 HA THR 57 HA THR 57 67.940 11.979 -4.193
454 HB THR 57 HB THR 57 68.604 9.026 -4.003
455 HG1 THR 57 HG1 THR 57 68.115 10.826 -1.883
456 HG21 THR 57 HG21 THR 57 70.497 9.907 -2.612
457 HG22 THR 57 HG22 THR 57 70.020 11.539 -3.080
458 HG23 THR 57 HG23 THR 57 70.578 10.399 -4.304
459 H GLN 58 HN GLN 58 67.216 9.479 -6.526
460 HA GLN 58 HA GLN 58 69.645 9.939 -8.097
461 HB2 GLN 58 HB2 GLN 58 67.102 8.371 -8.571
462 HB3 GLN 58 HB1 GLN 58 68.343 8.539 -9.814
463 HG2 GLN 58 HG2 GLN 58 70.009 7.526 -8.359
464 HG3 GLN 58 HG1 GLN 58 68.858 7.472 -7.023
465 HE21 GLN 58 HE21 GLN 58 69.668 6.014 -10.160
466 HE22 GLN 58 HE22 GLN 58 68.645 4.670 -9.993
467 H ARG 59 HN ARG 59 68.999 10.301 -10.635
468 HA ARG 59 HA ARG 59 66.880 12.204 -11.112
469 HB2 ARG 59 HB2 ARG 59 68.188 14.222 -11.366
470 HB3 ARG 59 HB1 ARG 59 68.504 13.575 -9.755
471 HG2 ARG 59 HG2 ARG 59 70.524 12.388 -10.775
472 HG3 ARG 59 HG1 ARG 59 70.273 13.396 -12.201
473 HD2 ARG 59 HD2 ARG 59 70.474 15.423 -10.820
474 HD3 ARG 59 HD1 ARG 59 70.700 14.428 -9.381
475 HE ARG 59 HE ARG 59 72.694 13.563 -11.096
476 HH11 ARG 59 HH21 ARG 59 71.609 16.589 -9.848
477 HH12 ARG 59 HH22 ARG 59 73.180 17.314 -9.875
478 HH21 ARG 59 HH11 ARG 59 74.754 14.494 -11.139
479 HH22 ARG 59 HH12 ARG 59 74.961 16.129 -10.605
480 H ARG 60 HN ARG 60 68.843 9.893 -12.150
481 HA ARG 60 HA ARG 60 69.806 10.834 -14.687
482 HB2 ARG 60 HB2 ARG 60 68.986 8.011 -13.942
483 HB3 ARG 60 HB1 ARG 60 70.070 8.479 -15.251
484 HG2 ARG 60 HG2 ARG 60 70.583 9.030 -12.312
485 HG3 ARG 60 HG1 ARG 60 71.297 7.699 -13.220
486 HD2 ARG 60 HD2 ARG 60 72.091 9.585 -14.864
487 HD3 ARG 60 HD1 ARG 60 71.803 10.653 -13.489
488 HE ARG 60 HE ARG 60 73.339 8.610 -12.425
489 HH11 ARG 60 HH21 ARG 60 73.552 10.762 -15.110
490 HH12 ARG 60 HH22 ARG 60 75.283 10.825 -15.093
491 HH21 ARG 60 HH11 ARG 60 75.599 8.680 -12.386
492 HH22 ARG 60 HH12 ARG 60 76.442 9.646 -13.551
493 H ARG 61 HN ARG 61 68.719 8.993 -16.524
494 HA ARG 61 HA ARG 61 66.905 8.680 -17.963
495 HB2 ARG 61 HB2 ARG 61 65.780 8.180 -15.635
496 HB3 ARG 61 HB1 ARG 61 65.011 9.749 -15.871
497 HG2 ARG 61 HG2 ARG 61 64.211 8.964 -18.111
498 HG3 ARG 61 HG1 ARG 61 64.867 7.368 -17.743
499 HD2 ARG 61 HD2 ARG 61 62.516 7.350 -17.172
500 HD3 ARG 61 HD1 ARG 61 63.438 7.343 -15.668
501 HE ARG 61 HE ARG 61 62.982 10.032 -16.145
502 HH11 ARG 61 HH21 ARG 61 61.074 7.168 -15.959
503 HH12 ARG 61 HH22 ARG 61 59.667 7.983 -15.361
504 HH21 ARG 61 HH11 ARG 61 61.157 11.114 -15.365
505 HH22 ARG 61 HH12 ARG 61 59.715 10.218 -15.025
506 H GLY 62 HN GLY 62 66.962 11.702 -16.110
507 HA2 GLY 62 HA2 GLY 62 66.632 13.913 -16.816
508 HA3 GLY 62 HA1 GLY 62 67.012 13.336 -18.439
Start of MODEL 14
1 H1 MET 1 HT1 MET 1 57.975 8.105 7.782
2 H2 MET 1 HT2 MET 1 58.714 9.021 9.009
3 H3 MET 1 HT3 MET 1 57.025 9.051 8.820
4 HA MET 1 HA MET 1 58.513 6.573 9.463
5 HB2 MET 1 HB2 MET 1 57.354 8.696 11.277
6 HB3 MET 1 HB1 MET 1 57.589 7.033 11.816
7 HG2 MET 1 HG2 MET 1 59.817 8.644 10.562
8 HG3 MET 1 HG1 MET 1 59.506 8.665 12.296
9 HE1 MET 1 HE1 MET 1 62.215 5.923 10.259
10 HE2 MET 1 HE2 MET 1 62.051 7.671 10.409
11 HE3 MET 1 HE3 MET 1 61.002 6.787 9.303
12 H VAL 2 HN VAL 2 55.447 8.377 9.950
13 HA VAL 2 HA VAL 2 53.776 6.163 10.382
14 HB VAL 2 HB VAL 2 53.071 8.656 8.800
15 HG11 VAL 2 HG11 VAL 2 51.307 7.070 8.569
16 HG12 VAL 2 HG12 VAL 2 50.796 8.140 9.874
17 HG13 VAL 2 HG13 VAL 2 51.455 6.547 10.247
18 HG21 VAL 2 HG21 VAL 2 53.048 8.079 11.780
19 HG22 VAL 2 HG22 VAL 2 52.303 9.495 11.037
20 HG23 VAL 2 HG23 VAL 2 54.049 9.267 10.947
21 H ARG 3 HN ARG 3 54.536 7.714 7.239
22 HA ARG 3 HA ARG 3 53.093 5.999 5.557
23 HB2 ARG 3 HB2 ARG 3 55.853 7.168 5.079
24 HB3 ARG 3 HB1 ARG 3 54.800 6.510 3.826
25 HG2 ARG 3 HG2 ARG 3 53.077 8.187 4.393
26 HG3 ARG 3 HG1 ARG 3 54.136 8.852 5.638
27 HD2 ARG 3 HD2 ARG 3 55.813 9.420 3.941
28 HD3 ARG 3 HD1 ARG 3 54.803 8.708 2.683
29 HE ARG 3 HE ARG 3 53.158 10.601 3.859
30 HH11 ARG 3 HH21 ARG 3 56.321 10.538 2.491
31 HH12 ARG 3 HH22 ARG 3 56.258 12.176 1.933
32 HH21 ARG 3 HH11 ARG 3 53.056 12.741 3.138
33 HH22 ARG 3 HH12 ARG 3 54.409 13.424 2.300
34 H GLN 4 HN GLN 4 56.183 5.453 7.177
35 HA GLN 4 HA GLN 4 56.970 3.085 5.828
36 HB2 GLN 4 HB2 GLN 4 58.223 4.476 7.641
37 HB3 GLN 4 HB1 GLN 4 57.362 3.465 8.800
38 HG2 GLN 4 HG2 GLN 4 59.104 2.419 6.547
39 HG3 GLN 4 HG1 GLN 4 59.604 2.544 8.233
40 HE21 GLN 4 HE21 GLN 4 58.243 0.414 5.990
41 HE22 GLN 4 HE22 GLN 4 57.536 -0.680 7.075
42 H GLU 5 HN GLU 5 54.802 3.575 8.597
43 HA GLU 5 HA GLU 5 54.283 0.744 8.970
44 HB2 GLU 5 HB2 GLU 5 53.998 2.242 10.849
45 HB3 GLU 5 HB1 GLU 5 52.854 3.233 9.945
46 HG2 GLU 5 HG2 GLU 5 51.188 1.543 9.980
47 HG3 GLU 5 HG1 GLU 5 52.344 0.302 10.466
48 H GLU 6 HN GLU 6 52.393 3.430 7.526
49 HA GLU 6 HA GLU 6 50.164 1.845 6.770
50 HB2 GLU 6 HB2 GLU 6 51.297 4.408 5.613
51 HB3 GLU 6 HB1 GLU 6 49.846 3.647 4.960
52 HG2 GLU 6 HG2 GLU 6 48.767 3.767 7.156
53 HG3 GLU 6 HG1 GLU 6 50.229 4.462 7.855
54 H LEU 7 HN LEU 7 53.378 1.920 5.466
55 HA LEU 7 HA LEU 7 52.628 0.884 2.844
56 HB2 LEU 7 HB2 LEU 7 54.720 2.108 3.058
57 HB3 LEU 7 HB1 LEU 7 55.273 1.011 4.318
58 HG LEU 7 HG LEU 7 55.445 -0.820 2.763
59 HD11 LEU 7 HD11 LEU 7 53.585 -0.620 1.329
60 HD12 LEU 7 HD12 LEU 7 54.944 -0.265 0.267
61 HD13 LEU 7 HD13 LEU 7 53.963 1.052 0.915
62 HD21 LEU 7 HD21 LEU 7 57.348 0.698 2.750
63 HD22 LEU 7 HD22 LEU 7 56.540 1.758 1.595
64 HD23 LEU 7 HD23 LEU 7 57.057 0.146 1.102
65 H ALA 8 HN ALA 8 54.007 -0.473 5.833
66 HA ALA 8 HA ALA 8 54.180 -3.168 4.924
67 HB1 ALA 8 HB1 ALA 8 53.704 -2.150 7.742
68 HB2 ALA 8 HB2 ALA 8 55.283 -2.372 6.984
69 HB3 ALA 8 HB3 ALA 8 54.258 -3.768 7.313
70 H ALA 9 HN ALA 9 51.454 -1.261 5.954
71 HA ALA 9 HA ALA 9 49.729 -3.509 6.592
72 HB1 ALA 9 HB1 ALA 9 49.159 -1.430 7.611
73 HB2 ALA 9 HB2 ALA 9 47.912 -1.717 6.399
74 HB3 ALA 9 HB3 ALA 9 49.216 -0.575 6.070
75 H ALA 10 HN ALA 10 49.731 -1.189 3.831
76 HA ALA 10 HA ALA 10 47.802 -2.635 2.317
77 HB1 ALA 10 HB1 ALA 10 48.160 -0.536 1.394
78 HB2 ALA 10 HB2 ALA 10 49.183 -1.494 0.322
79 HB3 ALA 10 HB3 ALA 10 49.897 -0.603 1.665
80 H ARG 11 HN ARG 11 51.214 -3.091 2.828
81 HA ARG 11 HA ARG 11 51.664 -4.944 0.661
82 HB2 ARG 11 HB2 ARG 11 53.337 -3.640 2.266
83 HB3 ARG 11 HB1 ARG 11 53.179 -5.075 3.273
84 HG2 ARG 11 HG2 ARG 11 54.910 -5.850 1.971
85 HG3 ARG 11 HG1 ARG 11 53.614 -6.259 0.849
86 HD2 ARG 11 HD2 ARG 11 53.902 -4.017 -0.218
87 HD3 ARG 11 HD1 ARG 11 55.280 -3.730 0.841
88 HE ARG 11 HE ARG 11 55.880 -6.143 -0.383
89 HH11 ARG 11 HH21 ARG 11 54.962 -2.981 -1.407
90 HH12 ARG 11 HH22 ARG 11 55.839 -3.065 -2.899
91 HH21 ARG 11 HH11 ARG 11 57.031 -6.270 -2.325
92 HH22 ARG 11 HH12 ARG 11 57.011 -4.928 -3.418
93 H ALA 12 HN ALA 12 51.014 -5.390 4.201
94 HA ALA 12 HA ALA 12 50.993 -8.198 4.209
95 HB1 ALA 12 HB1 ALA 12 49.182 -6.354 5.786
96 HB2 ALA 12 HB2 ALA 12 50.809 -6.838 6.265
97 HB3 ALA 12 HB3 ALA 12 49.520 -8.039 6.182
98 H ALA 13 HN ALA 13 48.854 -6.039 2.749
99 HA ALA 13 HA ALA 13 46.596 -7.892 2.577
100 HB1 ALA 13 HB1 ALA 13 46.983 -5.462 0.827
101 HB2 ALA 13 HB2 ALA 13 46.488 -5.306 2.512
102 HB3 ALA 13 HB3 ALA 13 45.474 -6.195 1.375
103 H LEU 14 HN LEU 14 49.281 -6.859 0.466
104 HA LEU 14 HA LEU 14 48.314 -8.269 -1.824
105 HB2 LEU 14 HB2 LEU 14 50.402 -6.560 -1.429
106 HB3 LEU 14 HB1 LEU 14 51.268 -8.081 -1.591
107 HG LEU 14 HG LEU 14 49.226 -7.011 -3.571
108 HD11 LEU 14 HD11 LEU 14 51.452 -5.769 -3.359
109 HD12 LEU 14 HD12 LEU 14 51.042 -6.391 -4.954
110 HD13 LEU 14 HD13 LEU 14 52.210 -7.249 -3.949
111 HD21 LEU 14 HD21 LEU 14 50.286 -8.839 -4.996
112 HD22 LEU 14 HD22 LEU 14 49.258 -9.398 -3.678
113 HD23 LEU 14 HD23 LEU 14 51.014 -9.451 -3.511
114 H HIS 15 HN HIS 15 49.994 -9.303 1.040
115 HA HIS 15 HA HIS 15 50.771 -11.894 -0.060
116 HB2 HIS 15 HB2 HIS 15 51.968 -10.861 1.865
117 HB3 HIS 15 HB1 HIS 15 50.500 -11.010 2.832
118 HD1 HIS 15 HD1 HIS 15 50.748 -12.959 4.360
119 HD2 HIS 15 HD2 HIS 15 52.376 -13.750 0.605
120 HE1 HIS 15 HE1 HIS 15 51.553 -15.359 4.420
121 H ASP 16 HN ASP 16 48.030 -10.520 1.647
122 HA ASP 16 HA ASP 16 46.772 -13.070 2.231
123 HB2 ASP 16 HB2 ASP 16 46.338 -10.924 3.481
124 HB3 ASP 16 HB1 ASP 16 45.461 -10.347 2.064
125 H LEU 17 HN LEU 17 46.573 -10.718 -0.408
126 HA LEU 17 HA LEU 17 44.267 -11.976 -1.641
127 HB2 LEU 17 HB2 LEU 17 46.304 -10.050 -2.794
128 HB3 LEU 17 HB1 LEU 17 44.793 -10.496 -3.563
129 HG LEU 17 HG LEU 17 44.915 -9.310 -0.783
130 HD11 LEU 17 HD11 LEU 17 44.442 -7.138 -1.763
131 HD12 LEU 17 HD12 LEU 17 44.409 -7.834 -3.381
132 HD13 LEU 17 HD13 LEU 17 45.923 -7.765 -2.482
133 HD21 LEU 17 HD21 LEU 17 42.796 -10.282 -1.077
134 HD22 LEU 17 HD22 LEU 17 42.739 -9.887 -2.792
135 HD23 LEU 17 HD23 LEU 17 42.520 -8.622 -1.591
136 H MET 18 HN MET 18 47.703 -12.558 -1.776
137 HA MET 18 HA MET 18 47.467 -14.146 -4.255
138 HB2 MET 18 HB2 MET 18 49.615 -12.888 -2.747
139 HB3 MET 18 HB1 MET 18 50.018 -14.577 -3.032
140 HG2 MET 18 HG2 MET 18 50.864 -13.298 -4.896
141 HG3 MET 18 HG1 MET 18 49.469 -14.208 -5.474
142 HE1 MET 18 HE1 MET 18 49.368 -10.897 -7.480
143 HE2 MET 18 HE2 MET 18 48.944 -12.603 -7.597
144 HE3 MET 18 HE3 MET 18 50.570 -12.139 -7.101
145 H THR 19 HN THR 19 46.964 -14.649 -0.935
146 HA THR 19 HA THR 19 47.736 -17.515 -1.035
147 HB THR 19 HB THR 19 46.713 -17.363 1.393
148 HG1 THR 19 HG1 THR 19 47.459 -14.758 1.461
149 HG21 THR 19 HG21 THR 19 48.866 -16.524 2.237
150 HG22 THR 19 HG22 THR 19 49.248 -15.873 0.643
151 HG23 THR 19 HG23 THR 19 49.117 -17.616 0.876
152 H GLY 20 HN GLY 20 45.065 -15.667 -1.896
153 HA2 GLY 20 HA2 GLY 20 43.262 -17.116 -2.964
154 HA3 GLY 20 HA1 GLY 20 43.187 -17.972 -1.427
155 H LYS 21 HN LYS 21 43.325 -15.738 0.332
156 HA LYS 21 HA LYS 21 40.640 -15.009 0.584
157 HB2 LYS 21 HB2 LYS 21 43.171 -13.649 1.495
158 HB3 LYS 21 HB1 LYS 21 41.602 -12.919 1.817
159 HG2 LYS 21 HG2 LYS 21 42.440 -14.357 3.673
160 HG3 LYS 21 HG1 LYS 21 40.884 -14.879 3.029
161 HD2 LYS 21 HD2 LYS 21 41.895 -16.665 1.794
162 HD3 LYS 21 HD1 LYS 21 43.517 -16.034 2.087
163 HE2 LYS 21 HE2 LYS 21 42.981 -17.966 3.560
164 HE3 LYS 21 HE1 LYS 21 43.298 -16.494 4.479
165 HZ1 LYS 21 HZ1 LYS 21 41.130 -16.278 5.069
166 HZ2 LYS 21 HZ2 LYS 21 41.191 -17.971 4.934
167 HZ3 LYS 21 HZ3 LYS 21 40.541 -17.038 3.671
168 H ARG 22 HN ARG 22 39.548 -14.214 -1.191
169 HA ARG 22 HA ARG 22 40.743 -12.327 -3.017
170 HB2 ARG 22 HB2 ARG 22 38.906 -14.087 -3.489
171 HB3 ARG 22 HB1 ARG 22 37.790 -12.915 -2.789
172 HG2 ARG 22 HG2 ARG 22 38.806 -11.220 -4.436
173 HG3 ARG 22 HG1 ARG 22 39.509 -12.616 -5.251
174 HD2 ARG 22 HD2 ARG 22 36.572 -12.051 -4.793
175 HD3 ARG 22 HD1 ARG 22 37.413 -12.153 -6.339
176 HE ARG 22 HE ARG 22 37.840 -14.638 -5.190
177 HH11 ARG 22 HH21 ARG 22 35.123 -12.631 -5.880
178 HH12 ARG 22 HH22 ARG 22 34.037 -13.958 -6.125
179 HH21 ARG 22 HH11 ARG 22 36.437 -16.383 -5.506
180 HH22 ARG 22 HH12 ARG 22 34.781 -16.082 -5.913
181 H VAL 23 HN VAL 23 38.209 -12.110 -0.517
182 HA VAL 23 HA VAL 23 37.977 -9.194 -0.888
183 HB VAL 23 HB VAL 23 36.070 -10.730 -0.244
184 HG11 VAL 23 HG11 VAL 23 37.315 -10.651 2.516
185 HG12 VAL 23 HG12 VAL 23 37.534 -12.017 1.421
186 HG13 VAL 23 HG13 VAL 23 35.918 -11.587 1.983
187 HG21 VAL 23 HG21 VAL 23 35.802 -8.362 0.092
188 HG22 VAL 23 HG22 VAL 23 36.802 -8.398 1.546
189 HG23 VAL 23 HG23 VAL 23 35.212 -9.158 1.551
190 H ALA 24 HN ALA 24 39.036 -7.657 0.279
191 HA ALA 24 HA ALA 24 40.268 -8.322 2.888
192 HB1 ALA 24 HB1 ALA 24 42.485 -7.435 2.199
193 HB2 ALA 24 HB2 ALA 24 41.902 -7.307 0.541
194 HB3 ALA 24 HB3 ALA 24 42.058 -8.891 1.301
195 H THR 25 HN THR 25 40.736 -6.412 4.126
196 HA THR 25 HA THR 25 39.417 -3.923 3.054
197 HB THR 25 HB THR 25 39.860 -4.773 5.932
198 HG1 THR 25 HG1 THR 25 37.628 -5.188 5.861
199 HG21 THR 25 HG21 THR 25 38.102 -2.950 6.267
200 HG22 THR 25 HG22 THR 25 38.450 -2.455 4.610
201 HG23 THR 25 HG23 THR 25 39.721 -2.404 5.831
202 H VAL 26 HN VAL 26 40.426 -1.876 3.559
203 HA VAL 26 HA VAL 26 43.175 -1.945 4.652
204 HB VAL 26 HB VAL 26 43.192 -2.245 2.074
205 HG11 VAL 26 HG11 VAL 26 41.413 -0.414 1.797
206 HG12 VAL 26 HG12 VAL 26 42.809 -0.326 0.724
207 HG13 VAL 26 HG13 VAL 26 42.707 0.739 2.123
208 HG21 VAL 26 HG21 VAL 26 45.187 -1.632 3.346
209 HG22 VAL 26 HG22 VAL 26 44.665 0.051 3.403
210 HG23 VAL 26 HG23 VAL 26 45.123 -0.677 1.865
211 H GLN 27 HN GLN 27 43.389 -0.292 6.027
212 HA GLN 27 HA GLN 27 41.360 1.845 6.067
213 HB2 GLN 27 HB2 GLN 27 43.651 1.064 7.881
214 HB3 GLN 27 HB1 GLN 27 42.772 2.577 8.107
215 HG2 GLN 27 HG2 GLN 27 40.670 1.370 8.359
216 HG3 GLN 27 HG1 GLN 27 41.475 -0.161 8.008
217 HE21 GLN 27 HE21 GLN 27 40.125 1.071 10.567
218 HE22 GLN 27 HE22 GLN 27 41.265 0.750 11.784
219 H LYS 28 HN LYS 28 41.677 3.621 4.811
220 HA LYS 28 HA LYS 28 44.478 4.460 4.180
221 HB2 LYS 28 HB2 LYS 28 42.852 3.928 2.271
222 HB3 LYS 28 HB1 LYS 28 41.963 5.375 2.755
223 HG2 LYS 28 HG2 LYS 28 44.084 6.689 2.516
224 HG3 LYS 28 HG1 LYS 28 44.860 5.239 1.877
225 HD2 LYS 28 HD2 LYS 28 43.279 5.156 0.024
226 HD3 LYS 28 HD1 LYS 28 42.382 6.521 0.690
227 HE2 LYS 28 HE2 LYS 28 45.258 6.582 -0.268
228 HE3 LYS 28 HE1 LYS 28 43.874 7.288 -1.102
229 HZ1 LYS 28 HZ1 LYS 28 44.460 9.111 0.037
230 HZ2 LYS 28 HZ2 LYS 28 45.327 8.244 1.213
231 HZ3 LYS 28 HZ3 LYS 28 43.637 8.375 1.325
232 H ASP 29 HN ASP 29 45.044 6.687 4.636
233 HA ASP 29 HA ASP 29 43.835 7.931 6.856
234 HB2 ASP 29 HB2 ASP 29 45.426 9.216 4.613
235 HB3 ASP 29 HB1 ASP 29 45.098 9.956 6.180
236 H GLY 30 HN GLY 30 41.537 7.874 6.410
237 HA2 GLY 30 HA2 GLY 30 40.163 10.104 5.850
238 HA3 GLY 30 HA1 GLY 30 40.529 9.578 4.205
239 H ARG 31 HN ARG 31 40.266 6.828 4.397
240 HA ARG 31 HA ARG 31 37.886 6.012 5.802
241 HB2 ARG 31 HB2 ARG 31 36.826 7.505 4.125
242 HB3 ARG 31 HB1 ARG 31 37.586 6.580 2.837
243 HG2 ARG 31 HG2 ARG 31 35.234 5.888 3.194
244 HG3 ARG 31 HG1 ARG 31 36.358 4.569 3.503
245 HD2 ARG 31 HD2 ARG 31 34.407 5.061 5.210
246 HD3 ARG 31 HD1 ARG 31 36.005 4.628 5.812
247 HE ARG 31 HE ARG 31 36.102 7.384 5.690
248 HH11 ARG 31 HH21 ARG 31 33.959 5.033 7.011
249 HH12 ARG 31 HH22 ARG 31 33.462 6.035 8.332
250 HH21 ARG 31 HH11 ARG 31 35.467 8.708 7.406
251 HH22 ARG 31 HH12 ARG 31 34.315 8.116 8.557
252 H ARG 32 HN ARG 32 37.552 3.831 5.630
253 HA ARG 32 HA ARG 32 39.736 2.268 4.434
254 HB2 ARG 32 HB2 ARG 32 39.070 0.577 5.882
255 HB3 ARG 32 HB1 ARG 32 38.448 1.975 6.748
256 HG2 ARG 32 HG2 ARG 32 36.249 1.598 5.483
257 HG3 ARG 32 HG1 ARG 32 36.909 0.029 5.020
258 HD2 ARG 32 HD2 ARG 32 35.609 -0.309 7.019
259 HD3 ARG 32 HD1 ARG 32 37.308 -0.424 7.476
260 HE ARG 32 HE ARG 32 36.697 2.244 7.893
261 HH11 ARG 32 HH21 ARG 32 35.375 -0.799 8.831
262 HH12 ARG 32 HH22 ARG 32 34.770 -0.220 10.347
263 HH21 ARG 32 HH11 ARG 32 35.914 3.018 9.868
264 HH22 ARG 32 HH12 ARG 32 35.076 1.941 10.934
265 H VAL 33 HN VAL 33 39.445 0.721 2.745
266 HA VAL 33 HA VAL 33 36.752 0.578 1.459
267 HB VAL 33 HB VAL 33 39.293 1.393 0.004
268 HG11 VAL 33 HG11 VAL 33 37.690 1.463 -1.981
269 HG12 VAL 33 HG12 VAL 33 36.553 0.557 -0.985
270 HG13 VAL 33 HG13 VAL 33 38.110 -0.152 -1.410
271 HG21 VAL 33 HG21 VAL 33 37.687 3.311 -0.685
272 HG22 VAL 33 HG22 VAL 33 38.325 3.352 0.955
273 HG23 VAL 33 HG23 VAL 33 36.683 2.780 0.663
274 H GLU 34 HN GLU 34 36.392 -1.323 0.380
275 HA GLU 34 HA GLU 34 38.389 -3.475 0.882
276 HB2 GLU 34 HB2 GLU 34 35.873 -3.430 1.682
277 HB3 GLU 34 HB1 GLU 34 35.536 -3.960 0.035
278 HG2 GLU 34 HG2 GLU 34 37.251 -5.788 0.389
279 HG3 GLU 34 HG1 GLU 34 37.283 -5.324 2.090
280 H PHE 35 HN PHE 35 39.543 -4.235 -0.821
281 HA PHE 35 HA PHE 35 38.424 -3.928 -3.595
282 HB2 PHE 35 HB2 PHE 35 41.230 -3.824 -2.488
283 HB3 PHE 35 HB1 PHE 35 40.978 -4.299 -4.163
284 HD1 PHE 35 HD2 PHE 35 39.136 -2.679 -5.411
285 HD2 PHE 35 HD1 PHE 35 41.713 -1.571 -2.160
286 HE1 PHE 35 HE2 PHE 35 38.963 -0.299 -6.079
287 HE2 PHE 35 HE1 PHE 35 41.553 0.803 -2.831
288 HZ PHE 35 HZ PHE 35 40.170 1.444 -4.791
289 H THR 36 HN THR 36 38.440 -5.787 -4.920
290 HA THR 36 HA THR 36 39.044 -8.371 -3.522
291 HB THR 36 HB THR 36 37.539 -9.404 -5.160
292 HG1 THR 36 HG1 THR 36 38.122 -7.800 -6.811
293 HG21 THR 36 HG21 THR 36 36.129 -6.914 -4.219
294 HG22 THR 36 HG22 THR 36 36.670 -8.143 -3.074
295 HG23 THR 36 HG23 THR 36 35.505 -8.558 -4.332
296 H ALA 37 HN ALA 37 40.071 -10.100 -5.051
297 HA ALA 37 HA ALA 37 42.460 -9.138 -6.205
298 HB1 ALA 37 HB1 ALA 37 42.281 -11.495 -5.782
299 HB2 ALA 37 HB2 ALA 37 42.479 -11.308 -7.521
300 HB3 ALA 37 HB3 ALA 37 40.885 -11.640 -6.849
301 H THR 38 HN THR 38 39.316 -8.754 -7.416
302 HA THR 38 HA THR 38 39.794 -8.866 -10.232
303 HB THR 38 HB THR 38 37.772 -7.464 -10.441
304 HG1 THR 38 HG1 THR 38 36.976 -7.214 -7.991
305 HG21 THR 38 HG21 THR 38 37.779 -9.993 -9.657
306 HG22 THR 38 HG22 THR 38 36.279 -9.067 -9.642
307 HG23 THR 38 HG23 THR 38 37.176 -9.309 -8.146
308 H SER 39 HN SER 39 40.670 -6.509 -7.830
309 HA SER 39 HA SER 39 41.710 -4.715 -10.010
310 HB2 SER 39 HB2 SER 39 41.081 -2.786 -8.767
311 HB3 SER 39 HB1 SER 39 39.670 -3.839 -8.734
312 HG SER 39 HG SER 39 40.728 -2.826 -6.678
313 H VAL 40 HN VAL 40 43.413 -6.609 -9.117
314 HA VAL 40 HA VAL 40 44.921 -5.634 -6.786
315 HB VAL 40 HB VAL 40 44.825 -8.025 -7.102
316 HG11 VAL 40 HG11 VAL 40 46.207 -7.589 -9.786
317 HG12 VAL 40 HG12 VAL 40 44.490 -7.957 -9.610
318 HG13 VAL 40 HG13 VAL 40 45.702 -9.134 -9.104
319 HG21 VAL 40 HG21 VAL 40 47.167 -8.530 -6.926
320 HG22 VAL 40 HG22 VAL 40 46.997 -6.872 -6.338
321 HG23 VAL 40 HG23 VAL 40 47.605 -7.175 -7.965
322 H SER 41 HN SER 41 44.856 -4.827 -10.113
323 HA SER 41 HA SER 41 47.676 -4.232 -10.432
324 HB2 SER 41 HB2 SER 41 46.909 -2.972 -12.439
325 HB3 SER 41 HB1 SER 41 46.271 -4.612 -12.390
326 HG SER 41 HG SER 41 44.654 -2.935 -11.047
327 H ASP 42 HN ASP 42 44.789 -2.205 -9.827
328 HA ASP 42 HA ASP 42 46.102 0.293 -9.649
329 HB2 ASP 42 HB2 ASP 42 44.173 0.799 -7.956
330 HB3 ASP 42 HB1 ASP 42 43.748 0.378 -9.616
331 H LEU 43 HN LEU 43 45.916 -2.368 -7.263
332 HA LEU 43 HA LEU 43 46.904 -0.792 -5.063
333 HB2 LEU 43 HB2 LEU 43 45.741 -3.126 -5.044
334 HB3 LEU 43 HB1 LEU 43 47.341 -3.767 -5.387
335 HG LEU 43 HG LEU 43 48.219 -2.781 -3.307
336 HD11 LEU 43 HD11 LEU 43 47.080 -0.837 -2.750
337 HD12 LEU 43 HD12 LEU 43 46.198 -1.951 -1.716
338 HD13 LEU 43 HD13 LEU 43 45.519 -1.465 -3.269
339 HD21 LEU 43 HD21 LEU 43 47.107 -4.267 -1.790
340 HD22 LEU 43 HD22 LEU 43 47.017 -5.025 -3.381
341 HD23 LEU 43 HD23 LEU 43 45.610 -4.200 -2.716
342 H LYS 44 HN LYS 44 48.410 -2.654 -7.660
343 HA LYS 44 HA LYS 44 51.101 -2.517 -6.624
344 HB2 LYS 44 HB2 LYS 44 49.827 -3.124 -9.265
345 HB3 LYS 44 HB1 LYS 44 51.525 -2.656 -9.306
346 HG2 LYS 44 HG2 LYS 44 52.162 -4.469 -7.894
347 HG3 LYS 44 HG1 LYS 44 50.489 -4.809 -7.454
348 HD2 LYS 44 HD2 LYS 44 49.979 -5.657 -9.619
349 HD3 LYS 44 HD1 LYS 44 51.454 -4.985 -10.312
350 HE2 LYS 44 HE2 LYS 44 51.314 -7.213 -8.260
351 HE3 LYS 44 HE1 LYS 44 51.704 -7.403 -9.968
352 HZ1 LYS 44 HZ1 LYS 44 53.441 -5.510 -9.226
353 HZ2 LYS 44 HZ2 LYS 44 53.798 -7.170 -9.250
354 HZ3 LYS 44 HZ3 LYS 44 53.341 -6.418 -7.797
355 H LYS 45 HN LYS 45 49.307 -0.465 -8.942
356 HA LYS 45 HA LYS 45 51.409 1.385 -9.441
357 HB2 LYS 45 HB2 LYS 45 49.217 1.152 -10.686
358 HB3 LYS 45 HB1 LYS 45 48.455 2.016 -9.353
359 HG2 LYS 45 HG2 LYS 45 49.853 3.963 -9.726
360 HG3 LYS 45 HG1 LYS 45 50.809 3.099 -10.926
361 HD2 LYS 45 HD2 LYS 45 49.332 4.379 -12.240
362 HD3 LYS 45 HD1 LYS 45 48.562 2.796 -12.200
363 HE2 LYS 45 HE2 LYS 45 46.953 4.651 -11.774
364 HE3 LYS 45 HE1 LYS 45 47.059 3.535 -10.416
365 HZ1 LYS 45 HZ1 LYS 45 49.003 5.580 -10.180
366 HZ2 LYS 45 HZ2 LYS 45 47.753 5.163 -9.108
367 HZ3 LYS 45 HZ3 LYS 45 47.462 6.264 -10.369
368 H TYR 46 HN TYR 46 48.843 1.386 -6.977
369 HA TYR 46 HA TYR 46 49.428 3.916 -5.823
370 HB2 TYR 46 HB2 TYR 46 47.399 2.641 -5.297
371 HB3 TYR 46 HB1 TYR 46 48.368 1.385 -4.538
372 HD1 TYR 46 HD1 TYR 46 48.070 5.133 -4.370
373 HD2 TYR 46 HD2 TYR 46 48.420 1.438 -2.203
374 HE1 TYR 46 HE1 TYR 46 47.964 6.376 -2.229
375 HE2 TYR 46 HE2 TYR 46 48.314 2.681 -0.063
376 HH TYR 46 HH TYR 46 48.868 5.097 0.686
377 H ILE 47 HN ILE 47 50.567 0.664 -4.849
378 HA ILE 47 HA ILE 47 52.312 1.459 -2.777
379 HB ILE 47 HB ILE 47 52.644 -0.771 -4.804
380 HG12 ILE 47 HG12 ILE 47 51.707 -1.057 -1.946
381 HG13 ILE 47 HG11 ILE 47 50.564 -0.659 -3.228
382 HG21 ILE 47 HG21 ILE 47 54.068 -0.158 -2.209
383 HG22 ILE 47 HG22 ILE 47 54.779 -0.429 -3.801
384 HG23 ILE 47 HG23 ILE 47 54.052 -1.772 -2.920
385 HD11 ILE 47 HD11 ILE 47 52.453 -2.963 -3.639
386 HD12 ILE 47 HD12 ILE 47 50.843 -2.705 -4.304
387 HD13 ILE 47 HD13 ILE 47 51.031 -3.188 -2.618
388 H ALA 48 HN ALA 48 53.047 0.974 -6.236
389 HA ALA 48 HA ALA 48 55.746 1.728 -6.204
390 HB1 ALA 48 HB1 ALA 48 55.457 2.287 -8.587
391 HB2 ALA 48 HB2 ALA 48 53.705 2.284 -8.374
392 HB3 ALA 48 HB3 ALA 48 54.619 0.788 -8.183
393 H GLU 49 HN GLU 49 52.866 3.798 -6.260
394 HA GLU 49 HA GLU 49 54.207 6.243 -6.828
395 HB2 GLU 49 HB2 GLU 49 51.718 5.805 -6.911
396 HB3 GLU 49 HB1 GLU 49 51.712 5.883 -5.149
397 HG2 GLU 49 HG2 GLU 49 51.151 8.068 -5.898
398 HG3 GLU 49 HG1 GLU 49 52.832 8.152 -5.381
399 H LEU 50 HN LEU 50 53.871 4.374 -3.872
400 HA LEU 50 HA LEU 50 54.747 6.613 -2.173
401 HB2 LEU 50 HB2 LEU 50 54.590 3.684 -1.419
402 HB3 LEU 50 HB1 LEU 50 54.570 5.077 -0.339
403 HG LEU 50 HG LEU 50 52.432 4.324 -2.353
404 HD11 LEU 50 HD11 LEU 50 52.213 2.964 -0.408
405 HD12 LEU 50 HD12 LEU 50 51.061 4.280 -0.189
406 HD13 LEU 50 HD13 LEU 50 52.601 4.308 0.666
407 HD21 LEU 50 HD21 LEU 50 51.240 6.299 -1.132
408 HD22 LEU 50 HD22 LEU 50 52.427 6.686 -2.375
409 HD23 LEU 50 HD23 LEU 50 52.869 6.797 -0.671
410 H GLU 51 HN GLU 51 56.214 3.787 -3.718
411 HA GLU 51 HA GLU 51 58.691 3.882 -2.271
412 HB2 GLU 51 HB2 GLU 51 58.032 2.869 -5.050
413 HB3 GLU 51 HB1 GLU 51 59.606 2.660 -4.283
414 HG2 GLU 51 HG2 GLU 51 58.685 1.329 -2.527
415 HG3 GLU 51 HG1 GLU 51 57.033 1.761 -2.973
416 H VAL 52 HN VAL 52 57.459 5.681 -5.035
417 HA VAL 52 HA VAL 52 60.082 6.870 -5.622
418 HB VAL 52 HB VAL 52 57.344 7.677 -6.654
419 HG11 VAL 52 HG11 VAL 52 60.189 8.238 -7.525
420 HG12 VAL 52 HG12 VAL 52 58.940 9.407 -7.100
421 HG13 VAL 52 HG13 VAL 52 58.807 8.477 -8.593
422 HG21 VAL 52 HG21 VAL 52 57.848 6.249 -8.583
423 HG22 VAL 52 HG22 VAL 52 57.880 5.282 -7.110
424 HG23 VAL 52 HG23 VAL 52 59.391 5.788 -7.864
425 H GLN 53 HN GLN 53 57.193 7.686 -3.776
426 HA GLN 53 HA GLN 53 57.966 10.483 -3.434
427 HB2 GLN 53 HB2 GLN 53 55.883 8.718 -2.131
428 HB3 GLN 53 HB1 GLN 53 56.148 10.390 -1.636
429 HG2 GLN 53 HG2 GLN 53 55.667 11.178 -3.894
430 HG3 GLN 53 HG1 GLN 53 55.512 9.518 -4.470
431 HE21 GLN 53 HE21 GLN 53 53.840 8.203 -2.928
432 HE22 GLN 53 HE22 GLN 53 52.382 9.023 -2.638
433 H THR 54 HN THR 54 58.302 7.476 -1.600
434 HA THR 54 HA THR 54 59.554 8.901 0.665
435 HB THR 54 HB THR 54 59.458 5.900 0.350
436 HG1 THR 54 HG1 THR 54 57.386 6.057 0.216
437 HG21 THR 54 HG21 THR 54 59.080 7.712 2.749
438 HG22 THR 54 HG22 THR 54 60.623 6.990 2.288
439 HG23 THR 54 HG23 THR 54 59.274 5.959 2.768
440 H GLY 55 HN GLY 55 60.843 8.933 -2.012
441 HA2 GLY 55 HA2 GLY 55 63.534 8.542 -1.219
442 HA3 GLY 55 HA1 GLY 55 63.029 7.133 -2.150
443 H MET 56 HN MET 56 63.529 10.620 -2.290
444 HA MET 56 HA MET 56 63.086 10.615 -5.234
445 HB2 MET 56 HB2 MET 56 63.517 12.794 -3.181
446 HB3 MET 56 HB1 MET 56 63.572 13.120 -4.914
447 HG2 MET 56 HG2 MET 56 61.294 12.126 -5.135
448 HG3 MET 56 HG1 MET 56 61.238 11.932 -3.384
449 HE1 MET 56 HE1 MET 56 58.779 14.855 -4.074
450 HE2 MET 56 HE2 MET 56 58.995 13.203 -3.500
451 HE3 MET 56 HE3 MET 56 59.135 13.555 -5.220
452 H THR 57 HN THR 57 64.775 10.629 -6.653
453 HA THR 57 HA THR 57 66.982 10.558 -7.432
454 HB THR 57 HB THR 57 67.726 12.299 -5.077
455 HG1 THR 57 HG1 THR 57 66.571 13.217 -7.485
456 HG21 THR 57 HG21 THR 57 68.609 12.145 -7.972
457 HG22 THR 57 HG22 THR 57 69.546 11.660 -6.559
458 HG23 THR 57 HG23 THR 57 69.165 13.361 -6.824
459 H GLN 58 HN GLN 58 66.007 9.167 -4.629
460 HA GLN 58 HA GLN 58 68.479 8.435 -3.363
461 HB2 GLN 58 HB2 GLN 58 66.183 8.173 -2.350
462 HB3 GLN 58 HB1 GLN 58 65.916 6.814 -3.444
463 HG2 GLN 58 HG2 GLN 58 67.788 5.602 -2.485
464 HG3 GLN 58 HG1 GLN 58 68.226 6.990 -1.489
465 HE21 GLN 58 HE21 GLN 58 65.652 4.547 -1.974
466 HE22 GLN 58 HE22 GLN 58 65.021 4.669 -0.403
467 H ARG 59 HN ARG 59 70.063 7.266 -4.272
468 HA ARG 59 HA ARG 59 69.621 5.712 -6.683
469 HB2 ARG 59 HB2 ARG 59 71.784 6.976 -5.648
470 HB3 ARG 59 HB1 ARG 59 72.131 5.345 -5.085
471 HG2 ARG 59 HG2 ARG 59 71.570 6.136 -7.964
472 HG3 ARG 59 HG1 ARG 59 73.158 5.762 -7.293
473 HD2 ARG 59 HD2 ARG 59 72.249 3.489 -6.654
474 HD3 ARG 59 HD1 ARG 59 70.802 3.883 -7.584
475 HE ARG 59 HE ARG 59 72.872 4.346 -9.363
476 HH11 ARG 59 HH21 ARG 59 71.860 1.754 -7.327
477 HH12 ARG 59 HH22 ARG 59 72.469 0.518 -8.376
478 HH21 ARG 59 HH11 ARG 59 73.671 2.747 -10.744
479 HH22 ARG 59 HH12 ARG 59 73.494 1.080 -10.310
480 H ARG 60 HN ARG 60 70.357 4.912 -3.283
481 HA ARG 60 HA ARG 60 70.261 2.051 -3.723
482 HB2 ARG 60 HB2 ARG 60 69.876 3.587 -1.135
483 HB3 ARG 60 HB1 ARG 60 70.299 1.881 -1.289
484 HG2 ARG 60 HG2 ARG 60 72.414 2.454 -2.351
485 HG3 ARG 60 HG1 ARG 60 71.985 4.166 -2.351
486 HD2 ARG 60 HD2 ARG 60 71.884 4.119 0.131
487 HD3 ARG 60 HD1 ARG 60 72.391 2.429 0.101
488 HE ARG 60 HE ARG 60 74.361 3.724 -1.347
489 HH11 ARG 60 HH21 ARG 60 72.878 4.105 1.743
490 HH12 ARG 60 HH22 ARG 60 74.299 4.756 2.491
491 HH21 ARG 60 HH11 ARG 60 76.222 4.572 -0.388
492 HH22 ARG 60 HH12 ARG 60 76.191 5.021 1.285
493 H ARG 61 HN ARG 61 68.500 1.516 -1.391
494 HA ARG 61 HA ARG 61 65.817 2.305 -2.429
495 HB2 ARG 61 HB2 ARG 61 66.779 -0.539 -1.982
496 HB3 ARG 61 HB1 ARG 61 65.083 -0.098 -2.179
497 HG2 ARG 61 HG2 ARG 61 67.262 0.495 -4.202
498 HG3 ARG 61 HG1 ARG 61 66.149 -0.865 -4.310
499 HD2 ARG 61 HD2 ARG 61 64.398 1.243 -3.963
500 HD3 ARG 61 HD1 ARG 61 65.672 1.999 -4.912
501 HE ARG 61 HE ARG 61 63.690 0.317 -5.970
502 HH11 ARG 61 HH21 ARG 61 67.142 0.453 -5.900
503 HH12 ARG 61 HH22 ARG 61 67.333 -0.536 -7.304
504 HH21 ARG 61 HH11 ARG 61 63.933 -0.951 -7.806
505 HH22 ARG 61 HH12 ARG 61 65.521 -1.324 -8.386
506 H GLY 62 HN GLY 62 66.946 3.380 -0.170
507 HA2 GLY 62 HA2 GLY 62 66.491 1.910 2.244
508 HA3 GLY 62 HA1 GLY 62 66.583 3.667 2.131
Start of MODEL 15
1 H1 MET 1 HT1 MET 1 57.254 8.327 12.355
2 H2 MET 1 HT2 MET 1 56.904 9.975 12.138
3 H3 MET 1 HT3 MET 1 58.443 9.373 11.745
4 HA MET 1 HA MET 1 56.868 9.809 9.825
5 HB2 MET 1 HB2 MET 1 57.551 7.615 8.737
6 HB3 MET 1 HB1 MET 1 58.872 8.535 9.456
7 HG2 MET 1 HG2 MET 1 58.899 7.130 11.407
8 HG3 MET 1 HG1 MET 1 57.399 6.335 10.926
9 HE1 MET 1 HE1 MET 1 60.850 7.303 10.081
10 HE2 MET 1 HE2 MET 1 60.493 7.186 8.359
11 HE3 MET 1 HE3 MET 1 61.561 6.005 9.112
12 H VAL 2 HN VAL 2 55.333 8.399 8.462
13 HA VAL 2 HA VAL 2 53.549 6.659 10.073
14 HB VAL 2 HB VAL 2 52.517 9.094 8.584
15 HG11 VAL 2 HG11 VAL 2 50.390 8.447 9.776
16 HG12 VAL 2 HG12 VAL 2 51.189 6.954 10.272
17 HG13 VAL 2 HG13 VAL 2 50.915 7.282 8.560
18 HG21 VAL 2 HG21 VAL 2 51.881 9.829 10.931
19 HG22 VAL 2 HG22 VAL 2 53.610 9.861 10.588
20 HG23 VAL 2 HG23 VAL 2 52.925 8.543 11.536
21 H ARG 3 HN ARG 3 54.327 8.127 6.934
22 HA ARG 3 HA ARG 3 52.698 6.483 5.296
23 HB2 ARG 3 HB2 ARG 3 55.469 7.553 4.673
24 HB3 ARG 3 HB1 ARG 3 54.276 7.014 3.490
25 HG2 ARG 3 HG2 ARG 3 52.755 8.789 4.116
26 HG3 ARG 3 HG1 ARG 3 53.790 9.261 5.465
27 HD2 ARG 3 HD2 ARG 3 54.685 9.314 2.570
28 HD3 ARG 3 HD1 ARG 3 54.036 10.719 3.419
29 HE ARG 3 HE ARG 3 56.083 9.839 5.066
30 HH11 ARG 3 HH21 ARG 3 55.728 10.663 1.737
31 HH12 ARG 3 HH22 ARG 3 57.355 11.232 1.568
32 HH21 ARG 3 HH11 ARG 3 58.210 10.576 4.863
33 HH22 ARG 3 HH12 ARG 3 58.760 11.183 3.336
34 H GLN 4 HN GLN 4 55.747 5.829 6.910
35 HA GLN 4 HA GLN 4 56.471 3.473 5.457
36 HB2 GLN 4 HB2 GLN 4 57.894 4.786 7.131
37 HB3 GLN 4 HB1 GLN 4 57.009 3.931 8.396
38 HG2 GLN 4 HG2 GLN 4 57.686 1.766 7.358
39 HG3 GLN 4 HG1 GLN 4 58.653 2.663 6.187
40 HE21 GLN 4 HE21 GLN 4 58.281 2.226 9.743
41 HE22 GLN 4 HE22 GLN 4 59.916 2.512 10.099
42 H GLU 5 HN GLU 5 54.377 4.005 8.267
43 HA GLU 5 HA GLU 5 53.917 1.180 8.749
44 HB2 GLU 5 HB2 GLU 5 52.573 3.722 9.679
45 HB3 GLU 5 HB1 GLU 5 51.921 2.137 10.095
46 HG2 GLU 5 HG2 GLU 5 54.049 1.507 11.139
47 HG3 GLU 5 HG1 GLU 5 54.753 3.057 10.679
48 H GLU 6 HN GLU 6 51.954 3.761 7.214
49 HA GLU 6 HA GLU 6 49.749 2.127 6.537
50 HB2 GLU 6 HB2 GLU 6 50.890 4.607 5.219
51 HB3 GLU 6 HB1 GLU 6 49.449 3.800 4.597
52 HG2 GLU 6 HG2 GLU 6 48.327 4.072 6.750
53 HG3 GLU 6 HG1 GLU 6 49.781 4.791 7.443
54 H LEU 7 HN LEU 7 52.969 2.111 5.253
55 HA LEU 7 HA LEU 7 52.231 0.896 2.704
56 HB2 LEU 7 HB2 LEU 7 54.424 2.223 3.439
57 HB3 LEU 7 HB1 LEU 7 54.983 0.620 3.898
58 HG LEU 7 HG LEU 7 53.911 1.347 1.151
59 HD11 LEU 7 HD11 LEU 7 56.228 1.291 0.414
60 HD12 LEU 7 HD12 LEU 7 56.769 0.859 2.037
61 HD13 LEU 7 HD13 LEU 7 56.080 2.454 1.732
62 HD21 LEU 7 HD21 LEU 7 53.585 -0.981 1.471
63 HD22 LEU 7 HD22 LEU 7 55.086 -1.156 2.378
64 HD23 LEU 7 HD23 LEU 7 55.134 -0.880 0.637
65 H ALA 8 HN ALA 8 53.697 -0.273 5.744
66 HA ALA 8 HA ALA 8 53.890 -3.003 5.048
67 HB1 ALA 8 HB1 ALA 8 53.801 -3.452 7.487
68 HB2 ALA 8 HB2 ALA 8 53.259 -1.796 7.761
69 HB3 ALA 8 HB3 ALA 8 54.870 -2.101 7.111
70 H ALA 9 HN ALA 9 51.085 -1.089 5.822
71 HA ALA 9 HA ALA 9 49.348 -3.332 6.460
72 HB1 ALA 9 HB1 ALA 9 47.524 -1.567 6.046
73 HB2 ALA 9 HB2 ALA 9 48.845 -0.428 5.783
74 HB3 ALA 9 HB3 ALA 9 48.668 -1.225 7.345
75 H ALA 10 HN ALA 10 49.553 -1.138 3.624
76 HA ALA 10 HA ALA 10 47.736 -2.641 2.031
77 HB1 ALA 10 HB1 ALA 10 49.927 -0.677 1.403
78 HB2 ALA 10 HB2 ALA 10 48.189 -0.507 1.172
79 HB3 ALA 10 HB3 ALA 10 49.124 -1.538 0.089
80 H ARG 11 HN ARG 11 51.131 -3.027 2.746
81 HA ARG 11 HA ARG 11 51.720 -4.928 0.656
82 HB2 ARG 11 HB2 ARG 11 53.273 -3.551 2.339
83 HB3 ARG 11 HB1 ARG 11 53.110 -4.990 3.338
84 HG2 ARG 11 HG2 ARG 11 54.916 -5.726 2.123
85 HG3 ARG 11 HG1 ARG 11 53.695 -6.152 0.927
86 HD2 ARG 11 HD2 ARG 11 53.991 -3.867 -0.079
87 HD3 ARG 11 HD1 ARG 11 55.333 -3.608 1.036
88 HE ARG 11 HE ARG 11 55.972 -5.993 -0.223
89 HH11 ARG 11 HH21 ARG 11 55.095 -2.807 -1.207
90 HH12 ARG 11 HH22 ARG 11 56.024 -2.859 -2.667
91 HH21 ARG 11 HH11 ARG 11 57.190 -6.080 -2.124
92 HH22 ARG 11 HH12 ARG 11 57.210 -4.712 -3.187
93 H ALA 12 HN ALA 12 50.927 -5.292 4.174
94 HA ALA 12 HA ALA 12 50.915 -8.103 4.257
95 HB1 ALA 12 HB1 ALA 12 49.362 -7.889 6.167
96 HB2 ALA 12 HB2 ALA 12 49.055 -6.212 5.719
97 HB3 ALA 12 HB3 ALA 12 50.657 -6.696 6.272
98 H ALA 13 HN ALA 13 48.869 -5.979 2.649
99 HA ALA 13 HA ALA 13 46.583 -7.779 2.440
100 HB1 ALA 13 HB1 ALA 13 46.607 -5.176 2.264
101 HB2 ALA 13 HB2 ALA 13 45.546 -6.086 1.191
102 HB3 ALA 13 HB3 ALA 13 47.079 -5.453 0.589
103 H LEU 14 HN LEU 14 49.398 -6.927 0.409
104 HA LEU 14 HA LEU 14 48.488 -8.338 -1.890
105 HB2 LEU 14 HB2 LEU 14 50.899 -6.992 -1.173
106 HB3 LEU 14 HB1 LEU 14 51.369 -8.572 -1.763
107 HG LEU 14 HG LEU 14 49.477 -6.738 -3.271
108 HD11 LEU 14 HD11 LEU 14 52.430 -7.145 -3.784
109 HD12 LEU 14 HD12 LEU 14 51.780 -5.751 -2.923
110 HD13 LEU 14 HD13 LEU 14 51.341 -6.028 -4.604
111 HD21 LEU 14 HD21 LEU 14 49.711 -8.253 -5.049
112 HD22 LEU 14 HD22 LEU 14 49.628 -9.321 -3.650
113 HD23 LEU 14 HD23 LEU 14 51.187 -8.957 -4.385
114 H HIS 15 HN HIS 15 50.061 -9.451 1.053
115 HA HIS 15 HA HIS 15 50.564 -12.127 0.012
116 HB2 HIS 15 HB2 HIS 15 51.858 -11.136 1.904
117 HB3 HIS 15 HB1 HIS 15 50.398 -11.189 2.892
118 HD1 HIS 15 HD1 HIS 15 52.811 -13.492 1.092
119 HD2 HIS 15 HD2 HIS 15 49.813 -13.701 3.981
120 HE1 HIS 15 HE1 HIS 15 52.879 -15.845 2.025
121 H ASP 16 HN ASP 16 47.982 -10.533 1.796
122 HA ASP 16 HA ASP 16 46.548 -12.991 2.383
123 HB2 ASP 16 HB2 ASP 16 45.518 -10.147 2.365
124 HB3 ASP 16 HB1 ASP 16 44.791 -11.524 3.188
125 H LEU 17 HN LEU 17 46.836 -11.033 -0.436
126 HA LEU 17 HA LEU 17 44.192 -11.883 -1.486
127 HB2 LEU 17 HB2 LEU 17 46.354 -10.102 -2.647
128 HB3 LEU 17 HB1 LEU 17 44.857 -10.493 -3.475
129 HG LEU 17 HG LEU 17 44.871 -9.306 -0.694
130 HD11 LEU 17 HD11 LEU 17 45.049 -7.918 -3.371
131 HD12 LEU 17 HD12 LEU 17 46.049 -7.666 -1.943
132 HD13 LEU 17 HD13 LEU 17 44.375 -7.116 -1.954
133 HD21 LEU 17 HD21 LEU 17 42.613 -8.433 -1.638
134 HD22 LEU 17 HD22 LEU 17 42.715 -10.139 -1.218
135 HD23 LEU 17 HD23 LEU 17 42.831 -9.638 -2.902
136 H MET 18 HN MET 18 47.576 -12.748 -1.789
137 HA MET 18 HA MET 18 47.033 -14.365 -4.216
138 HB2 MET 18 HB2 MET 18 49.461 -13.435 -2.744
139 HB3 MET 18 HB1 MET 18 49.606 -14.987 -3.565
140 HG2 MET 18 HG2 MET 18 49.257 -14.051 -5.682
141 HG3 MET 18 HG1 MET 18 48.434 -12.633 -5.035
142 HE1 MET 18 HE1 MET 18 49.943 -11.747 -7.006
143 HE2 MET 18 HE2 MET 18 51.155 -13.015 -7.174
144 HE3 MET 18 HE3 MET 18 51.663 -11.359 -6.854
145 H THR 19 HN THR 19 46.701 -14.772 -0.889
146 HA THR 19 HA THR 19 47.463 -17.633 -0.895
147 HB THR 19 HB THR 19 46.431 -17.419 1.513
148 HG1 THR 19 HG1 THR 19 46.992 -14.704 1.007
149 HG21 THR 19 HG21 THR 19 48.917 -15.861 0.743
150 HG22 THR 19 HG22 THR 19 48.848 -17.603 1.003
151 HG23 THR 19 HG23 THR 19 48.549 -16.500 2.345
152 H GLY 20 HN GLY 20 44.789 -15.856 -1.865
153 HA2 GLY 20 HA2 GLY 20 43.017 -17.378 -2.890
154 HA3 GLY 20 HA1 GLY 20 42.915 -18.145 -1.309
155 H LYS 21 HN LYS 21 42.880 -15.991 0.418
156 HA LYS 21 HA LYS 21 40.199 -15.146 0.352
157 HB2 LYS 21 HB2 LYS 21 42.503 -13.615 1.597
158 HB3 LYS 21 HB1 LYS 21 40.802 -13.519 2.057
159 HG2 LYS 21 HG2 LYS 21 41.011 -16.103 2.438
160 HG3 LYS 21 HG1 LYS 21 42.746 -15.789 2.474
161 HD2 LYS 21 HD2 LYS 21 42.402 -14.132 4.280
162 HD3 LYS 21 HD1 LYS 21 40.672 -14.471 4.252
163 HE2 LYS 21 HE2 LYS 21 41.083 -16.799 4.873
164 HE3 LYS 21 HE1 LYS 21 42.825 -16.530 4.812
165 HZ1 LYS 21 HZ1 LYS 21 42.706 -15.052 6.634
166 HZ2 LYS 21 HZ2 LYS 21 41.802 -16.422 7.075
167 HZ3 LYS 21 HZ3 LYS 21 41.011 -15.000 6.588
168 H ARG 22 HN ARG 22 39.331 -14.072 -1.350
169 HA ARG 22 HA ARG 22 40.875 -12.253 -2.972
170 HB2 ARG 22 HB2 ARG 22 39.039 -13.751 -3.818
171 HB3 ARG 22 HB1 ARG 22 37.886 -12.721 -2.971
172 HG2 ARG 22 HG2 ARG 22 38.857 -10.766 -4.263
173 HG3 ARG 22 HG1 ARG 22 39.728 -11.947 -5.238
174 HD2 ARG 22 HD2 ARG 22 36.751 -11.533 -5.009
175 HD3 ARG 22 HD1 ARG 22 37.746 -11.563 -6.464
176 HE ARG 22 HE ARG 22 38.051 -14.104 -5.407
177 HH11 ARG 22 HH21 ARG 22 35.416 -12.047 -6.246
178 HH12 ARG 22 HH22 ARG 22 34.356 -13.353 -6.666
179 HH21 ARG 22 HH11 ARG 22 36.685 -15.821 -5.952
180 HH22 ARG 22 HH12 ARG 22 35.075 -15.488 -6.499
181 H VAL 23 HN VAL 23 38.154 -11.881 -0.679
182 HA VAL 23 HA VAL 23 38.234 -8.948 -0.962
183 HB VAL 23 HB VAL 23 36.806 -10.609 1.139
184 HG11 VAL 23 HG11 VAL 23 37.003 -8.169 1.582
185 HG12 VAL 23 HG12 VAL 23 35.333 -8.645 1.269
186 HG13 VAL 23 HG13 VAL 23 36.272 -7.841 0.011
187 HG21 VAL 23 HG21 VAL 23 34.835 -10.276 -0.458
188 HG22 VAL 23 HG22 VAL 23 36.059 -11.431 -0.989
189 HG23 VAL 23 HG23 VAL 23 36.020 -9.806 -1.676
190 H ALA 24 HN ALA 24 39.336 -7.551 0.291
191 HA ALA 24 HA ALA 24 40.498 -8.457 2.888
192 HB1 ALA 24 HB1 ALA 24 42.088 -7.116 0.679
193 HB2 ALA 24 HB2 ALA 24 42.260 -8.796 1.183
194 HB3 ALA 24 HB3 ALA 24 42.686 -7.495 2.293
195 H THR 25 HN THR 25 40.970 -6.646 4.305
196 HA THR 25 HA THR 25 39.462 -4.158 3.538
197 HB THR 25 HB THR 25 40.408 -4.977 6.298
198 HG1 THR 25 HG1 THR 25 38.948 -6.465 6.114
199 HG21 THR 25 HG21 THR 25 39.771 -2.586 5.824
200 HG22 THR 25 HG22 THR 25 38.780 -3.372 7.053
201 HG23 THR 25 HG23 THR 25 38.154 -3.162 5.417
202 H VAL 26 HN VAL 26 40.456 -2.102 3.832
203 HA VAL 26 HA VAL 26 43.339 -2.054 4.560
204 HB VAL 26 HB VAL 26 42.403 -0.574 2.107
205 HG11 VAL 26 HG11 VAL 26 45.096 -1.806 2.690
206 HG12 VAL 26 HG12 VAL 26 44.652 -0.210 3.294
207 HG13 VAL 26 HG13 VAL 26 44.703 -0.512 1.557
208 HG21 VAL 26 HG21 VAL 26 43.343 -2.556 0.806
209 HG22 VAL 26 HG22 VAL 26 41.763 -2.798 1.552
210 HG23 VAL 26 HG23 VAL 26 43.208 -3.479 2.301
211 H GLN 27 HN GLN 27 43.628 -0.439 5.976
212 HA GLN 27 HA GLN 27 41.555 1.639 6.284
213 HB2 GLN 27 HB2 GLN 27 44.028 0.866 7.841
214 HB3 GLN 27 HB1 GLN 27 43.157 2.361 8.186
215 HG2 GLN 27 HG2 GLN 27 42.335 0.581 9.647
216 HG3 GLN 27 HG1 GLN 27 41.072 1.038 8.502
217 HE21 GLN 27 HE21 GLN 27 40.024 -1.036 8.414
218 HE22 GLN 27 HE22 GLN 27 40.779 -2.413 7.770
219 H LYS 28 HN LYS 28 41.702 3.435 5.039
220 HA LYS 28 HA LYS 28 44.412 4.395 4.201
221 HB2 LYS 28 HB2 LYS 28 42.686 3.763 2.405
222 HB3 LYS 28 HB1 LYS 28 41.773 5.179 2.934
223 HG2 LYS 28 HG2 LYS 28 43.719 6.615 2.484
224 HG3 LYS 28 HG1 LYS 28 44.650 5.206 1.976
225 HD2 LYS 28 HD2 LYS 28 43.065 4.789 0.149
226 HD3 LYS 28 HD1 LYS 28 42.083 6.158 0.671
227 HE2 LYS 28 HE2 LYS 28 43.938 7.694 0.230
228 HE3 LYS 28 HE1 LYS 28 44.976 6.341 -0.221
229 HZ1 LYS 28 HZ1 LYS 28 42.567 7.336 -1.623
230 HZ2 LYS 28 HZ2 LYS 28 43.241 5.810 -1.945
231 HZ3 LYS 28 HZ3 LYS 28 44.150 7.218 -2.219
232 H ASP 29 HN ASP 29 44.884 6.650 4.628
233 HA ASP 29 HA ASP 29 43.736 7.825 6.918
234 HB2 ASP 29 HB2 ASP 29 45.935 8.475 5.938
235 HB3 ASP 29 HB1 ASP 29 45.081 9.268 4.614
236 H GLY 30 HN GLY 30 41.415 7.630 6.565
237 HA2 GLY 30 HA2 GLY 30 39.924 9.820 6.084
238 HA3 GLY 30 HA1 GLY 30 40.215 9.284 4.428
239 H ARG 31 HN ARG 31 40.069 6.515 4.698
240 HA ARG 31 HA ARG 31 37.793 5.651 6.231
241 HB2 ARG 31 HB2 ARG 31 37.142 7.134 3.915
242 HB3 ARG 31 HB1 ARG 31 36.882 5.461 3.442
243 HG2 ARG 31 HG2 ARG 31 35.729 6.702 5.963
244 HG3 ARG 31 HG1 ARG 31 34.855 6.576 4.437
245 HD2 ARG 31 HD2 ARG 31 35.317 4.076 4.510
246 HD3 ARG 31 HD1 ARG 31 35.876 4.313 6.166
247 HE ARG 31 HE ARG 31 33.379 5.501 6.147
248 HH11 ARG 31 HH21 ARG 31 34.694 2.448 5.233
249 HH12 ARG 31 HH22 ARG 31 33.251 1.566 5.607
250 HH21 ARG 31 HH11 ARG 31 31.488 4.366 6.641
251 HH22 ARG 31 HH12 ARG 31 31.436 2.651 6.403
252 H ARG 32 HN ARG 32 37.462 3.444 6.054
253 HA ARG 32 HA ARG 32 39.699 1.947 4.894
254 HB2 ARG 32 HB2 ARG 32 39.066 0.248 6.321
255 HB3 ARG 32 HB1 ARG 32 38.239 1.569 7.130
256 HG2 ARG 32 HG2 ARG 32 36.199 0.994 5.690
257 HG3 ARG 32 HG1 ARG 32 37.056 -0.462 5.217
258 HD2 ARG 32 HD2 ARG 32 36.470 -1.504 7.146
259 HD3 ARG 32 HD1 ARG 32 37.137 -0.207 8.123
260 HE ARG 32 HE ARG 32 34.375 -0.749 7.738
261 HH11 ARG 32 HH21 ARG 32 36.539 1.933 7.501
262 HH12 ARG 32 HH22 ARG 32 35.297 3.113 7.746
263 HH21 ARG 32 HH11 ARG 32 32.762 0.776 8.057
264 HH22 ARG 32 HH12 ARG 32 33.164 2.460 8.059
265 H VAL 33 HN VAL 33 39.522 0.417 3.164
266 HA VAL 33 HA VAL 33 36.906 0.289 1.727
267 HB VAL 33 HB VAL 33 39.508 1.118 0.397
268 HG11 VAL 33 HG11 VAL 33 38.273 -0.322 -1.091
269 HG12 VAL 33 HG12 VAL 33 37.955 1.333 -1.610
270 HG13 VAL 33 HG13 VAL 33 36.748 0.457 -0.673
271 HG21 VAL 33 HG21 VAL 33 37.963 3.126 -0.233
272 HG22 VAL 33 HG22 VAL 33 38.610 3.084 1.404
273 HG23 VAL 33 HG23 VAL 33 36.947 2.579 1.100
274 H GLU 34 HN GLU 34 36.631 -1.561 0.528
275 HA GLU 34 HA GLU 34 38.681 -3.693 0.984
276 HB2 GLU 34 HB2 GLU 34 35.671 -3.690 0.827
277 HB3 GLU 34 HB1 GLU 34 36.556 -5.182 0.509
278 HG2 GLU 34 HG2 GLU 34 37.528 -5.183 2.691
279 HG3 GLU 34 HG1 GLU 34 37.021 -3.521 2.996
280 H PHE 35 HN PHE 35 39.940 -3.799 -0.887
281 HA PHE 35 HA PHE 35 38.580 -3.673 -3.539
282 HB2 PHE 35 HB2 PHE 35 41.471 -3.696 -2.640
283 HB3 PHE 35 HB1 PHE 35 41.044 -4.003 -4.319
284 HD1 PHE 35 HD2 PHE 35 39.302 -2.234 -5.350
285 HD2 PHE 35 HD1 PHE 35 41.918 -1.492 -2.034
286 HE1 PHE 35 HE2 PHE 35 39.161 0.207 -5.776
287 HE2 PHE 35 HE1 PHE 35 41.795 0.933 -2.451
288 HZ PHE 35 HZ PHE 35 40.408 1.794 -4.330
289 H THR 36 HN THR 36 38.436 -5.523 -4.866
290 HA THR 36 HA THR 36 39.093 -8.127 -3.547
291 HB THR 36 HB THR 36 37.568 -9.109 -5.236
292 HG1 THR 36 HG1 THR 36 37.925 -7.684 -6.926
293 HG21 THR 36 HG21 THR 36 36.753 -7.991 -3.056
294 HG22 THR 36 HG22 THR 36 35.555 -8.322 -4.307
295 HG23 THR 36 HG23 THR 36 36.182 -6.688 -4.101
296 H ALA 37 HN ALA 37 40.123 -9.842 -5.088
297 HA ALA 37 HA ALA 37 42.492 -8.835 -6.262
298 HB1 ALA 37 HB1 ALA 37 42.163 -11.230 -5.725
299 HB2 ALA 37 HB2 ALA 37 42.731 -11.006 -7.375
300 HB3 ALA 37 HB3 ALA 37 41.033 -11.367 -7.071
301 H THR 38 HN THR 38 39.333 -8.577 -7.472
302 HA THR 38 HA THR 38 39.703 -8.762 -10.270
303 HB THR 38 HB THR 38 37.775 -7.189 -10.437
304 HG1 THR 38 HG1 THR 38 37.016 -6.215 -8.636
305 HG21 THR 38 HG21 THR 38 37.153 -9.038 -8.150
306 HG22 THR 38 HG22 THR 38 37.640 -9.721 -9.702
307 HG23 THR 38 HG23 THR 38 36.206 -8.701 -9.598
308 H SER 39 HN SER 39 40.691 -6.284 -8.007
309 HA SER 39 HA SER 39 41.880 -4.731 -10.292
310 HB2 SER 39 HB2 SER 39 41.269 -2.678 -9.289
311 HB3 SER 39 HB1 SER 39 39.824 -3.674 -9.139
312 HG SER 39 HG SER 39 40.039 -3.152 -7.101
313 H VAL 40 HN VAL 40 43.465 -6.601 -9.181
314 HA VAL 40 HA VAL 40 44.896 -5.551 -6.851
315 HB VAL 40 HB VAL 40 44.796 -7.950 -7.082
316 HG11 VAL 40 HG11 VAL 40 44.538 -7.973 -9.598
317 HG12 VAL 40 HG12 VAL 40 45.725 -9.140 -9.015
318 HG13 VAL 40 HG13 VAL 40 46.263 -7.627 -9.737
319 HG21 VAL 40 HG21 VAL 40 47.613 -7.165 -7.887
320 HG22 VAL 40 HG22 VAL 40 47.126 -8.482 -6.822
321 HG23 VAL 40 HG23 VAL 40 46.961 -6.806 -6.289
322 H SER 41 HN SER 41 44.983 -4.845 -10.189
323 HA SER 41 HA SER 41 47.821 -4.305 -10.419
324 HB2 SER 41 HB2 SER 41 46.839 -4.555 -12.514
325 HB3 SER 41 HB1 SER 41 45.376 -3.694 -12.043
326 HG SER 41 HG SER 41 46.527 -2.311 -13.313
327 H ASP 42 HN ASP 42 44.951 -2.255 -9.825
328 HA ASP 42 HA ASP 42 46.276 0.245 -9.711
329 HB2 ASP 42 HB2 ASP 42 44.401 1.012 -8.356
330 HB3 ASP 42 HB1 ASP 42 43.789 -0.085 -9.592
331 H LEU 43 HN LEU 43 46.020 -2.345 -7.245
332 HA LEU 43 HA LEU 43 47.108 -0.805 -5.097
333 HB2 LEU 43 HB2 LEU 43 45.952 -3.155 -5.098
334 HB3 LEU 43 HB1 LEU 43 47.569 -3.773 -5.414
335 HG LEU 43 HG LEU 43 48.394 -2.704 -3.337
336 HD11 LEU 43 HD11 LEU 43 45.640 -1.522 -3.359
337 HD12 LEU 43 HD12 LEU 43 47.153 -0.835 -2.777
338 HD13 LEU 43 HD13 LEU 43 46.281 -1.995 -1.786
339 HD21 LEU 43 HD21 LEU 43 47.373 -4.261 -1.834
340 HD22 LEU 43 HD22 LEU 43 47.312 -5.018 -3.424
341 HD23 LEU 43 HD23 LEU 43 45.868 -4.267 -2.749
342 H LYS 44 HN LYS 44 48.601 -2.759 -7.658
343 HA LYS 44 HA LYS 44 51.291 -2.568 -6.657
344 HB2 LYS 44 HB2 LYS 44 50.025 -3.195 -9.306
345 HB3 LYS 44 HB1 LYS 44 51.744 -2.806 -9.299
346 HG2 LYS 44 HG2 LYS 44 52.260 -4.623 -7.854
347 HG3 LYS 44 HG1 LYS 44 50.569 -4.866 -7.425
348 HD2 LYS 44 HD2 LYS 44 50.038 -5.738 -9.577
349 HD3 LYS 44 HD1 LYS 44 51.559 -5.164 -10.265
350 HE2 LYS 44 HE2 LYS 44 51.427 -7.213 -8.043
351 HE3 LYS 44 HE1 LYS 44 51.482 -7.650 -9.751
352 HZ1 LYS 44 HZ1 LYS 44 53.469 -5.742 -8.785
353 HZ2 LYS 44 HZ2 LYS 44 53.613 -6.959 -9.961
354 HZ3 LYS 44 HZ3 LYS 44 53.657 -7.359 -8.311
355 H LYS 45 HN LYS 45 49.430 -0.526 -8.921
356 HA LYS 45 HA LYS 45 51.561 1.293 -9.506
357 HB2 LYS 45 HB2 LYS 45 49.571 1.199 -10.890
358 HB3 LYS 45 HB1 LYS 45 48.554 1.637 -9.520
359 HG2 LYS 45 HG2 LYS 45 49.461 3.845 -9.421
360 HG3 LYS 45 HG1 LYS 45 50.788 3.421 -10.504
361 HD2 LYS 45 HD2 LYS 45 49.140 4.678 -11.771
362 HD3 LYS 45 HD1 LYS 45 49.108 3.002 -12.317
363 HE2 LYS 45 HE2 LYS 45 47.243 3.936 -10.137
364 HE3 LYS 45 HE1 LYS 45 46.840 4.178 -11.835
365 HZ1 LYS 45 HZ1 LYS 45 46.386 1.916 -10.404
366 HZ2 LYS 45 HZ2 LYS 45 47.788 1.533 -11.284
367 HZ3 LYS 45 HZ3 LYS 45 46.381 2.033 -12.096
368 H TYR 46 HN TYR 46 49.009 1.319 -7.029
369 HA TYR 46 HA TYR 46 49.585 3.879 -5.924
370 HB2 TYR 46 HB2 TYR 46 47.557 2.601 -5.378
371 HB3 TYR 46 HB1 TYR 46 48.533 1.369 -4.589
372 HD1 TYR 46 HD1 TYR 46 48.237 5.124 -4.497
373 HD2 TYR 46 HD2 TYR 46 48.548 1.467 -2.257
374 HE1 TYR 46 HE1 TYR 46 48.115 6.406 -2.380
375 HE2 TYR 46 HE2 TYR 46 48.424 2.751 -0.143
376 HH TYR 46 HH TYR 46 48.166 4.751 0.779
377 H ILE 47 HN ILE 47 50.734 0.645 -4.905
378 HA ILE 47 HA ILE 47 52.468 1.470 -2.840
379 HB ILE 47 HB ILE 47 52.838 -0.775 -4.842
380 HG12 ILE 47 HG12 ILE 47 51.852 -1.024 -1.996
381 HG13 ILE 47 HG11 ILE 47 50.732 -0.667 -3.310
382 HG21 ILE 47 HG21 ILE 47 54.954 -0.409 -3.807
383 HG22 ILE 47 HG22 ILE 47 54.221 -1.745 -2.921
384 HG23 ILE 47 HG23 ILE 47 54.216 -0.123 -2.231
385 HD11 ILE 47 HD11 ILE 47 52.655 -2.955 -3.631
386 HD12 ILE 47 HD12 ILE 47 51.056 -2.730 -4.335
387 HD13 ILE 47 HD13 ILE 47 51.214 -3.175 -2.636
388 H ALA 48 HN ALA 48 53.226 0.968 -6.292
389 HA ALA 48 HA ALA 48 55.917 1.718 -6.267
390 HB1 ALA 48 HB1 ALA 48 54.763 0.829 -8.258
391 HB2 ALA 48 HB2 ALA 48 55.618 2.324 -8.637
392 HB3 ALA 48 HB3 ALA 48 53.869 2.341 -8.414
393 H GLU 49 HN GLU 49 53.058 3.835 -6.490
394 HA GLU 49 HA GLU 49 54.427 6.269 -6.925
395 HB2 GLU 49 HB2 GLU 49 51.851 5.678 -6.848
396 HB3 GLU 49 HB1 GLU 49 51.981 6.178 -5.164
397 HG2 GLU 49 HG2 GLU 49 52.820 7.853 -7.550
398 HG3 GLU 49 HG1 GLU 49 51.323 8.058 -6.644
399 H LEU 50 HN LEU 50 54.018 4.391 -3.978
400 HA LEU 50 HA LEU 50 54.907 6.584 -2.247
401 HB2 LEU 50 HB2 LEU 50 54.811 3.637 -1.563
402 HB3 LEU 50 HB1 LEU 50 54.780 5.000 -0.448
403 HG LEU 50 HG LEU 50 52.626 4.259 -2.450
404 HD11 LEU 50 HD11 LEU 50 52.633 4.360 0.580
405 HD12 LEU 50 HD12 LEU 50 52.699 2.888 -0.390
406 HD13 LEU 50 HD13 LEU 50 51.265 3.911 -0.437
407 HD21 LEU 50 HD21 LEU 50 53.043 6.697 -0.712
408 HD22 LEU 50 HD22 LEU 50 51.419 6.182 -1.166
409 HD23 LEU 50 HD23 LEU 50 52.583 6.622 -2.413
410 H GLU 51 HN GLU 51 56.415 3.851 -3.897
411 HA GLU 51 HA GLU 51 58.893 3.914 -2.451
412 HB2 GLU 51 HB2 GLU 51 58.185 2.998 -5.246
413 HB3 GLU 51 HB1 GLU 51 59.813 2.851 -4.585
414 HG2 GLU 51 HG2 GLU 51 59.099 1.383 -2.858
415 HG3 GLU 51 HG1 GLU 51 57.399 1.772 -3.121
416 H VAL 52 HN VAL 52 57.616 5.834 -5.101
417 HA VAL 52 HA VAL 52 60.207 7.092 -5.664
418 HB VAL 52 HB VAL 52 57.443 7.959 -6.568
419 HG11 VAL 52 HG11 VAL 52 58.837 8.872 -8.495
420 HG12 VAL 52 HG12 VAL 52 60.264 8.532 -7.516
421 HG13 VAL 52 HG13 VAL 52 59.063 9.693 -6.950
422 HG21 VAL 52 HG21 VAL 52 57.966 6.667 -8.631
423 HG22 VAL 52 HG22 VAL 52 57.853 5.621 -7.216
424 HG23 VAL 52 HG23 VAL 52 59.433 6.063 -7.862
425 H GLN 53 HN GLN 53 57.362 7.740 -3.692
426 HA GLN 53 HA GLN 53 57.956 10.515 -3.199
427 HB2 GLN 53 HB2 GLN 53 55.738 9.234 -2.818
428 HB3 GLN 53 HB1 GLN 53 56.463 8.692 -1.304
429 HG2 GLN 53 HG2 GLN 53 56.858 11.053 -0.669
430 HG3 GLN 53 HG1 GLN 53 56.079 11.569 -2.164
431 HE21 GLN 53 HE21 GLN 53 53.755 11.414 -2.300
432 HE22 GLN 53 HE22 GLN 53 52.792 11.009 -0.963
433 H THR 54 HN THR 54 58.973 7.474 -1.749
434 HA THR 54 HA THR 54 60.287 8.842 0.515
435 HB THR 54 HB THR 54 61.184 6.374 0.828
436 HG1 THR 54 HG1 THR 54 60.219 6.020 -1.422
437 HG21 THR 54 HG21 THR 54 58.242 7.056 1.112
438 HG22 THR 54 HG22 THR 54 59.505 7.432 2.284
439 HG23 THR 54 HG23 THR 54 59.077 5.753 1.956
440 H GLY 55 HN GLY 55 61.027 9.089 -2.494
441 HA2 GLY 55 HA2 GLY 55 63.866 9.337 -2.068
442 HA3 GLY 55 HA1 GLY 55 63.491 7.947 -3.083
443 H MET 56 HN MET 56 63.176 11.463 -2.845
444 HA MET 56 HA MET 56 61.959 11.859 -5.411
445 HB2 MET 56 HB2 MET 56 63.716 13.668 -3.728
446 HB3 MET 56 HB1 MET 56 62.884 14.193 -5.192
447 HG2 MET 56 HG2 MET 56 61.472 14.777 -3.331
448 HG3 MET 56 HG1 MET 56 60.726 13.397 -4.134
449 HE1 MET 56 HE1 MET 56 59.397 13.563 -1.903
450 HE2 MET 56 HE2 MET 56 60.469 14.543 -0.904
451 HE3 MET 56 HE3 MET 56 59.955 12.955 -0.339
452 H THR 57 HN THR 57 63.082 10.544 -6.929
453 HA THR 57 HA THR 57 65.974 10.902 -7.306
454 HB THR 57 HB THR 57 65.499 9.413 -9.346
455 HG1 THR 57 HG1 THR 57 63.486 9.111 -9.780
456 HG21 THR 57 HG21 THR 57 66.314 8.585 -7.136
457 HG22 THR 57 HG22 THR 57 65.286 7.418 -7.966
458 HG23 THR 57 HG23 THR 57 64.638 8.373 -6.633
459 H GLN 58 HN GLN 58 64.159 13.236 -7.632
460 HA GLN 58 HA GLN 58 65.289 14.247 -10.112
461 HB2 GLN 58 HB2 GLN 58 63.332 12.901 -10.936
462 HB3 GLN 58 HB1 GLN 58 62.276 13.947 -9.984
463 HG2 GLN 58 HG2 GLN 58 63.003 15.903 -11.238
464 HG3 GLN 58 HG1 GLN 58 64.186 14.936 -12.121
465 HE21 GLN 58 HE21 GLN 58 63.418 14.575 -14.206
466 HE22 GLN 58 HE22 GLN 58 61.812 14.199 -14.602
467 H ARG 59 HN ARG 59 65.895 16.208 -9.368
468 HA ARG 59 HA ARG 59 65.763 18.328 -8.390
469 HB2 ARG 59 HB2 ARG 59 63.632 18.260 -9.883
470 HB3 ARG 59 HB1 ARG 59 62.757 18.029 -8.370
471 HG2 ARG 59 HG2 ARG 59 63.887 20.093 -7.478
472 HG3 ARG 59 HG1 ARG 59 64.559 20.358 -9.087
473 HD2 ARG 59 HD2 ARG 59 62.335 20.534 -10.047
474 HD3 ARG 59 HD1 ARG 59 61.596 20.100 -8.505
475 HE ARG 59 HE ARG 59 63.099 22.349 -7.905
476 HH11 ARG 59 HH21 ARG 59 60.706 21.488 -10.233
477 HH12 ARG 59 HH22 ARG 59 60.057 23.089 -10.354
478 HH21 ARG 59 HH11 ARG 59 62.265 24.444 -8.050
479 HH22 ARG 59 HH12 ARG 59 60.939 24.763 -9.118
480 H ARG 60 HN ARG 60 65.916 19.015 -6.280
481 HA ARG 60 HA ARG 60 64.147 18.043 -4.189
482 HB2 ARG 60 HB2 ARG 60 65.893 16.843 -2.899
483 HB3 ARG 60 HB1 ARG 60 65.570 16.052 -4.442
484 HG2 ARG 60 HG2 ARG 60 67.514 17.348 -5.410
485 HG3 ARG 60 HG1 ARG 60 67.895 17.873 -3.769
486 HD2 ARG 60 HD2 ARG 60 67.777 15.006 -4.749
487 HD3 ARG 60 HD1 ARG 60 69.234 15.903 -4.325
488 HE ARG 60 HE ARG 60 67.689 16.028 -2.028
489 HH11 ARG 60 HH21 ARG 60 68.842 13.558 -4.138
490 HH12 ARG 60 HH22 ARG 60 68.944 12.358 -2.893
491 HH21 ARG 60 HH11 ARG 60 67.816 14.475 -0.390
492 HH22 ARG 60 HH12 ARG 60 68.364 12.877 -0.771
493 H ARG 61 HN ARG 61 64.393 19.288 -2.289
494 HA ARG 61 HA ARG 61 65.626 21.853 -2.589
495 HB2 ARG 61 HB2 ARG 61 64.876 20.509 0.023
496 HB3 ARG 61 HB1 ARG 61 64.990 22.241 -0.292
497 HG2 ARG 61 HG2 ARG 61 63.142 22.069 -1.921
498 HG3 ARG 61 HG1 ARG 61 63.019 20.339 -1.593
499 HD2 ARG 61 HD2 ARG 61 62.407 20.758 0.713
500 HD3 ARG 61 HD1 ARG 61 62.713 22.484 0.526
501 HE ARG 61 HE ARG 61 60.791 21.945 -1.394
502 HH11 ARG 61 HH21 ARG 61 61.168 21.411 1.991
503 HH12 ARG 61 HH22 ARG 61 59.472 21.516 2.331
504 HH21 ARG 61 HH11 ARG 61 58.575 22.085 -0.970
505 HH22 ARG 61 HH12 ARG 61 58.005 21.897 0.655
506 H GLY 62 HN GLY 62 66.564 20.995 0.464
507 HA2 GLY 62 HA2 GLY 62 69.094 19.697 -0.082
508 HA3 GLY 62 HA1 GLY 62 69.298 21.436 0.132
Start of MODEL 16
1 H1 MET 1 HT1 MET 1 59.179 11.017 9.339
2 H2 MET 1 HT2 MET 1 58.912 9.683 10.356
3 H3 MET 1 HT3 MET 1 57.888 11.035 10.439
4 HA MET 1 HA MET 1 56.950 10.595 8.330
5 HB2 MET 1 HB2 MET 1 57.787 8.604 7.024
6 HB3 MET 1 HB1 MET 1 58.941 9.933 7.129
7 HG2 MET 1 HG2 MET 1 60.076 8.802 9.007
8 HG3 MET 1 HG1 MET 1 58.925 7.471 8.900
9 HE1 MET 1 HE1 MET 1 61.353 6.234 8.911
10 HE2 MET 1 HE2 MET 1 62.276 7.703 8.600
11 HE3 MET 1 HE3 MET 1 62.492 6.298 7.558
12 H VAL 2 HN VAL 2 55.477 8.692 7.846
13 HA VAL 2 HA VAL 2 55.268 6.702 10.040
14 HB VAL 2 HB VAL 2 52.918 8.451 9.266
15 HG11 VAL 2 HG11 VAL 2 53.415 6.426 11.467
16 HG12 VAL 2 HG12 VAL 2 52.282 6.273 10.124
17 HG13 VAL 2 HG13 VAL 2 51.995 7.469 11.388
18 HG21 VAL 2 HG21 VAL 2 53.264 9.456 11.560
19 HG22 VAL 2 HG22 VAL 2 54.514 9.880 10.390
20 HG23 VAL 2 HG23 VAL 2 54.831 8.648 11.612
21 H ARG 3 HN ARG 3 54.715 7.731 6.804
22 HA ARG 3 HA ARG 3 52.763 5.836 5.963
23 HB2 ARG 3 HB2 ARG 3 55.107 6.871 4.341
24 HB3 ARG 3 HB1 ARG 3 53.585 6.236 3.713
25 HG2 ARG 3 HG2 ARG 3 52.378 8.084 4.878
26 HG3 ARG 3 HG1 ARG 3 53.933 8.747 5.378
27 HD2 ARG 3 HD2 ARG 3 53.354 9.941 3.401
28 HD3 ARG 3 HD1 ARG 3 54.559 8.757 2.893
29 HE ARG 3 HE ARG 3 52.148 7.451 2.497
30 HH11 ARG 3 HH21 ARG 3 53.530 10.478 1.593
31 HH12 ARG 3 HH22 ARG 3 52.663 10.577 0.097
32 HH21 ARG 3 HH11 ARG 3 51.008 7.564 0.548
33 HH22 ARG 3 HH12 ARG 3 51.235 8.928 -0.495
34 H GLN 4 HN GLN 4 56.056 5.435 6.910
35 HA GLN 4 HA GLN 4 56.815 3.142 5.440
36 HB2 GLN 4 HB2 GLN 4 58.236 4.486 7.074
37 HB3 GLN 4 HB1 GLN 4 57.445 3.583 8.367
38 HG2 GLN 4 HG2 GLN 4 58.211 1.464 7.367
39 HG3 GLN 4 HG1 GLN 4 58.999 2.360 6.066
40 HE21 GLN 4 HE21 GLN 4 59.234 1.466 9.467
41 HE22 GLN 4 HE22 GLN 4 60.781 2.116 9.721
42 H GLU 5 HN GLU 5 55.005 3.375 8.504
43 HA GLU 5 HA GLU 5 54.673 0.523 8.793
44 HB2 GLU 5 HB2 GLU 5 53.318 2.935 10.004
45 HB3 GLU 5 HB1 GLU 5 52.732 1.306 10.343
46 HG2 GLU 5 HG2 GLU 5 54.893 0.654 11.238
47 HG3 GLU 5 HG1 GLU 5 55.600 2.200 10.765
48 H GLU 6 HN GLU 6 52.580 3.099 7.466
49 HA GLU 6 HA GLU 6 50.348 1.436 6.902
50 HB2 GLU 6 HB2 GLU 6 51.338 3.996 5.617
51 HB3 GLU 6 HB1 GLU 6 49.875 3.180 5.063
52 HG2 GLU 6 HG2 GLU 6 48.919 3.323 7.317
53 HG3 GLU 6 HG1 GLU 6 50.394 4.086 7.910
54 H LEU 7 HN LEU 7 53.474 1.553 5.399
55 HA LEU 7 HA LEU 7 52.578 0.431 2.856
56 HB2 LEU 7 HB2 LEU 7 54.795 1.773 3.490
57 HB3 LEU 7 HB1 LEU 7 55.416 0.162 3.830
58 HG LEU 7 HG LEU 7 54.139 1.012 1.210
59 HD11 LEU 7 HD11 LEU 7 57.048 0.403 1.791
60 HD12 LEU 7 HD12 LEU 7 56.392 2.039 1.752
61 HD13 LEU 7 HD13 LEU 7 56.365 1.044 0.297
62 HD21 LEU 7 HD21 LEU 7 55.346 -1.563 2.232
63 HD22 LEU 7 HD22 LEU 7 55.301 -1.204 0.506
64 HD23 LEU 7 HD23 LEU 7 53.800 -1.320 1.419
65 H ALA 8 HN ALA 8 54.292 -0.836 5.723
66 HA ALA 8 HA ALA 8 54.478 -3.530 4.888
67 HB1 ALA 8 HB1 ALA 8 55.610 -2.693 6.902
68 HB2 ALA 8 HB2 ALA 8 54.607 -4.087 7.300
69 HB3 ALA 8 HB3 ALA 8 54.053 -2.460 7.695
70 H ALA 9 HN ALA 9 51.724 -1.715 6.022
71 HA ALA 9 HA ALA 9 50.088 -4.035 6.659
72 HB1 ALA 9 HB1 ALA 9 49.501 -2.000 7.763
73 HB2 ALA 9 HB2 ALA 9 48.218 -2.293 6.590
74 HB3 ALA 9 HB3 ALA 9 49.472 -1.102 6.246
75 H ALA 10 HN ALA 10 49.970 -1.630 3.984
76 HA ALA 10 HA ALA 10 48.027 -3.043 2.459
77 HB1 ALA 10 HB1 ALA 10 48.390 -0.867 1.682
78 HB2 ALA 10 HB2 ALA 10 49.264 -1.813 0.477
79 HB3 ALA 10 HB3 ALA 10 50.143 -1.017 1.783
80 H ARG 11 HN ARG 11 51.462 -3.462 2.869
81 HA ARG 11 HA ARG 11 51.884 -5.222 0.620
82 HB2 ARG 11 HB2 ARG 11 53.572 -3.959 2.254
83 HB3 ARG 11 HB1 ARG 11 53.465 -5.446 3.188
84 HG2 ARG 11 HG2 ARG 11 55.183 -6.108 1.806
85 HG3 ARG 11 HG1 ARG 11 53.862 -6.507 0.708
86 HD2 ARG 11 HD2 ARG 11 54.058 -4.180 -0.235
87 HD3 ARG 11 HD1 ARG 11 55.503 -3.962 0.749
88 HE ARG 11 HE ARG 11 56.007 -6.300 -0.651
89 HH11 ARG 11 HH21 ARG 11 55.044 -3.083 -1.431
90 HH12 ARG 11 HH22 ARG 11 55.824 -3.082 -2.977
91 HH21 ARG 11 HH11 ARG 11 57.032 -6.317 -2.665
92 HH22 ARG 11 HH12 ARG 11 56.950 -4.913 -3.676
93 H ALA 12 HN ALA 12 51.325 -5.806 4.156
94 HA ALA 12 HA ALA 12 51.313 -8.617 4.066
95 HB1 ALA 12 HB1 ALA 12 49.852 -8.523 6.064
96 HB2 ALA 12 HB2 ALA 12 49.543 -6.817 5.741
97 HB3 ALA 12 HB3 ALA 12 51.165 -7.351 6.178
98 H ALA 13 HN ALA 13 49.176 -6.401 2.720
99 HA ALA 13 HA ALA 13 46.877 -8.173 2.520
100 HB1 ALA 13 HB1 ALA 13 45.801 -6.414 1.411
101 HB2 ALA 13 HB2 ALA 13 47.300 -5.799 0.714
102 HB3 ALA 13 HB3 ALA 13 46.956 -5.551 2.425
103 H LEU 14 HN LEU 14 49.523 -7.154 0.314
104 HA LEU 14 HA LEU 14 48.548 -8.534 -1.950
105 HB2 LEU 14 HB2 LEU 14 51.033 -7.266 -1.262
106 HB3 LEU 14 HB1 LEU 14 51.405 -8.811 -1.999
107 HG LEU 14 HG LEU 14 49.467 -6.838 -3.246
108 HD11 LEU 14 HD11 LEU 14 51.744 -5.835 -2.964
109 HD12 LEU 14 HD12 LEU 14 51.271 -6.054 -4.644
110 HD13 LEU 14 HD13 LEU 14 52.403 -7.179 -3.895
111 HD21 LEU 14 HD21 LEU 14 49.599 -9.384 -3.840
112 HD22 LEU 14 HD22 LEU 14 51.111 -8.949 -4.633
113 HD23 LEU 14 HD23 LEU 14 49.596 -8.204 -5.147
114 H HIS 15 HN HIS 15 50.062 -9.712 0.948
115 HA HIS 15 HA HIS 15 50.618 -12.368 -0.126
116 HB2 HIS 15 HB2 HIS 15 51.829 -11.397 1.841
117 HB3 HIS 15 HB1 HIS 15 50.331 -11.501 2.767
118 HD1 HIS 15 HD1 HIS 15 53.077 -13.595 1.328
119 HD2 HIS 15 HD2 HIS 15 49.524 -14.171 3.430
120 HE1 HIS 15 HE1 HIS 15 53.090 -16.004 2.110
121 H ASP 16 HN ASP 16 47.968 -10.813 1.617
122 HA ASP 16 HA ASP 16 46.520 -13.292 2.065
123 HB2 ASP 16 HB2 ASP 16 46.323 -11.059 3.367
124 HB3 ASP 16 HB1 ASP 16 45.266 -10.547 2.052
125 H LEU 17 HN LEU 17 46.583 -10.863 -0.490
126 HA LEU 17 HA LEU 17 44.131 -11.835 -1.739
127 HB2 LEU 17 HB2 LEU 17 46.316 -10.079 -2.903
128 HB3 LEU 17 HB1 LEU 17 44.716 -10.319 -3.583
129 HG LEU 17 HG LEU 17 45.148 -9.241 -0.787
130 HD11 LEU 17 HD11 LEU 17 44.876 -7.003 -1.688
131 HD12 LEU 17 HD12 LEU 17 44.653 -7.641 -3.314
132 HD13 LEU 17 HD13 LEU 17 46.222 -7.775 -2.523
133 HD21 LEU 17 HD21 LEU 17 42.821 -8.269 -1.358
134 HD22 LEU 17 HD22 LEU 17 42.910 -9.997 -1.037
135 HD23 LEU 17 HD23 LEU 17 42.806 -9.411 -2.697
136 H MET 18 HN MET 18 47.505 -12.697 -1.893
137 HA MET 18 HA MET 18 47.114 -14.228 -4.403
138 HB2 MET 18 HB2 MET 18 49.380 -13.085 -2.950
139 HB3 MET 18 HB1 MET 18 49.697 -14.770 -3.345
140 HG2 MET 18 HG2 MET 18 50.492 -13.407 -5.178
141 HG3 MET 18 HG1 MET 18 49.048 -14.258 -5.727
142 HE1 MET 18 HE1 MET 18 48.551 -12.376 -7.786
143 HE2 MET 18 HE2 MET 18 50.208 -12.163 -7.227
144 HE3 MET 18 HE3 MET 18 49.178 -10.754 -7.463
145 H THR 19 HN THR 19 46.826 -14.738 -1.030
146 HA THR 19 HA THR 19 47.491 -17.620 -1.205
147 HB THR 19 HB THR 19 46.650 -17.493 1.271
148 HG1 THR 19 HG1 THR 19 45.763 -15.305 0.700
149 HG21 THR 19 HG21 THR 19 48.840 -16.623 1.986
150 HG22 THR 19 HG22 THR 19 49.104 -15.947 0.378
151 HG23 THR 19 HG23 THR 19 49.019 -17.695 0.596
152 H GLY 20 HN GLY 20 44.812 -15.726 -1.911
153 HA2 GLY 20 HA2 GLY 20 42.934 -17.182 -2.862
154 HA3 GLY 20 HA1 GLY 20 42.911 -17.976 -1.291
155 H LYS 21 HN LYS 21 43.051 -15.865 0.480
156 HA LYS 21 HA LYS 21 40.409 -14.938 0.617
157 HB2 LYS 21 HB2 LYS 21 42.759 -13.340 1.658
158 HB3 LYS 21 HB1 LYS 21 41.125 -13.416 2.314
159 HG2 LYS 21 HG2 LYS 21 41.709 -16.028 2.503
160 HG3 LYS 21 HG1 LYS 21 43.360 -15.409 2.540
161 HD2 LYS 21 HD2 LYS 21 42.555 -13.809 4.378
162 HD3 LYS 21 HD1 LYS 21 41.100 -14.800 4.454
163 HE2 LYS 21 HE2 LYS 21 42.784 -15.535 6.116
164 HE3 LYS 21 HE1 LYS 21 42.456 -16.794 4.925
165 HZ1 LYS 21 HZ1 LYS 21 44.872 -16.291 5.468
166 HZ2 LYS 21 HZ2 LYS 21 44.665 -14.864 4.568
167 HZ3 LYS 21 HZ3 LYS 21 44.450 -16.379 3.828
168 H ARG 22 HN ARG 22 39.538 -13.959 -1.200
169 HA ARG 22 HA ARG 22 41.063 -12.059 -2.769
170 HB2 ARG 22 HB2 ARG 22 39.092 -11.893 -4.150
171 HB3 ARG 22 HB1 ARG 22 39.320 -13.585 -3.709
172 HG2 ARG 22 HG2 ARG 22 37.706 -13.197 -1.791
173 HG3 ARG 22 HG1 ARG 22 37.354 -11.622 -2.504
174 HD2 ARG 22 HD2 ARG 22 35.724 -13.362 -3.223
175 HD3 ARG 22 HD1 ARG 22 36.623 -12.686 -4.580
176 HE ARG 22 HE ARG 22 38.106 -14.910 -3.840
177 HH11 ARG 22 HH21 ARG 22 34.822 -14.243 -4.649
178 HH12 ARG 22 HH22 ARG 22 34.533 -15.806 -5.335
179 HH21 ARG 22 HH11 ARG 22 37.749 -16.955 -4.734
180 HH22 ARG 22 HH12 ARG 22 36.191 -17.343 -5.383
181 H VAL 23 HN VAL 23 38.359 -11.772 -0.447
182 HA VAL 23 HA VAL 23 38.315 -8.840 -0.756
183 HB VAL 23 HB VAL 23 36.266 -10.174 -0.221
184 HG11 VAL 23 HG11 VAL 23 37.444 -10.454 2.553
185 HG12 VAL 23 HG12 VAL 23 37.581 -11.734 1.346
186 HG13 VAL 23 HG13 VAL 23 35.991 -11.218 1.908
187 HG21 VAL 23 HG21 VAL 23 36.445 -7.760 0.356
188 HG22 VAL 23 HG22 VAL 23 37.090 -8.201 1.936
189 HG23 VAL 23 HG23 VAL 23 35.435 -8.635 1.508
190 H ALA 24 HN ALA 24 39.395 -7.394 0.486
191 HA ALA 24 HA ALA 24 40.553 -8.236 3.095
192 HB1 ALA 24 HB1 ALA 24 42.327 -8.672 1.413
193 HB2 ALA 24 HB2 ALA 24 42.774 -7.366 2.509
194 HB3 ALA 24 HB3 ALA 24 42.213 -6.995 0.878
195 H THR 25 HN THR 25 40.998 -6.424 4.474
196 HA THR 25 HA THR 25 39.618 -3.894 3.606
197 HB THR 25 HB THR 25 40.271 -4.971 6.369
198 HG1 THR 25 HG1 THR 25 38.400 -5.651 4.779
199 HG21 THR 25 HG21 THR 25 38.937 -2.431 5.426
200 HG22 THR 25 HG22 THR 25 40.344 -2.583 6.479
201 HG23 THR 25 HG23 THR 25 38.749 -3.058 7.064
202 H VAL 26 HN VAL 26 40.736 -1.950 3.632
203 HA VAL 26 HA VAL 26 43.395 -1.813 4.911
204 HB VAL 26 HB VAL 26 44.056 -0.621 2.539
205 HG11 VAL 26 HG11 VAL 26 45.306 -2.640 1.994
206 HG12 VAL 26 HG12 VAL 26 44.262 -3.608 3.036
207 HG13 VAL 26 HG13 VAL 26 45.335 -2.397 3.740
208 HG21 VAL 26 HG21 VAL 26 41.860 -1.267 1.552
209 HG22 VAL 26 HG22 VAL 26 42.282 -2.964 1.793
210 HG23 VAL 26 HG23 VAL 26 43.231 -1.968 0.694
211 H GLN 27 HN GLN 27 43.674 0.130 5.817
212 HA GLN 27 HA GLN 27 41.605 2.168 5.479
213 HB2 GLN 27 HB2 GLN 27 42.533 3.229 7.384
214 HB3 GLN 27 HB1 GLN 27 42.684 1.501 7.699
215 HG2 GLN 27 HG2 GLN 27 45.025 1.734 6.601
216 HG3 GLN 27 HG1 GLN 27 44.813 3.461 6.885
217 HE21 GLN 27 HE21 GLN 27 44.183 4.025 9.260
218 HE22 GLN 27 HE22 GLN 27 44.916 3.106 10.484
219 H LYS 28 HN LYS 28 41.730 3.662 3.894
220 HA LYS 28 HA LYS 28 44.426 4.369 2.808
221 HB2 LYS 28 HB2 LYS 28 42.622 3.429 1.243
222 HB3 LYS 28 HB1 LYS 28 41.751 4.944 1.498
223 HG2 LYS 28 HG2 LYS 28 43.738 6.201 0.716
224 HG3 LYS 28 HG1 LYS 28 44.572 4.676 0.418
225 HD2 LYS 28 HD2 LYS 28 42.952 4.036 -1.256
226 HD3 LYS 28 HD1 LYS 28 41.925 5.414 -0.858
227 HE2 LYS 28 HE2 LYS 28 44.718 5.550 -2.032
228 HE3 LYS 28 HE1 LYS 28 43.214 5.898 -2.884
229 HZ1 LYS 28 HZ1 LYS 28 43.440 7.976 -2.188
230 HZ2 LYS 28 HZ2 LYS 28 44.735 7.574 -1.165
231 HZ3 LYS 28 HZ3 LYS 28 43.135 7.436 -0.609
232 H ASP 29 HN ASP 29 44.963 6.648 2.704
233 HA ASP 29 HA ASP 29 44.104 8.343 4.730
234 HB2 ASP 29 HB2 ASP 29 44.942 10.220 3.309
235 HB3 ASP 29 HB1 ASP 29 46.064 8.860 3.371
236 H GLY 30 HN GLY 30 41.814 8.220 4.948
237 HA2 GLY 30 HA2 GLY 30 40.137 10.151 4.223
238 HA3 GLY 30 HA1 GLY 30 40.150 9.247 2.708
239 H ARG 31 HN ARG 31 40.040 6.629 3.415
240 HA ARG 31 HA ARG 31 38.296 6.046 5.624
241 HB2 ARG 31 HB2 ARG 31 37.023 7.195 3.340
242 HB3 ARG 31 HB1 ARG 31 36.581 5.494 3.330
243 HG2 ARG 31 HG2 ARG 31 36.321 7.256 5.787
244 HG3 ARG 31 HG1 ARG 31 35.017 7.013 4.628
245 HD2 ARG 31 HD2 ARG 31 35.208 4.544 5.003
246 HD3 ARG 31 HD1 ARG 31 36.390 4.867 6.271
247 HE ARG 31 HE ARG 31 34.210 6.417 6.992
248 HH11 ARG 31 HH21 ARG 31 34.776 3.115 6.178
249 HH12 ARG 31 HH22 ARG 31 33.514 2.508 7.198
250 HH21 ARG 31 HH11 ARG 31 32.558 5.644 8.329
251 HH22 ARG 31 HH12 ARG 31 32.258 3.941 8.416
252 H ARG 32 HN ARG 32 37.811 3.856 5.792
253 HA ARG 32 HA ARG 32 39.689 2.056 4.521
254 HB2 ARG 32 HB2 ARG 32 37.460 1.824 6.513
255 HB3 ARG 32 HB1 ARG 32 37.981 0.347 5.709
256 HG2 ARG 32 HG2 ARG 32 40.229 0.602 6.511
257 HG3 ARG 32 HG1 ARG 32 39.902 2.236 7.091
258 HD2 ARG 32 HD2 ARG 32 38.408 1.407 8.795
259 HD3 ARG 32 HD1 ARG 32 38.473 -0.225 8.128
260 HE ARG 32 HE ARG 32 41.117 0.348 8.717
261 HH11 ARG 32 HH21 ARG 32 38.107 0.441 10.398
262 HH12 ARG 32 HH22 ARG 32 38.806 0.078 11.940
263 HH21 ARG 32 HH11 ARG 32 42.046 -0.127 10.721
264 HH22 ARG 32 HH12 ARG 32 41.035 -0.244 12.124
265 H VAL 33 HN VAL 33 39.334 0.557 2.904
266 HA VAL 33 HA VAL 33 36.611 0.305 1.738
267 HB VAL 33 HB VAL 33 39.035 1.216 0.147
268 HG11 VAL 33 HG11 VAL 33 37.824 -0.396 -1.175
269 HG12 VAL 33 HG12 VAL 33 37.349 1.201 -1.751
270 HG13 VAL 33 HG13 VAL 33 36.273 0.293 -0.694
271 HG21 VAL 33 HG21 VAL 33 37.316 3.066 -0.458
272 HG22 VAL 33 HG22 VAL 33 38.047 3.144 1.143
273 HG23 VAL 33 HG23 VAL 33 36.414 2.505 0.949
274 H GLU 34 HN GLU 34 36.330 -1.610 0.611
275 HA GLU 34 HA GLU 34 38.464 -3.658 1.071
276 HB2 GLU 34 HB2 GLU 34 35.465 -3.678 1.061
277 HB3 GLU 34 HB1 GLU 34 36.278 -5.159 0.560
278 HG2 GLU 34 HG2 GLU 34 37.400 -5.371 2.651
279 HG3 GLU 34 HG1 GLU 34 36.999 -3.719 3.120
280 H PHE 35 HN PHE 35 39.708 -3.722 -0.820
281 HA PHE 35 HA PHE 35 38.307 -3.752 -3.454
282 HB2 PHE 35 HB2 PHE 35 41.217 -3.604 -2.621
283 HB3 PHE 35 HB1 PHE 35 40.762 -3.955 -4.282
284 HD1 PHE 35 HD1 PHE 35 38.779 -2.265 -5.176
285 HD2 PHE 35 HD2 PHE 35 41.719 -1.381 -2.180
286 HE1 PHE 35 HE1 PHE 35 38.526 0.160 -5.631
287 HE2 PHE 35 HE2 PHE 35 41.468 1.030 -2.615
288 HZ PHE 35 HZ PHE 35 39.871 1.811 -4.355
289 H THR 36 HN THR 36 38.256 -5.650 -4.723
290 HA THR 36 HA THR 36 39.092 -8.161 -3.318
291 HB THR 36 HB THR 36 37.585 -9.315 -4.864
292 HG1 THR 36 HG1 THR 36 36.708 -6.894 -5.931
293 HG21 THR 36 HG21 THR 36 35.554 -8.585 -3.962
294 HG22 THR 36 HG22 THR 36 36.024 -6.888 -4.013
295 HG23 THR 36 HG23 THR 36 36.720 -7.959 -2.797
296 H ALA 37 HN ALA 37 39.916 -9.916 -4.988
297 HA ALA 37 HA ALA 37 42.327 -9.015 -6.164
298 HB1 ALA 37 HB1 ALA 37 42.204 -11.343 -5.810
299 HB2 ALA 37 HB2 ALA 37 42.092 -11.206 -7.562
300 HB3 ALA 37 HB3 ALA 37 40.635 -11.473 -6.604
301 H THR 38 HN THR 38 39.152 -8.531 -7.252
302 HA THR 38 HA THR 38 39.504 -8.616 -10.086
303 HB THR 38 HB THR 38 37.520 -7.119 -10.163
304 HG1 THR 38 HG1 THR 38 36.715 -6.850 -7.815
305 HG21 THR 38 HG21 THR 38 37.472 -9.676 -9.554
306 HG22 THR 38 HG22 THR 38 36.009 -8.713 -9.361
307 HG23 THR 38 HG23 THR 38 37.000 -9.094 -7.956
308 H SER 39 HN SER 39 40.445 -6.251 -7.687
309 HA SER 39 HA SER 39 41.520 -4.504 -9.889
310 HB2 SER 39 HB2 SER 39 40.928 -2.550 -8.673
311 HB3 SER 39 HB1 SER 39 39.499 -3.576 -8.608
312 HG SER 39 HG SER 39 40.969 -4.306 -6.587
313 H VAL 40 HN VAL 40 43.182 -6.421 -8.987
314 HA VAL 40 HA VAL 40 44.696 -5.508 -6.648
315 HB VAL 40 HB VAL 40 44.612 -7.888 -7.041
316 HG11 VAL 40 HG11 VAL 40 45.486 -8.927 -9.083
317 HG12 VAL 40 HG12 VAL 40 45.982 -7.360 -9.715
318 HG13 VAL 40 HG13 VAL 40 44.267 -7.737 -9.543
319 HG21 VAL 40 HG21 VAL 40 47.389 -7.009 -7.887
320 HG22 VAL 40 HG22 VAL 40 46.954 -8.394 -6.887
321 HG23 VAL 40 HG23 VAL 40 46.787 -6.755 -6.249
322 H SER 41 HN SER 41 44.632 -4.580 -9.934
323 HA SER 41 HA SER 41 47.451 -3.992 -10.252
324 HB2 SER 41 HB2 SER 41 46.681 -2.622 -12.180
325 HB3 SER 41 HB1 SER 41 46.009 -4.249 -12.207
326 HG SER 41 HG SER 41 44.138 -3.330 -11.157
327 H ASP 42 HN ASP 42 44.597 -2.016 -9.397
328 HA ASP 42 HA ASP 42 45.916 0.478 -9.156
329 HB2 ASP 42 HB2 ASP 42 44.070 1.154 -7.737
330 HB3 ASP 42 HB1 ASP 42 43.429 0.094 -8.993
331 H LEU 43 HN LEU 43 45.712 -2.251 -6.826
332 HA LEU 43 HA LEU 43 46.871 -0.841 -4.629
333 HB2 LEU 43 HB2 LEU 43 45.720 -3.180 -4.701
334 HB3 LEU 43 HB1 LEU 43 47.309 -3.785 -5.153
335 HG LEU 43 HG LEU 43 48.267 -2.840 -3.064
336 HD11 LEU 43 HD11 LEU 43 45.486 -1.726 -2.815
337 HD12 LEU 43 HD12 LEU 43 47.025 -1.016 -2.332
338 HD13 LEU 43 HD13 LEU 43 46.281 -2.255 -1.331
339 HD21 LEU 43 HD21 LEU 43 47.345 -4.502 -1.606
340 HD22 LEU 43 HD22 LEU 43 47.211 -5.156 -3.240
341 HD23 LEU 43 HD23 LEU 43 45.793 -4.475 -2.445
342 H LYS 44 HN LYS 44 48.270 -2.573 -7.383
343 HA LYS 44 HA LYS 44 50.999 -2.444 -6.457
344 HB2 LYS 44 HB2 LYS 44 49.629 -2.955 -9.073
345 HB3 LYS 44 HB1 LYS 44 51.332 -2.503 -9.141
346 HG2 LYS 44 HG2 LYS 44 51.989 -4.371 -7.817
347 HG3 LYS 44 HG1 LYS 44 50.327 -4.708 -7.333
348 HD2 LYS 44 HD2 LYS 44 49.738 -5.463 -9.518
349 HD3 LYS 44 HD1 LYS 44 51.216 -4.805 -10.219
350 HE2 LYS 44 HE2 LYS 44 51.191 -6.998 -8.132
351 HE3 LYS 44 HE1 LYS 44 51.261 -7.305 -9.868
352 HZ1 LYS 44 HZ1 LYS 44 53.275 -6.102 -8.109
353 HZ2 LYS 44 HZ2 LYS 44 53.217 -5.609 -9.734
354 HZ3 LYS 44 HZ3 LYS 44 53.468 -7.245 -9.347
355 H LYS 45 HN LYS 45 49.053 -0.299 -8.548
356 HA LYS 45 HA LYS 45 51.142 1.576 -9.085
357 HB2 LYS 45 HB2 LYS 45 48.861 1.350 -10.220
358 HB3 LYS 45 HB1 LYS 45 48.206 2.241 -8.849
359 HG2 LYS 45 HG2 LYS 45 49.679 4.130 -9.309
360 HG3 LYS 45 HG1 LYS 45 50.474 3.235 -10.600
361 HD2 LYS 45 HD2 LYS 45 48.947 4.570 -11.781
362 HD3 LYS 45 HD1 LYS 45 48.081 3.043 -11.633
363 HE2 LYS 45 HE2 LYS 45 46.648 5.000 -11.073
364 HE3 LYS 45 HE1 LYS 45 46.833 3.904 -9.706
365 HZ1 LYS 45 HZ1 LYS 45 48.338 5.334 -8.673
366 HZ2 LYS 45 HZ2 LYS 45 47.133 6.371 -9.273
367 HZ3 LYS 45 HZ3 LYS 45 48.619 6.228 -10.086
368 H TYR 46 HN TYR 46 48.678 1.437 -6.526
369 HA TYR 46 HA TYR 46 49.255 3.922 -5.283
370 HB2 TYR 46 HB2 TYR 46 47.290 2.551 -4.724
371 HB3 TYR 46 HB1 TYR 46 48.338 1.309 -4.051
372 HD1 TYR 46 HD2 TYR 46 47.938 5.043 -3.735
373 HD2 TYR 46 HD1 TYR 46 48.460 1.281 -1.719
374 HE1 TYR 46 HE2 TYR 46 47.886 6.205 -1.548
375 HE2 TYR 46 HE1 TYR 46 48.396 2.445 0.468
376 HH TYR 46 HH TYR 46 48.669 5.826 0.754
377 H ILE 47 HN ILE 47 50.539 0.672 -4.531
378 HA ILE 47 HA ILE 47 52.338 1.410 -2.488
379 HB ILE 47 HB ILE 47 52.641 -0.709 -4.634
380 HG12 ILE 47 HG12 ILE 47 51.803 -1.149 -1.763
381 HG13 ILE 47 HG11 ILE 47 50.612 -0.704 -2.985
382 HG21 ILE 47 HG21 ILE 47 54.166 -0.157 -2.086
383 HG22 ILE 47 HG22 ILE 47 54.801 -0.430 -3.709
384 HG23 ILE 47 HG23 ILE 47 54.108 -1.770 -2.797
385 HD11 ILE 47 HD11 ILE 47 51.159 -3.257 -2.503
386 HD12 ILE 47 HD12 ILE 47 52.504 -2.952 -3.605
387 HD13 ILE 47 HD13 ILE 47 50.847 -2.697 -4.144
388 H ALA 48 HN ALA 48 53.026 1.079 -5.981
389 HA ALA 48 HA ALA 48 55.699 1.891 -5.960
390 HB1 ALA 48 HB1 ALA 48 53.619 2.529 -8.070
391 HB2 ALA 48 HB2 ALA 48 54.545 1.032 -7.963
392 HB3 ALA 48 HB3 ALA 48 55.366 2.555 -8.308
393 H GLU 49 HN GLU 49 52.802 3.975 -6.112
394 HA GLU 49 HA GLU 49 54.162 6.435 -6.485
395 HB2 GLU 49 HB2 GLU 49 51.529 5.714 -5.195
396 HB3 GLU 49 HB1 GLU 49 52.097 7.383 -5.202
397 HG2 GLU 49 HG2 GLU 49 51.907 5.702 -7.714
398 HG3 GLU 49 HG1 GLU 49 50.601 6.748 -7.156
399 H LEU 50 HN LEU 50 53.740 4.496 -3.574
400 HA LEU 50 HA LEU 50 54.574 6.626 -1.771
401 HB2 LEU 50 HB2 LEU 50 54.685 3.638 -1.278
402 HB3 LEU 50 HB1 LEU 50 54.678 4.914 -0.063
403 HG LEU 50 HG LEU 50 52.423 4.259 -1.982
404 HD11 LEU 50 HD11 LEU 50 52.441 4.136 1.037
405 HD12 LEU 50 HD12 LEU 50 52.859 2.747 0.034
406 HD13 LEU 50 HD13 LEU 50 51.250 3.458 -0.070
407 HD21 LEU 50 HD21 LEU 50 52.250 6.589 -1.690
408 HD22 LEU 50 HD22 LEU 50 52.875 6.528 -0.041
409 HD23 LEU 50 HD23 LEU 50 51.238 5.971 -0.387
410 H GLU 51 HN GLU 51 56.232 4.146 -3.632
411 HA GLU 51 HA GLU 51 58.747 4.364 -2.235
412 HB2 GLU 51 HB2 GLU 51 57.920 3.303 -4.935
413 HB3 GLU 51 HB1 GLU 51 59.626 3.415 -4.507
414 HG2 GLU 51 HG2 GLU 51 58.598 1.179 -3.983
415 HG3 GLU 51 HG1 GLU 51 59.298 1.985 -2.578
416 H VAL 52 HN VAL 52 57.266 6.138 -4.896
417 HA VAL 52 HA VAL 52 59.709 7.552 -5.602
418 HB VAL 52 HB VAL 52 56.839 8.323 -6.211
419 HG11 VAL 52 HG11 VAL 52 58.316 10.149 -6.693
420 HG12 VAL 52 HG12 VAL 52 58.012 9.349 -8.234
421 HG13 VAL 52 HG13 VAL 52 59.530 9.072 -7.382
422 HG21 VAL 52 HG21 VAL 52 58.780 6.488 -7.646
423 HG22 VAL 52 HG22 VAL 52 57.335 7.153 -8.406
424 HG23 VAL 52 HG23 VAL 52 57.185 6.073 -7.020
425 H GLN 53 HN GLN 53 57.079 8.055 -3.329
426 HA GLN 53 HA GLN 53 57.738 10.857 -2.839
427 HB2 GLN 53 HB2 GLN 53 55.956 8.828 -1.486
428 HB3 GLN 53 HB1 GLN 53 56.223 10.426 -0.787
429 HG2 GLN 53 HG2 GLN 53 55.297 10.013 -3.641
430 HG3 GLN 53 HG1 GLN 53 54.183 10.242 -2.292
431 HE21 GLN 53 HE21 GLN 53 55.377 11.992 -4.733
432 HE22 GLN 53 HE22 GLN 53 55.576 13.504 -3.988
433 H THR 54 HN THR 54 58.537 7.742 -1.357
434 HA THR 54 HA THR 54 59.912 9.016 0.899
435 HB THR 54 HB THR 54 60.757 6.491 1.109
436 HG1 THR 54 HG1 THR 54 58.385 5.876 -0.141
437 HG21 THR 54 HG21 THR 54 57.910 7.432 1.555
438 HG22 THR 54 HG22 THR 54 59.236 7.459 2.715
439 HG23 THR 54 HG23 THR 54 58.552 5.919 2.193
440 H GLY 55 HN GLY 55 60.680 9.214 -2.142
441 HA2 GLY 55 HA2 GLY 55 62.688 9.511 -3.319
442 HA3 GLY 55 HA1 GLY 55 63.459 9.675 -1.740
443 H MET 56 HN MET 56 63.530 7.860 -4.493
444 HA MET 56 HA MET 56 65.007 5.703 -3.122
445 HB2 MET 56 HB2 MET 56 62.296 5.343 -3.886
446 HB3 MET 56 HB1 MET 56 63.226 4.497 -5.116
447 HG2 MET 56 HG2 MET 56 62.745 2.944 -3.311
448 HG3 MET 56 HG1 MET 56 64.468 3.313 -3.280
449 HE1 MET 56 HE1 MET 56 61.105 4.467 -0.519
450 HE2 MET 56 HE2 MET 56 61.072 4.187 -2.257
451 HE3 MET 56 HE3 MET 56 61.445 5.794 -1.638
452 H THR 57 HN THR 57 66.879 5.560 -4.238
453 HA THR 57 HA THR 57 66.941 6.421 -7.091
454 HB THR 57 HB THR 57 69.415 6.376 -6.773
455 HG1 THR 57 HG1 THR 57 69.253 4.739 -5.077
456 HG21 THR 57 HG21 THR 57 68.138 7.907 -4.508
457 HG22 THR 57 HG22 THR 57 67.895 8.369 -6.192
458 HG23 THR 57 HG23 THR 57 69.518 8.372 -5.501
459 H GLN 58 HN GLN 58 69.570 4.596 -6.894
460 HA GLN 58 HA GLN 58 68.554 1.898 -6.963
461 HB2 GLN 58 HB2 GLN 58 67.542 2.836 -9.069
462 HB3 GLN 58 HB1 GLN 58 69.177 3.130 -9.663
463 HG2 GLN 58 HG2 GLN 58 69.705 0.785 -9.616
464 HG3 GLN 58 HG1 GLN 58 68.212 0.408 -8.753
465 HE21 GLN 58 HE21 GLN 58 68.614 2.611 -11.559
466 HE22 GLN 58 HE22 GLN 58 67.588 1.736 -12.589
467 H ARG 59 HN ARG 59 71.016 4.250 -7.325
468 HA ARG 59 HA ARG 59 73.356 4.083 -7.311
469 HB2 ARG 59 HB2 ARG 59 72.684 2.691 -5.261
470 HB3 ARG 59 HB1 ARG 59 72.922 1.272 -6.279
471 HG2 ARG 59 HG2 ARG 59 75.016 1.512 -5.264
472 HG3 ARG 59 HG1 ARG 59 75.252 2.328 -6.808
473 HD2 ARG 59 HD2 ARG 59 74.297 4.385 -5.198
474 HD3 ARG 59 HD1 ARG 59 75.277 3.455 -4.071
475 HE ARG 59 HE ARG 59 76.311 5.236 -5.977
476 HH11 ARG 59 HH21 ARG 59 76.684 1.900 -5.158
477 HH12 ARG 59 HH22 ARG 59 78.254 1.774 -5.868
478 HH21 ARG 59 HH11 ARG 59 78.358 5.080 -6.888
479 HH22 ARG 59 HH12 ARG 59 79.204 3.569 -6.840
480 H ARG 60 HN ARG 60 72.466 3.731 -9.808
481 HA ARG 60 HA ARG 60 73.145 1.160 -10.964
482 HB2 ARG 60 HB2 ARG 60 72.968 2.373 -13.131
483 HB3 ARG 60 HB1 ARG 60 71.570 2.659 -12.094
484 HG2 ARG 60 HG2 ARG 60 72.679 4.770 -11.296
485 HG3 ARG 60 HG1 ARG 60 73.936 4.508 -12.506
486 HD2 ARG 60 HD2 ARG 60 72.242 4.551 -14.292
487 HD3 ARG 60 HD1 ARG 60 70.974 4.796 -13.091
488 HE ARG 60 HE ARG 60 72.737 6.881 -12.623
489 HH11 ARG 60 HH21 ARG 60 71.049 5.591 -15.339
490 HH12 ARG 60 HH22 ARG 60 70.899 7.119 -16.140
491 HH21 ARG 60 HH11 ARG 60 72.551 8.885 -13.654
492 HH22 ARG 60 HH12 ARG 60 71.749 8.984 -15.186
493 H ARG 61 HN ARG 61 75.017 0.673 -12.234
494 HA ARG 61 HA ARG 61 77.442 2.161 -11.358
495 HB2 ARG 61 HB2 ARG 61 77.150 -0.481 -12.844
496 HB3 ARG 61 HB1 ARG 61 78.687 0.283 -12.474
497 HG2 ARG 61 HG2 ARG 61 78.087 -1.426 -10.785
498 HG3 ARG 61 HG1 ARG 61 78.224 0.182 -10.081
499 HD2 ARG 61 HD2 ARG 61 76.178 -1.302 -9.435
500 HD3 ARG 61 HD1 ARG 61 75.905 0.399 -9.801
501 HE ARG 61 HE ARG 61 75.552 -0.851 -12.243
502 HH11 ARG 61 HH21 ARG 61 74.349 -1.262 -9.040
503 HH12 ARG 61 HH22 ARG 61 72.812 -1.872 -9.554
504 HH21 ARG 61 HH11 ARG 61 73.553 -1.646 -12.934
505 HH22 ARG 61 HH12 ARG 61 72.362 -2.089 -11.758
506 H GLY 62 HN GLY 62 75.978 1.008 -14.413
507 HA2 GLY 62 HA2 GLY 62 76.074 1.949 -16.562
508 HA3 GLY 62 HA1 GLY 62 76.586 3.452 -15.796
Start of MODEL 17
1 H1 MET 1 HT1 MET 1 55.639 11.224 9.160
2 H2 MET 1 HT2 MET 1 54.169 10.403 9.387
3 H3 MET 1 HT3 MET 1 54.854 10.512 7.836
4 HA MET 1 HA MET 1 56.509 8.987 8.288
5 HB2 MET 1 HB2 MET 1 57.169 10.140 10.422
6 HB3 MET 1 HB1 MET 1 55.854 9.287 11.234
7 HG2 MET 1 HG2 MET 1 56.844 7.138 10.702
8 HG3 MET 1 HG1 MET 1 58.085 7.909 9.713
9 HE1 MET 1 HE1 MET 1 60.471 6.916 12.418
10 HE2 MET 1 HE2 MET 1 60.093 7.052 10.702
11 HE3 MET 1 HE3 MET 1 59.166 5.950 11.716
12 H VAL 2 HN VAL 2 53.292 9.194 9.532
13 HA VAL 2 HA VAL 2 52.821 6.487 10.258
14 HB VAL 2 HB VAL 2 50.869 8.368 8.898
15 HG11 VAL 2 HG11 VAL 2 49.220 7.058 10.269
16 HG12 VAL 2 HG12 VAL 2 50.532 5.970 10.723
17 HG13 VAL 2 HG13 VAL 2 50.032 6.092 9.036
18 HG21 VAL 2 HG21 VAL 2 50.247 8.957 11.266
19 HG22 VAL 2 HG22 VAL 2 51.857 9.506 10.801
20 HG23 VAL 2 HG23 VAL 2 51.672 8.070 11.808
21 H ARG 3 HN ARG 3 53.468 7.891 7.191
22 HA ARG 3 HA ARG 3 52.060 6.037 5.511
23 HB2 ARG 3 HB2 ARG 3 54.615 7.591 4.997
24 HB3 ARG 3 HB1 ARG 3 53.673 6.759 3.760
25 HG2 ARG 3 HG2 ARG 3 51.726 8.167 4.262
26 HG3 ARG 3 HG1 ARG 3 52.627 8.978 5.543
27 HD2 ARG 3 HD2 ARG 3 54.257 9.802 3.898
28 HD3 ARG 3 HD1 ARG 3 53.392 8.967 2.609
29 HE ARG 3 HE ARG 3 51.461 10.586 3.760
30 HH11 ARG 3 HH21 ARG 3 54.631 10.999 2.473
31 HH12 ARG 3 HH22 ARG 3 54.343 12.617 1.927
32 HH21 ARG 3 HH11 ARG 3 51.066 12.697 3.055
33 HH22 ARG 3 HH12 ARG 3 52.325 13.579 2.258
34 H GLN 4 HN GLN 4 55.178 5.908 7.154
35 HA GLN 4 HA GLN 4 56.306 3.692 5.784
36 HB2 GLN 4 HB2 GLN 4 57.376 5.198 7.583
37 HB3 GLN 4 HB1 GLN 4 56.588 4.149 8.761
38 HG2 GLN 4 HG2 GLN 4 58.419 3.126 6.570
39 HG3 GLN 4 HG1 GLN 4 58.962 3.488 8.207
40 HE21 GLN 4 HE21 GLN 4 58.418 0.847 6.522
41 HE22 GLN 4 HE22 GLN 4 57.606 -0.131 7.646
42 H GLU 5 HN GLU 5 54.291 3.745 8.739
43 HA GLU 5 HA GLU 5 54.104 0.878 8.930
44 HB2 GLU 5 HB2 GLU 5 53.665 2.354 10.855
45 HB3 GLU 5 HB1 GLU 5 52.258 3.023 10.026
46 HG2 GLU 5 HG2 GLU 5 51.118 0.909 10.075
47 HG3 GLU 5 HG1 GLU 5 52.571 0.072 10.625
48 H GLU 6 HN GLU 6 51.898 3.357 7.593
49 HA GLU 6 HA GLU 6 49.824 1.594 6.837
50 HB2 GLU 6 HB2 GLU 6 49.692 4.105 6.776
51 HB3 GLU 6 HB1 GLU 6 50.669 4.083 5.309
52 HG2 GLU 6 HG2 GLU 6 48.991 2.695 4.187
53 HG3 GLU 6 HG1 GLU 6 48.023 2.653 5.660
54 H LEU 7 HN LEU 7 53.023 1.914 5.539
55 HA LEU 7 HA LEU 7 52.354 0.826 2.913
56 HB2 LEU 7 HB2 LEU 7 54.443 2.258 3.678
57 HB3 LEU 7 HB1 LEU 7 55.118 0.690 4.113
58 HG LEU 7 HG LEU 7 54.035 1.431 1.375
59 HD11 LEU 7 HD11 LEU 7 56.891 1.012 2.309
60 HD12 LEU 7 HD12 LEU 7 56.158 2.582 1.984
61 HD13 LEU 7 HD13 LEU 7 56.379 1.424 0.672
62 HD21 LEU 7 HD21 LEU 7 53.766 -0.899 1.535
63 HD22 LEU 7 HD22 LEU 7 55.179 -1.096 2.569
64 HD23 LEU 7 HD23 LEU 7 55.381 -0.765 0.848
65 H ALA 8 HN ALA 8 53.951 -0.441 5.849
66 HA ALA 8 HA ALA 8 54.265 -3.110 4.946
67 HB1 ALA 8 HB1 ALA 8 53.717 -2.131 7.767
68 HB2 ALA 8 HB2 ALA 8 55.308 -2.276 7.019
69 HB3 ALA 8 HB3 ALA 8 54.350 -3.721 7.343
70 H ALA 9 HN ALA 9 51.436 -1.381 5.997
71 HA ALA 9 HA ALA 9 49.825 -3.736 6.558
72 HB1 ALA 9 HB1 ALA 9 49.156 -1.703 7.632
73 HB2 ALA 9 HB2 ALA 9 47.921 -2.043 6.419
74 HB3 ALA 9 HB3 ALA 9 49.153 -0.819 6.105
75 H ALA 10 HN ALA 10 49.788 -1.334 3.879
76 HA ALA 10 HA ALA 10 47.940 -2.752 2.258
77 HB1 ALA 10 HB1 ALA 10 50.116 -0.761 1.677
78 HB2 ALA 10 HB2 ALA 10 48.375 -0.589 1.477
79 HB3 ALA 10 HB3 ALA 10 49.300 -1.563 0.334
80 H ARG 11 HN ARG 11 51.342 -3.192 2.860
81 HA ARG 11 HA ARG 11 51.858 -5.003 0.670
82 HB2 ARG 11 HB2 ARG 11 53.477 -3.697 2.340
83 HB3 ARG 11 HB1 ARG 11 53.329 -5.160 3.309
84 HG2 ARG 11 HG2 ARG 11 55.127 -5.807 2.011
85 HG3 ARG 11 HG1 ARG 11 53.840 -6.315 0.919
86 HD2 ARG 11 HD2 ARG 11 53.977 -4.096 -0.206
87 HD3 ARG 11 HD1 ARG 11 55.337 -3.683 0.838
88 HE ARG 11 HE ARG 11 56.103 -6.079 -0.328
89 HH11 ARG 11 HH21 ARG 11 54.959 -3.020 -1.430
90 HH12 ARG 11 HH22 ARG 11 55.831 -3.083 -2.925
91 HH21 ARG 11 HH11 ARG 11 57.249 -6.179 -2.274
92 HH22 ARG 11 HH12 ARG 11 57.128 -4.870 -3.402
93 H ALA 12 HN ALA 12 51.169 -5.497 4.195
94 HA ALA 12 HA ALA 12 51.141 -8.311 4.168
95 HB1 ALA 12 HB1 ALA 12 50.960 -6.995 6.246
96 HB2 ALA 12 HB2 ALA 12 49.641 -8.160 6.131
97 HB3 ALA 12 HB3 ALA 12 49.350 -6.460 5.763
98 H ALA 13 HN ALA 13 49.059 -6.113 2.711
99 HA ALA 13 HA ALA 13 46.747 -7.879 2.511
100 HB1 ALA 13 HB1 ALA 13 46.795 -5.275 2.400
101 HB2 ALA 13 HB2 ALA 13 45.708 -6.142 1.317
102 HB3 ALA 13 HB3 ALA 13 47.238 -5.511 0.710
103 H LEU 14 HN LEU 14 49.502 -6.984 0.424
104 HA LEU 14 HA LEU 14 48.526 -8.343 -1.880
105 HB2 LEU 14 HB2 LEU 14 50.952 -7.002 -1.197
106 HB3 LEU 14 HB1 LEU 14 51.410 -8.562 -1.846
107 HG LEU 14 HG LEU 14 49.463 -6.701 -3.243
108 HD11 LEU 14 HD11 LEU 14 51.282 -5.937 -4.608
109 HD12 LEU 14 HD12 LEU 14 52.405 -7.060 -3.845
110 HD13 LEU 14 HD13 LEU 14 51.761 -5.697 -2.931
111 HD21 LEU 14 HD21 LEU 14 51.163 -8.871 -4.464
112 HD22 LEU 14 HD22 LEU 14 49.665 -8.161 -5.071
113 HD23 LEU 14 HD23 LEU 14 49.624 -9.267 -3.702
114 H HIS 15 HN HIS 15 50.168 -9.511 0.997
115 HA HIS 15 HA HIS 15 50.684 -12.158 -0.106
116 HB2 HIS 15 HB2 HIS 15 52.007 -11.222 1.779
117 HB3 HIS 15 HB1 HIS 15 50.560 -11.250 2.787
118 HD1 HIS 15 HD1 HIS 15 51.454 -13.995 0.352
119 HD2 HIS 15 HD2 HIS 15 51.391 -13.354 4.471
120 HE1 HIS 15 HE1 HIS 15 51.870 -16.246 1.433
121 H ASP 16 HN ASP 16 48.086 -10.607 1.684
122 HA ASP 16 HA ASP 16 46.696 -13.085 2.286
123 HB2 ASP 16 HB2 ASP 16 46.458 -10.896 3.554
124 HB3 ASP 16 HB1 ASP 16 45.507 -10.307 2.190
125 H LEU 17 HN LEU 17 46.597 -10.724 -0.343
126 HA LEU 17 HA LEU 17 44.144 -11.776 -1.477
127 HB2 LEU 17 HB2 LEU 17 46.292 -9.987 -2.645
128 HB3 LEU 17 HB1 LEU 17 44.790 -10.379 -3.467
129 HG LEU 17 HG LEU 17 44.797 -9.224 -0.672
130 HD11 LEU 17 HD11 LEU 17 46.002 -7.568 -1.865
131 HD12 LEU 17 HD12 LEU 17 44.330 -7.008 -1.897
132 HD13 LEU 17 HD13 LEU 17 45.027 -7.786 -3.317
133 HD21 LEU 17 HD21 LEU 17 42.553 -8.320 -1.630
134 HD22 LEU 17 HD22 LEU 17 42.642 -10.032 -1.234
135 HD23 LEU 17 HD23 LEU 17 42.777 -9.508 -2.907
136 H MET 18 HN MET 18 47.533 -12.642 -1.801
137 HA MET 18 HA MET 18 46.957 -14.261 -4.221
138 HB2 MET 18 HB2 MET 18 49.404 -13.329 -2.785
139 HB3 MET 18 HB1 MET 18 49.537 -14.892 -3.588
140 HG2 MET 18 HG2 MET 18 49.174 -13.980 -5.713
141 HG3 MET 18 HG1 MET 18 48.356 -12.554 -5.077
142 HE1 MET 18 HE1 MET 18 51.573 -11.293 -6.929
143 HE2 MET 18 HE2 MET 18 49.845 -11.619 -7.045
144 HE3 MET 18 HE3 MET 18 50.998 -12.935 -7.246
145 H THR 19 HN THR 19 46.732 -14.645 -0.867
146 HA THR 19 HA THR 19 47.380 -17.542 -0.934
147 HB THR 19 HB THR 19 46.554 -17.274 1.560
148 HG1 THR 19 HG1 THR 19 47.112 -14.603 0.785
149 HG21 THR 19 HG21 THR 19 48.800 -16.526 2.211
150 HG22 THR 19 HG22 THR 19 49.083 -15.909 0.583
151 HG23 THR 19 HG23 THR 19 48.902 -17.643 0.851
152 H GLY 20 HN GLY 20 44.720 -15.609 -1.646
153 HA2 GLY 20 HA2 GLY 20 42.808 -17.095 -2.516
154 HA3 GLY 20 HA1 GLY 20 42.781 -17.781 -0.893
155 H LYS 21 HN LYS 21 43.023 -15.506 0.691
156 HA LYS 21 HA LYS 21 40.407 -14.561 0.902
157 HB2 LYS 21 HB2 LYS 21 43.036 -13.339 1.727
158 HB3 LYS 21 HB1 LYS 21 41.526 -12.486 2.018
159 HG2 LYS 21 HG2 LYS 21 42.299 -13.886 3.939
160 HG3 LYS 21 HG1 LYS 21 40.690 -14.305 3.355
161 HD2 LYS 21 HD2 LYS 21 41.525 -16.231 2.188
162 HD3 LYS 21 HD1 LYS 21 43.199 -15.733 2.445
163 HE2 LYS 21 HE2 LYS 21 42.898 -16.008 4.885
164 HE3 LYS 21 HE1 LYS 21 41.238 -16.537 4.613
165 HZ1 LYS 21 HZ1 LYS 21 42.473 -18.187 2.990
166 HZ2 LYS 21 HZ2 LYS 21 42.263 -18.541 4.638
167 HZ3 LYS 21 HZ3 LYS 21 43.747 -17.931 4.079
168 H ARG 22 HN ARG 22 39.445 -13.897 -1.031
169 HA ARG 22 HA ARG 22 40.725 -12.166 -2.916
170 HB2 ARG 22 HB2 ARG 22 38.762 -13.778 -3.306
171 HB3 ARG 22 HB1 ARG 22 37.743 -12.522 -2.606
172 HG2 ARG 22 HG2 ARG 22 38.767 -10.926 -4.300
173 HG3 ARG 22 HG1 ARG 22 39.453 -12.343 -5.090
174 HD2 ARG 22 HD2 ARG 22 36.497 -11.991 -4.517
175 HD3 ARG 22 HD1 ARG 22 37.253 -11.623 -6.068
176 HE ARG 22 HE ARG 22 38.028 -14.234 -5.561
177 HH11 ARG 22 HH21 ARG 22 35.062 -12.477 -5.666
178 HH12 ARG 22 HH22 ARG 22 34.123 -13.834 -6.189
179 HH21 ARG 22 HH11 ARG 22 36.818 -16.016 -6.244
180 HH22 ARG 22 HH12 ARG 22 35.117 -15.838 -6.517
181 H VAL 23 HN VAL 23 38.186 -11.568 -0.452
182 HA VAL 23 HA VAL 23 38.356 -8.652 -0.953
183 HB VAL 23 HB VAL 23 36.761 -8.651 1.110
184 HG11 VAL 23 HG11 VAL 23 35.923 -8.317 -1.140
185 HG12 VAL 23 HG12 VAL 23 34.862 -9.465 -0.322
186 HG13 VAL 23 HG13 VAL 23 36.051 -10.041 -1.490
187 HG21 VAL 23 HG21 VAL 23 37.514 -11.012 1.749
188 HG22 VAL 23 HG22 VAL 23 36.567 -11.586 0.376
189 HG23 VAL 23 HG23 VAL 23 35.770 -10.752 1.709
190 H ALA 24 HN ALA 24 39.544 -7.244 0.220
191 HA ALA 24 HA ALA 24 40.654 -8.082 2.867
192 HB1 ALA 24 HB1 ALA 24 42.312 -6.896 0.619
193 HB2 ALA 24 HB2 ALA 24 42.423 -8.555 1.208
194 HB3 ALA 24 HB3 ALA 24 42.881 -7.214 2.256
195 H THR 25 HN THR 25 41.048 -6.288 4.262
196 HA THR 25 HA THR 25 39.721 -3.744 3.360
197 HB THR 25 HB THR 25 40.433 -4.604 6.179
198 HG1 THR 25 HG1 THR 25 38.539 -5.583 6.275
199 HG21 THR 25 HG21 THR 25 38.627 -2.943 6.717
200 HG22 THR 25 HG22 THR 25 38.600 -2.501 5.009
201 HG23 THR 25 HG23 THR 25 40.055 -2.227 5.968
202 H VAL 26 HN VAL 26 40.824 -1.779 3.478
203 HA VAL 26 HA VAL 26 43.510 -1.693 4.684
204 HB VAL 26 HB VAL 26 44.101 -0.433 2.321
205 HG11 VAL 26 HG11 VAL 26 44.337 -3.426 2.765
206 HG12 VAL 26 HG12 VAL 26 45.429 -2.220 3.445
207 HG13 VAL 26 HG13 VAL 26 45.340 -2.442 1.699
208 HG21 VAL 26 HG21 VAL 26 42.330 -2.777 1.577
209 HG22 VAL 26 HG22 VAL 26 43.233 -1.741 0.474
210 HG23 VAL 26 HG23 VAL 26 41.878 -1.081 1.391
211 H GLN 27 HN GLN 27 44.072 0.322 5.331
212 HA GLN 27 HA GLN 27 41.917 2.309 5.457
213 HB2 GLN 27 HB2 GLN 27 44.664 2.885 6.535
214 HB3 GLN 27 HB1 GLN 27 43.087 3.251 7.230
215 HG2 GLN 27 HG2 GLN 27 43.836 1.520 8.615
216 HG3 GLN 27 HG1 GLN 27 42.859 0.642 7.441
217 HE21 GLN 27 HE21 GLN 27 44.810 -0.840 8.713
218 HE22 GLN 27 HE22 GLN 27 46.109 -1.148 7.665
219 H LYS 28 HN LYS 28 41.722 3.295 3.452
220 HA LYS 28 HA LYS 28 44.174 4.384 2.141
221 HB2 LYS 28 HB2 LYS 28 42.437 3.127 0.784
222 HB3 LYS 28 HB1 LYS 28 41.326 4.468 1.094
223 HG2 LYS 28 HG2 LYS 28 42.818 6.033 0.005
224 HG3 LYS 28 HG1 LYS 28 44.066 4.799 -0.161
225 HD2 LYS 28 HD2 LYS 28 42.635 3.501 -1.658
226 HD3 LYS 28 HD1 LYS 28 41.322 4.660 -1.442
227 HE2 LYS 28 HE2 LYS 28 44.042 5.322 -2.610
228 HE3 LYS 28 HE1 LYS 28 42.576 5.054 -3.553
229 HZ1 LYS 28 HZ1 LYS 28 43.021 7.182 -1.533
230 HZ2 LYS 28 HZ2 LYS 28 41.535 6.882 -2.299
231 HZ3 LYS 28 HZ3 LYS 28 42.876 7.390 -3.210
232 H ASP 29 HN ASP 29 44.695 6.490 2.938
233 HA ASP 29 HA ASP 29 44.334 8.735 3.632
234 HB2 ASP 29 HB2 ASP 29 41.629 8.589 2.293
235 HB3 ASP 29 HB1 ASP 29 42.735 9.957 2.413
236 H GLY 30 HN GLY 30 43.289 6.378 5.216
237 HA2 GLY 30 HA2 GLY 30 42.382 6.396 7.423
238 HA3 GLY 30 HA1 GLY 30 41.679 7.980 7.102
239 H ARG 31 HN ARG 31 40.684 6.661 4.437
240 HA ARG 31 HA ARG 31 38.113 5.790 5.608
241 HB2 ARG 31 HB2 ARG 31 38.913 7.123 3.205
242 HB3 ARG 31 HB1 ARG 31 38.175 5.607 2.701
243 HG2 ARG 31 HG2 ARG 31 36.875 7.524 4.664
244 HG3 ARG 31 HG1 ARG 31 36.566 7.550 2.930
245 HD2 ARG 31 HD2 ARG 31 36.248 4.986 4.491
246 HD3 ARG 31 HD1 ARG 31 34.955 6.182 4.453
247 HE ARG 31 HE ARG 31 35.611 5.839 1.783
248 HH11 ARG 31 HH21 ARG 31 34.769 3.804 4.437
249 HH12 ARG 31 HH22 ARG 31 33.995 2.610 3.448
250 HH21 ARG 31 HH11 ARG 31 34.604 4.293 0.478
251 HH22 ARG 31 HH12 ARG 31 33.903 2.887 1.206
252 H ARG 32 HN ARG 32 37.327 3.753 5.511
253 HA ARG 32 HA ARG 32 39.234 1.583 4.870
254 HB2 ARG 32 HB2 ARG 32 36.543 1.722 6.245
255 HB3 ARG 32 HB1 ARG 32 37.296 0.180 5.838
256 HG2 ARG 32 HG2 ARG 32 39.328 0.888 7.107
257 HG3 ARG 32 HG1 ARG 32 38.473 2.351 7.595
258 HD2 ARG 32 HD2 ARG 32 36.696 0.919 8.613
259 HD3 ARG 32 HD1 ARG 32 37.664 -0.502 8.220
260 HE ARG 32 HE ARG 32 39.403 1.103 9.659
261 HH11 ARG 32 HH21 ARG 32 36.231 -0.173 10.098
262 HH12 ARG 32 HH22 ARG 32 36.367 -0.276 11.822
263 HH21 ARG 32 HH11 ARG 32 39.599 0.977 11.907
264 HH22 ARG 32 HH12 ARG 32 38.273 0.375 12.846
265 H VAL 33 HN VAL 33 39.072 0.339 3.041
266 HA VAL 33 HA VAL 33 36.469 0.178 1.608
267 HB VAL 33 HB VAL 33 39.035 1.148 0.302
268 HG11 VAL 33 HG11 VAL 33 37.550 1.189 -1.763
269 HG12 VAL 33 HG12 VAL 33 36.393 0.219 -0.859
270 HG13 VAL 33 HG13 VAL 33 37.999 -0.422 -1.207
271 HG21 VAL 33 HG21 VAL 33 37.884 3.006 1.282
272 HG22 VAL 33 HG22 VAL 33 36.309 2.369 0.814
273 HG23 VAL 33 HG23 VAL 33 37.400 3.008 -0.412
274 H GLU 34 HN GLU 34 36.249 -1.688 0.408
275 HA GLU 34 HA GLU 34 38.340 -3.775 0.901
276 HB2 GLU 34 HB2 GLU 34 35.337 -3.932 0.534
277 HB3 GLU 34 HB1 GLU 34 36.373 -5.362 0.559
278 HG2 GLU 34 HG2 GLU 34 35.540 -5.033 2.804
279 HG3 GLU 34 HG1 GLU 34 37.245 -4.576 2.805
280 H PHE 35 HN PHE 35 39.625 -3.787 -0.992
281 HA PHE 35 HA PHE 35 38.236 -3.777 -3.630
282 HB2 PHE 35 HB2 PHE 35 41.137 -3.630 -2.774
283 HB3 PHE 35 HB1 PHE 35 40.714 -4.006 -4.438
284 HD1 PHE 35 HD2 PHE 35 38.688 -2.318 -5.345
285 HD2 PHE 35 HD1 PHE 35 41.686 -1.406 -2.412
286 HE1 PHE 35 HE2 PHE 35 38.433 0.099 -5.824
287 HE2 PHE 35 HE1 PHE 35 41.441 1.000 -2.885
288 HZ PHE 35 HZ PHE 35 39.809 1.762 -4.600
289 H THR 36 HN THR 36 38.205 -5.647 -4.946
290 HA THR 36 HA THR 36 38.938 -8.191 -3.552
291 HB THR 36 HB THR 36 37.500 -9.261 -5.281
292 HG1 THR 36 HG1 THR 36 36.262 -7.670 -6.562
293 HG21 THR 36 HG21 THR 36 36.421 -7.006 -3.613
294 HG22 THR 36 HG22 THR 36 36.203 -8.743 -3.421
295 HG23 THR 36 HG23 THR 36 35.344 -7.884 -4.696
296 H ALA 37 HN ALA 37 40.025 -9.910 -5.028
297 HA ALA 37 HA ALA 37 42.417 -8.975 -6.157
298 HB1 ALA 37 HB1 ALA 37 42.382 -11.152 -7.508
299 HB2 ALA 37 HB2 ALA 37 40.809 -11.457 -6.775
300 HB3 ALA 37 HB3 ALA 37 42.243 -11.316 -5.758
301 H THR 38 HN THR 38 39.305 -8.537 -7.425
302 HA THR 38 HA THR 38 39.851 -8.623 -10.234
303 HB THR 38 HB THR 38 37.819 -7.229 -10.462
304 HG1 THR 38 HG1 THR 38 36.907 -6.999 -8.095
305 HG21 THR 38 HG21 THR 38 37.204 -9.148 -8.232
306 HG22 THR 38 HG22 THR 38 37.830 -9.774 -9.759
307 HG23 THR 38 HG23 THR 38 36.322 -8.862 -9.730
308 H SER 39 HN SER 39 40.493 -6.228 -7.765
309 HA SER 39 HA SER 39 41.595 -4.381 -9.872
310 HB2 SER 39 HB2 SER 39 41.046 -2.522 -8.418
311 HB3 SER 39 HB1 SER 39 39.596 -3.496 -8.630
312 HG SER 39 HG SER 39 40.649 -4.594 -6.615
313 H VAL 40 HN VAL 40 43.266 -6.359 -9.029
314 HA VAL 40 HA VAL 40 44.811 -5.442 -6.698
315 HB VAL 40 HB VAL 40 44.639 -7.830 -7.027
316 HG11 VAL 40 HG11 VAL 40 46.039 -7.424 -9.706
317 HG12 VAL 40 HG12 VAL 40 44.309 -7.735 -9.535
318 HG13 VAL 40 HG13 VAL 40 45.481 -8.955 -9.034
319 HG21 VAL 40 HG21 VAL 40 46.968 -8.408 -6.862
320 HG22 VAL 40 HG22 VAL 40 46.845 -6.755 -6.251
321 HG23 VAL 40 HG23 VAL 40 47.444 -7.053 -7.883
322 H SER 41 HN SER 41 44.757 -4.621 -10.024
323 HA SER 41 HA SER 41 47.593 -4.116 -10.352
324 HB2 SER 41 HB2 SER 41 46.855 -2.801 -12.339
325 HB3 SER 41 HB1 SER 41 46.175 -4.426 -12.310
326 HG SER 41 HG SER 41 44.870 -2.175 -12.475
327 H ASP 42 HN ASP 42 44.777 -2.016 -9.679
328 HA ASP 42 HA ASP 42 46.172 0.438 -9.486
329 HB2 ASP 42 HB2 ASP 42 44.286 0.989 -7.770
330 HB3 ASP 42 HB1 ASP 42 43.818 0.590 -9.423
331 H LEU 43 HN LEU 43 45.896 -2.244 -7.120
332 HA LEU 43 HA LEU 43 46.965 -0.755 -4.909
333 HB2 LEU 43 HB2 LEU 43 45.779 -3.077 -4.935
334 HB3 LEU 43 HB1 LEU 43 47.373 -3.723 -5.308
335 HG LEU 43 HG LEU 43 48.271 -2.697 -3.226
336 HD11 LEU 43 HD11 LEU 43 46.225 -2.044 -1.586
337 HD12 LEU 43 HD12 LEU 43 45.488 -1.566 -3.115
338 HD13 LEU 43 HD13 LEU 43 47.014 -0.845 -2.605
339 HD21 LEU 43 HD21 LEU 43 47.212 -5.016 -3.351
340 HD22 LEU 43 HD22 LEU 43 45.770 -4.301 -2.631
341 HD23 LEU 43 HD23 LEU 43 47.291 -4.303 -1.740
342 H LYS 44 HN LYS 44 48.420 -2.597 -7.557
343 HA LYS 44 HA LYS 44 51.120 -2.499 -6.548
344 HB2 LYS 44 HB2 LYS 44 49.823 -3.056 -9.193
345 HB3 LYS 44 HB1 LYS 44 51.538 -2.653 -9.214
346 HG2 LYS 44 HG2 LYS 44 52.093 -4.497 -7.808
347 HG3 LYS 44 HG1 LYS 44 50.405 -4.777 -7.385
348 HD2 LYS 44 HD2 LYS 44 49.884 -5.577 -9.570
349 HD3 LYS 44 HD1 LYS 44 51.407 -4.979 -10.229
350 HE2 LYS 44 HE2 LYS 44 51.241 -7.109 -8.085
351 HE3 LYS 44 HE1 LYS 44 51.365 -7.469 -9.808
352 HZ1 LYS 44 HZ1 LYS 44 53.517 -6.935 -9.834
353 HZ2 LYS 44 HZ2 LYS 44 53.454 -7.068 -8.141
354 HZ3 LYS 44 HZ3 LYS 44 53.295 -5.548 -8.882
355 H LYS 45 HN LYS 45 49.297 -0.370 -8.768
356 HA LYS 45 HA LYS 45 51.466 1.427 -9.275
357 HB2 LYS 45 HB2 LYS 45 49.568 1.460 -10.731
358 HB3 LYS 45 HB1 LYS 45 48.460 1.730 -9.392
359 HG2 LYS 45 HG2 LYS 45 50.611 3.784 -9.709
360 HG3 LYS 45 HG1 LYS 45 49.416 3.743 -10.999
361 HD2 LYS 45 HD2 LYS 45 48.458 3.711 -8.143
362 HD3 LYS 45 HD1 LYS 45 49.007 5.232 -8.841
363 HE2 LYS 45 HE2 LYS 45 46.476 4.561 -9.054
364 HE3 LYS 45 HE1 LYS 45 47.301 5.270 -10.442
365 HZ1 LYS 45 HZ1 LYS 45 46.767 2.397 -9.941
366 HZ2 LYS 45 HZ2 LYS 45 47.794 2.957 -11.172
367 HZ3 LYS 45 HZ3 LYS 45 46.144 3.359 -11.190
368 H TYR 46 HN TYR 46 48.887 1.427 -6.827
369 HA TYR 46 HA TYR 46 49.454 3.943 -5.643
370 HB2 TYR 46 HB2 TYR 46 47.459 2.609 -5.098
371 HB3 TYR 46 HB1 TYR 46 48.474 1.379 -4.356
372 HD1 TYR 46 HD1 TYR 46 48.077 5.120 -4.178
373 HD2 TYR 46 HD2 TYR 46 48.563 1.431 -2.022
374 HE1 TYR 46 HE1 TYR 46 47.973 6.356 -2.033
375 HE2 TYR 46 HE2 TYR 46 48.458 2.669 0.121
376 HH TYR 46 HH TYR 46 47.286 5.689 0.444
377 H ILE 47 HN ILE 47 50.660 0.701 -4.739
378 HA ILE 47 HA ILE 47 52.442 1.506 -2.696
379 HB ILE 47 HB ILE 47 52.759 -0.723 -4.726
380 HG12 ILE 47 HG12 ILE 47 51.801 -1.019 -1.874
381 HG13 ILE 47 HG11 ILE 47 50.666 -0.600 -3.156
382 HG21 ILE 47 HG21 ILE 47 54.156 -1.724 -2.839
383 HG22 ILE 47 HG22 ILE 47 54.154 -0.118 -2.112
384 HG23 ILE 47 HG23 ILE 47 54.884 -0.367 -3.698
385 HD11 ILE 47 HD11 ILE 47 50.898 -2.642 -4.225
386 HD12 ILE 47 HD12 ILE 47 51.140 -3.141 -2.552
387 HD13 ILE 47 HD13 ILE 47 52.529 -2.909 -3.615
388 H ALA 48 HN ALA 48 52.965 1.190 -6.201
389 HA ALA 48 HA ALA 48 55.708 1.857 -6.253
390 HB1 ALA 48 HB1 ALA 48 55.331 2.461 -8.611
391 HB2 ALA 48 HB2 ALA 48 53.590 2.481 -8.328
392 HB3 ALA 48 HB3 ALA 48 54.487 0.967 -8.202
393 H GLU 49 HN GLU 49 52.860 3.938 -6.056
394 HA GLU 49 HA GLU 49 54.212 6.391 -6.656
395 HB2 GLU 49 HB2 GLU 49 51.739 6.042 -6.741
396 HB3 GLU 49 HB1 GLU 49 51.724 5.938 -4.982
397 HG2 GLU 49 HG2 GLU 49 51.146 8.193 -5.615
398 HG3 GLU 49 HG1 GLU 49 52.756 8.216 -4.903
399 H LEU 50 HN LEU 50 53.943 4.447 -3.752
400 HA LEU 50 HA LEU 50 54.842 6.635 -2.001
401 HB2 LEU 50 HB2 LEU 50 54.731 3.687 -1.329
402 HB3 LEU 50 HB1 LEU 50 54.699 5.051 -0.214
403 HG LEU 50 HG LEU 50 52.547 4.293 -2.211
404 HD11 LEU 50 HD11 LEU 50 52.396 2.916 -0.266
405 HD12 LEU 50 HD12 LEU 50 51.203 4.195 -0.042
406 HD13 LEU 50 HD13 LEU 50 52.745 4.271 0.807
407 HD21 LEU 50 HD21 LEU 50 51.338 6.238 -0.974
408 HD22 LEU 50 HD22 LEU 50 52.519 6.659 -2.210
409 HD23 LEU 50 HD23 LEU 50 52.957 6.755 -0.505
410 H GLU 51 HN GLU 51 56.299 3.890 -3.686
411 HA GLU 51 HA GLU 51 58.797 3.966 -2.251
412 HB2 GLU 51 HB2 GLU 51 57.967 2.873 -4.940
413 HB3 GLU 51 HB1 GLU 51 59.652 2.828 -4.423
414 HG2 GLU 51 HG2 GLU 51 57.391 1.734 -2.733
415 HG3 GLU 51 HG1 GLU 51 58.302 0.744 -3.876
416 H VAL 52 HN VAL 52 57.523 5.751 -5.006
417 HA VAL 52 HA VAL 52 60.128 6.959 -5.620
418 HB VAL 52 HB VAL 52 57.373 7.760 -6.609
419 HG11 VAL 52 HG11 VAL 52 60.204 8.322 -7.528
420 HG12 VAL 52 HG12 VAL 52 58.964 9.492 -7.076
421 HG13 VAL 52 HG13 VAL 52 58.801 8.566 -8.568
422 HG21 VAL 52 HG21 VAL 52 59.403 5.884 -7.865
423 HG22 VAL 52 HG22 VAL 52 57.835 6.328 -8.537
424 HG23 VAL 52 HG23 VAL 52 57.921 5.361 -7.065
425 H GLN 53 HN GLN 53 57.262 7.760 -3.728
426 HA GLN 53 HA GLN 53 58.047 10.557 -3.383
427 HB2 GLN 53 HB2 GLN 53 55.968 8.814 -2.035
428 HB3 GLN 53 HB1 GLN 53 56.228 10.507 -1.612
429 HG2 GLN 53 HG2 GLN 53 55.660 9.580 -4.438
430 HG3 GLN 53 HG1 GLN 53 54.398 10.106 -3.324
431 HE21 GLN 53 HE21 GLN 53 55.244 11.462 -5.843
432 HE22 GLN 53 HE22 GLN 53 55.754 13.015 -5.386
433 H THR 54 HN THR 54 58.352 7.544 -1.534
434 HA THR 54 HA THR 54 59.554 8.942 0.750
435 HB THR 54 HB THR 54 59.668 5.954 0.342
436 HG1 THR 54 HG1 THR 54 57.557 5.812 0.993
437 HG21 THR 54 HG21 THR 54 59.288 5.983 2.787
438 HG22 THR 54 HG22 THR 54 59.202 7.744 2.743
439 HG23 THR 54 HG23 THR 54 60.712 6.925 2.343
440 H GLY 55 HN GLY 55 60.733 8.699 -2.143
441 HA2 GLY 55 HA2 GLY 55 63.292 7.355 -1.656
442 HA3 GLY 55 HA1 GLY 55 62.858 8.262 -3.106
443 H MET 56 HN MET 56 61.976 10.577 -1.406
444 HA MET 56 HA MET 56 64.560 11.921 -1.301
445 HB2 MET 56 HB2 MET 56 62.594 13.182 -1.990
446 HB3 MET 56 HB1 MET 56 61.776 12.800 -0.475
447 HG2 MET 56 HG2 MET 56 63.316 14.120 0.798
448 HG3 MET 56 HG1 MET 56 64.409 14.287 -0.577
449 HE1 MET 56 HE1 MET 56 60.949 14.654 0.703
450 HE2 MET 56 HE2 MET 56 60.366 14.615 -0.959
451 HE3 MET 56 HE3 MET 56 60.257 16.108 -0.028
452 H THR 57 HN THR 57 65.904 11.437 0.382
453 HA THR 57 HA THR 57 64.888 11.781 3.136
454 HB THR 57 HB THR 57 65.876 9.608 3.865
455 HG1 THR 57 HG1 THR 57 66.162 8.101 2.036
456 HG21 THR 57 HG21 THR 57 63.840 9.154 1.679
457 HG22 THR 57 HG22 THR 57 63.427 9.928 3.210
458 HG23 THR 57 HG23 THR 57 64.022 8.269 3.193
459 H GLN 58 HN GLN 58 67.052 11.023 4.574
460 HA GLN 58 HA GLN 58 69.188 12.834 3.539
461 HB2 GLN 58 HB2 GLN 58 68.682 11.703 6.312
462 HB3 GLN 58 HB1 GLN 58 69.997 12.800 5.893
463 HG2 GLN 58 HG2 GLN 58 68.286 14.451 5.089
464 HG3 GLN 58 HG1 GLN 58 67.030 13.383 5.715
465 HE21 GLN 58 HE21 GLN 58 68.262 16.171 6.590
466 HE22 GLN 58 HE22 GLN 58 68.447 15.974 8.266
467 H ARG 59 HN ARG 59 71.033 11.422 5.543
468 HA ARG 59 HA ARG 59 71.399 8.731 4.574
469 HB2 ARG 59 HB2 ARG 59 73.376 9.067 3.200
470 HB3 ARG 59 HB1 ARG 59 72.068 10.055 2.548
471 HG2 ARG 59 HG2 ARG 59 72.987 11.972 3.961
472 HG3 ARG 59 HG1 ARG 59 74.408 10.963 4.237
473 HD2 ARG 59 HD2 ARG 59 74.747 10.788 1.789
474 HD3 ARG 59 HD1 ARG 59 73.347 11.829 1.530
475 HE ARG 59 HE ARG 59 74.976 13.320 3.203
476 HH11 ARG 59 HH21 ARG 59 75.323 11.653 0.206
477 HH12 ARG 59 HH22 ARG 59 76.529 12.735 -0.410
478 HH21 ARG 59 HH11 ARG 59 76.548 14.742 2.418
479 HH22 ARG 59 HH12 ARG 59 77.222 14.484 0.844
480 H ARG 60 HN ARG 60 72.890 7.655 5.877
481 HA ARG 60 HA ARG 60 73.675 8.892 8.333
482 HB2 ARG 60 HB2 ARG 60 74.775 6.386 7.022
483 HB3 ARG 60 HB1 ARG 60 74.982 6.829 8.714
484 HG2 ARG 60 HG2 ARG 60 72.227 6.586 7.496
485 HG3 ARG 60 HG1 ARG 60 73.073 5.169 8.111
486 HD2 ARG 60 HD2 ARG 60 73.365 6.437 10.304
487 HD3 ARG 60 HD1 ARG 60 72.243 7.635 9.660
488 HE ARG 60 HE ARG 60 70.902 5.235 9.341
489 HH11 ARG 60 HH21 ARG 60 72.477 6.905 11.913
490 HH12 ARG 60 HH22 ARG 60 71.446 6.257 13.145
491 HH21 ARG 60 HH11 ARG 60 69.545 4.378 10.934
492 HH22 ARG 60 HH12 ARG 60 69.786 4.825 12.590
493 H ARG 61 HN ARG 61 75.359 10.237 8.713
494 HA ARG 61 HA ARG 61 77.223 10.970 6.650
495 HB2 ARG 61 HB2 ARG 61 78.394 12.191 8.515
496 HB3 ARG 61 HB1 ARG 61 76.675 12.567 8.391
497 HG2 ARG 61 HG2 ARG 61 76.194 10.904 10.160
498 HG3 ARG 61 HG1 ARG 61 77.917 10.571 10.308
499 HD2 ARG 61 HD2 ARG 61 77.851 13.329 10.569
500 HD3 ARG 61 HD1 ARG 61 76.354 12.855 11.365
501 HE ARG 61 HE ARG 61 78.900 12.656 12.528
502 HH11 ARG 61 HH21 ARG 61 76.257 10.543 11.828
503 HH12 ARG 61 HH22 ARG 61 76.700 9.389 13.035
504 HH21 ARG 61 HH11 ARG 61 79.469 11.166 14.108
505 HH22 ARG 61 HH12 ARG 61 78.509 9.742 14.328
506 H GLY 62 HN GLY 62 79.726 11.018 7.749
507 HA2 GLY 62 HA2 GLY 62 80.655 8.339 7.336
508 HA3 GLY 62 HA1 GLY 62 81.632 9.665 7.970
Start of MODEL 18
1 H1 MET 1 HT1 MET 1 56.313 9.490 7.783
2 H2 MET 1 HT2 MET 1 57.939 9.912 7.528
3 H3 MET 1 HT3 MET 1 57.147 10.391 8.953
4 HA MET 1 HA MET 1 58.417 7.889 8.301
5 HB2 MET 1 HB2 MET 1 58.962 9.503 10.193
6 HB3 MET 1 HB1 MET 1 57.454 8.990 10.952
7 HG2 MET 1 HG2 MET 1 59.193 7.619 11.884
8 HG3 MET 1 HG1 MET 1 58.294 6.602 10.756
9 HE1 MET 1 HE1 MET 1 61.351 6.058 11.854
10 HE2 MET 1 HE2 MET 1 61.878 5.265 10.372
11 HE3 MET 1 HE3 MET 1 60.239 5.008 10.963
12 H VAL 2 HN VAL 2 55.218 8.972 9.322
13 HA VAL 2 HA VAL 2 54.248 6.443 10.247
14 HB VAL 2 HB VAL 2 52.641 8.635 8.902
15 HG11 VAL 2 HG11 VAL 2 51.376 6.587 9.233
16 HG12 VAL 2 HG12 VAL 2 50.861 7.763 10.443
17 HG13 VAL 2 HG13 VAL 2 51.954 6.454 10.895
18 HG21 VAL 2 HG21 VAL 2 53.997 9.612 10.679
19 HG22 VAL 2 HG22 VAL 2 53.540 8.317 11.784
20 HG23 VAL 2 HG23 VAL 2 52.330 9.481 11.241
21 H ARG 3 HN ARG 3 54.484 7.878 7.027
22 HA ARG 3 HA ARG 3 52.824 6.111 5.584
23 HB2 ARG 3 HB2 ARG 3 55.474 7.330 4.741
24 HB3 ARG 3 HB1 ARG 3 54.297 6.607 3.643
25 HG2 ARG 3 HG2 ARG 3 52.632 8.263 4.235
26 HG3 ARG 3 HG1 ARG 3 53.673 8.919 5.499
27 HD2 ARG 3 HD2 ARG 3 54.406 8.874 2.559
28 HD3 ARG 3 HD1 ARG 3 53.700 10.267 3.377
29 HE ARG 3 HE ARG 3 55.906 9.639 4.930
30 HH11 ARG 3 HH21 ARG 3 55.286 10.249 1.593
31 HH12 ARG 3 HH22 ARG 3 56.848 10.930 1.290
32 HH21 ARG 3 HH11 ARG 3 57.951 10.526 4.552
33 HH22 ARG 3 HH12 ARG 3 58.358 11.088 2.965
34 H GLN 4 HN GLN 4 55.831 5.510 7.184
35 HA GLN 4 HA GLN 4 56.684 3.226 5.662
36 HB2 GLN 4 HB2 GLN 4 58.069 4.523 7.351
37 HB3 GLN 4 HB1 GLN 4 57.163 3.690 8.615
38 HG2 GLN 4 HG2 GLN 4 57.874 1.510 7.673
39 HG3 GLN 4 HG1 GLN 4 58.813 2.359 6.445
40 HE21 GLN 4 HE21 GLN 4 59.759 4.500 8.219
41 HE22 GLN 4 HE22 GLN 4 60.871 3.796 9.291
42 H GLU 5 HN GLU 5 54.626 3.581 8.543
43 HA GLU 5 HA GLU 5 54.217 0.732 8.864
44 HB2 GLU 5 HB2 GLU 5 53.918 2.500 10.665
45 HB3 GLU 5 HB1 GLU 5 52.414 2.949 9.860
46 HG2 GLU 5 HG2 GLU 5 51.816 1.384 11.572
47 HG3 GLU 5 HG1 GLU 5 51.725 0.506 10.045
48 H GLU 6 HN GLU 6 52.445 3.329 7.210
49 HA GLU 6 HA GLU 6 50.145 1.720 6.596
50 HB2 GLU 6 HB2 GLU 6 49.822 4.062 6.439
51 HB3 GLU 6 HB1 GLU 6 51.258 4.293 5.448
52 HG2 GLU 6 HG2 GLU 6 49.067 4.435 4.193
53 HG3 GLU 6 HG1 GLU 6 50.205 3.256 3.546
54 H LEU 7 HN LEU 7 53.355 1.833 5.267
55 HA LEU 7 HA LEU 7 52.598 0.724 2.674
56 HB2 LEU 7 HB2 LEU 7 54.774 2.058 3.407
57 HB3 LEU 7 HB1 LEU 7 55.371 0.456 3.828
58 HG LEU 7 HG LEU 7 54.267 1.239 1.111
59 HD11 LEU 7 HD11 LEU 7 56.486 2.276 1.785
60 HD12 LEU 7 HD12 LEU 7 56.542 1.265 0.341
61 HD13 LEU 7 HD13 LEU 7 57.133 0.639 1.880
62 HD21 LEU 7 HD21 LEU 7 55.369 -1.318 2.284
63 HD22 LEU 7 HD22 LEU 7 55.501 -1.000 0.554
64 HD23 LEU 7 HD23 LEU 7 53.916 -1.082 1.315
65 H ALA 8 HN ALA 8 54.152 -0.565 5.624
66 HA ALA 8 HA ALA 8 54.345 -3.259 4.778
67 HB1 ALA 8 HB1 ALA 8 53.833 -2.198 7.575
68 HB2 ALA 8 HB2 ALA 8 55.416 -2.439 6.837
69 HB3 ALA 8 HB3 ALA 8 54.387 -3.827 7.190
70 H ALA 9 HN ALA 9 51.578 -1.398 5.779
71 HA ALA 9 HA ALA 9 49.878 -3.675 6.393
72 HB1 ALA 9 HB1 ALA 9 49.259 -1.599 7.398
73 HB2 ALA 9 HB2 ALA 9 48.036 -1.913 6.165
74 HB3 ALA 9 HB3 ALA 9 49.325 -0.750 5.852
75 H ALA 10 HN ALA 10 49.942 -1.362 3.640
76 HA ALA 10 HA ALA 10 48.061 -2.787 2.053
77 HB1 ALA 10 HB1 ALA 10 49.429 -1.656 0.106
78 HB2 ALA 10 HB2 ALA 10 50.265 -0.840 1.428
79 HB3 ALA 10 HB3 ALA 10 48.525 -0.643 1.233
80 H ARG 11 HN ARG 11 51.445 -3.279 2.693
81 HA ARG 11 HA ARG 11 51.924 -5.141 0.524
82 HB2 ARG 11 HB2 ARG 11 53.542 -3.811 2.256
83 HB3 ARG 11 HB1 ARG 11 53.472 -5.353 3.097
84 HG2 ARG 11 HG2 ARG 11 55.249 -5.817 1.708
85 HG3 ARG 11 HG1 ARG 11 53.957 -6.288 0.611
86 HD2 ARG 11 HD2 ARG 11 54.069 -3.663 0.003
87 HD3 ARG 11 HD1 ARG 11 55.735 -3.881 0.532
88 HE ARG 11 HE ARG 11 54.708 -4.661 -1.988
89 HH11 ARG 11 HH21 ARG 11 56.513 -6.035 0.618
90 HH12 ARG 11 HH22 ARG 11 57.126 -7.341 -0.333
91 HH21 ARG 11 HH11 ARG 11 55.520 -6.344 -3.232
92 HH22 ARG 11 HH12 ARG 11 56.575 -7.512 -2.508
93 H ALA 12 HN ALA 12 51.256 -5.536 4.067
94 HA ALA 12 HA ALA 12 51.194 -8.346 4.116
95 HB1 ALA 12 HB1 ALA 12 49.684 -8.126 6.066
96 HB2 ALA 12 HB2 ALA 12 49.411 -6.436 5.649
97 HB3 ALA 12 HB3 ALA 12 51.012 -6.969 6.158
98 H ALA 13 HN ALA 13 49.146 -6.152 2.607
99 HA ALA 13 HA ALA 13 46.808 -7.866 2.421
100 HB1 ALA 13 HB1 ALA 13 45.831 -6.146 1.166
101 HB2 ALA 13 HB2 ALA 13 47.372 -5.622 0.489
102 HB3 ALA 13 HB3 ALA 13 46.976 -5.257 2.167
103 H LEU 14 HN LEU 14 49.566 -7.065 0.264
104 HA LEU 14 HA LEU 14 48.630 -8.553 -1.950
105 HB2 LEU 14 HB2 LEU 14 51.127 -7.313 -1.249
106 HB3 LEU 14 HB1 LEU 14 51.479 -8.911 -1.876
107 HG LEU 14 HG LEU 14 49.647 -6.967 -3.314
108 HD11 LEU 14 HD11 LEU 14 51.952 -6.023 -3.008
109 HD12 LEU 14 HD12 LEU 14 51.521 -6.321 -4.688
110 HD13 LEU 14 HD13 LEU 14 52.589 -7.440 -3.841
111 HD21 LEU 14 HD21 LEU 14 49.720 -9.549 -3.742
112 HD22 LEU 14 HD22 LEU 14 51.270 -9.210 -4.508
113 HD23 LEU 14 HD23 LEU 14 49.796 -8.454 -5.119
114 H HIS 15 HN HIS 15 50.085 -9.609 1.048
115 HA HIS 15 HA HIS 15 50.503 -12.349 0.124
116 HB2 HIS 15 HB2 HIS 15 51.798 -11.332 2.012
117 HB3 HIS 15 HB1 HIS 15 50.312 -11.291 2.962
118 HD1 HIS 15 HD1 HIS 15 51.287 -14.138 0.673
119 HD2 HIS 15 HD2 HIS 15 50.981 -13.352 4.755
120 HE1 HIS 15 HE1 HIS 15 51.597 -16.357 1.856
121 H ASP 16 HN ASP 16 47.959 -10.531 1.722
122 HA ASP 16 HA ASP 16 46.367 -12.861 2.420
123 HB2 ASP 16 HB2 ASP 16 45.368 -10.028 2.117
124 HB3 ASP 16 HB1 ASP 16 44.734 -11.297 3.162
125 H LEU 17 HN LEU 17 46.669 -10.819 -0.413
126 HA LEU 17 HA LEU 17 44.124 -11.742 -1.559
127 HB2 LEU 17 HB2 LEU 17 46.381 -10.135 -2.798
128 HB3 LEU 17 HB1 LEU 17 44.814 -10.416 -3.534
129 HG LEU 17 HG LEU 17 45.114 -9.129 -0.812
130 HD11 LEU 17 HD11 LEU 17 44.933 -6.959 -1.895
131 HD12 LEU 17 HD12 LEU 17 44.814 -7.720 -3.479
132 HD13 LEU 17 HD13 LEU 17 46.320 -7.811 -2.571
133 HD21 LEU 17 HD21 LEU 17 42.876 -9.849 -1.124
134 HD22 LEU 17 HD22 LEU 17 42.882 -9.419 -2.833
135 HD23 LEU 17 HD23 LEU 17 42.843 -8.157 -1.609
136 H MET 18 HN MET 18 47.463 -12.740 -1.640
137 HA MET 18 HA MET 18 47.035 -14.408 -4.048
138 HB2 MET 18 HB2 MET 18 49.325 -13.289 -2.625
139 HB3 MET 18 HB1 MET 18 49.567 -15.011 -2.893
140 HG2 MET 18 HG2 MET 18 50.468 -13.836 -4.799
141 HG3 MET 18 HG1 MET 18 48.986 -14.634 -5.322
142 HE1 MET 18 HE1 MET 18 48.874 -12.869 -7.511
143 HE2 MET 18 HE2 MET 18 50.460 -12.550 -6.814
144 HE3 MET 18 HE3 MET 18 49.408 -11.204 -7.241
145 H THR 19 HN THR 19 46.509 -14.716 -0.716
146 HA THR 19 HA THR 19 47.138 -17.611 -0.638
147 HB THR 19 HB THR 19 46.040 -17.289 1.734
148 HG1 THR 19 HG1 THR 19 45.258 -15.158 1.021
149 HG21 THR 19 HG21 THR 19 48.641 -15.913 0.996
150 HG22 THR 19 HG22 THR 19 48.452 -17.636 1.319
151 HG23 THR 19 HG23 THR 19 48.186 -16.464 2.609
152 H GLY 20 HN GLY 20 44.586 -15.742 -1.734
153 HA2 GLY 20 HA2 GLY 20 42.758 -17.165 -2.775
154 HA3 GLY 20 HA1 GLY 20 42.596 -17.937 -1.199
155 H LYS 21 HN LYS 21 42.633 -15.804 0.545
156 HA LYS 21 HA LYS 21 40.007 -14.813 0.457
157 HB2 LYS 21 HB2 LYS 21 42.338 -13.324 1.690
158 HB3 LYS 21 HB1 LYS 21 40.650 -13.278 2.194
159 HG2 LYS 21 HG2 LYS 21 40.920 -15.849 2.549
160 HG3 LYS 21 HG1 LYS 21 42.649 -15.514 2.504
161 HD2 LYS 21 HD2 LYS 21 42.229 -15.315 4.790
162 HD3 LYS 21 HD1 LYS 21 42.036 -13.641 4.276
163 HE2 LYS 21 HE2 LYS 21 39.605 -13.922 4.167
164 HE3 LYS 21 HE1 LYS 21 39.763 -15.632 4.571
165 HZ1 LYS 21 HZ1 LYS 21 40.970 -13.660 6.367
166 HZ2 LYS 21 HZ2 LYS 21 40.291 -15.176 6.721
167 HZ3 LYS 21 HZ3 LYS 21 39.285 -13.844 6.403
168 H ARG 22 HN ARG 22 39.204 -13.665 -1.240
169 HA ARG 22 HA ARG 22 40.934 -11.924 -2.817
170 HB2 ARG 22 HB2 ARG 22 39.042 -11.686 -4.281
171 HB3 ARG 22 HB1 ARG 22 39.123 -13.375 -3.778
172 HG2 ARG 22 HG2 ARG 22 37.480 -12.773 -1.925
173 HG3 ARG 22 HG1 ARG 22 37.255 -11.228 -2.747
174 HD2 ARG 22 HD2 ARG 22 35.526 -12.728 -3.523
175 HD3 ARG 22 HD1 ARG 22 36.681 -12.512 -4.839
176 HE ARG 22 HE ARG 22 37.603 -14.763 -3.510
177 HH11 ARG 22 HH21 ARG 22 34.618 -13.707 -4.875
178 HH12 ARG 22 HH22 ARG 22 34.092 -15.303 -5.294
179 HH21 ARG 22 HH11 ARG 22 36.932 -16.853 -4.049
180 HH22 ARG 22 HH12 ARG 22 35.402 -17.085 -4.826
181 H VAL 23 HN VAL 23 38.178 -11.461 -0.595
182 HA VAL 23 HA VAL 23 38.240 -8.544 -0.968
183 HB VAL 23 HB VAL 23 36.158 -9.788 -0.372
184 HG11 VAL 23 HG11 VAL 23 37.426 -11.362 1.208
185 HG12 VAL 23 HG12 VAL 23 35.874 -10.761 1.794
186 HG13 VAL 23 HG13 VAL 23 37.376 -10.052 2.388
187 HG21 VAL 23 HG21 VAL 23 35.394 -8.177 1.312
188 HG22 VAL 23 HG22 VAL 23 36.447 -7.364 0.154
189 HG23 VAL 23 HG23 VAL 23 37.062 -7.807 1.746
190 H ALA 24 HN ALA 24 39.360 -7.083 0.223
191 HA ALA 24 HA ALA 24 40.592 -7.912 2.812
192 HB1 ALA 24 HB1 ALA 24 42.343 -8.306 1.149
193 HB2 ALA 24 HB2 ALA 24 42.756 -6.892 2.118
194 HB3 ALA 24 HB3 ALA 24 42.111 -6.687 0.489
195 H THR 25 HN THR 25 41.095 -6.091 4.175
196 HA THR 25 HA THR 25 39.581 -3.605 3.420
197 HB THR 25 HB THR 25 40.545 -4.558 6.137
198 HG1 THR 25 HG1 THR 25 38.092 -4.727 6.252
199 HG21 THR 25 HG21 THR 25 38.848 -2.248 5.197
200 HG22 THR 25 HG22 THR 25 40.301 -2.195 6.197
201 HG23 THR 25 HG23 THR 25 38.795 -2.835 6.860
202 H VAL 26 HN VAL 26 40.592 -1.528 3.758
203 HA VAL 26 HA VAL 26 43.467 -1.510 4.452
204 HB VAL 26 HB VAL 26 43.184 -1.839 1.922
205 HG11 VAL 26 HG11 VAL 26 42.451 1.095 1.986
206 HG12 VAL 26 HG12 VAL 26 41.234 -0.176 1.848
207 HG13 VAL 26 HG13 VAL 26 42.466 0.008 0.602
208 HG21 VAL 26 HG21 VAL 26 45.244 -0.955 3.027
209 HG22 VAL 26 HG22 VAL 26 44.597 0.677 2.859
210 HG23 VAL 26 HG23 VAL 26 44.988 -0.269 1.423
211 H GLN 27 HN GLN 27 43.947 0.245 5.635
212 HA GLN 27 HA GLN 27 41.882 2.294 6.093
213 HB2 GLN 27 HB2 GLN 27 44.657 2.472 7.257
214 HB3 GLN 27 HB1 GLN 27 43.110 2.892 7.993
215 HG2 GLN 27 HG2 GLN 27 42.561 0.406 7.957
216 HG3 GLN 27 HG1 GLN 27 44.250 0.130 7.532
217 HE21 GLN 27 HE21 GLN 27 45.788 1.585 9.100
218 HE22 GLN 27 HE22 GLN 27 45.417 1.432 10.750
219 H LYS 28 HN LYS 28 41.793 4.064 4.757
220 HA LYS 28 HA LYS 28 44.358 5.179 3.686
221 HB2 LYS 28 HB2 LYS 28 43.235 3.784 1.956
222 HB3 LYS 28 HB1 LYS 28 41.804 4.806 2.102
223 HG2 LYS 28 HG2 LYS 28 42.956 6.719 1.278
224 HG3 LYS 28 HG1 LYS 28 44.531 5.950 1.475
225 HD2 LYS 28 HD2 LYS 28 43.975 4.320 -0.277
226 HD3 LYS 28 HD1 LYS 28 42.378 5.046 -0.459
227 HE2 LYS 28 HE2 LYS 28 43.882 5.900 -2.196
228 HE3 LYS 28 HE1 LYS 28 43.450 7.198 -1.084
229 HZ1 LYS 28 HZ1 LYS 28 45.521 7.201 -0.134
230 HZ2 LYS 28 HZ2 LYS 28 45.916 6.815 -1.742
231 HZ3 LYS 28 HZ3 LYS 28 45.855 5.594 -0.562
232 H ASP 29 HN ASP 29 44.430 7.397 4.303
233 HA ASP 29 HA ASP 29 43.594 9.507 5.040
234 HB2 ASP 29 HB2 ASP 29 41.435 8.863 3.006
235 HB3 ASP 29 HB1 ASP 29 41.919 10.465 3.567
236 H GLY 30 HN GLY 30 42.917 7.631 6.869
237 HA2 GLY 30 HA2 GLY 30 41.321 7.040 8.493
238 HA3 GLY 30 HA1 GLY 30 40.749 8.694 8.271
239 H ARG 31 HN ARG 31 40.715 6.064 5.878
240 HA ARG 31 HA ARG 31 37.791 5.778 6.164
241 HB2 ARG 31 HB2 ARG 31 38.097 7.701 4.598
242 HB3 ARG 31 HB1 ARG 31 39.058 6.665 3.552
243 HG2 ARG 31 HG2 ARG 31 36.704 6.836 2.780
244 HG3 ARG 31 HG1 ARG 31 37.154 5.185 3.188
245 HD2 ARG 31 HD2 ARG 31 34.867 6.198 4.058
246 HD3 ARG 31 HD1 ARG 31 35.821 5.140 5.096
247 HE ARG 31 HE ARG 31 36.766 7.660 5.717
248 HH11 ARG 31 HH21 ARG 31 33.678 6.151 5.493
249 HH12 ARG 31 HH22 ARG 31 32.964 7.127 6.734
250 HH21 ARG 31 HH11 ARG 31 35.855 8.944 7.336
251 HH22 ARG 31 HH12 ARG 31 34.196 8.708 7.777
252 H ARG 32 HN ARG 32 37.186 3.753 5.719
253 HA ARG 32 HA ARG 32 39.247 1.797 4.916
254 HB2 ARG 32 HB2 ARG 32 36.464 1.645 6.080
255 HB3 ARG 32 HB1 ARG 32 37.276 0.200 5.481
256 HG2 ARG 32 HG2 ARG 32 39.172 0.631 6.996
257 HG3 ARG 32 HG1 ARG 32 38.368 2.082 7.593
258 HD2 ARG 32 HD2 ARG 32 36.523 0.759 8.467
259 HD3 ARG 32 HD1 ARG 32 37.198 -0.710 7.761
260 HE ARG 32 HE ARG 32 39.228 0.231 9.395
261 HH11 ARG 32 HH21 ARG 32 35.877 -0.505 9.735
262 HH12 ARG 32 HH22 ARG 32 36.011 -0.972 11.397
263 HH21 ARG 32 HH11 ARG 32 39.423 -0.373 11.565
264 HH22 ARG 32 HH12 ARG 32 38.019 -0.897 12.433
265 H VAL 33 HN VAL 33 39.103 0.454 3.125
266 HA VAL 33 HA VAL 33 36.763 0.674 1.302
267 HB VAL 33 HB VAL 33 39.616 1.232 0.409
268 HG11 VAL 33 HG11 VAL 33 38.565 -0.161 -1.254
269 HG12 VAL 33 HG12 VAL 33 38.469 1.496 -1.846
270 HG13 VAL 33 HG13 VAL 33 37.052 0.735 -1.129
271 HG21 VAL 33 HG21 VAL 33 38.405 3.322 -0.509
272 HG22 VAL 33 HG22 VAL 33 38.672 3.262 1.229
273 HG23 VAL 33 HG23 VAL 33 37.082 2.880 0.569
274 H GLU 34 HN GLU 34 36.472 -1.182 0.083
275 HA GLU 34 HA GLU 34 38.217 -3.500 0.853
276 HB2 GLU 34 HB2 GLU 34 35.266 -3.198 0.321
277 HB3 GLU 34 HB1 GLU 34 36.024 -4.777 0.118
278 HG2 GLU 34 HG2 GLU 34 36.720 -4.843 2.403
279 HG3 GLU 34 HG1 GLU 34 36.351 -3.133 2.637
280 H PHE 35 HN PHE 35 39.699 -3.696 -0.869
281 HA PHE 35 HA PHE 35 38.628 -3.615 -3.651
282 HB2 PHE 35 HB2 PHE 35 41.376 -3.509 -2.427
283 HB3 PHE 35 HB1 PHE 35 41.233 -4.117 -4.069
284 HD1 PHE 35 HD1 PHE 35 39.350 -2.515 -5.473
285 HD2 PHE 35 HD2 PHE 35 42.063 -1.295 -2.367
286 HE1 PHE 35 HE1 PHE 35 39.281 -0.191 -6.317
287 HE2 PHE 35 HE2 PHE 35 41.989 1.028 -3.213
288 HZ PHE 35 HZ PHE 35 40.598 1.582 -5.191
289 H THR 36 HN THR 36 38.692 -5.485 -4.983
290 HA THR 36 HA THR 36 39.181 -8.069 -3.528
291 HB THR 36 HB THR 36 37.636 -9.095 -5.098
292 HG1 THR 36 HG1 THR 36 38.065 -7.975 -6.949
293 HG21 THR 36 HG21 THR 36 36.786 -7.645 -3.117
294 HG22 THR 36 HG22 THR 36 35.628 -8.125 -4.356
295 HG23 THR 36 HG23 THR 36 36.300 -6.496 -4.365
296 H ALA 37 HN ALA 37 39.938 -9.859 -5.206
297 HA ALA 37 HA ALA 37 42.439 -9.013 -6.314
298 HB1 ALA 37 HB1 ALA 37 42.265 -11.295 -7.554
299 HB2 ALA 37 HB2 ALA 37 40.776 -11.510 -6.632
300 HB3 ALA 37 HB3 ALA 37 42.314 -11.312 -5.793
301 H THR 38 HN THR 38 39.287 -8.634 -7.514
302 HA THR 38 HA THR 38 39.618 -8.951 -10.306
303 HB THR 38 HB THR 38 37.786 -7.258 -10.515
304 HG1 THR 38 HG1 THR 38 38.684 -6.150 -8.544
305 HG21 THR 38 HG21 THR 38 37.107 -9.058 -8.200
306 HG22 THR 38 HG22 THR 38 37.491 -9.752 -9.776
307 HG23 THR 38 HG23 THR 38 36.130 -8.644 -9.607
308 H SER 39 HN SER 39 40.817 -6.468 -8.164
309 HA SER 39 HA SER 39 42.104 -5.139 -10.540
310 HB2 SER 39 HB2 SER 39 40.084 -3.808 -9.539
311 HB3 SER 39 HB1 SER 39 41.187 -3.449 -8.207
312 HG SER 39 HG SER 39 41.765 -1.914 -9.541
313 H VAL 40 HN VAL 40 43.580 -6.943 -9.282
314 HA VAL 40 HA VAL 40 44.978 -5.851 -6.968
315 HB VAL 40 HB VAL 40 44.901 -8.253 -7.173
316 HG11 VAL 40 HG11 VAL 40 45.859 -9.459 -9.081
317 HG12 VAL 40 HG12 VAL 40 46.408 -7.953 -9.808
318 HG13 VAL 40 HG13 VAL 40 44.681 -8.298 -9.694
319 HG21 VAL 40 HG21 VAL 40 47.726 -7.464 -7.945
320 HG22 VAL 40 HG22 VAL 40 47.228 -8.769 -6.871
321 HG23 VAL 40 HG23 VAL 40 47.048 -7.088 -6.361
322 H SER 41 HN SER 41 45.118 -5.182 -10.301
323 HA SER 41 HA SER 41 47.954 -4.622 -10.509
324 HB2 SER 41 HB2 SER 41 46.954 -4.914 -12.599
325 HB3 SER 41 HB1 SER 41 45.519 -3.994 -12.152
326 HG SER 41 HG SER 41 46.485 -2.343 -13.001
327 H ASP 42 HN ASP 42 45.065 -2.590 -9.935
328 HA ASP 42 HA ASP 42 46.387 -0.086 -9.843
329 HB2 ASP 42 HB2 ASP 42 44.491 0.712 -8.565
330 HB3 ASP 42 HB1 ASP 42 43.893 -0.446 -9.753
331 H LEU 43 HN LEU 43 46.097 -2.631 -7.329
332 HA LEU 43 HA LEU 43 47.179 -1.051 -5.203
333 HB2 LEU 43 HB2 LEU 43 45.997 -3.356 -5.100
334 HB3 LEU 43 HB1 LEU 43 47.572 -4.034 -5.492
335 HG LEU 43 HG LEU 43 48.542 -2.959 -3.472
336 HD11 LEU 43 HD11 LEU 43 46.559 -2.201 -1.803
337 HD12 LEU 43 HD12 LEU 43 45.784 -1.769 -3.326
338 HD13 LEU 43 HD13 LEU 43 47.337 -1.058 -2.892
339 HD21 LEU 43 HD21 LEU 43 47.429 -5.255 -3.487
340 HD22 LEU 43 HD22 LEU 43 46.025 -4.484 -2.751
341 HD23 LEU 43 HD23 LEU 43 47.572 -4.488 -1.905
342 H LYS 44 HN LYS 44 48.643 -2.978 -7.778
343 HA LYS 44 HA LYS 44 51.337 -2.862 -6.757
344 HB2 LYS 44 HB2 LYS 44 50.046 -3.518 -9.375
345 HB3 LYS 44 HB1 LYS 44 51.756 -3.097 -9.426
346 HG2 LYS 44 HG2 LYS 44 52.344 -4.881 -7.961
347 HG3 LYS 44 HG1 LYS 44 50.665 -5.160 -7.503
348 HD2 LYS 44 HD2 LYS 44 50.123 -6.055 -9.645
349 HD3 LYS 44 HD1 LYS 44 51.626 -5.463 -10.353
350 HE2 LYS 44 HE2 LYS 44 51.541 -7.496 -8.113
351 HE3 LYS 44 HE1 LYS 44 51.608 -7.942 -9.819
352 HZ1 LYS 44 HZ1 LYS 44 53.559 -6.013 -9.402
353 HZ2 LYS 44 HZ2 LYS 44 53.787 -7.663 -9.735
354 HZ3 LYS 44 HZ3 LYS 44 53.706 -7.120 -8.127
355 H LYS 45 HN LYS 45 49.502 -0.742 -8.969
356 HA LYS 45 HA LYS 45 51.738 0.995 -9.520
357 HB2 LYS 45 HB2 LYS 45 49.807 0.880 -11.002
358 HB3 LYS 45 HB1 LYS 45 48.747 1.440 -9.714
359 HG2 LYS 45 HG2 LYS 45 51.082 3.215 -10.284
360 HG3 LYS 45 HG1 LYS 45 49.901 3.107 -11.583
361 HD2 LYS 45 HD2 LYS 45 48.959 3.584 -8.758
362 HD3 LYS 45 HD1 LYS 45 49.594 4.926 -9.708
363 HE2 LYS 45 HE2 LYS 45 47.928 4.597 -11.421
364 HE3 LYS 45 HE1 LYS 45 47.388 3.090 -10.681
365 HZ1 LYS 45 HZ1 LYS 45 45.862 4.485 -9.798
366 HZ2 LYS 45 HZ2 LYS 45 46.874 5.848 -9.881
367 HZ3 LYS 45 HZ3 LYS 45 47.075 4.711 -8.635
368 H TYR 46 HN TYR 46 49.112 1.058 -7.137
369 HA TYR 46 HA TYR 46 49.641 3.651 -6.069
370 HB2 TYR 46 HB2 TYR 46 47.589 2.409 -5.571
371 HB3 TYR 46 HB1 TYR 46 48.522 1.167 -4.747
372 HD1 TYR 46 HD2 TYR 46 48.266 4.923 -4.680
373 HD2 TYR 46 HD1 TYR 46 48.469 1.274 -2.414
374 HE1 TYR 46 HE2 TYR 46 48.093 6.217 -2.574
375 HE2 TYR 46 HE1 TYR 46 48.287 2.569 -0.311
376 HH TYR 46 HH TYR 46 47.172 5.159 0.164
377 H ILE 47 HN ILE 47 50.870 0.433 -5.141
378 HA ILE 47 HA ILE 47 52.459 1.233 -2.932
379 HB ILE 47 HB ILE 47 52.886 -0.950 -4.992
380 HG12 ILE 47 HG12 ILE 47 52.012 -1.260 -2.114
381 HG13 ILE 47 HG11 ILE 47 50.842 -0.931 -3.391
382 HG21 ILE 47 HG21 ILE 47 55.036 -0.600 -4.048
383 HG22 ILE 47 HG22 ILE 47 54.352 -1.933 -3.122
384 HG23 ILE 47 HG23 ILE 47 54.373 -0.306 -2.441
385 HD11 ILE 47 HD11 ILE 47 52.828 -3.154 -3.788
386 HD12 ILE 47 HD12 ILE 47 51.201 -2.977 -4.437
387 HD13 ILE 47 HD13 ILE 47 51.428 -3.428 -2.750
388 H ALA 48 HN ALA 48 53.436 0.822 -6.346
389 HA ALA 48 HA ALA 48 56.079 1.703 -6.121
390 HB1 ALA 48 HB1 ALA 48 55.123 0.760 -8.193
391 HB2 ALA 48 HB2 ALA 48 55.930 2.295 -8.509
392 HB3 ALA 48 HB3 ALA 48 54.170 2.226 -8.419
393 H GLU 49 HN GLU 49 53.129 3.661 -6.484
394 HA GLU 49 HA GLU 49 54.394 6.175 -6.850
395 HB2 GLU 49 HB2 GLU 49 51.750 5.396 -5.609
396 HB3 GLU 49 HB1 GLU 49 52.252 7.081 -5.747
397 HG2 GLU 49 HG2 GLU 49 52.479 6.849 -8.171
398 HG3 GLU 49 HG1 GLU 49 52.073 5.135 -8.066
399 H LEU 50 HN LEU 50 53.924 4.254 -3.936
400 HA LEU 50 HA LEU 50 54.570 6.442 -2.124
401 HB2 LEU 50 HB2 LEU 50 54.781 3.465 -1.583
402 HB3 LEU 50 HB1 LEU 50 54.664 4.754 -0.387
403 HG LEU 50 HG LEU 50 52.532 3.986 -2.405
404 HD11 LEU 50 HD11 LEU 50 52.401 3.896 0.614
405 HD12 LEU 50 HD12 LEU 50 52.942 2.515 -0.343
406 HD13 LEU 50 HD13 LEU 50 51.308 3.143 -0.546
407 HD21 LEU 50 HD21 LEU 50 51.202 5.660 -0.888
408 HD22 LEU 50 HD22 LEU 50 52.252 6.311 -2.143
409 HD23 LEU 50 HD23 LEU 50 52.796 6.287 -0.465
410 H GLU 51 HN GLU 51 56.419 3.986 -3.846
411 HA GLU 51 HA GLU 51 58.856 4.308 -2.353
412 HB2 GLU 51 HB2 GLU 51 58.227 3.305 -5.133
413 HB3 GLU 51 HB1 GLU 51 59.893 3.435 -4.566
414 HG2 GLU 51 HG2 GLU 51 58.906 1.166 -4.184
415 HG3 GLU 51 HG1 GLU 51 59.424 1.954 -2.693
416 H VAL 52 HN VAL 52 57.378 6.116 -4.973
417 HA VAL 52 HA VAL 52 59.813 7.691 -5.471
418 HB VAL 52 HB VAL 52 56.989 8.192 -6.460
419 HG11 VAL 52 HG11 VAL 52 58.375 10.130 -6.777
420 HG12 VAL 52 HG12 VAL 52 58.306 9.304 -8.334
421 HG13 VAL 52 HG13 VAL 52 59.735 9.144 -7.314
422 HG21 VAL 52 HG21 VAL 52 57.903 7.059 -8.559
423 HG22 VAL 52 HG22 VAL 52 57.584 5.986 -7.196
424 HG23 VAL 52 HG23 VAL 52 59.237 6.484 -7.559
425 H GLN 53 HN GLN 53 56.855 7.934 -3.588
426 HA GLN 53 HA GLN 53 57.152 10.770 -3.036
427 HB2 GLN 53 HB2 GLN 53 54.980 9.458 -3.017
428 HB3 GLN 53 HB1 GLN 53 55.538 8.704 -1.522
429 HG2 GLN 53 HG2 GLN 53 54.184 10.558 -0.883
430 HG3 GLN 53 HG1 GLN 53 55.856 11.030 -0.597
431 HE21 GLN 53 HE21 GLN 53 53.619 11.075 -3.441
432 HE22 GLN 53 HE22 GLN 53 54.006 12.663 -3.899
433 H THR 54 HN THR 54 58.091 7.732 -1.499
434 HA THR 54 HA THR 54 59.033 9.134 0.924
435 HB THR 54 HB THR 54 59.601 6.231 0.344
436 HG1 THR 54 HG1 THR 54 57.155 7.438 0.397
437 HG21 THR 54 HG21 THR 54 60.326 7.414 2.459
438 HG22 THR 54 HG22 THR 54 59.294 6.008 2.723
439 HG23 THR 54 HG23 THR 54 58.618 7.633 2.841
440 H GLY 55 HN GLY 55 60.249 9.495 -1.859
441 HA2 GLY 55 HA2 GLY 55 63.025 9.449 -0.962
442 HA3 GLY 55 HA1 GLY 55 62.689 8.343 -2.293
443 H MET 56 HN MET 56 60.836 11.269 -2.075
444 HA MET 56 HA MET 56 61.581 12.122 -4.700
445 HB2 MET 56 HB2 MET 56 59.480 12.763 -3.401
446 HB3 MET 56 HB1 MET 56 60.484 13.917 -2.524
447 HG2 MET 56 HG2 MET 56 59.490 15.115 -4.355
448 HG3 MET 56 HG1 MET 56 61.184 14.859 -4.772
449 HE1 MET 56 HE1 MET 56 57.655 14.652 -5.813
450 HE2 MET 56 HE2 MET 56 57.681 13.134 -4.920
451 HE3 MET 56 HE3 MET 56 57.432 13.118 -6.664
452 H THR 57 HN THR 57 63.872 12.258 -4.803
453 HA THR 57 HA THR 57 64.979 14.771 -3.723
454 HB THR 57 HB THR 57 66.972 13.578 -2.771
455 HG1 THR 57 HG1 THR 57 66.975 11.430 -2.657
456 HG21 THR 57 HG21 THR 57 64.422 12.621 -1.464
457 HG22 THR 57 HG22 THR 57 64.919 14.312 -1.426
458 HG23 THR 57 HG23 THR 57 65.937 13.078 -0.686
459 H GLN 58 HN GLN 58 66.934 12.020 -4.695
460 HA GLN 58 HA GLN 58 67.115 12.956 -7.488
461 HB2 GLN 58 HB2 GLN 58 69.469 13.066 -5.575
462 HB3 GLN 58 HB1 GLN 58 69.603 13.217 -7.326
463 HG2 GLN 58 HG2 GLN 58 67.914 15.135 -7.142
464 HG3 GLN 58 HG1 GLN 58 68.207 15.084 -5.403
465 HE21 GLN 58 HE21 GLN 58 71.099 14.265 -5.880
466 HE22 GLN 58 HE22 GLN 58 71.879 15.695 -6.355
467 H ARG 59 HN ARG 59 69.168 11.557 -8.440
468 HA ARG 59 HA ARG 59 69.511 8.943 -7.259
469 HB2 ARG 59 HB2 ARG 59 68.164 7.629 -8.783
470 HB3 ARG 59 HB1 ARG 59 67.117 8.839 -8.036
471 HG2 ARG 59 HG2 ARG 59 67.591 10.313 -10.065
472 HG3 ARG 59 HG1 ARG 59 68.306 8.885 -10.817
473 HD2 ARG 59 HD2 ARG 59 65.923 9.149 -11.449
474 HD3 ARG 59 HD1 ARG 59 66.194 7.660 -10.543
475 HE ARG 59 HE ARG 59 65.508 9.507 -8.593
476 HH11 ARG 59 HH21 ARG 59 64.179 8.400 -11.576
477 HH12 ARG 59 HH22 ARG 59 62.537 8.662 -11.094
478 HH21 ARG 59 HH11 ARG 59 63.370 9.856 -7.947
479 HH22 ARG 59 HH12 ARG 59 62.078 9.487 -9.040
480 H ARG 60 HN ARG 60 69.977 7.461 -9.595
481 HA ARG 60 HA ARG 60 72.544 8.441 -10.392
482 HB2 ARG 60 HB2 ARG 60 70.734 6.350 -11.635
483 HB3 ARG 60 HB1 ARG 60 72.395 6.643 -12.150
484 HG2 ARG 60 HG2 ARG 60 73.166 6.200 -9.829
485 HG3 ARG 60 HG1 ARG 60 71.507 5.821 -9.370
486 HD2 ARG 60 HD2 ARG 60 71.879 4.201 -11.596
487 HD3 ARG 60 HD1 ARG 60 73.467 4.157 -10.837
488 HE ARG 60 HE ARG 60 71.252 2.679 -9.958
489 HH11 ARG 60 HH21 ARG 60 73.433 5.005 -8.628
490 HH12 ARG 60 HH22 ARG 60 73.176 4.496 -6.997
491 HH21 ARG 60 HH11 ARG 60 70.925 2.006 -7.841
492 HH22 ARG 60 HH12 ARG 60 71.764 2.800 -6.551
493 H ARG 61 HN ARG 61 73.175 9.085 -12.608
494 HA ARG 61 HA ARG 61 72.958 10.579 -14.407
495 HB2 ARG 61 HB2 ARG 61 71.599 8.579 -15.182
496 HB3 ARG 61 HB1 ARG 61 70.163 9.435 -14.620
497 HG2 ARG 61 HG2 ARG 61 70.745 11.342 -16.101
498 HG3 ARG 61 HG1 ARG 61 72.130 10.431 -16.701
499 HD2 ARG 61 HD2 ARG 61 70.304 10.138 -18.267
500 HD3 ARG 61 HD1 ARG 61 70.542 8.615 -17.411
501 HE ARG 61 HE ARG 61 68.622 9.927 -15.905
502 HH11 ARG 61 HH21 ARG 61 69.052 9.074 -19.218
503 HH12 ARG 61 HH22 ARG 61 67.358 8.898 -19.531
504 HH21 ARG 61 HH11 ARG 61 66.406 9.703 -16.294
505 HH22 ARG 61 HH12 ARG 61 65.860 9.254 -17.876
506 H GLY 62 HN GLY 62 72.873 12.241 -12.549
507 HA2 GLY 62 HA2 GLY 62 70.342 13.393 -11.798
508 HA3 GLY 62 HA1 GLY 62 71.914 14.168 -11.606
Start of MODEL 19
1 H1 MET 1 HT1 MET 1 57.594 8.191 9.739
2 H2 MET 1 HT2 MET 1 56.289 8.168 10.826
3 H3 MET 1 HT3 MET 1 57.078 9.631 10.472
4 HA MET 1 HA MET 1 55.289 9.877 9.119
5 HB2 MET 1 HB2 MET 1 57.164 8.125 7.498
6 HB3 MET 1 HB1 MET 1 55.916 9.174 6.822
7 HG2 MET 1 HG2 MET 1 57.032 11.107 8.023
8 HG3 MET 1 HG1 MET 1 58.363 10.010 8.397
9 HE1 MET 1 HE1 MET 1 58.432 8.193 5.484
10 HE2 MET 1 HE2 MET 1 59.461 8.597 6.856
11 HE3 MET 1 HE3 MET 1 59.964 9.039 5.227
12 H VAL 2 HN VAL 2 53.292 9.035 8.623
13 HA VAL 2 HA VAL 2 52.666 6.342 9.455
14 HB VAL 2 HB VAL 2 50.982 8.214 7.766
15 HG11 VAL 2 HG11 VAL 2 50.321 5.870 9.574
16 HG12 VAL 2 HG12 VAL 2 50.120 5.939 7.822
17 HG13 VAL 2 HG13 VAL 2 49.118 6.949 8.866
18 HG21 VAL 2 HG21 VAL 2 51.731 9.338 9.820
19 HG22 VAL 2 HG22 VAL 2 51.221 7.950 10.782
20 HG23 VAL 2 HG23 VAL 2 50.019 8.932 9.943
21 H ARG 3 HN ARG 3 53.626 7.778 6.435
22 HA ARG 3 HA ARG 3 52.561 5.849 4.627
23 HB2 ARG 3 HB2 ARG 3 55.195 7.336 4.400
24 HB3 ARG 3 HB1 ARG 3 54.289 6.605 3.074
25 HG2 ARG 3 HG2 ARG 3 52.393 8.124 3.538
26 HG3 ARG 3 HG1 ARG 3 53.314 8.866 4.846
27 HD2 ARG 3 HD2 ARG 3 55.049 9.564 3.245
28 HD3 ARG 3 HD1 ARG 3 54.150 8.806 1.931
29 HE ARG 3 HE ARG 3 52.326 10.565 3.049
30 HH11 ARG 3 HH21 ARG 3 55.549 10.735 1.837
31 HH12 ARG 3 HH22 ARG 3 55.401 12.374 1.297
32 HH21 ARG 3 HH11 ARG 3 52.115 12.705 2.351
33 HH22 ARG 3 HH12 ARG 3 53.458 13.489 1.589
34 H GLN 4 HN GLN 4 55.325 5.754 6.786
35 HA GLN 4 HA GLN 4 56.616 3.483 5.568
36 HB2 GLN 4 HB2 GLN 4 57.575 5.150 7.299
37 HB3 GLN 4 HB1 GLN 4 56.759 4.160 8.509
38 HG2 GLN 4 HG2 GLN 4 57.950 2.151 7.538
39 HG3 GLN 4 HG1 GLN 4 58.888 3.269 6.547
40 HE21 GLN 4 HE21 GLN 4 60.880 2.662 7.711
41 HE22 GLN 4 HE22 GLN 4 61.167 3.224 9.287
42 H GLU 5 HN GLU 5 54.459 3.778 8.407
43 HA GLU 5 HA GLU 5 54.243 0.918 8.778
44 HB2 GLU 5 HB2 GLU 5 53.822 2.559 10.596
45 HB3 GLU 5 HB1 GLU 5 52.390 3.122 9.733
46 HG2 GLU 5 HG2 GLU 5 51.348 0.941 9.918
47 HG3 GLU 5 HG1 GLU 5 52.815 0.254 10.614
48 H GLU 6 HN GLU 6 52.248 3.360 7.129
49 HA GLU 6 HA GLU 6 50.093 1.583 6.500
50 HB2 GLU 6 HB2 GLU 6 49.630 3.905 6.308
51 HB3 GLU 6 HB1 GLU 6 51.041 4.198 5.299
52 HG2 GLU 6 HG2 GLU 6 48.841 4.176 4.058
53 HG3 GLU 6 HG1 GLU 6 50.041 3.046 3.436
54 H LEU 7 HN LEU 7 53.304 1.869 5.231
55 HA LEU 7 HA LEU 7 52.697 0.727 2.623
56 HB2 LEU 7 HB2 LEU 7 54.714 2.067 2.874
57 HB3 LEU 7 HB1 LEU 7 55.286 1.027 4.173
58 HG LEU 7 HG LEU 7 55.616 -0.819 2.667
59 HD11 LEU 7 HD11 LEU 7 53.775 -0.767 1.189
60 HD12 LEU 7 HD12 LEU 7 55.141 -0.367 0.149
61 HD13 LEU 7 HD13 LEU 7 54.074 0.910 0.731
62 HD21 LEU 7 HD21 LEU 7 57.424 0.805 2.655
63 HD22 LEU 7 HD22 LEU 7 56.577 1.797 1.468
64 HD23 LEU 7 HD23 LEU 7 57.199 0.211 1.010
65 H ALA 8 HN ALA 8 54.146 -0.510 5.643
66 HA ALA 8 HA ALA 8 54.423 -3.209 4.761
67 HB1 ALA 8 HB1 ALA 8 55.519 -2.339 6.801
68 HB2 ALA 8 HB2 ALA 8 54.564 -3.780 7.153
69 HB3 ALA 8 HB3 ALA 8 53.942 -2.185 7.577
70 H ALA 9 HN ALA 9 51.650 -1.393 5.811
71 HA ALA 9 HA ALA 9 50.004 -3.694 6.479
72 HB1 ALA 9 HB1 ALA 9 48.132 -1.968 6.326
73 HB2 ALA 9 HB2 ALA 9 49.381 -0.782 5.948
74 HB3 ALA 9 HB3 ALA 9 49.400 -1.617 7.501
75 H ALA 10 HN ALA 10 49.928 -1.381 3.716
76 HA ALA 10 HA ALA 10 48.020 -2.873 2.219
77 HB1 ALA 10 HB1 ALA 10 48.306 -0.772 1.285
78 HB2 ALA 10 HB2 ALA 10 49.367 -1.692 0.217
79 HB3 ALA 10 HB3 ALA 10 50.046 -0.776 1.562
80 H ARG 11 HN ARG 11 51.450 -3.245 2.695
81 HA ARG 11 HA ARG 11 51.926 -5.086 0.521
82 HB2 ARG 11 HB2 ARG 11 53.581 -3.768 2.132
83 HB3 ARG 11 HB1 ARG 11 53.434 -5.200 3.144
84 HG2 ARG 11 HG2 ARG 11 55.188 -5.942 1.848
85 HG3 ARG 11 HG1 ARG 11 53.893 -6.404 0.746
86 HD2 ARG 11 HD2 ARG 11 54.119 -4.163 -0.352
87 HD3 ARG 11 HD1 ARG 11 55.517 -3.848 0.675
88 HE ARG 11 HE ARG 11 56.116 -6.271 -0.533
89 HH11 ARG 11 HH21 ARG 11 55.143 -3.133 -1.578
90 HH12 ARG 11 HH22 ARG 11 55.988 -3.228 -3.087
91 HH21 ARG 11 HH11 ARG 11 57.225 -6.413 -2.497
92 HH22 ARG 11 HH12 ARG 11 57.166 -5.084 -3.607
93 H ALA 12 HN ALA 12 51.285 -5.536 4.063
94 HA ALA 12 HA ALA 12 51.259 -8.348 4.079
95 HB1 ALA 12 HB1 ALA 12 49.756 -8.168 6.041
96 HB2 ALA 12 HB2 ALA 12 49.473 -6.472 5.649
97 HB3 ALA 12 HB3 ALA 12 51.080 -7.007 6.141
98 H ALA 13 HN ALA 13 49.173 -6.169 2.604
99 HA ALA 13 HA ALA 13 46.858 -7.917 2.425
100 HB1 ALA 13 HB1 ALA 13 47.010 -5.290 2.196
101 HB2 ALA 13 HB2 ALA 13 45.829 -6.187 1.242
102 HB3 ALA 13 HB3 ALA 13 47.336 -5.652 0.502
103 H LEU 14 HN LEU 14 49.586 -7.052 0.260
104 HA LEU 14 HA LEU 14 48.646 -8.516 -1.970
105 HB2 LEU 14 HB2 LEU 14 51.129 -7.246 -1.275
106 HB3 LEU 14 HB1 LEU 14 51.501 -8.831 -1.924
107 HG LEU 14 HG LEU 14 49.625 -6.901 -3.323
108 HD11 LEU 14 HD11 LEU 14 51.906 -5.912 -3.025
109 HD12 LEU 14 HD12 LEU 14 51.480 -6.211 -4.707
110 HD13 LEU 14 HD13 LEU 14 52.574 -7.310 -3.866
111 HD21 LEU 14 HD21 LEU 14 51.282 -9.103 -4.548
112 HD22 LEU 14 HD22 LEU 14 49.800 -8.362 -5.154
113 HD23 LEU 14 HD23 LEU 14 49.735 -9.472 -3.788
114 H HIS 15 HN HIS 15 50.130 -9.589 1.003
115 HA HIS 15 HA HIS 15 50.593 -12.310 0.045
116 HB2 HIS 15 HB2 HIS 15 51.873 -11.288 1.943
117 HB3 HIS 15 HB1 HIS 15 50.389 -11.295 2.897
118 HD1 HIS 15 HD1 HIS 15 50.219 -13.286 4.370
119 HD2 HIS 15 HD2 HIS 15 52.306 -14.162 0.868
120 HE1 HIS 15 HE1 HIS 15 50.895 -15.722 4.529
121 H ASP 16 HN ASP 16 48.019 -10.555 1.665
122 HA ASP 16 HA ASP 16 46.471 -12.919 2.342
123 HB2 ASP 16 HB2 ASP 16 45.441 -10.091 2.075
124 HB3 ASP 16 HB1 ASP 16 44.797 -11.385 3.083
125 H LEU 17 HN LEU 17 46.688 -10.797 -0.448
126 HA LEU 17 HA LEU 17 44.176 -11.777 -1.606
127 HB2 LEU 17 HB2 LEU 17 46.394 -10.114 -2.848
128 HB3 LEU 17 HB1 LEU 17 44.814 -10.399 -3.556
129 HG LEU 17 HG LEU 17 45.154 -9.158 -0.817
130 HD11 LEU 17 HD11 LEU 17 44.932 -6.970 -1.858
131 HD12 LEU 17 HD12 LEU 17 44.800 -7.704 -3.453
132 HD13 LEU 17 HD13 LEU 17 46.319 -7.795 -2.567
133 HD21 LEU 17 HD21 LEU 17 42.864 -8.193 -1.544
134 HD22 LEU 17 HD22 LEU 17 42.919 -9.898 -1.109
135 HD23 LEU 17 HD23 LEU 17 42.888 -9.420 -2.806
136 H MET 18 HN MET 18 47.536 -12.702 -1.711
137 HA MET 18 HA MET 18 47.131 -14.357 -4.132
138 HB2 MET 18 HB2 MET 18 49.409 -13.196 -2.711
139 HB3 MET 18 HB1 MET 18 49.692 -14.903 -3.033
140 HG2 MET 18 HG2 MET 18 50.529 -13.635 -4.915
141 HG3 MET 18 HG1 MET 18 49.072 -14.479 -5.438
142 HE1 MET 18 HE1 MET 18 48.716 -12.706 -7.573
143 HE2 MET 18 HE2 MET 18 50.344 -12.386 -6.980
144 HE3 MET 18 HE3 MET 18 49.257 -11.041 -7.321
145 H THR 19 HN THR 19 46.654 -14.716 -0.795
146 HA THR 19 HA THR 19 47.381 -17.588 -0.756
147 HB THR 19 HB THR 19 46.285 -17.324 1.630
148 HG1 THR 19 HG1 THR 19 45.343 -15.349 1.368
149 HG21 THR 19 HG21 THR 19 48.703 -17.607 1.197
150 HG22 THR 19 HG22 THR 19 48.416 -16.455 2.499
151 HG23 THR 19 HG23 THR 19 48.846 -15.877 0.888
152 H GLY 20 HN GLY 20 44.752 -15.805 -1.811
153 HA2 GLY 20 HA2 GLY 20 42.971 -17.294 -2.848
154 HA3 GLY 20 HA1 GLY 20 42.848 -18.075 -1.274
155 H LYS 21 HN LYS 21 42.827 -15.945 0.473
156 HA LYS 21 HA LYS 21 40.164 -15.043 0.389
157 HB2 LYS 21 HB2 LYS 21 42.415 -13.468 1.660
158 HB3 LYS 21 HB1 LYS 21 40.731 -13.561 2.177
159 HG2 LYS 21 HG2 LYS 21 41.172 -16.102 2.468
160 HG3 LYS 21 HG1 LYS 21 42.880 -15.670 2.394
161 HD2 LYS 21 HD2 LYS 21 42.620 -14.160 4.296
162 HD3 LYS 21 HD1 LYS 21 40.884 -14.466 4.334
163 HE2 LYS 21 HE2 LYS 21 41.285 -16.829 4.843
164 HE3 LYS 21 HE1 LYS 21 43.026 -16.574 4.737
165 HZ1 LYS 21 HZ1 LYS 21 41.149 -15.430 6.725
166 HZ2 LYS 21 HZ2 LYS 21 42.747 -14.883 6.535
167 HZ3 LYS 21 HZ3 LYS 21 42.446 -16.486 7.012
168 H ARG 22 HN ARG 22 39.268 -13.744 -1.137
169 HA ARG 22 HA ARG 22 41.012 -11.991 -2.732
170 HB2 ARG 22 HB2 ARG 22 39.058 -11.691 -4.178
171 HB3 ARG 22 HB1 ARG 22 39.383 -13.398 -3.887
172 HG2 ARG 22 HG2 ARG 22 37.607 -13.523 -2.243
173 HG3 ARG 22 HG1 ARG 22 37.338 -11.786 -2.329
174 HD2 ARG 22 HD2 ARG 22 37.053 -12.524 -4.986
175 HD3 ARG 22 HD1 ARG 22 36.372 -13.916 -4.151
176 HE ARG 22 HE ARG 22 35.040 -11.473 -4.524
177 HH11 ARG 22 HH21 ARG 22 35.936 -13.501 -1.874
178 HH12 ARG 22 HH22 ARG 22 34.710 -12.883 -0.825
179 HH21 ARG 22 HH11 ARG 22 33.435 -10.678 -3.169
180 HH22 ARG 22 HH12 ARG 22 33.294 -11.292 -1.557
181 H VAL 23 HN VAL 23 38.371 -11.626 -0.384
182 HA VAL 23 HA VAL 23 38.285 -8.702 -0.814
183 HB VAL 23 HB VAL 23 36.263 -10.029 -0.164
184 HG11 VAL 23 HG11 VAL 23 37.624 -11.520 1.418
185 HG12 VAL 23 HG12 VAL 23 36.062 -10.971 2.026
186 HG13 VAL 23 HG13 VAL 23 37.544 -10.191 2.575
187 HG21 VAL 23 HG21 VAL 23 36.428 -7.596 0.302
188 HG22 VAL 23 HG22 VAL 23 37.149 -7.954 1.872
189 HG23 VAL 23 HG23 VAL 23 35.483 -8.426 1.539
190 H ALA 24 HN ALA 24 39.393 -7.203 0.351
191 HA ALA 24 HA ALA 24 40.721 -8.010 2.904
192 HB1 ALA 24 HB1 ALA 24 42.437 -8.315 1.195
193 HB2 ALA 24 HB2 ALA 24 42.819 -6.889 2.158
194 HB3 ALA 24 HB3 ALA 24 42.119 -6.704 0.551
195 H THR 25 HN THR 25 41.188 -6.205 4.286
196 HA THR 25 HA THR 25 39.611 -3.733 3.600
197 HB THR 25 HB THR 25 40.597 -4.551 6.343
198 HG1 THR 25 HG1 THR 25 38.045 -5.111 5.271
199 HG21 THR 25 HG21 THR 25 38.320 -2.819 5.350
200 HG22 THR 25 HG22 THR 25 39.821 -2.245 6.078
201 HG23 THR 25 HG23 THR 25 38.666 -3.164 7.045
202 H VAL 26 HN VAL 26 40.615 -1.689 3.770
203 HA VAL 26 HA VAL 26 43.406 -1.546 4.731
204 HB VAL 26 HB VAL 26 43.729 -0.103 2.435
205 HG11 VAL 26 HG11 VAL 26 44.942 -2.010 1.525
206 HG12 VAL 26 HG12 VAL 26 44.056 -3.118 2.573
207 HG13 VAL 26 HG13 VAL 26 45.187 -1.956 3.270
208 HG21 VAL 26 HG21 VAL 26 42.648 -1.145 0.587
209 HG22 VAL 26 HG22 VAL 26 41.381 -0.807 1.762
210 HG23 VAL 26 HG23 VAL 26 42.014 -2.445 1.591
211 H GLN 27 HN GLN 27 43.789 0.323 5.729
212 HA GLN 27 HA GLN 27 41.633 2.303 5.954
213 HB2 GLN 27 HB2 GLN 27 44.418 2.258 7.175
214 HB3 GLN 27 HB1 GLN 27 43.112 3.344 7.644
215 HG2 GLN 27 HG2 GLN 27 42.895 0.325 7.771
216 HG3 GLN 27 HG1 GLN 27 43.394 1.320 9.138
217 HE21 GLN 27 HE21 GLN 27 41.337 3.372 7.684
218 HE22 GLN 27 HE22 GLN 27 39.869 2.906 8.392
219 H LYS 28 HN LYS 28 41.496 3.957 4.492
220 HA LYS 28 HA LYS 28 44.032 5.117 3.396
221 HB2 LYS 28 HB2 LYS 28 42.958 3.544 1.767
222 HB3 LYS 28 HB1 LYS 28 41.521 4.568 1.797
223 HG2 LYS 28 HG2 LYS 28 42.760 6.453 0.930
224 HG3 LYS 28 HG1 LYS 28 44.287 5.582 1.084
225 HD2 LYS 28 HD2 LYS 28 43.384 3.872 -0.534
226 HD3 LYS 28 HD1 LYS 28 41.996 4.931 -0.788
227 HE2 LYS 28 HE2 LYS 28 43.569 5.429 -2.534
228 HE3 LYS 28 HE1 LYS 28 43.643 6.768 -1.387
229 HZ1 LYS 28 HZ1 LYS 28 45.790 6.362 -1.142
230 HZ2 LYS 28 HZ2 LYS 28 45.699 5.022 -2.184
231 HZ3 LYS 28 HZ3 LYS 28 45.434 4.826 -0.517
232 H ASP 29 HN ASP 29 43.999 7.399 3.718
233 HA ASP 29 HA ASP 29 43.081 9.530 4.265
234 HB2 ASP 29 HB2 ASP 29 42.357 9.184 1.867
235 HB3 ASP 29 HB1 ASP 29 40.821 8.574 2.484
236 H GLY 30 HN GLY 30 42.646 7.903 6.353
237 HA2 GLY 30 HA2 GLY 30 41.184 7.384 8.125
238 HA3 GLY 30 HA1 GLY 30 40.517 8.979 7.775
239 H ARG 31 HN ARG 31 40.423 6.291 5.495
240 HA ARG 31 HA ARG 31 37.587 5.751 6.129
241 HB2 ARG 31 HB2 ARG 31 37.552 7.658 4.513
242 HB3 ARG 31 HB1 ARG 31 38.474 6.680 3.378
243 HG2 ARG 31 HG2 ARG 31 36.041 6.641 2.878
244 HG3 ARG 31 HG1 ARG 31 36.670 5.042 3.256
245 HD2 ARG 31 HD2 ARG 31 34.418 5.893 4.366
246 HD3 ARG 31 HD1 ARG 31 35.566 4.935 5.302
247 HE ARG 31 HE ARG 31 36.369 7.534 5.779
248 HH11 ARG 31 HH21 ARG 31 33.404 5.786 5.924
249 HH12 ARG 31 HH22 ARG 31 32.758 6.731 7.224
250 HH21 ARG 31 HH11 ARG 31 35.545 8.779 7.474
251 HH22 ARG 31 HH12 ARG 31 33.969 8.426 8.101
252 H ARG 32 HN ARG 32 37.126 3.670 5.798
253 HA ARG 32 HA ARG 32 39.242 1.872 4.829
254 HB2 ARG 32 HB2 ARG 32 36.547 1.481 6.138
255 HB3 ARG 32 HB1 ARG 32 37.503 0.123 5.548
256 HG2 ARG 32 HG2 ARG 32 39.384 0.810 6.979
257 HG3 ARG 32 HG1 ARG 32 38.445 2.187 7.556
258 HD2 ARG 32 HD2 ARG 32 37.652 -0.722 7.885
259 HD3 ARG 32 HD1 ARG 32 38.356 0.287 9.148
260 HE ARG 32 HE ARG 32 36.140 1.725 8.317
261 HH11 ARG 32 HH21 ARG 32 36.779 -1.490 9.387
262 HH12 ARG 32 HH22 ARG 32 35.219 -1.702 10.108
263 HH21 ARG 32 HH11 ARG 32 34.098 1.466 9.252
264 HH22 ARG 32 HH12 ARG 32 33.701 -0.028 10.032
265 H VAL 33 HN VAL 33 39.079 0.503 3.066
266 HA VAL 33 HA VAL 33 36.621 0.508 1.401
267 HB VAL 33 HB VAL 33 39.352 1.328 0.340
268 HG11 VAL 33 HG11 VAL 33 36.772 0.567 -1.060
269 HG12 VAL 33 HG12 VAL 33 38.356 -0.182 -1.258
270 HG13 VAL 33 HG13 VAL 33 38.072 1.454 -1.852
271 HG21 VAL 33 HG21 VAL 33 36.671 2.714 0.607
272 HG22 VAL 33 HG22 VAL 33 37.906 3.281 -0.516
273 HG23 VAL 33 HG23 VAL 33 38.237 3.254 1.213
274 H GLU 34 HN GLU 34 36.454 -1.362 0.151
275 HA GLU 34 HA GLU 34 38.463 -3.501 0.804
276 HB2 GLU 34 HB2 GLU 34 35.460 -3.470 0.637
277 HB3 GLU 34 HB1 GLU 34 36.304 -4.975 0.280
278 HG2 GLU 34 HG2 GLU 34 37.284 -5.061 2.450
279 HG3 GLU 34 HG1 GLU 34 36.855 -3.383 2.792
280 H PHE 35 HN PHE 35 39.769 -3.596 -1.051
281 HA PHE 35 HA PHE 35 38.432 -3.659 -3.718
282 HB2 PHE 35 HB2 PHE 35 41.321 -3.505 -2.819
283 HB3 PHE 35 HB1 PHE 35 40.919 -3.933 -4.475
284 HD1 PHE 35 HD1 PHE 35 38.900 -2.242 -5.444
285 HD2 PHE 35 HD2 PHE 35 41.933 -1.284 -2.557
286 HE1 PHE 35 HE1 PHE 35 38.702 0.160 -6.019
287 HE2 PHE 35 HE2 PHE 35 41.734 1.109 -3.121
288 HZ PHE 35 HZ PHE 35 40.115 1.838 -4.861
289 H THR 36 HN THR 36 38.387 -5.591 -4.940
290 HA THR 36 HA THR 36 39.159 -8.068 -3.444
291 HB THR 36 HB THR 36 37.677 -9.250 -5.003
292 HG1 THR 36 HG1 THR 36 36.406 -7.541 -6.327
293 HG21 THR 36 HG21 THR 36 35.634 -8.478 -4.155
294 HG22 THR 36 HG22 THR 36 36.142 -6.791 -4.191
295 HG23 THR 36 HG23 THR 36 36.792 -7.882 -2.968
296 H ALA 37 HN ALA 37 39.997 -9.884 -5.040
297 HA ALA 37 HA ALA 37 42.448 -9.053 -6.182
298 HB1 ALA 37 HB1 ALA 37 42.225 -11.281 -7.514
299 HB2 ALA 37 HB2 ALA 37 40.734 -11.501 -6.599
300 HB3 ALA 37 HB3 ALA 37 42.276 -11.368 -5.755
301 H THR 38 HN THR 38 39.311 -8.556 -7.357
302 HA THR 38 HA THR 38 39.746 -8.711 -10.183
303 HB THR 38 HB THR 38 37.756 -7.239 -10.354
304 HG1 THR 38 HG1 THR 38 38.532 -6.138 -8.295
305 HG21 THR 38 HG21 THR 38 37.705 -9.776 -9.642
306 HG22 THR 38 HG22 THR 38 36.231 -8.813 -9.546
307 HG23 THR 38 HG23 THR 38 37.172 -9.128 -8.089
308 H SER 39 HN SER 39 40.651 -6.344 -7.793
309 HA SER 39 HA SER 39 41.724 -4.573 -9.977
310 HB2 SER 39 HB2 SER 39 41.222 -2.647 -8.641
311 HB3 SER 39 HB1 SER 39 39.758 -3.624 -8.670
312 HG SER 39 HG SER 39 40.247 -4.376 -6.633
313 H VAL 40 HN VAL 40 43.367 -6.552 -9.144
314 HA VAL 40 HA VAL 40 44.960 -5.658 -6.837
315 HB VAL 40 HB VAL 40 44.716 -8.045 -7.164
316 HG11 VAL 40 HG11 VAL 40 46.136 -7.687 -9.838
317 HG12 VAL 40 HG12 VAL 40 44.396 -7.937 -9.675
318 HG13 VAL 40 HG13 VAL 40 45.522 -9.195 -9.167
319 HG21 VAL 40 HG21 VAL 40 47.545 -7.372 -8.020
320 HG22 VAL 40 HG22 VAL 40 47.017 -8.681 -6.966
321 HG23 VAL 40 HG23 VAL 40 46.955 -7.010 -6.399
322 H SER 41 HN SER 41 44.900 -4.872 -10.178
323 HA SER 41 HA SER 41 47.742 -4.399 -10.513
324 HB2 SER 41 HB2 SER 41 47.046 -3.158 -12.535
325 HB3 SER 41 HB1 SER 41 46.263 -4.733 -12.450
326 HG SER 41 HG SER 41 45.206 -2.168 -11.925
327 H ASP 42 HN ASP 42 44.939 -2.264 -9.895
328 HA ASP 42 HA ASP 42 46.357 0.179 -9.722
329 HB2 ASP 42 HB2 ASP 42 44.454 0.775 -8.042
330 HB3 ASP 42 HB1 ASP 42 44.003 0.351 -9.693
331 H LEU 43 HN LEU 43 46.047 -2.476 -7.336
332 HA LEU 43 HA LEU 43 47.068 -0.972 -5.117
333 HB2 LEU 43 HB2 LEU 43 45.922 -3.307 -5.129
334 HB3 LEU 43 HB1 LEU 43 47.520 -3.936 -5.514
335 HG LEU 43 HG LEU 43 48.429 -2.929 -3.437
336 HD11 LEU 43 HD11 LEU 43 46.402 -2.248 -1.783
337 HD12 LEU 43 HD12 LEU 43 45.664 -1.762 -3.307
338 HD13 LEU 43 HD13 LEU 43 47.202 -1.063 -2.808
339 HD21 LEU 43 HD21 LEU 43 47.435 -4.509 -1.932
340 HD22 LEU 43 HD22 LEU 43 47.355 -5.232 -3.538
341 HD23 LEU 43 HD23 LEU 43 45.915 -4.507 -2.826
342 H LYS 44 HN LYS 44 48.591 -2.824 -7.725
343 HA LYS 44 HA LYS 44 51.276 -2.659 -6.694
344 HB2 LYS 44 HB2 LYS 44 50.062 -3.155 -9.401
345 HB3 LYS 44 HB1 LYS 44 51.793 -2.836 -9.299
346 HG2 LYS 44 HG2 LYS 44 52.084 -4.690 -7.740
347 HG3 LYS 44 HG1 LYS 44 50.348 -4.979 -7.719
348 HD2 LYS 44 HD2 LYS 44 50.596 -5.238 -10.312
349 HD3 LYS 44 HD1 LYS 44 52.311 -5.449 -9.959
350 HE2 LYS 44 HE2 LYS 44 51.578 -7.657 -9.865
351 HE3 LYS 44 HE1 LYS 44 51.392 -7.194 -8.173
352 HZ1 LYS 44 HZ1 LYS 44 49.394 -7.855 -10.116
353 HZ2 LYS 44 HZ2 LYS 44 49.069 -6.387 -9.324
354 HZ3 LYS 44 HZ3 LYS 44 49.287 -7.812 -8.424
355 H LYS 45 HN LYS 45 49.469 -0.579 -8.980
356 HA LYS 45 HA LYS 45 51.606 1.265 -9.430
357 HB2 LYS 45 HB2 LYS 45 49.392 0.989 -10.711
358 HB3 LYS 45 HB1 LYS 45 48.675 1.987 -9.449
359 HG2 LYS 45 HG2 LYS 45 50.228 3.805 -9.937
360 HG3 LYS 45 HG1 LYS 45 51.079 2.802 -11.108
361 HD2 LYS 45 HD2 LYS 45 49.636 4.156 -12.420
362 HD3 LYS 45 HD1 LYS 45 48.835 2.590 -12.336
363 HE2 LYS 45 HE2 LYS 45 47.276 3.363 -10.700
364 HE3 LYS 45 HE1 LYS 45 48.210 4.827 -10.392
365 HZ1 LYS 45 HZ1 LYS 45 47.654 5.689 -12.490
366 HZ2 LYS 45 HZ2 LYS 45 46.200 5.082 -11.853
367 HZ3 LYS 45 HZ3 LYS 45 47.042 4.205 -13.040
368 H TYR 46 HN TYR 46 48.972 1.231 -7.045
369 HA TYR 46 HA TYR 46 49.448 3.771 -5.875
370 HB2 TYR 46 HB2 TYR 46 47.472 2.405 -5.372
371 HB3 TYR 46 HB1 TYR 46 48.490 1.196 -4.599
372 HD1 TYR 46 HD2 TYR 46 48.025 4.929 -4.439
373 HD2 TYR 46 HD1 TYR 46 48.498 1.250 -2.265
374 HE1 TYR 46 HE2 TYR 46 47.834 6.165 -2.298
375 HE2 TYR 46 HE1 TYR 46 48.298 2.485 -0.128
376 HH TYR 46 HH TYR 46 47.174 5.660 0.062
377 H ILE 47 HN ILE 47 50.713 0.573 -4.895
378 HA ILE 47 HA ILE 47 52.394 1.435 -2.800
379 HB ILE 47 HB ILE 47 52.868 -0.776 -4.818
380 HG12 ILE 47 HG12 ILE 47 51.827 -1.120 -2.003
381 HG13 ILE 47 HG11 ILE 47 50.719 -0.734 -3.319
382 HG21 ILE 47 HG21 ILE 47 54.237 -1.730 -2.888
383 HG22 ILE 47 HG22 ILE 47 54.149 -0.128 -2.157
384 HG23 ILE 47 HG23 ILE 47 54.942 -0.343 -3.717
385 HD11 ILE 47 HD11 ILE 47 52.674 -2.970 -3.744
386 HD12 ILE 47 HD12 ILE 47 51.046 -2.765 -4.379
387 HD13 ILE 47 HD13 ILE 47 51.278 -3.263 -2.705
388 H ALA 48 HN ALA 48 53.137 1.072 -6.267
389 HA ALA 48 HA ALA 48 55.829 1.836 -6.227
390 HB1 ALA 48 HB1 ALA 48 54.678 0.995 -8.237
391 HB2 ALA 48 HB2 ALA 48 55.515 2.509 -8.576
392 HB3 ALA 48 HB3 ALA 48 53.767 2.502 -8.346
393 H GLU 49 HN GLU 49 52.962 3.959 -6.453
394 HA GLU 49 HA GLU 49 54.349 6.396 -6.785
395 HB2 GLU 49 HB2 GLU 49 51.799 5.893 -6.870
396 HB3 GLU 49 HB1 GLU 49 51.828 6.190 -5.132
397 HG2 GLU 49 HG2 GLU 49 52.966 8.394 -5.628
398 HG3 GLU 49 HG1 GLU 49 52.635 8.098 -7.335
399 H LEU 50 HN LEU 50 53.829 4.470 -3.875
400 HA LEU 50 HA LEU 50 54.678 6.639 -2.097
401 HB2 LEU 50 HB2 LEU 50 54.578 3.690 -1.429
402 HB3 LEU 50 HB1 LEU 50 54.477 5.053 -0.319
403 HG LEU 50 HG LEU 50 52.419 4.231 -2.388
404 HD11 LEU 50 HD11 LEU 50 52.455 4.350 0.635
405 HD12 LEU 50 HD12 LEU 50 52.239 2.925 -0.383
406 HD13 LEU 50 HD13 LEU 50 50.978 4.155 -0.306
407 HD21 LEU 50 HD21 LEU 50 52.371 6.598 -2.468
408 HD22 LEU 50 HD22 LEU 50 52.717 6.751 -0.746
409 HD23 LEU 50 HD23 LEU 50 51.132 6.197 -1.282
410 H GLU 51 HN GLU 51 56.222 3.915 -3.730
411 HA GLU 51 HA GLU 51 58.679 3.997 -2.243
412 HB2 GLU 51 HB2 GLU 51 58.049 3.082 -5.059
413 HB3 GLU 51 HB1 GLU 51 59.645 2.915 -4.329
414 HG2 GLU 51 HG2 GLU 51 58.821 1.468 -2.619
415 HG3 GLU 51 HG1 GLU 51 57.143 1.849 -3.006
416 H VAL 52 HN VAL 52 57.413 5.892 -4.914
417 HA VAL 52 HA VAL 52 59.983 7.151 -5.507
418 HB VAL 52 HB VAL 52 57.195 8.063 -6.288
419 HG11 VAL 52 HG11 VAL 52 58.545 9.022 -8.239
420 HG12 VAL 52 HG12 VAL 52 59.986 8.687 -7.280
421 HG13 VAL 52 HG13 VAL 52 58.772 9.819 -6.683
422 HG21 VAL 52 HG21 VAL 52 59.139 6.283 -7.796
423 HG22 VAL 52 HG22 VAL 52 57.556 6.810 -8.363
424 HG23 VAL 52 HG23 VAL 52 57.678 5.714 -6.988
425 H GLN 53 HN GLN 53 57.217 7.807 -3.424
426 HA GLN 53 HA GLN 53 57.927 10.567 -2.890
427 HB2 GLN 53 HB2 GLN 53 56.158 8.547 -1.500
428 HB3 GLN 53 HB1 GLN 53 56.433 10.153 -0.823
429 HG2 GLN 53 HG2 GLN 53 55.544 11.213 -2.808
430 HG3 GLN 53 HG1 GLN 53 55.435 9.662 -3.642
431 HE21 GLN 53 HE21 GLN 53 53.706 8.192 -3.012
432 HE22 GLN 53 HE22 GLN 53 52.410 8.708 -2.044
433 H THR 54 HN THR 54 58.698 7.453 -1.382
434 HA THR 54 HA THR 54 60.467 8.855 0.590
435 HB THR 54 HB THR 54 60.548 6.481 1.602
436 HG1 THR 54 HG1 THR 54 58.756 6.212 -0.500
437 HG21 THR 54 HG21 THR 54 59.208 8.379 2.513
438 HG22 THR 54 HG22 THR 54 58.438 6.814 2.774
439 HG23 THR 54 HG23 THR 54 57.861 7.879 1.491
440 H GLY 55 HN GLY 55 60.949 8.191 -2.383
441 HA2 GLY 55 HA2 GLY 55 62.811 7.532 -3.654
442 HA3 GLY 55 HA1 GLY 55 63.727 7.540 -2.145
443 H MET 56 HN MET 56 63.423 5.598 -0.722
444 HA MET 56 HA MET 56 63.526 3.281 -0.434
445 HB2 MET 56 HB2 MET 56 61.053 3.871 -1.533
446 HB3 MET 56 HB1 MET 56 61.653 2.663 -2.662
447 HG2 MET 56 HG2 MET 56 60.453 1.499 -0.922
448 HG3 MET 56 HG1 MET 56 62.171 1.190 -0.667
449 HE1 MET 56 HE1 MET 56 58.921 2.254 1.144
450 HE2 MET 56 HE2 MET 56 59.296 3.505 -0.037
451 HE3 MET 56 HE3 MET 56 59.337 3.887 1.681
452 H THR 57 HN THR 57 64.333 1.293 -1.490
453 HA THR 57 HA THR 57 65.979 0.298 -2.847
454 HB THR 57 HB THR 57 65.456 0.361 -5.248
455 HG1 THR 57 HG1 THR 57 64.913 2.705 -5.061
456 HG21 THR 57 HG21 THR 57 62.837 0.408 -3.748
457 HG22 THR 57 HG22 THR 57 64.005 -0.898 -3.545
458 HG23 THR 57 HG23 THR 57 63.287 -0.594 -5.127
459 H GLN 58 HN GLN 58 67.366 2.132 -1.748
460 HA GLN 58 HA GLN 58 69.122 3.178 -3.786
461 HB2 GLN 58 HB2 GLN 58 67.233 4.841 -3.879
462 HB3 GLN 58 HB1 GLN 58 67.573 5.242 -2.195
463 HG2 GLN 58 HG2 GLN 58 69.837 5.939 -2.773
464 HG3 GLN 58 HG1 GLN 58 69.596 5.433 -4.445
465 HE21 GLN 58 HE21 GLN 58 68.685 6.960 -5.862
466 HE22 GLN 58 HE22 GLN 58 68.011 8.437 -5.369
467 H ARG 59 HN ARG 59 71.123 3.323 -2.884
468 HA ARG 59 HA ARG 59 71.598 4.262 -0.198
469 HB2 ARG 59 HB2 ARG 59 70.604 1.949 0.184
470 HB3 ARG 59 HB1 ARG 59 72.037 1.296 -0.611
471 HG2 ARG 59 HG2 ARG 59 73.473 2.441 1.050
472 HG3 ARG 59 HG1 ARG 59 72.032 3.056 1.859
473 HD2 ARG 59 HD2 ARG 59 72.831 0.151 1.531
474 HD3 ARG 59 HD1 ARG 59 72.767 1.068 3.036
475 HE ARG 59 HE ARG 59 70.187 1.249 2.042
476 HH11 ARG 59 HH21 ARG 59 72.437 -1.273 2.722
477 HH12 ARG 59 HH22 ARG 59 71.217 -2.438 3.113
478 HH21 ARG 59 HH11 ARG 59 68.580 -0.258 2.549
479 HH22 ARG 59 HH12 ARG 59 69.033 -1.864 3.016
480 H ARG 60 HN ARG 60 73.876 4.422 0.228
481 HA ARG 60 HA ARG 60 75.853 3.237 -1.511
482 HB2 ARG 60 HB2 ARG 60 74.747 5.045 -2.969
483 HB3 ARG 60 HB1 ARG 60 75.500 6.216 -1.886
484 HG2 ARG 60 HG2 ARG 60 77.715 5.292 -2.379
485 HG3 ARG 60 HG1 ARG 60 76.989 4.060 -3.412
486 HD2 ARG 60 HD2 ARG 60 77.869 5.967 -4.734
487 HD3 ARG 60 HD1 ARG 60 76.124 5.793 -4.915
488 HE ARG 60 HE ARG 60 76.395 7.588 -2.823
489 HH11 ARG 60 HH21 ARG 60 77.580 7.307 -6.048
490 HH12 ARG 60 HH22 ARG 60 77.667 9.017 -6.307
491 HH21 ARG 60 HH11 ARG 60 76.501 9.823 -3.143
492 HH22 ARG 60 HH12 ARG 60 77.056 10.441 -4.662
493 H ARG 61 HN ARG 61 75.803 3.184 1.173
494 HA ARG 61 HA ARG 61 76.969 3.788 3.122
495 HB2 ARG 61 HB2 ARG 61 79.003 4.701 1.063
496 HB3 ARG 61 HB1 ARG 61 79.334 4.339 2.758
497 HG2 ARG 61 HG2 ARG 61 78.540 2.011 2.389
498 HG3 ARG 61 HG1 ARG 61 78.313 2.380 0.682
499 HD2 ARG 61 HD2 ARG 61 80.930 3.209 1.115
500 HD3 ARG 61 HD1 ARG 61 80.813 1.788 2.148
501 HE ARG 61 HE ARG 61 81.156 1.702 -0.634
502 HH11 ARG 61 HH21 ARG 61 78.895 0.487 1.678
503 HH12 ARG 61 HH22 ARG 61 78.367 -0.809 0.665
504 HH21 ARG 61 HH11 ARG 61 80.484 0.010 -1.948
505 HH22 ARG 61 HH12 ARG 61 79.267 -1.084 -1.381
506 H GLY 62 HN GLY 62 75.228 5.557 3.255
507 HA2 GLY 62 HA2 GLY 62 75.823 8.249 2.472
508 HA3 GLY 62 HA1 GLY 62 74.660 7.788 3.716