Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
522913 | 2l8d RC | 17402 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 5.266 -6.262 -2.761
2 HA2 GLY 1 2HA GLY 1 5.623 -5.155 -4.810
3 HA3 GLY 1 1HA GLY 1 3.880 -4.967 -5.001
4 H ALA 2 H ALA 2 6.605 -3.410 -4.105
5 HA ALA 2 HA ALA 2 5.275 -1.750 -2.097
6 HB1 ALA 2 1HB ALA 2 7.491 -0.791 -1.705
7 HB2 ALA 2 2HB ALA 2 8.151 -1.756 -3.023
8 HB3 ALA 2 3HB ALA 2 7.542 -2.550 -1.571
9 H MET 3 H MET 3 5.964 -1.890 -5.382
10 HA MET 3 HA MET 3 5.562 -0.603 -7.129
11 HB2 MET 3 1HB MET 3 4.201 1.188 -5.130
12 HB3 MET 3 2HB MET 3 4.388 1.693 -6.800
13 HG2 MET 3 1HG MET 3 2.197 0.734 -6.448
14 HG3 MET 3 2HG MET 3 3.137 -0.275 -7.539
15 HE1 MET 3 3HE MET 3 0.481 -1.321 -6.292
16 HE2 MET 3 1HE MET 3 0.950 -2.941 -5.781
17 HE3 MET 3 2HE MET 3 1.539 -2.300 -7.314
18 H GLY 4 H GLY 4 6.752 1.530 -4.588
19 HA2 GLY 4 1HA GLY 4 8.634 2.635 -6.546
20 HA3 GLY 4 2HA GLY 4 8.269 3.320 -4.957
21 H MET 5 H MET 5 10.011 0.820 -6.673
22 HA MET 5 HA MET 5 11.907 0.631 -4.511
23 HB2 MET 5 1HB MET 5 10.032 -0.884 -3.803
24 HB3 MET 5 2HB MET 5 10.324 -1.842 -5.243
25 HG2 MET 5 1HG MET 5 11.357 -2.969 -3.444
26 HG3 MET 5 2HG MET 5 12.651 -2.233 -4.384
27 HE1 MET 5 3HE MET 5 13.983 -2.094 -0.692
28 HE2 MET 5 1HE MET 5 14.309 -2.629 -2.342
29 HE3 MET 5 2HE MET 5 12.991 -3.360 -1.425
30 HA PRO 6 HA PRO 6 13.794 -0.501 -8.613
31 HB2 PRO 6 1HB PRO 6 15.696 1.421 -8.696
32 HB3 PRO 6 2HB PRO 6 14.058 1.699 -9.298
33 HG2 PRO 6 1HG PRO 6 15.274 2.508 -6.684
34 HG3 PRO 6 2HG PRO 6 14.207 3.432 -7.754
35 HD2 PRO 6 1HD PRO 6 13.339 2.149 -5.506
36 HD3 PRO 6 2HD PRO 6 12.311 2.437 -6.922
37 H ASN 7 H ASN 7 14.873 0.141 -5.433
38 HA ASN 7 HA ASN 7 16.557 -2.030 -5.027
39 HB2 ASN 7 1HB ASN 7 18.154 -0.856 -6.581
40 HB3 ASN 7 2HB ASN 7 18.115 0.549 -5.531
41 HD21 ASN 7 2HD2 ASN 7 19.354 -2.658 -5.970
42 HD22 ASN 7 1HD2 ASN 7 20.484 -2.619 -4.667
43 H ARG 8 H ARG 8 16.390 1.392 -4.518
44 HA ARG 8 HA ARG 8 15.949 1.026 -1.638
45 HB2 ARG 8 1HB ARG 8 16.391 3.559 -3.274
46 HB3 ARG 8 2HB ARG 8 16.097 3.530 -1.553
47 HG2 ARG 8 1HG ARG 8 18.361 3.911 -1.765
48 HG3 ARG 8 2HG ARG 8 18.252 2.199 -1.381
49 HD2 ARG 8 1HD ARG 8 19.873 2.562 -3.087
50 HD3 ARG 8 2HD ARG 8 18.492 1.687 -3.764
51 HE ARG 8 HE ARG 8 17.877 4.202 -4.376
52 HH11 ARG 8 1HH1 ARG 8 20.927 2.453 -4.736
53 HH12 ARG 8 2HH1 ARG 8 21.474 3.330 -6.070
54 HH21 ARG 8 1HH2 ARG 8 18.655 5.454 -6.217
55 HH22 ARG 8 2HH2 ARG 8 20.161 5.115 -6.920
56 H LYS 9 H LYS 9 14.256 3.195 -1.265
57 HA LYS 9 HA LYS 9 11.892 2.299 -2.661
58 HB2 LYS 9 1HB LYS 9 11.759 2.920 -0.292
59 HB3 LYS 9 2HB LYS 9 12.300 4.546 -0.668
60 HG2 LYS 9 1HG LYS 9 10.259 5.016 -1.860
61 HG3 LYS 9 2HG LYS 9 9.722 3.347 -1.682
62 HD2 LYS 9 1HD LYS 9 10.276 5.180 0.650
63 HD3 LYS 9 2HD LYS 9 8.684 4.992 -0.079
64 HE2 LYS 9 1HE LYS 9 10.309 2.724 1.099
65 HE3 LYS 9 2HE LYS 9 9.012 3.561 1.933
66 HZ1 LYS 9 3HZ LYS 9 8.236 1.523 0.911
67 HZ2 LYS 9 1HZ LYS 9 8.708 2.064 -0.608
68 HZ3 LYS 9 2HZ LYS 9 7.490 2.860 0.219
69 H TYR 10 H TYR 10 14.206 4.852 -2.824
70 HA TYR 10 HA TYR 10 12.898 5.844 -5.245
71 HB2 TYR 10 1HB TYR 10 14.371 7.477 -3.162
72 HB3 TYR 10 2HB TYR 10 13.839 8.100 -4.725
73 HD1 TYR 10 HD1 TYR 10 11.512 8.379 -5.205
74 HD2 TYR 10 HD2 TYR 10 12.780 7.002 -1.417
75 HE1 TYR 10 HE1 TYR 10 9.240 8.742 -4.331
76 HE2 TYR 10 HE2 TYR 10 10.553 7.343 -0.514
77 HH TYR 10 HH TYR 10 8.519 8.709 -1.038
78 H ALA 11 H ALA 11 14.387 6.885 -6.765
79 HA ALA 11 HA ALA 11 16.740 5.241 -7.121
80 HB1 ALA 11 1HB ALA 11 15.505 7.422 -8.817
81 HB2 ALA 11 2HB ALA 11 15.272 5.687 -9.023
82 HB3 ALA 11 3HB ALA 11 16.856 6.405 -9.313
83 H ASP 12 H ASP 12 18.504 7.003 -8.357
84 HA ASP 12 HA ASP 12 18.876 9.132 -6.419
85 HB2 ASP 12 1HB ASP 12 21.306 8.812 -6.317
86 HB3 ASP 12 2HB ASP 12 20.495 7.339 -5.818
87 H GLY 13 H GLY 13 19.541 11.087 -7.216
88 HA2 GLY 13 1HA GLY 13 20.115 12.598 -8.878
89 HA3 GLY 13 2HA GLY 13 19.980 11.318 -10.087
90 H GLU 14 H GLU 14 17.433 10.851 -8.220
91 HA GLU 14 HA GLU 14 15.630 11.821 -10.220
92 HB2 GLU 14 1HB GLU 14 15.427 9.566 -9.487
93 HB3 GLU 14 2HB GLU 14 15.354 10.044 -7.807
94 HG2 GLU 14 1HG GLU 14 13.170 10.782 -8.003
95 HG3 GLU 14 2HG GLU 14 13.254 10.880 -9.759
96 H VAL 15 H VAL 15 14.121 13.461 -9.980
97 HA VAL 15 HA VAL 15 14.331 14.965 -7.508
98 HB VAL 15 HB VAL 15 14.475 16.337 -9.514
99 HG11 VAL 15 1HG1 VAL 15 12.658 16.527 -11.125
100 HG12 VAL 15 2HG1 VAL 15 11.817 15.200 -10.308
101 HG13 VAL 15 3HG1 VAL 15 13.383 14.918 -11.076
102 HG21 VAL 15 3HG2 VAL 15 13.319 17.381 -7.636
103 HG22 VAL 15 1HG2 VAL 15 11.782 16.743 -8.213
104 HG23 VAL 15 2HG2 VAL 15 12.649 17.946 -9.167
105 H VAL 16 H VAL 16 12.878 15.022 -6.010
106 HA VAL 16 HA VAL 16 10.294 13.715 -6.367
107 HB VAL 16 HB VAL 16 10.668 12.595 -4.092
108 HG11 VAL 16 1HG1 VAL 16 12.378 11.709 -6.410
109 HG12 VAL 16 2HG1 VAL 16 10.674 11.307 -6.171
110 HG13 VAL 16 3HG1 VAL 16 11.897 10.687 -5.056
111 HG21 VAL 16 3HG2 VAL 16 13.539 13.260 -4.758
112 HG22 VAL 16 1HG2 VAL 16 13.022 12.152 -3.482
113 HG23 VAL 16 2HG2 VAL 16 12.607 13.863 -3.387
114 H MET 17 H MET 17 9.211 13.907 -3.974
115 HA MET 17 HA MET 17 9.544 16.715 -3.167
116 HB2 MET 17 1HB MET 17 7.184 14.850 -2.729
117 HB3 MET 17 2HB MET 17 7.288 16.496 -2.142
118 HG2 MET 17 1HG MET 17 7.185 15.632 -5.020
119 HG3 MET 17 2HG MET 17 5.859 16.312 -4.095
120 HE1 MET 17 3HE MET 17 7.053 20.010 -3.527
121 HE2 MET 17 1HE MET 17 7.329 18.649 -2.441
122 HE3 MET 17 2HE MET 17 5.772 18.834 -3.245
123 H GLY 18 H GLY 18 10.204 17.038 -1.109
124 HA2 GLY 18 1HA GLY 18 10.379 14.650 0.639
125 HA3 GLY 18 2HA GLY 18 11.733 15.664 0.377
126 H ARG 19 H ARG 19 9.830 15.019 2.637
127 HA ARG 19 HA ARG 19 8.575 17.455 3.450
128 HB2 ARG 19 1HB ARG 19 7.817 15.186 4.120
129 HB3 ARG 19 2HB ARG 19 9.295 14.978 5.034
130 HG2 ARG 19 1HG ARG 19 8.586 17.015 6.362
131 HG3 ARG 19 2HG ARG 19 7.012 16.841 5.580
132 HD2 ARG 19 1HD ARG 19 8.412 14.734 7.208
133 HD3 ARG 19 2HD ARG 19 7.092 15.750 7.782
134 HE ARG 19 HE ARG 19 5.798 14.620 5.904
135 HH11 ARG 19 1HH1 ARG 19 8.552 12.941 7.408
136 HH12 ARG 19 2HH1 ARG 19 7.751 11.454 7.549
137 HH21 ARG 19 1HH2 ARG 19 4.731 12.462 6.017
138 HH22 ARG 19 2HH2 ARG 19 5.577 11.166 6.692
139 H TRP 20 H TRP 20 9.349 18.954 4.887
140 HA TRP 20 HA TRP 20 12.181 18.932 5.422
141 HB2 TRP 20 1HB TRP 20 10.813 21.050 4.893
142 HB3 TRP 20 2HB TRP 20 10.143 20.906 6.515
143 HD1 TRP 20 HD1 TRP 20 11.787 21.461 8.578
144 HE1 TRP 20 HE1 TRP 20 14.057 22.704 8.680
145 HE3 TRP 20 HE3 TRP 20 12.926 21.528 3.607
146 HZ2 TRP 20 HZ2 TRP 20 16.035 23.584 6.896
147 HZ3 TRP 20 HZ3 TRP 20 15.029 22.597 2.887
148 HH2 TRP 20 HH2 TRP 20 16.529 23.587 4.451
149 HA PRO 21 HA PRO 21 12.060 16.194 8.895
150 HB2 PRO 21 1HB PRO 21 13.884 18.175 10.128
151 HB3 PRO 21 2HB PRO 21 14.056 16.431 9.953
152 HG2 PRO 21 1HG PRO 21 15.275 18.279 8.337
153 HG3 PRO 21 2HG PRO 21 14.956 16.600 7.884
154 HD2 PRO 21 1HD PRO 21 13.784 19.017 6.825
155 HD3 PRO 21 2HD PRO 21 13.556 17.349 6.279
156 H GLY 22 H GLY 22 11.994 19.633 9.902
157 HA2 GLY 22 1HA GLY 22 10.614 18.841 12.341
158 HA3 GLY 22 2HA GLY 22 11.208 20.446 11.957
159 H SER 23 H SER 23 9.599 19.668 9.264
160 HA SER 23 HA SER 23 7.112 20.830 10.280
161 HB2 SER 23 1HB SER 23 8.434 22.377 8.872
162 HB3 SER 23 2HB SER 23 8.433 21.188 7.577
163 HG SER 23 HG SER 23 6.615 23.036 8.162
164 H VAL 24 H VAL 24 5.338 20.390 8.517
165 HA VAL 24 HA VAL 24 5.473 17.573 7.666
166 HB VAL 24 HB VAL 24 3.015 17.631 7.459
167 HG11 VAL 24 1HG1 VAL 24 3.951 16.873 9.535
168 HG12 VAL 24 2HG1 VAL 24 2.460 17.763 9.842
169 HG13 VAL 24 3HG1 VAL 24 4.022 18.522 10.146
170 HG21 VAL 24 3HG2 VAL 24 3.229 20.455 8.534
171 HG22 VAL 24 1HG2 VAL 24 1.724 19.547 8.360
172 HG23 VAL 24 2HG2 VAL 24 2.667 19.977 6.936
173 H LEU 25 H LEU 25 6.057 20.517 6.561
174 HA LEU 25 HA LEU 25 4.720 20.589 4.055
175 HB2 LEU 25 1HB LEU 25 7.096 22.014 5.076
176 HB3 LEU 25 2HB LEU 25 6.374 22.278 3.501
177 HG LEU 25 HG LEU 25 5.222 22.893 6.203
178 HD11 LEU 25 1HD1 LEU 25 6.696 24.468 5.139
179 HD12 LEU 25 2HD1 LEU 25 4.997 25.066 5.084
180 HD13 LEU 25 3HD1 LEU 25 5.730 24.231 3.679
181 HD21 LEU 25 3HD2 LEU 25 3.414 21.830 4.941
182 HD22 LEU 25 1HD2 LEU 25 3.805 22.834 3.537
183 HD23 LEU 25 2HD2 LEU 25 3.175 23.576 5.007
184 H TYR 26 H TYR 26 5.432 20.147 2.100
185 HA TYR 26 HA TYR 26 7.887 18.574 1.875
186 HB2 TYR 26 1HB TYR 26 5.263 18.343 0.402
187 HB3 TYR 26 2HB TYR 26 6.750 17.681 -0.253
188 HD1 TYR 26 HD2 TYR 26 4.595 17.541 2.798
189 HD2 TYR 26 HD1 TYR 26 7.372 15.528 0.293
190 HE1 TYR 26 HE2 TYR 26 4.257 15.463 4.090
191 HE2 TYR 26 HE1 TYR 26 7.038 13.463 1.565
192 HH TYR 26 HH TYR 26 6.257 12.751 3.807
193 H TYR 27 H TYR 27 9.367 19.275 0.584
194 HA TYR 27 HA TYR 27 8.719 21.458 -1.250
195 HB2 TYR 27 1HB TYR 27 11.137 20.971 0.448
196 HB3 TYR 27 2HB TYR 27 11.208 22.059 -0.934
197 HD1 TYR 27 HD2 TYR 27 9.807 21.550 2.457
198 HD2 TYR 27 HD1 TYR 27 10.187 24.232 -0.827
199 HE1 TYR 27 HE2 TYR 27 8.980 23.400 3.870
200 HE2 TYR 27 HE1 TYR 27 9.376 26.071 0.567
201 HH TYR 27 HH TYR 27 9.122 25.831 3.943
202 H GLU 28 H GLU 28 10.643 21.523 -2.950
203 HA GLU 28 HA GLU 28 10.497 18.856 -4.115
204 HB2 GLU 28 1HB GLU 28 9.574 20.753 -5.398
205 HB3 GLU 28 2HB GLU 28 11.153 21.526 -5.374
206 HG2 GLU 28 1HG GLU 28 12.072 19.743 -6.722
207 HG3 GLU 28 2HG GLU 28 10.540 18.876 -6.668
208 H VAL 29 H VAL 29 12.268 17.651 -4.289
209 HA VAL 29 HA VAL 29 14.877 18.931 -3.874
210 HB VAL 29 HB VAL 29 15.551 17.156 -2.326
211 HG11 VAL 29 1HG1 VAL 29 13.061 18.561 -1.424
212 HG12 VAL 29 2HG1 VAL 29 14.704 19.194 -1.366
213 HG13 VAL 29 3HG1 VAL 29 14.254 17.807 -0.370
214 HG21 VAL 29 3HG2 VAL 29 12.678 16.241 -2.453
215 HG22 VAL 29 1HG2 VAL 29 13.894 15.637 -1.323
216 HG23 VAL 29 2HG2 VAL 29 14.088 15.370 -3.056
217 H GLN 30 H GLN 30 16.642 17.520 -4.501
218 HA GLN 30 HA GLN 30 15.790 15.347 -6.291
219 HB2 GLN 30 1HB GLN 30 16.741 17.345 -7.482
220 HB3 GLN 30 2HB GLN 30 18.228 17.122 -6.578
221 HG2 GLN 30 1HG GLN 30 18.462 14.875 -7.621
222 HG3 GLN 30 2HG GLN 30 17.024 15.219 -8.566
223 HE21 GLN 30 2HE2 GLN 30 18.204 15.033 -10.484
224 HE22 GLN 30 1HE2 GLN 30 19.252 16.317 -10.998
225 H VAL 31 H VAL 31 16.631 13.453 -5.805
226 HA VAL 31 HA VAL 31 18.143 13.202 -3.391
227 HB VAL 31 HB VAL 31 16.399 11.517 -3.994
228 HG11 VAL 31 1HG1 VAL 31 16.785 9.861 -5.667
229 HG12 VAL 31 2HG1 VAL 31 18.072 10.903 -6.313
230 HG13 VAL 31 3HG1 VAL 31 16.416 11.483 -6.235
231 HG21 VAL 31 3HG2 VAL 31 19.155 10.299 -3.876
232 HG22 VAL 31 1HG2 VAL 31 17.643 9.469 -3.521
233 HG23 VAL 31 2HG2 VAL 31 18.192 10.784 -2.480
234 H THR 32 H THR 32 20.323 13.082 -3.111
235 HA THR 32 HA THR 32 21.863 12.916 -5.527
236 HB THR 32 HB THR 32 23.588 13.923 -3.991
237 HG1 THR 32 HG1 THR 32 22.885 14.880 -2.143
238 HG21 THR 32 3HG2 THR 32 21.105 15.522 -4.630
239 HG22 THR 32 1HG2 THR 32 22.454 15.232 -5.727
240 HG23 THR 32 2HG2 THR 32 22.690 16.211 -4.281
241 H SER 33 H SER 33 21.656 11.733 -2.154
242 HA SER 33 HA SER 33 23.211 9.416 -2.970
243 HB2 SER 33 1HB SER 33 24.119 11.220 -0.708
244 HB3 SER 33 2HB SER 33 24.848 9.666 -1.134
245 HG SER 33 HG SER 33 24.709 10.987 -3.344
246 H TYR 34 H TYR 34 23.543 7.994 -0.699
247 HA TYR 34 HA TYR 34 21.095 8.013 0.796
248 HB2 TYR 34 1HB TYR 34 20.182 7.005 -1.116
249 HB3 TYR 34 2HB TYR 34 21.624 6.056 -1.418
250 HD1 TYR 34 HD1 TYR 34 18.795 6.396 1.009
251 HD2 TYR 34 HD2 TYR 34 21.697 3.845 -0.773
252 HE1 TYR 34 HE1 TYR 34 17.735 4.440 2.072
253 HE2 TYR 34 HE2 TYR 34 20.659 1.903 0.289
254 HH TYR 34 HH TYR 34 19.250 1.320 2.004
255 H ASP 35 H ASP 35 21.490 7.304 2.719
256 HA ASP 35 HA ASP 35 23.853 5.701 3.431
257 HB2 ASP 35 1HB ASP 35 23.116 7.647 4.870
258 HB3 ASP 35 2HB ASP 35 21.576 6.828 5.087
259 H ASP 36 H ASP 36 23.636 3.539 3.513
260 HA ASP 36 HA ASP 36 20.952 2.473 3.052
261 HB2 ASP 36 1HB ASP 36 22.000 0.497 2.216
262 HB3 ASP 36 2HB ASP 36 22.816 1.883 1.500
263 H ALA 37 H ALA 37 23.157 2.811 5.544
264 HA ALA 37 HA ALA 37 22.537 0.330 6.852
265 HB1 ALA 37 1HB ALA 37 24.751 1.355 7.121
266 HB2 ALA 37 2HB ALA 37 23.924 1.182 8.672
267 HB3 ALA 37 3HB ALA 37 23.999 2.755 7.884
268 H SER 38 H SER 38 21.864 3.768 7.429
269 HA SER 38 HA SER 38 19.827 2.920 9.356
270 HB2 SER 38 1HB SER 38 20.987 5.653 8.843
271 HB3 SER 38 2HB SER 38 19.941 5.188 10.196
272 HG SER 38 HG SER 38 22.552 4.339 9.589
273 H HIS 39 H HIS 39 20.068 3.543 6.212
274 HA HIS 39 HA HIS 39 18.732 4.062 4.513
275 HB2 HIS 39 1HB HIS 39 16.463 3.506 6.447
276 HB3 HIS 39 2HB HIS 39 16.292 3.645 4.702
277 HD1 HIS 39 HD1 HIS 39 17.457 1.635 3.271
278 HD2 HIS 39 HD2 HIS 39 17.213 1.056 7.384
279 HE1 HIS 39 HE1 HIS 39 17.780 -0.812 3.646
280 H LEU 40 H LEU 40 19.639 6.134 4.712
281 HA LEU 40 HA LEU 40 17.613 8.247 5.143
282 HB2 LEU 40 1HB LEU 40 20.541 8.290 5.903
283 HB3 LEU 40 2HB LEU 40 19.742 9.766 5.451
284 HG LEU 40 HG LEU 40 19.956 9.581 7.841
285 HD11 LEU 40 1HD1 LEU 40 17.105 9.322 6.976
286 HD12 LEU 40 2HD1 LEU 40 18.071 10.793 7.051
287 HD13 LEU 40 3HD1 LEU 40 17.656 9.935 8.533
288 HD21 LEU 40 3HD2 LEU 40 18.295 7.084 7.642
289 HD22 LEU 40 1HD2 LEU 40 18.759 7.902 9.138
290 HD23 LEU 40 2HD2 LEU 40 19.996 7.195 8.096
291 H TYR 41 H TYR 41 17.473 9.726 3.480
292 HA TYR 41 HA TYR 41 19.193 9.096 1.196
293 HB2 TYR 41 1HB TYR 41 16.405 10.263 1.300
294 HB3 TYR 41 2HB TYR 41 17.367 10.154 -0.163
295 HD1 TYR 41 HD1 TYR 41 16.121 7.949 2.584
296 HD2 TYR 41 HD2 TYR 41 16.948 8.336 -1.570
297 HE1 TYR 41 HE1 TYR 41 15.175 5.736 2.198
298 HE2 TYR 41 HE2 TYR 41 15.994 6.099 -1.967
299 HH TYR 41 HH TYR 41 14.243 4.467 0.540
300 H THR 42 H THR 42 20.467 10.677 0.498
301 HA THR 42 HA THR 42 20.267 13.238 1.871
302 HB THR 42 HB THR 42 22.348 12.270 -0.103
303 HG1 THR 42 HG1 THR 42 21.807 11.478 2.427
304 HG21 THR 42 3HG2 THR 42 22.427 14.350 2.099
305 HG22 THR 42 1HG2 THR 42 22.334 14.690 0.372
306 HG23 THR 42 2HG2 THR 42 23.777 13.929 1.044
307 H VAL 43 H VAL 43 19.429 14.897 0.800
308 HA VAL 43 HA VAL 43 18.990 14.682 -2.078
309 HB VAL 43 HB VAL 43 16.763 15.703 -1.794
310 HG11 VAL 43 1HG1 VAL 43 17.101 13.143 -0.243
311 HG12 VAL 43 2HG1 VAL 43 16.788 13.296 -1.974
312 HG13 VAL 43 3HG1 VAL 43 15.561 13.777 -0.810
313 HG21 VAL 43 3HG2 VAL 43 15.692 15.824 0.424
314 HG22 VAL 43 1HG2 VAL 43 17.103 16.879 0.314
315 HG23 VAL 43 2HG2 VAL 43 17.219 15.343 1.171
316 H LYS 44 H LYS 44 18.686 16.779 -3.041
317 HA LYS 44 HA LYS 44 19.852 18.908 -1.419
318 HB2 LYS 44 1HB LYS 44 21.415 18.147 -3.119
319 HB3 LYS 44 2HB LYS 44 20.214 18.387 -4.371
320 HG2 LYS 44 1HG LYS 44 20.301 20.770 -4.102
321 HG3 LYS 44 2HG LYS 44 21.334 20.619 -2.680
322 HD2 LYS 44 1HD LYS 44 22.129 19.587 -5.390
323 HD3 LYS 44 2HD LYS 44 22.494 21.226 -4.858
324 HE2 LYS 44 1HE LYS 44 23.338 18.767 -3.298
325 HE3 LYS 44 2HE LYS 44 24.346 19.517 -4.529
326 HZ1 LYS 44 3HZ LYS 44 24.622 21.381 -3.313
327 HZ2 LYS 44 1HZ LYS 44 24.729 20.252 -2.103
328 HZ3 LYS 44 2HZ LYS 44 23.324 21.193 -2.299
329 H TYR 45 H TYR 45 18.781 20.797 -1.355
330 HA TYR 45 HA TYR 45 16.130 20.882 -2.518
331 HB2 TYR 45 1HB TYR 45 17.556 22.465 -0.399
332 HB3 TYR 45 2HB TYR 45 16.034 23.043 -1.043
333 HD1 TYR 45 HD1 TYR 45 17.634 20.204 0.730
334 HD2 TYR 45 HD2 TYR 45 14.010 22.171 -0.291
335 HE1 TYR 45 HE1 TYR 45 16.409 18.782 2.322
336 HE2 TYR 45 HE2 TYR 45 12.790 20.757 1.292
337 HH TYR 45 HH TYR 45 13.027 18.568 2.392
338 H LYS 46 H LYS 46 15.353 22.964 -3.320
339 HA LYS 46 HA LYS 46 16.695 23.896 -5.589
340 HB2 LYS 46 1HB LYS 46 14.265 23.977 -5.242
341 HB3 LYS 46 2HB LYS 46 14.487 25.144 -3.955
342 HG2 LYS 46 1HG LYS 46 15.383 26.741 -5.582
343 HG3 LYS 46 2HG LYS 46 15.079 25.565 -6.867
344 HD2 LYS 46 1HD LYS 46 12.726 25.594 -6.405
345 HD3 LYS 46 2HD LYS 46 12.973 26.637 -5.005
346 HE2 LYS 46 1HE LYS 46 13.883 28.359 -6.506
347 HE3 LYS 46 2HE LYS 46 13.505 27.335 -7.884
348 HZ1 LYS 46 3HZ LYS 46 11.761 28.967 -7.504
349 HZ2 LYS 46 1HZ LYS 46 11.565 28.411 -5.930
350 HZ3 LYS 46 2HZ LYS 46 11.164 27.417 -7.224
351 H ASP 47 H ASP 47 16.873 24.829 -2.302
352 HA ASP 47 HA ASP 47 18.040 27.432 -2.675
353 HB2 ASP 47 1HB ASP 47 17.780 25.688 -0.219
354 HB3 ASP 47 2HB ASP 47 18.446 27.314 -0.210
355 H GLY 48 H GLY 48 19.262 24.435 -3.228
356 HA2 GLY 48 1HA GLY 48 21.473 24.031 -3.900
357 HA3 GLY 48 2HA GLY 48 22.002 25.422 -2.962
358 H THR 49 H THR 49 20.680 24.779 -0.601
359 HA THR 49 HA THR 49 22.486 23.290 0.833
360 HB THR 49 HB THR 49 19.581 23.672 1.496
361 HG1 THR 49 HG1 THR 49 21.718 25.564 1.644
362 HG21 THR 49 3HG2 THR 49 20.446 23.973 3.769
363 HG22 THR 49 1HG2 THR 49 22.101 23.766 3.183
364 HG23 THR 49 2HG2 THR 49 20.961 22.420 3.116
365 H GLU 50 H GLU 50 22.639 21.096 1.267
366 HA GLU 50 HA GLU 50 20.476 19.419 0.283
367 HB2 GLU 50 1HB GLU 50 22.138 17.588 0.154
368 HB3 GLU 50 2HB GLU 50 22.564 18.932 -0.884
369 HG2 GLU 50 1HG GLU 50 23.775 18.399 1.819
370 HG3 GLU 50 2HG GLU 50 24.467 17.895 0.277
371 H LEU 51 H LEU 51 19.903 17.607 1.541
372 HA LEU 51 HA LEU 51 20.476 17.871 4.409
373 HB2 LEU 51 1HB LEU 51 18.467 19.208 3.704
374 HB3 LEU 51 2HB LEU 51 17.762 17.694 3.180
375 HG LEU 51 HG LEU 51 17.900 16.902 5.540
376 HD11 LEU 51 1HD1 LEU 51 18.137 18.584 7.292
377 HD12 LEU 51 2HD1 LEU 51 18.535 19.798 6.076
378 HD13 LEU 51 3HD1 LEU 51 19.619 18.437 6.347
379 HD21 LEU 51 3HD2 LEU 51 15.853 17.692 4.543
380 HD22 LEU 51 1HD2 LEU 51 16.267 19.358 4.953
381 HD23 LEU 51 2HD2 LEU 51 15.950 18.186 6.234
382 H ALA 52 H ALA 52 19.854 15.846 5.576
383 HA ALA 52 HA ALA 52 19.339 13.629 3.734
384 HB1 ALA 52 1HB ALA 52 20.294 12.151 5.431
385 HB2 ALA 52 2HB ALA 52 20.546 13.524 6.500
386 HB3 ALA 52 3HB ALA 52 21.463 13.401 4.994
387 H LEU 53 H LEU 53 17.524 12.509 4.037
388 HA LEU 53 HA LEU 53 16.060 12.821 6.498
389 HB2 LEU 53 1HB LEU 53 13.914 13.104 5.034
390 HB3 LEU 53 2HB LEU 53 14.878 14.488 5.490
391 HG LEU 53 HG LEU 53 15.898 14.538 3.252
392 HD11 LEU 53 1HD1 LEU 53 14.067 12.289 2.637
393 HD12 LEU 53 2HD1 LEU 53 15.846 12.214 2.717
394 HD13 LEU 53 3HD1 LEU 53 15.027 13.211 1.491
395 HD21 LEU 53 3HD2 LEU 53 13.870 15.038 1.950
396 HD22 LEU 53 1HD2 LEU 53 13.908 15.848 3.543
397 HD23 LEU 53 2HD2 LEU 53 12.936 14.389 3.294
398 H LYS 54 H LYS 54 13.995 11.389 6.420
399 HA LYS 54 HA LYS 54 15.011 8.738 5.801
400 HB2 LYS 54 1HB LYS 54 12.518 9.695 7.204
401 HB3 LYS 54 2HB LYS 54 12.813 8.006 6.866
402 HG2 LYS 54 1HG LYS 54 14.621 9.744 8.543
403 HG3 LYS 54 2HG LYS 54 13.347 8.717 9.194
404 HD2 LYS 54 1HD LYS 54 15.742 7.749 7.599
405 HD3 LYS 54 2HD LYS 54 15.572 7.653 9.349
406 HE2 LYS 54 1HE LYS 54 13.563 6.226 9.024
407 HE3 LYS 54 2HE LYS 54 13.844 6.266 7.288
408 HZ1 LYS 54 3HZ LYS 54 14.760 4.244 8.182
409 HZ2 LYS 54 1HZ LYS 54 15.627 5.085 9.343
410 HZ3 LYS 54 2HZ LYS 54 16.062 5.227 7.749
411 H GLU 55 H GLU 55 13.635 7.187 4.674
412 HA GLU 55 HA GLU 55 12.689 8.154 2.222
413 HB2 GLU 55 1HB GLU 55 11.543 5.736 2.239
414 HB3 GLU 55 2HB GLU 55 13.238 5.965 1.891
415 HG2 GLU 55 1HG GLU 55 12.928 4.096 3.398
416 HG3 GLU 55 2HG GLU 55 13.763 5.388 4.247
417 H SER 56 H SER 56 11.138 7.597 5.215
418 HA SER 56 HA SER 56 8.452 7.731 4.382
419 HB2 SER 56 1HB SER 56 9.674 8.456 7.041
420 HB3 SER 56 2HB SER 56 7.985 8.033 6.738
421 HG SER 56 HG SER 56 10.229 6.294 6.296
422 H ASP 57 H ASP 57 10.862 10.152 4.519
423 HA ASP 57 HA ASP 57 8.915 12.296 4.807
424 HB2 ASP 57 1HB ASP 57 11.928 12.341 4.584
425 HB3 ASP 57 2HB ASP 57 10.949 13.796 4.620
426 H ILE 58 H ILE 58 10.250 10.363 2.418
427 HA ILE 58 HA ILE 58 10.148 12.540 0.473
428 HB ILE 58 HB ILE 58 11.331 9.774 0.143
429 HG12 ILE 58 1HG1 ILE 58 12.610 12.466 0.538
430 HG13 ILE 58 2HG1 ILE 58 12.615 11.114 1.666
431 HG21 ILE 58 1HG2 ILE 58 11.419 12.187 -1.670
432 HG22 ILE 58 2HG2 ILE 58 10.485 10.719 -1.959
433 HG23 ILE 58 3HG2 ILE 58 12.250 10.657 -1.950
434 HD11 ILE 58 3HD1 ILE 58 13.968 9.811 0.139
435 HD12 ILE 58 1HD1 ILE 58 14.703 11.376 0.509
436 HD13 ILE 58 2HD1 ILE 58 13.902 11.136 -1.045
437 H ARG 59 H ARG 59 8.735 12.574 -1.019
438 HA ARG 59 HA ARG 59 7.208 10.154 -1.572
439 HB2 ARG 59 1HB ARG 59 5.991 12.891 -1.173
440 HB3 ARG 59 2HB ARG 59 5.140 11.573 -1.965
441 HG2 ARG 59 1HG ARG 59 5.475 10.215 0.110
442 HG3 ARG 59 2HG ARG 59 6.118 11.661 0.879
443 HD2 ARG 59 1HD ARG 59 4.015 12.813 0.494
444 HD3 ARG 59 2HD ARG 59 3.369 11.383 -0.317
445 HE ARG 59 HE ARG 59 4.209 11.416 2.502
446 HH11 ARG 59 1HH1 ARG 59 1.932 10.351 -0.015
447 HH12 ARG 59 2HH1 ARG 59 0.912 9.526 1.058
448 HH21 ARG 59 1HH2 ARG 59 2.803 10.259 3.974
449 HH22 ARG 59 2HH2 ARG 59 1.404 9.488 3.385
450 H LEU 60 H LEU 60 5.984 10.384 -3.665
451 HA LEU 60 HA LEU 60 7.836 10.764 -5.744
452 HB2 LEU 60 1HB LEU 60 4.824 10.684 -5.878
453 HB3 LEU 60 2HB LEU 60 5.893 10.526 -7.250
454 HG LEU 60 HG LEU 60 5.726 8.568 -4.951
455 HD11 LEU 60 1HD1 LEU 60 4.612 7.108 -6.565
456 HD12 LEU 60 2HD1 LEU 60 4.638 8.408 -7.756
457 HD13 LEU 60 3HD1 LEU 60 3.687 8.582 -6.279
458 HD21 LEU 60 3HD2 LEU 60 7.062 7.125 -6.408
459 HD22 LEU 60 1HD2 LEU 60 7.927 8.610 -6.019
460 HD23 LEU 60 2HD2 LEU 60 7.165 8.420 -7.598
461 H GLN 61 H GLN 61 7.871 12.330 -7.460
462 HA GLN 61 HA GLN 61 7.814 15.022 -6.749
463 HB2 GLN 61 1HB GLN 61 8.956 13.921 -8.750
464 HB3 GLN 61 2HB GLN 61 7.392 13.987 -9.550
465 HG2 GLN 61 1HG GLN 61 7.415 16.435 -9.294
466 HG3 GLN 61 2HG GLN 61 9.036 16.316 -8.606
467 HE21 GLN 61 2HE2 GLN 61 8.207 17.698 -10.984
468 HE22 GLN 61 1HE2 GLN 61 9.132 17.034 -12.271
469 H SER 62 H SER 62 5.415 12.994 -8.247
470 HA SER 62 HA SER 62 3.365 14.766 -7.275
471 HB2 SER 62 1HB SER 62 3.495 15.310 -9.680
472 HB3 SER 62 2HB SER 62 3.375 13.594 -10.078
473 HG SER 62 HG SER 62 1.389 15.103 -9.980
474 H SER 63 H SER 63 1.744 13.596 -6.355
475 HA SER 63 HA SER 63 2.285 10.836 -5.911
476 HB2 SER 63 1HB SER 63 1.318 12.472 -4.217
477 HB3 SER 63 2HB SER 63 -0.189 12.406 -5.126
478 HG SER 63 HG SER 63 1.086 10.392 -3.629
479 H PHE 64 H PHE 64 0.723 12.564 -8.324
480 HA PHE 64 HA PHE 64 -1.008 10.357 -9.087
481 HB2 PHE 64 1HB PHE 64 -0.609 13.078 -10.378
482 HB3 PHE 64 2HB PHE 64 -1.794 11.874 -10.876
483 HD1 PHE 64 HD1 PHE 64 -3.684 11.318 -9.376
484 HD2 PHE 64 HD2 PHE 64 -1.011 14.520 -8.541
485 HE1 PHE 64 HE1 PHE 64 -5.303 12.248 -7.778
486 HE2 PHE 64 HE2 PHE 64 -2.626 15.457 -6.938
487 HZ PHE 64 HZ PHE 64 -4.774 14.319 -6.556
488 H LYS 65 H LYS 65 0.312 8.809 -9.768
489 HA LYS 65 HA LYS 65 2.188 9.460 -11.925
490 HB2 LYS 65 1HB LYS 65 3.350 8.753 -9.845
491 HB3 LYS 65 2HB LYS 65 2.453 7.242 -9.885
492 HG2 LYS 65 1HG LYS 65 3.467 6.731 -12.074
493 HG3 LYS 65 2HG LYS 65 4.424 8.200 -11.941
494 HD2 LYS 65 1HD LYS 65 5.458 7.321 -9.895
495 HD3 LYS 65 2HD LYS 65 4.513 5.835 -10.075
496 HE2 LYS 65 1HE LYS 65 5.540 5.518 -12.315
497 HE3 LYS 65 2HE LYS 65 6.539 6.930 -12.002
498 HZ1 LYS 65 3HZ LYS 65 6.567 4.412 -10.441
499 HZ2 LYS 65 1HZ LYS 65 7.525 5.757 -10.115
500 HZ3 LYS 65 2HZ LYS 65 7.727 4.904 -11.542
501 H GLN 66 H GLN 66 1.954 8.310 -13.774
502 HA GLN 66 HA GLN 66 0.296 5.942 -13.734
503 HB2 GLN 66 1HB GLN 66 -1.159 7.894 -14.320
504 HB3 GLN 66 2HB GLN 66 -0.104 8.221 -15.688
505 HG2 GLN 66 1HG GLN 66 -0.641 6.054 -16.640
506 HG3 GLN 66 2HG GLN 66 -1.678 5.699 -15.261
507 HE21 GLN 66 2HE2 GLN 66 -2.328 5.800 -18.038
508 HE22 GLN 66 1HE2 GLN 66 -3.574 6.983 -18.231
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -1.144 10.380 3.425
2 HA2 GLY 1 2HA GLY 1 0.899 9.482 4.297
3 HA3 GLY 1 1HA GLY 1 -0.346 8.255 4.090
4 H ALA 2 H ALA 2 2.760 8.506 3.925
5 HA ALA 2 HA ALA 2 3.055 6.435 1.983
6 HB1 ALA 2 1HB ALA 2 3.231 8.360 0.500
7 HB2 ALA 2 2HB ALA 2 4.815 7.598 0.674
8 HB3 ALA 2 3HB ALA 2 4.443 9.086 1.547
9 H MET 3 H MET 3 4.172 5.066 3.097
10 HA MET 3 HA MET 3 5.831 5.838 5.318
11 HB2 MET 3 1HB MET 3 4.508 3.832 5.513
12 HB3 MET 3 2HB MET 3 5.206 3.171 4.046
13 HG2 MET 3 1HG MET 3 7.391 3.026 5.170
14 HG3 MET 3 2HG MET 3 6.651 3.644 6.646
15 HE1 MET 3 3HE MET 3 8.333 0.873 6.269
16 HE2 MET 3 1HE MET 3 7.404 -0.175 7.341
17 HE3 MET 3 2HE MET 3 7.763 1.482 7.820
18 H GLY 4 H GLY 4 6.266 4.720 2.054
19 HA2 GLY 4 1HA GLY 4 8.175 5.038 0.742
20 HA3 GLY 4 2HA GLY 4 9.104 5.377 2.207
21 H MET 5 H MET 5 10.454 3.715 0.795
22 HA MET 5 HA MET 5 9.858 1.093 1.943
23 HB2 MET 5 1HB MET 5 10.702 1.614 -0.918
24 HB3 MET 5 2HB MET 5 10.657 0.033 -0.163
25 HG2 MET 5 1HG MET 5 8.257 0.196 0.106
26 HG3 MET 5 2HG MET 5 8.270 1.824 -0.565
27 HE1 MET 5 3HE MET 5 9.260 -1.995 -2.988
28 HE2 MET 5 1HE MET 5 8.822 -1.997 -1.281
29 HE3 MET 5 2HE MET 5 10.363 -1.318 -1.797
30 HA PRO 6 HA PRO 6 14.230 1.303 3.103
31 HB2 PRO 6 1HB PRO 6 13.903 -1.661 3.044
32 HB3 PRO 6 2HB PRO 6 14.562 -0.639 4.327
33 HG2 PRO 6 1HG PRO 6 12.147 -1.716 4.567
34 HG3 PRO 6 2HG PRO 6 12.467 -0.069 5.132
35 HD2 PRO 6 1HD PRO 6 11.023 -0.980 2.679
36 HD3 PRO 6 2HD PRO 6 10.706 0.408 3.735
37 H ASN 7 H ASN 7 12.846 -0.860 0.703
38 HA ASN 7 HA ASN 7 15.260 -1.204 -0.836
39 HB2 ASN 7 1HB ASN 7 13.257 -2.750 -0.990
40 HB3 ASN 7 2HB ASN 7 12.362 -1.430 -1.730
41 HD21 ASN 7 2HD2 ASN 7 12.948 -4.057 -2.714
42 HD22 ASN 7 1HD2 ASN 7 13.780 -3.894 -4.201
43 H ARG 8 H ARG 8 16.072 0.205 -2.259
44 HA ARG 8 HA ARG 8 15.182 2.853 -2.020
45 HB2 ARG 8 1HB ARG 8 17.555 2.136 -2.163
46 HB3 ARG 8 2HB ARG 8 17.297 1.770 -3.860
47 HG2 ARG 8 1HG ARG 8 16.707 4.122 -4.246
48 HG3 ARG 8 2HG ARG 8 17.059 4.460 -2.552
49 HD2 ARG 8 1HD ARG 8 18.955 5.073 -3.909
50 HD3 ARG 8 2HD ARG 8 19.373 3.688 -2.904
51 HE ARG 8 HE ARG 8 18.700 2.412 -5.073
52 HH11 ARG 8 1HH1 ARG 8 20.630 5.355 -4.835
53 HH12 ARG 8 2HH1 ARG 8 21.421 5.143 -6.335
54 HH21 ARG 8 1HH2 ARG 8 19.794 2.065 -7.064
55 HH22 ARG 8 2HH2 ARG 8 20.941 3.174 -7.641
56 H LYS 9 H LYS 9 13.162 2.985 -2.882
57 HA LYS 9 HA LYS 9 12.508 2.575 -5.647
58 HB2 LYS 9 1HB LYS 9 10.744 2.598 -3.918
59 HB3 LYS 9 2HB LYS 9 11.227 4.203 -3.437
60 HG2 LYS 9 1HG LYS 9 9.163 4.317 -4.673
61 HG3 LYS 9 2HG LYS 9 10.449 5.105 -5.577
62 HD2 LYS 9 1HD LYS 9 9.070 3.817 -7.089
63 HD3 LYS 9 2HD LYS 9 10.660 3.075 -6.964
64 HE2 LYS 9 1HE LYS 9 9.811 1.362 -5.503
65 HE3 LYS 9 2HE LYS 9 8.253 2.172 -5.383
66 HZ1 LYS 9 3HZ LYS 9 7.870 1.715 -7.722
67 HZ2 LYS 9 1HZ LYS 9 8.194 0.287 -6.904
68 HZ3 LYS 9 2HZ LYS 9 9.376 0.977 -7.873
69 H TYR 10 H TYR 10 13.685 5.080 -3.625
70 HA TYR 10 HA TYR 10 13.582 7.052 -5.751
71 HB2 TYR 10 1HB TYR 10 14.568 7.453 -2.929
72 HB3 TYR 10 2HB TYR 10 14.016 8.677 -4.069
73 HD1 TYR 10 HD2 TYR 10 11.459 7.796 -4.995
74 HD2 TYR 10 HD1 TYR 10 13.132 7.330 -1.115
75 HE1 TYR 10 HE2 TYR 10 9.190 7.674 -4.041
76 HE2 TYR 10 HE1 TYR 10 10.873 7.197 -0.141
77 HH TYR 10 HH TYR 10 8.578 8.013 -0.745
78 H ALA 11 H ALA 11 15.116 6.053 -7.019
79 HA ALA 11 HA ALA 11 17.758 5.428 -6.077
80 HB1 ALA 11 1HB ALA 11 18.274 4.970 -8.418
81 HB2 ALA 11 2HB ALA 11 16.754 5.719 -8.905
82 HB3 ALA 11 3HB ALA 11 16.738 4.231 -7.961
83 H ASP 12 H ASP 12 19.696 6.495 -6.734
84 HA ASP 12 HA ASP 12 19.621 9.222 -6.147
85 HB2 ASP 12 1HB ASP 12 22.028 9.263 -6.658
86 HB3 ASP 12 2HB ASP 12 21.597 7.870 -5.675
87 H GLY 13 H GLY 13 19.358 11.002 -7.287
88 HA2 GLY 13 1HA GLY 13 19.717 12.327 -9.220
89 HA3 GLY 13 2HA GLY 13 19.652 10.863 -10.194
90 H GLU 14 H GLU 14 17.266 10.331 -8.078
91 HA GLU 14 HA GLU 14 15.297 11.028 -10.014
92 HB2 GLU 14 1HB GLU 14 15.239 8.913 -8.732
93 HB3 GLU 14 2HB GLU 14 14.970 9.847 -7.265
94 HG2 GLU 14 1HG GLU 14 12.884 8.906 -8.140
95 HG3 GLU 14 2HG GLU 14 12.861 10.670 -8.181
96 H VAL 15 H VAL 15 13.774 12.653 -9.843
97 HA VAL 15 HA VAL 15 14.256 14.468 -7.621
98 HB VAL 15 HB VAL 15 14.288 15.611 -9.759
99 HG11 VAL 15 1HG1 VAL 15 13.071 14.024 -11.082
100 HG12 VAL 15 2HG1 VAL 15 12.412 15.646 -11.306
101 HG13 VAL 15 3HG1 VAL 15 11.556 14.472 -10.291
102 HG21 VAL 15 3HG2 VAL 15 11.690 16.195 -8.340
103 HG22 VAL 15 1HG2 VAL 15 12.498 17.281 -9.470
104 HG23 VAL 15 2HG2 VAL 15 13.268 16.866 -7.939
105 H VAL 16 H VAL 16 12.899 14.679 -6.037
106 HA VAL 16 HA VAL 16 10.319 13.325 -6.131
107 HB VAL 16 HB VAL 16 10.823 12.380 -3.834
108 HG11 VAL 16 1HG1 VAL 16 10.831 10.952 -5.822
109 HG12 VAL 16 2HG1 VAL 16 12.068 10.445 -4.670
110 HG13 VAL 16 3HG1 VAL 16 12.524 11.361 -6.109
111 HG21 VAL 16 3HG2 VAL 16 13.660 13.094 -4.604
112 HG22 VAL 16 1HG2 VAL 16 13.200 12.078 -3.235
113 HG23 VAL 16 2HG2 VAL 16 12.735 13.778 -3.269
114 H MET 17 H MET 17 9.236 13.763 -3.870
115 HA MET 17 HA MET 17 9.863 16.520 -3.120
116 HB2 MET 17 1HB MET 17 7.219 15.054 -2.874
117 HB3 MET 17 2HB MET 17 7.535 16.663 -2.243
118 HG2 MET 17 1HG MET 17 8.002 17.424 -4.561
119 HG3 MET 17 2HG MET 17 7.541 15.825 -5.136
120 HE1 MET 17 3HE MET 17 5.915 17.978 -2.222
121 HE2 MET 17 1HE MET 17 4.671 18.835 -3.124
122 HE3 MET 17 2HE MET 17 6.379 19.150 -3.448
123 H GLY 18 H GLY 18 10.382 16.878 -1.021
124 HA2 GLY 18 1HA GLY 18 10.281 14.503 0.742
125 HA3 GLY 18 2HA GLY 18 11.727 15.405 0.566
126 H ARG 19 H ARG 19 10.158 14.963 2.913
127 HA ARG 19 HA ARG 19 8.851 17.462 3.515
128 HB2 ARG 19 1HB ARG 19 7.963 15.288 4.345
129 HB3 ARG 19 2HB ARG 19 9.403 15.112 5.335
130 HG2 ARG 19 1HG ARG 19 8.802 17.162 6.551
131 HG3 ARG 19 2HG ARG 19 7.343 17.302 5.578
132 HD2 ARG 19 1HD ARG 19 6.807 16.312 7.713
133 HD3 ARG 19 2HD ARG 19 6.596 15.114 6.439
134 HE ARG 19 HE ARG 19 9.092 14.602 7.224
135 HH11 ARG 19 1HH1 ARG 19 6.108 14.907 9.116
136 HH12 ARG 19 2HH1 ARG 19 6.740 14.007 10.430
137 HH21 ARG 19 1HH2 ARG 19 9.867 13.414 8.921
138 HH22 ARG 19 2HH2 ARG 19 8.950 13.122 10.330
139 H TRP 20 H TRP 20 9.591 19.001 4.768
140 HA TRP 20 HA TRP 20 12.398 19.034 5.404
141 HB2 TRP 20 1HB TRP 20 11.072 21.063 4.602
142 HB3 TRP 20 2HB TRP 20 10.308 21.095 6.187
143 HD1 TRP 20 HD1 TRP 20 11.845 21.889 8.271
144 HE1 TRP 20 HE1 TRP 20 14.066 23.199 8.347
145 HE3 TRP 20 HE3 TRP 20 13.234 21.445 3.385
146 HZ2 TRP 20 HZ2 TRP 20 16.120 23.951 6.569
147 HZ3 TRP 20 HZ3 TRP 20 15.330 22.487 2.650
148 HH2 TRP 20 HH2 TRP 20 16.741 23.701 4.184
149 HA PRO 21 HA PRO 21 11.680 16.847 9.262
150 HB2 PRO 21 1HB PRO 21 13.999 17.781 10.515
151 HB3 PRO 21 2HB PRO 21 13.881 16.328 9.515
152 HG2 PRO 21 1HG PRO 21 14.808 19.065 8.787
153 HG3 PRO 21 2HG PRO 21 15.428 17.491 8.254
154 HD2 PRO 21 1HD PRO 21 13.911 18.976 6.663
155 HD3 PRO 21 2HD PRO 21 13.711 17.209 6.698
156 H GLY 22 H GLY 22 10.429 17.366 10.842
157 HA2 GLY 22 1HA GLY 22 9.902 18.537 12.843
158 HA3 GLY 22 2HA GLY 22 10.784 19.928 12.221
159 H SER 23 H SER 23 9.633 19.862 9.641
160 HA SER 23 HA SER 23 7.107 21.148 10.277
161 HB2 SER 23 1HB SER 23 8.809 21.172 7.779
162 HB3 SER 23 2HB SER 23 7.385 22.172 8.066
163 HG SER 23 HG SER 23 9.101 22.418 10.106
164 H VAL 24 H VAL 24 5.473 20.885 8.387
165 HA VAL 24 HA VAL 24 5.440 18.074 7.564
166 HB VAL 24 HB VAL 24 3.580 18.838 9.087
167 HG11 VAL 24 1HG1 VAL 24 2.724 20.536 6.782
168 HG12 VAL 24 2HG1 VAL 24 3.266 21.079 8.372
169 HG13 VAL 24 3HG1 VAL 24 1.749 20.195 8.211
170 HG21 VAL 24 3HG2 VAL 24 3.215 16.884 7.708
171 HG22 VAL 24 1HG2 VAL 24 2.686 17.896 6.364
172 HG23 VAL 24 2HG2 VAL 24 1.718 17.805 7.836
173 H LEU 25 H LEU 25 6.613 20.613 6.449
174 HA LEU 25 HA LEU 25 5.300 21.147 3.956
175 HB2 LEU 25 1HB LEU 25 7.949 21.902 5.042
176 HB3 LEU 25 2HB LEU 25 7.385 22.368 3.454
177 HG LEU 25 HG LEU 25 6.407 23.272 6.137
178 HD11 LEU 25 1HD1 LEU 25 8.136 24.471 4.971
179 HD12 LEU 25 2HD1 LEU 25 6.611 25.411 4.983
180 HD13 LEU 25 3HD1 LEU 25 7.085 24.455 3.555
181 HD21 LEU 25 3HD2 LEU 25 4.369 22.602 4.996
182 HD22 LEU 25 1HD2 LEU 25 4.889 23.446 3.530
183 HD23 LEU 25 2HD2 LEU 25 4.519 24.360 4.986
184 H TYR 26 H TYR 26 5.956 20.605 1.946
185 HA TYR 26 HA TYR 26 7.970 18.517 1.714
186 HB2 TYR 26 1HB TYR 26 5.170 18.444 0.587
187 HB3 TYR 26 2HB TYR 26 6.479 17.520 -0.135
188 HD1 TYR 26 HD2 TYR 26 4.329 17.865 2.834
189 HD2 TYR 26 HD1 TYR 26 7.370 15.584 0.940
190 HE1 TYR 26 HE2 TYR 26 3.964 16.046 4.449
191 HE2 TYR 26 HE1 TYR 26 7.033 13.769 2.528
192 HH TYR 26 HH TYR 26 6.136 13.381 4.690
193 H TYR 27 H TYR 27 9.482 19.381 0.644
194 HA TYR 27 HA TYR 27 8.918 21.340 -1.462
195 HB2 TYR 27 1HB TYR 27 11.400 20.531 -0.035
196 HB3 TYR 27 2HB TYR 27 11.410 21.674 -1.371
197 HD1 TYR 27 HD1 TYR 27 10.491 21.169 2.165
198 HD2 TYR 27 HD2 TYR 27 10.657 23.944 -1.045
199 HE1 TYR 27 HE1 TYR 27 10.155 23.019 3.750
200 HE2 TYR 27 HE2 TYR 27 10.324 25.799 0.526
201 HH TYR 27 HH TYR 27 9.349 26.107 2.702
202 H GLU 28 H GLU 28 10.311 21.123 -3.358
203 HA GLU 28 HA GLU 28 10.364 18.313 -4.194
204 HB2 GLU 28 1HB GLU 28 9.128 20.019 -5.546
205 HB3 GLU 28 2HB GLU 28 10.664 20.817 -5.827
206 HG2 GLU 28 1HG GLU 28 11.482 18.845 -6.994
207 HG3 GLU 28 2HG GLU 28 9.929 18.050 -6.716
208 H VAL 29 H VAL 29 12.242 17.317 -4.413
209 HA VAL 29 HA VAL 29 14.733 18.863 -4.337
210 HB VAL 29 HB VAL 29 15.621 17.306 -2.638
211 HG11 VAL 29 1HG1 VAL 29 13.133 18.754 -1.795
212 HG12 VAL 29 2HG1 VAL 29 14.751 19.448 -1.943
213 HG13 VAL 29 3HG1 VAL 29 14.423 18.215 -0.723
214 HG21 VAL 29 3HG2 VAL 29 14.150 15.402 -3.014
215 HG22 VAL 29 1HG2 VAL 29 12.771 16.332 -2.430
216 HG23 VAL 29 2HG2 VAL 29 14.076 15.908 -1.325
217 H GLN 30 H GLN 30 16.586 17.457 -4.860
218 HA GLN 30 HA GLN 30 15.653 15.144 -6.412
219 HB2 GLN 30 1HB GLN 30 16.717 16.950 -7.801
220 HB3 GLN 30 2HB GLN 30 18.203 16.710 -6.891
221 HG2 GLN 30 1HG GLN 30 18.222 14.334 -7.674
222 HG3 GLN 30 2HG GLN 30 16.813 14.702 -8.638
223 HE21 GLN 30 2HE2 GLN 30 17.939 14.134 -10.504
224 HE22 GLN 30 1HE2 GLN 30 19.073 15.209 -11.218
225 H VAL 31 H VAL 31 16.440 13.215 -5.840
226 HA VAL 31 HA VAL 31 17.888 13.144 -3.385
227 HB VAL 31 HB VAL 31 16.117 11.415 -3.999
228 HG11 VAL 31 1HG1 VAL 31 16.696 9.555 -5.354
229 HG12 VAL 31 2HG1 VAL 31 18.116 10.459 -5.909
230 HG13 VAL 31 3HG1 VAL 31 16.499 11.084 -6.203
231 HG21 VAL 31 3HG2 VAL 31 17.657 10.953 -2.163
232 HG22 VAL 31 1HG2 VAL 31 18.827 10.286 -3.304
233 HG23 VAL 31 2HG2 VAL 31 17.279 9.481 -3.058
234 H THR 32 H THR 32 19.918 12.870 -3.029
235 HA THR 32 HA THR 32 21.631 13.003 -5.390
236 HB THR 32 HB THR 32 22.155 14.054 -2.609
237 HG1 THR 32 HG1 THR 32 20.383 14.838 -4.395
238 HG21 THR 32 3HG2 THR 32 23.681 15.523 -3.818
239 HG22 THR 32 1HG2 THR 32 23.311 14.678 -5.314
240 HG23 THR 32 2HG2 THR 32 24.159 13.821 -4.005
241 H SER 33 H SER 33 21.193 11.465 -2.201
242 HA SER 33 HA SER 33 22.854 9.310 -3.030
243 HB2 SER 33 1HB SER 33 24.553 10.940 -2.158
244 HB3 SER 33 2HB SER 33 23.717 10.941 -0.608
245 HG SER 33 HG SER 33 25.296 9.502 -0.372
246 H TYR 34 H TYR 34 23.019 7.789 -1.044
247 HA TYR 34 HA TYR 34 20.713 7.884 0.678
248 HB2 TYR 34 1HB TYR 34 19.668 6.848 -1.196
249 HB3 TYR 34 2HB TYR 34 21.073 5.847 -1.521
250 HD1 TYR 34 HD2 TYR 34 18.817 6.413 1.440
251 HD2 TYR 34 HD1 TYR 34 20.696 3.618 -1.153
252 HE1 TYR 34 HE2 TYR 34 17.800 4.560 2.700
253 HE2 TYR 34 HE1 TYR 34 19.687 1.766 0.093
254 HH TYR 34 HH TYR 34 18.771 1.315 2.311
255 H ASP 35 H ASP 35 21.515 7.409 2.570
256 HA ASP 35 HA ASP 35 23.867 5.690 2.900
257 HB2 ASP 35 1HB ASP 35 23.532 7.802 4.265
258 HB3 ASP 35 2HB ASP 35 22.084 7.073 4.945
259 H ASP 36 H ASP 36 23.545 3.552 3.216
260 HA ASP 36 HA ASP 36 20.753 2.720 3.435
261 HB2 ASP 36 1HB ASP 36 21.457 0.554 2.560
262 HB3 ASP 36 2HB ASP 36 21.944 1.864 1.492
263 H ALA 37 H ALA 37 23.375 3.067 5.326
264 HA ALA 37 HA ALA 37 22.958 0.730 6.966
265 HB1 ALA 37 1HB ALA 37 24.703 1.667 8.407
266 HB2 ALA 37 2HB ALA 37 24.692 3.150 7.452
267 HB3 ALA 37 3HB ALA 37 25.217 1.635 6.719
268 H SER 38 H SER 38 22.512 4.248 7.329
269 HA SER 38 HA SER 38 20.884 3.699 9.698
270 HB2 SER 38 1HB SER 38 22.688 5.400 9.829
271 HB3 SER 38 2HB SER 38 21.888 6.341 8.573
272 HG SER 38 HG SER 38 20.482 5.632 10.880
273 H HIS 39 H HIS 39 20.486 3.909 6.476
274 HA HIS 39 HA HIS 39 18.829 4.243 5.006
275 HB2 HIS 39 1HB HIS 39 17.051 3.906 7.433
276 HB3 HIS 39 2HB HIS 39 16.457 3.941 5.776
277 HD1 HIS 39 HD1 HIS 39 17.971 1.707 8.301
278 HD2 HIS 39 HD2 HIS 39 17.224 1.686 4.217
279 HE1 HIS 39 HE1 HIS 39 18.214 -0.688 7.558
280 H LEU 40 H LEU 40 19.869 6.374 5.007
281 HA LEU 40 HA LEU 40 17.843 8.475 5.398
282 HB2 LEU 40 1HB LEU 40 20.737 8.541 6.164
283 HB3 LEU 40 2HB LEU 40 20.015 9.998 5.541
284 HG LEU 40 HG LEU 40 20.090 10.106 7.920
285 HD11 LEU 40 1HD1 LEU 40 18.201 11.153 6.920
286 HD12 LEU 40 2HD1 LEU 40 17.774 10.491 8.499
287 HD13 LEU 40 3HD1 LEU 40 17.269 9.662 7.033
288 HD21 LEU 40 3HD2 LEU 40 18.879 8.563 9.378
289 HD22 LEU 40 1HD2 LEU 40 20.170 7.756 8.490
290 HD23 LEU 40 2HD2 LEU 40 18.497 7.557 7.980
291 H TYR 41 H TYR 41 17.413 9.614 3.616
292 HA TYR 41 HA TYR 41 19.021 9.067 1.250
293 HB2 TYR 41 1HB TYR 41 16.232 10.171 1.635
294 HB3 TYR 41 2HB TYR 41 17.034 10.071 0.079
295 HD1 TYR 41 HD2 TYR 41 16.007 7.880 2.958
296 HD2 TYR 41 HD1 TYR 41 16.667 8.202 -1.238
297 HE1 TYR 41 HE2 TYR 41 15.131 5.614 2.651
298 HE2 TYR 41 HE1 TYR 41 15.785 5.935 -1.553
299 HH TYR 41 HH TYR 41 14.291 4.125 1.043
300 H THR 42 H THR 42 20.400 10.617 0.677
301 HA THR 42 HA THR 42 20.167 13.259 1.859
302 HB THR 42 HB THR 42 22.200 12.223 -0.122
303 HG1 THR 42 HG1 THR 42 23.305 12.287 2.224
304 HG21 THR 42 3HG2 THR 42 23.622 14.001 0.822
305 HG22 THR 42 1HG2 THR 42 22.305 14.475 1.900
306 HG23 THR 42 2HG2 THR 42 22.131 14.662 0.155
307 H VAL 43 H VAL 43 19.329 14.908 0.742
308 HA VAL 43 HA VAL 43 18.924 14.567 -2.147
309 HB VAL 43 HB VAL 43 16.751 15.724 -1.938
310 HG11 VAL 43 1HG1 VAL 43 16.942 13.277 -0.183
311 HG12 VAL 43 2HG1 VAL 43 16.645 13.297 -1.924
312 HG13 VAL 43 3HG1 VAL 43 15.446 13.947 -0.819
313 HG21 VAL 43 3HG2 VAL 43 17.205 15.556 1.047
314 HG22 VAL 43 1HG2 VAL 43 15.707 16.073 0.271
315 HG23 VAL 43 2HG2 VAL 43 17.177 17.029 0.080
316 H LYS 44 H LYS 44 18.899 16.545 -3.287
317 HA LYS 44 HA LYS 44 20.174 18.772 -1.878
318 HB2 LYS 44 1HB LYS 44 21.425 17.887 -3.788
319 HB3 LYS 44 2HB LYS 44 20.026 18.093 -4.825
320 HG2 LYS 44 1HG LYS 44 20.180 20.541 -4.485
321 HG3 LYS 44 2HG LYS 44 21.632 20.293 -3.524
322 HD2 LYS 44 1HD LYS 44 21.399 19.325 -6.373
323 HD3 LYS 44 2HD LYS 44 21.918 20.953 -5.986
324 HE2 LYS 44 1HE LYS 44 23.856 19.558 -6.393
325 HE3 LYS 44 2HE LYS 44 23.816 20.012 -4.699
326 HZ1 LYS 44 3HZ LYS 44 24.412 17.682 -5.264
327 HZ2 LYS 44 1HZ LYS 44 22.832 17.368 -5.675
328 HZ3 LYS 44 2HZ LYS 44 23.293 17.802 -4.070
329 H TYR 45 H TYR 45 19.131 20.616 -1.638
330 HA TYR 45 HA TYR 45 16.466 20.975 -2.761
331 HB2 TYR 45 1HB TYR 45 17.989 22.249 -0.502
332 HB3 TYR 45 2HB TYR 45 16.582 23.041 -1.193
333 HD1 TYR 45 HD2 TYR 45 17.714 19.967 0.584
334 HD2 TYR 45 HD1 TYR 45 14.437 22.391 -0.599
335 HE1 TYR 45 HE2 TYR 45 16.198 18.637 2.013
336 HE2 TYR 45 HE1 TYR 45 12.943 21.117 0.773
337 HH TYR 45 HH TYR 45 14.014 18.867 3.124
338 H LYS 46 H LYS 46 15.903 22.918 -3.763
339 HA LYS 46 HA LYS 46 17.666 24.076 -5.631
340 HB2 LYS 46 1HB LYS 46 15.251 24.058 -5.901
341 HB3 LYS 46 2HB LYS 46 15.051 25.001 -4.441
342 HG2 LYS 46 1HG LYS 46 16.268 26.858 -5.572
343 HG3 LYS 46 2HG LYS 46 16.171 25.921 -7.068
344 HD2 LYS 46 1HD LYS 46 13.755 25.886 -6.933
345 HD3 LYS 46 2HD LYS 46 13.805 26.695 -5.369
346 HE2 LYS 46 1HE LYS 46 14.891 28.641 -6.495
347 HE3 LYS 46 2HE LYS 46 14.627 27.824 -8.036
348 HZ1 LYS 46 3HZ LYS 46 12.248 27.862 -7.611
349 HZ2 LYS 46 1HZ LYS 46 12.874 29.418 -7.546
350 HZ3 LYS 46 2HZ LYS 46 12.487 28.603 -6.133
351 H ASP 47 H ASP 47 16.926 24.702 -2.353
352 HA ASP 47 HA ASP 47 17.839 27.404 -2.150
353 HB2 ASP 47 1HB ASP 47 17.357 25.342 0.015
354 HB3 ASP 47 2HB ASP 47 17.615 27.060 0.285
355 H GLY 48 H GLY 48 19.554 24.630 -2.679
356 HA2 GLY 48 1HA GLY 48 21.876 24.557 -2.891
357 HA3 GLY 48 2HA GLY 48 21.995 25.934 -1.797
358 H THR 49 H THR 49 20.103 24.395 -0.045
359 HA THR 49 HA THR 49 22.069 23.168 1.612
360 HB THR 49 HB THR 49 19.055 23.239 1.830
361 HG1 THR 49 HG1 THR 49 21.095 25.052 2.495
362 HG21 THR 49 3HG2 THR 49 19.479 22.981 4.258
363 HG22 THR 49 1HG2 THR 49 21.206 22.848 3.932
364 HG23 THR 49 2HG2 THR 49 20.106 21.604 3.347
365 H GLU 50 H GLU 50 22.613 20.983 1.539
366 HA GLU 50 HA GLU 50 20.628 19.255 0.292
367 HB2 GLU 50 1HB GLU 50 23.509 18.674 1.045
368 HB3 GLU 50 2HB GLU 50 22.423 17.557 0.225
369 HG2 GLU 50 1HG GLU 50 22.273 19.155 -1.657
370 HG3 GLU 50 2HG GLU 50 23.458 20.172 -0.841
371 H LEU 51 H LEU 51 19.986 17.406 1.475
372 HA LEU 51 HA LEU 51 20.340 17.638 4.372
373 HB2 LEU 51 1HB LEU 51 18.430 19.023 3.674
374 HB3 LEU 51 2HB LEU 51 17.719 17.616 2.919
375 HG LEU 51 HG LEU 51 17.552 16.565 5.170
376 HD11 LEU 51 1HD1 LEU 51 17.751 17.996 7.137
377 HD12 LEU 51 2HD1 LEU 51 18.358 19.308 6.121
378 HD13 LEU 51 3HD1 LEU 51 19.296 17.828 6.310
379 HD21 LEU 51 3HD2 LEU 51 15.661 17.655 4.124
380 HD22 LEU 51 1HD2 LEU 51 16.172 19.212 4.777
381 HD23 LEU 51 2HD2 LEU 51 15.656 17.928 5.867
382 H ALA 52 H ALA 52 19.899 15.622 5.456
383 HA ALA 52 HA ALA 52 19.256 13.449 3.616
384 HB1 ALA 52 1HB ALA 52 20.232 11.968 5.299
385 HB2 ALA 52 2HB ALA 52 20.584 13.352 6.328
386 HB3 ALA 52 3HB ALA 52 21.411 13.172 4.779
387 H LEU 53 H LEU 53 17.446 12.405 3.962
388 HA LEU 53 HA LEU 53 16.030 12.737 6.454
389 HB2 LEU 53 1HB LEU 53 13.878 13.054 5.038
390 HB3 LEU 53 2HB LEU 53 14.894 14.426 5.405
391 HG LEU 53 HG LEU 53 15.802 14.401 3.126
392 HD11 LEU 53 1HD1 LEU 53 15.743 12.044 2.704
393 HD12 LEU 53 2HD1 LEU 53 14.904 12.987 1.449
394 HD13 LEU 53 3HD1 LEU 53 13.969 12.111 2.653
395 HD21 LEU 53 3HD2 LEU 53 12.849 14.188 3.257
396 HD22 LEU 53 1HD2 LEU 53 13.747 14.849 1.893
397 HD23 LEU 53 2HD2 LEU 53 13.805 15.671 3.476
398 H LYS 54 H LYS 54 14.092 11.300 6.506
399 HA LYS 54 HA LYS 54 15.063 8.738 5.607
400 HB2 LYS 54 1HB LYS 54 12.941 9.414 7.622
401 HB3 LYS 54 2HB LYS 54 13.245 7.762 7.076
402 HG2 LYS 54 1HG LYS 54 15.579 7.962 7.778
403 HG3 LYS 54 2HG LYS 54 15.250 9.603 8.324
404 HD2 LYS 54 1HD LYS 54 13.777 8.803 10.027
405 HD3 LYS 54 2HD LYS 54 13.881 7.153 9.407
406 HE2 LYS 54 1HE LYS 54 16.266 7.104 9.908
407 HE3 LYS 54 2HE LYS 54 16.191 8.760 10.488
408 HZ1 LYS 54 3HZ LYS 54 14.797 8.067 12.288
409 HZ2 LYS 54 1HZ LYS 54 16.182 7.101 12.258
410 HZ3 LYS 54 2HZ LYS 54 14.719 6.483 11.681
411 H GLU 55 H GLU 55 13.411 7.054 4.971
412 HA GLU 55 HA GLU 55 12.470 7.833 2.447
413 HB2 GLU 55 1HB GLU 55 11.575 5.591 2.200
414 HB3 GLU 55 2HB GLU 55 13.149 5.506 2.950
415 HG2 GLU 55 1HG GLU 55 10.489 5.188 4.332
416 HG3 GLU 55 2HG GLU 55 11.607 3.895 3.910
417 H SER 56 H SER 56 10.897 7.671 5.526
418 HA SER 56 HA SER 56 8.231 7.913 4.531
419 HB2 SER 56 1HB SER 56 9.289 8.550 7.280
420 HB3 SER 56 2HB SER 56 7.603 8.264 6.847
421 HG SER 56 HG SER 56 8.877 6.237 5.895
422 H ASP 57 H ASP 57 10.699 10.105 4.470
423 HA ASP 57 HA ASP 57 8.894 12.370 4.758
424 HB2 ASP 57 1HB ASP 57 11.892 12.223 4.463
425 HB3 ASP 57 2HB ASP 57 10.990 13.729 4.426
426 H ILE 58 H ILE 58 10.062 10.238 2.413
427 HA ILE 58 HA ILE 58 10.042 12.374 0.426
428 HB ILE 58 HB ILE 58 11.170 9.584 0.152
429 HG12 ILE 58 1HG1 ILE 58 12.461 12.283 0.478
430 HG13 ILE 58 2HG1 ILE 58 12.474 10.956 1.631
431 HG21 ILE 58 1HG2 ILE 58 12.084 10.395 -1.967
432 HG22 ILE 58 2HG2 ILE 58 11.288 11.948 -1.709
433 HG23 ILE 58 3HG2 ILE 58 10.317 10.495 -1.976
434 HD11 ILE 58 3HD1 ILE 58 13.823 9.628 0.123
435 HD12 ILE 58 1HD1 ILE 58 14.560 11.200 0.456
436 HD13 ILE 58 2HD1 ILE 58 13.748 10.922 -1.089
437 H ARG 59 H ARG 59 8.694 12.509 -1.039
438 HA ARG 59 HA ARG 59 6.745 10.357 -1.605
439 HB2 ARG 59 1HB ARG 59 6.368 13.357 -1.655
440 HB3 ARG 59 2HB ARG 59 5.198 12.202 -2.260
441 HG2 ARG 59 1HG ARG 59 4.880 11.325 -0.020
442 HG3 ARG 59 2HG ARG 59 6.123 12.418 0.590
443 HD2 ARG 59 1HD ARG 59 3.830 13.279 0.977
444 HD3 ARG 59 2HD ARG 59 4.818 14.345 -0.013
445 HE ARG 59 HE ARG 59 3.064 12.459 -1.358
446 HH11 ARG 59 1HH1 ARG 59 3.646 15.818 -0.350
447 HH12 ARG 59 2HH1 ARG 59 2.579 16.520 -1.458
448 HH21 ARG 59 1HH2 ARG 59 1.561 13.421 -2.895
449 HH22 ARG 59 2HH2 ARG 59 1.355 15.111 -2.950
450 H LEU 60 H LEU 60 5.903 10.651 -3.899
451 HA LEU 60 HA LEU 60 8.116 11.195 -5.668
452 HB2 LEU 60 1HB LEU 60 5.276 10.315 -6.197
453 HB3 LEU 60 2HB LEU 60 6.491 10.475 -7.446
454 HG LEU 60 HG LEU 60 6.596 8.534 -5.129
455 HD11 LEU 60 1HD1 LEU 60 6.068 8.084 -8.061
456 HD12 LEU 60 2HD1 LEU 60 4.907 7.907 -6.743
457 HD13 LEU 60 3HD1 LEU 60 6.291 6.820 -6.853
458 HD21 LEU 60 3HD2 LEU 60 8.466 8.899 -7.477
459 HD22 LEU 60 1HD2 LEU 60 8.528 7.571 -6.321
460 HD23 LEU 60 2HD2 LEU 60 8.834 9.219 -5.784
461 H GLN 61 H GLN 61 7.118 12.363 -7.874
462 HA GLN 61 HA GLN 61 7.072 15.088 -7.240
463 HB2 GLN 61 1HB GLN 61 7.846 14.190 -9.403
464 HB3 GLN 61 2HB GLN 61 6.206 13.723 -9.800
465 HG2 GLN 61 1HG GLN 61 5.554 16.091 -9.822
466 HG3 GLN 61 2HG GLN 61 7.215 16.537 -9.448
467 HE21 GLN 61 2HE2 GLN 61 7.453 17.694 -11.312
468 HE22 GLN 61 1HE2 GLN 61 7.588 16.994 -12.875
469 H SER 62 H SER 62 4.543 12.842 -7.238
470 HA SER 62 HA SER 62 2.376 12.875 -6.678
471 HB2 SER 62 1HB SER 62 2.979 14.566 -4.960
472 HB3 SER 62 2HB SER 62 2.722 15.848 -6.140
473 HG SER 62 HG SER 62 0.567 14.184 -5.942
474 H SER 63 H SER 63 3.164 15.660 -8.725
475 HA SER 63 HA SER 63 0.710 15.323 -10.195
476 HB2 SER 63 1HB SER 63 1.715 17.295 -11.482
477 HB3 SER 63 2HB SER 63 1.337 17.581 -9.781
478 HG SER 63 HG SER 63 3.332 18.210 -9.701
479 H PHE 64 H PHE 64 3.170 13.477 -10.069
480 HA PHE 64 HA PHE 64 4.341 13.290 -12.644
481 HB2 PHE 64 1HB PHE 64 5.238 12.255 -10.489
482 HB3 PHE 64 2HB PHE 64 3.955 11.073 -10.620
483 HD1 PHE 64 HD2 PHE 64 6.857 12.438 -12.484
484 HD2 PHE 64 HD1 PHE 64 4.326 9.096 -11.780
485 HE1 PHE 64 HE2 PHE 64 8.325 11.040 -13.870
486 HE2 PHE 64 HE1 PHE 64 5.791 7.691 -13.165
487 HZ PHE 64 HZ PHE 64 7.798 8.666 -14.213
488 H LYS 65 H LYS 65 3.090 12.997 -14.351
489 HA LYS 65 HA LYS 65 0.479 11.837 -14.100
490 HB2 LYS 65 1HB LYS 65 0.190 12.460 -16.438
491 HB3 LYS 65 2HB LYS 65 0.803 13.803 -15.483
492 HG2 LYS 65 1HG LYS 65 3.037 13.439 -16.359
493 HG3 LYS 65 2HG LYS 65 2.472 12.036 -17.266
494 HD2 LYS 65 1HD LYS 65 0.908 13.537 -18.493
495 HD3 LYS 65 2HD LYS 65 1.625 14.901 -17.637
496 HE2 LYS 65 1HE LYS 65 3.792 14.415 -18.605
497 HE3 LYS 65 2HE LYS 65 3.131 12.983 -19.394
498 HZ1 LYS 65 3HZ LYS 65 3.283 14.844 -20.923
499 HZ2 LYS 65 1HZ LYS 65 2.291 15.775 -19.924
500 HZ3 LYS 65 2HZ LYS 65 1.674 14.410 -20.671
501 H GLN 66 H GLN 66 -0.336 10.143 -15.310
502 HA GLN 66 HA GLN 66 1.636 8.321 -16.375
503 HB2 GLN 66 1HB GLN 66 0.066 6.441 -15.750
504 HB3 GLN 66 2HB GLN 66 0.787 7.261 -14.387
505 HG2 GLN 66 1HG GLN 66 -1.332 8.544 -14.136
506 HG3 GLN 66 2HG GLN 66 -2.012 7.529 -15.406
507 HE21 GLN 66 2HE2 GLN 66 -3.530 6.620 -14.085
508 HE22 GLN 66 1HE2 GLN 66 -3.140 5.498 -12.830
Start of MODEL 3
1 H1 GLY 1 H GLY 1 3.200 0.422 -0.377
2 HA2 GLY 1 2HA GLY 1 2.503 -0.483 -3.074
3 HA3 GLY 1 1HA GLY 1 3.976 0.365 -2.633
4 H ALA 2 H ALA 2 3.352 -2.416 -3.633
5 HA ALA 2 HA ALA 2 4.015 -4.207 -1.529
6 HB1 ALA 2 1HB ALA 2 4.256 -5.878 -3.307
7 HB2 ALA 2 2HB ALA 2 4.195 -4.603 -4.520
8 HB3 ALA 2 3HB ALA 2 2.779 -4.938 -3.521
9 H MET 3 H MET 3 5.820 -2.740 -4.174
10 HA MET 3 HA MET 3 8.299 -3.732 -3.010
11 HB2 MET 3 1HB MET 3 7.751 -2.275 -5.610
12 HB3 MET 3 2HB MET 3 9.355 -2.715 -5.057
13 HG2 MET 3 1HG MET 3 8.777 -5.073 -5.165
14 HG3 MET 3 2HG MET 3 7.131 -4.660 -5.638
15 HE1 MET 3 3HE MET 3 7.581 -3.228 -9.232
16 HE2 MET 3 1HE MET 3 7.481 -2.316 -7.728
17 HE3 MET 3 2HE MET 3 6.441 -3.717 -7.982
18 H GLY 4 H GLY 4 8.436 -2.520 -1.181
19 HA2 GLY 4 1HA GLY 4 8.394 0.384 -1.514
20 HA3 GLY 4 2HA GLY 4 8.280 -0.484 0.012
21 H MET 5 H MET 5 10.432 -2.215 -0.255
22 HA MET 5 HA MET 5 12.711 -0.418 -0.622
23 HB2 MET 5 1HB MET 5 12.165 -2.007 1.877
24 HB3 MET 5 2HB MET 5 13.714 -1.271 1.512
25 HG2 MET 5 1HG MET 5 12.717 0.938 1.583
26 HG3 MET 5 2HG MET 5 11.122 0.234 1.826
27 HE1 MET 5 3HE MET 5 11.410 -1.315 5.398
28 HE2 MET 5 1HE MET 5 11.760 -2.158 3.890
29 HE3 MET 5 2HE MET 5 10.391 -1.057 3.986
30 HA PRO 6 HA PRO 6 14.021 -4.477 -2.384
31 HB2 PRO 6 1HB PRO 6 15.403 -2.689 -4.287
32 HB3 PRO 6 2HB PRO 6 14.304 -4.023 -4.641
33 HG2 PRO 6 1HG PRO 6 13.588 -1.461 -5.055
34 HG3 PRO 6 2HG PRO 6 12.422 -2.684 -4.524
35 HD2 PRO 6 1HD PRO 6 13.823 -0.576 -2.919
36 HD3 PRO 6 2HD PRO 6 12.127 -1.105 -2.842
37 H ASN 7 H ASN 7 15.418 -1.405 -1.907
38 HA ASN 7 HA ASN 7 17.247 -1.857 0.055
39 HB2 ASN 7 1HB ASN 7 18.603 -3.071 -1.735
40 HB3 ASN 7 2HB ASN 7 18.643 -1.562 -2.646
41 HD21 ASN 7 2HD2 ASN 7 19.852 -3.259 0.134
42 HD22 ASN 7 1HD2 ASN 7 21.076 -2.123 0.535
43 H ARG 8 H ARG 8 17.120 -0.215 -3.052
44 HA ARG 8 HA ARG 8 16.708 2.302 -1.618
45 HB2 ARG 8 1HB ARG 8 17.792 1.822 -4.399
46 HB3 ARG 8 2HB ARG 8 17.369 3.400 -3.761
47 HG2 ARG 8 1HG ARG 8 19.059 3.073 -1.995
48 HG3 ARG 8 2HG ARG 8 19.531 1.566 -2.784
49 HD2 ARG 8 1HD ARG 8 20.124 2.748 -4.788
50 HD3 ARG 8 2HD ARG 8 19.525 4.266 -4.121
51 HE ARG 8 HE ARG 8 21.562 3.010 -2.553
52 HH11 ARG 8 1HH1 ARG 8 21.035 5.084 -5.351
53 HH12 ARG 8 2HH1 ARG 8 22.467 5.963 -5.207
54 HH21 ARG 8 1HH2 ARG 8 23.571 4.192 -2.299
55 HH22 ARG 8 2HH2 ARG 8 23.974 5.425 -3.395
56 H LYS 9 H LYS 9 14.821 3.198 -1.869
57 HA LYS 9 HA LYS 9 12.891 1.994 -3.683
58 HB2 LYS 9 1HB LYS 9 12.112 2.583 -1.451
59 HB3 LYS 9 2HB LYS 9 12.647 4.241 -1.668
60 HG2 LYS 9 1HG LYS 9 10.205 3.983 -1.871
61 HG3 LYS 9 2HG LYS 9 10.945 4.625 -3.339
62 HD2 LYS 9 1HD LYS 9 10.878 2.426 -4.349
63 HD3 LYS 9 2HD LYS 9 10.214 1.775 -2.845
64 HE2 LYS 9 1HE LYS 9 8.221 3.127 -3.134
65 HE3 LYS 9 2HE LYS 9 8.892 3.844 -4.598
66 HZ1 LYS 9 3HZ LYS 9 8.870 1.626 -5.621
67 HZ2 LYS 9 1HZ LYS 9 7.330 2.072 -5.126
68 HZ3 LYS 9 2HZ LYS 9 8.221 0.962 -4.230
69 H TYR 10 H TYR 10 14.735 4.873 -3.231
70 HA TYR 10 HA TYR 10 13.725 5.915 -5.763
71 HB2 TYR 10 1HB TYR 10 14.829 7.552 -3.472
72 HB3 TYR 10 2HB TYR 10 13.955 8.127 -4.887
73 HD1 TYR 10 HD1 TYR 10 11.461 7.352 -5.094
74 HD2 TYR 10 HD2 TYR 10 13.688 7.147 -1.483
75 HE1 TYR 10 HE1 TYR 10 9.363 7.287 -3.807
76 HE2 TYR 10 HE2 TYR 10 11.610 7.075 -0.187
77 HH TYR 10 HH TYR 10 9.251 7.760 -0.456
78 H ALA 11 H ALA 11 15.301 6.187 -7.223
79 HA ALA 11 HA ALA 11 18.034 5.551 -6.436
80 HB1 ALA 11 1HB ALA 11 16.830 6.129 -9.144
81 HB2 ALA 11 2HB ALA 11 17.084 4.523 -8.462
82 HB3 ALA 11 3HB ALA 11 18.468 5.546 -8.852
83 H ASP 12 H ASP 12 19.772 7.034 -6.910
84 HA ASP 12 HA ASP 12 18.944 9.651 -6.241
85 HB2 ASP 12 1HB ASP 12 21.329 10.283 -6.122
86 HB3 ASP 12 2HB ASP 12 20.959 8.853 -5.181
87 H GLY 13 H GLY 13 19.113 11.535 -7.350
88 HA2 GLY 13 1HA GLY 13 19.649 12.761 -9.310
89 HA3 GLY 13 2HA GLY 13 19.541 11.260 -10.231
90 H GLU 14 H GLU 14 17.051 10.817 -8.262
91 HA GLU 14 HA GLU 14 15.168 11.665 -10.259
92 HB2 GLU 14 1HB GLU 14 14.972 9.457 -9.180
93 HB3 GLU 14 2HB GLU 14 14.800 10.228 -7.617
94 HG2 GLU 14 1HG GLU 14 12.642 9.463 -8.468
95 HG3 GLU 14 2HG GLU 14 12.679 11.219 -8.328
96 H VAL 15 H VAL 15 13.485 13.164 -9.904
97 HA VAL 15 HA VAL 15 14.060 14.973 -7.686
98 HB VAL 15 HB VAL 15 13.841 16.082 -9.874
99 HG11 VAL 15 1HG1 VAL 15 11.063 14.939 -10.011
100 HG12 VAL 15 2HG1 VAL 15 12.434 14.537 -11.049
101 HG13 VAL 15 3HG1 VAL 15 11.725 16.152 -11.105
102 HG21 VAL 15 3HG2 VAL 15 11.492 16.703 -8.086
103 HG22 VAL 15 1HG2 VAL 15 12.118 17.763 -9.349
104 HG23 VAL 15 2HG2 VAL 15 13.120 17.367 -7.952
105 H VAL 16 H VAL 16 12.778 15.046 -5.971
106 HA VAL 16 HA VAL 16 10.269 13.570 -6.021
107 HB VAL 16 HB VAL 16 10.851 12.487 -3.828
108 HG11 VAL 16 1HG1 VAL 16 10.958 11.187 -5.889
109 HG12 VAL 16 2HG1 VAL 16 12.227 10.688 -4.769
110 HG13 VAL 16 3HG1 VAL 16 12.620 11.718 -6.145
111 HG21 VAL 16 3HG2 VAL 16 12.665 13.921 -3.116
112 HG22 VAL 16 1HG2 VAL 16 13.643 13.426 -4.499
113 HG23 VAL 16 2HG2 VAL 16 13.241 12.259 -3.241
114 H MET 17 H MET 17 9.187 13.847 -3.789
115 HA MET 17 HA MET 17 9.676 16.573 -2.852
116 HB2 MET 17 1HB MET 17 7.101 14.978 -2.778
117 HB3 MET 17 2HB MET 17 7.336 16.549 -2.027
118 HG2 MET 17 1HG MET 17 7.822 17.499 -4.263
119 HG3 MET 17 2HG MET 17 7.462 15.922 -4.952
120 HE1 MET 17 3HE MET 17 5.609 17.698 -1.927
121 HE2 MET 17 1HE MET 17 4.384 18.602 -2.807
122 HE3 MET 17 2HE MET 17 6.092 19.006 -3.005
123 H GLY 18 H GLY 18 10.160 16.790 -0.752
124 HA2 GLY 18 1HA GLY 18 9.964 14.346 0.904
125 HA3 GLY 18 2HA GLY 18 11.433 15.227 0.820
126 H ARG 19 H ARG 19 9.696 14.728 3.064
127 HA ARG 19 HA ARG 19 8.443 17.224 3.758
128 HB2 ARG 19 1HB ARG 19 7.618 15.037 4.600
129 HB3 ARG 19 2HB ARG 19 9.104 14.865 5.519
130 HG2 ARG 19 1HG ARG 19 8.507 17.008 6.689
131 HG3 ARG 19 2HG ARG 19 6.929 16.897 5.909
132 HD2 ARG 19 1HD ARG 19 6.883 15.962 8.174
133 HD3 ARG 19 2HD ARG 19 6.556 14.729 6.953
134 HE ARG 19 HE ARG 19 8.704 13.826 7.291
135 HH11 ARG 19 1HH1 ARG 19 7.895 16.292 9.713
136 HH12 ARG 19 2HH1 ARG 19 9.207 15.893 10.714
137 HH21 ARG 19 1HH2 ARG 19 10.439 13.304 8.632
138 HH22 ARG 19 2HH2 ARG 19 10.705 14.169 10.085
139 H TRP 20 H TRP 20 9.277 18.818 4.936
140 HA TRP 20 HA TRP 20 12.081 18.777 5.527
141 HB2 TRP 20 1HB TRP 20 10.888 20.825 4.651
142 HB3 TRP 20 2HB TRP 20 10.058 20.937 6.199
143 HD1 TRP 20 HD1 TRP 20 11.715 21.435 8.397
144 HE1 TRP 20 HE1 TRP 20 13.909 22.772 8.513
145 HE3 TRP 20 HE3 TRP 20 12.834 21.544 3.452
146 HZ2 TRP 20 HZ2 TRP 20 15.856 23.735 6.727
147 HZ3 TRP 20 HZ3 TRP 20 14.864 22.698 2.715
148 HH2 TRP 20 HH2 TRP 20 16.335 23.760 4.252
149 HA PRO 21 HA PRO 21 11.290 17.168 9.636
150 HB2 PRO 21 1HB PRO 21 13.873 17.473 10.528
151 HB3 PRO 21 2HB PRO 21 13.335 16.105 9.548
152 HG2 PRO 21 1HG PRO 21 14.780 18.590 8.705
153 HG3 PRO 21 2HG PRO 21 15.006 16.922 8.150
154 HD2 PRO 21 1HD PRO 21 13.660 18.800 6.769
155 HD3 PRO 21 2HD PRO 21 13.250 17.075 6.659
156 H GLY 22 H GLY 22 10.139 18.553 10.837
157 HA2 GLY 22 1HA GLY 22 10.518 20.011 12.791
158 HA3 GLY 22 2HA GLY 22 11.458 21.029 11.704
159 H SER 23 H SER 23 9.964 21.279 9.493
160 HA SER 23 HA SER 23 7.809 22.882 10.531
161 HB2 SER 23 1HB SER 23 7.701 23.728 8.203
162 HB3 SER 23 2HB SER 23 9.312 23.851 8.909
163 HG SER 23 HG SER 23 9.635 22.956 6.956
164 H VAL 24 H VAL 24 8.266 19.897 8.997
165 HA VAL 24 HA VAL 24 6.923 18.170 8.416
166 HB VAL 24 HB VAL 24 4.546 19.737 9.544
167 HG11 VAL 24 1HG1 VAL 24 3.558 17.536 9.977
168 HG12 VAL 24 2HG1 VAL 24 4.979 16.776 9.252
169 HG13 VAL 24 3HG1 VAL 24 3.913 17.768 8.259
170 HG21 VAL 24 3HG2 VAL 24 6.385 17.862 11.032
171 HG22 VAL 24 1HG2 VAL 24 4.930 18.613 11.684
172 HG23 VAL 24 2HG2 VAL 24 6.313 19.613 11.236
173 H LEU 25 H LEU 25 7.258 20.766 6.874
174 HA LEU 25 HA LEU 25 5.013 20.784 5.042
175 HB2 LEU 25 1HB LEU 25 7.582 22.256 5.081
176 HB3 LEU 25 2HB LEU 25 6.295 22.497 3.910
177 HG LEU 25 HG LEU 25 6.318 23.162 6.836
178 HD11 LEU 25 1HD1 LEU 25 7.199 24.739 5.263
179 HD12 LEU 25 2HD1 LEU 25 5.620 25.304 5.910
180 HD13 LEU 25 3HD1 LEU 25 5.726 24.490 4.322
181 HD21 LEU 25 3HD2 LEU 25 3.948 23.804 6.596
182 HD22 LEU 25 1HD2 LEU 25 4.189 22.062 6.449
183 HD23 LEU 25 2HD2 LEU 25 3.927 23.038 5.006
184 H TYR 26 H TYR 26 5.387 20.480 2.744
185 HA TYR 26 HA TYR 26 7.545 18.587 2.254
186 HB2 TYR 26 1HB TYR 26 4.755 18.644 1.127
187 HB3 TYR 26 2HB TYR 26 6.056 17.796 0.292
188 HD1 TYR 26 HD1 TYR 26 4.102 17.902 3.449
189 HD2 TYR 26 HD2 TYR 26 6.848 15.705 1.053
190 HE1 TYR 26 HE1 TYR 26 3.822 15.954 4.924
191 HE2 TYR 26 HE2 TYR 26 6.586 13.758 2.498
192 HH TYR 26 HH TYR 26 4.096 13.529 4.843
193 H TYR 27 H TYR 27 8.969 18.930 0.792
194 HA TYR 27 HA TYR 27 8.658 21.285 -0.929
195 HB2 TYR 27 1HB TYR 27 10.981 20.341 0.696
196 HB3 TYR 27 2HB TYR 27 11.205 21.426 -0.672
197 HD1 TYR 27 HD1 TYR 27 9.579 21.100 2.652
198 HD2 TYR 27 HD2 TYR 27 10.806 23.707 -0.456
199 HE1 TYR 27 HE1 TYR 27 9.124 23.040 4.099
200 HE2 TYR 27 HE2 TYR 27 10.353 25.640 0.963
201 HH TYR 27 HH TYR 27 9.790 25.334 4.294
202 H GLU 28 H GLU 28 9.859 21.206 -2.866
203 HA GLU 28 HA GLU 28 10.069 18.515 -3.959
204 HB2 GLU 28 1HB GLU 28 8.864 20.323 -5.198
205 HB3 GLU 28 2HB GLU 28 10.371 21.221 -5.282
206 HG2 GLU 28 1HG GLU 28 11.358 19.510 -6.672
207 HG3 GLU 28 2HG GLU 28 9.905 18.520 -6.519
208 H VAL 29 H VAL 29 11.995 17.553 -4.194
209 HA VAL 29 HA VAL 29 14.453 19.131 -3.947
210 HB VAL 29 HB VAL 29 15.380 17.441 -2.398
211 HG11 VAL 29 1HG1 VAL 29 14.147 18.069 -0.401
212 HG12 VAL 29 2HG1 VAL 29 12.838 18.680 -1.415
213 HG13 VAL 29 3HG1 VAL 29 14.425 19.447 -1.464
214 HG21 VAL 29 3HG2 VAL 29 14.000 15.542 -3.003
215 HG22 VAL 29 1HG2 VAL 29 12.579 16.333 -2.323
216 HG23 VAL 29 2HG2 VAL 29 13.904 15.844 -1.268
217 H GLN 30 H GLN 30 16.352 17.707 -4.495
218 HA GLN 30 HA GLN 30 15.535 15.631 -6.412
219 HB2 GLN 30 1HB GLN 30 18.232 17.000 -6.425
220 HB3 GLN 30 2HB GLN 30 17.498 16.057 -7.706
221 HG2 GLN 30 1HG GLN 30 17.249 18.156 -8.575
222 HG3 GLN 30 2HG GLN 30 15.745 18.035 -7.672
223 HE21 GLN 30 2HE2 GLN 30 15.546 20.223 -7.325
224 HE22 GLN 30 1HE2 GLN 30 16.593 21.108 -6.271
225 H VAL 31 H VAL 31 16.257 13.629 -5.882
226 HA VAL 31 HA VAL 31 17.623 13.371 -3.378
227 HB VAL 31 HB VAL 31 15.904 11.663 -4.090
228 HG11 VAL 31 1HG1 VAL 31 17.754 11.083 -6.251
229 HG12 VAL 31 2HG1 VAL 31 16.048 11.528 -6.288
230 HG13 VAL 31 3HG1 VAL 31 16.542 9.950 -5.664
231 HG21 VAL 31 3HG2 VAL 31 17.558 10.991 -2.407
232 HG22 VAL 31 1HG2 VAL 31 18.650 10.481 -3.695
233 HG23 VAL 31 2HG2 VAL 31 17.119 9.642 -3.453
234 H THR 32 H THR 32 19.750 13.104 -3.005
235 HA THR 32 HA THR 32 21.347 13.164 -5.435
236 HB THR 32 HB THR 32 21.474 15.276 -4.197
237 HG1 THR 32 HG1 THR 32 23.300 14.554 -5.354
238 HG21 THR 32 3HG2 THR 32 22.704 13.656 -1.968
239 HG22 THR 32 1HG2 THR 32 21.151 14.488 -1.914
240 HG23 THR 32 2HG2 THR 32 22.644 15.419 -2.030
241 H SER 33 H SER 33 21.010 11.587 -2.306
242 HA SER 33 HA SER 33 22.380 9.346 -3.346
243 HB2 SER 33 1HB SER 33 24.336 10.860 -2.645
244 HB3 SER 33 2HB SER 33 23.785 10.648 -0.984
245 HG SER 33 HG SER 33 24.645 8.662 -2.802
246 H TYR 34 H TYR 34 22.871 7.890 -1.200
247 HA TYR 34 HA TYR 34 20.659 8.034 0.647
248 HB2 TYR 34 1HB TYR 34 19.526 6.870 -1.086
249 HB3 TYR 34 2HB TYR 34 20.942 5.917 -1.484
250 HD1 TYR 34 HD1 TYR 34 18.661 6.465 1.448
251 HD2 TYR 34 HD2 TYR 34 20.905 3.714 -0.863
252 HE1 TYR 34 HE1 TYR 34 17.800 4.618 2.820
253 HE2 TYR 34 HE2 TYR 34 20.057 1.860 0.493
254 HH TYR 34 HH TYR 34 19.136 1.459 2.620
255 H ASP 35 H ASP 35 21.302 7.302 2.556
256 HA ASP 35 HA ASP 35 23.776 5.728 2.742
257 HB2 ASP 35 1HB ASP 35 23.612 7.724 4.212
258 HB3 ASP 35 2HB ASP 35 22.109 7.099 4.885
259 H ASP 36 H ASP 36 23.578 3.632 3.005
260 HA ASP 36 HA ASP 36 20.897 2.560 3.211
261 HB2 ASP 36 1HB ASP 36 21.910 0.350 2.649
262 HB3 ASP 36 2HB ASP 36 22.147 1.588 1.429
263 H ALA 37 H ALA 37 23.597 2.946 5.193
264 HA ALA 37 HA ALA 37 23.089 0.765 6.932
265 HB1 ALA 37 1HB ALA 37 24.620 1.917 8.470
266 HB2 ALA 37 2HB ALA 37 24.579 3.335 7.419
267 HB3 ALA 37 3HB ALA 37 25.274 1.826 6.834
268 H SER 38 H SER 38 22.309 4.251 7.128
269 HA SER 38 HA SER 38 20.588 3.640 9.404
270 HB2 SER 38 1HB SER 38 21.384 6.283 8.185
271 HB3 SER 38 2HB SER 38 20.494 6.055 9.695
272 HG SER 38 HG SER 38 23.102 5.093 9.143
273 H HIS 39 H HIS 39 20.286 3.664 6.131
274 HA HIS 39 HA HIS 39 18.626 3.811 4.618
275 HB2 HIS 39 1HB HIS 39 16.804 3.524 7.035
276 HB3 HIS 39 2HB HIS 39 16.277 3.382 5.365
277 HD1 HIS 39 HD1 HIS 39 17.263 1.240 4.029
278 HD2 HIS 39 HD2 HIS 39 17.844 1.283 8.142
279 HE1 HIS 39 HE1 HIS 39 17.816 -1.131 4.682
280 H LEU 40 H LEU 40 19.701 6.118 5.109
281 HA LEU 40 HA LEU 40 17.509 8.094 5.351
282 HB2 LEU 40 1HB LEU 40 20.357 8.172 6.222
283 HB3 LEU 40 2HB LEU 40 19.708 9.646 5.555
284 HG LEU 40 HG LEU 40 19.690 9.634 8.010
285 HD11 LEU 40 1HD1 LEU 40 16.935 9.616 6.835
286 HD12 LEU 40 2HD1 LEU 40 18.059 10.971 6.873
287 HD13 LEU 40 3HD1 LEU 40 17.405 10.326 8.379
288 HD21 LEU 40 3HD2 LEU 40 17.728 7.368 7.770
289 HD22 LEU 40 1HD2 LEU 40 18.144 8.223 9.253
290 HD23 LEU 40 2HD2 LEU 40 19.365 7.263 8.412
291 H TYR 41 H TYR 41 17.154 9.454 3.617
292 HA TYR 41 HA TYR 41 18.890 8.968 1.317
293 HB2 TYR 41 1HB TYR 41 16.039 9.925 1.533
294 HB3 TYR 41 2HB TYR 41 16.974 10.078 0.054
295 HD1 TYR 41 HD2 TYR 41 15.908 7.513 2.539
296 HD2 TYR 41 HD1 TYR 41 16.857 8.372 -1.516
297 HE1 TYR 41 HE2 TYR 41 15.228 5.249 1.900
298 HE2 TYR 41 HE1 TYR 41 16.167 6.102 -2.162
299 HH TYR 41 HH TYR 41 14.557 4.024 0.105
300 H THR 42 H THR 42 20.136 10.557 0.664
301 HA THR 42 HA THR 42 19.828 13.089 2.033
302 HB THR 42 HB THR 42 22.010 12.249 0.101
303 HG1 THR 42 HG1 THR 42 23.147 11.553 1.883
304 HG21 THR 42 3HG2 THR 42 21.898 14.301 2.326
305 HG22 THR 42 1HG2 THR 42 21.873 14.648 0.600
306 HG23 THR 42 2HG2 THR 42 23.317 13.950 1.340
307 H VAL 43 H VAL 43 19.009 14.744 1.005
308 HA VAL 43 HA VAL 43 18.576 14.582 -1.877
309 HB VAL 43 HB VAL 43 16.430 15.768 -1.560
310 HG11 VAL 43 1HG1 VAL 43 16.610 13.145 -0.088
311 HG12 VAL 43 2HG1 VAL 43 16.337 13.375 -1.819
312 HG13 VAL 43 3HG1 VAL 43 15.118 13.888 -0.659
313 HG21 VAL 43 3HG2 VAL 43 15.390 15.893 0.672
314 HG22 VAL 43 1HG2 VAL 43 16.871 16.851 0.583
315 HG23 VAL 43 2HG2 VAL 43 16.880 15.280 1.389
316 H LYS 44 H LYS 44 18.304 16.666 -2.820
317 HA LYS 44 HA LYS 44 19.808 18.710 -1.383
318 HB2 LYS 44 1HB LYS 44 21.178 17.697 -3.082
319 HB3 LYS 44 2HB LYS 44 19.891 17.842 -4.265
320 HG2 LYS 44 1HG LYS 44 20.171 20.193 -4.401
321 HG3 LYS 44 2HG LYS 44 21.240 20.211 -2.997
322 HD2 LYS 44 1HD LYS 44 22.462 20.409 -5.134
323 HD3 LYS 44 2HD LYS 44 22.932 18.988 -4.211
324 HE2 LYS 44 1HE LYS 44 22.745 18.433 -6.565
325 HE3 LYS 44 2HE LYS 44 21.504 17.600 -5.648
326 HZ1 LYS 44 3HZ LYS 44 21.106 20.048 -7.294
327 HZ2 LYS 44 1HZ LYS 44 19.890 19.272 -6.412
328 HZ3 LYS 44 2HZ LYS 44 20.632 18.487 -7.691
329 H TYR 45 H TYR 45 18.888 20.663 -1.369
330 HA TYR 45 HA TYR 45 16.292 20.954 -2.604
331 HB2 TYR 45 1HB TYR 45 17.768 22.573 -0.539
332 HB3 TYR 45 2HB TYR 45 16.303 23.176 -1.298
333 HD1 TYR 45 HD1 TYR 45 17.642 20.343 0.712
334 HD2 TYR 45 HD2 TYR 45 14.196 22.473 -0.573
335 HE1 TYR 45 HE1 TYR 45 16.251 19.022 2.246
336 HE2 TYR 45 HE2 TYR 45 12.807 21.170 0.941
337 HH TYR 45 HH TYR 45 12.853 18.985 2.106
338 H LYS 46 H LYS 46 15.768 22.959 -3.597
339 HA LYS 46 HA LYS 46 17.322 23.412 -5.861
340 HB2 LYS 46 1HB LYS 46 14.846 23.711 -5.550
341 HB3 LYS 46 2HB LYS 46 15.200 25.219 -4.728
342 HG2 LYS 46 1HG LYS 46 14.562 25.615 -6.994
343 HG3 LYS 46 2HG LYS 46 16.266 26.043 -6.719
344 HD2 LYS 46 1HD LYS 46 17.051 24.110 -7.827
345 HD3 LYS 46 2HD LYS 46 15.461 23.351 -7.798
346 HE2 LYS 46 1HE LYS 46 16.000 24.070 -10.040
347 HE3 LYS 46 2HE LYS 46 14.669 25.020 -9.398
348 HZ1 LYS 46 3HZ LYS 46 17.486 25.936 -9.482
349 HZ2 LYS 46 1HZ LYS 46 16.135 26.875 -9.062
350 HZ3 LYS 46 2HZ LYS 46 16.313 26.293 -10.637
351 H ASP 47 H ASP 47 17.334 24.846 -2.742
352 HA ASP 47 HA ASP 47 18.814 27.190 -3.498
353 HB2 ASP 47 1HB ASP 47 18.060 26.074 -0.788
354 HB3 ASP 47 2HB ASP 47 18.967 27.563 -1.011
355 H GLY 48 H GLY 48 19.709 24.051 -3.324
356 HA2 GLY 48 1HA GLY 48 21.937 23.399 -3.768
357 HA3 GLY 48 2HA GLY 48 22.508 24.825 -2.909
358 H THR 49 H THR 49 20.738 24.401 -0.687
359 HA THR 49 HA THR 49 22.280 23.088 1.152
360 HB THR 49 HB THR 49 19.285 23.369 1.213
361 HG1 THR 49 HG1 THR 49 19.625 25.513 1.764
362 HG21 THR 49 3HG2 THR 49 20.338 22.252 3.153
363 HG22 THR 49 1HG2 THR 49 19.675 23.824 3.600
364 HG23 THR 49 2HG2 THR 49 21.412 23.638 3.354
365 H GLU 50 H GLU 50 22.540 20.877 1.598
366 HA GLU 50 HA GLU 50 20.481 19.159 0.509
367 HB2 GLU 50 1HB GLU 50 22.213 17.280 0.780
368 HB3 GLU 50 2HB GLU 50 22.456 18.432 -0.512
369 HG2 GLU 50 1HG GLU 50 24.559 18.016 0.411
370 HG3 GLU 50 2HG GLU 50 24.083 19.609 0.974
371 H LEU 51 H LEU 51 19.736 17.391 1.688
372 HA LEU 51 HA LEU 51 19.951 17.677 4.592
373 HB2 LEU 51 1HB LEU 51 18.067 19.039 3.719
374 HB3 LEU 51 2HB LEU 51 17.404 17.575 3.020
375 HG LEU 51 HG LEU 51 17.189 16.647 5.322
376 HD11 LEU 51 1HD1 LEU 51 18.838 18.016 6.461
377 HD12 LEU 51 2HD1 LEU 51 17.251 18.215 7.203
378 HD13 LEU 51 3HD1 LEU 51 17.889 19.463 6.133
379 HD21 LEU 51 3HD2 LEU 51 15.743 19.220 4.753
380 HD22 LEU 51 1HD2 LEU 51 15.225 17.947 5.853
381 HD23 LEU 51 2HD2 LEU 51 15.321 17.624 4.122
382 H ALA 52 H ALA 52 19.383 15.691 5.674
383 HA ALA 52 HA ALA 52 18.942 13.427 3.864
384 HB1 ALA 52 1HB ALA 52 20.062 13.445 6.676
385 HB2 ALA 52 2HB ALA 52 20.999 13.240 5.199
386 HB3 ALA 52 3HB ALA 52 19.822 12.014 5.672
387 H LEU 53 H LEU 53 17.115 12.334 4.105
388 HA LEU 53 HA LEU 53 15.528 12.662 6.490
389 HB2 LEU 53 1HB LEU 53 13.467 12.917 4.904
390 HB3 LEU 53 2HB LEU 53 14.406 14.320 5.368
391 HG LEU 53 HG LEU 53 15.562 14.264 3.181
392 HD11 LEU 53 1HD1 LEU 53 13.687 12.073 2.519
393 HD12 LEU 53 2HD1 LEU 53 15.439 11.910 2.796
394 HD13 LEU 53 3HD1 LEU 53 14.826 12.876 1.436
395 HD21 LEU 53 3HD2 LEU 53 13.640 14.809 1.768
396 HD22 LEU 53 1HD2 LEU 53 13.571 15.628 3.349
397 HD23 LEU 53 2HD2 LEU 53 12.586 14.187 3.030
398 H LYS 54 H LYS 54 13.438 11.202 6.212
399 HA LYS 54 HA LYS 54 14.527 8.557 5.758
400 HB2 LYS 54 1HB LYS 54 11.818 9.465 6.710
401 HB3 LYS 54 2HB LYS 54 12.359 7.796 6.645
402 HG2 LYS 54 1HG LYS 54 14.044 8.241 8.304
403 HG3 LYS 54 2HG LYS 54 13.627 9.954 8.308
404 HD2 LYS 54 1HD LYS 54 11.382 9.414 9.084
405 HD3 LYS 54 2HD LYS 54 11.775 7.698 9.064
406 HE2 LYS 54 1HE LYS 54 13.522 8.093 10.733
407 HE3 LYS 54 2HE LYS 54 13.103 9.806 10.748
408 HZ1 LYS 54 3HZ LYS 54 10.892 9.211 11.541
409 HZ2 LYS 54 1HZ LYS 54 12.075 8.610 12.575
410 HZ3 LYS 54 2HZ LYS 54 11.308 7.577 11.515
411 H GLU 55 H GLU 55 13.461 7.005 4.428
412 HA GLU 55 HA GLU 55 12.588 7.909 1.906
413 HB2 GLU 55 1HB GLU 55 11.627 5.405 1.861
414 HB3 GLU 55 2HB GLU 55 13.315 5.772 1.598
415 HG2 GLU 55 1HG GLU 55 12.949 3.839 3.108
416 HG3 GLU 55 2HG GLU 55 13.853 5.138 3.877
417 H SER 56 H SER 56 10.917 7.143 4.823
418 HA SER 56 HA SER 56 8.303 7.085 3.734
419 HB2 SER 56 1HB SER 56 9.242 7.588 6.566
420 HB3 SER 56 2HB SER 56 7.593 7.187 6.088
421 HG SER 56 HG SER 56 9.825 5.464 5.526
422 H ASP 57 H ASP 57 10.492 9.636 4.281
423 HA ASP 57 HA ASP 57 8.364 11.609 4.598
424 HB2 ASP 57 1HB ASP 57 11.372 11.951 4.550
425 HB3 ASP 57 2HB ASP 57 10.234 13.274 4.707
426 H ILE 58 H ILE 58 9.828 9.917 2.186
427 HA ILE 58 HA ILE 58 9.873 12.195 0.369
428 HB ILE 58 HB ILE 58 11.052 9.431 0.021
429 HG12 ILE 58 1HG1 ILE 58 12.300 12.134 0.443
430 HG13 ILE 58 2HG1 ILE 58 12.280 10.787 1.576
431 HG21 ILE 58 1HG2 ILE 58 11.176 11.822 -1.811
432 HG22 ILE 58 2HG2 ILE 58 10.280 10.334 -2.123
433 HG23 ILE 58 3HG2 ILE 58 12.045 10.305 -2.047
434 HD11 ILE 58 3HD1 ILE 58 13.645 10.793 -1.098
435 HD12 ILE 58 1HD1 ILE 58 13.694 9.491 0.101
436 HD13 ILE 58 2HD1 ILE 58 14.403 11.079 0.464
437 H ARG 59 H ARG 59 8.548 12.389 -1.115
438 HA ARG 59 HA ARG 59 6.846 10.157 -2.003
439 HB2 ARG 59 1HB ARG 59 6.104 13.100 -1.761
440 HB3 ARG 59 2HB ARG 59 5.079 11.860 -2.473
441 HG2 ARG 59 1HG ARG 59 4.912 10.732 -0.326
442 HG3 ARG 59 2HG ARG 59 5.989 11.924 0.398
443 HD2 ARG 59 1HD ARG 59 4.367 13.678 -0.067
444 HD3 ARG 59 2HD ARG 59 3.287 12.504 -0.819
445 HE ARG 59 HE ARG 59 3.977 11.698 1.794
446 HH11 ARG 59 1HH1 ARG 59 1.944 14.074 0.148
447 HH12 ARG 59 2HH1 ARG 59 0.770 14.144 1.379
448 HH21 ARG 59 1HH2 ARG 59 2.389 11.788 3.477
449 HH22 ARG 59 2HH2 ARG 59 1.016 12.798 3.320
450 H LEU 60 H LEU 60 6.265 10.513 -4.374
451 HA LEU 60 HA LEU 60 8.648 11.416 -5.722
452 HB2 LEU 60 1HB LEU 60 6.038 10.429 -6.879
453 HB3 LEU 60 2HB LEU 60 7.507 10.694 -7.785
454 HG LEU 60 HG LEU 60 7.064 8.597 -5.670
455 HD11 LEU 60 1HD1 LEU 60 6.012 8.168 -7.823
456 HD12 LEU 60 2HD1 LEU 60 7.327 7.040 -7.494
457 HD13 LEU 60 3HD1 LEU 60 7.566 8.370 -8.627
458 HD21 LEU 60 3HD2 LEU 60 9.355 9.400 -5.525
459 HD22 LEU 60 1HD2 LEU 60 9.551 9.226 -7.270
460 HD23 LEU 60 2HD2 LEU 60 9.315 7.802 -6.262
461 H GLN 61 H GLN 61 8.478 12.912 -7.670
462 HA GLN 61 HA GLN 61 7.576 15.450 -6.810
463 HB2 GLN 61 1HB GLN 61 9.446 14.866 -8.491
464 HB3 GLN 61 2HB GLN 61 8.178 14.652 -9.678
465 HG2 GLN 61 1HG GLN 61 8.632 17.236 -8.202
466 HG3 GLN 61 2HG GLN 61 9.409 16.845 -9.729
467 HE21 GLN 61 2HE2 GLN 61 7.609 18.994 -9.041
468 HE22 GLN 61 1HE2 GLN 61 6.274 18.868 -10.133
469 H SER 62 H SER 62 6.284 13.078 -8.986
470 HA SER 62 HA SER 62 3.652 14.286 -8.678
471 HB2 SER 62 1HB SER 62 4.444 13.865 -11.063
472 HB3 SER 62 2HB SER 62 4.594 12.159 -10.655
473 HG SER 62 HG SER 62 2.386 13.669 -11.215
474 H SER 63 H SER 63 3.077 13.478 -6.751
475 HA SER 63 HA SER 63 4.283 11.244 -5.609
476 HB2 SER 63 1HB SER 63 1.849 12.752 -4.699
477 HB3 SER 63 2HB SER 63 2.854 11.691 -3.708
478 HG SER 63 HG SER 63 4.542 13.355 -4.825
479 H PHE 64 H PHE 64 1.535 11.357 -7.641
480 HA PHE 64 HA PHE 64 0.629 8.801 -6.613
481 HB2 PHE 64 1HB PHE 64 -0.541 10.591 -8.758
482 HB3 PHE 64 2HB PHE 64 -1.211 9.024 -8.317
483 HD1 PHE 64 HD1 PHE 64 -2.329 8.700 -6.185
484 HD2 PHE 64 HD2 PHE 64 -0.743 12.489 -7.271
485 HE1 PHE 64 HE1 PHE 64 -3.612 9.748 -4.369
486 HE2 PHE 64 HE2 PHE 64 -2.030 13.553 -5.459
487 HZ PHE 64 HZ PHE 64 -3.466 12.181 -4.004
488 H LYS 65 H LYS 65 2.007 7.283 -7.136
489 HA LYS 65 HA LYS 65 3.344 7.362 -9.665
490 HB2 LYS 65 1HB LYS 65 4.641 6.712 -7.701
491 HB3 LYS 65 2HB LYS 65 3.589 5.331 -7.450
492 HG2 LYS 65 1HG LYS 65 5.755 4.739 -8.520
493 HG3 LYS 65 2HG LYS 65 4.350 4.280 -9.480
494 HD2 LYS 65 1HD LYS 65 4.648 6.278 -10.875
495 HD3 LYS 65 2HD LYS 65 6.041 6.756 -9.904
496 HE2 LYS 65 1HE LYS 65 6.670 5.694 -12.030
497 HE3 LYS 65 2HE LYS 65 7.252 4.798 -10.634
498 HZ1 LYS 65 3HZ LYS 65 6.271 3.484 -12.485
499 HZ2 LYS 65 1HZ LYS 65 4.741 4.039 -12.079
500 HZ3 LYS 65 2HZ LYS 65 5.665 3.119 -10.976
501 H GLN 66 H GLN 66 2.430 6.749 -11.355
502 HA GLN 66 HA GLN 66 0.898 4.271 -11.340
503 HB2 GLN 66 1HB GLN 66 0.537 6.752 -13.045
504 HB3 GLN 66 2HB GLN 66 -0.391 5.265 -13.198
505 HG2 GLN 66 1HG GLN 66 -1.422 5.593 -11.087
506 HG3 GLN 66 2HG GLN 66 -0.308 6.893 -10.677
507 HE21 GLN 66 2HE2 GLN 66 -0.623 8.899 -11.530
508 HE22 GLN 66 1HE2 GLN 66 -2.075 9.351 -12.328
Start of MODEL 4
1 H1 GLY 1 H GLY 1 3.594 -5.089 -17.151
2 HA2 GLY 1 2HA GLY 1 5.135 -3.448 -16.254
3 HA3 GLY 1 1HA GLY 1 3.782 -3.766 -15.169
4 H ALA 2 H ALA 2 6.304 -2.714 -14.410
5 HA ALA 2 HA ALA 2 7.595 -4.936 -13.012
6 HB1 ALA 2 1HB ALA 2 9.066 -3.474 -14.320
7 HB2 ALA 2 2HB ALA 2 9.421 -3.335 -12.596
8 HB3 ALA 2 3HB ALA 2 8.494 -2.077 -13.412
9 H MET 3 H MET 3 8.499 -3.992 -10.780
10 HA MET 3 HA MET 3 6.124 -3.243 -9.293
11 HB2 MET 3 1HB MET 3 7.520 -5.097 -8.473
12 HB3 MET 3 2HB MET 3 8.903 -4.021 -8.374
13 HG2 MET 3 1HG MET 3 7.922 -4.423 -6.187
14 HG3 MET 3 2HG MET 3 7.795 -2.728 -6.643
15 HE1 MET 3 3HE MET 3 6.168 -4.049 -4.260
16 HE2 MET 3 1HE MET 3 4.573 -3.335 -4.510
17 HE3 MET 3 2HE MET 3 6.023 -2.352 -4.717
18 H GLY 4 H GLY 4 5.759 -1.238 -8.593
19 HA2 GLY 4 1HA GLY 4 7.152 0.998 -9.470
20 HA3 GLY 4 2HA GLY 4 6.024 0.998 -8.124
21 H MET 5 H MET 5 7.399 -0.634 -6.395
22 HA MET 5 HA MET 5 9.988 0.616 -6.069
23 HB2 MET 5 1HB MET 5 9.629 0.755 -3.575
24 HB3 MET 5 2HB MET 5 8.655 1.865 -4.512
25 HG2 MET 5 1HG MET 5 7.633 -0.735 -3.363
26 HG3 MET 5 2HG MET 5 7.491 0.828 -2.565
27 HE1 MET 5 3HE MET 5 3.798 0.104 -3.650
28 HE2 MET 5 1HE MET 5 4.867 0.556 -2.320
29 HE3 MET 5 2HE MET 5 4.997 -1.040 -3.048
30 HA PRO 6 HA PRO 6 10.628 -3.878 -6.175
31 HB2 PRO 6 1HB PRO 6 13.418 -2.890 -6.510
32 HB3 PRO 6 2HB PRO 6 12.528 -4.066 -7.481
33 HG2 PRO 6 1HG PRO 6 12.987 -1.625 -8.425
34 HG3 PRO 6 2HG PRO 6 11.429 -2.419 -8.704
35 HD2 PRO 6 1HD PRO 6 12.133 -0.283 -6.728
36 HD3 PRO 6 2HD PRO 6 10.685 -0.449 -7.743
37 H ASN 7 H ASN 7 12.767 -1.572 -4.662
38 HA ASN 7 HA ASN 7 12.688 -3.012 -2.115
39 HB2 ASN 7 1HB ASN 7 14.763 -3.786 -3.333
40 HB3 ASN 7 2HB ASN 7 15.276 -2.112 -3.462
41 HD21 ASN 7 2HD2 ASN 7 16.602 -4.379 -2.249
42 HD22 ASN 7 1HD2 ASN 7 16.888 -3.976 -0.601
43 H ARG 8 H ARG 8 14.197 -0.387 -3.880
44 HA ARG 8 HA ARG 8 12.900 1.528 -2.102
45 HB2 ARG 8 1HB ARG 8 15.672 1.760 -3.361
46 HB3 ARG 8 2HB ARG 8 14.856 3.009 -2.452
47 HG2 ARG 8 1HG ARG 8 14.966 1.623 -0.452
48 HG3 ARG 8 2HG ARG 8 15.781 0.362 -1.391
49 HD2 ARG 8 1HD ARG 8 16.771 3.150 -1.010
50 HD3 ARG 8 2HD ARG 8 17.346 1.709 -0.176
51 HE ARG 8 HE ARG 8 18.085 0.857 -2.310
52 HH11 ARG 8 1HH1 ARG 8 17.325 4.329 -2.287
53 HH12 ARG 8 2HH1 ARG 8 18.441 4.705 -3.520
54 HH21 ARG 8 1HH2 ARG 8 19.555 1.373 -4.000
55 HH22 ARG 8 2HH2 ARG 8 19.757 2.992 -4.514
56 H LYS 9 H LYS 9 12.237 3.428 -3.267
57 HA LYS 9 HA LYS 9 11.843 2.893 -6.113
58 HB2 LYS 9 1HB LYS 9 9.965 3.559 -4.438
59 HB3 LYS 9 2HB LYS 9 10.671 5.158 -4.480
60 HG2 LYS 9 1HG LYS 9 9.504 3.680 -6.843
61 HG3 LYS 9 2HG LYS 9 8.708 4.964 -5.939
62 HD2 LYS 9 1HD LYS 9 10.414 6.550 -6.676
63 HD3 LYS 9 2HD LYS 9 11.282 5.257 -7.497
64 HE2 LYS 9 1HE LYS 9 9.277 4.919 -8.917
65 HE3 LYS 9 2HE LYS 9 8.560 6.346 -8.185
66 HZ1 LYS 9 3HZ LYS 9 10.964 6.174 -9.900
67 HZ2 LYS 9 1HZ LYS 9 10.688 7.541 -8.942
68 HZ3 LYS 9 2HZ LYS 9 9.593 7.113 -10.149
69 H TYR 10 H TYR 10 13.214 5.160 -3.828
70 HA TYR 10 HA TYR 10 13.760 7.095 -5.885
71 HB2 TYR 10 1HB TYR 10 14.481 7.280 -2.960
72 HB3 TYR 10 2HB TYR 10 14.317 8.604 -4.113
73 HD1 TYR 10 HD1 TYR 10 11.873 8.547 -5.348
74 HD2 TYR 10 HD2 TYR 10 12.745 7.061 -1.460
75 HE1 TYR 10 HE1 TYR 10 9.500 8.735 -4.749
76 HE2 TYR 10 HE2 TYR 10 10.377 7.246 -0.850
77 HH TYR 10 HH TYR 10 8.412 8.402 -1.513
78 H ALA 11 H ALA 11 15.283 6.334 -7.137
79 HA ALA 11 HA ALA 11 17.773 5.317 -6.070
80 HB1 ALA 11 1HB ALA 11 16.850 5.843 -8.893
81 HB2 ALA 11 2HB ALA 11 16.809 4.287 -8.064
82 HB3 ALA 11 3HB ALA 11 18.355 5.042 -8.449
83 H ASP 12 H ASP 12 19.765 6.368 -6.468
84 HA ASP 12 HA ASP 12 19.685 9.106 -5.989
85 HB2 ASP 12 1HB ASP 12 22.178 9.061 -6.217
86 HB3 ASP 12 2HB ASP 12 21.540 7.843 -5.129
87 H GLY 13 H GLY 13 19.502 10.804 -7.189
88 HA2 GLY 13 1HA GLY 13 20.226 12.057 -9.126
89 HA3 GLY 13 2HA GLY 13 20.043 10.586 -10.066
90 H GLU 14 H GLU 14 17.465 10.287 -8.183
91 HA GLU 14 HA GLU 14 15.767 11.260 -10.265
92 HB2 GLU 14 1HB GLU 14 15.355 9.072 -9.246
93 HB3 GLU 14 2HB GLU 14 15.120 9.831 -7.681
94 HG2 GLU 14 1HG GLU 14 13.066 10.770 -8.321
95 HG3 GLU 14 2HG GLU 14 13.377 10.519 -10.032
96 H VAL 15 H VAL 15 14.313 12.937 -10.180
97 HA VAL 15 HA VAL 15 14.694 14.765 -7.975
98 HB VAL 15 HB VAL 15 14.513 15.701 -10.267
99 HG11 VAL 15 1HG1 VAL 15 13.049 14.109 -11.320
100 HG12 VAL 15 2HG1 VAL 15 12.385 15.733 -11.493
101 HG13 VAL 15 3HG1 VAL 15 11.707 14.625 -10.301
102 HG21 VAL 15 3HG2 VAL 15 13.841 17.132 -8.435
103 HG22 VAL 15 1HG2 VAL 15 12.201 16.494 -8.512
104 HG23 VAL 15 2HG2 VAL 15 12.839 17.451 -9.849
105 H VAL 16 H VAL 16 13.335 14.952 -6.320
106 HA VAL 16 HA VAL 16 10.907 13.327 -6.318
107 HB VAL 16 HB VAL 16 11.508 12.449 -4.052
108 HG11 VAL 16 1HG1 VAL 16 13.074 10.724 -4.824
109 HG12 VAL 16 2HG1 VAL 16 13.435 11.694 -6.250
110 HG13 VAL 16 3HG1 VAL 16 11.815 11.036 -6.022
111 HG21 VAL 16 3HG2 VAL 16 14.238 13.575 -4.702
112 HG22 VAL 16 1HG2 VAL 16 13.876 12.490 -3.357
113 HG23 VAL 16 2HG2 VAL 16 13.164 14.101 -3.402
114 H MET 17 H MET 17 9.630 13.790 -4.151
115 HA MET 17 HA MET 17 10.072 16.535 -3.432
116 HB2 MET 17 1HB MET 17 7.941 16.187 -4.494
117 HB3 MET 17 2HB MET 17 7.625 14.769 -3.505
118 HG2 MET 17 1HG MET 17 7.445 16.070 -1.575
119 HG3 MET 17 2HG MET 17 7.981 17.502 -2.467
120 HE1 MET 17 3HE MET 17 4.933 18.336 -4.724
121 HE2 MET 17 1HE MET 17 6.412 17.469 -5.150
122 HE3 MET 17 2HE MET 17 6.486 18.870 -4.083
123 H GLY 18 H GLY 18 10.542 16.893 -1.310
124 HA2 GLY 18 1HA GLY 18 10.394 14.556 0.506
125 HA3 GLY 18 2HA GLY 18 11.813 15.494 0.375
126 H ARG 19 H ARG 19 10.054 15.052 2.596
127 HA ARG 19 HA ARG 19 8.826 17.616 3.209
128 HB2 ARG 19 1HB ARG 19 7.775 15.452 3.842
129 HB3 ARG 19 2HB ARG 19 9.166 15.095 4.849
130 HG2 ARG 19 1HG ARG 19 8.622 17.087 6.215
131 HG3 ARG 19 2HG ARG 19 7.168 17.313 5.243
132 HD2 ARG 19 1HD ARG 19 6.616 16.148 7.279
133 HD3 ARG 19 2HD ARG 19 6.405 15.060 5.909
134 HE ARG 19 HE ARG 19 8.974 14.610 6.811
135 HH11 ARG 19 1HH1 ARG 19 5.760 14.325 8.300
136 HH12 ARG 19 2HH1 ARG 19 6.243 13.086 9.364
137 HH21 ARG 19 1HH2 ARG 19 9.591 13.056 8.186
138 HH22 ARG 19 2HH2 ARG 19 8.545 12.341 9.350
139 H TRP 20 H TRP 20 9.630 18.997 4.770
140 HA TRP 20 HA TRP 20 12.418 18.617 5.434
141 HB2 TRP 20 1HB TRP 20 11.335 20.909 4.925
142 HB3 TRP 20 2HB TRP 20 10.643 20.808 6.544
143 HD1 TRP 20 HD1 TRP 20 12.471 20.817 8.627
144 HE1 TRP 20 HE1 TRP 20 14.818 21.872 8.757
145 HE3 TRP 20 HE3 TRP 20 13.301 21.524 3.657
146 HZ2 TRP 20 HZ2 TRP 20 16.760 22.892 6.970
147 HZ3 TRP 20 HZ3 TRP 20 15.412 22.552 2.933
148 HH2 TRP 20 HH2 TRP 20 17.097 23.221 4.516
149 HA PRO 21 HA PRO 21 11.375 16.093 8.923
150 HB2 PRO 21 1HB PRO 21 13.746 16.541 10.318
151 HB3 PRO 21 2HB PRO 21 13.490 15.283 9.104
152 HG2 PRO 21 1HG PRO 21 14.792 17.950 8.833
153 HG3 PRO 21 2HG PRO 21 15.187 16.420 8.031
154 HD2 PRO 21 1HD PRO 21 13.897 18.435 6.828
155 HD3 PRO 21 2HD PRO 21 13.569 16.739 6.398
156 H GLY 22 H GLY 22 10.045 16.655 10.441
157 HA2 GLY 22 1HA GLY 22 9.647 17.549 12.606
158 HA3 GLY 22 2HA GLY 22 10.693 18.905 12.197
159 H SER 23 H SER 23 9.329 18.874 9.464
160 HA SER 23 HA SER 23 7.043 20.480 10.323
161 HB2 SER 23 1HB SER 23 8.871 20.749 7.944
162 HB3 SER 23 2HB SER 23 7.482 21.780 8.248
163 HG SER 23 HG SER 23 8.746 21.872 10.452
164 H VAL 24 H VAL 24 5.461 20.741 8.354
165 HA VAL 24 HA VAL 24 4.903 18.034 7.339
166 HB VAL 24 HB VAL 24 3.185 19.175 8.779
167 HG11 VAL 24 1HG1 VAL 24 1.750 20.912 7.809
168 HG12 VAL 24 2HG1 VAL 24 2.849 21.026 6.433
169 HG13 VAL 24 3HG1 VAL 24 3.411 21.451 8.049
170 HG21 VAL 24 3HG2 VAL 24 2.508 17.354 7.335
171 HG22 VAL 24 1HG2 VAL 24 2.284 18.468 5.987
172 HG23 VAL 24 2HG2 VAL 24 1.231 18.566 7.399
173 H LEU 25 H LEU 25 6.202 20.908 6.331
174 HA LEU 25 HA LEU 25 5.003 20.931 3.791
175 HB2 LEU 25 1HB LEU 25 6.883 22.670 3.337
176 HB3 LEU 25 2HB LEU 25 5.468 23.104 4.264
177 HG LEU 25 HG LEU 25 6.787 22.855 6.331
178 HD11 LEU 25 1HD1 LEU 25 9.193 22.514 6.187
179 HD12 LEU 25 2HD1 LEU 25 9.010 22.320 4.417
180 HD13 LEU 25 3HD1 LEU 25 8.233 21.184 5.497
181 HD21 LEU 25 3HD2 LEU 25 8.062 24.626 4.263
182 HD22 LEU 25 1HD2 LEU 25 8.201 24.809 6.008
183 HD23 LEU 25 2HD2 LEU 25 6.637 25.018 5.219
184 H TYR 26 H TYR 26 5.697 20.499 1.863
185 HA TYR 26 HA TYR 26 8.032 18.732 1.622
186 HB2 TYR 26 1HB TYR 26 5.311 18.580 0.327
187 HB3 TYR 26 2HB TYR 26 6.712 17.801 -0.369
188 HD1 TYR 26 HD2 TYR 26 4.542 17.848 2.653
189 HD2 TYR 26 HD1 TYR 26 7.402 15.691 0.366
190 HE1 TYR 26 HE2 TYR 26 4.098 15.833 3.995
191 HE2 TYR 26 HE1 TYR 26 6.974 13.686 1.683
192 HH TYR 26 HH TYR 26 4.305 13.448 3.816
193 H TYR 27 H TYR 27 9.333 19.080 -0.088
194 HA TYR 27 HA TYR 27 8.604 21.176 -2.018
195 HB2 TYR 27 1HB TYR 27 11.230 20.851 -0.614
196 HB3 TYR 27 2HB TYR 27 10.945 21.951 -1.955
197 HD1 TYR 27 HD2 TYR 27 9.369 23.855 -1.619
198 HD2 TYR 27 HD1 TYR 27 10.725 21.445 1.594
199 HE1 TYR 27 HE2 TYR 27 8.769 25.642 -0.033
200 HE2 TYR 27 HE1 TYR 27 10.139 23.223 3.177
201 HH TYR 27 HH TYR 27 8.223 25.843 2.345
202 H GLU 28 H GLU 28 10.092 21.061 -3.913
203 HA GLU 28 HA GLU 28 10.571 18.248 -4.483
204 HB2 GLU 28 1HB GLU 28 9.098 19.384 -6.062
205 HB3 GLU 28 2HB GLU 28 10.317 20.611 -6.346
206 HG2 GLU 28 1HG GLU 28 11.739 19.052 -7.438
207 HG3 GLU 28 2HG GLU 28 10.714 17.700 -6.968
208 H VAL 29 H VAL 29 12.488 17.494 -4.672
209 HA VAL 29 HA VAL 29 14.810 19.278 -4.643
210 HB VAL 29 HB VAL 29 15.778 17.846 -2.831
211 HG11 VAL 29 1HG1 VAL 29 14.781 19.990 -2.285
212 HG12 VAL 29 2HG1 VAL 29 14.490 18.814 -1.002
213 HG13 VAL 29 3HG1 VAL 29 13.202 19.222 -2.137
214 HG21 VAL 29 3HG2 VAL 29 14.400 15.863 -3.150
215 HG22 VAL 29 1HG2 VAL 29 12.969 16.752 -2.634
216 HG23 VAL 29 2HG2 VAL 29 14.275 16.441 -1.490
217 H GLN 30 H GLN 30 16.836 17.794 -4.834
218 HA GLN 30 HA GLN 30 16.059 15.509 -6.531
219 HB2 GLN 30 1HB GLN 30 18.561 17.197 -6.760
220 HB3 GLN 30 2HB GLN 30 18.272 15.727 -7.676
221 HG2 GLN 30 1HG GLN 30 16.283 16.784 -8.684
222 HG3 GLN 30 2HG GLN 30 16.666 18.271 -7.824
223 HE21 GLN 30 2HE2 GLN 30 19.606 17.865 -8.261
224 HE22 GLN 30 1HE2 GLN 30 19.853 18.250 -9.912
225 H VAL 31 H VAL 31 16.766 13.534 -5.963
226 HA VAL 31 HA VAL 31 17.985 13.413 -3.394
227 HB VAL 31 HB VAL 31 16.280 11.679 -4.224
228 HG11 VAL 31 1HG1 VAL 31 16.981 11.371 -6.398
229 HG12 VAL 31 2HG1 VAL 31 17.009 9.836 -5.518
230 HG13 VAL 31 3HG1 VAL 31 18.512 10.710 -5.837
231 HG21 VAL 31 3HG2 VAL 31 18.905 10.582 -3.237
232 HG22 VAL 31 1HG2 VAL 31 17.347 9.759 -3.165
233 HG23 VAL 31 2HG2 VAL 31 17.609 11.232 -2.228
234 H THR 32 H THR 32 19.981 13.158 -2.859
235 HA THR 32 HA THR 32 21.888 13.431 -5.038
236 HB THR 32 HB THR 32 22.315 14.108 -2.131
237 HG1 THR 32 HG1 THR 32 20.608 15.182 -3.963
238 HG21 THR 32 3HG2 THR 32 23.808 15.782 -3.103
239 HG22 THR 32 1HG2 THR 32 23.376 15.237 -4.718
240 HG23 THR 32 2HG2 THR 32 24.281 14.158 -3.637
241 H SER 33 H SER 33 21.334 11.745 -1.918
242 HA SER 33 HA SER 33 22.874 9.530 -2.846
243 HB2 SER 33 1HB SER 33 24.639 11.112 -2.011
244 HB3 SER 33 2HB SER 33 23.869 11.073 -0.425
245 HG SER 33 HG SER 33 25.720 9.584 -0.942
246 H TYR 34 H TYR 34 23.023 7.931 -0.923
247 HA TYR 34 HA TYR 34 20.868 8.128 0.969
248 HB2 TYR 34 1HB TYR 34 19.599 7.226 -0.879
249 HB3 TYR 34 2HB TYR 34 20.871 6.079 -1.265
250 HD1 TYR 34 HD2 TYR 34 18.899 6.940 1.813
251 HD2 TYR 34 HD1 TYR 34 20.257 3.846 -0.795
252 HE1 TYR 34 HE2 TYR 34 17.833 5.247 3.237
253 HE2 TYR 34 HE1 TYR 34 19.223 2.196 0.619
254 HH TYR 34 HH TYR 34 18.495 1.925 2.932
255 H ASP 35 H ASP 35 21.615 7.335 2.792
256 HA ASP 35 HA ASP 35 23.780 5.337 2.705
257 HB2 ASP 35 1HB ASP 35 24.088 7.269 4.276
258 HB3 ASP 35 2HB ASP 35 22.608 6.785 5.105
259 H ASP 36 H ASP 36 23.250 3.331 2.895
260 HA ASP 36 HA ASP 36 20.463 2.717 3.292
261 HB2 ASP 36 1HB ASP 36 20.955 0.499 2.519
262 HB3 ASP 36 2HB ASP 36 21.790 1.643 1.476
263 H ALA 37 H ALA 37 23.372 2.495 5.153
264 HA ALA 37 HA ALA 37 22.452 0.377 6.829
265 HB1 ALA 37 1HB ALA 37 24.386 0.824 8.199
266 HB2 ALA 37 2HB ALA 37 24.637 2.367 7.387
267 HB3 ALA 37 3HB ALA 37 24.854 0.857 6.498
268 H SER 38 H SER 38 22.707 3.906 7.234
269 HA SER 38 HA SER 38 21.213 3.639 9.725
270 HB2 SER 38 1HB SER 38 22.419 6.090 8.433
271 HB3 SER 38 2HB SER 38 21.832 5.948 10.092
272 HG SER 38 HG SER 38 24.216 5.299 9.060
273 H HIS 39 H HIS 39 20.543 3.894 6.545
274 HA HIS 39 HA HIS 39 18.729 4.311 5.287
275 HB2 HIS 39 1HB HIS 39 17.684 2.860 7.037
276 HB3 HIS 39 2HB HIS 39 17.234 4.301 7.926
277 HD1 HIS 39 HD1 HIS 39 14.729 4.297 7.762
278 HD2 HIS 39 HD2 HIS 39 16.547 3.488 4.121
279 HE1 HIS 39 HE1 HIS 39 12.868 4.084 6.084
280 H LEU 40 H LEU 40 19.968 6.402 5.099
281 HA LEU 40 HA LEU 40 18.118 8.628 5.638
282 HB2 LEU 40 1HB LEU 40 21.063 8.579 6.137
283 HB3 LEU 40 2HB LEU 40 20.361 10.057 5.536
284 HG LEU 40 HG LEU 40 20.588 10.273 7.866
285 HD11 LEU 40 1HD1 LEU 40 18.315 10.632 8.642
286 HD12 LEU 40 2HD1 LEU 40 17.704 9.714 7.271
287 HD13 LEU 40 3HD1 LEU 40 18.569 11.223 7.000
288 HD21 LEU 40 3HD2 LEU 40 19.088 7.681 8.190
289 HD22 LEU 40 1HD2 LEU 40 19.592 8.746 9.504
290 HD23 LEU 40 2HD2 LEU 40 20.803 7.940 8.506
291 H TYR 41 H TYR 41 17.482 9.688 3.905
292 HA TYR 41 HA TYR 41 18.977 9.325 1.436
293 HB2 TYR 41 1HB TYR 41 16.135 10.023 2.076
294 HB3 TYR 41 2HB TYR 41 16.832 10.606 0.577
295 HD1 TYR 41 HD1 TYR 41 17.630 8.985 -1.101
296 HD2 TYR 41 HD2 TYR 41 15.420 7.735 2.311
297 HE1 TYR 41 HE1 TYR 41 17.102 6.874 -2.228
298 HE2 TYR 41 HE2 TYR 41 14.897 5.596 1.165
299 HH TYR 41 HH TYR 41 14.746 4.755 -1.128
300 H THR 42 H THR 42 20.301 10.899 0.895
301 HA THR 42 HA THR 42 19.931 13.505 2.140
302 HB THR 42 HB THR 42 22.227 12.466 0.454
303 HG1 THR 42 HG1 THR 42 21.489 11.714 2.807
304 HG21 THR 42 3HG2 THR 42 22.073 14.936 0.589
305 HG22 THR 42 1HG2 THR 42 23.480 14.334 1.468
306 HG23 THR 42 2HG2 THR 42 22.037 14.830 2.349
307 H VAL 43 H VAL 43 19.171 15.148 0.974
308 HA VAL 43 HA VAL 43 18.961 14.845 -1.937
309 HB VAL 43 HB VAL 43 16.786 16.019 -1.849
310 HG11 VAL 43 1HG1 VAL 43 16.855 13.521 -0.166
311 HG12 VAL 43 2HG1 VAL 43 16.708 13.604 -1.923
312 HG13 VAL 43 3HG1 VAL 43 15.410 14.208 -0.901
313 HG21 VAL 43 3HG2 VAL 43 15.591 16.301 0.294
314 HG22 VAL 43 1HG2 VAL 43 17.071 17.260 0.232
315 HG23 VAL 43 2HG2 VAL 43 17.031 15.759 1.155
316 H LYS 44 H LYS 44 18.939 16.853 -3.044
317 HA LYS 44 HA LYS 44 20.175 19.035 -1.536
318 HB2 LYS 44 1HB LYS 44 21.464 18.105 -3.421
319 HB3 LYS 44 2HB LYS 44 20.143 18.498 -4.511
320 HG2 LYS 44 1HG LYS 44 20.449 20.903 -3.891
321 HG3 LYS 44 2HG LYS 44 21.888 20.428 -2.989
322 HD2 LYS 44 1HD LYS 44 21.441 19.965 -5.932
323 HD3 LYS 44 2HD LYS 44 22.407 21.272 -5.253
324 HE2 LYS 44 1HE LYS 44 23.946 19.652 -4.288
325 HE3 LYS 44 2HE LYS 44 22.956 18.321 -4.884
326 HZ1 LYS 44 3HZ LYS 44 24.857 18.738 -6.315
327 HZ2 LYS 44 1HZ LYS 44 24.341 20.324 -6.583
328 HZ3 LYS 44 2HZ LYS 44 23.410 19.020 -7.126
329 H TYR 45 H TYR 45 19.163 20.869 -1.331
330 HA TYR 45 HA TYR 45 16.580 21.318 -2.573
331 HB2 TYR 45 1HB TYR 45 17.989 22.415 -0.203
332 HB3 TYR 45 2HB TYR 45 16.857 23.476 -1.024
333 HD1 TYR 45 HD1 TYR 45 17.196 20.328 0.858
334 HD2 TYR 45 HD2 TYR 45 14.535 23.083 -0.973
335 HE1 TYR 45 HE1 TYR 45 15.297 19.235 1.972
336 HE2 TYR 45 HE2 TYR 45 12.641 22.019 0.111
337 HH TYR 45 HH TYR 45 12.986 19.781 2.640
338 H LYS 46 H LYS 46 16.103 23.474 -3.326
339 HA LYS 46 HA LYS 46 17.764 24.135 -5.455
340 HB2 LYS 46 1HB LYS 46 15.287 24.415 -5.344
341 HB3 LYS 46 2HB LYS 46 15.538 25.808 -4.301
342 HG2 LYS 46 1HG LYS 46 16.758 26.921 -6.003
343 HG3 LYS 46 2HG LYS 46 16.620 25.502 -7.055
344 HD2 LYS 46 1HD LYS 46 14.138 25.770 -6.955
345 HD3 LYS 46 2HD LYS 46 14.386 27.294 -6.096
346 HE2 LYS 46 1HE LYS 46 14.034 27.694 -8.478
347 HE3 LYS 46 2HE LYS 46 15.661 28.156 -7.989
348 HZ1 LYS 46 3HZ LYS 46 15.629 26.910 -10.089
349 HZ2 LYS 46 1HZ LYS 46 14.963 25.581 -9.298
350 HZ3 LYS 46 2HZ LYS 46 16.518 26.107 -8.918
351 H ASP 47 H ASP 47 17.663 25.309 -2.226
352 HA ASP 47 HA ASP 47 19.192 27.709 -2.730
353 HB2 ASP 47 1HB ASP 47 18.576 26.295 -0.126
354 HB3 ASP 47 2HB ASP 47 19.503 27.783 -0.225
355 H GLY 48 H GLY 48 20.065 24.584 -2.953
356 HA2 GLY 48 1HA GLY 48 22.200 23.799 -3.386
357 HA3 GLY 48 2HA GLY 48 22.871 25.258 -2.666
358 H THR 49 H THR 49 20.654 24.312 -0.592
359 HA THR 49 HA THR 49 22.521 23.243 1.297
360 HB THR 49 HB THR 49 19.525 23.464 1.513
361 HG1 THR 49 HG1 THR 49 21.447 25.350 1.219
362 HG21 THR 49 3HG2 THR 49 20.009 23.781 3.906
363 HG22 THR 49 1HG2 THR 49 21.737 23.641 3.577
364 HG23 THR 49 2HG2 THR 49 20.675 22.252 3.333
365 H GLU 50 H GLU 50 22.878 21.035 1.615
366 HA GLU 50 HA GLU 50 20.954 19.208 0.428
367 HB2 GLU 50 1HB GLU 50 23.535 18.598 1.897
368 HB3 GLU 50 2HB GLU 50 22.463 17.391 1.226
369 HG2 GLU 50 1HG GLU 50 24.207 17.533 -0.303
370 HG3 GLU 50 2HG GLU 50 22.934 18.502 -1.030
371 H LEU 51 H LEU 51 19.934 17.658 1.653
372 HA LEU 51 HA LEU 51 19.823 18.158 4.539
373 HB2 LEU 51 1HB LEU 51 17.990 19.377 3.441
374 HB3 LEU 51 2HB LEU 51 17.471 17.892 2.666
375 HG LEU 51 HG LEU 51 17.052 16.961 4.959
376 HD11 LEU 51 1HD1 LEU 51 17.460 19.821 5.775
377 HD12 LEU 51 2HD1 LEU 51 18.470 18.447 6.220
378 HD13 LEU 51 3HD1 LEU 51 16.803 18.540 6.800
379 HD21 LEU 51 3HD2 LEU 51 14.937 18.099 5.214
380 HD22 LEU 51 1HD2 LEU 51 15.274 17.796 3.517
381 HD23 LEU 51 2HD2 LEU 51 15.491 19.420 4.183
382 H ALA 52 H ALA 52 19.428 16.220 5.695
383 HA ALA 52 HA ALA 52 19.155 13.847 4.017
384 HB1 ALA 52 1HB ALA 52 20.287 14.122 6.812
385 HB2 ALA 52 2HB ALA 52 21.221 13.846 5.345
386 HB3 ALA 52 3HB ALA 52 20.109 12.607 5.927
387 H LEU 53 H LEU 53 17.393 12.702 4.322
388 HA LEU 53 HA LEU 53 15.803 13.131 6.670
389 HB2 LEU 53 1HB LEU 53 13.758 13.242 5.078
390 HB3 LEU 53 2HB LEU 53 14.679 14.690 5.408
391 HG LEU 53 HG LEU 53 15.831 14.423 3.219
392 HD11 LEU 53 1HD1 LEU 53 13.913 12.197 2.838
393 HD12 LEU 53 2HD1 LEU 53 15.694 12.090 2.949
394 HD13 LEU 53 3HD1 LEU 53 14.912 12.946 1.595
395 HD21 LEU 53 3HD2 LEU 53 12.853 14.426 3.122
396 HD22 LEU 53 1HD2 LEU 53 13.908 14.948 1.807
397 HD23 LEU 53 2HD2 LEU 53 13.893 15.845 3.344
398 H LYS 54 H LYS 54 13.792 11.563 6.465
399 HA LYS 54 HA LYS 54 15.063 8.985 6.073
400 HB2 LYS 54 1HB LYS 54 12.359 9.665 7.266
401 HB3 LYS 54 2HB LYS 54 13.079 8.061 7.224
402 HG2 LYS 54 1HG LYS 54 14.173 10.456 8.700
403 HG3 LYS 54 2HG LYS 54 13.332 9.090 9.428
404 HD2 LYS 54 1HD LYS 54 15.103 7.589 8.766
405 HD3 LYS 54 2HD LYS 54 15.910 8.872 7.868
406 HE2 LYS 54 1HE LYS 54 17.061 8.587 9.943
407 HE3 LYS 54 2HE LYS 54 16.183 10.106 10.004
408 HZ1 LYS 54 3HZ LYS 54 14.473 9.020 11.345
409 HZ2 LYS 54 1HZ LYS 54 15.985 8.877 12.055
410 HZ3 LYS 54 2HZ LYS 54 15.328 7.561 11.280
411 H GLU 55 H GLU 55 13.766 7.262 5.017
412 HA GLU 55 HA GLU 55 13.081 7.893 2.369
413 HB2 GLU 55 1HB GLU 55 13.711 5.663 2.869
414 HB3 GLU 55 2HB GLU 55 12.556 5.539 4.165
415 HG2 GLU 55 1HG GLU 55 11.726 5.667 1.269
416 HG3 GLU 55 2HG GLU 55 12.124 4.155 2.080
417 H SER 56 H SER 56 11.181 7.780 5.256
418 HA SER 56 HA SER 56 8.663 7.814 3.945
419 HB2 SER 56 1HB SER 56 9.378 8.360 6.821
420 HB3 SER 56 2HB SER 56 7.781 7.924 6.199
421 HG SER 56 HG SER 56 9.468 6.084 5.293
422 H ASP 57 H ASP 57 11.000 10.163 4.431
423 HA ASP 57 HA ASP 57 9.106 12.333 4.626
424 HB2 ASP 57 1HB ASP 57 12.114 12.298 4.358
425 HB3 ASP 57 2HB ASP 57 11.167 13.777 4.322
426 H ILE 58 H ILE 58 10.572 10.370 2.208
427 HA ILE 58 HA ILE 58 10.214 12.532 0.269
428 HB ILE 58 HB ILE 58 11.610 9.871 -0.107
429 HG12 ILE 58 1HG1 ILE 58 12.686 12.679 0.113
430 HG13 ILE 58 2HG1 ILE 58 12.854 11.393 1.304
431 HG21 ILE 58 1HG2 ILE 58 12.326 10.788 -2.268
432 HG22 ILE 58 2HG2 ILE 58 11.366 12.234 -1.953
433 HG23 ILE 58 3HG2 ILE 58 10.562 10.674 -2.174
434 HD11 ILE 58 3HD1 ILE 58 13.994 11.338 -1.477
435 HD12 ILE 58 1HD1 ILE 58 14.216 10.106 -0.229
436 HD13 ILE 58 2HD1 ILE 58 14.881 11.732 -0.008
437 H ARG 59 H ARG 59 8.716 12.528 -1.041
438 HA ARG 59 HA ARG 59 7.345 10.080 -1.853
439 HB2 ARG 59 1HB ARG 59 6.014 12.534 -0.734
440 HB3 ARG 59 2HB ARG 59 5.159 11.538 -1.900
441 HG2 ARG 59 1HG ARG 59 5.336 9.617 -0.425
442 HG3 ARG 59 2HG ARG 59 6.293 10.557 0.716
443 HD2 ARG 59 1HD ARG 59 4.410 11.987 1.196
444 HD3 ARG 59 2HD ARG 59 3.458 11.222 -0.078
445 HE ARG 59 HE ARG 59 2.975 9.503 1.319
446 HH11 ARG 59 1HH1 ARG 59 5.583 11.375 2.829
447 HH12 ARG 59 2HH1 ARG 59 5.616 10.446 4.244
448 HH21 ARG 59 1HH2 ARG 59 3.004 8.269 3.301
449 HH22 ARG 59 2HH2 ARG 59 4.145 8.609 4.503
450 H LEU 60 H LEU 60 6.377 10.275 -4.045
451 HA LEU 60 HA LEU 60 7.626 12.403 -5.542
452 HB2 LEU 60 1HB LEU 60 5.594 10.344 -6.428
453 HB3 LEU 60 2HB LEU 60 6.491 11.413 -7.482
454 HG LEU 60 HG LEU 60 7.591 9.136 -5.860
455 HD11 LEU 60 1HD1 LEU 60 8.138 8.235 -8.080
456 HD12 LEU 60 2HD1 LEU 60 7.230 9.560 -8.810
457 HD13 LEU 60 3HD1 LEU 60 6.407 8.382 -7.784
458 HD21 LEU 60 3HD2 LEU 60 9.739 9.641 -6.974
459 HD22 LEU 60 1HD2 LEU 60 9.217 10.940 -5.898
460 HD23 LEU 60 2HD2 LEU 60 9.021 11.109 -7.640
461 H GLN 61 H GLN 61 5.956 13.558 -7.087
462 HA GLN 61 HA GLN 61 4.439 15.169 -5.373
463 HB2 GLN 61 1HB GLN 61 3.561 16.275 -7.361
464 HB3 GLN 61 2HB GLN 61 5.295 16.037 -7.468
465 HG2 GLN 61 1HG GLN 61 4.968 14.161 -8.969
466 HG3 GLN 61 2HG GLN 61 3.219 14.325 -8.811
467 HE21 GLN 61 2HE2 GLN 61 2.215 16.081 -9.719
468 HE22 GLN 61 1HE2 GLN 61 2.931 17.018 -10.969
469 H SER 62 H SER 62 3.491 12.326 -7.199
470 HA SER 62 HA SER 62 0.770 12.719 -6.190
471 HB2 SER 62 1HB SER 62 1.639 11.094 -8.586
472 HB3 SER 62 2HB SER 62 -0.009 11.491 -8.104
473 HG SER 62 HG SER 62 1.008 13.781 -8.227
474 H SER 63 H SER 63 3.215 11.334 -4.903
475 HA SER 63 HA SER 63 2.442 8.562 -4.841
476 HB2 SER 63 1HB SER 63 4.320 10.113 -3.073
477 HB3 SER 63 2HB SER 63 4.079 8.372 -2.970
478 HG SER 63 HG SER 63 4.599 8.500 -5.330
479 H PHE 64 H PHE 64 1.178 7.524 -3.481
480 HA PHE 64 HA PHE 64 0.363 8.664 -0.972
481 HB2 PHE 64 1HB PHE 64 -2.063 8.401 -1.472
482 HB3 PHE 64 2HB PHE 64 -1.318 9.645 -2.463
483 HD1 PHE 64 HD2 PHE 64 -2.730 6.239 -2.472
484 HD2 PHE 64 HD1 PHE 64 -1.215 9.420 -4.847
485 HE1 PHE 64 HE2 PHE 64 -3.598 5.139 -4.486
486 HE2 PHE 64 HE1 PHE 64 -2.087 8.327 -6.865
487 HZ PHE 64 HZ PHE 64 -3.277 6.181 -6.688
488 H LYS 65 H LYS 65 -0.957 7.008 0.220
489 HA LYS 65 HA LYS 65 -0.533 4.315 -0.807
490 HB2 LYS 65 1HB LYS 65 0.972 4.777 1.132
491 HB3 LYS 65 2HB LYS 65 -0.432 5.194 2.102
492 HG2 LYS 65 1HG LYS 65 -1.269 2.905 1.873
493 HG3 LYS 65 2HG LYS 65 0.152 2.482 0.919
494 HD2 LYS 65 1HD LYS 65 1.593 3.025 2.824
495 HD3 LYS 65 2HD LYS 65 0.171 3.458 3.775
496 HE2 LYS 65 1HE LYS 65 -0.660 1.158 3.565
497 HE3 LYS 65 2HE LYS 65 0.758 0.739 2.610
498 HZ1 LYS 65 3HZ LYS 65 0.796 1.652 5.437
499 HZ2 LYS 65 1HZ LYS 65 2.140 1.259 4.502
500 HZ3 LYS 65 2HZ LYS 65 1.028 0.066 4.909
501 H GLN 66 H GLN 66 -2.466 4.403 -1.735
502 HA GLN 66 HA GLN 66 -4.637 4.186 -2.102
503 HB2 GLN 66 1HB GLN 66 -4.152 2.415 -0.169
504 HB3 GLN 66 2HB GLN 66 -5.221 3.470 0.742
505 HG2 GLN 66 1HG GLN 66 -6.557 1.745 -0.196
506 HG3 GLN 66 2HG GLN 66 -6.896 3.222 -1.102
507 HE21 GLN 66 2HE2 GLN 66 -7.582 2.088 -2.933
508 HE22 GLN 66 1HE2 GLN 66 -6.491 1.224 -3.951
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -0.856 4.526 -5.832
2 HA2 GLY 1 2HA GLY 1 -0.010 2.623 -4.630
3 HA3 GLY 1 1HA GLY 1 0.662 2.696 -6.260
4 H ALA 2 H ALA 2 1.662 1.571 -3.680
5 HA ALA 2 HA ALA 2 4.316 2.827 -3.785
6 HB1 ALA 2 1HB ALA 2 2.853 2.034 -1.264
7 HB2 ALA 2 2HB ALA 2 3.158 3.688 -1.795
8 HB3 ALA 2 3HB ALA 2 4.507 2.642 -1.345
9 H MET 3 H MET 3 2.952 0.404 -4.827
10 HA MET 3 HA MET 3 3.966 -1.852 -3.424
11 HB2 MET 3 1HB MET 3 3.301 -3.168 -5.395
12 HB3 MET 3 2HB MET 3 2.012 -2.131 -4.816
13 HG2 MET 3 1HG MET 3 2.524 -0.539 -6.627
14 HG3 MET 3 2HG MET 3 3.775 -1.638 -7.210
15 HE1 MET 3 3HE MET 3 3.294 -4.024 -8.262
16 HE2 MET 3 1HE MET 3 1.691 -4.747 -8.359
17 HE3 MET 3 2HE MET 3 2.451 -4.510 -6.791
18 H GLY 4 H GLY 4 5.260 -3.531 -4.932
19 HA2 GLY 4 1HA GLY 4 7.329 -4.045 -5.786
20 HA3 GLY 4 2HA GLY 4 7.500 -2.353 -6.276
21 H MET 5 H MET 5 8.810 -1.161 -5.211
22 HA MET 5 HA MET 5 10.081 -0.234 -3.609
23 HB2 MET 5 1HB MET 5 7.991 -0.207 -2.287
24 HB3 MET 5 2HB MET 5 8.381 -1.793 -1.659
25 HG2 MET 5 1HG MET 5 10.424 -0.848 -0.645
26 HG3 MET 5 2HG MET 5 9.917 0.749 -1.189
27 HE1 MET 5 3HE MET 5 6.692 0.507 -0.728
28 HE2 MET 5 1HE MET 5 7.625 1.945 -0.315
29 HE3 MET 5 2HE MET 5 6.563 1.206 0.881
30 HA PRO 6 HA PRO 6 12.984 -3.616 -2.841
31 HB2 PRO 6 1HB PRO 6 15.052 -2.119 -4.051
32 HB3 PRO 6 2HB PRO 6 14.160 -3.439 -4.804
33 HG2 PRO 6 1HG PRO 6 14.098 -0.724 -5.542
34 HG3 PRO 6 2HG PRO 6 13.006 -1.996 -6.118
35 HD2 PRO 6 1HD PRO 6 12.594 0.075 -4.025
36 HD3 PRO 6 2HD PRO 6 11.416 -0.698 -5.110
37 H ASN 7 H ASN 7 15.625 -2.727 -2.253
38 HA ASN 7 HA ASN 7 15.087 -1.176 0.148
39 HB2 ASN 7 1HB ASN 7 17.476 -2.810 -0.693
40 HB3 ASN 7 2HB ASN 7 17.584 -1.672 0.648
41 HD21 ASN 7 2HD2 ASN 7 16.310 -4.704 -0.428
42 HD22 ASN 7 1HD2 ASN 7 15.651 -5.174 1.106
43 H ARG 8 H ARG 8 15.126 -0.096 -2.554
44 HA ARG 8 HA ARG 8 16.249 2.380 -1.829
45 HB2 ARG 8 1HB ARG 8 18.201 1.409 -2.984
46 HB3 ARG 8 2HB ARG 8 17.171 0.949 -4.344
47 HG2 ARG 8 1HG ARG 8 16.720 3.261 -4.780
48 HG3 ARG 8 2HG ARG 8 17.760 3.742 -3.441
49 HD2 ARG 8 1HD ARG 8 18.707 2.167 -5.855
50 HD3 ARG 8 2HD ARG 8 18.845 3.913 -5.716
51 HE ARG 8 HE ARG 8 20.140 2.108 -3.783
52 HH11 ARG 8 1HH1 ARG 8 20.415 4.644 -6.252
53 HH12 ARG 8 2HH1 ARG 8 21.969 5.132 -5.861
54 HH21 ARG 8 1HH2 ARG 8 22.378 2.697 -3.252
55 HH22 ARG 8 2HH2 ARG 8 23.154 3.939 -4.124
56 H LYS 9 H LYS 9 14.071 2.787 -1.724
57 HA LYS 9 HA LYS 9 12.277 2.314 -3.874
58 HB2 LYS 9 1HB LYS 9 11.372 2.500 -1.647
59 HB3 LYS 9 2HB LYS 9 12.070 4.094 -1.439
60 HG2 LYS 9 1HG LYS 9 10.526 5.044 -3.017
61 HG3 LYS 9 2HG LYS 9 9.913 3.448 -3.440
62 HD2 LYS 9 1HD LYS 9 8.932 3.171 -1.291
63 HD3 LYS 9 2HD LYS 9 9.747 4.602 -0.663
64 HE2 LYS 9 1HE LYS 9 7.335 4.981 -1.168
65 HE3 LYS 9 2HE LYS 9 8.416 6.048 -2.058
66 HZ1 LYS 9 3HZ LYS 9 6.627 5.171 -3.429
67 HZ2 LYS 9 1HZ LYS 9 7.143 3.597 -3.170
68 HZ3 LYS 9 2HZ LYS 9 8.104 4.693 -4.020
69 H TYR 10 H TYR 10 14.439 4.882 -3.108
70 HA TYR 10 HA TYR 10 13.492 6.266 -5.511
71 HB2 TYR 10 1HB TYR 10 14.719 7.546 -3.049
72 HB3 TYR 10 2HB TYR 10 14.221 8.390 -4.510
73 HD1 TYR 10 HD1 TYR 10 11.811 8.457 -5.112
74 HD2 TYR 10 HD2 TYR 10 13.159 6.990 -1.363
75 HE1 TYR 10 HE1 TYR 10 9.548 8.694 -4.213
76 HE2 TYR 10 HE2 TYR 10 10.909 7.214 -0.448
77 HH TYR 10 HH TYR 10 8.796 8.535 -0.932
78 H ALA 11 H ALA 11 14.891 6.003 -7.065
79 HA ALA 11 HA ALA 11 17.594 5.231 -6.621
80 HB1 ALA 11 1HB ALA 11 17.772 5.547 -9.087
81 HB2 ALA 11 2HB ALA 11 16.158 6.249 -9.079
82 HB3 ALA 11 3HB ALA 11 16.386 4.560 -8.631
83 H ASP 12 H ASP 12 19.477 6.604 -7.085
84 HA ASP 12 HA ASP 12 18.919 9.227 -6.114
85 HB2 ASP 12 1HB ASP 12 21.342 9.623 -5.920
86 HB3 ASP 12 2HB ASP 12 20.881 8.115 -5.159
87 H GLY 13 H GLY 13 19.447 11.204 -7.040
88 HA2 GLY 13 1HA GLY 13 20.036 12.570 -8.834
89 HA3 GLY 13 2HA GLY 13 19.907 11.181 -9.914
90 H GLU 14 H GLU 14 17.346 10.776 -8.017
91 HA GLU 14 HA GLU 14 15.578 11.721 -10.062
92 HB2 GLU 14 1HB GLU 14 15.361 9.488 -9.043
93 HB3 GLU 14 2HB GLU 14 15.015 10.251 -7.498
94 HG2 GLU 14 1HG GLU 14 12.983 9.469 -8.685
95 HG3 GLU 14 2HG GLU 14 12.979 11.212 -8.400
96 H VAL 15 H VAL 15 13.979 13.282 -9.801
97 HA VAL 15 HA VAL 15 14.365 14.923 -7.430
98 HB VAL 15 HB VAL 15 14.503 16.205 -9.502
99 HG11 VAL 15 1HG1 VAL 15 12.633 16.418 -11.059
100 HG12 VAL 15 2HG1 VAL 15 11.771 15.161 -10.163
101 HG13 VAL 15 3HG1 VAL 15 13.287 14.781 -10.982
102 HG21 VAL 15 3HG2 VAL 15 12.751 17.896 -9.146
103 HG22 VAL 15 1HG2 VAL 15 13.483 17.362 -7.632
104 HG23 VAL 15 2HG2 VAL 15 11.894 16.763 -8.100
105 H VAL 16 H VAL 16 12.924 14.977 -5.894
106 HA VAL 16 HA VAL 16 10.344 13.661 -6.234
107 HB VAL 16 HB VAL 16 10.693 12.485 -4.021
108 HG11 VAL 16 1HG1 VAL 16 10.863 11.250 -6.120
109 HG12 VAL 16 2HG1 VAL 16 12.023 10.642 -4.939
110 HG13 VAL 16 3HG1 VAL 16 12.567 11.689 -6.249
111 HG21 VAL 16 3HG2 VAL 16 12.554 13.818 -3.183
112 HG22 VAL 16 1HG2 VAL 16 13.580 13.242 -4.496
113 HG23 VAL 16 2HG2 VAL 16 13.010 12.115 -3.267
114 H MET 17 H MET 17 9.232 13.874 -3.853
115 HA MET 17 HA MET 17 9.765 16.616 -3.025
116 HB2 MET 17 1HB MET 17 7.153 15.085 -2.905
117 HB3 MET 17 2HB MET 17 7.412 16.686 -2.220
118 HG2 MET 17 1HG MET 17 7.925 17.543 -4.477
119 HG3 MET 17 2HG MET 17 7.592 15.950 -5.136
120 HE1 MET 17 3HE MET 17 4.459 18.760 -3.237
121 HE2 MET 17 1HE MET 17 6.172 19.130 -3.429
122 HE3 MET 17 2HE MET 17 5.653 17.909 -2.263
123 H GLY 18 H GLY 18 10.266 16.909 -0.967
124 HA2 GLY 18 1HA GLY 18 10.255 14.515 0.800
125 HA3 GLY 18 2HA GLY 18 11.591 15.574 0.647
126 H ARG 19 H ARG 19 9.691 14.977 2.860
127 HA ARG 19 HA ARG 19 8.352 17.442 3.450
128 HB2 ARG 19 1HB ARG 19 7.503 15.372 4.360
129 HB3 ARG 19 2HB ARG 19 9.051 15.016 5.106
130 HG2 ARG 19 1HG ARG 19 8.720 17.134 6.460
131 HG3 ARG 19 2HG ARG 19 7.058 17.116 5.873
132 HD2 ARG 19 1HD ARG 19 6.631 15.026 6.887
133 HD3 ARG 19 2HD ARG 19 8.341 14.772 7.230
134 HE ARG 19 HE ARG 19 7.004 17.056 8.452
135 HH11 ARG 19 1HH1 ARG 19 8.668 13.923 8.830
136 HH12 ARG 19 2HH1 ARG 19 8.573 13.967 10.533
137 HH21 ARG 19 1HH2 ARG 19 6.965 17.103 10.804
138 HH22 ARG 19 2HH2 ARG 19 7.635 15.809 11.665
139 H TRP 20 H TRP 20 9.118 19.095 4.715
140 HA TRP 20 HA TRP 20 11.930 19.117 5.279
141 HB2 TRP 20 1HB TRP 20 10.632 21.197 4.583
142 HB3 TRP 20 2HB TRP 20 9.867 21.163 6.173
143 HD1 TRP 20 HD1 TRP 20 11.542 21.574 8.321
144 HE1 TRP 20 HE1 TRP 20 13.743 22.877 8.490
145 HE3 TRP 20 HE3 TRP 20 12.632 21.958 3.355
146 HZ2 TRP 20 HZ2 TRP 20 15.690 23.943 6.742
147 HZ3 TRP 20 HZ3 TRP 20 14.678 23.137 2.682
148 HH2 TRP 20 HH2 TRP 20 16.165 24.108 4.301
149 HA PRO 21 HA PRO 21 11.211 17.081 9.187
150 HB2 PRO 21 1HB PRO 21 13.752 17.355 10.165
151 HB3 PRO 21 2HB PRO 21 13.286 16.108 9.002
152 HG2 PRO 21 1HG PRO 21 14.624 18.740 8.520
153 HG3 PRO 21 2HG PRO 21 14.958 17.163 7.784
154 HD2 PRO 21 1HD PRO 21 13.556 19.080 6.528
155 HD3 PRO 21 2HD PRO 21 13.202 17.353 6.300
156 H GLY 22 H GLY 22 9.868 18.553 10.079
157 HA2 GLY 22 1HA GLY 22 10.347 19.687 12.434
158 HA3 GLY 22 2HA GLY 22 10.864 20.964 11.329
159 H SER 23 H SER 23 9.073 20.601 9.271
160 HA SER 23 HA SER 23 6.562 21.315 10.566
161 HB2 SER 23 1HB SER 23 6.181 22.600 8.412
162 HB3 SER 23 2HB SER 23 7.536 23.192 9.375
163 HG SER 23 HG SER 23 8.553 22.984 7.554
164 H VAL 24 H VAL 24 4.808 20.999 8.518
165 HA VAL 24 HA VAL 24 5.126 18.177 7.772
166 HB VAL 24 HB VAL 24 3.095 18.936 9.108
167 HG11 VAL 24 1HG1 VAL 24 1.235 20.008 7.943
168 HG12 VAL 24 2HG1 VAL 24 2.262 20.227 6.531
169 HG13 VAL 24 3HG1 VAL 24 2.654 21.053 8.034
170 HG21 VAL 24 3HG2 VAL 24 3.053 16.803 7.950
171 HG22 VAL 24 1HG2 VAL 24 2.560 17.597 6.454
172 HG23 VAL 24 2HG2 VAL 24 1.469 17.569 7.837
173 H LEU 25 H LEU 25 6.010 20.902 6.549
174 HA LEU 25 HA LEU 25 4.616 21.075 4.072
175 HB2 LEU 25 1HB LEU 25 7.119 22.361 4.999
176 HB3 LEU 25 2HB LEU 25 6.335 22.670 3.465
177 HG LEU 25 HG LEU 25 5.440 23.424 6.221
178 HD11 LEU 25 1HD1 LEU 25 5.634 24.654 3.591
179 HD12 LEU 25 2HD1 LEU 25 6.813 24.887 4.907
180 HD13 LEU 25 3HD1 LEU 25 5.151 25.557 5.037
181 HD21 LEU 25 3HD2 LEU 25 3.262 24.084 5.277
182 HD22 LEU 25 1HD2 LEU 25 3.476 22.332 5.224
183 HD23 LEU 25 2HD2 LEU 25 3.685 23.296 3.759
184 H TYR 26 H TYR 26 5.254 20.553 2.103
185 HA TYR 26 HA TYR 26 7.527 18.720 1.918
186 HB2 TYR 26 1HB TYR 26 4.837 18.629 0.629
187 HB3 TYR 26 2HB TYR 26 6.223 17.991 -0.249
188 HD1 TYR 26 HD1 TYR 26 4.545 17.721 3.089
189 HD2 TYR 26 HD2 TYR 26 6.835 15.806 0.060
190 HE1 TYR 26 HE1 TYR 26 4.359 15.588 4.300
191 HE2 TYR 26 HE2 TYR 26 6.654 13.678 1.252
192 HH TYR 26 HH TYR 26 4.482 13.234 3.843
193 H TYR 27 H TYR 27 9.030 19.078 0.520
194 HA TYR 27 HA TYR 27 8.734 21.375 -1.276
195 HB2 TYR 27 1HB TYR 27 11.032 20.532 0.458
196 HB3 TYR 27 2HB TYR 27 11.233 21.639 -0.898
197 HD1 TYR 27 HD2 TYR 27 9.529 21.198 2.377
198 HD2 TYR 27 HD1 TYR 27 10.707 23.893 -0.681
199 HE1 TYR 27 HE2 TYR 27 8.898 23.096 3.810
200 HE2 TYR 27 HE1 TYR 27 10.087 25.781 0.723
201 HH TYR 27 HH TYR 27 8.813 26.317 2.535
202 H GLU 28 H GLU 28 9.978 21.228 -3.161
203 HA GLU 28 HA GLU 28 10.274 18.517 -4.082
204 HB2 GLU 28 1HB GLU 28 9.209 20.143 -5.552
205 HB3 GLU 28 2HB GLU 28 10.628 21.171 -5.494
206 HG2 GLU 28 1HG GLU 28 11.919 19.482 -6.651
207 HG3 GLU 28 2HG GLU 28 10.520 18.408 -6.666
208 H VAL 29 H VAL 29 12.160 17.509 -4.170
209 HA VAL 29 HA VAL 29 14.647 19.016 -3.806
210 HB VAL 29 HB VAL 29 15.423 17.350 -2.163
211 HG11 VAL 29 1HG1 VAL 29 12.833 18.633 -1.354
212 HG12 VAL 29 2HG1 VAL 29 14.432 19.378 -1.305
213 HG13 VAL 29 3HG1 VAL 29 14.059 18.012 -0.253
214 HG21 VAL 29 3HG2 VAL 29 13.847 15.781 -1.107
215 HG22 VAL 29 1HG2 VAL 29 14.066 15.443 -2.825
216 HG23 VAL 29 2HG2 VAL 29 12.609 16.264 -2.268
217 H GLN 30 H GLN 30 16.509 17.641 -4.389
218 HA GLN 30 HA GLN 30 15.641 15.419 -6.090
219 HB2 GLN 30 1HB GLN 30 16.580 17.374 -7.353
220 HB3 GLN 30 2HB GLN 30 18.091 17.151 -6.485
221 HG2 GLN 30 1HG GLN 30 18.359 14.948 -7.491
222 HG3 GLN 30 2HG GLN 30 16.814 15.128 -8.308
223 HE21 GLN 30 2HE2 GLN 30 17.745 14.915 -10.319
224 HE22 GLN 30 1HE2 GLN 30 18.665 16.194 -11.036
225 H VAL 31 H VAL 31 16.475 13.519 -5.619
226 HA VAL 31 HA VAL 31 18.024 13.292 -3.229
227 HB VAL 31 HB VAL 31 16.267 11.578 -3.830
228 HG11 VAL 31 1HG1 VAL 31 16.736 9.891 -5.457
229 HG12 VAL 31 2HG1 VAL 31 18.015 10.954 -6.082
230 HG13 VAL 31 3HG1 VAL 31 16.348 11.494 -6.069
231 HG21 VAL 31 3HG2 VAL 31 17.562 9.561 -3.309
232 HG22 VAL 31 1HG2 VAL 31 18.002 10.907 -2.252
233 HG23 VAL 31 2HG2 VAL 31 19.053 10.458 -3.593
234 H THR 32 H THR 32 20.158 13.022 -3.044
235 HA THR 32 HA THR 32 21.561 12.867 -5.593
236 HB THR 32 HB THR 32 21.641 15.156 -4.667
237 HG1 THR 32 HG1 THR 32 23.411 14.112 -5.846
238 HG21 THR 32 3HG2 THR 32 21.598 14.668 -2.269
239 HG22 THR 32 1HG2 THR 32 23.008 15.650 -2.668
240 HG23 THR 32 2HG2 THR 32 23.191 13.921 -2.379
241 H SER 33 H SER 33 21.425 11.766 -2.269
242 HA SER 33 HA SER 33 23.356 9.718 -2.992
243 HB2 SER 33 1HB SER 33 23.630 11.298 -0.402
244 HB3 SER 33 2HB SER 33 24.674 10.020 -0.982
245 HG SER 33 HG SER 33 25.189 11.336 -2.764
246 H TYR 34 H TYR 34 23.189 7.845 -1.545
247 HA TYR 34 HA TYR 34 20.889 7.857 0.237
248 HB2 TYR 34 1HB TYR 34 19.882 6.949 -1.746
249 HB3 TYR 34 2HB TYR 34 21.272 5.914 -2.054
250 HD1 TYR 34 HD2 TYR 34 18.822 6.515 0.714
251 HD2 TYR 34 HD1 TYR 34 21.000 3.655 -1.554
252 HE1 TYR 34 HE2 TYR 34 17.790 4.711 2.015
253 HE2 TYR 34 HE1 TYR 34 19.973 1.839 -0.251
254 HH TYR 34 HH TYR 34 17.284 2.300 1.697
255 H ASP 35 H ASP 35 21.453 7.068 2.124
256 HA ASP 35 HA ASP 35 23.754 5.274 2.251
257 HB2 ASP 35 1HB ASP 35 23.965 7.179 3.739
258 HB3 ASP 35 2HB ASP 35 22.362 6.874 4.404
259 H ASP 36 H ASP 36 23.388 3.209 2.487
260 HA ASP 36 HA ASP 36 20.692 2.260 2.877
261 HB2 ASP 36 1HB ASP 36 21.594 0.045 2.390
262 HB3 ASP 36 2HB ASP 36 22.154 1.204 1.194
263 H ALA 37 H ALA 37 23.445 2.796 4.803
264 HA ALA 37 HA ALA 37 23.018 0.751 6.717
265 HB1 ALA 37 1HB ALA 37 25.199 1.810 6.439
266 HB2 ALA 37 2HB ALA 37 24.619 1.983 8.098
267 HB3 ALA 37 3HB ALA 37 24.524 3.346 6.983
268 H SER 38 H SER 38 22.298 4.253 6.753
269 HA SER 38 HA SER 38 20.666 3.855 9.155
270 HB2 SER 38 1HB SER 38 21.108 6.398 7.629
271 HB3 SER 38 2HB SER 38 20.746 6.194 9.342
272 HG SER 38 HG SER 38 23.109 5.618 7.933
273 H HIS 39 H HIS 39 20.290 3.602 5.903
274 HA HIS 39 HA HIS 39 18.654 3.692 4.355
275 HB2 HIS 39 1HB HIS 39 17.555 2.370 6.418
276 HB3 HIS 39 2HB HIS 39 16.517 3.788 6.470
277 HD1 HIS 39 HD1 HIS 39 16.245 0.574 5.323
278 HD2 HIS 39 HD2 HIS 39 15.772 4.229 3.420
279 HE1 HIS 39 HE1 HIS 39 14.826 0.122 3.281
280 H LEU 40 H LEU 40 19.768 5.964 4.704
281 HA LEU 40 HA LEU 40 17.666 8.019 4.997
282 HB2 LEU 40 1HB LEU 40 20.378 7.864 6.063
283 HB3 LEU 40 2HB LEU 40 20.083 9.343 5.180
284 HG LEU 40 HG LEU 40 18.216 9.878 6.678
285 HD11 LEU 40 1HD1 LEU 40 18.985 7.373 8.157
286 HD12 LEU 40 2HD1 LEU 40 17.493 7.631 7.254
287 HD13 LEU 40 3HD1 LEU 40 17.823 8.583 8.702
288 HD21 LEU 40 3HD2 LEU 40 20.772 9.199 8.114
289 HD22 LEU 40 1HD2 LEU 40 19.537 10.323 8.677
290 HD23 LEU 40 2HD2 LEU 40 20.446 10.678 7.210
291 H TYR 41 H TYR 41 17.517 9.577 3.417
292 HA TYR 41 HA TYR 41 19.176 9.084 1.061
293 HB2 TYR 41 1HB TYR 41 16.364 10.144 1.341
294 HB3 TYR 41 2HB TYR 41 17.280 10.217 -0.153
295 HD1 TYR 41 HD2 TYR 41 15.898 7.786 2.340
296 HD2 TYR 41 HD1 TYR 41 17.178 8.450 -1.657
297 HE1 TYR 41 HE2 TYR 41 15.028 5.573 1.691
298 HE2 TYR 41 HE1 TYR 41 16.311 6.250 -2.309
299 HH TYR 41 HH TYR 41 14.376 4.326 -0.172
300 H THR 42 H THR 42 20.467 10.739 0.533
301 HA THR 42 HA THR 42 20.120 13.247 1.964
302 HB THR 42 HB THR 42 22.231 12.554 -0.060
303 HG1 THR 42 HG1 THR 42 22.683 12.212 2.710
304 HG21 THR 42 3HG2 THR 42 22.096 14.895 0.662
305 HG22 THR 42 1HG2 THR 42 23.585 14.152 1.247
306 HG23 THR 42 2HG2 THR 42 22.230 14.391 2.348
307 H VAL 43 H VAL 43 19.250 14.902 0.955
308 HA VAL 43 HA VAL 43 18.799 14.744 -1.926
309 HB VAL 43 HB VAL 43 16.626 15.852 -1.601
310 HG11 VAL 43 1HG1 VAL 43 15.379 13.969 -0.620
311 HG12 VAL 43 2HG1 VAL 43 16.902 13.288 -0.044
312 HG13 VAL 43 3HG1 VAL 43 16.604 13.450 -1.774
313 HG21 VAL 43 3HG2 VAL 43 17.126 15.483 1.360
314 HG22 VAL 43 1HG2 VAL 43 15.610 16.029 0.642
315 HG23 VAL 43 2HG2 VAL 43 17.062 17.022 0.504
316 H LYS 44 H LYS 44 18.502 16.820 -2.880
317 HA LYS 44 HA LYS 44 19.997 18.921 -1.473
318 HB2 LYS 44 1HB LYS 44 21.252 17.838 -3.277
319 HB3 LYS 44 2HB LYS 44 19.966 18.218 -4.407
320 HG2 LYS 44 1HG LYS 44 20.399 20.641 -3.988
321 HG3 LYS 44 2HG LYS 44 21.789 20.172 -3.004
322 HD2 LYS 44 1HD LYS 44 21.395 19.430 -5.905
323 HD3 LYS 44 2HD LYS 44 22.397 20.760 -5.334
324 HE2 LYS 44 1HE LYS 44 22.834 17.882 -4.515
325 HE3 LYS 44 2HE LYS 44 23.618 18.623 -5.894
326 HZ1 LYS 44 3HZ LYS 44 23.911 19.553 -3.061
327 HZ2 LYS 44 1HZ LYS 44 24.630 20.231 -4.430
328 HZ3 LYS 44 2HZ LYS 44 25.014 18.674 -3.961
329 H TYR 45 H TYR 45 19.053 20.795 -1.382
330 HA TYR 45 HA TYR 45 16.465 21.229 -2.635
331 HB2 TYR 45 1HB TYR 45 17.982 22.633 -0.453
332 HB3 TYR 45 2HB TYR 45 16.582 23.382 -1.189
333 HD1 TYR 45 HD2 TYR 45 17.745 20.608 0.920
334 HD2 TYR 45 HD1 TYR 45 14.376 22.557 -0.786
335 HE1 TYR 45 HE2 TYR 45 16.258 19.351 2.417
336 HE2 TYR 45 HE1 TYR 45 12.888 21.323 0.684
337 HH TYR 45 HH TYR 45 12.892 19.209 1.998
338 H LYS 46 H LYS 46 16.053 23.335 -3.564
339 HA LYS 46 HA LYS 46 17.818 23.897 -5.651
340 HB2 LYS 46 1HB LYS 46 15.412 24.235 -5.821
341 HB3 LYS 46 2HB LYS 46 15.471 25.480 -4.589
342 HG2 LYS 46 1HG LYS 46 15.264 26.448 -6.797
343 HG3 LYS 46 2HG LYS 46 16.805 26.868 -6.029
344 HD2 LYS 46 1HD LYS 46 17.931 25.124 -7.323
345 HD3 LYS 46 2HD LYS 46 16.403 24.700 -8.097
346 HE2 LYS 46 1HE LYS 46 16.290 26.889 -9.117
347 HE3 LYS 46 2HE LYS 46 17.750 27.387 -8.263
348 HZ1 LYS 46 3HZ LYS 46 19.007 25.750 -9.493
349 HZ2 LYS 46 1HZ LYS 46 18.194 26.752 -10.555
350 HZ3 LYS 46 2HZ LYS 46 17.630 25.198 -10.275
351 H ASP 47 H ASP 47 17.681 25.053 -2.457
352 HA ASP 47 HA ASP 47 19.113 27.519 -2.862
353 HB2 ASP 47 1HB ASP 47 18.532 25.948 -0.341
354 HB3 ASP 47 2HB ASP 47 19.274 27.540 -0.374
355 H GLY 48 H GLY 48 20.085 24.392 -3.137
356 HA2 GLY 48 1HA GLY 48 22.250 23.635 -3.523
357 HA3 GLY 48 2HA GLY 48 22.880 25.099 -2.778
358 H THR 49 H THR 49 20.617 24.072 -0.776
359 HA THR 49 HA THR 49 22.404 23.068 1.204
360 HB THR 49 HB THR 49 19.390 23.176 1.207
361 HG1 THR 49 HG1 THR 49 19.588 25.306 1.841
362 HG21 THR 49 3HG2 THR 49 19.690 23.510 3.620
363 HG22 THR 49 1HG2 THR 49 21.440 23.395 3.428
364 HG23 THR 49 2HG2 THR 49 20.423 21.992 3.099
365 H GLU 50 H GLU 50 22.743 20.863 1.712
366 HA GLU 50 HA GLU 50 20.907 18.950 0.469
367 HB2 GLU 50 1HB GLU 50 23.575 18.442 1.823
368 HB3 GLU 50 2HB GLU 50 22.485 17.181 1.308
369 HG2 GLU 50 1HG GLU 50 24.169 17.302 -0.311
370 HG3 GLU 50 2HG GLU 50 22.756 18.061 -1.031
371 H LEU 51 H LEU 51 19.951 17.403 1.712
372 HA LEU 51 HA LEU 51 19.969 17.794 4.617
373 HB2 LEU 51 1HB LEU 51 18.070 19.007 3.576
374 HB3 LEU 51 2HB LEU 51 17.543 17.503 2.852
375 HG LEU 51 HG LEU 51 17.313 16.610 5.209
376 HD11 LEU 51 1HD1 LEU 51 17.021 18.262 6.973
377 HD12 LEU 51 2HD1 LEU 51 17.520 19.535 5.856
378 HD13 LEU 51 3HD1 LEU 51 18.668 18.287 6.335
379 HD21 LEU 51 3HD2 LEU 51 15.139 17.620 5.495
380 HD22 LEU 51 1HD2 LEU 51 15.428 17.245 3.799
381 HD23 LEU 51 2HD2 LEU 51 15.563 18.913 4.374
382 H ALA 52 H ALA 52 19.710 15.746 5.678
383 HA ALA 52 HA ALA 52 19.287 13.511 3.820
384 HB1 ALA 52 1HB ALA 52 20.359 12.087 5.519
385 HB2 ALA 52 2HB ALA 52 20.592 13.495 6.554
386 HB3 ALA 52 3HB ALA 52 21.440 13.385 5.012
387 H LEU 53 H LEU 53 17.529 12.320 4.111
388 HA LEU 53 HA LEU 53 16.108 12.502 6.596
389 HB2 LEU 53 1HB LEU 53 13.925 12.773 5.189
390 HB3 LEU 53 2HB LEU 53 14.849 14.160 5.710
391 HG LEU 53 HG LEU 53 15.809 14.381 3.442
392 HD11 LEU 53 1HD1 LEU 53 15.000 13.103 1.630
393 HD12 LEU 53 2HD1 LEU 53 13.976 12.189 2.710
394 HD13 LEU 53 3HD1 LEU 53 15.750 12.019 2.823
395 HD21 LEU 53 3HD2 LEU 53 12.871 14.040 3.427
396 HD22 LEU 53 1HD2 LEU 53 13.797 15.002 2.285
397 HD23 LEU 53 2HD2 LEU 53 13.702 15.506 3.998
398 H LYS 54 H LYS 54 14.162 11.077 6.586
399 HA LYS 54 HA LYS 54 15.108 8.473 5.715
400 HB2 LYS 54 1HB LYS 54 12.763 9.251 7.452
401 HB3 LYS 54 2HB LYS 54 13.220 7.593 7.080
402 HG2 LYS 54 1HG LYS 54 15.403 7.980 8.158
403 HG3 LYS 54 2HG LYS 54 14.885 9.613 8.575
404 HD2 LYS 54 1HD LYS 54 13.065 8.683 9.927
405 HD3 LYS 54 2HD LYS 54 13.577 7.050 9.493
406 HE2 LYS 54 1HE LYS 54 15.741 7.464 10.558
407 HE3 LYS 54 2HE LYS 54 15.217 9.088 10.984
408 HZ1 LYS 54 3HZ LYS 54 15.012 7.531 12.813
409 HZ2 LYS 54 1HZ LYS 54 13.932 6.584 11.932
410 HZ3 LYS 54 2HZ LYS 54 13.520 8.159 12.401
411 H GLU 55 H GLU 55 13.684 6.996 4.559
412 HA GLU 55 HA GLU 55 12.426 8.185 2.349
413 HB2 GLU 55 1HB GLU 55 11.413 5.773 2.058
414 HB3 GLU 55 2HB GLU 55 13.113 6.072 1.775
415 HG2 GLU 55 1HG GLU 55 12.769 3.998 3.007
416 HG3 GLU 55 2HG GLU 55 13.643 5.164 3.986
417 H SER 56 H SER 56 11.199 7.376 5.406
418 HA SER 56 HA SER 56 8.433 7.445 4.830
419 HB2 SER 56 1HB SER 56 9.872 8.019 7.422
420 HB3 SER 56 2HB SER 56 8.164 7.616 7.253
421 HG SER 56 HG SER 56 10.305 5.903 6.413
422 H ASP 57 H ASP 57 10.701 9.900 4.693
423 HA ASP 57 HA ASP 57 8.626 11.928 5.096
424 HB2 ASP 57 1HB ASP 57 11.630 12.116 5.345
425 HB3 ASP 57 2HB ASP 57 10.651 13.556 5.244
426 H ILE 58 H ILE 58 9.693 10.120 2.691
427 HA ILE 58 HA ILE 58 9.982 12.386 0.819
428 HB ILE 58 HB ILE 58 11.037 9.594 0.386
429 HG12 ILE 58 1HG1 ILE 58 12.511 12.089 1.160
430 HG13 ILE 58 2HG1 ILE 58 12.220 10.707 2.214
431 HG21 ILE 58 1HG2 ILE 58 12.274 10.649 -1.470
432 HG22 ILE 58 2HG2 ILE 58 11.505 12.191 -1.101
433 HG23 ILE 58 3HG2 ILE 58 10.531 10.833 -1.667
434 HD11 ILE 58 3HD1 ILE 58 14.435 10.808 1.285
435 HD12 ILE 58 1HD1 ILE 58 13.786 10.654 -0.340
436 HD13 ILE 58 2HD1 ILE 58 13.599 9.310 0.815
437 H ARG 59 H ARG 59 8.633 12.494 -0.781
438 HA ARG 59 HA ARG 59 7.230 10.085 -1.662
439 HB2 ARG 59 1HB ARG 59 5.939 12.737 -1.024
440 HB3 ARG 59 2HB ARG 59 5.306 11.793 -2.361
441 HG2 ARG 59 1HG ARG 59 3.981 11.277 -0.456
442 HG3 ARG 59 2HG ARG 59 5.013 9.887 -0.763
443 HD2 ARG 59 1HD ARG 59 6.590 11.000 0.969
444 HD3 ARG 59 2HD ARG 59 5.145 11.893 1.445
445 HE ARG 59 HE ARG 59 4.579 9.150 1.264
446 HH11 ARG 59 1HH1 ARG 59 5.954 11.546 3.475
447 HH12 ARG 59 2HH1 ARG 59 6.114 10.439 4.764
448 HH21 ARG 59 1HH2 ARG 59 4.736 7.679 3.062
449 HH22 ARG 59 2HH2 ARG 59 5.357 8.214 4.554
450 H LEU 60 H LEU 60 6.416 10.391 -3.966
451 HA LEU 60 HA LEU 60 8.575 11.570 -5.476
452 HB2 LEU 60 1HB LEU 60 6.033 10.227 -6.450
453 HB3 LEU 60 2HB LEU 60 7.381 10.691 -7.456
454 HG LEU 60 HG LEU 60 8.761 9.044 -6.081
455 HD11 LEU 60 1HD1 LEU 60 6.026 8.064 -5.312
456 HD12 LEU 60 2HD1 LEU 60 7.266 8.690 -4.228
457 HD13 LEU 60 3HD1 LEU 60 7.529 7.171 -5.084
458 HD21 LEU 60 3HD2 LEU 60 8.129 8.645 -8.390
459 HD22 LEU 60 1HD2 LEU 60 6.564 8.023 -7.871
460 HD23 LEU 60 2HD2 LEU 60 8.040 7.151 -7.462
461 H GLN 61 H GLN 61 7.700 12.840 -7.596
462 HA GLN 61 HA GLN 61 6.378 15.162 -6.707
463 HB2 GLN 61 1HB GLN 61 6.814 14.121 -9.515
464 HB3 GLN 61 2HB GLN 61 6.078 15.678 -9.170
465 HG2 GLN 61 1HG GLN 61 8.113 16.397 -8.029
466 HG3 GLN 61 2HG GLN 61 8.856 14.836 -8.362
467 HE21 GLN 61 2HE2 GLN 61 9.585 17.603 -9.195
468 HE22 GLN 61 1HE2 GLN 61 9.676 17.539 -10.903
469 H SER 62 H SER 62 5.263 12.182 -8.029
470 HA SER 62 HA SER 62 3.301 11.081 -7.867
471 HB2 SER 62 1HB SER 62 2.559 13.251 -5.906
472 HB3 SER 62 2HB SER 62 1.844 11.641 -6.013
473 HG SER 62 HG SER 62 4.315 12.450 -5.000
474 H SER 63 H SER 63 3.575 13.368 -9.744
475 HA SER 63 HA SER 63 0.821 14.252 -10.016
476 HB2 SER 63 1HB SER 63 3.315 14.983 -11.556
477 HB3 SER 63 2HB SER 63 1.741 15.762 -11.726
478 HG SER 63 HG SER 63 2.863 15.613 -9.158
479 H PHE 64 H PHE 64 -0.158 14.062 -12.240
480 HA PHE 64 HA PHE 64 0.266 11.450 -13.213
481 HB2 PHE 64 1HB PHE 64 -1.330 12.184 -15.137
482 HB3 PHE 64 2HB PHE 64 -1.976 12.031 -13.518
483 HD1 PHE 64 HD1 PHE 64 -0.908 14.445 -16.111
484 HD2 PHE 64 HD2 PHE 64 -2.943 13.878 -12.437
485 HE1 PHE 64 HE1 PHE 64 -1.883 16.702 -16.298
486 HE2 PHE 64 HE2 PHE 64 -3.909 16.134 -12.609
487 HZ PHE 64 HZ PHE 64 -3.376 17.546 -14.549
488 H LYS 65 H LYS 65 1.610 10.709 -14.486
489 HA LYS 65 HA LYS 65 3.750 12.307 -15.411
490 HB2 LYS 65 1HB LYS 65 3.175 9.398 -15.956
491 HB3 LYS 65 2HB LYS 65 4.712 10.217 -16.177
492 HG2 LYS 65 1HG LYS 65 4.848 10.603 -13.760
493 HG3 LYS 65 2HG LYS 65 3.288 9.810 -13.550
494 HD2 LYS 65 1HD LYS 65 5.019 8.227 -13.016
495 HD3 LYS 65 2HD LYS 65 4.280 7.744 -14.540
496 HE2 LYS 65 1HE LYS 65 6.152 8.787 -15.761
497 HE3 LYS 65 2HE LYS 65 6.882 9.235 -14.219
498 HZ1 LYS 65 3HZ LYS 65 7.004 6.840 -13.687
499 HZ2 LYS 65 1HZ LYS 65 7.872 7.235 -15.088
500 HZ3 LYS 65 2HZ LYS 65 6.391 6.501 -15.227
501 H GLN 66 H GLN 66 4.659 12.063 -17.607
502 HA GLN 66 HA GLN 66 2.781 11.696 -19.754
503 HB2 GLN 66 1HB GLN 66 2.650 14.122 -19.084
504 HB3 GLN 66 2HB GLN 66 4.375 14.248 -19.394
505 HG2 GLN 66 1HG GLN 66 3.954 13.591 -21.742
506 HG3 GLN 66 2HG GLN 66 2.226 13.624 -21.401
507 HE21 GLN 66 2HE2 GLN 66 5.072 15.474 -21.837
508 HE22 GLN 66 1HE2 GLN 66 4.323 17.016 -21.978
Start of MODEL 6
1 H1 GLY 1 H GLY 1 0.204 -7.251 0.679
2 HA2 GLY 1 2HA GLY 1 1.332 -7.177 2.753
3 HA3 GLY 1 1HA GLY 1 1.657 -8.908 2.614
4 H ALA 2 H ALA 2 3.525 -6.622 2.771
5 HA ALA 2 HA ALA 2 4.956 -7.165 0.280
6 HB1 ALA 2 1HB ALA 2 4.855 -4.551 1.781
7 HB2 ALA 2 2HB ALA 2 4.078 -4.880 0.233
8 HB3 ALA 2 3HB ALA 2 5.837 -4.878 0.355
9 H MET 3 H MET 3 6.447 -8.554 0.944
10 HA MET 3 HA MET 3 8.102 -7.797 3.235
11 HB2 MET 3 1HB MET 3 6.613 -9.895 3.491
12 HB3 MET 3 2HB MET 3 7.661 -10.640 2.302
13 HG2 MET 3 1HG MET 3 8.518 -9.587 5.001
14 HG3 MET 3 2HG MET 3 8.256 -11.272 4.600
15 HE1 MET 3 3HE MET 3 9.894 -12.665 2.961
16 HE2 MET 3 1HE MET 3 11.266 -11.936 2.128
17 HE3 MET 3 2HE MET 3 9.629 -11.465 1.693
18 H GLY 4 H GLY 4 9.964 -7.073 2.379
19 HA2 GLY 4 1HA GLY 4 11.686 -8.703 0.932
20 HA3 GLY 4 2HA GLY 4 10.854 -7.655 -0.219
21 H MET 5 H MET 5 13.286 -7.106 -0.359
22 HA MET 5 HA MET 5 13.737 -4.837 1.436
23 HB2 MET 5 1HB MET 5 15.822 -6.603 0.121
24 HB3 MET 5 2HB MET 5 16.174 -5.136 1.013
25 HG2 MET 5 1HG MET 5 15.265 -6.160 3.042
26 HG3 MET 5 2HG MET 5 14.931 -7.634 2.133
27 HE1 MET 5 3HE MET 5 16.630 -7.589 4.825
28 HE2 MET 5 1HE MET 5 17.954 -8.672 4.399
29 HE3 MET 5 2HE MET 5 16.303 -9.058 3.907
30 HA PRO 6 HA PRO 6 13.154 -3.061 -2.701
31 HB2 PRO 6 1HB PRO 6 12.570 -0.551 -1.858
32 HB3 PRO 6 2HB PRO 6 11.384 -1.858 -1.825
33 HG2 PRO 6 1HG PRO 6 13.053 -0.771 0.405
34 HG3 PRO 6 2HG PRO 6 11.340 -1.223 0.404
35 HD2 PRO 6 1HD PRO 6 13.283 -2.820 1.403
36 HD3 PRO 6 2HD PRO 6 11.801 -3.464 0.669
37 H ASN 7 H ASN 7 15.324 -2.293 -0.221
38 HA ASN 7 HA ASN 7 17.259 -1.200 0.022
39 HB2 ASN 7 1HB ASN 7 18.047 -2.666 -1.855
40 HB3 ASN 7 2HB ASN 7 17.553 -1.431 -3.009
41 HD21 ASN 7 2HD2 ASN 7 19.664 -1.095 -3.810
42 HD22 ASN 7 1HD2 ASN 7 20.874 -0.342 -2.841
43 H ARG 8 H ARG 8 16.750 0.267 -3.119
44 HA ARG 8 HA ARG 8 16.246 2.762 -1.690
45 HB2 ARG 8 1HB ARG 8 17.656 2.348 -4.331
46 HB3 ARG 8 2HB ARG 8 17.145 3.933 -3.724
47 HG2 ARG 8 1HG ARG 8 18.619 3.553 -1.790
48 HG3 ARG 8 2HG ARG 8 19.158 2.051 -2.543
49 HD2 ARG 8 1HD ARG 8 19.426 4.818 -3.726
50 HD3 ARG 8 2HD ARG 8 20.716 3.896 -2.960
51 HE ARG 8 HE ARG 8 19.337 2.990 -5.396
52 HH11 ARG 8 1HH1 ARG 8 22.379 3.703 -3.678
53 HH12 ARG 8 2HH1 ARG 8 23.336 2.971 -4.863
54 HH21 ARG 8 1HH2 ARG 8 20.721 2.058 -7.006
55 HH22 ARG 8 2HH2 ARG 8 22.406 2.029 -6.771
56 H LYS 9 H LYS 9 14.252 3.136 -1.734
57 HA LYS 9 HA LYS 9 12.369 2.080 -3.599
58 HB2 LYS 9 1HB LYS 9 11.845 2.704 -1.255
59 HB3 LYS 9 2HB LYS 9 12.129 4.386 -1.657
60 HG2 LYS 9 1HG LYS 9 10.240 4.247 -3.273
61 HG3 LYS 9 2HG LYS 9 9.905 2.621 -2.655
62 HD2 LYS 9 1HD LYS 9 9.632 3.529 -0.409
63 HD3 LYS 9 2HD LYS 9 9.994 5.140 -1.012
64 HE2 LYS 9 1HE LYS 9 7.998 4.963 -2.477
65 HE3 LYS 9 2HE LYS 9 7.592 3.440 -1.678
66 HZ1 LYS 9 3HZ LYS 9 7.710 4.800 0.459
67 HZ2 LYS 9 1HZ LYS 9 6.389 5.159 -0.571
68 HZ3 LYS 9 2HZ LYS 9 7.754 6.144 -0.550
69 H TYR 10 H TYR 10 14.120 5.046 -3.212
70 HA TYR 10 HA TYR 10 13.074 6.079 -5.743
71 HB2 TYR 10 1HB TYR 10 14.385 7.645 -3.489
72 HB3 TYR 10 2HB TYR 10 13.573 8.308 -4.903
73 HD1 TYR 10 HD2 TYR 10 11.045 7.671 -5.134
74 HD2 TYR 10 HD1 TYR 10 13.209 7.479 -1.497
75 HE1 TYR 10 HE2 TYR 10 8.921 7.721 -3.883
76 HE2 TYR 10 HE1 TYR 10 11.097 7.511 -0.223
77 HH TYR 10 HH TYR 10 8.688 8.335 -0.625
78 H ALA 11 H ALA 11 14.602 6.146 -7.313
79 HA ALA 11 HA ALA 11 17.234 5.144 -6.746
80 HB1 ALA 11 1HB ALA 11 16.085 4.567 -8.828
81 HB2 ALA 11 2HB ALA 11 17.596 5.414 -9.168
82 HB3 ALA 11 3HB ALA 11 16.058 6.267 -9.290
83 H ASP 12 H ASP 12 19.198 6.306 -7.117
84 HA ASP 12 HA ASP 12 18.992 8.957 -6.090
85 HB2 ASP 12 1HB ASP 12 21.425 8.981 -5.918
86 HB3 ASP 12 2HB ASP 12 20.802 7.461 -5.305
87 H GLY 13 H GLY 13 19.218 10.879 -7.037
88 HA2 GLY 13 1HA GLY 13 20.024 12.300 -8.754
89 HA3 GLY 13 2HA GLY 13 19.894 10.958 -9.885
90 H GLU 14 H GLU 14 17.204 10.577 -8.128
91 HA GLU 14 HA GLU 14 15.603 11.611 -10.277
92 HB2 GLU 14 1HB GLU 14 15.259 9.374 -9.225
93 HB3 GLU 14 2HB GLU 14 14.784 10.197 -7.749
94 HG2 GLU 14 1HG GLU 14 12.861 9.418 -9.090
95 HG3 GLU 14 2HG GLU 14 12.873 11.168 -8.859
96 H VAL 15 H VAL 15 13.822 13.083 -9.988
97 HA VAL 15 HA VAL 15 14.292 14.879 -7.739
98 HB VAL 15 HB VAL 15 14.193 16.000 -9.927
99 HG11 VAL 15 1HG1 VAL 15 11.407 14.908 -10.200
100 HG12 VAL 15 2HG1 VAL 15 12.817 14.471 -11.167
101 HG13 VAL 15 3HG1 VAL 15 12.154 16.104 -11.263
102 HG21 VAL 15 3HG2 VAL 15 13.393 17.272 -8.031
103 HG22 VAL 15 1HG2 VAL 15 11.768 16.628 -8.256
104 HG23 VAL 15 2HG2 VAL 15 12.470 17.690 -9.473
105 H VAL 16 H VAL 16 12.952 15.000 -6.102
106 HA VAL 16 HA VAL 16 10.417 13.584 -6.202
107 HB VAL 16 HB VAL 16 10.930 12.532 -3.953
108 HG11 VAL 16 1HG1 VAL 16 11.012 11.202 -6.013
109 HG12 VAL 16 2HG1 VAL 16 12.232 10.667 -4.858
110 HG13 VAL 16 3HG1 VAL 16 12.700 11.661 -6.239
111 HG21 VAL 16 3HG2 VAL 16 12.784 13.913 -3.268
112 HG22 VAL 16 1HG2 VAL 16 13.753 13.362 -4.641
113 HG23 VAL 16 2HG2 VAL 16 13.308 12.232 -3.365
114 H MET 17 H MET 17 9.345 13.892 -3.886
115 HA MET 17 HA MET 17 9.723 16.713 -3.146
116 HB2 MET 17 1HB MET 17 7.253 14.978 -2.788
117 HB3 MET 17 2HB MET 17 7.386 16.680 -2.373
118 HG2 MET 17 1HG MET 17 7.547 15.536 -5.156
119 HG3 MET 17 2HG MET 17 6.123 16.288 -4.452
120 HE1 MET 17 3HE MET 17 5.849 18.854 -4.040
121 HE2 MET 17 1HE MET 17 7.155 20.029 -4.198
122 HE3 MET 17 2HE MET 17 7.221 18.804 -2.931
123 H GLY 18 H GLY 18 10.295 17.028 -1.034
124 HA2 GLY 18 1HA GLY 18 10.248 14.653 0.768
125 HA3 GLY 18 2HA GLY 18 11.678 15.546 0.537
126 H ARG 19 H ARG 19 10.084 15.151 2.906
127 HA ARG 19 HA ARG 19 8.800 17.655 3.560
128 HB2 ARG 19 1HB ARG 19 7.893 15.606 4.445
129 HB3 ARG 19 2HB ARG 19 9.436 15.190 5.175
130 HG2 ARG 19 1HG ARG 19 9.198 17.315 6.528
131 HG3 ARG 19 2HG ARG 19 7.534 17.362 5.963
132 HD2 ARG 19 1HD ARG 19 6.986 15.372 7.048
133 HD3 ARG 19 2HD ARG 19 8.677 14.921 7.266
134 HE ARG 19 HE ARG 19 7.352 17.138 8.675
135 HH11 ARG 19 1HH1 ARG 19 9.745 14.491 8.607
136 HH12 ARG 19 2HH1 ARG 19 10.309 14.799 10.177
137 HH21 ARG 19 1HH2 ARG 19 8.105 17.526 10.807
138 HH22 ARG 19 2HH2 ARG 19 9.329 16.558 11.501
139 H TRP 20 H TRP 20 9.697 19.316 4.635
140 HA TRP 20 HA TRP 20 12.495 19.176 5.363
141 HB2 TRP 20 1HB TRP 20 11.505 21.230 4.333
142 HB3 TRP 20 2HB TRP 20 10.523 21.457 5.776
143 HD1 TRP 20 HD1 TRP 20 11.881 22.240 8.041
144 HE1 TRP 20 HE1 TRP 20 14.110 23.485 8.308
145 HE3 TRP 20 HE3 TRP 20 13.741 21.576 3.342
146 HZ2 TRP 20 HZ2 TRP 20 16.374 24.124 6.707
147 HZ3 TRP 20 HZ3 TRP 20 15.924 22.526 2.781
148 HH2 TRP 20 HH2 TRP 20 17.214 23.765 4.386
149 HA PRO 21 HA PRO 21 11.456 17.662 9.500
150 HB2 PRO 21 1HB PRO 21 13.928 18.228 10.603
151 HB3 PRO 21 2HB PRO 21 13.551 16.750 9.712
152 HG2 PRO 21 1HG PRO 21 14.889 19.245 8.769
153 HG3 PRO 21 2HG PRO 21 15.287 17.561 8.398
154 HD2 PRO 21 1HD PRO 21 13.995 19.077 6.650
155 HD3 PRO 21 2HD PRO 21 13.564 17.366 6.854
156 H GLY 22 H GLY 22 10.380 18.749 10.970
157 HA2 GLY 22 1HA GLY 22 10.270 20.408 12.702
158 HA3 GLY 22 2HA GLY 22 11.246 21.466 11.679
159 H SER 23 H SER 23 9.720 20.575 9.312
160 HA SER 23 HA SER 23 7.313 22.172 9.717
161 HB2 SER 23 1HB SER 23 8.927 21.650 7.205
162 HB3 SER 23 2HB SER 23 7.541 22.731 7.335
163 HG SER 23 HG SER 23 9.580 23.807 7.434
164 H VAL 24 H VAL 24 5.552 21.412 8.130
165 HA VAL 24 HA VAL 24 5.642 18.482 7.890
166 HB VAL 24 HB VAL 24 3.897 19.473 9.430
167 HG11 VAL 24 1HG1 VAL 24 2.690 20.559 6.906
168 HG12 VAL 24 2HG1 VAL 24 3.348 21.478 8.260
169 HG13 VAL 24 3HG1 VAL 24 1.897 20.503 8.480
170 HG21 VAL 24 3HG2 VAL 24 2.009 18.084 8.628
171 HG22 VAL 24 1HG2 VAL 24 3.556 17.237 8.557
172 HG23 VAL 24 2HG2 VAL 24 2.841 17.889 7.085
173 H LEU 25 H LEU 25 6.288 21.007 6.191
174 HA LEU 25 HA LEU 25 4.700 20.518 3.824
175 HB2 LEU 25 1HB LEU 25 6.753 22.544 4.452
176 HB3 LEU 25 2HB LEU 25 6.004 22.356 2.880
177 HG LEU 25 HG LEU 25 4.721 23.236 5.453
178 HD11 LEU 25 1HD1 LEU 25 5.831 24.861 4.059
179 HD12 LEU 25 2HD1 LEU 25 4.047 25.060 3.954
180 HD13 LEU 25 3HD1 LEU 25 4.947 24.152 2.704
181 HD21 LEU 25 3HD2 LEU 25 3.174 21.612 4.489
182 HD22 LEU 25 1HD2 LEU 25 3.377 22.372 2.900
183 HD23 LEU 25 2HD2 LEU 25 2.595 23.255 4.208
184 H TYR 26 H TYR 26 5.400 19.878 1.941
185 HA TYR 26 HA TYR 26 8.021 18.572 1.817
186 HB2 TYR 26 1HB TYR 26 5.412 17.949 0.393
187 HB3 TYR 26 2HB TYR 26 6.954 17.235 -0.053
188 HD1 TYR 26 HD2 TYR 26 4.782 17.669 2.967
189 HD2 TYR 26 HD1 TYR 26 7.487 15.173 0.840
190 HE1 TYR 26 HE2 TYR 26 4.450 15.901 4.632
191 HE2 TYR 26 HE1 TYR 26 7.170 13.401 2.489
192 HH TYR 26 HH TYR 26 6.422 13.172 4.870
193 H TYR 27 H TYR 27 9.393 19.282 0.370
194 HA TYR 27 HA TYR 27 8.415 21.243 -1.588
195 HB2 TYR 27 1HB TYR 27 11.132 21.174 -0.290
196 HB3 TYR 27 2HB TYR 27 10.524 22.422 -1.368
197 HD1 TYR 27 HD2 TYR 27 8.500 23.805 -0.549
198 HD2 TYR 27 HD1 TYR 27 10.851 21.370 2.028
199 HE1 TYR 27 HE2 TYR 27 7.652 25.049 1.410
200 HE2 TYR 27 HE1 TYR 27 10.007 22.619 3.975
201 HH TYR 27 HH TYR 27 9.072 24.794 4.478
202 H GLU 28 H GLU 28 10.168 21.425 -3.362
203 HA GLU 28 HA GLU 28 10.456 18.727 -4.376
204 HB2 GLU 28 1HB GLU 28 9.540 20.446 -5.878
205 HB3 GLU 28 2HB GLU 28 11.035 21.362 -5.744
206 HG2 GLU 28 1HG GLU 28 12.272 19.572 -6.793
207 HG3 GLU 28 2HG GLU 28 10.824 18.576 -6.855
208 H VAL 29 H VAL 29 12.243 17.633 -4.402
209 HA VAL 29 HA VAL 29 14.793 19.003 -4.014
210 HB VAL 29 HB VAL 29 15.496 17.273 -2.422
211 HG11 VAL 29 1HG1 VAL 29 14.633 19.339 -1.539
212 HG12 VAL 29 2HG1 VAL 29 14.191 17.988 -0.494
213 HG13 VAL 29 3HG1 VAL 29 12.994 18.694 -1.581
214 HG21 VAL 29 3HG2 VAL 29 13.840 15.786 -1.365
215 HG22 VAL 29 1HG2 VAL 29 14.052 15.466 -3.088
216 HG23 VAL 29 2HG2 VAL 29 12.630 16.348 -2.525
217 H GLN 30 H GLN 30 16.572 17.598 -4.582
218 HA GLN 30 HA GLN 30 15.793 15.465 -6.479
219 HB2 GLN 30 1HB GLN 30 18.391 17.013 -6.304
220 HB3 GLN 30 2HB GLN 30 18.022 15.756 -7.467
221 HG2 GLN 30 1HG GLN 30 16.367 17.145 -8.505
222 HG3 GLN 30 2HG GLN 30 16.586 18.400 -7.284
223 HE21 GLN 30 2HE2 GLN 30 16.968 18.536 -10.170
224 HE22 GLN 30 1HE2 GLN 30 18.615 19.010 -10.398
225 H VAL 31 H VAL 31 16.408 13.452 -5.835
226 HA VAL 31 HA VAL 31 17.799 13.251 -3.348
227 HB VAL 31 HB VAL 31 16.041 11.539 -4.003
228 HG11 VAL 31 1HG1 VAL 31 16.467 9.820 -5.515
229 HG12 VAL 31 2HG1 VAL 31 17.927 10.660 -6.048
230 HG13 VAL 31 3HG1 VAL 31 16.346 11.410 -6.262
231 HG21 VAL 31 3HG2 VAL 31 17.673 10.920 -2.287
232 HG22 VAL 31 1HG2 VAL 31 18.767 10.341 -3.543
233 HG23 VAL 31 2HG2 VAL 31 17.222 9.533 -3.277
234 H THR 32 H THR 32 19.927 12.973 -3.015
235 HA THR 32 HA THR 32 21.470 12.908 -5.485
236 HB THR 32 HB THR 32 21.401 15.176 -4.519
237 HG1 THR 32 HG1 THR 32 23.491 13.915 -5.384
238 HG21 THR 32 3HG2 THR 32 22.647 15.698 -2.451
239 HG22 THR 32 1HG2 THR 32 22.901 13.972 -2.185
240 HG23 THR 32 2HG2 THR 32 21.272 14.638 -2.139
241 H SER 33 H SER 33 21.229 11.710 -2.211
242 HA SER 33 HA SER 33 23.185 9.725 -2.903
243 HB2 SER 33 1HB SER 33 23.647 11.503 -0.464
244 HB3 SER 33 2HB SER 33 24.576 10.072 -0.886
245 HG SER 33 HG SER 33 24.545 11.574 -3.016
246 H TYR 34 H TYR 34 23.327 8.088 -1.049
247 HA TYR 34 HA TYR 34 20.981 7.998 0.643
248 HB2 TYR 34 1HB TYR 34 20.109 6.951 -1.326
249 HB3 TYR 34 2HB TYR 34 21.583 6.030 -1.569
250 HD1 TYR 34 HD2 TYR 34 18.720 6.405 0.792
251 HD2 TYR 34 HD1 TYR 34 21.724 3.842 -0.775
252 HE1 TYR 34 HE2 TYR 34 17.724 4.503 1.984
253 HE2 TYR 34 HE1 TYR 34 20.731 1.938 0.401
254 HH TYR 34 HH TYR 34 19.340 1.512 2.325
255 H ASP 35 H ASP 35 21.575 7.207 2.554
256 HA ASP 35 HA ASP 35 24.086 5.697 2.725
257 HB2 ASP 35 1HB ASP 35 23.923 7.570 4.329
258 HB3 ASP 35 2HB ASP 35 22.406 6.914 4.943
259 H ASP 36 H ASP 36 24.020 3.651 2.904
260 HA ASP 36 HA ASP 36 21.558 2.241 2.734
261 HB2 ASP 36 1HB ASP 36 23.448 1.415 1.529
262 HB3 ASP 36 2HB ASP 36 24.413 1.310 2.992
263 H ALA 37 H ALA 37 23.960 2.665 5.224
264 HA ALA 37 HA ALA 37 23.057 0.692 6.992
265 HB1 ALA 37 1HB ALA 37 24.418 1.810 8.663
266 HB2 ALA 37 2HB ALA 37 24.550 3.221 7.610
267 HB3 ALA 37 3HB ALA 37 25.270 1.686 7.125
268 H SER 38 H SER 38 22.362 4.207 7.008
269 HA SER 38 HA SER 38 20.440 3.740 9.151
270 HB2 SER 38 1HB SER 38 21.187 6.316 7.762
271 HB3 SER 38 2HB SER 38 20.287 6.154 9.265
272 HG SER 38 HG SER 38 22.980 5.588 8.739
273 H HIS 39 H HIS 39 20.371 3.467 5.878
274 HA HIS 39 HA HIS 39 18.827 3.519 4.209
275 HB2 HIS 39 1HB HIS 39 16.844 3.428 6.519
276 HB3 HIS 39 2HB HIS 39 16.429 3.140 4.838
277 HD1 HIS 39 HD1 HIS 39 16.748 1.277 7.743
278 HD2 HIS 39 HD2 HIS 39 18.369 0.825 3.945
279 HE1 HIS 39 HE1 HIS 39 17.319 -1.153 7.521
280 H LEU 40 H LEU 40 19.892 5.865 4.767
281 HA LEU 40 HA LEU 40 17.691 7.805 5.035
282 HB2 LEU 40 1HB LEU 40 20.331 7.702 6.161
283 HB3 LEU 40 2HB LEU 40 20.158 9.152 5.196
284 HG LEU 40 HG LEU 40 18.193 9.803 6.530
285 HD11 LEU 40 1HD1 LEU 40 17.378 7.611 7.177
286 HD12 LEU 40 2HD1 LEU 40 17.650 8.625 8.593
287 HD13 LEU 40 3HD1 LEU 40 18.808 7.364 8.176
288 HD21 LEU 40 3HD2 LEU 40 20.641 9.174 8.170
289 HD22 LEU 40 1HD2 LEU 40 19.385 10.336 8.595
290 HD23 LEU 40 2HD2 LEU 40 20.393 10.610 7.174
291 H TYR 41 H TYR 41 17.281 9.221 3.461
292 HA TYR 41 HA TYR 41 18.828 8.859 1.011
293 HB2 TYR 41 1HB TYR 41 15.995 9.807 1.503
294 HB3 TYR 41 2HB TYR 41 16.791 9.884 -0.059
295 HD1 TYR 41 HD2 TYR 41 15.958 7.374 2.604
296 HD2 TYR 41 HD1 TYR 41 16.406 8.164 -1.551
297 HE1 TYR 41 HE2 TYR 41 15.137 5.118 2.093
298 HE2 TYR 41 HE1 TYR 41 15.585 5.903 -2.072
299 HH TYR 41 HH TYR 41 14.276 3.859 0.435
300 H THR 42 H THR 42 20.106 10.503 0.528
301 HA THR 42 HA THR 42 19.700 12.999 1.967
302 HB THR 42 HB THR 42 21.962 12.264 0.133
303 HG1 THR 42 HG1 THR 42 21.247 11.091 2.403
304 HG21 THR 42 3HG2 THR 42 21.796 14.622 0.805
305 HG22 THR 42 1HG2 THR 42 23.198 13.874 1.570
306 HG23 THR 42 2HG2 THR 42 21.725 14.144 2.500
307 H VAL 43 H VAL 43 18.939 14.685 0.954
308 HA VAL 43 HA VAL 43 18.589 14.532 -1.935
309 HB VAL 43 HB VAL 43 16.445 15.711 -1.679
310 HG11 VAL 43 1HG1 VAL 43 16.382 13.301 -1.854
311 HG12 VAL 43 2HG1 VAL 43 15.111 13.856 -0.767
312 HG13 VAL 43 3HG1 VAL 43 16.584 13.145 -0.110
313 HG21 VAL 43 3HG2 VAL 43 16.842 15.317 1.295
314 HG22 VAL 43 1HG2 VAL 43 15.360 15.897 0.528
315 HG23 VAL 43 2HG2 VAL 43 16.836 16.861 0.439
316 H LYS 44 H LYS 44 18.367 16.580 -2.897
317 HA LYS 44 HA LYS 44 20.094 18.611 -1.638
318 HB2 LYS 44 1HB LYS 44 20.896 17.422 -3.643
319 HB3 LYS 44 2HB LYS 44 19.466 17.940 -4.511
320 HG2 LYS 44 1HG LYS 44 20.309 20.331 -3.979
321 HG3 LYS 44 2HG LYS 44 21.852 19.525 -3.662
322 HD2 LYS 44 1HD LYS 44 20.250 19.425 -6.224
323 HD3 LYS 44 2HD LYS 44 21.795 20.240 -5.976
324 HE2 LYS 44 1HE LYS 44 22.919 18.153 -5.697
325 HE3 LYS 44 2HE LYS 44 21.399 17.261 -5.681
326 HZ1 LYS 44 3HZ LYS 44 22.556 18.722 -8.000
327 HZ2 LYS 44 1HZ LYS 44 21.037 17.996 -7.971
328 HZ3 LYS 44 2HZ LYS 44 22.421 17.044 -7.826
329 H TYR 45 H TYR 45 19.038 20.565 -1.322
330 HA TYR 45 HA TYR 45 16.430 20.958 -2.555
331 HB2 TYR 45 1HB TYR 45 17.854 22.299 -0.271
332 HB3 TYR 45 2HB TYR 45 16.488 23.071 -1.050
333 HD1 TYR 45 HD1 TYR 45 17.532 20.134 0.946
334 HD2 TYR 45 HD2 TYR 45 14.295 22.367 -0.645
335 HE1 TYR 45 HE1 TYR 45 15.967 18.860 2.360
336 HE2 TYR 45 HE2 TYR 45 12.717 21.118 0.744
337 HH TYR 45 HH TYR 45 13.721 19.086 3.305
338 H LYS 46 H LYS 46 15.969 22.753 -3.748
339 HA LYS 46 HA LYS 46 17.943 23.846 -5.406
340 HB2 LYS 46 1HB LYS 46 15.558 23.655 -5.994
341 HB3 LYS 46 2HB LYS 46 15.157 24.810 -4.747
342 HG2 LYS 46 1HG LYS 46 16.263 26.562 -5.869
343 HG3 LYS 46 2HG LYS 46 16.926 25.446 -7.067
344 HD2 LYS 46 1HD LYS 46 14.694 24.976 -7.899
345 HD3 LYS 46 2HD LYS 46 13.990 26.018 -6.660
346 HE2 LYS 46 1HE LYS 46 14.163 27.108 -8.883
347 HE3 LYS 46 2HE LYS 46 15.031 27.950 -7.603
348 HZ1 LYS 46 3HZ LYS 46 16.299 27.818 -9.651
349 HZ2 LYS 46 1HZ LYS 46 16.297 26.138 -9.604
350 HZ3 LYS 46 2HZ LYS 46 17.101 27.034 -8.413
351 H ASP 47 H ASP 47 16.965 24.526 -2.295
352 HA ASP 47 HA ASP 47 17.716 27.266 -1.952
353 HB2 ASP 47 1HB ASP 47 16.147 25.941 -0.510
354 HB3 ASP 47 2HB ASP 47 17.518 25.005 0.041
355 H GLY 48 H GLY 48 19.547 24.552 -2.627
356 HA2 GLY 48 1HA GLY 48 21.871 24.503 -2.848
357 HA3 GLY 48 2HA GLY 48 21.990 25.816 -1.684
358 H THR 49 H THR 49 20.240 24.549 0.204
359 HA THR 49 HA THR 49 22.099 23.096 1.754
360 HB THR 49 HB THR 49 19.101 23.269 2.107
361 HG1 THR 49 HG1 THR 49 19.351 25.395 2.382
362 HG21 THR 49 3HG2 THR 49 19.692 23.264 4.502
363 HG22 THR 49 1HG2 THR 49 21.403 23.173 4.083
364 HG23 THR 49 2HG2 THR 49 20.328 21.828 3.699
365 H GLU 50 H GLU 50 22.487 20.852 1.695
366 HA GLU 50 HA GLU 50 20.339 19.235 0.540
367 HB2 GLU 50 1HB GLU 50 21.955 17.369 0.379
368 HB3 GLU 50 2HB GLU 50 22.527 18.775 -0.495
369 HG2 GLU 50 1HG GLU 50 24.082 19.286 1.236
370 HG3 GLU 50 2HG GLU 50 23.392 18.025 2.263
371 H LEU 51 H LEU 51 19.685 17.336 1.649
372 HA LEU 51 HA LEU 51 20.026 17.466 4.575
373 HB2 LEU 51 1HB LEU 51 18.122 18.824 3.952
374 HB3 LEU 51 2HB LEU 51 17.473 17.498 3.012
375 HG LEU 51 HG LEU 51 17.311 16.208 5.161
376 HD11 LEU 51 1HD1 LEU 51 17.244 17.503 7.227
377 HD12 LEU 51 2HD1 LEU 51 17.802 18.926 6.344
378 HD13 LEU 51 3HD1 LEU 51 18.848 17.517 6.496
379 HD21 LEU 51 3HD2 LEU 51 15.711 18.730 4.849
380 HD22 LEU 51 1HD2 LEU 51 15.251 17.312 5.787
381 HD23 LEU 51 2HD2 LEU 51 15.412 17.192 4.035
382 H ALA 52 H ALA 52 19.828 15.356 5.536
383 HA ALA 52 HA ALA 52 18.958 13.268 3.672
384 HB1 ALA 52 1HB ALA 52 20.667 12.960 6.133
385 HB2 ALA 52 2HB ALA 52 21.267 12.946 4.475
386 HB3 ALA 52 3HB ALA 52 20.189 11.667 5.036
387 H LEU 53 H LEU 53 17.284 12.101 4.147
388 HA LEU 53 HA LEU 53 16.132 12.177 6.786
389 HB2 LEU 53 1HB LEU 53 13.841 12.546 5.580
390 HB3 LEU 53 2HB LEU 53 14.844 13.916 6.000
391 HG LEU 53 HG LEU 53 15.637 14.046 3.657
392 HD11 LEU 53 1HD1 LEU 53 14.447 12.865 1.969
393 HD12 LEU 53 2HD1 LEU 53 13.756 11.823 3.213
394 HD13 LEU 53 3HD1 LEU 53 15.526 11.857 2.946
395 HD21 LEU 53 3HD2 LEU 53 13.523 14.658 2.591
396 HD22 LEU 53 1HD2 LEU 53 13.724 15.406 4.201
397 HD23 LEU 53 2HD2 LEU 53 12.687 13.982 3.986
398 H LYS 54 H LYS 54 14.049 10.696 6.660
399 HA LYS 54 HA LYS 54 15.016 8.166 5.634
400 HB2 LYS 54 1HB LYS 54 12.560 8.822 7.252
401 HB3 LYS 54 2HB LYS 54 13.027 7.194 6.779
402 HG2 LYS 54 1HG LYS 54 15.120 7.439 8.041
403 HG3 LYS 54 2HG LYS 54 14.619 9.050 8.543
404 HD2 LYS 54 1HD LYS 54 13.152 6.483 9.168
405 HD3 LYS 54 2HD LYS 54 14.197 7.362 10.284
406 HE2 LYS 54 1HE LYS 54 12.695 9.307 10.118
407 HE3 LYS 54 2HE LYS 54 11.646 8.390 9.042
408 HZ1 LYS 54 3HZ LYS 54 10.828 8.368 11.289
409 HZ2 LYS 54 1HZ LYS 54 12.256 7.681 11.863
410 HZ3 LYS 54 2HZ LYS 54 11.244 6.818 10.817
411 H GLU 55 H GLU 55 13.435 6.671 4.550
412 HA GLU 55 HA GLU 55 12.541 7.627 2.079
413 HB2 GLU 55 1HB GLU 55 13.110 5.340 2.284
414 HB3 GLU 55 2HB GLU 55 12.099 5.125 3.690
415 HG2 GLU 55 1HG GLU 55 10.925 5.614 0.967
416 HG3 GLU 55 2HG GLU 55 11.423 4.008 1.484
417 H SER 56 H SER 56 10.984 7.332 5.127
418 HA SER 56 HA SER 56 8.314 7.451 4.177
419 HB2 SER 56 1HB SER 56 9.372 7.869 6.964
420 HB3 SER 56 2HB SER 56 7.753 7.336 6.497
421 HG SER 56 HG SER 56 9.332 5.649 5.298
422 H ASP 57 H ASP 57 10.677 9.781 4.430
423 HA ASP 57 HA ASP 57 8.737 11.920 4.890
424 HB2 ASP 57 1HB ASP 57 11.738 11.843 5.142
425 HB3 ASP 57 2HB ASP 57 10.887 13.369 4.977
426 H ILE 58 H ILE 58 9.793 10.165 2.396
427 HA ILE 58 HA ILE 58 9.945 12.502 0.621
428 HB ILE 58 HB ILE 58 11.161 9.766 0.133
429 HG12 ILE 58 1HG1 ILE 58 12.415 12.416 0.764
430 HG13 ILE 58 2HG1 ILE 58 12.411 10.972 1.775
431 HG21 ILE 58 1HG2 ILE 58 10.403 10.860 -1.934
432 HG22 ILE 58 2HG2 ILE 58 12.169 10.789 -1.847
433 HG23 ILE 58 3HG2 ILE 58 11.328 12.299 -1.487
434 HD11 ILE 58 3HD1 ILE 58 14.521 11.360 0.663
435 HD12 ILE 58 1HD1 ILE 58 13.744 11.212 -0.909
436 HD13 ILE 58 2HD1 ILE 58 13.808 9.809 0.179
437 H ARG 59 H ARG 59 8.703 12.560 -1.053
438 HA ARG 59 HA ARG 59 7.098 10.209 -1.792
439 HB2 ARG 59 1HB ARG 59 6.129 13.075 -1.600
440 HB3 ARG 59 2HB ARG 59 5.269 11.798 -2.447
441 HG2 ARG 59 1HG ARG 59 5.056 10.562 -0.330
442 HG3 ARG 59 2HG ARG 59 5.860 11.893 0.504
443 HD2 ARG 59 1HD ARG 59 3.380 11.975 0.680
444 HD3 ARG 59 2HD ARG 59 4.075 13.404 -0.083
445 HE ARG 59 HE ARG 59 3.510 12.239 -2.237
446 HH11 ARG 59 1HH1 ARG 59 1.504 11.882 0.656
447 HH12 ARG 59 2HH1 ARG 59 0.096 11.459 -0.186
448 HH21 ARG 59 1HH2 ARG 59 1.588 11.734 -3.416
449 HH22 ARG 59 2HH2 ARG 59 0.143 11.367 -2.601
450 H LEU 60 H LEU 60 6.271 10.525 -4.131
451 HA LEU 60 HA LEU 60 8.514 11.470 -5.700
452 HB2 LEU 60 1HB LEU 60 5.900 10.172 -6.530
453 HB3 LEU 60 2HB LEU 60 7.143 10.661 -7.653
454 HG LEU 60 HG LEU 60 7.465 8.534 -5.528
455 HD11 LEU 60 1HD1 LEU 60 5.959 7.854 -7.337
456 HD12 LEU 60 2HD1 LEU 60 7.486 6.974 -7.403
457 HD13 LEU 60 3HD1 LEU 60 7.188 8.302 -8.522
458 HD21 LEU 60 3HD2 LEU 60 9.316 9.465 -7.725
459 HD22 LEU 60 1HD2 LEU 60 9.560 8.032 -6.726
460 HD23 LEU 60 2HD2 LEU 60 9.571 9.624 -5.983
461 H GLN 61 H GLN 61 7.555 12.578 -7.881
462 HA GLN 61 HA GLN 61 6.984 15.187 -7.212
463 HB2 GLN 61 1HB GLN 61 6.358 15.461 -9.635
464 HB3 GLN 61 2HB GLN 61 7.924 14.732 -9.317
465 HG2 GLN 61 1HG GLN 61 6.943 12.507 -9.714
466 HG3 GLN 61 2HG GLN 61 5.415 13.282 -10.115
467 HE21 GLN 61 2HE2 GLN 61 8.504 14.662 -11.050
468 HE22 GLN 61 1HE2 GLN 61 8.340 14.305 -12.720
469 H SER 62 H SER 62 4.692 12.615 -7.890
470 HA SER 62 HA SER 62 2.726 13.923 -6.345
471 HB2 SER 62 1HB SER 62 2.332 15.083 -8.528
472 HB3 SER 62 2HB SER 62 2.106 13.529 -9.310
473 HG SER 62 HG SER 62 0.505 14.150 -7.096
474 H SER 63 H SER 63 2.541 11.529 -8.997
475 HA SER 63 HA SER 63 2.356 9.452 -6.986
476 HB2 SER 63 1HB SER 63 0.479 8.427 -8.376
477 HB3 SER 63 2HB SER 63 0.049 9.881 -7.475
478 HG SER 63 HG SER 63 -0.032 9.425 -10.105
479 H PHE 64 H PHE 64 2.109 9.785 -10.514
480 HA PHE 64 HA PHE 64 3.368 9.174 -12.241
481 HB2 PHE 64 1HB PHE 64 5.070 10.489 -10.969
482 HB3 PHE 64 2HB PHE 64 5.626 9.004 -10.228
483 HD1 PHE 64 HD2 PHE 64 5.076 10.496 -13.599
484 HD2 PHE 64 HD1 PHE 64 7.438 7.934 -11.159
485 HE1 PHE 64 HE2 PHE 64 6.651 10.177 -15.463
486 HE2 PHE 64 HE1 PHE 64 9.005 7.612 -13.009
487 HZ PHE 64 HZ PHE 64 8.617 8.732 -15.170
488 H LYS 65 H LYS 65 2.176 6.998 -10.371
489 HA LYS 65 HA LYS 65 3.579 4.863 -11.754
490 HB2 LYS 65 1HB LYS 65 4.467 4.978 -9.428
491 HB3 LYS 65 2HB LYS 65 2.849 4.615 -8.837
492 HG2 LYS 65 1HG LYS 65 2.877 2.499 -10.037
493 HG3 LYS 65 2HG LYS 65 4.489 2.856 -10.646
494 HD2 LYS 65 1HD LYS 65 5.301 2.932 -8.307
495 HD3 LYS 65 2HD LYS 65 3.692 2.437 -7.769
496 HE2 LYS 65 1HE LYS 65 3.892 0.392 -9.142
497 HE3 LYS 65 2HE LYS 65 5.504 0.904 -9.615
498 HZ1 LYS 65 3HZ LYS 65 5.553 -0.708 -7.819
499 HZ2 LYS 65 1HZ LYS 65 4.637 0.317 -6.854
500 HZ3 LYS 65 2HZ LYS 65 6.200 0.763 -7.315
501 H GLN 66 H GLN 66 2.121 4.166 -13.080
502 HA GLN 66 HA GLN 66 -0.163 2.810 -12.133
503 HB2 GLN 66 1HB GLN 66 -1.165 5.036 -12.150
504 HB3 GLN 66 2HB GLN 66 -0.589 5.319 -13.785
505 HG2 GLN 66 1HG GLN 66 -2.045 3.561 -14.618
506 HG3 GLN 66 2HG GLN 66 -2.605 3.227 -12.983
507 HE21 GLN 66 2HE2 GLN 66 -4.043 4.620 -12.021
508 HE22 GLN 66 1HE2 GLN 66 -4.871 5.845 -12.896
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -1.876 -1.593 -3.974
2 HA2 GLY 1 2HA GLY 1 -0.690 -3.340 -2.829
3 HA3 GLY 1 1HA GLY 1 -1.244 -3.858 -4.412
4 H ALA 2 H ALA 2 1.076 -4.619 -2.640
5 HA ALA 2 HA ALA 2 3.413 -3.780 -4.063
6 HB1 ALA 2 1HB ALA 2 4.590 -5.382 -2.626
7 HB2 ALA 2 2HB ALA 2 3.046 -5.992 -2.039
8 HB3 ALA 2 3HB ALA 2 3.535 -4.334 -1.683
9 H MET 3 H MET 3 4.397 -4.785 -5.675
10 HA MET 3 HA MET 3 3.444 -7.426 -6.450
11 HB2 MET 3 1HB MET 3 3.837 -5.076 -8.305
12 HB3 MET 3 2HB MET 3 3.678 -6.735 -8.863
13 HG2 MET 3 1HG MET 3 1.461 -6.864 -7.837
14 HG3 MET 3 2HG MET 3 1.625 -5.201 -7.285
15 HE1 MET 3 3HE MET 3 -0.820 -6.341 -8.923
16 HE2 MET 3 1HE MET 3 -1.105 -5.055 -10.096
17 HE3 MET 3 2HE MET 3 -0.732 -4.653 -8.421
18 H GLY 4 H GLY 4 6.097 -5.047 -6.656
19 HA2 GLY 4 1HA GLY 4 8.010 -6.759 -5.845
20 HA3 GLY 4 2HA GLY 4 7.848 -7.159 -7.540
21 H MET 5 H MET 5 8.692 -4.619 -5.267
22 HA MET 5 HA MET 5 10.541 -3.583 -7.305
23 HB2 MET 5 1HB MET 5 9.174 -2.138 -5.039
24 HB3 MET 5 2HB MET 5 10.722 -1.567 -5.625
25 HG2 MET 5 1HG MET 5 8.979 -0.284 -6.631
26 HG3 MET 5 2HG MET 5 9.719 -1.285 -7.869
27 HE1 MET 5 3HE MET 5 5.999 -0.982 -9.033
28 HE2 MET 5 1HE MET 5 7.690 -0.766 -9.488
29 HE3 MET 5 2HE MET 5 6.981 0.253 -8.242
30 HA PRO 6 HA PRO 6 13.423 -5.351 -4.256
31 HB2 PRO 6 1HB PRO 6 15.150 -6.411 -5.987
32 HB3 PRO 6 2HB PRO 6 13.585 -7.188 -5.691
33 HG2 PRO 6 1HG PRO 6 14.429 -5.432 -7.961
34 HG3 PRO 6 2HG PRO 6 13.484 -6.929 -8.003
35 HD2 PRO 6 1HD PRO 6 12.413 -4.382 -8.088
36 HD3 PRO 6 2HD PRO 6 11.524 -5.822 -7.553
37 H ASN 7 H ASN 7 13.505 -2.965 -6.523
38 HA ASN 7 HA ASN 7 16.255 -2.171 -6.175
39 HB2 ASN 7 1HB ASN 7 15.646 -0.176 -7.562
40 HB3 ASN 7 2HB ASN 7 15.288 -1.698 -8.356
41 HD21 ASN 7 2HD2 ASN 7 13.167 -2.184 -8.880
42 HD22 ASN 7 1HD2 ASN 7 11.885 -1.045 -8.687
43 H ARG 8 H ARG 8 16.655 0.162 -5.470
44 HA ARG 8 HA ARG 8 15.789 0.370 -2.819
45 HB2 ARG 8 1HB ARG 8 17.939 1.249 -3.946
46 HB3 ARG 8 2HB ARG 8 17.003 2.663 -4.384
47 HG2 ARG 8 1HG ARG 8 18.117 3.176 -2.426
48 HG3 ARG 8 2HG ARG 8 16.420 2.893 -1.999
49 HD2 ARG 8 1HD ARG 8 17.822 1.810 -0.368
50 HD3 ARG 8 2HD ARG 8 17.025 0.573 -1.331
51 HE ARG 8 HE ARG 8 19.346 0.883 -2.635
52 HH11 ARG 8 1HH1 ARG 8 18.515 0.157 0.710
53 HH12 ARG 8 2HH1 ARG 8 20.094 -0.334 1.151
54 HH21 ARG 8 1HH2 ARG 8 21.537 0.128 -2.047
55 HH22 ARG 8 2HH2 ARG 8 21.810 -0.370 -0.435
56 H LYS 9 H LYS 9 14.416 1.812 -1.821
57 HA LYS 9 HA LYS 9 11.894 2.101 -2.816
58 HB2 LYS 9 1HB LYS 9 12.814 2.449 -0.430
59 HB3 LYS 9 2HB LYS 9 13.030 4.130 -0.901
60 HG2 LYS 9 1HG LYS 9 10.977 4.024 0.238
61 HG3 LYS 9 2HG LYS 9 10.565 4.126 -1.475
62 HD2 LYS 9 1HD LYS 9 9.135 2.453 -0.656
63 HD3 LYS 9 2HD LYS 9 10.449 1.558 -1.409
64 HE2 LYS 9 1HE LYS 9 10.110 2.071 1.568
65 HE3 LYS 9 2HE LYS 9 9.780 0.560 0.743
66 HZ1 LYS 9 3HZ LYS 9 12.426 1.821 1.260
67 HZ2 LYS 9 1HZ LYS 9 12.238 0.494 0.200
68 HZ3 LYS 9 2HZ LYS 9 11.840 0.350 1.801
69 H TYR 10 H TYR 10 14.355 4.625 -2.694
70 HA TYR 10 HA TYR 10 13.169 5.793 -5.091
71 HB2 TYR 10 1HB TYR 10 14.479 7.301 -2.794
72 HB3 TYR 10 2HB TYR 10 13.925 8.031 -4.299
73 HD1 TYR 10 HD2 TYR 10 11.569 8.227 -4.779
74 HD2 TYR 10 HD1 TYR 10 12.925 6.632 -1.096
75 HE1 TYR 10 HE2 TYR 10 9.279 8.436 -3.850
76 HE2 TYR 10 HE1 TYR 10 10.692 6.816 -0.152
77 HH TYR 10 HH TYR 10 7.944 7.416 -2.088
78 H ALA 11 H ALA 11 14.615 6.162 -6.691
79 HA ALA 11 HA ALA 11 17.239 4.988 -6.315
80 HB1 ALA 11 1HB ALA 11 15.942 4.378 -8.297
81 HB2 ALA 11 2HB ALA 11 17.431 5.213 -8.754
82 HB3 ALA 11 3HB ALA 11 15.890 6.070 -8.790
83 H ASP 12 H ASP 12 19.151 6.097 -6.835
84 HA ASP 12 HA ASP 12 19.130 8.783 -5.891
85 HB2 ASP 12 1HB ASP 12 21.613 8.586 -6.029
86 HB3 ASP 12 2HB ASP 12 20.855 7.320 -5.074
87 H GLY 13 H GLY 13 19.499 10.633 -6.927
88 HA2 GLY 13 1HA GLY 13 20.397 11.956 -8.651
89 HA3 GLY 13 2HA GLY 13 20.211 10.604 -9.757
90 H GLU 14 H GLU 14 17.444 10.419 -8.159
91 HA GLU 14 HA GLU 14 16.031 11.592 -10.374
92 HB2 GLU 14 1HB GLU 14 15.557 9.318 -9.609
93 HB3 GLU 14 2HB GLU 14 15.116 9.945 -8.031
94 HG2 GLU 14 1HG GLU 14 13.157 10.982 -8.926
95 HG3 GLU 14 2HG GLU 14 13.703 10.710 -10.576
96 H VAL 15 H VAL 15 14.176 13.089 -10.075
97 HA VAL 15 HA VAL 15 14.585 14.778 -7.744
98 HB VAL 15 HB VAL 15 14.321 15.886 -9.975
99 HG11 VAL 15 1HG1 VAL 15 11.492 14.882 -9.925
100 HG12 VAL 15 2HG1 VAL 15 12.757 14.381 -11.040
101 HG13 VAL 15 3HG1 VAL 15 12.150 16.040 -11.079
102 HG21 VAL 15 3HG2 VAL 15 12.701 17.613 -9.309
103 HG22 VAL 15 1HG2 VAL 15 13.792 17.162 -7.996
104 HG23 VAL 15 2HG2 VAL 15 12.136 16.553 -8.017
105 H VAL 16 H VAL 16 13.253 14.791 -6.045
106 HA VAL 16 HA VAL 16 10.755 13.277 -6.167
107 HB VAL 16 HB VAL 16 11.270 12.254 -3.930
108 HG11 VAL 16 1HG1 VAL 16 12.782 10.492 -4.738
109 HG12 VAL 16 2HG1 VAL 16 13.189 11.493 -6.132
110 HG13 VAL 16 3HG1 VAL 16 11.542 10.895 -5.924
111 HG21 VAL 16 3HG2 VAL 16 14.069 13.267 -4.461
112 HG22 VAL 16 1HG2 VAL 16 13.617 12.148 -3.172
113 HG23 VAL 16 2HG2 VAL 16 12.991 13.794 -3.168
114 H MET 17 H MET 17 9.492 13.702 -4.007
115 HA MET 17 HA MET 17 10.120 16.434 -3.217
116 HB2 MET 17 1HB MET 17 7.426 15.066 -3.316
117 HB3 MET 17 2HB MET 17 7.710 16.617 -2.529
118 HG2 MET 17 1HG MET 17 8.479 17.528 -4.703
119 HG3 MET 17 2HG MET 17 8.067 15.994 -5.458
120 HE1 MET 17 3HE MET 17 6.702 19.148 -3.558
121 HE2 MET 17 1HE MET 17 6.057 17.826 -2.584
122 HE3 MET 17 2HE MET 17 4.968 18.834 -3.526
123 H GLY 18 H GLY 18 10.450 16.840 -1.131
124 HA2 GLY 18 1HA GLY 18 10.226 14.499 0.667
125 HA3 GLY 18 2HA GLY 18 11.609 15.507 0.621
126 H ARG 19 H ARG 19 9.629 14.925 2.701
127 HA ARG 19 HA ARG 19 8.307 17.393 3.336
128 HB2 ARG 19 1HB ARG 19 7.383 15.245 4.043
129 HB3 ARG 19 2HB ARG 19 8.862 14.860 4.894
130 HG2 ARG 19 1HG ARG 19 8.414 16.691 6.471
131 HG3 ARG 19 2HG ARG 19 6.908 17.038 5.617
132 HD2 ARG 19 1HD ARG 19 6.035 14.895 6.133
133 HD3 ARG 19 2HD ARG 19 7.562 14.358 6.861
134 HE ARG 19 HE ARG 19 6.425 16.676 8.073
135 HH11 ARG 19 1HH1 ARG 19 6.316 13.100 8.091
136 HH12 ARG 19 2HH1 ARG 19 5.647 13.005 9.653
137 HH21 ARG 19 1HH2 ARG 19 5.453 16.468 10.263
138 HH22 ARG 19 2HH2 ARG 19 5.144 14.907 10.874
139 H TRP 20 H TRP 20 9.223 19.033 4.451
140 HA TRP 20 HA TRP 20 11.947 18.923 5.175
141 HB2 TRP 20 1HB TRP 20 10.668 21.041 4.620
142 HB3 TRP 20 2HB TRP 20 9.870 20.915 6.177
143 HD1 TRP 20 HD1 TRP 20 11.362 21.499 8.360
144 HE1 TRP 20 HE1 TRP 20 13.584 22.774 8.621
145 HE3 TRP 20 HE3 TRP 20 12.867 21.484 3.492
146 HZ2 TRP 20 HZ2 TRP 20 15.704 23.658 6.961
147 HZ3 TRP 20 HZ3 TRP 20 14.994 22.548 2.902
148 HH2 TRP 20 HH2 TRP 20 16.382 23.602 4.557
149 HA PRO 21 HA PRO 21 11.568 16.276 8.674
150 HB2 PRO 21 1HB PRO 21 13.678 17.407 10.151
151 HB3 PRO 21 2HB PRO 21 13.793 16.072 9.000
152 HG2 PRO 21 1HG PRO 21 14.327 18.973 8.607
153 HG3 PRO 21 2HG PRO 21 15.161 17.574 7.907
154 HD2 PRO 21 1HD PRO 21 13.480 19.017 6.464
155 HD3 PRO 21 2HD PRO 21 13.507 17.247 6.298
156 H GLY 22 H GLY 22 9.844 16.583 9.898
157 HA2 GLY 22 1HA GLY 22 8.958 17.127 12.028
158 HA3 GLY 22 2HA GLY 22 10.057 18.495 12.103
159 H SER 23 H SER 23 9.144 19.134 9.245
160 HA SER 23 HA SER 23 6.892 20.771 10.117
161 HB2 SER 23 1HB SER 23 8.611 20.951 7.646
162 HB3 SER 23 2HB SER 23 7.478 22.172 8.215
163 HG SER 23 HG SER 23 9.199 21.538 10.176
164 H VAL 24 H VAL 24 5.303 21.174 8.149
165 HA VAL 24 HA VAL 24 4.643 18.524 7.048
166 HB VAL 24 HB VAL 24 2.927 19.696 8.464
167 HG11 VAL 24 1HG1 VAL 24 2.796 21.686 6.217
168 HG12 VAL 24 2HG1 VAL 24 3.328 21.987 7.872
169 HG13 VAL 24 3HG1 VAL 24 1.646 21.576 7.549
170 HG21 VAL 24 3HG2 VAL 24 2.182 18.006 6.903
171 HG22 VAL 24 1HG2 VAL 24 2.098 19.199 5.605
172 HG23 VAL 24 2HG2 VAL 24 0.992 19.309 6.976
173 H LEU 25 H LEU 25 6.049 21.419 6.215
174 HA LEU 25 HA LEU 25 5.172 21.925 3.645
175 HB2 LEU 25 1HB LEU 25 7.681 22.471 5.182
176 HB3 LEU 25 2HB LEU 25 7.472 23.005 3.534
177 HG LEU 25 HG LEU 25 7.150 24.692 5.240
178 HD11 LEU 25 1HD1 LEU 25 6.106 25.006 3.054
179 HD12 LEU 25 2HD1 LEU 25 5.045 25.677 4.293
180 HD13 LEU 25 3HD1 LEU 25 4.682 24.108 3.577
181 HD21 LEU 25 3HD2 LEU 25 6.086 23.506 7.015
182 HD22 LEU 25 1HD2 LEU 25 4.663 23.195 6.022
183 HD23 LEU 25 2HD2 LEU 25 5.042 24.843 6.528
184 H TYR 26 H TYR 26 5.478 20.780 1.861
185 HA TYR 26 HA TYR 26 7.715 18.910 1.728
186 HB2 TYR 26 1HB TYR 26 5.068 18.993 0.316
187 HB3 TYR 26 2HB TYR 26 6.424 18.134 -0.394
188 HD1 TYR 26 HD2 TYR 26 4.153 18.236 2.538
189 HD2 TYR 26 HD1 TYR 26 7.104 16.043 0.410
190 HE1 TYR 26 HE2 TYR 26 3.657 16.244 3.906
191 HE2 TYR 26 HE1 TYR 26 6.624 14.065 1.751
192 HH TYR 26 HH TYR 26 3.875 13.848 3.751
193 H TYR 27 H TYR 27 9.278 19.186 0.351
194 HA TYR 27 HA TYR 27 9.064 21.408 -1.553
195 HB2 TYR 27 1HB TYR 27 11.386 20.499 0.120
196 HB3 TYR 27 2HB TYR 27 11.571 21.583 -1.255
197 HD1 TYR 27 HD1 TYR 27 10.345 21.275 2.203
198 HD2 TYR 27 HD2 TYR 27 10.823 23.873 -1.126
199 HE1 TYR 27 HE1 TYR 27 9.892 23.215 3.655
200 HE2 TYR 27 HE2 TYR 27 10.374 25.807 0.301
201 HH TYR 27 HH TYR 27 10.322 25.609 3.699
202 H GLU 28 H GLU 28 10.414 21.138 -3.419
203 HA GLU 28 HA GLU 28 10.512 18.333 -4.224
204 HB2 GLU 28 1HB GLU 28 9.235 19.919 -5.659
205 HB3 GLU 28 2HB GLU 28 10.694 20.860 -5.899
206 HG2 GLU 28 1HG GLU 28 11.719 19.071 -7.120
207 HG3 GLU 28 2HG GLU 28 10.381 17.988 -6.738
208 H VAL 29 H VAL 29 12.427 17.380 -4.437
209 HA VAL 29 HA VAL 29 14.830 19.047 -4.275
210 HB VAL 29 HB VAL 29 15.747 17.500 -2.559
211 HG11 VAL 29 1HG1 VAL 29 13.205 18.878 -1.768
212 HG12 VAL 29 2HG1 VAL 29 14.806 19.615 -1.873
213 HG13 VAL 29 3HG1 VAL 29 14.485 18.371 -0.668
214 HG21 VAL 29 3HG2 VAL 29 14.346 15.556 -2.981
215 HG22 VAL 29 1HG2 VAL 29 12.923 16.442 -2.428
216 HG23 VAL 29 2HG2 VAL 29 14.219 16.053 -1.294
217 H GLN 30 H GLN 30 16.767 17.780 -4.756
218 HA GLN 30 HA GLN 30 16.082 15.537 -6.562
219 HB2 GLN 30 1HB GLN 30 18.519 17.317 -6.471
220 HB3 GLN 30 2HB GLN 30 18.377 15.902 -7.499
221 HG2 GLN 30 1HG GLN 30 16.567 16.915 -8.723
222 HG3 GLN 30 2HG GLN 30 16.559 18.296 -7.624
223 HE21 GLN 30 2HE2 GLN 30 17.043 18.099 -10.531
224 HE22 GLN 30 1HE2 GLN 30 18.586 18.838 -10.784
225 H VAL 31 H VAL 31 16.746 13.520 -5.977
226 HA VAL 31 HA VAL 31 18.110 13.345 -3.479
227 HB VAL 31 HB VAL 31 16.394 11.587 -4.016
228 HG11 VAL 31 1HG1 VAL 31 18.083 10.707 -6.217
229 HG12 VAL 31 2HG1 VAL 31 16.529 11.531 -6.290
230 HG13 VAL 31 3HG1 VAL 31 16.639 9.930 -5.571
231 HG21 VAL 31 3HG2 VAL 31 17.672 9.575 -3.476
232 HG22 VAL 31 1HG2 VAL 31 18.136 10.938 -2.449
233 HG23 VAL 31 2HG2 VAL 31 19.165 10.455 -3.798
234 H THR 32 H THR 32 20.158 13.070 -3.065
235 HA THR 32 HA THR 32 21.909 13.343 -5.411
236 HB THR 32 HB THR 32 22.516 14.338 -2.634
237 HG1 THR 32 HG1 THR 32 20.495 15.062 -4.247
238 HG21 THR 32 3HG2 THR 32 23.222 15.305 -5.398
239 HG22 THR 32 1HG2 THR 32 24.297 14.377 -4.346
240 HG23 THR 32 2HG2 THR 32 23.768 16.004 -3.875
241 H SER 33 H SER 33 21.597 11.909 -2.162
242 HA SER 33 HA SER 33 23.347 9.796 -2.943
243 HB2 SER 33 1HB SER 33 24.929 11.544 -2.054
244 HB3 SER 33 2HB SER 33 24.055 11.516 -0.526
245 HG SER 33 HG SER 33 26.029 9.953 -1.286
246 H TYR 34 H TYR 34 23.561 8.463 -0.679
247 HA TYR 34 HA TYR 34 21.137 8.437 0.810
248 HB2 TYR 34 1HB TYR 34 20.133 7.529 -1.134
249 HB3 TYR 34 2HB TYR 34 21.528 6.521 -1.480
250 HD1 TYR 34 HD2 TYR 34 18.950 6.988 1.196
251 HD2 TYR 34 HD1 TYR 34 21.345 4.288 -1.037
252 HE1 TYR 34 HE2 TYR 34 17.876 5.097 2.329
253 HE2 TYR 34 HE1 TYR 34 20.286 2.408 0.077
254 HH TYR 34 HH TYR 34 19.122 1.993 2.264
255 H ASP 35 H ASP 35 21.598 7.601 2.705
256 HA ASP 35 HA ASP 35 23.950 5.882 3.060
257 HB2 ASP 35 1HB ASP 35 23.600 7.720 4.692
258 HB3 ASP 35 2HB ASP 35 22.015 7.046 5.069
259 H ASP 36 H ASP 36 23.748 3.839 3.077
260 HA ASP 36 HA ASP 36 21.196 2.621 2.564
261 HB2 ASP 36 1HB ASP 36 23.455 2.011 1.535
262 HB3 ASP 36 2HB ASP 36 23.825 1.222 3.059
263 H ALA 37 H ALA 37 23.500 2.757 5.169
264 HA ALA 37 HA ALA 37 22.627 0.646 6.756
265 HB1 ALA 37 1HB ALA 37 24.772 1.806 7.011
266 HB2 ALA 37 2HB ALA 37 23.895 1.664 8.534
267 HB3 ALA 37 3HB ALA 37 23.924 3.203 7.671
268 H SER 38 H SER 38 21.909 4.124 7.147
269 HA SER 38 HA SER 38 19.789 3.301 8.957
270 HB2 SER 38 1HB SER 38 21.130 5.968 8.603
271 HB3 SER 38 2HB SER 38 19.791 5.665 9.722
272 HG SER 38 HG SER 38 22.419 5.105 9.932
273 H HIS 39 H HIS 39 20.033 3.909 5.803
274 HA HIS 39 HA HIS 39 18.545 4.222 4.137
275 HB2 HIS 39 1HB HIS 39 16.417 4.199 6.311
276 HB3 HIS 39 2HB HIS 39 16.120 3.993 4.587
277 HD1 HIS 39 HD1 HIS 39 17.326 2.176 7.631
278 HD2 HIS 39 HD2 HIS 39 16.757 1.454 3.585
279 HE1 HIS 39 HE1 HIS 39 17.507 -0.306 7.337
280 H LEU 40 H LEU 40 19.851 6.359 4.941
281 HA LEU 40 HA LEU 40 17.885 8.552 5.180
282 HB2 LEU 40 1HB LEU 40 20.731 8.348 6.038
283 HB3 LEU 40 2HB LEU 40 20.192 9.906 5.469
284 HG LEU 40 HG LEU 40 20.153 9.765 7.904
285 HD11 LEU 40 1HD1 LEU 40 17.892 10.530 8.317
286 HD12 LEU 40 2HD1 LEU 40 17.392 9.917 6.744
287 HD13 LEU 40 3HD1 LEU 40 18.562 11.233 6.847
288 HD21 LEU 40 3HD2 LEU 40 19.730 7.391 8.176
289 HD22 LEU 40 1HD2 LEU 40 18.096 7.600 7.548
290 HD23 LEU 40 2HD2 LEU 40 18.556 8.353 9.078
291 H TYR 41 H TYR 41 17.410 9.719 3.453
292 HA TYR 41 HA TYR 41 19.085 9.362 1.111
293 HB2 TYR 41 1HB TYR 41 16.268 10.293 1.551
294 HB3 TYR 41 2HB TYR 41 17.117 10.641 0.050
295 HD1 TYR 41 HD1 TYR 41 15.760 7.924 2.178
296 HD2 TYR 41 HD2 TYR 41 17.461 8.994 -1.558
297 HE1 TYR 41 HE1 TYR 41 15.135 5.715 1.249
298 HE2 TYR 41 HE2 TYR 41 16.841 6.817 -2.484
299 HH TYR 41 HH TYR 41 16.303 4.730 -1.842
300 H THR 42 H THR 42 20.444 10.889 0.568
301 HA THR 42 HA THR 42 20.232 13.456 1.918
302 HB THR 42 HB THR 42 22.338 12.480 -0.009
303 HG1 THR 42 HG1 THR 42 21.738 11.577 2.454
304 HG21 THR 42 3HG2 THR 42 23.768 14.101 1.179
305 HG22 THR 42 1HG2 THR 42 22.415 14.526 2.227
306 HG23 THR 42 2HG2 THR 42 22.340 14.895 0.506
307 H VAL 43 H VAL 43 19.446 15.133 0.805
308 HA VAL 43 HA VAL 43 19.091 14.842 -2.085
309 HB VAL 43 HB VAL 43 16.932 16.012 -1.883
310 HG11 VAL 43 1HG1 VAL 43 17.093 13.510 -0.203
311 HG12 VAL 43 2HG1 VAL 43 16.855 13.590 -1.951
312 HG13 VAL 43 3HG1 VAL 43 15.611 14.193 -0.863
313 HG21 VAL 43 3HG2 VAL 43 17.316 17.254 0.187
314 HG22 VAL 43 1HG2 VAL 43 17.326 15.747 1.103
315 HG23 VAL 43 2HG2 VAL 43 15.846 16.290 0.319
316 H LYS 44 H LYS 44 18.961 16.831 -3.181
317 HA LYS 44 HA LYS 44 20.448 18.995 -1.885
318 HB2 LYS 44 1HB LYS 44 21.376 17.883 -3.928
319 HB3 LYS 44 2HB LYS 44 19.965 18.418 -4.817
320 HG2 LYS 44 1HG LYS 44 20.619 20.771 -4.320
321 HG3 LYS 44 2HG LYS 44 22.102 20.154 -3.591
322 HD2 LYS 44 1HD LYS 44 21.239 19.736 -6.462
323 HD3 LYS 44 2HD LYS 44 22.468 20.873 -5.915
324 HE2 LYS 44 1HE LYS 44 23.836 19.000 -5.119
325 HE3 LYS 44 2HE LYS 44 22.596 17.862 -5.639
326 HZ1 LYS 44 3HZ LYS 44 22.916 18.633 -7.918
327 HZ2 LYS 44 1HZ LYS 44 24.348 18.023 -7.292
328 HZ3 LYS 44 2HZ LYS 44 24.110 19.691 -7.429
329 H TYR 45 H TYR 45 19.444 20.881 -1.588
330 HA TYR 45 HA TYR 45 16.733 21.251 -2.567
331 HB2 TYR 45 1HB TYR 45 18.300 22.395 -0.297
332 HB3 TYR 45 2HB TYR 45 16.970 23.341 -0.936
333 HD1 TYR 45 HD1 TYR 45 17.903 20.283 0.855
334 HD2 TYR 45 HD2 TYR 45 14.709 22.638 -0.658
335 HE1 TYR 45 HE1 TYR 45 16.301 18.971 2.184
336 HE2 TYR 45 HE2 TYR 45 13.109 21.352 0.629
337 HH TYR 45 HH TYR 45 14.059 19.201 3.120
338 H LYS 46 H LYS 46 16.112 23.401 -3.158
339 HA LYS 46 HA LYS 46 17.426 24.427 -5.403
340 HB2 LYS 46 1HB LYS 46 15.022 24.606 -4.962
341 HB3 LYS 46 2HB LYS 46 15.345 25.631 -3.579
342 HG2 LYS 46 1HG LYS 46 16.231 27.351 -5.102
343 HG3 LYS 46 2HG LYS 46 15.816 26.310 -6.470
344 HD2 LYS 46 1HD LYS 46 13.465 26.349 -5.805
345 HD3 LYS 46 2HD LYS 46 13.865 27.350 -4.413
346 HE2 LYS 46 1HE LYS 46 14.653 29.113 -5.916
347 HE3 LYS 46 2HE LYS 46 14.224 28.113 -7.307
348 HZ1 LYS 46 3HZ LYS 46 12.496 29.757 -6.788
349 HZ2 LYS 46 1HZ LYS 46 12.348 29.119 -5.250
350 HZ3 LYS 46 2HZ LYS 46 11.900 28.194 -6.571
351 H ASP 47 H ASP 47 17.682 25.114 -2.053
352 HA ASP 47 HA ASP 47 18.978 27.691 -2.261
353 HB2 ASP 47 1HB ASP 47 18.700 25.824 0.089
354 HB3 ASP 47 2HB ASP 47 19.272 27.481 0.161
355 H GLY 48 H GLY 48 20.013 24.639 -2.873
356 HA2 GLY 48 1HA GLY 48 22.201 24.075 -3.413
357 HA3 GLY 48 2HA GLY 48 22.787 25.397 -2.401
358 H THR 49 H THR 49 21.130 24.660 -0.174
359 HA THR 49 HA THR 49 22.785 23.132 1.391
360 HB THR 49 HB THR 49 19.800 23.397 1.665
361 HG1 THR 49 HG1 THR 49 21.854 25.250 2.345
362 HG21 THR 49 3HG2 THR 49 20.892 21.960 3.344
363 HG22 THR 49 1HG2 THR 49 20.309 23.455 4.075
364 HG23 THR 49 2HG2 THR 49 22.025 23.256 3.723
365 H GLU 50 H GLU 50 23.117 20.919 1.516
366 HA GLU 50 HA GLU 50 21.093 19.189 0.325
367 HB2 GLU 50 1HB GLU 50 23.654 18.274 1.640
368 HB3 GLU 50 2HB GLU 50 22.668 17.403 0.484
369 HG2 GLU 50 1HG GLU 50 24.403 17.987 -0.863
370 HG3 GLU 50 2HG GLU 50 23.388 19.411 -1.085
371 H LEU 51 H LEU 51 20.136 17.572 1.553
372 HA LEU 51 HA LEU 51 20.367 17.818 4.473
373 HB2 LEU 51 1HB LEU 51 18.499 19.242 3.662
374 HB3 LEU 51 2HB LEU 51 17.794 17.824 2.921
375 HG LEU 51 HG LEU 51 17.548 16.815 5.170
376 HD11 LEU 51 1HD1 LEU 51 19.309 18.008 6.318
377 HD12 LEU 51 2HD1 LEU 51 17.765 18.254 7.134
378 HD13 LEU 51 3HD1 LEU 51 18.440 19.528 6.109
379 HD21 LEU 51 3HD2 LEU 51 15.684 17.940 4.120
380 HD22 LEU 51 1HD2 LEU 51 16.237 19.498 4.744
381 HD23 LEU 51 2HD2 LEU 51 15.680 18.249 5.856
382 H ALA 52 H ALA 52 19.831 15.810 5.566
383 HA ALA 52 HA ALA 52 19.250 13.633 3.708
384 HB1 ALA 52 1HB ALA 52 20.192 12.129 5.397
385 HB2 ALA 52 2HB ALA 52 20.495 13.491 6.468
386 HB3 ALA 52 3HB ALA 52 21.379 13.356 4.952
387 H LEU 53 H LEU 53 17.442 12.560 3.992
388 HA LEU 53 HA LEU 53 15.962 12.813 6.451
389 HB2 LEU 53 1HB LEU 53 13.835 13.085 4.984
390 HB3 LEU 53 2HB LEU 53 14.781 14.483 5.435
391 HG LEU 53 HG LEU 53 15.780 14.548 3.180
392 HD11 LEU 53 1HD1 LEU 53 13.995 12.254 2.570
393 HD12 LEU 53 2HD1 LEU 53 15.781 12.233 2.645
394 HD13 LEU 53 3HD1 LEU 53 14.936 13.201 1.421
395 HD21 LEU 53 3HD2 LEU 53 13.724 15.024 1.916
396 HD22 LEU 53 1HD2 LEU 53 13.761 15.806 3.523
397 HD23 LEU 53 2HD2 LEU 53 12.832 14.319 3.267
398 H LYS 54 H LYS 54 14.017 11.308 6.397
399 HA LYS 54 HA LYS 54 15.133 8.785 5.525
400 HB2 LYS 54 1HB LYS 54 12.732 9.368 7.253
401 HB3 LYS 54 2HB LYS 54 13.274 7.752 6.802
402 HG2 LYS 54 1HG LYS 54 15.432 8.194 7.891
403 HG3 LYS 54 2HG LYS 54 14.831 9.773 8.392
404 HD2 LYS 54 1HD LYS 54 13.041 8.667 9.667
405 HD3 LYS 54 2HD LYS 54 13.677 7.099 9.174
406 HE2 LYS 54 1HE LYS 54 15.778 7.561 10.270
407 HE3 LYS 54 2HE LYS 54 15.220 9.167 10.723
408 HZ1 LYS 54 3HZ LYS 54 13.477 8.089 12.059
409 HZ2 LYS 54 1HZ LYS 54 15.028 7.655 12.565
410 HZ3 LYS 54 2HZ LYS 54 14.104 6.580 11.665
411 H GLU 55 H GLU 55 13.773 7.177 4.470
412 HA GLU 55 HA GLU 55 12.617 8.148 2.113
413 HB2 GLU 55 1HB GLU 55 11.624 5.775 1.942
414 HB3 GLU 55 2HB GLU 55 13.369 5.945 1.937
415 HG2 GLU 55 1HG GLU 55 13.515 5.249 4.205
416 HG3 GLU 55 2HG GLU 55 11.767 5.351 4.394
417 H SER 56 H SER 56 11.138 7.450 5.219
418 HA SER 56 HA SER 56 8.468 7.608 4.249
419 HB2 SER 56 1HB SER 56 9.003 6.400 6.327
420 HB3 SER 56 2HB SER 56 9.506 7.911 7.086
421 HG SER 56 HG SER 56 7.172 8.482 6.303
422 H ASP 57 H ASP 57 10.820 9.953 4.576
423 HA ASP 57 HA ASP 57 8.856 12.031 5.079
424 HB2 ASP 57 1HB ASP 57 11.872 12.159 4.808
425 HB3 ASP 57 2HB ASP 57 10.859 13.591 4.922
426 H ILE 58 H ILE 58 10.099 10.264 2.535
427 HA ILE 58 HA ILE 58 9.928 12.521 0.693
428 HB ILE 58 HB ILE 58 11.031 9.730 0.244
429 HG12 ILE 58 1HG1 ILE 58 12.384 12.394 0.600
430 HG13 ILE 58 2HG1 ILE 58 12.388 11.053 1.740
431 HG21 ILE 58 1HG2 ILE 58 10.136 10.687 -1.832
432 HG22 ILE 58 2HG2 ILE 58 11.897 10.611 -1.884
433 HG23 ILE 58 3HG2 ILE 58 11.088 12.149 -1.575
434 HD11 ILE 58 3HD1 ILE 58 14.441 11.301 0.505
435 HD12 ILE 58 1HD1 ILE 58 13.599 11.008 -1.011
436 HD13 ILE 58 2HD1 ILE 58 13.694 9.720 0.208
437 H ARG 59 H ARG 59 8.537 12.594 -0.917
438 HA ARG 59 HA ARG 59 6.796 10.282 -1.435
439 HB2 ARG 59 1HB ARG 59 5.858 13.162 -1.434
440 HB3 ARG 59 2HB ARG 59 4.915 11.800 -2.006
441 HG2 ARG 59 1HG ARG 59 5.038 10.911 0.360
442 HG3 ARG 59 2HG ARG 59 5.708 12.488 0.796
443 HD2 ARG 59 1HD ARG 59 2.991 11.907 -0.386
444 HD3 ARG 59 2HD ARG 59 3.352 12.559 1.210
445 HE ARG 59 HE ARG 59 4.222 14.124 -1.087
446 HH11 ARG 59 1HH1 ARG 59 1.744 13.741 1.431
447 HH12 ARG 59 2HH1 ARG 59 1.168 15.337 1.254
448 HH21 ARG 59 1HH2 ARG 59 3.333 16.261 -1.355
449 HH22 ARG 59 2HH2 ARG 59 2.056 16.771 -0.345
450 H LEU 60 H LEU 60 5.766 10.563 -3.598
451 HA LEU 60 HA LEU 60 7.736 11.438 -5.528
452 HB2 LEU 60 1HB LEU 60 4.996 10.190 -5.848
453 HB3 LEU 60 2HB LEU 60 6.099 10.506 -7.169
454 HG LEU 60 HG LEU 60 6.652 8.608 -4.883
455 HD11 LEU 60 1HD1 LEU 60 6.349 6.849 -6.546
456 HD12 LEU 60 2HD1 LEU 60 5.837 8.056 -7.729
457 HD13 LEU 60 3HD1 LEU 60 4.876 7.777 -6.274
458 HD21 LEU 60 3HD2 LEU 60 8.160 9.130 -7.444
459 HD22 LEU 60 1HD2 LEU 60 8.529 7.865 -6.274
460 HD23 LEU 60 2HD2 LEU 60 8.693 9.558 -5.820
461 H GLN 61 H GLN 61 6.113 12.362 -7.560
462 HA GLN 61 HA GLN 61 5.743 15.028 -7.125
463 HB2 GLN 61 1HB GLN 61 3.904 14.700 -9.091
464 HB3 GLN 61 2HB GLN 61 5.632 14.725 -9.365
465 HG2 GLN 61 1HG GLN 61 4.600 12.911 -10.601
466 HG3 GLN 61 2HG GLN 61 5.674 12.263 -9.380
467 HE21 GLN 61 2HE2 GLN 61 4.732 10.288 -9.286
468 HE22 GLN 61 1HE2 GLN 61 3.159 9.986 -8.679
469 H SER 62 H SER 62 3.387 12.563 -6.486
470 HA SER 62 HA SER 62 1.944 14.377 -4.747
471 HB2 SER 62 1HB SER 62 0.496 12.746 -6.866
472 HB3 SER 62 2HB SER 62 -0.223 13.868 -5.713
473 HG SER 62 HG SER 62 1.350 14.404 -7.989
474 H SER 63 H SER 63 1.616 11.192 -6.304
475 HA SER 63 HA SER 63 2.318 9.766 -3.973
476 HB2 SER 63 1HB SER 63 -0.546 9.715 -4.991
477 HB3 SER 63 2HB SER 63 0.120 8.512 -3.888
478 HG SER 63 HG SER 63 0.588 11.055 -3.071
479 H PHE 64 H PHE 64 1.780 7.317 -4.603
480 HA PHE 64 HA PHE 64 3.246 6.839 -7.011
481 HB2 PHE 64 1HB PHE 64 3.490 5.532 -4.887
482 HB3 PHE 64 2HB PHE 64 1.872 4.902 -5.135
483 HD1 PHE 64 HD2 PHE 64 5.335 4.861 -6.323
484 HD2 PHE 64 HD1 PHE 64 1.468 3.137 -6.724
485 HE1 PHE 64 HE2 PHE 64 6.303 2.999 -7.604
486 HE2 PHE 64 HE1 PHE 64 2.432 1.271 -8.000
487 HZ PHE 64 HZ PHE 64 4.852 1.202 -8.438
488 H LYS 65 H LYS 65 2.346 6.841 -8.927
489 HA LYS 65 HA LYS 65 -0.487 6.229 -9.237
490 HB2 LYS 65 1HB LYS 65 0.357 8.313 -10.260
491 HB3 LYS 65 2HB LYS 65 1.533 7.389 -11.178
492 HG2 LYS 65 1HG LYS 65 -0.314 6.255 -12.355
493 HG3 LYS 65 2HG LYS 65 -1.464 7.247 -11.464
494 HD2 LYS 65 1HD LYS 65 -0.492 9.268 -12.451
495 HD3 LYS 65 2HD LYS 65 0.678 8.277 -13.328
496 HE2 LYS 65 1HE LYS 65 -1.171 7.153 -14.494
497 HE3 LYS 65 2HE LYS 65 -2.320 8.172 -13.631
498 HZ1 LYS 65 3HZ LYS 65 -1.325 10.112 -14.717
499 HZ2 LYS 65 1HZ LYS 65 -1.905 9.005 -15.843
500 HZ3 LYS 65 2HZ LYS 65 -0.259 9.117 -15.551
501 H GLN 66 H GLN 66 -0.929 4.168 -9.640
502 HA GLN 66 HA GLN 66 1.006 2.548 -11.143
503 HB2 GLN 66 1HB GLN 66 0.191 2.034 -8.651
504 HB3 GLN 66 2HB GLN 66 -1.228 1.426 -9.469
505 HG2 GLN 66 1HG GLN 66 1.588 0.427 -9.894
506 HG3 GLN 66 2HG GLN 66 0.394 -0.336 -8.864
507 HE21 GLN 66 2HE2 GLN 66 1.847 -1.453 -11.038
508 HE22 GLN 66 1HE2 GLN 66 0.703 -1.997 -12.202
Start of MODEL 8
1 H1 GLY 1 H GLY 1 4.497 5.611 0.950
2 HA2 GLY 1 2HA GLY 1 4.477 6.317 3.811
3 HA3 GLY 1 1HA GLY 1 3.492 5.067 3.058
4 H ALA 2 H ALA 2 4.847 3.990 4.910
5 HA ALA 2 HA ALA 2 7.250 2.855 3.653
6 HB1 ALA 2 1HB ALA 2 7.865 4.244 5.560
7 HB2 ALA 2 2HB ALA 2 8.161 2.541 5.908
8 HB3 ALA 2 3HB ALA 2 6.746 3.347 6.586
9 H MET 3 H MET 3 7.042 0.755 3.259
10 HA MET 3 HA MET 3 5.544 -0.925 5.087
11 HB2 MET 3 1HB MET 3 4.911 -0.766 2.131
12 HB3 MET 3 2HB MET 3 4.440 -2.104 3.161
13 HG2 MET 3 1HG MET 3 3.066 -0.606 4.489
14 HG3 MET 3 2HG MET 3 3.561 0.752 3.480
15 HE1 MET 3 3HE MET 3 -0.192 0.187 2.493
16 HE2 MET 3 1HE MET 3 1.001 1.349 3.073
17 HE3 MET 3 2HE MET 3 0.539 -0.013 4.087
18 H GLY 4 H GLY 4 6.742 -2.577 5.539
19 HA2 GLY 4 1HA GLY 4 7.846 -4.549 5.109
20 HA3 GLY 4 2HA GLY 4 7.997 -4.079 3.424
21 H MET 5 H MET 5 9.687 -2.487 2.940
22 HA MET 5 HA MET 5 12.026 -2.751 4.737
23 HB2 MET 5 1HB MET 5 11.928 -3.345 1.772
24 HB3 MET 5 2HB MET 5 13.393 -3.212 2.709
25 HG2 MET 5 1HG MET 5 12.787 -5.203 3.957
26 HG3 MET 5 2HG MET 5 11.258 -5.303 3.074
27 HE1 MET 5 3HE MET 5 11.941 -7.849 2.445
28 HE2 MET 5 1HE MET 5 13.500 -7.673 3.242
29 HE3 MET 5 2HE MET 5 13.427 -8.270 1.587
30 HA PRO 6 HA PRO 6 12.886 1.314 2.749
31 HB2 PRO 6 1HB PRO 6 15.751 0.666 2.889
32 HB3 PRO 6 2HB PRO 6 14.894 1.974 3.712
33 HG2 PRO 6 1HG PRO 6 15.922 -0.148 5.041
34 HG3 PRO 6 2HG PRO 6 14.460 0.698 5.574
35 HD2 PRO 6 1HD PRO 6 14.733 -1.884 4.104
36 HD3 PRO 6 2HD PRO 6 13.603 -1.444 5.407
37 H ASN 7 H ASN 7 12.308 0.835 0.671
38 HA ASN 7 HA ASN 7 13.447 -1.511 -0.626
39 HB2 ASN 7 1HB ASN 7 11.342 0.397 -1.621
40 HB3 ASN 7 2HB ASN 7 11.829 -1.082 -2.430
41 HD21 ASN 7 2HD2 ASN 7 11.264 -3.092 -1.474
42 HD22 ASN 7 1HD2 ASN 7 9.977 -3.159 -0.334
43 H ARG 8 H ARG 8 14.359 1.686 -0.549
44 HA ARG 8 HA ARG 8 15.321 3.126 -1.803
45 HB2 ARG 8 1HB ARG 8 17.115 1.370 -2.276
46 HB3 ARG 8 2HB ARG 8 16.185 0.887 -3.698
47 HG2 ARG 8 1HG ARG 8 16.300 3.274 -4.430
48 HG3 ARG 8 2HG ARG 8 17.458 3.515 -3.135
49 HD2 ARG 8 1HD ARG 8 17.847 1.503 -5.363
50 HD3 ARG 8 2HD ARG 8 18.428 3.159 -5.432
51 HE ARG 8 HE ARG 8 19.327 1.360 -3.289
52 HH11 ARG 8 1HH1 ARG 8 20.063 3.322 -6.169
53 HH12 ARG 8 2HH1 ARG 8 21.742 3.285 -5.952
54 HH21 ARG 8 1HH2 ARG 8 21.661 1.265 -3.024
55 HH22 ARG 8 2HH2 ARG 8 22.687 2.055 -4.125
56 H LYS 9 H LYS 9 13.074 3.315 -1.843
57 HA LYS 9 HA LYS 9 11.507 2.718 -4.150
58 HB2 LYS 9 1HB LYS 9 10.704 3.000 -1.825
59 HB3 LYS 9 2HB LYS 9 11.066 4.712 -1.934
60 HG2 LYS 9 1HG LYS 9 9.393 4.947 -3.693
61 HG3 LYS 9 2HG LYS 9 9.033 3.220 -3.580
62 HD2 LYS 9 1HD LYS 9 8.714 5.250 -1.366
63 HD3 LYS 9 2HD LYS 9 7.409 4.544 -2.313
64 HE2 LYS 9 1HE LYS 9 9.266 3.073 -0.411
65 HE3 LYS 9 2HE LYS 9 7.575 3.452 -0.141
66 HZ1 LYS 9 3HZ LYS 9 8.604 1.624 -2.253
67 HZ2 LYS 9 1HZ LYS 9 6.981 2.005 -1.995
68 HZ3 LYS 9 2HZ LYS 9 7.847 1.169 -0.831
69 H TYR 10 H TYR 10 13.724 5.099 -3.280
70 HA TYR 10 HA TYR 10 13.020 6.710 -5.590
71 HB2 TYR 10 1HB TYR 10 14.220 7.702 -2.975
72 HB3 TYR 10 2HB TYR 10 13.725 8.695 -4.347
73 HD1 TYR 10 HD1 TYR 10 11.241 8.681 -4.982
74 HD2 TYR 10 HD2 TYR 10 12.675 7.199 -1.277
75 HE1 TYR 10 HE1 TYR 10 8.954 8.824 -4.049
76 HE2 TYR 10 HE2 TYR 10 10.404 7.328 -0.328
77 HH TYR 10 HH TYR 10 8.315 8.614 -0.760
78 H ALA 11 H ALA 11 14.734 7.197 -6.822
79 HA ALA 11 HA ALA 11 16.987 5.377 -6.605
80 HB1 ALA 11 1HB ALA 11 16.284 7.421 -8.716
81 HB2 ALA 11 2HB ALA 11 15.775 5.739 -8.714
82 HB3 ALA 11 3HB ALA 11 17.482 6.139 -8.880
83 H ASP 12 H ASP 12 18.891 7.083 -8.016
84 HA ASP 12 HA ASP 12 19.358 9.199 -6.076
85 HB2 ASP 12 1HB ASP 12 21.795 8.879 -6.198
86 HB3 ASP 12 2HB ASP 12 21.026 7.408 -5.648
87 H GLY 13 H GLY 13 19.589 11.162 -6.903
88 HA2 GLY 13 1HA GLY 13 20.088 12.748 -8.518
89 HA3 GLY 13 2HA GLY 13 20.180 11.480 -9.736
90 H GLU 14 H GLU 14 17.539 10.776 -8.002
91 HA GLU 14 HA GLU 14 15.798 11.599 -10.115
92 HB2 GLU 14 1HB GLU 14 15.634 9.352 -9.260
93 HB3 GLU 14 2HB GLU 14 15.418 9.930 -7.621
94 HG2 GLU 14 1HG GLU 14 13.228 10.776 -8.180
95 HG3 GLU 14 2HG GLU 14 13.480 10.355 -9.872
96 H VAL 15 H VAL 15 14.240 13.208 -9.970
97 HA VAL 15 HA VAL 15 14.404 14.784 -7.545
98 HB VAL 15 HB VAL 15 14.481 16.054 -9.641
99 HG11 VAL 15 1HG1 VAL 15 12.585 16.235 -11.146
100 HG12 VAL 15 2HG1 VAL 15 11.755 14.962 -10.249
101 HG13 VAL 15 3HG1 VAL 15 13.256 14.605 -11.108
102 HG21 VAL 15 3HG2 VAL 15 11.904 16.541 -8.164
103 HG22 VAL 15 1HG2 VAL 15 12.693 17.692 -9.241
104 HG23 VAL 15 2HG2 VAL 15 13.489 17.190 -7.749
105 H VAL 16 H VAL 16 12.980 14.805 -6.019
106 HA VAL 16 HA VAL 16 10.419 13.427 -6.308
107 HB VAL 16 HB VAL 16 10.818 12.305 -4.081
108 HG11 VAL 16 1HG1 VAL 16 11.080 11.017 -6.126
109 HG12 VAL 16 2HG1 VAL 16 12.292 10.527 -4.939
110 HG13 VAL 16 3HG1 VAL 16 12.745 11.576 -6.279
111 HG21 VAL 16 3HG2 VAL 16 13.139 12.062 -3.297
112 HG22 VAL 16 1HG2 VAL 16 12.598 13.742 -3.249
113 HG23 VAL 16 2HG2 VAL 16 13.667 13.194 -4.540
114 H MET 17 H MET 17 9.310 13.722 -3.922
115 HA MET 17 HA MET 17 9.855 16.484 -3.106
116 HB2 MET 17 1HB MET 17 7.283 14.899 -2.784
117 HB3 MET 17 2HB MET 17 7.568 16.503 -2.134
118 HG2 MET 17 1HG MET 17 7.847 17.346 -4.434
119 HG3 MET 17 2HG MET 17 7.461 15.736 -5.035
120 HE1 MET 17 3HE MET 17 6.156 18.976 -3.343
121 HE2 MET 17 1HE MET 17 5.879 17.829 -2.036
122 HE3 MET 17 2HE MET 17 4.508 18.558 -2.874
123 H GLY 18 H GLY 18 10.463 16.772 -1.042
124 HA2 GLY 18 1HA GLY 18 10.366 14.402 0.732
125 HA3 GLY 18 2HA GLY 18 11.797 15.364 0.574
126 H ARG 19 H ARG 19 9.841 14.917 2.864
127 HA ARG 19 HA ARG 19 8.595 17.485 3.191
128 HB2 ARG 19 1HB ARG 19 7.668 15.422 4.182
129 HB3 ARG 19 2HB ARG 19 9.078 15.322 5.231
130 HG2 ARG 19 1HG ARG 19 8.441 17.556 6.149
131 HG3 ARG 19 2HG ARG 19 6.946 17.442 5.224
132 HD2 ARG 19 1HD ARG 19 6.609 16.740 7.519
133 HD3 ARG 19 2HD ARG 19 6.378 15.393 6.403
134 HE ARG 19 HE ARG 19 8.577 14.610 7.013
135 HH11 ARG 19 1HH1 ARG 19 7.427 17.231 9.109
136 HH12 ARG 19 2HH1 ARG 19 8.086 16.597 10.526
137 HH21 ARG 19 1HH2 ARG 19 9.493 13.725 8.909
138 HH22 ARG 19 2HH2 ARG 19 9.354 14.491 10.430
139 H TRP 20 H TRP 20 9.215 19.160 4.431
140 HA TRP 20 HA TRP 20 11.996 19.264 5.151
141 HB2 TRP 20 1HB TRP 20 10.658 21.252 4.251
142 HB3 TRP 20 2HB TRP 20 9.815 21.284 5.796
143 HD1 TRP 20 HD1 TRP 20 11.191 22.202 7.922
144 HE1 TRP 20 HE1 TRP 20 13.369 23.590 8.086
145 HE3 TRP 20 HE3 TRP 20 12.887 21.662 3.152
146 HZ2 TRP 20 HZ2 TRP 20 15.510 24.325 6.426
147 HZ3 TRP 20 HZ3 TRP 20 14.996 22.739 2.514
148 HH2 TRP 20 HH2 TRP 20 16.275 24.040 4.079
149 HA PRO 21 HA PRO 21 11.096 17.074 8.973
150 HB2 PRO 21 1HB PRO 21 13.344 17.961 10.350
151 HB3 PRO 21 2HB PRO 21 13.290 16.558 9.278
152 HG2 PRO 21 1HG PRO 21 14.173 19.357 8.686
153 HG3 PRO 21 2HG PRO 21 14.903 17.823 8.177
154 HD2 PRO 21 1HD PRO 21 13.463 19.220 6.477
155 HD3 PRO 21 2HD PRO 21 13.265 17.457 6.543
156 H GLY 22 H GLY 22 11.706 20.485 8.924
157 HA2 GLY 22 1HA GLY 22 10.955 20.892 11.670
158 HA3 GLY 22 2HA GLY 22 11.251 22.151 10.479
159 H SER 23 H SER 23 9.325 21.011 8.552
160 HA SER 23 HA SER 23 6.934 21.968 9.920
161 HB2 SER 23 1HB SER 23 6.268 22.772 7.629
162 HB3 SER 23 2HB SER 23 7.695 23.574 8.275
163 HG SER 23 HG SER 23 8.581 22.984 6.469
164 H VAL 24 H VAL 24 5.092 21.279 7.953
165 HA VAL 24 HA VAL 24 5.333 18.358 7.880
166 HB VAL 24 HB VAL 24 2.836 18.306 7.797
167 HG11 VAL 24 1HG1 VAL 24 3.988 19.753 10.187
168 HG12 VAL 24 2HG1 VAL 24 3.976 18.008 9.936
169 HG13 VAL 24 3HG1 VAL 24 2.458 18.876 10.159
170 HG21 VAL 24 3HG2 VAL 24 2.427 20.520 6.872
171 HG22 VAL 24 1HG2 VAL 24 3.085 21.263 8.331
172 HG23 VAL 24 2HG2 VAL 24 1.594 20.342 8.421
173 H LEU 25 H LEU 25 6.018 20.714 5.991
174 HA LEU 25 HA LEU 25 4.308 20.064 3.729
175 HB2 LEU 25 1HB LEU 25 6.317 22.199 4.119
176 HB3 LEU 25 2HB LEU 25 5.446 21.906 2.624
177 HG LEU 25 HG LEU 25 4.459 22.987 5.228
178 HD11 LEU 25 1HD1 LEU 25 5.232 24.464 3.499
179 HD12 LEU 25 2HD1 LEU 25 3.444 24.566 3.641
180 HD13 LEU 25 3HD1 LEU 25 4.206 23.567 2.376
181 HD21 LEU 25 3HD2 LEU 25 2.941 21.162 4.720
182 HD22 LEU 25 1HD2 LEU 25 2.777 21.752 3.061
183 HD23 LEU 25 2HD2 LEU 25 2.162 22.720 4.412
184 H TYR 26 H TYR 26 4.988 19.346 1.843
185 HA TYR 26 HA TYR 26 7.635 18.132 1.759
186 HB2 TYR 26 1HB TYR 26 5.062 17.507 0.310
187 HB3 TYR 26 2HB TYR 26 6.615 16.886 -0.237
188 HD1 TYR 26 HD2 TYR 26 4.405 16.954 2.789
189 HD2 TYR 26 HD1 TYR 26 7.434 14.907 0.612
190 HE1 TYR 26 HE2 TYR 26 4.259 15.067 4.363
191 HE2 TYR 26 HE1 TYR 26 7.295 13.024 2.169
192 HH TYR 26 HH TYR 26 6.585 12.633 4.512
193 H TYR 27 H TYR 27 9.110 18.898 0.542
194 HA TYR 27 HA TYR 27 8.366 20.961 -1.405
195 HB2 TYR 27 1HB TYR 27 10.846 20.650 0.290
196 HB3 TYR 27 2HB TYR 27 10.691 21.844 -0.998
197 HD1 TYR 27 HD2 TYR 27 9.288 20.775 2.274
198 HD2 TYR 27 HD1 TYR 27 9.652 23.939 -0.547
199 HE1 TYR 27 HE2 TYR 27 8.277 22.329 3.891
200 HE2 TYR 27 HE1 TYR 27 8.649 25.498 1.078
201 HH TYR 27 HH TYR 27 7.233 25.445 3.047
202 H GLU 28 H GLU 28 9.760 21.025 -3.271
203 HA GLU 28 HA GLU 28 10.234 18.352 -4.218
204 HB2 GLU 28 1HB GLU 28 9.145 20.071 -5.633
205 HB3 GLU 28 2HB GLU 28 10.633 21.004 -5.619
206 HG2 GLU 28 1HG GLU 28 11.782 19.255 -6.815
207 HG3 GLU 28 2HG GLU 28 10.348 18.231 -6.747
208 H VAL 29 H VAL 29 12.151 17.371 -4.306
209 HA VAL 29 HA VAL 29 14.598 18.925 -3.848
210 HB VAL 29 HB VAL 29 15.397 17.267 -2.231
211 HG11 VAL 29 1HG1 VAL 29 14.276 19.204 -1.342
212 HG12 VAL 29 2HG1 VAL 29 13.954 17.789 -0.339
213 HG13 VAL 29 3HG1 VAL 29 12.722 18.380 -1.455
214 HG21 VAL 29 3HG2 VAL 29 13.893 15.582 -1.264
215 HG22 VAL 29 1HG2 VAL 29 14.170 15.316 -2.987
216 HG23 VAL 29 2HG2 VAL 29 12.654 16.033 -2.440
217 H GLN 30 H GLN 30 16.519 17.643 -4.412
218 HA GLN 30 HA GLN 30 15.873 15.531 -6.365
219 HB2 GLN 30 1HB GLN 30 18.429 17.099 -6.005
220 HB3 GLN 30 2HB GLN 30 18.045 15.999 -7.320
221 HG2 GLN 30 1HG GLN 30 16.413 17.506 -8.180
222 HG3 GLN 30 2HG GLN 30 16.570 18.576 -6.791
223 HE21 GLN 30 2HE2 GLN 30 17.943 17.515 -9.742
224 HE22 GLN 30 1HE2 GLN 30 19.194 18.706 -9.829
225 H VAL 31 H VAL 31 16.475 13.508 -5.692
226 HA VAL 31 HA VAL 31 17.916 13.236 -3.232
227 HB VAL 31 HB VAL 31 16.150 11.551 -3.920
228 HG11 VAL 31 1HG1 VAL 31 16.608 9.863 -5.506
229 HG12 VAL 31 2HG1 VAL 31 18.038 10.768 -6.030
230 HG13 VAL 31 3HG1 VAL 31 16.433 11.473 -6.194
231 HG21 VAL 31 3HG2 VAL 31 17.775 10.875 -2.243
232 HG22 VAL 31 1HG2 VAL 31 18.898 10.392 -3.519
233 HG23 VAL 31 2HG2 VAL 31 17.384 9.524 -3.319
234 H THR 32 H THR 32 20.084 12.765 -2.971
235 HA THR 32 HA THR 32 21.466 12.577 -5.513
236 HB THR 32 HB THR 32 21.795 14.842 -4.694
237 HG1 THR 32 HG1 THR 32 24.315 13.834 -4.153
238 HG21 THR 32 3HG2 THR 32 23.070 13.604 -2.244
239 HG22 THR 32 1HG2 THR 32 21.554 14.503 -2.284
240 HG23 THR 32 2HG2 THR 32 23.076 15.322 -2.639
241 H SER 33 H SER 33 21.548 11.614 -2.099
242 HA SER 33 HA SER 33 23.346 9.445 -2.943
243 HB2 SER 33 1HB SER 33 23.796 11.069 -0.429
244 HB3 SER 33 2HB SER 33 24.843 9.833 -1.119
245 HG SER 33 HG SER 33 25.754 11.398 -2.165
246 H TYR 34 H TYR 34 22.963 7.506 -1.889
247 HA TYR 34 HA TYR 34 20.830 7.550 0.124
248 HB2 TYR 34 1HB TYR 34 20.052 6.460 -1.877
249 HB3 TYR 34 2HB TYR 34 21.501 5.476 -1.968
250 HD1 TYR 34 HD2 TYR 34 19.138 6.133 0.893
251 HD2 TYR 34 HD1 TYR 34 20.850 3.259 -1.743
252 HE1 TYR 34 HE2 TYR 34 17.986 4.342 2.093
253 HE2 TYR 34 HE1 TYR 34 19.691 1.466 -0.526
254 HH TYR 34 HH TYR 34 17.180 2.117 1.611
255 H ASP 35 H ASP 35 21.356 6.936 2.078
256 HA ASP 35 HA ASP 35 23.819 5.403 2.556
257 HB2 ASP 35 1HB ASP 35 23.410 7.452 3.934
258 HB3 ASP 35 2HB ASP 35 21.911 6.723 4.509
259 H ASP 36 H ASP 36 23.664 3.339 2.851
260 HA ASP 36 HA ASP 36 20.989 2.150 3.001
261 HB2 ASP 36 1HB ASP 36 22.413 1.469 1.146
262 HB3 ASP 36 2HB ASP 36 23.663 0.949 2.260
263 H ALA 37 H ALA 37 23.740 2.680 4.957
264 HA ALA 37 HA ALA 37 23.420 0.326 6.567
265 HB1 ALA 37 1HB ALA 37 25.087 2.770 7.108
266 HB2 ALA 37 2HB ALA 37 25.631 1.337 6.239
267 HB3 ALA 37 3HB ALA 37 25.192 1.223 7.945
268 H SER 38 H SER 38 22.884 3.811 7.066
269 HA SER 38 HA SER 38 21.432 3.144 9.515
270 HB2 SER 38 1HB SER 38 22.353 5.827 8.465
271 HB3 SER 38 2HB SER 38 21.705 5.495 10.068
272 HG SER 38 HG SER 38 24.177 4.817 8.944
273 H HIS 39 H HIS 39 20.894 3.570 6.314
274 HA HIS 39 HA HIS 39 19.146 3.958 4.982
275 HB2 HIS 39 1HB HIS 39 17.926 2.304 6.252
276 HB3 HIS 39 2HB HIS 39 17.571 3.453 7.527
277 HD1 HIS 39 HD1 HIS 39 15.014 2.841 7.233
278 HD2 HIS 39 HD2 HIS 39 16.761 4.611 3.906
279 HE1 HIS 39 HE1 HIS 39 13.113 3.588 5.751
280 H LEU 40 H LEU 40 19.922 5.991 4.551
281 HA LEU 40 HA LEU 40 18.001 8.095 5.178
282 HB2 LEU 40 1HB LEU 40 20.983 8.444 5.569
283 HB3 LEU 40 2HB LEU 40 19.937 9.793 5.235
284 HG LEU 40 HG LEU 40 20.346 9.880 7.501
285 HD11 LEU 40 1HD1 LEU 40 17.666 8.577 7.230
286 HD12 LEU 40 2HD1 LEU 40 18.056 10.283 7.061
287 HD13 LEU 40 3HD1 LEU 40 18.228 9.491 8.630
288 HD21 LEU 40 3HD2 LEU 40 20.092 8.024 9.087
289 HD22 LEU 40 1HD2 LEU 40 21.329 7.713 7.868
290 HD23 LEU 40 2HD2 LEU 40 19.748 6.941 7.736
291 H TYR 41 H TYR 41 17.803 9.668 3.598
292 HA TYR 41 HA TYR 41 19.279 9.147 1.123
293 HB2 TYR 41 1HB TYR 41 16.432 10.060 1.574
294 HB3 TYR 41 2HB TYR 41 17.250 10.222 0.028
295 HD1 TYR 41 HD2 TYR 41 16.335 7.659 2.572
296 HD2 TYR 41 HD1 TYR 41 17.061 8.521 -1.522
297 HE1 TYR 41 HE2 TYR 41 15.647 5.388 1.977
298 HE2 TYR 41 HE1 TYR 41 16.355 6.247 -2.135
299 HH TYR 41 HH TYR 41 14.690 4.203 -0.101
300 H THR 42 H THR 42 20.669 10.750 0.802
301 HA THR 42 HA THR 42 20.169 13.312 2.037
302 HB THR 42 HB THR 42 22.436 12.461 0.205
303 HG1 THR 42 HG1 THR 42 23.045 12.641 2.856
304 HG21 THR 42 3HG2 THR 42 22.189 14.899 0.517
305 HG22 THR 42 1HG2 THR 42 23.658 14.305 1.295
306 HG23 THR 42 2HG2 THR 42 22.236 14.676 2.266
307 H VAL 43 H VAL 43 19.324 14.905 0.983
308 HA VAL 43 HA VAL 43 18.894 14.721 -1.905
309 HB VAL 43 HB VAL 43 16.688 15.761 -1.596
310 HG11 VAL 43 1HG1 VAL 43 15.475 13.889 -0.544
311 HG12 VAL 43 2HG1 VAL 43 17.012 13.259 0.053
312 HG13 VAL 43 3HG1 VAL 43 16.707 13.348 -1.680
313 HG21 VAL 43 3HG2 VAL 43 15.667 15.989 0.641
314 HG22 VAL 43 1HG2 VAL 43 17.099 17.007 0.464
315 HG23 VAL 43 2HG2 VAL 43 17.195 15.501 1.374
316 H LYS 44 H LYS 44 18.553 16.838 -2.852
317 HA LYS 44 HA LYS 44 19.905 18.953 -1.338
318 HB2 LYS 44 1HB LYS 44 21.349 17.881 -3.070
319 HB3 LYS 44 2HB LYS 44 20.193 18.386 -4.290
320 HG2 LYS 44 1HG LYS 44 20.644 20.708 -3.799
321 HG3 LYS 44 2HG LYS 44 21.750 20.267 -2.504
322 HD2 LYS 44 1HD LYS 44 23.065 18.983 -4.249
323 HD3 LYS 44 2HD LYS 44 22.053 19.778 -5.458
324 HE2 LYS 44 1HE LYS 44 24.121 20.999 -5.211
325 HE3 LYS 44 2HE LYS 44 22.790 21.962 -4.581
326 HZ1 LYS 44 3HZ LYS 44 24.858 21.884 -3.192
327 HZ2 LYS 44 1HZ LYS 44 24.516 20.286 -2.823
328 HZ3 LYS 44 2HZ LYS 44 23.459 21.531 -2.351
329 H TYR 45 H TYR 45 18.949 20.867 -1.368
330 HA TYR 45 HA TYR 45 16.452 21.176 -2.834
331 HB2 TYR 45 1HB TYR 45 17.745 22.727 -0.598
332 HB3 TYR 45 2HB TYR 45 16.313 23.307 -1.422
333 HD1 TYR 45 HD2 TYR 45 17.644 20.621 0.742
334 HD2 TYR 45 HD1 TYR 45 14.186 22.406 -0.959
335 HE1 TYR 45 HE2 TYR 45 16.231 19.275 2.238
336 HE2 TYR 45 HE1 TYR 45 12.754 21.082 0.518
337 HH TYR 45 HH TYR 45 12.862 18.973 1.842
338 H LYS 46 H LYS 46 16.056 23.150 -3.955
339 HA LYS 46 HA LYS 46 18.025 23.889 -5.799
340 HB2 LYS 46 1HB LYS 46 15.582 24.093 -6.154
341 HB3 LYS 46 2HB LYS 46 15.532 25.379 -4.974
342 HG2 LYS 46 1HG LYS 46 16.965 26.747 -6.323
343 HG3 LYS 46 2HG LYS 46 17.071 25.479 -7.546
344 HD2 LYS 46 1HD LYS 46 14.592 25.625 -7.822
345 HD3 LYS 46 2HD LYS 46 14.584 26.974 -6.692
346 HE2 LYS 46 1HE LYS 46 14.534 27.764 -9.012
347 HE3 LYS 46 2HE LYS 46 16.007 28.270 -8.198
348 HZ1 LYS 46 3HZ LYS 46 15.809 25.934 -10.032
349 HZ2 LYS 46 1HZ LYS 46 17.208 26.511 -9.297
350 HZ3 LYS 46 2HZ LYS 46 16.417 27.445 -10.447
351 H ASP 47 H ASP 47 17.274 25.026 -2.678
352 HA ASP 47 HA ASP 47 18.567 27.587 -2.841
353 HB2 ASP 47 1HB ASP 47 16.669 27.075 -1.299
354 HB3 ASP 47 2HB ASP 47 17.731 26.015 -0.386
355 H GLY 48 H GLY 48 19.805 24.540 -2.833
356 HA2 GLY 48 1HA GLY 48 22.136 24.201 -3.028
357 HA3 GLY 48 2HA GLY 48 22.403 25.545 -1.927
358 H THR 49 H THR 49 20.588 24.804 0.044
359 HA THR 49 HA THR 49 22.053 23.270 1.776
360 HB THR 49 HB THR 49 19.060 23.610 1.767
361 HG1 THR 49 HG1 THR 49 21.204 25.333 2.455
362 HG21 THR 49 3HG2 THR 49 19.922 22.092 3.511
363 HG22 THR 49 1HG2 THR 49 19.340 23.600 4.223
364 HG23 THR 49 2HG2 THR 49 21.069 23.330 4.021
365 H GLU 50 H GLU 50 22.177 21.132 2.248
366 HA GLU 50 HA GLU 50 20.534 19.308 0.659
367 HB2 GLU 50 1HB GLU 50 23.283 18.894 1.849
368 HB3 GLU 50 2HB GLU 50 22.418 17.771 0.799
369 HG2 GLU 50 1HG GLU 50 22.522 19.265 -1.024
370 HG3 GLU 50 2HG GLU 50 23.187 20.553 -0.025
371 H LEU 51 H LEU 51 19.801 17.480 1.793
372 HA LEU 51 HA LEU 51 19.848 17.688 4.724
373 HB2 LEU 51 1HB LEU 51 17.917 18.899 3.799
374 HB3 LEU 51 2HB LEU 51 17.418 17.438 2.974
375 HG LEU 51 HG LEU 51 17.189 16.382 5.255
376 HD11 LEU 51 1HD1 LEU 51 16.905 17.901 7.147
377 HD12 LEU 51 2HD1 LEU 51 17.401 19.253 6.134
378 HD13 LEU 51 3HD1 LEU 51 18.551 17.968 6.512
379 HD21 LEU 51 3HD2 LEU 51 15.304 17.118 3.905
380 HD22 LEU 51 1HD2 LEU 51 15.455 18.745 4.571
381 HD23 LEU 51 2HD2 LEU 51 15.018 17.395 5.622
382 H ALA 52 H ALA 52 19.759 15.592 5.688
383 HA ALA 52 HA ALA 52 19.223 13.404 3.792
384 HB1 ALA 52 1HB ALA 52 20.330 11.941 5.440
385 HB2 ALA 52 2HB ALA 52 20.598 13.337 6.488
386 HB3 ALA 52 3HB ALA 52 21.398 13.246 4.922
387 H LEU 53 H LEU 53 17.478 12.222 4.080
388 HA LEU 53 HA LEU 53 16.096 12.232 6.611
389 HB2 LEU 53 1HB LEU 53 13.873 12.505 5.239
390 HB3 LEU 53 2HB LEU 53 14.759 13.895 5.816
391 HG LEU 53 HG LEU 53 15.673 14.278 3.566
392 HD11 LEU 53 1HD1 LEU 53 14.866 13.058 1.696
393 HD12 LEU 53 2HD1 LEU 53 14.025 11.952 2.777
394 HD13 LEU 53 3HD1 LEU 53 15.807 12.017 2.782
395 HD21 LEU 53 3HD2 LEU 53 13.595 14.769 2.394
396 HD22 LEU 53 1HD2 LEU 53 13.547 15.313 4.092
397 HD23 LEU 53 2HD2 LEU 53 12.744 13.808 3.596
398 H LYS 54 H LYS 54 14.106 10.678 6.478
399 HA LYS 54 HA LYS 54 15.129 8.151 5.583
400 HB2 LYS 54 1HB LYS 54 13.971 8.535 7.766
401 HB3 LYS 54 2HB LYS 54 12.500 8.878 6.875
402 HG2 LYS 54 1HG LYS 54 12.513 6.655 6.002
403 HG3 LYS 54 2HG LYS 54 14.025 6.324 6.858
404 HD2 LYS 54 1HD LYS 54 12.910 6.725 8.995
405 HD3 LYS 54 2HD LYS 54 11.399 7.068 8.147
406 HE2 LYS 54 1HE LYS 54 11.378 4.812 7.252
407 HE3 LYS 54 2HE LYS 54 12.896 4.456 8.067
408 HZ1 LYS 54 3HZ LYS 54 11.806 4.746 10.178
409 HZ2 LYS 54 1HZ LYS 54 10.992 3.610 9.254
410 HZ3 LYS 54 2HZ LYS 54 10.350 5.156 9.431
411 H GLU 55 H GLU 55 13.922 6.733 4.152
412 HA GLU 55 HA GLU 55 12.919 7.777 1.745
413 HB2 GLU 55 1HB GLU 55 13.804 5.533 1.986
414 HB3 GLU 55 2HB GLU 55 12.512 5.102 3.079
415 HG2 GLU 55 1HG GLU 55 10.922 5.239 1.251
416 HG3 GLU 55 2HG GLU 55 12.209 5.749 0.160
417 H SER 56 H SER 56 11.356 6.933 4.721
418 HA SER 56 HA SER 56 8.709 6.745 3.701
419 HB2 SER 56 1HB SER 56 9.598 7.130 6.540
420 HB3 SER 56 2HB SER 56 8.167 6.278 5.945
421 HG SER 56 HG SER 56 9.762 4.861 4.827
422 H ASP 57 H ASP 57 10.762 9.317 4.393
423 HA ASP 57 HA ASP 57 8.601 11.137 5.182
424 HB2 ASP 57 1HB ASP 57 11.035 10.768 6.316
425 HB3 ASP 57 2HB ASP 57 11.457 11.982 5.119
426 H ILE 58 H ILE 58 9.838 9.873 2.491
427 HA ILE 58 HA ILE 58 9.935 12.377 0.968
428 HB ILE 58 HB ILE 58 10.984 9.626 0.205
429 HG12 ILE 58 1HG1 ILE 58 12.452 12.098 1.086
430 HG13 ILE 58 2HG1 ILE 58 12.282 10.606 1.999
431 HG21 ILE 58 1HG2 ILE 58 10.332 10.958 -1.746
432 HG22 ILE 58 2HG2 ILE 58 12.085 10.782 -1.663
433 HG23 ILE 58 3HG2 ILE 58 11.325 12.297 -1.172
434 HD11 ILE 58 3HD1 ILE 58 13.710 10.912 -0.621
435 HD12 ILE 58 1HD1 ILE 58 13.609 9.421 0.337
436 HD13 ILE 58 2HD1 ILE 58 14.443 10.859 0.975
437 H ARG 59 H ARG 59 8.744 12.466 -0.905
438 HA ARG 59 HA ARG 59 6.701 10.406 -1.333
439 HB2 ARG 59 1HB ARG 59 5.726 12.254 -0.038
440 HB3 ARG 59 2HB ARG 59 6.309 13.408 -1.216
441 HG2 ARG 59 1HG ARG 59 4.762 12.591 -2.858
442 HG3 ARG 59 2HG ARG 59 4.278 11.265 -1.796
443 HD2 ARG 59 1HD ARG 59 3.924 14.197 -1.193
444 HD3 ARG 59 2HD ARG 59 2.653 13.117 -1.775
445 HE ARG 59 HE ARG 59 3.606 11.860 0.428
446 HH11 ARG 59 1HH1 ARG 59 2.316 15.116 -0.084
447 HH12 ARG 59 2HH1 ARG 59 1.690 15.259 1.487
448 HH21 ARG 59 1HH2 ARG 59 2.805 12.074 2.571
449 HH22 ARG 59 2HH2 ARG 59 1.975 13.487 3.048
450 H LEU 60 H LEU 60 5.896 10.433 -3.531
451 HA LEU 60 HA LEU 60 7.804 10.783 -5.567
452 HB2 LEU 60 1HB LEU 60 4.789 10.628 -5.774
453 HB3 LEU 60 2HB LEU 60 5.911 10.377 -7.091
454 HG LEU 60 HG LEU 60 5.760 8.605 -4.646
455 HD11 LEU 60 1HD1 LEU 60 4.603 8.203 -7.401
456 HD12 LEU 60 2HD1 LEU 60 3.694 8.467 -5.916
457 HD13 LEU 60 3HD1 LEU 60 4.647 6.997 -6.114
458 HD21 LEU 60 3HD2 LEU 60 7.124 8.224 -7.311
459 HD22 LEU 60 1HD2 LEU 60 7.098 7.071 -5.982
460 HD23 LEU 60 2HD2 LEU 60 7.938 8.612 -5.799
461 H GLN 61 H GLN 61 7.501 12.268 -7.507
462 HA GLN 61 HA GLN 61 7.709 14.949 -6.935
463 HB2 GLN 61 1HB GLN 61 6.786 13.676 -9.486
464 HB3 GLN 61 2HB GLN 61 7.003 15.403 -9.325
465 HG2 GLN 61 1HG GLN 61 9.378 14.969 -8.730
466 HG3 GLN 61 2HG GLN 61 9.097 13.268 -9.110
467 HE21 GLN 61 2HE2 GLN 61 9.294 16.497 -10.416
468 HE22 GLN 61 1HE2 GLN 61 9.382 16.023 -12.066
469 H SER 62 H SER 62 4.786 13.235 -7.559
470 HA SER 62 HA SER 62 3.324 15.548 -6.591
471 HB2 SER 62 1HB SER 62 2.618 14.093 -9.150
472 HB3 SER 62 2HB SER 62 1.652 15.364 -8.399
473 HG SER 62 HG SER 62 4.034 16.299 -8.511
474 H SER 63 H SER 63 3.425 12.073 -7.328
475 HA SER 63 HA SER 63 2.351 10.271 -6.476
476 HB2 SER 63 1HB SER 63 3.207 11.265 -4.305
477 HB3 SER 63 2HB SER 63 1.696 12.150 -4.160
478 HG SER 63 HG SER 63 1.010 10.503 -3.197
479 H PHE 64 H PHE 64 1.176 11.864 -8.276
480 HA PHE 64 HA PHE 64 -1.346 12.952 -7.649
481 HB2 PHE 64 1HB PHE 64 0.220 13.703 -9.444
482 HB3 PHE 64 2HB PHE 64 -0.173 12.246 -10.338
483 HD1 PHE 64 HD1 PHE 64 -1.619 15.312 -8.891
484 HD2 PHE 64 HD2 PHE 64 -2.023 12.216 -11.771
485 HE1 PHE 64 HE1 PHE 64 -3.486 16.523 -9.915
486 HE2 PHE 64 HE2 PHE 64 -3.898 13.421 -12.803
487 HZ PHE 64 HZ PHE 64 -4.627 15.584 -11.869
488 H LYS 65 H LYS 65 -3.350 12.163 -7.988
489 HA LYS 65 HA LYS 65 -3.644 9.333 -8.153
490 HB2 LYS 65 1HB LYS 65 -5.079 10.755 -6.662
491 HB3 LYS 65 2HB LYS 65 -5.760 11.522 -8.081
492 HG2 LYS 65 1HG LYS 65 -6.043 8.566 -7.490
493 HG3 LYS 65 2HG LYS 65 -7.212 9.776 -6.977
494 HD2 LYS 65 1HD LYS 65 -7.667 10.362 -9.282
495 HD3 LYS 65 2HD LYS 65 -6.395 9.280 -9.841
496 HE2 LYS 65 1HE LYS 65 -7.693 7.391 -8.842
497 HE3 LYS 65 2HE LYS 65 -8.980 8.554 -8.507
498 HZ1 LYS 65 3HZ LYS 65 -9.372 7.380 -10.575
499 HZ2 LYS 65 1HZ LYS 65 -7.895 7.939 -11.201
500 HZ3 LYS 65 2HZ LYS 65 -9.142 9.026 -10.848
501 H GLN 66 H GLN 66 -3.676 8.297 -9.997
502 HA GLN 66 HA GLN 66 -4.847 9.623 -12.298
503 HB2 GLN 66 1HB GLN 66 -3.275 8.158 -13.694
504 HB3 GLN 66 2HB GLN 66 -2.536 9.497 -12.840
505 HG2 GLN 66 1HG GLN 66 -1.708 7.986 -11.132
506 HG3 GLN 66 2HG GLN 66 -2.526 6.634 -11.905
507 HE21 GLN 66 2HE2 GLN 66 -1.821 7.513 -14.578
508 HE22 GLN 66 1HE2 GLN 66 -0.151 7.185 -14.794
Start of MODEL 9
1 H1 GLY 1 H GLY 1 7.073 -1.171 -18.603
2 HA2 GLY 1 2HA GLY 1 7.360 1.752 -18.759
3 HA3 GLY 1 1HA GLY 1 5.906 0.869 -18.288
4 H ALA 2 H ALA 2 6.732 2.570 -16.473
5 HA ALA 2 HA ALA 2 8.354 1.021 -14.608
6 HB1 ALA 2 1HB ALA 2 8.915 3.127 -13.518
7 HB2 ALA 2 2HB ALA 2 7.912 4.003 -14.676
8 HB3 ALA 2 3HB ALA 2 9.365 3.160 -15.222
9 H MET 3 H MET 3 6.980 -0.079 -13.461
10 HA MET 3 HA MET 3 4.641 1.280 -12.325
11 HB2 MET 3 1HB MET 3 3.811 -0.971 -11.732
12 HB3 MET 3 2HB MET 3 4.091 -0.792 -13.455
13 HG2 MET 3 1HG MET 3 6.202 -2.007 -13.236
14 HG3 MET 3 2HG MET 3 5.919 -2.188 -11.505
15 HE1 MET 3 3HE MET 3 6.584 -4.574 -13.545
16 HE2 MET 3 1HE MET 3 5.459 -5.808 -12.975
17 HE3 MET 3 2HE MET 3 6.341 -4.812 -11.817
18 H GLY 4 H GLY 4 7.716 -0.079 -11.549
19 HA2 GLY 4 1HA GLY 4 7.660 1.018 -8.941
20 HA3 GLY 4 2HA GLY 4 7.505 -0.737 -8.922
21 H MET 5 H MET 5 9.596 -0.521 -7.793
22 HA MET 5 HA MET 5 11.658 -1.321 -9.502
23 HB2 MET 5 1HB MET 5 11.924 1.105 -9.892
24 HB3 MET 5 2HB MET 5 12.056 1.363 -8.155
25 HG2 MET 5 1HG MET 5 14.097 -0.002 -8.114
26 HG3 MET 5 2HG MET 5 13.976 -0.225 -9.854
27 HE1 MET 5 3HE MET 5 14.608 3.395 -11.198
28 HE2 MET 5 1HE MET 5 13.038 2.679 -10.836
29 HE3 MET 5 2HE MET 5 14.288 1.713 -11.616
30 HA PRO 6 HA PRO 6 12.015 -3.241 -5.473
31 HB2 PRO 6 1HB PRO 6 14.273 -4.631 -6.781
32 HB3 PRO 6 2HB PRO 6 12.850 -5.308 -5.986
33 HG2 PRO 6 1HG PRO 6 13.104 -5.374 -8.643
34 HG3 PRO 6 2HG PRO 6 11.531 -5.105 -7.874
35 HD2 PRO 6 1HD PRO 6 13.373 -3.135 -9.160
36 HD3 PRO 6 2HD PRO 6 11.599 -3.259 -9.226
37 H ASN 7 H ASN 7 13.566 -3.341 -3.841
38 HA ASN 7 HA ASN 7 15.270 -2.738 -2.536
39 HB2 ASN 7 1HB ASN 7 16.687 -1.932 -5.102
40 HB3 ASN 7 2HB ASN 7 17.433 -1.811 -3.515
41 HD21 ASN 7 2HD2 ASN 7 18.107 -3.667 -2.514
42 HD22 ASN 7 1HD2 ASN 7 18.219 -5.188 -3.320
43 H ARG 8 H ARG 8 15.980 -0.133 -4.751
44 HA ARG 8 HA ARG 8 14.374 1.708 -3.171
45 HB2 ARG 8 1HB ARG 8 17.306 2.103 -3.849
46 HB3 ARG 8 2HB ARG 8 16.244 3.409 -3.376
47 HG2 ARG 8 1HG ARG 8 17.494 2.887 -1.459
48 HG3 ARG 8 2HG ARG 8 15.917 2.160 -1.197
49 HD2 ARG 8 1HD ARG 8 17.764 0.714 -0.487
50 HD3 ARG 8 2HD ARG 8 16.793 -0.023 -1.763
51 HE ARG 8 HE ARG 8 18.690 1.030 -3.226
52 HH11 ARG 8 1HH1 ARG 8 19.268 -0.484 -0.048
53 HH12 ARG 8 2HH1 ARG 8 20.699 -1.236 -0.533
54 HH21 ARG 8 1HH2 ARG 8 20.655 0.029 -3.855
55 HH22 ARG 8 2HH2 ARG 8 21.544 -0.925 -2.774
56 H LYS 9 H LYS 9 13.177 2.860 -4.536
57 HA LYS 9 HA LYS 9 13.733 2.806 -7.363
58 HB2 LYS 9 1HB LYS 9 11.388 2.746 -6.438
59 HB3 LYS 9 2HB LYS 9 11.627 4.385 -5.850
60 HG2 LYS 9 1HG LYS 9 12.099 5.066 -8.216
61 HG3 LYS 9 2HG LYS 9 11.569 3.468 -8.714
62 HD2 LYS 9 1HD LYS 9 9.385 3.920 -7.626
63 HD3 LYS 9 2HD LYS 9 9.940 5.565 -7.294
64 HE2 LYS 9 1HE LYS 9 10.388 5.769 -9.786
65 HE3 LYS 9 2HE LYS 9 9.507 4.259 -9.969
66 HZ1 LYS 9 3HZ LYS 9 7.589 5.401 -8.847
67 HZ2 LYS 9 1HZ LYS 9 8.036 6.079 -10.345
68 HZ3 LYS 9 2HZ LYS 9 8.511 6.822 -8.945
69 H TYR 10 H TYR 10 14.116 4.845 -4.632
70 HA TYR 10 HA TYR 10 14.653 7.194 -6.219
71 HB2 TYR 10 1HB TYR 10 14.971 7.010 -3.235
72 HB3 TYR 10 2HB TYR 10 14.642 8.426 -4.225
73 HD1 TYR 10 HD1 TYR 10 12.370 7.748 -5.824
74 HD2 TYR 10 HD2 TYR 10 13.208 6.617 -1.817
75 HE1 TYR 10 HE1 TYR 10 9.966 7.440 -5.420
76 HE2 TYR 10 HE2 TYR 10 10.815 6.309 -1.389
77 HH TYR 10 HH TYR 10 8.733 6.992 -2.230
78 H ALA 11 H ALA 11 16.362 6.134 -7.213
79 HA ALA 11 HA ALA 11 18.849 5.794 -5.742
80 HB1 ALA 11 1HB ALA 11 18.216 5.690 -8.684
81 HB2 ALA 11 2HB ALA 11 18.378 4.299 -7.606
82 HB3 ALA 11 3HB ALA 11 19.783 5.314 -7.975
83 H ASP 12 H ASP 12 20.685 7.131 -6.166
84 HA ASP 12 HA ASP 12 20.253 9.819 -5.931
85 HB2 ASP 12 1HB ASP 12 22.593 10.199 -6.203
86 HB3 ASP 12 2HB ASP 12 22.424 8.636 -5.436
87 H GLY 13 H GLY 13 19.715 11.431 -7.183
88 HA2 GLY 13 1HA GLY 13 19.897 12.623 -9.272
89 HA3 GLY 13 2HA GLY 13 19.917 11.065 -10.089
90 H GLU 14 H GLU 14 17.651 10.395 -7.916
91 HA GLU 14 HA GLU 14 15.539 10.905 -9.791
92 HB2 GLU 14 1HB GLU 14 15.578 8.791 -8.598
93 HB3 GLU 14 2HB GLU 14 15.591 9.613 -7.052
94 HG2 GLU 14 1HG GLU 14 13.401 8.713 -7.466
95 HG3 GLU 14 2HG GLU 14 13.339 10.472 -7.522
96 H VAL 15 H VAL 15 13.914 12.408 -9.581
97 HA VAL 15 HA VAL 15 14.346 14.347 -7.448
98 HB VAL 15 HB VAL 15 14.311 15.326 -9.690
99 HG11 VAL 15 1HG1 VAL 15 12.328 15.293 -11.123
100 HG12 VAL 15 2HG1 VAL 15 11.566 14.150 -10.013
101 HG13 VAL 15 3HG1 VAL 15 13.037 13.697 -10.882
102 HG21 VAL 15 3HG2 VAL 15 13.408 16.718 -7.927
103 HG22 VAL 15 1HG2 VAL 15 11.805 16.023 -8.163
104 HG23 VAL 15 2HG2 VAL 15 12.529 17.015 -9.426
105 H VAL 16 H VAL 16 12.954 14.530 -5.843
106 HA VAL 16 HA VAL 16 10.391 13.182 -6.004
107 HB VAL 16 HB VAL 16 10.777 12.289 -3.622
108 HG11 VAL 16 1HG1 VAL 16 10.615 10.820 -5.559
109 HG12 VAL 16 2HG1 VAL 16 11.850 10.232 -4.442
110 HG13 VAL 16 3HG1 VAL 16 12.322 11.087 -5.910
111 HG21 VAL 16 3HG2 VAL 16 13.667 12.659 -4.444
112 HG22 VAL 16 1HG2 VAL 16 13.108 11.761 -3.036
113 HG23 VAL 16 2HG2 VAL 16 12.844 13.501 -3.125
114 H MET 17 H MET 17 9.236 13.598 -3.737
115 HA MET 17 HA MET 17 9.746 16.389 -3.051
116 HB2 MET 17 1HB MET 17 7.214 14.762 -2.717
117 HB3 MET 17 2HB MET 17 7.440 16.415 -2.168
118 HG2 MET 17 1HG MET 17 7.789 17.102 -4.513
119 HG3 MET 17 2HG MET 17 7.444 15.449 -5.017
120 HE1 MET 17 3HE MET 17 6.108 18.683 -3.373
121 HE2 MET 17 1HE MET 17 5.702 17.535 -2.105
122 HE3 MET 17 2HE MET 17 4.417 18.319 -3.027
123 H GLY 18 H GLY 18 10.265 16.790 -0.974
124 HA2 GLY 18 1HA GLY 18 10.116 14.503 0.860
125 HA3 GLY 18 2HA GLY 18 11.633 15.223 0.578
126 H ARG 19 H ARG 19 9.909 14.980 2.876
127 HA ARG 19 HA ARG 19 8.898 17.526 3.718
128 HB2 ARG 19 1HB ARG 19 7.883 15.549 4.581
129 HB3 ARG 19 2HB ARG 19 9.425 14.911 5.115
130 HG2 ARG 19 1HG ARG 19 9.531 16.869 6.713
131 HG3 ARG 19 2HG ARG 19 7.846 17.178 6.299
132 HD2 ARG 19 1HD ARG 19 7.149 15.099 7.157
133 HD3 ARG 19 2HD ARG 19 8.798 14.487 7.244
134 HE ARG 19 HE ARG 19 7.584 16.479 9.021
135 HH11 ARG 19 1HH1 ARG 19 10.153 14.097 8.361
136 HH12 ARG 19 2HH1 ARG 19 10.836 14.204 9.915
137 HH21 ARG 19 1HH2 ARG 19 8.593 16.600 11.201
138 HH22 ARG 19 2HH2 ARG 19 9.934 15.608 11.536
139 H TRP 20 H TRP 20 9.996 19.085 4.685
140 HA TRP 20 HA TRP 20 12.735 18.591 5.486
141 HB2 TRP 20 1HB TRP 20 12.046 20.763 4.409
142 HB3 TRP 20 2HB TRP 20 11.122 21.137 5.863
143 HD1 TRP 20 HD1 TRP 20 12.742 21.350 8.199
144 HE1 TRP 20 HE1 TRP 20 15.101 22.355 8.401
145 HE3 TRP 20 HE3 TRP 20 14.081 21.162 3.334
146 HZ2 TRP 20 HZ2 TRP 20 17.250 22.993 6.690
147 HZ3 TRP 20 HZ3 TRP 20 16.294 22.002 2.651
148 HH2 TRP 20 HH2 TRP 20 17.840 22.893 4.245
149 HA PRO 21 HA PRO 21 11.310 17.176 9.429
150 HB2 PRO 21 1HB PRO 21 13.727 17.464 10.747
151 HB3 PRO 21 2HB PRO 21 13.266 16.059 9.784
152 HG2 PRO 21 1HG PRO 21 14.982 18.394 9.020
153 HG3 PRO 21 2HG PRO 21 15.154 16.686 8.584
154 HD2 PRO 21 1HD PRO 21 14.181 18.549 6.929
155 HD3 PRO 21 2HD PRO 21 13.608 16.878 6.844
156 H GLY 22 H GLY 22 9.968 18.584 10.341
157 HA2 GLY 22 1HA GLY 22 9.724 19.903 12.330
158 HA3 GLY 22 2HA GLY 22 11.154 20.804 11.847
159 H SER 23 H SER 23 10.239 20.886 9.019
160 HA SER 23 HA SER 23 8.592 23.243 9.384
161 HB2 SER 23 1HB SER 23 9.842 22.160 6.873
162 HB3 SER 23 2HB SER 23 9.172 23.772 7.102
163 HG SER 23 HG SER 23 10.728 24.102 8.744
164 H VAL 24 H VAL 24 8.152 20.011 8.637
165 HA VAL 24 HA VAL 24 6.301 18.748 8.390
166 HB VAL 24 HB VAL 24 4.747 21.360 8.237
167 HG11 VAL 24 1HG1 VAL 24 3.505 19.564 7.235
168 HG12 VAL 24 2HG1 VAL 24 2.783 20.007 8.792
169 HG13 VAL 24 3HG1 VAL 24 3.792 18.557 8.655
170 HG21 VAL 24 3HG2 VAL 24 5.160 19.498 10.581
171 HG22 VAL 24 1HG2 VAL 24 4.137 20.932 10.572
172 HG23 VAL 24 2HG2 VAL 24 5.884 21.095 10.386
173 H LEU 25 H LEU 25 6.767 21.331 6.201
174 HA LEU 25 HA LEU 25 5.119 20.490 4.089
175 HB2 LEU 25 1HB LEU 25 7.500 22.218 4.019
176 HB3 LEU 25 2HB LEU 25 6.254 22.069 2.798
177 HG LEU 25 HG LEU 25 6.061 23.244 5.529
178 HD11 LEU 25 1HD1 LEU 25 6.866 24.609 3.671
179 HD12 LEU 25 2HD1 LEU 25 5.193 25.113 4.104
180 HD13 LEU 25 3HD1 LEU 25 5.497 23.980 2.754
181 HD21 LEU 25 3HD2 LEU 25 3.824 22.619 3.623
182 HD22 LEU 25 1HD2 LEU 25 3.679 23.591 5.091
183 HD23 LEU 25 2HD2 LEU 25 4.082 21.874 5.212
184 H TYR 26 H TYR 26 5.567 19.608 2.220
185 HA TYR 26 HA TYR 26 8.082 18.136 1.886
186 HB2 TYR 26 1HB TYR 26 5.289 17.640 0.821
187 HB3 TYR 26 2HB TYR 26 6.704 16.873 0.131
188 HD1 TYR 26 HD2 TYR 26 4.997 17.284 3.456
189 HD2 TYR 26 HD1 TYR 26 7.309 14.809 0.897
190 HE1 TYR 26 HE2 TYR 26 4.818 15.441 5.079
191 HE2 TYR 26 HE1 TYR 26 7.149 12.980 2.491
192 HH TYR 26 HH TYR 26 6.705 12.568 4.839
193 H TYR 27 H TYR 27 9.385 19.085 0.549
194 HA TYR 27 HA TYR 27 8.275 20.934 -1.475
195 HB2 TYR 27 1HB TYR 27 11.105 20.758 -0.492
196 HB3 TYR 27 2HB TYR 27 10.409 22.039 -1.462
197 HD1 TYR 27 HD2 TYR 27 8.762 23.638 -0.384
198 HD2 TYR 27 HD1 TYR 27 11.004 20.821 1.885
199 HE1 TYR 27 HE2 TYR 27 8.325 24.931 1.678
200 HE2 TYR 27 HE1 TYR 27 10.580 22.120 3.922
201 HH TYR 27 HH TYR 27 10.075 24.458 4.489
202 H GLU 28 H GLU 28 9.837 20.997 -3.420
203 HA GLU 28 HA GLU 28 10.176 18.253 -4.294
204 HB2 GLU 28 1HB GLU 28 9.149 19.850 -5.875
205 HB3 GLU 28 2HB GLU 28 10.593 20.850 -5.817
206 HG2 GLU 28 1HG GLU 28 11.892 19.097 -6.867
207 HG3 GLU 28 2HG GLU 28 10.501 18.021 -6.837
208 H VAL 29 H VAL 29 12.080 17.232 -4.354
209 HA VAL 29 HA VAL 29 14.565 18.743 -3.888
210 HB VAL 29 HB VAL 29 15.260 17.127 -2.189
211 HG11 VAL 29 1HG1 VAL 29 12.554 18.253 -1.579
212 HG12 VAL 29 2HG1 VAL 29 14.105 19.081 -1.402
213 HG13 VAL 29 3HG1 VAL 29 13.723 17.685 -0.393
214 HG21 VAL 29 3HG2 VAL 29 14.060 15.168 -2.973
215 HG22 VAL 29 1HG2 VAL 29 12.524 15.897 -2.503
216 HG23 VAL 29 2HG2 VAL 29 13.707 15.466 -1.267
217 H GLN 30 H GLN 30 16.497 17.355 -4.437
218 HA GLN 30 HA GLN 30 15.634 15.048 -6.025
219 HB2 GLN 30 1HB GLN 30 16.358 16.958 -7.482
220 HB3 GLN 30 2HB GLN 30 17.945 16.855 -6.740
221 HG2 GLN 30 1HG GLN 30 18.243 14.602 -7.642
222 HG3 GLN 30 2HG GLN 30 16.618 14.651 -8.303
223 HE21 GLN 30 2HE2 GLN 30 17.388 14.320 -10.387
224 HE22 GLN 30 1HE2 GLN 30 18.151 15.596 -11.265
225 H VAL 31 H VAL 31 16.654 13.197 -5.639
226 HA VAL 31 HA VAL 31 18.159 13.149 -3.224
227 HB VAL 31 HB VAL 31 16.523 11.327 -3.796
228 HG11 VAL 31 1HG1 VAL 31 16.765 11.110 -6.019
229 HG12 VAL 31 2HG1 VAL 31 17.135 9.555 -5.266
230 HG13 VAL 31 3HG1 VAL 31 18.436 10.583 -5.885
231 HG21 VAL 31 3HG2 VAL 31 18.206 10.875 -2.086
232 HG22 VAL 31 1HG2 VAL 31 19.332 10.335 -3.329
233 HG23 VAL 31 2HG2 VAL 31 17.856 9.421 -3.024
234 H THR 32 H THR 32 20.150 12.991 -2.829
235 HA THR 32 HA THR 32 21.984 13.294 -5.076
236 HB THR 32 HB THR 32 22.218 14.148 -2.186
237 HG1 THR 32 HG1 THR 32 21.116 15.288 -4.492
238 HG21 THR 32 3HG2 THR 32 23.746 14.994 -4.635
239 HG22 THR 32 1HG2 THR 32 24.393 13.930 -3.374
240 HG23 THR 32 2HG2 THR 32 23.967 15.613 -3.004
241 H SER 33 H SER 33 21.483 11.592 -1.984
242 HA SER 33 HA SER 33 23.223 9.469 -2.828
243 HB2 SER 33 1HB SER 33 23.859 11.057 -0.311
244 HB3 SER 33 2HB SER 33 24.682 9.591 -0.843
245 HG SER 33 HG SER 33 24.774 11.191 -2.874
246 H TYR 34 H TYR 34 23.049 7.655 -1.221
247 HA TYR 34 HA TYR 34 20.833 7.944 0.636
248 HB2 TYR 34 1HB TYR 34 19.626 7.028 -1.178
249 HB3 TYR 34 2HB TYR 34 20.942 5.952 -1.621
250 HD1 TYR 34 HD2 TYR 34 18.698 6.544 1.350
251 HD2 TYR 34 HD1 TYR 34 20.668 3.736 -1.162
252 HE1 TYR 34 HE2 TYR 34 17.678 4.695 2.621
253 HE2 TYR 34 HE1 TYR 34 19.673 1.898 0.104
254 HH TYR 34 HH TYR 34 18.721 1.412 2.160
255 H ASP 35 H ASP 35 21.460 7.292 2.509
256 HA ASP 35 HA ASP 35 23.682 5.404 2.713
257 HB2 ASP 35 1HB ASP 35 23.736 7.432 4.146
258 HB3 ASP 35 2HB ASP 35 22.226 6.912 4.894
259 H ASP 36 H ASP 36 23.337 3.382 3.024
260 HA ASP 36 HA ASP 36 20.576 2.538 3.511
261 HB2 ASP 36 1HB ASP 36 21.685 1.797 1.429
262 HB3 ASP 36 2HB ASP 36 22.905 0.968 2.386
263 H ALA 37 H ALA 37 23.294 3.070 5.197
264 HA ALA 37 HA ALA 37 23.237 0.697 6.818
265 HB1 ALA 37 1HB ALA 37 24.995 1.777 8.107
266 HB2 ALA 37 2HB ALA 37 24.717 3.289 7.242
267 HB3 ALA 37 3HB ALA 37 25.356 1.888 6.383
268 H SER 38 H SER 38 22.587 4.158 7.307
269 HA SER 38 HA SER 38 20.994 3.445 9.670
270 HB2 SER 38 1HB SER 38 21.863 6.149 8.628
271 HB3 SER 38 2HB SER 38 21.077 5.843 10.175
272 HG SER 38 HG SER 38 23.482 4.566 9.457
273 H HIS 39 H HIS 39 20.613 3.791 6.464
274 HA HIS 39 HA HIS 39 18.983 4.086 4.992
275 HB2 HIS 39 1HB HIS 39 17.151 3.501 7.325
276 HB3 HIS 39 2HB HIS 39 16.620 3.617 5.655
277 HD1 HIS 39 HD1 HIS 39 17.581 1.666 4.005
278 HD2 HIS 39 HD2 HIS 39 18.154 1.117 8.088
279 HE1 HIS 39 HE1 HIS 39 18.113 -0.767 4.317
280 H LEU 40 H LEU 40 19.775 6.259 4.903
281 HA LEU 40 HA LEU 40 17.541 8.127 5.274
282 HB2 LEU 40 1HB LEU 40 20.438 8.709 5.912
283 HB3 LEU 40 2HB LEU 40 19.317 9.980 5.502
284 HG LEU 40 HG LEU 40 19.541 10.035 7.818
285 HD11 LEU 40 1HD1 LEU 40 17.281 10.318 7.140
286 HD12 LEU 40 2HD1 LEU 40 17.363 9.537 8.717
287 HD13 LEU 40 3HD1 LEU 40 16.984 8.583 7.285
288 HD21 LEU 40 3HD2 LEU 40 20.585 7.903 8.217
289 HD22 LEU 40 1HD2 LEU 40 19.065 7.065 7.909
290 HD23 LEU 40 2HD2 LEU 40 19.221 8.123 9.313
291 H TYR 41 H TYR 41 17.102 9.370 3.538
292 HA TYR 41 HA TYR 41 18.790 8.932 1.211
293 HB2 TYR 41 1HB TYR 41 15.948 9.946 1.518
294 HB3 TYR 41 2HB TYR 41 16.825 9.978 -0.004
295 HD1 TYR 41 HD2 TYR 41 15.259 7.774 2.530
296 HD2 TYR 41 HD1 TYR 41 17.071 7.993 -1.320
297 HE1 TYR 41 HE2 TYR 41 14.469 5.496 2.024
298 HE2 TYR 41 HE1 TYR 41 16.279 5.712 -1.822
299 HH TYR 41 HH TYR 41 13.984 4.097 0.074
300 H THR 42 H THR 42 20.181 10.511 0.794
301 HA THR 42 HA THR 42 19.757 13.087 2.083
302 HB THR 42 HB THR 42 22.141 12.100 0.501
303 HG1 THR 42 HG1 THR 42 21.173 11.214 2.787
304 HG21 THR 42 3HG2 THR 42 23.351 13.804 1.816
305 HG22 THR 42 1HG2 THR 42 21.851 14.233 2.641
306 HG23 THR 42 2HG2 THR 42 22.027 14.541 0.913
307 H VAL 43 H VAL 43 19.149 14.780 0.900
308 HA VAL 43 HA VAL 43 19.063 14.495 -2.019
309 HB VAL 43 HB VAL 43 16.853 15.570 -2.020
310 HG11 VAL 43 1HG1 VAL 43 15.460 13.820 -0.981
311 HG12 VAL 43 2HG1 VAL 43 16.898 13.169 -0.198
312 HG13 VAL 43 3HG1 VAL 43 16.761 13.144 -1.952
313 HG21 VAL 43 3HG2 VAL 43 17.063 16.932 0.002
314 HG22 VAL 43 1HG2 VAL 43 16.998 15.480 1.000
315 HG23 VAL 43 2HG2 VAL 43 15.588 15.962 0.060
316 H LYS 44 H LYS 44 19.137 16.545 -3.073
317 HA LYS 44 HA LYS 44 20.049 18.652 -1.301
318 HB2 LYS 44 1HB LYS 44 21.691 17.929 -3.078
319 HB3 LYS 44 2HB LYS 44 20.532 18.473 -4.286
320 HG2 LYS 44 1HG LYS 44 20.724 20.741 -3.568
321 HG3 LYS 44 2HG LYS 44 21.667 20.281 -2.160
322 HD2 LYS 44 1HD LYS 44 23.219 21.192 -3.682
323 HD3 LYS 44 2HD LYS 44 23.440 19.455 -3.786
324 HE2 LYS 44 1HE LYS 44 21.798 21.084 -5.732
325 HE3 LYS 44 2HE LYS 44 23.495 20.707 -5.967
326 HZ1 LYS 44 3HZ LYS 44 22.146 19.193 -7.206
327 HZ2 LYS 44 1HZ LYS 44 21.253 18.750 -5.866
328 HZ3 LYS 44 2HZ LYS 44 22.878 18.331 -5.983
329 H TYR 45 H TYR 45 19.005 20.529 -1.253
330 HA TYR 45 HA TYR 45 16.468 20.702 -2.614
331 HB2 TYR 45 1HB TYR 45 17.753 22.093 -0.317
332 HB3 TYR 45 2HB TYR 45 16.467 22.930 -1.155
333 HD1 TYR 45 HD1 TYR 45 17.288 19.818 0.685
334 HD2 TYR 45 HD2 TYR 45 14.243 22.412 -0.732
335 HE1 TYR 45 HE1 TYR 45 15.630 18.600 2.024
336 HE2 TYR 45 HE2 TYR 45 12.580 21.226 0.582
337 HH TYR 45 HH TYR 45 12.287 18.918 1.627
338 H LYS 46 H LYS 46 15.894 22.431 -3.801
339 HA LYS 46 HA LYS 46 17.618 23.590 -5.630
340 HB2 LYS 46 1HB LYS 46 15.176 23.308 -5.849
341 HB3 LYS 46 2HB LYS 46 14.939 24.559 -4.644
342 HG2 LYS 46 1HG LYS 46 16.087 26.125 -6.120
343 HG3 LYS 46 2HG LYS 46 16.179 24.861 -7.348
344 HD2 LYS 46 1HD LYS 46 13.732 24.677 -7.343
345 HD3 LYS 46 2HD LYS 46 13.646 25.955 -6.129
346 HE2 LYS 46 1HE LYS 46 14.751 27.478 -7.712
347 HE3 LYS 46 2HE LYS 46 14.737 26.178 -8.908
348 HZ1 LYS 46 3HZ LYS 46 12.322 26.203 -8.858
349 HZ2 LYS 46 1HZ LYS 46 12.903 27.745 -9.201
350 HZ3 LYS 46 2HZ LYS 46 12.346 27.396 -7.663
351 H ASP 47 H ASP 47 16.851 24.432 -2.411
352 HA ASP 47 HA ASP 47 17.605 27.197 -2.489
353 HB2 ASP 47 1HB ASP 47 15.970 26.154 -0.870
354 HB3 ASP 47 2HB ASP 47 17.335 25.391 -0.079
355 H GLY 48 H GLY 48 19.391 24.444 -2.746
356 HA2 GLY 48 1HA GLY 48 21.739 24.560 -3.102
357 HA3 GLY 48 2HA GLY 48 21.823 25.852 -1.914
358 H THR 49 H THR 49 20.364 24.668 0.104
359 HA THR 49 HA THR 49 22.357 23.130 1.391
360 HB THR 49 HB THR 49 19.487 23.649 2.162
361 HG1 THR 49 HG1 THR 49 21.828 25.186 2.184
362 HG21 THR 49 3HG2 THR 49 21.931 23.018 3.857
363 HG22 THR 49 1HG2 THR 49 20.572 21.930 3.564
364 HG23 THR 49 2HG2 THR 49 20.325 23.410 4.477
365 H GLU 50 H GLU 50 22.548 20.941 1.596
366 HA GLU 50 HA GLU 50 20.438 19.318 0.479
367 HB2 GLU 50 1HB GLU 50 22.021 17.416 0.689
368 HB3 GLU 50 2HB GLU 50 22.632 18.709 -0.323
369 HG2 GLU 50 1HG GLU 50 23.388 18.472 2.556
370 HG3 GLU 50 2HG GLU 50 24.216 17.561 1.294
371 H LEU 51 H LEU 51 19.662 17.491 1.614
372 HA LEU 51 HA LEU 51 19.691 17.759 4.537
373 HB2 LEU 51 1HB LEU 51 17.803 19.030 3.610
374 HB3 LEU 51 2HB LEU 51 17.283 17.591 2.757
375 HG LEU 51 HG LEU 51 17.010 16.502 5.018
376 HD11 LEU 51 1HD1 LEU 51 17.293 19.345 5.946
377 HD12 LEU 51 2HD1 LEU 51 18.342 17.988 6.345
378 HD13 LEU 51 3HD1 LEU 51 16.674 18.010 6.919
379 HD21 LEU 51 3HD2 LEU 51 14.834 17.484 5.351
380 HD22 LEU 51 1HD2 LEU 51 15.161 17.268 3.639
381 HD23 LEU 51 2HD2 LEU 51 15.279 18.877 4.364
382 H ALA 52 H ALA 52 19.309 15.719 5.567
383 HA ALA 52 HA ALA 52 18.912 13.463 3.742
384 HB1 ALA 52 1HB ALA 52 19.873 12.069 5.539
385 HB2 ALA 52 2HB ALA 52 20.117 13.512 6.523
386 HB3 ALA 52 3HB ALA 52 21.011 13.308 5.016
387 H LEU 53 H LEU 53 17.137 12.298 4.012
388 HA LEU 53 HA LEU 53 15.550 12.687 6.381
389 HB2 LEU 53 1HB LEU 53 13.504 12.930 4.842
390 HB3 LEU 53 2HB LEU 53 14.498 14.323 5.170
391 HG LEU 53 HG LEU 53 15.526 14.161 2.941
392 HD11 LEU 53 1HD1 LEU 53 14.753 12.640 1.315
393 HD12 LEU 53 2HD1 LEU 53 13.681 11.892 2.504
394 HD13 LEU 53 3HD1 LEU 53 15.461 11.795 2.707
395 HD21 LEU 53 3HD2 LEU 53 13.532 14.535 1.575
396 HD22 LEU 53 1HD2 LEU 53 13.495 15.462 3.101
397 HD23 LEU 53 2HD2 LEU 53 12.572 13.957 2.929
398 H LYS 54 H LYS 54 13.591 11.214 6.320
399 HA LYS 54 HA LYS 54 14.616 8.577 5.665
400 HB2 LYS 54 1HB LYS 54 12.164 9.384 7.233
401 HB3 LYS 54 2HB LYS 54 12.691 7.725 6.975
402 HG2 LYS 54 1HG LYS 54 14.821 8.287 8.117
403 HG3 LYS 54 2HG LYS 54 14.162 9.885 8.464
404 HD2 LYS 54 1HD LYS 54 12.341 8.860 9.718
405 HD3 LYS 54 2HD LYS 54 12.991 7.257 9.358
406 HE2 LYS 54 1HE LYS 54 15.096 7.921 10.516
407 HE3 LYS 54 2HE LYS 54 14.321 9.438 10.963
408 HZ1 LYS 54 3HZ LYS 54 12.634 8.144 12.152
409 HZ2 LYS 54 1HZ LYS 54 14.180 7.880 12.760
410 HZ3 LYS 54 2HZ LYS 54 13.457 6.721 11.777
411 H GLU 55 H GLU 55 13.035 6.956 4.755
412 HA GLU 55 HA GLU 55 11.981 7.758 2.277
413 HB2 GLU 55 1HB GLU 55 10.811 5.564 2.268
414 HB3 GLU 55 2HB GLU 55 12.510 5.426 2.678
415 HG2 GLU 55 1HG GLU 55 11.998 5.120 4.990
416 HG3 GLU 55 2HG GLU 55 10.301 5.500 4.710
417 H SER 56 H SER 56 10.593 7.620 5.464
418 HA SER 56 HA SER 56 7.884 7.913 4.853
419 HB2 SER 56 1HB SER 56 9.351 8.842 7.313
420 HB3 SER 56 2HB SER 56 7.674 8.297 7.182
421 HG SER 56 HG SER 56 8.562 6.490 7.786
422 H ASP 57 H ASP 57 10.488 10.065 4.551
423 HA ASP 57 HA ASP 57 8.817 12.430 4.863
424 HB2 ASP 57 1HB ASP 57 11.776 12.092 4.490
425 HB3 ASP 57 2HB ASP 57 10.986 13.661 4.586
426 H ILE 58 H ILE 58 9.409 10.224 2.571
427 HA ILE 58 HA ILE 58 9.722 12.261 0.509
428 HB ILE 58 HB ILE 58 10.528 9.345 0.415
429 HG12 ILE 58 1HG1 ILE 58 12.078 11.933 0.375
430 HG13 ILE 58 2HG1 ILE 58 12.015 10.762 1.684
431 HG21 ILE 58 1HG2 ILE 58 10.751 11.455 -1.729
432 HG22 ILE 58 2HG2 ILE 58 9.644 10.081 -1.778
433 HG23 ILE 58 3HG2 ILE 58 11.392 9.815 -1.840
434 HD11 ILE 58 3HD1 ILE 58 13.196 10.310 -1.038
435 HD12 ILE 58 1HD1 ILE 58 13.192 9.146 0.301
436 HD13 ILE 58 2HD1 ILE 58 14.064 10.682 0.453
437 H ARG 59 H ARG 59 8.320 12.540 -0.936
438 HA ARG 59 HA ARG 59 6.252 10.487 -1.491
439 HB2 ARG 59 1HB ARG 59 5.778 13.488 -1.430
440 HB3 ARG 59 2HB ARG 59 4.611 12.287 -1.945
441 HG2 ARG 59 1HG ARG 59 5.694 12.681 0.832
442 HG3 ARG 59 2HG ARG 59 4.075 13.075 0.255
443 HD2 ARG 59 1HD ARG 59 3.677 10.709 -0.196
444 HD3 ARG 59 2HD ARG 59 5.283 10.321 0.419
445 HE ARG 59 HE ARG 59 3.051 11.398 1.974
446 HH11 ARG 59 1HH1 ARG 59 6.217 9.748 1.905
447 HH12 ARG 59 2HH1 ARG 59 6.083 9.220 3.528
448 HH21 ARG 59 1HH2 ARG 59 2.928 10.641 4.163
449 HH22 ARG 59 2HH2 ARG 59 4.200 9.713 4.821
450 H LEU 60 H LEU 60 5.561 10.508 -3.730
451 HA LEU 60 HA LEU 60 7.523 11.677 -5.457
452 HB2 LEU 60 1HB LEU 60 5.066 10.036 -6.089
453 HB3 LEU 60 2HB LEU 60 6.181 10.640 -7.298
454 HG LEU 60 HG LEU 60 7.961 9.355 -5.951
455 HD11 LEU 60 1HD1 LEU 60 7.198 7.322 -4.883
456 HD12 LEU 60 2HD1 LEU 60 5.533 7.876 -5.037
457 HD13 LEU 60 3HD1 LEU 60 6.674 8.775 -4.034
458 HD21 LEU 60 3HD2 LEU 60 5.928 7.928 -7.641
459 HD22 LEU 60 1HD2 LEU 60 7.548 7.337 -7.263
460 HD23 LEU 60 2HD2 LEU 60 7.348 8.811 -8.204
461 H GLN 61 H GLN 61 6.678 12.854 -7.469
462 HA GLN 61 HA GLN 61 5.861 15.361 -6.688
463 HB2 GLN 61 1HB GLN 61 7.055 14.895 -8.755
464 HB3 GLN 61 2HB GLN 61 5.634 14.114 -9.414
465 HG2 GLN 61 1HG GLN 61 4.442 16.200 -9.444
466 HG3 GLN 61 2HG GLN 61 5.784 17.011 -8.634
467 HE21 GLN 61 2HE2 GLN 61 4.535 17.482 -11.247
468 HE22 GLN 61 1HE2 GLN 61 5.839 17.447 -12.367
469 H SER 62 H SER 62 3.806 12.753 -7.819
470 HA SER 62 HA SER 62 1.501 14.550 -7.474
471 HB2 SER 62 1HB SER 62 1.623 11.973 -9.043
472 HB3 SER 62 2HB SER 62 0.341 13.185 -9.073
473 HG SER 62 HG SER 62 2.786 13.134 -10.313
474 H SER 63 H SER 63 3.067 12.716 -5.470
475 HA SER 63 HA SER 63 2.777 11.075 -3.967
476 HB2 SER 63 1HB SER 63 -0.056 12.197 -3.923
477 HB3 SER 63 2HB SER 63 0.637 11.174 -2.662
478 HG SER 63 HG SER 63 1.653 13.698 -3.484
479 H PHE 64 H PHE 64 3.177 9.549 -5.533
480 HA PHE 64 HA PHE 64 1.253 8.589 -7.362
481 HB2 PHE 64 1HB PHE 64 3.701 8.731 -7.736
482 HB3 PHE 64 2HB PHE 64 3.914 7.379 -6.642
483 HD1 PHE 64 HD1 PHE 64 2.216 8.357 -9.798
484 HD2 PHE 64 HD2 PHE 64 3.914 5.215 -7.485
485 HE1 PHE 64 HE1 PHE 64 2.008 6.837 -11.719
486 HE2 PHE 64 HE2 PHE 64 3.697 3.685 -9.399
487 HZ PHE 64 HZ PHE 64 2.745 4.499 -11.520
488 H LYS 65 H LYS 65 2.616 7.143 -4.402
489 HA LYS 65 HA LYS 65 2.006 5.396 -3.095
490 HB2 LYS 65 1HB LYS 65 -0.595 5.456 -4.661
491 HB3 LYS 65 2HB LYS 65 -0.319 4.397 -3.294
492 HG2 LYS 65 1HG LYS 65 -0.215 7.410 -3.162
493 HG3 LYS 65 2HG LYS 65 -1.641 6.447 -2.774
494 HD2 LYS 65 1HD LYS 65 1.033 6.174 -1.385
495 HD3 LYS 65 2HD LYS 65 -0.305 7.148 -0.781
496 HE2 LYS 65 1HE LYS 65 -1.709 5.155 -0.633
497 HE3 LYS 65 2HE LYS 65 -0.409 4.168 -1.289
498 HZ1 LYS 65 3HZ LYS 65 -0.295 5.658 1.276
499 HZ2 LYS 65 1HZ LYS 65 0.917 4.659 0.665
500 HZ3 LYS 65 2HZ LYS 65 -0.557 4.004 1.119
501 H GLN 66 H GLN 66 1.761 2.982 -3.138
502 HA GLN 66 HA GLN 66 2.744 2.018 -5.719
503 HB2 GLN 66 1HB GLN 66 3.016 0.728 -2.987
504 HB3 GLN 66 2HB GLN 66 3.683 0.100 -4.483
505 HG2 GLN 66 1HG GLN 66 4.503 2.607 -3.031
506 HG3 GLN 66 2HG GLN 66 5.431 1.119 -3.199
507 HE21 GLN 66 2HE2 GLN 66 6.409 0.679 -5.218
508 HE22 GLN 66 1HE2 GLN 66 6.645 1.923 -6.389
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -0.448 -3.219 -1.180
2 HA2 GLY 1 2HA GLY 1 0.548 -5.217 -2.107
3 HA3 GLY 1 1HA GLY 1 1.488 -3.780 -2.509
4 H ALA 2 H ALA 2 3.247 -5.387 -2.775
5 HA ALA 2 HA ALA 2 4.241 -6.550 -0.332
6 HB1 ALA 2 1HB ALA 2 5.500 -6.440 -3.083
7 HB2 ALA 2 2HB ALA 2 4.539 -7.775 -2.442
8 HB3 ALA 2 3HB ALA 2 6.095 -7.380 -1.717
9 H MET 3 H MET 3 4.719 -4.908 1.005
10 HA MET 3 HA MET 3 6.368 -2.718 0.077
11 HB2 MET 3 1HB MET 3 4.468 -2.234 1.564
12 HB3 MET 3 2HB MET 3 5.186 -3.239 2.812
13 HG2 MET 3 1HG MET 3 5.568 -0.863 3.233
14 HG3 MET 3 2HG MET 3 7.083 -1.731 2.976
15 HE1 MET 3 3HE MET 3 8.463 0.473 2.519
16 HE2 MET 3 1HE MET 3 7.008 1.404 2.869
17 HE3 MET 3 2HE MET 3 7.936 1.739 1.407
18 H GLY 4 H GLY 4 8.452 -2.470 0.497
19 HA2 GLY 4 1HA GLY 4 9.943 -3.363 2.586
20 HA3 GLY 4 2HA GLY 4 9.989 -4.664 1.392
21 H MET 5 H MET 5 12.343 -3.844 1.584
22 HA MET 5 HA MET 5 12.677 -1.890 -0.573
23 HB2 MET 5 1HB MET 5 14.389 -2.157 1.899
24 HB3 MET 5 2HB MET 5 14.879 -1.252 0.479
25 HG2 MET 5 1HG MET 5 12.910 0.206 0.780
26 HG3 MET 5 2HG MET 5 12.512 -0.685 2.246
27 HE1 MET 5 3HE MET 5 13.822 2.767 3.574
28 HE2 MET 5 1HE MET 5 12.469 1.641 3.542
29 HE3 MET 5 2HE MET 5 12.933 2.501 2.075
30 HA PRO 6 HA PRO 6 14.827 -5.605 -2.066
31 HB2 PRO 6 1HB PRO 6 14.015 -4.702 -4.698
32 HB3 PRO 6 2HB PRO 6 13.527 -6.170 -3.859
33 HG2 PRO 6 1HG PRO 6 11.820 -4.103 -4.375
34 HG3 PRO 6 2HG PRO 6 11.628 -5.196 -2.993
35 HD2 PRO 6 1HD PRO 6 12.776 -2.434 -3.083
36 HD3 PRO 6 2HD PRO 6 11.713 -3.185 -1.868
37 H ASN 7 H ASN 7 14.836 -2.268 -3.022
38 HA ASN 7 HA ASN 7 17.643 -2.104 -3.330
39 HB2 ASN 7 1HB ASN 7 16.797 -3.038 -5.613
40 HB3 ASN 7 2HB ASN 7 15.915 -1.539 -5.787
41 HD21 ASN 7 2HD2 ASN 7 17.940 -2.650 -7.512
42 HD22 ASN 7 1HD2 ASN 7 19.214 -1.508 -7.616
43 H ARG 8 H ARG 8 17.855 0.336 -4.183
44 HA ARG 8 HA ARG 8 16.325 1.963 -2.399
45 HB2 ARG 8 1HB ARG 8 18.229 2.726 -4.634
46 HB3 ARG 8 2HB ARG 8 17.585 3.835 -3.434
47 HG2 ARG 8 1HG ARG 8 18.756 2.637 -1.678
48 HG3 ARG 8 2HG ARG 8 19.347 1.465 -2.852
49 HD2 ARG 8 1HD ARG 8 20.612 3.184 -3.997
50 HD3 ARG 8 2HD ARG 8 19.946 4.429 -2.940
51 HE ARG 8 HE ARG 8 21.233 2.418 -1.419
52 HH11 ARG 8 1HH1 ARG 8 22.041 5.198 -3.500
53 HH12 ARG 8 2HH1 ARG 8 23.492 5.534 -2.680
54 HH21 ARG 8 1HH2 ARG 8 23.205 2.899 -0.342
55 HH22 ARG 8 2HH2 ARG 8 24.181 4.204 -0.863
56 H LYS 9 H LYS 9 14.375 2.758 -2.847
57 HA LYS 9 HA LYS 9 13.096 2.546 -5.387
58 HB2 LYS 9 1HB LYS 9 12.032 2.788 -3.017
59 HB3 LYS 9 2HB LYS 9 12.339 4.495 -3.194
60 HG2 LYS 9 1HG LYS 9 10.517 2.874 -5.009
61 HG3 LYS 9 2HG LYS 9 9.976 3.790 -3.619
62 HD2 LYS 9 1HD LYS 9 9.475 5.265 -5.323
63 HD3 LYS 9 2HD LYS 9 11.107 5.798 -4.939
64 HE2 LYS 9 1HE LYS 9 11.966 4.436 -6.803
65 HE3 LYS 9 2HE LYS 9 10.325 3.919 -7.174
66 HZ1 LYS 9 3HZ LYS 9 11.328 6.752 -7.352
67 HZ2 LYS 9 1HZ LYS 9 9.749 6.220 -7.665
68 HZ3 LYS 9 2HZ LYS 9 11.016 5.720 -8.623
69 H TYR 10 H TYR 10 14.368 5.269 -3.531
70 HA TYR 10 HA TYR 10 14.216 6.919 -5.895
71 HB2 TYR 10 1HB TYR 10 15.193 7.664 -3.123
72 HB3 TYR 10 2HB TYR 10 14.778 8.772 -4.426
73 HD1 TYR 10 HD2 TYR 10 12.270 8.278 -5.340
74 HD2 TYR 10 HD1 TYR 10 13.646 7.526 -1.407
75 HE1 TYR 10 HE2 TYR 10 9.950 8.390 -4.511
76 HE2 TYR 10 HE1 TYR 10 11.314 7.632 -0.578
77 HH TYR 10 HH TYR 10 8.644 7.503 -2.559
78 H ALA 11 H ALA 11 15.800 6.192 -7.247
79 HA ALA 11 HA ALA 11 18.476 5.757 -6.239
80 HB1 ALA 11 1HB ALA 11 17.663 4.383 -8.115
81 HB2 ALA 11 2HB ALA 11 19.036 5.368 -8.623
82 HB3 ALA 11 3HB ALA 11 17.399 5.841 -9.073
83 H ASP 12 H ASP 12 20.244 7.118 -6.872
84 HA ASP 12 HA ASP 12 19.517 9.763 -6.435
85 HB2 ASP 12 1HB ASP 12 21.894 10.356 -6.590
86 HB3 ASP 12 2HB ASP 12 21.619 8.961 -5.565
87 H GLY 13 H GLY 13 19.177 11.431 -7.596
88 HA2 GLY 13 1HA GLY 13 19.529 12.694 -9.634
89 HA3 GLY 13 2HA GLY 13 19.451 11.168 -10.504
90 H GLU 14 H GLU 14 17.144 10.545 -8.345
91 HA GLU 14 HA GLU 14 15.089 11.297 -10.202
92 HB2 GLU 14 1HB GLU 14 15.140 9.064 -9.086
93 HB3 GLU 14 2HB GLU 14 14.939 9.854 -7.536
94 HG2 GLU 14 1HG GLU 14 12.698 10.515 -8.087
95 HG3 GLU 14 2HG GLU 14 12.914 10.032 -9.767
96 H VAL 15 H VAL 15 13.581 12.915 -9.911
97 HA VAL 15 HA VAL 15 14.097 14.630 -7.620
98 HB VAL 15 HB VAL 15 14.141 15.822 -9.734
99 HG11 VAL 15 1HG1 VAL 15 12.219 15.966 -11.237
100 HG12 VAL 15 2HG1 VAL 15 11.388 14.741 -10.263
101 HG13 VAL 15 3HG1 VAL 15 12.887 14.340 -11.108
102 HG21 VAL 15 3HG2 VAL 15 13.183 17.069 -7.885
103 HG22 VAL 15 1HG2 VAL 15 11.576 16.457 -8.280
104 HG23 VAL 15 2HG2 VAL 15 12.411 17.534 -9.402
105 H VAL 16 H VAL 16 12.727 14.816 -6.006
106 HA VAL 16 HA VAL 16 10.117 13.552 -6.195
107 HB VAL 16 HB VAL 16 10.534 12.477 -3.918
108 HG11 VAL 16 1HG1 VAL 16 12.171 11.494 -6.250
109 HG12 VAL 16 2HG1 VAL 16 10.456 11.180 -5.990
110 HG13 VAL 16 3HG1 VAL 16 11.652 10.520 -4.873
111 HG21 VAL 16 3HG2 VAL 16 12.870 11.998 -3.331
112 HG22 VAL 16 1HG2 VAL 16 12.546 13.732 -3.314
113 HG23 VAL 16 2HG2 VAL 16 13.414 13.005 -4.670
114 H MET 17 H MET 17 9.128 13.813 -3.775
115 HA MET 17 HA MET 17 9.515 16.640 -3.092
116 HB2 MET 17 1HB MET 17 7.098 14.841 -2.723
117 HB3 MET 17 2HB MET 17 7.222 16.469 -2.081
118 HG2 MET 17 1HG MET 17 7.335 15.756 -4.991
119 HG3 MET 17 2HG MET 17 5.876 16.303 -4.159
120 HE1 MET 17 3HE MET 17 5.609 18.741 -3.146
121 HE2 MET 17 1HE MET 17 6.846 19.997 -3.253
122 HE3 MET 17 2HE MET 17 7.116 18.591 -2.236
123 H GLY 18 H GLY 18 10.199 16.998 -1.072
124 HA2 GLY 18 1HA GLY 18 10.310 14.666 0.748
125 HA3 GLY 18 2HA GLY 18 11.658 15.701 0.497
126 H ARG 19 H ARG 19 9.871 15.146 2.829
127 HA ARG 19 HA ARG 19 8.708 17.741 3.355
128 HB2 ARG 19 1HB ARG 19 7.503 15.690 3.935
129 HB3 ARG 19 2HB ARG 19 8.825 15.208 4.979
130 HG2 ARG 19 1HG ARG 19 8.389 17.121 6.425
131 HG3 ARG 19 2HG ARG 19 7.074 17.626 5.360
132 HD2 ARG 19 1HD ARG 19 6.245 16.397 7.294
133 HD3 ARG 19 2HD ARG 19 5.909 15.542 5.787
134 HE ARG 19 HE ARG 19 8.296 14.837 7.308
135 HH11 ARG 19 1HH1 ARG 19 5.040 13.953 6.238
136 HH12 ARG 19 2HH1 ARG 19 5.194 12.316 6.635
137 HH21 ARG 19 1HH2 ARG 19 8.535 12.576 7.815
138 HH22 ARG 19 2HH2 ARG 19 7.220 11.509 7.557
139 H TRP 20 H TRP 20 9.566 19.181 4.689
140 HA TRP 20 HA TRP 20 12.300 18.929 5.393
141 HB2 TRP 20 1HB TRP 20 11.050 21.106 4.835
142 HB3 TRP 20 2HB TRP 20 10.388 21.029 6.462
143 HD1 TRP 20 HD1 TRP 20 12.170 21.364 8.504
144 HE1 TRP 20 HE1 TRP 20 14.447 22.552 8.574
145 HE3 TRP 20 HE3 TRP 20 13.061 21.676 3.494
146 HZ2 TRP 20 HZ2 TRP 20 16.373 23.521 6.719
147 HZ3 TRP 20 HZ3 TRP 20 15.130 22.740 2.722
148 HH2 TRP 20 HH2 TRP 20 16.744 23.637 4.268
149 HA PRO 21 HA PRO 21 11.657 16.328 8.918
150 HB2 PRO 21 1HB PRO 21 13.979 17.111 10.274
151 HB3 PRO 21 2HB PRO 21 13.839 15.787 9.116
152 HG2 PRO 21 1HG PRO 21 14.791 18.581 8.698
153 HG3 PRO 21 2HG PRO 21 15.359 17.071 7.956
154 HD2 PRO 21 1HD PRO 21 13.843 18.799 6.626
155 HD3 PRO 21 2HD PRO 21 13.626 17.047 6.409
156 H GLY 22 H GLY 22 10.135 16.812 10.264
157 HA2 GLY 22 1HA GLY 22 9.645 17.461 12.554
158 HA3 GLY 22 2HA GLY 22 10.621 18.904 12.283
159 H SER 23 H SER 23 9.492 19.286 9.645
160 HA SER 23 HA SER 23 7.122 20.740 10.488
161 HB2 SER 23 1HB SER 23 8.768 20.896 7.956
162 HB3 SER 23 2HB SER 23 7.560 22.063 8.493
163 HG SER 23 HG SER 23 9.286 22.980 9.272
164 H VAL 24 H VAL 24 5.440 20.865 8.565
165 HA VAL 24 HA VAL 24 5.072 18.137 7.547
166 HB VAL 24 HB VAL 24 3.252 19.093 8.991
167 HG11 VAL 24 1HG1 VAL 24 3.307 21.392 8.404
168 HG12 VAL 24 2HG1 VAL 24 1.700 20.757 8.054
169 HG13 VAL 24 3HG1 VAL 24 2.846 21.033 6.743
170 HG21 VAL 24 3HG2 VAL 24 1.351 18.441 7.539
171 HG22 VAL 24 1HG2 VAL 24 2.693 17.295 7.479
172 HG23 VAL 24 2HG2 VAL 24 2.449 18.439 6.160
173 H LEU 25 H LEU 25 6.304 20.949 6.657
174 HA LEU 25 HA LEU 25 5.129 21.408 4.122
175 HB2 LEU 25 1HB LEU 25 7.644 22.381 5.330
176 HB3 LEU 25 2HB LEU 25 7.103 22.824 3.724
177 HG LEU 25 HG LEU 25 5.998 23.613 6.378
178 HD11 LEU 25 1HD1 LEU 25 5.990 25.756 5.234
179 HD12 LEU 25 2HD1 LEU 25 6.470 24.841 3.781
180 HD13 LEU 25 3HD1 LEU 25 7.588 24.945 5.155
181 HD21 LEU 25 3HD2 LEU 25 3.981 24.451 5.262
182 HD22 LEU 25 1HD2 LEU 25 4.040 22.689 5.239
183 HD23 LEU 25 2HD2 LEU 25 4.444 23.611 3.787
184 H TYR 26 H TYR 26 5.581 20.793 2.262
185 HA TYR 26 HA TYR 26 7.777 18.895 1.859
186 HB2 TYR 26 1HB TYR 26 5.045 19.056 0.662
187 HB3 TYR 26 2HB TYR 26 6.350 18.389 -0.305
188 HD1 TYR 26 HD2 TYR 26 4.376 17.933 2.785
189 HD2 TYR 26 HD1 TYR 26 7.225 16.241 0.126
190 HE1 TYR 26 HE2 TYR 26 4.106 15.750 3.882
191 HE2 TYR 26 HE1 TYR 26 6.962 14.059 1.207
192 HH TYR 26 HH TYR 26 4.448 13.381 3.374
193 H TYR 27 H TYR 27 9.232 19.236 0.383
194 HA TYR 27 HA TYR 27 8.948 21.546 -1.383
195 HB2 TYR 27 1HB TYR 27 11.252 20.717 0.330
196 HB3 TYR 27 2HB TYR 27 11.479 21.796 -1.048
197 HD1 TYR 27 HD2 TYR 27 10.110 21.462 2.359
198 HD2 TYR 27 HD1 TYR 27 10.684 24.081 -0.942
199 HE1 TYR 27 HE2 TYR 27 9.548 23.383 3.789
200 HE2 TYR 27 HE1 TYR 27 10.129 25.999 0.471
201 HH TYR 27 HH TYR 27 9.018 26.507 2.422
202 H GLU 28 H GLU 28 10.291 21.358 -3.269
203 HA GLU 28 HA GLU 28 10.343 18.619 -4.208
204 HB2 GLU 28 1HB GLU 28 9.376 20.448 -5.605
205 HB3 GLU 28 2HB GLU 28 10.954 21.207 -5.664
206 HG2 GLU 28 1HG GLU 28 11.860 19.306 -6.869
207 HG3 GLU 28 2HG GLU 28 10.310 18.478 -6.760
208 H VAL 29 H VAL 29 12.150 17.463 -4.323
209 HA VAL 29 HA VAL 29 14.718 18.855 -4.019
210 HB VAL 29 HB VAL 29 15.470 17.177 -2.393
211 HG11 VAL 29 1HG1 VAL 29 14.172 17.890 -0.461
212 HG12 VAL 29 2HG1 VAL 29 12.927 18.519 -1.541
213 HG13 VAL 29 3HG1 VAL 29 14.539 19.237 -1.536
214 HG21 VAL 29 3HG2 VAL 29 12.626 16.158 -2.450
215 HG22 VAL 29 1HG2 VAL 29 13.875 15.653 -1.306
216 HG23 VAL 29 2HG2 VAL 29 14.059 15.303 -3.026
217 H GLN 30 H GLN 30 16.542 17.439 -4.628
218 HA GLN 30 HA GLN 30 15.596 15.222 -6.308
219 HB2 GLN 30 1HB GLN 30 16.454 17.196 -7.636
220 HB3 GLN 30 2HB GLN 30 18.021 16.945 -6.885
221 HG2 GLN 30 1HG GLN 30 18.194 14.744 -7.946
222 HG3 GLN 30 2HG GLN 30 16.585 14.937 -8.606
223 HE21 GLN 30 2HE2 GLN 30 17.380 14.673 -10.709
224 HE22 GLN 30 1HE2 GLN 30 18.191 15.960 -11.522
225 H VAL 31 H VAL 31 16.485 13.316 -5.910
226 HA VAL 31 HA VAL 31 17.988 13.101 -3.518
227 HB VAL 31 HB VAL 31 16.296 11.376 -4.113
228 HG11 VAL 31 1HG1 VAL 31 16.314 11.312 -6.320
229 HG12 VAL 31 2HG1 VAL 31 16.810 9.700 -5.775
230 HG13 VAL 31 3HG1 VAL 31 17.998 10.852 -6.400
231 HG21 VAL 31 3HG2 VAL 31 18.081 10.714 -2.571
232 HG22 VAL 31 1HG2 VAL 31 19.073 10.222 -3.943
233 HG23 VAL 31 2HG2 VAL 31 17.571 9.366 -3.594
234 H THR 32 H THR 32 20.021 12.703 -3.103
235 HA THR 32 HA THR 32 21.825 12.910 -5.391
236 HB THR 32 HB THR 32 22.110 14.146 -2.649
237 HG1 THR 32 HG1 THR 32 20.448 14.871 -4.380
238 HG21 THR 32 3HG2 THR 32 23.814 15.510 -3.732
239 HG22 THR 32 1HG2 THR 32 23.647 14.573 -5.211
240 HG23 THR 32 2HG2 THR 32 24.280 13.795 -3.744
241 H SER 33 H SER 33 21.386 11.517 -2.106
242 HA SER 33 HA SER 33 23.113 9.325 -2.779
243 HB2 SER 33 1HB SER 33 23.873 11.174 -0.471
244 HB3 SER 33 2HB SER 33 24.651 9.646 -0.864
245 HG SER 33 HG SER 33 24.597 11.115 -3.055
246 H TYR 34 H TYR 34 23.142 7.761 -0.738
247 HA TYR 34 HA TYR 34 20.920 8.164 1.063
248 HB2 TYR 34 1HB TYR 34 19.730 7.288 -0.822
249 HB3 TYR 34 2HB TYR 34 20.914 6.019 -1.058
250 HD1 TYR 34 HD1 TYR 34 18.680 7.193 1.723
251 HD2 TYR 34 HD2 TYR 34 20.171 3.934 -0.510
252 HE1 TYR 34 HE1 TYR 34 17.232 5.671 2.984
253 HE2 TYR 34 HE2 TYR 34 18.738 2.401 0.732
254 HH TYR 34 HH TYR 34 16.187 3.464 2.662
255 H ASP 35 H ASP 35 21.232 7.201 2.935
256 HA ASP 35 HA ASP 35 23.417 5.243 3.289
257 HB2 ASP 35 1HB ASP 35 23.281 7.208 4.858
258 HB3 ASP 35 2HB ASP 35 21.673 6.665 5.327
259 H ASP 36 H ASP 36 22.889 3.184 3.391
260 HA ASP 36 HA ASP 36 20.125 2.495 2.913
261 HB2 ASP 36 1HB ASP 36 22.560 0.691 3.029
262 HB3 ASP 36 2HB ASP 36 20.960 0.229 2.475
263 H ALA 37 H ALA 37 22.311 2.454 5.522
264 HA ALA 37 HA ALA 37 21.008 0.320 6.920
265 HB1 ALA 37 1HB ALA 37 23.406 0.722 7.177
266 HB2 ALA 37 2HB ALA 37 22.557 0.790 8.721
267 HB3 ALA 37 3HB ALA 37 23.058 2.282 7.922
268 H SER 38 H SER 38 21.228 3.860 7.413
269 HA SER 38 HA SER 38 19.166 3.570 9.445
270 HB2 SER 38 1HB SER 38 20.863 5.925 8.652
271 HB3 SER 38 2HB SER 38 19.700 5.922 9.987
272 HG SER 38 HG SER 38 22.073 5.412 10.289
273 H HIS 39 H HIS 39 19.169 3.947 6.226
274 HA HIS 39 HA HIS 39 17.578 4.426 4.664
275 HB2 HIS 39 1HB HIS 39 15.707 5.090 6.970
276 HB3 HIS 39 2HB HIS 39 15.239 4.777 5.311
277 HD1 HIS 39 HD1 HIS 39 15.478 3.186 8.525
278 HD2 HIS 39 HD2 HIS 39 15.857 1.955 4.576
279 HE1 HIS 39 HE1 HIS 39 15.131 0.693 8.527
280 H LEU 40 H LEU 40 19.378 6.365 5.170
281 HA LEU 40 HA LEU 40 17.800 8.870 5.322
282 HB2 LEU 40 1HB LEU 40 20.612 8.300 6.139
283 HB3 LEU 40 2HB LEU 40 20.251 9.893 5.529
284 HG LEU 40 HG LEU 40 20.253 9.913 7.929
285 HD11 LEU 40 1HD1 LEU 40 18.693 11.380 6.844
286 HD12 LEU 40 2HD1 LEU 40 18.076 10.824 8.395
287 HD13 LEU 40 3HD1 LEU 40 17.444 10.134 6.903
288 HD21 LEU 40 3HD2 LEU 40 19.747 7.603 8.394
289 HD22 LEU 40 1HD2 LEU 40 18.103 7.821 7.796
290 HD23 LEU 40 2HD2 LEU 40 18.632 8.663 9.254
291 H TYR 41 H TYR 41 17.383 9.852 3.467
292 HA TYR 41 HA TYR 41 19.168 9.355 1.217
293 HB2 TYR 41 1HB TYR 41 16.359 10.437 1.415
294 HB3 TYR 41 2HB TYR 41 17.325 10.646 -0.034
295 HD1 TYR 41 HD1 TYR 41 15.427 8.279 2.019
296 HD2 TYR 41 HD2 TYR 41 17.794 8.741 -1.481
297 HE1 TYR 41 HE1 TYR 41 14.631 6.099 1.167
298 HE2 TYR 41 HE2 TYR 41 17.003 6.561 -2.311
299 HH TYR 41 HH TYR 41 14.441 4.812 -0.659
300 H THR 42 H THR 42 20.513 10.883 0.662
301 HA THR 42 HA THR 42 20.228 13.508 1.896
302 HB THR 42 HB THR 42 22.407 12.401 0.103
303 HG1 THR 42 HG1 THR 42 21.825 11.966 2.706
304 HG21 THR 42 3HG2 THR 42 22.348 14.809 1.940
305 HG22 THR 42 1HG2 THR 42 22.329 14.854 0.179
306 HG23 THR 42 2HG2 THR 42 23.757 14.259 1.031
307 H VAL 43 H VAL 43 19.411 15.095 0.702
308 HA VAL 43 HA VAL 43 19.131 14.657 -2.185
309 HB VAL 43 HB VAL 43 16.925 15.751 -2.087
310 HG11 VAL 43 1HG1 VAL 43 15.620 13.994 -0.965
311 HG12 VAL 43 2HG1 VAL 43 17.093 13.410 -0.196
312 HG13 VAL 43 3HG1 VAL 43 16.917 13.316 -1.944
313 HG21 VAL 43 3HG2 VAL 43 17.272 15.733 0.917
314 HG22 VAL 43 1HG2 VAL 43 15.793 16.174 0.063
315 HG23 VAL 43 2HG2 VAL 43 17.243 17.162 -0.115
316 H LYS 44 H LYS 44 19.113 16.637 -3.368
317 HA LYS 44 HA LYS 44 20.301 18.842 -1.881
318 HB2 LYS 44 1HB LYS 44 21.497 17.907 -3.901
319 HB3 LYS 44 2HB LYS 44 20.151 18.471 -4.879
320 HG2 LYS 44 1HG LYS 44 20.613 20.782 -4.107
321 HG3 LYS 44 2HG LYS 44 22.026 20.174 -3.243
322 HD2 LYS 44 1HD LYS 44 22.945 19.348 -5.380
323 HD3 LYS 44 2HD LYS 44 21.550 20.038 -6.219
324 HE2 LYS 44 1HE LYS 44 23.353 21.584 -6.435
325 HE3 LYS 44 2HE LYS 44 22.197 22.269 -5.294
326 HZ1 LYS 44 3HZ LYS 44 23.740 21.269 -3.490
327 HZ2 LYS 44 1HZ LYS 44 24.351 22.581 -4.358
328 HZ3 LYS 44 2HZ LYS 44 24.812 21.031 -4.722
329 H TYR 45 H TYR 45 19.233 20.660 -1.631
330 HA TYR 45 HA TYR 45 16.556 20.944 -2.716
331 HB2 TYR 45 1HB TYR 45 18.124 22.295 -0.560
332 HB3 TYR 45 2HB TYR 45 16.734 23.103 -1.247
333 HD1 TYR 45 HD1 TYR 45 17.837 20.160 0.692
334 HD2 TYR 45 HD2 TYR 45 14.533 22.403 -0.757
335 HE1 TYR 45 HE1 TYR 45 16.322 18.916 2.185
336 HE2 TYR 45 HE2 TYR 45 13.038 21.193 0.702
337 HH TYR 45 HH TYR 45 14.124 19.231 3.240
338 H LYS 46 H LYS 46 15.933 22.911 -3.697
339 HA LYS 46 HA LYS 46 17.641 23.786 -5.735
340 HB2 LYS 46 1HB LYS 46 15.160 23.787 -5.818
341 HB3 LYS 46 2HB LYS 46 15.146 25.110 -4.661
342 HG2 LYS 46 1HG LYS 46 16.276 26.518 -6.192
343 HG3 LYS 46 2HG LYS 46 16.421 25.200 -7.364
344 HD2 LYS 46 1HD LYS 46 13.936 25.064 -7.423
345 HD3 LYS 46 2HD LYS 46 13.872 26.480 -6.372
346 HE2 LYS 46 1HE LYS 46 15.057 27.782 -8.070
347 HE3 LYS 46 2HE LYS 46 15.119 26.360 -9.107
348 HZ1 LYS 46 3HZ LYS 46 12.657 27.738 -8.198
349 HZ2 LYS 46 1HZ LYS 46 12.698 26.339 -9.119
350 HZ3 LYS 46 2HZ LYS 46 13.293 27.763 -9.762
351 H ASP 47 H ASP 47 17.123 24.783 -2.541
352 HA ASP 47 HA ASP 47 18.287 27.378 -2.508
353 HB2 ASP 47 1HB ASP 47 16.842 26.535 -0.727
354 HB3 ASP 47 2HB ASP 47 17.987 25.259 -0.364
355 H GLY 48 H GLY 48 19.736 24.452 -3.245
356 HA2 GLY 48 1HA GLY 48 21.982 24.193 -3.851
357 HA3 GLY 48 2HA GLY 48 22.390 25.593 -2.866
358 H THR 49 H THR 49 20.774 24.438 -0.706
359 HA THR 49 HA THR 49 22.849 23.113 0.728
360 HB THR 49 HB THR 49 19.956 23.671 1.384
361 HG1 THR 49 HG1 THR 49 20.674 25.643 1.441
362 HG21 THR 49 3HG2 THR 49 22.263 22.991 3.213
363 HG22 THR 49 1HG2 THR 49 20.901 21.935 2.846
364 HG23 THR 49 2HG2 THR 49 20.641 23.433 3.743
365 H GLU 50 H GLU 50 23.130 20.863 0.928
366 HA GLU 50 HA GLU 50 20.951 19.129 0.057
367 HB2 GLU 50 1HB GLU 50 23.705 18.392 1.107
368 HB3 GLU 50 2HB GLU 50 22.513 17.266 0.494
369 HG2 GLU 50 1HG GLU 50 24.201 17.544 -1.154
370 HG3 GLU 50 2HG GLU 50 22.751 18.352 -1.736
371 H LEU 51 H LEU 51 20.066 17.619 1.430
372 HA LEU 51 HA LEU 51 20.525 17.955 4.305
373 HB2 LEU 51 1HB LEU 51 18.612 19.390 3.541
374 HB3 LEU 51 2HB LEU 51 17.842 17.927 2.961
375 HG LEU 51 HG LEU 51 17.781 17.080 5.296
376 HD11 LEU 51 1HD1 LEU 51 18.703 19.862 5.970
377 HD12 LEU 51 2HD1 LEU 51 19.611 18.370 6.217
378 HD13 LEU 51 3HD1 LEU 51 18.121 18.659 7.125
379 HD21 LEU 51 3HD2 LEU 51 15.945 18.532 6.005
380 HD22 LEU 51 1HD2 LEU 51 15.841 18.126 4.292
381 HD23 LEU 51 2HD2 LEU 51 16.420 19.720 4.786
382 H ALA 52 H ALA 52 20.052 15.971 5.455
383 HA ALA 52 HA ALA 52 19.316 13.761 3.686
384 HB1 ALA 52 1HB ALA 52 20.317 12.283 5.374
385 HB2 ALA 52 2HB ALA 52 20.742 13.689 6.351
386 HB3 ALA 52 3HB ALA 52 21.490 13.449 4.768
387 H LEU 53 H LEU 53 17.538 12.707 4.065
388 HA LEU 53 HA LEU 53 16.165 12.926 6.587
389 HB2 LEU 53 1HB LEU 53 13.985 13.186 5.167
390 HB3 LEU 53 2HB LEU 53 14.911 14.584 5.663
391 HG LEU 53 HG LEU 53 15.880 14.745 3.395
392 HD11 LEU 53 1HD1 LEU 53 15.850 12.407 2.799
393 HD12 LEU 53 2HD1 LEU 53 15.063 13.465 1.604
394 HD13 LEU 53 3HD1 LEU 53 14.079 12.501 2.691
395 HD21 LEU 53 3HD2 LEU 53 13.798 15.261 2.202
396 HD22 LEU 53 1HD2 LEU 53 13.841 15.947 3.854
397 HD23 LEU 53 2HD2 LEU 53 12.952 14.452 3.524
398 H LYS 54 H LYS 54 14.247 11.395 6.599
399 HA LYS 54 HA LYS 54 15.316 8.888 5.615
400 HB2 LYS 54 1HB LYS 54 12.987 9.429 7.440
401 HB3 LYS 54 2HB LYS 54 13.438 7.824 6.884
402 HG2 LYS 54 1HG LYS 54 15.667 8.154 7.904
403 HG3 LYS 54 2HG LYS 54 15.083 9.683 8.576
404 HD2 LYS 54 1HD LYS 54 13.319 8.486 9.762
405 HD3 LYS 54 2HD LYS 54 13.874 6.971 9.055
406 HE2 LYS 54 1HE LYS 54 16.031 7.257 10.175
407 HE3 LYS 54 2HE LYS 54 15.436 8.740 10.918
408 HZ1 LYS 54 3HZ LYS 54 14.313 6.026 11.295
409 HZ2 LYS 54 1HZ LYS 54 13.687 7.436 11.975
410 HZ3 LYS 54 2HZ LYS 54 15.214 6.891 12.425
411 H GLU 55 H GLU 55 13.934 7.276 4.599
412 HA GLU 55 HA GLU 55 12.766 8.274 2.242
413 HB2 GLU 55 1HB GLU 55 13.602 5.849 2.697
414 HB3 GLU 55 2HB GLU 55 12.014 5.598 3.375
415 HG2 GLU 55 1HG GLU 55 10.916 6.202 1.315
416 HG3 GLU 55 2HG GLU 55 12.472 6.600 0.596
417 H SER 56 H SER 56 11.394 7.558 5.337
418 HA SER 56 HA SER 56 8.673 7.593 4.509
419 HB2 SER 56 1HB SER 56 9.846 7.906 7.269
420 HB3 SER 56 2HB SER 56 8.197 7.412 6.868
421 HG SER 56 HG SER 56 9.273 5.671 5.641
422 H ASP 57 H ASP 57 10.920 10.034 4.774
423 HA ASP 57 HA ASP 57 8.876 12.041 5.377
424 HB2 ASP 57 1HB ASP 57 11.905 12.273 5.291
425 HB3 ASP 57 2HB ASP 57 10.818 13.634 5.531
426 H ILE 58 H ILE 58 9.952 10.352 2.860
427 HA ILE 58 HA ILE 58 9.963 12.644 1.022
428 HB ILE 58 HB ILE 58 11.120 9.870 0.563
429 HG12 ILE 58 1HG1 ILE 58 12.474 12.503 1.064
430 HG13 ILE 58 2HG1 ILE 58 12.454 11.108 2.135
431 HG21 ILE 58 1HG2 ILE 58 11.263 12.354 -1.163
432 HG22 ILE 58 2HG2 ILE 58 10.307 10.910 -1.505
433 HG23 ILE 58 3HG2 ILE 58 12.068 10.818 -1.492
434 HD11 ILE 58 3HD1 ILE 58 14.524 11.410 0.914
435 HD12 ILE 58 1HD1 ILE 58 13.681 11.160 -0.606
436 HD13 ILE 58 2HD1 ILE 58 13.778 9.836 0.580
437 H ARG 59 H ARG 59 8.663 12.533 -0.702
438 HA ARG 59 HA ARG 59 7.011 10.114 -1.027
439 HB2 ARG 59 1HB ARG 59 5.742 12.050 0.068
440 HB3 ARG 59 2HB ARG 59 5.961 12.918 -1.442
441 HG2 ARG 59 1HG ARG 59 4.844 10.935 -2.572
442 HG3 ARG 59 2HG ARG 59 4.374 10.418 -0.953
443 HD2 ARG 59 1HD ARG 59 2.565 11.667 -1.869
444 HD3 ARG 59 2HD ARG 59 3.338 12.657 -0.629
445 HE ARG 59 HE ARG 59 4.299 13.075 -3.310
446 HH11 ARG 59 1HH1 ARG 59 2.022 14.129 -0.794
447 HH12 ARG 59 2HH1 ARG 59 1.740 15.650 -1.478
448 HH21 ARG 59 1HH2 ARG 59 3.822 15.234 -4.329
449 HH22 ARG 59 2HH2 ARG 59 2.785 16.282 -3.493
450 H LEU 60 H LEU 60 6.356 9.827 -3.299
451 HA LEU 60 HA LEU 60 8.148 10.847 -5.234
452 HB2 LEU 60 1HB LEU 60 5.459 9.494 -5.475
453 HB3 LEU 60 2HB LEU 60 6.381 9.996 -6.877
454 HG LEU 60 HG LEU 60 7.431 8.044 -4.818
455 HD11 LEU 60 1HD1 LEU 60 6.152 7.514 -7.500
456 HD12 LEU 60 2HD1 LEU 60 5.442 7.135 -5.931
457 HD13 LEU 60 3HD1 LEU 60 6.905 6.312 -6.454
458 HD21 LEU 60 3HD2 LEU 60 9.108 9.268 -6.167
459 HD22 LEU 60 1HD2 LEU 60 8.312 8.694 -7.625
460 HD23 LEU 60 2HD2 LEU 60 9.074 7.543 -6.527
461 H GLN 61 H GLN 61 7.139 12.030 -7.254
462 HA GLN 61 HA GLN 61 6.770 14.644 -6.456
463 HB2 GLN 61 1HB GLN 61 5.985 13.376 -9.072
464 HB3 GLN 61 2HB GLN 61 6.121 15.110 -8.804
465 HG2 GLN 61 1HG GLN 61 8.498 14.812 -8.258
466 HG3 GLN 61 2HG GLN 61 8.342 13.091 -8.595
467 HE21 GLN 61 2HE2 GLN 61 8.403 16.268 -9.943
468 HE22 GLN 61 1HE2 GLN 61 8.637 15.793 -11.580
469 H SER 62 H SER 62 4.314 12.269 -7.276
470 HA SER 62 HA SER 62 2.422 13.155 -5.487
471 HB2 SER 62 1HB SER 62 2.316 15.145 -7.132
472 HB3 SER 62 2HB SER 62 1.663 14.017 -8.312
473 HG SER 62 HG SER 62 -0.193 14.229 -7.407
474 H SER 63 H SER 63 2.722 12.010 -8.821
475 HA SER 63 HA SER 63 0.838 9.872 -8.317
476 HB2 SER 63 1HB SER 63 2.326 10.642 -10.830
477 HB3 SER 63 2HB SER 63 1.009 9.477 -10.714
478 HG SER 63 HG SER 63 0.563 12.053 -9.742
479 H PHE 64 H PHE 64 1.494 7.739 -9.375
480 HA PHE 64 HA PHE 64 4.276 7.081 -9.413
481 HB2 PHE 64 1HB PHE 64 3.993 5.122 -7.944
482 HB3 PHE 64 2HB PHE 64 3.572 6.568 -7.048
483 HD1 PHE 64 HD2 PHE 64 1.065 7.097 -6.778
484 HD2 PHE 64 HD1 PHE 64 2.531 3.328 -8.092
485 HE1 PHE 64 HE2 PHE 64 -1.070 6.053 -6.158
486 HE2 PHE 64 HE1 PHE 64 0.401 2.274 -7.470
487 HZ PHE 64 HZ PHE 64 -1.406 3.637 -6.501
488 H LYS 65 H LYS 65 4.424 4.948 -10.624
489 HA LYS 65 HA LYS 65 2.329 5.068 -12.565
490 HB2 LYS 65 1HB LYS 65 3.593 3.550 -13.934
491 HB3 LYS 65 2HB LYS 65 4.647 4.827 -13.357
492 HG2 LYS 65 1HG LYS 65 5.636 3.305 -11.737
493 HG3 LYS 65 2HG LYS 65 4.521 2.029 -12.230
494 HD2 LYS 65 1HD LYS 65 6.641 3.321 -13.955
495 HD3 LYS 65 2HD LYS 65 6.698 1.699 -13.265
496 HE2 LYS 65 1HE LYS 65 4.723 2.693 -15.349
497 HE3 LYS 65 2HE LYS 65 6.080 1.622 -15.623
498 HZ1 LYS 65 3HZ LYS 65 3.909 0.480 -15.436
499 HZ2 LYS 65 1HZ LYS 65 3.790 0.946 -13.848
500 HZ3 LYS 65 2HZ LYS 65 5.016 -0.092 -14.316
501 H GLN 66 H GLN 66 0.614 3.983 -12.565
502 HA GLN 66 HA GLN 66 0.343 1.673 -10.838
503 HB2 GLN 66 1HB GLN 66 -1.702 3.355 -12.321
504 HB3 GLN 66 2HB GLN 66 -2.095 1.979 -11.300
505 HG2 GLN 66 1HG GLN 66 -1.218 3.130 -9.355
506 HG3 GLN 66 2HG GLN 66 -0.711 4.481 -10.359
507 HE21 GLN 66 2HE2 GLN 66 -2.220 5.944 -11.040
508 HE22 GLN 66 1HE2 GLN 66 -3.837 5.991 -10.457