Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
618767 | 5o6f RC | 26802 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H2 MET 1 2H MET 1 7.085 -10.233 -8.663
2 H MET 1 1H MET 1 7.816 -10.233 -7.140
3 H3 MET 1 3H MET 1 6.767 -11.489 -7.574
4 HA MET 1 HA MET 1 6.047 -8.647 -7.168
5 HB2 MET 1 1HB MET 1 3.745 -9.317 -7.528
6 HB3 MET 1 2HB MET 1 4.701 -9.748 -8.938
7 HG2 MET 1 1HG MET 1 4.679 -12.036 -8.381
8 HG3 MET 1 2HG MET 1 4.077 -11.711 -6.758
9 HE1 MET 1 1HE MET 1 1.609 -11.048 -6.185
10 HE2 MET 1 2HE MET 1 0.374 -10.693 -7.393
11 HE3 MET 1 3HE MET 1 1.759 -9.620 -7.207
12 H ALA 2 H ALA 2 4.558 -8.371 -5.360
13 HA ALA 2 HA ALA 2 4.234 -10.531 -3.476
14 HB1 ALA 2 1HB ALA 2 5.870 -8.118 -2.688
15 HB2 ALA 2 2HB ALA 2 6.491 -9.754 -2.906
16 HB3 ALA 2 3HB ALA 2 5.342 -9.412 -1.612
17 H GLN 3 H GLN 3 2.756 -9.990 -1.796
18 HA GLN 3 HA GLN 3 1.389 -7.408 -2.123
19 HB2 GLN 3 1HB GLN 3 0.105 -10.091 -1.593
20 HB3 GLN 3 2HB GLN 3 -0.731 -8.550 -1.513
21 HG2 GLN 3 1HG GLN 3 -0.225 -8.188 -3.891
22 HG3 GLN 3 2HG GLN 3 0.517 -9.786 -3.950
23 HE21 GLN 3 1HE2 GLN 3 -1.744 -8.776 -5.437
24 HE22 GLN 3 2HE2 GLN 3 -3.081 -9.801 -5.045
25 H GLY 4 H GLY 4 0.029 -6.960 -0.096
26 HA2 GLY 4 1HA GLY 4 0.443 -8.269 2.310
27 HA3 GLY 4 2HA GLY 4 1.746 -7.104 2.154
28 H THR 5 H THR 5 0.894 -6.140 4.038
29 HA THR 5 HA THR 5 -1.307 -4.283 3.439
30 HB THR 5 HB THR 5 -0.778 -5.433 6.181
31 HG1 THR 5 HG1 THR 5 -2.113 -7.051 5.742
32 HG21 THR 5 1HG2 THR 5 -3.163 -3.998 5.009
33 HG22 THR 5 2HG2 THR 5 -1.963 -3.287 6.089
34 HG23 THR 5 3HG2 THR 5 -3.017 -4.579 6.669
35 H VAL 6 H VAL 6 -0.603 -2.237 3.569
36 HA VAL 6 HA VAL 6 1.948 -1.569 4.566
37 HB VAL 6 HB VAL 6 1.190 -0.059 2.974
38 HG11 VAL 6 1HG1 VAL 6 -1.139 -0.631 2.967
39 HG12 VAL 6 2HG1 VAL 6 -0.961 1.119 3.090
40 HG13 VAL 6 3HG1 VAL 6 -1.374 0.173 4.518
41 HG21 VAL 6 1HG2 VAL 6 0.982 2.115 4.096
42 HG22 VAL 6 2HG2 VAL 6 2.254 1.118 4.810
43 HG23 VAL 6 3HG2 VAL 6 0.697 1.284 5.627
44 H LYS 7 H LYS 7 2.549 -1.682 6.572
45 HA LYS 7 HA LYS 7 0.630 -1.856 8.673
46 HB2 LYS 7 1HB LYS 7 2.594 -2.165 10.142
47 HB3 LYS 7 2HB LYS 7 2.561 -3.267 8.780
48 HG2 LYS 7 1HG LYS 7 4.266 -2.032 7.656
49 HG3 LYS 7 2HG LYS 7 4.208 -0.756 8.873
50 HD2 LYS 7 1HD LYS 7 6.121 -2.287 9.195
51 HD3 LYS 7 2HD LYS 7 5.015 -2.286 10.571
52 HE2 LYS 7 1HE LYS 7 3.954 -4.332 9.627
53 HE3 LYS 7 2HE LYS 7 5.200 -4.354 8.384
54 HZ1 LYS 7 1HZ LYS 7 5.691 -5.840 10.248
55 HZ2 LYS 7 2HZ LYS 7 5.711 -4.520 11.304
56 HZ3 LYS 7 3HZ LYS 7 6.874 -4.638 10.077
57 H TRP 8 H TRP 8 2.805 0.544 7.447
58 HA TRP 8 HA TRP 8 1.196 2.601 8.522
59 HB2 TRP 8 1HB TRP 8 2.811 3.727 9.950
60 HB3 TRP 8 2HB TRP 8 2.484 2.117 10.570
61 HD1 TRP 8 HD1 TRP 8 4.489 0.391 10.618
62 HE1 TRP 8 HE1 TRP 8 7.037 0.687 10.392
63 HE3 TRP 8 HE3 TRP 8 4.587 5.111 8.654
64 HZ2 TRP 8 HZ2 TRP 8 8.842 2.664 9.511
65 HZ3 TRP 8 HZ3 TRP 8 6.765 6.131 8.146
66 HH2 TRP 8 HH2 TRP 8 8.849 4.928 8.564
67 H PHE 9 H PHE 9 1.647 4.606 7.576
68 HA PHE 9 HA PHE 9 3.939 4.774 5.804
69 HB2 PHE 9 1HB PHE 9 2.122 3.706 4.466
70 HB3 PHE 9 2HB PHE 9 1.139 5.141 4.727
71 HD1 PHE 9 HD1 PHE 9 4.133 3.812 3.090
72 HD2 PHE 9 HD2 PHE 9 1.550 7.162 3.517
73 HE1 PHE 9 HE1 PHE 9 5.182 4.865 1.130
74 HE2 PHE 9 HE2 PHE 9 2.591 8.218 1.556
75 HZ PHE 9 HZ PHE 9 4.411 7.073 0.362
76 H ASN 10 H ASN 10 4.767 6.721 5.825
77 HA ASN 10 HA ASN 10 3.254 8.911 7.019
78 HB2 ASN 10 1HB ASN 10 5.588 8.430 7.761
79 HB3 ASN 10 2HB ASN 10 6.149 8.810 6.141
80 HD21 ASN 10 1HD2 ASN 10 6.671 10.043 8.785
81 HD22 ASN 10 2HD2 ASN 10 6.308 11.720 8.575
82 H ALA 11 H ALA 11 1.928 9.819 5.598
83 HA ALA 11 HA ALA 11 2.401 9.825 2.790
84 HB1 ALA 11 1HB ALA 11 0.322 11.297 4.397
85 HB2 ALA 11 2HB ALA 11 0.152 9.677 3.721
86 HB3 ALA 11 3HB ALA 11 0.308 11.069 2.648
87 H GLU 12 H GLU 12 3.154 11.976 5.360
88 HA GLU 12 HA GLU 12 3.300 14.358 3.790
89 HB2 GLU 12 1HB GLU 12 2.971 14.277 6.282
90 HB3 GLU 12 2HB GLU 12 4.656 13.787 6.424
91 HG2 GLU 12 1HG GLU 12 4.409 16.159 6.834
92 HG3 GLU 12 2HG GLU 12 5.355 15.870 5.374
93 H LYS 13 H LYS 13 5.609 11.982 4.979
94 HA LYS 13 HA LYS 13 7.819 13.349 3.691
95 HB2 LYS 13 1HB LYS 13 7.728 10.747 5.209
96 HB3 LYS 13 2HB LYS 13 9.187 11.548 4.652
97 HG2 LYS 13 1HG LYS 13 7.228 12.689 6.622
98 HG3 LYS 13 2HG LYS 13 8.748 11.900 7.035
99 HD2 LYS 13 1HD LYS 13 9.908 13.623 5.633
100 HD3 LYS 13 2HD LYS 13 8.360 14.458 5.504
101 HE2 LYS 13 1HE LYS 13 8.264 14.654 7.939
102 HE3 LYS 13 2HE LYS 13 9.808 13.817 8.066
103 HZ1 LYS 13 1HZ LYS 13 9.331 16.452 6.790
104 HZ2 LYS 13 2HZ LYS 13 10.810 15.637 6.776
105 HZ3 LYS 13 3HZ LYS 13 10.149 16.168 8.241
106 H GLY 14 H GLY 14 5.789 10.568 3.213
107 HA2 GLY 14 1HA GLY 14 5.325 9.633 1.112
108 HA3 GLY 14 2HA GLY 14 6.806 10.344 0.492
109 H PHE 15 H PHE 15 6.652 8.413 3.445
110 HA PHE 15 HA PHE 15 7.526 6.047 2.013
111 HB2 PHE 15 1HB PHE 15 9.585 5.732 3.211
112 HB3 PHE 15 2HB PHE 15 9.624 7.313 2.447
113 HD1 PHE 15 HD1 PHE 15 9.814 9.302 3.741
114 HD2 PHE 15 HD2 PHE 15 9.282 5.538 5.659
115 HE1 PHE 15 HE1 PHE 15 10.421 10.314 5.899
116 HE2 PHE 15 HE2 PHE 15 9.877 6.552 7.817
117 HZ PHE 15 HZ PHE 15 10.449 8.941 7.939
118 H GLY 16 H GLY 16 7.692 4.139 3.442
119 HA2 GLY 16 1HA GLY 16 6.684 4.185 6.092
120 HA3 GLY 16 2HA GLY 16 5.389 3.805 4.963
121 H PHE 17 H PHE 17 5.309 1.740 6.109
122 HA PHE 17 HA PHE 17 7.147 -0.153 4.833
123 HB2 PHE 17 1HB PHE 17 6.730 0.182 7.761
124 HB3 PHE 17 2HB PHE 17 6.889 -1.456 7.135
125 HD1 PHE 17 HD1 PHE 17 8.595 1.722 7.697
126 HD2 PHE 17 HD2 PHE 17 8.957 -2.232 6.184
127 HE1 PHE 17 HE1 PHE 17 11.043 1.958 7.682
128 HE2 PHE 17 HE2 PHE 17 11.403 -2.006 6.160
129 HZ PHE 17 HZ PHE 17 12.452 0.091 6.912
130 H ILE 18 H ILE 18 6.312 -2.076 4.310
131 HA ILE 18 HA ILE 18 3.453 -2.513 4.859
132 HB ILE 18 HB ILE 18 5.101 -3.342 2.467
133 HG12 ILE 18 1HG1 ILE 18 2.609 -1.661 2.495
134 HG13 ILE 18 2HG1 ILE 18 4.218 -0.961 2.640
135 HG21 ILE 18 1HG2 ILE 18 2.248 -4.026 3.131
136 HG22 ILE 18 2HG2 ILE 18 3.604 -5.146 2.983
137 HG23 ILE 18 3HG2 ILE 18 3.009 -4.289 1.562
138 HD11 ILE 18 1HD1 ILE 18 4.829 -1.874 0.476
139 HD12 ILE 18 2HD1 ILE 18 3.377 -0.880 0.346
140 HD13 ILE 18 3HD1 ILE 18 3.246 -2.639 0.339
141 H ALA 19 H ALA 19 2.804 -4.539 5.496
142 HA ALA 19 HA ALA 19 4.931 -6.447 6.181
143 HB1 ALA 19 1HB ALA 19 3.415 -5.801 7.999
144 HB2 ALA 19 2HB ALA 19 3.261 -7.516 7.611
145 HB3 ALA 19 3HB ALA 19 2.040 -6.370 7.053
146 HA PRO 20 HA PRO 20 3.509 -8.131 2.145
147 HB2 PRO 20 1HB PRO 20 5.854 -9.825 2.812
148 HB3 PRO 20 2HB PRO 20 5.433 -9.038 1.292
149 HG2 PRO 20 1HG PRO 20 7.353 -8.055 2.852
150 HG3 PRO 20 2HG PRO 20 6.249 -6.985 1.973
151 HD2 PRO 20 1HD PRO 20 6.314 -7.678 4.860
152 HD3 PRO 20 2HD PRO 20 5.847 -6.164 4.073
153 H ASP 21 H ASP 21 2.459 -9.944 1.611
154 HA ASP 21 HA ASP 21 1.482 -11.662 3.681
155 HB2 ASP 21 1HB ASP 21 0.110 -10.929 1.749
156 HB3 ASP 21 2HB ASP 21 1.165 -11.832 0.673
157 H ASP 22 H ASP 22 4.218 -11.626 1.778
158 HA ASP 22 HA ASP 22 4.580 -14.460 1.440
159 HB2 ASP 22 1HB ASP 22 5.405 -12.753 -0.190
160 HB3 ASP 22 2HB ASP 22 6.579 -12.236 1.012
161 H GLY 23 H GLY 23 4.344 -13.284 4.185
162 HA2 GLY 23 1HA GLY 23 5.235 -14.349 6.132
163 HA3 GLY 23 2HA GLY 23 6.760 -14.550 5.281
164 H SER 24 H SER 24 5.641 -11.574 4.595
165 HA SER 24 HA SER 24 6.219 -9.476 5.117
166 HB2 SER 24 1HB SER 24 5.788 -8.806 7.483
167 HB3 SER 24 2HB SER 24 4.480 -9.714 6.731
168 HG SER 24 HG SER 24 6.259 -11.353 7.974
169 H ALA 25 H ALA 25 8.339 -9.398 4.455
170 HA ALA 25 HA ALA 25 10.402 -9.770 6.482
171 HB1 ALA 25 1HB ALA 25 11.987 -9.351 4.662
172 HB2 ALA 25 2HB ALA 25 10.639 -9.022 3.572
173 HB3 ALA 25 3HB ALA 25 10.850 -10.635 4.252
174 H ASP 26 H ASP 26 8.291 -7.541 6.191
175 HA ASP 26 HA ASP 26 8.047 -5.323 6.553
176 HB2 ASP 26 1HB ASP 26 10.796 -5.725 7.716
177 HB3 ASP 26 2HB ASP 26 9.995 -4.158 7.728
178 H VAL 27 H VAL 27 7.883 -4.853 4.360
179 HA VAL 27 HA VAL 27 10.329 -4.101 2.971
180 HB VAL 27 HB VAL 27 8.685 -5.570 1.841
181 HG11 VAL 27 1HG1 VAL 27 6.631 -4.595 0.938
182 HG12 VAL 27 2HG1 VAL 27 6.945 -3.122 1.858
183 HG13 VAL 27 3HG1 VAL 27 6.633 -4.641 2.702
184 HG21 VAL 27 1HG2 VAL 27 10.234 -4.339 0.504
185 HG22 VAL 27 2HG2 VAL 27 9.212 -2.900 0.569
186 HG23 VAL 27 3HG2 VAL 27 8.663 -4.336 -0.299
187 H PHE 28 H PHE 28 10.882 -2.100 2.485
188 HA PHE 28 HA PHE 28 9.498 0.061 3.806
189 HB2 PHE 28 1HB PHE 28 11.922 -0.067 3.931
190 HB3 PHE 28 2HB PHE 28 12.044 -0.047 2.178
191 HD1 PHE 28 HD1 PHE 28 12.210 1.963 1.016
192 HD2 PHE 28 HD2 PHE 28 10.980 1.980 5.089
193 HE1 PHE 28 HE1 PHE 28 12.384 4.415 1.054
194 HE2 PHE 28 HE2 PHE 28 11.153 4.433 5.136
195 HZ PHE 28 HZ PHE 28 11.853 5.652 3.116
196 H VAL 29 H VAL 29 8.155 1.466 2.876
197 HA VAL 29 HA VAL 29 7.750 1.251 -0.022
198 HB VAL 29 HB VAL 29 5.965 2.906 1.684
199 HG11 VAL 29 1HG1 VAL 29 5.459 1.039 -0.621
200 HG12 VAL 29 2HG1 VAL 29 5.636 2.790 -0.727
201 HG13 VAL 29 3HG1 VAL 29 4.269 2.093 0.140
202 HG21 VAL 29 1HG2 VAL 29 4.631 0.959 2.309
203 HG22 VAL 29 2HG2 VAL 29 6.239 0.915 3.032
204 HG23 VAL 29 3HG2 VAL 29 5.872 -0.099 1.636
205 H HIS 30 H HIS 30 7.742 3.054 -1.350
206 HA HIS 30 HA HIS 30 8.473 5.624 -0.183
207 HB2 HIS 30 1HB HIS 30 10.541 4.338 -0.899
208 HB3 HIS 30 2HB HIS 30 9.950 4.470 -2.552
209 HD1 HIS 30 HD1 HIS 30 10.950 6.344 -3.779
210 HD2 HIS 30 HD2 HIS 30 10.737 7.111 0.300
211 HE1 HIS 30 HE1 HIS 30 12.028 8.596 -3.454
212 HE2 HIS 30 HE2 HIS 30 12.107 8.905 -0.957
213 H TYR 31 H TYR 31 7.570 7.314 -1.213
214 HA TYR 31 HA TYR 31 5.163 6.820 -2.471
215 HB2 TYR 31 1HB TYR 31 4.892 9.189 -2.649
216 HB3 TYR 31 2HB TYR 31 5.744 8.845 -1.150
217 HD1 TYR 31 HD1 TYR 31 5.858 10.541 -4.332
218 HD2 TYR 31 HD2 TYR 31 8.210 9.284 -1.017
219 HE1 TYR 31 HE1 TYR 31 7.616 12.125 -4.985
220 HE2 TYR 31 HE2 TYR 31 9.974 10.865 -1.663
221 HH TYR 31 HH TYR 31 9.485 13.327 -3.951
222 H SER 32 H SER 32 8.263 7.491 -3.995
223 HA SER 32 HA SER 32 7.170 8.193 -6.528
224 HB2 SER 32 1HB SER 32 9.535 7.745 -7.332
225 HB3 SER 32 2HB SER 32 9.386 8.940 -6.041
226 HG SER 32 HG SER 32 10.330 6.278 -5.919
227 H GLU 33 H GLU 33 7.698 5.241 -4.902
228 HA GLU 33 HA GLU 33 7.661 3.642 -7.326
229 HB2 GLU 33 1HB GLU 33 8.006 3.030 -4.407
230 HB3 GLU 33 2HB GLU 33 7.681 1.753 -5.563
231 HG2 GLU 33 1HG GLU 33 10.065 1.985 -5.058
232 HG3 GLU 33 2HG GLU 33 9.710 2.256 -6.761
233 H ILE 34 H ILE 34 5.494 4.945 -5.064
234 HA ILE 34 HA ILE 34 3.526 2.890 -5.139
235 HB ILE 34 HB ILE 34 3.308 5.777 -4.301
236 HG12 ILE 34 1HG1 ILE 34 3.592 3.224 -2.704
237 HG13 ILE 34 2HG1 ILE 34 4.833 4.451 -2.921
238 HG21 ILE 34 1HG2 ILE 34 1.127 4.915 -4.958
239 HG22 ILE 34 2HG2 ILE 34 1.211 5.139 -3.210
240 HG23 ILE 34 3HG2 ILE 34 1.348 3.521 -3.901
241 HD11 ILE 34 1HD1 ILE 34 3.458 6.058 -1.728
242 HD12 ILE 34 2HD1 ILE 34 3.770 4.623 -0.747
243 HD13 ILE 34 3HD1 ILE 34 2.201 4.839 -1.527
244 H GLN 35 H GLN 35 1.875 2.586 -6.430
245 HA GLN 35 HA GLN 35 1.502 4.452 -8.682
246 HB2 GLN 35 1HB GLN 35 1.003 1.471 -8.683
247 HB3 GLN 35 2HB GLN 35 0.981 2.550 -10.068
248 HG2 GLN 35 1HG GLN 35 3.390 1.842 -8.421
249 HG3 GLN 35 2HG GLN 35 3.000 1.201 -10.014
250 HE21 GLN 35 1HE2 GLN 35 5.303 2.743 -9.023
251 HE22 GLN 35 2HE2 GLN 35 5.418 4.116 -10.067
252 H GLY 36 H GLY 36 -0.168 5.598 -7.645
253 HA2 GLY 36 1HA GLY 36 -2.491 3.992 -6.804
254 HA3 GLY 36 2HA GLY 36 -2.083 5.571 -6.153
255 H ASN 37 H ASN 37 -4.292 6.116 -6.625
256 HA ASN 37 HA ASN 37 -5.009 6.416 -9.432
257 HB2 ASN 37 1HB ASN 37 -7.197 7.174 -8.552
258 HB3 ASN 37 2HB ASN 37 -6.738 5.598 -7.923
259 HD21 ASN 37 1HD2 ASN 37 -6.204 5.392 -5.753
260 HD22 ASN 37 2HD2 ASN 37 -6.587 6.613 -4.592
261 H GLY 38 H GLY 38 -2.820 7.942 -8.769
262 HA2 GLY 38 1HA GLY 38 -2.424 10.225 -9.500
263 HA3 GLY 38 2HA GLY 38 -3.927 10.680 -8.704
264 H PHE 39 H PHE 39 -3.319 8.952 -6.410
265 HA PHE 39 HA PHE 39 -1.527 10.763 -4.997
266 HB2 PHE 39 1HB PHE 39 -3.371 8.566 -4.047
267 HB3 PHE 39 2HB PHE 39 -2.275 9.432 -2.977
268 HD1 PHE 39 HD1 PHE 39 -5.402 9.544 -4.806
269 HD2 PHE 39 HD2 PHE 39 -2.614 11.826 -2.541
270 HE1 PHE 39 HE1 PHE 39 -7.101 11.293 -4.484
271 HE2 PHE 39 HE2 PHE 39 -4.308 13.578 -2.211
272 HZ PHE 39 HZ PHE 39 -6.556 13.313 -3.184
273 H ARG 40 H ARG 40 0.379 10.165 -4.105
274 HA ARG 40 HA ARG 40 1.385 7.485 -4.782
275 HB2 ARG 40 1HB ARG 40 2.950 9.968 -4.045
276 HB3 ARG 40 2HB ARG 40 3.623 8.437 -4.580
277 HG2 ARG 40 1HG ARG 40 1.865 10.223 -6.245
278 HG3 ARG 40 2HG ARG 40 3.625 10.161 -6.333
279 HD2 ARG 40 1HD ARG 40 3.524 7.824 -7.010
280 HD3 ARG 40 2HD ARG 40 1.765 7.847 -6.869
281 HE ARG 40 HE ARG 40 2.392 9.873 -8.618
282 HH11 ARG 40 1HH1 ARG 40 2.900 6.401 -8.514
283 HH12 ARG 40 2HH1 ARG 40 2.874 6.228 -10.244
284 HH21 ARG 40 1HH2 ARG 40 2.378 9.637 -10.879
285 HH22 ARG 40 2HH2 ARG 40 2.579 8.063 -11.584
286 H THR 41 H THR 41 -0.316 7.641 -2.676
287 HA THR 41 HA THR 41 1.424 7.449 -0.323
288 HB THR 41 HB THR 41 -0.451 8.448 1.017
289 HG1 THR 41 HG1 THR 41 -2.158 8.251 -0.444
290 HG21 THR 41 1HG2 THR 41 0.066 10.777 0.393
291 HG22 THR 41 2HG2 THR 41 0.801 10.197 -1.102
292 HG23 THR 41 3HG2 THR 41 1.513 9.771 0.454
293 H LEU 42 H LEU 42 0.414 6.277 1.474
294 HA LEU 42 HA LEU 42 -1.626 4.345 0.642
295 HB2 LEU 42 1HB LEU 42 0.980 3.786 2.047
296 HB3 LEU 42 2HB LEU 42 -0.360 2.658 2.045
297 HG LEU 42 HG LEU 42 1.120 3.616 -0.398
298 HD11 LEU 42 1HD1 LEU 42 1.149 0.932 0.961
299 HD12 LEU 42 2HD1 LEU 42 2.438 2.134 1.048
300 HD13 LEU 42 3HD1 LEU 42 2.033 1.386 -0.497
301 HD21 LEU 42 1HD2 LEU 42 -1.099 1.604 -0.069
302 HD22 LEU 42 2HD2 LEU 42 -0.147 1.818 -1.539
303 HD23 LEU 42 3HD2 LEU 42 -1.172 3.129 -0.955
304 H GLU 43 H GLU 43 -2.824 3.435 2.384
305 HA GLU 43 HA GLU 43 -2.897 5.183 4.737
306 HB2 GLU 43 1HB GLU 43 -5.033 3.427 3.515
307 HB3 GLU 43 2HB GLU 43 -5.230 4.351 4.999
308 HG2 GLU 43 1HG GLU 43 -4.768 6.420 3.698
309 HG3 GLU 43 2HG GLU 43 -4.766 5.439 2.234
310 H GLU 44 H GLU 44 -2.723 4.334 6.738
311 HA GLU 44 HA GLU 44 -1.350 1.915 7.060
312 HB2 GLU 44 1HB GLU 44 -1.232 3.846 8.601
313 HB3 GLU 44 2HB GLU 44 -2.874 3.513 9.117
314 HG2 GLU 44 1HG GLU 44 -2.170 1.356 9.990
315 HG3 GLU 44 2HG GLU 44 -0.523 1.678 9.463
316 H ASN 45 H ASN 45 -1.990 -0.103 7.410
317 HA ASN 45 HA ASN 45 -3.276 -1.934 7.807
318 HB2 ASN 45 1HB ASN 45 -5.299 0.104 8.713
319 HB3 ASN 45 2HB ASN 45 -5.668 -1.612 8.640
320 HD21 ASN 45 1HD2 ASN 45 -3.927 0.875 10.271
321 HD22 ASN 45 2HD2 ASN 45 -3.408 -0.077 11.618
322 H GLN 46 H GLN 46 -3.102 -0.454 5.291
323 HA GLN 46 HA GLN 46 -5.583 -1.348 3.990
324 HB2 GLN 46 1HB GLN 46 -4.987 1.024 3.686
325 HB3 GLN 46 2HB GLN 46 -3.445 0.542 3.001
326 HG2 GLN 46 1HG GLN 46 -4.578 -0.522 1.143
327 HG3 GLN 46 2HG GLN 46 -6.139 -0.089 1.836
328 HE21 GLN 46 1HE2 GLN 46 -3.274 1.089 0.288
329 HE22 GLN 46 2HE2 GLN 46 -3.909 2.632 -0.165
330 H LYS 47 H LYS 47 -5.497 -2.770 2.275
331 HA LYS 47 HA LYS 47 -3.155 -4.428 2.130
332 HB2 LYS 47 1HB LYS 47 -5.711 -4.518 0.521
333 HB3 LYS 47 2HB LYS 47 -4.465 -5.761 0.529
334 HG2 LYS 47 1HG LYS 47 -6.158 -4.915 2.870
335 HG3 LYS 47 2HG LYS 47 -6.327 -6.402 1.940
336 HD2 LYS 47 1HD LYS 47 -3.821 -5.660 3.434
337 HD3 LYS 47 2HD LYS 47 -5.121 -6.615 4.142
338 HE2 LYS 47 1HE LYS 47 -3.695 -7.372 1.598
339 HE3 LYS 47 2HE LYS 47 -3.205 -7.935 3.194
340 HZ1 LYS 47 1HZ LYS 47 -5.337 -8.975 3.475
341 HZ2 LYS 47 2HZ LYS 47 -4.642 -9.518 2.035
342 HZ3 LYS 47 3HZ LYS 47 -5.882 -8.372 1.992
343 H VAL 48 H VAL 48 -1.909 -4.833 0.275
344 HA VAL 48 HA VAL 48 -2.011 -2.893 -1.877
345 HB VAL 48 HB VAL 48 -0.963 -1.676 -0.017
346 HG11 VAL 48 1HG1 VAL 48 1.145 -3.820 -0.144
347 HG12 VAL 48 2HG1 VAL 48 -0.014 -3.574 1.165
348 HG13 VAL 48 3HG1 VAL 48 1.218 -2.353 0.834
349 HG21 VAL 48 1HG2 VAL 48 0.934 -2.355 -2.253
350 HG22 VAL 48 2HG2 VAL 48 1.062 -0.956 -1.186
351 HG23 VAL 48 3HG2 VAL 48 -0.315 -1.109 -2.277
352 H GLU 49 H GLU 49 -0.626 -3.381 -3.599
353 HA GLU 49 HA GLU 49 0.821 -5.938 -3.433
354 HB2 GLU 49 1HB GLU 49 -1.181 -6.128 -4.841
355 HB3 GLU 49 2HB GLU 49 -0.640 -4.761 -5.800
356 HG2 GLU 49 1HG GLU 49 1.284 -6.015 -6.555
357 HG3 GLU 49 2HG GLU 49 0.815 -7.380 -5.540
358 H PHE 50 H PHE 50 2.869 -5.970 -4.341
359 HA PHE 50 HA PHE 50 3.950 -3.601 -5.588
360 HB2 PHE 50 1HB PHE 50 5.639 -3.287 -3.725
361 HB3 PHE 50 2HB PHE 50 3.993 -2.801 -3.337
362 HD1 PHE 50 HD1 PHE 50 2.587 -4.239 -1.902
363 HD2 PHE 50 HD2 PHE 50 6.722 -5.036 -2.525
364 HE1 PHE 50 HE1 PHE 50 2.591 -5.716 0.057
365 HE2 PHE 50 HE2 PHE 50 6.730 -6.514 -0.563
366 HZ PHE 50 HZ PHE 50 4.664 -6.856 0.730
367 H GLU 51 H GLU 51 6.487 -3.858 -5.507
368 HA GLU 51 HA GLU 51 7.200 -6.698 -5.798
369 HB2 GLU 51 1HB GLU 51 6.991 -5.621 -8.017
370 HB3 GLU 51 2HB GLU 51 8.158 -4.403 -7.520
371 HG2 GLU 51 1HG GLU 51 9.225 -6.064 -8.900
372 HG3 GLU 51 2HG GLU 51 9.854 -6.146 -7.255
373 H ILE 52 H ILE 52 8.807 -7.244 -4.459
374 HA ILE 52 HA ILE 52 10.054 -5.163 -2.910
375 HB ILE 52 HB ILE 52 10.471 -8.149 -2.789
376 HG12 ILE 52 1HG1 ILE 52 8.799 -6.298 -1.084
377 HG13 ILE 52 2HG1 ILE 52 8.172 -7.446 -2.259
378 HG21 ILE 52 1HG2 ILE 52 12.382 -6.919 -1.899
379 HG22 ILE 52 2HG2 ILE 52 11.484 -7.702 -0.598
380 HG23 ILE 52 3HG2 ILE 52 11.304 -5.969 -0.876
381 HD11 ILE 52 1HD1 ILE 52 7.950 -8.284 0.003
382 HD12 ILE 52 2HD1 ILE 52 9.691 -8.129 0.244
383 HD13 ILE 52 3HD1 ILE 52 9.062 -9.285 -0.930
384 H GLY 53 H GLY 53 11.873 -4.214 -3.345
385 HA2 GLY 53 1HA GLY 53 13.876 -5.645 -4.977
386 HA3 GLY 53 2HA GLY 53 13.572 -3.919 -5.143
387 H GLU 54 H GLU 54 15.921 -3.837 -4.731
388 HA GLU 54 HA GLU 54 16.561 -4.136 -1.880
389 HB2 GLU 54 1HB GLU 54 17.897 -5.464 -3.544
390 HB3 GLU 54 2HB GLU 54 18.486 -3.944 -4.197
391 HG2 GLU 54 1HG GLU 54 20.151 -4.798 -2.742
392 HG3 GLU 54 2HG GLU 54 19.404 -3.416 -1.942
393 H GLY 55 H GLY 55 16.722 -2.336 -0.757
394 HA2 GLY 55 1HA GLY 55 17.580 0.118 -2.153
395 HA3 GLY 55 2HA GLY 55 16.254 0.126 -0.996
396 H ALA 56 H ALA 56 17.959 1.851 -0.268
397 HA ALA 56 HA ALA 56 20.308 0.954 1.029
398 HB1 ALA 56 1HB ALA 56 20.408 3.182 1.990
399 HB2 ALA 56 2HB ALA 56 18.740 3.482 1.502
400 HB3 ALA 56 3HB ALA 56 19.990 3.263 0.279
401 H LYS 57 H LYS 57 16.987 1.241 2.030
402 HA LYS 57 HA LYS 57 17.708 0.686 4.812
403 HB2 LYS 57 1HB LYS 57 15.055 1.424 3.574
404 HB3 LYS 57 2HB LYS 57 15.332 1.167 5.291
405 HG2 LYS 57 1HG LYS 57 16.868 3.045 5.348
406 HG3 LYS 57 2HG LYS 57 16.657 3.284 3.614
407 HD2 LYS 57 1HD LYS 57 14.276 3.736 3.972
408 HD3 LYS 57 2HD LYS 57 14.497 3.505 5.707
409 HE2 LYS 57 1HE LYS 57 16.039 5.393 5.773
410 HE3 LYS 57 2HE LYS 57 15.864 5.611 4.033
411 HZ1 LYS 57 1HZ LYS 57 13.632 5.823 5.980
412 HZ2 LYS 57 2HZ LYS 57 13.572 6.175 4.325
413 HZ3 LYS 57 3HZ LYS 57 14.490 7.140 5.363
414 H GLY 58 H GLY 58 17.675 -1.248 2.428
415 HA2 GLY 58 1HA GLY 58 17.584 -3.622 2.799
416 HA3 GLY 58 2HA GLY 58 16.223 -3.357 3.881
417 HA PRO 59 HA PRO 59 14.176 -4.746 0.076
418 HB2 PRO 59 1HB PRO 59 11.900 -5.211 1.826
419 HB3 PRO 59 2HB PRO 59 12.814 -6.370 0.866
420 HG2 PRO 59 1HG PRO 59 12.891 -6.282 3.579
421 HG3 PRO 59 2HG PRO 59 14.228 -6.869 2.581
422 HD2 PRO 59 1HD PRO 59 13.906 -4.251 3.967
423 HD3 PRO 59 2HD PRO 59 15.369 -5.223 3.710
424 H GLN 60 H GLN 60 13.264 -3.282 -1.206
425 HA GLN 60 HA GLN 60 11.531 -1.264 0.053
426 HB2 GLN 60 1HB GLN 60 12.122 0.242 -1.804
427 HB3 GLN 60 2HB GLN 60 13.527 -0.238 -0.863
428 HG2 GLN 60 1HG GLN 60 14.227 -1.768 -2.554
429 HG3 GLN 60 2HG GLN 60 12.730 -1.534 -3.455
430 HE21 GLN 60 1HE2 GLN 60 14.376 1.117 -1.929
431 HE22 GLN 60 2HE2 GLN 60 14.936 1.866 -3.381
432 H ALA 61 H ALA 61 9.561 -0.884 -0.750
433 HA ALA 61 HA ALA 61 8.479 -2.864 -2.559
434 HB1 ALA 61 1HB ALA 61 6.318 -1.843 -2.037
435 HB2 ALA 61 2HB ALA 61 7.136 -0.553 -1.155
436 HB3 ALA 61 3HB ALA 61 7.218 -2.215 -0.565
437 H GLN 62 H GLN 62 8.788 -2.580 -4.642
438 HA GLN 62 HA GLN 62 8.643 0.121 -5.788
439 HB2 GLN 62 1HB GLN 62 9.434 -2.445 -7.164
440 HB3 GLN 62 2HB GLN 62 9.681 -0.805 -7.743
441 HG2 GLN 62 1HG GLN 62 11.298 -0.391 -6.008
442 HG3 GLN 62 2HG GLN 62 10.989 -1.977 -5.304
443 HE21 GLN 62 1HE2 GLN 62 11.662 -3.822 -6.416
444 HE22 GLN 62 2HE2 GLN 62 12.911 -3.755 -7.605
445 H GLN 63 H GLN 63 7.237 0.497 -7.576
446 HA GLN 63 HA GLN 63 5.184 0.431 -8.574
447 HB2 GLN 63 1HB GLN 63 5.868 -2.511 -8.642
448 HB3 GLN 63 2HB GLN 63 4.561 -1.773 -9.552
449 HG2 GLN 63 1HG GLN 63 7.443 -0.989 -9.838
450 HG3 GLN 63 2HG GLN 63 6.649 -2.202 -10.843
451 HE21 GLN 63 1HE2 GLN 63 7.037 1.151 -10.181
452 HE22 GLN 63 2HE2 GLN 63 6.109 1.739 -11.517
453 H VAL 64 H VAL 64 4.618 0.922 -6.178
454 HA VAL 64 HA VAL 64 3.271 -1.251 -4.800
455 HB VAL 64 HB VAL 64 3.350 1.597 -3.862
456 HG11 VAL 64 1HG1 VAL 64 3.273 -1.053 -2.450
457 HG12 VAL 64 2HG1 VAL 64 1.970 0.131 -2.578
458 HG13 VAL 64 3HG1 VAL 64 3.422 0.511 -1.649
459 HG21 VAL 64 1HG2 VAL 64 5.555 -0.429 -3.545
460 HG22 VAL 64 2HG2 VAL 64 5.483 1.151 -2.762
461 HG23 VAL 64 3HG2 VAL 64 5.630 1.040 -4.517
462 H HIS 65 H HIS 65 1.348 -1.714 -5.672
463 HA HIS 65 HA HIS 65 -0.494 0.471 -6.373
464 HB2 HIS 65 1HB HIS 65 -0.767 -2.495 -6.916
465 HB3 HIS 65 2HB HIS 65 -1.832 -1.231 -7.507
466 HD1 HIS 65 HD1 HIS 65 -1.286 -0.295 -9.759
467 HD2 HIS 65 HD2 HIS 65 1.893 -2.370 -8.085
468 HE1 HIS 65 HE1 HIS 65 0.446 -0.456 -11.573
469 HE2 HIS 65 HE2 HIS 65 2.237 -1.938 -10.610
470 H ALA 66 H ALA 66 -2.092 0.958 -5.005
471 HA ALA 66 HA ALA 66 -2.402 -0.493 -2.566
472 HB1 ALA 66 1HB ALA 66 -4.096 1.731 -3.699
473 HB2 ALA 66 2HB ALA 66 -2.674 1.942 -2.678
474 HB3 ALA 66 3HB ALA 66 -4.114 1.152 -2.033
475 H LEU 67 H LEU 67 -3.612 -2.195 -2.224
476 HA LEU 67 HA LEU 67 -5.483 -3.090 -4.259
477 HB2 LEU 67 1HB LEU 67 -4.526 -4.374 -1.700
478 HB3 LEU 67 2HB LEU 67 -5.652 -5.121 -2.812
479 HG LEU 67 HG LEU 67 -2.760 -4.456 -3.338
480 HD11 LEU 67 1HD1 LEU 67 -2.527 -6.878 -3.552
481 HD12 LEU 67 2HD1 LEU 67 -4.236 -7.080 -3.173
482 HD13 LEU 67 3HD1 LEU 67 -3.136 -6.431 -1.958
483 HD21 LEU 67 1HD2 LEU 67 -3.122 -5.550 -5.528
484 HD22 LEU 67 2HD2 LEU 67 -4.009 -4.036 -5.361
485 HD23 LEU 67 3HD2 LEU 67 -4.853 -5.576 -5.199
486 H GLY 68 H GLY 68 -5.450 -1.769 -1.048
487 HA2 GLY 68 1HA GLY 68 -7.246 -0.634 -0.049
488 HA3 GLY 68 2HA GLY 68 -8.344 -1.415 -1.179
489 H GLY 69 H GLY 69 -9.158 -3.442 -0.726
490 HA2 GLY 69 1HA GLY 69 -9.154 -5.460 0.630
491 HA3 GLY 69 2HA GLY 69 -8.556 -4.486 1.969
492 H GLU 70 H GLU 70 -9.969 -3.336 3.214
493 HA GLU 70 HA GLU 70 -12.717 -4.069 3.157
494 HB2 GLU 70 1HB GLU 70 -11.378 -1.811 4.658
495 HB3 GLU 70 2HB GLU 70 -12.977 -2.454 4.982
496 HG2 GLU 70 1HG GLU 70 -11.939 -4.632 5.535
497 HG3 GLU 70 2HG GLU 70 -10.355 -3.884 5.323
498 H ASN 71 H ASN 71 -13.815 -3.450 1.385
499 HA ASN 71 HA ASN 71 -13.583 -0.642 0.535
500 HB2 ASN 71 1HB ASN 71 -14.279 -1.379 -1.687
501 HB3 ASN 71 2HB ASN 71 -12.871 -2.290 -1.155
502 HD21 ASN 71 1HD2 ASN 71 -13.102 -4.471 -0.612
503 HD22 ASN 71 2HD2 ASN 71 -14.487 -5.388 -1.101
504 H LEU 72 H LEU 72 -15.371 -1.998 2.595
505 HA LEU 72 HA LEU 72 -17.987 -1.405 1.422
506 HB2 LEU 72 1HB LEU 72 -17.237 -2.874 3.949
507 HB3 LEU 72 2HB LEU 72 -18.885 -2.467 3.523
508 HG LEU 72 HG LEU 72 -18.613 -4.725 2.926
509 HD11 LEU 72 1HD1 LEU 72 -18.912 -4.758 0.533
510 HD12 LEU 72 2HD1 LEU 72 -18.195 -3.153 0.395
511 HD13 LEU 72 3HD1 LEU 72 -19.735 -3.362 1.228
512 HD21 LEU 72 1HD2 LEU 72 -16.057 -3.969 1.519
513 HD22 LEU 72 2HD2 LEU 72 -16.790 -5.573 1.538
514 HD23 LEU 72 3HD2 LEU 72 -16.189 -4.861 3.035
515 H TYR 73 H TYR 73 -16.755 0.835 1.663
516 HA TYR 73 HA TYR 73 -17.509 2.042 4.229
517 HB2 TYR 73 1HB TYR 73 -15.615 2.884 2.046
518 HB3 TYR 73 2HB TYR 73 -16.208 4.044 3.229
519 HD1 TYR 73 HD1 TYR 73 -14.989 4.365 5.158
520 HD2 TYR 73 HD2 TYR 73 -14.576 0.678 3.081
521 HE1 TYR 73 HE1 TYR 73 -13.222 3.690 6.725
522 HE2 TYR 73 HE2 TYR 73 -12.808 -0.009 4.645
523 HH TYR 73 HH TYR 73 -12.180 1.652 7.557
524 H PHE 74 H PHE 74 -18.789 3.893 4.295
525 HA PHE 74 HA PHE 74 -20.487 5.281 3.754
526 HB2 PHE 74 1HB PHE 74 -19.403 4.989 0.945
527 HB3 PHE 74 2HB PHE 74 -20.615 6.167 1.438
528 HD1 PHE 74 HD1 PHE 74 -19.974 7.885 3.181
529 HD2 PHE 74 HD2 PHE 74 -17.124 5.433 1.190
530 HE1 PHE 74 HE1 PHE 74 -18.189 9.460 3.804
531 HE2 PHE 74 HE2 PHE 74 -15.335 7.005 1.808
532 HZ PHE 74 HZ PHE 74 -15.867 9.019 3.118
533 H GLN 75 H GLN 75 -20.869 2.381 3.772
534 HA GLN 75 HA GLN 75 -23.336 2.315 2.167
535 HB2 GLN 75 1HB GLN 75 -23.108 -0.205 2.257
536 HB3 GLN 75 2HB GLN 75 -21.941 0.636 1.252
537 HG2 GLN 75 1HG GLN 75 -20.693 -0.979 2.357
538 HG3 GLN 75 2HG GLN 75 -20.371 0.499 3.255
539 HE21 GLN 75 1HE2 GLN 75 -19.767 -0.608 5.093
540 HE22 GLN 75 2HE2 GLN 75 -20.908 -1.436 6.100
541 H GLY 76 H GLY 76 -22.141 2.611 5.204
542 HA2 GLY 76 1HA GLY 76 -24.680 1.685 6.358
543 HA3 GLY 76 2HA GLY 76 -23.164 1.192 7.096
544 H HIS 77 H HIS 77 -23.426 2.190 9.018
545 HA HIS 77 HA HIS 77 -23.188 3.817 10.569
546 HB2 HIS 77 1HB HIS 77 -22.614 5.586 8.191
547 HB3 HIS 77 2HB HIS 77 -22.554 6.150 9.856
548 HD1 HIS 77 HD1 HIS 77 -20.723 4.875 11.403
549 HD2 HIS 77 HD2 HIS 77 -20.292 4.500 7.283
550 HE1 HIS 77 HE1 HIS 77 -18.363 4.089 11.037
551 HE2 HIS 77 HE2 HIS 77 -18.112 3.895 8.539
552 H HIS 78 H HIS 78 -24.939 5.220 7.799
553 HA HIS 78 HA HIS 78 -27.014 6.095 9.700
554 HB2 HIS 78 1HB HIS 78 -25.644 7.976 8.832
555 HB3 HIS 78 2HB HIS 78 -26.099 7.527 7.194
556 HD1 HIS 78 HD1 HIS 78 -28.179 8.565 6.293
557 HD2 HIS 78 HD2 HIS 78 -27.911 8.890 10.427
558 HE1 HIS 78 HE1 HIS 78 -30.088 10.049 6.980
559 HE2 HIS 78 HE2 HIS 78 -29.754 10.415 9.449
560 H HIS 79 H HIS 79 -28.596 4.653 9.399
561 HA HIS 79 HA HIS 79 -30.338 3.562 8.464
562 HB2 HIS 79 1HB HIS 79 -30.024 5.895 6.646
563 HB3 HIS 79 2HB HIS 79 -31.080 4.585 6.131
564 HD1 HIS 79 HD1 HIS 79 -33.289 4.267 7.400
565 HD2 HIS 79 HD2 HIS 79 -30.952 7.385 8.847
566 HE1 HIS 79 HE1 HIS 79 -34.786 5.578 8.931
567 HE2 HIS 79 HE2 HIS 79 -33.305 7.353 9.923
568 H HIS 80 H HIS 80 -28.759 1.774 8.223
569 HA HIS 80 HA HIS 80 -28.149 1.091 5.458
570 HB2 HIS 80 1HB HIS 80 -26.599 0.456 7.321
571 HB3 HIS 80 2HB HIS 80 -27.854 -0.595 7.964
572 HD1 HIS 80 HD1 HIS 80 -25.561 -0.259 4.969
573 HD2 HIS 80 HD2 HIS 80 -27.977 -3.092 6.828
574 HE1 HIS 80 HE1 HIS 80 -25.050 -2.441 3.833
575 HE2 HIS 80 HE2 HIS 80 -26.432 -4.157 5.052
576 H HIS 81 H HIS 81 -30.603 1.548 5.299
577 HA HIS 81 HA HIS 81 -32.048 -0.830 4.837
578 HB2 HIS 81 1HB HIS 81 -32.216 -0.963 7.267
579 HB3 HIS 81 2HB HIS 81 -32.750 0.708 7.354
580 HD1 HIS 81 HD1 HIS 81 -35.213 1.103 7.306
581 HD2 HIS 81 HD2 HIS 81 -34.203 -2.731 6.050
582 HE1 HIS 81 HE1 HIS 81 -37.392 -0.127 7.065
583 HE2 HIS 81 HE2 HIS 81 -36.748 -2.481 6.444
584 H HIS 82 H HIS 82 -33.678 -0.341 3.428
585 HA HIS 82 HA HIS 82 -34.202 2.467 2.886
586 HB2 HIS 82 1HB HIS 82 -35.012 -0.082 1.489
587 HB3 HIS 82 2HB HIS 82 -35.681 1.481 1.040
588 HD1 HIS 82 HD1 HIS 82 -33.014 -0.753 0.200
589 HD2 HIS 82 HD2 HIS 82 -33.478 3.378 0.308
590 HE1 HIS 82 HE1 HIS 82 -31.183 0.172 -1.253
591 HE2 HIS 82 HE2 HIS 82 -31.416 2.676 -1.088
Start of MODEL 2
1 H2 MET 1 2H MET 1 6.010 -11.426 -7.449
2 H MET 1 1H MET 1 6.379 -10.094 -8.425
3 H3 MET 1 3H MET 1 6.809 -10.093 -6.789
4 HA MET 1 HA MET 1 4.894 -8.705 -7.143
5 HB2 MET 1 1HB MET 1 4.041 -9.897 -9.133
6 HB3 MET 1 2HB MET 1 3.595 -11.261 -8.117
7 HG2 MET 1 1HG MET 1 2.026 -9.827 -6.896
8 HG3 MET 1 2HG MET 1 2.456 -8.478 -7.947
9 HE1 MET 1 1HE MET 1 1.158 -9.719 -11.425
10 HE2 MET 1 2HE MET 1 2.771 -9.970 -10.763
11 HE3 MET 1 3HE MET 1 1.961 -8.419 -10.547
12 H ALA 2 H ALA 2 4.655 -8.362 -5.043
13 HA ALA 2 HA ALA 2 3.641 -10.575 -3.386
14 HB1 ALA 2 1HB ALA 2 5.635 -8.465 -2.559
15 HB2 ALA 2 2HB ALA 2 5.992 -10.168 -2.854
16 HB3 ALA 2 3HB ALA 2 4.948 -9.705 -1.509
17 H GLN 3 H GLN 3 1.994 -10.085 -2.030
18 HA GLN 3 HA GLN 3 1.023 -7.314 -2.102
19 HB2 GLN 3 1HB GLN 3 -0.489 -9.869 -1.535
20 HB3 GLN 3 2HB GLN 3 -1.184 -8.253 -1.509
21 HG2 GLN 3 1HG GLN 3 -0.691 -7.988 -3.869
22 HG3 GLN 3 2HG GLN 3 0.045 -9.587 -3.907
23 HE21 GLN 3 1HE2 GLN 3 -2.894 -7.793 -3.809
24 HE22 GLN 3 2HE2 GLN 3 -3.959 -9.116 -4.100
25 H GLY 4 H GLY 4 -0.229 -6.760 -0.025
26 HA2 GLY 4 1HA GLY 4 0.244 -8.104 2.369
27 HA3 GLY 4 2HA GLY 4 1.569 -6.976 2.134
28 H THR 5 H THR 5 0.805 -6.025 4.087
29 HA THR 5 HA THR 5 -1.357 -4.095 3.575
30 HB THR 5 HB THR 5 -0.776 -5.320 6.275
31 HG1 THR 5 HG1 THR 5 -3.073 -6.205 5.568
32 HG21 THR 5 1HG2 THR 5 -1.847 -3.104 6.267
33 HG22 THR 5 2HG2 THR 5 -2.926 -4.355 6.888
34 HG23 THR 5 3HG2 THR 5 -3.136 -3.745 5.245
35 H VAL 6 H VAL 6 -0.514 -2.104 3.592
36 HA VAL 6 HA VAL 6 2.050 -1.507 4.579
37 HB VAL 6 HB VAL 6 1.356 -0.013 2.949
38 HG11 VAL 6 1HG1 VAL 6 -1.208 0.331 4.475
39 HG12 VAL 6 2HG1 VAL 6 -0.990 -0.510 2.940
40 HG13 VAL 6 3HG1 VAL 6 -0.765 1.235 3.030
41 HG21 VAL 6 1HG2 VAL 6 1.254 2.191 3.994
42 HG22 VAL 6 2HG2 VAL 6 2.439 1.161 4.801
43 HG23 VAL 6 3HG2 VAL 6 0.861 1.444 5.543
44 H LYS 7 H LYS 7 2.658 -1.556 6.591
45 HA LYS 7 HA LYS 7 0.753 -1.631 8.710
46 HB2 LYS 7 1HB LYS 7 2.712 -1.921 10.174
47 HB3 LYS 7 2HB LYS 7 2.696 -3.046 8.828
48 HG2 LYS 7 1HG LYS 7 4.428 -1.894 7.720
49 HG3 LYS 7 2HG LYS 7 4.286 -0.505 8.799
50 HD2 LYS 7 1HD LYS 7 6.233 -1.864 9.367
51 HD3 LYS 7 2HD LYS 7 5.047 -1.874 10.672
52 HE2 LYS 7 1HE LYS 7 4.192 -4.044 9.718
53 HE3 LYS 7 2HE LYS 7 5.603 -4.045 8.662
54 HZ1 LYS 7 1HZ LYS 7 7.005 -3.981 10.654
55 HZ2 LYS 7 2HZ LYS 7 6.030 -5.359 10.614
56 HZ3 LYS 7 3HZ LYS 7 5.627 -4.067 11.631
57 H TRP 8 H TRP 8 2.932 0.723 7.386
58 HA TRP 8 HA TRP 8 1.353 2.820 8.415
59 HB2 TRP 8 1HB TRP 8 2.904 3.942 9.868
60 HB3 TRP 8 2HB TRP 8 2.685 2.307 10.467
61 HD1 TRP 8 HD1 TRP 8 4.787 0.671 10.358
62 HE1 TRP 8 HE1 TRP 8 7.306 1.127 10.096
63 HE3 TRP 8 HE3 TRP 8 4.562 5.490 8.686
64 HZ2 TRP 8 HZ2 TRP 8 8.974 3.261 9.291
65 HZ3 TRP 8 HZ3 TRP 8 6.660 6.668 8.196
66 HH2 TRP 8 HH2 TRP 8 8.817 5.574 8.493
67 H PHE 9 H PHE 9 1.917 4.834 7.541
68 HA PHE 9 HA PHE 9 4.199 5.014 5.771
69 HB2 PHE 9 1HB PHE 9 2.377 3.937 4.415
70 HB3 PHE 9 2HB PHE 9 1.398 5.373 4.680
71 HD1 PHE 9 HD1 PHE 9 4.197 3.934 2.885
72 HD2 PHE 9 HD2 PHE 9 2.000 7.498 3.627
73 HE1 PHE 9 HE1 PHE 9 5.233 4.977 0.916
74 HE2 PHE 9 HE2 PHE 9 3.029 8.549 1.658
75 HZ PHE 9 HZ PHE 9 4.650 7.290 0.299
76 H ASN 10 H ASN 10 5.021 6.992 6.048
77 HA ASN 10 HA ASN 10 3.193 9.061 7.032
78 HB2 ASN 10 1HB ASN 10 5.124 10.222 7.952
79 HB3 ASN 10 2HB ASN 10 5.049 8.575 8.552
80 HD21 ASN 10 1HD2 ASN 10 7.269 10.379 8.494
81 HD22 ASN 10 2HD2 ASN 10 8.508 9.615 7.564
82 H ALA 11 H ALA 11 2.378 10.124 5.422
83 HA ALA 11 HA ALA 11 3.538 10.365 2.867
84 HB1 ALA 11 1HB ALA 11 1.129 10.457 3.251
85 HB2 ALA 11 2HB ALA 11 1.693 11.888 2.386
86 HB3 ALA 11 3HB ALA 11 1.321 11.987 4.107
87 H GLU 12 H GLU 12 3.853 12.215 5.738
88 HA GLU 12 HA GLU 12 4.630 14.707 4.816
89 HB2 GLU 12 1HB GLU 12 4.287 14.250 7.169
90 HB3 GLU 12 2HB GLU 12 5.623 13.107 7.176
91 HG2 GLU 12 1HG GLU 12 7.201 14.882 6.801
92 HG3 GLU 12 2HG GLU 12 5.893 16.053 6.646
93 H LYS 13 H LYS 13 6.513 11.757 5.208
94 HA LYS 13 HA LYS 13 8.830 13.074 3.995
95 HB2 LYS 13 1HB LYS 13 8.614 10.447 5.456
96 HB3 LYS 13 2HB LYS 13 10.102 11.140 4.827
97 HG2 LYS 13 1HG LYS 13 8.359 12.381 6.937
98 HG3 LYS 13 2HG LYS 13 9.850 11.492 7.235
99 HD2 LYS 13 1HD LYS 13 11.076 13.140 5.888
100 HD3 LYS 13 2HD LYS 13 9.579 14.037 5.651
101 HE2 LYS 13 1HE LYS 13 9.408 14.422 8.045
102 HE3 LYS 13 2HE LYS 13 10.874 13.479 8.313
103 HZ1 LYS 13 1HZ LYS 13 11.328 15.853 8.326
104 HZ2 LYS 13 2HZ LYS 13 10.713 16.007 6.760
105 HZ3 LYS 13 3HZ LYS 13 12.118 15.105 7.033
106 H GLY 14 H GLY 14 6.462 10.602 3.518
107 HA2 GLY 14 1HA GLY 14 5.750 9.913 1.392
108 HA3 GLY 14 2HA GLY 14 7.274 10.469 0.723
109 H PHE 15 H PHE 15 7.160 8.387 3.538
110 HA PHE 15 HA PHE 15 7.616 6.053 1.860
111 HB2 PHE 15 1HB PHE 15 9.661 5.401 2.903
112 HB3 PHE 15 2HB PHE 15 9.858 7.061 2.371
113 HD1 PHE 15 HD1 PHE 15 9.762 4.803 5.200
114 HD2 PHE 15 HD2 PHE 15 9.925 8.889 4.029
115 HE1 PHE 15 HE1 PHE 15 10.529 5.412 7.453
116 HE2 PHE 15 HE2 PHE 15 10.683 9.506 6.286
117 HZ PHE 15 HZ PHE 15 10.987 7.766 8.000
118 H GLY 16 H GLY 16 8.025 4.098 3.510
119 HA2 GLY 16 1HA GLY 16 6.870 4.122 6.043
120 HA3 GLY 16 2HA GLY 16 5.583 3.788 4.890
121 H PHE 17 H PHE 17 5.501 1.726 6.104
122 HA PHE 17 HA PHE 17 7.262 -0.199 4.771
123 HB2 PHE 17 1HB PHE 17 6.823 0.021 7.734
124 HB3 PHE 17 2HB PHE 17 7.211 -1.528 6.991
125 HD1 PHE 17 HD1 PHE 17 9.381 -1.935 6.019
126 HD2 PHE 17 HD2 PHE 17 8.458 1.797 7.834
127 HE1 PHE 17 HE1 PHE 17 11.773 -1.368 6.059
128 HE2 PHE 17 HE2 PHE 17 10.848 2.372 7.883
129 HZ PHE 17 HZ PHE 17 12.511 0.788 6.993
130 H ILE 18 H ILE 18 6.374 -2.127 4.306
131 HA ILE 18 HA ILE 18 3.508 -2.434 4.883
132 HB ILE 18 HB ILE 18 5.121 -3.445 2.539
133 HG12 ILE 18 1HG1 ILE 18 2.741 -1.604 2.510
134 HG13 ILE 18 2HG1 ILE 18 4.396 -1.016 2.595
135 HG21 ILE 18 1HG2 ILE 18 3.005 -4.332 1.663
136 HG22 ILE 18 2HG2 ILE 18 2.216 -3.906 3.185
137 HG23 ILE 18 3HG2 ILE 18 3.495 -5.122 3.163
138 HD11 ILE 18 1HD1 ILE 18 3.527 -0.968 0.320
139 HD12 ILE 18 2HD1 ILE 18 3.250 -2.710 0.388
140 HD13 ILE 18 3HD1 ILE 18 4.894 -2.073 0.467
141 H ALA 19 H ALA 19 2.770 -4.342 5.684
142 HA ALA 19 HA ALA 19 4.763 -6.375 6.393
143 HB1 ALA 19 1HB ALA 19 1.883 -6.080 7.260
144 HB2 ALA 19 2HB ALA 19 3.296 -5.596 8.199
145 HB3 ALA 19 3HB ALA 19 3.017 -7.301 7.840
146 HA PRO 20 HA PRO 20 3.203 -7.916 2.388
147 HB2 PRO 20 1HB PRO 20 5.465 -9.770 2.894
148 HB3 PRO 20 2HB PRO 20 5.068 -8.844 1.443
149 HG2 PRO 20 1HG PRO 20 7.064 -8.078 3.001
150 HG3 PRO 20 2HG PRO 20 5.962 -6.878 2.300
151 HD2 PRO 20 1HD PRO 20 6.039 -7.986 5.075
152 HD3 PRO 20 2HD PRO 20 5.774 -6.316 4.538
153 H ASP 21 H ASP 21 2.089 -9.673 1.759
154 HA ASP 21 HA ASP 21 1.274 -11.675 3.636
155 HB2 ASP 21 1HB ASP 21 -0.280 -11.012 1.920
156 HB3 ASP 21 2HB ASP 21 0.894 -11.342 0.652
157 H ASP 22 H ASP 22 3.933 -11.135 1.746
158 HA ASP 22 HA ASP 22 4.677 -13.826 1.114
159 HB2 ASP 22 1HB ASP 22 5.308 -11.741 -0.191
160 HB3 ASP 22 2HB ASP 22 6.448 -11.383 1.100
161 H GLY 23 H GLY 23 4.177 -13.084 3.958
162 HA2 GLY 23 1HA GLY 23 5.120 -14.307 5.783
163 HA3 GLY 23 2HA GLY 23 6.694 -14.155 5.026
164 H SER 24 H SER 24 4.729 -11.384 5.070
165 HA SER 24 HA SER 24 4.864 -9.373 6.064
166 HB2 SER 24 1HB SER 24 4.775 -9.470 8.593
167 HB3 SER 24 2HB SER 24 3.535 -10.370 7.723
168 HG SER 24 HG SER 24 5.844 -11.779 8.330
169 H ALA 25 H ALA 25 7.425 -10.266 5.146
170 HA ALA 25 HA ALA 25 9.330 -9.227 7.037
171 HB1 ALA 25 1HB ALA 25 10.925 -9.370 5.186
172 HB2 ALA 25 2HB ALA 25 9.608 -9.739 4.074
173 HB3 ALA 25 3HB ALA 25 10.023 -10.875 5.358
174 H ASP 26 H ASP 26 8.952 -7.173 7.597
175 HA ASP 26 HA ASP 26 7.453 -5.337 6.224
176 HB2 ASP 26 1HB ASP 26 8.397 -3.612 7.710
177 HB3 ASP 26 2HB ASP 26 7.914 -5.066 8.575
178 H VAL 27 H VAL 27 7.698 -4.522 4.374
179 HA VAL 27 HA VAL 27 10.364 -4.115 3.253
180 HB VAL 27 HB VAL 27 8.844 -5.539 1.979
181 HG11 VAL 27 1HG1 VAL 27 6.849 -4.587 0.900
182 HG12 VAL 27 2HG1 VAL 27 7.068 -3.117 1.853
183 HG13 VAL 27 3HG1 VAL 27 6.720 -4.650 2.659
184 HG21 VAL 27 1HG2 VAL 27 10.475 -4.256 0.745
185 HG22 VAL 27 2HG2 VAL 27 9.358 -2.895 0.643
186 HG23 VAL 27 3HG2 VAL 27 8.984 -4.408 -0.185
187 H PHE 28 H PHE 28 11.047 -2.181 2.481
188 HA PHE 28 HA PHE 28 9.863 0.148 3.678
189 HB2 PHE 28 1HB PHE 28 12.296 -0.191 3.610
190 HB3 PHE 28 2HB PHE 28 12.254 -0.171 1.853
191 HD1 PHE 28 HD1 PHE 28 12.178 1.873 0.642
192 HD2 PHE 28 HD2 PHE 28 11.870 1.870 4.886
193 HE1 PHE 28 HE1 PHE 28 12.537 4.307 0.666
194 HE2 PHE 28 HE2 PHE 28 12.225 4.304 4.917
195 HZ PHE 28 HZ PHE 28 12.558 5.523 2.807
196 H VAL 29 H VAL 29 8.432 1.452 2.756
197 HA VAL 29 HA VAL 29 7.968 1.202 -0.133
198 HB VAL 29 HB VAL 29 6.219 2.826 1.668
199 HG11 VAL 29 1HG1 VAL 29 4.492 2.140 0.089
200 HG12 VAL 29 2HG1 VAL 29 5.666 1.142 -0.767
201 HG13 VAL 29 3HG1 VAL 29 5.853 2.896 -0.742
202 HG21 VAL 29 1HG2 VAL 29 6.063 -0.167 1.389
203 HG22 VAL 29 2HG2 VAL 29 4.874 0.866 2.187
204 HG23 VAL 29 3HG2 VAL 29 6.502 0.721 2.849
205 H HIS 30 H HIS 30 7.960 2.984 -1.474
206 HA HIS 30 HA HIS 30 8.734 5.567 -0.341
207 HB2 HIS 30 1HB HIS 30 10.774 4.331 -1.131
208 HB3 HIS 30 2HB HIS 30 10.079 4.310 -2.747
209 HD1 HIS 30 HD1 HIS 30 11.292 5.937 -4.122
210 HD2 HIS 30 HD2 HIS 30 10.660 7.347 -0.259
211 HE1 HIS 30 HE1 HIS 30 12.266 8.262 -4.073
212 HE2 HIS 30 HE2 HIS 30 12.014 9.027 -1.687
213 H TYR 31 H TYR 31 7.636 7.219 -1.242
214 HA TYR 31 HA TYR 31 5.284 6.635 -2.601
215 HB2 TYR 31 1HB TYR 31 4.828 8.966 -2.606
216 HB3 TYR 31 2HB TYR 31 5.715 8.620 -1.130
217 HD1 TYR 31 HD1 TYR 31 8.130 9.265 -0.976
218 HD2 TYR 31 HD2 TYR 31 5.660 10.483 -4.216
219 HE1 TYR 31 HE1 TYR 31 9.742 11.030 -1.533
220 HE2 TYR 31 HE2 TYR 31 7.268 12.249 -4.787
221 HH TYR 31 HH TYR 31 10.398 12.364 -3.519
222 H SER 32 H SER 32 8.397 7.385 -3.918
223 HA SER 32 HA SER 32 7.510 8.237 -6.475
224 HB2 SER 32 1HB SER 32 10.151 6.952 -5.753
225 HB3 SER 32 2HB SER 32 9.818 7.983 -7.147
226 HG SER 32 HG SER 32 9.755 9.723 -5.882
227 H GLU 33 H GLU 33 7.796 5.167 -4.959
228 HA GLU 33 HA GLU 33 7.665 3.742 -7.510
229 HB2 GLU 33 1HB GLU 33 8.203 2.896 -4.677
230 HB3 GLU 33 2HB GLU 33 7.776 1.719 -5.907
231 HG2 GLU 33 1HG GLU 33 10.192 1.879 -5.566
232 HG3 GLU 33 2HG GLU 33 9.720 2.305 -7.208
233 H ILE 34 H ILE 34 5.619 5.050 -5.225
234 HA ILE 34 HA ILE 34 3.635 2.998 -5.166
235 HB ILE 34 HB ILE 34 3.504 5.895 -4.348
236 HG12 ILE 34 1HG1 ILE 34 3.690 3.322 -2.774
237 HG13 ILE 34 2HG1 ILE 34 4.959 4.525 -2.954
238 HG21 ILE 34 1HG2 ILE 34 1.280 5.164 -4.990
239 HG22 ILE 34 2HG2 ILE 34 1.385 5.334 -3.236
240 HG23 ILE 34 3HG2 ILE 34 1.436 3.731 -3.972
241 HD11 ILE 34 1HD1 ILE 34 3.584 6.146 -1.756
242 HD12 ILE 34 2HD1 ILE 34 3.880 4.697 -0.791
243 HD13 ILE 34 3HD1 ILE 34 2.318 4.933 -1.578
244 H GLN 35 H GLN 35 1.961 2.672 -6.388
245 HA GLN 35 HA GLN 35 1.531 4.448 -8.689
246 HB2 GLN 35 1HB GLN 35 0.821 1.526 -8.378
247 HB3 GLN 35 2HB GLN 35 0.666 2.489 -9.841
248 HG2 GLN 35 1HG GLN 35 3.250 1.838 -8.456
249 HG3 GLN 35 2HG GLN 35 2.620 1.014 -9.881
250 HE21 GLN 35 1HE2 GLN 35 5.085 2.561 -9.452
251 HE22 GLN 35 2HE2 GLN 35 5.077 3.780 -10.674
252 H GLY 36 H GLY 36 0.117 5.827 -7.568
253 HA2 GLY 36 1HA GLY 36 -2.256 4.594 -6.355
254 HA3 GLY 36 2HA GLY 36 -1.682 6.227 -6.053
255 H ASN 37 H ASN 37 -3.942 6.759 -6.424
256 HA ASN 37 HA ASN 37 -4.509 7.060 -9.301
257 HB2 ASN 37 1HB ASN 37 -6.479 6.713 -7.027
258 HB3 ASN 37 2HB ASN 37 -6.927 7.109 -8.680
259 HD21 ASN 37 1HD2 ASN 37 -6.803 5.539 -10.264
260 HD22 ASN 37 2HD2 ASN 37 -6.595 3.862 -9.895
261 H GLY 38 H GLY 38 -2.906 8.850 -8.021
262 HA2 GLY 38 1HA GLY 38 -3.211 11.291 -8.457
263 HA3 GLY 38 2HA GLY 38 -4.682 11.157 -7.502
264 H PHE 39 H PHE 39 -3.489 9.327 -5.585
265 HA PHE 39 HA PHE 39 -1.624 11.158 -4.230
266 HB2 PHE 39 1HB PHE 39 -3.666 9.269 -3.043
267 HB3 PHE 39 2HB PHE 39 -2.442 10.111 -2.102
268 HD1 PHE 39 HD1 PHE 39 -5.674 10.322 -3.651
269 HD2 PHE 39 HD2 PHE 39 -2.481 12.610 -2.022
270 HE1 PHE 39 HE1 PHE 39 -7.182 12.253 -3.425
271 HE2 PHE 39 HE2 PHE 39 -3.978 14.543 -1.792
272 HZ PHE 39 HZ PHE 39 -6.334 14.369 -2.493
273 H ARG 40 H ARG 40 0.375 10.388 -4.242
274 HA ARG 40 HA ARG 40 0.900 7.547 -4.429
275 HB2 ARG 40 1HB ARG 40 2.736 9.929 -4.191
276 HB3 ARG 40 2HB ARG 40 3.296 8.268 -4.325
277 HG2 ARG 40 1HG ARG 40 2.206 8.085 -6.507
278 HG3 ARG 40 2HG ARG 40 1.674 9.765 -6.372
279 HD2 ARG 40 1HD ARG 40 3.945 10.537 -6.349
280 HD3 ARG 40 2HD ARG 40 4.553 8.885 -6.277
281 HE ARG 40 HE ARG 40 3.191 10.074 -8.611
282 HH11 ARG 40 1HH1 ARG 40 5.388 7.751 -7.199
283 HH12 ARG 40 2HH1 ARG 40 6.042 7.242 -8.725
284 HH21 ARG 40 1HH2 ARG 40 4.017 9.378 -10.625
285 HH22 ARG 40 2HH2 ARG 40 5.256 8.163 -10.673
286 H THR 41 H THR 41 -0.529 7.904 -2.246
287 HA THR 41 HA THR 41 1.389 7.676 -0.038
288 HB THR 41 HB THR 41 -0.356 8.716 1.432
289 HG1 THR 41 HG1 THR 41 -2.222 9.266 0.589
290 HG21 THR 41 1HG2 THR 41 0.672 10.433 -0.830
291 HG22 THR 41 2HG2 THR 41 1.545 10.027 0.647
292 HG23 THR 41 3HG2 THR 41 0.096 11.028 0.727
293 H LEU 42 H LEU 42 0.757 6.270 1.642
294 HA LEU 42 HA LEU 42 -1.383 4.404 0.896
295 HB2 LEU 42 1HB LEU 42 1.252 3.887 2.259
296 HB3 LEU 42 2HB LEU 42 -0.049 2.716 2.203
297 HG LEU 42 HG LEU 42 1.417 3.832 -0.178
298 HD11 LEU 42 1HD1 LEU 42 2.731 2.272 1.200
299 HD12 LEU 42 2HD1 LEU 42 2.363 1.631 -0.400
300 HD13 LEU 42 3HD1 LEU 42 1.459 1.065 1.004
301 HD21 LEU 42 1HD2 LEU 42 -0.795 1.794 0.019
302 HD22 LEU 42 2HD2 LEU 42 0.171 2.087 -1.428
303 HD23 LEU 42 3HD2 LEU 42 -0.861 3.363 -0.786
304 H GLU 43 H GLU 43 -2.692 3.612 2.522
305 HA GLU 43 HA GLU 43 -2.805 5.287 4.908
306 HB2 GLU 43 1HB GLU 43 -4.760 3.384 3.626
307 HB3 GLU 43 2HB GLU 43 -5.041 4.125 5.194
308 HG2 GLU 43 1HG GLU 43 -4.605 5.630 2.628
309 HG3 GLU 43 2HG GLU 43 -6.176 5.296 3.356
310 H GLU 44 H GLU 44 -2.628 4.479 6.952
311 HA GLU 44 HA GLU 44 -1.088 2.160 7.313
312 HB2 GLU 44 1HB GLU 44 -1.129 4.148 8.815
313 HB3 GLU 44 2HB GLU 44 -2.716 3.647 9.368
314 HG2 GLU 44 1HG GLU 44 -1.796 1.609 10.258
315 HG3 GLU 44 2HG GLU 44 -0.204 2.028 9.638
316 H ASN 45 H ASN 45 -1.623 0.126 7.547
317 HA ASN 45 HA ASN 45 -2.776 -1.794 7.845
318 HB2 ASN 45 1HB ASN 45 -4.819 0.030 9.097
319 HB3 ASN 45 2HB ASN 45 -5.073 -1.701 8.939
320 HD21 ASN 45 1HD2 ASN 45 -3.369 0.802 10.564
321 HD22 ASN 45 2HD2 ASN 45 -2.616 -0.186 11.764
322 H GLN 46 H GLN 46 -2.825 -0.248 5.448
323 HA GLN 46 HA GLN 46 -5.403 -1.039 4.278
324 HB2 GLN 46 1HB GLN 46 -4.678 1.313 3.986
325 HB3 GLN 46 2HB GLN 46 -3.235 0.745 3.166
326 HG2 GLN 46 1HG GLN 46 -4.620 -0.241 1.417
327 HG3 GLN 46 2HG GLN 46 -6.061 0.351 2.234
328 HE21 GLN 46 1HE2 GLN 46 -3.260 1.207 0.403
329 HE22 GLN 46 2HE2 GLN 46 -3.767 2.807 -0.014
330 H LYS 47 H LYS 47 -5.482 -2.545 2.663
331 HA LYS 47 HA LYS 47 -3.257 -4.255 2.261
332 HB2 LYS 47 1HB LYS 47 -6.015 -4.074 1.145
333 HB3 LYS 47 2HB LYS 47 -4.828 -5.059 0.299
334 HG2 LYS 47 1HG LYS 47 -5.417 -5.370 3.224
335 HG3 LYS 47 2HG LYS 47 -6.264 -6.270 1.964
336 HD2 LYS 47 1HD LYS 47 -4.249 -7.312 1.243
337 HD3 LYS 47 2HD LYS 47 -3.265 -6.243 2.244
338 HE2 LYS 47 1HE LYS 47 -3.402 -8.404 3.280
339 HE3 LYS 47 2HE LYS 47 -4.289 -7.233 4.250
340 HZ1 LYS 47 1HZ LYS 47 -5.531 -9.264 4.076
341 HZ2 LYS 47 2HZ LYS 47 -5.463 -9.225 2.390
342 HZ3 LYS 47 3HZ LYS 47 -6.350 -8.054 3.225
343 H VAL 48 H VAL 48 -2.038 -4.607 0.405
344 HA VAL 48 HA VAL 48 -2.080 -2.626 -1.706
345 HB VAL 48 HB VAL 48 -0.945 -1.487 0.160
346 HG11 VAL 48 1HG1 VAL 48 1.079 -3.700 -0.066
347 HG12 VAL 48 2HG1 VAL 48 -0.042 -3.447 1.274
348 HG13 VAL 48 3HG1 VAL 48 1.223 -2.260 0.946
349 HG21 VAL 48 1HG2 VAL 48 1.065 -0.809 -1.050
350 HG22 VAL 48 2HG2 VAL 48 -0.343 -0.903 -2.109
351 HG23 VAL 48 3HG2 VAL 48 0.869 -2.185 -2.135
352 H GLU 49 H GLU 49 -0.713 -3.154 -3.451
353 HA GLU 49 HA GLU 49 0.574 -5.799 -3.339
354 HB2 GLU 49 1HB GLU 49 -1.481 -5.915 -4.646
355 HB3 GLU 49 2HB GLU 49 -0.962 -4.548 -5.618
356 HG2 GLU 49 1HG GLU 49 0.919 -5.863 -6.454
357 HG3 GLU 49 2HG GLU 49 0.370 -7.242 -5.499
358 H PHE 50 H PHE 50 2.617 -5.921 -4.200
359 HA PHE 50 HA PHE 50 3.758 -3.639 -5.578
360 HB2 PHE 50 1HB PHE 50 5.513 -3.369 -3.761
361 HB3 PHE 50 2HB PHE 50 3.902 -2.794 -3.351
362 HD1 PHE 50 HD1 PHE 50 2.447 -4.163 -1.869
363 HD2 PHE 50 HD2 PHE 50 6.547 -5.110 -2.519
364 HE1 PHE 50 HE1 PHE 50 2.423 -5.597 0.122
365 HE2 PHE 50 HE2 PHE 50 6.526 -6.546 -0.523
366 HZ PHE 50 HZ PHE 50 4.465 -6.793 0.797
367 H GLU 51 H GLU 51 6.214 -3.975 -5.766
368 HA GLU 51 HA GLU 51 6.868 -6.845 -5.905
369 HB2 GLU 51 1HB GLU 51 6.700 -5.886 -8.156
370 HB3 GLU 51 2HB GLU 51 7.832 -4.615 -7.710
371 HG2 GLU 51 1HG GLU 51 9.603 -6.217 -7.445
372 HG3 GLU 51 2HG GLU 51 8.487 -7.549 -7.734
373 H ILE 52 H ILE 52 8.459 -7.420 -4.563
374 HA ILE 52 HA ILE 52 9.752 -5.368 -3.024
375 HB ILE 52 HB ILE 52 10.099 -8.362 -2.899
376 HG12 ILE 52 1HG1 ILE 52 8.501 -6.473 -1.167
377 HG13 ILE 52 2HG1 ILE 52 7.823 -7.568 -2.363
378 HG21 ILE 52 1HG2 ILE 52 12.044 -7.193 -2.014
379 HG22 ILE 52 2HG2 ILE 52 11.120 -7.937 -0.707
380 HG23 ILE 52 3HG2 ILE 52 10.998 -6.201 -0.997
381 HD11 ILE 52 1HD1 ILE 52 9.315 -8.364 0.125
382 HD12 ILE 52 2HD1 ILE 52 8.649 -9.472 -1.077
383 HD13 ILE 52 3HD1 ILE 52 7.571 -8.452 -0.125
384 H GLY 53 H GLY 53 11.530 -4.403 -3.548
385 HA2 GLY 53 1HA GLY 53 13.590 -5.898 -5.050
386 HA3 GLY 53 2HA GLY 53 13.287 -4.182 -5.294
387 H GLU 54 H GLU 54 15.450 -3.696 -4.751
388 HA GLU 54 HA GLU 54 16.067 -4.045 -1.896
389 HB2 GLU 54 1HB GLU 54 17.576 -5.329 -3.334
390 HB3 GLU 54 2HB GLU 54 17.970 -3.873 -4.234
391 HG2 GLU 54 1HG GLU 54 18.924 -2.902 -2.177
392 HG3 GLU 54 2HG GLU 54 18.606 -4.425 -1.346
393 H GLY 55 H GLY 55 16.319 -2.254 -0.743
394 HA2 GLY 55 1HA GLY 55 16.651 0.289 -2.202
395 HA3 GLY 55 2HA GLY 55 15.794 0.126 -0.675
396 H ALA 56 H ALA 56 17.224 1.845 0.039
397 HA ALA 56 HA ALA 56 20.038 1.402 0.207
398 HB1 ALA 56 1HB ALA 56 18.359 3.397 1.715
399 HB2 ALA 56 2HB ALA 56 19.020 3.648 0.102
400 HB3 ALA 56 3HB ALA 56 20.105 3.451 1.477
401 H LYS 57 H LYS 57 17.314 0.946 2.380
402 HA LYS 57 HA LYS 57 19.138 -0.328 4.299
403 HB2 LYS 57 1HB LYS 57 16.886 1.581 4.917
404 HB3 LYS 57 2HB LYS 57 17.660 0.567 6.125
405 HG2 LYS 57 1HG LYS 57 19.809 1.650 5.627
406 HG3 LYS 57 2HG LYS 57 18.991 2.696 4.467
407 HD2 LYS 57 1HD LYS 57 17.630 3.644 6.226
408 HD3 LYS 57 2HD LYS 57 18.330 2.531 7.403
409 HE2 LYS 57 1HE LYS 57 20.535 3.531 7.032
410 HE3 LYS 57 2HE LYS 57 19.831 4.646 5.864
411 HZ1 LYS 57 1HZ LYS 57 18.517 5.630 7.597
412 HZ2 LYS 57 2HZ LYS 57 20.140 5.633 8.075
413 HZ3 LYS 57 3HZ LYS 57 19.069 4.502 8.730
414 H GLY 58 H GLY 58 18.017 -1.920 2.543
415 HA2 GLY 58 1HA GLY 58 17.104 -4.093 3.317
416 HA3 GLY 58 2HA GLY 58 15.791 -3.168 4.030
417 HA PRO 59 HA PRO 59 14.487 -4.574 -0.224
418 HB2 PRO 59 1HB PRO 59 12.098 -5.583 0.591
419 HB3 PRO 59 2HB PRO 59 13.579 -6.539 0.539
420 HG2 PRO 59 1HG PRO 59 12.279 -5.187 2.864
421 HG3 PRO 59 2HG PRO 59 13.000 -6.802 2.772
422 HD2 PRO 59 1HD PRO 59 14.300 -4.707 3.864
423 HD3 PRO 59 2HD PRO 59 15.150 -5.989 2.979
424 H GLN 60 H GLN 60 13.044 -3.484 -1.514
425 HA GLN 60 HA GLN 60 11.468 -1.378 -0.183
426 HB2 GLN 60 1HB GLN 60 11.888 0.071 -2.114
427 HB3 GLN 60 2HB GLN 60 13.389 -0.399 -1.327
428 HG2 GLN 60 1HG GLN 60 13.888 -1.968 -3.047
429 HG3 GLN 60 2HG GLN 60 12.293 -1.766 -3.768
430 HE21 GLN 60 1HE2 GLN 60 14.073 0.936 -2.537
431 HE22 GLN 60 2HE2 GLN 60 14.460 1.639 -4.064
432 H ALA 61 H ALA 61 9.456 -0.939 -0.960
433 HA ALA 61 HA ALA 61 8.251 -2.970 -2.644
434 HB1 ALA 61 1HB ALA 61 7.019 -0.569 -1.288
435 HB2 ALA 61 2HB ALA 61 7.066 -2.211 -0.643
436 HB3 ALA 61 3HB ALA 61 6.138 -1.862 -2.102
437 H GLN 62 H GLN 62 8.303 -2.783 -4.763
438 HA GLN 62 HA GLN 62 8.413 -0.103 -5.972
439 HB2 GLN 62 1HB GLN 62 9.041 -2.768 -7.243
440 HB3 GLN 62 2HB GLN 62 9.335 -1.178 -7.933
441 HG2 GLN 62 1HG GLN 62 11.003 -0.716 -6.260
442 HG3 GLN 62 2HG GLN 62 10.657 -2.245 -5.453
443 HE21 GLN 62 1HE2 GLN 62 11.252 -4.175 -6.457
444 HE22 GLN 62 2HE2 GLN 62 12.463 -4.223 -7.690
445 H GLN 63 H GLN 63 7.027 0.394 -7.702
446 HA GLN 63 HA GLN 63 5.012 0.497 -8.742
447 HB2 GLN 63 1HB GLN 63 5.544 -2.467 -8.917
448 HB3 GLN 63 2HB GLN 63 4.196 -1.688 -9.724
449 HG2 GLN 63 1HG GLN 63 5.849 -1.923 -11.357
450 HG3 GLN 63 2HG GLN 63 5.901 -0.229 -10.881
451 HE21 GLN 63 1HE2 GLN 63 7.727 0.583 -9.935
452 HE22 GLN 63 2HE2 GLN 63 9.186 -0.323 -9.764
453 H VAL 64 H VAL 64 4.600 0.862 -6.235
454 HA VAL 64 HA VAL 64 3.138 -1.224 -4.904
455 HB VAL 64 HB VAL 64 3.314 1.615 -3.951
456 HG11 VAL 64 1HG1 VAL 64 1.933 0.157 -2.641
457 HG12 VAL 64 2HG1 VAL 64 3.409 0.524 -1.746
458 HG13 VAL 64 3HG1 VAL 64 3.227 -1.037 -2.543
459 HG21 VAL 64 1HG2 VAL 64 5.462 1.073 -2.889
460 HG22 VAL 64 2HG2 VAL 64 5.560 1.046 -4.650
461 HG23 VAL 64 3HG2 VAL 64 5.478 -0.467 -3.748
462 H HIS 65 H HIS 65 1.179 -1.626 -5.770
463 HA HIS 65 HA HIS 65 -0.650 0.610 -6.295
464 HB2 HIS 65 1HB HIS 65 -0.802 -2.332 -6.951
465 HB3 HIS 65 2HB HIS 65 -2.160 -1.240 -7.162
466 HD1 HIS 65 HD1 HIS 65 -2.165 0.246 -9.220
467 HD2 HIS 65 HD2 HIS 65 1.349 -1.918 -8.752
468 HE1 HIS 65 HE1 HIS 65 -0.915 0.524 -11.378
469 HE2 HIS 65 HE2 HIS 65 1.096 -0.974 -11.148
470 H ALA 66 H ALA 66 -2.076 1.172 -4.810
471 HA ALA 66 HA ALA 66 -2.338 -0.334 -2.387
472 HB1 ALA 66 1HB ALA 66 -2.328 2.095 -2.340
473 HB2 ALA 66 2HB ALA 66 -3.847 1.467 -1.697
474 HB3 ALA 66 3HB ALA 66 -3.786 2.134 -3.330
475 H LEU 67 H LEU 67 -3.909 -1.698 -1.811
476 HA LEU 67 HA LEU 67 -5.753 -2.506 -3.908
477 HB2 LEU 67 1HB LEU 67 -5.052 -3.767 -1.262
478 HB3 LEU 67 2HB LEU 67 -6.143 -4.469 -2.438
479 HG LEU 67 HG LEU 67 -3.206 -3.934 -2.879
480 HD11 LEU 67 1HD1 LEU 67 -3.657 -5.744 -1.278
481 HD12 LEU 67 2HD1 LEU 67 -2.934 -6.329 -2.774
482 HD13 LEU 67 3HD1 LEU 67 -4.662 -6.543 -2.488
483 HD21 LEU 67 1HD2 LEU 67 -5.259 -5.287 -4.621
484 HD22 LEU 67 2HD2 LEU 67 -3.524 -5.247 -4.931
485 HD23 LEU 67 3HD2 LEU 67 -4.455 -3.750 -4.943
486 H GLY 68 H GLY 68 -7.420 -1.076 -3.913
487 HA2 GLY 68 1HA GLY 68 -8.872 -0.624 -1.397
488 HA3 GLY 68 2HA GLY 68 -9.064 0.307 -2.877
489 H GLY 69 H GLY 69 -8.991 -3.184 -2.573
490 HA2 GLY 69 1HA GLY 69 -11.549 -3.975 -2.388
491 HA3 GLY 69 2HA GLY 69 -11.471 -3.391 -4.046
492 H GLU 70 H GLU 70 -11.977 -5.621 -4.596
493 HA GLU 70 HA GLU 70 -11.371 -7.529 -5.641
494 HB2 GLU 70 1HB GLU 70 -8.546 -6.616 -5.099
495 HB3 GLU 70 2HB GLU 70 -8.974 -8.004 -6.090
496 HG2 GLU 70 1HG GLU 70 -9.678 -5.131 -6.624
497 HG3 GLU 70 2HG GLU 70 -8.493 -6.108 -7.491
498 H ASN 71 H ASN 71 -9.238 -7.055 -2.831
499 HA ASN 71 HA ASN 71 -9.231 -9.860 -2.211
500 HB2 ASN 71 1HB ASN 71 -8.228 -7.474 -0.641
501 HB3 ASN 71 2HB ASN 71 -7.950 -9.156 -0.199
502 HD21 ASN 71 1HD2 ASN 71 -6.481 -10.373 -1.361
503 HD22 ASN 71 2HD2 ASN 71 -5.385 -9.673 -2.494
504 H LEU 72 H LEU 72 -11.747 -9.525 -2.310
505 HA LEU 72 HA LEU 72 -12.638 -9.480 0.497
506 HB2 LEU 72 1HB LEU 72 -14.219 -8.638 -1.941
507 HB3 LEU 72 2HB LEU 72 -14.864 -8.760 -0.317
508 HG LEU 72 HG LEU 72 -12.710 -6.833 -1.196
509 HD11 LEU 72 1HD1 LEU 72 -14.408 -5.122 -0.944
510 HD12 LEU 72 2HD1 LEU 72 -15.602 -6.341 -0.501
511 HD13 LEU 72 3HD1 LEU 72 -14.925 -6.322 -2.128
512 HD21 LEU 72 1HD2 LEU 72 -13.045 -5.819 1.008
513 HD22 LEU 72 2HD2 LEU 72 -12.468 -7.480 1.139
514 HD23 LEU 72 3HD2 LEU 72 -14.168 -7.110 1.431
515 H TYR 73 H TYR 73 -11.595 -11.605 -1.242
516 HA TYR 73 HA TYR 73 -13.979 -13.272 -1.607
517 HB2 TYR 73 1HB TYR 73 -12.465 -14.733 -2.988
518 HB3 TYR 73 2HB TYR 73 -12.733 -13.126 -3.644
519 HD1 TYR 73 HD1 TYR 73 -10.271 -15.445 -2.273
520 HD2 TYR 73 HD2 TYR 73 -10.923 -11.463 -3.623
521 HE1 TYR 73 HE1 TYR 73 -7.840 -15.105 -2.432
522 HE2 TYR 73 HE2 TYR 73 -8.496 -11.115 -3.785
523 HH TYR 73 HH TYR 73 -6.242 -13.682 -3.568
524 H PHE 74 H PHE 74 -14.399 -14.784 -0.189
525 HA PHE 74 HA PHE 74 -12.429 -16.489 0.928
526 HB2 PHE 74 1HB PHE 74 -12.791 -15.893 3.327
527 HB3 PHE 74 2HB PHE 74 -11.934 -14.655 2.421
528 HD1 PHE 74 HD1 PHE 74 -13.073 -12.549 1.824
529 HD2 PHE 74 HD2 PHE 74 -14.917 -15.472 4.307
530 HE1 PHE 74 HE1 PHE 74 -14.702 -10.870 2.588
531 HE2 PHE 74 HE2 PHE 74 -16.548 -13.800 5.070
532 HZ PHE 74 HZ PHE 74 -16.443 -11.497 4.210
533 H GLN 75 H GLN 75 -15.675 -15.144 1.302
534 HA GLN 75 HA GLN 75 -16.687 -17.821 1.938
535 HB2 GLN 75 1HB GLN 75 -17.305 -15.953 3.451
536 HB3 GLN 75 2HB GLN 75 -18.076 -15.141 2.097
537 HG2 GLN 75 1HG GLN 75 -19.695 -16.915 1.901
538 HG3 GLN 75 2HG GLN 75 -18.885 -17.831 3.170
539 HE21 GLN 75 1HE2 GLN 75 -19.309 -14.363 3.262
540 HE22 GLN 75 2HE2 GLN 75 -20.436 -14.348 4.575
541 H GLY 76 H GLY 76 -17.340 -18.959 0.254
542 HA2 GLY 76 1HA GLY 76 -18.730 -19.311 -1.650
543 HA3 GLY 76 2HA GLY 76 -18.672 -17.581 -1.969
544 H HIS 77 H HIS 77 -18.087 -19.706 -3.832
545 HA HIS 77 HA HIS 77 -15.179 -19.418 -4.150
546 HB2 HIS 77 1HB HIS 77 -17.057 -21.418 -5.428
547 HB3 HIS 77 2HB HIS 77 -15.315 -21.357 -5.664
548 HD1 HIS 77 HD1 HIS 77 -17.793 -23.037 -3.731
549 HD2 HIS 77 HD2 HIS 77 -13.922 -21.707 -3.015
550 HE1 HIS 77 HE1 HIS 77 -16.994 -24.328 -1.730
551 HE2 HIS 77 HE2 HIS 77 -14.613 -23.593 -1.382
552 H HIS 78 H HIS 78 -14.676 -17.744 -5.408
553 HA HIS 78 HA HIS 78 -16.321 -16.762 -7.498
554 HB2 HIS 78 1HB HIS 78 -14.383 -15.414 -8.173
555 HB3 HIS 78 2HB HIS 78 -14.643 -15.328 -6.440
556 HD1 HIS 78 HD1 HIS 78 -12.741 -16.020 -4.947
557 HD2 HIS 78 HD2 HIS 78 -12.066 -16.940 -8.944
558 HE1 HIS 78 HE1 HIS 78 -10.321 -16.692 -5.088
559 HE2 HIS 78 HE2 HIS 78 -9.908 -17.128 -7.532
560 H HIS 79 H HIS 79 -14.005 -19.289 -7.251
561 HA HIS 79 HA HIS 79 -14.096 -19.861 -10.104
562 HB2 HIS 79 1HB HIS 79 -12.052 -20.348 -8.719
563 HB3 HIS 79 2HB HIS 79 -12.990 -21.546 -7.835
564 HD1 HIS 79 HD1 HIS 79 -12.894 -23.863 -8.736
565 HD2 HIS 79 HD2 HIS 79 -11.817 -21.026 -11.579
566 HE1 HIS 79 HE1 HIS 79 -12.132 -25.169 -10.746
567 HE2 HIS 79 HE2 HIS 79 -11.567 -23.434 -12.482
568 H HIS 80 H HIS 80 -16.310 -20.102 -10.409
569 HA HIS 80 HA HIS 80 -18.001 -21.485 -8.614
570 HB2 HIS 80 1HB HIS 80 -18.422 -20.618 -11.475
571 HB3 HIS 80 2HB HIS 80 -19.685 -21.335 -10.481
572 HD1 HIS 80 HD1 HIS 80 -21.064 -19.728 -9.186
573 HD2 HIS 80 HD2 HIS 80 -17.387 -18.114 -10.268
574 HE1 HIS 80 HE1 HIS 80 -21.119 -17.332 -8.421
575 HE2 HIS 80 HE2 HIS 80 -18.900 -16.363 -9.122
576 H HIS 81 H HIS 81 -18.586 -23.528 -8.457
577 HA HIS 81 HA HIS 81 -18.057 -25.396 -10.632
578 HB2 HIS 81 1HB HIS 81 -16.001 -25.371 -9.231
579 HB3 HIS 81 2HB HIS 81 -16.974 -25.804 -7.831
580 HD1 HIS 81 HD1 HIS 81 -17.357 -28.249 -7.433
581 HD2 HIS 81 HD2 HIS 81 -15.901 -27.461 -11.246
582 HE1 HIS 81 HE1 HIS 81 -16.849 -30.493 -8.442
583 HE2 HIS 81 HE2 HIS 81 -16.063 -29.997 -10.782
584 H HIS 82 H HIS 82 -20.023 -26.242 -10.914
585 HA HIS 82 HA HIS 82 -21.818 -26.603 -8.666
586 HB2 HIS 82 1HB HIS 82 -22.695 -25.759 -10.816
587 HB3 HIS 82 2HB HIS 82 -22.213 -27.262 -11.595
588 HD1 HIS 82 HD1 HIS 82 -24.165 -28.707 -11.965
589 HD2 HIS 82 HD2 HIS 82 -24.509 -26.550 -8.427
590 HE1 HIS 82 HE1 HIS 82 -26.358 -29.411 -10.952
591 HE2 HIS 82 HE2 HIS 82 -26.523 -28.130 -8.791
Start of MODEL 3
1 H2 MET 1 2H MET 1 5.761 -10.702 -8.419
2 H MET 1 1H MET 1 6.962 -9.536 -8.681
3 H3 MET 1 3H MET 1 7.115 -10.647 -7.412
4 HA MET 1 HA MET 1 6.466 -8.480 -6.609
5 HB2 MET 1 1HB MET 1 4.278 -7.569 -7.166
6 HB3 MET 1 2HB MET 1 5.238 -7.770 -8.623
7 HG2 MET 1 1HG MET 1 4.023 -9.848 -9.112
8 HG3 MET 1 2HG MET 1 3.035 -9.586 -7.677
9 HE1 MET 1 1HE MET 1 0.819 -9.771 -9.138
10 HE2 MET 1 2HE MET 1 1.814 -10.066 -10.563
11 HE3 MET 1 3HE MET 1 0.546 -8.840 -10.612
12 H ALA 2 H ALA 2 5.176 -8.297 -4.758
13 HA ALA 2 HA ALA 2 3.807 -10.767 -3.925
14 HB1 ALA 2 1HB ALA 2 5.747 -9.141 -2.274
15 HB2 ALA 2 2HB ALA 2 6.043 -10.750 -2.934
16 HB3 ALA 2 3HB ALA 2 4.807 -10.518 -1.696
17 H GLN 3 H GLN 3 2.431 -10.359 -1.976
18 HA GLN 3 HA GLN 3 1.324 -7.638 -2.050
19 HB2 GLN 3 1HB GLN 3 -0.022 -10.294 -1.613
20 HB3 GLN 3 2HB GLN 3 -0.783 -8.771 -1.181
21 HG2 GLN 3 1HG GLN 3 -0.779 -8.039 -3.440
22 HG3 GLN 3 2HG GLN 3 0.213 -9.406 -3.937
23 HE21 GLN 3 1HE2 GLN 3 -2.943 -8.394 -2.893
24 HE22 GLN 3 2HE2 GLN 3 -3.794 -9.789 -3.444
25 H GLY 4 H GLY 4 0.143 -7.113 0.037
26 HA2 GLY 4 1HA GLY 4 0.783 -8.398 2.442
27 HA3 GLY 4 2HA GLY 4 1.987 -7.155 2.146
28 H THR 5 H THR 5 1.197 -6.219 4.100
29 HA THR 5 HA THR 5 -1.103 -4.466 3.579
30 HB THR 5 HB THR 5 -0.512 -5.665 6.288
31 HG1 THR 5 HG1 THR 5 -1.202 -7.283 4.755
32 HG21 THR 5 1HG2 THR 5 -1.728 -3.529 6.267
33 HG22 THR 5 2HG2 THR 5 -2.747 -4.851 6.837
34 HG23 THR 5 3HG2 THR 5 -2.937 -4.236 5.194
35 H VAL 6 H VAL 6 -0.467 -2.413 3.702
36 HA VAL 6 HA VAL 6 2.072 -1.676 4.709
37 HB VAL 6 HB VAL 6 1.370 -0.229 3.053
38 HG11 VAL 6 1HG1 VAL 6 -0.841 0.860 3.001
39 HG12 VAL 6 2HG1 VAL 6 -1.299 -0.071 4.424
40 HG13 VAL 6 3HG1 VAL 6 -0.929 -0.897 2.911
41 HG21 VAL 6 1HG2 VAL 6 0.641 1.193 5.611
42 HG22 VAL 6 2HG2 VAL 6 1.019 1.971 4.075
43 HG23 VAL 6 3HG2 VAL 6 2.261 1.049 4.925
44 H LYS 7 H LYS 7 2.628 -1.649 6.727
45 HA LYS 7 HA LYS 7 0.709 -1.776 8.828
46 HB2 LYS 7 1HB LYS 7 2.684 -1.825 10.308
47 HB3 LYS 7 2HB LYS 7 2.787 -3.001 9.008
48 HG2 LYS 7 1HG LYS 7 4.360 -1.674 7.826
49 HG3 LYS 7 2HG LYS 7 4.120 -0.315 8.923
50 HD2 LYS 7 1HD LYS 7 6.185 -1.437 9.457
51 HD3 LYS 7 2HD LYS 7 5.025 -1.680 10.761
52 HE2 LYS 7 1HE LYS 7 4.497 -3.899 9.855
53 HE3 LYS 7 2HE LYS 7 5.689 -3.651 8.580
54 HZ1 LYS 7 1HZ LYS 7 7.350 -3.351 10.412
55 HZ2 LYS 7 2HZ LYS 7 6.735 -4.917 10.243
56 HZ3 LYS 7 3HZ LYS 7 6.175 -3.914 11.491
57 H TRP 8 H TRP 8 2.744 0.671 7.438
58 HA TRP 8 HA TRP 8 1.043 2.738 8.316
59 HB2 TRP 8 1HB TRP 8 2.581 4.004 9.737
60 HB3 TRP 8 2HB TRP 8 2.221 2.444 10.458
61 HD1 TRP 8 HD1 TRP 8 4.211 0.744 10.763
62 HE1 TRP 8 HE1 TRP 8 6.766 1.005 10.633
63 HE3 TRP 8 HE3 TRP 8 4.453 5.276 8.410
64 HZ2 TRP 8 HZ2 TRP 8 8.633 2.885 9.681
65 HZ3 TRP 8 HZ3 TRP 8 6.665 6.237 7.931
66 HH2 TRP 8 HH2 TRP 8 8.710 5.061 8.552
67 H PHE 9 H PHE 9 1.496 4.682 7.266
68 HA PHE 9 HA PHE 9 3.897 4.759 5.618
69 HB2 PHE 9 1HB PHE 9 2.100 3.754 4.227
70 HB3 PHE 9 2HB PHE 9 1.145 5.215 4.457
71 HD1 PHE 9 HD1 PHE 9 1.589 7.185 3.206
72 HD2 PHE 9 HD2 PHE 9 4.212 3.844 2.976
73 HE1 PHE 9 HE1 PHE 9 2.724 8.213 1.284
74 HE2 PHE 9 HE2 PHE 9 5.355 4.866 1.054
75 HZ PHE 9 HZ PHE 9 4.613 7.055 0.209
76 H ASN 10 H ASN 10 4.842 6.606 5.881
77 HA ASN 10 HA ASN 10 3.373 8.886 6.929
78 HB2 ASN 10 1HB ASN 10 5.572 8.217 7.900
79 HB3 ASN 10 2HB ASN 10 6.332 8.577 6.358
80 HD21 ASN 10 1HD2 ASN 10 6.711 9.709 9.042
81 HD22 ASN 10 2HD2 ASN 10 6.488 11.413 8.857
82 H ALA 11 H ALA 11 2.210 9.742 5.298
83 HA ALA 11 HA ALA 11 3.120 9.871 2.603
84 HB1 ALA 11 1HB ALA 11 0.792 11.264 3.913
85 HB2 ALA 11 2HB ALA 11 0.754 9.669 3.161
86 HB3 ALA 11 3HB ALA 11 1.060 11.100 2.178
87 H GLU 12 H GLU 12 3.427 11.937 5.339
88 HA GLU 12 HA GLU 12 3.827 14.398 3.991
89 HB2 GLU 12 1HB GLU 12 4.904 13.442 6.648
90 HB3 GLU 12 2HB GLU 12 4.931 15.107 6.086
91 HG2 GLU 12 1HG GLU 12 2.462 13.472 6.587
92 HG3 GLU 12 2HG GLU 12 3.126 14.693 7.671
93 H LYS 13 H LYS 13 6.027 11.949 5.247
94 HA LYS 13 HA LYS 13 8.337 13.230 4.076
95 HB2 LYS 13 1HB LYS 13 8.075 10.559 5.455
96 HB3 LYS 13 2HB LYS 13 9.582 11.370 5.060
97 HG2 LYS 13 1HG LYS 13 7.488 12.407 6.948
98 HG3 LYS 13 2HG LYS 13 8.980 11.597 7.419
99 HD2 LYS 13 1HD LYS 13 10.258 13.389 6.295
100 HD3 LYS 13 2HD LYS 13 8.739 14.207 5.936
101 HE2 LYS 13 1HE LYS 13 8.267 14.419 8.309
102 HE3 LYS 13 2HE LYS 13 9.746 13.544 8.697
103 HZ1 LYS 13 1HZ LYS 13 11.036 15.324 7.724
104 HZ2 LYS 13 2HZ LYS 13 10.008 15.950 8.914
105 HZ3 LYS 13 3HZ LYS 13 9.629 16.150 7.279
106 H GLY 14 H GLY 14 6.170 10.613 3.391
107 HA2 GLY 14 1HA GLY 14 5.712 9.878 1.206
108 HA3 GLY 14 2HA GLY 14 7.275 10.489 0.692
109 H PHE 15 H PHE 15 7.012 8.480 3.538
110 HA PHE 15 HA PHE 15 7.682 6.103 2.009
111 HB2 PHE 15 1HB PHE 15 9.740 5.627 3.111
112 HB3 PHE 15 2HB PHE 15 9.854 7.274 2.511
113 HD1 PHE 15 HD1 PHE 15 9.876 9.159 4.060
114 HD2 PHE 15 HD2 PHE 15 9.701 5.145 5.465
115 HE1 PHE 15 HE1 PHE 15 10.529 9.916 6.309
116 HE2 PHE 15 HE2 PHE 15 10.350 5.899 7.712
117 HZ PHE 15 HZ PHE 15 10.765 8.286 8.136
118 H GLY 16 H GLY 16 7.746 4.152 3.369
119 HA2 GLY 16 1HA GLY 16 6.678 4.222 6.016
120 HA3 GLY 16 2HA GLY 16 5.441 3.821 4.831
121 H PHE 17 H PHE 17 5.386 1.779 6.079
122 HA PHE 17 HA PHE 17 7.267 -0.101 4.853
123 HB2 PHE 17 1HB PHE 17 6.786 0.257 7.776
124 HB3 PHE 17 2HB PHE 17 7.080 -1.366 7.157
125 HD1 PHE 17 HD1 PHE 17 9.221 -1.973 6.222
126 HD2 PHE 17 HD2 PHE 17 8.531 1.926 7.771
127 HE1 PHE 17 HE1 PHE 17 11.644 -1.561 6.246
128 HE2 PHE 17 HE2 PHE 17 10.954 2.349 7.799
129 HZ PHE 17 HZ PHE 17 12.515 0.604 7.035
130 H ILE 18 H ILE 18 6.453 -1.981 4.259
131 HA ILE 18 HA ILE 18 3.623 -2.508 4.856
132 HB ILE 18 HB ILE 18 5.287 -3.327 2.475
133 HG12 ILE 18 1HG1 ILE 18 2.732 -1.743 2.501
134 HG13 ILE 18 2HG1 ILE 18 4.314 -0.982 2.605
135 HG21 ILE 18 1HG2 ILE 18 2.458 -4.101 3.164
136 HG22 ILE 18 2HG2 ILE 18 3.857 -5.176 3.068
137 HG23 ILE 18 3HG2 ILE 18 3.243 -4.394 1.609
138 HD11 ILE 18 1HD1 ILE 18 3.362 -2.737 0.355
139 HD12 ILE 18 2HD1 ILE 18 4.928 -1.926 0.453
140 HD13 ILE 18 3HD1 ILE 18 3.445 -0.975 0.326
141 H ALA 19 H ALA 19 3.052 -4.458 5.658
142 HA ALA 19 HA ALA 19 5.212 -6.344 6.272
143 HB1 ALA 19 1HB ALA 19 3.583 -7.384 7.794
144 HB2 ALA 19 2HB ALA 19 2.375 -6.199 7.294
145 HB3 ALA 19 3HB ALA 19 3.821 -5.675 8.157
146 HA PRO 20 HA PRO 20 3.632 -8.112 2.349
147 HB2 PRO 20 1HB PRO 20 5.954 -9.841 3.009
148 HB3 PRO 20 2HB PRO 20 5.501 -9.108 1.469
149 HG2 PRO 20 1HG PRO 20 7.484 -8.088 2.903
150 HG3 PRO 20 2HG PRO 20 6.339 -7.028 2.065
151 HD2 PRO 20 1HD PRO 20 6.528 -7.699 4.954
152 HD3 PRO 20 2HD PRO 20 6.074 -6.175 4.178
153 H ASP 21 H ASP 21 2.526 -9.900 1.877
154 HA ASP 21 HA ASP 21 1.517 -11.510 4.016
155 HB2 ASP 21 1HB ASP 21 0.178 -10.721 2.050
156 HB3 ASP 21 2HB ASP 21 1.108 -11.814 1.033
157 H ASP 22 H ASP 22 4.223 -11.646 2.092
158 HA ASP 22 HA ASP 22 4.474 -14.517 1.915
159 HB2 ASP 22 1HB ASP 22 5.343 -12.955 0.163
160 HB3 ASP 22 2HB ASP 22 6.540 -12.391 1.321
161 H GLY 23 H GLY 23 4.313 -13.074 4.559
162 HA2 GLY 23 1HA GLY 23 5.116 -14.085 6.572
163 HA3 GLY 23 2HA GLY 23 6.620 -14.453 5.747
164 H SER 24 H SER 24 5.308 -11.353 5.271
165 HA SER 24 HA SER 24 6.014 -9.277 5.751
166 HB2 SER 24 1HB SER 24 6.090 -8.726 8.166
167 HB3 SER 24 2HB SER 24 4.674 -9.664 7.699
168 HG SER 24 HG SER 24 6.739 -11.271 8.421
169 H ALA 25 H ALA 25 8.025 -9.428 4.581
170 HA ALA 25 HA ALA 25 10.454 -9.651 6.104
171 HB1 ALA 25 1HB ALA 25 10.427 -10.163 3.709
172 HB2 ALA 25 2HB ALA 25 11.566 -8.869 4.077
173 HB3 ALA 25 3HB ALA 25 10.002 -8.488 3.357
174 H ASP 26 H ASP 26 8.059 -7.450 5.996
175 HA ASP 26 HA ASP 26 7.722 -5.283 6.502
176 HB2 ASP 26 1HB ASP 26 10.382 -5.577 7.915
177 HB3 ASP 26 2HB ASP 26 9.244 -4.252 8.147
178 H VAL 27 H VAL 27 7.904 -4.863 4.268
179 HA VAL 27 HA VAL 27 10.468 -4.098 3.175
180 HB VAL 27 HB VAL 27 8.930 -5.512 1.884
181 HG11 VAL 27 1HG1 VAL 27 6.925 -4.543 0.867
182 HG12 VAL 27 2HG1 VAL 27 7.157 -3.085 1.837
183 HG13 VAL 27 3HG1 VAL 27 6.814 -4.628 2.627
184 HG21 VAL 27 1HG2 VAL 27 9.070 -4.321 -0.236
185 HG22 VAL 27 2HG2 VAL 27 10.557 -4.164 0.700
186 HG23 VAL 27 3HG2 VAL 27 9.412 -2.823 0.631
187 H PHE 28 H PHE 28 11.066 -2.115 2.507
188 HA PHE 28 HA PHE 28 9.784 0.136 3.770
189 HB2 PHE 28 1HB PHE 28 12.215 -0.068 3.768
190 HB3 PHE 28 2HB PHE 28 12.233 -0.088 2.011
191 HD1 PHE 28 HD1 PHE 28 11.549 2.024 4.964
192 HD2 PHE 28 HD2 PHE 28 12.247 1.907 0.768
193 HE1 PHE 28 HE1 PHE 28 11.821 4.468 4.944
194 HE2 PHE 28 HE2 PHE 28 12.518 4.352 0.741
195 HZ PHE 28 HZ PHE 28 12.307 5.635 2.831
196 H VAL 29 H VAL 29 8.431 1.544 2.836
197 HA VAL 29 HA VAL 29 7.968 1.255 -0.059
198 HB VAL 29 HB VAL 29 6.121 2.802 1.694
199 HG11 VAL 29 1HG1 VAL 29 4.450 1.976 0.121
200 HG12 VAL 29 2HG1 VAL 29 5.688 1.023 -0.695
201 HG13 VAL 29 3HG1 VAL 29 5.776 2.785 -0.715
202 HG21 VAL 29 1HG2 VAL 29 4.874 0.812 2.277
203 HG22 VAL 29 2HG2 VAL 29 6.508 0.743 2.936
204 HG23 VAL 29 3HG2 VAL 29 6.095 -0.198 1.502
205 H HIS 30 H HIS 30 7.897 3.037 -1.386
206 HA HIS 30 HA HIS 30 8.526 5.650 -0.221
207 HB2 HIS 30 1HB HIS 30 10.622 4.574 -1.057
208 HB3 HIS 30 2HB HIS 30 9.898 4.487 -2.658
209 HD1 HIS 30 HD1 HIS 30 10.796 6.241 -4.113
210 HD2 HIS 30 HD2 HIS 30 10.454 7.530 -0.168
211 HE1 HIS 30 HE1 HIS 30 11.611 8.630 -4.097
212 HE2 HIS 30 HE2 HIS 30 11.527 9.336 -1.677
213 H TYR 31 H TYR 31 7.355 7.255 -1.073
214 HA TYR 31 HA TYR 31 4.968 6.595 -2.318
215 HB2 TYR 31 1HB TYR 31 4.421 8.899 -2.273
216 HB3 TYR 31 2HB TYR 31 5.439 8.607 -0.870
217 HD1 TYR 31 HD1 TYR 31 4.961 10.572 -3.801
218 HD2 TYR 31 HD2 TYR 31 7.927 9.219 -1.071
219 HE1 TYR 31 HE1 TYR 31 6.441 12.399 -4.510
220 HE2 TYR 31 HE2 TYR 31 9.413 11.042 -1.773
221 HH TYR 31 HH TYR 31 8.337 13.676 -3.643
222 H SER 32 H SER 32 7.959 7.653 -3.790
223 HA SER 32 HA SER 32 6.883 8.453 -6.272
224 HB2 SER 32 1HB SER 32 9.654 7.379 -5.696
225 HB3 SER 32 2HB SER 32 9.175 8.376 -7.073
226 HG SER 32 HG SER 32 9.208 10.101 -5.849
227 H GLU 33 H GLU 33 7.396 5.378 -4.873
228 HA GLU 33 HA GLU 33 7.387 4.015 -7.458
229 HB2 GLU 33 1HB GLU 33 8.012 3.173 -4.652
230 HB3 GLU 33 2HB GLU 33 7.617 1.969 -5.867
231 HG2 GLU 33 1HG GLU 33 10.040 2.305 -5.557
232 HG3 GLU 33 2HG GLU 33 9.497 2.605 -7.205
233 H ILE 34 H ILE 34 5.212 5.090 -5.177
234 HA ILE 34 HA ILE 34 3.441 2.853 -5.163
235 HB ILE 34 HB ILE 34 2.977 5.712 -4.325
236 HG12 ILE 34 1HG1 ILE 34 3.508 3.197 -2.729
237 HG13 ILE 34 2HG1 ILE 34 4.641 4.520 -2.974
238 HG21 ILE 34 1HG2 ILE 34 0.971 4.872 -3.182
239 HG22 ILE 34 2HG2 ILE 34 1.235 3.284 -3.904
240 HG23 ILE 34 3HG2 ILE 34 0.864 4.668 -4.932
241 HD11 ILE 34 1HD1 ILE 34 2.013 4.700 -1.528
242 HD12 ILE 34 2HD1 ILE 34 3.156 6.020 -1.762
243 HD13 ILE 34 3HD1 ILE 34 3.609 4.625 -0.779
244 H GLN 35 H GLN 35 1.793 2.391 -6.403
245 HA GLN 35 HA GLN 35 1.252 4.149 -8.697
246 HB2 GLN 35 1HB GLN 35 0.864 1.167 -8.446
247 HB3 GLN 35 2HB GLN 35 0.616 2.125 -9.898
248 HG2 GLN 35 1HG GLN 35 3.242 1.740 -8.490
249 HG3 GLN 35 2HG GLN 35 2.723 0.878 -9.934
250 HE21 GLN 35 1HE2 GLN 35 5.006 2.660 -9.453
251 HE22 GLN 35 2HE2 GLN 35 4.881 3.903 -10.646
252 H GLY 36 H GLY 36 -0.503 5.321 -8.066
253 HA2 GLY 36 1HA GLY 36 -2.841 3.790 -7.141
254 HA3 GLY 36 2HA GLY 36 -2.340 5.245 -6.294
255 H ASN 37 H ASN 37 -4.720 5.555 -6.915
256 HA ASN 37 HA ASN 37 -5.269 6.318 -9.635
257 HB2 ASN 37 1HB ASN 37 -7.494 6.940 -8.745
258 HB3 ASN 37 2HB ASN 37 -7.027 5.307 -8.289
259 HD21 ASN 37 1HD2 ASN 37 -8.935 7.165 -7.071
260 HD22 ASN 37 2HD2 ASN 37 -8.437 7.339 -5.425
261 H GLY 38 H GLY 38 -3.135 7.820 -8.771
262 HA2 GLY 38 1HA GLY 38 -2.690 10.127 -9.223
263 HA3 GLY 38 2HA GLY 38 -4.308 10.514 -8.654
264 H PHE 39 H PHE 39 -3.563 8.450 -6.434
265 HA PHE 39 HA PHE 39 -2.122 10.377 -4.747
266 HB2 PHE 39 1HB PHE 39 -4.196 8.306 -4.020
267 HB3 PHE 39 2HB PHE 39 -3.224 9.161 -2.828
268 HD1 PHE 39 HD1 PHE 39 -5.947 9.440 -5.254
269 HD2 PHE 39 HD2 PHE 39 -3.601 11.492 -2.358
270 HE1 PHE 39 HE1 PHE 39 -7.582 11.277 -5.237
271 HE2 PHE 39 HE2 PHE 39 -5.233 13.330 -2.332
272 HZ PHE 39 HZ PHE 39 -7.226 13.226 -3.773
273 H ARG 40 H ARG 40 -0.064 9.780 -4.636
274 HA ARG 40 HA ARG 40 0.672 6.974 -4.608
275 HB2 ARG 40 1HB ARG 40 2.384 9.455 -4.419
276 HB3 ARG 40 2HB ARG 40 2.986 7.811 -4.577
277 HG2 ARG 40 1HG ARG 40 1.764 7.646 -6.736
278 HG3 ARG 40 2HG ARG 40 1.378 9.360 -6.588
279 HD2 ARG 40 1HD ARG 40 3.776 9.877 -6.521
280 HD3 ARG 40 2HD ARG 40 4.141 8.162 -6.710
281 HE ARG 40 HE ARG 40 2.903 9.896 -8.742
282 HH11 ARG 40 1HH1 ARG 40 4.480 6.899 -7.862
283 HH12 ARG 40 2HH1 ARG 40 4.777 6.426 -9.502
284 HH21 ARG 40 1HH2 ARG 40 3.271 9.266 -10.900
285 HH22 ARG 40 2HH2 ARG 40 4.092 7.775 -11.233
286 H THR 41 H THR 41 -0.817 7.161 -2.561
287 HA THR 41 HA THR 41 0.968 7.332 -0.244
288 HB THR 41 HB THR 41 -0.999 8.164 1.086
289 HG1 THR 41 HG1 THR 41 -2.464 9.373 -0.614
290 HG21 THR 41 1HG2 THR 41 -0.025 9.952 -1.145
291 HG22 THR 41 2HG2 THR 41 0.780 9.685 0.403
292 HG23 THR 41 3HG2 THR 41 -0.786 10.500 0.351
293 H LEU 42 H LEU 42 0.307 6.007 1.539
294 HA LEU 42 HA LEU 42 -1.572 3.867 0.828
295 HB2 LEU 42 1HB LEU 42 1.103 3.650 2.197
296 HB3 LEU 42 2HB LEU 42 -0.089 2.369 2.219
297 HG LEU 42 HG LEU 42 1.280 3.465 -0.228
298 HD11 LEU 42 1HD1 LEU 42 1.540 0.780 1.106
299 HD12 LEU 42 2HD1 LEU 42 2.702 2.098 1.253
300 HD13 LEU 42 3HD1 LEU 42 2.413 1.347 -0.317
301 HD21 LEU 42 1HD2 LEU 42 -0.765 1.276 0.094
302 HD22 LEU 42 2HD2 LEU 42 0.187 1.547 -1.368
303 HD23 LEU 42 3HD2 LEU 42 -0.945 2.780 -0.813
304 H GLU 43 H GLU 43 -2.892 3.150 2.456
305 HA GLU 43 HA GLU 43 -3.024 4.896 4.789
306 HB2 GLU 43 1HB GLU 43 -5.000 2.900 3.679
307 HB3 GLU 43 2HB GLU 43 -5.273 3.887 5.107
308 HG2 GLU 43 1HG GLU 43 -4.890 4.864 2.290
309 HG3 GLU 43 2HG GLU 43 -6.390 4.863 3.215
310 H GLU 44 H GLU 44 -3.228 4.056 6.889
311 HA GLU 44 HA GLU 44 -1.431 1.928 7.395
312 HB2 GLU 44 1HB GLU 44 -1.850 3.968 8.826
313 HB3 GLU 44 2HB GLU 44 -3.342 3.201 9.341
314 HG2 GLU 44 1HG GLU 44 -2.123 1.378 10.310
315 HG3 GLU 44 2HG GLU 44 -0.604 2.024 9.697
316 H ASN 45 H ASN 45 -1.787 -0.149 7.575
317 HA ASN 45 HA ASN 45 -2.770 -2.169 7.790
318 HB2 ASN 45 1HB ASN 45 -4.929 -0.529 9.086
319 HB3 ASN 45 2HB ASN 45 -5.127 -2.257 8.821
320 HD21 ASN 45 1HD2 ASN 45 -3.469 0.195 10.598
321 HD22 ASN 45 2HD2 ASN 45 -2.716 -0.846 11.751
322 H GLN 46 H GLN 46 -2.955 -0.526 5.440
323 HA GLN 46 HA GLN 46 -5.414 -1.499 4.182
324 HB2 GLN 46 1HB GLN 46 -4.697 0.870 3.863
325 HB3 GLN 46 2HB GLN 46 -3.240 0.288 3.078
326 HG2 GLN 46 1HG GLN 46 -4.630 -0.779 1.353
327 HG3 GLN 46 2HG GLN 46 -6.061 -0.095 2.119
328 HE21 GLN 46 1HE2 GLN 46 -3.208 0.560 0.285
329 HE22 GLN 46 2HE2 GLN 46 -3.633 2.168 -0.191
330 H LYS 47 H LYS 47 -5.356 -2.939 2.454
331 HA LYS 47 HA LYS 47 -3.046 -4.629 2.305
332 HB2 LYS 47 1HB LYS 47 -5.610 -4.614 0.711
333 HB3 LYS 47 2HB LYS 47 -4.353 -5.829 0.543
334 HG2 LYS 47 1HG LYS 47 -5.959 -5.264 3.026
335 HG3 LYS 47 2HG LYS 47 -6.161 -6.639 1.942
336 HD2 LYS 47 1HD LYS 47 -3.633 -6.039 3.476
337 HD3 LYS 47 2HD LYS 47 -4.886 -7.149 4.026
338 HE2 LYS 47 1HE LYS 47 -3.389 -7.429 1.422
339 HE3 LYS 47 2HE LYS 47 -2.953 -8.260 2.910
340 HZ1 LYS 47 1HZ LYS 47 -5.495 -8.556 1.410
341 HZ2 LYS 47 2HZ LYS 47 -5.169 -9.290 2.896
342 HZ3 LYS 47 3HZ LYS 47 -4.258 -9.701 1.532
343 H VAL 48 H VAL 48 -1.801 -5.025 0.433
344 HA VAL 48 HA VAL 48 -1.847 -3.047 -1.671
345 HB VAL 48 HB VAL 48 -0.784 -1.862 0.202
346 HG11 VAL 48 1HG1 VAL 48 1.378 -2.574 1.054
347 HG12 VAL 48 2HG1 VAL 48 1.303 -4.024 0.051
348 HG13 VAL 48 3HG1 VAL 48 0.138 -3.794 1.357
349 HG21 VAL 48 1HG2 VAL 48 -0.138 -1.277 -2.050
350 HG22 VAL 48 2HG2 VAL 48 1.093 -2.540 -2.051
351 HG23 VAL 48 3HG2 VAL 48 1.249 -1.155 -0.968
352 H GLU 49 H GLU 49 -0.444 -3.525 -3.373
353 HA GLU 49 HA GLU 49 0.949 -6.115 -3.247
354 HB2 GLU 49 1HB GLU 49 -1.083 -6.312 -4.580
355 HB3 GLU 49 2HB GLU 49 -0.622 -4.911 -5.528
356 HG2 GLU 49 1HG GLU 49 1.369 -6.164 -6.308
357 HG3 GLU 49 2HG GLU 49 0.747 -7.584 -5.464
358 H PHE 50 H PHE 50 3.018 -6.125 -4.194
359 HA PHE 50 HA PHE 50 4.012 -3.700 -5.427
360 HB2 PHE 50 1HB PHE 50 5.720 -3.386 -3.573
361 HB3 PHE 50 2HB PHE 50 4.065 -2.935 -3.174
362 HD1 PHE 50 HD1 PHE 50 2.689 -4.416 -1.754
363 HD2 PHE 50 HD2 PHE 50 6.830 -5.147 -2.414
364 HE1 PHE 50 HE1 PHE 50 2.721 -5.934 0.173
365 HE2 PHE 50 HE2 PHE 50 6.865 -6.668 -0.481
366 HZ PHE 50 HZ PHE 50 4.809 -7.064 0.812
367 H GLU 51 H GLU 51 6.266 -3.838 -6.015
368 HA GLU 51 HA GLU 51 7.212 -6.615 -6.235
369 HB2 GLU 51 1HB GLU 51 6.858 -5.340 -8.361
370 HB3 GLU 51 2HB GLU 51 8.084 -4.195 -7.828
371 HG2 GLU 51 1HG GLU 51 8.996 -5.800 -9.406
372 HG3 GLU 51 2HG GLU 51 9.752 -5.958 -7.821
373 H ILE 52 H ILE 52 8.788 -7.159 -4.879
374 HA ILE 52 HA ILE 52 9.990 -5.138 -3.238
375 HB ILE 52 HB ILE 52 10.461 -8.115 -3.291
376 HG12 ILE 52 1HG1 ILE 52 8.792 -6.407 -1.439
377 HG13 ILE 52 2HG1 ILE 52 8.154 -7.448 -2.706
378 HG21 ILE 52 1HG2 ILE 52 11.285 -6.039 -1.270
379 HG22 ILE 52 2HG2 ILE 52 12.360 -6.933 -2.344
380 HG23 ILE 52 3HG2 ILE 52 11.472 -7.782 -1.080
381 HD11 ILE 52 1HD1 ILE 52 7.950 -8.492 -0.533
382 HD12 ILE 52 2HD1 ILE 52 9.690 -8.345 -0.283
383 HD13 ILE 52 3HD1 ILE 52 9.068 -9.395 -1.556
384 H GLY 53 H GLY 53 11.701 -4.042 -3.751
385 HA2 GLY 53 1HA GLY 53 13.847 -5.365 -5.291
386 HA3 GLY 53 2HA GLY 53 13.534 -3.633 -5.331
387 H GLU 54 H GLU 54 15.812 -3.438 -4.719
388 HA GLU 54 HA GLU 54 16.254 -4.008 -1.868
389 HB2 GLU 54 1HB GLU 54 17.841 -5.146 -3.326
390 HB3 GLU 54 2HB GLU 54 18.262 -3.623 -4.092
391 HG2 GLU 54 1HG GLU 54 19.963 -4.322 -2.504
392 HG3 GLU 54 2HG GLU 54 19.206 -2.810 -2.009
393 H GLY 55 H GLY 55 16.557 -2.369 -0.512
394 HA2 GLY 55 1HA GLY 55 16.527 0.336 -1.685
395 HA3 GLY 55 2HA GLY 55 15.771 -0.099 -0.163
396 H ALA 56 H ALA 56 16.937 1.660 0.755
397 HA ALA 56 HA ALA 56 19.772 1.787 0.726
398 HB1 ALA 56 1HB ALA 56 18.357 3.750 1.097
399 HB2 ALA 56 2HB ALA 56 19.521 3.525 2.403
400 HB3 ALA 56 3HB ALA 56 17.832 3.074 2.639
401 H LYS 57 H LYS 57 17.426 0.630 3.132
402 HA LYS 57 HA LYS 57 19.593 -0.890 4.392
403 HB2 LYS 57 1HB LYS 57 17.623 0.901 5.801
404 HB3 LYS 57 2HB LYS 57 18.527 -0.356 6.630
405 HG2 LYS 57 1HG LYS 57 19.760 1.940 5.124
406 HG3 LYS 57 2HG LYS 57 19.529 1.880 6.872
407 HD2 LYS 57 1HD LYS 57 20.933 -0.165 6.936
408 HD3 LYS 57 2HD LYS 57 21.235 0.028 5.210
409 HE2 LYS 57 1HE LYS 57 23.087 0.928 6.491
410 HE3 LYS 57 2HE LYS 57 22.243 2.221 5.641
411 HZ1 LYS 57 1HZ LYS 57 21.128 2.815 7.678
412 HZ2 LYS 57 2HZ LYS 57 22.798 2.817 7.926
413 HZ3 LYS 57 3HZ LYS 57 21.862 1.535 8.501
414 H GLY 58 H GLY 58 17.779 -1.879 2.578
415 HA2 GLY 58 1HA GLY 58 16.979 -4.245 3.299
416 HA3 GLY 58 2HA GLY 58 15.773 -3.306 4.172
417 HA PRO 59 HA PRO 59 14.557 -4.436 -0.339
418 HB2 PRO 59 1HB PRO 59 12.132 -5.480 0.545
419 HB3 PRO 59 2HB PRO 59 13.551 -6.422 0.085
420 HG2 PRO 59 1HG PRO 59 12.623 -5.581 2.793
421 HG3 PRO 59 2HG PRO 59 13.337 -7.120 2.279
422 HD2 PRO 59 1HD PRO 59 14.799 -5.332 3.596
423 HD3 PRO 59 2HD PRO 59 15.497 -6.242 2.238
424 H GLN 60 H GLN 60 13.169 -3.230 -1.529
425 HA GLN 60 HA GLN 60 11.478 -1.324 -0.055
426 HB2 GLN 60 1HB GLN 60 11.951 0.360 -1.759
427 HB3 GLN 60 2HB GLN 60 13.430 -0.165 -0.970
428 HG2 GLN 60 1HG GLN 60 14.040 -1.502 -2.861
429 HG3 GLN 60 2HG GLN 60 12.483 -1.203 -3.630
430 HE21 GLN 60 1HE2 GLN 60 12.468 1.598 -2.810
431 HE22 GLN 60 2HE2 GLN 60 13.577 2.407 -3.856
432 H ALA 61 H ALA 61 9.481 -0.915 -0.835
433 HA ALA 61 HA ALA 61 8.399 -2.837 -2.697
434 HB1 ALA 61 1HB ALA 61 6.240 -1.814 -2.145
435 HB2 ALA 61 2HB ALA 61 7.074 -0.563 -1.222
436 HB3 ALA 61 3HB ALA 61 7.145 -2.245 -0.693
437 H GLN 62 H GLN 62 8.437 -2.535 -4.799
438 HA GLN 62 HA GLN 62 8.377 0.217 -5.848
439 HB2 GLN 62 1HB GLN 62 9.359 -2.276 -7.235
440 HB3 GLN 62 2HB GLN 62 9.489 -0.625 -7.824
441 HG2 GLN 62 1HG GLN 62 10.982 -0.089 -5.962
442 HG3 GLN 62 2HG GLN 62 10.867 -1.757 -5.402
443 HE21 GLN 62 1HE2 GLN 62 11.754 -3.407 -6.686
444 HE22 GLN 62 2HE2 GLN 62 13.001 -3.071 -7.834
445 H GLN 63 H GLN 63 7.057 0.616 -7.698
446 HA GLN 63 HA GLN 63 5.048 0.573 -8.759
447 HB2 GLN 63 1HB GLN 63 5.779 -2.349 -8.958
448 HB3 GLN 63 2HB GLN 63 4.412 -1.636 -9.793
449 HG2 GLN 63 1HG GLN 63 6.077 -1.719 -11.405
450 HG3 GLN 63 2HG GLN 63 6.113 -0.050 -10.845
451 HE21 GLN 63 1HE2 GLN 63 7.919 0.721 -9.838
452 HE22 GLN 63 2HE2 GLN 63 9.383 -0.181 -9.689
453 H VAL 64 H VAL 64 4.646 0.828 -6.210
454 HA VAL 64 HA VAL 64 3.373 -1.371 -4.909
455 HB VAL 64 HB VAL 64 3.194 1.478 -3.985
456 HG11 VAL 64 1HG1 VAL 64 3.379 -1.152 -2.547
457 HG12 VAL 64 2HG1 VAL 64 1.957 -0.118 -2.692
458 HG13 VAL 64 3HG1 VAL 64 3.358 0.429 -1.768
459 HG21 VAL 64 1HG2 VAL 64 5.580 -0.341 -3.712
460 HG22 VAL 64 2HG2 VAL 64 5.364 1.189 -2.861
461 HG23 VAL 64 3HG2 VAL 64 5.510 1.171 -4.619
462 H HIS 65 H HIS 65 1.535 -2.016 -5.845
463 HA HIS 65 HA HIS 65 -0.516 -0.156 -6.692
464 HB2 HIS 65 1HB HIS 65 -0.679 -3.165 -6.449
465 HB3 HIS 65 2HB HIS 65 -1.788 -2.129 -7.323
466 HD1 HIS 65 HD1 HIS 65 0.216 -4.585 -8.305
467 HD2 HIS 65 HD2 HIS 65 0.384 -0.519 -9.161
468 HE1 HIS 65 HE1 HIS 65 1.531 -4.391 -10.437
469 HE2 HIS 65 HE2 HIS 65 1.410 -1.950 -11.047
470 H ALA 66 H ALA 66 -1.659 0.810 -5.139
471 HA ALA 66 HA ALA 66 -2.011 -0.325 -2.547
472 HB1 ALA 66 1HB ALA 66 -3.402 1.623 -2.095
473 HB2 ALA 66 2HB ALA 66 -3.408 2.030 -3.813
474 HB3 ALA 66 3HB ALA 66 -1.902 2.095 -2.896
475 H LEU 67 H LEU 67 -3.355 -1.917 -2.096
476 HA LEU 67 HA LEU 67 -5.511 -2.570 -3.912
477 HB2 LEU 67 1HB LEU 67 -4.575 -3.918 -1.379
478 HB3 LEU 67 2HB LEU 67 -5.797 -4.553 -2.461
479 HG LEU 67 HG LEU 67 -2.875 -4.150 -3.098
480 HD11 LEU 67 1HD1 LEU 67 -2.810 -6.572 -3.234
481 HD12 LEU 67 2HD1 LEU 67 -4.518 -6.657 -2.805
482 HD13 LEU 67 3HD1 LEU 67 -3.345 -6.052 -1.636
483 HD21 LEU 67 1HD2 LEU 67 -4.231 -3.702 -5.065
484 HD22 LEU 67 2HD2 LEU 67 -5.100 -5.219 -4.831
485 HD23 LEU 67 3HD2 LEU 67 -3.383 -5.239 -5.232
486 H GLY 68 H GLY 68 -6.253 -0.269 -3.115
487 HA2 GLY 68 1HA GLY 68 -8.032 -0.635 -0.792
488 HA3 GLY 68 2HA GLY 68 -7.397 0.916 -1.324
489 H GLY 69 H GLY 69 -10.147 0.089 -0.891
490 HA2 GLY 69 1HA GLY 69 -11.251 1.223 -3.279
491 HA3 GLY 69 2HA GLY 69 -11.658 -0.477 -3.093
492 H GLU 70 H GLU 70 -12.315 -0.977 -0.706
493 HA GLU 70 HA GLU 70 -14.017 -0.890 0.789
494 HB2 GLU 70 1HB GLU 70 -12.467 0.926 1.640
495 HB3 GLU 70 2HB GLU 70 -13.518 2.088 0.842
496 HG2 GLU 70 1HG GLU 70 -15.409 1.157 2.208
497 HG3 GLU 70 2HG GLU 70 -14.202 0.247 3.115
498 H ASN 71 H ASN 71 -15.457 -1.466 -0.937
499 HA ASN 71 HA ASN 71 -17.435 -1.344 -2.031
500 HB2 ASN 71 1HB ASN 71 -17.666 1.415 -0.809
501 HB3 ASN 71 2HB ASN 71 -18.924 0.641 -1.763
502 HD21 ASN 71 1HD2 ASN 71 -17.281 0.747 1.267
503 HD22 ASN 71 2HD2 ASN 71 -18.347 -0.316 2.122
504 H LEU 72 H LEU 72 -16.030 1.914 -2.192
505 HA LEU 72 HA LEU 72 -15.213 3.169 -3.878
506 HB2 LEU 72 1HB LEU 72 -14.017 0.942 -4.357
507 HB3 LEU 72 2HB LEU 72 -15.187 0.732 -5.639
508 HG LEU 72 HG LEU 72 -12.955 1.618 -6.363
509 HD11 LEU 72 1HD1 LEU 72 -14.933 1.912 -7.759
510 HD12 LEU 72 2HD1 LEU 72 -13.842 3.290 -7.887
511 HD13 LEU 72 3HD1 LEU 72 -15.308 3.415 -6.917
512 HD21 LEU 72 1HD2 LEU 72 -12.596 3.073 -4.401
513 HD22 LEU 72 2HD2 LEU 72 -13.864 4.145 -4.998
514 HD23 LEU 72 3HD2 LEU 72 -12.389 3.914 -5.936
515 H TYR 73 H TYR 73 -17.041 0.833 -5.847
516 HA TYR 73 HA TYR 73 -18.638 3.093 -6.824
517 HB2 TYR 73 1HB TYR 73 -17.384 1.784 -8.530
518 HB3 TYR 73 2HB TYR 73 -18.297 0.353 -8.066
519 HD1 TYR 73 HD1 TYR 73 -20.324 -0.122 -9.115
520 HD2 TYR 73 HD2 TYR 73 -18.738 3.811 -9.385
521 HE1 TYR 73 HE1 TYR 73 -22.090 0.468 -10.715
522 HE2 TYR 73 HE2 TYR 73 -20.502 4.417 -10.990
523 HH TYR 73 HH TYR 73 -23.249 2.515 -11.491
524 H PHE 74 H PHE 74 -19.847 3.022 -4.865
525 HA PHE 74 HA PHE 74 -22.270 1.553 -5.182
526 HB2 PHE 74 1HB PHE 74 -20.981 -0.193 -4.053
527 HB3 PHE 74 2HB PHE 74 -20.520 0.938 -2.788
528 HD1 PHE 74 HD1 PHE 74 -21.781 1.089 -0.857
529 HD2 PHE 74 HD2 PHE 74 -23.511 -0.617 -4.349
530 HE1 PHE 74 HE1 PHE 74 -23.777 0.466 0.439
531 HE2 PHE 74 HE2 PHE 74 -25.510 -1.242 -3.060
532 HZ PHE 74 HZ PHE 74 -25.644 -0.701 -0.661
533 H GLN 75 H GLN 75 -23.891 2.763 -4.398
534 HA GLN 75 HA GLN 75 -23.152 5.008 -2.652
535 HB2 GLN 75 1HB GLN 75 -25.382 4.776 -4.676
536 HB3 GLN 75 2HB GLN 75 -25.191 6.128 -3.570
537 HG2 GLN 75 1HG GLN 75 -23.190 5.283 -5.652
538 HG3 GLN 75 2HG GLN 75 -24.325 6.623 -5.805
539 HE21 GLN 75 1HE2 GLN 75 -21.442 5.471 -4.246
540 HE22 GLN 75 2HE2 GLN 75 -20.926 6.994 -3.614
541 H GLY 76 H GLY 76 -23.432 3.974 -0.711
542 HA2 GLY 76 1HA GLY 76 -25.867 2.557 -0.087
543 HA3 GLY 76 2HA GLY 76 -24.563 2.944 1.031
544 H HIS 77 H HIS 77 -27.011 4.623 -0.904
545 HA HIS 77 HA HIS 77 -27.652 6.272 1.448
546 HB2 HIS 77 1HB HIS 77 -26.169 7.338 -0.453
547 HB3 HIS 77 2HB HIS 77 -27.699 7.442 -1.316
548 HD1 HIS 77 HD1 HIS 77 -25.644 9.180 1.118
549 HD2 HIS 77 HD2 HIS 77 -29.679 9.071 0.125
550 HE1 HIS 77 HE1 HIS 77 -26.647 11.237 2.145
551 HE2 HIS 77 HE2 HIS 77 -29.055 11.235 1.412
552 H HIS 78 H HIS 78 -29.805 6.511 1.787
553 HA HIS 78 HA HIS 78 -31.600 4.825 0.387
554 HB2 HIS 78 1HB HIS 78 -31.787 5.512 2.812
555 HB3 HIS 78 2HB HIS 78 -32.334 7.088 2.253
556 HD1 HIS 78 HD1 HIS 78 -34.771 7.176 2.687
557 HD2 HIS 78 HD2 HIS 78 -33.599 3.488 1.173
558 HE1 HIS 78 HE1 HIS 78 -36.891 5.882 2.344
559 HE2 HIS 78 HE2 HIS 78 -36.170 3.741 1.243
560 H HIS 79 H HIS 79 -32.677 5.193 -1.432
561 HA HIS 79 HA HIS 79 -32.291 7.711 -2.782
562 HB2 HIS 79 1HB HIS 79 -33.629 5.151 -3.672
563 HB3 HIS 79 2HB HIS 79 -33.377 6.554 -4.706
564 HD1 HIS 79 HD1 HIS 79 -31.895 3.426 -3.953
565 HD2 HIS 79 HD2 HIS 79 -30.422 7.235 -4.718
566 HE1 HIS 79 HE1 HIS 79 -29.483 3.101 -4.597
567 HE2 HIS 79 HE2 HIS 79 -28.573 5.438 -4.883
568 H HIS 80 H HIS 80 -33.927 7.962 -0.560
569 HA HIS 80 HA HIS 80 -36.072 9.431 -1.711
570 HB2 HIS 80 1HB HIS 80 -36.991 7.040 -1.589
571 HB3 HIS 80 2HB HIS 80 -36.910 7.204 0.161
572 HD1 HIS 80 HD1 HIS 80 -38.889 8.254 1.267
573 HD2 HIS 80 HD2 HIS 80 -38.789 9.004 -2.819
574 HE1 HIS 80 HE1 HIS 80 -41.060 9.403 0.738
575 HE2 HIS 80 HE2 HIS 80 -40.888 10.017 -1.698
576 H HIS 81 H HIS 81 -33.948 10.264 -0.389
577 HA HIS 81 HA HIS 81 -34.998 11.274 2.116
578 HB2 HIS 81 1HB HIS 81 -33.909 9.096 2.709
579 HB3 HIS 81 2HB HIS 81 -32.393 9.730 2.081
580 HD1 HIS 81 HD1 HIS 81 -34.707 9.953 4.990
581 HD2 HIS 81 HD2 HIS 81 -31.125 11.636 3.724
582 HE1 HIS 81 HE1 HIS 81 -33.755 11.115 7.007
583 HE2 HIS 81 HE2 HIS 81 -31.653 12.227 6.185
584 H HIS 82 H HIS 82 -32.220 11.001 -0.048
585 HA HIS 82 HA HIS 82 -30.593 12.437 -0.687
586 HB2 HIS 82 1HB HIS 82 -32.775 14.460 -0.144
587 HB3 HIS 82 2HB HIS 82 -31.245 14.853 -0.919
588 HD1 HIS 82 HD1 HIS 82 -34.614 13.749 -1.650
589 HD2 HIS 82 HD2 HIS 82 -30.885 13.370 -3.445
590 HE1 HIS 82 HE1 HIS 82 -35.075 13.077 -4.028
591 HE2 HIS 82 HE2 HIS 82 -32.802 12.721 -5.056
Start of MODEL 4
1 H2 MET 1 2H MET 1 4.269 -8.688 -9.125
2 H MET 1 1H MET 1 3.058 -9.360 -8.157
3 H3 MET 1 3H MET 1 3.966 -8.052 -7.591
4 HA MET 1 HA MET 1 4.977 -10.773 -8.154
5 HB2 MET 1 1HB MET 1 6.601 -8.931 -8.613
6 HB3 MET 1 2HB MET 1 6.422 -8.412 -6.942
7 HG2 MET 1 1HG MET 1 7.269 -10.603 -6.199
8 HG3 MET 1 2HG MET 1 7.510 -11.055 -7.887
9 HE1 MET 1 1HE MET 1 9.879 -11.366 -5.959
10 HE2 MET 1 2HE MET 1 11.195 -10.574 -6.825
11 HE3 MET 1 3HE MET 1 10.046 -11.583 -7.702
12 H ALA 2 H ALA 2 4.709 -8.279 -5.609
13 HA ALA 2 HA ALA 2 4.032 -10.435 -3.721
14 HB1 ALA 2 1HB ALA 2 6.293 -9.607 -3.302
15 HB2 ALA 2 2HB ALA 2 5.205 -9.185 -1.979
16 HB3 ALA 2 3HB ALA 2 5.669 -7.963 -3.164
17 H GLN 3 H GLN 3 2.864 -9.644 -1.801
18 HA GLN 3 HA GLN 3 1.389 -7.154 -2.162
19 HB2 GLN 3 1HB GLN 3 0.090 -9.849 -1.771
20 HB3 GLN 3 2HB GLN 3 -0.735 -8.324 -1.507
21 HG2 GLN 3 1HG GLN 3 -0.412 -7.735 -3.841
22 HG3 GLN 3 2HG GLN 3 0.436 -9.255 -4.112
23 HE21 GLN 3 1HE2 GLN 3 -1.968 -8.260 -5.385
24 HE22 GLN 3 2HE2 GLN 3 -3.202 -9.431 -5.061
25 H GLY 4 H GLY 4 0.052 -6.741 -0.122
26 HA2 GLY 4 1HA GLY 4 0.529 -8.120 2.257
27 HA3 GLY 4 2HA GLY 4 1.765 -6.880 2.110
28 H THR 5 H THR 5 0.862 -6.009 4.030
29 HA THR 5 HA THR 5 -1.349 -4.164 3.421
30 HB THR 5 HB THR 5 -0.870 -5.526 6.085
31 HG1 THR 5 HG1 THR 5 -1.881 -6.954 4.661
32 HG21 THR 5 1HG2 THR 5 -3.033 -3.610 5.218
33 HG22 THR 5 2HG2 THR 5 -1.704 -3.236 6.316
34 HG23 THR 5 3HG2 THR 5 -2.934 -4.412 6.785
35 H VAL 6 H VAL 6 -0.660 -2.120 3.585
36 HA VAL 6 HA VAL 6 1.945 -1.512 4.460
37 HB VAL 6 HB VAL 6 1.168 -0.011 2.872
38 HG11 VAL 6 1HG1 VAL 6 -1.190 -0.510 3.024
39 HG12 VAL 6 2HG1 VAL 6 -0.923 1.233 3.021
40 HG13 VAL 6 3HG1 VAL 6 -1.302 0.402 4.529
41 HG21 VAL 6 1HG2 VAL 6 2.359 1.140 4.667
42 HG22 VAL 6 2HG2 VAL 6 0.829 1.424 5.503
43 HG23 VAL 6 3HG2 VAL 6 1.134 2.186 3.941
44 H LYS 7 H LYS 7 2.679 -1.493 6.376
45 HA LYS 7 HA LYS 7 1.109 -1.726 8.706
46 HB2 LYS 7 1HB LYS 7 3.399 -2.648 8.423
47 HB3 LYS 7 2HB LYS 7 4.032 -1.010 8.413
48 HG2 LYS 7 1HG LYS 7 3.045 -0.721 10.698
49 HG3 LYS 7 2HG LYS 7 2.710 -2.451 10.689
50 HD2 LYS 7 1HD LYS 7 5.417 -1.155 10.419
51 HD3 LYS 7 2HD LYS 7 4.800 -1.988 11.844
52 HE2 LYS 7 1HE LYS 7 4.614 -4.054 10.471
53 HE3 LYS 7 2HE LYS 7 5.388 -3.188 9.145
54 HZ1 LYS 7 1HZ LYS 7 7.302 -2.809 10.641
55 HZ2 LYS 7 2HZ LYS 7 7.035 -4.447 10.301
56 HZ3 LYS 7 3HZ LYS 7 6.565 -3.802 11.796
57 H TRP 8 H TRP 8 3.037 0.850 7.309
58 HA TRP 8 HA TRP 8 1.258 2.865 8.216
59 HB2 TRP 8 1HB TRP 8 2.779 4.102 9.662
60 HB3 TRP 8 2HB TRP 8 2.507 2.498 10.324
61 HD1 TRP 8 HD1 TRP 8 4.575 0.823 10.370
62 HE1 TRP 8 HE1 TRP 8 7.112 1.214 10.196
63 HE3 TRP 8 HE3 TRP 8 4.532 5.569 8.483
64 HZ2 TRP 8 HZ2 TRP 8 8.863 3.274 9.375
65 HZ3 TRP 8 HZ3 TRP 8 6.679 6.675 8.029
66 HH2 TRP 8 HH2 TRP 8 8.796 5.548 8.465
67 H PHE 9 H PHE 9 1.754 4.901 7.270
68 HA PHE 9 HA PHE 9 4.100 4.999 5.554
69 HB2 PHE 9 1HB PHE 9 2.285 4.015 4.166
70 HB3 PHE 9 2HB PHE 9 1.330 5.469 4.440
71 HD1 PHE 9 HD1 PHE 9 4.443 4.185 2.949
72 HD2 PHE 9 HD2 PHE 9 1.692 7.420 3.162
73 HE1 PHE 9 HE1 PHE 9 5.555 5.250 1.034
74 HE2 PHE 9 HE2 PHE 9 2.797 8.493 1.247
75 HZ PHE 9 HZ PHE 9 4.733 7.408 0.182
76 H ASN 10 H ASN 10 5.026 6.898 5.696
77 HA ASN 10 HA ASN 10 3.482 9.150 6.771
78 HB2 ASN 10 1HB ASN 10 5.633 8.445 7.876
79 HB3 ASN 10 2HB ASN 10 6.478 8.922 6.410
80 HD21 ASN 10 1HD2 ASN 10 6.739 9.939 9.106
81 HD22 ASN 10 2HD2 ASN 10 6.397 11.632 9.023
82 H ALA 11 H ALA 11 2.510 10.192 5.147
83 HA ALA 11 HA ALA 11 3.533 10.257 2.488
84 HB1 ALA 11 1HB ALA 11 1.298 11.858 3.717
85 HB2 ALA 11 2HB ALA 11 1.137 10.269 2.969
86 HB3 ALA 11 3HB ALA 11 1.610 11.660 1.992
87 H GLU 12 H GLU 12 3.958 12.239 5.256
88 HA GLU 12 HA GLU 12 4.560 14.691 3.944
89 HB2 GLU 12 1HB GLU 12 5.508 13.714 6.643
90 HB3 GLU 12 2HB GLU 12 5.484 15.381 6.086
91 HG2 GLU 12 1HG GLU 12 3.074 13.645 6.532
92 HG3 GLU 12 2HG GLU 12 3.659 14.903 7.620
93 H LYS 13 H LYS 13 6.405 11.940 5.057
94 HA LYS 13 HA LYS 13 8.904 13.124 4.143
95 HB2 LYS 13 1HB LYS 13 8.450 10.435 5.432
96 HB3 LYS 13 2HB LYS 13 9.982 11.274 5.245
97 HG2 LYS 13 1HG LYS 13 7.676 12.118 6.976
98 HG3 LYS 13 2HG LYS 13 9.209 11.439 7.520
99 HD2 LYS 13 1HD LYS 13 10.387 13.380 6.620
100 HD3 LYS 13 2HD LYS 13 8.856 14.051 6.060
101 HE2 LYS 13 1HE LYS 13 8.060 14.136 8.380
102 HE3 LYS 13 2HE LYS 13 9.613 13.505 8.923
103 HZ1 LYS 13 1HZ LYS 13 10.695 15.467 8.051
104 HZ2 LYS 13 2HZ LYS 13 9.477 15.914 9.136
105 HZ3 LYS 13 3HZ LYS 13 9.221 16.064 7.473
106 H GLY 14 H GLY 14 6.612 10.634 3.353
107 HA2 GLY 14 1HA GLY 14 6.212 9.927 1.147
108 HA3 GLY 14 2HA GLY 14 7.832 10.438 0.709
109 H PHE 15 H PHE 15 7.439 8.501 3.565
110 HA PHE 15 HA PHE 15 7.951 6.060 2.073
111 HB2 PHE 15 1HB PHE 15 9.979 5.483 3.174
112 HB3 PHE 15 2HB PHE 15 10.184 7.113 2.554
113 HD1 PHE 15 HD1 PHE 15 10.251 9.027 4.105
114 HD2 PHE 15 HD2 PHE 15 9.998 5.017 5.511
115 HE1 PHE 15 HE1 PHE 15 10.970 9.764 6.341
116 HE2 PHE 15 HE2 PHE 15 10.710 5.750 7.745
117 HZ PHE 15 HZ PHE 15 11.198 8.126 8.163
118 H GLY 16 H GLY 16 8.012 4.137 3.519
119 HA2 GLY 16 1HA GLY 16 6.969 4.263 6.155
120 HA3 GLY 16 2HA GLY 16 5.683 3.919 5.004
121 H PHE 17 H PHE 17 5.559 1.873 6.244
122 HA PHE 17 HA PHE 17 7.329 -0.092 4.974
123 HB2 PHE 17 1HB PHE 17 6.847 0.232 7.905
124 HB3 PHE 17 2HB PHE 17 7.064 -1.388 7.250
125 HD1 PHE 17 HD1 PHE 17 8.672 1.792 7.993
126 HD2 PHE 17 HD2 PHE 17 9.179 -2.070 6.291
127 HE1 PHE 17 HE1 PHE 17 11.112 2.088 8.066
128 HE2 PHE 17 HE2 PHE 17 11.619 -1.785 6.354
129 HZ PHE 17 HZ PHE 17 12.590 0.297 7.245
130 H ILE 18 H ILE 18 6.383 -1.904 4.324
131 HA ILE 18 HA ILE 18 3.521 -2.243 4.915
132 HB ILE 18 HB ILE 18 5.132 -3.124 2.518
133 HG12 ILE 18 1HG1 ILE 18 2.691 -1.372 2.590
134 HG13 ILE 18 2HG1 ILE 18 4.328 -0.733 2.667
135 HG21 ILE 18 1HG2 ILE 18 3.596 -4.892 3.068
136 HG22 ILE 18 2HG2 ILE 18 3.040 -4.046 1.622
137 HG23 ILE 18 3HG2 ILE 18 2.264 -3.740 3.176
138 HD11 ILE 18 1HD1 ILE 18 3.429 -0.631 0.408
139 HD12 ILE 18 2HD1 ILE 18 3.183 -2.380 0.423
140 HD13 ILE 18 3HD1 ILE 18 4.818 -1.716 0.493
141 H ALA 19 H ALA 19 2.782 -4.220 5.582
142 HA ALA 19 HA ALA 19 4.802 -6.215 6.297
143 HB1 ALA 19 1HB ALA 19 1.888 -6.034 7.068
144 HB2 ALA 19 2HB ALA 19 3.249 -5.519 8.064
145 HB3 ALA 19 3HB ALA 19 3.043 -7.226 7.666
146 HA PRO 20 HA PRO 20 3.471 -7.857 2.249
147 HB2 PRO 20 1HB PRO 20 5.720 -9.667 2.909
148 HB3 PRO 20 2HB PRO 20 5.395 -8.769 1.427
149 HG2 PRO 20 1HG PRO 20 7.301 -7.975 3.100
150 HG3 PRO 20 2HG PRO 20 6.265 -6.797 2.274
151 HD2 PRO 20 1HD PRO 20 6.163 -7.762 5.094
152 HD3 PRO 20 2HD PRO 20 5.896 -6.134 4.452
153 H ASP 21 H ASP 21 2.253 -9.533 1.714
154 HA ASP 21 HA ASP 21 1.387 -11.432 3.681
155 HB2 ASP 21 1HB ASP 21 -0.221 -10.644 2.075
156 HB3 ASP 21 2HB ASP 21 0.815 -11.108 0.732
157 H ASP 22 H ASP 22 3.958 -11.195 1.588
158 HA ASP 22 HA ASP 22 4.318 -13.956 0.941
159 HB2 ASP 22 1HB ASP 22 6.084 -11.534 0.635
160 HB3 ASP 22 2HB ASP 22 6.571 -13.149 0.125
161 H GLY 23 H GLY 23 4.153 -13.159 3.800
162 HA2 GLY 23 1HA GLY 23 5.073 -14.499 5.550
163 HA3 GLY 23 2HA GLY 23 6.588 -14.557 4.665
164 H SER 24 H SER 24 5.152 -11.529 4.665
165 HA SER 24 HA SER 24 5.749 -9.529 5.519
166 HB2 SER 24 1HB SER 24 5.520 -9.461 8.050
167 HB3 SER 24 2HB SER 24 4.147 -10.086 7.141
168 HG SER 24 HG SER 24 6.022 -11.964 7.931
169 H ALA 25 H ALA 25 7.864 -9.358 4.704
170 HA ALA 25 HA ALA 25 10.005 -9.901 6.618
171 HB1 ALA 25 1HB ALA 25 10.352 -10.726 4.357
172 HB2 ALA 25 2HB ALA 25 11.538 -9.485 4.761
173 HB3 ALA 25 3HB ALA 25 10.168 -9.092 3.723
174 H ASP 26 H ASP 26 7.933 -7.550 6.276
175 HA ASP 26 HA ASP 26 7.799 -5.314 6.592
176 HB2 ASP 26 1HB ASP 26 10.552 -5.656 7.797
177 HB3 ASP 26 2HB ASP 26 9.552 -4.214 7.942
178 H VAL 27 H VAL 27 7.731 -4.711 4.475
179 HA VAL 27 HA VAL 27 10.261 -4.215 3.104
180 HB VAL 27 HB VAL 27 8.549 -5.555 1.944
181 HG11 VAL 27 1HG1 VAL 27 6.944 -3.018 1.972
182 HG12 VAL 27 2HG1 VAL 27 6.553 -4.521 2.817
183 HG13 VAL 27 3HG1 VAL 27 6.549 -4.472 1.051
184 HG21 VAL 27 1HG2 VAL 27 8.619 -4.361 -0.190
185 HG22 VAL 27 2HG2 VAL 27 10.176 -4.345 0.639
186 HG23 VAL 27 3HG2 VAL 27 9.154 -2.908 0.656
187 H PHE 28 H PHE 28 10.952 -2.264 2.512
188 HA PHE 28 HA PHE 28 9.783 0.025 3.830
189 HB2 PHE 28 1HB PHE 28 12.198 -0.314 3.857
190 HB3 PHE 28 2HB PHE 28 12.242 -0.293 2.100
191 HD1 PHE 28 HD1 PHE 28 11.684 1.766 5.104
192 HD2 PHE 28 HD2 PHE 28 12.317 1.737 0.896
193 HE1 PHE 28 HE1 PHE 28 12.080 4.192 5.149
194 HE2 PHE 28 HE2 PHE 28 12.712 4.164 0.934
195 HZ PHE 28 HZ PHE 28 12.596 5.395 3.064
196 H VAL 29 H VAL 29 8.500 1.506 2.911
197 HA VAL 29 HA VAL 29 7.999 1.260 0.027
198 HB VAL 29 HB VAL 29 6.328 2.976 1.803
199 HG11 VAL 29 1HG1 VAL 29 5.700 1.240 -0.575
200 HG12 VAL 29 2HG1 VAL 29 5.927 2.988 -0.596
201 HG13 VAL 29 3HG1 VAL 29 4.557 2.286 0.266
202 HG21 VAL 29 1HG2 VAL 29 4.930 1.104 2.428
203 HG22 VAL 29 2HG2 VAL 29 6.572 0.882 3.037
204 HG23 VAL 29 3HG2 VAL 29 6.030 -0.011 1.614
205 H HIS 30 H HIS 30 8.097 2.992 -1.340
206 HA HIS 30 HA HIS 30 8.904 5.588 -0.246
207 HB2 HIS 30 1HB HIS 30 10.917 4.368 -1.060
208 HB3 HIS 30 2HB HIS 30 10.170 4.246 -2.648
209 HD1 HIS 30 HD1 HIS 30 11.224 5.836 -4.185
210 HD2 HIS 30 HD2 HIS 30 10.896 7.399 -0.343
211 HE1 HIS 30 HE1 HIS 30 12.209 8.156 -4.305
212 HE2 HIS 30 HE2 HIS 30 12.187 8.990 -1.927
213 H TYR 31 H TYR 31 7.743 7.200 -1.062
214 HA TYR 31 HA TYR 31 5.342 6.676 -2.313
215 HB2 TYR 31 1HB TYR 31 4.958 9.021 -2.347
216 HB3 TYR 31 2HB TYR 31 5.928 8.684 -0.920
217 HD1 TYR 31 HD1 TYR 31 5.644 10.617 -3.897
218 HD2 TYR 31 HD2 TYR 31 8.460 9.094 -1.098
219 HE1 TYR 31 HE1 TYR 31 7.280 12.294 -4.637
220 HE2 TYR 31 HE2 TYR 31 10.100 10.766 -1.827
221 HH TYR 31 HH TYR 31 10.562 12.128 -3.855
222 H SER 32 H SER 32 8.386 7.485 -3.829
223 HA SER 32 HA SER 32 7.329 8.332 -6.312
224 HB2 SER 32 1HB SER 32 10.044 7.122 -5.739
225 HB3 SER 32 2HB SER 32 9.608 8.120 -7.129
226 HG SER 32 HG SER 32 9.315 9.864 -5.765
227 H GLU 33 H GLU 33 7.804 5.235 -4.895
228 HA GLU 33 HA GLU 33 7.646 3.869 -7.459
229 HB2 GLU 33 1HB GLU 33 8.210 3.005 -4.649
230 HB3 GLU 33 2HB GLU 33 7.702 1.823 -5.844
231 HG2 GLU 33 1HG GLU 33 10.137 1.928 -5.593
232 HG3 GLU 33 2HG GLU 33 9.610 2.326 -7.224
233 H ILE 34 H ILE 34 5.551 5.122 -5.193
234 HA ILE 34 HA ILE 34 3.583 3.062 -5.192
235 HB ILE 34 HB ILE 34 3.353 5.974 -4.445
236 HG12 ILE 34 1HG1 ILE 34 3.613 3.474 -2.761
237 HG13 ILE 34 2HG1 ILE 34 4.862 4.690 -3.002
238 HG21 ILE 34 1HG2 ILE 34 1.392 3.724 -4.020
239 HG22 ILE 34 2HG2 ILE 34 1.178 5.111 -5.090
240 HG23 ILE 34 3HG2 ILE 34 1.250 5.347 -3.341
241 HD11 ILE 34 1HD1 ILE 34 3.810 4.987 -0.857
242 HD12 ILE 34 2HD1 ILE 34 2.223 5.086 -1.620
243 HD13 ILE 34 3HD1 ILE 34 3.418 6.349 -1.907
244 H GLN 35 H GLN 35 2.072 2.638 -6.563
245 HA GLN 35 HA GLN 35 1.604 4.460 -8.821
246 HB2 GLN 35 1HB GLN 35 1.010 1.502 -8.585
247 HB3 GLN 35 2HB GLN 35 0.829 2.488 -10.029
248 HG2 GLN 35 1HG GLN 35 3.437 1.976 -8.631
249 HG3 GLN 35 2HG GLN 35 2.853 1.069 -10.023
250 HE21 GLN 35 1HE2 GLN 35 5.217 2.798 -9.629
251 HE22 GLN 35 2HE2 GLN 35 5.134 3.975 -10.888
252 H GLY 36 H GLY 36 0.087 5.760 -7.753
253 HA2 GLY 36 1HA GLY 36 -2.093 4.416 -6.339
254 HA3 GLY 36 2HA GLY 36 -1.662 6.112 -6.197
255 H ASN 37 H ASN 37 -3.969 6.406 -6.394
256 HA ASN 37 HA ASN 37 -4.935 6.245 -9.169
257 HB2 ASN 37 1HB ASN 37 -7.229 6.412 -8.098
258 HB3 ASN 37 2HB ASN 37 -6.353 4.920 -7.782
259 HD21 ASN 37 1HD2 ASN 37 -7.568 4.521 -5.939
260 HD22 ASN 37 2HD2 ASN 37 -7.320 5.401 -4.469
261 H GLY 38 H GLY 38 -3.262 8.312 -8.503
262 HA2 GLY 38 1HA GLY 38 -3.754 10.620 -9.296
263 HA3 GLY 38 2HA GLY 38 -5.093 10.610 -8.155
264 H PHE 39 H PHE 39 -3.471 9.110 -6.201
265 HA PHE 39 HA PHE 39 -1.508 11.157 -5.425
266 HB2 PHE 39 1HB PHE 39 -3.458 9.701 -3.628
267 HB3 PHE 39 2HB PHE 39 -2.108 10.664 -3.043
268 HD1 PHE 39 HD1 PHE 39 -5.495 10.699 -4.238
269 HD2 PHE 39 HD2 PHE 39 -2.070 13.121 -3.528
270 HE1 PHE 39 HE1 PHE 39 -6.910 12.709 -4.288
271 HE2 PHE 39 HE2 PHE 39 -3.481 15.136 -3.577
272 HZ PHE 39 HZ PHE 39 -5.904 14.931 -3.957
273 H ARG 40 H ARG 40 0.407 10.392 -4.631
274 HA ARG 40 HA ARG 40 0.804 7.498 -4.758
275 HB2 ARG 40 1HB ARG 40 2.814 9.751 -4.581
276 HB3 ARG 40 2HB ARG 40 3.217 8.044 -4.708
277 HG2 ARG 40 1HG ARG 40 2.097 7.950 -6.884
278 HG3 ARG 40 2HG ARG 40 1.727 9.669 -6.756
279 HD2 ARG 40 1HD ARG 40 4.153 10.141 -6.643
280 HD3 ARG 40 2HD ARG 40 4.468 8.422 -6.883
281 HE ARG 40 HE ARG 40 2.787 9.414 -8.932
282 HH11 ARG 40 1HH1 ARG 40 6.120 9.493 -7.867
283 HH12 ARG 40 2HH1 ARG 40 6.756 9.714 -9.463
284 HH21 ARG 40 1HH2 ARG 40 3.623 9.720 -11.032
285 HH22 ARG 40 2HH2 ARG 40 5.336 9.866 -11.258
286 H THR 41 H THR 41 -0.603 7.639 -2.745
287 HA THR 41 HA THR 41 1.144 7.725 -0.400
288 HB THR 41 HB THR 41 -0.820 8.698 0.889
289 HG1 THR 41 HG1 THR 41 -1.861 10.118 -1.101
290 HG21 THR 41 1HG2 THR 41 0.515 10.430 -1.190
291 HG22 THR 41 2HG2 THR 41 1.176 10.006 0.390
292 HG23 THR 41 3HG2 THR 41 -0.270 11.011 0.279
293 H LEU 42 H LEU 42 0.373 6.476 1.378
294 HA LEU 42 HA LEU 42 -1.637 4.460 0.658
295 HB2 LEU 42 1HB LEU 42 0.990 4.100 2.090
296 HB3 LEU 42 2HB LEU 42 -0.276 2.888 2.092
297 HG LEU 42 HG LEU 42 1.130 3.912 -0.369
298 HD11 LEU 42 1HD1 LEU 42 2.248 1.767 -0.412
299 HD12 LEU 42 2HD1 LEU 42 1.439 1.293 1.082
300 HD13 LEU 42 3HD1 LEU 42 2.606 2.616 1.092
301 HD21 LEU 42 1HD2 LEU 42 0.036 1.961 -1.445
302 HD22 LEU 42 2HD2 LEU 42 -1.099 3.193 -0.897
303 HD23 LEU 42 3HD2 LEU 42 -0.890 1.711 0.038
304 H GLU 43 H GLU 43 -2.728 3.498 2.468
305 HA GLU 43 HA GLU 43 -2.920 5.334 4.749
306 HB2 GLU 43 1HB GLU 43 -4.970 3.440 3.592
307 HB3 GLU 43 2HB GLU 43 -5.202 4.393 5.051
308 HG2 GLU 43 1HG GLU 43 -4.833 6.442 3.672
309 HG3 GLU 43 2HG GLU 43 -4.841 5.405 2.246
310 H GLU 44 H GLU 44 -2.809 4.533 6.787
311 HA GLU 44 HA GLU 44 -1.230 2.246 7.156
312 HB2 GLU 44 1HB GLU 44 -1.293 4.239 8.634
313 HB3 GLU 44 2HB GLU 44 -2.878 3.736 9.191
314 HG2 GLU 44 1HG GLU 44 -1.973 1.761 10.172
315 HG3 GLU 44 2HG GLU 44 -0.389 2.088 9.479
316 H ASN 45 H ASN 45 -1.694 0.204 7.539
317 HA ASN 45 HA ASN 45 -2.800 -1.731 7.935
318 HB2 ASN 45 1HB ASN 45 -4.947 0.098 8.995
319 HB3 ASN 45 2HB ASN 45 -5.108 -1.652 8.973
320 HD21 ASN 45 1HD2 ASN 45 -3.662 1.063 10.475
321 HD22 ASN 45 2HD2 ASN 45 -2.900 0.218 11.775
322 H GLN 46 H GLN 46 -2.959 -0.180 5.442
323 HA GLN 46 HA GLN 46 -5.488 -1.176 4.347
324 HB2 GLN 46 1HB GLN 46 -4.935 1.179 3.918
325 HB3 GLN 46 2HB GLN 46 -3.440 0.684 3.141
326 HG2 GLN 46 1HG GLN 46 -4.658 -0.414 1.387
327 HG3 GLN 46 2HG GLN 46 -6.187 -0.074 2.190
328 HE21 GLN 46 1HE2 GLN 46 -3.554 1.236 0.380
329 HE22 GLN 46 2HE2 GLN 46 -4.313 2.731 -0.032
330 H LYS 47 H LYS 47 -5.565 -2.692 2.782
331 HA LYS 47 HA LYS 47 -3.385 -4.436 2.367
332 HB2 LYS 47 1HB LYS 47 -5.859 -4.971 2.143
333 HB3 LYS 47 2HB LYS 47 -5.812 -4.133 0.600
334 HG2 LYS 47 1HG LYS 47 -5.641 -6.467 0.190
335 HG3 LYS 47 2HG LYS 47 -4.079 -5.729 -0.159
336 HD2 LYS 47 1HD LYS 47 -3.233 -6.460 2.004
337 HD3 LYS 47 2HD LYS 47 -4.807 -7.166 2.391
338 HE2 LYS 47 1HE LYS 47 -4.583 -8.679 0.476
339 HE3 LYS 47 2HE LYS 47 -3.006 -7.983 0.117
340 HZ1 LYS 47 1HZ LYS 47 -3.732 -9.433 2.601
341 HZ2 LYS 47 2HZ LYS 47 -2.220 -8.760 2.267
342 HZ3 LYS 47 3HZ LYS 47 -2.796 -10.048 1.336
343 H VAL 48 H VAL 48 -2.014 -4.650 0.574
344 HA VAL 48 HA VAL 48 -2.091 -2.607 -1.483
345 HB VAL 48 HB VAL 48 -1.008 -1.527 0.468
346 HG11 VAL 48 1HG1 VAL 48 1.082 -3.657 0.103
347 HG12 VAL 48 2HG1 VAL 48 -0.018 -3.495 1.471
348 HG13 VAL 48 3HG1 VAL 48 1.209 -2.262 1.174
349 HG21 VAL 48 1HG2 VAL 48 -0.439 -0.790 -1.772
350 HG22 VAL 48 2HG2 VAL 48 0.822 -2.018 -1.871
351 HG23 VAL 48 3HG2 VAL 48 0.967 -0.697 -0.711
352 H GLU 49 H GLU 49 -0.677 -3.015 -3.207
353 HA GLU 49 HA GLU 49 0.649 -5.639 -3.186
354 HB2 GLU 49 1HB GLU 49 -1.354 -5.613 -4.618
355 HB3 GLU 49 2HB GLU 49 -0.704 -4.240 -5.494
356 HG2 GLU 49 1HG GLU 49 1.126 -5.565 -6.304
357 HG3 GLU 49 2HG GLU 49 0.598 -6.941 -5.338
358 H PHE 50 H PHE 50 2.653 -5.740 -4.329
359 HA PHE 50 HA PHE 50 3.835 -3.379 -5.417
360 HB2 PHE 50 1HB PHE 50 5.590 -3.180 -3.610
361 HB3 PHE 50 2HB PHE 50 3.983 -2.633 -3.155
362 HD1 PHE 50 HD1 PHE 50 2.566 -4.046 -1.700
363 HD2 PHE 50 HD2 PHE 50 6.646 -4.980 -2.474
364 HE1 PHE 50 HE1 PHE 50 2.586 -5.545 0.241
365 HE2 PHE 50 HE2 PHE 50 6.669 -6.483 -0.528
366 HZ PHE 50 HZ PHE 50 4.639 -6.766 0.831
367 H GLU 51 H GLU 51 6.287 -3.706 -5.583
368 HA GLU 51 HA GLU 51 6.891 -6.557 -5.979
369 HB2 GLU 51 1HB GLU 51 6.615 -5.244 -8.099
370 HB3 GLU 51 2HB GLU 51 7.970 -4.244 -7.594
371 HG2 GLU 51 1HG GLU 51 9.424 -6.180 -7.597
372 HG3 GLU 51 2HG GLU 51 8.073 -7.210 -8.058
373 H ILE 52 H ILE 52 8.402 -7.200 -4.599
374 HA ILE 52 HA ILE 52 9.818 -5.275 -3.042
375 HB ILE 52 HB ILE 52 10.029 -8.281 -3.085
376 HG12 ILE 52 1HG1 ILE 52 8.665 -6.376 -1.177
377 HG13 ILE 52 2HG1 ILE 52 7.851 -7.386 -2.364
378 HG21 ILE 52 1HG2 ILE 52 11.221 -8.051 -0.957
379 HG22 ILE 52 2HG2 ILE 52 11.189 -6.297 -1.140
380 HG23 ILE 52 3HG2 ILE 52 12.100 -7.284 -2.283
381 HD11 ILE 52 1HD1 ILE 52 9.449 -8.366 -0.012
382 HD12 ILE 52 2HD1 ILE 52 8.616 -9.378 -1.195
383 HD13 ILE 52 3HD1 ILE 52 7.690 -8.318 -0.131
384 H GLY 53 H GLY 53 11.677 -4.412 -3.408
385 HA2 GLY 53 1HA GLY 53 13.636 -5.856 -5.078
386 HA3 GLY 53 2HA GLY 53 13.404 -4.116 -5.204
387 H GLU 54 H GLU 54 15.561 -3.707 -4.629
388 HA GLU 54 HA GLU 54 16.218 -4.363 -1.843
389 HB2 GLU 54 1HB GLU 54 18.567 -4.051 -2.455
390 HB3 GLU 54 2HB GLU 54 17.806 -5.289 -3.442
391 HG2 GLU 54 1HG GLU 54 17.617 -3.752 -5.291
392 HG3 GLU 54 2HG GLU 54 18.267 -2.445 -4.305
393 H GLY 55 H GLY 55 16.193 -2.778 -0.441
394 HA2 GLY 55 1HA GLY 55 16.238 -0.012 -1.431
395 HA3 GLY 55 2HA GLY 55 15.602 -0.536 0.124
396 H ALA 56 H ALA 56 16.936 1.183 0.995
397 HA ALA 56 HA ALA 56 19.782 0.994 0.832
398 HB1 ALA 56 1HB ALA 56 18.059 2.543 2.759
399 HB2 ALA 56 2HB ALA 56 18.655 3.128 1.205
400 HB3 ALA 56 3HB ALA 56 19.791 2.765 2.505
401 H LYS 57 H LYS 57 17.330 -0.051 3.138
402 HA LYS 57 HA LYS 57 19.400 -1.576 4.549
403 HB2 LYS 57 1HB LYS 57 17.368 0.269 5.785
404 HB3 LYS 57 2HB LYS 57 18.152 -1.009 6.700
405 HG2 LYS 57 1HG LYS 57 19.617 1.192 5.266
406 HG3 LYS 57 2HG LYS 57 19.193 1.221 6.979
407 HD2 LYS 57 1HD LYS 57 20.484 -0.871 7.288
408 HD3 LYS 57 2HD LYS 57 20.974 -0.785 5.596
409 HE2 LYS 57 1HE LYS 57 22.721 0.097 7.030
410 HE3 LYS 57 2HE LYS 57 22.045 1.376 6.026
411 HZ1 LYS 57 1HZ LYS 57 20.741 2.132 7.892
412 HZ2 LYS 57 2HZ LYS 57 22.372 2.079 8.327
413 HZ3 LYS 57 3HZ LYS 57 21.319 0.871 8.862
414 H GLY 58 H GLY 58 17.694 -2.634 2.646
415 HA2 GLY 58 1HA GLY 58 16.870 -4.974 3.385
416 HA3 GLY 58 2HA GLY 58 15.633 -4.031 4.205
417 HA PRO 59 HA PRO 59 14.121 -5.092 -0.064
418 HB2 PRO 59 1HB PRO 59 11.620 -5.781 0.778
419 HB3 PRO 59 2HB PRO 59 12.956 -6.924 0.650
420 HG2 PRO 59 1HG PRO 59 11.881 -5.524 3.054
421 HG3 PRO 59 2HG PRO 59 12.429 -7.199 2.885
422 HD2 PRO 59 1HD PRO 59 13.955 -5.279 4.018
423 HD3 PRO 59 2HD PRO 59 14.647 -6.626 3.095
424 H GLN 60 H GLN 60 13.037 -3.675 -1.334
425 HA GLN 60 HA GLN 60 11.529 -1.551 0.041
426 HB2 GLN 60 1HB GLN 60 12.217 0.029 -1.587
427 HB3 GLN 60 2HB GLN 60 13.671 -0.831 -1.103
428 HG2 GLN 60 1HG GLN 60 13.609 -2.159 -3.111
429 HG3 GLN 60 2HG GLN 60 12.072 -1.435 -3.578
430 HE21 GLN 60 1HE2 GLN 60 13.001 1.210 -2.590
431 HE22 GLN 60 2HE2 GLN 60 14.054 1.800 -3.822
432 H ALA 61 H ALA 61 9.588 -0.910 -0.804
433 HA ALA 61 HA ALA 61 8.291 -2.840 -2.542
434 HB1 ALA 61 1HB ALA 61 7.145 -2.083 -0.512
435 HB2 ALA 61 2HB ALA 61 6.231 -1.661 -1.963
436 HB3 ALA 61 3HB ALA 61 7.165 -0.426 -1.119
437 H GLN 62 H GLN 62 8.509 -2.594 -4.644
438 HA GLN 62 HA GLN 62 8.586 0.118 -5.781
439 HB2 GLN 62 1HB GLN 62 9.280 -2.482 -7.147
440 HB3 GLN 62 2HB GLN 62 9.621 -0.855 -7.720
441 HG2 GLN 62 1HG GLN 62 11.182 -0.529 -5.880
442 HG3 GLN 62 2HG GLN 62 10.829 -2.151 -5.287
443 HE21 GLN 62 1HE2 GLN 62 11.471 -3.941 -6.554
444 HE22 GLN 62 2HE2 GLN 62 12.770 -3.810 -7.683
445 H GLN 63 H GLN 63 7.198 0.640 -7.507
446 HA GLN 63 HA GLN 63 5.181 0.726 -8.546
447 HB2 GLN 63 1HB GLN 63 5.810 -2.208 -8.854
448 HB3 GLN 63 2HB GLN 63 4.439 -1.438 -9.630
449 HG2 GLN 63 1HG GLN 63 6.097 -1.530 -11.269
450 HG3 GLN 63 2HG GLN 63 6.109 0.137 -10.698
451 HE21 GLN 63 1HE2 GLN 63 7.902 0.920 -9.652
452 HE22 GLN 63 2HE2 GLN 63 9.390 0.049 -9.546
453 H VAL 64 H VAL 64 4.640 1.058 -6.118
454 HA VAL 64 HA VAL 64 3.236 -1.115 -4.836
455 HB VAL 64 HB VAL 64 3.357 1.718 -3.847
456 HG11 VAL 64 1HG1 VAL 64 3.324 0.611 -1.644
457 HG12 VAL 64 2HG1 VAL 64 3.155 -0.942 -2.461
458 HG13 VAL 64 3HG1 VAL 64 1.890 0.277 -2.613
459 HG21 VAL 64 1HG2 VAL 64 5.629 1.119 -4.437
460 HG22 VAL 64 2HG2 VAL 64 5.482 -0.397 -3.546
461 HG23 VAL 64 3HG2 VAL 64 5.443 1.141 -2.683
462 H HIS 65 H HIS 65 1.253 -1.564 -5.505
463 HA HIS 65 HA HIS 65 -0.575 0.623 -6.223
464 HB2 HIS 65 1HB HIS 65 -0.631 -2.339 -6.765
465 HB3 HIS 65 2HB HIS 65 -2.046 -1.327 -6.992
466 HD1 HIS 65 HD1 HIS 65 -2.241 -0.127 -9.173
467 HD2 HIS 65 HD2 HIS 65 1.566 -1.652 -8.521
468 HE1 HIS 65 HE1 HIS 65 -1.016 0.186 -11.343
469 HE2 HIS 65 HE2 HIS 65 1.219 -0.928 -10.984
470 H ALA 66 H ALA 66 -2.279 1.107 -4.963
471 HA ALA 66 HA ALA 66 -2.419 -0.160 -2.376
472 HB1 ALA 66 1HB ALA 66 -2.604 2.274 -2.594
473 HB2 ALA 66 2HB ALA 66 -4.031 1.571 -1.831
474 HB3 ALA 66 3HB ALA 66 -4.091 2.073 -3.521
475 H LEU 67 H LEU 67 -3.766 -1.706 -1.794
476 HA LEU 67 HA LEU 67 -5.820 -2.554 -3.708
477 HB2 LEU 67 1HB LEU 67 -4.538 -4.009 -1.396
478 HB3 LEU 67 2HB LEU 67 -5.777 -4.684 -2.430
479 HG LEU 67 HG LEU 67 -2.950 -3.974 -3.184
480 HD11 LEU 67 1HD1 LEU 67 -2.867 -6.388 -3.751
481 HD12 LEU 67 2HD1 LEU 67 -4.485 -6.565 -3.074
482 HD13 LEU 67 3HD1 LEU 67 -3.143 -6.076 -2.038
483 HD21 LEU 67 1HD2 LEU 67 -5.205 -4.887 -4.964
484 HD22 LEU 67 2HD2 LEU 67 -3.511 -4.778 -5.436
485 HD23 LEU 67 3HD2 LEU 67 -4.404 -3.317 -5.013
486 H GLY 68 H GLY 68 -7.497 -3.990 -2.144
487 HA2 GLY 68 1HA GLY 68 -8.296 -2.406 0.154
488 HA3 GLY 68 2HA GLY 68 -9.409 -2.380 -1.207
489 H GLY 69 H GLY 69 -10.428 -3.299 1.046
490 HA2 GLY 69 1HA GLY 69 -10.082 -6.087 1.487
491 HA3 GLY 69 2HA GLY 69 -11.427 -5.108 2.055
492 H GLU 70 H GLU 70 -11.510 -7.793 0.995
493 HA GLU 70 HA GLU 70 -12.703 -7.505 -1.649
494 HB2 GLU 70 1HB GLU 70 -12.122 -9.945 0.035
495 HB3 GLU 70 2HB GLU 70 -12.796 -9.985 -1.587
496 HG2 GLU 70 1HG GLU 70 -10.801 -9.109 -2.527
497 HG3 GLU 70 2HG GLU 70 -10.140 -8.748 -0.933
498 H ASN 71 H ASN 71 -14.801 -7.196 -1.879
499 HA ASN 71 HA ASN 71 -16.616 -8.252 0.183
500 HB2 ASN 71 1HB ASN 71 -16.481 -5.767 0.216
501 HB3 ASN 71 2HB ASN 71 -17.015 -5.739 -1.461
502 HD21 ASN 71 1HD2 ASN 71 -18.826 -4.521 -0.922
503 HD22 ASN 71 2HD2 ASN 71 -20.186 -5.198 -0.098
504 H LEU 72 H LEU 72 -16.091 -10.023 -1.596
505 HA LEU 72 HA LEU 72 -17.834 -9.849 -3.896
506 HB2 LEU 72 1HB LEU 72 -16.174 -12.109 -2.780
507 HB3 LEU 72 2HB LEU 72 -17.200 -12.280 -4.186
508 HG LEU 72 HG LEU 72 -15.819 -10.380 -5.215
509 HD11 LEU 72 1HD1 LEU 72 -13.942 -11.189 -3.000
510 HD12 LEU 72 2HD1 LEU 72 -14.729 -9.620 -3.172
511 HD13 LEU 72 3HD1 LEU 72 -13.545 -10.149 -4.367
512 HD21 LEU 72 1HD2 LEU 72 -14.545 -13.052 -4.657
513 HD22 LEU 72 2HD2 LEU 72 -14.091 -11.945 -5.953
514 HD23 LEU 72 3HD2 LEU 72 -15.689 -12.691 -5.949
515 H TYR 73 H TYR 73 -19.940 -9.817 -3.386
516 HA TYR 73 HA TYR 73 -20.900 -11.914 -1.558
517 HB2 TYR 73 1HB TYR 73 -21.149 -9.637 -0.608
518 HB3 TYR 73 2HB TYR 73 -22.132 -9.185 -1.997
519 HD1 TYR 73 HD1 TYR 73 -21.992 -11.383 0.974
520 HD2 TYR 73 HD2 TYR 73 -24.443 -9.736 -2.088
521 HE1 TYR 73 HE1 TYR 73 -23.991 -12.208 2.137
522 HE2 TYR 73 HE2 TYR 73 -26.450 -10.557 -0.929
523 HH TYR 73 HH TYR 73 -26.417 -11.647 2.256
524 H PHE 74 H PHE 74 -21.613 -13.454 -2.883
525 HA PHE 74 HA PHE 74 -23.393 -12.689 -5.086
526 HB2 PHE 74 1HB PHE 74 -21.515 -14.201 -5.647
527 HB3 PHE 74 2HB PHE 74 -22.115 -15.368 -4.473
528 HD1 PHE 74 HD1 PHE 74 -22.762 -13.764 -7.714
529 HD2 PHE 74 HD2 PHE 74 -23.967 -16.791 -4.977
530 HE1 PHE 74 HE1 PHE 74 -24.180 -14.770 -9.454
531 HE2 PHE 74 HE2 PHE 74 -25.388 -17.799 -6.712
532 HZ PHE 74 HZ PHE 74 -25.495 -16.790 -8.954
533 H GLN 75 H GLN 75 -25.429 -12.474 -4.350
534 HA GLN 75 HA GLN 75 -26.422 -14.185 -2.256
535 HB2 GLN 75 1HB GLN 75 -28.588 -12.984 -2.637
536 HB3 GLN 75 2HB GLN 75 -27.239 -11.948 -2.207
537 HG2 GLN 75 1HG GLN 75 -26.986 -11.296 -4.541
538 HG3 GLN 75 2HG GLN 75 -28.330 -12.349 -4.984
539 HE21 GLN 75 1HE2 GLN 75 -28.014 -9.442 -5.258
540 HE22 GLN 75 2HE2 GLN 75 -29.357 -8.742 -4.424
541 H GLY 76 H GLY 76 -27.236 -16.108 -2.542
542 HA2 GLY 76 1HA GLY 76 -28.255 -16.809 -5.223
543 HA3 GLY 76 2HA GLY 76 -27.271 -17.905 -4.264
544 H HIS 77 H HIS 77 -29.803 -18.544 -5.281
545 HA HIS 77 HA HIS 77 -31.767 -18.210 -3.199
546 HB2 HIS 77 1HB HIS 77 -31.830 -19.883 -5.719
547 HB3 HIS 77 2HB HIS 77 -33.202 -19.610 -4.652
548 HD1 HIS 77 HD1 HIS 77 -31.999 -18.480 -7.743
549 HD2 HIS 77 HD2 HIS 77 -33.516 -16.542 -4.393
550 HE1 HIS 77 HE1 HIS 77 -32.742 -16.221 -8.547
551 HE2 HIS 77 HE2 HIS 77 -33.473 -15.002 -6.469
552 H HIS 78 H HIS 78 -29.269 -20.411 -3.892
553 HA HIS 78 HA HIS 78 -30.198 -22.100 -1.691
554 HB2 HIS 78 1HB HIS 78 -29.329 -24.130 -2.894
555 HB3 HIS 78 2HB HIS 78 -30.781 -23.431 -3.593
556 HD1 HIS 78 HD1 HIS 78 -30.685 -22.762 -6.013
557 HD2 HIS 78 HD2 HIS 78 -26.940 -23.676 -4.455
558 HE1 HIS 78 HE1 HIS 78 -29.125 -22.825 -7.986
559 HE2 HIS 78 HE2 HIS 78 -26.839 -23.188 -6.989
560 H HIS 79 H HIS 79 -28.530 -20.156 -1.189
561 HA HIS 79 HA HIS 79 -25.774 -20.815 -1.681
562 HB2 HIS 79 1HB HIS 79 -26.644 -18.469 -1.518
563 HB3 HIS 79 2HB HIS 79 -26.909 -18.735 0.201
564 HD1 HIS 79 HD1 HIS 79 -24.947 -18.347 1.731
565 HD2 HIS 79 HD2 HIS 79 -23.847 -18.520 -2.277
566 HE1 HIS 79 HE1 HIS 79 -22.528 -17.663 1.663
567 HE2 HIS 79 HE2 HIS 79 -21.932 -17.623 -0.785
568 H HIS 80 H HIS 80 -26.320 -23.015 -0.658
569 HA HIS 80 HA HIS 80 -25.930 -24.545 0.964
570 HB2 HIS 80 1HB HIS 80 -23.672 -23.619 0.768
571 HB3 HIS 80 2HB HIS 80 -24.054 -22.400 1.977
572 HD1 HIS 80 HD1 HIS 80 -24.101 -26.211 1.804
573 HD2 HIS 80 HD2 HIS 80 -23.166 -23.116 4.419
574 HE1 HIS 80 HE1 HIS 80 -23.285 -27.323 3.907
575 HE2 HIS 80 HE2 HIS 80 -22.800 -25.436 5.504
576 H HIS 81 H HIS 81 -28.211 -24.030 1.627
577 HA HIS 81 HA HIS 81 -28.125 -23.468 4.512
578 HB2 HIS 81 1HB HIS 81 -30.221 -22.552 2.545
579 HB3 HIS 81 2HB HIS 81 -30.519 -22.628 4.277
580 HD1 HIS 81 HD1 HIS 81 -28.914 -21.067 5.775
581 HD2 HIS 81 HD2 HIS 81 -28.962 -20.282 1.694
582 HE1 HIS 81 HE1 HIS 81 -27.920 -18.775 5.516
583 HE2 HIS 81 HE2 HIS 81 -28.073 -18.270 3.055
584 H HIS 82 H HIS 82 -29.199 -25.415 1.903
585 HA HIS 82 HA HIS 82 -30.352 -27.292 3.839
586 HB2 HIS 82 1HB HIS 82 -31.414 -26.652 1.076
587 HB3 HIS 82 2HB HIS 82 -31.951 -28.016 2.050
588 HD1 HIS 82 HD1 HIS 82 -32.967 -24.747 1.218
589 HD2 HIS 82 HD2 HIS 82 -32.876 -26.919 4.760
590 HE1 HIS 82 HE1 HIS 82 -34.591 -23.601 2.754
591 HE2 HIS 82 HE2 HIS 82 -34.652 -25.039 4.821
Start of MODEL 5
1 H2 MET 1 2H MET 1 5.573 -10.590 -7.986
2 H MET 1 1H MET 1 4.043 -10.301 -8.642
3 H3 MET 1 3H MET 1 5.382 -9.443 -9.212
4 HA MET 1 HA MET 1 5.658 -8.396 -7.060
5 HB2 MET 1 1HB MET 1 2.942 -8.135 -8.357
6 HB3 MET 1 2HB MET 1 3.512 -7.050 -7.097
7 HG2 MET 1 1HG MET 1 5.378 -6.380 -8.520
8 HG3 MET 1 2HG MET 1 4.805 -7.462 -9.784
9 HE1 MET 1 1HE MET 1 5.410 -4.402 -10.307
10 HE2 MET 1 2HE MET 1 4.008 -3.929 -11.265
11 HE3 MET 1 3HE MET 1 4.787 -5.485 -11.552
12 H ALA 2 H ALA 2 5.425 -8.575 -4.955
13 HA ALA 2 HA ALA 2 3.679 -10.611 -3.872
14 HB1 ALA 2 1HB ALA 2 4.793 -10.114 -1.750
15 HB2 ALA 2 2HB ALA 2 5.627 -8.754 -2.503
16 HB3 ALA 2 3HB ALA 2 5.967 -10.403 -3.034
17 H GLN 3 H GLN 3 2.452 -10.054 -1.858
18 HA GLN 3 HA GLN 3 1.326 -7.347 -1.982
19 HB2 GLN 3 1HB GLN 3 -0.209 -9.907 -1.533
20 HB3 GLN 3 2HB GLN 3 -0.880 -8.288 -1.417
21 HG2 GLN 3 1HG GLN 3 -0.321 -7.932 -3.790
22 HG3 GLN 3 2HG GLN 3 0.225 -9.605 -3.878
23 HE21 GLN 3 1HE2 GLN 3 -1.882 -8.317 -5.362
24 HE22 GLN 3 2HE2 GLN 3 -3.340 -9.176 -4.995
25 H GLY 4 H GLY 4 0.072 -6.897 0.090
26 HA2 GLY 4 1HA GLY 4 0.522 -8.346 2.434
27 HA3 GLY 4 2HA GLY 4 1.824 -7.180 2.268
28 H THR 5 H THR 5 1.088 -6.222 4.184
29 HA THR 5 HA THR 5 -1.127 -4.348 3.694
30 HB THR 5 HB THR 5 -0.491 -5.624 6.364
31 HG1 THR 5 HG1 THR 5 -1.554 -6.953 4.605
32 HG21 THR 5 1HG2 THR 5 -2.803 -3.892 5.495
33 HG22 THR 5 2HG2 THR 5 -1.441 -3.357 6.480
34 HG23 THR 5 3HG2 THR 5 -2.556 -4.574 7.103
35 H VAL 6 H VAL 6 -0.311 -2.355 3.649
36 HA VAL 6 HA VAL 6 2.238 -1.685 4.632
37 HB VAL 6 HB VAL 6 1.516 -0.256 2.943
38 HG11 VAL 6 1HG1 VAL 6 -1.032 0.185 4.470
39 HG12 VAL 6 2HG1 VAL 6 -0.842 -0.778 3.004
40 HG13 VAL 6 3HG1 VAL 6 -0.593 0.967 2.953
41 HG21 VAL 6 1HG2 VAL 6 2.610 0.979 4.742
42 HG22 VAL 6 2HG2 VAL 6 1.040 1.276 5.496
43 HG23 VAL 6 3HG2 VAL 6 1.410 1.977 3.919
44 H LYS 7 H LYS 7 2.848 -1.606 6.639
45 HA LYS 7 HA LYS 7 0.982 -1.817 8.761
46 HB2 LYS 7 1HB LYS 7 2.949 -1.838 10.220
47 HB3 LYS 7 2HB LYS 7 3.160 -2.917 8.853
48 HG2 LYS 7 1HG LYS 7 4.626 -1.391 7.776
49 HG3 LYS 7 2HG LYS 7 4.274 -0.133 8.960
50 HD2 LYS 7 1HD LYS 7 6.411 -1.093 9.469
51 HD3 LYS 7 2HD LYS 7 5.263 -1.585 10.713
52 HE2 LYS 7 1HE LYS 7 5.021 -3.756 9.673
53 HE3 LYS 7 2HE LYS 7 6.071 -3.264 8.344
54 HZ1 LYS 7 1HZ LYS 7 7.308 -4.573 9.919
55 HZ2 LYS 7 2HZ LYS 7 6.856 -3.553 11.194
56 HZ3 LYS 7 3HZ LYS 7 7.867 -2.976 9.972
57 H TRP 8 H TRP 8 2.858 0.747 7.373
58 HA TRP 8 HA TRP 8 1.072 2.729 8.239
59 HB2 TRP 8 1HB TRP 8 2.518 4.049 9.707
60 HB3 TRP 8 2HB TRP 8 2.203 2.471 10.413
61 HD1 TRP 8 HD1 TRP 8 4.242 0.888 10.830
62 HE1 TRP 8 HE1 TRP 8 6.788 1.223 10.725
63 HE3 TRP 8 HE3 TRP 8 4.380 5.352 8.339
64 HZ2 TRP 8 HZ2 TRP 8 8.611 3.125 9.732
65 HZ3 TRP 8 HZ3 TRP 8 6.570 6.358 7.855
66 HH2 TRP 8 HH2 TRP 8 8.639 5.265 8.537
67 H PHE 9 H PHE 9 1.551 4.757 7.297
68 HA PHE 9 HA PHE 9 3.943 4.869 5.633
69 HB2 PHE 9 1HB PHE 9 2.091 3.951 4.236
70 HB3 PHE 9 2HB PHE 9 1.182 5.428 4.534
71 HD1 PHE 9 HD1 PHE 9 1.710 7.457 3.390
72 HD2 PHE 9 HD2 PHE 9 4.129 3.995 2.896
73 HE1 PHE 9 HE1 PHE 9 2.825 8.518 1.472
74 HE2 PHE 9 HE2 PHE 9 5.252 5.049 0.980
75 HZ PHE 9 HZ PHE 9 4.603 7.314 0.266
76 H ASN 10 H ASN 10 4.906 6.741 5.846
77 HA ASN 10 HA ASN 10 3.535 8.950 7.141
78 HB2 ASN 10 1HB ASN 10 5.865 8.314 7.776
79 HB3 ASN 10 2HB ASN 10 6.394 8.763 6.159
80 HD21 ASN 10 1HD2 ASN 10 5.468 9.884 9.265
81 HD22 ASN 10 2HD2 ASN 10 5.779 11.562 8.984
82 H ALA 11 H ALA 11 2.168 9.899 5.735
83 HA ALA 11 HA ALA 11 2.706 10.126 2.946
84 HB1 ALA 11 1HB ALA 11 0.601 11.341 2.838
85 HB2 ALA 11 2HB ALA 11 0.571 11.462 4.599
86 HB3 ALA 11 3HB ALA 11 0.439 9.884 3.819
87 H GLU 12 H GLU 12 3.735 11.920 5.574
88 HA GLU 12 HA GLU 12 3.749 14.523 4.397
89 HB2 GLU 12 1HB GLU 12 5.544 13.534 6.612
90 HB3 GLU 12 2HB GLU 12 5.035 15.188 6.298
91 HG2 GLU 12 1HG GLU 12 2.756 14.623 6.906
92 HG3 GLU 12 2HG GLU 12 3.232 12.948 7.174
93 H LYS 13 H LYS 13 6.241 12.120 5.090
94 HA LYS 13 HA LYS 13 8.184 13.518 3.456
95 HB2 LYS 13 1HB LYS 13 8.423 10.898 4.931
96 HB3 LYS 13 2HB LYS 13 9.746 11.843 4.262
97 HG2 LYS 13 1HG LYS 13 7.929 12.706 6.496
98 HG3 LYS 13 2HG LYS 13 9.564 12.079 6.682
99 HD2 LYS 13 1HD LYS 13 10.351 13.974 5.246
100 HD3 LYS 13 2HD LYS 13 8.718 14.633 5.342
101 HE2 LYS 13 1HE LYS 13 10.181 15.668 6.998
102 HE3 LYS 13 2HE LYS 13 8.896 14.744 7.773
103 HZ1 LYS 13 1HZ LYS 13 11.087 14.398 8.802
104 HZ2 LYS 13 2HZ LYS 13 11.667 13.755 7.351
105 HZ3 LYS 13 3HZ LYS 13 10.434 12.962 8.192
106 H GLY 14 H GLY 14 6.149 10.706 3.340
107 HA2 GLY 14 1HA GLY 14 5.370 9.789 1.314
108 HA3 GLY 14 2HA GLY 14 6.783 10.439 0.499
109 H PHE 15 H PHE 15 6.855 8.532 3.474
110 HA PHE 15 HA PHE 15 7.583 6.164 1.951
111 HB2 PHE 15 1HB PHE 15 9.658 5.771 3.092
112 HB3 PHE 15 2HB PHE 15 9.720 7.379 2.385
113 HD1 PHE 15 HD1 PHE 15 9.841 9.337 3.771
114 HD2 PHE 15 HD2 PHE 15 9.507 5.466 5.506
115 HE1 PHE 15 HE1 PHE 15 10.491 10.262 5.955
116 HE2 PHE 15 HE2 PHE 15 10.152 6.387 7.694
117 HZ PHE 15 HZ PHE 15 10.644 8.788 7.919
118 H GLY 16 H GLY 16 7.739 4.224 3.339
119 HA2 GLY 16 1HA GLY 16 6.711 4.289 6.000
120 HA3 GLY 16 2HA GLY 16 5.459 3.850 4.844
121 H PHE 17 H PHE 17 5.432 1.809 6.049
122 HA PHE 17 HA PHE 17 7.346 -0.048 4.835
123 HB2 PHE 17 1HB PHE 17 6.844 0.287 7.767
124 HB3 PHE 17 2HB PHE 17 7.230 -1.307 7.128
125 HD1 PHE 17 HD1 PHE 17 9.413 -1.771 6.177
126 HD2 PHE 17 HD2 PHE 17 8.495 2.031 7.848
127 HE1 PHE 17 HE1 PHE 17 11.810 -1.232 6.254
128 HE2 PHE 17 HE2 PHE 17 10.891 2.579 7.929
129 HZ PHE 17 HZ PHE 17 12.554 0.947 7.132
130 H ILE 18 H ILE 18 6.580 -2.079 4.454
131 HA ILE 18 HA ILE 18 3.722 -2.506 5.001
132 HB ILE 18 HB ILE 18 5.332 -3.435 2.624
133 HG12 ILE 18 1HG1 ILE 18 2.902 -1.666 2.644
134 HG13 ILE 18 2HG1 ILE 18 4.542 -1.029 2.702
135 HG21 ILE 18 1HG2 ILE 18 3.222 -4.369 1.774
136 HG22 ILE 18 2HG2 ILE 18 2.456 -3.991 3.317
137 HG23 ILE 18 3HG2 ILE 18 3.770 -5.166 3.249
138 HD11 ILE 18 1HD1 ILE 18 3.631 -0.999 0.441
139 HD12 ILE 18 2HD1 ILE 18 3.401 -2.748 0.511
140 HD13 ILE 18 3HD1 ILE 18 5.030 -2.069 0.560
141 H ALA 19 H ALA 19 3.077 -4.447 5.763
142 HA ALA 19 HA ALA 19 5.156 -6.435 6.359
143 HB1 ALA 19 1HB ALA 19 3.763 -5.724 8.254
144 HB2 ALA 19 2HB ALA 19 3.507 -7.429 7.873
145 HB3 ALA 19 3HB ALA 19 2.316 -6.225 7.375
146 HA PRO 20 HA PRO 20 3.498 -8.000 2.389
147 HB2 PRO 20 1HB PRO 20 5.714 -9.888 3.016
148 HB3 PRO 20 2HB PRO 20 5.307 -9.096 1.491
149 HG2 PRO 20 1HG PRO 20 7.334 -8.205 2.936
150 HG3 PRO 20 2HG PRO 20 6.227 -7.063 2.153
151 HD2 PRO 20 1HD PRO 20 6.394 -7.883 5.015
152 HD3 PRO 20 2HD PRO 20 6.048 -6.290 4.318
153 H ASP 21 H ASP 21 2.159 -9.607 1.925
154 HA ASP 21 HA ASP 21 1.255 -11.439 3.941
155 HB2 ASP 21 1HB ASP 21 -0.234 -10.432 2.213
156 HB3 ASP 21 2HB ASP 21 0.636 -11.326 0.974
157 H ASP 22 H ASP 22 3.752 -11.304 1.782
158 HA ASP 22 HA ASP 22 4.022 -14.080 1.105
159 HB2 ASP 22 1HB ASP 22 4.719 -12.249 -0.397
160 HB3 ASP 22 2HB ASP 22 5.930 -11.757 0.774
161 H GLY 23 H GLY 23 4.038 -13.200 3.983
162 HA2 GLY 23 1HA GLY 23 5.067 -14.461 5.731
163 HA3 GLY 23 2HA GLY 23 6.516 -14.586 4.745
164 H SER 24 H SER 24 4.964 -11.573 4.878
165 HA SER 24 HA SER 24 5.542 -9.548 5.654
166 HB2 SER 24 1HB SER 24 5.792 -9.440 8.155
167 HB3 SER 24 2HB SER 24 4.351 -10.265 7.566
168 HG SER 24 HG SER 24 6.482 -11.950 7.906
169 H ALA 25 H ALA 25 7.646 -10.226 4.260
170 HA ALA 25 HA ALA 25 10.021 -9.700 5.816
171 HB1 ALA 25 1HB ALA 25 11.153 -9.498 3.659
172 HB2 ALA 25 2HB ALA 25 9.600 -9.565 2.827
173 HB3 ALA 25 3HB ALA 25 10.187 -10.971 3.718
174 H ASP 26 H ASP 26 9.412 -7.864 6.935
175 HA ASP 26 HA ASP 26 8.037 -5.665 6.298
176 HB2 ASP 26 1HB ASP 26 10.686 -5.499 7.743
177 HB3 ASP 26 2HB ASP 26 9.314 -4.408 7.913
178 H VAL 27 H VAL 27 8.024 -4.525 4.533
179 HA VAL 27 HA VAL 27 10.564 -3.989 3.163
180 HB VAL 27 HB VAL 27 9.029 -5.453 1.938
181 HG11 VAL 27 1HG1 VAL 27 6.919 -4.569 1.052
182 HG12 VAL 27 2HG1 VAL 27 7.137 -3.124 2.040
183 HG13 VAL 27 3HG1 VAL 27 6.920 -4.698 2.812
184 HG21 VAL 27 1HG2 VAL 27 9.261 -2.735 0.678
185 HG22 VAL 27 2HG2 VAL 27 8.999 -4.261 -0.170
186 HG23 VAL 27 3HG2 VAL 27 10.512 -3.976 0.691
187 H PHE 28 H PHE 28 11.051 -1.979 2.464
188 HA PHE 28 HA PHE 28 9.703 0.214 3.785
189 HB2 PHE 28 1HB PHE 28 12.144 0.077 3.794
190 HB3 PHE 28 2HB PHE 28 12.169 0.103 2.038
191 HD1 PHE 28 HD1 PHE 28 11.543 2.095 5.059
192 HD2 PHE 28 HD2 PHE 28 11.973 2.143 0.827
193 HE1 PHE 28 HE1 PHE 28 11.728 4.547 5.110
194 HE2 PHE 28 HE2 PHE 28 12.157 4.595 0.871
195 HZ PHE 28 HZ PHE 28 12.035 5.798 3.012
196 H VAL 29 H VAL 29 8.355 1.631 2.844
197 HA VAL 29 HA VAL 29 7.888 1.333 -0.047
198 HB VAL 29 HB VAL 29 6.062 2.913 1.699
199 HG11 VAL 29 1HG1 VAL 29 5.700 2.879 -0.704
200 HG12 VAL 29 2HG1 VAL 29 4.378 2.072 0.136
201 HG13 VAL 29 3HG1 VAL 29 5.617 1.119 -0.679
202 HG21 VAL 29 1HG2 VAL 29 4.792 0.909 2.270
203 HG22 VAL 29 2HG2 VAL 29 6.408 0.887 2.977
204 HG23 VAL 29 3HG2 VAL 29 6.056 -0.092 1.552
205 H HIS 30 H HIS 30 7.793 3.124 -1.384
206 HA HIS 30 HA HIS 30 8.506 5.723 -0.249
207 HB2 HIS 30 1HB HIS 30 10.583 4.561 -0.997
208 HB3 HIS 30 2HB HIS 30 9.906 4.464 -2.618
209 HD1 HIS 30 HD1 HIS 30 10.929 6.139 -4.078
210 HD2 HIS 30 HD2 HIS 30 10.515 7.542 -0.183
211 HE1 HIS 30 HE1 HIS 30 11.843 8.487 -4.098
212 HE2 HIS 30 HE2 HIS 30 11.751 9.240 -1.694
213 H TYR 31 H TYR 31 7.468 7.375 -1.197
214 HA TYR 31 HA TYR 31 5.071 6.866 -2.471
215 HB2 TYR 31 1HB TYR 31 4.769 9.238 -2.611
216 HB3 TYR 31 2HB TYR 31 5.621 8.881 -1.115
217 HD1 TYR 31 HD1 TYR 31 8.077 9.358 -0.963
218 HD2 TYR 31 HD2 TYR 31 5.732 10.618 -4.279
219 HE1 TYR 31 HE1 TYR 31 9.826 10.966 -1.579
220 HE2 TYR 31 HE2 TYR 31 7.476 12.229 -4.908
221 HH TYR 31 HH TYR 31 9.343 13.453 -3.820
222 H SER 32 H SER 32 8.161 7.430 -3.938
223 HA SER 32 HA SER 32 7.207 8.308 -6.469
224 HB2 SER 32 1HB SER 32 9.502 8.749 -5.665
225 HB3 SER 32 2HB SER 32 9.850 7.023 -5.733
226 HG SER 32 HG SER 32 10.519 7.559 -7.665
227 H GLU 33 H GLU 33 7.561 5.241 -4.947
228 HA GLU 33 HA GLU 33 7.423 3.763 -7.448
229 HB2 GLU 33 1HB GLU 33 7.815 3.017 -4.570
230 HB3 GLU 33 2HB GLU 33 7.388 1.798 -5.758
231 HG2 GLU 33 1HG GLU 33 9.782 1.859 -5.355
232 HG3 GLU 33 2HG GLU 33 9.399 2.282 -7.020
233 H ILE 34 H ILE 34 5.315 5.039 -5.118
234 HA ILE 34 HA ILE 34 3.342 3.001 -5.109
235 HB ILE 34 HB ILE 34 3.155 5.908 -4.340
236 HG12 ILE 34 1HG1 ILE 34 3.430 3.382 -2.703
237 HG13 ILE 34 2HG1 ILE 34 4.681 4.593 -2.957
238 HG21 ILE 34 1HG2 ILE 34 0.948 5.071 -4.942
239 HG22 ILE 34 2HG2 ILE 34 1.069 5.317 -3.198
240 HG23 ILE 34 3HG2 ILE 34 1.168 3.688 -3.869
241 HD11 ILE 34 1HD1 ILE 34 3.649 4.813 -0.771
242 HD12 ILE 34 2HD1 ILE 34 2.073 5.032 -1.532
243 HD13 ILE 34 3HD1 ILE 34 3.338 6.234 -1.769
244 H GLN 35 H GLN 35 1.663 2.642 -6.350
245 HA GLN 35 HA GLN 35 1.382 4.300 -8.758
246 HB2 GLN 35 1HB GLN 35 0.622 1.415 -8.273
247 HB3 GLN 35 2HB GLN 35 0.441 2.280 -9.795
248 HG2 GLN 35 1HG GLN 35 3.036 1.743 -8.384
249 HG3 GLN 35 2HG GLN 35 2.418 0.853 -9.774
250 HE21 GLN 35 1HE2 GLN 35 4.817 2.558 -9.314
251 HE22 GLN 35 2HE2 GLN 35 4.801 3.702 -10.607
252 H GLY 36 H GLY 36 -0.020 5.797 -7.749
253 HA2 GLY 36 1HA GLY 36 -2.703 4.717 -7.169
254 HA3 GLY 36 2HA GLY 36 -2.062 6.201 -6.471
255 H ASN 37 H ASN 37 -4.476 6.314 -7.659
256 HA ASN 37 HA ASN 37 -4.148 7.171 -10.414
257 HB2 ASN 37 1HB ASN 37 -6.582 7.396 -10.444
258 HB3 ASN 37 2HB ASN 37 -6.117 5.822 -9.818
259 HD21 ASN 37 1HD2 ASN 37 -8.610 7.164 -9.475
260 HD22 ASN 37 2HD2 ASN 37 -8.828 7.411 -7.778
261 H GLY 38 H GLY 38 -2.657 8.728 -8.818
262 HA2 GLY 38 1HA GLY 38 -2.583 11.195 -9.152
263 HA3 GLY 38 2HA GLY 38 -4.214 11.218 -8.496
264 H PHE 39 H PHE 39 -3.087 8.948 -6.673
265 HA PHE 39 HA PHE 39 -1.831 10.755 -4.727
266 HB2 PHE 39 1HB PHE 39 -3.580 8.334 -4.323
267 HB3 PHE 39 2HB PHE 39 -2.597 9.013 -3.031
268 HD1 PHE 39 HD1 PHE 39 -3.104 11.202 -2.103
269 HD2 PHE 39 HD2 PHE 39 -5.570 9.440 -5.088
270 HE1 PHE 39 HE1 PHE 39 -4.895 12.798 -1.562
271 HE2 PHE 39 HE2 PHE 39 -7.364 11.037 -4.552
272 HZ PHE 39 HZ PHE 39 -7.028 12.718 -2.786
273 H ARG 40 H ARG 40 0.146 10.301 -4.003
274 HA ARG 40 HA ARG 40 1.313 7.682 -4.680
275 HB2 ARG 40 1HB ARG 40 2.730 10.251 -3.933
276 HB3 ARG 40 2HB ARG 40 3.496 8.751 -4.431
277 HG2 ARG 40 1HG ARG 40 1.667 10.395 -6.159
278 HG3 ARG 40 2HG ARG 40 3.429 10.460 -6.205
279 HD2 ARG 40 1HD ARG 40 3.516 8.120 -6.857
280 HD3 ARG 40 2HD ARG 40 1.760 8.004 -6.743
281 HE ARG 40 HE ARG 40 2.090 10.001 -8.509
282 HH11 ARG 40 1HH1 ARG 40 3.419 6.765 -8.337
283 HH12 ARG 40 2HH1 ARG 40 3.609 6.621 -10.057
284 HH21 ARG 40 1HH2 ARG 40 2.348 9.813 -10.767
285 HH22 ARG 40 2HH2 ARG 40 3.002 8.351 -11.437
286 H THR 41 H THR 41 -0.402 7.678 -2.608
287 HA THR 41 HA THR 41 1.317 7.632 -0.235
288 HB THR 41 HB THR 41 -0.688 8.430 1.076
289 HG1 THR 41 HG1 THR 41 -2.369 9.355 -0.024
290 HG21 THR 41 1HG2 THR 41 -0.315 10.797 0.544
291 HG22 THR 41 2HG2 THR 41 0.498 10.329 -0.948
292 HG23 THR 41 3HG2 THR 41 1.200 9.898 0.612
293 H LEU 42 H LEU 42 0.377 6.402 1.555
294 HA LEU 42 HA LEU 42 -1.544 4.341 0.770
295 HB2 LEU 42 1HB LEU 42 1.132 3.917 2.094
296 HB3 LEU 42 2HB LEU 42 -0.150 2.724 2.141
297 HG LEU 42 HG LEU 42 1.218 3.732 -0.348
298 HD11 LEU 42 1HD1 LEU 42 1.398 1.060 1.022
299 HD12 LEU 42 2HD1 LEU 42 2.629 2.320 1.087
300 HD13 LEU 42 3HD1 LEU 42 2.235 1.551 -0.450
301 HD21 LEU 42 1HD2 LEU 42 -0.901 1.626 0.050
302 HD22 LEU 42 2HD2 LEU 42 0.006 1.868 -1.444
303 HD23 LEU 42 3HD2 LEU 42 -1.062 3.138 -0.847
304 H GLU 43 H GLU 43 -2.643 3.405 2.557
305 HA GLU 43 HA GLU 43 -2.821 5.207 4.851
306 HB2 GLU 43 1HB GLU 43 -4.659 3.085 3.751
307 HB3 GLU 43 2HB GLU 43 -4.942 3.892 5.286
308 HG2 GLU 43 1HG GLU 43 -4.707 5.292 2.636
309 HG3 GLU 43 2HG GLU 43 -6.228 4.841 3.404
310 H GLU 44 H GLU 44 -3.066 4.232 6.994
311 HA GLU 44 HA GLU 44 -1.098 2.208 7.408
312 HB2 GLU 44 1HB GLU 44 -1.517 4.084 8.995
313 HB3 GLU 44 2HB GLU 44 -3.067 3.359 9.387
314 HG2 GLU 44 1HG GLU 44 -1.943 1.377 10.221
315 HG3 GLU 44 2HG GLU 44 -0.383 2.079 9.808
316 H ASN 45 H ASN 45 -1.380 0.145 8.126
317 HA ASN 45 HA ASN 45 -2.206 -1.929 7.923
318 HB2 ASN 45 1HB ASN 45 -4.211 -2.446 9.235
319 HB3 ASN 45 2HB ASN 45 -3.099 -1.410 10.107
320 HD21 ASN 45 1HD2 ASN 45 -3.737 0.585 10.734
321 HD22 ASN 45 2HD2 ASN 45 -5.349 1.180 10.548
322 H GLN 46 H GLN 46 -2.491 -0.490 5.630
323 HA GLN 46 HA GLN 46 -5.087 -1.303 4.532
324 HB2 GLN 46 1HB GLN 46 -4.360 1.033 4.172
325 HB3 GLN 46 2HB GLN 46 -2.927 0.445 3.346
326 HG2 GLN 46 1HG GLN 46 -4.374 -0.615 1.659
327 HG3 GLN 46 2HG GLN 46 -5.774 0.091 2.459
328 HE21 GLN 46 1HE2 GLN 46 -2.950 0.703 0.566
329 HE22 GLN 46 2HE2 GLN 46 -3.376 2.302 0.072
330 H LYS 47 H LYS 47 -5.228 -2.776 2.877
331 HA LYS 47 HA LYS 47 -3.018 -4.546 2.499
332 HB2 LYS 47 1HB LYS 47 -5.739 -4.368 1.219
333 HB3 LYS 47 2HB LYS 47 -4.555 -5.591 0.777
334 HG2 LYS 47 1HG LYS 47 -5.566 -5.192 3.579
335 HG3 LYS 47 2HG LYS 47 -6.287 -6.320 2.432
336 HD2 LYS 47 1HD LYS 47 -3.383 -6.378 3.243
337 HD3 LYS 47 2HD LYS 47 -4.638 -7.333 4.036
338 HE2 LYS 47 1HE LYS 47 -3.863 -7.482 1.121
339 HE3 LYS 47 2HE LYS 47 -3.437 -8.650 2.366
340 HZ1 LYS 47 1HZ LYS 47 -5.300 -9.458 1.126
341 HZ2 LYS 47 2HZ LYS 47 -6.169 -8.033 1.383
342 HZ3 LYS 47 3HZ LYS 47 -5.835 -9.061 2.680
343 H VAL 48 H VAL 48 -1.784 -4.851 0.651
344 HA VAL 48 HA VAL 48 -1.979 -2.922 -1.495
345 HB VAL 48 HB VAL 48 -0.919 -1.686 0.366
346 HG11 VAL 48 1HG1 VAL 48 0.187 -3.551 1.452
347 HG12 VAL 48 2HG1 VAL 48 1.340 -2.268 1.076
348 HG13 VAL 48 3HG1 VAL 48 1.276 -3.720 0.075
349 HG21 VAL 48 1HG2 VAL 48 -0.435 -1.038 -1.911
350 HG22 VAL 48 2HG2 VAL 48 0.869 -2.223 -1.994
351 HG23 VAL 48 3HG2 VAL 48 1.000 -0.842 -0.905
352 H GLU 49 H GLU 49 -0.628 -3.357 -3.229
353 HA GLU 49 HA GLU 49 0.831 -5.910 -3.178
354 HB2 GLU 49 1HB GLU 49 -1.146 -6.021 -4.586
355 HB3 GLU 49 2HB GLU 49 -0.671 -4.551 -5.417
356 HG2 GLU 49 1HG GLU 49 1.241 -5.666 -6.374
357 HG3 GLU 49 2HG GLU 49 0.865 -7.135 -5.470
358 H PHE 50 H PHE 50 2.869 -5.937 -4.224
359 HA PHE 50 HA PHE 50 4.019 -3.549 -5.316
360 HB2 PHE 50 1HB PHE 50 5.639 -3.240 -3.400
361 HB3 PHE 50 2HB PHE 50 3.978 -2.773 -3.051
362 HD1 PHE 50 HD1 PHE 50 6.695 -5.009 -2.197
363 HD2 PHE 50 HD2 PHE 50 2.543 -4.235 -1.671
364 HE1 PHE 50 HE1 PHE 50 6.651 -6.531 -0.268
365 HE2 PHE 50 HE2 PHE 50 2.498 -5.754 0.254
366 HZ PHE 50 HZ PHE 50 4.554 -6.904 0.960
367 H GLU 51 H GLU 51 6.227 -3.840 -5.951
368 HA GLU 51 HA GLU 51 7.089 -6.638 -5.954
369 HB2 GLU 51 1HB GLU 51 7.156 -5.590 -8.135
370 HB3 GLU 51 2HB GLU 51 8.095 -4.243 -7.501
371 HG2 GLU 51 1HG GLU 51 9.995 -5.624 -7.155
372 HG3 GLU 51 2HG GLU 51 9.073 -7.084 -7.491
373 H ILE 52 H ILE 52 8.385 -7.265 -4.383
374 HA ILE 52 HA ILE 52 9.746 -5.401 -2.713
375 HB ILE 52 HB ILE 52 10.019 -8.403 -2.873
376 HG12 ILE 52 1HG1 ILE 52 8.503 -6.634 -0.951
377 HG13 ILE 52 2HG1 ILE 52 7.776 -7.588 -2.238
378 HG21 ILE 52 1HG2 ILE 52 10.996 -6.477 -0.770
379 HG22 ILE 52 2HG2 ILE 52 12.008 -7.367 -1.907
380 HG23 ILE 52 3HG2 ILE 52 11.087 -8.236 -0.679
381 HD11 ILE 52 1HD1 ILE 52 8.529 -9.631 -1.148
382 HD12 ILE 52 2HD1 ILE 52 7.521 -8.660 -0.077
383 HD13 ILE 52 3HD1 ILE 52 9.272 -8.676 0.135
384 H GLY 53 H GLY 53 11.325 -4.263 -3.558
385 HA2 GLY 53 1HA GLY 53 13.419 -5.672 -5.078
386 HA3 GLY 53 2HA GLY 53 13.100 -3.943 -5.162
387 H GLU 54 H GLU 54 15.411 -3.769 -4.725
388 HA GLU 54 HA GLU 54 16.046 -4.282 -1.909
389 HB2 GLU 54 1HB GLU 54 18.428 -4.206 -2.658
390 HB3 GLU 54 2HB GLU 54 17.495 -5.540 -3.317
391 HG2 GLU 54 1HG GLU 54 17.192 -4.237 -5.396
392 HG3 GLU 54 2HG GLU 54 18.254 -2.999 -4.729
393 H GLY 55 H GLY 55 16.435 -2.661 -0.617
394 HA2 GLY 55 1HA GLY 55 16.772 0.020 -1.778
395 HA3 GLY 55 2HA GLY 55 16.129 -0.321 -0.175
396 H ALA 56 H ALA 56 17.733 1.230 0.560
397 HA ALA 56 HA ALA 56 20.511 0.529 0.357
398 HB1 ALA 56 1HB ALA 56 19.162 2.575 2.108
399 HB2 ALA 56 2HB ALA 56 19.799 2.863 0.487
400 HB3 ALA 56 3HB ALA 56 20.895 2.445 1.806
401 H LYS 57 H LYS 57 17.987 0.234 2.814
402 HA LYS 57 HA LYS 57 19.891 -1.292 4.463
403 HB2 LYS 57 1HB LYS 57 17.790 0.650 5.427
404 HB3 LYS 57 2HB LYS 57 18.786 -0.359 6.465
405 HG2 LYS 57 1HG LYS 57 20.785 0.769 5.665
406 HG3 LYS 57 2HG LYS 57 19.803 1.768 4.596
407 HD2 LYS 57 1HD LYS 57 18.657 2.720 6.531
408 HD3 LYS 57 2HD LYS 57 19.618 1.701 7.606
409 HE2 LYS 57 1HE LYS 57 20.703 3.815 5.744
410 HE3 LYS 57 2HE LYS 57 20.504 3.986 7.487
411 HZ1 LYS 57 1HZ LYS 57 22.061 2.143 7.788
412 HZ2 LYS 57 2HZ LYS 57 22.772 3.430 6.952
413 HZ3 LYS 57 3HZ LYS 57 22.285 2.047 6.112
414 H GLY 58 H GLY 58 17.839 -2.149 2.516
415 HA2 GLY 58 1HA GLY 58 16.947 -4.471 3.434
416 HA3 GLY 58 2HA GLY 58 15.789 -3.376 4.177
417 HA PRO 59 HA PRO 59 14.380 -4.593 -0.156
418 HB2 PRO 59 1HB PRO 59 11.899 -5.405 0.685
419 HB3 PRO 59 2HB PRO 59 13.269 -6.487 0.458
420 HG2 PRO 59 1HG PRO 59 12.209 -5.271 2.966
421 HG3 PRO 59 2HG PRO 59 12.816 -6.910 2.686
422 HD2 PRO 59 1HD PRO 59 14.305 -5.031 3.904
423 HD3 PRO 59 2HD PRO 59 15.026 -6.256 2.838
424 H GLN 60 H GLN 60 12.955 -3.394 -1.395
425 HA GLN 60 HA GLN 60 11.423 -1.319 0.016
426 HB2 GLN 60 1HB GLN 60 12.000 0.317 -1.699
427 HB3 GLN 60 2HB GLN 60 13.444 -0.280 -0.893
428 HG2 GLN 60 1HG GLN 60 14.003 -1.657 -2.763
429 HG3 GLN 60 2HG GLN 60 12.465 -1.302 -3.546
430 HE21 GLN 60 1HE2 GLN 60 14.304 1.125 -1.865
431 HE22 GLN 60 2HE2 GLN 60 14.781 2.015 -3.267
432 H ALA 61 H ALA 61 9.441 -0.888 -0.751
433 HA ALA 61 HA ALA 61 8.299 -2.817 -2.562
434 HB1 ALA 61 1HB ALA 61 7.054 -0.477 -1.121
435 HB2 ALA 61 2HB ALA 61 7.072 -2.154 -0.570
436 HB3 ALA 61 3HB ALA 61 6.172 -1.710 -2.022
437 H GLN 62 H GLN 62 8.486 -2.562 -4.668
438 HA GLN 62 HA GLN 62 8.474 0.167 -5.771
439 HB2 GLN 62 1HB GLN 62 9.408 -2.364 -7.121
440 HB3 GLN 62 2HB GLN 62 9.632 -0.715 -7.688
441 HG2 GLN 62 1HG GLN 62 11.060 -0.261 -5.750
442 HG3 GLN 62 2HG GLN 62 10.863 -1.933 -5.228
443 HE21 GLN 62 1HE2 GLN 62 11.743 -3.588 -6.520
444 HE22 GLN 62 2HE2 GLN 62 13.063 -3.270 -7.585
445 H GLN 63 H GLN 63 7.080 0.693 -7.420
446 HA GLN 63 HA GLN 63 5.090 0.716 -8.504
447 HB2 GLN 63 1HB GLN 63 5.921 -2.149 -8.940
448 HB3 GLN 63 2HB GLN 63 4.469 -1.475 -9.659
449 HG2 GLN 63 1HG GLN 63 6.195 -1.425 -11.292
450 HG3 GLN 63 2HG GLN 63 5.885 0.230 -10.779
451 HE21 GLN 63 1HE2 GLN 63 7.493 1.387 -9.808
452 HE22 GLN 63 2HE2 GLN 63 9.110 0.807 -9.610
453 H VAL 64 H VAL 64 4.396 1.027 -6.200
454 HA VAL 64 HA VAL 64 3.192 -1.258 -4.884
455 HB VAL 64 HB VAL 64 3.134 1.579 -3.897
456 HG11 VAL 64 1HG1 VAL 64 3.116 -1.094 -2.533
457 HG12 VAL 64 2HG1 VAL 64 1.804 0.079 -2.616
458 HG13 VAL 64 3HG1 VAL 64 3.261 0.447 -1.696
459 HG21 VAL 64 1HG2 VAL 64 5.275 1.153 -2.765
460 HG22 VAL 64 2HG2 VAL 64 5.431 1.156 -4.522
461 HG23 VAL 64 3HG2 VAL 64 5.415 -0.372 -3.642
462 H HIS 65 H HIS 65 1.215 -1.835 -5.445
463 HA HIS 65 HA HIS 65 -0.745 0.225 -6.224
464 HB2 HIS 65 1HB HIS 65 -0.733 -2.756 -6.742
465 HB3 HIS 65 2HB HIS 65 -2.031 -1.668 -7.202
466 HD1 HIS 65 HD1 HIS 65 -1.868 -0.678 -9.480
467 HD2 HIS 65 HD2 HIS 65 1.766 -2.181 -8.144
468 HE1 HIS 65 HE1 HIS 65 -0.302 -0.489 -11.435
469 HE2 HIS 65 HE2 HIS 65 1.831 -1.578 -10.659
470 H ALA 66 H ALA 66 -2.261 0.696 -4.757
471 HA ALA 66 HA ALA 66 -2.425 -0.739 -2.301
472 HB1 ALA 66 1HB ALA 66 -2.809 1.675 -2.431
473 HB2 ALA 66 2HB ALA 66 -4.184 0.833 -1.714
474 HB3 ALA 66 3HB ALA 66 -4.263 1.388 -3.388
475 H LEU 67 H LEU 67 -3.852 -2.241 -1.622
476 HA LEU 67 HA LEU 67 -5.586 -3.411 -3.664
477 HB2 LEU 67 1HB LEU 67 -4.660 -4.437 -0.986
478 HB3 LEU 67 2HB LEU 67 -5.743 -5.311 -2.047
479 HG LEU 67 HG LEU 67 -2.870 -4.592 -2.625
480 HD11 LEU 67 1HD1 LEU 67 -2.508 -7.007 -2.514
481 HD12 LEU 67 2HD1 LEU 67 -4.200 -7.241 -2.070
482 HD13 LEU 67 3HD1 LEU 67 -3.114 -6.371 -0.985
483 HD21 LEU 67 1HD2 LEU 67 -4.119 -4.538 -4.678
484 HD22 LEU 67 2HD2 LEU 67 -4.901 -6.070 -4.291
485 HD23 LEU 67 3HD2 LEU 67 -3.171 -6.023 -4.624
486 H GLY 68 H GLY 68 -6.699 -1.138 -2.950
487 HA2 GLY 68 1HA GLY 68 -8.459 -1.534 -0.660
488 HA3 GLY 68 2HA GLY 68 -8.297 -0.064 -1.610
489 H GLY 69 H GLY 69 -9.907 0.404 -2.942
490 HA2 GLY 69 1HA GLY 69 -12.081 -1.470 -3.236
491 HA3 GLY 69 2HA GLY 69 -12.041 0.188 -3.818
492 H GLU 70 H GLU 70 -10.733 -3.041 -4.470
493 HA GLU 70 HA GLU 70 -10.309 -2.359 -7.266
494 HB2 GLU 70 1HB GLU 70 -8.705 -3.827 -6.112
495 HB3 GLU 70 2HB GLU 70 -9.983 -4.994 -5.812
496 HG2 GLU 70 1HG GLU 70 -10.219 -5.419 -8.165
497 HG3 GLU 70 2HG GLU 70 -9.065 -4.142 -8.547
498 H ASN 71 H ASN 71 -12.497 -4.180 -5.252
499 HA ASN 71 HA ASN 71 -14.091 -4.941 -7.591
500 HB2 ASN 71 1HB ASN 71 -14.416 -5.810 -4.707
501 HB3 ASN 71 2HB ASN 71 -15.253 -6.476 -6.103
502 HD21 ASN 71 1HD2 ASN 71 -13.535 -7.762 -4.115
503 HD22 ASN 71 2HD2 ASN 71 -12.261 -8.519 -5.010
504 H LEU 72 H LEU 72 -15.732 -3.659 -8.114
505 HA LEU 72 HA LEU 72 -16.553 -1.517 -6.433
506 HB2 LEU 72 1HB LEU 72 -16.581 -1.368 -8.889
507 HB3 LEU 72 2HB LEU 72 -17.833 -2.593 -8.949
508 HG LEU 72 HG LEU 72 -19.373 -1.082 -7.774
509 HD11 LEU 72 1HD1 LEU 72 -17.087 0.875 -7.932
510 HD12 LEU 72 2HD1 LEU 72 -17.811 0.210 -6.467
511 HD13 LEU 72 3HD1 LEU 72 -18.745 1.291 -7.501
512 HD21 LEU 72 1HD2 LEU 72 -19.688 0.518 -9.598
513 HD22 LEU 72 2HD2 LEU 72 -19.342 -1.101 -10.207
514 HD23 LEU 72 3HD2 LEU 72 -18.080 0.130 -10.212
515 H TYR 73 H TYR 73 -17.767 -1.755 -4.707
516 HA TYR 73 HA TYR 73 -19.707 -3.937 -4.585
517 HB2 TYR 73 1HB TYR 73 -18.224 -3.813 -2.684
518 HB3 TYR 73 2HB TYR 73 -18.585 -2.106 -2.455
519 HD1 TYR 73 HD1 TYR 73 -20.111 -5.494 -2.329
520 HD2 TYR 73 HD2 TYR 73 -20.359 -1.435 -1.080
521 HE1 TYR 73 HE1 TYR 73 -21.926 -6.086 -0.780
522 HE2 TYR 73 HE2 TYR 73 -22.173 -2.018 0.471
523 HH TYR 73 HH TYR 73 -22.894 -5.145 1.368
524 H PHE 74 H PHE 74 -21.811 -3.589 -4.811
525 HA PHE 74 HA PHE 74 -22.760 -0.825 -4.951
526 HB2 PHE 74 1HB PHE 74 -24.082 -3.423 -5.761
527 HB3 PHE 74 2HB PHE 74 -24.807 -1.830 -5.944
528 HD1 PHE 74 HD1 PHE 74 -22.564 -4.269 -7.336
529 HD2 PHE 74 HD2 PHE 74 -23.742 -0.184 -7.495
530 HE1 PHE 74 HE1 PHE 74 -21.495 -4.052 -9.538
531 HE2 PHE 74 HE2 PHE 74 -22.678 0.039 -9.701
532 HZ PHE 74 HZ PHE 74 -21.553 -1.897 -10.724
533 H GLN 75 H GLN 75 -24.243 0.004 -3.562
534 HA GLN 75 HA GLN 75 -24.540 -1.206 -1.014
535 HB2 GLN 75 1HB GLN 75 -26.066 1.115 -2.210
536 HB3 GLN 75 2HB GLN 75 -26.013 0.692 -0.505
537 HG2 GLN 75 1HG GLN 75 -23.595 1.130 -0.493
538 HG3 GLN 75 2HG GLN 75 -23.691 1.612 -2.187
539 HE21 GLN 75 1HE2 GLN 75 -23.005 3.701 -1.791
540 HE22 GLN 75 2HE2 GLN 75 -23.986 4.869 -0.973
541 H GLY 76 H GLY 76 -25.860 -2.825 -0.518
542 HA2 GLY 76 1HA GLY 76 -27.781 -4.096 -0.397
543 HA3 GLY 76 2HA GLY 76 -28.614 -2.839 -1.299
544 H HIS 77 H HIS 77 -26.021 -5.204 -1.886
545 HA HIS 77 HA HIS 77 -27.376 -5.924 -4.398
546 HB2 HIS 77 1HB HIS 77 -25.334 -4.411 -4.655
547 HB3 HIS 77 2HB HIS 77 -24.378 -5.777 -4.095
548 HD1 HIS 77 HD1 HIS 77 -26.277 -4.505 -7.038
549 HD2 HIS 77 HD2 HIS 77 -24.118 -7.888 -5.949
550 HE1 HIS 77 HE1 HIS 77 -25.871 -5.765 -9.174
551 HE2 HIS 77 HE2 HIS 77 -24.405 -7.702 -8.514
552 H HIS 78 H HIS 78 -28.226 -7.626 -2.977
553 HA HIS 78 HA HIS 78 -26.307 -9.607 -2.060
554 HB2 HIS 78 1HB HIS 78 -28.416 -10.765 -1.192
555 HB3 HIS 78 2HB HIS 78 -27.979 -9.232 -0.454
556 HD1 HIS 78 HD1 HIS 78 -29.733 -7.472 -0.409
557 HD2 HIS 78 HD2 HIS 78 -30.653 -10.528 -3.070
558 HE1 HIS 78 HE1 HIS 78 -32.091 -7.026 -1.164
559 HE2 HIS 78 HE2 HIS 78 -32.681 -8.989 -2.630
560 H HIS 79 H HIS 79 -25.711 -9.945 -4.396
561 HA HIS 79 HA HIS 79 -27.604 -11.603 -5.863
562 HB2 HIS 79 1HB HIS 79 -26.257 -9.872 -7.050
563 HB3 HIS 79 2HB HIS 79 -24.805 -10.781 -6.657
564 HD1 HIS 79 HD1 HIS 79 -27.716 -10.731 -8.963
565 HD2 HIS 79 HD2 HIS 79 -24.474 -13.191 -8.120
566 HE1 HIS 79 HE1 HIS 79 -27.591 -12.356 -10.869
567 HE2 HIS 79 HE2 HIS 79 -25.531 -13.730 -10.421
568 H HIS 80 H HIS 80 -24.235 -11.898 -4.692
569 HA HIS 80 HA HIS 80 -24.611 -14.820 -4.672
570 HB2 HIS 80 1HB HIS 80 -22.126 -13.121 -4.723
571 HB3 HIS 80 2HB HIS 80 -22.074 -14.825 -4.294
572 HD1 HIS 80 HD1 HIS 80 -21.441 -12.799 -7.067
573 HD2 HIS 80 HD2 HIS 80 -23.560 -16.338 -6.548
574 HE1 HIS 80 HE1 HIS 80 -21.581 -13.845 -9.348
575 HE2 HIS 80 HE2 HIS 80 -22.755 -16.047 -8.985
576 H HIS 81 H HIS 81 -24.541 -12.123 -2.686
577 HA HIS 81 HA HIS 81 -24.044 -13.806 -0.323
578 HB2 HIS 81 1HB HIS 81 -23.523 -10.858 -0.735
579 HB3 HIS 81 2HB HIS 81 -23.489 -11.632 0.844
580 HD1 HIS 81 HD1 HIS 81 -21.434 -10.993 -2.124
581 HD2 HIS 81 HD2 HIS 81 -21.372 -13.587 1.121
582 HE1 HIS 81 HE1 HIS 81 -19.113 -11.952 -2.071
583 HE2 HIS 81 HE2 HIS 81 -19.045 -13.348 0.019
584 H HIS 82 H HIS 82 -25.140 -12.625 1.673
585 HA HIS 82 HA HIS 82 -27.894 -11.962 0.867
586 HB2 HIS 82 1HB HIS 82 -27.803 -14.149 1.951
587 HB3 HIS 82 2HB HIS 82 -26.938 -13.461 3.318
588 HD1 HIS 82 HD1 HIS 82 -28.311 -12.340 5.133
589 HD2 HIS 82 HD2 HIS 82 -30.573 -13.482 1.839
590 HE1 HIS 82 HE1 HIS 82 -30.708 -12.055 5.829
591 HE2 HIS 82 HE2 HIS 82 -32.062 -12.866 3.866
Start of MODEL 6
1 H2 MET 1 2H MET 1 4.330 -11.627 -8.381
2 H MET 1 1H MET 1 4.869 -10.393 -9.403
3 H3 MET 1 3H MET 1 5.675 -10.702 -7.951
4 HA MET 1 HA MET 1 4.340 -8.744 -7.738
5 HB2 MET 1 1HB MET 1 1.860 -8.964 -7.849
6 HB3 MET 1 2HB MET 1 2.651 -9.186 -9.401
7 HG2 MET 1 1HG MET 1 2.427 -11.610 -9.163
8 HG3 MET 1 2HG MET 1 1.615 -11.376 -7.616
9 HE1 MET 1 1HE MET 1 0.462 -13.070 -10.078
10 HE2 MET 1 2HE MET 1 -1.230 -12.583 -10.050
11 HE3 MET 1 3HE MET 1 -0.381 -12.909 -8.539
12 H ALA 2 H ALA 2 4.389 -8.360 -5.640
13 HA ALA 2 HA ALA 2 3.670 -10.543 -3.798
14 HB1 ALA 2 1HB ALA 2 5.118 -9.446 -2.159
15 HB2 ALA 2 2HB ALA 2 5.480 -8.173 -3.326
16 HB3 ALA 2 3HB ALA 2 6.006 -9.828 -3.635
17 H GLN 3 H GLN 3 2.639 -9.917 -1.790
18 HA GLN 3 HA GLN 3 1.169 -7.383 -1.956
19 HB2 GLN 3 1HB GLN 3 0.031 -10.082 -1.238
20 HB3 GLN 3 2HB GLN 3 -0.801 -8.558 -0.972
21 HG2 GLN 3 1HG GLN 3 -0.768 -8.128 -3.376
22 HG3 GLN 3 2HG GLN 3 0.041 -9.676 -3.632
23 HE21 GLN 3 1HE2 GLN 3 -2.909 -8.100 -2.754
24 HE22 GLN 3 2HE2 GLN 3 -3.939 -9.477 -2.898
25 H GLY 4 H GLY 4 0.164 -6.843 0.160
26 HA2 GLY 4 1HA GLY 4 0.949 -8.062 2.554
27 HA3 GLY 4 2HA GLY 4 2.105 -6.792 2.177
28 H THR 5 H THR 5 1.074 -6.159 4.337
29 HA THR 5 HA THR 5 -1.096 -4.277 3.698
30 HB THR 5 HB THR 5 -0.594 -5.587 6.379
31 HG1 THR 5 HG1 THR 5 -1.475 -7.016 4.762
32 HG21 THR 5 1HG2 THR 5 -2.849 -3.824 5.419
33 HG22 THR 5 2HG2 THR 5 -1.570 -3.345 6.536
34 HG23 THR 5 3HG2 THR 5 -2.736 -4.583 7.008
35 H VAL 6 H VAL 6 -0.380 -2.264 3.734
36 HA VAL 6 HA VAL 6 2.124 -1.514 4.773
37 HB VAL 6 HB VAL 6 1.387 -0.087 3.098
38 HG11 VAL 6 1HG1 VAL 6 -0.785 1.031 3.067
39 HG12 VAL 6 2HG1 VAL 6 -1.222 0.205 4.560
40 HG13 VAL 6 3HG1 VAL 6 -0.945 -0.723 3.086
41 HG21 VAL 6 1HG2 VAL 6 0.771 1.379 5.660
42 HG22 VAL 6 2HG2 VAL 6 1.145 2.126 4.106
43 HG23 VAL 6 3HG2 VAL 6 2.371 1.171 4.945
44 H LYS 7 H LYS 7 2.662 -1.536 6.809
45 HA LYS 7 HA LYS 7 0.686 -1.576 8.863
46 HB2 LYS 7 1HB LYS 7 2.637 -1.720 10.402
47 HB3 LYS 7 2HB LYS 7 2.599 -2.956 9.158
48 HG2 LYS 7 1HG LYS 7 4.300 -1.796 7.902
49 HG3 LYS 7 2HG LYS 7 4.290 -0.474 9.069
50 HD2 LYS 7 1HD LYS 7 6.169 -2.043 9.421
51 HD3 LYS 7 2HD LYS 7 5.086 -1.952 10.811
52 HE2 LYS 7 1HE LYS 7 3.960 -4.005 10.016
53 HE3 LYS 7 2HE LYS 7 5.129 -4.111 8.703
54 HZ1 LYS 7 1HZ LYS 7 6.874 -4.489 10.236
55 HZ2 LYS 7 2HZ LYS 7 5.607 -5.518 10.689
56 HZ3 LYS 7 3HZ LYS 7 5.896 -4.101 11.565
57 H TRP 8 H TRP 8 2.863 0.775 7.531
58 HA TRP 8 HA TRP 8 1.194 2.872 8.424
59 HB2 TRP 8 1HB TRP 8 2.718 4.093 9.855
60 HB3 TRP 8 2HB TRP 8 2.438 2.500 10.538
61 HD1 TRP 8 HD1 TRP 8 4.507 0.857 10.709
62 HE1 TRP 8 HE1 TRP 8 7.047 1.239 10.512
63 HE3 TRP 8 HE3 TRP 8 4.469 5.481 8.527
64 HZ2 TRP 8 HZ2 TRP 8 8.795 3.241 9.566
65 HZ3 TRP 8 HZ3 TRP 8 6.618 6.555 8.007
66 HH2 TRP 8 HH2 TRP 8 8.733 5.456 8.515
67 H PHE 9 H PHE 9 1.692 4.844 7.418
68 HA PHE 9 HA PHE 9 4.045 4.900 5.711
69 HB2 PHE 9 1HB PHE 9 2.245 3.906 4.328
70 HB3 PHE 9 2HB PHE 9 1.270 5.348 4.598
71 HD1 PHE 9 HD1 PHE 9 4.384 4.093 3.088
72 HD2 PHE 9 HD2 PHE 9 1.606 7.306 3.320
73 HE1 PHE 9 HE1 PHE 9 5.474 5.168 1.167
74 HE2 PHE 9 HE2 PHE 9 2.689 8.385 1.395
75 HZ PHE 9 HZ PHE 9 4.627 7.320 0.320
76 H ASN 10 H ASN 10 4.942 6.817 5.649
77 HA ASN 10 HA ASN 10 3.476 9.105 6.766
78 HB2 ASN 10 1HB ASN 10 5.612 8.418 7.853
79 HB3 ASN 10 2HB ASN 10 6.451 8.730 6.340
80 HD21 ASN 10 1HD2 ASN 10 6.720 9.901 9.020
81 HD22 ASN 10 2HD2 ASN 10 6.560 11.606 8.790
82 H ALA 11 H ALA 11 2.483 10.151 5.152
83 HA ALA 11 HA ALA 11 3.404 10.094 2.457
84 HB1 ALA 11 1HB ALA 11 1.254 11.757 3.750
85 HB2 ALA 11 2HB ALA 11 1.040 10.189 2.970
86 HB3 ALA 11 3HB ALA 11 1.515 11.594 2.014
87 H GLU 12 H GLU 12 3.760 12.312 5.111
88 HA GLU 12 HA GLU 12 4.485 14.617 3.655
89 HB2 GLU 12 1HB GLU 12 3.811 14.741 5.986
90 HB3 GLU 12 2HB GLU 12 5.183 13.750 6.464
91 HG2 GLU 12 1HG GLU 12 6.718 15.473 5.926
92 HG3 GLU 12 2HG GLU 12 5.462 16.434 5.151
93 H LYS 13 H LYS 13 6.391 12.071 5.179
94 HA LYS 13 HA LYS 13 8.864 13.128 4.122
95 HB2 LYS 13 1HB LYS 13 8.303 10.544 5.575
96 HB3 LYS 13 2HB LYS 13 9.896 11.194 5.220
97 HG2 LYS 13 1HG LYS 13 7.825 12.456 6.995
98 HG3 LYS 13 2HG LYS 13 9.275 11.607 7.525
99 HD2 LYS 13 1HD LYS 13 10.640 13.280 6.325
100 HD3 LYS 13 2HD LYS 13 9.160 14.150 5.923
101 HE2 LYS 13 1HE LYS 13 10.176 15.191 7.832
102 HE3 LYS 13 2HE LYS 13 8.695 14.388 8.340
103 HZ1 LYS 13 1HZ LYS 13 9.982 12.580 9.227
104 HZ2 LYS 13 2HZ LYS 13 10.556 14.029 9.876
105 HZ3 LYS 13 3HZ LYS 13 11.422 13.253 8.649
106 H GLY 14 H GLY 14 6.538 10.671 3.385
107 HA2 GLY 14 1HA GLY 14 6.104 9.932 1.209
108 HA3 GLY 14 2HA GLY 14 7.707 10.462 0.729
109 H PHE 15 H PHE 15 7.224 8.445 3.552
110 HA PHE 15 HA PHE 15 7.799 6.039 2.042
111 HB2 PHE 15 1HB PHE 15 9.832 5.465 3.124
112 HB3 PHE 15 2HB PHE 15 10.026 7.115 2.552
113 HD1 PHE 15 HD1 PHE 15 9.892 4.929 5.434
114 HD2 PHE 15 HD2 PHE 15 9.998 8.991 4.167
115 HE1 PHE 15 HE1 PHE 15 10.563 5.612 7.696
116 HE2 PHE 15 HE2 PHE 15 10.663 9.678 6.431
117 HZ PHE 15 HZ PHE 15 10.948 7.990 8.199
118 H GLY 16 H GLY 16 7.829 4.098 3.458
119 HA2 GLY 16 1HA GLY 16 6.768 4.239 6.100
120 HA3 GLY 16 2HA GLY 16 5.513 3.854 4.930
121 H PHE 17 H PHE 17 5.408 1.822 6.206
122 HA PHE 17 HA PHE 17 7.256 -0.121 5.012
123 HB2 PHE 17 1HB PHE 17 6.688 0.238 7.926
124 HB3 PHE 17 2HB PHE 17 7.014 -1.375 7.300
125 HD1 PHE 17 HD1 PHE 17 8.415 1.892 8.056
126 HD2 PHE 17 HD2 PHE 17 9.190 -1.937 6.379
127 HE1 PHE 17 HE1 PHE 17 10.830 2.333 8.177
128 HE2 PHE 17 HE2 PHE 17 11.607 -1.505 6.494
129 HZ PHE 17 HZ PHE 17 12.431 0.635 7.396
130 H ILE 18 H ILE 18 6.425 -2.035 4.490
131 HA ILE 18 HA ILE 18 3.570 -2.483 5.045
132 HB ILE 18 HB ILE 18 5.198 -3.284 2.632
133 HG12 ILE 18 1HG1 ILE 18 2.693 -1.631 2.697
134 HG13 ILE 18 2HG1 ILE 18 4.295 -0.914 2.822
135 HG21 ILE 18 1HG2 ILE 18 2.354 -3.987 3.307
136 HG22 ILE 18 2HG2 ILE 18 3.720 -5.101 3.179
137 HG23 ILE 18 3HG2 ILE 18 3.126 -4.260 1.743
138 HD11 ILE 18 1HD1 ILE 18 3.433 -0.831 0.544
139 HD12 ILE 18 2HD1 ILE 18 3.297 -2.591 0.533
140 HD13 ILE 18 3HD1 ILE 18 4.885 -1.829 0.650
141 H ALA 19 H ALA 19 2.948 -4.492 5.716
142 HA ALA 19 HA ALA 19 5.092 -6.407 6.322
143 HB1 ALA 19 1HB ALA 19 2.233 -6.311 7.296
144 HB2 ALA 19 2HB ALA 19 3.650 -5.769 8.197
145 HB3 ALA 19 3HB ALA 19 3.456 -7.478 7.801
146 HA PRO 20 HA PRO 20 3.550 -8.057 2.308
147 HB2 PRO 20 1HB PRO 20 5.855 -9.815 2.971
148 HB3 PRO 20 2HB PRO 20 5.426 -9.055 1.437
149 HG2 PRO 20 1HG PRO 20 7.395 -8.074 2.929
150 HG3 PRO 20 2HG PRO 20 6.285 -7.000 2.063
151 HD2 PRO 20 1HD PRO 20 6.418 -7.646 4.958
152 HD3 PRO 20 2HD PRO 20 5.948 -6.139 4.159
153 H ASP 21 H ASP 21 2.407 -9.838 1.803
154 HA ASP 21 HA ASP 21 1.377 -11.417 3.958
155 HB2 ASP 21 1HB ASP 21 -0.024 -10.673 2.066
156 HB3 ASP 21 2HB ASP 21 0.941 -11.653 0.969
157 H ASP 22 H ASP 22 4.055 -11.660 1.971
158 HA ASP 22 HA ASP 22 4.181 -14.537 1.803
159 HB2 ASP 22 1HB ASP 22 5.066 -13.017 0.023
160 HB3 ASP 22 2HB ASP 22 6.329 -12.517 1.140
161 H GLY 23 H GLY 23 4.142 -13.151 4.449
162 HA2 GLY 23 1HA GLY 23 5.009 -14.188 6.430
163 HA3 GLY 23 2HA GLY 23 6.494 -14.525 5.556
164 H SER 24 H SER 24 5.362 -11.484 4.888
165 HA SER 24 HA SER 24 6.032 -9.397 5.350
166 HB2 SER 24 1HB SER 24 5.816 -8.772 7.789
167 HB3 SER 24 2HB SER 24 4.414 -9.542 7.053
168 HG SER 24 HG SER 24 6.176 -11.321 8.182
169 H ALA 25 H ALA 25 8.138 -9.487 4.519
170 HA ALA 25 HA ALA 25 10.332 -9.856 6.367
171 HB1 ALA 25 1HB ALA 25 10.352 -8.891 3.511
172 HB2 ALA 25 2HB ALA 25 10.571 -10.559 4.036
173 HB3 ALA 25 3HB ALA 25 11.766 -9.337 4.466
174 H ASP 26 H ASP 26 8.187 -7.556 6.229
175 HA ASP 26 HA ASP 26 8.003 -5.345 6.671
176 HB2 ASP 26 1HB ASP 26 10.805 -5.698 7.760
177 HB3 ASP 26 2HB ASP 26 9.805 -4.268 8.000
178 H VAL 27 H VAL 27 7.878 -4.879 4.464
179 HA VAL 27 HA VAL 27 10.338 -4.229 3.060
180 HB VAL 27 HB VAL 27 8.608 -5.623 1.961
181 HG11 VAL 27 1HG1 VAL 27 6.981 -3.102 1.968
182 HG12 VAL 27 2HG1 VAL 27 6.628 -4.580 2.869
183 HG13 VAL 27 3HG1 VAL 27 6.581 -4.588 1.104
184 HG21 VAL 27 1HG2 VAL 27 10.188 -4.433 0.593
185 HG22 VAL 27 2HG2 VAL 27 9.177 -2.987 0.635
186 HG23 VAL 27 3HG2 VAL 27 8.605 -4.440 -0.188
187 H PHE 28 H PHE 28 10.919 -2.260 2.401
188 HA PHE 28 HA PHE 28 9.749 -0.003 3.780
189 HB2 PHE 28 1HB PHE 28 12.199 -0.376 3.646
190 HB3 PHE 28 2HB PHE 28 12.115 -0.174 1.903
191 HD1 PHE 28 HD1 PHE 28 11.845 1.530 5.139
192 HD2 PHE 28 HD2 PHE 28 11.968 1.994 0.912
193 HE1 PHE 28 HE1 PHE 28 12.206 3.946 5.420
194 HE2 PHE 28 HE2 PHE 28 12.330 4.413 1.186
195 HZ PHE 28 HZ PHE 28 12.449 5.392 3.440
196 H VAL 29 H VAL 29 8.481 1.530 2.886
197 HA VAL 29 HA VAL 29 7.898 1.256 0.009
198 HB VAL 29 HB VAL 29 6.139 2.850 1.799
199 HG11 VAL 29 1HG1 VAL 29 5.609 1.034 -0.541
200 HG12 VAL 29 2HG1 VAL 29 5.712 2.793 -0.589
201 HG13 VAL 29 3HG1 VAL 29 4.406 2.010 0.297
202 HG21 VAL 29 1HG2 VAL 29 6.041 -0.153 1.676
203 HG22 VAL 29 2HG2 VAL 29 4.878 0.906 2.480
204 HG23 VAL 29 3HG2 VAL 29 6.537 0.806 3.071
205 H HIS 30 H HIS 30 7.745 3.074 -1.288
206 HA HIS 30 HA HIS 30 8.522 5.649 -0.140
207 HB2 HIS 30 1HB HIS 30 10.547 4.506 -1.053
208 HB3 HIS 30 2HB HIS 30 9.767 4.461 -2.629
209 HD1 HIS 30 HD1 HIS 30 10.613 6.213 -4.107
210 HD2 HIS 30 HD2 HIS 30 10.601 7.432 -0.128
211 HE1 HIS 30 HE1 HIS 30 11.542 8.557 -4.108
212 HE2 HIS 30 HE2 HIS 30 11.695 9.192 -1.677
213 H TYR 31 H TYR 31 7.456 7.340 -1.020
214 HA TYR 31 HA TYR 31 4.958 6.786 -2.094
215 HB2 TYR 31 1HB TYR 31 4.548 9.121 -2.091
216 HB3 TYR 31 2HB TYR 31 5.607 8.791 -0.729
217 HD1 TYR 31 HD1 TYR 31 5.121 10.716 -3.690
218 HD2 TYR 31 HD2 TYR 31 8.107 9.277 -1.028
219 HE1 TYR 31 HE1 TYR 31 6.660 12.453 -4.490
220 HE2 TYR 31 HE2 TYR 31 9.657 11.012 -1.817
221 HH TYR 31 HH TYR 31 8.642 13.660 -3.692
222 H SER 32 H SER 32 7.893 7.679 -3.781
223 HA SER 32 HA SER 32 6.678 8.457 -6.207
224 HB2 SER 32 1HB SER 32 9.440 7.272 -5.879
225 HB3 SER 32 2HB SER 32 8.886 8.380 -7.137
226 HG SER 32 HG SER 32 9.445 9.934 -5.858
227 H GLU 33 H GLU 33 7.319 5.400 -4.777
228 HA GLU 33 HA GLU 33 7.171 3.960 -7.297
229 HB2 GLU 33 1HB GLU 33 7.819 3.203 -4.470
230 HB3 GLU 33 2HB GLU 33 7.385 1.965 -5.635
231 HG2 GLU 33 1HG GLU 33 9.809 2.243 -5.385
232 HG3 GLU 33 2HG GLU 33 9.254 2.542 -7.028
233 H ILE 34 H ILE 34 5.074 5.072 -4.901
234 HA ILE 34 HA ILE 34 3.250 2.890 -4.833
235 HB ILE 34 HB ILE 34 2.906 5.773 -4.023
236 HG12 ILE 34 1HG1 ILE 34 3.357 3.255 -2.415
237 HG13 ILE 34 2HG1 ILE 34 4.547 4.516 -2.711
238 HG21 ILE 34 1HG2 ILE 34 1.064 3.434 -3.534
239 HG22 ILE 34 2HG2 ILE 34 0.733 4.825 -4.568
240 HG23 ILE 34 3HG2 ILE 34 0.894 5.041 -2.824
241 HD11 ILE 34 1HD1 ILE 34 1.963 4.889 -1.229
242 HD12 ILE 34 2HD1 ILE 34 3.223 6.098 -1.463
243 HD13 ILE 34 3HD1 ILE 34 3.545 4.664 -0.485
244 H GLN 35 H GLN 35 1.412 2.530 -5.915
245 HA GLN 35 HA GLN 35 0.823 4.288 -8.205
246 HB2 GLN 35 1HB GLN 35 0.493 1.288 -8.147
247 HB3 GLN 35 2HB GLN 35 0.334 2.350 -9.536
248 HG2 GLN 35 1HG GLN 35 2.875 1.812 -8.029
249 HG3 GLN 35 2HG GLN 35 2.419 1.079 -9.563
250 HE21 GLN 35 1HE2 GLN 35 4.711 2.743 -8.839
251 HE22 GLN 35 2HE2 GLN 35 4.680 4.084 -9.925
252 H GLY 36 H GLY 36 -1.326 4.763 -8.532
253 HA2 GLY 36 1HA GLY 36 -3.445 3.241 -7.392
254 HA3 GLY 36 2HA GLY 36 -3.118 4.679 -6.435
255 H ASN 37 H ASN 37 -5.300 5.321 -7.007
256 HA ASN 37 HA ASN 37 -5.862 5.977 -9.766
257 HB2 ASN 37 1HB ASN 37 -7.599 5.212 -8.070
258 HB3 ASN 37 2HB ASN 37 -7.462 6.807 -7.340
259 HD21 ASN 37 1HD2 ASN 37 -9.567 7.372 -7.783
260 HD22 ASN 37 2HD2 ASN 37 -10.129 7.704 -9.384
261 H GLY 38 H GLY 38 -3.568 7.225 -9.060
262 HA2 GLY 38 1HA GLY 38 -2.790 9.426 -9.512
263 HA3 GLY 38 2HA GLY 38 -4.335 10.058 -8.956
264 H PHE 39 H PHE 39 -3.130 7.610 -6.989
265 HA PHE 39 HA PHE 39 -2.377 9.601 -4.970
266 HB2 PHE 39 1HB PHE 39 -3.354 6.758 -4.636
267 HB3 PHE 39 2HB PHE 39 -2.871 7.813 -3.314
268 HD1 PHE 39 HD1 PHE 39 -5.500 6.902 -5.611
269 HD2 PHE 39 HD2 PHE 39 -4.210 9.842 -2.821
270 HE1 PHE 39 HE1 PHE 39 -7.798 7.770 -5.469
271 HE2 PHE 39 HE2 PHE 39 -6.501 10.718 -2.675
272 HZ PHE 39 HZ PHE 39 -8.302 9.681 -3.999
273 H ARG 40 H ARG 40 -0.419 9.568 -4.049
274 HA ARG 40 HA ARG 40 1.342 7.268 -4.598
275 HB2 ARG 40 1HB ARG 40 2.155 10.095 -3.907
276 HB3 ARG 40 2HB ARG 40 3.238 8.770 -4.293
277 HG2 ARG 40 1HG ARG 40 1.244 9.977 -6.196
278 HG3 ARG 40 2HG ARG 40 2.961 10.375 -6.136
279 HD2 ARG 40 1HD ARG 40 3.476 7.992 -6.608
280 HD3 ARG 40 2HD ARG 40 1.746 7.693 -6.791
281 HE ARG 40 HE ARG 40 2.711 9.825 -8.452
282 HH11 ARG 40 1HH1 ARG 40 2.360 6.343 -8.236
283 HH12 ARG 40 2HH1 ARG 40 2.340 6.121 -9.961
284 HH21 ARG 40 1HH2 ARG 40 2.714 9.527 -10.709
285 HH22 ARG 40 2HH2 ARG 40 2.550 7.928 -11.365
286 H THR 41 H THR 41 -0.633 7.403 -2.550
287 HA THR 41 HA THR 41 1.039 7.522 -0.142
288 HB THR 41 HB THR 41 -1.023 8.342 1.070
289 HG1 THR 41 HG1 THR 41 -2.690 8.073 -0.312
290 HG21 THR 41 1HG2 THR 41 0.844 9.828 0.558
291 HG22 THR 41 2HG2 THR 41 -0.691 10.683 0.407
292 HG23 THR 41 3HG2 THR 41 0.167 10.147 -1.038
293 H LEU 42 H LEU 42 0.240 6.267 1.650
294 HA LEU 42 HA LEU 42 -1.567 4.084 0.901
295 HB2 LEU 42 1HB LEU 42 1.143 3.914 2.178
296 HB3 LEU 42 2HB LEU 42 -0.048 2.649 2.393
297 HG LEU 42 HG LEU 42 1.092 3.538 -0.249
298 HD11 LEU 42 1HD1 LEU 42 2.289 1.463 -0.249
299 HD12 LEU 42 2HD1 LEU 42 1.554 0.992 1.280
300 HD13 LEU 42 3HD1 LEU 42 2.681 2.345 1.226
301 HD21 LEU 42 1HD2 LEU 42 -1.159 2.745 -0.537
302 HD22 LEU 42 2HD2 LEU 42 -0.831 1.333 0.468
303 HD23 LEU 42 3HD2 LEU 42 -0.040 1.504 -1.101
304 H GLU 43 H GLU 43 -2.941 3.415 2.446
305 HA GLU 43 HA GLU 43 -3.180 5.094 4.798
306 HB2 GLU 43 1HB GLU 43 -4.962 2.905 3.722
307 HB3 GLU 43 2HB GLU 43 -5.344 3.941 5.087
308 HG2 GLU 43 1HG GLU 43 -4.950 4.826 2.239
309 HG3 GLU 43 2HG GLU 43 -6.488 4.680 3.087
310 H GLU 44 H GLU 44 -3.081 4.346 6.885
311 HA GLU 44 HA GLU 44 -1.247 2.245 7.340
312 HB2 GLU 44 1HB GLU 44 -1.485 4.275 8.752
313 HB3 GLU 44 2HB GLU 44 -3.031 3.666 9.311
314 HG2 GLU 44 1HG GLU 44 -1.914 1.726 10.271
315 HG3 GLU 44 2HG GLU 44 -0.364 2.356 9.729
316 H ASN 45 H ASN 45 -1.567 0.185 7.630
317 HA ASN 45 HA ASN 45 -2.501 -1.836 7.956
318 HB2 ASN 45 1HB ASN 45 -4.669 -0.238 9.308
319 HB3 ASN 45 2HB ASN 45 -4.711 -1.990 9.185
320 HD21 ASN 45 1HD2 ASN 45 -3.357 0.717 10.755
321 HD22 ASN 45 2HD2 ASN 45 -2.393 -0.144 11.902
322 H GLN 46 H GLN 46 -2.800 -0.407 5.550
323 HA GLN 46 HA GLN 46 -5.349 -1.458 4.536
324 HB2 GLN 46 1HB GLN 46 -4.933 0.901 4.052
325 HB3 GLN 46 2HB GLN 46 -3.393 0.493 3.313
326 HG2 GLN 46 1HG GLN 46 -4.523 -0.718 1.554
327 HG3 GLN 46 2HG GLN 46 -6.082 -0.407 2.311
328 HE21 GLN 46 1HE2 GLN 46 -3.430 0.963 0.561
329 HE22 GLN 46 2HE2 GLN 46 -4.225 2.424 0.094
330 H LYS 47 H LYS 47 -5.375 -2.959 2.889
331 HA LYS 47 HA LYS 47 -3.050 -4.572 2.545
332 HB2 LYS 47 1HB LYS 47 -5.391 -5.454 2.483
333 HB3 LYS 47 2HB LYS 47 -5.625 -4.606 0.963
334 HG2 LYS 47 1HG LYS 47 -5.185 -6.929 0.537
335 HG3 LYS 47 2HG LYS 47 -3.848 -5.951 -0.050
336 HD2 LYS 47 1HD LYS 47 -2.965 -7.902 1.037
337 HD3 LYS 47 2HD LYS 47 -2.601 -6.486 2.026
338 HE2 LYS 47 1HE LYS 47 -3.332 -8.302 3.439
339 HE3 LYS 47 2HE LYS 47 -4.541 -7.022 3.447
340 HZ1 LYS 47 1HZ LYS 47 -4.686 -9.501 1.819
341 HZ2 LYS 47 2HZ LYS 47 -5.861 -8.288 1.888
342 HZ3 LYS 47 3HZ LYS 47 -5.536 -9.224 3.253
343 H VAL 48 H VAL 48 -1.780 -4.801 0.689
344 HA VAL 48 HA VAL 48 -2.091 -2.849 -1.438
345 HB VAL 48 HB VAL 48 -0.961 -1.640 0.390
346 HG11 VAL 48 1HG1 VAL 48 0.147 -3.509 1.454
347 HG12 VAL 48 2HG1 VAL 48 1.313 -2.252 1.035
348 HG13 VAL 48 3HG1 VAL 48 1.194 -3.709 0.047
349 HG21 VAL 48 1HG2 VAL 48 0.866 -0.744 -0.902
350 HG22 VAL 48 2HG2 VAL 48 -0.513 -1.064 -1.954
351 HG23 VAL 48 3HG2 VAL 48 0.863 -2.167 -1.943
352 H GLU 49 H GLU 49 -0.761 -3.251 -3.232
353 HA GLU 49 HA GLU 49 0.615 -5.853 -3.231
354 HB2 GLU 49 1HB GLU 49 -1.414 -5.952 -4.559
355 HB3 GLU 49 2HB GLU 49 -0.952 -4.499 -5.428
356 HG2 GLU 49 1HG GLU 49 0.951 -5.670 -6.390
357 HG3 GLU 49 2HG GLU 49 0.496 -7.132 -5.511
358 H PHE 50 H PHE 50 2.618 -5.933 -4.296
359 HA PHE 50 HA PHE 50 3.719 -3.580 -5.515
360 HB2 PHE 50 1HB PHE 50 5.483 -3.279 -3.735
361 HB3 PHE 50 2HB PHE 50 3.861 -2.775 -3.278
362 HD1 PHE 50 HD1 PHE 50 2.523 -4.140 -1.737
363 HD2 PHE 50 HD2 PHE 50 6.586 -5.071 -2.602
364 HE1 PHE 50 HE1 PHE 50 2.606 -5.593 0.238
365 HE2 PHE 50 HE2 PHE 50 6.671 -6.523 -0.619
366 HZ PHE 50 HZ PHE 50 4.682 -6.787 0.801
367 H GLU 51 H GLU 51 6.145 -3.827 -5.759
368 HA GLU 51 HA GLU 51 6.870 -6.664 -6.072
369 HB2 GLU 51 1HB GLU 51 6.515 -5.519 -8.232
370 HB3 GLU 51 2HB GLU 51 7.702 -4.308 -7.775
371 HG2 GLU 51 1HG GLU 51 9.451 -5.960 -7.773
372 HG3 GLU 51 2HG GLU 51 8.283 -7.237 -8.112
373 H ILE 52 H ILE 52 8.454 -7.220 -4.720
374 HA ILE 52 HA ILE 52 9.779 -5.198 -3.186
375 HB ILE 52 HB ILE 52 10.163 -8.190 -3.168
376 HG12 ILE 52 1HG1 ILE 52 8.624 -6.357 -1.324
377 HG13 ILE 52 2HG1 ILE 52 7.912 -7.456 -2.499
378 HG21 ILE 52 1HG2 ILE 52 11.150 -6.082 -1.248
379 HG22 ILE 52 2HG2 ILE 52 12.144 -7.050 -2.337
380 HG23 ILE 52 3HG2 ILE 52 11.280 -7.825 -1.007
381 HD11 ILE 52 1HD1 ILE 52 9.521 -8.232 -0.079
382 HD12 ILE 52 2HD1 ILE 52 8.860 -9.351 -1.271
383 HD13 ILE 52 3HD1 ILE 52 7.776 -8.380 -0.275
384 H GLY 53 H GLY 53 11.624 -4.278 -3.564
385 HA2 GLY 53 1HA GLY 53 13.615 -5.683 -5.231
386 HA3 GLY 53 2HA GLY 53 13.318 -3.957 -5.391
387 H GLU 54 H GLU 54 15.571 -3.664 -4.921
388 HA GLU 54 HA GLU 54 16.198 -4.006 -2.068
389 HB2 GLU 54 1HB GLU 54 17.593 -5.271 -3.775
390 HB3 GLU 54 2HB GLU 54 18.197 -3.711 -4.304
391 HG2 GLU 54 1HG GLU 54 19.773 -4.709 -2.799
392 HG3 GLU 54 2HG GLU 54 19.045 -3.301 -2.028
393 H GLY 55 H GLY 55 16.053 -2.169 -1.017
394 HA2 GLY 55 1HA GLY 55 16.625 0.341 -2.457
395 HA3 GLY 55 2HA GLY 55 15.395 0.185 -1.213
396 H ALA 56 H ALA 56 16.419 1.960 -0.181
397 HA ALA 56 HA ALA 56 19.072 2.122 0.600
398 HB1 ALA 56 1HB ALA 56 17.463 3.974 0.695
399 HB2 ALA 56 2HB ALA 56 18.338 3.771 2.212
400 HB3 ALA 56 3HB ALA 56 16.675 3.201 2.071
401 H LYS 57 H LYS 57 16.333 1.033 2.623
402 HA LYS 57 HA LYS 57 18.112 0.153 4.700
403 HB2 LYS 57 1HB LYS 57 15.924 1.059 5.274
404 HB3 LYS 57 2HB LYS 57 15.133 -0.214 4.355
405 HG2 LYS 57 1HG LYS 57 16.032 -1.885 5.891
406 HG3 LYS 57 2HG LYS 57 16.814 -0.604 6.820
407 HD2 LYS 57 1HD LYS 57 14.647 0.365 7.340
408 HD3 LYS 57 2HD LYS 57 13.844 -0.863 6.360
409 HE2 LYS 57 1HE LYS 57 13.717 -1.416 8.735
410 HE3 LYS 57 2HE LYS 57 14.672 -2.607 7.856
411 HZ1 LYS 57 1HZ LYS 57 15.660 -1.930 9.993
412 HZ2 LYS 57 2HZ LYS 57 15.831 -0.353 9.401
413 HZ3 LYS 57 3HZ LYS 57 16.676 -1.625 8.678
414 H GLY 58 H GLY 58 15.944 -1.441 2.402
415 HA2 GLY 58 1HA GLY 58 17.564 -3.696 2.014
416 HA3 GLY 58 2HA GLY 58 16.366 -4.072 3.246
417 HA PRO 59 HA PRO 59 13.919 -5.108 -0.392
418 HB2 PRO 59 1HB PRO 59 11.715 -5.869 1.047
419 HB3 PRO 59 2HB PRO 59 13.073 -6.935 0.689
420 HG2 PRO 59 1HG PRO 59 12.471 -5.406 3.179
421 HG3 PRO 59 2HG PRO 59 13.103 -7.050 2.998
422 HD2 PRO 59 1HD PRO 59 14.691 -4.965 3.615
423 HD3 PRO 59 2HD PRO 59 15.258 -6.317 2.613
424 H GLN 60 H GLN 60 12.910 -3.574 -1.507
425 HA GLN 60 HA GLN 60 11.267 -1.650 -0.002
426 HB2 GLN 60 1HB GLN 60 11.869 0.082 -1.537
427 HB3 GLN 60 2HB GLN 60 13.351 -0.668 -0.965
428 HG2 GLN 60 1HG GLN 60 13.587 -1.889 -3.027
429 HG3 GLN 60 2HG GLN 60 12.030 -1.289 -3.595
430 HE21 GLN 60 1HE2 GLN 60 12.558 1.369 -2.440
431 HE22 GLN 60 2HE2 GLN 60 13.671 2.134 -3.513
432 H ALA 61 H ALA 61 9.318 -1.061 -0.809
433 HA ALA 61 HA ALA 61 8.121 -2.915 -2.678
434 HB1 ALA 61 1HB ALA 61 6.025 -1.793 -2.097
435 HB2 ALA 61 2HB ALA 61 6.925 -0.587 -1.179
436 HB3 ALA 61 3HB ALA 61 6.918 -2.270 -0.653
437 H GLN 62 H GLN 62 8.263 -2.588 -4.773
438 HA GLN 62 HA GLN 62 8.311 0.176 -5.794
439 HB2 GLN 62 1HB GLN 62 9.150 -2.314 -7.274
440 HB3 GLN 62 2HB GLN 62 9.487 -0.643 -7.706
441 HG2 GLN 62 1HG GLN 62 10.966 -0.417 -5.810
442 HG3 GLN 62 2HG GLN 62 10.571 -2.050 -5.276
443 HE21 GLN 62 1HE2 GLN 62 11.225 -3.807 -6.593
444 HE22 GLN 62 2HE2 GLN 62 12.596 -3.663 -7.636
445 H GLN 63 H GLN 63 6.944 0.701 -7.553
446 HA GLN 63 HA GLN 63 4.828 0.837 -8.362
447 HB2 GLN 63 1HB GLN 63 5.619 -1.971 -9.059
448 HB3 GLN 63 2HB GLN 63 4.040 -1.344 -9.502
449 HG2 GLN 63 1HG GLN 63 4.974 -0.561 -11.346
450 HG3 GLN 63 2HG GLN 63 5.804 0.617 -10.335
451 HE21 GLN 63 1HE2 GLN 63 7.448 -1.404 -9.037
452 HE22 GLN 63 2HE2 GLN 63 8.638 -1.877 -10.198
453 H VAL 64 H VAL 64 4.405 1.016 -5.968
454 HA VAL 64 HA VAL 64 3.169 -1.257 -4.678
455 HB VAL 64 HB VAL 64 3.136 1.517 -3.556
456 HG11 VAL 64 1HG1 VAL 64 2.028 -0.268 -2.337
457 HG12 VAL 64 2HG1 VAL 64 3.417 0.359 -1.447
458 HG13 VAL 64 3HG1 VAL 64 3.537 -1.180 -2.295
459 HG21 VAL 64 1HG2 VAL 64 5.398 1.172 -2.650
460 HG22 VAL 64 2HG2 VAL 64 5.384 1.298 -4.410
461 HG23 VAL 64 3HG2 VAL 64 5.550 -0.281 -3.639
462 H HIS 65 H HIS 65 1.285 -1.654 -5.792
463 HA HIS 65 HA HIS 65 -0.627 0.443 -6.323
464 HB2 HIS 65 1HB HIS 65 -0.748 -2.554 -6.649
465 HB3 HIS 65 2HB HIS 65 -2.097 -1.491 -7.021
466 HD1 HIS 65 HD1 HIS 65 -1.990 -0.145 -9.195
467 HD2 HIS 65 HD2 HIS 65 1.407 -2.434 -8.452
468 HE1 HIS 65 HE1 HIS 65 -0.678 -0.134 -11.343
469 HE2 HIS 65 HE2 HIS 65 1.294 -1.646 -10.916
470 H ALA 66 H ALA 66 -1.756 1.267 -4.732
471 HA ALA 66 HA ALA 66 -2.175 -0.010 -2.241
472 HB1 ALA 66 1HB ALA 66 -2.102 2.433 -2.517
473 HB2 ALA 66 2HB ALA 66 -3.574 1.895 -1.706
474 HB3 ALA 66 3HB ALA 66 -3.623 2.362 -3.406
475 H LEU 67 H LEU 67 -3.415 -1.728 -2.001
476 HA LEU 67 HA LEU 67 -5.536 -2.326 -3.821
477 HB2 LEU 67 1HB LEU 67 -4.633 -3.694 -1.293
478 HB3 LEU 67 2HB LEU 67 -5.874 -4.317 -2.363
479 HG LEU 67 HG LEU 67 -2.955 -3.929 -3.012
480 HD11 LEU 67 1HD1 LEU 67 -4.683 -6.341 -2.585
481 HD12 LEU 67 2HD1 LEU 67 -3.185 -5.893 -1.765
482 HD13 LEU 67 3HD1 LEU 67 -3.148 -6.410 -3.448
483 HD21 LEU 67 1HD2 LEU 67 -3.470 -4.888 -5.198
484 HD22 LEU 67 2HD2 LEU 67 -4.292 -3.351 -4.951
485 HD23 LEU 67 3HD2 LEU 67 -5.188 -4.863 -4.805
486 H GLY 68 H GLY 68 -7.215 -1.066 -3.740
487 HA2 GLY 68 1HA GLY 68 -9.336 -0.735 -2.416
488 HA3 GLY 68 2HA GLY 68 -8.262 -0.211 -1.121
489 H GLY 69 H GLY 69 -6.452 0.948 -3.240
490 HA2 GLY 69 1HA GLY 69 -7.778 3.553 -3.328
491 HA3 GLY 69 2HA GLY 69 -6.070 3.243 -3.600
492 H GLU 70 H GLU 70 -7.189 0.933 -5.402
493 HA GLU 70 HA GLU 70 -7.725 2.633 -7.754
494 HB2 GLU 70 1HB GLU 70 -6.548 -0.154 -7.756
495 HB3 GLU 70 2HB GLU 70 -6.716 0.919 -9.134
496 HG2 GLU 70 1HG GLU 70 -5.061 2.403 -8.266
497 HG3 GLU 70 2HG GLU 70 -4.983 1.505 -6.749
498 H ASN 71 H ASN 71 -9.578 1.541 -5.751
499 HA ASN 71 HA ASN 71 -11.556 0.476 -5.540
500 HB2 ASN 71 1HB ASN 71 -11.407 0.627 -8.541
501 HB3 ASN 71 2HB ASN 71 -12.749 -0.170 -7.728
502 HD21 ASN 71 1HD2 ASN 71 -12.669 2.241 -9.393
503 HD22 ASN 71 2HD2 ASN 71 -13.351 3.502 -8.426
504 H LEU 72 H LEU 72 -10.596 -1.230 -4.466
505 HA LEU 72 HA LEU 72 -9.576 -3.510 -5.890
506 HB2 LEU 72 1HB LEU 72 -8.644 -2.817 -3.720
507 HB3 LEU 72 2HB LEU 72 -10.185 -3.148 -2.955
508 HG LEU 72 HG LEU 72 -9.936 -5.545 -3.611
509 HD11 LEU 72 1HD1 LEU 72 -7.690 -6.326 -4.247
510 HD12 LEU 72 2HD1 LEU 72 -7.179 -4.647 -4.426
511 HD13 LEU 72 3HD1 LEU 72 -8.430 -5.305 -5.480
512 HD21 LEU 72 1HD2 LEU 72 -8.206 -6.048 -1.916
513 HD22 LEU 72 2HD2 LEU 72 -9.394 -4.863 -1.374
514 HD23 LEU 72 3HD2 LEU 72 -7.790 -4.334 -1.879
515 H TYR 73 H TYR 73 -11.545 -3.851 -7.131
516 HA TYR 73 HA TYR 73 -13.509 -5.445 -5.627
517 HB2 TYR 73 1HB TYR 73 -13.738 -4.215 -8.385
518 HB3 TYR 73 2HB TYR 73 -14.976 -5.192 -7.607
519 HD1 TYR 73 HD1 TYR 73 -14.030 -1.942 -8.334
520 HD2 TYR 73 HD2 TYR 73 -15.611 -4.272 -5.148
521 HE1 TYR 73 HE1 TYR 73 -14.994 0.087 -7.336
522 HE2 TYR 73 HE2 TYR 73 -16.578 -2.250 -4.140
523 HH TYR 73 HH TYR 73 -16.275 0.148 -4.162
524 H PHE 74 H PHE 74 -14.480 -7.041 -7.651
525 HA PHE 74 HA PHE 74 -12.386 -8.939 -8.015
526 HB2 PHE 74 1HB PHE 74 -14.853 -9.473 -7.812
527 HB3 PHE 74 2HB PHE 74 -15.036 -8.893 -9.466
528 HD1 PHE 74 HD1 PHE 74 -13.105 -11.335 -7.435
529 HD2 PHE 74 HD2 PHE 74 -14.765 -10.370 -11.229
530 HE1 PHE 74 HE1 PHE 74 -12.474 -13.558 -8.273
531 HE2 PHE 74 HE2 PHE 74 -14.142 -12.594 -12.071
532 HZ PHE 74 HZ PHE 74 -12.993 -14.190 -10.592
533 H GLN 75 H GLN 75 -13.298 -6.150 -9.651
534 HA GLN 75 HA GLN 75 -12.451 -6.714 -12.281
535 HB2 GLN 75 1HB GLN 75 -12.381 -4.106 -10.752
536 HB3 GLN 75 2HB GLN 75 -12.206 -4.270 -12.493
537 HG2 GLN 75 1HG GLN 75 -14.467 -5.167 -12.643
538 HG3 GLN 75 2HG GLN 75 -14.642 -5.011 -10.895
539 HE21 GLN 75 1HE2 GLN 75 -14.427 -3.318 -13.914
540 HE22 GLN 75 2HE2 GLN 75 -14.988 -1.792 -13.332
541 H GLY 76 H GLY 76 -10.759 -6.270 -9.337
542 HA2 GLY 76 1HA GLY 76 -8.212 -6.072 -10.808
543 HA3 GLY 76 2HA GLY 76 -8.460 -5.429 -9.190
544 H HIS 77 H HIS 77 -6.365 -7.014 -9.493
545 HA HIS 77 HA HIS 77 -5.302 -8.806 -8.621
546 HB2 HIS 77 1HB HIS 77 -6.674 -8.210 -6.606
547 HB3 HIS 77 2HB HIS 77 -7.870 -9.385 -7.133
548 HD1 HIS 77 HD1 HIS 77 -4.484 -9.103 -5.597
549 HD2 HIS 77 HD2 HIS 77 -7.151 -12.078 -6.731
550 HE1 HIS 77 HE1 HIS 77 -3.627 -11.214 -4.544
551 HE2 HIS 77 HE2 HIS 77 -5.147 -13.026 -5.398
552 H HIS 78 H HIS 78 -5.799 -9.354 -11.028
553 HA HIS 78 HA HIS 78 -6.197 -12.202 -10.936
554 HB2 HIS 78 1HB HIS 78 -7.805 -12.323 -12.790
555 HB3 HIS 78 2HB HIS 78 -8.497 -11.510 -11.395
556 HD1 HIS 78 HD1 HIS 78 -7.375 -10.902 -14.918
557 HD2 HIS 78 HD2 HIS 78 -9.215 -8.845 -11.809
558 HE1 HIS 78 HE1 HIS 78 -8.290 -8.799 -15.948
559 HE2 HIS 78 HE2 HIS 78 -9.485 -7.617 -14.072
560 H HIS 79 H HIS 79 -3.988 -10.598 -11.256
561 HA HIS 79 HA HIS 79 -3.289 -9.906 -13.878
562 HB2 HIS 79 1HB HIS 79 -2.160 -9.332 -11.603
563 HB3 HIS 79 2HB HIS 79 -1.263 -10.821 -11.855
564 HD1 HIS 79 HD1 HIS 79 -0.592 -7.497 -12.093
565 HD2 HIS 79 HD2 HIS 79 -0.331 -10.539 -14.912
566 HE1 HIS 79 HE1 HIS 79 1.023 -6.672 -13.831
567 HE2 HIS 79 HE2 HIS 79 1.094 -8.485 -15.574
568 H HIS 80 H HIS 80 -2.986 -12.927 -12.103
569 HA HIS 80 HA HIS 80 -1.931 -14.171 -14.558
570 HB2 HIS 80 1HB HIS 80 -0.493 -14.092 -12.363
571 HB3 HIS 80 2HB HIS 80 -1.545 -15.405 -11.851
572 HD1 HIS 80 HD1 HIS 80 1.450 -14.699 -13.812
573 HD2 HIS 80 HD2 HIS 80 -1.380 -17.736 -13.607
574 HE1 HIS 80 HE1 HIS 80 2.477 -16.663 -14.995
575 HE2 HIS 80 HE2 HIS 80 0.686 -18.431 -14.992
576 H HIS 81 H HIS 81 -4.708 -13.691 -13.801
577 HA HIS 81 HA HIS 81 -5.627 -16.487 -13.879
578 HB2 HIS 81 1HB HIS 81 -6.760 -14.219 -12.252
579 HB3 HIS 81 2HB HIS 81 -7.752 -15.592 -12.722
580 HD1 HIS 81 HD1 HIS 81 -7.992 -17.089 -10.785
581 HD2 HIS 81 HD2 HIS 81 -4.173 -15.470 -10.999
582 HE1 HIS 81 HE1 HIS 81 -6.736 -18.071 -8.847
583 HE2 HIS 81 HE2 HIS 81 -4.485 -16.945 -8.901
584 H HIS 82 H HIS 82 -7.100 -16.926 -15.443
585 HA HIS 82 HA HIS 82 -8.372 -14.692 -16.819
586 HB2 HIS 82 1HB HIS 82 -7.798 -15.681 -19.043
587 HB3 HIS 82 2HB HIS 82 -6.419 -15.028 -18.173
588 HD1 HIS 82 HD1 HIS 82 -4.618 -16.701 -17.376
589 HD2 HIS 82 HD2 HIS 82 -7.748 -18.448 -19.482
590 HE1 HIS 82 HE1 HIS 82 -3.845 -19.028 -17.933
591 HE2 HIS 82 HE2 HIS 82 -5.704 -20.020 -19.310
Start of MODEL 7
1 H2 MET 1 2H MET 1 5.849 -11.298 -8.145
2 H MET 1 1H MET 1 6.780 -10.112 -8.908
3 H3 MET 1 3H MET 1 7.327 -10.829 -7.477
4 HA MET 1 HA MET 1 6.507 -8.651 -7.010
5 HB2 MET 1 1HB MET 1 4.090 -8.163 -7.332
6 HB3 MET 1 2HB MET 1 4.964 -8.363 -8.841
7 HG2 MET 1 1HG MET 1 2.927 -9.458 -9.155
8 HG3 MET 1 2HG MET 1 4.094 -10.743 -8.865
9 HE1 MET 1 1HE MET 1 0.938 -11.159 -8.720
10 HE2 MET 1 2HE MET 1 0.813 -12.162 -7.276
11 HE3 MET 1 3HE MET 1 2.112 -12.444 -8.434
12 H ALA 2 H ALA 2 4.833 -8.191 -5.209
13 HA ALA 2 HA ALA 2 4.037 -10.567 -3.734
14 HB1 ALA 2 1HB ALA 2 5.985 -8.573 -2.576
15 HB2 ALA 2 2HB ALA 2 6.353 -10.242 -3.015
16 HB3 ALA 2 3HB ALA 2 5.224 -9.902 -1.701
17 H GLN 3 H GLN 3 2.491 -10.136 -2.141
18 HA GLN 3 HA GLN 3 1.422 -7.397 -2.205
19 HB2 GLN 3 1HB GLN 3 -0.022 -10.006 -1.740
20 HB3 GLN 3 2HB GLN 3 -0.760 -8.416 -1.616
21 HG2 GLN 3 1HG GLN 3 -0.395 -8.004 -3.945
22 HG3 GLN 3 2HG GLN 3 0.512 -9.505 -4.110
23 HE21 GLN 3 1HE2 GLN 3 -2.614 -8.073 -3.784
24 HE22 GLN 3 2HE2 GLN 3 -3.532 -9.489 -4.146
25 H GLY 4 H GLY 4 0.131 -6.905 -0.160
26 HA2 GLY 4 1HA GLY 4 0.606 -8.272 2.232
27 HA3 GLY 4 2HA GLY 4 1.868 -7.067 2.041
28 H THR 5 H THR 5 0.972 -6.215 4.005
29 HA THR 5 HA THR 5 -1.262 -4.387 3.441
30 HB THR 5 HB THR 5 -0.751 -5.660 6.136
31 HG1 THR 5 HG1 THR 5 -1.439 -7.315 4.790
32 HG21 THR 5 1HG2 THR 5 -3.129 -4.167 5.026
33 HG22 THR 5 2HG2 THR 5 -1.941 -3.512 6.155
34 HG23 THR 5 3HG2 THR 5 -2.993 -4.839 6.652
35 H VAL 6 H VAL 6 -0.545 -2.351 3.565
36 HA VAL 6 HA VAL 6 2.013 -1.722 4.561
37 HB VAL 6 HB VAL 6 1.328 -0.240 2.916
38 HG11 VAL 6 1HG1 VAL 6 -0.780 0.966 2.910
39 HG12 VAL 6 2HG1 VAL 6 -1.240 0.171 4.413
40 HG13 VAL 6 3HG1 VAL 6 -1.030 -0.778 2.941
41 HG21 VAL 6 1HG2 VAL 6 1.192 1.967 3.952
42 HG22 VAL 6 2HG2 VAL 6 2.388 0.953 4.761
43 HG23 VAL 6 3HG2 VAL 6 0.808 1.219 5.503
44 H LYS 7 H LYS 7 2.652 -1.626 6.556
45 HA LYS 7 HA LYS 7 0.747 -1.769 8.682
46 HB2 LYS 7 1HB LYS 7 2.748 -1.934 10.136
47 HB3 LYS 7 2HB LYS 7 2.722 -3.112 8.836
48 HG2 LYS 7 1HG LYS 7 4.351 -1.872 7.598
49 HG3 LYS 7 2HG LYS 7 4.287 -0.550 8.763
50 HD2 LYS 7 1HD LYS 7 6.256 -1.984 9.095
51 HD3 LYS 7 2HD LYS 7 5.182 -1.993 10.494
52 HE2 LYS 7 1HE LYS 7 4.208 -4.112 9.686
53 HE3 LYS 7 2HE LYS 7 5.358 -4.108 8.352
54 HZ1 LYS 7 1HZ LYS 7 5.999 -5.510 10.285
55 HZ2 LYS 7 2HZ LYS 7 6.161 -4.103 11.208
56 HZ3 LYS 7 3HZ LYS 7 7.161 -4.354 9.864
57 H TRP 8 H TRP 8 2.833 0.644 7.311
58 HA TRP 8 HA TRP 8 1.190 2.710 8.313
59 HB2 TRP 8 1HB TRP 8 2.780 3.910 9.710
60 HB3 TRP 8 2HB TRP 8 2.494 2.311 10.378
61 HD1 TRP 8 HD1 TRP 8 4.533 0.622 10.437
62 HE1 TRP 8 HE1 TRP 8 7.069 0.964 10.185
63 HE3 TRP 8 HE3 TRP 8 4.528 5.306 8.386
64 HZ2 TRP 8 HZ2 TRP 8 8.830 2.955 9.254
65 HZ3 TRP 8 HZ3 TRP 8 6.683 6.353 7.844
66 HH2 TRP 8 HH2 TRP 8 8.788 5.199 8.268
67 H PHE 9 H PHE 9 1.639 4.703 7.311
68 HA PHE 9 HA PHE 9 3.965 4.832 5.572
69 HB2 PHE 9 1HB PHE 9 2.150 3.779 4.226
70 HB3 PHE 9 2HB PHE 9 1.178 5.225 4.476
71 HD1 PHE 9 HD1 PHE 9 1.568 7.206 3.216
72 HD2 PHE 9 HD2 PHE 9 4.216 3.893 2.903
73 HE1 PHE 9 HE1 PHE 9 2.623 8.238 1.249
74 HE2 PHE 9 HE2 PHE 9 5.278 4.920 0.939
75 HZ PHE 9 HZ PHE 9 4.483 7.099 0.110
76 H ASN 10 H ASN 10 4.838 6.744 5.676
77 HA ASN 10 HA ASN 10 3.313 8.956 6.823
78 HB2 ASN 10 1HB ASN 10 5.592 8.348 7.704
79 HB3 ASN 10 2HB ASN 10 6.262 8.832 6.153
80 HD21 ASN 10 1HD2 ASN 10 6.643 9.865 8.883
81 HD22 ASN 10 2HD2 ASN 10 6.293 11.557 8.786
82 H ALA 11 H ALA 11 2.094 9.810 5.257
83 HA ALA 11 HA ALA 11 2.813 9.895 2.519
84 HB1 ALA 11 1HB ALA 11 0.770 11.209 2.243
85 HB2 ALA 11 2HB ALA 11 0.647 11.382 3.994
86 HB3 ALA 11 3HB ALA 11 0.495 9.789 3.252
87 H GLU 12 H GLU 12 3.292 12.056 5.174
88 HA GLU 12 HA GLU 12 3.645 14.452 3.689
89 HB2 GLU 12 1HB GLU 12 4.772 13.703 6.390
90 HB3 GLU 12 2HB GLU 12 4.624 15.332 5.744
91 HG2 GLU 12 1HG GLU 12 2.316 13.495 6.313
92 HG3 GLU 12 2HG GLU 12 2.886 14.767 7.389
93 H LYS 13 H LYS 13 5.808 11.976 4.924
94 HA LYS 13 HA LYS 13 8.135 13.298 3.801
95 HB2 LYS 13 1HB LYS 13 7.939 10.649 5.229
96 HB3 LYS 13 2HB LYS 13 9.409 11.550 4.892
97 HG2 LYS 13 1HG LYS 13 7.177 12.414 6.705
98 HG3 LYS 13 2HG LYS 13 8.742 11.783 7.211
99 HD2 LYS 13 1HD LYS 13 9.842 13.693 6.138
100 HD3 LYS 13 2HD LYS 13 8.264 14.322 5.662
101 HE2 LYS 13 1HE LYS 13 7.620 14.559 7.982
102 HE3 LYS 13 2HE LYS 13 9.139 13.834 8.505
103 HZ1 LYS 13 1HZ LYS 13 8.883 16.393 7.017
104 HZ2 LYS 13 2HZ LYS 13 10.328 15.701 7.564
105 HZ3 LYS 13 3HZ LYS 13 9.176 16.247 8.679
106 H GLY 14 H GLY 14 6.000 10.656 3.148
107 HA2 GLY 14 1HA GLY 14 5.575 9.842 0.996
108 HA3 GLY 14 2HA GLY 14 7.114 10.493 0.462
109 H PHE 15 H PHE 15 6.855 8.492 3.330
110 HA PHE 15 HA PHE 15 7.607 6.116 1.845
111 HB2 PHE 15 1HB PHE 15 9.688 5.725 2.898
112 HB3 PHE 15 2HB PHE 15 9.741 7.395 2.355
113 HD1 PHE 15 HD1 PHE 15 9.876 5.155 5.176
114 HD2 PHE 15 HD2 PHE 15 9.485 9.233 4.023
115 HE1 PHE 15 HE1 PHE 15 10.496 5.853 7.449
116 HE2 PHE 15 HE2 PHE 15 10.099 9.935 6.301
117 HZ PHE 15 HZ PHE 15 10.606 8.243 8.015
118 H GLY 16 H GLY 16 7.771 4.195 3.283
119 HA2 GLY 16 1HA GLY 16 6.762 4.277 5.936
120 HA3 GLY 16 2HA GLY 16 5.475 3.879 4.805
121 H PHE 17 H PHE 17 5.431 1.839 6.030
122 HA PHE 17 HA PHE 17 7.245 -0.069 4.741
123 HB2 PHE 17 1HB PHE 17 6.869 0.294 7.675
124 HB3 PHE 17 2HB PHE 17 7.053 -1.343 7.057
125 HD1 PHE 17 HD1 PHE 17 9.129 -2.090 6.100
126 HD2 PHE 17 HD2 PHE 17 8.703 1.876 7.570
127 HE1 PHE 17 HE1 PHE 17 11.571 -1.815 6.054
128 HE2 PHE 17 HE2 PHE 17 11.145 2.158 7.533
129 HZ PHE 17 HZ PHE 17 12.584 0.311 6.770
130 H ILE 18 H ILE 18 6.388 -1.995 4.249
131 HA ILE 18 HA ILE 18 3.550 -2.397 4.882
132 HB ILE 18 HB ILE 18 5.132 -3.321 2.487
133 HG12 ILE 18 1HG1 ILE 18 2.670 -1.605 2.509
134 HG13 ILE 18 2HG1 ILE 18 4.289 -0.925 2.601
135 HG21 ILE 18 1HG2 ILE 18 2.279 -3.932 3.216
136 HG22 ILE 18 2HG2 ILE 18 3.616 -5.081 3.103
137 HG23 ILE 18 3HG2 ILE 18 3.022 -4.272 1.651
138 HD11 ILE 18 1HD1 ILE 18 3.428 -0.889 0.326
139 HD12 ILE 18 2HD1 ILE 18 3.223 -2.642 0.372
140 HD13 ILE 18 3HD1 ILE 18 4.840 -1.940 0.456
141 H ALA 19 H ALA 19 2.881 -4.368 5.616
142 HA ALA 19 HA ALA 19 4.975 -6.315 6.279
143 HB1 ALA 19 1HB ALA 19 2.090 -6.183 7.171
144 HB2 ALA 19 2HB ALA 19 3.479 -5.635 8.108
145 HB3 ALA 19 3HB ALA 19 3.295 -7.348 7.726
146 HA PRO 20 HA PRO 20 3.535 -7.951 2.242
147 HB2 PRO 20 1HB PRO 20 5.779 -9.757 3.003
148 HB3 PRO 20 2HB PRO 20 5.418 -9.005 1.447
149 HG2 PRO 20 1HG PRO 20 7.353 -8.040 2.984
150 HG3 PRO 20 2HG PRO 20 6.279 -6.950 2.093
151 HD2 PRO 20 1HD PRO 20 6.315 -7.620 4.988
152 HD3 PRO 20 2HD PRO 20 5.918 -6.092 4.190
153 H ASP 21 H ASP 21 2.221 -9.591 1.794
154 HA ASP 21 HA ASP 21 1.373 -11.435 3.823
155 HB2 ASP 21 1HB ASP 21 -0.133 -10.506 2.042
156 HB3 ASP 21 2HB ASP 21 0.767 -11.441 0.853
157 H ASP 22 H ASP 22 3.857 -11.196 1.668
158 HA ASP 22 HA ASP 22 4.408 -13.938 1.098
159 HB2 ASP 22 1HB ASP 22 5.118 -12.012 -0.313
160 HB3 ASP 22 2HB ASP 22 6.208 -11.508 0.967
161 H GLY 23 H GLY 23 4.093 -12.999 3.967
162 HA2 GLY 23 1HA GLY 23 4.957 -14.268 5.794
163 HA3 GLY 23 2HA GLY 23 6.495 -14.364 4.956
164 H SER 24 H SER 24 5.351 -11.289 4.666
165 HA SER 24 HA SER 24 5.828 -9.286 5.583
166 HB2 SER 24 1HB SER 24 5.667 -10.852 8.157
167 HB3 SER 24 2HB SER 24 5.615 -9.094 8.031
168 HG SER 24 HG SER 24 3.818 -10.450 6.419
169 H ALA 25 H ALA 25 7.895 -9.049 4.680
170 HA ALA 25 HA ALA 25 10.132 -9.663 6.477
171 HB1 ALA 25 1HB ALA 25 10.190 -9.072 3.526
172 HB2 ALA 25 2HB ALA 25 10.282 -10.672 4.261
173 HB3 ALA 25 3HB ALA 25 11.576 -9.504 4.527
174 H ASP 26 H ASP 26 8.238 -7.301 6.430
175 HA ASP 26 HA ASP 26 8.232 -5.047 6.689
176 HB2 ASP 26 1HB ASP 26 11.131 -5.506 7.424
177 HB3 ASP 26 2HB ASP 26 10.232 -4.023 7.724
178 H VAL 27 H VAL 27 7.915 -4.793 4.393
179 HA VAL 27 HA VAL 27 10.301 -4.121 2.868
180 HB VAL 27 HB VAL 27 8.574 -5.612 1.887
181 HG11 VAL 27 1HG1 VAL 27 6.587 -4.570 2.771
182 HG12 VAL 27 2HG1 VAL 27 6.521 -4.645 1.008
183 HG13 VAL 27 3HG1 VAL 27 6.906 -3.121 1.814
184 HG21 VAL 27 1HG2 VAL 27 10.121 -4.461 0.453
185 HG22 VAL 27 2HG2 VAL 27 9.083 -3.033 0.436
186 HG23 VAL 27 3HG2 VAL 27 8.532 -4.535 -0.312
187 H PHE 28 H PHE 28 10.884 -2.153 2.325
188 HA PHE 28 HA PHE 28 9.618 0.081 3.639
189 HB2 PHE 28 1HB PHE 28 12.049 -0.154 3.636
190 HB3 PHE 28 2HB PHE 28 12.069 -0.118 1.879
191 HD1 PHE 28 HD1 PHE 28 11.627 1.873 4.920
192 HD2 PHE 28 HD2 PHE 28 11.868 1.945 0.673
193 HE1 PHE 28 HE1 PHE 28 11.909 4.314 4.979
194 HE2 PHE 28 HE2 PHE 28 12.148 4.388 0.725
195 HZ PHE 28 HZ PHE 28 12.169 5.576 2.883
196 H VAL 29 H VAL 29 8.258 1.496 2.742
197 HA VAL 29 HA VAL 29 7.802 1.302 -0.156
198 HB VAL 29 HB VAL 29 5.981 2.888 1.568
199 HG11 VAL 29 1HG1 VAL 29 5.552 1.007 -0.743
200 HG12 VAL 29 2HG1 VAL 29 5.604 2.769 -0.820
201 HG13 VAL 29 3HG1 VAL 29 4.296 1.961 0.046
202 HG21 VAL 29 1HG2 VAL 29 4.719 0.926 2.244
203 HG22 VAL 29 2HG2 VAL 29 6.348 0.901 2.919
204 HG23 VAL 29 3HG2 VAL 29 5.950 -0.119 1.535
205 H HIS 30 H HIS 30 7.701 3.129 -1.430
206 HA HIS 30 HA HIS 30 8.355 5.712 -0.248
207 HB2 HIS 30 1HB HIS 30 10.511 4.644 -0.870
208 HB3 HIS 30 2HB HIS 30 9.930 4.474 -2.521
209 HD1 HIS 30 HD1 HIS 30 10.830 6.182 -4.012
210 HD2 HIS 30 HD2 HIS 30 10.413 7.608 -0.123
211 HE1 HIS 30 HE1 HIS 30 11.692 8.552 -4.054
212 HE2 HIS 30 HE2 HIS 30 11.471 9.384 -1.688
213 H TYR 31 H TYR 31 7.327 7.350 -1.266
214 HA TYR 31 HA TYR 31 5.009 6.692 -2.644
215 HB2 TYR 31 1HB TYR 31 4.507 9.000 -2.694
216 HB3 TYR 31 2HB TYR 31 5.447 8.742 -1.232
217 HD1 TYR 31 HD1 TYR 31 5.215 10.514 -4.343
218 HD2 TYR 31 HD2 TYR 31 7.901 9.390 -1.243
219 HE1 TYR 31 HE1 TYR 31 6.768 12.275 -5.060
220 HE2 TYR 31 HE2 TYR 31 9.462 11.150 -1.950
221 HH TYR 31 HH TYR 31 9.980 12.453 -3.988
222 H SER 32 H SER 32 8.125 7.549 -3.958
223 HA SER 32 HA SER 32 7.180 8.238 -6.557
224 HB2 SER 32 1HB SER 32 9.945 7.299 -5.759
225 HB3 SER 32 2HB SER 32 9.514 8.224 -7.198
226 HG SER 32 HG SER 32 9.088 9.986 -5.955
227 H GLU 33 H GLU 33 7.770 5.296 -4.906
228 HA GLU 33 HA GLU 33 7.867 3.708 -7.340
229 HB2 GLU 33 1HB GLU 33 8.168 3.131 -4.419
230 HB3 GLU 33 2HB GLU 33 7.784 1.825 -5.526
231 HG2 GLU 33 1HG GLU 33 10.182 1.995 -5.060
232 HG3 GLU 33 2HG GLU 33 9.811 2.215 -6.767
233 H ILE 34 H ILE 34 5.603 4.917 -5.102
234 HA ILE 34 HA ILE 34 3.622 2.895 -5.419
235 HB ILE 34 HB ILE 34 3.329 5.746 -4.472
236 HG12 ILE 34 1HG1 ILE 34 3.582 3.150 -2.939
237 HG13 ILE 34 2HG1 ILE 34 4.804 4.412 -3.043
238 HG21 ILE 34 1HG2 ILE 34 1.408 3.430 -4.274
239 HG22 ILE 34 2HG2 ILE 34 1.208 4.870 -5.272
240 HG23 ILE 34 3HG2 ILE 34 1.193 5.007 -3.513
241 HD11 ILE 34 1HD1 ILE 34 2.096 4.649 -1.759
242 HD12 ILE 34 2HD1 ILE 34 3.269 5.957 -1.911
243 HD13 ILE 34 3HD1 ILE 34 3.652 4.539 -0.933
244 H GLN 35 H GLN 35 2.275 2.595 -7.012
245 HA GLN 35 HA GLN 35 2.233 4.424 -9.253
246 HB2 GLN 35 1HB GLN 35 0.803 1.804 -8.795
247 HB3 GLN 35 2HB GLN 35 0.880 2.671 -10.324
248 HG2 GLN 35 1HG GLN 35 3.292 1.652 -8.851
249 HG3 GLN 35 2HG GLN 35 2.459 0.749 -10.114
250 HE21 GLN 35 1HE2 GLN 35 5.193 1.919 -9.903
251 HE22 GLN 35 2HE2 GLN 35 5.381 2.863 -11.333
252 H GLY 36 H GLY 36 1.199 6.214 -8.398
253 HA2 GLY 36 1HA GLY 36 -1.152 5.989 -6.798
254 HA3 GLY 36 2HA GLY 36 -0.430 7.475 -7.384
255 H ASN 37 H ASN 37 -3.224 6.251 -7.259
256 HA ASN 37 HA ASN 37 -3.995 6.675 -10.058
257 HB2 ASN 37 1HB ASN 37 -5.626 5.669 -7.709
258 HB3 ASN 37 2HB ASN 37 -6.228 5.855 -9.351
259 HD21 ASN 37 1HD2 ASN 37 -5.561 4.420 -10.942
260 HD22 ASN 37 2HD2 ASN 37 -4.789 2.921 -10.560
261 H GLY 38 H GLY 38 -3.035 8.893 -8.842
262 HA2 GLY 38 1HA GLY 38 -4.069 11.115 -8.966
263 HA3 GLY 38 2HA GLY 38 -5.450 10.437 -8.112
264 H PHE 39 H PHE 39 -3.425 8.844 -6.521
265 HA PHE 39 HA PHE 39 -2.067 10.863 -4.950
266 HB2 PHE 39 1HB PHE 39 -3.027 10.018 -2.821
267 HB3 PHE 39 2HB PHE 39 -4.238 10.778 -3.844
268 HD1 PHE 39 HD1 PHE 39 -5.899 9.382 -5.037
269 HD2 PHE 39 HD2 PHE 39 -3.165 7.720 -2.228
270 HE1 PHE 39 HE1 PHE 39 -7.294 7.364 -4.876
271 HE2 PHE 39 HE2 PHE 39 -4.557 5.698 -2.067
272 HZ PHE 39 HZ PHE 39 -6.625 5.517 -3.391
273 H ARG 40 H ARG 40 -0.207 10.075 -4.070
274 HA ARG 40 HA ARG 40 0.333 7.214 -4.510
275 HB2 ARG 40 1HB ARG 40 2.241 9.543 -4.272
276 HB3 ARG 40 2HB ARG 40 2.729 7.863 -4.436
277 HG2 ARG 40 1HG ARG 40 1.620 7.758 -6.612
278 HG3 ARG 40 2HG ARG 40 1.153 9.451 -6.446
279 HD2 ARG 40 1HD ARG 40 3.489 10.107 -6.380
280 HD3 ARG 40 2HD ARG 40 3.981 8.417 -6.469
281 HE ARG 40 HE ARG 40 2.493 9.754 -8.641
282 HH11 ARG 40 1HH1 ARG 40 5.046 7.656 -7.504
283 HH12 ARG 40 2HH1 ARG 40 5.675 7.336 -9.085
284 HH21 ARG 40 1HH2 ARG 40 3.294 9.311 -10.740
285 HH22 ARG 40 2HH2 ARG 40 4.672 8.273 -10.931
286 H THR 41 H THR 41 -1.117 7.599 -2.364
287 HA THR 41 HA THR 41 0.772 7.576 -0.120
288 HB THR 41 HB THR 41 -1.089 8.536 1.265
289 HG1 THR 41 HG1 THR 41 -2.927 8.331 0.132
290 HG21 THR 41 1HG2 THR 41 -0.757 10.840 0.473
291 HG22 THR 41 2HG2 THR 41 -0.095 10.216 -1.039
292 HG23 THR 41 3HG2 THR 41 0.753 9.930 0.481
293 H LEU 42 H LEU 42 0.180 6.283 1.672
294 HA LEU 42 HA LEU 42 -1.793 4.193 1.077
295 HB2 LEU 42 1HB LEU 42 1.002 3.899 2.156
296 HB3 LEU 42 2HB LEU 42 -0.206 2.639 2.299
297 HG LEU 42 HG LEU 42 0.834 3.760 -0.298
298 HD11 LEU 42 1HD1 LEU 42 2.502 2.453 0.951
299 HD12 LEU 42 2HD1 LEU 42 2.001 1.665 -0.545
300 HD13 LEU 42 3HD1 LEU 42 1.373 1.099 1.003
301 HD21 LEU 42 1HD2 LEU 42 -1.424 3.000 -0.574
302 HD22 LEU 42 2HD2 LEU 42 -1.080 1.512 0.307
303 HD23 LEU 42 3HD2 LEU 42 -0.342 1.793 -1.271
304 H GLU 43 H GLU 43 -2.882 3.346 2.826
305 HA GLU 43 HA GLU 43 -2.859 5.040 5.208
306 HB2 GLU 43 1HB GLU 43 -4.893 3.097 4.119
307 HB3 GLU 43 2HB GLU 43 -5.054 3.896 5.673
308 HG2 GLU 43 1HG GLU 43 -4.843 5.305 3.027
309 HG3 GLU 43 2HG GLU 43 -6.349 4.971 3.878
310 H GLU 44 H GLU 44 -2.952 4.091 7.290
311 HA GLU 44 HA GLU 44 -1.206 1.887 7.631
312 HB2 GLU 44 1HB GLU 44 -1.454 3.786 9.220
313 HB3 GLU 44 2HB GLU 44 -3.050 3.188 9.638
314 HG2 GLU 44 1HG GLU 44 -2.017 1.096 10.423
315 HG3 GLU 44 2HG GLU 44 -0.433 1.788 10.092
316 H ASN 45 H ASN 45 -1.653 -0.165 7.568
317 HA ASN 45 HA ASN 45 -2.681 -2.168 7.732
318 HB2 ASN 45 1HB ASN 45 -4.971 -0.640 8.973
319 HB3 ASN 45 2HB ASN 45 -4.912 -2.389 8.817
320 HD21 ASN 45 1HD2 ASN 45 -3.828 0.358 10.540
321 HD22 ASN 45 2HD2 ASN 45 -2.940 -0.479 11.762
322 H GLN 46 H GLN 46 -2.900 -0.237 5.518
323 HA GLN 46 HA GLN 46 -5.345 -1.011 4.153
324 HB2 GLN 46 1HB GLN 46 -4.306 1.237 3.864
325 HB3 GLN 46 2HB GLN 46 -2.915 0.465 3.129
326 HG2 GLN 46 1HG GLN 46 -3.976 0.931 1.223
327 HG3 GLN 46 2HG GLN 46 -4.878 -0.534 1.591
328 HE21 GLN 46 1HE2 GLN 46 -4.952 2.883 1.367
329 HE22 GLN 46 2HE2 GLN 46 -6.645 3.089 1.635
330 H LYS 47 H LYS 47 -5.471 -2.572 2.556
331 HA LYS 47 HA LYS 47 -3.264 -4.399 2.321
332 HB2 LYS 47 1HB LYS 47 -6.073 -4.414 1.652
333 HB3 LYS 47 2HB LYS 47 -5.108 -4.988 0.295
334 HG2 LYS 47 1HG LYS 47 -4.778 -6.046 3.083
335 HG3 LYS 47 2HG LYS 47 -5.897 -6.748 1.912
336 HD2 LYS 47 1HD LYS 47 -4.132 -7.320 0.434
337 HD3 LYS 47 2HD LYS 47 -2.971 -6.345 1.336
338 HE2 LYS 47 1HE LYS 47 -2.698 -8.756 1.734
339 HE3 LYS 47 2HE LYS 47 -3.081 -7.863 3.202
340 HZ1 LYS 47 1HZ LYS 47 -4.312 -9.963 2.997
341 HZ2 LYS 47 2HZ LYS 47 -5.057 -9.384 1.594
342 HZ3 LYS 47 3HZ LYS 47 -5.340 -8.623 3.075
343 H VAL 48 H VAL 48 -1.953 -4.737 0.537
344 HA VAL 48 HA VAL 48 -2.061 -2.801 -1.622
345 HB VAL 48 HB VAL 48 -1.029 -1.622 0.303
346 HG11 VAL 48 1HG1 VAL 48 1.213 -2.269 1.032
347 HG12 VAL 48 2HG1 VAL 48 1.117 -3.707 0.016
348 HG13 VAL 48 3HG1 VAL 48 0.015 -3.517 1.379
349 HG21 VAL 48 1HG2 VAL 48 -0.480 -0.961 -1.971
350 HG22 VAL 48 2HG2 VAL 48 0.840 -2.131 -2.000
351 HG23 VAL 48 3HG2 VAL 48 0.904 -0.755 -0.899
352 H GLU 49 H GLU 49 -0.625 -3.239 -3.306
353 HA GLU 49 HA GLU 49 0.794 -5.816 -3.182
354 HB2 GLU 49 1HB GLU 49 -1.120 -5.941 -4.676
355 HB3 GLU 49 2HB GLU 49 -0.605 -4.483 -5.501
356 HG2 GLU 49 1HG GLU 49 1.467 -5.697 -6.171
357 HG3 GLU 49 2HG GLU 49 0.737 -7.165 -5.517
358 H PHE 50 H PHE 50 2.822 -5.878 -4.363
359 HA PHE 50 HA PHE 50 3.951 -3.465 -5.408
360 HB2 PHE 50 1HB PHE 50 5.728 -3.326 -3.594
361 HB3 PHE 50 2HB PHE 50 4.120 -2.774 -3.140
362 HD1 PHE 50 HD1 PHE 50 6.736 -5.205 -2.529
363 HD2 PHE 50 HD2 PHE 50 2.696 -4.162 -1.697
364 HE1 PHE 50 HE1 PHE 50 6.724 -6.759 -0.625
365 HE2 PHE 50 HE2 PHE 50 2.678 -5.713 0.203
366 HZ PHE 50 HZ PHE 50 4.696 -7.013 0.744
367 H GLU 51 H GLU 51 6.439 -3.757 -5.543
368 HA GLU 51 HA GLU 51 7.099 -6.582 -6.033
369 HB2 GLU 51 1HB GLU 51 6.835 -5.317 -8.140
370 HB3 GLU 51 2HB GLU 51 8.042 -4.163 -7.586
371 HG2 GLU 51 1HG GLU 51 9.743 -5.858 -7.615
372 HG3 GLU 51 2HG GLU 51 8.556 -7.092 -8.031
373 H ILE 52 H ILE 52 8.608 -7.251 -4.672
374 HA ILE 52 HA ILE 52 9.949 -5.371 -2.990
375 HB ILE 52 HB ILE 52 10.203 -8.370 -3.153
376 HG12 ILE 52 1HG1 ILE 52 8.775 -6.565 -1.196
377 HG13 ILE 52 2HG1 ILE 52 8.001 -7.547 -2.433
378 HG21 ILE 52 1HG2 ILE 52 11.340 -8.207 -0.979
379 HG22 ILE 52 2HG2 ILE 52 11.321 -6.448 -1.114
380 HG23 ILE 52 3HG2 ILE 52 12.250 -7.411 -2.263
381 HD11 ILE 52 1HD1 ILE 52 8.796 -9.567 -1.327
382 HD12 ILE 52 2HD1 ILE 52 7.825 -8.573 -0.241
383 HD13 ILE 52 3HD1 ILE 52 9.582 -8.581 -0.094
384 H GLY 53 H GLY 53 11.730 -4.381 -3.403
385 HA2 GLY 53 1HA GLY 53 13.855 -5.806 -4.878
386 HA3 GLY 53 2HA GLY 53 13.615 -4.066 -4.999
387 H GLU 54 H GLU 54 15.906 -4.024 -4.288
388 HA GLU 54 HA GLU 54 16.121 -4.413 -1.381
389 HB2 GLU 54 1HB GLU 54 18.332 -4.201 -3.423
390 HB3 GLU 54 2HB GLU 54 18.538 -4.503 -1.705
391 HG2 GLU 54 1HG GLU 54 17.339 -6.617 -1.933
392 HG3 GLU 54 2HG GLU 54 17.143 -6.317 -3.658
393 H GLY 55 H GLY 55 16.052 -2.660 -0.201
394 HA2 GLY 55 1HA GLY 55 16.573 -0.065 -1.472
395 HA3 GLY 55 2HA GLY 55 15.607 -0.324 -0.027
396 H ALA 56 H ALA 56 16.879 1.361 0.922
397 HA ALA 56 HA ALA 56 19.671 1.201 1.244
398 HB1 ALA 56 1HB ALA 56 17.646 2.651 2.939
399 HB2 ALA 56 2HB ALA 56 18.418 3.282 1.485
400 HB3 ALA 56 3HB ALA 56 19.383 2.944 2.920
401 H LYS 57 H LYS 57 17.062 0.502 3.599
402 HA LYS 57 HA LYS 57 19.095 -0.788 5.272
403 HB2 LYS 57 1HB LYS 57 16.329 0.185 5.986
404 HB3 LYS 57 2HB LYS 57 17.458 -0.566 7.105
405 HG2 LYS 57 1HG LYS 57 17.829 2.053 5.667
406 HG3 LYS 57 2HG LYS 57 17.497 1.826 7.385
407 HD2 LYS 57 1HD LYS 57 19.637 0.588 7.584
408 HD3 LYS 57 2HD LYS 57 19.967 0.954 5.891
409 HE2 LYS 57 1HE LYS 57 19.873 3.357 6.418
410 HE3 LYS 57 2HE LYS 57 19.613 2.959 8.114
411 HZ1 LYS 57 1HZ LYS 57 21.761 1.861 8.153
412 HZ2 LYS 57 2HZ LYS 57 21.933 3.469 7.662
413 HZ3 LYS 57 3HZ LYS 57 22.011 2.226 6.519
414 H GLY 58 H GLY 58 16.419 -1.498 3.288
415 HA2 GLY 58 1HA GLY 58 16.729 -4.298 3.652
416 HA3 GLY 58 2HA GLY 58 15.287 -3.723 4.480
417 HA PRO 59 HA PRO 59 14.233 -4.862 0.047
418 HB2 PRO 59 1HB PRO 59 11.730 -5.754 0.849
419 HB3 PRO 59 2HB PRO 59 13.140 -6.780 0.581
420 HG2 PRO 59 1HG PRO 59 12.048 -5.684 3.130
421 HG3 PRO 59 2HG PRO 59 12.750 -7.278 2.802
422 HD2 PRO 59 1HD PRO 59 14.148 -5.388 4.070
423 HD3 PRO 59 2HD PRO 59 14.927 -6.474 2.902
424 H GLN 60 H GLN 60 12.980 -3.642 -1.292
425 HA GLN 60 HA GLN 60 11.393 -1.527 0.007
426 HB2 GLN 60 1HB GLN 60 12.017 -0.028 -1.824
427 HB3 GLN 60 2HB GLN 60 13.431 -0.596 -0.948
428 HG2 GLN 60 1HG GLN 60 13.966 -2.146 -2.699
429 HG3 GLN 60 2HG GLN 60 12.466 -1.771 -3.544
430 HE21 GLN 60 1HE2 GLN 60 12.693 1.081 -2.947
431 HE22 GLN 60 2HE2 GLN 60 13.910 1.690 -4.008
432 H ALA 61 H ALA 61 9.457 -0.999 -0.822
433 HA ALA 61 HA ALA 61 8.247 -2.917 -2.626
434 HB1 ALA 61 1HB ALA 61 7.065 -0.567 -1.145
435 HB2 ALA 61 2HB ALA 61 7.028 -2.253 -0.626
436 HB3 ALA 61 3HB ALA 61 6.152 -1.756 -2.074
437 H GLN 62 H GLN 62 8.579 -2.608 -4.709
438 HA GLN 62 HA GLN 62 8.576 0.128 -5.780
439 HB2 GLN 62 1HB GLN 62 9.475 -2.422 -7.123
440 HB3 GLN 62 2HB GLN 62 9.711 -0.781 -7.711
441 HG2 GLN 62 1HG GLN 62 11.234 -0.294 -5.942
442 HG3 GLN 62 2HG GLN 62 10.878 -1.825 -5.147
443 HE21 GLN 62 1HE2 GLN 62 11.596 -3.746 -6.105
444 HE22 GLN 62 2HE2 GLN 62 12.928 -3.754 -7.205
445 H GLN 63 H GLN 63 7.291 0.609 -7.596
446 HA GLN 63 HA GLN 63 5.347 0.639 -8.760
447 HB2 GLN 63 1HB GLN 63 6.186 -2.234 -9.035
448 HB3 GLN 63 2HB GLN 63 4.738 -1.627 -9.820
449 HG2 GLN 63 1HG GLN 63 6.556 -1.638 -11.385
450 HG3 GLN 63 2HG GLN 63 6.111 0.025 -11.020
451 HE21 GLN 63 1HE2 GLN 63 7.566 1.353 -9.991
452 HE22 GLN 63 2HE2 GLN 63 9.212 0.906 -9.721
453 H VAL 64 H VAL 64 4.772 0.860 -6.265
454 HA VAL 64 HA VAL 64 3.326 -1.301 -5.091
455 HB VAL 64 HB VAL 64 3.196 1.566 -4.198
456 HG11 VAL 64 1HG1 VAL 64 3.014 0.546 -1.971
457 HG12 VAL 64 2HG1 VAL 64 3.032 -1.049 -2.723
458 HG13 VAL 64 3HG1 VAL 64 1.704 0.066 -3.050
459 HG21 VAL 64 1HG2 VAL 64 5.201 1.140 -2.842
460 HG22 VAL 64 2HG2 VAL 64 5.538 1.067 -4.571
461 HG23 VAL 64 3HG2 VAL 64 5.390 -0.422 -3.639
462 H HIS 65 H HIS 65 1.235 -1.744 -5.148
463 HA HIS 65 HA HIS 65 -0.584 0.171 -6.464
464 HB2 HIS 65 1HB HIS 65 -0.744 -2.850 -6.492
465 HB3 HIS 65 2HB HIS 65 -1.878 -1.759 -7.264
466 HD1 HIS 65 HD1 HIS 65 0.497 -3.992 -8.307
467 HD2 HIS 65 HD2 HIS 65 -0.030 0.060 -9.060
468 HE1 HIS 65 HE1 HIS 65 1.762 -3.526 -10.428
469 HE2 HIS 65 HE2 HIS 65 1.225 -1.128 -10.979
470 H ALA 66 H ALA 66 -1.976 0.991 -5.047
471 HA ALA 66 HA ALA 66 -2.381 -0.200 -2.477
472 HB1 ALA 66 1HB ALA 66 -3.835 2.113 -3.752
473 HB2 ALA 66 2HB ALA 66 -2.360 2.232 -2.793
474 HB3 ALA 66 3HB ALA 66 -3.856 1.677 -2.042
475 H LEU 67 H LEU 67 -3.546 -1.964 -2.272
476 HA LEU 67 HA LEU 67 -5.662 -2.636 -4.111
477 HB2 LEU 67 1HB LEU 67 -4.771 -4.019 -1.582
478 HB3 LEU 67 2HB LEU 67 -5.839 -4.692 -2.797
479 HG LEU 67 HG LEU 67 -2.922 -4.020 -3.186
480 HD11 LEU 67 1HD1 LEU 67 -3.366 -5.966 -1.735
481 HD12 LEU 67 2HD1 LEU 67 -2.576 -6.400 -3.248
482 HD13 LEU 67 3HD1 LEU 67 -4.302 -6.694 -3.040
483 HD21 LEU 67 1HD2 LEU 67 -4.898 -5.319 -5.060
484 HD22 LEU 67 2HD2 LEU 67 -3.168 -5.139 -5.349
485 HD23 LEU 67 3HD2 LEU 67 -4.197 -3.711 -5.243
486 H GLY 68 H GLY 68 -5.325 -1.600 -0.781
487 HA2 GLY 68 1HA GLY 68 -6.934 -0.323 0.377
488 HA3 GLY 68 2HA GLY 68 -8.164 -0.898 -0.741
489 H GLY 69 H GLY 69 -8.740 -3.206 -0.584
490 HA2 GLY 69 1HA GLY 69 -9.029 -5.185 0.659
491 HA3 GLY 69 2HA GLY 69 -8.241 -4.413 2.028
492 H GLU 70 H GLU 70 -9.427 -3.044 3.376
493 HA GLU 70 HA GLU 70 -12.321 -3.487 3.210
494 HB2 GLU 70 1HB GLU 70 -10.641 -2.569 5.548
495 HB3 GLU 70 2HB GLU 70 -12.370 -2.876 5.590
496 HG2 GLU 70 1HG GLU 70 -10.210 -4.906 5.069
497 HG3 GLU 70 2HG GLU 70 -11.146 -4.725 6.552
498 H ASN 71 H ASN 71 -12.389 -1.839 1.510
499 HA ASN 71 HA ASN 71 -12.656 0.839 2.709
500 HB2 ASN 71 1HB ASN 71 -11.684 0.100 -0.054
501 HB3 ASN 71 2HB ASN 71 -12.277 1.710 0.334
502 HD21 ASN 71 1HD2 ASN 71 -9.643 0.871 -0.536
503 HD22 ASN 71 2HD2 ASN 71 -8.539 1.387 0.695
504 H LEU 72 H LEU 72 -14.278 2.202 1.486
505 HA LEU 72 HA LEU 72 -16.456 2.545 0.965
506 HB2 LEU 72 1HB LEU 72 -15.928 0.099 -0.712
507 HB3 LEU 72 2HB LEU 72 -17.484 0.903 -0.707
508 HG LEU 72 HG LEU 72 -16.232 3.011 -1.418
509 HD11 LEU 72 1HD1 LEU 72 -14.101 2.663 -2.562
510 HD12 LEU 72 2HD1 LEU 72 -14.081 0.987 -2.014
511 HD13 LEU 72 3HD1 LEU 72 -13.980 2.301 -0.841
512 HD21 LEU 72 1HD2 LEU 72 -16.205 2.324 -3.765
513 HD22 LEU 72 2HD2 LEU 72 -17.639 1.731 -2.926
514 HD23 LEU 72 3HD2 LEU 72 -16.301 0.635 -3.268
515 H TYR 73 H TYR 73 -17.002 2.181 3.165
516 HA TYR 73 HA TYR 73 -17.710 -0.474 4.038
517 HB2 TYR 73 1HB TYR 73 -18.030 2.172 5.473
518 HB3 TYR 73 2HB TYR 73 -18.145 0.570 6.201
519 HD1 TYR 73 HD1 TYR 73 -16.021 -0.958 5.839
520 HD2 TYR 73 HD2 TYR 73 -16.003 3.288 5.592
521 HE1 TYR 73 HE1 TYR 73 -13.594 -0.952 6.223
522 HE2 TYR 73 HE2 TYR 73 -13.576 3.306 5.976
523 HH TYR 73 HH TYR 73 -11.660 0.586 5.673
524 H PHE 74 H PHE 74 -19.245 0.535 1.857
525 HA PHE 74 HA PHE 74 -21.909 1.022 2.858
526 HB2 PHE 74 1HB PHE 74 -21.105 1.885 0.651
527 HB3 PHE 74 2HB PHE 74 -20.990 0.228 0.079
528 HD1 PHE 74 HD1 PHE 74 -23.312 2.877 1.148
529 HD2 PHE 74 HD2 PHE 74 -22.908 -0.953 -0.663
530 HE1 PHE 74 HE1 PHE 74 -25.650 2.990 0.396
531 HE2 PHE 74 HE2 PHE 74 -25.247 -0.846 -1.417
532 HZ PHE 74 HZ PHE 74 -26.622 1.127 -0.889
533 H GLN 75 H GLN 75 -19.927 -1.562 1.732
534 HA GLN 75 HA GLN 75 -19.952 -3.792 1.957
535 HB2 GLN 75 1HB GLN 75 -20.383 -2.989 4.358
536 HB3 GLN 75 2HB GLN 75 -22.045 -3.494 4.093
537 HG2 GLN 75 1HG GLN 75 -20.785 -5.221 5.239
538 HG3 GLN 75 2HG GLN 75 -21.290 -5.772 3.643
539 HE21 GLN 75 1HE2 GLN 75 -19.117 -6.709 5.361
540 HE22 GLN 75 2HE2 GLN 75 -17.675 -6.566 4.416
541 H GLY 76 H GLY 76 -21.601 -2.759 -0.034
542 HA2 GLY 76 1HA GLY 76 -24.108 -4.206 0.018
543 HA3 GLY 76 2HA GLY 76 -23.493 -3.225 -1.302
544 H HIS 77 H HIS 77 -22.607 -6.222 0.412
545 HA HIS 77 HA HIS 77 -21.998 -7.408 -2.219
546 HB2 HIS 77 1HB HIS 77 -20.607 -7.950 0.415
547 HB3 HIS 77 2HB HIS 77 -20.296 -8.816 -1.083
548 HD1 HIS 77 HD1 HIS 77 -19.132 -7.404 -3.021
549 HD2 HIS 77 HD2 HIS 77 -19.250 -5.596 0.722
550 HE1 HIS 77 HE1 HIS 77 -17.435 -5.550 -3.109
551 HE2 HIS 77 HE2 HIS 77 -17.603 -4.402 -0.872
552 H HIS 78 H HIS 78 -24.533 -7.509 -1.158
553 HA HIS 78 HA HIS 78 -26.248 -8.931 -0.788
554 HB2 HIS 78 1HB HIS 78 -24.150 -11.054 -1.233
555 HB3 HIS 78 2HB HIS 78 -25.856 -11.402 -0.998
556 HD1 HIS 78 HD1 HIS 78 -27.317 -11.320 -3.038
557 HD2 HIS 78 HD2 HIS 78 -23.610 -9.543 -3.648
558 HE1 HIS 78 HE1 HIS 78 -27.212 -10.794 -5.495
559 HE2 HIS 78 HE2 HIS 78 -24.929 -9.787 -5.857
560 H HIS 79 H HIS 79 -23.842 -11.044 0.714
561 HA HIS 79 HA HIS 79 -25.122 -10.517 3.299
562 HB2 HIS 79 1HB HIS 79 -23.182 -12.698 2.500
563 HB3 HIS 79 2HB HIS 79 -23.882 -12.511 4.100
564 HD1 HIS 79 HD1 HIS 79 -24.259 -14.606 1.373
565 HD2 HIS 79 HD2 HIS 79 -26.977 -12.386 3.608
566 HE1 HIS 79 HE1 HIS 79 -26.494 -15.707 1.017
567 HE2 HIS 79 HE2 HIS 79 -28.136 -14.286 2.293
568 H HIS 80 H HIS 80 -21.783 -11.300 2.338
569 HA HIS 80 HA HIS 80 -20.844 -8.690 3.035
570 HB2 HIS 80 1HB HIS 80 -19.369 -9.319 4.876
571 HB3 HIS 80 2HB HIS 80 -21.046 -9.636 5.295
572 HD1 HIS 80 HD1 HIS 80 -21.655 -12.009 5.933
573 HD2 HIS 80 HD2 HIS 80 -17.799 -11.675 4.410
574 HE1 HIS 80 HE1 HIS 80 -20.555 -14.227 6.375
575 HE2 HIS 80 HE2 HIS 80 -18.260 -14.033 5.357
576 H HIS 81 H HIS 81 -20.738 -11.151 1.074
577 HA HIS 81 HA HIS 81 -18.209 -10.534 -0.048
578 HB2 HIS 81 1HB HIS 81 -17.397 -11.926 1.815
579 HB3 HIS 81 2HB HIS 81 -18.455 -13.234 1.303
580 HD1 HIS 81 HD1 HIS 81 -17.366 -14.945 -0.117
581 HD2 HIS 81 HD2 HIS 81 -15.418 -11.283 -0.330
582 HE1 HIS 81 HE1 HIS 81 -15.336 -15.342 -1.536
583 HE2 HIS 81 HE2 HIS 81 -14.068 -13.166 -1.466
584 H HIS 82 H HIS 82 -18.545 -10.738 -2.161
585 HA HIS 82 HA HIS 82 -19.624 -13.097 -3.328
586 HB2 HIS 82 1HB HIS 82 -21.726 -11.999 -2.554
587 HB3 HIS 82 2HB HIS 82 -21.327 -10.602 -3.543
588 HD1 HIS 82 HD1 HIS 82 -22.804 -13.978 -3.692
589 HD2 HIS 82 HD2 HIS 82 -21.528 -11.065 -6.367
590 HE1 HIS 82 HE1 HIS 82 -23.818 -14.602 -5.907
591 HE2 HIS 82 HE2 HIS 82 -22.923 -12.901 -7.536
Start of MODEL 8
1 H2 MET 1 2H MET 1 7.782 -10.253 -6.814
2 H MET 1 1H MET 1 6.791 -11.231 -7.770
3 H3 MET 1 3H MET 1 7.407 -9.781 -8.392
4 HA MET 1 HA MET 1 6.125 -8.499 -6.863
5 HB2 MET 1 1HB MET 1 4.579 -10.595 -8.385
6 HB3 MET 1 2HB MET 1 3.803 -9.235 -7.588
7 HG2 MET 1 1HG MET 1 5.902 -9.008 -9.730
8 HG3 MET 1 2HG MET 1 4.166 -8.882 -9.996
9 HE1 MET 1 1HE MET 1 3.253 -5.612 -8.065
10 HE2 MET 1 2HE MET 1 3.204 -7.246 -7.406
11 HE3 MET 1 3HE MET 1 2.654 -6.943 -9.054
12 H ALA 2 H ALA 2 4.800 -8.315 -5.094
13 HA ALA 2 HA ALA 2 3.990 -10.715 -3.656
14 HB1 ALA 2 1HB ALA 2 5.022 -9.958 -1.562
15 HB2 ALA 2 2HB ALA 2 5.788 -8.623 -2.424
16 HB3 ALA 2 3HB ALA 2 6.237 -10.289 -2.797
17 H GLN 3 H GLN 3 2.608 -10.144 -1.797
18 HA GLN 3 HA GLN 3 1.301 -7.533 -2.133
19 HB2 GLN 3 1HB GLN 3 -0.053 -10.175 -1.562
20 HB3 GLN 3 2HB GLN 3 -0.851 -8.612 -1.647
21 HG2 GLN 3 1HG GLN 3 -0.304 -8.421 -3.988
22 HG3 GLN 3 2HG GLN 3 0.597 -9.934 -3.926
23 HE21 GLN 3 1HE2 GLN 3 -2.516 -8.462 -4.009
24 HE22 GLN 3 2HE2 GLN 3 -3.427 -9.903 -4.266
25 H GLY 4 H GLY 4 -0.070 -7.058 -0.121
26 HA2 GLY 4 1HA GLY 4 0.303 -8.349 2.296
27 HA3 GLY 4 2HA GLY 4 1.643 -7.227 2.135
28 H THR 5 H THR 5 0.904 -6.139 3.946
29 HA THR 5 HA THR 5 -1.331 -4.313 3.395
30 HB THR 5 HB THR 5 -0.740 -5.430 6.137
31 HG1 THR 5 HG1 THR 5 -1.548 -7.209 5.224
32 HG21 THR 5 1HG2 THR 5 -3.157 -4.021 5.000
33 HG22 THR 5 2HG2 THR 5 -1.937 -3.291 6.045
34 HG23 THR 5 3HG2 THR 5 -2.971 -4.582 6.663
35 H VAL 6 H VAL 6 -0.572 -2.282 3.411
36 HA VAL 6 HA VAL 6 1.964 -1.597 4.437
37 HB VAL 6 HB VAL 6 1.278 -0.126 2.784
38 HG11 VAL 6 1HG1 VAL 6 -1.350 0.181 4.207
39 HG12 VAL 6 2HG1 VAL 6 -1.060 -0.713 2.716
40 HG13 VAL 6 3HG1 VAL 6 -0.873 1.038 2.745
41 HG21 VAL 6 1HG2 VAL 6 0.640 1.324 5.350
42 HG22 VAL 6 2HG2 VAL 6 1.071 2.075 3.813
43 HG23 VAL 6 3HG2 VAL 6 2.252 1.084 4.672
44 H LYS 7 H LYS 7 2.523 -1.601 6.464
45 HA LYS 7 HA LYS 7 0.561 -1.747 8.523
46 HB2 LYS 7 1HB LYS 7 2.519 -1.865 10.052
47 HB3 LYS 7 2HB LYS 7 2.533 -3.064 8.771
48 HG2 LYS 7 1HG LYS 7 4.218 -1.885 7.581
49 HG3 LYS 7 2HG LYS 7 4.084 -0.496 8.661
50 HD2 LYS 7 1HD LYS 7 6.054 -1.932 9.134
51 HD3 LYS 7 2HD LYS 7 4.954 -1.773 10.503
52 HE2 LYS 7 1HE LYS 7 3.939 -3.946 9.874
53 HE3 LYS 7 2HE LYS 7 5.145 -4.106 8.600
54 HZ1 LYS 7 1HZ LYS 7 5.853 -3.788 11.460
55 HZ2 LYS 7 2HZ LYS 7 6.867 -4.264 10.189
56 HZ3 LYS 7 3HZ LYS 7 5.639 -5.296 10.729
57 H TRP 8 H TRP 8 2.654 0.705 7.244
58 HA TRP 8 HA TRP 8 0.949 2.732 8.196
59 HB2 TRP 8 1HB TRP 8 2.434 3.932 9.688
60 HB3 TRP 8 2HB TRP 8 2.146 2.316 10.315
61 HD1 TRP 8 HD1 TRP 8 4.221 0.661 10.434
62 HE1 TRP 8 HE1 TRP 8 6.760 1.071 10.327
63 HE3 TRP 8 HE3 TRP 8 4.198 5.397 8.520
64 HZ2 TRP 8 HZ2 TRP 8 8.516 3.133 9.544
65 HZ3 TRP 8 HZ3 TRP 8 6.349 6.518 8.122
66 HH2 TRP 8 HH2 TRP 8 8.458 5.406 8.625
67 H PHE 9 H PHE 9 1.505 4.799 7.386
68 HA PHE 9 HA PHE 9 3.837 5.044 5.686
69 HB2 PHE 9 1HB PHE 9 2.078 3.917 4.282
70 HB3 PHE 9 2HB PHE 9 1.063 5.334 4.509
71 HD1 PHE 9 HD1 PHE 9 3.992 3.966 2.845
72 HD2 PHE 9 HD2 PHE 9 1.600 7.437 3.411
73 HE1 PHE 9 HE1 PHE 9 5.056 5.013 0.892
74 HE2 PHE 9 HE2 PHE 9 2.656 8.490 1.458
75 HZ PHE 9 HZ PHE 9 4.388 7.278 0.197
76 H ASN 10 H ASN 10 4.567 7.093 5.810
77 HA ASN 10 HA ASN 10 2.647 9.124 6.724
78 HB2 ASN 10 1HB ASN 10 4.572 10.377 7.645
79 HB3 ASN 10 2HB ASN 10 4.347 8.809 8.398
80 HD21 ASN 10 1HD2 ASN 10 6.679 10.513 8.308
81 HD22 ASN 10 2HD2 ASN 10 7.935 9.557 7.602
82 H ALA 11 H ALA 11 1.918 10.148 5.056
83 HA ALA 11 HA ALA 11 3.258 10.292 2.567
84 HB1 ALA 11 1HB ALA 11 0.817 11.782 3.511
85 HB2 ALA 11 2HB ALA 11 0.829 10.189 2.755
86 HB3 ALA 11 3HB ALA 11 1.342 11.605 1.838
87 H GLU 12 H GLU 12 3.329 12.307 5.337
88 HA GLU 12 HA GLU 12 3.925 14.782 4.165
89 HB2 GLU 12 1HB GLU 12 3.390 14.515 6.550
90 HB3 GLU 12 2HB GLU 12 4.905 13.652 6.788
91 HG2 GLU 12 1HG GLU 12 5.070 15.959 7.529
92 HG3 GLU 12 2HG GLU 12 6.157 15.636 6.181
93 H LYS 13 H LYS 13 5.978 12.089 5.144
94 HA LYS 13 HA LYS 13 8.321 13.388 4.000
95 HB2 LYS 13 1HB LYS 13 8.074 10.664 5.268
96 HB3 LYS 13 2HB LYS 13 9.564 11.525 4.914
97 HG2 LYS 13 1HG LYS 13 7.475 12.489 6.841
98 HG3 LYS 13 2HG LYS 13 8.888 11.545 7.304
99 HD2 LYS 13 1HD LYS 13 10.319 13.321 6.330
100 HD3 LYS 13 2HD LYS 13 8.863 14.273 6.035
101 HE2 LYS 13 1HE LYS 13 8.368 14.295 8.411
102 HE3 LYS 13 2HE LYS 13 9.772 13.281 8.732
103 HZ1 LYS 13 1HZ LYS 13 9.845 16.027 7.607
104 HZ2 LYS 13 2HZ LYS 13 11.192 15.056 7.915
105 HZ3 LYS 13 3HZ LYS 13 10.233 15.601 9.197
106 H GLY 14 H GLY 14 6.077 10.794 3.436
107 HA2 GLY 14 1HA GLY 14 5.449 10.083 1.283
108 HA3 GLY 14 2HA GLY 14 6.978 10.682 0.661
109 H PHE 15 H PHE 15 6.749 8.609 3.498
110 HA PHE 15 HA PHE 15 7.415 6.293 1.868
111 HB2 PHE 15 1HB PHE 15 9.403 5.716 3.041
112 HB3 PHE 15 2HB PHE 15 9.572 7.386 2.530
113 HD1 PHE 15 HD1 PHE 15 9.411 9.206 4.202
114 HD2 PHE 15 HD2 PHE 15 9.441 5.103 5.323
115 HE1 PHE 15 HE1 PHE 15 10.031 9.839 6.498
116 HE2 PHE 15 HE2 PHE 15 10.055 5.730 7.617
117 HZ PHE 15 HZ PHE 15 10.348 8.099 8.209
118 H GLY 16 H GLY 16 7.780 4.344 3.514
119 HA2 GLY 16 1HA GLY 16 6.460 4.283 5.969
120 HA3 GLY 16 2HA GLY 16 5.269 3.914 4.727
121 H PHE 17 H PHE 17 5.217 1.837 5.957
122 HA PHE 17 HA PHE 17 7.127 -0.014 4.724
123 HB2 PHE 17 1HB PHE 17 6.590 0.282 7.650
124 HB3 PHE 17 2HB PHE 17 6.930 -1.316 6.998
125 HD1 PHE 17 HD1 PHE 17 9.103 -1.840 6.053
126 HD2 PHE 17 HD2 PHE 17 8.301 1.959 7.785
127 HE1 PHE 17 HE1 PHE 17 11.516 -1.387 6.157
128 HE2 PHE 17 HE2 PHE 17 10.714 2.421 7.899
129 HZ PHE 17 HZ PHE 17 12.328 0.749 7.084
130 H ILE 18 H ILE 18 6.346 -1.985 4.225
131 HA ILE 18 HA ILE 18 3.489 -2.450 4.744
132 HB ILE 18 HB ILE 18 5.166 -3.336 2.396
133 HG12 ILE 18 1HG1 ILE 18 2.688 -1.631 2.382
134 HG13 ILE 18 2HG1 ILE 18 4.308 -0.953 2.480
135 HG21 ILE 18 1HG2 ILE 18 2.293 -3.977 3.024
136 HG22 ILE 18 2HG2 ILE 18 3.642 -5.114 2.985
137 HG23 ILE 18 3HG2 ILE 18 3.106 -4.328 1.498
138 HD11 ILE 18 1HD1 ILE 18 4.872 -1.961 0.341
139 HD12 ILE 18 2HD1 ILE 18 3.448 -0.927 0.199
140 HD13 ILE 18 3HD1 ILE 18 3.265 -2.682 0.249
141 H ALA 19 H ALA 19 2.850 -4.405 5.495
142 HA ALA 19 HA ALA 19 4.952 -6.345 6.163
143 HB1 ALA 19 1HB ALA 19 3.521 -5.623 8.024
144 HB2 ALA 19 2HB ALA 19 3.308 -7.339 7.676
145 HB3 ALA 19 3HB ALA 19 2.098 -6.172 7.140
146 HA PRO 20 HA PRO 20 3.384 -8.119 2.254
147 HB2 PRO 20 1HB PRO 20 5.632 -9.931 2.958
148 HB3 PRO 20 2HB PRO 20 5.241 -9.174 1.413
149 HG2 PRO 20 1HG PRO 20 7.233 -8.237 2.892
150 HG3 PRO 20 2HG PRO 20 6.143 -7.128 2.041
151 HD2 PRO 20 1HD PRO 20 6.235 -7.850 4.933
152 HD3 PRO 20 2HD PRO 20 5.896 -6.284 4.170
153 H ASP 21 H ASP 21 2.119 -9.816 1.847
154 HA ASP 21 HA ASP 21 1.167 -11.418 4.028
155 HB2 ASP 21 1HB ASP 21 -0.350 -10.595 2.295
156 HB3 ASP 21 2HB ASP 21 0.544 -11.480 1.067
157 H ASP 22 H ASP 22 3.702 -11.646 1.868
158 HA ASP 22 HA ASP 22 3.758 -14.502 1.529
159 HB2 ASP 22 1HB ASP 22 4.645 -12.751 -0.110
160 HB3 ASP 22 2HB ASP 22 6.026 -12.603 0.965
161 H GLY 23 H GLY 23 3.831 -13.380 4.267
162 HA2 GLY 23 1HA GLY 23 4.815 -14.521 6.135
163 HA3 GLY 23 2HA GLY 23 6.271 -14.743 5.180
164 H SER 24 H SER 24 5.209 -11.707 4.623
165 HA SER 24 HA SER 24 5.563 -9.629 5.395
166 HB2 SER 24 1HB SER 24 5.710 -11.019 8.063
167 HB3 SER 24 2HB SER 24 5.621 -9.270 7.845
168 HG SER 24 HG SER 24 3.682 -10.301 6.393
169 H ALA 25 H ALA 25 7.671 -10.136 4.151
170 HA ALA 25 HA ALA 25 9.977 -9.606 5.828
171 HB1 ALA 25 1HB ALA 25 10.308 -10.887 3.777
172 HB2 ALA 25 2HB ALA 25 11.185 -9.358 3.695
173 HB3 ALA 25 3HB ALA 25 9.663 -9.552 2.824
174 H ASP 26 H ASP 26 9.408 -7.751 6.894
175 HA ASP 26 HA ASP 26 8.011 -5.575 6.253
176 HB2 ASP 26 1HB ASP 26 10.683 -5.517 7.660
177 HB3 ASP 26 2HB ASP 26 9.495 -4.218 7.696
178 H VAL 27 H VAL 27 7.927 -4.543 4.414
179 HA VAL 27 HA VAL 27 10.423 -4.004 2.980
180 HB VAL 27 HB VAL 27 8.817 -5.451 1.821
181 HG11 VAL 27 1HG1 VAL 27 6.753 -4.612 2.741
182 HG12 VAL 27 2HG1 VAL 27 6.713 -4.542 0.978
183 HG13 VAL 27 3HG1 VAL 27 6.991 -3.070 1.912
184 HG21 VAL 27 1HG2 VAL 27 10.304 -4.081 0.501
185 HG22 VAL 27 2HG2 VAL 27 9.150 -2.749 0.548
186 HG23 VAL 27 3HG2 VAL 27 8.741 -4.242 -0.300
187 H PHE 28 H PHE 28 11.019 -2.025 2.462
188 HA PHE 28 HA PHE 28 9.673 0.197 3.722
189 HB2 PHE 28 1HB PHE 28 12.128 -0.026 3.787
190 HB3 PHE 28 2HB PHE 28 12.182 0.078 2.034
191 HD1 PHE 28 HD1 PHE 28 11.948 2.180 0.907
192 HD2 PHE 28 HD2 PHE 28 11.629 1.941 5.139
193 HE1 PHE 28 HE1 PHE 28 12.165 4.626 1.055
194 HE2 PHE 28 HE2 PHE 28 11.841 4.386 5.298
195 HZ PHE 28 HZ PHE 28 12.109 5.731 3.254
196 H VAL 29 H VAL 29 8.517 1.761 2.728
197 HA VAL 29 HA VAL 29 8.209 1.523 -0.197
198 HB VAL 29 HB VAL 29 6.130 2.816 1.510
199 HG11 VAL 29 1HG1 VAL 29 6.024 1.262 -1.063
200 HG12 VAL 29 2HG1 VAL 29 5.964 3.016 -0.899
201 HG13 VAL 29 3HG1 VAL 29 4.648 2.025 -0.270
202 HG21 VAL 29 1HG2 VAL 29 6.534 0.678 2.598
203 HG22 VAL 29 2HG2 VAL 29 6.323 -0.152 1.054
204 HG23 VAL 29 3HG2 VAL 29 4.966 0.704 1.790
205 H HIS 30 H HIS 30 8.463 3.318 -1.403
206 HA HIS 30 HA HIS 30 8.472 5.926 -0.048
207 HB2 HIS 30 1HB HIS 30 10.790 5.057 -0.761
208 HB3 HIS 30 2HB HIS 30 10.239 5.291 -2.415
209 HD1 HIS 30 HD1 HIS 30 10.954 7.464 -3.358
210 HD2 HIS 30 HD2 HIS 30 10.449 7.655 0.764
211 HE1 HIS 30 HE1 HIS 30 11.598 9.805 -2.701
212 HE2 HIS 30 HE2 HIS 30 11.500 9.819 -0.183
213 H TYR 31 H TYR 31 7.336 7.502 -1.100
214 HA TYR 31 HA TYR 31 5.150 6.599 -2.557
215 HB2 TYR 31 1HB TYR 31 4.364 8.806 -2.549
216 HB3 TYR 31 2HB TYR 31 5.366 8.691 -1.110
217 HD1 TYR 31 HD1 TYR 31 7.758 9.604 -1.252
218 HD2 TYR 31 HD2 TYR 31 4.759 10.451 -4.147
219 HE1 TYR 31 HE1 TYR 31 9.035 11.568 -1.996
220 HE2 TYR 31 HE2 TYR 31 6.026 12.412 -4.901
221 HH TYR 31 HH TYR 31 9.258 12.980 -3.989
222 H SER 32 H SER 32 8.230 7.449 -3.761
223 HA SER 32 HA SER 32 7.447 8.331 -6.343
224 HB2 SER 32 1HB SER 32 9.893 7.698 -6.871
225 HB3 SER 32 2HB SER 32 9.611 8.959 -5.668
226 HG SER 32 HG SER 32 10.473 6.296 -5.320
227 H GLU 33 H GLU 33 7.748 5.220 -4.866
228 HA GLU 33 HA GLU 33 7.771 3.847 -7.448
229 HB2 GLU 33 1HB GLU 33 8.011 2.879 -4.606
230 HB3 GLU 33 2HB GLU 33 7.796 1.780 -5.957
231 HG2 GLU 33 1HG GLU 33 10.111 1.876 -5.413
232 HG3 GLU 33 2HG GLU 33 9.866 2.679 -6.960
233 H ILE 34 H ILE 34 5.605 4.909 -5.061
234 HA ILE 34 HA ILE 34 3.618 2.899 -5.386
235 HB ILE 34 HB ILE 34 3.341 5.700 -4.301
236 HG12 ILE 34 1HG1 ILE 34 3.734 3.066 -2.875
237 HG13 ILE 34 2HG1 ILE 34 4.941 4.336 -3.038
238 HG21 ILE 34 1HG2 ILE 34 1.190 4.798 -4.994
239 HG22 ILE 34 2HG2 ILE 34 1.290 4.876 -3.234
240 HG23 ILE 34 3HG2 ILE 34 1.491 3.331 -4.063
241 HD11 ILE 34 1HD1 ILE 34 3.547 5.840 -1.737
242 HD12 ILE 34 2HD1 ILE 34 3.896 4.360 -0.843
243 HD13 ILE 34 3HD1 ILE 34 2.318 4.589 -1.596
244 H GLN 35 H GLN 35 1.860 2.852 -6.636
245 HA GLN 35 HA GLN 35 1.813 4.736 -8.879
246 HB2 GLN 35 1HB GLN 35 0.654 1.964 -8.567
247 HB3 GLN 35 2HB GLN 35 0.515 2.954 -10.014
248 HG2 GLN 35 1HG GLN 35 3.114 2.054 -8.809
249 HG3 GLN 35 2HG GLN 35 2.290 1.240 -10.137
250 HE21 GLN 35 1HE2 GLN 35 4.915 2.564 -9.982
251 HE22 GLN 35 2HE2 GLN 35 4.916 3.738 -11.249
252 H GLY 36 H GLY 36 0.273 6.222 -8.905
253 HA2 GLY 36 1HA GLY 36 -2.379 5.613 -7.889
254 HA3 GLY 36 2HA GLY 36 -1.504 6.878 -7.036
255 H ASN 37 H ASN 37 -3.870 7.489 -8.202
256 HA ASN 37 HA ASN 37 -3.372 8.612 -10.836
257 HB2 ASN 37 1HB ASN 37 -5.831 8.482 -9.089
258 HB3 ASN 37 2HB ASN 37 -5.788 9.400 -10.587
259 HD21 ASN 37 1HD2 ASN 37 -7.383 8.130 -11.495
260 HD22 ASN 37 2HD2 ASN 37 -7.081 6.519 -12.047
261 H GLY 38 H GLY 38 -1.713 9.736 -8.961
262 HA2 GLY 38 1HA GLY 38 -1.230 12.169 -9.103
263 HA3 GLY 38 2HA GLY 38 -2.888 12.425 -8.579
264 H PHE 39 H PHE 39 -2.868 10.282 -6.648
265 HA PHE 39 HA PHE 39 -1.018 11.414 -4.662
266 HB2 PHE 39 1HB PHE 39 -3.745 10.180 -4.300
267 HB3 PHE 39 2HB PHE 39 -2.633 10.445 -2.963
268 HD1 PHE 39 HD1 PHE 39 -1.844 12.799 -2.512
269 HD2 PHE 39 HD2 PHE 39 -5.118 11.903 -5.077
270 HE1 PHE 39 HE1 PHE 39 -2.648 15.111 -2.288
271 HE2 PHE 39 HE2 PHE 39 -5.929 14.213 -4.857
272 HZ PHE 39 HZ PHE 39 -4.691 15.819 -3.461
273 H ARG 40 H ARG 40 0.692 10.162 -4.654
274 HA ARG 40 HA ARG 40 0.433 7.273 -4.898
275 HB2 ARG 40 1HB ARG 40 2.893 9.010 -4.650
276 HB3 ARG 40 2HB ARG 40 2.875 7.298 -5.031
277 HG2 ARG 40 1HG ARG 40 1.640 7.789 -7.097
278 HG3 ARG 40 2HG ARG 40 1.742 9.510 -6.722
279 HD2 ARG 40 1HD ARG 40 4.189 9.360 -6.767
280 HD3 ARG 40 2HD ARG 40 4.069 7.649 -7.173
281 HE ARG 40 HE ARG 40 2.802 9.596 -8.952
282 HH11 ARG 40 1HH1 ARG 40 5.323 7.243 -8.365
283 HH12 ARG 40 2HH1 ARG 40 5.861 7.213 -10.011
284 HH21 ARG 40 1HH2 ARG 40 3.494 9.561 -11.126
285 HH22 ARG 40 2HH2 ARG 40 4.814 8.537 -11.591
286 H THR 41 H THR 41 -0.815 7.643 -2.762
287 HA THR 41 HA THR 41 1.058 7.525 -0.501
288 HB THR 41 HB THR 41 -0.877 8.382 0.873
289 HG1 THR 41 HG1 THR 41 -2.690 8.259 -0.286
290 HG21 THR 41 1HG2 THR 41 0.965 9.837 0.230
291 HG22 THR 41 2HG2 THR 41 -0.559 10.726 0.182
292 HG23 THR 41 3HG2 THR 41 0.186 10.167 -1.317
293 H LEU 42 H LEU 42 0.261 6.301 1.361
294 HA LEU 42 HA LEU 42 -1.580 4.139 0.642
295 HB2 LEU 42 1HB LEU 42 1.142 3.929 1.902
296 HB3 LEU 42 2HB LEU 42 -0.062 2.671 2.095
297 HG LEU 42 HG LEU 42 1.038 3.601 -0.551
298 HD11 LEU 42 1HD1 LEU 42 1.648 1.107 1.021
299 HD12 LEU 42 2HD1 LEU 42 2.734 2.480 0.808
300 HD13 LEU 42 3HD1 LEU 42 2.261 1.507 -0.583
301 HD21 LEU 42 1HD2 LEU 42 -0.043 1.536 -1.393
302 HD22 LEU 42 2HD2 LEU 42 -1.194 2.728 -0.790
303 HD23 LEU 42 3HD2 LEU 42 -0.788 1.321 0.192
304 H GLU 43 H GLU 43 -2.806 3.323 2.307
305 HA GLU 43 HA GLU 43 -2.982 5.066 4.647
306 HB2 GLU 43 1HB GLU 43 -4.940 3.150 3.387
307 HB3 GLU 43 2HB GLU 43 -5.226 3.953 4.921
308 HG2 GLU 43 1HG GLU 43 -4.761 5.354 2.303
309 HG3 GLU 43 2HG GLU 43 -6.340 5.056 3.030
310 H GLU 44 H GLU 44 -2.905 4.274 6.694
311 HA GLU 44 HA GLU 44 -1.326 2.005 7.163
312 HB2 GLU 44 1HB GLU 44 -1.470 3.971 8.652
313 HB3 GLU 44 2HB GLU 44 -3.109 3.509 9.075
314 HG2 GLU 44 1HG GLU 44 -2.234 1.401 9.993
315 HG3 GLU 44 2HG GLU 44 -0.604 1.964 9.653
316 H ASN 45 H ASN 45 -1.810 -0.049 7.409
317 HA ASN 45 HA ASN 45 -2.921 -1.995 7.670
318 HB2 ASN 45 1HB ASN 45 -4.889 -0.171 8.999
319 HB3 ASN 45 2HB ASN 45 -5.304 -1.854 8.702
320 HD21 ASN 45 1HD2 ASN 45 -3.375 0.335 10.525
321 HD22 ASN 45 2HD2 ASN 45 -2.728 -0.814 11.636
322 H GLN 46 H GLN 46 -3.071 -0.363 5.283
323 HA GLN 46 HA GLN 46 -5.570 -1.369 4.112
324 HB2 GLN 46 1HB GLN 46 -5.023 1.027 3.781
325 HB3 GLN 46 2HB GLN 46 -3.532 0.555 2.980
326 HG2 GLN 46 1HG GLN 46 -4.784 -0.522 1.215
327 HG3 GLN 46 2HG GLN 46 -6.298 -0.136 2.028
328 HE21 GLN 46 1HE2 GLN 46 -3.608 1.111 0.249
329 HE22 GLN 46 2HE2 GLN 46 -4.314 2.637 -0.155
330 H LYS 47 H LYS 47 -5.507 -2.786 2.365
331 HA LYS 47 HA LYS 47 -3.176 -4.429 2.202
332 HB2 LYS 47 1HB LYS 47 -5.719 -4.448 0.575
333 HB3 LYS 47 2HB LYS 47 -4.462 -5.674 0.479
334 HG2 LYS 47 1HG LYS 47 -6.106 -5.011 2.911
335 HG3 LYS 47 2HG LYS 47 -6.315 -6.413 1.866
336 HD2 LYS 47 1HD LYS 47 -3.812 -5.801 3.430
337 HD3 LYS 47 2HD LYS 47 -5.084 -6.895 3.971
338 HE2 LYS 47 1HE LYS 47 -3.516 -7.221 1.414
339 HE3 LYS 47 2HE LYS 47 -3.146 -8.048 2.924
340 HZ1 LYS 47 1HZ LYS 47 -5.702 -8.291 1.431
341 HZ2 LYS 47 2HZ LYS 47 -5.287 -9.126 2.839
342 HZ3 LYS 47 3HZ LYS 47 -4.447 -9.423 1.404
343 H VAL 48 H VAL 48 -1.962 -4.865 0.291
344 HA VAL 48 HA VAL 48 -1.983 -2.888 -1.814
345 HB VAL 48 HB VAL 48 -0.893 -1.713 0.050
346 HG11 VAL 48 1HG1 VAL 48 -0.005 -3.640 1.222
347 HG12 VAL 48 2HG1 VAL 48 1.265 -2.460 0.894
348 HG13 VAL 48 3HG1 VAL 48 1.143 -3.921 -0.088
349 HG21 VAL 48 1HG2 VAL 48 -0.230 -1.134 -2.192
350 HG22 VAL 48 2HG2 VAL 48 0.960 -2.437 -2.207
351 HG23 VAL 48 3HG2 VAL 48 1.168 -1.064 -1.119
352 H GLU 49 H GLU 49 -0.632 -3.408 -3.535
353 HA GLU 49 HA GLU 49 0.777 -5.989 -3.385
354 HB2 GLU 49 1HB GLU 49 -1.231 -6.147 -4.786
355 HB3 GLU 49 2HB GLU 49 -0.688 -4.774 -5.734
356 HG2 GLU 49 1HG GLU 49 1.243 -6.049 -6.490
357 HG3 GLU 49 2HG GLU 49 0.706 -7.430 -5.532
358 H PHE 50 H PHE 50 2.832 -6.045 -4.358
359 HA PHE 50 HA PHE 50 3.927 -3.658 -5.553
360 HB2 PHE 50 1HB PHE 50 5.604 -3.353 -3.684
361 HB3 PHE 50 2HB PHE 50 3.954 -2.890 -3.288
362 HD1 PHE 50 HD1 PHE 50 6.705 -5.109 -2.514
363 HD2 PHE 50 HD2 PHE 50 2.564 -4.363 -1.869
364 HE1 PHE 50 HE1 PHE 50 6.732 -6.618 -0.573
365 HE2 PHE 50 HE2 PHE 50 2.587 -5.871 0.067
366 HZ PHE 50 HZ PHE 50 4.673 -7.001 0.717
367 H GLU 51 H GLU 51 6.305 -3.870 -5.862
368 HA GLU 51 HA GLU 51 7.114 -6.690 -6.097
369 HB2 GLU 51 1HB GLU 51 7.069 -5.441 -8.226
370 HB3 GLU 51 2HB GLU 51 8.168 -4.249 -7.545
371 HG2 GLU 51 1HG GLU 51 9.344 -5.795 -8.994
372 HG3 GLU 51 2HG GLU 51 9.895 -5.945 -7.327
373 H ILE 52 H ILE 52 8.947 -7.359 -5.050
374 HA ILE 52 HA ILE 52 9.934 -5.456 -3.073
375 HB ILE 52 HB ILE 52 10.204 -8.454 -3.206
376 HG12 ILE 52 1HG1 ILE 52 8.673 -6.611 -1.363
377 HG13 ILE 52 2HG1 ILE 52 7.974 -7.641 -2.606
378 HG21 ILE 52 1HG2 ILE 52 11.225 -6.523 -1.133
379 HG22 ILE 52 2HG2 ILE 52 12.206 -7.507 -2.217
380 HG23 ILE 52 3HG2 ILE 52 11.221 -8.278 -0.972
381 HD11 ILE 52 1HD1 ILE 52 8.727 -9.614 -1.391
382 HD12 ILE 52 2HD1 ILE 52 7.685 -8.596 -0.397
383 HD13 ILE 52 3HD1 ILE 52 9.432 -8.579 -0.148
384 H GLY 53 H GLY 53 11.650 -4.355 -3.545
385 HA2 GLY 53 1HA GLY 53 13.825 -5.665 -5.049
386 HA3 GLY 53 2HA GLY 53 13.553 -3.929 -4.995
387 H GLU 54 H GLU 54 15.611 -3.467 -4.222
388 HA GLU 54 HA GLU 54 16.056 -4.266 -1.428
389 HB2 GLU 54 1HB GLU 54 17.618 -5.359 -3.066
390 HB3 GLU 54 2HB GLU 54 18.207 -3.757 -3.482
391 HG2 GLU 54 1HG GLU 54 19.741 -4.714 -1.949
392 HG3 GLU 54 2HG GLU 54 18.854 -3.452 -1.096
393 H GLY 55 H GLY 55 16.307 -2.636 -0.054
394 HA2 GLY 55 1HA GLY 55 16.878 0.039 -1.155
395 HA3 GLY 55 2HA GLY 55 15.624 -0.220 0.048
396 H ALA 56 H ALA 56 16.826 1.370 1.302
397 HA ALA 56 HA ALA 56 19.442 0.641 2.260
398 HB1 ALA 56 1HB ALA 56 17.616 2.854 3.179
399 HB2 ALA 56 2HB ALA 56 18.816 2.988 1.893
400 HB3 ALA 56 3HB ALA 56 19.331 2.686 3.553
401 H LYS 57 H LYS 57 16.152 0.703 3.555
402 HA LYS 57 HA LYS 57 17.134 -0.354 6.104
403 HB2 LYS 57 1HB LYS 57 14.317 0.496 5.434
404 HB3 LYS 57 2HB LYS 57 15.010 0.251 7.031
405 HG2 LYS 57 1HG LYS 57 15.719 2.435 5.086
406 HG3 LYS 57 2HG LYS 57 14.794 2.609 6.576
407 HD2 LYS 57 1HD LYS 57 16.726 2.020 7.897
408 HD3 LYS 57 2HD LYS 57 17.656 1.667 6.438
409 HE2 LYS 57 1HE LYS 57 17.409 4.029 5.753
410 HE3 LYS 57 2HE LYS 57 16.576 4.357 7.272
411 HZ1 LYS 57 1HZ LYS 57 18.929 4.948 7.356
412 HZ2 LYS 57 2HZ LYS 57 19.356 3.341 7.038
413 HZ3 LYS 57 3HZ LYS 57 18.555 3.736 8.474
414 H GLY 58 H GLY 58 17.004 -1.938 3.639
415 HA2 GLY 58 1HA GLY 58 16.670 -4.376 3.859
416 HA3 GLY 58 2HA GLY 58 15.085 -3.999 4.527
417 HA PRO 59 HA PRO 59 14.320 -4.751 0.053
418 HB2 PRO 59 1HB PRO 59 11.751 -5.604 0.496
419 HB3 PRO 59 2HB PRO 59 13.155 -6.670 0.450
420 HG2 PRO 59 1HG PRO 59 11.687 -5.564 2.790
421 HG3 PRO 59 2HG PRO 59 12.412 -7.162 2.572
422 HD2 PRO 59 1HD PRO 59 13.572 -5.206 4.043
423 HD3 PRO 59 2HD PRO 59 14.506 -6.428 3.159
424 H GLN 60 H GLN 60 13.061 -3.517 -1.353
425 HA GLN 60 HA GLN 60 11.466 -1.398 -0.075
426 HB2 GLN 60 1HB GLN 60 12.131 0.135 -1.846
427 HB3 GLN 60 2HB GLN 60 13.544 -0.479 -1.003
428 HG2 GLN 60 1HG GLN 60 14.084 -1.935 -2.800
429 HG3 GLN 60 2HG GLN 60 12.549 -1.609 -3.602
430 HE21 GLN 60 1HE2 GLN 60 14.411 0.899 -2.072
431 HE22 GLN 60 2HE2 GLN 60 14.903 1.693 -3.525
432 H ALA 61 H ALA 61 9.534 -0.872 -0.966
433 HA ALA 61 HA ALA 61 8.382 -2.857 -2.733
434 HB1 ALA 61 1HB ALA 61 7.140 -0.462 -1.381
435 HB2 ALA 61 2HB ALA 61 7.125 -2.121 -0.780
436 HB3 ALA 61 3HB ALA 61 6.263 -1.711 -2.265
437 H GLN 62 H GLN 62 8.520 -2.659 -4.831
438 HA GLN 62 HA GLN 62 8.685 0.023 -6.036
439 HB2 GLN 62 1HB GLN 62 9.410 -2.629 -7.287
440 HB3 GLN 62 2HB GLN 62 9.757 -1.031 -7.923
441 HG2 GLN 62 1HG GLN 62 11.280 -0.605 -6.084
442 HG3 GLN 62 2HG GLN 62 10.906 -2.186 -5.397
443 HE21 GLN 62 1HE2 GLN 62 11.586 -4.046 -6.499
444 HE22 GLN 62 2HE2 GLN 62 12.899 -3.998 -7.620
445 H GLN 63 H GLN 63 7.320 0.539 -7.757
446 HA GLN 63 HA GLN 63 5.309 0.617 -8.833
447 HB2 GLN 63 1HB GLN 63 5.809 -2.353 -9.084
448 HB3 GLN 63 2HB GLN 63 4.665 -1.431 -10.045
449 HG2 GLN 63 1HG GLN 63 7.642 -1.011 -10.018
450 HG3 GLN 63 2HG GLN 63 6.751 -1.913 -11.242
451 HE21 GLN 63 1HE2 GLN 63 7.585 1.209 -10.024
452 HE22 GLN 63 2HE2 GLN 63 6.910 2.124 -11.327
453 H VAL 64 H VAL 64 4.738 0.920 -6.384
454 HA VAL 64 HA VAL 64 3.339 -1.278 -5.149
455 HB VAL 64 HB VAL 64 3.343 1.549 -4.146
456 HG11 VAL 64 1HG1 VAL 64 3.281 -1.118 -2.763
457 HG12 VAL 64 2HG1 VAL 64 1.934 0.003 -2.952
458 HG13 VAL 64 3HG1 VAL 64 3.321 0.446 -1.955
459 HG21 VAL 64 1HG2 VAL 64 5.443 1.047 -2.958
460 HG22 VAL 64 2HG2 VAL 64 5.642 1.087 -4.709
461 HG23 VAL 64 3HG2 VAL 64 5.567 -0.459 -3.865
462 H HIS 65 H HIS 65 1.278 -1.734 -5.475
463 HA HIS 65 HA HIS 65 -0.541 0.441 -6.298
464 HB2 HIS 65 1HB HIS 65 -0.628 -2.497 -6.988
465 HB3 HIS 65 2HB HIS 65 -1.950 -1.386 -7.301
466 HD1 HIS 65 HD1 HIS 65 -1.847 -0.055 -9.434
467 HD2 HIS 65 HD2 HIS 65 1.742 -1.943 -8.528
468 HE1 HIS 65 HE1 HIS 65 -0.405 0.214 -11.478
469 HE2 HIS 65 HE2 HIS 65 1.737 -0.994 -10.934
470 H ALA 66 H ALA 66 -2.026 0.938 -4.849
471 HA ALA 66 HA ALA 66 -2.297 -0.553 -2.437
472 HB1 ALA 66 1HB ALA 66 -3.963 1.735 -3.472
473 HB2 ALA 66 2HB ALA 66 -2.499 1.887 -2.502
474 HB3 ALA 66 3HB ALA 66 -3.936 1.129 -1.815
475 H LEU 67 H LEU 67 -3.687 -2.101 -1.943
476 HA LEU 67 HA LEU 67 -5.585 -2.946 -3.984
477 HB2 LEU 67 1HB LEU 67 -4.673 -4.272 -1.432
478 HB3 LEU 67 2HB LEU 67 -5.820 -4.971 -2.555
479 HG LEU 67 HG LEU 67 -2.914 -4.375 -3.107
480 HD11 LEU 67 1HD1 LEU 67 -3.348 -6.317 -1.654
481 HD12 LEU 67 2HD1 LEU 67 -2.660 -6.768 -3.213
482 HD13 LEU 67 3HD1 LEU 67 -4.383 -6.998 -2.910
483 HD21 LEU 67 1HD2 LEU 67 -5.037 -5.552 -4.897
484 HD22 LEU 67 2HD2 LEU 67 -3.310 -5.508 -5.255
485 HD23 LEU 67 3HD2 LEU 67 -4.219 -4.004 -5.112
486 H GLY 68 H GLY 68 -7.162 -1.360 -3.744
487 HA2 GLY 68 1HA GLY 68 -8.346 -0.816 -1.173
488 HA3 GLY 68 2HA GLY 68 -8.868 -0.173 -2.720
489 H GLY 69 H GLY 69 -8.521 -3.538 -1.696
490 HA2 GLY 69 1HA GLY 69 -11.342 -3.966 -2.383
491 HA3 GLY 69 2HA GLY 69 -10.110 -5.217 -2.277
492 H GLU 70 H GLU 70 -12.804 -4.689 -0.937
493 HA GLU 70 HA GLU 70 -11.872 -5.196 1.804
494 HB2 GLU 70 1HB GLU 70 -12.813 -2.875 1.496
495 HB3 GLU 70 2HB GLU 70 -14.349 -3.616 1.081
496 HG2 GLU 70 1HG GLU 70 -12.987 -4.154 3.698
497 HG3 GLU 70 2HG GLU 70 -14.037 -2.761 3.460
498 H ASN 71 H ASN 71 -12.492 -7.121 2.464
499 HA ASN 71 HA ASN 71 -15.076 -8.191 1.643
500 HB2 ASN 71 1HB ASN 71 -13.441 -9.056 0.001
501 HB3 ASN 71 2HB ASN 71 -12.483 -9.723 1.319
502 HD21 ASN 71 1HD2 ASN 71 -15.435 -9.982 -0.498
503 HD22 ASN 71 2HD2 ASN 71 -15.849 -11.581 0.014
504 H LEU 72 H LEU 72 -15.855 -8.071 3.675
505 HA LEU 72 HA LEU 72 -16.250 -8.576 5.843
506 HB2 LEU 72 1HB LEU 72 -14.549 -10.985 5.196
507 HB3 LEU 72 2HB LEU 72 -15.458 -10.785 6.682
508 HG LEU 72 HG LEU 72 -16.627 -10.997 3.906
509 HD11 LEU 72 1HD1 LEU 72 -15.742 -13.103 4.777
510 HD12 LEU 72 2HD1 LEU 72 -17.503 -13.127 4.692
511 HD13 LEU 72 3HD1 LEU 72 -16.698 -12.898 6.244
512 HD21 LEU 72 1HD2 LEU 72 -18.792 -11.052 5.047
513 HD22 LEU 72 2HD2 LEU 72 -17.962 -9.520 5.310
514 HD23 LEU 72 3HD2 LEU 72 -17.989 -10.737 6.585
515 H TYR 73 H TYR 73 -14.145 -6.794 5.285
516 HA TYR 73 HA TYR 73 -12.008 -7.452 7.151
517 HB2 TYR 73 1HB TYR 73 -11.454 -6.320 5.033
518 HB3 TYR 73 2HB TYR 73 -12.479 -4.965 5.486
519 HD1 TYR 73 HD1 TYR 73 -11.460 -3.112 6.414
520 HD2 TYR 73 HD2 TYR 73 -9.576 -6.904 6.835
521 HE1 TYR 73 HE1 TYR 73 -9.555 -2.034 7.530
522 HE2 TYR 73 HE2 TYR 73 -7.664 -5.833 7.949
523 HH TYR 73 HH TYR 73 -6.606 -3.663 8.125
524 H PHE 74 H PHE 74 -13.287 -7.560 9.047
525 HA PHE 74 HA PHE 74 -14.347 -4.991 9.999
526 HB2 PHE 74 1HB PHE 74 -14.784 -7.811 11.004
527 HB3 PHE 74 2HB PHE 74 -15.410 -6.373 11.801
528 HD1 PHE 74 HD1 PHE 74 -15.868 -8.749 9.135
529 HD2 PHE 74 HD2 PHE 74 -17.088 -4.958 10.633
530 HE1 PHE 74 HE1 PHE 74 -17.868 -8.831 7.703
531 HE2 PHE 74 HE2 PHE 74 -19.089 -5.032 9.205
532 HZ PHE 74 HZ PHE 74 -19.482 -6.971 7.738
533 H GLN 75 H GLN 75 -12.353 -4.061 10.483
534 HA GLN 75 HA GLN 75 -10.479 -5.398 12.210
535 HB2 GLN 75 1HB GLN 75 -9.851 -3.807 10.354
536 HB3 GLN 75 2HB GLN 75 -10.485 -2.503 11.347
537 HG2 GLN 75 1HG GLN 75 -8.059 -2.678 11.509
538 HG3 GLN 75 2HG GLN 75 -8.843 -2.967 13.061
539 HE21 GLN 75 1HE2 GLN 75 -7.067 -4.093 13.848
540 HE22 GLN 75 2HE2 GLN 75 -6.677 -5.691 13.312
541 H GLY 76 H GLY 76 -12.286 -5.679 13.826
542 HA2 GLY 76 1HA GLY 76 -11.792 -4.100 16.078
543 HA3 GLY 76 2HA GLY 76 -13.275 -3.521 15.332
544 H HIS 77 H HIS 77 -12.581 -5.030 17.879
545 HA HIS 77 HA HIS 77 -13.476 -6.619 19.215
546 HB2 HIS 77 1HB HIS 77 -15.725 -6.454 17.202
547 HB3 HIS 77 2HB HIS 77 -15.818 -7.372 18.702
548 HD1 HIS 77 HD1 HIS 77 -16.542 -4.118 17.346
549 HD2 HIS 77 HD2 HIS 77 -15.360 -5.590 21.051
550 HE1 HIS 77 HE1 HIS 77 -17.096 -2.309 19.003
551 HE2 HIS 77 HE2 HIS 77 -16.217 -3.155 21.205
552 H HIS 78 H HIS 78 -11.670 -7.378 17.159
553 HA HIS 78 HA HIS 78 -12.305 -10.237 17.071
554 HB2 HIS 78 1HB HIS 78 -11.398 -8.566 14.725
555 HB3 HIS 78 2HB HIS 78 -11.175 -10.309 14.779
556 HD1 HIS 78 HD1 HIS 78 -13.257 -8.121 13.162
557 HD2 HIS 78 HD2 HIS 78 -14.035 -11.388 15.618
558 HE1 HIS 78 HE1 HIS 78 -15.595 -8.859 12.594
559 HE2 HIS 78 HE2 HIS 78 -16.097 -10.728 14.199
560 H HIS 79 H HIS 79 -10.593 -8.380 18.656
561 HA HIS 79 HA HIS 79 -7.878 -8.914 17.926
562 HB2 HIS 79 1HB HIS 79 -8.552 -6.934 19.283
563 HB3 HIS 79 2HB HIS 79 -8.988 -8.015 20.599
564 HD1 HIS 79 HD1 HIS 79 -6.062 -6.453 18.901
565 HD2 HIS 79 HD2 HIS 79 -6.803 -9.131 21.998
566 HE1 HIS 79 HE1 HIS 79 -3.887 -6.675 20.144
567 HE2 HIS 79 HE2 HIS 79 -4.316 -8.421 21.903
568 H HIS 80 H HIS 80 -6.997 -10.851 18.054
569 HA HIS 80 HA HIS 80 -8.156 -12.921 19.674
570 HB2 HIS 80 1HB HIS 80 -5.678 -12.872 17.942
571 HB3 HIS 80 2HB HIS 80 -6.274 -14.308 18.770
572 HD1 HIS 80 HD1 HIS 80 -6.943 -12.095 15.847
573 HD2 HIS 80 HD2 HIS 80 -8.628 -15.424 17.675
574 HE1 HIS 80 HE1 HIS 80 -8.629 -12.978 14.212
575 HE2 HIS 80 HE2 HIS 80 -9.772 -14.869 15.423
576 H HIS 81 H HIS 81 -7.212 -13.983 21.424
577 HA HIS 81 HA HIS 81 -5.310 -12.280 22.891
578 HB2 HIS 81 1HB HIS 81 -7.494 -14.101 23.922
579 HB3 HIS 81 2HB HIS 81 -6.312 -13.302 24.952
580 HD1 HIS 81 HD1 HIS 81 -6.988 -11.083 25.832
581 HD2 HIS 81 HD2 HIS 81 -9.150 -12.143 22.442
582 HE1 HIS 81 HE1 HIS 81 -8.726 -9.287 25.545
583 HE2 HIS 81 HE2 HIS 81 -10.102 -10.018 23.567
584 H HIS 82 H HIS 82 -3.490 -13.358 21.989
585 HA HIS 82 HA HIS 82 -2.933 -15.866 23.405
586 HB2 HIS 82 1HB HIS 82 -2.369 -15.275 20.505
587 HB3 HIS 82 2HB HIS 82 -1.470 -16.494 21.396
588 HD1 HIS 82 HD1 HIS 82 -4.224 -16.256 19.196
589 HD2 HIS 82 HD2 HIS 82 -3.481 -18.403 22.679
590 HE1 HIS 82 HE1 HIS 82 -5.834 -18.186 19.160
591 HE2 HIS 82 HE2 HIS 82 -5.249 -19.557 21.189
Start of MODEL 9
1 H2 MET 1 2H MET 1 6.600 -11.127 -7.846
2 H MET 1 1H MET 1 7.037 -9.673 -8.594
3 H3 MET 1 3H MET 1 7.478 -9.964 -6.988
4 HA MET 1 HA MET 1 5.633 -8.424 -7.125
5 HB2 MET 1 1HB MET 1 4.658 -9.276 -9.209
6 HB3 MET 1 2HB MET 1 4.221 -10.776 -8.405
7 HG2 MET 1 1HG MET 1 2.727 -9.520 -6.913
8 HG3 MET 1 2HG MET 1 3.134 -8.039 -7.777
9 HE1 MET 1 1HE MET 1 2.555 -7.632 -10.347
10 HE2 MET 1 2HE MET 1 1.686 -8.791 -11.351
11 HE3 MET 1 3HE MET 1 3.318 -9.156 -10.794
12 H ALA 2 H ALA 2 4.782 -8.229 -5.158
13 HA ALA 2 HA ALA 2 3.939 -10.629 -3.706
14 HB1 ALA 2 1HB ALA 2 5.817 -8.543 -2.591
15 HB2 ALA 2 2HB ALA 2 6.240 -10.209 -2.993
16 HB3 ALA 2 3HB ALA 2 5.104 -9.878 -1.684
17 H GLN 3 H GLN 3 2.622 -10.092 -1.816
18 HA GLN 3 HA GLN 3 1.444 -7.406 -1.969
19 HB2 GLN 3 1HB GLN 3 -0.022 -10.003 -1.503
20 HB3 GLN 3 2HB GLN 3 -0.736 -8.408 -1.338
21 HG2 GLN 3 1HG GLN 3 -0.254 -7.988 -3.719
22 HG3 GLN 3 2HG GLN 3 0.345 -9.640 -3.856
23 HE21 GLN 3 1HE2 GLN 3 -1.862 -8.386 -5.247
24 HE22 GLN 3 2HE2 GLN 3 -3.274 -9.305 -4.848
25 H GLY 4 H GLY 4 0.190 -6.948 0.103
26 HA2 GLY 4 1HA GLY 4 0.710 -8.339 2.467
27 HA3 GLY 4 2HA GLY 4 1.976 -7.140 2.265
28 H THR 5 H THR 5 1.247 -6.156 4.162
29 HA THR 5 HA THR 5 -1.016 -4.348 3.695
30 HB THR 5 HB THR 5 -0.499 -5.613 6.387
31 HG1 THR 5 HG1 THR 5 -1.138 -7.251 4.906
32 HG21 THR 5 1HG2 THR 5 -2.758 -4.820 6.875
33 HG22 THR 5 2HG2 THR 5 -2.894 -4.180 5.236
34 HG23 THR 5 3HG2 THR 5 -1.724 -3.485 6.359
35 H VAL 6 H VAL 6 -0.307 -2.320 3.886
36 HA VAL 6 HA VAL 6 2.261 -1.734 4.934
37 HB VAL 6 HB VAL 6 1.682 -0.262 3.248
38 HG11 VAL 6 1HG1 VAL 6 -0.665 -0.780 3.109
39 HG12 VAL 6 2HG1 VAL 6 -0.430 0.967 3.136
40 HG13 VAL 6 3HG1 VAL 6 -0.974 0.130 4.589
41 HG21 VAL 6 1HG2 VAL 6 2.633 0.955 5.135
42 HG22 VAL 6 2HG2 VAL 6 1.011 1.229 5.780
43 HG23 VAL 6 3HG2 VAL 6 1.485 1.958 4.245
44 H LYS 7 H LYS 7 2.815 -1.621 6.945
45 HA LYS 7 HA LYS 7 0.847 -1.671 9.015
46 HB2 LYS 7 1HB LYS 7 2.807 -1.773 10.536
47 HB3 LYS 7 2HB LYS 7 2.818 -3.006 9.285
48 HG2 LYS 7 1HG LYS 7 4.502 -1.877 8.064
49 HG3 LYS 7 2HG LYS 7 4.357 -0.438 9.073
50 HD2 LYS 7 1HD LYS 7 6.340 -1.811 9.625
51 HD3 LYS 7 2HD LYS 7 5.226 -1.631 10.980
52 HE2 LYS 7 1HE LYS 7 4.296 -3.838 10.510
53 HE3 LYS 7 2HE LYS 7 5.394 -4.018 9.145
54 HZ1 LYS 7 1HZ LYS 7 6.198 -3.732 11.988
55 HZ2 LYS 7 2HZ LYS 7 7.255 -3.899 10.681
56 HZ3 LYS 7 3HZ LYS 7 6.221 -5.167 11.093
57 H TRP 8 H TRP 8 2.988 0.685 7.631
58 HA TRP 8 HA TRP 8 1.365 2.798 8.600
59 HB2 TRP 8 1HB TRP 8 3.013 4.006 9.925
60 HB3 TRP 8 2HB TRP 8 2.699 2.436 10.645
61 HD1 TRP 8 HD1 TRP 8 4.697 0.731 10.789
62 HE1 TRP 8 HE1 TRP 8 7.237 0.982 10.456
63 HE3 TRP 8 HE3 TRP 8 4.776 5.277 8.447
64 HZ2 TRP 8 HZ2 TRP 8 9.029 2.852 9.362
65 HZ3 TRP 8 HZ3 TRP 8 6.949 6.222 7.791
66 HH2 TRP 8 HH2 TRP 8 9.027 5.031 8.239
67 H PHE 9 H PHE 9 1.826 4.762 7.576
68 HA PHE 9 HA PHE 9 4.050 4.764 5.692
69 HB2 PHE 9 1HB PHE 9 2.029 3.894 4.502
70 HB3 PHE 9 2HB PHE 9 1.233 5.428 4.829
71 HD1 PHE 9 HD1 PHE 9 3.993 3.809 3.026
72 HD2 PHE 9 HD2 PHE 9 1.720 7.367 3.541
73 HE1 PHE 9 HE1 PHE 9 4.995 4.740 0.981
74 HE2 PHE 9 HE2 PHE 9 2.716 8.304 1.498
75 HZ PHE 9 HZ PHE 9 4.356 6.991 0.216
76 H ASN 10 H ASN 10 5.107 6.564 5.851
77 HA ASN 10 HA ASN 10 3.906 8.903 7.105
78 HB2 ASN 10 1HB ASN 10 6.172 8.116 7.784
79 HB3 ASN 10 2HB ASN 10 6.743 8.418 6.150
80 HD21 ASN 10 1HD2 ASN 10 7.623 9.525 8.682
81 HD22 ASN 10 2HD2 ASN 10 7.471 11.240 8.536
82 H ALA 11 H ALA 11 2.579 9.815 5.609
83 HA ALA 11 HA ALA 11 3.208 9.946 2.832
84 HB1 ALA 11 1HB ALA 11 1.090 11.410 4.395
85 HB2 ALA 11 2HB ALA 11 0.905 9.836 3.621
86 HB3 ALA 11 3HB ALA 11 1.172 11.277 2.638
87 H GLU 12 H GLU 12 3.835 11.960 5.551
88 HA GLU 12 HA GLU 12 4.178 14.439 4.251
89 HB2 GLU 12 1HB GLU 12 3.960 14.275 6.673
90 HB3 GLU 12 2HB GLU 12 5.450 13.346 6.767
91 HG2 GLU 12 1HG GLU 12 6.721 15.263 6.006
92 HG3 GLU 12 2HG GLU 12 5.239 16.199 5.833
93 H LYS 13 H LYS 13 6.395 11.819 5.028
94 HA LYS 13 HA LYS 13 8.560 13.162 3.611
95 HB2 LYS 13 1HB LYS 13 8.560 10.562 5.136
96 HB3 LYS 13 2HB LYS 13 9.975 11.403 4.520
97 HG2 LYS 13 1HG LYS 13 8.088 12.460 6.605
98 HG3 LYS 13 2HG LYS 13 9.659 11.729 6.922
99 HD2 LYS 13 1HD LYS 13 10.744 13.500 5.641
100 HD3 LYS 13 2HD LYS 13 9.171 14.224 5.307
101 HE2 LYS 13 1HE LYS 13 8.824 14.596 7.688
102 HE3 LYS 13 2HE LYS 13 10.374 13.836 8.043
103 HZ1 LYS 13 1HZ LYS 13 11.487 15.593 6.845
104 HZ2 LYS 13 2HZ LYS 13 10.514 16.256 8.058
105 HZ3 LYS 13 3HZ LYS 13 10.011 16.313 6.445
106 H GLY 14 H GLY 14 6.277 10.630 3.245
107 HA2 GLY 14 1HA GLY 14 5.594 9.761 1.194
108 HA3 GLY 14 2HA GLY 14 7.074 10.363 0.468
109 H PHE 15 H PHE 15 7.054 8.390 3.379
110 HA PHE 15 HA PHE 15 7.619 6.000 1.823
111 HB2 PHE 15 1HB PHE 15 9.732 5.516 2.839
112 HB3 PHE 15 2HB PHE 15 9.826 7.132 2.159
113 HD1 PHE 15 HD1 PHE 15 10.100 9.062 3.580
114 HD2 PHE 15 HD2 PHE 15 9.703 5.167 5.250
115 HE1 PHE 15 HE1 PHE 15 10.906 9.906 5.748
116 HE2 PHE 15 HE2 PHE 15 10.502 6.011 7.415
117 HZ PHE 15 HZ PHE 15 11.104 8.382 7.667
118 H GLY 16 H GLY 16 7.800 4.055 3.238
119 HA2 GLY 16 1HA GLY 16 6.855 4.186 5.931
120 HA3 GLY 16 2HA GLY 16 5.570 3.735 4.818
121 H PHE 17 H PHE 17 5.607 1.722 6.127
122 HA PHE 17 HA PHE 17 7.432 -0.163 4.824
123 HB2 PHE 17 1HB PHE 17 7.107 0.212 7.767
124 HB3 PHE 17 2HB PHE 17 7.358 -1.414 7.144
125 HD1 PHE 17 HD1 PHE 17 8.851 1.900 7.569
126 HD2 PHE 17 HD2 PHE 17 9.452 -2.070 6.176
127 HE1 PHE 17 HE1 PHE 17 11.273 2.314 7.457
128 HE2 PHE 17 HE2 PHE 17 11.874 -1.668 6.057
129 HZ PHE 17 HZ PHE 17 12.790 0.527 6.699
130 H ILE 18 H ILE 18 6.576 -2.009 4.224
131 HA ILE 18 HA ILE 18 3.774 -2.520 4.934
132 HB ILE 18 HB ILE 18 5.331 -3.329 2.482
133 HG12 ILE 18 1HG1 ILE 18 2.823 -1.679 2.630
134 HG13 ILE 18 2HG1 ILE 18 4.427 -0.961 2.687
135 HG21 ILE 18 1HG2 ILE 18 3.874 -5.149 3.097
136 HG22 ILE 18 2HG2 ILE 18 3.232 -4.327 1.672
137 HG23 ILE 18 3HG2 ILE 18 2.510 -4.041 3.256
138 HD11 ILE 18 1HD1 ILE 18 4.932 -1.874 0.494
139 HD12 ILE 18 2HD1 ILE 18 3.465 -0.892 0.442
140 HD13 ILE 18 3HD1 ILE 18 3.349 -2.653 0.444
141 H ALA 19 H ALA 19 3.190 -4.449 5.750
142 HA ALA 19 HA ALA 19 5.305 -6.409 6.264
143 HB1 ALA 19 1HB ALA 19 2.474 -6.275 7.313
144 HB2 ALA 19 2HB ALA 19 3.917 -5.733 8.172
145 HB3 ALA 19 3HB ALA 19 3.704 -7.444 7.797
146 HA PRO 20 HA PRO 20 3.636 -8.087 2.356
147 HB2 PRO 20 1HB PRO 20 5.936 -9.885 2.890
148 HB3 PRO 20 2HB PRO 20 5.486 -9.047 1.404
149 HG2 PRO 20 1HG PRO 20 7.514 -8.166 2.860
150 HG3 PRO 20 2HG PRO 20 6.375 -7.022 2.125
151 HD2 PRO 20 1HD PRO 20 6.560 -7.959 4.954
152 HD3 PRO 20 2HD PRO 20 6.226 -6.334 4.325
153 H ASP 21 H ASP 21 2.459 -9.856 1.885
154 HA ASP 21 HA ASP 21 1.601 -11.580 4.003
155 HB2 ASP 21 1HB ASP 21 0.119 -10.818 2.151
156 HB3 ASP 21 2HB ASP 21 1.075 -11.778 1.028
157 H ASP 22 H ASP 22 4.184 -11.514 1.941
158 HA ASP 22 HA ASP 22 4.554 -14.328 1.511
159 HB2 ASP 22 1HB ASP 22 5.289 -12.567 -0.093
160 HB3 ASP 22 2HB ASP 22 6.489 -12.046 1.078
161 H GLY 23 H GLY 23 4.418 -13.217 4.307
162 HA2 GLY 23 1HA GLY 23 5.393 -14.383 6.167
163 HA3 GLY 23 2HA GLY 23 6.890 -14.494 5.260
164 H SER 24 H SER 24 5.214 -11.523 5.221
165 HA SER 24 HA SER 24 5.627 -9.468 6.016
166 HB2 SER 24 1HB SER 24 5.855 -9.333 8.523
167 HB3 SER 24 2HB SER 24 4.470 -10.244 7.927
168 HG SER 24 HG SER 24 6.774 -11.717 8.360
169 H ALA 25 H ALA 25 7.845 -10.249 4.685
170 HA ALA 25 HA ALA 25 10.127 -9.418 6.254
171 HB1 ALA 25 1HB ALA 25 10.460 -10.925 4.349
172 HB2 ALA 25 2HB ALA 25 11.332 -9.410 4.120
173 HB3 ALA 25 3HB ALA 25 9.819 -9.692 3.262
174 H ASP 26 H ASP 26 9.258 -7.507 7.105
175 HA ASP 26 HA ASP 26 7.786 -5.555 6.004
176 HB2 ASP 26 1HB ASP 26 10.102 -5.059 7.875
177 HB3 ASP 26 2HB ASP 26 8.728 -3.982 7.619
178 H VAL 27 H VAL 27 7.899 -4.411 4.302
179 HA VAL 27 HA VAL 27 10.512 -3.940 3.060
180 HB VAL 27 HB VAL 27 8.988 -5.402 1.822
181 HG11 VAL 27 1HG1 VAL 27 7.160 -3.019 1.772
182 HG12 VAL 27 2HG1 VAL 27 6.863 -4.575 2.554
183 HG13 VAL 27 3HG1 VAL 27 6.954 -4.475 0.795
184 HG21 VAL 27 1HG2 VAL 27 9.378 -2.744 0.481
185 HG22 VAL 27 2HG2 VAL 27 9.086 -4.285 -0.328
186 HG23 VAL 27 3HG2 VAL 27 10.573 -4.036 0.590
187 H PHE 28 H PHE 28 11.111 -1.966 2.383
188 HA PHE 28 HA PHE 28 9.847 0.294 3.642
189 HB2 PHE 28 1HB PHE 28 12.268 0.069 3.636
190 HB3 PHE 28 2HB PHE 28 12.287 0.027 1.880
191 HD1 PHE 28 HD1 PHE 28 12.265 2.015 0.601
192 HD2 PHE 28 HD2 PHE 28 11.708 2.173 4.816
193 HE1 PHE 28 HE1 PHE 28 12.585 4.453 0.547
194 HE2 PHE 28 HE2 PHE 28 12.021 4.611 4.769
195 HZ PHE 28 HZ PHE 28 12.460 5.754 2.633
196 H VAL 29 H VAL 29 8.330 1.523 2.728
197 HA VAL 29 HA VAL 29 7.836 1.244 -0.142
198 HB VAL 29 HB VAL 29 6.128 2.913 1.650
199 HG11 VAL 29 1HG1 VAL 29 5.660 2.888 -0.736
200 HG12 VAL 29 2HG1 VAL 29 4.352 2.124 0.166
201 HG13 VAL 29 3HG1 VAL 29 5.522 1.129 -0.700
202 HG21 VAL 29 1HG2 VAL 29 4.829 0.960 2.299
203 HG22 VAL 29 2HG2 VAL 29 6.483 0.866 2.909
204 HG23 VAL 29 3HG2 VAL 29 6.004 -0.090 1.504
205 H HIS 30 H HIS 30 7.722 2.993 -1.550
206 HA HIS 30 HA HIS 30 8.507 5.619 -0.514
207 HB2 HIS 30 1HB HIS 30 10.452 4.315 -1.549
208 HB3 HIS 30 2HB HIS 30 9.615 4.488 -3.086
209 HD1 HIS 30 HD1 HIS 30 11.046 6.109 -4.305
210 HD2 HIS 30 HD2 HIS 30 10.193 7.360 -0.431
211 HE1 HIS 30 HE1 HIS 30 12.026 8.421 -4.105
212 HE2 HIS 30 HE2 HIS 30 11.370 9.215 -1.804
213 H TYR 31 H TYR 31 7.279 7.228 -1.304
214 HA TYR 31 HA TYR 31 4.801 6.536 -2.361
215 HB2 TYR 31 1HB TYR 31 4.230 8.825 -2.240
216 HB3 TYR 31 2HB TYR 31 5.366 8.537 -0.931
217 HD1 TYR 31 HD1 TYR 31 4.664 10.439 -3.891
218 HD2 TYR 31 HD2 TYR 31 7.775 9.264 -1.240
219 HE1 TYR 31 HE1 TYR 31 6.052 12.289 -4.713
220 HE2 TYR 31 HE2 TYR 31 9.170 11.114 -2.050
221 HH TYR 31 HH TYR 31 9.326 12.498 -4.200
222 H SER 32 H SER 32 7.673 7.576 -4.065
223 HA SER 32 HA SER 32 6.304 8.345 -6.453
224 HB2 SER 32 1HB SER 32 8.715 8.090 -7.395
225 HB3 SER 32 2HB SER 32 8.400 9.349 -6.197
226 HG SER 32 HG SER 32 9.582 6.798 -5.785
227 H GLU 33 H GLU 33 7.250 5.378 -5.074
228 HA GLU 33 HA GLU 33 7.196 3.915 -7.580
229 HB2 GLU 33 1HB GLU 33 7.726 3.211 -4.713
230 HB3 GLU 33 2HB GLU 33 7.351 1.945 -5.869
231 HG2 GLU 33 1HG GLU 33 9.792 2.388 -5.437
232 HG3 GLU 33 2HG GLU 33 9.292 2.366 -7.124
233 H ILE 34 H ILE 34 5.068 4.945 -5.140
234 HA ILE 34 HA ILE 34 3.105 2.922 -5.341
235 HB ILE 34 HB ILE 34 2.798 5.824 -4.552
236 HG12 ILE 34 1HG1 ILE 34 3.090 3.328 -2.863
237 HG13 ILE 34 2HG1 ILE 34 4.327 4.555 -3.097
238 HG21 ILE 34 1HG2 ILE 34 0.665 4.880 -5.245
239 HG22 ILE 34 2HG2 ILE 34 0.695 5.123 -3.497
240 HG23 ILE 34 3HG2 ILE 34 0.906 3.504 -4.167
241 HD11 ILE 34 1HD1 ILE 34 3.254 4.854 -0.963
242 HD12 ILE 34 2HD1 ILE 34 1.671 4.925 -1.737
243 HD13 ILE 34 3HD1 ILE 34 2.849 6.204 -2.025
244 H GLN 35 H GLN 35 1.602 2.571 -6.788
245 HA GLN 35 HA GLN 35 1.764 3.961 -9.292
246 HB2 GLN 35 1HB GLN 35 -0.030 1.721 -8.355
247 HB3 GLN 35 2HB GLN 35 0.084 2.291 -10.012
248 HG2 GLN 35 1HG GLN 35 2.306 1.056 -8.406
249 HG3 GLN 35 2HG GLN 35 1.382 0.266 -9.681
250 HE21 GLN 35 1HE2 GLN 35 3.904 2.501 -8.932
251 HE22 GLN 35 2HE2 GLN 35 4.471 2.723 -10.549
252 H GLY 36 H GLY 36 0.277 5.277 -10.216
253 HA2 GLY 36 1HA GLY 36 -1.177 6.963 -8.528
254 HA3 GLY 36 2HA GLY 36 -1.301 6.924 -10.278
255 H ASN 37 H ASN 37 -2.801 6.181 -7.326
256 HA ASN 37 HA ASN 37 -5.092 5.014 -8.780
257 HB2 ASN 37 1HB ASN 37 -4.049 3.600 -6.941
258 HB3 ASN 37 2HB ASN 37 -4.573 4.832 -5.800
259 HD21 ASN 37 1HD2 ASN 37 -5.949 3.474 -4.699
260 HD22 ASN 37 2HD2 ASN 37 -7.427 2.885 -5.376
261 H GLY 38 H GLY 38 -4.472 7.755 -8.771
262 HA2 GLY 38 1HA GLY 38 -5.803 9.689 -8.540
263 HA3 GLY 38 2HA GLY 38 -6.715 8.883 -7.265
264 H PHE 39 H PHE 39 -3.913 8.013 -6.345
265 HA PHE 39 HA PHE 39 -2.713 10.387 -5.292
266 HB2 PHE 39 1HB PHE 39 -3.043 9.654 -2.891
267 HB3 PHE 39 2HB PHE 39 -4.487 10.279 -3.678
268 HD1 PHE 39 HD1 PHE 39 -2.832 7.276 -2.378
269 HD2 PHE 39 HD2 PHE 39 -6.369 8.858 -4.134
270 HE1 PHE 39 HE1 PHE 39 -4.040 5.218 -1.788
271 HE2 PHE 39 HE2 PHE 39 -7.584 6.802 -3.547
272 HZ PHE 39 HZ PHE 39 -6.421 4.978 -2.372
273 H ARG 40 H ARG 40 -0.669 9.951 -4.387
274 HA ARG 40 HA ARG 40 0.265 7.178 -4.710
275 HB2 ARG 40 1HB ARG 40 1.745 9.799 -4.744
276 HB3 ARG 40 2HB ARG 40 2.563 8.253 -4.604
277 HG2 ARG 40 1HG ARG 40 1.604 7.575 -6.761
278 HG3 ARG 40 2HG ARG 40 0.853 9.168 -6.903
279 HD2 ARG 40 1HD ARG 40 3.010 10.237 -6.890
280 HD3 ARG 40 2HD ARG 40 3.810 8.698 -6.579
281 HE ARG 40 HE ARG 40 2.286 8.648 -8.991
282 HH11 ARG 40 1HH1 ARG 40 5.297 9.742 -7.598
283 HH12 ARG 40 2HH1 ARG 40 6.174 9.669 -9.090
284 HH21 ARG 40 1HH2 ARG 40 3.432 8.548 -10.967
285 HH22 ARG 40 2HH2 ARG 40 5.108 8.985 -11.010
286 H THR 41 H THR 41 -1.099 7.298 -2.525
287 HA THR 41 HA THR 41 0.893 7.458 -0.400
288 HB THR 41 HB THR 41 -0.990 8.433 1.074
289 HG1 THR 41 HG1 THR 41 -2.748 8.515 -0.201
290 HG21 THR 41 1HG2 THR 41 1.062 9.633 0.541
291 HG22 THR 41 2HG2 THR 41 -0.322 10.725 0.506
292 HG23 THR 41 3HG2 THR 41 0.377 10.140 -1.004
293 H LEU 42 H LEU 42 0.509 6.160 1.377
294 HA LEU 42 HA LEU 42 -1.632 4.178 1.049
295 HB2 LEU 42 1HB LEU 42 1.161 3.876 2.131
296 HB3 LEU 42 2HB LEU 42 -0.093 2.683 2.396
297 HG LEU 42 HG LEU 42 1.024 3.506 -0.281
298 HD11 LEU 42 1HD1 LEU 42 1.302 0.947 1.277
299 HD12 LEU 42 2HD1 LEU 42 2.557 2.165 1.065
300 HD13 LEU 42 3HD1 LEU 42 1.956 1.267 -0.327
301 HD21 LEU 42 1HD2 LEU 42 -1.308 2.932 -0.519
302 HD22 LEU 42 2HD2 LEU 42 -1.082 1.475 0.449
303 HD23 LEU 42 3HD2 LEU 42 -0.321 1.606 -1.137
304 H GLU 43 H GLU 43 -2.465 3.287 3.026
305 HA GLU 43 HA GLU 43 -2.288 5.170 5.278
306 HB2 GLU 43 1HB GLU 43 -4.581 3.411 4.399
307 HB3 GLU 43 2HB GLU 43 -4.564 4.351 5.884
308 HG2 GLU 43 1HG GLU 43 -4.347 6.405 4.546
309 HG3 GLU 43 2HG GLU 43 -4.459 5.429 3.080
310 H GLU 44 H GLU 44 -2.648 4.160 7.403
311 HA GLU 44 HA GLU 44 -1.036 1.887 7.803
312 HB2 GLU 44 1HB GLU 44 -1.447 3.635 9.510
313 HB3 GLU 44 2HB GLU 44 -3.113 3.093 9.637
314 HG2 GLU 44 1HG GLU 44 -2.232 0.854 10.304
315 HG3 GLU 44 2HG GLU 44 -0.634 1.588 10.392
316 H ASN 45 H ASN 45 -1.574 -0.206 8.251
317 HA ASN 45 HA ASN 45 -2.596 -2.166 7.901
318 HB2 ASN 45 1HB ASN 45 -4.764 -2.518 8.993
319 HB3 ASN 45 2HB ASN 45 -3.638 -1.654 10.018
320 HD21 ASN 45 1HD2 ASN 45 -4.089 0.411 10.648
321 HD22 ASN 45 2HD2 ASN 45 -5.618 1.166 10.380
322 H GLN 46 H GLN 46 -2.598 -0.422 5.706
323 HA GLN 46 HA GLN 46 -5.066 -1.054 4.283
324 HB2 GLN 46 1HB GLN 46 -4.192 1.168 3.913
325 HB3 GLN 46 2HB GLN 46 -2.607 0.526 3.515
326 HG2 GLN 46 1HG GLN 46 -3.545 1.087 1.463
327 HG3 GLN 46 2HG GLN 46 -3.745 -0.657 1.580
328 HE21 GLN 46 1HE2 GLN 46 -5.287 2.391 1.462
329 HE22 GLN 46 2HE2 GLN 46 -6.912 1.816 1.358
330 H LYS 47 H LYS 47 -5.198 -2.639 2.776
331 HA LYS 47 HA LYS 47 -3.023 -4.482 2.497
332 HB2 LYS 47 1HB LYS 47 -5.720 -4.289 1.168
333 HB3 LYS 47 2HB LYS 47 -4.551 -5.545 0.781
334 HG2 LYS 47 1HG LYS 47 -5.667 -5.041 3.527
335 HG3 LYS 47 2HG LYS 47 -6.285 -6.247 2.401
336 HD2 LYS 47 1HD LYS 47 -3.445 -6.162 3.405
337 HD3 LYS 47 2HD LYS 47 -4.719 -7.146 4.125
338 HE2 LYS 47 1HE LYS 47 -3.722 -7.341 1.283
339 HE3 LYS 47 2HE LYS 47 -3.334 -8.452 2.590
340 HZ1 LYS 47 1HZ LYS 47 -5.999 -7.993 1.369
341 HZ2 LYS 47 2HZ LYS 47 -5.751 -8.921 2.757
342 HZ3 LYS 47 3HZ LYS 47 -5.067 -9.403 1.287
343 H VAL 48 H VAL 48 -1.758 -4.837 0.687
344 HA VAL 48 HA VAL 48 -1.875 -2.879 -1.450
345 HB VAL 48 HB VAL 48 -0.784 -1.702 0.402
346 HG11 VAL 48 1HG1 VAL 48 1.263 -3.901 0.247
347 HG12 VAL 48 2HG1 VAL 48 0.129 -3.617 1.569
348 HG13 VAL 48 3HG1 VAL 48 1.394 -2.438 1.224
349 HG21 VAL 48 1HG2 VAL 48 1.274 -1.036 -0.773
350 HG22 VAL 48 2HG2 VAL 48 -0.136 -1.097 -1.831
351 HG23 VAL 48 3HG2 VAL 48 1.056 -2.397 -1.874
352 H GLU 49 H GLU 49 -0.563 -3.353 -3.184
353 HA GLU 49 HA GLU 49 0.856 -5.930 -3.139
354 HB2 GLU 49 1HB GLU 49 -1.162 -6.093 -4.472
355 HB3 GLU 49 2HB GLU 49 -0.739 -4.635 -5.348
356 HG2 GLU 49 1HG GLU 49 1.172 -5.755 -6.330
357 HG3 GLU 49 2HG GLU 49 0.793 -7.219 -5.421
358 H PHE 50 H PHE 50 2.868 -5.966 -4.232
359 HA PHE 50 HA PHE 50 3.905 -3.549 -5.393
360 HB2 PHE 50 1HB PHE 50 5.683 -3.310 -3.594
361 HB3 PHE 50 2HB PHE 50 4.059 -2.806 -3.140
362 HD1 PHE 50 HD1 PHE 50 6.775 -5.098 -2.472
363 HD2 PHE 50 HD2 PHE 50 2.677 -4.258 -1.694
364 HE1 PHE 50 HE1 PHE 50 6.825 -6.625 -0.545
365 HE2 PHE 50 HE2 PHE 50 2.722 -5.784 0.226
366 HZ PHE 50 HZ PHE 50 4.798 -6.968 0.806
367 H GLU 51 H GLU 51 6.176 -3.726 -5.947
368 HA GLU 51 HA GLU 51 7.042 -6.515 -6.317
369 HB2 GLU 51 1HB GLU 51 6.678 -5.085 -8.363
370 HB3 GLU 51 2HB GLU 51 7.969 -4.040 -7.790
371 HG2 GLU 51 1HG GLU 51 8.774 -5.570 -9.485
372 HG3 GLU 51 2HG GLU 51 9.541 -5.892 -7.931
373 H ILE 52 H ILE 52 8.574 -7.115 -4.910
374 HA ILE 52 HA ILE 52 9.791 -5.166 -3.221
375 HB ILE 52 HB ILE 52 10.262 -8.137 -3.403
376 HG12 ILE 52 1HG1 ILE 52 8.677 -6.468 -1.447
377 HG13 ILE 52 2HG1 ILE 52 7.988 -7.471 -2.717
378 HG21 ILE 52 1HG2 ILE 52 12.211 -7.020 -2.468
379 HG22 ILE 52 2HG2 ILE 52 11.347 -7.911 -1.213
380 HG23 ILE 52 3HG2 ILE 52 11.181 -6.159 -1.326
381 HD11 ILE 52 1HD1 ILE 52 9.585 -8.440 -0.360
382 HD12 ILE 52 2HD1 ILE 52 8.917 -9.456 -1.637
383 HD13 ILE 52 3HD1 ILE 52 7.838 -8.565 -0.565
384 H GLY 53 H GLY 53 11.434 -3.981 -3.761
385 HA2 GLY 53 1HA GLY 53 13.633 -5.186 -5.313
386 HA3 GLY 53 2HA GLY 53 13.345 -3.455 -5.143
387 H GLU 54 H GLU 54 15.795 -3.899 -4.524
388 HA GLU 54 HA GLU 54 15.933 -4.552 -1.671
389 HB2 GLU 54 1HB GLU 54 17.423 -5.782 -3.244
390 HB3 GLU 54 2HB GLU 54 18.196 -4.257 -3.644
391 HG2 GLU 54 1HG GLU 54 19.484 -5.577 -2.029
392 HG3 GLU 54 2HG GLU 54 18.991 -4.010 -1.385
393 H GLY 55 H GLY 55 16.818 -3.143 -0.190
394 HA2 GLY 55 1HA GLY 55 17.357 -0.413 -1.174
395 HA3 GLY 55 2HA GLY 55 16.303 -0.695 0.203
396 H ALA 56 H ALA 56 17.919 0.817 1.178
397 HA ALA 56 HA ALA 56 20.574 -0.151 1.654
398 HB1 ALA 56 1HB ALA 56 20.083 2.241 1.504
399 HB2 ALA 56 2HB ALA 56 20.829 1.827 3.049
400 HB3 ALA 56 3HB ALA 56 19.094 2.127 2.960
401 H LYS 57 H LYS 57 17.716 0.320 3.734
402 HA LYS 57 HA LYS 57 18.998 -1.421 5.734
403 HB2 LYS 57 1HB LYS 57 16.915 0.739 6.043
404 HB3 LYS 57 2HB LYS 57 17.347 -0.377 7.331
405 HG2 LYS 57 1HG LYS 57 19.646 0.432 7.268
406 HG3 LYS 57 2HG LYS 57 19.217 1.548 5.971
407 HD2 LYS 57 1HD LYS 57 17.688 2.718 7.435
408 HD3 LYS 57 2HD LYS 57 17.978 1.548 8.721
409 HE2 LYS 57 1HE LYS 57 20.056 3.374 7.522
410 HE3 LYS 57 2HE LYS 57 19.225 3.650 9.050
411 HZ1 LYS 57 1HZ LYS 57 20.974 1.330 8.440
412 HZ2 LYS 57 2HZ LYS 57 20.196 1.620 9.910
413 HZ3 LYS 57 3HZ LYS 57 21.410 2.667 9.377
414 H GLY 58 H GLY 58 17.587 -2.344 3.401
415 HA2 GLY 58 1HA GLY 58 16.420 -4.571 3.870
416 HA3 GLY 58 2HA GLY 58 15.183 -3.548 4.593
417 HA PRO 59 HA PRO 59 14.589 -4.334 -0.110
418 HB2 PRO 59 1HB PRO 59 12.061 -5.395 0.296
419 HB3 PRO 59 2HB PRO 59 13.524 -6.337 0.011
420 HG2 PRO 59 1HG PRO 59 12.164 -5.672 2.581
421 HG3 PRO 59 2HG PRO 59 12.936 -7.186 2.077
422 HD2 PRO 59 1HD PRO 59 14.162 -5.509 3.751
423 HD3 PRO 59 2HD PRO 59 15.075 -6.376 2.499
424 H GLN 60 H GLN 60 13.032 -3.240 -1.416
425 HA GLN 60 HA GLN 60 11.408 -1.282 0.052
426 HB2 GLN 60 1HB GLN 60 12.011 0.469 -1.499
427 HB3 GLN 60 2HB GLN 60 13.466 -0.199 -0.769
428 HG2 GLN 60 1HG GLN 60 13.919 -1.471 -2.780
429 HG3 GLN 60 2HG GLN 60 12.427 -0.879 -3.510
430 HE21 GLN 60 1HE2 GLN 60 15.675 -0.119 -2.615
431 HE22 GLN 60 2HE2 GLN 60 15.767 1.398 -3.439
432 H ALA 61 H ALA 61 9.466 -0.742 -0.811
433 HA ALA 61 HA ALA 61 8.364 -2.700 -2.627
434 HB1 ALA 61 1HB ALA 61 6.211 -1.705 -2.071
435 HB2 ALA 61 2HB ALA 61 7.024 -0.393 -1.217
436 HB3 ALA 61 3HB ALA 61 7.138 -2.045 -0.608
437 H GLN 62 H GLN 62 8.401 -2.447 -4.716
438 HA GLN 62 HA GLN 62 8.362 0.266 -5.859
439 HB2 GLN 62 1HB GLN 62 9.330 -2.327 -7.074
440 HB3 GLN 62 2HB GLN 62 9.423 -0.741 -7.827
441 HG2 GLN 62 1HG GLN 62 11.043 0.009 -6.296
442 HG3 GLN 62 2HG GLN 62 10.749 -1.342 -5.206
443 HE21 GLN 62 1HE2 GLN 62 10.688 -3.332 -7.282
444 HE22 GLN 62 2HE2 GLN 62 12.315 -3.546 -7.817
445 H GLN 63 H GLN 63 6.959 0.640 -7.647
446 HA GLN 63 HA GLN 63 4.917 0.569 -8.653
447 HB2 GLN 63 1HB GLN 63 5.699 -2.339 -8.824
448 HB3 GLN 63 2HB GLN 63 4.257 -1.692 -9.587
449 HG2 GLN 63 1HG GLN 63 5.923 -1.834 -11.252
450 HG3 GLN 63 2HG GLN 63 5.732 -0.129 -10.857
451 HE21 GLN 63 1HE2 GLN 63 7.415 0.980 -9.968
452 HE22 GLN 63 2HE2 GLN 63 9.000 0.317 -9.787
453 H VAL 64 H VAL 64 4.393 1.002 -6.240
454 HA VAL 64 HA VAL 64 3.160 -1.196 -4.829
455 HB VAL 64 HB VAL 64 3.139 1.679 -3.961
456 HG11 VAL 64 1HG1 VAL 64 3.161 -0.921 -2.454
457 HG12 VAL 64 2HG1 VAL 64 1.799 0.188 -2.632
458 HG13 VAL 64 3HG1 VAL 64 3.227 0.681 -1.720
459 HG21 VAL 64 1HG2 VAL 64 5.424 1.187 -4.600
460 HG22 VAL 64 2HG2 VAL 64 5.395 -0.290 -3.639
461 HG23 VAL 64 3HG2 VAL 64 5.290 1.282 -2.844
462 H HIS 65 H HIS 65 1.143 -1.767 -5.136
463 HA HIS 65 HA HIS 65 -0.824 0.214 -6.084
464 HB2 HIS 65 1HB HIS 65 -0.892 -2.803 -6.205
465 HB3 HIS 65 2HB HIS 65 -2.191 -1.754 -6.737
466 HD1 HIS 65 HD1 HIS 65 -2.112 -0.973 -9.103
467 HD2 HIS 65 HD2 HIS 65 1.479 -2.640 -7.844
468 HE1 HIS 65 HE1 HIS 65 -0.709 -1.193 -11.175
469 HE2 HIS 65 HE2 HIS 65 1.384 -2.382 -10.417
470 H ALA 66 H ALA 66 -2.272 0.889 -4.614
471 HA ALA 66 HA ALA 66 -2.560 -0.433 -2.087
472 HB1 ALA 66 1HB ALA 66 -4.247 1.255 -1.604
473 HB2 ALA 66 2HB ALA 66 -4.242 1.764 -3.294
474 HB3 ALA 66 3HB ALA 66 -2.806 2.000 -2.297
475 H LEU 67 H LEU 67 -3.735 -2.176 -1.738
476 HA LEU 67 HA LEU 67 -5.428 -3.203 -3.832
477 HB2 LEU 67 1HB LEU 67 -4.570 -4.289 -1.162
478 HB3 LEU 67 2HB LEU 67 -5.679 -5.141 -2.214
479 HG LEU 67 HG LEU 67 -2.807 -4.447 -2.822
480 HD11 LEU 67 1HD1 LEU 67 -2.473 -6.858 -2.772
481 HD12 LEU 67 2HD1 LEU 67 -4.171 -7.096 -2.359
482 HD13 LEU 67 3HD1 LEU 67 -3.095 -6.276 -1.227
483 HD21 LEU 67 1HD2 LEU 67 -3.163 -5.806 -4.864
484 HD22 LEU 67 2HD2 LEU 67 -4.082 -4.304 -4.858
485 HD23 LEU 67 3HD2 LEU 67 -4.889 -5.831 -4.508
486 H GLY 68 H GLY 68 -7.218 -1.845 -3.873
487 HA2 GLY 68 1HA GLY 68 -8.846 -1.353 -1.587
488 HA3 GLY 68 2HA GLY 68 -9.326 -1.143 -3.267
489 H GLY 69 H GLY 69 -10.226 -2.672 -0.592
490 HA2 GLY 69 1HA GLY 69 -10.529 -5.356 -1.649
491 HA3 GLY 69 2HA GLY 69 -11.004 -4.801 -0.053
492 H GLU 70 H GLU 70 -12.905 -3.318 -0.004
493 HA GLU 70 HA GLU 70 -14.899 -4.284 -1.942
494 HB2 GLU 70 1HB GLU 70 -15.261 -3.541 0.967
495 HB3 GLU 70 2HB GLU 70 -16.562 -4.008 -0.123
496 HG2 GLU 70 1HG GLU 70 -15.652 -6.207 -0.365
497 HG3 GLU 70 2HG GLU 70 -14.209 -5.759 0.541
498 H ASN 71 H ASN 71 -13.583 -2.214 -2.813
499 HA ASN 71 HA ASN 71 -14.842 0.272 -1.982
500 HB2 ASN 71 1HB ASN 71 -12.691 -0.331 -4.021
501 HB3 ASN 71 2HB ASN 71 -13.330 1.280 -3.728
502 HD21 ASN 71 1HD2 ASN 71 -13.599 0.809 -0.839
503 HD22 ASN 71 2HD2 ASN 71 -11.992 0.881 -0.209
504 H LEU 72 H LEU 72 -16.774 -1.317 -2.881
505 HA LEU 72 HA LEU 72 -17.239 -0.921 -5.699
506 HB2 LEU 72 1HB LEU 72 -18.038 -2.945 -4.552
507 HB3 LEU 72 2HB LEU 72 -19.069 -1.960 -3.533
508 HG LEU 72 HG LEU 72 -20.357 -1.268 -5.527
509 HD11 LEU 72 1HD1 LEU 72 -20.035 -2.427 -7.641
510 HD12 LEU 72 2HD1 LEU 72 -18.633 -3.268 -6.979
511 HD13 LEU 72 3HD1 LEU 72 -18.589 -1.518 -7.195
512 HD21 LEU 72 1HD2 LEU 72 -21.127 -3.144 -4.199
513 HD22 LEU 72 2HD2 LEU 72 -20.108 -4.245 -5.126
514 HD23 LEU 72 3HD2 LEU 72 -21.461 -3.428 -5.907
515 H TYR 73 H TYR 73 -17.053 1.393 -5.689
516 HA TYR 73 HA TYR 73 -19.109 2.922 -4.344
517 HB2 TYR 73 1HB TYR 73 -17.067 3.838 -6.379
518 HB3 TYR 73 2HB TYR 73 -18.046 4.874 -5.347
519 HD1 TYR 73 HD1 TYR 73 -17.801 4.239 -2.734
520 HD2 TYR 73 HD2 TYR 73 -14.884 3.512 -5.742
521 HE1 TYR 73 HE1 TYR 73 -16.052 4.182 -1.013
522 HE2 TYR 73 HE2 TYR 73 -13.126 3.450 -4.026
523 HH TYR 73 HH TYR 73 -12.712 4.216 -1.781
524 H PHE 74 H PHE 74 -18.873 1.144 -7.136
525 HA PHE 74 HA PHE 74 -20.529 2.684 -8.873
526 HB2 PHE 74 1HB PHE 74 -19.923 -0.285 -8.874
527 HB3 PHE 74 2HB PHE 74 -20.683 0.600 -10.188
528 HD1 PHE 74 HD1 PHE 74 -19.385 2.164 -11.548
529 HD2 PHE 74 HD2 PHE 74 -17.562 -0.187 -8.505
530 HE1 PHE 74 HE1 PHE 74 -17.172 2.626 -12.519
531 HE2 PHE 74 HE2 PHE 74 -15.346 0.273 -9.469
532 HZ PHE 74 HZ PHE 74 -15.151 1.682 -11.479
533 H GLN 75 H GLN 75 -22.328 3.266 -7.607
534 HA GLN 75 HA GLN 75 -24.091 1.063 -6.772
535 HB2 GLN 75 1HB GLN 75 -23.493 2.763 -5.061
536 HB3 GLN 75 2HB GLN 75 -24.247 3.998 -6.059
537 HG2 GLN 75 1HG GLN 75 -26.396 2.810 -5.855
538 HG3 GLN 75 2HG GLN 75 -25.622 1.642 -4.785
539 HE21 GLN 75 1HE2 GLN 75 -24.989 2.294 -2.723
540 HE22 GLN 75 2HE2 GLN 75 -25.620 3.723 -1.984
541 H GLY 76 H GLY 76 -23.854 3.865 -8.835
542 HA2 GLY 76 1HA GLY 76 -26.568 3.325 -9.855
543 HA3 GLY 76 2HA GLY 76 -25.738 4.872 -9.981
544 H HIS 77 H HIS 77 -26.924 3.281 -12.094
545 HA HIS 77 HA HIS 77 -24.777 2.097 -13.595
546 HB2 HIS 77 1HB HIS 77 -27.631 2.794 -14.305
547 HB3 HIS 77 2HB HIS 77 -26.512 2.068 -15.451
548 HD1 HIS 77 HD1 HIS 77 -28.871 1.239 -12.795
549 HD2 HIS 77 HD2 HIS 77 -25.631 -0.589 -14.643
550 HE1 HIS 77 HE1 HIS 77 -29.052 -1.201 -12.215
551 HE2 HIS 77 HE2 HIS 77 -26.969 -2.244 -13.170
552 H HIS 78 H HIS 78 -23.217 3.667 -13.855
553 HA HIS 78 HA HIS 78 -24.025 6.072 -15.350
554 HB2 HIS 78 1HB HIS 78 -21.692 5.628 -13.483
555 HB3 HIS 78 2HB HIS 78 -21.871 7.060 -14.492
556 HD1 HIS 78 HD1 HIS 78 -22.297 6.213 -11.160
557 HD2 HIS 78 HD2 HIS 78 -24.780 8.074 -13.927
558 HE1 HIS 78 HE1 HIS 78 -23.981 7.497 -9.805
559 HE2 HIS 78 HE2 HIS 78 -25.573 8.462 -11.499
560 H HIS 79 H HIS 79 -23.252 3.292 -16.281
561 HA HIS 79 HA HIS 79 -21.134 4.162 -18.139
562 HB2 HIS 79 1HB HIS 79 -20.611 2.143 -16.734
563 HB3 HIS 79 2HB HIS 79 -21.955 1.315 -17.510
564 HD1 HIS 79 HD1 HIS 79 -21.331 -0.035 -19.487
565 HD2 HIS 79 HD2 HIS 79 -18.597 3.011 -18.771
566 HE1 HIS 79 HE1 HIS 79 -19.507 -0.351 -21.186
567 HE2 HIS 79 HE2 HIS 79 -17.917 1.559 -20.801
568 H HIS 80 H HIS 80 -22.987 5.311 -19.131
569 HA HIS 80 HA HIS 80 -24.000 3.866 -21.364
570 HB2 HIS 80 1HB HIS 80 -25.602 3.160 -19.557
571 HB3 HIS 80 2HB HIS 80 -26.068 4.849 -19.383
572 HD1 HIS 80 HD1 HIS 80 -27.759 5.760 -21.029
573 HD2 HIS 80 HD2 HIS 80 -26.376 1.979 -22.053
574 HE1 HIS 80 HE1 HIS 80 -29.216 4.999 -22.929
575 HE2 HIS 80 HE2 HIS 80 -28.277 2.767 -23.618
576 H HIS 81 H HIS 81 -25.055 6.637 -19.382
577 HA HIS 81 HA HIS 81 -25.109 8.870 -19.749
578 HB2 HIS 81 1HB HIS 81 -22.775 8.668 -20.484
579 HB3 HIS 81 2HB HIS 81 -23.314 8.283 -22.114
580 HD1 HIS 81 HD1 HIS 81 -24.157 10.237 -23.577
581 HD2 HIS 81 HD2 HIS 81 -22.930 11.373 -19.775
582 HE1 HIS 81 HE1 HIS 81 -24.002 12.741 -23.639
583 HE2 HIS 81 HE2 HIS 81 -23.109 13.394 -21.378
584 H HIS 82 H HIS 82 -26.729 10.045 -20.505
585 HA HIS 82 HA HIS 82 -28.080 9.159 -22.948
586 HB2 HIS 82 1HB HIS 82 -29.472 9.453 -20.923
587 HB3 HIS 82 2HB HIS 82 -28.989 11.144 -20.846
588 HD1 HIS 82 HD1 HIS 82 -30.585 12.709 -21.899
589 HD2 HIS 82 HD2 HIS 82 -30.861 8.901 -23.537
590 HE1 HIS 82 HE1 HIS 82 -32.487 12.815 -23.538
591 HE2 HIS 82 HE2 HIS 82 -32.729 10.465 -24.405
Start of MODEL 10
1 H2 MET 1 2H MET 1 5.028 -7.874 -8.735
2 H MET 1 1H MET 1 4.166 -7.501 -7.335
3 H3 MET 1 3H MET 1 5.818 -7.867 -7.240
4 HA MET 1 HA MET 1 3.792 -9.774 -8.230
5 HB2 MET 1 1HB MET 1 6.088 -10.234 -8.910
6 HB3 MET 1 2HB MET 1 6.630 -10.108 -7.243
7 HG2 MET 1 1HG MET 1 5.189 -12.046 -6.691
8 HG3 MET 1 2HG MET 1 4.824 -12.211 -8.405
9 HE1 MET 1 1HE MET 1 6.061 -14.495 -6.481
10 HE2 MET 1 2HE MET 1 7.237 -15.222 -7.575
11 HE3 MET 1 3HE MET 1 5.640 -14.769 -8.170
12 H ALA 2 H ALA 2 5.684 -8.807 -5.357
13 HA ALA 2 HA ALA 2 4.301 -10.583 -3.609
14 HB1 ALA 2 1HB ALA 2 6.543 -9.830 -3.077
15 HB2 ALA 2 2HB ALA 2 5.421 -9.334 -1.808
16 HB3 ALA 2 3HB ALA 2 5.986 -8.158 -2.997
17 H GLN 3 H GLN 3 2.962 -9.954 -1.828
18 HA GLN 3 HA GLN 3 1.489 -7.443 -2.207
19 HB2 GLN 3 1HB GLN 3 0.232 -10.144 -1.709
20 HB3 GLN 3 2HB GLN 3 -0.624 -8.612 -1.676
21 HG2 GLN 3 1HG GLN 3 -0.113 -8.271 -4.031
22 HG3 GLN 3 2HG GLN 3 0.759 -9.802 -4.066
23 HE21 GLN 3 1HE2 GLN 3 -2.339 -8.277 -3.928
24 HE22 GLN 3 2HE2 GLN 3 -3.284 -9.688 -4.234
25 H GLY 4 H GLY 4 0.090 -7.027 -0.208
26 HA2 GLY 4 1HA GLY 4 0.466 -8.354 2.198
27 HA3 GLY 4 2HA GLY 4 1.750 -7.160 2.084
28 H THR 5 H THR 5 0.887 -6.163 3.914
29 HA THR 5 HA THR 5 -1.316 -4.325 3.266
30 HB THR 5 HB THR 5 -0.851 -5.551 5.994
31 HG1 THR 5 HG1 THR 5 -1.759 -6.964 4.243
32 HG21 THR 5 1HG2 THR 5 -3.119 -3.859 4.935
33 HG22 THR 5 2HG2 THR 5 -1.843 -3.302 6.019
34 HG23 THR 5 3HG2 THR 5 -2.992 -4.524 6.566
35 H VAL 6 H VAL 6 -0.608 -2.280 3.393
36 HA VAL 6 HA VAL 6 1.931 -1.638 4.445
37 HB VAL 6 HB VAL 6 1.344 -0.121 2.830
38 HG11 VAL 6 1HG1 VAL 6 -0.837 1.023 2.704
39 HG12 VAL 6 2HG1 VAL 6 -1.384 0.043 4.064
40 HG13 VAL 6 3HG1 VAL 6 -0.943 -0.730 2.541
41 HG21 VAL 6 1HG2 VAL 6 0.974 2.062 3.874
42 HG22 VAL 6 2HG2 VAL 6 2.162 1.103 4.762
43 HG23 VAL 6 3HG2 VAL 6 0.514 1.258 5.378
44 H LYS 7 H LYS 7 2.471 -1.686 6.452
45 HA LYS 7 HA LYS 7 0.558 -1.901 8.535
46 HB2 LYS 7 1HB LYS 7 2.518 -2.029 10.015
47 HB3 LYS 7 2HB LYS 7 2.656 -3.115 8.642
48 HG2 LYS 7 1HG LYS 7 4.227 -1.697 7.577
49 HG3 LYS 7 2HG LYS 7 3.934 -0.402 8.737
50 HD2 LYS 7 1HD LYS 7 6.009 -1.479 9.282
51 HD3 LYS 7 2HD LYS 7 4.823 -1.871 10.526
52 HE2 LYS 7 1HE LYS 7 4.424 -4.034 9.436
53 HE3 LYS 7 2HE LYS 7 5.641 -3.637 8.224
54 HZ1 LYS 7 1HZ LYS 7 7.244 -3.422 10.107
55 HZ2 LYS 7 2HZ LYS 7 6.675 -4.994 9.839
56 HZ3 LYS 7 3HZ LYS 7 6.059 -4.075 11.124
57 H TRP 8 H TRP 8 2.546 0.634 7.258
58 HA TRP 8 HA TRP 8 0.844 2.635 8.265
59 HB2 TRP 8 1HB TRP 8 2.322 3.815 9.775
60 HB3 TRP 8 2HB TRP 8 2.093 2.179 10.370
61 HD1 TRP 8 HD1 TRP 8 4.208 0.618 10.501
62 HE1 TRP 8 HE1 TRP 8 6.733 1.075 10.313
63 HE3 TRP 8 HE3 TRP 8 4.035 5.313 8.486
64 HZ2 TRP 8 HZ2 TRP 8 8.424 3.156 9.434
65 HZ3 TRP 8 HZ3 TRP 8 6.151 6.465 8.004
66 HH2 TRP 8 HH2 TRP 8 8.298 5.404 8.468
67 H PHE 9 H PHE 9 1.290 4.654 7.332
68 HA PHE 9 HA PHE 9 3.660 4.858 5.669
69 HB2 PHE 9 1HB PHE 9 1.879 3.776 4.270
70 HB3 PHE 9 2HB PHE 9 0.914 5.234 4.469
71 HD1 PHE 9 HD1 PHE 9 1.391 7.208 3.219
72 HD2 PHE 9 HD2 PHE 9 3.984 3.842 3.020
73 HE1 PHE 9 HE1 PHE 9 2.539 8.209 1.286
74 HE2 PHE 9 HE2 PHE 9 5.140 4.841 1.094
75 HZ PHE 9 HZ PHE 9 4.419 7.027 0.227
76 H ASN 10 H ASN 10 4.474 6.796 5.797
77 HA ASN 10 HA ASN 10 2.856 8.975 6.883
78 HB2 ASN 10 1HB ASN 10 5.118 8.432 7.840
79 HB3 ASN 10 2HB ASN 10 5.826 8.909 6.302
80 HD21 ASN 10 1HD2 ASN 10 6.127 9.996 9.013
81 HD22 ASN 10 2HD2 ASN 10 5.738 11.675 8.884
82 H ALA 11 H ALA 11 1.689 9.888 5.306
83 HA ALA 11 HA ALA 11 2.404 9.712 2.578
84 HB1 ALA 11 1HB ALA 11 0.377 10.949 2.139
85 HB2 ALA 11 2HB ALA 11 0.262 11.405 3.838
86 HB3 ALA 11 3HB ALA 11 0.085 9.716 3.365
87 H GLU 12 H GLU 12 2.608 12.341 4.930
88 HA GLU 12 HA GLU 12 3.141 14.339 2.980
89 HB2 GLU 12 1HB GLU 12 3.753 15.770 4.870
90 HB3 GLU 12 2HB GLU 12 2.225 14.947 5.149
91 HG2 GLU 12 1HG GLU 12 3.284 13.384 6.627
92 HG3 GLU 12 2HG GLU 12 4.868 14.058 6.260
93 H LYS 13 H LYS 13 5.128 12.153 4.844
94 HA LYS 13 HA LYS 13 7.573 13.443 3.966
95 HB2 LYS 13 1HB LYS 13 7.131 10.915 5.551
96 HB3 LYS 13 2HB LYS 13 8.701 11.618 5.199
97 HG2 LYS 13 1HG LYS 13 6.517 12.784 6.893
98 HG3 LYS 13 2HG LYS 13 8.094 12.204 7.419
99 HD2 LYS 13 1HD LYS 13 9.091 13.981 5.918
100 HD3 LYS 13 2HD LYS 13 7.461 14.638 5.779
101 HE2 LYS 13 1HE LYS 13 9.012 14.262 8.334
102 HE3 LYS 13 2HE LYS 13 8.745 15.790 7.504
103 HZ1 LYS 13 1HZ LYS 13 6.683 14.082 8.787
104 HZ2 LYS 13 2HZ LYS 13 6.332 15.465 7.874
105 HZ3 LYS 13 3HZ LYS 13 7.214 15.599 9.310
106 H GLY 14 H GLY 14 5.610 10.670 3.229
107 HA2 GLY 14 1HA GLY 14 5.411 9.798 1.065
108 HA3 GLY 14 2HA GLY 14 6.958 10.511 0.654
109 H PHE 15 H PHE 15 6.589 8.568 3.545
110 HA PHE 15 HA PHE 15 7.532 6.201 2.150
111 HB2 PHE 15 1HB PHE 15 9.515 5.885 3.438
112 HB3 PHE 15 2HB PHE 15 9.580 7.507 2.766
113 HD1 PHE 15 HD1 PHE 15 9.494 5.506 5.773
114 HD2 PHE 15 HD2 PHE 15 9.200 9.468 4.247
115 HE1 PHE 15 HE1 PHE 15 9.928 6.401 8.021
116 HE2 PHE 15 HE2 PHE 15 9.625 10.367 6.500
117 HZ PHE 15 HZ PHE 15 9.990 8.833 8.387
118 H GLY 16 H GLY 16 7.564 4.283 3.507
119 HA2 GLY 16 1HA GLY 16 6.410 4.265 6.101
120 HA3 GLY 16 2HA GLY 16 5.192 3.904 4.884
121 H PHE 17 H PHE 17 5.081 1.813 6.003
122 HA PHE 17 HA PHE 17 7.027 -0.037 4.828
123 HB2 PHE 17 1HB PHE 17 6.388 0.248 7.730
124 HB3 PHE 17 2HB PHE 17 6.709 -1.358 7.087
125 HD1 PHE 17 HD1 PHE 17 8.127 1.953 7.736
126 HD2 PHE 17 HD2 PHE 17 8.896 -2.011 6.412
127 HE1 PHE 17 HE1 PHE 17 10.540 2.362 7.939
128 HE2 PHE 17 HE2 PHE 17 11.314 -1.611 6.606
129 HZ PHE 17 HZ PHE 17 12.139 0.578 7.375
130 H ILE 18 H ILE 18 6.275 -2.026 4.337
131 HA ILE 18 HA ILE 18 3.406 -2.507 4.766
132 HB ILE 18 HB ILE 18 5.141 -3.325 2.437
133 HG12 ILE 18 1HG1 ILE 18 2.621 -1.684 2.399
134 HG13 ILE 18 2HG1 ILE 18 4.221 -0.966 2.542
135 HG21 ILE 18 1HG2 ILE 18 3.126 -4.361 1.493
136 HG22 ILE 18 2HG2 ILE 18 2.275 -4.048 3.007
137 HG23 ILE 18 3HG2 ILE 18 3.656 -5.147 2.981
138 HD11 ILE 18 1HD1 ILE 18 4.852 -1.918 0.399
139 HD12 ILE 18 2HD1 ILE 18 3.400 -0.925 0.246
140 HD13 ILE 18 3HD1 ILE 18 3.269 -2.687 0.265
141 H ALA 19 H ALA 19 2.787 -4.471 5.510
142 HA ALA 19 HA ALA 19 4.910 -6.374 6.214
143 HB1 ALA 19 1HB ALA 19 3.241 -7.413 7.668
144 HB2 ALA 19 2HB ALA 19 2.019 -6.279 7.090
145 HB3 ALA 19 3HB ALA 19 3.397 -5.692 8.025
146 HA PRO 20 HA PRO 20 3.538 -8.063 2.190
147 HB2 PRO 20 1HB PRO 20 5.775 -9.870 2.952
148 HB3 PRO 20 2HB PRO 20 5.441 -9.082 1.410
149 HG2 PRO 20 1HG PRO 20 7.350 -8.157 3.008
150 HG3 PRO 20 2HG PRO 20 6.299 -7.048 2.113
151 HD2 PRO 20 1HD PRO 20 6.262 -7.774 4.996
152 HD3 PRO 20 2HD PRO 20 5.899 -6.225 4.219
153 H ASP 21 H ASP 21 2.223 -9.667 1.728
154 HA ASP 21 HA ASP 21 1.325 -11.527 3.715
155 HB2 ASP 21 1HB ASP 21 -0.288 -10.700 2.152
156 HB3 ASP 21 2HB ASP 21 0.723 -11.134 0.780
157 H ASP 22 H ASP 22 3.835 -11.389 1.514
158 HA ASP 22 HA ASP 22 4.120 -14.183 0.951
159 HB2 ASP 22 1HB ASP 22 5.902 -11.794 0.489
160 HB3 ASP 22 2HB ASP 22 6.353 -13.431 0.024
161 H GLY 23 H GLY 23 4.111 -13.217 3.789
162 HA2 GLY 23 1HA GLY 23 5.086 -14.475 5.569
163 HA3 GLY 23 2HA GLY 23 6.541 -14.648 4.603
164 H SER 24 H SER 24 5.079 -11.582 4.667
165 HA SER 24 HA SER 24 5.814 -9.562 5.374
166 HB2 SER 24 1HB SER 24 5.810 -9.492 7.961
167 HB3 SER 24 2HB SER 24 4.331 -9.924 7.107
168 HG SER 24 HG SER 24 6.194 -11.730 8.270
169 H ALA 25 H ALA 25 7.932 -9.681 4.361
170 HA ALA 25 HA ALA 25 10.187 -10.055 6.137
171 HB1 ALA 25 1HB ALA 25 11.554 -9.407 4.228
172 HB2 ALA 25 2HB ALA 25 10.103 -8.961 3.329
173 HB3 ALA 25 3HB ALA 25 10.386 -10.645 3.770
174 H ASP 26 H ASP 26 7.951 -7.782 5.976
175 HA ASP 26 HA ASP 26 7.695 -5.588 6.446
176 HB2 ASP 26 1HB ASP 26 10.391 -5.921 7.768
177 HB3 ASP 26 2HB ASP 26 9.314 -4.545 7.987
178 H VAL 27 H VAL 27 7.701 -4.790 4.406
179 HA VAL 27 HA VAL 27 10.287 -4.151 3.201
180 HB VAL 27 HB VAL 27 8.713 -5.570 1.928
181 HG11 VAL 27 1HG1 VAL 27 6.999 -3.106 1.884
182 HG12 VAL 27 2HG1 VAL 27 6.613 -4.654 2.644
183 HG13 VAL 27 3HG1 VAL 27 6.746 -4.540 0.887
184 HG21 VAL 27 1HG2 VAL 27 8.895 -4.372 -0.186
185 HG22 VAL 27 2HG2 VAL 27 10.381 -4.270 0.760
186 HG23 VAL 27 3HG2 VAL 27 9.280 -2.892 0.695
187 H PHE 28 H PHE 28 10.883 -2.128 2.694
188 HA PHE 28 HA PHE 28 9.449 0.049 3.950
189 HB2 PHE 28 1HB PHE 28 11.854 -0.056 4.202
190 HB3 PHE 28 2HB PHE 28 12.074 -0.090 2.459
191 HD1 PHE 28 HD1 PHE 28 12.210 1.895 1.210
192 HD2 PHE 28 HD2 PHE 28 10.967 2.027 5.278
193 HE1 PHE 28 HE1 PHE 28 12.403 4.348 1.185
194 HE2 PHE 28 HE2 PHE 28 11.156 4.478 5.260
195 HZ PHE 28 HZ PHE 28 11.872 5.643 3.213
196 H VAL 29 H VAL 29 8.336 1.647 2.932
197 HA VAL 29 HA VAL 29 8.062 1.362 0.010
198 HB VAL 29 HB VAL 29 6.081 2.843 1.684
199 HG11 VAL 29 1HG1 VAL 29 4.540 2.150 -0.072
200 HG12 VAL 29 2HG1 VAL 29 5.831 1.233 -0.846
201 HG13 VAL 29 3HG1 VAL 29 5.939 2.991 -0.743
202 HG21 VAL 29 1HG2 VAL 29 6.341 0.714 2.818
203 HG22 VAL 29 2HG2 VAL 29 6.089 -0.139 1.293
204 HG23 VAL 29 3HG2 VAL 29 4.782 0.813 2.001
205 H HIS 30 H HIS 30 8.603 3.021 -1.257
206 HA HIS 30 HA HIS 30 8.776 5.700 -0.047
207 HB2 HIS 30 1HB HIS 30 10.964 4.646 -0.866
208 HB3 HIS 30 2HB HIS 30 10.307 4.793 -2.493
209 HD1 HIS 30 HD1 HIS 30 11.632 6.638 -3.510
210 HD2 HIS 30 HD2 HIS 30 10.347 7.564 0.333
211 HE1 HIS 30 HE1 HIS 30 12.321 9.025 -3.123
212 HE2 HIS 30 HE2 HIS 30 11.708 9.495 -0.724
213 H TYR 31 H TYR 31 7.544 7.244 -0.969
214 HA TYR 31 HA TYR 31 5.252 6.420 -2.264
215 HB2 TYR 31 1HB TYR 31 4.561 8.672 -2.281
216 HB3 TYR 31 2HB TYR 31 5.611 8.509 -0.881
217 HD1 TYR 31 HD1 TYR 31 7.997 9.365 -1.056
218 HD2 TYR 31 HD2 TYR 31 5.018 10.241 -3.964
219 HE1 TYR 31 HE1 TYR 31 9.333 11.271 -1.844
220 HE2 TYR 31 HE2 TYR 31 6.347 12.145 -4.762
221 HH TYR 31 HH TYR 31 8.086 13.663 -3.902
222 H SER 32 H SER 32 8.242 7.319 -3.739
223 HA SER 32 HA SER 32 7.168 8.174 -6.227
224 HB2 SER 32 1HB SER 32 9.462 8.743 -5.373
225 HB3 SER 32 2HB SER 32 9.941 7.081 -5.718
226 HG SER 32 HG SER 32 8.890 8.906 -7.627
227 H GLU 33 H GLU 33 7.537 5.093 -4.817
228 HA GLU 33 HA GLU 33 7.548 3.738 -7.405
229 HB2 GLU 33 1HB GLU 33 7.822 2.781 -4.571
230 HB3 GLU 33 2HB GLU 33 7.539 1.666 -5.900
231 HG2 GLU 33 1HG GLU 33 9.859 3.567 -5.687
232 HG3 GLU 33 2HG GLU 33 9.908 1.844 -5.317
233 H ILE 34 H ILE 34 5.339 4.921 -5.162
234 HA ILE 34 HA ILE 34 3.386 2.858 -5.330
235 HB ILE 34 HB ILE 34 3.076 5.732 -4.477
236 HG12 ILE 34 1HG1 ILE 34 3.388 3.214 -2.833
237 HG13 ILE 34 2HG1 ILE 34 4.652 4.409 -3.102
238 HG21 ILE 34 1HG2 ILE 34 0.943 4.771 -5.154
239 HG22 ILE 34 2HG2 ILE 34 1.002 4.997 -3.404
240 HG23 ILE 34 3HG2 ILE 34 1.218 3.386 -4.096
241 HD11 ILE 34 1HD1 ILE 34 2.032 4.927 -1.726
242 HD12 ILE 34 2HD1 ILE 34 3.341 6.084 -1.948
243 HD13 ILE 34 3HD1 ILE 34 3.580 4.666 -0.924
244 H GLN 35 H GLN 35 1.906 2.491 -6.758
245 HA GLN 35 HA GLN 35 1.534 4.370 -8.982
246 HB2 GLN 35 1HB GLN 35 0.685 1.474 -8.782
247 HB3 GLN 35 2HB GLN 35 0.735 2.465 -10.232
248 HG2 GLN 35 1HG GLN 35 3.128 1.630 -8.618
249 HG3 GLN 35 2HG GLN 35 2.589 0.868 -10.111
250 HE21 GLN 35 1HE2 GLN 35 5.093 2.251 -9.417
251 HE22 GLN 35 2HE2 GLN 35 5.280 3.486 -10.606
252 H GLY 36 H GLY 36 0.086 5.759 -7.880
253 HA2 GLY 36 1HA GLY 36 -2.266 4.529 -6.643
254 HA3 GLY 36 2HA GLY 36 -1.726 6.184 -6.410
255 H ASN 37 H ASN 37 -4.196 6.241 -6.751
256 HA ASN 37 HA ASN 37 -4.892 6.393 -9.593
257 HB2 ASN 37 1HB ASN 37 -6.690 6.809 -7.191
258 HB3 ASN 37 2HB ASN 37 -7.194 6.604 -8.861
259 HD21 ASN 37 1HD2 ASN 37 -6.153 5.041 -5.978
260 HD22 ASN 37 2HD2 ASN 37 -6.416 3.420 -6.511
261 H GLY 38 H GLY 38 -3.040 8.251 -8.807
262 HA2 GLY 38 1HA GLY 38 -3.165 10.604 -9.549
263 HA3 GLY 38 2HA GLY 38 -4.625 10.738 -8.575
264 H PHE 39 H PHE 39 -3.431 9.055 -6.458
265 HA PHE 39 HA PHE 39 -1.446 10.948 -5.393
266 HB2 PHE 39 1HB PHE 39 -3.763 9.608 -4.022
267 HB3 PHE 39 2HB PHE 39 -2.359 10.149 -3.108
268 HD1 PHE 39 HD1 PHE 39 -5.238 11.220 -5.112
269 HD2 PHE 39 HD2 PHE 39 -1.941 12.470 -2.731
270 HE1 PHE 39 HE1 PHE 39 -6.191 13.484 -4.986
271 HE2 PHE 39 HE2 PHE 39 -2.885 14.737 -2.603
272 HZ PHE 39 HZ PHE 39 -5.016 15.246 -3.733
273 H ARG 40 H ARG 40 0.463 10.051 -5.092
274 HA ARG 40 HA ARG 40 0.738 7.170 -4.995
275 HB2 ARG 40 1HB ARG 40 2.810 9.364 -4.881
276 HB3 ARG 40 2HB ARG 40 3.168 7.647 -4.955
277 HG2 ARG 40 1HG ARG 40 1.925 7.576 -7.129
278 HG3 ARG 40 2HG ARG 40 1.848 9.337 -7.059
279 HD2 ARG 40 1HD ARG 40 4.303 9.425 -6.976
280 HD3 ARG 40 2HD ARG 40 4.358 7.666 -7.091
281 HE ARG 40 HE ARG 40 3.220 9.375 -9.211
282 HH11 ARG 40 1HH1 ARG 40 5.194 6.672 -8.196
283 HH12 ARG 40 2HH1 ARG 40 5.599 6.195 -9.810
284 HH21 ARG 40 1HH2 ARG 40 3.738 8.736 -11.337
285 HH22 ARG 40 2HH2 ARG 40 4.773 7.370 -11.597
286 H THR 41 H THR 41 -0.677 7.546 -2.949
287 HA THR 41 HA THR 41 1.120 7.550 -0.632
288 HB THR 41 HB THR 41 -0.724 8.695 0.661
289 HG1 THR 41 HG1 THR 41 -2.245 8.311 -1.230
290 HG21 THR 41 1HG2 THR 41 1.291 9.894 0.006
291 HG22 THR 41 2HG2 THR 41 -0.115 10.952 -0.115
292 HG23 THR 41 3HG2 THR 41 0.588 10.248 -1.572
293 H LEU 42 H LEU 42 0.621 6.102 0.949
294 HA LEU 42 HA LEU 42 -1.592 4.258 0.378
295 HB2 LEU 42 1HB LEU 42 1.025 3.842 1.816
296 HB3 LEU 42 2HB LEU 42 -0.273 2.666 1.818
297 HG LEU 42 HG LEU 42 1.230 3.618 -0.611
298 HD11 LEU 42 1HD1 LEU 42 2.563 2.204 0.870
299 HD12 LEU 42 2HD1 LEU 42 2.183 1.395 -0.650
300 HD13 LEU 42 3HD1 LEU 42 1.301 0.972 0.818
301 HD21 LEU 42 1HD2 LEU 42 -1.031 3.068 -1.216
302 HD22 LEU 42 2HD2 LEU 42 -0.949 1.562 -0.301
303 HD23 LEU 42 3HD2 LEU 42 0.036 1.771 -1.749
304 H GLU 43 H GLU 43 -2.728 3.370 2.150
305 HA GLU 43 HA GLU 43 -2.950 5.227 4.419
306 HB2 GLU 43 1HB GLU 43 -4.882 3.148 3.375
307 HB3 GLU 43 2HB GLU 43 -5.181 4.213 4.737
308 HG2 GLU 43 1HG GLU 43 -4.723 5.115 1.906
309 HG3 GLU 43 2HG GLU 43 -6.300 4.934 2.670
310 H GLU 44 H GLU 44 -3.032 4.365 6.552
311 HA GLU 44 HA GLU 44 -1.391 2.073 6.925
312 HB2 GLU 44 1HB GLU 44 -1.412 3.995 8.488
313 HB3 GLU 44 2HB GLU 44 -3.046 3.561 8.964
314 HG2 GLU 44 1HG GLU 44 -2.261 1.435 9.807
315 HG3 GLU 44 2HG GLU 44 -0.626 1.814 9.289
316 H ASN 45 H ASN 45 -1.904 0.039 7.320
317 HA ASN 45 HA ASN 45 -3.073 -1.872 7.611
318 HB2 ASN 45 1HB ASN 45 -5.332 -0.072 8.496
319 HB3 ASN 45 2HB ASN 45 -5.361 -1.828 8.583
320 HD21 ASN 45 1HD2 ASN 45 -4.294 1.074 10.023
321 HD22 ASN 45 2HD2 ASN 45 -3.518 0.374 11.398
322 H GLN 46 H GLN 46 -2.985 -0.292 5.182
323 HA GLN 46 HA GLN 46 -5.445 -1.062 3.801
324 HB2 GLN 46 1HB GLN 46 -4.604 1.193 3.432
325 HB3 GLN 46 2HB GLN 46 -3.047 0.558 2.941
326 HG2 GLN 46 1HG GLN 46 -4.181 -0.551 1.026
327 HG3 GLN 46 2HG GLN 46 -5.655 0.301 1.483
328 HE21 GLN 46 1HE2 GLN 46 -5.716 1.439 -0.446
329 HE22 GLN 46 2HE2 GLN 46 -4.616 2.727 -0.784
330 H LYS 47 H LYS 47 -5.485 -2.648 2.254
331 HA LYS 47 HA LYS 47 -3.285 -4.465 2.108
332 HB2 LYS 47 1HB LYS 47 -5.858 -4.282 0.547
333 HB3 LYS 47 2HB LYS 47 -4.667 -5.553 0.305
334 HG2 LYS 47 1HG LYS 47 -6.113 -4.977 2.877
335 HG3 LYS 47 2HG LYS 47 -6.505 -6.270 1.748
336 HD2 LYS 47 1HD LYS 47 -3.849 -5.970 3.148
337 HD3 LYS 47 2HD LYS 47 -5.159 -7.006 3.713
338 HE2 LYS 47 1HE LYS 47 -3.786 -7.241 1.035
339 HE3 LYS 47 2HE LYS 47 -3.443 -8.241 2.442
340 HZ1 LYS 47 1HZ LYS 47 -6.031 -8.087 0.996
341 HZ2 LYS 47 2HZ LYS 47 -5.751 -9.002 2.390
342 HZ3 LYS 47 3HZ LYS 47 -4.938 -9.376 0.958
343 H VAL 48 H VAL 48 -1.947 -4.868 0.327
344 HA VAL 48 HA VAL 48 -1.906 -2.891 -1.784
345 HB VAL 48 HB VAL 48 -0.912 -1.771 0.193
346 HG11 VAL 48 1HG1 VAL 48 0.062 -3.717 1.257
347 HG12 VAL 48 2HG1 VAL 48 1.285 -2.475 0.982
348 HG13 VAL 48 3HG1 VAL 48 1.208 -3.887 -0.074
349 HG21 VAL 48 1HG2 VAL 48 -0.291 -1.072 -2.042
350 HG22 VAL 48 2HG2 VAL 48 0.988 -2.286 -2.082
351 HG23 VAL 48 3HG2 VAL 48 1.084 -0.941 -0.944
352 H GLU 49 H GLU 49 -0.474 -3.338 -3.411
353 HA GLU 49 HA GLU 49 0.886 -5.944 -3.349
354 HB2 GLU 49 1HB GLU 49 -0.945 -6.087 -4.868
355 HB3 GLU 49 2HB GLU 49 -0.605 -4.502 -5.532
356 HG2 GLU 49 1HG GLU 49 1.520 -5.419 -6.439
357 HG3 GLU 49 2HG GLU 49 0.989 -7.015 -5.907
358 H PHE 50 H PHE 50 2.980 -5.977 -4.384
359 HA PHE 50 HA PHE 50 4.116 -3.546 -5.387
360 HB2 PHE 50 1HB PHE 50 5.802 -3.338 -3.521
361 HB3 PHE 50 2HB PHE 50 4.160 -2.871 -3.099
362 HD1 PHE 50 HD1 PHE 50 6.895 -5.128 -2.406
363 HD2 PHE 50 HD2 PHE 50 2.755 -4.391 -1.744
364 HE1 PHE 50 HE1 PHE 50 6.914 -6.701 -0.519
365 HE2 PHE 50 HE2 PHE 50 2.771 -5.964 0.138
366 HZ PHE 50 HZ PHE 50 4.850 -7.121 0.755
367 H GLU 51 H GLU 51 6.568 -3.765 -5.495
368 HA GLU 51 HA GLU 51 7.326 -6.573 -5.964
369 HB2 GLU 51 1HB GLU 51 7.059 -5.108 -8.029
370 HB3 GLU 51 2HB GLU 51 8.421 -4.167 -7.431
371 HG2 GLU 51 1HG GLU 51 9.295 -5.674 -9.009
372 HG3 GLU 51 2HG GLU 51 9.744 -6.307 -7.425
373 H ILE 52 H ILE 52 8.759 -7.165 -4.450
374 HA ILE 52 HA ILE 52 10.084 -5.232 -2.835
375 HB ILE 52 HB ILE 52 10.501 -8.216 -2.989
376 HG12 ILE 52 1HG1 ILE 52 8.950 -6.509 -1.036
377 HG13 ILE 52 2HG1 ILE 52 8.242 -7.514 -2.293
378 HG21 ILE 52 1HG2 ILE 52 11.622 -7.984 -0.822
379 HG22 ILE 52 2HG2 ILE 52 11.455 -6.231 -0.927
380 HG23 ILE 52 3HG2 ILE 52 12.469 -7.089 -2.085
381 HD11 ILE 52 1HD1 ILE 52 8.093 -8.586 -0.131
382 HD12 ILE 52 2HD1 ILE 52 9.843 -8.483 0.060
383 HD13 ILE 52 3HD1 ILE 52 9.151 -9.500 -1.204
384 H GLY 53 H GLY 53 11.845 -4.184 -3.261
385 HA2 GLY 53 1HA GLY 53 13.892 -5.450 -4.974
386 HA3 GLY 53 2HA GLY 53 13.592 -3.716 -4.939
387 H GLU 54 H GLU 54 15.974 -3.789 -4.502
388 HA GLU 54 HA GLU 54 16.521 -4.301 -1.659
389 HB2 GLU 54 1HB GLU 54 17.865 -5.619 -3.269
390 HB3 GLU 54 2HB GLU 54 18.465 -4.122 -3.967
391 HG2 GLU 54 1HG GLU 54 20.149 -4.934 -2.527
392 HG3 GLU 54 2HG GLU 54 19.405 -3.558 -1.717
393 H GLY 55 H GLY 55 16.354 -2.481 -0.537
394 HA2 GLY 55 1HA GLY 55 17.015 0.073 -1.796
395 HA3 GLY 55 2HA GLY 55 16.195 -0.150 -0.257
396 H ALA 56 H ALA 56 17.707 1.494 0.505
397 HA ALA 56 HA ALA 56 20.499 0.794 0.661
398 HB1 ALA 56 1HB ALA 56 19.776 3.124 0.408
399 HB2 ALA 56 2HB ALA 56 20.763 2.889 1.849
400 HB3 ALA 56 3HB ALA 56 19.013 3.048 1.995
401 H LYS 57 H LYS 57 17.705 0.264 2.578
402 HA LYS 57 HA LYS 57 19.384 -0.405 4.904
403 HB2 LYS 57 1HB LYS 57 16.543 0.614 4.854
404 HB3 LYS 57 2HB LYS 57 17.407 0.116 6.301
405 HG2 LYS 57 1HG LYS 57 18.977 1.902 6.061
406 HG3 LYS 57 2HG LYS 57 18.314 2.330 4.483
407 HD2 LYS 57 1HD LYS 57 16.216 2.974 5.501
408 HD3 LYS 57 2HD LYS 57 16.794 2.448 7.083
409 HE2 LYS 57 1HE LYS 57 18.028 4.648 5.430
410 HE3 LYS 57 2HE LYS 57 16.913 4.900 6.771
411 HZ1 LYS 57 1HZ LYS 57 18.522 3.779 8.223
412 HZ2 LYS 57 2HZ LYS 57 19.160 5.175 7.518
413 HZ3 LYS 57 3HZ LYS 57 19.604 3.655 6.929
414 H GLY 58 H GLY 58 17.217 -1.599 2.588
415 HA2 GLY 58 1HA GLY 58 17.417 -4.249 3.165
416 HA3 GLY 58 2HA GLY 58 16.084 -3.705 4.175
417 HA PRO 59 HA PRO 59 14.231 -4.881 0.108
418 HB2 PRO 59 1HB PRO 59 11.854 -5.644 1.236
419 HB3 PRO 59 2HB PRO 59 13.218 -6.732 0.985
420 HG2 PRO 59 1HG PRO 59 12.375 -5.290 3.462
421 HG3 PRO 59 2HG PRO 59 12.955 -6.955 3.279
422 HD2 PRO 59 1HD PRO 59 14.551 -4.989 4.179
423 HD3 PRO 59 2HD PRO 59 15.170 -6.301 3.154
424 H GLN 60 H GLN 60 13.081 -3.516 -1.101
425 HA GLN 60 HA GLN 60 11.472 -1.474 0.279
426 HB2 GLN 60 1HB GLN 60 12.135 0.143 -1.444
427 HB3 GLN 60 2HB GLN 60 13.523 -0.450 -0.542
428 HG2 GLN 60 1HG GLN 60 14.115 -1.931 -2.359
429 HG3 GLN 60 2HG GLN 60 12.679 -1.442 -3.253
430 HE21 GLN 60 1HE2 GLN 60 12.941 1.349 -2.451
431 HE22 GLN 60 2HE2 GLN 60 14.247 1.989 -3.382
432 H ALA 61 H ALA 61 9.547 -0.936 -0.601
433 HA ALA 61 HA ALA 61 8.421 -2.844 -2.451
434 HB1 ALA 61 1HB ALA 61 6.305 -1.713 -1.988
435 HB2 ALA 61 2HB ALA 61 7.166 -0.466 -1.085
436 HB3 ALA 61 3HB ALA 61 7.147 -2.128 -0.494
437 H GLN 62 H GLN 62 8.698 -2.602 -4.527
438 HA GLN 62 HA GLN 62 8.783 0.106 -5.673
439 HB2 GLN 62 1HB GLN 62 9.855 -2.513 -6.732
440 HB3 GLN 62 2HB GLN 62 9.945 -0.975 -7.580
441 HG2 GLN 62 1HG GLN 62 11.375 -0.057 -5.900
442 HG3 GLN 62 2HG GLN 62 11.162 -1.475 -4.878
443 HE21 GLN 62 1HE2 GLN 62 11.369 -3.375 -7.028
444 HE22 GLN 62 2HE2 GLN 62 13.027 -3.410 -7.506
445 H GLN 63 H GLN 63 7.550 0.544 -7.535
446 HA GLN 63 HA GLN 63 5.519 0.605 -8.562
447 HB2 GLN 63 1HB GLN 63 6.300 -2.269 -9.033
448 HB3 GLN 63 2HB GLN 63 4.927 -1.502 -9.813
449 HG2 GLN 63 1HG GLN 63 6.446 -1.156 -11.438
450 HG3 GLN 63 2HG GLN 63 6.805 0.268 -10.463
451 HE21 GLN 63 1HE2 GLN 63 8.741 0.362 -9.312
452 HE22 GLN 63 2HE2 GLN 63 10.017 -0.775 -9.577
453 H VAL 64 H VAL 64 4.726 0.893 -6.313
454 HA VAL 64 HA VAL 64 3.460 -1.399 -5.063
455 HB VAL 64 HB VAL 64 3.409 1.445 -4.085
456 HG11 VAL 64 1HG1 VAL 64 3.189 -1.215 -2.708
457 HG12 VAL 64 2HG1 VAL 64 1.926 0.000 -2.903
458 HG13 VAL 64 3HG1 VAL 64 3.320 0.332 -1.875
459 HG21 VAL 64 1HG2 VAL 64 5.574 -0.601 -3.649
460 HG22 VAL 64 2HG2 VAL 64 5.446 0.946 -2.809
461 HG23 VAL 64 3HG2 VAL 64 5.724 0.907 -4.550
462 H HIS 65 H HIS 65 1.437 -1.925 -5.462
463 HA HIS 65 HA HIS 65 -0.392 0.118 -6.538
464 HB2 HIS 65 1HB HIS 65 -0.565 -2.896 -6.738
465 HB3 HIS 65 2HB HIS 65 -1.713 -1.761 -7.426
466 HD1 HIS 65 HD1 HIS 65 -1.101 -0.660 -9.642
467 HD2 HIS 65 HD2 HIS 65 1.905 -3.071 -8.094
468 HE1 HIS 65 HE1 HIS 65 0.576 -0.915 -11.494
469 HE2 HIS 65 HE2 HIS 65 2.277 -2.548 -10.600
470 H ALA 66 H ALA 66 -1.994 0.765 -5.259
471 HA ALA 66 HA ALA 66 -2.274 -0.423 -2.654
472 HB1 ALA 66 1HB ALA 66 -2.324 2.001 -2.932
473 HB2 ALA 66 2HB ALA 66 -3.821 1.406 -2.213
474 HB3 ALA 66 3HB ALA 66 -3.780 1.861 -3.917
475 H LEU 67 H LEU 67 -3.636 -1.949 -2.117
476 HA LEU 67 HA LEU 67 -5.694 -2.760 -4.029
477 HB2 LEU 67 1HB LEU 67 -4.601 -4.166 -1.593
478 HB3 LEU 67 2HB LEU 67 -5.768 -4.841 -2.709
479 HG LEU 67 HG LEU 67 -2.901 -4.138 -3.342
480 HD11 LEU 67 1HD1 LEU 67 -4.266 -6.818 -3.150
481 HD12 LEU 67 2HD1 LEU 67 -3.203 -6.129 -1.925
482 HD13 LEU 67 3HD1 LEU 67 -2.568 -6.521 -3.521
483 HD21 LEU 67 1HD2 LEU 67 -4.318 -3.771 -5.282
484 HD22 LEU 67 2HD2 LEU 67 -5.040 -5.367 -5.080
485 HD23 LEU 67 3HD2 LEU 67 -3.334 -5.218 -5.505
486 H GLY 68 H GLY 68 -7.187 -1.095 -3.531
487 HA2 GLY 68 1HA GLY 68 -9.234 -0.622 -2.477
488 HA3 GLY 68 2HA GLY 68 -8.738 -1.613 -1.114
489 H GLY 69 H GLY 69 -9.075 -0.169 0.516
490 HA2 GLY 69 1HA GLY 69 -7.109 1.922 0.797
491 HA3 GLY 69 2HA GLY 69 -8.752 2.517 0.615
492 H GLU 70 H GLU 70 -9.965 2.685 2.368
493 HA GLU 70 HA GLU 70 -8.832 1.963 4.917
494 HB2 GLU 70 1HB GLU 70 -11.506 3.219 4.276
495 HB3 GLU 70 2HB GLU 70 -10.764 3.122 5.866
496 HG2 GLU 70 1HG GLU 70 -8.943 4.554 5.113
497 HG3 GLU 70 2HG GLU 70 -9.672 4.641 3.509
498 H ASN 71 H ASN 71 -9.438 0.350 6.232
499 HA ASN 71 HA ASN 71 -11.798 -1.240 5.515
500 HB2 ASN 71 1HB ASN 71 -9.581 -2.257 4.706
501 HB3 ASN 71 2HB ASN 71 -9.207 -2.512 6.406
502 HD21 ASN 71 1HD2 ASN 71 -10.108 -4.207 7.458
503 HD22 ASN 71 2HD2 ASN 71 -11.168 -5.353 6.714
504 H LEU 72 H LEU 72 -12.032 0.612 7.313
505 HA LEU 72 HA LEU 72 -11.547 -0.518 9.973
506 HB2 LEU 72 1HB LEU 72 -10.928 1.867 9.370
507 HB3 LEU 72 2HB LEU 72 -12.639 2.205 9.246
508 HG LEU 72 HG LEU 72 -11.486 1.131 11.804
509 HD11 LEU 72 1HD1 LEU 72 -11.594 4.022 10.956
510 HD12 LEU 72 2HD1 LEU 72 -10.131 3.068 11.201
511 HD13 LEU 72 3HD1 LEU 72 -11.186 3.432 12.566
512 HD21 LEU 72 1HD2 LEU 72 -13.369 2.320 12.790
513 HD22 LEU 72 2HD2 LEU 72 -13.929 1.197 11.552
514 HD23 LEU 72 3HD2 LEU 72 -13.840 2.923 11.202
515 H TYR 73 H TYR 73 -14.059 0.373 7.720
516 HA TYR 73 HA TYR 73 -16.112 -0.500 9.631
517 HB2 TYR 73 1HB TYR 73 -16.321 1.182 7.128
518 HB3 TYR 73 2HB TYR 73 -17.716 0.603 8.034
519 HD1 TYR 73 HD1 TYR 73 -17.995 1.347 10.429
520 HD2 TYR 73 HD2 TYR 73 -15.157 3.126 7.805
521 HE1 TYR 73 HE1 TYR 73 -17.856 3.301 11.913
522 HE2 TYR 73 HE2 TYR 73 -15.010 5.085 9.284
523 HH TYR 73 HH TYR 73 -16.210 5.097 12.432
524 H PHE 74 H PHE 74 -14.467 -2.396 8.350
525 HA PHE 74 HA PHE 74 -15.617 -3.516 6.032
526 HB2 PHE 74 1HB PHE 74 -13.370 -4.111 6.647
527 HB3 PHE 74 2HB PHE 74 -13.904 -4.725 8.205
528 HD1 PHE 74 HD1 PHE 74 -14.367 -6.969 8.474
529 HD2 PHE 74 HD2 PHE 74 -14.270 -5.321 4.553
530 HE1 PHE 74 HE1 PHE 74 -14.590 -9.226 7.525
531 HE2 PHE 74 HE2 PHE 74 -14.493 -7.575 3.601
532 HZ PHE 74 HZ PHE 74 -14.654 -9.532 5.083
533 H GLN 75 H GLN 75 -16.350 -3.847 9.433
534 HA GLN 75 HA GLN 75 -18.246 -5.998 8.875
535 HB2 GLN 75 1HB GLN 75 -17.528 -4.756 11.537
536 HB3 GLN 75 2HB GLN 75 -18.440 -6.237 11.284
537 HG2 GLN 75 1HG GLN 75 -15.633 -5.956 10.282
538 HG3 GLN 75 2HG GLN 75 -15.966 -6.401 11.951
539 HE21 GLN 75 1HE2 GLN 75 -18.116 -7.461 9.435
540 HE22 GLN 75 2HE2 GLN 75 -17.623 -9.113 9.435
541 H GLY 76 H GLY 76 -18.320 -2.886 8.418
542 HA2 GLY 76 1HA GLY 76 -20.106 -1.481 8.022
543 HA3 GLY 76 2HA GLY 76 -21.173 -2.705 8.692
544 H HIS 77 H HIS 77 -21.253 -2.904 11.021
545 HA HIS 77 HA HIS 77 -21.207 -0.276 12.267
546 HB2 HIS 77 1HB HIS 77 -23.225 -1.655 12.502
547 HB3 HIS 77 2HB HIS 77 -22.279 -2.932 13.252
548 HD1 HIS 77 HD1 HIS 77 -23.771 0.431 13.943
549 HD2 HIS 77 HD2 HIS 77 -21.665 -2.539 15.948
550 HE1 HIS 77 HE1 HIS 77 -23.950 1.003 16.386
551 HE2 HIS 77 HE2 HIS 77 -22.553 -0.729 17.568
552 H HIS 78 H HIS 78 -19.242 0.269 12.967
553 HA HIS 78 HA HIS 78 -17.324 -1.556 14.001
554 HB2 HIS 78 1HB HIS 78 -16.782 0.672 12.983
555 HB3 HIS 78 2HB HIS 78 -17.461 1.443 14.411
556 HD1 HIS 78 HD1 HIS 78 -15.925 1.756 16.369
557 HD2 HIS 78 HD2 HIS 78 -14.394 -0.880 13.544
558 HE1 HIS 78 HE1 HIS 78 -13.566 1.280 17.095
559 HE2 HIS 78 HE2 HIS 78 -12.605 -0.156 15.263
560 H HIS 79 H HIS 79 -16.724 -1.948 16.135
561 HA HIS 79 HA HIS 79 -17.053 -2.388 18.328
562 HB2 HIS 79 1HB HIS 79 -16.934 0.083 18.559
563 HB3 HIS 79 2HB HIS 79 -18.678 0.169 18.349
564 HD1 HIS 79 HD1 HIS 79 -16.173 -1.403 20.740
565 HD2 HIS 79 HD2 HIS 79 -20.062 0.054 20.673
566 HE1 HIS 79 HE1 HIS 79 -16.955 -1.462 23.122
567 HE2 HIS 79 HE2 HIS 79 -19.249 -0.425 23.078
568 H HIS 80 H HIS 80 -18.270 -4.166 17.383
569 HA HIS 80 HA HIS 80 -21.159 -3.981 17.356
570 HB2 HIS 80 1HB HIS 80 -19.885 -5.252 15.630
571 HB3 HIS 80 2HB HIS 80 -19.364 -6.370 16.882
572 HD1 HIS 80 HD1 HIS 80 -20.833 -8.335 17.284
573 HD2 HIS 80 HD2 HIS 80 -22.789 -5.315 15.210
574 HE1 HIS 80 HE1 HIS 80 -23.050 -9.306 16.610
575 HE2 HIS 80 HE2 HIS 80 -24.130 -7.529 15.194
576 H HIS 81 H HIS 81 -21.335 -3.482 19.642
577 HA HIS 81 HA HIS 81 -20.681 -5.506 21.582
578 HB2 HIS 81 1HB HIS 81 -20.727 -3.117 22.198
579 HB3 HIS 81 2HB HIS 81 -22.442 -3.049 21.816
580 HD1 HIS 81 HD1 HIS 81 -20.042 -4.373 24.377
581 HD2 HIS 81 HD2 HIS 81 -24.143 -4.026 23.800
582 HE1 HIS 81 HE1 HIS 81 -21.086 -4.932 26.593
583 HE2 HIS 81 HE2 HIS 81 -23.555 -4.567 26.259
584 H HIS 82 H HIS 82 -21.730 -7.392 21.343
585 HA HIS 82 HA HIS 82 -24.662 -7.318 21.357
586 HB2 HIS 82 1HB HIS 82 -23.913 -7.684 19.021
587 HB3 HIS 82 2HB HIS 82 -23.009 -9.097 19.548
588 HD1 HIS 82 HD1 HIS 82 -24.266 -11.270 19.753
589 HD2 HIS 82 HD2 HIS 82 -26.769 -8.009 19.135
590 HE1 HIS 82 HE1 HIS 82 -26.536 -12.238 19.285
591 HE2 HIS 82 HE2 HIS 82 -28.060 -10.249 19.046
Start of MODEL 11
1 H2 MET 1 2H MET 1 5.469 -10.877 -7.961
2 H MET 1 1H MET 1 4.049 -11.704 -8.360
3 H3 MET 1 3H MET 1 4.601 -10.443 -9.342
4 HA MET 1 HA MET 1 4.213 -8.845 -7.617
5 HB2 MET 1 1HB MET 1 1.876 -10.679 -8.168
6 HB3 MET 1 2HB MET 1 1.714 -9.123 -7.372
7 HG2 MET 1 1HG MET 1 2.597 -8.016 -9.368
8 HG3 MET 1 2HG MET 1 2.740 -9.583 -10.162
9 HE1 MET 1 1HE MET 1 1.117 -6.968 -11.248
10 HE2 MET 1 2HE MET 1 -0.304 -7.752 -11.938
11 HE3 MET 1 3HE MET 1 1.296 -8.451 -12.184
12 H ALA 2 H ALA 2 4.537 -8.524 -5.539
13 HA ALA 2 HA ALA 2 3.831 -10.660 -3.641
14 HB1 ALA 2 1HB ALA 2 6.186 -9.986 -3.587
15 HB2 ALA 2 2HB ALA 2 5.368 -9.565 -2.081
16 HB3 ALA 2 3HB ALA 2 5.704 -8.317 -3.281
17 H GLN 3 H GLN 3 2.633 -10.132 -1.784
18 HA GLN 3 HA GLN 3 1.424 -7.459 -1.797
19 HB2 GLN 3 1HB GLN 3 -0.031 -10.064 -1.336
20 HB3 GLN 3 2HB GLN 3 -0.728 -8.465 -1.127
21 HG2 GLN 3 1HG GLN 3 -0.337 -8.010 -3.507
22 HG3 GLN 3 2HG GLN 3 0.285 -9.646 -3.699
23 HE21 GLN 3 1HE2 GLN 3 -1.956 -8.416 -5.019
24 HE22 GLN 3 2HE2 GLN 3 -3.347 -9.364 -4.620
25 H GLY 4 H GLY 4 0.248 -7.079 0.321
26 HA2 GLY 4 1HA GLY 4 0.874 -8.489 2.647
27 HA3 GLY 4 2HA GLY 4 2.112 -7.263 2.413
28 H THR 5 H THR 5 1.314 -6.394 4.425
29 HA THR 5 HA THR 5 -0.999 -4.626 3.950
30 HB THR 5 HB THR 5 -0.156 -5.665 6.658
31 HG1 THR 5 HG1 THR 5 -0.996 -7.341 5.231
32 HG21 THR 5 1HG2 THR 5 -1.372 -3.535 6.648
33 HG22 THR 5 2HG2 THR 5 -2.337 -4.826 7.366
34 HG23 THR 5 3HG2 THR 5 -2.672 -4.286 5.720
35 H VAL 6 H VAL 6 -0.328 -2.583 3.809
36 HA VAL 6 HA VAL 6 2.192 -1.690 4.707
37 HB VAL 6 HB VAL 6 1.263 -0.367 3.012
38 HG11 VAL 6 1HG1 VAL 6 -1.206 -0.067 4.696
39 HG12 VAL 6 2HG1 VAL 6 -1.048 -1.035 3.230
40 HG13 VAL 6 3HG1 VAL 6 -0.922 0.721 3.148
41 HG21 VAL 6 1HG2 VAL 6 1.061 1.877 3.969
42 HG22 VAL 6 2HG2 VAL 6 2.389 0.976 4.705
43 HG23 VAL 6 3HG2 VAL 6 0.866 1.171 5.574
44 H LYS 7 H LYS 7 2.799 -1.676 6.729
45 HA LYS 7 HA LYS 7 0.960 -1.847 8.877
46 HB2 LYS 7 1HB LYS 7 2.944 -1.779 10.317
47 HB3 LYS 7 2HB LYS 7 3.150 -2.911 8.991
48 HG2 LYS 7 1HG LYS 7 4.603 -1.441 7.847
49 HG3 LYS 7 2HG LYS 7 4.223 -0.113 8.941
50 HD2 LYS 7 1HD LYS 7 6.368 -0.990 9.539
51 HD3 LYS 7 2HD LYS 7 5.216 -1.440 10.794
52 HE2 LYS 7 1HE LYS 7 5.014 -3.666 9.802
53 HE3 LYS 7 2HE LYS 7 6.173 -3.214 8.554
54 HZ1 LYS 7 1HZ LYS 7 7.766 -2.772 10.418
55 HZ2 LYS 7 2HZ LYS 7 7.365 -4.396 10.184
56 HZ3 LYS 7 3HZ LYS 7 6.666 -3.525 11.460
57 H TRP 8 H TRP 8 2.796 0.711 7.411
58 HA TRP 8 HA TRP 8 0.965 2.669 8.257
59 HB2 TRP 8 1HB TRP 8 2.394 4.067 9.652
60 HB3 TRP 8 2HB TRP 8 2.168 2.494 10.401
61 HD1 TRP 8 HD1 TRP 8 4.291 0.969 10.717
62 HE1 TRP 8 HE1 TRP 8 6.814 1.427 10.552
63 HE3 TRP 8 HE3 TRP 8 4.141 5.474 8.300
64 HZ2 TRP 8 HZ2 TRP 8 8.517 3.440 9.546
65 HZ3 TRP 8 HZ3 TRP 8 6.267 6.598 7.776
66 HH2 TRP 8 HH2 TRP 8 8.405 5.597 8.386
67 H PHE 9 H PHE 9 1.372 4.702 7.289
68 HA PHE 9 HA PHE 9 3.701 4.891 5.574
69 HB2 PHE 9 1HB PHE 9 1.962 3.735 4.221
70 HB3 PHE 9 2HB PHE 9 0.909 5.129 4.441
71 HD1 PHE 9 HD1 PHE 9 1.180 7.086 3.136
72 HD2 PHE 9 HD2 PHE 9 4.066 3.971 2.960
73 HE1 PHE 9 HE1 PHE 9 2.218 8.163 1.183
74 HE2 PHE 9 HE2 PHE 9 5.111 5.041 1.011
75 HZ PHE 9 HZ PHE 9 4.187 7.141 0.121
76 H ASN 10 H ASN 10 4.505 6.821 5.788
77 HA ASN 10 HA ASN 10 2.941 9.001 6.866
78 HB2 ASN 10 1HB ASN 10 5.325 8.594 7.513
79 HB3 ASN 10 2HB ASN 10 5.801 8.990 5.869
80 HD21 ASN 10 1HD2 ASN 10 6.471 10.251 8.421
81 HD22 ASN 10 2HD2 ASN 10 6.011 11.908 8.257
82 H ALA 11 H ALA 11 1.527 9.818 5.456
83 HA ALA 11 HA ALA 11 1.869 9.567 2.649
84 HB1 ALA 11 1HB ALA 11 -0.209 11.089 4.200
85 HB2 ALA 11 2HB ALA 11 -0.312 9.399 3.706
86 HB3 ALA 11 3HB ALA 11 -0.291 10.676 2.488
87 H GLU 12 H GLU 12 2.450 12.174 4.904
88 HA GLU 12 HA GLU 12 2.427 14.178 2.833
89 HB2 GLU 12 1HB GLU 12 3.062 15.749 4.581
90 HB3 GLU 12 2HB GLU 12 1.706 14.758 5.095
91 HG2 GLU 12 1HG GLU 12 3.179 13.397 6.445
92 HG3 GLU 12 2HG GLU 12 4.572 14.316 5.880
93 H LYS 13 H LYS 13 4.739 12.077 4.261
94 HA LYS 13 HA LYS 13 6.946 13.606 3.090
95 HB2 LYS 13 1HB LYS 13 7.022 11.193 4.896
96 HB3 LYS 13 2HB LYS 13 8.417 12.104 4.344
97 HG2 LYS 13 1HG LYS 13 6.223 13.085 6.140
98 HG3 LYS 13 2HG LYS 13 7.882 12.718 6.600
99 HD2 LYS 13 1HD LYS 13 8.668 14.513 5.121
100 HD3 LYS 13 2HD LYS 13 6.997 14.889 4.710
101 HE2 LYS 13 1HE LYS 13 6.537 15.409 7.050
102 HE3 LYS 13 2HE LYS 13 8.206 15.028 7.466
103 HZ1 LYS 13 1HZ LYS 13 8.947 16.843 6.076
104 HZ2 LYS 13 2HZ LYS 13 7.841 17.412 7.224
105 HZ3 LYS 13 3HZ LYS 13 7.355 17.192 5.622
106 H GLY 14 H GLY 14 5.213 10.600 2.866
107 HA2 GLY 14 1HA GLY 14 4.867 9.490 0.835
108 HA3 GLY 14 2HA GLY 14 6.283 10.289 0.177
109 H PHE 15 H PHE 15 6.252 8.527 3.239
110 HA PHE 15 HA PHE 15 7.403 6.192 1.947
111 HB2 PHE 15 1HB PHE 15 9.420 6.143 3.233
112 HB3 PHE 15 2HB PHE 15 9.326 7.714 2.453
113 HD1 PHE 15 HD1 PHE 15 8.815 9.727 3.788
114 HD2 PHE 15 HD2 PHE 15 9.387 5.918 5.599
115 HE1 PHE 15 HE1 PHE 15 9.149 10.815 5.970
116 HE2 PHE 15 HE2 PHE 15 9.721 7.002 7.780
117 HZ PHE 15 HZ PHE 15 9.601 9.453 7.967
118 H GLY 16 H GLY 16 7.546 4.333 3.353
119 HA2 GLY 16 1HA GLY 16 6.482 4.364 5.990
120 HA3 GLY 16 2HA GLY 16 5.246 3.893 4.832
121 H PHE 17 H PHE 17 5.248 1.848 6.007
122 HA PHE 17 HA PHE 17 7.238 0.032 4.853
123 HB2 PHE 17 1HB PHE 17 6.670 0.396 7.764
124 HB3 PHE 17 2HB PHE 17 7.055 -1.213 7.165
125 HD1 PHE 17 HD1 PHE 17 8.340 2.069 7.980
126 HD2 PHE 17 HD2 PHE 17 9.246 -1.661 6.148
127 HE1 PHE 17 HE1 PHE 17 10.739 2.590 8.121
128 HE2 PHE 17 HE2 PHE 17 11.646 -1.147 6.282
129 HZ PHE 17 HZ PHE 17 12.398 0.977 7.271
130 H ILE 18 H ILE 18 6.539 -2.014 4.469
131 HA ILE 18 HA ILE 18 3.701 -2.583 5.009
132 HB ILE 18 HB ILE 18 5.329 -3.312 2.573
133 HG12 ILE 18 1HG1 ILE 18 2.760 -1.755 2.697
134 HG13 ILE 18 2HG1 ILE 18 4.342 -0.988 2.747
135 HG21 ILE 18 1HG2 ILE 18 3.280 -4.387 1.727
136 HG22 ILE 18 2HG2 ILE 18 2.531 -4.145 3.306
137 HG23 ILE 18 3HG2 ILE 18 3.942 -5.193 3.150
138 HD11 ILE 18 1HD1 ILE 18 3.294 -2.718 0.518
139 HD12 ILE 18 2HD1 ILE 18 4.870 -1.925 0.563
140 HD13 ILE 18 3HD1 ILE 18 3.396 -0.956 0.503
141 H ALA 19 H ALA 19 3.206 -4.583 5.756
142 HA ALA 19 HA ALA 19 5.423 -6.427 6.291
143 HB1 ALA 19 1HB ALA 19 3.892 -7.556 7.805
144 HB2 ALA 19 2HB ALA 19 2.572 -6.508 7.286
145 HB3 ALA 19 3HB ALA 19 3.937 -5.831 8.174
146 HA PRO 20 HA PRO 20 3.838 -8.157 2.367
147 HB2 PRO 20 1HB PRO 20 6.294 -9.765 2.732
148 HB3 PRO 20 2HB PRO 20 5.747 -8.851 1.327
149 HG2 PRO 20 1HG PRO 20 7.748 -7.959 2.843
150 HG3 PRO 20 2HG PRO 20 6.556 -6.847 2.149
151 HD2 PRO 20 1HD PRO 20 6.787 -7.874 4.940
152 HD3 PRO 20 2HD PRO 20 6.341 -6.258 4.365
153 H ASP 21 H ASP 21 2.584 -9.861 2.072
154 HA ASP 21 HA ASP 21 2.351 -11.967 4.013
155 HB2 ASP 21 1HB ASP 21 0.427 -11.117 2.671
156 HB3 ASP 21 2HB ASP 21 1.184 -11.775 1.225
157 H ASP 22 H ASP 22 4.372 -11.251 1.498
158 HA ASP 22 HA ASP 22 4.942 -13.854 0.466
159 HB2 ASP 22 1HB ASP 22 5.207 -11.649 -0.758
160 HB3 ASP 22 2HB ASP 22 6.639 -11.370 0.225
161 H GLY 23 H GLY 23 5.227 -13.406 3.405
162 HA2 GLY 23 1HA GLY 23 6.666 -14.725 4.791
163 HA3 GLY 23 2HA GLY 23 7.966 -14.450 3.643
164 H SER 24 H SER 24 6.084 -11.755 4.310
165 HA SER 24 HA SER 24 6.645 -9.723 5.178
166 HB2 SER 24 1HB SER 24 6.631 -9.937 7.750
167 HB3 SER 24 2HB SER 24 5.217 -10.465 6.842
168 HG SER 24 HG SER 24 6.037 -12.608 6.986
169 H ALA 25 H ALA 25 8.793 -9.623 4.135
170 HA ALA 25 HA ALA 25 11.027 -9.845 5.977
171 HB1 ALA 25 1HB ALA 25 10.951 -8.813 3.146
172 HB2 ALA 25 2HB ALA 25 11.343 -10.463 3.630
173 HB3 ALA 25 3HB ALA 25 12.403 -9.132 4.096
174 H ASP 26 H ASP 26 8.640 -7.820 5.903
175 HA ASP 26 HA ASP 26 8.174 -5.661 6.365
176 HB2 ASP 26 1HB ASP 26 10.860 -5.917 7.711
177 HB3 ASP 26 2HB ASP 26 9.867 -4.465 7.832
178 H VAL 27 H VAL 27 8.035 -4.801 4.384
179 HA VAL 27 HA VAL 27 10.500 -4.009 3.029
180 HB VAL 27 HB VAL 27 8.875 -5.501 1.876
181 HG11 VAL 27 1HG1 VAL 27 6.840 -4.529 0.935
182 HG12 VAL 27 2HG1 VAL 27 7.130 -3.059 1.867
183 HG13 VAL 27 3HG1 VAL 27 6.809 -4.583 2.698
184 HG21 VAL 27 1HG2 VAL 27 9.370 -2.836 0.584
185 HG22 VAL 27 2HG2 VAL 27 8.928 -4.321 -0.263
186 HG23 VAL 27 3HG2 VAL 27 10.462 -4.220 0.600
187 H PHE 28 H PHE 28 10.906 -1.958 2.374
188 HA PHE 28 HA PHE 28 9.476 0.137 3.793
189 HB2 PHE 28 1HB PHE 28 11.920 0.077 3.895
190 HB3 PHE 28 2HB PHE 28 12.011 0.179 2.143
191 HD1 PHE 28 HD1 PHE 28 11.015 2.026 5.185
192 HD2 PHE 28 HD2 PHE 28 11.969 2.253 1.045
193 HE1 PHE 28 HE1 PHE 28 11.101 4.478 5.344
194 HE2 PHE 28 HE2 PHE 28 12.052 4.706 1.197
195 HZ PHE 28 HZ PHE 28 11.619 5.822 3.348
196 H VAL 29 H VAL 29 8.230 1.668 2.855
197 HA VAL 29 HA VAL 29 7.810 1.398 -0.049
198 HB VAL 29 HB VAL 29 5.869 2.898 1.614
199 HG11 VAL 29 1HG1 VAL 29 4.276 1.899 0.052
200 HG12 VAL 29 2HG1 VAL 29 5.584 0.972 -0.681
201 HG13 VAL 29 3HG1 VAL 29 5.582 2.732 -0.789
202 HG21 VAL 29 1HG2 VAL 29 4.684 0.890 2.279
203 HG22 VAL 29 2HG2 VAL 29 6.298 0.937 2.989
204 HG23 VAL 29 3HG2 VAL 29 5.972 -0.108 1.604
205 H HIS 30 H HIS 30 7.794 3.175 -1.344
206 HA HIS 30 HA HIS 30 8.138 5.813 -0.146
207 HB2 HIS 30 1HB HIS 30 10.402 4.895 -0.649
208 HB3 HIS 30 2HB HIS 30 9.929 4.728 -2.335
209 HD1 HIS 30 HD1 HIS 30 11.148 6.456 -3.589
210 HD2 HIS 30 HD2 HIS 30 9.698 7.910 0.031
211 HE1 HIS 30 HE1 HIS 30 11.731 8.907 -3.554
212 HE2 HIS 30 HE2 HIS 30 10.962 9.733 -1.301
213 H TYR 31 H TYR 31 7.133 7.412 -1.306
214 HA TYR 31 HA TYR 31 4.931 6.545 -2.792
215 HB2 TYR 31 1HB TYR 31 4.228 8.782 -2.864
216 HB3 TYR 31 2HB TYR 31 5.130 8.630 -1.364
217 HD1 TYR 31 HD1 TYR 31 4.743 10.457 -4.381
218 HD2 TYR 31 HD2 TYR 31 7.595 9.412 -1.405
219 HE1 TYR 31 HE1 TYR 31 6.129 12.370 -5.048
220 HE2 TYR 31 HE2 TYR 31 8.990 11.325 -2.063
221 HH TYR 31 HH TYR 31 7.874 13.830 -4.032
222 H SER 32 H SER 32 8.074 7.279 -3.907
223 HA SER 32 HA SER 32 7.389 8.064 -6.558
224 HB2 SER 32 1HB SER 32 9.619 8.503 -5.548
225 HB3 SER 32 2HB SER 32 9.943 6.770 -5.550
226 HG SER 32 HG SER 32 9.371 8.311 -7.868
227 H GLU 33 H GLU 33 7.572 5.089 -4.851
228 HA GLU 33 HA GLU 33 7.604 3.464 -7.265
229 HB2 GLU 33 1HB GLU 33 7.746 2.854 -4.325
230 HB3 GLU 33 2HB GLU 33 7.508 1.593 -5.518
231 HG2 GLU 33 1HG GLU 33 9.840 1.785 -4.824
232 HG3 GLU 33 2HG GLU 33 9.637 2.107 -6.542
233 H ILE 34 H ILE 34 5.406 4.750 -4.971
234 HA ILE 34 HA ILE 34 3.387 2.765 -5.216
235 HB ILE 34 HB ILE 34 3.158 5.616 -4.260
236 HG12 ILE 34 1HG1 ILE 34 3.469 3.023 -2.738
237 HG13 ILE 34 2HG1 ILE 34 4.697 4.272 -2.909
238 HG21 ILE 34 1HG2 ILE 34 1.242 3.304 -3.956
239 HG22 ILE 34 2HG2 ILE 34 0.993 4.742 -4.950
240 HG23 ILE 34 3HG2 ILE 34 1.071 4.888 -3.193
241 HD11 ILE 34 1HD1 ILE 34 2.045 4.586 -1.533
242 HD12 ILE 34 2HD1 ILE 34 3.284 5.830 -1.695
243 HD13 ILE 34 3HD1 ILE 34 3.608 4.378 -0.745
244 H GLN 35 H GLN 35 1.640 2.669 -6.447
245 HA GLN 35 HA GLN 35 1.486 4.541 -8.707
246 HB2 GLN 35 1HB GLN 35 0.436 1.712 -8.513
247 HB3 GLN 35 2HB GLN 35 0.508 2.713 -9.958
248 HG2 GLN 35 1HG GLN 35 2.888 1.727 -8.406
249 HG3 GLN 35 2HG GLN 35 2.274 1.016 -9.896
250 HE21 GLN 35 1HE2 GLN 35 4.854 2.300 -9.190
251 HE22 GLN 35 2HE2 GLN 35 5.086 3.517 -10.393
252 H GLY 36 H GLY 36 -0.509 5.460 -9.206
253 HA2 GLY 36 1HA GLY 36 -2.933 4.661 -7.959
254 HA3 GLY 36 2HA GLY 36 -2.226 6.025 -7.105
255 H ASN 37 H ASN 37 -4.011 7.303 -7.666
256 HA ASN 37 HA ASN 37 -4.120 8.079 -10.501
257 HB2 ASN 37 1HB ASN 37 -6.513 8.720 -10.009
258 HB3 ASN 37 2HB ASN 37 -6.175 6.996 -9.973
259 HD21 ASN 37 1HD2 ASN 37 -7.952 6.579 -8.703
260 HD22 ASN 37 2HD2 ASN 37 -8.017 6.991 -7.023
261 H GLY 38 H GLY 38 -2.363 9.192 -8.569
262 HA2 GLY 38 1HA GLY 38 -1.822 11.603 -8.671
263 HA3 GLY 38 2HA GLY 38 -3.503 11.901 -8.240
264 H PHE 39 H PHE 39 -3.686 9.786 -6.328
265 HA PHE 39 HA PHE 39 -2.066 10.887 -4.160
266 HB2 PHE 39 1HB PHE 39 -4.492 9.089 -4.176
267 HB3 PHE 39 2HB PHE 39 -3.547 9.391 -2.724
268 HD1 PHE 39 HD1 PHE 39 -6.093 10.639 -4.939
269 HD2 PHE 39 HD2 PHE 39 -3.392 11.715 -1.830
270 HE1 PHE 39 HE1 PHE 39 -7.411 12.667 -4.503
271 HE2 PHE 39 HE2 PHE 39 -4.707 13.748 -1.388
272 HZ PHE 39 HZ PHE 39 -6.719 14.227 -2.726
273 H ARG 40 H ARG 40 -0.086 9.969 -4.335
274 HA ARG 40 HA ARG 40 0.092 7.068 -4.584
275 HB2 ARG 40 1HB ARG 40 2.241 9.193 -4.543
276 HB3 ARG 40 2HB ARG 40 2.546 7.469 -4.711
277 HG2 ARG 40 1HG ARG 40 1.124 7.488 -6.755
278 HG3 ARG 40 2HG ARG 40 1.042 9.244 -6.618
279 HD2 ARG 40 1HD ARG 40 3.492 9.347 -6.785
280 HD3 ARG 40 2HD ARG 40 3.539 7.594 -6.967
281 HE ARG 40 HE ARG 40 1.996 9.188 -8.884
282 HH11 ARG 40 1HH1 ARG 40 4.704 7.082 -8.199
283 HH12 ARG 40 2HH1 ARG 40 5.088 6.823 -9.870
284 HH21 ARG 40 1HH2 ARG 40 2.500 8.842 -11.091
285 HH22 ARG 40 2HH2 ARG 40 3.857 7.843 -11.511
286 H THR 41 H THR 41 -1.103 7.095 -2.524
287 HA THR 41 HA THR 41 0.732 7.169 -0.239
288 HB THR 41 HB THR 41 -1.197 7.996 1.141
289 HG1 THR 41 HG1 THR 41 -2.854 7.472 -0.395
290 HG21 THR 41 1HG2 THR 41 -0.228 9.797 -1.080
291 HG22 THR 41 2HG2 THR 41 0.554 9.537 0.480
292 HG23 THR 41 3HG2 THR 41 -1.008 10.350 0.402
293 H LEU 42 H LEU 42 -0.046 5.874 1.584
294 HA LEU 42 HA LEU 42 -1.863 3.710 0.791
295 HB2 LEU 42 1HB LEU 42 0.781 3.485 2.222
296 HB3 LEU 42 2HB LEU 42 -0.387 2.184 2.124
297 HG LEU 42 HG LEU 42 1.019 3.451 -0.218
298 HD11 LEU 42 1HD1 LEU 42 2.241 1.380 -0.370
299 HD12 LEU 42 2HD1 LEU 42 1.378 0.734 1.023
300 HD13 LEU 42 3HD1 LEU 42 2.480 2.096 1.223
301 HD21 LEU 42 1HD2 LEU 42 -0.915 1.144 -0.050
302 HD22 LEU 42 2HD2 LEU 42 0.046 1.542 -1.474
303 HD23 LEU 42 3HD2 LEU 42 -1.162 2.681 -0.881
304 H GLU 43 H GLU 43 -3.124 2.858 2.429
305 HA GLU 43 HA GLU 43 -3.505 4.619 4.705
306 HB2 GLU 43 1HB GLU 43 -5.078 2.216 3.767
307 HB3 GLU 43 2HB GLU 43 -5.547 3.283 5.079
308 HG2 GLU 43 1HG GLU 43 -5.215 4.125 2.210
309 HG3 GLU 43 2HG GLU 43 -6.751 3.719 2.974
310 H GLU 44 H GLU 44 -2.961 4.124 6.739
311 HA GLU 44 HA GLU 44 -1.176 2.054 7.311
312 HB2 GLU 44 1HB GLU 44 -1.388 4.161 8.597
313 HB3 GLU 44 2HB GLU 44 -2.927 3.600 9.224
314 HG2 GLU 44 1HG GLU 44 -1.806 1.734 10.307
315 HG3 GLU 44 2HG GLU 44 -0.262 2.300 9.689
316 H ASN 45 H ASN 45 -1.458 -0.002 7.721
317 HA ASN 45 HA ASN 45 -2.365 -2.012 8.178
318 HB2 ASN 45 1HB ASN 45 -4.410 -0.320 9.588
319 HB3 ASN 45 2HB ASN 45 -4.567 -2.070 9.488
320 HD21 ASN 45 1HD2 ASN 45 -2.897 0.570 10.904
321 HD22 ASN 45 2HD2 ASN 45 -1.957 -0.344 12.026
322 H GLN 46 H GLN 46 -2.648 -1.002 5.707
323 HA GLN 46 HA GLN 46 -5.245 -2.114 4.875
324 HB2 GLN 46 1HB GLN 46 -5.142 0.247 4.340
325 HB3 GLN 46 2HB GLN 46 -3.572 0.040 3.579
326 HG2 GLN 46 1HG GLN 46 -4.585 -1.350 1.856
327 HG3 GLN 46 2HG GLN 46 -6.162 -1.145 2.611
328 HE21 GLN 46 1HE2 GLN 46 -3.620 0.391 0.834
329 HE22 GLN 46 2HE2 GLN 46 -4.525 1.774 0.327
330 H LYS 47 H LYS 47 -5.212 -3.670 3.298
331 HA LYS 47 HA LYS 47 -2.796 -5.020 2.738
332 HB2 LYS 47 1HB LYS 47 -5.569 -5.215 1.598
333 HB3 LYS 47 2HB LYS 47 -4.240 -6.173 0.956
334 HG2 LYS 47 1HG LYS 47 -5.055 -6.185 3.847
335 HG3 LYS 47 2HG LYS 47 -5.658 -7.333 2.651
336 HD2 LYS 47 1HD LYS 47 -3.416 -8.127 2.224
337 HD3 LYS 47 2HD LYS 47 -2.744 -6.900 3.299
338 HE2 LYS 47 1HE LYS 47 -2.799 -9.022 4.433
339 HE3 LYS 47 2HE LYS 47 -3.955 -7.923 5.181
340 HZ1 LYS 47 1HZ LYS 47 -4.605 -10.086 3.254
341 HZ2 LYS 47 2HZ LYS 47 -5.724 -9.025 3.941
342 HZ3 LYS 47 3HZ LYS 47 -4.891 -10.124 4.919
343 H VAL 48 H VAL 48 -1.631 -5.166 0.842
344 HA VAL 48 HA VAL 48 -2.060 -3.180 -1.223
345 HB VAL 48 HB VAL 48 -0.993 -1.919 0.593
346 HG11 VAL 48 1HG1 VAL 48 1.265 -3.882 0.283
347 HG12 VAL 48 2HG1 VAL 48 0.168 -3.765 1.660
348 HG13 VAL 48 3HG1 VAL 48 1.277 -2.440 1.300
349 HG21 VAL 48 1HG2 VAL 48 0.820 -2.391 -1.763
350 HG22 VAL 48 2HG2 VAL 48 0.894 -1.006 -0.674
351 HG23 VAL 48 3HG2 VAL 48 -0.525 -1.255 -1.690
352 H GLU 49 H GLU 49 -0.724 -3.471 -3.021
353 HA GLU 49 HA GLU 49 0.726 -6.028 -3.119
354 HB2 GLU 49 1HB GLU 49 -1.335 -6.053 -4.420
355 HB3 GLU 49 2HB GLU 49 -0.850 -4.587 -5.250
356 HG2 GLU 49 1HG GLU 49 0.986 -5.749 -6.300
357 HG3 GLU 49 2HG GLU 49 0.582 -7.223 -5.412
358 H PHE 50 H PHE 50 2.702 -6.041 -4.248
359 HA PHE 50 HA PHE 50 3.793 -3.657 -5.400
360 HB2 PHE 50 1HB PHE 50 5.560 -3.388 -3.607
361 HB3 PHE 50 2HB PHE 50 3.939 -2.890 -3.139
362 HD1 PHE 50 HD1 PHE 50 2.590 -4.317 -1.647
363 HD2 PHE 50 HD2 PHE 50 6.672 -5.175 -2.497
364 HE1 PHE 50 HE1 PHE 50 2.673 -5.814 0.294
365 HE2 PHE 50 HE2 PHE 50 6.757 -6.673 -0.549
366 HZ PHE 50 HZ PHE 50 4.759 -6.994 0.847
367 H GLU 51 H GLU 51 6.281 -3.929 -5.547
368 HA GLU 51 HA GLU 51 6.997 -6.774 -5.819
369 HB2 GLU 51 1HB GLU 51 6.768 -5.731 -8.033
370 HB3 GLU 51 2HB GLU 51 7.881 -4.456 -7.553
371 HG2 GLU 51 1HG GLU 51 9.649 -6.146 -7.273
372 HG3 GLU 51 2HG GLU 51 8.528 -7.377 -7.844
373 H ILE 52 H ILE 52 8.641 -7.333 -4.523
374 HA ILE 52 HA ILE 52 9.865 -5.278 -2.935
375 HB ILE 52 HB ILE 52 10.359 -8.252 -2.922
376 HG12 ILE 52 1HG1 ILE 52 8.695 -6.514 -1.096
377 HG13 ILE 52 2HG1 ILE 52 8.049 -7.583 -2.335
378 HG21 ILE 52 1HG2 ILE 52 12.251 -7.007 -2.019
379 HG22 ILE 52 2HG2 ILE 52 11.393 -7.854 -0.732
380 HG23 ILE 52 3HG2 ILE 52 11.167 -6.119 -0.949
381 HD11 ILE 52 1HD1 ILE 52 8.975 -9.504 -1.150
382 HD12 ILE 52 2HD1 ILE 52 7.869 -8.576 -0.135
383 HD13 ILE 52 3HD1 ILE 52 9.613 -8.427 0.092
384 H GLY 53 H GLY 53 11.613 -4.245 -3.390
385 HA2 GLY 53 1HA GLY 53 13.713 -5.591 -4.972
386 HA3 GLY 53 2HA GLY 53 13.399 -3.859 -5.060
387 H GLU 54 H GLU 54 15.841 -4.092 -4.493
388 HA GLU 54 HA GLU 54 16.157 -4.371 -1.593
389 HB2 GLU 54 1HB GLU 54 17.621 -5.689 -3.168
390 HB3 GLU 54 2HB GLU 54 18.328 -4.163 -3.673
391 HG2 GLU 54 1HG GLU 54 19.722 -5.277 -2.030
392 HG3 GLU 54 2HG GLU 54 19.099 -3.753 -1.403
393 H GLY 55 H GLY 55 16.759 -2.698 -0.346
394 HA2 GLY 55 1HA GLY 55 17.130 -0.104 -1.697
395 HA3 GLY 55 2HA GLY 55 16.349 -0.299 -0.135
396 H ALA 56 H ALA 56 17.872 1.293 0.612
397 HA ALA 56 HA ALA 56 20.677 0.749 0.533
398 HB1 ALA 56 1HB ALA 56 19.188 2.752 2.218
399 HB2 ALA 56 2HB ALA 56 19.774 3.034 0.579
400 HB3 ALA 56 3HB ALA 56 20.920 2.738 1.887
401 H LYS 57 H LYS 57 18.158 0.490 3.007
402 HA LYS 57 HA LYS 57 20.091 -0.951 4.696
403 HB2 LYS 57 1HB LYS 57 17.731 0.727 5.551
404 HB3 LYS 57 2HB LYS 57 18.750 -0.204 6.639
405 HG2 LYS 57 1HG LYS 57 19.734 2.032 4.882
406 HG3 LYS 57 2HG LYS 57 19.290 2.209 6.580
407 HD2 LYS 57 1HD LYS 57 21.026 0.596 7.200
408 HD3 LYS 57 2HD LYS 57 21.464 0.414 5.500
409 HE2 LYS 57 1HE LYS 57 22.096 2.757 5.390
410 HE3 LYS 57 2HE LYS 57 21.597 2.987 7.064
411 HZ1 LYS 57 1HZ LYS 57 23.997 2.718 6.851
412 HZ2 LYS 57 2HZ LYS 57 23.780 1.188 6.166
413 HZ3 LYS 57 3HZ LYS 57 23.319 1.469 7.766
414 H GLY 58 H GLY 58 17.150 -1.165 2.989
415 HA2 GLY 58 1HA GLY 58 16.847 -3.913 3.728
416 HA3 GLY 58 2HA GLY 58 15.587 -2.903 4.419
417 HA PRO 59 HA PRO 59 14.516 -4.326 0.030
418 HB2 PRO 59 1HB PRO 59 12.101 -5.396 0.791
419 HB3 PRO 59 2HB PRO 59 13.588 -6.324 0.611
420 HG2 PRO 59 1HG PRO 59 12.326 -5.225 3.081
421 HG3 PRO 59 2HG PRO 59 13.112 -6.792 2.826
422 HD2 PRO 59 1HD PRO 59 14.362 -4.776 4.082
423 HD3 PRO 59 2HD PRO 59 15.237 -5.898 3.023
424 H GLN 60 H GLN 60 13.110 -3.230 -1.274
425 HA GLN 60 HA GLN 60 11.406 -1.222 0.050
426 HB2 GLN 60 1HB GLN 60 11.916 0.364 -1.699
427 HB3 GLN 60 2HB GLN 60 13.415 -0.194 -0.969
428 HG2 GLN 60 1HG GLN 60 13.851 -1.635 -2.843
429 HG3 GLN 60 2HG GLN 60 12.284 -1.245 -3.551
430 HE21 GLN 60 1HE2 GLN 60 15.490 -0.127 -2.905
431 HE22 GLN 60 2HE2 GLN 60 15.445 1.252 -3.943
432 H ALA 61 H ALA 61 9.413 -0.868 -0.775
433 HA ALA 61 HA ALA 61 8.369 -2.930 -2.522
434 HB1 ALA 61 1HB ALA 61 6.182 -1.964 -1.977
435 HB2 ALA 61 2HB ALA 61 6.982 -0.656 -1.106
436 HB3 ALA 61 3HB ALA 61 7.117 -2.316 -0.522
437 H GLN 62 H GLN 62 8.533 -2.679 -4.622
438 HA GLN 62 HA GLN 62 8.435 0.015 -5.785
439 HB2 GLN 62 1HB GLN 62 9.195 -2.575 -7.130
440 HB3 GLN 62 2HB GLN 62 9.435 -0.949 -7.750
441 HG2 GLN 62 1HG GLN 62 11.053 -0.495 -6.006
442 HG3 GLN 62 2HG GLN 62 10.782 -2.095 -5.317
443 HE21 GLN 62 1HE2 GLN 62 11.493 -3.916 -6.456
444 HE22 GLN 62 2HE2 GLN 62 12.708 -3.801 -7.679
445 H GLN 63 H GLN 63 7.065 0.410 -7.595
446 HA GLN 63 HA GLN 63 5.055 0.366 -8.680
447 HB2 GLN 63 1HB GLN 63 5.661 -2.593 -8.717
448 HB3 GLN 63 2HB GLN 63 4.482 -1.790 -9.739
449 HG2 GLN 63 1HG GLN 63 7.427 -1.192 -9.747
450 HG3 GLN 63 2HG GLN 63 6.630 -2.302 -10.861
451 HE21 GLN 63 1HE2 GLN 63 7.214 0.998 -10.031
452 HE22 GLN 63 2HE2 GLN 63 6.464 1.699 -11.423
453 H VAL 64 H VAL 64 4.479 0.771 -6.197
454 HA VAL 64 HA VAL 64 3.094 -1.425 -4.941
455 HB VAL 64 HB VAL 64 3.148 1.413 -3.958
456 HG11 VAL 64 1HG1 VAL 64 1.639 -0.005 -2.763
457 HG12 VAL 64 2HG1 VAL 64 3.054 0.294 -1.752
458 HG13 VAL 64 3HG1 VAL 64 2.878 -1.247 -2.586
459 HG21 VAL 64 1HG2 VAL 64 5.191 0.864 -2.729
460 HG22 VAL 64 2HG2 VAL 64 5.440 0.787 -4.474
461 HG23 VAL 64 3HG2 VAL 64 5.254 -0.700 -3.543
462 H HIS 65 H HIS 65 1.059 -1.888 -5.210
463 HA HIS 65 HA HIS 65 -0.825 0.236 -6.008
464 HB2 HIS 65 1HB HIS 65 -0.826 -2.702 -6.711
465 HB3 HIS 65 2HB HIS 65 -2.208 -1.652 -6.965
466 HD1 HIS 65 HD1 HIS 65 -2.228 -0.245 -9.057
467 HD2 HIS 65 HD2 HIS 65 1.422 -2.114 -8.383
468 HE1 HIS 65 HE1 HIS 65 -0.897 0.099 -11.160
469 HE2 HIS 65 HE2 HIS 65 1.229 -1.201 -10.800
470 H ALA 66 H ALA 66 -2.372 0.639 -4.556
471 HA ALA 66 HA ALA 66 -2.424 -0.811 -2.100
472 HB1 ALA 66 1HB ALA 66 -2.798 1.602 -2.190
473 HB2 ALA 66 2HB ALA 66 -4.150 0.761 -1.431
474 HB3 ALA 66 3HB ALA 66 -4.290 1.336 -3.095
475 H LEU 67 H LEU 67 -3.915 -2.209 -1.313
476 HA LEU 67 HA LEU 67 -5.914 -3.212 -3.223
477 HB2 LEU 67 1HB LEU 67 -4.660 -4.572 -0.834
478 HB3 LEU 67 2HB LEU 67 -5.857 -5.291 -1.891
479 HG LEU 67 HG LEU 67 -3.051 -4.495 -2.666
480 HD11 LEU 67 1HD1 LEU 67 -4.338 -7.198 -2.324
481 HD12 LEU 67 2HD1 LEU 67 -3.147 -6.470 -1.247
482 HD13 LEU 67 3HD1 LEU 67 -2.696 -6.899 -2.897
483 HD21 LEU 67 1HD2 LEU 67 -4.570 -4.188 -4.539
484 HD22 LEU 67 2HD2 LEU 67 -5.231 -5.803 -4.292
485 HD23 LEU 67 3HD2 LEU 67 -3.554 -5.607 -4.801
486 H GLY 68 H GLY 68 -6.668 -0.947 -2.004
487 HA2 GLY 68 1HA GLY 68 -8.278 -1.766 0.331
488 HA3 GLY 68 2HA GLY 68 -7.755 -0.121 0.003
489 H GLY 69 H GLY 69 -8.523 -0.936 -2.943
490 HA2 GLY 69 1HA GLY 69 -10.709 -1.285 -3.970
491 HA3 GLY 69 2HA GLY 69 -11.412 -0.438 -2.600
492 H GLU 70 H GLU 70 -11.216 -0.023 -5.659
493 HA GLU 70 HA GLU 70 -9.973 2.603 -5.768
494 HB2 GLU 70 1HB GLU 70 -11.399 1.034 -7.924
495 HB3 GLU 70 2HB GLU 70 -10.499 2.523 -8.163
496 HG2 GLU 70 1HG GLU 70 -8.457 1.370 -7.408
497 HG3 GLU 70 2HG GLU 70 -9.383 -0.125 -7.281
498 H ASN 71 H ASN 71 -11.299 3.893 -4.514
499 HA ASN 71 HA ASN 71 -14.116 4.058 -5.122
500 HB2 ASN 71 1HB ASN 71 -14.177 5.867 -3.441
501 HB3 ASN 71 2HB ASN 71 -13.445 4.400 -2.811
502 HD21 ASN 71 1HD2 ASN 71 -13.238 7.182 -1.939
503 HD22 ASN 71 2HD2 ASN 71 -11.551 7.564 -1.944
504 H LEU 72 H LEU 72 -15.010 5.322 -6.594
505 HA LEU 72 HA LEU 72 -13.265 6.968 -8.217
506 HB2 LEU 72 1HB LEU 72 -14.863 5.454 -9.289
507 HB3 LEU 72 2HB LEU 72 -16.192 6.296 -8.517
508 HG LEU 72 HG LEU 72 -15.639 8.331 -9.797
509 HD11 LEU 72 1HD1 LEU 72 -13.251 7.946 -10.094
510 HD12 LEU 72 2HD1 LEU 72 -14.049 8.208 -11.645
511 HD13 LEU 72 3HD1 LEU 72 -13.595 6.577 -11.152
512 HD21 LEU 72 1HD2 LEU 72 -16.042 5.849 -11.460
513 HD22 LEU 72 2HD2 LEU 72 -16.368 7.500 -11.990
514 HD23 LEU 72 3HD2 LEU 72 -17.302 6.797 -10.669
515 H TYR 73 H TYR 73 -12.961 9.044 -7.834
516 HA TYR 73 HA TYR 73 -14.773 10.472 -6.090
517 HB2 TYR 73 1HB TYR 73 -12.102 11.128 -7.302
518 HB3 TYR 73 2HB TYR 73 -13.077 12.370 -6.520
519 HD1 TYR 73 HD1 TYR 73 -13.592 12.200 -4.117
520 HD2 TYR 73 HD2 TYR 73 -10.933 9.480 -6.016
521 HE1 TYR 73 HE1 TYR 73 -12.738 11.517 -1.919
522 HE2 TYR 73 HE2 TYR 73 -10.067 8.791 -3.819
523 HH TYR 73 HH TYR 73 -11.597 9.757 -0.859
524 H PHE 74 H PHE 74 -16.472 11.473 -6.824
525 HA PHE 74 HA PHE 74 -16.786 12.080 -9.623
526 HB2 PHE 74 1HB PHE 74 -18.597 12.669 -7.267
527 HB3 PHE 74 2HB PHE 74 -19.035 12.846 -8.963
528 HD1 PHE 74 HD1 PHE 74 -19.055 10.787 -10.423
529 HD2 PHE 74 HD2 PHE 74 -18.802 10.606 -6.179
530 HE1 PHE 74 HE1 PHE 74 -19.780 8.438 -10.482
531 HE2 PHE 74 HE2 PHE 74 -19.527 8.257 -6.234
532 HZ PHE 74 HZ PHE 74 -20.016 7.170 -8.387
533 H GLN 75 H GLN 75 -15.125 13.593 -9.935
534 HA GLN 75 HA GLN 75 -15.303 16.105 -8.444
535 HB2 GLN 75 1HB GLN 75 -13.157 15.124 -10.334
536 HB3 GLN 75 2HB GLN 75 -13.083 16.581 -9.354
537 HG2 GLN 75 1HG GLN 75 -13.184 13.752 -8.332
538 HG3 GLN 75 2HG GLN 75 -11.769 14.805 -8.363
539 HE21 GLN 75 1HE2 GLN 75 -11.640 16.519 -6.911
540 HE22 GLN 75 2HE2 GLN 75 -12.656 16.613 -5.512
541 H GLY 76 H GLY 76 -17.016 15.129 -10.800
542 HA2 GLY 76 1HA GLY 76 -16.425 16.526 -13.134
543 HA3 GLY 76 2HA GLY 76 -18.041 16.052 -12.633
544 H HIS 77 H HIS 77 -18.139 17.628 -10.252
545 HA HIS 77 HA HIS 77 -18.061 20.345 -11.388
546 HB2 HIS 77 1HB HIS 77 -20.103 19.083 -9.567
547 HB3 HIS 77 2HB HIS 77 -19.965 20.826 -9.758
548 HD1 HIS 77 HD1 HIS 77 -21.652 17.959 -11.137
549 HD2 HIS 77 HD2 HIS 77 -20.344 21.625 -12.591
550 HE1 HIS 77 HE1 HIS 77 -22.926 18.332 -13.270
551 HE2 HIS 77 HE2 HIS 77 -22.240 20.627 -14.042
552 H HIS 78 H HIS 78 -16.044 18.876 -9.844
553 HA HIS 78 HA HIS 78 -14.482 19.297 -8.257
554 HB2 HIS 78 1HB HIS 78 -15.901 21.954 -7.972
555 HB3 HIS 78 2HB HIS 78 -14.344 21.559 -7.256
556 HD1 HIS 78 HD1 HIS 78 -15.808 23.075 -10.167
557 HD2 HIS 78 HD2 HIS 78 -12.339 20.926 -9.374
558 HE1 HIS 78 HE1 HIS 78 -14.247 23.587 -12.067
559 HE2 HIS 78 HE2 HIS 78 -12.099 22.418 -11.472
560 H HIS 79 H HIS 79 -14.624 18.015 -6.535
561 HA HIS 79 HA HIS 79 -16.482 18.803 -4.403
562 HB2 HIS 79 1HB HIS 79 -16.150 16.097 -5.627
563 HB3 HIS 79 2HB HIS 79 -16.538 16.222 -3.916
564 HD1 HIS 79 HD1 HIS 79 -18.160 15.801 -7.021
565 HD2 HIS 79 HD2 HIS 79 -18.948 18.078 -3.629
566 HE1 HIS 79 HE1 HIS 79 -20.613 16.346 -7.117
567 HE2 HIS 79 HE2 HIS 79 -21.088 17.638 -5.010
568 H HIS 80 H HIS 80 -15.622 18.961 -2.467
569 HA HIS 80 HA HIS 80 -13.528 17.419 -1.421
570 HB2 HIS 80 1HB HIS 80 -11.760 19.208 -1.317
571 HB3 HIS 80 2HB HIS 80 -12.028 18.550 -2.926
572 HD1 HIS 80 HD1 HIS 80 -12.614 20.178 -4.747
573 HD2 HIS 80 HD2 HIS 80 -12.860 21.859 -0.952
574 HE1 HIS 80 HE1 HIS 80 -13.002 22.636 -5.116
575 HE2 HIS 80 HE2 HIS 80 -13.078 23.643 -2.810
576 H HIS 81 H HIS 81 -12.991 18.070 0.762
577 HA HIS 81 HA HIS 81 -14.671 20.241 1.809
578 HB2 HIS 81 1HB HIS 81 -15.677 17.904 2.154
579 HB3 HIS 81 2HB HIS 81 -14.349 17.624 3.275
580 HD1 HIS 81 HD1 HIS 81 -17.740 18.668 3.261
581 HD2 HIS 81 HD2 HIS 81 -14.348 19.843 5.358
582 HE1 HIS 81 HE1 HIS 81 -18.588 19.897 5.288
583 HE2 HIS 81 HE2 HIS 81 -16.517 20.701 6.480
584 H HIS 82 H HIS 82 -12.765 21.485 1.859
585 HA HIS 82 HA HIS 82 -11.368 21.317 4.334
586 HB2 HIS 82 1HB HIS 82 -10.062 19.664 3.003
587 HB3 HIS 82 2HB HIS 82 -9.718 20.922 1.822
588 HD1 HIS 82 HD1 HIS 82 -7.660 22.264 2.220
589 HD2 HIS 82 HD2 HIS 82 -8.909 20.266 5.639
590 HE1 HIS 82 HE1 HIS 82 -5.865 22.671 3.928
591 HE2 HIS 82 HE2 HIS 82 -6.575 21.342 5.944
Start of MODEL 12
1 H2 MET 1 2H MET 1 3.566 -11.154 -8.626
2 H MET 1 1H MET 1 4.494 -10.066 -9.530
3 H3 MET 1 3H MET 1 5.184 -10.889 -8.225
4 HA MET 1 HA MET 1 4.726 -8.635 -7.609
5 HB2 MET 1 1HB MET 1 1.981 -9.357 -8.589
6 HB3 MET 1 2HB MET 1 2.193 -8.096 -7.383
7 HG2 MET 1 1HG MET 1 3.509 -8.124 -10.090
8 HG3 MET 1 2HG MET 1 2.041 -7.235 -9.688
9 HE1 MET 1 1HE MET 1 4.818 -6.037 -10.928
10 HE2 MET 1 2HE MET 1 4.921 -4.513 -10.048
11 HE3 MET 1 3HE MET 1 3.372 -5.056 -10.689
12 H ALA 2 H ALA 2 4.674 -8.358 -5.482
13 HA ALA 2 HA ALA 2 3.671 -10.569 -3.841
14 HB1 ALA 2 1HB ALA 2 6.000 -9.943 -3.474
15 HB2 ALA 2 2HB ALA 2 5.032 -9.573 -2.046
16 HB3 ALA 2 3HB ALA 2 5.516 -8.279 -3.144
17 H GLN 3 H GLN 3 2.655 -9.925 -1.757
18 HA GLN 3 HA GLN 3 1.145 -7.424 -1.966
19 HB2 GLN 3 1HB GLN 3 -0.030 -10.132 -1.329
20 HB3 GLN 3 2HB GLN 3 -0.890 -8.605 -1.208
21 HG2 GLN 3 1HG GLN 3 -0.702 -8.262 -3.581
22 HG3 GLN 3 2HG GLN 3 0.279 -9.718 -3.742
23 HE21 GLN 3 1HE2 GLN 3 -2.894 -8.448 -3.244
24 HE22 GLN 3 2HE2 GLN 3 -3.753 -9.923 -3.484
25 H GLY 4 H GLY 4 -0.014 -7.004 0.161
26 HA2 GLY 4 1HA GLY 4 0.643 -8.310 2.524
27 HA3 GLY 4 2HA GLY 4 1.876 -7.086 2.260
28 H THR 5 H THR 5 1.047 -6.268 4.277
29 HA THR 5 HA THR 5 -1.227 -4.452 3.822
30 HB THR 5 HB THR 5 -0.450 -5.617 6.503
31 HG1 THR 5 HG1 THR 5 -1.290 -7.327 5.355
32 HG21 THR 5 1HG2 THR 5 -2.633 -4.760 7.207
33 HG22 THR 5 2HG2 THR 5 -2.909 -4.127 5.583
34 HG23 THR 5 3HG2 THR 5 -1.611 -3.466 6.581
35 H VAL 6 H VAL 6 -0.542 -2.389 3.840
36 HA VAL 6 HA VAL 6 2.088 -1.713 4.577
37 HB VAL 6 HB VAL 6 1.283 -0.233 3.011
38 HG11 VAL 6 1HG1 VAL 6 -1.239 0.044 4.620
39 HG12 VAL 6 2HG1 VAL 6 -1.045 -0.834 3.102
40 HG13 VAL 6 3HG1 VAL 6 -0.875 0.921 3.136
41 HG21 VAL 6 1HG2 VAL 6 2.382 1.000 4.813
42 HG22 VAL 6 2HG2 VAL 6 0.822 1.223 5.611
43 HG23 VAL 6 3HG2 VAL 6 1.125 1.973 4.043
44 H LYS 7 H LYS 7 2.894 -1.680 6.460
45 HA LYS 7 HA LYS 7 1.431 -1.907 8.847
46 HB2 LYS 7 1HB LYS 7 3.725 -2.786 8.473
47 HB3 LYS 7 2HB LYS 7 4.322 -1.138 8.429
48 HG2 LYS 7 1HG LYS 7 4.787 -2.030 10.578
49 HG3 LYS 7 2HG LYS 7 3.506 -0.836 10.752
50 HD2 LYS 7 1HD LYS 7 3.011 -2.789 12.098
51 HD3 LYS 7 2HD LYS 7 1.843 -2.641 10.786
52 HE2 LYS 7 1HE LYS 7 3.015 -4.331 9.511
53 HE3 LYS 7 2HE LYS 7 4.266 -4.435 10.748
54 HZ1 LYS 7 1HZ LYS 7 2.701 -6.236 10.974
55 HZ2 LYS 7 2HZ LYS 7 1.405 -5.158 11.085
56 HZ3 LYS 7 3HZ LYS 7 2.571 -5.208 12.308
57 H TRP 8 H TRP 8 3.119 0.699 7.260
58 HA TRP 8 HA TRP 8 1.340 2.672 8.175
59 HB2 TRP 8 1HB TRP 8 2.873 4.020 9.551
60 HB3 TRP 8 2HB TRP 8 2.538 2.466 10.300
61 HD1 TRP 8 HD1 TRP 8 4.549 0.769 10.559
62 HE1 TRP 8 HE1 TRP 8 7.096 1.068 10.427
63 HE3 TRP 8 HE3 TRP 8 4.707 5.332 8.262
64 HZ2 TRP 8 HZ2 TRP 8 8.931 2.987 9.481
65 HZ3 TRP 8 HZ3 TRP 8 6.904 6.326 7.777
66 HH2 TRP 8 HH2 TRP 8 8.970 5.175 8.374
67 H PHE 9 H PHE 9 1.698 4.654 7.122
68 HA PHE 9 HA PHE 9 4.084 4.804 5.445
69 HB2 PHE 9 1HB PHE 9 2.248 3.880 4.058
70 HB3 PHE 9 2HB PHE 9 1.297 5.324 4.398
71 HD1 PHE 9 HD1 PHE 9 1.621 7.308 3.173
72 HD2 PHE 9 HD2 PHE 9 4.401 4.109 2.827
73 HE1 PHE 9 HE1 PHE 9 2.696 8.455 1.284
74 HE2 PHE 9 HE2 PHE 9 5.483 5.248 0.936
75 HZ PHE 9 HZ PHE 9 4.631 7.426 0.165
76 H ASN 10 H ASN 10 5.062 6.634 5.804
77 HA ASN 10 HA ASN 10 3.609 8.850 7.010
78 HB2 ASN 10 1HB ASN 10 5.820 8.093 7.911
79 HB3 ASN 10 2HB ASN 10 6.564 8.597 6.401
80 HD21 ASN 10 1HD2 ASN 10 6.899 9.491 9.209
81 HD22 ASN 10 2HD2 ASN 10 6.674 11.206 9.157
82 H ALA 11 H ALA 11 2.448 9.842 5.466
83 HA ALA 11 HA ALA 11 3.316 10.100 2.767
84 HB1 ALA 11 1HB ALA 11 0.954 9.914 3.376
85 HB2 ALA 11 2HB ALA 11 1.274 11.368 2.430
86 HB3 ALA 11 3HB ALA 11 1.042 11.484 4.174
87 H GLU 12 H GLU 12 3.853 11.946 5.585
88 HA GLU 12 HA GLU 12 4.256 14.490 4.369
89 HB2 GLU 12 1HB GLU 12 5.473 13.393 6.908
90 HB3 GLU 12 2HB GLU 12 5.392 15.086 6.448
91 HG2 GLU 12 1HG GLU 12 3.060 13.299 7.076
92 HG3 GLU 12 2HG GLU 12 3.727 14.556 8.115
93 H LYS 13 H LYS 13 6.327 11.796 5.263
94 HA LYS 13 HA LYS 13 8.678 13.110 4.173
95 HB2 LYS 13 1HB LYS 13 8.432 10.347 5.354
96 HB3 LYS 13 2HB LYS 13 9.914 11.251 5.082
97 HG2 LYS 13 1HG LYS 13 7.730 11.967 7.019
98 HG3 LYS 13 2HG LYS 13 9.288 11.254 7.426
99 HD2 LYS 13 1HD LYS 13 10.415 13.243 6.539
100 HD3 LYS 13 2HD LYS 13 8.845 13.951 6.162
101 HE2 LYS 13 1HE LYS 13 8.250 13.878 8.539
102 HE3 LYS 13 2HE LYS 13 9.833 13.196 8.909
103 HZ1 LYS 13 1HZ LYS 13 9.379 15.853 7.664
104 HZ2 LYS 13 2HZ LYS 13 10.871 15.209 8.128
105 HZ3 LYS 13 3HZ LYS 13 9.716 15.599 9.300
106 H GLY 14 H GLY 14 6.439 10.560 3.402
107 HA2 GLY 14 1HA GLY 14 5.940 9.964 1.170
108 HA3 GLY 14 2HA GLY 14 7.537 10.510 0.688
109 H PHE 15 H PHE 15 7.327 8.479 3.484
110 HA PHE 15 HA PHE 15 7.816 6.089 1.892
111 HB2 PHE 15 1HB PHE 15 9.896 5.535 2.891
112 HB3 PHE 15 2HB PHE 15 10.038 7.208 2.370
113 HD1 PHE 15 HD1 PHE 15 10.053 9.024 4.038
114 HD2 PHE 15 HD2 PHE 15 9.999 4.928 5.189
115 HE1 PHE 15 HE1 PHE 15 10.774 9.651 6.306
116 HE2 PHE 15 HE2 PHE 15 10.715 5.551 7.454
117 HZ PHE 15 HZ PHE 15 11.103 7.914 8.016
118 H GLY 16 H GLY 16 7.949 4.119 3.293
119 HA2 GLY 16 1HA GLY 16 6.961 4.220 5.963
120 HA3 GLY 16 2HA GLY 16 5.681 3.809 4.828
121 H PHE 17 H PHE 17 5.665 1.787 6.110
122 HA PHE 17 HA PHE 17 7.445 -0.134 4.798
123 HB2 PHE 17 1HB PHE 17 7.082 0.188 7.753
124 HB3 PHE 17 2HB PHE 17 7.375 -1.411 7.080
125 HD1 PHE 17 HD1 PHE 17 9.489 -1.948 6.023
126 HD2 PHE 17 HD2 PHE 17 8.805 1.863 7.775
127 HE1 PHE 17 HE1 PHE 17 11.908 -1.503 5.987
128 HE2 PHE 17 HE2 PHE 17 11.221 2.319 7.747
129 HZ PHE 17 HZ PHE 17 12.779 0.632 6.849
130 H ILE 18 H ILE 18 6.502 -1.937 4.167
131 HA ILE 18 HA ILE 18 3.698 -2.373 4.923
132 HB ILE 18 HB ILE 18 5.216 -3.260 2.469
133 HG12 ILE 18 1HG1 ILE 18 2.731 -1.584 2.582
134 HG13 ILE 18 2HG1 ILE 18 4.339 -0.876 2.649
135 HG21 ILE 18 1HG2 ILE 18 3.726 -5.042 3.140
136 HG22 ILE 18 2HG2 ILE 18 3.119 -4.251 1.683
137 HG23 ILE 18 3HG2 ILE 18 2.382 -3.902 3.248
138 HD11 ILE 18 1HD1 ILE 18 3.406 -0.829 0.395
139 HD12 ILE 18 2HD1 ILE 18 3.275 -2.589 0.418
140 HD13 ILE 18 3HD1 ILE 18 4.863 -1.819 0.478
141 H ALA 19 H ALA 19 3.052 -4.366 5.634
142 HA ALA 19 HA ALA 19 5.170 -6.287 6.279
143 HB1 ALA 19 1HB ALA 19 3.446 -7.350 7.704
144 HB2 ALA 19 2HB ALA 19 2.299 -6.104 7.208
145 HB3 ALA 19 3HB ALA 19 3.733 -5.665 8.135
146 HA PRO 20 HA PRO 20 3.695 -8.001 2.280
147 HB2 PRO 20 1HB PRO 20 5.967 -9.774 3.017
148 HB3 PRO 20 2HB PRO 20 5.580 -9.034 1.463
149 HG2 PRO 20 1HG PRO 20 7.530 -8.047 2.965
150 HG3 PRO 20 2HG PRO 20 6.431 -6.968 2.090
151 HD2 PRO 20 1HD PRO 20 6.512 -7.643 4.984
152 HD3 PRO 20 2HD PRO 20 6.108 -6.110 4.196
153 H ASP 21 H ASP 21 2.571 -9.788 1.776
154 HA ASP 21 HA ASP 21 1.452 -11.343 3.894
155 HB2 ASP 21 1HB ASP 21 0.203 -10.649 1.858
156 HB3 ASP 21 2HB ASP 21 1.230 -11.702 0.894
157 H ASP 22 H ASP 22 4.240 -11.538 2.100
158 HA ASP 22 HA ASP 22 4.534 -14.404 2.034
159 HB2 ASP 22 1HB ASP 22 5.457 -12.842 0.292
160 HB3 ASP 22 2HB ASP 22 6.613 -12.280 1.491
161 H GLY 23 H GLY 23 4.232 -12.887 4.619
162 HA2 GLY 23 1HA GLY 23 4.922 -13.877 6.689
163 HA3 GLY 23 2HA GLY 23 6.481 -14.215 5.962
164 H SER 24 H SER 24 5.230 -11.131 5.319
165 HA SER 24 HA SER 24 5.765 -9.035 5.956
166 HB2 SER 24 1HB SER 24 5.424 -8.599 8.392
167 HB3 SER 24 2HB SER 24 4.135 -9.526 7.630
168 HG SER 24 HG SER 24 6.052 -11.168 8.599
169 H ALA 25 H ALA 25 7.941 -9.079 5.135
170 HA ALA 25 HA ALA 25 10.035 -9.348 7.156
171 HB1 ALA 25 1HB ALA 25 10.273 -8.960 4.180
172 HB2 ALA 25 2HB ALA 25 10.364 -10.503 5.032
173 HB3 ALA 25 3HB ALA 25 11.602 -9.274 5.297
174 H ASP 26 H ASP 26 8.063 -7.022 6.669
175 HA ASP 26 HA ASP 26 7.989 -4.758 6.703
176 HB2 ASP 26 1HB ASP 26 10.803 -5.010 7.784
177 HB3 ASP 26 2HB ASP 26 9.813 -3.558 7.841
178 H VAL 27 H VAL 27 7.878 -4.598 4.433
179 HA VAL 27 HA VAL 27 10.377 -4.084 3.025
180 HB VAL 27 HB VAL 27 8.698 -5.550 1.970
181 HG11 VAL 27 1HG1 VAL 27 6.671 -4.574 0.997
182 HG12 VAL 27 2HG1 VAL 27 7.018 -3.065 1.843
183 HG13 VAL 27 3HG1 VAL 27 6.669 -4.533 2.761
184 HG21 VAL 27 1HG2 VAL 27 9.227 -2.985 0.496
185 HG22 VAL 27 2HG2 VAL 27 8.735 -4.510 -0.244
186 HG23 VAL 27 3HG2 VAL 27 10.292 -4.389 0.580
187 H PHE 28 H PHE 28 11.030 -2.154 2.346
188 HA PHE 28 HA PHE 28 9.885 0.158 3.610
189 HB2 PHE 28 1HB PHE 28 12.303 -0.165 3.499
190 HB3 PHE 28 2HB PHE 28 12.241 -0.167 1.743
191 HD1 PHE 28 HD1 PHE 28 12.223 1.849 0.511
192 HD2 PHE 28 HD2 PHE 28 11.838 1.923 4.747
193 HE1 PHE 28 HE1 PHE 28 12.588 4.281 0.496
194 HE2 PHE 28 HE2 PHE 28 12.204 4.355 4.740
195 HZ PHE 28 HZ PHE 28 12.579 5.537 2.614
196 H VAL 29 H VAL 29 8.427 1.484 2.752
197 HA VAL 29 HA VAL 29 7.841 1.248 -0.114
198 HB VAL 29 HB VAL 29 6.188 2.903 1.738
199 HG11 VAL 29 1HG1 VAL 29 4.380 2.168 0.266
200 HG12 VAL 29 2HG1 VAL 29 5.523 1.171 -0.632
201 HG13 VAL 29 3HG1 VAL 29 5.690 2.926 -0.637
202 HG21 VAL 29 1HG2 VAL 29 4.867 0.979 2.387
203 HG22 VAL 29 2HG2 VAL 29 6.532 0.819 2.952
204 HG23 VAL 29 3HG2 VAL 29 5.986 -0.091 1.541
205 H HIS 30 H HIS 30 7.738 3.037 -1.455
206 HA HIS 30 HA HIS 30 8.559 5.619 -0.361
207 HB2 HIS 30 1HB HIS 30 10.569 4.437 -1.256
208 HB3 HIS 30 2HB HIS 30 9.785 4.368 -2.829
209 HD1 HIS 30 HD1 HIS 30 10.741 6.043 -4.328
210 HD2 HIS 30 HD2 HIS 30 10.546 7.421 -0.404
211 HE1 HIS 30 HE1 HIS 30 11.662 8.391 -4.381
212 HE2 HIS 30 HE2 HIS 30 11.611 9.173 -1.984
213 H TYR 31 H TYR 31 7.426 7.255 -1.177
214 HA TYR 31 HA TYR 31 4.957 6.736 -2.297
215 HB2 TYR 31 1HB TYR 31 4.568 9.063 -2.262
216 HB3 TYR 31 2HB TYR 31 5.691 8.758 -0.945
217 HD1 TYR 31 HD1 TYR 31 8.161 9.243 -1.341
218 HD2 TYR 31 HD2 TYR 31 5.090 10.593 -3.956
219 HE1 TYR 31 HE1 TYR 31 9.694 10.927 -2.264
220 HE2 TYR 31 HE2 TYR 31 6.614 12.278 -4.890
221 HH TYR 31 HH TYR 31 9.926 12.211 -4.428
222 H SER 32 H SER 32 7.929 7.553 -3.948
223 HA SER 32 HA SER 32 6.764 8.410 -6.374
224 HB2 SER 32 1HB SER 32 9.503 7.194 -5.976
225 HB3 SER 32 2HB SER 32 8.994 8.279 -7.274
226 HG SER 32 HG SER 32 9.161 9.943 -5.975
227 H GLU 33 H GLU 33 7.300 5.300 -5.010
228 HA GLU 33 HA GLU 33 7.079 3.968 -7.595
229 HB2 GLU 33 1HB GLU 33 7.790 3.047 -4.829
230 HB3 GLU 33 2HB GLU 33 7.329 1.891 -6.067
231 HG2 GLU 33 1HG GLU 33 9.759 2.136 -5.853
232 HG3 GLU 33 2HG GLU 33 9.175 2.566 -7.456
233 H ILE 34 H ILE 34 5.090 5.078 -5.146
234 HA ILE 34 HA ILE 34 3.169 2.978 -5.102
235 HB ILE 34 HB ILE 34 2.894 5.867 -4.288
236 HG12 ILE 34 1HG1 ILE 34 3.369 3.363 -2.661
237 HG13 ILE 34 2HG1 ILE 34 4.545 4.636 -2.961
238 HG21 ILE 34 1HG2 ILE 34 0.893 5.145 -3.059
239 HG22 ILE 34 2HG2 ILE 34 1.057 3.534 -3.763
240 HG23 ILE 34 3HG2 ILE 34 0.717 4.919 -4.801
241 HD11 ILE 34 1HD1 ILE 34 3.134 6.214 -1.743
242 HD12 ILE 34 2HD1 ILE 34 3.594 4.834 -0.744
243 HD13 ILE 34 3HD1 ILE 34 1.972 4.926 -1.434
244 H GLN 35 H GLN 35 1.509 2.593 -6.344
245 HA GLN 35 HA GLN 35 0.942 4.442 -8.560
246 HB2 GLN 35 1HB GLN 35 0.395 1.473 -8.377
247 HB3 GLN 35 2HB GLN 35 0.169 2.491 -9.792
248 HG2 GLN 35 1HG GLN 35 2.799 1.880 -8.470
249 HG3 GLN 35 2HG GLN 35 2.195 1.144 -9.951
250 HE21 GLN 35 1HE2 GLN 35 4.597 2.745 -9.421
251 HE22 GLN 35 2HE2 GLN 35 4.528 4.063 -10.534
252 H GLY 36 H GLY 36 -0.566 5.702 -7.452
253 HA2 GLY 36 1HA GLY 36 -2.830 4.284 -6.218
254 HA3 GLY 36 2HA GLY 36 -2.328 5.923 -5.831
255 H ASN 37 H ASN 37 -4.563 6.466 -6.124
256 HA ASN 37 HA ASN 37 -5.467 6.503 -8.921
257 HB2 ASN 37 1HB ASN 37 -7.069 7.025 -6.403
258 HB3 ASN 37 2HB ASN 37 -7.708 6.904 -8.037
259 HD21 ASN 37 1HD2 ASN 37 -6.479 5.172 -5.303
260 HD22 ASN 37 2HD2 ASN 37 -6.911 3.588 -5.852
261 H GLY 38 H GLY 38 -3.457 8.249 -8.288
262 HA2 GLY 38 1HA GLY 38 -3.372 10.564 -9.063
263 HA3 GLY 38 2HA GLY 38 -4.858 10.849 -8.164
264 H PHE 39 H PHE 39 -3.970 9.265 -5.894
265 HA PHE 39 HA PHE 39 -1.958 11.091 -4.775
266 HB2 PHE 39 1HB PHE 39 -4.248 9.612 -3.502
267 HB3 PHE 39 2HB PHE 39 -2.901 10.212 -2.543
268 HD1 PHE 39 HD1 PHE 39 -5.654 11.240 -4.792
269 HD2 PHE 39 HD2 PHE 39 -2.763 12.461 -1.919
270 HE1 PHE 39 HE1 PHE 39 -6.741 13.440 -4.638
271 HE2 PHE 39 HE2 PHE 39 -3.845 14.664 -1.762
272 HZ PHE 39 HZ PHE 39 -5.837 15.157 -3.122
273 H ARG 40 H ARG 40 -0.018 10.222 -4.543
274 HA ARG 40 HA ARG 40 0.289 7.339 -4.483
275 HB2 ARG 40 1HB ARG 40 2.367 9.527 -4.375
276 HB3 ARG 40 2HB ARG 40 2.700 7.810 -4.539
277 HG2 ARG 40 1HG ARG 40 1.425 7.826 -6.668
278 HG3 ARG 40 2HG ARG 40 1.283 9.579 -6.516
279 HD2 ARG 40 1HD ARG 40 3.750 9.730 -6.469
280 HD3 ARG 40 2HD ARG 40 3.835 7.991 -6.736
281 HE ARG 40 HE ARG 40 2.776 9.956 -8.661
282 HH11 ARG 40 1HH1 ARG 40 4.078 6.791 -7.948
283 HH12 ARG 40 2HH1 ARG 40 4.397 6.410 -9.607
284 HH21 ARG 40 1HH2 ARG 40 3.167 9.441 -10.852
285 HH22 ARG 40 2HH2 ARG 40 3.879 7.911 -11.257
286 H THR 41 H THR 41 -1.005 7.427 -2.440
287 HA THR 41 HA THR 41 0.804 7.559 -0.142
288 HB THR 41 HB THR 41 -1.187 8.465 1.187
289 HG1 THR 41 HG1 THR 41 -2.585 8.146 -0.819
290 HG21 THR 41 1HG2 THR 41 0.794 9.803 0.728
291 HG22 THR 41 2HG2 THR 41 -0.658 10.797 0.607
292 HG23 THR 41 3HG2 THR 41 0.153 10.237 -0.857
293 H LEU 42 H LEU 42 0.200 6.222 1.616
294 HA LEU 42 HA LEU 42 -1.779 4.155 0.952
295 HB2 LEU 42 1HB LEU 42 0.973 3.831 2.127
296 HB3 LEU 42 2HB LEU 42 -0.248 2.578 2.209
297 HG LEU 42 HG LEU 42 0.890 3.722 -0.334
298 HD11 LEU 42 1HD1 LEU 42 1.371 1.050 0.964
299 HD12 LEU 42 2HD1 LEU 42 2.502 2.403 0.976
300 HD13 LEU 42 3HD1 LEU 42 2.067 1.632 -0.549
301 HD21 LEU 42 1HD2 LEU 42 -1.368 2.964 -0.676
302 HD22 LEU 42 2HD2 LEU 42 -1.032 1.458 0.179
303 HD23 LEU 42 3HD2 LEU 42 -0.258 1.784 -1.374
304 H GLU 43 H GLU 43 -2.872 3.225 2.677
305 HA GLU 43 HA GLU 43 -2.993 4.924 5.052
306 HB2 GLU 43 1HB GLU 43 -4.900 2.873 3.928
307 HB3 GLU 43 2HB GLU 43 -5.156 3.725 5.443
308 HG2 GLU 43 1HG GLU 43 -4.908 5.012 2.739
309 HG3 GLU 43 2HG GLU 43 -6.418 4.708 3.595
310 H GLU 44 H GLU 44 -2.601 4.157 7.062
311 HA GLU 44 HA GLU 44 -1.041 1.840 7.377
312 HB2 GLU 44 1HB GLU 44 -0.977 3.822 8.867
313 HB3 GLU 44 2HB GLU 44 -2.567 3.390 9.473
314 HG2 GLU 44 1HG GLU 44 -1.633 1.260 10.275
315 HG3 GLU 44 2HG GLU 44 -0.040 1.795 9.756
316 H ASN 45 H ASN 45 -1.552 -0.201 7.801
317 HA ASN 45 HA ASN 45 -2.712 -2.086 8.317
318 HB2 ASN 45 1HB ASN 45 -4.902 -0.210 9.216
319 HB3 ASN 45 2HB ASN 45 -4.951 -1.959 9.394
320 HD21 ASN 45 1HD2 ASN 45 -3.619 0.994 10.533
321 HD22 ASN 45 2HD2 ASN 45 -2.844 0.355 11.937
322 H GLN 46 H GLN 46 -2.894 -0.475 5.789
323 HA GLN 46 HA GLN 46 -5.378 -1.578 4.681
324 HB2 GLN 46 1HB GLN 46 -4.923 0.814 4.298
325 HB3 GLN 46 2HB GLN 46 -3.414 0.392 3.506
326 HG2 GLN 46 1HG GLN 46 -4.635 -0.767 1.758
327 HG3 GLN 46 2HG GLN 46 -6.156 -0.387 2.558
328 HE21 GLN 46 1HE2 GLN 46 -3.484 0.866 0.756
329 HE22 GLN 46 2HE2 GLN 46 -4.217 2.372 0.324
330 H LYS 47 H LYS 47 -5.323 -2.936 2.868
331 HA LYS 47 HA LYS 47 -2.947 -4.519 2.600
332 HB2 LYS 47 1HB LYS 47 -5.598 -4.581 1.169
333 HB3 LYS 47 2HB LYS 47 -4.282 -5.692 0.809
334 HG2 LYS 47 1HG LYS 47 -5.548 -5.389 3.518
335 HG3 LYS 47 2HG LYS 47 -6.010 -6.611 2.336
336 HD2 LYS 47 1HD LYS 47 -3.189 -6.301 3.332
337 HD3 LYS 47 2HD LYS 47 -4.373 -7.323 4.146
338 HE2 LYS 47 1HE LYS 47 -3.591 -7.598 1.248
339 HE3 LYS 47 2HE LYS 47 -2.882 -8.535 2.559
340 HZ1 LYS 47 1HZ LYS 47 -4.642 -9.753 1.448
341 HZ2 LYS 47 2HZ LYS 47 -5.752 -8.528 1.797
342 HZ3 LYS 47 3HZ LYS 47 -5.071 -9.431 3.054
343 H VAL 48 H VAL 48 -1.856 -4.905 0.579
344 HA VAL 48 HA VAL 48 -2.034 -2.899 -1.477
345 HB VAL 48 HB VAL 48 -0.892 -1.692 0.331
346 HG11 VAL 48 1HG1 VAL 48 1.320 -2.369 1.073
347 HG12 VAL 48 2HG1 VAL 48 1.214 -3.822 0.077
348 HG13 VAL 48 3HG1 VAL 48 0.114 -3.604 1.441
349 HG21 VAL 48 1HG2 VAL 48 -0.366 -1.096 -1.949
350 HG22 VAL 48 2HG2 VAL 48 0.877 -2.347 -2.014
351 HG23 VAL 48 3HG2 VAL 48 1.074 -0.962 -0.939
352 H GLU 49 H GLU 49 -0.720 -3.349 -3.262
353 HA GLU 49 HA GLU 49 0.650 -5.951 -3.245
354 HB2 GLU 49 1HB GLU 49 -1.478 -6.099 -4.426
355 HB3 GLU 49 2HB GLU 49 -1.052 -4.711 -5.410
356 HG2 GLU 49 1HG GLU 49 0.720 -5.955 -6.465
357 HG3 GLU 49 2HG GLU 49 0.408 -7.339 -5.414
358 H PHE 50 H PHE 50 2.654 -5.996 -4.242
359 HA PHE 50 HA PHE 50 3.693 -3.654 -5.578
360 HB2 PHE 50 1HB PHE 50 5.416 -3.258 -3.767
361 HB3 PHE 50 2HB PHE 50 3.772 -2.790 -3.348
362 HD1 PHE 50 HD1 PHE 50 6.558 -4.960 -2.551
363 HD2 PHE 50 HD2 PHE 50 2.428 -4.216 -1.831
364 HE1 PHE 50 HE1 PHE 50 6.643 -6.390 -0.554
365 HE2 PHE 50 HE2 PHE 50 2.513 -5.647 0.162
366 HZ PHE 50 HZ PHE 50 4.624 -6.734 0.805
367 H GLU 51 H GLU 51 6.036 -3.891 -6.050
368 HA GLU 51 HA GLU 51 6.840 -6.724 -6.099
369 HB2 GLU 51 1HB GLU 51 6.554 -5.674 -8.339
370 HB3 GLU 51 2HB GLU 51 7.784 -4.491 -7.910
371 HG2 GLU 51 1HG GLU 51 9.454 -6.210 -7.751
372 HG3 GLU 51 2HG GLU 51 8.243 -7.462 -8.008
373 H ILE 52 H ILE 52 8.469 -7.247 -4.816
374 HA ILE 52 HA ILE 52 9.687 -5.185 -3.243
375 HB ILE 52 HB ILE 52 10.109 -8.168 -3.193
376 HG12 ILE 52 1HG1 ILE 52 8.480 -6.355 -1.413
377 HG13 ILE 52 2HG1 ILE 52 7.817 -7.414 -2.649
378 HG21 ILE 52 1HG2 ILE 52 12.027 -6.974 -2.282
379 HG22 ILE 52 2HG2 ILE 52 11.125 -7.776 -0.996
380 HG23 ILE 52 3HG2 ILE 52 10.960 -6.037 -1.238
381 HD11 ILE 52 1HD1 ILE 52 8.656 -9.351 -1.429
382 HD12 ILE 52 2HD1 ILE 52 7.570 -8.374 -0.442
383 HD13 ILE 52 3HD1 ILE 52 9.313 -8.282 -0.190
384 H GLY 53 H GLY 53 11.393 -4.123 -3.799
385 HA2 GLY 53 1HA GLY 53 13.481 -5.449 -5.401
386 HA3 GLY 53 2HA GLY 53 13.236 -3.708 -5.307
387 H GLU 54 H GLU 54 15.353 -3.307 -4.625
388 HA GLU 54 HA GLU 54 15.876 -4.098 -1.844
389 HB2 GLU 54 1HB GLU 54 17.261 -5.389 -3.485
390 HB3 GLU 54 2HB GLU 54 17.967 -3.868 -4.008
391 HG2 GLU 54 1HG GLU 54 19.462 -4.948 -2.483
392 HG3 GLU 54 2HG GLU 54 18.799 -3.505 -1.717
393 H GLY 55 H GLY 55 16.321 -2.455 -0.537
394 HA2 GLY 55 1HA GLY 55 16.851 0.178 -1.760
395 HA3 GLY 55 2HA GLY 55 15.961 -0.061 -0.264
396 H ALA 56 H ALA 56 17.470 1.476 0.660
397 HA ALA 56 HA ALA 56 20.251 0.749 0.832
398 HB1 ALA 56 1HB ALA 56 20.496 2.766 2.156
399 HB2 ALA 56 2HB ALA 56 18.742 2.928 2.265
400 HB3 ALA 56 3HB ALA 56 19.549 3.093 0.705
401 H LYS 57 H LYS 57 17.423 0.564 2.904
402 HA LYS 57 HA LYS 57 19.071 -0.480 5.092
403 HB2 LYS 57 1HB LYS 57 16.196 0.444 5.053
404 HB3 LYS 57 2HB LYS 57 17.025 -0.185 6.469
405 HG2 LYS 57 1HG LYS 57 18.612 1.668 6.369
406 HG3 LYS 57 2HG LYS 57 17.783 2.296 4.942
407 HD2 LYS 57 1HD LYS 57 15.750 2.610 6.239
408 HD3 LYS 57 2HD LYS 57 16.533 1.918 7.661
409 HE2 LYS 57 1HE LYS 57 18.150 3.751 7.660
410 HE3 LYS 57 2HE LYS 57 17.379 4.439 6.233
411 HZ1 LYS 57 1HZ LYS 57 16.691 5.502 8.328
412 HZ2 LYS 57 2HZ LYS 57 16.027 4.034 8.844
413 HZ3 LYS 57 3HZ LYS 57 15.391 4.821 7.489
414 H GLY 58 H GLY 58 16.739 -1.410 2.733
415 HA2 GLY 58 1HA GLY 58 17.135 -4.145 3.013
416 HA3 GLY 58 2HA GLY 58 15.732 -3.734 3.992
417 HA PRO 59 HA PRO 59 14.309 -4.719 -0.352
418 HB2 PRO 59 1HB PRO 59 11.904 -5.696 0.601
419 HB3 PRO 59 2HB PRO 59 13.323 -6.681 0.251
420 HG2 PRO 59 1HG PRO 59 12.369 -5.587 2.860
421 HG3 PRO 59 2HG PRO 59 13.040 -7.186 2.496
422 HD2 PRO 59 1HD PRO 59 14.535 -5.317 3.664
423 HD3 PRO 59 2HD PRO 59 15.226 -6.385 2.425
424 H GLN 60 H GLN 60 12.980 -3.446 -1.553
425 HA GLN 60 HA GLN 60 11.381 -1.467 -0.073
426 HB2 GLN 60 1HB GLN 60 11.875 0.183 -1.763
427 HB3 GLN 60 2HB GLN 60 13.383 -0.467 -1.136
428 HG2 GLN 60 1HG GLN 60 13.747 -1.754 -3.086
429 HG3 GLN 60 2HG GLN 60 12.112 -1.449 -3.672
430 HE21 GLN 60 1HE2 GLN 60 15.302 -0.161 -3.288
431 HE22 GLN 60 2HE2 GLN 60 15.083 1.226 -4.297
432 H ALA 61 H ALA 61 9.392 -0.922 -0.857
433 HA ALA 61 HA ALA 61 8.167 -2.860 -2.621
434 HB1 ALA 61 1HB ALA 61 6.952 -0.483 -1.215
435 HB2 ALA 61 2HB ALA 61 7.007 -2.129 -0.584
436 HB3 ALA 61 3HB ALA 61 6.071 -1.772 -2.036
437 H GLN 62 H GLN 62 8.342 -2.608 -4.715
438 HA GLN 62 HA GLN 62 8.373 0.105 -5.859
439 HB2 GLN 62 1HB GLN 62 9.214 -2.529 -7.080
440 HB3 GLN 62 2HB GLN 62 9.359 -0.953 -7.842
441 HG2 GLN 62 1HG GLN 62 11.030 -0.263 -6.324
442 HG3 GLN 62 2HG GLN 62 10.723 -1.630 -5.256
443 HE21 GLN 62 1HE2 GLN 62 10.525 -3.555 -7.388
444 HE22 GLN 62 2HE2 GLN 62 12.125 -3.813 -7.979
445 H GLN 63 H GLN 63 6.912 0.622 -7.492
446 HA GLN 63 HA GLN 63 4.878 0.641 -8.501
447 HB2 GLN 63 1HB GLN 63 5.564 -2.284 -8.831
448 HB3 GLN 63 2HB GLN 63 4.173 -1.529 -9.585
449 HG2 GLN 63 1HG GLN 63 5.792 -1.590 -11.255
450 HG3 GLN 63 2HG GLN 63 5.822 0.071 -10.668
451 HE21 GLN 63 1HE2 GLN 63 7.646 0.844 -9.675
452 HE22 GLN 63 2HE2 GLN 63 9.131 -0.033 -9.609
453 H VAL 64 H VAL 64 4.281 1.047 -6.170
454 HA VAL 64 HA VAL 64 3.083 -1.191 -4.756
455 HB VAL 64 HB VAL 64 3.145 1.641 -3.772
456 HG11 VAL 64 1HG1 VAL 64 3.216 -1.034 -2.408
457 HG12 VAL 64 2HG1 VAL 64 1.879 0.114 -2.437
458 HG13 VAL 64 3HG1 VAL 64 3.370 0.516 -1.585
459 HG21 VAL 64 1HG2 VAL 64 5.394 1.201 -4.537
460 HG22 VAL 64 2HG2 VAL 64 5.414 -0.334 -3.668
461 HG23 VAL 64 3HG2 VAL 64 5.347 1.186 -2.773
462 H HIS 65 H HIS 65 1.103 -1.696 -5.407
463 HA HIS 65 HA HIS 65 -0.816 0.453 -6.016
464 HB2 HIS 65 1HB HIS 65 -0.380 -1.237 -7.790
465 HB3 HIS 65 2HB HIS 65 -0.934 -2.494 -6.697
466 HD1 HIS 65 HD1 HIS 65 -2.117 -0.017 -9.135
467 HD2 HIS 65 HD2 HIS 65 -3.755 -2.383 -6.139
468 HE1 HIS 65 HE1 HIS 65 -4.593 -0.030 -9.566
469 HE2 HIS 65 HE2 HIS 65 -5.530 -1.639 -7.868
470 H ALA 66 H ALA 66 -2.284 0.883 -4.511
471 HA ALA 66 HA ALA 66 -2.418 -0.598 -2.096
472 HB1 ALA 66 1HB ALA 66 -4.276 1.552 -3.097
473 HB2 ALA 66 2HB ALA 66 -2.774 1.825 -2.213
474 HB3 ALA 66 3HB ALA 66 -4.118 0.991 -1.430
475 H LEU 67 H LEU 67 -3.901 -2.011 -1.336
476 HA LEU 67 HA LEU 67 -5.755 -3.097 -3.334
477 HB2 LEU 67 1HB LEU 67 -4.533 -4.349 -0.886
478 HB3 LEU 67 2HB LEU 67 -5.744 -5.128 -1.879
479 HG LEU 67 HG LEU 67 -2.957 -4.362 -2.731
480 HD11 LEU 67 1HD1 LEU 67 -4.240 -7.062 -2.356
481 HD12 LEU 67 2HD1 LEU 67 -3.123 -6.302 -1.223
482 HD13 LEU 67 3HD1 LEU 67 -2.575 -6.742 -2.840
483 HD21 LEU 67 1HD2 LEU 67 -3.501 -5.525 -4.822
484 HD22 LEU 67 2HD2 LEU 67 -4.507 -4.098 -4.583
485 HD23 LEU 67 3HD2 LEU 67 -5.170 -5.703 -4.280
486 H GLY 68 H GLY 68 -7.718 -2.262 -3.086
487 HA2 GLY 68 1HA GLY 68 -8.829 -1.729 -0.463
488 HA3 GLY 68 2HA GLY 68 -9.658 -1.555 -2.008
489 H GLY 69 H GLY 69 -8.463 -4.381 -2.497
490 HA2 GLY 69 1HA GLY 69 -9.039 -6.497 -1.246
491 HA3 GLY 69 2HA GLY 69 -10.663 -5.827 -1.176
492 H GLU 70 H GLU 70 -11.642 -7.439 -2.365
493 HA GLU 70 HA GLU 70 -10.673 -7.924 -5.074
494 HB2 GLU 70 1HB GLU 70 -12.936 -9.185 -3.515
495 HB3 GLU 70 2HB GLU 70 -12.459 -9.651 -5.142
496 HG2 GLU 70 1HG GLU 70 -10.728 -9.834 -2.684
497 HG3 GLU 70 2HG GLU 70 -11.565 -11.176 -3.462
498 H ASN 71 H ASN 71 -12.864 -5.972 -3.411
499 HA ASN 71 HA ASN 71 -14.527 -5.491 -5.769
500 HB2 ASN 71 1HB ASN 71 -14.711 -4.436 -2.936
501 HB3 ASN 71 2HB ASN 71 -15.806 -3.979 -4.234
502 HD21 ASN 71 1HD2 ASN 71 -17.554 -4.761 -3.067
503 HD22 ASN 71 2HD2 ASN 71 -17.873 -6.454 -2.917
504 H LEU 72 H LEU 72 -13.650 -4.119 -7.198
505 HA LEU 72 HA LEU 72 -12.812 -1.505 -6.308
506 HB2 LEU 72 1HB LEU 72 -10.615 -1.533 -7.257
507 HB3 LEU 72 2HB LEU 72 -10.737 -2.859 -6.121
508 HG LEU 72 HG LEU 72 -11.122 -3.300 -9.073
509 HD11 LEU 72 1HD1 LEU 72 -8.757 -3.896 -9.207
510 HD12 LEU 72 2HD1 LEU 72 -8.526 -3.366 -7.541
511 HD13 LEU 72 3HD1 LEU 72 -8.968 -2.197 -8.785
512 HD21 LEU 72 1HD2 LEU 72 -11.818 -5.088 -7.538
513 HD22 LEU 72 2HD2 LEU 72 -10.199 -5.106 -6.836
514 HD23 LEU 72 3HD2 LEU 72 -10.435 -5.569 -8.521
515 H TYR 73 H TYR 73 -12.632 0.013 -8.015
516 HA TYR 73 HA TYR 73 -14.235 -0.657 -10.336
517 HB2 TYR 73 1HB TYR 73 -14.576 1.478 -9.114
518 HB3 TYR 73 2HB TYR 73 -12.941 1.965 -9.540
519 HD1 TYR 73 HD1 TYR 73 -12.645 3.299 -11.410
520 HD2 TYR 73 HD2 TYR 73 -16.113 0.847 -11.172
521 HE1 TYR 73 HE1 TYR 73 -13.489 4.297 -13.495
522 HE2 TYR 73 HE2 TYR 73 -16.964 1.838 -13.255
523 HH TYR 73 HH TYR 73 -16.680 3.935 -14.549
524 H PHE 74 H PHE 74 -13.526 -0.574 -12.453
525 HA PHE 74 HA PHE 74 -11.061 -1.671 -13.031
526 HB2 PHE 74 1HB PHE 74 -12.890 -0.068 -14.828
527 HB3 PHE 74 2HB PHE 74 -11.549 -1.057 -15.395
528 HD1 PHE 74 HD1 PHE 74 -11.590 -3.547 -14.738
529 HD2 PHE 74 HD2 PHE 74 -14.994 -1.002 -14.589
530 HE1 PHE 74 HE1 PHE 74 -13.059 -5.519 -14.808
531 HE2 PHE 74 HE2 PHE 74 -16.472 -2.968 -14.656
532 HZ PHE 74 HZ PHE 74 -15.505 -5.231 -14.766
533 H GLN 75 H GLN 75 -9.089 -0.932 -13.569
534 HA GLN 75 HA GLN 75 -8.414 1.673 -12.607
535 HB2 GLN 75 1HB GLN 75 -6.967 -0.272 -12.214
536 HB3 GLN 75 2HB GLN 75 -6.695 -0.424 -13.944
537 HG2 GLN 75 1HG GLN 75 -5.694 1.866 -13.903
538 HG3 GLN 75 2HG GLN 75 -5.807 1.816 -12.144
539 HE21 GLN 75 1HE2 GLN 75 -3.477 2.001 -13.894
540 HE22 GLN 75 2HE2 GLN 75 -2.462 0.660 -13.487
541 H GLY 76 H GLY 76 -7.973 3.480 -13.703
542 HA2 GLY 76 1HA GLY 76 -7.346 4.851 -15.454
543 HA3 GLY 76 2HA GLY 76 -7.112 3.420 -16.443
544 H HIS 77 H HIS 77 -8.089 4.877 -18.061
545 HA HIS 77 HA HIS 77 -11.026 4.887 -17.869
546 HB2 HIS 77 1HB HIS 77 -9.912 7.109 -18.088
547 HB3 HIS 77 2HB HIS 77 -9.248 6.591 -19.631
548 HD1 HIS 77 HD1 HIS 77 -10.547 7.375 -21.570
549 HD2 HIS 77 HD2 HIS 77 -12.928 6.951 -18.189
550 HE1 HIS 77 HE1 HIS 77 -12.833 8.171 -22.249
551 HE2 HIS 77 HE2 HIS 77 -14.284 7.794 -20.223
552 H HIS 78 H HIS 78 -10.321 2.504 -18.428
553 HA HIS 78 HA HIS 78 -10.344 0.762 -19.881
554 HB2 HIS 78 1HB HIS 78 -11.816 2.771 -21.594
555 HB3 HIS 78 2HB HIS 78 -11.694 1.056 -21.964
556 HD1 HIS 78 HD1 HIS 78 -13.993 3.324 -20.599
557 HD2 HIS 78 HD2 HIS 78 -12.714 -0.474 -19.498
558 HE1 HIS 78 HE1 HIS 78 -15.801 2.403 -19.116
559 HE2 HIS 78 HE2 HIS 78 -14.920 0.185 -18.321
560 H HIS 79 H HIS 79 -7.957 2.152 -19.860
561 HA HIS 79 HA HIS 79 -7.170 2.734 -22.583
562 HB2 HIS 79 1HB HIS 79 -6.334 3.988 -20.540
563 HB3 HIS 79 2HB HIS 79 -5.379 2.563 -20.158
564 HD1 HIS 79 HD1 HIS 79 -5.597 5.411 -22.581
565 HD2 HIS 79 HD2 HIS 79 -3.098 2.199 -21.733
566 HE1 HIS 79 HE1 HIS 79 -3.490 5.828 -23.886
567 HE2 HIS 79 HE2 HIS 79 -2.052 3.804 -23.469
568 H HIS 80 H HIS 80 -6.764 0.184 -20.221
569 HA HIS 80 HA HIS 80 -4.935 -1.303 -21.906
570 HB2 HIS 80 1HB HIS 80 -6.315 -2.066 -19.323
571 HB3 HIS 80 2HB HIS 80 -5.111 -3.049 -20.147
572 HD1 HIS 80 HD1 HIS 80 -5.341 -0.900 -17.390
573 HD2 HIS 80 HD2 HIS 80 -2.596 -1.284 -20.487
574 HE1 HIS 80 HE1 HIS 80 -3.225 0.170 -16.554
575 HE2 HIS 80 HE2 HIS 80 -1.634 0.071 -18.502
576 H HIS 81 H HIS 81 -6.056 -1.754 -23.787
577 HA HIS 81 HA HIS 81 -8.100 -3.814 -23.561
578 HB2 HIS 81 1HB HIS 81 -9.668 -2.675 -25.066
579 HB3 HIS 81 2HB HIS 81 -9.418 -1.739 -23.599
580 HD1 HIS 81 HD1 HIS 81 -8.823 0.661 -23.913
581 HD2 HIS 81 HD2 HIS 81 -8.181 -1.578 -27.359
582 HE1 HIS 81 HE1 HIS 81 -8.192 2.318 -25.691
583 HE2 HIS 81 HE2 HIS 81 -7.693 0.933 -27.736
584 H HIS 82 H HIS 82 -8.659 -4.709 -25.754
585 HA HIS 82 HA HIS 82 -6.238 -4.756 -27.412
586 HB2 HIS 82 1HB HIS 82 -8.553 -6.696 -27.236
587 HB3 HIS 82 2HB HIS 82 -7.219 -6.846 -28.374
588 HD1 HIS 82 HD1 HIS 82 -8.264 -8.025 -25.178
589 HD2 HIS 82 HD2 HIS 82 -4.617 -6.960 -26.856
590 HE1 HIS 82 HE1 HIS 82 -6.516 -9.072 -23.711
591 HE2 HIS 82 HE2 HIS 82 -4.321 -8.261 -24.642
Start of MODEL 13
1 H2 MET 1 2H MET 1 6.444 -11.032 -8.137
2 H MET 1 1H MET 1 7.098 -9.622 -8.808
3 H3 MET 1 3H MET 1 7.572 -10.127 -7.265
4 HA MET 1 HA MET 1 6.061 -8.288 -7.105
5 HB2 MET 1 1HB MET 1 3.749 -8.510 -7.849
6 HB3 MET 1 2HB MET 1 4.849 -8.676 -9.207
7 HG2 MET 1 1HG MET 1 4.548 -11.054 -9.235
8 HG3 MET 1 2HG MET 1 3.590 -10.992 -7.757
9 HE1 MET 1 1HE MET 1 1.760 -8.378 -8.300
10 HE2 MET 1 2HE MET 1 1.228 -9.896 -7.576
11 HE3 MET 1 3HE MET 1 0.335 -9.203 -8.927
12 H ALA 2 H ALA 2 4.862 -8.108 -5.251
13 HA ALA 2 HA ALA 2 4.081 -10.570 -3.862
14 HB1 ALA 2 1HB ALA 2 6.329 -10.035 -3.071
15 HB2 ALA 2 2HB ALA 2 5.140 -9.770 -1.795
16 HB3 ALA 2 3HB ALA 2 5.811 -8.397 -2.677
17 H GLN 3 H GLN 3 2.851 -9.953 -1.810
18 HA GLN 3 HA GLN 3 1.460 -7.398 -2.068
19 HB2 GLN 3 1HB GLN 3 0.090 -10.084 -1.920
20 HB3 GLN 3 2HB GLN 3 -0.723 -8.554 -1.633
21 HG2 GLN 3 1HG GLN 3 -0.221 -7.848 -3.900
22 HG3 GLN 3 2HG GLN 3 0.628 -9.364 -4.192
23 HE21 GLN 3 1HE2 GLN 3 -1.665 -8.253 -5.578
24 HE22 GLN 3 2HE2 GLN 3 -2.931 -9.417 -5.423
25 H GLY 4 H GLY 4 0.115 -6.967 -0.121
26 HA2 GLY 4 1HA GLY 4 0.384 -8.417 2.253
27 HA3 GLY 4 2HA GLY 4 1.704 -7.263 2.176
28 H THR 5 H THR 5 1.019 -6.089 3.885
29 HA THR 5 HA THR 5 -1.255 -4.317 3.348
30 HB THR 5 HB THR 5 -0.755 -5.506 6.076
31 HG1 THR 5 HG1 THR 5 -2.101 -7.118 5.607
32 HG21 THR 5 1HG2 THR 5 -3.017 -4.700 6.535
33 HG22 THR 5 2HG2 THR 5 -3.136 -4.083 4.886
34 HG23 THR 5 3HG2 THR 5 -1.969 -3.381 6.010
35 H VAL 6 H VAL 6 -0.516 -2.285 3.463
36 HA VAL 6 HA VAL 6 2.036 -1.671 4.504
37 HB VAL 6 HB VAL 6 1.429 -0.183 2.845
38 HG11 VAL 6 1HG1 VAL 6 -1.233 0.157 4.190
39 HG12 VAL 6 2HG1 VAL 6 -0.910 -0.744 2.707
40 HG13 VAL 6 3HG1 VAL 6 -0.706 1.006 2.740
41 HG21 VAL 6 1HG2 VAL 6 2.362 1.040 4.734
42 HG22 VAL 6 2HG2 VAL 6 0.740 1.273 5.393
43 HG23 VAL 6 3HG2 VAL 6 1.187 2.028 3.863
44 H LYS 7 H LYS 7 2.601 -1.635 6.516
45 HA LYS 7 HA LYS 7 0.689 -1.788 8.610
46 HB2 LYS 7 1HB LYS 7 2.617 -1.908 10.101
47 HB3 LYS 7 2HB LYS 7 2.822 -2.980 8.725
48 HG2 LYS 7 1HG LYS 7 4.387 -1.529 7.716
49 HG3 LYS 7 2HG LYS 7 4.026 -0.238 8.860
50 HD2 LYS 7 1HD LYS 7 6.110 -1.269 9.469
51 HD3 LYS 7 2HD LYS 7 4.893 -1.670 10.681
52 HE2 LYS 7 1HE LYS 7 4.566 -3.851 9.625
53 HE3 LYS 7 2HE LYS 7 5.781 -3.448 8.414
54 HZ1 LYS 7 1HZ LYS 7 6.799 -4.782 10.077
55 HZ2 LYS 7 2HZ LYS 7 6.207 -3.800 11.328
56 HZ3 LYS 7 3HZ LYS 7 7.384 -3.202 10.275
57 H TRP 8 H TRP 8 2.671 0.707 7.244
58 HA TRP 8 HA TRP 8 0.925 2.730 8.112
59 HB2 TRP 8 1HB TRP 8 2.390 4.024 9.574
60 HB3 TRP 8 2HB TRP 8 2.071 2.447 10.278
61 HD1 TRP 8 HD1 TRP 8 4.115 0.835 10.642
62 HE1 TRP 8 HE1 TRP 8 6.662 1.176 10.530
63 HE3 TRP 8 HE3 TRP 8 4.231 5.346 8.239
64 HZ2 TRP 8 HZ2 TRP 8 8.476 3.101 9.564
65 HZ3 TRP 8 HZ3 TRP 8 6.416 6.366 7.760
66 HH2 TRP 8 HH2 TRP 8 8.491 5.263 8.409
67 H PHE 9 H PHE 9 1.370 4.704 7.086
68 HA PHE 9 HA PHE 9 3.813 4.826 5.503
69 HB2 PHE 9 1HB PHE 9 2.049 3.844 4.052
70 HB3 PHE 9 2HB PHE 9 1.086 5.298 4.290
71 HD1 PHE 9 HD1 PHE 9 4.156 3.940 2.812
72 HD2 PHE 9 HD2 PHE 9 1.589 7.318 3.119
73 HE1 PHE 9 HE1 PHE 9 5.334 4.999 0.932
74 HE2 PHE 9 HE2 PHE 9 2.761 8.382 1.236
75 HZ PHE 9 HZ PHE 9 4.637 7.224 0.141
76 H ASN 10 H ASN 10 4.734 6.703 5.734
77 HA ASN 10 HA ASN 10 3.272 8.918 6.905
78 HB2 ASN 10 1HB ASN 10 5.569 8.279 7.672
79 HB3 ASN 10 2HB ASN 10 6.182 8.747 6.094
80 HD21 ASN 10 1HD2 ASN 10 6.702 9.759 8.817
81 HD22 ASN 10 2HD2 ASN 10 6.398 11.461 8.732
82 H ALA 11 H ALA 11 2.026 9.943 5.480
83 HA ALA 11 HA ALA 11 2.585 10.017 2.685
84 HB1 ALA 11 1HB ALA 11 0.548 11.344 2.516
85 HB2 ALA 11 2HB ALA 11 0.515 11.526 4.272
86 HB3 ALA 11 3HB ALA 11 0.304 9.932 3.547
87 H GLU 12 H GLU 12 3.357 12.062 5.334
88 HA GLU 12 HA GLU 12 3.639 14.491 3.851
89 HB2 GLU 12 1HB GLU 12 4.906 13.756 6.492
90 HB3 GLU 12 2HB GLU 12 4.675 15.377 5.851
91 HG2 GLU 12 1HG GLU 12 2.249 15.067 5.989
92 HG3 GLU 12 2HG GLU 12 2.510 13.470 6.686
93 H LYS 13 H LYS 13 5.810 12.009 5.066
94 HA LYS 13 HA LYS 13 8.117 13.290 3.876
95 HB2 LYS 13 1HB LYS 13 7.889 10.642 5.298
96 HB3 LYS 13 2HB LYS 13 9.382 11.469 4.883
97 HG2 LYS 13 1HG LYS 13 7.285 12.494 6.774
98 HG3 LYS 13 2HG LYS 13 8.801 11.724 7.239
99 HD2 LYS 13 1HD LYS 13 10.030 13.523 6.090
100 HD3 LYS 13 2HD LYS 13 8.494 14.300 5.710
101 HE2 LYS 13 1HE LYS 13 8.011 14.541 8.080
102 HE3 LYS 13 2HE LYS 13 9.521 13.725 8.484
103 HZ1 LYS 13 1HZ LYS 13 10.729 15.524 7.407
104 HZ2 LYS 13 2HZ LYS 13 9.754 16.116 8.651
105 HZ3 LYS 13 3HZ LYS 13 9.278 16.309 7.040
106 H GLY 14 H GLY 14 5.976 10.623 3.278
107 HA2 GLY 14 1HA GLY 14 5.527 9.750 1.153
108 HA3 GLY 14 2HA GLY 14 7.036 10.432 0.573
109 H PHE 15 H PHE 15 6.829 8.458 3.476
110 HA PHE 15 HA PHE 15 7.629 6.092 2.002
111 HB2 PHE 15 1HB PHE 15 9.669 5.695 3.193
112 HB3 PHE 15 2HB PHE 15 9.755 7.308 2.506
113 HD1 PHE 15 HD1 PHE 15 9.861 9.253 3.915
114 HD2 PHE 15 HD2 PHE 15 9.443 5.368 5.603
115 HE1 PHE 15 HE1 PHE 15 10.467 10.147 6.127
116 HE2 PHE 15 HE2 PHE 15 10.044 6.261 7.814
117 HZ PHE 15 HZ PHE 15 10.556 8.652 8.078
118 H GLY 16 H GLY 16 7.766 4.160 3.429
119 HA2 GLY 16 1HA GLY 16 6.640 4.221 6.039
120 HA3 GLY 16 2HA GLY 16 5.411 3.813 4.849
121 H PHE 17 H PHE 17 5.299 1.770 6.021
122 HA PHE 17 HA PHE 17 7.213 -0.132 4.876
123 HB2 PHE 17 1HB PHE 17 6.616 0.234 7.778
124 HB3 PHE 17 2HB PHE 17 6.903 -1.393 7.173
125 HD1 PHE 17 HD1 PHE 17 8.391 1.836 7.929
126 HD2 PHE 17 HD2 PHE 17 9.074 -2.023 6.284
127 HE1 PHE 17 HE1 PHE 17 10.817 2.199 8.105
128 HE2 PHE 17 HE2 PHE 17 11.502 -1.670 6.451
129 HZ PHE 17 HZ PHE 17 12.378 0.443 7.365
130 H ILE 18 H ILE 18 6.400 -2.110 4.396
131 HA ILE 18 HA ILE 18 3.526 -2.518 4.868
132 HB ILE 18 HB ILE 18 5.211 -3.395 2.524
133 HG12 ILE 18 1HG1 ILE 18 2.727 -1.703 2.500
134 HG13 ILE 18 2HG1 ILE 18 4.342 -1.015 2.614
135 HG21 ILE 18 1HG2 ILE 18 3.694 -5.182 3.088
136 HG22 ILE 18 2HG2 ILE 18 3.162 -4.385 1.605
137 HG23 ILE 18 3HG2 ILE 18 2.340 -4.052 3.132
138 HD11 ILE 18 1HD1 ILE 18 3.516 -0.970 0.332
139 HD12 ILE 18 2HD1 ILE 18 3.302 -2.721 0.364
140 HD13 ILE 18 3HD1 ILE 18 4.922 -2.028 0.473
141 H ALA 19 H ALA 19 2.861 -4.444 5.644
142 HA ALA 19 HA ALA 19 4.918 -6.437 6.283
143 HB1 ALA 19 1HB ALA 19 3.482 -5.698 8.140
144 HB2 ALA 19 2HB ALA 19 3.258 -7.412 7.785
145 HB3 ALA 19 3HB ALA 19 2.061 -6.235 7.244
146 HA PRO 20 HA PRO 20 3.306 -8.137 2.360
147 HB2 PRO 20 1HB PRO 20 5.596 -9.936 2.935
148 HB3 PRO 20 2HB PRO 20 5.173 -9.094 1.440
149 HG2 PRO 20 1HG PRO 20 7.178 -8.217 2.928
150 HG3 PRO 20 2HG PRO 20 6.051 -7.070 2.184
151 HD2 PRO 20 1HD PRO 20 6.177 -8.038 5.011
152 HD3 PRO 20 2HD PRO 20 5.886 -6.398 4.395
153 H ASP 21 H ASP 21 2.040 -9.846 1.949
154 HA ASP 21 HA ASP 21 1.303 -11.648 4.061
155 HB2 ASP 21 1HB ASP 21 -0.326 -10.843 2.374
156 HB3 ASP 21 2HB ASP 21 0.574 -11.685 1.120
157 H ASP 22 H ASP 22 3.713 -11.460 1.799
158 HA ASP 22 HA ASP 22 4.197 -14.212 1.243
159 HB2 ASP 22 1HB ASP 22 5.876 -11.730 0.920
160 HB3 ASP 22 2HB ASP 22 6.407 -13.327 0.408
161 H GLY 23 H GLY 23 4.053 -13.364 4.124
162 HA2 GLY 23 1HA GLY 23 5.087 -14.627 5.872
163 HA3 GLY 23 2HA GLY 23 6.571 -14.638 4.936
164 H SER 24 H SER 24 4.843 -11.703 5.134
165 HA SER 24 HA SER 24 5.209 -9.713 6.120
166 HB2 SER 24 1HB SER 24 5.898 -11.483 8.467
167 HB3 SER 24 2HB SER 24 5.532 -9.760 8.564
168 HG SER 24 HG SER 24 3.698 -11.420 7.258
169 H ALA 25 H ALA 25 7.352 -10.446 4.558
170 HA ALA 25 HA ALA 25 9.769 -9.756 5.959
171 HB1 ALA 25 1HB ALA 25 9.865 -11.139 3.938
172 HB2 ALA 25 2HB ALA 25 10.785 -9.649 3.734
173 HB3 ALA 25 3HB ALA 25 9.192 -9.809 2.995
174 H ASP 26 H ASP 26 9.010 -7.881 7.012
175 HA ASP 26 HA ASP 26 7.592 -5.766 6.155
176 HB2 ASP 26 1HB ASP 26 10.076 -5.487 7.851
177 HB3 ASP 26 2HB ASP 26 8.708 -4.380 7.805
178 H VAL 27 H VAL 27 7.699 -4.667 4.379
179 HA VAL 27 HA VAL 27 10.322 -4.143 3.178
180 HB VAL 27 HB VAL 27 8.824 -5.544 1.844
181 HG11 VAL 27 1HG1 VAL 27 6.978 -3.175 1.879
182 HG12 VAL 27 2HG1 VAL 27 6.689 -4.746 2.634
183 HG13 VAL 27 3HG1 VAL 27 6.778 -4.612 0.877
184 HG21 VAL 27 1HG2 VAL 27 8.902 -4.282 -0.239
185 HG22 VAL 27 2HG2 VAL 27 10.392 -4.102 0.686
186 HG23 VAL 27 3HG2 VAL 27 9.202 -2.802 0.672
187 H PHE 28 H PHE 28 10.905 -2.132 2.546
188 HA PHE 28 HA PHE 28 9.560 0.065 3.858
189 HB2 PHE 28 1HB PHE 28 12.020 -0.184 3.905
190 HB3 PHE 28 2HB PHE 28 12.061 -0.003 2.156
191 HD1 PHE 28 HD1 PHE 28 11.546 1.714 5.345
192 HD2 PHE 28 HD2 PHE 28 11.812 2.148 1.121
193 HE1 PHE 28 HE1 PHE 28 11.770 4.148 5.615
194 HE2 PHE 28 HE2 PHE 28 12.033 4.584 1.383
195 HZ PHE 28 HZ PHE 28 12.014 5.586 3.632
196 H VAL 29 H VAL 29 8.272 1.524 2.904
197 HA VAL 29 HA VAL 29 7.894 1.292 -0.008
198 HB VAL 29 HB VAL 29 6.011 2.858 1.679
199 HG11 VAL 29 1HG1 VAL 29 5.731 2.782 -0.736
200 HG12 VAL 29 2HG1 VAL 29 4.378 2.003 0.082
201 HG13 VAL 29 3HG1 VAL 29 5.631 1.023 -0.675
202 HG21 VAL 29 1HG2 VAL 29 5.978 -0.147 1.562
203 HG22 VAL 29 2HG2 VAL 29 4.733 0.884 2.270
204 HG23 VAL 29 3HG2 VAL 29 6.344 0.832 2.984
205 H HIS 30 H HIS 30 7.836 3.125 -1.296
206 HA HIS 30 HA HIS 30 8.435 5.700 -0.068
207 HB2 HIS 30 1HB HIS 30 10.594 4.580 -0.697
208 HB3 HIS 30 2HB HIS 30 10.045 4.576 -2.369
209 HD1 HIS 30 HD1 HIS 30 10.999 6.421 -3.671
210 HD2 HIS 30 HD2 HIS 30 10.537 7.441 0.331
211 HE1 HIS 30 HE1 HIS 30 11.912 8.754 -3.457
212 HE2 HIS 30 HE2 HIS 30 11.832 9.248 -0.991
213 H TYR 31 H TYR 31 7.495 7.363 -1.099
214 HA TYR 31 HA TYR 31 5.128 6.826 -2.375
215 HB2 TYR 31 1HB TYR 31 4.840 9.188 -2.642
216 HB3 TYR 31 2HB TYR 31 5.672 8.899 -1.121
217 HD1 TYR 31 HD1 TYR 31 5.847 10.445 -4.387
218 HD2 TYR 31 HD2 TYR 31 8.108 9.404 -0.940
219 HE1 TYR 31 HE1 TYR 31 7.608 12.011 -5.077
220 HE2 TYR 31 HE2 TYR 31 9.874 10.969 -1.618
221 HH TYR 31 HH TYR 31 9.433 13.297 -4.049
222 H SER 32 H SER 32 8.206 7.570 -3.923
223 HA SER 32 HA SER 32 7.089 8.213 -6.452
224 HB2 SER 32 1HB SER 32 9.472 7.836 -7.245
225 HB3 SER 32 2HB SER 32 9.276 9.030 -5.961
226 HG SER 32 HG SER 32 10.223 6.363 -5.771
227 H GLU 33 H GLU 33 7.649 5.275 -4.819
228 HA GLU 33 HA GLU 33 7.744 3.687 -7.247
229 HB2 GLU 33 1HB GLU 33 7.988 3.071 -4.321
230 HB3 GLU 33 2HB GLU 33 7.709 1.788 -5.485
231 HG2 GLU 33 1HG GLU 33 10.063 1.980 -4.965
232 HG3 GLU 33 2HG GLU 33 9.767 2.389 -6.651
233 H ILE 34 H ILE 34 5.471 4.936 -5.073
234 HA ILE 34 HA ILE 34 3.495 2.888 -5.347
235 HB ILE 34 HB ILE 34 3.176 5.745 -4.428
236 HG12 ILE 34 1HG1 ILE 34 3.529 3.209 -2.819
237 HG13 ILE 34 2HG1 ILE 34 4.753 4.453 -3.043
238 HG21 ILE 34 1HG2 ILE 34 1.347 3.369 -4.105
239 HG22 ILE 34 2HG2 ILE 34 1.063 4.773 -5.136
240 HG23 ILE 34 3HG2 ILE 34 1.102 4.959 -3.381
241 HD11 ILE 34 1HD1 ILE 34 3.361 6.058 -1.879
242 HD12 ILE 34 2HD1 ILE 34 3.640 4.630 -0.878
243 HD13 ILE 34 3HD1 ILE 34 2.094 4.848 -1.700
244 H GLN 35 H GLN 35 1.923 2.701 -6.782
245 HA GLN 35 HA GLN 35 1.718 4.756 -8.885
246 HB2 GLN 35 1HB GLN 35 1.032 1.829 -9.120
247 HB3 GLN 35 2HB GLN 35 1.148 3.000 -10.421
248 HG2 GLN 35 1HG GLN 35 3.448 2.075 -8.724
249 HG3 GLN 35 2HG GLN 35 3.063 1.460 -10.328
250 HE21 GLN 35 1HE2 GLN 35 5.449 2.818 -9.332
251 HE22 GLN 35 2HE2 GLN 35 5.663 4.198 -10.350
252 H GLY 36 H GLY 36 0.065 5.940 -7.881
253 HA2 GLY 36 1HA GLY 36 -2.358 4.414 -7.168
254 HA3 GLY 36 2HA GLY 36 -1.859 5.900 -6.378
255 H ASN 37 H ASN 37 -3.987 6.656 -6.800
256 HA ASN 37 HA ASN 37 -4.805 7.075 -9.559
257 HB2 ASN 37 1HB ASN 37 -6.895 7.907 -8.573
258 HB3 ASN 37 2HB ASN 37 -6.468 6.335 -7.907
259 HD21 ASN 37 1HD2 ASN 37 -8.182 8.419 -6.812
260 HD22 ASN 37 2HD2 ASN 37 -7.519 8.829 -5.269
261 H GLY 38 H GLY 38 -2.485 8.455 -8.968
262 HA2 GLY 38 1HA GLY 38 -1.818 10.674 -9.511
263 HA3 GLY 38 2HA GLY 38 -3.397 11.248 -8.983
264 H PHE 39 H PHE 39 -3.164 9.451 -6.603
265 HA PHE 39 HA PHE 39 -1.344 11.113 -5.012
266 HB2 PHE 39 1HB PHE 39 -3.717 9.434 -4.184
267 HB3 PHE 39 2HB PHE 39 -2.640 10.241 -3.052
268 HD1 PHE 39 HD1 PHE 39 -2.620 12.678 -2.882
269 HD2 PHE 39 HD2 PHE 39 -5.364 10.647 -5.420
270 HE1 PHE 39 HE1 PHE 39 -3.978 14.719 -3.039
271 HE2 PHE 39 HE2 PHE 39 -6.727 12.685 -5.585
272 HZ PHE 39 HZ PHE 39 -6.034 14.727 -4.393
273 H ARG 40 H ARG 40 0.572 10.174 -4.837
274 HA ARG 40 HA ARG 40 0.806 7.284 -4.819
275 HB2 ARG 40 1HB ARG 40 2.933 9.418 -4.603
276 HB3 ARG 40 2HB ARG 40 3.224 7.699 -4.815
277 HG2 ARG 40 1HG ARG 40 1.978 7.823 -6.965
278 HG3 ARG 40 2HG ARG 40 1.912 9.574 -6.761
279 HD2 ARG 40 1HD ARG 40 4.387 9.603 -6.665
280 HD3 ARG 40 2HD ARG 40 4.387 7.874 -7.005
281 HE ARG 40 HE ARG 40 3.384 9.941 -8.861
282 HH11 ARG 40 1HH1 ARG 40 4.772 6.779 -8.268
283 HH12 ARG 40 2HH1 ARG 40 5.138 6.487 -9.938
284 HH21 ARG 40 1HH2 ARG 40 3.845 9.551 -11.055
285 HH22 ARG 40 2HH2 ARG 40 4.593 8.059 -11.530
286 H THR 41 H THR 41 -0.572 7.449 -2.805
287 HA THR 41 HA THR 41 1.178 7.510 -0.456
288 HB THR 41 HB THR 41 -0.866 8.464 0.790
289 HG1 THR 41 HG1 THR 41 -2.359 8.304 -0.945
290 HG21 THR 41 1HG2 THR 41 0.677 10.192 -1.146
291 HG22 THR 41 2HG2 THR 41 1.197 9.717 0.472
292 HG23 THR 41 3HG2 THR 41 -0.201 10.775 0.269
293 H LEU 42 H LEU 42 0.302 6.342 1.377
294 HA LEU 42 HA LEU 42 -1.681 4.300 0.671
295 HB2 LEU 42 1HB LEU 42 1.007 3.875 1.968
296 HB3 LEU 42 2HB LEU 42 -0.272 2.680 1.991
297 HG LEU 42 HG LEU 42 1.067 3.743 -0.487
298 HD11 LEU 42 1HD1 LEU 42 2.150 1.604 -0.626
299 HD12 LEU 42 2HD1 LEU 42 1.325 1.051 0.828
300 HD13 LEU 42 3HD1 LEU 42 2.521 2.342 0.931
301 HD21 LEU 42 1HD2 LEU 42 -0.107 1.853 -1.591
302 HD22 LEU 42 2HD2 LEU 42 -1.195 3.100 -0.981
303 HD23 LEU 42 3HD2 LEU 42 -1.003 1.586 -0.092
304 H GLU 43 H GLU 43 -2.609 3.243 2.551
305 HA GLU 43 HA GLU 43 -2.761 5.093 4.835
306 HB2 GLU 43 1HB GLU 43 -4.788 3.125 3.770
307 HB3 GLU 43 2HB GLU 43 -4.999 4.081 5.228
308 HG2 GLU 43 1HG GLU 43 -4.877 6.127 3.898
309 HG3 GLU 43 2HG GLU 43 -4.674 5.157 2.440
310 H GLU 44 H GLU 44 -3.030 4.159 6.932
311 HA GLU 44 HA GLU 44 -1.268 1.964 7.353
312 HB2 GLU 44 1HB GLU 44 -1.507 3.927 8.874
313 HB3 GLU 44 2HB GLU 44 -3.094 3.328 9.326
314 HG2 GLU 44 1HG GLU 44 -2.119 1.333 10.244
315 HG3 GLU 44 2HG GLU 44 -0.519 1.839 9.714
316 H ASN 45 H ASN 45 -1.713 -0.103 7.548
317 HA ASN 45 HA ASN 45 -2.804 -2.077 7.659
318 HB2 ASN 45 1HB ASN 45 -4.969 -0.420 8.945
319 HB3 ASN 45 2HB ASN 45 -5.090 -2.159 8.723
320 HD21 ASN 45 1HD2 ASN 45 -3.655 0.398 10.495
321 HD22 ASN 45 2HD2 ASN 45 -2.871 -0.575 11.688
322 H GLN 46 H GLN 46 -2.800 -0.479 5.374
323 HA GLN 46 HA GLN 46 -5.339 -1.134 4.065
324 HB2 GLN 46 1HB GLN 46 -4.440 1.153 3.810
325 HB3 GLN 46 2HB GLN 46 -2.980 0.488 3.104
326 HG2 GLN 46 1HG GLN 46 -4.376 -0.466 1.284
327 HG3 GLN 46 2HG GLN 46 -5.750 0.409 1.958
328 HE21 GLN 46 1HE2 GLN 46 -6.023 1.677 0.162
329 HE22 GLN 46 2HE2 GLN 46 -4.917 2.931 -0.277
330 H LYS 47 H LYS 47 -5.447 -2.834 2.703
331 HA LYS 47 HA LYS 47 -3.253 -4.563 2.305
332 HB2 LYS 47 1HB LYS 47 -5.871 -4.338 0.819
333 HB3 LYS 47 2HB LYS 47 -4.702 -5.624 0.553
334 HG2 LYS 47 1HG LYS 47 -6.163 -5.040 3.116
335 HG3 LYS 47 2HG LYS 47 -6.482 -6.373 2.009
336 HD2 LYS 47 1HD LYS 47 -3.918 -5.926 3.535
337 HD3 LYS 47 2HD LYS 47 -5.180 -7.077 3.972
338 HE2 LYS 47 1HE LYS 47 -4.817 -8.273 1.871
339 HE3 LYS 47 2HE LYS 47 -3.570 -7.112 1.422
340 HZ1 LYS 47 1HZ LYS 47 -2.341 -7.790 3.428
341 HZ2 LYS 47 2HZ LYS 47 -2.535 -9.050 2.314
342 HZ3 LYS 47 3HZ LYS 47 -3.493 -8.998 3.709
343 H VAL 48 H VAL 48 -1.922 -4.876 0.523
344 HA VAL 48 HA VAL 48 -1.994 -2.906 -1.598
345 HB VAL 48 HB VAL 48 -0.961 -1.754 0.342
346 HG11 VAL 48 1HG1 VAL 48 0.083 -3.655 1.401
347 HG12 VAL 48 2HG1 VAL 48 1.287 -2.412 1.054
348 HG13 VAL 48 3HG1 VAL 48 1.176 -3.845 0.030
349 HG21 VAL 48 1HG2 VAL 48 -0.422 -1.046 -1.907
350 HG22 VAL 48 2HG2 VAL 48 0.868 -2.244 -1.995
351 HG23 VAL 48 3HG2 VAL 48 0.991 -0.899 -0.861
352 H GLU 49 H GLU 49 -0.585 -3.324 -3.270
353 HA GLU 49 HA GLU 49 0.783 -5.931 -3.262
354 HB2 GLU 49 1HB GLU 49 -1.190 -5.956 -4.679
355 HB3 GLU 49 2HB GLU 49 -0.688 -4.469 -5.457
356 HG2 GLU 49 1HG GLU 49 1.284 -5.661 -6.350
357 HG3 GLU 49 2HG GLU 49 0.634 -7.155 -5.669
358 H PHE 50 H PHE 50 2.829 -5.963 -4.421
359 HA PHE 50 HA PHE 50 3.963 -3.527 -5.411
360 HB2 PHE 50 1HB PHE 50 5.688 -3.365 -3.550
361 HB3 PHE 50 2HB PHE 50 4.061 -2.841 -3.139
362 HD1 PHE 50 HD1 PHE 50 6.709 -5.206 -2.439
363 HD2 PHE 50 HD2 PHE 50 2.613 -4.281 -1.752
364 HE1 PHE 50 HE1 PHE 50 6.673 -6.761 -0.539
365 HE2 PHE 50 HE2 PHE 50 2.574 -5.837 0.147
366 HZ PHE 50 HZ PHE 50 4.608 -7.079 0.756
367 H GLU 51 H GLU 51 6.464 -3.769 -5.455
368 HA GLU 51 HA GLU 51 7.211 -6.574 -5.974
369 HB2 GLU 51 1HB GLU 51 6.955 -5.312 -8.078
370 HB3 GLU 51 2HB GLU 51 8.080 -4.097 -7.488
371 HG2 GLU 51 1HG GLU 51 9.197 -5.546 -9.039
372 HG3 GLU 51 2HG GLU 51 9.848 -5.802 -7.422
373 H ILE 52 H ILE 52 8.676 -7.179 -4.508
374 HA ILE 52 HA ILE 52 9.983 -5.222 -2.879
375 HB ILE 52 HB ILE 52 10.336 -8.219 -2.897
376 HG12 ILE 52 1HG1 ILE 52 8.669 -6.432 -1.119
377 HG13 ILE 52 2HG1 ILE 52 8.039 -7.489 -2.376
378 HG21 ILE 52 1HG2 ILE 52 11.152 -6.160 -0.848
379 HG22 ILE 52 2HG2 ILE 52 12.243 -7.050 -1.909
380 HG23 ILE 52 3HG2 ILE 52 11.316 -7.909 -0.676
381 HD11 ILE 52 1HD1 ILE 52 8.892 -9.429 -1.149
382 HD12 ILE 52 2HD1 ILE 52 7.751 -8.484 -0.193
383 HD13 ILE 52 3HD1 ILE 52 9.480 -8.353 0.120
384 H GLY 53 H GLY 53 11.686 -4.171 -3.503
385 HA2 GLY 53 1HA GLY 53 13.849 -5.650 -4.870
386 HA3 GLY 53 2HA GLY 53 13.579 -3.920 -5.046
387 H GLU 54 H GLU 54 15.694 -3.441 -4.320
388 HA GLU 54 HA GLU 54 15.932 -3.662 -1.409
389 HB2 GLU 54 1HB GLU 54 17.428 -5.304 -2.431
390 HB3 GLU 54 2HB GLU 54 18.165 -4.041 -3.402
391 HG2 GLU 54 1HG GLU 54 19.089 -2.995 -1.464
392 HG3 GLU 54 2HG GLU 54 18.207 -4.088 -0.398
393 H GLY 55 H GLY 55 16.030 -1.777 -0.510
394 HA2 GLY 55 1HA GLY 55 16.914 0.532 -2.114
395 HA3 GLY 55 2HA GLY 55 15.727 0.607 -0.819
396 H ALA 56 H ALA 56 17.048 2.302 0.064
397 HA ALA 56 HA ALA 56 19.724 2.016 0.802
398 HB1 ALA 56 1HB ALA 56 17.606 3.703 2.119
399 HB2 ALA 56 2HB ALA 56 18.558 4.160 0.706
400 HB3 ALA 56 3HB ALA 56 19.350 3.920 2.264
401 H LYS 57 H LYS 57 16.778 1.059 2.496
402 HA LYS 57 HA LYS 57 18.473 -0.107 4.600
403 HB2 LYS 57 1HB LYS 57 15.784 1.219 4.951
404 HB3 LYS 57 2HB LYS 57 16.635 0.337 6.208
405 HG2 LYS 57 1HG LYS 57 17.588 2.846 4.845
406 HG3 LYS 57 2HG LYS 57 16.926 2.727 6.476
407 HD2 LYS 57 1HD LYS 57 18.798 1.220 7.078
408 HD3 LYS 57 2HD LYS 57 19.478 1.469 5.469
409 HE2 LYS 57 1HE LYS 57 20.596 2.927 7.016
410 HE3 LYS 57 2HE LYS 57 19.588 3.899 5.945
411 HZ1 LYS 57 1HZ LYS 57 17.920 4.021 7.683
412 HZ2 LYS 57 2HZ LYS 57 19.400 4.610 8.248
413 HZ3 LYS 57 3HZ LYS 57 18.873 3.071 8.708
414 H GLY 58 H GLY 58 17.965 -1.706 2.555
415 HA2 GLY 58 1HA GLY 58 17.489 -4.030 2.719
416 HA3 GLY 58 2HA GLY 58 16.209 -3.655 3.861
417 HA PRO 59 HA PRO 59 14.147 -4.779 -0.075
418 HB2 PRO 59 1HB PRO 59 11.790 -5.449 1.163
419 HB3 PRO 59 2HB PRO 59 13.125 -6.567 0.890
420 HG2 PRO 59 1HG PRO 59 12.397 -5.050 3.352
421 HG3 PRO 59 2HG PRO 59 12.964 -6.721 3.192
422 HD2 PRO 59 1HD PRO 59 14.598 -4.741 3.977
423 HD3 PRO 59 2HD PRO 59 15.176 -6.082 2.967
424 H GLN 60 H GLN 60 13.060 -3.436 -1.325
425 HA GLN 60 HA GLN 60 11.532 -1.258 -0.055
426 HB2 GLN 60 1HB GLN 60 12.155 0.191 -1.885
427 HB3 GLN 60 2HB GLN 60 13.619 -0.503 -1.198
428 HG2 GLN 60 1HG GLN 60 13.669 -2.154 -3.014
429 HG3 GLN 60 2HG GLN 60 12.231 -1.413 -3.707
430 HE21 GLN 60 1HE2 GLN 60 13.179 1.287 -2.977
431 HE22 GLN 60 2HE2 GLN 60 14.404 1.664 -4.135
432 H ALA 61 H ALA 61 9.510 -0.852 -0.796
433 HA ALA 61 HA ALA 61 8.324 -2.832 -2.548
434 HB1 ALA 61 1HB ALA 61 7.117 -2.142 -0.545
435 HB2 ALA 61 2HB ALA 61 6.204 -1.723 -1.995
436 HB3 ALA 61 3HB ALA 61 7.091 -0.476 -1.120
437 H GLN 62 H GLN 62 8.645 -2.569 -4.649
438 HA GLN 62 HA GLN 62 8.609 0.143 -5.783
439 HB2 GLN 62 1HB GLN 62 9.463 -2.428 -7.112
440 HB3 GLN 62 2HB GLN 62 9.729 -0.793 -7.698
441 HG2 GLN 62 1HG GLN 62 11.211 -0.358 -5.809
442 HG3 GLN 62 2HG GLN 62 10.948 -1.999 -5.226
443 HE21 GLN 62 1HE2 GLN 62 11.757 -3.738 -6.451
444 HE22 GLN 62 2HE2 GLN 62 13.061 -3.518 -7.562
445 H GLN 63 H GLN 63 7.280 0.605 -7.579
446 HA GLN 63 HA GLN 63 5.300 0.613 -8.695
447 HB2 GLN 63 1HB GLN 63 6.038 -2.300 -8.943
448 HB3 GLN 63 2HB GLN 63 4.660 -1.592 -9.766
449 HG2 GLN 63 1HG GLN 63 6.274 -1.556 -11.398
450 HG3 GLN 63 2HG GLN 63 6.395 0.067 -10.725
451 HE21 GLN 63 1HE2 GLN 63 8.246 0.671 -9.664
452 HE22 GLN 63 2HE2 GLN 63 9.667 -0.307 -9.612
453 H VAL 64 H VAL 64 4.737 0.874 -6.206
454 HA VAL 64 HA VAL 64 3.322 -1.311 -5.013
455 HB VAL 64 HB VAL 64 3.180 1.542 -4.088
456 HG11 VAL 64 1HG1 VAL 64 1.740 0.059 -2.903
457 HG12 VAL 64 2HG1 VAL 64 3.114 0.438 -1.863
458 HG13 VAL 64 3HG1 VAL 64 3.038 -1.114 -2.693
459 HG21 VAL 64 1HG2 VAL 64 5.526 1.084 -4.514
460 HG22 VAL 64 2HG2 VAL 64 5.419 -0.409 -3.579
461 HG23 VAL 64 3HG2 VAL 64 5.216 1.150 -2.779
462 H HIS 65 H HIS 65 1.287 -1.838 -5.282
463 HA HIS 65 HA HIS 65 -0.579 0.141 -6.435
464 HB2 HIS 65 1HB HIS 65 -0.834 -2.863 -6.634
465 HB3 HIS 65 2HB HIS 65 -1.764 -1.656 -7.500
466 HD1 HIS 65 HD1 HIS 65 0.269 -4.100 -8.501
467 HD2 HIS 65 HD2 HIS 65 0.715 0.024 -8.818
468 HE1 HIS 65 HE1 HIS 65 1.851 -3.727 -10.425
469 HE2 HIS 65 HE2 HIS 65 2.030 -1.229 -10.664
470 H ALA 66 H ALA 66 -2.166 0.726 -5.065
471 HA ALA 66 HA ALA 66 -2.378 -0.560 -2.515
472 HB1 ALA 66 1HB ALA 66 -4.096 1.609 -3.710
473 HB2 ALA 66 2HB ALA 66 -2.633 1.864 -2.759
474 HB3 ALA 66 3HB ALA 66 -4.052 1.128 -2.013
475 H LEU 67 H LEU 67 -3.733 -2.088 -1.883
476 HA LEU 67 HA LEU 67 -5.720 -3.072 -3.797
477 HB2 LEU 67 1HB LEU 67 -4.628 -4.304 -1.266
478 HB3 LEU 67 2HB LEU 67 -5.799 -5.064 -2.321
479 HG LEU 67 HG LEU 67 -2.938 -4.399 -3.012
480 HD11 LEU 67 1HD1 LEU 67 -3.180 -6.301 -1.503
481 HD12 LEU 67 2HD1 LEU 67 -2.654 -6.821 -3.104
482 HD13 LEU 67 3HD1 LEU 67 -4.334 -7.042 -2.611
483 HD21 LEU 67 1HD2 LEU 67 -4.354 -4.130 -4.960
484 HD22 LEU 67 2HD2 LEU 67 -5.094 -5.704 -4.668
485 HD23 LEU 67 3HD2 LEU 67 -3.388 -5.598 -5.108
486 H GLY 68 H GLY 68 -5.369 -1.753 -0.579
487 HA2 GLY 68 1HA GLY 68 -8.157 -2.111 0.088
488 HA3 GLY 68 2HA GLY 68 -6.956 -1.252 1.041
489 H GLY 69 H GLY 69 -8.598 -0.938 -2.101
490 HA2 GLY 69 1HA GLY 69 -9.676 1.628 -1.374
491 HA3 GLY 69 2HA GLY 69 -8.372 1.743 -2.549
492 H GLU 70 H GLU 70 -8.612 0.154 -4.423
493 HA GLU 70 HA GLU 70 -11.201 0.552 -5.622
494 HB2 GLU 70 1HB GLU 70 -8.718 -0.856 -6.615
495 HB3 GLU 70 2HB GLU 70 -10.162 -0.582 -7.582
496 HG2 GLU 70 1HG GLU 70 -9.841 1.749 -7.582
497 HG3 GLU 70 2HG GLU 70 -8.632 1.661 -6.303
498 H ASN 71 H ASN 71 -11.922 -0.810 -3.622
499 HA ASN 71 HA ASN 71 -12.909 -3.296 -4.591
500 HB2 ASN 71 1HB ASN 71 -10.597 -3.980 -3.924
501 HB3 ASN 71 2HB ASN 71 -10.928 -3.417 -2.292
502 HD21 ASN 71 1HD2 ASN 71 -10.536 -5.468 -1.450
503 HD22 ASN 71 2HD2 ASN 71 -11.665 -6.765 -1.630
504 H LEU 72 H LEU 72 -14.292 -4.335 -2.816
505 HA LEU 72 HA LEU 72 -15.939 -2.408 -1.627
506 HB2 LEU 72 1HB LEU 72 -15.605 -5.347 -1.030
507 HB3 LEU 72 2HB LEU 72 -16.832 -4.353 -0.274
508 HG LEU 72 HG LEU 72 -17.695 -3.850 -2.613
509 HD11 LEU 72 1HD1 LEU 72 -15.754 -4.504 -3.900
510 HD12 LEU 72 2HD1 LEU 72 -17.143 -5.492 -4.352
511 HD13 LEU 72 3HD1 LEU 72 -15.890 -6.160 -3.308
512 HD21 LEU 72 1HD2 LEU 72 -17.779 -6.689 -1.611
513 HD22 LEU 72 2HD2 LEU 72 -18.901 -5.978 -2.771
514 HD23 LEU 72 3HD2 LEU 72 -18.840 -5.369 -1.117
515 H TYR 73 H TYR 73 -13.684 -4.653 -0.039
516 HA TYR 73 HA TYR 73 -12.285 -4.441 1.725
517 HB2 TYR 73 1HB TYR 73 -11.657 -2.420 0.205
518 HB3 TYR 73 2HB TYR 73 -12.422 -1.454 1.461
519 HD1 TYR 73 HD1 TYR 73 -10.180 -4.433 1.557
520 HD2 TYR 73 HD2 TYR 73 -10.793 -0.388 2.720
521 HE1 TYR 73 HE1 TYR 73 -8.069 -4.480 2.807
522 HE2 TYR 73 HE2 TYR 73 -8.680 -0.425 3.981
523 HH TYR 73 HH TYR 73 -7.131 -1.973 4.973
524 H PHE 74 H PHE 74 -14.113 -5.198 3.015
525 HA PHE 74 HA PHE 74 -15.605 -3.252 4.542
526 HB2 PHE 74 1HB PHE 74 -15.501 -6.268 4.677
527 HB3 PHE 74 2HB PHE 74 -16.556 -5.272 5.673
528 HD1 PHE 74 HD1 PHE 74 -16.134 -6.901 2.521
529 HD2 PHE 74 HD2 PHE 74 -18.245 -3.794 4.513
530 HE1 PHE 74 HE1 PHE 74 -17.825 -6.912 0.737
531 HE2 PHE 74 HE2 PHE 74 -19.940 -3.795 2.733
532 HZ PHE 74 HZ PHE 74 -19.730 -5.356 0.843
533 H GLN 75 H GLN 75 -13.382 -2.399 5.237
534 HA GLN 75 HA GLN 75 -12.246 -3.875 7.480
535 HB2 GLN 75 1HB GLN 75 -10.803 -2.779 5.727
536 HB3 GLN 75 2HB GLN 75 -11.358 -1.224 6.324
537 HG2 GLN 75 1HG GLN 75 -9.182 -1.751 7.226
538 HG3 GLN 75 2HG GLN 75 -10.386 -1.713 8.513
539 HE21 GLN 75 1HE2 GLN 75 -10.032 -4.360 6.255
540 HE22 GLN 75 2HE2 GLN 75 -9.440 -5.510 7.400
541 H GLY 76 H GLY 76 -14.824 -3.099 7.973
542 HA2 GLY 76 1HA GLY 76 -14.759 -0.651 9.541
543 HA3 GLY 76 2HA GLY 76 -16.145 -1.708 9.313
544 H HIS 77 H HIS 77 -15.256 -4.105 10.111
545 HA HIS 77 HA HIS 77 -14.869 -5.450 11.890
546 HB2 HIS 77 1HB HIS 77 -12.589 -4.338 11.627
547 HB3 HIS 77 2HB HIS 77 -13.053 -3.290 12.958
548 HD1 HIS 77 HD1 HIS 77 -12.650 -7.006 12.267
549 HD2 HIS 77 HD2 HIS 77 -12.421 -4.288 15.401
550 HE1 HIS 77 HE1 HIS 77 -11.785 -8.311 14.232
551 HE2 HIS 77 HE2 HIS 77 -11.442 -6.589 16.041
552 H HIS 78 H HIS 78 -17.068 -3.589 11.987
553 HA HIS 78 HA HIS 78 -17.219 -2.937 14.846
554 HB2 HIS 78 1HB HIS 78 -19.006 -2.086 12.559
555 HB3 HIS 78 2HB HIS 78 -19.236 -1.625 14.238
556 HD1 HIS 78 HD1 HIS 78 -16.942 -0.359 15.261
557 HD2 HIS 78 HD2 HIS 78 -17.646 -0.224 11.165
558 HE1 HIS 78 HE1 HIS 78 -15.572 1.563 14.400
559 HE2 HIS 78 HE2 HIS 78 -15.899 1.536 11.904
560 H HIS 79 H HIS 79 -18.593 -4.958 12.373
561 HA HIS 79 HA HIS 79 -20.688 -5.893 14.188
562 HB2 HIS 79 1HB HIS 79 -20.155 -6.504 11.275
563 HB3 HIS 79 2HB HIS 79 -21.475 -7.199 12.209
564 HD1 HIS 79 HD1 HIS 79 -20.904 -4.624 9.871
565 HD2 HIS 79 HD2 HIS 79 -23.088 -4.884 13.397
566 HE1 HIS 79 HE1 HIS 79 -22.578 -2.757 9.767
567 HE2 HIS 79 HE2 HIS 79 -23.965 -3.007 11.854
568 H HIS 80 H HIS 80 -18.847 -6.747 15.547
569 HA HIS 80 HA HIS 80 -17.539 -9.100 14.472
570 HB2 HIS 80 1HB HIS 80 -16.402 -7.402 15.994
571 HB3 HIS 80 2HB HIS 80 -17.355 -8.088 17.307
572 HD1 HIS 80 HD1 HIS 80 -16.214 -9.908 18.542
573 HD2 HIS 80 HD2 HIS 80 -14.817 -9.557 14.642
574 HE1 HIS 80 HE1 HIS 80 -14.382 -11.614 18.323
575 HE2 HIS 80 HE2 HIS 80 -13.461 -11.291 15.999
576 H HIS 81 H HIS 81 -20.104 -8.297 16.741
577 HA HIS 81 HA HIS 81 -21.013 -11.041 16.477
578 HB2 HIS 81 1HB HIS 81 -21.324 -11.438 18.847
579 HB3 HIS 81 2HB HIS 81 -19.633 -11.108 18.513
580 HD1 HIS 81 HD1 HIS 81 -18.592 -9.045 19.625
581 HD2 HIS 81 HD2 HIS 81 -22.651 -9.499 20.397
582 HE1 HIS 81 HE1 HIS 81 -19.112 -7.436 21.480
583 HE2 HIS 81 HE2 HIS 81 -21.494 -7.944 22.108
584 H HIS 82 H HIS 82 -21.738 -8.056 15.974
585 HA HIS 82 HA HIS 82 -24.503 -8.515 15.852
586 HB2 HIS 82 1HB HIS 82 -25.388 -6.914 17.422
587 HB3 HIS 82 2HB HIS 82 -24.374 -8.048 18.301
588 HD1 HIS 82 HD1 HIS 82 -24.763 -4.460 17.503
589 HD2 HIS 82 HD2 HIS 82 -21.931 -6.932 19.269
590 HE1 HIS 82 HE1 HIS 82 -23.194 -2.924 18.724
591 HE2 HIS 82 HE2 HIS 82 -21.612 -4.459 19.942
Start of MODEL 14
1 H2 MET 1 2H MET 1 3.790 -8.816 -7.601
2 H MET 1 1H MET 1 3.897 -9.697 -9.038
3 H3 MET 1 3H MET 1 2.759 -10.130 -7.864
4 HA MET 1 HA MET 1 4.574 -11.657 -7.805
5 HB2 MET 1 1HB MET 1 6.225 -9.160 -7.397
6 HB3 MET 1 2HB MET 1 6.819 -10.776 -7.045
7 HG2 MET 1 1HG MET 1 6.510 -11.410 -9.374
8 HG3 MET 1 2HG MET 1 5.882 -9.804 -9.733
9 HE1 MET 1 1HE MET 1 9.024 -11.888 -8.648
10 HE2 MET 1 2HE MET 1 8.920 -10.708 -7.344
11 HE3 MET 1 3HE MET 1 10.256 -10.639 -8.491
12 H ALA 2 H ALA 2 5.009 -8.836 -5.644
13 HA ALA 2 HA ALA 2 4.460 -10.650 -3.400
14 HB1 ALA 2 1HB ALA 2 5.903 -8.004 -3.381
15 HB2 ALA 2 2HB ALA 2 6.670 -9.593 -3.362
16 HB3 ALA 2 3HB ALA 2 5.675 -9.075 -1.999
17 H GLN 3 H GLN 3 3.243 -9.884 -1.639
18 HA GLN 3 HA GLN 3 1.547 -7.555 -2.086
19 HB2 GLN 3 1HB GLN 3 0.521 -10.326 -1.456
20 HB3 GLN 3 2HB GLN 3 -0.442 -8.863 -1.331
21 HG2 GLN 3 1HG GLN 3 -0.196 -8.481 -3.714
22 HG3 GLN 3 2HG GLN 3 0.806 -9.926 -3.851
23 HE21 GLN 3 1HE2 GLN 3 -2.387 -8.695 -3.367
24 HE22 GLN 3 2HE2 GLN 3 -3.226 -10.182 -3.598
25 H GLY 4 H GLY 4 0.248 -7.151 -0.029
26 HA2 GLY 4 1HA GLY 4 0.842 -8.362 2.393
27 HA3 GLY 4 2HA GLY 4 2.033 -7.091 2.164
28 H THR 5 H THR 5 1.007 -6.324 4.144
29 HA THR 5 HA THR 5 -1.216 -4.524 3.454
30 HB THR 5 HB THR 5 -0.793 -5.698 6.205
31 HG1 THR 5 HG1 THR 5 -1.366 -7.345 4.652
32 HG21 THR 5 1HG2 THR 5 -3.088 -4.920 6.574
33 HG22 THR 5 2HG2 THR 5 -3.140 -4.294 4.926
34 HG23 THR 5 3HG2 THR 5 -2.029 -3.589 6.103
35 H VAL 6 H VAL 6 -0.612 -2.460 3.642
36 HA VAL 6 HA VAL 6 1.919 -1.741 4.643
37 HB VAL 6 HB VAL 6 1.140 -0.275 3.021
38 HG11 VAL 6 1HG1 VAL 6 -1.182 -0.854 3.022
39 HG12 VAL 6 2HG1 VAL 6 -1.028 0.897 3.152
40 HG13 VAL 6 3HG1 VAL 6 -1.418 -0.060 4.578
41 HG21 VAL 6 1HG2 VAL 6 0.954 1.916 4.088
42 HG22 VAL 6 2HG2 VAL 6 2.196 0.929 4.866
43 HG23 VAL 6 3HG2 VAL 6 0.621 1.135 5.636
44 H LYS 7 H LYS 7 2.558 -1.680 6.596
45 HA LYS 7 HA LYS 7 0.867 -1.964 8.842
46 HB2 LYS 7 1HB LYS 7 3.207 -2.811 8.645
47 HB3 LYS 7 2HB LYS 7 3.775 -1.151 8.726
48 HG2 LYS 7 1HG LYS 7 2.704 -0.961 10.959
49 HG3 LYS 7 2HG LYS 7 2.338 -2.683 10.875
50 HD2 LYS 7 1HD LYS 7 5.073 -1.417 10.821
51 HD3 LYS 7 2HD LYS 7 4.365 -2.334 12.150
52 HE2 LYS 7 1HE LYS 7 4.250 -4.309 10.652
53 HE3 LYS 7 2HE LYS 7 5.085 -3.371 9.414
54 HZ1 LYS 7 1HZ LYS 7 6.897 -3.062 11.104
55 HZ2 LYS 7 2HZ LYS 7 6.723 -4.634 10.501
56 HZ3 LYS 7 3HZ LYS 7 6.131 -4.244 12.042
57 H TRP 8 H TRP 8 2.691 0.655 7.434
58 HA TRP 8 HA TRP 8 0.879 2.639 8.318
59 HB2 TRP 8 1HB TRP 8 2.405 3.924 9.750
60 HB3 TRP 8 2HB TRP 8 2.074 2.346 10.451
61 HD1 TRP 8 HD1 TRP 8 4.091 0.659 10.681
62 HE1 TRP 8 HE1 TRP 8 6.641 0.955 10.517
63 HE3 TRP 8 HE3 TRP 8 4.233 5.247 8.434
64 HZ2 TRP 8 HZ2 TRP 8 8.465 2.880 9.567
65 HZ3 TRP 8 HZ3 TRP 8 6.424 6.241 7.930
66 HH2 TRP 8 HH2 TRP 8 8.493 5.078 8.484
67 H PHE 9 H PHE 9 1.384 4.695 7.391
68 HA PHE 9 HA PHE 9 3.770 4.774 5.711
69 HB2 PHE 9 1HB PHE 9 1.818 3.972 4.338
70 HB3 PHE 9 2HB PHE 9 1.046 5.525 4.638
71 HD1 PHE 9 HD1 PHE 9 1.629 7.436 3.382
72 HD2 PHE 9 HD2 PHE 9 3.973 3.897 3.104
73 HE1 PHE 9 HE1 PHE 9 2.837 8.389 1.464
74 HE2 PHE 9 HE2 PHE 9 5.188 4.847 1.190
75 HZ PHE 9 HZ PHE 9 4.621 7.095 0.369
76 H ASN 10 H ASN 10 4.728 6.709 5.642
77 HA ASN 10 HA ASN 10 3.383 8.949 6.985
78 HB2 ASN 10 1HB ASN 10 5.623 8.206 7.829
79 HB3 ASN 10 2HB ASN 10 6.308 8.641 6.270
80 HD21 ASN 10 1HD2 ASN 10 6.801 9.650 8.996
81 HD22 ASN 10 2HD2 ASN 10 6.574 11.360 8.893
82 H ALA 11 H ALA 11 2.318 10.181 5.601
83 HA ALA 11 HA ALA 11 2.777 10.029 2.798
84 HB1 ALA 11 1HB ALA 11 0.897 11.551 2.603
85 HB2 ALA 11 2HB ALA 11 0.958 11.868 4.336
86 HB3 ALA 11 3HB ALA 11 0.541 10.259 3.747
87 H GLU 12 H GLU 12 3.485 12.466 5.260
88 HA GLU 12 HA GLU 12 4.096 14.475 3.314
89 HB2 GLU 12 1HB GLU 12 4.928 15.790 5.248
90 HB3 GLU 12 2HB GLU 12 3.280 15.211 5.439
91 HG2 GLU 12 1HG GLU 12 4.043 13.449 6.908
92 HG3 GLU 12 2HG GLU 12 5.714 13.944 6.662
93 H LYS 13 H LYS 13 5.883 11.983 4.904
94 HA LYS 13 HA LYS 13 8.419 13.107 3.987
95 HB2 LYS 13 1HB LYS 13 7.896 10.549 5.498
96 HB3 LYS 13 2HB LYS 13 9.469 11.256 5.171
97 HG2 LYS 13 1HG LYS 13 7.308 12.440 6.883
98 HG3 LYS 13 2HG LYS 13 8.794 11.680 7.446
99 HD2 LYS 13 1HD LYS 13 10.102 13.418 6.344
100 HD3 LYS 13 2HD LYS 13 8.617 14.171 5.761
101 HE2 LYS 13 1HE LYS 13 7.898 14.518 8.078
102 HE3 LYS 13 2HE LYS 13 9.401 13.799 8.647
103 HZ1 LYS 13 1HZ LYS 13 10.625 15.585 7.608
104 HZ2 LYS 13 2HZ LYS 13 9.471 16.225 8.664
105 HZ3 LYS 13 3HZ LYS 13 9.198 16.256 6.994
106 H GLY 14 H GLY 14 6.141 10.583 3.292
107 HA2 GLY 14 1HA GLY 14 5.770 9.715 1.159
108 HA3 GLY 14 2HA GLY 14 7.347 10.304 0.664
109 H PHE 15 H PHE 15 7.025 8.404 3.577
110 HA PHE 15 HA PHE 15 7.709 5.975 2.130
111 HB2 PHE 15 1HB PHE 15 9.711 5.505 3.341
112 HB3 PHE 15 2HB PHE 15 9.872 7.116 2.662
113 HD1 PHE 15 HD1 PHE 15 9.895 9.077 4.114
114 HD2 PHE 15 HD2 PHE 15 9.578 5.147 5.719
115 HE1 PHE 15 HE1 PHE 15 10.507 9.935 6.338
116 HE2 PHE 15 HE2 PHE 15 10.184 6.005 7.941
117 HZ PHE 15 HZ PHE 15 10.650 8.399 8.253
118 H GLY 16 H GLY 16 7.743 4.060 3.551
119 HA2 GLY 16 1HA GLY 16 6.575 4.168 6.147
120 HA3 GLY 16 2HA GLY 16 5.375 3.754 4.929
121 H PHE 17 H PHE 17 5.321 1.721 6.263
122 HA PHE 17 HA PHE 17 7.193 -0.174 5.043
123 HB2 PHE 17 1HB PHE 17 6.767 0.237 7.961
124 HB3 PHE 17 2HB PHE 17 6.988 -1.411 7.378
125 HD1 PHE 17 HD1 PHE 17 9.090 -2.135 6.462
126 HD2 PHE 17 HD2 PHE 17 8.569 1.854 7.833
127 HE1 PHE 17 HE1 PHE 17 11.527 -1.810 6.425
128 HE2 PHE 17 HE2 PHE 17 11.005 2.190 7.806
129 HZ PHE 17 HZ PHE 17 12.490 0.355 7.099
130 H ILE 18 H ILE 18 6.328 -1.969 4.341
131 HA ILE 18 HA ILE 18 3.506 -2.506 4.955
132 HB ILE 18 HB ILE 18 5.210 -3.309 2.596
133 HG12 ILE 18 1HG1 ILE 18 2.635 -1.759 2.584
134 HG13 ILE 18 2HG1 ILE 18 4.203 -0.977 2.730
135 HG21 ILE 18 1HG2 ILE 18 3.196 -4.389 1.681
136 HG22 ILE 18 2HG2 ILE 18 2.383 -4.127 3.224
137 HG23 ILE 18 3HG2 ILE 18 3.796 -5.181 3.139
138 HD11 ILE 18 1HD1 ILE 18 3.378 -0.966 0.432
139 HD12 ILE 18 2HD1 ILE 18 3.331 -2.731 0.446
140 HD13 ILE 18 3HD1 ILE 18 4.874 -1.887 0.584
141 H ALA 19 H ALA 19 2.883 -4.514 5.654
142 HA ALA 19 HA ALA 19 5.025 -6.383 6.380
143 HB1 ALA 19 1HB ALA 19 3.335 -7.479 7.773
144 HB2 ALA 19 2HB ALA 19 2.110 -6.357 7.180
145 HB3 ALA 19 3HB ALA 19 3.452 -5.762 8.159
146 HA PRO 20 HA PRO 20 3.759 -8.087 2.324
147 HB2 PRO 20 1HB PRO 20 6.074 -9.799 3.040
148 HB3 PRO 20 2HB PRO 20 5.712 -8.977 1.522
149 HG2 PRO 20 1HG PRO 20 7.579 -8.027 3.152
150 HG3 PRO 20 2HG PRO 20 6.479 -6.931 2.297
151 HD2 PRO 20 1HD PRO 20 6.456 -7.791 5.149
152 HD3 PRO 20 2HD PRO 20 6.075 -6.211 4.446
153 H ASP 21 H ASP 21 2.765 -9.915 1.710
154 HA ASP 21 HA ASP 21 1.668 -11.594 3.743
155 HB2 ASP 21 1HB ASP 21 0.324 -10.929 1.831
156 HB3 ASP 21 2HB ASP 21 1.464 -11.689 0.729
157 H ASP 22 H ASP 22 4.505 -11.646 1.980
158 HA ASP 22 HA ASP 22 4.794 -14.498 1.739
159 HB2 ASP 22 1HB ASP 22 5.808 -12.758 0.182
160 HB3 ASP 22 2HB ASP 22 6.983 -12.447 1.453
161 H GLY 23 H GLY 23 4.401 -13.222 4.411
162 HA2 GLY 23 1HA GLY 23 5.043 -14.312 6.436
163 HA3 GLY 23 2HA GLY 23 6.627 -14.606 5.735
164 H SER 24 H SER 24 5.350 -11.516 5.217
165 HA SER 24 HA SER 24 5.938 -9.450 5.875
166 HB2 SER 24 1HB SER 24 5.710 -9.025 8.332
167 HB3 SER 24 2HB SER 24 4.352 -9.880 7.604
168 HG SER 24 HG SER 24 6.287 -11.572 8.535
169 H ALA 25 H ALA 25 8.081 -9.687 4.948
170 HA ALA 25 HA ALA 25 10.273 -9.932 6.825
171 HB1 ALA 25 1HB ALA 25 11.712 -9.522 4.899
172 HB2 ALA 25 2HB ALA 25 10.299 -9.148 3.913
173 HB3 ALA 25 3HB ALA 25 10.529 -10.781 4.541
174 H ASP 26 H ASP 26 8.091 -7.642 6.241
175 HA ASP 26 HA ASP 26 7.849 -5.425 6.579
176 HB2 ASP 26 1HB ASP 26 10.550 -5.649 7.918
177 HB3 ASP 26 2HB ASP 26 9.496 -4.241 7.996
178 H VAL 27 H VAL 27 7.815 -4.643 4.575
179 HA VAL 27 HA VAL 27 10.386 -4.114 3.268
180 HB VAL 27 HB VAL 27 8.798 -5.585 2.067
181 HG11 VAL 27 1HG1 VAL 27 7.085 -3.121 1.913
182 HG12 VAL 27 2HG1 VAL 27 6.708 -4.613 2.779
183 HG13 VAL 27 3HG1 VAL 27 6.814 -4.616 1.017
184 HG21 VAL 27 1HG2 VAL 27 9.407 -2.953 0.746
185 HG22 VAL 27 2HG2 VAL 27 8.949 -4.434 -0.099
186 HG23 VAL 27 3HG2 VAL 27 10.456 -4.371 0.821
187 H PHE 28 H PHE 28 10.974 -2.132 2.686
188 HA PHE 28 HA PHE 28 9.664 0.103 3.915
189 HB2 PHE 28 1HB PHE 28 12.075 -0.025 3.912
190 HB3 PHE 28 2HB PHE 28 12.109 -0.153 2.160
191 HD1 PHE 28 HD1 PHE 28 12.047 1.768 0.785
192 HD2 PHE 28 HD2 PHE 28 11.465 2.121 4.986
193 HE1 PHE 28 HE1 PHE 28 12.310 4.205 0.612
194 HE2 PHE 28 HE2 PHE 28 11.727 4.561 4.819
195 HZ PHE 28 HZ PHE 28 12.148 5.605 2.629
196 H VAL 29 H VAL 29 8.269 1.483 2.995
197 HA VAL 29 HA VAL 29 7.737 1.169 0.126
198 HB VAL 29 HB VAL 29 6.060 2.867 1.927
199 HG11 VAL 29 1HG1 VAL 29 5.424 1.167 -0.477
200 HG12 VAL 29 2HG1 VAL 29 5.646 2.917 -0.472
201 HG13 VAL 29 3HG1 VAL 29 4.287 2.198 0.391
202 HG21 VAL 29 1HG2 VAL 29 6.315 0.776 3.133
203 HG22 VAL 29 2HG2 VAL 29 5.840 -0.123 1.692
204 HG23 VAL 29 3HG2 VAL 29 4.680 0.941 2.491
205 H HIS 30 H HIS 30 7.749 2.887 -1.273
206 HA HIS 30 HA HIS 30 8.668 5.476 -0.256
207 HB2 HIS 30 1HB HIS 30 10.568 4.035 -1.135
208 HB3 HIS 30 2HB HIS 30 9.810 4.143 -2.717
209 HD1 HIS 30 HD1 HIS 30 11.519 5.486 -3.912
210 HD2 HIS 30 HD2 HIS 30 10.344 7.235 -0.324
211 HE1 HIS 30 HE1 HIS 30 12.637 7.747 -3.853
212 HE2 HIS 30 HE2 HIS 30 11.798 8.839 -1.744
213 H TYR 31 H TYR 31 7.490 7.105 -1.077
214 HA TYR 31 HA TYR 31 5.075 6.497 -2.303
215 HB2 TYR 31 1HB TYR 31 4.564 8.794 -2.222
216 HB3 TYR 31 2HB TYR 31 5.613 8.487 -0.846
217 HD1 TYR 31 HD1 TYR 31 8.104 9.078 -1.107
218 HD2 TYR 31 HD2 TYR 31 5.081 10.463 -3.758
219 HE1 TYR 31 HE1 TYR 31 9.585 10.895 -1.839
220 HE2 TYR 31 HE2 TYR 31 6.556 12.279 -4.502
221 HH TYR 31 HH TYR 31 9.846 12.352 -3.868
222 H SER 32 H SER 32 8.085 7.366 -3.827
223 HA SER 32 HA SER 32 6.941 8.210 -6.296
224 HB2 SER 32 1HB SER 32 9.295 7.847 -7.157
225 HB3 SER 32 2HB SER 32 9.159 8.950 -5.786
226 HG SER 32 HG SER 32 10.119 6.293 -5.861
227 H GLU 33 H GLU 33 7.619 5.163 -4.857
228 HA GLU 33 HA GLU 33 7.460 3.741 -7.387
229 HB2 GLU 33 1HB GLU 33 8.050 2.927 -4.559
230 HB3 GLU 33 2HB GLU 33 7.624 1.723 -5.763
231 HG2 GLU 33 1HG GLU 33 10.016 1.861 -5.551
232 HG3 GLU 33 2HG GLU 33 9.525 2.437 -7.140
233 H ILE 34 H ILE 34 5.376 4.912 -5.025
234 HA ILE 34 HA ILE 34 3.443 2.828 -5.036
235 HB ILE 34 HB ILE 34 3.175 5.730 -4.259
236 HG12 ILE 34 1HG1 ILE 34 3.459 3.209 -2.612
237 HG13 ILE 34 2HG1 ILE 34 4.693 4.443 -2.835
238 HG21 ILE 34 1HG2 ILE 34 1.228 3.460 -3.860
239 HG22 ILE 34 2HG2 ILE 34 1.003 4.859 -4.912
240 HG23 ILE 34 3HG2 ILE 34 1.077 5.074 -3.162
241 HD11 ILE 34 1HD1 ILE 34 3.633 4.694 -0.685
242 HD12 ILE 34 2HD1 ILE 34 2.048 4.792 -1.452
243 HD13 ILE 34 3HD1 ILE 34 3.233 6.068 -1.715
244 H GLN 35 H GLN 35 1.774 2.464 -6.287
245 HA GLN 35 HA GLN 35 1.430 4.186 -8.645
246 HB2 GLN 35 1HB GLN 35 0.744 1.260 -8.326
247 HB3 GLN 35 2HB GLN 35 0.695 2.195 -9.813
248 HG2 GLN 35 1HG GLN 35 3.175 1.609 -8.222
249 HG3 GLN 35 2HG GLN 35 2.657 0.727 -9.654
250 HE21 GLN 35 1HE2 GLN 35 5.077 2.310 -9.107
251 HE22 GLN 35 2HE2 GLN 35 5.153 3.484 -10.371
252 H GLY 36 H GLY 36 -0.466 5.232 -8.792
253 HA2 GLY 36 1HA GLY 36 -2.900 4.017 -7.791
254 HA3 GLY 36 2HA GLY 36 -2.392 5.467 -6.936
255 H ASN 37 H ASN 37 -4.769 5.698 -8.018
256 HA ASN 37 HA ASN 37 -4.503 6.801 -10.715
257 HB2 ASN 37 1HB ASN 37 -6.942 6.863 -10.752
258 HB3 ASN 37 2HB ASN 37 -6.388 5.268 -10.262
259 HD21 ASN 37 1HD2 ASN 37 -8.951 6.553 -9.826
260 HD22 ASN 37 2HD2 ASN 37 -9.193 6.587 -8.115
261 H GLY 38 H GLY 38 -3.163 8.261 -8.816
262 HA2 GLY 38 1HA GLY 38 -3.183 10.727 -8.832
263 HA3 GLY 38 2HA GLY 38 -4.898 10.628 -8.449
264 H PHE 39 H PHE 39 -3.010 8.280 -6.926
265 HA PHE 39 HA PHE 39 -2.592 9.898 -4.525
266 HB2 PHE 39 1HB PHE 39 -4.141 7.322 -4.694
267 HB3 PHE 39 2HB PHE 39 -3.352 7.817 -3.204
268 HD1 PHE 39 HD1 PHE 39 -4.098 9.829 -2.017
269 HD2 PHE 39 HD2 PHE 39 -6.157 8.351 -5.436
270 HE1 PHE 39 HE1 PHE 39 -6.066 11.170 -1.405
271 HE2 PHE 39 HE2 PHE 39 -8.128 9.695 -4.834
272 HZ PHE 39 HZ PHE 39 -8.086 11.105 -2.817
273 H ARG 40 H ARG 40 -0.467 9.759 -4.143
274 HA ARG 40 HA ARG 40 0.805 7.127 -4.462
275 HB2 ARG 40 1HB ARG 40 2.038 9.878 -4.306
276 HB3 ARG 40 2HB ARG 40 2.963 8.383 -4.293
277 HG2 ARG 40 1HG ARG 40 1.912 7.827 -6.501
278 HG3 ARG 40 2HG ARG 40 1.261 9.468 -6.517
279 HD2 ARG 40 1HD ARG 40 3.528 10.364 -6.352
280 HD3 ARG 40 2HD ARG 40 4.176 8.727 -6.338
281 HE ARG 40 HE ARG 40 2.931 10.083 -8.629
282 HH11 ARG 40 1HH1 ARG 40 4.641 7.331 -7.318
283 HH12 ARG 40 2HH1 ARG 40 5.236 6.800 -8.856
284 HH21 ARG 40 1HH2 ARG 40 3.698 9.379 -10.665
285 HH22 ARG 40 2HH2 ARG 40 4.686 7.955 -10.766
286 H THR 41 H THR 41 -0.830 7.294 -2.414
287 HA THR 41 HA THR 41 0.957 7.305 -0.108
288 HB THR 41 HB THR 41 -1.010 8.249 1.238
289 HG1 THR 41 HG1 THR 41 -1.882 9.771 -0.840
290 HG21 THR 41 1HG2 THR 41 -0.360 10.569 0.772
291 HG22 THR 41 2HG2 THR 41 0.437 10.039 -0.712
292 HG23 THR 41 3HG2 THR 41 1.041 9.501 0.855
293 H LEU 42 H LEU 42 0.446 5.801 1.448
294 HA LEU 42 HA LEU 42 -1.674 3.904 0.722
295 HB2 LEU 42 1HB LEU 42 0.930 3.489 2.181
296 HB3 LEU 42 2HB LEU 42 -0.331 2.278 2.094
297 HG LEU 42 HG LEU 42 1.218 3.396 -0.234
298 HD11 LEU 42 1HD1 LEU 42 1.210 0.634 0.965
299 HD12 LEU 42 2HD1 LEU 42 2.463 1.848 1.224
300 HD13 LEU 42 3HD1 LEU 42 2.186 1.200 -0.391
301 HD21 LEU 42 1HD2 LEU 42 -1.019 2.916 -0.962
302 HD22 LEU 42 2HD2 LEU 42 -1.006 1.363 -0.128
303 HD23 LEU 42 3HD2 LEU 42 0.040 1.623 -1.526
304 H GLU 43 H GLU 43 -2.945 3.032 2.377
305 HA GLU 43 HA GLU 43 -3.209 4.842 4.654
306 HB2 GLU 43 1HB GLU 43 -5.139 2.763 3.618
307 HB3 GLU 43 2HB GLU 43 -5.463 3.940 4.881
308 HG2 GLU 43 1HG GLU 43 -5.025 4.447 1.958
309 HG3 GLU 43 2HG GLU 43 -6.496 4.711 2.894
310 H GLU 44 H GLU 44 -3.074 4.143 6.727
311 HA GLU 44 HA GLU 44 -1.547 1.887 7.322
312 HB2 GLU 44 1HB GLU 44 -1.854 3.903 8.766
313 HB3 GLU 44 2HB GLU 44 -3.461 3.315 9.164
314 HG2 GLU 44 1HG GLU 44 -2.414 1.262 10.073
315 HG3 GLU 44 2HG GLU 44 -0.840 2.004 9.805
316 H ASN 45 H ASN 45 -2.023 -0.179 7.547
317 HA ASN 45 HA ASN 45 -3.137 -2.135 7.742
318 HB2 ASN 45 1HB ASN 45 -5.320 -0.377 8.848
319 HB3 ASN 45 2HB ASN 45 -5.486 -2.120 8.701
320 HD21 ASN 45 1HD2 ASN 45 -4.070 0.479 10.427
321 HD22 ASN 45 2HD2 ASN 45 -3.355 -0.455 11.688
322 H GLN 46 H GLN 46 -3.030 -0.764 5.309
323 HA GLN 46 HA GLN 46 -5.533 -1.654 4.037
324 HB2 GLN 46 1HB GLN 46 -4.977 0.730 3.701
325 HB3 GLN 46 2HB GLN 46 -3.439 0.260 2.999
326 HG2 GLN 46 1HG GLN 46 -4.595 -0.863 1.180
327 HG3 GLN 46 2HG GLN 46 -6.147 -0.418 1.884
328 HE21 GLN 46 1HE2 GLN 46 -3.330 0.701 0.225
329 HE22 GLN 46 2HE2 GLN 46 -3.966 2.236 -0.248
330 H LYS 47 H LYS 47 -5.433 -3.156 2.416
331 HA LYS 47 HA LYS 47 -3.077 -4.736 2.202
332 HB2 LYS 47 1HB LYS 47 -5.791 -4.795 0.991
333 HB3 LYS 47 2HB LYS 47 -4.505 -5.666 0.166
334 HG2 LYS 47 1HG LYS 47 -5.193 -6.056 3.063
335 HG3 LYS 47 2HG LYS 47 -5.835 -7.044 1.747
336 HD2 LYS 47 1HD LYS 47 -3.492 -7.570 1.089
337 HD3 LYS 47 2HD LYS 47 -2.943 -6.712 2.531
338 HE2 LYS 47 1HE LYS 47 -4.754 -9.118 2.496
339 HE3 LYS 47 2HE LYS 47 -3.033 -9.133 2.870
340 HZ1 LYS 47 1HZ LYS 47 -3.474 -7.703 4.770
341 HZ2 LYS 47 2HZ LYS 47 -4.357 -9.143 4.877
342 HZ3 LYS 47 3HZ LYS 47 -5.129 -7.714 4.417
343 H VAL 48 H VAL 48 -1.823 -5.097 0.333
344 HA VAL 48 HA VAL 48 -1.911 -3.120 -1.771
345 HB VAL 48 HB VAL 48 -0.868 -1.925 0.117
346 HG11 VAL 48 1HG1 VAL 48 1.271 -4.031 -0.083
347 HG12 VAL 48 2HG1 VAL 48 0.127 -3.832 1.246
348 HG13 VAL 48 3HG1 VAL 48 1.332 -2.583 0.927
349 HG21 VAL 48 1HG2 VAL 48 1.001 -2.528 -2.162
350 HG22 VAL 48 2HG2 VAL 48 1.127 -1.151 -1.068
351 HG23 VAL 48 3HG2 VAL 48 -0.267 -1.301 -2.140
352 H GLU 49 H GLU 49 -0.511 -3.577 -3.470
353 HA GLU 49 HA GLU 49 0.884 -6.165 -3.363
354 HB2 GLU 49 1HB GLU 49 -1.110 -6.343 -4.733
355 HB3 GLU 49 2HB GLU 49 -0.663 -4.898 -5.626
356 HG2 GLU 49 1HG GLU 49 1.298 -6.057 -6.504
357 HG3 GLU 49 2HG GLU 49 0.825 -7.509 -5.619
358 H PHE 50 H PHE 50 2.922 -6.220 -4.389
359 HA PHE 50 HA PHE 50 3.974 -3.868 -5.646
360 HB2 PHE 50 1HB PHE 50 5.697 -3.465 -3.838
361 HB3 PHE 50 2HB PHE 50 4.054 -2.988 -3.432
362 HD1 PHE 50 HD1 PHE 50 2.716 -4.357 -1.883
363 HD2 PHE 50 HD2 PHE 50 6.829 -5.168 -2.614
364 HE1 PHE 50 HE1 PHE 50 2.799 -5.730 0.148
365 HE2 PHE 50 HE2 PHE 50 6.915 -6.545 -0.578
366 HZ PHE 50 HZ PHE 50 4.902 -6.826 0.805
367 H GLU 51 H GLU 51 6.375 -4.039 -5.907
368 HA GLU 51 HA GLU 51 7.248 -6.851 -6.067
369 HB2 GLU 51 1HB GLU 51 6.904 -5.793 -8.286
370 HB3 GLU 51 2HB GLU 51 8.042 -4.530 -7.839
371 HG2 GLU 51 1HG GLU 51 9.794 -6.253 -7.601
372 HG3 GLU 51 2HG GLU 51 8.644 -7.455 -8.184
373 H ILE 52 H ILE 52 8.798 -7.242 -4.604
374 HA ILE 52 HA ILE 52 9.992 -5.069 -3.188
375 HB ILE 52 HB ILE 52 10.671 -8.003 -3.005
376 HG12 ILE 52 1HG1 ILE 52 8.796 -6.319 -1.340
377 HG13 ILE 52 2HG1 ILE 52 8.292 -7.500 -2.541
378 HG21 ILE 52 1HG2 ILE 52 11.596 -7.422 -0.818
379 HG22 ILE 52 2HG2 ILE 52 11.200 -5.726 -1.096
380 HG23 ILE 52 3HG2 ILE 52 12.409 -6.524 -2.102
381 HD11 ILE 52 1HD1 ILE 52 9.802 -8.074 -0.006
382 HD12 ILE 52 2HD1 ILE 52 9.340 -9.271 -1.217
383 HD13 ILE 52 3HD1 ILE 52 8.097 -8.405 -0.313
384 H GLY 53 H GLY 53 11.827 -4.108 -3.488
385 HA2 GLY 53 1HA GLY 53 13.947 -5.444 -5.022
386 HA3 GLY 53 2HA GLY 53 13.464 -3.804 -5.444
387 H GLU 54 H GLU 54 15.752 -3.335 -4.951
388 HA GLU 54 HA GLU 54 16.228 -3.209 -2.063
389 HB2 GLU 54 1HB GLU 54 18.602 -2.937 -2.618
390 HB3 GLU 54 2HB GLU 54 17.940 -4.427 -3.268
391 HG2 GLU 54 1HG GLU 54 17.758 -3.377 -5.469
392 HG3 GLU 54 2HG GLU 54 18.452 -1.897 -4.810
393 H GLY 55 H GLY 55 16.178 -1.345 -1.068
394 HA2 GLY 55 1HA GLY 55 16.265 1.111 -2.702
395 HA3 GLY 55 2HA GLY 55 15.341 0.943 -1.215
396 H ALA 56 H ALA 56 16.498 2.883 -0.559
397 HA ALA 56 HA ALA 56 19.309 2.835 -0.166
398 HB1 ALA 56 1HB ALA 56 18.028 4.917 -0.374
399 HB2 ALA 56 2HB ALA 56 18.979 4.873 1.111
400 HB3 ALA 56 3HB ALA 56 17.242 4.575 1.168
401 H LYS 57 H LYS 57 16.567 1.866 1.771
402 HA LYS 57 HA LYS 57 18.408 1.099 3.931
403 HB2 LYS 57 1HB LYS 57 15.554 2.052 4.187
404 HB3 LYS 57 2HB LYS 57 16.536 1.450 5.512
405 HG2 LYS 57 1HG LYS 57 18.126 3.294 5.135
406 HG3 LYS 57 2HG LYS 57 17.061 3.918 3.873
407 HD2 LYS 57 1HD LYS 57 15.261 4.150 5.531
408 HD3 LYS 57 2HD LYS 57 16.354 3.560 6.784
409 HE2 LYS 57 1HE LYS 57 16.735 6.057 5.134
410 HE3 LYS 57 2HE LYS 57 16.183 6.005 6.807
411 HZ1 LYS 57 1HZ LYS 57 18.509 6.517 6.743
412 HZ2 LYS 57 2HZ LYS 57 18.844 5.164 5.792
413 HZ3 LYS 57 3HZ LYS 57 18.325 4.964 7.391
414 H GLY 58 H GLY 58 18.213 -0.754 2.118
415 HA2 GLY 58 1HA GLY 58 17.946 -3.079 2.312
416 HA3 GLY 58 2HA GLY 58 16.686 -2.809 3.506
417 HA PRO 59 HA PRO 59 14.571 -4.209 -0.339
418 HB2 PRO 59 1HB PRO 59 12.483 -5.346 1.007
419 HB3 PRO 59 2HB PRO 59 13.982 -6.192 0.627
420 HG2 PRO 59 1HG PRO 59 13.150 -4.865 3.171
421 HG3 PRO 59 2HG PRO 59 13.959 -6.425 2.938
422 HD2 PRO 59 1HD PRO 59 15.321 -4.233 3.677
423 HD3 PRO 59 2HD PRO 59 16.029 -5.441 2.585
424 H GLN 60 H GLN 60 13.138 -3.039 -1.405
425 HA GLN 60 HA GLN 60 11.324 -1.313 0.143
426 HB2 GLN 60 1HB GLN 60 11.565 0.427 -1.525
427 HB3 GLN 60 2HB GLN 60 13.145 0.012 -0.875
428 HG2 GLN 60 1HG GLN 60 13.755 -1.156 -2.829
429 HG3 GLN 60 2HG GLN 60 12.101 -1.158 -3.431
430 HE21 GLN 60 1HE2 GLN 60 11.659 1.622 -2.685
431 HE22 GLN 60 2HE2 GLN 60 12.505 2.572 -3.851
432 H ALA 61 H ALA 61 9.297 -0.996 -0.671
433 HA ALA 61 HA ALA 61 8.310 -2.975 -2.519
434 HB1 ALA 61 1HB ALA 61 6.905 -0.676 -1.155
435 HB2 ALA 61 2HB ALA 61 6.976 -2.340 -0.574
436 HB3 ALA 61 3HB ALA 61 6.119 -1.963 -2.070
437 H GLN 62 H GLN 62 8.566 -2.706 -4.614
438 HA GLN 62 HA GLN 62 8.537 0.011 -5.737
439 HB2 GLN 62 1HB GLN 62 9.507 -2.574 -6.957
440 HB3 GLN 62 2HB GLN 62 9.657 -0.975 -7.672
441 HG2 GLN 62 1HG GLN 62 11.250 -0.294 -6.103
442 HG3 GLN 62 2HG GLN 62 10.863 -1.618 -5.009
443 HE21 GLN 62 1HE2 GLN 62 10.804 -3.612 -7.090
444 HE22 GLN 62 2HE2 GLN 62 12.440 -3.897 -7.549
445 H GLN 63 H GLN 63 7.186 0.454 -7.509
446 HA GLN 63 HA GLN 63 5.154 0.454 -8.524
447 HB2 GLN 63 1HB GLN 63 5.883 -2.459 -8.816
448 HB3 GLN 63 2HB GLN 63 4.463 -1.751 -9.564
449 HG2 GLN 63 1HG GLN 63 6.011 -1.740 -11.271
450 HG3 GLN 63 2HG GLN 63 6.113 -0.101 -10.635
451 HE21 GLN 63 1HE2 GLN 63 7.979 0.568 -9.629
452 HE22 GLN 63 2HE2 GLN 63 9.437 -0.357 -9.638
453 H VAL 64 H VAL 64 4.614 0.820 -6.122
454 HA VAL 64 HA VAL 64 3.337 -1.386 -4.771
455 HB VAL 64 HB VAL 64 3.186 1.449 -3.823
456 HG11 VAL 64 1HG1 VAL 64 3.419 -1.214 -2.455
457 HG12 VAL 64 2HG1 VAL 64 2.008 -0.159 -2.518
458 HG13 VAL 64 3HG1 VAL 64 3.445 0.340 -1.625
459 HG21 VAL 64 1HG2 VAL 64 5.495 1.194 -4.505
460 HG22 VAL 64 2HG2 VAL 64 5.611 -0.327 -3.619
461 HG23 VAL 64 3HG2 VAL 64 5.382 1.189 -2.745
462 H HIS 65 H HIS 65 1.487 -1.961 -5.739
463 HA HIS 65 HA HIS 65 -0.481 0.075 -6.487
464 HB2 HIS 65 1HB HIS 65 -0.482 -2.922 -6.900
465 HB3 HIS 65 2HB HIS 65 -1.736 -1.831 -7.460
466 HD1 HIS 65 HD1 HIS 65 -1.285 -0.513 -9.611
467 HD2 HIS 65 HD2 HIS 65 1.923 -2.849 -8.371
468 HE1 HIS 65 HE1 HIS 65 0.301 -0.572 -11.559
469 HE2 HIS 65 HE2 HIS 65 2.291 -1.886 -10.746
470 H ALA 66 H ALA 66 -1.989 0.630 -5.052
471 HA ALA 66 HA ALA 66 -2.280 -0.765 -2.590
472 HB1 ALA 66 1HB ALA 66 -3.970 0.893 -2.061
473 HB2 ALA 66 2HB ALA 66 -4.001 1.422 -3.745
474 HB3 ALA 66 3HB ALA 66 -2.550 1.664 -2.772
475 H LEU 67 H LEU 67 -3.691 -2.273 -1.991
476 HA LEU 67 HA LEU 67 -5.569 -3.259 -4.005
477 HB2 LEU 67 1HB LEU 67 -4.578 -4.479 -1.433
478 HB3 LEU 67 2HB LEU 67 -5.726 -5.243 -2.512
479 HG LEU 67 HG LEU 67 -2.856 -4.571 -3.162
480 HD11 LEU 67 1HD1 LEU 67 -4.197 -7.241 -2.778
481 HD12 LEU 67 2HD1 LEU 67 -3.164 -6.446 -1.592
482 HD13 LEU 67 3HD1 LEU 67 -2.496 -6.951 -3.143
483 HD21 LEU 67 1HD2 LEU 67 -3.270 -5.841 -5.235
484 HD22 LEU 67 2HD2 LEU 67 -4.233 -4.367 -5.142
485 HD23 LEU 67 3HD2 LEU 67 -4.980 -5.930 -4.817
486 H GLY 68 H GLY 68 -7.746 -3.336 -3.675
487 HA2 GLY 68 1HA GLY 68 -9.778 -2.883 -2.678
488 HA3 GLY 68 2HA GLY 68 -8.938 -2.676 -1.146
489 H GLY 69 H GLY 69 -8.219 -0.645 -0.534
490 HA2 GLY 69 1HA GLY 69 -7.838 1.644 -0.751
491 HA3 GLY 69 2HA GLY 69 -8.501 1.578 -2.377
492 H GLU 70 H GLU 70 -9.139 3.598 -0.581
493 HA GLU 70 HA GLU 70 -11.728 2.944 0.572
494 HB2 GLU 70 1HB GLU 70 -10.335 5.624 0.510
495 HB3 GLU 70 2HB GLU 70 -11.635 5.121 1.584
496 HG2 GLU 70 1HG GLU 70 -8.842 3.999 1.557
497 HG3 GLU 70 2HG GLU 70 -9.478 5.159 2.720
498 H ASN 71 H ASN 71 -12.254 2.478 -1.868
499 HA ASN 71 HA ASN 71 -12.861 4.881 -3.388
500 HB2 ASN 71 1HB ASN 71 -13.216 1.967 -4.103
501 HB3 ASN 71 2HB ASN 71 -13.540 3.317 -5.183
502 HD21 ASN 71 1HD2 ASN 71 -11.146 1.318 -3.752
503 HD22 ASN 71 2HD2 ASN 71 -9.787 1.971 -4.602
504 H LEU 72 H LEU 72 -14.570 2.277 -1.725
505 HA LEU 72 HA LEU 72 -17.144 3.282 -2.611
506 HB2 LEU 72 1HB LEU 72 -16.286 0.801 -1.908
507 HB3 LEU 72 2HB LEU 72 -17.039 1.315 -0.413
508 HG LEU 72 HG LEU 72 -18.392 1.159 -3.110
509 HD11 LEU 72 1HD1 LEU 72 -17.952 -1.024 -2.144
510 HD12 LEU 72 2HD1 LEU 72 -19.677 -0.655 -2.102
511 HD13 LEU 72 3HD1 LEU 72 -18.711 -0.523 -0.633
512 HD21 LEU 72 1HD2 LEU 72 -19.316 2.981 -1.790
513 HD22 LEU 72 2HD2 LEU 72 -19.528 1.897 -0.415
514 HD23 LEU 72 3HD2 LEU 72 -20.460 1.642 -1.893
515 H TYR 73 H TYR 73 -15.865 5.273 -1.417
516 HA TYR 73 HA TYR 73 -17.540 5.790 0.906
517 HB2 TYR 73 1HB TYR 73 -14.532 6.164 0.881
518 HB3 TYR 73 2HB TYR 73 -15.599 6.881 2.084
519 HD1 TYR 73 HD1 TYR 73 -13.761 3.947 1.127
520 HD2 TYR 73 HD2 TYR 73 -16.983 5.333 3.528
521 HE1 TYR 73 HE1 TYR 73 -13.659 1.877 2.449
522 HE2 TYR 73 HE2 TYR 73 -16.889 3.272 4.862
523 HH TYR 73 HH TYR 73 -16.121 1.027 4.715
524 H PHE 74 H PHE 74 -18.713 7.432 0.176
525 HA PHE 74 HA PHE 74 -17.762 9.112 -1.943
526 HB2 PHE 74 1HB PHE 74 -20.152 8.252 -1.617
527 HB3 PHE 74 2HB PHE 74 -20.315 9.498 -0.386
528 HD1 PHE 74 HD1 PHE 74 -19.601 8.937 -3.965
529 HD2 PHE 74 HD2 PHE 74 -20.792 11.718 -0.977
530 HE1 PHE 74 HE1 PHE 74 -20.176 10.562 -5.716
531 HE2 PHE 74 HE2 PHE 74 -21.370 13.353 -2.722
532 HZ PHE 74 HZ PHE 74 -21.061 12.775 -5.096
533 H GLN 75 H GLN 75 -15.932 9.895 -0.612
534 HA GLN 75 HA GLN 75 -16.738 12.329 0.834
535 HB2 GLN 75 1HB GLN 75 -14.794 12.050 2.310
536 HB3 GLN 75 2HB GLN 75 -15.915 10.703 2.451
537 HG2 GLN 75 1HG GLN 75 -14.476 9.334 1.054
538 HG3 GLN 75 2HG GLN 75 -13.366 10.689 0.851
539 HE21 GLN 75 1HE2 GLN 75 -11.649 9.608 1.768
540 HE22 GLN 75 2HE2 GLN 75 -11.561 9.269 3.461
541 H GLY 76 H GLY 76 -16.004 11.806 -1.977
542 HA2 GLY 76 1HA GLY 76 -13.439 12.624 -2.653
543 HA3 GLY 76 2HA GLY 76 -14.868 12.922 -3.631
544 H HIS 77 H HIS 77 -16.263 14.588 -1.855
545 HA HIS 77 HA HIS 77 -14.422 16.859 -1.540
546 HB2 HIS 77 1HB HIS 77 -16.315 18.384 -2.049
547 HB3 HIS 77 2HB HIS 77 -15.859 17.373 -3.409
548 HD1 HIS 77 HD1 HIS 77 -18.703 18.332 -1.323
549 HD2 HIS 77 HD2 HIS 77 -17.758 15.239 -3.931
550 HE1 HIS 77 HE1 HIS 77 -20.897 17.285 -1.962
551 HE2 HIS 77 HE2 HIS 77 -20.311 15.574 -3.707
552 H HIS 78 H HIS 78 -14.583 15.197 0.441
553 HA HIS 78 HA HIS 78 -14.728 15.177 2.682
554 HB2 HIS 78 1HB HIS 78 -16.044 17.858 2.282
555 HB3 HIS 78 2HB HIS 78 -15.816 17.144 3.874
556 HD1 HIS 78 HD1 HIS 78 -13.602 17.538 4.967
557 HD2 HIS 78 HD2 HIS 78 -13.516 18.356 0.893
558 HE1 HIS 78 HE1 HIS 78 -11.350 18.561 4.532
559 HE2 HIS 78 HE2 HIS 78 -11.259 18.895 2.040
560 H HIS 79 H HIS 79 -17.874 16.794 2.257
561 HA HIS 79 HA HIS 79 -19.172 14.252 2.962
562 HB2 HIS 79 1HB HIS 79 -19.518 16.858 4.459
563 HB3 HIS 79 2HB HIS 79 -20.594 15.480 4.633
564 HD1 HIS 79 HD1 HIS 79 -19.941 13.743 6.316
565 HD2 HIS 79 HD2 HIS 79 -16.821 16.341 5.409
566 HE1 HIS 79 HE1 HIS 79 -18.084 13.168 7.914
567 HE2 HIS 79 HE2 HIS 79 -16.166 14.658 7.259
568 H HIS 80 H HIS 80 -21.244 14.004 2.202
569 HA HIS 80 HA HIS 80 -22.632 16.304 1.085
570 HB2 HIS 80 1HB HIS 80 -21.256 15.274 -0.768
571 HB3 HIS 80 2HB HIS 80 -22.230 13.819 -0.588
572 HD1 HIS 80 HD1 HIS 80 -22.737 17.513 -1.337
573 HD2 HIS 80 HD2 HIS 80 -24.481 13.821 -2.114
574 HE1 HIS 80 HE1 HIS 80 -24.596 17.975 -2.957
575 HE2 HIS 80 HE2 HIS 80 -25.784 15.772 -3.205
576 H HIS 81 H HIS 81 -22.673 12.821 1.750
577 HA HIS 81 HA HIS 81 -25.544 12.715 1.909
578 HB2 HIS 81 1HB HIS 81 -23.359 10.758 2.615
579 HB3 HIS 81 2HB HIS 81 -25.048 10.433 2.983
580 HD1 HIS 81 HD1 HIS 81 -26.298 9.243 1.220
581 HD2 HIS 81 HD2 HIS 81 -22.975 11.221 -0.301
582 HE1 HIS 81 HE1 HIS 81 -26.182 8.602 -1.204
583 HE2 HIS 81 HE2 HIS 81 -24.282 9.960 -2.142
584 H HIS 82 H HIS 82 -22.860 12.723 4.195
585 HA HIS 82 HA HIS 82 -24.444 14.112 6.141
586 HB2 HIS 82 1HB HIS 82 -25.118 11.810 6.646
587 HB3 HIS 82 2HB HIS 82 -23.430 11.327 6.765
588 HD1 HIS 82 HD1 HIS 82 -22.466 11.368 9.043
589 HD2 HIS 82 HD2 HIS 82 -25.816 13.805 8.735
590 HE1 HIS 82 HE1 HIS 82 -22.896 12.220 11.367
591 HE2 HIS 82 HE2 HIS 82 -24.838 13.803 11.130
Start of MODEL 15
1 H2 MET 1 2H MET 1 5.339 -11.190 -8.344
2 H MET 1 1H MET 1 3.797 -10.594 -8.705
3 H3 MET 1 3H MET 1 5.161 -9.929 -9.454
4 HA MET 1 HA MET 1 5.970 -9.124 -7.336
5 HB2 MET 1 1HB MET 1 4.402 -7.317 -7.050
6 HB3 MET 1 2HB MET 1 4.501 -7.698 -8.762
7 HG2 MET 1 1HG MET 1 2.319 -8.677 -6.939
8 HG3 MET 1 2HG MET 1 2.209 -7.225 -7.929
9 HE1 MET 1 1HE MET 1 2.175 -7.208 -10.537
10 HE2 MET 1 2HE MET 1 2.280 -8.647 -11.550
11 HE3 MET 1 3HE MET 1 3.685 -8.116 -10.629
12 H ALA 2 H ALA 2 5.275 -8.503 -5.124
13 HA ALA 2 HA ALA 2 3.967 -10.789 -3.834
14 HB1 ALA 2 1HB ALA 2 5.749 -8.641 -2.677
15 HB2 ALA 2 2HB ALA 2 6.232 -10.291 -3.076
16 HB3 ALA 2 3HB ALA 2 5.066 -10.002 -1.785
17 H GLN 3 H GLN 3 2.851 -10.124 -1.724
18 HA GLN 3 HA GLN 3 1.403 -7.593 -2.002
19 HB2 GLN 3 1HB GLN 3 0.124 -10.276 -1.454
20 HB3 GLN 3 2HB GLN 3 -0.700 -8.727 -1.388
21 HG2 GLN 3 1HG GLN 3 -0.365 -8.398 -3.746
22 HG3 GLN 3 2HG GLN 3 0.588 -9.878 -3.846
23 HE21 GLN 3 1HE2 GLN 3 -2.567 -8.523 -3.575
24 HE22 GLN 3 2HE2 GLN 3 -3.450 -9.981 -3.835
25 H GLY 4 H GLY 4 0.147 -7.182 0.085
26 HA2 GLY 4 1HA GLY 4 0.682 -8.557 2.442
27 HA3 GLY 4 2HA GLY 4 1.953 -7.361 2.251
28 H THR 5 H THR 5 1.280 -6.331 4.104
29 HA THR 5 HA THR 5 -1.069 -4.609 3.718
30 HB THR 5 HB THR 5 -0.264 -5.729 6.403
31 HG1 THR 5 HG1 THR 5 -0.968 -7.452 5.051
32 HG21 THR 5 1HG2 THR 5 -1.567 -3.659 6.431
33 HG22 THR 5 2HG2 THR 5 -2.514 -5.011 7.057
34 HG23 THR 5 3HG2 THR 5 -2.799 -4.417 5.419
35 H VAL 6 H VAL 6 -0.382 -2.559 3.689
36 HA VAL 6 HA VAL 6 2.188 -1.789 4.561
37 HB VAL 6 HB VAL 6 1.391 -0.355 2.935
38 HG11 VAL 6 1HG1 VAL 6 -0.925 -1.039 2.967
39 HG12 VAL 6 2HG1 VAL 6 -0.800 0.719 2.947
40 HG13 VAL 6 3HG1 VAL 6 -1.193 -0.120 4.446
41 HG21 VAL 6 1HG2 VAL 6 0.807 1.085 5.517
42 HG22 VAL 6 2HG2 VAL 6 1.104 1.850 3.955
43 HG23 VAL 6 3HG2 VAL 6 2.388 0.930 4.744
44 H LYS 7 H LYS 7 2.845 -1.769 6.546
45 HA LYS 7 HA LYS 7 1.047 -1.997 8.729
46 HB2 LYS 7 1HB LYS 7 3.090 -2.006 10.110
47 HB3 LYS 7 2HB LYS 7 3.181 -3.134 8.769
48 HG2 LYS 7 1HG LYS 7 4.637 -1.703 7.561
49 HG3 LYS 7 2HG LYS 7 4.393 -0.390 8.712
50 HD2 LYS 7 1HD LYS 7 6.523 -1.426 9.135
51 HD3 LYS 7 2HD LYS 7 5.429 -1.795 10.465
52 HE2 LYS 7 1HE LYS 7 4.956 -3.982 9.367
53 HE3 LYS 7 2HE LYS 7 6.211 -3.603 8.189
54 HZ1 LYS 7 1HZ LYS 7 7.205 -4.938 9.843
55 HZ2 LYS 7 2HZ LYS 7 6.531 -4.023 11.102
56 HZ3 LYS 7 3HZ LYS 7 7.746 -3.360 10.135
57 H TRP 8 H TRP 8 2.883 0.573 7.294
58 HA TRP 8 HA TRP 8 1.123 2.530 8.277
59 HB2 TRP 8 1HB TRP 8 2.587 3.833 9.708
60 HB3 TRP 8 2HB TRP 8 2.429 2.213 10.370
61 HD1 TRP 8 HD1 TRP 8 4.602 0.687 10.416
62 HE1 TRP 8 HE1 TRP 8 7.105 1.236 10.193
63 HE3 TRP 8 HE3 TRP 8 4.225 5.394 8.459
64 HZ2 TRP 8 HZ2 TRP 8 8.707 3.389 9.309
65 HZ3 TRP 8 HZ3 TRP 8 6.291 6.628 7.956
66 HH2 TRP 8 HH2 TRP 8 8.481 5.644 8.372
67 H PHE 9 H PHE 9 1.420 4.498 7.222
68 HA PHE 9 HA PHE 9 3.793 4.824 5.579
69 HB2 PHE 9 1HB PHE 9 2.150 3.580 4.178
70 HB3 PHE 9 2HB PHE 9 1.029 4.926 4.362
71 HD1 PHE 9 HD1 PHE 9 1.363 6.993 3.177
72 HD2 PHE 9 HD2 PHE 9 4.165 3.810 2.856
73 HE1 PHE 9 HE1 PHE 9 2.396 8.106 1.243
74 HE2 PHE 9 HE2 PHE 9 5.204 4.916 0.920
75 HZ PHE 9 HZ PHE 9 4.321 7.068 0.114
76 H ASN 10 H ASN 10 4.489 6.746 6.096
77 HA ASN 10 HA ASN 10 2.640 8.834 6.910
78 HB2 ASN 10 1HB ASN 10 4.779 8.457 8.142
79 HB3 ASN 10 2HB ASN 10 5.660 8.910 6.690
80 HD21 ASN 10 1HD2 ASN 10 5.566 10.110 9.385
81 HD22 ASN 10 2HD2 ASN 10 5.161 11.772 9.117
82 H ALA 11 H ALA 11 1.599 9.660 5.214
83 HA ALA 11 HA ALA 11 2.634 9.778 2.591
84 HB1 ALA 11 1HB ALA 11 0.301 11.266 3.778
85 HB2 ALA 11 2HB ALA 11 0.244 9.654 3.067
86 HB3 ALA 11 3HB ALA 11 0.626 11.048 2.057
87 H GLU 12 H GLU 12 2.702 12.013 5.264
88 HA GLU 12 HA GLU 12 3.245 14.381 3.834
89 HB2 GLU 12 1HB GLU 12 4.249 13.672 6.590
90 HB3 GLU 12 2HB GLU 12 4.053 15.284 5.922
91 HG2 GLU 12 1HG GLU 12 1.604 14.853 5.793
92 HG3 GLU 12 2HG GLU 12 1.886 13.339 6.651
93 H LYS 13 H LYS 13 5.290 11.891 5.226
94 HA LYS 13 HA LYS 13 7.719 13.156 4.305
95 HB2 LYS 13 1HB LYS 13 7.261 10.437 5.533
96 HB3 LYS 13 2HB LYS 13 8.824 11.194 5.273
97 HG2 LYS 13 1HG LYS 13 6.653 12.227 7.073
98 HG3 LYS 13 2HG LYS 13 8.102 11.365 7.588
99 HD2 LYS 13 1HD LYS 13 9.469 13.167 6.581
100 HD3 LYS 13 2HD LYS 13 7.981 14.037 6.210
101 HE2 LYS 13 1HE LYS 13 7.434 14.168 8.564
102 HE3 LYS 13 2HE LYS 13 8.866 13.224 8.970
103 HZ1 LYS 13 1HZ LYS 13 8.869 15.901 7.690
104 HZ2 LYS 13 2HZ LYS 13 10.242 14.997 8.082
105 HZ3 LYS 13 3HZ LYS 13 9.238 15.581 9.309
106 H GLY 14 H GLY 14 5.568 10.600 3.373
107 HA2 GLY 14 1HA GLY 14 5.230 9.913 1.158
108 HA3 GLY 14 2HA GLY 14 6.799 10.578 0.731
109 H PHE 15 H PHE 15 6.620 8.553 3.537
110 HA PHE 15 HA PHE 15 7.290 6.190 1.998
111 HB2 PHE 15 1HB PHE 15 9.417 5.789 2.976
112 HB3 PHE 15 2HB PHE 15 9.442 7.438 2.372
113 HD1 PHE 15 HD1 PHE 15 9.529 9.321 3.913
114 HD2 PHE 15 HD2 PHE 15 9.503 5.310 5.333
115 HE1 PHE 15 HE1 PHE 15 10.309 10.093 6.117
116 HE2 PHE 15 HE2 PHE 15 10.278 6.076 7.533
117 HZ PHE 15 HZ PHE 15 10.682 8.470 7.928
118 H GLY 16 H GLY 16 7.597 4.272 3.411
119 HA2 GLY 16 1HA GLY 16 6.666 4.276 6.093
120 HA3 GLY 16 2HA GLY 16 5.364 3.844 4.992
121 H PHE 17 H PHE 17 5.357 1.761 6.036
122 HA PHE 17 HA PHE 17 7.292 -0.025 4.750
123 HB2 PHE 17 1HB PHE 17 6.771 0.168 7.690
124 HB3 PHE 17 2HB PHE 17 7.148 -1.396 6.980
125 HD1 PHE 17 HD1 PHE 17 8.436 1.874 7.899
126 HD2 PHE 17 HD2 PHE 17 9.331 -1.824 6.005
127 HE1 PHE 17 HE1 PHE 17 10.837 2.390 8.041
128 HE2 PHE 17 HE2 PHE 17 11.733 -1.319 6.138
129 HZ PHE 17 HZ PHE 17 12.490 0.791 7.162
130 H ILE 18 H ILE 18 6.544 -2.041 4.290
131 HA ILE 18 HA ILE 18 3.717 -2.579 4.887
132 HB ILE 18 HB ILE 18 5.312 -3.366 2.449
133 HG12 ILE 18 1HG1 ILE 18 2.764 -1.778 2.558
134 HG13 ILE 18 2HG1 ILE 18 4.350 -1.021 2.611
135 HG21 ILE 18 1HG2 ILE 18 3.901 -5.216 3.069
136 HG22 ILE 18 2HG2 ILE 18 3.237 -4.422 1.638
137 HG23 ILE 18 3HG2 ILE 18 2.509 -4.141 3.220
138 HD11 ILE 18 1HD1 ILE 18 3.308 -2.766 0.394
139 HD12 ILE 18 2HD1 ILE 18 4.883 -1.971 0.438
140 HD13 ILE 18 3HD1 ILE 18 3.408 -1.004 0.365
141 H ALA 19 H ALA 19 3.195 -4.559 5.655
142 HA ALA 19 HA ALA 19 5.397 -6.434 6.156
143 HB1 ALA 19 1HB ALA 19 3.859 -7.539 7.704
144 HB2 ALA 19 2HB ALA 19 2.581 -6.408 7.254
145 HB3 ALA 19 3HB ALA 19 4.019 -5.826 8.095
146 HA PRO 20 HA PRO 20 3.727 -8.166 2.250
147 HB2 PRO 20 1HB PRO 20 6.075 -9.888 2.855
148 HB3 PRO 20 2HB PRO 20 5.588 -9.152 1.328
149 HG2 PRO 20 1HG PRO 20 7.601 -8.134 2.731
150 HG3 PRO 20 2HG PRO 20 6.447 -7.076 1.902
151 HD2 PRO 20 1HD PRO 20 6.685 -7.723 4.792
152 HD3 PRO 20 2HD PRO 20 6.203 -6.208 4.012
153 H ASP 21 H ASP 21 2.546 -9.963 1.872
154 HA ASP 21 HA ASP 21 1.710 -11.526 4.120
155 HB2 ASP 21 1HB ASP 21 0.197 -10.841 2.253
156 HB3 ASP 21 2HB ASP 21 1.082 -11.924 1.186
157 H ASP 22 H ASP 22 4.244 -11.685 1.976
158 HA ASP 22 HA ASP 22 4.512 -14.536 1.777
159 HB2 ASP 22 1HB ASP 22 5.323 -12.713 0.117
160 HB3 ASP 22 2HB ASP 22 6.707 -12.573 1.192
161 H GLY 23 H GLY 23 4.467 -13.184 4.452
162 HA2 GLY 23 1HA GLY 23 5.395 -14.223 6.401
163 HA3 GLY 23 2HA GLY 23 6.881 -14.487 5.506
164 H SER 24 H SER 24 5.630 -11.437 4.948
165 HA SER 24 HA SER 24 6.143 -9.337 5.582
166 HB2 SER 24 1HB SER 24 6.166 -10.616 8.314
167 HB3 SER 24 2HB SER 24 6.069 -8.883 8.004
168 HG SER 24 HG SER 24 4.213 -10.655 6.830
169 H ALA 25 H ALA 25 8.218 -9.473 4.466
170 HA ALA 25 HA ALA 25 10.578 -9.729 6.112
171 HB1 ALA 25 1HB ALA 25 10.319 -8.796 3.259
172 HB2 ALA 25 2HB ALA 25 10.622 -10.454 3.776
173 HB3 ALA 25 3HB ALA 25 11.821 -9.200 4.089
174 H ASP 26 H ASP 26 8.351 -7.477 6.073
175 HA ASP 26 HA ASP 26 8.147 -5.272 6.545
176 HB2 ASP 26 1HB ASP 26 10.989 -5.517 7.542
177 HB3 ASP 26 2HB ASP 26 9.847 -4.243 7.953
178 H VAL 27 H VAL 27 8.049 -4.829 4.286
179 HA VAL 27 HA VAL 27 10.516 -4.005 2.988
180 HB VAL 27 HB VAL 27 8.935 -5.485 1.802
181 HG11 VAL 27 1HG1 VAL 27 6.847 -4.631 2.642
182 HG12 VAL 27 2HG1 VAL 27 6.870 -4.557 0.879
183 HG13 VAL 27 3HG1 VAL 27 7.126 -3.090 1.829
184 HG21 VAL 27 1HG2 VAL 27 10.482 -4.129 0.537
185 HG22 VAL 27 2HG2 VAL 27 9.334 -2.790 0.533
186 HG23 VAL 27 3HG2 VAL 27 8.951 -4.286 -0.323
187 H PHE 28 H PHE 28 11.028 -1.983 2.446
188 HA PHE 28 HA PHE 28 9.642 0.165 3.783
189 HB2 PHE 28 1HB PHE 28 12.089 0.057 3.772
190 HB3 PHE 28 2HB PHE 28 12.098 0.130 2.015
191 HD1 PHE 28 HD1 PHE 28 11.784 2.202 0.855
192 HD2 PHE 28 HD2 PHE 28 11.547 2.029 5.100
193 HE1 PHE 28 HE1 PHE 28 11.931 4.655 0.958
194 HE2 PHE 28 HE2 PHE 28 11.688 4.483 5.209
195 HZ PHE 28 HZ PHE 28 11.880 5.797 3.137
196 H VAL 29 H VAL 29 8.299 1.631 2.867
197 HA VAL 29 HA VAL 29 7.840 1.363 -0.030
198 HB VAL 29 HB VAL 29 5.951 2.849 1.729
199 HG11 VAL 29 1HG1 VAL 29 4.310 2.022 0.131
200 HG12 VAL 29 2HG1 VAL 29 5.564 1.087 -0.682
201 HG13 VAL 29 3HG1 VAL 29 5.634 2.850 -0.688
202 HG21 VAL 29 1HG2 VAL 29 4.742 0.833 2.283
203 HG22 VAL 29 2HG2 VAL 29 6.378 0.779 2.941
204 HG23 VAL 29 3HG2 VAL 29 5.978 -0.147 1.493
205 H HIS 30 H HIS 30 7.880 3.112 -1.345
206 HA HIS 30 HA HIS 30 8.293 5.753 -0.153
207 HB2 HIS 30 1HB HIS 30 10.496 4.821 -0.827
208 HB3 HIS 30 2HB HIS 30 9.890 4.625 -2.468
209 HD1 HIS 30 HD1 HIS 30 10.687 6.394 -3.951
210 HD2 HIS 30 HD2 HIS 30 10.169 7.774 -0.057
211 HE1 HIS 30 HE1 HIS 30 11.355 8.826 -3.992
212 HE2 HIS 30 HE2 HIS 30 10.935 9.665 -1.653
213 H TYR 31 H TYR 31 7.145 7.317 -1.120
214 HA TYR 31 HA TYR 31 4.836 6.552 -2.433
215 HB2 TYR 31 1HB TYR 31 4.245 8.857 -2.532
216 HB3 TYR 31 2HB TYR 31 5.150 8.609 -1.046
217 HD1 TYR 31 HD1 TYR 31 4.958 10.415 -4.146
218 HD2 TYR 31 HD2 TYR 31 7.564 9.335 -0.967
219 HE1 TYR 31 HE1 TYR 31 6.474 12.241 -4.776
220 HE2 TYR 31 HE2 TYR 31 9.087 11.157 -1.585
221 HH TYR 31 HH TYR 31 9.633 12.491 -3.596
222 H SER 32 H SER 32 7.844 7.649 -3.859
223 HA SER 32 HA SER 32 6.780 8.287 -6.407
224 HB2 SER 32 1HB SER 32 9.599 7.412 -5.746
225 HB3 SER 32 2HB SER 32 9.081 8.357 -7.144
226 HG SER 32 HG SER 32 8.902 10.101 -5.929
227 H GLU 33 H GLU 33 7.530 5.328 -4.842
228 HA GLU 33 HA GLU 33 7.641 3.832 -7.334
229 HB2 GLU 33 1HB GLU 33 8.117 3.153 -4.452
230 HB3 GLU 33 2HB GLU 33 7.861 1.884 -5.637
231 HG2 GLU 33 1HG GLU 33 10.244 2.366 -5.171
232 HG3 GLU 33 2HG GLU 33 9.798 2.529 -6.866
233 H ILE 34 H ILE 34 5.348 4.926 -5.153
234 HA ILE 34 HA ILE 34 3.530 2.719 -5.355
235 HB ILE 34 HB ILE 34 3.039 5.553 -4.442
236 HG12 ILE 34 1HG1 ILE 34 3.513 3.022 -2.859
237 HG13 ILE 34 2HG1 ILE 34 4.646 4.356 -3.029
238 HG21 ILE 34 1HG2 ILE 34 0.990 4.674 -3.422
239 HG22 ILE 34 2HG2 ILE 34 1.309 3.102 -4.156
240 HG23 ILE 34 3HG2 ILE 34 0.976 4.501 -5.178
241 HD11 ILE 34 1HD1 ILE 34 3.072 5.828 -1.880
242 HD12 ILE 34 2HD1 ILE 34 3.516 4.437 -0.890
243 HD13 ILE 34 3HD1 ILE 34 1.952 4.480 -1.704
244 H GLN 35 H GLN 35 1.971 2.400 -6.767
245 HA GLN 35 HA GLN 35 1.658 4.334 -8.965
246 HB2 GLN 35 1HB GLN 35 1.068 1.367 -8.935
247 HB3 GLN 35 2HB GLN 35 1.001 2.432 -10.333
248 HG2 GLN 35 1HG GLN 35 3.491 1.847 -8.762
249 HG3 GLN 35 2HG GLN 35 3.020 1.003 -10.235
250 HE21 GLN 35 1HE2 GLN 35 5.368 2.642 -9.643
251 HE22 GLN 35 2HE2 GLN 35 5.382 3.886 -10.842
252 H GLY 36 H GLY 36 0.040 5.568 -7.967
253 HA2 GLY 36 1HA GLY 36 -2.355 4.108 -7.068
254 HA3 GLY 36 2HA GLY 36 -1.866 5.687 -6.477
255 H ASN 37 H ASN 37 -4.049 6.304 -6.935
256 HA ASN 37 HA ASN 37 -4.719 6.604 -9.769
257 HB2 ASN 37 1HB ASN 37 -6.981 7.243 -8.895
258 HB3 ASN 37 2HB ASN 37 -6.482 5.612 -8.467
259 HD21 ASN 37 1HD2 ASN 37 -7.763 5.421 -6.699
260 HD22 ASN 37 2HD2 ASN 37 -7.540 6.351 -5.251
261 H GLY 38 H GLY 38 -2.655 8.192 -8.961
262 HA2 GLY 38 1HA GLY 38 -2.258 10.504 -9.469
263 HA3 GLY 38 2HA GLY 38 -3.870 10.874 -8.864
264 H PHE 39 H PHE 39 -3.639 9.222 -6.525
265 HA PHE 39 HA PHE 39 -1.750 10.817 -4.946
266 HB2 PHE 39 1HB PHE 39 -4.213 9.251 -4.200
267 HB3 PHE 39 2HB PHE 39 -3.041 9.758 -2.991
268 HD1 PHE 39 HD1 PHE 39 -5.716 10.817 -5.210
269 HD2 PHE 39 HD2 PHE 39 -2.696 12.132 -2.514
270 HE1 PHE 39 HE1 PHE 39 -6.812 13.013 -5.059
271 HE2 PHE 39 HE2 PHE 39 -3.790 14.328 -2.354
272 HZ PHE 39 HZ PHE 39 -5.850 14.772 -3.629
273 H ARG 40 H ARG 40 0.166 9.869 -4.804
274 HA ARG 40 HA ARG 40 0.382 6.973 -4.808
275 HB2 ARG 40 1HB ARG 40 2.507 9.116 -4.680
276 HB3 ARG 40 2HB ARG 40 2.810 7.395 -4.860
277 HG2 ARG 40 1HG ARG 40 1.534 7.447 -6.988
278 HG3 ARG 40 2HG ARG 40 1.409 9.199 -6.819
279 HD2 ARG 40 1HD ARG 40 3.869 9.344 -6.802
280 HD3 ARG 40 2HD ARG 40 3.953 7.599 -7.046
281 HE ARG 40 HE ARG 40 2.683 9.412 -8.997
282 HH11 ARG 40 1HH1 ARG 40 4.772 6.710 -8.240
283 HH12 ARG 40 2HH1 ARG 40 5.196 6.412 -9.894
284 HH21 ARG 40 1HH2 ARG 40 3.218 9.000 -11.182
285 HH22 ARG 40 2HH2 ARG 40 4.298 7.697 -11.569
286 H THR 41 H THR 41 -0.890 7.005 -2.756
287 HA THR 41 HA THR 41 0.887 7.254 -0.436
288 HB THR 41 HB THR 41 -1.076 8.183 0.854
289 HG1 THR 41 HG1 THR 41 -2.409 7.641 -1.274
290 HG21 THR 41 1HG2 THR 41 -0.003 9.882 -1.399
291 HG22 THR 41 2HG2 THR 41 0.788 9.606 0.154
292 HG23 THR 41 3HG2 THR 41 -0.740 10.485 0.086
293 H LEU 42 H LEU 42 0.251 5.998 1.385
294 HA LEU 42 HA LEU 42 -1.725 3.898 0.819
295 HB2 LEU 42 1HB LEU 42 0.996 3.643 2.086
296 HB3 LEU 42 2HB LEU 42 -0.231 2.402 2.211
297 HG LEU 42 HG LEU 42 1.020 3.369 -0.352
298 HD11 LEU 42 1HD1 LEU 42 2.529 2.072 1.106
299 HD12 LEU 42 2HD1 LEU 42 2.145 1.250 -0.404
300 HD13 LEU 42 3HD1 LEU 42 1.358 0.752 1.092
301 HD21 LEU 42 1HD2 LEU 42 -1.005 1.209 0.203
302 HD22 LEU 42 2HD2 LEU 42 -0.140 1.396 -1.323
303 HD23 LEU 42 3HD2 LEU 42 -1.234 2.664 -0.770
304 H GLU 43 H GLU 43 -2.426 2.782 2.856
305 HA GLU 43 HA GLU 43 -2.755 4.759 5.010
306 HB2 GLU 43 1HB GLU 43 -4.701 2.713 3.938
307 HB3 GLU 43 2HB GLU 43 -4.972 3.656 5.395
308 HG2 GLU 43 1HG GLU 43 -4.494 4.899 2.705
309 HG3 GLU 43 2HG GLU 43 -6.099 4.483 3.305
310 H GLU 44 H GLU 44 -2.716 4.012 7.116
311 HA GLU 44 HA GLU 44 -0.992 1.873 7.655
312 HB2 GLU 44 1HB GLU 44 -1.377 3.871 9.102
313 HB3 GLU 44 2HB GLU 44 -2.928 3.189 9.555
314 HG2 GLU 44 1HG GLU 44 -1.704 1.196 10.410
315 HG3 GLU 44 2HG GLU 44 -0.206 2.074 10.127
316 H ASN 45 H ASN 45 -1.320 -0.200 7.829
317 HA ASN 45 HA ASN 45 -2.240 -2.234 8.119
318 HB2 ASN 45 1HB ASN 45 -4.400 -0.658 9.501
319 HB3 ASN 45 2HB ASN 45 -4.459 -2.408 9.346
320 HD21 ASN 45 1HD2 ASN 45 -3.113 0.254 10.994
321 HD22 ASN 45 2HD2 ASN 45 -2.150 -0.634 12.117
322 H GLN 46 H GLN 46 -2.650 -0.666 5.740
323 HA GLN 46 HA GLN 46 -5.211 -1.711 4.761
324 HB2 GLN 46 1HB GLN 46 -4.677 0.681 4.372
325 HB3 GLN 46 2HB GLN 46 -3.265 0.192 3.452
326 HG2 GLN 46 1HG GLN 46 -4.695 -0.923 1.830
327 HG3 GLN 46 2HG GLN 46 -6.118 -0.440 2.750
328 HE21 GLN 46 1HE2 GLN 46 -3.545 0.606 0.699
329 HE22 GLN 46 2HE2 GLN 46 -4.208 2.152 0.309
330 H LYS 47 H LYS 47 -5.288 -3.096 2.973
331 HA LYS 47 HA LYS 47 -2.992 -4.757 2.613
332 HB2 LYS 47 1HB LYS 47 -5.675 -4.709 1.236
333 HB3 LYS 47 2HB LYS 47 -4.433 -5.911 0.917
334 HG2 LYS 47 1HG LYS 47 -5.723 -5.418 3.590
335 HG3 LYS 47 2HG LYS 47 -6.149 -6.715 2.478
336 HD2 LYS 47 1HD LYS 47 -3.380 -6.332 3.602
337 HD3 LYS 47 2HD LYS 47 -4.600 -7.359 4.355
338 HE2 LYS 47 1HE LYS 47 -3.631 -7.682 1.520
339 HE3 LYS 47 2HE LYS 47 -2.983 -8.573 2.891
340 HZ1 LYS 47 1HZ LYS 47 -4.682 -9.818 1.664
341 HZ2 LYS 47 2HZ LYS 47 -5.822 -8.628 2.032
342 HZ3 LYS 47 3HZ LYS 47 -5.134 -9.545 3.271
343 H VAL 48 H VAL 48 -1.826 -5.096 0.692
344 HA VAL 48 HA VAL 48 -2.013 -3.102 -1.395
345 HB VAL 48 HB VAL 48 -0.875 -1.927 0.442
346 HG11 VAL 48 1HG1 VAL 48 1.221 -4.065 0.150
347 HG12 VAL 48 2HG1 VAL 48 0.134 -3.850 1.523
348 HG13 VAL 48 3HG1 VAL 48 1.349 -2.621 1.157
349 HG21 VAL 48 1HG2 VAL 48 -0.349 -1.308 -1.842
350 HG22 VAL 48 2HG2 VAL 48 0.910 -2.539 -1.904
351 HG23 VAL 48 3HG2 VAL 48 1.078 -1.160 -0.818
352 H GLU 49 H GLU 49 -0.686 -3.521 -3.159
353 HA GLU 49 HA GLU 49 0.664 -6.135 -3.217
354 HB2 GLU 49 1HB GLU 49 -1.424 -6.178 -4.472
355 HB3 GLU 49 2HB GLU 49 -0.960 -4.729 -5.343
356 HG2 GLU 49 1HG GLU 49 0.834 -5.921 -6.430
357 HG3 GLU 49 2HG GLU 49 0.451 -7.377 -5.508
358 H PHE 50 H PHE 50 2.711 -6.148 -4.242
359 HA PHE 50 HA PHE 50 3.778 -3.768 -5.457
360 HB2 PHE 50 1HB PHE 50 5.426 -3.338 -3.602
361 HB3 PHE 50 2HB PHE 50 3.760 -2.941 -3.197
362 HD1 PHE 50 HD1 PHE 50 2.456 -4.438 -1.730
363 HD2 PHE 50 HD2 PHE 50 6.613 -5.033 -2.419
364 HE1 PHE 50 HE1 PHE 50 2.561 -5.913 0.225
365 HE2 PHE 50 HE2 PHE 50 6.721 -6.510 -0.456
366 HZ PHE 50 HZ PHE 50 4.697 -6.952 0.865
367 H GLU 51 H GLU 51 6.114 -3.965 -5.898
368 HA GLU 51 HA GLU 51 6.998 -6.774 -5.886
369 HB2 GLU 51 1HB GLU 51 6.848 -5.793 -8.134
370 HB3 GLU 51 2HB GLU 51 7.923 -4.488 -7.641
371 HG2 GLU 51 1HG GLU 51 9.715 -6.090 -7.265
372 HG3 GLU 51 2HG GLU 51 8.643 -7.409 -7.723
373 H ILE 52 H ILE 52 8.608 -7.287 -4.560
374 HA ILE 52 HA ILE 52 9.788 -5.216 -2.957
375 HB ILE 52 HB ILE 52 10.297 -8.190 -2.926
376 HG12 ILE 52 1HG1 ILE 52 8.573 -6.452 -1.157
377 HG13 ILE 52 2HG1 ILE 52 7.971 -7.548 -2.394
378 HG21 ILE 52 1HG2 ILE 52 12.151 -6.898 -1.989
379 HG22 ILE 52 2HG2 ILE 52 11.288 -7.787 -0.730
380 HG23 ILE 52 3HG2 ILE 52 11.022 -6.055 -0.929
381 HD11 ILE 52 1HD1 ILE 52 8.888 -9.440 -1.162
382 HD12 ILE 52 2HD1 ILE 52 7.755 -8.509 -0.180
383 HD13 ILE 52 3HD1 ILE 52 9.491 -8.338 0.076
384 H GLY 53 H GLY 53 11.404 -4.068 -3.670
385 HA2 GLY 53 1HA GLY 53 13.562 -5.412 -5.173
386 HA3 GLY 53 2HA GLY 53 13.185 -3.695 -5.288
387 H GLU 54 H GLU 54 15.550 -3.552 -4.795
388 HA GLU 54 HA GLU 54 16.091 -3.944 -1.937
389 HB2 GLU 54 1HB GLU 54 17.605 -4.987 -3.665
390 HB3 GLU 54 2HB GLU 54 18.084 -3.361 -4.123
391 HG2 GLU 54 1HG GLU 54 19.714 -4.352 -2.636
392 HG3 GLU 54 2HG GLU 54 18.930 -2.969 -1.868
393 H GLY 55 H GLY 55 16.619 -2.260 -0.636
394 HA2 GLY 55 1HA GLY 55 16.575 0.420 -1.875
395 HA3 GLY 55 2HA GLY 55 15.730 0.055 -0.379
396 H ALA 56 H ALA 56 16.936 1.811 0.523
397 HA ALA 56 HA ALA 56 19.750 1.886 0.606
398 HB1 ALA 56 1HB ALA 56 17.795 3.147 2.521
399 HB2 ALA 56 2HB ALA 56 18.312 3.840 0.985
400 HB3 ALA 56 3HB ALA 56 19.481 3.609 2.284
401 H LYS 57 H LYS 57 17.449 1.016 3.198
402 HA LYS 57 HA LYS 57 19.681 -0.246 4.624
403 HB2 LYS 57 1HB LYS 57 18.517 1.481 5.878
404 HB3 LYS 57 2HB LYS 57 16.979 0.680 5.610
405 HG2 LYS 57 1HG LYS 57 17.787 0.295 7.865
406 HG3 LYS 57 2HG LYS 57 17.720 -1.215 6.953
407 HD2 LYS 57 1HD LYS 57 20.136 -1.038 6.521
408 HD3 LYS 57 2HD LYS 57 20.187 0.441 7.480
409 HE2 LYS 57 1HE LYS 57 19.342 -2.270 8.492
410 HE3 LYS 57 2HE LYS 57 20.924 -1.538 8.748
411 HZ1 LYS 57 1HZ LYS 57 19.813 0.287 9.926
412 HZ2 LYS 57 2HZ LYS 57 19.548 -1.209 10.668
413 HZ3 LYS 57 3HZ LYS 57 18.325 -0.501 9.742
414 H GLY 58 H GLY 58 16.618 -0.866 3.134
415 HA2 GLY 58 1HA GLY 58 17.060 -3.719 3.376
416 HA3 GLY 58 2HA GLY 58 15.621 -3.112 4.185
417 HA PRO 59 HA PRO 59 14.538 -4.152 -0.233
418 HB2 PRO 59 1HB PRO 59 12.158 -5.303 0.458
419 HB3 PRO 59 2HB PRO 59 13.671 -6.198 0.315
420 HG2 PRO 59 1HG PRO 59 12.323 -5.129 2.758
421 HG3 PRO 59 2HG PRO 59 13.110 -6.696 2.513
422 HD2 PRO 59 1HD PRO 59 14.332 -4.695 3.812
423 HD3 PRO 59 2HD PRO 59 15.231 -5.810 2.764
424 H GLN 60 H GLN 60 13.045 -3.061 -1.492
425 HA GLN 60 HA GLN 60 11.335 -1.149 -0.049
426 HB2 GLN 60 1HB GLN 60 11.774 0.529 -1.747
427 HB3 GLN 60 2HB GLN 60 13.283 0.001 -1.016
428 HG2 GLN 60 1HG GLN 60 13.787 -1.367 -2.933
429 HG3 GLN 60 2HG GLN 60 12.225 -0.983 -3.654
430 HE21 GLN 60 1HE2 GLN 60 14.172 1.358 -1.959
431 HE22 GLN 60 2HE2 GLN 60 14.593 2.298 -3.343
432 H ALA 61 H ALA 61 9.327 -0.838 -0.783
433 HA ALA 61 HA ALA 61 8.242 -2.812 -2.564
434 HB1 ALA 61 1HB ALA 61 7.004 -2.086 -0.579
435 HB2 ALA 61 2HB ALA 61 6.090 -1.776 -2.056
436 HB3 ALA 61 3HB ALA 61 6.913 -0.450 -1.236
437 H GLN 62 H GLN 62 8.314 -2.631 -4.661
438 HA GLN 62 HA GLN 62 8.390 0.050 -5.878
439 HB2 GLN 62 1HB GLN 62 9.345 -2.575 -7.023
440 HB3 GLN 62 2HB GLN 62 9.562 -0.983 -7.737
441 HG2 GLN 62 1HG GLN 62 11.051 -0.325 -5.993
442 HG3 GLN 62 2HG GLN 62 10.708 -1.791 -5.079
443 HE21 GLN 62 1HE2 GLN 62 10.743 -3.461 -7.476
444 HE22 GLN 62 2HE2 GLN 62 12.404 -3.636 -7.908
445 H GLN 63 H GLN 63 7.020 0.495 -7.589
446 HA GLN 63 HA GLN 63 5.053 0.455 -8.713
447 HB2 GLN 63 1HB GLN 63 5.800 -2.459 -8.931
448 HB3 GLN 63 2HB GLN 63 4.416 -1.763 -9.751
449 HG2 GLN 63 1HG GLN 63 6.022 -1.751 -11.394
450 HG3 GLN 63 2HG GLN 63 6.134 -0.115 -10.749
451 HE21 GLN 63 1HE2 GLN 63 7.969 0.508 -9.666
452 HE22 GLN 63 2HE2 GLN 63 9.410 -0.444 -9.627
453 H VAL 64 H VAL 64 4.536 0.771 -6.241
454 HA VAL 64 HA VAL 64 3.161 -1.410 -4.966
455 HB VAL 64 HB VAL 64 3.124 1.441 -4.032
456 HG11 VAL 64 1HG1 VAL 64 3.018 -1.208 -2.625
457 HG12 VAL 64 2HG1 VAL 64 1.727 -0.017 -2.772
458 HG13 VAL 64 3HG1 VAL 64 3.159 0.346 -1.807
459 HG21 VAL 64 1HG2 VAL 64 5.218 0.992 -2.817
460 HG22 VAL 64 2HG2 VAL 64 5.432 0.978 -4.568
461 HG23 VAL 64 3HG2 VAL 64 5.361 -0.543 -3.677
462 H HIS 65 H HIS 65 1.097 -1.889 -5.179
463 HA HIS 65 HA HIS 65 -0.780 0.225 -6.012
464 HB2 HIS 65 1HB HIS 65 -0.773 -2.709 -6.709
465 HB3 HIS 65 2HB HIS 65 -2.169 -1.672 -6.951
466 HD1 HIS 65 HD1 HIS 65 -2.186 -0.197 -9.001
467 HD2 HIS 65 HD2 HIS 65 1.435 -2.144 -8.407
468 HE1 HIS 65 HE1 HIS 65 -0.871 0.171 -11.108
469 HE2 HIS 65 HE2 HIS 65 1.217 -1.206 -10.809
470 H ALA 66 H ALA 66 -2.268 0.682 -4.545
471 HA ALA 66 HA ALA 66 -2.429 -0.790 -2.111
472 HB1 ALA 66 1HB ALA 66 -4.208 1.418 -3.134
473 HB2 ALA 66 2HB ALA 66 -2.732 1.640 -2.195
474 HB3 ALA 66 3HB ALA 66 -4.124 0.831 -1.472
475 H LEU 67 H LEU 67 -3.884 -2.247 -1.445
476 HA LEU 67 HA LEU 67 -5.803 -3.222 -3.433
477 HB2 LEU 67 1HB LEU 67 -4.746 -4.477 -0.899
478 HB3 LEU 67 2HB LEU 67 -5.922 -5.226 -1.960
479 HG LEU 67 HG LEU 67 -3.069 -4.545 -2.679
480 HD11 LEU 67 1HD1 LEU 67 -4.402 -7.217 -2.269
481 HD12 LEU 67 2HD1 LEU 67 -3.317 -6.435 -1.121
482 HD13 LEU 67 3HD1 LEU 67 -2.715 -6.934 -2.701
483 HD21 LEU 67 1HD2 LEU 67 -3.540 -5.802 -4.747
484 HD22 LEU 67 2HD2 LEU 67 -4.498 -4.328 -4.620
485 HD23 LEU 67 3HD2 LEU 67 -5.239 -5.893 -4.285
486 H GLY 68 H GLY 68 -6.383 -0.828 -2.123
487 HA2 GLY 68 1HA GLY 68 -8.391 -1.525 -0.103
488 HA3 GLY 68 2HA GLY 68 -7.779 0.091 -0.431
489 H GLY 69 H GLY 69 -10.467 -0.311 -0.220
490 HA2 GLY 69 1HA GLY 69 -11.683 -0.872 -2.748
491 HA3 GLY 69 2HA GLY 69 -12.483 -0.217 -1.327
492 H GLU 70 H GLU 70 -11.100 0.464 -4.371
493 HA GLU 70 HA GLU 70 -11.142 3.341 -3.957
494 HB2 GLU 70 1HB GLU 70 -9.342 2.313 -5.313
495 HB3 GLU 70 2HB GLU 70 -10.549 1.752 -6.462
496 HG2 GLU 70 1HG GLU 70 -11.189 4.135 -6.831
497 HG3 GLU 70 2HG GLU 70 -9.813 4.598 -5.830
498 H ASN 71 H ASN 71 -13.295 3.764 -3.608
499 HA ASN 71 HA ASN 71 -15.304 2.838 -5.451
500 HB2 ASN 71 1HB ASN 71 -15.470 4.769 -3.128
501 HB3 ASN 71 2HB ASN 71 -16.853 4.206 -4.059
502 HD21 ASN 71 1HD2 ASN 71 -17.863 3.210 -2.359
503 HD22 ASN 71 2HD2 ASN 71 -17.242 1.788 -1.591
504 H LEU 72 H LEU 72 -15.690 3.775 -7.328
505 HA LEU 72 HA LEU 72 -14.470 6.320 -7.938
506 HB2 LEU 72 1HB LEU 72 -16.111 4.454 -9.652
507 HB3 LEU 72 2HB LEU 72 -15.283 5.883 -10.233
508 HG LEU 72 HG LEU 72 -13.954 3.437 -9.064
509 HD11 LEU 72 1HD1 LEU 72 -14.886 3.026 -11.270
510 HD12 LEU 72 2HD1 LEU 72 -13.125 3.100 -11.342
511 HD13 LEU 72 3HD1 LEU 72 -14.090 4.471 -11.891
512 HD21 LEU 72 1HD2 LEU 72 -12.698 5.456 -8.561
513 HD22 LEU 72 2HD2 LEU 72 -12.775 5.944 -10.254
514 HD23 LEU 72 3HD2 LEU 72 -11.869 4.502 -9.791
515 H TYR 73 H TYR 73 -15.917 7.398 -6.314
516 HA TYR 73 HA TYR 73 -18.596 7.939 -7.350
517 HB2 TYR 73 1HB TYR 73 -17.275 8.913 -4.810
518 HB3 TYR 73 2HB TYR 73 -18.948 9.192 -5.267
519 HD1 TYR 73 HD1 TYR 73 -19.307 6.292 -6.399
520 HD2 TYR 73 HD2 TYR 73 -17.837 7.859 -2.728
521 HE1 TYR 73 HE1 TYR 73 -19.971 4.222 -5.255
522 HE2 TYR 73 HE2 TYR 73 -18.490 5.792 -1.578
523 HH TYR 73 HH TYR 73 -20.143 3.943 -1.912
524 H PHE 74 H PHE 74 -18.189 9.156 -9.147
525 HA PHE 74 HA PHE 74 -16.429 11.417 -9.074
526 HB2 PHE 74 1HB PHE 74 -18.472 10.608 -11.155
527 HB3 PHE 74 2HB PHE 74 -17.218 11.829 -11.363
528 HD1 PHE 74 HD1 PHE 74 -18.040 8.402 -11.720
529 HD2 PHE 74 HD2 PHE 74 -14.780 11.050 -11.044
530 HE1 PHE 74 HE1 PHE 74 -16.471 6.657 -12.461
531 HE2 PHE 74 HE2 PHE 74 -13.208 9.316 -11.791
532 HZ PHE 74 HZ PHE 74 -14.053 7.114 -12.500
533 H GLN 75 H GLN 75 -19.684 10.797 -8.308
534 HA GLN 75 HA GLN 75 -20.265 13.663 -8.080
535 HB2 GLN 75 1HB GLN 75 -22.573 12.983 -7.637
536 HB3 GLN 75 2HB GLN 75 -22.002 12.289 -9.147
537 HG2 GLN 75 1HG GLN 75 -21.632 10.154 -8.042
538 HG3 GLN 75 2HG GLN 75 -22.160 10.846 -6.510
539 HE21 GLN 75 1HE2 GLN 75 -24.336 11.315 -6.206
540 HE22 GLN 75 2HE2 GLN 75 -25.567 10.649 -7.221
541 H GLY 76 H GLY 76 -21.301 14.344 -5.992
542 HA2 GLY 76 1HA GLY 76 -21.397 14.329 -3.659
543 HA3 GLY 76 2HA GLY 76 -20.585 12.769 -3.658
544 H HIS 77 H HIS 77 -18.326 12.685 -3.714
545 HA HIS 77 HA HIS 77 -16.996 15.217 -3.088
546 HB2 HIS 77 1HB HIS 77 -15.152 13.931 -2.233
547 HB3 HIS 77 2HB HIS 77 -16.631 13.252 -1.572
548 HD1 HIS 77 HD1 HIS 77 -17.210 10.832 -2.215
549 HD2 HIS 77 HD2 HIS 77 -13.762 12.269 -4.039
550 HE1 HIS 77 HE1 HIS 77 -16.050 8.814 -3.163
551 HE2 HIS 77 HE2 HIS 77 -14.098 9.741 -4.448
552 H HIS 78 H HIS 78 -14.830 15.584 -4.105
553 HA HIS 78 HA HIS 78 -14.997 14.798 -6.938
554 HB2 HIS 78 1HB HIS 78 -15.415 17.212 -6.447
555 HB3 HIS 78 2HB HIS 78 -13.788 17.324 -5.790
556 HD1 HIS 78 HD1 HIS 78 -12.273 18.384 -7.416
557 HD2 HIS 78 HD2 HIS 78 -15.162 16.066 -9.292
558 HE1 HIS 78 HE1 HIS 78 -11.791 18.561 -9.874
559 HE2 HIS 78 HE2 HIS 78 -13.429 16.994 -10.968
560 H HIS 79 H HIS 79 -13.387 13.594 -7.687
561 HA HIS 79 HA HIS 79 -11.027 13.078 -6.171
562 HB2 HIS 79 1HB HIS 79 -11.932 11.366 -7.655
563 HB3 HIS 79 2HB HIS 79 -11.721 12.420 -9.047
564 HD1 HIS 79 HD1 HIS 79 -9.502 12.341 -10.212
565 HD2 HIS 79 HD2 HIS 79 -9.436 10.409 -6.533
566 HE1 HIS 79 HE1 HIS 79 -7.276 11.181 -10.100
567 HE2 HIS 79 HE2 HIS 79 -7.315 9.898 -7.935
568 H HIS 80 H HIS 80 -9.731 14.776 -5.837
569 HA HIS 80 HA HIS 80 -8.729 16.188 -8.212
570 HB2 HIS 80 1HB HIS 80 -10.217 17.693 -7.001
571 HB3 HIS 80 2HB HIS 80 -9.360 17.373 -5.498
572 HD1 HIS 80 HD1 HIS 80 -8.978 19.177 -8.781
573 HD2 HIS 80 HD2 HIS 80 -7.061 18.864 -5.104
574 HE1 HIS 80 HE1 HIS 80 -7.228 20.976 -8.774
575 HE2 HIS 80 HE2 HIS 80 -5.941 20.617 -6.638
576 H HIS 81 H HIS 81 -6.757 15.393 -8.471
577 HA HIS 81 HA HIS 81 -5.044 14.433 -6.474
578 HB2 HIS 81 1HB HIS 81 -3.304 14.457 -8.147
579 HB3 HIS 81 2HB HIS 81 -4.805 13.973 -8.924
580 HD1 HIS 81 HD1 HIS 81 -2.002 16.103 -9.427
581 HD2 HIS 81 HD2 HIS 81 -6.065 16.389 -10.249
582 HE1 HIS 81 HE1 HIS 81 -2.216 17.899 -11.172
583 HE2 HIS 81 HE2 HIS 81 -4.655 17.892 -11.806
584 H HIS 82 H HIS 82 -3.197 15.355 -5.508
585 HA HIS 82 HA HIS 82 -3.641 18.027 -4.622
586 HB2 HIS 82 1HB HIS 82 -2.723 16.248 -3.162
587 HB3 HIS 82 2HB HIS 82 -1.259 16.223 -4.137
588 HD1 HIS 82 HD1 HIS 82 -3.127 18.390 -1.690
589 HD2 HIS 82 HD2 HIS 82 0.586 18.192 -3.548
590 HE1 HIS 82 HE1 HIS 82 -1.708 20.124 -0.554
591 HE2 HIS 82 HE2 HIS 82 0.580 19.853 -1.568