Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
562281 | 2ltf RC | 18475 | 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 H MET 1 1.808 0.000 0.855
2 HA MET 1 HA MET 1 1.421 -0.269 -2.044
3 HB2 MET 1 2HB MET 1 1.987 2.131 -1.111
4 HB3 MET 1 3HB MET 1 3.619 1.481 -1.023
5 HG2 MET 1 2HG MET 1 2.001 1.327 -3.539
6 HG3 MET 1 3HG MET 1 2.944 2.757 -3.125
7 HE1 MET 1 3HE MET 1 2.559 -0.207 -4.788
8 HE2 MET 1 1HE MET 1 3.814 0.316 -5.912
9 HE3 MET 1 2HE MET 1 4.071 -1.109 -4.905
10 H LYS 2 H LYS 2 1.991 -2.467 -1.810
11 HA LYS 2 HA LYS 2 4.823 -2.932 -1.140
12 HB2 LYS 2 2HB LYS 2 4.194 -5.248 -0.612
13 HB3 LYS 2 3HB LYS 2 3.320 -4.095 0.389
14 HG2 LYS 2 2HG LYS 2 1.406 -4.316 -1.240
15 HG3 LYS 2 3HG LYS 2 2.283 -5.676 -1.946
16 HD2 LYS 2 2HD LYS 2 0.800 -6.648 -0.405
17 HD3 LYS 2 3HD LYS 2 2.362 -6.634 0.418
18 HE2 LYS 2 2HE LYS 2 0.702 -5.907 1.975
19 HE3 LYS 2 3HE LYS 2 1.675 -4.507 1.527
20 HZ1 LYS 2 3HZ LYS 2 -0.394 -4.561 -0.279
21 HZ2 LYS 2 1HZ LYS 2 -0.224 -3.505 1.032
22 HZ3 LYS 2 2HZ LYS 2 -1.117 -4.930 1.206
23 H THR 3 H THR 3 6.016 -4.373 -2.452
24 HA THR 3 HA THR 3 4.804 -5.049 -5.043
25 HB THR 3 HB THR 3 6.046 -3.035 -5.482
26 HG1 THR 3 HG1 THR 3 7.869 -4.127 -6.767
27 HG21 THR 3 3HG2 THR 3 7.755 -3.976 -3.449
28 HG22 THR 3 1HG2 THR 3 7.868 -2.457 -4.337
29 HG23 THR 3 2HG2 THR 3 8.726 -3.884 -4.918
30 H PHE 4 H PHE 4 5.729 -6.832 -6.120
31 HA PHE 4 HA PHE 4 6.799 -8.824 -4.358
32 HB2 PHE 4 2HB PHE 4 6.546 -9.044 -7.356
33 HB3 PHE 4 3HB PHE 4 6.543 -10.346 -6.171
34 HD1 PHE 4 HD1 PHE 4 4.628 -9.675 -4.217
35 HD2 PHE 4 HD2 PHE 4 4.516 -8.865 -8.394
36 HE1 PHE 4 HE1 PHE 4 2.171 -9.591 -4.131
37 HE2 PHE 4 HE2 PHE 4 2.059 -8.779 -8.315
38 HZ PHE 4 HZ PHE 4 0.883 -9.141 -6.182
39 H ALA 5 H ALA 5 8.868 -8.857 -3.798
40 HA ALA 5 HA ALA 5 10.932 -7.527 -5.182
41 HB1 ALA 5 1HB ALA 5 11.546 -9.799 -3.353
42 HB2 ALA 5 2HB ALA 5 12.329 -8.225 -3.500
43 HB3 ALA 5 3HB ALA 5 10.762 -8.359 -2.703
44 H LEU 6 H LEU 6 12.711 -8.369 -6.343
45 HA LEU 6 HA LEU 6 12.586 -11.124 -7.264
46 HB2 LEU 6 2HB LEU 6 12.476 -8.793 -9.172
47 HB3 LEU 6 3HB LEU 6 12.664 -10.485 -9.627
48 HG LEU 6 HG LEU 6 10.240 -9.439 -8.178
49 HD11 LEU 6 1HD1 LEU 6 9.175 -9.616 -10.477
50 HD12 LEU 6 2HD1 LEU 6 10.816 -9.596 -11.122
51 HD13 LEU 6 3HD1 LEU 6 10.219 -8.224 -10.188
52 HD21 LEU 6 3HD2 LEU 6 9.879 -11.634 -7.987
53 HD22 LEU 6 1HD2 LEU 6 11.160 -12.033 -9.132
54 HD23 LEU 6 2HD2 LEU 6 9.553 -11.610 -9.721
55 H GLN 7 H GLN 7 14.433 -11.256 -9.133
56 HA GLN 7 HA GLN 7 16.860 -11.088 -7.837
57 HB2 GLN 7 2HB GLN 7 16.128 -12.231 -10.102
58 HB3 GLN 7 3HB GLN 7 16.800 -10.766 -10.807
59 HG2 GLN 7 2HG GLN 7 18.827 -11.385 -9.217
60 HG3 GLN 7 3HG GLN 7 18.154 -13.002 -9.417
61 HE21 GLN 7 1HE2 GLN 7 17.779 -13.703 -11.665
62 HE22 GLN 7 2HE2 GLN 7 18.914 -13.212 -12.871
63 H GLY 8 H GLY 8 18.127 -9.456 -7.259
64 HA2 GLY 8 2HA GLY 8 19.106 -7.381 -7.183
65 HA3 GLY 8 3HA GLY 8 18.793 -7.277 -8.909
66 H ASP 9 H ASP 9 16.139 -7.759 -6.742
67 HA ASP 9 HA ASP 9 15.410 -4.917 -7.005
68 HB2 ASP 9 2HB ASP 9 13.788 -7.370 -7.580
69 HB3 ASP 9 3HB ASP 9 12.982 -5.909 -7.019
70 H THR 10 H THR 10 16.655 -6.505 -4.812
71 HA THR 10 HA THR 10 14.698 -6.862 -2.768
72 HB THR 10 HB THR 10 16.474 -7.357 -1.301
73 HG1 THR 10 HG1 THR 10 18.185 -6.127 -1.306
74 HG21 THR 10 3HG2 THR 10 16.215 -8.899 -3.280
75 HG22 THR 10 1HG2 THR 10 17.785 -8.960 -2.480
76 HG23 THR 10 2HG2 THR 10 17.603 -8.085 -4.000
77 H LEU 11 H LEU 11 15.247 -5.689 -0.554
78 HA LEU 11 HA LEU 11 14.280 -3.122 -0.676
79 HB2 LEU 11 2HB LEU 11 16.132 -4.266 1.409
80 HB3 LEU 11 3HB LEU 11 15.137 -2.825 1.606
81 HG LEU 11 HG LEU 11 14.183 -5.672 1.325
82 HD11 LEU 11 1HD1 LEU 11 13.802 -3.725 3.588
83 HD12 LEU 11 2HD1 LEU 11 15.100 -4.917 3.534
84 HD13 LEU 11 3HD1 LEU 11 13.418 -5.446 3.563
85 HD21 LEU 11 3HD2 LEU 11 12.383 -4.747 0.359
86 HD22 LEU 11 1HD2 LEU 11 12.822 -3.116 0.868
87 HD23 LEU 11 2HD2 LEU 11 11.995 -4.197 1.990
88 H ASP 12 H ASP 12 17.656 -4.173 -0.671
89 HA ASP 12 HA ASP 12 18.934 -1.736 -0.419
90 HB2 ASP 12 2HB ASP 12 20.321 -3.629 -0.390
91 HB3 ASP 12 3HB ASP 12 19.655 -4.253 -1.896
92 H ALA 13 H ALA 13 17.464 -3.191 -3.269
93 HA ALA 13 HA ALA 13 18.327 -1.003 -4.973
94 HB1 ALA 13 1HB ALA 13 18.343 -2.822 -6.309
95 HB2 ALA 13 2HB ALA 13 17.092 -3.650 -5.380
96 HB3 ALA 13 3HB ALA 13 16.647 -2.397 -6.539
97 H ILE 14 H ILE 14 15.205 -2.410 -3.972
98 HA ILE 14 HA ILE 14 13.493 -0.579 -5.093
99 HB ILE 14 HB ILE 14 13.196 -1.896 -2.391
100 HG12 ILE 14 2HG1 ILE 14 12.108 -2.753 -5.079
101 HG13 ILE 14 3HG1 ILE 14 13.562 -3.423 -4.348
102 HG21 ILE 14 1HG2 ILE 14 11.124 -0.644 -4.190
103 HG22 ILE 14 2HG2 ILE 14 10.787 -1.548 -2.714
104 HG23 ILE 14 3HG2 ILE 14 11.668 -0.023 -2.631
105 HD11 ILE 14 3HD1 ILE 14 10.804 -3.541 -3.152
106 HD12 ILE 14 1HD1 ILE 14 11.605 -4.851 -4.019
107 HD13 ILE 14 2HD1 ILE 14 12.266 -4.271 -2.490
108 H CYS 15 H CYS 15 15.009 -0.380 -1.879
109 HA CYS 15 HA CYS 15 13.897 1.993 -1.008
110 HB2 CYS 15 2HB CYS 15 16.592 0.745 -0.515
111 HB3 CYS 15 3HB CYS 15 16.134 2.265 0.245
112 HG CYS 15 HG CYS 15 13.671 0.233 0.777
113 H VAL 16 H VAL 16 16.549 1.476 -3.249
114 HA VAL 16 HA VAL 16 17.164 4.306 -3.407
115 HB VAL 16 HB VAL 16 18.227 2.007 -5.056
116 HG11 VAL 16 1HG1 VAL 16 18.946 3.667 -6.378
117 HG12 VAL 16 2HG1 VAL 16 18.613 4.905 -5.165
118 HG13 VAL 16 3HG1 VAL 16 20.114 3.982 -5.095
119 HG21 VAL 16 3HG2 VAL 16 18.672 2.572 -2.369
120 HG22 VAL 16 1HG2 VAL 16 19.648 1.535 -3.408
121 HG23 VAL 16 2HG2 VAL 16 20.078 3.233 -3.203
122 H ARG 17 H ARG 17 15.121 2.043 -4.980
123 HA ARG 17 HA ARG 17 14.890 3.575 -7.428
124 HB2 ARG 17 2HB ARG 17 13.409 1.142 -6.417
125 HB3 ARG 17 3HB ARG 17 13.127 1.885 -7.985
126 HG2 ARG 17 2HG ARG 17 15.800 1.524 -8.089
127 HG3 ARG 17 3HG ARG 17 15.322 0.161 -7.075
128 HD2 ARG 17 2HD ARG 17 13.960 -0.751 -8.736
129 HD3 ARG 17 3HD ARG 17 13.879 0.767 -9.630
130 HE ARG 17 HE ARG 17 16.505 0.120 -9.735
131 HH11 ARG 17 1HH1 ARG 17 13.576 -1.598 -10.502
132 HH12 ARG 17 2HH1 ARG 17 14.309 -2.555 -11.746
133 HH21 ARG 17 1HH2 ARG 17 17.481 -1.135 -11.371
134 HH22 ARG 17 2HH2 ARG 17 16.530 -2.292 -12.239
135 H TYR 18 H TYR 18 13.396 3.453 -4.343
136 HA TYR 18 HA TYR 18 11.110 5.027 -5.318
137 HB2 TYR 18 2HB TYR 18 11.498 3.261 -2.921
138 HB3 TYR 18 3HB TYR 18 10.258 4.511 -2.910
139 HD1 TYR 18 HD1 TYR 18 11.418 1.507 -4.760
140 HD2 TYR 18 HD2 TYR 18 8.183 4.150 -3.950
141 HE1 TYR 18 HE1 TYR 18 9.889 -0.009 -5.949
142 HE2 TYR 18 HE2 TYR 18 6.646 2.641 -5.136
143 HH TYR 18 HH TYR 18 7.775 -0.437 -6.495
144 H TYR 19 H TYR 19 13.107 4.842 -2.365
145 HA TYR 19 HA TYR 19 12.702 7.662 -1.868
146 HB2 TYR 19 2HB TYR 19 14.548 5.843 -0.333
147 HB3 TYR 19 3HB TYR 19 13.737 7.300 0.229
148 HD1 TYR 19 HD1 TYR 19 11.221 7.246 0.517
149 HD2 TYR 19 HD2 TYR 19 13.539 3.730 -0.092
150 HE1 TYR 19 HE1 TYR 19 9.377 5.883 1.406
151 HE2 TYR 19 HE2 TYR 19 11.701 2.358 0.795
152 HH TYR 19 HH TYR 19 9.576 2.345 1.479
153 H GLY 20 H GLY 20 15.287 5.533 -2.947
154 HA2 GLY 20 2HA GLY 20 17.054 6.198 -4.353
155 HA3 GLY 20 3HA GLY 20 16.749 7.871 -3.908
156 H ARG 21 H ARG 21 16.915 5.565 -1.359
157 HA ARG 21 HA ARG 21 19.729 5.739 -0.901
158 HB2 ARG 21 2HB ARG 21 19.658 7.083 1.139
159 HB3 ARG 21 3HB ARG 21 19.095 8.014 -0.243
160 HG2 ARG 21 2HG ARG 21 17.066 6.599 1.396
161 HG3 ARG 21 3HG ARG 21 17.829 8.040 2.072
162 HD2 ARG 21 2HD ARG 21 17.262 8.980 -0.356
163 HD3 ARG 21 3HD ARG 21 15.995 7.759 -0.241
164 HE ARG 21 HE ARG 21 15.774 9.082 2.101
165 HH11 ARG 21 1HH1 ARG 21 15.905 10.127 -1.217
166 HH12 ARG 21 2HH1 ARG 21 14.923 11.529 -0.950
167 HH21 ARG 21 1HH2 ARG 21 14.480 10.924 2.465
168 HH22 ARG 21 2HH2 ARG 21 14.113 11.982 1.145
169 H THR 22 H THR 22 20.353 4.710 1.165
170 HA THR 22 HA THR 22 18.308 2.771 2.034
171 HB THR 22 HB THR 22 20.631 1.545 2.712
172 HG1 THR 22 HG1 THR 22 22.212 2.408 1.614
173 HG21 THR 22 3HG2 THR 22 18.562 0.867 1.242
174 HG22 THR 22 1HG2 THR 22 20.081 -0.018 1.110
175 HG23 THR 22 2HG2 THR 22 19.664 1.203 -0.092
176 H GLU 23 H GLU 23 20.750 5.045 3.001
177 HA GLU 23 HA GLU 23 20.880 4.259 5.741
178 HB2 GLU 23 2HB GLU 23 22.552 5.682 4.347
179 HB3 GLU 23 3HB GLU 23 21.507 7.030 4.772
180 HG2 GLU 23 2HG GLU 23 23.210 7.042 6.371
181 HG3 GLU 23 3HG GLU 23 21.819 6.329 7.185
182 H GLY 24 H GLY 24 19.191 4.379 7.065
183 HA2 GLY 24 2HA GLY 24 17.762 5.700 8.439
184 HA3 GLY 24 3HA GLY 24 17.669 6.889 7.148
185 H VAL 25 H VAL 25 17.280 4.453 5.286
186 HA VAL 25 HA VAL 25 14.371 4.355 5.648
187 HB VAL 25 HB VAL 25 15.943 3.512 3.214
188 HG11 VAL 25 1HG1 VAL 25 13.264 4.453 2.755
189 HG12 VAL 25 2HG1 VAL 25 13.990 2.896 2.349
190 HG13 VAL 25 3HG1 VAL 25 13.265 3.146 3.938
191 HG21 VAL 25 3HG2 VAL 25 15.126 6.181 4.163
192 HG22 VAL 25 1HG2 VAL 25 16.428 5.712 3.070
193 HG23 VAL 25 2HG2 VAL 25 14.772 5.825 2.473
194 H VAL 26 H VAL 26 17.183 2.274 5.134
195 HA VAL 26 HA VAL 26 15.952 -0.189 4.901
196 HB VAL 26 HB VAL 26 18.013 -1.168 5.866
197 HG11 VAL 26 1HG1 VAL 26 18.150 0.950 3.759
198 HG12 VAL 26 2HG1 VAL 26 19.603 0.064 4.227
199 HG13 VAL 26 3HG1 VAL 26 18.206 -0.804 3.588
200 HG21 VAL 26 3HG2 VAL 26 19.657 1.104 6.090
201 HG22 VAL 26 1HG2 VAL 26 18.217 1.427 7.055
202 HG23 VAL 26 2HG2 VAL 26 19.181 -0.017 7.365
203 H GLU 27 H GLU 27 16.367 1.810 7.721
204 HA GLU 27 HA GLU 27 15.783 -0.246 9.628
205 HB2 GLU 27 2HB GLU 27 15.938 2.756 9.784
206 HB3 GLU 27 3HB GLU 27 15.420 1.786 11.156
207 HG2 GLU 27 2HG GLU 27 17.527 0.663 11.245
208 HG3 GLU 27 3HG GLU 27 18.047 1.420 9.741
209 H THR 28 H THR 28 13.933 2.144 7.857
210 HA THR 28 HA THR 28 11.534 1.919 9.350
211 HB THR 28 HB THR 28 11.468 2.597 6.439
212 HG1 THR 28 HG1 THR 28 12.142 4.786 7.206
213 HG21 THR 28 3HG2 THR 28 9.933 3.182 8.880
214 HG22 THR 28 1HG2 THR 28 9.399 3.076 7.203
215 HG23 THR 28 2HG2 THR 28 10.160 4.553 7.795
216 H VAL 29 H VAL 29 12.391 0.600 6.144
217 HA VAL 29 HA VAL 29 10.126 -0.963 5.771
218 HB VAL 29 HB VAL 29 12.923 -1.595 4.820
219 HG11 VAL 29 1HG1 VAL 29 11.887 -3.492 4.183
220 HG12 VAL 29 2HG1 VAL 29 10.277 -2.780 4.307
221 HG13 VAL 29 3HG1 VAL 29 11.268 -2.478 2.880
222 HG21 VAL 29 3HG2 VAL 29 12.743 0.313 3.675
223 HG22 VAL 29 1HG2 VAL 29 11.503 -0.499 2.720
224 HG23 VAL 29 2HG2 VAL 29 11.041 0.498 4.099
225 H LEU 30 H LEU 30 12.876 -1.488 7.806
226 HA LEU 30 HA LEU 30 12.617 -4.299 8.111
227 HB2 LEU 30 2HB LEU 30 14.532 -2.586 8.763
228 HB3 LEU 30 3HB LEU 30 13.700 -2.627 10.316
229 HG LEU 30 HG LEU 30 14.047 -5.055 10.427
230 HD11 LEU 30 1HD1 LEU 30 14.296 -6.076 8.452
231 HD12 LEU 30 2HD1 LEU 30 15.999 -5.649 8.622
232 HD13 LEU 30 3HD1 LEU 30 14.925 -4.626 7.668
233 HD21 LEU 30 3HD2 LEU 30 15.723 -4.060 11.603
234 HD22 LEU 30 1HD2 LEU 30 16.295 -3.128 10.219
235 HD23 LEU 30 2HD2 LEU 30 16.690 -4.842 10.352
236 H ALA 31 H ALA 31 11.316 -1.524 9.864
237 HA ALA 31 HA ALA 31 10.088 -3.090 11.918
238 HB1 ALA 31 1HB ALA 31 10.291 -1.026 12.776
239 HB2 ALA 31 2HB ALA 31 10.240 -0.251 11.192
240 HB3 ALA 31 3HB ALA 31 8.741 -0.735 11.985
241 H ALA 32 H ALA 32 9.115 -1.887 8.783
242 HA ALA 32 HA ALA 32 6.327 -2.551 9.186
243 HB1 ALA 32 1HB ALA 32 6.904 -0.625 7.819
244 HB2 ALA 32 2HB ALA 32 7.792 -1.664 6.703
245 HB3 ALA 32 3HB ALA 32 6.043 -1.830 6.861
246 H ASN 33 H ASN 33 9.174 -4.094 8.021
247 HA ASN 33 HA ASN 33 7.562 -6.422 7.233
248 HB2 ASN 33 2HB ASN 33 9.938 -5.282 5.751
249 HB3 ASN 33 3HB ASN 33 9.268 -6.881 5.442
250 HD21 ASN 33 1HD2 ASN 33 8.581 -3.442 5.381
251 HD22 ASN 33 2HD2 ASN 33 7.322 -3.524 4.200
252 HA PRO 34 HA PRO 34 10.740 -7.540 10.418
253 HB2 PRO 34 2HB PRO 34 9.048 -9.057 11.902
254 HB3 PRO 34 3HB PRO 34 9.208 -7.310 12.114
255 HG2 PRO 34 2HG PRO 34 7.124 -8.854 10.619
256 HG3 PRO 34 3HG PRO 34 6.925 -7.460 11.698
257 HD2 PRO 34 2HD PRO 34 6.907 -7.228 9.000
258 HD3 PRO 34 3HD PRO 34 7.528 -5.950 10.064
259 H GLY 35 H GLY 35 11.814 -9.501 10.642
260 HA2 GLY 35 2HA GLY 35 12.168 -11.802 10.356
261 HA3 GLY 35 3HA GLY 35 10.676 -11.894 9.432
262 H LEU 36 H LEU 36 11.882 -9.391 7.981
263 HA LEU 36 HA LEU 36 12.987 -10.925 5.809
264 HB2 LEU 36 2HB LEU 36 11.532 -8.654 5.919
265 HB3 LEU 36 3HB LEU 36 13.151 -7.982 5.734
266 HG LEU 36 HG LEU 36 11.979 -8.202 3.591
267 HD11 LEU 36 1HD1 LEU 36 13.847 -8.797 2.453
268 HD12 LEU 36 2HD1 LEU 36 14.098 -10.261 3.404
269 HD13 LEU 36 3HD1 LEU 36 14.551 -8.691 4.067
270 HD21 LEU 36 3HD2 LEU 36 11.392 -10.317 2.667
271 HD22 LEU 36 1HD2 LEU 36 10.660 -10.222 4.269
272 HD23 LEU 36 2HD2 LEU 36 12.121 -11.179 4.023
273 H ALA 37 H ALA 37 14.210 -9.186 8.495
274 HA ALA 37 HA ALA 37 16.772 -8.541 7.399
275 HB1 ALA 37 1HB ALA 37 15.365 -7.911 9.729
276 HB2 ALA 37 2HB ALA 37 16.801 -8.783 10.266
277 HB3 ALA 37 3HB ALA 37 16.968 -7.345 9.260
278 H GLU 38 H GLU 38 15.373 -11.441 8.234
279 HA GLU 38 HA GLU 38 17.801 -12.689 9.240
280 HB2 GLU 38 2HB GLU 38 15.070 -13.844 8.649
281 HB3 GLU 38 3HB GLU 38 16.406 -14.737 9.361
282 HG2 GLU 38 2HG GLU 38 15.536 -12.229 10.687
283 HG3 GLU 38 3HG GLU 38 14.511 -13.655 10.835
284 H LEU 39 H LEU 39 15.957 -12.437 6.294
285 HA LEU 39 HA LEU 39 16.918 -14.615 4.864
286 HB2 LEU 39 2HB LEU 39 15.398 -12.325 4.333
287 HB3 LEU 39 3HB LEU 39 16.733 -12.285 3.183
288 HG LEU 39 HG LEU 39 16.098 -14.439 2.301
289 HD11 LEU 39 1HD1 LEU 39 15.247 -15.797 3.901
290 HD12 LEU 39 2HD1 LEU 39 13.722 -15.214 3.234
291 HD13 LEU 39 3HD1 LEU 39 14.375 -14.493 4.705
292 HD21 LEU 39 3HD2 LEU 39 13.863 -12.443 2.558
293 HD22 LEU 39 1HD2 LEU 39 13.759 -13.866 1.522
294 HD23 LEU 39 2HD2 LEU 39 15.000 -12.648 1.225
295 H GLY 40 H GLY 40 18.237 -11.301 4.957
296 HA2 GLY 40 2HA GLY 40 20.448 -10.619 4.843
297 HA3 GLY 40 3HA GLY 40 20.928 -12.308 4.759
298 H ALA 41 H ALA 41 20.937 -13.367 2.722
299 HA ALA 41 HA ALA 41 21.950 -11.841 0.612
300 HB1 ALA 41 1HB ALA 41 22.276 -14.309 1.016
301 HB2 ALA 41 2HB ALA 41 20.683 -14.551 0.296
302 HB3 ALA 41 3HB ALA 41 21.983 -13.837 -0.658
303 H VAL 42 H VAL 42 20.800 -12.516 -1.719
304 HA VAL 42 HA VAL 42 18.792 -10.652 -2.094
305 HB VAL 42 HB VAL 42 19.200 -13.140 -3.757
306 HG11 VAL 42 1HG1 VAL 42 17.366 -12.309 -4.763
307 HG12 VAL 42 2HG1 VAL 42 17.575 -10.706 -4.054
308 HG13 VAL 42 3HG1 VAL 42 18.508 -11.170 -5.478
309 HG21 VAL 42 3HG2 VAL 42 20.941 -10.911 -3.278
310 HG22 VAL 42 1HG2 VAL 42 21.206 -12.339 -4.278
311 HG23 VAL 42 2HG2 VAL 42 20.423 -10.916 -4.964
312 H LEU 43 H LEU 43 16.552 -10.778 -2.377
313 HA LEU 43 HA LEU 43 15.265 -12.788 -0.736
314 HB2 LEU 43 2HB LEU 43 13.760 -10.711 -2.254
315 HB3 LEU 43 3HB LEU 43 13.432 -11.395 -0.663
316 HG LEU 43 HG LEU 43 15.693 -9.485 -1.238
317 HD11 LEU 43 1HD1 LEU 43 14.221 -7.845 -0.022
318 HD12 LEU 43 2HD1 LEU 43 12.891 -8.978 -0.266
319 HD13 LEU 43 3HD1 LEU 43 13.708 -8.264 -1.657
320 HD21 LEU 43 3HD2 LEU 43 14.470 -10.543 1.306
321 HD22 LEU 43 1HD2 LEU 43 15.626 -9.213 1.234
322 HD23 LEU 43 2HD2 LEU 43 16.104 -10.827 0.706
323 HA PRO 44 HA PRO 44 13.814 -15.403 -3.951
324 HB2 PRO 44 2HB PRO 44 11.440 -16.220 -2.919
325 HB3 PRO 44 3HB PRO 44 12.999 -16.775 -2.299
326 HG2 PRO 44 2HG PRO 44 11.190 -14.640 -1.236
327 HG3 PRO 44 3HG PRO 44 12.080 -15.895 -0.353
328 HD2 PRO 44 2HD PRO 44 12.949 -13.336 -0.520
329 HD3 PRO 44 3HD PRO 44 14.060 -14.717 -0.424
330 H HIS 45 H HIS 45 12.941 -14.957 -5.869
331 HA HIS 45 HA HIS 45 11.524 -12.687 -6.509
332 HB2 HIS 45 2HB HIS 45 10.836 -13.926 -8.592
333 HB3 HIS 45 3HB HIS 45 12.564 -13.955 -8.252
334 HD1 HIS 45 HD1 HIS 45 9.630 -16.141 -8.700
335 HD2 HIS 45 HD2 HIS 45 13.535 -16.487 -7.326
336 HE1 HIS 45 HE1 HIS 45 10.105 -18.609 -8.643
337 H GLY 46 H GLY 46 9.696 -12.085 -5.509
338 HA2 GLY 46 2HA GLY 46 7.230 -12.444 -5.891
339 HA3 GLY 46 3HA GLY 46 7.524 -14.078 -5.313
340 H THR 47 H THR 47 9.495 -11.985 -3.643
341 HA THR 47 HA THR 47 8.111 -12.369 -1.200
342 HB THR 47 HB THR 47 10.372 -10.458 -1.822
343 HG1 THR 47 HG1 THR 47 10.698 -12.879 -0.439
344 HG21 THR 47 3HG2 THR 47 10.349 -11.414 0.869
345 HG22 THR 47 1HG2 THR 47 8.774 -10.714 0.500
346 HG23 THR 47 2HG2 THR 47 10.238 -9.753 0.286
347 H ALA 48 H ALA 48 6.521 -11.228 -0.312
348 HA ALA 48 HA ALA 48 5.644 -8.771 -1.594
349 HB1 ALA 48 1HB ALA 48 3.959 -9.256 0.556
350 HB2 ALA 48 2HB ALA 48 3.674 -9.696 -1.129
351 HB3 ALA 48 3HB ALA 48 4.404 -10.861 -0.025
352 H VAL 49 H VAL 49 6.947 -7.108 -0.992
353 HA VAL 49 HA VAL 49 7.284 -6.629 1.896
354 HB VAL 49 HB VAL 49 8.969 -5.593 -0.389
355 HG11 VAL 49 1HG1 VAL 49 9.617 -4.007 1.028
356 HG12 VAL 49 2HG1 VAL 49 8.662 -4.709 2.335
357 HG13 VAL 49 3HG1 VAL 49 10.307 -5.273 2.042
358 HG21 VAL 49 3HG2 VAL 49 9.794 -7.692 -0.252
359 HG22 VAL 49 1HG2 VAL 49 10.650 -7.034 1.143
360 HG23 VAL 49 2HG2 VAL 49 9.161 -7.951 1.374
361 H GLU 50 H GLU 50 6.473 -4.820 2.779
362 HA GLU 50 HA GLU 50 4.888 -3.073 1.081
363 HB2 GLU 50 2HB GLU 50 4.004 -4.003 3.233
364 HB3 GLU 50 3HB GLU 50 5.186 -3.021 4.087
365 HG2 GLU 50 2HG GLU 50 3.341 -1.688 2.175
366 HG3 GLU 50 3HG GLU 50 2.718 -2.203 3.742
367 H LEU 51 H LEU 51 5.147 -0.848 0.921
368 HA LEU 51 HA LEU 51 7.811 0.134 1.698
369 HB2 LEU 51 2HB LEU 51 6.008 1.221 -0.456
370 HB3 LEU 51 3HB LEU 51 7.685 1.665 -0.146
371 HG LEU 51 HG LEU 51 6.699 -0.984 -1.203
372 HD11 LEU 51 1HD1 LEU 51 6.983 -0.153 -3.239
373 HD12 LEU 51 2HD1 LEU 51 8.599 0.425 -2.834
374 HD13 LEU 51 3HD1 LEU 51 7.193 1.439 -2.510
375 HD21 LEU 51 3HD2 LEU 51 8.628 -1.305 0.235
376 HD22 LEU 51 1HD2 LEU 51 9.500 -0.029 -0.615
377 HD23 LEU 51 2HD2 LEU 51 9.083 -1.522 -1.455
378 HA PRO 52 HA PRO 52 5.096 2.552 4.450
379 HB2 PRO 52 2HB PRO 52 7.031 2.995 6.301
380 HB3 PRO 52 3HB PRO 52 6.076 1.509 6.247
381 HG2 PRO 52 2HG PRO 52 8.836 2.026 5.209
382 HG3 PRO 52 3HG PRO 52 8.219 0.620 6.095
383 HD2 PRO 52 2HD PRO 52 8.555 0.616 3.408
384 HD3 PRO 52 3HD PRO 52 7.270 -0.310 4.212
385 H ASP 53 H ASP 53 5.029 4.763 4.901
386 HA ASP 53 HA ASP 53 5.424 6.980 4.582
387 HB2 ASP 53 2HB ASP 53 7.717 6.086 5.603
388 HB3 ASP 53 3HB ASP 53 8.316 6.543 4.011
389 H VAL 54 H VAL 54 4.654 5.393 2.361
390 HA VAL 54 HA VAL 54 5.958 6.862 0.162
391 HB VAL 54 HB VAL 54 4.736 4.100 0.061
392 HG11 VAL 54 1HG1 VAL 54 4.285 4.814 -2.053
393 HG12 VAL 54 2HG1 VAL 54 5.581 6.012 -2.045
394 HG13 VAL 54 3HG1 VAL 54 5.957 4.305 -2.287
395 HG21 VAL 54 3HG2 VAL 54 7.568 5.100 0.020
396 HG22 VAL 54 1HG2 VAL 54 6.842 3.882 1.069
397 HG23 VAL 54 2HG2 VAL 54 7.127 3.523 -0.634
398 H GLN 55 H GLN 55 4.658 7.753 -1.422
399 HA GLN 55 HA GLN 55 1.915 8.241 -0.629
400 HB2 GLN 55 2HB GLN 55 3.767 9.396 -2.679
401 HB3 GLN 55 3HB GLN 55 2.035 9.668 -2.822
402 HG2 GLN 55 2HG GLN 55 3.393 10.238 -0.233
403 HG3 GLN 55 3HG GLN 55 3.554 11.376 -1.570
404 HE21 GLN 55 1HE2 GLN 55 2.125 11.391 1.104
405 HE22 GLN 55 2HE2 GLN 55 0.527 11.921 0.720
406 H THR 56 H THR 56 0.178 8.178 -2.301
407 HA THR 56 HA THR 56 -0.153 5.584 -3.296
408 HB THR 56 HB THR 56 -1.993 7.238 -2.781
409 HG1 THR 56 HG1 THR 56 -2.645 5.403 -3.807
410 HG21 THR 56 3HG2 THR 56 -2.511 8.980 -4.164
411 HG22 THR 56 1HG2 THR 56 -1.847 8.188 -5.592
412 HG23 THR 56 2HG2 THR 56 -0.766 8.940 -4.419
413 H ALA 57 H ALA 57 -1.034 5.531 -5.790
414 HA ALA 57 HA ALA 57 -0.433 5.401 -7.982
415 HB1 ALA 57 1HB ALA 57 1.487 7.426 -8.324
416 HB2 ALA 57 2HB ALA 57 -0.226 7.474 -8.742
417 HB3 ALA 57 3HB ALA 57 0.312 8.038 -7.160
418 HA PRO 58 HA PRO 58 3.274 3.066 -8.227
419 HB2 PRO 58 2HB PRO 58 3.991 3.382 -10.827
420 HB3 PRO 58 3HB PRO 58 2.606 2.405 -10.324
421 HG2 PRO 58 2HG PRO 58 2.666 5.209 -11.370
422 HG3 PRO 58 3HG PRO 58 1.551 3.889 -11.770
423 HD2 PRO 58 2HD PRO 58 0.902 5.872 -10.044
424 HD3 PRO 58 3HD PRO 58 0.284 4.216 -9.873
425 H VAL 59 H VAL 59 5.576 3.292 -9.496
426 HA VAL 59 HA VAL 59 6.636 5.954 -8.802
427 HB VAL 59 HB VAL 59 7.263 4.203 -7.134
428 HG11 VAL 59 1HG1 VAL 59 8.771 3.023 -9.466
429 HG12 VAL 59 2HG1 VAL 59 8.928 2.519 -7.782
430 HG13 VAL 59 3HG1 VAL 59 7.399 2.293 -8.633
431 HG21 VAL 59 3HG2 VAL 59 9.795 4.962 -8.492
432 HG22 VAL 59 1HG2 VAL 59 8.701 6.254 -7.997
433 HG23 VAL 59 2HG2 VAL 59 9.327 5.120 -6.799
434 H ALA 60 H ALA 60 8.454 6.674 -10.005
435 HA ALA 60 HA ALA 60 8.338 6.312 -12.736
436 HB1 ALA 60 1HB ALA 60 9.615 8.055 -11.219
437 HB2 ALA 60 2HB ALA 60 10.978 6.983 -11.545
438 HB3 ALA 60 3HB ALA 60 10.113 7.741 -12.882
439 H GLU 61 H GLU 61 8.448 4.336 -13.643
440 HA GLU 61 HA GLU 61 10.949 3.037 -13.891
441 HB2 GLU 61 2HB GLU 61 10.125 2.334 -11.557
442 HB3 GLU 61 3HB GLU 61 8.922 1.377 -12.411
443 HG2 GLU 61 2HG GLU 61 10.612 0.064 -13.467
444 HG3 GLU 61 3HG GLU 61 11.885 1.116 -12.850
445 H THR 62 H THR 62 10.771 1.007 -15.182
446 HA THR 62 HA THR 62 8.333 1.022 -16.840
447 HB THR 62 HB THR 62 9.935 0.193 -18.694
448 HG1 THR 62 HG1 THR 62 12.001 0.272 -18.254
449 HG21 THR 62 3HG2 THR 62 10.087 2.343 -19.541
450 HG22 THR 62 1HG2 THR 62 10.430 3.052 -17.964
451 HG23 THR 62 2HG2 THR 62 8.796 2.516 -18.352
452 H VAL 63 H VAL 63 7.246 -0.812 -16.635
453 HA VAL 63 HA VAL 63 8.371 -3.352 -17.092
454 HB VAL 63 HB VAL 63 9.287 -2.984 -14.808
455 HG11 VAL 63 1HG1 VAL 63 7.955 -2.725 -12.922
456 HG12 VAL 63 2HG1 VAL 63 7.164 -1.689 -14.111
457 HG13 VAL 63 3HG1 VAL 63 6.502 -3.284 -13.749
458 HG21 VAL 63 3HG2 VAL 63 9.095 -5.181 -14.310
459 HG22 VAL 63 1HG2 VAL 63 7.334 -5.158 -14.404
460 HG23 VAL 63 2HG2 VAL 63 8.296 -5.244 -15.880
461 H ASN 64 H ASN 64 6.808 -4.880 -17.456
462 HA ASN 64 HA ASN 64 4.031 -4.095 -16.864
463 HB2 ASN 64 2HB ASN 64 5.219 -5.183 -19.405
464 HB3 ASN 64 3HB ASN 64 3.507 -5.388 -19.043
465 HD21 ASN 64 1HD2 ASN 64 5.737 -3.455 -20.518
466 HD22 ASN 64 2HD2 ASN 64 4.819 -1.995 -20.621
467 H LEU 65 H LEU 65 5.140 -5.582 -15.005
468 HA LEU 65 HA LEU 65 4.957 -8.402 -15.534
469 HB2 LEU 65 2HB LEU 65 5.492 -6.712 -13.133
470 HB3 LEU 65 3HB LEU 65 5.072 -8.411 -12.919
471 HG LEU 65 HG LEU 65 7.365 -7.521 -14.651
472 HD11 LEU 65 1HD1 LEU 65 7.309 -6.949 -12.025
473 HD12 LEU 65 2HD1 LEU 65 8.778 -7.374 -12.903
474 HD13 LEU 65 3HD1 LEU 65 7.924 -8.601 -11.968
475 HD21 LEU 65 3HD2 LEU 65 8.110 -9.881 -13.977
476 HD22 LEU 65 1HD2 LEU 65 6.808 -9.730 -15.157
477 HD23 LEU 65 2HD2 LEU 65 6.435 -10.120 -13.478
478 H TRP 66 H TRP 66 2.962 -9.116 -16.032
479 HA TRP 66 HA TRP 66 0.758 -8.401 -14.213
480 HB2 TRP 66 2HB TRP 66 0.471 -9.501 -17.010
481 HB3 TRP 66 3HB TRP 66 -0.780 -8.776 -16.004
482 HD1 TRP 66 HD1 TRP 66 0.839 -7.895 -18.969
483 HE1 TRP 66 HE1 TRP 66 1.224 -5.363 -19.228
484 HE3 TRP 66 HE3 TRP 66 0.206 -6.476 -14.098
485 HZ2 TRP 66 HZ2 TRP 66 1.255 -3.068 -17.584
486 HZ3 TRP 66 HZ3 TRP 66 0.431 -4.094 -13.525
487 HH2 TRP 66 HH2 TRP 66 0.945 -2.427 -15.234
488 H GLU 67 H GLU 67 -0.204 -9.960 -13.058
489 HA GLU 67 HA GLU 67 -0.449 -12.653 -13.840
490 HB2 GLU 67 2HB GLU 67 1.081 -13.655 -12.124
491 HB3 GLU 67 3HB GLU 67 1.902 -12.878 -13.470
492 HG2 GLU 67 2HG GLU 67 2.165 -10.853 -12.020
493 HG3 GLU 67 3HG GLU 67 1.559 -11.823 -10.678
494 H VAL 68 H VAL 68 -2.286 -13.210 -12.898
495 HA VAL 68 HA VAL 68 -2.819 -12.247 -10.162
496 HB VAL 68 HB VAL 68 -5.210 -12.274 -10.689
497 HG11 VAL 68 1HG1 VAL 68 -3.569 -10.302 -11.200
498 HG12 VAL 68 2HG1 VAL 68 -3.988 -10.656 -12.878
499 HG13 VAL 68 3HG1 VAL 68 -5.251 -10.221 -11.725
500 HG21 VAL 68 3HG2 VAL 68 -5.698 -13.768 -12.328
501 HG22 VAL 68 1HG2 VAL 68 -5.583 -12.322 -13.332
502 HG23 VAL 68 2HG2 VAL 68 -4.218 -13.433 -13.227
503 H GLU 69 H GLU 69 -3.025 -14.911 -12.430
504 HA GLU 69 HA GLU 69 -3.988 -16.677 -10.290
505 HB2 GLU 69 2HB GLU 69 -5.123 -16.563 -12.593
506 HB3 GLU 69 3HB GLU 69 -3.713 -17.425 -13.193
507 HG2 GLU 69 2HG GLU 69 -5.518 -18.963 -12.737
508 HG3 GLU 69 3HG GLU 69 -4.169 -19.255 -11.641
509 H HIS 70 H HIS 70 -2.417 -17.610 -9.166
510 HA HIS 70 HA HIS 70 -0.033 -18.562 -10.616
511 HB2 HIS 70 2HB HIS 70 1.184 -18.302 -8.441
512 HB3 HIS 70 3HB HIS 70 0.632 -16.783 -9.141
513 HD1 HIS 70 HD1 HIS 70 -0.171 -19.188 -6.348
514 HD2 HIS 70 HD2 HIS 70 -1.092 -15.324 -7.567
515 HE1 HIS 70 HE1 HIS 70 -1.424 -18.157 -4.427
516 H HIS 71 H HIS 71 -2.476 -19.252 -8.211
517 HA HIS 71 HA HIS 71 -1.450 -21.674 -7.227
518 HB2 HIS 71 2HB HIS 71 -3.392 -20.298 -6.306
519 HB3 HIS 71 3HB HIS 71 -4.388 -21.062 -7.541
520 HD1 HIS 71 HD1 HIS 71 -3.723 -23.933 -7.404
521 HD2 HIS 71 HD2 HIS 71 -3.895 -21.574 -3.988
522 HE1 HIS 71 HE1 HIS 71 -4.106 -25.532 -5.501
Start of MODEL 2
1 H1 MET 1 H MET 1 2.955 0.688 -0.276
2 HA MET 1 HA MET 1 3.373 0.699 -3.194
3 HB2 MET 1 2HB MET 1 4.981 2.167 -1.097
4 HB3 MET 1 3HB MET 1 5.249 2.221 -2.834
5 HG2 MET 1 2HG MET 1 2.716 3.141 -1.502
6 HG3 MET 1 3HG MET 1 4.071 4.200 -1.884
7 HE1 MET 1 3HE MET 1 0.666 4.087 -4.423
8 HE2 MET 1 1HE MET 1 0.724 2.967 -3.062
9 HE3 MET 1 2HE MET 1 1.094 4.674 -2.816
10 H LYS 2 H LYS 2 3.404 -1.622 -1.466
11 HA LYS 2 HA LYS 2 6.161 -2.329 -1.020
12 HB2 LYS 2 2HB LYS 2 5.312 -4.451 -0.256
13 HB3 LYS 2 3HB LYS 2 4.302 -3.172 0.405
14 HG2 LYS 2 2HG LYS 2 2.600 -4.426 -0.307
15 HG3 LYS 2 3HG LYS 2 2.985 -3.772 -1.901
16 HD2 LYS 2 2HD LYS 2 4.001 -5.706 -2.600
17 HD3 LYS 2 3HD LYS 2 4.455 -6.186 -0.963
18 HE2 LYS 2 2HE LYS 2 1.894 -6.432 -0.606
19 HE3 LYS 2 3HE LYS 2 1.828 -6.480 -2.367
20 HZ1 LYS 2 3HZ LYS 2 2.225 -8.645 -2.135
21 HZ2 LYS 2 1HZ LYS 2 2.697 -8.492 -0.518
22 HZ3 LYS 2 2HZ LYS 2 3.818 -8.222 -1.756
23 H THR 3 H THR 3 7.304 -4.001 -2.089
24 HA THR 3 HA THR 3 6.237 -4.894 -4.664
25 HB THR 3 HB THR 3 7.501 -2.921 -5.259
26 HG1 THR 3 HG1 THR 3 8.913 -3.912 -6.710
27 HG21 THR 3 3HG2 THR 3 9.208 -3.762 -3.139
28 HG22 THR 3 1HG2 THR 3 9.258 -2.260 -4.061
29 HG23 THR 3 2HG2 THR 3 10.164 -3.666 -4.618
30 H PHE 4 H PHE 4 7.307 -6.744 -5.538
31 HA PHE 4 HA PHE 4 8.230 -8.552 -3.513
32 HB2 PHE 4 2HB PHE 4 8.245 -9.045 -6.489
33 HB3 PHE 4 3HB PHE 4 8.152 -10.235 -5.196
34 HD1 PHE 4 HD2 PHE 4 6.066 -9.402 -3.480
35 HD2 PHE 4 HD1 PHE 4 6.312 -9.021 -7.713
36 HE1 PHE 4 HE2 PHE 4 3.610 -9.356 -3.615
37 HE2 PHE 4 HE1 PHE 4 3.856 -8.973 -7.854
38 HZ PHE 4 HZ PHE 4 2.502 -9.142 -5.804
39 H ALA 5 H ALA 5 10.251 -8.745 -2.840
40 HA ALA 5 HA ALA 5 12.425 -7.436 -4.139
41 HB1 ALA 5 1HB ALA 5 12.014 -8.073 -1.605
42 HB2 ALA 5 2HB ALA 5 12.933 -9.505 -2.070
43 HB3 ALA 5 3HB ALA 5 13.640 -7.902 -2.268
44 H LEU 6 H LEU 6 14.323 -8.402 -5.007
45 HA LEU 6 HA LEU 6 14.230 -11.226 -5.693
46 HB2 LEU 6 2HB LEU 6 14.472 -9.110 -7.825
47 HB3 LEU 6 3HB LEU 6 14.506 -10.856 -8.063
48 HG LEU 6 HG LEU 6 12.100 -9.381 -7.010
49 HD11 LEU 6 1HD1 LEU 6 12.677 -8.565 -9.252
50 HD12 LEU 6 2HD1 LEU 6 11.182 -9.499 -9.249
51 HD13 LEU 6 3HD1 LEU 6 12.673 -10.225 -9.847
52 HD21 LEU 6 3HD2 LEU 6 10.942 -11.363 -7.265
53 HD22 LEU 6 1HD2 LEU 6 12.513 -11.927 -6.693
54 HD23 LEU 6 2HD2 LEU 6 12.112 -12.023 -8.408
55 H GLN 7 H GLN 7 16.266 -11.561 -7.317
56 HA GLN 7 HA GLN 7 18.540 -11.304 -5.778
57 HB2 GLN 7 2HB GLN 7 18.037 -12.665 -7.979
58 HB3 GLN 7 3HB GLN 7 18.804 -11.286 -8.755
59 HG2 GLN 7 2HG GLN 7 20.692 -11.698 -7.020
60 HG3 GLN 7 3HG GLN 7 19.973 -13.302 -6.894
61 HE21 GLN 7 1HE2 GLN 7 22.181 -11.425 -8.515
62 HE22 GLN 7 2HE2 GLN 7 22.424 -12.425 -9.903
63 H GLY 8 H GLY 8 19.784 -9.644 -5.229
64 HA2 GLY 8 2HA GLY 8 20.806 -7.588 -5.252
65 HA3 GLY 8 3HA GLY 8 20.677 -7.650 -7.003
66 H ASP 9 H ASP 9 17.796 -7.877 -5.103
67 HA ASP 9 HA ASP 9 17.176 -5.061 -5.708
68 HB2 ASP 9 2HB ASP 9 15.554 -7.531 -6.218
69 HB3 ASP 9 3HB ASP 9 14.739 -6.002 -5.899
70 H THR 10 H THR 10 18.128 -6.475 -3.253
71 HA THR 10 HA THR 10 15.945 -6.573 -1.417
72 HB THR 10 HB THR 10 17.543 -6.966 0.289
73 HG1 THR 10 HG1 THR 10 19.718 -6.424 0.061
74 HG21 THR 10 3HG2 THR 10 18.618 -8.093 -2.299
75 HG22 THR 10 1HG2 THR 10 17.367 -8.810 -1.285
76 HG23 THR 10 2HG2 THR 10 19.021 -8.685 -0.687
77 H LEU 11 H LEU 11 16.317 -5.226 0.736
78 HA LEU 11 HA LEU 11 15.498 -2.643 0.287
79 HB2 LEU 11 2HB LEU 11 17.138 -3.461 2.672
80 HB3 LEU 11 3HB LEU 11 15.908 -2.201 2.587
81 HG LEU 11 HG LEU 11 14.473 -4.430 1.929
82 HD11 LEU 11 1HD1 LEU 11 15.172 -6.302 2.980
83 HD12 LEU 11 2HD1 LEU 11 15.949 -5.412 4.289
84 HD13 LEU 11 3HD1 LEU 11 16.759 -5.574 2.731
85 HD21 LEU 11 3HD2 LEU 11 14.781 -3.751 4.808
86 HD22 LEU 11 1HD2 LEU 11 13.319 -3.989 3.851
87 HD23 LEU 11 2HD2 LEU 11 14.237 -2.490 3.700
88 H ASP 12 H ASP 12 18.797 -3.829 0.740
89 HA ASP 12 HA ASP 12 20.164 -1.432 0.921
90 HB2 ASP 12 2HB ASP 12 21.016 -3.982 -0.468
91 HB3 ASP 12 3HB ASP 12 22.100 -2.657 -0.050
92 H ALA 13 H ALA 13 18.937 -3.085 -1.938
93 HA ALA 13 HA ALA 13 20.076 -1.092 -3.718
94 HB1 ALA 13 1HB ALA 13 19.986 -2.742 -5.195
95 HB2 ALA 13 2HB ALA 13 19.216 -3.773 -3.988
96 HB3 ALA 13 3HB ALA 13 18.227 -2.786 -5.064
97 H ILE 14 H ILE 14 16.806 -2.281 -2.930
98 HA ILE 14 HA ILE 14 15.309 -0.496 -4.392
99 HB ILE 14 HB ILE 14 14.661 -1.561 -1.641
100 HG12 ILE 14 2HG1 ILE 14 13.850 -2.611 -4.359
101 HG13 ILE 14 3HG1 ILE 14 15.167 -3.273 -3.396
102 HG21 ILE 14 1HG2 ILE 14 12.320 -1.157 -2.260
103 HG22 ILE 14 2HG2 ILE 14 13.255 0.336 -2.206
104 HG23 ILE 14 3HG2 ILE 14 12.857 -0.398 -3.759
105 HD11 ILE 14 3HD1 ILE 14 12.280 -3.168 -2.556
106 HD12 ILE 14 1HD1 ILE 14 13.115 -4.583 -3.195
107 HD13 ILE 14 2HD1 ILE 14 13.609 -3.891 -1.650
108 H CYS 15 H CYS 15 16.387 -0.087 -1.019
109 HA CYS 15 HA CYS 15 15.329 2.423 -0.541
110 HB2 CYS 15 2HB CYS 15 17.853 1.123 0.483
111 HB3 CYS 15 3HB CYS 15 17.283 2.679 1.073
112 HG CYS 15 HG CYS 15 14.785 1.573 1.926
113 H VAL 16 H VAL 16 18.076 1.519 -2.461
114 HA VAL 16 HA VAL 16 19.092 4.230 -2.636
115 HB VAL 16 HB VAL 16 19.938 1.717 -4.086
116 HG11 VAL 16 1HG1 VAL 16 20.658 3.400 -5.500
117 HG12 VAL 16 2HG1 VAL 16 20.936 4.535 -4.177
118 HG13 VAL 16 3HG1 VAL 16 22.047 3.189 -4.434
119 HG21 VAL 16 3HG2 VAL 16 20.275 1.850 -1.574
120 HG22 VAL 16 1HG2 VAL 16 21.718 1.557 -2.545
121 HG23 VAL 16 2HG2 VAL 16 21.404 3.166 -1.895
122 H ARG 17 H ARG 17 17.085 2.051 -4.474
123 HA ARG 17 HA ARG 17 17.135 3.721 -6.843
124 HB2 ARG 17 2HB ARG 17 16.126 1.989 -7.932
125 HB3 ARG 17 3HB ARG 17 16.818 1.085 -6.591
126 HG2 ARG 17 2HG ARG 17 14.634 1.340 -5.402
127 HG3 ARG 17 3HG ARG 17 13.979 2.028 -6.889
128 HD2 ARG 17 2HD ARG 17 15.314 -0.365 -7.584
129 HD3 ARG 17 3HD ARG 17 14.317 -0.714 -6.172
130 HE ARG 17 HE ARG 17 12.439 -0.428 -7.461
131 HH11 ARG 17 1HH1 ARG 17 15.220 0.781 -9.172
132 HH12 ARG 17 2HH1 ARG 17 14.368 1.002 -10.664
133 HH21 ARG 17 1HH2 ARG 17 11.307 -0.142 -9.420
134 HH22 ARG 17 2HH2 ARG 17 12.142 0.478 -10.804
135 H TYR 18 H TYR 18 15.474 3.667 -3.919
136 HA TYR 18 HA TYR 18 13.167 5.093 -5.061
137 HB2 TYR 18 2HB TYR 18 13.507 3.285 -2.749
138 HB3 TYR 18 3HB TYR 18 12.467 4.678 -2.471
139 HD1 TYR 18 HD2 TYR 18 10.369 4.929 -3.693
140 HD2 TYR 18 HD1 TYR 18 12.860 1.530 -4.285
141 HE1 TYR 18 HE2 TYR 18 8.509 3.766 -4.804
142 HE2 TYR 18 HE1 TYR 18 11.006 0.358 -5.399
143 HH TYR 18 HH TYR 18 8.325 1.844 -6.558
144 H TYR 19 H TYR 19 15.088 5.155 -2.052
145 HA TYR 19 HA TYR 19 14.635 8.028 -1.848
146 HB2 TYR 19 2HB TYR 19 16.159 6.318 0.110
147 HB3 TYR 19 3HB TYR 19 15.367 7.863 0.400
148 HD1 TYR 19 HD2 TYR 19 12.838 7.952 0.347
149 HD2 TYR 19 HD1 TYR 19 15.002 4.289 0.412
150 HE1 TYR 19 HE2 TYR 19 10.816 6.777 1.106
151 HE2 TYR 19 HE1 TYR 19 12.985 3.104 1.170
152 HH TYR 19 HH TYR 19 10.899 3.388 2.039
153 H GLY 20 H GLY 20 17.238 5.717 -2.341
154 HA2 GLY 20 2HA GLY 20 19.192 6.203 -3.579
155 HA3 GLY 20 3HA GLY 20 18.938 7.913 -3.263
156 H ARG 21 H ARG 21 18.595 5.856 -0.555
157 HA ARG 21 HA ARG 21 21.334 5.799 0.246
158 HB2 ARG 21 2HB ARG 21 21.404 7.466 1.874
159 HB3 ARG 21 3HB ARG 21 20.553 8.245 0.546
160 HG2 ARG 21 2HG ARG 21 19.236 6.989 2.945
161 HG3 ARG 21 3HG ARG 21 19.540 8.714 2.732
162 HD2 ARG 21 2HD ARG 21 17.799 6.971 0.992
163 HD3 ARG 21 3HD ARG 21 17.243 8.175 2.154
164 HE ARG 21 HE ARG 21 18.276 8.658 -0.495
165 HH11 ARG 21 1HH1 ARG 21 17.643 10.010 2.650
166 HH12 ARG 21 2HH1 ARG 21 17.586 11.645 2.080
167 HH21 ARG 21 1HH2 ARG 21 18.203 10.806 -1.258
168 HH22 ARG 21 2HH2 ARG 21 17.903 12.096 -0.144
169 H THR 22 H THR 22 21.632 4.811 2.344
170 HA THR 22 HA THR 22 19.275 3.246 3.166
171 HB THR 22 HB THR 22 21.215 1.771 4.210
172 HG1 THR 22 HG1 THR 22 22.467 3.017 1.968
173 HG21 THR 22 3HG2 THR 22 21.324 0.571 1.931
174 HG22 THR 22 1HG2 THR 22 20.210 1.821 1.381
175 HG23 THR 22 2HG2 THR 22 19.749 0.748 2.703
176 H GLU 23 H GLU 23 21.829 5.347 4.226
177 HA GLU 23 HA GLU 23 21.714 4.837 6.993
178 HB2 GLU 23 2HB GLU 23 23.541 6.092 5.914
179 HB3 GLU 23 3HB GLU 23 22.427 7.409 5.573
180 HG2 GLU 23 2HG GLU 23 23.739 7.981 7.485
181 HG3 GLU 23 3HG GLU 23 22.079 7.692 8.003
182 H GLY 24 H GLY 24 19.950 4.991 8.210
183 HA2 GLY 24 2HA GLY 24 18.331 6.229 9.385
184 HA3 GLY 24 3HA GLY 24 18.408 7.468 8.141
185 H VAL 25 H VAL 25 18.195 5.116 6.149
186 HA VAL 25 HA VAL 25 15.274 5.134 6.098
187 HB VAL 25 HB VAL 25 17.146 4.099 3.970
188 HG11 VAL 25 1HG1 VAL 25 15.338 3.739 2.685
189 HG12 VAL 25 2HG1 VAL 25 14.471 3.710 4.222
190 HG13 VAL 25 3HG1 VAL 25 14.515 5.189 3.261
191 HG21 VAL 25 3HG2 VAL 25 16.520 6.343 2.869
192 HG22 VAL 25 1HG2 VAL 25 16.117 6.862 4.506
193 HG23 VAL 25 2HG2 VAL 25 17.758 6.342 4.124
194 H VAL 26 H VAL 26 17.984 2.852 6.016
195 HA VAL 26 HA VAL 26 16.629 0.470 5.711
196 HB VAL 26 HB VAL 26 18.471 -0.596 6.994
197 HG11 VAL 26 1HG1 VAL 26 19.057 1.406 4.843
198 HG12 VAL 26 2HG1 VAL 26 20.336 0.394 5.516
199 HG13 VAL 26 3HG1 VAL 26 18.944 -0.350 4.728
200 HG21 VAL 26 3HG2 VAL 26 19.213 2.269 7.546
201 HG22 VAL 26 1HG2 VAL 26 18.895 0.985 8.712
202 HG23 VAL 26 2HG2 VAL 26 20.346 0.928 7.711
203 H GLU 27 H GLU 27 17.038 2.419 8.616
204 HA GLU 27 HA GLU 27 16.008 0.529 10.449
205 HB2 GLU 27 2HB GLU 27 17.131 3.060 10.613
206 HB3 GLU 27 3HB GLU 27 15.478 3.306 11.160
207 HG2 GLU 27 2HG GLU 27 16.906 0.983 12.289
208 HG3 GLU 27 3HG GLU 27 17.473 2.579 12.779
209 H THR 28 H THR 28 14.512 2.935 8.385
210 HA THR 28 HA THR 28 11.953 2.950 9.557
211 HB THR 28 HB THR 28 12.304 3.306 6.602
212 HG1 THR 28 HG1 THR 28 13.129 5.392 7.008
213 HG21 THR 28 3HG2 THR 28 10.590 4.915 6.828
214 HG22 THR 28 1HG2 THR 28 10.798 5.009 8.576
215 HG23 THR 28 2HG2 THR 28 10.097 3.563 7.848
216 H VAL 29 H VAL 29 12.929 1.357 6.513
217 HA VAL 29 HA VAL 29 10.630 -0.204 6.238
218 HB VAL 29 HB VAL 29 13.382 -0.972 5.265
219 HG11 VAL 29 1HG1 VAL 29 10.622 -1.598 4.222
220 HG12 VAL 29 2HG1 VAL 29 12.139 -2.065 3.452
221 HG13 VAL 29 3HG1 VAL 29 11.712 -2.722 5.032
222 HG21 VAL 29 3HG2 VAL 29 12.157 0.237 3.151
223 HG22 VAL 29 1HG2 VAL 29 11.622 1.240 4.499
224 HG23 VAL 29 2HG2 VAL 29 13.345 1.006 4.204
225 H LEU 30 H LEU 30 13.713 -0.920 7.822
226 HA LEU 30 HA LEU 30 13.389 -3.604 8.367
227 HB2 LEU 30 2HB LEU 30 15.436 -2.386 8.842
228 HB3 LEU 30 3HB LEU 30 14.621 -1.481 10.116
229 HG LEU 30 HG LEU 30 14.333 -3.612 11.366
230 HD11 LEU 30 1HD1 LEU 30 16.406 -4.941 9.747
231 HD12 LEU 30 2HD1 LEU 30 14.796 -4.863 9.032
232 HD13 LEU 30 3HD1 LEU 30 15.024 -5.619 10.609
233 HD21 LEU 30 3HD2 LEU 30 16.516 -1.966 11.201
234 HD22 LEU 30 1HD2 LEU 30 17.226 -3.566 10.986
235 HD23 LEU 30 2HD2 LEU 30 16.263 -3.215 12.421
236 H ALA 31 H ALA 31 12.014 -0.827 10.037
237 HA ALA 31 HA ALA 31 10.937 -2.295 12.224
238 HB1 ALA 31 1HB ALA 31 10.863 -0.180 12.925
239 HB2 ALA 31 2HB ALA 31 10.907 0.454 11.280
240 HB3 ALA 31 3HB ALA 31 9.372 -0.039 11.994
241 H ALA 32 H ALA 32 9.790 -1.478 9.020
242 HA ALA 32 HA ALA 32 7.063 -2.178 9.478
243 HB1 ALA 32 1HB ALA 32 6.902 -1.066 7.564
244 HB2 ALA 32 2HB ALA 32 8.643 -1.169 7.300
245 HB3 ALA 32 3HB ALA 32 7.590 -2.469 6.745
246 H ASN 33 H ASN 33 9.924 -3.915 8.434
247 HA ASN 33 HA ASN 33 8.314 -6.379 8.279
248 HB2 ASN 33 2HB ASN 33 10.567 -5.371 6.622
249 HB3 ASN 33 3HB ASN 33 10.533 -7.100 6.956
250 HD21 ASN 33 1HD2 ASN 33 8.244 -4.536 6.061
251 HD22 ASN 33 2HD2 ASN 33 7.440 -5.452 4.835
252 HA PRO 34 HA PRO 34 11.244 -6.692 11.891
253 HB2 PRO 34 2HB PRO 34 9.373 -7.576 13.649
254 HB3 PRO 34 3HB PRO 34 9.686 -5.860 13.360
255 HG2 PRO 34 2HG PRO 34 7.518 -7.603 12.253
256 HG3 PRO 34 3HG PRO 34 7.413 -5.946 12.874
257 HD2 PRO 34 2HD PRO 34 7.504 -6.507 10.226
258 HD3 PRO 34 3HD PRO 34 8.204 -5.027 10.913
259 H GLY 35 H GLY 35 12.221 -8.560 12.563
260 HA2 GLY 35 2HA GLY 35 12.422 -10.861 12.978
261 HA3 GLY 35 3HA GLY 35 10.879 -11.118 12.176
262 H LEU 36 H LEU 36 12.157 -9.257 9.999
263 HA LEU 36 HA LEU 36 13.030 -11.441 8.344
264 HB2 LEU 36 2HB LEU 36 11.702 -9.767 7.309
265 HB3 LEU 36 3HB LEU 36 12.760 -8.481 7.887
266 HG LEU 36 HG LEU 36 14.087 -10.426 6.142
267 HD11 LEU 36 1HD1 LEU 36 12.819 -8.818 4.281
268 HD12 LEU 36 2HD1 LEU 36 11.524 -9.325 5.364
269 HD13 LEU 36 3HD1 LEU 36 12.526 -10.534 4.562
270 HD21 LEU 36 3HD2 LEU 36 14.562 -8.073 5.038
271 HD22 LEU 36 1HD2 LEU 36 15.379 -8.583 6.516
272 HD23 LEU 36 2HD2 LEU 36 13.997 -7.491 6.605
273 H ALA 37 H ALA 37 14.538 -9.225 10.436
274 HA ALA 37 HA ALA 37 17.013 -8.807 9.215
275 HB1 ALA 37 1HB ALA 37 15.956 -7.903 11.460
276 HB2 ALA 37 2HB ALA 37 16.916 -9.208 12.159
277 HB3 ALA 37 3HB ALA 37 17.702 -7.944 11.213
278 H GLU 38 H GLU 38 15.663 -11.651 10.604
279 HA GLU 38 HA GLU 38 18.241 -12.957 10.927
280 HB2 GLU 38 2HB GLU 38 16.983 -14.838 11.794
281 HB3 GLU 38 3HB GLU 38 16.432 -13.357 12.563
282 HG2 GLU 38 2HG GLU 38 14.355 -13.711 11.896
283 HG3 GLU 38 3HG GLU 38 14.870 -13.880 10.218
284 H LEU 39 H LEU 39 16.014 -12.437 8.465
285 HA LEU 39 HA LEU 39 15.902 -14.803 7.049
286 HB2 LEU 39 2HB LEU 39 14.762 -12.615 6.526
287 HB3 LEU 39 3HB LEU 39 16.275 -12.097 5.785
288 HG LEU 39 HG LEU 39 16.090 -13.846 4.115
289 HD11 LEU 39 1HD1 LEU 39 13.972 -15.174 3.997
290 HD12 LEU 39 2HD1 LEU 39 13.608 -14.622 5.632
291 HD13 LEU 39 3HD1 LEU 39 15.043 -15.603 5.332
292 HD21 LEU 39 3HD2 LEU 39 13.444 -12.991 3.627
293 HD22 LEU 39 1HD2 LEU 39 14.941 -12.352 2.947
294 HD23 LEU 39 2HD2 LEU 39 14.281 -11.662 4.430
295 H GLY 40 H GLY 40 18.363 -12.238 6.758
296 HA2 GLY 40 2HA GLY 40 20.689 -13.364 6.729
297 HA3 GLY 40 3HA GLY 40 20.061 -14.131 5.278
298 H ALA 41 H ALA 41 21.790 -13.172 4.095
299 HA ALA 41 HA ALA 41 22.104 -10.338 3.950
300 HB1 ALA 41 1HB ALA 41 23.332 -12.694 2.717
301 HB2 ALA 41 2HB ALA 41 23.286 -11.267 1.680
302 HB3 ALA 41 3HB ALA 41 24.063 -11.184 3.261
303 H VAL 42 H VAL 42 21.365 -12.492 1.221
304 HA VAL 42 HA VAL 42 19.757 -10.383 0.022
305 HB VAL 42 HB VAL 42 20.399 -13.094 -1.137
306 HG11 VAL 42 1HG1 VAL 42 19.825 -10.584 -2.666
307 HG12 VAL 42 2HG1 VAL 42 19.679 -12.265 -3.183
308 HG13 VAL 42 3HG1 VAL 42 18.510 -11.585 -2.050
309 HG21 VAL 42 3HG2 VAL 42 21.904 -10.503 -1.497
310 HG22 VAL 42 1HG2 VAL 42 22.462 -11.893 -0.566
311 HG23 VAL 42 2HG2 VAL 42 22.246 -12.030 -2.311
312 H LEU 43 H LEU 43 17.590 -10.425 -0.220
313 HA LEU 43 HA LEU 43 16.093 -12.352 1.303
314 HB2 LEU 43 2HB LEU 43 15.003 -10.211 -0.507
315 HB3 LEU 43 3HB LEU 43 14.184 -11.008 0.836
316 HG LEU 43 HG LEU 43 16.623 -9.561 1.592
317 HD11 LEU 43 1HD1 LEU 43 15.565 -8.171 -0.270
318 HD12 LEU 43 2HD1 LEU 43 15.851 -7.376 1.278
319 HD13 LEU 43 3HD1 LEU 43 14.227 -7.914 0.851
320 HD21 LEU 43 3HD2 LEU 43 13.935 -10.169 2.629
321 HD22 LEU 43 1HD2 LEU 43 14.610 -8.615 3.119
322 HD23 LEU 43 2HD2 LEU 43 15.489 -10.106 3.461
323 HA PRO 44 HA PRO 44 15.003 -15.171 -1.883
324 HB2 PRO 44 2HB PRO 44 12.522 -15.920 -1.076
325 HB3 PRO 44 3HB PRO 44 13.997 -16.434 -0.249
326 HG2 PRO 44 2HG PRO 44 12.095 -14.235 0.463
327 HG3 PRO 44 3HG PRO 44 12.869 -15.430 1.520
328 HD2 PRO 44 2HD PRO 44 13.771 -12.887 1.289
329 HD3 PRO 44 3HD PRO 44 14.854 -14.259 1.598
330 H HIS 45 H HIS 45 14.322 -14.891 -3.909
331 HA HIS 45 HA HIS 45 13.027 -12.657 -4.863
332 HB2 HIS 45 2HB HIS 45 12.542 -14.037 -6.910
333 HB3 HIS 45 3HB HIS 45 14.222 -14.071 -6.383
334 HD1 HIS 45 HD1 HIS 45 11.305 -16.233 -7.001
335 HD2 HIS 45 HD2 HIS 45 15.018 -16.543 -5.162
336 HE1 HIS 45 HE1 HIS 45 11.707 -18.699 -6.708
337 H GLY 46 H GLY 46 11.116 -11.960 -4.111
338 HA2 GLY 46 2HA GLY 46 8.697 -12.327 -4.726
339 HA3 GLY 46 3HA GLY 46 8.900 -13.910 -3.990
340 H THR 47 H THR 47 10.727 -11.724 -2.286
341 HA THR 47 HA THR 47 9.036 -11.865 -0.002
342 HB THR 47 HB THR 47 11.409 -10.033 -0.375
343 HG1 THR 47 HG1 THR 47 11.552 -12.535 -0.680
344 HG21 THR 47 3HG2 THR 47 10.574 -9.378 1.640
345 HG22 THR 47 1HG2 THR 47 11.495 -10.778 2.189
346 HG23 THR 47 2HG2 THR 47 9.756 -10.914 1.925
347 H ALA 48 H ALA 48 7.447 -10.554 0.614
348 HA ALA 48 HA ALA 48 6.890 -8.167 -0.950
349 HB1 ALA 48 1HB ALA 48 5.335 -9.734 1.080
350 HB2 ALA 48 2HB ALA 48 4.804 -8.142 0.539
351 HB3 ALA 48 3HB ALA 48 4.972 -9.458 -0.623
352 H VAL 49 H VAL 49 8.169 -6.502 -0.343
353 HA VAL 49 HA VAL 49 8.316 -5.852 2.526
354 HB VAL 49 HB VAL 49 10.115 -4.821 0.331
355 HG11 VAL 49 1HG1 VAL 49 10.609 -4.819 3.296
356 HG12 VAL 49 2HG1 VAL 49 11.463 -3.920 2.041
357 HG13 VAL 49 3HG1 VAL 49 9.808 -3.483 2.469
358 HG21 VAL 49 3HG2 VAL 49 10.358 -7.246 0.583
359 HG22 VAL 49 1HG2 VAL 49 11.790 -6.390 1.155
360 HG23 VAL 49 2HG2 VAL 49 10.629 -7.039 2.313
361 H GLU 50 H GLU 50 7.552 -3.949 3.270
362 HA GLU 50 HA GLU 50 6.048 -2.297 1.400
363 HB2 GLU 50 2HB GLU 50 4.894 -2.987 3.414
364 HB3 GLU 50 3HB GLU 50 6.172 -2.318 4.419
365 HG2 GLU 50 2HG GLU 50 5.575 -0.105 3.887
366 HG3 GLU 50 3HG GLU 50 4.542 -0.623 2.555
367 H LEU 51 H LEU 51 6.419 -0.146 1.019
368 HA LEU 51 HA LEU 51 9.008 0.882 1.963
369 HB2 LEU 51 2HB LEU 51 7.436 1.855 -0.409
370 HB3 LEU 51 3HB LEU 51 9.114 2.211 -0.008
371 HG LEU 51 HG LEU 51 8.103 -0.520 -0.793
372 HD11 LEU 51 1HD1 LEU 51 8.395 1.721 -2.433
373 HD12 LEU 51 2HD1 LEU 51 8.246 0.037 -2.935
374 HD13 LEU 51 3HD1 LEU 51 9.843 0.749 -2.701
375 HD21 LEU 51 3HD2 LEU 51 10.938 0.347 -0.991
376 HD22 LEU 51 1HD2 LEU 51 10.260 -1.251 -0.680
377 HD23 LEU 51 2HD2 LEU 51 10.297 -0.043 0.605
378 HA PRO 52 HA PRO 52 6.107 3.551 4.252
379 HB2 PRO 52 2HB PRO 52 7.882 4.134 6.222
380 HB3 PRO 52 3HB PRO 52 6.912 2.657 6.210
381 HG2 PRO 52 2HG PRO 52 9.759 3.059 5.376
382 HG3 PRO 52 3HG PRO 52 9.045 1.739 6.321
383 HD2 PRO 52 2HD PRO 52 9.611 1.502 3.684
384 HD3 PRO 52 3HD PRO 52 8.247 0.661 4.447
385 H ASP 53 H ASP 53 6.189 5.821 4.777
386 HA ASP 53 HA ASP 53 6.635 7.997 4.286
387 HB2 ASP 53 2HB ASP 53 9.454 6.909 4.239
388 HB3 ASP 53 3HB ASP 53 9.069 8.625 4.136
389 H VAL 54 H VAL 54 6.134 6.020 2.115
390 HA VAL 54 HA VAL 54 7.418 7.451 -0.118
391 HB VAL 54 HB VAL 54 6.238 4.670 -0.075
392 HG11 VAL 54 1HG1 VAL 54 5.831 5.322 -2.241
393 HG12 VAL 54 2HG1 VAL 54 7.215 6.416 -2.287
394 HG13 VAL 54 3HG1 VAL 54 7.464 4.673 -2.387
395 HG21 VAL 54 3HG2 VAL 54 8.708 4.169 -0.716
396 HG22 VAL 54 1HG2 VAL 54 9.028 5.739 0.021
397 HG23 VAL 54 2HG2 VAL 54 8.289 4.452 0.973
398 H GLN 55 H GLN 55 6.175 8.241 -1.791
399 HA GLN 55 HA GLN 55 3.288 8.366 -1.251
400 HB2 GLN 55 2HB GLN 55 4.876 10.211 -3.032
401 HB3 GLN 55 3HB GLN 55 3.240 10.446 -2.432
402 HG2 GLN 55 2HG GLN 55 4.171 10.563 -0.129
403 HG3 GLN 55 3HG GLN 55 5.787 10.505 -0.833
404 HE21 GLN 55 1HE2 GLN 55 2.818 12.365 -0.657
405 HE22 GLN 55 2HE2 GLN 55 3.524 13.886 -1.072
406 H THR 56 H THR 56 2.285 9.139 -3.630
407 HA THR 56 HA THR 56 1.897 6.797 -5.033
408 HB THR 56 HB THR 56 0.348 8.569 -5.371
409 HG1 THR 56 HG1 THR 56 1.762 8.432 -7.832
410 HG21 THR 56 3HG2 THR 56 1.093 10.672 -5.307
411 HG22 THR 56 1HG2 THR 56 1.595 10.469 -6.985
412 HG23 THR 56 2HG2 THR 56 2.741 10.165 -5.679
413 H ALA 57 H ALA 57 2.572 6.105 -7.137
414 HA ALA 57 HA ALA 57 5.201 7.141 -7.969
415 HB1 ALA 57 1HB ALA 57 4.662 4.595 -6.879
416 HB2 ALA 57 2HB ALA 57 5.004 4.364 -8.594
417 HB3 ALA 57 3HB ALA 57 6.174 5.190 -7.565
418 HA PRO 58 HA PRO 58 3.687 7.288 -12.084
419 HB2 PRO 58 2HB PRO 58 5.846 6.504 -13.530
420 HB3 PRO 58 3HB PRO 58 5.753 8.070 -12.715
421 HG2 PRO 58 2HG PRO 58 7.118 5.555 -11.835
422 HG3 PRO 58 3HG PRO 58 7.698 7.229 -11.756
423 HD2 PRO 58 2HD PRO 58 6.664 5.943 -9.610
424 HD3 PRO 58 3HD PRO 58 6.484 7.692 -9.852
425 H VAL 59 H VAL 59 3.968 5.883 -14.275
426 HA VAL 59 HA VAL 59 2.396 3.633 -13.999
427 HB VAL 59 HB VAL 59 4.422 4.083 -16.194
428 HG11 VAL 59 1HG1 VAL 59 2.099 2.909 -17.202
429 HG12 VAL 59 2HG1 VAL 59 3.671 2.141 -16.977
430 HG13 VAL 59 3HG1 VAL 59 2.449 2.039 -15.709
431 HG21 VAL 59 3HG2 VAL 59 1.786 5.325 -15.614
432 HG22 VAL 59 1HG2 VAL 59 3.227 6.020 -16.357
433 HG23 VAL 59 2HG2 VAL 59 2.176 4.957 -17.294
434 H ALA 60 H ALA 60 2.730 1.629 -13.300
435 HA ALA 60 HA ALA 60 5.450 0.523 -13.372
436 HB1 ALA 60 1HB ALA 60 5.333 -0.271 -11.139
437 HB2 ALA 60 2HB ALA 60 4.894 1.437 -11.096
438 HB3 ALA 60 3HB ALA 60 3.640 0.201 -10.988
439 H GLU 61 H GLU 61 5.013 -1.917 -12.269
440 HA GLU 61 HA GLU 61 3.926 -3.406 -14.343
441 HB2 GLU 61 2HB GLU 61 5.422 -4.057 -12.251
442 HB3 GLU 61 3HB GLU 61 3.869 -4.538 -11.584
443 HG2 GLU 61 2HG GLU 61 3.539 -6.173 -13.214
444 HG3 GLU 61 3HG GLU 61 4.766 -5.488 -14.278
445 H THR 62 H THR 62 2.111 -5.078 -13.974
446 HA THR 62 HA THR 62 -0.115 -4.198 -12.374
447 HB THR 62 HB THR 62 -0.531 -2.676 -14.146
448 HG1 THR 62 HG1 THR 62 -2.532 -3.380 -14.761
449 HG21 THR 62 3HG2 THR 62 -0.688 -3.439 -16.518
450 HG22 THR 62 1HG2 THR 62 -0.029 -4.995 -16.012
451 HG23 THR 62 2HG2 THR 62 0.940 -3.530 -15.846
452 H VAL 63 H VAL 63 -1.445 -5.860 -11.897
453 HA VAL 63 HA VAL 63 -1.044 -8.373 -13.387
454 HB VAL 63 HB VAL 63 -0.236 -8.411 -11.028
455 HG11 VAL 63 1HG1 VAL 63 -2.220 -6.891 -10.312
456 HG12 VAL 63 2HG1 VAL 63 -3.088 -8.417 -10.134
457 HG13 VAL 63 3HG1 VAL 63 -1.621 -8.122 -9.201
458 HG21 VAL 63 3HG2 VAL 63 -0.826 -10.590 -10.775
459 HG22 VAL 63 1HG2 VAL 63 -2.538 -10.272 -11.053
460 HG23 VAL 63 2HG2 VAL 63 -1.424 -10.356 -12.418
461 H ASN 64 H ASN 64 -3.330 -6.083 -12.152
462 HA ASN 64 HA ASN 64 -5.641 -7.750 -12.483
463 HB2 ASN 64 2HB ASN 64 -6.867 -5.535 -12.221
464 HB3 ASN 64 3HB ASN 64 -5.846 -6.020 -10.871
465 HD21 ASN 64 1HD2 ASN 64 -5.441 -4.018 -10.077
466 HD22 ASN 64 2HD2 ASN 64 -4.537 -2.813 -10.923
467 H LEU 65 H LEU 65 -4.756 -8.306 -14.748
468 HA LEU 65 HA LEU 65 -6.400 -6.897 -16.652
469 HB2 LEU 65 2HB LEU 65 -3.456 -6.628 -16.598
470 HB3 LEU 65 3HB LEU 65 -4.193 -6.905 -18.175
471 HG LEU 65 HG LEU 65 -4.839 -4.623 -16.309
472 HD11 LEU 65 1HD1 LEU 65 -3.645 -4.168 -18.968
473 HD12 LEU 65 2HD1 LEU 65 -2.581 -4.852 -17.739
474 HD13 LEU 65 3HD1 LEU 65 -3.394 -3.315 -17.445
475 HD21 LEU 65 3HD2 LEU 65 -5.918 -5.472 -18.973
476 HD22 LEU 65 1HD2 LEU 65 -5.950 -3.782 -18.470
477 HD23 LEU 65 2HD2 LEU 65 -6.794 -5.002 -17.516
478 H TRP 66 H TRP 66 -6.813 -8.093 -18.529
479 HA TRP 66 HA TRP 66 -6.903 -10.842 -18.295
480 HB2 TRP 66 2HB TRP 66 -6.808 -9.276 -20.882
481 HB3 TRP 66 3HB TRP 66 -7.456 -10.900 -20.670
482 HD1 TRP 66 HD1 TRP 66 -8.720 -7.615 -21.163
483 HE1 TRP 66 HE1 TRP 66 -11.051 -7.279 -20.125
484 HE3 TRP 66 HE3 TRP 66 -8.815 -11.671 -18.053
485 HZ2 TRP 66 HZ2 TRP 66 -12.710 -8.564 -18.236
486 HZ3 TRP 66 HZ3 TRP 66 -10.811 -12.046 -16.664
487 HH2 TRP 66 HH2 TRP 66 -12.717 -10.523 -16.755
488 H GLU 67 H GLU 67 -5.123 -12.021 -17.887
489 HA GLU 67 HA GLU 67 -2.942 -11.885 -19.861
490 HB2 GLU 67 2HB GLU 67 -2.215 -10.859 -17.749
491 HB3 GLU 67 3HB GLU 67 -2.647 -12.327 -16.884
492 HG2 GLU 67 2HG GLU 67 -0.413 -12.657 -17.122
493 HG3 GLU 67 3HG GLU 67 -0.988 -13.430 -18.598
494 H VAL 68 H VAL 68 -3.428 -13.663 -21.042
495 HA VAL 68 HA VAL 68 -4.012 -16.178 -19.663
496 HB VAL 68 HB VAL 68 -4.520 -17.056 -21.927
497 HG11 VAL 68 1HG1 VAL 68 -6.002 -14.501 -21.328
498 HG12 VAL 68 2HG1 VAL 68 -6.615 -15.919 -22.182
499 HG13 VAL 68 3HG1 VAL 68 -6.243 -16.017 -20.460
500 HG21 VAL 68 3HG2 VAL 68 -3.986 -15.976 -23.803
501 HG22 VAL 68 1HG2 VAL 68 -4.703 -14.472 -23.225
502 HG23 VAL 68 2HG2 VAL 68 -3.041 -14.878 -22.797
503 H GLU 69 H GLU 69 -1.416 -15.323 -19.301
504 HA GLU 69 HA GLU 69 0.061 -17.357 -20.819
505 HB2 GLU 69 2HB GLU 69 0.669 -14.457 -20.570
506 HB3 GLU 69 3HB GLU 69 2.025 -15.573 -20.493
507 HG2 GLU 69 2HG GLU 69 0.022 -15.704 -22.714
508 HG3 GLU 69 3HG GLU 69 1.388 -14.592 -22.765
509 H HIS 70 H HIS 70 -0.098 -18.718 -19.007
510 HA HIS 70 HA HIS 70 0.627 -19.678 -17.076
511 HB2 HIS 70 2HB HIS 70 2.851 -18.786 -18.153
512 HB3 HIS 70 3HB HIS 70 2.806 -17.639 -16.817
513 HD1 HIS 70 HD1 HIS 70 1.933 -21.332 -16.723
514 HD2 HIS 70 HD2 HIS 70 4.697 -18.659 -15.151
515 HE1 HIS 70 HE1 HIS 70 3.282 -22.657 -15.064
516 H HIS 71 H HIS 71 -1.224 -17.362 -17.058
517 HA HIS 71 HA HIS 71 -2.267 -15.968 -15.587
518 HB2 HIS 71 2HB HIS 71 -1.109 -18.064 -13.759
519 HB3 HIS 71 3HB HIS 71 -2.119 -16.757 -13.148
520 HD1 HIS 71 HD1 HIS 71 -4.412 -16.629 -15.008
521 HD2 HIS 71 HD2 HIS 71 -2.679 -20.247 -13.927
522 HE1 HIS 71 HE1 HIS 71 -6.179 -18.371 -15.420
Start of MODEL 3
1 H1 MET 1 H MET 1 5.706 0.377 -7.291
2 HA MET 1 HA MET 1 7.842 1.249 -9.119
3 HB2 MET 1 2HB MET 1 7.153 3.121 -7.669
4 HB3 MET 1 3HB MET 1 7.477 2.135 -6.250
5 HG2 MET 1 2HG MET 1 9.300 3.653 -6.616
6 HG3 MET 1 3HG MET 1 9.839 2.001 -6.906
7 HE1 MET 1 3HE MET 1 10.223 5.216 -7.606
8 HE2 MET 1 1HE MET 1 11.648 4.704 -8.511
9 HE3 MET 1 2HE MET 1 10.339 5.554 -9.334
10 H LYS 2 H LYS 2 8.592 -0.859 -9.369
11 HA LYS 2 HA LYS 2 9.888 -1.986 -6.977
12 HB2 LYS 2 2HB LYS 2 9.492 -4.251 -8.011
13 HB3 LYS 2 3HB LYS 2 8.050 -3.435 -7.421
14 HG2 LYS 2 2HG LYS 2 8.385 -2.690 -10.124
15 HG3 LYS 2 3HG LYS 2 8.599 -4.439 -10.024
16 HD2 LYS 2 2HD LYS 2 6.349 -3.373 -8.461
17 HD3 LYS 2 3HD LYS 2 6.195 -3.186 -10.210
18 HE2 LYS 2 2HE LYS 2 6.917 -5.688 -10.261
19 HE3 LYS 2 3HE LYS 2 6.400 -5.682 -8.576
20 HZ1 LYS 2 3HZ LYS 2 4.783 -5.224 -11.001
21 HZ2 LYS 2 1HZ LYS 2 4.260 -4.661 -9.493
22 HZ3 LYS 2 2HZ LYS 2 4.513 -6.315 -9.737
23 H THR 3 H THR 3 11.867 -3.070 -7.320
24 HA THR 3 HA THR 3 13.054 -2.912 -9.983
25 HB THR 3 HB THR 3 13.611 -0.771 -8.811
26 HG1 THR 3 HG1 THR 3 15.531 -0.828 -9.757
27 HG21 THR 3 3HG2 THR 3 13.920 -2.278 -6.584
28 HG22 THR 3 1HG2 THR 3 14.629 -0.677 -6.794
29 HG23 THR 3 2HG2 THR 3 15.598 -2.118 -7.101
30 H PHE 4 H PHE 4 14.909 -4.238 -10.257
31 HA PHE 4 HA PHE 4 14.850 -6.611 -8.652
32 HB2 PHE 4 2HB PHE 4 16.879 -5.939 -10.782
33 HB3 PHE 4 3HB PHE 4 16.375 -7.535 -10.235
34 HD1 PHE 4 HD1 PHE 4 13.847 -8.091 -10.576
35 HD2 PHE 4 HD2 PHE 4 15.955 -5.062 -12.698
36 HE1 PHE 4 HE1 PHE 4 12.157 -8.171 -12.362
37 HE2 PHE 4 HE2 PHE 4 14.267 -5.137 -14.487
38 HZ PHE 4 HZ PHE 4 12.365 -6.692 -14.320
39 H ALA 5 H ALA 5 16.121 -7.159 -6.997
40 HA ALA 5 HA ALA 5 17.996 -5.244 -5.957
41 HB1 ALA 5 1HB ALA 5 16.413 -6.756 -4.622
42 HB2 ALA 5 2HB ALA 5 17.615 -8.020 -4.888
43 HB3 ALA 5 3HB ALA 5 18.059 -6.549 -4.023
44 H LEU 6 H LEU 6 20.217 -5.571 -5.592
45 HA LEU 6 HA LEU 6 21.512 -7.856 -6.842
46 HB2 LEU 6 2HB LEU 6 22.231 -5.042 -7.638
47 HB3 LEU 6 3HB LEU 6 22.955 -6.532 -8.239
48 HG LEU 6 HG LEU 6 20.068 -5.810 -8.697
49 HD11 LEU 6 1HD1 LEU 6 22.475 -5.238 -10.415
50 HD12 LEU 6 2HD1 LEU 6 21.362 -4.067 -9.708
51 HD13 LEU 6 3HD1 LEU 6 20.805 -5.157 -10.977
52 HD21 LEU 6 3HD2 LEU 6 19.941 -7.834 -9.592
53 HD22 LEU 6 1HD2 LEU 6 21.620 -8.141 -9.145
54 HD23 LEU 6 2HD2 LEU 6 21.241 -7.430 -10.714
55 H GLN 7 H GLN 7 24.075 -7.294 -6.706
56 HA GLN 7 HA GLN 7 24.769 -7.485 -4.041
57 HB2 GLN 7 2HB GLN 7 27.065 -7.084 -4.736
58 HB3 GLN 7 3HB GLN 7 26.251 -8.117 -5.904
59 HG2 GLN 7 2HG GLN 7 25.833 -6.022 -7.259
60 HG3 GLN 7 3HG GLN 7 26.965 -5.215 -6.174
61 HE21 GLN 7 1HE2 GLN 7 29.118 -6.237 -5.978
62 HE22 GLN 7 2HE2 GLN 7 29.815 -6.933 -7.397
63 H GLY 8 H GLY 8 24.865 -6.090 -2.409
64 HA2 GLY 8 2HA GLY 8 24.939 -4.120 -1.233
65 HA3 GLY 8 3HA GLY 8 25.850 -3.461 -2.584
66 H ASP 9 H ASP 9 22.688 -4.742 -3.158
67 HA ASP 9 HA ASP 9 21.602 -2.006 -3.274
68 HB2 ASP 9 2HB ASP 9 21.524 -4.186 -5.328
69 HB3 ASP 9 3HB ASP 9 20.194 -3.035 -5.235
70 H THR 10 H THR 10 21.416 -4.180 -1.247
71 HA THR 10 HA THR 10 18.785 -5.275 -1.378
72 HB THR 10 HB THR 10 19.173 -6.198 0.740
73 HG1 THR 10 HG1 THR 10 20.881 -5.306 2.112
74 HG21 THR 10 3HG2 THR 10 20.808 -6.898 -1.064
75 HG22 THR 10 1HG2 THR 10 21.312 -7.216 0.595
76 HG23 THR 10 2HG2 THR 10 21.984 -5.842 -0.284
77 H LEU 11 H LEU 11 17.380 -4.891 0.741
78 HA LEU 11 HA LEU 11 16.105 -2.470 0.492
79 HB2 LEU 11 2HB LEU 11 16.302 -4.114 3.011
80 HB3 LEU 11 3HB LEU 11 15.054 -2.927 2.635
81 HG LEU 11 HG LEU 11 15.492 -5.585 1.278
82 HD11 LEU 11 1HD1 LEU 11 13.257 -6.081 2.179
83 HD12 LEU 11 2HD1 LEU 11 13.271 -4.535 3.026
84 HD13 LEU 11 3HD1 LEU 11 14.443 -5.782 3.450
85 HD21 LEU 11 3HD2 LEU 11 13.672 -3.286 0.626
86 HD22 LEU 11 1HD2 LEU 11 13.305 -4.941 0.138
87 HD23 LEU 11 2HD2 LEU 11 14.776 -4.158 -0.440
88 H ASP 12 H ASP 12 18.776 -3.317 2.634
89 HA ASP 12 HA ASP 12 18.848 -1.084 4.264
90 HB2 ASP 12 2HB ASP 12 20.339 -2.808 4.821
91 HB3 ASP 12 3HB ASP 12 21.011 -2.877 3.194
92 H ALA 13 H ALA 13 20.113 -1.495 0.994
93 HA ALA 13 HA ALA 13 21.168 1.211 0.951
94 HB1 ALA 13 1HB ALA 13 21.388 0.313 -1.611
95 HB2 ALA 13 2HB ALA 13 22.605 0.090 -0.354
96 HB3 ALA 13 3HB ALA 13 21.445 -1.194 -0.696
97 H ILE 14 H ILE 14 18.732 -0.656 -0.863
98 HA ILE 14 HA ILE 14 17.742 1.332 -2.487
99 HB ILE 14 HB ILE 14 16.159 -0.857 -1.136
100 HG12 ILE 14 2HG1 ILE 14 17.403 -0.783 -3.892
101 HG13 ILE 14 3HG1 ILE 14 18.120 -1.594 -2.504
102 HG21 ILE 14 1HG2 ILE 14 14.684 0.862 -1.989
103 HG22 ILE 14 2HG2 ILE 14 15.504 0.828 -3.549
104 HG23 ILE 14 3HG2 ILE 14 14.582 -0.574 -3.007
105 HD11 ILE 14 3HD1 ILE 14 16.391 -2.693 -4.351
106 HD12 ILE 14 1HD1 ILE 14 16.848 -3.384 -2.794
107 HD13 ILE 14 2HD1 ILE 14 15.381 -2.414 -2.932
108 H CYS 15 H CYS 15 16.593 0.486 0.778
109 HA CYS 15 HA CYS 15 14.602 2.403 1.013
110 HB2 CYS 15 2HB CYS 15 16.396 1.144 3.087
111 HB3 CYS 15 3HB CYS 15 15.081 2.234 3.511
112 HG CYS 15 HG CYS 15 13.645 0.110 3.923
113 H VAL 16 H VAL 16 18.053 2.740 1.201
114 HA VAL 16 HA VAL 16 17.920 5.400 2.354
115 HB VAL 16 HB VAL 16 20.271 3.813 1.315
116 HG11 VAL 16 1HG1 VAL 16 20.075 6.545 2.533
117 HG12 VAL 16 2HG1 VAL 16 21.542 5.578 2.692
118 HG13 VAL 16 3HG1 VAL 16 20.951 6.030 1.093
119 HG21 VAL 16 3HG2 VAL 16 19.546 4.481 4.162
120 HG22 VAL 16 1HG2 VAL 16 19.111 2.965 3.372
121 HG23 VAL 16 2HG2 VAL 16 20.808 3.387 3.598
122 H ARG 17 H ARG 17 18.290 3.895 -0.773
123 HA ARG 17 HA ARG 17 19.039 6.373 -2.074
124 HB2 ARG 17 2HB ARG 17 19.507 5.115 -3.930
125 HB3 ARG 17 3HB ARG 17 19.669 3.876 -2.693
126 HG2 ARG 17 2HG ARG 17 17.343 3.175 -3.144
127 HG3 ARG 17 3HG ARG 17 17.276 4.357 -4.453
128 HD2 ARG 17 2HD ARG 17 19.321 2.151 -4.294
129 HD3 ARG 17 3HD ARG 17 17.792 2.004 -5.160
130 HE ARG 17 HE ARG 17 19.343 4.292 -5.942
131 HH11 ARG 17 1HH1 ARG 17 18.799 0.892 -6.455
132 HH12 ARG 17 2HH1 ARG 17 19.435 0.901 -8.067
133 HH21 ARG 17 1HH2 ARG 17 20.183 4.317 -8.062
134 HH22 ARG 17 2HH2 ARG 17 20.223 2.849 -8.980
135 H TYR 18 H TYR 18 16.183 4.922 -1.065
136 HA TYR 18 HA TYR 18 14.595 6.333 -3.100
137 HB2 TYR 18 2HB TYR 18 14.218 3.820 -1.606
138 HB3 TYR 18 3HB TYR 18 12.778 4.821 -1.747
139 HD1 TYR 18 HD2 TYR 18 15.359 3.002 -3.663
140 HD2 TYR 18 HD1 TYR 18 11.620 5.027 -3.816
141 HE1 TYR 18 HE2 TYR 18 14.995 2.146 -5.940
142 HE2 TYR 18 HE1 TYR 18 11.245 4.175 -6.093
143 HH TYR 18 HH TYR 18 13.666 2.807 -7.965
144 H TYR 19 H TYR 19 14.322 5.481 0.356
145 HA TYR 19 HA TYR 19 12.835 7.952 0.814
146 HB2 TYR 19 2HB TYR 19 13.419 5.899 2.926
147 HB3 TYR 19 3HB TYR 19 12.052 7.000 2.802
148 HD1 TYR 19 HD2 TYR 19 10.221 6.525 1.208
149 HD2 TYR 19 HD1 TYR 19 13.398 3.767 1.840
150 HE1 TYR 19 HE2 TYR 19 8.881 4.750 0.159
151 HE2 TYR 19 HE1 TYR 19 12.067 1.984 0.791
152 HH TYR 19 HH TYR 19 9.825 1.429 0.262
153 H GLY 20 H GLY 20 15.847 6.367 1.697
154 HA2 GLY 20 2HA GLY 20 17.831 7.538 2.220
155 HA3 GLY 20 3HA GLY 20 16.863 8.944 2.639
156 H ARG 21 H ARG 21 15.998 5.809 3.855
157 HA ARG 21 HA ARG 21 17.466 5.985 6.295
158 HB2 ARG 21 2HB ARG 21 15.638 6.442 7.812
159 HB3 ARG 21 3HB ARG 21 15.784 7.767 6.665
160 HG2 ARG 21 2HG ARG 21 13.911 5.613 5.927
161 HG3 ARG 21 3HG ARG 21 13.457 6.612 7.310
162 HD2 ARG 21 2HD ARG 21 14.208 8.541 5.622
163 HD3 ARG 21 3HD ARG 21 13.716 7.323 4.446
164 HE ARG 21 HE ARG 21 11.749 7.666 6.470
165 HH11 ARG 21 1HH1 ARG 21 13.035 9.103 3.572
166 HH12 ARG 21 2HH1 ARG 21 11.556 9.903 3.156
167 HH21 ARG 21 1HH2 ARG 21 9.796 8.715 5.933
168 HH22 ARG 21 2HH2 ARG 21 9.714 9.682 4.500
169 H THR 22 H THR 22 16.866 4.255 7.818
170 HA THR 22 HA THR 22 15.562 2.007 6.424
171 HB THR 22 HB THR 22 17.081 0.678 8.162
172 HG1 THR 22 HG1 THR 22 19.156 1.797 8.218
173 HG21 THR 22 3HG2 THR 22 18.918 1.171 6.138
174 HG22 THR 22 1HG2 THR 22 17.354 1.487 5.389
175 HG23 THR 22 2HG2 THR 22 17.671 -0.076 6.142
176 H GLU 23 H GLU 23 15.873 3.822 9.377
177 HA GLU 23 HA GLU 23 14.439 2.017 11.048
178 HB2 GLU 23 2HB GLU 23 15.992 3.838 11.837
179 HB3 GLU 23 3HB GLU 23 14.740 4.998 11.419
180 HG2 GLU 23 2HG GLU 23 14.331 4.719 13.643
181 HG3 GLU 23 3HG GLU 23 13.256 3.499 12.963
182 H GLY 24 H GLY 24 12.382 1.485 10.726
183 HA2 GLY 24 2HA GLY 24 10.074 2.006 10.853
184 HA3 GLY 24 3HA GLY 24 10.436 3.632 10.293
185 H VAL 25 H VAL 25 12.216 2.236 8.190
186 HA VAL 25 HA VAL 25 10.045 1.895 6.252
187 HB VAL 25 HB VAL 25 12.995 2.171 5.678
188 HG11 VAL 25 1HG1 VAL 25 10.971 3.041 3.731
189 HG12 VAL 25 2HG1 VAL 25 12.477 2.155 3.487
190 HG13 VAL 25 3HG1 VAL 25 11.030 1.305 4.030
191 HG21 VAL 25 3HG2 VAL 25 12.082 4.550 4.966
192 HG22 VAL 25 1HG2 VAL 25 10.905 4.209 6.233
193 HG23 VAL 25 2HG2 VAL 25 12.627 4.224 6.611
194 H VAL 26 H VAL 26 12.957 0.285 7.454
195 HA VAL 26 HA VAL 26 13.014 -1.908 5.752
196 HB VAL 26 HB VAL 26 14.169 -3.117 7.584
197 HG11 VAL 26 1HG1 VAL 26 14.953 -0.324 6.849
198 HG12 VAL 26 2HG1 VAL 26 15.966 -1.287 7.926
199 HG13 VAL 26 3HG1 VAL 26 15.625 -1.856 6.291
200 HG21 VAL 26 3HG2 VAL 26 13.066 -2.453 9.542
201 HG22 VAL 26 1HG2 VAL 26 14.653 -1.691 9.653
202 HG23 VAL 26 2HG2 VAL 26 13.250 -0.738 9.170
203 H GLU 27 H GLU 27 10.856 -1.177 8.363
204 HA GLU 27 HA GLU 27 9.882 -3.871 8.664
205 HB2 GLU 27 2HB GLU 27 8.864 -1.221 9.697
206 HB3 GLU 27 3HB GLU 27 8.123 -2.769 10.079
207 HG2 GLU 27 2HG GLU 27 9.976 -3.480 11.317
208 HG3 GLU 27 3HG GLU 27 11.016 -2.227 10.642
209 H THR 28 H THR 28 9.005 -1.016 6.853
210 HA THR 28 HA THR 28 6.386 -1.812 6.129
211 HB THR 28 HB THR 28 8.123 -0.069 4.398
212 HG1 THR 28 HG1 THR 28 7.439 1.666 5.805
213 HG21 THR 28 3HG2 THR 28 5.700 1.116 4.564
214 HG22 THR 28 1HG2 THR 28 5.240 -0.573 4.773
215 HG23 THR 28 2HG2 THR 28 6.127 -0.072 3.333
216 H VAL 29 H VAL 29 9.340 -1.739 4.121
217 HA VAL 29 HA VAL 29 8.339 -3.166 1.963
218 HB VAL 29 HB VAL 29 11.191 -3.275 2.949
219 HG11 VAL 29 1HG1 VAL 29 11.103 -4.812 1.239
220 HG12 VAL 29 2HG1 VAL 29 9.833 -3.941 0.377
221 HG13 VAL 29 3HG1 VAL 29 11.491 -3.338 0.352
222 HG21 VAL 29 3HG2 VAL 29 9.643 -1.039 2.064
223 HG22 VAL 29 1HG2 VAL 29 11.333 -1.093 2.564
224 HG23 VAL 29 2HG2 VAL 29 10.903 -1.385 0.879
225 H LEU 30 H LEU 30 9.397 -4.291 5.069
226 HA LEU 30 HA LEU 30 9.840 -7.007 4.371
227 HB2 LEU 30 2HB LEU 30 9.507 -5.461 6.876
228 HB3 LEU 30 3HB LEU 30 9.227 -7.199 6.962
229 HG LEU 30 HG LEU 30 11.774 -5.951 5.939
230 HD11 LEU 30 1HD1 LEU 30 12.104 -7.303 8.419
231 HD12 LEU 30 2HD1 LEU 30 10.829 -6.098 8.600
232 HD13 LEU 30 3HD1 LEU 30 12.426 -5.614 8.027
233 HD21 LEU 30 3HD2 LEU 30 12.669 -8.214 6.279
234 HD22 LEU 30 1HD2 LEU 30 11.360 -8.189 5.097
235 HD23 LEU 30 2HD2 LEU 30 11.059 -8.772 6.735
236 H ALA 31 H ALA 31 7.007 -5.145 5.170
237 HA ALA 31 HA ALA 31 5.333 -7.471 5.559
238 HB1 ALA 31 1HB ALA 31 5.171 -4.780 6.279
239 HB2 ALA 31 2HB ALA 31 3.864 -5.033 5.123
240 HB3 ALA 31 3HB ALA 31 3.969 -6.038 6.568
241 H ALA 32 H ALA 32 6.159 -5.266 2.986
242 HA ALA 32 HA ALA 32 4.013 -6.179 1.265
243 HB1 ALA 32 1HB ALA 32 5.650 -3.896 1.376
244 HB2 ALA 32 2HB ALA 32 6.021 -4.707 -0.147
245 HB3 ALA 32 3HB ALA 32 4.359 -4.250 0.227
246 H ASN 33 H ASN 33 7.359 -6.890 1.855
247 HA ASN 33 HA ASN 33 7.282 -8.866 -0.327
248 HB2 ASN 33 2HB ASN 33 9.337 -6.829 0.324
249 HB3 ASN 33 3HB ASN 33 9.935 -8.427 -0.111
250 HD21 ASN 33 1HD2 ASN 33 7.356 -6.246 -1.211
251 HD22 ASN 33 2HD2 ASN 33 7.737 -6.371 -2.892
252 HA PRO 34 HA PRO 34 8.019 -10.967 3.745
253 HB2 PRO 34 2HB PRO 34 6.268 -12.989 3.280
254 HB3 PRO 34 3HB PRO 34 5.783 -11.441 3.983
255 HG2 PRO 34 2HG PRO 34 5.550 -12.393 1.154
256 HG3 PRO 34 3HG PRO 34 4.369 -11.510 2.138
257 HD2 PRO 34 2HD PRO 34 5.925 -10.291 0.287
258 HD3 PRO 34 3HD PRO 34 5.397 -9.479 1.775
259 H GLY 35 H GLY 35 9.087 -12.950 4.131
260 HA2 GLY 35 2HA GLY 35 10.221 -14.905 3.581
261 HA3 GLY 35 3HA GLY 35 9.647 -14.740 1.928
262 H LEU 36 H LEU 36 10.848 -11.804 2.606
263 HA LEU 36 HA LEU 36 13.289 -12.329 1.152
264 HB2 LEU 36 2HB LEU 36 11.625 -10.291 1.018
265 HB3 LEU 36 3HB LEU 36 12.646 -9.661 2.310
266 HG LEU 36 HG LEU 36 13.303 -8.795 0.118
267 HD11 LEU 36 1HD1 LEU 36 15.466 -8.785 0.692
268 HD12 LEU 36 2HD1 LEU 36 15.588 -10.544 0.653
269 HD13 LEU 36 3HD1 LEU 36 14.940 -9.736 2.081
270 HD21 LEU 36 3HD2 LEU 36 14.302 -11.478 -0.699
271 HD22 LEU 36 1HD2 LEU 36 13.866 -10.085 -1.688
272 HD23 LEU 36 2HD2 LEU 36 12.604 -11.085 -0.969
273 H ALA 37 H ALA 37 12.339 -11.435 4.412
274 HA ALA 37 HA ALA 37 14.889 -10.746 5.392
275 HB1 ALA 37 1HB ALA 37 13.389 -11.891 7.496
276 HB2 ALA 37 2HB ALA 37 13.635 -10.183 7.132
277 HB3 ALA 37 3HB ALA 37 12.258 -11.042 6.442
278 H GLU 38 H GLU 38 13.396 -13.797 4.732
279 HA GLU 38 HA GLU 38 15.321 -15.284 6.325
280 HB2 GLU 38 2HB GLU 38 14.096 -17.262 5.631
281 HB3 GLU 38 3HB GLU 38 12.975 -16.039 6.210
282 HG2 GLU 38 2HG GLU 38 12.193 -15.565 4.068
283 HG3 GLU 38 3HG GLU 38 13.580 -16.329 3.294
284 H LEU 39 H LEU 39 15.238 -13.893 3.300
285 HA LEU 39 HA LEU 39 16.351 -15.733 1.568
286 HB2 LEU 39 2HB LEU 39 15.641 -13.267 1.215
287 HB3 LEU 39 3HB LEU 39 17.314 -12.899 1.629
288 HG LEU 39 HG LEU 39 16.937 -12.949 -0.796
289 HD11 LEU 39 1HD1 LEU 39 18.850 -14.232 -1.360
290 HD12 LEU 39 2HD1 LEU 39 18.644 -15.281 0.043
291 HD13 LEU 39 3HD1 LEU 39 19.121 -13.598 0.264
292 HD21 LEU 39 3HD2 LEU 39 16.363 -14.956 -1.952
293 HD22 LEU 39 1HD2 LEU 39 15.139 -14.687 -0.710
294 HD23 LEU 39 2HD2 LEU 39 16.399 -15.895 -0.459
295 H GLY 40 H GLY 40 18.101 -13.471 3.702
296 HA2 GLY 40 2HA GLY 40 19.980 -15.012 4.797
297 HA3 GLY 40 3HA GLY 40 20.601 -14.859 3.160
298 H ALA 41 H ALA 41 22.457 -13.782 3.920
299 HA ALA 41 HA ALA 41 22.297 -11.387 5.462
300 HB1 ALA 41 1HB ALA 41 24.467 -12.821 4.001
301 HB2 ALA 41 2HB ALA 41 24.734 -11.164 4.545
302 HB3 ALA 41 3HB ALA 41 24.335 -12.423 5.715
303 H VAL 42 H VAL 42 23.091 -11.991 2.037
304 HA VAL 42 HA VAL 42 22.232 -9.230 1.457
305 HB VAL 42 HB VAL 42 24.684 -9.580 1.169
306 HG11 VAL 42 1HG1 VAL 42 23.878 -11.389 -1.104
307 HG12 VAL 42 2HG1 VAL 42 25.519 -10.948 -0.627
308 HG13 VAL 42 3HG1 VAL 42 24.526 -11.945 0.438
309 HG21 VAL 42 3HG2 VAL 42 22.858 -8.742 -1.018
310 HG22 VAL 42 1HG2 VAL 42 24.023 -7.798 -0.090
311 HG23 VAL 42 2HG2 VAL 42 24.579 -8.863 -1.381
312 H LEU 43 H LEU 43 20.757 -8.942 -0.120
313 HA LEU 43 HA LEU 43 19.204 -11.086 -1.033
314 HB2 LEU 43 2HB LEU 43 19.419 -8.197 -1.719
315 HB3 LEU 43 3HB LEU 43 18.485 -9.248 -2.782
316 HG LEU 43 HG LEU 43 16.987 -9.813 -0.971
317 HD11 LEU 43 1HD1 LEU 43 18.090 -9.871 1.016
318 HD12 LEU 43 2HD1 LEU 43 17.359 -8.272 1.152
319 HD13 LEU 43 3HD1 LEU 43 19.044 -8.431 0.659
320 HD21 LEU 43 3HD2 LEU 43 16.555 -7.171 -0.351
321 HD22 LEU 43 1HD2 LEU 43 15.938 -8.012 -1.773
322 HD23 LEU 43 2HD2 LEU 43 17.432 -7.080 -1.879
323 HA PRO 44 HA PRO 44 21.178 -12.604 -4.645
324 HB2 PRO 44 2HB PRO 44 19.085 -13.024 -6.321
325 HB3 PRO 44 3HB PRO 44 19.397 -14.032 -4.903
326 HG2 PRO 44 2HG PRO 44 17.463 -11.770 -5.231
327 HG3 PRO 44 3HG PRO 44 17.226 -13.338 -4.438
328 HD2 PRO 44 2HD PRO 44 17.729 -11.066 -3.053
329 HD3 PRO 44 3HD PRO 44 18.282 -12.662 -2.504
330 H HIS 45 H HIS 45 20.833 -12.362 -7.243
331 HA HIS 45 HA HIS 45 20.810 -9.467 -7.794
332 HB2 HIS 45 2HB HIS 45 22.493 -10.187 -9.668
333 HB3 HIS 45 3HB HIS 45 23.065 -9.949 -8.019
334 HD1 HIS 45 HD1 HIS 45 24.889 -11.626 -7.804
335 HD2 HIS 45 HD2 HIS 45 21.453 -13.253 -9.479
336 HE1 HIS 45 HE1 HIS 45 25.339 -14.093 -8.000
337 H GLY 46 H GLY 46 18.594 -9.675 -8.425
338 HA2 GLY 46 2HA GLY 46 17.882 -9.579 -10.953
339 HA3 GLY 46 3HA GLY 46 18.057 -11.320 -10.786
340 H THR 47 H THR 47 17.120 -10.757 -7.857
341 HA THR 47 HA THR 47 14.388 -11.446 -8.350
342 HB THR 47 HB THR 47 15.794 -10.784 -5.755
343 HG1 THR 47 HG1 THR 47 15.145 -13.252 -7.027
344 HG21 THR 47 3HG2 THR 47 13.576 -12.459 -5.320
345 HG22 THR 47 1HG2 THR 47 13.006 -11.145 -6.347
346 HG23 THR 47 2HG2 THR 47 13.779 -10.786 -4.803
347 H ALA 48 H ALA 48 12.691 -10.140 -8.540
348 HA ALA 48 HA ALA 48 12.946 -7.330 -8.560
349 HB1 ALA 48 1HB ALA 48 10.678 -9.243 -8.797
350 HB2 ALA 48 2HB ALA 48 10.325 -7.537 -8.522
351 HB3 ALA 48 3HB ALA 48 11.256 -8.028 -9.937
352 H VAL 49 H VAL 49 11.897 -5.773 -7.203
353 HA VAL 49 HA VAL 49 11.025 -6.649 -4.567
354 HB VAL 49 HB VAL 49 13.332 -4.727 -4.905
355 HG11 VAL 49 1HG1 VAL 49 13.227 -5.317 -2.265
356 HG12 VAL 49 2HG1 VAL 49 12.483 -3.892 -2.994
357 HG13 VAL 49 3HG1 VAL 49 11.512 -5.330 -2.676
358 HG21 VAL 49 3HG2 VAL 49 14.515 -6.517 -3.525
359 HG22 VAL 49 1HG2 VAL 49 13.181 -7.579 -3.975
360 HG23 VAL 49 2HG2 VAL 49 14.213 -6.882 -5.223
361 H GLU 50 H GLU 50 9.257 -5.547 -4.069
362 HA GLU 50 HA GLU 50 8.584 -3.135 -5.520
363 HB2 GLU 50 2HB GLU 50 6.909 -4.921 -5.065
364 HB3 GLU 50 3HB GLU 50 7.032 -4.556 -3.350
365 HG2 GLU 50 2HG GLU 50 6.407 -2.300 -5.154
366 HG3 GLU 50 3HG GLU 50 5.154 -3.520 -4.928
367 H LEU 51 H LEU 51 8.136 -1.118 -4.588
368 HA LEU 51 HA LEU 51 9.363 -0.702 -1.942
369 HB2 LEU 51 2HB LEU 51 9.456 0.876 -4.466
370 HB3 LEU 51 3HB LEU 51 9.547 1.732 -2.928
371 HG LEU 51 HG LEU 51 11.766 1.365 -3.810
372 HD11 LEU 51 1HD1 LEU 51 12.446 1.144 -1.715
373 HD12 LEU 51 2HD1 LEU 51 12.138 -0.591 -1.783
374 HD13 LEU 51 3HD1 LEU 51 10.862 0.511 -1.266
375 HD21 LEU 51 3HD2 LEU 51 11.134 -0.664 -5.145
376 HD22 LEU 51 1HD2 LEU 51 11.232 -1.594 -3.649
377 HD23 LEU 51 2HD2 LEU 51 12.667 -0.785 -4.279
378 HA PRO 52 HA PRO 52 4.989 0.384 -1.258
379 HB2 PRO 52 2HB PRO 52 5.073 -0.116 1.409
380 HB3 PRO 52 3HB PRO 52 4.834 -1.384 0.201
381 HG2 PRO 52 2HG PRO 52 7.335 -0.586 1.640
382 HG3 PRO 52 3HG PRO 52 6.716 -2.210 1.289
383 HD2 PRO 52 2HD PRO 52 8.674 -1.049 -0.177
384 HD3 PRO 52 3HD PRO 52 7.495 -2.175 -0.880
385 H ASP 53 H ASP 53 4.002 2.077 -0.015
386 HA ASP 53 HA ASP 53 3.873 4.166 0.876
387 HB2 ASP 53 2HB ASP 53 5.328 2.905 2.652
388 HB3 ASP 53 3HB ASP 53 6.633 3.903 2.016
389 H VAL 54 H VAL 54 4.779 3.921 -1.760
390 HA VAL 54 HA VAL 54 6.567 6.255 -1.951
391 HB VAL 54 HB VAL 54 6.528 3.865 -3.799
392 HG11 VAL 54 1HG1 VAL 54 8.710 5.298 -4.506
393 HG12 VAL 54 2HG1 VAL 54 7.145 5.414 -5.314
394 HG13 VAL 54 3HG1 VAL 54 7.592 6.593 -4.080
395 HG21 VAL 54 3HG2 VAL 54 7.687 3.323 -1.776
396 HG22 VAL 54 1HG2 VAL 54 8.891 3.617 -3.031
397 HG23 VAL 54 2HG2 VAL 54 8.569 4.849 -1.811
398 H GLN 55 H GLN 55 6.077 7.782 -3.498
399 HA GLN 55 HA GLN 55 3.605 7.350 -5.036
400 HB2 GLN 55 2HB GLN 55 3.009 9.712 -4.631
401 HB3 GLN 55 3HB GLN 55 3.068 8.772 -3.146
402 HG2 GLN 55 2HG GLN 55 5.179 9.720 -2.550
403 HG3 GLN 55 3HG GLN 55 5.314 10.521 -4.114
404 HE21 GLN 55 1HE2 GLN 55 5.522 12.541 -3.147
405 HE22 GLN 55 2HE2 GLN 55 4.181 13.356 -2.426
406 H THR 56 H THR 56 3.374 9.139 -6.761
407 HA THR 56 HA THR 56 4.141 10.106 -8.675
408 HB THR 56 HB THR 56 6.894 10.363 -7.513
409 HG1 THR 56 HG1 THR 56 4.846 12.217 -6.903
410 HG21 THR 56 3HG2 THR 56 5.791 11.243 -9.837
411 HG22 THR 56 1HG2 THR 56 7.159 12.009 -9.033
412 HG23 THR 56 2HG2 THR 56 5.529 12.634 -8.787
413 H ALA 57 H ALA 57 4.106 7.364 -8.650
414 HA ALA 57 HA ALA 57 6.381 6.744 -10.400
415 HB1 ALA 57 1HB ALA 57 7.173 5.489 -8.698
416 HB2 ALA 57 2HB ALA 57 5.594 5.349 -7.922
417 HB3 ALA 57 3HB ALA 57 5.993 4.325 -9.301
418 HA PRO 58 HA PRO 58 3.445 5.052 -13.186
419 HB2 PRO 58 2HB PRO 58 4.770 2.912 -14.204
420 HB3 PRO 58 3HB PRO 58 5.196 4.581 -14.597
421 HG2 PRO 58 2HG PRO 58 6.459 2.719 -12.622
422 HG3 PRO 58 3HG PRO 58 7.234 3.827 -13.769
423 HD2 PRO 58 2HD PRO 58 6.941 4.419 -11.143
424 HD3 PRO 58 3HD PRO 58 6.909 5.661 -12.412
425 H VAL 59 H VAL 59 2.198 3.083 -13.760
426 HA VAL 59 HA VAL 59 2.018 1.173 -11.525
427 HB VAL 59 HB VAL 59 -0.358 2.318 -12.997
428 HG11 VAL 59 1HG1 VAL 59 -1.474 1.276 -10.882
429 HG12 VAL 59 2HG1 VAL 59 -1.048 0.247 -12.251
430 HG13 VAL 59 3HG1 VAL 59 -0.009 0.296 -10.826
431 HG21 VAL 59 3HG2 VAL 59 -0.048 4.122 -11.707
432 HG22 VAL 59 1HG2 VAL 59 -0.584 3.096 -10.376
433 HG23 VAL 59 2HG2 VAL 59 1.139 3.302 -10.692
434 H ALA 60 H ALA 60 2.169 -0.873 -12.150
435 HA ALA 60 HA ALA 60 2.242 -1.556 -14.939
436 HB1 ALA 60 1HB ALA 60 2.592 -3.129 -12.406
437 HB2 ALA 60 2HB ALA 60 2.562 -3.904 -13.991
438 HB3 ALA 60 3HB ALA 60 3.800 -2.705 -13.620
439 H GLU 61 H GLU 61 0.707 -2.502 -16.154
440 HA GLU 61 HA GLU 61 -1.857 -3.114 -14.845
441 HB2 GLU 61 2HB GLU 61 -2.815 -2.800 -17.162
442 HB3 GLU 61 3HB GLU 61 -2.168 -1.352 -16.405
443 HG2 GLU 61 2HG GLU 61 -0.201 -1.437 -17.744
444 HG3 GLU 61 3HG GLU 61 -0.631 -3.027 -18.370
445 H THR 62 H THR 62 0.319 -4.979 -14.940
446 HA THR 62 HA THR 62 -0.912 -7.068 -16.614
447 HB THR 62 HB THR 62 1.405 -8.084 -16.779
448 HG1 THR 62 HG1 THR 62 2.591 -6.971 -15.299
449 HG21 THR 62 3HG2 THR 62 1.934 -6.895 -18.736
450 HG22 THR 62 1HG2 THR 62 1.265 -5.390 -18.107
451 HG23 THR 62 2HG2 THR 62 0.189 -6.710 -18.567
452 H VAL 63 H VAL 63 -2.116 -7.763 -14.794
453 HA VAL 63 HA VAL 63 -0.579 -9.481 -13.007
454 HB VAL 63 HB VAL 63 -2.586 -7.475 -11.968
455 HG11 VAL 63 1HG1 VAL 63 -1.525 -8.431 -9.752
456 HG12 VAL 63 2HG1 VAL 63 -2.891 -9.230 -10.532
457 HG13 VAL 63 3HG1 VAL 63 -1.255 -9.848 -10.765
458 HG21 VAL 63 3HG2 VAL 63 -0.540 -6.703 -10.652
459 HG22 VAL 63 1HG2 VAL 63 0.410 -7.622 -11.820
460 HG23 VAL 63 2HG2 VAL 63 -0.600 -6.283 -12.364
461 H ASN 64 H ASN 64 -1.500 -11.418 -12.874
462 HA ASN 64 HA ASN 64 -4.337 -11.665 -13.621
463 HB2 ASN 64 2HB ASN 64 -3.712 -14.072 -14.132
464 HB3 ASN 64 3HB ASN 64 -3.017 -12.857 -15.200
465 HD21 ASN 64 1HD2 ASN 64 -0.812 -12.351 -15.010
466 HD22 ASN 64 2HD2 ASN 64 0.297 -13.438 -14.253
467 H LEU 65 H LEU 65 -4.283 -10.952 -11.152
468 HA LEU 65 HA LEU 65 -4.738 -13.421 -9.638
469 HB2 LEU 65 2HB LEU 65 -2.786 -11.324 -9.065
470 HB3 LEU 65 3HB LEU 65 -3.852 -11.685 -7.708
471 HG LEU 65 HG LEU 65 -1.815 -12.962 -7.515
472 HD11 LEU 65 1HD1 LEU 65 -4.258 -13.953 -7.169
473 HD12 LEU 65 2HD1 LEU 65 -2.801 -14.909 -6.899
474 HD13 LEU 65 3HD1 LEU 65 -3.693 -15.069 -8.412
475 HD21 LEU 65 3HD2 LEU 65 -1.834 -13.037 -10.255
476 HD22 LEU 65 1HD2 LEU 65 -2.255 -14.694 -9.822
477 HD23 LEU 65 2HD2 LEU 65 -0.766 -13.975 -9.209
478 H TRP 66 H TRP 66 -5.749 -12.664 -7.376
479 HA TRP 66 HA TRP 66 -7.870 -10.723 -8.028
480 HB2 TRP 66 2HB TRP 66 -8.110 -13.208 -6.318
481 HB3 TRP 66 3HB TRP 66 -9.401 -12.056 -6.651
482 HD1 TRP 66 HD1 TRP 66 -9.397 -11.730 -9.679
483 HE1 TRP 66 HE1 TRP 66 -9.858 -13.696 -11.274
484 HE3 TRP 66 HE3 TRP 66 -8.242 -15.603 -6.548
485 HZ2 TRP 66 HZ2 TRP 66 -9.748 -16.516 -11.213
486 HZ3 TRP 66 HZ3 TRP 66 -8.447 -17.904 -7.393
487 HH2 TRP 66 HH2 TRP 66 -9.185 -18.349 -9.677
488 H GLU 67 H GLU 67 -7.181 -8.929 -6.983
489 HA GLU 67 HA GLU 67 -6.672 -9.185 -4.092
490 HB2 GLU 67 2HB GLU 67 -5.310 -7.518 -6.173
491 HB3 GLU 67 3HB GLU 67 -5.381 -6.943 -4.513
492 HG2 GLU 67 2HG GLU 67 -3.403 -8.043 -4.436
493 HG3 GLU 67 3HG GLU 67 -4.479 -9.372 -4.009
494 H VAL 68 H VAL 68 -9.188 -8.708 -5.575
495 HA VAL 68 HA VAL 68 -9.822 -5.965 -4.740
496 HB VAL 68 HB VAL 68 -10.401 -6.574 -7.059
497 HG11 VAL 68 1HG1 VAL 68 -12.673 -8.259 -6.264
498 HG12 VAL 68 2HG1 VAL 68 -11.585 -8.394 -7.647
499 HG13 VAL 68 3HG1 VAL 68 -11.086 -9.001 -6.068
500 HG21 VAL 68 3HG2 VAL 68 -11.812 -5.055 -5.411
501 HG22 VAL 68 1HG2 VAL 68 -12.347 -5.382 -7.059
502 HG23 VAL 68 2HG2 VAL 68 -13.035 -6.289 -5.712
503 H GLU 69 H GLU 69 -10.526 -9.311 -4.098
504 HA GLU 69 HA GLU 69 -12.597 -8.534 -2.162
505 HB2 GLU 69 2HB GLU 69 -12.990 -10.326 -3.984
506 HB3 GLU 69 3HB GLU 69 -11.982 -11.360 -2.981
507 HG2 GLU 69 2HG GLU 69 -13.534 -11.476 -1.295
508 HG3 GLU 69 3HG GLU 69 -14.297 -9.953 -1.746
509 H HIS 70 H HIS 70 -10.024 -7.933 -1.421
510 HA HIS 70 HA HIS 70 -9.409 -10.000 0.589
511 HB2 HIS 70 2HB HIS 70 -7.626 -8.161 -0.976
512 HB3 HIS 70 3HB HIS 70 -7.104 -8.779 0.588
513 HD1 HIS 70 HD1 HIS 70 -5.379 -10.462 -0.041
514 HD2 HIS 70 HD2 HIS 70 -8.865 -10.880 -2.262
515 HE1 HIS 70 HE1 HIS 70 -5.071 -12.565 -1.386
516 H HIS 71 H HIS 71 -10.974 -9.045 2.006
517 HA HIS 71 HA HIS 71 -11.657 -7.701 3.711
518 HB2 HIS 71 2HB HIS 71 -9.183 -8.313 4.314
519 HB3 HIS 71 3HB HIS 71 -8.874 -6.616 3.959
520 HD1 HIS 71 HD1 HIS 71 -8.857 -5.280 6.025
521 HD2 HIS 71 HD2 HIS 71 -11.608 -8.387 6.234
522 HE1 HIS 71 HE1 HIS 71 -9.932 -5.075 8.289
Start of MODEL 4
1 H1 MET 1 H MET 1 2.410 2.308 3.651
2 HA MET 1 HA MET 1 1.781 1.638 0.857
3 HB2 MET 1 2HB MET 1 2.675 4.054 1.401
4 HB3 MET 1 3HB MET 1 4.227 3.233 1.500
5 HG2 MET 1 2HG MET 1 2.459 2.874 -0.884
6 HG3 MET 1 3HG MET 1 3.501 4.287 -0.733
7 HE1 MET 1 3HE MET 1 3.698 0.797 -2.574
8 HE2 MET 1 1HE MET 1 4.594 -0.067 -1.324
9 HE3 MET 1 2HE MET 1 3.032 0.660 -0.946
10 H LYS 2 H LYS 2 2.096 -0.565 1.477
11 HA LYS 2 HA LYS 2 4.943 -1.276 1.710
12 HB2 LYS 2 2HB LYS 2 4.405 -3.105 3.189
13 HB3 LYS 2 3HB LYS 2 3.762 -1.616 3.870
14 HG2 LYS 2 2HG LYS 2 1.570 -2.327 2.664
15 HG3 LYS 2 3HG LYS 2 2.312 -3.929 2.669
16 HD2 LYS 2 2HD LYS 2 2.707 -3.497 5.179
17 HD3 LYS 2 3HD LYS 2 1.510 -2.213 4.995
18 HE2 LYS 2 2HE LYS 2 1.129 -5.152 4.437
19 HE3 LYS 2 3HE LYS 2 0.411 -4.219 5.750
20 HZ1 LYS 2 3HZ LYS 2 -0.468 -4.514 3.052
21 HZ2 LYS 2 1HZ LYS 2 -0.313 -2.883 3.476
22 HZ3 LYS 2 2HZ LYS 2 -1.301 -3.905 4.393
23 H THR 3 H THR 3 5.574 -3.214 0.686
24 HA THR 3 HA THR 3 3.588 -4.494 -1.049
25 HB THR 3 HB THR 3 4.653 -2.800 -2.449
26 HG1 THR 3 HG1 THR 3 4.595 -4.251 -3.979
27 HG21 THR 3 3HG2 THR 3 6.858 -2.358 -2.487
28 HG22 THR 3 1HG2 THR 3 7.298 -4.065 -2.470
29 HG23 THR 3 2HG2 THR 3 6.902 -3.242 -0.961
30 H PHE 4 H PHE 4 4.385 -6.534 -1.997
31 HA PHE 4 HA PHE 4 5.739 -8.087 -0.004
32 HB2 PHE 4 2HB PHE 4 4.986 -9.001 -2.779
33 HB3 PHE 4 3HB PHE 4 5.197 -9.988 -1.337
34 HD1 PHE 4 HD1 PHE 4 3.645 -8.721 0.689
35 HD2 PHE 4 HD2 PHE 4 2.801 -9.100 -3.465
36 HE1 PHE 4 HE1 PHE 4 1.237 -8.540 1.165
37 HE2 PHE 4 HE2 PHE 4 0.393 -8.919 -2.997
38 HZ PHE 4 HZ PHE 4 -0.392 -8.638 -0.679
39 H ALA 5 H ALA 5 7.725 -9.097 -0.130
40 HA ALA 5 HA ALA 5 9.604 -7.882 -2.012
41 HB1 ALA 5 1HB ALA 5 10.254 -9.619 0.360
42 HB2 ALA 5 2HB ALA 5 11.339 -8.548 -0.527
43 HB3 ALA 5 3HB ALA 5 10.043 -7.871 0.458
44 H LEU 6 H LEU 6 9.595 -8.971 -3.900
45 HA LEU 6 HA LEU 6 9.653 -11.900 -3.850
46 HB2 LEU 6 2HB LEU 6 9.144 -9.909 -6.046
47 HB3 LEU 6 3HB LEU 6 9.350 -11.633 -6.346
48 HG LEU 6 HG LEU 6 7.354 -11.336 -4.350
49 HD11 LEU 6 1HD1 LEU 6 7.074 -9.042 -5.113
50 HD12 LEU 6 2HD1 LEU 6 5.685 -10.028 -5.566
51 HD13 LEU 6 3HD1 LEU 6 6.897 -9.603 -6.776
52 HD21 LEU 6 3HD2 LEU 6 7.034 -12.038 -7.263
53 HD22 LEU 6 1HD2 LEU 6 6.008 -12.535 -5.917
54 HD23 LEU 6 2HD2 LEU 6 7.657 -13.149 -6.042
55 H GLN 7 H GLN 7 10.967 -12.644 -6.011
56 HA GLN 7 HA GLN 7 13.643 -12.567 -5.344
57 HB2 GLN 7 2HB GLN 7 12.275 -14.017 -7.083
58 HB3 GLN 7 3HB GLN 7 12.903 -12.835 -8.223
59 HG2 GLN 7 2HG GLN 7 15.157 -13.399 -7.672
60 HG3 GLN 7 3HG GLN 7 14.625 -14.432 -6.346
61 HE21 GLN 7 1HE2 GLN 7 16.298 -15.457 -8.191
62 HE22 GLN 7 2HE2 GLN 7 15.472 -16.591 -9.198
63 H GLY 8 H GLY 8 15.066 -10.964 -5.339
64 HA2 GLY 8 2HA GLY 8 16.278 -9.137 -6.043
65 HA3 GLY 8 3HA GLY 8 15.459 -9.262 -7.593
66 H ASP 9 H ASP 9 13.539 -9.012 -4.734
67 HA ASP 9 HA ASP 9 13.053 -6.163 -5.305
68 HB2 ASP 9 2HB ASP 9 11.102 -8.409 -4.966
69 HB3 ASP 9 3HB ASP 9 10.643 -6.785 -4.461
70 H THR 10 H THR 10 14.729 -7.567 -3.284
71 HA THR 10 HA THR 10 13.446 -7.351 -0.752
72 HB THR 10 HB THR 10 15.574 -7.765 0.232
73 HG1 THR 10 HG1 THR 10 17.403 -7.112 -0.652
74 HG21 THR 10 3HG2 THR 10 16.426 -9.684 -1.098
75 HG22 THR 10 1HG2 THR 10 15.379 -9.185 -2.426
76 HG23 THR 10 2HG2 THR 10 14.674 -9.702 -0.894
77 H LEU 11 H LEU 11 14.727 -5.934 0.971
78 HA LEU 11 HA LEU 11 13.949 -3.316 0.667
79 HB2 LEU 11 2HB LEU 11 16.291 -4.280 2.302
80 HB3 LEU 11 3HB LEU 11 15.394 -2.782 2.543
81 HG LEU 11 HG LEU 11 14.347 -5.581 2.959
82 HD11 LEU 11 1HD1 LEU 11 14.691 -5.320 5.178
83 HD12 LEU 11 2HD1 LEU 11 14.450 -3.575 5.126
84 HD13 LEU 11 3HD1 LEU 11 15.988 -4.268 4.610
85 HD21 LEU 11 3HD2 LEU 11 12.549 -3.906 4.109
86 HD22 LEU 11 1HD2 LEU 11 12.373 -4.613 2.502
87 HD23 LEU 11 2HD2 LEU 11 13.015 -2.980 2.682
88 H ASP 12 H ASP 12 17.162 -4.695 0.047
89 HA ASP 12 HA ASP 12 18.526 -2.374 -0.604
90 HB2 ASP 12 2HB ASP 12 19.768 -4.391 -0.386
91 HB3 ASP 12 3HB ASP 12 18.816 -5.195 -1.632
92 H ALA 13 H ALA 13 16.249 -4.233 -2.498
93 HA ALA 13 HA ALA 13 16.791 -2.720 -4.915
94 HB1 ALA 13 1HB ALA 13 14.475 -4.197 -5.328
95 HB2 ALA 13 2HB ALA 13 16.114 -4.646 -5.799
96 HB3 ALA 13 3HB ALA 13 15.457 -5.199 -4.258
97 H ILE 14 H ILE 14 13.923 -3.296 -2.867
98 HA ILE 14 HA ILE 14 12.227 -1.439 -4.003
99 HB ILE 14 HB ILE 14 12.427 -2.255 -1.104
100 HG12 ILE 14 2HG1 ILE 14 10.472 -3.170 -3.216
101 HG13 ILE 14 3HG1 ILE 14 11.969 -4.024 -2.860
102 HG21 ILE 14 1HG2 ILE 14 11.240 -0.170 -1.218
103 HG22 ILE 14 2HG2 ILE 14 10.250 -0.758 -2.553
104 HG23 ILE 14 3HG2 ILE 14 10.077 -1.468 -0.948
105 HD11 ILE 14 3HD1 ILE 14 10.246 -3.448 -0.548
106 HD12 ILE 14 1HD1 ILE 14 9.609 -4.596 -1.725
107 HD13 ILE 14 2HD1 ILE 14 11.166 -4.897 -0.953
108 H CYS 15 H CYS 15 14.904 -0.931 -1.828
109 HA CYS 15 HA CYS 15 14.211 1.755 -1.129
110 HB2 CYS 15 2HB CYS 15 16.668 0.058 -0.802
111 HB3 CYS 15 3HB CYS 15 16.719 1.779 -0.442
112 HG CYS 15 HG CYS 15 14.275 1.235 1.267
113 H VAL 16 H VAL 16 16.082 0.231 -3.658
114 HA VAL 16 HA VAL 16 17.182 2.746 -4.592
115 HB VAL 16 HB VAL 16 17.324 -0.015 -5.811
116 HG11 VAL 16 1HG1 VAL 16 18.458 2.628 -6.616
117 HG12 VAL 16 2HG1 VAL 16 19.360 1.149 -6.955
118 HG13 VAL 16 3HG1 VAL 16 17.738 1.364 -7.612
119 HG21 VAL 16 3HG2 VAL 16 18.427 0.430 -3.538
120 HG22 VAL 16 1HG2 VAL 16 19.424 -0.269 -4.815
121 HG23 VAL 16 2HG2 VAL 16 19.554 1.448 -4.434
122 H ARG 17 H ARG 17 14.427 0.766 -5.176
123 HA ARG 17 HA ARG 17 13.878 1.907 -7.785
124 HB2 ARG 17 2HB ARG 17 12.210 0.331 -7.995
125 HB3 ARG 17 3HB ARG 17 13.305 -0.495 -6.895
126 HG2 ARG 17 2HG ARG 17 11.921 0.258 -4.999
127 HG3 ARG 17 3HG ARG 17 10.798 0.993 -6.145
128 HD2 ARG 17 2HD ARG 17 11.482 -1.930 -5.873
129 HD3 ARG 17 3HD ARG 17 9.944 -1.155 -5.494
130 HE ARG 17 HE ARG 17 10.856 -2.003 -8.067
131 HH11 ARG 17 1HH1 ARG 17 8.860 0.314 -6.404
132 HH12 ARG 17 2HH1 ARG 17 7.811 0.578 -7.757
133 HH21 ARG 17 1HH2 ARG 17 9.483 -1.664 -9.857
134 HH22 ARG 17 2HH2 ARG 17 8.166 -0.548 -9.721
135 H TYR 18 H TYR 18 13.234 2.630 -4.514
136 HA TYR 18 HA TYR 18 11.021 4.418 -5.259
137 HB2 TYR 18 2HB TYR 18 11.715 2.937 -2.779
138 HB3 TYR 18 3HB TYR 18 10.969 4.519 -2.580
139 HD1 TYR 18 HD1 TYR 18 8.673 4.910 -3.285
140 HD2 TYR 18 HD2 TYR 18 10.478 1.084 -3.743
141 HE1 TYR 18 HE1 TYR 18 6.456 3.917 -3.668
142 HE2 TYR 18 HE2 TYR 18 8.266 0.081 -4.128
143 HH TYR 18 HH TYR 18 5.540 1.855 -4.839
144 H TYR 19 H TYR 19 13.712 4.390 -2.914
145 HA TYR 19 HA TYR 19 13.876 7.286 -3.049
146 HB2 TYR 19 2HB TYR 19 15.719 5.493 -1.483
147 HB3 TYR 19 3HB TYR 19 15.284 7.168 -1.159
148 HD1 TYR 19 HD2 TYR 19 12.918 7.671 -0.400
149 HD2 TYR 19 HD1 TYR 19 14.496 3.721 -0.535
150 HE1 TYR 19 HE2 TYR 19 11.150 6.918 1.135
151 HE2 TYR 19 HE1 TYR 19 12.730 2.958 0.998
152 HH TYR 19 HH TYR 19 10.982 3.542 2.231
153 H GLY 20 H GLY 20 15.738 4.464 -4.022
154 HA2 GLY 20 2HA GLY 20 17.204 4.413 -5.863
155 HA3 GLY 20 3HA GLY 20 17.301 6.167 -5.806
156 H ARG 21 H ARG 21 17.668 4.541 -2.812
157 HA ARG 21 HA ARG 21 20.486 4.114 -2.949
158 HB2 ARG 21 2HB ARG 21 21.189 5.889 -1.434
159 HB3 ARG 21 3HB ARG 21 20.468 6.571 -2.885
160 HG2 ARG 21 2HG ARG 21 18.780 6.146 -0.463
161 HG3 ARG 21 3HG ARG 21 19.869 7.532 -0.545
162 HD2 ARG 21 2HD ARG 21 18.641 7.581 -2.998
163 HD3 ARG 21 3HD ARG 21 17.348 7.036 -1.931
164 HE ARG 21 HE ARG 21 18.433 9.656 -2.085
165 HH11 ARG 21 1HH1 ARG 21 17.109 7.332 0.143
166 HH12 ARG 21 2HH1 ARG 21 16.541 8.530 1.259
167 HH21 ARG 21 1HH2 ARG 21 17.690 11.243 -0.624
168 HH22 ARG 21 2HH2 ARG 21 16.871 10.754 0.821
169 H THR 22 H THR 22 21.388 3.456 -0.852
170 HA THR 22 HA THR 22 19.289 2.359 0.903
171 HB THR 22 HB THR 22 21.162 0.697 1.549
172 HG1 THR 22 HG1 THR 22 22.923 1.551 0.523
173 HG21 THR 22 3HG2 THR 22 20.680 -0.650 -0.597
174 HG22 THR 22 1HG2 THR 22 19.654 0.711 -1.047
175 HG23 THR 22 2HG2 THR 22 19.318 -0.198 0.426
176 H GLU 23 H GLU 23 22.167 4.262 0.728
177 HA GLU 23 HA GLU 23 22.981 4.130 3.423
178 HB2 GLU 23 2HB GLU 23 24.367 5.035 1.568
179 HB3 GLU 23 3HB GLU 23 23.309 6.437 1.497
180 HG2 GLU 23 2HG GLU 23 25.217 7.081 2.724
181 HG3 GLU 23 3HG GLU 23 23.907 6.890 3.888
182 H GLY 24 H GLY 24 21.741 4.629 5.106
183 HA2 GLY 24 2HA GLY 24 20.660 6.129 6.542
184 HA3 GLY 24 3HA GLY 24 20.467 7.243 5.197
185 H VAL 25 H VAL 25 19.475 4.513 3.859
186 HA VAL 25 HA VAL 25 16.672 5.022 4.567
187 HB VAL 25 HB VAL 25 17.710 3.451 2.208
188 HG11 VAL 25 1HG1 VAL 25 15.550 3.381 1.425
189 HG12 VAL 25 2HG1 VAL 25 15.277 3.267 3.165
190 HG13 VAL 25 3HG1 VAL 25 15.058 4.809 2.336
191 HG21 VAL 25 3HG2 VAL 25 17.142 5.517 0.901
192 HG22 VAL 25 1HG2 VAL 25 17.011 6.372 2.438
193 HG23 VAL 25 2HG2 VAL 25 18.552 5.666 1.950
194 H VAL 26 H VAL 26 18.827 2.277 3.834
195 HA VAL 26 HA VAL 26 17.158 0.201 4.550
196 HB VAL 26 HB VAL 26 19.198 -1.108 5.054
197 HG11 VAL 26 1HG1 VAL 26 20.334 -0.628 2.797
198 HG12 VAL 26 2HG1 VAL 26 18.635 -1.106 2.790
199 HG13 VAL 26 3HG1 VAL 26 19.076 0.589 2.585
200 HG21 VAL 26 3HG2 VAL 26 21.391 0.154 4.566
201 HG22 VAL 26 1HG2 VAL 26 20.461 1.607 4.932
202 HG23 VAL 26 2HG2 VAL 26 20.647 0.349 6.153
203 H GLU 27 H GLU 27 19.069 2.309 6.613
204 HA GLU 27 HA GLU 27 18.884 0.873 9.006
205 HB2 GLU 27 2HB GLU 27 20.088 3.182 8.274
206 HB3 GLU 27 3HB GLU 27 18.736 3.820 9.199
207 HG2 GLU 27 2HG GLU 27 20.288 1.619 10.421
208 HG3 GLU 27 3HG GLU 27 21.069 3.195 10.302
209 H THR 28 H THR 28 16.708 3.272 7.579
210 HA THR 28 HA THR 28 14.901 3.364 9.763
211 HB THR 28 HB THR 28 14.022 3.918 6.951
212 HG1 THR 28 HG1 THR 28 15.958 5.313 8.462
213 HG21 THR 28 3HG2 THR 28 12.456 5.246 7.912
214 HG22 THR 28 1HG2 THR 28 13.545 5.789 9.187
215 HG23 THR 28 2HG2 THR 28 12.757 4.216 9.312
216 H VAL 29 H VAL 29 14.602 1.804 6.565
217 HA VAL 29 HA VAL 29 12.208 0.490 6.958
218 HB VAL 29 HB VAL 29 14.564 -0.635 5.440
219 HG11 VAL 29 1HG1 VAL 29 12.942 -2.314 5.556
220 HG12 VAL 29 2HG1 VAL 29 11.611 -1.166 5.393
221 HG13 VAL 29 3HG1 VAL 29 12.638 -1.530 4.006
222 HG21 VAL 29 3HG2 VAL 29 14.359 1.451 4.481
223 HG22 VAL 29 1HG2 VAL 29 13.235 0.508 3.501
224 HG23 VAL 29 2HG2 VAL 29 12.626 1.542 4.793
225 H LEU 30 H LEU 30 15.458 -0.517 7.908
226 HA LEU 30 HA LEU 30 14.765 -3.111 8.783
227 HB2 LEU 30 2HB LEU 30 17.069 -1.292 9.066
228 HB3 LEU 30 3HB LEU 30 16.904 -2.522 10.317
229 HG LEU 30 HG LEU 30 16.955 -3.183 7.380
230 HD11 LEU 30 1HD1 LEU 30 19.366 -3.949 8.123
231 HD12 LEU 30 2HD1 LEU 30 19.181 -2.622 9.269
232 HD13 LEU 30 3HD1 LEU 30 19.059 -2.314 7.537
233 HD21 LEU 30 3HD2 LEU 30 17.989 -5.269 8.858
234 HD22 LEU 30 1HD2 LEU 30 16.356 -5.169 8.198
235 HD23 LEU 30 2HD2 LEU 30 16.668 -4.670 9.861
236 H ALA 31 H ALA 31 14.992 -0.005 10.469
237 HA ALA 31 HA ALA 31 14.493 -0.970 13.063
238 HB1 ALA 31 1HB ALA 31 14.584 1.634 11.738
239 HB2 ALA 31 2HB ALA 31 13.475 1.565 13.108
240 HB3 ALA 31 3HB ALA 31 15.174 1.146 13.327
241 H ALA 32 H ALA 32 12.350 -0.043 10.438
242 HA ALA 32 HA ALA 32 9.966 -0.162 12.038
243 HB1 ALA 32 1HB ALA 32 9.098 -0.331 9.457
244 HB2 ALA 32 2HB ALA 32 9.412 1.171 10.326
245 HB3 ALA 32 3HB ALA 32 10.648 0.488 9.270
246 H ASN 33 H ASN 33 11.804 -2.372 10.070
247 HA ASN 33 HA ASN 33 9.808 -4.467 10.630
248 HB2 ASN 33 2HB ASN 33 11.571 -4.100 8.204
249 HB3 ASN 33 3HB ASN 33 10.721 -5.602 8.556
250 HD21 ASN 33 1HD2 ASN 33 10.503 -2.459 7.276
251 HD22 ASN 33 2HD2 ASN 33 8.821 -2.485 6.878
252 HA PRO 34 HA PRO 34 13.805 -5.535 12.743
253 HB2 PRO 34 2HB PRO 34 12.642 -6.274 15.082
254 HB3 PRO 34 3HB PRO 34 13.097 -4.605 14.721
255 HG2 PRO 34 2HG PRO 34 10.414 -5.920 14.531
256 HG3 PRO 34 3HG PRO 34 10.833 -4.320 15.169
257 HD2 PRO 34 2HD PRO 34 9.798 -4.675 12.692
258 HD3 PRO 34 3HD PRO 34 10.944 -3.372 13.071
259 H GLY 35 H GLY 35 14.595 -7.604 13.245
260 HA2 GLY 35 2HA GLY 35 14.433 -9.933 13.571
261 HA3 GLY 35 3HA GLY 35 12.747 -9.862 13.079
262 H LEU 36 H LEU 36 13.623 -8.175 10.710
263 HA LEU 36 HA LEU 36 13.729 -10.240 8.815
264 HB2 LEU 36 2HB LEU 36 13.175 -7.627 8.689
265 HB3 LEU 36 3HB LEU 36 14.829 -7.590 8.082
266 HG LEU 36 HG LEU 36 13.187 -7.658 6.270
267 HD11 LEU 36 1HD1 LEU 36 15.491 -9.025 6.411
268 HD12 LEU 36 2HD1 LEU 36 14.469 -8.989 4.975
269 HD13 LEU 36 3HD1 LEU 36 14.375 -10.352 6.090
270 HD21 LEU 36 3HD2 LEU 36 12.010 -9.692 7.925
271 HD22 LEU 36 1HD2 LEU 36 12.319 -10.318 6.306
272 HD23 LEU 36 2HD2 LEU 36 11.341 -8.866 6.517
273 H ALA 37 H ALA 37 16.226 -8.557 10.544
274 HA ALA 37 HA ALA 37 18.417 -9.060 8.873
275 HB1 ALA 37 1HB ALA 37 19.360 -9.200 11.507
276 HB2 ALA 37 2HB ALA 37 19.330 -7.789 10.448
277 HB3 ALA 37 3HB ALA 37 17.983 -8.098 11.544
278 H GLU 38 H GLU 38 16.612 -11.149 10.954
279 HA GLU 38 HA GLU 38 18.673 -13.201 10.977
280 HB2 GLU 38 2HB GLU 38 15.931 -12.992 12.201
281 HB3 GLU 38 3HB GLU 38 16.828 -14.504 12.198
282 HG2 GLU 38 2HG GLU 38 17.725 -11.914 13.442
283 HG3 GLU 38 3HG GLU 38 17.103 -13.324 14.299
284 H LEU 39 H LEU 39 16.841 -12.177 8.621
285 HA LEU 39 HA LEU 39 15.515 -14.584 7.775
286 HB2 LEU 39 2HB LEU 39 14.697 -12.330 7.195
287 HB3 LEU 39 3HB LEU 39 16.144 -12.078 6.220
288 HG LEU 39 HG LEU 39 14.362 -14.389 5.596
289 HD11 LEU 39 1HD1 LEU 39 12.870 -13.093 4.319
290 HD12 LEU 39 2HD1 LEU 39 13.838 -11.633 4.519
291 HD13 LEU 39 3HD1 LEU 39 12.957 -12.300 5.892
292 HD21 LEU 39 3HD2 LEU 39 16.663 -13.229 4.489
293 HD22 LEU 39 1HD2 LEU 39 15.341 -12.838 3.389
294 HD23 LEU 39 2HD2 LEU 39 15.670 -14.519 3.808
295 H GLY 40 H GLY 40 18.330 -12.738 6.592
296 HA2 GLY 40 2HA GLY 40 20.285 -14.368 6.208
297 HA3 GLY 40 3HA GLY 40 19.164 -15.130 5.089
298 H ALA 41 H ALA 41 18.711 -14.153 3.122
299 HA ALA 41 HA ALA 41 20.294 -11.752 2.484
300 HB1 ALA 41 1HB ALA 41 21.556 -12.992 1.139
301 HB2 ALA 41 2HB ALA 41 20.517 -14.401 1.356
302 HB3 ALA 41 3HB ALA 41 20.134 -13.205 0.117
303 H VAL 42 H VAL 42 18.073 -13.793 0.601
304 HA VAL 42 HA VAL 42 16.538 -11.385 -0.067
305 HB VAL 42 HB VAL 42 16.338 -14.104 -1.362
306 HG11 VAL 42 1HG1 VAL 42 14.617 -13.218 -2.447
307 HG12 VAL 42 2HG1 VAL 42 14.840 -11.685 -1.601
308 HG13 VAL 42 3HG1 VAL 42 15.691 -11.990 -3.115
309 HG21 VAL 42 3HG2 VAL 42 18.320 -11.960 -1.682
310 HG22 VAL 42 1HG2 VAL 42 18.419 -13.671 -2.096
311 HG23 VAL 42 2HG2 VAL 42 17.609 -12.546 -3.186
312 H LEU 43 H LEU 43 14.344 -11.229 0.262
313 HA LEU 43 HA LEU 43 13.264 -12.926 2.338
314 HB2 LEU 43 2HB LEU 43 11.846 -10.698 0.902
315 HB3 LEU 43 3HB LEU 43 11.493 -11.359 2.498
316 HG LEU 43 HG LEU 43 13.995 -10.452 2.914
317 HD11 LEU 43 1HD1 LEU 43 14.624 -9.296 1.089
318 HD12 LEU 43 2HD1 LEU 43 13.630 -8.025 1.801
319 HD13 LEU 43 3HD1 LEU 43 12.967 -9.058 0.534
320 HD21 LEU 43 3HD2 LEU 43 11.394 -8.944 3.111
321 HD22 LEU 43 1HD2 LEU 43 12.899 -8.419 3.865
322 HD23 LEU 43 2HD2 LEU 43 12.155 -9.943 4.350
323 HA PRO 44 HA PRO 44 10.855 -15.609 -0.168
324 HB2 PRO 44 2HB PRO 44 8.715 -16.036 1.446
325 HB3 PRO 44 3HB PRO 44 10.311 -16.724 1.766
326 HG2 PRO 44 2HG PRO 44 9.020 -14.300 2.956
327 HG3 PRO 44 3HG PRO 44 9.960 -15.574 3.756
328 HD2 PRO 44 2HD PRO 44 11.019 -13.165 3.117
329 HD3 PRO 44 3HD PRO 44 11.978 -14.659 3.119
330 H HIS 45 H HIS 45 9.718 -15.107 -1.923
331 HA HIS 45 HA HIS 45 8.342 -12.761 -2.378
332 HB2 HIS 45 2HB HIS 45 7.234 -13.998 -4.268
333 HB3 HIS 45 3HB HIS 45 8.990 -14.129 -4.234
334 HD1 HIS 45 HD1 HIS 45 5.901 -16.134 -4.098
335 HD2 HIS 45 HD2 HIS 45 9.959 -16.698 -3.409
336 HE1 HIS 45 HE1 HIS 45 6.234 -18.627 -4.045
337 H GLY 46 H GLY 46 6.734 -12.022 -1.133
338 HA2 GLY 46 2HA GLY 46 4.185 -12.440 -1.151
339 HA3 GLY 46 3HA GLY 46 4.635 -13.900 -0.282
340 H THR 47 H THR 47 6.886 -12.010 0.844
341 HA THR 47 HA THR 47 5.347 -11.291 3.204
342 HB THR 47 HB THR 47 8.323 -11.183 2.676
343 HG1 THR 47 HG1 THR 47 6.773 -12.937 4.306
344 HG21 THR 47 3HG2 THR 47 8.080 -9.586 4.328
345 HG22 THR 47 1HG2 THR 47 8.269 -11.051 5.290
346 HG23 THR 47 2HG2 THR 47 6.663 -10.370 5.026
347 H ALA 48 H ALA 48 4.463 -9.348 3.387
348 HA ALA 48 HA ALA 48 5.168 -7.172 1.674
349 HB1 ALA 48 1HB ALA 48 3.265 -6.188 2.395
350 HB2 ALA 48 2HB ALA 48 2.903 -7.824 2.947
351 HB3 ALA 48 3HB ALA 48 3.542 -6.632 4.079
352 H VAL 49 H VAL 49 6.059 -5.163 2.252
353 HA VAL 49 HA VAL 49 7.415 -5.032 4.854
354 HB VAL 49 HB VAL 49 8.774 -4.304 2.258
355 HG11 VAL 49 1HG1 VAL 49 9.332 -3.759 5.020
356 HG12 VAL 49 2HG1 VAL 49 10.618 -4.745 4.324
357 HG13 VAL 49 3HG1 VAL 49 10.183 -3.207 3.578
358 HG21 VAL 49 3HG2 VAL 49 9.033 -6.778 3.960
359 HG22 VAL 49 1HG2 VAL 49 8.530 -6.682 2.272
360 HG23 VAL 49 2HG2 VAL 49 10.195 -6.310 2.719
361 H GLU 50 H GLU 50 7.130 -3.139 5.839
362 HA GLU 50 HA GLU 50 5.638 -1.055 4.579
363 HB2 GLU 50 2HB GLU 50 5.265 -1.441 6.909
364 HB3 GLU 50 3HB GLU 50 6.976 -1.269 7.274
365 HG2 GLU 50 2HG GLU 50 6.929 1.039 7.016
366 HG3 GLU 50 3HG GLU 50 5.424 1.001 6.098
367 H LEU 51 H LEU 51 6.295 0.894 3.813
368 HA LEU 51 HA LEU 51 9.199 1.397 3.779
369 HB2 LEU 51 2HB LEU 51 7.122 1.961 1.673
370 HB3 LEU 51 3HB LEU 51 8.765 2.596 1.623
371 HG LEU 51 HG LEU 51 8.333 -0.355 1.799
372 HD11 LEU 51 1HD1 LEU 51 7.214 1.206 -0.245
373 HD12 LEU 51 2HD1 LEU 51 7.426 -0.544 -0.214
374 HD13 LEU 51 3HD1 LEU 51 8.675 0.483 -0.918
375 HD21 LEU 51 3HD2 LEU 51 10.579 0.895 1.965
376 HD22 LEU 51 1HD2 LEU 51 10.398 1.142 0.228
377 HD23 LEU 51 2HD2 LEU 51 10.467 -0.494 0.883
378 HA PRO 52 HA PRO 52 7.483 4.950 6.063
379 HB2 PRO 52 2HB PRO 52 9.785 5.453 7.410
380 HB3 PRO 52 3HB PRO 52 8.617 4.231 7.928
381 HG2 PRO 52 2HG PRO 52 11.169 3.884 6.403
382 HG3 PRO 52 3HG PRO 52 10.523 2.914 7.739
383 HD2 PRO 52 2HD PRO 52 10.327 2.143 5.150
384 HD3 PRO 52 3HD PRO 52 9.093 1.742 6.362
385 H ASP 53 H ASP 53 7.964 7.191 5.971
386 HA ASP 53 HA ASP 53 8.657 9.122 4.988
387 HB2 ASP 53 2HB ASP 53 10.934 7.961 5.721
388 HB3 ASP 53 3HB ASP 53 11.169 7.874 3.978
389 H VAL 54 H VAL 54 6.991 7.479 3.497
390 HA VAL 54 HA VAL 54 7.959 7.978 0.757
391 HB VAL 54 HB VAL 54 6.164 5.728 1.675
392 HG11 VAL 54 1HG1 VAL 54 6.711 5.060 -0.827
393 HG12 VAL 54 2HG1 VAL 54 5.340 6.094 -0.421
394 HG13 VAL 54 3HG1 VAL 54 6.842 6.809 -1.007
395 HG21 VAL 54 3HG2 VAL 54 8.992 5.739 0.627
396 HG22 VAL 54 1HG2 VAL 54 8.464 5.298 2.250
397 HG23 VAL 54 2HG2 VAL 54 8.019 4.289 0.873
398 H GLN 55 H GLN 55 6.595 8.996 -0.637
399 HA GLN 55 HA GLN 55 3.936 9.731 0.398
400 HB2 GLN 55 2HB GLN 55 4.227 11.881 -0.884
401 HB3 GLN 55 3HB GLN 55 5.266 11.701 0.523
402 HG2 GLN 55 2HG GLN 55 7.129 11.082 -0.905
403 HG3 GLN 55 3HG GLN 55 6.093 11.198 -2.327
404 HE21 GLN 55 1HE2 GLN 55 7.260 13.095 0.423
405 HE22 GLN 55 2HE2 GLN 55 7.347 14.598 -0.426
406 H THR 56 H THR 56 2.265 9.272 -0.881
407 HA THR 56 HA THR 56 2.624 7.834 -3.297
408 HB THR 56 HB THR 56 0.075 8.261 -3.515
409 HG1 THR 56 HG1 THR 56 -0.691 9.612 -2.089
410 HG21 THR 56 3HG2 THR 56 0.412 6.891 -0.963
411 HG22 THR 56 1HG2 THR 56 1.573 6.370 -2.183
412 HG23 THR 56 2HG2 THR 56 -0.157 6.270 -2.512
413 H ALA 57 H ALA 57 2.190 8.412 -5.423
414 HA ALA 57 HA ALA 57 1.490 11.156 -6.056
415 HB1 ALA 57 1HB ALA 57 3.684 11.726 -6.051
416 HB2 ALA 57 2HB ALA 57 4.230 10.075 -6.351
417 HB3 ALA 57 3HB ALA 57 3.604 11.052 -7.679
418 HA PRO 58 HA PRO 58 -0.343 9.371 -9.620
419 HB2 PRO 58 2HB PRO 58 0.021 11.302 -11.494
420 HB3 PRO 58 3HB PRO 58 -1.120 11.467 -10.153
421 HG2 PRO 58 2HG PRO 58 1.651 12.566 -10.429
422 HG3 PRO 58 3HG PRO 58 0.191 13.356 -9.806
423 HD2 PRO 58 2HD PRO 58 2.100 12.331 -8.181
424 HD3 PRO 58 3HD PRO 58 0.381 12.355 -7.738
425 H VAL 59 H VAL 59 1.418 7.717 -9.670
426 HA VAL 59 HA VAL 59 3.330 8.145 -11.860
427 HB VAL 59 HB VAL 59 4.355 7.425 -9.778
428 HG11 VAL 59 1HG1 VAL 59 2.648 6.301 -8.622
429 HG12 VAL 59 2HG1 VAL 59 2.368 5.179 -9.955
430 HG13 VAL 59 3HG1 VAL 59 3.840 5.055 -8.991
431 HG21 VAL 59 3HG2 VAL 59 4.491 4.938 -11.393
432 HG22 VAL 59 1HG2 VAL 59 4.931 6.454 -12.180
433 HG23 VAL 59 2HG2 VAL 59 5.789 5.931 -10.731
434 H ALA 60 H ALA 60 3.432 6.771 -13.609
435 HA ALA 60 HA ALA 60 1.030 5.172 -14.077
436 HB1 ALA 60 1HB ALA 60 1.284 5.576 -16.296
437 HB2 ALA 60 2HB ALA 60 2.168 6.971 -15.676
438 HB3 ALA 60 3HB ALA 60 3.046 5.540 -16.215
439 H GLU 61 H GLU 61 1.152 3.105 -13.497
440 HA GLU 61 HA GLU 61 3.653 1.647 -14.053
441 HB2 GLU 61 2HB GLU 61 1.684 1.251 -11.795
442 HB3 GLU 61 3HB GLU 61 2.995 0.138 -12.164
443 HG2 GLU 61 2HG GLU 61 4.568 2.089 -11.858
444 HG3 GLU 61 3HG GLU 61 3.193 2.974 -11.201
445 H THR 62 H THR 62 3.509 -0.032 -15.391
446 HA THR 62 HA THR 62 1.001 -1.482 -15.680
447 HB THR 62 HB THR 62 1.469 -1.326 -18.282
448 HG1 THR 62 HG1 THR 62 2.420 1.175 -17.292
449 HG21 THR 62 3HG2 THR 62 -0.420 -0.061 -18.409
450 HG22 THR 62 1HG2 THR 62 0.159 1.119 -17.234
451 HG23 THR 62 2HG2 THR 62 -0.481 -0.431 -16.686
452 H VAL 63 H VAL 63 1.237 -3.493 -16.860
453 HA VAL 63 HA VAL 63 3.818 -4.418 -17.670
454 HB VAL 63 HB VAL 63 4.145 -4.568 -15.253
455 HG11 VAL 63 1HG1 VAL 63 2.645 -5.381 -13.792
456 HG12 VAL 63 2HG1 VAL 63 1.488 -5.116 -15.098
457 HG13 VAL 63 3HG1 VAL 63 2.189 -6.716 -14.850
458 HG21 VAL 63 3HG2 VAL 63 3.905 -7.401 -15.619
459 HG22 VAL 63 1HG2 VAL 63 4.452 -6.647 -17.117
460 HG23 VAL 63 2HG2 VAL 63 5.354 -6.396 -15.623
461 H ASN 64 H ASN 64 3.616 -6.082 -19.056
462 HA ASN 64 HA ASN 64 0.996 -7.424 -19.187
463 HB2 ASN 64 2HB ASN 64 1.749 -7.782 -21.668
464 HB3 ASN 64 3HB ASN 64 1.072 -6.233 -21.177
465 HD21 ASN 64 1HD2 ASN 64 3.874 -7.921 -22.249
466 HD22 ASN 64 2HD2 ASN 64 4.891 -6.539 -22.458
467 H LEU 65 H LEU 65 1.480 -9.227 -17.985
468 HA LEU 65 HA LEU 65 3.596 -10.969 -19.070
469 HB2 LEU 65 2HB LEU 65 3.439 -11.990 -16.676
470 HB3 LEU 65 3HB LEU 65 4.402 -10.545 -16.971
471 HG LEU 65 HG LEU 65 2.466 -9.190 -16.138
472 HD11 LEU 65 1HD1 LEU 65 0.730 -10.288 -14.870
473 HD12 LEU 65 2HD1 LEU 65 1.428 -11.868 -15.223
474 HD13 LEU 65 3HD1 LEU 65 0.734 -10.901 -16.524
475 HD21 LEU 65 3HD2 LEU 65 4.475 -10.465 -14.766
476 HD22 LEU 65 1HD2 LEU 65 3.035 -10.894 -13.844
477 HD23 LEU 65 2HD2 LEU 65 3.430 -9.198 -14.123
478 H TRP 66 H TRP 66 1.237 -11.130 -20.311
479 HA TRP 66 HA TRP 66 -0.122 -13.457 -19.125
480 HB2 TRP 66 2HB TRP 66 -1.954 -12.848 -20.807
481 HB3 TRP 66 3HB TRP 66 -1.733 -11.762 -19.438
482 HD1 TRP 66 HD1 TRP 66 -0.932 -9.299 -19.944
483 HE1 TRP 66 HE1 TRP 66 -0.700 -7.939 -22.117
484 HE3 TRP 66 HE3 TRP 66 -1.328 -13.107 -23.332
485 HZ2 TRP 66 HZ2 TRP 66 -0.686 -8.417 -24.899
486 HZ3 TRP 66 HZ3 TRP 66 -1.196 -12.572 -25.730
487 HH2 TRP 66 HH2 TRP 66 -0.882 -10.275 -26.495
488 H GLU 67 H GLU 67 1.911 -12.435 -21.648
489 HA GLU 67 HA GLU 67 1.271 -14.796 -23.276
490 HB2 GLU 67 2HB GLU 67 2.625 -13.704 -25.035
491 HB3 GLU 67 3HB GLU 67 1.261 -12.721 -24.522
492 HG2 GLU 67 2HG GLU 67 2.803 -11.434 -23.068
493 HG3 GLU 67 3HG GLU 67 4.144 -12.356 -23.745
494 H VAL 68 H VAL 68 2.688 -15.017 -20.781
495 HA VAL 68 HA VAL 68 5.465 -15.492 -21.519
496 HB VAL 68 HB VAL 68 4.879 -14.463 -19.320
497 HG11 VAL 68 1HG1 VAL 68 2.875 -16.065 -19.051
498 HG12 VAL 68 2HG1 VAL 68 4.065 -17.194 -18.398
499 HG13 VAL 68 3HG1 VAL 68 3.809 -15.631 -17.620
500 HG21 VAL 68 3HG2 VAL 68 6.194 -16.875 -18.392
501 HG22 VAL 68 1HG2 VAL 68 6.834 -16.323 -19.939
502 HG23 VAL 68 2HG2 VAL 68 6.825 -15.236 -18.551
503 H GLU 69 H GLU 69 2.515 -17.241 -21.000
504 HA GLU 69 HA GLU 69 3.931 -19.804 -21.016
505 HB2 GLU 69 2HB GLU 69 2.125 -19.370 -19.331
506 HB3 GLU 69 3HB GLU 69 0.975 -19.300 -20.659
507 HG2 GLU 69 2HG GLU 69 0.801 -21.464 -19.778
508 HG3 GLU 69 3HG GLU 69 1.726 -21.631 -21.268
509 H HIS 70 H HIS 70 4.572 -19.526 -23.258
510 HA HIS 70 HA HIS 70 2.375 -20.120 -25.132
511 HB2 HIS 70 2HB HIS 70 3.500 -17.910 -25.495
512 HB3 HIS 70 3HB HIS 70 4.999 -18.779 -25.811
513 HD1 HIS 70 HD1 HIS 70 5.409 -19.365 -28.182
514 HD2 HIS 70 HD2 HIS 70 1.381 -18.680 -27.426
515 HE1 HIS 70 HE1 HIS 70 4.271 -19.505 -30.420
516 H HIS 71 H HIS 71 2.556 -21.878 -26.425
517 HA HIS 71 HA HIS 71 4.838 -23.641 -25.921
518 HB2 HIS 71 2HB HIS 71 2.057 -24.107 -26.975
519 HB3 HIS 71 3HB HIS 71 3.318 -25.325 -27.142
520 HD1 HIS 71 HD1 HIS 71 1.110 -26.330 -25.560
521 HD2 HIS 71 HD2 HIS 71 4.051 -23.970 -23.815
522 HE1 HIS 71 HE1 HIS 71 1.003 -26.833 -23.098
Start of MODEL 5
1 H1 MET 1 H MET 1 2.350 -0.657 4.188
2 HA MET 1 HA MET 1 0.879 -2.601 2.787
3 HB2 MET 1 2HB MET 1 2.935 -1.178 1.090
4 HB3 MET 1 3HB MET 1 1.949 -2.554 0.613
5 HG2 MET 1 2HG MET 1 0.957 0.215 1.245
6 HG3 MET 1 3HG MET 1 1.095 -0.511 -0.354
7 HE1 MET 1 3HE MET 1 -2.490 -0.506 2.234
8 HE2 MET 1 1HE MET 1 -0.940 -0.542 3.074
9 HE3 MET 1 2HE MET 1 -1.262 0.708 1.872
10 H LYS 2 H LYS 2 1.716 -4.388 3.616
11 HA LYS 2 HA LYS 2 4.638 -4.667 3.727
12 HB2 LYS 2 2HB LYS 2 2.835 -5.654 5.933
13 HB3 LYS 2 3HB LYS 2 4.592 -5.571 5.929
14 HG2 LYS 2 2HG LYS 2 4.101 -2.990 5.606
15 HG3 LYS 2 3HG LYS 2 2.588 -3.437 6.397
16 HD2 LYS 2 2HD LYS 2 5.279 -4.203 7.503
17 HD3 LYS 2 3HD LYS 2 4.489 -2.677 7.906
18 HE2 LYS 2 2HE LYS 2 3.747 -3.992 9.628
19 HE3 LYS 2 3HE LYS 2 2.457 -4.253 8.455
20 HZ1 LYS 2 3HZ LYS 2 3.615 -6.252 9.645
21 HZ2 LYS 2 1HZ LYS 2 4.764 -6.060 8.418
22 HZ3 LYS 2 2HZ LYS 2 3.149 -6.368 8.023
23 H THR 3 H THR 3 5.414 -6.817 3.602
24 HA THR 3 HA THR 3 3.482 -8.933 3.063
25 HB THR 3 HB THR 3 3.945 -7.837 0.864
26 HG1 THR 3 HG1 THR 3 4.979 -10.485 1.086
27 HG21 THR 3 3HG2 THR 3 6.508 -7.626 1.709
28 HG22 THR 3 1HG2 THR 3 6.022 -7.557 0.015
29 HG23 THR 3 2HG2 THR 3 6.618 -9.068 0.701
30 H PHE 4 H PHE 4 4.403 -11.056 3.098
31 HA PHE 4 HA PHE 4 6.565 -11.287 4.965
32 HB2 PHE 4 2HB PHE 4 5.298 -13.554 3.432
33 HB3 PHE 4 3HB PHE 4 6.082 -13.613 5.007
34 HD1 PHE 4 HD1 PHE 4 4.910 -11.640 6.613
35 HD2 PHE 4 HD2 PHE 4 3.058 -13.978 3.578
36 HE1 PHE 4 HE1 PHE 4 2.729 -11.330 7.711
37 HE2 PHE 4 HE2 PHE 4 0.874 -13.672 4.669
38 HZ PHE 4 HZ PHE 4 0.708 -12.346 6.738
39 H ALA 5 H ALA 5 8.640 -11.895 4.622
40 HA ALA 5 HA ALA 5 9.644 -11.728 1.922
41 HB1 ALA 5 1HB ALA 5 10.684 -10.882 4.207
42 HB2 ALA 5 2HB ALA 5 11.426 -12.482 4.172
43 HB3 ALA 5 3HB ALA 5 11.694 -11.356 2.841
44 H LEU 6 H LEU 6 10.960 -13.329 0.907
45 HA LEU 6 HA LEU 6 10.907 -16.027 1.983
46 HB2 LEU 6 2HB LEU 6 9.600 -15.288 -0.630
47 HB3 LEU 6 3HB LEU 6 9.962 -16.939 -0.129
48 HG LEU 6 HG LEU 6 8.161 -15.132 1.465
49 HD11 LEU 6 1HD1 LEU 6 7.498 -16.917 -0.859
50 HD12 LEU 6 2HD1 LEU 6 7.083 -15.219 -0.627
51 HD13 LEU 6 3HD1 LEU 6 6.308 -16.459 0.360
52 HD21 LEU 6 3HD2 LEU 6 8.221 -16.839 2.883
53 HD22 LEU 6 1HD2 LEU 6 9.208 -17.788 1.771
54 HD23 LEU 6 2HD2 LEU 6 7.449 -17.838 1.650
55 H GLN 7 H GLN 7 11.836 -17.516 0.026
56 HA GLN 7 HA GLN 7 14.519 -16.910 -0.201
57 HB2 GLN 7 2HB GLN 7 13.225 -19.115 -0.681
58 HB3 GLN 7 3HB GLN 7 13.132 -18.507 -2.329
59 HG2 GLN 7 2HG GLN 7 15.011 -19.858 -2.351
60 HG3 GLN 7 3HG GLN 7 15.674 -18.236 -2.163
61 HE21 GLN 7 1HE2 GLN 7 15.598 -21.359 -0.944
62 HE22 GLN 7 2HE2 GLN 7 16.416 -21.073 0.550
63 H GLY 8 H GLY 8 15.631 -15.474 -1.345
64 HA2 GLY 8 2HA GLY 8 16.181 -13.923 -2.945
65 HA3 GLY 8 3HA GLY 8 15.229 -14.895 -4.057
66 H ASP 9 H ASP 9 13.705 -13.594 -1.238
67 HA ASP 9 HA ASP 9 12.405 -11.545 -2.912
68 HB2 ASP 9 2HB ASP 9 11.245 -13.527 -0.995
69 HB3 ASP 9 3HB ASP 9 10.461 -11.960 -1.177
70 H THR 10 H THR 10 14.739 -11.398 -1.074
71 HA THR 10 HA THR 10 13.925 -10.046 1.297
72 HB THR 10 HB THR 10 16.195 -9.670 1.741
73 HG1 THR 10 HG1 THR 10 16.813 -10.078 -1.010
74 HG21 THR 10 3HG2 THR 10 17.022 -11.787 1.697
75 HG22 THR 10 1HG2 THR 10 16.695 -11.996 -0.023
76 HG23 THR 10 2HG2 THR 10 15.387 -12.157 1.149
77 H LEU 11 H LEU 11 15.047 -7.767 1.666
78 HA LEU 11 HA LEU 11 13.551 -5.858 0.370
79 HB2 LEU 11 2HB LEU 11 16.302 -5.452 1.533
80 HB3 LEU 11 3HB LEU 11 15.086 -4.205 1.264
81 HG LEU 11 HG LEU 11 14.375 -6.472 3.050
82 HD11 LEU 11 1HD1 LEU 11 15.926 -6.098 4.588
83 HD12 LEU 11 2HD1 LEU 11 15.571 -4.371 4.583
84 HD13 LEU 11 3HD1 LEU 11 16.752 -5.031 3.452
85 HD21 LEU 11 3HD2 LEU 11 13.354 -4.484 4.283
86 HD22 LEU 11 1HD2 LEU 11 12.659 -4.911 2.719
87 HD23 LEU 11 2HD2 LEU 11 13.760 -3.540 2.849
88 H ASP 12 H ASP 12 16.811 -6.983 -0.428
89 HA ASP 12 HA ASP 12 17.457 -5.181 -2.429
90 HB2 ASP 12 2HB ASP 12 18.140 -8.114 -2.176
91 HB3 ASP 12 3HB ASP 12 18.872 -7.041 -3.366
92 H ALA 13 H ALA 13 15.380 -8.008 -2.549
93 HA ALA 13 HA ALA 13 15.021 -7.785 -5.422
94 HB1 ALA 13 1HB ALA 13 13.146 -9.595 -4.456
95 HB2 ALA 13 2HB ALA 13 14.718 -9.973 -5.161
96 HB3 ALA 13 3HB ALA 13 14.552 -9.807 -3.413
97 H ILE 14 H ILE 14 12.895 -7.667 -2.558
98 HA ILE 14 HA ILE 14 10.552 -6.899 -3.780
99 HB ILE 14 HB ILE 14 11.568 -5.977 -1.089
100 HG12 ILE 14 2HG1 ILE 14 9.720 -8.278 -1.738
101 HG13 ILE 14 3HG1 ILE 14 11.452 -8.465 -1.488
102 HG21 ILE 14 1HG2 ILE 14 9.176 -5.680 -0.547
103 HG22 ILE 14 2HG2 ILE 14 9.732 -4.590 -1.815
104 HG23 ILE 14 3HG2 ILE 14 8.779 -6.013 -2.233
105 HD11 ILE 14 3HD1 ILE 14 9.499 -7.396 0.536
106 HD12 ILE 14 1HD1 ILE 14 10.168 -9.027 0.508
107 HD13 ILE 14 2HD1 ILE 14 11.227 -7.644 0.784
108 H CYS 15 H CYS 15 13.067 -4.748 -2.461
109 HA CYS 15 HA CYS 15 11.909 -2.314 -3.091
110 HB2 CYS 15 2HB CYS 15 14.806 -3.149 -2.969
111 HB3 CYS 15 3HB CYS 15 14.314 -1.480 -3.230
112 HG CYS 15 HG CYS 15 12.607 -2.154 -0.690
113 H VAL 16 H VAL 16 13.518 -4.609 -5.159
114 HA VAL 16 HA VAL 16 13.677 -2.755 -7.386
115 HB VAL 16 HB VAL 16 14.307 -5.706 -7.235
116 HG11 VAL 16 1HG1 VAL 16 13.851 -5.376 -9.483
117 HG12 VAL 16 2HG1 VAL 16 14.465 -3.721 -9.469
118 HG13 VAL 16 3HG1 VAL 16 15.587 -5.081 -9.398
119 HG21 VAL 16 3HG2 VAL 16 16.595 -5.083 -7.117
120 HG22 VAL 16 1HG2 VAL 16 16.220 -3.391 -7.443
121 HG23 VAL 16 2HG2 VAL 16 15.749 -4.119 -5.907
122 H ARG 17 H ARG 17 11.569 -5.240 -6.193
123 HA ARG 17 HA ARG 17 10.140 -5.508 -8.701
124 HB2 ARG 17 2HB ARG 17 9.158 -7.345 -7.792
125 HB3 ARG 17 3HB ARG 17 10.533 -7.251 -6.700
126 HG2 ARG 17 2HG ARG 17 9.124 -5.978 -5.110
127 HG3 ARG 17 3HG ARG 17 7.749 -6.227 -6.189
128 HD2 ARG 17 2HD ARG 17 9.372 -8.381 -4.837
129 HD3 ARG 17 3HD ARG 17 7.748 -7.864 -4.385
130 HE ARG 17 HE ARG 17 7.582 -8.606 -7.028
131 HH11 ARG 17 1HH1 ARG 17 8.494 -10.128 -4.033
132 HH12 ARG 17 2HH1 ARG 17 7.987 -11.708 -4.530
133 HH21 ARG 17 1HH2 ARG 17 6.910 -10.681 -7.695
134 HH22 ARG 17 2HH2 ARG 17 7.087 -12.022 -6.614
135 H TYR 18 H TYR 18 10.088 -3.443 -6.022
136 HA TYR 18 HA TYR 18 7.295 -2.673 -6.535
137 HB2 TYR 18 2HB TYR 18 8.988 -2.712 -4.122
138 HB3 TYR 18 3HB TYR 18 7.997 -1.269 -4.306
139 HD1 TYR 18 HD2 TYR 18 7.931 -4.927 -3.901
140 HD2 TYR 18 HD1 TYR 18 5.611 -1.365 -4.067
141 HE1 TYR 18 HE2 TYR 18 5.990 -6.157 -3.022
142 HE2 TYR 18 HE1 TYR 18 3.664 -2.584 -3.188
143 HH TYR 18 HH TYR 18 3.804 -5.413 -1.660
144 H TYR 19 H TYR 19 10.344 -1.081 -5.577
145 HA TYR 19 HA TYR 19 9.503 1.335 -6.971
146 HB2 TYR 19 2HB TYR 19 12.080 0.951 -5.455
147 HB3 TYR 19 3HB TYR 19 11.244 2.457 -5.817
148 HD1 TYR 19 HD2 TYR 19 9.122 3.003 -4.619
149 HD2 TYR 19 HD1 TYR 19 11.543 -0.319 -3.520
150 HE1 TYR 19 HE2 TYR 19 7.984 2.900 -2.441
151 HE2 TYR 19 HE1 TYR 19 10.411 -0.431 -1.340
152 HH TYR 19 HH TYR 19 8.902 0.489 0.001
153 H GLY 20 H GLY 20 11.951 -1.185 -7.159
154 HA2 GLY 20 2HA GLY 20 12.945 -1.895 -9.180
155 HA3 GLY 20 3HA GLY 20 12.521 -0.351 -9.904
156 H ARG 21 H ARG 21 14.012 -0.386 -6.782
157 HA ARG 21 HA ARG 21 16.713 -0.227 -7.688
158 HB2 ARG 21 2HB ARG 21 17.128 2.117 -7.229
159 HB3 ARG 21 3HB ARG 21 15.878 1.969 -8.457
160 HG2 ARG 21 2HG ARG 21 14.920 2.152 -5.680
161 HG3 ARG 21 3HG ARG 21 15.707 3.594 -6.324
162 HD2 ARG 21 2HD ARG 21 14.118 2.974 -8.399
163 HD3 ARG 21 3HD ARG 21 13.149 2.323 -7.078
164 HE ARG 21 HE ARG 21 14.086 5.002 -6.620
165 HH11 ARG 21 1HH1 ARG 21 11.581 3.043 -8.036
166 HH12 ARG 21 2HH1 ARG 21 10.384 4.293 -7.969
167 HH21 ARG 21 1HH2 ARG 21 12.519 6.657 -6.526
168 HH22 ARG 21 2HH2 ARG 21 10.919 6.349 -7.111
169 H THR 22 H THR 22 18.203 0.389 -5.893
170 HA THR 22 HA THR 22 17.010 -0.266 -3.277
171 HB THR 22 HB THR 22 19.485 -1.095 -2.838
172 HG1 THR 22 HG1 THR 22 20.008 -2.242 -4.970
173 HG21 THR 22 3HG2 THR 22 17.030 -2.341 -3.590
174 HG22 THR 22 1HG2 THR 22 18.321 -2.975 -2.570
175 HG23 THR 22 2HG2 THR 22 18.365 -3.238 -4.313
176 H GLU 23 H GLU 23 19.336 1.658 -5.049
177 HA GLU 23 HA GLU 23 20.613 2.880 -2.856
178 HB2 GLU 23 2HB GLU 23 21.450 2.928 -5.200
179 HB3 GLU 23 3HB GLU 23 20.153 4.043 -5.608
180 HG2 GLU 23 2HG GLU 23 21.090 5.572 -3.824
181 HG3 GLU 23 3HG GLU 23 22.496 4.510 -3.793
182 H GLY 24 H GLY 24 19.634 4.019 -1.320
183 HA2 GLY 24 2HA GLY 24 18.596 6.001 -0.554
184 HA3 GLY 24 3HA GLY 24 17.804 6.161 -2.114
185 H VAL 25 H VAL 25 17.039 3.245 -1.962
186 HA VAL 25 HA VAL 25 14.582 3.681 -0.457
187 HB VAL 25 HB VAL 25 15.309 1.322 -2.196
188 HG11 VAL 25 1HG1 VAL 25 13.228 0.533 -1.862
189 HG12 VAL 25 2HG1 VAL 25 13.295 1.513 -0.396
190 HG13 VAL 25 3HG1 VAL 25 12.508 2.143 -1.844
191 HG21 VAL 25 3HG2 VAL 25 15.407 3.344 -3.526
192 HG22 VAL 25 1HG2 VAL 25 13.957 2.428 -3.938
193 HG23 VAL 25 2HG2 VAL 25 13.836 3.857 -2.911
194 H VAL 26 H VAL 26 17.281 1.387 -0.592
195 HA VAL 26 HA VAL 26 16.432 -0.426 1.332
196 HB VAL 26 HB VAL 26 18.815 -0.952 1.696
197 HG11 VAL 26 1HG1 VAL 26 17.833 -0.582 -1.118
198 HG12 VAL 26 2HG1 VAL 26 19.366 -1.378 -0.757
199 HG13 VAL 26 3HG1 VAL 26 17.856 -2.051 -0.143
200 HG21 VAL 26 3HG2 VAL 26 20.170 0.556 -0.178
201 HG22 VAL 26 1HG2 VAL 26 19.137 1.733 0.632
202 HG23 VAL 26 2HG2 VAL 26 20.257 0.749 1.573
203 H GLU 27 H GLU 27 17.784 2.771 1.700
204 HA GLU 27 HA GLU 27 18.361 2.518 4.493
205 HB2 GLU 27 2HB GLU 27 18.119 4.913 2.672
206 HB3 GLU 27 3HB GLU 27 18.543 5.035 4.374
207 HG2 GLU 27 2HG GLU 27 20.096 3.484 2.316
208 HG3 GLU 27 3HG GLU 27 20.496 5.104 2.884
209 H THR 28 H THR 28 15.581 3.350 2.600
210 HA THR 28 HA THR 28 14.139 4.692 4.668
211 HB THR 28 HB THR 28 12.705 3.311 2.442
212 HG1 THR 28 HG1 THR 28 13.354 5.375 1.242
213 HG21 THR 28 3HG2 THR 28 12.499 6.056 3.687
214 HG22 THR 28 1HG2 THR 28 11.452 4.678 4.026
215 HG23 THR 28 2HG2 THR 28 11.440 5.423 2.427
216 H VAL 29 H VAL 29 13.507 1.539 3.114
217 HA VAL 29 HA VAL 29 11.661 0.600 4.956
218 HB VAL 29 HB VAL 29 13.654 -1.115 3.471
219 HG11 VAL 29 1HG1 VAL 29 12.592 -2.623 4.804
220 HG12 VAL 29 2HG1 VAL 29 11.138 -1.634 4.956
221 HG13 VAL 29 3HG1 VAL 29 11.426 -2.560 3.482
222 HG21 VAL 29 3HG2 VAL 29 12.759 -0.312 1.596
223 HG22 VAL 29 1HG2 VAL 29 11.253 -1.098 2.070
224 HG23 VAL 29 2HG2 VAL 29 11.536 0.592 2.489
225 H LEU 30 H LEU 30 15.181 0.447 5.029
226 HA LEU 30 HA LEU 30 15.516 -1.337 7.144
227 HB2 LEU 30 2HB LEU 30 17.126 0.843 5.943
228 HB3 LEU 30 3HB LEU 30 17.613 0.262 7.534
229 HG LEU 30 HG LEU 30 17.358 -1.443 5.057
230 HD11 LEU 30 1HD1 LEU 30 19.987 -1.157 6.258
231 HD12 LEU 30 2HD1 LEU 30 19.344 0.371 5.657
232 HD13 LEU 30 3HD1 LEU 30 19.488 -1.012 4.572
233 HD21 LEU 30 3HD2 LEU 30 18.206 -2.033 7.881
234 HD22 LEU 30 1HD2 LEU 30 18.643 -3.063 6.518
235 HD23 LEU 30 2HD2 LEU 30 16.945 -2.818 6.929
236 H ALA 31 H ALA 31 15.257 2.211 7.221
237 HA ALA 31 HA ALA 31 15.494 2.543 9.984
238 HB1 ALA 31 1HB ALA 31 13.749 4.281 8.267
239 HB2 ALA 31 2HB ALA 31 14.714 4.732 9.673
240 HB3 ALA 31 3HB ALA 31 15.509 4.319 8.153
241 H ALA 32 H ALA 32 12.825 1.455 8.050
242 HA ALA 32 HA ALA 32 10.897 1.796 10.196
243 HB1 ALA 32 1HB ALA 32 10.790 1.231 7.332
244 HB2 ALA 32 2HB ALA 32 9.633 0.301 8.285
245 HB3 ALA 32 3HB ALA 32 9.632 2.062 8.370
246 H ASN 33 H ASN 33 12.960 -0.660 8.892
247 HA ASN 33 HA ASN 33 11.852 -2.572 10.835
248 HB2 ASN 33 2HB ASN 33 12.394 -2.938 7.931
249 HB3 ASN 33 3HB ASN 33 12.774 -4.284 9.001
250 HD21 ASN 33 1HD2 ASN 33 10.179 -1.959 8.352
251 HD22 ASN 33 2HD2 ASN 33 8.885 -3.081 8.578
252 HA PRO 34 HA PRO 34 16.392 -1.893 11.536
253 HB2 PRO 34 2HB PRO 34 16.175 -1.644 14.231
254 HB3 PRO 34 3HB PRO 34 15.981 -0.282 13.122
255 HG2 PRO 34 2HG PRO 34 13.885 -1.948 14.461
256 HG3 PRO 34 3HG PRO 34 13.943 -0.190 14.238
257 HD2 PRO 34 2HD PRO 34 12.452 -1.810 12.662
258 HD3 PRO 34 3HD PRO 34 13.198 -0.315 12.060
259 H GLY 35 H GLY 35 17.506 -3.739 11.489
260 HA2 GLY 35 2HA GLY 35 18.219 -5.530 13.166
261 HA3 GLY 35 3HA GLY 35 16.530 -6.010 13.096
262 H LEU 36 H LEU 36 16.639 -5.209 10.132
263 HA LEU 36 HA LEU 36 17.297 -7.848 9.185
264 HB2 LEU 36 2HB LEU 36 15.405 -6.169 8.441
265 HB3 LEU 36 3HB LEU 36 16.658 -5.601 7.339
266 HG LEU 36 HG LEU 36 15.236 -7.164 6.193
267 HD11 LEU 36 1HD1 LEU 36 17.640 -8.831 6.734
268 HD12 LEU 36 2HD1 LEU 36 17.861 -7.217 6.059
269 HD13 LEU 36 3HD1 LEU 36 16.880 -8.404 5.201
270 HD21 LEU 36 3HD2 LEU 36 15.758 -9.636 7.389
271 HD22 LEU 36 1HD2 LEU 36 14.223 -8.768 7.346
272 HD23 LEU 36 2HD2 LEU 36 15.319 -8.554 8.711
273 H ALA 37 H ALA 37 18.596 -4.584 8.829
274 HA ALA 37 HA ALA 37 20.501 -5.057 6.859
275 HB1 ALA 37 1HB ALA 37 19.855 -2.960 8.647
276 HB2 ALA 37 2HB ALA 37 21.593 -3.239 8.754
277 HB3 ALA 37 3HB ALA 37 20.851 -2.893 7.193
278 H GLU 38 H GLU 38 20.731 -5.475 10.372
279 HA GLU 38 HA GLU 38 23.442 -6.502 10.138
280 HB2 GLU 38 2HB GLU 38 23.342 -6.662 12.605
281 HB3 GLU 38 3HB GLU 38 22.976 -5.047 12.014
282 HG2 GLU 38 2HG GLU 38 20.658 -6.816 12.404
283 HG3 GLU 38 3HG GLU 38 21.522 -6.344 13.867
284 H LEU 39 H LEU 39 20.690 -7.818 9.334
285 HA LEU 39 HA LEU 39 20.730 -10.267 10.850
286 HB2 LEU 39 2HB LEU 39 18.681 -9.198 9.840
287 HB3 LEU 39 3HB LEU 39 19.278 -9.728 8.269
288 HG LEU 39 HG LEU 39 19.080 -12.051 8.951
289 HD11 LEU 39 1HD1 LEU 39 19.495 -12.190 11.209
290 HD12 LEU 39 2HD1 LEU 39 17.743 -12.383 11.164
291 HD13 LEU 39 3HD1 LEU 39 18.447 -10.825 11.596
292 HD21 LEU 39 3HD2 LEU 39 17.125 -11.422 7.923
293 HD22 LEU 39 1HD2 LEU 39 16.725 -10.236 9.166
294 HD23 LEU 39 2HD2 LEU 39 16.518 -11.957 9.491
295 H GLY 40 H GLY 40 21.520 -9.325 7.509
296 HA2 GLY 40 2HA GLY 40 23.780 -10.541 6.968
297 HA3 GLY 40 3HA GLY 40 22.741 -11.953 7.076
298 H ALA 41 H ALA 41 23.469 -12.272 4.834
299 HA ALA 41 HA ALA 41 22.813 -10.502 2.751
300 HB1 ALA 41 1HB ALA 41 23.046 -13.503 2.581
301 HB2 ALA 41 2HB ALA 41 23.216 -12.347 1.258
302 HB3 ALA 41 3HB ALA 41 24.410 -12.385 2.556
303 H VAL 42 H VAL 42 21.221 -13.628 3.398
304 HA VAL 42 HA VAL 42 18.751 -12.527 2.262
305 HB VAL 42 HB VAL 42 19.334 -15.415 2.917
306 HG11 VAL 42 1HG1 VAL 42 17.119 -15.524 2.569
307 HG12 VAL 42 2HG1 VAL 42 17.064 -13.946 1.781
308 HG13 VAL 42 3HG1 VAL 42 17.546 -15.375 0.865
309 HG21 VAL 42 3HG2 VAL 42 19.646 -14.001 0.269
310 HG22 VAL 42 1HG2 VAL 42 20.966 -14.562 1.295
311 HG23 VAL 42 2HG2 VAL 42 19.864 -15.727 0.562
312 H LEU 43 H LEU 43 16.743 -12.796 3.316
313 HA LEU 43 HA LEU 43 16.983 -12.949 6.236
314 HB2 LEU 43 2HB LEU 43 14.576 -11.972 6.023
315 HB3 LEU 43 3HB LEU 43 15.985 -10.937 5.801
316 HG LEU 43 HG LEU 43 15.711 -11.080 3.375
317 HD11 LEU 43 1HD1 LEU 43 13.391 -12.851 4.094
318 HD12 LEU 43 2HD1 LEU 43 14.761 -13.216 3.045
319 HD13 LEU 43 3HD1 LEU 43 13.540 -12.053 2.528
320 HD21 LEU 43 3HD2 LEU 43 13.018 -10.354 4.447
321 HD22 LEU 43 1HD2 LEU 43 14.000 -9.537 3.231
322 HD23 LEU 43 2HD2 LEU 43 14.441 -9.433 4.936
323 HA PRO 44 HA PRO 44 14.663 -16.657 6.572
324 HB2 PRO 44 2HB PRO 44 13.148 -16.187 8.776
325 HB3 PRO 44 3HB PRO 44 14.890 -16.476 8.851
326 HG2 PRO 44 2HG PRO 44 13.395 -13.883 8.926
327 HG3 PRO 44 3HG PRO 44 14.776 -14.407 9.907
328 HD2 PRO 44 2HD PRO 44 15.044 -12.758 7.776
329 HD3 PRO 44 3HD PRO 44 16.300 -13.921 8.247
330 H HIS 45 H HIS 45 12.848 -17.530 5.737
331 HA HIS 45 HA HIS 45 10.945 -15.919 4.429
332 HB2 HIS 45 2HB HIS 45 9.844 -17.959 3.828
333 HB3 HIS 45 3HB HIS 45 11.577 -18.274 3.805
334 HD1 HIS 45 HD1 HIS 45 8.573 -19.789 4.870
335 HD2 HIS 45 HD2 HIS 45 12.364 -19.421 6.528
336 HE1 HIS 45 HE1 HIS 45 8.733 -21.613 6.593
337 H GLY 46 H GLY 46 8.969 -15.181 4.998
338 HA2 GLY 46 2HA GLY 46 6.923 -15.445 6.291
339 HA3 GLY 46 3HA GLY 46 7.915 -16.010 7.628
340 H THR 47 H THR 47 9.931 -14.044 7.520
341 HA THR 47 HA THR 47 8.895 -12.065 9.155
342 HB THR 47 HB THR 47 11.351 -11.914 7.397
343 HG1 THR 47 HG1 THR 47 11.052 -13.589 9.174
344 HG21 THR 47 3HG2 THR 47 10.418 -10.190 9.685
345 HG22 THR 47 1HG2 THR 47 10.836 -9.688 8.047
346 HG23 THR 47 2HG2 THR 47 12.097 -10.246 9.148
347 H ALA 48 H ALA 48 7.523 -10.471 8.748
348 HA ALA 48 HA ALA 48 6.904 -9.657 6.067
349 HB1 ALA 48 1HB ALA 48 5.548 -9.649 8.472
350 HB2 ALA 48 2HB ALA 48 5.841 -7.939 8.151
351 HB3 ALA 48 3HB ALA 48 4.997 -8.928 6.960
352 H VAL 49 H VAL 49 7.253 -7.660 5.107
353 HA VAL 49 HA VAL 49 9.208 -5.912 6.455
354 HB VAL 49 HB VAL 49 9.109 -6.442 3.485
355 HG11 VAL 49 1HG1 VAL 49 11.554 -5.386 4.685
356 HG12 VAL 49 2HG1 VAL 49 10.679 -4.864 3.244
357 HG13 VAL 49 3HG1 VAL 49 10.166 -4.310 4.838
358 HG21 VAL 49 3HG2 VAL 49 11.298 -7.639 3.939
359 HG22 VAL 49 1HG2 VAL 49 10.830 -7.643 5.639
360 HG23 VAL 49 2HG2 VAL 49 9.831 -8.476 4.448
361 H GLU 50 H GLU 50 8.713 -3.808 6.545
362 HA GLU 50 HA GLU 50 6.178 -2.934 5.465
363 HB2 GLU 50 2HB GLU 50 6.687 -2.228 7.696
364 HB3 GLU 50 3HB GLU 50 8.245 -1.583 7.198
365 HG2 GLU 50 2HG GLU 50 7.118 0.137 5.885
366 HG3 GLU 50 3HG GLU 50 5.555 -0.509 6.380
367 H LEU 51 H LEU 51 5.873 -1.780 3.671
368 HA LEU 51 HA LEU 51 8.250 -0.775 2.260
369 HB2 LEU 51 2HB LEU 51 5.649 -1.910 1.365
370 HB3 LEU 51 3HB LEU 51 6.439 -0.717 0.336
371 HG LEU 51 HG LEU 51 8.452 -2.189 0.290
372 HD11 LEU 51 1HD1 LEU 51 7.915 -3.393 2.400
373 HD12 LEU 51 2HD1 LEU 51 8.311 -4.454 1.049
374 HD13 LEU 51 3HD1 LEU 51 6.630 -4.239 1.537
375 HD21 LEU 51 3HD2 LEU 51 7.672 -3.175 -1.567
376 HD22 LEU 51 1HD2 LEU 51 6.190 -2.283 -1.220
377 HD23 LEU 51 2HD2 LEU 51 6.346 -3.965 -0.711
378 HA PRO 52 HA PRO 52 6.289 3.125 3.577
379 HB2 PRO 52 2HB PRO 52 8.598 4.550 3.485
380 HB3 PRO 52 3HB PRO 52 8.137 3.556 4.872
381 HG2 PRO 52 2HG PRO 52 10.018 2.925 2.630
382 HG3 PRO 52 3HG PRO 52 10.203 2.615 4.366
383 HD2 PRO 52 2HD PRO 52 9.445 0.693 2.616
384 HD3 PRO 52 3HD PRO 52 8.879 0.729 4.298
385 H ASP 53 H ASP 53 5.665 4.883 2.374
386 HA ASP 53 HA ASP 53 5.258 6.163 0.538
387 HB2 ASP 53 2HB ASP 53 7.958 5.327 -0.514
388 HB3 ASP 53 3HB ASP 53 7.082 6.822 -0.831
389 H VAL 54 H VAL 54 3.932 3.936 0.368
390 HA VAL 54 HA VAL 54 4.076 3.237 -2.461
391 HB VAL 54 HB VAL 54 4.091 1.180 -0.251
392 HG11 VAL 54 1HG1 VAL 54 3.387 0.961 -3.154
393 HG12 VAL 54 2HG1 VAL 54 4.082 -0.410 -2.287
394 HG13 VAL 54 3HG1 VAL 54 2.555 0.292 -1.751
395 HG21 VAL 54 3HG2 VAL 54 5.989 1.700 -2.539
396 HG22 VAL 54 1HG2 VAL 54 6.295 2.021 -0.832
397 HG23 VAL 54 2HG2 VAL 54 6.107 0.361 -1.397
398 H GLN 55 H GLN 55 2.110 2.739 -3.373
399 HA GLN 55 HA GLN 55 -0.150 2.673 -3.621
400 HB2 GLN 55 2HB GLN 55 0.231 0.824 -1.836
401 HB3 GLN 55 3HB GLN 55 -0.445 1.995 -0.711
402 HG2 GLN 55 2HG GLN 55 -2.536 1.799 -1.543
403 HG3 GLN 55 3HG GLN 55 -1.975 1.507 -3.188
404 HE21 GLN 55 1HE2 GLN 55 -3.796 0.137 -1.064
405 HE22 GLN 55 2HE2 GLN 55 -3.369 -1.529 -1.224
406 H THR 56 H THR 56 0.996 5.147 -3.119
407 HA THR 56 HA THR 56 -1.042 6.475 -1.453
408 HB THR 56 HB THR 56 0.519 8.299 -1.088
409 HG1 THR 56 HG1 THR 56 1.774 8.342 -2.900
410 HG21 THR 56 3HG2 THR 56 0.655 6.547 0.536
411 HG22 THR 56 1HG2 THR 56 2.301 7.060 0.170
412 HG23 THR 56 2HG2 THR 56 1.668 5.568 -0.524
413 H ALA 57 H ALA 57 -0.947 9.005 -2.211
414 HA ALA 57 HA ALA 57 -2.423 9.157 -4.543
415 HB1 ALA 57 1HB ALA 57 -1.118 11.065 -2.752
416 HB2 ALA 57 2HB ALA 57 -1.318 11.649 -4.405
417 HB3 ALA 57 3HB ALA 57 -2.722 11.107 -3.485
418 HA PRO 58 HA PRO 58 0.334 9.058 -7.955
419 HB2 PRO 58 2HB PRO 58 -0.700 10.955 -9.598
420 HB3 PRO 58 3HB PRO 58 -1.486 9.398 -9.314
421 HG2 PRO 58 2HG PRO 58 -2.070 12.065 -8.087
422 HG3 PRO 58 3HG PRO 58 -3.201 10.837 -8.686
423 HD2 PRO 58 2HD PRO 58 -2.639 11.142 -6.054
424 HD3 PRO 58 3HD PRO 58 -3.029 9.565 -6.771
425 H VAL 59 H VAL 59 2.267 9.791 -6.996
426 HA VAL 59 HA VAL 59 2.863 12.642 -7.459
427 HB VAL 59 HB VAL 59 4.638 12.344 -5.675
428 HG11 VAL 59 1HG1 VAL 59 2.128 13.241 -5.498
429 HG12 VAL 59 2HG1 VAL 59 2.032 11.908 -4.344
430 HG13 VAL 59 3HG1 VAL 59 3.224 13.189 -4.118
431 HG21 VAL 59 3HG2 VAL 59 4.653 10.511 -4.262
432 HG22 VAL 59 1HG2 VAL 59 3.011 10.036 -4.694
433 HG23 VAL 59 2HG2 VAL 59 4.335 9.766 -5.829
434 H ALA 60 H ALA 60 3.344 11.669 -9.662
435 HA ALA 60 HA ALA 60 6.114 11.607 -10.074
436 HB1 ALA 60 1HB ALA 60 5.662 9.029 -11.032
437 HB2 ALA 60 2HB ALA 60 6.650 9.493 -9.646
438 HB3 ALA 60 3HB ALA 60 4.959 9.049 -9.414
439 H GLU 61 H GLU 61 6.583 11.979 -12.186
440 HA GLU 61 HA GLU 61 4.304 12.043 -14.030
441 HB2 GLU 61 2HB GLU 61 5.869 14.070 -13.486
442 HB3 GLU 61 3HB GLU 61 6.962 13.292 -14.622
443 HG2 GLU 61 2HG GLU 61 4.138 13.750 -15.434
444 HG3 GLU 61 3HG GLU 61 5.255 15.114 -15.410
445 H THR 62 H THR 62 4.850 9.560 -13.921
446 HA THR 62 HA THR 62 6.377 8.984 -16.353
447 HB THR 62 HB THR 62 7.261 6.885 -15.221
448 HG1 THR 62 HG1 THR 62 6.592 6.609 -13.238
449 HG21 THR 62 3HG2 THR 62 8.351 9.403 -13.991
450 HG22 THR 62 1HG2 THR 62 8.545 9.044 -15.706
451 HG23 THR 62 2HG2 THR 62 9.225 7.957 -14.495
452 H VAL 63 H VAL 63 6.071 6.483 -16.826
453 HA VAL 63 HA VAL 63 3.573 5.351 -16.004
454 HB VAL 63 HB VAL 63 2.669 6.985 -17.549
455 HG11 VAL 63 1HG1 VAL 63 3.700 5.997 -20.033
456 HG12 VAL 63 2HG1 VAL 63 3.737 7.637 -19.384
457 HG13 VAL 63 3HG1 VAL 63 5.031 6.503 -18.993
458 HG21 VAL 63 3HG2 VAL 63 2.652 4.294 -18.904
459 HG22 VAL 63 1HG2 VAL 63 1.728 4.665 -17.448
460 HG23 VAL 63 2HG2 VAL 63 1.395 5.530 -18.948
461 H ASN 64 H ASN 64 3.660 3.199 -16.215
462 HA ASN 64 HA ASN 64 5.736 2.081 -17.982
463 HB2 ASN 64 2HB ASN 64 4.703 1.131 -15.309
464 HB3 ASN 64 3HB ASN 64 5.663 0.107 -16.373
465 HD21 ASN 64 1HD2 ASN 64 7.682 1.358 -17.230
466 HD22 ASN 64 2HD2 ASN 64 8.614 2.136 -16.000
467 H LEU 65 H LEU 65 5.256 -0.261 -18.595
468 HA LEU 65 HA LEU 65 2.591 -1.197 -18.681
469 HB2 LEU 65 2HB LEU 65 2.060 -0.854 -21.001
470 HB3 LEU 65 3HB LEU 65 2.347 0.701 -20.224
471 HG LEU 65 HG LEU 65 4.780 0.311 -21.232
472 HD11 LEU 65 1HD1 LEU 65 3.604 -1.902 -22.225
473 HD12 LEU 65 2HD1 LEU 65 4.950 -1.069 -23.002
474 HD13 LEU 65 3HD1 LEU 65 3.297 -0.763 -23.536
475 HD21 LEU 65 3HD2 LEU 65 4.239 2.100 -22.449
476 HD22 LEU 65 1HD2 LEU 65 2.617 1.930 -21.778
477 HD23 LEU 65 2HD2 LEU 65 3.001 1.218 -23.345
478 H TRP 66 H TRP 66 2.403 -3.232 -19.704
479 HA TRP 66 HA TRP 66 4.979 -4.421 -20.501
480 HB2 TRP 66 2HB TRP 66 2.707 -5.848 -19.105
481 HB3 TRP 66 3HB TRP 66 4.301 -6.501 -19.475
482 HD1 TRP 66 HD1 TRP 66 6.380 -4.908 -18.224
483 HE1 TRP 66 HE1 TRP 66 6.430 -4.181 -15.755
484 HE3 TRP 66 HE3 TRP 66 1.406 -5.376 -17.139
485 HZ2 TRP 66 HZ2 TRP 66 4.603 -3.851 -13.629
486 HZ3 TRP 66 HZ3 TRP 66 0.639 -4.835 -14.864
487 HH2 TRP 66 HH2 TRP 66 2.206 -4.089 -13.147
488 H GLU 67 H GLU 67 4.781 -6.330 -21.927
489 HA GLU 67 HA GLU 67 2.324 -6.569 -23.447
490 HB2 GLU 67 2HB GLU 67 3.332 -4.731 -24.620
491 HB3 GLU 67 3HB GLU 67 4.887 -5.548 -24.672
492 HG2 GLU 67 2HG GLU 67 4.196 -7.037 -26.310
493 HG3 GLU 67 3HG GLU 67 2.487 -6.761 -25.976
494 H VAL 68 H VAL 68 2.084 -8.708 -23.258
495 HA VAL 68 HA VAL 68 4.408 -10.434 -23.797
496 HB VAL 68 HB VAL 68 3.166 -12.220 -22.634
497 HG11 VAL 68 1HG1 VAL 68 3.925 -11.583 -20.600
498 HG12 VAL 68 2HG1 VAL 68 4.616 -10.251 -21.529
499 HG13 VAL 68 3HG1 VAL 68 3.099 -10.026 -20.658
500 HG21 VAL 68 3HG2 VAL 68 0.958 -12.026 -22.435
501 HG22 VAL 68 1HG2 VAL 68 1.240 -10.817 -21.182
502 HG23 VAL 68 2HG2 VAL 68 1.013 -10.314 -22.857
503 H GLU 69 H GLU 69 1.200 -9.593 -24.806
504 HA GLU 69 HA GLU 69 0.710 -11.898 -26.407
505 HB2 GLU 69 2HB GLU 69 -0.511 -9.145 -26.328
506 HB3 GLU 69 3HB GLU 69 -1.027 -10.364 -27.485
507 HG2 GLU 69 2HG GLU 69 -1.018 -10.871 -24.530
508 HG3 GLU 69 3HG GLU 69 -2.386 -10.129 -25.358
509 H HIS 70 H HIS 70 2.672 -12.126 -27.588
510 HA HIS 70 HA HIS 70 3.469 -10.066 -29.444
511 HB2 HIS 70 2HB HIS 70 4.491 -12.749 -28.652
512 HB3 HIS 70 3HB HIS 70 4.944 -12.141 -30.242
513 HD1 HIS 70 HD1 HIS 70 6.036 -9.601 -30.129
514 HD2 HIS 70 HD2 HIS 70 6.136 -11.911 -26.678
515 HE1 HIS 70 HE1 HIS 70 7.810 -8.566 -28.678
516 H HIS 71 H HIS 71 2.625 -9.774 -31.390
517 HA HIS 71 HA HIS 71 1.393 -10.092 -33.281
518 HB2 HIS 71 2HB HIS 71 3.467 -11.678 -33.512
519 HB3 HIS 71 3HB HIS 71 2.272 -12.958 -33.324
520 HD1 HIS 71 HD1 HIS 71 1.220 -13.724 -35.427
521 HD2 HIS 71 HD2 HIS 71 2.738 -9.872 -35.771
522 HE1 HIS 71 HE1 HIS 71 0.875 -13.078 -37.832
Start of MODEL 6
1 H1 MET 1 H MET 1 7.729 0.580 -8.744
2 HA MET 1 HA MET 1 9.774 1.673 -10.313
3 HB2 MET 1 2HB MET 1 9.698 3.575 -8.811
4 HB3 MET 1 3HB MET 1 9.822 2.517 -7.411
5 HG2 MET 1 2HG MET 1 11.946 3.540 -7.804
6 HG3 MET 1 3HG MET 1 12.061 1.822 -8.180
7 HE1 MET 1 3HE MET 1 13.364 5.235 -10.521
8 HE2 MET 1 1HE MET 1 13.154 4.917 -8.799
9 HE3 MET 1 2HE MET 1 14.408 4.071 -9.705
10 H LYS 2 H LYS 2 11.302 0.161 -10.548
11 HA LYS 2 HA LYS 2 11.758 -1.755 -8.373
12 HB2 LYS 2 2HB LYS 2 10.925 -2.360 -11.187
13 HB3 LYS 2 3HB LYS 2 11.953 -3.495 -10.322
14 HG2 LYS 2 2HG LYS 2 10.308 -3.901 -8.690
15 HG3 LYS 2 3HG LYS 2 9.353 -2.505 -9.194
16 HD2 LYS 2 2HD LYS 2 8.338 -3.651 -10.837
17 HD3 LYS 2 3HD LYS 2 9.833 -4.451 -11.327
18 HE2 LYS 2 2HE LYS 2 8.110 -5.210 -8.970
19 HE3 LYS 2 3HE LYS 2 8.173 -6.056 -10.515
20 HZ1 LYS 2 3HZ LYS 2 10.785 -5.833 -9.577
21 HZ2 LYS 2 1HZ LYS 2 9.853 -7.237 -9.730
22 HZ3 LYS 2 2HZ LYS 2 9.844 -6.371 -8.278
23 H THR 3 H THR 3 13.807 -2.776 -8.404
24 HA THR 3 HA THR 3 15.749 -2.112 -10.416
25 HB THR 3 HB THR 3 15.851 -0.026 -9.206
26 HG1 THR 3 HG1 THR 3 17.902 -0.407 -9.671
27 HG21 THR 3 3HG2 THR 3 14.874 -0.956 -7.081
28 HG22 THR 3 1HG2 THR 3 16.231 0.148 -6.857
29 HG23 THR 3 2HG2 THR 3 16.475 -1.593 -6.707
30 H PHE 4 H PHE 4 17.733 -3.243 -10.156
31 HA PHE 4 HA PHE 4 17.437 -5.736 -8.774
32 HB2 PHE 4 2HB PHE 4 19.941 -4.720 -10.116
33 HB3 PHE 4 3HB PHE 4 19.464 -6.393 -9.841
34 HD1 PHE 4 HD2 PHE 4 16.818 -6.640 -10.814
35 HD2 PHE 4 HD1 PHE 4 19.990 -4.257 -12.356
36 HE1 PHE 4 HE2 PHE 4 15.783 -6.711 -13.045
37 HE2 PHE 4 HE1 PHE 4 18.959 -4.323 -14.589
38 HZ PHE 4 HZ PHE 4 16.854 -5.552 -14.936
39 H ALA 5 H ALA 5 18.354 -6.408 -6.911
40 HA ALA 5 HA ALA 5 19.634 -4.385 -5.256
41 HB1 ALA 5 1HB ALA 5 18.963 -7.187 -4.407
42 HB2 ALA 5 2HB ALA 5 19.139 -5.744 -3.408
43 HB3 ALA 5 3HB ALA 5 17.747 -5.911 -4.477
44 H LEU 6 H LEU 6 21.767 -4.170 -5.408
45 HA LEU 6 HA LEU 6 23.406 -6.559 -5.905
46 HB2 LEU 6 2HB LEU 6 24.433 -3.756 -6.067
47 HB3 LEU 6 3HB LEU 6 25.020 -5.205 -6.881
48 HG LEU 6 HG LEU 6 22.490 -3.700 -7.549
49 HD11 LEU 6 1HD1 LEU 6 23.656 -2.508 -9.021
50 HD12 LEU 6 2HD1 LEU 6 24.524 -3.928 -9.601
51 HD13 LEU 6 3HD1 LEU 6 25.104 -3.062 -8.179
52 HD21 LEU 6 3HD2 LEU 6 22.442 -6.190 -7.907
53 HD22 LEU 6 1HD2 LEU 6 23.764 -5.974 -9.054
54 HD23 LEU 6 2HD2 LEU 6 22.203 -5.212 -9.356
55 H GLN 7 H GLN 7 25.808 -5.945 -4.987
56 HA GLN 7 HA GLN 7 25.746 -6.464 -2.281
57 HB2 GLN 7 2HB GLN 7 27.707 -6.444 -4.069
58 HB3 GLN 7 3HB GLN 7 28.034 -4.875 -3.344
59 HG2 GLN 7 2HG GLN 7 28.467 -5.812 -1.241
60 HG3 GLN 7 3HG GLN 7 27.737 -7.354 -1.686
61 HE21 GLN 7 1HE2 GLN 7 30.065 -7.641 -0.602
62 HE22 GLN 7 2HE2 GLN 7 31.315 -7.946 -1.754
63 H GLY 8 H GLY 8 25.218 -5.305 -0.554
64 HA2 GLY 8 2HA GLY 8 24.873 -3.514 0.844
65 HA3 GLY 8 3HA GLY 8 26.021 -2.622 -0.143
66 H ASP 9 H ASP 9 23.290 -3.982 -1.734
67 HA ASP 9 HA ASP 9 21.964 -1.352 -1.738
68 HB2 ASP 9 2HB ASP 9 22.668 -3.143 -4.040
69 HB3 ASP 9 3HB ASP 9 21.269 -2.079 -4.150
70 H THR 10 H THR 10 21.505 -3.888 -0.222
71 HA THR 10 HA THR 10 19.148 -5.110 -1.258
72 HB THR 10 HB THR 10 19.014 -6.318 0.781
73 HG1 THR 10 HG1 THR 10 20.972 -4.762 2.063
74 HG21 THR 10 3HG2 THR 10 20.936 -6.915 -0.621
75 HG22 THR 10 1HG2 THR 10 21.290 -7.161 1.089
76 HG23 THR 10 2HG2 THR 10 21.933 -5.750 0.249
77 H LEU 11 H LEU 11 17.211 -5.222 0.457
78 HA LEU 11 HA LEU 11 15.757 -2.901 0.220
79 HB2 LEU 11 2HB LEU 11 15.455 -4.838 2.503
80 HB3 LEU 11 3HB LEU 11 14.210 -3.815 1.790
81 HG LEU 11 HG LEU 11 15.526 -6.197 0.485
82 HD11 LEU 11 1HD1 LEU 11 12.741 -5.782 1.560
83 HD12 LEU 11 2HD1 LEU 11 13.980 -6.840 2.234
84 HD13 LEU 11 3HD1 LEU 11 13.287 -7.192 0.651
85 HD21 LEU 11 3HD2 LEU 11 14.915 -5.260 -1.438
86 HD22 LEU 11 1HD2 LEU 11 14.063 -3.955 -0.611
87 HD23 LEU 11 2HD2 LEU 11 13.242 -5.484 -0.924
88 H ASP 12 H ASP 12 17.713 -3.958 2.985
89 HA ASP 12 HA ASP 12 17.119 -1.913 4.761
90 HB2 ASP 12 2HB ASP 12 19.584 -3.582 4.336
91 HB3 ASP 12 3HB ASP 12 19.544 -2.331 5.576
92 H ALA 13 H ALA 13 19.239 -1.919 1.978
93 HA ALA 13 HA ALA 13 20.329 0.696 2.616
94 HB1 ALA 13 1HB ALA 13 21.798 -0.951 1.606
95 HB2 ALA 13 2HB ALA 13 20.734 -1.070 0.204
96 HB3 ALA 13 3HB ALA 13 21.598 0.432 0.530
97 H ILE 14 H ILE 14 18.516 -0.700 -0.126
98 HA ILE 14 HA ILE 14 17.958 1.619 -1.498
99 HB ILE 14 HB ILE 14 16.136 -0.768 -1.170
100 HG12 ILE 14 2HG1 ILE 14 18.041 -0.170 -3.433
101 HG13 ILE 14 3HG1 ILE 14 18.497 -1.149 -2.043
102 HG21 ILE 14 1HG2 ILE 14 14.925 1.153 -2.032
103 HG22 ILE 14 2HG2 ILE 14 16.158 1.397 -3.268
104 HG23 ILE 14 3HG2 ILE 14 15.151 -0.050 -3.302
105 HD11 ILE 14 3HD1 ILE 14 16.708 -2.726 -2.579
106 HD12 ILE 14 1HD1 ILE 14 16.279 -1.750 -3.984
107 HD13 ILE 14 2HD1 ILE 14 17.852 -2.545 -3.909
108 H CYS 15 H CYS 15 16.144 0.194 1.194
109 HA CYS 15 HA CYS 15 14.006 1.997 1.215
110 HB2 CYS 15 2HB CYS 15 15.277 0.315 3.365
111 HB3 CYS 15 3HB CYS 15 13.903 1.360 3.708
112 HG CYS 15 HG CYS 15 12.756 -1.078 3.453
113 H VAL 16 H VAL 16 17.256 2.257 2.464
114 HA VAL 16 HA VAL 16 16.674 4.688 3.938
115 HB VAL 16 HB VAL 16 19.304 3.295 3.412
116 HG11 VAL 16 1HG1 VAL 16 19.971 5.455 3.856
117 HG12 VAL 16 2HG1 VAL 16 18.592 5.778 4.909
118 HG13 VAL 16 3HG1 VAL 16 19.920 4.766 5.479
119 HG21 VAL 16 3HG2 VAL 16 17.588 2.090 4.818
120 HG22 VAL 16 1HG2 VAL 16 19.137 2.405 5.602
121 HG23 VAL 16 2HG2 VAL 16 17.736 3.409 5.980
122 H ARG 17 H ARG 17 17.892 3.746 0.831
123 HA ARG 17 HA ARG 17 18.998 6.362 0.249
124 HB2 ARG 17 2HB ARG 17 19.977 5.403 -1.570
125 HB3 ARG 17 3HB ARG 17 19.702 3.940 -0.633
126 HG2 ARG 17 2HG ARG 17 17.592 3.591 -1.880
127 HG3 ARG 17 3HG ARG 17 17.993 4.993 -2.875
128 HD2 ARG 17 2HD ARG 17 19.878 2.676 -2.577
129 HD3 ARG 17 3HD ARG 17 18.586 2.667 -3.776
130 HE ARG 17 HE ARG 17 19.849 5.020 -4.231
131 HH11 ARG 17 1HH1 ARG 17 20.929 1.720 -3.982
132 HH12 ARG 17 2HH1 ARG 17 22.253 1.933 -5.078
133 HH21 ARG 17 1HH2 ARG 17 21.589 5.313 -5.677
134 HH22 ARG 17 2HH2 ARG 17 22.628 3.978 -6.041
135 H TYR 18 H TYR 18 15.973 4.852 0.104
136 HA TYR 18 HA TYR 18 15.006 6.747 -1.928
137 HB2 TYR 18 2HB TYR 18 14.218 4.000 -1.155
138 HB3 TYR 18 3HB TYR 18 12.902 5.093 -1.567
139 HD1 TYR 18 HD2 TYR 18 15.855 3.327 -2.832
140 HD2 TYR 18 HD1 TYR 18 12.626 5.911 -3.831
141 HE1 TYR 18 HE2 TYR 18 16.275 2.918 -5.221
142 HE2 TYR 18 HE1 TYR 18 13.036 5.509 -6.222
143 HH TYR 18 HH TYR 18 15.822 4.184 -7.412
144 H TYR 19 H TYR 19 13.758 5.174 1.023
145 HA TYR 19 HA TYR 19 12.125 7.522 1.570
146 HB2 TYR 19 2HB TYR 19 12.253 5.066 3.299
147 HB3 TYR 19 3HB TYR 19 10.919 6.193 3.083
148 HD1 TYR 19 HD1 TYR 19 9.577 6.128 0.990
149 HD2 TYR 19 HD2 TYR 19 12.536 3.195 1.852
150 HE1 TYR 19 HE1 TYR 19 8.595 4.646 -0.709
151 HE2 TYR 19 HE2 TYR 19 11.563 1.705 0.155
152 HH TYR 19 HH TYR 19 9.878 1.386 -1.266
153 H GLY 20 H GLY 20 14.877 5.777 2.895
154 HA2 GLY 20 2HA GLY 20 16.599 6.803 4.143
155 HA3 GLY 20 3HA GLY 20 15.497 8.113 4.542
156 H ARG 21 H ARG 21 14.385 4.859 4.881
157 HA ARG 21 HA ARG 21 15.188 4.496 7.594
158 HB2 ARG 21 2HB ARG 21 13.028 4.748 8.665
159 HB3 ARG 21 3HB ARG 21 13.480 6.260 7.889
160 HG2 ARG 21 2HG ARG 21 11.847 4.416 6.270
161 HG3 ARG 21 3HG ARG 21 11.055 5.139 7.672
162 HD2 ARG 21 2HD ARG 21 12.291 7.304 6.629
163 HD3 ARG 21 3HD ARG 21 11.978 6.376 5.163
164 HE ARG 21 HE ARG 21 9.700 6.638 6.907
165 HH11 ARG 21 1HH1 ARG 21 11.497 8.048 4.279
166 HH12 ARG 21 2HH1 ARG 21 10.150 8.954 3.672
167 HH21 ARG 21 1HH2 ARG 21 7.920 7.826 6.117
168 HH22 ARG 21 2HH2 ARG 21 8.117 8.827 4.719
169 H THR 22 H THR 22 14.114 2.570 8.575
170 HA THR 22 HA THR 22 13.258 0.681 6.478
171 HB THR 22 HB THR 22 14.218 -1.029 8.271
172 HG1 THR 22 HG1 THR 22 14.838 0.873 9.619
173 HG21 THR 22 3HG2 THR 22 15.365 -1.414 6.391
174 HG22 THR 22 1HG2 THR 22 16.565 -0.274 6.997
175 HG23 THR 22 2HG2 THR 22 15.290 0.282 5.913
176 H GLU 23 H GLU 23 12.804 1.837 9.749
177 HA GLU 23 HA GLU 23 10.914 -0.121 10.555
178 HB2 GLU 23 2HB GLU 23 10.362 1.474 12.363
179 HB3 GLU 23 3HB GLU 23 12.092 1.198 12.208
180 HG2 GLU 23 2HG GLU 23 12.436 3.367 12.001
181 HG3 GLU 23 3HG GLU 23 11.404 3.411 10.573
182 H GLY 24 H GLY 24 8.928 -0.404 9.804
183 HA2 GLY 24 2HA GLY 24 6.712 0.258 9.370
184 HA3 GLY 24 3HA GLY 24 7.262 1.920 9.218
185 H VAL 25 H VAL 25 9.484 0.765 7.418
186 HA VAL 25 HA VAL 25 7.889 0.912 4.966
187 HB VAL 25 HB VAL 25 10.894 1.042 5.217
188 HG11 VAL 25 1HG1 VAL 25 9.748 2.466 3.006
189 HG12 VAL 25 2HG1 VAL 25 10.923 1.150 2.999
190 HG13 VAL 25 3HG1 VAL 25 9.195 0.792 2.999
191 HG21 VAL 25 3HG2 VAL 25 10.242 3.574 4.709
192 HG22 VAL 25 1HG2 VAL 25 8.805 3.106 5.618
193 HG23 VAL 25 2HG2 VAL 25 10.402 2.951 6.351
194 H VAL 26 H VAL 26 10.541 -1.009 6.365
195 HA VAL 26 HA VAL 26 10.809 -2.921 4.393
196 HB VAL 26 HB VAL 26 11.627 -4.452 6.148
197 HG11 VAL 26 1HG1 VAL 26 12.530 -1.598 6.098
198 HG12 VAL 26 2HG1 VAL 26 13.334 -2.778 7.135
199 HG13 VAL 26 3HG1 VAL 26 13.290 -3.022 5.389
200 HG21 VAL 26 3HG2 VAL 26 10.311 -2.442 7.918
201 HG22 VAL 26 1HG2 VAL 26 10.306 -4.203 8.015
202 HG23 VAL 26 2HG2 VAL 26 11.741 -3.297 8.495
203 H GLU 27 H GLU 27 8.384 -2.678 6.923
204 HA GLU 27 HA GLU 27 7.286 -5.248 6.715
205 HB2 GLU 27 2HB GLU 27 5.988 -2.629 7.480
206 HB3 GLU 27 3HB GLU 27 5.224 -4.201 7.671
207 HG2 GLU 27 2HG GLU 27 7.869 -3.553 8.925
208 HG3 GLU 27 3HG GLU 27 6.337 -3.183 9.713
209 H THR 28 H THR 28 6.816 -2.355 4.803
210 HA THR 28 HA THR 28 4.520 -3.311 3.392
211 HB THR 28 HB THR 28 6.409 -1.173 2.417
212 HG1 THR 28 HG1 THR 28 5.198 0.275 3.679
213 HG21 THR 28 3HG2 THR 28 3.420 -1.271 2.140
214 HG22 THR 28 1HG2 THR 28 4.476 -2.105 1.000
215 HG23 THR 28 2HG2 THR 28 4.589 -0.355 1.189
216 H VAL 29 H VAL 29 7.889 -2.760 2.344
217 HA VAL 29 HA VAL 29 7.738 -3.903 -0.160
218 HB VAL 29 HB VAL 29 10.102 -4.056 1.716
219 HG11 VAL 29 1HG1 VAL 29 10.725 -5.444 0.002
220 HG12 VAL 29 2HG1 VAL 29 9.738 -4.598 -1.190
221 HG13 VAL 29 3HG1 VAL 29 11.256 -3.890 -0.638
222 HG21 VAL 29 3HG2 VAL 29 9.990 -1.817 1.607
223 HG22 VAL 29 1HG2 VAL 29 10.608 -2.024 -0.032
224 HG23 VAL 29 2HG2 VAL 29 8.875 -1.843 0.241
225 H LEU 30 H LEU 30 8.252 -5.483 2.955
226 HA LEU 30 HA LEU 30 8.810 -8.059 1.946
227 HB2 LEU 30 2HB LEU 30 8.168 -6.858 4.541
228 HB3 LEU 30 3HB LEU 30 7.659 -8.537 4.373
229 HG LEU 30 HG LEU 30 10.093 -8.965 3.625
230 HD11 LEU 30 1HD1 LEU 30 11.745 -7.439 4.400
231 HD12 LEU 30 2HD1 LEU 30 10.530 -6.419 5.171
232 HD13 LEU 30 3HD1 LEU 30 10.606 -6.525 3.412
233 HD21 LEU 30 3HD2 LEU 30 9.699 -9.993 5.597
234 HD22 LEU 30 1HD2 LEU 30 8.963 -8.563 6.321
235 HD23 LEU 30 2HD2 LEU 30 10.719 -8.698 6.225
236 H ALA 31 H ALA 31 5.794 -6.543 3.041
237 HA ALA 31 HA ALA 31 4.123 -8.769 2.729
238 HB1 ALA 31 1HB ALA 31 3.216 -7.007 3.950
239 HB2 ALA 31 2HB ALA 31 3.621 -5.815 2.715
240 HB3 ALA 31 3HB ALA 31 2.315 -6.966 2.434
241 H ALA 32 H ALA 32 5.501 -6.605 0.405
242 HA ALA 32 HA ALA 32 3.692 -7.502 -1.705
243 HB1 ALA 32 1HB ALA 32 5.586 -5.260 -1.371
244 HB2 ALA 32 2HB ALA 32 5.402 -5.902 -3.004
245 HB3 ALA 32 3HB ALA 32 3.994 -5.301 -2.129
246 H ASN 33 H ASN 33 6.859 -8.091 -0.470
247 HA ASN 33 HA ASN 33 7.318 -10.012 -2.642
248 HB2 ASN 33 2HB ASN 33 9.502 -8.268 -1.488
249 HB3 ASN 33 3HB ASN 33 9.638 -9.397 -2.833
250 HD21 ASN 33 1HD2 ASN 33 8.445 -6.305 -1.790
251 HD22 ASN 33 2HD2 ASN 33 8.150 -5.661 -3.366
252 HA PRO 34 HA PRO 34 7.763 -11.922 1.570
253 HB2 PRO 34 2HB PRO 34 6.266 -14.111 0.991
254 HB3 PRO 34 3HB PRO 34 5.567 -12.598 1.579
255 HG2 PRO 34 2HG PRO 34 5.741 -13.643 -1.221
256 HG3 PRO 34 3HG PRO 34 4.381 -12.849 -0.406
257 HD2 PRO 34 2HD PRO 34 6.019 -11.539 -2.119
258 HD3 PRO 34 3HD PRO 34 5.255 -10.741 -0.730
259 H GLY 35 H GLY 35 9.236 -13.474 2.102
260 HA2 GLY 35 2HA GLY 35 10.562 -15.387 1.793
261 HA3 GLY 35 3HA GLY 35 10.081 -15.421 0.103
262 H LEU 36 H LEU 36 10.779 -12.382 0.206
263 HA LEU 36 HA LEU 36 13.457 -12.745 -0.796
264 HB2 LEU 36 2HB LEU 36 11.574 -11.148 -1.632
265 HB3 LEU 36 3HB LEU 36 12.185 -10.074 -0.376
266 HG LEU 36 HG LEU 36 13.100 -9.534 -2.584
267 HD11 LEU 36 1HD1 LEU 36 15.262 -9.146 -1.863
268 HD12 LEU 36 2HD1 LEU 36 15.360 -10.677 -0.995
269 HD13 LEU 36 3HD1 LEU 36 14.389 -9.355 -0.345
270 HD21 LEU 36 3HD2 LEU 36 14.982 -11.618 -2.922
271 HD22 LEU 36 1HD2 LEU 36 13.670 -11.141 -4.000
272 HD23 LEU 36 2HD2 LEU 36 13.390 -12.362 -2.759
273 H ALA 37 H ALA 37 11.928 -11.237 2.000
274 HA ALA 37 HA ALA 37 14.305 -10.061 3.031
275 HB1 ALA 37 1HB ALA 37 11.755 -10.774 4.476
276 HB2 ALA 37 2HB ALA 37 13.015 -9.686 5.059
277 HB3 ALA 37 3HB ALA 37 12.070 -9.257 3.633
278 H GLU 38 H GLU 38 12.948 -13.235 3.149
279 HA GLU 38 HA GLU 38 14.586 -14.048 5.411
280 HB2 GLU 38 2HB GLU 38 12.510 -15.420 3.725
281 HB3 GLU 38 3HB GLU 38 13.554 -16.341 4.798
282 HG2 GLU 38 2HG GLU 38 12.028 -14.003 5.850
283 HG3 GLU 38 3HG GLU 38 11.223 -15.554 5.614
284 H LEU 39 H LEU 39 15.410 -13.328 2.453
285 HA LEU 39 HA LEU 39 16.608 -15.606 1.338
286 HB2 LEU 39 2HB LEU 39 16.209 -13.340 0.266
287 HB3 LEU 39 3HB LEU 39 17.673 -12.806 1.089
288 HG LEU 39 HG LEU 39 19.010 -14.364 -0.171
289 HD11 LEU 39 1HD1 LEU 39 17.972 -15.731 -1.965
290 HD12 LEU 39 2HD1 LEU 39 16.388 -15.300 -1.322
291 HD13 LEU 39 3HD1 LEU 39 17.515 -16.231 -0.336
292 HD21 LEU 39 3HD2 LEU 39 17.128 -12.627 -1.728
293 HD22 LEU 39 1HD2 LEU 39 18.392 -13.557 -2.535
294 HD23 LEU 39 2HD2 LEU 39 18.823 -12.350 -1.323
295 H GLY 40 H GLY 40 17.652 -13.420 3.855
296 HA2 GLY 40 2HA GLY 40 19.198 -14.234 5.524
297 HA3 GLY 40 3HA GLY 40 20.015 -15.137 4.257
298 H ALA 41 H ALA 41 21.955 -14.340 3.848
299 HA ALA 41 HA ALA 41 22.850 -11.807 4.654
300 HB1 ALA 41 1HB ALA 41 24.882 -12.480 3.937
301 HB2 ALA 41 2HB ALA 41 24.087 -14.052 3.849
302 HB3 ALA 41 3HB ALA 41 24.263 -13.071 2.394
303 H VAL 42 H VAL 42 24.240 -10.739 2.519
304 HA VAL 42 HA VAL 42 22.452 -8.958 1.403
305 HB VAL 42 HB VAL 42 24.937 -8.691 1.443
306 HG11 VAL 42 1HG1 VAL 42 26.350 -9.918 0.188
307 HG12 VAL 42 2HG1 VAL 42 25.033 -11.092 0.208
308 HG13 VAL 42 3HG1 VAL 42 25.230 -10.011 -1.171
309 HG21 VAL 42 3HG2 VAL 42 23.577 -7.152 0.169
310 HG22 VAL 42 1HG2 VAL 42 25.063 -7.496 -0.718
311 HG23 VAL 42 2HG2 VAL 42 23.549 -8.261 -1.202
312 H LEU 43 H LEU 43 21.294 -8.827 -0.474
313 HA LEU 43 HA LEU 43 20.439 -11.251 -1.671
314 HB2 LEU 43 2HB LEU 43 20.018 -8.501 -2.805
315 HB3 LEU 43 3HB LEU 43 18.998 -9.926 -2.997
316 HG LEU 43 HG LEU 43 19.387 -8.609 -0.325
317 HD11 LEU 43 1HD1 LEU 43 17.345 -7.356 -0.713
318 HD12 LEU 43 2HD1 LEU 43 17.253 -7.980 -2.360
319 HD13 LEU 43 3HD1 LEU 43 18.576 -6.910 -1.895
320 HD21 LEU 43 3HD2 LEU 43 17.073 -9.632 -0.037
321 HD22 LEU 43 1HD2 LEU 43 18.440 -10.745 -0.100
322 HD23 LEU 43 2HD2 LEU 43 17.411 -10.533 -1.516
323 HA PRO 44 HA PRO 44 23.310 -11.789 -4.952
324 HB2 PRO 44 2HB PRO 44 21.725 -12.993 -6.798
325 HB3 PRO 44 3HB PRO 44 22.289 -13.811 -5.337
326 HG2 PRO 44 2HG PRO 44 19.644 -12.520 -5.883
327 HG3 PRO 44 3HG PRO 44 19.992 -14.063 -5.081
328 HD2 PRO 44 2HD PRO 44 19.406 -11.805 -3.706
329 HD3 PRO 44 3HD PRO 44 20.505 -13.048 -3.076
330 H HIS 45 H HIS 45 24.079 -10.206 -6.191
331 HA HIS 45 HA HIS 45 22.689 -8.039 -7.185
332 HB2 HIS 45 2HB HIS 45 24.632 -7.760 -8.761
333 HB3 HIS 45 3HB HIS 45 25.078 -7.953 -7.068
334 HD1 HIS 45 HD1 HIS 45 25.500 -9.472 -10.401
335 HD2 HIS 45 HD2 HIS 45 26.235 -10.498 -6.443
336 HE1 HIS 45 HE1 HIS 45 27.053 -11.448 -10.496
337 H GLY 46 H GLY 46 20.910 -8.221 -8.412
338 HA2 GLY 46 2HA GLY 46 20.619 -8.415 -10.983
339 HA3 GLY 46 3HA GLY 46 20.933 -10.114 -10.660
340 H THR 47 H THR 47 19.422 -9.345 -7.977
341 HA THR 47 HA THR 47 16.849 -10.260 -8.979
342 HB THR 47 HB THR 47 17.846 -9.856 -6.154
343 HG1 THR 47 HG1 THR 47 17.643 -12.057 -7.904
344 HG21 THR 47 3HG2 THR 47 15.481 -9.539 -6.113
345 HG22 THR 47 1HG2 THR 47 15.794 -11.180 -5.549
346 HG23 THR 47 2HG2 THR 47 15.218 -10.907 -7.193
347 H ALA 48 H ALA 48 15.341 -8.850 -9.552
348 HA ALA 48 HA ALA 48 15.469 -6.088 -8.762
349 HB1 ALA 48 1HB ALA 48 14.453 -5.876 -10.722
350 HB2 ALA 48 2HB ALA 48 14.178 -7.616 -10.813
351 HB3 ALA 48 3HB ALA 48 13.001 -6.578 -10.008
352 H VAL 49 H VAL 49 13.994 -4.949 -7.506
353 HA VAL 49 HA VAL 49 12.096 -6.558 -5.934
354 HB VAL 49 HB VAL 49 13.787 -4.344 -4.771
355 HG11 VAL 49 1HG1 VAL 49 12.782 -6.133 -2.825
356 HG12 VAL 49 2HG1 VAL 49 12.363 -4.436 -3.070
357 HG13 VAL 49 3HG1 VAL 49 11.441 -5.700 -3.885
358 HG21 VAL 49 3HG2 VAL 49 15.177 -6.274 -5.404
359 HG22 VAL 49 1HG2 VAL 49 15.081 -6.068 -3.655
360 HG23 VAL 49 2HG2 VAL 49 14.132 -7.325 -4.449
361 H GLU 50 H GLU 50 10.166 -5.592 -5.436
362 HA GLU 50 HA GLU 50 9.475 -3.258 -6.991
363 HB2 GLU 50 2HB GLU 50 7.862 -5.016 -6.970
364 HB3 GLU 50 3HB GLU 50 7.880 -5.100 -5.214
365 HG2 GLU 50 2HG GLU 50 6.668 -3.118 -4.988
366 HG3 GLU 50 3HG GLU 50 6.994 -2.626 -6.649
367 H LEU 51 H LEU 51 9.401 -1.231 -6.282
368 HA LEU 51 HA LEU 51 9.639 -0.762 -3.389
369 HB2 LEU 51 2HB LEU 51 10.240 1.220 -5.566
370 HB3 LEU 51 3HB LEU 51 10.722 1.285 -3.872
371 HG LEU 51 HG LEU 51 11.778 -0.658 -5.926
372 HD11 LEU 51 1HD1 LEU 51 13.181 1.660 -4.612
373 HD12 LEU 51 2HD1 LEU 51 12.475 1.719 -6.227
374 HD13 LEU 51 3HD1 LEU 51 13.800 0.607 -5.885
375 HD21 LEU 51 3HD2 LEU 51 12.332 -0.261 -3.000
376 HD22 LEU 51 1HD2 LEU 51 13.489 -1.040 -4.080
377 HD23 LEU 51 2HD2 LEU 51 11.888 -1.744 -3.846
378 HA PRO 52 HA PRO 52 5.361 0.613 -4.158
379 HB2 PRO 52 2HB PRO 52 4.561 0.226 -1.592
380 HB3 PRO 52 3HB PRO 52 4.626 -1.077 -2.786
381 HG2 PRO 52 2HG PRO 52 6.594 -0.371 -0.644
382 HG3 PRO 52 3HG PRO 52 6.003 -1.968 -1.138
383 HD2 PRO 52 2HD PRO 52 8.402 -0.994 -1.930
384 HD3 PRO 52 3HD PRO 52 7.428 -2.075 -2.946
385 H ASP 53 H ASP 53 4.216 2.461 -3.452
386 HA ASP 53 HA ASP 53 3.983 4.610 -2.743
387 HB2 ASP 53 2HB ASP 53 5.983 3.961 -0.577
388 HB3 ASP 53 3HB ASP 53 4.709 5.177 -0.542
389 H VAL 54 H VAL 54 6.162 3.799 -4.597
390 HA VAL 54 HA VAL 54 8.003 6.058 -4.155
391 HB VAL 54 HB VAL 54 8.464 3.548 -5.774
392 HG11 VAL 54 1HG1 VAL 54 9.595 5.393 -6.813
393 HG12 VAL 54 2HG1 VAL 54 10.236 5.933 -5.259
394 HG13 VAL 54 3HG1 VAL 54 10.788 4.412 -5.963
395 HG21 VAL 54 3HG2 VAL 54 10.328 3.313 -3.998
396 HG22 VAL 54 1HG2 VAL 54 9.349 4.435 -3.054
397 HG23 VAL 54 2HG2 VAL 54 8.675 2.884 -3.556
398 H GLN 55 H GLN 55 8.409 7.487 -5.821
399 HA GLN 55 HA GLN 55 6.627 7.256 -8.156
400 HB2 GLN 55 2HB GLN 55 7.636 9.808 -6.893
401 HB3 GLN 55 3HB GLN 55 6.474 9.670 -8.205
402 HG2 GLN 55 2HG GLN 55 4.984 8.427 -6.601
403 HG3 GLN 55 3HG GLN 55 6.103 8.905 -5.326
404 HE21 GLN 55 1HE2 GLN 55 5.904 10.863 -4.441
405 HE22 GLN 55 2HE2 GLN 55 4.820 12.093 -4.985
406 H THR 56 H THR 56 7.596 9.234 -9.738
407 HA THR 56 HA THR 56 9.197 9.733 -11.278
408 HB THR 56 HB THR 56 11.322 8.674 -9.435
409 HG1 THR 56 HG1 THR 56 11.243 10.856 -8.501
410 HG21 THR 56 3HG2 THR 56 12.473 10.756 -10.348
411 HG22 THR 56 1HG2 THR 56 11.147 10.853 -11.505
412 HG23 THR 56 2HG2 THR 56 12.202 9.439 -11.489
413 H ALA 57 H ALA 57 7.921 7.271 -11.510
414 HA ALA 57 HA ALA 57 10.014 5.720 -12.857
415 HB1 ALA 57 1HB ALA 57 9.888 4.156 -11.270
416 HB2 ALA 57 2HB ALA 57 8.418 4.847 -10.582
417 HB3 ALA 57 3HB ALA 57 8.316 3.755 -11.963
418 HA PRO 58 HA PRO 58 7.206 5.409 -16.214
419 HB2 PRO 58 2HB PRO 58 7.684 2.904 -17.146
420 HB3 PRO 58 3HB PRO 58 8.830 4.236 -17.340
421 HG2 PRO 58 2HG PRO 58 8.818 2.026 -15.320
422 HG3 PRO 58 3HG PRO 58 10.180 2.697 -16.237
423 HD2 PRO 58 2HD PRO 58 9.683 3.373 -13.662
424 HD3 PRO 58 3HD PRO 58 10.403 4.505 -14.824
425 H VAL 59 H VAL 59 5.123 5.457 -15.477
426 HA VAL 59 HA VAL 59 3.809 3.613 -13.899
427 HB VAL 59 HB VAL 59 2.912 5.845 -14.539
428 HG11 VAL 59 1HG1 VAL 59 1.973 4.520 -17.072
429 HG12 VAL 59 2HG1 VAL 59 1.839 6.220 -16.616
430 HG13 VAL 59 3HG1 VAL 59 3.417 5.528 -16.993
431 HG21 VAL 59 3HG2 VAL 59 0.888 3.729 -15.199
432 HG22 VAL 59 1HG2 VAL 59 1.554 3.899 -13.575
433 HG23 VAL 59 2HG2 VAL 59 0.664 5.234 -14.307
434 H ALA 60 H ALA 60 2.362 1.905 -14.338
435 HA ALA 60 HA ALA 60 2.741 0.631 -16.970
436 HB1 ALA 60 1HB ALA 60 2.394 -1.544 -15.663
437 HB2 ALA 60 2HB ALA 60 3.948 -0.725 -15.499
438 HB3 ALA 60 3HB ALA 60 2.735 -0.580 -14.226
439 H GLU 61 H GLU 61 0.980 -1.332 -16.990
440 HA GLU 61 HA GLU 61 -1.617 -0.091 -16.363
441 HB2 GLU 61 2HB GLU 61 -2.467 -1.221 -18.453
442 HB3 GLU 61 3HB GLU 61 -1.361 0.120 -18.717
443 HG2 GLU 61 2HG GLU 61 0.464 -1.444 -19.101
444 HG3 GLU 61 3HG GLU 61 -0.626 -2.798 -18.807
445 H THR 62 H THR 62 -0.944 -1.564 -14.417
446 HA THR 62 HA THR 62 -2.566 -3.950 -14.640
447 HB THR 62 HB THR 62 0.227 -4.312 -13.575
448 HG1 THR 62 HG1 THR 62 -0.599 -5.138 -16.160
449 HG21 THR 62 3HG2 THR 62 -0.509 -6.721 -14.406
450 HG22 THR 62 1HG2 THR 62 -2.118 -6.046 -14.160
451 HG23 THR 62 2HG2 THR 62 -0.974 -6.107 -12.820
452 H VAL 63 H VAL 63 -3.232 -4.783 -12.619
453 HA VAL 63 HA VAL 63 -2.292 -3.648 -10.158
454 HB VAL 63 HB VAL 63 -3.727 -1.809 -10.968
455 HG11 VAL 63 1HG1 VAL 63 -6.231 -3.266 -10.528
456 HG12 VAL 63 2HG1 VAL 63 -5.809 -2.078 -11.763
457 HG13 VAL 63 3HG1 VAL 63 -5.338 -3.766 -11.964
458 HG21 VAL 63 3HG2 VAL 63 -4.992 -3.225 -8.628
459 HG22 VAL 63 1HG2 VAL 63 -3.461 -2.353 -8.541
460 HG23 VAL 63 2HG2 VAL 63 -4.947 -1.489 -8.938
461 H ASN 64 H ASN 64 -3.080 -4.728 -8.332
462 HA ASN 64 HA ASN 64 -4.705 -7.115 -8.921
463 HB2 ASN 64 2HB ASN 64 -2.341 -6.755 -7.086
464 HB3 ASN 64 3HB ASN 64 -3.460 -8.102 -6.903
465 HD21 ASN 64 1HD2 ASN 64 -2.272 -9.788 -7.526
466 HD22 ASN 64 2HD2 ASN 64 -1.506 -9.946 -9.066
467 H LEU 65 H LEU 65 -5.619 -8.044 -6.755
468 HA LEU 65 HA LEU 65 -6.354 -6.054 -4.799
469 HB2 LEU 65 2HB LEU 65 -8.756 -6.250 -5.151
470 HB3 LEU 65 3HB LEU 65 -7.949 -5.564 -6.560
471 HG LEU 65 HG LEU 65 -8.508 -8.489 -6.534
472 HD11 LEU 65 1HD1 LEU 65 -10.547 -6.732 -5.943
473 HD12 LEU 65 2HD1 LEU 65 -10.728 -8.343 -6.637
474 HD13 LEU 65 3HD1 LEU 65 -10.670 -6.931 -7.691
475 HD21 LEU 65 3HD2 LEU 65 -9.043 -6.773 -8.866
476 HD22 LEU 65 1HD2 LEU 65 -8.208 -8.323 -8.760
477 HD23 LEU 65 2HD2 LEU 65 -7.363 -6.835 -8.333
478 H TRP 66 H TRP 66 -7.222 -6.940 -2.913
479 HA TRP 66 HA TRP 66 -6.670 -9.761 -2.568
480 HB2 TRP 66 2HB TRP 66 -7.344 -7.503 -0.701
481 HB3 TRP 66 3HB TRP 66 -7.387 -9.174 -0.145
482 HD1 TRP 66 HD1 TRP 66 -4.800 -10.306 -1.526
483 HE1 TRP 66 HE1 TRP 66 -2.473 -9.513 -0.763
484 HE3 TRP 66 HE3 TRP 66 -6.127 -5.879 0.661
485 HZ2 TRP 66 HZ2 TRP 66 -1.349 -7.304 0.588
486 HZ3 TRP 66 HZ3 TRP 66 -4.366 -4.486 1.666
487 HH2 TRP 66 HH2 TRP 66 -2.027 -5.186 1.630
488 H GLU 67 H GLU 67 -8.241 -11.007 -3.451
489 HA GLU 67 HA GLU 67 -11.000 -10.533 -2.528
490 HB2 GLU 67 2HB GLU 67 -11.640 -11.862 -4.611
491 HB3 GLU 67 3HB GLU 67 -11.046 -10.227 -4.862
492 HG2 GLU 67 2HG GLU 67 -10.062 -11.642 -6.503
493 HG3 GLU 67 3HG GLU 67 -8.808 -11.174 -5.357
494 H VAL 68 H VAL 68 -8.965 -12.028 -1.124
495 HA VAL 68 HA VAL 68 -9.914 -14.794 -1.411
496 HB VAL 68 HB VAL 68 -7.478 -14.494 -1.478
497 HG11 VAL 68 1HG1 VAL 68 -7.873 -12.567 0.427
498 HG12 VAL 68 2HG1 VAL 68 -7.180 -13.892 1.364
499 HG13 VAL 68 3HG1 VAL 68 -6.312 -13.248 -0.030
500 HG21 VAL 68 3HG2 VAL 68 -7.114 -16.424 -0.374
501 HG22 VAL 68 1HG2 VAL 68 -7.779 -15.804 1.137
502 HG23 VAL 68 2HG2 VAL 68 -8.860 -16.391 -0.126
503 H GLU 69 H GLU 69 -9.804 -12.076 0.767
504 HA GLU 69 HA GLU 69 -10.405 -13.315 3.186
505 HB2 GLU 69 2HB GLU 69 -9.915 -10.801 2.559
506 HB3 GLU 69 3HB GLU 69 -11.669 -10.692 2.510
507 HG2 GLU 69 2HG GLU 69 -11.876 -11.232 4.782
508 HG3 GLU 69 3HG GLU 69 -10.215 -11.813 4.880
509 H HIS 70 H HIS 70 -11.937 -14.860 3.272
510 HA HIS 70 HA HIS 70 -14.495 -14.495 1.954
511 HB2 HIS 70 2HB HIS 70 -13.249 -16.706 2.067
512 HB3 HIS 70 3HB HIS 70 -13.689 -16.767 3.771
513 HD1 HIS 70 HD1 HIS 70 -15.727 -18.082 4.197
514 HD2 HIS 70 HD2 HIS 70 -15.774 -16.361 0.415
515 HE1 HIS 70 HE1 HIS 70 -17.865 -18.865 3.128
516 H HIS 71 H HIS 71 -16.475 -14.287 2.970
517 HA HIS 71 HA HIS 71 -16.423 -12.972 5.523
518 HB2 HIS 71 2HB HIS 71 -17.961 -12.458 3.520
519 HB3 HIS 71 3HB HIS 71 -18.916 -13.831 4.071
520 HD1 HIS 71 HD1 HIS 71 -17.527 -10.623 5.587
521 HD2 HIS 71 HD2 HIS 71 -20.852 -13.105 5.803
522 HE1 HIS 71 HE1 HIS 71 -19.099 -9.501 7.197
Start of MODEL 7
1 H1 MET 1 H MET 1 6.317 -3.201 -8.482
2 HA MET 1 HA MET 1 8.338 -1.578 -9.748
3 HB2 MET 1 2HB MET 1 7.253 -0.713 -7.064
4 HB3 MET 1 3HB MET 1 8.554 0.050 -7.969
5 HG2 MET 1 2HG MET 1 7.111 1.329 -9.043
6 HG3 MET 1 3HG MET 1 6.228 -0.085 -9.613
7 HE1 MET 1 3HE MET 1 3.825 -0.652 -8.863
8 HE2 MET 1 1HE MET 1 4.770 -1.480 -7.624
9 HE3 MET 1 2HE MET 1 3.358 -0.528 -7.166
10 H LYS 2 H LYS 2 9.561 -3.475 -9.661
11 HA LYS 2 HA LYS 2 10.647 -4.071 -6.999
12 HB2 LYS 2 2HB LYS 2 10.122 -6.232 -9.034
13 HB3 LYS 2 3HB LYS 2 10.570 -6.422 -7.344
14 HG2 LYS 2 2HG LYS 2 8.255 -5.052 -7.092
15 HG3 LYS 2 3HG LYS 2 7.939 -5.971 -8.565
16 HD2 LYS 2 2HD LYS 2 9.032 -7.271 -6.086
17 HD3 LYS 2 3HD LYS 2 7.299 -7.052 -6.337
18 HE2 LYS 2 2HE LYS 2 7.261 -8.485 -8.172
19 HE3 LYS 2 3HE LYS 2 8.999 -8.348 -8.435
20 HZ1 LYS 2 3HZ LYS 2 8.105 -9.506 -5.906
21 HZ2 LYS 2 1HZ LYS 2 9.455 -9.885 -6.852
22 HZ3 LYS 2 2HZ LYS 2 7.925 -10.451 -7.298
23 H THR 3 H THR 3 12.808 -4.821 -6.982
24 HA THR 3 HA THR 3 14.263 -4.806 -9.513
25 HB THR 3 HB THR 3 14.347 -2.470 -8.702
26 HG1 THR 3 HG1 THR 3 16.821 -3.880 -8.519
27 HG21 THR 3 3HG2 THR 3 15.870 -3.585 -6.348
28 HG22 THR 3 1HG2 THR 3 14.198 -3.030 -6.276
29 HG23 THR 3 2HG2 THR 3 15.489 -1.893 -6.664
30 H PHE 4 H PHE 4 16.373 -5.747 -9.378
31 HA PHE 4 HA PHE 4 16.503 -7.892 -7.483
32 HB2 PHE 4 2HB PHE 4 18.674 -7.078 -9.414
33 HB3 PHE 4 3HB PHE 4 18.381 -8.672 -8.726
34 HD1 PHE 4 HD1 PHE 4 15.638 -9.232 -9.159
35 HD2 PHE 4 HD2 PHE 4 18.335 -7.112 -11.678
36 HE1 PHE 4 HE1 PHE 4 14.272 -9.827 -11.117
37 HE2 PHE 4 HE2 PHE 4 16.973 -7.702 -13.640
38 HZ PHE 4 HZ PHE 4 14.938 -9.061 -13.361
39 H ALA 5 H ALA 5 17.725 -8.086 -5.693
40 HA ALA 5 HA ALA 5 19.074 -5.704 -4.723
41 HB1 ALA 5 1HB ALA 5 17.556 -6.930 -3.242
42 HB2 ALA 5 2HB ALA 5 18.598 -8.349 -3.353
43 HB3 ALA 5 3HB ALA 5 19.195 -6.874 -2.593
44 H LEU 6 H LEU 6 21.050 -5.452 -5.615
45 HA LEU 6 HA LEU 6 22.846 -7.761 -5.763
46 HB2 LEU 6 2HB LEU 6 23.033 -5.000 -6.953
47 HB3 LEU 6 3HB LEU 6 24.285 -6.231 -7.104
48 HG LEU 6 HG LEU 6 21.767 -7.288 -7.991
49 HD11 LEU 6 1HD1 LEU 6 21.555 -5.822 -10.004
50 HD12 LEU 6 2HD1 LEU 6 22.621 -4.669 -9.204
51 HD13 LEU 6 3HD1 LEU 6 21.060 -5.068 -8.488
52 HD21 LEU 6 3HD2 LEU 6 24.159 -7.973 -8.525
53 HD22 LEU 6 1HD2 LEU 6 24.178 -6.618 -9.654
54 HD23 LEU 6 2HD2 LEU 6 23.020 -7.931 -9.872
55 H GLN 7 H GLN 7 25.293 -6.796 -5.537
56 HA GLN 7 HA GLN 7 25.782 -6.582 -2.831
57 HB2 GLN 7 2HB GLN 7 27.370 -6.960 -4.917
58 HB3 GLN 7 3HB GLN 7 27.662 -5.237 -4.718
59 HG2 GLN 7 2HG GLN 7 28.400 -5.594 -2.441
60 HG3 GLN 7 3HG GLN 7 28.038 -7.314 -2.573
61 HE21 GLN 7 1HE2 GLN 7 30.532 -6.420 -1.842
62 HE22 GLN 7 2HE2 GLN 7 31.663 -6.782 -3.097
63 H GLY 8 H GLY 8 25.257 -5.050 -1.428
64 HA2 GLY 8 2HA GLY 8 25.046 -2.963 -0.476
65 HA3 GLY 8 3HA GLY 8 25.937 -2.313 -1.844
66 H ASP 9 H ASP 9 23.064 -4.173 -2.396
67 HA ASP 9 HA ASP 9 21.576 -1.691 -2.948
68 HB2 ASP 9 2HB ASP 9 22.022 -4.088 -4.673
69 HB3 ASP 9 3HB ASP 9 20.470 -3.260 -4.776
70 H THR 10 H THR 10 21.597 -3.562 -0.632
71 HA THR 10 HA THR 10 19.203 -5.098 -0.697
72 HB THR 10 HB THR 10 19.532 -5.498 1.624
73 HG1 THR 10 HG1 THR 10 21.542 -3.526 1.816
74 HG21 THR 10 3HG2 THR 10 21.944 -6.076 1.749
75 HG22 THR 10 1HG2 THR 10 22.207 -5.164 0.263
76 HG23 THR 10 2HG2 THR 10 21.183 -6.600 0.247
77 H LEU 11 H LEU 11 17.591 -4.641 1.255
78 HA LEU 11 HA LEU 11 15.952 -2.555 0.531
79 HB2 LEU 11 2HB LEU 11 16.153 -3.588 3.347
80 HB3 LEU 11 3HB LEU 11 14.735 -2.928 2.536
81 HG LEU 11 HG LEU 11 16.051 -5.590 2.011
82 HD11 LEU 11 1HD1 LEU 11 13.604 -6.264 2.604
83 HD12 LEU 11 2HD1 LEU 11 13.572 -4.697 3.412
84 HD13 LEU 11 3HD1 LEU 11 14.760 -5.910 3.889
85 HD21 LEU 11 3HD2 LEU 11 15.325 -4.772 -0.099
86 HD22 LEU 11 1HD2 LEU 11 13.809 -4.180 0.580
87 HD23 LEU 11 2HD2 LEU 11 14.103 -5.915 0.459
88 H ASP 12 H ASP 12 18.378 -2.598 3.123
89 HA ASP 12 HA ASP 12 17.933 -0.066 4.171
90 HB2 ASP 12 2HB ASP 12 19.436 -1.748 5.183
91 HB3 ASP 12 3HB ASP 12 20.593 -1.478 3.882
92 H ALA 13 H ALA 13 19.577 -1.031 1.249
93 HA ALA 13 HA ALA 13 20.662 1.623 0.790
94 HB1 ALA 13 1HB ALA 13 21.096 0.304 -1.533
95 HB2 ALA 13 2HB ALA 13 22.178 0.249 -0.141
96 HB3 ALA 13 3HB ALA 13 21.005 -1.042 -0.398
97 H ILE 14 H ILE 14 18.478 -0.560 -1.003
98 HA ILE 14 HA ILE 14 17.606 1.209 -2.927
99 HB ILE 14 HB ILE 14 16.014 -0.970 -1.572
100 HG12 ILE 14 2HG1 ILE 14 17.423 -1.035 -4.242
101 HG13 ILE 14 3HG1 ILE 14 18.184 -1.573 -2.749
102 HG21 ILE 14 1HG2 ILE 14 14.505 0.556 -2.670
103 HG22 ILE 14 2HG2 ILE 14 15.482 0.521 -4.137
104 HG23 ILE 14 3HG2 ILE 14 14.622 -0.927 -3.616
105 HD11 ILE 14 3HD1 ILE 14 15.710 -2.722 -4.018
106 HD12 ILE 14 1HD1 ILE 14 17.311 -3.460 -3.958
107 HD13 ILE 14 2HD1 ILE 14 16.389 -3.233 -2.472
108 H CYS 15 H CYS 15 16.280 0.695 0.324
109 HA CYS 15 HA CYS 15 14.092 2.411 0.148
110 HB2 CYS 15 2HB CYS 15 15.804 1.534 2.464
111 HB3 CYS 15 3HB CYS 15 14.449 2.633 2.691
112 HG CYS 15 HG CYS 15 13.009 0.562 3.280
113 H VAL 16 H VAL 16 17.475 3.094 0.526
114 HA VAL 16 HA VAL 16 17.027 5.854 1.302
115 HB VAL 16 HB VAL 16 19.585 4.398 0.619
116 HG11 VAL 16 1HG1 VAL 16 20.341 6.539 2.087
117 HG12 VAL 16 2HG1 VAL 16 20.346 6.498 0.323
118 HG13 VAL 16 3HG1 VAL 16 18.989 7.223 1.186
119 HG21 VAL 16 3HG2 VAL 16 18.266 3.721 2.699
120 HG22 VAL 16 1HG2 VAL 16 19.958 4.163 2.924
121 HG23 VAL 16 2HG2 VAL 16 18.685 5.311 3.336
122 H ARG 17 H ARG 17 17.757 4.010 -1.570
123 HA ARG 17 HA ARG 17 18.387 6.366 -3.136
124 HB2 ARG 17 2HB ARG 17 19.091 4.934 -4.783
125 HB3 ARG 17 3HB ARG 17 19.285 3.891 -3.381
126 HG2 ARG 17 2HG ARG 17 17.075 2.898 -3.858
127 HG3 ARG 17 3HG ARG 17 16.979 3.888 -5.315
128 HD2 ARG 17 2HD ARG 17 19.276 2.024 -4.795
129 HD3 ARG 17 3HD ARG 17 17.792 1.484 -5.580
130 HE ARG 17 HE ARG 17 18.732 3.772 -6.900
131 HH11 ARG 17 1HH1 ARG 17 19.588 0.434 -6.403
132 HH12 ARG 17 2HH1 ARG 17 20.420 0.287 -7.916
133 HH21 ARG 17 1HH2 ARG 17 19.825 3.591 -8.894
134 HH22 ARG 17 2HH2 ARG 17 20.555 2.083 -9.332
135 H TYR 18 H TYR 18 15.600 4.783 -2.130
136 HA TYR 18 HA TYR 18 14.054 5.772 -4.430
137 HB2 TYR 18 2HB TYR 18 13.777 3.445 -2.638
138 HB3 TYR 18 3HB TYR 18 12.274 4.276 -3.021
139 HD1 TYR 18 HD1 TYR 18 15.190 2.548 -4.512
140 HD2 TYR 18 HD2 TYR 18 11.252 4.030 -5.140
141 HE1 TYR 18 HE1 TYR 18 15.098 1.370 -6.669
142 HE2 TYR 18 HE2 TYR 18 11.148 2.855 -7.299
143 HH TYR 18 HH TYR 18 13.930 1.033 -8.535
144 H TYR 19 H TYR 19 13.584 5.330 -0.919
145 HA TYR 19 HA TYR 19 11.856 7.683 -0.884
146 HB2 TYR 19 2HB TYR 19 12.479 5.960 1.500
147 HB3 TYR 19 3HB TYR 19 11.042 6.928 1.185
148 HD1 TYR 19 HD1 TYR 19 9.399 6.149 -0.541
149 HD2 TYR 19 HD2 TYR 19 12.614 3.703 0.795
150 HE1 TYR 19 HE1 TYR 19 8.252 4.164 -1.434
151 HE2 TYR 19 HE2 TYR 19 11.477 1.712 -0.096
152 HH TYR 19 HH TYR 19 9.809 1.045 -1.561
153 H GLY 20 H GLY 20 14.927 6.533 0.389
154 HA2 GLY 20 2HA GLY 20 16.754 7.950 0.872
155 HA3 GLY 20 3HA GLY 20 15.637 9.299 1.023
156 H ARG 21 H ARG 21 14.899 6.317 2.618
157 HA ARG 21 HA ARG 21 16.179 6.924 5.093
158 HB2 ARG 21 2HB ARG 21 14.152 7.389 6.404
159 HB3 ARG 21 3HB ARG 21 14.444 8.632 5.195
160 HG2 ARG 21 2HG ARG 21 12.622 6.365 4.546
161 HG3 ARG 21 3HG ARG 21 12.047 7.684 5.567
162 HD2 ARG 21 2HD ARG 21 13.141 9.131 3.618
163 HD3 ARG 21 3HD ARG 21 12.776 7.675 2.693
164 HE ARG 21 HE ARG 21 10.573 8.255 2.759
165 HH11 ARG 21 1HH1 ARG 21 12.238 9.921 5.323
166 HH12 ARG 21 2HH1 ARG 21 10.855 10.853 5.792
167 HH21 ARG 21 1HH2 ARG 21 8.745 9.476 3.368
168 HH22 ARG 21 2HH2 ARG 21 8.868 10.598 4.680
169 H THR 22 H THR 22 15.676 5.356 6.767
170 HA THR 22 HA THR 22 14.558 2.870 5.645
171 HB THR 22 HB THR 22 16.023 1.811 7.531
172 HG1 THR 22 HG1 THR 22 17.426 4.248 7.058
173 HG21 THR 22 3HG2 THR 22 17.206 1.084 5.786
174 HG22 THR 22 1HG2 THR 22 17.947 2.669 5.568
175 HG23 THR 22 2HG2 THR 22 16.403 2.304 4.797
176 H GLU 23 H GLU 23 14.590 5.071 8.345
177 HA GLU 23 HA GLU 23 13.219 3.459 10.213
178 HB2 GLU 23 2HB GLU 23 14.452 5.543 10.780
179 HB3 GLU 23 3HB GLU 23 13.190 6.473 9.985
180 HG2 GLU 23 2HG GLU 23 11.555 5.537 11.593
181 HG3 GLU 23 3HG GLU 23 12.889 4.748 12.430
182 H GLY 24 H GLY 24 11.282 2.587 9.884
183 HA2 GLY 24 2HA GLY 24 8.932 2.736 9.769
184 HA3 GLY 24 3HA GLY 24 9.091 4.324 9.035
185 H VAL 25 H VAL 25 11.196 3.037 7.203
186 HA VAL 25 HA VAL 25 9.263 2.186 5.188
187 HB VAL 25 HB VAL 25 12.215 2.691 4.816
188 HG11 VAL 25 1HG1 VAL 25 10.172 3.003 2.677
189 HG12 VAL 25 2HG1 VAL 25 11.868 2.529 2.561
190 HG13 VAL 25 3HG1 VAL 25 10.666 1.374 3.137
191 HG21 VAL 25 3HG2 VAL 25 11.658 4.813 5.357
192 HG22 VAL 25 1HG2 VAL 25 11.037 4.843 3.707
193 HG23 VAL 25 2HG2 VAL 25 9.940 4.553 5.057
194 H VAL 26 H VAL 26 12.313 1.067 6.631
195 HA VAL 26 HA VAL 26 12.589 -1.331 5.267
196 HB VAL 26 HB VAL 26 13.888 -2.136 7.202
197 HG11 VAL 26 1HG1 VAL 26 14.461 0.759 6.584
198 HG12 VAL 26 2HG1 VAL 26 15.617 -0.463 7.115
199 HG13 VAL 26 3HG1 VAL 26 14.864 -0.591 5.524
200 HG21 VAL 26 3HG2 VAL 26 12.604 0.223 8.522
201 HG22 VAL 26 1HG2 VAL 26 12.783 -1.429 9.112
202 HG23 VAL 26 2HG2 VAL 26 14.180 -0.354 9.064
203 H GLU 27 H GLU 27 10.536 -0.522 7.994
204 HA GLU 27 HA GLU 27 9.818 -3.171 8.695
205 HB2 GLU 27 2HB GLU 27 8.448 -0.521 9.156
206 HB3 GLU 27 3HB GLU 27 7.849 -2.041 9.806
207 HG2 GLU 27 2HG GLU 27 10.527 -0.801 10.394
208 HG3 GLU 27 3HG GLU 27 9.126 -0.809 11.464
209 H THR 28 H THR 28 8.764 -0.995 6.217
210 HA THR 28 HA THR 28 6.271 -2.295 5.677
211 HB THR 28 HB THR 28 7.734 -0.648 3.639
212 HG1 THR 28 HG1 THR 28 7.920 0.607 5.470
213 HG21 THR 28 3HG2 THR 28 5.512 0.060 3.024
214 HG22 THR 28 1HG2 THR 28 4.819 -0.768 4.418
215 HG23 THR 28 2HG2 THR 28 5.544 -1.701 3.109
216 H VAL 29 H VAL 29 9.361 -2.163 3.893
217 HA VAL 29 HA VAL 29 8.723 -4.028 1.928
218 HB VAL 29 HB VAL 29 11.467 -3.612 3.118
219 HG11 VAL 29 1HG1 VAL 29 10.453 -5.179 0.921
220 HG12 VAL 29 2HG1 VAL 29 11.612 -3.974 0.355
221 HG13 VAL 29 3HG1 VAL 29 12.076 -5.126 1.608
222 HG21 VAL 29 3HG2 VAL 29 9.780 -1.887 1.411
223 HG22 VAL 29 1HG2 VAL 29 11.057 -1.459 2.549
224 HG23 VAL 29 2HG2 VAL 29 11.471 -2.048 0.939
225 H LEU 30 H LEU 30 10.350 -4.536 5.050
226 HA LEU 30 HA LEU 30 10.863 -7.242 4.863
227 HB2 LEU 30 2HB LEU 30 10.396 -5.345 7.081
228 HB3 LEU 30 3HB LEU 30 10.262 -7.058 7.471
229 HG LEU 30 HG LEU 30 12.691 -5.760 6.238
230 HD11 LEU 30 1HD1 LEU 30 13.716 -5.902 8.399
231 HD12 LEU 30 2HD1 LEU 30 12.284 -6.675 9.079
232 HD13 LEU 30 3HD1 LEU 30 12.211 -4.994 8.551
233 HD21 LEU 30 3HD2 LEU 30 13.507 -7.808 5.956
234 HD22 LEU 30 1HD2 LEU 30 11.897 -8.433 6.312
235 HD23 LEU 30 2HD2 LEU 30 13.084 -8.268 7.606
236 H ALA 31 H ALA 31 7.854 -5.606 5.658
237 HA ALA 31 HA ALA 31 6.438 -7.938 6.463
238 HB1 ALA 31 1HB ALA 31 5.943 -5.320 6.720
239 HB2 ALA 31 2HB ALA 31 4.917 -5.673 5.329
240 HB3 ALA 31 3HB ALA 31 4.689 -6.554 6.840
241 H ALA 32 H ALA 32 7.021 -6.369 3.392
242 HA ALA 32 HA ALA 32 5.035 -7.866 1.957
243 HB1 ALA 32 1HB ALA 32 6.933 -5.743 1.373
244 HB2 ALA 32 2HB ALA 32 6.810 -6.927 0.071
245 HB3 ALA 32 3HB ALA 32 5.365 -6.094 0.644
246 H ASN 33 H ASN 33 8.427 -8.236 2.707
247 HA ASN 33 HA ASN 33 8.399 -10.822 1.300
248 HB2 ASN 33 2HB ASN 33 10.399 -8.622 1.203
249 HB3 ASN 33 3HB ASN 33 11.017 -10.272 1.220
250 HD21 ASN 33 1HD2 ASN 33 8.786 -8.113 -0.450
251 HD22 ASN 33 2HD2 ASN 33 8.917 -8.881 -1.993
252 HA PRO 34 HA PRO 34 9.339 -11.409 5.811
253 HB2 PRO 34 2HB PRO 34 7.652 -13.512 6.129
254 HB3 PRO 34 3HB PRO 34 7.133 -11.830 6.294
255 HG2 PRO 34 2HG PRO 34 6.840 -13.682 3.961
256 HG3 PRO 34 3HG PRO 34 5.660 -12.549 4.645
257 HD2 PRO 34 2HD PRO 34 7.104 -11.985 2.425
258 HD3 PRO 34 3HD PRO 34 6.597 -10.734 3.577
259 H GLY 35 H GLY 35 10.504 -13.113 6.786
260 HA2 GLY 35 2HA GLY 35 11.554 -15.222 6.842
261 HA3 GLY 35 3HA GLY 35 11.134 -15.451 5.151
262 H LEU 36 H LEU 36 12.183 -12.653 4.618
263 HA LEU 36 HA LEU 36 14.732 -13.380 3.714
264 HB2 LEU 36 2HB LEU 36 13.099 -11.366 3.146
265 HB3 LEU 36 3HB LEU 36 14.152 -10.523 4.280
266 HG LEU 36 HG LEU 36 14.828 -10.154 1.960
267 HD11 LEU 36 1HD1 LEU 36 17.026 -11.869 2.888
268 HD12 LEU 36 2HD1 LEU 36 16.441 -10.689 4.061
269 HD13 LEU 36 3HD1 LEU 36 17.013 -10.152 2.482
270 HD21 LEU 36 3HD2 LEU 36 15.443 -13.100 1.843
271 HD22 LEU 36 1HD2 LEU 36 15.607 -11.910 0.551
272 HD23 LEU 36 2HD2 LEU 36 14.005 -12.368 1.130
273 H ALA 37 H ALA 37 13.656 -11.955 6.718
274 HA ALA 37 HA ALA 37 16.040 -10.931 7.708
275 HB1 ALA 37 1HB ALA 37 14.765 -10.492 9.470
276 HB2 ALA 37 2HB ALA 37 13.464 -11.401 8.699
277 HB3 ALA 37 3HB ALA 37 14.565 -12.211 9.814
278 H GLU 38 H GLU 38 15.041 -14.220 7.288
279 HA GLU 38 HA GLU 38 17.061 -15.294 9.060
280 HB2 GLU 38 2HB GLU 38 15.400 -16.807 7.046
281 HB3 GLU 38 3HB GLU 38 16.219 -17.452 8.461
282 HG2 GLU 38 2HG GLU 38 13.937 -15.495 8.565
283 HG3 GLU 38 3HG GLU 38 13.765 -17.242 8.717
284 H LEU 39 H LEU 39 16.728 -14.500 5.709
285 HA LEU 39 HA LEU 39 18.580 -16.149 4.495
286 HB2 LEU 39 2HB LEU 39 17.113 -14.508 3.353
287 HB3 LEU 39 3HB LEU 39 18.170 -13.218 3.923
288 HG LEU 39 HG LEU 39 19.977 -14.023 2.553
289 HD11 LEU 39 1HD1 LEU 39 18.122 -16.273 1.790
290 HD12 LEU 39 2HD1 LEU 39 19.596 -16.408 2.749
291 HD13 LEU 39 3HD1 LEU 39 19.689 -15.942 1.051
292 HD21 LEU 39 3HD2 LEU 39 17.406 -13.242 1.484
293 HD22 LEU 39 1HD2 LEU 39 18.330 -14.198 0.325
294 HD23 LEU 39 2HD2 LEU 39 19.027 -12.731 1.011
295 H GLY 40 H GLY 40 19.187 -12.962 5.978
296 HA2 GLY 40 2HA GLY 40 21.376 -13.332 7.422
297 HA3 GLY 40 3HA GLY 40 22.063 -13.431 5.808
298 H ALA 41 H ALA 41 23.258 -11.603 5.736
299 HA ALA 41 HA ALA 41 22.116 -9.075 6.609
300 HB1 ALA 41 1HB ALA 41 24.379 -8.182 5.945
301 HB2 ALA 41 2HB ALA 41 24.378 -9.384 7.236
302 HB3 ALA 41 3HB ALA 41 24.842 -9.848 5.599
303 H VAL 42 H VAL 42 24.039 -9.791 3.707
304 HA VAL 42 HA VAL 42 22.348 -7.966 2.182
305 HB VAL 42 HB VAL 42 24.845 -7.797 2.079
306 HG11 VAL 42 1HG1 VAL 42 26.137 -9.395 0.892
307 HG12 VAL 42 2HG1 VAL 42 25.186 -10.293 2.077
308 HG13 VAL 42 3HG1 VAL 42 24.699 -10.278 0.381
309 HG21 VAL 42 3HG2 VAL 42 22.935 -7.716 -0.046
310 HG22 VAL 42 1HG2 VAL 42 24.364 -6.713 0.201
311 HG23 VAL 42 2HG2 VAL 42 24.495 -8.231 -0.686
312 H LEU 43 H LEU 43 21.165 -8.540 0.398
313 HA LEU 43 HA LEU 43 20.378 -11.306 0.226
314 HB2 LEU 43 2HB LEU 43 19.518 -9.062 -1.581
315 HB3 LEU 43 3HB LEU 43 18.671 -10.573 -1.251
316 HG LEU 43 HG LEU 43 18.717 -9.521 1.226
317 HD11 LEU 43 1HD1 LEU 43 17.890 -7.048 0.492
318 HD12 LEU 43 2HD1 LEU 43 19.221 -7.308 -0.635
319 HD13 LEU 43 3HD1 LEU 43 19.502 -7.423 1.102
320 HD21 LEU 43 3HD2 LEU 43 16.661 -10.216 0.519
321 HD22 LEU 43 1HD2 LEU 43 16.789 -9.387 -1.032
322 HD23 LEU 43 2HD2 LEU 43 16.426 -8.470 0.431
323 HA PRO 44 HA PRO 44 22.912 -12.592 -3.122
324 HB2 PRO 44 2HB PRO 44 21.267 -14.367 -4.351
325 HB3 PRO 44 3HB PRO 44 22.049 -14.697 -2.801
326 HG2 PRO 44 2HG PRO 44 19.255 -13.778 -3.355
327 HG3 PRO 44 3HG PRO 44 19.823 -15.002 -2.205
328 HD2 PRO 44 2HD PRO 44 19.172 -12.485 -1.450
329 HD3 PRO 44 3HD PRO 44 20.440 -13.427 -0.640
330 H HIS 45 H HIS 45 23.420 -11.555 -4.938
331 HA HIS 45 HA HIS 45 21.823 -9.748 -6.278
332 HB2 HIS 45 2HB HIS 45 23.475 -9.793 -8.062
333 HB3 HIS 45 3HB HIS 45 24.284 -9.880 -6.500
334 HD1 HIS 45 HD1 HIS 45 25.501 -12.081 -5.916
335 HD2 HIS 45 HD2 HIS 45 23.710 -12.078 -9.665
336 HE1 HIS 45 HE1 HIS 45 26.434 -14.088 -7.109
337 H GLY 46 H GLY 46 20.193 -9.893 -7.681
338 HA2 GLY 46 2HA GLY 46 19.326 -10.896 -9.739
339 HA3 GLY 46 3HA GLY 46 19.811 -12.458 -9.097
340 H THR 47 H THR 47 18.737 -11.164 -6.424
341 HA THR 47 HA THR 47 16.090 -12.332 -6.724
342 HB THR 47 HB THR 47 17.541 -11.307 -4.277
343 HG1 THR 47 HG1 THR 47 16.969 -13.924 -5.252
344 HG21 THR 47 3HG2 THR 47 14.807 -12.506 -4.623
345 HG22 THR 47 1HG2 THR 47 15.265 -11.039 -3.760
346 HG23 THR 47 2HG2 THR 47 15.682 -12.620 -3.097
347 H ALA 48 H ALA 48 14.445 -11.101 -7.334
348 HA ALA 48 HA ALA 48 14.517 -8.254 -7.256
349 HB1 ALA 48 1HB ALA 48 12.746 -10.318 -8.303
350 HB2 ALA 48 2HB ALA 48 11.887 -8.899 -7.701
351 HB3 ALA 48 3HB ALA 48 13.128 -8.719 -8.942
352 H VAL 49 H VAL 49 13.114 -6.846 -6.096
353 HA VAL 49 HA VAL 49 11.848 -7.973 -3.701
354 HB VAL 49 HB VAL 49 13.637 -5.543 -3.598
355 HG11 VAL 49 1HG1 VAL 49 13.084 -6.886 -1.102
356 HG12 VAL 49 2HG1 VAL 49 12.841 -5.196 -1.549
357 HG13 VAL 49 3HG1 VAL 49 11.595 -6.392 -1.908
358 HG21 VAL 49 3HG2 VAL 49 14.198 -8.350 -2.646
359 HG22 VAL 49 1HG2 VAL 49 14.968 -7.546 -4.014
360 HG23 VAL 49 2HG2 VAL 49 15.227 -6.944 -2.377
361 H GLU 50 H GLU 50 9.855 -7.217 -3.444
362 HA GLU 50 HA GLU 50 8.780 -5.233 -5.170
363 HB2 GLU 50 2HB GLU 50 7.440 -7.105 -4.301
364 HB3 GLU 50 3HB GLU 50 7.595 -6.459 -2.674
365 HG2 GLU 50 2HG GLU 50 6.474 -4.667 -4.745
366 HG3 GLU 50 3HG GLU 50 5.472 -6.010 -4.198
367 H LEU 51 H LEU 51 8.328 -3.115 -4.837
368 HA LEU 51 HA LEU 51 9.305 -1.943 -2.319
369 HB2 LEU 51 2HB LEU 51 9.008 -0.641 -5.021
370 HB3 LEU 51 3HB LEU 51 9.662 0.115 -3.571
371 HG LEU 51 HG LEU 51 10.908 -2.193 -5.064
372 HD11 LEU 51 1HD1 LEU 51 12.642 -0.059 -5.114
373 HD12 LEU 51 2HD1 LEU 51 11.070 0.694 -5.381
374 HD13 LEU 51 3HD1 LEU 51 11.622 -0.598 -6.448
375 HD21 LEU 51 3HD2 LEU 51 11.302 -2.134 -2.593
376 HD22 LEU 51 1HD2 LEU 51 12.052 -0.552 -2.811
377 HD23 LEU 51 2HD2 LEU 51 12.759 -1.976 -3.576
378 HA PRO 52 HA PRO 52 4.811 -1.264 -1.980
379 HB2 PRO 52 2HB PRO 52 4.838 -1.096 0.729
380 HB3 PRO 52 3HB PRO 52 4.797 -2.636 -0.138
381 HG2 PRO 52 2HG PRO 52 7.127 -1.218 1.098
382 HG3 PRO 52 3HG PRO 52 6.713 -2.942 1.144
383 HD2 PRO 52 2HD PRO 52 8.586 -1.937 -0.533
384 HD3 PRO 52 3HD PRO 52 7.575 -3.334 -0.957
385 H ASP 53 H ASP 53 3.582 0.539 -1.162
386 HA ASP 53 HA ASP 53 3.182 2.761 -0.886
387 HB2 ASP 53 2HB ASP 53 5.646 2.348 0.773
388 HB3 ASP 53 3HB ASP 53 4.999 3.972 0.554
389 H VAL 54 H VAL 54 4.508 1.928 -3.274
390 HA VAL 54 HA VAL 54 6.122 4.322 -3.873
391 HB VAL 54 HB VAL 54 6.253 1.598 -5.171
392 HG11 VAL 54 1HG1 VAL 54 6.637 3.160 -6.896
393 HG12 VAL 54 2HG1 VAL 54 7.603 4.199 -5.846
394 HG13 VAL 54 3HG1 VAL 54 8.235 2.636 -6.365
395 HG21 VAL 54 3HG2 VAL 54 8.591 1.641 -4.295
396 HG22 VAL 54 1HG2 VAL 54 8.170 3.097 -3.394
397 HG23 VAL 54 2HG2 VAL 54 7.351 1.575 -3.043
398 H GLN 55 H GLN 55 5.678 5.484 -5.723
399 HA GLN 55 HA GLN 55 3.004 5.146 -6.785
400 HB2 GLN 55 2HB GLN 55 5.093 7.263 -7.328
401 HB3 GLN 55 3HB GLN 55 3.438 7.298 -7.920
402 HG2 GLN 55 2HG GLN 55 4.232 7.302 -5.017
403 HG3 GLN 55 3HG GLN 55 3.793 8.730 -5.954
404 HE21 GLN 55 1HE2 GLN 55 2.514 7.773 -3.590
405 HE22 GLN 55 2HE2 GLN 55 0.881 7.392 -4.008
406 H THR 56 H THR 56 2.613 5.326 -9.136
407 HA THR 56 HA THR 56 3.765 3.272 -10.571
408 HB THR 56 HB THR 56 2.791 5.634 -12.110
409 HG1 THR 56 HG1 THR 56 1.237 4.094 -10.292
410 HG21 THR 56 3HG2 THR 56 3.090 3.820 -13.502
411 HG22 THR 56 1HG2 THR 56 1.393 3.628 -13.064
412 HG23 THR 56 2HG2 THR 56 2.626 2.655 -12.262
413 H ALA 57 H ALA 57 5.013 3.420 -12.623
414 HA ALA 57 HA ALA 57 6.798 5.668 -12.933
415 HB1 ALA 57 1HB ALA 57 8.687 4.841 -12.062
416 HB2 ALA 57 2HB ALA 57 7.621 3.760 -11.163
417 HB3 ALA 57 3HB ALA 57 8.367 3.215 -12.666
418 HA PRO 58 HA PRO 58 6.887 4.357 -17.120
419 HB2 PRO 58 2HB PRO 58 9.398 5.038 -17.893
420 HB3 PRO 58 3HB PRO 58 8.132 6.231 -17.581
421 HG2 PRO 58 2HG PRO 58 10.373 5.340 -15.807
422 HG3 PRO 58 3HG PRO 58 9.766 6.979 -16.105
423 HD2 PRO 58 2HD PRO 58 9.109 5.562 -13.894
424 HD3 PRO 58 3HD PRO 58 8.000 6.726 -14.646
425 H VAL 59 H VAL 59 6.767 2.060 -16.342
426 HA VAL 59 HA VAL 59 9.003 0.574 -17.457
427 HB VAL 59 HB VAL 59 8.026 0.059 -14.644
428 HG11 VAL 59 1HG1 VAL 59 8.458 -2.062 -15.466
429 HG12 VAL 59 2HG1 VAL 59 9.766 -1.502 -16.510
430 HG13 VAL 59 3HG1 VAL 59 10.011 -1.606 -14.766
431 HG21 VAL 59 3HG2 VAL 59 9.515 1.878 -14.540
432 HG22 VAL 59 1HG2 VAL 59 10.487 0.463 -14.136
433 HG23 VAL 59 2HG2 VAL 59 10.590 1.174 -15.747
434 H ALA 60 H ALA 60 8.430 -1.417 -18.281
435 HA ALA 60 HA ALA 60 5.655 -1.804 -18.839
436 HB1 ALA 60 1HB ALA 60 6.857 -2.523 -20.624
437 HB2 ALA 60 2HB ALA 60 8.195 -3.104 -19.632
438 HB3 ALA 60 3HB ALA 60 6.720 -4.060 -19.770
439 H GLU 61 H GLU 61 4.420 -2.378 -17.128
440 HA GLU 61 HA GLU 61 4.912 -5.001 -15.963
441 HB2 GLU 61 2HB GLU 61 4.362 -2.619 -14.192
442 HB3 GLU 61 3HB GLU 61 4.698 -4.269 -13.686
443 HG2 GLU 61 2HG GLU 61 6.957 -3.951 -14.863
444 HG3 GLU 61 3HG GLU 61 6.575 -2.231 -14.814
445 H THR 62 H THR 62 2.958 -5.187 -14.147
446 HA THR 62 HA THR 62 0.484 -4.221 -15.377
447 HB THR 62 HB THR 62 -0.520 -6.515 -15.146
448 HG1 THR 62 HG1 THR 62 1.033 -8.252 -15.111
449 HG21 THR 62 3HG2 THR 62 1.587 -5.794 -17.125
450 HG22 THR 62 1HG2 THR 62 -0.146 -6.022 -17.357
451 HG23 THR 62 2HG2 THR 62 0.911 -7.422 -17.173
452 H VAL 63 H VAL 63 -1.421 -5.281 -13.934
453 HA VAL 63 HA VAL 63 -0.923 -5.680 -11.186
454 HB VAL 63 HB VAL 63 -0.316 -3.265 -11.320
455 HG11 VAL 63 1HG1 VAL 63 -1.970 -2.706 -13.100
456 HG12 VAL 63 2HG1 VAL 63 -3.244 -2.825 -11.884
457 HG13 VAL 63 3HG1 VAL 63 -1.987 -1.598 -11.728
458 HG21 VAL 63 3HG2 VAL 63 -1.223 -4.365 -9.264
459 HG22 VAL 63 1HG2 VAL 63 -1.497 -2.625 -9.345
460 HG23 VAL 63 2HG2 VAL 63 -2.814 -3.742 -9.702
461 H ASN 64 H ASN 64 -2.835 -6.038 -9.981
462 HA ASN 64 HA ASN 64 -5.075 -6.833 -11.606
463 HB2 ASN 64 2HB ASN 64 -5.060 -6.867 -8.600
464 HB3 ASN 64 3HB ASN 64 -5.872 -7.964 -9.713
465 HD21 ASN 64 1HD2 ASN 64 -4.919 -9.823 -10.178
466 HD22 ASN 64 2HD2 ASN 64 -3.283 -10.233 -9.805
467 H LEU 65 H LEU 65 -7.340 -6.360 -10.561
468 HA LEU 65 HA LEU 65 -7.780 -3.891 -9.276
469 HB2 LEU 65 2HB LEU 65 -6.946 -3.220 -11.608
470 HB3 LEU 65 3HB LEU 65 -8.507 -3.802 -12.185
471 HG LEU 65 HG LEU 65 -9.636 -2.138 -10.778
472 HD11 LEU 65 1HD1 LEU 65 -7.791 -0.284 -10.072
473 HD12 LEU 65 2HD1 LEU 65 -6.907 -1.777 -9.760
474 HD13 LEU 65 3HD1 LEU 65 -8.461 -1.493 -8.977
475 HD21 LEU 65 3HD2 LEU 65 -9.527 -0.735 -12.496
476 HD22 LEU 65 1HD2 LEU 65 -8.191 -1.698 -13.126
477 HD23 LEU 65 2HD2 LEU 65 -7.864 -0.297 -12.106
478 H TRP 66 H TRP 66 -10.065 -3.351 -9.119
479 HA TRP 66 HA TRP 66 -12.234 -3.914 -8.735
480 HB2 TRP 66 2HB TRP 66 -11.818 -5.566 -11.236
481 HB3 TRP 66 3HB TRP 66 -13.384 -5.237 -10.500
482 HD1 TRP 66 HD1 TRP 66 -13.933 -2.443 -10.302
483 HE1 TRP 66 HE1 TRP 66 -13.549 -0.662 -12.120
484 HE3 TRP 66 HE3 TRP 66 -10.499 -4.928 -13.161
485 HZ2 TRP 66 HZ2 TRP 66 -11.996 -0.352 -14.457
486 HZ3 TRP 66 HZ3 TRP 66 -9.615 -3.820 -15.171
487 HH2 TRP 66 HH2 TRP 66 -10.349 -1.579 -15.805
488 H GLU 67 H GLU 67 -10.826 -5.126 -6.958
489 HA GLU 67 HA GLU 67 -11.541 -7.981 -7.032
490 HB2 GLU 67 2HB GLU 67 -9.271 -6.480 -5.819
491 HB3 GLU 67 3HB GLU 67 -9.850 -7.912 -4.978
492 HG2 GLU 67 2HG GLU 67 -8.272 -8.873 -6.286
493 HG3 GLU 67 3HG GLU 67 -9.645 -8.973 -7.387
494 H VAL 68 H VAL 68 -13.737 -7.013 -6.474
495 HA VAL 68 HA VAL 68 -13.981 -6.336 -3.635
496 HB VAL 68 HB VAL 68 -16.340 -5.803 -4.175
497 HG11 VAL 68 1HG1 VAL 68 -15.809 -3.708 -4.842
498 HG12 VAL 68 2HG1 VAL 68 -14.162 -4.286 -4.580
499 HG13 VAL 68 3HG1 VAL 68 -14.844 -4.270 -6.207
500 HG21 VAL 68 3HG2 VAL 68 -16.103 -5.646 -7.021
501 HG22 VAL 68 1HG2 VAL 68 -15.790 -7.301 -6.495
502 HG23 VAL 68 2HG2 VAL 68 -17.300 -6.505 -6.051
503 H GLU 69 H GLU 69 -13.239 -8.950 -4.061
504 HA GLU 69 HA GLU 69 -15.707 -10.412 -3.384
505 HB2 GLU 69 2HB GLU 69 -14.640 -11.001 -5.620
506 HB3 GLU 69 3HB GLU 69 -13.294 -11.654 -4.698
507 HG2 GLU 69 2HG GLU 69 -14.676 -13.479 -5.224
508 HG3 GLU 69 3HG GLU 69 -14.960 -13.127 -3.520
509 H HIS 70 H HIS 70 -15.632 -10.583 -1.226
510 HA HIS 70 HA HIS 70 -13.689 -12.256 -0.003
511 HB2 HIS 70 2HB HIS 70 -12.784 -10.587 1.598
512 HB3 HIS 70 3HB HIS 70 -12.299 -10.270 -0.065
513 HD1 HIS 70 HD1 HIS 70 -14.629 -8.981 2.605
514 HD2 HIS 70 HD2 HIS 70 -13.070 -7.824 -1.068
515 HE1 HIS 70 HE1 HIS 70 -15.294 -6.572 2.321
516 H HIS 71 H HIS 71 -14.387 -13.039 1.954
517 HA HIS 71 HA HIS 71 -17.141 -12.532 2.610
518 HB2 HIS 71 2HB HIS 71 -15.996 -14.800 2.681
519 HB3 HIS 71 3HB HIS 71 -15.204 -14.253 4.156
520 HD1 HIS 71 HD1 HIS 71 -17.618 -16.490 3.520
521 HD2 HIS 71 HD2 HIS 71 -17.752 -12.962 5.710
522 HE1 HIS 71 HE1 HIS 71 -19.563 -16.749 5.093
Start of MODEL 8
1 H1 MET 1 H MET 1 3.277 0.302 1.265
2 HA MET 1 HA MET 1 3.585 -0.132 -1.634
3 HB2 MET 1 2HB MET 1 5.232 1.784 0.010
4 HB3 MET 1 3HB MET 1 5.132 1.673 -1.742
5 HG2 MET 1 2HG MET 1 2.889 2.529 0.072
6 HG3 MET 1 3HG MET 1 3.936 3.614 -0.840
7 HE1 MET 1 3HE MET 1 0.565 2.251 -0.737
8 HE2 MET 1 1HE MET 1 0.884 3.945 -1.110
9 HE3 MET 1 2HE MET 1 0.044 2.928 -2.281
10 H LYS 2 H LYS 2 3.943 -2.357 -0.373
11 HA LYS 2 HA LYS 2 6.803 -2.597 0.271
12 HB2 LYS 2 2HB LYS 2 6.263 -4.637 1.437
13 HB3 LYS 2 3HB LYS 2 5.186 -3.365 1.998
14 HG2 LYS 2 2HG LYS 2 3.586 -4.321 0.164
15 HG3 LYS 2 3HG LYS 2 4.586 -5.765 0.341
16 HD2 LYS 2 2HD LYS 2 4.003 -6.025 2.599
17 HD3 LYS 2 3HD LYS 2 3.388 -4.375 2.719
18 HE2 LYS 2 2HE LYS 2 1.471 -4.903 1.428
19 HE3 LYS 2 3HE LYS 2 2.145 -6.456 0.936
20 HZ1 LYS 2 3HZ LYS 2 1.871 -7.312 3.107
21 HZ2 LYS 2 1HZ LYS 2 0.411 -6.552 2.715
22 HZ3 LYS 2 2HZ LYS 2 1.508 -5.791 3.754
23 H THR 3 H THR 3 8.028 -4.304 -0.636
24 HA THR 3 HA THR 3 6.850 -5.738 -2.896
25 HB THR 3 HB THR 3 7.765 -3.764 -3.952
26 HG1 THR 3 HG1 THR 3 8.104 -5.737 -5.056
27 HG21 THR 3 3HG2 THR 3 9.562 -2.705 -3.172
28 HG22 THR 3 1HG2 THR 3 10.565 -4.122 -3.478
29 HG23 THR 3 2HG2 THR 3 9.730 -3.949 -1.934
30 H PHE 4 H PHE 4 8.168 -7.521 -3.651
31 HA PHE 4 HA PHE 4 9.450 -8.879 -1.475
32 HB2 PHE 4 2HB PHE 4 9.395 -9.780 -4.354
33 HB3 PHE 4 3HB PHE 4 9.536 -10.777 -2.910
34 HD1 PHE 4 HD2 PHE 4 7.466 -10.269 -1.192
35 HD2 PHE 4 HD1 PHE 4 7.391 -9.932 -5.435
36 HE1 PHE 4 HE2 PHE 4 5.026 -10.582 -1.170
37 HE2 PHE 4 HE1 PHE 4 4.950 -10.243 -5.419
38 HZ PHE 4 HZ PHE 4 3.765 -10.570 -3.286
39 H ALA 5 H ALA 5 11.515 -8.731 -0.935
40 HA ALA 5 HA ALA 5 13.401 -7.343 -2.590
41 HB1 ALA 5 1HB ALA 5 13.375 -7.175 -0.116
42 HB2 ALA 5 2HB ALA 5 13.918 -8.851 -0.032
43 HB3 ALA 5 3HB ALA 5 14.949 -7.627 -0.772
44 H LEU 6 H LEU 6 14.360 -8.271 -4.271
45 HA LEU 6 HA LEU 6 14.985 -11.142 -4.141
46 HB2 LEU 6 2HB LEU 6 14.748 -9.339 -6.545
47 HB3 LEU 6 3HB LEU 6 15.095 -11.066 -6.584
48 HG LEU 6 HG LEU 6 12.666 -10.687 -5.155
49 HD11 LEU 6 1HD1 LEU 6 12.525 -9.474 -7.898
50 HD12 LEU 6 2HD1 LEU 6 12.698 -8.496 -6.441
51 HD13 LEU 6 3HD1 LEU 6 11.280 -9.523 -6.650
52 HD21 LEU 6 3HD2 LEU 6 12.642 -11.677 -7.940
53 HD22 LEU 6 1HD2 LEU 6 11.980 -12.395 -6.471
54 HD23 LEU 6 2HD2 LEU 6 13.707 -12.516 -6.811
55 H GLN 7 H GLN 7 16.907 -11.500 -5.919
56 HA GLN 7 HA GLN 7 19.258 -10.823 -4.650
57 HB2 GLN 7 2HB GLN 7 20.413 -11.525 -6.676
58 HB3 GLN 7 3HB GLN 7 19.071 -12.607 -6.331
59 HG2 GLN 7 2HG GLN 7 17.885 -10.799 -7.970
60 HG3 GLN 7 3HG GLN 7 19.527 -10.831 -8.612
61 HE21 GLN 7 1HE2 GLN 7 19.514 -12.065 -10.350
62 HE22 GLN 7 2HE2 GLN 7 18.797 -13.632 -10.477
63 H GLY 8 H GLY 8 20.386 -9.006 -4.446
64 HA2 GLY 8 2HA GLY 8 21.229 -6.909 -4.862
65 HA3 GLY 8 3HA GLY 8 20.803 -7.155 -6.550
66 H ASP 9 H ASP 9 18.257 -7.493 -4.282
67 HA ASP 9 HA ASP 9 17.326 -4.763 -4.878
68 HB2 ASP 9 2HB ASP 9 15.865 -7.374 -5.100
69 HB3 ASP 9 3HB ASP 9 14.976 -5.894 -4.755
70 H THR 10 H THR 10 18.689 -5.995 -2.523
71 HA THR 10 HA THR 10 16.768 -6.222 -0.426
72 HB THR 10 HB THR 10 18.588 -6.402 1.073
73 HG1 THR 10 HG1 THR 10 20.733 -5.754 0.390
74 HG21 THR 10 3HG2 THR 10 19.984 -8.074 0.082
75 HG22 THR 10 1HG2 THR 10 19.676 -7.451 -1.538
76 HG23 THR 10 2HG2 THR 10 18.380 -8.231 -0.632
77 H LEU 11 H LEU 11 17.283 -4.756 1.627
78 HA LEU 11 HA LEU 11 16.144 -2.290 1.218
79 HB2 LEU 11 2HB LEU 11 18.040 -3.181 3.380
80 HB3 LEU 11 3HB LEU 11 17.161 -1.655 3.424
81 HG LEU 11 HG LEU 11 15.777 -4.323 3.263
82 HD11 LEU 11 1HD1 LEU 11 16.693 -4.652 5.306
83 HD12 LEU 11 2HD1 LEU 11 15.370 -3.596 5.799
84 HD13 LEU 11 3HD1 LEU 11 16.989 -2.934 5.575
85 HD21 LEU 11 3HD2 LEU 11 13.830 -3.178 3.659
86 HD22 LEU 11 1HD2 LEU 11 14.715 -1.989 2.703
87 HD23 LEU 11 2HD2 LEU 11 14.651 -1.837 4.459
88 H ASP 12 H ASP 12 19.582 -3.115 1.270
89 HA ASP 12 HA ASP 12 20.681 -0.571 1.178
90 HB2 ASP 12 2HB ASP 12 22.201 -2.337 1.469
91 HB3 ASP 12 3HB ASP 12 21.588 -3.215 0.069
92 H ALA 13 H ALA 13 19.289 -2.512 -1.403
93 HA ALA 13 HA ALA 13 20.015 -0.562 -3.429
94 HB1 ALA 13 1HB ALA 13 18.258 -2.361 -4.591
95 HB2 ALA 13 2HB ALA 13 20.020 -2.430 -4.640
96 HB3 ALA 13 3HB ALA 13 19.137 -3.322 -3.401
97 H ILE 14 H ILE 14 16.984 -1.953 -2.162
98 HA ILE 14 HA ILE 14 15.172 -0.384 -3.516
99 HB ILE 14 HB ILE 14 14.960 -1.350 -0.662
100 HG12 ILE 14 2HG1 ILE 14 13.840 -2.589 -3.180
101 HG13 ILE 14 3HG1 ILE 14 15.370 -3.077 -2.460
102 HG21 ILE 14 1HG2 ILE 14 12.531 -1.154 -0.995
103 HG22 ILE 14 2HG2 ILE 14 13.347 0.405 -1.095
104 HG23 ILE 14 3HG2 ILE 14 12.821 -0.410 -2.567
105 HD11 ILE 14 3HD1 ILE 14 13.180 -3.069 -0.553
106 HD12 ILE 14 1HD1 ILE 14 12.909 -4.153 -1.917
107 HD13 ILE 14 2HD1 ILE 14 14.358 -4.326 -0.927
108 H CYS 15 H CYS 15 16.729 0.328 -0.398
109 HA CYS 15 HA CYS 15 15.483 2.768 0.109
110 HB2 CYS 15 2HB CYS 15 18.191 1.695 0.886
111 HB3 CYS 15 3HB CYS 15 17.614 3.263 1.437
112 HG CYS 15 HG CYS 15 16.553 0.167 2.319
113 H VAL 16 H VAL 16 18.063 1.953 -2.072
114 HA VAL 16 HA VAL 16 18.808 4.722 -2.521
115 HB VAL 16 HB VAL 16 19.723 2.189 -3.891
116 HG11 VAL 16 1HG1 VAL 16 21.650 3.948 -4.457
117 HG12 VAL 16 2HG1 VAL 16 20.260 3.684 -5.511
118 HG13 VAL 16 3HG1 VAL 16 20.276 5.052 -4.397
119 HG21 VAL 16 3HG2 VAL 16 20.319 2.551 -1.450
120 HG22 VAL 16 1HG2 VAL 16 21.667 2.304 -2.560
121 HG23 VAL 16 2HG2 VAL 16 21.278 3.928 -1.992
122 H ARG 17 H ARG 17 16.833 2.252 -3.992
123 HA ARG 17 HA ARG 17 16.477 3.746 -6.449
124 HB2 ARG 17 2HB ARG 17 15.472 1.872 -7.300
125 HB3 ARG 17 3HB ARG 17 16.444 1.130 -6.036
126 HG2 ARG 17 2HG ARG 17 14.472 1.177 -4.546
127 HG3 ARG 17 3HG ARG 17 13.516 1.809 -5.888
128 HD2 ARG 17 2HD ARG 17 15.083 -0.687 -6.305
129 HD3 ARG 17 3HD ARG 17 13.602 -0.773 -5.351
130 HE ARG 17 HE ARG 17 13.183 0.605 -7.803
131 HH11 ARG 17 1HH1 ARG 17 13.549 -2.570 -6.423
132 HH12 ARG 17 2HH1 ARG 17 12.629 -3.357 -7.663
133 HH21 ARG 17 1HH2 ARG 17 11.970 -0.419 -9.440
134 HH22 ARG 17 2HH2 ARG 17 11.732 -2.133 -9.379
135 H TYR 18 H TYR 18 15.149 3.776 -3.360
136 HA TYR 18 HA TYR 18 12.613 4.914 -4.323
137 HB2 TYR 18 2HB TYR 18 13.368 3.332 -1.944
138 HB3 TYR 18 3HB TYR 18 12.235 4.647 -1.651
139 HD1 TYR 18 HD1 TYR 18 12.744 1.435 -3.342
140 HD2 TYR 18 HD2 TYR 18 9.994 4.588 -2.569
141 HE1 TYR 18 HE1 TYR 18 10.903 0.020 -4.154
142 HE2 TYR 18 HE2 TYR 18 8.145 3.181 -3.378
143 HH TYR 18 HH TYR 18 8.734 0.018 -4.812
144 H TYR 19 H TYR 19 14.848 5.372 -1.577
145 HA TYR 19 HA TYR 19 14.167 8.211 -1.539
146 HB2 TYR 19 2HB TYR 19 16.003 6.809 0.394
147 HB3 TYR 19 3HB TYR 19 15.083 8.290 0.638
148 HD1 TYR 19 HD2 TYR 19 12.649 8.184 1.033
149 HD2 TYR 19 HD1 TYR 19 15.007 4.656 0.734
150 HE1 TYR 19 HE2 TYR 19 10.830 6.889 2.064
151 HE2 TYR 19 HE1 TYR 19 13.195 3.350 1.763
152 HH TYR 19 HH TYR 19 11.033 3.378 2.392
153 H GLY 20 H GLY 20 16.890 6.058 -2.098
154 HA2 GLY 20 2HA GLY 20 18.685 6.572 -3.545
155 HA3 GLY 20 3HA GLY 20 18.320 8.280 -3.352
156 H ARG 21 H ARG 21 18.479 6.278 -0.537
157 HA ARG 21 HA ARG 21 21.254 6.662 0.006
158 HB2 ARG 21 2HB ARG 21 21.043 8.229 1.861
159 HB3 ARG 21 3HB ARG 21 20.468 8.963 0.369
160 HG2 ARG 21 2HG ARG 21 18.487 7.626 2.134
161 HG3 ARG 21 3HG ARG 21 19.136 9.192 2.625
162 HD2 ARG 21 2HD ARG 21 18.568 9.763 0.084
163 HD3 ARG 21 3HD ARG 21 17.382 8.484 0.342
164 HE ARG 21 HE ARG 21 16.993 10.068 2.478
165 HH11 ARG 21 1HH1 ARG 21 17.225 10.742 -0.929
166 HH12 ARG 21 2HH1 ARG 21 16.167 12.112 -0.863
167 HH21 ARG 21 1HH2 ARG 21 15.599 11.870 2.579
168 HH22 ARG 21 2HH2 ARG 21 15.244 12.754 1.133
169 H THR 22 H THR 22 21.875 5.825 2.118
170 HA THR 22 HA THR 22 19.872 3.934 3.169
171 HB THR 22 HB THR 22 22.082 2.757 4.012
172 HG1 THR 22 HG1 THR 22 23.774 3.056 2.503
173 HG21 THR 22 3HG2 THR 22 20.561 2.591 1.499
174 HG22 THR 22 1HG2 THR 22 20.947 1.336 2.676
175 HG23 THR 22 2HG2 THR 22 22.141 1.809 1.467
176 H GLU 23 H GLU 23 22.084 6.472 3.920
177 HA GLU 23 HA GLU 23 22.232 5.968 6.736
178 HB2 GLU 23 2HB GLU 23 23.871 7.314 5.262
179 HB3 GLU 23 3HB GLU 23 22.727 8.637 5.442
180 HG2 GLU 23 2HG GLU 23 22.953 8.225 7.963
181 HG3 GLU 23 3HG GLU 23 24.389 7.295 7.537
182 H GLY 24 H GLY 24 20.508 6.125 8.010
183 HA2 GLY 24 2HA GLY 24 18.955 7.460 9.210
184 HA3 GLY 24 3HA GLY 24 18.860 8.543 7.828
185 H VAL 25 H VAL 25 18.639 5.982 6.131
186 HA VAL 25 HA VAL 25 15.728 5.813 6.350
187 HB VAL 25 HB VAL 25 17.484 4.712 4.155
188 HG11 VAL 25 1HG1 VAL 25 14.698 5.517 3.646
189 HG12 VAL 25 2HG1 VAL 25 15.603 4.118 3.063
190 HG13 VAL 25 3HG1 VAL 25 14.907 4.107 4.684
191 HG21 VAL 25 3HG2 VAL 25 17.886 7.038 4.138
192 HG22 VAL 25 1HG2 VAL 25 16.665 6.756 2.897
193 HG23 VAL 25 2HG2 VAL 25 16.193 7.411 4.465
194 H VAL 26 H VAL 26 18.584 3.717 6.217
195 HA VAL 26 HA VAL 26 17.329 1.241 6.299
196 HB VAL 26 HB VAL 26 19.407 0.386 7.349
197 HG11 VAL 26 1HG1 VAL 26 19.368 2.082 4.920
198 HG12 VAL 26 2HG1 VAL 26 20.944 1.545 5.506
199 HG13 VAL 26 3HG1 VAL 26 19.703 0.360 5.096
200 HG21 VAL 26 3HG2 VAL 26 21.122 2.568 7.253
201 HG22 VAL 26 1HG2 VAL 26 19.682 3.175 8.071
202 HG23 VAL 26 2HG2 VAL 26 20.525 1.760 8.702
203 H GLU 27 H GLU 27 17.713 3.622 8.785
204 HA GLU 27 HA GLU 27 17.200 1.835 10.977
205 HB2 GLU 27 2HB GLU 27 17.461 4.805 10.676
206 HB3 GLU 27 3HB GLU 27 16.782 4.135 12.153
207 HG2 GLU 27 2HG GLU 27 19.470 3.380 11.034
208 HG3 GLU 27 3HG GLU 27 19.214 4.614 12.266
209 H THR 28 H THR 28 15.311 3.825 8.836
210 HA THR 28 HA THR 28 12.935 3.887 10.398
211 HB THR 28 HB THR 28 12.749 4.021 7.430
212 HG1 THR 28 HG1 THR 28 14.353 5.684 9.033
213 HG21 THR 28 3HG2 THR 28 11.753 6.276 8.921
214 HG22 THR 28 1HG2 THR 28 11.171 4.767 9.623
215 HG23 THR 28 2HG2 THR 28 10.873 5.121 7.921
216 H VAL 29 H VAL 29 13.595 2.122 7.364
217 HA VAL 29 HA VAL 29 11.382 0.473 7.389
218 HB VAL 29 HB VAL 29 14.124 -0.323 6.403
219 HG11 VAL 29 1HG1 VAL 29 11.370 -1.386 6.005
220 HG12 VAL 29 2HG1 VAL 29 12.522 -1.482 4.672
221 HG13 VAL 29 3HG1 VAL 29 12.893 -2.249 6.217
222 HG21 VAL 29 3HG2 VAL 29 12.537 0.562 4.269
223 HG22 VAL 29 1HG2 VAL 29 12.363 1.776 5.536
224 HG23 VAL 29 2HG2 VAL 29 13.966 1.346 4.942
225 H LEU 30 H LEU 30 14.495 0.020 8.992
226 HA LEU 30 HA LEU 30 14.240 -2.607 9.829
227 HB2 LEU 30 2HB LEU 30 15.686 -0.219 10.812
228 HB3 LEU 30 3HB LEU 30 15.524 -1.569 11.934
229 HG LEU 30 HG LEU 30 16.730 -1.802 9.180
230 HD11 LEU 30 1HD1 LEU 30 18.687 -2.147 11.156
231 HD12 LEU 30 2HD1 LEU 30 17.824 -0.667 11.575
232 HD13 LEU 30 3HD1 LEU 30 18.558 -0.838 9.980
233 HD21 LEU 30 3HD2 LEU 30 17.126 -3.673 11.482
234 HD22 LEU 30 1HD2 LEU 30 17.324 -3.967 9.754
235 HD23 LEU 30 2HD2 LEU 30 15.707 -3.817 10.443
236 H ALA 31 H ALA 31 13.142 0.346 11.476
237 HA ALA 31 HA ALA 31 12.074 -0.882 13.753
238 HB1 ALA 31 1HB ALA 31 12.420 1.664 13.033
239 HB2 ALA 31 2HB ALA 31 10.692 1.517 12.709
240 HB3 ALA 31 3HB ALA 31 11.319 1.178 14.322
241 H ALA 32 H ALA 32 10.688 -0.297 10.568
242 HA ALA 32 HA ALA 32 8.048 -1.143 11.303
243 HB1 ALA 32 1HB ALA 32 7.693 0.073 9.468
244 HB2 ALA 32 2HB ALA 32 9.366 -0.095 8.932
245 HB3 ALA 32 3HB ALA 32 8.189 -1.355 8.560
246 H ASN 33 H ASN 33 10.945 -2.706 10.252
247 HA ASN 33 HA ASN 33 9.530 -5.277 10.277
248 HB2 ASN 33 2HB ASN 33 11.223 -4.151 8.094
249 HB3 ASN 33 3HB ASN 33 11.336 -5.878 8.422
250 HD21 ASN 33 1HD2 ASN 33 9.166 -3.277 7.530
251 HD22 ASN 33 2HD2 ASN 33 7.973 -4.276 6.779
252 HA PRO 34 HA PRO 34 13.263 -5.258 13.038
253 HB2 PRO 34 2HB PRO 34 12.001 -6.424 15.140
254 HB3 PRO 34 3HB PRO 34 11.996 -4.678 14.865
255 HG2 PRO 34 2HG PRO 34 9.891 -6.704 14.212
256 HG3 PRO 34 3HG PRO 34 9.707 -5.087 14.916
257 HD2 PRO 34 2HD PRO 34 9.246 -5.597 12.297
258 HD3 PRO 34 3HD PRO 34 9.878 -4.040 12.870
259 H GLY 35 H GLY 35 14.630 -6.962 13.324
260 HA2 GLY 35 2HA GLY 35 15.223 -9.225 13.608
261 HA3 GLY 35 3HA GLY 35 13.593 -9.687 13.141
262 H LEU 36 H LEU 36 14.143 -7.590 10.850
263 HA LEU 36 HA LEU 36 14.848 -9.584 8.913
264 HB2 LEU 36 2HB LEU 36 13.311 -7.392 8.805
265 HB3 LEU 36 3HB LEU 36 14.806 -6.725 8.153
266 HG LEU 36 HG LEU 36 13.279 -7.446 6.385
267 HD11 LEU 36 1HD1 LEU 36 15.900 -7.742 6.394
268 HD12 LEU 36 2HD1 LEU 36 14.912 -8.311 5.049
269 HD13 LEU 36 3HD1 LEU 36 15.471 -9.448 6.275
270 HD21 LEU 36 3HD2 LEU 36 13.554 -10.261 6.543
271 HD22 LEU 36 1HD2 LEU 36 12.078 -9.297 6.592
272 HD23 LEU 36 2HD2 LEU 36 12.922 -9.693 8.089
273 H ALA 37 H ALA 37 16.498 -7.031 10.596
274 HA ALA 37 HA ALA 37 18.715 -6.767 8.851
275 HB1 ALA 37 1HB ALA 37 19.550 -6.186 11.483
276 HB2 ALA 37 2HB ALA 37 19.079 -5.055 10.213
277 HB3 ALA 37 3HB ALA 37 17.871 -5.665 11.344
278 H GLU 38 H GLU 38 17.772 -9.248 10.959
279 HA GLU 38 HA GLU 38 20.338 -10.196 11.744
280 HB2 GLU 38 2HB GLU 38 17.555 -11.255 11.806
281 HB3 GLU 38 3HB GLU 38 18.872 -12.409 11.962
282 HG2 GLU 38 2HG GLU 38 18.553 -11.936 14.150
283 HG3 GLU 38 3HG GLU 38 19.706 -10.661 13.762
284 H LEU 39 H LEU 39 18.430 -10.501 8.881
285 HA LEU 39 HA LEU 39 19.317 -12.875 7.785
286 HB2 LEU 39 2HB LEU 39 17.674 -11.006 6.921
287 HB3 LEU 39 3HB LEU 39 19.102 -10.474 6.035
288 HG LEU 39 HG LEU 39 18.095 -11.801 4.467
289 HD11 LEU 39 1HD1 LEU 39 20.381 -12.641 4.994
290 HD12 LEU 39 2HD1 LEU 39 19.318 -13.843 4.262
291 HD13 LEU 39 3HD1 LEU 39 19.637 -13.888 5.996
292 HD21 LEU 39 3HD2 LEU 39 17.109 -13.425 6.787
293 HD22 LEU 39 1HD2 LEU 39 17.045 -14.047 5.137
294 HD23 LEU 39 2HD2 LEU 39 16.181 -12.567 5.555
295 H GLY 40 H GLY 40 20.780 -9.647 7.357
296 HA2 GLY 40 2HA GLY 40 23.063 -9.149 7.280
297 HA3 GLY 40 3HA GLY 40 23.414 -10.870 7.237
298 H ALA 41 H ALA 41 23.540 -11.935 5.275
299 HA ALA 41 HA ALA 41 24.407 -10.443 3.066
300 HB1 ALA 41 1HB ALA 41 24.399 -13.120 3.796
301 HB2 ALA 41 2HB ALA 41 23.442 -13.064 2.316
302 HB3 ALA 41 3HB ALA 41 25.086 -12.428 2.326
303 H VAL 42 H VAL 42 23.251 -11.444 0.815
304 HA VAL 42 HA VAL 42 21.114 -9.749 0.340
305 HB VAL 42 HB VAL 42 21.659 -12.345 -1.107
306 HG11 VAL 42 1HG1 VAL 42 20.348 -9.827 -2.119
307 HG12 VAL 42 2HG1 VAL 42 20.520 -11.363 -2.971
308 HG13 VAL 42 3HG1 VAL 42 19.467 -11.248 -1.560
309 HG21 VAL 42 3HG2 VAL 42 22.728 -10.373 -2.650
310 HG22 VAL 42 1HG2 VAL 42 23.101 -9.793 -1.026
311 HG23 VAL 42 2HG2 VAL 42 23.646 -11.390 -1.540
312 H LEU 43 H LEU 43 18.947 -9.867 0.547
313 HA LEU 43 HA LEU 43 17.829 -11.823 2.284
314 HB2 LEU 43 2HB LEU 43 16.275 -9.929 0.545
315 HB3 LEU 43 3HB LEU 43 15.798 -10.629 2.091
316 HG LEU 43 HG LEU 43 18.129 -8.752 1.912
317 HD11 LEU 43 1HD1 LEU 43 16.698 -6.876 2.287
318 HD12 LEU 43 2HD1 LEU 43 15.269 -7.909 2.341
319 HD13 LEU 43 3HD1 LEU 43 16.148 -7.697 0.826
320 HD21 LEU 43 3HD2 LEU 43 16.335 -9.838 4.032
321 HD22 LEU 43 1HD2 LEU 43 17.068 -8.249 4.254
322 HD23 LEU 43 2HD2 LEU 43 18.091 -9.666 4.018
323 HA PRO 44 HA PRO 44 16.475 -14.926 -0.511
324 HB2 PRO 44 2HB PRO 44 14.202 -15.765 0.713
325 HB3 PRO 44 3HB PRO 44 15.817 -16.126 1.334
326 HG2 PRO 44 2HG PRO 44 13.889 -14.002 2.190
327 HG3 PRO 44 3HG PRO 44 14.897 -15.067 3.188
328 HD2 PRO 44 2HD PRO 44 15.569 -12.497 2.663
329 HD3 PRO 44 3HD PRO 44 16.781 -13.774 2.887
330 H HIS 45 H HIS 45 15.700 -14.475 -2.472
331 HA HIS 45 HA HIS 45 13.900 -12.503 -3.162
332 HB2 HIS 45 2HB HIS 45 13.575 -13.804 -5.289
333 HB3 HIS 45 3HB HIS 45 15.257 -13.515 -4.857
334 HD1 HIS 45 HD1 HIS 45 12.819 -16.202 -5.496
335 HD2 HIS 45 HD2 HIS 45 16.638 -15.840 -3.899
336 HE1 HIS 45 HE1 HIS 45 13.748 -18.539 -5.438
337 H GLY 46 H GLY 46 11.935 -12.286 -2.278
338 HA2 GLY 46 2HA GLY 46 9.640 -13.312 -2.894
339 HA3 GLY 46 3HA GLY 46 10.253 -14.679 -1.976
340 H THR 47 H THR 47 11.633 -12.306 -0.378
341 HA THR 47 HA THR 47 9.526 -12.224 1.626
342 HB THR 47 HB THR 47 12.391 -11.263 1.713
343 HG1 THR 47 HG1 THR 47 11.606 -13.647 1.808
344 HG21 THR 47 3HG2 THR 47 11.540 -9.905 3.328
345 HG22 THR 47 1HG2 THR 47 11.681 -11.375 4.291
346 HG23 THR 47 2HG2 THR 47 10.125 -10.924 3.593
347 H ALA 48 H ALA 48 8.083 -10.639 1.604
348 HA ALA 48 HA ALA 48 8.526 -8.198 0.153
349 HB1 ALA 48 1HB ALA 48 6.298 -9.639 0.855
350 HB2 ALA 48 2HB ALA 48 6.209 -8.236 1.921
351 HB3 ALA 48 3HB ALA 48 6.300 -8.011 0.174
352 H VAL 49 H VAL 49 8.801 -6.145 0.952
353 HA VAL 49 HA VAL 49 9.167 -5.873 3.859
354 HB VAL 49 HB VAL 49 10.974 -4.601 1.802
355 HG11 VAL 49 1HG1 VAL 49 10.619 -4.328 4.699
356 HG12 VAL 49 2HG1 VAL 49 12.290 -4.564 4.184
357 HG13 VAL 49 3HG1 VAL 49 11.346 -3.222 3.534
358 HG21 VAL 49 3HG2 VAL 49 11.427 -6.938 1.745
359 HG22 VAL 49 1HG2 VAL 49 12.690 -6.188 2.721
360 HG23 VAL 49 2HG2 VAL 49 11.370 -7.056 3.504
361 H GLU 50 H GLU 50 8.251 -4.117 4.746
362 HA GLU 50 HA GLU 50 6.629 -2.418 3.085
363 HB2 GLU 50 2HB GLU 50 5.747 -3.132 5.217
364 HB3 GLU 50 3HB GLU 50 7.129 -2.453 6.064
365 HG2 GLU 50 2HG GLU 50 5.223 -1.016 6.336
366 HG3 GLU 50 3HG GLU 50 6.440 -0.205 5.352
367 H LEU 51 H LEU 51 6.946 -0.315 2.555
368 HA LEU 51 HA LEU 51 9.526 0.868 3.342
369 HB2 LEU 51 2HB LEU 51 7.880 1.346 0.862
370 HB3 LEU 51 3HB LEU 51 9.393 2.160 1.254
371 HG LEU 51 HG LEU 51 9.400 -0.811 1.082
372 HD11 LEU 51 1HD1 LEU 51 8.597 -0.831 -0.991
373 HD12 LEU 51 2HD1 LEU 51 10.057 0.034 -1.470
374 HD13 LEU 51 3HD1 LEU 51 8.588 0.930 -1.084
375 HD21 LEU 51 3HD2 LEU 51 11.440 0.960 -0.137
376 HD22 LEU 51 1HD2 LEU 51 11.632 -0.553 0.749
377 HD23 LEU 51 2HD2 LEU 51 11.323 0.947 1.624
378 HA PRO 52 HA PRO 52 6.518 3.602 5.407
379 HB2 PRO 52 2HB PRO 52 8.270 4.427 7.309
380 HB3 PRO 52 3HB PRO 52 7.362 2.916 7.430
381 HG2 PRO 52 2HG PRO 52 10.189 3.362 6.551
382 HG3 PRO 52 3HG PRO 52 9.533 2.100 7.610
383 HD2 PRO 52 2HD PRO 52 10.104 1.660 5.000
384 HD3 PRO 52 3HD PRO 52 8.777 0.831 5.841
385 H ASP 53 H ASP 53 6.360 5.856 5.477
386 HA ASP 53 HA ASP 53 6.727 8.003 4.823
387 HB2 ASP 53 2HB ASP 53 9.668 7.319 4.756
388 HB3 ASP 53 3HB ASP 53 8.937 8.905 4.988
389 H VAL 54 H VAL 54 6.063 6.186 2.840
390 HA VAL 54 HA VAL 54 7.528 7.286 0.532
391 HB VAL 54 HB VAL 54 6.427 4.483 0.781
392 HG11 VAL 54 1HG1 VAL 54 7.741 5.916 -1.520
393 HG12 VAL 54 2HG1 VAL 54 7.525 4.166 -1.445
394 HG13 VAL 54 3HG1 VAL 54 6.118 5.229 -1.466
395 HG21 VAL 54 3HG2 VAL 54 8.443 4.540 1.988
396 HG22 VAL 54 1HG2 VAL 54 8.883 3.916 0.398
397 HG23 VAL 54 2HG2 VAL 54 9.218 5.598 0.809
398 H GLN 55 H GLN 55 6.318 7.962 -1.188
399 HA GLN 55 HA GLN 55 3.409 7.577 -1.041
400 HB2 GLN 55 2HB GLN 55 4.755 10.195 -1.724
401 HB3 GLN 55 3HB GLN 55 3.024 9.899 -1.621
402 HG2 GLN 55 2HG GLN 55 3.378 10.876 0.399
403 HG3 GLN 55 3HG GLN 55 3.626 9.186 0.835
404 HE21 GLN 55 1HE2 GLN 55 5.471 11.939 -0.437
405 HE22 GLN 55 2HE2 GLN 55 6.875 11.664 0.532
406 H THR 56 H THR 56 6.162 8.561 -3.043
407 HA THR 56 HA THR 56 4.833 8.496 -5.521
408 HB THR 56 HB THR 56 7.069 8.334 -6.537
409 HG1 THR 56 HG1 THR 56 8.543 7.329 -5.409
410 HG21 THR 56 3HG2 THR 56 7.928 10.416 -5.741
411 HG22 THR 56 1HG2 THR 56 7.136 10.215 -4.179
412 HG23 THR 56 2HG2 THR 56 6.170 10.498 -5.628
413 H ALA 57 H ALA 57 3.661 6.716 -6.011
414 HA ALA 57 HA ALA 57 5.062 4.122 -5.979
415 HB1 ALA 57 1HB ALA 57 3.323 3.256 -4.913
416 HB2 ALA 57 2HB ALA 57 2.569 4.851 -4.864
417 HB3 ALA 57 3HB ALA 57 2.247 3.765 -6.216
418 HA PRO 58 HA PRO 58 4.601 3.724 -10.325
419 HB2 PRO 58 2HB PRO 58 4.002 1.092 -10.610
420 HB3 PRO 58 3HB PRO 58 5.608 1.667 -10.148
421 HG2 PRO 58 2HG PRO 58 3.411 0.594 -8.421
422 HG3 PRO 58 3HG PRO 58 5.150 0.257 -8.355
423 HD2 PRO 58 2HD PRO 58 3.937 1.994 -6.669
424 HD3 PRO 58 3HD PRO 58 5.612 2.208 -7.218
425 H VAL 59 H VAL 59 3.052 2.418 -11.974
426 HA VAL 59 HA VAL 59 0.408 3.517 -11.481
427 HB VAL 59 HB VAL 59 -0.058 2.957 -13.822
428 HG11 VAL 59 1HG1 VAL 59 2.616 4.195 -14.037
429 HG12 VAL 59 2HG1 VAL 59 1.052 4.757 -14.629
430 HG13 VAL 59 3HG1 VAL 59 1.479 4.964 -12.930
431 HG21 VAL 59 3HG2 VAL 59 2.491 2.277 -14.806
432 HG22 VAL 59 1HG2 VAL 59 2.162 1.189 -13.457
433 HG23 VAL 59 2HG2 VAL 59 1.031 1.289 -14.806
434 H ALA 60 H ALA 60 -1.485 2.153 -12.315
435 HA ALA 60 HA ALA 60 -1.786 -0.092 -10.669
436 HB1 ALA 60 1HB ALA 60 -3.932 -0.248 -11.484
437 HB2 ALA 60 2HB ALA 60 -3.552 1.439 -11.833
438 HB3 ALA 60 3HB ALA 60 -3.464 0.231 -13.116
439 H GLU 61 H GLU 61 -2.711 -2.227 -11.776
440 HA GLU 61 HA GLU 61 -1.391 -3.107 -14.141
441 HB2 GLU 61 2HB GLU 61 0.466 -3.064 -12.401
442 HB3 GLU 61 3HB GLU 61 -0.391 -4.368 -11.592
443 HG2 GLU 61 2HG GLU 61 0.419 -4.562 -14.470
444 HG3 GLU 61 3HG GLU 61 1.517 -4.990 -13.160
445 H THR 62 H THR 62 -2.673 -4.588 -15.009
446 HA THR 62 HA THR 62 -3.851 -6.697 -13.445
447 HB THR 62 HB THR 62 -6.184 -5.995 -14.536
448 HG1 THR 62 HG1 THR 62 -6.416 -3.853 -14.757
449 HG21 THR 62 3HG2 THR 62 -6.901 -5.481 -12.402
450 HG22 THR 62 1HG2 THR 62 -5.442 -4.568 -12.017
451 HG23 THR 62 2HG2 THR 62 -5.394 -6.330 -12.062
452 H VAL 63 H VAL 63 -3.402 -8.381 -14.700
453 HA VAL 63 HA VAL 63 -4.285 -8.344 -17.484
454 HB VAL 63 HB VAL 63 -1.494 -9.172 -16.676
455 HG11 VAL 63 1HG1 VAL 63 -1.829 -10.595 -18.406
456 HG12 VAL 63 2HG1 VAL 63 -3.124 -9.619 -19.102
457 HG13 VAL 63 3HG1 VAL 63 -1.440 -9.159 -19.352
458 HG21 VAL 63 3HG2 VAL 63 -1.776 -6.742 -16.765
459 HG22 VAL 63 1HG2 VAL 63 -0.751 -7.318 -18.080
460 HG23 VAL 63 2HG2 VAL 63 -2.428 -6.876 -18.398
461 H ASN 64 H ASN 64 -5.524 -10.064 -17.780
462 HA ASN 64 HA ASN 64 -5.848 -12.147 -15.964
463 HB2 ASN 64 2HB ASN 64 -6.415 -12.318 -18.928
464 HB3 ASN 64 3HB ASN 64 -7.199 -13.225 -17.638
465 HD21 ASN 64 1HD2 ASN 64 -8.689 -12.187 -16.304
466 HD22 ASN 64 2HD2 ASN 64 -9.424 -10.688 -16.751
467 H LEU 65 H LEU 65 -5.638 -14.550 -16.761
468 HA LEU 65 HA LEU 65 -2.798 -14.943 -17.364
469 HB2 LEU 65 2HB LEU 65 -4.120 -15.920 -15.317
470 HB3 LEU 65 3HB LEU 65 -4.607 -17.145 -16.487
471 HG LEU 65 HG LEU 65 -2.718 -17.909 -15.165
472 HD11 LEU 65 1HD1 LEU 65 -1.654 -17.293 -17.900
473 HD12 LEU 65 2HD1 LEU 65 -2.984 -18.424 -17.655
474 HD13 LEU 65 3HD1 LEU 65 -1.413 -18.736 -16.916
475 HD21 LEU 65 3HD2 LEU 65 -0.581 -16.375 -16.146
476 HD22 LEU 65 1HD2 LEU 65 -1.178 -16.463 -14.489
477 HD23 LEU 65 2HD2 LEU 65 -1.798 -15.227 -15.585
478 H TRP 66 H TRP 66 -2.738 -14.832 -19.585
479 HA TRP 66 HA TRP 66 -2.962 -15.504 -21.748
480 HB2 TRP 66 2HB TRP 66 -3.270 -18.074 -20.224
481 HB3 TRP 66 3HB TRP 66 -3.406 -18.055 -21.980
482 HD1 TRP 66 HD1 TRP 66 -0.940 -18.869 -19.563
483 HE1 TRP 66 HE1 TRP 66 1.458 -18.490 -20.416
484 HE3 TRP 66 HE3 TRP 66 -1.970 -15.883 -23.583
485 HZ2 TRP 66 HZ2 TRP 66 2.744 -17.108 -22.514
486 HZ3 TRP 66 HZ3 TRP 66 -0.099 -15.074 -24.961
487 HH2 TRP 66 HH2 TRP 66 2.208 -15.674 -24.436
488 H GLU 67 H GLU 67 -5.238 -14.292 -20.683
489 HA GLU 67 HA GLU 67 -7.415 -15.804 -21.972
490 HB2 GLU 67 2HB GLU 67 -7.484 -15.170 -19.430
491 HB3 GLU 67 3HB GLU 67 -7.922 -13.578 -20.033
492 HG2 GLU 67 2HG GLU 67 -9.855 -14.489 -21.154
493 HG3 GLU 67 3HG GLU 67 -9.393 -16.122 -20.677
494 H VAL 68 H VAL 68 -5.534 -14.122 -23.358
495 HA VAL 68 HA VAL 68 -7.105 -11.746 -24.040
496 HB VAL 68 HB VAL 68 -4.669 -11.490 -23.611
497 HG11 VAL 68 1HG1 VAL 68 -3.026 -12.402 -25.005
498 HG12 VAL 68 2HG1 VAL 68 -4.142 -13.739 -24.718
499 HG13 VAL 68 3HG1 VAL 68 -4.198 -12.854 -26.242
500 HG21 VAL 68 3HG2 VAL 68 -4.861 -10.791 -26.458
501 HG22 VAL 68 1HG2 VAL 68 -6.213 -10.250 -25.463
502 HG23 VAL 68 2HG2 VAL 68 -4.567 -9.766 -25.054
503 H GLU 69 H GLU 69 -6.188 -14.854 -25.261
504 HA GLU 69 HA GLU 69 -6.633 -14.400 -28.012
505 HB2 GLU 69 2HB GLU 69 -5.420 -16.357 -27.239
506 HB3 GLU 69 3HB GLU 69 -6.843 -16.938 -26.385
507 HG2 GLU 69 2HG GLU 69 -6.562 -18.174 -28.425
508 HG3 GLU 69 3HG GLU 69 -8.011 -17.176 -28.534
509 H HIS 70 H HIS 70 -8.524 -13.298 -28.392
510 HA HIS 70 HA HIS 70 -11.011 -14.730 -27.717
511 HB2 HIS 70 2HB HIS 70 -10.549 -12.392 -26.680
512 HB3 HIS 70 3HB HIS 70 -10.923 -11.782 -28.289
513 HD1 HIS 70 HD1 HIS 70 -13.154 -10.723 -27.888
514 HD2 HIS 70 HD2 HIS 70 -12.957 -14.610 -26.433
515 HE1 HIS 70 HE1 HIS 70 -15.499 -11.297 -27.181
516 H HIS 71 H HIS 71 -9.677 -12.402 -30.068
517 HA HIS 71 HA HIS 71 -11.613 -12.985 -32.061
518 HB2 HIS 71 2HB HIS 71 -10.260 -10.865 -31.895
519 HB3 HIS 71 3HB HIS 71 -8.876 -11.777 -32.489
520 HD1 HIS 71 HD1 HIS 71 -12.469 -11.243 -33.655
521 HD2 HIS 71 HD2 HIS 71 -8.598 -11.455 -35.148
522 HE1 HIS 71 HE1 HIS 71 -12.680 -10.841 -36.128
Start of MODEL 9
1 H1 MET 1 H MET 1 1.475 -1.163 -0.481
2 HA MET 1 HA MET 1 0.580 -3.276 -2.325
3 HB2 MET 1 2HB MET 1 1.034 -1.196 -3.567
4 HB3 MET 1 3HB MET 1 2.661 -1.159 -2.901
5 HG2 MET 1 2HG MET 1 3.030 -2.069 -4.969
6 HG3 MET 1 3HG MET 1 2.868 -3.514 -3.973
7 HE1 MET 1 3HE MET 1 1.345 -5.307 -6.548
8 HE2 MET 1 1HE MET 1 2.356 -5.167 -5.108
9 HE3 MET 1 2HE MET 1 0.638 -5.533 -4.947
10 H LYS 2 H LYS 2 1.235 -4.751 -0.648
11 HA LYS 2 HA LYS 2 4.161 -5.032 -0.427
12 HB2 LYS 2 2HB LYS 2 3.804 -6.160 1.705
13 HB3 LYS 2 3HB LYS 2 3.075 -4.559 1.728
14 HG2 LYS 2 2HG LYS 2 0.928 -5.888 0.994
15 HG3 LYS 2 3HG LYS 2 1.784 -7.235 1.748
16 HD2 LYS 2 2HD LYS 2 2.054 -5.819 3.789
17 HD3 LYS 2 3HD LYS 2 1.016 -4.612 3.025
18 HE2 LYS 2 2HE LYS 2 -0.792 -6.247 2.891
19 HE3 LYS 2 3HE LYS 2 0.246 -7.467 3.627
20 HZ1 LYS 2 3HZ LYS 2 0.413 -5.955 5.584
21 HZ2 LYS 2 1HZ LYS 2 -1.134 -6.584 5.318
22 HZ3 LYS 2 2HZ LYS 2 -0.785 -4.988 4.884
23 H THR 3 H THR 3 5.068 -7.085 -0.650
24 HA THR 3 HA THR 3 3.291 -9.253 -1.506
25 HB THR 3 HB THR 3 4.014 -8.206 -3.579
26 HG1 THR 3 HG1 THR 3 4.194 -10.173 -4.317
27 HG21 THR 3 3HG2 THR 3 6.335 -7.609 -2.236
28 HG22 THR 3 1HG2 THR 3 6.083 -7.430 -3.972
29 HG23 THR 3 2HG2 THR 3 6.846 -8.888 -3.337
30 H PHE 4 H PHE 4 4.415 -11.364 -1.601
31 HA PHE 4 HA PHE 4 6.033 -11.716 0.738
32 HB2 PHE 4 2HB PHE 4 5.417 -13.810 -1.346
33 HB3 PHE 4 3HB PHE 4 5.809 -14.058 0.352
34 HD1 PHE 4 HD1 PHE 4 4.099 -12.400 1.849
35 HD2 PHE 4 HD2 PHE 4 3.262 -14.422 -1.802
36 HE1 PHE 4 HE1 PHE 4 1.701 -12.401 2.403
37 HE2 PHE 4 HE2 PHE 4 0.863 -14.425 -1.254
38 HZ PHE 4 HZ PHE 4 0.080 -13.413 0.850
39 H ALA 5 H ALA 5 8.180 -11.930 0.892
40 HA ALA 5 HA ALA 5 9.772 -11.580 -1.516
41 HB1 ALA 5 1HB ALA 5 10.664 -11.684 1.363
42 HB2 ALA 5 2HB ALA 5 11.625 -11.161 -0.020
43 HB3 ALA 5 3HB ALA 5 10.225 -10.217 0.488
44 H LEU 6 H LEU 6 10.320 -13.337 -2.627
45 HA LEU 6 HA LEU 6 10.885 -15.824 -1.163
46 HB2 LEU 6 2HB LEU 6 10.514 -15.670 -4.126
47 HB3 LEU 6 3HB LEU 6 10.260 -17.036 -3.042
48 HG LEU 6 HG LEU 6 8.488 -14.597 -3.151
49 HD11 LEU 6 1HD1 LEU 6 8.493 -15.956 -5.251
50 HD12 LEU 6 2HD1 LEU 6 6.938 -15.883 -4.422
51 HD13 LEU 6 3HD1 LEU 6 7.939 -17.329 -4.292
52 HD21 LEU 6 3HD2 LEU 6 8.624 -15.964 -1.018
53 HD22 LEU 6 1HD2 LEU 6 7.911 -17.288 -1.940
54 HD23 LEU 6 2HD2 LEU 6 7.022 -15.778 -1.734
55 H GLN 7 H GLN 7 12.416 -17.238 -2.789
56 HA GLN 7 HA GLN 7 14.987 -16.322 -2.405
57 HB2 GLN 7 2HB GLN 7 14.292 -18.670 -2.970
58 HB3 GLN 7 3HB GLN 7 14.141 -18.160 -4.646
59 HG2 GLN 7 2HG GLN 7 16.411 -17.924 -4.924
60 HG3 GLN 7 3HG GLN 7 16.706 -17.702 -3.200
61 HE21 GLN 7 1HE2 GLN 7 16.313 -19.618 -1.826
62 HE22 GLN 7 2HE2 GLN 7 16.733 -21.170 -2.460
63 H GLY 8 H GLY 8 16.162 -14.763 -3.298
64 HA2 GLY 8 2HA GLY 8 16.975 -13.259 -4.834
65 HA3 GLY 8 3HA GLY 8 16.245 -14.253 -6.086
66 H ASP 9 H ASP 9 14.163 -13.117 -3.604
67 HA ASP 9 HA ASP 9 13.196 -10.966 -5.370
68 HB2 ASP 9 2HB ASP 9 11.668 -13.152 -3.999
69 HB3 ASP 9 3HB ASP 9 10.890 -11.602 -4.307
70 H THR 10 H THR 10 14.957 -11.005 -2.955
71 HA THR 10 HA THR 10 13.473 -9.919 -0.777
72 HB THR 10 HB THR 10 15.535 -9.552 0.307
73 HG1 THR 10 HG1 THR 10 17.353 -9.038 -0.729
74 HG21 THR 10 3HG2 THR 10 16.166 -11.843 -1.545
75 HG22 THR 10 1HG2 THR 10 14.966 -11.956 -0.258
76 HG23 THR 10 2HG2 THR 10 16.655 -11.637 0.137
77 H LEU 11 H LEU 11 14.429 -7.693 0.118
78 HA LEU 11 HA LEU 11 13.278 -5.649 -1.314
79 HB2 LEU 11 2HB LEU 11 15.635 -5.394 0.547
80 HB3 LEU 11 3HB LEU 11 14.515 -4.108 0.100
81 HG LEU 11 HG LEU 11 13.549 -6.574 1.508
82 HD11 LEU 11 1HD1 LEU 11 13.726 -5.032 3.582
83 HD12 LEU 11 2HD1 LEU 11 14.991 -4.221 2.658
84 HD13 LEU 11 3HD1 LEU 11 15.146 -5.934 3.051
85 HD21 LEU 11 3HD2 LEU 11 11.723 -5.370 0.793
86 HD22 LEU 11 1HD2 LEU 11 12.542 -3.817 0.968
87 HD23 LEU 11 2HD2 LEU 11 11.981 -4.684 2.398
88 H ASP 12 H ASP 12 16.663 -6.692 -1.357
89 HA ASP 12 HA ASP 12 17.739 -4.698 -2.954
90 HB2 ASP 12 2HB ASP 12 18.423 -7.616 -2.654
91 HB3 ASP 12 3HB ASP 12 19.348 -6.554 -3.711
92 H ALA 13 H ALA 13 15.845 -7.511 -3.848
93 HA ALA 13 HA ALA 13 16.236 -7.042 -6.687
94 HB1 ALA 13 1HB ALA 13 14.181 -8.963 -5.800
95 HB2 ALA 13 2HB ALA 13 15.443 -9.129 -7.020
96 HB3 ALA 13 3HB ALA 13 15.839 -9.315 -5.312
97 H ILE 14 H ILE 14 13.437 -7.181 -4.476
98 HA ILE 14 HA ILE 14 11.475 -6.310 -6.200
99 HB ILE 14 HB ILE 14 11.730 -5.644 -3.265
100 HG12 ILE 14 2HG1 ILE 14 10.137 -7.857 -4.564
101 HG13 ILE 14 3HG1 ILE 14 11.767 -8.088 -3.941
102 HG21 ILE 14 1HG2 ILE 14 10.122 -4.191 -4.361
103 HG22 ILE 14 2HG2 ILE 14 9.319 -5.589 -5.075
104 HG23 ILE 14 3HG2 ILE 14 9.293 -5.354 -3.327
105 HD11 ILE 14 3HD1 ILE 14 9.978 -6.846 -2.015
106 HD12 ILE 14 1HD1 ILE 14 9.442 -8.441 -2.542
107 HD13 ILE 14 2HD1 ILE 14 11.049 -8.236 -1.842
108 H CYS 15 H CYS 15 13.646 -4.330 -4.206
109 HA CYS 15 HA CYS 15 12.585 -1.829 -4.869
110 HB2 CYS 15 2HB CYS 15 15.344 -2.695 -4.019
111 HB3 CYS 15 3HB CYS 15 14.944 -1.006 -4.306
112 HG CYS 15 HG CYS 15 12.676 -2.278 -2.316
113 H VAL 16 H VAL 16 14.712 -3.956 -6.617
114 HA VAL 16 HA VAL 16 15.451 -1.926 -8.553
115 HB VAL 16 HB VAL 16 16.028 -4.890 -8.473
116 HG11 VAL 16 1HG1 VAL 16 17.851 -3.978 -10.176
117 HG12 VAL 16 2HG1 VAL 16 16.261 -4.528 -10.709
118 HG13 VAL 16 3HG1 VAL 16 16.578 -2.804 -10.509
119 HG21 VAL 16 3HG2 VAL 16 17.080 -3.378 -6.731
120 HG22 VAL 16 1HG2 VAL 16 18.193 -4.324 -7.719
121 HG23 VAL 16 2HG2 VAL 16 17.948 -2.611 -8.060
122 H ARG 17 H ARG 17 13.138 -4.502 -8.206
123 HA ARG 17 HA ARG 17 12.410 -4.476 -11.012
124 HB2 ARG 17 2HB ARG 17 11.194 -6.368 -10.590
125 HB3 ARG 17 3HB ARG 17 12.337 -6.463 -9.258
126 HG2 ARG 17 2HG ARG 17 10.669 -5.403 -7.786
127 HG3 ARG 17 3HG ARG 17 9.521 -5.407 -9.127
128 HD2 ARG 17 2HD ARG 17 9.306 -7.308 -7.478
129 HD3 ARG 17 3HD ARG 17 9.440 -7.768 -9.175
130 HE ARG 17 HE ARG 17 11.947 -7.719 -7.752
131 HH11 ARG 17 1HH1 ARG 17 9.174 -9.622 -8.651
132 HH12 ARG 17 2HH1 ARG 17 9.989 -11.139 -8.459
133 HH21 ARG 17 1HH2 ARG 17 13.031 -9.709 -7.496
134 HH22 ARG 17 2HH2 ARG 17 12.183 -11.187 -7.801
135 H TYR 18 H TYR 18 11.655 -2.688 -8.259
136 HA TYR 18 HA TYR 18 9.050 -1.874 -9.357
137 HB2 TYR 18 2HB TYR 18 10.139 -2.073 -6.609
138 HB3 TYR 18 3HB TYR 18 9.094 -0.694 -6.930
139 HD1 TYR 18 HD1 TYR 18 9.266 -4.344 -6.673
140 HD2 TYR 18 HD2 TYR 18 6.736 -1.005 -7.417
141 HE1 TYR 18 HE1 TYR 18 7.292 -5.781 -6.376
142 HE2 TYR 18 HE2 TYR 18 4.755 -2.432 -7.121
143 HH TYR 18 HH TYR 18 4.995 -5.685 -5.928
144 H TYR 19 H TYR 19 11.744 -0.382 -7.551
145 HA TYR 19 HA TYR 19 11.216 2.150 -8.898
146 HB2 TYR 19 2HB TYR 19 13.374 1.722 -6.854
147 HB3 TYR 19 3HB TYR 19 12.472 3.188 -7.218
148 HD1 TYR 19 HD1 TYR 19 10.135 3.430 -6.424
149 HD2 TYR 19 HD2 TYR 19 12.555 0.121 -5.284
150 HE1 TYR 19 HE1 TYR 19 8.584 2.939 -4.579
151 HE2 TYR 19 HE2 TYR 19 11.010 -0.379 -3.437
152 HH TYR 19 HH TYR 19 9.050 0.114 -2.490
153 H GLY 20 H GLY 20 13.677 -0.348 -8.677
154 HA2 GLY 20 2HA GLY 20 15.160 -0.867 -10.445
155 HA3 GLY 20 3HA GLY 20 14.934 0.757 -11.079
156 H ARG 21 H ARG 21 15.463 0.638 -7.721
157 HA ARG 21 HA ARG 21 18.356 0.956 -7.998
158 HB2 ARG 21 2HB ARG 21 16.754 2.979 -6.446
159 HB3 ARG 21 3HB ARG 21 18.441 3.065 -6.936
160 HG2 ARG 21 2HG ARG 21 17.598 4.446 -8.503
161 HG3 ARG 21 3HG ARG 21 17.302 2.926 -9.350
162 HD2 ARG 21 2HD ARG 21 15.023 2.882 -8.584
163 HD3 ARG 21 3HD ARG 21 15.298 4.292 -7.561
164 HE ARG 21 HE ARG 21 15.803 4.740 -10.363
165 HH11 ARG 21 1HH1 ARG 21 13.429 4.779 -7.817
166 HH12 ARG 21 2HH1 ARG 21 12.390 5.905 -8.626
167 HH21 ARG 21 1HH2 ARG 21 14.444 6.223 -11.438
168 HH22 ARG 21 2HH2 ARG 21 12.967 6.725 -10.685
169 H THR 22 H THR 22 19.437 1.073 -5.836
170 HA THR 22 HA THR 22 17.905 -0.374 -3.778
171 HB THR 22 HB THR 22 20.338 -1.362 -3.288
172 HG1 THR 22 HG1 THR 22 21.532 -1.601 -5.104
173 HG21 THR 22 3HG2 THR 22 19.174 -2.893 -5.458
174 HG22 THR 22 1HG2 THR 22 17.947 -2.327 -4.326
175 HG23 THR 22 2HG2 THR 22 19.305 -3.291 -3.745
176 H GLU 23 H GLU 23 20.623 1.747 -4.521
177 HA GLU 23 HA GLU 23 21.357 2.271 -1.833
178 HB2 GLU 23 2HB GLU 23 22.474 4.315 -2.868
179 HB3 GLU 23 3HB GLU 23 22.994 2.744 -3.461
180 HG2 GLU 23 2HG GLU 23 21.775 2.994 -5.471
181 HG3 GLU 23 3HG GLU 23 20.912 4.401 -4.852
182 H GLY 24 H GLY 24 20.048 3.181 -0.391
183 HA2 GLY 24 2HA GLY 24 18.976 5.067 0.536
184 HA3 GLY 24 3HA GLY 24 18.737 5.700 -1.086
185 H VAL 25 H VAL 25 17.621 3.245 -2.148
186 HA VAL 25 HA VAL 25 14.895 3.683 -1.413
187 HB VAL 25 HB VAL 25 15.965 1.415 -3.090
188 HG11 VAL 25 1HG1 VAL 25 13.353 2.208 -2.272
189 HG12 VAL 25 2HG1 VAL 25 13.497 2.434 -4.016
190 HG13 VAL 25 3HG1 VAL 25 13.828 0.857 -3.300
191 HG21 VAL 25 3HG2 VAL 25 15.450 4.287 -3.794
192 HG22 VAL 25 1HG2 VAL 25 16.873 3.302 -4.133
193 HG23 VAL 25 2HG2 VAL 25 15.369 3.009 -5.007
194 H VAL 26 H VAL 26 16.979 0.790 -1.231
195 HA VAL 26 HA VAL 26 15.269 -0.877 0.147
196 HB VAL 26 HB VAL 26 17.264 -2.057 0.980
197 HG11 VAL 26 1HG1 VAL 26 16.631 -2.661 -1.200
198 HG12 VAL 26 2HG1 VAL 26 17.235 -1.150 -1.884
199 HG13 VAL 26 3HG1 VAL 26 18.367 -2.367 -1.295
200 HG21 VAL 26 3HG2 VAL 26 18.516 0.532 0.383
201 HG22 VAL 26 1HG2 VAL 26 18.970 -0.710 1.551
202 HG23 VAL 26 2HG2 VAL 26 19.438 -0.877 -0.141
203 H GLU 27 H GLU 27 17.269 1.731 1.371
204 HA GLU 27 HA GLU 27 17.085 1.120 4.115
205 HB2 GLU 27 2HB GLU 27 17.742 3.555 2.524
206 HB3 GLU 27 3HB GLU 27 17.386 3.756 4.233
207 HG2 GLU 27 2HG GLU 27 19.521 1.983 3.067
208 HG3 GLU 27 3HG GLU 27 19.773 3.543 3.848
209 H THR 28 H THR 28 14.988 2.911 1.935
210 HA THR 28 HA THR 28 13.317 4.153 3.782
211 HB THR 28 HB THR 28 12.323 2.991 1.183
212 HG1 THR 28 HG1 THR 28 13.051 5.206 0.434
213 HG21 THR 28 3HG2 THR 28 11.611 5.696 2.178
214 HG22 THR 28 1HG2 THR 28 10.927 4.313 3.030
215 HG23 THR 28 2HG2 THR 28 10.632 4.518 1.303
216 H VAL 29 H VAL 29 12.679 1.082 2.072
217 HA VAL 29 HA VAL 29 10.398 0.331 3.433
218 HB VAL 29 HB VAL 29 12.564 -1.525 2.434
219 HG11 VAL 29 1HG1 VAL 29 10.332 -2.913 2.068
220 HG12 VAL 29 2HG1 VAL 29 11.227 -2.966 3.588
221 HG13 VAL 29 3HG1 VAL 29 9.801 -1.938 3.438
222 HG21 VAL 29 3HG2 VAL 29 12.033 -0.827 0.392
223 HG22 VAL 29 1HG2 VAL 29 10.395 -1.429 0.651
224 HG23 VAL 29 2HG2 VAL 29 10.791 0.245 1.038
225 H LEU 30 H LEU 30 13.780 -0.300 4.294
226 HA LEU 30 HA LEU 30 13.431 -1.968 6.463
227 HB2 LEU 30 2HB LEU 30 15.463 0.176 5.920
228 HB3 LEU 30 3HB LEU 30 15.543 -0.846 7.354
229 HG LEU 30 HG LEU 30 15.708 -1.781 4.489
230 HD11 LEU 30 1HD1 LEU 30 17.679 -0.854 6.393
231 HD12 LEU 30 2HD1 LEU 30 17.851 -1.223 4.677
232 HD13 LEU 30 3HD1 LEU 30 17.994 -2.510 5.874
233 HD21 LEU 30 3HD2 LEU 30 16.276 -3.965 5.519
234 HD22 LEU 30 1HD2 LEU 30 14.615 -3.456 5.824
235 HD23 LEU 30 2HD2 LEU 30 15.832 -3.300 7.092
236 H ALA 31 H ALA 31 13.530 1.591 6.477
237 HA ALA 31 HA ALA 31 13.142 1.991 9.201
238 HB1 ALA 31 1HB ALA 31 13.576 4.009 8.336
239 HB2 ALA 31 2HB ALA 31 12.877 3.594 6.770
240 HB3 ALA 31 3HB ALA 31 11.832 4.116 8.092
241 H ALA 32 H ALA 32 10.800 1.374 6.644
242 HA ALA 32 HA ALA 32 8.514 1.824 8.320
243 HB1 ALA 32 1HB ALA 32 7.627 0.325 6.184
244 HB2 ALA 32 2HB ALA 32 7.682 2.086 6.267
245 HB3 ALA 32 3HB ALA 32 9.012 1.196 5.526
246 H ASN 33 H ASN 33 10.580 -0.856 7.588
247 HA ASN 33 HA ASN 33 9.035 -2.519 9.430
248 HB2 ASN 33 2HB ASN 33 9.669 -3.175 6.576
249 HB3 ASN 33 3HB ASN 33 9.602 -4.471 7.766
250 HD21 ASN 33 1HD2 ASN 33 7.780 -1.886 6.256
251 HD22 ASN 33 2HD2 ASN 33 6.216 -2.544 6.580
252 HA PRO 34 HA PRO 34 13.605 -2.563 10.238
253 HB2 PRO 34 2HB PRO 34 13.369 -2.177 12.915
254 HB3 PRO 34 3HB PRO 34 13.424 -0.845 11.753
255 HG2 PRO 34 2HG PRO 34 11.055 -2.098 13.088
256 HG3 PRO 34 3HG PRO 34 11.402 -0.382 12.805
257 HD2 PRO 34 2HD PRO 34 9.706 -1.802 11.244
258 HD3 PRO 34 3HD PRO 34 10.698 -0.471 10.613
259 H GLY 35 H GLY 35 14.828 -4.168 11.315
260 HA2 GLY 35 2HA GLY 35 15.176 -6.140 12.514
261 HA3 GLY 35 3HA GLY 35 13.447 -6.231 12.819
262 H LEU 36 H LEU 36 13.489 -5.684 9.663
263 HA LEU 36 HA LEU 36 13.099 -8.473 9.021
264 HB2 LEU 36 2HB LEU 36 11.880 -6.241 8.175
265 HB3 LEU 36 3HB LEU 36 13.070 -6.424 6.888
266 HG LEU 36 HG LEU 36 10.908 -7.402 6.288
267 HD11 LEU 36 1HD1 LEU 36 13.190 -8.360 5.591
268 HD12 LEU 36 2HD1 LEU 36 11.752 -9.348 5.335
269 HD13 LEU 36 3HD1 LEU 36 12.814 -9.676 6.704
270 HD21 LEU 36 3HD2 LEU 36 10.278 -8.014 8.632
271 HD22 LEU 36 1HD2 LEU 36 11.384 -9.382 8.509
272 HD23 LEU 36 2HD2 LEU 36 9.987 -9.278 7.437
273 H ALA 37 H ALA 37 15.431 -5.942 8.322
274 HA ALA 37 HA ALA 37 16.859 -7.385 6.325
275 HB1 ALA 37 1HB ALA 37 18.628 -5.560 7.480
276 HB2 ALA 37 2HB ALA 37 17.644 -5.328 6.034
277 HB3 ALA 37 3HB ALA 37 17.035 -4.813 7.607
278 H GLU 38 H GLU 38 16.802 -7.487 9.760
279 HA GLU 38 HA GLU 38 19.421 -8.438 10.240
280 HB2 GLU 38 2HB GLU 38 16.845 -8.536 11.774
281 HB3 GLU 38 3HB GLU 38 18.250 -9.422 12.348
282 HG2 GLU 38 2HG GLU 38 19.496 -7.195 12.153
283 HG3 GLU 38 3HG GLU 38 17.895 -6.466 12.045
284 H LEU 39 H LEU 39 16.640 -9.910 8.899
285 HA LEU 39 HA LEU 39 16.876 -12.566 9.610
286 HB2 LEU 39 2HB LEU 39 15.165 -11.358 8.092
287 HB3 LEU 39 3HB LEU 39 16.276 -11.770 6.787
288 HG LEU 39 HG LEU 39 14.409 -13.353 6.968
289 HD11 LEU 39 1HD1 LEU 39 16.979 -14.688 7.779
290 HD12 LEU 39 2HD1 LEU 39 16.703 -14.014 6.173
291 HD13 LEU 39 3HD1 LEU 39 15.691 -15.333 6.761
292 HD21 LEU 39 3HD2 LEU 39 14.258 -13.089 9.497
293 HD22 LEU 39 1HD2 LEU 39 15.579 -14.255 9.583
294 HD23 LEU 39 2HD2 LEU 39 14.045 -14.715 8.845
295 H GLY 40 H GLY 40 18.411 -10.952 6.823
296 HA2 GLY 40 2HA GLY 40 20.922 -11.806 6.900
297 HA3 GLY 40 3HA GLY 40 20.113 -13.285 6.405
298 H ALA 41 H ALA 41 21.145 -13.350 4.407
299 HA ALA 41 HA ALA 41 21.036 -11.129 2.591
300 HB1 ALA 41 1HB ALA 41 21.968 -12.767 0.956
301 HB2 ALA 41 2HB ALA 41 22.910 -12.604 2.438
302 HB3 ALA 41 3HB ALA 41 21.860 -14.002 2.211
303 H VAL 42 H VAL 42 19.620 -14.407 2.482
304 HA VAL 42 HA VAL 42 17.568 -13.382 0.645
305 HB VAL 42 HB VAL 42 18.183 -16.272 1.259
306 HG11 VAL 42 1HG1 VAL 42 16.772 -16.831 -0.488
307 HG12 VAL 42 2HG1 VAL 42 15.931 -15.464 0.246
308 HG13 VAL 42 3HG1 VAL 42 16.879 -15.232 -1.223
309 HG21 VAL 42 3HG2 VAL 42 19.166 -14.605 -1.057
310 HG22 VAL 42 1HG2 VAL 42 20.150 -15.159 0.298
311 HG23 VAL 42 2HG2 VAL 42 19.447 -16.330 -0.818
312 H LEU 43 H LEU 43 15.659 -12.905 1.489
313 HA LEU 43 HA LEU 43 14.914 -13.641 4.134
314 HB2 LEU 43 2HB LEU 43 13.087 -12.564 2.002
315 HB3 LEU 43 3HB LEU 43 12.912 -12.423 3.750
316 HG LEU 43 HG LEU 43 15.285 -11.180 2.441
317 HD11 LEU 43 1HD1 LEU 43 14.142 -9.271 1.744
318 HD12 LEU 43 2HD1 LEU 43 12.673 -9.718 2.611
319 HD13 LEU 43 3HD1 LEU 43 13.142 -10.601 1.159
320 HD21 LEU 43 3HD2 LEU 43 13.798 -11.005 4.967
321 HD22 LEU 43 1HD2 LEU 43 14.313 -9.457 4.297
322 HD23 LEU 43 2HD2 LEU 43 15.505 -10.715 4.627
323 HA PRO 44 HA PRO 44 12.850 -17.467 3.513
324 HB2 PRO 44 2HB PRO 44 10.908 -17.313 5.404
325 HB3 PRO 44 3HB PRO 44 12.612 -17.566 5.796
326 HG2 PRO 44 2HG PRO 44 11.007 -15.040 5.870
327 HG3 PRO 44 3HG PRO 44 12.190 -15.649 7.043
328 HD2 PRO 44 2HD PRO 44 12.795 -13.741 5.219
329 HD3 PRO 44 3HD PRO 44 13.987 -14.923 5.795
330 H HIS 45 H HIS 45 11.581 -17.968 1.850
331 HA HIS 45 HA HIS 45 9.781 -16.311 0.576
332 HB2 HIS 45 2HB HIS 45 8.938 -18.301 -0.556
333 HB3 HIS 45 3HB HIS 45 10.692 -18.381 -0.409
334 HD1 HIS 45 HD1 HIS 45 11.669 -20.188 1.162
335 HD2 HIS 45 HD2 HIS 45 7.525 -20.243 0.877
336 HE1 HIS 45 HE1 HIS 45 10.953 -22.371 2.186
337 H GLY 46 H GLY 46 7.803 -15.591 1.025
338 HA2 GLY 46 2HA GLY 46 5.505 -16.198 1.667
339 HA3 GLY 46 3HA GLY 46 6.206 -17.083 3.014
340 H THR 47 H THR 47 8.142 -14.584 3.019
341 HA THR 47 HA THR 47 6.610 -13.188 5.052
342 HB THR 47 HB THR 47 9.469 -12.839 4.131
343 HG1 THR 47 HG1 THR 47 9.649 -13.649 6.463
344 HG21 THR 47 3HG2 THR 47 9.696 -11.477 6.218
345 HG22 THR 47 1HG2 THR 47 7.938 -11.491 6.356
346 HG23 THR 47 2HG2 THR 47 8.708 -10.723 4.967
347 H ALA 48 H ALA 48 5.277 -11.614 4.454
348 HA ALA 48 HA ALA 48 5.426 -10.265 1.966
349 HB1 ALA 48 1HB ALA 48 3.446 -9.287 2.538
350 HB2 ALA 48 2HB ALA 48 3.425 -10.659 3.647
351 HB3 ALA 48 3HB ALA 48 3.913 -9.066 4.224
352 H VAL 49 H VAL 49 5.787 -8.010 1.588
353 HA VAL 49 HA VAL 49 7.283 -6.557 3.636
354 HB VAL 49 HB VAL 49 8.365 -6.972 0.845
355 HG11 VAL 49 1HG1 VAL 49 10.333 -5.944 2.543
356 HG12 VAL 49 2HG1 VAL 49 9.507 -5.103 1.230
357 HG13 VAL 49 3HG1 VAL 49 8.883 -4.999 2.876
358 HG21 VAL 49 3HG2 VAL 49 9.194 -8.132 3.498
359 HG22 VAL 49 1HG2 VAL 49 8.688 -8.997 2.047
360 HG23 VAL 49 2HG2 VAL 49 10.228 -8.139 2.069
361 H GLU 50 H GLU 50 6.655 -4.503 3.724
362 HA GLU 50 HA GLU 50 4.755 -3.475 1.855
363 HB2 GLU 50 2HB GLU 50 4.560 -2.846 4.169
364 HB3 GLU 50 3HB GLU 50 6.196 -2.203 4.184
365 HG2 GLU 50 2HG GLU 50 4.537 -0.427 4.112
366 HG3 GLU 50 3HG GLU 50 5.538 -0.432 2.661
367 H LEU 51 H LEU 51 4.979 -1.850 0.349
368 HA LEU 51 HA LEU 51 7.747 -1.074 -0.301
369 HB2 LEU 51 2HB LEU 51 5.436 -1.712 -2.118
370 HB3 LEU 51 3HB LEU 51 6.890 -0.884 -2.670
371 HG LEU 51 HG LEU 51 7.072 -3.567 -1.347
372 HD11 LEU 51 1HD1 LEU 51 5.702 -3.023 -3.790
373 HD12 LEU 51 2HD1 LEU 51 6.017 -4.574 -3.012
374 HD13 LEU 51 3HD1 LEU 51 7.191 -3.900 -4.142
375 HD21 LEU 51 3HD2 LEU 51 9.011 -1.897 -2.000
376 HD22 LEU 51 1HD2 LEU 51 8.778 -2.621 -3.591
377 HD23 LEU 51 2HD2 LEU 51 9.185 -3.640 -2.210
378 HA PRO 52 HA PRO 52 5.664 2.868 0.650
379 HB2 PRO 52 2HB PRO 52 7.956 4.142 1.353
380 HB3 PRO 52 3HB PRO 52 7.053 3.105 2.464
381 HG2 PRO 52 2HG PRO 52 9.491 2.476 0.844
382 HG3 PRO 52 3HG PRO 52 9.129 2.059 2.529
383 HD2 PRO 52 2HD PRO 52 8.847 0.291 0.498
384 HD3 PRO 52 3HD PRO 52 7.803 0.271 1.934
385 H ASP 53 H ASP 53 5.636 4.834 -0.456
386 HA ASP 53 HA ASP 53 5.889 6.257 -2.213
387 HB2 ASP 53 2HB ASP 53 8.630 5.095 -2.672
388 HB3 ASP 53 3HB ASP 53 8.067 6.733 -2.994
389 H VAL 54 H VAL 54 4.497 4.001 -2.776
390 HA VAL 54 HA VAL 54 5.250 3.500 -5.571
391 HB VAL 54 HB VAL 54 4.295 1.390 -3.631
392 HG11 VAL 54 1HG1 VAL 54 4.547 1.438 -6.604
393 HG12 VAL 54 2HG1 VAL 54 4.844 -0.066 -5.730
394 HG13 VAL 54 3HG1 VAL 54 3.281 0.741 -5.594
395 HG21 VAL 54 3HG2 VAL 54 6.625 1.821 -3.302
396 HG22 VAL 54 1HG2 VAL 54 6.477 0.317 -4.213
397 HG23 VAL 54 2HG2 VAL 54 6.927 1.808 -5.040
398 H GLN 55 H GLN 55 3.552 3.298 -7.008
399 HA GLN 55 HA GLN 55 1.026 4.377 -6.088
400 HB2 GLN 55 2HB GLN 55 2.445 4.724 -8.380
401 HB3 GLN 55 3HB GLN 55 1.272 3.522 -8.900
402 HG2 GLN 55 2HG GLN 55 -0.507 4.936 -8.636
403 HG3 GLN 55 3HG GLN 55 0.309 5.911 -7.416
404 HE21 GLN 55 1HE2 GLN 55 -1.039 7.116 -9.448
405 HE22 GLN 55 2HE2 GLN 55 0.075 7.873 -10.530
406 H THR 56 H THR 56 -0.921 3.338 -7.490
407 HA THR 56 HA THR 56 -2.384 1.603 -7.683
408 HB THR 56 HB THR 56 -0.103 -0.349 -7.528
409 HG1 THR 56 HG1 THR 56 0.330 0.076 -9.698
410 HG21 THR 56 3HG2 THR 56 -1.640 -1.231 -9.504
411 HG22 THR 56 1HG2 THR 56 -2.857 -0.283 -8.651
412 HG23 THR 56 2HG2 THR 56 -2.008 -1.584 -7.816
413 H ALA 57 H ALA 57 -1.671 2.606 -5.085
414 HA ALA 57 HA ALA 57 -2.870 0.585 -3.478
415 HB1 ALA 57 1HB ALA 57 -0.050 0.480 -3.673
416 HB2 ALA 57 2HB ALA 57 -0.450 1.070 -2.059
417 HB3 ALA 57 3HB ALA 57 -1.112 -0.463 -2.627
418 HA PRO 58 HA PRO 58 -3.979 4.047 -1.021
419 HB2 PRO 58 2HB PRO 58 -4.101 2.982 1.473
420 HB3 PRO 58 3HB PRO 58 -5.294 2.628 0.218
421 HG2 PRO 58 2HG PRO 58 -2.938 1.007 1.103
422 HG3 PRO 58 3HG PRO 58 -4.585 0.471 0.724
423 HD2 PRO 58 2HD PRO 58 -2.531 0.213 -1.022
424 HD3 PRO 58 3HD PRO 58 -4.203 0.492 -1.549
425 H VAL 59 H VAL 59 -1.816 5.027 -1.484
426 HA VAL 59 HA VAL 59 -0.347 5.386 1.035
427 HB VAL 59 HB VAL 59 1.031 5.207 -1.643
428 HG11 VAL 59 1HG1 VAL 59 2.395 6.480 -0.277
429 HG12 VAL 59 2HG1 VAL 59 1.931 5.601 1.181
430 HG13 VAL 59 3HG1 VAL 59 3.007 4.850 0.002
431 HG21 VAL 59 3HG2 VAL 59 0.257 3.014 -1.242
432 HG22 VAL 59 1HG2 VAL 59 1.935 3.033 -0.698
433 HG23 VAL 59 2HG2 VAL 59 0.625 3.116 0.480
434 H ALA 60 H ALA 60 0.659 7.423 1.290
435 HA ALA 60 HA ALA 60 -0.769 9.629 0.456
436 HB1 ALA 60 1HB ALA 60 1.486 10.856 1.000
437 HB2 ALA 60 2HB ALA 60 0.552 10.074 2.275
438 HB3 ALA 60 3HB ALA 60 1.961 9.263 1.589
439 H GLU 61 H GLU 61 0.184 11.529 -0.798
440 HA GLU 61 HA GLU 61 0.349 10.921 -3.484
441 HB2 GLU 61 2HB GLU 61 1.265 13.226 -3.775
442 HB3 GLU 61 3HB GLU 61 -0.183 13.153 -2.781
443 HG2 GLU 61 2HG GLU 61 2.421 13.023 -1.384
444 HG3 GLU 61 3HG GLU 61 1.960 14.566 -2.103
445 H THR 62 H THR 62 1.936 10.441 -4.906
446 HA THR 62 HA THR 62 4.720 10.776 -4.282
447 HB THR 62 HB THR 62 3.876 7.925 -4.724
448 HG1 THR 62 HG1 THR 62 3.171 7.878 -2.737
449 HG21 THR 62 3HG2 THR 62 6.150 7.991 -3.181
450 HG22 THR 62 1HG2 THR 62 6.361 9.383 -4.242
451 HG23 THR 62 2HG2 THR 62 6.105 7.779 -4.930
452 H VAL 63 H VAL 63 6.124 10.063 -6.062
453 HA VAL 63 HA VAL 63 4.714 9.669 -8.607
454 HB VAL 63 HB VAL 63 5.230 12.090 -8.334
455 HG11 VAL 63 1HG1 VAL 63 7.437 12.908 -8.250
456 HG12 VAL 63 2HG1 VAL 63 7.369 11.623 -7.042
457 HG13 VAL 63 3HG1 VAL 63 8.124 11.324 -8.608
458 HG21 VAL 63 3HG2 VAL 63 5.106 10.923 -10.550
459 HG22 VAL 63 1HG2 VAL 63 6.075 12.396 -10.543
460 HG23 VAL 63 2HG2 VAL 63 6.866 10.820 -10.523
461 H ASN 64 H ASN 64 5.712 8.323 -10.016
462 HA ASN 64 HA ASN 64 8.478 7.788 -10.078
463 HB2 ASN 64 2HB ASN 64 7.892 6.676 -7.905
464 HB3 ASN 64 3HB ASN 64 6.843 5.585 -8.806
465 HD21 ASN 64 1HD2 ASN 64 10.095 6.874 -9.392
466 HD22 ASN 64 2HD2 ASN 64 10.854 5.335 -9.588
467 H LEU 65 H LEU 65 9.032 6.077 -11.605
468 HA LEU 65 HA LEU 65 6.817 5.120 -13.260
469 HB2 LEU 65 2HB LEU 65 7.806 7.324 -14.111
470 HB3 LEU 65 3HB LEU 65 9.237 6.378 -14.515
471 HG LEU 65 HG LEU 65 7.499 4.905 -15.827
472 HD11 LEU 65 1HD1 LEU 65 5.636 6.419 -14.870
473 HD12 LEU 65 2HD1 LEU 65 5.573 5.954 -16.570
474 HD13 LEU 65 3HD1 LEU 65 6.147 7.558 -16.116
475 HD21 LEU 65 3HD2 LEU 65 8.619 5.718 -17.565
476 HD22 LEU 65 1HD2 LEU 65 9.311 6.924 -16.481
477 HD23 LEU 65 2HD2 LEU 65 7.850 7.296 -17.396
478 H TRP 66 H TRP 66 7.144 3.139 -14.138
479 HA TRP 66 HA TRP 66 9.798 2.012 -14.343
480 HB2 TRP 66 2HB TRP 66 9.413 0.130 -12.874
481 HB3 TRP 66 3HB TRP 66 9.170 1.620 -11.965
482 HD1 TRP 66 HD1 TRP 66 7.210 -1.326 -13.455
483 HE1 TRP 66 HE1 TRP 66 4.907 -1.434 -12.309
484 HE3 TRP 66 HE3 TRP 66 7.449 3.000 -10.740
485 HZ2 TRP 66 HZ2 TRP 66 3.393 0.110 -10.495
486 HZ3 TRP 66 HZ3 TRP 66 5.531 3.612 -9.325
487 HH2 TRP 66 HH2 TRP 66 3.546 2.196 -9.207
488 H GLU 67 H GLU 67 9.450 -0.499 -14.905
489 HA GLU 67 HA GLU 67 7.116 -1.311 -16.215
490 HB2 GLU 67 2HB GLU 67 8.029 -1.124 -18.599
491 HB3 GLU 67 3HB GLU 67 7.384 0.338 -17.866
492 HG2 GLU 67 2HG GLU 67 9.618 1.119 -17.374
493 HG3 GLU 67 3HG GLU 67 10.304 -0.377 -18.004
494 H VAL 68 H VAL 68 7.249 -3.451 -16.306
495 HA VAL 68 HA VAL 68 9.626 -4.797 -17.217
496 HB VAL 68 HB VAL 68 10.291 -4.466 -14.918
497 HG11 VAL 68 1HG1 VAL 68 8.359 -6.058 -13.536
498 HG12 VAL 68 2HG1 VAL 68 8.836 -4.384 -13.243
499 HG13 VAL 68 3HG1 VAL 68 7.540 -4.747 -14.384
500 HG21 VAL 68 3HG2 VAL 68 10.903 -6.646 -14.429
501 HG22 VAL 68 1HG2 VAL 68 9.361 -7.308 -14.972
502 HG23 VAL 68 2HG2 VAL 68 10.540 -6.737 -16.152
503 H GLU 69 H GLU 69 8.942 -6.438 -18.412
504 HA GLU 69 HA GLU 69 6.759 -8.121 -17.497
505 HB2 GLU 69 2HB GLU 69 5.902 -6.136 -18.969
506 HB3 GLU 69 3HB GLU 69 6.568 -7.074 -20.299
507 HG2 GLU 69 2HG GLU 69 4.334 -7.700 -20.225
508 HG3 GLU 69 3HG GLU 69 5.172 -9.012 -19.397
509 H HIS 70 H HIS 70 7.043 -10.201 -18.065
510 HA HIS 70 HA HIS 70 8.729 -10.882 -20.340
511 HB2 HIS 70 2HB HIS 70 10.085 -12.452 -18.946
512 HB3 HIS 70 3HB HIS 70 10.368 -10.753 -18.578
513 HD1 HIS 70 HD1 HIS 70 9.359 -9.862 -16.312
514 HD2 HIS 70 HD2 HIS 70 9.127 -13.974 -16.854
515 HE1 HIS 70 HE1 HIS 70 8.843 -10.812 -14.041
516 H HIS 71 H HIS 71 8.894 -13.432 -20.395
517 HA HIS 71 HA HIS 71 6.144 -14.408 -20.057
518 HB2 HIS 71 2HB HIS 71 8.358 -15.175 -21.950
519 HB3 HIS 71 3HB HIS 71 6.945 -16.199 -21.712
520 HD1 HIS 71 HD1 HIS 71 4.576 -14.902 -22.210
521 HD2 HIS 71 HD2 HIS 71 8.028 -13.279 -23.857
522 HE1 HIS 71 HE1 HIS 71 3.791 -13.384 -24.056
Start of MODEL 10
1 H1 MET 1 H MET 1 3.151 -0.495 5.224
2 HA MET 1 HA MET 1 2.109 -2.369 3.380
3 HB2 MET 1 2HB MET 1 2.450 -0.633 1.734
4 HB3 MET 1 3HB MET 1 4.095 -0.367 2.296
5 HG2 MET 1 2HG MET 1 4.913 -2.083 1.117
6 HG3 MET 1 3HG MET 1 3.529 -3.115 1.467
7 HE1 MET 1 3HE MET 1 3.137 -3.977 -1.572
8 HE2 MET 1 1HE MET 1 2.382 -4.012 0.022
9 HE3 MET 1 2HE MET 1 1.519 -3.309 -1.346
10 H LYS 2 H LYS 2 2.909 -4.050 4.488
11 HA LYS 2 HA LYS 2 5.828 -4.255 4.717
12 HB2 LYS 2 2HB LYS 2 5.562 -5.304 6.956
13 HB3 LYS 2 3HB LYS 2 5.094 -3.609 6.922
14 HG2 LYS 2 2HG LYS 2 2.704 -4.595 6.506
15 HG3 LYS 2 3HG LYS 2 3.405 -6.038 7.240
16 HD2 LYS 2 2HD LYS 2 3.784 -3.399 8.579
17 HD3 LYS 2 3HD LYS 2 2.224 -4.215 8.717
18 HE2 LYS 2 2HE LYS 2 4.772 -5.685 9.278
19 HE3 LYS 2 3HE LYS 2 4.048 -4.649 10.506
20 HZ1 LYS 2 3HZ LYS 2 2.014 -5.943 10.349
21 HZ2 LYS 2 1HZ LYS 2 3.324 -6.940 10.741
22 HZ3 LYS 2 2HZ LYS 2 2.706 -6.936 9.167
23 H THR 3 H THR 3 6.646 -6.392 4.708
24 HA THR 3 HA THR 3 4.760 -8.560 4.194
25 HB THR 3 HB THR 3 5.229 -7.681 1.963
26 HG1 THR 3 HG1 THR 3 5.000 -9.856 1.892
27 HG21 THR 3 3HG2 THR 3 7.835 -7.307 3.003
28 HG22 THR 3 1HG2 THR 3 7.225 -6.863 1.409
29 HG23 THR 3 2HG2 THR 3 7.963 -8.445 1.662
30 H PHE 4 H PHE 4 5.744 -10.681 4.293
31 HA PHE 4 HA PHE 4 7.759 -10.819 6.328
32 HB2 PHE 4 2HB PHE 4 6.644 -13.126 4.730
33 HB3 PHE 4 3HB PHE 4 7.365 -13.176 6.336
34 HD1 PHE 4 HD2 PHE 4 6.144 -11.955 8.216
35 HD2 PHE 4 HD1 PHE 4 4.350 -12.882 4.469
36 HE1 PHE 4 HE2 PHE 4 3.915 -11.702 9.225
37 HE2 PHE 4 HE1 PHE 4 2.118 -12.629 5.472
38 HZ PHE 4 HZ PHE 4 1.898 -12.039 7.853
39 H ALA 5 H ALA 5 9.878 -11.277 6.143
40 HA ALA 5 HA ALA 5 11.039 -11.245 3.488
41 HB1 ALA 5 1HB ALA 5 12.470 -11.410 6.134
42 HB2 ALA 5 2HB ALA 5 13.141 -10.926 4.576
43 HB3 ALA 5 3HB ALA 5 11.955 -9.900 5.382
44 H LEU 6 H LEU 6 12.389 -12.840 2.626
45 HA LEU 6 HA LEU 6 12.605 -15.385 4.026
46 HB2 LEU 6 2HB LEU 6 11.523 -15.311 1.225
47 HB3 LEU 6 3HB LEU 6 11.611 -16.685 2.326
48 HG LEU 6 HG LEU 6 9.855 -14.307 2.874
49 HD11 LEU 6 1HD1 LEU 6 8.962 -16.848 1.538
50 HD12 LEU 6 2HD1 LEU 6 9.360 -15.381 0.644
51 HD13 LEU 6 3HD1 LEU 6 8.036 -15.372 1.809
52 HD21 LEU 6 3HD2 LEU 6 10.545 -16.670 4.289
53 HD22 LEU 6 1HD2 LEU 6 8.850 -16.787 3.814
54 HD23 LEU 6 2HD2 LEU 6 9.410 -15.401 4.750
55 H GLN 7 H GLN 7 13.710 -16.992 2.267
56 HA GLN 7 HA GLN 7 16.326 -16.149 1.986
57 HB2 GLN 7 2HB GLN 7 14.763 -18.440 1.207
58 HB3 GLN 7 3HB GLN 7 15.894 -18.021 -0.072
59 HG2 GLN 7 2HG GLN 7 17.709 -18.025 1.644
60 HG3 GLN 7 3HG GLN 7 16.534 -18.660 2.795
61 HE21 GLN 7 1HE2 GLN 7 16.646 -20.761 3.045
62 HE22 GLN 7 2HE2 GLN 7 17.097 -21.915 1.842
63 H GLY 8 H GLY 8 17.341 -14.812 0.642
64 HA2 GLY 8 2HA GLY 8 17.798 -13.493 -1.181
65 HA3 GLY 8 3HA GLY 8 16.812 -14.603 -2.122
66 H ASP 9 H ASP 9 15.353 -13.068 0.596
67 HA ASP 9 HA ASP 9 14.018 -11.145 -1.192
68 HB2 ASP 9 2HB ASP 9 12.837 -13.072 0.773
69 HB3 ASP 9 3HB ASP 9 12.023 -11.540 0.469
70 H THR 10 H THR 10 16.290 -10.928 0.742
71 HA THR 10 HA THR 10 15.348 -9.480 3.014
72 HB THR 10 HB THR 10 17.593 -9.110 3.580
73 HG1 THR 10 HG1 THR 10 18.572 -9.779 1.025
74 HG21 THR 10 3HG2 THR 10 16.903 -11.537 3.423
75 HG22 THR 10 1HG2 THR 10 18.640 -11.236 3.391
76 HG23 THR 10 2HG2 THR 10 17.781 -11.601 1.895
77 H LEU 11 H LEU 11 16.498 -7.203 3.351
78 HA LEU 11 HA LEU 11 15.108 -5.326 1.904
79 HB2 LEU 11 2HB LEU 11 17.795 -4.971 3.224
80 HB3 LEU 11 3HB LEU 11 16.702 -3.669 2.761
81 HG LEU 11 HG LEU 11 16.203 -5.756 4.882
82 HD11 LEU 11 1HD1 LEU 11 17.724 -4.223 5.775
83 HD12 LEU 11 2HD1 LEU 11 16.150 -3.635 6.309
84 HD13 LEU 11 3HD1 LEU 11 16.968 -2.856 4.955
85 HD21 LEU 11 3HD2 LEU 11 14.137 -5.164 3.744
86 HD22 LEU 11 1HD2 LEU 11 14.487 -3.450 3.968
87 HD23 LEU 11 2HD2 LEU 11 14.171 -4.475 5.368
88 H ASP 12 H ASP 12 18.361 -6.571 1.292
89 HA ASP 12 HA ASP 12 19.149 -4.867 -0.745
90 HB2 ASP 12 2HB ASP 12 19.746 -7.772 -0.218
91 HB3 ASP 12 3HB ASP 12 20.462 -6.913 -1.580
92 H ALA 13 H ALA 13 17.024 -7.665 -0.862
93 HA ALA 13 HA ALA 13 16.775 -7.511 -3.751
94 HB1 ALA 13 1HB ALA 13 16.677 -9.715 -3.169
95 HB2 ALA 13 2HB ALA 13 15.854 -9.391 -1.642
96 HB3 ALA 13 3HB ALA 13 14.955 -9.331 -3.158
97 H ILE 14 H ILE 14 14.562 -7.268 -0.962
98 HA ILE 14 HA ILE 14 12.264 -6.523 -2.277
99 HB ILE 14 HB ILE 14 13.213 -5.490 0.398
100 HG12 ILE 14 2HG1 ILE 14 11.387 -7.823 -0.202
101 HG13 ILE 14 3HG1 ILE 14 13.110 -7.992 0.117
102 HG21 ILE 14 1HG2 ILE 14 11.387 -4.151 -0.491
103 HG22 ILE 14 2HG2 ILE 14 10.440 -5.610 -0.780
104 HG23 ILE 14 3HG2 ILE 14 10.835 -5.127 0.870
105 HD11 ILE 14 3HD1 ILE 14 12.834 -7.141 2.340
106 HD12 ILE 14 1HD1 ILE 14 11.137 -6.774 2.032
107 HD13 ILE 14 2HD1 ILE 14 11.683 -8.451 2.077
108 H CYS 15 H CYS 15 14.788 -4.358 -1.003
109 HA CYS 15 HA CYS 15 13.667 -1.937 -1.767
110 HB2 CYS 15 2HB CYS 15 16.546 -2.794 -1.490
111 HB3 CYS 15 3HB CYS 15 16.088 -1.135 -1.853
112 HG CYS 15 HG CYS 15 14.514 -0.936 0.538
113 H VAL 16 H VAL 16 15.271 -4.356 -3.674
114 HA VAL 16 HA VAL 16 15.591 -2.609 -5.968
115 HB VAL 16 HB VAL 16 16.088 -5.572 -5.654
116 HG11 VAL 16 1HG1 VAL 16 17.336 -5.308 -7.813
117 HG12 VAL 16 2HG1 VAL 16 15.582 -5.176 -7.948
118 HG13 VAL 16 3HG1 VAL 16 16.582 -3.723 -7.979
119 HG21 VAL 16 3HG2 VAL 16 18.109 -3.364 -5.966
120 HG22 VAL 16 1HG2 VAL 16 17.560 -3.946 -4.394
121 HG23 VAL 16 2HG2 VAL 16 18.390 -5.042 -5.499
122 H ARG 17 H ARG 17 13.369 -5.020 -4.788
123 HA ARG 17 HA ARG 17 11.997 -5.261 -7.330
124 HB2 ARG 17 2HB ARG 17 10.902 -7.048 -6.427
125 HB3 ARG 17 3HB ARG 17 12.297 -7.026 -5.356
126 HG2 ARG 17 2HG ARG 17 10.972 -5.706 -3.732
127 HG3 ARG 17 3HG ARG 17 9.571 -5.884 -4.790
128 HD2 ARG 17 2HD ARG 17 10.170 -8.436 -4.612
129 HD3 ARG 17 3HD ARG 17 10.977 -7.923 -3.131
130 HE ARG 17 HE ARG 17 8.297 -6.945 -3.313
131 HH11 ARG 17 1HH1 ARG 17 10.241 -9.708 -2.474
132 HH12 ARG 17 2HH1 ARG 17 9.067 -10.367 -1.383
133 HH21 ARG 17 1HH2 ARG 17 6.743 -7.801 -1.880
134 HH22 ARG 17 2HH2 ARG 17 7.077 -9.282 -1.047
135 H TYR 18 H TYR 18 11.959 -3.141 -4.716
136 HA TYR 18 HA TYR 18 9.182 -2.332 -5.254
137 HB2 TYR 18 2HB TYR 18 10.884 -2.303 -2.839
138 HB3 TYR 18 3HB TYR 18 9.872 -0.881 -3.068
139 HD1 TYR 18 HD2 TYR 18 7.429 -1.077 -3.044
140 HD2 TYR 18 HD1 TYR 18 9.918 -4.453 -2.329
141 HE1 TYR 18 HE2 TYR 18 5.502 -2.296 -2.124
142 HE2 TYR 18 HE1 TYR 18 7.997 -5.682 -1.408
143 HH TYR 18 HH TYR 18 5.320 -5.464 -1.789
144 H TYR 19 H TYR 19 12.261 -0.776 -4.339
145 HA TYR 19 HA TYR 19 11.473 1.605 -5.829
146 HB2 TYR 19 2HB TYR 19 14.026 1.285 -4.269
147 HB3 TYR 19 3HB TYR 19 13.153 2.764 -4.653
148 HD1 TYR 19 HD2 TYR 19 11.086 3.336 -3.424
149 HD2 TYR 19 HD1 TYR 19 13.450 -0.037 -2.358
150 HE1 TYR 19 HE2 TYR 19 9.948 3.235 -1.247
151 HE2 TYR 19 HE1 TYR 19 12.317 -0.149 -0.177
152 HH TYR 19 HH TYR 19 10.984 1.011 1.267
153 H GLY 20 H GLY 20 13.887 -0.952 -5.863
154 HA2 GLY 20 2HA GLY 20 14.912 -1.748 -7.837
155 HA3 GLY 20 3HA GLY 20 14.545 -0.217 -8.618
156 H ARG 21 H ARG 21 15.957 -0.219 -5.454
157 HA ARG 21 HA ARG 21 18.680 -0.131 -6.298
158 HB2 ARG 21 2HB ARG 21 19.135 2.210 -5.876
159 HB3 ARG 21 3HB ARG 21 17.904 2.069 -7.123
160 HG2 ARG 21 2HG ARG 21 16.925 2.331 -4.354
161 HG3 ARG 21 3HG ARG 21 17.723 3.745 -5.045
162 HD2 ARG 21 2HD ARG 21 16.120 3.029 -7.098
163 HD3 ARG 21 3HD ARG 21 15.146 2.493 -5.730
164 HE ARG 21 HE ARG 21 16.138 5.155 -5.401
165 HH11 ARG 21 1HH1 ARG 21 13.639 3.232 -6.875
166 HH12 ARG 21 2HH1 ARG 21 12.493 4.529 -6.931
167 HH21 ARG 21 1HH2 ARG 21 14.638 6.872 -5.470
168 HH22 ARG 21 2HH2 ARG 21 13.062 6.600 -6.133
169 H THR 22 H THR 22 20.147 0.443 -4.487
170 HA THR 22 HA THR 22 18.879 -0.135 -1.888
171 HB THR 22 HB THR 22 21.363 -0.970 -1.405
172 HG1 THR 22 HG1 THR 22 22.310 -1.847 -3.211
173 HG21 THR 22 3HG2 THR 22 20.349 -3.222 -2.615
174 HG22 THR 22 1HG2 THR 22 18.903 -2.262 -2.307
175 HG23 THR 22 2HG2 THR 22 19.981 -2.685 -0.977
176 H GLU 23 H GLU 23 21.167 1.803 -3.656
177 HA GLU 23 HA GLU 23 22.382 3.037 -1.391
178 HB2 GLU 23 2HB GLU 23 23.293 2.900 -3.782
179 HB3 GLU 23 3HB GLU 23 22.212 4.238 -4.148
180 HG2 GLU 23 2HG GLU 23 24.174 4.408 -1.895
181 HG3 GLU 23 3HG GLU 23 24.653 4.752 -3.556
182 H GLY 24 H GLY 24 21.307 4.282 -0.009
183 HA2 GLY 24 2HA GLY 24 20.290 6.359 0.529
184 HA3 GLY 24 3HA GLY 24 19.595 6.406 -1.085
185 H VAL 25 H VAL 25 18.868 3.448 -0.588
186 HA VAL 25 HA VAL 25 16.305 4.059 0.692
187 HB VAL 25 HB VAL 25 17.051 1.565 -0.835
188 HG11 VAL 25 1HG1 VAL 25 14.267 2.464 -0.756
189 HG12 VAL 25 2HG1 VAL 25 14.949 0.854 -0.513
190 HG13 VAL 25 3HG1 VAL 25 14.926 2.013 0.817
191 HG21 VAL 25 3HG2 VAL 25 15.499 2.799 -2.576
192 HG22 VAL 25 1HG2 VAL 25 16.123 4.234 -1.763
193 HG23 VAL 25 2HG2 VAL 25 17.236 3.098 -2.525
194 H VAL 26 H VAL 26 18.984 1.750 0.847
195 HA VAL 26 HA VAL 26 18.035 0.049 2.817
196 HB VAL 26 HB VAL 26 20.411 -0.385 3.390
197 HG11 VAL 26 1HG1 VAL 26 19.690 -1.722 1.651
198 HG12 VAL 26 2HG1 VAL 26 19.462 -0.357 0.556
199 HG13 VAL 26 3HG1 VAL 26 21.089 -0.923 0.937
200 HG21 VAL 26 3HG2 VAL 26 21.768 1.026 1.393
201 HG22 VAL 26 1HG2 VAL 26 20.740 2.213 2.195
202 HG23 VAL 26 2HG2 VAL 26 21.887 1.261 3.137
203 H GLU 27 H GLU 27 19.204 3.307 3.080
204 HA GLU 27 HA GLU 27 19.688 3.243 5.900
205 HB2 GLU 27 2HB GLU 27 19.463 5.429 3.853
206 HB3 GLU 27 3HB GLU 27 19.549 5.812 5.567
207 HG2 GLU 27 2HG GLU 27 21.598 4.226 4.037
208 HG3 GLU 27 3HG GLU 27 21.732 5.931 4.462
209 H THR 28 H THR 28 16.948 3.930 3.848
210 HA THR 28 HA THR 28 15.336 5.222 5.787
211 HB THR 28 HB THR 28 14.016 3.611 3.666
212 HG1 THR 28 HG1 THR 28 14.665 5.501 2.234
213 HG21 THR 28 3HG2 THR 28 13.362 6.351 3.564
214 HG22 THR 28 1HG2 THR 28 13.475 5.924 5.271
215 HG23 THR 28 2HG2 THR 28 12.387 5.031 4.208
216 H VAL 29 H VAL 29 15.016 1.926 4.449
217 HA VAL 29 HA VAL 29 13.146 0.963 6.238
218 HB VAL 29 HB VAL 29 15.405 -0.612 4.996
219 HG11 VAL 29 1HG1 VAL 29 14.595 -2.235 6.315
220 HG12 VAL 29 2HG1 VAL 29 13.104 -1.352 6.651
221 HG13 VAL 29 3HG1 VAL 29 13.261 -2.285 5.163
222 HG21 VAL 29 3HG2 VAL 29 13.285 0.768 3.768
223 HG22 VAL 29 1HG2 VAL 29 14.393 -0.390 3.032
224 HG23 VAL 29 2HG2 VAL 29 12.864 -0.944 3.714
225 H LEU 30 H LEU 30 16.570 1.436 6.676
226 HA LEU 30 HA LEU 30 16.903 -0.200 8.962
227 HB2 LEU 30 2HB LEU 30 18.430 1.999 7.670
228 HB3 LEU 30 3HB LEU 30 18.840 1.569 9.329
229 HG LEU 30 HG LEU 30 18.878 -0.332 6.986
230 HD11 LEU 30 1HD1 LEU 30 20.918 1.462 8.164
231 HD12 LEU 30 2HD1 LEU 30 20.718 0.903 6.504
232 HD13 LEU 30 3HD1 LEU 30 21.429 -0.165 7.715
233 HD21 LEU 30 3HD2 LEU 30 18.649 -0.897 9.672
234 HD22 LEU 30 1HD2 LEU 30 20.383 -1.020 9.377
235 HD23 LEU 30 2HD2 LEU 30 19.257 -1.991 8.429
236 H ALA 31 H ALA 31 16.224 3.261 8.566
237 HA ALA 31 HA ALA 31 16.231 3.913 11.307
238 HB1 ALA 31 1HB ALA 31 15.308 5.201 8.814
239 HB2 ALA 31 2HB ALA 31 14.579 5.775 10.314
240 HB3 ALA 31 3HB ALA 31 16.330 5.828 10.109
241 H ALA 32 H ALA 32 13.725 2.690 9.166
242 HA ALA 32 HA ALA 32 11.628 3.008 11.118
243 HB1 ALA 32 1HB ALA 32 10.514 1.378 9.314
244 HB2 ALA 32 2HB ALA 32 10.651 3.121 9.079
245 HB3 ALA 32 3HB ALA 32 11.824 2.036 8.333
246 H ASN 33 H ASN 33 13.893 0.545 10.189
247 HA ASN 33 HA ASN 33 12.795 -1.196 12.282
248 HB2 ASN 33 2HB ASN 33 13.214 -1.838 9.416
249 HB3 ASN 33 3HB ASN 33 13.712 -3.066 10.576
250 HD21 ASN 33 1HD2 ASN 33 10.990 -0.910 9.869
251 HD22 ASN 33 2HD2 ASN 33 9.758 -2.050 10.281
252 HA PRO 34 HA PRO 34 17.349 -0.442 12.792
253 HB2 PRO 34 2HB PRO 34 17.200 0.079 15.453
254 HB3 PRO 34 3HB PRO 34 16.971 1.321 14.216
255 HG2 PRO 34 2HG PRO 34 14.918 -0.204 15.772
256 HG3 PRO 34 3HG PRO 34 14.962 1.523 15.370
257 HD2 PRO 34 2HD PRO 34 13.438 -0.251 14.006
258 HD3 PRO 34 3HD PRO 34 14.162 1.176 13.236
259 H GLY 35 H GLY 35 18.837 -1.880 13.616
260 HA2 GLY 35 2HA GLY 35 19.595 -3.657 14.963
261 HA3 GLY 35 3HA GLY 35 17.932 -3.983 15.429
262 H LEU 36 H LEU 36 17.277 -3.772 12.433
263 HA LEU 36 HA LEU 36 17.287 -6.548 11.916
264 HB2 LEU 36 2HB LEU 36 15.835 -4.536 10.980
265 HB3 LEU 36 3HB LEU 36 17.019 -4.613 9.677
266 HG LEU 36 HG LEU 36 14.985 -5.856 9.136
267 HD11 LEU 36 1HD1 LEU 36 17.535 -6.645 8.715
268 HD12 LEU 36 2HD1 LEU 36 16.122 -7.457 8.044
269 HD13 LEU 36 3HD1 LEU 36 16.877 -8.073 9.513
270 HD21 LEU 36 3HD2 LEU 36 14.231 -7.719 10.363
271 HD22 LEU 36 1HD2 LEU 36 14.526 -6.457 11.560
272 HD23 LEU 36 2HD2 LEU 36 15.693 -7.763 11.350
273 H ALA 37 H ALA 37 19.447 -3.946 11.022
274 HA ALA 37 HA ALA 37 20.860 -5.268 8.973
275 HB1 ALA 37 1HB ALA 37 22.712 -3.582 10.066
276 HB2 ALA 37 2HB ALA 37 21.507 -3.128 8.860
277 HB3 ALA 37 3HB ALA 37 21.191 -2.844 10.572
278 H GLU 38 H GLU 38 21.126 -5.342 12.463
279 HA GLU 38 HA GLU 38 23.596 -6.874 12.367
280 HB2 GLU 38 2HB GLU 38 21.912 -6.123 14.762
281 HB3 GLU 38 3HB GLU 38 23.550 -6.761 14.792
282 HG2 GLU 38 2HG GLU 38 24.227 -4.702 13.485
283 HG3 GLU 38 3HG GLU 38 22.627 -4.064 13.857
284 H LEU 39 H LEU 39 20.653 -7.707 11.600
285 HA LEU 39 HA LEU 39 19.993 -9.876 13.287
286 HB2 LEU 39 2HB LEU 39 18.446 -8.738 11.699
287 HB3 LEU 39 3HB LEU 39 19.298 -9.531 10.375
288 HG LEU 39 HG LEU 39 18.546 -11.694 11.122
289 HD11 LEU 39 1HD1 LEU 39 18.473 -11.740 13.407
290 HD12 LEU 39 2HD1 LEU 39 16.756 -11.582 13.041
291 HD13 LEU 39 3HD1 LEU 39 17.687 -10.166 13.526
292 HD21 LEU 39 3HD2 LEU 39 16.001 -11.223 11.083
293 HD22 LEU 39 1HD2 LEU 39 16.975 -10.795 9.677
294 HD23 LEU 39 2HD2 LEU 39 16.484 -9.547 10.822
295 H GLY 40 H GLY 40 21.844 -9.659 10.275
296 HA2 GLY 40 2HA GLY 40 23.766 -11.451 10.627
297 HA3 GLY 40 3HA GLY 40 22.400 -12.523 10.355
298 H ALA 41 H ALA 41 23.871 -13.187 8.546
299 HA ALA 41 HA ALA 41 24.442 -11.536 6.363
300 HB1 ALA 41 1HB ALA 41 24.303 -14.457 6.822
301 HB2 ALA 41 2HB ALA 41 24.268 -13.903 5.147
302 HB3 ALA 41 3HB ALA 41 25.620 -13.467 6.192
303 H VAL 42 H VAL 42 21.892 -14.032 6.494
304 HA VAL 42 HA VAL 42 20.294 -12.347 4.676
305 HB VAL 42 HB VAL 42 21.107 -14.475 3.657
306 HG11 VAL 42 1HG1 VAL 42 20.175 -16.589 4.372
307 HG12 VAL 42 2HG1 VAL 42 21.026 -15.831 5.719
308 HG13 VAL 42 3HG1 VAL 42 19.264 -15.788 5.652
309 HG21 VAL 42 3HG2 VAL 42 19.318 -14.124 2.383
310 HG22 VAL 42 1HG2 VAL 42 18.404 -15.185 3.455
311 HG23 VAL 42 2HG2 VAL 42 18.424 -13.445 3.744
312 H LEU 43 H LEU 43 18.202 -11.937 5.189
313 HA LEU 43 HA LEU 43 17.354 -12.155 7.850
314 HB2 LEU 43 2HB LEU 43 16.058 -11.407 5.277
315 HB3 LEU 43 3HB LEU 43 15.032 -11.701 6.680
316 HG LEU 43 HG LEU 43 16.087 -9.911 7.892
317 HD11 LEU 43 1HD1 LEU 43 18.325 -9.892 7.342
318 HD12 LEU 43 2HD1 LEU 43 17.735 -8.461 6.497
319 HD13 LEU 43 3HD1 LEU 43 18.010 -9.958 5.608
320 HD21 LEU 43 3HD2 LEU 43 14.812 -9.516 5.307
321 HD22 LEU 43 1HD2 LEU 43 15.798 -8.140 5.804
322 HD23 LEU 43 2HD2 LEU 43 14.507 -8.725 6.855
323 HA PRO 44 HA PRO 44 15.478 -16.102 8.234
324 HB2 PRO 44 2HB PRO 44 13.266 -15.556 9.710
325 HB3 PRO 44 3HB PRO 44 14.902 -15.515 10.379
326 HG2 PRO 44 2HG PRO 44 13.183 -13.252 9.437
327 HG3 PRO 44 3HG PRO 44 14.202 -13.355 10.884
328 HD2 PRO 44 2HD PRO 44 14.983 -12.054 8.642
329 HD3 PRO 44 3HD PRO 44 16.131 -12.884 9.713
330 H HIS 45 H HIS 45 13.046 -17.069 8.245
331 HA HIS 45 HA HIS 45 11.755 -16.070 5.791
332 HB2 HIS 45 2HB HIS 45 11.069 -18.509 5.458
333 HB3 HIS 45 3HB HIS 45 12.761 -18.117 5.171
334 HD1 HIS 45 HD1 HIS 45 10.580 -20.282 7.157
335 HD2 HIS 45 HD2 HIS 45 14.516 -18.963 7.320
336 HE1 HIS 45 HE1 HIS 45 11.744 -21.835 8.757
337 H GLY 46 H GLY 46 10.277 -14.825 7.007
338 HA2 GLY 46 2HA GLY 46 7.788 -15.502 7.384
339 HA3 GLY 46 3HA GLY 46 8.473 -16.304 8.789
340 H THR 47 H THR 47 10.464 -13.887 8.709
341 HA THR 47 HA THR 47 9.060 -12.377 10.700
342 HB THR 47 HB THR 47 11.741 -11.860 9.398
343 HG1 THR 47 HG1 THR 47 11.266 -12.839 12.016
344 HG21 THR 47 3HG2 THR 47 10.139 -10.276 11.220
345 HG22 THR 47 1HG2 THR 47 11.637 -9.860 10.388
346 HG23 THR 47 2HG2 THR 47 11.692 -10.711 11.931
347 H ALA 48 H ALA 48 7.815 -10.652 10.407
348 HA ALA 48 HA ALA 48 7.246 -9.615 7.838
349 HB1 ALA 48 1HB ALA 48 6.571 -7.998 10.228
350 HB2 ALA 48 2HB ALA 48 5.575 -8.449 8.843
351 HB3 ALA 48 3HB ALA 48 5.886 -9.621 10.124
352 H VAL 49 H VAL 49 7.579 -7.471 7.045
353 HA VAL 49 HA VAL 49 9.697 -5.908 8.315
354 HB VAL 49 HB VAL 49 9.846 -6.787 5.428
355 HG11 VAL 49 1HG1 VAL 49 11.132 -5.002 5.125
356 HG12 VAL 49 2HG1 VAL 49 11.000 -4.568 6.831
357 HG13 VAL 49 3HG1 VAL 49 12.271 -5.669 6.295
358 HG21 VAL 49 3HG2 VAL 49 10.589 -8.659 6.531
359 HG22 VAL 49 1HG2 VAL 49 12.090 -7.741 6.408
360 HG23 VAL 49 2HG2 VAL 49 11.178 -7.742 7.917
361 H GLU 50 H GLU 50 9.353 -3.774 8.166
362 HA GLU 50 HA GLU 50 7.042 -2.868 6.642
363 HB2 GLU 50 2HB GLU 50 7.244 -2.199 8.996
364 HB3 GLU 50 3HB GLU 50 8.773 -1.406 8.643
365 HG2 GLU 50 2HG GLU 50 7.329 0.368 8.632
366 HG3 GLU 50 3HG GLU 50 7.364 -0.058 6.922
367 H LEU 51 H LEU 51 7.113 -1.503 4.933
368 HA LEU 51 HA LEU 51 9.784 -0.691 3.990
369 HB2 LEU 51 2HB LEU 51 7.312 -1.344 2.392
370 HB3 LEU 51 3HB LEU 51 8.829 -0.755 1.715
371 HG LEU 51 HG LEU 51 8.640 -3.336 3.249
372 HD11 LEU 51 1HD1 LEU 51 7.458 -2.780 0.748
373 HD12 LEU 51 2HD1 LEU 51 7.651 -4.342 1.542
374 HD13 LEU 51 3HD1 LEU 51 8.897 -3.752 0.443
375 HD21 LEU 51 3HD2 LEU 51 10.848 -2.104 2.819
376 HD22 LEU 51 1HD2 LEU 51 10.618 -2.563 1.131
377 HD23 LEU 51 2HD2 LEU 51 10.752 -3.809 2.372
378 HA PRO 52 HA PRO 52 7.738 3.286 4.866
379 HB2 PRO 52 2HB PRO 52 10.066 4.632 5.236
380 HB3 PRO 52 3HB PRO 52 9.302 3.669 6.505
381 HG2 PRO 52 2HG PRO 52 11.571 2.951 4.689
382 HG3 PRO 52 3HG PRO 52 11.392 2.653 6.428
383 HD2 PRO 52 2HD PRO 52 10.935 0.740 4.568
384 HD3 PRO 52 3HD PRO 52 10.044 0.812 6.102
385 H ASP 53 H ASP 53 7.635 5.225 3.673
386 HA ASP 53 HA ASP 53 7.699 6.530 1.811
387 HB2 ASP 53 2HB ASP 53 10.259 6.234 2.409
388 HB3 ASP 53 3HB ASP 53 10.273 5.311 0.909
389 H VAL 54 H VAL 54 6.256 4.184 1.626
390 HA VAL 54 HA VAL 54 6.693 3.414 -1.187
391 HB VAL 54 HB VAL 54 5.578 1.694 1.032
392 HG11 VAL 54 1HG1 VAL 54 5.822 1.229 -1.930
393 HG12 VAL 54 2HG1 VAL 54 5.633 -0.084 -0.766
394 HG13 VAL 54 3HG1 VAL 54 4.374 1.142 -0.927
395 HG21 VAL 54 3HG2 VAL 54 7.985 1.883 1.159
396 HG22 VAL 54 1HG2 VAL 54 7.550 0.280 0.566
397 HG23 VAL 54 2HG2 VAL 54 8.136 1.507 -0.557
398 H GLN 55 H GLN 55 4.920 3.334 -2.527
399 HA GLN 55 HA GLN 55 2.383 4.294 -1.376
400 HB2 GLN 55 2HB GLN 55 3.468 4.905 -4.130
401 HB3 GLN 55 3HB GLN 55 1.968 5.512 -3.442
402 HG2 GLN 55 2HG GLN 55 3.414 6.560 -1.629
403 HG3 GLN 55 3HG GLN 55 4.783 6.206 -2.682
404 HE21 GLN 55 1HE2 GLN 55 2.290 8.359 -1.966
405 HE22 GLN 55 2HE2 GLN 55 2.460 9.402 -3.332
406 H THR 56 H THR 56 0.921 2.729 -1.419
407 HA THR 56 HA THR 56 1.091 0.604 -3.398
408 HB THR 56 HB THR 56 0.648 0.073 -1.004
409 HG1 THR 56 HG1 THR 56 -0.024 -1.471 -2.445
410 HG21 THR 56 3HG2 THR 56 -2.173 0.977 -1.369
411 HG22 THR 56 1HG2 THR 56 -0.957 2.150 -0.866
412 HG23 THR 56 2HG2 THR 56 -1.260 0.716 0.116
413 H ALA 57 H ALA 57 -1.111 -0.184 -4.263
414 HA ALA 57 HA ALA 57 -2.869 0.158 -5.668
415 HB1 ALA 57 1HB ALA 57 -3.899 1.082 -3.631
416 HB2 ALA 57 2HB ALA 57 -3.289 2.679 -4.066
417 HB3 ALA 57 3HB ALA 57 -4.475 1.877 -5.097
418 HA PRO 58 HA PRO 58 -0.365 2.872 -8.385
419 HB2 PRO 58 2HB PRO 58 -0.649 1.288 -10.572
420 HB3 PRO 58 3HB PRO 58 0.584 1.008 -9.336
421 HG2 PRO 58 2HG PRO 58 -2.073 -0.323 -9.696
422 HG3 PRO 58 3HG PRO 58 -0.505 -1.046 -9.295
423 HD2 PRO 58 2HD PRO 58 -2.402 -0.554 -7.427
424 HD3 PRO 58 3HD PRO 58 -0.665 -0.468 -7.070
425 H VAL 59 H VAL 59 -0.959 3.667 -10.667
426 HA VAL 59 HA VAL 59 -3.462 4.936 -10.563
427 HB VAL 59 HB VAL 59 -1.697 4.524 -12.981
428 HG11 VAL 59 1HG1 VAL 59 -3.679 5.277 -13.883
429 HG12 VAL 59 2HG1 VAL 59 -4.097 6.219 -12.450
430 HG13 VAL 59 3HG1 VAL 59 -2.847 6.797 -13.552
431 HG21 VAL 59 3HG2 VAL 59 -1.100 6.979 -12.328
432 HG22 VAL 59 1HG2 VAL 59 -1.640 6.479 -10.725
433 HG23 VAL 59 2HG2 VAL 59 -0.307 5.632 -11.511
434 H ALA 60 H ALA 60 -5.418 4.166 -10.970
435 HA ALA 60 HA ALA 60 -5.711 1.648 -12.410
436 HB1 ALA 60 1HB ALA 60 -7.940 1.574 -11.538
437 HB2 ALA 60 2HB ALA 60 -6.848 2.020 -10.226
438 HB3 ALA 60 3HB ALA 60 -7.840 3.253 -11.006
439 H GLU 61 H GLU 61 -5.765 4.912 -13.118
440 HA GLU 61 HA GLU 61 -7.812 4.715 -15.184
441 HB2 GLU 61 2HB GLU 61 -6.114 7.016 -14.215
442 HB3 GLU 61 3HB GLU 61 -7.236 7.140 -15.563
443 HG2 GLU 61 2HG GLU 61 -9.084 6.545 -14.073
444 HG3 GLU 61 3HG GLU 61 -7.954 6.447 -12.723
445 H THR 62 H THR 62 -5.917 2.963 -15.814
446 HA THR 62 HA THR 62 -4.788 4.085 -18.238
447 HB THR 62 HB THR 62 -2.944 2.611 -16.359
448 HG1 THR 62 HG1 THR 62 -2.014 4.814 -16.137
449 HG21 THR 62 3HG2 THR 62 -2.362 2.505 -18.731
450 HG22 THR 62 1HG2 THR 62 -1.201 3.493 -17.845
451 HG23 THR 62 2HG2 THR 62 -2.439 4.264 -18.837
452 H VAL 63 H VAL 63 -4.928 2.668 -19.864
453 HA VAL 63 HA VAL 63 -5.240 -0.187 -19.199
454 HB VAL 63 HB VAL 63 -7.390 0.834 -19.892
455 HG11 VAL 63 1HG1 VAL 63 -5.948 2.304 -21.634
456 HG12 VAL 63 2HG1 VAL 63 -6.552 1.041 -22.709
457 HG13 VAL 63 3HG1 VAL 63 -7.683 2.028 -21.782
458 HG21 VAL 63 3HG2 VAL 63 -6.841 -1.555 -20.312
459 HG22 VAL 63 1HG2 VAL 63 -8.002 -0.883 -21.458
460 HG23 VAL 63 2HG2 VAL 63 -6.319 -1.108 -21.936
461 H ASN 64 H ASN 64 -4.272 -1.671 -20.554
462 HA ASN 64 HA ASN 64 -1.916 -0.917 -21.853
463 HB2 ASN 64 2HB ASN 64 -3.562 -3.423 -21.820
464 HB3 ASN 64 3HB ASN 64 -2.196 -3.292 -22.924
465 HD21 ASN 64 1HD2 ASN 64 -2.975 -4.644 -20.184
466 HD22 ASN 64 2HD2 ASN 64 -1.501 -4.509 -19.293
467 H LEU 65 H LEU 65 -1.529 -1.758 -24.234
468 HA LEU 65 HA LEU 65 -3.726 -0.989 -25.997
469 HB2 LEU 65 2HB LEU 65 -2.524 1.077 -25.622
470 HB3 LEU 65 3HB LEU 65 -0.998 0.294 -26.029
471 HG LEU 65 HG LEU 65 -2.128 -0.108 -28.340
472 HD11 LEU 65 1HD1 LEU 65 -4.216 0.650 -28.477
473 HD12 LEU 65 2HD1 LEU 65 -3.521 2.270 -28.487
474 HD13 LEU 65 3HD1 LEU 65 -4.072 1.557 -26.971
475 HD21 LEU 65 3HD2 LEU 65 -0.260 1.578 -27.503
476 HD22 LEU 65 1HD2 LEU 65 -1.502 2.762 -27.909
477 HD23 LEU 65 2HD2 LEU 65 -0.913 1.644 -29.141
478 H TRP 66 H TRP 66 -3.854 -2.286 -27.712
479 HA TRP 66 HA TRP 66 -2.043 -4.445 -28.045
480 HB2 TRP 66 2HB TRP 66 -4.255 -3.443 -29.850
481 HB3 TRP 66 3HB TRP 66 -3.403 -4.970 -30.058
482 HD1 TRP 66 HD1 TRP 66 -3.418 -6.060 -27.116
483 HE1 TRP 66 HE1 TRP 66 -5.626 -6.784 -26.010
484 HE3 TRP 66 HE3 TRP 66 -6.688 -3.439 -30.043
485 HZ2 TRP 66 HZ2 TRP 66 -8.389 -6.307 -26.336
486 HZ3 TRP 66 HZ3 TRP 66 -9.098 -3.628 -29.580
487 HH2 TRP 66 HH2 TRP 66 -9.928 -5.034 -27.765
488 H GLU 67 H GLU 67 -1.454 -4.882 -30.562
489 HA GLU 67 HA GLU 67 -0.362 -2.540 -31.856
490 HB2 GLU 67 2HB GLU 67 1.356 -4.547 -30.441
491 HB3 GLU 67 3HB GLU 67 1.952 -3.759 -31.895
492 HG2 GLU 67 2HG GLU 67 1.435 -1.562 -30.769
493 HG3 GLU 67 3HG GLU 67 1.178 -2.486 -29.289
494 H VAL 68 H VAL 68 -1.016 -2.874 -33.872
495 HA VAL 68 HA VAL 68 -0.987 -5.599 -34.961
496 HB VAL 68 HB VAL 68 -2.381 -4.670 -36.790
497 HG11 VAL 68 1HG1 VAL 68 -3.677 -5.686 -35.174
498 HG12 VAL 68 2HG1 VAL 68 -3.238 -4.511 -33.932
499 HG13 VAL 68 3HG1 VAL 68 -4.364 -4.062 -35.213
500 HG21 VAL 68 3HG2 VAL 68 -3.004 -2.476 -36.948
501 HG22 VAL 68 1HG2 VAL 68 -2.842 -2.190 -35.216
502 HG23 VAL 68 2HG2 VAL 68 -1.404 -2.278 -36.234
503 H GLU 69 H GLU 69 1.483 -4.234 -34.661
504 HA GLU 69 HA GLU 69 2.214 -3.826 -37.487
505 HB2 GLU 69 2HB GLU 69 2.321 -1.784 -35.935
506 HB3 GLU 69 3HB GLU 69 3.692 -2.582 -35.179
507 HG2 GLU 69 2HG GLU 69 4.760 -1.254 -36.692
508 HG3 GLU 69 3HG GLU 69 4.575 -2.732 -37.635
509 H HIS 70 H HIS 70 2.806 -5.969 -37.811
510 HA HIS 70 HA HIS 70 4.475 -7.449 -36.081
511 HB2 HIS 70 2HB HIS 70 3.911 -7.758 -39.034
512 HB3 HIS 70 3HB HIS 70 4.814 -8.929 -38.078
513 HD1 HIS 70 HD1 HIS 70 1.633 -8.607 -39.420
514 HD2 HIS 70 HD2 HIS 70 2.995 -9.546 -35.609
515 HE1 HIS 70 HE1 HIS 70 -0.272 -9.809 -38.302
516 H HIS 71 H HIS 71 6.659 -8.290 -36.751
517 HA HIS 71 HA HIS 71 8.394 -6.037 -37.234
518 HB2 HIS 71 2HB HIS 71 8.816 -7.890 -35.540
519 HB3 HIS 71 3HB HIS 71 9.229 -8.919 -36.909
520 HD1 HIS 71 HD1 HIS 71 10.475 -6.005 -34.923
521 HD2 HIS 71 HD2 HIS 71 11.701 -8.383 -38.102
522 HE1 HIS 71 HE1 HIS 71 12.904 -5.456 -35.276
Start of MODEL 11
1 H1 MET 1 H MET 1 4.144 -7.113 -1.414
2 HA MET 1 HA MET 1 4.543 -9.373 -2.971
3 HB2 MET 1 2HB MET 1 6.181 -6.995 -3.829
4 HB3 MET 1 3HB MET 1 6.712 -8.647 -4.115
5 HG2 MET 1 2HG MET 1 4.208 -8.757 -5.113
6 HG3 MET 1 3HG MET 1 4.616 -7.074 -5.439
7 HE1 MET 1 3HE MET 1 6.600 -10.842 -6.338
8 HE2 MET 1 1HE MET 1 4.892 -10.570 -5.992
9 HE3 MET 1 2HE MET 1 5.446 -10.676 -7.663
10 H LYS 2 H LYS 2 5.898 -10.733 -1.934
11 HA LYS 2 HA LYS 2 7.848 -9.612 -0.049
12 HB2 LYS 2 2HB LYS 2 5.756 -11.697 0.579
13 HB3 LYS 2 3HB LYS 2 7.167 -11.409 1.590
14 HG2 LYS 2 2HG LYS 2 6.343 -9.484 2.431
15 HG3 LYS 2 3HG LYS 2 5.531 -9.045 0.927
16 HD2 LYS 2 2HD LYS 2 3.906 -9.523 2.677
17 HD3 LYS 2 3HD LYS 2 3.797 -10.719 1.383
18 HE2 LYS 2 2HE LYS 2 4.849 -12.372 2.675
19 HE3 LYS 2 3HE LYS 2 5.460 -11.195 3.837
20 HZ1 LYS 2 3HZ LYS 2 3.146 -10.784 4.517
21 HZ2 LYS 2 1HZ LYS 2 3.624 -12.385 4.787
22 HZ3 LYS 2 2HZ LYS 2 2.628 -12.010 3.472
23 H THR 3 H THR 3 9.604 -10.992 0.452
24 HA THR 3 HA THR 3 9.833 -13.583 -0.772
25 HB THR 3 HB THR 3 10.341 -12.398 -2.764
26 HG1 THR 3 HG1 THR 3 12.514 -13.001 -3.066
27 HG21 THR 3 3HG2 THR 3 11.952 -10.582 -2.895
28 HG22 THR 3 1HG2 THR 3 12.273 -10.712 -1.166
29 HG23 THR 3 2HG2 THR 3 10.688 -10.184 -1.732
30 H PHE 4 H PHE 4 11.756 -14.702 -0.154
31 HA PHE 4 HA PHE 4 12.712 -13.921 2.432
32 HB2 PHE 4 2HB PHE 4 13.762 -16.188 0.739
33 HB3 PHE 4 3HB PHE 4 13.814 -16.036 2.493
34 HD1 PHE 4 HD1 PHE 4 11.196 -15.427 3.341
35 HD2 PHE 4 HD2 PHE 4 12.402 -17.914 0.104
36 HE1 PHE 4 HE1 PHE 4 9.080 -16.672 3.513
37 HE2 PHE 4 HE2 PHE 4 10.289 -19.162 0.270
38 HZ PHE 4 HZ PHE 4 8.624 -18.541 1.976
39 H ALA 5 H ALA 5 14.751 -13.270 3.033
40 HA ALA 5 HA ALA 5 16.365 -12.103 0.901
41 HB1 ALA 5 1HB ALA 5 16.536 -11.777 3.894
42 HB2 ALA 5 2HB ALA 5 17.516 -10.910 2.711
43 HB3 ALA 5 3HB ALA 5 15.770 -10.662 2.762
44 H LEU 6 H LEU 6 17.655 -13.629 0.013
45 HA LEU 6 HA LEU 6 19.166 -15.412 1.779
46 HB2 LEU 6 2HB LEU 6 19.251 -15.536 -1.205
47 HB3 LEU 6 3HB LEU 6 19.477 -16.828 -0.028
48 HG LEU 6 HG LEU 6 16.828 -15.517 -0.627
49 HD11 LEU 6 1HD1 LEU 6 16.380 -17.782 -1.709
50 HD12 LEU 6 2HD1 LEU 6 18.131 -17.981 -1.740
51 HD13 LEU 6 3HD1 LEU 6 17.382 -16.640 -2.606
52 HD21 LEU 6 3HD2 LEU 6 15.903 -16.868 0.921
53 HD22 LEU 6 1HD2 LEU 6 17.530 -16.865 1.602
54 HD23 LEU 6 2HD2 LEU 6 17.007 -18.200 0.575
55 H GLN 7 H GLN 7 21.415 -15.955 0.496
56 HA GLN 7 HA GLN 7 23.143 -13.884 1.103
57 HB2 GLN 7 2HB GLN 7 23.535 -16.436 0.498
58 HB3 GLN 7 3HB GLN 7 23.900 -15.763 -1.086
59 HG2 GLN 7 2HG GLN 7 25.715 -14.527 -0.264
60 HG3 GLN 7 3HG GLN 7 25.213 -14.749 1.411
61 HE21 GLN 7 1HE2 GLN 7 27.336 -15.738 -0.900
62 HE22 GLN 7 2HE2 GLN 7 27.792 -17.266 -0.237
63 H GLY 8 H GLY 8 23.467 -11.967 0.200
64 HA2 GLY 8 2HA GLY 8 23.767 -10.349 -1.412
65 HA3 GLY 8 3HA GLY 8 23.771 -11.628 -2.617
66 H ASP 9 H ASP 9 21.051 -11.588 -0.555
67 HA ASP 9 HA ASP 9 19.465 -10.260 -2.655
68 HB2 ASP 9 2HB ASP 9 18.968 -12.770 -1.103
69 HB3 ASP 9 3HB ASP 9 17.592 -11.802 -1.626
70 H THR 10 H THR 10 20.706 -9.180 -0.179
71 HA THR 10 HA THR 10 18.648 -8.725 1.734
72 HB THR 10 HB THR 10 20.133 -7.217 2.807
73 HG1 THR 10 HG1 THR 10 21.741 -7.168 0.457
74 HG21 THR 10 3HG2 THR 10 21.740 -9.369 1.428
75 HG22 THR 10 1HG2 THR 10 20.877 -9.516 2.957
76 HG23 THR 10 2HG2 THR 10 22.281 -8.455 2.836
77 H LEU 11 H LEU 11 18.306 -6.224 2.310
78 HA LEU 11 HA LEU 11 16.470 -5.210 0.525
79 HB2 LEU 11 2HB LEU 11 18.137 -3.486 2.340
80 HB3 LEU 11 3HB LEU 11 16.489 -3.198 1.788
81 HG LEU 11 HG LEU 11 17.391 -5.295 3.760
82 HD11 LEU 11 1HD1 LEU 11 17.341 -3.075 4.710
83 HD12 LEU 11 2HD1 LEU 11 15.979 -4.015 5.320
84 HD13 LEU 11 3HD1 LEU 11 15.722 -2.803 4.064
85 HD21 LEU 11 3HD2 LEU 11 14.989 -5.077 2.124
86 HD22 LEU 11 1HD2 LEU 11 14.649 -5.170 3.852
87 HD23 LEU 11 2HD2 LEU 11 15.598 -6.435 3.071
88 H ASP 12 H ASP 12 19.907 -4.396 0.824
89 HA ASP 12 HA ASP 12 20.003 -2.346 -1.068
90 HB2 ASP 12 2HB ASP 12 22.073 -4.336 -0.148
91 HB3 ASP 12 3HB ASP 12 22.444 -3.069 -1.314
92 H ALA 13 H ALA 13 19.903 -5.808 -1.455
93 HA ALA 13 HA ALA 13 20.557 -5.678 -4.281
94 HB1 ALA 13 1HB ALA 13 21.305 -7.715 -3.795
95 HB2 ALA 13 2HB ALA 13 20.442 -7.739 -2.257
96 HB3 ALA 13 3HB ALA 13 19.620 -8.235 -3.736
97 H ILE 14 H ILE 14 17.786 -6.903 -2.390
98 HA ILE 14 HA ILE 14 16.014 -7.335 -4.445
99 HB ILE 14 HB ILE 14 15.394 -6.288 -1.682
100 HG12 ILE 14 2HG1 ILE 14 15.146 -9.114 -2.708
101 HG13 ILE 14 3HG1 ILE 14 16.623 -8.513 -1.962
102 HG21 ILE 14 1HG2 ILE 14 13.219 -7.742 -2.512
103 HG22 ILE 14 2HG2 ILE 14 13.329 -5.983 -2.477
104 HG23 ILE 14 3HG2 ILE 14 13.679 -6.859 -3.967
105 HD11 ILE 14 3HD1 ILE 14 14.962 -9.792 -0.506
106 HD12 ILE 14 1HD1 ILE 14 15.616 -8.279 0.119
107 HD13 ILE 14 2HD1 ILE 14 13.988 -8.323 -0.559
108 H CYS 15 H CYS 15 16.468 -4.312 -2.623
109 HA CYS 15 HA CYS 15 14.540 -2.763 -3.863
110 HB2 CYS 15 2HB CYS 15 17.214 -2.065 -2.669
111 HB3 CYS 15 3HB CYS 15 16.163 -0.828 -3.348
112 HG CYS 15 HG CYS 15 15.862 -2.556 -0.477
113 H VAL 16 H VAL 16 17.724 -3.682 -4.992
114 HA VAL 16 HA VAL 16 17.611 -1.897 -7.273
115 HB VAL 16 HB VAL 16 19.612 -4.061 -6.606
116 HG11 VAL 16 1HG1 VAL 16 19.733 -3.690 -8.933
117 HG12 VAL 16 2HG1 VAL 16 19.548 -1.945 -8.743
118 HG13 VAL 16 3HG1 VAL 16 21.039 -2.736 -8.230
119 HG21 VAL 16 3HG2 VAL 16 19.416 -2.111 -5.002
120 HG22 VAL 16 1HG2 VAL 16 21.007 -2.373 -5.716
121 HG23 VAL 16 2HG2 VAL 16 19.968 -1.086 -6.327
122 H ARG 17 H ARG 17 16.720 -5.125 -6.499
123 HA ARG 17 HA ARG 17 16.707 -6.032 -9.252
124 HB2 ARG 17 2HB ARG 17 15.684 -7.360 -6.735
125 HB3 ARG 17 3HB ARG 17 15.788 -8.121 -8.317
126 HG2 ARG 17 2HG ARG 17 18.339 -7.257 -7.979
127 HG3 ARG 17 3HG ARG 17 17.870 -7.629 -6.318
128 HD2 ARG 17 2HD ARG 17 18.011 -9.816 -6.698
129 HD3 ARG 17 3HD ARG 17 16.971 -9.690 -8.116
130 HE ARG 17 HE ARG 17 19.398 -8.781 -8.968
131 HH11 ARG 17 1HH1 ARG 17 18.256 -11.704 -7.462
132 HH12 ARG 17 2HH1 ARG 17 19.453 -12.710 -8.207
133 HH21 ARG 17 1HH2 ARG 17 20.980 -10.095 -9.955
134 HH22 ARG 17 2HH2 ARG 17 21.003 -11.794 -9.624
135 H TYR 18 H TYR 18 14.591 -4.444 -7.089
136 HA TYR 18 HA TYR 18 12.265 -5.095 -8.768
137 HB2 TYR 18 2HB TYR 18 12.548 -4.246 -5.906
138 HB3 TYR 18 3HB TYR 18 11.045 -3.931 -6.767
139 HD1 TYR 18 HD1 TYR 18 13.433 -6.768 -6.255
140 HD2 TYR 18 HD2 TYR 18 9.380 -5.506 -6.547
141 HE1 TYR 18 HE1 TYR 18 12.690 -9.065 -5.783
142 HE2 TYR 18 HE2 TYR 18 8.626 -7.799 -6.075
143 HH TYR 18 HH TYR 18 9.312 -9.831 -5.257
144 H TYR 19 H TYR 19 13.453 -2.310 -6.878
145 HA TYR 19 HA TYR 19 12.166 -0.482 -8.725
146 HB2 TYR 19 2HB TYR 19 13.933 0.301 -6.415
147 HB3 TYR 19 3HB TYR 19 12.629 1.222 -7.156
148 HD1 TYR 19 HD2 TYR 19 10.253 0.466 -6.801
149 HD2 TYR 19 HD1 TYR 19 13.515 -1.171 -4.615
150 HE1 TYR 19 HE2 TYR 19 8.684 -0.384 -5.109
151 HE2 TYR 19 HE1 TYR 19 11.956 -2.027 -2.917
152 HH TYR 19 HH TYR 19 9.818 -2.317 -2.360
153 H GLY 20 H GLY 20 15.413 -1.507 -7.839
154 HA2 GLY 20 2HA GLY 20 17.249 -1.484 -9.320
155 HA3 GLY 20 3HA GLY 20 16.414 -0.287 -10.300
156 H ARG 21 H ARG 21 16.464 0.266 -6.913
157 HA ARG 21 HA ARG 21 18.925 1.703 -6.799
158 HB2 ARG 21 2HB ARG 21 18.016 3.955 -6.587
159 HB3 ARG 21 3HB ARG 21 17.619 3.279 -8.161
160 HG2 ARG 21 2HG ARG 21 15.651 3.010 -5.944
161 HG3 ARG 21 3HG ARG 21 15.830 4.568 -6.754
162 HD2 ARG 21 2HD ARG 21 15.736 2.660 -8.798
163 HD3 ARG 21 3HD ARG 21 14.491 2.179 -7.646
164 HE ARG 21 HE ARG 21 14.460 4.471 -9.364
165 HH11 ARG 21 1HH1 ARG 21 13.310 3.171 -6.346
166 HH12 ARG 21 2HH1 ARG 21 11.914 4.195 -6.287
167 HH21 ARG 21 1HH2 ARG 21 12.626 5.825 -9.297
168 HH22 ARG 21 2HH2 ARG 21 11.525 5.703 -7.966
169 H THR 22 H THR 22 19.092 2.966 -4.719
170 HA THR 22 HA THR 22 17.441 1.691 -2.635
171 HB THR 22 HB THR 22 19.610 2.269 -1.211
172 HG1 THR 22 HG1 THR 22 21.183 2.866 -2.491
173 HG21 THR 22 3HG2 THR 22 20.452 -0.054 -1.771
174 HG22 THR 22 1HG2 THR 22 19.177 -0.126 -2.987
175 HG23 THR 22 2HG2 THR 22 18.761 0.055 -1.283
176 H GLU 23 H GLU 23 18.991 4.612 -3.772
177 HA GLU 23 HA GLU 23 18.604 6.253 -1.541
178 HB2 GLU 23 2HB GLU 23 19.826 6.643 -3.859
179 HB3 GLU 23 3HB GLU 23 18.292 7.391 -4.282
180 HG2 GLU 23 2HG GLU 23 19.753 8.163 -1.788
181 HG3 GLU 23 3HG GLU 23 20.166 8.869 -3.349
182 H GLY 24 H GLY 24 16.739 6.588 -0.526
183 HA2 GLY 24 2HA GLY 24 14.624 7.586 -0.319
184 HA3 GLY 24 3HA GLY 24 14.446 7.520 -2.066
185 H VAL 25 H VAL 25 15.425 4.573 -1.673
186 HA VAL 25 HA VAL 25 12.715 3.519 -1.318
187 HB VAL 25 HB VAL 25 15.134 2.052 -2.369
188 HG11 VAL 25 1HG1 VAL 25 12.755 1.048 -1.509
189 HG12 VAL 25 2HG1 VAL 25 12.437 1.287 -3.228
190 HG13 VAL 25 3HG1 VAL 25 13.794 0.284 -2.712
191 HG21 VAL 25 3HG2 VAL 25 14.941 3.623 -4.015
192 HG22 VAL 25 1HG2 VAL 25 13.742 2.461 -4.583
193 HG23 VAL 25 2HG2 VAL 25 13.227 3.901 -3.704
194 H VAL 26 H VAL 26 16.031 3.055 -0.170
195 HA VAL 26 HA VAL 26 15.659 0.871 1.495
196 HB VAL 26 HB VAL 26 17.566 1.745 2.827
197 HG11 VAL 26 1HG1 VAL 26 19.184 1.821 0.901
198 HG12 VAL 26 2HG1 VAL 26 18.097 0.430 0.921
199 HG13 VAL 26 3HG1 VAL 26 17.787 1.777 -0.175
200 HG21 VAL 26 3HG2 VAL 26 17.128 4.097 2.800
201 HG22 VAL 26 1HG2 VAL 26 18.672 3.824 1.992
202 HG23 VAL 26 2HG2 VAL 26 17.223 4.148 1.039
203 H GLU 27 H GLU 27 14.969 4.276 2.074
204 HA GLU 27 HA GLU 27 14.439 4.071 4.838
205 HB2 GLU 27 2HB GLU 27 13.403 6.042 2.795
206 HB3 GLU 27 3HB GLU 27 13.221 6.219 4.534
207 HG2 GLU 27 2HG GLU 27 15.562 6.458 4.841
208 HG3 GLU 27 3HG GLU 27 15.889 5.991 3.173
209 H THR 28 H THR 28 12.583 3.282 2.026
210 HA THR 28 HA THR 28 10.016 3.305 3.274
211 HB THR 28 HB THR 28 10.418 1.498 0.969
212 HG1 THR 28 HG1 THR 28 10.666 4.313 0.625
213 HG21 THR 28 3HG2 THR 28 8.372 2.389 0.249
214 HG22 THR 28 1HG2 THR 28 8.576 3.861 1.198
215 HG23 THR 28 2HG2 THR 28 8.221 2.333 2.005
216 H VAL 29 H VAL 29 12.031 0.583 2.137
217 HA VAL 29 HA VAL 29 10.583 -1.484 3.249
218 HB VAL 29 HB VAL 29 13.594 -1.375 3.027
219 HG11 VAL 29 1HG1 VAL 29 13.292 -3.321 4.163
220 HG12 VAL 29 2HG1 VAL 29 11.636 -3.529 3.590
221 HG13 VAL 29 3HG1 VAL 29 12.993 -3.920 2.532
222 HG21 VAL 29 3HG2 VAL 29 12.668 -2.793 0.871
223 HG22 VAL 29 1HG2 VAL 29 11.483 -1.494 1.014
224 HG23 VAL 29 2HG2 VAL 29 13.195 -1.110 0.839
225 H LEU 30 H LEU 30 13.077 0.518 4.755
226 HA LEU 30 HA LEU 30 13.193 -0.931 7.190
227 HB2 LEU 30 2HB LEU 30 14.193 1.649 6.169
228 HB3 LEU 30 3HB LEU 30 13.993 1.540 7.917
229 HG LEU 30 HG LEU 30 15.365 -0.752 7.387
230 HD11 LEU 30 1HD1 LEU 30 17.227 -0.104 5.903
231 HD12 LEU 30 2HD1 LEU 30 16.338 1.354 5.462
232 HD13 LEU 30 3HD1 LEU 30 15.687 -0.233 5.054
233 HD21 LEU 30 3HD2 LEU 30 16.233 0.385 9.134
234 HD22 LEU 30 1HD2 LEU 30 16.028 1.955 8.357
235 HD23 LEU 30 2HD2 LEU 30 17.393 0.927 7.920
236 H ALA 31 H ALA 31 11.128 1.606 5.987
237 HA ALA 31 HA ALA 31 10.026 2.308 8.540
238 HB1 ALA 31 1HB ALA 31 8.473 3.672 7.300
239 HB2 ALA 31 2HB ALA 31 10.092 3.873 6.626
240 HB3 ALA 31 3HB ALA 31 8.910 2.862 5.795
241 H ALA 32 H ALA 32 9.259 0.026 6.007
242 HA ALA 32 HA ALA 32 6.676 -0.624 7.168
243 HB1 ALA 32 1HB ALA 32 7.015 -2.507 5.278
244 HB2 ALA 32 2HB ALA 32 6.391 -0.890 4.946
245 HB3 ALA 32 3HB ALA 32 8.093 -1.254 4.662
246 H ASN 33 H ASN 33 9.942 -1.750 7.260
247 HA ASN 33 HA ASN 33 9.100 -3.950 9.016
248 HB2 ASN 33 2HB ASN 33 11.273 -4.139 6.918
249 HB3 ASN 33 3HB ASN 33 10.828 -5.403 8.060
250 HD21 ASN 33 1HD2 ASN 33 10.011 -3.761 5.143
251 HD22 ASN 33 2HD2 ASN 33 8.713 -4.798 4.670
252 HA PRO 34 HA PRO 34 12.270 -1.213 11.023
253 HB2 PRO 34 2HB PRO 34 10.956 -1.036 13.392
254 HB3 PRO 34 3HB PRO 34 10.642 0.053 12.036
255 HG2 PRO 34 2HG PRO 34 9.118 -2.370 12.911
256 HG3 PRO 34 3HG PRO 34 8.504 -0.794 12.379
257 HD2 PRO 34 2HD PRO 34 8.571 -2.956 10.751
258 HD3 PRO 34 3HD PRO 34 8.778 -1.300 10.147
259 H GLY 35 H GLY 35 13.845 -1.857 12.461
260 HA2 GLY 35 2HA GLY 35 14.804 -3.182 14.151
261 HA3 GLY 35 3HA GLY 35 13.428 -4.270 14.049
262 H LEU 36 H LEU 36 13.874 -4.139 10.996
263 HA LEU 36 HA LEU 36 15.318 -6.563 10.803
264 HB2 LEU 36 2HB LEU 36 13.550 -5.350 9.220
265 HB3 LEU 36 3HB LEU 36 15.029 -4.831 8.414
266 HG LEU 36 HG LEU 36 14.065 -6.817 7.363
267 HD11 LEU 36 1HD1 LEU 36 16.082 -7.714 6.922
268 HD12 LEU 36 2HD1 LEU 36 16.465 -7.964 8.625
269 HD13 LEU 36 3HD1 LEU 36 16.667 -6.369 7.902
270 HD21 LEU 36 3HD2 LEU 36 13.752 -7.653 10.082
271 HD22 LEU 36 1HD2 LEU 36 14.712 -8.843 9.203
272 HD23 LEU 36 2HD2 LEU 36 13.115 -8.387 8.610
273 H ALA 37 H ALA 37 16.179 -3.193 10.213
274 HA ALA 37 HA ALA 37 18.703 -3.649 9.053
275 HB1 ALA 37 1HB ALA 37 18.952 -1.239 10.368
276 HB2 ALA 37 2HB ALA 37 18.338 -1.473 8.731
277 HB3 ALA 37 3HB ALA 37 17.216 -1.376 10.088
278 H GLU 38 H GLU 38 17.646 -3.408 12.400
279 HA GLU 38 HA GLU 38 20.175 -3.203 13.607
280 HB2 GLU 38 2HB GLU 38 17.716 -4.539 14.746
281 HB3 GLU 38 3HB GLU 38 19.079 -3.903 15.655
282 HG2 GLU 38 2HG GLU 38 18.392 -1.676 14.390
283 HG3 GLU 38 3HG GLU 38 16.825 -2.482 14.366
284 H LEU 39 H LEU 39 18.564 -5.849 12.116
285 HA LEU 39 HA LEU 39 19.604 -8.056 13.409
286 HB2 LEU 39 2HB LEU 39 17.950 -8.073 11.553
287 HB3 LEU 39 3HB LEU 39 19.270 -7.757 10.429
288 HG LEU 39 HG LEU 39 20.251 -9.906 10.900
289 HD11 LEU 39 1HD1 LEU 39 18.011 -10.277 12.883
290 HD12 LEU 39 2HD1 LEU 39 19.716 -10.050 13.271
291 HD13 LEU 39 3HD1 LEU 39 19.192 -11.501 12.416
292 HD21 LEU 39 3HD2 LEU 39 17.515 -9.607 9.940
293 HD22 LEU 39 1HD2 LEU 39 17.882 -11.237 10.505
294 HD23 LEU 39 2HD2 LEU 39 18.871 -10.497 9.246
295 H GLY 40 H GLY 40 21.046 -6.299 10.659
296 HA2 GLY 40 2HA GLY 40 23.607 -6.078 11.386
297 HA3 GLY 40 3HA GLY 40 23.527 -7.784 10.968
298 H ALA 41 H ALA 41 24.961 -7.570 9.246
299 HA ALA 41 HA ALA 41 24.561 -5.672 7.150
300 HB1 ALA 41 1HB ALA 41 26.765 -6.315 7.304
301 HB2 ALA 41 2HB ALA 41 26.363 -8.013 7.565
302 HB3 ALA 41 3HB ALA 41 26.207 -7.307 5.956
303 H VAL 42 H VAL 42 24.659 -9.204 6.765
304 HA VAL 42 HA VAL 42 22.573 -8.975 4.721
305 HB VAL 42 HB VAL 42 24.384 -11.308 5.363
306 HG11 VAL 42 1HG1 VAL 42 22.813 -12.455 4.247
307 HG12 VAL 42 2HG1 VAL 42 22.058 -10.992 3.612
308 HG13 VAL 42 3HG1 VAL 42 23.479 -11.670 2.816
309 HG21 VAL 42 3HG2 VAL 42 25.931 -10.414 4.033
310 HG22 VAL 42 1HG2 VAL 42 24.742 -10.073 2.776
311 HG23 VAL 42 2HG2 VAL 42 25.003 -8.915 4.081
312 H LEU 43 H LEU 43 20.696 -10.200 4.762
313 HA LEU 43 HA LEU 43 19.801 -10.971 7.405
314 HB2 LEU 43 2HB LEU 43 18.293 -11.103 4.801
315 HB3 LEU 43 3HB LEU 43 17.616 -11.156 6.428
316 HG LEU 43 HG LEU 43 17.130 -9.001 5.808
317 HD11 LEU 43 1HD1 LEU 43 18.546 -9.078 7.875
318 HD12 LEU 43 2HD1 LEU 43 18.531 -7.527 7.038
319 HD13 LEU 43 3HD1 LEU 43 19.917 -8.604 6.873
320 HD21 LEU 43 3HD2 LEU 43 17.988 -8.026 4.005
321 HD22 LEU 43 1HD2 LEU 43 19.027 -9.439 3.816
322 HD23 LEU 43 2HD2 LEU 43 19.610 -8.028 4.700
323 HA PRO 44 HA PRO 44 20.341 -15.312 7.025
324 HB2 PRO 44 2HB PRO 44 18.229 -16.220 8.471
325 HB3 PRO 44 3HB PRO 44 19.645 -15.464 9.210
326 HG2 PRO 44 2HG PRO 44 16.974 -14.270 8.580
327 HG3 PRO 44 3HG PRO 44 17.970 -14.078 10.034
328 HD2 PRO 44 2HD PRO 44 17.876 -12.211 8.076
329 HD3 PRO 44 3HD PRO 44 19.334 -12.506 9.045
330 H HIS 45 H HIS 45 19.991 -16.481 5.253
331 HA HIS 45 HA HIS 45 17.957 -16.154 3.420
332 HB2 HIS 45 2HB HIS 45 18.571 -18.458 2.612
333 HB3 HIS 45 3HB HIS 45 19.931 -17.353 2.790
334 HD1 HIS 45 HD1 HIS 45 18.603 -20.579 3.979
335 HD2 HIS 45 HD2 HIS 45 21.620 -17.925 5.035
336 HE1 HIS 45 HE1 HIS 45 20.109 -21.857 5.536
337 H GLY 46 H GLY 46 15.854 -16.211 3.948
338 HA2 GLY 46 2HA GLY 46 14.174 -18.184 4.064
339 HA3 GLY 46 3HA GLY 46 14.887 -18.401 5.655
340 H THR 47 H THR 47 15.131 -15.284 5.557
341 HA THR 47 HA THR 47 12.587 -14.851 6.895
342 HB THR 47 HB THR 47 15.005 -13.057 6.613
343 HG1 THR 47 HG1 THR 47 13.980 -14.524 8.836
344 HG21 THR 47 3HG2 THR 47 12.288 -12.536 7.562
345 HG22 THR 47 1HG2 THR 47 13.567 -11.407 7.118
346 HG23 THR 47 2HG2 THR 47 13.539 -12.118 8.732
347 H ALA 48 H ALA 48 10.885 -14.133 5.812
348 HA ALA 48 HA ALA 48 11.141 -12.953 3.201
349 HB1 ALA 48 1HB ALA 48 9.104 -13.794 2.963
350 HB2 ALA 48 2HB ALA 48 9.109 -14.279 4.659
351 HB3 ALA 48 3HB ALA 48 8.490 -12.694 4.197
352 H VAL 49 H VAL 49 10.507 -10.871 2.575
353 HA VAL 49 HA VAL 49 10.153 -8.917 4.746
354 HB VAL 49 HB VAL 49 11.906 -8.436 2.336
355 HG11 VAL 49 1HG1 VAL 49 12.628 -6.638 4.243
356 HG12 VAL 49 2HG1 VAL 49 11.480 -6.315 2.942
357 HG13 VAL 49 3HG1 VAL 49 10.895 -6.784 4.539
358 HG21 VAL 49 3HG2 VAL 49 13.809 -8.610 3.871
359 HG22 VAL 49 1HG2 VAL 49 12.714 -9.087 5.169
360 HG23 VAL 49 2HG2 VAL 49 12.923 -10.131 3.763
361 H GLU 50 H GLU 50 8.716 -7.304 4.356
362 HA GLU 50 HA GLU 50 6.968 -7.613 2.093
363 HB2 GLU 50 2HB GLU 50 5.941 -7.080 4.183
364 HB3 GLU 50 3HB GLU 50 6.998 -5.696 4.421
365 HG2 GLU 50 2HG GLU 50 5.911 -4.453 2.732
366 HG3 GLU 50 3HG GLU 50 5.042 -5.872 2.151
367 H LEU 51 H LEU 51 6.884 -6.428 0.277
368 HA LEU 51 HA LEU 51 8.841 -4.249 -0.003
369 HB2 LEU 51 2HB LEU 51 7.522 -5.773 -2.234
370 HB3 LEU 51 3HB LEU 51 8.928 -4.715 -2.330
371 HG LEU 51 HG LEU 51 8.862 -7.390 -0.934
372 HD11 LEU 51 1HD1 LEU 51 8.636 -7.613 -3.358
373 HD12 LEU 51 2HD1 LEU 51 10.208 -8.184 -2.799
374 HD13 LEU 51 3HD1 LEU 51 10.070 -6.611 -3.585
375 HD21 LEU 51 3HD2 LEU 51 11.384 -7.036 -1.082
376 HD22 LEU 51 1HD2 LEU 51 10.506 -6.096 0.124
377 HD23 LEU 51 2HD2 LEU 51 11.009 -5.339 -1.387
378 HA PRO 52 HA PRO 52 4.908 -1.943 -0.042
379 HB2 PRO 52 2HB PRO 52 6.033 0.384 0.787
380 HB3 PRO 52 3HB PRO 52 5.558 -0.904 1.901
381 HG2 PRO 52 2HG PRO 52 8.265 -0.252 0.801
382 HG3 PRO 52 3HG PRO 52 7.807 -0.696 2.456
383 HD2 PRO 52 2HD PRO 52 8.901 -2.465 0.723
384 HD3 PRO 52 3HD PRO 52 7.726 -2.946 1.964
385 H ASP 53 H ASP 53 4.127 -0.397 -1.471
386 HA ASP 53 HA ASP 53 3.992 0.792 -3.405
387 HB2 ASP 53 2HB ASP 53 5.971 1.973 -2.013
388 HB3 ASP 53 3HB ASP 53 6.880 1.470 -3.435
389 H VAL 54 H VAL 54 4.262 -1.879 -3.783
390 HA VAL 54 HA VAL 54 6.008 -2.037 -6.153
391 HB VAL 54 HB VAL 54 5.376 -4.239 -4.185
392 HG11 VAL 54 1HG1 VAL 54 6.573 -4.286 -6.920
393 HG12 VAL 54 2HG1 VAL 54 7.112 -5.449 -5.707
394 HG13 VAL 54 3HG1 VAL 54 5.414 -5.391 -6.183
395 HG21 VAL 54 3HG2 VAL 54 7.897 -2.740 -4.863
396 HG22 VAL 54 1HG2 VAL 54 7.084 -2.854 -3.302
397 HG23 VAL 54 2HG2 VAL 54 7.893 -4.267 -3.980
398 H GLN 55 H GLN 55 5.188 -3.036 -7.971
399 HA GLN 55 HA GLN 55 2.436 -2.872 -8.425
400 HB2 GLN 55 2HB GLN 55 4.369 -2.901 -10.120
401 HB3 GLN 55 3HB GLN 55 4.268 -4.653 -10.015
402 HG2 GLN 55 2HG GLN 55 3.034 -3.682 -11.928
403 HG3 GLN 55 3HG GLN 55 2.032 -4.646 -10.845
404 HE21 GLN 55 1HE2 GLN 55 0.082 -3.763 -10.978
405 HE22 GLN 55 2HE2 GLN 55 -0.282 -2.093 -10.728
406 H THR 56 H THR 56 1.035 -4.698 -9.171
407 HA THR 56 HA THR 56 -0.082 -6.642 -8.774
408 HB THR 56 HB THR 56 2.399 -7.889 -7.635
409 HG1 THR 56 HG1 THR 56 3.403 -7.670 -9.480
410 HG21 THR 56 3HG2 THR 56 0.883 -9.339 -9.644
411 HG22 THR 56 1HG2 THR 56 -0.122 -8.843 -8.283
412 HG23 THR 56 2HG2 THR 56 1.323 -9.815 -8.004
413 H ALA 57 H ALA 57 -0.243 -4.682 -6.827
414 HA ALA 57 HA ALA 57 -0.877 -6.305 -4.506
415 HB1 ALA 57 1HB ALA 57 1.336 -4.349 -4.554
416 HB2 ALA 57 2HB ALA 57 0.274 -4.303 -3.147
417 HB3 ALA 57 3HB ALA 57 1.117 -5.794 -3.568
418 HA PRO 58 HA PRO 58 -4.273 -3.558 -4.096
419 HB2 PRO 58 2HB PRO 58 -4.590 -3.417 -1.403
420 HB3 PRO 58 3HB PRO 58 -4.992 -4.859 -2.344
421 HG2 PRO 58 2HG PRO 58 -2.540 -4.272 -0.731
422 HG3 PRO 58 3HG PRO 58 -3.482 -5.771 -0.829
423 HD2 PRO 58 2HD PRO 58 -1.163 -5.417 -2.181
424 HD3 PRO 58 3HD PRO 58 -2.493 -6.412 -2.809
425 H VAL 59 H VAL 59 -3.332 -1.635 -4.915
426 HA VAL 59 HA VAL 59 -2.778 0.357 -2.833
427 HB VAL 59 HB VAL 59 -1.051 1.371 -4.401
428 HG11 VAL 59 1HG1 VAL 59 -0.295 0.405 -2.382
429 HG12 VAL 59 2HG1 VAL 59 -0.579 -1.234 -2.973
430 HG13 VAL 59 3HG1 VAL 59 0.729 -0.264 -3.652
431 HG21 VAL 59 3HG2 VAL 59 -0.369 0.324 -6.267
432 HG22 VAL 59 1HG2 VAL 59 -0.436 -1.270 -5.513
433 HG23 VAL 59 2HG2 VAL 59 -1.906 -0.533 -6.151
434 H ALA 60 H ALA 60 -5.087 -0.304 -4.584
435 HA ALA 60 HA ALA 60 -5.293 1.667 -6.619
436 HB1 ALA 60 1HB ALA 60 -7.630 0.406 -5.217
437 HB2 ALA 60 2HB ALA 60 -7.517 0.968 -6.886
438 HB3 ALA 60 3HB ALA 60 -6.645 -0.480 -6.382
439 H GLU 61 H GLU 61 -4.849 3.706 -5.868
440 HA GLU 61 HA GLU 61 -6.956 5.137 -4.640
441 HB2 GLU 61 2HB GLU 61 -5.961 3.952 -2.649
442 HB3 GLU 61 3HB GLU 61 -4.487 4.869 -2.924
443 HG2 GLU 61 2HG GLU 61 -5.818 5.895 -1.188
444 HG3 GLU 61 3HG GLU 61 -5.717 6.952 -2.595
445 H THR 62 H THR 62 -6.804 6.736 -6.098
446 HA THR 62 HA THR 62 -6.038 8.604 -7.152
447 HB THR 62 HB THR 62 -3.658 8.679 -5.318
448 HG1 THR 62 HG1 THR 62 -4.996 9.639 -3.755
449 HG21 THR 62 3HG2 THR 62 -3.473 10.814 -5.978
450 HG22 THR 62 1HG2 THR 62 -5.203 11.106 -5.809
451 HG23 THR 62 2HG2 THR 62 -4.572 10.375 -7.285
452 H VAL 63 H VAL 63 -5.113 5.898 -7.895
453 HA VAL 63 HA VAL 63 -2.482 6.495 -9.055
454 HB VAL 63 HB VAL 63 -2.747 4.373 -7.770
455 HG11 VAL 63 1HG1 VAL 63 -4.288 3.250 -10.068
456 HG12 VAL 63 2HG1 VAL 63 -4.156 2.665 -8.408
457 HG13 VAL 63 3HG1 VAL 63 -5.142 4.082 -8.769
458 HG21 VAL 63 3HG2 VAL 63 -2.186 3.841 -10.679
459 HG22 VAL 63 1HG2 VAL 63 -1.083 4.736 -9.634
460 HG23 VAL 63 2HG2 VAL 63 -1.472 3.054 -9.272
461 H ASN 64 H ASN 64 -2.082 6.126 -11.279
462 HA ASN 64 HA ASN 64 -4.070 7.064 -13.017
463 HB2 ASN 64 2HB ASN 64 -1.669 5.449 -13.876
464 HB3 ASN 64 3HB ASN 64 -2.509 6.706 -14.780
465 HD21 ASN 64 1HD2 ASN 64 -2.666 8.809 -13.290
466 HD22 ASN 64 2HD2 ASN 64 -1.129 9.337 -12.704
467 H LEU 65 H LEU 65 -4.098 5.529 -15.259
468 HA LEU 65 HA LEU 65 -4.853 2.817 -14.634
469 HB2 LEU 65 2HB LEU 65 -7.146 3.294 -15.792
470 HB3 LEU 65 3HB LEU 65 -6.938 3.553 -14.061
471 HG LEU 65 HG LEU 65 -6.582 5.981 -14.551
472 HD11 LEU 65 1HD1 LEU 65 -7.585 5.242 -17.294
473 HD12 LEU 65 2HD1 LEU 65 -5.922 5.687 -16.914
474 HD13 LEU 65 3HD1 LEU 65 -7.219 6.861 -16.698
475 HD21 LEU 65 3HD2 LEU 65 -8.764 6.316 -14.192
476 HD22 LEU 65 1HD2 LEU 65 -8.899 4.558 -14.239
477 HD23 LEU 65 2HD2 LEU 65 -9.230 5.507 -15.688
478 H TRP 66 H TRP 66 -6.008 1.891 -16.752
479 HA TRP 66 HA TRP 66 -4.069 2.156 -18.823
480 HB2 TRP 66 2HB TRP 66 -6.743 0.770 -19.037
481 HB3 TRP 66 3HB TRP 66 -5.282 0.441 -19.965
482 HD1 TRP 66 HD1 TRP 66 -3.123 -0.439 -18.294
483 HE1 TRP 66 HE1 TRP 66 -3.254 -2.208 -16.429
484 HE3 TRP 66 HE3 TRP 66 -8.155 -0.306 -17.402
485 HZ2 TRP 66 HZ2 TRP 66 -5.229 -3.390 -14.796
486 HZ3 TRP 66 HZ3 TRP 66 -9.085 -1.788 -15.672
487 HH2 TRP 66 HH2 TRP 66 -7.651 -3.298 -14.397
488 H GLU 67 H GLU 67 -5.307 2.095 -21.194
489 HA GLU 67 HA GLU 67 -7.290 4.141 -21.485
490 HB2 GLU 67 2HB GLU 67 -4.412 4.776 -21.846
491 HB3 GLU 67 3HB GLU 67 -5.521 5.400 -23.060
492 HG2 GLU 67 2HG GLU 67 -6.874 6.264 -21.036
493 HG3 GLU 67 3HG GLU 67 -5.374 6.021 -20.143
494 H VAL 68 H VAL 68 -8.510 3.132 -22.942
495 HA VAL 68 HA VAL 68 -7.228 1.691 -25.149
496 HB VAL 68 HB VAL 68 -9.033 0.608 -23.720
497 HG11 VAL 68 1HG1 VAL 68 -11.164 1.345 -23.705
498 HG12 VAL 68 2HG1 VAL 68 -10.420 2.888 -24.131
499 HG13 VAL 68 3HG1 VAL 68 -11.108 1.862 -25.390
500 HG21 VAL 68 3HG2 VAL 68 -10.297 0.014 -26.070
501 HG22 VAL 68 1HG2 VAL 68 -8.746 0.641 -26.630
502 HG23 VAL 68 2HG2 VAL 68 -8.795 -0.721 -25.510
503 H GLU 69 H GLU 69 -7.542 4.674 -24.917
504 HA GLU 69 HA GLU 69 -9.343 5.237 -27.150
505 HB2 GLU 69 2HB GLU 69 -9.133 7.547 -26.574
506 HB3 GLU 69 3HB GLU 69 -9.376 6.653 -25.080
507 HG2 GLU 69 2HG GLU 69 -7.033 6.803 -24.552
508 HG3 GLU 69 3HG GLU 69 -6.699 7.567 -26.105
509 H HIS 70 H HIS 70 -6.750 3.814 -27.429
510 HA HIS 70 HA HIS 70 -5.842 5.153 -29.772
511 HB2 HIS 70 2HB HIS 70 -4.724 6.330 -27.701
512 HB3 HIS 70 3HB HIS 70 -3.677 4.914 -27.718
513 HD1 HIS 70 HD1 HIS 70 -4.973 6.990 -30.632
514 HD2 HIS 70 HD2 HIS 70 -1.398 5.803 -28.878
515 HE1 HIS 70 HE1 HIS 70 -3.160 7.869 -32.138
516 H HIS 71 H HIS 71 -3.840 4.004 -30.678
517 HA HIS 71 HA HIS 71 -4.385 1.281 -30.930
518 HB2 HIS 71 2HB HIS 71 -2.378 1.126 -32.218
519 HB3 HIS 71 3HB HIS 71 -3.072 2.713 -32.537
520 HD1 HIS 71 HD1 HIS 71 -1.601 4.691 -32.126
521 HD2 HIS 71 HD2 HIS 71 -0.101 1.219 -30.408
522 HE1 HIS 71 HE1 HIS 71 0.691 5.294 -31.284
Start of MODEL 12
1 H1 MET 1 H MET 1 13.421 -1.640 -12.180
2 HA MET 1 HA MET 1 15.802 -0.101 -11.433
3 HB2 MET 1 2HB MET 1 13.558 1.166 -11.129
4 HB3 MET 1 3HB MET 1 13.306 0.076 -9.773
5 HG2 MET 1 2HG MET 1 14.232 2.064 -8.900
6 HG3 MET 1 3HG MET 1 15.503 0.844 -8.860
7 HE1 MET 1 3HE MET 1 15.163 4.084 -8.819
8 HE2 MET 1 1HE MET 1 16.225 4.873 -9.986
9 HE3 MET 1 2HE MET 1 14.566 4.474 -10.433
10 H LYS 2 H LYS 2 16.801 -2.157 -11.179
11 HA LYS 2 HA LYS 2 16.086 -3.453 -8.643
12 HB2 LYS 2 2HB LYS 2 16.559 -5.660 -9.612
13 HB3 LYS 2 3HB LYS 2 15.210 -4.874 -10.421
14 HG2 LYS 2 2HG LYS 2 16.778 -4.172 -12.219
15 HG3 LYS 2 3HG LYS 2 18.031 -5.135 -11.434
16 HD2 LYS 2 2HD LYS 2 16.291 -7.056 -11.588
17 HD3 LYS 2 3HD LYS 2 15.531 -6.038 -12.813
18 HE2 LYS 2 2HE LYS 2 16.940 -7.374 -14.074
19 HE3 LYS 2 3HE LYS 2 17.909 -5.920 -13.834
20 HZ1 LYS 2 3HZ LYS 2 18.684 -7.301 -11.735
21 HZ2 LYS 2 1HZ LYS 2 19.429 -7.470 -13.245
22 HZ3 LYS 2 2HZ LYS 2 18.276 -8.599 -12.740
23 H THR 3 H THR 3 17.829 -4.440 -7.535
24 HA THR 3 HA THR 3 20.513 -4.109 -8.602
25 HB THR 3 HB THR 3 19.964 -1.937 -7.482
26 HG1 THR 3 HG1 THR 3 21.916 -2.133 -6.034
27 HG21 THR 3 3HG2 THR 3 19.047 -1.864 -5.453
28 HG22 THR 3 1HG2 THR 3 20.346 -2.849 -4.783
29 HG23 THR 3 2HG2 THR 3 18.927 -3.623 -5.488
30 H PHE 4 H PHE 4 22.133 -5.226 -7.372
31 HA PHE 4 HA PHE 4 21.135 -7.642 -6.195
32 HB2 PHE 4 2HB PHE 4 24.010 -6.726 -6.234
33 HB3 PHE 4 3HB PHE 4 23.402 -8.376 -6.154
34 HD1 PHE 4 HD2 PHE 4 22.055 -9.215 -8.183
35 HD2 PHE 4 HD1 PHE 4 24.590 -5.797 -8.271
36 HE1 PHE 4 HE2 PHE 4 22.192 -9.384 -10.633
37 HE2 PHE 4 HE1 PHE 4 24.731 -5.960 -10.722
38 HZ PHE 4 HZ PHE 4 23.532 -7.756 -11.906
39 H ALA 5 H ALA 5 21.217 -8.310 -4.088
40 HA ALA 5 HA ALA 5 21.475 -6.202 -2.100
41 HB1 ALA 5 1HB ALA 5 19.565 -7.926 -2.245
42 HB2 ALA 5 2HB ALA 5 20.712 -9.034 -1.490
43 HB3 ALA 5 3HB ALA 5 20.243 -7.550 -0.661
44 H LEU 6 H LEU 6 22.798 -6.349 -0.255
45 HA LEU 6 HA LEU 6 24.793 -8.461 -0.136
46 HB2 LEU 6 2HB LEU 6 25.551 -5.555 -0.395
47 HB3 LEU 6 3HB LEU 6 26.663 -6.881 -0.064
48 HG LEU 6 HG LEU 6 25.035 -6.713 -2.590
49 HD11 LEU 6 1HD1 LEU 6 27.847 -5.729 -2.127
50 HD12 LEU 6 2HD1 LEU 6 26.434 -4.715 -2.417
51 HD13 LEU 6 3HD1 LEU 6 27.012 -5.803 -3.679
52 HD21 LEU 6 3HD2 LEU 6 27.024 -8.544 -1.462
53 HD22 LEU 6 1HD2 LEU 6 27.343 -8.054 -3.126
54 HD23 LEU 6 2HD2 LEU 6 25.807 -8.814 -2.710
55 H GLN 7 H GLN 7 26.442 -7.682 1.755
56 HA GLN 7 HA GLN 7 25.055 -7.903 4.131
57 HB2 GLN 7 2HB GLN 7 27.775 -7.526 3.332
58 HB3 GLN 7 3HB GLN 7 27.433 -6.457 4.686
59 HG2 GLN 7 2HG GLN 7 26.365 -8.628 5.707
60 HG3 GLN 7 3HG GLN 7 27.445 -9.426 4.565
61 HE21 GLN 7 1HE2 GLN 7 28.191 -10.192 6.784
62 HE22 GLN 7 2HE2 GLN 7 29.469 -9.284 7.510
63 H GLY 8 H GLY 8 23.828 -6.562 5.276
64 HA2 GLY 8 2HA GLY 8 22.884 -4.634 6.088
65 HA3 GLY 8 3HA GLY 8 24.424 -3.854 5.761
66 H ASP 9 H ASP 9 22.728 -5.383 3.162
67 HA ASP 9 HA ASP 9 21.826 -2.748 2.203
68 HB2 ASP 9 2HB ASP 9 23.408 -4.861 0.790
69 HB3 ASP 9 3HB ASP 9 22.313 -3.838 -0.136
70 H THR 10 H THR 10 20.444 -5.008 3.580
71 HA THR 10 HA THR 10 18.778 -6.305 1.661
72 HB THR 10 HB THR 10 17.628 -7.269 3.463
73 HG1 THR 10 HG1 THR 10 18.638 -5.470 5.375
74 HG21 THR 10 3HG2 THR 10 20.314 -6.660 4.688
75 HG22 THR 10 1HG2 THR 10 20.097 -7.795 3.356
76 HG23 THR 10 2HG2 THR 10 19.323 -8.101 4.911
77 H LEU 11 H LEU 11 16.265 -6.115 2.136
78 HA LEU 11 HA LEU 11 15.345 -3.792 0.997
79 HB2 LEU 11 2HB LEU 11 13.769 -5.418 2.978
80 HB3 LEU 11 3HB LEU 11 13.144 -4.445 1.649
81 HG LEU 11 HG LEU 11 14.700 -7.018 1.401
82 HD11 LEU 11 1HD1 LEU 11 12.182 -6.908 2.148
83 HD12 LEU 11 2HD1 LEU 11 12.732 -8.096 0.967
84 HD13 LEU 11 3HD1 LEU 11 11.916 -6.629 0.426
85 HD21 LEU 11 3HD2 LEU 11 13.912 -6.738 -1.033
86 HD22 LEU 11 1HD2 LEU 11 15.304 -5.801 -0.489
87 HD23 LEU 11 2HD2 LEU 11 13.721 -5.033 -0.620
88 H ASP 12 H ASP 12 15.717 -4.531 4.431
89 HA ASP 12 HA ASP 12 14.443 -2.338 5.543
90 HB2 ASP 12 2HB ASP 12 15.158 -3.994 7.049
91 HB3 ASP 12 3HB ASP 12 16.808 -3.970 6.433
92 H ALA 13 H ALA 13 17.677 -2.589 4.172
93 HA ALA 13 HA ALA 13 18.315 0.155 4.879
94 HB1 ALA 13 1HB ALA 13 19.803 -2.186 4.160
95 HB2 ALA 13 2HB ALA 13 20.257 -0.841 3.112
96 HB3 ALA 13 3HB ALA 13 20.374 -0.673 4.863
97 H ILE 14 H ILE 14 18.014 -1.738 1.872
98 HA ILE 14 HA ILE 14 18.346 0.282 0.031
99 HB ILE 14 HB ILE 14 16.428 -2.044 -0.167
100 HG12 ILE 14 2HG1 ILE 14 19.257 -1.792 -1.205
101 HG13 ILE 14 3HG1 ILE 14 18.832 -2.605 0.297
102 HG21 ILE 14 1HG2 ILE 14 16.875 0.158 -1.918
103 HG22 ILE 14 2HG2 ILE 14 17.485 -1.309 -2.682
104 HG23 ILE 14 3HG2 ILE 14 15.810 -1.230 -2.135
105 HD11 ILE 14 3HD1 ILE 14 17.276 -3.566 -1.949
106 HD12 ILE 14 1HD1 ILE 14 19.011 -3.755 -2.196
107 HD13 ILE 14 2HD1 ILE 14 18.241 -4.456 -0.772
108 H CYS 15 H CYS 15 15.290 -0.770 1.528
109 HA CYS 15 HA CYS 15 13.574 0.998 0.261
110 HB2 CYS 15 2HB CYS 15 13.500 -0.233 3.011
111 HB3 CYS 15 3HB CYS 15 12.200 0.792 2.416
112 HG CYS 15 HG CYS 15 11.913 -0.956 0.082
113 H VAL 16 H VAL 16 15.884 1.577 2.781
114 HA VAL 16 HA VAL 16 14.783 4.174 3.462
115 HB VAL 16 HB VAL 16 17.333 2.829 4.366
116 HG11 VAL 16 1HG1 VAL 16 16.116 5.481 4.975
117 HG12 VAL 16 2HG1 VAL 16 16.985 4.622 6.248
118 HG13 VAL 16 3HG1 VAL 16 17.809 5.043 4.746
119 HG21 VAL 16 3HG2 VAL 16 15.148 1.769 5.039
120 HG22 VAL 16 1HG2 VAL 16 16.189 2.274 6.370
121 HG23 VAL 16 2HG2 VAL 16 14.791 3.253 5.924
122 H ARG 17 H ARG 17 17.345 2.822 1.508
123 HA ARG 17 HA ARG 17 18.569 5.403 1.020
124 HB2 ARG 17 2HB ARG 17 20.298 4.262 0.035
125 HB3 ARG 17 3HB ARG 17 19.675 3.004 1.095
126 HG2 ARG 17 2HG ARG 17 18.382 2.093 -0.798
127 HG3 ARG 17 3HG ARG 17 19.107 3.314 -1.845
128 HD2 ARG 17 2HD ARG 17 20.197 1.049 -1.910
129 HD3 ARG 17 3HD ARG 17 21.276 2.398 -1.557
130 HE ARG 17 HE ARG 17 20.226 1.092 0.783
131 HH11 ARG 17 1HH1 ARG 17 22.756 1.111 -1.609
132 HH12 ARG 17 2HH1 ARG 17 23.892 0.276 -0.603
133 HH21 ARG 17 1HH2 ARG 17 21.713 -0.009 2.117
134 HH22 ARG 17 2HH2 ARG 17 23.298 -0.362 1.516
135 H TYR 18 H TYR 18 15.948 3.693 -0.189
136 HA TYR 18 HA TYR 18 16.111 5.032 -2.804
137 HB2 TYR 18 2HB TYR 18 15.024 2.448 -1.907
138 HB3 TYR 18 3HB TYR 18 13.979 3.334 -3.013
139 HD1 TYR 18 HD1 TYR 18 17.405 1.959 -2.626
140 HD2 TYR 18 HD2 TYR 18 14.437 3.383 -5.321
141 HE1 TYR 18 HE1 TYR 18 18.757 1.169 -4.522
142 HE2 TYR 18 HE2 TYR 18 15.780 2.596 -7.225
143 HH TYR 18 HH TYR 18 18.524 2.145 -7.478
144 H TYR 19 H TYR 19 13.582 4.059 -0.479
145 HA TYR 19 HA TYR 19 12.015 6.398 -1.261
146 HB2 TYR 19 2HB TYR 19 11.151 4.265 0.681
147 HB3 TYR 19 3HB TYR 19 10.144 5.339 -0.283
148 HD1 TYR 19 HD2 TYR 19 9.730 4.877 -2.638
149 HD2 TYR 19 HD1 TYR 19 12.133 2.269 -0.288
150 HE1 TYR 19 HE2 TYR 19 9.543 3.148 -4.377
151 HE2 TYR 19 HE1 TYR 19 11.954 0.533 -2.021
152 HH TYR 19 HH TYR 19 10.161 0.010 -3.924
153 H GLY 20 H GLY 20 13.669 5.008 1.512
154 HA2 GLY 20 2HA GLY 20 14.629 6.301 3.241
155 HA3 GLY 20 3HA GLY 20 13.539 7.617 2.829
156 H ARG 21 H ARG 21 12.299 4.396 3.169
157 HA ARG 21 HA ARG 21 11.640 4.580 5.938
158 HB2 ARG 21 2HB ARG 21 9.219 4.822 5.706
159 HB3 ARG 21 3HB ARG 21 10.052 6.235 5.074
160 HG2 ARG 21 2HG ARG 21 9.350 4.058 3.180
161 HG3 ARG 21 3HG ARG 21 8.061 5.105 3.776
162 HD2 ARG 21 2HD ARG 21 9.818 6.988 3.140
163 HD3 ARG 21 3HD ARG 21 10.379 5.738 2.031
164 HE ARG 21 HE ARG 21 7.732 5.777 1.564
165 HH11 ARG 21 1HH1 ARG 21 10.123 8.302 1.735
166 HH12 ARG 21 2HH1 ARG 21 9.311 9.327 0.599
167 HH21 ARG 21 1HH2 ARG 21 6.653 7.118 0.067
168 HH22 ARG 21 2HH2 ARG 21 7.337 8.653 -0.349
169 H THR 22 H THR 22 10.345 2.751 6.671
170 HA THR 22 HA THR 22 10.512 0.480 4.798
171 HB THR 22 HB THR 22 10.470 -0.800 7.140
172 HG1 THR 22 HG1 THR 22 10.846 0.514 8.745
173 HG21 THR 22 3HG2 THR 22 12.278 -1.423 5.936
174 HG22 THR 22 1HG2 THR 22 13.131 -0.323 7.018
175 HG23 THR 22 2HG2 THR 22 12.631 0.225 5.418
176 H GLU 23 H GLU 23 8.516 2.272 6.980
177 HA GLU 23 HA GLU 23 6.468 0.319 7.303
178 HB2 GLU 23 2HB GLU 23 6.895 2.345 8.780
179 HB3 GLU 23 3HB GLU 23 6.126 3.306 7.525
180 HG2 GLU 23 2HG GLU 23 4.109 1.847 7.767
181 HG3 GLU 23 3HG GLU 23 4.888 1.118 9.170
182 H GLY 24 H GLY 24 5.307 -0.443 5.662
183 HA2 GLY 24 2HA GLY 24 3.572 -0.216 4.075
184 HA3 GLY 24 3HA GLY 24 4.030 1.466 3.850
185 H VAL 25 H VAL 25 6.921 0.438 3.683
186 HA VAL 25 HA VAL 25 6.829 -0.052 0.803
187 HB VAL 25 HB VAL 25 9.260 0.499 2.506
188 HG11 VAL 25 1HG1 VAL 25 9.320 -0.538 0.094
189 HG12 VAL 25 2HG1 VAL 25 9.036 1.133 -0.396
190 HG13 VAL 25 3HG1 VAL 25 10.458 0.724 0.565
191 HG21 VAL 25 3HG2 VAL 25 8.124 2.465 2.820
192 HG22 VAL 25 1HG2 VAL 25 8.943 2.817 1.297
193 HG23 VAL 25 2HG2 VAL 25 7.248 2.330 1.295
194 H VAL 26 H VAL 26 8.131 -1.464 3.774
195 HA VAL 26 HA VAL 26 9.596 -3.561 2.714
196 HB VAL 26 HB VAL 26 9.149 -4.766 4.835
197 HG11 VAL 26 1HG1 VAL 26 10.960 -3.319 4.986
198 HG12 VAL 26 2HG1 VAL 26 9.948 -1.879 4.854
199 HG13 VAL 26 3HG1 VAL 26 9.947 -2.827 6.342
200 HG21 VAL 26 3HG2 VAL 26 6.896 -4.279 5.314
201 HG22 VAL 26 1HG2 VAL 26 7.824 -3.452 6.565
202 HG23 VAL 26 2HG2 VAL 26 7.164 -2.539 5.208
203 H GLU 27 H GLU 27 6.131 -3.236 3.118
204 HA GLU 27 HA GLU 27 5.535 -5.982 2.576
205 HB2 GLU 27 2HB GLU 27 3.829 -3.491 2.593
206 HB3 GLU 27 3HB GLU 27 3.186 -5.095 2.271
207 HG2 GLU 27 2HG GLU 27 4.758 -4.617 4.757
208 HG3 GLU 27 3HG GLU 27 3.079 -4.086 4.666
209 H THR 28 H THR 28 6.052 -3.134 0.664
210 HA THR 28 HA THR 28 4.766 -3.994 -1.709
211 HB THR 28 HB THR 28 7.157 -2.197 -1.814
212 HG1 THR 28 HG1 THR 28 4.658 -1.623 -0.588
213 HG21 THR 28 3HG2 THR 28 4.833 -1.164 -3.077
214 HG22 THR 28 1HG2 THR 28 4.967 -2.869 -3.506
215 HG23 THR 28 2HG2 THR 28 6.308 -1.771 -3.828
216 H VAL 29 H VAL 29 8.264 -3.764 -1.022
217 HA VAL 29 HA VAL 29 9.180 -5.157 -3.224
218 HB VAL 29 HB VAL 29 10.418 -5.250 -0.470
219 HG11 VAL 29 1HG1 VAL 29 11.759 -6.690 -1.581
220 HG12 VAL 29 2HG1 VAL 29 11.296 -6.069 -3.166
221 HG13 VAL 29 3HG1 VAL 29 12.482 -5.202 -2.190
222 HG21 VAL 29 3HG2 VAL 29 10.210 -2.975 -0.846
223 HG22 VAL 29 1HG2 VAL 29 11.799 -3.321 -1.528
224 HG23 VAL 29 2HG2 VAL 29 10.404 -3.140 -2.591
225 H LEU 30 H LEU 30 7.815 -6.380 -0.249
226 HA LEU 30 HA LEU 30 8.665 -9.054 -0.455
227 HB2 LEU 30 2HB LEU 30 7.416 -7.694 1.443
228 HB3 LEU 30 3HB LEU 30 5.997 -8.423 0.694
229 HG LEU 30 HG LEU 30 7.264 -10.656 1.018
230 HD11 LEU 30 1HD1 LEU 30 9.378 -10.222 1.722
231 HD12 LEU 30 2HD1 LEU 30 8.588 -10.307 3.296
232 HD13 LEU 30 3HD1 LEU 30 8.917 -8.739 2.558
233 HD21 LEU 30 3HD2 LEU 30 5.876 -9.008 3.085
234 HD22 LEU 30 1HD2 LEU 30 6.527 -10.588 3.520
235 HD23 LEU 30 2HD2 LEU 30 5.322 -10.454 2.239
236 H ALA 31 H ALA 31 5.982 -7.312 -1.888
237 HA ALA 31 HA ALA 31 4.675 -9.664 -2.892
238 HB1 ALA 31 1HB ALA 31 3.580 -7.721 -4.364
239 HB2 ALA 31 2HB ALA 31 3.104 -8.044 -2.696
240 HB3 ALA 31 3HB ALA 31 4.241 -6.743 -3.052
241 H ALA 32 H ALA 32 7.047 -7.383 -4.076
242 HA ALA 32 HA ALA 32 6.894 -8.301 -6.804
243 HB1 ALA 32 1HB ALA 32 7.509 -6.042 -6.557
244 HB2 ALA 32 2HB ALA 32 8.744 -6.425 -5.358
245 HB3 ALA 32 3HB ALA 32 8.983 -6.879 -7.045
246 H ASN 33 H ASN 33 8.755 -9.044 -3.954
247 HA ASN 33 HA ASN 33 10.214 -11.082 -5.499
248 HB2 ASN 33 2HB ASN 33 11.259 -9.318 -3.280
249 HB3 ASN 33 3HB ASN 33 12.097 -10.762 -3.840
250 HD21 ASN 33 1HD2 ASN 33 10.760 -7.690 -4.960
251 HD22 ASN 33 2HD2 ASN 33 11.931 -7.432 -6.204
252 HA PRO 34 HA PRO 34 7.762 -13.064 -2.094
253 HB2 PRO 34 2HB PRO 34 6.829 -15.094 -3.636
254 HB3 PRO 34 3HB PRO 34 6.023 -13.525 -3.524
255 HG2 PRO 34 2HG PRO 34 7.868 -14.560 -5.642
256 HG3 PRO 34 3HG PRO 34 6.359 -13.644 -5.821
257 HD2 PRO 34 2HD PRO 34 8.799 -12.486 -6.017
258 HD3 PRO 34 3HD PRO 34 7.383 -11.628 -5.375
259 H GLY 35 H GLY 35 8.421 -14.781 -0.867
260 HA2 GLY 35 2HA GLY 35 9.506 -16.810 -0.403
261 HA3 GLY 35 3HA GLY 35 10.228 -16.766 -2.004
262 H LEU 36 H LEU 36 10.887 -13.812 -1.227
263 HA LEU 36 HA LEU 36 13.580 -14.338 -0.487
264 HB2 LEU 36 2HB LEU 36 12.464 -12.340 -1.794
265 HB3 LEU 36 3HB LEU 36 12.381 -11.629 -0.183
266 HG LEU 36 HG LEU 36 14.345 -10.865 -1.434
267 HD11 LEU 36 1HD1 LEU 36 15.572 -10.767 0.435
268 HD12 LEU 36 2HD1 LEU 36 15.662 -12.522 0.586
269 HD13 LEU 36 3HD1 LEU 36 14.240 -11.659 1.171
270 HD21 LEU 36 3HD2 LEU 36 15.989 -12.257 -2.267
271 HD22 LEU 36 1HD2 LEU 36 14.523 -13.172 -2.620
272 HD23 LEU 36 2HD2 LEU 36 15.521 -13.606 -1.232
273 H ALA 37 H ALA 37 10.711 -13.336 1.264
274 HA ALA 37 HA ALA 37 11.932 -12.502 3.650
275 HB1 ALA 37 1HB ALA 37 9.459 -13.704 4.296
276 HB2 ALA 37 2HB ALA 37 9.818 -11.990 4.080
277 HB3 ALA 37 3HB ALA 37 9.280 -12.958 2.707
278 H GLU 38 H GLU 38 11.603 -15.611 2.278
279 HA GLU 38 HA GLU 38 11.852 -17.009 4.815
280 HB2 GLU 38 2HB GLU 38 11.670 -17.959 1.957
281 HB3 GLU 38 3HB GLU 38 11.939 -19.048 3.310
282 HG2 GLU 38 2HG GLU 38 9.821 -18.317 4.305
283 HG3 GLU 38 3HG GLU 38 9.546 -17.266 2.917
284 H LEU 39 H LEU 39 13.897 -15.519 2.629
285 HA LEU 39 HA LEU 39 16.082 -17.186 2.369
286 HB2 LEU 39 2HB LEU 39 15.663 -14.818 1.451
287 HB3 LEU 39 3HB LEU 39 16.394 -14.263 2.956
288 HG LEU 39 HG LEU 39 17.971 -14.288 1.059
289 HD11 LEU 39 1HD1 LEU 39 19.076 -16.406 2.764
290 HD12 LEU 39 2HD1 LEU 39 18.420 -15.017 3.629
291 HD13 LEU 39 3HD1 LEU 39 19.684 -14.787 2.421
292 HD21 LEU 39 3HD2 LEU 39 16.857 -16.401 0.082
293 HD22 LEU 39 1HD2 LEU 39 17.927 -17.281 1.173
294 HD23 LEU 39 2HD2 LEU 39 18.606 -16.221 -0.062
295 H GLY 40 H GLY 40 15.488 -14.825 4.978
296 HA2 GLY 40 2HA GLY 40 16.081 -16.195 7.184
297 HA3 GLY 40 3HA GLY 40 17.689 -15.949 6.520
298 H ALA 41 H ALA 41 18.400 -14.657 8.201
299 HA ALA 41 HA ALA 41 16.940 -12.350 9.068
300 HB1 ALA 41 1HB ALA 41 19.694 -13.400 9.624
301 HB2 ALA 41 2HB ALA 41 19.166 -11.827 10.222
302 HB3 ALA 41 3HB ALA 41 18.309 -13.289 10.711
303 H VAL 42 H VAL 42 20.071 -12.703 7.385
304 HA VAL 42 HA VAL 42 19.614 -10.046 6.192
305 HB VAL 42 HB VAL 42 21.570 -10.156 7.714
306 HG11 VAL 42 1HG1 VAL 42 22.110 -12.546 7.207
307 HG12 VAL 42 2HG1 VAL 42 22.785 -12.006 5.669
308 HG13 VAL 42 3HG1 VAL 42 23.499 -11.460 7.187
309 HG21 VAL 42 3HG2 VAL 42 21.561 -9.297 4.948
310 HG22 VAL 42 1HG2 VAL 42 22.180 -8.478 6.381
311 HG23 VAL 42 2HG2 VAL 42 23.193 -9.639 5.523
312 H LEU 43 H LEU 43 19.616 -9.856 4.028
313 HA LEU 43 HA LEU 43 19.347 -12.095 2.375
314 HB2 LEU 43 2HB LEU 43 19.732 -9.178 1.920
315 HB3 LEU 43 3HB LEU 43 19.903 -10.274 0.550
316 HG LEU 43 HG LEU 43 17.625 -11.012 0.790
317 HD11 LEU 43 1HD1 LEU 43 17.768 -9.493 3.354
318 HD12 LEU 43 2HD1 LEU 43 17.119 -11.100 3.032
319 HD13 LEU 43 3HD1 LEU 43 16.220 -9.670 2.527
320 HD21 LEU 43 3HD2 LEU 43 17.239 -9.251 -0.520
321 HD22 LEU 43 1HD2 LEU 43 18.346 -8.228 0.396
322 HD23 LEU 43 2HD2 LEU 43 16.676 -8.419 0.930
323 HA PRO 44 HA PRO 44 23.405 -13.318 1.240
324 HB2 PRO 44 2HB PRO 44 23.127 -13.875 -1.402
325 HB3 PRO 44 3HB PRO 44 22.444 -14.893 -0.129
326 HG2 PRO 44 2HG PRO 44 21.106 -12.808 -1.809
327 HG3 PRO 44 3HG PRO 44 20.519 -14.415 -1.342
328 HD2 PRO 44 2HD PRO 44 19.711 -12.150 -0.097
329 HD3 PRO 44 3HD PRO 44 19.858 -13.704 0.749
330 H HIS 45 H HIS 45 24.955 -13.029 -0.868
331 HA HIS 45 HA HIS 45 25.087 -10.129 -1.377
332 HB2 HIS 45 2HB HIS 45 27.610 -10.516 -1.492
333 HB3 HIS 45 3HB HIS 45 26.871 -10.576 0.106
334 HD1 HIS 45 HD1 HIS 45 28.964 -12.493 -2.171
335 HD2 HIS 45 HD2 HIS 45 26.488 -13.315 1.062
336 HE1 HIS 45 HE1 HIS 45 29.602 -14.802 -1.406
337 H GLY 46 H GLY 46 24.007 -10.361 -3.372
338 HA2 GLY 46 2HA GLY 46 25.212 -10.279 -5.686
339 HA3 GLY 46 3HA GLY 46 25.332 -12.010 -5.405
340 H THR 47 H THR 47 22.629 -11.757 -3.971
341 HA THR 47 HA THR 47 21.041 -12.551 -6.184
342 HB THR 47 HB THR 47 20.219 -11.842 -3.362
343 HG1 THR 47 HG1 THR 47 20.537 -14.394 -4.589
344 HG21 THR 47 3HG2 THR 47 18.277 -13.468 -4.150
345 HG22 THR 47 1HG2 THR 47 18.681 -12.789 -5.726
346 HG23 THR 47 2HG2 THR 47 18.186 -11.726 -4.408
347 H ALA 48 H ALA 48 19.856 -11.377 -7.542
348 HA ALA 48 HA ALA 48 19.849 -8.540 -7.432
349 HB1 ALA 48 1HB ALA 48 19.164 -10.562 -9.324
350 HB2 ALA 48 2HB ALA 48 17.841 -9.400 -9.218
351 HB3 ALA 48 3HB ALA 48 19.472 -8.846 -9.595
352 H VAL 49 H VAL 49 18.013 -7.136 -7.293
353 HA VAL 49 HA VAL 49 15.585 -8.221 -6.098
354 HB VAL 49 HB VAL 49 17.234 -6.096 -4.720
355 HG11 VAL 49 1HG1 VAL 49 14.418 -6.907 -4.503
356 HG12 VAL 49 2HG1 VAL 49 15.282 -6.776 -2.970
357 HG13 VAL 49 3HG1 VAL 49 15.202 -5.391 -4.060
358 HG21 VAL 49 3HG2 VAL 49 17.186 -7.820 -2.849
359 HG22 VAL 49 1HG2 VAL 49 16.664 -8.976 -4.075
360 HG23 VAL 49 2HG2 VAL 49 18.228 -8.174 -4.227
361 H GLU 50 H GLU 50 13.853 -7.238 -6.910
362 HA GLU 50 HA GLU 50 14.220 -4.848 -8.526
363 HB2 GLU 50 2HB GLU 50 12.935 -6.744 -9.433
364 HB3 GLU 50 3HB GLU 50 11.774 -6.578 -8.122
365 HG2 GLU 50 2HG GLU 50 11.144 -4.378 -8.925
366 HG3 GLU 50 3HG GLU 50 12.347 -4.486 -10.209
367 H LEU 51 H LEU 51 13.171 -2.902 -8.199
368 HA LEU 51 HA LEU 51 12.087 -2.520 -5.492
369 HB2 LEU 51 2HB LEU 51 13.641 -0.785 -7.350
370 HB3 LEU 51 3HB LEU 51 12.550 -0.029 -6.191
371 HG LEU 51 HG LEU 51 14.805 -0.044 -5.324
372 HD11 LEU 51 1HD1 LEU 51 13.914 -0.315 -3.315
373 HD12 LEU 51 2HD1 LEU 51 13.989 -2.067 -3.505
374 HD13 LEU 51 3HD1 LEU 51 12.556 -1.183 -4.032
375 HD21 LEU 51 3HD2 LEU 51 14.671 -3.030 -5.721
376 HD22 LEU 51 1HD2 LEU 51 15.932 -2.189 -4.819
377 HD23 LEU 51 2HD2 LEU 51 15.739 -1.895 -6.548
378 HA PRO 52 HA PRO 52 8.318 -2.071 -8.016
379 HB2 PRO 52 2HB PRO 52 6.638 -2.723 -5.986
380 HB3 PRO 52 3HB PRO 52 7.463 -3.933 -6.976
381 HG2 PRO 52 2HG PRO 52 8.177 -2.903 -4.257
382 HG3 PRO 52 3HG PRO 52 8.197 -4.569 -4.863
383 HD2 PRO 52 2HD PRO 52 10.441 -3.068 -4.655
384 HD3 PRO 52 3HD PRO 52 10.226 -4.294 -5.921
385 H ASP 53 H ASP 53 6.529 -0.604 -7.856
386 HA ASP 53 HA ASP 53 5.541 1.391 -7.388
387 HB2 ASP 53 2HB ASP 53 5.606 0.203 -5.027
388 HB3 ASP 53 3HB ASP 53 6.763 1.480 -4.663
389 H VAL 54 H VAL 54 8.045 1.417 -8.661
390 HA VAL 54 HA VAL 54 9.109 3.991 -7.701
391 HB VAL 54 HB VAL 54 10.682 1.670 -8.821
392 HG11 VAL 54 1HG1 VAL 54 12.601 3.385 -8.219
393 HG12 VAL 54 2HG1 VAL 54 11.820 3.391 -9.801
394 HG13 VAL 54 3HG1 VAL 54 11.334 4.559 -8.572
395 HG21 VAL 54 3HG2 VAL 54 10.212 1.423 -6.472
396 HG22 VAL 54 1HG2 VAL 54 11.907 1.868 -6.671
397 HG23 VAL 54 2HG2 VAL 54 10.733 3.077 -6.153
398 H GLN 55 H GLN 55 9.598 5.514 -9.243
399 HA GLN 55 HA GLN 55 9.510 6.613 -11.233
400 HB2 GLN 55 2HB GLN 55 11.019 4.601 -11.836
401 HB3 GLN 55 3HB GLN 55 9.600 3.970 -12.660
402 HG2 GLN 55 2HG GLN 55 10.656 5.050 -14.372
403 HG3 GLN 55 3HG GLN 55 9.571 6.315 -13.798
404 HE21 GLN 55 1HE2 GLN 55 10.617 8.158 -14.092
405 HE22 GLN 55 2HE2 GLN 55 12.224 8.501 -13.559
406 H THR 56 H THR 56 7.113 6.275 -10.050
407 HA THR 56 HA THR 56 5.086 4.973 -11.411
408 HB THR 56 HB THR 56 4.730 6.060 -9.245
409 HG1 THR 56 HG1 THR 56 2.783 5.801 -10.113
410 HG21 THR 56 3HG2 THR 56 6.077 8.127 -9.896
411 HG22 THR 56 1HG2 THR 56 4.613 8.397 -8.950
412 HG23 THR 56 2HG2 THR 56 4.608 8.698 -10.688
413 H ALA 57 H ALA 57 3.546 5.660 -12.957
414 HA ALA 57 HA ALA 57 3.936 8.110 -14.418
415 HB1 ALA 57 1HB ALA 57 5.139 7.391 -16.140
416 HB2 ALA 57 2HB ALA 57 5.412 5.891 -15.253
417 HB3 ALA 57 3HB ALA 57 4.065 6.014 -16.384
418 HA PRO 58 HA PRO 58 -0.315 7.586 -15.366
419 HB2 PRO 58 2HB PRO 58 -0.507 8.708 -17.831
420 HB3 PRO 58 3HB PRO 58 -0.251 9.656 -16.361
421 HG2 PRO 58 2HG PRO 58 1.742 8.756 -18.406
422 HG3 PRO 58 3HG PRO 58 1.593 10.331 -17.606
423 HD2 PRO 58 2HD PRO 58 3.406 8.472 -16.838
424 HD3 PRO 58 3HD PRO 58 2.652 9.601 -15.693
425 H VAL 59 H VAL 59 0.044 5.194 -15.484
426 HA VAL 59 HA VAL 59 -0.806 4.233 -18.099
427 HB VAL 59 HB VAL 59 1.669 3.992 -18.079
428 HG11 VAL 59 1HG1 VAL 59 2.830 2.923 -16.461
429 HG12 VAL 59 2HG1 VAL 59 1.442 3.379 -15.472
430 HG13 VAL 59 3HG1 VAL 59 1.543 1.757 -16.156
431 HG21 VAL 59 3HG2 VAL 59 1.577 2.035 -19.224
432 HG22 VAL 59 1HG2 VAL 59 0.682 1.205 -17.951
433 HG23 VAL 59 2HG2 VAL 59 -0.158 2.299 -19.050
434 H ALA 60 H ALA 60 -1.945 2.274 -18.035
435 HA ALA 60 HA ALA 60 -3.318 0.687 -17.153
436 HB1 ALA 60 1HB ALA 60 -2.559 -0.598 -15.355
437 HB2 ALA 60 2HB ALA 60 -1.083 0.027 -16.091
438 HB3 ALA 60 3HB ALA 60 -1.715 0.765 -14.619
439 H GLU 61 H GLU 61 -4.402 3.108 -17.063
440 HA GLU 61 HA GLU 61 -5.187 3.912 -14.426
441 HB2 GLU 61 2HB GLU 61 -5.945 4.737 -17.206
442 HB3 GLU 61 3HB GLU 61 -6.913 5.272 -15.840
443 HG2 GLU 61 2HG GLU 61 -5.367 6.992 -16.288
444 HG3 GLU 61 3HG GLU 61 -4.804 6.179 -14.828
445 H THR 62 H THR 62 -7.646 4.226 -14.040
446 HA THR 62 HA THR 62 -9.662 3.281 -13.566
447 HB THR 62 HB THR 62 -9.384 1.429 -15.911
448 HG1 THR 62 HG1 THR 62 -10.234 3.282 -17.149
449 HG21 THR 62 3HG2 THR 62 -11.854 2.876 -15.686
450 HG22 THR 62 1HG2 THR 62 -11.455 2.127 -14.141
451 HG23 THR 62 2HG2 THR 62 -11.571 1.138 -15.596
452 H VAL 63 H VAL 63 -7.135 2.095 -12.597
453 HA VAL 63 HA VAL 63 -8.146 -0.611 -12.007
454 HB VAL 63 HB VAL 63 -5.244 0.206 -12.201
455 HG11 VAL 63 1HG1 VAL 63 -4.975 -2.343 -12.123
456 HG12 VAL 63 2HG1 VAL 63 -5.342 -1.506 -10.614
457 HG13 VAL 63 3HG1 VAL 63 -6.617 -2.362 -11.481
458 HG21 VAL 63 3HG2 VAL 63 -5.695 0.040 -14.411
459 HG22 VAL 63 1HG2 VAL 63 -5.550 -1.687 -14.084
460 HG23 VAL 63 2HG2 VAL 63 -7.143 -0.934 -14.153
461 H ASN 64 H ASN 64 -8.966 -0.468 -10.009
462 HA ASN 64 HA ASN 64 -8.095 1.335 -8.023
463 HB2 ASN 64 2HB ASN 64 -9.817 -1.133 -7.967
464 HB3 ASN 64 3HB ASN 64 -9.417 -0.267 -6.486
465 HD21 ASN 64 1HD2 ASN 64 -11.900 -0.690 -8.255
466 HD22 ASN 64 2HD2 ASN 64 -12.574 0.897 -8.367
467 H LEU 65 H LEU 65 -7.429 0.489 -5.775
468 HA LEU 65 HA LEU 65 -5.693 -1.815 -5.776
469 HB2 LEU 65 2HB LEU 65 -3.767 -0.313 -4.928
470 HB3 LEU 65 3HB LEU 65 -4.047 -0.472 -6.661
471 HG LEU 65 HG LEU 65 -3.512 1.851 -5.763
472 HD11 LEU 65 1HD1 LEU 65 -5.024 0.985 -7.888
473 HD12 LEU 65 2HD1 LEU 65 -4.421 2.624 -7.645
474 HD13 LEU 65 3HD1 LEU 65 -6.055 2.202 -7.133
475 HD21 LEU 65 3HD2 LEU 65 -5.154 3.087 -4.655
476 HD22 LEU 65 1HD2 LEU 65 -5.165 1.529 -3.830
477 HD23 LEU 65 2HD2 LEU 65 -6.417 1.908 -5.013
478 H TRP 66 H TRP 66 -8.037 -0.718 -4.330
479 HA TRP 66 HA TRP 66 -7.050 -0.118 -1.675
480 HB2 TRP 66 2HB TRP 66 -9.900 -0.667 -2.518
481 HB3 TRP 66 3HB TRP 66 -9.358 0.153 -1.057
482 HD1 TRP 66 HD1 TRP 66 -10.922 1.021 -4.130
483 HE1 TRP 66 HE1 TRP 66 -10.402 3.433 -4.863
484 HE3 TRP 66 HE3 TRP 66 -6.888 1.932 -1.125
485 HZ2 TRP 66 HZ2 TRP 66 -8.530 5.454 -4.250
486 HZ3 TRP 66 HZ3 TRP 66 -5.789 4.130 -1.260
487 HH2 TRP 66 HH2 TRP 66 -6.594 5.853 -2.791
488 H GLU 67 H GLU 67 -7.350 -1.409 0.164
489 HA GLU 67 HA GLU 67 -7.841 -4.259 -0.409
490 HB2 GLU 67 2HB GLU 67 -5.502 -3.906 0.105
491 HB3 GLU 67 3HB GLU 67 -5.919 -3.012 1.560
492 HG2 GLU 67 2HG GLU 67 -5.167 -5.288 2.047
493 HG3 GLU 67 3HG GLU 67 -6.823 -5.003 2.577
494 H VAL 68 H VAL 68 -9.988 -4.310 0.171
495 HA VAL 68 HA VAL 68 -10.544 -3.807 3.021
496 HB VAL 68 HB VAL 68 -12.889 -3.259 2.365
497 HG11 VAL 68 1HG1 VAL 68 -12.149 -1.002 1.219
498 HG12 VAL 68 2HG1 VAL 68 -11.750 -1.348 2.903
499 HG13 VAL 68 3HG1 VAL 68 -10.539 -1.583 1.642
500 HG21 VAL 68 3HG2 VAL 68 -12.060 -2.617 -0.394
501 HG22 VAL 68 1HG2 VAL 68 -12.298 -4.326 -0.032
502 HG23 VAL 68 2HG2 VAL 68 -13.613 -3.179 0.224
503 H GLU 69 H GLU 69 -9.695 -6.273 1.848
504 HA GLU 69 HA GLU 69 -12.139 -7.890 2.166
505 HB2 GLU 69 2HB GLU 69 -10.768 -7.860 -0.087
506 HB3 GLU 69 3HB GLU 69 -9.717 -8.968 0.784
507 HG2 GLU 69 2HG GLU 69 -11.201 -10.333 -0.391
508 HG3 GLU 69 3HG GLU 69 -11.800 -10.331 1.267
509 H HIS 70 H HIS 70 -12.172 -8.736 4.139
510 HA HIS 70 HA HIS 70 -9.750 -9.248 5.616
511 HB2 HIS 70 2HB HIS 70 -11.835 -8.385 6.685
512 HB3 HIS 70 3HB HIS 70 -12.600 -9.938 6.358
513 HD1 HIS 70 HD1 HIS 70 -12.266 -11.738 8.057
514 HD2 HIS 70 HD2 HIS 70 -9.605 -8.585 8.548
515 HE1 HIS 70 HE1 HIS 70 -11.061 -12.204 10.215
516 H HIS 71 H HIS 71 -8.895 -11.215 6.186
517 HA HIS 71 HA HIS 71 -10.203 -13.670 5.366
518 HB2 HIS 71 2HB HIS 71 -8.839 -12.733 3.390
519 HB3 HIS 71 3HB HIS 71 -7.419 -13.165 4.338
520 HD1 HIS 71 HD1 HIS 71 -10.620 -14.985 3.339
521 HD2 HIS 71 HD2 HIS 71 -6.516 -15.584 3.580
522 HE1 HIS 71 HE1 HIS 71 -10.235 -17.336 2.531
Start of MODEL 13
1 H1 MET 1 H MET 1 4.212 -6.495 -5.195
2 HA MET 1 HA MET 1 5.679 -4.964 -7.243
3 HB2 MET 1 2HB MET 1 4.514 -4.099 -4.609
4 HB3 MET 1 3HB MET 1 5.825 -3.201 -5.361
5 HG2 MET 1 2HG MET 1 3.951 -2.074 -6.085
6 HG3 MET 1 3HG MET 1 4.305 -3.148 -7.436
7 HE1 MET 1 3HE MET 1 1.016 -2.795 -4.570
8 HE2 MET 1 1HE MET 1 1.733 -4.320 -4.047
9 HE3 MET 1 2HE MET 1 2.725 -2.865 -4.140
10 H LYS 2 H LYS 2 6.676 -7.379 -6.371
11 HA LYS 2 HA LYS 2 8.839 -6.606 -4.527
12 HB2 LYS 2 2HB LYS 2 9.105 -9.003 -4.054
13 HB3 LYS 2 3HB LYS 2 7.482 -8.443 -3.673
14 HG2 LYS 2 2HG LYS 2 7.073 -9.278 -6.182
15 HG3 LYS 2 3HG LYS 2 8.400 -10.350 -5.729
16 HD2 LYS 2 2HD LYS 2 6.912 -10.626 -3.542
17 HD3 LYS 2 3HD LYS 2 5.628 -10.197 -4.675
18 HE2 LYS 2 2HE LYS 2 6.326 -12.019 -6.151
19 HE3 LYS 2 3HE LYS 2 7.613 -12.443 -5.023
20 HZ1 LYS 2 3HZ LYS 2 6.099 -13.208 -3.462
21 HZ2 LYS 2 1HZ LYS 2 5.432 -13.746 -4.920
22 HZ3 LYS 2 2HZ LYS 2 4.794 -12.381 -4.150
23 H THR 3 H THR 3 10.970 -7.105 -5.048
24 HA THR 3 HA THR 3 11.469 -8.134 -7.754
25 HB THR 3 HB THR 3 11.584 -5.708 -7.938
26 HG1 THR 3 HG1 THR 3 13.422 -5.781 -9.055
27 HG21 THR 3 3HG2 THR 3 12.433 -5.694 -5.365
28 HG22 THR 3 1HG2 THR 3 12.608 -4.331 -6.469
29 HG23 THR 3 2HG2 THR 3 13.957 -5.438 -6.214
30 H PHE 4 H PHE 4 13.767 -8.746 -8.086
31 HA PHE 4 HA PHE 4 14.686 -10.297 -5.858
32 HB2 PHE 4 2HB PHE 4 16.144 -9.854 -8.463
33 HB3 PHE 4 3HB PHE 4 16.293 -11.220 -7.362
34 HD1 PHE 4 HD2 PHE 4 13.581 -12.014 -6.836
35 HD2 PHE 4 HD1 PHE 4 15.322 -10.627 -10.464
36 HE1 PHE 4 HE2 PHE 4 11.871 -13.233 -8.118
37 HE2 PHE 4 HE1 PHE 4 13.614 -11.843 -11.752
38 HZ PHE 4 HZ PHE 4 11.887 -13.150 -10.579
39 H ALA 5 H ALA 5 16.776 -10.182 -4.891
40 HA ALA 5 HA ALA 5 17.963 -7.484 -4.977
41 HB1 ALA 5 1HB ALA 5 17.205 -9.212 -2.697
42 HB2 ALA 5 2HB ALA 5 18.697 -8.285 -2.542
43 HB3 ALA 5 3HB ALA 5 17.172 -7.455 -2.852
44 H LEU 6 H LEU 6 19.831 -7.604 -6.043
45 HA LEU 6 HA LEU 6 21.479 -10.009 -5.812
46 HB2 LEU 6 2HB LEU 6 21.667 -7.631 -7.654
47 HB3 LEU 6 3HB LEU 6 22.779 -8.998 -7.667
48 HG LEU 6 HG LEU 6 20.531 -10.352 -8.041
49 HD11 LEU 6 1HD1 LEU 6 18.984 -9.121 -9.463
50 HD12 LEU 6 2HD1 LEU 6 19.917 -7.645 -9.219
51 HD13 LEU 6 3HD1 LEU 6 19.081 -8.394 -7.859
52 HD21 LEU 6 3HD2 LEU 6 21.867 -8.806 -10.258
53 HD22 LEU 6 1HD2 LEU 6 21.001 -10.336 -10.399
54 HD23 LEU 6 2HD2 LEU 6 22.524 -10.264 -9.512
55 H GLN 7 H GLN 7 23.980 -9.221 -6.152
56 HA GLN 7 HA GLN 7 24.868 -8.423 -3.665
57 HB2 GLN 7 2HB GLN 7 26.118 -9.407 -5.778
58 HB3 GLN 7 3HB GLN 7 26.510 -7.715 -6.056
59 HG2 GLN 7 2HG GLN 7 28.319 -8.576 -4.854
60 HG3 GLN 7 3HG GLN 7 27.371 -7.672 -3.674
61 HE21 GLN 7 1HE2 GLN 7 27.072 -8.652 -1.817
62 HE22 GLN 7 2HE2 GLN 7 27.064 -10.359 -1.550
63 H GLY 8 H GLY 8 24.834 -6.555 -2.609
64 HA2 GLY 8 2HA GLY 8 24.858 -4.295 -2.183
65 HA3 GLY 8 3HA GLY 8 25.467 -4.062 -3.815
66 H ASP 9 H ASP 9 22.533 -5.806 -3.539
67 HA ASP 9 HA ASP 9 21.005 -3.385 -4.237
68 HB2 ASP 9 2HB ASP 9 21.019 -6.095 -5.529
69 HB3 ASP 9 3HB ASP 9 19.581 -5.081 -5.610
70 H THR 10 H THR 10 21.384 -4.819 -1.666
71 HA THR 10 HA THR 10 19.002 -6.255 -1.067
72 HB THR 10 HB THR 10 19.728 -6.325 1.167
73 HG1 THR 10 HG1 THR 10 21.051 -4.781 2.080
74 HG21 THR 10 3HG2 THR 10 21.319 -7.278 -0.647
75 HG22 THR 10 1HG2 THR 10 21.896 -7.156 1.014
76 HG23 THR 10 2HG2 THR 10 22.380 -5.950 -0.178
77 H LEU 11 H LEU 11 17.808 -5.359 1.075
78 HA LEU 11 HA LEU 11 16.023 -3.434 0.259
79 HB2 LEU 11 2HB LEU 11 16.869 -4.087 3.077
80 HB3 LEU 11 3HB LEU 11 15.419 -3.185 2.640
81 HG LEU 11 HG LEU 11 15.691 -5.873 1.443
82 HD11 LEU 11 1HD1 LEU 11 14.643 -5.868 4.201
83 HD12 LEU 11 2HD1 LEU 11 16.396 -5.784 4.027
84 HD13 LEU 11 3HD1 LEU 11 15.502 -7.125 3.311
85 HD21 LEU 11 3HD2 LEU 11 13.574 -4.030 2.397
86 HD22 LEU 11 1HD2 LEU 11 13.235 -5.760 2.451
87 HD23 LEU 11 2HD2 LEU 11 13.661 -4.993 0.921
88 H ASP 12 H ASP 12 18.955 -2.988 2.201
89 HA ASP 12 HA ASP 12 18.706 -0.297 2.804
90 HB2 ASP 12 2HB ASP 12 20.478 -1.434 3.847
91 HB3 ASP 12 3HB ASP 12 21.104 -2.046 2.319
92 H ALA 13 H ALA 13 19.702 -1.835 -0.183
93 HA ALA 13 HA ALA 13 20.462 0.692 -1.396
94 HB1 ALA 13 1HB ALA 13 21.851 -1.001 -2.138
95 HB2 ALA 13 2HB ALA 13 20.533 -2.166 -2.272
96 HB3 ALA 13 3HB ALA 13 20.687 -0.868 -3.457
97 H ILE 14 H ILE 14 18.103 -1.880 -2.152
98 HA ILE 14 HA ILE 14 16.711 -0.626 -4.161
99 HB ILE 14 HB ILE 14 15.568 -2.402 -2.001
100 HG12 ILE 14 2HG1 ILE 14 16.354 -3.188 -4.802
101 HG13 ILE 14 3HG1 ILE 14 17.502 -3.242 -3.469
102 HG21 ILE 14 1HG2 ILE 14 14.414 -1.250 -4.487
103 HG22 ILE 14 2HG2 ILE 14 13.972 -2.898 -4.044
104 HG23 ILE 14 3HG2 ILE 14 13.653 -1.571 -2.929
105 HD11 ILE 14 3HD1 ILE 14 16.520 -5.421 -3.876
106 HD12 ILE 14 1HD1 ILE 14 16.058 -4.810 -2.288
107 HD13 ILE 14 2HD1 ILE 14 14.907 -4.755 -3.623
108 H CYS 15 H CYS 15 16.046 -0.435 -0.669
109 HA CYS 15 HA CYS 15 13.825 1.212 -0.741
110 HB2 CYS 15 2HB CYS 15 16.044 0.947 1.281
111 HB3 CYS 15 3HB CYS 15 14.671 2.015 1.543
112 HG CYS 15 HG CYS 15 14.529 -1.383 1.163
113 H VAL 16 H VAL 16 17.239 2.058 -0.939
114 HA VAL 16 HA VAL 16 16.748 4.892 -0.874
115 HB VAL 16 HB VAL 16 19.245 3.382 -1.660
116 HG11 VAL 16 1HG1 VAL 16 19.665 5.445 -2.546
117 HG12 VAL 16 2HG1 VAL 16 18.602 6.275 -1.407
118 HG13 VAL 16 3HG1 VAL 16 20.195 5.722 -0.887
119 HG21 VAL 16 3HG2 VAL 16 18.715 4.790 0.943
120 HG22 VAL 16 1HG2 VAL 16 18.350 3.082 0.701
121 HG23 VAL 16 2HG2 VAL 16 20.010 3.660 0.552
122 H ARG 17 H ARG 17 16.751 2.440 -3.269
123 HA ARG 17 HA ARG 17 17.242 4.245 -5.481
124 HB2 ARG 17 2HB ARG 17 16.401 1.341 -5.428
125 HB3 ARG 17 3HB ARG 17 16.796 2.247 -6.883
126 HG2 ARG 17 2HG ARG 17 19.013 2.661 -5.354
127 HG3 ARG 17 3HG ARG 17 18.550 1.021 -4.895
128 HD2 ARG 17 2HD ARG 17 18.844 0.197 -7.028
129 HD3 ARG 17 3HD ARG 17 18.606 1.774 -7.781
130 HE ARG 17 HE ARG 17 21.076 0.671 -6.808
131 HH11 ARG 17 1HH1 ARG 17 19.345 3.596 -7.562
132 HH12 ARG 17 2HH1 ARG 17 20.779 4.535 -7.812
133 HH21 ARG 17 1HH2 ARG 17 22.972 1.897 -7.134
134 HH22 ARG 17 2HH2 ARG 17 22.841 3.568 -7.568
135 H TYR 18 H TYR 18 14.542 2.923 -3.755
136 HA TYR 18 HA TYR 18 12.687 4.006 -5.765
137 HB2 TYR 18 2HB TYR 18 12.403 1.869 -3.670
138 HB3 TYR 18 3HB TYR 18 10.983 2.658 -4.349
139 HD1 TYR 18 HD1 TYR 18 13.919 0.564 -5.161
140 HD2 TYR 18 HD2 TYR 18 10.194 2.105 -6.522
141 HE1 TYR 18 HE1 TYR 18 13.984 -0.983 -7.072
142 HE2 TYR 18 HE2 TYR 18 10.248 0.562 -8.436
143 HH TYR 18 HH TYR 18 11.325 -1.652 -8.987
144 H TYR 19 H TYR 19 12.796 3.623 -2.217
145 HA TYR 19 HA TYR 19 11.046 5.837 -1.785
146 HB2 TYR 19 2HB TYR 19 12.843 4.507 0.247
147 HB3 TYR 19 3HB TYR 19 11.375 5.427 0.559
148 HD1 TYR 19 HD2 TYR 19 9.274 4.430 -0.879
149 HD2 TYR 19 HD1 TYR 19 12.647 2.231 0.494
150 HE1 TYR 19 HE2 TYR 19 7.952 2.358 -0.970
151 HE2 TYR 19 HE1 TYR 19 11.335 0.152 0.406
152 HH TYR 19 HH TYR 19 8.262 -0.085 0.436
153 H GLY 20 H GLY 20 14.526 5.372 -1.779
154 HA2 GLY 20 2HA GLY 20 16.116 7.053 -2.154
155 HA3 GLY 20 3HA GLY 20 14.884 8.262 -1.823
156 H ARG 21 H ARG 21 14.847 5.871 0.528
157 HA ARG 21 HA ARG 21 16.969 6.812 2.188
158 HB2 ARG 21 2HB ARG 21 15.167 7.564 3.977
159 HB3 ARG 21 3HB ARG 21 15.813 8.694 2.795
160 HG2 ARG 21 2HG ARG 21 13.366 8.844 3.062
161 HG3 ARG 21 3HG ARG 21 13.863 8.451 1.415
162 HD2 ARG 21 2HD ARG 21 13.092 6.287 1.555
163 HD3 ARG 21 3HD ARG 21 13.243 6.236 3.311
164 HE ARG 21 HE ARG 21 10.944 6.980 1.833
165 HH11 ARG 21 1HH1 ARG 21 12.730 7.761 4.718
166 HH12 ARG 21 2HH1 ARG 21 11.346 8.360 5.570
167 HH21 ARG 21 1HH2 ARG 21 9.114 7.767 2.945
168 HH22 ARG 21 2HH2 ARG 21 9.289 8.363 4.560
169 H THR 22 H THR 22 16.548 5.987 4.550
170 HA THR 22 HA THR 22 15.149 3.400 4.427
171 HB THR 22 HB THR 22 17.109 2.687 6.060
172 HG1 THR 22 HG1 THR 22 19.093 3.641 5.225
173 HG21 THR 22 3HG2 THR 22 18.009 1.453 4.317
174 HG22 THR 22 1HG2 THR 22 17.819 2.764 3.153
175 HG23 THR 22 2HG2 THR 22 16.409 1.851 3.692
176 H GLU 23 H GLU 23 15.229 6.312 5.855
177 HA GLU 23 HA GLU 23 14.932 5.508 8.612
178 HB2 GLU 23 2HB GLU 23 15.918 7.704 7.907
179 HB3 GLU 23 3HB GLU 23 14.319 8.189 7.364
180 HG2 GLU 23 2HG GLU 23 13.509 8.418 9.485
181 HG3 GLU 23 3HG GLU 23 14.631 7.237 10.160
182 H GLY 24 H GLY 24 13.143 4.500 9.250
183 HA2 GLY 24 2HA GLY 24 10.877 4.387 9.806
184 HA3 GLY 24 3HA GLY 24 10.561 5.704 8.686
185 H VAL 25 H VAL 25 12.348 3.814 6.843
186 HA VAL 25 HA VAL 25 10.010 2.470 5.706
187 HB VAL 25 HB VAL 25 12.748 2.762 4.470
188 HG11 VAL 25 1HG1 VAL 25 10.464 1.274 3.741
189 HG12 VAL 25 2HG1 VAL 25 10.589 2.622 2.609
190 HG13 VAL 25 3HG1 VAL 25 11.947 1.515 2.818
191 HG21 VAL 25 3HG2 VAL 25 10.321 4.527 4.163
192 HG22 VAL 25 1HG2 VAL 25 11.855 4.971 4.910
193 HG23 VAL 25 2HG2 VAL 25 11.782 4.628 3.181
194 H VAL 26 H VAL 26 13.402 1.763 6.525
195 HA VAL 26 HA VAL 26 13.409 -0.955 5.968
196 HB VAL 26 HB VAL 26 15.286 -1.161 7.502
197 HG11 VAL 26 1HG1 VAL 26 16.685 0.755 6.620
198 HG12 VAL 26 2HG1 VAL 26 15.867 -0.232 5.407
199 HG13 VAL 26 3HG1 VAL 26 15.217 1.349 5.845
200 HG21 VAL 26 3HG2 VAL 26 14.104 1.288 8.657
201 HG22 VAL 26 1HG2 VAL 26 14.960 -0.041 9.440
202 HG23 VAL 26 2HG2 VAL 26 15.865 1.219 8.601
203 H GLU 27 H GLU 27 12.134 0.765 8.733
204 HA GLU 27 HA GLU 27 11.815 -1.506 10.417
205 HB2 GLU 27 2HB GLU 27 10.546 1.232 10.428
206 HB3 GLU 27 3HB GLU 27 10.204 0.015 11.650
207 HG2 GLU 27 2HG GLU 27 12.540 -0.020 12.304
208 HG3 GLU 27 3HG GLU 27 12.924 1.152 11.044
209 H THR 28 H THR 28 9.976 -0.142 7.821
210 HA THR 28 HA THR 28 7.519 -1.489 8.483
211 HB THR 28 HB THR 28 8.243 -0.296 5.808
212 HG1 THR 28 HG1 THR 28 6.991 1.044 7.986
213 HG21 THR 28 3HG2 THR 28 6.223 -1.228 5.391
214 HG22 THR 28 1HG2 THR 28 5.623 0.215 6.208
215 HG23 THR 28 2HG2 THR 28 5.785 -1.299 7.097
216 H VAL 29 H VAL 29 9.701 -1.763 5.668
217 HA VAL 29 HA VAL 29 8.680 -4.094 4.605
218 HB VAL 29 HB VAL 29 11.604 -3.340 4.616
219 HG11 VAL 29 1HG1 VAL 29 9.940 -5.245 3.043
220 HG12 VAL 29 2HG1 VAL 29 11.290 -4.434 2.248
221 HG13 VAL 29 3HG1 VAL 29 11.576 -5.431 3.675
222 HG21 VAL 29 3HG2 VAL 29 11.036 -1.513 3.484
223 HG22 VAL 29 1HG2 VAL 29 10.397 -2.553 2.211
224 HG23 VAL 29 2HG2 VAL 29 9.335 -1.979 3.497
225 H LEU 30 H LEU 30 11.080 -3.706 7.167
226 HA LEU 30 HA LEU 30 11.900 -6.355 7.418
227 HB2 LEU 30 2HB LEU 30 11.774 -4.017 9.253
228 HB3 LEU 30 3HB LEU 30 12.110 -5.604 9.942
229 HG LEU 30 HG LEU 30 13.744 -4.242 7.800
230 HD11 LEU 30 1HD1 LEU 30 14.346 -3.034 9.633
231 HD12 LEU 30 2HD1 LEU 30 15.418 -4.418 9.842
232 HD13 LEU 30 3HD1 LEU 30 13.917 -4.319 10.762
233 HD21 LEU 30 3HD2 LEU 30 15.372 -6.081 8.432
234 HD22 LEU 30 1HD2 LEU 30 13.962 -6.569 7.491
235 HD23 LEU 30 2HD2 LEU 30 14.013 -6.875 9.228
236 H ALA 31 H ALA 31 9.139 -4.682 8.867
237 HA ALA 31 HA ALA 31 8.282 -6.931 10.406
238 HB1 ALA 31 1HB ALA 31 7.657 -4.232 10.328
239 HB2 ALA 31 2HB ALA 31 6.179 -5.035 9.798
240 HB3 ALA 31 3HB ALA 31 6.904 -5.458 11.349
241 H ALA 32 H ALA 32 7.824 -5.891 7.142
242 HA ALA 32 HA ALA 32 5.479 -7.515 6.686
243 HB1 ALA 32 1HB ALA 32 7.086 -5.600 5.121
244 HB2 ALA 32 2HB ALA 32 6.289 -6.879 4.204
245 HB3 ALA 32 3HB ALA 32 5.337 -5.801 5.224
246 H ASN 33 H ASN 33 8.929 -7.824 6.373
247 HA ASN 33 HA ASN 33 8.547 -10.525 5.258
248 HB2 ASN 33 2HB ASN 33 10.828 -8.603 4.743
249 HB3 ASN 33 3HB ASN 33 10.779 -10.274 4.188
250 HD21 ASN 33 1HD2 ASN 33 9.669 -7.064 3.687
251 HD22 ASN 33 2HD2 ASN 33 8.805 -7.357 2.220
252 HA PRO 34 HA PRO 34 10.570 -10.818 9.429
253 HB2 PRO 34 2HB PRO 34 9.018 -12.869 10.295
254 HB3 PRO 34 3HB PRO 34 8.551 -11.173 10.465
255 HG2 PRO 34 2HG PRO 34 7.699 -13.175 8.409
256 HG3 PRO 34 3HG PRO 34 6.720 -11.981 9.281
257 HD2 PRO 34 2HD PRO 34 7.574 -11.591 6.741
258 HD3 PRO 34 3HD PRO 34 7.361 -10.256 7.893
259 H GLY 35 H GLY 35 12.381 -11.982 9.570
260 HA2 GLY 35 2HA GLY 35 13.375 -14.208 9.718
261 HA3 GLY 35 3HA GLY 35 12.428 -14.650 8.305
262 H LEU 36 H LEU 36 13.129 -11.857 7.228
263 HA LEU 36 HA LEU 36 15.409 -12.724 5.722
264 HB2 LEU 36 2HB LEU 36 13.397 -11.210 5.028
265 HB3 LEU 36 3HB LEU 36 14.393 -9.915 5.688
266 HG LEU 36 HG LEU 36 14.610 -10.094 3.257
267 HD11 LEU 36 1HD1 LEU 36 16.807 -9.587 3.283
268 HD12 LEU 36 2HD1 LEU 36 17.250 -11.055 4.155
269 HD13 LEU 36 3HD1 LEU 36 16.583 -9.677 5.030
270 HD21 LEU 36 3HD2 LEU 36 14.647 -12.080 2.271
271 HD22 LEU 36 1HD2 LEU 36 14.750 -12.884 3.838
272 HD23 LEU 36 2HD2 LEU 36 16.223 -12.397 2.999
273 H ALA 37 H ALA 37 14.806 -10.297 8.222
274 HA ALA 37 HA ALA 37 17.308 -9.051 8.203
275 HB1 ALA 37 1HB ALA 37 16.283 -9.201 10.877
276 HB2 ALA 37 2HB ALA 37 16.356 -7.818 9.783
277 HB3 ALA 37 3HB ALA 37 14.967 -8.904 9.741
278 H GLU 38 H GLU 38 16.320 -12.135 9.426
279 HA GLU 38 HA GLU 38 18.414 -12.541 11.288
280 HB2 GLU 38 2HB GLU 38 16.963 -14.680 9.728
281 HB3 GLU 38 3HB GLU 38 17.762 -14.850 11.284
282 HG2 GLU 38 2HG GLU 38 15.225 -13.365 10.672
283 HG3 GLU 38 3HG GLU 38 15.430 -14.792 11.686
284 H LEU 39 H LEU 39 18.232 -12.750 7.841
285 HA LEU 39 HA LEU 39 20.254 -14.524 7.217
286 HB2 LEU 39 2HB LEU 39 18.674 -13.136 5.705
287 HB3 LEU 39 3HB LEU 39 19.965 -11.936 5.739
288 HG LEU 39 HG LEU 39 20.035 -13.331 3.722
289 HD11 LEU 39 1HD1 LEU 39 22.439 -14.258 5.140
290 HD12 LEU 39 2HD1 LEU 39 22.118 -12.527 5.238
291 HD13 LEU 39 3HD1 LEU 39 22.283 -13.305 3.664
292 HD21 LEU 39 3HD2 LEU 39 19.135 -15.373 5.001
293 HD22 LEU 39 1HD2 LEU 39 20.818 -15.656 5.444
294 HD23 LEU 39 2HD2 LEU 39 20.346 -15.640 3.745
295 H GLY 40 H GLY 40 20.573 -11.008 7.742
296 HA2 GLY 40 2HA GLY 40 22.695 -10.799 9.323
297 HA3 GLY 40 3HA GLY 40 23.476 -11.278 7.823
298 H ALA 41 H ALA 41 24.287 -9.631 6.732
299 HA ALA 41 HA ALA 41 23.020 -6.991 7.016
300 HB1 ALA 41 1HB ALA 41 25.442 -6.524 5.825
301 HB2 ALA 41 2HB ALA 41 25.109 -6.404 7.553
302 HB3 ALA 41 3HB ALA 41 25.794 -7.886 6.889
303 H VAL 42 H VAL 42 24.192 -9.352 4.691
304 HA VAL 42 HA VAL 42 22.823 -7.838 2.566
305 HB VAL 42 HB VAL 42 25.383 -7.839 2.445
306 HG11 VAL 42 1HG1 VAL 42 25.522 -10.292 3.033
307 HG12 VAL 42 2HG1 VAL 42 24.972 -10.627 1.390
308 HG13 VAL 42 3HG1 VAL 42 26.493 -9.773 1.655
309 HG21 VAL 42 3HG2 VAL 42 24.070 -7.149 0.568
310 HG22 VAL 42 1HG2 VAL 42 25.336 -8.224 -0.024
311 HG23 VAL 42 2HG2 VAL 42 23.686 -8.820 0.154
312 H LEU 43 H LEU 43 21.855 -9.084 0.903
313 HA LEU 43 HA LEU 43 21.296 -11.863 1.701
314 HB2 LEU 43 2HB LEU 43 19.329 -11.202 -0.080
315 HB3 LEU 43 3HB LEU 43 19.181 -11.167 1.676
316 HG LEU 43 HG LEU 43 20.130 -8.736 0.212
317 HD11 LEU 43 1HD1 LEU 43 17.966 -9.717 -0.792
318 HD12 LEU 43 2HD1 LEU 43 17.990 -8.018 -0.321
319 HD13 LEU 43 3HD1 LEU 43 17.219 -9.212 0.723
320 HD21 LEU 43 3HD2 LEU 43 18.839 -9.369 2.838
321 HD22 LEU 43 1HD2 LEU 43 18.726 -7.749 2.149
322 HD23 LEU 43 2HD2 LEU 43 20.306 -8.447 2.505
323 HA PRO 44 HA PRO 44 22.964 -13.408 -2.052
324 HB2 PRO 44 2HB PRO 44 21.280 -15.466 -2.601
325 HB3 PRO 44 3HB PRO 44 22.458 -15.514 -1.284
326 HG2 PRO 44 2HG PRO 44 19.526 -14.915 -1.183
327 HG3 PRO 44 3HG PRO 44 20.502 -15.918 -0.094
328 HD2 PRO 44 2HD PRO 44 19.774 -13.384 0.521
329 HD3 PRO 44 3HD PRO 44 21.305 -14.097 1.069
330 H HIS 45 H HIS 45 22.526 -13.799 -4.341
331 HA HIS 45 HA HIS 45 20.761 -11.821 -5.421
332 HB2 HIS 45 2HB HIS 45 21.627 -12.514 -7.591
333 HB3 HIS 45 3HB HIS 45 22.950 -12.332 -6.443
334 HD1 HIS 45 HD1 HIS 45 24.268 -14.436 -5.812
335 HD2 HIS 45 HD2 HIS 45 21.117 -15.160 -8.421
336 HE1 HIS 45 HE1 HIS 45 24.609 -16.785 -6.642
337 H GLY 46 H GLY 46 18.749 -12.049 -6.183
338 HA2 GLY 46 2HA GLY 46 17.131 -13.360 -7.443
339 HA3 GLY 46 3HA GLY 46 17.739 -14.788 -6.620
340 H THR 47 H THR 47 17.833 -13.100 -4.080
341 HA THR 47 HA THR 47 15.458 -13.997 -2.934
342 HB THR 47 HB THR 47 17.218 -11.712 -2.024
343 HG1 THR 47 HG1 THR 47 18.360 -13.243 -0.979
344 HG21 THR 47 3HG2 THR 47 15.743 -11.370 -0.392
345 HG22 THR 47 1HG2 THR 47 15.977 -13.033 0.145
346 HG23 THR 47 2HG2 THR 47 14.710 -12.653 -1.022
347 H ALA 48 H ALA 48 13.463 -13.398 -3.455
348 HA ALA 48 HA ALA 48 12.925 -10.760 -4.528
349 HB1 ALA 48 1HB ALA 48 10.496 -11.821 -4.429
350 HB2 ALA 48 2HB ALA 48 11.650 -12.238 -5.697
351 HB3 ALA 48 3HB ALA 48 11.430 -13.313 -4.317
352 H VAL 49 H VAL 49 12.536 -9.090 -3.244
353 HA VAL 49 HA VAL 49 11.315 -9.581 -0.608
354 HB VAL 49 HB VAL 49 12.872 -7.134 -1.442
355 HG11 VAL 49 1HG1 VAL 49 11.899 -6.344 0.414
356 HG12 VAL 49 2HG1 VAL 49 11.409 -7.951 0.955
357 HG13 VAL 49 3HG1 VAL 49 13.045 -7.373 1.274
358 HG21 VAL 49 3HG2 VAL 49 14.688 -8.126 -0.003
359 HG22 VAL 49 1HG2 VAL 49 13.793 -9.645 -0.061
360 HG23 VAL 49 2HG2 VAL 49 14.419 -8.933 -1.548
361 H GLU 50 H GLU 50 9.586 -8.338 0.081
362 HA GLU 50 HA GLU 50 7.983 -7.193 -2.044
363 HB2 GLU 50 2HB GLU 50 6.816 -8.615 -0.521
364 HB3 GLU 50 3HB GLU 50 7.445 -7.746 0.872
365 HG2 GLU 50 2HG GLU 50 6.103 -5.840 0.383
366 HG3 GLU 50 3HG GLU 50 5.613 -6.516 -1.169
367 H LEU 51 H LEU 51 7.198 -5.079 -2.102
368 HA LEU 51 HA LEU 51 8.654 -3.164 -0.400
369 HB2 LEU 51 2HB LEU 51 7.855 -2.957 -3.294
370 HB3 LEU 51 3HB LEU 51 8.396 -1.578 -2.339
371 HG LEU 51 HG LEU 51 10.071 -4.036 -2.829
372 HD11 LEU 51 1HD1 LEU 51 10.487 -3.299 -4.875
373 HD12 LEU 51 2HD1 LEU 51 11.091 -1.789 -4.195
374 HD13 LEU 51 3HD1 LEU 51 9.390 -1.939 -4.635
375 HD21 LEU 51 3HD2 LEU 51 10.976 -1.294 -2.005
376 HD22 LEU 51 1HD2 LEU 51 11.852 -2.822 -1.911
377 HD23 LEU 51 2HD2 LEU 51 10.497 -2.515 -0.824
378 HA PRO 52 HA PRO 52 4.268 -2.482 0.637
379 HB2 PRO 52 2HB PRO 52 4.798 -1.487 3.107
380 HB3 PRO 52 3HB PRO 52 4.711 -3.220 2.768
381 HG2 PRO 52 2HG PRO 52 7.118 -1.457 3.018
382 HG3 PRO 52 3HG PRO 52 6.854 -3.088 3.660
383 HD2 PRO 52 2HD PRO 52 8.290 -2.622 1.412
384 HD3 PRO 52 3HD PRO 52 7.327 -4.096 1.642
385 H ASP 53 H ASP 53 3.063 -0.567 0.907
386 HA ASP 53 HA ASP 53 2.556 1.632 0.619
387 HB2 ASP 53 2HB ASP 53 4.267 1.735 2.581
388 HB3 ASP 53 3HB ASP 53 5.363 2.389 1.367
389 H VAL 54 H VAL 54 3.488 0.136 -1.604
390 HA VAL 54 HA VAL 54 4.696 2.294 -3.208
391 HB VAL 54 HB VAL 54 5.180 -0.670 -3.539
392 HG11 VAL 54 1HG1 VAL 54 5.126 0.392 -5.693
393 HG12 VAL 54 2HG1 VAL 54 6.169 1.697 -5.124
394 HG13 VAL 54 3HG1 VAL 54 6.805 0.058 -5.272
395 HG21 VAL 54 3HG2 VAL 54 7.580 0.089 -3.086
396 HG22 VAL 54 1HG2 VAL 54 6.859 1.567 -2.448
397 HG23 VAL 54 2HG2 VAL 54 6.480 0.011 -1.710
398 H GLN 55 H GLN 55 3.878 2.616 -5.259
399 HA GLN 55 HA GLN 55 1.519 1.009 -5.985
400 HB2 GLN 55 2HB GLN 55 0.458 3.038 -6.851
401 HB3 GLN 55 3HB GLN 55 0.811 3.191 -5.135
402 HG2 GLN 55 2HG GLN 55 2.981 4.350 -5.935
403 HG3 GLN 55 3HG GLN 55 2.115 4.538 -7.458
404 HE21 GLN 55 1HE2 GLN 55 1.043 6.357 -7.671
405 HE22 GLN 55 2HE2 GLN 55 0.412 7.329 -6.390
406 H THR 56 H THR 56 1.477 0.232 -8.003
407 HA THR 56 HA THR 56 3.694 0.170 -9.644
408 HB THR 56 HB THR 56 2.163 -0.573 -11.462
409 HG1 THR 56 HG1 THR 56 0.041 -0.350 -9.606
410 HG21 THR 56 3HG2 THR 56 2.129 -1.733 -8.722
411 HG22 THR 56 1HG2 THR 56 2.782 -2.395 -10.220
412 HG23 THR 56 2HG2 THR 56 1.043 -2.422 -9.929
413 H ALA 57 H ALA 57 3.876 0.999 -11.901
414 HA ALA 57 HA ALA 57 2.986 3.806 -12.028
415 HB1 ALA 57 1HB ALA 57 5.567 2.842 -12.024
416 HB2 ALA 57 2HB ALA 57 5.245 3.143 -13.732
417 HB3 ALA 57 3HB ALA 57 5.056 4.444 -12.557
418 HA PRO 58 HA PRO 58 0.932 3.103 -15.841
419 HB2 PRO 58 2HB PRO 58 1.518 5.352 -17.244
420 HB3 PRO 58 3HB PRO 58 0.413 5.341 -15.865
421 HG2 PRO 58 2HG PRO 58 3.295 6.142 -15.976
422 HG3 PRO 58 3HG PRO 58 1.944 6.935 -15.144
423 HD2 PRO 58 2HD PRO 58 3.722 5.352 -13.854
424 HD3 PRO 58 3HD PRO 58 2.021 5.476 -13.361
425 H VAL 59 H VAL 59 2.419 1.303 -16.367
426 HA VAL 59 HA VAL 59 4.311 2.000 -18.515
427 HB VAL 59 HB VAL 59 5.333 0.850 -16.585
428 HG11 VAL 59 1HG1 VAL 59 3.033 -0.611 -16.491
429 HG12 VAL 59 2HG1 VAL 59 4.159 -1.758 -17.220
430 HG13 VAL 59 3HG1 VAL 59 4.530 -1.028 -15.657
431 HG21 VAL 59 3HG2 VAL 59 6.641 -0.649 -17.843
432 HG22 VAL 59 1HG2 VAL 59 5.310 -1.014 -18.942
433 HG23 VAL 59 2HG2 VAL 59 6.092 0.565 -18.998
434 H ALA 60 H ALA 60 4.270 0.856 -20.451
435 HA ALA 60 HA ALA 60 1.687 -0.207 -21.175
436 HB1 ALA 60 1HB ALA 60 4.151 -0.036 -22.898
437 HB2 ALA 60 2HB ALA 60 2.473 -0.173 -23.425
438 HB3 ALA 60 3HB ALA 60 3.035 1.306 -22.646
439 H GLU 61 H GLU 61 1.631 -2.120 -19.897
440 HA GLU 61 HA GLU 61 2.904 -4.375 -21.215
441 HB2 GLU 61 2HB GLU 61 3.528 -3.496 -18.439
442 HB3 GLU 61 3HB GLU 61 3.379 -5.223 -18.735
443 HG2 GLU 61 2HG GLU 61 5.063 -4.988 -20.553
444 HG3 GLU 61 3HG GLU 61 5.285 -3.310 -20.059
445 H THR 62 H THR 62 2.086 -6.482 -20.239
446 HA THR 62 HA THR 62 -0.780 -6.164 -19.667
447 HB THR 62 HB THR 62 -0.421 -7.441 -21.663
448 HG1 THR 62 HG1 THR 62 -2.056 -8.272 -20.321
449 HG21 THR 62 3HG2 THR 62 0.891 -9.545 -21.635
450 HG22 THR 62 1HG2 THR 62 1.419 -9.162 -19.997
451 HG23 THR 62 2HG2 THR 62 1.881 -8.116 -21.339
452 H VAL 63 H VAL 63 -1.718 -7.072 -17.898
453 HA VAL 63 HA VAL 63 -0.564 -9.095 -16.304
454 HB VAL 63 HB VAL 63 1.022 -7.353 -15.659
455 HG11 VAL 63 1HG1 VAL 63 0.418 -5.229 -15.434
456 HG12 VAL 63 2HG1 VAL 63 -1.255 -5.684 -15.765
457 HG13 VAL 63 3HG1 VAL 63 -0.661 -5.653 -14.105
458 HG21 VAL 63 3HG2 VAL 63 -0.162 -9.053 -14.009
459 HG22 VAL 63 1HG2 VAL 63 1.007 -7.863 -13.435
460 HG23 VAL 63 2HG2 VAL 63 -0.722 -7.557 -13.261
461 H ASN 64 H ASN 64 -1.975 -9.842 -14.743
462 HA ASN 64 HA ASN 64 -4.687 -8.882 -14.968
463 HB2 ASN 64 2HB ASN 64 -3.370 -11.232 -13.647
464 HB3 ASN 64 3HB ASN 64 -5.025 -10.802 -13.224
465 HD21 ASN 64 1HD2 ASN 64 -3.639 -13.045 -14.780
466 HD22 ASN 64 2HD2 ASN 64 -4.592 -13.184 -16.214
467 H LEU 65 H LEU 65 -5.594 -7.428 -13.681
468 HA LEU 65 HA LEU 65 -5.104 -7.347 -10.864
469 HB2 LEU 65 2HB LEU 65 -3.167 -6.087 -12.018
470 HB3 LEU 65 3HB LEU 65 -4.371 -4.837 -12.327
471 HG LEU 65 HG LEU 65 -3.986 -5.802 -9.532
472 HD11 LEU 65 1HD1 LEU 65 -2.185 -3.804 -10.892
473 HD12 LEU 65 2HD1 LEU 65 -1.714 -5.421 -10.371
474 HD13 LEU 65 3HD1 LEU 65 -2.188 -4.213 -9.177
475 HD21 LEU 65 3HD2 LEU 65 -4.662 -3.571 -8.984
476 HD22 LEU 65 1HD2 LEU 65 -5.783 -4.208 -10.187
477 HD23 LEU 65 2HD2 LEU 65 -4.530 -3.064 -10.669
478 H TRP 66 H TRP 66 -7.038 -6.966 -10.034
479 HA TRP 66 HA TRP 66 -9.026 -5.526 -11.612
480 HB2 TRP 66 2HB TRP 66 -9.413 -6.952 -8.974
481 HB3 TRP 66 3HB TRP 66 -10.666 -6.431 -10.098
482 HD1 TRP 66 HD1 TRP 66 -10.171 -7.659 -12.728
483 HE1 TRP 66 HE1 TRP 66 -9.855 -10.182 -13.127
484 HE3 TRP 66 HE3 TRP 66 -8.803 -9.061 -8.006
485 HZ2 TRP 66 HZ2 TRP 66 -9.124 -12.465 -11.637
486 HZ3 TRP 66 HZ3 TRP 66 -8.313 -11.434 -7.576
487 HH2 TRP 66 HH2 TRP 66 -8.471 -13.099 -9.355
488 H GLU 67 H GLU 67 -10.259 -3.793 -10.754
489 HA GLU 67 HA GLU 67 -9.623 -2.595 -8.242
490 HB2 GLU 67 2HB GLU 67 -8.706 -0.479 -9.179
491 HB3 GLU 67 3HB GLU 67 -7.635 -1.859 -9.382
492 HG2 GLU 67 2HG GLU 67 -8.556 -2.088 -11.712
493 HG3 GLU 67 3HG GLU 67 -9.345 -0.531 -11.464
494 H VAL 68 H VAL 68 -11.545 -1.900 -7.609
495 HA VAL 68 HA VAL 68 -13.228 -0.445 -9.536
496 HB VAL 68 HB VAL 68 -15.225 -1.450 -8.337
497 HG11 VAL 68 1HG1 VAL 68 -15.413 -3.075 -9.930
498 HG12 VAL 68 2HG1 VAL 68 -14.054 -2.167 -10.597
499 HG13 VAL 68 3HG1 VAL 68 -13.764 -3.654 -9.693
500 HG21 VAL 68 3HG2 VAL 68 -13.401 -2.418 -6.586
501 HG22 VAL 68 1HG2 VAL 68 -15.018 -3.086 -6.804
502 HG23 VAL 68 2HG2 VAL 68 -13.642 -3.824 -7.623
503 H GLU 69 H GLU 69 -12.007 1.311 -8.342
504 HA GLU 69 HA GLU 69 -13.758 2.485 -6.421
505 HB2 GLU 69 2HB GLU 69 -12.037 2.710 -4.617
506 HB3 GLU 69 3HB GLU 69 -12.637 1.073 -4.844
507 HG2 GLU 69 2HG GLU 69 -10.645 0.451 -6.034
508 HG3 GLU 69 3HG GLU 69 -10.057 2.112 -5.989
509 H HIS 70 H HIS 70 -13.521 4.674 -6.343
510 HA HIS 70 HA HIS 70 -11.449 5.803 -8.085
511 HB2 HIS 70 2HB HIS 70 -14.120 6.848 -7.149
512 HB3 HIS 70 3HB HIS 70 -12.938 7.873 -7.957
513 HD1 HIS 70 HD1 HIS 70 -14.232 8.251 -10.095
514 HD2 HIS 70 HD2 HIS 70 -13.747 4.227 -9.183
515 HE1 HIS 70 HE1 HIS 70 -15.006 7.001 -12.135
516 H HIS 71 H HIS 71 -10.564 7.947 -7.446
517 HA HIS 71 HA HIS 71 -9.196 7.839 -5.051
518 HB2 HIS 71 2HB HIS 71 -9.914 10.210 -6.776
519 HB3 HIS 71 3HB HIS 71 -8.827 10.323 -5.394
520 HD1 HIS 71 HD1 HIS 71 -6.521 10.461 -6.256
521 HD2 HIS 71 HD2 HIS 71 -8.811 7.755 -8.421
522 HE1 HIS 71 HE1 HIS 71 -4.952 9.451 -7.941
Start of MODEL 14
1 H1 MET 1 H MET 1 8.715 -3.319 -8.781
2 HA MET 1 HA MET 1 10.943 -1.896 -10.084
3 HB2 MET 1 2HB MET 1 8.978 -0.525 -9.077
4 HB3 MET 1 3HB MET 1 9.691 -0.947 -7.526
5 HG2 MET 1 2HG MET 1 10.735 1.029 -7.879
6 HG3 MET 1 3HG MET 1 11.879 -0.039 -8.687
7 HE1 MET 1 3HE MET 1 12.984 1.390 -10.703
8 HE2 MET 1 1HE MET 1 12.329 -0.216 -11.026
9 HE3 MET 1 2HE MET 1 12.042 1.098 -12.166
10 H LYS 2 H LYS 2 11.878 -4.133 -9.575
11 HA LYS 2 HA LYS 2 12.956 -4.133 -6.832
12 HB2 LYS 2 2HB LYS 2 13.109 -6.511 -6.910
13 HB3 LYS 2 3HB LYS 2 11.492 -6.085 -7.456
14 HG2 LYS 2 2HG LYS 2 12.499 -6.227 -9.826
15 HG3 LYS 2 3HG LYS 2 13.807 -7.116 -9.043
16 HD2 LYS 2 2HD LYS 2 12.231 -8.750 -8.195
17 HD3 LYS 2 3HD LYS 2 10.881 -7.833 -8.865
18 HE2 LYS 2 2HE LYS 2 11.245 -9.542 -10.419
19 HE3 LYS 2 3HE LYS 2 12.038 -8.135 -11.127
20 HZ1 LYS 2 3HZ LYS 2 14.153 -8.955 -10.284
21 HZ2 LYS 2 1HZ LYS 2 13.426 -10.097 -11.298
22 HZ3 LYS 2 2HZ LYS 2 13.388 -10.310 -9.621
23 H THR 3 H THR 3 15.158 -4.674 -6.548
24 HA THR 3 HA THR 3 16.823 -4.764 -8.954
25 HB THR 3 HB THR 3 16.687 -2.383 -8.285
26 HG1 THR 3 HG1 THR 3 18.725 -2.215 -8.850
27 HG21 THR 3 3HG2 THR 3 17.031 -1.636 -6.189
28 HG22 THR 3 1HG2 THR 3 18.365 -2.752 -5.904
29 HG23 THR 3 2HG2 THR 3 16.700 -3.303 -5.718
30 H PHE 4 H PHE 4 19.053 -5.410 -8.507
31 HA PHE 4 HA PHE 4 19.135 -7.521 -6.568
32 HB2 PHE 4 2HB PHE 4 21.454 -6.491 -8.202
33 HB3 PHE 4 3HB PHE 4 21.246 -8.100 -7.517
34 HD1 PHE 4 HD1 PHE 4 18.882 -9.197 -8.323
35 HD2 PHE 4 HD2 PHE 4 21.223 -6.363 -10.470
36 HE1 PHE 4 HE1 PHE 4 17.872 -9.965 -10.431
37 HE2 PHE 4 HE2 PHE 4 20.216 -7.126 -12.581
38 HZ PHE 4 HZ PHE 4 18.538 -8.929 -12.564
39 H ALA 5 H ALA 5 19.845 -7.424 -4.544
40 HA ALA 5 HA ALA 5 20.865 -4.956 -3.479
41 HB1 ALA 5 1HB ALA 5 20.817 -6.108 -1.324
42 HB2 ALA 5 2HB ALA 5 19.295 -6.309 -2.194
43 HB3 ALA 5 3HB ALA 5 20.463 -7.630 -2.143
44 H LEU 6 H LEU 6 22.915 -4.462 -4.006
45 HA LEU 6 HA LEU 6 24.964 -6.554 -3.858
46 HB2 LEU 6 2HB LEU 6 25.460 -3.769 -4.826
47 HB3 LEU 6 3HB LEU 6 26.298 -5.261 -5.250
48 HG LEU 6 HG LEU 6 23.566 -4.389 -6.187
49 HD11 LEU 6 1HD1 LEU 6 25.871 -5.014 -7.965
50 HD12 LEU 6 2HD1 LEU 6 25.824 -3.455 -7.143
51 HD13 LEU 6 3HD1 LEU 6 24.509 -3.924 -8.221
52 HD21 LEU 6 3HD2 LEU 6 24.115 -6.517 -7.702
53 HD22 LEU 6 1HD2 LEU 6 23.217 -6.630 -6.188
54 HD23 LEU 6 2HD2 LEU 6 24.938 -7.012 -6.223
55 H GLN 7 H GLN 7 27.218 -5.312 -3.269
56 HA GLN 7 HA GLN 7 27.252 -5.057 -0.522
57 HB2 GLN 7 2HB GLN 7 29.479 -4.039 -0.787
58 HB3 GLN 7 3HB GLN 7 29.273 -5.450 -1.815
59 HG2 GLN 7 2HG GLN 7 28.621 -3.749 -3.637
60 HG3 GLN 7 3HG GLN 7 29.385 -2.564 -2.580
61 HE21 GLN 7 1HE2 GLN 7 30.979 -2.160 -4.130
62 HE22 GLN 7 2HE2 GLN 7 32.272 -3.270 -4.415
63 H GLY 8 H GLY 8 26.413 -3.586 0.792
64 HA2 GLY 8 2HA GLY 8 25.817 -1.542 1.665
65 HA3 GLY 8 3HA GLY 8 26.799 -0.790 0.417
66 H ASP 9 H ASP 9 24.297 -2.981 -0.527
67 HA ASP 9 HA ASP 9 22.585 -0.703 -1.273
68 HB2 ASP 9 2HB ASP 9 23.562 -2.992 -2.933
69 HB3 ASP 9 3HB ASP 9 21.970 -2.315 -3.265
70 H THR 10 H THR 10 22.527 -2.618 1.005
71 HA THR 10 HA THR 10 20.394 -4.454 0.579
72 HB THR 10 HB THR 10 20.440 -4.874 2.919
73 HG1 THR 10 HG1 THR 10 21.506 -3.434 4.359
74 HG21 THR 10 3HG2 THR 10 22.859 -5.148 3.385
75 HG22 THR 10 1HG2 THR 10 23.216 -4.151 1.975
76 HG23 THR 10 2HG2 THR 10 22.404 -5.704 1.774
77 H LEU 11 H LEU 11 18.491 -4.256 2.321
78 HA LEU 11 HA LEU 11 16.688 -2.406 1.377
79 HB2 LEU 11 2HB LEU 11 16.663 -3.435 4.202
80 HB3 LEU 11 3HB LEU 11 15.285 -2.966 3.209
81 HG LEU 11 HG LEU 11 16.484 -5.031 1.789
82 HD11 LEU 11 1HD1 LEU 11 17.566 -5.273 4.258
83 HD12 LEU 11 2HD1 LEU 11 17.269 -6.623 3.164
84 HD13 LEU 11 3HD1 LEU 11 16.107 -6.247 4.435
85 HD21 LEU 11 3HD2 LEU 11 14.274 -5.622 3.685
86 HD22 LEU 11 1HD2 LEU 11 14.430 -6.006 1.971
87 HD23 LEU 11 2HD2 LEU 11 14.019 -4.366 2.472
88 H ASP 12 H ASP 12 18.755 -2.144 4.250
89 HA ASP 12 HA ASP 12 17.832 0.286 5.226
90 HB2 ASP 12 2HB ASP 12 20.543 -1.024 5.326
91 HB3 ASP 12 3HB ASP 12 20.234 0.524 6.109
92 H ALA 13 H ALA 13 19.951 -0.400 2.539
93 HA ALA 13 HA ALA 13 20.691 2.388 2.205
94 HB1 ALA 13 1HB ALA 13 22.200 0.367 1.739
95 HB2 ALA 13 2HB ALA 13 21.281 0.199 0.242
96 HB3 ALA 13 3HB ALA 13 22.186 1.679 0.560
97 H ILE 14 H ILE 14 19.085 -0.068 0.170
98 HA ILE 14 HA ILE 14 18.223 1.573 -1.868
99 HB ILE 14 HB ILE 14 16.782 -0.811 -0.700
100 HG12 ILE 14 2HG1 ILE 14 18.519 -0.699 -3.165
101 HG13 ILE 14 3HG1 ILE 14 19.165 -1.085 -1.574
102 HG21 ILE 14 1HG2 ILE 14 16.406 0.611 -3.331
103 HG22 ILE 14 2HG2 ILE 14 15.707 -0.957 -2.931
104 HG23 ILE 14 3HG2 ILE 14 15.237 0.476 -2.018
105 HD11 ILE 14 3HD1 ILE 14 17.056 -2.622 -3.069
106 HD12 ILE 14 1HD1 ILE 14 18.733 -3.103 -2.815
107 HD13 ILE 14 2HD1 ILE 14 17.628 -2.997 -1.444
108 H CYS 15 H CYS 15 16.576 0.851 1.193
109 HA CYS 15 HA CYS 15 14.217 2.261 0.714
110 HB2 CYS 15 2HB CYS 15 15.697 1.586 3.249
111 HB3 CYS 15 3HB CYS 15 14.177 2.472 3.276
112 HG CYS 15 HG CYS 15 14.338 -0.513 1.655
113 H VAL 16 H VAL 16 17.396 3.373 1.560
114 HA VAL 16 HA VAL 16 16.486 6.034 2.272
115 HB VAL 16 HB VAL 16 19.271 4.905 1.963
116 HG11 VAL 16 1HG1 VAL 16 18.285 7.654 2.577
117 HG12 VAL 16 2HG1 VAL 16 19.771 7.075 3.334
118 HG13 VAL 16 3HG1 VAL 16 19.643 7.143 1.575
119 HG21 VAL 16 3HG2 VAL 16 19.353 4.791 4.317
120 HG22 VAL 16 1HG2 VAL 16 17.882 5.747 4.493
121 HG23 VAL 16 2HG2 VAL 16 17.794 4.101 3.868
122 H ARG 17 H ARG 17 17.821 4.361 -0.482
123 HA ARG 17 HA ARG 17 18.347 6.809 -1.940
124 HB2 ARG 17 2HB ARG 17 19.447 5.514 -3.477
125 HB3 ARG 17 3HB ARG 17 19.574 4.467 -2.070
126 HG2 ARG 17 2HG ARG 17 17.638 3.189 -2.851
127 HG3 ARG 17 3HG ARG 17 17.530 4.234 -4.269
128 HD2 ARG 17 2HD ARG 17 18.671 2.199 -4.869
129 HD3 ARG 17 3HD ARG 17 19.817 3.539 -4.904
130 HE ARG 17 HE ARG 17 19.769 1.325 -3.013
131 HH11 ARG 17 1HH1 ARG 17 21.130 4.385 -3.964
132 HH12 ARG 17 2HH1 ARG 17 22.559 4.197 -3.003
133 HH21 ARG 17 1HH2 ARG 17 21.646 1.065 -1.743
134 HH22 ARG 17 2HH2 ARG 17 22.852 2.308 -1.740
135 H TYR 18 H TYR 18 15.680 4.855 -1.328
136 HA TYR 18 HA TYR 18 14.337 5.694 -3.808
137 HB2 TYR 18 2HB TYR 18 14.114 3.313 -2.070
138 HB3 TYR 18 3HB TYR 18 12.593 3.949 -2.686
139 HD1 TYR 18 HD2 TYR 18 15.893 2.607 -3.684
140 HD2 TYR 18 HD1 TYR 18 11.962 3.632 -4.950
141 HE1 TYR 18 HE2 TYR 18 16.290 1.461 -5.824
142 HE2 TYR 18 HE1 TYR 18 12.348 2.488 -7.093
143 HH TYR 18 HH TYR 18 14.567 0.315 -7.643
144 H TYR 19 H TYR 19 13.472 5.113 -0.394
145 HA TYR 19 HA TYR 19 11.456 7.215 -0.575
146 HB2 TYR 19 2HB TYR 19 12.010 5.496 1.835
147 HB3 TYR 19 3HB TYR 19 10.522 6.334 1.411
148 HD1 TYR 19 HD2 TYR 19 9.094 5.460 -0.425
149 HD2 TYR 19 HD1 TYR 19 12.486 3.317 0.991
150 HE1 TYR 19 HE2 TYR 19 8.244 3.417 -1.499
151 HE2 TYR 19 HE1 TYR 19 11.646 1.268 -0.080
152 HH TYR 19 HH TYR 19 8.755 0.671 -0.894
153 H GLY 20 H GLY 20 14.467 6.459 1.078
154 HA2 GLY 20 2HA GLY 20 16.007 8.103 1.793
155 HA3 GLY 20 3HA GLY 20 14.702 9.279 1.821
156 H ARG 21 H ARG 21 14.213 6.176 3.277
157 HA ARG 21 HA ARG 21 15.082 6.888 5.900
158 HB2 ARG 21 2HB ARG 21 12.924 7.106 6.974
159 HB3 ARG 21 3HB ARG 21 13.068 8.316 5.707
160 HG2 ARG 21 2HG ARG 21 11.804 5.762 4.941
161 HG3 ARG 21 3HG ARG 21 10.899 6.794 6.050
162 HD2 ARG 21 2HD ARG 21 11.727 8.609 4.217
163 HD3 ARG 21 3HD ARG 21 11.552 7.175 3.207
164 HE ARG 21 HE ARG 21 9.287 7.609 4.895
165 HH11 ARG 21 1HH1 ARG 21 10.801 8.553 1.906
166 HH12 ARG 21 2HH1 ARG 21 9.316 9.032 1.153
167 HH21 ARG 21 1HH2 ARG 21 7.325 8.238 3.915
168 HH22 ARG 21 2HH2 ARG 21 7.340 8.854 2.297
169 H THR 22 H THR 22 14.463 5.235 7.515
170 HA THR 22 HA THR 22 13.934 2.639 6.220
171 HB THR 22 HB THR 22 15.244 1.803 8.363
172 HG1 THR 22 HG1 THR 22 16.085 3.437 9.407
173 HG21 THR 22 3HG2 THR 22 16.372 1.074 6.566
174 HG22 THR 22 1HG2 THR 22 17.398 2.488 6.800
175 HG23 THR 22 2HG2 THR 22 16.056 2.552 5.658
176 H GLU 23 H GLU 23 13.241 4.765 8.885
177 HA GLU 23 HA GLU 23 11.816 2.875 10.471
178 HB2 GLU 23 2HB GLU 23 12.777 4.956 11.394
179 HB3 GLU 23 3HB GLU 23 11.623 5.892 10.455
180 HG2 GLU 23 2HG GLU 23 10.540 5.851 12.445
181 HG3 GLU 23 3HG GLU 23 9.883 4.380 11.732
182 H GLY 24 H GLY 24 10.018 1.906 9.801
183 HA2 GLY 24 2HA GLY 24 7.678 1.972 9.401
184 HA3 GLY 24 3HA GLY 24 7.871 3.570 8.694
185 H VAL 25 H VAL 25 10.286 2.359 7.208
186 HA VAL 25 HA VAL 25 8.699 1.393 4.945
187 HB VAL 25 HB VAL 25 11.614 2.175 4.958
188 HG11 VAL 25 1HG1 VAL 25 11.621 1.874 2.716
189 HG12 VAL 25 2HG1 VAL 25 10.326 0.738 3.095
190 HG13 VAL 25 3HG1 VAL 25 9.937 2.364 2.534
191 HG21 VAL 25 3HG2 VAL 25 10.555 4.244 3.741
192 HG22 VAL 25 1HG2 VAL 25 9.134 3.807 4.689
193 HG23 VAL 25 2HG2 VAL 25 10.651 4.191 5.501
194 H VAL 26 H VAL 26 11.545 0.524 6.872
195 HA VAL 26 HA VAL 26 12.302 -1.798 5.564
196 HB VAL 26 HB VAL 26 13.250 -2.546 7.726
197 HG11 VAL 26 1HG1 VAL 26 13.675 0.255 6.759
198 HG12 VAL 26 2HG1 VAL 26 14.601 -0.378 8.121
199 HG13 VAL 26 3HG1 VAL 26 14.697 -1.166 6.546
200 HG21 VAL 26 3HG2 VAL 26 11.600 -0.266 8.759
201 HG22 VAL 26 1HG2 VAL 26 11.708 -1.922 9.357
202 HG23 VAL 26 2HG2 VAL 26 13.047 -0.803 9.611
203 H GLU 27 H GLU 27 9.586 -1.214 7.649
204 HA GLU 27 HA GLU 27 9.027 -3.953 8.237
205 HB2 GLU 27 2HB GLU 27 7.486 -1.389 8.509
206 HB3 GLU 27 3HB GLU 27 6.707 -2.939 8.798
207 HG2 GLU 27 2HG GLU 27 8.082 -3.417 10.632
208 HG3 GLU 27 3HG GLU 27 9.239 -2.159 10.199
209 H THR 28 H THR 28 8.056 -1.691 5.737
210 HA THR 28 HA THR 28 5.947 -3.225 4.646
211 HB THR 28 HB THR 28 7.564 -1.488 2.846
212 HG1 THR 28 HG1 THR 28 6.990 0.351 3.890
213 HG21 THR 28 3HG2 THR 28 4.627 -1.894 3.395
214 HG22 THR 28 1HG2 THR 28 5.533 -2.381 1.963
215 HG23 THR 28 2HG2 THR 28 5.251 -0.671 2.288
216 H VAL 29 H VAL 29 9.216 -2.690 3.311
217 HA VAL 29 HA VAL 29 9.129 -4.610 1.323
218 HB VAL 29 HB VAL 29 11.585 -3.886 2.924
219 HG11 VAL 29 1HG1 VAL 29 12.702 -4.322 0.705
220 HG12 VAL 29 2HG1 VAL 29 12.058 -5.744 1.530
221 HG13 VAL 29 3HG1 VAL 29 11.180 -5.036 0.173
222 HG21 VAL 29 3HG2 VAL 29 11.381 -1.812 2.152
223 HG22 VAL 29 1HG2 VAL 29 11.484 -2.442 0.508
224 HG23 VAL 29 2HG2 VAL 29 9.910 -2.247 1.281
225 H LEU 30 H LEU 30 9.994 -4.973 4.727
226 HA LEU 30 HA LEU 30 10.972 -7.582 4.657
227 HB2 LEU 30 2HB LEU 30 9.775 -5.824 6.717
228 HB3 LEU 30 3HB LEU 30 9.836 -7.549 7.076
229 HG LEU 30 HG LEU 30 12.233 -5.861 6.364
230 HD11 LEU 30 1HD1 LEU 30 10.817 -6.272 8.882
231 HD12 LEU 30 2HD1 LEU 30 12.016 -5.059 8.438
232 HD13 LEU 30 3HD1 LEU 30 12.535 -6.661 8.962
233 HD21 LEU 30 3HD2 LEU 30 13.428 -7.740 6.342
234 HD22 LEU 30 1HD2 LEU 30 11.893 -8.603 6.249
235 HD23 LEU 30 2HD2 LEU 30 12.661 -8.337 7.814
236 H ALA 31 H ALA 31 7.653 -6.403 5.053
237 HA ALA 31 HA ALA 31 6.471 -8.950 5.417
238 HB1 ALA 31 1HB ALA 31 4.347 -7.783 4.875
239 HB2 ALA 31 2HB ALA 31 5.299 -6.978 6.123
240 HB3 ALA 31 3HB ALA 31 5.285 -6.343 4.478
241 H ALA 32 H ALA 32 7.488 -7.184 2.612
242 HA ALA 32 HA ALA 32 5.943 -8.792 0.766
243 HB1 ALA 32 1HB ALA 32 7.824 -7.442 -0.731
244 HB2 ALA 32 2HB ALA 32 6.185 -6.894 -0.378
245 HB3 ALA 32 3HB ALA 32 7.529 -6.362 0.631
246 H ASN 33 H ASN 33 9.149 -8.744 2.122
247 HA ASN 33 HA ASN 33 9.790 -11.161 0.569
248 HB2 ASN 33 2HB ASN 33 11.655 -8.886 1.271
249 HB3 ASN 33 3HB ASN 33 12.183 -10.429 0.608
250 HD21 ASN 33 1HD2 ASN 33 10.967 -7.342 -0.069
251 HD22 ASN 33 2HD2 ASN 33 10.764 -7.532 -1.774
252 HA PRO 34 HA PRO 34 10.031 -11.988 5.133
253 HB2 PRO 34 2HB PRO 34 8.682 -14.342 5.013
254 HB3 PRO 34 3HB PRO 34 7.874 -12.779 5.179
255 HG2 PRO 34 2HG PRO 34 8.293 -14.444 2.727
256 HG3 PRO 34 3HG PRO 34 6.843 -13.565 3.248
257 HD2 PRO 34 2HD PRO 34 8.534 -12.600 1.367
258 HD3 PRO 34 3HD PRO 34 7.638 -11.544 2.478
259 H GLY 35 H GLY 35 11.316 -13.529 6.193
260 HA2 GLY 35 2HA GLY 35 12.680 -15.445 6.334
261 HA3 GLY 35 3HA GLY 35 12.561 -15.630 4.590
262 H LEU 36 H LEU 36 13.199 -12.663 4.357
263 HA LEU 36 HA LEU 36 15.940 -12.925 3.829
264 HB2 LEU 36 2HB LEU 36 14.130 -11.175 3.053
265 HB3 LEU 36 3HB LEU 36 14.765 -10.250 4.412
266 HG LEU 36 HG LEU 36 15.786 -9.582 2.292
267 HD11 LEU 36 1HD1 LEU 36 18.079 -10.909 3.537
268 HD12 LEU 36 2HD1 LEU 36 17.048 -10.027 4.663
269 HD13 LEU 36 3HD1 LEU 36 17.757 -9.194 3.280
270 HD21 LEU 36 3HD2 LEU 36 17.540 -11.724 1.780
271 HD22 LEU 36 1HD2 LEU 36 16.250 -11.105 0.748
272 HD23 LEU 36 2HD2 LEU 36 15.918 -12.411 1.887
273 H ALA 37 H ALA 37 14.207 -11.772 6.657
274 HA ALA 37 HA ALA 37 16.314 -10.554 8.028
275 HB1 ALA 37 1HB ALA 37 14.633 -11.870 9.906
276 HB2 ALA 37 2HB ALA 37 14.671 -10.163 9.463
277 HB3 ALA 37 3HB ALA 37 13.633 -11.280 8.578
278 H GLU 38 H GLU 38 15.604 -13.900 7.477
279 HA GLU 38 HA GLU 38 17.428 -14.804 9.554
280 HB2 GLU 38 2HB GLU 38 15.842 -16.357 7.501
281 HB3 GLU 38 3HB GLU 38 16.805 -17.072 8.787
282 HG2 GLU 38 2HG GLU 38 14.319 -15.408 9.065
283 HG3 GLU 38 3HG GLU 38 14.532 -17.110 9.469
284 H LEU 39 H LEU 39 18.021 -13.373 6.808
285 HA LEU 39 HA LEU 39 19.844 -15.263 5.587
286 HB2 LEU 39 2HB LEU 39 18.457 -13.565 4.331
287 HB3 LEU 39 3HB LEU 39 19.548 -12.334 4.964
288 HG LEU 39 HG LEU 39 21.410 -13.332 3.768
289 HD11 LEU 39 1HD1 LEU 39 19.387 -15.435 3.092
290 HD12 LEU 39 2HD1 LEU 39 21.017 -15.624 3.736
291 HD13 LEU 39 3HD1 LEU 39 20.784 -15.144 2.055
292 HD21 LEU 39 3HD2 LEU 39 19.107 -13.090 1.849
293 HD22 LEU 39 1HD2 LEU 39 20.802 -12.683 1.582
294 HD23 LEU 39 2HD2 LEU 39 19.821 -11.699 2.667
295 H GLY 40 H GLY 40 20.128 -12.078 7.169
296 HA2 GLY 40 2HA GLY 40 22.104 -12.411 8.908
297 HA3 GLY 40 3HA GLY 40 23.013 -12.447 7.405
298 H ALA 41 H ALA 41 24.132 -10.577 7.520
299 HA ALA 41 HA ALA 41 22.794 -8.113 8.287
300 HB1 ALA 41 1HB ALA 41 24.885 -8.080 9.206
301 HB2 ALA 41 2HB ALA 41 25.617 -8.940 7.851
302 HB3 ALA 41 3HB ALA 41 25.207 -7.232 7.692
303 H VAL 42 H VAL 42 25.097 -8.689 5.641
304 HA VAL 42 HA VAL 42 23.461 -6.961 3.930
305 HB VAL 42 HB VAL 42 25.891 -6.442 4.240
306 HG11 VAL 42 1HG1 VAL 42 26.306 -8.923 2.576
307 HG12 VAL 42 2HG1 VAL 42 27.552 -7.796 3.116
308 HG13 VAL 42 3HG1 VAL 42 26.680 -8.779 4.293
309 HG21 VAL 42 3HG2 VAL 42 25.538 -5.349 2.338
310 HG22 VAL 42 1HG2 VAL 42 26.073 -6.781 1.456
311 HG23 VAL 42 2HG2 VAL 42 24.362 -6.556 1.818
312 H LEU 43 H LEU 43 22.639 -7.618 1.988
313 HA LEU 43 HA LEU 43 22.294 -10.447 1.619
314 HB2 LEU 43 2HB LEU 43 21.451 -8.246 -0.251
315 HB3 LEU 43 3HB LEU 43 20.789 -9.876 -0.137
316 HG LEU 43 HG LEU 43 20.266 -8.961 2.353
317 HD11 LEU 43 1HD1 LEU 43 20.759 -6.761 2.365
318 HD12 LEU 43 2HD1 LEU 43 19.177 -6.627 1.597
319 HD13 LEU 43 3HD1 LEU 43 20.640 -6.611 0.611
320 HD21 LEU 43 3HD2 LEU 43 18.524 -9.970 1.245
321 HD22 LEU 43 1HD2 LEU 43 18.717 -8.972 -0.196
322 HD23 LEU 43 2HD2 LEU 43 17.986 -8.290 1.257
323 HA PRO 44 HA PRO 44 25.495 -11.264 -1.273
324 HB2 PRO 44 2HB PRO 44 24.324 -13.173 -2.807
325 HB3 PRO 44 3HB PRO 44 24.870 -13.472 -1.153
326 HG2 PRO 44 2HG PRO 44 22.114 -12.882 -2.161
327 HG3 PRO 44 3HG PRO 44 22.633 -14.076 -0.957
328 HD2 PRO 44 2HD PRO 44 21.544 -11.693 -0.271
329 HD3 PRO 44 3HD PRO 44 22.769 -12.506 0.725
330 H HIS 45 H HIS 45 26.123 -9.973 -2.876
331 HA HIS 45 HA HIS 45 24.518 -8.397 -4.467
332 HB2 HIS 45 2HB HIS 45 26.512 -8.235 -5.994
333 HB3 HIS 45 3HB HIS 45 26.857 -7.910 -4.298
334 HD1 HIS 45 HD1 HIS 45 27.752 -10.136 -7.090
335 HD2 HIS 45 HD2 HIS 45 28.296 -10.012 -2.973
336 HE1 HIS 45 HE1 HIS 45 29.568 -11.806 -6.601
337 H GLY 46 H GLY 46 22.864 -9.206 -5.624
338 HA2 GLY 46 2HA GLY 46 22.795 -10.097 -8.067
339 HA3 GLY 46 3HA GLY 46 23.331 -11.580 -7.290
340 H THR 47 H THR 47 21.565 -10.488 -4.932
341 HA THR 47 HA THR 47 19.207 -11.966 -5.775
342 HB THR 47 HB THR 47 19.970 -10.824 -3.081
343 HG1 THR 47 HG1 THR 47 20.061 -13.422 -4.228
344 HG21 THR 47 3HG2 THR 47 17.547 -12.339 -4.004
345 HG22 THR 47 1HG2 THR 47 17.630 -10.870 -3.032
346 HG23 THR 47 2HG2 THR 47 18.095 -12.420 -2.330
347 H ALA 48 H ALA 48 17.512 -10.974 -6.628
348 HA ALA 48 HA ALA 48 17.230 -8.128 -6.584
349 HB1 ALA 48 1HB ALA 48 15.903 -10.391 -7.902
350 HB2 ALA 48 2HB ALA 48 14.861 -9.007 -7.569
351 HB3 ALA 48 3HB ALA 48 16.326 -8.798 -8.528
352 H VAL 49 H VAL 49 15.690 -6.878 -5.555
353 HA VAL 49 HA VAL 49 14.049 -8.218 -3.511
354 HB VAL 49 HB VAL 49 15.492 -5.602 -3.076
355 HG11 VAL 49 1HG1 VAL 49 13.639 -5.569 -1.684
356 HG12 VAL 49 2HG1 VAL 49 13.688 -7.312 -1.409
357 HG13 VAL 49 3HG1 VAL 49 14.885 -6.264 -0.647
358 HG21 VAL 49 3HG2 VAL 49 16.993 -6.821 -1.598
359 HG22 VAL 49 1HG2 VAL 49 16.180 -8.335 -1.998
360 HG23 VAL 49 2HG2 VAL 49 17.084 -7.465 -3.238
361 H GLU 50 H GLU 50 11.969 -7.669 -3.568
362 HA GLU 50 HA GLU 50 11.027 -5.750 -5.469
363 HB2 GLU 50 2HB GLU 50 9.703 -7.712 -5.126
364 HB3 GLU 50 3HB GLU 50 9.628 -7.433 -3.392
365 HG2 GLU 50 2HG GLU 50 8.090 -5.716 -3.602
366 HG3 GLU 50 3HG GLU 50 8.491 -5.430 -5.294
367 H LEU 51 H LEU 51 10.074 -3.773 -5.126
368 HA LEU 51 HA LEU 51 10.329 -2.671 -2.404
369 HB2 LEU 51 2HB LEU 51 10.807 -1.365 -5.072
370 HB3 LEU 51 3HB LEU 51 10.640 -0.458 -3.570
371 HG LEU 51 HG LEU 51 12.725 -2.593 -3.827
372 HD11 LEU 51 1HD1 LEU 51 13.956 -1.445 -5.268
373 HD12 LEU 51 2HD1 LEU 51 13.799 0.021 -4.301
374 HD13 LEU 51 3HD1 LEU 51 12.586 -0.363 -5.522
375 HD21 LEU 51 3HD2 LEU 51 13.093 -0.037 -2.373
376 HD22 LEU 51 1HD2 LEU 51 13.630 -1.666 -1.962
377 HD23 LEU 51 2HD2 LEU 51 11.950 -1.198 -1.698
378 HA PRO 52 HA PRO 52 5.868 -2.417 -3.310
379 HB2 PRO 52 2HB PRO 52 5.131 -2.454 -0.697
380 HB3 PRO 52 3HB PRO 52 5.492 -3.921 -1.614
381 HG2 PRO 52 2HG PRO 52 7.230 -2.404 0.294
382 HG3 PRO 52 3HG PRO 52 7.003 -4.156 0.138
383 HD2 PRO 52 2HD PRO 52 9.149 -2.868 -0.895
384 HD3 PRO 52 3HD PRO 52 8.445 -4.310 -1.653
385 H ASP 53 H ASP 53 4.303 -0.779 -2.850
386 HA ASP 53 HA ASP 53 3.620 1.377 -2.607
387 HB2 ASP 53 2HB ASP 53 5.466 1.024 -0.270
388 HB3 ASP 53 3HB ASP 53 4.765 2.606 -0.601
389 H VAL 54 H VAL 54 5.305 1.114 -4.664
390 HA VAL 54 HA VAL 54 6.965 3.543 -4.504
391 HB VAL 54 HB VAL 54 7.628 1.012 -6.016
392 HG11 VAL 54 1HG1 VAL 54 9.855 2.499 -6.187
393 HG12 VAL 54 2HG1 VAL 54 8.587 2.512 -7.414
394 HG13 VAL 54 3HG1 VAL 54 8.644 3.781 -6.190
395 HG21 VAL 54 3HG2 VAL 54 8.927 2.321 -3.629
396 HG22 VAL 54 1HG2 VAL 54 8.078 0.776 -3.658
397 HG23 VAL 54 2HG2 VAL 54 9.604 0.960 -4.523
398 H GLN 55 H GLN 55 6.936 4.901 -6.270
399 HA GLN 55 HA GLN 55 5.018 4.208 -8.397
400 HB2 GLN 55 2HB GLN 55 5.489 6.852 -7.023
401 HB3 GLN 55 3HB GLN 55 4.598 6.703 -8.532
402 HG2 GLN 55 2HG GLN 55 3.851 5.265 -5.999
403 HG3 GLN 55 3HG GLN 55 3.189 6.827 -6.479
404 HE21 GLN 55 1HE2 GLN 55 1.211 5.411 -6.230
405 HE22 GLN 55 2HE2 GLN 55 0.656 4.605 -7.653
406 H THR 56 H THR 56 5.667 4.447 -10.456
407 HA THR 56 HA THR 56 8.087 5.998 -11.022
408 HB THR 56 HB THR 56 8.760 3.615 -10.708
409 HG1 THR 56 HG1 THR 56 9.085 4.161 -13.443
410 HG21 THR 56 3HG2 THR 56 7.132 3.130 -13.204
411 HG22 THR 56 1HG2 THR 56 6.656 2.621 -11.584
412 HG23 THR 56 2HG2 THR 56 8.107 1.949 -12.330
413 H ALA 57 H ALA 57 8.454 6.005 -13.510
414 HA ALA 57 HA ALA 57 6.371 7.335 -14.734
415 HB1 ALA 57 1HB ALA 57 7.969 5.933 -16.690
416 HB2 ALA 57 2HB ALA 57 7.875 7.659 -16.339
417 HB3 ALA 57 3HB ALA 57 8.971 6.630 -15.417
418 HA PRO 58 HA PRO 58 3.476 4.387 -16.211
419 HB2 PRO 58 2HB PRO 58 2.834 5.373 -18.658
420 HB3 PRO 58 3HB PRO 58 2.318 6.136 -17.149
421 HG2 PRO 58 2HG PRO 58 4.599 6.852 -18.950
422 HG3 PRO 58 3HG PRO 58 3.433 7.917 -18.143
423 HD2 PRO 58 2HD PRO 58 5.937 7.514 -17.194
424 HD3 PRO 58 3HD PRO 58 4.550 7.824 -16.129
425 H VAL 59 H VAL 59 4.120 2.378 -16.690
426 HA VAL 59 HA VAL 59 5.447 1.930 -19.279
427 HB VAL 59 HB VAL 59 6.730 0.074 -18.259
428 HG11 VAL 59 1HG1 VAL 59 7.751 2.278 -18.570
429 HG12 VAL 59 2HG1 VAL 59 7.204 2.758 -16.963
430 HG13 VAL 59 3HG1 VAL 59 8.391 1.465 -17.142
431 HG21 VAL 59 3HG2 VAL 59 5.195 -0.289 -16.342
432 HG22 VAL 59 1HG2 VAL 59 6.889 -0.162 -15.868
433 HG23 VAL 59 2HG2 VAL 59 5.799 1.202 -15.621
434 H ALA 60 H ALA 60 5.063 -0.146 -20.235
435 HA ALA 60 HA ALA 60 2.433 -0.979 -20.251
436 HB1 ALA 60 1HB ALA 60 3.581 -1.679 -22.104
437 HB2 ALA 60 2HB ALA 60 4.983 -2.208 -21.173
438 HB3 ALA 60 3HB ALA 60 3.513 -3.183 -21.186
439 H GLU 61 H GLU 61 1.239 -1.942 -18.756
440 HA GLU 61 HA GLU 61 2.308 -4.179 -17.247
441 HB2 GLU 61 2HB GLU 61 1.682 -3.275 -15.073
442 HB3 GLU 61 3HB GLU 61 2.872 -2.239 -15.847
443 HG2 GLU 61 2HG GLU 61 1.378 -0.714 -14.999
444 HG3 GLU 61 3HG GLU 61 0.817 -0.896 -16.660
445 H THR 62 H THR 62 0.394 -4.776 -15.545
446 HA THR 62 HA THR 62 -2.220 -4.451 -16.780
447 HB THR 62 HB THR 62 -1.368 -7.266 -16.216
448 HG1 THR 62 HG1 THR 62 -0.466 -7.463 -18.199
449 HG21 THR 62 3HG2 THR 62 -3.587 -5.862 -17.543
450 HG22 THR 62 1HG2 THR 62 -3.563 -7.421 -16.720
451 HG23 THR 62 2HG2 THR 62 -2.999 -7.295 -18.386
452 H VAL 63 H VAL 63 -3.969 -5.215 -15.435
453 HA VAL 63 HA VAL 63 -3.391 -6.101 -12.750
454 HB VAL 63 HB VAL 63 -3.013 -3.685 -12.530
455 HG11 VAL 63 1HG1 VAL 63 -4.947 -3.369 -14.392
456 HG12 VAL 63 2HG1 VAL 63 -5.846 -2.990 -12.921
457 HG13 VAL 63 3HG1 VAL 63 -4.386 -2.085 -13.322
458 HG21 VAL 63 3HG2 VAL 63 -5.605 -4.485 -11.214
459 HG22 VAL 63 1HG2 VAL 63 -4.014 -5.034 -10.687
460 HG23 VAL 63 2HG2 VAL 63 -4.420 -3.319 -10.624
461 H ASN 64 H ASN 64 -5.104 -7.124 -11.825
462 HA ASN 64 HA ASN 64 -7.443 -7.508 -13.505
463 HB2 ASN 64 2HB ASN 64 -8.025 -9.229 -11.725
464 HB3 ASN 64 3HB ASN 64 -6.545 -9.527 -12.632
465 HD21 ASN 64 1HD2 ASN 64 -4.783 -9.954 -11.512
466 HD22 ASN 64 2HD2 ASN 64 -4.546 -9.626 -9.833
467 H LEU 65 H LEU 65 -9.613 -7.630 -12.397
468 HA LEU 65 HA LEU 65 -9.931 -5.801 -10.153
469 HB2 LEU 65 2HB LEU 65 -10.896 -5.291 -12.930
470 HB3 LEU 65 3HB LEU 65 -11.864 -4.739 -11.565
471 HG LEU 65 HG LEU 65 -8.999 -3.945 -12.082
472 HD11 LEU 65 1HD1 LEU 65 -11.540 -2.384 -12.524
473 HD12 LEU 65 2HD1 LEU 65 -10.526 -3.073 -13.792
474 HD13 LEU 65 3HD1 LEU 65 -9.894 -1.793 -12.755
475 HD21 LEU 65 3HD2 LEU 65 -11.037 -2.973 -10.082
476 HD22 LEU 65 1HD2 LEU 65 -9.458 -2.239 -10.365
477 HD23 LEU 65 2HD2 LEU 65 -9.566 -3.881 -9.730
478 H TRP 66 H TRP 66 -11.083 -6.974 -8.774
479 HA TRP 66 HA TRP 66 -12.751 -9.133 -9.520
480 HB2 TRP 66 2HB TRP 66 -12.474 -7.602 -6.930
481 HB3 TRP 66 3HB TRP 66 -13.506 -9.017 -7.109
482 HD1 TRP 66 HD1 TRP 66 -11.435 -10.742 -8.898
483 HE1 TRP 66 HE1 TRP 66 -9.389 -11.784 -7.735
484 HE3 TRP 66 HE3 TRP 66 -11.237 -7.743 -4.763
485 HZ2 TRP 66 HZ2 TRP 66 -7.890 -11.387 -5.376
486 HZ3 TRP 66 HZ3 TRP 66 -9.467 -8.141 -3.101
487 HH2 TRP 66 HH2 TRP 66 -7.829 -9.926 -3.403
488 H GLU 67 H GLU 67 -14.565 -8.858 -10.650
489 HA GLU 67 HA GLU 67 -16.365 -6.655 -9.883
490 HB2 GLU 67 2HB GLU 67 -15.924 -8.005 -12.543
491 HB3 GLU 67 3HB GLU 67 -17.321 -6.988 -12.219
492 HG2 GLU 67 2HG GLU 67 -15.881 -5.092 -11.787
493 HG3 GLU 67 3HG GLU 67 -14.453 -6.100 -12.012
494 H VAL 68 H VAL 68 -16.220 -9.282 -8.632
495 HA VAL 68 HA VAL 68 -18.847 -10.375 -9.400
496 HB VAL 68 HB VAL 68 -17.209 -12.081 -9.667
497 HG11 VAL 68 1HG1 VAL 68 -16.067 -12.559 -7.182
498 HG12 VAL 68 2HG1 VAL 68 -15.271 -11.859 -8.593
499 HG13 VAL 68 3HG1 VAL 68 -15.990 -10.807 -7.372
500 HG21 VAL 68 3HG2 VAL 68 -19.376 -12.381 -8.076
501 HG22 VAL 68 1HG2 VAL 68 -18.319 -13.704 -8.568
502 HG23 VAL 68 2HG2 VAL 68 -18.098 -12.938 -6.995
503 H GLU 69 H GLU 69 -20.276 -9.324 -8.126
504 HA GLU 69 HA GLU 69 -20.478 -10.008 -5.399
505 HB2 GLU 69 2HB GLU 69 -18.618 -8.147 -5.552
506 HB3 GLU 69 3HB GLU 69 -20.002 -7.070 -5.676
507 HG2 GLU 69 2HG GLU 69 -20.855 -8.225 -3.561
508 HG3 GLU 69 3HG GLU 69 -19.217 -8.856 -3.404
509 H HIS 70 H HIS 70 -22.559 -9.882 -4.831
510 HA HIS 70 HA HIS 70 -24.323 -8.167 -6.454
511 HB2 HIS 70 2HB HIS 70 -26.112 -9.822 -5.982
512 HB3 HIS 70 3HB HIS 70 -24.765 -10.513 -6.883
513 HD1 HIS 70 HD1 HIS 70 -26.698 -10.889 -3.785
514 HD2 HIS 70 HD2 HIS 70 -23.068 -12.226 -5.299
515 HE1 HIS 70 HE1 HIS 70 -26.018 -12.805 -2.306
516 H HIS 71 H HIS 71 -23.475 -9.258 -3.246
517 HA HIS 71 HA HIS 71 -25.594 -7.669 -2.026
518 HB2 HIS 71 2HB HIS 71 -24.749 -10.024 -1.254
519 HB3 HIS 71 3HB HIS 71 -23.473 -9.102 -0.465
520 HD1 HIS 71 HD1 HIS 71 -24.209 -9.478 1.922
521 HD2 HIS 71 HD2 HIS 71 -27.224 -7.926 -0.479
522 HE1 HIS 71 HE1 HIS 71 -26.067 -8.850 3.497
Start of MODEL 15
1 H1 MET 1 H MET 1 2.821 -2.691 -2.726
2 HA MET 1 HA MET 1 3.754 -2.620 -5.518
3 HB2 MET 1 2HB MET 1 3.677 -0.495 -3.972
4 HB3 MET 1 3HB MET 1 5.162 -1.168 -3.313
5 HG2 MET 1 2HG MET 1 5.877 0.312 -4.956
6 HG3 MET 1 3HG MET 1 5.983 -1.272 -5.722
7 HE1 MET 1 3HE MET 1 4.407 -2.104 -7.659
8 HE2 MET 1 1HE MET 1 4.139 -0.849 -8.868
9 HE3 MET 1 2HE MET 1 5.738 -1.057 -8.153
10 H LYS 2 H LYS 2 3.723 -4.996 -3.893
11 HA LYS 2 HA LYS 2 6.399 -5.458 -2.942
12 HB2 LYS 2 2HB LYS 2 5.621 -7.786 -2.615
13 HB3 LYS 2 3HB LYS 2 4.558 -6.603 -1.863
14 HG2 LYS 2 2HG LYS 2 3.000 -6.803 -3.726
15 HG3 LYS 2 3HG LYS 2 4.072 -7.970 -4.503
16 HD2 LYS 2 2HD LYS 2 3.839 -9.258 -2.243
17 HD3 LYS 2 3HD LYS 2 2.383 -8.277 -2.055
18 HE2 LYS 2 2HE LYS 2 1.638 -9.084 -4.293
19 HE3 LYS 2 3HE LYS 2 3.028 -10.168 -4.314
20 HZ1 LYS 2 3HZ LYS 2 0.639 -10.863 -3.385
21 HZ2 LYS 2 1HZ LYS 2 1.346 -10.309 -1.951
22 HZ3 LYS 2 2HZ LYS 2 2.082 -11.551 -2.833
23 H THR 3 H THR 3 7.906 -6.938 -3.824
24 HA THR 3 HA THR 3 7.468 -7.864 -6.553
25 HB THR 3 HB THR 3 8.434 -5.629 -6.856
26 HG1 THR 3 HG1 THR 3 10.346 -6.386 -8.042
27 HG21 THR 3 3HG2 THR 3 9.962 -4.838 -5.444
28 HG22 THR 3 1HG2 THR 3 11.104 -6.059 -6.003
29 HG23 THR 3 2HG2 THR 3 10.044 -6.402 -4.636
30 H PHE 4 H PHE 4 9.184 -9.330 -7.295
31 HA PHE 4 HA PHE 4 10.048 -11.032 -5.121
32 HB2 PHE 4 2HB PHE 4 10.577 -11.451 -8.062
33 HB3 PHE 4 3HB PHE 4 10.535 -12.664 -6.787
34 HD1 PHE 4 HD2 PHE 4 8.184 -12.636 -5.451
35 HD2 PHE 4 HD1 PHE 4 8.791 -11.421 -9.485
36 HE1 PHE 4 HE2 PHE 4 5.809 -13.060 -5.933
37 HE2 PHE 4 HE1 PHE 4 6.417 -11.842 -9.973
38 HZ PHE 4 HZ PHE 4 4.923 -12.664 -8.197
39 H ALA 5 H ALA 5 11.844 -10.450 -4.078
40 HA ALA 5 HA ALA 5 13.900 -8.844 -5.075
41 HB1 ALA 5 1HB ALA 5 14.397 -10.883 -2.940
42 HB2 ALA 5 2HB ALA 5 15.017 -9.238 -3.080
43 HB3 ALA 5 3HB ALA 5 13.330 -9.510 -2.644
44 H LEU 6 H LEU 6 16.024 -9.325 -5.746
45 HA LEU 6 HA LEU 6 16.683 -12.078 -6.410
46 HB2 LEU 6 2HB LEU 6 16.596 -9.921 -8.514
47 HB3 LEU 6 3HB LEU 6 17.153 -11.578 -8.743
48 HG LEU 6 HG LEU 6 14.324 -10.869 -7.985
49 HD11 LEU 6 1HD1 LEU 6 14.872 -11.792 -10.714
50 HD12 LEU 6 2HD1 LEU 6 15.452 -10.167 -10.350
51 HD13 LEU 6 3HD1 LEU 6 13.748 -10.564 -10.131
52 HD21 LEU 6 3HD2 LEU 6 13.930 -13.063 -7.951
53 HD22 LEU 6 1HD2 LEU 6 15.680 -13.268 -7.891
54 HD23 LEU 6 2HD2 LEU 6 14.838 -13.333 -9.439
55 H GLN 7 H GLN 7 18.905 -11.887 -7.800
56 HA GLN 7 HA GLN 7 20.869 -11.121 -6.022
57 HB2 GLN 7 2HB GLN 7 22.452 -11.360 -7.851
58 HB3 GLN 7 3HB GLN 7 21.241 -12.632 -7.933
59 HG2 GLN 7 2HG GLN 7 20.030 -11.177 -9.615
60 HG3 GLN 7 3HG GLN 7 21.495 -10.198 -9.667
61 HE21 GLN 7 1HE2 GLN 7 22.969 -10.743 -11.105
62 HE22 GLN 7 2HE2 GLN 7 23.101 -12.273 -11.895
63 H GLY 8 H GLY 8 21.649 -9.227 -5.373
64 HA2 GLY 8 2HA GLY 8 22.133 -6.985 -5.297
65 HA3 GLY 8 3HA GLY 8 22.213 -7.048 -7.052
66 H ASP 9 H ASP 9 19.291 -7.960 -5.421
67 HA ASP 9 HA ASP 9 18.081 -5.380 -6.167
68 HB2 ASP 9 2HB ASP 9 17.175 -8.166 -6.770
69 HB3 ASP 9 3HB ASP 9 15.964 -6.912 -6.516
70 H THR 10 H THR 10 19.112 -6.444 -3.594
71 HA THR 10 HA THR 10 16.889 -7.101 -1.939
72 HB THR 10 HB THR 10 18.369 -6.956 -0.088
73 HG1 THR 10 HG1 THR 10 20.419 -5.751 -1.594
74 HG21 THR 10 3HG2 THR 10 19.904 -7.842 -2.532
75 HG22 THR 10 1HG2 THR 10 18.866 -8.840 -1.515
76 HG23 THR 10 2HG2 THR 10 20.375 -8.195 -0.870
77 H LEU 11 H LEU 11 16.694 -5.639 0.178
78 HA LEU 11 HA LEU 11 15.197 -3.425 -0.465
79 HB2 LEU 11 2HB LEU 11 16.799 -3.722 2.068
80 HB3 LEU 11 3HB LEU 11 15.323 -2.785 1.845
81 HG LEU 11 HG LEU 11 15.583 -5.790 1.854
82 HD11 LEU 11 1HD1 LEU 11 15.236 -3.923 3.922
83 HD12 LEU 11 2HD1 LEU 11 15.079 -5.677 4.009
84 HD13 LEU 11 3HD1 LEU 11 13.665 -4.681 3.666
85 HD21 LEU 11 3HD2 LEU 11 13.946 -5.240 0.208
86 HD22 LEU 11 1HD2 LEU 11 13.219 -4.021 1.255
87 HD23 LEU 11 2HD2 LEU 11 13.088 -5.730 1.669
88 H ASP 12 H ASP 12 18.643 -3.568 0.323
89 HA ASP 12 HA ASP 12 19.216 -0.861 0.440
90 HB2 ASP 12 2HB ASP 12 20.945 -2.343 1.054
91 HB3 ASP 12 3HB ASP 12 20.847 -3.222 -0.470
92 H ALA 13 H ALA 13 18.770 -2.935 -2.359
93 HA ALA 13 HA ALA 13 19.523 -0.825 -4.206
94 HB1 ALA 13 1HB ALA 13 20.180 -2.718 -5.230
95 HB2 ALA 13 2HB ALA 13 18.991 -3.713 -4.387
96 HB3 ALA 13 3HB ALA 13 18.509 -2.762 -5.792
97 H ILE 14 H ILE 14 16.603 -2.787 -3.605
98 HA ILE 14 HA ILE 14 14.854 -1.507 -5.301
99 HB ILE 14 HB ILE 14 14.218 -2.607 -2.561
100 HG12 ILE 14 2HG1 ILE 14 13.932 -3.966 -5.242
101 HG13 ILE 14 3HG1 ILE 14 15.354 -4.152 -4.222
102 HG21 ILE 14 1HG2 ILE 14 11.935 -2.888 -3.465
103 HG22 ILE 14 2HG2 ILE 14 12.424 -1.199 -3.344
104 HG23 ILE 14 3HG2 ILE 14 12.428 -2.008 -4.911
105 HD11 ILE 14 3HD1 ILE 14 14.017 -5.140 -2.478
106 HD12 ILE 14 1HD1 ILE 14 12.546 -4.861 -3.409
107 HD13 ILE 14 2HD1 ILE 14 13.757 -6.002 -3.994
108 H CYS 15 H CYS 15 15.442 -0.722 -1.874
109 HA CYS 15 HA CYS 15 13.732 1.433 -1.631
110 HB2 CYS 15 2HB CYS 15 16.396 0.881 -0.328
111 HB3 CYS 15 3HB CYS 15 15.388 2.251 0.123
112 HG CYS 15 HG CYS 15 13.177 0.457 0.724
113 H VAL 16 H VAL 16 16.834 1.243 -3.202
114 HA VAL 16 HA VAL 16 17.064 4.122 -3.485
115 HB VAL 16 HB VAL 16 18.766 1.893 -4.611
116 HG11 VAL 16 1HG1 VAL 16 19.105 3.678 -6.075
117 HG12 VAL 16 2HG1 VAL 16 18.981 4.879 -4.789
118 HG13 VAL 16 3HG1 VAL 16 20.408 3.848 -4.899
119 HG21 VAL 16 3HG2 VAL 16 20.320 2.376 -2.881
120 HG22 VAL 16 1HG2 VAL 16 19.423 3.812 -2.386
121 HG23 VAL 16 2HG2 VAL 16 18.742 2.209 -2.111
122 H ARG 17 H ARG 17 15.927 1.394 -5.304
123 HA ARG 17 HA ARG 17 15.873 2.839 -7.816
124 HB2 ARG 17 2HB ARG 17 15.490 0.832 -8.809
125 HB3 ARG 17 3HB ARG 17 16.134 0.220 -7.292
126 HG2 ARG 17 2HG ARG 17 13.812 0.006 -6.450
127 HG3 ARG 17 3HG ARG 17 13.233 0.488 -8.046
128 HD2 ARG 17 2HD ARG 17 15.087 -1.842 -7.636
129 HD3 ARG 17 3HD ARG 17 13.333 -2.006 -7.561
130 HE ARG 17 HE ARG 17 13.965 -0.713 -9.947
131 HH11 ARG 17 1HH1 ARG 17 14.439 -3.814 -8.438
132 HH12 ARG 17 2HH1 ARG 17 14.486 -4.682 -9.937
133 HH21 ARG 17 1HH2 ARG 17 14.024 -1.844 -11.926
134 HH22 ARG 17 2HH2 ARG 17 14.251 -3.560 -11.921
135 H TYR 18 H TYR 18 13.893 2.524 -5.092
136 HA TYR 18 HA TYR 18 11.496 3.303 -6.610
137 HB2 TYR 18 2HB TYR 18 11.932 1.715 -4.164
138 HB3 TYR 18 3HB TYR 18 10.582 2.842 -4.086
139 HD1 TYR 18 HD2 TYR 18 11.929 -0.121 -5.797
140 HD2 TYR 18 HD1 TYR 18 8.599 2.497 -5.402
141 HE1 TYR 18 HE2 TYR 18 10.533 -1.719 -7.040
142 HE2 TYR 18 HE1 TYR 18 7.193 0.906 -6.643
143 HH TYR 18 HH TYR 18 7.977 -2.236 -7.145
144 H TYR 19 H TYR 19 12.924 3.956 -3.404
145 HA TYR 19 HA TYR 19 11.775 6.633 -3.454
146 HB2 TYR 19 2HB TYR 19 13.425 5.447 -1.230
147 HB3 TYR 19 3HB TYR 19 12.241 6.745 -1.135
148 HD1 TYR 19 HD2 TYR 19 9.810 6.205 -1.357
149 HD2 TYR 19 HD1 TYR 19 12.776 3.173 -1.023
150 HE1 TYR 19 HE2 TYR 19 8.070 4.580 -0.739
151 HE2 TYR 19 HE1 TYR 19 11.045 1.539 -0.405
152 HH TYR 19 HH TYR 19 8.738 1.177 -0.499
153 H GLY 20 H GLY 20 14.905 5.029 -3.499
154 HA2 GLY 20 2HA GLY 20 16.821 5.931 -4.543
155 HA3 GLY 20 3HA GLY 20 16.116 7.534 -4.399
156 H ARG 21 H ARG 21 16.069 5.465 -1.635
157 HA ARG 21 HA ARG 21 18.572 6.286 -0.538
158 HB2 ARG 21 2HB ARG 21 17.757 7.731 1.228
159 HB3 ARG 21 3HB ARG 21 17.301 8.398 -0.334
160 HG2 ARG 21 2HG ARG 21 15.320 6.634 0.956
161 HG3 ARG 21 3HG ARG 21 15.618 8.190 1.735
162 HD2 ARG 21 2HD ARG 21 15.426 8.938 -0.864
163 HD3 ARG 21 3HD ARG 21 14.315 7.570 -0.827
164 HE ARG 21 HE ARG 21 13.928 9.456 1.314
165 HH11 ARG 21 1HH1 ARG 21 13.117 8.624 -1.968
166 HH12 ARG 21 2HH1 ARG 21 11.625 9.504 -1.960
167 HH21 ARG 21 1HH2 ARG 21 11.966 10.618 1.336
168 HH22 ARG 21 2HH2 ARG 21 10.972 10.639 -0.081
169 H THR 22 H THR 22 18.800 5.581 1.753
170 HA THR 22 HA THR 22 17.031 3.290 2.317
171 HB THR 22 HB THR 22 19.183 2.482 3.611
172 HG1 THR 22 HG1 THR 22 20.257 4.130 1.544
173 HG21 THR 22 3HG2 THR 22 18.114 2.030 0.987
174 HG22 THR 22 1HG2 THR 22 18.913 0.893 2.072
175 HG23 THR 22 2HG2 THR 22 19.869 1.864 0.951
176 H GLU 23 H GLU 23 18.731 6.055 3.589
177 HA GLU 23 HA GLU 23 18.387 5.533 6.338
178 HB2 GLU 23 2HB GLU 23 19.929 7.246 5.359
179 HB3 GLU 23 3HB GLU 23 18.523 8.239 5.001
180 HG2 GLU 23 2HG GLU 23 18.032 7.976 7.543
181 HG3 GLU 23 3HG GLU 23 19.744 7.566 7.635
182 H GLY 24 H GLY 24 16.492 5.213 7.301
183 HA2 GLY 24 2HA GLY 24 14.470 6.020 8.213
184 HA3 GLY 24 3HA GLY 24 14.369 7.184 6.900
185 H VAL 25 H VAL 25 14.994 4.956 4.959
186 HA VAL 25 HA VAL 25 12.233 4.089 4.635
187 HB VAL 25 HB VAL 25 14.550 3.607 2.763
188 HG11 VAL 25 1HG1 VAL 25 12.092 2.463 2.749
189 HG12 VAL 25 2HG1 VAL 25 11.810 3.884 1.741
190 HG13 VAL 25 3HG1 VAL 25 13.074 2.733 1.309
191 HG21 VAL 25 3HG2 VAL 25 13.342 5.565 1.519
192 HG22 VAL 25 1HG2 VAL 25 12.786 5.984 3.140
193 HG23 VAL 25 2HG2 VAL 25 14.513 5.910 2.791
194 H VAL 26 H VAL 26 15.463 2.690 4.999
195 HA VAL 26 HA VAL 26 14.841 0.004 4.656
196 HB VAL 26 HB VAL 26 16.805 -0.482 6.090
197 HG11 VAL 26 1HG1 VAL 26 16.977 1.568 3.912
198 HG12 VAL 26 2HG1 VAL 26 18.432 0.961 4.706
199 HG13 VAL 26 3HG1 VAL 26 17.360 -0.152 3.854
200 HG21 VAL 26 3HG2 VAL 26 17.920 2.043 6.485
201 HG22 VAL 26 1HG2 VAL 26 16.250 2.188 7.032
202 HG23 VAL 26 2HG2 VAL 26 17.299 0.950 7.722
203 H GLU 27 H GLU 27 14.290 2.112 7.384
204 HA GLU 27 HA GLU 27 13.737 0.040 9.269
205 HB2 GLU 27 2HB GLU 27 13.139 2.996 9.244
206 HB3 GLU 27 3HB GLU 27 12.690 1.945 10.580
207 HG2 GLU 27 2HG GLU 27 14.933 1.496 11.120
208 HG3 GLU 27 3HG GLU 27 15.515 2.158 9.593
209 H THR 28 H THR 28 11.910 1.697 6.839
210 HA THR 28 HA THR 28 9.320 1.076 7.879
211 HB THR 28 HB THR 28 9.741 1.556 4.961
212 HG1 THR 28 HG1 THR 28 10.219 3.678 5.290
213 HG21 THR 28 3HG2 THR 28 7.764 2.668 6.954
214 HG22 THR 28 1HG2 THR 28 7.479 1.270 5.919
215 HG23 THR 28 2HG2 THR 28 7.712 2.865 5.203
216 H VAL 29 H VAL 29 10.977 -0.109 4.945
217 HA VAL 29 HA VAL 29 9.266 -2.214 4.387
218 HB VAL 29 HB VAL 29 12.247 -2.221 3.900
219 HG11 VAL 29 1HG1 VAL 29 9.954 -3.823 2.881
220 HG12 VAL 29 2HG1 VAL 29 11.293 -3.470 1.788
221 HG13 VAL 29 3HG1 VAL 29 11.590 -4.332 3.298
222 HG21 VAL 29 3HG2 VAL 29 10.805 -1.443 1.594
223 HG22 VAL 29 1HG2 VAL 29 10.250 -0.435 2.930
224 HG23 VAL 29 2HG2 VAL 29 11.966 -0.498 2.527
225 H LEU 30 H LEU 30 11.930 -2.043 6.660
226 HA LEU 30 HA LEU 30 12.219 -4.789 7.179
227 HB2 LEU 30 2HB LEU 30 12.970 -2.267 8.513
228 HB3 LEU 30 3HB LEU 30 12.880 -3.690 9.549
229 HG LEU 30 HG LEU 30 14.605 -3.418 7.087
230 HD11 LEU 30 1HD1 LEU 30 15.058 -2.179 9.423
231 HD12 LEU 30 2HD1 LEU 30 16.342 -2.811 8.393
232 HD13 LEU 30 3HD1 LEU 30 15.777 -3.751 9.774
233 HD21 LEU 30 3HD2 LEU 30 14.427 -5.666 7.162
234 HD22 LEU 30 1HD2 LEU 30 13.886 -5.676 8.841
235 HD23 LEU 30 2HD2 LEU 30 15.602 -5.505 8.468
236 H ALA 31 H ALA 31 10.162 -2.323 8.675
237 HA ALA 31 HA ALA 31 9.086 -3.962 10.700
238 HB1 ALA 31 1HB ALA 31 7.742 -1.605 9.388
239 HB2 ALA 31 2HB ALA 31 7.433 -2.255 10.999
240 HB3 ALA 31 3HB ALA 31 8.974 -1.475 10.644
241 H ALA 32 H ALA 32 8.168 -3.410 7.351
242 HA ALA 32 HA ALA 32 5.666 -4.773 7.512
243 HB1 ALA 32 1HB ALA 32 6.482 -4.871 4.857
244 HB2 ALA 32 2HB ALA 32 5.461 -3.643 5.607
245 HB3 ALA 32 3HB ALA 32 7.203 -3.392 5.492
246 H ASN 33 H ASN 33 8.964 -5.727 6.826
247 HA ASN 33 HA ASN 33 8.055 -8.522 6.652
248 HB2 ASN 33 2HB ASN 33 9.918 -7.010 4.891
249 HB3 ASN 33 3HB ASN 33 10.326 -8.685 5.251
250 HD21 ASN 33 1HD2 ASN 33 7.602 -6.678 4.205
251 HD22 ASN 33 2HD2 ASN 33 6.950 -7.835 3.100
252 HA PRO 34 HA PRO 34 11.034 -7.979 10.173
253 HB2 PRO 34 2HB PRO 34 9.568 -9.427 11.941
254 HB3 PRO 34 3HB PRO 34 9.320 -7.697 11.676
255 HG2 PRO 34 2HG PRO 34 7.792 -10.022 10.570
256 HG3 PRO 34 3HG PRO 34 7.181 -8.489 11.220
257 HD2 PRO 34 2HD PRO 34 7.396 -8.962 8.563
258 HD3 PRO 34 3HD PRO 34 7.607 -7.345 9.264
259 H GLY 35 H GLY 35 12.406 -9.549 11.094
260 HA2 GLY 35 2HA GLY 35 13.207 -11.732 11.468
261 HA3 GLY 35 3HA GLY 35 11.982 -12.345 10.368
262 H LEU 36 H LEU 36 12.854 -10.119 8.451
263 HA LEU 36 HA LEU 36 14.545 -11.703 6.853
264 HB2 LEU 36 2HB LEU 36 12.971 -9.614 6.353
265 HB3 LEU 36 3HB LEU 36 14.510 -8.763 6.462
266 HG LEU 36 HG LEU 36 13.918 -9.303 4.149
267 HD11 LEU 36 1HD1 LEU 36 16.343 -9.534 5.307
268 HD12 LEU 36 2HD1 LEU 36 16.057 -9.694 3.575
269 HD13 LEU 36 3HD1 LEU 36 16.179 -11.134 4.585
270 HD21 LEU 36 3HD2 LEU 36 13.370 -11.367 3.394
271 HD22 LEU 36 1HD2 LEU 36 12.847 -11.576 5.066
272 HD23 LEU 36 2HD2 LEU 36 14.418 -12.191 4.551
273 H ALA 37 H ALA 37 15.189 -9.272 9.265
274 HA ALA 37 HA ALA 37 17.804 -8.567 8.622
275 HB1 ALA 37 1HB ALA 37 17.606 -7.341 10.461
276 HB2 ALA 37 2HB ALA 37 16.038 -8.099 10.740
277 HB3 ALA 37 3HB ALA 37 17.491 -8.782 11.470
278 H GLU 38 H GLU 38 16.542 -11.517 9.897
279 HA GLU 38 HA GLU 38 19.138 -12.448 10.818
280 HB2 GLU 38 2HB GLU 38 16.403 -13.724 10.774
281 HB3 GLU 38 3HB GLU 38 17.848 -14.566 11.316
282 HG2 GLU 38 2HG GLU 38 17.988 -13.384 13.248
283 HG3 GLU 38 3HG GLU 38 17.258 -11.940 12.550
284 H LEU 39 H LEU 39 17.243 -12.507 7.977
285 HA LEU 39 HA LEU 39 17.890 -14.907 6.777
286 HB2 LEU 39 2HB LEU 39 16.431 -12.919 5.967
287 HB3 LEU 39 3HB LEU 39 17.920 -12.359 5.209
288 HG LEU 39 HG LEU 39 16.482 -13.557 3.633
289 HD11 LEU 39 1HD1 LEU 39 18.226 -14.504 2.568
290 HD12 LEU 39 2HD1 LEU 39 18.691 -15.478 3.963
291 HD13 LEU 39 3HD1 LEU 39 19.152 -13.778 3.882
292 HD21 LEU 39 3HD2 LEU 39 15.980 -15.880 3.869
293 HD22 LEU 39 1HD2 LEU 39 15.460 -15.063 5.343
294 HD23 LEU 39 2HD2 LEU 39 16.955 -15.998 5.335
295 H GLY 40 H GLY 40 19.704 -11.842 6.547
296 HA2 GLY 40 2HA GLY 40 22.226 -12.566 6.929
297 HA3 GLY 40 3HA GLY 40 21.949 -13.259 5.338
298 H ALA 41 H ALA 41 22.933 -12.030 3.880
299 HA ALA 41 HA ALA 41 22.857 -9.109 4.206
300 HB1 ALA 41 1HB ALA 41 25.092 -9.863 4.042
301 HB2 ALA 41 2HB ALA 41 24.716 -10.906 2.670
302 HB3 ALA 41 3HB ALA 41 24.696 -9.154 2.476
303 H VAL 42 H VAL 42 22.413 -11.666 1.780
304 HA VAL 42 HA VAL 42 20.746 -9.785 0.237
305 HB VAL 42 HB VAL 42 22.903 -10.395 -0.891
306 HG11 VAL 42 1HG1 VAL 42 21.636 -13.128 -1.064
307 HG12 VAL 42 2HG1 VAL 42 23.137 -12.623 -1.841
308 HG13 VAL 42 3HG1 VAL 42 23.039 -12.708 -0.082
309 HG21 VAL 42 3HG2 VAL 42 21.687 -9.796 -2.655
310 HG22 VAL 42 1HG2 VAL 42 21.289 -11.498 -2.892
311 HG23 VAL 42 2HG2 VAL 42 20.222 -10.467 -1.939
312 H LEU 43 H LEU 43 18.792 -10.505 -0.503
313 HA LEU 43 HA LEU 43 17.728 -12.867 0.765
314 HB2 LEU 43 2HB LEU 43 16.320 -11.100 -1.216
315 HB3 LEU 43 3HB LEU 43 15.605 -12.138 0.016
316 HG LEU 43 HG LEU 43 17.001 -10.456 1.586
317 HD11 LEU 43 1HD1 LEU 43 16.652 -9.107 -1.015
318 HD12 LEU 43 2HD1 LEU 43 17.848 -8.843 0.254
319 HD13 LEU 43 3HD1 LEU 43 16.225 -8.172 0.418
320 HD21 LEU 43 3HD2 LEU 43 14.825 -10.674 2.200
321 HD22 LEU 43 1HD2 LEU 43 14.225 -10.505 0.550
322 HD23 LEU 43 2HD2 LEU 43 14.726 -9.077 1.457
323 HA PRO 44 HA PRO 44 18.111 -15.702 -2.566
324 HB2 PRO 44 2HB PRO 44 15.886 -17.216 -2.208
325 HB3 PRO 44 3HB PRO 44 17.288 -17.301 -1.136
326 HG2 PRO 44 2HG PRO 44 14.708 -15.830 -0.765
327 HG3 PRO 44 3HG PRO 44 15.628 -16.788 0.409
328 HD2 PRO 44 2HD PRO 44 15.722 -14.083 0.344
329 HD3 PRO 44 3HD PRO 44 17.109 -15.075 0.836
330 H HIS 45 H HIS 45 17.647 -15.706 -4.687
331 HA HIS 45 HA HIS 45 15.999 -13.861 -5.900
332 HB2 HIS 45 2HB HIS 45 16.170 -15.320 -7.938
333 HB3 HIS 45 3HB HIS 45 17.713 -14.948 -7.176
334 HD1 HIS 45 HD1 HIS 45 15.538 -17.747 -8.153
335 HD2 HIS 45 HD2 HIS 45 18.864 -17.157 -5.734
336 HE1 HIS 45 HE1 HIS 45 16.461 -20.043 -7.708
337 H GLY 46 H GLY 46 13.893 -13.666 -5.392
338 HA2 GLY 46 2HA GLY 46 11.730 -14.559 -6.296
339 HA3 GLY 46 3HA GLY 46 12.221 -16.095 -5.596
340 H THR 47 H THR 47 13.197 -13.554 -3.643
341 HA THR 47 HA THR 47 11.388 -14.282 -1.567
342 HB THR 47 HB THR 47 13.216 -11.875 -1.671
343 HG1 THR 47 HG1 THR 47 14.020 -14.255 -1.868
344 HG21 THR 47 3HG2 THR 47 13.150 -12.521 0.901
345 HG22 THR 47 1HG2 THR 47 11.572 -13.163 0.449
346 HG23 THR 47 2HG2 THR 47 11.940 -11.458 0.183
347 H ALA 48 H ALA 48 9.474 -13.444 -1.026
348 HA ALA 48 HA ALA 48 8.377 -11.306 -2.660
349 HB1 ALA 48 1HB ALA 48 6.252 -11.854 -1.503
350 HB2 ALA 48 2HB ALA 48 6.981 -13.232 -2.328
351 HB3 ALA 48 3HB ALA 48 7.116 -13.080 -0.576
352 H VAL 49 H VAL 49 8.949 -9.310 -2.042
353 HA VAL 49 HA VAL 49 8.705 -8.632 0.818
354 HB VAL 49 HB VAL 49 10.469 -7.224 -1.187
355 HG11 VAL 49 1HG1 VAL 49 10.583 -5.656 0.382
356 HG12 VAL 49 2HG1 VAL 49 9.607 -6.625 1.488
357 HG13 VAL 49 3HG1 VAL 49 11.358 -6.835 1.440
358 HG21 VAL 49 3HG2 VAL 49 12.192 -8.408 0.528
359 HG22 VAL 49 1HG2 VAL 49 10.923 -9.630 0.445
360 HG23 VAL 49 2HG2 VAL 49 11.725 -9.090 -1.030
361 H GLU 50 H GLU 50 7.655 -6.743 1.381
362 HA GLU 50 HA GLU 50 6.043 -5.537 -0.760
363 HB2 GLU 50 2HB GLU 50 4.708 -6.550 0.980
364 HB3 GLU 50 3HB GLU 50 5.593 -5.677 2.223
365 HG2 GLU 50 2HG GLU 50 4.646 -3.609 1.576
366 HG3 GLU 50 3HG GLU 50 3.983 -4.299 0.096
367 H LEU 51 H LEU 51 5.900 -3.319 -0.999
368 HA LEU 51 HA LEU 51 8.009 -1.789 0.365
369 HB2 LEU 51 2HB LEU 51 6.836 -1.703 -2.361
370 HB3 LEU 51 3HB LEU 51 7.384 -0.183 -1.656
371 HG LEU 51 HG LEU 51 9.631 -1.244 -1.335
372 HD11 LEU 51 1HD1 LEU 51 9.361 -3.525 -1.363
373 HD12 LEU 51 2HD1 LEU 51 9.933 -3.228 -3.005
374 HD13 LEU 51 3HD1 LEU 51 8.214 -3.483 -2.703
375 HD21 LEU 51 3HD2 LEU 51 9.901 -1.411 -4.008
376 HD22 LEU 51 1HD2 LEU 51 9.781 0.114 -3.129
377 HD23 LEU 51 2HD2 LEU 51 8.353 -0.570 -3.905
378 HA PRO 52 HA PRO 52 4.261 -0.020 2.267
379 HB2 PRO 52 2HB PRO 52 5.549 0.814 4.507
380 HB3 PRO 52 3HB PRO 52 4.965 -0.841 4.294
381 HG2 PRO 52 2HG PRO 52 7.726 0.257 3.927
382 HG3 PRO 52 3HG PRO 52 7.217 -1.254 4.704
383 HD2 PRO 52 2HD PRO 52 8.194 -1.172 2.181
384 HD3 PRO 52 3HD PRO 52 6.972 -2.353 2.693
385 H ASP 53 H ASP 53 3.832 2.193 3.078
386 HA ASP 53 HA ASP 53 3.836 4.448 2.783
387 HB2 ASP 53 2HB ASP 53 6.766 3.831 2.977
388 HB3 ASP 53 3HB ASP 53 6.234 5.472 2.621
389 H VAL 54 H VAL 54 3.498 2.823 0.476
390 HA VAL 54 HA VAL 54 4.653 4.579 -1.592
391 HB VAL 54 HB VAL 54 3.983 1.642 -1.821
392 HG11 VAL 54 1HG1 VAL 54 5.178 2.070 -4.111
393 HG12 VAL 54 2HG1 VAL 54 3.455 2.401 -3.928
394 HG13 VAL 54 3HG1 VAL 54 4.619 3.724 -3.861
395 HG21 VAL 54 3HG2 VAL 54 6.053 1.871 -0.698
396 HG22 VAL 54 1HG2 VAL 54 6.447 1.512 -2.379
397 HG23 VAL 54 2HG2 VAL 54 6.579 3.164 -1.776
398 H GLN 55 H GLN 55 3.313 5.296 -3.223
399 HA GLN 55 HA GLN 55 0.512 5.371 -2.600
400 HB2 GLN 55 2HB GLN 55 2.218 6.571 -4.761
401 HB3 GLN 55 3HB GLN 55 0.464 6.658 -4.847
402 HG2 GLN 55 2HG GLN 55 1.833 7.544 -2.358
403 HG3 GLN 55 3HG GLN 55 1.860 8.591 -3.776
404 HE21 GLN 55 1HE2 GLN 55 0.337 8.173 -0.994
405 HE22 GLN 55 2HE2 GLN 55 -1.250 8.724 -1.399
406 H THR 56 H THR 56 -1.160 4.908 -4.251
407 HA THR 56 HA THR 56 -0.704 2.269 -5.372
408 HB THR 56 HB THR 56 -2.787 2.842 -4.083
409 HG1 THR 56 HG1 THR 56 -4.164 1.789 -5.724
410 HG21 THR 56 3HG2 THR 56 -2.945 5.097 -5.427
411 HG22 THR 56 1HG2 THR 56 -4.405 4.266 -4.894
412 HG23 THR 56 2HG2 THR 56 -3.860 4.108 -6.564
413 H ALA 57 H ALA 57 0.034 5.177 -6.479
414 HA ALA 57 HA ALA 57 -1.111 4.979 -9.140
415 HB1 ALA 57 1HB ALA 57 0.996 6.957 -8.788
416 HB2 ALA 57 2HB ALA 57 -0.677 7.162 -9.311
417 HB3 ALA 57 3HB ALA 57 -0.292 7.100 -7.591
418 HA PRO 58 HA PRO 58 2.223 2.955 -11.149
419 HB2 PRO 58 2HB PRO 58 2.393 4.301 -13.501
420 HB3 PRO 58 3HB PRO 58 1.063 3.202 -13.117
421 HG2 PRO 58 2HG PRO 58 1.159 6.189 -12.951
422 HG3 PRO 58 3HG PRO 58 -0.134 5.144 -13.568
423 HD2 PRO 58 2HD PRO 58 -0.210 6.252 -11.099
424 HD3 PRO 58 3HD PRO 58 -0.929 4.669 -11.457
425 H VAL 59 H VAL 59 4.313 3.445 -12.454
426 HA VAL 59 HA VAL 59 5.621 5.901 -11.549
427 HB VAL 59 HB VAL 59 6.970 3.230 -11.195
428 HG11 VAL 59 1HG1 VAL 59 8.079 5.029 -9.451
429 HG12 VAL 59 2HG1 VAL 59 8.733 4.599 -11.033
430 HG13 VAL 59 3HG1 VAL 59 7.719 6.031 -10.856
431 HG21 VAL 59 3HG2 VAL 59 5.313 4.805 -9.245
432 HG22 VAL 59 1HG2 VAL 59 5.184 3.099 -9.672
433 HG23 VAL 59 2HG2 VAL 59 6.554 3.669 -8.719
434 H ALA 60 H ALA 60 7.507 6.458 -12.741
435 HA ALA 60 HA ALA 60 7.357 5.870 -15.494
436 HB1 ALA 60 1HB ALA 60 8.338 7.885 -15.298
437 HB2 ALA 60 2HB ALA 60 9.085 7.489 -13.750
438 HB3 ALA 60 3HB ALA 60 9.827 6.942 -15.253
439 H GLU 61 H GLU 61 8.783 4.174 -12.925
440 HA GLU 61 HA GLU 61 10.776 2.858 -14.591
441 HB2 GLU 61 2HB GLU 61 10.100 2.770 -11.665
442 HB3 GLU 61 3HB GLU 61 11.128 1.539 -12.386
443 HG2 GLU 61 2HG GLU 61 12.786 3.111 -12.956
444 HG3 GLU 61 3HG GLU 61 11.709 4.471 -12.643
445 H THR 62 H THR 62 7.623 2.289 -13.229
446 HA THR 62 HA THR 62 7.378 -0.134 -14.818
447 HB THR 62 HB THR 62 6.388 -1.400 -12.891
448 HG1 THR 62 HG1 THR 62 6.368 -0.525 -10.949
449 HG21 THR 62 3HG2 THR 62 8.643 -1.893 -13.660
450 HG22 THR 62 1HG2 THR 62 8.558 -2.029 -11.904
451 HG23 THR 62 2HG2 THR 62 9.293 -0.607 -12.644
452 H VAL 63 H VAL 63 5.376 -0.378 -15.639
453 HA VAL 63 HA VAL 63 3.240 1.341 -14.553
454 HB VAL 63 HB VAL 63 4.033 2.145 -16.742
455 HG11 VAL 63 1HG1 VAL 63 2.877 -0.176 -18.164
456 HG12 VAL 63 2HG1 VAL 63 4.233 0.866 -18.602
457 HG13 VAL 63 3HG1 VAL 63 4.451 -0.412 -17.406
458 HG21 VAL 63 3HG2 VAL 63 1.648 2.356 -16.011
459 HG22 VAL 63 1HG2 VAL 63 1.887 2.395 -17.758
460 HG23 VAL 63 2HG2 VAL 63 1.286 0.930 -16.982
461 H ASN 64 H ASN 64 4.104 -1.753 -15.951
462 HA ASN 64 HA ASN 64 1.629 -2.912 -16.331
463 HB2 ASN 64 2HB ASN 64 4.023 -3.851 -16.737
464 HB3 ASN 64 3HB ASN 64 3.873 -4.485 -15.101
465 HD21 ASN 64 1HD2 ASN 64 3.033 -4.870 -18.373
466 HD22 ASN 64 2HD2 ASN 64 2.038 -6.272 -18.196
467 H LEU 65 H LEU 65 0.473 -4.493 -15.005
468 HA LEU 65 HA LEU 65 0.673 -3.933 -12.122
469 HB2 LEU 65 2HB LEU 65 -1.953 -4.471 -13.452
470 HB3 LEU 65 3HB LEU 65 -1.631 -3.707 -11.896
471 HG LEU 65 HG LEU 65 -1.015 -2.431 -14.558
472 HD11 LEU 65 1HD1 LEU 65 -3.438 -2.222 -12.790
473 HD12 LEU 65 2HD1 LEU 65 -3.368 -2.659 -14.496
474 HD13 LEU 65 3HD1 LEU 65 -3.014 -1.005 -13.995
475 HD21 LEU 65 3HD2 LEU 65 0.272 -1.694 -12.532
476 HD22 LEU 65 1HD2 LEU 65 -1.262 -1.182 -11.829
477 HD23 LEU 65 2HD2 LEU 65 -0.679 -0.431 -13.315
478 H TRP 66 H TRP 66 1.019 -5.704 -10.971
479 HA TRP 66 HA TRP 66 0.127 -8.289 -12.069
480 HB2 TRP 66 2HB TRP 66 2.576 -7.583 -10.456
481 HB3 TRP 66 3HB TRP 66 2.008 -9.242 -10.628
482 HD1 TRP 66 HD1 TRP 66 1.379 -9.494 -13.623
483 HE1 TRP 66 HE1 TRP 66 3.214 -9.270 -15.414
484 HE3 TRP 66 HE3 TRP 66 4.835 -6.869 -10.921
485 HZ2 TRP 66 HZ2 TRP 66 5.786 -8.132 -15.650
486 HZ3 TRP 66 HZ3 TRP 66 6.957 -6.252 -12.003
487 HH2 TRP 66 HH2 TRP 66 7.421 -6.872 -14.319
488 H GLU 67 H GLU 67 0.149 -6.155 -9.343
489 HA GLU 67 HA GLU 67 -1.256 -8.169 -7.722
490 HB2 GLU 67 2HB GLU 67 -0.776 -6.529 -5.828
491 HB3 GLU 67 3HB GLU 67 0.599 -7.397 -6.494
492 HG2 GLU 67 2HG GLU 67 -0.086 -4.709 -7.575
493 HG3 GLU 67 3HG GLU 67 0.738 -4.836 -6.022
494 H VAL 68 H VAL 68 -3.303 -7.913 -8.621
495 HA VAL 68 HA VAL 68 -4.565 -5.286 -8.178
496 HB VAL 68 HB VAL 68 -6.275 -6.047 -9.859
497 HG11 VAL 68 1HG1 VAL 68 -4.562 -4.457 -10.474
498 HG12 VAL 68 2HG1 VAL 68 -3.418 -5.765 -10.784
499 HG13 VAL 68 3HG1 VAL 68 -4.840 -5.574 -11.811
500 HG21 VAL 68 3HG2 VAL 68 -4.581 -7.898 -11.241
501 HG22 VAL 68 1HG2 VAL 68 -4.890 -8.482 -9.605
502 HG23 VAL 68 2HG2 VAL 68 -6.239 -8.112 -10.679
503 H GLU 69 H GLU 69 -4.785 -8.736 -7.675
504 HA GLU 69 HA GLU 69 -6.179 -10.038 -6.427
505 HB2 GLU 69 2HB GLU 69 -5.154 -8.298 -4.763
506 HB3 GLU 69 3HB GLU 69 -6.789 -7.652 -4.720
507 HG2 GLU 69 2HG GLU 69 -7.665 -9.638 -3.818
508 HG3 GLU 69 3HG GLU 69 -6.199 -10.544 -4.189
509 H HIS 70 H HIS 70 -7.361 -8.641 -8.671
510 HA HIS 70 HA HIS 70 -10.102 -8.184 -7.712
511 HB2 HIS 70 2HB HIS 70 -8.690 -7.363 -10.250
512 HB3 HIS 70 3HB HIS 70 -10.434 -7.231 -10.049
513 HD1 HIS 70 HD1 HIS 70 -9.777 -6.382 -6.874
514 HD2 HIS 70 HD2 HIS 70 -8.712 -4.495 -10.419
515 HE1 HIS 70 HE1 HIS 70 -9.353 -3.981 -6.257
516 H HIS 71 H HIS 71 -11.826 -9.325 -8.542
517 HA HIS 71 HA HIS 71 -11.122 -11.833 -9.872
518 HB2 HIS 71 2HB HIS 71 -13.668 -10.977 -8.480
519 HB3 HIS 71 3HB HIS 71 -13.399 -12.561 -9.202
520 HD1 HIS 71 HD1 HIS 71 -11.102 -13.773 -8.129
521 HD2 HIS 71 HD2 HIS 71 -13.132 -10.963 -5.839
522 HE1 HIS 71 HE1 HIS 71 -10.390 -14.199 -5.755
Start of MODEL 16
1 H1 MET 1 H MET 1 1.091 -0.693 3.004
2 HA MET 1 HA MET 1 0.163 -1.893 0.620
3 HB2 MET 1 2HB MET 1 0.948 0.286 -0.305
4 HB3 MET 1 3HB MET 1 2.565 -0.092 0.274
5 HG2 MET 1 2HG MET 1 2.652 -0.698 -1.951
6 HG3 MET 1 3HG MET 1 2.340 -2.229 -1.135
7 HE1 MET 1 3HE MET 1 0.220 -3.194 -4.041
8 HE2 MET 1 1HE MET 1 1.605 -2.152 -4.367
9 HE3 MET 1 2HE MET 1 1.707 -3.387 -3.112
10 H LYS 2 H LYS 2 0.664 -3.888 1.290
11 HA LYS 2 HA LYS 2 3.492 -4.480 1.802
12 HB2 LYS 2 2HB LYS 2 1.290 -5.756 3.415
13 HB3 LYS 2 3HB LYS 2 3.023 -5.813 3.708
14 HG2 LYS 2 2HG LYS 2 2.692 -3.188 3.902
15 HG3 LYS 2 3HG LYS 2 1.057 -3.690 4.339
16 HD2 LYS 2 2HD LYS 2 3.489 -4.898 5.626
17 HD3 LYS 2 3HD LYS 2 2.750 -3.414 6.234
18 HE2 LYS 2 2HE LYS 2 1.030 -5.801 5.752
19 HE3 LYS 2 3HE LYS 2 2.055 -5.763 7.186
20 HZ1 LYS 2 3HZ LYS 2 0.058 -3.690 6.455
21 HZ2 LYS 2 1HZ LYS 2 1.014 -3.701 7.850
22 HZ3 LYS 2 2HZ LYS 2 -0.165 -4.891 7.624
23 H THR 3 H THR 3 4.135 -6.618 1.298
24 HA THR 3 HA THR 3 2.191 -8.364 0.010
25 HB THR 3 HB THR 3 2.839 -7.123 -1.904
26 HG1 THR 3 HG1 THR 3 3.240 -8.895 -2.982
27 HG21 THR 3 3HG2 THR 3 5.612 -7.415 -2.162
28 HG22 THR 3 1HG2 THR 3 5.347 -6.879 -0.504
29 HG23 THR 3 2HG2 THR 3 4.720 -5.927 -1.849
30 H PHE 4 H PHE 4 3.033 -10.511 -0.418
31 HA PHE 4 HA PHE 4 4.788 -11.387 1.672
32 HB2 PHE 4 2HB PHE 4 3.774 -13.070 -0.617
33 HB3 PHE 4 3HB PHE 4 4.244 -13.601 0.995
34 HD1 PHE 4 HD1 PHE 4 2.845 -12.001 2.837
35 HD2 PHE 4 HD2 PHE 4 1.536 -13.370 -0.974
36 HE1 PHE 4 HE1 PHE 4 0.507 -11.820 3.580
37 HE2 PHE 4 HE2 PHE 4 -0.805 -13.190 -0.238
38 HZ PHE 4 HZ PHE 4 -1.322 -12.414 2.041
39 H ALA 5 H ALA 5 6.863 -12.102 1.546
40 HA ALA 5 HA ALA 5 8.315 -11.430 -0.894
41 HB1 ALA 5 1HB ALA 5 9.110 -10.577 1.285
42 HB2 ALA 5 2HB ALA 5 9.405 -12.239 1.798
43 HB3 ALA 5 3HB ALA 5 10.314 -11.558 0.449
44 H LEU 6 H LEU 6 8.227 -13.043 -2.352
45 HA LEU 6 HA LEU 6 8.645 -15.800 -1.444
46 HB2 LEU 6 2HB LEU 6 7.969 -15.049 -4.256
47 HB3 LEU 6 3HB LEU 6 7.607 -16.535 -3.380
48 HG LEU 6 HG LEU 6 6.276 -13.884 -2.836
49 HD11 LEU 6 1HD1 LEU 6 4.781 -16.084 -4.109
50 HD12 LEU 6 2HD1 LEU 6 5.948 -15.243 -5.129
51 HD13 LEU 6 3HD1 LEU 6 4.657 -14.340 -4.338
52 HD21 LEU 6 3HD2 LEU 6 5.062 -14.922 -1.242
53 HD22 LEU 6 1HD2 LEU 6 6.460 -15.995 -1.179
54 HD23 LEU 6 2HD2 LEU 6 5.034 -16.458 -2.109
55 H GLN 7 H GLN 7 9.735 -17.067 -3.492
56 HA GLN 7 HA GLN 7 12.446 -16.583 -3.330
57 HB2 GLN 7 2HB GLN 7 10.742 -18.376 -4.735
58 HB3 GLN 7 3HB GLN 7 11.912 -17.740 -5.883
59 HG2 GLN 7 2HG GLN 7 13.740 -18.478 -4.512
60 HG3 GLN 7 3HG GLN 7 12.629 -18.982 -3.239
61 HE21 GLN 7 1HE2 GLN 7 13.988 -20.974 -3.649
62 HE22 GLN 7 2HE2 GLN 7 13.369 -22.105 -4.799
63 H GLY 8 H GLY 8 13.668 -14.972 -4.041
64 HA2 GLY 8 2HA GLY 8 14.532 -13.349 -5.425
65 HA3 GLY 8 3HA GLY 8 13.530 -13.998 -6.714
66 H ASP 9 H ASP 9 11.988 -13.052 -3.777
67 HA ASP 9 HA ASP 9 11.097 -10.547 -5.044
68 HB2 ASP 9 2HB ASP 9 9.488 -12.728 -3.768
69 HB3 ASP 9 3HB ASP 9 8.908 -11.066 -3.692
70 H THR 10 H THR 10 13.175 -11.163 -2.998
71 HA THR 10 HA THR 10 12.214 -10.291 -0.464
72 HB THR 10 HB THR 10 14.438 -10.342 0.283
73 HG1 THR 10 HG1 THR 10 15.281 -10.134 -2.435
74 HG21 THR 10 3HG2 THR 10 14.553 -12.280 -2.017
75 HG22 THR 10 1HG2 THR 10 13.508 -12.535 -0.620
76 HG23 THR 10 2HG2 THR 10 15.257 -12.447 -0.409
77 H LEU 11 H LEU 11 13.528 -8.341 0.565
78 HA LEU 11 HA LEU 11 12.442 -5.993 -0.364
79 HB2 LEU 11 2HB LEU 11 15.076 -6.165 1.081
80 HB3 LEU 11 3HB LEU 11 13.925 -4.830 1.102
81 HG LEU 11 HG LEU 11 13.564 -7.544 2.371
82 HD11 LEU 11 1HD1 LEU 11 14.900 -6.427 3.852
83 HD12 LEU 11 2HD1 LEU 11 13.313 -5.879 4.390
84 HD13 LEU 11 3HD1 LEU 11 14.304 -4.839 3.367
85 HD21 LEU 11 3HD2 LEU 11 11.620 -5.647 1.471
86 HD22 LEU 11 1HD2 LEU 11 11.601 -5.722 3.233
87 HD23 LEU 11 2HD2 LEU 11 11.376 -7.193 2.286
88 H ASP 12 H ASP 12 15.686 -7.279 -1.014
89 HA ASP 12 HA ASP 12 16.708 -5.169 -2.495
90 HB2 ASP 12 2HB ASP 12 17.194 -8.139 -2.631
91 HB3 ASP 12 3HB ASP 12 18.060 -7.012 -3.672
92 H ALA 13 H ALA 13 14.441 -7.663 -3.416
93 HA ALA 13 HA ALA 13 14.543 -6.935 -6.225
94 HB1 ALA 13 1HB ALA 13 12.924 -8.704 -6.558
95 HB2 ALA 13 2HB ALA 13 14.255 -9.286 -5.556
96 HB3 ALA 13 3HB ALA 13 12.709 -8.869 -4.815
97 H ILE 14 H ILE 14 11.976 -7.067 -3.745
98 HA ILE 14 HA ILE 14 9.985 -5.759 -5.116
99 HB ILE 14 HB ILE 14 10.608 -5.586 -2.167
100 HG12 ILE 14 2HG1 ILE 14 8.560 -7.288 -3.591
101 HG13 ILE 14 3HG1 ILE 14 10.175 -7.860 -3.190
102 HG21 ILE 14 1HG2 ILE 14 8.114 -4.822 -3.676
103 HG22 ILE 14 2HG2 ILE 14 8.219 -4.971 -1.923
104 HG23 ILE 14 3HG2 ILE 14 9.174 -3.749 -2.763
105 HD11 ILE 14 3HD1 ILE 14 8.580 -8.612 -1.546
106 HD12 ILE 14 1HD1 ILE 14 9.703 -7.464 -0.816
107 HD13 ILE 14 2HD1 ILE 14 8.070 -6.951 -1.243
108 H CYS 15 H CYS 15 12.615 -4.333 -3.219
109 HA CYS 15 HA CYS 15 11.848 -1.676 -3.267
110 HB2 CYS 15 2HB CYS 15 14.514 -3.044 -3.194
111 HB3 CYS 15 3HB CYS 15 14.442 -1.292 -3.344
112 HG CYS 15 HG CYS 15 12.570 -1.422 -0.963
113 H VAL 16 H VAL 16 13.308 -3.621 -5.787
114 HA VAL 16 HA VAL 16 13.738 -1.341 -7.525
115 HB VAL 16 HB VAL 16 14.023 -4.293 -8.103
116 HG11 VAL 16 1HG1 VAL 16 13.863 -3.405 -10.208
117 HG12 VAL 16 2HG1 VAL 16 14.499 -1.835 -9.714
118 HG13 VAL 16 3HG1 VAL 16 15.590 -3.206 -9.916
119 HG21 VAL 16 3HG2 VAL 16 16.519 -3.000 -8.065
120 HG22 VAL 16 1HG2 VAL 16 15.662 -2.474 -6.616
121 HG23 VAL 16 2HG2 VAL 16 15.903 -4.194 -6.923
122 H ARG 17 H ARG 17 11.262 -3.630 -6.875
123 HA ARG 17 HA ARG 17 9.957 -3.310 -9.443
124 HB2 ARG 17 2HB ARG 17 8.999 -4.687 -6.927
125 HB3 ARG 17 3HB ARG 17 8.228 -4.776 -8.505
126 HG2 ARG 17 2HG ARG 17 10.484 -5.709 -9.318
127 HG3 ARG 17 3HG ARG 17 10.814 -5.977 -7.605
128 HD2 ARG 17 2HD ARG 17 9.749 -7.922 -7.846
129 HD3 ARG 17 3HD ARG 17 8.265 -6.974 -7.926
130 HE ARG 17 HE ARG 17 9.584 -7.254 -10.461
131 HH11 ARG 17 1HH1 ARG 17 7.361 -8.721 -8.220
132 HH12 ARG 17 2HH1 ARG 17 6.553 -9.658 -9.433
133 HH21 ARG 17 1HH2 ARG 17 8.529 -8.483 -12.067
134 HH22 ARG 17 2HH2 ARG 17 7.218 -9.522 -11.621
135 H TYR 18 H TYR 18 9.972 -1.772 -6.388
136 HA TYR 18 HA TYR 18 7.430 -0.414 -6.978
137 HB2 TYR 18 2HB TYR 18 8.918 -0.927 -4.419
138 HB3 TYR 18 3HB TYR 18 7.732 0.370 -4.522
139 HD1 TYR 18 HD2 TYR 18 7.929 -3.212 -5.599
140 HD2 TYR 18 HD1 TYR 18 5.669 -0.169 -3.665
141 HE1 TYR 18 HE2 TYR 18 6.129 -4.832 -5.166
142 HE2 TYR 18 HE1 TYR 18 3.864 -1.781 -3.225
143 HH TYR 18 HH TYR 18 4.019 -5.094 -4.459
144 H TYR 19 H TYR 19 10.537 0.384 -5.413
145 HA TYR 19 HA TYR 19 10.281 3.145 -6.255
146 HB2 TYR 19 2HB TYR 19 12.651 1.920 -4.853
147 HB3 TYR 19 3HB TYR 19 12.134 3.602 -4.847
148 HD1 TYR 19 HD1 TYR 19 10.215 4.308 -3.485
149 HD2 TYR 19 HD2 TYR 19 11.652 0.304 -3.376
150 HE1 TYR 19 HE1 TYR 19 8.955 3.918 -1.408
151 HE2 TYR 19 HE2 TYR 19 10.395 -0.096 -1.300
152 HH TYR 19 HH TYR 19 9.463 1.226 0.571
153 H GLY 20 H GLY 20 12.232 0.318 -7.022
154 HA2 GLY 20 2HA GLY 20 13.186 -0.074 -9.147
155 HA3 GLY 20 3HA GLY 20 13.098 1.650 -9.478
156 H ARG 21 H ARG 21 14.339 0.857 -6.405
157 HA ARG 21 HA ARG 21 17.072 0.503 -7.149
158 HB2 ARG 21 2HB ARG 21 17.980 2.605 -6.586
159 HB3 ARG 21 3HB ARG 21 16.607 2.964 -7.624
160 HG2 ARG 21 2HG ARG 21 16.477 3.033 -4.621
161 HG3 ARG 21 3HG ARG 21 16.851 4.439 -5.620
162 HD2 ARG 21 2HD ARG 21 14.314 2.815 -5.614
163 HD3 ARG 21 3HD ARG 21 14.515 4.488 -5.095
164 HE ARG 21 HE ARG 21 14.096 3.566 -7.753
165 HH11 ARG 21 1HH1 ARG 21 15.712 6.014 -5.878
166 HH12 ARG 21 2HH1 ARG 21 15.721 7.177 -7.163
167 HH21 ARG 21 1HH2 ARG 21 14.101 5.089 -9.452
168 HH22 ARG 21 2HH2 ARG 21 14.804 6.650 -9.195
169 H THR 22 H THR 22 18.525 0.715 -5.176
170 HA THR 22 HA THR 22 17.020 -0.071 -2.765
171 HB THR 22 HB THR 22 19.220 -1.339 -2.209
172 HG1 THR 22 HG1 THR 22 19.392 -1.210 -5.053
173 HG21 THR 22 3HG2 THR 22 18.242 -3.056 -4.183
174 HG22 THR 22 1HG2 THR 22 16.863 -2.064 -3.711
175 HG23 THR 22 2HG2 THR 22 17.743 -2.987 -2.493
176 H GLU 23 H GLU 23 19.680 1.757 -4.095
177 HA GLU 23 HA GLU 23 20.990 2.481 -1.731
178 HB2 GLU 23 2HB GLU 23 21.808 4.443 -3.029
179 HB3 GLU 23 3HB GLU 23 22.015 2.910 -3.865
180 HG2 GLU 23 2HG GLU 23 19.811 3.458 -5.034
181 HG3 GLU 23 3HG GLU 23 20.046 5.095 -4.424
182 H GLY 24 H GLY 24 20.106 3.416 -0.012
183 HA2 GLY 24 2HA GLY 24 19.147 5.153 1.202
184 HA3 GLY 24 3HA GLY 24 18.667 5.908 -0.310
185 H VAL 25 H VAL 25 17.657 2.845 -0.646
186 HA VAL 25 HA VAL 25 14.972 3.506 0.355
187 HB VAL 25 HB VAL 25 15.747 1.452 -1.720
188 HG11 VAL 25 1HG1 VAL 25 13.013 2.384 -1.758
189 HG12 VAL 25 2HG1 VAL 25 13.640 0.736 -1.681
190 HG13 VAL 25 3HG1 VAL 25 13.427 1.671 -0.200
191 HG21 VAL 25 3HG2 VAL 25 16.200 3.538 -2.703
192 HG22 VAL 25 1HG2 VAL 25 14.582 3.115 -3.263
193 HG23 VAL 25 2HG2 VAL 25 14.786 4.289 -1.963
194 H VAL 26 H VAL 26 17.191 0.739 0.018
195 HA VAL 26 HA VAL 26 15.795 -1.146 1.469
196 HB VAL 26 HB VAL 26 17.975 -2.191 1.988
197 HG11 VAL 26 1HG1 VAL 26 17.430 -1.187 -0.785
198 HG12 VAL 26 2HG1 VAL 26 18.784 -2.268 -0.448
199 HG13 VAL 26 3HG1 VAL 26 17.133 -2.787 -0.106
200 HG21 VAL 26 3HG2 VAL 26 19.040 0.417 0.932
201 HG22 VAL 26 1HG2 VAL 26 19.375 -0.356 2.482
202 HG23 VAL 26 2HG2 VAL 26 20.012 -1.053 0.992
203 H GLU 27 H GLU 27 17.797 1.500 2.637
204 HA GLU 27 HA GLU 27 18.030 0.741 5.315
205 HB2 GLU 27 2HB GLU 27 18.880 2.865 3.829
206 HB3 GLU 27 3HB GLU 27 17.658 3.623 4.840
207 HG2 GLU 27 2HG GLU 27 18.912 2.339 6.756
208 HG3 GLU 27 3HG GLU 27 20.243 2.371 5.602
209 H THR 28 H THR 28 15.493 2.573 3.661
210 HA THR 28 HA THR 28 13.977 3.249 5.923
211 HB THR 28 HB THR 28 12.529 2.654 3.395
212 HG1 THR 28 HG1 THR 28 14.413 4.783 3.632
213 HG21 THR 28 3HG2 THR 28 11.083 4.051 4.350
214 HG22 THR 28 1HG2 THR 28 12.289 5.336 4.312
215 HG23 THR 28 2HG2 THR 28 12.184 4.266 5.710
216 H VAL 29 H VAL 29 13.709 0.476 3.711
217 HA VAL 29 HA VAL 29 11.496 -0.733 4.943
218 HB VAL 29 HB VAL 29 13.724 -2.183 3.513
219 HG11 VAL 29 1HG1 VAL 29 11.812 -3.681 2.851
220 HG12 VAL 29 2HG1 VAL 29 12.253 -3.725 4.559
221 HG13 VAL 29 3HG1 VAL 29 10.830 -2.823 4.037
222 HG21 VAL 29 3HG2 VAL 29 12.177 -1.876 1.505
223 HG22 VAL 29 1HG2 VAL 29 11.411 -0.594 2.443
224 HG23 VAL 29 2HG2 VAL 29 13.118 -0.476 2.018
225 H LEU 30 H LEU 30 14.870 -0.697 5.770
226 HA LEU 30 HA LEU 30 14.870 -2.977 7.464
227 HB2 LEU 30 2HB LEU 30 16.692 -0.782 6.802
228 HB3 LEU 30 3HB LEU 30 16.852 -1.377 8.453
229 HG LEU 30 HG LEU 30 18.452 -2.476 7.017
230 HD11 LEU 30 1HD1 LEU 30 16.248 -4.429 7.641
231 HD12 LEU 30 2HD1 LEU 30 17.318 -3.736 8.860
232 HD13 LEU 30 3HD1 LEU 30 17.983 -4.741 7.573
233 HD21 LEU 30 3HD2 LEU 30 17.607 -2.379 4.859
234 HD22 LEU 30 1HD2 LEU 30 16.038 -3.029 5.335
235 HD23 LEU 30 2HD2 LEU 30 17.446 -4.089 5.264
236 H ALA 31 H ALA 31 14.529 0.503 8.084
237 HA ALA 31 HA ALA 31 14.257 0.248 10.897
238 HB1 ALA 31 1HB ALA 31 14.941 2.345 9.930
239 HB2 ALA 31 2HB ALA 31 13.425 2.470 9.037
240 HB3 ALA 31 3HB ALA 31 13.423 2.576 10.798
241 H ALA 32 H ALA 32 12.006 0.111 8.224
242 HA ALA 32 HA ALA 32 9.672 0.238 9.923
243 HB1 ALA 32 1HB ALA 32 8.405 -0.105 7.872
244 HB2 ALA 32 2HB ALA 32 9.610 1.166 7.659
245 HB3 ALA 32 3HB ALA 32 9.898 -0.441 6.993
246 H ASN 33 H ASN 33 11.752 -2.195 8.611
247 HA ASN 33 HA ASN 33 10.026 -4.261 9.797
248 HB2 ASN 33 2HB ASN 33 11.531 -4.448 7.178
249 HB3 ASN 33 3HB ASN 33 10.733 -5.803 7.972
250 HD21 ASN 33 1HD2 ASN 33 10.373 -3.118 5.928
251 HD22 ASN 33 2HD2 ASN 33 8.663 -3.220 5.701
252 HA PRO 34 HA PRO 34 14.306 -4.408 11.580
253 HB2 PRO 34 2HB PRO 34 13.473 -4.694 14.148
254 HB3 PRO 34 3HB PRO 34 13.674 -3.118 13.374
255 HG2 PRO 34 2HG PRO 34 11.177 -4.711 13.807
256 HG3 PRO 34 3HG PRO 34 11.445 -2.971 14.019
257 HD2 PRO 34 2HD PRO 34 10.235 -4.002 11.827
258 HD3 PRO 34 3HD PRO 34 11.235 -2.536 11.766
259 H GLY 35 H GLY 35 15.410 -6.253 12.050
260 HA2 GLY 35 2HA GLY 35 15.620 -8.441 12.976
261 HA3 GLY 35 3HA GLY 35 13.883 -8.647 12.803
262 H LEU 36 H LEU 36 14.251 -7.404 10.007
263 HA LEU 36 HA LEU 36 14.392 -9.890 8.620
264 HB2 LEU 36 2HB LEU 36 13.318 -7.421 8.104
265 HB3 LEU 36 3HB LEU 36 14.693 -7.474 7.002
266 HG LEU 36 HG LEU 36 12.602 -8.199 5.937
267 HD11 LEU 36 1HD1 LEU 36 13.657 -9.735 4.673
268 HD12 LEU 36 2HD1 LEU 36 14.111 -10.725 6.059
269 HD13 LEU 36 3HD1 LEU 36 15.049 -9.287 5.658
270 HD21 LEU 36 3HD2 LEU 36 11.154 -9.443 7.067
271 HD22 LEU 36 1HD2 LEU 36 12.323 -9.687 8.365
272 HD23 LEU 36 2HD2 LEU 36 12.291 -10.790 6.989
273 H ALA 37 H ALA 37 16.699 -7.507 9.509
274 HA ALA 37 HA ALA 37 18.617 -8.024 7.464
275 HB1 ALA 37 1HB ALA 37 19.812 -7.077 9.904
276 HB2 ALA 37 2HB ALA 37 19.634 -6.260 8.351
277 HB3 ALA 37 3HB ALA 37 18.337 -6.181 9.543
278 H GLU 38 H GLU 38 17.547 -9.863 10.046
279 HA GLU 38 HA GLU 38 20.097 -11.161 10.566
280 HB2 GLU 38 2HB GLU 38 17.336 -11.418 11.719
281 HB3 GLU 38 3HB GLU 38 18.555 -12.645 12.031
282 HG2 GLU 38 2HG GLU 38 19.932 -11.144 13.188
283 HG3 GLU 38 3HG GLU 38 19.060 -9.741 12.573
284 H LEU 39 H LEU 39 17.116 -11.725 8.830
285 HA LEU 39 HA LEU 39 17.223 -14.450 8.392
286 HB2 LEU 39 2HB LEU 39 15.771 -12.281 7.394
287 HB3 LEU 39 3HB LEU 39 16.472 -13.062 5.978
288 HG LEU 39 HG LEU 39 15.396 -15.153 6.556
289 HD11 LEU 39 1HD1 LEU 39 15.087 -13.854 9.124
290 HD12 LEU 39 2HD1 LEU 39 14.987 -15.563 8.702
291 HD13 LEU 39 3HD1 LEU 39 13.566 -14.531 8.540
292 HD21 LEU 39 3HD2 LEU 39 14.084 -13.739 5.177
293 HD22 LEU 39 1HD2 LEU 39 13.601 -12.736 6.545
294 HD23 LEU 39 2HD2 LEU 39 13.000 -14.389 6.408
295 H GLY 40 H GLY 40 18.668 -11.887 6.373
296 HA2 GLY 40 2HA GLY 40 20.678 -11.952 5.208
297 HA3 GLY 40 3HA GLY 40 20.891 -13.618 5.723
298 H ALA 41 H ALA 41 20.009 -15.295 4.489
299 HA ALA 41 HA ALA 41 20.024 -14.928 1.718
300 HB1 ALA 41 1HB ALA 41 19.301 -17.217 1.549
301 HB2 ALA 41 2HB ALA 41 20.462 -17.075 2.870
302 HB3 ALA 41 3HB ALA 41 18.738 -17.203 3.220
303 H VAL 42 H VAL 42 17.937 -16.151 0.558
304 HA VAL 42 HA VAL 42 16.030 -14.169 0.244
305 HB VAL 42 HB VAL 42 16.430 -16.077 -1.327
306 HG11 VAL 42 1HG1 VAL 42 14.433 -17.747 0.053
307 HG12 VAL 42 2HG1 VAL 42 15.862 -18.213 -0.872
308 HG13 VAL 42 3HG1 VAL 42 16.028 -17.683 0.802
309 HG21 VAL 42 3HG2 VAL 42 13.560 -15.619 -0.512
310 HG22 VAL 42 1HG2 VAL 42 14.510 -14.585 -1.579
311 HG23 VAL 42 2HG2 VAL 42 14.108 -16.229 -2.074
312 H LEU 43 H LEU 43 13.874 -13.942 0.917
313 HA LEU 43 HA LEU 43 13.401 -14.796 3.633
314 HB2 LEU 43 2HB LEU 43 11.340 -13.372 2.026
315 HB3 LEU 43 3HB LEU 43 11.765 -13.190 3.727
316 HG LEU 43 HG LEU 43 13.352 -12.140 1.384
317 HD11 LEU 43 1HD1 LEU 43 12.644 -9.986 2.840
318 HD12 LEU 43 2HD1 LEU 43 11.231 -11.011 3.086
319 HD13 LEU 43 3HD1 LEU 43 11.732 -10.579 1.451
320 HD21 LEU 43 3HD2 LEU 43 13.794 -11.940 4.359
321 HD22 LEU 43 1HD2 LEU 43 14.638 -10.962 3.158
322 HD23 LEU 43 2HD2 LEU 43 14.844 -12.714 3.171
323 HA PRO 44 HA PRO 44 10.780 -18.234 2.867
324 HB2 PRO 44 2HB PRO 44 9.035 -18.037 4.937
325 HB3 PRO 44 3HB PRO 44 10.717 -18.541 5.143
326 HG2 PRO 44 2HG PRO 44 9.475 -15.856 5.602
327 HG3 PRO 44 3HG PRO 44 10.657 -16.727 6.597
328 HD2 PRO 44 2HD PRO 44 11.361 -14.729 4.910
329 HD3 PRO 44 3HD PRO 44 12.428 -16.105 5.259
330 H HIS 45 H HIS 45 9.397 -18.302 1.214
331 HA HIS 45 HA HIS 45 7.686 -16.308 0.368
332 HB2 HIS 45 2HB HIS 45 6.520 -18.078 -0.927
333 HB3 HIS 45 3HB HIS 45 8.273 -18.169 -1.071
334 HD1 HIS 45 HD1 HIS 45 5.340 -20.140 -0.156
335 HD2 HIS 45 HD2 HIS 45 9.435 -20.310 0.524
336 HE1 HIS 45 HE1 HIS 45 5.795 -22.486 0.628
337 H GLY 46 H GLY 46 5.978 -15.419 1.311
338 HA2 GLY 46 2HA GLY 46 3.616 -15.977 1.958
339 HA3 GLY 46 3HA GLY 46 4.335 -17.110 3.093
340 H THR 47 H THR 47 6.492 -14.815 3.299
341 HA THR 47 HA THR 47 5.224 -13.599 5.617
342 HB THR 47 HB THR 47 8.064 -13.424 4.595
343 HG1 THR 47 HG1 THR 47 7.253 -14.627 7.013
344 HG21 THR 47 3HG2 THR 47 6.629 -11.953 6.705
345 HG22 THR 47 1HG2 THR 47 8.096 -11.529 5.825
346 HG23 THR 47 2HG2 THR 47 8.177 -12.645 7.188
347 H ALA 48 H ALA 48 4.150 -11.754 5.431
348 HA ALA 48 HA ALA 48 4.388 -10.074 3.123
349 HB1 ALA 48 1HB ALA 48 2.977 -8.971 5.445
350 HB2 ALA 48 2HB ALA 48 2.431 -9.195 3.782
351 HB3 ALA 48 3HB ALA 48 2.396 -10.549 4.912
352 H VAL 49 H VAL 49 5.170 -7.970 3.000
353 HA VAL 49 HA VAL 49 6.786 -7.044 5.280
354 HB VAL 49 HB VAL 49 7.639 -6.821 2.392
355 HG11 VAL 49 1HG1 VAL 49 8.481 -5.523 4.788
356 HG12 VAL 49 2HG1 VAL 49 9.786 -6.559 4.208
357 HG13 VAL 49 3HG1 VAL 49 9.098 -5.329 3.147
358 HG21 VAL 49 3HG2 VAL 49 8.381 -8.811 4.519
359 HG22 VAL 49 1HG2 VAL 49 7.809 -9.116 2.879
360 HG23 VAL 49 2HG2 VAL 49 9.429 -8.472 3.142
361 H GLU 50 H GLU 50 6.649 -4.915 5.751
362 HA GLU 50 HA GLU 50 4.617 -3.374 4.410
363 HB2 GLU 50 2HB GLU 50 4.699 -3.201 6.794
364 HB3 GLU 50 3HB GLU 50 6.411 -2.801 6.767
365 HG2 GLU 50 2HG GLU 50 6.042 -0.635 6.127
366 HG3 GLU 50 3HG GLU 50 4.500 -1.010 5.359
367 H LEU 51 H LEU 51 4.875 -1.642 3.093
368 HA LEU 51 HA LEU 51 7.640 -0.947 2.347
369 HB2 LEU 51 2HB LEU 51 5.133 -0.952 0.675
370 HB3 LEU 51 3HB LEU 51 6.685 -0.311 0.139
371 HG LEU 51 HG LEU 51 6.629 -3.130 1.060
372 HD11 LEU 51 1HD1 LEU 51 5.123 -3.859 -0.390
373 HD12 LEU 51 2HD1 LEU 51 6.018 -3.111 -1.712
374 HD13 LEU 51 3HD1 LEU 51 4.770 -2.197 -0.864
375 HD21 LEU 51 3HD2 LEU 51 8.632 -1.797 0.195
376 HD22 LEU 51 1HD2 LEU 51 7.889 -1.952 -1.396
377 HD23 LEU 51 2HD2 LEU 51 8.355 -3.396 -0.498
378 HA PRO 52 HA PRO 52 6.048 2.910 4.183
379 HB2 PRO 52 2HB PRO 52 8.508 3.841 4.858
380 HB3 PRO 52 3HB PRO 52 7.607 2.695 5.857
381 HG2 PRO 52 2HG PRO 52 9.820 2.177 3.909
382 HG3 PRO 52 3HG PRO 52 9.567 1.488 5.524
383 HD2 PRO 52 2HD PRO 52 8.935 0.153 3.255
384 HD3 PRO 52 3HD PRO 52 8.023 -0.045 4.765
385 H ASP 53 H ASP 53 6.109 5.037 3.441
386 HA ASP 53 HA ASP 53 6.346 6.731 1.942
387 HB2 ASP 53 2HB ASP 53 8.865 6.055 2.525
388 HB3 ASP 53 3HB ASP 53 8.868 5.619 0.818
389 H VAL 54 H VAL 54 4.748 4.647 1.150
390 HA VAL 54 HA VAL 54 5.210 4.623 -1.756
391 HB VAL 54 HB VAL 54 4.182 2.295 -0.126
392 HG11 VAL 54 1HG1 VAL 54 4.180 1.091 -2.284
393 HG12 VAL 54 2HG1 VAL 54 3.023 2.423 -2.243
394 HG13 VAL 54 3HG1 VAL 54 4.552 2.607 -3.103
395 HG21 VAL 54 3HG2 VAL 54 6.241 1.200 -1.204
396 HG22 VAL 54 1HG2 VAL 54 6.791 2.850 -1.498
397 HG23 VAL 54 2HG2 VAL 54 6.501 2.298 0.152
398 H GLN 55 H GLN 55 3.403 4.848 -3.039
399 HA GLN 55 HA GLN 55 0.872 5.361 -1.621
400 HB2 GLN 55 2HB GLN 55 2.137 7.361 -2.647
401 HB3 GLN 55 3HB GLN 55 1.635 6.705 -4.200
402 HG2 GLN 55 2HG GLN 55 0.026 8.308 -3.691
403 HG3 GLN 55 3HG GLN 55 -0.735 6.773 -3.277
404 HE21 GLN 55 1HE2 GLN 55 -1.416 6.439 -1.246
405 HE22 GLN 55 2HE2 GLN 55 -1.207 7.553 0.057
406 H THR 56 H THR 56 -0.793 4.145 -2.216
407 HA THR 56 HA THR 56 -0.613 2.045 -4.027
408 HB THR 56 HB THR 56 -3.279 3.293 -3.477
409 HG1 THR 56 HG1 THR 56 -1.482 2.208 -1.592
410 HG21 THR 56 3HG2 THR 56 -3.472 0.661 -2.889
411 HG22 THR 56 1HG2 THR 56 -2.173 0.626 -4.081
412 HG23 THR 56 2HG2 THR 56 -3.735 1.328 -4.501
413 H ALA 57 H ALA 57 -1.530 1.692 -6.087
414 HA ALA 57 HA ALA 57 -2.019 2.193 -8.253
415 HB1 ALA 57 1HB ALA 57 -3.825 3.485 -8.528
416 HB2 ALA 57 2HB ALA 57 -3.792 3.652 -6.772
417 HB3 ALA 57 3HB ALA 57 -3.051 4.888 -7.789
418 HA PRO 58 HA PRO 58 1.277 4.571 -9.904
419 HB2 PRO 58 2HB PRO 58 0.278 5.372 -12.298
420 HB3 PRO 58 3HB PRO 58 0.747 3.701 -11.964
421 HG2 PRO 58 2HG PRO 58 -1.975 4.947 -11.935
422 HG3 PRO 58 3HG PRO 58 -1.467 3.382 -12.597
423 HD2 PRO 58 2HD PRO 58 -2.698 3.618 -10.197
424 HD3 PRO 58 3HD PRO 58 -1.494 2.358 -10.532
425 H VAL 59 H VAL 59 1.847 6.736 -10.870
426 HA VAL 59 HA VAL 59 0.091 8.835 -9.772
427 HB VAL 59 HB VAL 59 3.096 8.993 -10.022
428 HG11 VAL 59 1HG1 VAL 59 2.288 11.175 -10.023
429 HG12 VAL 59 2HG1 VAL 59 0.981 10.796 -8.900
430 HG13 VAL 59 3HG1 VAL 59 2.646 10.877 -8.323
431 HG21 VAL 59 3HG2 VAL 59 3.019 8.819 -7.499
432 HG22 VAL 59 1HG2 VAL 59 1.362 8.244 -7.680
433 HG23 VAL 59 2HG2 VAL 59 2.694 7.330 -8.386
434 H ALA 60 H ALA 60 -0.257 10.670 -10.976
435 HA ALA 60 HA ALA 60 -0.018 10.424 -13.798
436 HB1 ALA 60 1HB ALA 60 -1.801 11.736 -13.528
437 HB2 ALA 60 2HB ALA 60 -1.292 12.239 -11.916
438 HB3 ALA 60 3HB ALA 60 -0.654 13.063 -13.339
439 H GLU 61 H GLU 61 2.248 10.208 -14.136
440 HA GLU 61 HA GLU 61 3.614 12.793 -14.255
441 HB2 GLU 61 2HB GLU 61 4.647 10.312 -12.907
442 HB3 GLU 61 3HB GLU 61 5.748 11.518 -13.560
443 HG2 GLU 61 2HG GLU 61 4.556 13.217 -12.143
444 HG3 GLU 61 3HG GLU 61 3.723 11.870 -11.370
445 H THR 62 H THR 62 5.685 12.585 -15.579
446 HA THR 62 HA THR 62 5.167 10.777 -17.848
447 HB THR 62 HB THR 62 4.984 13.278 -18.260
448 HG1 THR 62 HG1 THR 62 5.589 12.856 -20.268
449 HG21 THR 62 3HG2 THR 62 6.884 14.631 -18.314
450 HG22 THR 62 1HG2 THR 62 7.984 13.254 -18.296
451 HG23 THR 62 2HG2 THR 62 7.100 13.695 -16.835
452 H VAL 63 H VAL 63 7.225 11.317 -15.292
453 HA VAL 63 HA VAL 63 9.604 10.321 -16.682
454 HB VAL 63 HB VAL 63 9.372 11.188 -13.799
455 HG11 VAL 63 1HG1 VAL 63 11.428 9.906 -15.282
456 HG12 VAL 63 2HG1 VAL 63 11.961 11.545 -14.899
457 HG13 VAL 63 3HG1 VAL 63 11.457 10.455 -13.607
458 HG21 VAL 63 3HG2 VAL 63 8.830 13.109 -15.066
459 HG22 VAL 63 1HG2 VAL 63 10.536 13.270 -14.650
460 HG23 VAL 63 2HG2 VAL 63 10.069 12.756 -16.271
461 H ASN 64 H ASN 64 8.480 8.222 -16.974
462 HA ASN 64 HA ASN 64 9.391 6.338 -15.061
463 HB2 ASN 64 2HB ASN 64 7.458 6.978 -13.777
464 HB3 ASN 64 3HB ASN 64 6.414 6.847 -15.190
465 HD21 ASN 64 1HD2 ASN 64 8.490 4.992 -13.030
466 HD22 ASN 64 2HD2 ASN 64 7.633 3.501 -13.195
467 H LEU 65 H LEU 65 9.399 4.249 -15.866
468 HA LEU 65 HA LEU 65 7.851 3.359 -18.049
469 HB2 LEU 65 2HB LEU 65 9.531 3.298 -19.794
470 HB3 LEU 65 3HB LEU 65 9.210 4.957 -19.293
471 HG LEU 65 HG LEU 65 11.339 4.499 -17.766
472 HD11 LEU 65 1HD1 LEU 65 11.277 2.125 -19.048
473 HD12 LEU 65 2HD1 LEU 65 12.745 2.871 -18.418
474 HD13 LEU 65 3HD1 LEU 65 12.330 3.046 -20.123
475 HD21 LEU 65 3HD2 LEU 65 12.254 6.059 -19.072
476 HD22 LEU 65 1HD2 LEU 65 10.781 5.952 -20.036
477 HD23 LEU 65 2HD2 LEU 65 12.205 5.018 -20.496
478 H TRP 66 H TRP 66 8.019 1.179 -18.294
479 HA TRP 66 HA TRP 66 9.621 -0.229 -16.356
480 HB2 TRP 66 2HB TRP 66 7.756 -1.284 -18.494
481 HB3 TRP 66 3HB TRP 66 8.468 -2.238 -17.196
482 HD1 TRP 66 HD1 TRP 66 7.864 -0.878 -14.622
483 HE1 TRP 66 HE1 TRP 66 5.487 -0.287 -13.832
484 HE3 TRP 66 HE3 TRP 66 5.480 -0.893 -19.144
485 HZ2 TRP 66 HZ2 TRP 66 2.938 0.119 -14.975
486 HZ3 TRP 66 HZ3 TRP 66 3.071 -0.394 -19.209
487 HH2 TRP 66 HH2 TRP 66 1.828 0.101 -17.167
488 H GLU 67 H GLU 67 10.818 -2.243 -17.057
489 HA GLU 67 HA GLU 67 12.128 -1.929 -19.659
490 HB2 GLU 67 2HB GLU 67 13.468 -0.811 -17.816
491 HB3 GLU 67 3HB GLU 67 13.701 -2.413 -17.131
492 HG2 GLU 67 2HG GLU 67 15.049 -3.109 -18.871
493 HG3 GLU 67 3HG GLU 67 14.426 -1.887 -19.978
494 H VAL 68 H VAL 68 10.267 -3.834 -18.051
495 HA VAL 68 HA VAL 68 9.799 -6.063 -18.102
496 HB VAL 68 HB VAL 68 12.191 -6.411 -19.905
497 HG11 VAL 68 1HG1 VAL 68 11.537 -8.543 -19.691
498 HG12 VAL 68 2HG1 VAL 68 9.969 -8.094 -19.016
499 HG13 VAL 68 3HG1 VAL 68 10.213 -8.087 -20.763
500 HG21 VAL 68 3HG2 VAL 68 9.604 -5.092 -20.403
501 HG22 VAL 68 1HG2 VAL 68 11.152 -4.910 -21.229
502 HG23 VAL 68 2HG2 VAL 68 10.102 -6.274 -21.613
503 H GLU 69 H GLU 69 10.855 -5.506 -15.841
504 HA GLU 69 HA GLU 69 13.175 -7.263 -15.420
505 HB2 GLU 69 2HB GLU 69 12.712 -4.675 -14.548
506 HB3 GLU 69 3HB GLU 69 12.345 -5.652 -13.133
507 HG2 GLU 69 2HG GLU 69 14.865 -6.151 -14.642
508 HG3 GLU 69 3HG GLU 69 14.761 -4.775 -13.546
509 H HIS 70 H HIS 70 12.488 -9.266 -14.984
510 HA HIS 70 HA HIS 70 11.083 -9.801 -12.571
511 HB2 HIS 70 2HB HIS 70 9.112 -9.235 -13.829
512 HB3 HIS 70 3HB HIS 70 9.619 -10.249 -15.177
513 HD1 HIS 70 HD1 HIS 70 9.407 -11.140 -11.487
514 HD2 HIS 70 HD2 HIS 70 7.797 -12.257 -15.151
515 HE1 HIS 70 HE1 HIS 70 7.971 -13.148 -11.006
516 H HIS 71 H HIS 71 11.333 -11.911 -11.910
517 HA HIS 71 HA HIS 71 13.103 -13.534 -13.585
518 HB2 HIS 71 2HB HIS 71 13.556 -14.797 -11.507
519 HB3 HIS 71 3HB HIS 71 13.903 -13.080 -11.332
520 HD1 HIS 71 HD1 HIS 71 11.043 -15.469 -10.560
521 HD2 HIS 71 HD2 HIS 71 12.802 -11.994 -9.115
522 HE1 HIS 71 HE1 HIS 71 9.826 -14.938 -8.424
Start of MODEL 17
1 H1 MET 1 H MET 1 3.747 -4.449 -5.691
2 HA MET 1 HA MET 1 5.215 -3.993 -7.869
3 HB2 MET 1 2HB MET 1 4.882 -1.510 -7.114
4 HB3 MET 1 3HB MET 1 6.195 -1.865 -5.999
5 HG2 MET 1 2HG MET 1 6.555 -2.547 -8.867
6 HG3 MET 1 3HG MET 1 6.638 -0.854 -8.385
7 HE1 MET 1 3HE MET 1 8.460 -4.465 -7.867
8 HE2 MET 1 1HE MET 1 8.490 -3.569 -9.386
9 HE3 MET 1 2HE MET 1 9.958 -3.715 -8.420
10 H LYS 2 H LYS 2 6.202 -5.887 -7.435
11 HA LYS 2 HA LYS 2 8.026 -5.944 -5.123
12 HB2 LYS 2 2HB LYS 2 6.615 -8.378 -6.209
13 HB3 LYS 2 3HB LYS 2 7.538 -8.241 -4.718
14 HG2 LYS 2 2HG LYS 2 5.711 -6.453 -4.124
15 HG3 LYS 2 3HG LYS 2 4.771 -7.337 -5.329
16 HD2 LYS 2 2HD LYS 2 5.937 -9.308 -3.740
17 HD3 LYS 2 3HD LYS 2 5.424 -8.057 -2.606
18 HE2 LYS 2 2HE LYS 2 3.667 -9.726 -2.982
19 HE3 LYS 2 3HE LYS 2 3.174 -8.121 -3.519
20 HZ1 LYS 2 3HZ LYS 2 3.067 -8.777 -5.649
21 HZ2 LYS 2 1HZ LYS 2 2.931 -10.331 -4.995
22 HZ3 LYS 2 2HZ LYS 2 4.431 -9.772 -5.541
23 H THR 3 H THR 3 9.968 -7.125 -5.401
24 HA THR 3 HA THR 3 10.602 -7.999 -8.123
25 HB THR 3 HB THR 3 11.392 -5.729 -8.128
26 HG1 THR 3 HG1 THR 3 13.675 -7.334 -7.586
27 HG21 THR 3 3HG2 THR 3 12.917 -4.842 -6.474
28 HG22 THR 3 1HG2 THR 3 12.953 -6.388 -5.628
29 HG23 THR 3 2HG2 THR 3 11.468 -5.438 -5.665
30 H PHE 4 H PHE 4 12.399 -9.423 -8.266
31 HA PHE 4 HA PHE 4 12.698 -11.098 -5.958
32 HB2 PHE 4 2HB PHE 4 14.265 -11.299 -8.529
33 HB3 PHE 4 3HB PHE 4 13.899 -12.584 -7.382
34 HD1 PHE 4 HD2 PHE 4 11.113 -12.494 -6.928
35 HD2 PHE 4 HD1 PHE 4 13.225 -11.674 -10.531
36 HE1 PHE 4 HE2 PHE 4 9.112 -13.087 -8.231
37 HE2 PHE 4 HE1 PHE 4 11.227 -12.265 -11.840
38 HZ PHE 4 HZ PHE 4 9.167 -12.974 -10.691
39 H ALA 5 H ALA 5 14.051 -10.671 -4.355
40 HA ALA 5 HA ALA 5 16.225 -8.825 -4.631
41 HB1 ALA 5 1HB ALA 5 16.622 -9.218 -2.280
42 HB2 ALA 5 2HB ALA 5 14.892 -9.017 -2.564
43 HB3 ALA 5 3HB ALA 5 15.562 -10.628 -2.307
44 H LEU 6 H LEU 6 18.051 -9.375 -5.624
45 HA LEU 6 HA LEU 6 19.090 -12.105 -5.256
46 HB2 LEU 6 2HB LEU 6 19.945 -10.204 -7.414
47 HB3 LEU 6 3HB LEU 6 20.149 -11.953 -7.348
48 HG LEU 6 HG LEU 6 17.477 -10.590 -7.652
49 HD11 LEU 6 1HD1 LEU 6 19.502 -11.440 -9.674
50 HD12 LEU 6 2HD1 LEU 6 18.488 -9.999 -9.635
51 HD13 LEU 6 3HD1 LEU 6 17.782 -11.561 -10.047
52 HD21 LEU 6 3HD2 LEU 6 18.122 -13.394 -8.444
53 HD22 LEU 6 1HD2 LEU 6 16.577 -12.683 -7.979
54 HD23 LEU 6 2HD2 LEU 6 17.798 -13.020 -6.751
55 H GLN 7 H GLN 7 21.658 -11.924 -5.860
56 HA GLN 7 HA GLN 7 22.905 -10.975 -3.588
57 HB2 GLN 7 2HB GLN 7 25.013 -11.258 -4.779
58 HB3 GLN 7 3HB GLN 7 23.923 -12.591 -5.136
59 HG2 GLN 7 2HG GLN 7 23.305 -11.393 -7.249
60 HG3 GLN 7 3HG GLN 7 24.609 -10.259 -6.902
61 HE21 GLN 7 1HE2 GLN 7 26.774 -11.126 -6.736
62 HE22 GLN 7 2HE2 GLN 7 27.204 -12.517 -7.666
63 H GLY 8 H GLY 8 23.411 -9.018 -2.859
64 HA2 GLY 8 2HA GLY 8 23.940 -6.780 -2.818
65 HA3 GLY 8 3HA GLY 8 24.381 -6.922 -4.513
66 H ASP 9 H ASP 9 21.211 -7.929 -3.696
67 HA ASP 9 HA ASP 9 20.123 -5.349 -4.613
68 HB2 ASP 9 2HB ASP 9 19.496 -8.131 -5.542
69 HB3 ASP 9 3HB ASP 9 18.255 -6.883 -5.614
70 H THR 10 H THR 10 20.484 -6.561 -1.914
71 HA THR 10 HA THR 10 17.926 -7.363 -0.952
72 HB THR 10 HB THR 10 18.860 -7.400 1.199
73 HG1 THR 10 HG1 THR 10 20.333 -5.985 1.892
74 HG21 THR 10 3HG2 THR 10 20.926 -8.566 0.965
75 HG22 THR 10 1HG2 THR 10 21.285 -7.755 -0.559
76 HG23 THR 10 2HG2 THR 10 19.969 -8.927 -0.471
77 H LEU 11 H LEU 11 17.063 -6.067 1.070
78 HA LEU 11 HA LEU 11 15.763 -3.817 0.174
79 HB2 LEU 11 2HB LEU 11 16.543 -4.379 3.030
80 HB3 LEU 11 3HB LEU 11 15.232 -3.332 2.491
81 HG LEU 11 HG LEU 11 15.320 -6.306 2.002
82 HD11 LEU 11 1HD1 LEU 11 13.492 -6.272 3.788
83 HD12 LEU 11 2HD1 LEU 11 14.150 -4.703 4.251
84 HD13 LEU 11 3HD1 LEU 11 15.166 -6.142 4.328
85 HD21 LEU 11 3HD2 LEU 11 12.832 -5.871 1.698
86 HD22 LEU 11 1HD2 LEU 11 13.904 -5.307 0.416
87 HD23 LEU 11 2HD2 LEU 11 13.255 -4.162 1.591
88 H ASP 12 H ASP 12 18.789 -3.982 2.015
89 HA ASP 12 HA ASP 12 19.214 -1.280 2.445
90 HB2 ASP 12 2HB ASP 12 20.659 -2.863 3.498
91 HB3 ASP 12 3HB ASP 12 21.174 -3.521 1.947
92 H ALA 13 H ALA 13 19.695 -3.185 -0.454
93 HA ALA 13 HA ALA 13 20.997 -0.992 -1.846
94 HB1 ALA 13 1HB ALA 13 20.111 -3.337 -3.389
95 HB2 ALA 13 2HB ALA 13 21.673 -2.517 -3.360
96 HB3 ALA 13 3HB ALA 13 21.256 -3.667 -2.089
97 H ILE 14 H ILE 14 18.061 -2.957 -2.363
98 HA ILE 14 HA ILE 14 16.940 -1.526 -4.429
99 HB ILE 14 HB ILE 14 15.515 -2.886 -2.140
100 HG12 ILE 14 2HG1 ILE 14 16.040 -3.869 -4.951
101 HG13 ILE 14 3HG1 ILE 14 17.051 -4.276 -3.568
102 HG21 ILE 14 1HG2 ILE 14 14.455 -1.917 -4.790
103 HG22 ILE 14 2HG2 ILE 14 13.580 -2.977 -3.686
104 HG23 ILE 14 3HG2 ILE 14 13.999 -1.338 -3.188
105 HD11 ILE 14 3HD1 ILE 14 15.126 -5.334 -2.490
106 HD12 ILE 14 1HD1 ILE 14 14.138 -4.951 -3.900
107 HD13 ILE 14 2HD1 ILE 14 15.499 -6.063 -4.052
108 H CYS 15 H CYS 15 16.510 -0.970 -0.943
109 HA CYS 15 HA CYS 15 14.731 1.163 -1.093
110 HB2 CYS 15 2HB CYS 15 16.847 0.461 0.937
111 HB3 CYS 15 3HB CYS 15 15.765 1.832 1.149
112 HG CYS 15 HG CYS 15 14.125 0.369 2.479
113 H VAL 16 H VAL 16 18.155 1.045 -1.666
114 HA VAL 16 HA VAL 16 18.453 3.931 -1.612
115 HB VAL 16 HB VAL 16 20.409 1.755 -2.364
116 HG11 VAL 16 1HG1 VAL 16 20.604 4.727 -2.401
117 HG12 VAL 16 2HG1 VAL 16 22.021 3.784 -1.933
118 HG13 VAL 16 3HG1 VAL 16 21.279 3.538 -3.514
119 HG21 VAL 16 3HG2 VAL 16 19.617 1.983 0.053
120 HG22 VAL 16 1HG2 VAL 16 21.357 2.017 -0.232
121 HG23 VAL 16 2HG2 VAL 16 20.483 3.519 0.067
122 H ARG 17 H ARG 17 18.026 1.368 -3.941
123 HA ARG 17 HA ARG 17 18.638 3.075 -6.200
124 HB2 ARG 17 2HB ARG 17 18.600 1.181 -7.486
125 HB3 ARG 17 3HB ARG 17 18.943 0.459 -5.920
126 HG2 ARG 17 2HG ARG 17 16.529 -0.004 -5.650
127 HG3 ARG 17 3HG ARG 17 16.263 0.619 -7.280
128 HD2 ARG 17 2HD ARG 17 18.001 -1.732 -6.538
129 HD3 ARG 17 3HD ARG 17 16.401 -1.819 -7.273
130 HE ARG 17 HE ARG 17 17.846 -0.280 -8.995
131 HH11 ARG 17 1HH1 ARG 17 18.252 -3.448 -7.611
132 HH12 ARG 17 2HH1 ARG 17 19.120 -4.075 -8.974
133 HH21 ARG 17 1HH2 ARG 17 18.987 -1.093 -10.795
134 HH22 ARG 17 2HH2 ARG 17 19.538 -2.734 -10.784
135 H TYR 18 H TYR 18 15.980 2.511 -4.223
136 HA TYR 18 HA TYR 18 14.085 3.319 -6.324
137 HB2 TYR 18 2HB TYR 18 13.868 1.598 -3.934
138 HB3 TYR 18 3HB TYR 18 12.500 2.669 -4.216
139 HD1 TYR 18 HD2 TYR 18 14.532 -0.037 -5.714
140 HD2 TYR 18 HD1 TYR 18 10.934 2.223 -5.938
141 HE1 TYR 18 HE2 TYR 18 13.654 -1.612 -7.386
142 HE2 TYR 18 HE1 TYR 18 10.045 0.653 -7.610
143 HH TYR 18 HH TYR 18 11.458 -2.355 -8.240
144 H TYR 19 H TYR 19 14.505 3.800 -2.812
145 HA TYR 19 HA TYR 19 13.330 6.460 -3.067
146 HB2 TYR 19 2HB TYR 19 14.220 5.198 -0.486
147 HB3 TYR 19 3HB TYR 19 12.973 6.413 -0.744
148 HD1 TYR 19 HD1 TYR 19 10.804 5.735 -1.799
149 HD2 TYR 19 HD2 TYR 19 13.713 2.885 -0.567
150 HE1 TYR 19 HE1 TYR 19 9.091 3.971 -1.854
151 HE2 TYR 19 HE2 TYR 19 12.008 1.113 -0.620
152 HH TYR 19 HH TYR 19 9.781 0.704 -0.734
153 H GLY 20 H GLY 20 16.349 4.879 -2.201
154 HA2 GLY 20 2HA GLY 20 18.475 5.857 -2.518
155 HA3 GLY 20 3HA GLY 20 17.720 7.444 -2.510
156 H ARG 21 H ARG 21 16.906 5.142 -0.048
157 HA ARG 21 HA ARG 21 18.883 5.957 1.840
158 HB2 ARG 21 2HB ARG 21 17.389 7.159 3.379
159 HB3 ARG 21 3HB ARG 21 17.560 8.004 1.846
160 HG2 ARG 21 2HG ARG 21 15.269 6.139 2.213
161 HG3 ARG 21 3HG ARG 21 15.219 7.728 2.979
162 HD2 ARG 21 2HD ARG 21 15.983 8.486 0.548
163 HD3 ARG 21 3HD ARG 21 15.158 6.992 0.105
164 HE ARG 21 HE ARG 21 13.158 8.001 0.569
165 HH11 ARG 21 1HH1 ARG 21 15.733 9.872 1.980
166 HH12 ARG 21 2HH1 ARG 21 14.702 11.187 2.437
167 HH21 ARG 21 1HH2 ARG 21 11.791 9.727 1.166
168 HH22 ARG 21 2HH2 ARG 21 12.460 11.103 1.975
169 H THR 22 H THR 22 18.545 4.980 3.963
170 HA THR 22 HA THR 22 16.767 2.633 3.809
171 HB THR 22 HB THR 22 18.515 1.779 5.617
172 HG1 THR 22 HG1 THR 22 20.082 3.500 3.968
173 HG21 THR 22 3HG2 THR 22 19.927 1.227 3.309
174 HG22 THR 22 1HG2 THR 22 18.298 1.554 2.720
175 HG23 THR 22 2HG2 THR 22 18.562 0.302 3.934
176 H GLU 23 H GLU 23 17.792 5.363 5.674
177 HA GLU 23 HA GLU 23 16.613 4.509 8.145
178 HB2 GLU 23 2HB GLU 23 18.512 6.213 7.815
179 HB3 GLU 23 3HB GLU 23 17.242 7.359 7.410
180 HG2 GLU 23 2HG GLU 23 17.645 7.727 9.668
181 HG3 GLU 23 3HG GLU 23 16.196 6.723 9.649
182 H GLY 24 H GLY 24 14.487 4.295 8.370
183 HA2 GLY 24 2HA GLY 24 12.353 5.309 8.679
184 HA3 GLY 24 3HA GLY 24 12.765 6.485 7.440
185 H VAL 25 H VAL 25 13.831 4.082 5.837
186 HA VAL 25 HA VAL 25 11.250 3.469 4.599
187 HB VAL 25 HB VAL 25 14.005 2.879 3.515
188 HG11 VAL 25 1HG1 VAL 25 11.762 3.316 1.685
189 HG12 VAL 25 2HG1 VAL 25 13.007 2.066 1.679
190 HG13 VAL 25 3HG1 VAL 25 11.590 1.896 2.715
191 HG21 VAL 25 3HG2 VAL 25 14.088 5.171 3.563
192 HG22 VAL 25 1HG2 VAL 25 13.292 4.915 2.010
193 HG23 VAL 25 2HG2 VAL 25 12.339 5.348 3.430
194 H VAL 26 H VAL 26 14.202 1.815 5.693
195 HA VAL 26 HA VAL 26 13.495 -0.800 5.155
196 HB VAL 26 HB VAL 26 14.988 -1.458 7.012
197 HG11 VAL 26 1HG1 VAL 26 17.013 -0.153 6.176
198 HG12 VAL 26 2HG1 VAL 26 16.088 -1.057 4.976
199 HG13 VAL 26 3HG1 VAL 26 15.886 0.690 5.114
200 HG21 VAL 26 3HG2 VAL 26 16.197 0.507 8.145
201 HG22 VAL 26 1HG2 VAL 26 14.800 1.465 7.655
202 HG23 VAL 26 2HG2 VAL 26 14.587 0.079 8.724
203 H GLU 27 H GLU 27 12.506 1.262 7.821
204 HA GLU 27 HA GLU 27 11.363 -0.716 9.461
205 HB2 GLU 27 2HB GLU 27 10.997 2.242 9.177
206 HB3 GLU 27 3HB GLU 27 9.891 1.330 10.194
207 HG2 GLU 27 2HG GLU 27 11.927 0.430 11.385
208 HG3 GLU 27 3HG GLU 27 12.859 1.642 10.507
209 H THR 28 H THR 28 10.140 1.037 6.683
210 HA THR 28 HA THR 28 7.417 0.271 6.989
211 HB THR 28 HB THR 28 8.657 0.927 4.331
212 HG1 THR 28 HG1 THR 28 8.397 3.147 4.921
213 HG21 THR 28 3HG2 THR 28 6.546 1.266 3.668
214 HG22 THR 28 1HG2 THR 28 6.164 2.214 5.104
215 HG23 THR 28 2HG2 THR 28 6.060 0.454 5.156
216 H VAL 29 H VAL 29 9.789 -0.764 4.528
217 HA VAL 29 HA VAL 29 8.366 -2.882 3.482
218 HB VAL 29 HB VAL 29 11.364 -2.822 3.843
219 HG11 VAL 29 1HG1 VAL 29 10.924 -4.001 1.459
220 HG12 VAL 29 2HG1 VAL 29 11.103 -4.888 2.975
221 HG13 VAL 29 3HG1 VAL 29 9.494 -4.535 2.342
222 HG21 VAL 29 3HG2 VAL 29 11.307 -0.975 2.590
223 HG22 VAL 29 1HG2 VAL 29 10.785 -2.015 1.265
224 HG23 VAL 29 2HG2 VAL 29 9.588 -1.168 2.245
225 H LEU 30 H LEU 30 10.367 -2.782 6.373
226 HA LEU 30 HA LEU 30 10.592 -5.501 6.904
227 HB2 LEU 30 2HB LEU 30 11.763 -3.705 8.128
228 HB3 LEU 30 3HB LEU 30 10.242 -3.275 8.907
229 HG LEU 30 HG LEU 30 10.276 -5.720 9.769
230 HD11 LEU 30 1HD1 LEU 30 12.040 -6.664 8.535
231 HD12 LEU 30 2HD1 LEU 30 12.678 -6.441 10.163
232 HD13 LEU 30 3HD1 LEU 30 13.117 -5.311 8.882
233 HD21 LEU 30 3HD2 LEU 30 12.269 -4.694 11.398
234 HD22 LEU 30 1HD2 LEU 30 10.531 -4.469 11.593
235 HD23 LEU 30 2HD2 LEU 30 11.483 -3.266 10.724
236 H ALA 31 H ALA 31 8.019 -3.238 7.829
237 HA ALA 31 HA ALA 31 6.476 -5.076 9.302
238 HB1 ALA 31 1HB ALA 31 5.281 -3.256 9.726
239 HB2 ALA 31 2HB ALA 31 6.302 -2.365 8.596
240 HB3 ALA 31 3HB ALA 31 4.811 -3.120 8.032
241 H ALA 32 H ALA 32 6.634 -4.329 5.878
242 HA ALA 32 HA ALA 32 4.293 -5.856 5.202
243 HB1 ALA 32 1HB ALA 32 6.188 -4.141 3.813
244 HB2 ALA 32 2HB ALA 32 5.717 -5.552 2.866
245 HB3 ALA 32 3HB ALA 32 4.484 -4.451 3.480
246 H ASN 33 H ASN 33 7.665 -6.494 5.622
247 HA ASN 33 HA ASN 33 7.195 -9.296 4.904
248 HB2 ASN 33 2HB ASN 33 9.230 -7.460 3.730
249 HB3 ASN 33 3HB ASN 33 9.705 -9.128 4.033
250 HD21 ASN 33 1HD2 ASN 33 7.299 -7.122 2.424
251 HD22 ASN 33 2HD2 ASN 33 6.940 -8.248 1.163
252 HA PRO 34 HA PRO 34 9.250 -8.779 9.036
253 HB2 PRO 34 2HB PRO 34 7.619 -10.524 10.325
254 HB3 PRO 34 3HB PRO 34 7.228 -8.812 10.126
255 HG2 PRO 34 2HG PRO 34 6.268 -11.169 8.551
256 HG3 PRO 34 3HG PRO 34 5.352 -9.772 9.145
257 HD2 PRO 34 2HD PRO 34 6.195 -9.976 6.580
258 HD3 PRO 34 3HD PRO 34 6.053 -8.417 7.417
259 H GLY 35 H GLY 35 10.622 -10.241 10.080
260 HA2 GLY 35 2HA GLY 35 11.588 -12.350 10.494
261 HA3 GLY 35 3HA GLY 35 10.677 -13.008 9.144
262 H LEU 36 H LEU 36 11.617 -10.571 7.548
263 HA LEU 36 HA LEU 36 13.762 -11.839 6.239
264 HB2 LEU 36 2HB LEU 36 12.068 -9.925 5.524
265 HB3 LEU 36 3HB LEU 36 13.418 -8.898 6.002
266 HG LEU 36 HG LEU 36 13.392 -9.320 3.591
267 HD11 LEU 36 1HD1 LEU 36 15.539 -9.357 5.237
268 HD12 LEU 36 2HD1 LEU 36 15.633 -9.372 3.476
269 HD13 LEU 36 3HD1 LEU 36 15.750 -10.883 4.378
270 HD21 LEU 36 3HD2 LEU 36 12.534 -11.816 4.203
271 HD22 LEU 36 1HD2 LEU 36 14.236 -12.122 3.856
272 HD23 LEU 36 2HD2 LEU 36 13.214 -11.351 2.643
273 H ALA 37 H ALA 37 13.634 -9.475 8.809
274 HA ALA 37 HA ALA 37 16.292 -8.565 8.700
275 HB1 ALA 37 1HB ALA 37 15.588 -8.489 11.380
276 HB2 ALA 37 2HB ALA 37 15.346 -7.209 10.190
277 HB3 ALA 37 3HB ALA 37 14.052 -8.360 10.523
278 H GLU 38 H GLU 38 14.930 -11.541 9.776
279 HA GLU 38 HA GLU 38 17.121 -12.280 11.486
280 HB2 GLU 38 2HB GLU 38 14.784 -13.809 10.349
281 HB3 GLU 38 3HB GLU 38 16.018 -14.570 11.343
282 HG2 GLU 38 2HG GLU 38 14.636 -12.138 12.362
283 HG3 GLU 38 3HG GLU 38 13.796 -13.688 12.397
284 H LEU 39 H LEU 39 16.513 -12.332 8.128
285 HA LEU 39 HA LEU 39 17.875 -14.556 7.222
286 HB2 LEU 39 2HB LEU 39 16.630 -12.594 5.986
287 HB3 LEU 39 3HB LEU 39 18.264 -11.956 5.820
288 HG LEU 39 HG LEU 39 18.023 -13.077 3.835
289 HD11 LEU 39 1HD1 LEU 39 18.961 -15.339 5.585
290 HD12 LEU 39 2HD1 LEU 39 19.962 -13.953 5.154
291 HD13 LEU 39 3HD1 LEU 39 19.370 -15.038 3.896
292 HD21 LEU 39 3HD2 LEU 39 16.971 -15.496 3.931
293 HD22 LEU 39 1HD2 LEU 39 15.960 -14.055 3.827
294 HD23 LEU 39 2HD2 LEU 39 16.204 -14.849 5.383
295 H GLY 40 H GLY 40 19.236 -11.304 7.787
296 HA2 GLY 40 2HA GLY 40 21.333 -10.800 8.684
297 HA3 GLY 40 3HA GLY 40 21.748 -12.506 8.613
298 H ALA 41 H ALA 41 22.604 -13.373 6.706
299 HA ALA 41 HA ALA 41 24.293 -11.683 5.242
300 HB1 ALA 41 1HB ALA 41 23.707 -14.115 3.808
301 HB2 ALA 41 2HB ALA 41 25.199 -13.608 4.601
302 HB3 ALA 41 3HB ALA 41 23.945 -14.432 5.527
303 H VAL 42 H VAL 42 24.131 -12.320 2.606
304 HA VAL 42 HA VAL 42 22.340 -10.464 1.576
305 HB VAL 42 HB VAL 42 24.331 -11.302 0.365
306 HG11 VAL 42 1HG1 VAL 42 24.336 -13.401 -0.759
307 HG12 VAL 42 2HG1 VAL 42 23.911 -13.713 0.925
308 HG13 VAL 42 3HG1 VAL 42 22.658 -13.712 -0.316
309 HG21 VAL 42 3HG2 VAL 42 23.269 -10.264 -1.296
310 HG22 VAL 42 1HG2 VAL 42 22.676 -11.846 -1.800
311 HG23 VAL 42 2HG2 VAL 42 21.697 -10.834 -0.737
312 H LEU 43 H LEU 43 20.265 -10.512 0.943
313 HA LEU 43 HA LEU 43 18.480 -12.424 1.830
314 HB2 LEU 43 2HB LEU 43 18.364 -10.277 -0.228
315 HB3 LEU 43 3HB LEU 43 17.041 -11.438 -0.150
316 HG LEU 43 HG LEU 43 16.498 -10.766 2.085
317 HD11 LEU 43 1HD1 LEU 43 17.824 -8.740 3.008
318 HD12 LEU 43 2HD1 LEU 43 19.098 -9.300 1.926
319 HD13 LEU 43 3HD1 LEU 43 18.486 -10.364 3.192
320 HD21 LEU 43 3HD2 LEU 43 16.447 -8.119 1.556
321 HD22 LEU 43 1HD2 LEU 43 15.318 -9.285 0.867
322 HD23 LEU 43 2HD2 LEU 43 16.724 -8.765 -0.062
323 HA PRO 44 HA PRO 44 18.545 -15.805 -0.965
324 HB2 PRO 44 2HB PRO 44 15.910 -16.420 -1.196
325 HB3 PRO 44 3HB PRO 44 16.846 -16.735 0.271
326 HG2 PRO 44 2HG PRO 44 14.985 -14.471 -0.339
327 HG3 PRO 44 3HG PRO 44 15.143 -15.419 1.151
328 HD2 PRO 44 2HD PRO 44 16.236 -12.958 0.869
329 HD3 PRO 44 3HD PRO 44 16.979 -14.224 1.867
330 H HIS 45 H HIS 45 18.857 -15.902 -3.094
331 HA HIS 45 HA HIS 45 17.851 -13.895 -4.851
332 HB2 HIS 45 2HB HIS 45 19.038 -15.129 -6.608
333 HB3 HIS 45 3HB HIS 45 20.057 -14.915 -5.188
334 HD1 HIS 45 HD1 HIS 45 18.669 -17.473 -7.408
335 HD2 HIS 45 HD2 HIS 45 20.347 -17.331 -3.610
336 HE1 HIS 45 HE1 HIS 45 19.276 -19.849 -6.852
337 H GLY 46 H GLY 46 15.974 -13.854 -5.893
338 HA2 GLY 46 2HA GLY 46 14.406 -14.911 -7.393
339 HA3 GLY 46 3HA GLY 46 14.659 -16.416 -6.521
340 H THR 47 H THR 47 14.538 -14.230 -4.146
341 HA THR 47 HA THR 47 11.747 -14.826 -3.581
342 HB THR 47 HB THR 47 13.865 -13.504 -1.875
343 HG1 THR 47 HG1 THR 47 13.363 -15.649 -0.728
344 HG21 THR 47 3HG2 THR 47 11.639 -12.721 -1.255
345 HG22 THR 47 1HG2 THR 47 12.281 -13.804 -0.021
346 HG23 THR 47 2HG2 THR 47 11.066 -14.386 -1.159
347 H ALA 48 H ALA 48 10.143 -13.440 -3.919
348 HA ALA 48 HA ALA 48 10.690 -10.776 -4.866
349 HB1 ALA 48 1HB ALA 48 8.769 -11.094 -5.924
350 HB2 ALA 48 2HB ALA 48 8.558 -12.630 -5.082
351 HB3 ALA 48 3HB ALA 48 7.916 -11.144 -4.381
352 H VAL 49 H VAL 49 10.456 -8.885 -3.803
353 HA VAL 49 HA VAL 49 9.527 -9.012 -1.007
354 HB VAL 49 HB VAL 49 11.620 -7.136 -2.112
355 HG11 VAL 49 1HG1 VAL 49 10.020 -6.866 0.118
356 HG12 VAL 49 2HG1 VAL 49 11.514 -7.548 0.764
357 HG13 VAL 49 3HG1 VAL 49 11.557 -6.049 -0.164
358 HG21 VAL 49 3HG2 VAL 49 12.972 -8.919 -1.998
359 HG22 VAL 49 1HG2 VAL 49 12.864 -8.712 -0.250
360 HG23 VAL 49 2HG2 VAL 49 11.805 -9.860 -1.069
361 H GLU 50 H GLU 50 7.946 -7.655 -0.421
362 HA GLU 50 HA GLU 50 6.661 -6.047 -2.412
363 HB2 GLU 50 2HB GLU 50 5.259 -7.159 -0.831
364 HB3 GLU 50 3HB GLU 50 6.143 -6.479 0.528
365 HG2 GLU 50 2HG GLU 50 5.225 -4.349 0.206
366 HG3 GLU 50 3HG GLU 50 4.663 -4.744 -1.417
367 H LEU 51 H LEU 51 7.058 -3.996 -2.891
368 HA LEU 51 HA LEU 51 8.616 -2.387 -0.983
369 HB2 LEU 51 2HB LEU 51 8.283 -1.903 -3.935
370 HB3 LEU 51 3HB LEU 51 9.413 -1.109 -2.841
371 HG LEU 51 HG LEU 51 9.514 -3.981 -3.760
372 HD11 LEU 51 1HD1 LEU 51 10.988 -1.490 -4.495
373 HD12 LEU 51 2HD1 LEU 51 10.337 -2.759 -5.532
374 HD13 LEU 51 3HD1 LEU 51 11.798 -3.054 -4.590
375 HD21 LEU 51 3HD2 LEU 51 11.663 -4.044 -2.534
376 HD22 LEU 51 1HD2 LEU 51 10.266 -3.854 -1.474
377 HD23 LEU 51 2HD2 LEU 51 11.286 -2.463 -1.848
378 HA PRO 52 HA PRO 52 4.531 -0.375 -0.750
379 HB2 PRO 52 2HB PRO 52 4.951 0.646 1.730
380 HB3 PRO 52 3HB PRO 52 4.401 -1.011 1.454
381 HG2 PRO 52 2HG PRO 52 7.158 -0.005 2.043
382 HG3 PRO 52 3HG PRO 52 6.321 -1.424 2.699
383 HD2 PRO 52 2HD PRO 52 8.156 -1.602 0.716
384 HD3 PRO 52 3HD PRO 52 6.771 -2.706 0.837
385 H ASP 53 H ASP 53 3.940 1.799 -0.872
386 HA ASP 53 HA ASP 53 4.169 4.008 -1.365
387 HB2 ASP 53 2HB ASP 53 6.823 3.920 0.069
388 HB3 ASP 53 3HB ASP 53 5.750 5.302 -0.140
389 H VAL 54 H VAL 54 4.941 2.222 -3.330
390 HA VAL 54 HA VAL 54 7.213 3.623 -4.585
391 HB VAL 54 HB VAL 54 6.402 0.729 -4.858
392 HG11 VAL 54 1HG1 VAL 54 6.970 1.510 -7.052
393 HG12 VAL 54 2HG1 VAL 54 8.411 2.324 -6.441
394 HG13 VAL 54 3HG1 VAL 54 8.322 0.562 -6.434
395 HG21 VAL 54 3HG2 VAL 54 7.725 1.111 -2.900
396 HG22 VAL 54 1HG2 VAL 54 8.757 0.358 -4.115
397 HG23 VAL 54 2HG2 VAL 54 8.878 2.090 -3.807
398 H GLN 55 H GLN 55 7.013 4.255 -6.706
399 HA GLN 55 HA GLN 55 5.965 4.967 -8.595
400 HB2 GLN 55 2HB GLN 55 4.728 2.285 -8.128
401 HB3 GLN 55 3HB GLN 55 4.084 3.315 -9.399
402 HG2 GLN 55 2HG GLN 55 6.488 3.484 -10.236
403 HG3 GLN 55 3HG GLN 55 6.822 2.125 -9.164
404 HE21 GLN 55 1HE2 GLN 55 4.391 3.083 -11.569
405 HE22 GLN 55 2HE2 GLN 55 4.323 1.550 -12.362
406 H THR 56 H THR 56 4.938 5.729 -5.921
407 HA THR 56 HA THR 56 2.085 5.981 -6.190
408 HB THR 56 HB THR 56 3.671 7.653 -4.279
409 HG1 THR 56 HG1 THR 56 2.993 5.020 -3.567
410 HG21 THR 56 3HG2 THR 56 1.284 6.079 -3.504
411 HG22 THR 56 1HG2 THR 56 1.028 7.402 -4.641
412 HG23 THR 56 2HG2 THR 56 1.750 7.722 -3.064
413 H ALA 57 H ALA 57 2.751 6.984 -8.464
414 HA ALA 57 HA ALA 57 2.270 9.846 -8.179
415 HB1 ALA 57 1HB ALA 57 4.033 9.853 -10.273
416 HB2 ALA 57 2HB ALA 57 4.409 10.329 -8.617
417 HB3 ALA 57 3HB ALA 57 4.763 8.691 -9.165
418 HA PRO 58 HA PRO 58 -0.441 9.321 -11.589
419 HB2 PRO 58 2HB PRO 58 -0.155 11.664 -12.930
420 HB3 PRO 58 3HB PRO 58 -0.987 11.543 -11.375
421 HG2 PRO 58 2HG PRO 58 1.814 12.422 -11.962
422 HG3 PRO 58 3HG PRO 58 0.629 13.130 -10.848
423 HD2 PRO 58 2HD PRO 58 2.637 11.518 -10.008
424 HD3 PRO 58 3HD PRO 58 1.054 11.570 -9.205
425 H VAL 59 H VAL 59 -0.031 7.900 -13.162
426 HA VAL 59 HA VAL 59 2.372 8.108 -14.775
427 HB VAL 59 HB VAL 59 1.699 5.973 -15.744
428 HG11 VAL 59 1HG1 VAL 59 2.375 4.769 -13.957
429 HG12 VAL 59 2HG1 VAL 59 2.607 6.364 -13.239
430 HG13 VAL 59 3HG1 VAL 59 1.139 5.447 -12.897
431 HG21 VAL 59 3HG2 VAL 59 -0.781 6.243 -14.045
432 HG22 VAL 59 1HG2 VAL 59 -0.714 6.345 -15.804
433 HG23 VAL 59 2HG2 VAL 59 -0.328 4.827 -14.993
434 H ALA 60 H ALA 60 1.776 7.259 -17.207
435 HA ALA 60 HA ALA 60 -0.322 9.036 -18.251
436 HB1 ALA 60 1HB ALA 60 1.394 9.351 -20.218
437 HB2 ALA 60 2HB ALA 60 1.470 10.362 -18.774
438 HB3 ALA 60 3HB ALA 60 2.571 8.996 -18.953
439 H GLU 61 H GLU 61 -0.075 6.089 -17.803
440 HA GLU 61 HA GLU 61 -1.188 5.271 -20.314
441 HB2 GLU 61 2HB GLU 61 0.412 3.513 -20.828
442 HB3 GLU 61 3HB GLU 61 1.214 5.078 -20.819
443 HG2 GLU 61 2HG GLU 61 2.268 4.643 -18.761
444 HG3 GLU 61 3HG GLU 61 1.235 3.252 -18.439
445 H THR 62 H THR 62 -1.830 2.928 -20.251
446 HA THR 62 HA THR 62 -2.888 2.337 -17.609
447 HB THR 62 HB THR 62 -4.020 0.414 -18.925
448 HG1 THR 62 HG1 THR 62 -2.476 0.994 -20.784
449 HG21 THR 62 3HG2 THR 62 -4.987 2.959 -20.054
450 HG22 THR 62 1HG2 THR 62 -4.807 2.929 -18.300
451 HG23 THR 62 2HG2 THR 62 -5.839 1.744 -19.101
452 H VAL 63 H VAL 63 -1.661 1.194 -16.265
453 HA VAL 63 HA VAL 63 -0.741 -1.414 -16.966
454 HB VAL 63 HB VAL 63 1.074 -0.057 -17.965
455 HG11 VAL 63 1HG1 VAL 63 2.281 1.508 -16.845
456 HG12 VAL 63 2HG1 VAL 63 0.770 1.656 -15.945
457 HG13 VAL 63 3HG1 VAL 63 2.098 0.697 -15.290
458 HG21 VAL 63 3HG2 VAL 63 2.253 -1.412 -15.579
459 HG22 VAL 63 1HG2 VAL 63 1.330 -2.353 -16.751
460 HG23 VAL 63 2HG2 VAL 63 2.763 -1.464 -17.266
461 H ASN 64 H ASN 64 -0.133 -2.641 -15.165
462 HA ASN 64 HA ASN 64 -0.296 -3.296 -12.990
463 HB2 ASN 64 2HB ASN 64 1.020 -0.600 -12.761
464 HB3 ASN 64 3HB ASN 64 0.674 -1.565 -11.329
465 HD21 ASN 64 1HD2 ASN 64 3.156 -1.144 -11.450
466 HD22 ASN 64 2HD2 ASN 64 4.070 -2.440 -12.135
467 H LEU 65 H LEU 65 -2.715 -2.675 -13.845
468 HA LEU 65 HA LEU 65 -4.005 -0.629 -12.314
469 HB2 LEU 65 2HB LEU 65 -4.898 -2.802 -14.151
470 HB3 LEU 65 3HB LEU 65 -6.084 -2.012 -13.114
471 HG LEU 65 HG LEU 65 -4.309 -0.402 -14.915
472 HD11 LEU 65 1HD1 LEU 65 -6.306 -2.304 -15.744
473 HD12 LEU 65 2HD1 LEU 65 -5.229 -1.306 -16.720
474 HD13 LEU 65 3HD1 LEU 65 -6.779 -0.661 -16.179
475 HD21 LEU 65 3HD2 LEU 65 -6.453 1.007 -14.869
476 HD22 LEU 65 1HD2 LEU 65 -5.460 0.963 -13.412
477 HD23 LEU 65 2HD2 LEU 65 -6.928 -0.009 -13.507
478 H TRP 66 H TRP 66 -3.509 -1.083 -10.153
479 HA TRP 66 HA TRP 66 -3.845 -3.535 -8.864
480 HB2 TRP 66 2HB TRP 66 -4.279 -0.828 -7.593
481 HB3 TRP 66 3HB TRP 66 -3.761 -2.313 -6.801
482 HD1 TRP 66 HD1 TRP 66 -2.333 0.804 -7.783
483 HE1 TRP 66 HE1 TRP 66 0.195 0.632 -8.237
484 HE3 TRP 66 HE3 TRP 66 -1.927 -4.275 -8.197
485 HZ2 TRP 66 HZ2 TRP 66 2.107 -1.390 -8.709
486 HZ3 TRP 66 HZ3 TRP 66 0.287 -5.248 -8.651
487 HH2 TRP 66 HH2 TRP 66 2.261 -3.834 -8.903
488 H GLU 67 H GLU 67 -5.548 -4.592 -8.001
489 HA GLU 67 HA GLU 67 -8.101 -3.256 -7.657
490 HB2 GLU 67 2HB GLU 67 -9.358 -4.673 -9.102
491 HB3 GLU 67 3HB GLU 67 -8.021 -4.034 -10.048
492 HG2 GLU 67 2HG GLU 67 -6.803 -6.195 -9.498
493 HG3 GLU 67 3HG GLU 67 -8.361 -6.798 -8.936
494 H VAL 68 H VAL 68 -6.051 -4.648 -6.023
495 HA VAL 68 HA VAL 68 -6.016 -5.973 -4.171
496 HB VAL 68 HB VAL 68 -8.972 -6.422 -4.560
497 HG11 VAL 68 1HG1 VAL 68 -8.697 -7.652 -2.725
498 HG12 VAL 68 2HG1 VAL 68 -7.031 -7.104 -2.525
499 HG13 VAL 68 3HG1 VAL 68 -8.360 -6.150 -1.865
500 HG21 VAL 68 3HG2 VAL 68 -8.950 -4.435 -2.793
501 HG22 VAL 68 1HG2 VAL 68 -7.493 -4.004 -3.687
502 HG23 VAL 68 2HG2 VAL 68 -9.035 -4.146 -4.530
503 H GLU 69 H GLU 69 -5.002 -7.250 -6.168
504 HA GLU 69 HA GLU 69 -6.369 -9.851 -6.353
505 HB2 GLU 69 2HB GLU 69 -5.352 -8.235 -8.374
506 HB3 GLU 69 3HB GLU 69 -4.131 -9.484 -8.176
507 HG2 GLU 69 2HG GLU 69 -5.727 -10.123 -9.870
508 HG3 GLU 69 3HG GLU 69 -5.841 -11.204 -8.482
509 H HIS 70 H HIS 70 -5.611 -11.069 -4.722
510 HA HIS 70 HA HIS 70 -2.690 -11.381 -4.519
511 HB2 HIS 70 2HB HIS 70 -4.664 -11.436 -2.227
512 HB3 HIS 70 3HB HIS 70 -2.931 -11.719 -2.098
513 HD1 HIS 70 HD1 HIS 70 -1.399 -9.679 -2.084
514 HD2 HIS 70 HD2 HIS 70 -5.405 -8.737 -2.661
515 HE1 HIS 70 HE1 HIS 70 -1.546 -7.181 -1.832
516 H HIS 71 H HIS 71 -5.838 -12.887 -3.860
517 HA HIS 71 HA HIS 71 -4.711 -15.517 -3.616
518 HB2 HIS 71 2HB HIS 71 -7.002 -16.278 -3.391
519 HB3 HIS 71 3HB HIS 71 -6.777 -14.826 -2.421
520 HD1 HIS 71 HD1 HIS 71 -8.931 -16.261 -4.954
521 HD2 HIS 71 HD2 HIS 71 -7.852 -12.430 -3.760
522 HE1 HIS 71 HE1 HIS 71 -10.682 -14.737 -5.920
Start of MODEL 18
1 H1 MET 1 H MET 1 15.323 5.325 -5.084
2 HA MET 1 HA MET 1 13.103 6.432 -3.498
3 HB2 MET 1 2HB MET 1 13.260 4.195 -5.471
4 HB3 MET 1 3HB MET 1 12.086 4.088 -4.166
5 HG2 MET 1 2HG MET 1 10.952 5.023 -6.000
6 HG3 MET 1 3HG MET 1 11.252 6.349 -4.879
7 HE1 MET 1 3HE MET 1 13.346 5.616 -8.896
8 HE2 MET 1 1HE MET 1 13.992 4.785 -7.481
9 HE3 MET 1 2HE MET 1 12.334 4.484 -7.999
10 H LYS 2 H LYS 2 15.812 5.566 -2.599
11 HA LYS 2 HA LYS 2 15.258 3.174 -1.037
12 HB2 LYS 2 2HB LYS 2 17.593 3.334 -0.333
13 HB3 LYS 2 3HB LYS 2 17.461 3.420 -2.084
14 HG2 LYS 2 2HG LYS 2 17.455 6.006 -1.639
15 HG3 LYS 2 3HG LYS 2 18.239 5.525 -0.133
16 HD2 LYS 2 2HD LYS 2 19.199 4.527 -2.798
17 HD3 LYS 2 3HD LYS 2 19.735 6.075 -2.142
18 HE2 LYS 2 2HE LYS 2 20.421 4.827 -0.065
19 HE3 LYS 2 3HE LYS 2 20.108 3.335 -0.950
20 HZ1 LYS 2 3HZ LYS 2 21.834 3.771 -2.435
21 HZ2 LYS 2 1HZ LYS 2 22.476 4.209 -0.932
22 HZ3 LYS 2 2HZ LYS 2 21.939 5.403 -2.002
23 H THR 3 H THR 3 15.385 3.107 1.248
24 HA THR 3 HA THR 3 15.261 5.673 2.654
25 HB THR 3 HB THR 3 12.931 5.154 2.225
26 HG1 THR 3 HG1 THR 3 12.732 5.915 4.187
27 HG21 THR 3 3HG2 THR 3 13.794 2.464 2.672
28 HG22 THR 3 1HG2 THR 3 12.246 3.042 2.056
29 HG23 THR 3 2HG2 THR 3 12.486 2.846 3.792
30 H PHE 4 H PHE 4 15.569 5.493 4.960
31 HA PHE 4 HA PHE 4 17.496 3.478 5.627
32 HB2 PHE 4 2HB PHE 4 16.247 5.479 7.511
33 HB3 PHE 4 3HB PHE 4 17.805 4.674 7.673
34 HD1 PHE 4 HD2 PHE 4 19.008 5.017 5.057
35 HD2 PHE 4 HD1 PHE 4 16.671 7.737 7.351
36 HE1 PHE 4 HE2 PHE 4 20.101 6.907 3.924
37 HE2 PHE 4 HE1 PHE 4 17.760 9.632 6.220
38 HZ PHE 4 HZ PHE 4 19.478 9.218 4.505
39 H ALA 5 H ALA 5 17.087 1.543 6.447
40 HA ALA 5 HA ALA 5 14.424 0.861 7.338
41 HB1 ALA 5 1HB ALA 5 16.129 -0.567 5.948
42 HB2 ALA 5 2HB ALA 5 16.711 -1.037 7.545
43 HB3 ALA 5 3HB ALA 5 15.033 -1.337 7.095
44 H LEU 6 H LEU 6 13.745 0.609 9.383
45 HA LEU 6 HA LEU 6 15.755 0.740 11.532
46 HB2 LEU 6 2HB LEU 6 12.989 1.863 11.803
47 HB3 LEU 6 3HB LEU 6 14.407 2.171 12.803
48 HG LEU 6 HG LEU 6 14.082 3.127 9.960
49 HD11 LEU 6 1HD1 LEU 6 13.788 4.693 12.517
50 HD12 LEU 6 2HD1 LEU 6 12.445 4.144 11.515
51 HD13 LEU 6 3HD1 LEU 6 13.610 5.300 10.870
52 HD21 LEU 6 3HD2 LEU 6 15.992 4.558 10.510
53 HD22 LEU 6 1HD2 LEU 6 16.400 2.848 10.647
54 HD23 LEU 6 2HD2 LEU 6 16.100 3.801 12.100
55 H GLN 7 H GLN 7 14.402 0.218 13.721
56 HA GLN 7 HA GLN 7 13.992 -2.513 13.746
57 HB2 GLN 7 2HB GLN 7 14.235 -0.743 15.684
58 HB3 GLN 7 3HB GLN 7 12.477 -0.801 15.673
59 HG2 GLN 7 2HG GLN 7 12.466 -3.116 16.194
60 HG3 GLN 7 3HG GLN 7 14.205 -3.245 15.933
61 HE21 GLN 7 1HE2 GLN 7 12.462 -3.805 18.284
62 HE22 GLN 7 2HE2 GLN 7 13.171 -2.915 19.584
63 H GLY 8 H GLY 8 12.412 -3.809 13.076
64 HA2 GLY 8 2HA GLY 8 10.358 -4.543 12.357
65 HA3 GLY 8 3HA GLY 8 9.658 -3.232 13.294
66 H ASP 9 H ASP 9 11.969 -2.392 10.889
67 HA ASP 9 HA ASP 9 9.800 -1.616 9.052
68 HB2 ASP 9 2HB ASP 9 12.084 0.012 10.112
69 HB3 ASP 9 3HB ASP 9 11.435 0.358 8.511
70 H THR 10 H THR 10 11.690 -3.921 9.118
71 HA THR 10 HA THR 10 13.624 -3.520 7.058
72 HB THR 10 HB THR 10 14.111 -5.821 7.214
73 HG1 THR 10 HG1 THR 10 12.568 -7.252 7.411
74 HG21 THR 10 3HG2 THR 10 14.441 -4.405 9.321
75 HG22 THR 10 1HG2 THR 10 14.493 -6.157 9.510
76 HG23 THR 10 2HG2 THR 10 13.044 -5.262 9.970
77 H LEU 11 H LEU 11 13.515 -5.313 5.195
78 HA LEU 11 HA LEU 11 11.739 -4.434 3.293
79 HB2 LEU 11 2HB LEU 11 12.948 -7.188 3.512
80 HB3 LEU 11 3HB LEU 11 12.242 -6.494 2.054
81 HG LEU 11 HG LEU 11 14.724 -5.516 3.465
82 HD11 LEU 11 1HD1 LEU 11 15.214 -7.556 2.354
83 HD12 LEU 11 2HD1 LEU 11 15.804 -6.252 1.323
84 HD13 LEU 11 3HD1 LEU 11 14.295 -7.075 0.927
85 HD21 LEU 11 3HD2 LEU 11 12.999 -4.347 1.392
86 HD22 LEU 11 1HD2 LEU 11 14.723 -4.354 1.019
87 HD23 LEU 11 2HD2 LEU 11 14.143 -3.574 2.491
88 H ASP 12 H ASP 12 11.307 -6.992 5.664
89 HA ASP 12 HA ASP 12 9.015 -8.205 4.660
90 HB2 ASP 12 2HB ASP 12 10.103 -9.243 6.495
91 HB3 ASP 12 3HB ASP 12 9.988 -7.789 7.483
92 H ALA 13 H ALA 13 9.364 -5.297 6.633
93 HA ALA 13 HA ALA 13 6.488 -4.906 6.747
94 HB1 ALA 13 1HB ALA 13 7.196 -4.077 8.706
95 HB2 ALA 13 2HB ALA 13 8.832 -3.792 8.109
96 HB3 ALA 13 3HB ALA 13 7.555 -2.624 7.772
97 H ILE 14 H ILE 14 9.310 -3.178 5.428
98 HA ILE 14 HA ILE 14 8.031 -1.054 4.226
99 HB ILE 14 HB ILE 14 10.402 -2.571 3.131
100 HG12 ILE 14 2HG1 ILE 14 10.380 -0.087 4.852
101 HG13 ILE 14 3HG1 ILE 14 10.582 -1.711 5.501
102 HG21 ILE 14 1HG2 ILE 14 10.953 -0.515 1.958
103 HG22 ILE 14 2HG2 ILE 14 9.357 -1.091 1.479
104 HG23 ILE 14 3HG2 ILE 14 9.506 0.259 2.603
105 HD11 ILE 14 3HD1 ILE 14 12.648 -0.210 4.976
106 HD12 ILE 14 1HD1 ILE 14 12.686 -1.939 4.635
107 HD13 ILE 14 2HD1 ILE 14 12.394 -0.789 3.330
108 H CYS 15 H CYS 15 8.845 -4.159 2.668
109 HA CYS 15 HA CYS 15 7.674 -3.728 0.213
110 HB2 CYS 15 2HB CYS 15 7.944 -6.262 1.830
111 HB3 CYS 15 3HB CYS 15 7.332 -6.251 0.181
112 HG CYS 15 HG CYS 15 10.040 -4.588 -0.056
113 H VAL 16 H VAL 16 6.153 -4.311 3.268
114 HA VAL 16 HA VAL 16 3.575 -4.947 2.105
115 HB VAL 16 HB VAL 16 4.367 -4.447 4.977
116 HG11 VAL 16 1HG1 VAL 16 2.142 -5.612 5.409
117 HG12 VAL 16 2HG1 VAL 16 2.076 -3.938 4.856
118 HG13 VAL 16 3HG1 VAL 16 1.758 -5.254 3.726
119 HG21 VAL 16 3HG2 VAL 16 5.301 -6.484 3.783
120 HG22 VAL 16 1HG2 VAL 16 4.392 -6.788 5.264
121 HG23 VAL 16 2HG2 VAL 16 3.639 -7.069 3.694
122 H ARG 17 H ARG 17 4.971 -2.298 4.031
123 HA ARG 17 HA ARG 17 2.658 -0.663 3.920
124 HB2 ARG 17 2HB ARG 17 4.005 1.049 4.892
125 HB3 ARG 17 3HB ARG 17 4.522 -0.475 5.599
126 HG2 ARG 17 2HG ARG 17 6.603 -0.045 4.995
127 HG3 ARG 17 3HG ARG 17 6.108 -0.020 3.301
128 HD2 ARG 17 2HD ARG 17 5.777 2.360 5.106
129 HD3 ARG 17 3HD ARG 17 7.267 2.060 4.213
130 HE ARG 17 HE ARG 17 5.386 1.935 2.287
131 HH11 ARG 17 1HH1 ARG 17 6.075 4.272 4.773
132 HH12 ARG 17 2HH1 ARG 17 5.490 5.618 3.852
133 HH21 ARG 17 1HH2 ARG 17 4.613 3.698 1.064
134 HH22 ARG 17 2HH2 ARG 17 4.658 5.290 1.743
135 H TYR 18 H TYR 18 4.882 -1.499 1.560
136 HA TYR 18 HA TYR 18 4.409 0.974 0.039
137 HB2 TYR 18 2HB TYR 18 6.650 -0.957 0.161
138 HB3 TYR 18 3HB TYR 18 6.260 -0.331 -1.438
139 HD1 TYR 18 HD1 TYR 18 6.508 2.055 -1.934
140 HD2 TYR 18 HD2 TYR 18 7.596 0.468 1.860
141 HE1 TYR 18 HE1 TYR 18 7.770 4.109 -1.444
142 HE2 TYR 18 HE2 TYR 18 8.860 2.517 2.362
143 HH TYR 18 HH TYR 18 10.005 4.482 0.465
144 H TYR 19 H TYR 19 4.746 -2.530 -0.556
145 HA TYR 19 HA TYR 19 2.883 -2.265 -2.805
146 HB2 TYR 19 2HB TYR 19 4.466 -4.735 -2.134
147 HB3 TYR 19 3HB TYR 19 3.784 -4.258 -3.684
148 HD1 TYR 19 HD2 TYR 19 4.817 -2.298 -4.906
149 HD2 TYR 19 HD1 TYR 19 6.664 -4.132 -1.541
150 HE1 TYR 19 HE2 TYR 19 6.969 -1.299 -5.551
151 HE2 TYR 19 HE1 TYR 19 8.822 -3.136 -2.175
152 HH TYR 19 HH TYR 19 9.947 -2.170 -3.971
153 H GLY 20 H GLY 20 3.360 -3.933 0.254
154 HA2 GLY 20 2HA GLY 20 1.582 -4.596 1.663
155 HA3 GLY 20 3HA GLY 20 0.510 -4.598 0.271
156 H ARG 21 H ARG 21 3.615 -6.141 0.080
157 HA ARG 21 HA ARG 21 2.745 -8.740 0.869
158 HB2 ARG 21 2HB ARG 21 2.766 -9.804 -1.329
159 HB3 ARG 21 3HB ARG 21 1.518 -8.567 -1.249
160 HG2 ARG 21 2HG ARG 21 4.181 -7.807 -2.324
161 HG3 ARG 21 3HG ARG 21 3.114 -8.790 -3.329
162 HD2 ARG 21 2HD ARG 21 1.344 -6.967 -2.585
163 HD3 ARG 21 3HD ARG 21 2.797 -5.990 -2.381
164 HE ARG 21 HE ARG 21 3.125 -7.009 -4.848
165 HH11 ARG 21 1HH1 ARG 21 0.457 -5.386 -3.309
166 HH12 ARG 21 2HH1 ARG 21 -0.134 -4.684 -4.779
167 HH21 ARG 21 1HH2 ARG 21 2.357 -6.089 -6.790
168 HH22 ARG 21 2HH2 ARG 21 0.948 -5.085 -6.758
169 H THR 22 H THR 22 4.410 -10.365 0.580
170 HA THR 22 HA THR 22 7.079 -9.164 0.222
171 HB THR 22 HB THR 22 7.739 -11.255 1.687
172 HG1 THR 22 HG1 THR 22 6.007 -12.269 2.358
173 HG21 THR 22 3HG2 THR 22 7.130 -8.515 2.236
174 HG22 THR 22 1HG2 THR 22 8.322 -9.559 3.008
175 HG23 THR 22 2HG2 THR 22 6.672 -9.499 3.626
176 H GLU 23 H GLU 23 4.949 -11.781 -0.603
177 HA GLU 23 HA GLU 23 6.935 -13.464 -1.779
178 HB2 GLU 23 2HB GLU 23 4.779 -14.339 -0.976
179 HB3 GLU 23 3HB GLU 23 3.943 -13.407 -2.210
180 HG2 GLU 23 2HG GLU 23 4.142 -15.728 -2.867
181 HG3 GLU 23 3HG GLU 23 5.065 -14.690 -3.952
182 H GLY 24 H GLY 24 8.068 -12.878 -3.509
183 HA2 GLY 24 2HA GLY 24 8.197 -12.576 -5.865
184 HA3 GLY 24 3HA GLY 24 6.615 -11.814 -5.826
185 H VAL 25 H VAL 25 7.693 -10.285 -3.369
186 HA VAL 25 HA VAL 25 8.875 -8.120 -4.953
187 HB VAL 25 HB VAL 25 7.828 -7.957 -2.128
188 HG11 VAL 25 1HG1 VAL 25 9.379 -6.192 -3.523
189 HG12 VAL 25 2HG1 VAL 25 7.751 -5.599 -3.856
190 HG13 VAL 25 3HG1 VAL 25 8.305 -5.769 -2.190
191 HG21 VAL 25 3HG2 VAL 25 5.875 -8.490 -3.193
192 HG22 VAL 25 1HG2 VAL 25 5.901 -6.748 -3.470
193 HG23 VAL 25 2HG2 VAL 25 6.418 -7.851 -4.745
194 H VAL 26 H VAL 26 9.373 -9.911 -1.930
195 HA VAL 26 HA VAL 26 11.660 -8.656 -1.009
196 HB VAL 26 HB VAL 26 12.227 -10.796 0.105
197 HG11 VAL 26 1HG1 VAL 26 9.450 -9.690 0.205
198 HG12 VAL 26 2HG1 VAL 26 9.903 -11.052 1.231
199 HG13 VAL 26 3HG1 VAL 26 10.766 -9.519 1.366
200 HG21 VAL 26 3HG2 VAL 26 11.694 -12.482 -1.410
201 HG22 VAL 26 1HG2 VAL 26 10.429 -12.621 -0.189
202 HG23 VAL 26 2HG2 VAL 26 10.088 -11.825 -1.726
203 H GLU 27 H GLU 27 11.318 -11.118 -3.501
204 HA GLU 27 HA GLU 27 14.067 -11.703 -3.797
205 HB2 GLU 27 2HB GLU 27 11.782 -12.772 -4.796
206 HB3 GLU 27 3HB GLU 27 12.368 -11.897 -6.204
207 HG2 GLU 27 2HG GLU 27 14.301 -13.602 -4.742
208 HG3 GLU 27 3HG GLU 27 13.058 -14.400 -5.703
209 H THR 28 H THR 28 11.992 -9.215 -5.114
210 HA THR 28 HA THR 28 13.667 -8.331 -7.198
211 HB THR 28 HB THR 28 11.951 -6.391 -5.699
212 HG1 THR 28 HG1 THR 28 10.246 -7.410 -7.205
213 HG21 THR 28 3HG2 THR 28 12.456 -6.935 -8.626
214 HG22 THR 28 1HG2 THR 28 13.124 -5.610 -7.675
215 HG23 THR 28 2HG2 THR 28 11.392 -5.677 -7.999
216 H VAL 29 H VAL 29 13.115 -6.752 -4.043
217 HA VAL 29 HA VAL 29 15.167 -4.908 -4.176
218 HB VAL 29 HB VAL 29 14.248 -6.306 -1.662
219 HG11 VAL 29 1HG1 VAL 29 15.905 -5.051 -0.805
220 HG12 VAL 29 2HG1 VAL 29 15.981 -4.001 -2.221
221 HG13 VAL 29 3HG1 VAL 29 14.751 -3.730 -0.985
222 HG21 VAL 29 3HG2 VAL 29 13.013 -3.782 -1.979
223 HG22 VAL 29 1HG2 VAL 29 12.788 -4.673 -3.485
224 HG23 VAL 29 2HG2 VAL 29 12.254 -5.374 -1.957
225 H LEU 30 H LEU 30 15.271 -8.250 -3.013
226 HA LEU 30 HA LEU 30 17.845 -8.293 -1.975
227 HB2 LEU 30 2HB LEU 30 15.946 -10.106 -2.108
228 HB3 LEU 30 3HB LEU 30 16.844 -10.630 -3.531
229 HG LEU 30 HG LEU 30 18.873 -10.639 -1.872
230 HD11 LEU 30 1HD1 LEU 30 17.739 -11.580 0.353
231 HD12 LEU 30 2HD1 LEU 30 16.512 -10.401 -0.108
232 HD13 LEU 30 3HD1 LEU 30 18.179 -9.884 0.146
233 HD21 LEU 30 3HD2 LEU 30 16.813 -12.606 -2.538
234 HD22 LEU 30 1HD2 LEU 30 17.733 -12.991 -1.083
235 HD23 LEU 30 2HD2 LEU 30 18.572 -12.730 -2.612
236 H ALA 31 H ALA 31 16.787 -9.001 -5.297
237 HA ALA 31 HA ALA 31 19.284 -9.593 -6.383
238 HB1 ALA 31 1HB ALA 31 17.607 -10.131 -7.831
239 HB2 ALA 31 2HB ALA 31 16.690 -8.663 -7.491
240 HB3 ALA 31 3HB ALA 31 18.113 -8.592 -8.530
241 H ALA 32 H ALA 32 17.691 -6.489 -5.874
242 HA ALA 32 HA ALA 32 19.649 -4.957 -7.281
243 HB1 ALA 32 1HB ALA 32 17.922 -3.557 -7.175
244 HB2 ALA 32 2HB ALA 32 17.184 -4.451 -5.845
245 HB3 ALA 32 3HB ALA 32 18.409 -3.227 -5.512
246 H ASN 33 H ASN 33 19.273 -6.080 -3.997
247 HA ASN 33 HA ASN 33 21.856 -4.835 -3.333
248 HB2 ASN 33 2HB ASN 33 19.293 -4.822 -1.807
249 HB3 ASN 33 3HB ASN 33 20.796 -4.939 -0.896
250 HD21 ASN 33 1HD2 ASN 33 19.187 -3.039 -3.403
251 HD22 ASN 33 2HD2 ASN 33 19.909 -1.531 -2.970
252 HA PRO 34 HA PRO 34 22.042 -9.442 -2.778
253 HB2 PRO 34 2HB PRO 34 24.446 -9.727 -4.006
254 HB3 PRO 34 3HB PRO 34 22.912 -9.734 -4.884
255 HG2 PRO 34 2HG PRO 34 24.877 -7.505 -4.524
256 HG3 PRO 34 3HG PRO 34 24.000 -7.998 -5.984
257 HD2 PRO 34 2HD PRO 34 23.227 -5.898 -4.460
258 HD3 PRO 34 3HD PRO 34 22.070 -6.914 -5.343
259 H GLY 35 H GLY 35 23.011 -10.399 -1.070
260 HA2 GLY 35 2HA GLY 35 24.729 -10.812 0.481
261 HA3 GLY 35 3HA GLY 35 25.502 -9.312 -0.009
262 H LEU 36 H LEU 36 22.681 -8.076 0.283
263 HA LEU 36 HA LEU 36 23.104 -7.005 2.871
264 HB2 LEU 36 2HB LEU 36 21.851 -6.048 0.788
265 HB3 LEU 36 3HB LEU 36 20.457 -6.862 1.495
266 HG LEU 36 HG LEU 36 20.527 -4.485 2.075
267 HD11 LEU 36 1HD1 LEU 36 21.153 -5.969 4.592
268 HD12 LEU 36 2HD1 LEU 36 19.725 -6.383 3.645
269 HD13 LEU 36 3HD1 LEU 36 19.914 -4.752 4.286
270 HD21 LEU 36 3HD2 LEU 36 22.830 -4.837 3.891
271 HD22 LEU 36 1HD2 LEU 36 22.304 -3.421 2.979
272 HD23 LEU 36 2HD2 LEU 36 23.198 -4.708 2.170
273 H ALA 37 H ALA 37 20.951 -9.488 1.598
274 HA ALA 37 HA ALA 37 19.334 -9.834 3.862
275 HB1 ALA 37 1HB ALA 37 19.632 -12.353 2.649
276 HB2 ALA 37 2HB ALA 37 18.335 -11.182 2.411
277 HB3 ALA 37 3HB ALA 37 19.749 -11.157 1.358
278 H GLU 38 H GLU 38 22.603 -10.736 3.249
279 HA GLU 38 HA GLU 38 22.830 -12.901 5.048
280 HB2 GLU 38 2HB GLU 38 24.925 -10.932 4.113
281 HB3 GLU 38 3HB GLU 38 25.262 -12.431 4.967
282 HG2 GLU 38 2HG GLU 38 23.716 -12.472 2.413
283 HG3 GLU 38 3HG GLU 38 25.474 -12.347 2.392
284 H LEU 39 H LEU 39 22.370 -9.588 5.572
285 HA LEU 39 HA LEU 39 23.805 -9.020 7.861
286 HB2 LEU 39 2HB LEU 39 22.435 -7.398 6.628
287 HB3 LEU 39 3HB LEU 39 20.977 -8.185 7.230
288 HG LEU 39 HG LEU 39 21.751 -6.002 8.346
289 HD11 LEU 39 1HD1 LEU 39 21.350 -8.255 10.277
290 HD12 LEU 39 2HD1 LEU 39 20.070 -7.776 9.162
291 HD13 LEU 39 3HD1 LEU 39 20.706 -6.613 10.326
292 HD21 LEU 39 3HD2 LEU 39 24.136 -7.096 8.551
293 HD22 LEU 39 1HD2 LEU 39 23.463 -7.747 10.045
294 HD23 LEU 39 2HD2 LEU 39 23.525 -6.002 9.792
295 H GLY 40 H GLY 40 20.527 -10.416 7.675
296 HA2 GLY 40 2HA GLY 40 20.519 -12.424 9.363
297 HA3 GLY 40 3HA GLY 40 20.697 -11.110 10.516
298 H ALA 41 H ALA 41 18.719 -11.595 11.505
299 HA ALA 41 HA ALA 41 16.269 -11.817 10.115
300 HB1 ALA 41 1HB ALA 41 17.011 -11.329 12.970
301 HB2 ALA 41 2HB ALA 41 15.328 -11.209 12.453
302 HB3 ALA 41 3HB ALA 41 16.210 -12.722 12.243
303 H VAL 42 H VAL 42 17.022 -9.210 12.410
304 HA VAL 42 HA VAL 42 15.477 -7.372 10.734
305 HB VAL 42 HB VAL 42 14.918 -7.592 13.162
306 HG11 VAL 42 1HG1 VAL 42 16.343 -6.776 14.849
307 HG12 VAL 42 2HG1 VAL 42 17.359 -7.802 13.835
308 HG13 VAL 42 3HG1 VAL 42 17.443 -6.047 13.680
309 HG21 VAL 42 3HG2 VAL 42 14.088 -5.648 12.215
310 HG22 VAL 42 1HG2 VAL 42 15.044 -5.031 13.563
311 HG23 VAL 42 2HG2 VAL 42 15.695 -4.981 11.925
312 H LEU 43 H LEU 43 16.329 -5.583 9.802
313 HA LEU 43 HA LEU 43 19.180 -5.450 9.518
314 HB2 LEU 43 2HB LEU 43 17.172 -3.425 8.564
315 HB3 LEU 43 3HB LEU 43 18.788 -3.727 7.929
316 HG LEU 43 HG LEU 43 16.894 -5.990 7.788
317 HD11 LEU 43 1HD1 LEU 43 16.624 -3.763 5.797
318 HD12 LEU 43 2HD1 LEU 43 15.588 -3.864 7.221
319 HD13 LEU 43 3HD1 LEU 43 15.588 -5.170 6.036
320 HD21 LEU 43 3HD2 LEU 43 18.632 -6.636 6.551
321 HD22 LEU 43 1HD2 LEU 43 19.285 -5.000 6.472
322 HD23 LEU 43 2HD2 LEU 43 18.048 -5.511 5.323
323 HA PRO 44 HA PRO 44 20.182 -2.516 12.628
324 HB2 PRO 44 2HB PRO 44 22.240 -1.200 11.444
325 HB3 PRO 44 3HB PRO 44 22.382 -2.851 12.059
326 HG2 PRO 44 2HG PRO 44 21.937 -1.907 9.254
327 HG3 PRO 44 3HG PRO 44 23.011 -3.188 9.846
328 HD2 PRO 44 2HD PRO 44 20.600 -3.709 8.730
329 HD3 PRO 44 3HD PRO 44 21.298 -4.722 10.009
330 H HIS 45 H HIS 45 19.347 -0.619 13.245
331 HA HIS 45 HA HIS 45 17.722 0.964 11.692
332 HB2 HIS 45 2HB HIS 45 18.222 2.770 13.465
333 HB3 HIS 45 3HB HIS 45 17.514 1.252 14.009
334 HD1 HIS 45 HD1 HIS 45 18.849 -0.137 15.644
335 HD2 HIS 45 HD2 HIS 45 20.992 3.081 14.123
336 HE1 HIS 45 HE1 HIS 45 20.952 -0.019 17.019
337 H GLY 46 H GLY 46 18.350 1.815 9.795
338 HA2 GLY 46 2HA GLY 46 19.342 3.977 9.012
339 HA3 GLY 46 3HA GLY 46 20.823 3.434 9.787
340 H THR 47 H THR 47 19.206 0.842 8.410
341 HA THR 47 HA THR 47 21.230 0.414 6.470
342 HB THR 47 HB THR 47 18.552 -0.958 6.778
343 HG1 THR 47 HG1 THR 47 20.987 -2.131 7.515
344 HG21 THR 47 3HG2 THR 47 21.017 -1.797 5.246
345 HG22 THR 47 1HG2 THR 47 19.480 -1.294 4.544
346 HG23 THR 47 2HG2 THR 47 19.574 -2.781 5.487
347 H ALA 48 H ALA 48 21.396 1.207 4.485
348 HA ALA 48 HA ALA 48 19.176 2.675 3.324
349 HB1 ALA 48 1HB ALA 48 21.319 2.655 1.519
350 HB2 ALA 48 2HB ALA 48 20.846 3.954 2.615
351 HB3 ALA 48 3HB ALA 48 22.039 2.759 3.126
352 H VAL 49 H VAL 49 17.679 1.291 2.511
353 HA VAL 49 HA VAL 49 18.606 -0.742 0.592
354 HB VAL 49 HB VAL 49 15.930 -0.667 1.986
355 HG11 VAL 49 1HG1 VAL 49 15.374 -2.269 0.555
356 HG12 VAL 49 2HG1 VAL 49 16.968 -2.183 -0.196
357 HG13 VAL 49 3HG1 VAL 49 16.693 -3.262 1.173
358 HG21 VAL 49 3HG2 VAL 49 16.794 -2.444 3.430
359 HG22 VAL 49 1HG2 VAL 49 18.382 -2.282 2.680
360 HG23 VAL 49 2HG2 VAL 49 17.715 -0.952 3.628
361 H GLU 50 H GLU 50 17.787 -0.791 -1.456
362 HA GLU 50 HA GLU 50 16.349 1.597 -2.315
363 HB2 GLU 50 2HB GLU 50 18.331 1.039 -3.579
364 HB3 GLU 50 3HB GLU 50 17.739 -0.591 -3.866
365 HG2 GLU 50 2HG GLU 50 17.428 0.652 -5.861
366 HG3 GLU 50 3HG GLU 50 15.841 0.398 -5.139
367 H LEU 51 H LEU 51 14.353 1.596 -3.250
368 HA LEU 51 HA LEU 51 12.864 -0.936 -3.107
369 HB2 LEU 51 2HB LEU 51 11.743 1.858 -3.159
370 HB3 LEU 51 3HB LEU 51 10.869 0.364 -2.828
371 HG LEU 51 HG LEU 51 13.044 1.451 -1.048
372 HD11 LEU 51 1HD1 LEU 51 11.294 3.079 -1.061
373 HD12 LEU 51 2HD1 LEU 51 11.164 2.145 0.429
374 HD13 LEU 51 3HD1 LEU 51 10.059 1.829 -0.909
375 HD21 LEU 51 3HD2 LEU 51 10.860 -0.501 -0.378
376 HD22 LEU 51 1HD2 LEU 51 12.337 -0.149 0.521
377 HD23 LEU 51 2HD2 LEU 51 12.424 -1.016 -1.012
378 HA PRO 52 HA PRO 52 13.156 -0.328 -7.617
379 HB2 PRO 52 2HB PRO 52 12.855 -2.963 -8.194
380 HB3 PRO 52 3HB PRO 52 14.408 -2.250 -7.744
381 HG2 PRO 52 2HG PRO 52 12.467 -3.782 -6.057
382 HG3 PRO 52 3HG PRO 52 14.235 -3.904 -6.118
383 HD2 PRO 52 2HD PRO 52 12.935 -2.540 -4.174
384 HD3 PRO 52 3HD PRO 52 14.534 -2.056 -4.774
385 H ASP 53 H ASP 53 11.574 -0.379 -9.210
386 HA ASP 53 HA ASP 53 9.469 -0.308 -10.069
387 HB2 ASP 53 2HB ASP 53 8.983 -2.654 -8.220
388 HB3 ASP 53 3HB ASP 53 7.988 -2.199 -9.600
389 H VAL 54 H VAL 54 9.744 1.651 -8.375
390 HA VAL 54 HA VAL 54 7.258 1.642 -6.794
391 HB VAL 54 HB VAL 54 9.887 2.918 -6.028
392 HG11 VAL 54 1HG1 VAL 54 8.436 3.370 -3.881
393 HG12 VAL 54 2HG1 VAL 54 8.415 4.491 -5.243
394 HG13 VAL 54 3HG1 VAL 54 7.107 3.324 -5.039
395 HG21 VAL 54 3HG2 VAL 54 9.872 0.572 -5.528
396 HG22 VAL 54 1HG2 VAL 54 9.647 1.461 -4.021
397 HG23 VAL 54 2HG2 VAL 54 8.268 0.688 -4.804
398 H GLN 55 H GLN 55 6.028 3.498 -6.845
399 HA GLN 55 HA GLN 55 6.337 5.164 -9.135
400 HB2 GLN 55 2HB GLN 55 4.295 6.229 -8.428
401 HB3 GLN 55 3HB GLN 55 4.136 4.494 -8.191
402 HG2 GLN 55 2HG GLN 55 4.531 4.741 -5.823
403 HG3 GLN 55 3HG GLN 55 4.820 6.468 -6.026
404 HE21 GLN 55 1HE2 GLN 55 2.353 4.033 -6.787
405 HE22 GLN 55 2HE2 GLN 55 1.001 5.026 -6.373
406 H THR 56 H THR 56 5.620 7.674 -8.384
407 HA THR 56 HA THR 56 6.434 9.672 -7.652
408 HB THR 56 HB THR 56 7.936 8.238 -5.474
409 HG1 THR 56 HG1 THR 56 6.062 8.026 -4.344
410 HG21 THR 56 3HG2 THR 56 6.923 10.983 -5.976
411 HG22 THR 56 1HG2 THR 56 8.409 10.452 -5.190
412 HG23 THR 56 2HG2 THR 56 6.880 10.392 -4.315
413 H ALA 57 H ALA 57 7.851 8.274 -9.660
414 HA ALA 57 HA ALA 57 10.448 9.555 -9.370
415 HB1 ALA 57 1HB ALA 57 10.713 6.871 -10.503
416 HB2 ALA 57 2HB ALA 57 11.737 7.724 -9.347
417 HB3 ALA 57 3HB ALA 57 10.284 6.893 -8.792
418 HA PRO 58 HA PRO 58 9.986 10.476 -13.635
419 HB2 PRO 58 2HB PRO 58 12.542 10.344 -14.542
420 HB3 PRO 58 3HB PRO 58 11.959 11.646 -13.498
421 HG2 PRO 58 2HG PRO 58 13.516 9.193 -12.777
422 HG3 PRO 58 3HG PRO 58 13.733 10.861 -12.215
423 HD2 PRO 58 2HD PRO 58 12.467 8.979 -10.736
424 HD3 PRO 58 3HD PRO 58 12.026 10.698 -10.675
425 H VAL 59 H VAL 59 8.788 8.473 -14.057
426 HA VAL 59 HA VAL 59 10.351 6.631 -15.742
427 HB VAL 59 HB VAL 59 8.884 4.787 -15.064
428 HG11 VAL 59 1HG1 VAL 59 9.672 4.651 -12.644
429 HG12 VAL 59 2HG1 VAL 59 10.913 4.863 -13.881
430 HG13 VAL 59 3HG1 VAL 59 10.391 6.239 -12.909
431 HG21 VAL 59 3HG2 VAL 59 7.551 6.957 -13.537
432 HG22 VAL 59 1HG2 VAL 59 6.857 5.572 -14.379
433 HG23 VAL 59 2HG2 VAL 59 7.615 5.355 -12.802
434 H ALA 60 H ALA 60 8.516 5.169 -16.941
435 HA ALA 60 HA ALA 60 6.920 7.139 -18.418
436 HB1 ALA 60 1HB ALA 60 7.659 6.105 -20.234
437 HB2 ALA 60 2HB ALA 60 8.561 4.974 -19.225
438 HB3 ALA 60 3HB ALA 60 6.903 4.603 -19.700
439 H GLU 61 H GLU 61 4.954 5.837 -19.545
440 HA GLU 61 HA GLU 61 3.133 5.330 -17.412
441 HB2 GLU 61 2HB GLU 61 2.652 6.356 -19.729
442 HB3 GLU 61 3HB GLU 61 2.595 4.695 -20.302
443 HG2 GLU 61 2HG GLU 61 0.376 5.627 -19.784
444 HG3 GLU 61 3HG GLU 61 0.765 4.190 -18.839
445 H THR 62 H THR 62 1.727 3.376 -17.351
446 HA THR 62 HA THR 62 3.100 0.924 -18.189
447 HB THR 62 HB THR 62 2.442 -0.059 -15.908
448 HG1 THR 62 HG1 THR 62 2.511 2.702 -15.199
449 HG21 THR 62 3HG2 THR 62 4.740 1.523 -16.711
450 HG22 THR 62 1HG2 THR 62 4.677 -0.004 -15.831
451 HG23 THR 62 2HG2 THR 62 4.517 1.522 -14.962
452 H VAL 63 H VAL 63 1.694 -1.019 -17.951
453 HA VAL 63 HA VAL 63 -1.093 -0.797 -17.551
454 HB VAL 63 HB VAL 63 -0.970 0.471 -19.672
455 HG11 VAL 63 1HG1 VAL 63 -0.387 -1.971 -21.233
456 HG12 VAL 63 2HG1 VAL 63 0.009 -0.284 -21.570
457 HG13 VAL 63 3HG1 VAL 63 0.978 -1.206 -20.420
458 HG21 VAL 63 3HG2 VAL 63 -2.322 -1.977 -20.564
459 HG22 VAL 63 1HG2 VAL 63 -2.770 -1.432 -18.948
460 HG23 VAL 63 2HG2 VAL 63 -2.959 -0.349 -20.327
461 H ASN 64 H ASN 64 -2.043 -2.784 -17.430
462 HA ASN 64 HA ASN 64 -0.412 -5.089 -18.273
463 HB2 ASN 64 2HB ASN 64 -0.951 -6.261 -16.289
464 HB3 ASN 64 3HB ASN 64 -0.514 -4.638 -15.760
465 HD21 ASN 64 1HD2 ASN 64 -2.153 -6.640 -14.438
466 HD22 ASN 64 2HD2 ASN 64 -3.693 -5.904 -14.174
467 H LEU 65 H LEU 65 -1.813 -7.155 -18.293
468 HA LEU 65 HA LEU 65 -4.563 -6.653 -19.122
469 HB2 LEU 65 2HB LEU 65 -2.425 -7.820 -20.879
470 HB3 LEU 65 3HB LEU 65 -4.136 -8.143 -21.149
471 HG LEU 65 HG LEU 65 -3.032 -5.347 -21.076
472 HD11 LEU 65 1HD1 LEU 65 -2.882 -7.380 -23.224
473 HD12 LEU 65 2HD1 LEU 65 -1.815 -6.023 -22.866
474 HD13 LEU 65 3HD1 LEU 65 -3.351 -5.744 -23.688
475 HD21 LEU 65 3HD2 LEU 65 -5.102 -5.246 -22.730
476 HD22 LEU 65 1HD2 LEU 65 -5.295 -5.113 -20.982
477 HD23 LEU 65 2HD2 LEU 65 -5.603 -6.651 -21.788
478 H TRP 66 H TRP 66 -5.913 -8.255 -18.547
479 HA TRP 66 HA TRP 66 -5.119 -10.266 -16.790
480 HB2 TRP 66 2HB TRP 66 -7.609 -10.172 -18.507
481 HB3 TRP 66 3HB TRP 66 -7.381 -11.188 -17.086
482 HD1 TRP 66 HD1 TRP 66 -6.138 -9.019 -15.123
483 HE1 TRP 66 HE1 TRP 66 -7.634 -7.139 -14.202
484 HE3 TRP 66 HE3 TRP 66 -9.825 -9.109 -18.663
485 HZ2 TRP 66 HZ2 TRP 66 -10.058 -5.864 -14.885
486 HZ3 TRP 66 HZ3 TRP 66 -11.698 -7.527 -18.455
487 HH2 TRP 66 HH2 TRP 66 -11.810 -5.939 -16.604
488 H GLU 67 H GLU 67 -4.510 -12.354 -17.009
489 HA GLU 67 HA GLU 67 -4.573 -13.555 -19.687
490 HB2 GLU 67 2HB GLU 67 -2.177 -13.278 -17.883
491 HB3 GLU 67 3HB GLU 67 -2.261 -14.512 -19.132
492 HG2 GLU 67 2HG GLU 67 -2.575 -12.747 -20.819
493 HG3 GLU 67 3HG GLU 67 -2.401 -11.535 -19.551
494 H VAL 68 H VAL 68 -6.404 -14.124 -17.734
495 HA VAL 68 HA VAL 68 -5.639 -16.863 -16.977
496 HB VAL 68 HB VAL 68 -7.272 -14.979 -15.269
497 HG11 VAL 68 1HG1 VAL 68 -8.167 -16.993 -14.691
498 HG12 VAL 68 2HG1 VAL 68 -6.723 -17.894 -15.157
499 HG13 VAL 68 3HG1 VAL 68 -6.755 -17.002 -13.635
500 HG21 VAL 68 3HG2 VAL 68 -5.040 -14.294 -15.035
501 HG22 VAL 68 1HG2 VAL 68 -5.321 -15.372 -13.668
502 HG23 VAL 68 2HG2 VAL 68 -4.436 -15.950 -15.079
503 H GLU 69 H GLU 69 -6.733 -17.553 -18.882
504 HA GLU 69 HA GLU 69 -9.551 -17.991 -18.449
505 HB2 GLU 69 2HB GLU 69 -9.152 -15.735 -19.742
506 HB3 GLU 69 3HB GLU 69 -8.873 -16.804 -21.110
507 HG2 GLU 69 2HG GLU 69 -11.101 -17.821 -20.689
508 HG3 GLU 69 3HG GLU 69 -11.372 -16.597 -19.449
509 H HIS 70 H HIS 70 -10.023 -19.997 -19.055
510 HA HIS 70 HA HIS 70 -8.130 -21.414 -20.783
511 HB2 HIS 70 2HB HIS 70 -9.198 -23.467 -19.920
512 HB3 HIS 70 3HB HIS 70 -8.579 -22.450 -18.622
513 HD1 HIS 70 HD1 HIS 70 -11.845 -23.397 -20.277
514 HD2 HIS 70 HD2 HIS 70 -10.438 -21.693 -16.759
515 HE1 HIS 70 HE1 HIS 70 -13.852 -23.203 -18.775
516 H HIS 71 H HIS 71 -11.417 -20.307 -20.636
517 HA HIS 71 HA HIS 71 -12.165 -21.833 -23.009
518 HB2 HIS 71 2HB HIS 71 -13.686 -21.492 -20.966
519 HB3 HIS 71 3HB HIS 71 -13.911 -19.850 -21.561
520 HD1 HIS 71 HD1 HIS 71 -14.476 -20.077 -24.418
521 HD2 HIS 71 HD2 HIS 71 -15.803 -22.962 -21.740
522 HE1 HIS 71 HE1 HIS 71 -16.398 -21.224 -25.564
Start of MODEL 19
1 H1 MET 1 H MET 1 12.587 -1.737 -12.722
2 HA MET 1 HA MET 1 14.653 0.192 -11.910
3 HB2 MET 1 2HB MET 1 11.758 0.110 -11.133
4 HB3 MET 1 3HB MET 1 12.950 0.754 -10.012
5 HG2 MET 1 2HG MET 1 12.168 2.627 -11.129
6 HG3 MET 1 3HG MET 1 13.684 2.255 -11.945
7 HE1 MET 1 3HE MET 1 9.611 1.110 -12.763
8 HE2 MET 1 1HE MET 1 10.102 2.522 -11.828
9 HE3 MET 1 2HE MET 1 9.598 2.709 -13.507
10 H LYS 2 H LYS 2 15.479 -2.246 -11.835
11 HA LYS 2 HA LYS 2 15.122 -3.141 -9.051
12 HB2 LYS 2 2HB LYS 2 15.467 -5.437 -9.777
13 HB3 LYS 2 3HB LYS 2 14.107 -4.729 -10.638
14 HG2 LYS 2 2HG LYS 2 15.950 -4.185 -12.433
15 HG3 LYS 2 3HG LYS 2 16.785 -5.527 -11.647
16 HD2 LYS 2 2HD LYS 2 13.935 -5.734 -12.585
17 HD3 LYS 2 3HD LYS 2 15.304 -6.097 -13.639
18 HE2 LYS 2 2HE LYS 2 16.009 -7.885 -12.261
19 HE3 LYS 2 3HE LYS 2 14.943 -7.389 -10.947
20 HZ1 LYS 2 3HZ LYS 2 14.403 -9.173 -13.031
21 HZ2 LYS 2 1HZ LYS 2 13.385 -7.836 -13.229
22 HZ3 LYS 2 2HZ LYS 2 13.379 -8.695 -11.772
23 H THR 3 H THR 3 16.967 -3.987 -7.999
24 HA THR 3 HA THR 3 19.540 -3.600 -9.347
25 HB THR 3 HB THR 3 19.231 -1.520 -8.170
26 HG1 THR 3 HG1 THR 3 20.953 -1.975 -6.425
27 HG21 THR 3 3HG2 THR 3 18.878 -3.093 -5.622
28 HG22 THR 3 1HG2 THR 3 17.532 -2.437 -6.552
29 HG23 THR 3 2HG2 THR 3 18.727 -1.351 -5.844
30 H PHE 4 H PHE 4 21.354 -4.579 -8.152
31 HA PHE 4 HA PHE 4 20.624 -7.181 -7.196
32 HB2 PHE 4 2HB PHE 4 23.383 -5.958 -7.144
33 HB3 PHE 4 3HB PHE 4 22.960 -7.666 -7.197
34 HD1 PHE 4 HD1 PHE 4 21.061 -7.906 -9.316
35 HD2 PHE 4 HD2 PHE 4 24.489 -5.395 -9.072
36 HE1 PHE 4 HE1 PHE 4 21.203 -7.866 -11.773
37 HE2 PHE 4 HE2 PHE 4 24.635 -5.350 -11.528
38 HZ PHE 4 HZ PHE 4 22.991 -6.586 -12.881
39 H ALA 5 H ALA 5 20.711 -7.994 -5.154
40 HA ALA 5 HA ALA 5 20.949 -6.032 -2.995
41 HB1 ALA 5 1HB ALA 5 19.854 -8.841 -2.905
42 HB2 ALA 5 2HB ALA 5 19.766 -7.636 -1.619
43 HB3 ALA 5 3HB ALA 5 18.892 -7.379 -3.129
44 H LEU 6 H LEU 6 22.969 -5.843 -2.250
45 HA LEU 6 HA LEU 6 24.595 -8.269 -1.933
46 HB2 LEU 6 2HB LEU 6 25.637 -5.482 -1.623
47 HB3 LEU 6 3HB LEU 6 26.507 -6.951 -2.061
48 HG LEU 6 HG LEU 6 24.534 -5.546 -3.859
49 HD11 LEU 6 1HD1 LEU 6 26.900 -4.488 -3.149
50 HD12 LEU 6 2HD1 LEU 6 26.181 -4.290 -4.746
51 HD13 LEU 6 3HD1 LEU 6 27.415 -5.523 -4.481
52 HD21 LEU 6 3HD2 LEU 6 26.525 -7.222 -5.106
53 HD22 LEU 6 1HD2 LEU 6 24.767 -7.264 -5.250
54 HD23 LEU 6 2HD2 LEU 6 25.565 -8.132 -3.938
55 H GLN 7 H GLN 7 26.333 -7.694 -0.026
56 HA GLN 7 HA GLN 7 25.027 -8.169 2.359
57 HB2 GLN 7 2HB GLN 7 27.708 -7.777 1.512
58 HB3 GLN 7 3HB GLN 7 27.451 -6.763 2.926
59 HG2 GLN 7 2HG GLN 7 26.437 -8.880 3.986
60 HG3 GLN 7 3HG GLN 7 27.257 -9.736 2.680
61 HE21 GLN 7 1HE2 GLN 7 29.583 -8.383 2.435
62 HE22 GLN 7 2HE2 GLN 7 30.513 -8.515 3.886
63 H GLY 8 H GLY 8 23.816 -6.957 3.650
64 HA2 GLY 8 2HA GLY 8 22.987 -5.126 4.770
65 HA3 GLY 8 3HA GLY 8 24.460 -4.273 4.333
66 H ASP 9 H ASP 9 22.694 -5.630 1.734
67 HA ASP 9 HA ASP 9 21.510 -2.998 1.136
68 HB2 ASP 9 2HB ASP 9 23.102 -4.843 -0.611
69 HB3 ASP 9 3HB ASP 9 21.888 -3.790 -1.330
70 H THR 10 H THR 10 20.398 -5.475 2.369
71 HA THR 10 HA THR 10 18.688 -6.718 0.457
72 HB THR 10 HB THR 10 17.716 -7.897 2.247
73 HG1 THR 10 HG1 THR 10 18.674 -5.815 3.946
74 HG21 THR 10 3HG2 THR 10 20.341 -8.002 1.906
75 HG22 THR 10 1HG2 THR 10 19.542 -8.914 3.186
76 HG23 THR 10 2HG2 THR 10 20.339 -7.385 3.558
77 H LEU 11 H LEU 11 16.199 -6.765 1.233
78 HA LEU 11 HA LEU 11 15.015 -4.465 0.302
79 HB2 LEU 11 2HB LEU 11 13.771 -6.289 2.347
80 HB3 LEU 11 3HB LEU 11 12.940 -5.296 1.152
81 HG LEU 11 HG LEU 11 14.614 -7.744 0.597
82 HD11 LEU 11 1HD1 LEU 11 12.528 -8.406 1.503
83 HD12 LEU 11 2HD1 LEU 11 12.404 -8.601 -0.245
84 HD13 LEU 11 3HD1 LEU 11 11.653 -7.213 0.542
85 HD21 LEU 11 3HD2 LEU 11 13.380 -7.282 -1.713
86 HD22 LEU 11 1HD2 LEU 11 14.964 -6.605 -1.337
87 HD23 LEU 11 2HD2 LEU 11 13.516 -5.616 -1.150
88 H ASP 12 H ASP 12 15.641 -5.365 3.676
89 HA ASP 12 HA ASP 12 14.405 -3.236 4.949
90 HB2 ASP 12 2HB ASP 12 15.205 -4.991 6.314
91 HB3 ASP 12 3HB ASP 12 16.838 -4.863 5.664
92 H ALA 13 H ALA 13 17.489 -3.372 3.297
93 HA ALA 13 HA ALA 13 18.247 -0.713 4.184
94 HB1 ALA 13 1HB ALA 13 19.582 -2.973 2.945
95 HB2 ALA 13 2HB ALA 13 20.013 -1.438 2.190
96 HB3 ALA 13 3HB ALA 13 20.245 -1.664 3.924
97 H ILE 14 H ILE 14 17.749 -2.272 1.010
98 HA ILE 14 HA ILE 14 17.833 -0.046 -0.595
99 HB ILE 14 HB ILE 14 15.998 -2.424 -0.912
100 HG12 ILE 14 2HG1 ILE 14 18.658 -1.947 -2.250
101 HG13 ILE 14 3HG1 ILE 14 18.521 -2.806 -0.719
102 HG21 ILE 14 1HG2 ILE 14 16.000 -1.838 -3.303
103 HG22 ILE 14 2HG2 ILE 14 15.264 -0.585 -2.304
104 HG23 ILE 14 3HG2 ILE 14 16.901 -0.369 -2.925
105 HD11 ILE 14 3HD1 ILE 14 17.052 -4.449 -1.805
106 HD12 ILE 14 1HD1 ILE 14 17.278 -3.608 -3.338
107 HD13 ILE 14 2HD1 ILE 14 18.653 -4.372 -2.540
108 H CYS 15 H CYS 15 14.954 -1.398 1.005
109 HA CYS 15 HA CYS 15 13.065 0.401 0.092
110 HB2 CYS 15 2HB CYS 15 13.296 -1.087 2.702
111 HB3 CYS 15 3HB CYS 15 11.906 -0.075 2.328
112 HG CYS 15 HG CYS 15 10.862 -2.437 1.715
113 H VAL 16 H VAL 16 15.454 0.777 2.626
114 HA VAL 16 HA VAL 16 14.354 3.308 3.511
115 HB VAL 16 HB VAL 16 16.937 1.942 4.284
116 HG11 VAL 16 1HG1 VAL 16 16.361 3.558 6.351
117 HG12 VAL 16 2HG1 VAL 16 17.399 4.035 5.006
118 HG13 VAL 16 3HG1 VAL 16 15.703 4.519 5.027
119 HG21 VAL 16 3HG2 VAL 16 14.747 0.768 4.828
120 HG22 VAL 16 1HG2 VAL 16 15.829 1.097 6.182
121 HG23 VAL 16 2HG2 VAL 16 14.417 2.118 5.914
122 H ARG 17 H ARG 17 16.660 2.174 1.227
123 HA ARG 17 HA ARG 17 18.077 4.697 1.052
124 HB2 ARG 17 2HB ARG 17 18.260 2.218 -0.671
125 HB3 ARG 17 3HB ARG 17 19.338 3.606 -0.759
126 HG2 ARG 17 2HG ARG 17 19.496 2.927 1.882
127 HG3 ARG 17 3HG ARG 17 19.320 1.356 1.097
128 HD2 ARG 17 2HD ARG 17 21.279 1.595 -0.111
129 HD3 ARG 17 3HD ARG 17 21.262 3.354 0.017
130 HE ARG 17 HE ARG 17 22.400 1.493 1.882
131 HH11 ARG 17 1HH1 ARG 17 21.045 4.675 1.493
132 HH12 ARG 17 2HH1 ARG 17 21.864 5.335 2.869
133 HH21 ARG 17 1HH2 ARG 17 23.485 2.349 3.697
134 HH22 ARG 17 2HH2 ARG 17 23.252 4.011 4.122
135 H TYR 18 H TYR 18 15.312 3.237 -0.322
136 HA TYR 18 HA TYR 18 15.309 5.156 -2.551
137 HB2 TYR 18 2HB TYR 18 13.981 2.492 -2.151
138 HB3 TYR 18 3HB TYR 18 13.340 3.641 -3.321
139 HD1 TYR 18 HD1 TYR 18 16.589 2.059 -2.363
140 HD2 TYR 18 HD2 TYR 18 14.109 3.522 -5.496
141 HE1 TYR 18 HE1 TYR 18 18.229 1.275 -4.020
142 HE2 TYR 18 HE2 TYR 18 15.742 2.741 -7.161
143 HH TYR 18 HH TYR 18 18.604 2.238 -6.835
144 H TYR 19 H TYR 19 12.913 3.599 -0.411
145 HA TYR 19 HA TYR 19 11.200 5.933 -0.603
146 HB2 TYR 19 2HB TYR 19 10.708 3.497 1.101
147 HB3 TYR 19 3HB TYR 19 9.526 4.625 0.446
148 HD1 TYR 19 HD1 TYR 19 9.092 4.625 -2.035
149 HD2 TYR 19 HD2 TYR 19 11.385 1.594 -0.123
150 HE1 TYR 19 HE1 TYR 19 8.765 3.159 -3.982
151 HE2 TYR 19 HE2 TYR 19 11.066 0.120 -2.065
152 HH TYR 19 HH TYR 19 8.862 0.291 -4.161
153 H GLY 20 H GLY 20 13.230 4.314 1.771
154 HA2 GLY 20 2HA GLY 20 14.298 5.390 3.569
155 HA3 GLY 20 3HA GLY 20 13.173 6.730 3.406
156 H ARG 21 H ARG 21 11.891 3.527 3.442
157 HA ARG 21 HA ARG 21 11.521 3.323 6.264
158 HB2 ARG 21 2HB ARG 21 9.094 3.642 6.313
159 HB3 ARG 21 3HB ARG 21 9.915 5.117 5.820
160 HG2 ARG 21 2HG ARG 21 8.916 3.245 3.729
161 HG3 ARG 21 3HG ARG 21 7.776 4.298 4.570
162 HD2 ARG 21 2HD ARG 21 9.671 6.093 3.982
163 HD3 ARG 21 3HD ARG 21 9.930 4.964 2.652
164 HE ARG 21 HE ARG 21 7.972 5.683 1.719
165 HH11 ARG 21 1HH1 ARG 21 8.039 6.628 5.069
166 HH12 ARG 21 2HH1 ARG 21 6.596 7.582 4.964
167 HH21 ARG 21 1HH2 ARG 21 6.072 6.936 1.567
168 HH22 ARG 21 2HH2 ARG 21 5.478 7.755 2.972
169 H THR 22 H THR 22 10.245 1.435 6.862
170 HA THR 22 HA THR 22 10.142 -0.546 4.681
171 HB THR 22 HB THR 22 10.274 -2.131 6.842
172 HG1 THR 22 HG1 THR 22 11.898 -1.129 8.238
173 HG21 THR 22 3HG2 THR 22 12.031 -1.289 4.790
174 HG22 THR 22 1HG2 THR 22 12.087 -2.783 5.725
175 HG23 THR 22 2HG2 THR 22 12.967 -1.360 6.284
176 H GLU 23 H GLU 23 8.433 0.965 7.277
177 HA GLU 23 HA GLU 23 6.365 -0.970 7.555
178 HB2 GLU 23 2HB GLU 23 7.021 0.894 9.192
179 HB3 GLU 23 3HB GLU 23 6.081 1.965 8.162
180 HG2 GLU 23 2HG GLU 23 4.712 1.273 9.986
181 HG3 GLU 23 3HG GLU 23 4.114 0.504 8.517
182 H GLY 24 H GLY 24 5.028 -1.502 5.958
183 HA2 GLY 24 2HA GLY 24 3.162 -1.059 4.585
184 HA3 GLY 24 3HA GLY 24 3.628 0.635 4.536
185 H VAL 25 H VAL 25 6.470 -0.416 3.961
186 HA VAL 25 HA VAL 25 6.085 -0.531 1.061
187 HB VAL 25 HB VAL 25 8.679 -0.165 2.561
188 HG11 VAL 25 1HG1 VAL 25 8.261 -0.787 -0.067
189 HG12 VAL 25 2HG1 VAL 25 8.364 0.974 -0.114
190 HG13 VAL 25 3HG1 VAL 25 9.688 0.030 0.571
191 HG21 VAL 25 3HG2 VAL 25 8.255 2.280 1.696
192 HG22 VAL 25 1HG2 VAL 25 6.564 1.784 1.782
193 HG23 VAL 25 2HG2 VAL 25 7.572 1.733 3.228
194 H VAL 26 H VAL 26 7.651 -2.280 3.704
195 HA VAL 26 HA VAL 26 9.002 -4.224 2.256
196 HB VAL 26 HB VAL 26 8.805 -5.661 4.252
197 HG11 VAL 26 1HG1 VAL 26 10.593 -4.246 4.496
198 HG12 VAL 26 2HG1 VAL 26 9.591 -2.794 4.457
199 HG13 VAL 26 3HG1 VAL 26 9.636 -3.797 5.907
200 HG21 VAL 26 3HG2 VAL 26 6.689 -3.681 4.938
201 HG22 VAL 26 1HG2 VAL 26 6.715 -5.431 5.160
202 HG23 VAL 26 2HG2 VAL 26 7.640 -4.390 6.243
203 H GLU 27 H GLU 27 5.599 -3.941 3.003
204 HA GLU 27 HA GLU 27 4.895 -6.613 2.304
205 HB2 GLU 27 2HB GLU 27 3.423 -4.090 2.876
206 HB3 GLU 27 3HB GLU 27 2.569 -5.347 1.993
207 HG2 GLU 27 2HG GLU 27 3.999 -5.984 4.538
208 HG3 GLU 27 3HG GLU 27 2.391 -5.263 4.563
209 H THR 28 H THR 28 5.440 -3.697 0.523
210 HA THR 28 HA THR 28 4.020 -4.488 -1.836
211 HB THR 28 HB THR 28 6.234 -2.524 -2.064
212 HG1 THR 28 HG1 THR 28 4.669 -0.968 -1.046
213 HG21 THR 28 3HG2 THR 28 4.206 -3.203 -3.677
214 HG22 THR 28 1HG2 THR 28 4.908 -1.586 -3.655
215 HG23 THR 28 2HG2 THR 28 3.421 -1.914 -2.765
216 H VAL 29 H VAL 29 7.513 -3.996 -1.274
217 HA VAL 29 HA VAL 29 8.418 -5.222 -3.591
218 HB VAL 29 HB VAL 29 9.799 -5.155 -0.904
219 HG11 VAL 29 1HG1 VAL 29 11.012 -6.702 -2.143
220 HG12 VAL 29 2HG1 VAL 29 10.739 -5.847 -3.663
221 HG13 VAL 29 3HG1 VAL 29 11.854 -5.187 -2.466
222 HG21 VAL 29 3HG2 VAL 29 9.070 -3.056 -2.634
223 HG22 VAL 29 1HG2 VAL 29 10.124 -2.982 -1.222
224 HG23 VAL 29 2HG2 VAL 29 10.809 -3.283 -2.819
225 H LEU 30 H LEU 30 7.937 -6.656 -0.373
226 HA LEU 30 HA LEU 30 8.845 -9.214 -0.867
227 HB2 LEU 30 2HB LEU 30 8.287 -8.677 1.344
228 HB3 LEU 30 3HB LEU 30 6.662 -8.162 0.899
229 HG LEU 30 HG LEU 30 6.039 -10.499 0.493
230 HD11 LEU 30 1HD1 LEU 30 8.909 -10.875 0.726
231 HD12 LEU 30 2HD1 LEU 30 7.683 -11.920 0.008
232 HD13 LEU 30 3HD1 LEU 30 7.993 -11.988 1.742
233 HD21 LEU 30 3HD2 LEU 30 7.120 -10.862 3.152
234 HD22 LEU 30 1HD2 LEU 30 5.446 -10.671 2.630
235 HD23 LEU 30 2HD2 LEU 30 6.442 -9.247 2.937
236 H ALA 31 H ALA 31 5.557 -7.947 -1.353
237 HA ALA 31 HA ALA 31 4.354 -10.278 -2.275
238 HB1 ALA 31 1HB ALA 31 2.616 -8.902 -2.264
239 HB2 ALA 31 2HB ALA 31 3.692 -7.509 -2.132
240 HB3 ALA 31 3HB ALA 31 3.236 -8.124 -3.721
241 H ALA 32 H ALA 32 6.248 -7.862 -4.016
242 HA ALA 32 HA ALA 32 5.775 -8.969 -6.603
243 HB1 ALA 32 1HB ALA 32 7.242 -6.740 -5.481
244 HB2 ALA 32 2HB ALA 32 8.148 -7.544 -6.764
245 HB3 ALA 32 3HB ALA 32 6.526 -6.929 -7.082
246 H ASN 33 H ASN 33 8.112 -9.526 -4.071
247 HA ASN 33 HA ASN 33 9.321 -11.639 -5.725
248 HB2 ASN 33 2HB ASN 33 10.645 -9.513 -4.096
249 HB3 ASN 33 3HB ASN 33 11.408 -11.097 -4.189
250 HD21 ASN 33 1HD2 ASN 33 10.276 -8.361 -6.062
251 HD22 ASN 33 2HD2 ASN 33 11.288 -8.641 -7.434
252 HA PRO 34 HA PRO 34 7.604 -13.397 -1.788
253 HB2 PRO 34 2HB PRO 34 6.439 -15.540 -2.981
254 HB3 PRO 34 3HB PRO 34 5.635 -13.974 -2.822
255 HG2 PRO 34 2HG PRO 34 7.063 -15.138 -5.181
256 HG3 PRO 34 3HG PRO 34 5.528 -14.252 -5.128
257 HD2 PRO 34 2HD PRO 34 7.859 -13.087 -5.866
258 HD3 PRO 34 3HD PRO 34 6.573 -12.200 -5.024
259 H GLY 35 H GLY 35 8.612 -14.929 -0.584
260 HA2 GLY 35 2HA GLY 35 9.810 -16.907 -0.173
261 HA3 GLY 35 3HA GLY 35 10.145 -17.036 -1.893
262 H LEU 36 H LEU 36 10.915 -14.031 -1.636
263 HA LEU 36 HA LEU 36 13.725 -14.562 -1.246
264 HB2 LEU 36 2HB LEU 36 12.535 -12.994 -2.974
265 HB3 LEU 36 3HB LEU 36 12.614 -11.824 -1.659
266 HG LEU 36 HG LEU 36 14.457 -11.556 -3.251
267 HD11 LEU 36 1HD1 LEU 36 14.626 -11.208 -0.688
268 HD12 LEU 36 2HD1 LEU 36 16.094 -11.183 -1.663
269 HD13 LEU 36 3HD1 LEU 36 15.675 -12.625 -0.739
270 HD21 LEU 36 3HD2 LEU 36 14.519 -14.076 -3.743
271 HD22 LEU 36 1HD2 LEU 36 15.552 -14.187 -2.318
272 HD23 LEU 36 2HD2 LEU 36 16.050 -13.201 -3.693
273 H ALA 37 H ALA 37 11.154 -12.826 0.410
274 HA ALA 37 HA ALA 37 12.778 -11.501 2.307
275 HB1 ALA 37 1HB ALA 37 9.871 -12.284 2.362
276 HB2 ALA 37 2HB ALA 37 10.646 -11.313 3.615
277 HB3 ALA 37 3HB ALA 37 10.560 -10.711 1.959
278 H GLU 38 H GLU 38 11.811 -14.769 1.990
279 HA GLU 38 HA GLU 38 12.206 -15.387 4.804
280 HB2 GLU 38 2HB GLU 38 11.371 -16.989 2.402
281 HB3 GLU 38 3HB GLU 38 11.843 -17.785 3.897
282 HG2 GLU 38 2HG GLU 38 10.097 -16.156 4.963
283 HG3 GLU 38 3HG GLU 38 9.464 -16.093 3.319
284 H LEU 39 H LEU 39 14.298 -14.572 2.593
285 HA LEU 39 HA LEU 39 16.115 -16.751 2.459
286 HB2 LEU 39 2HB LEU 39 15.986 -14.731 0.926
287 HB3 LEU 39 3HB LEU 39 16.824 -13.841 2.195
288 HG LEU 39 HG LEU 39 18.279 -14.645 0.328
289 HD11 LEU 39 1HD1 LEU 39 20.087 -15.117 1.722
290 HD12 LEU 39 2HD1 LEU 39 19.079 -15.940 2.911
291 HD13 LEU 39 3HD1 LEU 39 18.993 -14.187 2.746
292 HD21 LEU 39 3HD2 LEU 39 18.177 -17.376 1.507
293 HD22 LEU 39 1HD2 LEU 39 18.643 -16.860 -0.114
294 HD23 LEU 39 2HD2 LEU 39 16.939 -16.911 0.339
295 H GLY 40 H GLY 40 16.146 -13.741 4.374
296 HA2 GLY 40 2HA GLY 40 16.744 -14.542 6.826
297 HA3 GLY 40 3HA GLY 40 18.289 -14.824 6.036
298 H ALA 41 H ALA 41 19.112 -13.281 7.611
299 HA ALA 41 HA ALA 41 18.292 -10.594 7.720
300 HB1 ALA 41 1HB ALA 41 20.938 -10.479 8.375
301 HB2 ALA 41 2HB ALA 41 19.634 -10.896 9.487
302 HB3 ALA 41 3HB ALA 41 20.556 -12.171 8.691
303 H VAL 42 H VAL 42 21.040 -12.066 5.985
304 HA VAL 42 HA VAL 42 21.230 -9.640 4.341
305 HB VAL 42 HB VAL 42 23.206 -11.917 4.479
306 HG11 VAL 42 1HG1 VAL 42 23.370 -9.118 3.371
307 HG12 VAL 42 2HG1 VAL 42 24.749 -10.205 3.544
308 HG13 VAL 42 3HG1 VAL 42 23.420 -10.628 2.463
309 HG21 VAL 42 3HG2 VAL 42 24.528 -10.528 5.975
310 HG22 VAL 42 1HG2 VAL 42 23.275 -9.286 5.954
311 HG23 VAL 42 2HG2 VAL 42 22.946 -10.859 6.681
312 H LEU 43 H LEU 43 21.335 -9.771 2.071
313 HA LEU 43 HA LEU 43 19.958 -12.117 0.977
314 HB2 LEU 43 2HB LEU 43 19.969 -9.251 0.390
315 HB3 LEU 43 3HB LEU 43 20.043 -10.274 -1.043
316 HG LEU 43 HG LEU 43 17.960 -11.328 -0.463
317 HD11 LEU 43 1HD1 LEU 43 17.380 -11.528 1.668
318 HD12 LEU 43 2HD1 LEU 43 16.965 -9.814 1.672
319 HD13 LEU 43 3HD1 LEU 43 18.580 -10.331 2.157
320 HD21 LEU 43 3HD2 LEU 43 16.574 -9.069 -0.167
321 HD22 LEU 43 1HD2 LEU 43 17.350 -9.519 -1.686
322 HD23 LEU 43 2HD2 LEU 43 18.138 -8.376 -0.598
323 HA PRO 44 HA PRO 44 23.378 -13.502 -1.396
324 HB2 PRO 44 2HB PRO 44 22.219 -14.208 -3.747
325 HB3 PRO 44 3HB PRO 44 22.005 -15.132 -2.255
326 HG2 PRO 44 2HG PRO 44 20.183 -13.118 -3.513
327 HG3 PRO 44 3HG PRO 44 19.784 -14.679 -2.773
328 HD2 PRO 44 2HD PRO 44 19.453 -12.325 -1.476
329 HD3 PRO 44 3HD PRO 44 19.874 -13.829 -0.632
330 H HIS 45 H HIS 45 24.891 -12.101 -2.048
331 HA HIS 45 HA HIS 45 24.460 -9.723 -3.442
332 HB2 HIS 45 2HB HIS 45 26.870 -9.648 -3.764
333 HB3 HIS 45 3HB HIS 45 26.504 -10.223 -2.140
334 HD1 HIS 45 HD1 HIS 45 27.098 -12.672 -1.587
335 HD2 HIS 45 HD2 HIS 45 28.092 -11.520 -5.453
336 HE1 HIS 45 HE1 HIS 45 28.598 -14.490 -2.467
337 H GLY 46 H GLY 46 24.100 -9.260 -5.516
338 HA2 GLY 46 2HA GLY 46 24.600 -9.530 -7.852
339 HA3 GLY 46 3HA GLY 46 24.864 -11.242 -7.555
340 H THR 47 H THR 47 22.254 -10.733 -5.786
341 HA THR 47 HA THR 47 20.473 -11.669 -7.887
342 HB THR 47 HB THR 47 20.053 -11.431 -4.902
343 HG1 THR 47 HG1 THR 47 20.882 -13.481 -6.636
344 HG21 THR 47 3HG2 THR 47 17.872 -11.480 -5.457
345 HG22 THR 47 1HG2 THR 47 18.169 -13.182 -5.809
346 HG23 THR 47 2HG2 THR 47 18.204 -11.993 -7.111
347 H ALA 48 H ALA 48 19.323 -10.260 -9.022
348 HA ALA 48 HA ALA 48 18.955 -7.552 -8.239
349 HB1 ALA 48 1HB ALA 48 17.566 -7.379 -10.260
350 HB2 ALA 48 2HB ALA 48 19.113 -8.163 -10.579
351 HB3 ALA 48 3HB ALA 48 17.645 -9.131 -10.449
352 H VAL 49 H VAL 49 16.951 -6.461 -7.851
353 HA VAL 49 HA VAL 49 14.707 -8.131 -6.988
354 HB VAL 49 HB VAL 49 15.833 -5.953 -5.227
355 HG11 VAL 49 1HG1 VAL 49 14.223 -7.661 -3.746
356 HG12 VAL 49 2HG1 VAL 49 13.805 -6.042 -4.308
357 HG13 VAL 49 3HG1 VAL 49 13.357 -7.452 -5.268
358 HG21 VAL 49 3HG2 VAL 49 16.201 -8.934 -5.150
359 HG22 VAL 49 1HG2 VAL 49 17.431 -7.670 -5.108
360 HG23 VAL 49 2HG2 VAL 49 16.385 -7.930 -3.712
361 H GLU 50 H GLU 50 12.872 -7.358 -7.783
362 HA GLU 50 HA GLU 50 12.766 -4.870 -9.161
363 HB2 GLU 50 2HB GLU 50 11.418 -6.664 -9.981
364 HB3 GLU 50 3HB GLU 50 10.645 -6.882 -8.417
365 HG2 GLU 50 2HG GLU 50 9.354 -4.956 -8.650
366 HG3 GLU 50 3HG GLU 50 10.375 -4.318 -9.938
367 H LEU 51 H LEU 51 11.821 -2.952 -8.608
368 HA LEU 51 HA LEU 51 10.899 -2.705 -5.819
369 HB2 LEU 51 2HB LEU 51 12.459 -0.765 -7.513
370 HB3 LEU 51 3HB LEU 51 11.712 -0.337 -5.975
371 HG LEU 51 HG LEU 51 13.701 -2.573 -6.141
372 HD11 LEU 51 1HD1 LEU 51 15.275 -1.140 -6.792
373 HD12 LEU 51 2HD1 LEU 51 15.096 -0.384 -5.209
374 HD13 LEU 51 3HD1 LEU 51 14.207 0.249 -6.594
375 HD21 LEU 51 3HD2 LEU 51 12.128 -1.797 -4.123
376 HD22 LEU 51 1HD2 LEU 51 13.489 -0.707 -3.857
377 HD23 LEU 51 2HD2 LEU 51 13.749 -2.451 -3.880
378 HA PRO 52 HA PRO 52 7.252 -1.568 -8.308
379 HB2 PRO 52 2HB PRO 52 5.472 -2.233 -6.370
380 HB3 PRO 52 3HB PRO 52 6.173 -3.418 -7.478
381 HG2 PRO 52 2HG PRO 52 6.948 -2.768 -4.660
382 HG3 PRO 52 3HG PRO 52 6.790 -4.353 -5.440
383 HD2 PRO 52 2HD PRO 52 9.186 -3.149 -5.059
384 HD3 PRO 52 3HD PRO 52 8.857 -4.202 -6.450
385 H ASP 53 H ASP 53 5.727 0.122 -8.076
386 HA ASP 53 HA ASP 53 4.990 2.175 -7.429
387 HB2 ASP 53 2HB ASP 53 4.709 0.699 -5.235
388 HB3 ASP 53 3HB ASP 53 5.951 1.793 -4.632
389 H VAL 54 H VAL 54 7.493 2.099 -8.570
390 HA VAL 54 HA VAL 54 8.931 4.195 -7.076
391 HB VAL 54 HB VAL 54 10.078 2.030 -8.840
392 HG11 VAL 54 1HG1 VAL 54 11.389 3.849 -9.419
393 HG12 VAL 54 2HG1 VAL 54 11.269 4.576 -7.815
394 HG13 VAL 54 3HG1 VAL 54 12.281 3.153 -8.066
395 HG21 VAL 54 3HG2 VAL 54 9.602 1.291 -6.584
396 HG22 VAL 54 1HG2 VAL 54 11.345 1.449 -6.803
397 HG23 VAL 54 2HG2 VAL 54 10.452 2.685 -5.918
398 H GLN 55 H GLN 55 9.641 5.977 -8.199
399 HA GLN 55 HA GLN 55 9.628 7.589 -9.803
400 HB2 GLN 55 2HB GLN 55 9.969 5.081 -11.400
401 HB3 GLN 55 3HB GLN 55 9.725 6.608 -12.237
402 HG2 GLN 55 2HG GLN 55 11.658 7.481 -10.802
403 HG3 GLN 55 3HG GLN 55 11.990 5.783 -10.464
404 HE21 GLN 55 1HE2 GLN 55 11.718 8.183 -13.010
405 HE22 GLN 55 2HE2 GLN 55 12.725 7.363 -14.149
406 H THR 56 H THR 56 7.092 6.478 -8.802
407 HA THR 56 HA THR 56 5.158 6.202 -10.791
408 HB THR 56 HB THR 56 4.686 7.510 -8.110
409 HG1 THR 56 HG1 THR 56 4.715 5.532 -7.219
410 HG21 THR 56 3HG2 THR 56 2.959 6.106 -10.121
411 HG22 THR 56 1HG2 THR 56 2.705 7.663 -9.335
412 HG23 THR 56 2HG2 THR 56 2.498 6.170 -8.420
413 H ALA 57 H ALA 57 3.777 7.626 -11.822
414 HA ALA 57 HA ALA 57 4.141 10.490 -11.403
415 HB1 ALA 57 1HB ALA 57 5.576 10.609 -13.119
416 HB2 ALA 57 2HB ALA 57 5.131 9.015 -13.730
417 HB3 ALA 57 3HB ALA 57 4.141 10.419 -14.127
418 HA PRO 58 HA PRO 58 -0.154 10.759 -12.259
419 HB2 PRO 58 2HB PRO 58 -0.342 13.134 -13.562
420 HB3 PRO 58 3HB PRO 58 -0.001 13.012 -11.832
421 HG2 PRO 58 2HG PRO 58 1.891 13.449 -14.110
422 HG3 PRO 58 3HG PRO 58 1.847 14.241 -12.524
423 HD2 PRO 58 2HD PRO 58 3.574 12.238 -13.104
424 HD3 PRO 58 3HD PRO 58 2.910 12.484 -11.476
425 H VAL 59 H VAL 59 0.056 8.902 -13.789
426 HA VAL 59 HA VAL 59 -0.609 9.777 -16.520
427 HB VAL 59 HB VAL 59 0.990 7.298 -15.878
428 HG11 VAL 59 1HG1 VAL 59 -0.089 6.855 -17.874
429 HG12 VAL 59 2HG1 VAL 59 -0.039 8.540 -18.396
430 HG13 VAL 59 3HG1 VAL 59 1.430 7.563 -18.423
431 HG21 VAL 59 3HG2 VAL 59 2.309 9.294 -15.402
432 HG22 VAL 59 1HG2 VAL 59 2.907 8.476 -16.846
433 HG23 VAL 59 2HG2 VAL 59 1.931 9.937 -17.001
434 H ALA 60 H ALA 60 -2.205 8.620 -17.571
435 HA ALA 60 HA ALA 60 -4.107 7.299 -15.914
436 HB1 ALA 60 1HB ALA 60 -5.529 7.369 -17.718
437 HB2 ALA 60 2HB ALA 60 -4.435 8.699 -18.099
438 HB3 ALA 60 3HB ALA 60 -4.232 7.135 -18.889
439 H GLU 61 H GLU 61 -4.255 5.217 -15.403
440 HA GLU 61 HA GLU 61 -3.622 3.100 -17.180
441 HB2 GLU 61 2HB GLU 61 -1.336 3.995 -16.311
442 HB3 GLU 61 3HB GLU 61 -1.774 3.179 -14.817
443 HG2 GLU 61 2HG GLU 61 -0.558 1.553 -15.862
444 HG3 GLU 61 3HG GLU 61 -2.189 1.139 -16.389
445 H THR 62 H THR 62 -4.267 1.075 -16.391
446 HA THR 62 HA THR 62 -5.966 1.233 -14.011
447 HB THR 62 HB THR 62 -7.068 0.451 -16.040
448 HG1 THR 62 HG1 THR 62 -6.751 -1.853 -14.429
449 HG21 THR 62 3HG2 THR 62 -4.925 -1.670 -16.014
450 HG22 THR 62 1HG2 THR 62 -5.275 -0.502 -17.288
451 HG23 THR 62 2HG2 THR 62 -6.413 -1.807 -16.951
452 H VAL 63 H VAL 63 -5.888 -0.320 -12.364
453 HA VAL 63 HA VAL 63 -4.029 -2.471 -12.341
454 HB VAL 63 HB VAL 63 -2.451 -0.570 -12.070
455 HG11 VAL 63 1HG1 VAL 63 -3.185 -0.046 -9.297
456 HG12 VAL 63 2HG1 VAL 63 -2.733 1.076 -10.582
457 HG13 VAL 63 3HG1 VAL 63 -4.396 0.500 -10.456
458 HG21 VAL 63 3HG2 VAL 63 -1.178 -1.571 -10.345
459 HG22 VAL 63 1HG2 VAL 63 -2.620 -2.185 -9.538
460 HG23 VAL 63 2HG2 VAL 63 -2.112 -2.874 -11.080
461 H ASN 64 H ASN 64 -4.311 -3.829 -10.576
462 HA ASN 64 HA ASN 64 -6.797 -3.763 -9.295
463 HB2 ASN 64 2HB ASN 64 -5.117 -5.731 -9.690
464 HB3 ASN 64 3HB ASN 64 -4.483 -5.262 -8.115
465 HD21 ASN 64 1HD2 ASN 64 -5.117 -7.131 -7.103
466 HD22 ASN 64 2HD2 ASN 64 -6.772 -7.512 -6.785
467 H LEU 65 H LEU 65 -7.388 -3.379 -7.138
468 HA LEU 65 HA LEU 65 -5.588 -1.532 -5.721
469 HB2 LEU 65 2HB LEU 65 -7.992 -0.909 -6.572
470 HB3 LEU 65 3HB LEU 65 -8.498 -1.745 -5.106
471 HG LEU 65 HG LEU 65 -6.611 0.607 -5.155
472 HD11 LEU 65 1HD1 LEU 65 -8.714 1.686 -4.061
473 HD12 LEU 65 2HD1 LEU 65 -9.582 0.432 -4.945
474 HD13 LEU 65 3HD1 LEU 65 -8.582 1.593 -5.817
475 HD21 LEU 65 3HD2 LEU 65 -6.162 -0.171 -3.103
476 HD22 LEU 65 1HD2 LEU 65 -7.568 -1.236 -3.094
477 HD23 LEU 65 2HD2 LEU 65 -7.752 0.469 -2.681
478 H TRP 66 H TRP 66 -4.542 -2.497 -4.114
479 HA TRP 66 HA TRP 66 -5.445 -4.894 -2.870
480 HB2 TRP 66 2HB TRP 66 -3.106 -4.628 -2.950
481 HB3 TRP 66 3HB TRP 66 -3.185 -2.982 -2.325
482 HD1 TRP 66 HD1 TRP 66 -4.823 -6.087 -0.704
483 HE1 TRP 66 HE1 TRP 66 -3.838 -6.367 1.657
484 HE3 TRP 66 HE3 TRP 66 -1.318 -2.367 -0.840
485 HZ2 TRP 66 HZ2 TRP 66 -1.841 -5.169 3.252
486 HZ3 TRP 66 HZ3 TRP 66 0.088 -1.999 1.145
487 HH2 TRP 66 HH2 TRP 66 -0.170 -3.372 3.148
488 H GLU 67 H GLU 67 -6.957 -5.066 -1.364
489 HA GLU 67 HA GLU 67 -7.022 -3.503 0.981
490 HB2 GLU 67 2HB GLU 67 -9.217 -2.381 0.609
491 HB3 GLU 67 3HB GLU 67 -7.917 -1.741 -0.387
492 HG2 GLU 67 2HG GLU 67 -9.256 -1.997 -2.129
493 HG3 GLU 67 3HG GLU 67 -9.048 -3.738 -1.941
494 H VAL 68 H VAL 68 -7.688 -4.926 2.432
495 HA VAL 68 HA VAL 68 -9.786 -6.850 1.663
496 HB VAL 68 HB VAL 68 -7.553 -7.879 2.073
497 HG11 VAL 68 1HG1 VAL 68 -7.926 -7.314 4.986
498 HG12 VAL 68 2HG1 VAL 68 -6.470 -7.804 4.118
499 HG13 VAL 68 3HG1 VAL 68 -7.082 -6.158 3.957
500 HG21 VAL 68 3HG2 VAL 68 -9.655 -8.648 4.095
501 HG22 VAL 68 1HG2 VAL 68 -9.661 -9.120 2.396
502 HG23 VAL 68 2HG2 VAL 68 -8.374 -9.682 3.462
503 H GLU 69 H GLU 69 -8.610 -4.623 4.082
504 HA GLU 69 HA GLU 69 -9.529 -3.764 5.980
505 HB2 GLU 69 2HB GLU 69 -11.312 -3.369 4.056
506 HB3 GLU 69 3HB GLU 69 -12.268 -4.473 5.034
507 HG2 GLU 69 2HG GLU 69 -12.866 -2.311 5.724
508 HG3 GLU 69 3HG GLU 69 -11.815 -2.947 6.988
509 H HIS 70 H HIS 70 -8.594 -6.098 6.619
510 HA HIS 70 HA HIS 70 -10.424 -7.078 8.609
511 HB2 HIS 70 2HB HIS 70 -11.110 -8.388 6.624
512 HB3 HIS 70 3HB HIS 70 -9.461 -8.984 6.465
513 HD1 HIS 70 HD1 HIS 70 -12.580 -9.430 8.443
514 HD2 HIS 70 HD2 HIS 70 -8.701 -10.916 8.375
515 HE1 HIS 70 HE1 HIS 70 -12.610 -11.457 9.931
516 H HIS 71 H HIS 71 -9.206 -7.218 10.363
517 HA HIS 71 HA HIS 71 -6.371 -7.945 10.068
518 HB2 HIS 71 2HB HIS 71 -7.160 -5.714 11.158
519 HB3 HIS 71 3HB HIS 71 -7.538 -6.723 12.551
520 HD1 HIS 71 HD1 HIS 71 -5.673 -5.360 13.835
521 HD2 HIS 71 HD2 HIS 71 -4.310 -7.705 10.688
522 HE1 HIS 71 HE1 HIS 71 -3.185 -5.531 14.153
Start of MODEL 20
1 H1 MET 1 H MET 1 1.831 0.510 1.383
2 HA MET 1 HA MET 1 1.915 0.400 -1.558
3 HB2 MET 1 2HB MET 1 3.719 2.164 0.091
4 HB3 MET 1 3HB MET 1 3.489 2.178 -1.653
5 HG2 MET 1 2HG MET 1 1.426 2.967 0.392
6 HG3 MET 1 3HG MET 1 2.409 4.076 -0.562
7 HE1 MET 1 3HE MET 1 -1.364 2.195 -1.071
8 HE2 MET 1 1HE MET 1 -0.583 3.235 0.120
9 HE3 MET 1 2HE MET 1 -1.416 3.948 -1.262
10 H LYS 2 H LYS 2 2.333 -1.917 -0.765
11 HA LYS 2 HA LYS 2 5.216 -2.256 -0.255
12 HB2 LYS 2 2HB LYS 2 4.676 -4.425 0.751
13 HB3 LYS 2 3HB LYS 2 3.846 -3.115 1.580
14 HG2 LYS 2 2HG LYS 2 1.893 -3.718 -0.049
15 HG3 LYS 2 3HG LYS 2 2.738 -5.264 -0.158
16 HD2 LYS 2 2HD LYS 2 2.709 -5.327 2.362
17 HD3 LYS 2 3HD LYS 2 1.624 -3.936 2.307
18 HE2 LYS 2 2HE LYS 2 1.040 -6.475 0.812
19 HE3 LYS 2 3HE LYS 2 0.565 -6.254 2.495
20 HZ1 LYS 2 3HZ LYS 2 -0.878 -5.495 0.316
21 HZ2 LYS 2 1HZ LYS 2 -0.186 -4.042 0.840
22 HZ3 LYS 2 2HZ LYS 2 -1.128 -4.962 1.902
23 H THR 3 H THR 3 6.311 -3.926 -1.373
24 HA THR 3 HA THR 3 4.895 -5.116 -3.649
25 HB THR 3 HB THR 3 5.922 -3.176 -4.624
26 HG1 THR 3 HG1 THR 3 7.644 -4.362 -5.909
27 HG21 THR 3 3HG2 THR 3 7.933 -3.627 -2.672
28 HG22 THR 3 1HG2 THR 3 7.767 -2.262 -3.776
29 HG23 THR 3 2HG2 THR 3 8.701 -3.678 -4.258
30 H PHE 4 H PHE 4 6.059 -6.915 -4.634
31 HA PHE 4 HA PHE 4 7.265 -8.579 -2.634
32 HB2 PHE 4 2HB PHE 4 7.064 -9.174 -5.586
33 HB3 PHE 4 3HB PHE 4 7.183 -10.325 -4.259
34 HD1 PHE 4 HD1 PHE 4 5.200 -9.539 -2.376
35 HD2 PHE 4 HD2 PHE 4 5.035 -9.399 -6.626
36 HE1 PHE 4 HE1 PHE 4 2.745 -9.685 -2.282
37 HE2 PHE 4 HE2 PHE 4 2.580 -9.544 -6.539
38 HZ PHE 4 HZ PHE 4 1.432 -9.687 -4.365
39 H ALA 5 H ALA 5 9.359 -9.297 -2.490
40 HA ALA 5 HA ALA 5 11.357 -7.616 -3.747
41 HB1 ALA 5 1HB ALA 5 12.760 -8.228 -2.069
42 HB2 ALA 5 2HB ALA 5 11.226 -8.581 -1.273
43 HB3 ALA 5 3HB ALA 5 12.154 -9.884 -2.014
44 H LEU 6 H LEU 6 13.200 -8.451 -4.874
45 HA LEU 6 HA LEU 6 13.052 -11.169 -5.892
46 HB2 LEU 6 2HB LEU 6 12.996 -8.772 -7.720
47 HB3 LEU 6 3HB LEU 6 13.179 -10.448 -8.233
48 HG LEU 6 HG LEU 6 10.738 -9.421 -6.796
49 HD11 LEU 6 1HD1 LEU 6 9.800 -9.693 -9.227
50 HD12 LEU 6 2HD1 LEU 6 11.471 -9.365 -9.683
51 HD13 LEU 6 3HD1 LEU 6 10.573 -8.190 -8.723
52 HD21 LEU 6 3HD2 LEU 6 10.209 -11.602 -8.495
53 HD22 LEU 6 1HD2 LEU 6 10.192 -11.570 -6.732
54 HD23 LEU 6 2HD2 LEU 6 11.669 -12.007 -7.591
55 H GLN 7 H GLN 7 14.927 -11.274 -7.727
56 HA GLN 7 HA GLN 7 17.335 -11.148 -6.377
57 HB2 GLN 7 2HB GLN 7 16.698 -12.348 -8.589
58 HB3 GLN 7 3HB GLN 7 17.220 -10.857 -9.363
59 HG2 GLN 7 2HG GLN 7 19.431 -11.109 -8.577
60 HG3 GLN 7 3HG GLN 7 18.964 -12.394 -7.465
61 HE21 GLN 7 1HE2 GLN 7 18.707 -14.463 -8.220
62 HE22 GLN 7 2HE2 GLN 7 19.180 -14.953 -9.808
63 H GLY 8 H GLY 8 18.647 -9.544 -5.809
64 HA2 GLY 8 2HA GLY 8 19.628 -7.472 -5.701
65 HA3 GLY 8 3HA GLY 8 19.354 -7.370 -7.434
66 H ASP 9 H ASP 9 16.607 -7.837 -5.412
67 HA ASP 9 HA ASP 9 15.899 -4.994 -5.744
68 HB2 ASP 9 2HB ASP 9 14.296 -7.489 -6.146
69 HB3 ASP 9 3HB ASP 9 13.477 -6.021 -5.619
70 H THR 10 H THR 10 17.209 -6.423 -3.484
71 HA THR 10 HA THR 10 15.313 -6.678 -1.373
72 HB THR 10 HB THR 10 17.114 -7.087 0.060
73 HG1 THR 10 HG1 THR 10 18.546 -5.387 -1.686
74 HG21 THR 10 3HG2 THR 10 18.203 -8.800 -0.983
75 HG22 THR 10 1HG2 THR 10 18.586 -7.836 -2.409
76 HG23 THR 10 2HG2 THR 10 16.963 -8.492 -2.197
77 H LEU 11 H LEU 11 15.898 -5.347 0.747
78 HA LEU 11 HA LEU 11 14.860 -2.814 0.472
79 HB2 LEU 11 2HB LEU 11 16.808 -3.683 2.601
80 HB3 LEU 11 3HB LEU 11 15.646 -2.363 2.714
81 HG LEU 11 HG LEU 11 14.990 -5.305 2.558
82 HD11 LEU 11 1HD1 LEU 11 14.596 -3.378 4.837
83 HD12 LEU 11 2HD1 LEU 11 15.963 -4.484 4.707
84 HD13 LEU 11 3HD1 LEU 11 14.324 -5.121 4.838
85 HD21 LEU 11 3HD2 LEU 11 13.381 -2.875 2.203
86 HD22 LEU 11 1HD2 LEU 11 12.721 -4.046 3.344
87 HD23 LEU 11 2HD2 LEU 11 13.070 -4.533 1.685
88 H ASP 12 H ASP 12 18.257 -3.795 0.477
89 HA ASP 12 HA ASP 12 19.457 -1.290 0.523
90 HB2 ASP 12 2HB ASP 12 20.303 -3.875 -0.783
91 HB3 ASP 12 3HB ASP 12 21.327 -2.442 -0.771
92 H ALA 13 H ALA 13 17.988 -3.045 -2.139
93 HA ALA 13 HA ALA 13 18.840 -1.070 -4.089
94 HB1 ALA 13 1HB ALA 13 18.711 -2.865 -5.392
95 HB2 ALA 13 2HB ALA 13 17.825 -3.770 -4.165
96 HB3 ALA 13 3HB ALA 13 16.956 -2.728 -5.291
97 H ILE 14 H ILE 14 15.722 -2.307 -2.873
98 HA ILE 14 HA ILE 14 14.025 -0.566 -4.171
99 HB ILE 14 HB ILE 14 13.713 -1.622 -1.358
100 HG12 ILE 14 2HG1 ILE 14 12.572 -2.741 -3.920
101 HG13 ILE 14 3HG1 ILE 14 14.083 -3.308 -3.217
102 HG21 ILE 14 1HG2 ILE 14 11.649 -0.562 -3.283
103 HG22 ILE 14 2HG2 ILE 14 11.316 -1.284 -1.710
104 HG23 ILE 14 3HG2 ILE 14 12.204 0.236 -1.812
105 HD11 ILE 14 3HD1 ILE 14 12.173 -4.740 -2.660
106 HD12 ILE 14 1HD1 ILE 14 12.924 -4.033 -1.230
107 HD13 ILE 14 2HD1 ILE 14 11.407 -3.377 -1.845
108 H CYS 15 H CYS 15 15.657 -0.095 -1.051
109 HA CYS 15 HA CYS 15 14.551 2.380 -0.398
110 HB2 CYS 15 2HB CYS 15 17.184 1.089 0.281
111 HB3 CYS 15 3HB CYS 15 16.765 2.688 0.883
112 HG CYS 15 HG CYS 15 14.181 1.231 1.748
113 H VAL 16 H VAL 16 17.031 1.536 -2.676
114 HA VAL 16 HA VAL 16 17.929 4.277 -3.002
115 HB VAL 16 HB VAL 16 18.660 1.781 -4.539
116 HG11 VAL 16 1HG1 VAL 16 19.709 4.597 -4.675
117 HG12 VAL 16 2HG1 VAL 16 20.606 3.206 -5.287
118 HG13 VAL 16 3HG1 VAL 16 19.038 3.621 -5.980
119 HG21 VAL 16 3HG2 VAL 16 20.353 3.279 -2.557
120 HG22 VAL 16 1HG2 VAL 16 19.308 1.937 -2.090
121 HG23 VAL 16 2HG2 VAL 16 20.622 1.673 -3.236
122 H ARG 17 H ARG 17 15.782 2.005 -4.550
123 HA ARG 17 HA ARG 17 15.459 3.648 -6.915
124 HB2 ARG 17 2HB ARG 17 14.324 1.884 -7.838
125 HB3 ARG 17 3HB ARG 17 15.292 1.021 -6.650
126 HG2 ARG 17 2HG ARG 17 13.372 1.079 -5.097
127 HG3 ARG 17 3HG ARG 17 12.410 1.842 -6.365
128 HD2 ARG 17 2HD ARG 17 13.244 -0.240 -7.758
129 HD3 ARG 17 3HD ARG 17 13.415 -0.950 -6.154
130 HE ARG 17 HE ARG 17 10.861 0.287 -6.589
131 HH11 ARG 17 1HH1 ARG 17 12.735 -2.616 -7.011
132 HH12 ARG 17 2HH1 ARG 17 11.351 -3.657 -7.073
133 HH21 ARG 17 1HH2 ARG 17 9.031 -1.072 -6.669
134 HH22 ARG 17 2HH2 ARG 17 9.245 -2.777 -6.879
135 H TYR 18 H TYR 18 14.202 3.581 -3.797
136 HA TYR 18 HA TYR 18 11.712 4.905 -4.635
137 HB2 TYR 18 2HB TYR 18 12.432 3.161 -2.362
138 HB3 TYR 18 3HB TYR 18 11.384 4.518 -1.969
139 HD1 TYR 18 HD2 TYR 18 11.662 1.366 -3.809
140 HD2 TYR 18 HD1 TYR 18 9.125 4.646 -2.856
141 HE1 TYR 18 HE2 TYR 18 9.725 0.102 -4.644
142 HE2 TYR 18 HE1 TYR 18 7.180 3.390 -3.688
143 HH TYR 18 HH TYR 18 6.466 1.220 -4.188
144 H TYR 19 H TYR 19 14.028 5.097 -1.925
145 HA TYR 19 HA TYR 19 13.505 7.961 -1.719
146 HB2 TYR 19 2HB TYR 19 15.305 6.347 0.079
147 HB3 TYR 19 3HB TYR 19 14.501 7.873 0.428
148 HD1 TYR 19 HD2 TYR 19 12.020 7.899 0.767
149 HD2 TYR 19 HD1 TYR 19 14.226 4.273 0.472
150 HE1 TYR 19 HE2 TYR 19 10.144 6.681 1.790
151 HE2 TYR 19 HE1 TYR 19 12.356 3.045 1.492
152 HH TYR 19 HH TYR 19 10.414 3.293 2.670
153 H GLY 20 H GLY 20 16.098 5.704 -2.465
154 HA2 GLY 20 2HA GLY 20 17.880 6.199 -3.933
155 HA3 GLY 20 3HA GLY 20 17.605 7.912 -3.651
156 H ARG 21 H ARG 21 17.723 5.797 -0.923
157 HA ARG 21 HA ARG 21 20.528 5.997 -0.442
158 HB2 ARG 21 2HB ARG 21 20.428 7.490 1.501
159 HB3 ARG 21 3HB ARG 21 19.934 8.318 0.030
160 HG2 ARG 21 2HG ARG 21 17.864 7.088 1.788
161 HG3 ARG 21 3HG ARG 21 18.588 8.634 2.234
162 HD2 ARG 21 2HD ARG 21 18.034 9.163 -0.319
163 HD3 ARG 21 3HD ARG 21 16.790 7.949 -0.021
164 HE ARG 21 HE ARG 21 15.674 9.468 1.275
165 HH11 ARG 21 1HH1 ARG 21 18.950 10.554 0.818
166 HH12 ARG 21 2HH1 ARG 21 18.680 12.098 1.557
167 HH21 ARG 21 1HH2 ARG 21 15.306 11.496 2.251
168 HH22 ARG 21 2HH2 ARG 21 16.607 12.632 2.373
169 H THR 22 H THR 22 21.162 5.003 1.576
170 HA THR 22 HA THR 22 19.069 3.219 2.636
171 HB THR 22 HB THR 22 21.150 1.813 3.335
172 HG1 THR 22 HG1 THR 22 22.809 3.155 2.749
173 HG21 THR 22 3HG2 THR 22 20.302 0.473 1.773
174 HG22 THR 22 1HG2 THR 22 21.103 1.413 0.514
175 HG23 THR 22 2HG2 THR 22 19.478 1.851 1.043
176 H GLU 23 H GLU 23 21.516 5.538 3.410
177 HA GLU 23 HA GLU 23 21.766 4.925 6.176
178 HB2 GLU 23 2HB GLU 23 23.363 6.298 4.722
179 HB3 GLU 23 3HB GLU 23 22.240 7.632 4.941
180 HG2 GLU 23 2HG GLU 23 22.594 7.644 7.296
181 HG3 GLU 23 3HG GLU 23 23.526 6.149 7.218
182 H GLY 24 H GLY 24 20.160 5.070 7.593
183 HA2 GLY 24 2HA GLY 24 18.672 6.303 8.941
184 HA3 GLY 24 3HA GLY 24 18.567 7.517 7.675
185 H VAL 25 H VAL 25 18.162 5.184 5.729
186 HA VAL 25 HA VAL 25 15.262 5.104 6.052
187 HB VAL 25 HB VAL 25 16.904 4.125 3.714
188 HG11 VAL 25 1HG1 VAL 25 14.314 3.575 4.287
189 HG12 VAL 25 2HG1 VAL 25 14.141 5.053 3.339
190 HG13 VAL 25 3HG1 VAL 25 14.975 3.657 2.655
191 HG21 VAL 25 3HG2 VAL 25 17.400 6.395 3.759
192 HG22 VAL 25 1HG2 VAL 25 15.995 6.320 2.695
193 HG23 VAL 25 2HG2 VAL 25 15.806 6.833 4.372
194 H VAL 26 H VAL 26 17.997 2.888 5.615
195 HA VAL 26 HA VAL 26 16.613 0.480 5.556
196 HB VAL 26 HB VAL 26 18.688 -0.565 6.424
197 HG11 VAL 26 1HG1 VAL 26 18.946 1.502 4.251
198 HG12 VAL 26 2HG1 VAL 26 20.183 0.290 4.589
199 HG13 VAL 26 3HG1 VAL 26 18.571 -0.212 4.078
200 HG21 VAL 26 3HG2 VAL 26 20.479 1.590 6.402
201 HG22 VAL 26 1HG2 VAL 26 19.127 2.095 7.416
202 HG23 VAL 26 2HG2 VAL 26 19.999 0.607 7.785
203 H GLU 27 H GLU 27 17.288 2.602 8.219
204 HA GLU 27 HA GLU 27 16.811 0.689 10.289
205 HB2 GLU 27 2HB GLU 27 17.077 3.672 10.181
206 HB3 GLU 27 3HB GLU 27 16.468 2.904 11.640
207 HG2 GLU 27 2HG GLU 27 19.006 1.928 10.425
208 HG3 GLU 27 3HG GLU 27 19.007 3.415 11.372
209 H THR 28 H THR 28 14.836 2.854 8.403
210 HA THR 28 HA THR 28 12.533 2.728 10.092
211 HB THR 28 HB THR 28 12.234 3.306 7.184
212 HG1 THR 28 HG1 THR 28 13.484 5.039 7.237
213 HG21 THR 28 3HG2 THR 28 10.402 4.383 7.880
214 HG22 THR 28 1HG2 THR 28 11.302 5.269 9.111
215 HG23 THR 28 2HG2 THR 28 10.687 3.653 9.460
216 H VAL 29 H VAL 29 13.089 1.410 6.819
217 HA VAL 29 HA VAL 29 10.852 -0.222 6.701
218 HB VAL 29 HB VAL 29 13.533 -0.847 5.458
219 HG11 VAL 29 1HG1 VAL 29 10.757 -1.843 5.059
220 HG12 VAL 29 2HG1 VAL 29 11.818 -1.711 3.655
221 HG13 VAL 29 3HG1 VAL 29 12.287 -2.718 5.025
222 HG21 VAL 29 3HG2 VAL 29 11.818 0.368 3.589
223 HG22 VAL 29 1HG2 VAL 29 11.776 1.375 5.037
224 HG23 VAL 29 2HG2 VAL 29 13.317 1.012 4.260
225 H LEU 30 H LEU 30 13.955 -0.783 8.227
226 HA LEU 30 HA LEU 30 13.696 -3.563 8.632
227 HB2 LEU 30 2HB LEU 30 15.827 -2.426 8.832
228 HB3 LEU 30 3HB LEU 30 15.226 -1.493 10.200
229 HG LEU 30 HG LEU 30 15.056 -3.584 11.507
230 HD11 LEU 30 1HD1 LEU 30 16.180 -4.767 8.987
231 HD12 LEU 30 2HD1 LEU 30 14.754 -5.264 9.898
232 HD13 LEU 30 3HD1 LEU 30 16.365 -5.547 10.559
233 HD21 LEU 30 3HD2 LEU 30 17.478 -2.299 10.578
234 HD22 LEU 30 1HD2 LEU 30 17.766 -3.969 11.065
235 HD23 LEU 30 2HD2 LEU 30 17.034 -2.834 12.199
236 H ALA 31 H ALA 31 12.633 -0.769 10.485
237 HA ALA 31 HA ALA 31 11.818 -2.245 12.785
238 HB1 ALA 31 1HB ALA 31 12.250 0.002 13.207
239 HB2 ALA 31 2HB ALA 31 11.316 0.544 11.812
240 HB3 ALA 31 3HB ALA 31 10.489 -0.090 13.234
241 H ALA 32 H ALA 32 10.320 -1.382 9.758
242 HA ALA 32 HA ALA 32 7.655 -2.083 10.631
243 HB1 ALA 32 1HB ALA 32 7.255 -0.630 8.985
244 HB2 ALA 32 2HB ALA 32 8.861 -0.846 8.287
245 HB3 ALA 32 3HB ALA 32 7.566 -1.975 7.886
246 H ASN 33 H ASN 33 10.348 -3.635 9.080
247 HA ASN 33 HA ASN 33 8.787 -6.122 8.958
248 HB2 ASN 33 2HB ASN 33 10.344 -4.808 6.788
249 HB3 ASN 33 3HB ASN 33 10.443 -6.563 6.906
250 HD21 ASN 33 1HD2 ASN 33 8.029 -3.966 6.969
251 HD22 ASN 33 2HD2 ASN 33 6.849 -4.809 6.030
252 HA PRO 34 HA PRO 34 12.722 -6.628 11.379
253 HB2 PRO 34 2HB PRO 34 11.554 -7.936 13.452
254 HB3 PRO 34 3HB PRO 34 11.652 -6.174 13.361
255 HG2 PRO 34 2HG PRO 34 9.361 -7.980 12.690
256 HG3 PRO 34 3HG PRO 34 9.352 -6.441 13.572
257 HD2 PRO 34 2HD PRO 34 8.644 -6.631 10.965
258 HD3 PRO 34 3HD PRO 34 9.430 -5.189 11.638
259 H GLY 35 H GLY 35 13.993 -8.396 11.218
260 HA2 GLY 35 2HA GLY 35 14.243 -10.815 11.427
261 HA3 GLY 35 3HA GLY 35 12.684 -10.977 10.633
262 H LEU 36 H LEU 36 13.461 -8.791 8.720
263 HA LEU 36 HA LEU 36 14.388 -10.427 6.634
264 HB2 LEU 36 2HB LEU 36 13.119 -8.138 6.631
265 HB3 LEU 36 3HB LEU 36 14.746 -7.464 6.562
266 HG LEU 36 HG LEU 36 13.718 -7.610 4.347
267 HD11 LEU 36 1HD1 LEU 36 16.236 -8.084 4.908
268 HD12 LEU 36 2HD1 LEU 36 15.618 -8.298 3.270
269 HD13 LEU 36 3HD1 LEU 36 15.840 -9.699 4.318
270 HD21 LEU 36 3HD2 LEU 36 12.878 -9.520 3.413
271 HD22 LEU 36 1HD2 LEU 36 12.481 -9.810 5.107
272 HD23 LEU 36 2HD2 LEU 36 13.896 -10.580 4.389
273 H ALA 37 H ALA 37 16.055 -8.146 8.750
274 HA ALA 37 HA ALA 37 18.535 -8.104 7.458
275 HB1 ALA 37 1HB ALA 37 18.444 -6.489 9.057
276 HB2 ALA 37 2HB ALA 37 17.583 -7.515 10.205
277 HB3 ALA 37 3HB ALA 37 19.318 -7.724 9.965
278 H GLU 38 H GLU 38 17.059 -10.503 9.494
279 HA GLU 38 HA GLU 38 19.466 -11.914 10.120
280 HB2 GLU 38 2HB GLU 38 16.635 -12.966 10.163
281 HB3 GLU 38 3HB GLU 38 18.022 -13.629 11.016
282 HG2 GLU 38 2HG GLU 38 16.592 -11.044 11.551
283 HG3 GLU 38 3HG GLU 38 16.717 -12.455 12.600
284 H LEU 39 H LEU 39 17.296 -11.847 7.440
285 HA LEU 39 HA LEU 39 17.571 -14.363 6.337
286 HB2 LEU 39 2HB LEU 39 16.292 -12.191 5.563
287 HB3 LEU 39 3HB LEU 39 17.716 -11.990 4.543
288 HG LEU 39 HG LEU 39 16.071 -13.048 3.215
289 HD11 LEU 39 1HD1 LEU 39 17.972 -15.161 4.220
290 HD12 LEU 39 2HD1 LEU 39 18.315 -13.966 2.970
291 HD13 LEU 39 3HD1 LEU 39 17.089 -15.204 2.694
292 HD21 LEU 39 3HD2 LEU 39 15.303 -14.260 5.696
293 HD22 LEU 39 1HD2 LEU 39 15.529 -15.504 4.466
294 HD23 LEU 39 2HD2 LEU 39 14.413 -14.169 4.175
295 H GLY 40 H GLY 40 19.644 -11.522 5.736
296 HA2 GLY 40 2HA GLY 40 22.111 -12.339 5.910
297 HA3 GLY 40 3HA GLY 40 21.637 -13.301 4.518
298 H ALA 41 H ALA 41 22.615 -12.438 2.805
299 HA ALA 41 HA ALA 41 22.973 -9.567 2.586
300 HB1 ALA 41 1HB ALA 41 23.991 -11.948 1.122
301 HB2 ALA 41 2HB ALA 41 23.986 -10.389 0.297
302 HB3 ALA 41 3HB ALA 41 24.869 -10.583 1.811
303 H VAL 42 H VAL 42 21.194 -12.145 0.939
304 HA VAL 42 HA VAL 42 19.571 -10.068 -0.379
305 HB VAL 42 HB VAL 42 21.100 -11.279 -1.969
306 HG11 VAL 42 1HG1 VAL 42 19.277 -13.616 -1.415
307 HG12 VAL 42 2HG1 VAL 42 20.598 -13.557 -2.584
308 HG13 VAL 42 3HG1 VAL 42 20.944 -13.484 -0.855
309 HG21 VAL 42 3HG2 VAL 42 18.557 -12.097 -3.047
310 HG22 VAL 42 1HG2 VAL 42 18.419 -10.540 -2.231
311 HG23 VAL 42 2HG2 VAL 42 19.598 -10.756 -3.524
312 H LEU 43 H LEU 43 17.366 -10.497 -0.608
313 HA LEU 43 HA LEU 43 16.351 -12.529 1.239
314 HB2 LEU 43 2HB LEU 43 14.157 -11.219 0.753
315 HB3 LEU 43 3HB LEU 43 15.374 -10.543 1.833
316 HG LEU 43 HG LEU 43 16.169 -9.098 0.015
317 HD11 LEU 43 1HD1 LEU 43 13.999 -10.484 -1.531
318 HD12 LEU 43 2HD1 LEU 43 15.704 -10.311 -1.943
319 HD13 LEU 43 3HD1 LEU 43 14.637 -8.908 -2.000
320 HD21 LEU 43 3HD2 LEU 43 14.528 -7.511 0.278
321 HD22 LEU 43 1HD2 LEU 43 14.157 -8.603 1.613
322 HD23 LEU 43 2HD2 LEU 43 13.217 -8.681 0.122
323 HA PRO 44 HA PRO 44 14.659 -15.113 -1.878
324 HB2 PRO 44 2HB PRO 44 12.305 -15.881 -0.764
325 HB3 PRO 44 3HB PRO 44 13.874 -16.461 -0.191
326 HG2 PRO 44 2HG PRO 44 12.138 -14.288 0.916
327 HG3 PRO 44 3HG PRO 44 13.033 -15.553 1.778
328 HD2 PRO 44 2HD PRO 44 13.943 -13.011 1.567
329 HD3 PRO 44 3HD PRO 44 15.031 -14.412 1.635
330 H HIS 45 H HIS 45 13.350 -15.064 -3.660
331 HA HIS 45 HA HIS 45 12.035 -12.629 -4.288
332 HB2 HIS 45 2HB HIS 45 11.528 -13.636 -6.411
333 HB3 HIS 45 3HB HIS 45 13.154 -14.132 -5.952
334 HD1 HIS 45 HD1 HIS 45 9.990 -15.461 -7.081
335 HD2 HIS 45 HD2 HIS 45 13.178 -16.863 -4.815
336 HE1 HIS 45 HE1 HIS 45 9.764 -17.966 -7.080
337 H GLY 46 H GLY 46 9.952 -12.039 -4.125
338 HA2 GLY 46 2HA GLY 46 7.592 -12.678 -4.272
339 HA3 GLY 46 3HA GLY 46 8.001 -14.118 -3.351
340 H THR 47 H THR 47 9.619 -12.929 -1.381
341 HA THR 47 HA THR 47 7.768 -12.238 0.555
342 HB THR 47 HB THR 47 10.695 -11.487 0.446
343 HG1 THR 47 HG1 THR 47 9.546 -13.582 1.960
344 HG21 THR 47 3HG2 THR 47 9.702 -10.097 2.091
345 HG22 THR 47 1HG2 THR 47 10.431 -11.443 2.966
346 HG23 THR 47 2HG2 THR 47 8.689 -11.409 2.692
347 H ALA 48 H ALA 48 6.497 -10.523 0.731
348 HA ALA 48 HA ALA 48 7.089 -8.082 -0.709
349 HB1 ALA 48 1HB ALA 48 4.785 -9.227 -0.423
350 HB2 ALA 48 2HB ALA 48 4.760 -8.410 1.140
351 HB3 ALA 48 3HB ALA 48 4.886 -7.468 -0.345
352 H VAL 49 H VAL 49 7.393 -6.048 0.204
353 HA VAL 49 HA VAL 49 7.889 -5.970 3.103
354 HB VAL 49 HB VAL 49 9.669 -4.656 1.047
355 HG11 VAL 49 1HG1 VAL 49 9.287 -4.200 3.816
356 HG12 VAL 49 2HG1 VAL 49 10.866 -4.961 3.611
357 HG13 VAL 49 3HG1 VAL 49 10.482 -3.475 2.741
358 HG21 VAL 49 3HG2 VAL 49 11.311 -6.403 2.156
359 HG22 VAL 49 1HG2 VAL 49 9.812 -7.298 2.406
360 HG23 VAL 49 2HG2 VAL 49 10.303 -6.838 0.776
361 H GLU 50 H GLU 50 7.107 -4.219 4.129
362 HA GLU 50 HA GLU 50 5.468 -2.380 2.644
363 HB2 GLU 50 2HB GLU 50 4.679 -3.176 4.788
364 HB3 GLU 50 3HB GLU 50 6.125 -2.573 5.587
365 HG2 GLU 50 2HG GLU 50 4.169 -1.145 5.963
366 HG3 GLU 50 3HG GLU 50 5.478 -0.297 5.141
367 H LEU 51 H LEU 51 5.870 -0.297 2.141
368 HA LEU 51 HA LEU 51 8.530 0.749 2.837
369 HB2 LEU 51 2HB LEU 51 6.755 1.632 0.571
370 HB3 LEU 51 3HB LEU 51 8.444 2.060 0.838
371 HG LEU 51 HG LEU 51 7.699 -0.801 0.401
372 HD11 LEU 51 1HD1 LEU 51 8.475 0.174 -2.077
373 HD12 LEU 51 2HD1 LEU 51 7.289 1.342 -1.496
374 HD13 LEU 51 3HD1 LEU 51 6.862 -0.365 -1.611
375 HD21 LEU 51 3HD2 LEU 51 10.016 0.147 1.065
376 HD22 LEU 51 1HD2 LEU 51 10.106 0.652 -0.622
377 HD23 LEU 51 2HD2 LEU 51 9.915 -1.055 -0.222
378 HA PRO 52 HA PRO 52 5.816 3.466 5.295
379 HB2 PRO 52 2HB PRO 52 7.743 4.091 7.103
380 HB3 PRO 52 3HB PRO 52 6.776 2.614 7.201
381 HG2 PRO 52 2HG PRO 52 9.547 2.998 6.134
382 HG3 PRO 52 3HG PRO 52 8.914 1.698 7.161
383 HD2 PRO 52 2HD PRO 52 9.267 1.405 4.492
384 HD3 PRO 52 3HD PRO 52 7.969 0.580 5.380
385 H ASP 53 H ASP 53 5.762 5.713 5.505
386 HA ASP 53 HA ASP 53 6.173 7.879 4.947
387 HB2 ASP 53 2HB ASP 53 9.077 7.140 4.617
388 HB3 ASP 53 3HB ASP 53 8.396 8.696 5.083
389 H VAL 54 H VAL 54 5.428 6.061 2.901
390 HA VAL 54 HA VAL 54 6.763 7.289 0.576
391 HB VAL 54 HB VAL 54 5.559 4.522 0.742
392 HG11 VAL 54 1HG1 VAL 54 6.765 6.056 -1.549
393 HG12 VAL 54 2HG1 VAL 54 6.574 4.302 -1.558
394 HG13 VAL 54 3HG1 VAL 54 5.155 5.344 -1.443
395 HG21 VAL 54 3HG2 VAL 54 7.976 3.894 0.180
396 HG22 VAL 54 1HG2 VAL 54 8.387 5.530 0.695
397 HG23 VAL 54 2HG2 VAL 54 7.632 4.411 1.831
398 H GLN 55 H GLN 55 5.486 8.035 -1.085
399 HA GLN 55 HA GLN 55 2.579 7.973 -0.608
400 HB2 GLN 55 2HB GLN 55 4.093 10.218 -1.940
401 HB3 GLN 55 3HB GLN 55 2.403 10.210 -1.456
402 HG2 GLN 55 2HG GLN 55 2.992 10.236 0.856
403 HG3 GLN 55 3HG GLN 55 4.697 10.003 0.475
404 HE21 GLN 55 1HE2 GLN 55 2.560 12.217 1.469
405 HE22 GLN 55 2HE2 GLN 55 3.301 13.659 0.872
406 H THR 56 H THR 56 1.616 9.019 -2.883
407 HA THR 56 HA THR 56 1.592 6.911 -4.677
408 HB THR 56 HB THR 56 1.080 9.786 -5.447
409 HG1 THR 56 HG1 THR 56 -0.548 7.918 -4.049
410 HG21 THR 56 3HG2 THR 56 1.067 8.281 -7.332
411 HG22 THR 56 1HG2 THR 56 -0.594 8.735 -6.957
412 HG23 THR 56 2HG2 THR 56 0.017 7.153 -6.474
413 H ALA 57 H ALA 57 2.764 6.325 -6.424
414 HA ALA 57 HA ALA 57 4.802 8.156 -7.456
415 HB1 ALA 57 1HB ALA 57 5.904 6.774 -5.747
416 HB2 ALA 57 2HB ALA 57 5.416 5.323 -6.624
417 HB3 ALA 57 3HB ALA 57 6.537 6.466 -7.364
418 HA PRO 58 HA PRO 58 2.536 6.160 -10.904
419 HB2 PRO 58 2HB PRO 58 2.710 8.321 -12.539
420 HB3 PRO 58 3HB PRO 58 1.452 8.145 -11.310
421 HG2 PRO 58 2HG PRO 58 4.001 9.711 -11.201
422 HG3 PRO 58 3HG PRO 58 2.379 10.174 -10.654
423 HD2 PRO 58 2HD PRO 58 4.297 9.305 -8.952
424 HD3 PRO 58 3HD PRO 58 2.570 8.995 -8.683
425 H VAL 59 H VAL 59 4.039 4.681 -11.578
426 HA VAL 59 HA VAL 59 6.293 5.718 -13.173
427 HB VAL 59 HB VAL 59 7.515 3.660 -12.645
428 HG11 VAL 59 1HG1 VAL 59 7.695 5.713 -11.222
429 HG12 VAL 59 2HG1 VAL 59 6.555 4.963 -10.103
430 HG13 VAL 59 3HG1 VAL 59 8.122 4.210 -10.405
431 HG21 VAL 59 3HG2 VAL 59 6.705 2.096 -10.979
432 HG22 VAL 59 1HG2 VAL 59 5.224 3.034 -10.786
433 HG23 VAL 59 2HG2 VAL 59 5.552 2.208 -12.309
434 H ALA 60 H ALA 60 7.119 3.698 -14.600
435 HA ALA 60 HA ALA 60 4.790 2.958 -16.224
436 HB1 ALA 60 1HB ALA 60 6.123 3.012 -18.089
437 HB2 ALA 60 2HB ALA 60 6.911 4.235 -17.091
438 HB3 ALA 60 3HB ALA 60 7.586 2.609 -17.191
439 H GLU 61 H GLU 61 4.932 1.417 -14.032
440 HA GLU 61 HA GLU 61 6.111 -1.108 -14.992
441 HB2 GLU 61 2HB GLU 61 5.815 0.008 -12.220
442 HB3 GLU 61 3HB GLU 61 5.939 -1.727 -12.475
443 HG2 GLU 61 2HG GLU 61 8.126 -1.204 -12.118
444 HG3 GLU 61 3HG GLU 61 8.050 -1.060 -13.873
445 H THR 62 H THR 62 3.682 -0.447 -15.987
446 HA THR 62 HA THR 62 1.841 -2.195 -14.489
447 HB THR 62 HB THR 62 0.010 -0.855 -15.725
448 HG1 THR 62 HG1 THR 62 0.817 0.654 -16.968
449 HG21 THR 62 3HG2 THR 62 1.637 0.160 -13.413
450 HG22 THR 62 1HG2 THR 62 0.075 -0.658 -13.390
451 HG23 THR 62 2HG2 THR 62 0.190 1.007 -13.961
452 H VAL 63 H VAL 63 0.156 -3.211 -15.893
453 HA VAL 63 HA VAL 63 -0.324 -4.699 -17.554
454 HB VAL 63 HB VAL 63 0.922 -2.601 -19.335
455 HG11 VAL 63 1HG1 VAL 63 -1.199 -3.749 -20.661
456 HG12 VAL 63 2HG1 VAL 63 0.507 -4.115 -20.924
457 HG13 VAL 63 3HG1 VAL 63 -0.454 -5.117 -19.835
458 HG21 VAL 63 3HG2 VAL 63 -1.454 -1.817 -19.579
459 HG22 VAL 63 1HG2 VAL 63 -1.860 -2.848 -18.207
460 HG23 VAL 63 2HG2 VAL 63 -0.725 -1.514 -18.002
461 H ASN 64 H ASN 64 1.281 -6.187 -16.716
462 HA ASN 64 HA ASN 64 3.378 -6.701 -18.694
463 HB2 ASN 64 2HB ASN 64 3.844 -6.768 -15.704
464 HB3 ASN 64 3HB ASN 64 5.018 -7.199 -16.944
465 HD21 ASN 64 1HD2 ASN 64 5.341 -5.410 -18.619
466 HD22 ASN 64 2HD2 ASN 64 5.528 -3.814 -17.984
467 H LEU 65 H LEU 65 1.304 -8.123 -19.046
468 HA LEU 65 HA LEU 65 2.007 -10.766 -18.094
469 HB2 LEU 65 2HB LEU 65 -0.175 -11.317 -17.247
470 HB3 LEU 65 3HB LEU 65 0.463 -9.924 -16.376
471 HG LEU 65 HG LEU 65 -0.988 -8.622 -18.190
472 HD11 LEU 65 1HD1 LEU 65 -1.633 -11.133 -18.926
473 HD12 LEU 65 2HD1 LEU 65 -2.697 -9.742 -19.133
474 HD13 LEU 65 3HD1 LEU 65 -2.905 -10.811 -17.746
475 HD21 LEU 65 3HD2 LEU 65 -1.167 -9.174 -15.492
476 HD22 LEU 65 1HD2 LEU 65 -2.749 -9.641 -16.116
477 HD23 LEU 65 2HD2 LEU 65 -2.143 -8.007 -16.385
478 H TRP 66 H TRP 66 1.434 -12.371 -19.504
479 HA TRP 66 HA TRP 66 0.027 -11.502 -21.943
480 HB2 TRP 66 2HB TRP 66 2.154 -13.634 -21.645
481 HB3 TRP 66 3HB TRP 66 1.334 -13.213 -23.146
482 HD1 TRP 66 HD1 TRP 66 1.629 -10.345 -23.663
483 HE1 TRP 66 HE1 TRP 66 3.866 -9.071 -23.674
484 HE3 TRP 66 HE3 TRP 66 4.424 -13.584 -20.863
485 HZ2 TRP 66 HZ2 TRP 66 6.470 -9.396 -22.634
486 HZ3 TRP 66 HZ3 TRP 66 6.779 -13.029 -20.418
487 HH2 TRP 66 HH2 TRP 66 7.779 -10.978 -21.287
488 H GLU 67 H GLU 67 0.270 -13.917 -19.447
489 HA GLU 67 HA GLU 67 -2.305 -14.997 -20.259
490 HB2 GLU 67 2HB GLU 67 -0.868 -16.495 -21.438
491 HB3 GLU 67 3HB GLU 67 0.203 -16.660 -20.053
492 HG2 GLU 67 2HG GLU 67 -1.128 -18.646 -20.296
493 HG3 GLU 67 3HG GLU 67 -1.592 -17.798 -18.822
494 H VAL 68 H VAL 68 -3.220 -14.227 -18.391
495 HA VAL 68 HA VAL 68 -2.096 -15.173 -15.844
496 HB VAL 68 HB VAL 68 -2.460 -12.717 -16.095
497 HG11 VAL 68 1HG1 VAL 68 -5.397 -13.361 -15.974
498 HG12 VAL 68 2HG1 VAL 68 -4.637 -11.784 -16.197
499 HG13 VAL 68 3HG1 VAL 68 -4.551 -12.995 -17.476
500 HG21 VAL 68 3HG2 VAL 68 -4.016 -14.198 -13.983
501 HG22 VAL 68 1HG2 VAL 68 -2.360 -13.600 -13.886
502 HG23 VAL 68 2HG2 VAL 68 -3.707 -12.463 -13.929
503 H GLU 69 H GLU 69 -4.869 -15.333 -17.934
504 HA GLU 69 HA GLU 69 -6.533 -16.625 -15.943
505 HB2 GLU 69 2HB GLU 69 -6.930 -15.940 -18.851
506 HB3 GLU 69 3HB GLU 69 -8.097 -16.894 -17.945
507 HG2 GLU 69 2HG GLU 69 -7.202 -14.208 -16.974
508 HG3 GLU 69 3HG GLU 69 -8.488 -14.375 -18.169
509 H HIS 70 H HIS 70 -4.566 -18.221 -15.838
510 HA HIS 70 HA HIS 70 -4.361 -20.201 -17.870
511 HB2 HIS 70 2HB HIS 70 -3.005 -21.437 -16.268
512 HB3 HIS 70 3HB HIS 70 -2.547 -19.736 -16.257
513 HD1 HIS 70 HD1 HIS 70 -4.700 -22.128 -14.237
514 HD2 HIS 70 HD2 HIS 70 -2.524 -18.619 -13.785
515 HE1 HIS 70 HE1 HIS 70 -4.767 -21.609 -11.778
516 H HIS 71 H HIS 71 -4.644 -22.612 -17.121
517 HA HIS 71 HA HIS 71 -6.983 -23.090 -15.498
518 HB2 HIS 71 2HB HIS 71 -8.140 -24.311 -17.414
519 HB3 HIS 71 3HB HIS 71 -8.182 -22.552 -17.466
520 HD1 HIS 71 HD1 HIS 71 -6.260 -25.435 -19.010
521 HD2 HIS 71 HD2 HIS 71 -7.234 -21.469 -19.777
522 HE1 HIS 71 HE1 HIS 71 -5.426 -24.976 -21.337